USER MOD reduce.3.24.130724 H: found=0, std=0, add=34, rem=0, adj=0 USER MOD reduce.3.24.130724 removed 36 hydrogens (0 hets) ATOM 8 N CYS A 2 2.643 -1.725 -3.006 1.00 31.25 N ATOM 9 CA CYS A 2 2.441 -2.769 -4.003 1.00 54.33 C ATOM 10 C CYS A 2 3.165 -4.051 -3.604 1.00 20.12 C ATOM 11 O CYS A 2 4.147 -4.033 -2.861 1.00 72.42 O ATOM 12 CB CYS A 2 2.934 -2.297 -5.373 1.00 13.35 C ATOM 13 SG CYS A 2 2.399 -0.613 -5.815 1.00 51.44 S ATOM 0 HA CYS A 2 1.373 -2.979 -4.061 1.00 54.33 H new ATOM 0 HB2 CYS A 2 4.023 -2.337 -5.389 1.00 13.35 H new ATOM 0 HB3 CYS A 2 2.579 -2.991 -6.134 1.00 13.35 H new ATOM 18 N PRO A 3 2.670 -5.191 -4.108 1.00 25.40 N ATOM 19 CA PRO A 3 3.255 -6.504 -3.818 1.00 63.14 C ATOM 20 C PRO A 3 4.618 -6.689 -4.477 1.00 23.44 C ATOM 21 O PRO A 3 4.685 -6.812 -5.699 1.00 14.43 O ATOM 22 CB PRO A 3 2.238 -7.484 -4.410 1.00 4.44 C ATOM 23 CG PRO A 3 1.546 -6.712 -5.480 1.00 5.45 C ATOM 24 CD PRO A 3 1.503 -5.287 -5.000 1.00 33.11 C ATOM 0 HA PRO A 3 3.433 -6.645 -2.752 1.00 63.14 H new ATOM 0 HB2 PRO A 3 2.730 -8.368 -4.815 1.00 4.44 H new ATOM 0 HB3 PRO A 3 1.534 -7.829 -3.653 1.00 4.44 H new ATOM 0 HG2 PRO A 3 2.082 -6.789 -6.426 1.00 5.45 H new ATOM 0 HG3 PRO A 3 0.541 -7.097 -5.651 1.00 5.45 H new ATOM 0 HD2 PRO A 3 1.572 -4.582 -5.828 1.00 33.11 H new ATOM 0 HD3 PRO A 3 0.575 -5.069 -4.472 1.00 33.11 H new ATOM 56 N ASP A 5 6.859 -4.472 -4.294 1.00 53.10 N ATOM 57 CA ASP A 5 7.349 -3.099 -4.323 1.00 52.34 C ATOM 58 C ASP A 5 6.612 -2.237 -3.303 1.00 3.14 C ATOM 59 O ASP A 5 5.705 -1.475 -3.637 1.00 11.34 O ATOM 60 CB ASP A 5 7.184 -2.506 -5.724 1.00 0.34 C ATOM 61 CG ASP A 5 7.910 -3.312 -6.783 1.00 15.12 C ATOM 62 OD1 ASP A 5 9.133 -3.517 -6.638 1.00 34.05 O ATOM 63 OD2 ASP A 5 7.254 -3.737 -7.758 1.00 25.14 O ATOM 0 HA ASP A 5 8.408 -3.112 -4.064 1.00 52.34 H new ATOM 0 HB2 ASP A 5 6.124 -2.457 -5.972 1.00 0.34 H new ATOM 0 HB3 ASP A 5 7.560 -1.483 -5.729 1.00 0.34 H new ATOM 68 N PRO A 6 7.010 -2.360 -2.027 1.00 54.24 N ATOM 69 CA PRO A 6 6.400 -1.600 -0.932 1.00 21.33 C ATOM 70 C PRO A 6 6.739 -0.115 -0.997 1.00 22.11 C ATOM 71 O PRO A 6 6.186 0.691 -0.249 1.00 20.34 O ATOM 72 CB PRO A 6 7.010 -2.234 0.321 1.00 2.42 C ATOM 73 CG PRO A 6 8.307 -2.807 -0.137 1.00 54.11 C