USER MOD reduce.3.24.130724 H: found=0, std=0, add=946, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 949 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 18 ASN :FLIP amide:sc= 0.38 F(o=0.12,f=0.91) USER MOD Set 1.2: A 124 THR OG1 : rot -88:sc= 0.53 USER MOD Set 2.1: A 17 SER OG : rot -75:sc= 0.985 USER MOD Set 2.2: A 50 ASN : amide:sc= -2.88! C(o=-1.9!,f=-3.6!) USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ 166:sc= -0.031 (180deg=-0.248) USER MOD Single : A 40 LYS NZ :NH3+ 152:sc= 0.104 (180deg=0.000259) USER MOD Single : A 41 LYS NZ :NH3+ -145:sc= -0.128 (180deg=-0.985) USER MOD Single : A 42 THR OG1 : rot 141:sc= 1.44 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ 142:sc= -0.154 (180deg=-0.768) USER MOD Single : A 47 ASN : amide:sc= -1.55! C(o=-1.6!,f=-1.2!) USER MOD Single : A 54 ASN : amide:sc= -5.04! C(o=-5!,f=-6.8!) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot -170:sc= 0.0309 USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 THR OG1 : rot -55:sc= 1.23 USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ -139:sc= 0 (180deg=-0.635) USER MOD Single : A 99 THR OG1 : rot -99:sc= 0.575 USER MOD Single : A 102 GLN : amide:sc= -0.109 K(o=-0.11,f=-2.2!) USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 40:sc= 0.538 USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 115 ASN : amide:sc= -0.815 K(o=-0.81,f=-14!) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 GLN : amide:sc= -0.285 X(o=-0.29,f=-0.57) USER MOD Single : A 121 THR OG1 : rot -35:sc= 0.972 USER MOD Single : A 131 TYR OH : rot 180:sc= -0.0355 USER MOD ----------------------------------------------------------------- ATOM 48 N SER A 6 -7.930 -22.338 2.685 1.00 0.00 N ATOM 49 CA SER A 6 -7.770 -22.549 1.251 1.00 0.00 C ATOM 50 C SER A 6 -6.908 -21.452 0.633 1.00 0.00 C ATOM 51 O SER A 6 -7.291 -20.829 -0.356 1.00 0.00 O ATOM 52 CB SER A 6 -9.137 -22.586 0.564 1.00 0.00 C ATOM 53 OG SER A 6 -9.773 -23.837 0.762 1.00 0.00 O ATOM 0 HA SER A 6 -7.270 -23.506 1.103 1.00 0.00 H new ATOM 0 HB2 SER A 6 -9.767 -21.788 0.957 1.00 0.00 H new ATOM 0 HB3 SER A 6 -9.016 -22.401 -0.503 1.00 0.00 H new ATOM 0 HG SER A 6 -10.645 -23.835 0.315 1.00 0.00 H new ATOM 59 N GLY A 7 -5.739 -21.223 1.225 1.00 0.00 N ATOM 60 CA GLY A 7 -4.839 -20.203 0.720 1.00 0.00 C ATOM 61 C GLY A 7 -5.477 -18.828 0.698 1.00 0.00 C ATOM 62 O GLY A 7 -6.430 -18.590 -0.044 1.00 0.00 O ATOM 0 H GLY A 7 -5.400 -21.726 2.045 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -3.943 -20.175 1.339 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -4.522 -20.469 -0.288 1.00 0.00 H new ATOM 66 N MET A 8 -4.952 -17.920 1.515 1.00 0.00 N ATOM 67 CA MET A 8 -5.477 -16.561 1.585 1.00 0.00 C ATOM 68 C MET A 8 -4.356 -15.558 1.839 1.00 0.00 C ATOM 69 O MET A 8 -3.524 -15.753 2.725 1.00 0.00 O ATOM 70 CB MET A 8 -6.531 -16.456 2.689 1.00 0.00 C ATOM 71 CG MET A 8 -6.803 -15.029 3.135 1.00 0.00 C ATOM 72 SD MET A 8 -8.449 -14.824 3.843 1.00 0.00 S ATOM 73 CE MET A 8 -9.399 -14.418 2.380 1.00 0.00 C ATOM 0 H MET A 8 -4.164 -18.101 2.137 1.00 0.00 H new ATOM 0 HA MET A 8 -5.940 -16.326 0.627 1.00 0.00 H new ATOM 0 HB2 MET A 8 -7.461 -16.901 2.336 1.00 0.00 H new ATOM 0 HB3 MET A 8 -6.204 -17.041 3.549 1.00 0.00 H new ATOM 0 HG2 MET A 8 -6.056 -14.734 3.872 1.00 0.00 H new ATOM 0 HG3 MET A 8 -6.692 -14.359 2.283 1.00 0.00 H new ATOM 0 HE1 MET A 8 -10.442 -14.261 2.655 1.00 0.00 H new ATOM 0 HE2 MET A 8 -9.002 -13.508 1.929 1.00 0.00 H new ATOM 0 HE3 MET A 8 -9.332 -15.237 1.664 1.00 0.00 H new ATOM 83 N LEU A 9 -4.341 -14.485 1.056 1.00 0.00 N ATOM 84 CA LEU A 9 -3.322 -13.451 1.195 1.00 0.00 C ATOM 85 C LEU A 9 -3.916 -12.178 1.790 1.00 0.00 C ATOM 86 O LEU A 9 -4.929 -11.670 1.309 1.00 0.00 O ATOM 87 CB LEU A 9 -2.688 -13.145 -0.163 1.00 0.00 C ATOM 88 CG LEU A 9 -1.539 -12.136 -0.155 1.00 0.00 C ATOM 89 CD1 LEU A 9 -0.228 -12.822 0.198 1.00 0.00 C ATOM 90 CD2 LEU A 9 -1.432 -11.440 -1.504 1.00 0.00 C ATOM 0 H LEU A 9 -5.023 -14.308 0.318 1.00 0.00 H new ATOM 0 HA LEU A 9 -2.553 -13.823 1.872 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -2.322 -14.079 -0.589 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -3.466 -12.774 -0.830 1.00 0.00 H new ATOM 0 HG LEU A 9 -1.747 -11.383 0.605 1.00 0.00 H new ATOM 0 HD11 LEU A 9 0.578 -12.088 0.199 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -0.308 -13.274 1.187 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -0.013 -13.596 -0.538 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -0.609 -10.725 -1.480 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -1.247 -12.181 -2.282 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -2.363 -10.915 -1.717 1.00 0.00 H new ATOM 102 N ARG A 10 -3.277 -11.666 2.837 1.00 0.00 N ATOM 103 CA ARG A 10 -3.742 -10.452 3.497 1.00 0.00 C ATOM 104 C ARG A 10 -2.769 -9.300 3.263 1.00 0.00 C ATOM 105 O ARG A 10 -1.578 -9.410 3.553 1.00 0.00 O ATOM 106 CB ARG A 10 -3.910 -10.694 4.998 1.00 0.00 C ATOM 107 CG ARG A 10 -5.277 -11.239 5.378 1.00 0.00 C ATOM 108 CD ARG A 10 -5.492 -11.205 6.883 1.00 0.00 C ATOM 109 NE ARG A 10 -6.802 -11.730 7.260 1.00 0.00 N ATOM 110 CZ ARG A 10 -7.253 -11.752 8.510 1.00 0.00 C ATOM 111 NH1 ARG A 10 -6.504 -11.279 9.496 1.00 0.00 N ATOM 112 NH2 ARG A 10 -8.455 -12.246 8.774 1.00 0.00 N ATOM 0 H ARG A 10 -2.436 -12.073 3.246 1.00 0.00 H new ATOM 0 HA ARG A 10 -4.708 -10.183 3.069 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -3.144 -11.393 5.333 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -3.741 -9.758 5.530 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -6.053 -10.653 4.885 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -5.374 -12.263 5.019 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -4.713 -11.788 7.374 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -5.396 -10.180 7.240 1.00 0.00 H new ATOM 0 HE ARG A 10 -7.403 -12.100 6.524 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -5.580 -10.897 9.296 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -6.852 -11.297 10.455 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -9.034 -12.610 8.017 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -8.800 -12.262 9.734 1.00 0.00 H new ATOM 126 N VAL A 11 -3.285 -8.194 2.736 1.00 0.00 N ATOM 127 CA VAL A 11 -2.463 -7.021 2.463 1.00 0.00 C ATOM 128 C VAL A 11 -2.937 -5.818 3.270 1.00 0.00 C ATOM 129 O VAL A 11 -3.885 -5.133 2.884 1.00 0.00 O ATOM 130 CB VAL A 11 -2.480 -6.660 0.965 1.00 0.00 C ATOM 131 CG1 VAL A 11 -1.493 -5.540 0.675 1.00 0.00 C ATOM 132 CG2 VAL A 11 -2.173 -7.886 0.119 1.00 0.00 C ATOM 0 H VAL A 11 -4.269 -8.086 2.490 1.00 0.00 H new ATOM 0 HA VAL A 11 -1.444 -7.273 2.757 1.00 0.00 H new ATOM 0 HB VAL A 11 -3.478 -6.308 0.704 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -1.519 -5.298 -0.388 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -1.764 -4.657 1.254 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -0.488 -5.860 0.950 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -2.189 -7.613 -0.936 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -1.187 -8.270 0.380 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -2.923 -8.655 0.307 1.00 0.00 H new ATOM 142 N ILE A 12 -2.272 -5.566 4.392 1.00 0.00 N ATOM 143 CA ILE A 12 -2.624 -4.444 5.253 1.00 0.00 C ATOM 144 C ILE A 12 -2.009 -3.145 4.743 1.00 0.00 C ATOM 145 O ILE A 12 -0.835 -3.105 4.373 1.00 0.00 O ATOM 146 CB ILE A 12 -2.166 -4.682 6.704 1.00 0.00 C ATOM 147 CG1 ILE A 12 -2.662 -6.040 7.202 1.00 0.00 C ATOM 148 CG2 ILE A 12 -2.666 -3.565 7.607 1.00 0.00 C ATOM 149 CD1 ILE A 12 -1.872 -6.579 8.375 1.00 0.00 C ATOM 0 H ILE A 12 -1.486 -6.124 4.726 1.00 0.00 H new ATOM 0 HA ILE A 12 -3.711 -4.360 5.233 1.00 0.00 H new ATOM 0 HB ILE A 12 -1.076 -4.683 6.730 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -3.710 -5.952 7.490 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -2.616 -6.757 6.383 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -2.334 -3.747 8.629 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -2.267 -2.611 7.261 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -3.755 -3.535 7.579 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -2.279 -7.544 8.675 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -0.828 -6.700 8.086 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -1.939 -5.882 9.210 1.00 0.00 H new ATOM 161 N VAL A 13 -2.808 -2.083 4.729 1.00 0.00 N ATOM 162 CA VAL A 13 -2.341 -0.781 4.267 1.00 0.00 C ATOM 163 C VAL A 13 -2.255 0.212 5.421 1.00 0.00 C ATOM 164 O VAL A 13 -3.262 0.784 5.836 1.00 0.00 O ATOM 165 CB VAL A 13 -3.266 -0.207 3.178 1.00 0.00 C ATOM 166 CG1 VAL A 13 -2.676 1.067 2.593 1.00 0.00 C ATOM 167 CG2 VAL A 13 -3.512 -1.240 2.089 1.00 0.00 C ATOM 0 H VAL A 13 -3.782 -2.099 5.032 1.00 0.00 H new ATOM 0 HA VAL A 13 -1.347 -0.932 3.846 1.00 0.00 H new ATOM 0 HB VAL A 13 -4.224 0.041 3.634 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -3.344 1.458 1.825 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -2.557 1.809 3.383 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -1.704 0.848 2.151 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -4.168 -0.817 1.328 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -2.563 -1.522 1.634 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -3.982 -2.122 2.524 1.00 0.00 H new ATOM 177 N GLU A 14 -1.045 0.411 5.934 1.00 0.00 N ATOM 178 CA GLU A 14 -0.827 1.335 7.040 1.00 0.00 C ATOM 179 C GLU A 14 -1.095 2.774 6.608 1.00 0.00 C ATOM 180 O GLU A 14 -2.120 3.359 6.959 1.00 0.00 O ATOM 181 CB GLU A 14 0.603 1.207 7.568 1.00 0.00 C ATOM 182 CG GLU A 14 0.933 -0.175 8.105 1.00 0.00 C ATOM 183 CD GLU A 14 2.064 -0.155 9.114 1.00 0.00 C ATOM 184 OE1 GLU A 14 1.983 0.629 10.082 1.00 0.00 O ATOM 185 OE2 GLU A 14 3.031 -0.925 8.935 1.00 0.00 O ATOM 0 H GLU A 14 -0.201 -0.055 5.601 1.00 0.00 H new ATOM 0 HA GLU A 14 -1.524 1.077 7.837 1.00 0.00 H new ATOM 0 HB2 GLU A 14 1.300 1.452 6.767 1.00 0.00 H new ATOM 0 HB3 GLU A 14 0.756 1.941 8.359 1.00 0.00 H new ATOM 0 HG2 GLU A 14 0.044 -0.602 8.570 1.00 0.00 H new ATOM 0 HG3 GLU A 14 1.203 -0.828 7.275 1.00 0.00 H new ATOM 192 N SER A 15 -0.165 3.339 5.844 1.00 0.00 N ATOM 193 CA SER A 15 -0.297 4.710 5.367 1.00 0.00 C ATOM 194 C SER A 15 0.837 5.064 4.409 1.00 0.00 C ATOM 195 O SER A 15 1.833 4.347 4.318 1.00 0.00 O ATOM 196 CB SER A 15 -0.306 5.684 6.547 1.00 0.00 C ATOM 197 OG SER A 15 0.776 5.431 7.426 1.00 0.00 O ATOM 0 H SER A 15 0.688 2.868 5.542 1.00 0.00 H new ATOM 0 HA SER A 15 -1.242 4.792 4.830 1.00 0.00 H new ATOM 0 HB2 SER A 15 -0.247 6.708 6.178 1.00 0.00 H new ATOM 0 HB3 SER A 15 -1.247 5.595 7.089 1.00 0.00 H new ATOM 0 HG SER A 15 0.749 6.068 8.170 1.00 0.00 H new ATOM 203 N ALA A 16 0.676 6.175 3.697 1.00 0.00 N ATOM 204 CA ALA A 16 1.686 6.626 2.748 1.00 0.00 C ATOM 205 C ALA A 16 2.224 8.001 3.130 1.00 0.00 C ATOM 206 O ALA A 16 1.655 8.686 3.980 1.00 0.00 O ATOM 207 CB ALA A 16 1.111 6.654 1.339 1.00 0.00 C ATOM 0 H ALA A 16 -0.144 6.779 3.760 1.00 0.00 H new ATOM 0 HA ALA A 16 2.516 5.920 2.776 1.00 0.00 H new ATOM 0 HB1 ALA A 16 1.876 6.993 0.640 1.00 0.00 H new ATOM 0 HB2 ALA A 16 0.783 5.653 1.060 1.00 0.00 H new ATOM 0 HB3 ALA A 16 0.262 7.337 1.306 1.00 0.00 H new ATOM 213 N SER A 17 3.323 8.398 2.496 1.00 0.00 N ATOM 214 CA SER A 17 3.939 9.690 2.773 1.00 0.00 C ATOM 215 C SER A 17 4.825 10.130 1.611 1.00 0.00 C ATOM 216 O SER A 17 5.232 9.315 0.784 1.00 0.00 O ATOM 217 CB SER A 17 4.764 9.620 4.060 1.00 0.00 C ATOM 218 OG SER A 17 3.927 9.611 5.203 1.00 0.00 O ATOM 0 H SER A 17 3.804 7.844 1.788 1.00 0.00 H new ATOM 0 HA SER A 17 3.143 10.424 2.899 1.00 0.00 H new ATOM 0 HB2 SER A 17 5.382 8.722 4.051 1.00 0.00 H new ATOM 0 HB3 SER A 17 5.441 10.473 4.108 1.00 0.00 H new ATOM 0 HG SER A 17 3.576 10.513 5.358 1.00 0.00 H new ATOM 224 N ASN A 18 5.119 11.425 1.557 1.00 0.00 N ATOM 225 CA ASN A 18 5.956 11.974 0.496 1.00 0.00 C ATOM 226 C ASN A 18 5.239 11.914 -0.849 1.00 0.00 C ATOM 227 O ASN A 18 5.812 11.484 -1.851 1.00 0.00 O ATOM 228 CB ASN A 18 7.280 11.211 0.416 1.00 0.00 C ATOM 229 CG ASN A 18 7.939 11.053 1.772 1.00 0.00 C ATOM 230 OD1 ASN A 18 7.878 9.846 2.322 1.00 0.00 O flip ATOM 231 ND2 ASN A 18 8.497 12.004 2.318 1.00 0.00 N flip ATOM 0 H ASN A 18 4.791 12.113 2.235 1.00 0.00 H new ATOM 0 HA ASN A 18 6.160 13.018 0.732 1.00 0.00 H new ATOM 0 HB2 ASN A 18 7.103 10.226 -0.016 1.00 0.00 H new ATOM 0 HB3 ASN A 18 7.959 11.736 -0.256 1.00 0.00 H new ATOM 0 HD21 ASN A 18 8.520 12.914 1.858 1.00 0.00 H new ATOM 0 HD22 ASN A 18 8.937 11.882 3.230 1.00 0.00 H new ATOM 238 N ILE A 19 3.983 12.348 -0.864 1.00 0.00 N ATOM 239 CA ILE A 19 3.188 12.345 -2.086 1.00 0.00 C ATOM 240 C ILE A 19 3.330 13.665 -2.836 1.00 0.00 C ATOM 241 O ILE A 19 3.292 14.747 -2.252 1.00 0.00 O ATOM 242 CB ILE A 19 1.698 12.094 -1.788 1.00 0.00 C ATOM 243 CG1 ILE A 19 1.508 10.714 -1.155 1.00 0.00 C ATOM 244 CG2 ILE A 19 0.876 12.216 -3.062 1.00 0.00 C ATOM 245 CD1 ILE A 19 0.086 10.205 -1.232 1.00 0.00 C ATOM 0 H ILE A 19 3.494 12.706 -0.044 1.00 0.00 H new ATOM 0 HA ILE A 19 3.567 11.534 -2.708 1.00 0.00 H new ATOM 0 HB ILE A 19 1.351 12.848 -1.081 1.00 0.00 H new ATOM 0 HG12 ILE A 19 2.168 10.002 -1.651 1.00 0.00 H new ATOM 0 HG13 ILE A 19 1.814 10.757 -0.110 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -0.175 12.036 -2.836 1.00 0.00 H new ATOM 0 HG22 ILE A 19 0.992 13.218 -3.475 1.00 0.00 H new ATOM 0 HG23 ILE A 19 1.221 11.481 -3.790 1.00 0.00 H new ATOM 0 HD11 ILE A 19 0.025 9.222 -0.764 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -0.577 10.896 -0.711 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -0.217 10.129 -2.276 1.00 0.00 H new ATOM 257 N PRO A 20 3.495 13.575 -4.164 1.00 0.00 N ATOM 