USER MOD reduce.3.24.130724 H: found=0, std=0, add=879, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 881 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 2 GLN : amide:sc= 0.57 K(o=1.3,f=-1.1) USER MOD Set 1.2: A 20 SER OG : rot -84:sc= 0.709 USER MOD Single : A 4 THR OG1 : rot 180:sc= -0.0405 USER MOD Single : A 7 ASN : amide:sc= 0.55 K(o=0.55,f=-3.3!) USER MOD Single : A 13 SER OG : rot -66:sc= 0.691 USER MOD Single : A 18 GLN : amide:sc= 0 X(o=0,f=-0.28) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 63 SER OG : rot -77:sc= 1.09 USER MOD Single : A 64 HIS : no HD1:sc= -0.32 X(o=-0.32,f=-0.33) USER MOD Single : A 66 SER OG : rot -45:sc= 0.646 USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 81 SER OG : rot -42:sc= 0.564 USER MOD Single : A 82 GLN : amide:sc= 0.177 X(o=0.18,f=0) USER MOD Single : A 84 LYS NZ :NH3+ -177:sc= 1.08 (180deg=1.07) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 97 ASN : amide:sc= 0 X(o=0,f=-0.31) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 102 THR OG1 : rot -70:sc= 1.3 USER MOD Single : A 106 SER OG : rot 180:sc= -0.236 USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 TYR OH : rot 180:sc= 0 USER MOD Single : A 117 LYS NZ :NH3+ -150:sc= 1.01 (180deg=0.592) USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 119 TYR OH : rot 180:sc= 0 USER MOD Single : A 127 SER OG : rot 35:sc= 0.0995 USER MOD Single : A 135 ASN : amide:sc= 0 X(o=0,f=-0.46) USER MOD Single : A 136 HIS : no HE2:sc= 0.295 K(o=0.3,f=-1) USER MOD Single : A 139 THR OG1 : rot 180:sc= 0 USER MOD Single : A 141 SER OG : rot 180:sc= 0.348 USER MOD Single : A 144 ASN : amide:sc= 0.221 K(o=0.22,f=-2.5!) USER MOD ----------------------------------------------------------------- ATOM 13 N GLN A 2 -12.493 14.557 4.519 1.00 25.00 N ATOM 14 CA GLN A 2 -11.212 14.166 3.894 1.00 25.00 C ATOM 15 C GLN A 2 -10.031 15.043 4.365 1.00 25.00 C ATOM 16 O GLN A 2 -10.162 15.782 5.344 1.00 25.00 O ATOM 17 CB GLN A 2 -11.316 14.045 2.355 1.00 25.00 C ATOM 18 CG GLN A 2 -11.348 15.344 1.543 1.00 25.00 C ATOM 19 CD GLN A 2 -11.213 15.082 0.060 1.00 25.00 C ATOM 20 OE1 GLN A 2 -11.608 14.033 -0.435 1.00 25.00 O ATOM 21 NE2 GLN A 2 -10.640 16.016 -0.650 1.00 25.00 N ATOM 0 HA GLN A 2 -10.986 13.161 4.250 1.00 25.00 H new ATOM 0 HB2 GLN A 2 -10.471 13.451 2.007 1.00 25.00 H new ATOM 0 HB3 GLN A 2 -12.219 13.481 2.122 1.00 25.00 H new ATOM 0 HG2 GLN A 2 -12.283 15.870 1.736 1.00 25.00 H new ATOM 0 HG3 GLN A 2 -10.540 15.998 1.872 1.00 25.00 H new ATOM 0 HE21 GLN A 2 -10.324 16.876 -0.202 1.00 25.00 H new ATOM 0 HE22 GLN A 2 -10.508 15.886 -1.653 1.00 25.00 H new ATOM 30 N GLY A 3 -8.865 14.863 3.761 1.00 25.00 N ATOM 31 CA GLY A 3 -7.668 15.546 4.221 1.00 25.00 C ATOM 32 C GLY A 3 -7.285 16.783 3.443 1.00 25.00 C ATOM 33 O GLY A 3 -7.923 17.157 2.458 1.00 25.00 O ATOM 0 H GLY A 3 -8.724 14.253 2.956 1.00 25.00 H new ATOM 0 HA2 GLY A 3 -7.808 15.824 5.266 1.00 25.00 H new ATOM 0 HA3 GLY A 3 -6.835 14.844 4.187 1.00 25.00 H new ATOM 37 N THR A 4 -6.193 17.388 3.882 1.00 25.00 N ATOM 38 CA THR A 4 -5.584 18.549 3.234 1.00 25.00 C ATOM 39 C THR A 4 -4.145 18.117 2.943 1.00 25.00 C ATOM 40 O THR A 4 -3.791 16.976 3.213 1.00 25.00 O ATOM 41 CB THR A 4 -5.667 19.810 4.156 1.00 25.00 C ATOM 42 OG1 THR A 4 -5.006 20.919 3.541 1.00 25.00 O ATOM 43 CG2 THR A 4 -5.030 19.559 5.526 1.00 25.00 C ATOM 0 H THR A 4 -5.691 17.083 4.716 1.00 25.00 H new ATOM 0 HA THR A 4 -6.096 18.843 2.318 1.00 25.00 H new ATOM 0 HB THR A 4 -6.725 20.031 4.298 1.00 25.00 H new ATOM 0 HG1 THR A 4 -5.067 21.702 4.127 1.00 25.00 H new ATOM 0 HG21 THR A 4 -5.109 20.460 6.135 1.00 25.00 H new ATOM 0 HG22 THR A 4 -5.548 18.739 6.023 1.00 25.00 H new ATOM 0 HG23 THR A 4 -3.979 19.300 5.397 1.00 25.00 H new ATOM 51 N ASP A 5 -3.300 18.975 2.395 1.00 25.00 N ATOM 52 CA ASP A 5 -1.928 18.567 2.058 1.00 25.00 C ATOM 53 C ASP A 5 -0.970 18.641 3.242 1.00 25.00 C ATOM 54 O ASP A 5 0.201 18.272 3.154 1.00 25.00 O ATOM 55 CB ASP A 5 -1.416 19.369 0.862 1.00 25.00 C ATOM 56 CG ASP A 5 -2.008 18.878 -0.445 1.00 25.00 C ATOM 57 OD1 ASP A 5 -2.135 17.633 -0.612 1.00 25.00 O ATOM 58 OD2 ASP A 5 -2.364 19.708 -1.295 1.00 25.00 O ATOM 0 H ASP A 5 -3.526 19.945 2.173 1.00 25.00 H new ATOM 0 HA ASP A 5 -1.965 17.513 1.782 1.00 25.00 H new ATOM 0 HB2 ASP A 5 -1.662 20.422 0.999 1.00 25.00 H new ATOM 0 HB3 ASP A 5 -0.329 19.299 0.817 1.00 25.00 H new ATOM 63 N GLY A 6 -1.529 18.994 4.384 1.00 25.00 N ATOM 64 CA GLY A 6 -0.817 18.920 5.652 1.00 25.00 C ATOM 65 C GLY A 6 -0.967 17.516 6.220 1.00 25.00 C ATOM 66 O GLY A 6 -1.479 16.637 5.535 1.00 25.00 O ATOM 0 H GLY A 6 -2.486 19.339 4.462 1.00 25.00 H new ATOM 0 HA2 GLY A 6 0.237 19.157 5.507 1.00 25.00 H new ATOM 0 HA3 GLY A 6 -1.216 19.654 6.352 1.00 25.00 H new ATOM 70 N ASN A 7 -0.556 17.281 7.456 1.00 25.00 N ATOM 71 CA ASN A 7 -0.722 15.952 8.065 1.00 25.00 C ATOM 72 C ASN A 7 -2.147 15.838 8.610 1.00 25.00 C ATOM 73 O ASN A 7 -2.642 16.774 9.228 1.00 25.00 O ATOM 74 CB ASN A 7 0.272 15.745 9.216 1.00 25.00 C ATOM 75 CG ASN A 7 1.694 15.530 8.739 1.00 25.00 C ATOM 76 OD1 ASN A 7 2.001 15.632 7.560 1.00 25.00 O ATOM 77 ND2 ASN A 7 2.569 15.243 9.662 1.00 25.00 N ATOM 0 H ASN A 7 -0.111 17.975 8.057 1.00 25.00 H new ATOM 0 HA ASN A 7 -0.535 15.192 7.307 1.00 25.00 H new ATOM 0 HB2 ASN A 7 0.243 16.613 9.874 1.00 25.00 H new ATOM 0 HB3 ASN A 7 -0.041 14.885 9.808 1.00 25.00 H new ATOM 0 HD21 ASN A 7 3.546 15.095 9.410 1.00 25.00 H new ATOM 0 HD22 ASN A 7 2.276 15.166 10.636 1.00 25.00 H new ATOM 84 N ASP A 8 -2.797 14.702 8.381 1.00 25.00 N ATOM 85 CA ASP A 8 -4.183 14.485 8.819 1.00 25.00 C ATOM 86 C ASP A 8 -4.334 13.176 9.582 1.00 25.00 C ATOM 87 O ASP A 8 -3.645 12.193 9.302 1.00 25.00 O ATOM 88 CB ASP A 8 -5.121 14.390 7.611 1.00 25.00 C ATOM 89 CG ASP A 8 -5.192 15.667 6.822 1.00 25.00 C ATOM 90 OD1 ASP A 8 -5.878 16.610 7.235 1.00 50.00 O ATOM 91 OD2 ASP A 8 -4.619 15.693 5.710 1.00 50.00 O ATOM 0 H ASP A 8 -2.387 13.907 7.891 1.00 25.00 H new ATOM 0 HA ASP A 8 -4.436 15.331 9.458 1.00 25.00 H new ATOM 0 HB2 ASP A 8 -4.784 13.584 6.959 1.00 25.00 H new ATOM 0 HB3 ASP A 8 -6.121 14.125 7.954 1.00 25.00 H new ATOM 96 N VAL A 9 -5.309 13.135 10.479 1.00 25.00 N ATOM 97 CA VAL A 9 -5.712 11.895 11.140 1.00 25.00 C ATOM 98 C VAL A 9 -7.220 11.832 10.945 1.00 25.00 C ATOM 99 O VAL A 9 -7.943 12.715 11.399 1.00 25.00 O ATOM 100 CB VAL A 9 -5.351 11.881 12.654 1.00 25.00 C ATOM 101 CG1 VAL A 9 -5.828 10.572 13.312 1.00 25.00 C ATOM 102 CG2 VAL A 9 -3.827 12.036 12.842 1.00 25.00 C ATOM 0 H VAL A 9 -5.843 13.954 10.770 1.00 25.00 H new ATOM 0 HA VAL A 9 -5.191 11.036 10.717 1.00 25.00 H new ATOM 0 HB VAL A 9 -5.856 12.719 13.134 1.00 25.00 H new ATOM 0 HG11 VAL A 9 -5.567 10.580 14.370 1.00 25.00 H new ATOM 0 HG12 VAL A 9 -6.909 10.484 13.206 1.00 25.00 H new ATOM 0 HG13 VAL A 9 -5.346 9.724 12.826 1.00 25.00 H new ATOM 0 HG21 VAL A 9 -3.589 12.025 13.906 1.00 25.00 H new ATOM 0 HG22 VAL A 9 -3.314 11.212 12.346 1.00 25.00 H new ATOM 0 HG23 VAL A 9 -3.501 12.981 12.407 1.00 25.00 H new ATOM 112 N LEU A 10 -7.677 10.846 10.186 1.00 25.00 N ATOM 113 CA LEU A 10 -9.088 10.737 9.817 1.00 25.00 C ATOM 114 C LEU A 10 -9.601 9.335 10.081 1.00 25.00 C ATOM 115 O LEU A 10 -8.903 8.362 9.827 1.00 25.00 O ATOM 116 CB LEU A 10 -9.253 11.057 8.329 1.00 25.00 C ATOM 117 CG LEU A 10 -8.888 12.489 7.914 1.00 25.00 C ATOM 118 CD1 LEU A 10 -8.784 12.562 6.414 1.00 25.00 C ATOM 119 CD2 LEU A 10 -9.919 13.504 8.416 1.00 25.00 C ATOM 0 H LEU A 10 -7.089 10.103 9.809 1.00 25.00 H new ATOM 0 HA LEU A 10 -9.660 11.444 10.418 1.00 25.00 H new ATOM 0 HB2 LEU A 10 -8.637 10.364 7.756 1.00 25.00 H new ATOM 0 HB3 LEU A 10 -10.289 10.869 8.048 1.00 25.00 H new ATOM 0 HG LEU A 10 -7.929 12.741 8.367 1.00 25.00 H new ATOM 0 HD11 LEU A 10 -8.525 13.578 6.116 1.00 25.00 H new ATOM 0 HD12 LEU A 10 -8.012 11.875 6.069 1.00 25.00 H new ATOM 0 HD13 LEU A 10 -9.740 12.286 5.969 1.00 25.00 H new ATOM 0 HD21 LEU A 10 -9.626 14.506 8.102 1.00 25.00 H new ATOM 0 HD22 LEU A 10 -10.897 13.265 7.999 1.00 25.00 H new ATOM 0 HD23 LEU A 10 -9.969 13.464 9.504 1.00 25.00 H new ATOM 131 N ILE A 11 -10.831 9.245 10.567 1.00 25.00 N ATOM 132 CA ILE A 11 -11.468 7.963 10.861 1.00 25.00 C ATOM 133 C ILE A 11 -12.848 7.986 10.216 1.00 25.00 C ATOM 134 O ILE A 11 -13.584 8.963 10.376 1.00 25.00 O ATOM 135 CB ILE A 11 -11.597 7.722 12.409 1.00 25.00 C ATOM 136 CG1 ILE A 11 -10.204 7.794 13.081 1.00 25.00 C ATOM 137 CG2 ILE A 11 -12.255 6.344 12.700 1.00 25.00 C ATOM 138 CD1 ILE A 11 -10.233 7.783 14.624 1.00 25.00 C ATOM 0 H ILE A 11 -11.417 10.055 10.769 1.00 25.00 H new ATOM 0 HA ILE A 11 -10.860 7.150 10.465 1.00 25.00 H new ATOM 0 HB ILE A 11 -12.233 8.504 12.823 1.00 25.00 H new ATOM 0 HG12 ILE A 11 -9.605 6.951 12.736 1.00 25.00 H new ATOM 0 HG13 ILE A 11 -9.700 8.701 12.747 1.00 25.00 H new ATOM 0 HG21 ILE A 11 -12.334 6.199 13.777 1.00 25.00 H new ATOM 0 HG22 ILE A 11 -13.250 6.315 12.256 1.00 25.00 H new ATOM 0 HG23 ILE A 11 -11.643 5.551 12.271 1.00 25.00 H new ATOM 0 HD11 ILE A 11 -9.214 7.836 15.007 1.00 25.00 H new ATOM 0 HD12 ILE A 11 -10.801 8.641 14.983 1.00 25.00 H new ATOM 0 HD13 ILE A 11 -10.704 6.864 14.973 1.00 25.00 H new ATOM 150 N GLY A 12 -13.170 6.946 9.461 1.00 25.00 N ATOM 151 CA GLY A 12 -14.450 6.865 8.781 1.00 25.00 C ATOM 152 C GLY A 12 -15.551 6.274 9.639 1.00 25.00 C ATOM 153 O GLY A 12 -15.363 5.972 10.813 1.00 25.00 O ATOM 0 H GLY A 12 -12.559 6.145 9.305 1.00 25.00 H new ATOM 0 HA2 GLY A 12 -14.746 7.864 8.460 1.00 25.00 H new ATOM 0 HA3 GLY A 12 -14.337 6.261 7.881 1.00 25.00 H new ATOM 157 N SER A 13 -16.710 6.109 9.028 1.00 25.00 N ATOM 158 CA SER A 13 -17.895 5.559 9.680 1.00 25.00 C ATOM 159 C SER A 13 -18.253 4.213 9.048 1.00 25.00 C ATOM 160 O SER A 13 -17.575 3.745 8.139 1.00 25.00 O ATOM 161 CB SER A 13 -19.048 6.547 9.529 1.00 25.00 C ATOM 162 OG SER A 13 -19.331 6.775 8.164 1.00 25.00 O ATOM 0 H SER A 13 -16.862 6.356 8.050 1.00 25.00 H new ATOM 0 HA SER A 13 -17.698 5.400 10.740 1.00 25.00 H new ATOM 0 HB2 SER A 13 -19.935 6.159 10.030 1.00 25.00 H new ATOM 0 HB3 SER A 13 -18.793 7.489 10.016 1.00 25.00 H new ATOM 0 HG SER A 13 -18.572 7.232 7.744 1.00 25.00 H new ATOM 168 N ASP A 14 -19.312 3.582 9.526 1.00 25.00 N ATOM 169 CA ASP A 14 -19.690 2.242 9.063 1.00 25.00 C ATOM 170 C ASP A 14 -20.312 2.184 7.666 1.00 25.00 C ATOM 171 O ASP A 14 -20.433 1.110 7.083 1.00 25.00 O ATOM 172 CB ASP A 14 -20.664 1.625 10.066 1.00 25.00 C ATOM 173 CG ASP A 14 -20.030 1.418 11.420 1.00 25.00 C ATOM 174 OD1 ASP A 14 -18.927 0.832 11.481 1.00 25.00 O ATOM 175 OD2 ASP A 14 -20.602 1.903 12.418 1.00 25.00 O ATOM 0 H ASP A 14 -19.932 3.971 10.237 1.00 25.00 H new ATOM 0 HA ASP A 14 -18.757 1.682 8.993 1.00 25.00 H new ATOM 0 HB2 ASP A 14 -21.535 2.272 10.169 1.00 25.00 H new ATOM 0 HB3 ASP A 14 -21.020 0.669 9.683 1.00 25.00 H new ATOM 180 N VAL A 15 -20.689 3.328 7.110 1.00 25.00 N ATOM 181 CA VAL A 15 -21.254 3.364 5.758 1.00 25.00 C ATOM 182 C VAL A 15 -20.113 3.413 4.741 1.00 25.00 C ATOM 183 O VAL A 15 -18.953 3.628 5.114 1.00 25.00 O ATOM 184 CB VAL A 15 -22.208 4.585 5.554 1.00 25.00 C ATOM 185 CG1 VAL A 15 -23.404 4.489 6.519 1.00 25.00 C ATOM 186 CG2 VAL A 15 -21.480 5.915 5.767 1.00 25.00 C ATOM 0 H VAL A 15 -20.617 4.238 7.565 1.00 25.00 H new ATOM 0 HA VAL A 15 -21.850 2.463 5.613 1.00 25.00 H new ATOM 0 HB VAL A 15 -22.563 4.556 4.524 1.00 25.00 H new ATOM 0 HG11 VAL A 15 -24.062 5.345 6.369 1.00 25.00 H new ATOM 0 HG12 VAL A 15 -23.955 3.569 6.325 1.00 25.00 H new ATOM 0 HG13 VAL A 15 -23.042 4.486 7.547 1.00 25.00 H new ATOM 0 HG21 VAL A 15 -22.177 6.739 5.616 1.00 25.00 H new ATOM 0 HG22 VAL A 15 -21.085 5.955 6.782 1.00 25.00 H new ATOM 0 HG23 VAL A 15 -20.659 5.999 5.055 1.00 25.00 H new ATOM 196 N GLY A 16 -20.428 3.212 3.469 1.00 25.00 N ATOM 197 CA GLY A 16 -19.408 3.296 2.433 1.00 25.00 C ATOM 198 C GLY A 16 -18.975 4.734 2.218 1.00 25.00 C ATOM 199 O GLY A 16 -19.815 5.635 2.253 1.00 25.00 O ATOM 0 H GLY A 16 -21.366 2.993 3.133 1.00 25.00 H new ATOM 0 HA2 GLY A 16 -18.547 2.690 2.715 1.00 25.00 H new ATOM 0 HA3 GLY A 16 -19.795 2.885 1.501 1.00 25.00 H new ATOM 203 N GLU A 17 -17.679 4.964 2.061 1.00 25.00 N ATOM 204 CA GLU A 17 -17.125 6.321 1.984 1.00 25.00 C ATOM 205 C GLU A 17 -15.974 6.415 0.983 1.00 25.00 C ATOM 206 O GLU A 17 -15.370 5.417 0.610 1.00 25.00 O ATOM 207 CB GLU A 17 -16.577 6.736 3.359 1.00 25.00 C ATOM 208 CG GLU A 17 -17.629 6.898 4.443 1.00 25.00 C ATOM 209 CD GLU A 17 -17.041 6.779 5.824 1.00 25.00 C ATOM 210 OE1 GLU A 17 -16.468 5.708 6.125 1.00 50.00 O ATOM 211 OE2 GLU A 17 -17.211 7.696 6.647 1.00 50.00 O ATOM 0 H GLU A 17 -16.981 4.225 1.983 1.00 25.00 H new ATOM 0 HA GLU A 17 -17.934 6.976 1.661 1.00 25.00 H new ATOM 0 HB2 GLU A 17 -15.852 5.991 3.685 1.00 25.00 H new ATOM 0 HB3 GLU A 17 -16.039 7.678 3.251 1.00 25.00 H new ATOM 0 HG2 GLU A 17 -18.111 7.870 4.337 1.00 25.00 H new ATOM 0 HG3 