USER MOD reduce.3.24.130724 H: found=0, std=0, add=1160, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1160 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 145 SER OG : rot 122:sc= 0.596 USER MOD Set 1.2: A 148 THR OG1 : rot 160:sc= -1.19 USER MOD Set 2.1: A 94 HIS : no HE2:sc= 0.467 K(o=0.055,f=-5.7!) USER MOD Set 2.2: A 137 TYR OH : rot -25:sc= -0.412 USER MOD Set 3.1: A 87 THR OG1 : rot -35:sc= 1.14 USER MOD Set 3.2: A 124 THR OG1 : rot -40:sc= 1.95 USER MOD Set 4.1: A 70 GLN : amide:sc= -7.42! C(o=-8.8!,f=-12!) USER MOD Set 4.2: A 74 THR OG1 : rot -151:sc= -1.39! USER MOD Set 5.1: A 1 MET CE :methyl -149:sc= -0.449 (180deg=-1.79!) USER MOD Set 5.2: A 43 GLN : amide:sc= -2.53 K(o=-3,f=-5.4!) USER MOD Single : A 1 MET N :NH3+ -134:sc= 0.624 (180deg=-0.0203) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 TYR OH : rot 180:sc= -0.162 USER MOD Single : A 5 LYS NZ :NH3+ 138:sc= -0.0111 (180deg=-0.444) USER MOD Single : A 16 LYS NZ :NH3+ -150:sc= 0.156 (180deg=0.011) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 20 THR OG1 : rot 139:sc= 1.26 USER MOD Single : A 22 GLN : amide:sc= -1.97 K(o=-2,f=-6.5!) USER MOD Single : A 25 GLN : amide:sc= -1.74 K(o=-1.7,f=-2.3!) USER MOD Single : A 40 TYR OH : rot 180:sc= -2.39! USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 CYS SG : rot 3:sc= -0.879 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 MET CE :methyl -147:sc= -0.926 (180deg=-3.05!) USER MOD Single : A 80 CYS SG : rot 167:sc= -1.46 USER MOD Single : A 85 ASN : amide:sc= -1.99! C(o=-2!,f=-6.9!) USER MOD Single : A 86 ASN : amide:sc= -0.0272 K(o=-0.027,f=-0.77) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 SER OG : rot -54:sc= 1.25 USER MOD Single : A 95 GLN : amide:sc= -0.376 K(o=-0.38,f=-1.3!) USER MOD Single : A 96 TYR OH : rot -80:sc= -0.313 USER MOD Single : A 99 GLN : amide:sc= -0.174 X(o=-0.17,f=0.12) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 SER OG : rot 40:sc= 0.839 USER MOD Single : A 111 MET CE :methyl -157:sc= -1.07 (180deg=-2.03!) USER MOD Single : A 116 ASN : amide:sc= -5.51! C(o=-5.5!,f=-11!) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 CYS SG : rot -41:sc= -1.03 USER MOD Single : A 127 SER OG : rot 180:sc= 0.00218 USER MOD Single : A 129 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 131 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 141 TYR OH : rot 180:sc= 0 USER MOD Single : A 144 THR OG1 : rot 180:sc= 0 USER MOD Single : A 147 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 150 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 157 TYR OH : rot 180:sc= 0 USER MOD Single : A 158 THR OG1 : rot 90:sc= 1.15 USER MOD Single : A 165 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 166 HIS : no HD1:sc= -1.31 X(o=-1.3,f=-1.4) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -3.057 -2.490 22.797 1.00 63.42 N ATOM 2 CA MET A 1 -3.552 -1.684 21.651 1.00 74.04 C ATOM 3 C MET A 1 -3.785 -2.552 20.423 1.00 60.54 C ATOM 4 O MET A 1 -3.014 -3.468 20.138 1.00 21.12 O ATOM 5 CB MET A 1 -2.525 -0.592 21.341 1.00 32.22 C ATOM 6 CG MET A 1 -1.164 -1.131 20.931 1.00 35.11 C ATOM 7 SD MET A 1 -0.019 -1.254 22.318 1.00 43.42 S ATOM 8 CE MET A 1 0.004 0.443 22.889 1.00 75.41 C ATOM 0 H1 MET A 1 -3.583 -2.231 23.656 1.00 63.42 H new ATOM 0 H2 MET A 1 -3.197 -3.501 22.597 1.00 63.42 H new ATOM 0 H3 MET A 1 -2.044 -2.303 22.941 1.00 63.42 H new ATOM 0 HA MET A 1 -4.508 -1.235 21.919 1.00 74.04 H new ATOM 0 HB2 MET A 1 -2.911 0.041 20.542 1.00 32.22 H new ATOM 0 HB3 MET A 1 -2.405 0.042 22.220 1.00 32.22 H new ATOM 0 HG2 MET A 1 -1.288 -2.115 20.479 1.00 35.11 H new ATOM 0 HG3 MET A 1 -0.735 -0.482 20.168 1.00 35.11 H new ATOM 0 HE1 MET A 1 0.981 0.670 23.316 1.00 75.41 H new ATOM 0 HE2 MET A 1 -0.190 1.112 22.050 1.00 75.41 H new ATOM 0 HE3 MET A 1 -0.765 0.582 23.649 1.00 75.41 H new ATOM 18 N THR A 2 -4.857 -2.253 19.700 1.00 15.31 N ATOM 19 CA THR A 2 -5.206 -2.997 18.498 1.00 65.53 C ATOM 20 C THR A 2 -4.038 -3.005 17.511 1.00 14.41 C ATOM 21 O THR A 2 -3.297 -2.028 17.403 1.00 23.44 O ATOM 22 CB THR A 2 -6.460 -2.385 17.858 1.00 43.50 C ATOM 23 OG1 THR A 2 -7.616 -3.109 18.239 1.00 33.24 O ATOM 24 CG2 THR A 2 -6.426 -2.349 16.346 1.00 25.15 C ATOM 0 H THR A 2 -5.502 -1.496 19.927 1.00 15.31 H new ATOM 0 HA THR A 2 -5.419 -4.031 18.769 1.00 65.53 H new ATOM 0 HB THR A 2 -6.487 -1.358 18.221 1.00 43.50 H new ATOM 0 HG1 THR A 2 -8.407 -2.705 17.824 1.00 33.24 H new ATOM 0 HG21 THR A 2 -7.347 -1.903 15.972 1.00 25.15 H new ATOM 0 HG22 THR A 2 -5.574 -1.754 16.015 1.00 25.15 H new ATOM 0 HG23 THR A 2 -6.332 -3.364 15.960 1.00 25.15 H new ATOM 32 N GLU A 3 -3.883 -4.114 16.796 1.00 22.12 N ATOM 33 CA GLU A 3 -2.808 -4.248 15.820 1.00 73.41 C ATOM 34 C GLU A 3 -3.357 -4.226 14.399 1.00 22.02 C ATOM 35 O GLU A 3 -4.104 -5.117 13.997 1.00 21.53 O ATOM 36 CB GLU A 3 -2.029 -5.543 16.060 1.00 43.02 C ATOM 37 CG GLU A 3 -0.937 -5.412 17.109 1.00 12.43 C ATOM 38 CD GLU A 3 -0.801 -6.655 17.967 1.00 2.34 C ATOM 39 OE1 GLU A 3 -0.688 -7.760 17.397 1.00 15.24 O ATOM 40 OE2 GLU A 3 -0.808 -6.522 19.209 1.00 64.12 O ATOM 0 H GLU A 3 -4.487 -4.932 16.874 1.00 22.12 H new ATOM 0 HA GLU A 3 -2.134 -3.400 15.942 1.00 73.41 H new ATOM 0 HB2 GLU A 3 -2.725 -6.324 16.368 1.00 43.02 H new ATOM 0 HB3 GLU A 3 -1.581 -5.867 15.120 1.00 43.02 H new ATOM 0 HG2 GLU A 3 0.014 -5.210 16.615 1.00 12.43 H new ATOM 0 HG3 GLU A 3 -1.153 -4.556 17.748 1.00 12.43 H new ATOM 47 N TYR A 4 -2.982 -3.199 13.645 1.00 0.22 N ATOM 48 CA TYR A 4 -3.436 -3.055 12.269 1.00 20.42 C ATOM 49 C TYR A 4 -2.353 -3.496 11.291 1.00 61.00 C ATOM 50 O TYR A 4 -1.427 -2.742 10.992 1.00 30.04 O ATOM 51 CB TYR A 4 -3.831 -1.604 11.992 1.00 72.24 C ATOM 52 CG TYR A 4 -5.125 -1.194 12.656 1.00 60.32 C ATOM 53 CD1 TYR A 4 -6.317 -1.837 12.351 1.00 34.51 C ATOM 54 CD2 TYR A 4 -5.154 -0.163 13.587 1.00 24.32 C ATOM 55 CE1 TYR A 4 -7.503 -1.464 12.954 1.00 14.32 C ATOM 56 CE2 TYR A 4 -6.336 0.216 14.194 1.00 71.01 C ATOM 57 CZ TYR A 4 -7.508 -0.437 13.874 1.00 31.33 C ATOM 58 OH TYR A 4 -8.687 -0.062 14.476 1.00 74.12 O ATOM 0 H TYR A 4 -2.364 -2.453 13.965 1.00 0.22 H new ATOM 0 HA TYR A 4 -4.307 -3.695 12.130 1.00 20.42 H new ATOM 0 HB2 TYR A 4 -3.032 -0.947 12.335 1.00 72.24 H new ATOM 0 HB3 TYR A 4 -3.923 -1.460 10.915 1.00 72.24 H new ATOM 0 HD1 TYR A 4 -6.317 -2.642 11.631 1.00 34.51 H new ATOM 0 HD2 TYR A 4 -4.238 0.350 13.840 1.00 24.32 H new ATOM 0 HE1 TYR A 4 -8.422 -1.975 12.706 1.00 14.32 H new ATOM 0 HE2 TYR A 4 -6.342 1.020 14.915 1.00 71.01 H new ATOM 0 HH TYR A 4 -8.516 0.675 15.099 1.00 74.12 H new ATOM 68 N LYS A 5 -2.476 -4.722 10.797 1.00 14.55 N ATOM 69 CA LYS A 5 -1.509 -5.266 9.853 1.00 3.20 C ATOM 70 C LYS A 5 -1.873 -4.884 8.420 1.00 52.20 C ATOM 71 O LYS A 5 -2.722 -5.520 7.794 1.00 3.23 O ATOM 72 CB LYS A 5 -1.434 -6.787 9.992 1.00 53.24 C ATOM 73 CG LYS A 5 -0.018 -7.313 10.145 1.00 32.13 C ATOM 74 CD LYS A 5 0.522 -7.846 8.828 1.00 44.33 C ATOM 75 CE LYS A 5 1.333 -9.114 9.033 1.00 73.44 C ATOM 76 NZ LYS A 5 2.797 -8.857 8.945 1.00 21.43 N ATOM 0 H LYS A 5 -3.237 -5.358 11.035 1.00 14.55 H new ATOM 0 HA LYS A 5 -0.532 -4.841 10.082 1.00 3.20 H new ATOM 0 HB2 LYS A 5 -2.022 -7.094 10.857 1.00 53.24 H new ATOM 0 HB3 LYS A 5 -1.891 -7.247 9.116 1.00 53.24 H new ATOM 0 HG2 LYS A 5 0.630 -6.516 10.510 1.00 32.13 H new ATOM 0 HG3 LYS A 5 -0.002 -8.105 10.894 1.00 32.13 H new ATOM 0 HD2 LYS A 5 -0.306 -8.048 8.149 1.00 44.33 H new ATOM 0 HD3 LYS A 5 1.145 -7.087 8.355 1.00 44.33 H new ATOM 0 HE2 LYS A 5 1.097 -9.542 10.007 1.00 73.44 H new ATOM 0 HE3 LYS A 5 1.048 -9.852 8.283 1.00 73.44 H new ATOM 0 HZ1 LYS A 5 3.288 -9.387 9.693 1.00 21.43 H new ATOM 0 HZ2 LYS A 5 3.148 -9.164 8.016 1.00 21.43 H new ATOM 0 HZ3 LYS A 5 2.979 -7.840 9.065 1.00 21.43 H new ATOM 90 N LEU A 6 -1.228 -3.840 7.909 1.00 14.33 N ATOM 91 CA LEU A 6 -1.486 -3.369 6.553 1.00 34.02 C ATOM 92 C LEU A 6 -0.672 -4.156 5.530 1.00 53.24 C ATOM 93 O LEU A 6 0.538 -4.325 5.682 1.00 61.30 O ATOM 94 CB LEU A 6 -1.160 -1.879 6.441 1.00 54.11 C ATOM 95 CG LEU A 6 -1.606 -1.029 7.632 1.00 3.12 C ATOM 96 CD1 LEU A 6 -1.319 0.442 7.373 1.00 71.21 C ATOM 97 CD2 LEU A 6 -3.086 -1.248 7.920 1.00 31.51 C ATOM 0 H LEU A 6 -0.522 -3.304 8.414 1.00 14.33 H new ATOM 0 HA LEU A 6 -2.544 -3.524 6.340 1.00 34.02 H new ATOM 0 HB2 LEU A 6 -0.083 -1.766 6.316 1.00 54.11 H new ATOM 0 HB3 LEU A 6 -1.628 -1.487 5.538 1.00 54.11 H new ATOM 0 HG LEU A 6 -1.039 -1.338 8.510 1.00 3.12 H new ATOM 0 HD11 LEU A 6 -1.643 1.032 8.230 1.00 71.21 H new ATOM 0 HD12 LEU A 6 -0.249 0.582 7.219 1.00 71.21 H new ATOM 0 HD13 LEU A 6 -1.859 0.767 6.484 1.00 71.21 H new ATOM 0 HD21 LEU A 6 -3.386 -0.635 8.770 1.00 31.51 H new ATOM 0 HD22 LEU A 6 -3.672 -0.967 7.045 1.00 31.51 H new ATOM 0 HD23 LEU A 6 -3.260 -2.299 8.151 1.00 31.51 H new ATOM 109 N VAL A 7 -1.345 -4.633 4.487 1.00 33.24 N ATOM 110 CA VAL A 7 -0.690 -5.399 3.437 1.00 20.55 C ATOM 111 C VAL A 7 -0.487 -4.545 2.188 1.00 72.20 C ATOM 112 O VAL A 7 -1.421 -4.320 1.419 1.00 44.23 O ATOM 113 CB VAL A 7 -1.512 -6.652 3.073 1.00 41.24 C ATOM 114 CG1 VAL A 7 -0.916 -7.361 1.868 1.00 40.33 C ATOM 115 CG2 VAL A 7 -1.598 -7.595 4.262 1.00 61.41 C ATOM 0 H VAL A 7 -2.347 -4.501 4.348 1.00 33.24 H new ATOM 0 HA VAL A 7 0.282 -5.712 3.818 1.00 20.55 H new ATOM 0 HB VAL A 7 -2.521 -6.333 2.811 1.00 41.24 H new ATOM 0 HG11 VAL A 7 -1.514 -8.241 1.631 1.00 40.33 H new ATOM 0 HG12 VAL A 7 -0.912 -6.685 1.013 1.00 40.33 H new ATOM 0 HG13 VAL A 7 0.106 -7.666 2.094 1.00 40.33 H new ATOM 0 HG21 VAL A 7 -2.181 -8.474 3.988 1.00 61.41 H new ATOM 0 HG22 VAL A 7 -0.594 -7.903 4.556 1.00 61.41 H new ATOM 0 HG23 VAL A 7 -2.080 -7.085 5.096 1.00 61.41 H new ATOM 125 N VAL A 8 0.740 -4.074 1.994 1.00 13.52 N ATOM 126 CA VAL A 8 1.067 -3.248 0.841 1.00 5.34 C ATOM 127 C VAL A 8 1.414 -4.110 -0.368 1.00 31.55 C ATOM 128 O VAL A 8 2.110 -5.118 -0.247 1.00 31.52 O ATOM 129 CB VAL A 8 2.247 -2.308 1.150 1.00 62.20 C ATOM 130 CG1 VAL A 8 2.548 -1.415 -0.042 1.00 51.04 C ATOM 131 CG2 VAL A 8 1.953 -1.476 2.388 1.00 63.21 C ATOM 0 H VAL A 8 1.524 -4.251 2.622 1.00 13.52 H new ATOM 0 HA VAL A 8 0.185 -2.649 0.612 1.00 5.34 H new ATOM 0 HB VAL A 8 3.130 -2.916 1.348 1.00 62.20 H new ATOM 0 HG11 VAL A 8 3.385 -0.759 0.197 1.00 51.04 H new ATOM 0 HG12 VAL A 8 2.805 -2.032 -0.903 1.00 51.04 H new ATOM 0 HG13 VAL A 8 1.670 -0.813 -0.276 1.00 51.04 H new ATOM 0 HG21 VAL A 8 2.797 -0.817 2.592 1.00 63.21 H new ATOM 0 HG22 VAL A 8 1.058 -0.877 2.220 1.00 63.21 H new ATOM 0 HG23 VAL A 8 1.793 -2.136 3.241 1.00 63.21 H new ATOM 141 N VAL A 9 0.926 -3.703 -1.535 1.00 64.22 N ATOM 142 CA VAL A 9 1.186 -4.435 -2.768 1.00 31.21 C ATOM 143 C VAL A 9 1.616 -3.489 -3.883 1.00 63.44 C ATOM 144 O VAL A 9 1.231 -2.320 -3.902 1.00 24.15 O ATOM 145 CB VAL A 9 -0.054 -5.226 -3.227 1.00 10.34 C ATOM 146 CG1 VAL A 9 -0.457 -6.248 -2.175 1.00 10.00 C ATOM 147 CG2 VAL A 9 -1.208 -4.284 -3.533 1.00 21.42 C ATOM 0 H VAL A 9 0.349 -2.870 -1.652 1.00 64.22 H new ATOM 0 HA VAL A 9 1.993 -5.137 -2.557 1.00 31.21 H new ATOM 0 HB VAL A 9 0.200 -5.761 -4.142 1.00 10.34 H new ATOM 0 HG11 VAL A 9 -1.334 -6.796 -2.518 1.00 10.00 H new ATOM 0 HG12 VAL A 9 0.365 -6.945 -2.011 1.00 10.00 H new ATOM 0 HG13 VAL A 9 -0.691 -5.736 -1.241 1.00 10.00 H new ATOM 0 HG21 VAL A 9 -2.074 -4.862 -3.855 1.00 21.42 H new ATOM 0 HG22 VAL A 9 -1.463 -3.718 -2.637 1.00 21.42 H new ATOM 0 HG23 VAL A 9 -0.915 -3.596 -4.326 1.00 21.42 H new ATOM 157 N GLY A 10 2.418 -4.000 -4.810 1.00 14.21 N ATOM 158 CA GLY A 10 2.887 -3.184 -5.914 1.00 30.40 C ATOM 159 C GLY A 10 3.694 -3.977 -6.924 1.00 54.33 C ATOM 160 O GLY A 10 4.259 -5.021 -6.596 1.00 14.03 O ATOM 0 H GLY A 10 2.752 -4.964 -4.817 1.00 14.21 H new ATOM 0 HA2 GLY A 10 2.032 -2.730 -6.414 1.00 30.40 H new ATOM 0 HA3 GLY A 10 3.498 -2.370 -5.525 1.00 30.40 H new ATOM 164 N ALA A 11 3.745 -3.480 -8.155 1.00 33.23 N ATOM 165 CA ALA A 11 4.486 -4.146 -9.220 1.00 70.31 C ATOM 166 C ALA A 11 5.967 -4.281 -8.875 1.00 41.02 C ATOM 167 O ALA A 11 6.675 -5.101 -9.459 1.00 33.12 O ATOM 168 CB ALA A 11 4.316 -3.390 -10.529 1.00 61.50 C ATOM 0 H ALA A 11 3.282 -2.617 -8.440 1.00 33.23 H new ATOM 0 HA ALA A 11 4.079 -5.151 -9.331 1.00 70.31 H new ATOM 0 HB1 ALA A 11 4.874 -3.897 -11.317 1.00 61.50 H new ATOM 0 HB2 ALA A 11 3.260 -3.357 -10.796 1.00 61.50 H new ATOM 0 HB3 ALA A 11 4.693 -2.374 -10.414 1.00 61.50 H new ATOM 174 N GLY A 12 6.432 -3.471 -7.929 1.00 65.33 N ATOM 175 CA GLY A 12 7.828 -3.516 -7.533 1.00 1.43 C ATOM 176 C GLY A 12 8.495 -2.161 -7.643 1.00 53.20 C ATOM 177 O GLY A 12 8.819 -1.536 -6.632 1.00 41.12 O ATOM 0 H GLY A 12 5.867 -2.784 -7.430 1.00 65.33 H new ATOM 0 HA2 GLY A 12 7.902 -3.874 -6.506 1.00 1.43 H new ATOM 0 HA3 GLY A 12 8.359 -4.233 -8.159 1.00 1.43 H new ATOM 181 N GLY A 13 8.692 -1.700 -8.874 1.00 14.12 N ATOM 182 CA GLY A 13 9.313 -0.407 -9.090 1.00 1.43 C ATOM 183 C GLY A 13 8.367 0.746 -8.803 1.00 62.32 C ATOM 184 O GLY A 13 8.768 1.909 -8.834 1.00 23.25 O ATOM 0 H GLY A 13 8.433 -2.199 -9.725 1.00 14.12 H new ATOM 0 HA2 GLY A 13 10.193 -0.319 -8.452 1.00 1.43 H new ATOM 0 HA3 GLY A 13 9.659 -0.341 -10.122 1.00 1.43 H new ATOM 188 N VAL A 14 7.105 0.421 -8.524 1.00 13.14 N ATOM 189 CA VAL A 14 6.096 1.432 -8.231 1.00 41.31 C ATOM 190 C VAL A 14 6.538 2.347 -7.092 1.00 71.22 C ATOM 191 O VAL A 14 6.160 3.517 -7.042 1.00 53.12 O ATOM 192 CB VAL A 14 4.749 0.781 -7.861 1.00 4.30 C ATOM 193 CG1 VAL A 14 4.194 -0.005 -9.039 1.00 12.03 C ATOM 194 CG2 VAL A 14 4.906 -0.116 -6.643 1.00 1.14 C ATOM 0 H VAL A 14 6.759 -0.538 -8.495 1.00 13.14 H new ATOM 0 HA VAL A 14 5.972 2.027 -9.136 1.00 41.31 H new ATOM 0 HB VAL A 14 4.041 1.572 -7.614 1.00 4.30 H new ATOM 0 HG11 VAL A 14 3.243 -0.457 -8.759 1.00 12.03 H new ATOM 0 HG12 VAL A 14 4.042 0.666 -9.885 1.00 12.03 H new ATOM 0 HG13 VAL A 14 4.899 -0.787 -9.319 1.00 12.03 H new ATOM 0 HG21 VAL A 14 3.945 -0.567 -6.397 1.00 1.14 H new ATOM 0 HG22 VAL A 14 5.630 -0.901 -6.860 1.00 1.14 H new ATOM 0 HG23 VAL A 14 5.256 0.476 -5.798 1.00 1.14 H new ATOM 204 N GLY A 15 7.339 1.805 -6.180 1.00 61.40 N ATOM 205 CA GLY A 15 7.817 2.588 -5.055 1.00 25.12 C ATOM 206 C GLY A 15 6.969 2.398 -3.812 1.00 73.43 C ATOM 207 O GLY A 15 6.894 3.285 -2.962 1.00 40.14 O ATOM 0 H GLY A 15 7.665 0.839 -6.200 1.00 61.40 H new ATOM 0 HA2 GLY A 15 8.847 2.309 -4.834 1.00 25.12 H new ATOM 0 HA3 GLY A 15 7.824 3.643 -5.328 1.00 25.12 H new ATOM 211 N LYS A 16 6.328 1.238 -3.708 1.00 13.21 N ATOM 212 CA LYS A 16 5.478 0.931 -2.562 1.00 2.02 C ATOM 213 C LYS A 16 6.299 0.837 -1.278 1.00 4.41 C ATOM 214 O LYS A 16 5.769 1.000 -0.179 1.00 11.41 O ATOM 215 CB LYS A 16 4.733 -0.384 -2.797 1.00 40.44 C ATOM 216 CG LYS A 16 5.646 -1.600 -2.844 1.00 43.41 C ATOM 217 CD LYS A 16 4.931 -2.812 -3.418 1.00 52.32 C ATOM 218 CE LYS A 16 5.400 -4.102 -2.762 1.00 11.31 C ATOM 219 NZ LYS A 16 5.779 -5.131 -3.768 1.00 2.31 N ATOM 0 H LYS A 16 6.381 0.494 -4.404 1.00 13.21 H new ATOM 0 HA LYS A 16 4.757 1.741 -2.450 1.00 2.02 H new ATOM 0 HB2 LYS A 16 3.998 -0.522 -2.004 1.00 40.44 H new ATOM 0 HB3 LYS A 16 4.182 -0.317 -3.735 1.00 40.44 H new ATOM 0 HG2 LYS A 16 6.524 -1.374 -3.449 1.00 43.41 H new ATOM 0 HG3 LYS A 16 6.002 -1.828 -1.839 1.00 43.41 H new ATOM 0 HD2 LYS A 16 3.856 -2.701 -3.277 1.00 52.32 H new ATOM 0 HD3 LYS A 16 5.108 -2.864 -4.492 1.00 52.32 H new ATOM 0 HE2 LYS A 16 6.254 -3.892 -2.118 1.00 11.31 H new ATOM 0 HE3 LYS A 16 4.608 -4.493 -2.123 1.00 11.31 H new ATOM 0 HZ1 LYS A 16 5.602 -6.079 -3.379 1.00 2.31 H new ATOM 0 HZ2 LYS A 16 5.212 -4.999 -4.630 1.00 2.31 H new ATOM 0 HZ3 LYS A 16 6.788 -5.035 -4.000 1.00 2.31 H new ATOM 233 N SER A 17 7.591 0.566 -1.426 1.00 12.03 N ATOM 234 CA SER A 17 8.484 0.441 -0.280 1.00 1.31 C ATOM 235 C SER A 17 8.918 1.812 0.229 1.00 22.25 C ATOM 236 O SER A 17 8.955 2.052 1.436 1.00 22.05 O ATOM 237 CB SER A 17 9.712 -0.392 -0.653 1.00 40.34 C ATOM 238 OG SER A 17 9.359 -1.460 -1.517 1.00 11.02 O ATOM 0 H SER A 17 8.044 0.429 -2.330 1.00 12.03 H new ATOM 0 HA SER A 17 7.940 -0.064 0.518 1.00 1.31 H new ATOM 0 HB2 SER A 17 10.453 0.243 -1.138 1.00 40.34 H new ATOM 0 HB3 SER A 17 10.175 -0.788 0.251 1.00 40.34 H new ATOM 0 HG SER A 17 10.161 -1.977 -1.743 1.00 11.02 H new ATOM 244 N ALA A 18 9.246 2.708 -0.697 1.00 34.40 N ATOM 245 CA ALA A 18 9.678 4.056 -0.341 1.00 53.44 C ATOM 246 C ALA A 18 8.671 4.734 0.584 1.00 31.14 C ATOM 247 O ALA A 18 9.044 5.330 1.594 1.00 2.32 O ATOM 248 CB ALA A 18 9.888 4.890 -1.596 1.00 75.13 C ATOM 0 H ALA A 18 9.221 2.525 -1.700 1.00 34.40 H new ATOM 0 HA ALA A 18 10.624 3.976 0.194 1.00 53.44 H new ATOM 0 HB1 ALA A 18 10.210 5.893 -1.317 1.00 75.13 H new ATOM 0 HB2 ALA A 18 10.652 4.424 -2.219 1.00 75.13 H new ATOM 0 HB3 ALA A 18 8.953 4.951 -2.153 1.00 75.13 H new ATOM 254 N LEU A 19 7.394 4.638 0.230 1.00 23.23 N ATOM 255 CA LEU A 19 6.333 5.242 1.027 1.00 0.34 C ATOM 256 C LEU A 19 6.308 4.654 2.434 1.00 65.41 C ATOM 257 O LEU A 19 6.007 5.350 3.404 1.00 0.02 O ATOM 258 CB LEU A 19 4.977 5.033 0.350 1.00 14.20 C ATOM 259 CG LEU A 19 4.812 5.735 -0.998 1.00 63.32 C ATOM 260 CD1 LEU A 19 3.405 5.530 -1.537 1.00 32.40 C ATOM 261 CD2 LEU A 19 5.123 7.219 -0.865 1.00 1.34 C ATOM 0 H LEU A 19 7.069 4.148 -0.603 1.00 23.23 H new ATOM 0 HA LEU A 19 6.533 6.311 1.103 1.00 0.34 H new ATOM 0 HB2 LEU A 19 4.820 3.964 0.207 1.00 14.20 H new ATOM 0 HB3 LEU A 19 4.194 5.383 1.023 1.00 14.20 H new ATOM 0 HG LEU A 19 5.517 5.297 -1.705 1.00 63.32 H new ATOM 0 HD11 LEU A 19 3.306 6.037 -2.497 1.00 32.40 H new ATOM 0 HD12 LEU A 19 3.217 4.464 -1.668 1.00 32.40 H new ATOM 0 HD13 LEU A 19 2.682 5.942 -0.833 1.00 32.40 H new ATOM 0 HD21 LEU A 19 5.001 7.705 -1.833 1.00 1.34 H new ATOM 0 HD22 LEU A 19 4.441 7.670 -0.144 1.00 1.34 H new ATOM 0 HD23 LEU A 19 6.150 7.346 -0.522 1.00 1.34 H new ATOM 273 N THR A 20 6.626 3.368 2.538 1.00 45.02 N ATOM 274 CA THR A 20 6.640 2.685 3.827 1.00 22.54 C ATOM 275 C THR A 20 7.803 3.170 4.685 1.00 50.42 C ATOM 276 O THR A 20 7.620 3.539 5.845 1.00 11.41 O ATOM 277 CB THR A 20 6.736 1.172 3.624 1.00 54.42 C ATOM 278 OG1 THR A 20 5.669 0.707 2.816 1.00 2.43 O ATOM 279 CG2 THR A 20 6.705 0.391 4.919 1.00 72.51 C ATOM 0 H THR A 20 6.878 2.777 1.745 1.00 45.02 H new ATOM 0 HA THR A 20 5.709 2.916 4.344 1.00 22.54 H new ATOM 0 HB THR A 20 7.699 1.005 3.142 1.00 54.42 H new ATOM 0 HG1 THR A 20 6.006 0.043 2.179 1.00 2.43 H new ATOM 0 HG21 THR A 20 6.777 -0.675 4.703 1.00 72.51 H new ATOM 0 HG22 THR A 20 7.545 0.692 5.545 1.00 72.51 H new ATOM 0 HG23 THR A 20 5.771 0.593 5.443 1.00 72.51 H new ATOM 287 N ILE A 21 9.000 3.168 4.107 1.00 54.41 N ATOM 288 CA ILE A 21 10.193 3.610 4.819 1.00 52.22 C ATOM 289 C ILE A 21 10.066 5.069 5.246 1.00 23.00 C ATOM 290 O ILE A 21 10.423 5.431 6.367 1.00 52.42 O ATOM 291 CB ILE A 21 11.457 3.440 3.951 1.00 52.32 C ATOM 292 CG1 ILE A 21 11.625 1.977 3.539 1.00 53.20 C ATOM 293 CG2 ILE A 21 12.693 3.927 4.694 1.00 23.22 C ATOM 294 CD1 ILE A 21 11.653 1.016 4.708 1.00 62.21 C ATOM 0 H ILE A 21 9.169 2.865 3.148 1.00 54.41 H new ATOM 0 HA ILE A 21 10.288 2.985 5.707 1.00 52.22 H new ATOM 0 HB ILE A 21 11.339 4.046 3.052 1.00 52.32 H new ATOM 0 HG12 ILE A 21 10.809 1.700 2.872 1.00 53.20 H new ATOM 0 HG13 ILE A 21 12.550 1.872 2.971 1.00 53.20 H new ATOM 0 HG21 ILE A 21 13.572 3.797 4.062 1.00 23.22 H new ATOM 0 HG22 ILE A 21 12.577 4.982 4.942 1.00 23.22 H new ATOM 0 HG23 ILE A 21 12.817 3.351 5.611 1.00 23.22 H new ATOM 0 HD11 ILE A 21 11.775 -0.002 4.339 1.00 62.21 H new ATOM 0 HD12 ILE A 21 12.486 1.266 5.365 1.00 62.21 H new ATOM 0 HD13 ILE A 21 10.718 1.091 5.263 1.00 62.21 H new ATOM 306 N GLN A 22 9.553 5.903 4.346 1.00 61.04 N ATOM 307 CA GLN A 22 9.378 7.323 4.635 1.00 22.42 C ATOM 308 C GLN A 22 8.498 7.520 5.865 1.00 53.05 C ATOM 309 O GLN A 22 8.803 8.335 6.736 1.00 22.04 O ATOM 310 CB GLN A 22 8.761 8.038 3.431 1.00 43.32 C ATOM 311 CG GLN A 22 9.790 8.579 2.451 1.00 11.35 C ATOM 312 CD GLN A 22 10.421 9.874 2.925 1.00 13.01 C ATOM 313 OE1 GLN A 22 9.888 10.552 3.803 1.00 22.22 O ATOM 314 NE2 GLN A 22 11.562 10.224 2.343 1.00 34.53 N ATOM 0 H GLN A 22 9.252 5.621 3.413 1.00 61.04 H new ATOM 0 HA GLN A 22 10.359 7.752 4.838 1.00 22.42 H new ATOM 0 HB2 GLN A 22 8.101 7.346 2.907 1.00 43.32 H new ATOM 0 HB3 GLN A 22 8.142 8.862 3.786 1.00 43.32 H new ATOM 0 HG2 GLN A 22 10.570 7.833 2.300 1.00 11.35 H new ATOM 0 HG3 GLN A 22 9.314 8.743 1.484 1.00 11.35 H new ATOM 0 HE21 GLN A 22 11.968 9.631 1.619 1.00 34.53 H new ATOM 0 HE22 GLN A 22 12.032 11.086 2.620 1.00 34.53 H new ATOM 323 N LEU A 23 7.408 6.763 5.931 1.00 44.11 N ATOM 324 CA LEU A 23 6.485 6.847 7.056 1.00 12.33 C ATOM 325 C LEU A 23 7.121 6.271 8.316 1.00 43.54 C ATOM 326 O LEU A 23 7.262 6.960 9.326 1.00 33.54 O ATOM 327 CB LEU A 23 5.189 6.099 6.734 1.00 21.42 C ATOM 328 CG LEU A 23 4.245 5.891 7.920 1.00 52.33 C ATOM 329 CD1 LEU A 23 3.899 7.224 8.566 1.00 51.32 C ATOM 330 CD2 LEU A 23 2.985 5.166 7.475 1.00 22.13 C ATOM 0 H LEU A 23 7.142 6.084 5.218 1.00 44.11 H new ATOM 0 HA LEU A 23 6.253 7.897 7.233 1.00 12.33 H new ATOM 0 HB2 LEU A 23 4.655 6.647 5.957 1.00 21.42 H new ATOM 0 HB3 LEU A 23 5.445 5.124 6.318 1.00 21.42 H new ATOM 0 HG LEU A 23 4.752 5.274 8.662 1.00 52.33 H new ATOM 0 HD11 LEU A 23 3.227 7.057 9.408 1.00 51.32 H new ATOM 0 HD12 LEU A 23 4.811 7.704 8.920 1.00 51.32 H new ATOM 0 HD13 LEU A 23 3.411 7.867 7.834 1.00 51.32 H new ATOM 0 HD21 LEU A 23 2.324 5.026 8.331 1.00 22.13 H new ATOM 0 HD22 LEU A 23 2.474 5.757 6.715 1.00 22.13 H new ATOM 0 HD23 LEU A 23 3.252 4.194 7.060 1.00 22.13 H new ATOM 342 N ILE A 24 7.503 5.000 8.245 1.00 54.50 N ATOM 343 CA ILE A 24 8.127 4.321 9.375 1.00 10.11 C ATOM 344 C ILE A 24 9.360 5.082 9.855 1.00 64.04 C ATOM 345 O ILE A 24 9.432 5.498 11.011 1.00 13.24 O ATOM 346 CB ILE A 24 8.529 2.876 9.012 1.00 32.21 C ATOM 347 CG1 ILE A 24 7.307 2.083 8.538 1.00 24.12 C ATOM 348 CG2 ILE A 24 9.180 2.186 10.203 1.00 11.34 C ATOM 349 CD1 ILE A 24 6.318 1.779 9.642 1.00 44.43 C ATOM 0 H ILE A 24 7.391 4.418 7.415 1.00 54.50 H new ATOM 0 HA ILE A 24 7.389 4.289 10.176 1.00 10.11 H new ATOM 0 HB ILE A 24 9.254 2.916 8.199 1.00 32.21 H new ATOM 0 HG12 ILE A 24 6.801 2.645 7.753 1.00 24.12 H new ATOM 0 HG13 ILE A 24 7.642 1.146 8.093 1.00 24.12 H new ATOM 0 HG21 ILE A 24 9.456 1.168 9.927 1.00 11.34 H new ATOM 0 HG22 ILE A 24 10.073 2.737 10.499 1.00 11.34 H new ATOM 0 HG23 ILE A 24 8.478 2.158 11.036 1.00 11.34 H new ATOM 0 HD11 ILE A 24 5.479 1.216 9.234 1.00 44.43 H new ATOM 0 HD12 ILE A 24 6.808 1.190 10.417 1.00 44.43 H new ATOM 0 HD13 ILE A 24 5.954 2.712 10.071 1.00 44.43 H new ATOM 361 N GLN A 25 10.328 5.260 8.961 1.00 70.11 N ATOM 362 CA GLN A 25 11.554 5.971 9.299 1.00 62.24 C ATOM 363 C GLN A 25 11.410 7.467 9.012 1.00 33.02 C ATOM 364 O GLN A 25 10.977 8.229 9.876 1.00 72.43 O ATOM 365 CB GLN A 25 12.740 5.387 8.527 1.00 23.52 C ATOM 366 CG GLN A 25 13.424 4.235 9.244 1.00 72.24 C ATOM 367 CD GLN A 25 12.474 3.094 9.552 1.00 13.42 C ATOM 368 OE1 GLN A 25 12.314 2.698 10.707 1.00 53.53 O ATOM 369 NE2 GLN A 25 11.838 2.558 8.517 1.00 14.31 N ATOM 0 H GLN A 25 10.286 4.922 7.999 1.00 70.11 H new ATOM 0 HA GLN A 25 11.740 5.846 10.366 1.00 62.24 H new ATOM 0 HB2 GLN A 25 12.394 5.043 7.552 1.00 23.52 H new ATOM 0 HB3 GLN A 25 13.470 6.176 8.347 1.00 23.52 H new ATOM 0 HG2 GLN A 25 14.244 3.864 8.629 1.00 72.24 H new ATOM 0 HG3 GLN A 25 13.862 4.599 10.173 1.00 72.24 H new ATOM 0 HE21 GLN A 25 12.001 2.918 7.576 1.00 14.31 H new ATOM 0 HE22 GLN A 25 11.187 1.787 8.662 1.00 14.31 H new ATOM 588 N TYR A 40 7.452 -3.393 8.802 1.00 61.51 N ATOM 589 CA TYR A 40 7.700 -2.502 9.931 1.00 71.14 C ATOM 590 C TYR A 40 6.391 -2.127 10.619 1.00 74.30 C ATOM 591 O TYR A 40 5.409 -1.787 9.961 1.00 61.32 O ATOM 592 CB TYR A 40 8.424 -1.232 9.470 1.00 72.22 C ATOM 593 CG TYR A 40 9.277 -1.422 8.233 1.00 4.15 C ATOM 594 CD1 TYR A 40 8.713 -1.376 6.964 1.00 23.31 C ATOM 595 CD2 TYR A 40 10.644 -1.645 8.336 1.00 41.43 C ATOM 596 CE1 TYR A 40 9.488 -1.547 5.833 1.00 72.45 C ATOM 597 CE2 TYR A 40 11.425 -1.816 7.209 1.00 13.44 C ATOM 598 CZ TYR A 40 10.843 -1.767 5.961 1.00 24.42 C ATOM 599 OH TYR A 40 11.617 -1.938 4.836 1.00 14.24 O ATOM 0 HA TYR A 40 8.334 -3.031 10.642 1.00 71.14 H new ATOM 0 HB2 TYR A 40 7.684 -0.456 9.273 1.00 72.22 H new ATOM 0 HB3 TYR A 40 9.055 -0.871 10.282 1.00 72.22 H new ATOM 0 HD1 TYR A 40 7.652 -1.204 6.860 1.00 23.31 H new ATOM 0 HD2 TYR A 40 11.104 -1.685 9.312 1.00 41.43 H new ATOM 0 HE1 TYR A 40 9.035 -1.509 4.854 1.00 72.45 H new ATOM 0 HE2 TYR A 40 12.487 -1.987 7.306 1.00 13.44 H new ATOM 0 HH TYR A 40 12.550 -2.082 5.100 1.00 14.24 H new ATOM 609 N ARG A 41 6.385 -2.189 11.947 1.00 13.21 N ATOM 610 CA ARG A 41 5.194 -1.854 12.720 1.00 71.40 C ATOM 611 C ARG A 41 5.434 -0.618 13.580 1.00 11.40 C ATOM 612 O ARG A 41 6.359 -0.583 14.391 1.00 4.14 O ATOM 613 CB ARG A 41 4.783 -3.034 13.602 1.00 22.22 C ATOM 614 CG ARG A 41 5.833 -3.420 14.631 1.00 74.21 C ATOM 615 CD ARG A 41 5.877 -4.925 14.845 1.00 22.30 C ATOM 616 NE ARG A 41 7.035 -5.331 15.637 1.00 61.54 N ATOM 617 CZ ARG A 41 7.208 -6.559 16.121 1.00 64.22 C ATOM 618 NH1 ARG A 41 6.302 -7.503 15.897 1.00 41.12 N ATOM 619 NH2 ARG A 41 8.291 -6.844 16.832 1.00 25.03 N ATOM 0 H ARG A 41 7.189 -2.467 12.509 1.00 13.21 H new ATOM 0 HA ARG A 41 4.387 -1.636 12.021 1.00 71.40 H new ATOM 0 HB2 ARG A 41 3.855 -2.786 14.118 1.00 22.22 H new ATOM 0 HB3 ARG A 41 4.574 -3.895 12.968 1.00 22.22 H new ATOM 0 HG2 ARG A 41 6.812 -3.069 14.303 1.00 74.21 H new ATOM 0 HG3 ARG A 41 5.617 -2.923 15.577 1.00 74.21 H new ATOM 0 HD2 ARG A 41 4.964 -5.247 15.346 1.00 22.30 H new ATOM 0 HD3 ARG A 41 5.904 -5.428 13.878 1.00 22.30 H new ATOM 0 HE ARG A 41 7.753 -4.633 15.831 1.00 61.54 H new ATOM 0 HH11 ARG A 41 5.467 -7.289 15.351 1.00 41.12 H new ATOM 0 HH12 ARG A 41 6.441 -8.442 16.271 1.00 41.12 H new ATOM 0 HH21 ARG A 41 8.990 -6.123 17.007 1.00 25.03 H new ATOM 0 HH22 ARG A 41 8.424 -7.785 17.203 1.00 25.03 H new ATOM 633 N LYS A 42 4.593 0.395 13.396 1.00 22.43 N ATOM 634 CA LYS A 42 4.713 1.635 14.153 1.00 2.04 C ATOM 635 C LYS A 42 3.436 1.921 14.937 1.00 52.30 C ATOM 636 O LYS A 42 2.339 1.561 14.509 1.00 45.45 O ATOM 637 CB LYS A 42 5.020 2.802 13.214 1.00 2.10 C ATOM 638 CG LYS A 42 5.616 4.010 13.919 1.00 20.34 C ATOM 639 CD LYS A 42 5.893 5.143 12.944 1.00 41.41 C ATOM 640 CE LYS A 42 4.609 5.677 12.328 1.00 72.43 C ATOM 641 NZ LYS A 42 4.481 7.150 12.502 1.00 31.04 N ATOM 0 H LYS A 42 3.821 0.381 12.729 1.00 22.43 H new ATOM 0 HA LYS A 42 5.534 1.521 14.861 1.00 2.04 H new ATOM 0 HB2 LYS A 42 5.712 2.464 12.442 1.00 2.10 H new ATOM 0 HB3 LYS A 42 4.102 3.103 12.709 1.00 2.10 H new ATOM 0 HG2 LYS A 42 4.932 4.355 14.694 1.00 20.34 H new ATOM 0 HG3 LYS A 42 6.542 3.722 14.417 1.00 20.34 H new ATOM 0 HD2 LYS A 42 6.412 5.950 13.461 1.00 41.41 H new ATOM 0 HD3 LYS A 42 6.557 4.791 12.155 1.00 41.41 H new ATOM 0 HE2 LYS A 42 4.587 5.434 11.266 1.00 72.43 H new ATOM 0 HE3 LYS A 42 3.753 5.181 12.786 1.00 72.43 H new ATOM 0 HZ1 LYS A 42 3.593 7.475 12.069 1.00 31.04 H new ATOM 0 HZ2 LYS A 42 4.476 7.381 13.516 1.00 31.04 H new ATOM 0 HZ3 LYS A 42 5.284 7.625 12.043 1.00 31.04 H new ATOM 655 N GLN A 43 3.587 2.570 16.086 1.00 13.33 N ATOM 656 CA GLN A 43 2.449 2.906 16.932 1.00 22.43 C ATOM 657 C GLN A 43 2.060 4.371 16.761 1.00 2.22 C ATOM 658 O GLN A 43 2.893 5.265 16.908 1.00 11.31 O ATOM 659 CB GLN A 43 2.778 2.622 18.398 1.00 54.44 C ATOM 660 CG GLN A 43 1.562 2.643 19.309 1.00 44.32 C ATOM 661 CD GLN A 43 1.478 3.909 20.140 1.00 73.31 C ATOM 662 OE1 GLN A 43 1.615 5.017 19.620 1.00 63.32 O ATOM 663 NE2 GLN A 43 1.253 3.750 21.439 1.00 40.41 N ATOM 0 H GLN A 43 4.489 2.874 16.453 1.00 13.33 H new ATOM 0 HA GLN A 43 1.605 2.286 16.629 1.00 22.43 H new ATOM 0 HB2 GLN A 43 3.260 1.647 18.471 1.00 54.44 H new ATOM 0 HB3 GLN A 43 3.498 3.361 18.750 1.00 54.44 H new ATOM 0 HG2 GLN A 43 0.659 2.548 18.706 1.00 44.32 H new ATOM 0 HG3 GLN A 43 1.595 1.779 19.972 1.00 44.32 H new ATOM 0 HE21 GLN A 43 1.146 2.813 21.827 1.00 40.41 H new ATOM 0 HE22 GLN A 43 1.187 4.565 22.049 1.00 40.41 H new ATOM 672 N VAL A 44 0.791 4.611 16.449 1.00 14.24 N ATOM 673 CA VAL A 44 0.296 5.968 16.258 1.00 55.30 C ATOM 674 C VAL A 44 -1.069 6.157 16.911 1.00 64.04 C ATOM 675 O VAL A 44 -1.662 5.206 17.420 1.00 43.33 O ATOM 676 CB VAL A 44 0.191 6.322 14.762 1.00 42.14 C ATOM 677 CG1 VAL A 44 1.559 6.265 14.101 1.00 21.04 C ATOM 678 CG2 VAL A 44 -0.787 5.393 14.058 1.00 31.52 C ATOM 0 H VAL A 44 0.087 3.883 16.323 1.00 14.24 H new ATOM 0 HA VAL A 44 1.016 6.635 16.733 1.00 55.30 H new ATOM 0 HB VAL A 44 -0.186 7.341 14.677 1.00 42.14 H new ATOM 0 HG11 VAL A 44 1.464 6.518 13.045 1.00 21.04 H new ATOM 0 HG12 VAL A 44 2.227 6.977 14.586 1.00 21.04 H new ATOM 0 HG13 VAL A 44 1.968 5.259 14.198 1.00 21.04 H new ATOM 0 HG21 VAL A 44 -0.847 5.660 13.003 1.00 31.52 H new ATOM 0 HG22 VAL A 44 -0.443 4.363 14.153 1.00 31.52 H new ATOM 0 HG23 VAL A 44 -1.773 5.490 14.513 1.00 31.52 H new ATOM 688 N VAL A 45 -1.563 7.390 16.890 1.00 21.43 N ATOM 689 CA VAL A 45 -2.859 7.706 17.476 1.00 12.34 C ATOM 690 C VAL A 45 -3.845 8.158 16.405 1.00 43.21 C ATOM 691 O VAL A 45 -3.810 9.305 15.959 1.00 44.42 O ATOM 692 CB VAL A 45 -2.740 8.806 18.547 1.00 4.11 C ATOM 693 CG1 VAL A 45 -4.062 8.990 19.275 1.00 62.15 C ATOM 694 CG2 VAL A 45 -1.624 8.476 19.527 1.00 43.03 C ATOM 0 H VAL A 45 -1.084 8.188 16.472 1.00 21.43 H new ATOM 0 HA VAL A 45 -3.227 6.794 17.946 1.00 12.34 H new ATOM 0 HB VAL A 45 -2.493 9.745 18.052 1.00 4.11 H new ATOM 0 HG11 VAL A 45 -3.957 9.771 20.028 1.00 62.15 H new ATOM 0 HG12 VAL A 45 -4.834 9.275 18.561 1.00 62.15 H new ATOM 0 HG13 VAL A 45 -4.344 8.055 19.759 1.00 62.15 H new ATOM 0 HG21 VAL A 45 -1.554 9.264 20.277 1.00 43.03 H new ATOM 0 HG22 VAL A 45 -1.839 7.526 20.017 1.00 43.03 H new ATOM 0 HG23 VAL A 45 -0.678 8.401 18.990 1.00 43.03 H new ATOM 704 N ILE A 46 -4.723 7.248 15.995 1.00 13.41 N ATOM 705 CA ILE A 46 -5.718 7.550 14.973 1.00 23.02 C ATOM 706 C ILE A 46 -7.133 7.375 15.516 1.00 3.21 C ATOM 707 O ILE A 46 -7.450 6.359 16.135 1.00 53.52 O ATOM 708 CB ILE A 46 -5.533 6.653 13.733 1.00 44.54 C ATOM 709 CG1 ILE A 46 -4.087 6.725 13.238 1.00 52.02 C ATOM 710 CG2 ILE A 46 -6.497 7.062 12.629 1.00 4.41 C ATOM 711 CD1 ILE A 46 -3.816 5.857 12.029 1.00 24.41 C ATOM 0 H ILE A 46 -4.765 6.295 16.355 1.00 13.41 H new ATOM 0 HA ILE A 46 -5.574 8.591 14.682 1.00 23.02 H new ATOM 0 HB ILE A 46 -5.753 5.623 14.014 1.00 44.54 H new ATOM 0 HG12 ILE A 46 -3.847 7.760 12.993 1.00 52.02 H new ATOM 0 HG13 ILE A 46 -3.420 6.426 14.046 1.00 52.02 H new ATOM 0 HG21 ILE A 46 -6.352 6.418 11.762 1.00 4.41 H new ATOM 0 HG22 ILE A 46 -7.522 6.964 12.986 1.00 4.41 H new ATOM 0 HG23 ILE A 46 -6.309 8.098 12.347 1.00 4.41 H new ATOM 0 HD11 ILE A 46 -2.771 5.959 11.735 1.00 24.41 H new ATOM 0 HD12 ILE A 46 -4.024 4.816 12.275 1.00 24.41 H new ATOM 0 HD13 ILE A 46 -4.457 6.170 11.205 1.00 24.41 H new ATOM 723 N ASP A 47 -7.979 8.373 15.279 1.00 45.21 N ATOM 724 CA ASP A 47 -9.362 8.333 15.744 1.00 72.14 C ATOM 725 C ASP A 47 -9.425 8.346 17.268 1.00 10.14 C ATOM 726 O ASP A 47 -10.305 7.728 17.868 1.00 5.34 O ATOM 727 CB ASP A 47 -10.072 7.091 15.202 1.00 55.24 C ATOM 728 CG ASP A 47 -11.582 7.227 15.234 1.00 51.34 C ATOM 729 OD1 ASP A 47 -12.119 8.061 14.475 1.00 53.13 O ATOM 730 OD2 ASP A 47 -12.227 6.498 16.017 1.00 32.31 O ATOM 0 H ASP A 47 -7.731 9.220 14.767 1.00 45.21 H new ATOM 0 HA ASP A 47 -9.869 9.223 15.370 1.00 72.14 H new ATOM 0 HB2 ASP A 47 -9.748 6.909 14.177 1.00 55.24 H new ATOM 0 HB3 ASP A 47 -9.776 6.222 15.789 1.00 55.24 H new ATOM 735 N GLY A 48 -8.487 9.055 17.888 1.00 44.41 N ATOM 736 CA GLY A 48 -8.454 9.137 19.337 1.00 1.41 C ATOM 737 C GLY A 48 -8.328 7.776 19.993 1.00 11.23 C ATOM 738 O GLY A 48 -8.842 7.559 21.091 1.00 31.35 O ATOM 0 H GLY A 48 -7.749 9.574 17.413 1.00 44.41 H new ATOM 0 HA2 GLY A 48 -7.616 9.763 19.643 1.00 1.41 H new ATOM 0 HA3 GLY A 48 -9.362 9.625 19.691 1.00 1.41 H new ATOM 742 N GLU A 49 -7.644 6.858 19.320 1.00 14.23 N ATOM 743 CA GLU A 49 -7.454 5.510 19.843 1.00 43.24 C ATOM 744 C GLU A 49 -6.087 4.959 19.446 1.00 72.54 C ATOM 745 O GLU A 49 -5.848 4.646 18.280 1.00 21.12 O ATOM 746 CB GLU A 49 -8.560 4.584 19.334 1.00 44.04 C ATOM 747 CG GLU A 49 -8.438 3.153 19.835 1.00 22.34 C ATOM 748 CD GLU A 49 -9.696 2.667 20.529 1.00 3.34 C ATOM 749 OE1 GLU A 49 -10.755 2.611 19.870 1.00 64.24 O ATOM 750 OE2 GLU A 49 -9.621 2.341 21.733 1.00 14.33 O ATOM 0 H GLU A 49 -7.212 7.022 18.411 1.00 14.23 H new ATOM 0 HA GLU A 49 -7.502 5.558 20.931 1.00 43.24 H new ATOM 0 HB2 GLU A 49 -9.527 4.985 19.639 1.00 44.04 H new ATOM 0 HB3 GLU A 49 -8.546 4.580 18.244 1.00 44.04 H new ATOM 0 HG2 GLU A 49 -8.215 2.496 18.995 1.00 22.34 H new ATOM 0 HG3 GLU A 49 -7.597 3.084 20.525 1.00 22.34 H new ATOM 757 N THR A 50 -5.194 4.842 20.424 1.00 72.43 N ATOM 758 CA THR A 50 -3.851 4.328 20.176 1.00 63.22 C ATOM 759 C THR A 50 -3.907 2.912 19.612 1.00 32.24 C ATOM 760 O THR A 50 -4.494 2.015 20.216 1.00 21.40 O ATOM 761 CB THR A 50 -3.029 4.343 21.466 1.00 31.33 C ATOM 762 OG1 THR A 50 -2.965 5.652 22.005 1.00 15.42 O ATOM 763 CG2 THR A 50 -1.609 3.854 21.278 1.00 64.45 C ATOM 0 H THR A 50 -5.376 5.096 21.395 1.00 72.43 H new ATOM 0 HA THR A 50 -3.372 4.975 19.441 1.00 63.22 H new ATOM 0 HB THR A 50 -3.544 3.661 22.143 1.00 31.33 H new ATOM 0 HG1 THR A 