USER MOD reduce.3.24.130724 H: found=0, std=0, add=740, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 740 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 68 SER OG : rot -70:sc= -0.561 USER MOD Set 1.2: A 71 GLN : amide:sc= 0.112 X(o=-0.45,f=-0.5) USER MOD Set 2.1: A 26 HIS : no HD1:sc= -1.28! K(o=0.021!,f=-4.2) USER MOD Set 2.2: A 40 SER OG : rot -96:sc= 1.3 USER MOD Single : A 4 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0.0254 USER MOD Single : A 15 THR OG1 : rot 84:sc= 0.00941 USER MOD Single : A 16 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 GLN : amide:sc= -0.48 X(o=-0.48,f=-0.21) USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 28 THR OG1 : rot 180:sc= -0.724 USER MOD Single : A 30 THR OG1 : rot 88:sc= 0.729 USER MOD Single : A 35 LYS NZ :NH3+ -154:sc= -0.0675 (180deg=-0.481) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 GLN : amide:sc=-0.00214 X(o=-0.0021,f=0) USER MOD Single : A 67 MET CE :methyl -175:sc= -2.04 (180deg=-2.15) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 CYS SG : rot 26:sc= -0.217 USER MOD Single : A 78 SER OG : rot 180:sc= -0.305 USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 TYR OH : rot -147:sc= 0.437 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 88 HIS : no HD1:sc= -0.182 K(o=-0.18,f=-1.2) USER MOD Single : A 95 ASN : amide:sc= -0.232 X(o=-0.23,f=-0.59) USER MOD Single : A 97 THR OG1 : rot 180:sc= 0.027 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 18 N GLY A 2 1.142 -0.382 -2.701 1.00 0.00 N ATOM 19 CA GLY A 2 0.646 -1.062 -3.883 1.00 0.00 C ATOM 20 C GLY A 2 -0.859 -0.949 -4.028 1.00 0.00 C ATOM 21 O GLY A 2 -1.404 -1.174 -5.109 1.00 0.00 O ATOM 0 HA2 GLY A 2 1.126 -0.643 -4.768 1.00 0.00 H new ATOM 0 HA3 GLY A 2 0.926 -2.115 -3.837 1.00 0.00 H new ATOM 25 N VAL A 3 -1.533 -0.602 -2.936 1.00 0.00 N ATOM 26 CA VAL A 3 -2.984 -0.460 -2.946 1.00 0.00 C ATOM 27 C VAL A 3 -3.431 0.682 -2.041 1.00 0.00 C ATOM 28 O VAL A 3 -3.018 0.767 -0.884 1.00 0.00 O ATOM 29 CB VAL A 3 -3.678 -1.760 -2.496 1.00 0.00 C ATOM 30 CG1 VAL A 3 -3.157 -2.199 -1.136 1.00 0.00 C ATOM 31 CG2 VAL A 3 -5.187 -1.574 -2.464 1.00 0.00 C ATOM 0 H VAL A 3 -1.097 -0.414 -2.033 1.00 0.00 H new ATOM 0 HA VAL A 3 -3.273 -0.239 -3.973 1.00 0.00 H new ATOM 0 HB VAL A 3 -3.447 -2.544 -3.217 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -3.658 -3.119 -0.834 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -2.083 -2.374 -1.197 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -3.356 -1.419 -0.401 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -5.661 -2.502 -2.144 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -5.441 -0.777 -1.765 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -5.542 -1.310 -3.460 1.00 0.00 H new ATOM 41 N GLN A 4 -4.277 1.556 -2.574 1.00 0.00 N ATOM 42 CA GLN A 4 -4.780 2.694 -1.813 1.00 0.00 C ATOM 43 C GLN A 4 -6.298 2.626 -1.672 1.00 0.00 C