USER MOD reduce.3.24.130724 H: found=0, std=0, add=1101, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 1101 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 83 ASN :FLIP amide:sc= -0.816 F(o=-5.5,f=-2.6) USER MOD Set 1.2: A 84 ASN : amide:sc= -1.79 K(o=-2.6,f=-6.2!) USER MOD Set 2.1: A 11 ASN :FLIP amide:sc= -0.364 F(o=-3.5,f=-1.2) USER MOD Set 2.2: A 74 GLN :FLIP amide:sc= -0.833 F(o=-3.5!,f=-1.2) USER MOD Single : A 4 TYR OH : rot -78:sc= 0.0742 USER MOD Single : A 5 LYS NZ :NH3+ -151:sc= -1.61! (180deg=-3.55!) USER MOD Single : A 13 GLN : amide:sc= -2.24! C(o=-2.2!,f=-6.6!) USER MOD Single : A 17 SER OG : rot -37:sc= 0.942 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot -170:sc= 0 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 30 ASN : amide:sc= -0.055 K(o=-0.055,f=-0.74) USER MOD Single : A 32 GLN : amide:sc= 0.487 K(o=0.49,f=-4.4!) USER MOD Single : A 36 MET CE :methyl 136:sc= -0.255 (180deg=-2.03) USER MOD Single : A 37 ASN : amide:sc= -3.87! C(o=-3.9!,f=-7.8!) USER MOD Single : A 45 SER OG : rot 72:sc= 0.958 USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 47 HIS :FLIP no HE2:sc= -0.25 F(o=-1.1,f=-0.25) USER MOD Single : A 55 THR OG1 : rot 24:sc= -1.12! USER MOD Single : A 58 SER OG : rot 180:sc= -0.0861 USER MOD Single : A 68 THR OG1 : rot -74:sc= -1.09! USER MOD Single : A 70 LYS NZ :NH3+ -170:sc=-0.00844 (180deg=-0.107) USER MOD Single : A 82 ASN : amide:sc= 0.61 X(o=0.61,f=0.66) USER MOD Single : A 94 GLN : amide:sc= -0.924 K(o=-0.92,f=-5!) USER MOD Single : A 101 THR OG1 : rot 134:sc= 0.715 USER MOD Single : A 103 TYR OH : rot 180:sc= 0 USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 115 SER OG : rot 74:sc= 0.212 USER MOD Single : A 119 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 122 MET CE :methyl -152:sc= -2.18 (180deg=-3.05!) USER MOD Single : A 125 HIS : no HD1:sc= -0.325 K(o=-0.33,f=-2.7!) USER MOD Single : A 128 SER OG : rot 85:sc= 0.975 USER MOD Single : A 130 ASN : amide:sc= -0.633 K(o=-0.63,f=-3.6!) USER MOD Single : A 131 TYR OH : rot 180:sc= 0.121 USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 143 GLN : amide:sc= -0.14 K(o=-0.14,f=-1.3) USER MOD Single : A 144 GLN : amide:sc= -0.89 K(o=-0.89,f=-5.1!) USER MOD ----------------------------------------------------------------- ATOM 44 N VAL A 3 5.339 -3.480 18.274 1.00 74.14 N ATOM 45 CA VAL A 3 6.436 -3.385 17.306 1.00 32.03 C ATOM 46 C VAL A 3 6.545 -4.656 16.439 1.00 4.43 C ATOM 47 O VAL A 3 7.049 -5.690 16.886 1.00 24.44 O ATOM 48 CB VAL A 3 7.791 -3.120 18.014 1.00 44.44 C ATOM 49 CG1 VAL A 3 8.922 -2.985 16.995 1.00 13.42 C ATOM 50 CG2 VAL A 3 7.705 -1.875 18.896 1.00 62.30 C ATOM 0 HA VAL A 3 6.206 -2.542 16.655 1.00 32.03 H new ATOM 0 HB VAL A 3 8.012 -3.976 18.652 1.00 44.44 H new ATOM 0 HG11 VAL A 3 9.861 -2.800 17.516 1.00 13.42 H new ATOM 0 HG12 VAL A 3 9.003 -3.906 16.417 1.00 13.42 H new ATOM 0 HG13 VAL A 3 8.709 -2.153 16.324 1.00 13.42 H new ATOM 0 HG21 VAL A 3 8.666 -1.707 19.383 1.00 62.30 H new ATOM 0 HG22 VAL A 3 7.454 -1.010 18.282 1.00 62.30 H new ATOM 0 HG23 VAL A 3 6.934 -2.018 19.653 1.00 62.30 H new ATOM 60 N TYR A 4 6.046 -4.574 15.207 1.00 25.42 N ATOM 61 CA TYR A 4 6.178 -5.667 14.236 1.00 34.20 C ATOM 62 C TYR A 4 7.440 -5.504 13.377 1.00 65.52 C ATOM 63 O TYR A 4 7.802 -4.394 12.981 1.00 75.01 O ATOM 64 CB TYR A 4 4.945 -5.741 13.318 1.00 63.12 C ATOM 65 CG TYR A 4 3.767 -6.494 13.904 1.00 41.12 C ATOM 66 CD1 TYR A 4 3.755 -7.884 13.926 1.00 71.44 C ATOM 67 CD2 TYR A 4 2.666 -5.822 14.422 1.00 11.11 C ATOM 68 CE1 TYR A 4 2.682 -8.582 14.445 1.00 4.11 C ATOM 69 CE2 TYR A 4 1.587 -6.514 14.943 1.00 72.03 C ATOM 70 CZ TYR A 4 1.600 -7.895 14.951 1.00 33.51 C ATOM 71 OH TYR A 4 0.529 -8.590 15.470 1.00 41.04 O ATOM 0 H TYR A 4 5.544 -3.760 14.853 1.00 25.42 H new ATOM 0 HA TYR A 4 6.258 -6.593 14.806 1.00 34.20 H new ATOM 0 HB2 TYR A 4 4.627 -4.727 13.076 1.00 63.12 H new ATOM 0 HB3 TYR A 4 5.234 -6.217 12.381 1.00 63.12 H new ATOM 0 HD1 TYR A 4 4.600 -8.428 13.530 1.00 71.44 H new ATOM 0 HD2 TYR A 4 2.653 -4.742 14.418 1.00 11.11 H new ATOM 0 HE1 TYR A 4 2.691 -9.662 14.454 1.00 4.11 H new ATOM 0 HE2 TYR A 4 0.739 -5.977 15.341 1.00 72.03 H new ATOM 0 HH TYR A 4 -0.022 -8.937 14.737 1.00 41.04 H new ATOM 81 N LYS A 5 8.106 -6.619 13.090 1.00 10.04 N ATOM 82 CA LYS A 5 9.277 -6.615 12.203 1.00 10.44 C ATOM 83 C LYS A 5 8.959 -7.342 10.878 1.00 21.41 C ATOM 84 O LYS A 5 8.049 -8.174 10.825 1.00 13.11 O ATOM 85 CB LYS A 5 10.490 -7.266 12.898 1.00 1.23 C ATOM 86 CG LYS A 5 10.991 -6.522 14.139 1.00 14.20 C ATOM 87 CD LYS A 5 10.150 -6.807 15.387 1.00 52.04 C ATOM 88 CE LYS A 5 10.377 -8.217 15.945 1.00 25.51 C ATOM 89 NZ LYS A 5 9.764 -9.286 15.105 1.00 40.42 N ATOM 0 H LYS A 5 7.859 -7.539 13.456 1.00 10.04 H new ATOM 0 HA LYS A 5 9.527 -5.579 11.976 1.00 10.44 H new ATOM 0 HB2 LYS A 5 10.225 -8.284 13.184 1.00 1.23 H new ATOM 0 HB3 LYS A 5 11.307 -7.339 12.180 1.00 1.23 H new ATOM 0 HG2 LYS A 5 12.026 -6.805 14.332 1.00 14.20 H new ATOM 0 HG3 LYS A 5 10.985 -5.450 13.940 1.00 14.20 H new ATOM 0 HD2 LYS A 5 10.390 -6.073 16.157 1.00 52.04 H new ATOM 0 HD3 LYS A 5 9.095 -6.682 15.145 1.00 52.04 H new ATOM 0 HE2 LYS A 5 11.448 -8.399 16.029 1.00 25.51 H new ATOM 0 HE3 LYS A 5 9.964 -8.273 16.952 1.00 25.51 H new ATOM 0 HZ1 LYS A 5 9.507 -10.095 15.706 1.00 40.42 H new ATOM 0 HZ2 LYS A 5 8.911 -8.916 14.640 1.00 40.42 H new ATOM 0 HZ3 LYS A 5 10.446 -9.594 14.383 1.00 40.42 H new ATOM 103 N PRO A 6 9.721 -7.066 9.793 1.00 43.24 N ATOM 104 CA PRO A 6 9.417 -7.596 8.441 1.00 12.11 C ATOM 105 C PRO A 6 9.663 -9.111 8.276 1.00 10.35 C ATOM 106 O PRO A 6 9.801 -9.604 7.157 1.00 2.13 O ATOM 107 CB PRO A 6 10.360 -6.789 7.540 1.00 63.22 C ATOM 108 CG PRO A 6 11.513 -6.438 8.417 1.00 13.30 C ATOM 109 CD PRO A 6 10.935 -6.219 9.788 1.00 23.22 C ATOM 0 HA PRO A 6 8.358 -7.490 8.206 1.00 12.11 H new ATOM 0 HB2 PRO A 6 10.682 -7.374 6.678 1.00 63.22 H new ATOM 0 HB3 PRO A 6 9.870 -5.895 7.153 1.00 63.22 H new ATOM 0 HG2 PRO A 6 12.253 -7.238 8.428 1.00 13.30 H new ATOM 0 HG3 PRO A 6 12.018 -5.541 8.058 1.00 13.30 H new ATOM 0 HD2 PRO A 6 11.634 -6.516 10.570 1.00 23.22 H new ATOM 0 HD3 PRO A 6 10.693 -5.170 9.958 1.00 23.22 H new ATOM 117 N GLU A 7 9.724 -9.839 9.387 1.00 13.14 N ATOM 118 CA GLU A 7 9.810 -11.304 9.363 1.00 42.11 C ATOM 119 C GLU A 7 8.708 -11.952 10.221 1.00 31.43 C ATOM 120 O GLU A 7 8.482 -13.159 10.148 1.00 13.25 O ATOM 121 CB GLU A 7 11.210 -11.768 9.817 1.00 2.45 C ATOM 122 CG GLU A 7 11.798 -10.999 11.004 1.00 24.01 C ATOM 123 CD GLU A 7 11.015 -11.165 12.299 1.00 35.20 C ATOM 124 OE1 GLU A 7 11.217 -12.180 12.998 1.00 12.52 O ATOM 125 OE2 GLU A 7 10.201 -10.277 12.621 1.00 62.11 O ATOM 0 H GLU A 7 9.716 -9.438 10.325 1.00 13.14 H new ATOM 0 HA GLU A 7 9.653 -11.632 8.335 1.00 42.11 H new ATOM 0 HB2 GLU A 7 11.158 -12.825 10.079 1.00 2.45 H new ATOM 0 HB3 GLU A 7 11.895 -11.682 8.974 1.00 2.45 H new ATOM 0 HG2 GLU A 7 12.823 -11.331 11.167 1.00 24.01 H new ATOM 0 HG3 GLU A 7 11.842 -9.940 10.751 1.00 24.01 H new ATOM 132 N ASP A 8 8.026 -11.142 11.031 1.00 53.25 N ATOM 133 CA ASP A 8 6.948 -11.630 11.901 1.00 15.11 C ATOM 134 C ASP A 8 5.569 -11.401 11.257 1.00 44.12 C ATOM 135 O ASP A 8 4.581 -12.037 11.631 1.00 12.22 O ATOM 136 CB ASP A 8 7.037 -10.930 13.262 1.00 34.44 C ATOM 137 CG ASP A 8 6.052 -11.480 14.280 1.00 2.04 C ATOM 138 OD1 ASP A 8 6.039 -12.709 14.495 1.00 52.22 O ATOM 139 OD2 ASP A 8 5.315 -10.680 14.898 1.00 54.01 O ATOM 0 H ASP A 8 8.200 -10.140 11.105 1.00 53.25 H new ATOM 0 HA ASP A 8 7.067 -12.704 12.042 1.00 15.11 H new ATOM 0 HB2 ASP A 8 8.050 -11.034 13.652 1.00 34.44 H new ATOM 0 HB3 ASP A 8 6.855 -9.864 13.128 1.00 34.44 H new ATOM 144 N VAL A 9 5.515 -10.493 10.284 1.00 12.43 N ATOM 145 CA VAL A 9 4.277 -10.212 9.542 1.00 54.24 C ATOM 146 C VAL A 9 3.733 -11.480 8.854 1.00 23.03 C ATOM 147 O VAL A 9 4.483 -12.201 8.190 1.00 45.30 O ATOM 148 CB VAL A 9 4.507 -9.108 8.475 1.00 40.30 C ATOM 149 CG1 VAL A 9 3.235 -8.848 7.665 1.00 13.11 C ATOM 150 CG2 VAL A 9 5.009 -7.819 9.132 1.00 13.11 C ATOM 0 H VAL A 9 6.315 -9.935 9.987 1.00 12.43 H new ATOM 0 HA VAL A 9 3.542 -9.863 10.267 1.00 54.24 H new ATOM 0 HB VAL A 9 5.273 -9.461 7.785 1.00 40.30 H new ATOM 0 HG11 VAL A 9 3.427 -8.070 6.926 1.00 13.11 H new ATOM 0 HG12 VAL A 9 2.933 -9.764 7.158 1.00 13.11 H new ATOM 0 HG13 VAL A 9 2.438 -8.524 8.334 1.00 13.11 H new ATOM 0 HG21 VAL A 9 5.164 -7.058 8.368 1.00 13.11 H new ATOM 0 HG22 VAL A 9 4.270 -7.466 9.851 1.00 13.11 H new ATOM 0 HG23 VAL A 9 5.950 -8.015 9.645 1.00 13.11 H new ATOM 160 N PRO A 10 2.425 -11.781 9.020 1.00 13.51 N ATOM 161 CA PRO A 10 1.784 -12.944 8.377 1.00 44.53 C ATOM 162 C PRO A 10 2.062 -13.030 6.866 1.00 22.41 C ATOM 163 O PRO A 10 1.589 -12.208 6.080 1.00 54.32 O ATOM 164 CB PRO A 10 0.290 -12.713 8.643 1.00 50.13 C ATOM 165 CG PRO A 10 0.257 -11.921 9.904 1.00 34.43 C ATOM 166 CD PRO A 10 1.470 -11.026 9.861 1.00 40.24 C ATOM 0 HA PRO A 10 2.166 -13.885 8.774 1.00 44.53 H new ATOM 0 HB2 PRO A 10 -0.181 -12.173 7.822 1.00 50.13 H new ATOM 0 HB3 PRO A 10 -0.245 -13.656 8.752 1.00 50.13 H new ATOM 0 HG2 PRO A 10 -0.659 -11.334 9.973 1.00 34.43 H new ATOM 0 HG3 PRO A 10 0.284 -12.574 10.776 1.00 34.43 H new ATOM 0 HD2 PRO A 10 1.236 -10.053 9.429 1.00 40.24 H new ATOM 0 HD3 PRO A 10 1.870 -10.844 10.858 1.00 40.24 H new ATOM 174 N ASN A 11 2.845 -14.031 6.469 1.00 25.20 N ATOM 175 CA ASN A 11 3.208 -14.224 5.063 1.00 54.22 C ATOM 176 C ASN A 11 2.004 -14.705 4.239 1.00 13.12 C ATOM 177 O ASN A 11 1.680 -15.889 4.236 1.00 5.13 O ATOM 178 CB ASN A 11 4.352 -15.239 4.956 1.00 60.42 C ATOM 179 CG ASN A 11 5.588 -14.791 5.707 1.00 51.13 C ATOM 180 OD1 ASN A 11 6.503 -14.156 5.012 1.00 74.33 O flip ATOM 181 ND2 ASN A 11 5.727 -15.032 6.898 1.00 23.54 N flip ATOM 0 H ASN A 11 3.243 -14.725 7.103 1.00 25.20 H new ATOM 0 HA ASN A 11 3.533 -13.264 4.661 1.00 54.22 H new ATOM 0 HB2 ASN A 11 4.020 -16.200 5.348 1.00 60.42 H new ATOM 0 HB3 ASN A 11 4.603 -15.392 3.906 1.00 60.42 H new ATOM 0 HD21 ASN A 11 4.995 -15.528 7.407 1.00 23.54 H new ATOM 0 HD22 ASN A 11 6.575 -14.737 7.382 1.00 23.54 H new ATOM 188 N VAL A 12 1.336 -13.781 3.552 1.00 42.35 N ATOM 189 CA VAL A 12 0.144 -14.128 2.759 1.00 14.25 C ATOM 190 C VAL A 12 0.459 -14.441 1.276 1.00 53.20 C ATOM 191 O VAL A 12 0.058 -15.483 0.762 1.00 0.45 O ATOM 192 CB VAL A 12 -0.929 -13.005 2.835 1.00 33.43 C ATOM 193 CG1 VAL A 12 -1.455 -12.855 4.262 1.00 43.34 C ATOM 194 CG2 VAL A 12 -0.377 -11.673 2.324 1.00 10.41 C ATOM 0 H VAL A 12 1.591 -12.794 3.524 1.00 42.35 H new ATOM 0 HA VAL A 12 -0.246 -15.042 3.207 1.00 14.25 H new ATOM 0 HB VAL A 12 -1.758 -13.294 2.189 1.00 33.43 H new ATOM 0 HG11 VAL A 12 -2.204 -12.064 4.292 1.00 43.34 H new ATOM 0 HG12 VAL A 12 -1.905 -13.794 4.584 1.00 43.34 H new ATOM 0 HG13 VAL A 12 -0.631 -12.600 4.929 1.00 43.34 H new ATOM 0 HG21 VAL A 12 -1.151 -10.909 2.390 1.00 10.41 H new ATOM 0 HG22 VAL A 12 0.478 -11.377 2.931 1.00 10.41 H new ATOM 0 HG23 VAL A 12 -0.064 -11.783 1.286 1.00 10.41 H new ATOM 204 N GLN A 13 1.203 -13.559 0.607 1.00 42.10 N ATOM 205 CA GLN A 13 1.380 -13.623 -0.859 1.00 52.22 C ATOM 206 C GLN A 13 1.880 -14.983 -1.388 1.00 32.33 C ATOM 207 O GLN A 13 1.500 -15.396 -2.484 1.00 63.14 O ATOM 208 CB GLN A 13 2.328 -12.511 -1.327 1.00 54.35 C ATOM 209 CG GLN A 13 1.708 -11.120 -1.275 1.00 44.21 C ATOM 210 CD GLN A 13 0.445 -11.019 -2.112 1.00 23.41 C ATOM 211 OE1 GLN A 13 -0.652 -11.237 -1.621 1.00 52.14 O ATOM 212 NE2 GLN A 13 0.588 -10.723 -3.387 1.00 24.41 N ATOM 0 H GLN A 13 1.698 -12.786 1.052 1.00 42.10 H new ATOM 0 HA GLN A 13 0.382 -13.485 -1.276 1.00 52.22 H new ATOM 0 HB2 GLN A 13 3.224 -12.524 -0.707 1.00 54.35 H new ATOM 0 HB3 GLN A 13 2.645 -12.721 -2.349 1.00 54.35 H new ATOM 0 HG2 GLN A 13 1.477 -10.867 -0.240 1.00 44.21 H new ATOM 0 HG3 GLN A 13 2.434 -10.388 -1.628 1.00 44.21 H new ATOM 0 HE21 GLN A 13 1.517 -10.546 -3.768 1.00 24.41 H new ATOM 0 HE22 GLN A 13 -0.231 -10.671 -3.993 1.00 24.41 H new ATOM 221 N LEU A 14 2.716 -15.679 -0.623 1.00 62.33 N ATOM 222 CA LEU A 14 3.326 -16.936 -1.100 1.00 62.14 C ATOM 223 C LEU A 14 2.348 -18.131 -1.041 1.00 23.35 C ATOM 224 O LEU A 14 2.733 -19.269 -1.318 1.00 42.53 O ATOM 225 CB LEU A 14 4.617 -17.259 -0.315 1.00 34.02 C ATOM 226 CG LEU A 14 4.444 -17.787 1.125 1.00 34.33 C ATOM 227 CD1 LEU A 14 5.805 -18.063 1.764 1.00 62.41 C ATOM 228 CD2 LEU A 14 3.644 -16.811 1.977 1.00 62.44 C ATOM 0 H LEU A 14 2.990 -15.406 0.321 1.00 62.33 H new ATOM 0 HA LEU A 14 3.580 -16.778 -2.148 1.00 62.14 H new ATOM 0 HB2 LEU A 14 5.183 -17.998 -0.882 1.00 34.02 H new ATOM 0 HB3 LEU A 14 5.225 -16.355 -0.274 1.00 34.02 H new ATOM 0 HG LEU A 14 3.888 -18.723 1.073 1.00 34.33 H new ATOM 0 HD11 LEU A 14 5.662 -18.434 2.779 1.00 62.41 H new ATOM 0 HD12 LEU A 14 6.338 -18.810 1.176 1.00 62.41 H new ATOM 0 HD13 LEU A 14 6.387 -17.142 1.794 1.00 62.41 H new ATOM 0 HD21 LEU A 14 3.539 -17.210 2.986 1.00 62.44 H new ATOM 0 HD22 LEU A 14 4.163 -15.854 2.018 1.00 62.44 H new ATOM 0 HD23 LEU A 14 2.656 -16.670 1.538 1.00 62.44 H new ATOM 240 N ALA A 15 1.089 -17.868 -0.688 1.00 75.32 N ATOM 241 CA ALA A 15 0.055 -18.915 -0.656 1.00 25.21 C ATOM 242 C ALA A 15 -1.358 -18.314 -0.734 1.00 2.21 C ATOM 243 O ALA A 15 -2.180 -18.718 -1.562 1.00 63.31 O ATOM 244 CB ALA A 15 0.200 -19.767 0.600 1.00 21.32 C ATOM 0 H ALA A 15 0.756 -16.942 -0.420 1.00 75.32 H new ATOM 0 HA ALA A 15 0.197 -19.548 -1.532 1.00 25.21 H new ATOM 0 HB1 ALA A 15 -0.572 -20.537 0.609 1.00 21.32 H new ATOM 0 HB2 ALA A 15 1.183 -20.239 0.608 1.00 21.32 H new ATOM 0 HB3 ALA A 15 0.093 -19.136 1.482 1.00 21.32 H new ATOM 250 N ASP A 16 -1.635 -17.350 0.133 1.00 64.22 N ATOM 251 CA ASP A 16 -2.922 -16.644 0.142 1.00 25.12 C ATOM 252 C ASP A 16 -2.941 -15.502 -0.896 1.00 51.32 C ATOM 253 O ASP A 16 -3.374 -14.392 -0.600 1.00 21.20 O ATOM 254 CB ASP A 16 -3.191 -16.089 1.546 1.00 11.11 C ATOM 255 CG ASP A 16 -3.269 -17.183 2.594 1.00 1.54 C ATOM 256 OD1 ASP A 16 -4.368 -17.742 2.793 1.00 51.23 O ATOM 257 OD2 ASP A 16 -2.233 -17.498 3.219 1.00 1.32 O ATOM 0 H ASP A 16 -0.982 -17.032 0.849 1.00 64.22 H new ATOM 0 HA ASP A 16 -3.707 -17.351 -0.128 1.00 25.12 H new ATOM 0 HB2 ASP A 16 -2.401 -15.388 1.814 1.00 11.11 H new ATOM 0 HB3 ASP A 16 -4.126 -15.528 1.539 1.00 11.11 H new ATOM 262 N SER A 17 -2.507 -15.799 -2.123 1.00 13.23 N ATOM 263 CA SER A 17 -2.390 -14.786 -3.192 1.00 53.51 C ATOM 264 C SER A 17 -3.742 -14.134 -3.544 1.00 74.41 C ATOM 265 O SER A 17 -3.786 -13.139 -4.267 1.00 50.15 O ATOM 266 CB SER A 17 -1.780 -15.412 -4.455 1.00 4.13 C ATOM 267 OG SER A 17 -0.549 -16.066 -4.166 1.00 1.15 O ATOM 0 H SER A 17 -2.227 -16.737 -2.409 1.00 13.23 H new ATOM 0 HA SER A 17 -1.736 -14.002 -2.810 1.00 53.51 H new ATOM 0 HB2 SER A 17 -2.482 -16.127 -4.884 1.00 4.13 H new ATOM 0 HB3 SER A 17 -1.616 -14.638 -5.204 1.00 4.13 H new ATOM 0 HG SER A 17 -0.053 -15.549 -3.497 1.00 1.15 H new ATOM 273 N THR A 18 -4.837 -14.706 -3.050 1.00 4.51 N ATOM 274 CA THR A 18 -6.173 -14.121 -3.234 1.00 21.42 C ATOM 275 C THR A 18 -6.386 -12.946 -2.271 1.00 65.10 C ATOM 276 O THR A 18 -7.115 -11.998 -2.572 1.00 61.13 O ATOM 277 CB THR A 18 -7.288 -15.166 -3.000 1.00 62.33 C ATOM 278 OG1 THR A 18 -7.263 -15.607 -1.634 1.00 63.42 O ATOM 279 CG2 THR A 18 -7.122 -16.367 -3.928 1.00 4.12 C ATOM 0 H THR A 18 -4.831 -15.576 -2.517 1.00 4.51 H new ATOM 0 HA THR A 18 -6.229 -13.770 -4.264 1.00 21.42 H new ATOM 0 HB THR A 18 -8.246 -14.694 -3.217 1.00 62.33 H new ATOM 0 HG1 THR A 18 -7.972 -16.268 -1.491 1.00 63.42 H new ATOM 0 HG21 THR A 18 -7.920 -17.085 -3.740 1.00 4.12 H new ATOM 0 HG22 THR A 18 -7.169 -16.035 -4.965 1.00 4.12 H new ATOM 0 HG23 THR A 18 -6.158 -16.840 -3.742 1.00 4.12 H new ATOM 287 N