GLU A 17 -18.403 6.142 4.312 1.00 25.00 H new ATOM 218 N GLN A 18 -15.635 7.645 0.624 1.00 25.00 N ATOM 219 CA GLN A 18 -14.478 7.933 -0.220 1.00 25.00 C ATOM 220 C GLN A 18 -13.655 8.970 0.539 1.00 25.00 C ATOM 221 O GLN A 18 -14.138 10.073 0.813 1.00 25.00 O ATOM 222 CB GLN A 18 -14.941 8.472 -1.578 1.00 25.00 C ATOM 223 CG GLN A 18 -13.810 8.788 -2.548 1.00 25.00 C ATOM 224 CD GLN A 18 -14.333 9.292 -3.872 1.00 25.00 C ATOM 225 OE1 GLN A 18 -14.607 8.523 -4.776 1.00 25.00 O ATOM 226 NE2 GLN A 18 -14.496 10.586 -3.985 1.00 25.00 N ATOM 0 H GLN A 18 -16.154 8.475 0.909 1.00 25.00 H new ATOM 0 HA GLN A 18 -13.885 7.041 -0.422 1.00 25.00 H new ATOM 0 HB2 GLN A 18 -15.605 7.740 -2.039 1.00 25.00 H new ATOM 0 HB3 GLN A 18 -15.527 9.376 -1.416 1.00 25.00 H new ATOM 0 HG2 GLN A 18 -13.152 9.537 -2.108 1.00 25.00 H new ATOM 0 HG3 GLN A 18 -13.210 7.893 -2.711 1.00 25.00 H new ATOM 0 HE21 GLN A 18 -14.256 11.200 -3.207 1.00 25.00 H new ATOM 0 HE22 GLN A 18 -14.863 10.980 -4.851 1.00 25.00 H new ATOM 235 N ILE A 19 -12.455 8.593 0.954 1.00 25.00 N ATOM 236 CA ILE A 19 -11.612 9.449 1.791 1.00 25.00 C ATOM 237 C ILE A 19 -10.228 9.564 1.163 1.00 25.00 C ATOM 238 O ILE A 19 -9.552 8.566 0.946 1.00 25.00 O ATOM 239 CB ILE A 19 -11.456 8.856 3.238 1.00 25.00 C ATOM 240 CG1 ILE A 19 -12.845 8.597 3.876 1.00 25.00 C ATOM 241 CG2 ILE A 19 -10.624 9.824 4.139 1.00 25.00 C ATOM 242 CD1 ILE A 19 -12.807 7.825 5.213 1.00 25.00 C ATOM 0 H ILE A 19 -12.036 7.692 0.725 1.00 25.00 H new ATOM 0 HA ILE A 19 -12.088 10.427 1.860 1.00 25.00 H new ATOM 0 HB ILE A 19 -10.927 7.906 3.161 1.00 25.00 H new ATOM 0 HG12 ILE A 19 -13.339 9.555 4.039 1.00 25.00 H new ATOM 0 HG13 ILE A 19 -13.457 8.039 3.167 1.00 25.00 H new ATOM 0 HG21 ILE A 19 -10.526 9.398 5.137 1.00 25.00 H new ATOM 0 HG22 ILE A 19 -9.634 9.964 3.705 1.00 25.00 H new ATOM 0 HG23 ILE A 19 -11.131 10.787 4.204 1.00 25.00 H new ATOM 0 HD11 ILE A 19 -13.823 7.690 5.584 1.00 25.00 H new ATOM 0 HD12 ILE A 19 -12.345 6.850 5.057 1.00 25.00 H new ATOM 0 HD13 ILE A 19 -12.226 8.389 5.942 1.00 25.00 H new ATOM 254 N SER A 20 -9.788 10.784 0.900 1.00 25.00 N ATOM 255 CA SER A 20 -8.452 11.005 0.361 1.00 25.00 C ATOM 256 C SER A 20 -7.602 11.744 1.383 1.00 25.00 C ATOM 257 O SER A 20 -8.083 12.637 2.080 1.00 25.00 O ATOM 258 CB SER A 20 -8.516 11.786 -0.955 1.00 25.00 C ATOM 259 OG SER A 20 -9.015 13.093 -0.755 1.00 25.00 O ATOM 0 H SER A 20 -10.332 11.634 1.049 1.00 25.00 H new ATOM 0 HA SER A 20 -7.994 10.038 0.152 1.00 25.00 H new ATOM 0 HB2 SER A 20 -7.521 11.838 -1.398 1.00 25.00 H new ATOM 0 HB3 SER A 20 -9.153 11.256 -1.664 1.00 25.00 H new ATOM 0 HG SER A 20 -9.995 13.074 -0.763 1.00 25.00 H new ATOM 265 N GLY A 21 -6.344 11.346 1.498 1.00 25.00 N ATOM 266 CA GLY A 21 -5.442 11.959 2.459 1.00 25.00 C ATOM 267 C GLY A 21 -4.617 13.093 1.888 1.00 25.00 C ATOM 268 O GLY A 21 -4.175 13.962 2.633 1.00 25.00 O ATOM 0 H GLY A 21 -5.926 10.603 0.939 1.00 25.00 H new ATOM 0 HA2 GLY A 21 -6.024 12.334 3.301 1.00 25.00 H new ATOM 0 HA3 GLY A 21 -4.770 11.195 2.851 1.00 25.00 H new ATOM 272 N GLY A 22 -4.378 13.088 0.586 1.00 25.00 N ATOM 273 CA GLY A 22 -3.551 14.120 -0.033 1.00 25.00 C ATOM 274 C GLY A 22 -2.087 13.995 0.366 1.00 25.00 C ATOM 275 O GLY A 22 -1.641 12.920 0.801 1.00 25.00 O ATOM 0 H GLY A 22 -4.740 12.388 -0.061 1.00 25.00 H new ATOM 0 HA2 GLY A 22 -3.638 14.052 -1.117 1.00 25.00 H new ATOM 0 HA3 GLY A 22 -3.922 15.103 0.255 1.00 25.00 H new ATOM 279 N ALA A 23 -1.325 15.073 0.247 1.00 25.00 N ATOM 280 CA ALA A 23 0.084 15.063 0.643 1.00 25.00 C ATOM 281 C ALA A 23 0.193 15.024 2.173 1.00 25.00 C ATOM 282 O ALA A 23 -0.819 14.977 2.877 1.00 25.00 O ATOM 283 CB ALA A 23 0.809 16.289 0.075 1.00 25.00 C ATOM 0 H ALA A 23 -1.654 15.966 -0.119 1.00 25.00 H new ATOM 0 HA ALA A 23 0.562 14.172 0.237 1.00 25.00 H new ATOM 0 HB1 ALA A 23 1.856 16.266 0.379 1.00 25.00 H new ATOM 0 HB2 ALA A 23 0.747 16.277 -1.013 1.00 25.00 H new ATOM 0 HB3 ALA A 23 0.341 17.197 0.455 1.00 25.00 H new ATOM 289 N GLY A 24 1.415 15.003 2.679 1.00 25.00 N ATOM 290 CA GLY A 24 1.637 14.926 4.116 1.00 25.00 C ATOM 291 C GLY A 24 1.531 13.504 4.634 1.00 25.00 C ATOM 292 O GLY A 24 1.063 12.600 3.926 1.00 25.00 O ATOM 0 H GLY A 24 2.267 15.038 2.119 1.00 25.00 H new ATOM 0 HA2 GLY A 24 2.624 15.325 4.352 1.00 25.00 H new ATOM 0 HA3 GLY A 24 0.908 15.554 4.629 1.00 25.00 H new ATOM 296 N ASP A 25 1.970 13.300 5.864 1.00 25.00 N ATOM 297 CA ASP A 25 1.952 11.981 6.499 1.00 25.00 C ATOM 298 C ASP A 25 0.615 11.839 7.206 1.00 25.00 C ATOM 299 O ASP A 25 0.319 12.584 8.140 1.00 25.00 O ATOM 300 CB ASP A 25 3.087 11.849 7.518 1.00 25.00 C ATOM 301 CG ASP A 25 4.448 11.678 6.866 1.00 25.00 C ATOM 302 OD1 ASP A 25 4.552 11.662 5.612 1.00 25.00 O ATOM 303 OD2 ASP A 25 5.432 11.492 7.621 1.00 25.00 O ATOM 0 H ASP A 25 2.350 14.039 6.455 1.00 25.00 H new ATOM 0 HA ASP A 25 2.088 11.203 5.747 1.00 25.00 H new ATOM 0 HB2 ASP A 25 3.103 12.734 8.154 1.00 25.00 H new ATOM 0 HB3 ASP A 25 2.890 10.995 8.166 1.00 25.00 H new ATOM 308 N ASP A 26 -0.217 10.932 6.721 1.00 25.00 N ATOM 309 CA ASP A 26 -1.592 10.825 7.193 1.00 25.00 C ATOM 310 C ASP A 26 -1.923 9.482 7.814 1.00 25.00 C ATOM 311 O ASP A 26 -1.236 8.478 7.588 1.00 25.00 O ATOM 312 CB ASP A 26 -2.542 11.044 6.016 1.00 25.00 C ATOM 313 CG ASP A 26 -2.262 12.325 5.282 1.00 25.00 C ATOM 314 OD1 ASP A 26 -2.170 13.384 5.920 1.00 50.00 O ATOM 315 OD2 ASP A 26 -2.148 12.302 4.035 1.00 50.00 O ATOM 0 H ASP A 26 0.034 10.257 5.999 1.00 25.00 H new ATOM 0 HA ASP A 26 -1.709 11.583 7.968 1.00 25.00 H new ATOM 0 HB2 ASP A 26 -2.457 10.206 5.324 1.00 25.00 H new ATOM 0 HB3 ASP A 26 -3.570 11.054 6.379 1.00 25.00 H new ATOM 320 N ARG A 27 -3.033 9.447 8.539 1.00 25.00 N ATOM 321 CA ARG A 27 -3.583 8.203 9.061 1.00 25.00 C ATOM 322 C ARG A 27 -5.034 8.187 8.640 1.00 25.00 C ATOM 323 O ARG A 27 -5.796 9.055 9.041 1.00 25.00 O ATOM 324 CB ARG A 27 -3.470 8.141 10.585 1.00 25.00 C ATOM 325 CG ARG A 27 -2.040 8.214 11.090 1.00 25.00 C ATOM 326 CD ARG A 27 -1.979 7.871 12.564 1.00 25.00 C ATOM 327 NE ARG A 27 -0.625 8.081 13.110 1.00 25.00 N ATOM 328 CZ ARG A 27 -0.215 7.681 14.309 1.00 25.00 C ATOM 329 NH1 ARG A 27 -0.996 7.028 15.133 1.00 25.00 N ATOM 330 NH2 ARG A 27 1.005 7.941 14.683 1.00 25.00 N ATOM 0 H ARG A 27 -3.576 10.276 8.781 1.00 25.00 H new ATOM 0 HA ARG A 27 -3.037 7.342 8.675 1.00 25.00 H new ATOM 0 HB2 ARG A 27 -4.042 8.962 11.017 1.00 25.00 H new ATOM 0 HB3 ARG A 27 -3.925 7.215 10.938 1.00 25.00 H new ATOM 0 HG2 ARG A 27 -1.413 7.525 10.524 1.00 25.00 H new ATOM 0 HG3 ARG A 27 -1.641 9.215 10.927 1.00 25.00 H new ATOM 0 HD2 ARG A 27 -2.693 8.486 13.112 1.00 25.00 H new ATOM 0 HD3 ARG A 27 -2.275 6.832 12.710 1.00 25.00 H new ATOM 0 HE ARG A 27 0.049 8.571 12.522 1.00 25.00 H new ATOM 0 HH11 ARG A 27 -1.955 6.810 14.862 1.00 25.00 H new ATOM 0 HH12 ARG A 27 -0.645 6.737 16.046 1.00 25.00 H new ATOM 0 HH21 ARG A 27 1.633 8.446 14.058 1.00 25.00 H new ATOM 0 HH22 ARG A 27 1.332 7.640 15.601 1.00 25.00 H new ATOM 344 N LEU A 28 -5.383 7.247 7.783 1.00 25.00 N ATOM 345 CA LEU A 28 -6.735 7.119 7.266 1.00 25.00 C ATOM 346 C LEU A 28 -7.285 5.832 7.840 1.00 25.00 C ATOM 347 O LEU A 28 -6.583 4.825 7.876 1.00 25.00 O ATOM 348 CB LEU A 28 -6.742 7.014 5.727 1.00 25.00 C ATOM 349 CG LEU A 28 -6.244 8.175 4.839 1.00 25.00 C ATOM 350 CD1 LEU A 28 -6.681 9.533 5.379 1.00 25.00 C ATOM 351 CD2 LEU A 28 -4.718 8.152 4.653 1.00 25.00 C ATOM 0 H LEU A 28 -4.735 6.547 7.423 1.00 25.00 H new ATOM 0 HA LEU A 28 -7.326 7.992 7.542 1.00 25.00 H new ATOM 0 HB2 LEU A 28 -6.148 6.138 5.466 1.00 25.00 H new ATOM 0 HB3 LEU A 28 -7.769 6.804 5.428 1.00 25.00 H new ATOM 0 HG LEU A 28 -6.707 8.026 3.864 1.00 25.00 H new ATOM 0 HD11 LEU A 28 -6.310 10.321 4.724 1.00 25.00 H new ATOM 0 HD12 LEU A 28 -7.769 9.576 5.418 1.00 25.00 H new ATOM 0 HD13 LEU A 28 -6.277 9.673 6.381 1.00 25.00 H new ATOM 0 HD21 LEU A 28 -4.416 8.987 4.021 1.00 25.00 H new ATOM 0 HD22 LEU A 28 -4.232 8.237 5.625 1.00 25.00 H new ATOM 0 HD23 LEU A 28 -4.423 7.215 4.181 1.00 25.00 H new ATOM 363 N ASP A 29 -8.541 5.849 8.233 1.00 25.00 N ATOM 364 CA ASP A 29 -9.231 4.650 8.677 1.00 25.00 C ATOM 365 C ASP A 29 -10.586 4.703 7.994 1.00 25.00 C ATOM 366 O ASP A 29 -11.183 5.769 7.895 1.00 25.00 O ATOM 367 CB ASP A 29 -9.364 4.627 10.205 1.00 25.00 C ATOM 368 CG ASP A 29 -9.780 3.266 10.737 1.00 25.00 C ATOM 369 OD1 ASP A 29 -10.678 2.623 10.147 1.00 25.00 O ATOM 370 OD2 ASP A 29 -9.181 2.827 11.737 1.00 25.00 O ATOM 0 H ASP A 29 -9.115 6.692 8.255 1.00 25.00 H new ATOM 0 HA ASP A 29 -8.689 3.741 8.418 1.00 25.00 H new ATOM 0 HB2 ASP A 29 -8.412 4.912 10.653 1.00 25.00 H new ATOM 0 HB3 ASP A 29 -10.097 5.373 10.513 1.00 25.00 H new ATOM 375 N GLY A 30 -11.017 3.580 7.454 1.00 25.00 N ATOM 376 CA GLY A 30 -12.256 3.510 6.705 1.00 25.00 C ATOM 377 C GLY A 30 -13.410 2.956 7.509 1.00 25.00 C ATOM 378 O GLY A 30 -14.569 3.160 7.150 1.00 25.00 O ATOM 0 H GLY A 30 -10.519 2.692 7.522 1.00 25.00 H new ATOM 0 HA2 GLY A 30 -12.515 4.508 6.350 1.00 25.00 H new ATOM 0 HA3 GLY A 30 -12.105 2.888 5.823 1.00 25.00 H new ATOM 382 N GLY A 31 -13.118 2.229 8.576 1.00 25.00 N ATOM 383 CA GLY A 31 -14.167 1.573 9.343 1.00 25.00 C ATOM 384 C GLY A 31 -14.882 0.506 8.527 1.00 25.00 C ATOM 385 O GLY A 31 -14.355 0.002 7.517 1.00 25.00 O ATOM 0 H GLY A 31 -12.173 2.079 8.929 1.00 25.00 H new ATOM 0 HA2 GLY A 31 -13.735 1.119 10.235 1.00 25.00 H new ATOM 0 HA3 GLY A 31 -14.889 2.316 9.681 1.00 25.00 H new ATOM 389 N ALA A 32 -16.095 0.153 8.929 1.00 25.00 N ATOM 390 CA ALA A 32 -16.877 -0.838 8.194 1.00 25.00 C ATOM 391 C ALA A 32 -17.403 -0.230 6.880 1.00 25.00 C ATOM 392 O ALA A 32 -17.208 0.961 6.600 1.00 25.00 O ATOM 393 CB ALA A 32 -18.034 -1.347 9.062 1.00 25.00 C ATOM 0 H ALA A 32 -16.559 0.534 9.754 1.00 25.00 H new ATOM 0 HA ALA A 32 -16.236 -1.685 7.947 1.00 25.00 H new ATOM 0 HB1 ALA A 32 -18.610 -2.085 8.504 1.00 25.00 H new ATOM 0 HB2 ALA A 32 -17.635 -1.806 9.967 1.00 25.00 H new ATOM 0 HB3 ALA A 32 -18.680 -0.512 9.333 1.00 25.00 H new ATOM 399 N GLY A 33 -18.038 -1.065 6.071 1.00 25.00 N ATOM 400 CA GLY A 33 -18.551 -0.631 4.781 1.00 25.00 C ATOM 401 C GLY A 33 -17.463 -0.662 3.728 1.00 25.00 C ATOM 402 O GLY A 33 -16.276 -0.766 4.056 1.00 25.00 O ATOM 0 H GLY A 33 -18.210 -2.047 6.286 1.00 25.00 H new ATOM 0 HA2 GLY A 33 -19.375 -1.276 4.477 1.00 25.00 H new ATOM 0 HA3 GLY A 33 -18.952 0.379 4.866 1.00 25.00 H new ATOM 406 N ASP A 34 -17.856 -0.597 2.469 1.00 0.00 N ATOM 407 CA ASP A 34 -16.906 -0.650 1.361 1.00 25.00 C ATOM 408 C ASP A 34 -16.352 0.759 1.157 1.00 25.00 C ATOM 409 O ASP A 34 -17.122 1.711 1.098 1.00 25.00 O ATOM 410 CB ASP A 34 -17.612 -1.137 0.092 1.00 25.00 C ATOM 411 CG ASP A 34 -18.182 -2.544 0.241 1.00 25.00 C ATOM 412 OD1 ASP A 34 -17.690 -3.323 1.096 1.00 25.00 O ATOM 413 OD2 ASP A 34 -19.171 -2.846 -0.452 1.00 25.00 O ATOM 0 H ASP A 34 -18.831 -0.507 2.182 1.00 0.00 H new ATOM 0 HA ASP A 34 -16.095 -1.344 1.581 1.00 25.00 H new ATOM 0 HB2 ASP A 34 -18.418 -0.447 -0.158 1.00 25.00 H new ATOM 0 HB3 ASP A 34 -16.908 -1.120 -0.740 1.00 25.00 H new ATOM 418 N ASP A 35 -15.035 0.917 1.153 1.00 25.00 N ATOM 419 CA ASP A 35 -14.436 2.261 1.149 1.00 25.00 C ATOM 420 C ASP A 35 -13.343 2.466 0.106 1.00 25.00 C ATOM 421 O ASP A 35 -12.608 1.543 -0.245 1.00 25.00 O ATOM 422 CB ASP A 35 -13.828 2.562 2.524 1.00 25.00 C ATOM 423 CG ASP A 35 -14.849 2.497 3.639 1.00 25.00 C ATOM 424 OD1 ASP A 35 -15.836 3.259 3.621 1.00 50.00 O ATOM 425 OD2 ASP A 35 -14.640 1.723 4.606 1.00 50.00 O ATOM 0 H ASP A 35 -14.363 0.149 1.152 1.00 25.00 H new ATOM 0 HA ASP A 35 -15.255 2.936 0.899 1.00 25.00 H new ATOM 0 HB2 ASP A 35 -13.028 1.850 2.727 1.00 25.00 H new ATOM 0 HB3 ASP A 35 -13.376 3.554 2.508 1.00 25.00 H new ATOM 430 N LEU A 36 -13.198 3.707 -0.332 1.00 25.00 N ATOM 431 CA LEU A 36 -12.123 4.102 -1.236 1.00 25.00 C ATOM 432 C LEU A 36 -11.167 4.981 -0.440 1.00 25.00 C ATOM 433 O LEU A 36 -11.580 6.024 0.076 1.00 25.00 O ATOM 434 CB LEU A 36 -12.667 4.899 -2.430 1.00 25.00 C ATOM 435 CG LEU A 36 -13.659 4.195 -3.372 1.00 25.00 C ATOM 436 CD1 LEU A 36 -15.117 4.465 -2.980 1.00 25.00 C ATOM 437 CD2 LEU A 36 -13.427 4.680 -4.804 1.00 25.00 C ATOM 0 H LEU A 36 -13.822 4.471 -0.072 1.00 25.00 H new ATOM 0 HA LEU A 36 -11.625 3.215 -1.628 1.00 25.00 H new ATOM 0 HB2 LEU A 36 -13.152 5.794 -2.041 1.00 25.00 H new ATOM 0 HB3 LEU A 36 -11.817 5.230 -3.026 1.00 25.00 H new ATOM 0 HG LEU A 36 -13.485 3.122 -3.295 1.00 25.00 H new ATOM 0 HD11 LEU A 36 -15.782 3.948 -3.672 1.00 25.00 H new ATOM 0 HD12 LEU A 36 -15.295 4.102 -1.968 1.00 25.00 H new ATOM 0 HD13 LEU A 36 -15.312 5.537 -3.021 1.00 25.00 H new ATOM 0 HD21 LEU A 36 -14.128 4.183 -5.475 1.00 25.00 H new ATOM 0 HD22 LEU A 36 -13.580 5.758 -4.852 1.00 25.00 H new ATOM 0 HD23 LEU A 36 -12.407 4.445 -5.107 1.00 25.00 H new ATOM 449 N LEU A 37 -9.918 4.554 -0.302 1.00 25.00 N ATOM 450 CA LEU A 37 -8.929 5.293 0.491 1.00 25.00 C ATOM 451 C LEU A 37 -7.684 5.646 -0.331 1.00 25.00 C ATOM 452 O LEU A 37 -6.926 4.775 -0.757 1.00 25.00 O ATOM 453 CB LEU A 37 -8.516 4.474 1.717 1.00 25.00 C ATOM 454 CG LEU A 37 -9.133 4.854 3.080 1.00 25.00 C ATOM 455 CD1 LEU A 37 -10.642 4.633 3.132 1.00 25.00 C ATOM 456 CD2 LEU A 37 -8.468 4.025 4.184 1.00 25.00 C ATOM 0 H LEU A 37 -9.560 3.699 -0.728 1.00 25.00 H new ATOM 0 HA LEU A 37 -9.399 6.224 0.809 1.00 25.00 H new ATOM 0 HB2 LEU A 37 -8.759 3.430 1.519 1.00 25.00 H new ATOM 0 HB3 LEU A 37 -7.432 4.537 1.811 1.00 25.00 H new ATOM 0 HG LEU A 37 -8.956 5.919 3.227 1.00 25.00 H new ATOM 0 HD11 LEU A 37 -11.018 4.918 4.115 1.00 25.00 H new ATOM 0 HD12 LEU A 37 -11.125 5.242 2.368 1.00 25.00 H new ATOM 0 HD13 LEU A 37 -10.862 3.581 2.950 1.00 25.00 H new ATOM 0 HD21 LEU A 37 -8.901 4.290 5.149 1.00 25.00 H new ATOM 0 HD22 LEU A 37 -8.632 2.965 3.992 1.00 25.00 H new ATOM 0 HD23 LEU A 37 -7.397 4.230 4.198 1.00 25.00 H new ATOM 468 N ASP A 38 -7.460 6.934 -0.520 1.00 25.00 N ATOM 469 CA ASP A 38 -6.307 7.419 -1.293 1.00 25.00 C ATOM 470 C ASP A 38 -5.242 7.957 -0.344 1.00 25.00 C ATOM 471 O ASP A 38 -5.468 8.938 0.370 1.00 25.00 O ATOM 472 CB ASP A 38 -6.720 8.536 -2.263 1.00 25.00 C ATOM 473 CG ASP A 38 -7.389 8.007 -3.526 1.00 25.00 C ATOM 474 OD1 ASP A 38 -8.373 7.247 -3.430 1.00 25.00 O ATOM 475 OD2 ASP A 38 -6.936 8.386 -4.628 1.00 25.00 O ATOM 0 H ASP A 38 -8.058 7.674 -0.151 1.00 25.00 H new ATOM 0 HA ASP A 38 -5.912 6.582 -1.869 1.00 25.00 H new ATOM 0 HB2 ASP A 38 -7.402 9.218 -1.755 1.00 25.00 H new ATOM 0 HB3 ASP A 38 -5.839 9.114 -2.540 1.00 25.00 H new ATOM 480 N GLY A 39 -4.077 7.322 -0.316 1.00 25.00 N ATOM 481 CA GLY A 39 -3.029 7.729 0.613 1.00 25.00 C ATOM 482 C GLY A 39 -2.379 9.053 0.258 1.00 25.00 C ATOM 483 O GLY A 39 -2.141 9.910 1.130 1.00 25.00 O ATOM 0 H GLY A 39 -3.835 6.534 -0.917 1.00 25.00 H new ATOM 0 HA2 GLY A 39 -3.452 7.799 1.615 1.00 25.00 H new ATOM 0 HA3 GLY A 39 -2.262 6.955 0.644 1.00 25.00 H new ATOM 487 N GLY A 40 -2.073 9.230 -1.018 1.00 25.00 N ATOM 488 CA GLY A 40 -1.424 10.447 -1.478 1.00 25.00 C ATOM 489 C GLY A 40 0.052 10.498 -1.111 1.00 25.00 C ATOM 490 O GLY A 40 0.573 9.607 -0.436 1.00 25.00 O ATOM 0 H GLY A 40 -2.263 8.548 -1.752 1.00 25.00 H new ATOM 0 HA2 GLY A 40 -1.528 10.523 -2.560 1.00 25.00 H new ATOM 0 HA3 GLY A 40 -1.932 11.310 -1.047 1.00 25.00 H new ATOM 494 N ALA A 41 0.737 11.560 -1.521 1.00 25.00 N ATOM 495 CA ALA A 41 2.159 11.722 -1.207 1.00 25.00 C ATOM 496 C ALA A 41 2.379 11.697 0.317 1.00 25.00 C ATOM 497 O ALA A 41 1.460 11.985 1.092 1.00 25.00 O ATOM 498 CB ALA A 41 2.680 13.033 -1.811 1.00 25.00 C ATOM 0 H ALA A 41 0.336 12.321 -2.070 1.00 25.00 H new ATOM 0 HA ALA A 41 2.716 10.892 -1.642 1.00 25.00 H new ATOM 0 HB1 ALA A 41 3.738 13.148 -1.574 1.00 25.00 H new ATOM 0 HB2 ALA A 41 2.551 13.012 -2.893 1.00 25.00 H new ATOM 0 HB3 ALA A 41 2.122 13.872 -1.395 1.00 25.00 H new ATOM 504 N GLY A 42 3.582 11.321 0.733 1.00 25.00 N ATOM 505 CA GLY A 42 3.893 11.179 2.151 1.00 25.00 C ATOM 506 C GLY A 42 3.764 9.727 2.577 1.00 25.00 C ATOM 507 O GLY A 42 3.325 8.889 1.777 1.00 25.00 O ATOM 0 H GLY A 42 4.360 11.109 0.108 1.00 25.00 H new ATOM 0 HA2 GLY A 42 4.905 11.533 2.345 1.00 25.00 H new ATOM 0 HA3 GLY A 42 3.219 11.799 2.742 1.00 25.00 H new ATOM 511 N ARG A 43 4.156 9.413 3.806 1.00 25.00 N ATOM 512 CA ARG A 43 4.103 8.031 4.317 1.00 25.00 C ATOM 513 C ARG A 43 2.843 7.902 5.166 1.00 25.00 C ATOM 514 O ARG A 43 2.630 8.661 6.109 1.00 25.00 O ATOM 515 CB ARG A 43 5.389 7.670 5.097 1.00 25.00 C ATOM 516 CG ARG A 43 5.731 8.605 6.244 1.00 25.00 C ATOM 517 CD ARG A 43 7.080 8.329 6.893 1.00 25.00 C ATOM 518 NE ARG A 43 8.220 8.795 6.081 1.00 25.00 N ATOM 519 CZ ARG A 43 8.652 10.051 5.999 1.00 25.00 C ATOM 520 NH1 ARG A 43 8.064 11.056 6.596 1.00 25.00 N ATOM 521 NH2 ARG A 43 9.712 10.295 5.286 1.00 25.00 N ATOM 0 H ARG A 43 4.516 10.092 4.476 1.00 25.00 H new ATOM 0 HA ARG A 43 4.056 7.318 3.494 1.00 25.00 H new ATOM 0 HB2 ARG A 43 5.284 6.659 5.492 1.00 25.00 H new ATOM 0 HB3 ARG A 43 6.226 7.655 4.399 1.00 25.00 H new ATOM 0 HG2 ARG A 43 5.720 9.631 5.877 1.00 25.00 H new ATOM 0 HG3 ARG A 43 4.953 8.530 7.004 1.00 25.00 H new ATOM 0 HD2 ARG A 43 7.113 8.815 7.868 1.00 25.00 H new ATOM 0 HD3 ARG A 43 7.180 7.258 7.067 1.00 25.00 H new ATOM 0 HE ARG A 43 8.721 8.094 5.535 1.00 25.00 H new ATOM 0 HH11 ARG A 43 7.229 10.897 7.160 1.00 25.00 H new ATOM 0 HH12 ARG A 43 8.440 11.999 6.497 1.00 25.00 H new ATOM 0 HH21 ARG A 43 10.191 9.533 4.807 1.00 25.00 H new ATOM 0 HH22 ARG A 43 10.065 11.249 5.206 1.00 25.00 H new ATOM 535 N ASP A 44 1.956 7.020 4.746 1.00 25.00 N ATOM 536 CA ASP A 44 0.600 6.986 5.284 1.00 25.00 C ATOM 537 C ASP A 44 0.230 5.650 5.901 1.00 25.00 C ATOM 538 O ASP A 44 0.922 4.650 5.728 1.00 25.00 O ATOM 539 CB ASP A 44 -0.380 7.305 4.157 1.00 25.00 C ATOM 540 CG ASP A 44 -0.068 8.620 3.487 1.00 25.00 C ATOM 541 OD1 ASP A 44 -0.133 9.668 4.146 1.00 50.00 O ATOM 542 OD2 ASP A 44 0.259 8.632 2.282 1.00 50.00 O ATOM 0 H ASP A 44 2.146 6.315 4.034 1.00 25.00 H new ATOM 0 HA ASP A 44 0.550 7.726 6.083 1.00 25.00 H new ATOM 0 HB2 ASP A 44 -0.352 6.506 3.416 1.00 25.00 H new ATOM 0 HB3 ASP A 44 -1.394 7.334 4.556 1.00 25.00 H new ATOM 547 N ARG A 45 -0.878 5.646 6.625 1.00 25.00 N ATOM 548 CA ARG A 45 -1.424 4.434 7.234 1.00 25.00 C ATOM 549 C ARG A 45 -2.856 4.395 6.761 1.00 25.00 C ATOM 550 O ARG A 45 -3.517 5.427 6.782 1.00 25.00 O ATOM 551 CB ARG A 45 -1.367 4.492 8.767 1.00 25.00 C ATOM 552 CG ARG A 45 0.013 4.188 9.360 1.00 25.00 C ATOM 553 CD ARG A 45 0.953 5.388 9.272 1.00 25.00 C ATOM 554 NE ARG A 45 2.278 5.106 9.842 1.00 25.00 N ATOM 555 CZ ARG A 45 3.340 5.894 9.719 1.00 25.00 C ATOM 556 NH1 ARG A 45 3.302 7.023 9.049 1.00 25.00 N ATOM 557 NH2 ARG A 45 4.463 5.541 10.282 1.00 25.00 N ATOM 0 H ARG A 45 -1.429 6.484 6.810 1.00 25.00 H new ATOM 0 HA ARG A 45 -0.856 3.548 6.951 1.00 25.00 H new ATOM 0 HB2 ARG A 45 -1.679 5.484 9.093 1.00 25.00 H new ATOM 0 HB3 ARG A 45 -2.088 3.782 9.173 1.00 25.00 H new ATOM 0 HG2 ARG A 45 -0.098 3.891 10.403 1.00 25.00 H new ATOM 0 HG3 ARG A 45 0.455 3.342 8.833 1.00 25.00 H new ATOM 0 HD2 ARG A 45 1.065 5.682 8.229 1.00 25.00 H new ATOM 0 HD3 ARG A 45 0.508 6.234 9.796 1.00 25.00 H new ATOM 0 HE ARG A 45 2.390 4.241 10.371 1.00 25.00 H new ATOM 0 HH11 ARG A 45 2.436 7.321 8.601 1.00 25.00 H new ATOM 0 HH12 ARG A 45 4.139 7.602 8.977 1.00 25.00 H new ATOM 0 HH21 ARG A 45 4.518 4.669 10.809 1.00 25.00 H new ATOM 0 HH22 ARG A 45 5.286 6.137 10.195 1.00 25.00 H new ATOM 571 N LEU A 46 -3.300 3.251 6.272 1.00 25.00 N ATOM 572 CA LEU A 46 -4.631 3.112 5.687 1.00 25.00 C ATOM 573 C LEU A 46 -5.339 1.888 6.257 1.00 25.00 C ATOM 574 O LEU A 46 -5.097 0.775 5.817 1.00 25.00 O ATOM 575 CB LEU A 46 -4.508 2.960 4.161 1.00 25.00 C ATOM 576 CG LEU A 46 -3.802 4.116 3.433 1.00 25.00 C ATOM 577 CD1 LEU A 46 -2.432 3.675 2.926 1.00 25.00 C ATOM 578 CD2 LEU A 46 -4.642 4.615 2.278 1.00 25.00 C ATOM 0 H LEU A 46 -2.753 2.390 6.267 1.00 25.00 H new ATOM 0 HA LEU A 46 -5.213 4.002 5.927 1.00 25.00 H new ATOM 0 HB2 LEU A 46 -3.969 2.037 3.948 1.00 25.00 H new ATOM 0 HB3 LEU A 46 -5.509 2.848 3.743 1.00 25.00 H new ATOM 0 HG LEU A 46 -3.669 4.930 4.146 1.00 25.00 H new ATOM 0 HD11 LEU A 46 -1.949 4.507 2.414 1.00 25.00 H new ATOM 0 HD12 LEU A 46 -1.816 3.360 3.769 1.00 25.00 H new ATOM 0 HD13 LEU A 46 -2.551 2.842 2.233 1.00 25.00 H new ATOM 0 HD21 LEU A 46 -4.123 5.433 1.777 1.00 25.00 H new ATOM 0 HD22 LEU A 46 -4.807 3.803 1.570 1.00 25.00 H new ATOM 0 HD23 LEU A 46 -5.602 4.970 2.653 1.00 25.00 H new ATOM 590 N THR A 47 -6.211 2.082 7.227 1.00 25.00 N ATOM 591 CA THR A 47 -6.952 0.961 7.795 1.00 25.00 C ATOM 592 C THR A 47 -8.206 0.767 6.968 1.00 25.00 C ATOM 593 O THR A 47 -9.054 1.650 6.899 1.00 25.00 O ATOM 594 CB THR A 47 -7.355 1.231 9.257 1.00 25.00 C ATOM 595 OG1 THR A 47 -6.202 1.614 10.011 1.00 25.00 O ATOM 596 CG2 THR A 47 -7.966 -0.002 9.905 1.00 25.00 C ATOM 0 H THR A 47 -6.426 2.991 7.637 1.00 25.00 H new ATOM 0 HA THR A 47 -6.319 0.074 7.780 1.00 25.00 H new ATOM 0 HB THR A 47 -8.096 2.030 9.252 1.00 25.00 H new ATOM 0 HG1 THR A 47 -6.461 1.787 10.940 1.00 25.00 H new ATOM 0 HG21 THR A 47 -8.238 0.226 10.936 1.00 25.00 H new ATOM 0 HG22 THR A 47 -8.857 -0.300 9.352 1.00 25.00 H new ATOM 0 HG23 THR A 47 -7.242 -0.816 9.892 1.00 25.00 H new ATOM 604 N GLY A 48 -8.322 -0.372 6.303 1.00 25.00 N ATOM 605 CA GLY A 48 -9.491 -0.610 5.475 1.00 25.00 C ATOM 606 C GLY A 48 -10.646 -1.117 6.303 1.00 25.00 C ATOM 607 O GLY A 48 -11.794 -0.693 6.115 1.00 25.00 O ATOM 0 H GLY A 48 -7.638 -1.129 6.319 1.00 25.00 H new ATOM 0 HA2 GLY A 48 -9.778 0.313 4.971 1.00 25.00 H new ATOM 0 HA3 GLY A 48 -9.249 -1.336 4.698 1.00 25.00 H new ATOM 611 N GLY A 49 -10.357 -2.023 7.224 1.00 25.00 N ATOM 612 CA GLY A 49 -11.393 -2.592 8.064 1.00 25.00 C ATOM 613 C GLY A 49 -12.301 -3.512 7.275 1.00 25.00 C ATOM 614 O GLY A 49 -11.983 -3.920 6.146 1.00 25.00 O ATOM 0 H GLY A 49 -9.418 -2.377 7.406 1.00 25.00 H new ATOM 0 HA2 GLY A 49 -10.935 -3.145 8.884 1.00 25.00 H new ATOM 0 HA3 GLY A 49 -11.983 -1.791 8.510 1.00 25.00 H new ATOM 618 N LEU A 50 -13.456 -3.818 7.850 1.00 25.00 N ATOM 619 CA LEU A 50 -14.443 -4.677 7.195 1.00 25.00 C ATOM 620 C LEU A 50 -14.941 -4.044 5.905 1.00 25.00 C ATOM 621 O LEU A 50 -14.924 -2.816 5.748 1.00 25.00 O ATOM 622 CB LEU A 50 -15.640 -4.921 8.122 1.00 25.00 C ATOM 623 CG LEU A 50 -15.346 -5.745 9.384 1.00 25.00 C ATOM 624 CD1 LEU A 50 -16.548 -5.679 10.321 1.00 25.00 C ATOM 625 CD2 LEU A 50 -15.033 -7.201 9.048 1.00 25.00 C ATOM 0 H LEU A 50 -13.737 -3.485 8.772 1.00 25.00 H new ATOM 0 HA LEU A 50 -13.956 -5.625 6.966 1.00 25.00 H new ATOM 0 HB2 LEU A 50 -16.043 -3.955 8.426 1.00 25.00 H new ATOM 0 HB3 LEU A 50 -16.420 -5.427 7.553 1.00 25.00 H new ATOM 0 HG LEU A 50 -14.467 -5.321 9.869 1.00 25.00 H new ATOM 0 HD11 LEU A 50 -16.343 -6.263 11.218 1.00 25.00 H new ATOM 0 HD12 LEU A 50 -16.737 -4.642 10.598 1.00 25.00 H new ATOM 0 HD13 LEU A 50 -17.425 -6.085 9.817 1.00 25.00 H new ATOM 0 HD21 LEU A 50 -14.831 -7.751 9.967 1.00 25.00 H new ATOM 0 HD22 LEU A 50 -15.886 -7.648 8.538 1.00 25.00 H new ATOM 0 HD23 LEU A 50 -14.158 -7.245 8.399 1.00 25.00 H new ATOM 637 N GLY A 51 -15.394 -4.898 4.999 1.00 25.00 N ATOM 638 CA GLY A 51 -15.880 -4.466 3.696 1.00 25.00 C ATOM 639 C GLY A 51 -14.775 -4.546 2.663 1.00 25.00 C ATOM 640 O GLY A 51 -13.590 -4.671 3.024 1.00 25.00 O ATOM 0 H GLY A 51 -15.435 -5.907 5.145 1.00 25.00 H new ATOM 0 HA2 GLY A 51 -16.719 -5.091 3.389 1.00 25.00 H new ATOM 0 HA3 GLY A 51 -16.252 -3.443 3.761 1.00 25.00 H new ATOM 644 N ALA A 52 -15.146 -4.490 1.393 1.00 25.00 N ATOM 645 CA ALA A 52 -14.187 -4.522 0.302 1.00 25.00 C ATOM 646 C ALA A 52 -13.692 -3.090 0.135 1.00 25.00 C ATOM 647 O ALA A 52 -14.479 -2.170 -0.026 1.00 25.00 O ATOM 648 CB ALA A 52 -14.856 -5.027 -0.987 1.00 25.00 C ATOM 0 H ALA A 52 -16.118 -4.421 1.091 1.00 25.00 H new ATOM 0 HA ALA A 52 -13.361 -5.201 0.513 1.00 25.00 H new ATOM 0 HB1 ALA A 52 -14.124 -5.045 -1.794 1.00 25.00 H new ATOM 0 HB2 ALA A 52 -15.243 -6.033 -0.826 1.00 25.00 H new ATOM 0 HB3 ALA A 52 -15.676 -4.362 -1.256 1.00 25.00 H new ATOM 654 N ASP A 53 -12.394 -2.894 0.242 1.00 25.00 N ATOM 655 CA ASP A 53 -11.821 -1.557 0.200 1.00 25.00 C ATOM 656 C ASP A 53 -10.837 -1.466 -0.939 1.00 25.00 C ATOM 657 O ASP A 53 -10.206 -2.456 -1.290 1.00 25.00 O ATOM 658 CB ASP A 53 -11.097 -1.255 1.510 1.00 25.00 C ATOM 659 CG ASP A 53 -11.981 -1.437 2.718 1.00 25.00 C ATOM 660 OD1 ASP A 53 -13.007 -0.739 2.861 1.00 50.00 O ATOM 661 OD2 ASP A 53 -11.642 -2.289 3.569 1.00 50.00 O ATOM 0 H ASP A 53 -11.711 -3.643 0.359 1.00 25.00 H new ATOM 0 HA ASP A 53 -12.624 -0.834 0.056 1.00 25.00 H new ATOM 0 HB2 ASP A 53 -10.228 -1.907 1.599 1.00 25.00 H new ATOM 0 HB3 ASP A 53 -10.726 -0.230 1.487 1.00 25.00 H new ATOM 666 N THR A 54 -10.654 -0.278 -1.485 1.00 25.00 N ATOM 667 CA THR A 54 -9.643 -0.077 -2.511 1.00 25.00 C ATOM 668 C THR A 54 -8.703 1.017 -2.039 1.00 25.00 C ATOM 669 O THR A 54 -9.121 1.997 -1.411 1.00 25.00 O ATOM 670 CB THR A 54 -10.253 0.221 -3.908 1.00 25.00 C ATOM 671 OG1 THR A 54 -9.202 0.311 -4.874 1.00 25.00 O ATOM 672 CG2 THR A 54 -11.040 1.515 -3.935 1.00 25.00 C ATOM 0 H THR A 54 -11.186 0.557 -1.239 1.00 25.00 H new ATOM 0 HA THR A 54 -9.084 -1.002 -2.651 1.00 25.00 H new ATOM 0 HB THR A 54 -10.937 -0.595 -4.140 1.00 25.00 H new ATOM 0 HG1 THR A 54 -9.584 0.497 -5.757 1.00 25.00 H new ATOM 0 HG21 THR A 54 -11.444 1.674 -4.935 1.00 25.00 H new ATOM 0 HG22 THR A 54 -11.859 1.458 -3.218 1.00 25.00 H new ATOM 0 HG23 THR A 54 -10.384 2.345 -3.672 1.00 25.00 H new ATOM 680 N PHE A 55 -7.420 0.805 -2.275 1.00 25.00 N ATOM 681 CA PHE A 55 -6.386 1.717 -1.818 1.00 25.00 C ATOM 682 C PHE A 55 -5.655 2.238 -3.037 1.00 25.00 C ATOM 683 O PHE A 55 -5.287 1.453 -3.911 1.00 25.00 O ATOM 684 CB PHE A 55 -5.437 0.982 -0.876 1.00 25.00 C ATOM 685 CG PHE A 55 -6.146 0.287 0.252 1.00 25.00 C ATOM 686 CD1 PHE A 55 -6.565 1.004 1.388 1.00 25.00 C ATOM 687 CD2 PHE A 55 -6.417 -1.095 0.177 1.00 25.00 C ATOM 688 CE1 PHE A 55 -7.246 0.353 2.444 1.00 25.00 C ATOM 689 CE2 PHE A 55 -7.096 -1.754 1.225 1.00 25.00 C ATOM 690 CZ PHE A 55 -7.508 -1.032 2.358 1.00 25.00 C ATOM 0 H PHE A 55 -7.066 -0.003 -2.788 1.00 25.00 H new ATOM 0 HA PHE A 55 -6.816 2.554 -1.268 1.00 25.00 H new ATOM 0 HB2 PHE A 55 -4.866 0.248 -1.445 1.00 25.00 H new ATOM 0 HB3 PHE A 55 -4.721 1.693 -0.464 1.00 25.00 H new ATOM 0 HD1 PHE A 55 -6.365 2.063 1.455 1.00 25.00 H new ATOM 0 HD2 PHE A 55 -6.102 -1.655 -0.691 1.00 25.00 H new ATOM 0 HE1 PHE A 55 -7.564 0.913 3.311 1.00 25.00 H new ATOM 0 HE2 PHE A 55 -7.299 -2.813 1.156 1.00 25.00 H new ATOM 0 HZ PHE A 55 -8.024 -1.536 3.162 1.00 25.00 H new ATOM 700 N ARG A 56 -5.512 3.552 -3.146 1.00 25.00 N ATOM 701 CA ARG A 56 -5.037 4.155 -4.392 1.00 25.00 C ATOM 702 C ARG A 56 -3.906 5.176 -4.244 1.00 25.00 C ATOM 703 O ARG A 56 -3.860 5.966 -3.294 1.00 25.00 O ATOM 704 CB ARG A 56 -6.254 4.793 -5.076 1.00 25.00 C ATOM 705 CG ARG A 56 -6.026 5.273 -6.495 1.00 25.00 C ATOM 706 CD ARG A 56 -7.337 5.687 -7.131 1.00 25.00 C ATOM 707 NE ARG A 56 -7.129 6.277 -8.464 1.00 25.00 N ATOM 708 CZ ARG A 56 -7.117 5.614 -9.615 1.00 25.00 C ATOM 709 NH1 ARG A 56 -7.284 4.322 -9.698 1.00 25.00 N ATOM 710 NH2 ARG A 56 -6.933 6.277 -10.720 1.00 25.00 N ATOM 0 H ARG A 56 -5.714 4.217 -2.399 1.00 25.00 H new ATOM 0 HA ARG A 56 -4.588 3.360 -4.988 1.00 25.00 H new ATOM 0 HB2 ARG A 56 -7.067 4.067 -5.082 1.00 25.00 H new ATOM 0 HB3 ARG A 56 -6.586 5.639 -4.474 1.00 25.00 H new ATOM 0 HG2 ARG A 56 -5.334 6.115 -6.494 1.00 25.00 H new ATOM 0 HG3 ARG A 56 -5.563 4.481 -7.084 1.00 25.00 H new ATOM 0 HD2 ARG A 56 -7.992 4.820 -7.214 1.00 25.00 H new ATOM 0 HD3 ARG A 56 -7.843 6.408 -6.488 1.00 25.00 H new ATOM 0 HE ARG A 56 -6.981 7.285 -8.507 1.00 25.00 H new ATOM 0 HH11 ARG A 56 -7.433 3.772 -8.852 1.00 25.00 H new ATOM 0 HH12 ARG A 56 -7.266 3.863 -10.609 1.00 25.00 H new ATOM 0 HH21 ARG A 56 -6.801 7.288 -10.692 1.00 25.00 H new ATOM 0 HH22 ARG A 56 -6.921 5.785 -11.614 1.00 25.00 H new ATOM 724 N PHE A 57 -2.989 5.130 -5.204 1.00 25.00 N ATOM 725 CA PHE A 57 -1.884 6.085 -5.312 1.00 25.00 C ATOM 726 C PHE A 57 -2.366 7.458 -5.804 1.00 25.00 C ATOM 727 O PHE A 57 -3.383 7.555 -6.478 1.00 25.00 O ATOM 728 CB PHE A 57 -0.879 5.568 -6.355 1.00 25.00 C ATOM 729 CG PHE A 57 -1.459 5.500 -7.761 1.00 25.00 C ATOM 730 CD1 PHE A 57 -1.443 6.629 -8.607 1.00 25.00 C ATOM 731 CD2 PHE A 57 -2.057 4.317 -8.226 1.00 25.00 C ATOM 732 CE1 PHE A 57 -2.030 6.580 -9.895 1.00 25.00 C ATOM 733 CE2 PHE A 57 -2.650 4.255 -9.510 1.00 25.00 C ATOM 734 CZ PHE A 57 -2.635 5.388 -10.344 1.00 25.00 C ATOM 0 H PHE A 57 -2.989 4.422 -5.939 1.00 25.00 H new ATOM 0 HA PHE A 57 -1.440 6.186 -4.322 1.00 25.00 H new ATOM 0 HB2 PHE A 57 -0.004 6.218 -6.361 1.00 25.00 H new ATOM 0 HB3 PHE A 57 -0.537 4.576 -6.061 1.00 25.00 H new ATOM 0 HD1 PHE A 57 -0.977 7.542 -8.268 1.00 25.00 H new ATOM 0 HD2 PHE A 57 -2.064 3.441 -7.594 1.00 25.00 H new ATOM 0 HE1 PHE A 57 -2.014 7.453 -10.531 1.00 25.00 H new ATOM 0 HE2 PHE A 57 -3.113 3.340 -9.849 1.00 25.00 H new ATOM 0 HZ PHE A 57 -3.085 5.345 -11.325 1.00 25.00 H new ATOM 744 N ALA A 58 -1.545 8.479 -5.599 1.00 25.00 N ATOM 745 CA ALA A 58 -1.732 9.772 -6.268 1.00 25.00 C ATOM 746 C ALA A 58 -0.432 10.222 -6.965 1.00 25.00 C ATOM 747 O ALA A 58 -0.403 11.252 -7.629 1.00 25.00 O ATOM 748 CB ALA A 58 -2.192 10.825 -5.261 1.00 25.00 C ATOM 0 H ALA A 58 -0.739 8.443 -4.974 1.00 25.00 H new ATOM 0 HA ALA A 58 -2.502 9.657 -7.031 1.00 25.00 H new ATOM 0 HB1 ALA A 58 -2.327 11.780 -5.769 1.00 25.00 H new ATOM 0 HB2 ALA A 58 -3.137 10.514 -4.815 1.00 25.00 H new ATOM 0 HB3 ALA A 58 -1.440 10.933 -4.479 1.00 25.00 H new ATOM 754 N LEU A 59 0.645 9.468 -6.777 1.00 25.00 N ATOM 755 CA LEU A 59 1.961 9.824 -7.320 1.00 25.00 C ATOM 756 C LEU A 59 2.788 8.543 -7.424 1.00 25.00 C ATOM 757 O LEU A 59 2.422 7.545 -6.825 1.00 25.00 O ATOM 758 CB LEU A 59 2.641 10.823 -6.357 1.00 25.00 C ATOM 759 CG LEU A 59 3.888 11.587 -6.835 1.00 25.00 C ATOM 760 CD1 LEU A 59 3.596 12.444 -8.069 1.00 25.00 C ATOM 761 CD2 LEU A 59 4.405 12.463 -5.700 1.00 25.00 C ATOM 0 H LEU A 59 0.637 8.596 -6.248 1.00 25.00 H new ATOM 0 HA LEU A 59 1.871 10.286 -8.303 1.00 25.00 H new ATOM 0 HB2 LEU A 59 1.894 11.561 -6.067 1.00 25.00 H new ATOM 0 HB3 LEU A 59 2.916 10.276 -5.455 1.00 25.00 H new ATOM 0 HG LEU A 59 4.645 10.857 -7.120 1.00 25.00 H new ATOM 0 HD11 LEU A 59 4.504 12.966 -8.373 1.00 25.00 H new ATOM 0 HD12 LEU A 59 3.255 11.805 -8.884 1.00 25.00 H new ATOM 0 HD13 LEU A 59 2.821 13.172 -7.831 1.00 25.00 H new ATOM 0 HD21 LEU A 59 5.289 13.007 -6.034 1.00 25.00 H new ATOM 0 HD22 LEU A 59 3.631 13.173 -5.407 1.00 25.00 H new ATOM 0 HD23 LEU A 59 4.665 11.837 -4.847 1.00 25.00 H new ATOM 773 N ARG A 60 3.915 8.558 -8.124 1.00 25.00 N ATOM 774 CA ARG A 60 4.799 7.381 -8.125 1.00 25.00 C ATOM 775 C ARG A 60 5.628 7.334 -6.836 1.00 25.00 C ATOM 776 O ARG A 60 6.078 6.298 -6.413 1.00 25.00 O ATOM 777 CB ARG A 60 5.722 7.363 -9.356 1.00 25.00 C ATOM 778 CG ARG A 60 6.867 8.348 -9.315 1.00 25.00 C ATOM 779 CD ARG A 60 7.756 8.241 -10.525 1.00 25.00 C ATOM 780 NE ARG A 60 8.905 9.151 -10.389 1.00 25.00 N ATOM 781 CZ ARG A 60 9.941 9.206 -11.219 1.00 25.00 C ATOM 782 NH1 ARG A 60 10.050 8.416 -12.261 1.00 25.00 N ATOM 783 NH2 ARG A 60 10.886 10.072 -10.982 1.00 25.00 N ATOM 0 H ARG A 60 4.240 9.345 -8.686 1.00 25.00 H new ATOM 0 HA ARG A 60 4.167 6.494 -8.173 1.00 25.00 H new ATOM 0 HB2 ARG A 60 6.131 6.359 -9.469 1.00 25.00 H new ATOM 0 HB3 ARG A 60 5.122 7.564 -10.243 1.00 25.00 H new ATOM 0 HG2 ARG A 60 6.470 9.361 -9.247 1.00 25.00 H new ATOM 0 HG3 ARG A 60 7.459 8.177 -8.416 1.00 25.00 H new ATOM 0 HD2 ARG A 60 8.106 7.215 -10.639 1.00 25.00 H new ATOM 0 HD3 ARG A 60 7.191 8.487 -11.424 1.00 25.00 H new ATOM 0 HE ARG A 60 8.906 9.790 -9.594 1.00 25.00 H new ATOM 0 HH11 ARG A 60 9.323 7.728 -12.458 1.00 25.00 H new ATOM 0 HH12 ARG A 60 10.862 8.490 -12.874 1.00 25.00 H new ATOM 0 HH21 ARG A 60 10.821 10.690 -10.173 1.00 25.00 H new ATOM 0 HH22 ARG A 60 11.691 10.132 -11.606 1.00 25.00 H new ATOM 797 N GLU A 61 5.808 8.482 -6.203 1.00 25.00 N ATOM 798 CA GLU A 61 6.636 8.592 -4.993 1.00 25.00 C ATOM 799 C GLU A 61 5.738 8.559 -3.764 1.00 25.00 C ATOM 800 O GLU A 61 6.113 8.911 -2.652 1.00 25.00 O ATOM 801 CB GLU A 61 7.466 9.869 -5.068 1.00 25.00 C ATOM 802 CG GLU A 61 8.430 9.820 -6.260 1.00 25.00 C ATOM 803 CD GLU A 61 9.292 11.049 -6.446 1.00 25.00 C ATOM 804 OE1 GLU A 61 9.665 11.710 -5.464 1.00 25.00 O ATOM 805 OE2 GLU A 61 9.676 11.296 -7.619 1.00 25.00 O ATOM 0 H GLU A 61 5.391 9.363 -6.504 1.00 25.00 H new ATOM 0 HA GLU A 61 7.326 7.752 -4.919 1.00 25.00 H new ATOM 0 HB2 GLU A 61 6.807 10.732 -5.162 1.00 25.00 H new ATOM 0 HB3 GLU A 61 8.029 9.997 -4.144 1.00 25.00 H new ATOM 0 HG2 GLU A 61 9.081 8.954 -6.144 1.00 25.00 H new ATOM 0 HG3 GLU A 61 7.850 9.663 -7.169 1.00 25.00 H new ATOM 812 N ASP A 62 4.528 8.092 -4.013 1.00 25.00 N ATOM 813 CA ASP A 62 3.505 7.898 -2.988 1.00 25.00 C ATOM 814 C ASP A 62 3.954 6.852 -1.960 1.00 25.00 C ATOM 815 O ASP A 62 3.680 6.986 -0.759 1.00 25.00 O ATOM 816 CB ASP A 62 2.229 7.450 -3.699 1.00 25.00 C ATOM 817 CG ASP A 62 1.004 7.590 -2.854 1.00 25.00 C ATOM 818 OD1 ASP A 62 0.960 7.062 -1.730 1.00 25.00 O ATOM 819 OD2 ASP A 62 0.071 8.266 -3.317 1.00 25.00 O ATOM 0 H ASP A 62 4.218 7.831 -4.949 1.00 25.00 H new ATOM 0 HA ASP A 62 3.331 8.825 -2.441 1.00 25.00 H new ATOM 0 HB2 ASP A 62 2.103 8.036 -4.610 1.00 25.00 H new ATOM 0 HB3 ASP A 62 2.336 6.409 -4.002 1.00 25.00 H new ATOM 824 N SER A 63 4.681 5.846 -2.433 1.00 25.00 N ATOM 825 CA SER A 63 5.277 4.809 -1.580 1.00 25.00 C ATOM 826 C SER A 63 6.601 4.439 -2.243 1.00 25.00 C ATOM 827 O SER A 63 6.632 3.775 -3.276 1.00 25.00 O ATOM 828 CB SER A 63 4.355 3.594 -1.455 1.00 25.00 C ATOM 829 OG SER A 63 4.730 2.778 -0.355 1.00 25.00 O ATOM 0 H SER A 63 4.878 5.721 -3.426 1.00 25.00 H new ATOM 0 HA SER A 63 5.430 5.169 -0.563 1.00 25.00 H new ATOM 0 HB2 SER A 63 3.325 3.927 -1.330 1.00 25.00 H new ATOM 0 HB3 SER A 63 4.392 3.010 -2.374 1.00 25.00 H new ATOM 0 HG SER A 63 5.519 2.248 -0.595 1.00 25.00 H new ATOM 835 N HIS A 64 7.677 4.988 -1.708 1.00 25.00 N ATOM 836 CA HIS A 64 8.997 4.949 -2.335 1.00 25.00 C ATOM 837 C HIS A 64 10.055 5.103 -1.241 1.00 25.00 C ATOM 838 O HIS A 64 10.136 6.147 -0.581 1.00 25.00 O ATOM 839 CB HIS A 64 9.085 6.107 -3.339 1.00 25.00 C ATOM 840 CG HIS A 64 10.456 6.330 -3.897 1.00 25.00 C ATOM 841 ND1 HIS A 64 11.411 7.113 -3.302 1.00 25.00 N ATOM 842 CD2 HIS A 64 11.034 5.880 -5.046 1.00 25.00 C ATOM 843 CE1 HIS A 64 12.492 7.108 -4.067 1.00 25.00 C ATOM 844 NE2 HIS A 64 12.321 6.371 -5.146 1.00 25.00 N ATOM 0 H HIS A 64 7.664 5.481 -0.815 1.00 25.00 H new ATOM 0 HA HIS A 64 9.161 4.007 -2.859 1.00 25.00 H new ATOM 0 HB2 HIS A 64 8.397 5.913 -4.162 1.00 25.00 H new ATOM 0 HB3 HIS A 64 8.750 7.022 -2.852 1.00 25.00 H new ATOM 0 HD2 HIS A 64 10.557 5.236 -5.770 1.00 25.00 H new ATOM 0 HE1 HIS A 64 13.402 7.642 -3.835 1.00 25.00 H new ATOM 0 HE2 HIS A 64 12.994 6.200 -5.893 1.00 25.00 H new ATOM 852 N ARG A 65 10.858 4.068 -1.024 1.00 25.00 N ATOM 853 CA ARG A 65 11.853 4.091 0.055 1.00 25.00 C ATOM 854 C ARG A 65 13.238 4.321 -0.522 1.00 25.00 C ATOM 855 O ARG A 65 13.677 3.605 -1.403 1.00 25.00 O ATOM 856 CB ARG A 65 11.818 2.782 0.862 1.00 25.00 C ATOM 857 CG ARG A 65 10.498 2.576 1.616 1.00 25.00 C ATOM 858 CD ARG A 65 10.619 1.585 2.785 1.00 25.00 C ATOM 859 NE ARG A 65 10.748 0.179 2.357 1.00 25.00 N ATOM 860 CZ ARG A 65 10.000 -0.837 2.784 1.00 25.00 C ATOM 861 NH1 ARG A 65 9.025 -0.695 3.647 1.00 25.00 N ATOM 862 NH2 ARG A 65 10.244 -2.029 2.319 1.00 25.00 N ATOM 0 H ARG A 65 10.845 3.208 -1.572 1.00 25.00 H new ATOM 0 HA ARG A 65 11.610 4.910 0.732 1.00 25.00 H new ATOM 0 HB2 ARG A 65 11.979 1.941 0.187 1.00 25.00 H new ATOM 0 HB3 ARG A 65 12.642 2.780 1.576 1.00 25.00 H new ATOM 0 HG2 ARG A 65 10.150 3.536 1.996 1.00 25.00 H new ATOM 0 HG3 ARG A 65 9.741 2.216 0.919 1.00 25.00 H new ATOM 0 HD2 ARG A 65 11.486 1.853 3.389 1.00 25.00 H new ATOM 0 HD3 ARG A 65 9.742 1.682 3.425 1.00 25.00 H new ATOM 0 HE ARG A 65 11.474 -0.034 1.673 1.00 25.00 H new ATOM 0 HH11 ARG A 65 8.809 0.227 4.025 1.00 25.00 H new ATOM 0 HH12 ARG A 65 8.482 -1.507 3.941 1.00 25.00 H new ATOM 0 HH21 ARG A 65 10.995 -2.169 1.643 1.00 25.00 H new ATOM 0 HH22 ARG A 65 9.684 -2.823 2.631 1.00 25.00 H new ATOM 876 N SER A 66 13.918 5.343 -0.021 1.00 25.00 N ATOM 877 CA SER A 66 15.263 5.678 -0.477 1.00 25.00 C ATOM 878 C SER A 66 16.019 6.296 0.694 1.00 25.00 C ATOM 879 O SER A 66 15.391 6.780 1.642 1.00 25.00 O ATOM 880 CB SER A 66 15.186 6.683 -1.632 1.00 25.00 C ATOM 881 OG SER A 66 14.782 7.960 -1.162 1.00 25.00 O ATOM 0 H SER A 66 13.558 5.960 0.707 1.00 25.00 H new ATOM 0 HA SER A 66 15.776 4.783 -0.829 1.00 25.00 H new ATOM 0 HB2 SER A 66 16.158 6.760 -2.118 1.00 25.00 H new ATOM 0 HB3 SER A 66 14.481 6.327 -2.383 1.00 25.00 H new ATOM 0 HG SER A 66 14.024 7.858 -0.549 1.00 25.00 H new ATOM 887 N PRO A 67 17.366 6.322 0.647 1.00 25.00 N ATOM 888 CA PRO A 67 18.063 6.964 1.769 1.00 25.00 C ATOM 889 C PRO A 67 17.910 8.487 1.777 1.00 25.00 C ATOM 890 O PRO A 67 18.144 9.132 2.786 1.00 25.00 O ATOM 891 CB PRO A 67 19.521 6.558 1.540 1.00 25.00 C ATOM 892 CG PRO A 67 19.633 6.431 0.064 1.00 25.00 C ATOM 893 CD PRO A 67 18.324 5.801 -0.353 1.00 25.00 C ATOM 0 HA PRO A 67 17.662 6.653 2.734 1.00 25.00 H new ATOM 0 HB2 PRO A 67 20.210 7.308 1.929 1.00 25.00 H new ATOM 0 HB3 PRO A 67 19.757 5.619 2.040 1.00 25.00 H new ATOM 0 HG2 PRO A 67 19.777 7.402 -0.410 1.00 25.00 H new ATOM 0 HG3 PRO A 67 20.482 5.809 -0.219 1.00 25.00 H new ATOM 0 HD2 PRO A 67 18.044 6.087 -1.367 1.00 25.00 H new ATOM 0 HD3 PRO A 67 18.376 4.712 -0.332 1.00 25.00 H new ATOM 901 N LEU A 68 17.482 9.046 0.651 1.00 25.00 N ATOM 902 CA LEU A 68 17.276 10.488 0.522 1.00 25.00 C ATOM 903 C LEU A 68 15.916 10.884 1.093 1.00 25.00 C ATOM 904 O LEU A 68 15.578 12.058 1.184 1.00 25.00 O ATOM 905 CB LEU A 68 17.335 10.886 -0.959 1.00 25.00 C ATOM 906 CG LEU A 68 18.627 10.519 -1.713 1.00 25.00 C ATOM 907 CD1 LEU A 68 18.470 10.866 -3.188 1.00 25.00 C ATOM 908 CD2 LEU A 68 19.849 11.241 -1.137 1.00 25.00 C ATOM 0 H LEU A 68 17.268 8.518 -0.195 1.00 25.00 H new ATOM 0 HA LEU A 68 18.060 11.003 1.077 1.00 25.00 H new ATOM 0 HB2 LEU A 68 16.495 10.419 -1.473 1.00 25.00 H new ATOM 0 HB3 LEU A 68 17.192 11.964 -1.030 1.00 25.00 H new ATOM 0 HG LEU A 68 18.792 9.448 -1.596 1.00 25.00 H new ATOM 0 HD11 LEU A 68 19.384 10.607 -3.722 1.00 25.00 H new ATOM 0 HD12 LEU A 68 17.634 10.306 -3.607 1.00 25.00 H new ATOM 0 HD13 LEU A 68 18.280 11.934 -3.292 1.00 25.00 H new ATOM 0 HD21 LEU A 68 20.739 10.954 -1.697 1.00 25.00 H new ATOM 0 HD22 LEU