ATOM 44 O GLN A 4 -6.994 2.150 -2.568 1.00 0.00 O ATOM 45 CB GLN A 4 -4.377 4.005 -2.489 1.00 0.00 C ATOM 46 CG GLN A 4 -3.183 4.684 -1.838 1.00 0.00 C ATOM 47 CD GLN A 4 -1.902 3.889 -1.998 1.00 0.00 C ATOM 48 OE1 GLN A 4 -1.471 3.603 -3.115 1.00 0.00 O ATOM 49 NE2 GLN A 4 -1.285 3.529 -0.879 1.00 0.00 N ATOM 0 H GLN A 4 -4.629 1.499 -3.530 1.00 0.00 H new ATOM 0 HA GLN A 4 -4.339 2.657 -0.817 1.00 0.00 H new ATOM 0 HB2 GLN A 4 -4.146 3.808 -3.536 1.00 0.00 H new ATOM 0 HB3 GLN A 4 -5.226 4.688 -2.473 1.00 0.00 H new ATOM 0 HG2 GLN A 4 -3.049 5.673 -2.275 1.00 0.00 H new ATOM 0 HG3 GLN A 4 -3.386 4.829 -0.777 1.00 0.00 H new ATOM 0 HE21 GLN A 4 -1.678 3.788 0.026 1.00 0.00 H new ATOM 0 HE22 GLN A 4 -0.418 2.994 -0.924 1.00 0.00 H new ATOM 58 N VAL A 5 -6.804 3.107 -0.541 1.00 0.00 N ATOM 59 CA VAL A 5 -8.239 3.101 -0.282 1.00 0.00 C ATOM 60 C VAL A 5 -8.758 4.514 -0.038 1.00 0.00 C ATOM 61 O VAL A 5 -8.300 5.207 0.870 1.00 0.00 O ATOM 62 CB VAL A 5 -8.587 2.221 0.933 1.00 0.00 C ATOM 63 CG1 VAL A 5 -7.798 2.663 2.156 1.00 0.00 C ATOM 64 CG2 VAL A 5 -10.082 2.262 1.209 1.00 0.00 C ATOM 0 H VAL A 5 -6.241 3.506 0.211 1.00 0.00 H new ATOM 0 HA VAL A 5 -8.719 2.688 -1.169 1.00 0.00 H new ATOM 0 HB VAL A 5 -8.311 1.191 0.705 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -8.057 2.030 3.005 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -6.731 2.577 1.951 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -8.040 3.700 2.390 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -10.310 1.635 2.071 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -10.386 3.288 1.416 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -10.623 1.893 0.338 1.00 0.00 H new ATOM 74 N VAL A 6 -9.718 4.935 -0.855 1.00 0.00 N ATOM 75 CA VAL A 6 -10.302 6.264 -0.728 1.00 0.00 C ATOM 76 C VAL A 6 -11.725 6.190 -0.184 1.00 0.00 C ATOM 77 O VAL A 6 -12.665 5.870 -0.912 1.00 0.00 O ATOM 78 CB VAL A 6 -10.320 7.002 -2.080 1.00 0.00 C ATOM 79 CG1 VAL A 6 -10.754 8.448 -1.894 1.00 0.00 C ATOM 80 CG2 VAL A 6 -8.953 6.928 -2.744 1.00 0.00 C ATOM 0 H VAL A 6 -10.108 4.374 -1.612 1.00 0.00 H new ATOM 0 HA VAL A 6 -9.676 6.818 -0.028 1.00 0.00 H new ATOM 0 HB VAL A 6 -11.043 6.513 -2.732 1.00 0.00 H new ATOM 0 HG11 VAL A 6 -10.761 8.953 -2.860 1.00 0.00 H new ATOM 0 HG12 VAL A 6 -11.755 8.475 -1.464 1.00 0.00 H new ATOM 0 HG13 VAL A 6 -10.058 8.954 -1.225 1.00 0.00 H new ATOM 0 HG21 VAL A 6 -8.983 7.454 -3.698 1.00 0.00 H new ATOM 0 HG22 VAL A 6 -8.209 7.392 -2.097 1.00 0.00 H new ATOM 0 HG23 VAL A 6 -8.687 5.885 -2.913 1.00 0.00 H new ATOM 90 N THR A 7 -11.877 6.489 1.103 1.00 0.00 N ATOM 91 CA THR A 7 -13.184 6.455 1.746 1.00 0.00 C ATOM 92 C THR A 7 -14.206 7.265 0.956 1.00 0.00 C ATOM 93 O THR A 7 -13.963 8.421 0.608 1.00 0.00 O ATOM 94 CB THR A 7 -13.117 6.999 3.185 1.00 0.00 C ATOM 95 OG1 THR A 7 -11.895 6.587 3.808 1.00 0.00 O ATOM 96 CG2 THR A 7 -14.301 6.510 4.005 1.00 0.00 C