258 CA PRO A 20 3.643 14.753 -5.025 1.00 0.00 C ATOM 259 C PRO A 20 2.350 15.552 -5.141 1.00 0.00 C ATOM 260 O PRO A 20 1.399 15.122 -5.796 1.00 0.00 O ATOM 261 CB PRO A 20 4.027 14.155 -6.381 1.00 0.00 C ATOM 262 CG PRO A 20 3.467 12.775 -6.358 1.00 0.00 C ATOM 263 CD PRO A 20 3.550 12.317 -4.928 1.00 0.00 C ATOM 0 HA PRO A 20 4.377 15.457 -4.631 1.00 0.00 H new ATOM 0 HB2 PRO A 20 3.611 14.738 -7.203 1.00 0.00 H new ATOM 0 HB3 PRO A 20 5.109 14.141 -6.516 1.00 0.00 H new ATOM 0 HG2 PRO A 20 2.436 12.767 -6.711 1.00 0.00 H new ATOM 0 HG3 PRO A 20 4.034 12.113 -7.013 1.00 0.00 H new ATOM 0 HD2 PRO A 20 2.725 11.654 -4.670 1.00 0.00 H new ATOM 0 HD3 PRO A 20 4.472 11.769 -4.734 1.00 0.00 H new ATOM 271 N LYS A 21 2.320 16.717 -4.503 1.00 0.00 N ATOM 272 CA LYS A 21 1.143 17.578 -4.536 1.00 0.00 C ATOM 273 C LYS A 21 0.800 17.975 -5.968 1.00 0.00 C ATOM 274 O LYS A 21 1.455 17.544 -6.918 1.00 0.00 O ATOM 275 CB LYS A 21 1.380 18.831 -3.690 1.00 0.00 C ATOM 276 CG LYS A 21 2.524 19.695 -4.190 1.00 0.00 C ATOM 277 CD LYS A 21 2.882 20.780 -3.188 1.00 0.00 C ATOM 278 CE LYS A 21 3.801 20.251 -2.097 1.00 0.00 C ATOM 279 NZ LYS A 21 4.556 21.347 -1.429 1.00 0.00 N ATOM 0 H LYS A 21 3.098 17.087 -3.956 1.00 0.00 H new ATOM 0 HA LYS A 21 0.303 17.021 -4.122 1.00 0.00 H new ATOM 0 HB2 LYS A 21 0.467 19.426 -3.673 1.00 0.00 H new ATOM 0 HB3 LYS A 21 1.584 18.532 -2.662 1.00 0.00 H new ATOM 0 HG2 LYS A 21 3.397 19.071 -4.379 1.00 0.00 H new ATOM 0 HG3 LYS A 21 2.248 20.152 -5.140 1.00 0.00 H new ATOM 0 HD2 LYS A 21 3.368 21.608 -3.705 1.00 0.00 H new ATOM 0 HD3 LYS A 21 1.972 21.176 -2.738 1.00 0.00 H new ATOM 0 HE2 LYS A 21 3.212 19.712 -1.356 1.00 0.00 H new ATOM 0 HE3 LYS A 21 4.503 19.537 -2.528 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 5.171 20.946 -0.692 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 5.138 21.846 -2.132 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 3.887 22.015 -0.996 1.00 0.00 H new ATOM 293 N THR A 22 -0.230 18.802 -6.117 1.00 0.00 N ATOM 294 CA THR A 22 -0.660 19.258 -7.433 1.00 0.00 C ATOM 295 C THR A 22 -0.776 20.777 -7.478 1.00 0.00 C ATOM 296 O THR A 22 -0.584 21.455 -6.468 1.00 0.00 O ATOM 297 CB THR A 22 -2.014 18.640 -7.828 1.00 0.00 C ATOM 298 OG1 THR A 22 -3.032 19.067 -6.915 1.00 0.00 O ATOM 299 CG2 THR A 22 -1.935 17.121 -7.831 1.00 0.00 C ATOM 0 H THR A 22 -0.782 19.170 -5.342 1.00 0.00 H new ATOM 0 HA THR A 22 0.100 18.933 -8.143 1.00 0.00 H new ATOM 0 HB THR A 22 -2.263 18.978 -8.834 1.00 0.00 H new ATOM 0 HG1 THR A 22 -3.890 18.671 -7.174 1.00 0.00 H new ATOM 0 HG21 THR A 22 -2.903 16.707 -8.113 1.00 0.00 H new ATOM 0 HG22 THR A 22 -1.179 16.797 -8.547 1.00 0.00 H new ATOM 0 HG23 THR A 22 -1.666 16.769 -6.835 1.00 0.00 H new ATOM 356 N LYS A 26 -3.612 19.710 -2.717 1.00 0.00 N ATOM 357 CA LYS A 26 -3.400 18.348 -2.240 1.00 0.00 C ATOM 358 C LYS A 26 -4.424 17.394 -2.844 1.00 0.00 C ATOM 359 O LYS A 26 -5.619 17.462 -2.554 1.00 0.00 O ATOM 360 CB LYS A 26 -3.483 18.302 -0.712 1.00 0.00 C ATOM 361 CG LYS A 26 -2.441 19.163 -0.020 1.00 0.00 C ATOM 362 CD LYS A 26 -2.472 18.972 1.487 1.00 0.00 C ATOM 363 CE LYS A 26 -1.132 19.318 2.120 1.00 0.00 C ATOM 364 NZ LYS A 26 -0.986 20.783 2.343 1.00 0.00 N ATOM 0 HA LYS A 26 -2.405 18.031 -2.554 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -4.476 18.627 -0.401 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -3.367 17.270 -0.381 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -1.450 18.912 -0.399 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -2.618 20.212 -0.259 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -3.252 19.599 1.918 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -2.729 17.938 1.719 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -1.033 18.794 3.071 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -0.325 18.966 1.477 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -0.060 20.978 2.775 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -1.055 21.281 1.433 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -1.741 21.115 2.977 1.00 0.00 H new ATOM 378 N PRO A 27 -3.949 16.481 -3.704 1.00 0.00 N ATOM 379 CA PRO A 27 -4.807 15.494 -4.366 1.00 0.00 C ATOM 380 C PRO A 27 -5.340 14.445 -3.395 1.00 0.00 C ATOM 381 O PRO A 27 -4.993 14.446 -2.214 1.00 0.00 O ATOM 382 CB PRO A 27 -3.876 14.846 -5.394 1.00 0.00 C ATOM 383 CG PRO A 27 -2.507 15.032 -4.835 1.00 0.00 C ATOM 384 CD PRO A 27 -2.536 16.341 -4.096 1.00 0.00 C ATOM 0 HA PRO A 27 -5.693 15.953 -4.803 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -4.109 13.790 -5.528 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -3.973 15.321 -6.370 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -2.244 14.212 -4.167 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -1.760 15.048 -5.629 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -1.878 16.327 -3.227 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -2.211 17.167 -4.729 1.00 0.00 H new ATOM 392 N ASP A 28 -6.184 13.552 -3.900 1.00 0.00 N ATOM 393 CA ASP A 28 -6.763 12.497 -3.078 1.00 0.00 C ATOM 394 C ASP A 28 -6.100 11.155 -3.369 1.00 0.00 C ATOM 395 O ASP A 28 -6.458 10.449 -4.312 1.00 0.00 O ATOM 396 CB ASP A 28 -8.270 12.399 -3.322 1.00 0.00 C ATOM 397 CG ASP A 28 -8.988 13.705 -3.043 1.00 0.00 C ATOM 398 OD1 ASP A 28 -8.377 14.774 -3.252 1.00 0.00 O ATOM 399 OD2 ASP A 28 -10.160 13.658 -2.614 1.00 0.00 O ATOM 0 H ASP A 28 -6.482 13.538 -4.875 1.00 0.00 H new ATOM 0 HA ASP A 28 -6.588 12.749 -2.032 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -8.449 12.103 -4.356 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -8.687 11.616 -2.689 1.00 0.00 H new ATOM 404 N PRO A 29 -5.108 10.792 -2.542 1.00 0.00 N ATOM 405 CA PRO A 29 -4.373 9.533 -2.691 1.00 0.00 C ATOM 406 C PRO A 29 -5.231 8.318 -2.353 1.00 0.00 C ATOM 407 O PRO A 29 -6.104 8.384 -1.488 1.00 0.00 O ATOM 408 CB PRO A 29 -3.224 9.671 -1.689 1.00 0.00 C ATOM 409 CG PRO A 29 -3.729 10.627 -0.664 1.00 0.00 C ATOM 410 CD PRO A 29 -4.628 11.584 -1.397 1.00 0.00 C ATOM 0 HA PRO A 29 -4.044 9.373 -3.718 1.00 0.00 H new ATOM 0 HB2 PRO A 29 -2.970 8.709 -1.243 1.00 0.00 H new ATOM 0 HB3 PRO A 29 -2.321 10.047 -2.171 1.00 0.00 H new ATOM 0 HG2 PRO A 29 -4.274 10.104 0.122 1.00 0.00 H new ATOM 0 HG3 PRO A 29 -2.905 11.155 -0.184 1.00 0.00 H new ATOM 0 HD2 PRO A 29 -5.452 11.922 -0.769 1.00 0.00 H new ATOM 0 HD3 PRO A 29 -4.088 12.474 -1.722 1.00 0.00 H new ATOM 418 N ILE A 30 -4.976 7.210 -3.041 1.00 0.00 N ATOM 419 CA ILE A 30 -5.724 5.980 -2.813 1.00 0.00 C ATOM 420 C ILE A 30 -4.929 4.761 -3.266 1.00 0.00 C ATOM 421 O ILE A 30 -4.447 4.706 -4.398 1.00 0.00 O ATOM 422 CB ILE A 30 -7.077 5.999 -3.547 1.00 0.00 C ATOM 423 CG1 ILE A 30 -7.962 4.850 -3.062 1.00 0.00 C ATOM 424 CG2 ILE A 30 -6.864 5.912 -5.051 1.00 0.00 C ATOM 425 CD1 ILE A 30 -9.441 5.103 -3.253 1.00 0.00 C ATOM 0 H ILE A 30 -4.257 7.139 -3.761 1.00 0.00 H new ATOM 0 HA ILE A 30 -5.904 5.915 -1.740 1.00 0.00 H new ATOM 0 HB ILE A 30 -7.581 6.939 -3.324 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -7.686 3.940 -3.595 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -7.766 4.673 -2.005 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -7.830 5.926 -5.557 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -6.267 6.761 -5.384 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -6.342 4.986 -5.292 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -10.007 4.246 -2.887 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -9.732 5.995 -2.698 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -9.651 5.251 -4.312 1.00 0.00 H new ATOM 437 N VAL A 31 -4.797 3.782 -2.376 1.00 0.00 N ATOM 438 CA VAL A 31 -4.063 2.561 -2.686 1.00 0.00 C ATOM 439 C VAL A 31 -4.935 1.576 -3.456 1.00 0.00 C ATOM 440 O VAL A 31 -6.112 1.398 -3.145 1.00 0.00 O ATOM 441 CB VAL A 31 -3.544 1.878 -1.406 1.00 0.00 C ATOM 442 CG1 VAL A 31 -2.647 0.700 -1.755 1.00 0.00 C ATOM 443 CG2 VAL A 31 -2.807 2.880 -0.530 1.00 0.00 C ATOM 0 H VAL A 31 -5.189 3.811 -1.435 1.00 0.00 H new ATOM 0 HA VAL A 31 -3.214 2.851 -3.305 1.00 0.00 H new ATOM 0 HB VAL A 31 -4.398 1.499 -0.845 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -2.290 0.230 -0.838 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -3.212 -0.027 -2.339 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -1.796 1.051 -2.338 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -2.447 2.381 0.370 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -1.961 3.291 -1.080 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -3.485 3.687 -0.251 1.00 0.00 H new ATOM 453 N SER A 32 -4.348 0.938 -4.464 1.00 0.00 N ATOM 454 CA SER A 32 -5.072 -0.027 -5.283 1.00 0.00 C ATOM 455 C SER A 32 -4.268 -1.314 -5.445 1.00 0.00 C ATOM 456 O SER A 32 -3.302 -1.364 -6.206 1.00 0.00 O ATOM 457 CB SER A 32 -5.384 0.569 -6.656 1.00 0.00 C ATOM 458 OG SER A 32 -6.151 1.755 -6.536 1.00 0.00 O ATOM 0 H SER A 32 -3.373 1.072 -4.733 1.00 0.00 H new ATOM 0 HA SER A 32 -6.008 -0.265 -4.778 1.00 0.00 H new ATOM 0 HB2 SER A 32 -4.454 0.786 -7.182 1.00 0.00 H new ATOM 0 HB3 SER A 32 -5.928 -0.160 -7.257 1.00 0.00 H new ATOM 0 HG SER A 32 -6.335 2.117 -7.428 1.00 0.00 H new ATOM 464 N VAL A 33 -4.675 -2.353 -4.722 1.00 0.00 N ATOM 465 CA VAL A 33 -3.994 -3.641 -4.786 1.00 0.00 C ATOM 466 C VAL A 33 -4.683 -4.579 -5.771 1.00 0.00 C ATOM 467 O VAL A 33 -5.908 -4.706 -5.769 1.00 0.00 O ATOM 468 CB VAL A 33 -3.940 -4.316 -3.402 1.00 0.00 C ATOM 469 CG1 VAL A 33 -3.299 -5.692 -3.504 1.00 0.00 C ATOM 470 CG2 VAL A 33 -3.188 -3.441 -2.412 1.00 0.00 C ATOM 0 H VAL A 33 -5.472 -2.328 -4.086 1.00 0.00 H new ATOM 0 HA VAL A 33 -2.977 -3.445 -5.127 1.00 0.00 H new ATOM 0 HB VAL A 33 -4.960 -4.442 -3.038 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -3.269 -6.154 -2.517 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -3.884 -6.317 -4.179 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -2.284 -5.593 -3.889 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -3.160 -3.933 -1.440 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -2.170 -3.281 -2.768 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -3.694 -2.480 -2.318 1.00 0.00 H new ATOM 480 N ILE A 34 -3.888 -5.234 -6.610 1.00 0.00 N ATOM 481 CA ILE A 34 -4.422 -6.162 -7.599 1.00 0.00 C ATOM 482 C ILE A 34 -3.756 -7.529 -7.486 1.00 0.00 C ATOM 483 O ILE A 34 -2.539 -7.653 -7.626 1.00 0.00 O ATOM 484 CB ILE A 34 -4.232 -5.629 -9.032 1.00 0.00 C ATOM 485 CG1 ILE A 34 -5.070 -4.366 -9.244 1.00 0.00 C ATOM 486 CG2 ILE A 34 -4.606 -6.696 -10.049 1.00 0.00 C ATOM 487 CD1 ILE A 34 -4.401 -3.106 -8.741 1.00 0.00 C ATOM 0 H ILE A 34 -2.873 -5.139 -6.625 1.00 0.00 H new ATOM 0 HA ILE A 34 -5.488 -6.261 -7.395 1.00 0.00 H new ATOM 0 HB ILE A 34 -3.182 -5.374 -9.173 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -5.283 -4.255 -10.307 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -6.028 -4.486 -8.738 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -4.466 -6.304 -11.056 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -3.971 -7.571 -9.909 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -5.649 -6.980 -9.912 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -5.052 -2.251 -8.924 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -4.213 -3.196 -7.671 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -3.456 -2.962 -9.265 1.00 0.00 H new ATOM 499 N PHE A 35 -4.563 -8.555 -7.233 1.00 0.00 N ATOM 500 CA PHE A 35 -4.052 -9.914 -7.102 1.00 0.00 C ATOM 501 C PHE A 35 -5.152 -10.937 -7.372 1.00 0.00 C ATOM 502 O PHE A 35 -6.248 -10.848 -6.818 1.00 0.00 O ATOM 503 CB PHE A 35 -3.472 -10.131 -5.703 1.00 0.00 C ATOM 504 CG PHE A 35 -2.801 -11.464 -5.532 1.00 0.00 C ATOM 505 CD1 PHE A 35 -3.527 -12.573 -5.129 1.00 0.00 C ATOM 506 CD2 PHE A 35 -1.444 -11.608 -5.773 1.00 0.00 C ATOM 507 CE1 PHE A 35 -2.913 -13.801 -4.971 1.00 0.00 C ATOM 508 CE2 PHE A 35 -0.825 -12.833 -5.617 1.00 0.00 C ATOM 509 CZ PHE A 35 -1.560 -13.931 -5.214 1.00 0.00 C ATOM 0 H PHE A 35 -5.573 -8.471 -7.115 1.00 0.00 H new ATOM 0 HA PHE A 35 -3.262 -10.051 -7.841 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -2.752 -9.341 -5.490 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -4.272 -10.039 -4.968 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -4.585 -12.477 -4.936 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -0.864 -10.753 -6.086 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -3.491 -14.658 -4.658 1.00 0.00 H new ATOM 0 HE2 PHE A 35 0.233 -12.932 -5.810 1.00 0.00 H new ATOM 0 HZ PHE A 35 -1.077 -14.889 -5.089 1.00 0.00 H new ATOM 519 N LYS A 36 -4.852 -11.908 -8.228 1.00 0.00 N ATOM 520 CA LYS A 36 -5.813 -12.949 -8.573 1.00 0.00 C ATOM 521 C LYS A 36 -7.068 -12.346 -9.196 1.00 0.00 C ATOM 522 O LYS A 36 -8.185 -12.630 -8.764 1.00 0.00 O ATOM 523 CB LYS A 36 -6.187 -13.758 -7.329 1.00 0.00 C ATOM 524 CG LYS A 36 -5.053 -14.618 -6.800 1.00 0.00 C ATOM 525 CD LYS A 36 -5.034 -15.986 -7.462 1.00 0.00 C ATOM 526 CE LYS A 36 -3.668 -16.644 -7.342 1.00 0.00 C ATOM 527 NZ LYS A 36 -2.704 -16.109 -8.343 1.00 0.00 N ATOM 0 H LYS A 36 -3.950 -11.996 -8.696 1.00 0.00 H new ATOM 0 HA LYS A 36 -5.348 -13.611 -9.304 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -6.510 -13.074 -6.544 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -7.038 -14.398 -7.564 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -4.102 -14.115 -6.975 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -5.158 -14.736 -5.721 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -5.788 -16.624 -7.002 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -5.300 -15.886 -8.514 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -3.275 -16.484 -6.338 