50 -2.437 5.640 22.830 1.00 15.42 H new ATOM 0 HG21 THR A 50 -1.082 3.891 22.232 1.00 64.45 H new ATOM 0 HG22 THR A 50 -1.623 2.828 20.911 1.00 64.45 H new ATOM 0 HG23 THR A 50 -1.097 4.491 20.556 1.00 64.45 H new ATOM 771 N CYS A 51 -3.291 2.720 18.450 1.00 53.35 N ATOM 772 CA CYS A 51 -3.269 1.413 17.804 1.00 41.35 C ATOM 773 C CYS A 51 -1.971 1.211 17.030 1.00 12.52 C ATOM 774 O CYS A 51 -1.354 2.172 16.571 1.00 34.03 O ATOM 775 CB CYS A 51 -4.466 1.267 16.862 1.00 0.04 C ATOM 776 SG CYS A 51 -6.066 1.221 17.702 1.00 73.04 S ATOM 0 H CYS A 51 -2.801 3.453 17.937 1.00 53.35 H new ATOM 0 HA CYS A 51 -3.331 0.650 18.580 1.00 41.35 H new ATOM 0 HB2 CYS A 51 -4.462 2.097 16.156 1.00 0.04 H new ATOM 0 HB3 CYS A 51 -4.347 0.353 16.280 1.00 0.04 H new ATOM 0 HG CYS A 51 -5.890 1.377 18.980 1.00 73.04 H new ATOM 782 N LEU A 52 -1.562 -0.046 16.890 1.00 2.44 N ATOM 783 CA LEU A 52 -0.336 -0.375 16.173 1.00 32.13 C ATOM 784 C LEU A 52 -0.604 -0.516 14.677 1.00 33.44 C ATOM 785 O LEU A 52 -1.653 -1.013 14.268 1.00 30.32 O ATOM 786 CB LEU A 52 0.267 -1.671 16.722 1.00 30.50 C ATOM 787 CG LEU A 52 1.606 -1.508 17.443 1.00 44.33 C ATOM 788 CD1 LEU A 52 2.683 -1.051 16.472 1.00 25.25 C ATOM 789 CD2 LEU A 52 1.472 -0.524 18.596 1.00 74.43 C ATOM 0 H LEU A 52 -2.062 -0.853 17.264 1.00 2.44 H new ATOM 0 HA LEU A 52 0.374 0.438 16.321 1.00 32.13 H new ATOM 0 HB2 LEU A 52 -0.447 -2.122 17.411 1.00 30.50 H new ATOM 0 HB3 LEU A 52 0.399 -2.370 15.897 1.00 30.50 H new ATOM 0 HG LEU A 52 1.900 -2.476 17.849 1.00 44.33 H new ATOM 0 HD11 LEU A 52 3.628 -0.940 17.003 1.00 25.25 H new ATOM 0 HD12 LEU A 52 2.796 -1.791 15.680 1.00 25.25 H new ATOM 0 HD13 LEU A 52 2.398 -0.094 16.036 1.00 25.25 H new ATOM 0 HD21 LEU A 52 2.434 -0.419 19.099 1.00 74.43 H new ATOM 0 HD22 LEU A 52 1.156 0.446 18.212 1.00 74.43 H new ATOM 0 HD23 LEU A 52 0.730 -0.893 19.305 1.00 74.43 H new ATOM 801 N LEU A 53 0.354 -0.079 13.866 1.00 14.21 N ATOM 802 CA LEU A 53 0.223 -0.159 12.416 1.00 11.11 C ATOM 803 C LEU A 53 1.304 -1.058 11.824 1.00 22.13 C ATOM 804 O LEU A 53 2.309 -0.576 11.301 1.00 30.55 O ATOM 805 CB LEU A 53 0.307 1.237 11.795 1.00 10.30 C ATOM 806 CG LEU A 53 -0.809 2.196 12.209 1.00 12.23 C ATOM 807 CD1 LEU A 53 -0.679 3.518 11.469 1.00 10.35 C ATOM 808 CD2 LEU A 53 -2.171 1.570 11.951 1.00 53.13 C ATOM 0 H LEU A 53 1.229 0.334 14.188 1.00 14.21 H new ATOM 0 HA LEU A 53 -0.751 -0.590 12.187 1.00 11.11 H new ATOM 0 HB2 LEU A 53 1.265 1.681 12.064 1.00 10.30 H new ATOM 0 HB3 LEU A 53 0.296 1.137 10.710 1.00 10.30 H new ATOM 0 HG LEU A 53 -0.717 2.391 13.277 1.00 12.23 H new ATOM 0 HD11 LEU A 53 -1.482 4.188 11.777 1.00 10.35 H new ATOM 0 HD12 LEU A 53 0.283 3.973 11.704 1.00 10.35 H new ATOM 0 HD13 LEU A 53 -0.745 3.342 10.395 1.00 10.35 H new ATOM 0 HD21 LEU A 53 -2.954 2.266 12.251 1.00 53.13 H new ATOM 0 HD22 LEU A 53 -2.273 1.345 10.889 1.00 53.13 H new ATOM 0 HD23 LEU A 53 -2.263 0.649 12.527 1.00 53.13 H new ATOM 820 N ASP A 54 1.091 -2.366 11.913 1.00 41.50 N ATOM 821 CA ASP A 54 2.049 -3.333 11.388 1.00 21.01 C ATOM 822 C ASP A 54 2.073 -3.306 9.864 1.00 2.35 C ATOM 823 O ASP A 54 1.237 -3.926 9.208 1.00 14.21 O ATOM 824 CB ASP A 54 1.705 -4.741 11.878 1.00 74.00 C ATOM 825 CG ASP A 54 2.185 -4.994 13.293 1.00 72.15 C ATOM 826 OD1 ASP A 54 1.990 -4.109 14.154 1.00 22.12 O ATOM 827 OD2 ASP A 54 2.757 -6.076 13.542 1.00 72.44 O ATOM 0 H ASP A 54 0.265 -2.781 12.343 1.00 41.50 H new ATOM 0 HA ASP A 54 3.039 -3.059 11.753 1.00 21.01 H new ATOM 0 HB2 ASP A 54 0.626 -4.885 11.832 1.00 74.00 H new ATOM 0 HB3 ASP A 54 2.153 -5.475 11.209 1.00 74.00 H new ATOM 832 N ILE A 55 3.039 -2.585 9.304 1.00 22.41 N ATOM 833 CA ILE A 55 3.167 -2.484 7.856 1.00 11.41 C ATOM 834 C ILE A 55 3.833 -3.727 7.279 1.00 33.11 C ATOM 835 O ILE A 55 4.952 -4.078 7.652 1.00 21.02 O ATOM 836 CB ILE A 55 3.974 -1.236 7.446 1.00 65.35 C ATOM 837 CG1 ILE A 55 3.349 0.020 8.056 1.00 10.53 C ATOM 838 CG2 ILE A 55 4.037 -1.117 5.929 1.00 63.04 C ATOM 839 CD1 ILE A 55 1.888 0.195 7.704 1.00 21.22 C ATOM 0 H ILE A 55 3.742 -2.064 9.829 1.00 22.41 H new ATOM 0 HA ILE A 55 2.158 -2.397 7.452 1.00 11.41 H new ATOM 0 HB ILE A 55 4.991 -1.338 7.824 1.00 65.35 H new ATOM 0 HG12 ILE A 55 3.451 -0.022 9.140 1.00 10.53 H new ATOM 0 HG13 ILE A 55 3.904 0.895 7.717 1.00 10.53 H new ATOM 0 HG21 ILE A 55 4.610 -0.231 5.657 1.00 63.04 H new ATOM 0 HG22 ILE A 55 4.519 -2.002 5.514 1.00 63.04 H new ATOM 0 HG23 ILE A 55 3.027 -1.033 5.528 1.00 63.04 H new ATOM 0 HD11 ILE A 55 1.508 1.105 8.169 1.00 21.22 H new ATOM 0 HD12 ILE A 55 1.781 0.269 6.622 1.00 21.22 H new ATOM 0 HD13 ILE A 55 1.321 -0.662 8.067 1.00 21.22 H new ATOM 851 N LEU A 56 3.132 -4.390 6.366 1.00 72.42 N ATOM 852 CA LEU A 56 3.648 -5.596 5.733 1.00 33.33 C ATOM 853 C LEU A 56 3.883 -5.369 4.243 1.00 42.13 C ATOM 854 O LEU A 56 2.945 -5.389 3.447 1.00 11.42 O ATOM 855 CB LEU A 56 2.673 -6.759 5.942 1.00 3.51 C ATOM 856 CG LEU A 56 3.113 -8.100 5.349 1.00 63.54 C ATOM 857 CD1 LEU A 56 2.879 -8.120 3.847 1.00 12.31 C ATOM 858 CD2 LEU A 56 4.576 -8.375 5.668 1.00 43.21 C ATOM 0 H LEU A 56 2.204 -4.111 6.048 1.00 72.42 H new ATOM 0 HA LEU A 56 4.603 -5.844 6.196 1.00 33.33 H new ATOM 0 HB2 LEU A 56 2.514 -6.889 7.012 1.00 3.51 H new ATOM 0 HB3 LEU A 56 1.711 -6.487 5.507 1.00 3.51 H new ATOM 0 HG LEU A 56 2.512 -8.889 5.801 1.00 63.54 H new ATOM 0 HD11 LEU A 56 3.197 -9.081 3.442 1.00 12.31 H new ATOM 0 HD12 LEU A 56 1.819 -7.973 3.642 1.00 12.31 H new ATOM 0 HD13 LEU A 56 3.453 -7.321 3.379 1.00 12.31 H new ATOM 0 HD21 LEU A 56 4.868 -9.333 5.238 1.00 43.21 H new ATOM 0 HD22 LEU A 56 5.195 -7.583 5.246 1.00 43.21 H new ATOM 0 HD23 LEU A 56 4.713 -8.406 6.749 1.00 43.21 H new ATOM 870 N ASP A 57 5.142 -5.155 3.874 1.00 54.50 N ATOM 871 CA ASP A 57 5.503 -4.926 2.480 1.00 51.33 C ATOM 872 C ASP A 57 6.294 -6.106 1.925 1.00 53.44 C ATOM 873 O ASP A 57 7.451 -6.316 2.290 1.00 23.54 O ATOM 874 CB ASP A 57 6.320 -3.638 2.350 1.00 34.53 C ATOM 875 CG ASP A 57 5.741 -2.686 1.321 1.00 42.32 C ATOM 876 OD1 ASP A 57 5.207 -3.168 0.300 1.00 34.14 O ATOM 877 OD2 ASP A 57 5.821 -1.459 1.537 1.00 14.05 O ATOM 0 H ASP A 57 5.930 -5.135 4.522 1.00 54.50 H new ATOM 0 HA ASP A 57 4.585 -4.824 1.901 1.00 51.33 H new ATOM 0 HB2 ASP A 57 6.363 -3.139 3.318 1.00 34.53 H new ATOM 0 HB3 ASP A 57 7.345 -3.887 2.074 1.00 34.53 H new ATOM 882 N THR A 58 5.663 -6.873 1.043 1.00 70.13 N ATOM 883 CA THR A 58 6.309 -8.033 0.441 1.00 65.11 C ATOM 884 C THR A 58 7.320 -7.603 -0.617 1.00 70.11 C ATOM 885 O THR A 58 7.394 -6.428 -0.977 1.00 53.30 O ATOM 886 CB THR A 58 5.264 -8.957 -0.184 1.00 74.04 C ATOM 887 OG1 THR A 58 4.803 -8.431 -1.416 1.00 22.45 O ATOM 888 CG2 THR A 58 4.057 -9.179 0.700 1.00 12.43 C ATOM 0 H THR A 58 4.706 -6.713 0.729 1.00 70.13 H new ATOM 0 HA THR A 58 6.838 -8.572 1.227 1.00 65.11 H new ATOM 0 HB THR A 58 5.770 -9.912 -0.326 1.00 74.04 H new ATOM 0 HG1 THR A 58 4.136 -9.037 -1.801 1.00 22.45 H new ATOM 0 HG21 THR A 58 3.355 -9.844 0.197 1.00 12.43 H new ATOM 0 HG22 THR A 58 4.373 -9.630 1.641 1.00 12.43 H new ATOM 0 HG23 THR A 58 3.572 -8.224 0.900 1.00 12.43 H new ATOM 896 N ALA A 59 8.096 -8.561 -1.110 1.00 11.12 N ATOM 897 CA ALA A 59 9.102 -8.281 -2.126 1.00 75.33 C ATOM 898 C ALA A 59 8.463 -7.739 -3.399 1.00 1.34 C ATOM 899 O ALA A 59 7.288 -7.988 -3.672 1.00 23.01 O ATOM 900 CB ALA A 59 9.904 -9.536 -2.434 1.00 52.44 C ATOM 0 H ALA A 59 8.047 -9.538 -0.822 1.00 11.12 H new ATOM 0 HA ALA A 59 9.774 -7.518 -1.733 1.00 75.33 H new ATOM 0 HB1 ALA A 59 10.652 -9.312 -3.195 1.00 52.44 H new ATOM 0 HB2 ALA A 59 10.401 -9.882 -1.528 1.00 52.44 H new ATOM 0 HB3 ALA A 59 9.235 -10.314 -2.801 1.00 52.44 H new ATOM 1002 N MET A 67 3.693 -17.886 -0.430 1.00 40.23 N ATOM 1003 CA MET A 67 3.522 -17.158 0.820 1.00 1.40 C ATOM 1004 C MET A 67 2.736 -15.869 0.595 1.00 44.12 C ATOM 1005 O MET A 67 2.135 -15.328 1.523 1.00 31.11 O ATOM 1006 CB MET A 67 4.881 -16.852 1.442 1.00 51.33 C ATOM 1007 CG MET A 67 5.439 -18.010 2.250 1.00 73.13 C ATOM 1008 SD MET A 67 7.231 -18.138 2.140 1.00 51.34 S ATOM 1009 CE MET A 67 7.719 -16.708 3.097 1.00 1.11 C ATOM 0 HA MET A 67 2.955 -17.785 1.508 1.00 1.40 H new ATOM 0 HB2 MET A 67 5.586 -16.595 0.652 1.00 51.33 H new ATOM 0 HB3 MET A 67 4.791 -15.977 2.086 1.00 51.33 H new ATOM 0 HG2 MET A 67 5.151 -17.890 3.295 1.00 73.13 H new ATOM 0 HG3 MET A 67 4.991 -18.940 1.901 1.00 73.13 H new ATOM 0 HE1 MET A 67 8.807 -16.644 3.126 1.00 1.11 H new ATOM 0 HE2 MET A 67 7.314 -15.807 2.637 1.00 1.11 H new ATOM 0 HE3 MET A 67 7.334 -16.801 4.112 1.00 1.11 H new ATOM 1019 N ARG A 68 2.739 -15.385 -0.646 1.00 12.04 N ATOM 1020 CA ARG A 68 2.020 -14.164 -0.996 1.00 35.33 C ATOM 1021 C ARG A 68 0.562 -14.240 -0.547 1.00 22.34 C ATOM 1022 O ARG A 68 -0.080 -13.216 -0.314 1.00 64.12 O ATOM 1023 CB ARG A 68 2.088 -13.929 -2.507 1.00 42.22 C ATOM 1024 CG ARG A 68 1.665 -12.533 -2.930 1.00 71.44 C ATOM 1025 CD ARG A 68 1.885 -12.313 -4.419 1.00 0.40 C ATOM 1026 NE ARG A 68 1.187 -13.309 -5.229 1.00 24.44 N ATOM 1027 CZ ARG A 68 1.213 -13.333 -6.560 1.00 71.11 C ATOM 1028 NH1 ARG A 68 1.899 -12.419 -7.235 1.00 4.05 N ATOM 1029 NH2 ARG A 68 0.552 -14.276 -7.218 1.00 21.12 N ATOM 0 H ARG A 68 3.232 -15.821 -1.425 1.00 12.04 H new ATOM 0 HA ARG A 68 2.495 -13.330 -0.480 1.00 35.33 H new ATOM 0 HB2 ARG A 68 3.108 -14.108 -2.848 1.00 42.22 H new ATOM 0 HB3 ARG A 68 1.452 -14.659 -3.008 1.00 42.22 H new ATOM 0 HG2 ARG A 68 0.613 -12.382 -2.690 1.00 71.44 H new ATOM 0 HG3 ARG A 68 2.230 -11.793 -2.364 1.00 71.44 H new ATOM 0 HD2 ARG A 68 1.539 -11.316 -4.693 1.00 0.40 H new ATOM 0 HD3 ARG A 68 2.952 -12.352 -4.637 1.00 0.40 H new ATOM 0 HE ARG A 68 0.648 -14.028 -4.746 1.00 24.44 H new ATOM 0 HH11 ARG A 68 2.410 -11.692 -6.734 1.00 4.05 H new ATOM 0 HH12 ARG A 68 1.915 -12.443 -8.255 1.00 4.05 H new ATOM 0 HH21 ARG A 68 0.024 -14.982 -6.704 1.00 21.12 H new ATOM 0 HH22 ARG A 68 0.571 -14.295 -8.238 1.00 21.12 H new ATOM 1043 N ASP A 69 0.045 -15.461 -0.431 1.00 32.32 N ATOM 1044 CA ASP A 69 -1.337 -15.671 -0.012 1.00 73.52 C ATOM 1045 C ASP A 69 -1.479 -15.536 1.501 1.00 60.52 C ATOM 1046 O ASP A 69 -2.484 -15.024 1.995 1.00 22.34 O ATOM 1047 CB ASP A 69 -1.825 -17.050 -0.463 1.00 2.52 C ATOM 1048 CG ASP A 69 -3.144 -16.980 -1.207 1.00 61.01 C ATOM 1049 OD1 ASP A 69 -3.245 -16.183 -2.164 1.00 1.13 O ATOM 1050 OD2 ASP A 69 -4.077 -17.721 -0.833 1.00 4.42 O ATOM 0 H ASP A 69 0.563 -16.319 -0.621 1.00 32.32 H new ATOM 0 HA ASP A 69 -1.951 -14.904 -0.483 1.00 73.52 H new ATOM 0 HB2 ASP A 69 -1.072 -17.507 -1.105 1.00 2.52 H new ATOM 0 HB3 ASP A 69 -1.936 -17.696 0.408 1.00 2.52 H new ATOM 1055 N GLN A 70 -0.472 -16.001 2.236 1.00 13.41 N ATOM 1056 CA GLN A 70 -0.500 -15.929 3.693 1.00 24.12 C ATOM 1057 C GLN A 70 -0.677 -14.487 4.160 1.00 73.41 C ATOM 1058 O GLN A 70 -1.434 -14.213 5.089 1.00 51.22 O ATOM 1059 CB GLN A 70 0.779 -16.552 4.289 1.00 12.34 C ATOM 1060 CG GLN A 70 1.842 -15.549 4.736 1.00 60.21 C ATOM 1061 CD GLN A 70 1.618 -15.036 6.136 1.00 75.25 C ATOM 1062 OE1 GLN A 70 1.616 -13.827 6.364 1.00 31.21 O ATOM 1063 NE2 GLN A 70 1.441 -15.954 7.083 1.00 35.53 N ATOM 0 H GLN A 70 0.369 -16.429 1.849 1.00 13.41 H new ATOM 0 HA GLN A 70 -1.355 -16.503 4.050 1.00 24.12 H new ATOM 0 HB2 GLN A 70 0.500 -17.167 5.144 1.00 12.34 H new ATOM 0 HB3 GLN A 70 1.220 -17.218 3.547 1.00 12.34 H new ATOM 0 HG2 GLN A 70 2.824 -16.020 4.680 1.00 60.21 H new ATOM 0 HG3 GLN A 70 1.853 -14.707 4.044 1.00 60.21 H new ATOM 0 HE21 GLN A 70 1.451 -16.945 6.841 1.00 35.53 H new ATOM 0 HE22 GLN A 70 1.295 -15.667 8.051 1.00 35.53 H new ATOM 1072 N TYR A 71 0.027 -13.572 3.503 1.00 51.25 N ATOM 1073 CA TYR A 71 -0.040 -12.156 3.845 1.00 65.20 C ATOM 1074 C TYR A 71 -1.478 -11.653 3.873 1.00 4.03 C ATOM 1075 O TYR A 71 -1.905 -11.028 4.843 1.00 61.25 O ATOM 1076 CB TYR A 71 0.789 -11.343 2.856 1.00 34.14 C ATOM 1077 CG TYR A 71 2.274 -11.518 3.056 1.00 74.15 C ATOM 1078 CD1 TYR A 71 2.832 -11.457 4.329 1.00 33.30 C ATOM 1079 CD2 TYR A 71 3.117 -11.750 1.981 1.00 43.32 C ATOM 1080 CE1 TYR A 71 4.188 -11.619 4.522 1.00 43.25 C ATOM 1081 CE2 TYR A 71 4.475 -11.912 2.166 1.00 71.51 C ATOM 1082 CZ TYR A 71 5.006 -11.846 3.437 1.00 62.44 C ATOM 1083 OH TYR A 71 6.359 -12.000 3.622 1.00 11.43 O ATOM 0 H TYR A 71 0.653 -13.787 2.727 1.00 51.25 H new ATOM 0 HA TYR A 71 0.371 -12.031 4.847 1.00 65.20 H new ATOM 0 HB2 TYR A 71 0.527 -11.638 1.840 1.00 34.14 H new ATOM 0 HB3 TYR A 71 0.535 -10.288 2.957 1.00 34.14 H new ATOM 0 HD1 TYR A 71 2.192 -11.280 5.181 1.00 33.30 H new ATOM 0 HD2 TYR A 71 2.705 -11.805 0.984 1.00 43.32 H new ATOM 0 HE1 TYR A 71 4.606 -11.568 5.517 1.00 43.25 H new ATOM 0 HE2 TYR A 71 5.120 -12.090 1.318 1.00 71.51 H new ATOM 0 HH TYR A 71 6.792 -12.154 2.756 1.00 11.43 H new ATOM 1093 N MET A 72 -2.225 -11.929 2.810 1.00 10.34 N ATOM 1094 CA MET A 72 -3.617 -11.501 2.733 1.00 53.10 C ATOM 1095 C MET A 72 -4.401 -12.025 3.931 1.00 41.15 C ATOM 1096 O MET A 72 -5.304 -11.359 4.438 1.00 50.11 O ATOM 1097 CB MET A 72 -4.256 -11.993 1.431 1.00 53.14 C ATOM 1098 CG MET A 72 -3.355 -11.851 0.214 1.00 72.51 C ATOM 1099 SD MET A 72 -4.255 -11.344 -1.264 1.00 44.55 S ATOM 1100 CE MET A 72 -2.928 -10.653 -2.248 1.00 41.44 C ATOM 0 H MET A 72 -1.893 -12.444 1.994 1.00 10.34 H new ATOM 0 HA MET A 72 -3.643 -10.411 2.746 1.00 53.10 H new ATOM 0 HB2 MET A 72 -4.533 -13.041 1.546 1.00 53.14 H new ATOM 0 HB3 MET A 72 -5.177 -11.437 1.256 1.00 53.14 H new ATOM 0 HG2 MET A 72 -2.575 -11.120 0.428 1.00 72.51 H new ATOM 0 HG3 MET A 72 -2.857 -12.802 0.023 1.00 72.51 H new ATOM 0 HE1 MET A 72 -3.311 -9.827 -2.847 1.00 41.44 H new ATOM 0 HE2 MET A 72 -2.139 -10.288 -1.590 1.00 41.44 H new ATOM 0 HE3 MET A 72 -2.524 -11.422 -2.906 1.00 41.44 H new ATOM 1110 N ARG A 73 -4.044 -13.224 4.378 1.00 54.24 N ATOM 1111 CA ARG A 73 -4.702 -13.849 5.518 1.00 61.34 C ATOM 1112 C ARG A 73 -4.150 -13.320 6.843 1.00 10.01 C ATOM 1113 O ARG A 73 -4.781 -13.469 7.888 1.00 30.12 O ATOM 1114 CB ARG A 73 -4.542 -15.368 5.447 1.00 14.01 C ATOM 1115 CG ARG A 73 -4.981 -15.958 4.115 1.00 43.41 C ATOM 1116 CD ARG A 73 -5.004 -17.478 4.154 1.00 33.52 C ATOM 1117 NE ARG A 73 -3.835 -18.029 4.834 1.00 3.42 N ATOM 1118 CZ ARG A 73 -3.784 -19.258 5.345 1.00 52.11 C ATOM 1119 NH1 ARG A 73 -4.834 -20.066 5.255 1.00 60.34 N ATOM 1120 NH2 ARG A 73 -2.681 -19.680 5.948 1.00 15.20 N ATOM 0 H ARG A 73 -3.298 -13.785 3.965 1.00 54.24 H new ATOM 0 HA ARG A 73 -5.761 -13.596 5.475 1.00 61.34 H new ATOM 0 HB2 ARG A 73 -3.498 -15.625 5.624 1.00 14.01 H new ATOM 0 HB3 ARG A 73 -5.123 -15.825 6.248 1.00 14.01 H new ATOM 0 HG2 ARG A 73 -5.973 -15.585 3.861 1.00 43.41 H new ATOM 0 HG3 ARG A 73 -4.304 -15.624 3.328 1.00 43.41 H new ATOM 0 HD2 ARG A 73 -5.909 -17.813 4.661 1.00 33.52 H new ATOM 0 HD3 ARG A 73 -5.047 -17.865 3.136 1.00 33.52 H new ATOM 0 HE ARG A 73 -3.009 -17.438 4.923 1.00 3.42 H new ATOM 0 HH11 ARG A 73 -5.685 -19.746 4.793 1.00 60.34 H new ATOM 0 HH12 ARG A 73 -4.789 -21.006 5.648 1.00 60.34 H new ATOM 0 HH21 ARG A 73 -1.872 -19.063 6.021 1.00 15.20 H new ATOM 0 HH22 ARG A 73 -2.642 -20.621 6.339 1.00 15.20 H new ATOM 1134 N THR A 74 -2.972 -12.698 6.795 1.00 60.32 N ATOM 1135 CA THR A 74 -2.351 -12.147 7.997 1.00 72.15 C ATOM 1136 C THR A 74 -2.616 -10.648 8.111 1.00 41.01 C ATOM 1137 O THR A 74 -2.332 -10.036 9.141 1.00 52.23 O ATOM 1138 CB THR A 74 -0.839 -12.385 7.987 1.00 41.34 C ATOM 1139 OG1 THR A 74 -0.243 -11.750 6.871 1.00 75.31 O ATOM 1140 CG2 THR A 74 -0.447 -13.846 7.946 1.00 24.33 C ATOM 0 H THR A 74 -2.432 -12.564 5.940 1.00 60.32 H new ATOM 0 HA THR A 74 -2.793 -12.657 8.853 1.00 72.15 H new ATOM 0 HB THR A 74 -0.481 -11.965 8.927 1.00 41.34 H new ATOM 0 HG1 THR A 74 0.558 -12.246 6.601 1.00 75.31 H new ATOM 0 HG21 THR A 74 0.640 -13.931 7.941 1.00 24.33 H new ATOM 0 HG22 THR A 74 -0.847 -14.355 8.823 1.00 24.33 H new ATOM 0 HG23 THR A 74 -0.851 -14.306 7.044 1.00 24.33 H new ATOM 1148 N GLY A 75 -3.139 -10.054 7.041 1.00 23.14 N ATOM 1149 CA GLY A 75 -3.401 -8.630 7.045 1.00 32.14 C ATOM 1150 C GLY A 75 -4.855 -8.279 7.289 1.00 54.13 C ATOM 1151 O GLY A 75 -5.754 -9.071 7.005 1.00 51.03 O ATOM 0 H GLY A 75 -3.384 -10.534 6.175 1.00 23.14 H new ATOM 0 HA2 GLY A 75 -2.789 -8.159 7.814 1.00 32.14 H new ATOM 0 HA3 GLY A 75 -3.090 -8.210 6.088 1.00 32.14 H new ATOM 1155 N GLU A 76 -5.079 -7.074 7.806 1.00 74.32 N ATOM 1156 CA GLU A 76 -6.426 -6.588 8.083 1.00 62.12 C ATOM 1157 C GLU A 76 -6.933 -5.725 6.929 1.00 22.30 C ATOM 1158 O GLU A 76 -8.136 -5.506 6.787 1.00 10.45 O ATOM 1159 CB GLU A 76 -6.443 -5.782 9.384 1.00 53.45 C ATOM 1160 CG GLU A 76 -6.156 -6.616 10.622 1.00 5.54 C ATOM 1161 CD GLU A 76 -7.397 -6.868 11.457 1.00 70.45 C ATOM 1162 