ARG A 19 -5.748 -13.022 -1.105 1.00 74.25 N ATOM 288 CA ARG A 19 -5.775 -11.936 -0.124 1.00 14.44 C ATOM 289 C ARG A 19 -4.413 -11.231 -0.055 1.00 74.31 C ATOM 290 O ARG A 19 -3.504 -11.660 0.652 1.00 43.32 O ATOM 291 CB ARG A 19 -6.190 -12.466 1.258 1.00 34.41 C ATOM 292 CG ARG A 19 -5.956 -11.484 2.408 1.00 42.24 C ATOM 293 CD ARG A 19 -6.802 -11.825 3.634 1.00 51.04 C ATOM 294 NE ARG A 19 -8.147 -11.261 3.533 1.00 64.12 N ATOM 295 CZ ARG A 19 -9.195 -11.889 3.074 1.00 62.32 C ATOM 296 NH1 ARG A 19 -9.147 -13.155 2.799 1.00 1.30 N ATOM 297 NH2 ARG A 19 -10.306 -11.242 2.939 1.00 52.20 N ATOM 0 H ARG A 19 -5.201 -13.832 -0.814 1.00 74.25 H new ATOM 0 HA ARG A 19 -6.517 -11.204 -0.443 1.00 14.44 H new ATOM 0 HB2 ARG A 19 -7.247 -12.729 1.230 1.00 34.41 H new ATOM 0 HB3 ARG A 19 -5.639 -13.384 1.462 1.00 34.41 H new ATOM 0 HG2 ARG A 19 -4.901 -11.492 2.682 1.00 42.24 H new ATOM 0 HG3 ARG A 19 -6.191 -10.473 2.075 1.00 42.24 H new ATOM 0 HD2 ARG A 19 -6.868 -12.908 3.742 1.00 51.04 H new ATOM 0 HD3 ARG A 19 -6.314 -11.445 4.531 1.00 51.04 H new ATOM 0 HE ARG A 19 -8.277 -10.299 3.847 1.00 64.12 H new ATOM 0 HH11 ARG A 19 -8.281 -13.675 2.941 1.00 1.30 H new ATOM 0 HH12 ARG A 19 -9.975 -13.631 2.441 1.00 1.30 H new ATOM 0 HH21 ARG A 19 -10.355 -10.255 3.190 1.00 52.20 H new ATOM 0 HH22 ARG A 19 -11.134 -11.719 2.582 1.00 52.20 H new ATOM 311 N LEU A 20 -4.287 -10.143 -0.804 1.00 55.13 N ATOM 312 CA LEU A 20 -3.031 -9.389 -0.873 1.00 12.14 C ATOM 313 C LEU A 20 -2.972 -8.312 0.225 1.00 61.22 C ATOM 314 O LEU A 20 -2.125 -7.418 0.197 1.00 64.02 O ATOM 315 CB LEU A 20 -2.872 -8.743 -2.261 1.00 32.15 C ATOM 316 CG LEU A 20 -2.966 -9.708 -3.463 1.00 3.25 C ATOM 317 CD1 LEU A 20 -4.423 -10.013 -3.808 1.00 53.40 C ATOM 318 CD2 LEU A 20 -2.227 -9.141 -4.673 1.00 73.21 C ATOM 0 H LEU A 20 -5.039 -9.758 -1.376 1.00 55.13 H new ATOM 0 HA LEU A 20 -2.208 -10.086 -0.710 1.00 12.14 H new ATOM 0 HB2 LEU A 20 -3.638 -7.975 -2.374 1.00 32.15 H new ATOM 0 HB3 LEU A 20 -1.907 -8.238 -2.298 1.00 32.15 H new ATOM 0 HG LEU A 20 -2.485 -10.645 -3.181 1.00 3.25 H new ATOM 0 HD11 LEU A 20 -4.461 -10.695 -4.658 1.00 53.40 H new ATOM 0 HD12 LEU A 20 -4.911 -10.475 -2.950 1.00 53.40 H new ATOM 0 HD13 LEU A 20 -4.938 -9.087 -4.063 1.00 53.40 H new ATOM 0 HD21 LEU A 20 -2.307 -9.838 -5.507 1.00 73.21 H new ATOM 0 HD22 LEU A 20 -2.669 -8.185 -4.955 1.00 73.21 H new ATOM 0 HD23 LEU A 20 -1.176 -8.994 -4.422 1.00 73.21 H new ATOM 330 N VAL A 21 -3.878 -8.410 1.199 1.00 63.22 N ATOM 331 CA VAL A 21 -3.979 -7.421 2.278 1.00 24.30 C ATOM 332 C VAL A 21 -3.702 -8.048 3.654 1.00 63.11 C ATOM 333 O VAL A 21 -4.319 -9.045 4.029 1.00 25.13 O ATOM 334 CB VAL A 21 -5.386 -6.772 2.310 1.00 42.40 C ATOM 335 CG1 VAL A 21 -5.434 -5.608 3.299 1.00 53.51 C ATOM 336 CG2 VAL A 21 -5.801 -6.325 0.912 1.00 3.12 C ATOM 0 H VAL A 21 -4.557 -9.168 1.264 1.00 63.22 H new ATOM 0 HA VAL A 21 -3.225 -6.662 2.072 1.00 24.30 H new ATOM 0 HB VAL A 21 -6.099 -7.522 2.652 1.00 42.40 H new ATOM 0 HG11 VAL A 21 -6.433 -5.172 3.300 1.00 53.51 H new ATOM 0 HG12 VAL A 21 -5.195 -5.970 4.299 1.00 53.51 H new ATOM 0 HG13 VAL A 21 -4.708 -4.850 3.005 1.00 53.51 H new ATOM 0 HG21 VAL A 21 -6.791 -5.872 0.954 1.00 3.12 H new ATOM 0 HG22 VAL A 21 -5.084 -5.596 0.535 1.00 3.12 H new ATOM 0 HG23 VAL A 21 -5.825 -7.188 0.246 1.00 3.12 H new ATOM 346 N THR A 22 -2.781 -7.450 4.402 1.00 34.54 N ATOM 347 CA THR A 22 -2.477 -7.897 5.769 1.00 43.10 C ATOM 348 C THR A 22 -2.710 -6.760 6.774 1.00 14.31 C ATOM 349 O THR A 22 -1.902 -5.838 6.881 1.00 21.30 O ATOM 350 CB THR A 22 -1.013 -8.396 5.893 1.00 41.41 C ATOM 351 OG1 THR A 22 -0.751 -9.406 4.907 1.00 73.24 O ATOM 352 CG2 THR A 22 -0.736 -8.964 7.284 1.00 21.43 C ATOM 0 H THR A 22 -2.228 -6.652 4.090 1.00 34.54 H new ATOM 0 HA THR A 22 -3.148 -8.726 5.993 1.00 43.10 H new ATOM 0 HB THR A 22 -0.356 -7.542 5.730 1.00 41.41 H new ATOM 0 HG1 THR A 22 0.115 -9.826 5.091 1.00 73.24 H new ATOM 0 HG21 THR A 22 0.298 -9.305 7.339 1.00 21.43 H new ATOM 0 HG22 THR A 22 -0.903 -8.190 8.033 1.00 21.43 H new ATOM 0 HG23 THR A 22 -1.405 -9.803 7.474 1.00 21.43 H new ATOM 360 N ASP A 23 -3.825 -6.824 7.500 1.00 51.42 N ATOM 361 CA ASP A 23 -4.182 -5.782 8.471 1.00 52.10 C ATOM 362 C ASP A 23 -3.820 -6.201 9.906 1.00 73.35 C ATOM 363 O ASP A 23 -4.517 -7.005 10.527 1.00 3.44 O ATOM 364 CB ASP A 23 -5.679 -5.448 8.365 1.00 64.02 C ATOM 365 CG ASP A 23 -6.151 -4.487 9.448 1.00 43.33 C ATOM 366 OD1 ASP A 23 -5.809 -3.282 9.387 1.00 33.10 O ATOM 367 OD2 ASP A 23 -6.856 -4.936 10.377 1.00 21.23 O ATOM 0 H ASP A 23 -4.500 -7.586 7.437 1.00 51.42 H new ATOM 0 HA ASP A 23 -3.604 -4.889 8.234 1.00 52.10 H new ATOM 0 HB2 ASP A 23 -5.880 -5.012 7.387 1.00 64.02 H new ATOM 0 HB3 ASP A 23 -6.257 -6.370 8.428 1.00 64.02 H new ATOM 372 N GLU A 24 -2.714 -5.667 10.414 1.00 60.34 N ATOM 373 CA GLU A 24 -2.287 -5.917 11.797 1.00 71.52 C ATOM 374 C GLU A 24 -2.604 -4.709 12.690 1.00 70.03 C ATOM 375 O GLU A 24 -2.926 -4.855 13.875 1.00 4.14 O ATOM 376 CB GLU A 24 -0.783 -6.221 11.839 1.00 33.50 C ATOM 377 CG GLU A 24 -0.378 -7.455 11.037 1.00 1.13 C ATOM 378 CD GLU A 24 -1.009 -8.731 11.571 1.00 1.14 C ATOM 379 OE1 GLU A 24 -0.490 -9.285 12.559 1.00 65.11 O ATOM 380 OE2 GLU A 24 -2.031 -9.180 11.014 1.00 2.31 O ATOM 0 H GLU A 24 -2.090 -5.054 9.889 1.00 60.34 H new ATOM 0 HA GLU A 24 -2.836 -6.780 12.175 1.00 71.52 H new ATOM 0 HB2 GLU A 24 -0.237 -5.358 11.459 1.00 33.50 H new ATOM 0 HB3 GLU A 24 -0.479 -6.358 12.877 1.00 33.50 H new ATOM 0 HG2 GLU A 24 -0.669 -7.318 9.995 1.00 1.13 H new ATOM 0 HG3 GLU A 24 0.707 -7.555 11.055 1.00 1.13 H new ATOM 387 N ALA A 25 -2.501 -3.513 12.113 1.00 71.15 N ATOM 388 CA ALA A 25 -2.840 -2.270 12.815 1.00 40.11 C ATOM 389 C ALA A 25 -4.313 -2.223 13.250 1.00 32.00 C ATOM 390 O ALA A 25 -4.659 -1.573 14.236 1.00 44.24 O ATOM 391 CB ALA A 25 -2.527 -1.072 11.930 1.00 2.24 C ATOM 0 H ALA A 25 -2.183 -3.375 11.154 1.00 71.15 H new ATOM 0 HA ALA A 25 -2.232 -2.236 13.719 1.00 40.11 H new ATOM 0 HB1 ALA A 25 -2.781 -0.153 12.458 1.00 2.24 H new ATOM 0 HB2 ALA A 25 -1.465 -1.068 11.686 1.00 2.24 H new ATOM 0 HB3 ALA A 25 -3.110 -1.136 11.011 1.00 2.24 H new ATOM 397 N GLY A 26 -5.180 -2.912 12.510 1.00 61.24 N ATOM 398 CA GLY A 26 -6.609 -2.874 12.801 1.00 54.44 C ATOM 399 C GLY A 26 -7.278 -1.615 12.265 1.00 3.34 C ATOM 400 O GLY A 26 -8.284 -1.149 12.808 1.00 71.12 O ATOM 0 H GLY A 26 -4.921 -3.496 11.715 1.00 61.24 H new ATOM 0 HA2 GLY A 26 -7.089 -3.750 12.366 1.00 54.44 H new ATOM 0 HA3 GLY A 26 -6.759 -2.931 13.879 1.00 54.44 H new ATOM 404 N LEU A 27 -6.721 -1.067 11.189 1.00 32.12 N ATOM 405 CA LEU A 27 -7.221 0.180 10.598 1.00 12.20 C ATOM 406 C LEU A 27 -8.210 -0.100 9.458 1.00 11.41 C ATOM 407 O LEU A 27 -8.964 0.783 9.045 1.00 55.34 O ATOM 408 CB LEU A 27 -6.042 1.025 10.093 1.00 63.43 C ATOM 409 CG LEU A 27 -5.047 1.467 11.183 1.00 10.25 C ATOM 410 CD1 LEU A 27 -3.855 2.201 10.576 1.00 25.40 C ATOM 411 CD2 LEU A 27 -5.742 2.337 12.227 1.00 23.44 C ATOM 0 H LEU A 27 -5.918 -1.466 10.703 1.00 32.12 H new ATOM 0 HA LEU A 27 -7.756 0.735 11.369 1.00 12.20 H new ATOM 0 HB2 LEU A 27 -5.502 0.454 9.338 1.00 63.43 H new ATOM 0 HB3 LEU A 27 -6.436 1.913 9.599 1.00 63.43 H new ATOM 0 HG LEU A 27 -4.672 0.571 11.677 1.00 10.25 H new ATOM 0 HD11 LEU A 27 -3.170 2.501 11.369 1.00 25.40 H new ATOM 0 HD12 LEU A 27 -3.337 1.541 9.880 1.00 25.40 H new ATOM 0 HD13 LEU A 27 -4.205 3.086 10.045 1.00 25.40 H new ATOM 0 HD21 LEU A 27 -5.022 2.638 12.987 1.00 23.44 H new ATOM 0 HD22 LEU A 27 -6.154 3.224 11.746 1.00 23.44 H new ATOM 0 HD23 LEU A 27 -6.548 1.771 12.694 1.00 23.44 H new ATOM 423 N LEU A 28 -8.191 -1.332 8.953 1.00 73.41 N ATOM 424 CA LEU A 28 -9.127 -1.768 7.912 1.00 43.01 C ATOM 425 C LEU A 28 -10.177 -2.735 8.487 1.00 1.14 C ATOM 426 O LEU A 28 -9.842 -3.835 8.926 1.00 73.41 O ATOM 427 CB LEU A 28 -8.361 -2.457 6.769 1.00 12.21 C ATOM 428 CG LEU A 28 -7.396 -1.557 5.977 1.00 54.12 C ATOM 429 CD1 LEU A 28 -6.583 -2.380 4.979 1.00 20.23 C ATOM 430 CD2 LEU A 28 -8.163 -0.448 5.258 1.00 73.43 C ATOM 0 H LEU A 28 -7.533 -2.053 9.249 1.00 73.41 H new ATOM 0 HA LEU A 28 -9.640 -0.887 7.526 1.00 43.01 H new ATOM 0 HB2 LEU A 28 -7.794 -3.289 7.186 1.00 12.21 H new ATOM 0 HB3 LEU A 28 -9.086 -2.882 6.074 1.00 12.21 H new ATOM 0 HG LEU A 28 -6.705 -1.096 6.683 1.00 54.12 H new ATOM 0 HD11 LEU A 28 -5.908 -1.723 4.430 1.00 20.23 H new ATOM 0 HD12 LEU A 28 -6.003 -3.132 5.514 1.00 20.23 H new ATOM 0 HD13 LEU A 28 -7.258 -2.873 4.279 1.00 20.23 H new ATOM 0 HD21 LEU A 28 -7.464 0.178 4.704 1.00 73.43 H new ATOM 0 HD22 LEU A 28 -8.880 -0.891 4.567 1.00 73.43 H new ATOM 0 HD23 LEU A 28 -8.693 0.161 5.990 1.00 73.43 H new ATOM 442 N SER A 29 -11.441 -2.316 8.504 1.00 61.43 N ATOM 443 CA SER A 29 -12.532 -3.202 8.938 1.00 15.31 C ATOM 444 C SER A 29 -12.697 -4.370 7.957 1.00 44.20 C ATOM 445 O SER A 29 -12.393 -4.230 6.779 1.00 14.11 O ATOM 446 CB SER A 29 -13.856 -2.436 9.053 1.00 31.12 C ATOM 447 OG SER A 29 -14.905 -3.292 9.483 1.00 63.54 O ATOM 0 H SER A 29 -11.738 -1.380 8.227 1.00 61.43 H new ATOM 0 HA SER A 29 -12.270 -3.592 9.922 1.00 15.31 H new ATOM 0 HB2 SER A 29 -13.743 -1.612 9.757 1.00 31.12 H new ATOM 0 HB3 SER A 29 -14.112 -1.998 8.088 1.00 31.12 H new ATOM 0 HG SER A 29 -15.738 -2.780 9.550 1.00 63.54 H new ATOM 453 N ASN A 30 -13.201 -5.503 8.444 1.00 64.33 N ATOM 454 CA ASN A 30 -13.295 -6.739 7.639 1.00 73.30 C ATOM 455 C ASN A 30 -13.840 -6.488 6.216 1.00 53.30 C ATOM 456 O ASN A 30 -13.224 -6.893 5.228 1.00 74.23 O ATOM 457 CB ASN A 30 -14.167 -7.766 8.368 1.00 44.13 C ATOM 458 CG ASN A 30 -13.577 -8.164 9.707 1.00 73.51 C ATOM 459 OD1 ASN A 30 -12.365 -8.176 9.888 1.00 42.23 O ATOM 460 ND2 ASN A 30 -14.422 -8.489 10.659 1.00 64.40 N ATOM 0 H ASN A 30 -13.554 -5.599 9.396 1.00 64.33 H new ATOM 0 HA ASN A 30 -12.283 -7.126 7.522 1.00 73.30 H new ATOM 0 HB2 ASN A 30 -15.164 -7.352 8.520 1.00 44.13 H new ATOM 0 HB3 ASN A 30 -14.281 -8.653 7.744 1.00 44.13 H new ATOM 0 HD21 ASN A 30 -14.074 -8.761 11.579 1.00 64.40 H new ATOM 0 HD22 ASN A 30 -15.426 -8.470 10.479 1.00 64.40 H new ATOM 467 N ALA A 31 -14.982 -5.808 6.114 1.00 71.12 N ATOM 468 CA ALA A 31 -15.561 -5.472 4.806 1.00 60.32 C ATOM 469 C ALA A 31 -14.605 -4.601 3.975 1.00 2.40 C ATOM 470 O ALA A 31 -14.320 -4.910 2.820 1.00 14.14 O ATOM 471 CB ALA A 31 -16.903 -4.767 4.978 1.00 15.43 C ATOM 0 H ALA A 31 -15.524 -5.479 6.913 1.00 71.12 H new ATOM 0 HA ALA A 31 -15.720 -6.406 4.266 1.00 60.32 H new ATOM 0 HB1 ALA A 31 -17.316 -4.526 3.998 1.00 15.43 H new ATOM 0 HB2 ALA A 31 -17.592 -5.422 5.511 1.00 15.43 H new ATOM 0 HB3 ALA A 31 -16.761 -3.848 5.547 1.00 15.43 H new ATOM 477 N GLN A 32 -14.102 -3.526 4.583 1.00 10.40 N ATOM 478 CA GLN A 32 -13.165 -2.607 3.915 1.00 34.03 C ATOM 479 C GLN A 32 -11.904 -3.343 3.433 1.00 63.34 C ATOM 480 O GLN A 32 -11.387 -3.078 2.347 1.00 22.21 O ATOM 481 CB GLN A 32 -12.764 -1.478 4.876 1.00 13.34 C ATOM 482 CG GLN A 32 -13.928 -0.602 5.322 1.00 1.44 C ATOM 483 CD GLN A 32 -13.539 0.371 6.425 1.00 15.40 C ATOM 484 OE1 GLN A 32 -12.675 0.084 7.246 1.00 31.34 O ATOM 485 NE2 GLN A 32 -14.173 1.525 6.451 1.00 71.31 N ATOM 0 H GLN A 32 -14.327 -3.265 5.543 1.00 10.40 H new ATOM 0 HA GLN A 32 -13.671 -2.189 3.045 1.00 34.03 H new ATOM 0 HB2 GLN A 32 -12.293 -1.914 5.757 1.00 13.34 H new ATOM 0 HB3 GLN A 32 -12.015 -0.851 4.392 1.00 13.34 H new ATOM 0 HG2 GLN A 32 -14.306 -0.043 4.466 1.00 1.44 H new ATOM 0 HG3 GLN A 32 -14.742 -1.237 5.673 1.00 1.44 H new ATOM 0 HE21 GLN A 32 -14.887 1.731 5.752 1.00 71.31 H new ATOM 0 HE22 GLN A 32 -13.950 2.213 7.170 1.00 71.31 H new ATOM 494 N GLU A 33 -11.420 -4.266 4.257 1.00 71.22 N ATOM 495 CA GLU A 33 -10.249 -5.075 3.928 1.00 14.52 C ATOM 496 C GLU A 33 -10.514 -5.927 2.677 1.00 13.12 C ATOM 497 O GLU A 33 -9.730 -5.910 1.727 1.00 11.23 O ATOM 498 CB GLU A 33 -9.879 -5.966 5.128 1.00 74.14 C ATOM 499 CG GLU A 33 -8.623 -6.817 4.924 1.00 73.50 C ATOM 500 CD GLU A 33 -8.907 -8.312 4.964 1.00 14.45 C ATOM 501 OE1 GLU A 33 -9.500 -8.831 3.997 1.00 5.22 O ATOM 502 OE2 GLU A 33 -8.543 -8.973 5.959 1.00 73.10 O ATOM 0 H GLU A 33 -11.826 -4.475 5.169 1.00 71.22 H new ATOM 0 HA GLU A 33 -9.411 -4.413 3.710 1.00 14.52 H new ATOM 0 HB2 GLU A 33 -9.735 -5.333 6.004 1.00 74.14 H new ATOM 0 HB3 GLU A 33 -10.718 -6.626 5.346 1.00 74.14 H new ATOM 0 HG2 GLU A 33 -8.171 -6.564 3.965 1.00 73.50 H new ATOM 0 HG3 GLU A 33 -7.894 -6.570 5.696 1.00 73.50 H new ATOM 509 N GLU A 34 -11.634 -6.652 2.672 1.00 35.13 N ATOM 510 CA GLU A 34 -12.027 -7.459 1.509 1.00 2.23 C ATOM 511 C GLU A 34 -12.311 -6.573 0.281 1.00 3.41 C ATOM 512 O GLU A 34 -12.101 -6.991 -0.859 1.00 61.23 O ATOM 513 CB GLU A 34 -13.253 -8.321 1.841 1.00 4.24 C ATOM 514 CG GLU A 34 -13.623 -9.324 0.747 1.00 4.00 C ATOM 515 CD GLU A 34 -12.571 -10.418 0.545 1.00 3.13 C ATOM 516 OE1 GLU A 34 -12.507 -11.343 1.387 1.00 22.22 O ATOM 517 OE2 GLU A 34 -11.814 -10.360 -0.455 1.00 54.13 O ATOM 0 H GLU A 34 -12.285 -6.699 3.456 1.00 35.13 H new ATOM 0 HA GLU A 34 -11.192 -8.116 1.263 1.00 2.23 H new ATOM 0 HB2 GLU A 34 -13.063 -8.863 2.767 1.00 4.24 H new ATOM 0 HB3 GLU A 34 -14.106 -7.667 2.023 1.00 4.24 H new ATOM 0 HG2 GLU A 34 -14.576 -9.789 0.998 1.00 4.00 H new ATOM 0 HG3 GLU A 34 -13.766 -8.790 -0.192 1.00 4.00 H new ATOM 524 N VAL A 35 -12.787 -5.345 0.515 1.00 12.13 N ATOM 525 CA VAL A 35 -12.938 -4.356 -0.563 1.00 63.33 C ATOM 526 C VAL A 35 -11.573 -4.029 -1.182 1.00 21.23 C ATOM 527 O VAL A 35 -11.421 -4.004 -2.406 1.00 60.01 O ATOM 528 CB VAL A 35 -13.602 -3.043 -0.063 1.00 32.11 C ATOM 529 CG1 VAL A 35 -13.574 -1.960 -1.145 1.00 0.51 C ATOM 530 CG2 VAL A 35 -15.037 -3.302 0.390 1.00 21.31 C ATOM 0 H VAL A 35 -13.073 -5.012 1.435 1.00 12.13 H new ATOM 0 HA VAL A 35 -13.590 -4.801 -1.314 1.00 63.33 H new ATOM 0 HB VAL A 35 -13.026 -2.685 0.790 1.00 32.11 H new ATOM 0 HG11 VAL A 35 -14.046 -1.054 -0.765 1.00 0.51 H new ATOM 0 HG12 VAL A 35 -12.541 -1.744 -1.417 1.00 0.51 H new ATOM 0 HG13 VAL A 35 -14.116 -2.310 -2.024 1.00 0.51 H new ATOM 0 HG21 VAL A 35 -15.483 -2.370 0.736 1.00 21.31 H new ATOM 0 HG22 VAL A 35 -15.617 -3.694 -0.445 1.00 21.31 H new ATOM 0 HG23 VAL A 35 -15.036 -4.028 1.203 1.00 21.31 H new ATOM 540 N MET A 36 -10.577 -3.789 -0.329 1.00 45.10 N ATOM 541 CA MET A 36 -9.209 -3.571 -0.797 1.00 10.04 C ATOM 542 C MET A 36 -8.703 -4.802 -1.557 1.00 30.24 C ATOM 543 O MET A 36 -8.088 -4.680 -2.615 1.00 35.24 O ATOM 544 CB MET A 36 -8.266 -3.266 0.368 1.00 75.24 C ATOM 545 CG MET A 36 -6.863 -2.901 -0.094 1.00 50.42 C ATOM 546 SD MET A 36 -6.822 -1.325 -0.973 1.00 40.41 S ATOM 547 CE MET A 36 -7.368 -0.201 0.313 1.00 5.52 C ATOM 0 H MET A 36 -10.691 -3.741 0.683 1.00 45.10 H new ATOM 0 HA MET A 36 -9.222 -2.711 -1.466 1.00 10.04 H new ATOM 0 HB2 MET A 36 -8.676 -2.445 0.957 1.00 75.24 H new ATOM 0 HB3 MET A 36 -8.214 -4.134 1.025 1.00 75.24 H new ATOM 0 HG2 MET A 36 -6.200 -2.851 0.770 1.00 50.42 H new ATOM 0 HG3 MET A 36 -6.480 -3.688 -0.744 1.00 50.42 H new ATOM 0 HE1 MET A 36 -6.741 0.690 0.308 1.00 5.52 H new ATOM 0 HE2 MET A 36 -8.404 0.084 0.131 1.00 5.52 H new ATOM 0 HE3 MET A 36 -7.291 -0.693 1.283 1.00 5.52 H new ATOM 557 N ASN A 37 -8.969 -5.991 -1.009 1.00 22.10 N ATOM 558 CA ASN A 37 -8.652 -7.238 -1.707 1.00 25.02 C ATOM 559 C ASN A 37 -9.332 -7.278 -3.075 1.00 73.20 C ATOM 560 O ASN A 37 -8.752 -7.750 -4.037 1.00 71.22 O ATOM 561 CB ASN A 37 -9.059 -8.466 -0.887 1.00 0.04 C ATOM 562 CG ASN A 37 -8.151 -8.697 0.305 1.00 32.23 C ATOM 563 OD1 ASN A 37 -7.087 -9.285 0.178 1.00 35.22 O ATOM 564 ND2 ASN A 37 -8.563 -8.256 1.471 1.00 13.33 N ATOM 0 H ASN A 37 -9.399 -6.115 -0.093 1.00 22.10 H new ATOM 0 HA ASN A 37 -7.571 -7.266 -1.843 1.00 25.02 H new ATOM 0 HB2 ASN A 37 -10.085 -8.343 -0.539 1.00 0.04 