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -3.771 -17.721 -7.476 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -1.785 -16.583 -8.228 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -3.066 -16.284 -9.302 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -2.586 -15.086 -8.199 1.00 0.00 H new ATOM 541 N ASP A 37 -6.876 -11.514 -10.214 1.00 0.00 N ATOM 542 CA ASP A 37 -7.993 -10.873 -10.899 1.00 0.00 C ATOM 543 C ASP A 37 -8.908 -10.167 -9.903 1.00 0.00 C ATOM 544 O ASP A 37 -10.113 -10.059 -10.123 1.00 0.00 O ATOM 545 CB ASP A 37 -8.789 -11.905 -11.698 1.00 0.00 C ATOM 546 CG ASP A 37 -8.173 -12.187 -13.055 1.00 0.00 C ATOM 547 OD1 ASP A 37 -6.928 -12.201 -13.149 1.00 0.00 O ATOM 548 OD2 ASP A 37 -8.936 -12.393 -14.022 1.00 0.00 O ATOM 0 H ASP A 37 -5.958 -11.268 -10.583 1.00 0.00 H new ATOM 0 HA ASP A 37 -7.588 -10.128 -11.584 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -8.849 -12.833 -11.129 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -9.810 -11.547 -11.833 1.00 0.00 H new ATOM 553 N GLU A 38 -8.325 -9.689 -8.807 1.00 0.00 N ATOM 554 CA GLU A 38 -9.089 -8.996 -7.777 1.00 0.00 C ATOM 555 C GLU A 38 -8.453 -7.650 -7.441 1.00 0.00 C ATOM 556 O GLU A 38 -7.376 -7.591 -6.846 1.00 0.00 O ATOM 557 CB GLU A 38 -9.186 -9.856 -6.516 1.00 0.00 C ATOM 558 CG GLU A 38 -10.418 -9.568 -5.675 1.00 0.00 C ATOM 559 CD GLU A 38 -11.645 -10.312 -6.164 1.00 0.00 C ATOM 560 OE1 GLU A 38 -11.827 -11.483 -5.768 1.00 0.00 O ATOM 561 OE2 GLU A 38 -12.424 -9.723 -6.942 1.00 0.00 O ATOM 0 H GLU A 38 -7.327 -9.769 -8.611 1.00 0.00 H new ATOM 0 HA GLU A 38 -10.092 -8.818 -8.164 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -9.190 -10.907 -6.803 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -8.296 -9.695 -5.908 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -10.219 -9.844 -4.639 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -10.619 -8.497 -5.686 1.00 0.00 H new ATOM 568 N LYS A 39 -9.125 -6.571 -7.826 1.00 0.00 N ATOM 569 CA LYS A 39 -8.628 -5.225 -7.566 1.00 0.00 C ATOM 570 C LYS A 39 -9.328 -4.611 -6.358 1.00 0.00 C ATOM 571 O LYS A 39 -10.516 -4.291 -6.411 1.00 0.00 O ATOM 572 CB LYS A 39 -8.834 -4.337 -8.795 1.00 0.00 C ATOM 573 CG LYS A 39 -8.192 -2.966 -8.669 1.00 0.00 C ATOM 574 CD LYS A 39 -7.768 -2.423 -10.023 1.00 0.00 C ATOM 575 CE LYS A 39 -8.970 -2.121 -10.904 1.00 0.00 C ATOM 576 NZ LYS A 39 -9.812 -1.030 -10.340 1.00 0.00 N ATOM 0 H LYS A 39 -10.017 -6.602 -8.320 1.00 0.00 H new ATOM 0 HA LYS A 39 -7.562 -5.293 -7.350 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -8.425 -4.842 -9.670 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -9.903 -4.214 -8.969 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -8.895 -2.275 -8.203 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -7.324 -3.029 -8.013 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -7.180 -1.516 -9.884 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -7.123 -3.147 -10.521 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -8.628 -1.838 -11.900 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -9.572 -3.022 -11.018 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -10.475 -0.692 -11.067 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -10.347 -1.391 -9.524 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -9.203 -0.244 -10.034 1.00 0.00 H new ATOM 590 N LYS A 40 -8.584 -4.447 -5.269 1.00 0.00 N ATOM 591 CA LYS A 40 -9.131 -3.868 -4.048 1.00 0.00 C ATOM 592 C LYS A 40 -8.334 -2.638 -3.624 1.00 0.00 C ATOM 593 O LYS A 40 -7.115 -2.700 -3.467 1.00 0.00 O ATOM 594 CB LYS A 40 -9.128 -4.904 -2.922 1.00 0.00 C ATOM 595 CG LYS A 40 -9.940 -6.148 -3.238 1.00 0.00 C ATOM 596 CD LYS A 40 -10.134 -7.016 -2.005 1.00 0.00 C ATOM 597 CE LYS A 40 -10.503 -8.443 -2.380 1.00 0.00 C ATOM 598 NZ LYS A 40 -11.338 -9.093 -1.333 1.00 0.00 N ATOM 0 H LYS A 40 -7.600 -4.707 -5.208 1.00 0.00 H new ATOM 0 HA LYS A 40 -10.158 -3.562 -4.249 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -8.099 -5.196 -2.711 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -9.521 -4.444 -2.015 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -10.912 -5.858 -3.636 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -9.437 -6.724 -4.014 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -9.218 -7.019 -1.413 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -10.917 -6.589 -1.378 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -11.044 -8.442 -3.327 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -9.594 -9.025 -2.533 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -11.945 -9.815 -1.772 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -10.721 -9.542 -0.626 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -11.932 -8.377 -0.869 1.00 0.00 H new ATOM 612 N LYS A 41 -9.031 -1.522 -3.438 1.00 0.00 N ATOM 613 CA LYS A 41 -8.390 -0.278 -3.030 1.00 0.00 C ATOM 614 C LYS A 41 -8.917 0.186 -1.676 1.00 0.00 C ATOM 615 O LYS A 41 -10.035 -0.150 -1.284 1.00 0.00 O ATOM 616 CB LYS A 41 -8.624 0.809 -4.080 1.00 0.00 C ATOM 617 CG LYS A 41 -10.089 1.026 -4.416 1.00 0.00 C ATOM 618 CD LYS A 41 -10.769 1.923 -3.394 1.00 0.00 C ATOM 619 CE LYS A 41 -11.928 2.691 -4.010 1.00 0.00 C ATOM 620 NZ LYS A 41 -12.536 3.647 -3.043 1.00 0.00 N ATOM 0 H LYS A 41 -10.041 -1.454 -3.564 1.00 0.00 H new ATOM 0 HA LYS A 41 -7.319 -0.462 -2.940 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -8.200 1.747 -3.721 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -8.087 0.544 -4.991 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -10.174 1.472 -5.407 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -10.601 0.064 -4.455 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -11.132 1.319 -2.563 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -10.043 2.625 -2.984 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -11.578 3.235 -4.887 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -12.688 1.989 -4.353 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -13.562 3.700 -3.206 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -12.356 3.320 -2.072 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -12.115 4.589 -3.175 1.00 0.00 H new ATOM 634 N THR A 42 -8.105 0.962 -0.964 1.00 0.00 N ATOM 635 CA THR A 42 -8.490 1.473 0.346 1.00 0.00 C ATOM 636 C THR A 42 -9.373 2.708 0.216 1.00 0.00 C ATOM 637 O THR A 42 -9.491 3.290 -0.863 1.00 0.00 O ATOM 638 CB THR A 42 -7.254 1.826 1.196 1.00 0.00 C ATOM 639 OG1 THR A 42 -6.582 2.960 0.636 1.00 0.00 O ATOM 640 CG2 THR A 42 -6.295 0.648 1.272 1.00 0.00 C ATOM 0 H THR A 42 -7.177 1.250 -1.273 1.00 0.00 H new ATOM 0 HA THR A 42 -9.050 0.681 0.843 1.00 0.00 H new ATOM 0 HB THR A 42 -7.590 2.065 2.205 1.00 0.00 H new ATOM 0 HG1 THR A 42 -6.266 3.542 1.358 1.00 0.00 H new ATOM 0 HG21 THR A 42 -5.430 0.921 1.877 1.00 0.00 H new ATOM 0 HG22 THR A 42 -6.801 -0.204 1.726 1.00 0.00 H new ATOM 0 HG23 THR A 42 -5.965 0.382 0.268 1.00 0.00 H new ATOM 648 N LYS A 43 -9.992 3.106 1.323 1.00 0.00 N ATOM 649 CA LYS A 43 -10.864 4.275 1.334 1.00 0.00 C ATOM 650 C LYS A 43 -10.102 5.527 0.913 1.00 0.00 C ATOM 651 O LYS A 43 -9.147 5.937 1.573 1.00 0.00 O ATOM 652 CB LYS A 43 -11.464 4.475 2.728 1.00 0.00 C ATOM 653 CG LYS A 43 -10.422 4.594 3.827 1.00 0.00 C ATOM 654 CD LYS A 43 -11.069 4.766 5.191 1.00 0.00 C ATOM 655 CE LYS A 43 -10.054 5.198 6.238 1.00 0.00 C ATOM 656 NZ LYS A 43 -10.708 5.828 7.418 1.00 0.00 N ATOM 0 H LYS A 43 -9.906 2.636 2.224 1.00 0.00 H new ATOM 0 HA LYS A 43 -11.669 4.104 0.619 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -12.080 5.374 2.724 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -12.124 3.638 2.954 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -9.793 3.704 3.831 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -9.771 5.444 3.622 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -11.865 5.508 5.126 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -11.532 3.828 5.497 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -9.476 4.333 6.562 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -9.351 5.902 5.793 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -9.983 6.108 8.108 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -11.239 6.669 7.113 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -11.360 5.148 7.858 1.00 0.00 H new ATOM 670 N LYS A 44 -10.530 6.131 -0.191 1.00 0.00 N ATOM 671 CA LYS A 44 -9.890 7.338 -0.700 1.00 0.00 C ATOM 672 C LYS A 44 -9.764 8.391 0.397 1.00 0.00 C ATOM 673 O LYS A 44 -10.746 8.740 1.052 1.00 0.00 O ATOM 674 CB LYS A 44 -10.687 7.905 -1.877 1.00 0.00 C ATOM 675 CG LYS A 44 -11.765 8.891 -1.462 1.00 0.00 C ATOM 676 CD LYS A 44 -12.552 9.394 -2.661 1.00 0.00 C ATOM 677 CE LYS A 44 -13.467 10.548 -2.283 1.00 0.00 C ATOM 678 NZ LYS A 44 -12.719 11.657 -1.628 1.00 0.00 N ATOM 0 H LYS A 44 -11.318 5.804 -0.750 1.00 0.00 H new ATOM 0 HA LYS A 44 -8.889 7.073 -1.041 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -10.001 8.398 -2.566 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -11.149 7.082 -2.422 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -12.443 8.414 -0.755 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -11.308 9.735 -0.945 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -11.862 9.716 -3.441 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -13.145 8.579 -3.076 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -13.965 10.924 -3.176 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -14.246 10.189 -1.611 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -13.104 12.570 -1.944 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -12.816 11.579 -0.595 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -11.713 11.598 -1.887 1.00 0.00 H new ATOM 692 N VAL A 45 -8.549 8.895 0.590 1.00 0.00 N ATOM 693 CA VAL A 45 -8.296 9.910 1.606 1.00 0.00 C ATOM 694 C VAL A 45 -8.440 11.313 1.028 1.00 0.00 C ATOM 695 O VAL A 45 -7.928 11.606 -0.053 1.00 0.00 O ATOM 696 CB VAL A 45 -6.888 9.758 2.212 1.00 0.00 C ATOM 697 CG1 VAL A 45 -6.625 10.855 3.233 1.00 0.00 C ATOM 698 CG2 VAL A 45 -6.725 8.383 2.841 1.00 0.00 C ATOM 0 H VAL A 45 -7.725 8.617 0.057 1.00 0.00 H new ATOM 0 HA VAL A 45 -9.039 9.765 2.391 1.00 0.00 H new ATOM 0 HB VAL A 45 -6.154 9.856 1.412 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -5.626 10.731 3.651 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -6.698 11.828 2.748 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -7.363 10.792 4.033 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -5.725 8.293 3.264 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -7.466 8.254 3.630 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -6.868 7.616 2.080 1.00 0.00 H new ATOM 708 N ASP A 46 -9.139 12.178 1.755 1.00 0.00 N ATOM 709 CA ASP A 46 -9.350 13.552 1.315 1.00 0.00 C ATOM 710 C ASP A 46 -8.020 14.239 1.022 1.00 0.00 C ATOM 711 O ASP A 46 -6.954 13.700 1.317 1.00 0.00 O ATOM 712 CB ASP A 46 -10.120 14.338 2.378 1.00 0.00 C ATOM 713 CG ASP A 46 -11.622 14.225 2.207 1.00 0.00 C ATOM 714 OD1 ASP A 46 -12.091 13.149 1.781 1.00 0.00 O ATOM 715 OD2 ASP A 46 -12.328 15.213 2.498 1.00 0.00 O ATOM 0 H ASP A 46 -9.569 11.952 2.652 1.00 0.00 H new ATOM 0 HA ASP A 46 -9.936 13.527 0.396 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -9.842 13.974 3.367 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -9.830 15.388 2.331 1.00 0.00 H new ATOM 720 N ASN A 47 -8.091 15.431 0.438 1.00 0.00 N ATOM 721 CA ASN A 47 -6.892 16.190 0.103 1.00 0.00 C ATOM 722 C ASN A 47 -5.856 16.093 1.219 1.00 0.00 C ATOM 723 O ASN A 47 -5.972 16.760 2.246 1.00 0.00 O ATOM 724 CB ASN A 47 -7.246 17.656 -0.152 1.00 0.00 C ATOM 725 CG ASN A 47 -7.619 18.391 1.121 1.00 0.00 C ATOM 726 OD1 ASN A 47 -8.734 18.255 1.626 1.00 0.00 O ATOM 727 ND2 ASN A 47 -6.685 19.175 1.646 1.00 0.00 N ATOM 0 H ASN A 47 -8.966 15.892 0.187 1.00 0.00 H new ATOM 0 HA ASN A 47 -6.464 15.763 -0.804 1.00 0.00 H new ATOM 0 HB2 ASN A 47 -6.398 18.155 -0.621 1.00 0.00 H new ATOM 0 HB3 ASN A 47 -8.077 17.709 -0.856 1.00 0.00 H new ATOM 0 HD21 ASN A 47 -6.878 19.695 2.502 1.00 0.00 H new ATOM 0 HD22 ASN A 47 -5.775 19.257 1.193 1.00 0.00 H new ATOM 734 N GLU A 48 -4.844 15.256 1.009 1.00 0.00 N ATOM 735 CA GLU A 48 -3.789 15.072 1.998 1.00 0.00 C ATOM 736 C GLU A 48 -2.582 14.370 1.381 1.00 0.00 C ATOM 737 O GLU A 48 -2.725 13.378 0.664 1.00 0.00 O ATOM 738 CB GLU A 48 -4.310 14.263 3.187 1.00 0.00 C ATOM 739 CG GLU A 48 -3.208 13.674 4.053 1.00 0.00 C ATOM 740 CD GLU A 48 -2.366 14.739 4.730 1.00 0.00 C ATOM 741 OE1 GLU A 48 -1.896 15.658 4.027 1.00 0.00 O ATOM 742 OE2 GLU A 48 -2.178 14.653 5.961 1.00 0.00 O ATOM 0 H GLU A 48 -4.733 14.696 0.164 1.00 0.00 H new ATOM 0 HA GLU A 48 -3.477 16.056 2.346 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -4.941 14.904 3.803 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -4.941 13.455 2.817 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -3.652 13.030 4.812 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -2.565 13.044 3.438 1.00 0.00 H new ATOM 749 N LEU A 49 -1.394 14.892 1.664 1.00 0.00 N ATOM 750 CA LEU A 49 -0.161 14.317 1.137 1.00 0.00 C ATOM 751 C LEU A 49 0.143 12.978 1.801 1.00 0.00 C ATOM 752 O LEU A 49 0.433 11.991 1.126 1.00 0.00 O ATOM 753 CB LEU A 49 1.007 15.281 1.351 1.00 0.00 C ATOM 754 CG LEU A 49 1.270 16.279 0.222 1.00 0.00 C ATOM 755 CD1 LEU A 49 -0.035 16.685 -0.445 1.00 0.00 C ATOM 756 CD2 LEU A 49 2.004 17.502 0.752 1.00 0.00 C ATOM 0 H LEU A 49 -1.258 15.712 2.255 1.00 0.00 H new ATOM 0 HA LEU A 49 -0.296 14.150 0.068 1.00 0.00 H new ATOM 0 HB2 LEU A 49 0.826 15.841 2.269 1.00 0.00 H new ATOM 0 HB3 LEU A 49 1.912 14.694 1.508 1.00 0.00 H new ATOM 0 HG LEU A 49 1.901 15.797 -0.525 