ATOM 0 H THR A 7 -11.110 6.757 1.720 1.00 0.00 H new ATOM 0 HA THR A 7 -13.495 5.411 1.775 1.00 0.00 H new ATOM 0 HB THR A 7 -13.152 8.088 3.140 1.00 0.00 H new ATOM 0 HG1 THR A 7 -11.859 6.938 4.722 1.00 0.00 H new ATOM 0 HG21 THR A 7 -14.231 6.907 5.018 1.00 0.00 H new ATOM 0 HG22 THR A 7 -15.228 6.851 3.544 1.00 0.00 H new ATOM 0 HG23 THR A 7 -14.293 5.421 4.042 1.00 0.00 H new ATOM 104 N LEU A 8 -15.351 6.651 0.676 1.00 0.00 N ATOM 105 CA LEU A 8 -16.412 7.316 -0.073 1.00 0.00 C ATOM 106 C LEU A 8 -17.678 7.439 0.769 1.00 0.00 C ATOM 107 O LEU A 8 -18.294 8.503 0.830 1.00 0.00 O ATOM 108 CB LEU A 8 -16.714 6.546 -1.360 1.00 0.00 C ATOM 109 CG LEU A 8 -15.586 6.493 -2.391 1.00 0.00 C ATOM 110 CD1 LEU A 8 -15.677 5.219 -3.216 1.00 0.00 C ATOM 111 CD2 LEU A 8 -15.629 7.718 -3.292 1.00 0.00 C ATOM 0 H LEU A 8 -15.568 5.695 0.956 1.00 0.00 H new ATOM 0 HA LEU A 8 -16.069 8.319 -0.329 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -16.984 5.524 -1.093 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -17.589 6.994 -1.831 1.00 0.00 H new ATOM 0 HG LEU A 8 -14.634 6.491 -1.860 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -14.866 5.199 -3.944 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -15.596 4.353 -2.559 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -16.634 5.191 -3.737 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -14.819 7.663 -4.019 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -16.585 7.752 -3.815 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -15.514 8.618 -2.688 1.00 0.00 H new ATOM 123 N ALA A 9 -18.059 6.344 1.419 1.00 0.00 N ATOM 124 CA ALA A 9 -19.249 6.331 2.260 1.00 0.00 C ATOM 125 C ALA A 9 -19.014 5.520 3.530 1.00 0.00 C ATOM 126 O ALA A 9 -19.075 4.291 3.513 1.00 0.00 O ATOM 127 CB ALA A 9 -20.435 5.774 1.488 1.00 0.00 C ATOM 0 H ALA A 9 -17.561 5.455 1.379 1.00 0.00 H new ATOM 0 HA ALA A 9 -19.469 7.358 2.551 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -21.317 5.770 2.129 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -20.625 6.396 0.613 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -20.215 4.756 1.168 1.00 0.00 H new ATOM 133 N ALA A 10 -18.745 6.216 4.630 1.00 0.00 N ATOM 134 CA ALA A 10 -18.502 5.560 5.909 1.00 0.00 C ATOM 135 C ALA A 10 -19.622 4.582 6.245 1.00 0.00 C ATOM 136 O ALA A 10 -20.797 4.865 6.015 1.00 0.00 O ATOM 137 CB ALA A 10 -18.353 6.596 7.013 1.00 0.00 C ATOM 0 H ALA A 10 -18.690 7.234 4.661 1.00 0.00 H new ATOM 0 HA ALA A 10 -17.574 4.994 5.830 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -18.172 6.092 7.963 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -17.514 7.253 6.785 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -19.267 7.186 7.084 1.00 0.00 H new ATOM 143 N GLY A 11 -19.251 3.428 6.792 1.00 0.00 N ATOM 144 CA GLY A 11 -20.236 2.425 7.151 1.00 0.00 C ATOM 145 C GLY A 11 -20.417 2.300 8.651 1.00 0.00 C ATOM 146 O GLY A 11 -20.599 3.299 9.346 1.00 0.00 O ATOM 0 H GLY A 11 -18.285 3.170 6.993 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -21.192 2.679 6.693 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -19.933 1.461 6.743 1.00 0.00 H new ATOM 150 N ASP A 12 -20.367 1.070 9.150 1.00 0.00 N ATOM 151 CA ASP A 12 -20.528 0.818 10.578 1.00 0.00 C ATOM 152 C ASP A 12 -19.200 0.980 11.311 1.00 0.00 C ATOM 153 O ASP A 12 -19.170 1.152 12.529 1.00 0.00 O ATOM 154 CB ASP A 12 -21.084 -0.588 10.809 1.00 0.00 C ATOM 155 CG ASP A 12 -20.028 -1.663 10.640 1.00 0.00 C ATOM 156 OD1 ASP A 12 -19.144 -1.495 9.775 1.00 0.00 O ATOM 157 OD2 ASP A 12 -20.087 -2.673 11.373 1.00 0.00 O ATOM 0 H ASP A 12 -20.216 0.232 8.588 1.00 0.00 H new ATOM 0 HA ASP A 12 -21.233 1.549 10.974 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -21.503 -0.649 11.813 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -21.901 -0.772 10.111 1.00 0.00 H new ATOM 162 N GLU A 13 -18.104 0.922 10.560 1.00 0.00 N ATOM 163 CA GLU A 13 -16.773 1.061 11.140 1.00 0.00 C ATOM 164 C GLU A 13 -16.683 0.330 12.476 1.00 0.00 C ATOM 165 O GLU A 13 -16.092 0.832 13.432 1.00 0.00 O ATOM 166 CB GLU A 13 -16.427 2.539 11.330 1.00 0.00 C ATOM 167 CG GLU A 13 -17.332 3.254 12.319 1.00 0.00 C ATOM 168 CD GLU A 13 -16.736 4.555 12.820 1.00 0.00 C ATOM 169 OE1 GLU A 13 -15.704 4.502 13.523 1.00 0.00 O ATOM 170 OE2 GLU A 13 -17.300 5.625 12.511 1.00 0.00 O ATOM 0 H GLU A 13 -18.112 0.780 9.550 1.00 0.00 H new ATOM 0 HA GLU A 13 -16.056 0.613 10.452 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -15.395 2.621 11.670 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -16.486 3.044 10.366 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -18.292 3.457 11.845 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -17.527 2.598 13.167 1.00 0.00 H new ATOM 177 N ALA A 14 -17.276 -0.858 12.536 1.00 0.00 N ATOM 178 CA ALA A 14 -17.262 -1.658 13.753 1.00 0.00 C ATOM 179 C ALA A 14 -17.059 -3.136 13.437 1.00 0.00 C ATOM 180 O ALA A 14 -16.330 -3.839 14.138 1.00 0.00 O ATOM 181 CB ALA A 14 -18.553 -1.456 14.533 1.00 0.00 C ATOM 0 H ALA A 14 -17.772 -1.287 11.755 1.00 0.00 H new ATOM 0 HA ALA A 14 -16.424 -1.326 14.366 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -18.528 -2.060 15.440 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -18.656 -0.404 14.800 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -19.401 -1.759 13.918 1.00 0.00 H new ATOM 187 N THR A 15 -17.710 -3.604 12.375 1.00 0.00 N ATOM 188 CA THR A 15 -17.602 -4.999 11.967 1.00 0.00 C ATOM 189 C THR A 15 -16.714 -5.144 10.736 1.00 0.00 C ATOM 190 O THR A 15 -17.064 -4.686 9.648 1.00 0.00 O ATOM 191 CB THR A 15 -18.986 -5.603 11.662 1.00 0.00 C ATOM 192 OG1 THR A 15 -19.850 -5.443 12.792 1.00 0.00 O ATOM 193 CG2 THR A 15 -18.867 -7.079 11.313 1.00 0.00 C ATOM 0 H THR A 15 -18.317 -3.037 11.783 1.00 0.00 H new ATOM 0 HA THR A 15 -17.154 -5.539 12.801 1.00 