OE1 GLU A 76 -8.110 -5.891 11.770 1.00 3.32 O ATOM 1163 OE2 GLU A 76 -7.654 -8.041 11.798 1.00 74.45 O ATOM 0 H GLU A 76 -4.339 -6.413 8.043 1.00 74.32 H new ATOM 0 HA GLU A 76 -7.085 -7.449 8.191 1.00 62.12 H new ATOM 0 HB2 GLU A 76 -5.705 -4.983 9.316 1.00 53.45 H new ATOM 0 HB3 GLU A 76 -7.418 -5.307 9.494 1.00 53.45 H new ATOM 0 HG2 GLU A 76 -5.726 -7.571 10.320 1.00 5.54 H new ATOM 0 HG3 GLU A 76 -5.409 -6.108 11.232 1.00 5.54 H new ATOM 1170 N GLY A 77 -6.005 -5.241 6.106 1.00 54.14 N ATOM 1171 CA GLY A 77 -6.371 -4.410 4.974 1.00 3.50 C ATOM 1172 C GLY A 77 -5.395 -4.553 3.821 1.00 55.33 C ATOM 1173 O GLY A 77 -4.587 -5.481 3.798 1.00 61.41 O ATOM 0 H GLY A 77 -5.004 -5.411 6.205 1.00 54.14 H new ATOM 0 HA2 GLY A 77 -7.372 -4.679 4.636 1.00 3.50 H new ATOM 0 HA3 GLY A 77 -6.410 -3.367 5.288 1.00 3.50 H new ATOM 1177 N PHE A 78 -5.467 -3.635 2.862 1.00 13.01 N ATOM 1178 CA PHE A 78 -4.578 -3.674 1.706 1.00 20.11 C ATOM 1179 C PHE A 78 -4.406 -2.288 1.092 1.00 24.22 C ATOM 1180 O PHE A 78 -5.360 -1.517 0.996 1.00 4.50 O ATOM 1181 CB PHE A 78 -5.119 -4.645 0.655 1.00 74.01 C ATOM 1182 CG PHE A 78 -5.256 -6.054 1.157 1.00 13.23 C ATOM 1183 CD1 PHE A 78 -4.199 -6.944 1.054 1.00 63.14 C ATOM 1184 CD2 PHE A 78 -6.440 -6.487 1.731 1.00 10.23 C ATOM 1185 CE1 PHE A 78 -4.321 -8.241 1.516 1.00 65.24 C ATOM 1186 CE2 PHE A 78 -6.567 -7.783 2.194 1.00 45.24 C ATOM 1187 CZ PHE A 78 -5.506 -8.661 2.086 1.00 61.21 C ATOM 0 H PHE A 78 -6.128 -2.859 2.862 1.00 13.01 H new ATOM 0 HA PHE A 78 -3.602 -4.019 2.047 1.00 20.11 H new ATOM 0 HB2 PHE A 78 -6.092 -4.293 0.313 1.00 74.01 H new ATOM 0 HB3 PHE A 78 -4.456 -4.639 -0.210 1.00 74.01 H new ATOM 0 HD1 PHE A 78 -3.270 -6.621 0.608 1.00 63.14 H new ATOM 0 HD2 PHE A 78 -7.273 -5.805 1.818 1.00 10.23 H new ATOM 0 HE1 PHE A 78 -3.490 -8.925 1.431 1.00 65.24 H new ATOM 0 HE2 PHE A 78 -7.495 -8.109 2.640 1.00 45.24 H new ATOM 0 HZ PHE A 78 -5.603 -9.674 2.447 1.00 61.21 H new ATOM 1197 N LEU A 79 -3.182 -1.982 0.673 1.00 73.54 N ATOM 1198 CA LEU A 79 -2.880 -0.692 0.063 1.00 21.53 C ATOM 1199 C LEU A 79 -2.260 -0.879 -1.318 1.00 64.50 C ATOM 1200 O LEU A 79 -1.223 -1.526 -1.461 1.00 60.32 O ATOM 1201 CB LEU A 79 -1.931 0.110 0.958 1.00 14.41 C ATOM 1202 CG LEU A 79 -2.341 1.565 1.193 1.00 14.44 C ATOM 1203 CD1 LEU A 79 -3.041 1.710 2.535 1.00 24.24 C ATOM 1204 CD2 LEU A 79 -1.128 2.481 1.120 1.00 35.22 C ATOM 0 H LEU A 79 -2.382 -2.611 0.745 1.00 73.54 H new ATOM 0 HA LEU A 79 -3.814 -0.141 -0.048 1.00 21.53 H new ATOM 0 HB2 LEU A 79 -1.855 -0.391 1.923 1.00 14.41 H new ATOM 0 HB3 LEU A 79 -0.936 0.096 0.513 1.00 14.41 H new ATOM 0 HG LEU A 79 -3.038 1.858 0.408 1.00 14.44 H new ATOM 0 HD11 LEU A 79 -3.326 2.751 2.686 1.00 24.24 H new ATOM 0 HD12 LEU A 79 -3.933 1.084 2.550 1.00 24.24 H new ATOM 0 HD13 LEU A 79 -2.366 1.399 3.333 1.00 24.24 H new ATOM 0 HD21 LEU A 79 -1.440 3.512 1.290 1.00 35.22 H new ATOM 0 HD22 LEU A 79 -0.406 2.190 1.883 1.00 35.22 H new ATOM 0 HD23 LEU A 79 -0.668 2.398 0.135 1.00 35.22 H new ATOM 1216 N CYS A 80 -2.901 -0.307 -2.332 1.00 32.43 N ATOM 1217 CA CYS A 80 -2.409 -0.412 -3.701 1.00 64.42 C ATOM 1218 C CYS A 80 -1.605 0.825 -4.085 1.00 73.42 C ATOM 1219 O CYS A 80 -2.163 1.906 -4.274 1.00 3.44 O ATOM 1220 CB CYS A 80 -3.575 -0.598 -4.675 1.00 12.44 C ATOM 1221 SG CYS A 80 -4.158 -2.304 -4.813 1.00 35.13 S ATOM 0 H CYS A 80 -3.761 0.233 -2.232 1.00 32.43 H new ATOM 0 HA CYS A 80 -1.756 -1.283 -3.759 1.00 64.42 H new ATOM 0 HB2 CYS A 80 -4.405 0.033 -4.356 1.00 12.44 H new ATOM 0 HB3 CYS A 80 -3.269 -0.249 -5.661 1.00 12.44 H new ATOM 0 HG CYS A 80 -5.302 -2.323 -5.431 1.00 35.13 H new ATOM 1227 N VAL A 81 -0.292 0.660 -4.198 1.00 73.15 N ATOM 1228 CA VAL A 81 0.587 1.765 -4.559 1.00 11.21 C ATOM 1229 C VAL A 81 1.013 1.675 -6.020 1.00 3.13 C ATOM 1230 O VAL A 81 1.744 0.765 -6.410 1.00 21.31 O ATOM 1231 CB VAL A 81 1.845 1.797 -3.668 1.00 61.34 C ATOM 1232 CG1 VAL A 81 2.725 2.986 -4.024 1.00 42.22 C ATOM 1233 CG2 VAL A 81 1.457 1.835 -2.198 1.00 55.20 C ATOM 0 H VAL A 81 0.187 -0.228 -4.045 1.00 73.15 H new ATOM 0 HA VAL A 81 0.020 2.683 -4.406 1.00 11.21 H new ATOM 0 HB VAL A 81 2.416 0.886 -3.847 1.00 61.34 H new ATOM 0 HG11 VAL A 81 3.607 2.990 -3.384 1.00 42.22 H new ATOM 0 HG12 VAL A 81 3.034 2.911 -5.067 1.00 42.22 H new ATOM 0 HG13 VAL A 81 2.165 3.910 -3.877 1.00 42.22 H new ATOM 0 HG21 VAL A 81 2.358 1.857 -1.584 1.00 55.20 H new ATOM 0 HG22 VAL A 81 0.862 2.727 -2.002 1.00 55.20 H new ATOM 0 HG23 VAL A 81 0.873 0.948 -1.953 1.00 55.20 H new ATOM 1243 N PHE A 82 0.553 2.630 -6.823 1.00 54.03 N ATOM 1244 CA PHE A 82 0.890 2.662 -8.241 1.00 72.31 C ATOM 1245 C PHE A 82 1.493 4.013 -8.620 1.00 32.10 C ATOM 1246 O PHE A 82 1.091 5.051 -8.095 1.00 74.24 O ATOM 1247 CB PHE A 82 -0.353 2.370 -9.092 1.00 15.22 C ATOM 1248 CG PHE A 82 -1.194 3.581 -9.392 1.00 3.13 C ATOM 1249 CD1 PHE A 82 -2.084 4.075 -8.452 1.00 23.53 C ATOM 1250 CD2 PHE A 82 -1.092 4.224 -10.616 1.00 53.44 C ATOM 1251 CE1 PHE A 82 -2.857 5.188 -8.727 1.00 63.43 C ATOM 1252 CE2 PHE A 82 -1.862 5.337 -10.896 1.00 73.15 C ATOM 1253 CZ PHE A 82 -2.746 5.819 -9.950 1.00 74.32 C ATOM 0 H PHE A 82 -0.053 3.391 -6.516 1.00 54.03 H new ATOM 0 HA PHE A 82 1.633 1.889 -8.436 1.00 72.31 H new ATOM 0 HB2 PHE A 82 -0.038 1.919 -10.033 1.00 15.22 H new ATOM 0 HB3 PHE A 82 -0.968 1.633 -8.575 1.00 15.22 H new ATOM 0 HD1 PHE A 82 -2.175 3.585 -7.494 1.00 23.53 H new ATOM 0 HD2 PHE A 82 -0.403 3.851 -11.359 1.00 53.44 H new ATOM 0 HE1 PHE A 82 -3.547 5.563 -7.986 1.00 63.43 H new ATOM 0 HE2 PHE A 82 -1.773 5.829 -11.853 1.00 73.15 H new ATOM 0 HZ PHE A 82 -3.349 6.688 -10.167 1.00 74.32 H new ATOM 1263 N ALA A 83 2.457 3.992 -9.533 1.00 73.53 N ATOM 1264 CA ALA A 83 3.108 5.216 -9.977 1.00 1.23 C ATOM 1265 C ALA A 83 2.342 5.853 -11.131 1.00 53.33 C ATOM 1266 O ALA A 83 2.116 5.220 -12.163 1.00 33.30 O ATOM 1267 CB ALA A 83 4.544 4.929 -10.387 1.00 53.54 C ATOM 0 H ALA A 83 2.804 3.142 -9.979 1.00 73.53 H new ATOM 0 HA ALA A 83 3.114 5.921 -9.146 1.00 1.23 H new ATOM 0 HB1 ALA A 83 5.020 5.853 -10.717 1.00 53.54 H new ATOM 0 HB2 ALA A 83 5.091 4.523 -9.536 1.00 53.54 H new ATOM 0 HB3 ALA A 83 4.552 4.205 -11.202 1.00 53.54 H new ATOM 1273 N ILE A 84 1.949 7.110 -10.953 1.00 53.31 N ATOM 1274 CA ILE A 84 1.212 7.831 -11.983 1.00 71.34 C ATOM 1275 C ILE A 84 2.026 7.924 -13.268 1.00 15.42 C ATOM 1276 O ILE A 84 1.474 7.946 -14.367 1.00 63.42 O ATOM 1277 CB ILE A 84 0.844 9.253 -11.517 1.00 50.14 C ATOM 1278 CG1 ILE A 84 2.085 9.986 -11.009 1.00 74.54 C ATOM 1279 CG2 ILE A 84 -0.218 9.194 -10.433 1.00 71.32 C ATOM 1280 CD1 ILE A 84 1.980 11.492 -11.108 1.00 53.40 C ATOM 0 H ILE A 84 2.129 7.649 -10.106 1.00 53.31 H new ATOM 0 HA ILE A 84 0.296 7.272 -12.173 1.00 71.34 H new ATOM 0 HB ILE A 84 0.442 9.804 -12.367 1.00 50.14 H new ATOM 0 HG12 ILE A 84 2.260 9.710 -9.969 1.00 74.54 H new ATOM 0 HG13 ILE A 84 2.953 9.652 -11.578 1.00 74.54 H new ATOM 0 HG21 ILE A 84 -0.468 10.206 -10.113 1.00 71.32 H new ATOM 0 HG22 ILE A 84 -1.111 8.706 -10.824 1.00 71.32 H new ATOM 0 HG23 ILE A 84 0.162 8.628 -9.582 1.00 71.32 H new ATOM 0 HD11 ILE A 84 2.896 11.946 -10.730 1.00 53.40 H new ATOM 0 HD12 ILE A 84 1.836 11.779 -12.150 1.00 53.40 H new ATOM 0 HD13 ILE A 84 1.133 11.837 -10.516 1.00 53.40 H new ATOM 1292 N ASN A 85 3.345 7.974 -13.118 1.00 23.51 N ATOM 1293 CA ASN A 85 4.243 8.061 -14.262 1.00 41.22 C ATOM 1294 C ASN A 85 4.277 6.741 -15.026 1.00 13.13 C ATOM 1295 O ASN A 85 4.498 6.719 -16.237 1.00 41.15 O ATOM 1296 CB ASN A 85 5.653 8.437 -13.800 1.00 63.10 C ATOM 1297 CG ASN A 85 6.332 9.405 -14.748 1.00 4.12 C ATOM 1298 OD1 ASN A 85 6.259 10.621 -14.570 1.00 33.50 O ATOM 1299 ND2 ASN A 85 6.998 8.869 -15.764 1.00 43.40 N ATOM 0 H ASN A 85 3.816 7.956 -12.213 1.00 23.51 H new ATOM 0 HA ASN A 85 3.870 8.836 -14.931 1.00 41.22 H new ATOM 0 HB2 ASN A 85 5.600 8.882 -12.806 1.00 63.10 H new ATOM 0 HB3 ASN A 85 6.257 7.534 -13.713 1.00 63.10 H new ATOM 0 HD21 ASN A 85 7.475 9.471 -16.435 1.00 43.40 H new ATOM 0 HD22 ASN A 85 7.032 7.855 -15.873 1.00 43.40 H new ATOM 1306 N ASN A 86 4.053 5.643 -14.311 1.00 22.24 N ATOM 1307 CA ASN A 86 4.055 4.319 -14.922 1.00 62.11 C ATOM 1308 C ASN A 86 2.635 3.773 -15.036 1.00 41.45 C ATOM 1309 O ASN A 86 2.011 3.425 -14.034 1.00 50.15 O ATOM 1310 CB ASN A 86 4.919 3.358 -14.103 1.00 33.02 C ATOM 1311 CG ASN A 86 5.658 2.360 -14.972 1.00 22.12 C ATOM 1312 OD1 ASN A 86 5.252 2.080 -16.100 1.00 50.01 O ATOM 1313 ND2 ASN A 86 6.752 1.817 -14.450 1.00 73.43 N ATOM 0 H ASN A 86 3.868 5.644 -13.308 1.00 22.24 H new ATOM 0 HA ASN A 86 4.474 4.408 -15.924 1.00 62.11 H new ATOM 0 HB2 ASN A 86 5.640 3.930 -13.519 1.00 33.02 H new ATOM 0 HB3 ASN A 86 4.288 2.821 -13.394 1.00 33.02 H new ATOM 0 HD21 ASN A 86 7.292 1.139 -14.988 1.00 73.43 H new ATOM 0 HD22 ASN A 86 7.053 2.078 -13.511 1.00 73.43 H new ATOM 1320 N THR A 87 2.130 3.704 -16.263 1.00 24.42 N ATOM 1321 CA THR A 87 0.782 3.203 -16.507 1.00 72.40 C ATOM 1322 C THR A 87 0.682 1.714 -16.191 1.00 14.32 C ATOM 1323 O THR A 87 -0.397 1.207 -15.881 1.00 22.23 O ATOM 1324 CB THR A 87 0.377 3.455 -17.960 1.00 74.02 C ATOM 1325 OG1 THR A 87 0.931 4.670 -18.432 1.00 64.41 O ATOM 1326 CG2 THR A 87 -1.122 3.526 -18.159 1.00 44.40 C ATOM 0 H THR A 87 2.633 3.988 -17.103 1.00 24.42 H new ATOM 0 HA THR A 87 0.101 3.740 -15.847 1.00 72.40 H new ATOM 0 HB THR A 87 0.762 2.602 -18.519 1.00 74.02 H new ATOM 0 HG1 THR A 87 0.951 5.325 -17.704 1.00 64.41 H new ATOM 0 HG21 THR A 87 -1.341 3.707 -19.211 1.00 44.40 H new ATOM 0 HG22 THR A 87 -1.575 2.584 -17.851 1.00 44.40 H new ATOM 0 HG23 THR A 87 -1.531 4.339 -17.559 1.00 44.40 H new ATOM 1334 N LYS A 88 1.810 1.015 -16.270 1.00 11.24 N ATOM 1335 CA LYS A 88 1.847 -0.410 -15.991 1.00 12.15 C ATOM 1336 C LYS A 88 1.431 -0.688 -14.548 1.00 62.20 C ATOM 1337 O LYS A 88 0.692 -1.634 -14.276 1.00 41.41 O ATOM 1338 CB LYS A 88 3.253 -0.952 -16.260 1.00 22.51 C ATOM 1339 CG LYS A 88 3.499 -2.334 -15.682 1.00 64.14 C ATOM 1340 CD LYS A 88 4.131 -3.267 -16.703 1.00 12.43 C ATOM 1341 CE LYS A 88 5.448 -2.715 -17.226 1.00 14.05 C ATOM 1342 NZ LYS A 88 6.531 -3.736 -17.194 1.00 35.21 N ATOM 0 H LYS A 88 2.712 1.417 -16.526 1.00 11.24 H new ATOM 0 HA LYS A 88 1.140 -0.917 -16.648 1.00 12.15 H new ATOM 0 HB2 LYS A 88 3.420 -0.984 -17.337 1.00 22.51 H new ATOM 0 HB3 LYS A 88 3.985 -0.259 -15.844 1.00 22.51 H new ATOM 0 HG2 LYS A 88 4.149 -2.254 -14.811 1.00 64.14 H new ATOM 0 HG3 LYS A 88 2.556 -2.757 -15.337 1.00 64.14 H new ATOM 0 HD2 LYS A 88 4.300 -4.243 -16.249 1.00 12.43 H new ATOM 0 HD3 LYS A 88 3.443 -3.417 -17.535 1.00 12.43 H new ATOM 0 HE2 LYS A 88 5.313 -2.361 -18.248 1.00 14.05 H new ATOM 0 HE3 LYS A 88 5.744 -1.854 -16.627 1.00 14.05 H new ATOM 0 HZ1 LYS A 88 7.412 -3.320 -17.559 1.00 35.21 H new ATOM 0 HZ2 LYS A 88 6.678 -4.055 -16.215 1.00 35.21 H new ATOM 0 HZ3 LYS A 88 6.261 -4.547 -17.786 1.00 35.21 H new ATOM 1356 N SER A 89 1.909 0.144 -13.630 1.00 35.33 N ATOM 1357 CA SER A 89 1.586 -0.010 -12.216 1.00 52.14 C ATOM 1358 C SER A 89 0.084 0.122 -11.984 1.00 63.42 C ATOM 1359 O SER A 89 -0.463 -0.461 -11.048 1.00 63.32 O ATOM 1360 CB SER A 89 2.336 1.032 -11.385 1.00 24.45 C ATOM 1361 OG SER A 89 1.842 2.337 -11.635 1.00 23.42 O ATOM 0 H SER A 89 2.522 0.932 -13.839 1.00 35.33 H new ATOM 0 HA SER A 89 1.897 -1.007 -11.903 1.00 52.14 H new ATOM 0 HB2 SER A 89 2.234 0.798 -10.325 1.00 24.45 H new ATOM 0 HB3 SER A 89 3.400 0.991 -11.620 1.00 24.45 H new ATOM 0 HG SER A 89 1.861 2.515 -12.599 1.00 23.42 H new ATOM 1367 N PHE A 90 -0.577 0.893 -12.841 1.00 5.22 N ATOM 1368 CA PHE A 90 -2.016 1.102 -12.730 1.00 53.04 C ATOM 1369 C PHE A 90 -2.777 -0.189 -13.016 1.00 3.13 C ATOM 1370 O PHE A 90 -3.709 -0.544 -12.294 1.00 73.15 O ATOM 1371 CB PHE A 90 -2.467 2.202 -13.695 1.00 64.03 C ATOM 1372 CG PHE A 90 -3.948 2.451 -13.677 1.00 11.10 C ATOM 1373 CD1 PHE A 90 -4.586 2.831 -12.507 1.00 15.44 C ATOM 1374 CD2 PHE A 90 -4.702 2.304 -14.829 1.00 70.23 C ATOM 1375 CE1 PHE A 90 -5.948 3.060 -12.487 1.00 11.11 C ATOM 1376 CE2 PHE A 90 -6.065 2.531 -14.816 1.00 24.12 C ATOM 1377 CZ PHE A 90 -6.689 2.910 -13.643 1.00 51.11 C ATOM 0 H PHE A 90 -0.139 1.384 -13.620 1.00 5.22 H new ATOM 0 HA PHE A 90 -2.237 1.412 -11.709 1.00 53.04 H new ATOM 0 HB2 PHE A 90 -1.949 3.128 -13.445 1.00 64.03 H new ATOM 0 HB3 PHE A 90 -2.165 1.932 -14.707 1.00 64.03 H new ATOM 0 HD1 PHE A 90 -4.012 2.949 -11.600 1.00 15.44 H new ATOM 0 HD2 PHE A 90 -4.219 2.008 -15.749 1.00 70.23 H new ATOM 0 HE1 PHE A 90 -6.433 3.356 -11.569 1.00 11.11 H new ATOM 0 HE2 PHE A 90 -6.642 2.412 -15.721 1.00 24.12 H new ATOM 0 HZ PHE A 90 -7.754 3.089 -13.630 1.00 51.11 H new ATOM 1387 N GLU A 91 -2.375 -0.885 -14.074 1.00 34.41 N ATOM 1388 CA GLU A 91 -3.021 -2.135 -14.457 1.00 43.51 C ATOM 1389 C GLU A 91 -2.849 -3.196 -13.374 1.00 35.21 C ATOM 1390 O GLU A 91 -3.700 -4.070 -13.209 1.00 42.22 O ATOM 1391 CB GLU A 91 -2.447 -2.642 -15.782 1.00 40.34 C ATOM 1392 CG GLU A 91 -2.411 -1.584 -16.873 1.00 42.03 C ATOM 1393 CD GLU A 91 -3.056 -2.053 -18.163 1.00 53.45 C ATOM 1394 OE1 GLU A 91 -4.291 -1.921 -18.292 1.00 21.40 O ATOM 1395 OE2 GLU A 91 -2.325 -2.551 -19.045 1.00 41.44 O ATOM 0 H GLU A 91 -1.605 -0.605 -14.681 1.00 34.41 H new ATOM 0 HA GLU A 91 -4.087 -1.941 -14.579 1.00 43.51 H new ATOM 0 HB2 GLU A 91 -1.436 -3.012 -15.613 1.00 40.34 H new ATOM 0 HB3 GLU A 91 -3.042 -3.488 -16.127 1.00 40.34 H new ATOM 0 HG2 GLU A 91 -2.921 -0.687 -16.521 1.00 42.03 H new ATOM 0 HG3 GLU A 91 -1.376 -1.305 -17.069 1.00 42.03 H new ATOM 1402 N ASP A 92 -1.744 -3.115 -12.640 1.00 31.03 N ATOM 1403 CA ASP A 92 -1.463 -4.070 -11.574 1.00 22.21 C ATOM 1404 C ASP A 92 -2.460 -3.917 -10.429 1.00 11.23 C ATOM 1405 O ASP A 92 -2.812 -4.893 -9.765 1.00 23.25 O ATOM 1406 CB ASP A 92 -0.034 -3.883 -11.056 1.00 3.12 C ATOM 1407 CG ASP A 92 0.866 -5.050 -11.411 1.00 54.12 C ATOM 1408 OD1 ASP A 92 0.536 -5.786 -12.364 1.00 60.11 O ATOM 1409 OD2 ASP A 92 1.902 -5.227 -10.736 1.00 52.01 O ATOM 0 H ASP A 92 -1.029 -2.398 -12.764 1.00 31.03 H new ATOM 0 HA ASP A 92 -1.563 -5.075 -11.984 1.00 22.21 H new ATOM 0 HB2 ASP A 92 0.383 -2.966 -11.472 1.00 3.12 H new ATOM 0 HB3 ASP A 92 -0.056 -3.761 -9.973 1.00 3.12 H new ATOM 1414 N ILE A 93 -2.914 -2.689 -10.202 1.00 34.43 N ATOM 1415 CA ILE A 93 -3.873 -2.416 -9.138 1.00 13.43 C ATOM 1416 C ILE A 93 -5.180 -3.168 -9.376 1.00 34.01 C ATOM 1417 O ILE A 93 -5.886 -3.519 -8.430 1.00 1.01 O ATOM 1418 CB ILE A 93 -4.169 -0.906 -9.018 1.00 5.14 C ATOM 1419 CG1 ILE A 93 -2.878 -0.114 -8.820 1.00 25.43 C ATOM 1420 CG2 ILE A 93 -5.126 -0.633 -7.870 1.00 41.04 C ATOM 1421 CD1 ILE A 93 -1.963 -0.686 -7.758 1.00 12.53 C ATOM 0 H ILE A 93 -2.634 -1.869 -10.739 1.00 34.43 H new ATOM 0 HA ILE A 93 -3.423 -2.760 -8.207 1.00 13.43 H new ATOM 0 HB ILE A 93 -4.638 -0.583 -9.948 1.00 5.14 H new ATOM 0 HG12 ILE A 93 -2.339 -0.074 -9.767 1.00 25.43 H new ATOM 0 HG13 ILE A 93 -3.130 0.912 -8.554 1.00 25.43 H new ATOM 0 HG21 ILE A 93 -5.320 0.438 -7.805 1.00 41.04 H new ATOM 0 HG22 ILE A 93 -6.063 -1.162 -8.044 1.00 41.04 H new ATOM 0 HG23 ILE A 93 -4.682 -0.979 -6.936 1.00 41.04 H new ATOM 0 HD11 ILE A 93 -1.069 -0.068 -7.677 1.00 12.53 H new ATOM 0 HD12 ILE A 93 -2.482 -0.700 -6.800 1.00 12.53 H new ATOM 0 HD13 ILE A 93 -1.679 -1.702 -8.032 1.00 12.53 H new ATOM 1433 N HIS A 94 -5.494 -3.414 -10.644 1.00 31.25 N ATOM 1434 CA HIS A 94 -6.713 -4.127 -11.005 1.00 52.14 C ATOM 1435 C HIS A 94 -6.592 -5.610 -10.663 1.00 40.23 C ATOM 1436 O HIS A 94 -7.423 -6.160 -9.940 1.00 54.41 O ATOM 1437 CB HIS A 94 -7.004 -3.952 -12.499 1.00 61.33 C ATOM 1438 CG HIS A 94 -8.140 -4.794 -12.999 1.00 60.11 C ATOM 1439 ND1 HIS A 94 -9.462 -4.419 -12.886 1.00 54.53 N ATOM 1440 CD2 HIS A 94 -8.143 -5.999 -13.617 1.00 23.01 C ATOM 1441 CE1 HIS A 94 -10.230 -5.357 -13.413 1.00 14.14 C ATOM 1442 NE2 HIS A 94 -9.454 -6.325 -13.863 1.00 71.03 N ATOM 0 H HIS A 94 -4.921 -3.130 -11.438 1.00 31.25 H new ATOM 0 HA HIS A 94 -7.540 -3.708 -10.431 1.00 52.14 H new ATOM 0 HB2 HIS A 94 -7.228 -2.903 -12.695 1.00 61.33 H new ATOM 0 HB3 HIS A 94 -6.106 -4.198 -13.065 1.00 61.33 H new ATOM 0 HD1 HIS A 94 -9.795 -3.553 -12.462 1.00 54.53 H new ATOM 0 HD2 HIS A 94 -7.277 -6.592 -13.869 1.00 23.01 H new ATOM 0 HE1 HIS A 94 -11.308 -5.335 -13.466 1.00 14.14 H new ATOM 1451 N GLN A 95 -5.552 -6.248 -11.188 1.00 12.03 N ATOM 1452 CA GLN A 95 -5.321 -7.666 -10.939 1.00 14.52 C ATOM 1453 C GLN A 95 -4.972 -7.915 -9.474 1.00 14.32 C ATOM 1454 O GLN A 95 -5.241 -8.989 -8.936 1.00 15.51 O ATOM 1455 CB GLN A 95 -4.198 -8.187 -11.838 1.00 20.03 C ATOM 1456 CG GLN A 95 -2.886 -7.438 -11.672 1.00 23.30 C ATOM 1457 CD GLN A 95 -1.956 -8.105 -10.677 1.00 24.43 C