A 68 19.704 12.319 -1.213 1.00 25.00 H new ATOM 0 HD23 LEU A 68 19.975 10.965 -0.090 1.00 25.00 H new ATOM 920 N GLY A 69 15.126 9.882 1.443 1.00 25.00 N ATOM 921 CA GLY A 69 13.788 10.109 1.951 1.00 25.00 C ATOM 922 C GLY A 69 12.980 8.845 1.788 1.00 25.00 C ATOM 923 O GLY A 69 12.623 8.457 0.674 1.00 25.00 O ATOM 0 H GLY A 69 15.393 8.899 1.383 1.00 25.00 H new ATOM 0 HA2 GLY A 69 13.828 10.398 3.001 1.00 25.00 H new ATOM 0 HA3 GLY A 69 13.315 10.930 1.413 1.00 25.00 H new ATOM 927 N THR A 70 12.732 8.157 2.892 1.00 25.00 N ATOM 928 CA THR A 70 12.002 6.903 2.852 1.00 25.00 C ATOM 929 C THR A 70 10.530 7.122 3.182 1.00 25.00 C ATOM 930 O THR A 70 10.172 7.598 4.266 1.00 25.00 O ATOM 931 CB THR A 70 12.656 5.846 3.790 1.00 25.00 C ATOM 932 OG1 THR A 70 11.780 4.730 3.947 1.00 25.00 O ATOM 933 CG2 THR A 70 12.991 6.410 5.174 1.00 25.00 C ATOM 0 H THR A 70 13.026 8.447 3.825 1.00 25.00 H new ATOM 0 HA THR A 70 12.053 6.509 1.837 1.00 25.00 H new ATOM 0 HB THR A 70 13.590 5.542 3.318 1.00 25.00 H new ATOM 0 HG1 THR A 70 12.197 4.067 4.537 1.00 25.00 H new ATOM 0 HG21 THR A 70 13.444 5.629 5.785 1.00 25.00 H new ATOM 0 HG22 THR A 70 13.689 7.240 5.069 1.00 25.00 H new ATOM 0 HG23 THR A 70 12.078 6.762 5.654 1.00 25.00 H new ATOM 941 N PHE A 71 9.677 6.807 2.224 1.00 25.00 N ATOM 942 CA PHE A 71 8.239 6.912 2.398 1.00 25.00 C ATOM 943 C PHE A 71 7.683 5.549 2.053 1.00 25.00 C ATOM 944 O PHE A 71 8.122 4.929 1.104 1.00 25.00 O ATOM 945 CB PHE A 71 7.650 7.971 1.464 1.00 25.00 C ATOM 946 CG PHE A 71 8.150 9.364 1.733 1.00 25.00 C ATOM 947 CD1 PHE A 71 7.467 10.201 2.635 1.00 25.00 C ATOM 948 CD2 PHE A 71 9.296 9.854 1.080 1.00 25.00 C ATOM 949 CE1 PHE A 71 7.912 11.521 2.879 1.00 25.00 C ATOM 950 CE2 PHE A 71 9.759 11.173 1.323 1.00 25.00 C ATOM 951 CZ PHE A 71 9.062 12.007 2.221 1.00 25.00 C ATOM 0 H PHE A 71 9.961 6.471 1.304 1.00 25.00 H new ATOM 0 HA PHE A 71 7.987 7.211 3.415 1.00 25.00 H new ATOM 0 HB2 PHE A 71 7.884 7.704 0.434 1.00 25.00 H new ATOM 0 HB3 PHE A 71 6.564 7.961 1.557 1.00 25.00 H new ATOM 0 HD1 PHE A 71 6.592 9.830 3.148 1.00 25.00 H new ATOM 0 HD2 PHE A 71 9.829 9.220 0.387 1.00 25.00 H new ATOM 0 HE1 PHE A 71 7.373 12.155 3.567 1.00 25.00 H new ATOM 0 HE2 PHE A 71 10.643 11.537 0.821 1.00 25.00 H new ATOM 0 HZ PHE A 71 9.407 13.014 2.405 1.00 25.00 H new ATOM 961 N SER A 72 6.738 5.068 2.830 1.00 25.00 N ATOM 962 CA SER A 72 6.120 3.785 2.555 1.00 25.00 C ATOM 963 C SER A 72 4.767 3.890 3.174 1.00 25.00 C ATOM 964 O SER A 72 4.618 4.552 4.202 1.00 25.00 O ATOM 965 CB SER A 72 6.898 2.643 3.209 1.00 25.00 C ATOM 966 OG SER A 72 6.289 1.380 2.976 1.00 25.00 O ATOM 0 H SER A 72 6.379 5.544 3.658 1.00 25.00 H new ATOM 0 HA SER A 72 6.091 3.570 1.487 1.00 25.00 H new ATOM 0 HB2 SER A 72 7.917 2.631 2.822 1.00 25.00 H new ATOM 0 HB3 SER A 72 6.967 2.820 4.282 1.00 25.00 H new ATOM 0 HG SER A 72 6.817 0.677 3.409 1.00 25.00 H new ATOM 972 N ASP A 73 3.794 3.237 2.583 1.00 25.00 N ATOM 973 CA ASP A 73 2.461 3.218 3.152 1.00 25.00 C ATOM 974 C ASP A 73 2.250 1.868 3.790 1.00 25.00 C ATOM 975 O ASP A 73 2.847 0.867 3.370 1.00 25.00 O ATOM 976 CB ASP A 73 1.400 3.491 2.090 1.00 25.00 C ATOM 977 CG ASP A 73 1.320 4.958 1.724 1.00 25.00 C ATOM 978 OD1 ASP A 73 2.160 5.763 2.190 1.00 50.00 O ATOM 979 OD2 ASP A 73 0.424 5.347 0.956 1.00 50.00 O ATOM 0 H ASP A 73 3.896 2.714 1.713 1.00 25.00 H new ATOM 0 HA ASP A 73 2.366 4.007 3.898 1.00 25.00 H new ATOM 0 HB2 ASP A 73 1.624 2.907 1.197 1.00 25.00 H new ATOM 0 HB3 ASP A 73 0.429 3.156 2.455 1.00 25.00 H new ATOM 984 N LEU A 74 1.426 1.864 4.822 1.00 25.00 N ATOM 985 CA LEU A 74 1.070 0.657 5.546 1.00 25.00 C ATOM 986 C LEU A 74 -0.431 0.527 5.436 1.00 25.00 C ATOM 987 O LEU A 74 -1.142 1.501 5.674 1.00 25.00 O ATOM 988 CB LEU A 74 1.463 0.789 7.021 1.00 25.00 C ATOM 989 CG LEU A 74 2.414 -0.283 7.568 1.00 25.00 C ATOM 990 CD1 LEU A 74 2.783 0.056 9.011 1.00 25.00 C ATOM 991 CD2 LEU A 74 1.787 -1.670 7.510 1.00 25.00 C ATOM 0 H LEU A 74 0.981 2.707 5.185 1.00 25.00 H new ATOM 0 HA LEU A 74 1.584 -0.213 5.137 1.00 25.00 H new ATOM 0 HB2 LEU A 74 1.927 1.765 7.166 1.00 25.00 H new ATOM 0 HB3 LEU A 74 0.553 0.777 7.620 1.00 25.00 H new ATOM 0 HG LEU A 74 3.309 -0.295 6.945 1.00 25.00 H new ATOM 0 HD11 LEU A 74 3.459 -0.705 9.402 1.00 25.00 H new ATOM 0 HD12 LEU A 74 3.274 1.029 9.042 1.00 25.00 H new ATOM 0 HD13 LEU A 74 1.880 0.086 9.620 1.00 25.00 H new ATOM 0 HD21 LEU A 74 2.489 -2.404 7.906 1.00 25.00 H new ATOM 0 HD22 LEU A 74 0.875 -1.682 8.107 1.00 25.00 H new ATOM 0 HD23 LEU A 74 1.547 -1.918 6.476 1.00 25.00 H new ATOM 1003 N ILE A 75 -0.924 -0.650 5.099 1.00 25.00 N ATOM 1004 CA ILE A 75 -2.364 -0.879 5.059 1.00 25.00 C ATOM 1005 C ILE A 75 -2.611 -1.754 6.260 1.00 25.00 C ATOM 1006 O ILE A 75 -1.769 -2.576 6.604 1.00 25.00 O ATOM 1007 CB ILE A 75 -2.836 -1.562 3.760 1.00 25.00 C ATOM 1008 CG1 ILE A 75 -2.320 -0.756 2.539 1.00 25.00 C ATOM 1009 CG2 ILE A 75 -4.378 -1.681 3.725 1.00 25.00 C ATOM 1010 CD1 ILE A 75 -2.737 -1.300 1.164 1.00 25.00 C ATOM 0 H ILE A 75 -0.357 -1.460 4.850 1.00 25.00 H new ATOM 0 HA ILE A 75 -2.922 0.057 5.078 1.00 25.00 H new ATOM 0 HB ILE A 75 -2.428 -2.572 3.722 1.00 25.00 H new ATOM 0 HG12 ILE A 75 -2.675 0.271 2.627 1.00 25.00 H new ATOM 0 HG13 ILE A 75 -1.231 -0.722 2.582 1.00 25.00 H new ATOM 0 HG21 ILE A 75 -4.685 -2.166 2.798 1.00 25.00 H new ATOM 0 HG22 ILE A 75 -4.717 -2.274 4.574 1.00 25.00 H new ATOM 0 HG23 ILE A 75 -4.821 -0.686 3.778 1.00 25.00 H new ATOM 0 HD11 ILE A 75 -2.324 -0.664 0.381 1.00 25.00 H new ATOM 0 HD12 ILE A 75 -2.359 -2.315 1.044 1.00 25.00 H new ATOM 0 HD13 ILE A 75 -3.824 -1.307 1.090 1.00 25.00 H new ATOM 1022 N LEU A 76 -3.721 -1.524 6.925 1.00 25.00 N ATOM 1023 CA LEU A 76 -4.066 -2.211 8.164 1.00 25.00 C ATOM 1024 C LEU A 76 -5.423 -2.856 7.946 1.00 25.00 C ATOM 1025 O LEU A 76 -6.238 -2.336 7.168 1.00 25.00 O ATOM 1026 CB LEU A 76 -4.151 -1.238 9.358 1.00 25.00 C ATOM 1027 CG LEU A 76 -2.941 -0.403 9.838 1.00 25.00 C ATOM 1028 CD1 LEU A 76 -1.682 -1.245 9.990 1.00 25.00 C ATOM 1029 CD2 LEU A 76 -2.646 0.794 8.930 1.00 25.00 C ATOM 0 H LEU A 76 -4.422 -0.848 6.623 1.00 25.00 H new ATOM 0 HA LEU A 76 -3.295 -2.944 8.401 1.00 25.00 H new ATOM 0 HB2 LEU A 76 -4.947 -0.530 9.127 1.00 25.00 H new ATOM 0 HB3 LEU A 76 -4.485 -1.824 10.214 1.00 25.00 H new ATOM 0 HG LEU A 76 -3.230 -0.023 10.818 1.00 25.00 H new ATOM 0 HD11 LEU A 76 -0.861 -0.614 10.329 1.00 25.00 H new ATOM 0 HD12 LEU A 76 -1.858 -2.034 10.721 1.00 25.00 H new ATOM 0 HD13 LEU A 76 -1.424 -1.691 9.029 1.00 25.00 H new ATOM 0 HD21 LEU A 76 -1.787 1.342 9.318 1.00 25.00 H new ATOM 0 HD22 LEU A 76 -2.427 0.441 7.922 1.00 25.00 H new ATOM 0 HD23 LEU A 76 -3.514 1.453 8.903 1.00 25.00 H new ATOM 1041 N ASP A 77 -5.652 -3.975 8.624 1.00 25.00 N ATOM 1042 CA ASP A 77 -6.901 -4.749 8.520 1.00 25.00 C ATOM 1043 C ASP A 77 -7.168 -5.060 7.051 1.00 25.00 C ATOM 1044 O ASP A 77 -8.253 -4.806 6.505 1.00 25.00 O ATOM 1045 CB ASP A 77 -8.085 -4.010 9.157 1.00 25.00 C ATOM 1046 CG ASP A 77 -7.917 -3.810 10.657 1.00 25.00 C ATOM 1047 OD1 ASP A 77 -6.941 -4.328 11.249 1.00 25.00 O ATOM 1048 OD2 ASP A 77 -8.784 -3.134 11.246 1.00 25.00 O ATOM 0 H ASP A 77 -4.975 -4.381 9.270 1.00 25.00 H new ATOM 0 HA ASP A 77 -6.786 -5.681 9.074 1.00 25.00 H new ATOM 0 HB2 ASP A 77 -8.202 -3.039 8.676 1.00 25.00 H new ATOM 0 HB3 ASP A 77 -9.001 -4.571 8.970 1.00 25.00 H new ATOM 1053 N PHE A 78 -6.121 -5.537 6.396 1.00 25.00 N ATOM 1054 CA PHE A 78 -6.170 -5.824 4.977 1.00 25.00 C ATOM 1055 C PHE A 78 -6.842 -7.169 4.715 1.00 25.00 C ATOM 1056 O PHE A 78 -6.478 -8.196 5.295 1.00 25.00 O ATOM 1057 CB PHE A 78 -4.751 -5.828 4.410 1.00 25.00 C ATOM 1058 CG PHE A 78 -4.701 -5.974 2.919 1.00 25.00 C ATOM 1059 CD1 PHE A 78 -5.265 -4.984 2.091 1.00 25.00 C ATOM 1060 CD2 PHE A 78 -4.096 -7.096 2.328 1.00 25.00 C ATOM 1061 CE1 PHE A 78 -5.219 -5.106 0.686 1.00 25.00 C ATOM 1062 CE2 PHE A 78 -4.043 -7.225 0.919 1.00 25.00 C ATOM 1063 CZ PHE A 78 -4.609 -6.228 0.101 1.00 25.00 C ATOM 0 H PHE A 78 -5.220 -5.734 6.833 1.00 25.00 H new ATOM 0 HA PHE A 78 -6.759 -5.050 4.484 1.00 25.00 H new ATOM 0 HB2 PHE A 78 -4.253 -4.901 4.693 1.00 25.00 H new ATOM 0 HB3 PHE A 78 -4.189 -6.643 4.866 1.00 25.00 H new ATOM 0 HD1 PHE A 78 -5.738 -4.121 2.537 1.00 25.00 H new ATOM 0 HD2 PHE A 78 -3.668 -7.866 2.953 1.00 25.00 H new ATOM 0 HE1 PHE A 78 -5.652 -4.338 0.062 1.00 25.00 H new ATOM 0 HE2 PHE A 78 -3.569 -8.087 0.472 1.00 25.00 H new ATOM 0 HZ PHE A 78 -4.574 -6.326 -0.974 1.00 25.00 H new ATOM 1073 N ASP A 79 -7.804 -7.159 3.805 1.00 25.00 N ATOM 1074 CA ASP A 79 -8.505 -8.374 3.396 1.00 25.00 C ATOM 1075 C ASP A 79 -8.014 -8.779 2.013 1.00 25.00 C ATOM 1076 O ASP A 79 -8.590 -8.366 1.013 1.00 25.00 O ATOM 1077 CB ASP A 79 -10.017 -8.140 3.304 1.00 25.00 C ATOM 1078 CG ASP A 79 -10.649 -7.853 4.637 1.00 25.00 C ATOM 1079 OD1 ASP A 79 -10.444 -8.617 5.588 1.00 25.00 O ATOM 1080 OD2 ASP A 79 -11.385 -6.841 4.719 1.00 25.00 O ATOM 0 H ASP A 79 -8.122 -6.315 3.329 1.00 25.00 H new ATOM 0 HA ASP A 79 -8.307 -9.148 4.138 1.00 25.00 H new ATOM 0 HB2 ASP A 79 -10.210 -7.306 2.630 1.00 25.00 H new ATOM 0 HB3 ASP A 79 -10.489 -9.019 2.866 1.00 25.00 H new ATOM 1085 N PRO A 80 -6.973 -9.622 1.925 1.00 25.00 N ATOM 1086 CA PRO A 80 -6.485 -10.016 0.598 1.00 25.00 C ATOM 1087 C PRO A 80 -7.456 -10.869 -0.229 1.00 25.00 C ATOM 1088 O PRO A 80 -7.173 -11.196 -1.376 1.00 25.00 O ATOM 1089 CB PRO A 80 -5.216 -10.801 0.930 1.00 25.00 C ATOM 1090 CG PRO A 80 -5.476 -11.350 2.265 1.00 25.00 C ATOM 1091 CD PRO A 80 -6.160 -10.242 2.983 1.00 25.00 C ATOM 0 HA PRO A 80 -6.338 -9.142 -0.037 1.00 25.00 H new ATOM 0 HB2 PRO A 80 -5.034 -11.592 0.202 1.00 25.00 H new ATOM 0 HB3 PRO A 80 -4.337 -10.157 0.928 1.00 25.00 H new ATOM 0 HG2 PRO A 80 -6.103 -12.240 2.215 1.00 25.00 H new ATOM 0 HG3 PRO A 80 -4.551 -11.639 2.765 1.00 25.00 H new ATOM 0 HD2 PRO A 80 -6.776 -10.611 3.803 1.00 25.00 H new ATOM 0 HD3 PRO A 80 -5.448 -9.537 3.412 1.00 25.00 H new ATOM 1099 N SER A 81 -8.606 -11.196 0.345 1.00 25.00 N ATOM 1100 CA SER A 81 -9.651 -11.934 -0.359 1.00 25.00 C ATOM 1101 C SER A 81 -10.759 -11.008 -0.883 1.00 25.00 C ATOM 1102 O SER A 81 -11.711 -11.482 -1.497 1.00 25.00 O ATOM 1103 CB SER A 81 -10.279 -12.952 0.596 1.00 25.00 C ATOM 1104 OG SER A 81 -11.189 -13.798 -0.085 1.00 25.00 O ATOM 0 H SER A 81 -8.842 -10.959 1.309 1.00 25.00 H new ATOM 0 HA SER A 81 -9.187 -12.428 -1.212 1.00 25.00 H new ATOM 0 HB2 SER A 81 -9.496 -13.553 1.058 1.00 25.00 H new ATOM 0 HB3 SER A 81 -10.796 -12.429 1.401 1.00 25.00 H new ATOM 0 HG SER A 81 -11.724 -13.267 -0.711 1.00 25.00 H new ATOM 1110 N GLN A 82 -10.682 -9.718 -0.565 1.00 25.00 N ATOM 1111 CA GLN A 82 -11.762 -8.764 -0.891 1.00 25.00 C ATOM 1112 C GLN A 82 -11.271 -7.395 -1.374 1.00 25.00 C ATOM 1113 O GLN A 82 -11.949 -6.731 -2.147 1.00 25.00 O ATOM 1114 CB GLN A 82 -12.619 -8.506 0.359 1.00 25.00 C ATOM 1115 CG GLN A 82 -13.424 -9.705 0.858 1.00 25.00 C ATOM 1116 CD GLN A 82 -14.621 -10.003 -0.019 1.00 25.00 C ATOM 1117 OE1 GLN A 82 -15.593 -9.271 -0.025 1.00 25.00 O ATOM 1118 NE2 GLN A 82 -14.562 -11.082 -0.750 1.00 25.00 N ATOM 0 H GLN A 82 -9.887 -9.300 -0.082 1.00 25.00 H new ATOM 0 HA GLN A 82 -12.319 -9.233 -1.702 1.00 25.00 H new ATOM 0 HB2 GLN A 82 -11.966 -8.168 1.163 1.00 25.00 H new ATOM 0 HB3 GLN A 82 -13.309 -7.690 0.144 1.00 25.00 H new ATOM 0 HG2 GLN A 82 -12.778 -10.582 0.896 1.00 25.00 H new ATOM 0 HG3 GLN A 82 -13.762 -9.513 1.876 1.00 25.00 H new ATOM 0 HE21 GLN A 82 -13.731 -11.673 -0.721 1.00 25.00 H new ATOM 0 HE22 GLN A 82 -15.347 -11.334 -1.351 1.00 25.00 H new ATOM 1127 N ASP A 83 -10.148 -6.941 -0.840 1.00 25.00 N ATOM 1128 CA ASP A 83 -9.672 -5.584 -1.082 1.00 25.00 C ATOM 1129 C ASP A 83 -8.914 -5.480 -2.417 1.00 25.00 C ATOM 1130 O ASP A 83 -8.703 -6.475 -3.113 1.00 25.00 O ATOM 1131 CB ASP A 83 -8.774 -5.130 0.086 1.00 25.00 C ATOM 1132 CG ASP A 83 -9.552 -4.950 1.403 1.00 25.00 C ATOM 1133 OD1 ASP A 83 -10.797 -4.922 1.391 1.00 50.00 O ATOM 1134 OD2 ASP A 83 -8.925 -4.840 2.483 1.00 50.00 O ATOM 0 H ASP A 83 -9.544 -7.495 -0.232 1.00 25.00 H new ATOM 0 HA ASP A 83 -10.539 -4.926 -1.147 1.00 25.00 H new ATOM 0 HB2 ASP A 83 -7.981 -5.863 0.235 1.00 25.00 H new ATOM 0 HB3 ASP A 83 -8.292 -4.189 -0.177 1.00 25.00 H new ATOM 1139 N LYS A 84 -8.522 -4.266 -2.783 1.00 25.00 N ATOM 1140 CA LYS A 84 -7.810 -4.022 -4.039 1.00 25.00 C ATOM 1141 C LYS A 84 -6.776 -2.914 -3.854 1.00 25.00 C ATOM 1142 O LYS A 84 -6.996 -1.989 -3.082 1.00 25.00 O ATOM 1143 CB LYS A 84 -8.830 -3.619 -5.118 1.00 25.00 C ATOM 1144 CG LYS A 84 -8.325 -3.733 -6.552 1.00 25.00 C ATOM 1145 CD LYS A 84 -8.274 -5.190 -7.016 1.00 25.00 C ATOM 1146 CE LYS A 84 -7.566 -5.279 -8.351 1.00 25.00 C ATOM 1147 NZ LYS A 84 -7.480 -6.682 -8.863 1.00 25.00 N ATOM 0 H LYS A 84 -8.685 -3.427 -2.226 1.00 25.00 H new ATOM 0 HA LYS A 84 -7.289 -4.929 -4.346 1.00 25.00 H new ATOM 0 HB2 LYS A 84 -9.717 -4.243 -5.010 1.00 25.00 H new ATOM 0 HB3 LYS A 84 -9.140 -2.590 -4.938 1.00 25.00 H new ATOM 0 HG2 LYS A 84 -8.976 -3.162 -7.214 1.00 25.00 H new ATOM 0 HG3 LYS A 84 -7.331 -3.292 -6.625 1.00 25.00 H new ATOM 0 HD2 LYS A 84 -7.753 -5.799 -6.277 1.00 25.00 H new ATOM 0 HD3 LYS A 84 -9.285 -5.589 -7.103 1.00 25.00 H new ATOM 0 HE2 LYS A 84 -8.092 -4.662 -9.079 1.00 25.00 H new ATOM 0 HE3 LYS A 84 -6.561 -4.869 -8.253 1.00 25.00 H new ATOM 0 HZ1 LYS A 84 -6.943 -6.694 -9.753 1.00 25.00 H new ATOM 0 HZ2 LYS A 84 -6.999 -7.279 -8.160 1.00 25.00 H new ATOM 0 HZ3 LYS A 84 -8.438 -7.049 -9.032 1.00 25.00 H new ATOM 1161 N ILE A 85 -5.649 -3.003 -4.548 1.00 25.00 N ATOM 1162 CA ILE A 85 -4.609 -1.973 -4.454 1.00 25.00 C ATOM 1163 C ILE A 85 -4.233 -1.469 -5.849 1.00 25.00 C ATOM 1164 O ILE A 85 -3.779 -2.235 -6.716 1.00 25.00 O ATOM 1165 CB ILE A 85 -3.317 -2.491 -3.743 1.00 25.00 C ATOM 1166 CG1 ILE A 85 -3.661 -3.176 -2.398 1.00 25.00 C ATOM 1167 CG2 ILE A 85 -2.339 -1.299 -3.487 1.00 25.00 C ATOM 1168 CD1 ILE A 85 -2.461 -3.867 -1.717 1.00 25.00 C ATOM 0 H ILE A 85 -5.427 -3.772 -5.181 1.00 25.00 H new ATOM 0 HA ILE A 85 -5.027 -1.163 -3.855 1.00 25.00 H new ATOM 0 HB ILE A 85 -2.841 -3.225 -4.393 1.00 25.00 H new ATOM 0 HG12 ILE A 85 -4.071 -2.430 -1.717 1.00 25.00 H new ATOM 0 HG13 ILE A 85 -4.443 -3.916 -2.569 1.00 25.00 H new ATOM 0 HG21 ILE A 85 -1.440 -1.666 -2.991 1.00 25.00 H new ATOM 0 HG22 ILE A 85 -2.067 -0.841 -4.438 1.00 25.00 H new ATOM 0 HG23 ILE A 85 -2.826 -0.558 -2.853 1.00 25.00 H new ATOM 0 HD11 ILE A 85 -2.786 -4.322 -0.781 1.00 25.00 H new ATOM 0 HD12 ILE A 85 -2.063 -4.638 -2.376 1.00 25.00 H new ATOM 0 HD13 ILE A 85 -1.685 -3.130 -1.511 1.00 25.00 H new ATOM 1180 N ASP A 86 -4.402 -0.174 -6.050 1.00 25.00 N ATOM 1181 CA ASP A 86 -4.018 0.488 -7.284 1.00 25.00 C ATOM 1182 C ASP A 86 -2.554 0.878 -7.174 1.00 25.00 C ATOM 1183 O ASP A 86 -2.165 1.588 -6.249 1.00 25.00 O ATOM 1184 CB ASP A 86 -4.849 1.751 -7.467 1.00 25.00 C ATOM 1185 CG ASP A 86 -5.811 1.647 -8.611 1.00 25.00 C ATOM 1186 OD1 ASP A 86 -5.346 1.476 -9.758 1.00 25.00 O ATOM 1187 OD2 ASP A 86 -7.025 1.841 -8.390 1.00 25.00 O ATOM 0 H ASP A 86 -4.812 0.452 -5.357 1.00 25.00 H new ATOM 0 HA ASP A 86 -4.180 -0.178 -8.132 1.00 25.00 H new ATOM 0 HB2 ASP A 86 -5.402 1.954 -6.550 1.00 25.00 H new ATOM 0 HB3 ASP A 86 -4.184 2.598 -7.632 1.00 25.00 H new ATOM 1192 N VAL A 87 -1.737 0.403 -8.105 1.00 25.00 N ATOM 1193 CA VAL A 87 -0.293 0.676 -8.076 1.00 25.00 C ATOM 1194 C VAL A 87 0.233 1.151 -9.430 1.00 25.00 C ATOM 1195 O VAL A 87 1.428 1.101 -9.697 1.00 25.00 O ATOM 1196 CB VAL A 87 0.518 -0.607 -7.664 1.00 25.00 C ATOM 1197 CG1 VAL A 87 0.166 -1.034 -6.241 1.00 25.00 C ATOM 1198 CG2 VAL A 87 0.244 -1.782 -8.632 1.00 25.00 C ATOM 0 H VAL A 87 -2.042 -0.172 -8.890 1.00 25.00 H new ATOM 0 HA VAL A 87 -0.153 1.467 -7.339 1.00 25.00 H new ATOM 0 HB VAL A 87 1.576 -0.351 -7.715 1.00 25.00 H new ATOM 0 HG11 VAL A 87 0.738 -1.923 -5.976 1.00 25.00 H new ATOM 0 HG12 VAL A 87 0.408 -0.227 -5.549 1.00 25.00 H new ATOM 0 HG13 VAL A 87 -0.899 -1.257 -6.181 1.00 25.00 H new ATOM 0 HG21 VAL A 87 0.820 -2.653 -8.319 1.00 25.00 H new ATOM 0 HG22 VAL A 87 -0.818 -2.025 -8.618 1.00 25.00 H new ATOM 0 HG23 VAL A 87 0.537 -1.497 -9.642 1.00 25.00 H new ATOM 1208 N SER A 88 -0.672 1.579 -10.299 1.00 25.00 N ATOM 1209 CA SER A 88 -0.318 1.933 -11.680 1.00 25.00 C ATOM 1210 C SER A 88 0.797 2.987 -11.807 1.00 25.00 C ATOM 1211 O SER A 88 1.654 2.872 -12.669 1.00 25.00 O ATOM 1212 CB SER A 88 -1.567 2.414 -12.424 1.00 25.00 C ATOM 1213 OG SER A 88 -1.301 2.605 -13.798 1.00 25.00 O ATOM 0 H SER A 88 -1.661 1.692 -10.078 1.00 25.00 H new ATOM 0 HA SER A 88 0.081 1.023 -12.127 1.00 25.00 H new ATOM 0 HB2 SER A 88 -2.368 1.685 -12.304 1.00 25.00 H new ATOM 0 HB3 SER A 88 -1.918 3.348 -11.985 1.00 25.00 H new ATOM 0 HG SER A 88 -2.115 2.911 -14.249 1.00 25.00 H new ATOM 1219 N ALA A 89 0.805 3.994 -10.936 1.00 25.00 N ATOM 1220 CA ALA A 89 1.845 5.028 -11.001 1.00 25.00 C ATOM 1221 C ALA A 89 3.224 4.511 -10.585 1.00 25.00 C ATOM 1222 O ALA A 89 4.233 5.108 -10.940 1.00 25.00 O ATOM 1223 CB ALA A 89 1.465 6.213 -10.127 1.00 25.00 C ATOM 0 H ALA A 89 0.120 4.119 -10.190 1.00 25.00 H new ATOM 0 HA ALA A 89 1.912 5.336 -12.044 1.00 25.00 H new ATOM 0 HB1 ALA A 89 2.245 6.972 -10.184 1.00 25.00 H new ATOM 0 HB2 ALA A 89 0.522 6.634 -10.475 1.00 25.00 H new ATOM 0 HB3 ALA A 89 1.355 5.883 -9.094 1.00 25.00 H new ATOM 1229 N LEU A 90 3.264 3.438 -9.808 1.00 25.00 N ATOM 1230 CA LEU A 90 4.533 2.875 -9.358 1.00 25.00 C ATOM 1231 C LEU A 90 5.051 2.020 -10.501 1.00 25.00 C ATOM 1232 O LEU A 90 6.110 2.267 -11.066 1.00 25.00 O ATOM 1233 CB LEU A 90 4.350 2.000 -8.098 1.00 25.00 C ATOM 1234 CG LEU A 90 3.490 2.549 -6.951 1.00 25.00 C ATOM 1235 CD1 LEU A 90 3.416 1.516 -5.825 1.00 25.00 C ATOM 1236 CD2 LEU A 90 4.016 3.858 -6.389 1.00 25.00 C ATOM 0 H LEU A 90 2.438 2.940 -9.476 1.00 25.00 H new ATOM 0 HA LEU A 90 5.227 3.673 -9.095 1.00 25.00 H new ATOM 0 HB2 LEU A 90 3.918 1.050 -8.413 1.00 25.00 H new ATOM 0 HB3 LEU A 90 5.340 1.783 -7.697 1.00 25.00 H new ATOM 0 HG LEU A 90 2.501 2.746 -7.365 1.00 25.00 H new ATOM 0 HD11 LEU A 90 2.805 1.908 -5.012 1.00 25.00 H new ATOM 0 HD12 LEU A 90 2.970 0.596 -6.204 1.00 25.00 H new ATOM 0 HD13 LEU A 90 4.420 1.307 -5.456 1.00 25.00 H new ATOM 0 HD21 LEU A 90 3.366 4.195 -5.582 1.00 25.00 H new ATOM 0 HD22 LEU A 90 5.025 3.709 -6.004 1.00 25.00 H new ATOM 0 HD23 LEU A 90 4.036 4.611 -7.177 1.00 25.00 H new ATOM 1248 N GLY A 91 4.239 1.035 -10.862 1.00 25.00 N ATOM 1249 CA GLY A 91 4.591 0.100 -11.916 1.00 25.00 C ATOM 1250 C GLY A 91 5.553 -0.967 -11.428 1.00 25.00 C ATOM 1251 O GLY A 91 6.450 -0.702 -10.641 1.00 25.00 O ATOM 0 H GLY A 91 3.328 0.865 -10.436 1.00 25.00 H new ATOM 0 HA2 GLY A 91 3.687 -0.374 -12.298 1.00 25.00 H new ATOM 0 HA3 GLY A 91 5.042 0.643 -12.747 1.00 25.00 H new ATOM 1327 N ASN A 97 12.558 -12.083 -7.746 1.00 25.00 N ATOM 1328 CA ASN A 97 13.965 -12.267 -7.340 1.00 25.00 C ATOM 1329 C ASN A 97 14.502 -11.059 -6.556 1.00 25.00 C ATOM 1330 O ASN A 97 15.659 -11.041 -6.156 1.00 25.00 O ATOM 1331 CB ASN A 97 14.859 -12.503 -8.566 1.00 25.00 C ATOM 1332 CG ASN A 97 14.530 -13.784 -9.286 1.00 25.00 C ATOM 1333 OD1 ASN A 97 14.307 -14.810 -8.679 1.00 25.00 O ATOM 1334 ND2 ASN A 97 14.508 -13.728 -10.591 1.00 25.00 N ATOM 0 HA ASN A 97 13.990 -13.141 -6.689 1.00 25.00 H new ATOM 0 HB2 ASN A 97 14.752 -11.666 -9.255 1.00 25.00 H new ATOM 0 HB3 ASN A 97 15.902 -12.525 -8.251 1.00 25.00 H new ATOM 0 HD21 ASN A 97 14.298 -14.566 -11.134 1.00 25.00 H new ATOM 0 HD22 ASN A 97 14.701 -12.847 -11.067 1.00 25.00 H new ATOM 1341 N GLY A 98 13.670 -10.043 -6.370 1.00 25.00 N ATOM 1342 CA GLY A 98 14.053 -8.850 -5.620 1.00 25.00 C ATOM 1343 C GLY A 98 14.968 -7.857 -6.312 1.00 25.00 C ATOM 1344 O GLY A 98 15.313 -6.832 -5.725 1.00 25.00 O ATOM 0 H GLY A 98 12.716 -10.020 -6.731 1.00 25.00 H new ATOM 0 HA2 GLY A 98 13.142 -8.325 -5.332 1.00 25.00 H new ATOM 0 HA3 GLY A 98 14.539 -9.172 -4.699 1.00 25.00 H new ATOM 1348 N TYR A 99 15.375 -8.148 -7.539 1.00 25.00 N ATOM 1349 CA TYR A 99 16.294 -7.284 -8.287 1.00 25.00 C ATOM 1350 C TYR A 99 15.836 -7.137 -9.727 1.00 25.00 C ATOM 1351 O TYR A 99 15.100 -7.980 -10.225 1.00 25.00 O ATOM 1352 CB TYR A 99 17.707 -7.875 -8.276 1.00 25.00 C ATOM 1353 CG TYR A 99 18.309 -7.991 -6.892 1.00 25.00 C ATOM 1354 CD1 TYR A 99 18.854 -6.862 -6.246 1.00 25.00 C ATOM 1355 CD2 TYR A 99 18.348 -9.230 -6.223 1.00 25.00 C ATOM 1356 CE1 TYR A 99 19.430 -6.973 -4.949 1.00 25.00 C ATOM 1357 CE2 TYR A 99 18.918 -9.343 -4.924 1.00 25.00 C ATOM 1358 CZ TYR A 99 19.452 -8.211 -4.304 1.00 25.00 C ATOM 1359 OH TYR A 99 20.011 -8.319 -3.054 1.00 25.00 O ATOM 0 H TYR A 99 15.083 -8.983 -8.047 1.00 25.00 H new ATOM 0 HA TYR A 99 16.300 -6.306 -7.807 1.00 25.00 H new ATOM 0 HB2 TYR A 99 17.681 -8.863 -8.735 1.00 25.00 H new ATOM 0 HB3 TYR A 99 18.356 -7.254 -8.893 1.00 25.00 H new ATOM 0 HD1 TYR A 99 18.834 -5.902 -6.741 1.00 25.00 H new ATOM 0 HD2 TYR A 99 17.939 -10.107 -6.703 1.00 25.00 H new ATOM 0 HE1 TYR A 99 19.849 -6.103 -4.466 1.00 25.00 H new ATOM 0 HE2 TYR A 99 18.938 -10.298 -4.421 1.00 25.00 H new ATOM 0 HH TYR A 99 19.945 -9.247 -2.745 1.00 25.00 H new ATOM 1369 N ALA A 100 16.314 -6.092 -10.396 1.00 25.00 N ATOM 1370 CA ALA A 100 16.038 -5.852 -11.818 1.00 25.00 C ATOM 1371 C ALA A 100 14.538 -5.865 -12.149 1.00 25.00 C ATOM 1372 O ALA A 100 14.099 -6.537 -13.081 1.00 25.00 O ATOM 1373 CB ALA A 100 16.806 -6.876 -12.687 1.00 25.00 C ATOM 0 H ALA A 100 16.908 -5.381 -9.969 1.00 25.00 H new ATOM 0 HA ALA A 100 16.390 -4.847 -12.049 1.00 25.00 H new ATOM 0 HB1 ALA A 100 16.595 -6.690 -13.740 1.00 25.00 H new ATOM 0 HB2 ALA A 100 17.876 -6.775 -12.508 1.00 25.00 H new ATOM 0 HB3 ALA A 100 16.488 -7.885 -12.426 1.00 25.00 H new ATOM 1379 N GLY A 101 13.758 -5.127 -11.371 1.00 25.00 N ATOM 1380 CA GLY A 101 12.334 -5.008 -11.634 1.00 25.00 C ATOM 1381 C GLY A 101 11.490 -6.132 -11.076 1.00 25.00 C ATOM 1382 O GLY A 101 10.265 -6.115 -11.230 1.00 25.00 O ATOM 0 H GLY A 101 14.086 -4.606 -10.558 1.00 25.00 H new ATOM 0 HA2 GLY A 101 11.979 -4.065 -11.218 1.00 25.00 H new ATOM 0 HA3 GLY A 101 12.181 -4.958 -12.712 1.00 25.00 H new ATOM 1386 N THR A 102 12.116 -7.108 -10.432 1.00 25.00 N ATOM 1387 CA THR A 102 11.380 -8.231 -9.849 1.00 25.00 C ATOM 1388 C THR A 102 11.239 -7.960 -8.358 1.00 25.00 C ATOM 1389 O THR A 102 11.976 -7.145 -7.799 1.00 25.00 O ATOM 1390 CB THR A 102 12.106 -9.585 -10.047 1.00 25.00 C ATOM 1391 OG1 THR A 102 13.293 -9.612 -9.267 1.00 25.00 O ATOM 1392 CG2 THR A 102 12.517 -9.832 -11.495 1.00 25.00 C ATOM 0 H THR A 102 13.126 -7.149 -10.298 1.00 25.00 H new ATOM 0 HA THR A 102 10.414 -8.309 -10.348 1.00 25.00 H new ATOM 0 HB THR A 102 11.398 -10.356 -9.744 1.00 25.00 H new ATOM 0 HG1 THR A 102 13.950 -8.994 -9.650 1.00 25.00 H new ATOM 0 HG21 THR A 102 13.021 -10.796 -11.571 1.00 25.00 H new ATOM 0 HG22 THR A 102 11.631 -9.835 -12.129 1.00 25.00 H new ATOM 0 HG23 THR A 102 13.194 -9.042 -11.821 1.00 25.00 H new ATOM 1400 N LEU A 103 10.270 -8.599 -7.721 1.00 25.00 N ATOM 1401 CA LEU A 103 9.927 -8.269 -6.337 1.00 25.00 C ATOM 1402 C LEU A 103 10.528 -9.220 -5.327 1.00 25.00 C ATOM 1403 O LEU A 103 10.912 -10.324 -5.657 1.00 25.00 O ATOM 1404 CB LEU A 103 8.400 -8.308 -6.166 1.00 25.00 C ATOM 1405 CG LEU A 103 7.570 -7.378 -7.067 1.00 25.00 C ATOM 1406 CD1 LEU A 103 6.086 -7.674 -6.880 1.00 25.00 C ATOM 1407 CD2 LEU A 103 7.848 -5.920 -6.744 1.00 25.00 C ATOM 0 H LEU A 103 9.708 -9.344 -8.132 1.00 25.00 H new ATOM 0 HA LEU A 103 10.335 -7.276 -6.149 1.00 25.00 H new ATOM 0 HB2 LEU A 103 8.066 -9.331 -6.338 1.00 25.00 H new ATOM 0 HB3 LEU A 103 8.170 -8.068 -5.128 1.00 25.00 H new ATOM 0 HG LEU A 103 7.852 -7.559 -8.104 1.00 25.00 H new ATOM 0 HD11 LEU A 103 5.500 -7.014 -7.519 1.00 25.00 H new ATOM 0 HD12 LEU A 103 5.885 -8.711 -7.148 1.00 25.00 H new ATOM 0 HD13 LEU A 103 5.810 -7.509 -5.838 1.00 25.00 H new ATOM 0 HD21 LEU A 103 7.249 -5.283 -7.395 1.00 25.00 H new ATOM 0 HD22 LEU A 103 7.589 -5.722 -5.704 1.00 25.00 H new ATOM 0 HD23 LEU A 103 8.905 -5.708 -6.902 1.00 25.00 H new ATOM 1419 N ALA A 104 10.528 -8.807 -4.073 1.00 25.00 N ATOM 1420 CA ALA A 104 10.865 -9.685 -2.965 1.00 25.00 C ATOM 1421 C ALA A 104 9.771 -9.467 -1.930 1.00 25.00 C ATOM 1422 O ALA A 104 9.545 -8.344 -1.479 1.00 25.00 O ATOM 1423 CB ALA A 104 12.246 -9.352 -2.395 1.00 25.00 C ATOM 0 H ALA A 104 10.295 -7.854 -3.793 1.00 25.00 H new ATOM 0 HA ALA A 104 10.918 -10.728 -3.279 1.00 25.00 H new ATOM 0 HB1 ALA A 104 12.470 -10.025 -1.568 1.00 25.00 H new ATOM 0 HB2 ALA A 104 12.999 -9.471 -3.174 1.00 25.00 H new ATOM 0 HB3 ALA A 104 12.253 -8.322 -2.037 1.00 25.00 H new ATOM 1429 N VAL A 105 9.075 -10.534 -1.583 1.00 25.00 N ATOM 1430 CA VAL A 105 8.000 -10.468 -0.605 1.00 25.00 C ATOM 1431 C VAL A 105 8.498 -11.186 0.637 1.00 25.00 C ATOM 1432 O VAL A 105 9.221 -12.176 0.547 1.00 25.00 O ATOM 1433 CB VAL A 105 6.676 -11.092 -1.174 1.00 25.00 C ATOM 1434 CG1 VAL A 105 6.877 -12.559 -1.611 1.00 25.00 C ATOM 1435 CG2 VAL A 105 5.529 -10.992 -0.152 1.00 25.00 C ATOM 0 H VAL A 105 9.236 -11.465 -1.967 1.00 25.00 H new ATOM 0 HA VAL A 105 7.748 -9.436 -0.361 1.00 25.00 H new ATOM 0 HB VAL A 105 6.405 -10.513 -2.057 1.00 25.00 H new ATOM 0 HG11 VAL A 105 5.938 -12.955 -1.999 1.00 25.00 H new ATOM 0 HG12 VAL A 105 7.639 -12.606 -2.389 1.00 25.00 H new ATOM 0 HG13 VAL A 105 7.195 -13.153 -0.755 1.00 25.00 H new ATOM 0 HG21 VAL A 105 4.626 -11.432 -0.575 1.00 25.00 H new ATOM 0 HG22 VAL A 105 5.803 -11.528 0.756 1.00 25.00 H new ATOM 0 HG23 VAL A 105 5.345 -9.945 0.087 1.00 25.00 H new ATOM 1445 N SER A 106 8.144 -10.664 1.797 1.00 25.00 N ATOM 1446 CA SER A 106 8.522 -11.278 3.059 1.00 25.00 C ATOM 1447 C SER A 106 7.326 -11.172 3.983 1.00 25.00 C ATOM 1448 O SER A 106 6.447 -10.330 3.774 1.00 25.00 O ATOM 1449 CB SER A 