0.00 H new ATOM 0 HB THR A 15 -19.407 -5.076 10.806 1.00 0.00 H new ATOM 0 HG1 THR A 15 -20.252 -4.550 12.772 1.00 0.00 H new ATOM 0 HG21 THR A 15 -19.857 -7.484 11.102 1.00 0.00 H new ATOM 0 HG22 THR A 15 -18.232 -7.195 10.435 1.00 0.00 H new ATOM 0 HG23 THR A 15 -18.427 -7.617 12.153 1.00 0.00 H new ATOM 201 N TYR A 16 -15.565 -5.785 10.914 1.00 0.00 N ATOM 202 CA TYR A 16 -14.626 -5.990 9.818 1.00 0.00 C ATOM 203 C TYR A 16 -14.496 -7.472 9.481 1.00 0.00 C ATOM 204 O TYR A 16 -14.728 -8.347 10.315 1.00 0.00 O ATOM 205 CB TYR A 16 -13.255 -5.416 10.179 1.00 0.00 C ATOM 206 CG TYR A 16 -13.255 -3.914 10.359 1.00 0.00 C ATOM 207 CD1 TYR A 16 -13.851 -3.328 11.468 1.00 0.00 C ATOM 208 CD2 TYR A 16 -12.660 -3.083 9.418 1.00 0.00 C ATOM 209 CE1 TYR A 16 -13.855 -1.957 11.636 1.00 0.00 C ATOM 210 CE2 TYR A 16 -12.657 -1.710 9.579 1.00 0.00 C ATOM 211 CZ TYR A 16 -13.256 -1.152 10.689 1.00 0.00 C ATOM 212 OH TYR A 16 -13.256 0.214 10.851 1.00 0.00 O ATOM 0 H TYR A 16 -15.261 -6.172 11.807 1.00 0.00 H new ATOM 0 HA TYR A 16 -15.012 -5.469 8.942 1.00 0.00 H new ATOM 0 HB2 TYR A 16 -12.906 -5.884 11.099 1.00 0.00 H new ATOM 0 HB3 TYR A 16 -12.543 -5.680 9.397 1.00 0.00 H new ATOM 0 HD1 TYR A 16 -14.320 -3.955 12.212 1.00 0.00 H new ATOM 0 HD2 TYR A 16 -12.192 -3.517 8.547 1.00 0.00 H new ATOM 0 HE1 TYR A 16 -14.324 -1.518 12.504 1.00 0.00 H new ATOM 0 HE2 TYR A 16 -12.188 -1.078 8.840 1.00 0.00 H new ATOM 0 HH TYR A 16 -12.792 0.633 10.096 1.00 0.00 H new ATOM 222 N PRO A 17 -14.116 -7.761 8.227 1.00 0.00 N ATOM 223 CA PRO A 17 -13.945 -9.137 7.750 1.00 0.00 C ATOM 224 C PRO A 17 -12.738 -9.823 8.379 1.00 0.00 C ATOM 225 O PRO A 17 -11.654 -9.244 8.461 1.00 0.00 O ATOM 226 CB PRO A 17 -13.738 -8.966 6.243 1.00 0.00 C ATOM 227 CG PRO A 17 -13.192 -7.588 6.089 1.00 0.00 C ATOM 228 CD PRO A 17 -13.823 -6.768 7.180 1.00 0.00 C ATOM 0 HA PRO A 17 -14.796 -9.767 8.009 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -13.046 -9.712 5.851 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -14.675 -9.084 5.699 1.00 0.00 H new ATOM 0 HG2 PRO A 17 -12.106 -7.586 6.178 1.00 0.00 H new ATOM 0 HG3 PRO A 17 -13.432 -7.181 5.107 1.00 0.00 H new ATOM 0 HD2 PRO A 17 -13.148 -5.991 7.540 1.00 0.00 H new ATOM 0 HD3 PRO A 17 -14.728 -6.269 6.835 1.00 0.00 H new ATOM 236 N LYS A 18 -12.931 -11.061 8.821 1.00 0.00 N ATOM 237 CA LYS A 18 -11.857 -11.828 9.442 1.00 0.00 C ATOM 238 C LYS A 18 -11.006 -12.526 8.385 1.00 0.00 C ATOM 239 O LYS A 18 -11.524 -13.019 7.384 1.00 0.00 O ATOM 240 CB LYS A 18 -12.436 -12.863 10.410 1.00 0.00 C ATOM 241 CG LYS A 18 -11.498 -13.220 11.550 1.00 0.00 C ATOM 242 CD LYS A 18 -11.649 -12.260 12.718 1.00 0.00 C ATOM 243 CE LYS A 18 -10.681 -11.092 12.608 1.00 0.00 C ATOM 244 NZ LYS A 18 -10.323 -10.540 13.944 1.00 0.00 N ATOM 0 H LYS A 18 -13.821 -11.555 8.761 1.00 0.00 H new ATOM 0 HA LYS A 18 -11.223 -11.136 9.996 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -13.368 -12.479 10.824 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -12.682 -13.769 9.856 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -11.702 -14.237 11.885 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -10.468 -13.202 11.194 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -12.672 -11.884 12.752 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -11.474 -12.792 13.653 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -9.776 -11.418 12.095 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -11.128 -10.306 11.998 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -9.662 -9.746 13.826 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -11.183 -10.206 14.423 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -9.874 -11.282 14.517 1.00 0.00 H new ATOM 258 N ALA A 19 -9.698 -12.564 8.617 1.00 0.00 N ATOM 259 CA ALA A 19 -8.776 -13.204 7.687 1.00 0.00 C ATOM 260 C ALA A 19 -9.123 -14.677 7.496 1.00 0.00 C ATOM 261 O ALA A 19 -9.215 -15.433 8.462 1.00 0.00 O ATOM 262 CB ALA A 19 -7.344 -13.057 8.178 1.00 0.00 C ATOM 0 H ALA A 19 -9.253 -12.159 9.441 1.00 0.00 H new ATOM 0 HA ALA A 19 -8.870 -12.707 6.721 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -6.666 -13.540 7.474 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -7.093 -11.999 8.256 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -7.245 -13.527 9.157 1.00 0.00 H new ATOM 268 N GLY A 20 -9.316 -15.077 6.243 1.00 0.00 N ATOM 269 CA GLY A 20 -9.652 -16.458 5.949 1.00 0.00 C ATOM 270 C GLY A 20 -11.148 -16.704 5.948 1.00 0.00 C ATOM 271 O GLY A 20 -11.603 -17.799 5.619 1.00 0.00 O ATOM 0 H GLY A 20 -9.246 -14.470 5.426 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -9.242 -16.729 4.976 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -9.181 -17.108 6.686 1.00 0.00 H new ATOM 275 N GLN A 21 -11.913 -15.683 6.319 1.00 0.00 N ATOM 276 CA GLN A 21 -13.367 -15.794 6.362 1.00 0.00 C ATOM 277 C GLN A 21 -13.993 -15.244 5.086 1.00 0.00 C ATOM 278 O GLN A 21 -13.344 -14.531 4.320 1.00 0.00 O ATOM 279 CB GLN A 21 -13.920 -15.050 7.579 1.00 0.00 C ATOM 280 CG GLN A 21 -14.590 -15.961 8.596 1.00 0.00 C ATOM 281 CD GLN A 21 -14.982 -15.229 9.864 1.00 0.00 C ATOM 282 OE1 GLN A 21 -14.758 -15.719 10.972 1.00 0.00 O ATOM 283 NE2 GLN A 21 -15.571 -14.049 9.710 1.00 0.00 N ATOM 0 H GLN A 21 -11.551 -14.770 6.594 1.00 0.00 H new ATOM 0 HA GLN A 21 -13.624 -16.850 6.443 1.00 0.00 H new ATOM 0 HB2 GLN A 21 -13.107 -14.512 8.066 1.00 0.00 H new ATOM 0 HB3 GLN A 21 -14.640 -14.304 7.242 1.00 0.00 H new ATOM 0 HG2 GLN A 21 -15.478 -16.407 8.149 1.00 0.00 H new ATOM 0 HG3 GLN A 21 -13.914 -16.779 8.847 1.00 0.00 H new ATOM 0 HE21 GLN A 21 -15.737 -13.680 8.774 1.00 0.00 H new ATOM 0 HE22 GLN A 21 -15.857 -13.511 10.528 1.00 0.00 H new ATOM 292 N VAL A 22 -15.260 -15.578 4.862 1.00 0.00 N ATOM 293 CA VAL A 22 -15.975 -15.117 3.678 1.00 0.00 C ATOM 294 C VAL A 