ATOM 1458 OE1 GLN A 95 -1.911 -9.331 -10.577 1.00 52.24 O ATOM 1459 NE2 GLN A 95 -1.208 -7.298 -9.933 1.00 55.32 N ATOM 0 H GLN A 95 -4.856 -5.806 -11.788 1.00 12.03 H new ATOM 0 HA GLN A 95 -6.241 -8.203 -11.169 1.00 14.52 H new ATOM 0 HB2 GLN A 95 -4.033 -9.243 -11.624 1.00 20.03 H new ATOM 0 HB3 GLN A 95 -4.516 -8.119 -12.878 1.00 20.03 H new ATOM 0 HG2 GLN A 95 -2.387 -7.367 -12.639 1.00 23.30 H new ATOM 0 HG3 GLN A 95 -3.092 -6.419 -11.344 1.00 23.30 H new ATOM 0 HE21 GLN A 95 -1.277 -6.287 -10.049 1.00 55.32 H new ATOM 0 HE22 GLN A 95 -0.564 -7.689 -9.245 1.00 55.32 H new ATOM 1468 N TYR A 96 -4.372 -6.915 -8.835 1.00 24.21 N ATOM 1469 CA TYR A 96 -3.988 -7.027 -7.432 1.00 63.43 C ATOM 1470 C TYR A 96 -5.216 -7.201 -6.543 1.00 24.03 C ATOM 1471 O TYR A 96 -5.263 -8.099 -5.702 1.00 64.52 O ATOM 1472 CB TYR A 96 -3.199 -5.791 -6.998 1.00 33.21 C ATOM 1473 CG TYR A 96 -1.702 -5.946 -7.147 1.00 21.34 C ATOM 1474 CD1 TYR A 96 -1.051 -7.078 -6.673 1.00 52.32 C ATOM 1475 CD2 TYR A 96 -0.940 -4.960 -7.762 1.00 50.34 C ATOM 1476 CE1 TYR A 96 0.317 -7.223 -6.807 1.00 11.05 C ATOM 1477 CE2 TYR A 96 0.428 -5.098 -7.900 1.00 43.31 C ATOM 1478 CZ TYR A 96 1.051 -6.231 -7.422 1.00 1.31 C ATOM 1479 OH TYR A 96 2.413 -6.373 -7.558 1.00 51.42 O ATOM 0 H TYR A 96 -4.142 -6.020 -9.266 1.00 24.21 H new ATOM 0 HA TYR A 96 -3.357 -7.909 -7.323 1.00 63.43 H new ATOM 0 HB2 TYR A 96 -3.528 -4.935 -7.587 1.00 33.21 H new ATOM 0 HB3 TYR A 96 -3.431 -5.569 -5.956 1.00 33.21 H new ATOM 0 HD1 TYR A 96 -1.623 -7.857 -6.192 1.00 52.32 H new ATOM 0 HD2 TYR A 96 -1.425 -4.071 -8.138 1.00 50.34 H new ATOM 0 HE1 TYR A 96 0.808 -8.109 -6.432 1.00 11.05 H new ATOM 0 HE2 TYR A 96 1.006 -4.322 -8.380 1.00 43.31 H new ATOM 0 HH TYR A 96 2.853 -6.135 -6.715 1.00 51.42 H new ATOM 1489 N ARG A 97 -6.207 -6.336 -6.734 1.00 43.13 N ATOM 1490 CA ARG A 97 -7.436 -6.394 -5.949 1.00 62.33 C ATOM 1491 C ARG A 97 -8.103 -7.759 -6.080 1.00 42.24 C ATOM 1492 O ARG A 97 -8.685 -8.272 -5.123 1.00 44.55 O ATOM 1493 CB ARG A 97 -8.403 -5.296 -6.395 1.00 54.33 C ATOM 1494 CG ARG A 97 -9.669 -5.224 -5.557 1.00 3.22 C ATOM 1495 CD ARG A 97 -10.356 -3.875 -5.700 1.00 31.44 C ATOM 1496 NE ARG A 97 -11.523 -3.759 -4.829 1.00 71.45 N ATOM 1497 CZ ARG A 97 -12.709 -4.298 -5.103 1.00 72.41 C ATOM 1498 NH1 ARG A 97 -12.890 -4.988 -6.222 1.00 4.41 N ATOM 1499 NH2 ARG A 97 -13.717 -4.147 -4.255 1.00 0.14 N ATOM 0 H ARG A 97 -6.183 -5.586 -7.425 1.00 43.13 H new ATOM 0 HA ARG A 97 -7.176 -6.237 -4.902 1.00 62.33 H new ATOM 0 HB2 ARG A 97 -7.893 -4.334 -6.351 1.00 54.33 H new ATOM 0 HB3 ARG A 97 -8.676 -5.465 -7.437 1.00 54.33 H new ATOM 0 HG2 ARG A 97 -10.353 -6.016 -5.861 1.00 3.22 H new ATOM 0 HG3 ARG A 97 -9.424 -5.399 -4.510 1.00 3.22 H new ATOM 0 HD2 ARG A 97 -9.648 -3.081 -5.464 1.00 31.44 H new ATOM 0 HD3 ARG A 97 -10.662 -3.732 -6.736 1.00 31.44 H new ATOM 0 HE ARG A 97 -11.423 -3.234 -3.960 1.00 71.45 H new ATOM 0 HH11 ARG A 97 -12.118 -5.108 -6.878 1.00 4.41 H new ATOM 0 HH12 ARG A 97 -13.801 -5.399 -6.426 1.00 4.41 H new ATOM 0 HH21 ARG A 97 -13.584 -3.618 -3.393 1.00 0.14 H new ATOM 0 HH22 ARG A 97 -14.626 -4.560 -4.465 1.00 0.14 H new ATOM 1513 N GLU A 98 -8.015 -8.344 -7.270 1.00 31.01 N ATOM 1514 CA GLU A 98 -8.610 -9.651 -7.525 1.00 14.00 C ATOM 1515 C GLU A 98 -8.008 -10.710 -6.607 1.00 62.32 C ATOM 1516 O GLU A 98 -8.708 -11.604 -6.132 1.00 32.42 O ATOM 1517 CB GLU A 98 -8.405 -10.051 -8.988 1.00 33.12 C ATOM 1518 CG GLU A 98 -9.530 -9.598 -9.905 1.00 60.31 C ATOM 1519 CD GLU A 98 -10.348 -10.757 -10.441 1.00 63.33 C ATOM 1520 OE1 GLU A 98 -9.827 -11.509 -11.291 1.00 13.51 O ATOM 1521 OE2 GLU A 98 -11.510 -10.912 -10.011 1.00 2.04 O ATOM 0 H GLU A 98 -7.538 -7.934 -8.073 1.00 31.01 H new ATOM 0 HA GLU A 98 -9.678 -9.583 -7.321 1.00 14.00 H new ATOM 0 HB2 GLU A 98 -7.465 -9.629 -9.343 1.00 33.12 H new ATOM 0 HB3 GLU A 98 -8.311 -11.135 -9.050 1.00 33.12 H new ATOM 0 HG2 GLU A 98 -10.185 -8.917 -9.362 1.00 60.31 H new ATOM 0 HG3 GLU A 98 -9.110 -9.038 -10.740 1.00 60.31 H new ATOM 1528 N GLN A 99 -6.706 -10.601 -6.360 1.00 32.41 N ATOM 1529 CA GLN A 99 -6.010 -11.548 -5.497 1.00 51.14 C ATOM 1530 C GLN A 99 -6.564 -11.496 -4.076 1.00 34.42 C ATOM 1531 O GLN A 99 -6.676 -12.522 -3.405 1.00 72.10 O ATOM 1532 CB GLN A 99 -4.508 -11.251 -5.488 1.00 4.04 C ATOM 1533 CG GLN A 99 -3.659 -12.402 -6.002 1.00 4.41 C ATOM 1534 CD GLN A 99 -3.124 -13.275 -4.883 1.00 52.44 C ATOM 1535 OE1 GLN A 99 -3.852 -13.634 -3.958 1.00 52.34 O ATOM 1536 NE2 GLN A 99 -1.845 -13.621 -4.964 1.00 0.30 N ATOM 0 H GLN A 99 -6.112 -9.866 -6.745 1.00 32.41 H new ATOM 0 HA GLN A 99 -6.171 -12.551 -5.892 1.00 51.14 H new ATOM 0 HB2 GLN A 99 -4.317 -10.368 -6.098 1.00 4.04 H new ATOM 0 HB3 GLN A 99 -4.200 -11.009 -4.471 1.00 4.04 H new ATOM 0 HG2 GLN A 99 -4.254 -13.012 -6.682 1.00 4.41 H new ATOM 0 HG3 GLN A 99 -2.824 -12.004 -6.579 1.00 4.41 H new ATOM 0 HE21 GLN A 99 -1.279 -13.300 -5.749 1.00 0.30 H new ATOM 0 HE22 GLN A 99 -1.429 -14.208 -4.241 1.00 0.30 H new ATOM 1545 N ILE A 100 -6.910 -10.294 -3.626 1.00 22.32 N ATOM 1546 CA ILE A 100 -7.453 -10.107 -2.286 1.00 75.54 C ATOM 1547 C ILE A 100 -8.852 -10.705 -2.174 1.00 62.33 C ATOM 1548 O ILE A 100 -9.173 -11.378 -1.195 1.00 51.24 O ATOM 1549 CB ILE A 100 -7.506 -8.612 -1.907 1.00 12.31 C ATOM 1550 CG1 ILE A 100 -6.111 -7.992 -2.012 1.00 4.23 C ATOM 1551 CG2 ILE A 100 -8.067 -8.433 -0.503 1.00 20.33 C ATOM 1552 CD1 ILE A 100 -6.125 -6.483 -2.110 1.00 11.02 C ATOM 0 H ILE A 100 -6.824 -9.435 -4.170 1.00 22.32 H new ATOM 0 HA ILE A 100 -6.787 -10.623 -1.595 1.00 75.54 H new ATOM 0 HB ILE A 100 -8.169 -8.100 -2.605 1.00 12.31 H new ATOM 0 HG12 ILE A 100 -5.525 -8.286 -1.141 1.00 4.23 H new ATOM 0 HG13 ILE A 100 -5.606 -8.400 -2.888 1.00 4.23 H new ATOM 0 HG21 ILE A 100 -8.096 -7.372 -0.255 1.00 20.33 H new ATOM 0 HG22 ILE A 100 -9.076 -8.843 -0.459 1.00 20.33 H new ATOM 0 HG23 ILE A 100 -7.431 -8.955 0.212 1.00 20.33 H new ATOM 0 HD11 ILE A 100 -5.102 -6.114 -2.181 1.00 11.02 H new ATOM 0 HD12 ILE A 100 -6.683 -6.181 -2.997 1.00 11.02 H new ATOM 0 HD13 ILE A 100 -6.601 -6.065 -1.223 1.00 11.02 H new ATOM 1564 N LYS A 101 -9.680 -10.459 -3.183 1.00 0.51 N ATOM 1565 CA LYS A 101 -11.043 -10.977 -3.194 1.00 14.24 C ATOM 1566 C LYS A 101 -11.046 -12.499 -3.091 1.00 75.34 C ATOM 1567 O LYS A 101 -11.977 -13.092 -2.545 1.00 74.33 O ATOM 1568 CB LYS A 101 -11.769 -10.539 -4.468 1.00 5.00 C ATOM 1569 CG LYS A 101 -11.537 -9.081 -4.835 1.00 61.13 C ATOM 1570 CD LYS A 101 -12.842 -8.366 -5.151 1.00 73.21 C ATOM 1571 CE LYS A 101 -13.593 -9.042 -6.288 1.00 22.42 C ATOM 1572 NZ LYS A 101 -13.965 -8.077 -7.360 1.00 24.40 N ATOM 0 H LYS A 101 -9.432 -9.905 -4.003 1.00 0.51 H new ATOM 0 HA LYS A 101 -11.567 -10.570 -2.329 1.00 14.24 H new ATOM 0 HB2 LYS A 101 -11.443 -11.169 -5.296 1.00 5.00 H new ATOM 0 HB3 LYS A 101 -12.839 -10.707 -4.342 1.00 5.00 H new ATOM 0 HG2 LYS A 101 -11.034 -8.574 -4.011 1.00 61.13 H new ATOM 0 HG3 LYS A 101 -10.873 -9.024 -5.697 1.00 61.13 H new ATOM 0 HD2 LYS A 101 -13.471 -8.346 -4.261 1.00 73.21 H new ATOM 0 HD3 LYS A 101 -12.634 -7.330 -5.418 1.00 73.21 H new ATOM 0 HE2 LYS A 101 -12.975 -9.834 -6.711 1.00 22.42 H new ATOM 0 HE3 LYS A 101 -14.494 -9.515 -5.897 1.00 22.42 H new ATOM 0 HZ1 LYS A 101 -14.475 -8.577 -8.116 1.00 24.40 H new ATOM 0 HZ2 LYS A 101 -14.576 -7.335 -6.963 1.00 24.40 H new ATOM 0 HZ3 LYS A 101 -13.104 -7.644 -7.751 1.00 24.40 H new ATOM 1586 N ARG A 102 -10.000 -13.127 -3.619 1.00 21.45 N ATOM 1587 CA ARG A 102 -9.883 -14.580 -3.587 1.00 40.21 C ATOM 1588 C ARG A 102 -9.600 -15.075 -2.172 1.00 32.11 C ATOM 1589 O ARG A 102 -10.368 -15.860 -1.615 1.00 52.05 O ATOM 1590 CB ARG A 102 -8.775 -15.043 -4.536 1.00 33.50 C ATOM 1591 CG ARG A 102 -9.217 -16.138 -5.489 1.00 12.02 C ATOM 1592 CD ARG A 102 -8.190 -16.376 -6.584 1.00 65.00 C ATOM 1593 NE ARG A 102 -8.211 -17.755 -7.065 1.00 41.14 N ATOM 1594 CZ ARG A 102 -9.210 -18.277 -7.774 1.00 62.54 C ATOM 1595 NH1 ARG A 102 -10.267 -17.539 -8.089 1.00 14.14 N ATOM 1596 NH2 ARG A 102 -9.151 -19.541 -8.170 1.00 22.50 N ATOM 0 H ARG A 102 -9.221 -12.652 -4.074 1.00 21.45 H new ATOM 0 HA ARG A 102 -10.833 -15.003 -3.914 1.00 40.21 H new ATOM 0 HB2 ARG A 102 -8.422 -14.189 -5.114 1.00 33.50 H new ATOM 0 HB3 ARG A 102 -7.930 -15.402 -3.948 1.00 33.50 H new ATOM 0 HG2 ARG A 102 -9.378 -17.062 -4.933 1.00 12.02 H new ATOM 0 HG3 ARG A 102 -10.172 -15.866 -5.938 1.00 12.02 H new ATOM 0 HD2 ARG A 102 -8.384 -15.699 -7.416 1.00 65.00 H new ATOM 0 HD3 ARG A 102 -7.196 -16.139 -6.206 1.00 65.00 H new ATOM 0 HE ARG A 102 -7.414 -18.353 -6.845 1.00 41.14 H new ATOM 0 HH11 ARG A 102 -10.318 -16.566 -7.788 1.00 14.14 H new ATOM 0 HH12 ARG A 102 -11.029 -17.945 -8.632 1.00 14.14 H new ATOM 0 HH21 ARG A 102 -8.341 -20.113 -7.931 1.00 22.50 H new ATOM 0 HH22 ARG A 102 -9.916 -19.942 -8.713 1.00 22.50 H new ATOM 1610 N VAL A 103 -8.497 -14.611 -1.592 1.00 72.24 N ATOM 1611 CA VAL A 103 -8.121 -15.009 -0.242 1.00 14.43 C ATOM 1612 C VAL A 103 -9.215 -14.648 0.755 1.00 24.21 C ATOM 1613 O VAL A 103 -9.749 -15.514 1.448 1.00 70.42 O ATOM 1614 CB VAL A 103 -6.802 -14.344 0.192 1.00 23.23 C ATOM 1615 CG1 VAL A 103 -6.360 -14.866 1.550 1.00 15.02 C ATOM 1616 CG2 VAL A 103 -5.721 -14.573 -0.852 1.00 1.44 C ATOM 0 H VAL A 103 -7.850 -13.960 -2.036 1.00 72.24 H new ATOM 0 HA VAL A 103 -7.984 -16.090 -0.253 1.00 14.43 H new ATOM 0 HB VAL A 103 -6.970 -13.271 0.280 1.00 23.23 H new ATOM 0 HG11 VAL A 103 -5.426 -14.384 1.839 1.00 15.02 H new ATOM 0 HG12 VAL A 103 -7.127 -14.645 2.292 1.00 15.02 H new ATOM 0 HG13 VAL A 103 -6.209 -15.944 1.494 1.00 15.02 H new ATOM 0 HG21 VAL A 103 -4.796 -14.096 -0.528 1.00 1.44 H new ATOM 0 HG22 VAL A 103 -5.554 -15.643 -0.974 1.00 1.44 H new ATOM 0 HG23 VAL A 103 -6.037 -14.144 -1.803 1.00 1.44 H new ATOM 1626 N LYS A 104 -9.549 -13.363 0.818 1.00 64.40 N ATOM 1627 CA LYS A 104 -10.585 -12.886 1.725 1.00 33.21 C ATOM 1628 C LYS A 104 -11.917 -13.568 1.428 1.00 45.02 C ATOM 1629 O LYS A 104 -12.777 -13.678 2.301 1.00 71.43 O ATOM 1630 CB LYS A 104 -10.738 -11.367 1.608 1.00 72.34 C ATOM 1631 CG LYS A 104 -9.427 -10.606 1.741 1.00 21.21 C ATOM 1632 CD LYS A 104 -8.742 -10.896 3.067 1.00 22.22 C ATOM 1633 CE LYS A 104 -8.833 -9.711 4.014 1.00 40.30 C ATOM 1634 NZ LYS A 104 -9.428 -10.091 5.325 1.00 34.42 N ATOM 0 H LYS A 104 -9.117 -12.634 0.251 1.00 64.40 H new ATOM 0 HA LYS A 104 -10.286 -13.134 2.743 1.00 33.21 H new ATOM 0 HB2 LYS A 104 -11.189 -11.130 0.644 1.00 72.34 H new ATOM 0 HB3 LYS A 104 -11.428 -11.020 2.377 1.00 72.34 H new ATOM 0 HG2 LYS A 104 -8.763 -10.879 0.921 1.00 21.21 H new ATOM 0 HG3 LYS A 104 -9.617 -9.536 1.655 1.00 21.21 H new ATOM 0 HD2 LYS A 104 -9.201 -11.769 3.531 1.00 22.22 H new ATOM 0 HD3 LYS A 104 -7.695 -11.142 2.890 1.00 22.22 H new ATOM 0 HE2 LYS A 104 -7.837 -9.297 4.174 1.00 40.30 H new ATOM 0 HE3 LYS A 104 -9.435 -8.926 3.556 1.00 40.30 H new ATOM 0 HZ1 LYS A 104 -9.472 -9.255 5.942 1.00 34.42 H new ATOM 0 HZ2 LYS A 104 -10.388 -10.462 5.176 1.00 34.42 H new ATOM 0 HZ3 LYS A 104 -8.840 -10.822 5.774 1.00 34.42 H new ATOM 1648 N ASP A 105 -12.080 -14.026 0.189 1.00 15.24 N ATOM 1649 CA ASP A 105 -13.306 -14.700 -0.221 1.00 2.40 C ATOM 1650 C ASP A 105 -14.504 -13.764 -0.103 1.00 55.42 C ATOM 1651 O ASP A 105 -15.598 -14.183 0.274 1.00 3.14 O ATOM 1652 CB ASP A 105 -13.533 -15.951 0.631 1.00 21.03 C ATOM 1653 CG ASP A 105 -14.570 -16.882 0.031 1.00 51.12 C ATOM 1654 OD1 ASP A 105 -15.131 -16.543 -1.032 1.00 32.43 O ATOM 1655 OD2 ASP A 105 -14.820 -17.952 0.626 1.00 51.32 O ATOM 0 H ASP A 105 -11.378 -13.942 -0.547 1.00 15.24 H new ATOM 0 HA ASP A 105 -13.200 -14.995 -1.265 1.00 2.40 H new ATOM 0 HB2 ASP A 105 -12.590 -16.486 0.743 1.00 21.03 H new ATOM 0 HB3 ASP A 105 -13.851 -15.653 1.630 1.00 21.03 H new ATOM 1660 N SER A 106 -14.288 -12.493 -0.427 1.00 44.20 N ATOM 1661 CA SER A 106 -15.349 -11.497 -0.358 1.00 42.45 C ATOM 1662 C SER A 106 -14.968 -10.240 -1.133 1.00 13.13 C ATOM 1663 O SER A 106 -13.787 -9.970 -1.357 1.00 1.23 O ATOM 1664 CB SER A 106 -15.647 -11.141 1.100 1.00 33.53 C ATOM 1665 OG SER A 106 -16.654 -11.982 1.635 1.00 44.05 O ATOM 0 H SER A 106 -13.388 -12.130 -0.740 1.00 44.20 H new ATOM 0 HA SER A 106 -16.244 -11.923 -0.812 1.00 42.45 H new ATOM 0 HB2 SER A 106 -14.738 -11.235 1.694 1.00 33.53 H new ATOM 0 HB3 SER A 106 -15.965 -10.101 1.166 1.00 33.53 H new ATOM 0 HG SER A 106 -16.519 -12.898 1.315 1.00 44.05 H new ATOM 1671 N ASP A 107 -15.975 -9.474 -1.538 1.00 2.20 N ATOM 1672 CA ASP A 107 -15.747 -8.244 -2.286 1.00 41.33 C ATOM 1673 C ASP A 107 -15.495 -7.077 -1.338 1.00 64.24 C ATOM 1674 O ASP A 107 -14.605 -6.258 -1.569 1.00 2.21 O ATOM 1675 CB ASP A 107 -16.946 -7.938 -3.185 1.00 52.45 C ATOM 1676 CG ASP A 107 -18.229 -7.760 -2.398 1.00 2.55 C ATOM 1677 OD1 ASP A 107 -18.563 -8.658 -1.596 1.00 22.11 O ATOM 1678 OD2 ASP A 107 -18.900 -6.723 -2.583 1.00 53.44 O ATOM 0 H ASP A 107 -16.957 -9.684 -1.361 1.00 2.20 H new ATOM 0 HA ASP A 107 -14.864 -8.383 -2.910 1.00 41.33 H new ATOM 0 HB2 ASP A 107 -16.746 -7.032 -3.757 1.00 52.45 H new ATOM 0 HB3 ASP A 107 -17.073 -8.747 -3.904 1.00 52.45 H new ATOM 1683 N ASP A 108 -16.281 -7.010 -0.269 1.00 2.41 N ATOM 1684 CA ASP A 108 -16.140 -5.947 0.718 1.00 22.15 C ATOM 1685 C ASP A 108 -14.860 -6.130 1.526 1.00 65.14 C ATOM 1686 O ASP A 108 -14.848 -6.832 2.538 1.00 54.22 O ATOM 1687 CB ASP A 108 -17.350 -5.924 1.653 1.00 54.23 C ATOM 1688 CG ASP A 108 -18.626 -5.521 0.940 1.00 22.11 C ATOM 1689 OD1 ASP A 108 -18.548 -4.703 0.000 1.00 25.14 O ATOM 1690 OD2 ASP A 108 -19.704 -6.025 1.321 1.00 24.14 O ATOM 0 H ASP A 108 -17.023 -7.680 -0.064 1.00 2.41 H new ATOM 0 HA ASP A 108 -16.085 -4.996 0.189 1.00 22.15 H new ATOM 0 HB2 ASP A 108 -17.481 -6.911 2.096 1.00 54.23 H new ATOM 0 HB3 ASP A 108 -17.160 -5.230 2.471 1.00 54.23 H new ATOM 1695 N VAL A 109 -13.785 -5.495 1.074 1.00 4.20 N ATOM 1696 CA VAL A 109 -12.503 -5.584 1.750 1.00 25.44 C ATOM 1697 C VAL A 109 -11.930 -4.193 2.010 1.00 31.21 C ATOM 1698 O VAL A 109 -11.973 -3.320 1.144 1.00 31.31 O ATOM 1699 CB VAL A 109 -11.488 -6.409 0.933 1.00 54.35 C ATOM 1700 CG1 VAL A 109 -10.174 -6.548 1.688 1.00 14.34 C ATOM 1701 CG2 VAL A 109 -12.063 -7.776 0.598 1.00 2.12 C ATOM 0 H VAL A 109 -13.780 -4.911 0.238 1.00 4.20 H new ATOM 0 HA VAL A 109 -12.677 -6.088 2.701 1.00 25.44 H new ATOM 0 HB VAL A 109 -11.288 -5.882 0.000 1.00 54.35 H new ATOM 0 HG11 VAL A 109 -9.473 -7.133 1.093 1.00 14.34 H new ATOM 0 HG12 VAL A 109 -9.755 -5.559 1.874 1.00 14.34 H new ATOM 0 HG13 VAL A 109 -10.352 -7.051 2.638 1.00 14.34 H new ATOM 0 HG21 VAL A 109 -11.334 -8.346 0.021 1.00 2.12 H new ATOM 0 HG22 VAL A 109 -12.293 -8.310 1.520 1.00 2.12 H new ATOM 0 HG23 VAL A 109 -12.974 -7.654 0.012 1.00 2.12 H new ATOM 1711 N PRO A 110 -11.391 -3.971 3.216 1.00 72.55 N ATOM 1712 CA PRO A 110 -10.811 -2.684 3.603 1.00 62.04 C ATOM 1713 C PRO A 110 -9.452 -2.439 2.956 1.00 73.04 C ATOM 1714 O PRO A 110 -8.434 -2.967 3.404 1.00 2.13 O ATOM 1715 CB PRO A 110 -10.666 -2.808 5.120 1.00 4.43 C ATOM 1716 CG PRO A 110 -10.508 -4.270 5.365 1.00 24.00 C ATOM 1717 CD PRO A 110 -11.313 -4.965 4.299 1.00 21.21 C ATOM 0 HA PRO A 110 -11.430 -1.845 3.285 1.00 62.04 H new ATOM 0 HB2 PRO A 110 -9.803 -2.250 5.483 1.00 4.43 H new ATOM 0 HB3 PRO A 110 -11.541 -2.412 5.635 1.00 4.43 H new ATOM 0 HG2 PRO A 110 -9.459 -4.562 5.313 1.00 24.00 H new ATOM 0 HG3 PRO A 110 -10.865 -4.539 6.359 1.00 24.00 H new ATOM 0 HD2 PRO A 110 -10.828 -5.883 3.966 1.00 21.21 H new ATOM 0 HD3 PRO A 110 -12.303 -5.241 4.661 1.00 21.21 H new ATOM 1725 N MET A 111 -9.444 -1.631 1.901 1.00 43.35 N ATOM 1726 CA MET A 111 -8.211 -1.310 1.193 1.00 74.11 C ATOM 1727 C MET A 111 -8.244 0.119 0.665 1.00 62.53 C ATOM 1728 O MET A 111 -9.292 0.765 0.659 1.00 63.31 O ATOM 1729 CB MET A 111 -7.987 -2.286 0.036 1.00 53.42 C ATOM 1730 CG MET A 111 -9.039 -2.187 -1.058 1.00 22.42 C ATOM 1731 SD MET A 111 -10.142 -3.611 -1.095 1.00 24.14 S ATOM 1732 CE MET A 111 -9.056 -4.845 -1.798 1.00 2.15 C ATOM 0 H MET A 111 -10.278 -1.187 1.518 1.00 43.35 H new ATOM 0 HA MET A 111 -7.386 -1.401 1.899 1.00 74.11 H new ATOM 0 HB2 MET A 111 -7.005 -2.101 -0.399 1.00 53.42 H new ATOM 0 HB3 MET A 111 -7.976 -3.303 0.427 1.00 53.42 H new ATOM 0 HG2 MET A 111 -9.627 -1.281 -0.910 1.00 22.42 H new ATOM 0 HG3 MET A 111 -8.544 -2.091 -2.024 1.00 22.42 H new ATOM 0 HE1 MET A 111 -9.651 -5.632 -2.261 1.00 2.15 H new ATOM 0 HE2 MET A 111 -8.418 -4.382 -2.551 1.00 2.15 H new ATOM 0 HE3 MET A 111 -8.435 -5.274 -1.011 1.00 2.15 H new ATOM 1742 N VAL A 112 -7.091 0.605 0.219 1.00 62.35 N ATOM 1743 CA VAL A 112 -6.989 1.956 -0.313 1.00 15.30 C ATOM 1744 C VAL A 112 -6.018 2.011 -1.486 