106 9.751 -10.588 3.648 1.00 25.00 C ATOM 1450 OG SER A 106 9.535 -9.198 3.761 1.00 25.00 O ATOM 0 H SER A 106 7.592 -9.811 1.892 1.00 25.00 H new ATOM 0 HA SER A 106 8.793 -12.324 2.918 1.00 25.00 H new ATOM 0 HB2 SER A 106 9.975 -11.007 4.629 1.00 25.00 H new ATOM 0 HB3 SER A 106 10.618 -10.776 3.015 1.00 25.00 H new ATOM 0 HG SER A 106 10.332 -8.773 4.142 1.00 25.00 H new ATOM 1456 N LEU A 107 7.266 -12.064 4.958 1.00 25.00 N ATOM 1457 CA LEU A 107 6.133 -12.173 5.866 1.00 25.00 C ATOM 1458 C LEU A 107 6.648 -12.278 7.286 1.00 25.00 C ATOM 1459 O LEU A 107 7.792 -12.677 7.507 1.00 25.00 O ATOM 1460 CB LEU A 107 5.337 -13.449 5.550 1.00 25.00 C ATOM 1461 CG LEU A 107 4.526 -13.483 4.247 1.00 25.00 C ATOM 1462 CD1 LEU A 107 4.122 -14.920 3.922 1.00 25.00 C ATOM 1463 CD2 LEU A 107 3.277 -12.621 4.367 1.00 25.00 C ATOM 0 H LEU A 107 8.008 -12.739 5.144 1.00 25.00 H new ATOM 0 HA LEU A 107 5.495 -11.297 5.751 1.00 25.00 H new ATOM 0 HB2 LEU A 107 6.037 -14.284 5.530 1.00 25.00 H new ATOM 0 HB3 LEU A 107 4.650 -13.628 6.377 1.00 25.00 H new ATOM 0 HG LEU A 107 5.150 -13.088 3.445 1.00 25.00 H new ATOM 0 HD11 LEU A 107 3.547 -14.936 2.996 1.00 25.00 H new ATOM 0 HD12 LEU A 107 5.016 -15.532 3.804 1.00 25.00 H new ATOM 0 HD13 LEU A 107 3.514 -15.319 4.734 1.00 25.00 H new ATOM 0 HD21 LEU A 107 2.717 -12.659 3.433 1.00 25.00 H new ATOM 0 HD22 LEU A 107 2.654 -12.995 5.179 1.00 25.00 H new ATOM 0 HD23 LEU A 107 3.565 -11.591 4.575 1.00 25.00 H new ATOM 1534 N ARG A 113 1.766 -9.921 8.939 1.00 25.00 N ATOM 1535 CA ARG A 113 2.430 -8.726 8.432 1.00 25.00 C ATOM 1536 C ARG A 113 3.121 -9.134 7.153 1.00 25.00 C ATOM 1537 O ARG A 113 3.615 -10.258 7.047 1.00 25.00 O ATOM 1538 CB ARG A 113 3.441 -8.189 9.446 1.00 25.00 C ATOM 1539 CG ARG A 113 2.924 -8.216 10.873 1.00 25.00 C ATOM 1540 CD ARG A 113 3.855 -7.501 11.834 1.00 25.00 C ATOM 1541 NE ARG A 113 3.542 -7.851 13.230 1.00 25.00 N ATOM 1542 CZ ARG A 113 2.625 -7.259 13.991 1.00 25.00 C ATOM 1543 NH1 ARG A 113 1.888 -6.266 13.578 1.00 25.00 N ATOM 1544 NH2 ARG A 113 2.447 -7.691 15.209 1.00 25.00 N ATOM 0 HA ARG A 113 1.711 -7.926 8.255 1.00 25.00 H new ATOM 0 HB2 ARG A 113 4.355 -8.779 9.386 1.00 25.00 H new ATOM 0 HB3 ARG A 113 3.704 -7.165 9.180 1.00 25.00 H new ATOM 0 HG2 ARG A 113 1.939 -7.750 10.910 1.00 25.00 H new ATOM 0 HG3 ARG A 113 2.799 -9.251 11.193 1.00 25.00 H new ATOM 0 HD2 ARG A 113 4.888 -7.768 11.611 1.00 25.00 H new ATOM 0 HD3 ARG A 113 3.767 -6.423 11.697 1.00 25.00 H new ATOM 0 HE ARG A 113 4.074 -8.613 13.650 1.00 25.00 H new ATOM 0 HH11 ARG A 113 2.001 -5.907 12.630 1.00 25.00 H new ATOM 0 HH12 ARG A 113 1.199 -5.848 14.203 1.00 25.00 H new ATOM 0 HH21 ARG A 113 3.006 -8.468 15.561 1.00 25.00 H new ATOM 0 HH22 ARG A 113 1.749 -7.251 15.809 1.00 25.00 H new ATOM 1558 N THR A 114 3.132 -8.245 6.179 1.00 25.00 N ATOM 1559 CA THR A 114 3.714 -8.529 4.871 1.00 25.00 C ATOM 1560 C THR A 114 4.513 -7.319 4.439 1.00 25.00 C ATOM 1561 O THR A 114 4.106 -6.191 4.687 1.00 25.00 O ATOM 1562 CB THR A 114 2.607 -8.793 3.827 1.00 25.00 C ATOM 1563 OG1 THR A 114 1.658 -9.719 4.363 1.00 25.00 O ATOM 1564 CG2 THR A 114 3.166 -9.363 2.529 1.00 25.00 C ATOM 0 H THR A 114 2.741 -7.307 6.266 1.00 25.00 H new ATOM 0 HA THR A 114 4.346 -9.414 4.941 1.00 25.00 H new ATOM 0 HB THR A 114 2.135 -7.837 3.603 1.00 25.00 H new ATOM 0 HG1 THR A 114 0.954 -9.886 3.702 1.00 25.00 H new ATOM 0 HG21 THR A 114 2.351 -9.532 1.825 1.00 25.00 H new ATOM 0 HG22 THR A 114 3.877 -8.658 2.098 1.00 25.00 H new ATOM 0 HG23 THR A 114 3.671 -10.307 2.734 1.00 25.00 H new ATOM 1572 N TYR A 115 5.642 -7.535 3.789 1.00 25.00 N ATOM 1573 CA TYR A 115 6.457 -6.430 3.308 1.00 25.00 C ATOM 1574 C TYR A 115 6.817 -6.703 1.863 1.00 25.00 C ATOM 1575 O TYR A 115 7.071 -7.850 1.489 1.00 25.00 O ATOM 1576 CB TYR A 115 7.712 -6.290 4.167 1.00 25.00 C ATOM 1577 CG TYR A 115 7.418 -6.399 5.648 1.00 25.00 C ATOM 1578 CD1 TYR A 115 6.889 -5.304 6.363 1.00 25.00 C ATOM 1579 CD2 TYR A 115 7.645 -7.609 6.343 1.00 25.00 C ATOM 1580 CE1 TYR A 115 6.587 -5.415 7.747 1.00 25.00 C ATOM 1581 CE2 TYR A 115 7.345 -7.719 7.728 1.00 25.00 C ATOM 1582 CZ TYR A 115 6.821 -6.623 8.414 1.00 25.00 C ATOM 1583 OH TYR A 115 6.534 -6.726 9.751 1.00 25.00 O ATOM 0 H TYR A 115 6.016 -8.461 3.582 1.00 25.00 H new ATOM 0 HA TYR A 115 5.905 -5.493 3.376 1.00 25.00 H new ATOM 0 HB2 TYR A 115 8.429 -7.061 3.885 1.00 25.00 H new ATOM 0 HB3 TYR A 115 8.182 -5.328 3.963 1.00 25.00 H new ATOM 0 HD1 TYR A 115 6.711 -4.369 5.852 1.00 25.00 H new ATOM 0 HD2 TYR A 115 8.051 -8.460 5.816 1.00 25.00 H new ATOM 0 HE1 TYR A 115 6.178 -4.571 8.282 1.00 25.00 H new ATOM 0 HE2 TYR A 115 7.522 -8.649 8.248 1.00 25.00 H new ATOM 0 HH TYR A 115 6.752 -7.629 10.064 1.00 25.00 H new ATOM 1593 N LEU A 116 6.797 -5.656 1.052 1.00 25.00 N ATOM 1594 CA LEU A 116 7.081 -5.767 -0.374 1.00 25.00 C ATOM 1595 C LEU A 116 8.283 -4.898 -0.698 1.00 25.00 C ATOM 1596 O LEU A 116 8.323 -3.717 -0.344 1.00 25.00 O ATOM 1597 CB LEU A 116 5.869 -5.302 -1.195 1.00 25.00 C ATOM 1598 CG LEU A 116 4.580 -6.131 -1.039 1.00 25.00 C ATOM 1599 CD1 LEU A 116 3.414 -5.410 -1.713 1.00 25.00 C ATOM 1600 CD2 LEU A 116 4.745 -7.524 -1.648 1.00 25.00 C ATOM 0 H LEU A 116 6.584 -4.707 1.361 1.00 25.00 H new ATOM 0 HA LEU A 116 7.291 -6.807 -0.625 1.00 25.00 H new ATOM 0 HB2 LEU A 116 5.647 -4.270 -0.923 1.00 25.00 H new ATOM 0 HB3 LEU A 116 6.149 -5.301 -2.248 1.00 25.00 H new ATOM 0 HG LEU A 116 4.375 -6.243 0.026 1.00 25.00 H new ATOM 0 HD11 LEU A 116 2.506 -6.002 -1.599 1.00 25.00 H new ATOM 0 HD12 LEU A 116 3.272 -4.434 -1.249 1.00 25.00 H new ATOM 0 HD13 LEU A 116 3.631 -5.279 -2.773 1.00 25.00 H new ATOM 0 HD21 LEU A 116 3.820 -8.087 -1.524 1.00 25.00 H new ATOM 0 HD22 LEU A 116 4.974 -7.432 -2.710 1.00 25.00 H new ATOM 0 HD23 LEU A 116 5.559 -8.047 -1.145 1.00 25.00 H new ATOM 1612 N LYS A 117 9.264 -5.497 -1.349 1.00 25.00 N ATOM 1613 CA LYS A 117 10.505 -4.824 -1.718 1.00 25.00 C ATOM 1614 C LYS A 117 10.649 -4.981 -3.230 1.00 25.00 C ATOM 1615 O LYS A 117 10.255 -6.003 -3.775 1.00 25.00 O ATOM 1616 CB LYS A 117 11.682 -5.510 -0.997 1.00 25.00 C ATOM 1617 CG LYS A 117 12.800 -4.596 -0.472 1.00 25.00 C ATOM 1618 CD LYS A 117 13.533 -3.888 -1.598 1.00 25.00 C ATOM 1619 CE LYS A 117 14.769 -3.154 -1.129 1.00 25.00 C ATOM 1620 NZ LYS A 117 15.170 -2.172 -2.196 1.00 25.00 N ATOM 0 H LYS A 117 9.225 -6.474 -1.641 1.00 25.00 H new ATOM 0 HA LYS A 117 10.497 -3.771 -1.437 1.00 25.00 H new ATOM 0 HB2 LYS A 117 11.282 -6.075 -0.155 1.00 25.00 H new ATOM 0 HB3 LYS A 117 12.127 -6.231 -1.683 1.00 25.00 H new ATOM 0 HG2 LYS A 117 12.375 -3.856 0.205 1.00 25.00 H new ATOM 0 HG3 LYS A 117 13.510 -5.187 0.107 1.00 25.00 H new ATOM 0 HD2 LYS A 117 13.817 -4.619 -2.355 1.00 25.00 H new ATOM 0 HD3 LYS A 117 12.856 -3.180 -2.076 1.00 25.00 H new ATOM 0 HE2 LYS A 117 14.569 -2.635 -0.191 1.00 25.00 H new ATOM 0 HE3 LYS A 117 15.579 -3.858 -0.938 1.00 25.00 H new ATOM 0 HZ1 LYS A 117 16.201 -2.037 -2.174 1.00 25.00 H new ATOM 0 HZ2 LYS A 117 14.889 -2.538 -3.128 1.00 25.00 H new ATOM 0 HZ3 LYS A 117 14.698 -1.261 -2.025 1.00 25.00 H new ATOM 1634 N SER A 118 11.248 -3.998 -3.882 1.00 25.00 N ATOM 1635 CA SER A 118 11.577 -4.075 -5.300 1.00 25.00 C ATOM 1636 C SER A 118 12.906 -3.361 -5.456 1.00 25.00 C ATOM 1637 O SER A 118 13.307 -2.595 -4.566 1.00 25.00 O ATOM 1638 CB SER A 118 10.513 -3.374 -6.149 1.00 25.00 C ATOM 1639 OG SER A 118 10.722 -3.635 -7.526 1.00 25.00 O ATOM 0 H SER A 118 11.522 -3.119 -3.442 1.00 25.00 H new ATOM 0 HA SER A 118 11.624 -5.112 -5.633 1.00 25.00 H new ATOM 0 HB2 SER A 118 9.521 -3.717 -5.855 1.00 25.00 H new ATOM 0 HB3 SER A 118 10.545 -2.300 -5.968 1.00 25.00 H new ATOM 0 HG SER A 118 10.032 -3.181 -8.053 1.00 25.00 H new ATOM 1645 N TYR A 119 13.583 -3.583 -6.565 1.00 25.00 N ATOM 1646 CA TYR A 119 14.798 -2.847 -6.896 1.00 25.00 C ATOM 1647 C TYR A 119 14.742 -2.582 -8.387 1.00 25.00 C ATOM 1648 O TYR A 119 14.841 -3.500 -9.211 1.00 25.00 O ATOM 1649 CB TYR A 119 16.057 -3.623 -6.525 1.00 25.00 C ATOM 1650 CG TYR A 119 17.328 -2.907 -6.931 1.00 25.00 C ATOM 1651 CD1 TYR A 119 17.876 -1.888 -6.124 1.00 25.00 C ATOM 1652 CD2 TYR A 119 17.981 -3.230 -8.140 1.00 25.00 C ATOM 1653 CE1 TYR A 119 19.053 -1.202 -6.518 1.00 25.00 C ATOM 1654 CE2 TYR A 119 19.158 -2.545 -8.536 1.00 25.00 C ATOM 1655 CZ TYR A 119 19.683 -1.538 -7.720 1.00 25.00 C ATOM 1656 OH TYR A 119 20.820 -0.870 -8.101 1.00 25.00 O ATOM 0 H TYR A 119 13.312 -4.275 -7.263 1.00 25.00 H new ATOM 0 HA TYR A 119 14.847 -1.918 -6.327 1.00 25.00 H new ATOM 0 HB2 TYR A 119 16.069 -3.793 -5.448 1.00 25.00 H new ATOM 0 HB3 TYR A 119 16.029 -4.602 -7.002 1.00 25.00 H new ATOM 0 HD1 TYR A 119 17.393 -1.627 -5.194 1.00 25.00 H new ATOM 0 HD2 TYR A 119 17.579 -4.009 -8.771 1.00 25.00 H new ATOM 0 HE1 TYR A 119 19.461 -0.423 -5.892 1.00 25.00 H new ATOM 0 HE2 TYR A 119 19.647 -2.800 -9.464 1.00 25.00 H new ATOM 0 HH TYR A 119 21.135 -1.223 -8.959 1.00 25.00 H new ATOM 1758 N SER A 127 12.858 3.055 -6.857 1.00 25.00 N ATOM 1759 CA SER A 127 12.284 1.750 -6.530 1.00 25.00 C ATOM 1760 C SER A 127 11.107 1.945 -5.592 1.00 25.00 C ATOM 1761 O SER A 127 11.098 2.880 -4.785 1.00 25.00 O ATOM 1762 CB SER A 127 13.334 0.870 -5.861 1.00 25.00 C ATOM 1763 OG SER A 127 14.477 0.719 -6.691 1.00 25.00 O ATOM 0 HA SER A 127 11.948 1.263 -7.445 1.00 25.00 H new ATOM 0 HB2 SER A 127 13.628 1.310 -4.908 1.00 25.00 H new ATOM 0 HB3 SER A 127 12.907 -0.109 -5.642 1.00 25.00 H new ATOM 0 HG SER A 127 14.635 1.550 -7.185 1.00 25.00 H new ATOM 1769 N PHE A 128 10.105 1.089 -5.700 1.00 25.00 N ATOM 1770 CA PHE A 128 8.877 1.257 -4.925 1.00 25.00 C ATOM 1771 C PHE A 128 8.673 0.094 -3.971 1.00 25.00 C ATOM 1772 O PHE A 128 8.895 -1.062 -4.317 1.00 25.00 O ATOM 1773 CB PHE A 128 7.713 1.424 -5.890 1.00 25.00 C ATOM 1774 CG PHE A 128 7.992 2.435 -6.966 1.00 25.00 C ATOM 1775 CD1 PHE A 128 8.080 3.805 -6.655 1.00 25.00 C ATOM 1776 CD2 PHE A 128 8.218 2.023 -8.291 1.00 25.00 C ATOM 1777 CE1 PHE A 128 8.401 4.755 -7.655 1.00 25.00 C ATOM 1778 CE2 PHE A 128 8.536 2.964 -9.295 1.00 25.00 C ATOM 1779 CZ PHE A 128 8.625 4.333 -8.976 1.00 25.00 C ATOM 0 H PHE A 128 10.112 0.273 -6.312 1.00 25.00 H new ATOM 0 HA PHE A 128 8.946 2.150 -4.304 1.00 25.00 H new ATOM 0 HB2 PHE A 128 7.487 0.462 -6.351 1.00 25.00 H new ATOM 0 HB3 PHE A 128 6.826 1.727 -5.334 1.00 25.00 H new ATOM 0 HD1 PHE A 128 7.901 4.135 -5.643 1.00 25.00 H new ATOM 0 HD2 PHE A 128 8.148 0.975 -8.544 1.00 25.00 H new ATOM 0 HE1 PHE A 128 8.473 5.803 -7.402 1.00 25.00 H new ATOM 0 HE2 PHE A 128 8.711 2.634 -10.308 1.00 25.00 H new ATOM 0 HZ PHE A 128 8.864 5.055 -9.743 1.00 25.00 H new ATOM 1789 N GLU A 129 8.339 0.421 -2.731 1.00 25.00 N ATOM 1790 CA GLU A 129 8.288 -0.564 -1.654 1.00 25.00 C ATOM 1791 C GLU A 129 7.096 -0.242 -0.753 1.00 25.00 C ATOM 1792 O GLU A 129 6.737 0.930 -0.607 1.00 25.00 O ATOM 1793 CB GLU A 129 9.590 -0.513 -0.846 1.00 25.00 C ATOM 1794 CG GLU A 129 10.866 -0.776 -1.671 1.00 25.00 C ATOM 1795 CD GLU A 129 12.136 -0.751 -0.833 1.00 25.00 C ATOM 1796 OE1 GLU A 129 12.111 -1.222 0.326 1.00 25.00 O ATOM 1797 OE2 GLU A 129 13.182 -0.310 -1.347 1.00 25.00 O ATOM 0 H GLU A 129 8.097 1.369 -2.442 1.00 25.00 H new ATOM 0 HA GLU A 129 8.174 -1.566 -2.068 1.00 25.00 H new ATOM 0 HB2 GLU A 129 9.672 0.467 -0.375 1.00 25.00 H new ATOM 0 HB3 GLU A 129 9.534 -1.248 -0.043 1.00 25.00 H new ATOM 0 HG2 GLU A 129 10.781 -1.746 -2.161 1.00 25.00 H new ATOM 0 HG3 GLU A 129 10.943 -0.026 -2.459 1.00 25.00 H new ATOM 1804 N LEU A 130 6.458 -1.271 -0.204 1.00 25.00 N ATOM 1805 CA LEU A 130 5.217 -1.114 0.578 1.00 25.00 C ATOM 1806 C LEU A 130 5.198 -2.077 1.769 1.00 25.00 C ATOM 1807 O LEU A 130 6.042 -2.975 1.861 1.00 25.00 O ATOM 1808 CB LEU A 130 3.992 -1.425 -0.306 1.00 25.00 C ATOM 1809 CG LEU A 130 3.757 -0.537 -1.540 1.00 25.00 C ATOM 1810 CD1 LEU A 130 4.231 -1.229 -2.825 1.00 25.00 C ATOM 1811 CD2 LEU A 130 2.270 -0.196 -1.659 1.00 25.00 C ATOM 0 H LEU A 130 6.777 -2.236 -0.283 1.00 25.00 H new ATOM 0 HA LEU A 130 5.179 -0.085 0.936 1.00 25.00 H new ATOM 0 HB2 LEU A 130 4.078 -2.457 -0.647 1.00 25.00 H new ATOM 0 HB3 LEU A 130 3.103 -1.369 0.322 1.00 25.00 H new ATOM 0 HG LEU A 130 4.336 0.377 -1.412 1.00 25.00 H new ATOM 0 HD11 LEU A 130 4.051 -0.575 -3.678 1.00 25.00 H new ATOM 0 HD12 LEU A 130 5.297 -1.443 -2.751 1.00 25.00 H new ATOM 0 HD13 LEU A 130 3.682 -2.161 -2.960 1.00 25.00 H new ATOM 0 HD21 LEU A 130 2.110 0.433 -2.535 1.00 25.00 H new ATOM 0 HD22 LEU A 130 1.693 -1.115 -1.762 1.00 25.00 H new ATOM 0 HD23 LEU A 130 1.946 0.337 -0.765 1.00 25.00 H new ATOM 1823 N ALA A 131 4.206 -1.935 2.643 1.00 25.00 N ATOM 1824 CA ALA A 131 4.007 -2.866 3.754 1.00 25.00 C ATOM 1825 C ALA A 131 2.505 -3.058 4.016 1.00 25.00 C ATOM 1826 O ALA A 131 1.702 -2.165 3.750 1.00 25.00 O ATOM 1827 CB ALA A 131 4.708 -2.336 5.008 1.00 25.00 C ATOM 0 H ALA A 131 3.522 -1.179 2.604 1.00 25.00 H new ATOM 0 