1.00 0.00 H new ATOM 0 HD11 LEU A 49 0.171 17.395 -1.246 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -0.522 15.802 -0.859 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -0.691 17.149 0.291 1.00 0.00 H new ATOM 0 HD21 LEU A 49 2.183 18.201 -0.065 1.00 0.00 H new ATOM 0 HD22 LEU A 49 1.398 17.986 1.518 1.00 0.00 H new ATOM 0 HD23 LEU A 49 2.957 17.196 1.183 1.00 0.00 H new ATOM 768 N ASN A 50 0.071 12.951 3.128 1.00 0.00 N ATOM 769 CA ASN A 50 0.336 11.732 3.883 1.00 0.00 C ATOM 770 C ASN A 50 -0.956 11.150 4.448 1.00 0.00 C ATOM 771 O ASN A 50 -1.308 11.364 5.608 1.00 0.00 O ATOM 772 CB ASN A 50 1.320 12.016 5.020 1.00 0.00 C ATOM 773 CG ASN A 50 2.624 12.608 4.522 1.00 0.00 C ATOM 774 OD1 ASN A 50 3.688 12.005 4.666 1.00 0.00 O ATOM 775 ND2 ASN A 50 2.547 13.795 3.932 1.00 0.00 N ATOM 0 H ASN A 50 -0.169 13.759 3.702 1.00 0.00 H new ATOM 0 HA ASN A 50 0.776 11.002 3.204 1.00 0.00 H new ATOM 0 HB2 ASN A 50 0.861 12.703 5.731 1.00 0.00 H new ATOM 0 HB3 ASN A 50 1.526 11.091 5.558 1.00 0.00 H new ATOM 0 HD21 ASN A 50 3.391 14.243 3.576 1.00 0.00 H new ATOM 0 HD22 ASN A 50 1.644 14.258 3.834 1.00 0.00 H new ATOM 782 N PRO A 51 -1.681 10.394 3.609 1.00 0.00 N ATOM 783 CA PRO A 51 -2.945 9.764 4.002 1.00 0.00 C ATOM 784 C PRO A 51 -2.741 8.631 5.002 1.00 0.00 C ATOM 785 O PRO A 51 -1.628 8.136 5.177 1.00 0.00 O ATOM 786 CB PRO A 51 -3.495 9.219 2.682 1.00 0.00 C ATOM 787 CG PRO A 51 -2.293 9.016 1.825 1.00 0.00 C ATOM 788 CD PRO A 51 -1.321 10.096 2.212 1.00 0.00 C ATOM 0 HA PRO A 51 -3.613 10.466 4.500 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -4.035 8.284 2.834 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -4.193 9.920 2.225 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -1.862 8.028 1.985 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -2.551 9.084 0.768 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -0.289 9.757 2.127 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -1.422 10.975 1.575 1.00 0.00 H new ATOM 796 N VAL A 52 -3.824 8.225 5.658 1.00 0.00 N ATOM 797 CA VAL A 52 -3.764 7.149 6.640 1.00 0.00 C ATOM 798 C VAL A 52 -5.009 6.272 6.570 1.00 0.00 C ATOM 799 O VAL A 52 -6.099 6.691 6.957 1.00 0.00 O ATOM 800 CB VAL A 52 -3.620 7.703 8.070 1.00 0.00 C ATOM 801 CG1 VAL A 52 -3.782 6.588 9.093 1.00 0.00 C ATOM 802 CG2 VAL A 52 -2.279 8.401 8.238 1.00 0.00 C ATOM 0 H VAL A 52 -4.753 8.625 5.527 1.00 0.00 H new ATOM 0 HA VAL A 52 -2.886 6.549 6.400 1.00 0.00 H new ATOM 0 HB VAL A 52 -4.409 8.436 8.239 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -3.677 6.998 10.098 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -4.768 6.137 8.986 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -3.016 5.830 8.929 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -2.194 8.786 9.254 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -1.473 7.691 8.051 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -2.207 9.226 7.530 1.00 0.00 H new ATOM 812 N TRP A 53 -4.838 5.052 6.073 1.00 0.00 N ATOM 813 CA TRP A 53 -5.948 4.113 5.953 1.00 0.00 C ATOM 814 C TRP A 53 -5.977 3.150 7.134 1.00 0.00 C ATOM 815 O TRP A 53 -6.998 3.006 7.805 1.00 0.00 O ATOM 816 CB TRP A 53 -5.842 3.331 4.643 1.00 0.00 C ATOM 817 CG TRP A 53 -5.740 4.210 3.433 1.00 0.00 C ATOM 818 CD1 TRP A 53 -6.773 4.694 2.682 1.00 0.00 C ATOM 819 CD2 TRP A 53 -4.538 4.707 2.833 1.00 0.00 C ATOM 820 NE1 TRP A 53 -6.286 5.463 1.652 1.00 0.00 N ATOM 821 CE2 TRP A 53 -4.918 5.487 1.723 1.00 0.00 C ATOM 822 CE3 TRP A 53 -3.179 4.571 3.127 1.00 0.00 C ATOM 823 CZ2 TRP A 53 -3.987 6.125 0.909 1.00 0.00 C ATOM 824 CZ3 TRP A 53 -2.256 5.205 2.318 1.00 0.00 C ATOM 825 CH2 TRP A 53 -2.663 5.975 1.220 1.00 0.00 C ATOM 0 H TRP A 53 -3.942 4.690 5.747 1.00 0.00 H new ATOM 0 HA TRP A 53 -6.876 4.685 5.952 1.00 0.00 H new ATOM 0 HB2 TRP A 53 -4.968 2.681 4.686 1.00 0.00 H new ATOM 0 HB3 TRP A 53 -6.714 2.686 4.542 1.00 0.00 H new ATOM 0 HD1 TRP A 53 -7.819 4.501 2.870 1.00 0.00 H new ATOM 0 HE1 TRP A 53 -6.851 5.939 0.949 1.00 0.00 H new ATOM 0 HE3 TRP A 53 -2.856 3.981 3.972 1.00 0.00 H new ATOM 0 HZ2 TRP A 53 -4.299 6.718 0.062 1.00 0.00 H new ATOM 0 HZ3 TRP A 53 -1.203 5.106 2.535 1.00 0.00 H new ATOM 0 HH2 TRP A 53 -1.917 6.459 0.607 1.00 0.00 H new ATOM 836 N ASN A 54 -4.850 2.491 7.382 1.00 0.00 N ATOM 837 CA ASN A 54 -4.747 1.539 8.483 1.00 0.00 C ATOM 838 C ASN A 54 -5.812 0.454 8.365 1.00 0.00 C ATOM 839 O ASN A 54 -6.347 -0.016 9.369 1.00 0.00 O ATOM 840 CB ASN A 54 -4.886 2.263 9.824 1.00 0.00 C ATOM 841 CG ASN A 54 -3.891 3.397 9.975 1.00 0.00 C ATOM 842 OD1 ASN A 54 -4.216 4.456 10.512 1.00 0.00 O ATOM 843 ND2 ASN A 54 -2.669 3.179 9.501 1.00 0.00 N ATOM 0 H ASN A 54 -3.995 2.598 6.836 1.00 0.00 H new ATOM 0 HA ASN A 54 -3.766 1.067 8.432 1.00 0.00 H new ATOM 0 HB2 ASN A 54 -5.898 2.657 9.918 1.00 0.00 H new ATOM 0 HB3 ASN A 54 -4.745 1.549 10.635 1.00 0.00 H new ATOM 0 HD21 ASN A 54 -1.956 3.905 9.575 1.00 0.00 H new ATOM 0 HD22 ASN A 54 -2.444 2.286 9.063 1.00 0.00 H new ATOM 850 N GLU A 55 -6.115 0.060 7.132 1.00 0.00 N ATOM 851 CA GLU A 55 -7.117 -0.970 6.883 1.00 0.00 C ATOM 852 C GLU A 55 -6.454 -2.310 6.575 1.00 0.00 C ATOM 853 O GLU A 55 -5.237 -2.388 6.408 1.00 0.00 O ATOM 854 CB GLU A 55 -8.026 -0.559 5.723 1.00 0.00 C ATOM 855 CG GLU A 55 -7.489 -0.957 4.358 1.00 0.00 C ATOM 856 CD GLU A 55 -8.489 -0.715 3.245 1.00 0.00 C ATOM 857 OE1 GLU A 55 -9.608 -0.249 3.544 1.00 0.00 O ATOM 858 OE2 GLU A 55 -8.153 -0.992 2.074 1.00 0.00 O ATOM 0 H GLU A 55 -5.681 0.438 6.290 1.00 0.00 H new ATOM 0 HA GLU A 55 -7.719 -1.081 7.785 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -9.008 -1.011 5.864 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -8.166 0.522 5.748 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -6.578 -0.395 4.152 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -7.216 -2.012 4.373 1.00 0.00 H new ATOM 865 N ILE A 56 -7.264 -3.360 6.502 1.00 0.00 N ATOM 866 CA ILE A 56 -6.758 -4.696 6.214 1.00 0.00 C ATOM 867 C ILE A 56 -7.465 -5.304 5.008 1.00 0.00 C ATOM 868 O ILE A 56 -8.695 -5.322 4.939 1.00 0.00 O ATOM 869 CB ILE A 56 -6.928 -5.636 7.422 1.00 0.00 C ATOM 870 CG1 ILE A 56 -6.261 -5.035 8.661 1.00 0.00 C ATOM 871 CG2 ILE A 56 -6.346 -7.007 7.113 1.00 0.00 C ATOM 872 CD1 ILE A 56 -6.557 -5.795 9.936 1.00 0.00 C ATOM 0 H ILE A 56 -8.274 -3.312 6.638 1.00 0.00 H new ATOM 0 HA ILE A 56 -5.696 -4.589 5.994 1.00 0.00 H new ATOM 0 HB ILE A 56 -7.992 -5.753 7.626 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -5.182 -5.008 8.506 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -6.592 -4.003 8.777 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -6.474 -7.660 7.977 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -6.862 -7.436 6.254 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -5.284 -6.909 6.887 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -6.052 -5.313 10.773 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -7.632 -5.800 10.115 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -6.200 -6.820 9.839 1.00 0.00 H new ATOM 884 N LEU A 57 -6.681 -5.804 4.059 1.00 0.00 N ATOM 885 CA LEU A 57 -7.232 -6.415 2.855 1.00 0.00 C ATOM 886 C LEU A 57 -6.896 -7.902 2.796 1.00 0.00 C ATOM 887 O LEU A 57 -5.857 -8.333 3.296 1.00 0.00 O ATOM 888 CB LEU A 57 -6.695 -5.710 1.609 1.00 0.00 C ATOM 889 CG LEU A 57 -6.958 -4.206 1.522 1.00 0.00 C ATOM 890 CD1 LEU A 57 -5.869 -3.519 0.713 1.00 0.00 C ATOM 891 CD2 LEU A 57 -8.327 -3.938 0.914 1.00 0.00 C ATOM 0 H LEU A 57 -5.662 -5.798 4.100 1.00 0.00 H new ATOM 0 HA LEU A 57 -8.316 -6.307 2.887 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -5.619 -5.874 1.559 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -7.131 -6.186 0.731 1.00 0.00 H new ATOM 0 HG LEU A 57 -6.945 -3.796 2.532 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -6.073 -2.450 0.662 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -4.903 -3.682 1.191 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -5.849 -3.933 -0.295 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -8.497 -2.863 0.860 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -8.369 -4.363 -0.089 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -9.097 -4.396 1.535 1.00 0.00 H new ATOM 903 N GLU A 58 -7.781 -8.680 2.180 1.00 0.00 N ATOM 904 CA GLU A 58 -7.576 -10.118 2.056 1.00 0.00 C ATOM 905 C GLU A 58 -7.912 -10.596 0.646 1.00 0.00 C ATOM 906 O GLU A 58 -8.584 -9.898 -0.114 1.00 0.00 O ATOM 907 CB GLU A 58 -8.433 -10.869 3.077 1.00 0.00 C ATOM 908 CG GLU A 58 -8.589 -10.133 4.398 1.00 0.00 C ATOM 909 CD GLU A 58 -9.795 -9.215 4.416 1.00 0.00 C ATOM 910 OE1 GLU A 58 -9.662 -8.053 3.976 1.00 0.00 O ATOM 911 OE2 GLU A 58 -10.871 -9.657 4.869 1.00 0.00 O ATOM 0 H GLU A 58 -8.646 -8.339 1.760 1.00 0.00 H new ATOM 0 HA GLU A 58 -6.524 -10.326 2.252 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -9.420 -11.046 2.650 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -7.987 -11.846 3.265 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -8.678 -10.859 5.206 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -7.690 -9.549 4.592 1.00 0.00 H new ATOM 918 N PHE A 59 -7.439 -11.789 0.303 1.00 0.00 N ATOM 919 CA PHE A 59 -7.687 -12.360 -1.016 1.00 0.00 C ATOM 920 C PHE A 59 -7.852 -13.875 -0.930 1.00 0.00 C ATOM 921 O PHE A 59 -7.337 -14.515 -0.014 1.00 0.00 O ATOM 922 CB PHE A 59 -6.541 -12.014 -1.969 1.00 0.00 C ATOM 923 CG PHE A 59 -6.370 -10.538 -2.189 1.00 0.00 C ATOM 924 CD1 PHE A 59 -5.814 -9.737 -1.205 1.00 0.00 C ATOM 925 CD2 PHE A 59 -6.767 -9.951 -3.380 1.00 0.00 C ATOM 926 CE1 PHE A 59 -5.655 -8.378 -1.405 1.00 0.00 C ATOM 927 CE2 PHE A 59 -6.610 -8.594 -3.586 1.00 0.00 C ATOM 928 CZ PHE A 59 -6.054 -7.806 -2.596 1.00 0.00 C ATOM 0 H PHE A 59 -6.882 -12.380 0.920 1.00 0.00 H new ATOM 0 HA PHE A 59 -8.612 -11.932 -1.402 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -5.612 -12.424 -1.572 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -6.719 -12.498 -2.929 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -5.501 -10.179 -0.271 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -7.204 -10.562 -4.156 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -5.219 -7.765 -0.630 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -6.921 -8.149 -4.520 1.00 0.00 H new ATOM 0 HZ PHE A 59 -5.932 -6.745 -2.754 1.00 0.00 H new ATOM 938 N ASP A 60 -8.575 -14.440 -1.891 1.00 0.00 N ATOM 939 CA ASP A 60 -8.808 -15.879 -1.926 1.00 0.00 C ATOM 940 C ASP A 60 -7.940 -16.545 -2.990 1.00 0.00 C ATOM 941 O ASP A 60 -7.996 -16.186 -4.167 1.00 0.00 O ATOM 942 CB ASP A 60 -10.284 -16.171 -2.200 1.00 0.00 C ATOM 943 CG ASP A 60 -11.093 -16.309 -0.925 1.00 0.00 C ATOM 944 OD1 ASP A 60 -11.503 -15.270 -0.366 1.00 0.00 O ATOM 945 OD2 ASP A 60 -11.316 -17.457 -0.486 1.00 0.00 O ATOM 0 H ASP A 60 -9.010 -13.924 -2.656 1.00 0.00 H new ATOM 0 HA ASP A 60 -8.538 -16.289 -0.953 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -10.703 -15.369 -2.808 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -10.368 -17.089 -2.781 1.00 0.00 H new ATOM 950 N LEU A 61 -7.136 -17.514 -2.567 1.00 0.00 N ATOM 951 CA LEU A 61 -6.254 -18.230 -3.483 1.00 0.00 C ATOM 952 C LEU A 61 -6.919 -19.505 -3.993 1.00 0.00 C ATOM 953 O LEU A 61 -6.504 -20.070 -5.005 1.00 0.00 O ATOM 954 CB LEU A 61 -4.935 -18.572 -2.788 1.00 0.00 C ATOM 955 CG LEU A 61 -4.264 -17.431 -2.022 1.00 0.00 C ATOM 956 CD1 LEU A 61 -3.140 -17.964 -1.147 1.00 0.00 C ATOM 957 CD2 LEU A 61 -3.739 -16.378 -2.987 1.00 0.00 C ATOM 0 H LEU A 61 -7.076 -17.822 -1.596 1.00 0.00 H new ATOM 0 HA LEU A 61 -6.051 -17.582 -4.336 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -5.116 -19.392 -2.093 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -4.236 -18.939 -3.540 1.00 0.00 H new ATOM 0 HG LEU A 61 -5.008 -16.964 -1.377 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -2.674 -17.138 -0.610 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -3.544 -18.680 -0.432 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -2.395 -18.456 -1.772 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -3.265 -15.574 -2.425 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -3.009 -16.831 -3.658 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -4.567 -15.974 -3.570 1.00 0.00 H new ATOM 969 N ARG A 62 -7.953 -19.951 -3.288 1.00 0.00 N ATOM 970 CA ARG A 62 -8.675 -21.158 -3.670 1.00 0.00 C ATOM 971 C ARG A 62 -7.763 -22.380 -3.610 1.00 0.00 C ATOM 972 O ARG A 62 -7.787 -23.230 -4.499 1.00 0.00 O ATOM 973 CB ARG A 62 -9.252 -21.008 -5.079 1.00 0.00 C ATOM 974 CG ARG A 62 -10.270 -19.887 -5.204 1.00 0.00 C ATOM 975 CD ARG A 62 -11.627 -20.303 -4.657 1.00 0.00 C ATOM 976 NE ARG A 62 -12.416 -21.033 -5.646 1.00 0.00 N ATOM 977 CZ ARG A 62 -13.173 -20.441 -6.563 1.00 0.00 C ATOM 978 NH1 ARG A 62 -13.243 -19.118 -6.617 1.00 0.00 N ATOM 979 NH2 ARG A 62 -13.862 -21.173 -7.429 1.00 0.00 N ATOM 0 H ARG A 62 -8.310 -19.494 -2.449 1.00 0.00 H new ATOM 0 HA ARG A 62 -9.492 -21.301 -2.963 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -8.436 -20.826 -5.779 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -9.721 -21.947 -5.372 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -9.913 -19.009 -4.666 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -10.371 -19.601 -6.251 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -11.486 -20.926 -3.774 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -12.176 -19.417 -4.338 1.00 0.00 H new ATOM 0 HE ARG A 62 -12.384 -22.052 -5.632 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -12.715 -18.552 -5.953 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -13.825 -18.666 -7.322 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -13.811 -22.191 -7.391 