H new ATOM 0 HB3 ASN A 37 -9.043 -9.348 -1.528 1.00 0.04 H new ATOM 0 HD21 ASN A 37 -7.990 -8.401 2.302 1.00 13.33 H new ATOM 0 HD22 ASN A 37 -9.456 -7.769 1.545 1.00 13.33 H new ATOM 571 N GLY A 38 -10.562 -6.772 -3.154 1.00 13.02 N ATOM 572 CA GLY A 38 -11.243 -6.656 -4.439 1.00 32.13 C ATOM 573 C GLY A 38 -10.487 -5.758 -5.413 1.00 41.23 C ATOM 574 O GLY A 38 -10.290 -6.113 -6.576 1.00 5.12 O ATOM 0 H GLY A 38 -11.100 -6.440 -2.354 1.00 13.02 H new ATOM 0 HA2 GLY A 38 -11.360 -7.647 -4.877 1.00 32.13 H new ATOM 0 HA3 GLY A 38 -12.245 -6.257 -4.282 1.00 32.13 H new ATOM 578 N ARG A 39 -10.049 -4.596 -4.921 1.00 40.33 N ATOM 579 CA ARG A 39 -9.246 -3.654 -5.715 1.00 10.24 C ATOM 580 C ARG A 39 -7.959 -4.321 -6.235 1.00 11.32 C ATOM 581 O ARG A 39 -7.698 -4.345 -7.439 1.00 23.50 O ATOM 582 CB ARG A 39 -8.872 -2.434 -4.854 1.00 31.01 C ATOM 583 CG ARG A 39 -10.062 -1.691 -4.241 1.00 30.03 C ATOM 584 CD ARG A 39 -10.652 -0.641 -5.181 1.00 63.43 C ATOM 585 NE ARG A 39 -11.253 -1.217 -6.384 1.00 55.53 N ATOM 586 CZ ARG A 39 -11.851 -0.513 -7.309 1.00 3.14 C ATOM 587 NH1 ARG A 39 -11.974 0.770 -7.185 1.00 2.34 N ATOM 588 NH2 ARG A 39 -12.338 -1.098 -8.354 1.00 51.23 N ATOM 0 H ARG A 39 -10.237 -4.281 -3.969 1.00 40.33 H new ATOM 0 HA ARG A 39 -9.844 -3.338 -6.570 1.00 10.24 H new ATOM 0 HB2 ARG A 39 -8.214 -2.763 -4.050 1.00 31.01 H new ATOM 0 HB3 ARG A 39 -8.302 -1.735 -5.467 1.00 31.01 H new ATOM 0 HG2 ARG A 39 -10.836 -2.411 -3.976 1.00 30.03 H new ATOM 0 HG3 ARG A 39 -9.746 -1.208 -3.317 1.00 30.03 H new ATOM 0 HD2 ARG A 39 -11.407 -0.066 -4.645 1.00 63.43 H new ATOM 0 HD3 ARG A 39 -9.868 0.057 -5.473 1.00 63.43 H new ATOM 0 HE ARG A 39 -11.202 -2.228 -6.508 1.00 55.53 H new ATOM 0 HH11 ARG A 39 -11.603 1.241 -6.360 1.00 2.34 H new ATOM 0 HH12 ARG A 39 -12.442 1.310 -7.913 1.00 2.34 H new ATOM 0 HH21 ARG A 39 -12.256 -2.109 -8.457 1.00 51.23 H new ATOM 0 HH22 ARG A 39 -12.805 -0.548 -9.075 1.00 51.23 H new ATOM 602 N LEU A 40 -7.166 -4.869 -5.310 1.00 42.23 N ATOM 603 CA LEU A 40 -5.902 -5.543 -5.652 1.00 13.53 C ATOM 604 C LEU A 40 -6.128 -6.785 -6.539 1.00 4.15 C ATOM 605 O LEU A 40 -5.434 -6.987 -7.536 1.00 73.12 O ATOM 606 CB LEU A 40 -5.169 -5.953 -4.364 1.00 64.21 C ATOM 607 CG LEU A 40 -4.946 -4.821 -3.345 1.00 1.43 C ATOM 608 CD1 LEU A 40 -4.210 -5.334 -2.111 1.00 23.10 C ATOM 609 CD2 LEU A 40 -4.188 -3.660 -3.981 1.00 42.44 C ATOM 0 H LEU A 40 -7.375 -4.861 -4.312 1.00 42.23 H new ATOM 0 HA LEU A 40 -5.296 -4.838 -6.220 1.00 13.53 H new ATOM 0 HB2 LEU A 40 -5.736 -6.748 -3.880 1.00 64.21 H new ATOM 0 HB3 LEU A 40 -4.200 -6.372 -4.635 1.00 64.21 H new ATOM 0 HG LEU A 40 -5.924 -4.457 -3.029 1.00 1.43 H new ATOM 0 HD11 LEU A 40 -4.065 -4.515 -1.407 1.00 23.10 H new ATOM 0 HD12 LEU A 40 -4.798 -6.120 -1.637 1.00 23.10 H new ATOM 0 HD13 LEU A 40 -3.240 -5.735 -2.406 1.00 23.10 H new ATOM 0 HD21 LEU A 40 -4.042 -2.872 -3.242 1.00 42.44 H new ATOM 0 HD22 LEU A 40 -3.218 -4.009 -4.335 1.00 42.44 H new ATOM 0 HD23 LEU A 40 -4.761 -3.268 -4.821 1.00 42.44 H new ATOM 621 N ARG A 41 -7.109 -7.603 -6.163 1.00 63.22 N ATOM 622 CA ARG A 41 -7.431 -8.851 -6.876 1.00 73.15 C ATOM 623 C ARG A 41 -7.869 -8.561 -8.319 1.00 21.22 C ATOM 624 O ARG A 41 -7.486 -9.272 -9.254 1.00 61.32 O ATOM 625 CB ARG A 41 -8.541 -9.598 -6.112 1.00 11.40 C ATOM 626 CG ARG A 41 -8.764 -11.050 -6.526 1.00 41.13 C ATOM 627 CD ARG A 41 -9.768 -11.736 -5.594 1.00 63.45 C ATOM 628 NE ARG A 41 -9.344 -11.669 -4.191 1.00 33.41 N ATOM 629 CZ ARG A 41 -10.135 -11.399 -3.177 1.00 23.01 C ATOM 630 NH1 ARG A 41 -11.395 -11.165 -3.350 1.00 23.02 N ATOM 631 NH2 ARG A 41 -9.656 -11.367 -1.975 1.00 74.15 N ATOM 0 H ARG A 41 -7.707 -7.425 -5.356 1.00 63.22 H new ATOM 0 HA ARG A 41 -6.539 -9.476 -6.922 1.00 73.15 H new ATOM 0 HB2 ARG A 41 -8.304 -9.575 -5.048 1.00 11.40 H new ATOM 0 HB3 ARG A 41 -9.476 -9.054 -6.242 1.00 11.40 H new ATOM 0 HG2 ARG A 41 -9.130 -11.088 -7.552 1.00 41.13 H new ATOM 0 HG3 ARG A 41 -7.816 -11.588 -6.505 1.00 41.13 H new ATOM 0 HD2 ARG A 41 -10.745 -11.264 -5.701 1.00 63.45 H new ATOM 0 HD3 ARG A 41 -9.884 -12.779 -5.889 1.00 63.45 H new ATOM 0 HE ARG A 41 -8.360 -11.845 -3.987 1.00 33.41 H new ATOM 0 HH11 ARG A 41 -11.794 -11.188 -4.289 1.00 23.02 H new ATOM 0 HH12 ARG A 41 -11.990 -10.958 -2.548 1.00 23.02 H new ATOM 0 HH21 ARG A 41 -8.666 -11.551 -1.816 1.00 74.15 H new ATOM 0 HH22 ARG A 41 -10.269 -11.158 -1.187 1.00 74.15 H new ATOM 645 N ALA A 42 -8.667 -7.505 -8.495 1.00 12.42 N ATOM 646 CA ALA A 42 -9.088 -7.060 -9.826 1.00 43.45 C ATOM 647 C ALA A 42 -7.879 -6.647 -10.676 1.00 13.31 C ATOM 648 O ALA A 42 -7.758 -7.046 -11.834 1.00 54.21 O ATOM 649 CB ALA A 42 -10.081 -5.908 -9.714 1.00 34.13 C ATOM 0 H ALA A 42 -9.036 -6.940 -7.730 1.00 12.42 H new ATOM 0 HA ALA A 42 -9.580 -7.896 -10.323 1.00 43.45 H new ATOM 0 HB1 ALA A 42 -10.383 -5.590 -10.712 1.00 34.13 H new ATOM 0 HB2 ALA A 42 -10.958 -6.237 -9.157 1.00 34.13 H new ATOM 0 HB3 ALA A 42 -9.612 -5.073 -9.193 1.00 34.13 H new ATOM 655 N ILE A 43 -6.976 -5.857 -10.092 1.00 61.53 N ATOM 656 CA ILE A 43 -5.733 -5.466 -10.771 1.00 51.32 C ATOM 657 C ILE A 43 -4.892 -6.704 -11.137 1.00 31.15 C ATOM 658 O ILE A 43 -4.380 -6.819 -12.251 1.00 64.23 O ATOM 659 CB ILE A 43 -4.887 -4.511 -9.889 1.00 3.22 C ATOM 660 CG1 ILE A 43 -5.684 -3.233 -9.569 1.00 14.02 C ATOM 661 CG2 ILE A 43 -3.563 -4.167 -10.573 1.00 1.45 C ATOM 662 CD1 ILE A 43 -4.970 -2.277 -8.633 1.00 41.52 C ATOM 0 H ILE A 43 -7.079 -5.475 -9.152 1.00 61.53 H new ATOM 0 HA ILE A 43 -6.016 -4.943 -11.685 1.00 51.32 H new ATOM 0 HB ILE A 43 -4.658 -5.020 -8.953 1.00 3.22 H new ATOM 0 HG12 ILE A 43 -5.907 -2.714 -10.501 1.00 14.02 H new ATOM 0 HG13 ILE A 43 -6.639 -3.515 -9.125 1.00 14.02 H new ATOM 0 HG21 ILE A 43 -2.987 -3.496 -9.935 1.00 1.45 H new ATOM 0 HG22 ILE A 43 -2.994 -5.081 -10.745 1.00 1.45 H new ATOM 0 HG23 ILE A 43 -3.762 -3.679 -11.527 1.00 1.45 H new ATOM 0 HD11 ILE A 43 -5.597 -1.403 -8.458 1.00 41.52 H new ATOM 0 HD12 ILE A 43 -4.771 -2.777 -7.685 1.00 41.52 H new ATOM 0 HD13 ILE A 43 -4.028 -1.963 -9.083 1.00 41.52 H new ATOM 674 N ARG A 44 -4.773 -7.633 -10.189 1.00 71.22 N ATOM 675 CA ARG A 44 -4.044 -8.891 -10.405 1.00 50.05 C ATOM 676 C ARG A 44 -4.691 -9.743 -11.514 1.00 53.20 C ATOM 677 O ARG A 44 -4.017 -10.533 -12.178 1.00 1.23 O ATOM 678 CB ARG A 44 -3.976 -9.686 -9.089 1.00 10.32 C ATOM 679 CG ARG A 44 -3.307 -11.056 -9.205 1.00 22.12 C ATOM 680 CD ARG A 44 -1.853 -10.960 -9.668 1.00 11.34 C ATOM 681 NE ARG A 44 -1.243 -12.281 -9.802 1.00 4.52 N ATOM 682 CZ ARG A 44 -0.056 -12.507 -10.303 1.00 64.15 C ATOM 683 NH1 ARG A 44 0.661 -11.543 -10.784 1.00 21.33 N ATOM 684 NH2 ARG A 44 0.399 -13.715 -10.348 1.00 62.51 N ATOM 0 H ARG A 44 -5.174 -7.540 -9.256 1.00 71.22 H new ATOM 0 HA ARG A 44 -3.034 -8.643 -10.732 1.00 50.05 H new ATOM 0 HB2 ARG A 44 -3.436 -9.094 -8.350 1.00 10.32 H new ATOM 0 HB3 ARG A 44 -4.989 -9.822 -8.710 1.00 10.32 H new ATOM 0 HG2 ARG A 44 -3.345 -11.558 -8.238 1.00 22.12 H new ATOM 0 HG3 ARG A 44 -3.868 -11.673 -9.907 1.00 22.12 H new ATOM 0 HD2 ARG A 44 -1.809 -10.439 -10.625 1.00 11.34 H new ATOM 0 HD3 ARG A 44 -1.282 -10.365 -8.955 1.00 11.34 H new ATOM 0 HE ARG A 44 -1.782 -13.085 -9.482 1.00 4.52 H new ATOM 0 HH11 ARG A 44 0.303 -10.588 -10.776 1.00 21.33 H new ATOM 0 HH12 ARG A 44 1.584 -11.738 -11.171 1.00 21.33 H new ATOM 0 HH21 ARG A 44 -0.167 -14.487 -9.994 1.00 62.51 H new ATOM 0 HH22 ARG A 44 1.324 -13.897 -10.738 1.00 62.51 H new ATOM 698 N SER A 45 -5.995 -9.576 -11.720 1.00 1.02 N ATOM 699 CA SER A 45 -6.718 -10.338 -12.748 1.00 65.32 C ATOM 700 C SER A 45 -6.594 -9.658 -14.116 1.00 72.00 C ATOM 701 O SER A 45 -6.159 -10.269 -15.095 1.00 71.54 O ATOM 702 CB SER A 45 -8.202 -10.481 -12.370 1.00 55.32 C ATOM 703 OG SER A 45 -8.359 -11.182 -11.142 1.00 1.31 O ATOM 0 H SER A 45 -6.576 -8.923 -11.193 1.00 1.02 H new ATOM 0 HA SER A 45 -6.271 -11.330 -12.808 1.00 65.32 H new ATOM 0 HB2 SER A 45 -8.655 -9.493 -12.287 1.00 55.32 H new ATOM 0 HB3 SER A 45 -8.732 -11.009 -13.163 1.00 55.32 H new ATOM 0 HG SER A 45 -8.065 -10.613 -10.400 1.00 1.31 H new ATOM 709 N SER A 46 -6.957 -8.382 -14.160 1.00 72.21 N ATOM 710 CA SER A 46 -6.929 -7.590 -15.396 1.00 70.22 C ATOM 711 C SER A 46 -5.497 -7.254 -15.845 1.00 5.34 C ATOM 712 O SER A 46 -5.096 -7.578 -16.965 1.00 64.32 O ATOM 713 CB SER A 46 -7.716 -6.285 -15.197 1.00 51.25 C ATOM 714 OG SER A 46 -9.079 -6.536 -14.882 1.00 21.33 O ATOM 0 H SER A 46 -7.280 -7.862 -13.344 1.00 72.21 H new ATOM 0 HA SER A 46 -7.388 -8.197 -16.176 1.00 70.22 H new ATOM 0 HB2 SER A 46 -7.259 -5.703 -14.397 1.00 51.25 H new ATOM 0 HB3 SER A 46 -7.657 -5.683 -16.103 1.00 51.25 H new ATOM 0 HG SER A 46 -9.549 -5.685 -14.761 1.00 21.33 H new ATOM 720 N HIS A 47 -4.734 -6.604 -14.966 1.00 34.31 N ATOM 721 CA HIS A 47 -3.392 -6.103 -15.310 1.00 23.52 C ATOM 722 C HIS A 47 -2.282 -7.079 -14.882 1.00 51.14 C ATOM 723 O HIS A 47 -1.117 -6.897 -15.237 1.00 51.24 O ATOM 724 CB HIS A 47 -3.172 -4.738 -14.644 1.00 72.54 C ATOM 725 CG HIS A 47 -4.278 -3.767 -14.917 1.00 12.13 C ATOM 726 ND1 HIS A 47 -5.326 -3.406 -14.134 1.00 53.23 N flip ATOM 727 CD2 HIS A 47 -4.363 -3.100 -16.109 1.00 43.43 C flip ATOM 728 CE1 HIS A 47 -6.067 -2.508 -14.856 1.00 1.43 C flip ATOM 729 NE2 HIS A 47 -5.449 -2.357 -16.035 1.00 14.42 N flip ATOM 0 H HIS A 47 -5.019 -6.409 -14.006 1.00 34.31 H new ATOM 0 HA HIS A 47 -3.339 -6.006 -16.394 1.00 23.52 H new ATOM 0 HB2 HIS A 47 -3.076 -4.877 -13.567 1.00 72.54 H new ATOM 0 HB3 HIS A 47 -2.231 -4.316 -14.996 1.00 72.54 H new ATOM 0 HD1 HIS A 47 -5.524 -3.739 -13.190 1.00 53.23 H new ATOM 0 HD2 HIS A 47 -3.679 -3.169 -16.942 1.00 43.43 H new ATOM 0 HE1 HIS A 47 -6.974 -2.017 -14.536 1.00 1.43 H new ATOM 737 N ALA A 48 -2.654 -8.091 -14.092 1.00 70.10 N ATOM 738 CA ALA A 48 -1.715 -9.131 -13.624 1.00 42.20 C ATOM 739 C ALA A 48 -0.700 -8.604 -12.589 1.00 42.42 C ATOM 740 O ALA A 48 0.144 -9.356 -12.103 1.00 3.22 O ATOM 741 CB ALA A 48 -0.991 -9.780 -14.803 1.00 51.02 C ATOM 0 H ALA A 48 -3.609 -8.218 -13.757 1.00 70.10 H new ATOM 0 HA ALA A 48 -2.317 -9.885 -13.117 1.00 42.20 H new ATOM 0 HB1 ALA A 48 -0.305 -10.542 -14.434 1.00 51.02 H new ATOM 0 HB2 ALA A 48 -1.721 -10.240 -15.469 1.00 51.02 H new ATOM 0 HB3 ALA A 48 -0.430 -9.021 -15.348 1.00 51.02 H new ATOM 747 N VAL A 49 -0.809 -7.328 -12.232 1.00 55.13 N ATOM 748 CA VAL A 49 0.134 -6.694 -11.299 1.00 31.21 C ATOM 749 C VAL A 49 0.031 -7.276 -9.876 1.00 65.25 C ATOM 750 O VAL A 49 -1.067 -7.422 -9.330 1.00 31.10 O ATOM 751 CB VAL A 49 -0.092 -5.160 -11.238 1.00 20.24 C ATOM 752 CG1 VAL A 49 0.860 -4.499 -10.241 1.00 5.42 C ATOM 753 CG2 VAL A 49 0.058 -4.538 -12.627 1.00 20.34 C ATOM 0 H VAL A 49 -1.542 -6.706 -12.573 1.00 55.13 H new ATOM 0 HA VAL A 49 1.132 -6.904 -11.683 1.00 31.21 H new ATOM 0 HB VAL A 49 -1.110 -4.984 -10.891 1.00 20.24 H new ATOM 0 HG11 VAL A 49 0.677 -3.425 -10.221 1.00 5.42 H new ATOM 0 HG12 VAL A 49 0.692 -4.914 -9.247 1.00 5.42 H new ATOM 0 HG13 VAL A 49 1.890 -4.686 -10.543 1.00 5.42 H new ATOM 0 HG21 VAL A 49 -0.104 -3.462 -12.563 1.00 20.34 H new ATOM 0 HG22 VAL A 49 1.061 -4.732 -13.006 1.00 20.34 H new ATOM 0 HG23 VAL A 49 -0.676 -4.976 -13.303 1.00 20.34 H new ATOM 763 N GLU A 50 1.180 -7.611 -9.287 1.00 61.42 N ATOM 764 CA GLU A 50 1.238 -8.068 -7.894 1.00 14.21 C ATOM 765 C GLU A 50 1.235 -6.868 -6.932 1.00 74.13 C ATOM 766 O GLU A 50 2.272 -6.267 -6.665 1.00 14.24 O ATOM 767 CB GLU A 50 2.488 -8.940 -7.671 1.00 63.31 C ATOM 768 CG GLU A 50 2.439 -10.273 -8.411 1.00 73.44 C ATOM 769 CD GLU A 50 3.735 -11.065 -8.311 1.00 33.21 C ATOM 770 OE1 GLU A 50 4.048 -11.562 -7.211 1.00 51.23 O ATOM 771 OE2 GLU A 50 4.430 -11.214 -9.342 1.00 72.03 O ATOM 0 H GLU A 50 2.087 -7.575 -9.753 1.00 61.42 H new ATOM 0 HA GLU A 50 0.354 -8.671 -7.688 1.00 14.21 H new ATOM 0 HB2 GLU A 50 3.370 -8.386 -7.994 1.00 63.31 H new ATOM 0 HB3 GLU A 50 2.603 -9.130 -6.604 1.00 63.31 H new ATOM 0 HG2 GLU A 50 1.622 -10.873 -8.010 1.00 73.44 H new ATOM 0 HG3 GLU A 50 2.214 -10.089 -9.462 1.00 73.44 H new ATOM 778 N PHE A 51 0.055 -6.532 -6.418 1.00 54.32 N ATOM 779 CA PHE A 51 -0.129 -5.336 -5.584 1.00 3.01 C ATOM 780 C PHE A 51 -0.623 -5.729 -4.178 1.00 54.51 C ATOM 781 O PHE A 51 -1.764 -6.149 -4.013 1.00 1.31 O ATOM 782 CB PHE A 51 -1.143 -4.408 -6.284 1.00 24.12 C ATOM 783 CG PHE A 51 -1.261 -3.000 -5.735 1.00 71.25 C ATOM 784 CD1 PHE A 51 -0.599 -2.596 -4.579 1.00 63.22 C ATOM 785 CD2 PHE A 51 -2.053 -2.073 -6.398 1.00 43.13 C ATOM 786 CE1 PHE A 51 -0.731 -1.303 -4.105 1.00 2.24 C ATOM 787 CE2 PHE A 51 -2.187 -0.784 -5.927 1.00 70.13 C ATOM 788 CZ PHE A 51 -1.529 -0.396 -4.780 1.00 13.42 C ATOM 0 H PHE A 51 -0.798 -7.073 -6.563 1.00 54.32 H new ATOM 0 HA PHE A 51 0.821 -4.816 -5.463 1.00 3.01 H new ATOM 0 HB2 PHE A 51 -0.874 -4.342 -7.338 1.00 24.12 H new ATOM 0 HB3 PHE A 51 -2.126 -4.877 -6.235 1.00 24.12 H new ATOM 0 HD1 PHE A 51 0.024 -3.299 -4.047 1.00 63.22 H new ATOM 0 HD2 PHE A 51 -2.573 -2.366 -7.298 1.00 43.13 H new ATOM 0 HE1 PHE A 51 -0.211 -1.001 -3.208 1.00 2.24 H new ATOM 0 HE2 PHE A 51 -2.808 -0.078 -6.458 1.00 70.13 H new ATOM 0 HZ PHE A 51 -1.636 0.613 -4.409 1.00 13.42 H new ATOM 798 N ALA A 52 0.246 -5.596 -3.174 1.00 20.51 N ATOM 799 CA ALA A 52 -0.082 -5.997 -1.796 1.00 12.52 C ATOM 800 C ALA A 52 -0.082 -4.799 -0.833 1.00 14.22 C ATOM 801 O ALA A 52 0.710 -3.869 -0.982 1.00 31.11 O ATOM 802 CB ALA A 52 0.904 -7.059 -1.319 1.00 31.51 C ATOM 0 H ALA A 52 1.185 -5.213 -3.285 1.00 20.51 H new ATOM 0 HA ALA A 52 -1.091 -6.410 -1.800 1.00 12.52 H new ATOM 0 HB1 ALA A 52 0.657 -7.353 -0.299 1.00 31.51 H new ATOM 0 HB2 ALA A 52 0.845 -7.930 -1.972 1.00 31.51 H new ATOM 0 HB3 ALA A 52 1.916 -6.654 -1.345 1.00 31.51 H new ATOM 808 N VAL A 53 -0.968 -4.836 0.165 1.00 11.11 N ATOM 809 CA VAL A 53 -1.088 -3.752 1.151 1.00 22.21 C ATOM 810 C VAL A 53 -1.029 -4.294 2.594 1.00 51.04 C ATOM 811 O VAL A 53 -1.845 -5.128 2.989 1.00 33.24 O ATOM 812 CB VAL A 53 -2.408 -2.956 0.958 1.00 65.50 C ATOM 813 CG1 VAL A 53 -2.529 -1.835 1.990 1.00 13.25 C ATOM 814 CG2 VAL A 53 -2.501 -2.397 -0.463 1.00 22.32 C ATOM 0 H VAL A 53 -1.617 -5.608 0.314 1.00 11.11 H new ATOM 0 HA VAL A 53 -0.242 -3.084 0.988 1.00 22.21 H new ATOM 0 HB VAL A 53 -3.240 -3.643 1.110 1.00 65.50 H new ATOM 0 HG11 VAL A 53 -3.462 -1.294 1.832 1.00 13.25 H new ATOM 0 HG12 VAL A 53 -2.522 -2.262 2.993 1.00 13.25 H new ATOM 0 HG13 VAL A 53 -1.689 -1.149 1.882 1.00 13.25 H new ATOM 0 HG21 VAL A 53 -3.433 -1.843 -0.576 1.00 22.32 H new ATOM 0 HG22 VAL A 53 -1.658 -1.731 -0.648 1.00 22.32 H new ATOM 0 HG23 VAL A 53 -2.478 -3.218 -1.179 1.00 22.32 H new ATOM 824 N VAL A 54 -0.063 -3.811 3.378 1.00 2.22 N ATOM 825 CA VAL A 54 0.121 -4.260 4.768 1.00 34.33 C ATOM 826 C VAL A 54 0.027 -3.082 5.757 1.00 55.53 C ATOM 827 O VAL A 54 0.649 -2.043 5.552 1.00 75.24 O ATOM 828 CB VAL A 54 1.494 -4.959 4.954 1.00 34.42 C ATOM 829 CG1 VAL A 54 1.668 -5.450 6.392 1.00 10.43 C ATOM 830 CG2 VAL A 54 1.650 -6.113 3.964 1.00 12.13 C ATOM 0 H VAL A 54 0.609 -3.106 3.076 1.00 2.22 H new ATOM 0 HA VAL A 54 -0.680 -4.969 4.977 1.00 34.33 H new ATOM 0 HB VAL A 54 2.276 -4.227 4.752 1.00 34.42 H new ATOM 0 HG11 VAL A 54 2.638 -5.936 6.496 1.00 10.43 H new ATOM 0 HG12 VAL A 54 1.612 -4.602 7.075 1.00 10.43 H new ATOM 0 HG13 VAL A 54 0.878 -6.162 6.631 1.00 10.43 H new ATOM 0 HG21 VAL A 54 2.619 -6.590 4.111 1.00 12.13 H new ATOM 0 HG22 VAL A 54 0.858 -6.843 4.129 1.00 12.13 H new ATOM 0 HG23 VAL A 54 1.585 -5.730 2.946 1.00 12.13 H new ATOM 840 N THR A 55 -0.748 -3.250 6.829 1.00 3.01 N ATOM 841 CA THR A 55 -0.893 -2.204 7.857 1.00 52.33 C ATOM 842 C THR A 55 -0.355 -2.678 9.214 1.00 11.33 C ATOM 843 O THR A 55 -0.800 -3.693 9.752 1.00 30.13 O ATOM 844 CB THR A 55 -2.372 -1.770 8.051 1.00 