HA ALA A 131 4.439 -3.832 3.495 1.00 25.00 H new ATOM 0 HB1 ALA A 131 4.556 -3.033 5.832 1.00 25.00 H new ATOM 0 HB2 ALA A 131 5.775 -2.233 4.812 1.00 25.00 H new ATOM 0 HB3 ALA A 131 4.292 -1.364 5.274 1.00 25.00 H new ATOM 1833 N LEU A 132 2.147 -4.215 4.554 1.00 25.00 N ATOM 1834 CA LEU A 132 0.765 -4.540 4.915 1.00 25.00 C ATOM 1835 C LEU A 132 0.793 -5.106 6.326 1.00 25.00 C ATOM 1836 O LEU A 132 1.757 -5.774 6.704 1.00 25.00 O ATOM 1837 CB LEU A 132 0.192 -5.620 3.985 1.00 25.00 C ATOM 1838 CG LEU A 132 0.225 -5.390 2.463 1.00 25.00 C ATOM 1839 CD1 LEU A 132 -0.206 -6.669 1.747 1.00 25.00 C ATOM 1840 CD2 LEU A 132 -0.679 -4.250 2.048 1.00 25.00 C ATOM 0 H LEU A 132 2.809 -4.964 4.756 1.00 25.00 H new ATOM 0 HA LEU A 132 0.148 -3.645 4.835 1.00 25.00 H new ATOM 0 HB2 LEU A 132 0.727 -6.547 4.189 1.00 25.00 H new ATOM 0 HB3 LEU A 132 -0.847 -5.782 4.271 1.00 25.00 H new ATOM 0 HG LEU A 132 1.245 -5.126 2.185 1.00 25.00 H new ATOM 0 HD11 LEU A 132 -0.183 -6.508 0.669 1.00 25.00 H new ATOM 0 HD12 LEU A 132 0.475 -7.479 2.007 1.00 25.00 H new ATOM 0 HD13 LEU A 132 -1.218 -6.934 2.053 1.00 25.00 H new ATOM 0 HD21 LEU A 132 -0.627 -4.120 0.967 1.00 25.00 H new ATOM 0 HD22 LEU A 132 -1.705 -4.475 2.338 1.00 25.00 H new ATOM 0 HD23 LEU A 132 -0.356 -3.332 2.540 1.00 25.00 H new ATOM 1852 N ASP A 133 -0.268 -4.891 7.080 1.00 25.00 N ATOM 1853 CA ASP A 133 -0.411 -5.479 8.412 1.00 25.00 C ATOM 1854 C ASP A 133 -1.880 -5.841 8.613 1.00 25.00 C ATOM 1855 O ASP A 133 -2.752 -5.331 7.905 1.00 25.00 O ATOM 1856 CB ASP A 133 0.074 -4.506 9.484 1.00 25.00 C ATOM 1857 CG ASP A 133 0.699 -5.209 10.669 1.00 25.00 C ATOM 1858 OD1 ASP A 133 0.070 -6.132 11.222 1.00 25.00 O ATOM 1859 OD2 ASP A 133 1.835 -4.845 11.058 1.00 25.00 O ATOM 0 H ASP A 133 -1.055 -4.308 6.795 1.00 25.00 H new ATOM 0 HA ASP A 133 0.201 -6.377 8.498 1.00 25.00 H new ATOM 0 HB2 ASP A 133 0.802 -3.823 9.046 1.00 25.00 H new ATOM 0 HB3 ASP A 133 -0.765 -3.901 9.827 1.00 25.00 H new ATOM 1864 N GLY A 134 -2.155 -6.760 9.525 1.00 25.00 N ATOM 1865 CA GLY A 134 -3.515 -7.245 9.716 1.00 25.00 C ATOM 1866 C GLY A 134 -3.921 -8.112 8.541 1.00 25.00 C ATOM 1867 O GLY A 134 -5.090 -8.231 8.200 1.00 25.00 O ATOM 0 H GLY A 134 -1.461 -7.183 10.141 1.00 25.00 H new ATOM 0 HA2 GLY A 134 -3.580 -7.817 10.641 1.00 25.00 H new ATOM 0 HA3 GLY A 134 -4.201 -6.403 9.813 1.00 25.00 H new ATOM 1871 N ASN A 135 -2.921 -8.681 7.885 1.00 25.00 N ATOM 1872 CA ASN A 135 -3.120 -9.475 6.679 1.00 25.00 C ATOM 1873 C ASN A 135 -3.680 -10.860 6.983 1.00 25.00 C ATOM 1874 O ASN A 135 -3.122 -11.608 7.784 1.00 25.00 O ATOM 1875 CB ASN A 135 -1.772 -9.652 5.973 1.00 25.00 C ATOM 1876 CG ASN A 135 -1.882 -10.484 4.727 1.00 25.00 C ATOM 1877 OD1 ASN A 135 -2.641 -10.171 3.825 1.00 25.00 O ATOM 1878 ND2 ASN A 135 -1.146 -11.559 4.680 1.00 25.00 N ATOM 0 H ASN A 135 -1.946 -8.606 8.174 1.00 25.00 H new ATOM 0 HA ASN A 135 -3.838 -8.945 6.053 1.00 25.00 H new ATOM 0 HB2 ASN A 135 -1.367 -8.673 5.718 1.00 25.00 H new ATOM 0 HB3 ASN A 135 -1.065 -10.120 6.658 1.00 25.00 H new ATOM 0 HD21 ASN A 135 -1.192 -12.174 3.867 1.00 25.00 H new ATOM 0 HD22 ASN A 135 -0.524 -11.785 5.456 1.00 25.00 H new ATOM 1885 N HIS A 136 -4.728 -11.238 6.270 1.00 25.00 N ATOM 1886 CA HIS A 136 -5.252 -12.602 6.342 1.00 25.00 C ATOM 1887 C HIS A 136 -4.361 -13.518 5.525 1.00 25.00 C ATOM 1888 O HIS A 136 -4.603 -13.758 4.355 1.00 25.00 O ATOM 1889 CB HIS A 136 -6.701 -12.664 5.869 1.00 25.00 C ATOM 1890 CG HIS A 136 -7.654 -11.930 6.761 1.00 25.00 C ATOM 1891 ND1 HIS A 136 -7.851 -10.567 6.753 1.00 25.00 N ATOM 1892 CD2 HIS A 136 -8.494 -12.398 7.724 1.00 25.00 C ATOM 1893 CE1 HIS A 136 -8.772 -10.276 7.668 1.00 25.00 C ATOM 1894 NE2 HIS A 136 -9.192 -11.358 8.296 1.00 25.00 N ATOM 0 H HIS A 136 -5.236 -10.624 5.634 1.00 25.00 H new ATOM 0 HA HIS A 136 -5.247 -12.935 7.380 1.00 25.00 H new ATOM 0 HB2 HIS A 136 -6.764 -12.249 4.863 1.00 25.00 H new ATOM 0 HB3 HIS A 136 -7.009 -13.708 5.803 1.00 25.00 H new ATOM 0 HD1 HIS A 136 -7.374 -9.897 6.150 1.00 25.00 H new ATOM 0 HD2 HIS A 136 -8.598 -13.437 8.000 1.00 25.00 H new ATOM 0 HE1 HIS A 136 -9.131 -9.278 7.872 1.00 25.00 H new ATOM 1902 N ALA A 137 -3.337 -14.052 6.179 1.00 25.00 N ATOM 1903 CA ALA A 137 -2.417 -14.997 5.554 1.00 25.00 C ATOM 1904 C ALA A 137 -3.185 -16.233 5.094 1.00 25.00 C ATOM 1905 O ALA A 137 -2.853 -16.849 4.091 1.00 25.00 O ATOM 1906 CB ALA A 137 -1.334 -15.390 6.547 1.00 25.00 C ATOM 0 H ALA A 137 -3.120 -13.844 7.154 1.00 25.00 H new ATOM 0 HA ALA A 137 -1.949 -14.530 4.688 1.00 25.00 H new ATOM 0 HB1 ALA A 137 -0.649 -16.096 6.078 1.00 25.00 H new ATOM 0 HB2 ALA A 137 -0.784 -14.501 6.856 1.00 25.00 H new ATOM 0 HB3 ALA A 137 -1.792 -15.855 7.420 1.00 25.00 H new ATOM 1912 N ALA A 138 -4.246 -16.545 5.830 1.00 25.00 N ATOM 1913 CA ALA A 138 -5.115 -17.665 5.500 1.00 25.00 C ATOM 1914 C ALA A 138 -5.743 -17.482 4.113 1.00 25.00 C ATOM 1915 O ALA A 138 -6.085 -18.460 3.461 1.00 25.00 O ATOM 1916 CB ALA A 138 -6.210 -17.803 6.569 1.00 25.00 C ATOM 0 H ALA A 138 -4.525 -16.032 6.666 1.00 25.00 H new ATOM 0 HA ALA A 138 -4.516 -18.576 5.479 1.00 25.00 H new ATOM 0 HB1 ALA A 138 -6.859 -18.642 6.319 1.00 25.00 H new ATOM 0 HB2 ALA A 138 -5.749 -17.978 7.541 1.00 25.00 H new ATOM 0 HB3 ALA A 138 -6.800 -16.887 6.606 1.00 25.00 H new ATOM 1922 N THR A 139 -5.887 -16.235 3.676 1.00 25.00 N ATOM 1923 CA THR A 139 -6.459 -15.964 2.346 1.00 25.00 C ATOM 1924 C THR A 139 -5.568 -15.054 1.493 1.00 25.00 C ATOM 1925 O THR A 139 -6.075 -14.258 0.698 1.00 25.00 O ATOM 1926 CB THR A 139 -7.852 -15.302 2.464 1.00 25.00 C ATOM 1927 OG1 THR A 139 -7.731 -14.047 3.134 1.00 25.00 O ATOM 1928 CG2 THR A 139 -8.818 -16.173 3.262 1.00 25.00 C ATOM 0 H THR A 139 -5.623 -15.404 4.206 1.00 25.00 H new ATOM 0 HA THR A 139 -6.539 -16.934 1.856 1.00 25.00 H new ATOM 0 HB THR A 139 -8.240 -15.170 1.454 1.00 25.00 H new ATOM 0 HG1 THR A 139 -8.614 -13.628 3.206 1.00 25.00 H new ATOM 0 HG21 THR A 139 -9.787 -15.678 3.325 1.00 25.00 H new ATOM 0 HG22 THR A 139 -8.935 -17.136 2.765 1.00 25.00 H new ATOM 0 HG23 THR A 139 -8.423 -16.328 4.266 1.00 25.00 H new ATOM 1936 N LEU A 140 -4.252 -15.126 1.674 1.00 25.00 N ATOM 1937 CA LEU A 140 -3.349 -14.243 0.927 1.00 25.00 C ATOM 1938 C LEU A 140 -3.450 -14.531 -0.577 1.00 25.00 C ATOM 1939 O LEU A 140 -3.628 -15.672 -0.994 1.00 25.00 O ATOM 1940 CB LEU A 140 -1.898 -14.349 1.436 1.00 25.00 C ATOM 1941 CG LEU A 140 -1.061 -15.584 1.053 1.00 25.00 C ATOM 1942 CD1 LEU A 140 -0.263 -15.360 -0.244 1.00 25.00 C ATOM 1943 CD2 LEU A 140 -0.075 -15.909 2.180 1.00 25.00 C ATOM 0 H LEU A 140 -3.791 -15.770 2.316 1.00 25.00 H new ATOM 0 HA LEU A 140 -3.661 -13.212 1.096 1.00 25.00 H new ATOM 0 HB2 LEU A 140 -1.362 -13.467 1.087 1.00 25.00 H new ATOM 0 HB3 LEU A 140 -1.926 -14.295 2.524 1.00 25.00 H new ATOM 0 HG LEU A 140 -1.755 -16.409 0.894 1.00 25.00 H new ATOM 0 HD11 LEU A 140 0.313 -16.256 -0.476 1.00 25.00 H new ATOM 0 HD12 LEU A 140 -0.951 -15.148 -1.063 1.00 25.00 H new ATOM 0 HD13 LEU A 140 0.415 -14.517 -0.113 1.00 25.00 H new ATOM 0 HD21 LEU A 140 0.516 -16.783 1.906 1.00 25.00 H new ATOM 0 HD22 LEU A 140 0.588 -15.059 2.340 1.00 25.00 H new ATOM 0 HD23 LEU A 140 -0.626 -16.117 3.097 1.00 25.00 H new ATOM 1955 N SER A 141 -3.372 -13.482 -1.383 1.00 25.00 N ATOM 1956 CA SER A 141 -3.537 -13.612 -2.830 1.00 25.00 C ATOM 1957 C SER A 141 -2.857 -12.474 -3.583 1.00 25.00 C ATOM 1958 O SER A 141 -2.800 -11.342 -3.103 1.00 25.00 O ATOM 1959 CB SER A 141 -5.031 -13.600 -3.172 1.00 25.00 C ATOM 1960 OG SER A 141 -5.239 -13.703 -4.573 1.00 25.00 O ATOM 0 H SER A 141 -3.196 -12.530 -1.063 1.00 25.00 H new ATOM 0 HA SER A 141 -3.074 -14.551 -3.134 1.00 25.00 H new ATOM 0 HB2 SER A 141 -5.529 -14.427 -2.666 1.00 25.00 H new ATOM 0 HB3 SER A 141 -5.484 -12.681 -2.801 1.00 25.00 H new ATOM 0 HG SER A 141 -6.200 -13.695 -4.762 1.00 25.00 H new ATOM 1966 N ALA A 142 -2.379 -12.763 -4.786 1.00 25.00 N ATOM 1967 CA ALA A 142 -1.774 -11.745 -5.646 1.00 25.00 C ATOM 1968 C ALA A 142 -2.861 -10.975 -6.414 1.00 25.00 C ATOM 1969 O ALA A 142 -2.587 -9.965 -7.062 1.00 25.00 O ATOM 1970 CB ALA A 142 -0.798 -12.406 -6.631 1.00 25.00 C ATOM 0 H ALA A 142 -2.397 -13.698 -5.193 1.00 25.00 H new ATOM 0 HA ALA A 142 -1.226 -11.039 -5.021 1.00 25.00 H new ATOM 0 HB1 ALA A 142 -0.351 -11.643 -7.268 1.00 25.00 H new ATOM 0 HB2 ALA A 142 -0.013 -12.920 -6.076 1.00 25.00 H new ATOM 0 HB3 ALA A 142 -1.336 -13.125 -7.249 1.00 25.00 H new ATOM 1976 N GLY A 143 -4.094 -11.458 -6.332 1.00 25.00 N ATOM 1977 CA GLY A 143 -5.203 -10.863 -7.070 1.00 25.00 C ATOM 1978 C GLY A 143 -5.560 -9.446 -6.654 1.00 25.00 C ATOM 1979 O GLY A 143 -6.287 -8.755 -7.361 1.00 25.00 O ATOM 0 H GLY A 143 -4.353 -12.262 -5.760 1.00 25.00 H new ATOM 0 HA2 GLY A 143 -4.956 -10.863 -8.132 1.00 25.00 H new ATOM 0 HA3 GLY A 143 -6.083 -11.495 -6.947 1.00 25.00 H new ATOM 1983 N ASN A 144 -5.030 -9.003 -5.525 1.00 25.00 N ATOM 1984 CA ASN A 144 -5.277 -7.652 -5.021 1.00 25.00 C ATOM 1985 C ASN A 144 -4.650 -6.588 -5.919 1.00 25.00 C ATOM 1986 O ASN A 144 -5.068 -5.434 -5.914 1.00 25.00 O ATOM 1987 CB ASN A 144 -4.678 -7.514 -3.618 1.00 25.00 C ATOM 1988 CG ASN A 144 -5.401 -8.347 -2.604 1.00 25.00 C ATOM 1989 OD1 ASN A 144 -6.393 -7.931 -2.058 1.00 25.00 O ATOM 1990 ND2 ASN A 144 -4.916 -9.530 -2.360 1.00 25.00 N ATOM 0 H ASN A 144 -4.419 -9.563 -4.931 1.00 25.00 H new ATOM 0 HA ASN A 144 -6.356 -7.500 -5.002 1.00 25.00 H new ATOM 0 HB2 ASN A 144 -3.629 -7.807 -3.643 1.00 25.00 H new ATOM 0 HB3 ASN A 144 -4.709 -6.468 -3.314 1.00 25.00 H new ATOM 0 HD21 ASN A 144 -5.377 -10.141 -1.686 1.00 25.00 H new ATOM 0 HD22 ASN A 144 -4.075 -9.846 -2.842 1.00 25.00 H new ATOM 1997 N ILE A 145 -3.622 -6.965 -6.660 1.00 25.00 N ATOM 1998 CA ILE A 145 -2.891 -6.018 -7.499 1.00 25.00 C ATOM 1999 C ILE A 145 -3.759 -5.667 -8.711 1.00 25.00 C ATOM 2000 O ILE A 145 -4.375 -6.544 -9.318 1.00 25.00 O ATOM 2001 CB ILE A 145 -1.520 -6.621 -7.955 1.00 25.00 C ATOM 2002 CG1 ILE A 145 -0.696 -7.064 -6.719 1.00 25.00 C ATOM 2003 CG2 ILE A 145 -0.706 -5.577 -8.766 1.00 25.00 C ATOM 2004 CD1 ILE A 145 0.560 -7.889 -7.051 1.00 25.00 C ATOM 0 H ILE A 145 -3.271 -7.922 -6.701 1.00 25.00 H new ATOM 0 HA ILE A 145 -2.676 -5.115 -6.928 1.00 25.00 H new ATOM 0 HB ILE A 145 -1.722 -7.485 -8.589 1.00 25.00 H new ATOM 0 HG12 ILE A 145 -0.396 -6.177 -6.162 1.00 25.00 H new ATOM 0 HG13 ILE A 145 -1.338 -7.651 -6.062 1.00 25.00 H new ATOM 0 HG21 ILE A 145 0.243 -6.015 -9.074 1.00 25.00 H new ATOM 0 HG22 ILE A 145 -1.272 -5.281 -9.649 1.00 25.00 H new ATOM 0 HG23 ILE A 145 -0.517 -4.701 -8.145 1.00 25.00 H new ATOM 0 HD11 ILE A 145 1.075 -8.156 -6.128 1.00 25.00 H new ATOM 0 HD12 ILE A 145 0.270 -8.797 -7.580 1.00 25.00 H new ATOM 0 HD13 ILE A 145 1.226 -7.300 -7.681 1.00 25.00 H new ATOM 2016 N VAL A 146 -3.814 -4.386 -9.059 1.00 25.00 N ATOM 2017 CA VAL A 146 -4.647 -3.898 -10.172 1.00 25.00 C ATOM 2018 C VAL A 146 -4.360 -4.576 -11.524 1.00 25.00 C ATOM 2019 O VAL A 146 -5.243 -4.662 -12.372 1.00 25.00 O ATOM 2020 CB VAL A 146 -4.525 -2.336 -10.296 1.00 25.00 C ATOM 2021 CG1 VAL A 146 -3.145 -1.910 -10.843 1.00 25.00 C ATOM 2022 CG2 VAL A 146 -5.643 -1.757 -11.165 1.00 25.00 C ATOM 0 H VAL A 146 -3.288 -3.652 -8.585 1.00 25.00 H new ATOM 0 HA VAL A 146 -5.672 -4.173 -9.923 1.00 25.00 H new ATOM 0 HB VAL A 146 -4.627 -1.931 -9.289 1.00 25.00 H new ATOM 0 HG11 VAL A 146 -3.101 -0.823 -10.914 1.00 25.00 H new ATOM 0 HG12 VAL A 146 -2.363 -2.262 -10.170 1.00 25.00 H new ATOM 0 HG13 VAL A 146 -2.996 -2.344 -11.832 1.00 25.00 H new ATOM 0 HG21 VAL A 146 -5.530 -0.675 -11.230 1.00 25.00 H new ATOM 0 HG22 VAL A 146 -5.588 -2.189 -12.164 1.00 25.00 H new ATOM 0 HG23 VAL A 146 -6.609 -1.994 -10.720 1.00 25.00 H new ATOM 2032 N PHE A 147 -3.158 -5.109 -11.708 1.00 25.00 N ATOM 2033 CA PHE A 147 -2.801 -5.765 -12.966 1.00 25.00 C ATOM 2034 C PHE A 147 -3.600 -7.051 -13.189 1.00 25.00 C ATOM 2035 O PHE A 147 -3.868 -7.417 -14.333 1.00 25.00 O ATOM 2036 CB PHE A 147 -1.300 -6.084 -12.996 1.00 25.00 C ATOM 2037 CG PHE A 147 -0.412 -4.882 -12.749 1.00 25.00 C ATOM 2038 CD1 PHE A 147 -0.667 -3.646 -13.382 1.00 25.00 C ATOM 2039 CD2 PHE A 147 0.695 -4.985 -11.884 1.00 25.00 C ATOM 2040 CE1 PHE A 147 0.169 -2.520 -13.139 1.00 25.00 C ATOM 2041 CE2 PHE A 147 1.535 -3.872 -11.640 1.00 25.00 C ATOM 2042 CZ PHE A 147 1.270 -2.639 -12.267 1.00 25.00 C ATOM 0 H PHE A 147 -2.416 -5.102 -11.008 1.00 25.00 H new ATOM 0 HA PHE A 147 -3.046 -5.071 -13.770 1.00 25.00 H new ATOM 0 HB2 PHE A 147 -1.085 -6.843 -12.244 1.00 25.00 H new ATOM 0 HB3 PHE A 147 -1.050 -6.515 -13.965 1.00 25.00 H new ATOM 0 HD1 PHE A 147 -1.505 -3.554 -14.057 1.00 25.00 H new ATOM 0 HD2 PHE A 147 0.906 -5.927 -11.400 1.00 25.00 H new ATOM 0 HE1 PHE A 147 -0.040 -1.577 -13.622 1.00 25.00 H new ATOM 0 HE2 PHE A 147 2.379 -3.968 -10.973 1.00 25.00 H new ATOM 0 HZ PHE A 147 1.908 -1.788 -12.080 1.00 25.00 H new