1.00 34.41 C ATOM 1745 O VAL A 112 -5.074 1.224 -1.562 1.00 43.34 O ATOM 1746 CB VAL A 112 -6.528 2.952 0.766 1.00 2.22 C ATOM 1747 CG1 VAL A 112 -6.599 4.379 0.243 1.00 70.21 C ATOM 1748 CG2 VAL A 112 -7.365 2.797 2.026 1.00 5.11 C ATOM 0 H VAL A 112 -6.215 0.083 0.216 1.00 62.35 H new ATOM 0 HA VAL A 112 -7.985 2.238 -0.654 1.00 15.30 H new ATOM 0 HB VAL A 112 -5.490 2.733 1.016 1.00 2.22 H new ATOM 0 HG11 VAL A 112 -6.269 5.068 1.020 1.00 70.21 H new ATOM 0 HG12 VAL A 112 -5.953 4.479 -0.629 1.00 70.21 H new ATOM 0 HG13 VAL A 112 -7.626 4.613 -0.037 1.00 70.21 H new ATOM 0 HG21 VAL A 112 -7.025 3.509 2.778 1.00 5.11 H new ATOM 0 HG22 VAL A 112 -8.413 2.988 1.793 1.00 5.11 H new ATOM 0 HG23 VAL A 112 -7.258 1.783 2.411 1.00 5.11 H new ATOM 1758 N LEU A 113 -6.256 2.945 -2.400 1.00 3.34 N ATOM 1759 CA LEU A 113 -5.402 3.103 -3.569 1.00 63.43 C ATOM 1760 C LEU A 113 -4.599 4.396 -3.487 1.00 61.02 C ATOM 1761 O LEU A 113 -5.157 5.474 -3.284 1.00 63.02 O ATOM 1762 CB LEU A 113 -6.243 3.092 -4.848 1.00 41.05 C ATOM 1763 CG LEU A 113 -5.459 3.308 -6.145 1.00 64.50 C ATOM 1764 CD1 LEU A 113 -4.156 2.522 -6.123 1.00 32.15 C ATOM 1765 CD2 LEU A 113 -6.302 2.910 -7.346 1.00 11.22 C ATOM 0 H LEU A 113 -7.033 3.604 -2.353 1.00 3.34 H new ATOM 0 HA LEU A 113 -4.705 2.265 -3.593 1.00 63.43 H new ATOM 0 HB2 LEU A 113 -6.765 2.137 -4.912 1.00 41.05 H new ATOM 0 HB3 LEU A 113 -7.005 3.867 -4.769 1.00 41.05 H new ATOM 0 HG LEU A 113 -5.217 4.367 -6.228 1.00 64.50 H new ATOM 0 HD11 LEU A 113 -3.614 2.689 -7.054 1.00 32.15 H new ATOM 0 HD12 LEU A 113 -3.545 2.853 -5.283 1.00 32.15 H new ATOM 0 HD13 LEU A 113 -4.374 1.459 -6.016 1.00 32.15 H new ATOM 0 HD21 LEU A 113 -5.731 3.069 -8.260 1.00 11.22 H new ATOM 0 HD22 LEU A 113 -6.574 1.857 -7.267 1.00 11.22 H new ATOM 0 HD23 LEU A 113 -7.207 3.517 -7.373 1.00 11.22 H new ATOM 1777 N VAL A 114 -3.285 4.280 -3.644 1.00 71.04 N ATOM 1778 CA VAL A 114 -2.403 5.433 -3.586 1.00 14.31 C ATOM 1779 C VAL A 114 -1.632 5.600 -4.891 1.00 34.20 C ATOM 1780 O VAL A 114 -1.145 4.627 -5.465 1.00 33.35 O ATOM 1781 CB VAL A 114 -1.404 5.304 -2.424 1.00 25.23 C ATOM 1782 CG1 VAL A 114 -0.596 6.579 -2.275 1.00 10.31 C ATOM 1783 CG2 VAL A 114 -2.132 4.969 -1.132 1.00 51.22 C ATOM 0 H VAL A 114 -2.809 3.394 -3.813 1.00 71.04 H new ATOM 0 HA VAL A 114 -3.029 6.311 -3.426 1.00 14.31 H new ATOM 0 HB VAL A 114 -0.715 4.489 -2.647 1.00 25.23 H new ATOM 0 HG11 VAL A 114 0.106 6.470 -1.448 1.00 10.31 H new ATOM 0 HG12 VAL A 114 -0.045 6.770 -3.196 1.00 10.31 H new ATOM 0 HG13 VAL A 114 -1.267 7.414 -2.074 1.00 10.31 H new ATOM 0 HG21 VAL A 114 -1.410 4.881 -0.320 1.00 51.22 H new ATOM 0 HG22 VAL A 114 -2.845 5.761 -0.900 1.00 51.22 H new ATOM 0 HG23 VAL A 114 -2.664 4.025 -1.248 1.00 51.22 H new ATOM 1793 N GLY A 115 -1.524 6.841 -5.354 1.00 2.21 N ATOM 1794 CA GLY A 115 -0.811 7.112 -6.587 1.00 65.23 C ATOM 1795 C GLY A 115 0.573 7.680 -6.344 1.00 63.42 C ATOM 1796 O GLY A 115 0.786 8.887 -6.462 1.00 23.32 O ATOM 0 H GLY A 115 -1.918 7.663 -4.897 1.00 2.21 H new ATOM 0 HA2 GLY A 115 -0.726 6.191 -7.164 1.00 65.23 H new ATOM 0 HA3 GLY A 115 -1.388 7.814 -7.190 1.00 65.23 H new ATOM 1800 N ASN A 116 1.519 6.808 -6.005 1.00 74.31 N ATOM 1801 CA ASN A 116 2.893 7.230 -5.744 1.00 42.21 C ATOM 1802 C ASN A 116 3.440 8.056 -6.904 1.00 55.24 C ATOM 1803 O ASN A 116 2.818 8.146 -7.963 1.00 33.35 O ATOM 1804 CB ASN A 116 3.785 6.009 -5.511 1.00 50.23 C ATOM 1805 CG ASN A 116 4.858 6.265 -4.471 1.00 3.43 C ATOM 1806 OD1 ASN A 116 4.958 7.363 -3.922 1.00 13.13 O ATOM 1807 ND2 ASN A 116 5.668 5.249 -4.195 1.00 4.54 N ATOM 0 H ASN A 116 1.360 5.806 -5.905 1.00 74.31 H new ATOM 0 HA ASN A 116 2.892 7.851 -4.848 1.00 42.21 H new ATOM 0 HB2 ASN A 116 3.169 5.168 -5.193 1.00 50.23 H new ATOM 0 HB3 ASN A 116 4.256 5.722 -6.451 1.00 50.23 H new ATOM 0 HD21 ASN A 116 6.410 5.361 -3.504 1.00 4.54 H new ATOM 0 HD22 ASN A 116 5.548 4.357 -4.674 1.00 4.54 H new ATOM 1814 N LYS A 117 4.607 8.657 -6.698 1.00 60.24 N ATOM 1815 CA LYS A 117 5.237 9.475 -7.728 1.00 62.12 C ATOM 1816 C LYS A 117 4.359 10.671 -8.086 1.00 10.34 C ATOM 1817 O LYS A 117 4.098 10.934 -9.260 1.00 71.14 O ATOM 1818 CB LYS A 117 5.513 8.634 -8.977 1.00 3.31 C ATOM 1819 CG LYS A 117 6.166 7.295 -8.676 1.00 63.13 C ATOM 1820 CD LYS A 117 6.952 6.778 -9.870 1.00 24.42 C ATOM 1821 CE LYS A 117 8.311 7.450 -9.975 1.00 22.34 C ATOM 1822 NZ LYS A 117 9.277 6.632 -10.758 1.00 24.01 N ATOM 0 H LYS A 117 5.135 8.593 -5.828 1.00 60.24 H new ATOM 0 HA LYS A 117 6.182 9.848 -7.334 1.00 62.12 H new ATOM 0 HB2 LYS A 117 4.574 8.461 -9.503 1.00 3.31 H new ATOM 0 HB3 LYS A 117 6.157 9.200 -9.651 1.00 3.31 H new ATOM 0 HG2 LYS A 117 6.831 7.398 -7.818 1.00 63.13 H new ATOM 0 HG3 LYS A 117 5.401 6.569 -8.401 1.00 63.13 H new ATOM 0 HD2 LYS A 117 7.084 5.700 -9.781 1.00 24.42 H new ATOM 0 HD3 LYS A 117 6.386 6.955 -10.784 1.00 24.42 H new ATOM 0 HE2 LYS A 117 8.197 8.427 -10.446 1.00 22.34 H new ATOM 0 HE3 LYS A 117 8.709 7.622 -8.975 1.00 22.34 H new ATOM 0 HZ1 LYS A 117 10.191 7.126 -10.806 1.00 24.01 H new ATOM 0 HZ2 LYS A 117 9.406 5.709 -10.296 1.00 24.01 H new ATOM 0 HZ3 LYS A 117 8.910 6.489 -11.721 1.00 24.01 H new ATOM 1836 N CYS A 118 3.906 11.393 -7.065 1.00 21.50 N ATOM 1837 CA CYS A 118 3.057 12.562 -7.272 1.00 12.20 C ATOM 1838 C CYS A 118 3.890 13.826 -7.485 1.00 14.52 C ATOM 1839 O CYS A 118 3.347 14.927 -7.570 1.00 11.21 O ATOM 1840 CB CYS A 118 2.120 12.752 -6.078 1.00 12.41 C ATOM 1841 SG CYS A 118 0.695 13.810 -6.420 1.00 52.14 S ATOM 0 H CYS A 118 4.112 11.189 -6.087 1.00 21.50 H new ATOM 0 HA CYS A 118 2.466 12.390 -8.172 1.00 12.20 H new ATOM 0 HB2 CYS A 118 1.764 11.775 -5.750 1.00 12.41 H new ATOM 0 HB3 CYS A 118 2.686 13.179 -5.250 1.00 12.41 H new ATOM 0 HG CYS A 118 1.069 14.820 -7.148 1.00 52.14 H new ATOM 1847 N ASP A 119 5.209 13.665 -7.572 1.00 2.40 N ATOM 1848 CA ASP A 119 6.105 14.798 -7.776 1.00 64.22 C ATOM 1849 C ASP A 119 6.720 14.768 -9.174 1.00 44.11 C ATOM 1850 O ASP A 119 7.230 15.778 -9.658 1.00 12.12 O ATOM 1851 CB ASP A 119 7.212 14.796 -6.719 1.00 21.24 C ATOM 1852 CG ASP A 119 8.103 13.572 -6.815 1.00 5.35 C ATOM 1853 OD1 ASP A 119 7.612 12.457 -6.540 1.00 51.15 O ATOM 1854 OD2 ASP A 119 9.291 13.729 -7.167 1.00 73.04 O ATOM 0 H ASP A 119 5.679 12.762 -7.504 1.00 2.40 H new ATOM 0 HA ASP A 119 5.519 15.712 -7.679 1.00 64.22 H new ATOM 0 HB2 ASP A 119 7.820 15.694 -6.832 1.00 21.24 H new ATOM 0 HB3 ASP A 119 6.763 14.838 -5.727 1.00 21.24 H new ATOM 1859 N LEU A 120 6.668 13.604 -9.819 1.00 74.01 N ATOM 1860 CA LEU A 120 7.220 13.444 -11.161 1.00 32.02 C ATOM 1861 C LEU A 120 6.651 14.491 -12.115 1.00 53.31 C ATOM 1862 O LEU A 120 5.744 15.243 -11.757 1.00 44.31 O ATOM 1863 CB LEU A 120 6.923 12.039 -11.689 1.00 54.45 C ATOM 1864 CG LEU A 120 7.834 10.932 -11.150 1.00 3.44 C ATOM 1865 CD1 LEU A 120 9.227 11.049 -11.746 1.00 11.42 C ATOM 1866 CD2 LEU A 120 7.897 10.982 -9.630 1.00 21.23 C ATOM 0 H LEU A 120 6.249 12.758 -9.433 1.00 74.01 H new ATOM 0 HA LEU A 120 8.299 13.584 -11.103 1.00 32.02 H new ATOM 0 HB2 LEU A 120 5.891 11.788 -11.446 1.00 54.45 H new ATOM 0 HB3 LEU A 120 7.000 12.053 -12.776 1.00 54.45 H new ATOM 0 HG LEU A 120 7.414 9.970 -11.444 1.00 3.44 H new ATOM 0 HD11 LEU A 120 9.860 10.254 -11.351 1.00 11.42 H new ATOM 0 HD12 LEU A 120 9.167 10.960 -12.831 1.00 11.42 H new ATOM 0 HD13 LEU A 120 9.655 12.017 -11.484 1.00 11.42 H new ATOM 0 HD21 LEU A 120 8.549 10.188 -9.267 1.00 21.23 H new ATOM 0 HD22 LEU A 120 8.291 11.948 -9.314 1.00 21.23 H new ATOM 0 HD23 LEU A 120 6.896 10.846 -9.220 1.00 21.23 H new ATOM 1878 N ALA A 121 7.189 14.534 -13.330 1.00 61.23 N ATOM 1879 CA ALA A 121 6.735 15.490 -14.333 1.00 12.42 C ATOM 1880 C ALA A 121 6.211 14.777 -15.576 1.00 42.02 C ATOM 1881 O ALA A 121 6.472 15.198 -16.703 1.00 15.53 O ATOM 1882 CB ALA A 121 7.863 16.440 -14.704 1.00 51.35 C ATOM 0 H ALA A 121 7.939 13.918 -13.643 1.00 61.23 H new ATOM 0 HA ALA A 121 5.915 16.066 -13.904 1.00 12.42 H new ATOM 0 HB1 ALA A 121 7.510 17.148 -15.454 1.00 51.35 H new ATOM 0 HB2 ALA A 121 8.188 16.983 -13.816 1.00 51.35 H new ATOM 0 HB3 ALA A 121 8.700 15.871 -15.108 1.00 51.35 H new ATOM 1888 N ALA A 122 5.468 13.696 -15.362 1.00 62.54 N ATOM 1889 CA ALA A 122 4.906 12.925 -16.465 1.00 43.12 C ATOM 1890 C ALA A 122 3.847 11.949 -15.965 1.00 34.35 C ATOM 1891 O ALA A 122 4.010 10.733 -16.064 1.00 54.34 O ATOM 1892 CB ALA A 122 6.009 12.182 -17.204 1.00 71.31 C ATOM 0 H ALA A 122 5.241 13.334 -14.436 1.00 62.54 H new ATOM 0 HA ALA A 122 4.426 13.618 -17.156 1.00 43.12 H new ATOM 0 HB1 ALA A 122 5.576 11.610 -18.025 1.00 71.31 H new ATOM 0 HB2 ALA A 122 6.728 12.899 -17.601 1.00 71.31 H new ATOM 0 HB3 ALA A 122 6.514 11.504 -16.517 1.00 71.31 H new ATOM 1898 N ARG A 123 2.760 12.490 -15.425 1.00 33.12 N ATOM 1899 CA ARG A 123 1.673 11.669 -14.907 1.00 50.30 C ATOM 1900 C ARG A 123 0.891 11.018 -16.042 1.00 45.32 C ATOM 1901 O ARG A 123 -0.139 11.534 -16.475 1.00 53.31 O ATOM 1902 CB ARG A 123 0.732 12.518 -14.052 1.00 11.04 C ATOM 1903 CG ARG A 123 0.248 13.774 -14.755 1.00 32.44 C ATOM 1904 CD ARG A 123 -1.225 14.033 -14.488 1.00 31.22 C ATOM 1905 NE ARG A 123 -1.486 14.309 -13.077 1.00 31.04 N ATOM 1906 CZ ARG A 123 -2.646 14.766 -12.613 1.00 44.41 C ATOM 1907 NH1 ARG A 123 -3.655 14.999 -13.444 1.00 41.23 N ATOM 1908 NH2 ARG A 123 -2.799 14.991 -11.316 1.00 55.34 N ATOM 0 H ARG A 123 2.609 13.495 -15.335 1.00 33.12 H new ATOM 0 HA ARG A 123 2.109 10.882 -14.292 1.00 50.30 H new ATOM 0 HB2 ARG A 123 -0.130 11.915 -13.766 1.00 11.04 H new ATOM 0 HB3 ARG A 123 1.244 12.800 -13.132 1.00 11.04 H new ATOM 0 HG2 ARG A 123 0.835 14.629 -14.419 1.00 32.44 H new ATOM 0 HG3 ARG A 123 0.412 13.677 -15.828 1.00 32.44 H new ATOM 0 HD2 ARG A 123 -1.559 14.878 -15.090 1.00 31.22 H new ATOM 0 HD3 ARG A 123 -1.808 13.167 -14.802 1.00 31.22 H new ATOM 0 HE ARG A 123 -0.734 14.141 -12.408 1.00 31.04 H new ATOM 0 HH11 ARG A 123 -3.543 14.828 -14.443 1.00 41.23 H new ATOM 0 HH12 ARG A 123 -4.542 15.349 -13.083 1.00 41.23 H new ATOM 0 HH21 ARG A 123 -2.027 14.814 -10.673 1.00 55.34 H new ATOM 0 HH22 ARG A 123 -3.689 15.341 -10.961 1.00 55.34 H new ATOM 1922 N THR A 124 1.384 9.880 -16.517 1.00 5.22 N ATOM 1923 CA THR A 124 0.726 9.158 -17.600 1.00 1.14 C ATOM 1924 C THR A 124 -0.686 8.747 -17.195 1.00 54.03 C ATOM 1925 O THR A 124 -1.570 8.609 -18.041 1.00 51.40 O ATOM 1926 CB THR A 124 1.539 7.921 -17.984 1.00 24.34 C ATOM 1927 OG1 THR A 124 1.427 6.917 -16.990 1.00 55.52 O ATOM 1928 CG2 THR A 124 3.012 8.210 -18.179 1.00 52.43 C ATOM 0 H THR A 124 2.235 9.438 -16.170 1.00 5.22 H new ATOM 0 HA THR A 124 0.661 9.822 -18.462 1.00 1.14 H new ATOM 0 HB THR A 124 1.121 7.585 -18.933 1.00 24.34 H new ATOM 0 HG1 THR A 124 1.450 7.331 -16.102 1.00 55.52 H new ATOM 0 HG21 THR A 124 3.531 7.290 -18.450 1.00 52.43 H new ATOM 0 HG22 THR A 124 3.136 8.944 -18.975 1.00 52.43 H new ATOM 0 HG23 THR A 124 3.431 8.604 -17.253 1.00 52.43 H new ATOM 1936 N VAL A 125 -0.890 8.553 -15.896 1.00 54.00 N ATOM 1937 CA VAL A 125 -2.186 8.158 -15.373 1.00 34.13 C ATOM 1938 C VAL A 125 -2.833 9.303 -14.598 1.00 22.02 C ATOM 1939 O VAL A 125 -2.618 9.451 -13.395 1.00 43.12 O ATOM 1940 CB VAL A 125 -2.053 6.931 -14.452 1.00 23.43 C ATOM 1941 CG1 VAL A 125 -3.403 6.537 -13.883 1.00 71.45 C ATOM 1942 CG2 VAL A 125 -1.424 5.768 -15.202 1.00 70.02 C ATOM 0 H VAL A 125 -0.167 8.665 -15.185 1.00 54.00 H new ATOM 0 HA VAL A 125 -2.818 7.901 -16.223 1.00 34.13 H new ATOM 0 HB VAL A 125 -1.400 7.196 -13.620 1.00 23.43 H new ATOM 0 HG11 VAL A 125 -3.285 5.668 -13.235 1.00 71.45 H new ATOM 0 HG12 VAL A 125 -3.811 7.367 -13.306 1.00 71.45 H new ATOM 0 HG13 VAL A 125 -4.084 6.292 -14.698 1.00 71.45 H new ATOM 0 HG21 VAL A 125 -1.338 4.910 -14.536 1.00 70.02 H new ATOM 0 HG22 VAL A 125 -2.049 5.504 -16.055 1.00 70.02 H new ATOM 0 HG23 VAL A 125 -0.433 6.055 -15.554 1.00 70.02 H new ATOM 1952 N GLU A 126 -3.625 10.111 -15.295 1.00 35.45 N ATOM 1953 CA GLU A 126 -4.302 11.241 -14.671 1.00 13.11 C ATOM 1954 C GLU A 126 -5.219 10.772 -13.546 1.00 1.05 C ATOM 1955 O GLU A 126 -5.524 9.584 -13.435 1.00 43.15 O ATOM 1956 CB GLU A 126 -5.109 12.018 -15.712 1.00 63.52 C ATOM 1957 CG GLU A 126 -6.034 11.142 -16.542 1.00 33.31 C ATOM 1958 CD GLU A 126 -7.012 11.949 -17.373 1.00 44.42 C ATOM 1959 OE1 GLU A 126 -7.179 13.155 -17.091 1.00 62.11 O ATOM 1960 OE2 GLU A 126 -7.613 11.375 -18.305 1.00 21.11 O ATOM 0 H GLU A 126 -3.814 10.004 -16.292 1.00 35.45 H new ATOM 0 HA GLU A 126 -3.543 11.898 -14.247 1.00 13.11 H new ATOM 0 HB2 GLU A 126 -5.701 12.780 -15.206 1.00 63.52 H new ATOM 0 HB3 GLU A 126 -4.421 12.539 -16.378 1.00 63.52 H new ATOM 0 HG2 GLU A 126 -5.437 10.512 -17.201 1.00 33.31 H new ATOM 0 HG3 GLU A 126 -6.588 10.476 -15.880 1.00 33.31 H new ATOM 1967 N SER A 127 -5.656 11.712 -12.713 1.00 34.21 N ATOM 1968 CA SER A 127 -6.539 11.394 -11.596 1.00 40.14 C ATOM 1969 C SER A 127 -7.818 10.716 -12.081 1.00 75.11 C ATOM 1970 O SER A 127 -8.459 9.976 -11.335 1.00 53.22 O ATOM 1971 CB SER A 127 -6.886 12.664 -10.817 1.00 33.24 C ATOM 1972 OG SER A 127 -5.725 13.433 -10.552 1.00 41.53 O ATOM 0 H SER A 127 -5.413 12.700 -12.790 1.00 34.21 H new ATOM 0 HA SER A 127 -6.013 10.702 -10.938 1.00 40.14 H new ATOM 0 HB2 SER A 127 -7.599 13.260 -11.386 1.00 33.24 H new ATOM 0 HB3 SER A 127 -7.372 12.397 -9.878 1.00 33.24 H new ATOM 0 HG SER A 127 -5.974 14.240 -10.055 1.00 41.53 H new ATOM 1978 N ARG A 128 -8.184 10.974 -13.332 1.00 22.24 N ATOM 1979 CA ARG A 128 -9.387 10.388 -13.913 1.00 35.12 C ATOM 1980 C ARG A 128 -9.282 8.868 -13.965 1.00 42.23 C ATOM 1981 O ARG A 128 -10.131 8.157 -13.427 1.00 44.32 O ATOM 1982 CB ARG A 128 -9.624 10.941 -15.320 1.00 62.11 C ATOM 1983 CG ARG A 128 -9.469 12.450 -15.421 1.00 63.51 C ATOM 1984 CD ARG A 128 -10.333 13.171 -14.399 1.00 21.32 C ATOM 1985 NE ARG A 128 -11.759 12.962 -14.641 1.00 52.54 N ATOM 1986 CZ ARG A 128 -12.722 13.675 -14.062 1.00 45.14 C ATOM 1987 NH1 ARG A 128 -12.417 14.641 -13.205 1.00 2.25 N ATOM 1988 NH2 ARG A 128 -13.993 13.420 -14.340 1.00 41.15 N ATOM 0 H ARG A 128 -7.665 11.585 -13.963 1.00 22.24 H new ATOM 0 HA ARG A 128 -10.232 10.656 -13.278 1.00 35.12 H new ATOM 0 HB2 ARG A 128 -8.925 10.467 -16.009 1.00 62.11 H new ATOM 0 HB3 ARG A 128 -10.628 10.666 -15.644 1.00 62.11 H new ATOM 0 HG2 ARG A 128 -8.424 12.720 -15.270 1.00 63.51 H new ATOM 0 HG3 ARG A 128 -9.741 12.778 -16.424 1.00 63.51 H new ATOM 0 HD2 ARG A 128 -10.080 12.820 -13.399 1.00 21.32 H new ATOM 0 HD3 ARG A 128 -10.113 14.238 -14.427 1.00 21.32 H new ATOM 0 HE ARG A 128 -12.032 12.226 -15.292 1.00 52.54 H new ATOM 0 HH11 ARG A 128 -11.441 14.840 -12.987 1.00 2.25 H new ATOM 0 HH12 ARG A 128 -13.159 15.185 -12.764 1.00 2.25 H new ATOM 0 HH21 ARG A 128 -14.232 12.678 -14.997 1.00 41.15 H new ATOM 0 HH22 ARG A 128 -14.732 13.966 -13.897 1.00 41.15 H new ATOM 2002 N GLN A 129 -8.235 8.375 -14.618 1.00 74.40 N ATOM 2003 CA GLN A 129 -8.017 6.939 -14.745 1.00 14.32 C ATOM 2004 C GLN A 129 -7.892 6.280 -13.375 1.00 52.43 C ATOM 2005 O GLN A 129 -8.392 5.177 -13.158 1.00 42.10 O ATOM 2006 CB GLN A 129 -6.758 6.667 -15.571 1.00 34.35 C ATOM 2007 CG GLN A 129 -6.703 7.452 -16.872 1.00 24.23 C ATOM 2008 CD GLN A 129 -6.237 6.609 -18.043 1.00 21.02 C ATOM 2009 OE1 GLN A 129 -7.024 6.256 -18.921 1.00 25.03 O ATOM 2010 NE2 GLN A 129 -4.950 6.281 -18.060 1.00 75.04 N ATOM 0 H GLN A 129 -7.523 8.950 -15.068 1.00 74.40 H new ATOM 0 HA GLN A 129 -8.880 6.510 -15.254 1.00 14.32 H new ATOM 0 HB2 GLN A 129 -5.881 6.911 -14.972 1.00 34.35 H new ATOM 0 HB3 GLN A 129 -6.704 5.602 -15.796 1.00 34.35 H new ATOM 0 HG2 GLN A 129 -7.692 7.856 -17.090 1.00 24.23 H new ATOM 0 HG3 GLN A 129 -6.031 8.302 -16.751 1.00 24.23 H new ATOM 0 HE21 GLN A 129 -4.334 6.596 -17.311 1.00 75.04 H new ATOM 0 HE22 GLN A 129 -4.578 5.714 -18.822 1.00 75.04 H new ATOM 2019 N ALA A 130 -7.219 6.963 -12.455 1.00 71.15 N ATOM 2020 CA ALA A 130 -7.025 6.443 -11.106 1.00 73.23 C ATOM 2021 C ALA A 130 -8.346 6.365 -10.348 1.00 63.32 C ATOM 2022 O ALA A 130 -8.575 5.435 -9.575 1.00 53.15 O ATOM 2023 CB ALA A 130 -6.030 7.307 -10.348 1.00 2.13 C ATOM 0 H ALA A 130 -6.799 7.878 -12.619 1.00 71.15 H new ATOM 0 HA ALA A 130 -6.626 5.432 -11.188 1.00 73.23 H new ATOM 0 HB1 ALA A 130 -5.894 6.908 -9.343 1.00 2.13 H new ATOM 0 HB2 ALA A 130 -5.074 7.305 -10.871 1.00 2.13 H new ATOM 0 HB3 ALA A 130 -6.408 8.328 -10.286 1.00 2.13 H new ATOM 2029 N GLN A 131 -9.210 7.349 -10.572 1.00 73.12 N ATOM 2030 CA GLN A 131 -10.508 7.394 -9.907 1.00 42.44 C ATOM 2031 C GLN A 131 -11.437 6.309 -10.444 1.00 44.04 C ATOM 2032 O GLN A 131 -12.304 5.810 -9.725 1.00 40.14 O ATOM 2033 CB GLN A 131 -11.150 8.769 -10.092 1.00 