20.11 C ATOM 845 OG1 THR A 55 -3.125 -2.824 8.672 1.00 11.31 O ATOM 846 CG2 THR A 55 -3.017 -1.406 6.717 1.00 43.23 C ATOM 0 H THR A 55 -1.286 -4.097 7.013 1.00 3.01 H new ATOM 0 HA THR A 55 -0.314 -1.353 7.498 1.00 52.33 H new ATOM 0 HB THR A 55 -2.378 -0.890 8.695 1.00 20.11 H new ATOM 0 HG1 THR A 55 -2.518 -3.409 9.172 1.00 11.31 H new ATOM 0 HG21 THR A 55 -4.052 -1.106 6.883 1.00 43.23 H new ATOM 0 HG22 THR A 55 -2.469 -0.582 6.261 1.00 43.23 H new ATOM 0 HG23 THR A 55 -2.992 -2.270 6.053 1.00 43.23 H new ATOM 854 N LEU A 56 0.598 -1.938 9.772 1.00 70.41 N ATOM 855 CA LEU A 56 1.154 -2.267 11.089 1.00 45.35 C ATOM 856 C LEU A 56 0.898 -1.142 12.101 1.00 25.51 C ATOM 857 O LEU A 56 0.908 0.041 11.747 1.00 1.54 O ATOM 858 CB LEU A 56 2.659 -2.523 10.998 1.00 45.23 C ATOM 859 CG LEU A 56 3.089 -3.695 10.110 1.00 74.32 C ATOM 860 CD1 LEU A 56 4.601 -3.851 10.149 1.00 74.41 C ATOM 861 CD2 LEU A 56 2.412 -4.993 10.541 1.00 13.41 C ATOM 0 H LEU A 56 1.003 -1.109 9.338 1.00 70.41 H new ATOM 0 HA LEU A 56 0.652 -3.172 11.430 1.00 45.35 H new ATOM 0 HB2 LEU A 56 3.140 -1.617 10.628 1.00 45.23 H new ATOM 0 HB3 LEU A 56 3.039 -2.697 12.005 1.00 45.23 H new ATOM 0 HG LEU A 56 2.778 -3.478 9.088 1.00 74.32 H new ATOM 0 HD11 LEU A 56 4.897 -4.687 9.515 1.00 74.41 H new ATOM 0 HD12 LEU A 56 5.071 -2.936 9.787 1.00 74.41 H new ATOM 0 HD13 LEU A 56 4.921 -4.042 11.173 1.00 74.41 H new ATOM 0 HD21 LEU A 56 2.737 -5.806 9.892 1.00 13.41 H new ATOM 0 HD22 LEU A 56 2.684 -5.221 11.572 1.00 13.41 H new ATOM 0 HD23 LEU A 56 1.330 -4.881 10.468 1.00 13.41 H new ATOM 873 N PRO A 57 0.668 -1.494 13.381 1.00 64.33 N ATOM 874 CA PRO A 57 0.445 -0.503 14.447 1.00 61.14 C ATOM 875 C PRO A 57 1.732 0.249 14.825 1.00 71.42 C ATOM 876 O PRO A 57 1.725 1.468 15.000 1.00 14.21 O ATOM 877 CB PRO A 57 -0.047 -1.360 15.622 1.00 72.34 C ATOM 878 CG PRO A 57 0.567 -2.698 15.388 1.00 61.40 C ATOM 879 CD PRO A 57 0.598 -2.879 13.893 1.00 34.35 C ATOM 0 HA PRO A 57 -0.256 0.276 14.146 1.00 61.14 H new ATOM 0 HB2 PRO A 57 0.266 -0.941 16.578 1.00 72.34 H new ATOM 0 HB3 PRO A 57 -1.135 -1.420 15.642 1.00 72.34 H new ATOM 0 HG2 PRO A 57 1.571 -2.746 15.809 1.00 61.40 H new ATOM 0 HG3 PRO A 57 -0.017 -3.485 15.865 1.00 61.40 H new ATOM 0 HD2 PRO A 57 1.459 -3.468 13.577 1.00 34.35 H new ATOM 0 HD3 PRO A 57 -0.291 -3.396 13.532 1.00 34.35 H new ATOM 887 N SER A 58 2.840 -0.483 14.938 1.00 62.42 N ATOM 888 CA SER A 58 4.112 0.109 15.361 1.00 4.44 C ATOM 889 C SER A 58 5.316 -0.665 14.816 1.00 11.54 C ATOM 890 O SER A 58 5.279 -1.887 14.703 1.00 61.25 O ATOM 891 CB SER A 58 4.193 0.157 16.894 1.00 30.31 C ATOM 892 OG SER A 58 3.080 0.841 17.451 1.00 35.31 O ATOM 0 H SER A 58 2.884 -1.483 14.744 1.00 62.42 H new ATOM 0 HA SER A 58 4.146 1.120 14.954 1.00 4.44 H new ATOM 0 HB2 SER A 58 4.233 -0.858 17.290 1.00 30.31 H new ATOM 0 HB3 SER A 58 5.115 0.654 17.196 1.00 30.31 H new ATOM 0 HG SER A 58 3.159 0.854 18.428 1.00 35.31 H new ATOM 898 N ILE A 59 6.375 0.063 14.463 1.00 71.52 N ATOM 899 CA ILE A 59 7.658 -0.555 14.087 1.00 62.33 C ATOM 900 C ILE A 59 8.817 0.071 14.885 1.00 45.13 C ATOM 901 O ILE A 59 9.928 -0.463 14.919 1.00 73.52 O ATOM 902 CB ILE A 59 7.943 -0.437 12.565 1.00 13.15 C ATOM 903 CG1 ILE A 59 8.057 1.037 12.139 1.00 74.54 C ATOM 904 CG2 ILE A 59 6.854 -1.150 11.759 1.00 20.11 C ATOM 905 CD1 ILE A 59 8.383 1.225 10.670 1.00 20.34 C ATOM 0 H ILE A 59 6.375 1.082 14.428 1.00 71.52 H new ATOM 0 HA ILE A 59 7.582 -1.615 14.330 1.00 62.33 H new ATOM 0 HB ILE A 59 8.898 -0.921 12.359 1.00 13.15 H new ATOM 0 HG12 ILE A 59 7.118 1.544 12.361 1.00 74.54 H new ATOM 0 HG13 ILE A 59 8.829 1.520 12.738 1.00 74.54 H new ATOM 0 HG21 ILE A 59 7.070 -1.057 10.695 1.00 20.11 H new ATOM 0 HG22 ILE A 59 6.830 -2.205 12.034 1.00 20.11 H new ATOM 0 HG23 ILE A 59 5.886 -0.697 11.974 1.00 20.11 H new ATOM 0 HD11 ILE A 59 8.447 2.290 10.445 1.00 20.34 H new ATOM 0 HD12 ILE A 59 9.337 0.748 10.445 1.00 20.34 H new ATOM 0 HD13 ILE A 59 7.599 0.772 10.063 1.00 20.34 H new ATOM 917 N GLY A 60 8.546 1.215 15.522 1.00 35.34 N ATOM 918 CA GLY A 60 9.519 1.843 16.410 1.00 0.31 C ATOM 919 C GLY A 60 10.746 2.391 15.687 1.00 0.13 C ATOM 920 O GLY A 60 10.640 3.286 14.848 1.00 4.42 O ATOM 0 H GLY A 60 7.664 1.720 15.437 1.00 35.34 H new ATOM 0 HA2 GLY A 60 9.033 2.656 16.950 1.00 0.31 H new ATOM 0 HA3 GLY A 60 9.842 1.115 17.154 1.00 0.31 H new ATOM 924 N ASP A 61 11.911 1.840 16.011 1.00 44.44 N ATOM 925 CA ASP A 61 13.181 2.294 15.435 1.00 53.35 C ATOM 926 C ASP A 61 13.485 1.595 14.099 1.00 10.55 C ATOM 927 O ASP A 61 14.543 1.811 13.501 1.00 21.02 O ATOM 928 CB ASP A 61 14.314 2.037 16.430 1.00 24.11 C ATOM 929 CG ASP A 61 14.081 2.734 17.759 1.00 2.13 C ATOM 930 OD1 ASP A 61 14.512 3.894 17.911 1.00 52.50 O ATOM 931 OD2 ASP A 61 13.471 2.120 18.661 1.00 24.13 O ATOM 0 H ASP A 61 12.006 1.072 16.675 1.00 44.44 H new ATOM 0 HA ASP A 61 13.098 3.362 15.235 1.00 53.35 H new ATOM 0 HB2 ASP A 61 14.412 0.964 16.597 1.00 24.11 H new ATOM 0 HB3 ASP A 61 15.256 2.380 16.002 1.00 24.11 H new ATOM 936 N ALA A 62 12.566 0.752 13.640 1.00 34.13 N ATOM 937 CA ALA A 62 12.729 0.044 12.367 1.00 64.04 C ATOM 938 C ALA A 62 12.545 0.991 11.166 1.00 12.11 C ATOM 939 O ALA A 62 11.491 1.610 11.015 1.00 52.32 O ATOM 940 CB ALA A 62 11.738 -1.110 12.286 1.00 1.42 C ATOM 0 H ALA A 62 11.697 0.539 14.129 1.00 34.13 H new ATOM 0 HA ALA A 62 13.745 -0.348 12.326 1.00 64.04 H new ATOM 0 HB1 ALA A 62 11.864 -1.632 11.338 1.00 1.42 H new ATOM 0 HB2 ALA A 62 11.918 -1.803 13.108 1.00 1.42 H new ATOM 0 HB3 ALA A 62 10.722 -0.722 12.354 1.00 1.42 H new ATOM 946 N PRO A 63 13.568 1.128 10.298 1.00 23.25 N ATOM 947 CA PRO A 63 13.474 1.972 9.089 1.00 53.14 C ATOM 948 C PRO A 63 12.427 1.453 8.082 1.00 0.12 C ATOM 949 O PRO A 63 12.350 0.251 7.807 1.00 33.35 O ATOM 950 CB PRO A 63 14.891 1.911 8.495 1.00 20.52 C ATOM 951 CG PRO A 63 15.497 0.668 9.061 1.00 72.13 C ATOM 952 CD PRO A 63 14.897 0.497 10.429 1.00 21.14 C ATOM 0 HA PRO A 63 13.147 2.985 9.325 1.00 53.14 H new ATOM 0 HB2 PRO A 63 14.861 1.874 7.406 1.00 20.52 H new ATOM 0 HB3 PRO A 63 15.471 2.792 8.768 1.00 20.52 H new ATOM 0 HG2 PRO A 63 15.280 -0.194 8.430 1.00 72.13 H new ATOM 0 HG3 PRO A 63 16.582 0.755 9.119 1.00 72.13 H new ATOM 0 HD2 PRO A 63 14.818 -0.555 10.705 1.00 21.14 H new ATOM 0 HD3 PRO A 63 15.499 0.983 11.196 1.00 21.14 H new ATOM 960 N LEU A 64 11.640 2.370 7.518 1.00 54.04 N ATOM 961 CA LEU A 64 10.522 2.012 6.632 1.00 32.41 C ATOM 962 C LEU A 64 11.005 1.497 5.263 1.00 31.25 C ATOM 963 O LEU A 64 10.554 0.452 4.792 1.00 72.44 O ATOM 964 CB LEU A 64 9.592 3.223 6.445 1.00 3.32 C ATOM 965 CG LEU A 64 8.356 2.983 5.555 1.00 1.23 C ATOM 966 CD1 LEU A 64 7.477 1.871 6.126 1.00 63.24 C ATOM 967 CD2 LEU A 64 7.552 4.273 5.388 1.00 15.44 C ATOM 0 H LEU A 64 11.754 3.374 7.658 1.00 54.04 H new ATOM 0 HA LEU A 64 9.974 1.199 7.108 1.00 32.41 H new ATOM 0 HB2 LEU A 64 9.252 3.552 7.427 1.00 3.32 H new ATOM 0 HB3 LEU A 64 10.172 4.041 6.018 1.00 3.32 H new ATOM 0 HG LEU A 64 8.705 2.666 4.572 1.00 1.23 H new ATOM 0 HD11 LEU A 64 6.612 1.722 5.479 1.00 63.24 H new ATOM 0 HD12 LEU A 64 8.051 0.946 6.183 1.00 63.24 H new ATOM 0 HD13 LEU A 64 7.140 2.150 7.124 1.00 63.24 H new ATOM 0 HD21 LEU A 64 6.684 4.082 4.757 1.00 15.44 H new ATOM 0 HD22 LEU A 64 7.220 4.624 6.365 1.00 15.44 H new ATOM 0 HD23 LEU A 64 8.178 5.034 4.923 1.00 15.44 H new ATOM 979 N GLU A 65 11.919 2.231 4.628 1.00 54.12 N ATOM 980 CA GLU A 65 12.450 1.837 3.312 1.00 30.13 C ATOM 981 C GLU A 65 13.189 0.489 3.373 1.00 1.22 C ATOM 982 O GLU A 65 13.191 -0.279 2.407 1.00 72.34 O ATOM 983 CB GLU A 65 13.376 2.930 2.760 1.00 3.31 C ATOM 984 CG GLU A 65 12.645 4.221 2.398 1.00 52.40 C ATOM 985 CD GLU A 65 13.560 5.281 1.806 1.00 32.51 C ATOM 986 OE1 GLU A 65 14.086 5.061 0.693 1.00 74.12 O ATOM 987 OE2 GLU A 65 13.766 6.330 2.454 1.00 41.10 O ATOM 0 H GLU A 65 12.309 3.098 4.997 1.00 54.12 H new ATOM 0 HA GLU A 65 11.601 1.716 2.639 1.00 30.13 H new ATOM 0 HB2 GLU A 65 14.145 3.152 3.500 1.00 3.31 H new ATOM 0 HB3 GLU A 65 13.886 2.550 1.875 1.00 3.31 H new ATOM 0 HG2 GLU A 65 11.853 3.995 1.685 1.00 52.40 H new ATOM 0 HG3 GLU A 65 12.165 4.622 3.291 1.00 52.40 H new ATOM 994 N ASP A 66 13.830 0.213 4.503 1.00 23.33 N ATOM 995 CA ASP A 66 14.451 -1.090 4.742 1.00 2.45 C ATOM 996 C ASP A 66 13.389 -2.161 5.036 1.00 51.53 C ATOM 997 O ASP A 66 13.506 -3.306 4.595 1.00 43.13 O ATOM 998 CB ASP A 66 15.435 -0.991 5.905 1.00 22.31 C ATOM 999 CG ASP A 66 16.579 -0.044 5.601 1.00 55.33 C ATOM 1000 OD1 ASP A 66 16.353 1.184 5.580 1.00 53.34 O ATOM 1001 OD2 ASP A 66 17.707 -0.520 5.373 1.00 71.13 O ATOM 0 H ASP A 66 13.935 0.875 5.272 1.00 23.33 H new ATOM 0 HA ASP A 66 14.988 -1.385 3.841 1.00 2.45 H new ATOM 0 HB2 ASP A 66 14.909 -0.650 6.797 1.00 22.31 H new ATOM 0 HB3 ASP A 66 15.833 -1.981 6.128 1.00 22.31 H new ATOM 1006 N PHE A 67 12.350 -1.779 5.782 1.00 74.42 N ATOM 1007 CA PHE A 67 11.244 -2.690 6.098 1.00 35.32 C ATOM 1008 C PHE A 67 10.601 -3.244 4.816 1.00 13.23 C ATOM 1009 O PHE A 67 10.478 -4.458 4.641 1.00 32.15 O ATOM 1010 CB PHE A 67 10.182 -1.969 6.943 1.00 5.33 C ATOM 1011 CG PHE A 67 9.025 -2.852 7.341 1.00 50.31 C ATOM 1012 CD1 PHE A 67 7.948 -3.039 6.485 1.00 73.42 C ATOM 1013 CD2 PHE A 67 9.023 -3.504 8.564 1.00 15.25 C ATOM 1014 CE1 PHE A 67 6.898 -3.858 6.841 1.00 14.52 C ATOM 1015 CE2 PHE A 67 7.972 -4.322 8.924 1.00 63.41 C ATOM 1016 CZ PHE A 67 6.911 -4.501 8.060 1.00 61.21 C ATOM 0 H PHE A 67 12.250 -0.845 6.179 1.00 74.42 H new ATOM 0 HA PHE A 67 11.651 -3.525 6.669 1.00 35.32 H new ATOM 0 HB2 PHE A 67 10.653 -1.574 7.843 1.00 5.33 H new ATOM 0 HB3 PHE A 67 9.801 -1.116 6.382 1.00 5.33 H new ATOM 0 HD1 PHE A 67 7.933 -2.537 5.529 1.00 73.42 H new ATOM 0 HD2 PHE A 67 9.853 -3.370 9.242 1.00 15.25 H new ATOM 0 HE1 PHE A 67 6.066 -3.996 6.166 1.00 14.52 H new ATOM 0 HE2 PHE A 67 7.980 -4.822 9.881 1.00 63.41 H new ATOM 0 HZ PHE A 67 6.090 -5.145 8.339 1.00 61.21 H new ATOM 1026 N THR A 68 10.191 -2.336 3.929 1.00 52.30 N ATOM 1027 CA THR A 68 9.588 -2.702 2.637 1.00 74.13 C ATOM 1028 C THR A 68 10.466 -3.699 1.871 1.00 44.23 C ATOM 1029 O THR A 68 9.969 -4.669 1.297 1.00 75.04 O ATOM 1030 CB THR A 68 9.365 -1.444 1.761 1.00 24.21 C ATOM 1031 OG1 THR A 68 10.593 -0.720 1.633 1.00 64.10 O ATOM 1032 CG2 THR A 68 8.295 -0.541 2.369 1.00 20.23 C ATOM 0 H THR A 68 10.265 -1.330 4.080 1.00 52.30 H new ATOM 0 HA THR A 68 8.628 -3.172 2.851 1.00 74.13 H new ATOM 0 HB THR A 68 9.026 -1.765 0.776 1.00 24.21 H new ATOM 0 HG1 THR A 68 10.789 -0.257 2.474 1.00 64.10 H new ATOM 0 HG21 THR A 68 8.156 0.336 1.736 1.00 20.23 H new ATOM 0 HG22 THR A 68 7.355 -1.089 2.442 1.00 20.23 H new ATOM 0 HG23 THR A 68 8.608 -0.224 3.364 1.00 20.23 H new ATOM 1040 N LEU A 69 11.773 -3.457 1.882 1.00 40.31 N ATOM 1041 CA LEU A 69 12.740 -4.371 1.270 1.00 51.42 C ATOM 1042 C LEU A 69 12.658 -5.780 1.885 1.00 73.25 C ATOM 1043 O LEU A 69 12.465 -6.769 1.174 1.00 63.32 O ATOM 1044 CB LEU A 69 14.165 -3.815 1.435 1.00 3.45 C ATOM 1045 CG LEU A 69 15.310 -4.781 1.065 1.00 1.24 C ATOM 1046 CD1 LEU A 69 15.248 -5.170 -0.410 1.00 41.30 C ATOM 1047 CD2 LEU A 69 16.665 -4.165 1.407 1.00 24.23 C ATOM 0 H LEU A 69 12.192 -2.631 2.310 1.00 40.31 H new ATOM 0 HA LEU A 69 12.496 -4.451 0.211 1.00 51.42 H new ATOM 0 HB2 LEU A 69 14.258 -2.919 0.821 1.00 3.45 H new ATOM 0 HB3 LEU A 69 14.296 -3.506 2.472 1.00 3.45 H new ATOM 0 HG LEU A 69 15.187 -5.690 1.654 1.00 1.24 H new ATOM 0 HD11 LEU A 69 16.067 -5.851 -0.641 1.00 41.30 H new ATOM 0 HD12 LEU A 69 14.298 -5.662 -0.617 1.00 41.30 H new ATOM 0 HD13 LEU A 69 15.335 -4.275 -1.026 1.00 41.30 H new ATOM 0 HD21 LEU A 69 17.459 -4.861 1.139 1.00 24.23 H new ATOM 0 HD22 LEU A 69 16.793 -3.236 0.851 1.00 24.23 H new ATOM 0 HD23 LEU A 69 16.711 -3.957 2.476 1.00 24.23 H new ATOM 1059 N LYS A 70 12.786 -5.859 3.210 1.00 51.11 N ATOM 1060 CA LYS A 70 12.858 -7.149 3.909 1.00 21.23 C ATOM 1061 C LYS A 70 11.540 -7.944 3.824 1.00 2.41 C ATOM 1062 O LYS A 70 11.549 -9.159 3.603 1.00 25.12 O ATOM 1063 CB LYS A 70 13.252 -6.938 5.378 1.00 50.41 C ATOM 1064 CG LYS A 70 14.541 -6.137 5.574 1.00 4.21 C ATOM 1065 CD LYS A 70 15.737 -6.769 4.864 1.00 62.13 C ATOM 1066 CE LYS A 70 16.118 -8.127 5.453 1.00 52.14 C ATOM 1067 NZ LYS A 70 16.579 -8.023 6.863 1.00 2.22 N ATOM 0 H LYS A 70 12.842 -5.046 3.824 1.00 51.11 H new ATOM 0 HA LYS A 70 13.623 -7.740 3.406 1.00 21.23 H new ATOM 0 HB2 LYS A 70 12.438 -6.426 5.891 1.00 50.41 H new ATOM 0 HB3 LYS A 70 13.367 -7.911 5.855 1.00 50.41 H new ATOM 0 HG2 LYS A 70 14.395 -5.123 5.201 1.00 4.21 H new ATOM 0 HG3 LYS A 70 14.756 -6.056 6.639 1.00 4.21 H new ATOM 0 HD2 LYS A 70 15.506 -6.888 3.806 1.00 62.13 H new ATOM 0 HD3 LYS A 70 16.592 -6.096 4.930 1.00 62.13 H new ATOM 0 HE2 LYS A 70 15.259 -8.796 5.403 1.00 52.14 H new ATOM 0 HE3 LYS A 70 16.906 -8.574 4.848 1.00 52.14 H new ATOM 0 HZ1 LYS A 70 16.984 -8.933 7.164 1.00 2.22 H new ATOM 0 HZ2 LYS A 70 17.303 -7.280 6.938 1.00 2.22 H new ATOM 0 HZ3 LYS A 70 15.773 -7.784 7.475 1.00 2.22 H new ATOM 1081 N LEU A 71 10.410 -7.262 3.989 1.00 62.11 N ATOM 1082 CA LEU A 71 9.098 -7.922 3.926 1.00 73.31 C ATOM 1083 C LEU A 71 8.783 -8.401 2.500 1.00 1.42 C ATOM 1084 O LEU A 71 8.381 -9.547 2.285 1.00 63.31 O ATOM 1085 CB LEU A 71 7.992 -6.971 4.410 1.00 0.33 C ATOM 1086 CG LEU A 71 6.576 -7.576 4.441 1.00 60.12 C ATOM 1087 CD1 LEU A 71 6.512 -8.760 5.407 1.00 33.53 C ATOM 1088 CD2 LEU A 71 5.541 -6.515 4.814 1.00 10.53 C ATOM 0 H LEU A 71 10.370 -6.258 4.167 1.00 62.11 H new ATOM 0 HA LEU A 71 9.135 -8.792 4.582 1.00 73.31 H new ATOM 0 HB2 LEU A 71 8.245 -6.626 5.413 1.00 0.33 H new ATOM 0 HB3 LEU A 71 7.981 -6.093 3.764 1.00 0.33 H new ATOM 0 HG LEU A 71 6.342 -7.942 3.441 1.00 60.12 H new ATOM 0 HD11 LEU A 71 5.503 -9.171 5.412 1.00 33.53 H new ATOM 0 HD12 LEU A 71 7.215 -9.529 5.087 1.00 33.53 H new ATOM 0 HD13 LEU A 71 6.773 -8.425 6.411 1.00 33.53 H new ATOM 0 HD21 LEU A 71 4.548 -6.965 4.830 1.00 10.53 H new ATOM 0 HD22 LEU A 71 5.772 -6.112 5.800 1.00 10.53 H new ATOM 0 HD23 LEU A 71 5.563 -5.711 4.079 1.00 10.53 H new ATOM 1100 N ALA A 72 8.977 -7.525 1.522 1.00 13.23 N ATOM 1101 CA ALA A 72 8.659 -7.849 0.133 1.00 43.30 C ATOM 1102 C ALA A 72 9.599 -8.916 -0.451 1.00 51.24 C ATOM 1103 O ALA A 72 9.191 -9.699 -1.310 1.00 1.20 O ATOM 1104 CB ALA A 72 8.696 -6.592 -0.718 1.00 62.35 C ATOM 0 H ALA A 72 9.352 -6.587 1.662 1.00 13.23 H new ATOM 0 HA ALA A 72 7.653 -8.268 0.121 1.00 43.30 H new ATOM 0 HB1 ALA A 72 8.458 -6.845 -1.751 1.00 62.35 H new ATOM 0 HB2 ALA A 72 7.965 -5.876 -0.342 1.00 62.35 H new ATOM 0 HB3 ALA A 72 9.692 -6.151 -0.673 1.00 62.35 H new ATOM 1110 N ARG A 73 10.851 -8.950 0.012 1.00 30.04 N ATOM 1111 CA ARG A 73 11.819 -9.936 -0.489 1.00 1.25 C ATOM 1112 C ARG A 73 11.478 -11.355 -0.004 1.00 52.34 C ATOM 1113 O ARG A 73 11.606 -12.320 -0.758 1.00 31.42 O ATOM 1114 CB ARG A 73 13.258 -9.567 -0.086 1.00 11.44 C ATOM 1115 CG ARG A 73 13.557 -9.693 1.404 1.00 24.23 C ATOM 1116 CD ARG A 73 14.979 -9.255 1.734 1.00 32.22 C ATOM 1117 NE ARG A 73 15.973 -10.047 1.017 1.00 62.50 N ATOM 1118 CZ ARG A 73 16.977 -9.544 0.353 1.00 5.34 C ATOM 1119 NH1 ARG A 73 17.159 -8.265 0.292 1.00 11.34 N ATOM 1120 NH2 ARG A 73 17.801 -10.330 -0.252 1.00 13.53 N ATOM 0 H ARG A 73 11.217 -8.317 0.723 1.00 30.04 H new ATOM 0 HA ARG A 73 11.754 -9.922 -1.577 1.00 1.25 H new ATOM 0 HB2 ARG A 73 13.949 -10.205 -0.636 1.00 11.44 H new ATOM 0 HB3 ARG A 73 13.456 -8.541 -0.396 1.00 11.44 H new ATOM 0 HG2 ARG A 73 12.849 -9.087 1.969 1.00 24.23 H new ATOM 0 HG3 ARG A 73 13.413 -10.727 1.718 1.00 24.23 H new ATOM 0 HD2 ARG A 73 15.102 -8.202 1.481 1.00 32.22 H new ATOM 0 HD3 ARG A 73 15.147 -9.347 2.807 1.00 32.22 H new ATOM 0 HE ARG A 73 15.876 -11.062 