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -14.443 -20.718 -8.133 1.00 0.00 H new ATOM 993 N GLY A 63 -6.958 -22.459 -2.554 1.00 0.00 N ATOM 994 CA GLY A 63 -6.049 -23.580 -2.398 1.00 0.00 C ATOM 995 C GLY A 63 -4.799 -23.435 -3.243 1.00 0.00 C ATOM 996 O GLY A 63 -3.847 -24.201 -3.091 1.00 0.00 O ATOM 0 H GLY A 63 -6.919 -21.768 -1.805 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -5.766 -23.671 -1.349 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -6.563 -24.501 -2.671 1.00 0.00 H new ATOM 1000 N ILE A 64 -4.803 -22.452 -4.138 1.00 0.00 N ATOM 1001 CA ILE A 64 -3.661 -22.211 -5.011 1.00 0.00 C ATOM 1002 C ILE A 64 -2.522 -21.538 -4.254 1.00 0.00 C ATOM 1003 O ILE A 64 -2.627 -20.393 -3.814 1.00 0.00 O ATOM 1004 CB ILE A 64 -4.050 -21.334 -6.216 1.00 0.00 C ATOM 1005 CG1 ILE A 64 -5.219 -21.964 -6.977 1.00 0.00 C ATOM 1006 CG2 ILE A 64 -2.854 -21.140 -7.137 1.00 0.00 C ATOM 1007 CD1 ILE A 64 -4.803 -23.086 -7.902 1.00 0.00 C ATOM 0 H ILE A 64 -5.584 -21.810 -4.277 1.00 0.00 H new ATOM 0 HA ILE A 64 -3.329 -23.184 -5.372 1.00 0.00 H new ATOM 0 HB ILE A 64 -4.364 -20.357 -5.850 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -5.945 -22.346 -6.260 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -5.722 -21.192 -7.559 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -3.144 -20.518 -7.984 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -2.048 -20.653 -6.589 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -2.512 -22.110 -7.499 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -5.682 -23.485 -8.408 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -4.100 -22.705 -8.643 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -4.327 -23.877 -7.323 1.00 0.00 H new ATOM 1019 N PRO A 65 -1.405 -22.264 -4.097 1.00 0.00 N ATOM 1020 CA PRO A 65 -0.223 -21.757 -3.394 1.00 0.00 C ATOM 1021 C PRO A 65 0.486 -20.654 -4.174 1.00 0.00 C ATOM 1022 O PRO A 65 0.145 -20.376 -5.324 1.00 0.00 O ATOM 1023 CB PRO A 65 0.676 -22.990 -3.275 1.00 0.00 C ATOM 1024 CG PRO A 65 0.263 -23.870 -4.405 1.00 0.00 C ATOM 1025 CD PRO A 65 -1.210 -23.636 -4.595 1.00 0.00 C ATOM 0 HA PRO A 65 -0.481 -21.307 -2.435 1.00 0.00 H new ATOM 0 HB2 PRO A 65 1.730 -22.720 -3.348 1.00 0.00 H new ATOM 0 HB3 PRO A 65 0.540 -23.488 -2.315 1.00 0.00 H new ATOM 0 HG2 PRO A 65 0.817 -23.627 -5.312 1.00 0.00 H new ATOM 0 HG3 PRO A 65 0.466 -24.917 -4.179 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -1.500 -23.728 -5.642 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -1.807 -24.356 -4.034 1.00 0.00 H new ATOM 1033 N LEU A 66 1.473 -20.030 -3.541 1.00 0.00 N ATOM 1034 CA LEU A 66 2.231 -18.958 -4.176 1.00 0.00 C ATOM 1035 C LEU A 66 3.452 -19.511 -4.904 1.00 0.00 C ATOM 1036 O LEU A 66 3.984 -20.559 -4.537 1.00 0.00 O ATOM 1037 CB LEU A 66 2.669 -17.929 -3.132 1.00 0.00 C ATOM 1038 CG LEU A 66 1.655 -16.832 -2.804 1.00 0.00 C ATOM 1039 CD1 LEU A 66 2.241 -15.843 -1.808 1.00 0.00 C ATOM 1040 CD2 LEU A 66 1.214 -16.117 -4.072 1.00 0.00 C ATOM 0 H LEU A 66 1.767 -20.248 -2.589 1.00 0.00 H new ATOM 0 HA LEU A 66 1.584 -18.473 -4.907 1.00 0.00 H new ATOM 0 HB2 LEU A 66 2.913 -18.457 -2.210 1.00 0.00 H new ATOM 0 HB3 LEU A 66 3.587 -17.455 -3.481 1.00 0.00 H new ATOM 0 HG LEU A 66 0.780 -17.297 -2.350 1.00 0.00 H new ATOM 0 HD11 LEU A 66 1.505 -15.070 -1.587 1.00 0.00 H new ATOM 0 HD12 LEU A 66 2.505 -16.366 -0.889 1.00 0.00 H new ATOM 0 HD13 LEU A 66 3.133 -15.383 -2.234 1.00 0.00 H new ATOM 0 HD21 LEU A 66 0.493 -15.340 -3.819 1.00 0.00 H new ATOM 0 HD22 LEU A 66 2.080 -15.665 -4.555 1.00 0.00 H new ATOM 0 HD23 LEU A 66 0.753 -16.833 -4.752 1.00 0.00 H new ATOM 1052 N ASP A 67 3.892 -18.799 -5.935 1.00 0.00 N ATOM 1053 CA ASP A 67 5.052 -19.216 -6.713 1.00 0.00 C ATOM 1054 C ASP A 67 6.059 -18.077 -6.842 1.00 0.00 C ATOM 1055 O ASP A 67 5.776 -16.939 -6.467 1.00 0.00 O ATOM 1056 CB ASP A 67 4.619 -19.690 -8.102 1.00 0.00 C ATOM 1057 CG ASP A 67 5.719 -20.440 -8.827 1.00 0.00 C ATOM 1058 OD1 ASP A 67 5.936 -21.628 -8.509 1.00 0.00 O ATOM 1059 OD2 ASP A 67 6.361 -19.839 -9.713 1.00 0.00 O ATOM 0 H ASP A 67 3.463 -17.930 -6.252 1.00 0.00 H new ATOM 0 HA ASP A 67 5.531 -20.043 -6.189 1.00 0.00 H new ATOM 0 HB2 ASP A 67 3.745 -20.335 -8.007 1.00 0.00 H new ATOM 0 HB3 ASP A 67 4.316 -18.829 -8.698 1.00 0.00 H new ATOM 1064 N PHE A 68 7.235 -18.391 -7.374 1.00 0.00 N ATOM 1065 CA PHE A 68 8.285 -17.394 -7.551 1.00 0.00 C ATOM 1066 C PHE A 68 7.915 -16.404 -8.651 1.00 0.00 C ATOM 1067 O PHE A 68 8.666 -15.472 -8.941 1.00 0.00 O ATOM 1068 CB PHE A 68 9.613 -18.075 -7.887 1.00 0.00 C ATOM 1069 CG PHE A 68 10.220 -18.811 -6.727 1.00 0.00 C ATOM 1070 CD1 PHE A 68 9.740 -20.055 -6.351 1.00 0.00 C ATOM 1071 CD2 PHE A 68 11.272 -18.260 -6.014 1.00 0.00 C ATOM 1072 CE1 PHE A 68 10.296 -20.734 -5.283 1.00 0.00 C ATOM 1073 CE2 PHE A 68 11.833 -18.934 -4.945 1.00 0.00 C ATOM 1074 CZ PHE A 68 11.345 -20.173 -4.580 1.00 0.00 C ATOM 0 H PHE A 68 7.485 -19.328 -7.690 1.00 0.00 H new ATOM 0 HA PHE A 68 8.393 -16.846 -6.615 1.00 0.00 H new ATOM 0 HB2 PHE A 68 9.456 -18.774 -8.708 1.00 0.00 H new ATOM 0 HB3 PHE A 68 10.319 -17.323 -8.239 1.00 0.00 H new ATOM 0 HD1 PHE A 68 8.922 -20.499 -6.899 1.00 0.00 H new ATOM 0 HD2 PHE A 68 11.659 -17.292 -6.297 1.00 0.00 H new ATOM 0 HE1 PHE A 68 9.911 -21.702 -4.998 1.00 0.00 H new ATOM 0 HE2 PHE A 68 12.652 -18.492 -4.396 1.00 0.00 H new ATOM 0 HZ PHE A 68 11.782 -20.703 -3.747 1.00 0.00 H new ATOM 1084 N SER A 69 6.753 -16.613 -9.261 1.00 0.00 N ATOM 1085 CA SER A 69 6.285 -15.742 -10.333 1.00 0.00 C ATOM 1086 C SER A 69 5.110 -14.889 -9.865 1.00 0.00 C ATOM 1087 O SER A 69 4.609 -14.042 -10.605 1.00 0.00 O ATOM 1088 CB SER A 69 5.874 -16.572 -11.550 1.00 0.00 C ATOM 1089 OG SER A 69 6.993 -16.864 -12.370 1.00 0.00 O ATOM 0 H SER A 69 6.118 -17.378 -9.031 1.00 0.00 H new ATOM 0 HA SER A 69 7.104 -15.080 -10.614 1.00 0.00 H new ATOM 0 HB2 SER A 69 5.409 -17.501 -11.220 1.00 0.00 H new ATOM 0 HB3 SER A 69 5.127 -16.029 -12.129 1.00 0.00 H new ATOM 0 HG SER A 69 6.704 -17.397 -13.140 1.00 0.00 H new ATOM 1095 N SER A 70 4.675 -15.118 -8.630 1.00 0.00 N ATOM 1096 CA SER A 70 3.556 -14.374 -8.063 1.00 0.00 C ATOM 1097 C SER A 70 4.038 -13.079 -7.416 1.00 0.00 C ATOM 1098 O SER A 70 4.921 -13.092 -6.559 1.00 0.00 O ATOM 1099 CB SER A 70 2.818 -15.229 -7.032 1.00 0.00 C ATOM 1100 OG SER A 70 2.350 -16.436 -7.610 1.00 0.00 O ATOM 0 H SER A 70 5.080 -15.813 -8.003 1.00 0.00 H new ATOM 0 HA SER A 70 2.871 -14.122 -8.873 1.00 0.00 H new ATOM 0 HB2 SER A 70 3.484 -15.455 -6.199 1.00 0.00 H new ATOM 0 HB3 SER A 70 1.977 -14.668 -6.624 1.00 0.00 H new ATOM 0 HG SER A 70 1.751 -16.889 -6.981 1.00 0.00 H new ATOM 1106 N SER A 71 3.449 -11.962 -7.833 1.00 0.00 N ATOM 1107 CA SER A 71 3.820 -10.658 -7.297 1.00 0.00 C ATOM 1108 C SER A 71 2.586 -9.785 -7.090 1.00 0.00 C ATOM 1109 O SER A 71 1.516 -10.062 -7.635 1.00 0.00 O ATOM 1110 CB SER A 71 4.802 -9.957 -8.238 1.00 0.00 C ATOM 1111 OG SER A 71 4.288 -9.895 -9.557 1.00 0.00 O ATOM 0 H SER A 71 2.714 -11.934 -8.540 1.00 0.00 H new ATOM 0 HA SER A 71 4.301 -10.813 -6.331 1.00 0.00 H new ATOM 0 HB2 SER A 71 5.002 -8.949 -7.875 1.00 0.00 H new ATOM 0 HB3 SER A 71 5.753 -10.490 -8.239 1.00 0.00 H new ATOM 0 HG SER A 71 4.933 -9.441 -10.139 1.00 0.00 H new ATOM 1117 N LEU A 72 2.742 -8.729 -6.299 1.00 0.00 N ATOM 1118 CA LEU A 72 1.641 -7.814 -6.019 1.00 0.00 C ATOM 1119 C LEU A 72 1.865 -6.468 -6.700 1.00 0.00 C ATOM 1120 O LEU A 72 2.982 -5.953 -6.728 1.00 0.00 O ATOM 1121 CB LEU A 72 1.488 -7.616 -4.510 1.00 0.00 C ATOM 1122 CG LEU A 72 0.178 -6.979 -4.046 1.00 0.00 C ATOM 1123 CD1 LEU A 72 -0.953 -7.995 -4.083 1.00 0.00 C ATOM 1124 CD2 LEU A 72 0.332 -6.401 -2.646 1.00 0.00 C ATOM 0 H LEU A 72 3.620 -8.485 -5.840 1.00 0.00 H new ATOM 0 HA LEU A 72 0.726 -8.253 -6.416 1.00 0.00 H new ATOM 0 HB2 LEU A 72 1.589 -8.587 -4.024 1.00 0.00 H new ATOM 0 HB3 LEU A 72 2.314 -6.997 -4.159 1.00 0.00 H new ATOM 0 HG LEU A 72 -0.069 -6.166 -4.728 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -1.877 -7.523 -3.749 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -1.080 -8.361 -5.102 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -0.714 -8.830 -3.424 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -0.610 -5.952 -2.332 1.00 0.00 H new ATOM 0 HD22 LEU A 72 0.604 -7.196 -1.952 1.00 0.00 H new ATOM 0 HD23 LEU A 72 1.113 -5.641 -2.650 1.00 0.00 H new ATOM 1136 N GLY A 73 0.794 -5.901 -7.246 1.00 0.00 N ATOM 1137 CA GLY A 73 0.894 -4.618 -7.917 1.00 0.00 C ATOM 1138 C GLY A 73 0.239 -3.499 -7.132 1.00 0.00 C ATOM 1139 O GLY A 73 -0.987 -3.414 -7.066 1.00 0.00 O ATOM 0 H GLY A 73 -0.142 -6.307 -7.236 1.00 0.00 H new ATOM 0 HA2 GLY A 73 1.945 -4.377 -8.079 1.00 0.00 H new ATOM 0 HA3 GLY A 73 0.428 -4.689 -8.900 1.00 0.00 H new ATOM 1143 N ILE A 74 1.058 -2.641 -6.533 1.00 0.00 N ATOM 1144 CA ILE A 74 0.550 -1.523 -5.748 1.00 0.00 C ATOM 1145 C ILE A 74 0.589 -0.226 -6.549 1.00 0.00 C ATOM 1146 O ILE A 74 1.658 0.341 -6.780 1.00 0.00 O ATOM 1147 CB ILE A 74 1.357 -1.335 -4.449 1.00 0.00 C ATOM 1148 CG1 ILE A 74 1.262 -2.590 -3.578 1.00 0.00 C ATOM 1149 CG2 ILE A 74 0.858 -0.116 -3.688 1.00 0.00 C ATOM 1150 CD1 ILE A 74 -0.158 -2.968 -3.216 1.00 0.00 C ATOM 0 H ILE A 74 2.075 -2.699 -6.576 1.00 0.00 H new ATOM 0 HA ILE A 74 -0.483 -1.759 -5.494 1.00 0.00 H new ATOM 0 HB ILE A 74 2.403 -1.174 -4.708 1.00 0.00 H new ATOM 0 HG12 ILE A 74 1.729 -3.423 -4.103 1.00 0.00 H new ATOM 0 HG13 ILE A 74 1.832 -2.431 -2.662 1.00 0.00 H new ATOM 0 HG21 ILE A 74 1.438 0.004 -2.773 1.00 0.00 H new ATOM 0 HG22 ILE A 74 0.972 0.773 -4.309 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -0.194 -0.250 -3.436 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -0.149 -3.866 -2.598 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -0.622 -2.152 -2.663 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -0.727 -3.159 -4.126 1.00 0.00 H new ATOM 1162 N ILE A 75 -0.583 0.239 -6.969 1.00 0.00 N ATOM 1163 CA ILE A 75 -0.683 1.471 -7.741 1.00 0.00 C ATOM 1164 C ILE A 75 -1.412 2.555 -6.955 1.00 0.00 C ATOM 1165 O ILE A 75 -2.451 2.303 -6.345 1.00 0.00 O ATOM 1166 CB ILE A 75 -1.415 1.241 -9.076 1.00 0.00 C ATOM 1167 CG1 ILE A 75 -1.021 -0.112 -9.672 1.00 0.00 C ATOM 1168 CG2 ILE A 75 -1.105 2.366 -10.052 1.00 0.00 C ATOM 1169 CD1 ILE A 75 -1.979 -0.607 -10.733 1.00 0.00 C ATOM 0 H ILE A 75 -1.476 -0.219 -6.788 1.00 0.00 H new ATOM 0 HA ILE A 75 0.336 1.798 -7.946 1.00 0.00 H new ATOM 0 HB ILE A 75 -2.489 1.236 -8.888 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -0.023 -0.033 -10.103 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -0.965 -0.850 -8.872 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -1.630 2.188 -10.991 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -1.431 3.316 -9.628 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -0.032 2.401 -10.238 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -1.637 -1.571 -11.111 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -2.974 -0.718 -10.302 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -2.017 0.111 -11.552 1.00 0.00 H new ATOM 1181 N VAL A 76 -0.861 3.765 -6.974 1.00 0.00 N ATOM 1182 CA VAL A 76 -1.460 4.890 -6.266 1.00 0.00 C ATOM 1183 C VAL A 76 -1.878 5.990 -7.235 1.00 0.00 C ATOM 1184 O VAL A 76 -1.043 6.581 -7.919 1.00 0.00 O ATOM 1185 CB VAL A 76 -0.489 5.479 -5.225 1.00 0.00 C ATOM 1186 CG1 VAL A 76 -1.095 6.708 -4.566 1.00 0.00 C ATOM 1187 CG2 VAL A 76 -0.123 4.431 -4.185 1.00 0.00 C ATOM 0 H VAL A 76 -0.000 3.991 -7.472 1.00 0.00 H new ATOM 0 HA VAL A 76 -2.343 4.508 -5.753 1.00 0.00 H new ATOM 0 HB VAL A 76 0.424 5.784 -5.736 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -0.395 7.111 -3.834 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -1.301 7.463 -5.324 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -2.024 6.432 -4.067 1.00 0.00 H new ATOM 0 HG21 VAL A 76 0.564 4.864 -3.458 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -1.026 4.093 -3.676 1.00 0.00 H new ATOM 0 HG23 VAL A 76 0.356 3.583 -4.675 1.00 0.00 H new ATOM 1197 N LYS A 77 -3.178 6.261 -7.288 1.00 0.00 N ATOM 1198 CA LYS A 77 -3.709 7.292 -8.171 1.00 0.00 C ATOM 1199 C LYS A 77 -4.559 8.291 -7.393 1.00 0.00 C ATOM 1200 O LYS A 77 -4.708 8.178 -6.176 1.00 0.00 O ATOM 1201 CB LYS A 77 -4.543 6.657 -9.286 1.00 0.00 C ATOM 1202 CG LYS A 77 -3.727 6.253 -10.502 1.00 0.00 C ATOM 1203 CD LYS A 77 -4.578 6.226 -11.760 1.00 0.00 C ATOM 1204 CE LYS A 77 -5.211 4.860 -11.975 1.00 0.00 C ATOM 1205 NZ LYS A 77 -6.146 4.858 -13.135 1.00 0.00 N ATOM 0 H LYS A 77 -3.883 5.780 -6.729 1.00 0.00 H new ATOM 0 HA LYS A 77 -2.867 7.825 -8.613 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -5.052 5.777 -8.892 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -5.316 7.360 -9.595 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -2.901 6.951 -10.635 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -3.289 5.269 -10.337 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -5.359 6.983 -11.689 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -3.963 6.483 -12.622 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -4.429 4.119 -12.138 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -5.749 4.563 -11.075 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -6.557 3.909 -13.248 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -6.907 5.547 -12.969 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -5.628 5.116 -13.999 1.00 0.00 H new ATOM 1219 N ASP A 78 -5.114 9.268 -8.102 1.00 0.00 N ATOM 1220 CA ASP A 78 -5.951 10.286 -7.477 1.00 0.00 C ATOM 1221 C ASP A 78 -7.419 10.077 -7.835 1.00 0.00 C ATOM 1222 O ASP A 78 -7.802 10.157 -9.002 1.00 0.00 O ATOM 1223 CB ASP A 78 -5.502 11.682 -7.909 