74.14 C ATOM 2034 CG GLN A 131 -10.886 9.724 -8.939 1.00 15.02 C ATOM 2035 CD GLN A 131 -12.161 10.249 -8.310 1.00 33.12 C ATOM 2036 OE1 GLN A 131 -12.587 11.370 -8.586 1.00 52.32 O ATOM 2037 NE2 GLN A 131 -12.778 9.438 -7.459 1.00 31.21 N ATOM 0 H GLN A 131 -9.035 8.126 -11.209 1.00 73.12 H new ATOM 0 HA GLN A 131 -10.349 7.214 -8.844 1.00 42.44 H new ATOM 0 HB2 GLN A 131 -10.776 9.214 -11.014 1.00 74.14 H new ATOM 0 HB3 GLN A 131 -12.226 8.645 -10.211 1.00 74.14 H new ATOM 0 HG2 GLN A 131 -10.294 9.214 -8.179 1.00 15.02 H new ATOM 0 HG3 GLN A 131 -10.290 10.563 -9.297 1.00 15.02 H new ATOM 0 HE21 GLN A 131 -12.389 8.516 -7.260 1.00 31.21 H new ATOM 0 HE22 GLN A 131 -13.641 9.736 -7.005 1.00 31.21 H new ATOM 2046 N ASP A 132 -11.253 5.949 -11.710 1.00 42.43 N ATOM 2047 CA ASP A 132 -12.078 4.925 -12.343 1.00 72.13 C ATOM 2048 C ASP A 132 -12.086 3.641 -11.518 1.00 62.13 C ATOM 2049 O ASP A 132 -13.138 3.041 -11.295 1.00 62.21 O ATOM 2050 CB ASP A 132 -11.568 4.633 -13.756 1.00 45.31 C ATOM 2051 CG ASP A 132 -12.494 3.711 -14.528 1.00 64.45 C ATOM 2052 OD1 ASP A 132 -13.439 3.169 -13.917 1.00 55.41 O ATOM 2053 OD2 ASP A 132 -12.273 3.532 -15.744 1.00 43.53 O ATOM 0 H ASP A 132 -10.540 6.351 -12.318 1.00 42.43 H new ATOM 0 HA ASP A 132 -13.099 5.303 -12.401 1.00 72.13 H new ATOM 0 HB2 ASP A 132 -11.458 5.571 -14.300 1.00 45.31 H new ATOM 0 HB3 ASP A 132 -10.578 4.181 -13.696 1.00 45.31 H new ATOM 2058 N LEU A 133 -10.907 3.225 -11.069 1.00 45.53 N ATOM 2059 CA LEU A 133 -10.777 2.013 -10.271 1.00 65.22 C ATOM 2060 C LEU A 133 -11.289 2.231 -8.851 1.00 32.33 C ATOM 2061 O LEU A 133 -12.072 1.434 -8.334 1.00 45.43 O ATOM 2062 CB LEU A 133 -9.321 1.565 -10.238 1.00 42.12 C ATOM 2063 CG LEU A 133 -8.826 0.919 -11.529 1.00 42.21 C ATOM 2064 CD1 LEU A 133 -7.440 0.339 -11.327 1.00 13.34 C ATOM 2065 CD2 LEU A 133 -9.799 -0.157 -11.994 1.00 73.22 C ATOM 0 H LEU A 133 -10.027 3.710 -11.245 1.00 45.53 H new ATOM 0 HA LEU A 133 -11.384 1.235 -10.734 1.00 65.22 H new ATOM 0 HB2 LEU A 133 -8.694 2.428 -10.015 1.00 42.12 H new ATOM 0 HB3 LEU A 133 -9.191 0.857 -9.420 1.00 42.12 H new ATOM 0 HG LEU A 133 -8.770 1.684 -12.304 1.00 42.21 H new ATOM 0 HD11 LEU A 133 -7.098 -0.119 -12.255 1.00 13.34 H new ATOM 0 HD12 LEU A 133 -6.751 1.134 -11.039 1.00 13.34 H new ATOM 0 HD13 LEU A 133 -7.472 -0.415 -10.541 1.00 13.34 H new ATOM 0 HD21 LEU A 133 -9.430 -0.607 -12.916 1.00 73.22 H new ATOM 0 HD22 LEU A 133 -9.887 -0.925 -11.225 1.00 73.22 H new ATOM 0 HD23 LEU A 133 -10.777 0.290 -12.174 1.00 73.22 H new ATOM 2077 N ALA A 134 -10.843 3.316 -8.226 1.00 53.44 N ATOM 2078 CA ALA A 134 -11.256 3.639 -6.865 1.00 24.34 C ATOM 2079 C ALA A 134 -12.774 3.743 -6.763 1.00 32.25 C ATOM 2080 O ALA A 134 -13.372 3.308 -5.779 1.00 63.33 O ATOM 2081 CB ALA A 134 -10.604 4.936 -6.410 1.00 31.53 C ATOM 0 H ALA A 134 -10.196 3.986 -8.640 1.00 53.44 H new ATOM 0 HA ALA A 134 -10.928 2.832 -6.210 1.00 24.34 H new ATOM 0 HB1 ALA A 134 -10.921 5.165 -5.393 1.00 31.53 H new ATOM 0 HB2 ALA A 134 -9.520 4.827 -6.436 1.00 31.53 H new ATOM 0 HB3 ALA A 134 -10.903 5.746 -7.075 1.00 31.53 H new ATOM 2087 N ARG A 135 -13.392 4.322 -7.788 1.00 22.12 N ATOM 2088 CA ARG A 135 -14.840 4.481 -7.815 1.00 24.11 C ATOM 2089 C ARG A 135 -15.528 3.146 -8.081 1.00 23.33 C ATOM 2090 O ARG A 135 -16.515 2.804 -7.430 1.00 41.31 O ATOM 2091 CB ARG A 135 -15.242 5.500 -8.884 1.00 52.21 C ATOM 2092 CG ARG A 135 -16.744 5.706 -8.995 1.00 50.45 C ATOM 2093 CD ARG A 135 -17.081 6.903 -9.871 1.00 64.40 C ATOM 2094 NE ARG A 135 -18.167 6.611 -10.804 1.00 30.31 N ATOM 2095 CZ ARG A 135 -18.703 7.512 -11.623 1.00 64.14 C ATOM 2096 NH1 ARG A 135 -18.259 8.763 -11.627 1.00 33.12 N ATOM 2097 NH2 ARG A 135 -19.687 7.162 -12.440 1.00 54.10 N ATOM 0 H ARG A 135 -12.912 4.688 -8.610 1.00 22.12 H new ATOM 0 HA ARG A 135 -15.160 4.845 -6.839 1.00 24.11 H new ATOM 0 HB2 ARG A 135 -14.768 6.456 -8.659 1.00 52.21 H new ATOM 0 HB3 ARG A 135 -14.856 5.172 -9.849 1.00 52.21 H new ATOM 0 HG2 ARG A 135 -17.205 4.810 -9.409 1.00 50.45 H new ATOM 0 HG3 ARG A 135 -17.167 5.851 -8.001 1.00 50.45 H new ATOM 0 HD2 ARG A 135 -17.362 7.746 -9.240 1.00 64.40 H new ATOM 0 HD3 ARG A 135 -16.195 7.204 -10.429 1.00 64.40 H new ATOM 0 HE ARG A 135 -18.536 5.660 -10.829 1.00 30.31 H new ATOM 0 HH11 ARG A 135 -17.503 9.038 -11.000 1.00 33.12 H new ATOM 0 HH12 ARG A 135 -18.674 9.449 -12.257 1.00 33.12 H new ATOM 0 HH21 ARG A 135 -20.033 6.202 -12.440 1.00 54.10 H new ATOM 0 HH22 ARG A 135 -20.098 7.852 -13.068 1.00 54.10 H new ATOM 2111 N SER A 136 -14.999 2.395 -9.042 1.00 74.32 N ATOM 2112 CA SER A 136 -15.561 1.097 -9.394 1.00 0.25 C ATOM 2113 C SER A 136 -15.445 0.122 -8.227 1.00 14.32 C ATOM 2114 O SER A 136 -16.341 -0.689 -7.991 1.00 13.11 O ATOM 2115 CB SER A 136 -14.851 0.527 -10.623 1.00 73.13 C ATOM 2116 OG SER A 136 -15.446 -0.691 -11.037 1.00 61.42 O ATOM 0 H SER A 136 -14.182 2.664 -9.590 1.00 74.32 H new ATOM 0 HA SER A 136 -16.617 1.236 -9.626 1.00 0.25 H new ATOM 0 HB2 SER A 136 -14.891 1.250 -11.438 1.00 73.13 H new ATOM 0 HB3 SER A 136 -13.798 0.362 -10.395 1.00 73.13 H new ATOM 0 HG SER A 136 -14.975 -1.034 -11.825 1.00 61.42 H new ATOM 2122 N TYR A 137 -14.337 0.208 -7.500 1.00 2.05 N ATOM 2123 CA TYR A 137 -14.103 -0.664 -6.355 1.00 24.34 C ATOM 2124 C TYR A 137 -14.769 -0.110 -5.098 1.00 25.12 C ATOM 2125 O TYR A 137 -15.033 -0.847 -4.148 1.00 1.35 O ATOM 2126 CB TYR A 137 -12.602 -0.841 -6.118 1.00 44.12 C ATOM 2127 CG TYR A 137 -11.864 -1.431 -7.301 1.00 2.15 C ATOM 2128 CD1 TYR A 137 -12.440 -2.432 -8.075 1.00 53.10 C ATOM 2129 CD2 TYR A 137 -10.591 -0.989 -7.640 1.00 74.25 C ATOM 2130 CE1 TYR A 137 -11.768 -2.974 -9.154 1.00 12.44 C ATOM 2131 CE2 TYR A 137 -9.914 -1.527 -8.718 1.00 64.04 C ATOM 2132 CZ TYR A 137 -10.506 -2.519 -9.472 1.00 54.12 C ATOM 2133 OH TYR A 137 -9.834 -3.057 -10.545 1.00 21.11 O ATOM 0 H TYR A 137 -13.586 0.873 -7.683 1.00 2.05 H new ATOM 0 HA TYR A 137 -14.545 -1.635 -6.577 1.00 24.34 H new ATOM 0 HB2 TYR A 137 -12.165 0.127 -5.875 1.00 44.12 H new ATOM 0 HB3 TYR A 137 -12.454 -1.485 -5.251 1.00 44.12 H new ATOM 0 HD1 TYR A 137 -13.428 -2.792 -7.829 1.00 53.10 H new ATOM 0 HD2 TYR A 137 -10.123 -0.213 -7.052 1.00 74.25 H new ATOM 0 HE1 TYR A 137 -12.229 -3.751 -9.746 1.00 12.44 H new ATOM 0 HE2 TYR A 137 -8.925 -1.172 -8.969 1.00 64.04 H new ATOM 0 HH TYR A 137 -10.166 -3.963 -10.718 1.00 21.11 H new ATOM 2143 N GLY A 138 -15.039 1.193 -5.098 1.00 4.32 N ATOM 2144 CA GLY A 138 -15.672 1.819 -3.952 1.00 15.03 C ATOM 2145 C GLY A 138 -14.679 2.187 -2.867 1.00 60.31 C ATOM 2146 O GLY A 138 -15.061 2.412 -1.719 1.00 11.51 O ATOM 0 H GLY A 138 -14.831 1.825 -5.871 1.00 4.32 H new ATOM 0 HA2 GLY A 138 -16.198 2.716 -4.277 1.00 15.03 H new ATOM 0 HA3 GLY A 138 -16.421 1.142 -3.540 1.00 15.03 H new ATOM 2150 N ILE A 139 -13.400 2.250 -3.229 1.00 24.34 N ATOM 2151 CA ILE A 139 -12.354 2.594 -2.273 1.00 40.25 C ATOM 2152 C ILE A 139 -11.832 4.009 -2.502 1.00 21.22 C ATOM 2153 O ILE A 139 -11.944 4.552 -3.601 1.00 22.42 O ATOM 2154 CB ILE A 139 -11.177 1.614 -2.340 1.00 62.44 C ATOM 2155 CG1 ILE A 139 -10.816 1.310 -3.786 1.00 75.24 C ATOM 2156 CG2 ILE A 139 -11.515 0.334 -1.594 1.00 74.23 C ATOM 2157 CD1 ILE A 139 -9.579 0.464 -3.912 1.00 3.44 C ATOM 0 H ILE A 139 -13.065 2.068 -4.175 1.00 24.34 H new ATOM 0 HA ILE A 139 -12.811 2.533 -1.285 1.00 40.25 H new ATOM 0 HB ILE A 139 -10.313 2.076 -1.863 1.00 62.44 H new ATOM 0 HG12 ILE A 139 -11.651 0.798 -4.264 1.00 75.24 H new ATOM 0 HG13 ILE A 139 -10.666 2.247 -4.323 1.00 75.24 H new ATOM 0 HG21 ILE A 139 -10.671 -0.353 -1.649 1.00 74.23 H new ATOM 0 HG22 ILE A 139 -11.726 0.566 -0.550 1.00 74.23 H new ATOM 0 HG23 ILE A 139 -12.391 -0.130 -2.047 1.00 74.23 H new ATOM 0 HD11 ILE A 139 -9.370 0.279 -4.966 1.00 3.44 H new ATOM 0 HD12 ILE A 139 -8.735 0.985 -3.461 1.00 3.44 H new ATOM 0 HD13 ILE A 139 -9.734 -0.486 -3.401 1.00 3.44 H new ATOM 2169 N PRO A 140 -11.249 4.625 -1.460 1.00 73.42 N ATOM 2170 CA PRO A 140 -10.704 5.981 -1.549 1.00 1.35 C ATOM 2171 C PRO A 140 -9.399 6.027 -2.336 1.00 44.41 C ATOM 2172 O PRO A 140 -8.627 5.068 -2.332 1.00 43.32 O ATOM 2173 CB PRO A 140 -10.465 6.361 -0.088 1.00 73.51 C ATOM 2174 CG PRO A 140 -10.231 5.064 0.606 1.00 72.41 C ATOM 2175 CD PRO A 140 -11.073 4.044 -0.114 1.00 50.24 C ATOM 0 HA PRO A 140 -11.376 6.660 -2.074 1.00 1.35 H new ATOM 0 HB2 PRO A 140 -9.606 7.025 0.013 1.00 73.51 H new ATOM 0 HB3 PRO A 140 -11.324 6.885 0.331 1.00 73.51 H new ATOM 0 HG2 PRO A 140 -9.176 4.790 0.574 1.00 72.41 H new ATOM 0 HG3 PRO A 140 -10.512 5.129 1.657 1.00 72.41 H new ATOM 0 HD2 PRO A 140 -10.577 3.074 -0.158 1.00 50.24 H new ATOM 0 HD3 PRO A 140 -12.030 3.891 0.385 1.00 50.24 H new ATOM 2183 N TYR A 141 -9.158 7.146 -3.013 1.00 54.21 N ATOM 2184 CA TYR A 141 -7.946 7.312 -3.807 1.00 74.42 C ATOM 2185 C TYR A 141 -7.183 8.566 -3.386 1.00 54.43 C ATOM 2186 O TYR A 141 -7.733 9.668 -3.382 1.00 62.30 O ATOM 2187 CB TYR A 141 -8.294 7.383 -5.298 1.00 24.33 C ATOM 2188 CG TYR A 141 -7.142 7.823 -6.176 1.00 43.12 C ATOM 2189 CD1 TYR A 141 -5.899 7.211 -6.082 1.00 1.24 C ATOM 2190 CD2 TYR A 141 -7.299 8.852 -7.096 1.00 44.11 C ATOM 2191 CE1 TYR A 141 -4.844 7.612 -6.879 1.00 51.21 C ATOM 2192 CE2 TYR A 141 -6.249 9.259 -7.896 1.00 0.12 C ATOM 2193 CZ TYR A 141 -5.024 8.636 -7.784 1.00 55.05 C ATOM 2194 OH TYR A 141 -3.976 9.039 -8.579 1.00 44.34 O ATOM 0 H TYR A 141 -9.785 7.950 -3.027 1.00 54.21 H new ATOM 0 HA TYR A 141 -7.306 6.448 -3.632 1.00 74.42 H new ATOM 0 HB2 TYR A 141 -8.636 6.402 -5.628 1.00 24.33 H new ATOM 0 HB3 TYR A 141 -9.126 8.073 -5.434 1.00 24.33 H new ATOM 0 HD1 TYR A 141 -5.755 6.408 -5.374 1.00 1.24 H new ATOM 0 HD2 TYR A 141 -8.257 9.342 -7.187 1.00 44.11 H new ATOM 0 HE1 TYR A 141 -3.883 7.126 -6.793 1.00 51.21 H new ATOM 0 HE2 TYR A 141 -6.387 10.061 -8.606 1.00 0.12 H new ATOM 0 HH TYR A 141 -4.270 9.770 -9.162 1.00 44.34 H new ATOM 2204 N ILE A 142 -5.913 8.389 -3.037 1.00 24.34 N ATOM 2205 CA ILE A 142 -5.071 9.497 -2.619 1.00 33.43 C ATOM 2206 C ILE A 142 -3.801 9.562 -3.463 1.00 74.43 C ATOM 2207 O ILE A 142 -3.367 8.558 -4.027 1.00 43.23 O ATOM 2208 CB ILE A 142 -4.685 9.368 -1.136 1.00 74.22 C ATOM 2209 CG1 ILE A 142 -5.935 9.195 -0.273 1.00 70.53 C ATOM 2210 CG2 ILE A 142 -3.891 10.582 -0.691 1.00 22.30 C ATOM 2211 CD1 ILE A 142 -6.249 7.751 0.051 1.00 51.03 C ATOM 0 H ILE A 142 -5.445 7.483 -3.037 1.00 24.34 H new ATOM 0 HA ILE A 142 -5.645 10.413 -2.760 1.00 33.43 H new ATOM 0 HB ILE A 142 -4.059 8.484 -1.014 1.00 74.22 H new ATOM 0 HG12 ILE A 142 -5.804 9.748 0.657 1.00 70.53 H new ATOM 0 HG13 ILE A 142 -6.787 9.637 -0.789 1.00 70.53 H new ATOM 0 HG21 ILE A 142 -3.625 10.477 0.361 1.00 22.30 H new ATOM 0 HG22 ILE A 142 -2.983 10.662 -1.289 1.00 22.30 H new ATOM 0 HG23 ILE A 142 -4.494 11.480 -0.825 1.00 22.30 H new ATOM 0 HD11 ILE A 142 -7.148 7.703 0.666 1.00 51.03 H new ATOM 0 HD12 ILE A 142 -6.412 7.198 -0.874 1.00 51.03 H new ATOM 0 HD13 ILE A 142 -5.414 7.310 0.595 1.00 51.03 H new ATOM 2223 N GLU A 143 -3.208 10.749 -3.544 1.00 45.44 N ATOM 2224 CA GLU A 143 -1.987 10.942 -4.318 1.00 41.42 C ATOM 2225 C GLU A 143 -0.824 11.331 -3.410 1.00 22.21 C ATOM 2226 O GLU A 143 -0.940 12.246 -2.595 1.00 64.11 O ATOM 2227 CB GLU A 143 -2.198 12.017 -5.385 1.00 12.31 C ATOM 2228 CG GLU A 143 -3.384 11.744 -6.297 1.00 72.01 C ATOM 2229 CD GLU A 143 -4.512 12.739 -6.103 1.00 44.12 C ATOM 2230 OE1 GLU A 143 -4.404 13.869 -6.625 1.00 20.42 O ATOM 2231 OE2 GLU A 143 -5.503 12.388 -5.429 1.00 2.00 O ATOM 0 H GLU A 143 -3.553 11.591 -3.083 1.00 45.44 H new ATOM 0 HA GLU A 143 -1.744 9.999 -4.807 1.00 41.42 H new ATOM 0 HB2 GLU A 143 -2.341 12.980 -4.895 1.00 12.31 H new ATOM 0 HB3 GLU A 143 -1.295 12.098 -5.991 1.00 12.31 H new ATOM 0 HG2 GLU A 143 -3.053 11.774 -7.335 1.00 72.01 H new ATOM 0 HG3 GLU A 143 -3.757 10.737 -6.110 1.00 72.01 H new ATOM 2238 N THR A 144 0.296 10.630 -3.555 1.00 65.43 N ATOM 2239 CA THR A 144 1.478 10.904 -2.745 1.00 31.02 C ATOM 2240 C THR A 144 2.755 10.708 -3.557 1.00 24.31 C ATOM 2241 O THR A 144 2.732 10.119 -4.637 1.00 63.25 O ATOM 2242 CB THR A 144 1.499 9.997 -1.513 1.00 64.32 C ATOM 2243 OG1 THR A 144 1.906 8.686 -1.863 1.00 10.41 O ATOM 2244 CG2 THR A 144 0.156 9.892 -0.823 1.00 70.00 C ATOM 0 H THR A 144 0.410 9.869 -4.225 1.00 65.43 H new ATOM 0 HA THR A 144 1.432 11.944 -2.422 1.00 31.02 H new ATOM 0 HB THR A 144 2.207 10.460 -0.825 1.00 64.32 H new ATOM 0 HG1 THR A 144 1.915 8.121 -1.062 1.00 10.41 H new ATOM 0 HG21 THR A 144 0.242 9.234 0.042 1.00 70.00 H new ATOM 0 HG22 THR A 144 -0.163 10.882 -0.496 1.00 70.00 H new ATOM 0 HG23 THR A 144 -0.579 9.485 -1.517 1.00 70.00 H new ATOM 2252 N SER A 145 3.867 11.207 -3.026 1.00 72.50 N ATOM 2253 CA SER A 145 5.157 11.089 -3.697 1.00 71.31 C ATOM 2254 C SER A 145 6.215 10.541 -2.742 1.00 45.22 C ATOM 2255 O SER A 145 6.452 11.105 -1.675 1.00 51.54 O ATOM 2256 CB SER A 145 5.598 12.449 -4.245 1.00 44.54 C ATOM 2257 OG SER A 145 4.837 13.501 -3.675 1.00 21.31 O ATOM 0 H SER A 145 3.901 11.697 -2.132 1.00 72.50 H new ATOM 0 HA SER A 145 5.047 10.392 -4.528 1.00 71.31 H new ATOM 0 HB2 SER A 145 6.656 12.605 -4.032 1.00 44.54 H new ATOM 0 HB3 SER A 145 5.486 12.461 -5.329 1.00 44.54 H new ATOM 0 HG SER A 145 5.437 14.134 -3.229 1.00 21.31 H new ATOM 2263 N ALA A 146 6.846 9.439 -3.134 1.00 1.31 N ATOM 2264 CA ALA A 146 7.876 8.816 -2.311 1.00 10.52 C ATOM 2265 C ALA A 146 9.172 9.622 -2.342 1.00 14.03 C ATOM 2266 O ALA A 146 9.974 9.559 -1.410 1.00 60.24 O ATOM 2267 CB ALA A 146 8.128 7.388 -2.776 1.00 22.24 C ATOM 0 H ALA A 146 6.662 8.960 -4.015 1.00 1.31 H new ATOM 0 HA ALA A 146 7.519 8.796 -1.281 1.00 10.52 H new ATOM 0 HB1 ALA A 146 8.899 6.933 -2.154 1.00 22.24 H new ATOM 0 HB2 ALA A 146 7.207 6.810 -2.693 1.00 22.24 H new ATOM 0 HB3 ALA A 146 8.458 7.397 -3.815 1.00 22.24 H new ATOM 2273 N LYS A 147 9.372 10.376 -3.418 1.00 3.23 N ATOM 2274 CA LYS A 147 10.573 11.190 -3.568 1.00 50.25 C ATOM 2275 C LYS A 147 10.482 12.463 -2.732 1.00 72.22 C ATOM 2276 O LYS A 147 11.392 12.779 -1.966 1.00 34.51 O ATOM 2277 CB LYS A 147 10.788 11.549 -5.040 1.00 53.22 C ATOM 2278 CG LYS A 147 12.252 11.639 -5.437 1.00 31.51 C ATOM 2279 CD LYS A 147 12.880 10.260 -5.564 1.00 22.00 C ATOM 2280 CE LYS A 147 14.381 10.308 -5.329 1.00 42.30 C ATOM 2281 NZ LYS A 147 14.896 9.033 -4.759 1.00 60.44 N ATOM 0 H LYS A 147 8.718 10.440 -4.198 1.00 3.23 H new ATOM 0 HA LYS A 147 11.422 10.606 -3.212 1.00 50.25 H new ATOM 0 HB2 LYS A 147 10.297 10.802 -5.663 1.00 53.22 H new ATOM 0 HB3 LYS A 147 10.305 12.504 -5.247 1.00 53.22 H new ATOM 0 HG2 LYS A 147 12.341 12.169 -6.385 1.00 31.51 H new ATOM 0 HG3 LYS A 147 12.797 12.221 -4.694 1.00 31.51 H new ATOM 0 HD2 LYS A 147 12.420 9.582 -4.846 1.00 22.00 H new ATOM 0 HD3 LYS A 147 12.679 9.857 -6.557 1.00 22.00 H new ATOM 0 HE2 LYS A 147 14.889 10.516 -6.271 1.00 42.30 H new ATOM 0 HE3 LYS A 147 14.616 11.129 -4.652 1.00 42.30 H new ATOM 0 HZ1 LYS A 147 15.923 9.107 -4.614 1.00 60.44 H new ATOM 0 HZ2 LYS A 147 14.430 8.847 -3.848 1.00 60.44 H new ATOM 0 HZ3 LYS A 147 14.695 8.253 -5.416 1.00 60.44 H new ATOM 2295 N THR A 148 9.382 13.192 -2.887 1.00 23.22 N ATOM 2296 CA THR A 148 9.177 14.433 -2.149 1.00 30.45 C ATOM 2297 C THR A 148 8.512 14.176 -0.799 1.00 34.20 C ATOM 2298 O THR A 148 8.588 15.007 0.106 1.00 11.22 O ATOM 2299 CB THR A 148 8.326 15.403 -2.971 1.00 33.35 C ATOM 2300 OG1 THR A 148 7.185 14.748 -3.496 1.00 34.15 O ATOM 2301 CG2 THR A 148 9.075 16.021 -4.131 1.00 31.32 C ATOM 0 H THR A 148 8.619 12.945 -3.517 1.00 23.22 H new ATOM 0 HA THR A 148 10.156 14.876 -1.966 1.00 30.45 H new ATOM 0 HB THR A 148 8.043 16.196 -2.279 1.00 33.35 H new ATOM 0 HG1 THR A 148 6.506 15.414 -3.733 1.00 34.15 H new ATOM 0 HG21 THR A 148 8.414 16.698 -4.672 1.00 31.32 H new ATOM 0 HG22 THR A 148 9.934 16.576 -3.755 1.00 31.32 H new ATOM 0 HG23 THR A 148 9.417 15.234 -4.803 1.00 31.32 H new ATOM 2309 N ARG A 149 7.858 13.025 -0.667 1.00 42.44 N ATOM 2310 CA ARG A 149 7.180 12.671 0.576 1.00 24.15 C ATOM 2311 C ARG A 149 6.050 13.654 0.870 1.00 2.43 C ATOM 2312 O ARG A 149 6.064 14.350 1.886 1.00 33.34 O ATOM 2313 CB ARG A 149 8.174 12.650 1.739 1.00 3.42 C ATOM 2314 CG ARG A 149 7.592 12.090 3.027 1.00 64.22 C ATOM 2315 CD ARG A 149 8.173 12.782 4.250 1.00 32.33 C ATOM 2316 NE ARG A 149 7.243 13.751 4.825 1.00 52.23 N ATOM 2317 CZ ARG A 149 7.553 14.570 5.828 1.00 22.21 C ATOM 2318 NH1 ARG A 149 8.765 14.542 6.367 1.00 3.20 N ATOM 2319 NH2 ARG A 149 6.647 15.420 6.293 1.00 22.21 N ATOM 0 H ARG A 149 7.783 12.323 -1.404 1.00 42.44 H new ATOM 0 HA ARG A 149 6.753 11.675 0.461 1.00 24.15 H new ATOM 0 HB2 ARG A 149 9.042 12.055 1.454 1.00 3.42 