1.036 1.00 62.50 H new ATOM 0 HH11 ARG A 73 16.513 -7.635 0.767 1.00 11.34 H new ATOM 0 HH12 ARG A 73 17.949 -7.887 -0.231 1.00 11.34 H new ATOM 0 HH21 ARG A 73 17.666 -11.340 -0.210 1.00 13.53 H new ATOM 0 HH22 ARG A 73 18.588 -9.942 -0.772 1.00 13.53 H new ATOM 1134 N GLN A 74 11.030 -11.483 1.249 1.00 20.11 N ATOM 1135 CA GLN A 74 10.642 -12.794 1.787 1.00 33.22 C ATOM 1136 C GLN A 74 9.312 -13.267 1.170 1.00 22.32 C ATOM 1137 O GLN A 74 9.025 -14.466 1.119 1.00 13.42 O ATOM 1138 CB GLN A 74 10.541 -12.760 3.323 1.00 53.41 C ATOM 1139 CG GLN A 74 9.387 -11.920 3.861 1.00 10.41 C ATOM 1140 CD GLN A 74 9.180 -12.070 5.361 1.00 32.41 C ATOM 1141 OE1 GLN A 74 10.252 -12.240 6.109 1.00 24.44 O flip ATOM 1142 NE2 GLN A 74 8.058 -12.013 5.850 1.00 51.25 N flip ATOM 0 H GLN A 74 10.927 -10.707 1.903 1.00 20.11 H new ATOM 0 HA GLN A 74 11.422 -13.506 1.516 1.00 33.22 H new ATOM 0 HB2 GLN A 74 10.433 -13.781 3.690 1.00 53.41 H new ATOM 0 HB3 GLN A 74 11.476 -12.372 3.728 1.00 53.41 H new ATOM 0 HG2 GLN A 74 9.572 -10.871 3.630 1.00 10.41 H new ATOM 0 HG3 GLN A 74 8.470 -12.203 3.345 1.00 10.41 H new ATOM 0 HE21 GLN A 74 7.245 -11.881 5.248 1.00 51.25 H new ATOM 0 HE22 GLN A 74 7.937 -12.098 6.859 1.00 51.25 H new ATOM 1151 N TRP A 75 8.496 -12.313 0.708 1.00 31.43 N ATOM 1152 CA TRP A 75 7.264 -12.632 -0.032 1.00 60.15 C ATOM 1153 C TRP A 75 7.537 -12.755 -1.542 1.00 53.53 C ATOM 1154 O TRP A 75 6.734 -13.325 -2.281 1.00 44.13 O ATOM 1155 CB TRP A 75 6.197 -11.546 0.204 1.00 34.52 C ATOM 1156 CG TRP A 75 5.671 -11.478 1.610 1.00 53.02 C ATOM 1157 CD1 TRP A 75 6.170 -12.111 2.712 1.00 62.41 C ATOM 1158 CD2 TRP A 75 4.536 -10.728 2.061 1.00 72.55 C ATOM 1159 NE1 TRP A 75 5.419 -11.800 3.817 1.00 73.32 N ATOM 1160 CE2 TRP A 75 4.408 -10.955 3.443 1.00 34.15 C ATOM 1161 CE3 TRP A 75 3.614 -9.888 1.429 1.00 2.01 C ATOM 1162 CZ2 TRP A 75 3.401 -10.369 4.204 1.00 3.44 C ATOM 1163 CZ3 TRP A 75 2.613 -9.308 2.185 1.00 51.14 C ATOM 1164 CH2 TRP A 75 2.512 -9.553 3.560 1.00 73.22 C ATOM 0 H TRP A 75 8.664 -11.315 0.832 1.00 31.43 H new ATOM 0 HA TRP A 75 6.898 -13.590 0.338 1.00 60.15 H new ATOM 0 HB2 TRP A 75 6.621 -10.577 -0.058 1.00 34.52 H new ATOM 0 HB3 TRP A 75 5.362 -11.723 -0.474 1.00 34.52 H new ATOM 0 HD1 TRP A 75 7.031 -12.762 2.714 1.00 62.41 H new ATOM 0 HE1 TRP A 75 5.586 -12.142 4.763 1.00 73.32 H new ATOM 0 HE3 TRP A 75 3.683 -9.696 0.368 1.00 2.01 H new ATOM 0 HZ2 TRP A 75 3.324 -10.552 5.266 1.00 3.44 H new ATOM 0 HZ3 TRP A 75 1.897 -8.655 1.708 1.00 51.14 H new ATOM 0 HH2 TRP A 75 1.716 -9.088 4.123 1.00 73.22 H new ATOM 1175 N GLY A 76 8.680 -12.228 -1.985 1.00 33.01 N ATOM 1176 CA GLY A 76 9.044 -12.275 -3.399 1.00 73.13 C ATOM 1177 C GLY A 76 8.088 -11.496 -4.304 1.00 30.05 C ATOM 1178 O GLY A 76 7.795 -11.926 -5.419 1.00 74.40 O ATOM 0 H GLY A 76 9.365 -11.766 -1.387 1.00 33.01 H new ATOM 0 HA2 GLY A 76 10.051 -11.876 -3.520 1.00 73.13 H new ATOM 0 HA3 GLY A 76 9.072 -13.315 -3.724 1.00 73.13 H new ATOM 1182 N VAL A 77 7.608 -10.343 -3.831 1.00 34.05 N ATOM 1183 CA VAL A 77 6.629 -9.544 -4.587 1.00 42.05 C ATOM 1184 C VAL A 77 7.246 -8.247 -5.149 1.00 23.11 C ATOM 1185 O VAL A 77 7.742 -8.221 -6.278 1.00 2.04 O ATOM 1186 CB VAL A 77 5.397 -9.193 -3.710 1.00 65.43 C ATOM 1187 CG1 VAL A 77 4.336 -8.442 -4.518 1.00 13.25 C ATOM 1188 CG2 VAL A 77 4.809 -10.453 -3.079 1.00 71.22 C ATOM 0 H VAL A 77 7.877 -9.940 -2.933 1.00 34.05 H new ATOM 0 HA VAL A 77 6.310 -10.161 -5.427 1.00 42.05 H new ATOM 0 HB VAL A 77 5.732 -8.533 -2.910 1.00 65.43 H new ATOM 0 HG11 VAL A 77 3.486 -8.211 -3.876 1.00 13.25 H new ATOM 0 HG12 VAL A 77 4.761 -7.516 -4.905 1.00 13.25 H new ATOM 0 HG13 VAL A 77 4.004 -9.064 -5.349 1.00 13.25 H new ATOM 0 HG21 VAL A 77 3.947 -10.186 -2.468 1.00 71.22 H new ATOM 0 HG22 VAL A 77 4.498 -11.142 -3.864 1.00 71.22 H new ATOM 0 HG23 VAL A 77 5.562 -10.932 -2.453 1.00 71.22 H new ATOM 1256 N ASN A 82 12.706 -7.119 -8.882 1.00 40.32 N ATOM 1257 CA ASN A 82 11.583 -8.008 -9.183 1.00 31.11 C ATOM 1258 C ASN A 82 10.848 -7.595 -10.471 1.00 5.32 C ATOM 1259 O ASN A 82 11.351 -6.808 -11.266 1.00 63.04 O ATOM 1260 CB ASN A 82 10.603 -8.023 -8.010 1.00 52.21 C ATOM 1261 CG ASN A 82 11.159 -8.722 -6.785 1.00 34.01 C ATOM 1262 OD1 ASN A 82 12.355 -8.689 -6.520 1.00 61.03 O ATOM 1263 ND2 ASN A 82 10.294 -9.363 -6.023 1.00 25.43 N ATOM 0 HA ASN A 82 11.988 -9.007 -9.340 1.00 31.11 H new ATOM 0 HB2 ASN A 82 10.341 -6.998 -7.749 1.00 52.21 H new ATOM 0 HB3 ASN A 82 9.683 -8.519 -8.318 1.00 52.21 H new ATOM 0 HD21 ASN A 82 10.614 -9.850 -5.186 1.00 25.43 H new ATOM 0 HD22 ASN A 82 9.305 -9.372 -6.271 1.00 25.43 H new ATOM 1270 N ASN A 83 9.660 -8.155 -10.672 1.00 53.51 N ATOM 1271 CA ASN A 83 8.815 -7.829 -11.827 1.00 73.22 C ATOM 1272 C ASN A 83 7.746 -6.777 -11.456 1.00 22.11 C ATOM 1273 O ASN A 83 8.046 -5.809 -10.760 1.00 12.02 O ATOM 1274 CB ASN A 83 8.175 -9.118 -12.348 1.00 13.51 C ATOM 1275 CG ASN A 83 7.472 -9.895 -11.248 1.00 24.21 C ATOM 1276 OD1 ASN A 83 6.181 -9.686 -11.095 1.00 12.21 O flip ATOM 1277 ND2 ASN A 83 8.089 -10.686 -10.545 1.00 52.05 N flip ATOM 0 H ASN A 83 9.252 -8.847 -10.043 1.00 53.51 H new ATOM 0 HA ASN A 83 9.428 -7.389 -12.614 1.00 73.22 H new ATOM 0 HB2 ASN A 83 7.459 -8.875 -13.133 1.00 13.51 H new ATOM 0 HB3 ASN A 83 8.943 -9.746 -12.800 1.00 13.51 H new ATOM 0 HD21 ASN A 83 9.089 -10.824 -10.690 1.00 52.05 H new ATOM 0 HD22 ASN A 83 7.603 -11.206 -9.815 1.00 52.05 H new ATOM 1284 N ASN A 84 6.516 -6.941 -11.953 1.00 43.32 N ATOM 1285 CA ASN A 84 5.397 -6.026 -11.636 1.00 30.52 C ATOM 1286 C ASN A 84 4.920 -6.127 -10.166 1.00 3.13 C ATOM 1287 O ASN A 84 3.720 -6.118 -9.894 1.00 24.22 O ATOM 1288 CB ASN A 84 4.222 -6.318 -12.579 1.00 41.12 C ATOM 1289 CG ASN A 84 3.784 -7.770 -12.506 1.00 52.44 C ATOM 1290 OD1 ASN A 84 2.948 -8.145 -11.697 1.00 21.03 O ATOM 1291 ND2 ASN A 84 4.357 -8.601 -13.347 1.00 4.32 N ATOM 0 H ASN A 84 6.262 -7.703 -12.582 1.00 43.32 H new ATOM 0 HA ASN A 84 5.766 -5.010 -11.776 1.00 30.52 H new ATOM 0 HB2 ASN A 84 3.382 -5.672 -12.323 1.00 41.12 H new ATOM 0 HB3 ASN A 84 4.509 -6.077 -13.602 1.00 41.12 H new ATOM 0 HD21 ASN A 84 4.107 -9.590 -13.337 1.00 4.32 H new ATOM 0 HD22 ASN A 84 5.051 -8.257 -14.010 1.00 4.32 H new ATOM 1298 N GLY A 85 5.854 -6.183 -9.223 1.00 41.11 N ATOM 1299 CA GLY A 85 5.492 -6.256 -7.814 1.00 61.42 C ATOM 1300 C GLY A 85 5.413 -4.882 -7.153 1.00 15.33 C ATOM 1301 O GLY A 85 6.243 -4.010 -7.422 1.00 33.52 O ATOM 0 H GLY A 85 6.857 -6.179 -9.406 1.00 41.11 H new ATOM 0 HA2 GLY A 85 4.529 -6.757 -7.716 1.00 61.42 H new ATOM 0 HA3 GLY A 85 6.224 -6.867 -7.286 1.00 61.42 H new ATOM 1305 N LEU A 86 4.421 -4.694 -6.286 1.00 13.22 N ATOM 1306 CA LEU A 86 4.227 -3.428 -5.571 1.00 14.11 C ATOM 1307 C LEU A 86 3.742 -3.675 -4.134 1.00 14.53 C ATOM 1308 O LEU A 86 2.687 -4.272 -3.917 1.00 11.43 O ATOM 1309 CB LEU A 86 3.220 -2.540 -6.323 1.00 45.43 C ATOM 1310 CG LEU A 86 2.887 -1.193 -5.654 1.00 64.11 C ATOM 1311 CD1 LEU A 86 4.152 -0.373 -5.424 1.00 54.13 C ATOM 1312 CD2 LEU A 86 1.883 -0.410 -6.500 1.00 32.40 C ATOM 0 H LEU A 86 3.730 -5.409 -6.058 1.00 13.22 H new ATOM 0 HA LEU A 86 5.188 -2.916 -5.524 1.00 14.11 H new ATOM 0 HB2 LEU A 86 3.612 -2.342 -7.320 1.00 45.43 H new ATOM 0 HB3 LEU A 86 2.294 -3.100 -6.450 1.00 45.43 H new ATOM 0 HG LEU A 86 2.436 -1.397 -4.683 1.00 64.11 H new ATOM 0 HD11 LEU A 86 3.891 0.574 -4.951 1.00 54.13 H new ATOM 0 HD12 LEU A 86 4.832 -0.927 -4.777 1.00 54.13 H new ATOM 0 HD13 LEU A 86 4.638 -0.179 -6.380 1.00 54.13 H new ATOM 0 HD21 LEU A 86 1.659 0.539 -6.013 1.00 32.40 H new ATOM 0 HD22 LEU A 86 2.308 -0.220 -7.486 1.00 32.40 H new ATOM 0 HD23 LEU A 86 0.966 -0.989 -6.605 1.00 32.40 H new ATOM 1324 N LEU A 87 4.522 -3.222 -3.156 1.00 41.50 N ATOM 1325 CA LEU A 87 4.154 -3.369 -1.742 1.00 42.23 C ATOM 1326 C LEU A 87 3.839 -2.005 -1.104 1.00 65.52 C ATOM 1327 O LEU A 87 4.671 -1.098 -1.111 1.00 51.11 O ATOM 1328 CB LEU A 87 5.286 -4.062 -0.967 1.00 1.31 C ATOM 1329 CG LEU A 87 5.004 -4.311 0.528 1.00 65.12 C ATOM 1330 CD1 LEU A 87 3.830 -5.276 0.712 1.00 53.33 C ATOM 1331 CD2 LEU A 87 6.251 -4.834 1.237 1.00 64.01 C ATOM 0 H LEU A 87 5.413 -2.750 -3.312 1.00 41.50 H new ATOM 0 HA LEU A 87 3.256 -3.984 -1.692 1.00 42.23 H new ATOM 0 HB2 LEU A 87 5.498 -5.019 -1.444 1.00 1.31 H new ATOM 0 HB3 LEU A 87 6.188 -3.456 -1.054 1.00 1.31 H new ATOM 0 HG LEU A 87 4.731 -3.358 0.981 1.00 65.12 H new ATOM 0 HD11 LEU A 87 3.652 -5.434 1.776 1.00 53.33 H new ATOM 0 HD12 LEU A 87 2.936 -4.853 0.254 1.00 53.33 H new ATOM 0 HD13 LEU A 87 4.064 -6.229 0.238 1.00 53.33 H new ATOM 0 HD21 LEU A 87 6.027 -5.002 2.290 1.00 64.01 H new ATOM 0 HD22 LEU A 87 6.564 -5.772 0.778 1.00 64.01 H new ATOM 0 HD23 LEU A 87 7.054 -4.102 1.149 1.00 64.01 H new ATOM 1343 N LEU A 88 2.630 -1.871 -0.566 1.00 32.22 N ATOM 1344 CA LEU A 88 2.209 -0.656 0.139 1.00 72.10 C ATOM 1345 C LEU A 88 2.073 -0.921 1.647 1.00 75.21 C ATOM 1346 O LEU A 88 1.130 -1.580 2.091 1.00 13.04 O ATOM 1347 CB LEU A 88 0.876 -0.152 -0.434 1.00 4.55 C ATOM 1348 CG LEU A 88 0.250 1.053 0.293 1.00 2.42 C ATOM 1349 CD1 LEU A 88 1.195 2.253 0.277 1.00 12.11 C ATOM 1350 CD2 LEU A 88 -1.099 1.415 -0.326 1.00 71.21 C ATOM 0 H LEU A 88 1.914 -2.597 -0.604 1.00 32.22 H new ATOM 0 HA LEU A 88 2.971 0.110 -0.006 1.00 72.10 H new ATOM 0 HB2 LEU A 88 1.029 0.117 -1.479 1.00 4.55 H new ATOM 0 HB3 LEU A 88 0.161 -0.974 -0.418 1.00 4.55 H new ATOM 0 HG LEU A 88 0.084 0.772 1.333 1.00 2.42 H new ATOM 0 HD11 LEU A 88 0.729 3.090 0.797 1.00 12.11 H new ATOM 0 HD12 LEU A 88 2.127 1.989 0.777 1.00 12.11 H new ATOM 0 HD13 LEU A 88 1.404 2.537 -0.754 1.00 12.11 H new ATOM 0 HD21 LEU A 88 -1.524 2.268 0.202 1.00 71.21 H new ATOM 0 HD22 LEU A 88 -0.960 1.671 -1.377 1.00 71.21 H new ATOM 0 HD23 LEU A 88 -1.776 0.565 -0.246 1.00 71.21 H new ATOM 1362 N VAL A 89 3.022 -0.417 2.430 1.00 32.45 N ATOM 1363 CA VAL A 89 3.016 -0.627 3.884 1.00 0.23 C ATOM 1364 C VAL A 89 2.630 0.649 4.646 1.00 73.11 C ATOM 1365 O VAL A 89 3.328 1.661 4.573 1.00 41.32 O ATOM 1366 CB VAL A 89 4.396 -1.117 4.396 1.00 43.15 C ATOM 1367 CG1 VAL A 89 4.368 -1.336 5.911 1.00 32.54 C ATOM 1368 CG2 VAL A 89 4.821 -2.392 3.670 1.00 45.02 C ATOM 0 H VAL A 89 3.806 0.139 2.088 1.00 32.45 H new ATOM 0 HA VAL A 89 2.266 -1.395 4.075 1.00 0.23 H new ATOM 0 HB VAL A 89 5.132 -0.343 4.181 1.00 43.15 H new ATOM 0 HG11 VAL A 89 5.346 -1.679 6.247 1.00 32.54 H new ATOM 0 HG12 VAL A 89 4.121 -0.399 6.410 1.00 32.54 H new ATOM 0 HG13 VAL A 89 3.616 -2.086 6.156 1.00 32.54 H new ATOM 0 HG21 VAL A 89 5.791 -2.718 4.045 1.00 45.02 H new ATOM 0 HG22 VAL A 89 4.083 -3.174 3.846 1.00 45.02 H new ATOM 0 HG23 VAL A 89 4.893 -2.195 2.600 1.00 45.02 H new ATOM 1378 N LEU A 90 1.513 0.589 5.371 1.00 60.41 N ATOM 1379 CA LEU A 90 1.080 1.685 6.245 1.00 64.01 C ATOM 1380 C LEU A 90 1.514 1.426 7.695 1.00 43.10 C ATOM 1381 O LEU A 90 1.155 0.408 8.289 1.00 33.43 O ATOM 1382 CB LEU A 90 -0.448 1.850 6.194 1.00 55.21 C ATOM 1383 CG LEU A 90 -1.034 2.817 7.245 1.00 22.23 C ATOM 1384 CD1 LEU A 90 -0.670 4.268 6.945 1.00 72.22 C ATOM 1385 CD2 LEU A 90 -2.546 2.651 7.359 1.00 54.42 C ATOM 0 H LEU A 90 0.885 -0.214 5.371 1.00 60.41 H new ATOM 0 HA LEU A 90 1.551 2.601 5.888 1.00 64.01 H new ATOM 0 HB2 LEU A 90 -0.728 2.203 5.201 1.00 55.21 H new ATOM 0 HB3 LEU A 90 -0.909 0.871 6.326 1.00 55.21 H new ATOM 0 HG LEU A 90 -0.588 2.559 8.205 1.00 22.23 H new ATOM 0 HD11 LEU A 90 -1.101 4.916 7.708 1.00 72.22 H new ATOM 0 HD12 LEU A 90 0.414 4.379 6.946 1.00 72.22 H new ATOM 0 HD13 LEU A 90 -1.063 4.547 5.967 1.00 72.22 H new ATOM 0 HD21 LEU A 90 -2.933 3.344 8.106 1.00 54.42 H new ATOM 0 HD22 LEU A 90 -3.009 2.861 6.395 1.00 54.42 H new ATOM 0 HD23 LEU A 90 -2.778 1.629 7.658 1.00 54.42 H new ATOM 1397 N VAL A 91 2.279 2.350 8.263 1.00 25.54 N ATOM 1398 CA VAL A 91 2.722 2.237 9.655 1.00 52.03 C ATOM 1399 C VAL A 91 2.049 3.299 10.540 1.00 22.33 C ATOM 1400 O VAL A 91 2.437 4.470 10.523 1.00 71.31 O ATOM 1401 CB VAL A 91 4.262 2.374 9.767 1.00 3.33 C ATOM 1402 CG1 VAL A 91 4.719 2.224 11.217 1.00 23.12 C ATOM 1403 CG2 VAL A 91 4.962 1.355 8.868 1.00 63.23 C ATOM 0 H VAL A 91 2.608 3.188 7.784 1.00 25.54 H new ATOM 0 HA VAL A 91 2.429 1.247 10.004 1.00 52.03 H new ATOM 0 HB VAL A 91 4.539 3.373 9.429 1.00 3.33 H new ATOM 0 HG11 VAL A 91 5.803 2.324 11.269 1.00 23.12 H new ATOM 0 HG12 VAL A 91 4.253 2.998 11.827 1.00 23.12 H new ATOM 0 HG13 VAL A 91 4.427 1.243 11.591 1.00 23.12 H new ATOM 0 HG21 VAL A 91 6.042 1.468 8.962 1.00 63.23 H new ATOM 0 HG22 VAL A 91 4.676 0.347 9.169 1.00 63.23 H new ATOM 0 HG23 VAL A 91 4.668 1.522 7.832 1.00 63.23 H new ATOM 1413 N LEU A 92 1.045 2.877 11.313 1.00 1.52 N ATOM 1414 CA LEU A 92 0.307 3.774 12.220 1.00 61.43 C ATOM 1415 C LEU A 92 1.267 4.564 13.133 1.00 12.23 C ATOM 1416 O LEU A 92 1.089 5.761 13.355 1.00 5.34 O ATOM 1417 CB LEU A 92 -0.680 2.952 13.065 1.00 44.22 C ATOM 1418 CG LEU A 92 -1.483 3.736 14.119 1.00 54.05 C ATOM 1419 CD1 LEU A 92 -2.355 4.801 13.459 1.00 72.34 C ATOM 1420 CD2 LEU A 92 -2.333 2.784 14.962 1.00 35.33 C ATOM 0 H LEU A 92 0.719 1.911 11.332 1.00 1.52 H new ATOM 0 HA LEU A 92 -0.244 4.497 11.618 1.00 61.43 H new ATOM 0 HB2 LEU A 92 -1.383 2.462 12.392 1.00 44.22 H new ATOM 0 HB3 LEU A 92 -0.124 2.164 13.573 1.00 44.22 H new ATOM 0 HG LEU A 92 -0.778 4.242 14.778 1.00 54.05 H new ATOM 0 HD11 LEU A 92 -2.912 5.341 14.225 1.00 72.34 H new ATOM 0 HD12 LEU A 92 -1.723 5.499 12.910 1.00 72.34 H new ATOM 0 HD13 LEU A 92 -3.053 4.324 12.771 1.00 72.34 H new ATOM 0 HD21 LEU A 92 -2.894 3.355 15.702 1.00 35.33 H new ATOM 0 HD22 LEU A 92 -3.027 2.247 14.316 1.00 35.33 H new ATOM 0 HD23 LEU A 92 -1.684 2.070 15.470 1.00 35.33 H new ATOM 1432 N ASP A 93 2.288 3.871 13.636 1.00 31.13 N ATOM 1433 CA ASP A 93 3.345 4.470 14.473 1.00 23.53 C ATOM 1434 C ASP A 93 3.874 5.798 13.893 1.00 54.33 C ATOM 1435 O ASP A 93 4.073 6.775 14.619 1.00 25.22 O ATOM 1436 CB ASP A 93 4.481 3.447 14.604 1.00 53.31 C ATOM 1437 CG ASP A 93 5.666 3.925 15.421 1.00 4.21 C ATOM 1438 OD1 ASP A 93 5.458 4.599 16.445 1.00 3.11 O ATOM 1439 OD2 ASP A 93 6.814 3.593 15.049 1.00 70.02 O ATOM 0 H ASP A 93 2.412 2.871 13.477 1.00 31.13 H new ATOM 0 HA ASP A 93 2.927 4.711 15.450 1.00 23.53 H new ATOM 0 HB2 ASP A 93 4.085 2.539 15.059 1.00 53.31 H new ATOM 0 HB3 ASP A 93 4.828 3.179 13.606 1.00 53.31 H new ATOM 1444 N GLN A 94 4.093 5.830 12.581 1.00 41.42 N ATOM 1445 CA GLN A 94 4.589 7.037 11.904 1.00 13.51 C ATOM 1446 C GLN A 94 3.487 7.730 11.087 1.00 43.42 C ATOM 1447 O GLN A 94 3.702 8.818 10.550 1.00 22.51 O ATOM 1448 CB GLN A 94 5.760 6.679 10.975 1.00 64.52 C ATOM 1449 CG GLN A 94 7.037 6.282 11.704 1.00 34.10 C ATOM 1450 CD GLN A 94 8.143 5.870 10.748 1.00 71.11 C ATOM 1451 OE1 GLN A 94 8.926 6.691 10.281 1.00 22.55 O ATOM 1452 NE2 GLN A 94 8.215 4.591 10.447 1.00 62.22 N ATOM 0 H GLN A 94 3.936 5.036 11.960 1.00 41.42 H new ATOM 0 HA GLN A 94 4.924 7.728 12.678 1.00 13.51 H new ATOM 0 HB2 GLN A 94 5.456 5.858 10.325 1.00 64.52 H new ATOM 0 HB3 GLN A 94 5.973 7.533 10.332 1.00 64.52 H new ATOM 0 HG2 GLN A 94 7.380 7.118 12.313 1.00 34.10 H new ATOM 0 HG3 GLN A 94 6.823 5.458 12.385 1.00 34.10 H new ATOM 0 HE21 GLN A 94 7.549 3.933 10.852 1.00 62.22 H new ATOM 0 HE22 GLN A 94 8.937 4.257 9.809 1.00 62.22 H new ATOM 1461 N ARG A 95 2.318 7.091 10.989 1.00 52.51 N ATOM 1462 CA ARG A 95 1.218 7.578 10.135 1.00 53.32 C ATOM 1463 C ARG A 95 1.702 7.761 8.683 1.00 15.42 C ATOM 1464 O ARG A 95 1.157 8.552 7.914 1.00 62.45 O ATOM 1465 CB ARG A 95 0.640 8.886 10.711 1.00 5.14 C ATOM 1466 CG ARG A 95 0.202 8.757 12.171 1.00 73.51 C ATOM 1467 CD ARG A 95 -0.292 10.078 12.756 1.00 55.14 C ATOM 1468 NE ARG A 95 -1.604 10.475 12.249 1.00 0.22 N ATOM 1469 CZ ARG A 95 -2.130 11.660 12.433 1.00 41.41 C