1.00 0.00 C ATOM 1224 CG ASP A 78 -4.264 12.147 -7.168 1.00 0.00 C ATOM 1225 OD1 ASP A 78 -4.029 11.662 -6.041 1.00 0.00 O ATOM 1226 OD2 ASP A 78 -3.529 12.997 -7.715 1.00 0.00 O ATOM 0 H ASP A 78 -4.999 9.377 -9.110 1.00 0.00 H new ATOM 0 HA ASP A 78 -5.843 10.197 -6.396 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -5.302 11.681 -8.980 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -6.312 12.391 -7.737 1.00 0.00 H new ATOM 1231 N PHE A 79 -8.237 9.806 -6.823 1.00 0.00 N ATOM 1232 CA PHE A 79 -9.663 9.584 -7.031 1.00 0.00 C ATOM 1233 C PHE A 79 -10.290 10.747 -7.794 1.00 0.00 C ATOM 1234 O PHE A 79 -11.217 10.558 -8.580 1.00 0.00 O ATOM 1235 CB PHE A 79 -10.373 9.398 -5.689 1.00 0.00 C ATOM 1236 CG PHE A 79 -11.683 8.671 -5.799 1.00 0.00 C ATOM 1237 CD1 PHE A 79 -12.827 9.336 -6.209 1.00 0.00 C ATOM 1238 CD2 PHE A 79 -11.770 7.323 -5.491 1.00 0.00 C ATOM 1239 CE1 PHE A 79 -14.034 8.670 -6.312 1.00 0.00 C ATOM 1240 CE2 PHE A 79 -12.974 6.652 -5.592 1.00 0.00 C ATOM 1241 CZ PHE A 79 -14.108 7.327 -6.002 1.00 0.00 C ATOM 0 H PHE A 79 -7.937 9.735 -5.851 1.00 0.00 H new ATOM 0 HA PHE A 79 -9.781 8.678 -7.625 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -9.717 8.849 -5.013 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -10.546 10.376 -5.240 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -12.775 10.387 -6.451 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -10.887 6.791 -5.168 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -14.918 9.200 -6.635 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -13.029 5.601 -5.351 1.00 0.00 H new ATOM 0 HZ PHE A 79 -15.050 6.805 -6.080 1.00 0.00 H new ATOM 1378 N ILE A 88 0.710 8.754 -10.085 1.00 0.00 N ATOM 1379 CA ILE A 88 1.437 9.261 -8.927 1.00 0.00 C ATOM 1380 C ILE A 88 2.653 8.394 -8.619 1.00 0.00 C ATOM 1381 O ILE A 88 3.764 8.898 -8.461 1.00 0.00 O ATOM 1382 CB ILE A 88 0.536 9.323 -7.680 1.00 0.00 C ATOM 1383 CG1 ILE A 88 -0.706 10.171 -7.963 1.00 0.00 C ATOM 1384 CG2 ILE A 88 1.309 9.883 -6.496 1.00 0.00 C ATOM 1385 CD1 ILE A 88 -1.612 10.334 -6.763 1.00 0.00 C ATOM 0 HA ILE A 88 1.767 10.269 -9.178 1.00 0.00 H new ATOM 0 HB ILE A 88 0.213 8.312 -7.432 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -0.392 11.156 -8.308 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -1.271 9.714 -8.775 1.00 0.00 H new ATOM 0 HG21 ILE A 88 0.659 9.921 -5.622 1.00 0.00 H new ATOM 0 HG22 ILE A 88 2.165 9.242 -6.284 1.00 0.00 H new ATOM 0 HG23 ILE A 88 1.658 10.888 -6.732 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -2.471 10.946 -7.036 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -1.955 9.354 -6.430 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -1.063 10.819 -5.956 1.00 0.00 H new ATOM 1397 N GLY A 89 2.435 7.085 -8.538 1.00 0.00 N ATOM 1398 CA GLY A 89 3.522 6.168 -8.251 1.00 0.00 C ATOM 1399 C GLY A 89 3.053 4.732 -8.126 1.00 0.00 C ATOM 1400 O GLY A 89 1.959 4.469 -7.624 1.00 0.00 O ATOM 0 H GLY A 89 1.525 6.643 -8.666 1.00 0.00 H new ATOM 0 HA2 GLY A 89 4.268 6.235 -9.043 1.00 0.00 H new ATOM 0 HA3 GLY A 89 4.012 6.469 -7.325 1.00 0.00 H new ATOM 1404 N THR A 90 3.880 3.798 -8.584 1.00 0.00 N ATOM 1405 CA THR A 90 3.543 2.381 -8.524 1.00 0.00 C ATOM 1406 C THR A 90 4.710 1.560 -7.989 1.00 0.00 C ATOM 1407 O THR A 90 5.871 1.863 -8.262 1.00 0.00 O ATOM 1408 CB THR A 90 3.141 1.840 -9.909 1.00 0.00 C ATOM 1409 OG1 THR A 90 4.288 1.785 -10.765 1.00 0.00 O ATOM 1410 CG2 THR A 90 2.070 2.716 -10.542 1.00 0.00 C ATOM 0 H THR A 90 4.789 3.997 -9.001 1.00 0.00 H new ATOM 0 HA THR A 90 2.695 2.287 -7.845 1.00 0.00 H new ATOM 0 HB THR A 90 2.737 0.836 -9.780 1.00 0.00 H new ATOM 0 HG1 THR A 90 4.713 2.667 -10.800 1.00 0.00 H new ATOM 0 HG21 THR A 90 1.802 2.314 -11.519 1.00 0.00 H new ATOM 0 HG22 THR A 90 1.188 2.732 -9.902 1.00 0.00 H new ATOM 0 HG23 THR A 90 2.452 3.730 -10.659 1.00 0.00 H new ATOM 1418 N ALA A 91 4.395 0.519 -7.226 1.00 0.00 N ATOM 1419 CA ALA A 91 5.419 -0.348 -6.655 1.00 0.00 C ATOM 1420 C ALA A 91 4.996 -1.812 -6.718 1.00 0.00 C ATOM 1421 O ALA A 91 3.837 -2.146 -6.469 1.00 0.00 O ATOM 1422 CB ALA A 91 5.712 0.057 -5.218 1.00 0.00 C ATOM 0 H ALA A 91 3.439 0.255 -6.989 1.00 0.00 H new ATOM 0 HA ALA A 91 6.328 -0.234 -7.246 1.00 0.00 H new ATOM 0 HB1 ALA A 91 6.478 -0.599 -4.804 1.00 0.00 H new ATOM 0 HB2 ALA A 91 6.066 1.088 -5.195 1.00 0.00 H new ATOM 0 HB3 ALA A 91 4.802 -0.028 -4.623 1.00 0.00 H new ATOM 1428 N THR A 92 5.943 -2.682 -7.054 1.00 0.00 N ATOM 1429 CA THR A 92 5.669 -4.110 -7.152 1.00 0.00 C ATOM 1430 C THR A 92 6.374 -4.883 -6.043 1.00 0.00 C ATOM 1431 O THR A 92 7.559 -4.673 -5.784 1.00 0.00 O ATOM 1432 CB THR A 92 6.110 -4.674 -8.516 1.00 0.00 C ATOM 1433 OG1 THR A 92 5.460 -3.961 -9.574 1.00 0.00 O ATOM 1434 CG2 THR A 92 5.781 -6.156 -8.620 1.00 0.00 C ATOM 0 H THR A 92 6.907 -2.422 -7.263 1.00 0.00 H new ATOM 0 HA THR A 92 4.591 -4.233 -7.048 1.00 0.00 H new ATOM 0 HB THR A 92 7.189 -4.550 -8.604 1.00 0.00 H new ATOM 0 HG1 THR A 92 5.747 -4.324 -10.438 1.00 0.00 H new ATOM 0 HG21 THR A 92 6.101 -6.533 -9.591 1.00 0.00 H new ATOM 0 HG22 THR A 92 6.300 -6.700 -7.831 1.00 0.00 H new ATOM 0 HG23 THR A 92 4.706 -6.298 -8.512 1.00 0.00 H new ATOM 1442 N VAL A 93 5.639 -5.778 -5.392 1.00 0.00 N ATOM 1443 CA VAL A 93 6.195 -6.585 -4.312 1.00 0.00 C ATOM 1444 C VAL A 93 6.217 -8.062 -4.685 1.00 0.00 C ATOM 1445 O VAL A 93 5.174 -8.709 -4.765 1.00 0.00 O ATOM 1446 CB VAL A 93 5.392 -6.407 -3.009 1.00 0.00 C ATOM 1447 CG1 VAL A 93 6.097 -7.096 -1.850 1.00 0.00 C ATOM 1448 CG2 VAL A 93 5.178 -4.931 -2.713 1.00 0.00 C ATOM 0 H VAL A 93 4.656 -5.963 -5.593 1.00 0.00 H new ATOM 0 HA VAL A 93 7.216 -6.239 -4.151 1.00 0.00 H new ATOM 0 HB VAL A 93 4.415 -6.873 -3.137 1.00 0.00 H new ATOM 0 HG11 VAL A 93 5.516 -6.960 -0.938 1.00 0.00 H new ATOM 0 HG12 VAL A 93 6.193 -8.161 -2.064 1.00 0.00 H new ATOM 0 HG13 VAL A 93 7.088 -6.662 -1.717 1.00 0.00 H new ATOM 0 HG21 VAL A 93 4.609 -4.824 -1.789 1.00 0.00 H new ATOM 0 HG22 VAL A 93 6.144 -4.438 -2.604 1.00 0.00 H new ATOM 0 HG23 VAL A 93 4.627 -4.471 -3.534 1.00 0.00 H new ATOM 1458 N ALA A 94 7.415 -8.591 -4.912 1.00 0.00 N ATOM 1459 CA ALA A 94 7.575 -9.994 -5.274 1.00 0.00 C ATOM 1460 C ALA A 94 7.278 -10.905 -4.088 1.00 0.00 C ATOM 1461 O ALA A 94 7.984 -10.877 -3.079 1.00 0.00 O ATOM 1462 CB ALA A 94 8.981 -10.248 -5.797 1.00 0.00 C ATOM 0 H ALA A 94 8.289 -8.069 -4.852 1.00 0.00 H new ATOM 0 HA ALA A 94 6.859 -10.223 -6.063 1.00 0.00 H new ATOM 0 HB1 ALA A 94 9.086 -11.300 -6.063 1.00 0.00 H new ATOM 0 HB2 ALA A 94 9.158 -9.631 -6.678 1.00 0.00 H new ATOM 0 HB3 ALA A 94 9.708 -9.995 -5.025 1.00 0.00 H new ATOM 1468 N LEU A 95 6.229 -11.710 -4.214 1.00 0.00 N ATOM 1469 CA LEU A 95 5.838 -12.630 -3.151 1.00 0.00 C ATOM 1470 C LEU A 95 6.696 -13.890 -3.178 1.00 0.00 C ATOM 1471 O LEU A 95 6.436 -14.847 -2.449 1.00 0.00 O ATOM 1472 CB LEU A 95 4.361 -13.001 -3.289 1.00 0.00 C ATOM 1473 CG LEU A 95 3.404 -11.847 -3.590 1.00 0.00 C ATOM 1474 CD1 LEU A 95 1.994 -12.369 -3.818 1.00 0.00 C ATOM 1475 CD2 LEU A 95 3.422 -10.830 -2.459 1.00 0.00 C ATOM 0 H LEU A 95 5.634 -11.745 -5.042 1.00 0.00 H new ATOM 0 HA LEU A 95 5.992 -12.129 -2.195 1.00 0.00 H new ATOM 0 HB2 LEU A 95 4.266 -13.742 -4.083 1.00 0.00 H new ATOM 0 HB3 LEU A 95 4.040 -13.481 -2.365 1.00 0.00 H new ATOM 0 HG LEU A 95 3.738 -11.352 -4.502 1.00 0.00 H new ATOM 0 HD11 LEU A 95 1.327 -11.534 -4.031 1.00 0.00 H new ATOM 0 HD12 LEU A 95 1.993 -13.058 -4.662 1.00 0.00 H new ATOM 0 HD13 LEU A 95 1.650 -12.890 -2.924 1.00 0.00 H new ATOM 0 HD21 LEU A 95 2.735 -10.016 -2.691 1.00 0.00 H new ATOM 0 HD22 LEU A 95 3.114 -11.312 -1.531 1.00 0.00 H new ATOM 0 HD23 LEU A 95 4.430 -10.432 -2.343 1.00 0.00 H new ATOM 1487 N LYS A 96 7.721 -13.884 -4.024 1.00 0.00 N ATOM 1488 CA LYS A 96 8.621 -15.025 -4.145 1.00 0.00 C ATOM 1489 C LYS A 96 9.400 -15.243 -2.852 1.00 0.00 C ATOM 1490 O LYS A 96 10.002 -16.298 -2.649 1.00 0.00 O ATOM 1491 CB LYS A 96 9.592 -14.814 -5.309 1.00 0.00 C ATOM 1492 CG LYS A 96 10.608 -13.712 -5.061 1.00 0.00 C ATOM 1493 CD LYS A 96 11.823 -13.863 -5.960 1.00 0.00 C ATOM 1494 CE LYS A 96 12.673 -12.601 -5.965 1.00 0.00 C ATOM 1495 NZ LYS A 96 12.057 -11.521 -6.783 1.00 0.00 N ATOM 0 H LYS A 96 7.949 -13.101 -4.636 1.00 0.00 H new ATOM 0 HA LYS A 96 8.018 -15.912 -4.339 1.00 0.00 H new ATOM 0 HB2 LYS A 96 10.121 -15.747 -5.504 1.00 0.00 H new ATOM 0 HB3 LYS A 96 9.023 -14.576 -6.208 1.00 0.00 H new ATOM 0 HG2 LYS A 96 10.144 -12.741 -5.235 1.00 0.00 H new ATOM 0 HG3 LYS A 96 10.921 -13.733 -4.017 1.00 0.00 H new ATOM 0 HD2 LYS A 96 12.425 -14.707 -5.622 1.00 0.00 H new ATOM 0 HD3 LYS A 96 11.499 -14.089 -6.976 1.00 0.00 H new ATOM 0 HE2 LYS A 96 12.808 -12.250 -4.942 1.00 0.00 H new ATOM 0 HE3 LYS A 96 13.664 -12.832 -6.356 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 12.796 -11.037 -7.332 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 11.357 -11.934 -7.432 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 11.587 -10.837 -6.157 1.00 0.00 H new ATOM 1509 N ASP A 97 9.384 -14.241 -1.981 1.00 0.00 N ATOM 1510 CA ASP A 97 10.087 -14.324 -0.706 1.00 0.00 C ATOM 1511 C ASP A 97 9.184 -14.908 0.376 1.00 0.00 C ATOM 1512 O ASP A 97 9.661 -15.488 1.352 1.00 0.00 O ATOM 1513 CB ASP A 97 10.584 -12.941 -0.282 1.00 0.00 C ATOM 1514 CG ASP A 97 11.810 -13.014 0.607 1.00 0.00 C ATOM 1515 OD1 ASP A 97 12.366 -14.122 0.762 1.00 0.00 O ATOM 1516 OD2 ASP A 97 12.215 -11.963 1.146 1.00 0.00 O ATOM 0 H ASP A 97 8.892 -13.361 -2.134 1.00 0.00 H new ATOM 0 HA ASP A 97 10.944 -14.985 -0.834 1.00 0.00 H new ATOM 0 HB2 ASP A 97 10.817 -12.354 -1.170 1.00 0.00 H new ATOM 0 HB3 ASP A 97 9.787 -12.418 0.246 1.00 0.00 H new ATOM 1521 N LEU A 98 7.877 -14.749 0.197 1.00 0.00 N ATOM 1522 CA LEU A 98 6.906 -15.259 1.158 1.00 0.00 C ATOM 1523 C LEU A 98 6.593 -16.728 0.890 1.00 0.00 C ATOM 1524 O LEU A 98 6.210 -17.469 1.796 1.00 0.00 O ATOM 1525 CB LEU A 98 5.620 -14.434 1.101 1.00 0.00 C ATOM 1526 CG LEU A 98 5.791 -12.917 1.188 1.00 0.00 C ATOM 1527 CD1 LEU A 98 4.680 -12.209 0.429 1.00 0.00 C ATOM 1528 CD2 LEU A 98 5.819 -12.465 2.641 1.00 0.00 C ATOM 0 H LEU A 98 7.466 -14.271 -0.605 1.00 0.00 H new ATOM 0 HA LEU A 98 7.341 -15.175 2.154 1.00 0.00 H new ATOM 0 HB2 LEU A 98 5.103 -14.668 0.171 1.00 0.00 H new ATOM 0 HB3 LEU A 98 4.971 -14.754 1.916 1.00 0.00 H new ATOM 0 HG LEU A 98 6.743 -12.652 0.728 1.00 0.00 H new ATOM 0 HD11 LEU A 98 4.819 -11.130 0.503 1.00 0.00 H new ATOM 0 HD12 LEU A 98 4.708 -12.508 -0.619 1.00 0.00 H new ATOM 0 HD13 LEU A 98 3.716 -12.481 0.858 1.00 0.00 H new ATOM 0 HD21 LEU A 98 5.941 -11.383 2.683 1.00 0.00 H new ATOM 0 HD22 LEU A 98 4.884 -12.744 3.127 1.00 0.00 H new ATOM 0 HD23 LEU A 98 6.652 -12.945 3.155 1.00 0.00 H new ATOM 1540 N THR A 99 6.761 -17.144 -0.362 1.00 0.00 N ATOM 1541 CA THR A 99 6.498 -18.524 -0.751 1.00 0.00 C ATOM 1542 C THR A 99 6.983 -19.498 0.317 1.00 0.00 C ATOM 1543 O THR A 99 7.913 -19.201 1.066 1.00 0.00 O ATOM 1544 CB THR A 99 7.176 -18.869 -2.090 1.00 0.00 C ATOM 1545 OG1 THR A 99 8.525 -18.389 -2.095 1.00 0.00 O ATOM 1546 CG2 THR A 99 6.411 -18.261 -3.256 1.00 0.00 C ATOM 0 H THR A 99 7.078 -16.544 -1.124 1.00 0.00 H new ATOM 0 HA THR A 99 5.418 -18.620 -0.864 1.00 0.00 H new ATOM 0 HB THR A 99 7.177 -19.953 -2.203 1.00 0.00 H new ATOM 0 HG1 THR A 99 8.567 -17.537 -2.578 1.00 0.00 H new ATOM 0 HG21 THR A 99 6.909 -18.518 -4.191 1.00 0.00 H new ATOM 0 HG22 THR A 99 5.394 -18.652 -3.267 1.00 0.00 H new ATOM 0 HG23 THR A 99 6.382 -17.177 -3.146 1.00 0.00 H new ATOM 1554 N GLY A 100 6.346 -20.663 0.382 1.00 0.00 N ATOM 1555 CA GLY A 100 6.727 -21.663 1.362 1.00 0.00 C ATOM 1556 C GLY A 100 5.562 -22.535 1.784 1.00 0.00 C ATOM 1557 O GLY A 100 4.462 -22.419 1.242 1.00 0.00 O ATOM 0 H GLY A 100 5.573 -20.932 -0.227 1.00 0.00 H new ATOM 0 HA2 GLY A 100 7.516 -22.291 0.948 1.00 0.00 H new ATOM 0 HA3 GLY A 100 7.142 -21.167 2.239 1.00 0.00 H new ATOM 1561 N ASP A 101 5.801 -23.412 2.753 1.00 0.00 N ATOM 1562 CA ASP A 101 4.762 -24.308 3.248 1.00 0.00 C ATOM 1563 C ASP A 101 4.254 -23.850 4.612 1.00 0.00 C ATOM 1564 O ASP A 101 3.466 -24.543 5.254 1.00 0.00 O ATOM 1565 CB ASP A 101 5.295 -25.738 3.342 1.00 0.00 C ATOM 1566 CG ASP A 101 5.209 -26.477 2.021 1.00 0.00 C ATOM 1567 OD1 ASP A 101 4.304 -26.158 1.222 1.00 0.00 O ATOM 1568 OD2 ASP A 101 6.045 -27.374 1.786 1.00 0.00 O ATOM 0 H ASP A 101 6.706 -23.522 3.212 1.00 0.00 H new ATOM 0 HA ASP A 101 3.930 -24.284 2.544 1.00 0.00 H new ATOM 0 HB2 ASP A 101 6.333 -25.715 3.675 1.00 0.00 H new ATOM 0 HB3 ASP A 101 4.730 -26.284 4.098 1.00 0.00 H new ATOM 1573 N GLN A 102 4.712 -22.681 5.046 1.00 0.00 N ATOM 1574 CA GLN A 102 4.305 -22.133 6.335 1.00 0.00 C ATOM 1575 C GLN A 102 4.051 -20.633 6.232 1.00 0.00 C ATOM 1576 O GLN A 102 4.880 -19.886 5.713 1.00 0.00 O ATOM 1577 CB GLN A 102 5.376 -22.409 7.392 1.00 0.00 C ATOM 1578 CG GLN A 102 5.470 -23.872 7.794 1.00 0.00 C ATOM 1579 CD GLN A 102 6.828 -24.234 8.363 1.00 0.00 C ATOM 1580 OE1 GLN A 102 7.782 -23.463 8.262 1.00 0.00 O ATOM 1581 NE2 GLN A 102 6.922 -25.414 8.965 1.00 0.00 N ATOM 0 H GLN A 102 5.364 -22.095 4.525 1.00 0.00 H new ATOM 0 HA GLN A 102 3.377 -22.621 6.632 1.00 0.00 H new ATOM 0 HB2 GLN A 102 6.344 -22.082 7.011 1.00 0.00 H new ATOM 0 HB3 GLN A 102 5.164 -21.810 8.278 1.00 0.00 H new ATOM 0 HG2 GLN A 102 4.700 -24.092 8.533 1.00 0.00 H new ATOM 0 HG3 GLN A 102 5.266 -24.498 6.925 1.00 0.00 H new ATOM 0 HE21 GLN A 102 6.105 -26.022 9.026 1.00 0.00 H new ATOM 0 HE22 GLN A 102 7.811 -25.712 9.366 1.00 0.00 H new ATOM 1590 N SER A 103 2.897 -20.198 6.729 1.00 0.00 N ATOM 1591 CA SER A 103 2.531 -18.786 6.690 1.00 0.00 C ATOM 1592 C SER A 103 3.754 -17.902 6.912 1.00 0.00 C ATOM 1593 O SER A 103 4.630 -18.225 