H new ATOM 0 HB3 ARG A 149 8.529 13.664 1.921 1.00 3.42 H new ATOM 0 HG2 ARG A 149 6.509 12.210 3.020 1.00 64.22 H new ATOM 0 HG3 ARG A 149 7.793 11.020 3.083 1.00 64.22 H new ATOM 0 HD2 ARG A 149 8.429 12.035 5.002 1.00 32.33 H new ATOM 0 HD3 ARG A 149 9.099 13.287 3.975 1.00 32.33 H new ATOM 0 HE ARG A 149 6.302 13.803 4.436 1.00 52.23 H new ATOM 0 HH11 ARG A 149 9.466 13.890 6.013 1.00 3.20 H new ATOM 0 HH12 ARG A 149 8.996 15.172 7.135 1.00 3.20 H new ATOM 0 HH21 ARG A 149 5.714 15.446 5.882 1.00 22.21 H new ATOM 0 HH22 ARG A 149 6.884 16.048 7.061 1.00 22.21 H new ATOM 2333 N GLN A 150 5.075 13.709 -0.030 1.00 32.34 N ATOM 2334 CA GLN A 150 3.938 14.609 0.124 1.00 23.52 C ATOM 2335 C GLN A 150 2.628 13.828 0.184 1.00 42.34 C ATOM 2336 O GLN A 150 2.276 13.115 -0.754 1.00 71.23 O ATOM 2337 CB GLN A 150 3.902 15.609 -1.034 1.00 71.45 C ATOM 2338 CG GLN A 150 2.680 16.514 -1.028 1.00 51.42 C ATOM 2339 CD GLN A 150 3.002 17.924 -1.472 1.00 31.01 C ATOM 2340 OE1 GLN A 150 2.914 18.871 -0.691 1.00 3.04 O ATOM 2341 NE2 GLN A 150 3.377 18.068 -2.735 1.00 33.42 N ATOM 0 H GLN A 150 5.049 13.140 -0.876 1.00 32.34 H new ATOM 0 HA GLN A 150 4.054 15.151 1.062 1.00 23.52 H new ATOM 0 HB2 GLN A 150 4.800 16.226 -0.996 1.00 71.45 H new ATOM 0 HB3 GLN A 150 3.932 15.061 -1.976 1.00 71.45 H new ATOM 0 HG2 GLN A 150 1.918 16.095 -1.685 1.00 51.42 H new ATOM 0 HG3 GLN A 150 2.256 16.540 -0.024 1.00 51.42 H new ATOM 0 HE21 GLN A 150 3.436 17.253 -3.346 1.00 33.42 H new ATOM 0 HE22 GLN A 150 3.607 18.994 -3.096 1.00 33.42 H new ATOM 2350 N GLY A 151 1.910 13.972 1.293 1.00 3.31 N ATOM 2351 CA GLY A 151 0.646 13.279 1.456 1.00 71.22 C ATOM 2352 C GLY A 151 0.813 11.781 1.644 1.00 23.20 C ATOM 2353 O GLY A 151 -0.169 11.039 1.636 1.00 50.31 O ATOM 0 H GLY A 151 2.182 14.557 2.083 1.00 3.31 H new ATOM 0 HA2 GLY A 151 0.120 13.692 2.317 1.00 71.22 H new ATOM 0 HA3 GLY A 151 0.021 13.463 0.582 1.00 71.22 H new ATOM 2357 N VAL A 152 2.054 11.334 1.817 1.00 62.24 N ATOM 2358 CA VAL A 152 2.333 9.916 2.008 1.00 20.34 C ATOM 2359 C VAL A 152 1.575 9.363 3.209 1.00 34.02 C ATOM 2360 O VAL A 152 1.051 8.250 3.167 1.00 21.51 O ATOM 2361 CB VAL A 152 3.837 9.662 2.204 1.00 24.34 C ATOM 2362 CG1 VAL A 152 4.603 9.966 0.925 1.00 33.03 C ATOM 2363 CG2 VAL A 152 4.365 10.490 3.361 1.00 65.10 C ATOM 0 H VAL A 152 2.880 11.933 1.829 1.00 62.24 H new ATOM 0 HA VAL A 152 2.000 9.404 1.105 1.00 20.34 H new ATOM 0 HB VAL A 152 3.984 8.608 2.442 1.00 24.34 H new ATOM 0 HG11 VAL A 152 5.665 9.780 1.084 1.00 33.03 H new ATOM 0 HG12 VAL A 152 4.239 9.325 0.122 1.00 33.03 H new ATOM 0 HG13 VAL A 152 4.454 11.011 0.652 1.00 33.03 H new ATOM 0 HG21 VAL A 152 5.431 10.300 3.488 1.00 65.10 H new ATOM 0 HG22 VAL A 152 4.207 11.548 3.153 1.00 65.10 H new ATOM 0 HG23 VAL A 152 3.837 10.217 4.275 1.00 65.10 H new ATOM 2373 N GLU A 153 1.518 10.149 4.279 1.00 62.21 N ATOM 2374 CA GLU A 153 0.821 9.740 5.492 1.00 20.42 C ATOM 2375 C GLU A 153 -0.691 9.802 5.296 1.00 54.24 C ATOM 2376 O GLU A 153 -1.436 9.018 5.884 1.00 21.00 O ATOM 2377 CB GLU A 153 1.230 10.629 6.668 1.00 1.33 C ATOM 2378 CG GLU A 153 2.722 10.915 6.727 1.00 4.34 C ATOM 2379 CD GLU A 153 3.199 11.229 8.132 1.00 0.51 C ATOM 2380 OE1 GLU A 153 2.689 12.199 8.729 1.00 20.24 O ATOM 2381 OE2 GLU A 153 4.084 10.504 8.633 1.00 32.10 O ATOM 0 H GLU A 153 1.946 11.073 4.330 1.00 62.21 H new ATOM 0 HA GLU A 153 1.101 8.710 5.711 1.00 20.42 H new ATOM 0 HB2 GLU A 153 0.690 11.574 6.603 1.00 1.33 H new ATOM 0 HB3 GLU A 153 0.924 10.150 7.598 1.00 1.33 H new ATOM 0 HG2 GLU A 153 3.269 10.053 6.345 1.00 4.34 H new ATOM 0 HG3 GLU A 153 2.954 11.755 6.072 1.00 4.34 H new ATOM 2388 N ASP A 154 -1.136 10.740 4.467 1.00 52.13 N ATOM 2389 CA ASP A 154 -2.558 10.906 4.193 1.00 53.22 C ATOM 2390 C ASP A 154 -3.135 9.653 3.542 1.00 3.24 C ATOM 2391 O ASP A 154 -4.286 9.289 3.784 1.00 24.14 O ATOM 2392 CB ASP A 154 -2.787 12.118 3.287 1.00 74.40 C ATOM 2393 CG ASP A 154 -4.012 12.915 3.688 1.00 72.12 C ATOM 2394 OD1 ASP A 154 -4.117 13.287 4.876 1.00 41.23 O ATOM 2395 OD2 ASP A 154 -4.868 13.168 2.814 1.00 41.44 O ATOM 0 H ASP A 154 -0.532 11.397 3.973 1.00 52.13 H new ATOM 0 HA ASP A 154 -3.069 11.070 5.142 1.00 53.22 H new ATOM 0 HB2 ASP A 154 -1.910 12.764 3.320 1.00 74.40 H new ATOM 0 HB3 ASP A 154 -2.897 11.782 2.256 1.00 74.40 H new ATOM 2400 N ALA A 155 -2.327 8.997 2.715 1.00 44.44 N ATOM 2401 CA ALA A 155 -2.755 7.785 2.029 1.00 42.12 C ATOM 2402 C ALA A 155 -2.812 6.602 2.989 1.00 12.11 C ATOM 2403 O ALA A 155 -3.732 5.785 2.930 1.00 51.31 O ATOM 2404 CB ALA A 155 -1.822 7.482 0.865 1.00 1.01 C ATOM 0 H ALA A 155 -1.372 9.285 2.504 1.00 44.44 H new ATOM 0 HA ALA A 155 -3.760 7.950 1.641 1.00 42.12 H new ATOM 0 HB1 ALA A 155 -2.153 6.574 0.361 1.00 1.01 H new ATOM 0 HB2 ALA A 155 -1.836 8.314 0.161 1.00 1.01 H new ATOM 0 HB3 ALA A 155 -0.808 7.341 1.239 1.00 1.01 H new ATOM 2410 N PHE A 156 -1.825 6.515 3.874 1.00 24.14 N ATOM 2411 CA PHE A 156 -1.763 5.431 4.848 1.00 63.24 C ATOM 2412 C PHE A 156 -2.877 5.563 5.881 1.00 3.42 C ATOM 2413 O PHE A 156 -3.600 4.604 6.154 1.00 40.52 O ATOM 2414 CB PHE A 156 -0.401 5.419 5.544 1.00 51.25 C ATOM 2415 CG PHE A 156 0.696 4.831 4.704 1.00 73.43 C ATOM 2416 CD1 PHE A 156 0.663 3.495 4.336 1.00 71.55 C ATOM 2417 CD2 PHE A 156 1.758 5.613 4.281 1.00 50.23 C ATOM 2418 CE1 PHE A 156 1.670 2.951 3.561 1.00 14.31 C ATOM 2419 CE2 PHE A 156 2.768 5.075 3.506 1.00 63.33 C ATOM 2420 CZ PHE A 156 2.724 3.742 3.146 1.00 2.40 C ATOM 0 H PHE A 156 -1.056 7.183 3.937 1.00 24.14 H new ATOM 0 HA PHE A 156 -1.898 4.489 4.316 1.00 63.24 H new ATOM 0 HB2 PHE A 156 -0.132 6.440 5.816 1.00 51.25 H new ATOM 0 HB3 PHE A 156 -0.481 4.852 6.472 1.00 51.25 H new ATOM 0 HD1 PHE A 156 -0.158 2.872 4.658 1.00 71.55 H new ATOM 0 HD2 PHE A 156 1.797 6.656 4.560 1.00 50.23 H new ATOM 0 HE1 PHE A 156 1.633 1.909 3.280 1.00 14.31 H new ATOM 0 HE2 PHE A 156 3.590 5.696 3.182 1.00 63.33 H new ATOM 0 HZ PHE A 156 3.512 3.319 2.541 1.00 2.40 H new ATOM 2430 N TYR A 157 -3.012 6.756 6.451 1.00 62.33 N ATOM 2431 CA TYR A 157 -4.041 7.013 7.453 1.00 42.41 C ATOM 2432 C TYR A 157 -5.427 6.693 6.903 1.00 42.54 C ATOM 2433 O TYR A 157 -6.333 6.325 7.651 1.00 72.45 O ATOM 2434 CB TYR A 157 -3.984 8.472 7.910 1.00 32.13 C ATOM 2435 CG TYR A 157 -2.754 8.803 8.726 1.00 53.20 C ATOM 2436 CD1 TYR A 157 -2.303 7.941 9.718 1.00 44.21 C ATOM 2437 CD2 TYR A 157 -2.043 9.976 8.503 1.00 42.12 C ATOM 2438 CE1 TYR A 157 -1.179 8.239 10.465 1.00 13.32 C ATOM 2439 CE2 TYR A 157 -0.918 10.280 9.246 1.00 24.52 C ATOM 2440 CZ TYR A 157 -0.491 9.409 10.225 1.00 41.23 C ATOM 2441 OH TYR A 157 0.629 9.709 10.967 1.00 12.52 O ATOM 0 H TYR A 157 -2.422 7.560 6.236 1.00 62.33 H new ATOM 0 HA TYR A 157 -3.851 6.365 8.308 1.00 42.41 H new ATOM 0 HB2 TYR A 157 -4.014 9.120 7.034 1.00 32.13 H new ATOM 0 HB3 TYR A 157 -4.873 8.694 8.501 1.00 32.13 H new ATOM 0 HD1 TYR A 157 -2.839 7.023 9.908 1.00 44.21 H new ATOM 0 HD2 TYR A 157 -2.375 10.661 7.737 1.00 42.12 H new ATOM 0 HE1 TYR A 157 -0.841 7.559 11.233 1.00 13.32 H new ATOM 0 HE2 TYR A 157 -0.376 11.196 9.060 1.00 24.52 H new ATOM 0 HH TYR A 157 0.997 10.568 10.672 1.00 12.52 H new ATOM 2451 N THR A 158 -5.585 6.829 5.589 1.00 13.22 N ATOM 2452 CA THR A 158 -6.855 6.550 4.939 1.00 41.32 C ATOM 2453 C THR A 158 -7.280 5.106 5.188 1.00 1.45 C ATOM 2454 O THR A 158 -8.444 4.832 5.481 1.00 43.23 O ATOM 2455 CB THR A 158 -6.741 6.815 3.439 1.00 34.21 C ATOM 2456 OG1 THR A 158 -6.430 8.175 3.193 1.00 22.35 O ATOM 2457 CG2 THR A 158 -8.004 6.491 2.677 1.00 14.31 C ATOM 0 H THR A 158 -4.845 7.132 4.955 1.00 13.22 H new ATOM 0 HA THR A 158 -7.614 7.209 5.360 1.00 41.32 H new ATOM 0 HB THR A 158 -5.946 6.157 3.089 1.00 34.21 H new ATOM 0 HG1 THR A 158 -5.457 8.289 3.168 1.00 22.35 H new ATOM 0 HG21 THR A 158 -7.854 6.702 1.618 1.00 14.31 H new ATOM 0 HG22 THR A 158 -8.246 5.436 2.806 1.00 14.31 H new ATOM 0 HG23 THR A 158 -8.824 7.101 3.056 1.00 14.31 H new ATOM 2465 N LEU A 159 -6.326 4.188 5.076 1.00 50.22 N ATOM 2466 CA LEU A 159 -6.598 2.773 5.296 1.00 71.21 C ATOM 2467 C LEU A 159 -7.136 2.545 6.704 1.00 62.32 C ATOM 2468 O LEU A 159 -8.101 1.807 6.900 1.00 61.23 O ATOM 2469 CB LEU A 159 -5.326 1.948 5.080 1.00 22.12 C ATOM 2470 CG LEU A 159 -5.483 0.442 5.301 1.00 15.14 C ATOM 2471 CD1 LEU A 159 -6.625 -0.106 4.459 1.00 61.32 C ATOM 2472 CD2 LEU A 159 -4.184 -0.280 4.975 1.00 54.34 C ATOM 0 H LEU A 159 -5.358 4.399 4.834 1.00 50.22 H new ATOM 0 HA LEU A 159 -7.353 2.452 4.578 1.00 71.21 H new ATOM 0 HB2 LEU A 159 -4.972 2.115 4.063 1.00 22.12 H new ATOM 0 HB3 LEU A 159 -4.552 2.319 5.752 1.00 22.12 H new ATOM 0 HG LEU A 159 -5.720 0.270 6.351 1.00 15.14 H new ATOM 0 HD11 LEU A 159 -6.721 -1.178 4.630 1.00 61.32 H new ATOM 0 HD12 LEU A 159 -7.554 0.391 4.739 1.00 61.32 H new ATOM 0 HD13 LEU A 159 -6.419 0.076 3.404 1.00 61.32 H new ATOM 0 HD21 LEU A 159 -4.312 -1.350 5.137 1.00 54.34 H new ATOM 0 HD22 LEU A 159 -3.919 -0.100 3.933 1.00 54.34 H new ATOM 0 HD23 LEU A 159 -3.389 0.092 5.621 1.00 54.34 H new ATOM 2484 N VAL A 160 -6.507 3.191 7.682 1.00 11.42 N ATOM 2485 CA VAL A 160 -6.919 3.070 9.075 1.00 23.11 C ATOM 2486 C VAL A 160 -8.414 3.332 9.233 1.00 0.34 C ATOM 2487 O VAL A 160 -9.121 2.576 9.900 1.00 74.33 O ATOM 2488 CB VAL A 160 -6.139 4.050 9.972 1.00 61.10 C ATOM 2489 CG1 VAL A 160 -6.527 3.872 11.432 1.00 21.23 C ATOM 2490 CG2 VAL A 160 -4.640 3.867 9.785 1.00 20.00 C ATOM 0 H VAL A 160 -5.707 3.806 7.533 1.00 11.42 H new ATOM 0 HA VAL A 160 -6.700 2.048 9.385 1.00 23.11 H new ATOM 0 HB VAL A 160 -6.399 5.066 9.676 1.00 61.10 H new ATOM 0 HG11 VAL A 160 -5.964 4.574 12.046 1.00 21.23 H new ATOM 0 HG12 VAL A 160 -7.594 4.061 11.551 1.00 21.23 H new ATOM 0 HG13 VAL A 160 -6.302 2.853 11.747 1.00 21.23 H new ATOM 0 HG21 VAL A 160 -4.105 4.567 10.426 1.00 20.00 H new ATOM 0 HG22 VAL A 160 -4.362 2.847 10.050 1.00 20.00 H new ATOM 0 HG23 VAL A 160 -4.378 4.055 8.744 1.00 20.00 H new ATOM 2500 N ARG A 161 -8.888 4.407 8.613 1.00 62.31 N ATOM 2501 CA ARG A 161 -10.298 4.768 8.683 1.00 43.24 C ATOM 2502 C ARG A 161 -11.156 3.749 7.938 1.00 31.01 C ATOM 2503 O ARG A 161 -12.300 3.495 8.312 1.00 1.53 O ATOM 2504 CB ARG A 161 -10.517 6.166 8.098 1.00 21.01 C ATOM 2505 CG ARG A 161 -10.698 7.245 9.154 1.00 63.43 C ATOM 2506 CD ARG A 161 -9.715 8.389 8.961 1.00 11.31 C ATOM 2507 NE ARG A 161 -10.018 9.525 9.830 1.00 4.44 N ATOM 2508 CZ ARG A 161 -10.964 10.425 9.571 1.00 44.45 C ATOM 2509 NH1 ARG A 161 -11.702 10.327 8.472 1.00 55.11 N ATOM 2510 NH2 ARG A 161 -11.173 11.427 10.414 1.00 44.22 N ATOM 0 H ARG A 161 -8.316 5.043 8.057 1.00 62.31 H new ATOM 0 HA ARG A 161 -10.598 4.771 9.731 1.00 43.24 H new ATOM 0 HB2 ARG A 161 -9.666 6.425 7.468 1.00 21.01 H new ATOM 0 HB3 ARG A 161 -11.396 6.148 7.454 1.00 21.01 H new ATOM 0 HG2 ARG A 161 -11.717 7.629 9.111 1.00 63.43 H new ATOM 0 HG3 ARG A 161 -10.562 6.811 10.145 1.00 63.43 H new ATOM 0 HD2 ARG A 161 -8.704 8.036 9.165 1.00 11.31 H new ATOM 0 HD3 ARG A 161 -9.736 8.713 7.920 1.00 11.31 H new ATOM 0 HE ARG A 161 -9.473 9.634 10.685 1.00 4.44 H new ATOM 0 HH11 ARG A 161 -11.546 9.559 7.820 1.00 55.11 H new ATOM 0 HH12 ARG A 161 -12.425 11.020 8.280 1.00 55.11 H new ATOM 0 HH21 ARG A 161 -10.609 11.508 11.260 1.00 44.22 H new ATOM 0 HH22 ARG A 161 -11.898 12.117 10.216 1.00 44.22 H new ATOM 2524 N GLU A 162 -10.595 3.170 6.882 1.00 42.24 N ATOM 2525 CA GLU A 162 -11.311 2.181 6.085 1.00 71.41 C ATOM 2526 C GLU A 162 -11.498 0.881 6.861 1.00 14.24 C ATOM 2527 O GLU A 162 -12.611 0.367 6.968 1.00 71.43 O ATOM 2528 CB GLU A 162 -10.561 1.909 4.780 1.00 74.12 C ATOM 2529 CG GLU A 162 -10.738 3.001 3.738 1.00 73.30 C ATOM 2530 CD GLU A 162 -11.948 2.773 2.853 1.00 43.03 C ATOM 2531 OE1 GLU A 162 -12.039 1.688 2.241 1.00 1.20 O ATOM 2532 OE2 GLU A 162 -12.804 3.678 2.773 1.00 13.25 O ATOM 0 H GLU A 162 -9.648 3.368 6.559 1.00 42.24 H new ATOM 0 HA GLU A 162 -12.297 2.585 5.853 1.00 71.41 H new ATOM 0 HB2 GLU A 162 -9.499 1.795 4.998 1.00 74.12 H new ATOM 0 HB3 GLU A 162 -10.905 0.962 4.364 1.00 74.12 H new ATOM 0 HG2 GLU A 162 -10.836 3.964 4.239 1.00 73.30 H new ATOM 0 HG3 GLU A 162 -9.844 3.054 3.117 1.00 73.30 H new ATOM 2539 N ILE A 163 -10.403 0.354 7.403 1.00 34.11 N ATOM 2540 CA ILE A 163 -10.448 -0.881 8.168 1.00 44.44 C ATOM 2541 C ILE A 163 -11.429 -0.768 9.333 1.00 22.32 C ATOM 2542 O ILE A 163 -12.231 -1.670 9.572 1.00 33.21 O ATOM 2543 CB ILE A 163 -9.055 -1.246 8.705 1.00 11.15 C ATOM 2544 CG1 ILE A 163 -8.053 -1.334 7.553 1.00 72.42 C ATOM 2545 CG2 ILE A 163 -9.108 -2.559 9.465 1.00 1.13 C ATOM 2546 CD1 ILE A 163 -6.685 -1.811 7.980 1.00 44.51 C ATOM 0 H ILE A 163 -9.474 0.767 7.324 1.00 34.11 H new ATOM 0 HA ILE A 163 -10.787 -1.669 7.495 1.00 44.44 H new ATOM 0 HB ILE A 163 -8.729 -0.465 9.392 1.00 11.15 H new ATOM 0 HG12 ILE A 163 -8.444 -2.010 6.793 1.00 72.42 H new ATOM 0 HG13 ILE A 163 -7.958 -0.353 7.088 1.00 72.42 H new ATOM 0 HG21 ILE A 163 -8.114 -2.803 9.839 1.00 1.13 H new ATOM 0 HG22 ILE A 163 -9.798 -2.466 10.303 1.00 1.13 H new ATOM 0 HG23 ILE A 163 -9.450 -3.351 8.799 1.00 1.13 H new ATOM 0 HD11 ILE A 163 -6.026 -1.849 7.113 1.00 44.51 H new ATOM 0 HD12 ILE A 163 -6.274 -1.123 8.718 1.00 44.51 H new ATOM 0 HD13 ILE A 163 -6.767 -2.806 8.418 1.00 44.51 H new ATOM 2558 N ARG A 164 -11.359 0.349 10.052 1.00 30.32 N ATOM 2559 CA ARG A 164 -12.239 0.585 11.188 1.00 61.33 C ATOM 2560 C ARG A 164 -13.689 0.746 10.738 1.00 51.43 C ATOM 2561 O ARG A 164 -14.618 0.477 11.499 1.00 65.23 O ATOM 2562 CB ARG A 164 -11.789 1.831 11.948 1.00 70.21 C ATOM 2563 CG ARG A 164 -10.722 1.553 12.993 1.00 11.52 C ATOM 2564 CD ARG A 164 -10.763 2.575 14.115 1.00 22.31 C ATOM 2565 NE ARG A 164 -10.890 1.945 15.427 1.00 24.03 N ATOM 2566 CZ ARG A 164 -12.038 1.485 15.922 1.00 23.25 C ATOM 2567 NH1 ARG A 164 -13.160 1.588 15.222 1.00 62.12 N ATOM 2568 NH2 ARG A 164 -12.064 0.921 17.122 1.00 40.34 N ATOM 0 H ARG A 164 -10.700 1.105 9.866 1.00 30.32 H new ATOM 0 HA ARG A 164 -12.181 -0.281 11.847 1.00 61.33 H new ATOM 0 HB2 ARG A 164 -11.407 2.562 11.236 1.00 70.21 H new ATOM 0 HB3 ARG A 164 -12.654 2.282 12.435 1.00 70.21 H new ATOM 0 HG2 ARG A 164 -10.865 0.554 13.404 1.00 11.52 H new ATOM 0 HG3 ARG A 164 -9.739 1.566 12.523 1.00 11.52 H new ATOM 0 HD2 ARG A 164 -9.855 3.178 14.089 1.00 22.31 H new ATOM 0 HD3 ARG A 164 -11.601 3.254 13.956 1.00 22.31 H new ATOM 0 HE ARG A 164 -10.050 1.852 15.998 1.00 24.03 H new ATOM 0 HH11 ARG A 164 -13.147 2.021 14.299 1.00 62.12 H new ATOM 0 HH12 ARG A 164 -14.036 1.234 15.607 1.00 62.12 H new ATOM 0 HH21 ARG A 164 -11.205 0.839 17.666 1.00 40.34 H new ATOM 0 HH22 ARG A 164 -12.943 0.569 17.501 1.00 40.34 H new ATOM 2582 N GLN A 165 -13.876 1.189 9.498 1.00 21.05 N ATOM 2583 CA GLN A 165 -15.214 1.386 8.951 1.00 3.42 C ATOM 2584 C GLN A 165 -15.667 0.170 8.151 1.00 10.31 C ATOM 2585 O GLN A 165 -16.495 0.282 7.247 1.00 32.21 O ATOM 2586 CB GLN A 165 -15.244 2.630 8.065 1.00 61.42 C ATOM 2587 CG GLN A 165 -15.246 3.929 8.850 1.00 31.23 C ATOM 2588 CD GLN A 165 -15.860 5.079 8.075 1.00 41.32 C ATOM 2589 OE1 GLN A 165 -17.008 5.457 8.308 1.00 53.14 O ATOM 2590 NE2 GLN A 165 -15.096 5.642 7.146 1.00 61.24 N ATOM 0 H GLN A 165 -13.119 1.418 8.854 1.00 21.05 H new ATOM 0 HA GLN A 165 -15.901 1.521 9.786 1.00 3.42 H new ATOM 0 HB2 GLN A 165 -14.379 2.616 7.402 1.00 61.42 H new ATOM 0 HB3 GLN A 165 -16.131 2.595 7.432 1.00 61.42 H new ATOM 0 HG2 GLN A 165 -15.798 3.787 9.779 1.00 31.23 H new ATOM 0 HG3 GLN A 165 -14.222 4.186 9.123 1.00 31.23 H new ATOM 0 HE21 GLN A 165 -14.150 5.297 6.986 1.00 61.24 H new ATOM 0 HE22 GLN A 165 -15.456 6.420 6.593 1.00 61.24 H new ATOM 2599 N HIS A 166 -15.120 -0.990 8.491 1.00 15.44 N ATOM 2600 CA HIS A 166 -15.466 -2.229 7.806 1.00 44.33 C ATOM 2601 C HIS A 166 -14.875 -3.436 8.532 1.00 20.52 C ATOM 2602 O HIS A 166 -14.896 -3.441 9.781 1.00 73.12 O ATOM 2603 CB HIS A 166 -14.972 -2.189 6.358 1.00 1.31 C ATOM 2604 CG HIS A 166 -15.991 -2.657 5.366 1.00 3.12 C ATOM 2605 ND1 HIS A 166 -16.846 -3.713 5.605 1.00 60.52 N ATOM 2606 CD2 HIS A 166 -16.292 -2.207 4.124 1.00 0.40 C ATOM 2607 CE1 HIS A 166 -17.627 -3.892 4.555 1.00 61.43 C ATOM 2608 NE2 HIS A 166 -17.311 -2.991 3.643 1.00 65.11 N ATOM 2609 OXT HIS A 166 -14.398 -4.366 7.847 1.00 62.35 O ATOM 0 H HIS A 166 -14.434 -1.099 9.238 1.00 15.44 H new ATOM 0 HA HIS A 166 -16.552 -2.328 7.807 1.00 44.33 H new ATOM 0 HB2 HIS A 166 -14.678 -1.169 6.111 1.00 1.31 H new ATOM 0 HB3 HIS A 166 -14.079 -2.808 6.270 1.00 1.31 H new ATOM 0 HD2 HIS A 166 -15.818 -1.385 3.608 1.00 0.40 H new ATOM 0 HE1 HIS A 166 -18.393 -4.647 4.459 1.00 61.43 H new ATOM 0 HE2 HIS A 166 -17.753 -2.893 2.729 1.00 65.11 H new