ATOM 1470 NH1 ARG A 95 -1.477 12.582 13.064 1.00 15.21 N ATOM 1471 NH2 ARG A 95 -3.311 11.919 11.980 1.00 51.50 N ATOM 0 H ARG A 95 2.103 6.230 11.492 1.00 52.51 H new ATOM 0 HA ARG A 95 0.420 6.836 10.123 1.00 53.32 H new ATOM 0 HB2 ARG A 95 1.389 9.674 10.631 1.00 5.14 H new ATOM 0 HB3 ARG A 95 -0.214 9.196 10.108 1.00 5.14 H new ATOM 0 HG2 ARG A 95 -0.591 8.013 12.244 1.00 73.51 H new ATOM 0 HG3 ARG A 95 1.039 8.391 12.766 1.00 73.51 H new ATOM 0 HD2 ARG A 95 -0.339 9.992 13.842 1.00 55.14 H new ATOM 0 HD3 ARG A 95 0.431 10.862 12.529 1.00 55.14 H new ATOM 0 HE ARG A 95 -2.142 9.788 11.720 1.00 0.22 H new ATOM 0 HH11 ARG A 95 -0.542 12.389 13.424 1.00 15.21 H new ATOM 0 HH12 ARG A 95 -1.897 13.501 13.201 1.00 15.21 H new ATOM 0 HH21 ARG A 95 -3.834 11.201 11.479 1.00 51.50 H new ATOM 0 HH22 ARG A 95 -3.721 12.842 12.123 1.00 51.50 H new ATOM 1485 N ARG A 96 2.726 6.980 8.322 1.00 21.24 N ATOM 1486 CA ARG A 96 3.360 7.040 6.995 1.00 23.24 C ATOM 1487 C ARG A 96 3.105 5.757 6.190 1.00 43.33 C ATOM 1488 O ARG A 96 2.726 4.725 6.746 1.00 52.14 O ATOM 1489 CB ARG A 96 4.882 7.213 7.137 1.00 14.42 C ATOM 1490 CG ARG A 96 5.341 8.580 7.629 1.00 64.42 C ATOM 1491 CD ARG A 96 6.852 8.594 7.852 1.00 30.22 C ATOM 1492 NE ARG A 96 7.375 9.936 8.091 1.00 21.22 N ATOM 1493 CZ ARG A 96 8.498 10.185 8.710 1.00 14.12 C ATOM 1494 NH1 ARG A 96 9.176 9.230 9.264 1.00 10.14 N ATOM 1495 NH2 ARG A 96 8.932 11.400 8.789 1.00 63.24 N ATOM 0 H ARG A 96 3.142 6.285 8.942 1.00 21.24 H new ATOM 0 HA ARG A 96 2.923 7.890 6.472 1.00 23.24 H new ATOM 0 HB2 ARG A 96 5.254 6.454 7.825 1.00 14.42 H new ATOM 0 HB3 ARG A 96 5.344 7.020 6.169 1.00 14.42 H new ATOM 0 HG2 ARG A 96 5.069 9.344 6.901 1.00 64.42 H new ATOM 0 HG3 ARG A 96 4.829 8.828 8.559 1.00 64.42 H new ATOM 0 HD2 ARG A 96 7.095 7.957 8.702 1.00 30.22 H new ATOM 0 HD3 ARG A 96 7.347 8.165 6.981 1.00 30.22 H new ATOM 0 HE ARG A 96 6.829 10.729 7.753 1.00 21.22 H new ATOM 0 HH11 ARG A 96 8.834 8.270 9.220 1.00 10.14 H new ATOM 0 HH12 ARG A 96 10.051 9.438 9.744 1.00 10.14 H new ATOM 0 HH21 ARG A 96 8.398 12.161 8.369 1.00 63.24 H new ATOM 0 HH22 ARG A 96 9.808 11.598 9.272 1.00 63.24 H new ATOM 1509 N VAL A 97 3.346 5.830 4.883 1.00 11.45 N ATOM 1510 CA VAL A 97 3.297 4.653 4.005 1.00 21.03 C ATOM 1511 C VAL A 97 4.475 4.668 3.018 1.00 22.54 C ATOM 1512 O VAL A 97 5.219 5.649 2.939 1.00 45.20 O ATOM 1513 CB VAL A 97 1.975 4.572 3.191 1.00 51.12 C ATOM 1514 CG1 VAL A 97 0.759 4.683 4.092 1.00 61.22 C ATOM 1515 CG2 VAL A 97 1.935 5.637 2.095 1.00 52.53 C ATOM 0 H VAL A 97 3.580 6.698 4.401 1.00 11.45 H new ATOM 0 HA VAL A 97 3.355 3.782 4.657 1.00 21.03 H new ATOM 0 HB VAL A 97 1.948 3.592 2.714 1.00 51.12 H new ATOM 0 HG11 VAL A 97 -0.147 4.622 3.489 1.00 61.22 H new ATOM 0 HG12 VAL A 97 0.768 3.869 4.817 1.00 61.22 H new ATOM 0 HG13 VAL A 97 0.782 5.637 4.618 1.00 61.22 H new ATOM 0 HG21 VAL A 97 0.999 5.556 1.543 1.00 52.53 H new ATOM 0 HG22 VAL A 97 2.005 6.627 2.547 1.00 52.53 H new ATOM 0 HG23 VAL A 97 2.773 5.489 1.413 1.00 52.53 H new ATOM 1525 N ARG A 98 4.653 3.579 2.276 1.00 70.01 N ATOM 1526 CA ARG A 98 5.643 3.540 1.193 1.00 40.24 C ATOM 1527 C ARG A 98 5.249 2.533 0.102 1.00 4.33 C ATOM 1528 O ARG A 98 4.712 1.464 0.395 1.00 55.24 O ATOM 1529 CB ARG A 98 7.043 3.184 1.721 1.00 4.32 C ATOM 1530 CG ARG A 98 8.124 3.302 0.646 1.00 50.22 C ATOM 1531 CD ARG A 98 9.474 2.749 1.092 1.00 51.20 C ATOM 1532 NE ARG A 98 10.499 2.974 0.070 1.00 62.33 N ATOM 1533 CZ ARG A 98 11.154 2.037 -0.555 1.00 52.30 C ATOM 1534 NH1 ARG A 98 11.004 0.807 -0.230 1.00 24.44 N ATOM 1535 NH2 ARG A 98 11.988 2.348 -1.492 1.00 3.43 N ATOM 0 H ARG A 98 4.129 2.713 2.400 1.00 70.01 H new ATOM 0 HA ARG A 98 5.667 4.541 0.762 1.00 40.24 H new ATOM 0 HB2 ARG A 98 7.291 3.841 2.554 1.00 4.32 H new ATOM 0 HB3 ARG A 98 7.032 2.166 2.110 1.00 4.32 H new ATOM 0 HG2 ARG A 98 7.798 2.771 -0.248 1.00 50.22 H new ATOM 0 HG3 ARG A 98 8.241 4.350 0.370 1.00 50.22 H new ATOM 0 HD2 ARG A 98 9.775 3.225 2.025 1.00 51.20 H new ATOM 0 HD3 ARG A 98 9.385 1.681 1.293 1.00 51.20 H new ATOM 0 HE ARG A 98 10.717 3.941 -0.171 1.00 62.33 H new ATOM 0 HH11 ARG A 98 10.367 0.553 0.525 1.00 24.44 H new ATOM 0 HH12 ARG A 98 11.522 0.082 -0.726 1.00 24.44 H new ATOM 0 HH21 ARG A 98 12.133 3.326 -1.742 1.00 3.43 H new ATOM 0 HH22 ARG A 98 12.501 1.615 -1.982 1.00 3.43 H new ATOM 1549 N PHE A 99 5.526 2.890 -1.151 1.00 2.32 N ATOM 1550 CA PHE A 99 5.347 1.984 -2.292 1.00 34.42 C ATOM 1551 C PHE A 99 6.697 1.385 -2.727 1.00 72.01 C ATOM 1552 O PHE A 99 7.611 2.114 -3.119 1.00 22.42 O ATOM 1553 CB PHE A 99 4.718 2.729 -3.481 1.00 12.33 C ATOM 1554 CG PHE A 99 3.289 3.169 -3.270 1.00 32.11 C ATOM 1555 CD1 PHE A 99 2.234 2.322 -3.589 1.00 15.24 C ATOM 1556 CD2 PHE A 99 2.998 4.431 -2.774 1.00 74.33 C ATOM 1557 CE1 PHE A 99 0.924 2.724 -3.413 1.00 31.24 C ATOM 1558 CE2 PHE A 99 1.687 4.836 -2.594 1.00 0.12 C ATOM 1559 CZ PHE A 99 0.651 3.982 -2.916 1.00 50.41 C ATOM 0 H PHE A 99 5.880 3.812 -1.407 1.00 2.32 H new ATOM 0 HA PHE A 99 4.682 1.180 -1.978 1.00 34.42 H new ATOM 0 HB2 PHE A 99 5.324 3.607 -3.703 1.00 12.33 H new ATOM 0 HB3 PHE A 99 4.759 2.083 -4.358 1.00 12.33 H new ATOM 0 HD1 PHE A 99 2.441 1.337 -3.980 1.00 15.24 H new ATOM 0 HD2 PHE A 99 3.804 5.106 -2.525 1.00 74.33 H new ATOM 0 HE1 PHE A 99 0.115 2.054 -3.664 1.00 31.24 H new ATOM 0 HE2 PHE A 99 1.474 5.820 -2.202 1.00 0.12 H new ATOM 0 HZ PHE A 99 -0.372 4.298 -2.779 1.00 50.41 H new ATOM 1569 N GLU A 100 6.820 0.065 -2.641 1.00 74.42 N ATOM 1570 CA GLU A 100 8.026 -0.641 -3.097 1.00 44.12 C ATOM 1571 C GLU A 100 7.749 -1.372 -4.424 1.00 61.33 C ATOM 1572 O GLU A 100 6.965 -2.324 -4.460 1.00 25.21 O ATOM 1573 CB GLU A 100 8.474 -1.652 -2.026 1.00 74.12 C ATOM 1574 CG GLU A 100 9.794 -2.362 -2.334 1.00 53.13 C ATOM 1575 CD GLU A 100 11.023 -1.503 -2.067 1.00 41.03 C ATOM 1576 OE1 GLU A 100 11.353 -0.636 -2.899 1.00 23.45 O ATOM 1577 OE2 GLU A 100 11.669 -1.694 -1.011 1.00 11.22 O ATOM 0 H GLU A 100 6.099 -0.546 -2.258 1.00 74.42 H new ATOM 0 HA GLU A 100 8.820 0.088 -3.259 1.00 44.12 H new ATOM 0 HB2 GLU A 100 8.570 -1.133 -1.072 1.00 74.12 H new ATOM 0 HB3 GLU A 100 7.693 -2.402 -1.904 1.00 74.12 H new ATOM 0 HG2 GLU A 100 9.858 -3.270 -1.734 1.00 53.13 H new ATOM 0 HG3 GLU A 100 9.796 -2.670 -3.380 1.00 53.13 H new ATOM 1584 N THR A 101 8.382 -0.921 -5.509 1.00 0.22 N ATOM 1585 CA THR A 101 8.147 -1.495 -6.847 1.00 74.32 C ATOM 1586 C THR A 101 9.271 -2.425 -7.305 1.00 54.44 C ATOM 1587 O THR A 101 10.395 -2.375 -6.810 1.00 13.01 O ATOM 1588 CB THR A 101 7.990 -0.402 -7.938 1.00 41.12 C ATOM 1589 OG1 THR A 101 8.984 0.618 -7.770 1.00 33.24 O ATOM 1590 CG2 THR A 101 6.599 0.218 -7.929 1.00 11.00 C ATOM 0 H THR A 101 9.062 -0.161 -5.493 1.00 0.22 H new ATOM 0 HA THR A 101 7.222 -2.061 -6.736 1.00 74.32 H new ATOM 0 HB THR A 101 8.129 -0.887 -8.904 1.00 41.12 H new ATOM 0 HG1 THR A 101 9.394 0.821 -8.637 1.00 33.24 H new ATOM 0 HG21 THR A 101 6.534 0.977 -8.708 1.00 11.00 H new ATOM 0 HG22 THR A 101 5.854 -0.556 -8.114 1.00 11.00 H new ATOM 0 HG23 THR A 101 6.412 0.677 -6.958 1.00 11.00 H new ATOM 1598 N GLY A 102 8.931 -3.287 -8.257 1.00 2.25 N ATOM 1599 CA GLY A 102 9.932 -4.038 -8.999 1.00 22.23 C ATOM 1600 C GLY A 102 10.122 -3.476 -10.409 1.00 73.42 C ATOM 1601 O GLY A 102 9.489 -2.486 -10.783 1.00 63.22 O ATOM 0 H GLY A 102 7.968 -3.482 -8.532 1.00 2.25 H new ATOM 0 HA2 GLY A 102 10.881 -4.009 -8.464 1.00 22.23 H new ATOM 0 HA3 GLY A 102 9.632 -5.084 -9.060 1.00 22.23 H new ATOM 1605 N TYR A 103 10.948 -4.137 -11.211 1.00 34.34 N ATOM 1606 CA TYR A 103 11.284 -3.659 -12.562 1.00 63.21 C ATOM 1607 C TYR A 103 10.042 -3.581 -13.473 1.00 64.05 C ATOM 1608 O TYR A 103 10.005 -2.794 -14.422 1.00 60.45 O ATOM 1609 CB TYR A 103 12.369 -4.573 -13.178 1.00 74.04 C ATOM 1610 CG TYR A 103 12.191 -4.866 -14.663 1.00 13.13 C ATOM 1611 CD1 TYR A 103 12.736 -4.032 -15.637 1.00 53.45 C ATOM 1612 CD2 TYR A 103 11.466 -5.977 -15.085 1.00 63.53 C ATOM 1613 CE1 TYR A 103 12.559 -4.299 -16.983 1.00 53.14 C ATOM 1614 CE2 TYR A 103 11.289 -6.250 -16.424 1.00 21.22 C ATOM 1615 CZ TYR A 103 11.836 -5.408 -17.371 1.00 20.52 C ATOM 1616 OH TYR A 103 11.652 -5.676 -18.711 1.00 25.42 O ATOM 0 H TYR A 103 11.404 -5.012 -10.954 1.00 34.34 H new ATOM 0 HA TYR A 103 11.673 -2.644 -12.479 1.00 63.21 H new ATOM 0 HB2 TYR A 103 13.343 -4.108 -13.028 1.00 74.04 H new ATOM 0 HB3 TYR A 103 12.380 -5.518 -12.634 1.00 74.04 H new ATOM 0 HD1 TYR A 103 13.305 -3.164 -15.337 1.00 53.45 H new ATOM 0 HD2 TYR A 103 11.034 -6.638 -14.348 1.00 63.53 H new ATOM 0 HE1 TYR A 103 12.985 -3.642 -17.727 1.00 53.14 H new ATOM 0 HE2 TYR A 103 10.725 -7.118 -16.731 1.00 21.22 H new ATOM 0 HH TYR A 103 11.121 -6.494 -18.811 1.00 25.42 H new ATOM 1626 N GLY A 104 9.018 -4.365 -13.157 1.00 74.45 N ATOM 1627 CA GLY A 104 7.857 -4.476 -14.038 1.00 61.21 C ATOM 1628 C GLY A 104 6.952 -3.252 -13.995 1.00 55.13 C ATOM 1629 O GLY A 104 6.165 -3.013 -14.912 1.00 1.00 O ATOM 0 H GLY A 104 8.965 -4.928 -12.308 1.00 74.45 H new ATOM 0 HA2 GLY A 104 8.199 -4.631 -15.061 1.00 61.21 H new ATOM 0 HA3 GLY A 104 7.279 -5.357 -13.758 1.00 61.21 H new ATOM 1633 N LEU A 105 7.063 -2.470 -12.928 1.00 2.51 N ATOM 1634 CA LEU A 105 6.203 -1.302 -12.736 1.00 41.14 C ATOM 1635 C LEU A 105 6.963 0.018 -12.909 1.00 24.44 C ATOM 1636 O LEU A 105 6.352 1.081 -12.946 1.00 74.14 O ATOM 1637 CB LEU A 105 5.546 -1.379 -11.355 1.00 75.22 C ATOM 1638 CG LEU A 105 4.504 -2.501 -11.214 1.00 23.24 C ATOM 1639 CD1 LEU A 105 4.017 -2.621 -9.776 1.00 2.53 C ATOM 1640 CD2 LEU A 105 3.328 -2.264 -12.163 1.00 72.43 C ATOM 0 H LEU A 105 7.740 -2.621 -12.180 1.00 2.51 H new ATOM 0 HA LEU A 105 5.434 -1.317 -13.509 1.00 41.14 H new ATOM 0 HB2 LEU A 105 6.322 -1.523 -10.603 1.00 75.22 H new ATOM 0 HB3 LEU A 105 5.067 -0.424 -11.139 1.00 75.22 H new ATOM 0 HG LEU A 105 4.984 -3.442 -11.485 1.00 23.24 H new ATOM 0 HD11 LEU A 105 3.281 -3.422 -9.707 1.00 2.53 H new ATOM 0 HD12 LEU A 105 4.861 -2.846 -9.124 1.00 2.53 H new ATOM 0 HD13 LEU A 105 3.560 -1.681 -9.467 1.00 2.53 H new ATOM 0 HD21 LEU A 105 2.601 -3.068 -12.049 1.00 72.43 H new ATOM 0 HD22 LEU A 105 2.855 -1.311 -11.926 1.00 72.43 H new ATOM 0 HD23 LEU A 105 3.689 -2.244 -13.191 1.00 72.43 H new ATOM 1652 N GLU A 106 8.285 -0.057 -13.048 1.00 41.32 N ATOM 1653 CA GLU A 106 9.116 1.140 -13.266 1.00 65.32 C ATOM 1654 C GLU A 106 8.666 1.941 -14.503 1.00 64.40 C ATOM 1655 O GLU A 106 8.890 3.150 -14.589 1.00 21.24 O ATOM 1656 CB GLU A 106 10.590 0.730 -13.410 1.00 33.44 C ATOM 1657 CG GLU A 106 11.202 0.153 -12.135 1.00 53.12 C ATOM 1658 CD GLU A 106 11.308 1.181 -11.018 1.00 54.32 C ATOM 1659 OE1 GLU A 106 10.348 1.330 -10.237 1.00 61.52 O ATOM 1660 OE2 GLU A 106 12.349 1.866 -10.931 1.00 12.51 O ATOM 0 H GLU A 106 8.810 -0.931 -13.015 1.00 41.32 H new ATOM 0 HA GLU A 106 8.996 1.789 -12.398 1.00 65.32 H new ATOM 0 HB2 GLU A 106 10.675 -0.008 -14.208 1.00 33.44 H new ATOM 0 HB3 GLU A 106 11.170 1.600 -13.718 1.00 33.44 H new ATOM 0 HG2 GLU A 106 10.597 -0.687 -11.794 1.00 53.12 H new ATOM 0 HG3 GLU A 106 12.194 -0.239 -12.358 1.00 53.12 H new ATOM 1667 N GLY A 107 8.032 1.260 -15.457 1.00 22.12 N ATOM 1668 CA GLY A 107 7.536 1.926 -16.659 1.00 31.54 C ATOM 1669 C GLY A 107 6.174 2.601 -16.469 1.00 2.21 C ATOM 1670 O GLY A 107 5.810 3.498 -17.232 1.00 25.22 O ATOM 0 H GLY A 107 7.851 0.257 -15.421 1.00 22.12 H new ATOM 0 HA2 GLY A 107 8.262 2.675 -16.975 1.00 31.54 H new ATOM 0 HA3 GLY A 107 7.461 1.195 -17.464 1.00 31.54 H new ATOM 1674 N TYR A 108 5.418 2.166 -15.459 1.00 34.21 N ATOM 1675 CA TYR A 108 4.084 2.730 -15.180 1.00 44.34 C ATOM 1676 C TYR A 108 4.124 3.702 -13.995 1.00 12.55 C ATOM 1677 O TYR A 108 3.681 4.846 -14.092 1.00 33.22 O ATOM 1678 CB TYR A 108 3.075 1.615 -14.861 1.00 15.52 C ATOM 1679 CG TYR A 108 2.849 0.623 -15.985 1.00 72.05 C ATOM 1680 CD1 TYR A 108 2.131 0.983 -17.120 1.00 72.21 C ATOM 1681 CD2 TYR A 108 3.349 -0.673 -15.908 1.00 70.31 C ATOM 1682 CE1 TYR A 108 1.915 0.081 -18.144 1.00 55.42 C ATOM 1683 CE2 TYR A 108 3.137 -1.580 -16.929 1.00 31.31 C ATOM 1684 CZ TYR A 108 2.420 -1.199 -18.044 1.00 21.14 C ATOM 1685 OH TYR A 108 2.208 -2.099 -19.065 1.00 53.13 O ATOM 0 H TYR A 108 5.701 1.425 -14.817 1.00 34.21 H new ATOM 0 HA TYR A 108 3.773 3.267 -16.076 1.00 44.34 H new ATOM 0 HB2 TYR A 108 3.420 1.073 -13.980 1.00 15.52 H new ATOM 0 HB3 TYR A 108 2.120 2.072 -14.601 1.00 15.52 H new ATOM 0 HD1 TYR A 108 1.735 1.985 -17.203 1.00 72.21 H new ATOM 0 HD2 TYR A 108 3.912 -0.975 -15.037 1.00 70.31 H new ATOM 0 HE1 TYR A 108 1.354 0.376 -19.018 1.00 55.42 H new ATOM 0 HE2 TYR A 108 3.531 -2.583 -16.854 1.00 31.31 H new ATOM 0 HH TYR A 108 2.629 -2.955 -18.840 1.00 53.13 H new ATOM 1695 N LEU A 109 4.653 3.218 -12.876 1.00 11.42 N ATOM 1696 CA LEU A 109 4.651 3.950 -11.608 1.00 64.20 C ATOM 1697 C LEU A 109 6.078 4.333 -11.178 1.00 2.43 C ATOM 1698 O LEU A 109 6.740 3.576 -10.468 1.00 1.24 O ATOM 1699 CB LEU A 109 4.006 3.066 -10.529 1.00 70.20 C ATOM 1700 CG LEU A 109 2.584 2.573 -10.850 1.00 20.32 C ATOM 1701 CD1 LEU A 109 2.259 1.305 -10.064 1.00 32.10 C ATOM 1702 CD2 LEU A 109 1.558 3.670 -10.561 1.00 41.12 C ATOM 0 H LEU A 109 5.098 2.302 -12.820 1.00 11.42 H new ATOM 0 HA LEU A 109 4.083 4.872 -11.737 1.00 64.20 H new ATOM 0 HB2 LEU A 109 4.645 2.199 -10.363 1.00 70.20 H new ATOM 0 HB3 LEU A 109 3.977 3.625 -9.594 1.00 70.20 H new ATOM 0 HG LEU A 109 2.537 2.332 -11.912 1.00 20.32 H new ATOM 0 HD11 LEU A 109 1.249 0.975 -10.307 1.00 32.10 H new ATOM 0 HD12 LEU A 109 2.970 0.522 -10.327 1.00 32.10 H new ATOM 0 HD13 LEU A 109 2.326 1.512 -8.996 1.00 32.10 H new ATOM 0 HD21 LEU A 109 0.558 3.304 -10.794 1.00 41.12 H new ATOM 0 HD22 LEU A 109 1.607 3.946 -9.508 1.00 41.12 H new ATOM 0 HD23 LEU A 109 1.776 4.543 -11.175 1.00 41.12 H new ATOM 1714 N PRO A 110 6.588 5.496 -11.625 1.00 22.01 N ATOM 1715 CA PRO A 110 7.914 5.984 -11.216 1.00 14.44 C ATOM 1716 C PRO A 110 7.922 6.515 -9.771 1.00 52.15 C ATOM 1717 O PRO A 110 6.869 6.840 -9.212 1.00 32.41 O ATOM 1718 CB PRO A 110 8.215 7.122 -12.214 1.00 41.20 C ATOM 1719 CG PRO A 110 7.123 7.068 -13.239 1.00 3.52 C ATOM 1720 CD PRO A 110 5.946 6.419 -12.568 1.00 5.02 C ATOM 0 HA PRO A 110 8.658 5.188 -11.231 1.00 14.44 H new ATOM 0 HB2 PRO A 110 8.231 8.089 -11.711 1.00 41.20 H new ATOM 0 HB3 PRO A 110 9.193 6.987 -12.677 1.00 41.20 H new ATOM 0 HG2 PRO A 110 6.868 8.068 -13.589 1.00 3.52 H new ATOM 0 HG3 PRO A 110 7.437 6.496 -14.112 1.00 3.52 H new ATOM 0 HD2 PRO A 110 5.317 7.148 -12.058 1.00 5.02 H new ATOM 0 HD3 PRO A 110 5.311 5.894 -13.281 1.00 5.02 H new ATOM 1728 N ASP A 111 9.114 6.623 -9.182 1.00 33.54 N ATOM 1729 CA ASP A 111 9.262 7.081 -7.794 1.00 35.30 C ATOM 1730 C ASP A 111 8.517 8.409 -7.536 1.00 72.44 C ATOM 1731 O ASP A 111 7.832 8.559 -6.521 1.00 25.44 O ATOM 1732 CB ASP A 111 10.749 7.225 -7.448 1.00 62.22 C ATOM 1733 CG ASP A 111 11.470 8.175 -8.386 1.00 50.42 C ATOM 1734 OD1 ASP A 111 11.875 7.740 -9.488 1.00 23.35 O ATOM 1735 OD2 ASP A 111 11.617 9.364 -8.038 1.00 31.50 O ATOM 0 H ASP A 111 9.995 6.399 -9.644 1.00 33.54 H new ATOM 0 HA ASP A 111 8.809 6.329 -7.147 1.00 35.30 H new ATOM 0 HB2 ASP A 111 10.848 7.585 -6.424 1.00 62.22 H new ATOM 0 HB3 ASP A 111 11.226 6.246 -7.490 1.00 62.22 H new ATOM 1740 N GLY A 112 8.648 9.360 -8.465 1.00 21.54 N ATOM 1741 CA GLY A 112 7.963 10.645 -8.336 1.00 42.51 C ATOM 1742 C GLY A 112 6.444 10.510 -8.235 1.00 65.24 C ATOM 1743 O GLY A 112 5.806 11.154 -7.396 1.00 21.41 O ATOM 0 H GLY A 112 9.217 9.264 -9.306 1.00 21.54 H new ATOM 0 HA2 GLY A 112 8.335 11.161 -7.451 1.00 42.51 H new ATOM 0 HA3 GLY A 112 8.210 11.269 -9.195 1.00 42.51 H new ATOM 1747 N LEU A 113 5.863 9.674 -9.093 1.00 1.52 N ATOM 1748 CA LEU A 113 4.420 9.411 -9.065 1.00 4.25 C