7.714 1.00 0.00 O ATOM 1594 CB SER A 103 1.469 -18.483 7.748 1.00 0.00 C ATOM 1595 OG SER A 103 1.436 -17.101 8.056 1.00 0.00 O ATOM 0 H SER A 103 2.200 -20.803 7.163 1.00 0.00 H new ATOM 0 HA SER A 103 2.122 -18.569 5.703 1.00 0.00 H new ATOM 0 HB2 SER A 103 0.491 -18.802 7.388 1.00 0.00 H new ATOM 0 HB3 SER A 103 1.678 -19.055 8.652 1.00 0.00 H new ATOM 0 HG SER A 103 0.748 -16.933 8.733 1.00 0.00 H new ATOM 1601 N ARG A 104 3.806 -16.783 6.196 1.00 0.00 N ATOM 1602 CA ARG A 104 4.921 -15.852 6.313 1.00 0.00 C ATOM 1603 C ARG A 104 4.470 -14.424 6.015 1.00 0.00 C ATOM 1604 O ARG A 104 4.019 -14.123 4.910 1.00 0.00 O ATOM 1605 CB ARG A 104 6.049 -16.251 5.361 1.00 0.00 C ATOM 1606 CG ARG A 104 7.252 -15.324 5.419 1.00 0.00 C ATOM 1607 CD ARG A 104 8.483 -15.968 4.800 1.00 0.00 C ATOM 1608 NE ARG A 104 8.910 -17.154 5.538 1.00 0.00 N ATOM 1609 CZ ARG A 104 9.721 -18.079 5.038 1.00 0.00 C ATOM 1610 NH1 ARG A 104 10.191 -17.956 3.804 1.00 0.00 N ATOM 1611 NH2 ARG A 104 10.065 -19.129 5.772 1.00 0.00 N ATOM 0 H ARG A 104 3.088 -16.500 5.529 1.00 0.00 H new ATOM 0 HA ARG A 104 5.289 -15.892 7.338 1.00 0.00 H new ATOM 0 HB2 ARG A 104 6.371 -17.265 5.598 1.00 0.00 H new ATOM 0 HB3 ARG A 104 5.663 -16.269 4.342 1.00 0.00 H new ATOM 0 HG2 ARG A 104 7.023 -14.396 4.895 1.00 0.00 H new ATOM 0 HG3 ARG A 104 7.460 -15.061 6.456 1.00 0.00 H new ATOM 0 HD2 ARG A 104 8.268 -16.242 3.767 1.00 0.00 H new ATOM 0 HD3 ARG A 104 9.297 -15.244 4.775 1.00 0.00 H new ATOM 0 HE ARG A 104 8.566 -17.279 6.490 1.00 0.00 H new ATOM 0 HH11 ARG A 104 9.930 -17.150 3.237 1.00 0.00 H new ATOM 0 HH12 ARG A 104 10.814 -18.668 3.422 1.00 0.00 H new ATOM 0 HH21 ARG A 104 9.706 -19.227 6.722 1.00 0.00 H new ATOM 0 HH22 ARG A 104 10.688 -19.839 5.386 1.00 0.00 H new ATOM 1625 N SER A 105 4.596 -13.550 7.008 1.00 0.00 N ATOM 1626 CA SER A 105 4.198 -12.156 6.854 1.00 0.00 C ATOM 1627 C SER A 105 5.396 -11.227 7.025 1.00 0.00 C ATOM 1628 O SER A 105 5.881 -11.018 8.138 1.00 0.00 O ATOM 1629 CB SER A 105 3.112 -11.798 7.871 1.00 0.00 C ATOM 1630 OG SER A 105 3.537 -12.082 9.193 1.00 0.00 O ATOM 0 H SER A 105 4.971 -13.783 7.928 1.00 0.00 H new ATOM 0 HA SER A 105 3.800 -12.027 5.847 1.00 0.00 H new ATOM 0 HB2 SER A 105 2.863 -10.740 7.785 1.00 0.00 H new ATOM 0 HB3 SER A 105 2.203 -12.358 7.650 1.00 0.00 H new ATOM 0 HG SER A 105 4.481 -11.838 9.293 1.00 0.00 H new ATOM 1636 N LEU A 106 5.869 -10.672 5.915 1.00 0.00 N ATOM 1637 CA LEU A 106 7.010 -9.764 5.939 1.00 0.00 C ATOM 1638 C LEU A 106 6.563 -8.320 5.735 1.00 0.00 C ATOM 1639 O LEU A 106 5.897 -7.983 4.757 1.00 0.00 O ATOM 1640 CB LEU A 106 8.020 -10.154 4.859 1.00 0.00 C ATOM 1641 CG LEU A 106 8.775 -11.465 5.087 1.00 0.00 C ATOM 1642 CD1 LEU A 106 9.368 -11.973 3.782 1.00 0.00 C ATOM 1643 CD2 LEU A 106 9.864 -11.278 6.133 1.00 0.00 C ATOM 0 H LEU A 106 5.480 -10.835 4.986 1.00 0.00 H new ATOM 0 HA LEU A 106 7.484 -9.843 6.917 1.00 0.00 H new ATOM 0 HB2 LEU A 106 7.495 -10.221 3.906 1.00 0.00 H new ATOM 0 HB3 LEU A 106 8.750 -9.350 4.765 1.00 0.00 H new ATOM 0 HG LEU A 106 8.069 -12.209 5.456 1.00 0.00 H new ATOM 0 HD11 LEU A 106 9.901 -12.906 3.964 1.00 0.00 H new ATOM 0 HD12 LEU A 106 8.568 -12.146 3.062 1.00 0.00 H new ATOM 0 HD13 LEU A 106 10.060 -11.231 3.384 1.00 0.00 H new ATOM 0 HD21 LEU A 106 10.391 -12.221 6.282 1.00 0.00 H new ATOM 0 HD22 LEU A 106 10.568 -10.519 5.793 1.00 0.00 H new ATOM 0 HD23 LEU A 106 9.414 -10.961 7.074 1.00 0.00 H new ATOM 1655 N PRO A 107 6.939 -7.445 6.680 1.00 0.00 N ATOM 1656 CA PRO A 107 6.589 -6.022 6.625 1.00 0.00 C ATOM 1657 C PRO A 107 7.327 -5.287 5.511 1.00 0.00 C ATOM 1658 O PRO A 107 8.543 -5.102 5.576 1.00 0.00 O ATOM 1659 CB PRO A 107 7.027 -5.497 7.994 1.00 0.00 C ATOM 1660 CG PRO A 107 8.102 -6.430 8.433 1.00 0.00 C ATOM 1661 CD PRO A 107 7.734 -7.777 7.874 1.00 0.00 C ATOM 0 HA PRO A 107 5.531 -5.870 6.413 1.00 0.00 H new ATOM 0 HB2 PRO A 107 7.395 -4.473 7.926 1.00 0.00 H new ATOM 0 HB3 PRO A 107 6.196 -5.491 8.700 1.00 0.00 H new ATOM 0 HG2 PRO A 107 9.075 -6.106 8.063 1.00 0.00 H new ATOM 0 HG3 PRO A 107 8.170 -6.464 9.520 1.00 0.00 H new ATOM 0 HD2 PRO A 107 8.618 -8.361 7.618 1.00 0.00 H new ATOM 0 HD3 PRO A 107 7.159 -8.365 8.589 1.00 0.00 H new ATOM 1669 N TYR A 108 6.585 -4.870 4.492 1.00 0.00 N ATOM 1670 CA TYR A 108 7.170 -4.156 3.363 1.00 0.00 C ATOM 1671 C TYR A 108 6.976 -2.650 3.511 1.00 0.00 C ATOM 1672 O TYR A 108 5.899 -2.120 3.234 1.00 0.00 O ATOM 1673 CB TYR A 108 6.546 -4.636 2.051 1.00 0.00 C ATOM 1674 CG TYR A 108 7.001 -6.016 1.633 1.00 0.00 C ATOM 1675 CD1 TYR A 108 6.325 -7.151 2.062 1.00 0.00 C ATOM 1676 CD2 TYR A 108 8.106 -6.184 0.808 1.00 0.00 C ATOM 1677 CE1 TYR A 108 6.737 -8.414 1.684 1.00 0.00 C ATOM 1678 CE2 TYR A 108 8.524 -7.443 0.423 1.00 0.00 C ATOM 1679 CZ TYR A 108 7.837 -8.555 0.864 1.00 0.00 C ATOM 1680 OH TYR A 108 8.250 -9.811 0.483 1.00 0.00 O ATOM 0 H TYR A 108 5.577 -5.014 4.424 1.00 0.00 H new ATOM 0 HA TYR A 108 8.239 -4.366 3.347 1.00 0.00 H new ATOM 0 HB2 TYR A 108 5.461 -4.636 2.153 1.00 0.00 H new ATOM 0 HB3 TYR A 108 6.792 -3.927 1.261 1.00 0.00 H new ATOM 0 HD1 TYR A 108 5.462 -7.044 2.702 1.00 0.00 H new ATOM 0 HD2 TYR A 108 8.647 -5.316 0.462 1.00 0.00 H new ATOM 0 HE1 TYR A 108 6.201 -9.286 2.029 1.00 0.00 H new ATOM 0 HE2 TYR A 108 9.384 -7.556 -0.220 1.00 0.00 H new ATOM 0 HH TYR A 108 9.038 -9.735 -0.095 1.00 0.00 H new ATOM 1690 N LYS A 109 8.026 -1.965 3.949 1.00 0.00 N ATOM 1691 CA LYS A 109 7.975 -0.520 4.133 1.00 0.00 C ATOM 1692 C LYS A 109 9.104 0.166 3.370 1.00 0.00 C ATOM 1693 O LYS A 109 9.985 -0.494 2.818 1.00 0.00 O ATOM 1694 CB LYS A 109 8.066 -0.171 5.620 1.00 0.00 C ATOM 1695 CG LYS A 109 7.323 -1.144 6.520 1.00 0.00 C ATOM 1696 CD LYS A 109 6.970 -0.511 7.855 1.00 0.00 C ATOM 1697 CE LYS A 109 6.628 -1.564 8.898 1.00 0.00 C ATOM 1698 NZ LYS A 109 6.695 -1.017 10.282 1.00 0.00 N ATOM 0 H LYS A 109 8.924 -2.388 4.184 1.00 0.00 H new ATOM 0 HA LYS A 109 7.024 -0.162 3.739 1.00 0.00 H new ATOM 0 HB2 LYS A 109 9.115 -0.145 5.915 1.00 0.00 H new ATOM 0 HB3 LYS A 109 7.666 0.831 5.774 1.00 0.00 H new ATOM 0 HG2 LYS A 109 6.412 -1.478 6.023 1.00 0.00 H new ATOM 0 HG3 LYS A 109 7.938 -2.028 6.687 1.00 0.00 H new ATOM 0 HD2 LYS A 109 7.808 0.092 8.206 1.00 0.00 H new ATOM 0 HD3 LYS A 109 6.124 0.164 7.727 1.00 0.00 H new ATOM 0 HE2 LYS A 109 5.627 -1.951 8.709 1.00 0.00 H new ATOM 0 HE3 LYS A 109 7.317 -2.404 8.806 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 6.455 -1.766 10.963 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 7.657 -0.671 10.472 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 6.019 -0.232 10.378 1.00 0.00 H new ATOM 1712 N LEU A 110 9.072 1.494 3.343 1.00 0.00 N ATOM 1713 CA LEU A 110 10.094 2.270 2.648 1.00 0.00 C ATOM 1714 C LEU A 110 10.161 1.886 1.174 1.00 0.00 C ATOM 1715 O LEU A 110 11.242 1.812 0.590 1.00 0.00 O ATOM 1716 CB LEU A 110 11.459 2.056 3.305 1.00 0.00 C ATOM 1717 CG LEU A 110 11.520 2.287 4.815 1.00 0.00 C ATOM 1718 CD1 LEU A 110 12.617 1.439 5.441 1.00 0.00 C ATOM 1719 CD2 LEU A 110 11.744 3.761 5.121 1.00 0.00 C ATOM 0 H LEU A 110 8.350 2.056 3.794 1.00 0.00 H new ATOM 0 HA LEU A 110 9.825 3.324 2.718 1.00 0.00 H new ATOM 0 HB2 LEU A 110 11.782 1.035 3.100 1.00 0.00 H new ATOM 0 HB3 LEU A 110 12.178 2.720 2.827 1.00 0.00 H new ATOM 0 HG LEU A 110 10.565 1.987 5.247 1.00 0.00 H new ATOM 0 HD11 LEU A 110 12.645 1.617 6.516 1.00 0.00 H new ATOM 0 HD12 LEU A 110 12.414 0.385 5.253 1.00 0.00 H new ATOM 0 HD13 LEU A 110 13.579 1.707 5.003 1.00 0.00 H new ATOM 0 HD21 LEU A 110 11.785 3.906 6.200 1.00 0.00 H new ATOM 0 HD22 LEU A 110 12.684 4.086 4.675 1.00 0.00 H new ATOM 0 HD23 LEU A 110 10.924 4.347 4.707 1.00 0.00 H new ATOM 1731 N ILE A 111 8.998 1.644 0.577 1.00 0.00 N ATOM 1732 CA ILE A 111 8.925 1.271 -0.830 1.00 0.00 C ATOM 1733 C ILE A 111 8.900 2.505 -1.725 1.00 0.00 C ATOM 1734 O ILE A 111 8.031 3.366 -1.588 1.00 0.00 O ATOM 1735 CB ILE A 111 7.679 0.414 -1.121 1.00 0.00 C ATOM 1736 CG1 ILE A 111 7.745 -0.902 -0.342 1.00 0.00 C ATOM 1737 CG2 ILE A 111 7.557 0.147 -2.614 1.00 0.00 C ATOM 1738 CD1 ILE A 111 6.442 -1.671 -0.344 1.00 0.00 C ATOM 0 H ILE A 111 8.094 1.700 1.046 1.00 0.00 H new ATOM 0 HA ILE A 111 9.818 0.685 -1.048 1.00 0.00 H new ATOM 0 HB ILE A 111 6.795 0.962 -0.796 1.00 0.00 H new ATOM 0 HG12 ILE A 111 8.528 -1.529 -0.769 1.00 0.00 H new ATOM 0 HG13 ILE A 111 8.032 -0.691 0.688 1.00 0.00 H new ATOM 0 HG21 ILE A 111 6.672 -0.460 -2.804 1.00 0.00 H new ATOM 0 HG22 ILE A 111 7.469 1.094 -3.147 1.00 0.00 H new ATOM 0 HG23 ILE A 111 8.443 -0.384 -2.962 1.00 0.00 H new ATOM 0 HD11 ILE A 111 6.562 -2.592 0.226 1.00 0.00 H new ATOM 0 HD12 ILE A 111 5.660 -1.063 0.110 1.00 0.00 H new ATOM 0 HD13 ILE A 111 6.164 -1.913 -1.370 1.00 0.00 H new ATOM 1750 N SER A 112 9.858 2.583 -2.643 1.00 0.00 N ATOM 1751 CA SER A 112 9.947 3.713 -3.561 1.00 0.00 C ATOM 1752 C SER A 112 8.966 3.551 -4.719 1.00 0.00 C ATOM 1753 O SER A 112 9.090 2.632 -5.529 1.00 0.00 O ATOM 1754 CB SER A 112 11.372 3.847 -4.100 1.00 0.00 C ATOM 1755 OG SER A 112 12.155 4.687 -3.269 1.00 0.00 O ATOM 0 H SER A 112 10.583 1.877 -2.771 1.00 0.00 H new ATOM 0 HA SER A 112 9.687 4.618 -3.012 1.00 0.00 H new ATOM 0 HB2 SER A 112 11.834 2.862 -4.165 1.00 0.00 H new ATOM 0 HB3 SER A 112 11.345 4.253 -5.111 1.00 0.00 H new ATOM 0 HG SER A 112 13.062 4.755 -3.634 1.00 0.00 H new ATOM 1761 N LEU A 113 7.991 4.451 -4.790 1.00 0.00 N ATOM 1762 CA LEU A 113 6.988 4.410 -5.848 1.00 0.00 C ATOM 1763 C LEU A 113 7.539 4.997 -7.143 1.00 0.00 C ATOM 1764 O LEU A 113 8.146 6.069 -7.143 1.00 0.00 O ATOM 1765 CB LEU A 113 5.735 5.176 -5.419 1.00 0.00 C ATOM 1766 CG LEU A 113 5.043 4.675 -4.151 1.00 0.00 C ATOM 1767 CD1 LEU A 113 3.941 5.634 -3.730 1.00 0.00 C ATOM 1768 CD2 LEU A 113 4.481 3.277 -4.367 1.00 0.00 C ATOM 0 H LEU A 113 7.874 5.218 -4.128 1.00 0.00 H new ATOM 0 HA LEU A 113 6.725 3.367 -6.027 1.00 0.00 H new ATOM 0 HB2 LEU A 113 6.005 6.222 -5.272 1.00 0.00 H new ATOM 0 HB3 LEU A 113 5.016 5.144 -6.238 1.00 0.00 H new ATOM 0 HG LEU A 113 5.782 4.629 -3.351 1.00 0.00 H new ATOM 0 HD11 LEU A 113 3.460 5.261 -2.826 1.00 0.00 H new ATOM 0 HD12 LEU A 113 4.369 6.617 -3.534 1.00 0.00 H new ATOM 0 HD13 LEU A 113 3.203 5.713 -4.528 1.00 0.00 H new ATOM 0 HD21 LEU A 113 3.992 2.936 -3.454 1.00 0.00 H new ATOM 0 HD22 LEU A 113 3.756 3.298 -5.181 1.00 0.00 H new ATOM 0 HD23 LEU A 113 5.292 2.594 -4.621 1.00 0.00 H new ATOM 1780 N LEU A 114 7.321 4.290 -8.246 1.00 0.00 N ATOM 1781 CA LEU A 114 7.793 4.742 -9.551 1.00 0.00 C ATOM 1782 C LEU A 114 6.628 4.928 -10.517 1.00 0.00 C ATOM 1783 O LEU A 114 5.679 4.145 -10.518 1.00 0.00 O ATOM 1784 CB LEU A 114 8.794 3.739 -10.128 1.00 0.00 C ATOM 1785 CG LEU A 114 9.669 3.004 -9.112 1.00 0.00 C ATOM 1786 CD1 LEU A 114 10.344 1.804 -9.758 1.00 0.00 C ATOM 1787 CD2 LEU A 114 10.707 3.947 -8.520 1.00 0.00 C ATOM 0 H LEU A 114 6.820 3.401 -8.263 1.00 0.00 H new ATOM 0 HA LEU A 114 8.287 5.704 -9.418 1.00 0.00 H new ATOM 0 HB2 LEU A 114 8.243 2.998 -10.706 1.00 0.00 H new ATOM 0 HB3 LEU A 114 9.446 4.266 -10.825 1.00 0.00 H new ATOM 0 HG LEU A 114 9.031 2.645 -8.304 1.00 0.00 H new ATOM 0 HD11 LEU A 114 10.962 1.293 -9.020 1.00 0.00 H new ATOM 0 HD12 LEU A 114 9.585 1.117 -10.133 1.00 0.00 H new ATOM 0 HD13 LEU A 114 10.969 2.140 -10.585 1.00 0.00 H new ATOM 0 HD21 LEU A 114 11.320 3.407 -7.799 1.00 0.00 H new ATOM 0 HD22 LEU A 114 11.341 4.336 -9.316 1.00 0.00 H new ATOM 0 HD23 LEU A 114 10.204 4.774 -8.020 1.00 0.00 H new ATOM 1799 N ASN A 115 6.709 5.968 -11.340 1.00 0.00 N ATOM 1800 CA ASN A 115 5.662 6.256 -12.314 1.00 0.00 C ATOM 1801 C ASN A 115 5.673 5.231 -13.444 1.00 0.00 C ATOM 1802 O ASN A 115 6.474 4.297 -13.440 1.00 0.00 O ATOM 1803 CB ASN A 115 5.841 7.664 -12.885 1.00 0.00 C ATOM 1804 CG ASN A 115 7.301 8.038 -13.054 1.00 0.00 C ATOM 1805 OD1 ASN A 115 8.161 7.171 -13.210 1.00 0.00 O ATOM 1806 ND2 ASN A 115 7.587 9.335 -13.024 1.00 0.00 N ATOM 0 H ASN A 115 7.489 6.626 -11.352 1.00 0.00 H new ATOM 0 HA ASN A 115 4.700 6.198 -11.804 1.00 0.00 H new ATOM 0 HB2 ASN A 115 5.338 7.728 -13.850 1.00 0.00 H new ATOM 0 HB3 ASN A 115 5.358 8.385 -12.225 1.00 0.00 H new ATOM 0 HD21 ASN A 115 8.552 9.647 -13.133 1.00 0.00 H new ATOM 0 HD22 ASN A 115 6.842 10.019 -12.892 1.00 0.00 H new ATOM 1813 N GLU A 116 4.778 5.414 -14.410 1.00 0.00 N ATOM 1814 CA GLU A 116 4.686 4.505 -15.546 1.00 0.00 C ATOM 1815 C GLU A 116 6.019 4.419 -16.284 1.00 0.00 C ATOM 1816 O GLU A 116 6.232 3.524 -17.103 1.00 0.00 O ATOM 1817 CB GLU A 116 3.587 4.965 -16.507 1.00 0.00 C ATOM 1818 CG GLU A 116 3.823 6.351 -17.082 1.00 0.00 C ATOM 1819 CD GLU A 116 2.898 6.667 -18.242 1.00 0.00 C ATOM 1820 OE1 GLU A 116 1.738 6.207 -18.218 1.00 0.00 O ATOM 1821 OE2 GLU A 116 3.336 7.375 -19.173 1.00 0.00 O ATOM 0 H GLU A 116 4.107 6.182 -14.428 1.00 0.00 H new ATOM 0 HA GLU A 116 4.436 3.514 -15.167 1.00 0.00 H new ATOM 0 HB2 GLU A 116 3.509 4.250 -17.326 1.00 0.00 H new ATOM 0 HB3 GLU A 116 2.631 4.956 -15.984 1.00 0.00 H new ATOM 0 HG2 GLU A 116 3.683 7.094 -16.297 1.00 0.00 H new ATOM 0 HG3 GLU A 116 4.858 6.431 -17.415 1.00 0.00 H new ATOM 1828 N LYS A 117 6.914 5.355 -15.989 1.00 0.00 N ATOM 1829 CA LYS A 117 8.227 5.387 -16.622 1.00 0.00 C ATOM 1830 C LYS A 117 9.249 4.616 -15.792 1.00 0.00 C ATOM 1831 O LYS A 117 10.204 4.057 -16.330 1.00 0.00 O ATOM 1832 CB LYS A 117 8.691 6.833 -16.808 1.00 0.00 C ATOM 1833 CG LYS A 117 7.643 7.731 -17.441 1.00 0.00 C ATOM 1834 CD LYS A 117 7.468 7.429 -18.919 1.00 0.00 C ATOM 1835 CE LYS A 117 8.609 8.003 -19.745 1.00 0.00 C ATOM 1836 NZ LYS A 117 8.394 9.442 -20.064 1.00 0.00 N ATOM 0 H LYS A 117 6.754 6.103 -15.314 1.00 0.00 H new ATOM 0 HA LYS A 117 8.144 4.911 -17.599 1.00 0.00 H new ATOM 0 HB2 LYS