ATOM 74 CD PRO A 6 8.085 -3.249 -1.557 1.00 71.21 C ATOM 0 HA PRO A 6 5.311 -1.644 -0.962 1.00 21.33 H new ATOM 0 HB2 PRO A 6 7.160 -1.493 1.106 1.00 2.42 H new ATOM 0 HB3 PRO A 6 6.359 -3.006 0.731 1.00 2.42 H new ATOM 0 HG2 PRO A 6 9.104 -2.065 -0.079 1.00 54.11 H new ATOM 0 HG3 PRO A 6 8.606 -3.646 0.491 1.00 54.11 H new ATOM 0 HD2 PRO A 6 8.988 -3.140 -2.158 1.00 71.21 H new ATOM 0 HD3 PRO A 6 7.792 -4.297 -1.610 1.00 71.21 H new ATOM 82 N TRP A 7 7.650 0.240 -1.896 1.00 22.24 N ATOM 83 CA TRP A 7 8.062 1.629 -2.058 1.00 44.43 C ATOM 84 C TRP A 7 7.576 2.189 -3.390 1.00 52.24 C ATOM 85 O TRP A 7 8.045 3.233 -3.845 1.00 62.22 O ATOM 86 CB TRP A 7 9.585 1.745 -1.968 1.00 12.22 C ATOM 87 CG TRP A 7 10.047 3.032 -1.353 1.00 62.32 C ATOM 88 CD1 TRP A 7 10.509 4.135 -2.012 1.00 4.10 C ATOM 89 CD2 TRP A 7 10.094 3.346 0.043 1.00 54.53 C ATOM 90 NE1 TRP A 7 10.840 5.117 -1.110 1.00 24.05 N ATOM 91 CE2 TRP A 7 10.594 4.658 0.157 1.00 13.44 C ATOM 92 CE3 TRP A 7 9.760 2.649 1.207 1.00 75.05 C ATOM 93 CZ2 TRP A 7 10.768 5.283 1.389 1.00 12.24 C ATOM 94 CZ3 TRP A 7 9.933 3.270 2.429 1.00 42.45 C ATOM 95 CH2 TRP A 7 10.433 4.577 2.513 1.00 73.25 C ATOM 0 H TRP A 7 8.117 -0.415 -2.523 1.00 22.24 H new ATOM 0 HA TRP A 7 7.612 2.211 -1.254 1.00 44.43 H new ATOM 0 HB2 TRP A 7 9.972 0.911 -1.382 1.00 12.22 H new ATOM 0 HB3 TRP A 7 10.009 1.656 -2.968 1.00 12.22 H new ATOM 0 HD1 TRP A 7 10.601 4.223 -3.085 1.00 4.10 H new ATOM 0 HE1 TRP A 7 11.209 6.038 -1.346 1.00 24.05 H new ATOM 0 HE3 TRP A 7 9.373 1.642 1.152 1.00 75.05 H new ATOM 0 HZ2 TRP A 7 11.154 6.290 1.456 1.00 12.24 H new ATOM 0 HZ3 TRP A 7 9.679 2.740 3.335 1.00 42.45 H new ATOM 0 HH2 TRP A 7 10.556 5.036 3.483 1.00 73.25 H new ATOM 106 N CYS A 8 6.632 1.490 -4.012 1.00 64.30 N ATOM 107 CA CYS A 8 6.082 1.917 -5.293 1.00 30.43 C ATOM 108 C CYS A 8 5.340 3.243 -5.151 1.00 61.41 C ATOM 109 O CYS A 8 5.007 3.663 -4.043 1.00 32.00 O ATOM 110 CB CYS A 8 5.138 0.848 -5.847 1.00 52.24 C ATOM 111 SG CYS A 8 3.559 0.712 -4.949 1.00 1.02 S ATOM 0 H CYS A 8 6.232 0.625 -3.649 1.00 64.30 H new ATOM 0 HA CYS A 8 6.910 2.057 -5.988 1.00 30.43 H new ATOM 0 HB2 CYS A 8 4.930 1.069 -6.894 1.00 52.24 H new ATOM 0 HB3 CYS A 8 5.644 -0.117 -5.820 1.00 52.24 H new