ATOM 1749 C LEU A 113 4.002 8.751 -7.742 1.00 42.12 C ATOM 1750 O LEU A 113 2.985 9.116 -7.149 1.00 65.33 O ATOM 1751 CB LEU A 113 4.015 8.526 -10.253 1.00 13.35 C ATOM 1752 CG LEU A 113 2.520 8.172 -10.332 1.00 15.35 C ATOM 1753 CD1 LEU A 113 1.664 9.437 -10.376 1.00 11.13 C ATOM 1754 CD2 LEU A 113 2.237 7.284 -11.543 1.00 3.33 C ATOM 0 H LEU A 113 6.368 9.165 -9.819 1.00 1.52 H new ATOM 0 HA LEU A 113 3.902 10.367 -9.144 1.00 4.25 H new ATOM 0 HB2 LEU A 113 4.300 9.032 -11.175 1.00 13.35 H new ATOM 0 HB3 LEU A 113 4.588 7.600 -10.207 1.00 13.35 H new ATOM 0 HG LEU A 113 2.256 7.615 -9.433 1.00 15.35 H new ATOM 0 HD11 LEU A 113 0.611 9.162 -10.432 1.00 11.13 H new ATOM 0 HD12 LEU A 113 1.838 10.026 -9.475 1.00 11.13 H new ATOM 0 HD13 LEU A 113 1.932 10.027 -11.252 1.00 11.13 H new ATOM 0 HD21 LEU A 113 1.174 7.046 -11.579 1.00 3.33 H new ATOM 0 HD22 LEU A 113 2.522 7.810 -12.454 1.00 3.33 H new ATOM 0 HD23 LEU A 113 2.813 6.362 -11.461 1.00 3.33 H new ATOM 1766 N LEU A 114 4.795 7.785 -7.281 1.00 60.23 N ATOM 1767 CA LEU A 114 4.544 7.131 -5.991 1.00 62.15 C ATOM 1768 C LEU A 114 4.554 8.159 -4.845 1.00 52.12 C ATOM 1769 O LEU A 114 3.678 8.152 -3.978 1.00 13.33 O ATOM 1770 CB LEU A 114 5.594 6.038 -5.738 1.00 2.41 C ATOM 1771 CG LEU A 114 5.652 4.922 -6.798 1.00 21.24 C ATOM 1772 CD1 LEU A 114 6.759 3.920 -6.468 1.00 53.31 C ATOM 1773 CD2 LEU A 114 4.300 4.218 -6.918 1.00 64.34 C ATOM 0 H LEU A 114 5.615 7.436 -7.777 1.00 60.23 H new ATOM 0 HA LEU A 114 3.557 6.670 -6.026 1.00 62.15 H new ATOM 0 HB2 LEU A 114 6.575 6.508 -5.675 1.00 2.41 H new ATOM 0 HB3 LEU A 114 5.395 5.584 -4.767 1.00 2.41 H new ATOM 0 HG LEU A 114 5.883 5.378 -7.761 1.00 21.24 H new ATOM 0 HD11 LEU A 114 6.783 3.140 -7.229 1.00 53.31 H new ATOM 0 HD12 LEU A 114 7.720 4.434 -6.445 1.00 53.31 H new ATOM 0 HD13 LEU A 114 6.565 3.471 -5.494 1.00 53.31 H new ATOM 0 HD21 LEU A 114 4.364 3.434 -7.672 1.00 64.34 H new ATOM 0 HD22 LEU A 114 4.033 3.777 -5.958 1.00 64.34 H new ATOM 0 HD23 LEU A 114 3.538 4.941 -7.210 1.00 64.34 H new ATOM 1785 N SER A 115 5.544 9.052 -4.867 1.00 32.32 N ATOM 1786 CA SER A 115 5.645 10.138 -3.879 1.00 3.11 C ATOM 1787 C SER A 115 4.428 11.073 -3.960 1.00 74.22 C ATOM 1788 O SER A 115 3.943 11.576 -2.940 1.00 63.12 O ATOM 1789 CB SER A 115 6.936 10.943 -4.101 1.00 53.43 C ATOM 1790 OG SER A 115 8.091 10.139 -3.887 1.00 1.12 O ATOM 0 H SER A 115 6.293 9.048 -5.560 1.00 32.32 H new ATOM 0 HA SER A 115 5.669 9.688 -2.887 1.00 3.11 H new ATOM 0 HB2 SER A 115 6.950 11.340 -5.116 1.00 53.43 H new ATOM 0 HB3 SER A 115 6.955 11.798 -3.425 1.00 53.43 H new ATOM 0 HG SER A 115 8.208 9.526 -4.643 1.00 1.12 H new ATOM 1796 N ARG A 116 3.940 11.301 -5.181 1.00 12.21 N ATOM 1797 CA ARG A 116 2.736 12.110 -5.402 1.00 21.12 C ATOM 1798 C ARG A 116 1.507 11.496 -4.711 1.00 24.10 C ATOM 1799 O ARG A 116 0.859 12.145 -3.895 1.00 73.11 O ATOM 1800 CB ARG A 116 2.461 12.259 -6.907 1.00 53.35 C ATOM 1801 CG ARG A 116 1.105 12.890 -7.223 1.00 41.11 C ATOM 1802 CD ARG A 116 0.829 12.941 -8.720 1.00 72.10 C ATOM 1803 NE ARG A 116 -0.531 13.394 -9.000 1.00 52.32 N ATOM 1804 CZ ARG A 116 -0.953 13.794 -10.166 1.00 12.20 C ATOM 1805 NH1 ARG A 116 -0.155 13.831 -11.182 1.00 53.44 N ATOM 1806 NH2 ARG A 116 -2.178 14.174 -10.302 1.00 24.43 N ATOM 0 H ARG A 116 4.361 10.936 -6.036 1.00 12.21 H new ATOM 0 HA ARG A 116 2.917 13.092 -4.966 1.00 21.12 H new ATOM 0 HB2 ARG A 116 3.248 12.867 -7.353 1.00 53.35 H new ATOM 0 HB3 ARG A 116 2.513 11.277 -7.376 1.00 53.35 H new ATOM 0 HG2 ARG A 116 0.317 12.321 -6.729 1.00 41.11 H new ATOM 0 HG3 ARG A 116 1.072 13.900 -6.815 1.00 41.11 H new ATOM 0 HD2 ARG A 116 1.542 13.611 -9.200 1.00 72.10 H new ATOM 0 HD3 ARG A 116 0.980 11.952 -9.153 1.00 72.10 H new ATOM 0 HE ARG A 116 -1.198 13.397 -8.228 1.00 52.32 H new ATOM 0 HH11 ARG A 116 0.818 13.545 -11.077 1.00 53.44 H new ATOM 0 HH12 ARG A 116 -0.499 14.146 -12.089 1.00 53.44 H new ATOM 0 HH21 ARG A 116 -2.808 14.160 -9.500 1.00 24.43 H new ATOM 0 HH22 ARG A 116 -2.516 14.489 -11.211 1.00 24.43 H new ATOM 1820 N ILE A 117 1.202 10.239 -5.038 1.00 41.24 N ATOM 1821 CA ILE A 117 0.026 9.550 -4.485 1.00 1.12 C ATOM 1822 C ILE A 117 -0.027 9.658 -2.949 1.00 31.31 C ATOM 1823 O ILE A 117 -1.085 9.930 -2.367 1.00 23.12 O ATOM 1824 CB ILE A 117 0.016 8.054 -4.901 1.00 55.45 C ATOM 1825 CG1 ILE A 117 0.013 7.928 -6.439 1.00 54.21 C ATOM 1826 CG2 ILE A 117 -1.191 7.331 -4.295 1.00 72.44 C ATOM 1827 CD1 ILE A 117 0.072 6.498 -6.942 1.00 15.03 C ATOM 0 H ILE A 117 1.752 9.673 -5.684 1.00 41.24 H new ATOM 0 HA ILE A 117 -0.855 10.043 -4.895 1.00 1.12 H new ATOM 0 HB ILE A 117 0.920 7.581 -4.517 1.00 55.45 H new ATOM 0 HG12 ILE A 117 -0.887 8.403 -6.830 1.00 54.21 H new ATOM 0 HG13 ILE A 117 0.864 8.479 -6.840 1.00 54.21 H new ATOM 0 HG21 ILE A 117 -1.179 6.284 -4.599 1.00 72.44 H new ATOM 0 HG22 ILE A 117 -1.144 7.394 -3.208 1.00 72.44 H new ATOM 0 HG23 ILE A 117 -2.110 7.800 -4.646 1.00 72.44 H new ATOM 0 HD11 ILE A 117 0.066 6.495 -8.032 1.00 15.03 H new ATOM 0 HD12 ILE A 117 0.985 6.023 -6.583 1.00 15.03 H new ATOM 0 HD13 ILE A 117 -0.793 5.947 -6.573 1.00 15.03 H new ATOM 1839 N ILE A 118 1.123 9.468 -2.304 1.00 73.34 N ATOM 1840 CA ILE A 118 1.226 9.576 -0.846 1.00 74.01 C ATOM 1841 C ILE A 118 0.857 10.989 -0.350 1.00 31.21 C ATOM 1842 O ILE A 118 0.018 11.147 0.533 1.00 12.32 O ATOM 1843 CB ILE A 118 2.655 9.219 -0.355 1.00 21.32 C ATOM 1844 CG1 ILE A 118 3.037 7.796 -0.804 1.00 5.33 C ATOM 1845 CG2 ILE A 118 2.753 9.350 1.165 1.00 61.30 C ATOM 1846 CD1 ILE A 118 4.438 7.377 -0.403 1.00 54.34 C ATOM 0 H ILE A 118 2.001 9.237 -2.769 1.00 73.34 H new ATOM 0 HA ILE A 118 0.514 8.863 -0.430 1.00 74.01 H new ATOM 0 HB ILE A 118 3.358 9.922 -0.802 1.00 21.32 H new ATOM 0 HG12 ILE A 118 2.323 7.089 -0.382 1.00 5.33 H new ATOM 0 HG13 ILE A 118 2.946 7.732 -1.888 1.00 5.33 H new ATOM 0 HG21 ILE A 118 3.762 9.095 1.488 1.00 61.30 H new ATOM 0 HG22 ILE A 118 2.526 10.375 1.457 1.00 61.30 H new ATOM 0 HG23 ILE A 118 2.040 8.673 1.635 1.00 61.30 H new ATOM 0 HD11 ILE A 118 4.630 6.364 -0.756 1.00 54.34 H new ATOM 0 HD12 ILE A 118 5.163 8.059 -0.847 1.00 54.34 H new ATOM 0 HD13 ILE A 118 4.530 7.406 0.683 1.00 54.34 H new ATOM 1858 N HIS A 119 1.469 12.015 -0.935 1.00 14.31 N ATOM 1859 CA HIS A 119 1.268 13.399 -0.475 1.00 33.25 C ATOM 1860 C HIS A 119 -0.106 13.972 -0.871 1.00 61.05 C ATOM 1861 O HIS A 119 -0.818 14.537 -0.040 1.00 62.34 O ATOM 1862 CB HIS A 119 2.395 14.298 -1.002 1.00 12.51 C ATOM 1863 CG HIS A 119 3.665 14.183 -0.220 1.00 25.33 C ATOM 1864 ND1 HIS A 119 4.116 15.177 0.620 1.00 70.24 N ATOM 1865 CD2 HIS A 119 4.579 13.185 -0.139 1.00 44.32 C ATOM 1866 CE1 HIS A 119 5.245 14.798 1.183 1.00 21.10 C ATOM 1867 NE2 HIS A 119 5.548 13.597 0.742 1.00 23.05 N ATOM 0 H HIS A 119 2.107 11.922 -1.726 1.00 14.31 H new ATOM 0 HA HIS A 119 1.293 13.378 0.615 1.00 33.25 H new ATOM 0 HB2 HIS A 119 2.594 14.044 -2.043 1.00 12.51 H new ATOM 0 HB3 HIS A 119 2.060 15.335 -0.985 1.00 12.51 H new ATOM 0 HD2 HIS A 119 4.550 12.244 -0.668 1.00 44.32 H new ATOM 0 HE1 HIS A 119 5.824 15.376 1.888 1.00 21.10 H new ATOM 0 HE2 HIS A 119 6.371 13.058 1.011 1.00 23.05 H new ATOM 1876 N ASP A 120 -0.475 13.812 -2.133 1.00 14.35 N ATOM 1877 CA ASP A 120 -1.696 14.418 -2.674 1.00 73.20 C ATOM 1878 C ASP A 120 -2.974 13.813 -2.069 1.00 20.10 C ATOM 1879 O ASP A 120 -3.825 14.536 -1.543 1.00 51.14 O ATOM 1880 CB ASP A 120 -1.717 14.266 -4.201 1.00 63.05 C ATOM 1881 CG ASP A 120 -0.642 15.094 -4.890 1.00 33.22 C ATOM 1882 OD1 ASP A 120 0.491 15.169 -4.372 1.00 71.14 O ATOM 1883 OD2 ASP A 120 -0.933 15.694 -5.946 1.00 21.12 O ATOM 0 H ASP A 120 0.054 13.264 -2.811 1.00 14.35 H new ATOM 0 HA ASP A 120 -1.682 15.474 -2.403 1.00 73.20 H new ATOM 0 HB2 ASP A 120 -1.582 13.216 -4.459 1.00 63.05 H new ATOM 0 HB3 ASP A 120 -2.696 14.563 -4.578 1.00 63.05 H new ATOM 1888 N ARG A 121 -3.107 12.492 -2.140 1.00 21.31 N ATOM 1889 CA ARG A 121 -4.352 11.820 -1.741 1.00 63.44 C ATOM 1890 C ARG A 121 -4.293 11.269 -0.304 1.00 1.25 C ATOM 1891 O ARG A 121 -5.230 11.447 0.475 1.00 42.14 O ATOM 1892 CB ARG A 121 -4.667 10.686 -2.730 1.00 54.12 C ATOM 1893 CG ARG A 121 -4.656 11.132 -4.194 1.00 42.31 C ATOM 1894 CD ARG A 121 -5.711 12.199 -4.485 1.00 50.31 C ATOM 1895 NE ARG A 121 -7.068 11.648 -4.521 1.00 42.42 N ATOM 1896 CZ ARG A 121 -8.138 12.290 -4.130 1.00 15.30 C ATOM 1897 NH1 ARG A 121 -8.046 13.448 -3.560 1.00 54.41 N ATOM 1898 NH2 ARG A 121 -9.306 11.763 -4.289 1.00 21.34 N ATOM 0 H ARG A 121 -2.375 11.862 -2.468 1.00 21.31 H new ATOM 0 HA ARG A 121 -5.147 12.566 -1.762 1.00 63.44 H new ATOM 0 HB2 ARG A 121 -3.939 9.886 -2.597 1.00 54.12 H new ATOM 0 HB3 ARG A 121 -5.646 10.269 -2.493 1.00 54.12 H new ATOM 0 HG2 ARG A 121 -3.670 11.522 -4.445 1.00 42.31 H new ATOM 0 HG3 ARG A 121 -4.830 10.268 -4.836 1.00 42.31 H new ATOM 0 HD2 ARG A 121 -5.658 12.976 -3.723 1.00 50.31 H new ATOM 0 HD3 ARG A 121 -5.489 12.674 -5.441 1.00 50.31 H new ATOM 0 HE ARG A 121 -7.186 10.699 -4.875 1.00 42.42 H new ATOM 0 HH11 ARG A 121 -7.130 13.872 -3.411 1.00 54.41 H new ATOM 0 HH12 ARG A 121 -8.889 13.937 -3.260 1.00 54.41 H new ATOM 0 HH21 ARG A 121 -9.396 10.843 -4.721 1.00 21.34 H new ATOM 0 HH22 ARG A 121 -10.139 12.266 -3.983 1.00 21.34 H new ATOM 1912 N MET A 122 -3.188 10.614 0.044 1.00 4.34 N ATOM 1913 CA MET A 122 -3.069 9.919 1.336 1.00 64.13 C ATOM 1914 C MET A 122 -2.903 10.871 2.540 1.00 42.13 C ATOM 1915 O MET A 122 -3.666 10.787 3.508 1.00 14.23 O ATOM 1916 CB MET A 122 -1.898 8.935 1.285 1.00 2.14 C ATOM 1917 CG MET A 122 -2.173 7.693 0.450 1.00 22.45 C ATOM 1918 SD MET A 122 -0.801 6.525 0.491 1.00 64.01 S ATOM 1919 CE MET A 122 -1.553 5.086 -0.261 1.00 33.54 C ATOM 0 H MET A 122 -2.359 10.546 -0.546 1.00 4.34 H new ATOM 0 HA MET A 122 -4.009 9.390 1.492 1.00 64.13 H new ATOM 0 HB2 MET A 122 -1.024 9.446 0.881 1.00 2.14 H new ATOM 0 HB3 MET A 122 -1.648 8.630 2.301 1.00 2.14 H new ATOM 0 HG2 MET A 122 -3.075 7.204 0.817 1.00 22.45 H new ATOM 0 HG3 MET A 122 -2.367 7.987 -0.582 1.00 22.45 H new ATOM 0 HE1 MET A 122 -1.071 4.184 0.116 1.00 33.54 H new ATOM 0 HE2 MET A 122 -2.615 5.060 -0.015 1.00 33.54 H new ATOM 0 HE3 MET A 122 -1.432 5.136 -1.343 1.00 33.54 H new ATOM 1929 N ILE A 123 -1.907 11.762 2.484 1.00 42.31 N ATOM 1930 CA ILE A 123 -1.587 12.659 3.614 1.00 12.42 C ATOM 1931 C ILE A 123 -2.831 13.360 4.214 1.00 2.14 C ATOM 1932 O ILE A 123 -3.037 13.303 5.429 1.00 42.55 O ATOM 1933 CB ILE A 123 -0.522 13.721 3.216 1.00 63.34 C ATOM 1934 CG1 ILE A 123 0.836 13.052 2.944 1.00 14.34 C ATOM 1935 CG2 ILE A 123 -0.385 14.796 4.293 1.00 22.03 C ATOM 1936 CD1 ILE A 123 1.430 12.336 4.143 1.00 55.13 C ATOM 0 H ILE A 123 -1.305 11.886 1.670 1.00 42.31 H new ATOM 0 HA ILE A 123 -1.177 12.012 4.389 1.00 12.42 H new ATOM 0 HB ILE A 123 -0.859 14.205 2.299 1.00 63.34 H new ATOM 0 HG12 ILE A 123 0.719 12.337 2.130 1.00 14.34 H new ATOM 0 HG13 ILE A 123 1.540 13.811 2.603 1.00 14.34 H new ATOM 0 HG21 ILE A 123 0.366 15.524 3.987 1.00 22.03 H new ATOM 0 HG22 ILE A 123 -1.343 15.298 4.430 1.00 22.03 H new ATOM 0 HG23 ILE A 123 -0.081 14.334 5.232 1.00 22.03 H new ATOM 0 HD11 ILE A 123 2.386 11.893 3.865 1.00 55.13 H new ATOM 0 HD12 ILE A 123 1.582 13.049 4.954 1.00 55.13 H new ATOM 0 HD13 ILE A 123 0.749 11.552 4.473 1.00 55.13 H new ATOM 1948 N PRO A 124 -3.683 14.031 3.393 1.00 4.01 N ATOM 1949 CA PRO A 124 -4.908 14.690 3.898 1.00 33.41 C ATOM 1950 C PRO A 124 -5.774 13.764 4.773 1.00 72.21 C ATOM 1951 O PRO A 124 -6.322 14.189 5.793 1.00 14.22 O ATOM 1952 CB PRO A 124 -5.655 15.080 2.613 1.00 54.24 C ATOM 1953 CG PRO A 124 -4.578 15.249 1.596 1.00 20.43 C ATOM 1954 CD PRO A 124 -3.529 14.218 1.931 1.00 72.30 C ATOM 0 HA PRO A 124 -4.673 15.534 4.547 1.00 33.41 H new ATOM 0 HB2 PRO A 124 -6.365 14.308 2.316 1.00 54.24 H new ATOM 0 HB3 PRO A 124 -6.223 16.001 2.747 1.00 54.24 H new ATOM 0 HG2 PRO A 124 -4.965 15.099 0.588 1.00 20.43 H new ATOM 0 HG3 PRO A 124 -4.162 16.256 1.631 1.00 20.43 H new ATOM 0 HD2 PRO A 124 -3.693 13.287 1.388 1.00 72.30 H new ATOM 0 HD3 PRO A 124 -2.528 14.565 1.674 1.00 72.30 H new ATOM 1962 N HIS A 125 -5.881 12.496 4.376 1.00 3.32 N ATOM 1963 CA HIS A 125 -6.648 11.508 5.143 1.00 32.23 C ATOM 1964 C HIS A 125 -5.904 11.076 6.414 1.00 20.41 C ATOM 1965 O HIS A 125 -6.473 11.085 7.507 1.00 11.31 O ATOM 1966 CB HIS A 125 -6.963 10.280 4.282 1.00 41.23 C ATOM 1967 CG HIS A 125 -8.013 10.524 3.243 1.00 71.24 C ATOM 1968 ND1 HIS A 125 -9.334 10.671 3.585 1.00 63.15 N ATOM 1969 CD2 HIS A 125 -7.891 10.624 1.902 1.00 1.31 C ATOM 1970 CE1 HIS A 125 -9.984 10.854 2.450 1.00 25.33 C ATOM 1971 NE2 HIS A 125 -9.151 10.834 1.406 1.00 43.34 N ATOM 0 H HIS A 125 -5.448 12.127 3.529 1.00 3.32 H new ATOM 0 HA HIS A 125 -7.582 11.985 5.442 1.00 32.23 H new ATOM 0 HB2 HIS A 125 -6.049 9.948 3.790 1.00 41.23 H new ATOM 0 HB3 HIS A 125 -7.289 9.467 4.931 1.00 41.23 H new ATOM 0 HD2 HIS A 125 -6.977 10.552 1.331 1.00 1.31 H new ATOM 0 HE1 HIS A 125 -11.051 11.001 2.376 1.00 25.33 H new ATOM 0 HE2 HIS A 125 -9.405 10.953 0.425 1.00 43.34 H new ATOM 1979 N PHE A 126 -4.632 10.703 6.271 1.00 35.34 N ATOM 1980 CA PHE A 126 -3.832 10.244 7.414 1.00 13.43 C ATOM 1981 C PHE A 126 -3.795 11.292 8.535 1.00 24.34 C ATOM 1982 O PHE A 126 -3.938 10.954 9.713 1.00 25.35 O ATOM 1983 CB PHE A 126 -2.404 9.889 6.970 1.00 34.41 C ATOM 1984 CG PHE A 126 -2.331 8.715 6.016 1.00 13.42 C ATOM 1985 CD1 PHE A 126 -3.353 7.770 5.968 1.00 35.55 C ATOM 1986 CD2 PHE A 126 -1.244 8.557 5.170 1.00 25.13 C ATOM 1987 CE1 PHE A 126 -3.287 6.699 5.097 1.00 34.14 C ATOM 1988 CE2 PHE A 126 -1.176 7.487 4.298 1.00 3.24 C ATOM 1989 CZ PHE A 126 -2.198 6.558 4.261 1.00 50.21 C ATOM 0 H PHE A 126 -4.133 10.708 5.381 1.00 35.34 H new ATOM 0 HA PHE A 126 -4.311 9.348 7.809 1.00 13.43 H new ATOM 0 HB2 PHE A 126 -1.955 10.760 6.493 1.00 34.41 H new ATOM 0 HB3 PHE A 126 -1.805 9.665 7.853 1.00 34.41 H new ATOM 0 HD1 PHE A 126 -4.208 7.875 6.620 1.00 35.55 H new ATOM 0 HD2 PHE A 126 -0.441 9.279 5.193 1.00 25.13 H new ATOM 0 HE1 PHE A 126 -4.087 5.973 5.071 1.00 34.14 H new ATOM 0 HE2 PHE A 126 -0.323 7.377 3.645 1.00 3.24 H new ATOM 0 HZ PHE A 126 -2.145 5.723 3.579 1.00 50.21 H new ATOM 1999 N ARG A 127 -3.616 12.560 8.161 1.00 24.22 N ATOM 2000 CA ARG A 127 -3.659 13.668 9.124 1.00 12.01 C ATOM 2001 C ARG A 127 -5.009 13.718 9.858 1.00 44.22 C ATOM 2002 O ARG A 127 -5.063 13.931 11.071 1.00 20.20 O ATOM 2003 CB ARG A 127 -3.413 15.009 8.421 1.00 44.45 C ATOM 2004 CG ARG A 127 -2.002 15.181 7.862 1.00 41.24 C ATOM 2005 CD ARG A 127 -1.801 16.578 7.284 1.00 44.25 C ATOM 2006 NE ARG A 127 -0.430 16.799 6.829 1.00 63.41 N ATOM 2007 CZ ARG A 127 0.084 17.979 6.600 1.00 3.13 C ATOM 2008 NH1 ARG A 127 -0.603 19.054 6.820 1.00 44.11 N ATOM 2009 NH2 ARG A 127 1.294 18.081 6.167 1.00 22.12 N ATOM 0 H ARG A 127 -3.440 12.848 7.199 1.00 24.22 H new ATOM 0 HA ARG A 127 -2.869 13.493 9.854 1.00 12.01 H new ATOM 0 HB2 ARG A 127 -4.129 15.114 7.606 1.00 44.45 H new ATOM 0 HB3 ARG A 127 -3.612 15.816 9.126 1.00 44.45 H new ATOM 0 HG2 ARG A 127 -1.272 15.003 8.651 1.00 41.24 H new ATOM 0 HG3 ARG A 127 -1.822 14.435 7.088 1.00 41.24 H new ATOM 0 HD2 ARG A 127 -2.486 16.725 6.449 1.00 44.25 H new ATOM 0 HD3 ARG A 127 -2.055 17.321 8.040 1.00 44.25 H new ATOM 0 HE ARG A 127 0.163 15.982 6.681 1.00 63.41 H new ATOM 0 HH11 ARG A 127 -1.556 18.986 7.176 1.00 44.11 H new ATOM 0 HH12 ARG A 127 -0.191 19.969 6.637 1.00 44.11 H new ATOM 0 HH21 ARG A 127 1.850 17.241 6.003 1.00 22.12 H new ATOM 0 HH22 ARG A 127 1.696 19.001 5.988 1.00 22.12 H new ATOM 2023 N SER A 128 -6.094 13.519 9.111 1.00 22.14 N ATOM 2024 CA SER A 128 -7.453 13.539 9.678 1.00 25.13 C ATOM 2025 C SER A 128 -7.756 12.261 10.476 1.00 45.11 C ATOM 2026 O SER A 128 -8.736 