A 117 8.971 7.244 -15.838 1.00 0.00 H new ATOM 0 HB3 LYS A 117 9.587 6.841 -17.428 1.00 0.00 H new ATOM 0 HG2 LYS A 117 6.691 7.599 -16.927 1.00 0.00 H new ATOM 0 HG3 LYS A 117 7.932 8.774 -17.314 1.00 0.00 H new ATOM 0 HD2 LYS A 117 7.417 6.350 -19.067 1.00 0.00 H new ATOM 0 HD3 LYS A 117 6.522 7.844 -19.266 1.00 0.00 H new ATOM 0 HE2 LYS A 117 9.546 7.888 -19.200 1.00 0.00 H new ATOM 0 HE3 LYS A 117 8.708 7.437 -20.671 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 9.193 9.796 -20.628 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 7.513 9.549 -20.606 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 8.325 9.987 -19.181 1.00 0.00 H new ATOM 1850 N GLY A 118 9.041 4.590 -14.479 1.00 0.00 N ATOM 1851 CA GLY A 118 9.952 3.884 -13.598 1.00 0.00 C ATOM 1852 C GLY A 118 10.812 4.826 -12.778 1.00 0.00 C ATOM 1853 O GLY A 118 11.728 4.391 -12.081 1.00 0.00 O ATOM 0 H GLY A 118 8.258 5.045 -14.010 1.00 0.00 H new ATOM 0 HA2 GLY A 118 9.380 3.242 -12.928 1.00 0.00 H new ATOM 0 HA3 GLY A 118 10.595 3.233 -14.191 1.00 0.00 H new ATOM 1857 N GLN A 119 10.517 6.119 -12.863 1.00 0.00 N ATOM 1858 CA GLN A 119 11.272 7.124 -12.124 1.00 0.00 C ATOM 1859 C GLN A 119 10.754 7.253 -10.695 1.00 0.00 C ATOM 1860 O GLN A 119 9.545 7.267 -10.462 1.00 0.00 O ATOM 1861 CB GLN A 119 11.189 8.477 -12.833 1.00 0.00 C ATOM 1862 CG GLN A 119 12.087 8.579 -14.056 1.00 0.00 C ATOM 1863 CD GLN A 119 13.542 8.302 -13.736 1.00 0.00 C ATOM 1864 OE1 GLN A 119 14.038 8.674 -12.672 1.00 0.00 O ATOM 1865 NE2 GLN A 119 14.236 7.644 -14.658 1.00 0.00 N ATOM 0 H GLN A 119 9.761 6.495 -13.436 1.00 0.00 H new ATOM 0 HA GLN A 119 12.313 6.804 -12.086 1.00 0.00 H new ATOM 0 HB2 GLN A 119 10.157 8.657 -13.134 1.00 0.00 H new ATOM 0 HB3 GLN A 119 11.458 9.264 -12.129 1.00 0.00 H new ATOM 0 HG2 GLN A 119 11.745 7.874 -14.813 1.00 0.00 H new ATOM 0 HG3 GLN A 119 11.997 9.577 -14.486 1.00 0.00 H new ATOM 0 HE21 GLN A 119 13.785 7.355 -15.526 1.00 0.00 H new ATOM 0 HE22 GLN A 119 15.220 7.428 -14.498 1.00 0.00 H new ATOM 1874 N ASP A 120 11.676 7.346 -9.744 1.00 0.00 N ATOM 1875 CA ASP A 120 11.313 7.475 -8.337 1.00 0.00 C ATOM 1876 C ASP A 120 10.444 8.708 -8.111 1.00 0.00 C ATOM 1877 O ASP A 120 10.949 9.827 -8.013 1.00 0.00 O ATOM 1878 CB ASP A 120 12.569 7.554 -7.469 1.00 0.00 C ATOM 1879 CG ASP A 120 13.549 6.436 -7.765 1.00 0.00 C ATOM 1880 OD1 ASP A 120 13.319 5.689 -8.739 1.00 0.00 O ATOM 1881 OD2 ASP A 120 14.546 6.308 -7.023 1.00 0.00 O ATOM 0 H ASP A 120 12.680 7.335 -9.921 1.00 0.00 H new ATOM 0 HA ASP A 120 10.740 6.592 -8.053 1.00 0.00 H new ATOM 0 HB2 ASP A 120 13.059 8.514 -7.630 1.00 0.00 H new ATOM 0 HB3 ASP A 120 12.284 7.514 -6.418 1.00 0.00 H new ATOM 1886 N THR A 121 9.134 8.497 -8.029 1.00 0.00 N ATOM 1887 CA THR A 121 8.195 9.591 -7.817 1.00 0.00 C ATOM 1888 C THR A 121 8.499 10.332 -6.520 1.00 0.00 C ATOM 1889 O THR A 121 8.145 11.500 -6.364 1.00 0.00 O ATOM 1890 CB THR A 121 6.741 9.084 -7.776 1.00 0.00 C ATOM 1891 OG1 THR A 121 6.596 8.095 -6.750 1.00 0.00 O ATOM 1892 CG2 THR A 121 6.337 8.492 -9.118 1.00 0.00 C ATOM 0 H THR A 121 8.699 7.578 -8.106 1.00 0.00 H new ATOM 0 HA THR A 121 8.310 10.274 -8.659 1.00 0.00 H new ATOM 0 HB THR A 121 6.090 9.931 -7.559 1.00 0.00 H new ATOM 0 HG1 THR A 121 7.419 7.567 -6.686 1.00 0.00 H new ATOM 0 HG21 THR A 121 5.307 8.141 -9.065 1.00 0.00 H new ATOM 0 HG22 THR A 121 6.421 9.255 -9.892 1.00 0.00 H new ATOM 0 HG23 THR A 121 6.994 7.656 -9.359 1.00 0.00 H new ATOM 1900 N GLY A 122 9.158 9.646 -5.591 1.00 0.00 N ATOM 1901 CA GLY A 122 9.499 10.256 -4.320 1.00 0.00 C ATOM 1902 C GLY A 122 8.439 10.022 -3.262 1.00 0.00 C ATOM 1903 O GLY A 122 8.370 10.749 -2.271 1.00 0.00 O ATOM 0 H GLY A 122 9.462 8.678 -5.697 1.00 0.00 H new ATOM 0 HA2 GLY A 122 10.451 9.855 -3.972 1.00 0.00 H new ATOM 0 HA3 GLY A 122 9.637 11.328 -4.460 1.00 0.00 H new ATOM 1907 N ALA A 123 7.609 9.006 -3.472 1.00 0.00 N ATOM 1908 CA ALA A 123 6.547 8.678 -2.528 1.00 0.00 C ATOM 1909 C ALA A 123 6.765 7.300 -1.914 1.00 0.00 C ATOM 1910 O ALA A 123 7.036 6.328 -2.621 1.00 0.00 O ATOM 1911 CB ALA A 123 5.192 8.743 -3.216 1.00 0.00 C ATOM 0 H ALA A 123 7.651 8.395 -4.288 1.00 0.00 H new ATOM 0 HA ALA A 123 6.570 9.413 -1.723 1.00 0.00 H new ATOM 0 HB1 ALA A 123 4.408 8.496 -2.500 1.00 0.00 H new ATOM 0 HB2 ALA A 123 5.027 9.749 -3.601 1.00 0.00 H new ATOM 0 HB3 ALA A 123 5.168 8.030 -4.040 1.00 0.00 H new ATOM 1917 N THR A 124 6.647 7.221 -0.592 1.00 0.00 N ATOM 1918 CA THR A 124 6.833 5.962 0.118 1.00 0.00 C ATOM 1919 C THR A 124 5.545 5.521 0.804 1.00 0.00 C ATOM 1920 O THR A 124 4.790 6.348 1.316 1.00 0.00 O ATOM 1921 CB THR A 124 7.951 6.071 1.172 1.00 0.00 C ATOM 1922 OG1 THR A 124 7.548 6.957 2.223 1.00 0.00 O ATOM 1923 CG2 THR A 124 9.241 6.575 0.543 1.00 0.00 C ATOM 0 H THR A 124 6.423 8.015 0.008 1.00 0.00 H new ATOM 0 HA THR A 124 7.117 5.219 -0.627 1.00 0.00 H new ATOM 0 HB THR A 124 8.131 5.078 1.583 1.00 0.00 H new ATOM 0 HG1 THR A 124 7.788 7.877 1.985 1.00 0.00 H new ATOM 0 HG21 THR A 124 10.016 6.644 1.307 1.00 0.00 H new ATOM 0 HG22 THR A 124 9.560 5.883 -0.236 1.00 0.00 H new ATOM 0 HG23 THR A 124 9.073 7.560 0.107 1.00 0.00 H new ATOM 1931 N ILE A 125 5.300 4.215 0.810 1.00 0.00 N ATOM 1932 CA ILE A 125 4.103 3.666 1.435 1.00 0.00 C ATOM 1933 C ILE A 125 4.415 2.373 2.179 1.00 0.00 C ATOM 1934 O ILE A 125 5.120 1.503 1.665 1.00 0.00 O ATOM 1935 CB ILE A 125 3.000 3.394 0.395 1.00 0.00 C ATOM 1936 CG1 ILE A 125 1.800 2.713 1.059 1.00 0.00 C ATOM 1937 CG2 ILE A 125 3.541 2.536 -0.739 1.00 0.00 C ATOM 1938 CD1 ILE A 125 0.562 2.692 0.191 1.00 0.00 C ATOM 0 H ILE A 125 5.914 3.518 0.389 1.00 0.00 H new ATOM 0 HA ILE A 125 3.746 4.413 2.144 1.00 0.00 H new ATOM 0 HB ILE A 125 2.670 4.346 -0.021 1.00 0.00 H new ATOM 0 HG12 ILE A 125 2.070 1.689 1.317 1.00 0.00 H new ATOM 0 HG13 ILE A 125 1.571 3.227 1.992 1.00 0.00 H new ATOM 0 HG21 ILE A 125 2.750 2.352 -1.466 1.00 0.00 H new ATOM 0 HG22 ILE A 125 4.367 3.055 -1.225 1.00 0.00 H new ATOM 0 HG23 ILE A 125 3.894 1.585 -0.339 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -0.248 2.195 0.725 1.00 0.00 H new ATOM 0 HD12 ILE A 125 0.267 3.714 -0.046 1.00 0.00 H new ATOM 0 HD13 ILE A 125 0.774 2.152 -0.732 1.00 0.00 H new ATOM 1950 N ASP A 126 3.886 2.251 3.391 1.00 0.00 N ATOM 1951 CA ASP A 126 4.105 1.062 4.206 1.00 0.00 C ATOM 1952 C ASP A 126 2.998 0.037 3.981 1.00 0.00 C ATOM 1953 O ASP A 126 1.817 0.383 3.936 1.00 0.00 O ATOM 1954 CB ASP A 126 4.176 1.438 5.687 1.00 0.00 C ATOM 1955 CG ASP A 126 4.837 2.784 5.911 1.00 0.00 C ATOM 1956 OD1 ASP A 126 6.084 2.831 5.958 1.00 0.00 O ATOM 1957 OD2 ASP A 126 4.107 3.789 6.041 1.00 0.00 O ATOM 0 H ASP A 126 3.302 2.962 3.831 1.00 0.00 H new ATOM 0 HA ASP A 126 5.054 0.617 3.907 1.00 0.00 H new ATOM 0 HB2 ASP A 126 3.169 1.457 6.103 1.00 0.00 H new ATOM 0 HB3 ASP A 126 4.729 0.670 6.228 1.00 0.00 H new ATOM 1962 N LEU A 127 3.387 -1.225 3.839 1.00 0.00 N ATOM 1963 CA LEU A 127 2.428 -2.302 3.617 1.00 0.00 C ATOM 1964 C LEU A 127 2.908 -3.599 4.259 1.00 0.00 C ATOM 1965 O LEU A 127 4.105 -3.883 4.292 1.00 0.00 O ATOM 1966 CB LEU A 127 2.206 -2.513 2.118 1.00 0.00 C ATOM 1967 CG LEU A 127 1.794 -1.275 1.320 1.00 0.00 C ATOM 1968 CD1 LEU A 127 2.181 -1.430 -0.142 1.00 0.00 C ATOM 1969 CD2 LEU A 127 0.298 -1.027 1.454 1.00 0.00 C ATOM 0 H LEU A 127 4.360 -1.528 3.874 1.00 0.00 H new ATOM 0 HA LEU A 127 1.484 -2.016 4.081 1.00 0.00 H new ATOM 0 HB2 LEU A 127 3.125 -2.909 1.687 1.00 0.00 H new ATOM 0 HB3 LEU A 127 1.439 -3.276 1.988 1.00 0.00 H new ATOM 0 HG LEU A 127 2.323 -0.412 1.726 1.00 0.00 H new ATOM 0 HD11 LEU A 127 1.880 -0.540 -0.694 1.00 0.00 H new ATOM 0 HD12 LEU A 127 3.261 -1.558 -0.221 1.00 0.00 H new ATOM 0 HD13 LEU A 127 1.680 -2.303 -0.560 1.00 0.00 H new ATOM 0 HD21 LEU A 127 0.023 -0.142 0.880 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -0.249 -1.890 1.075 1.00 0.00 H new ATOM 0 HD23 LEU A 127 0.048 -0.871 2.503 1.00 0.00 H new ATOM 1981 N VAL A 128 1.964 -4.386 4.768 1.00 0.00 N ATOM 1982 CA VAL A 128 2.290 -5.655 5.407 1.00 0.00 C ATOM 1983 C VAL A 128 1.550 -6.811 4.741 1.00 0.00 C ATOM 1984 O VAL A 128 0.374 -7.048 5.015 1.00 0.00 O ATOM 1985 CB VAL A 128 1.942 -5.635 6.907 1.00 0.00 C ATOM 1986 CG1 VAL A 128 2.425 -6.908 7.585 1.00 0.00 C ATOM 1987 CG2 VAL A 128 2.541 -4.406 7.575 1.00 0.00 C ATOM 0 H VAL A 128 0.968 -4.166 4.750 1.00 0.00 H new ATOM 0 HA VAL A 128 3.364 -5.800 5.293 1.00 0.00 H new ATOM 0 HB VAL A 128 0.858 -5.586 7.010 1.00 0.00 H new ATOM 0 HG11 VAL A 128 2.170 -6.875 8.644 1.00 0.00 H new ATOM 0 HG12 VAL A 128 1.945 -7.771 7.123 1.00 0.00 H new ATOM 0 HG13 VAL A 128 3.506 -6.991 7.475 1.00 0.00 H new ATOM 0 HG21 VAL A 128 2.286 -4.407 8.635 1.00 0.00 H new ATOM 0 HG22 VAL A 128 3.625 -4.423 7.463 1.00 0.00 H new ATOM 0 HG23 VAL A 128 2.142 -3.506 7.107 1.00 0.00 H new ATOM 1997 N ILE A 129 2.248 -7.527 3.866 1.00 0.00 N ATOM 1998 CA ILE A 129 1.658 -8.658 3.162 1.00 0.00 C ATOM 1999 C ILE A 129 2.015 -9.975 3.843 1.00 0.00 C ATOM 2000 O ILE A 129 3.115 -10.136 4.370 1.00 0.00 O ATOM 2001 CB ILE A 129 2.119 -8.711 1.694 1.00 0.00 C ATOM 2002 CG1 ILE A 129 2.085 -7.312 1.075 1.00 0.00 C ATOM 2003 CG2 ILE A 129 1.246 -9.670 0.898 1.00 0.00 C ATOM 2004 CD1 ILE A 129 3.106 -7.112 -0.023 1.00 0.00 C ATOM 0 H ILE A 129 3.223 -7.344 3.628 1.00 0.00 H new ATOM 0 HA ILE A 129 0.577 -8.518 3.189 1.00 0.00 H new ATOM 0 HB ILE A 129 3.146 -9.076 1.664 1.00 0.00 H new ATOM 0 HG12 ILE A 129 1.089 -7.126 0.672 1.00 0.00 H new ATOM 0 HG13 ILE A 129 2.256 -6.573 1.858 1.00 0.00 H new ATOM 0 HG21 ILE A 129 1.585 -9.696 -0.138 1.00 0.00 H new ATOM 0 HG22 ILE A 129 1.317 -10.669 1.328 1.00 0.00 H new ATOM 0 HG23 ILE A 129 0.210 -9.333 0.932 1.00 0.00 H new ATOM 0 HD11 ILE A 129 3.024 -6.098 -0.415 1.00 0.00 H new ATOM 0 HD12 ILE A 129 4.107 -7.266 0.379 1.00 0.00 H new ATOM 0 HD13 ILE A 129 2.923 -7.827 -0.825 1.00 0.00 H new ATOM 2016 N GLY A 130 1.076 -10.917 3.826 1.00 0.00 N ATOM 2017 CA GLY A 130 1.311 -12.210 4.443 1.00 0.00 C ATOM 2018 C GLY A 130 0.670 -13.346 3.671 1.00 0.00 C ATOM 2019 O GLY A 130 -0.527 -13.313 3.384 1.00 0.00 O ATOM 0 H GLY A 130 0.157 -10.808 3.396 1.00 0.00 H new ATOM 0 HA2 GLY A 130 2.384 -12.385 4.516 1.00 0.00 H new ATOM 0 HA3 GLY A 130 0.920 -12.200 5.460 1.00 0.00 H new ATOM 2023 N TYR A 131 1.468 -14.353 3.333 1.00 0.00 N ATOM 2024 CA TYR A 131 0.972 -15.503 2.586 1.00 0.00 C ATOM 2025 C TYR A 131 0.678 -16.673 3.520 1.00 0.00 C ATOM 2026 O TYR A 131 1.390 -16.895 4.499 1.00 0.00 O ATOM 2027 CB TYR A 131 1.990 -15.925 1.525 1.00 0.00 C ATOM 2028 CG TYR A 131 1.798 -17.342 1.032 1.00 0.00 C ATOM 2029 CD1 TYR A 131 0.770 -17.659 0.153 1.00 0.00 C ATOM 2030 CD2 TYR A 131 2.643 -18.364 1.447 1.00 0.00 C ATOM 2031 CE1 TYR A 131 0.590 -18.951 -0.300 1.00 0.00 C ATOM 2032 CE2 TYR A 131 2.472 -19.659 0.998 1.00 0.00 C ATOM 2033 CZ TYR A 131 1.444 -19.948 0.125 1.00 0.00 C ATOM 2034 OH TYR A 131 1.269 -21.237 -0.323 1.00 0.00 O ATOM 0 H TYR A 131 2.460 -14.396 3.564 1.00 0.00 H new ATOM 0 HA TYR A 131 0.044 -15.213 2.094 1.00 0.00 H new ATOM 0 HB2 TYR A 131 1.924 -15.242 0.678 1.00 0.00 H new ATOM 0 HB3 TYR A 131 2.994 -15.825 1.937 1.00 0.00 H new ATOM 0 HD1 TYR A 131 0.100 -16.881 -0.182 1.00 0.00 H new ATOM 0 HD2 TYR A 131 3.447 -18.142 2.133 1.00 0.00 H new ATOM 0 HE1 TYR A 131 -0.215 -19.180 -0.983 1.00 0.00 H new ATOM 0 HE2 TYR A 131 3.140 -20.441 1.329 1.00 0.00 H new ATOM 0 HH TYR A 131 1.955 -21.816 0.071 1.00 0.00 H new ATOM 2044 N ASP A 132 -0.376 -17.420 3.208 1.00 0.00 N ATOM 2045 CA ASP A 132 -0.765 -18.569 4.016 1.00 0.00 C ATOM 2046 C ASP A 132 -0.923 -19.815 3.149 1.00 0.00 C ATOM 2047 O ASP A 132 -1.739 -19.860 2.228 1.00 0.00 O ATOM 2048 CB ASP A 132 -2.071 -18.279 4.758 1.00 0.00 C ATOM 2049 CG ASP A 132 -1.851 -17.482 6.028 1.00 0.00 C ATOM 2050 OD1 ASP A 132 -1.260 -16.385 5.944 1.00 0.00 O ATOM 2051 OD2 ASP A 132 -2.268 -17.955 7.106 1.00 0.00 O ATOM 0 H ASP A 132 -0.976 -17.250 2.401 1.00 0.00 H new ATOM 0 HA ASP A 132 0.024 -18.754 4.745 1.00 0.00 H new ATOM 0 HB2 ASP A 132 -2.745 -17.730 4.100 1.00 0.00 H new ATOM 0 HB3 ASP A 132 -2.562 -19.220 5.004 1.00 0.00 H new ATOM 2056 N PRO A 133 -0.125 -20.850 3.449 1.00 0.00 N ATOM 2057 CA PRO A 133 -0.157 -22.115 2.708 1.00 0.00 C ATOM 2058 C PRO A 133 -1.438 -22.902 2.963 1.00 0.00 C ATOM 2059 O PRO A 133 -1.838 -23.132 4.104 1.00 0.00 O ATOM 2060 CB PRO A 133 1.055 -22.875 3.252 1.00 0.00 C ATOM 2061 CG PRO A 133 1.277 -22.311 4.613 1.00 0.00 C ATOM 2062 CD PRO A 133 0.871 -20.865 4.534 1.00 0.00 C ATOM 0 HA PRO A 133 -0.129 -21.958 1.630 1.00 0.00 H new ATOM 0 HB2 PRO A 133 0.863 -23.947 3.294 1.00 0.00 H new ATOM 0 HB3 PRO A 133 1.929 -22.732 2.617 1.00 0.00 H new ATOM 0 HG2 PRO A 133 0.684 -22.843 5.357 1.00 0.00 H new ATOM 0 HG3 PRO A 133 2.321 -22.407 4.910 1.00 0.00 H new ATOM 0 HD2 PRO A 133 0.446 -20.515 5.475 1.00 0.00 H new ATOM 0 HD3 PRO A 133 1.721 -20.221 4.309 1.00 0.00 H new ATOM 2070 N PRO A 134 -2.097 -23.328 1.875 1.00 0.00 N ATOM 2071 CA PRO A 134 -3.342 -24.098 1.955 1.00 0.00 C ATOM 2072 C PRO A 134 -3.118 -25.508 2.491 1.00 0.00 C ATOM 2073 O PRO A 134 -2.134 -26.163 2.150 1.00 0.00 O ATOM 2074 CB PRO A 134 -3.822 -24.148 0.502 1.00 0.00 C ATOM 2075 CG PRO A 134 -2.584 -23.991 -0.311 1.00 0.00 C ATOM 2076 CD PRO A 134 -1.678 -23.091 0.483 1.00 0.00 C ATOM 0 HA PRO A 134 -4.059 -23.644 2.640 1.00 0.00 H new ATOM 0 HB2 PRO A 134 -4.323 -25.091 0.283 1.00 0.00 H new ATOM 0 HB3 PRO A 134 -4.536 -23.352 0.293 1.00 0.00 H new ATOM 0 HG2 PRO A 134 -2.112 -24.956 -0.494 1.00 0.00 H new ATOM 0 HG3 PRO A 134 -2.809 -23.557 -1.285 1.00 0.00 H new ATOM 0 HD2 PRO A 134 -0.628 -23.342 0.331 1.00 0.00 H new ATOM 0 HD3 PRO A 134 -1.800 -22.046 0.199 1.00 0.00 H new