12.197 11.218 1.00 44.05 O ATOM 2027 CB SER A 128 -8.492 13.698 8.557 1.00 21.00 C ATOM 2028 OG SER A 128 -8.235 14.853 7.771 1.00 10.42 O ATOM 0 H SER A 128 -6.064 13.341 8.107 1.00 22.14 H new ATOM 0 HA SER A 128 -7.510 14.388 10.359 1.00 25.13 H new ATOM 0 HB2 SER A 128 -8.481 12.813 7.920 1.00 21.00 H new ATOM 0 HB3 SER A 128 -9.490 13.766 8.991 1.00 21.00 H new ATOM 0 HG SER A 128 -7.584 14.635 7.072 1.00 10.42 H new ATOM 2034 N GLY A 129 -6.909 11.245 10.313 1.00 72.13 N ATOM 2035 CA GLY A 129 -7.125 9.963 10.979 1.00 51.23 C ATOM 2036 C GLY A 129 -7.803 8.939 10.071 1.00 3.33 C ATOM 2037 O GLY A 129 -8.040 7.795 10.470 1.00 51.52 O ATOM 0 H GLY A 129 -6.073 11.285 9.730 1.00 72.13 H new ATOM 0 HA2 GLY A 129 -6.167 9.567 11.317 1.00 51.23 H new ATOM 0 HA3 GLY A 129 -7.737 10.117 11.868 1.00 51.23 H new ATOM 2041 N ASN A 130 -8.105 9.354 8.842 1.00 43.14 N ATOM 2042 CA ASN A 130 -8.753 8.489 7.849 1.00 25.15 C ATOM 2043 C ASN A 130 -7.734 7.552 7.173 1.00 11.52 C ATOM 2044 O ASN A 130 -7.467 7.665 5.975 1.00 41.51 O ATOM 2045 CB ASN A 130 -9.444 9.347 6.779 1.00 5.44 C ATOM 2046 CG ASN A 130 -10.481 10.301 7.343 1.00 64.02 C ATOM 2047 OD1 ASN A 130 -10.376 10.765 8.471 1.00 62.51 O ATOM 2048 ND2 ASN A 130 -11.486 10.611 6.548 1.00 15.34 N ATOM 0 H ASN A 130 -7.909 10.296 8.504 1.00 43.14 H new ATOM 0 HA ASN A 130 -9.492 7.878 8.368 1.00 25.15 H new ATOM 0 HB2 ASN A 130 -8.689 9.921 6.241 1.00 5.44 H new ATOM 0 HB3 ASN A 130 -9.923 8.691 6.052 1.00 5.44 H new ATOM 0 HD21 ASN A 130 -12.208 11.257 6.867 1.00 15.34 H new ATOM 0 HD22 ASN A 130 -11.541 10.205 5.614 1.00 15.34 H new ATOM 2055 N TYR A 131 -7.172 6.624 7.938 1.00 73.43 N ATOM 2056 CA TYR A 131 -6.131 5.727 7.419 1.00 13.41 C ATOM 2057 C TYR A 131 -6.675 4.796 6.319 1.00 40.14 C ATOM 2058 O TYR A 131 -6.053 4.637 5.266 1.00 23.25 O ATOM 2059 CB TYR A 131 -5.510 4.921 8.567 1.00 34.40 C ATOM 2060 CG TYR A 131 -4.876 5.798 9.636 1.00 15.24 C ATOM 2061 CD1 TYR A 131 -3.630 6.390 9.435 1.00 2.12 C ATOM 2062 CD2 TYR A 131 -5.529 6.045 10.840 1.00 70.14 C ATOM 2063 CE1 TYR A 131 -3.060 7.198 10.400 1.00 11.15 C ATOM 2064 CE2 TYR A 131 -4.961 6.851 11.809 1.00 4.41 C ATOM 2065 CZ TYR A 131 -3.728 7.424 11.584 1.00 24.53 C ATOM 2066 OH TYR A 131 -3.161 8.232 12.543 1.00 64.32 O ATOM 0 H TYR A 131 -7.414 6.468 8.917 1.00 73.43 H new ATOM 0 HA TYR A 131 -5.355 6.340 6.961 1.00 13.41 H new ATOM 0 HB2 TYR A 131 -6.280 4.299 9.025 1.00 34.40 H new ATOM 0 HB3 TYR A 131 -4.755 4.247 8.163 1.00 34.40 H new ATOM 0 HD1 TYR A 131 -3.102 6.214 8.510 1.00 2.12 H new ATOM 0 HD2 TYR A 131 -6.496 5.599 11.020 1.00 70.14 H new ATOM 0 HE1 TYR A 131 -2.095 7.651 10.227 1.00 11.15 H new ATOM 0 HE2 TYR A 131 -5.481 7.031 12.738 1.00 4.41 H new ATOM 0 HH TYR A 131 -3.759 8.290 13.317 1.00 64.32 H new ATOM 2076 N ALA A 132 -7.840 4.194 6.561 1.00 11.24 N ATOM 2077 CA ALA A 132 -8.505 3.351 5.556 1.00 31.01 C ATOM 2078 C ALA A 132 -8.839 4.149 4.284 1.00 55.35 C ATOM 2079 O ALA A 132 -8.613 3.683 3.163 1.00 71.30 O ATOM 2080 CB ALA A 132 -9.773 2.736 6.139 1.00 13.40 C ATOM 0 H ALA A 132 -8.346 4.272 7.443 1.00 11.24 H new ATOM 0 HA ALA A 132 -7.815 2.554 5.280 1.00 31.01 H new ATOM 0 HB1 ALA A 132 -10.256 2.114 5.385 1.00 13.40 H new ATOM 0 HB2 ALA A 132 -9.516 2.124 7.004 1.00 13.40 H new ATOM 0 HB3 ALA A 132 -10.455 3.529 6.446 1.00 13.40 H new ATOM 2086 N GLU A 133 -9.375 5.355 4.471 1.00 3.32 N ATOM 2087 CA GLU A 133 -9.735 6.238 3.353 1.00 33.43 C ATOM 2088 C GLU A 133 -8.507 6.577 2.488 1.00 43.43 C ATOM 2089 O GLU A 133 -8.555 6.485 1.258 1.00 42.14 O ATOM 2090 CB GLU A 133 -10.370 7.528 3.894 1.00 14.34 C ATOM 2091 CG GLU A 133 -11.610 7.301 4.756 1.00 52.12 C ATOM 2092 CD GLU A 133 -12.758 6.654 3.996 1.00 72.23 C ATOM 2093 OE1 GLU A 133 -13.278 7.282 3.049 1.00 62.11 O ATOM 2094 OE2 GLU A 133 -13.148 5.519 4.341 1.00 31.31 O ATOM 0 H GLU A 133 -9.572 5.748 5.391 1.00 3.32 H new ATOM 0 HA GLU A 133 -10.454 5.714 2.723 1.00 33.43 H new ATOM 0 HB2 GLU A 133 -9.627 8.067 4.481 1.00 14.34 H new ATOM 0 HB3 GLU A 133 -10.638 8.168 3.053 1.00 14.34 H new ATOM 0 HG2 GLU A 133 -11.344 6.671 5.605 1.00 52.12 H new ATOM 0 HG3 GLU A 133 -11.943 8.257 5.160 1.00 52.12 H new ATOM 2101 N GLY A 134 -7.405 6.955 3.142 1.00 74.03 N ATOM 2102 CA GLY A 134 -6.170 7.270 2.429 1.00 34.11 C ATOM 2103 C GLY A 134 -5.651 6.105 1.592 1.00 74.51 C ATOM 2104 O GLY A 134 -5.285 6.279 0.426 1.00 71.53 O ATOM 0 H GLY A 134 -7.345 7.049 4.156 1.00 74.03 H new ATOM 0 HA2 GLY A 134 -6.341 8.129 1.780 1.00 34.11 H new ATOM 0 HA3 GLY A 134 -5.406 7.562 3.149 1.00 34.11 H new ATOM 2108 N LEU A 135 -5.618 4.914 2.185 1.00 10.04 N ATOM 2109 CA LEU A 135 -5.216 3.704 1.460 1.00 65.10 C ATOM 2110 C LEU A 135 -6.151 3.437 0.271 1.00 20.42 C ATOM 2111 O LEU A 135 -5.699 3.099 -0.823 1.00 63.31 O ATOM 2112 CB LEU A 135 -5.218 2.488 2.398 1.00 40.14 C ATOM 2113 CG LEU A 135 -4.230 2.549 3.573 1.00 23.34 C ATOM 2114 CD1 LEU A 135 -4.341 1.290 4.432 1.00 35.52 C ATOM 2115 CD2 LEU A 135 -2.799 2.738 3.071 1.00 20.45 C ATOM 0 H LEU A 135 -5.863 4.758 3.163 1.00 10.04 H new ATOM 0 HA LEU A 135 -4.206 3.865 1.082 1.00 65.10 H new ATOM 0 HB2 LEU A 135 -6.224 2.364 2.800 1.00 40.14 H new ATOM 0 HB3 LEU A 135 -4.998 1.598 1.809 1.00 40.14 H new ATOM 0 HG LEU A 135 -4.487 3.410 4.191 1.00 23.34 H new ATOM 0 HD11 LEU A 135 -3.634 1.351 5.259 1.00 35.52 H new ATOM 0 HD12 LEU A 135 -5.354 1.206 4.826 1.00 35.52 H new ATOM 0 HD13 LEU A 135 -4.114 0.414 3.824 1.00 35.52 H new ATOM 0 HD21 LEU A 135 -2.118 2.778 3.921 1.00 20.45 H new ATOM 0 HD22 LEU A 135 -2.526 1.902 2.426 1.00 20.45 H new ATOM 0 HD23 LEU A 135 -2.731 3.668 2.507 1.00 20.45 H new ATOM 2127 N SER A 136 -7.456 3.599 0.495 1.00 64.30 N ATOM 2128 CA SER A 136 -8.464 3.368 -0.552 1.00 33.42 C ATOM 2129 C SER A 136 -8.198 4.220 -1.801 1.00 31.00 C ATOM 2130 O SER A 136 -8.116 3.695 -2.915 1.00 30.41 O ATOM 2131 CB SER A 136 -9.875 3.662 -0.024 1.00 13.25 C ATOM 2132 OG SER A 136 -10.855 3.452 -1.031 1.00 52.13 O ATOM 0 H SER A 136 -7.844 3.890 1.392 1.00 64.30 H new ATOM 0 HA SER A 136 -8.393 2.317 -0.833 1.00 33.42 H new ATOM 0 HB2 SER A 136 -10.087 3.021 0.832 1.00 13.25 H new ATOM 0 HB3 SER A 136 -9.927 4.692 0.328 1.00 13.25 H new ATOM 0 HG SER A 136 -11.744 3.645 -0.667 1.00 52.13 H new ATOM 2138 N GLU A 137 -8.060 5.535 -1.616 1.00 23.31 N ATOM 2139 CA GLU A 137 -7.800 6.443 -2.742 1.00 22.32 C ATOM 2140 C GLU A 137 -6.401 6.219 -3.330 1.00 31.13 C ATOM 2141 O GLU A 137 -6.197 6.364 -4.536 1.00 64.43 O ATOM 2142 CB GLU A 137 -7.966 7.910 -2.317 1.00 53.24 C ATOM 2143 CG GLU A 137 -9.351 8.237 -1.768 1.00 3.05 C ATOM 2144 CD GLU A 137 -9.624 9.732 -1.675 1.00 54.13 C ATOM 2145 OE1 GLU A 137 -8.701 10.498 -1.329 1.00 54.45 O ATOM 2146 OE2 GLU A 137 -10.772 10.148 -1.939 1.00 72.02 O ATOM 0 H GLU A 137 -8.123 5.994 -0.707 1.00 23.31 H new ATOM 0 HA GLU A 137 -8.535 6.219 -3.515 1.00 22.32 H new ATOM 0 HB2 GLU A 137 -7.219 8.146 -1.559 1.00 53.24 H new ATOM 0 HB3 GLU A 137 -7.764 8.552 -3.174 1.00 53.24 H new ATOM 0 HG2 GLU A 137 -10.105 7.776 -2.406 1.00 3.05 H new ATOM 0 HG3 GLU A 137 -9.456 7.793 -0.778 1.00 3.05 H new ATOM 2153 N GLY A 138 -5.443 5.860 -2.474 1.00 15.25 N ATOM 2154 CA GLY A 138 -4.093 5.553 -2.939 1.00 24.54 C ATOM 2155 C GLY A 138 -4.057 4.372 -3.907 1.00 24.25 C ATOM 2156 O GLY A 138 -3.507 4.471 -5.007 1.00 43.31 O ATOM 0 H GLY A 138 -5.576 5.776 -1.466 1.00 15.25 H new ATOM 0 HA2 GLY A 138 -3.673 6.432 -3.429 1.00 24.54 H new ATOM 0 HA3 GLY A 138 -3.459 5.333 -2.080 1.00 24.54 H new ATOM 2160 N VAL A 139 -4.648 3.253 -3.496 1.00 4.20 N ATOM 2161 CA VAL A 139 -4.748 2.066 -4.353 1.00 74.21 C ATOM 2162 C VAL A 139 -5.581 2.357 -5.612 1.00 34.35 C ATOM 2163 O VAL A 139 -5.219 1.956 -6.720 1.00 5.33 O ATOM 2164 CB VAL A 139 -5.379 0.880 -3.587 1.00 11.00 C ATOM 2165 CG1 VAL A 139 -5.553 -0.340 -4.496 1.00 65.04 C ATOM 2166 CG2 VAL A 139 -4.538 0.530 -2.360 1.00 42.32 C ATOM 0 H VAL A 139 -5.067 3.139 -2.573 1.00 4.20 H new ATOM 0 HA VAL A 139 -3.734 1.800 -4.652 1.00 74.21 H new ATOM 0 HB VAL A 139 -6.371 1.184 -3.251 1.00 11.00 H new ATOM 0 HG11 VAL A 139 -5.999 -1.156 -3.928 1.00 65.04 H new ATOM 0 HG12 VAL A 139 -6.204 -0.081 -5.331 1.00 65.04 H new ATOM 0 HG13 VAL A 139 -4.580 -0.652 -4.877 1.00 65.04 H new ATOM 0 HG21 VAL A 139 -4.996 -0.307 -1.832 1.00 42.32 H new ATOM 0 HG22 VAL A 139 -3.532 0.253 -2.675 1.00 42.32 H new ATOM 0 HG23 VAL A 139 -4.486 1.393 -1.696 1.00 42.32 H new ATOM 2176 N LEU A 140 -6.703 3.053 -5.429 1.00 52.31 N ATOM 2177 CA LEU A 140 -7.548 3.470 -6.552 1.00 2.24 C ATOM 2178 C LEU A 140 -6.755 4.335 -7.544 1.00 71.00 C ATOM 2179 O LEU A 140 -6.925 4.220 -8.756 1.00 52.15 O ATOM 2180 CB LEU A 140 -8.770 4.243 -6.036 1.00 74.31 C ATOM 2181 CG LEU A 140 -9.747 4.739 -7.119 1.00 40.52 C ATOM 2182 CD1 LEU A 140 -10.329 3.568 -7.909 1.00 43.11 C ATOM 2183 CD2 LEU A 140 -10.861 5.579 -6.495 1.00 21.14 C ATOM 0 H LEU A 140 -7.049 3.341 -4.514 1.00 52.31 H new ATOM 0 HA LEU A 140 -7.887 2.575 -7.074 1.00 2.24 H new ATOM 0 HB2 LEU A 140 -9.317 3.603 -5.344 1.00 74.31 H new ATOM 0 HB3 LEU A 140 -8.420 5.103 -5.466 1.00 74.31 H new ATOM 0 HG LEU A 140 -9.191 5.369 -7.813 1.00 40.52 H new ATOM 0 HD11 LEU A 140 -11.015 3.946 -8.667 1.00 43.11 H new ATOM 0 HD12 LEU A 140 -9.522 3.018 -8.392 1.00 43.11 H new ATOM 0 HD13 LEU A 140 -10.866 2.904 -7.232 1.00 43.11 H new ATOM 0 HD21 LEU A 140 -11.541 5.920 -7.276 1.00 21.14 H new ATOM 0 HD22 LEU A 140 -11.411 4.975 -5.773 1.00 21.14 H new ATOM 0 HD23 LEU A 140 -10.427 6.442 -5.990 1.00 21.14 H new ATOM 2195 N ALA A 141 -5.884 5.193 -7.016 1.00 33.34 N ATOM 2196 CA ALA A 141 -5.030 6.044 -7.851 1.00 64.42 C ATOM 2197 C ALA A 141 -4.105 5.197 -8.737 1.00 31.44 C ATOM 2198 O ALA A 141 -4.053 5.380 -9.954 1.00 23.30 O ATOM 2199 CB ALA A 141 -4.211 6.997 -6.983 1.00 33.52 C ATOM 0 H ALA A 141 -5.749 5.319 -6.013 1.00 33.34 H new ATOM 0 HA ALA A 141 -5.676 6.633 -8.502 1.00 64.42 H new ATOM 0 HB1 ALA A 141 -3.583 7.621 -7.620 1.00 33.52 H new ATOM 0 HB2 ALA A 141 -4.883 7.630 -6.404 1.00 33.52 H new ATOM 0 HB3 ALA A 141 -3.581 6.421 -6.305 1.00 33.52 H new ATOM 2205 N VAL A 142 -3.386 4.262 -8.111 1.00 22.41 N ATOM 2206 CA VAL A 142 -2.529 3.318 -8.841 1.00 12.34 C ATOM 2207 C VAL A 142 -3.327 2.575 -9.924 1.00 53.01 C ATOM 2208 O VAL A 142 -2.914 2.503 -11.086 1.00 53.42 O ATOM 2209 CB VAL A 142 -1.888 2.282 -7.881 1.00 75.05 C ATOM 2210 CG1 VAL A 142 -1.045 1.268 -8.656 1.00 11.02 C ATOM 2211 CG2 VAL A 142 -1.050 2.981 -6.808 1.00 31.43 C ATOM 0 H VAL A 142 -3.379 4.137 -7.099 1.00 22.41 H new ATOM 0 HA VAL A 142 -1.738 3.902 -9.313 1.00 12.34 H new ATOM 0 HB VAL A 142 -2.692 1.740 -7.383 1.00 75.05 H new ATOM 0 HG11 VAL A 142 -0.606 0.552 -7.961 1.00 11.02 H new ATOM 0 HG12 VAL A 142 -1.677 0.740 -9.370 1.00 11.02 H new ATOM 0 HG13 VAL A 142 -0.250 1.788 -9.191 1.00 11.02 H new ATOM 0 HG21 VAL A 142 -0.610 2.235 -6.146 1.00 31.43 H new ATOM 0 HG22 VAL A 142 -0.256 3.557 -7.284 1.00 31.43 H new ATOM 0 HG23 VAL A 142 -1.686 3.650 -6.228 1.00 31.43 H new ATOM 2221 N GLN A 143 -4.476 2.028 -9.530 1.00 52.42 N ATOM 2222 CA GLN A 143 -5.378 1.346 -10.464 1.00 24.23 C ATOM 2223 C GLN A 143 -5.731 2.240 -11.669 1.00 1.33 C ATOM 2224 O GLN A 143 -5.678 1.796 -12.816 1.00 54.51 O ATOM 2225 CB GLN A 143 -6.661 0.911 -9.738 1.00 63.14 C ATOM 2226 CG GLN A 143 -7.643 0.152 -10.626 1.00 43.53 C ATOM 2227 CD GLN A 143 -8.902 -0.278 -9.889 1.00 54.11 C ATOM 2228 OE1 GLN A 143 -9.885 0.451 -9.831 1.00 41.52 O ATOM 2229 NE2 GLN A 143 -8.881 -1.470 -9.328 1.00 12.41 N ATOM 0 H GLN A 143 -4.808 2.043 -8.566 1.00 52.42 H new ATOM 0 HA GLN A 143 -4.859 0.465 -10.842 1.00 24.23 H new ATOM 0 HB2 GLN A 143 -6.392 0.282 -8.889 1.00 63.14 H new ATOM 0 HB3 GLN A 143 -7.157 1.794 -9.336 1.00 63.14 H new ATOM 0 HG2 GLN A 143 -7.921 0.781 -11.471 1.00 43.53 H new ATOM 0 HG3 GLN A 143 -7.149 -0.730 -11.034 1.00 43.53 H new ATOM 0 HE21 GLN A 143 -8.045 -2.051 -9.396 1.00 12.41 H new ATOM 0 HE22 GLN A 143 -9.700 -1.812 -8.826 1.00 12.41 H new ATOM 2238 N GLN A 144 -6.082 3.499 -11.402 1.00 41.31 N ATOM 2239 CA GLN A 144 -6.425 4.456 -12.467 1.00 54.35 C ATOM 2240 C GLN A 144 -5.218 4.767 -13.372 1.00 62.32 C ATOM 2241 O GLN A 144 -5.373 4.984 -14.578 1.00 34.44 O ATOM 2242 CB GLN A 144 -6.985 5.755 -11.858 1.00 43.22 C ATOM 2243 CG GLN A 144 -8.325 5.579 -11.141 1.00 43.23 C ATOM 2244 CD GLN A 144 -9.487 5.292 -12.085 1.00 63.52 C ATOM 2245 OE1 GLN A 144 -9.318 4.733 -13.166 1.00 5.20 O ATOM 2246 NE2 GLN A 144 -10.682 5.667 -11.679 1.00 54.32 N ATOM 0 H GLN A 144 -6.138 3.884 -10.459 1.00 41.31 H new ATOM 0 HA GLN A 144 -7.190 3.993 -13.090 1.00 54.35 H new ATOM 0 HB2 GLN A 144 -6.257 6.157 -11.153 1.00 43.22 H new ATOM 0 HB3 GLN A 144 -7.103 6.494 -12.650 1.00 43.22 H new ATOM 0 HG2 GLN A 144 -8.240 4.763 -10.424 1.00 43.23 H new ATOM 0 HG3 GLN A 144 -8.545 6.482 -10.571 1.00 43.23 H new ATOM 0 HE21 GLN A 144 -10.792 6.129 -10.776 1.00 54.32 H new ATOM 0 HE22 GLN A 144 -11.498 5.495 -12.267 1.00 54.32 H new ATOM 2255 N VAL A 145 -4.018 4.787 -12.791 1.00 43.25 N ATOM 2256 CA VAL A 145 -2.790 4.979 -13.573 1.00 73.24 C ATOM 2257 C VAL A 145 -2.582 3.823 -14.565 1.00 11.40 C ATOM 2258 O VAL A 145 -2.332 4.041 -15.753 1.00 53.45 O ATOM 2259 CB VAL A 145 -1.539 5.101 -12.660 1.00 10.10 C ATOM 2260 CG1 VAL A 145 -0.259 5.191 -13.490 1.00 10.12 C ATOM 2261 CG2 VAL A 145 -1.660 6.307 -11.729 1.00 24.42 C ATOM 0 H VAL A 145 -3.867 4.674 -11.789 1.00 43.25 H new ATOM 0 HA VAL A 145 -2.911 5.912 -14.124 1.00 73.24 H new ATOM 0 HB VAL A 145 -1.484 4.200 -12.049 1.00 10.10 H new ATOM 0 HG11 VAL A 145 0.601 5.276 -12.825 1.00 10.12 H new ATOM 0 HG12 VAL A 145 -0.158 4.294 -14.101 1.00 10.12 H new ATOM 0 HG13 VAL A 145 -0.305 6.067 -14.136 1.00 10.12 H new ATOM 0 HG21 VAL A 145 -0.772 6.371 -11.100 1.00 24.42 H new ATOM 0 HG22 VAL A 145 -1.751 7.217 -12.322 1.00 24.42 H new ATOM 0 HG23 VAL A 145 -2.543 6.194 -11.100 1.00 24.42 H new ATOM 2271 N LEU A 146 -2.694 2.593 -14.068 1.00 40.12 N ATOM 2272 CA LEU A 146 -2.530 1.396 -14.903 1.00 33.43 C ATOM 2273 C LEU A 146 -3.647 1.287 -15.954 1.00 74.43 C ATOM 2274 O LEU A 146 -3.385 1.246 -17.160 1.00 51.43 O ATOM 2275 CB LEU A 146 -2.528 0.138 -14.019 1.00 54.34 C ATOM 2276 CG LEU A 146 -1.454 0.103 -12.918 1.00 52.34 C ATOM 2277 CD1 LEU A 146 -1.623 -1.130 -12.035 1.00 5.23 C ATOM 2278 CD2 LEU A 146 -0.052 0.144 -13.526 1.00 42.41 C ATOM 0 H LEU A 146 -2.898 2.395 -13.089 1.00 40.12 H new ATOM 0 HA LEU A 146 -1.578 1.480 -15.426 1.00 33.43 H new ATOM 0 HB2 LEU A 146 -3.507 0.043 -13.550 1.00 54.34 H new ATOM 0 HB3 LEU A 146 -2.396 -0.734 -14.659 1.00 54.34 H new ATOM 0 HG LEU A 146 -1.580 0.988 -12.294 1.00 52.34 H new ATOM 0 HD11 LEU A 146 -0.853 -1.134 -11.264 1.00 5.23 H new ATOM 0 HD12 LEU A 146 -2.606 -1.109 -11.566 1.00 5.23 H new ATOM 0 HD13 LEU A 146 -1.531 -2.029 -12.644 1.00 5.23 H new ATOM 0 HD21 LEU A 146 0.691 0.118 -12.729 1.00 42.41 H new ATOM 0 HD22 LEU A 146 0.087 -0.717 -14.179 1.00 42.41 H new ATOM 0 HD23 LEU A 146 0.067 1.060 -14.104 1.00 42.41 H new ATOM 2290 N ASP A 147 -4.894 1.269 -15.485 1.00 3.33 N ATOM 2291 CA ASP A 147 -6.058 1.105 -16.362 1.00 52.44 C ATOM 2292 C ASP A 147 -6.175 2.252 -17.384 1.00 3.02 C ATOM 2293 O ASP A 147 -6.541 2.028 -18.540 1.00 73.23 O ATOM 2294 CB ASP A 147 -7.333 1.015 -15.516 1.00 71.00 C ATOM 2295 CG ASP A 147 -8.566 0.719 -16.351 1.00 61.53 C ATOM 2296 OD1 ASP A 147 -8.674 -0.406 -16.877 1.00 42.22 O ATOM 2297 OD2 ASP A 147 -9.430 1.609 -16.494 1.00 30.41 O ATOM 0 H ASP A 147 -5.127 1.366 -14.497 1.00 3.33 H new ATOM 0 HA ASP A 147 -5.926 0.181 -16.925 1.00 52.44 H new ATOM 0 HB2 ASP A 147 -7.212 0.235 -14.764 1.00 71.00 H new ATOM 0 HB3 ASP A 147 -7.477 1.954 -14.981 1.00 71.00 H new