22 -16.520 -13.707 3.880 1.00 0.00 C ATOM 295 O VAL A 22 -17.029 -13.375 4.950 1.00 0.00 O ATOM 296 CB VAL A 22 -17.140 -16.060 3.323 1.00 0.00 C ATOM 297 CG1 VAL A 22 -17.802 -15.625 2.024 1.00 0.00 C ATOM 298 CG2 VAL A 22 -16.651 -17.497 3.227 1.00 0.00 C ATOM 0 H VAL A 22 -15.813 -16.167 5.485 1.00 0.00 H new ATOM 0 HA VAL A 22 -15.258 -15.113 2.857 1.00 0.00 H new ATOM 0 HB VAL A 22 -17.884 -16.006 4.118 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -18.623 -16.303 1.789 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -18.188 -14.612 2.134 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -17.070 -15.648 1.217 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -17.487 -18.150 2.975 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -15.887 -17.571 2.453 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -16.228 -17.802 4.184 1.00 0.00 H new ATOM 308 N ALA A 23 -16.410 -12.882 2.844 1.00 0.00 N ATOM 309 CA ALA A 23 -16.894 -11.509 2.907 1.00 0.00 C ATOM 310 C ALA A 23 -17.668 -11.141 1.646 1.00 0.00 C ATOM 311 O ALA A 23 -17.224 -11.414 0.530 1.00 0.00 O ATOM 312 CB ALA A 23 -15.732 -10.549 3.113 1.00 0.00 C ATOM 0 H ALA A 23 -15.990 -13.141 1.951 1.00 0.00 H new ATOM 0 HA ALA A 23 -17.573 -11.428 3.756 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -16.108 -9.527 3.158 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -15.222 -10.790 4.046 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -15.032 -10.642 2.283 1.00 0.00 H new ATOM 318 N VAL A 24 -18.830 -10.522 1.829 1.00 0.00 N ATOM 319 CA VAL A 24 -19.667 -10.117 0.706 1.00 0.00 C ATOM 320 C VAL A 24 -19.622 -8.606 0.504 1.00 0.00 C ATOM 321 O VAL A 24 -19.988 -7.839 1.395 1.00 0.00 O ATOM 322 CB VAL A 24 -21.129 -10.554 0.909 1.00 0.00 C ATOM 323 CG1 VAL A 24 -21.941 -10.307 -0.353 1.00 0.00 C ATOM 324 CG2 VAL A 24 -21.196 -12.018 1.317 1.00 0.00 C ATOM 0 H VAL A 24 -19.213 -10.290 2.745 1.00 0.00 H new ATOM 0 HA VAL A 24 -19.268 -10.611 -0.180 1.00 0.00 H new ATOM 0 HB VAL A 24 -21.560 -9.956 1.712 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -22.972 -10.622 -0.190 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -21.921 -9.245 -0.597 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -21.514 -10.877 -1.178 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -22.237 -12.310 1.456 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -20.748 -12.634 0.537 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -20.651 -12.161 2.250 1.00 0.00 H new ATOM 334 N VAL A 25 -19.172 -8.185 -0.673 1.00 0.00 N ATOM 335 CA VAL A 25 -19.081 -6.766 -0.994 1.00 0.00 C ATOM 336 C VAL A 25 -19.410 -6.511 -2.460 1.00 0.00 C ATOM 337 O VAL A 25 -19.554 -7.447 -3.247 1.00 0.00 O ATOM 338 CB VAL A 25 -17.677 -6.210 -0.690 1.00 0.00 C ATOM 339 CG1 VAL A 25 -17.168 -6.743 0.641 1.00 0.00 C ATOM 340 CG2 VAL A 25 -16.713 -6.556 -1.815 1.00 0.00 C ATOM 0 H VAL A 25 -18.864 -8.807 -1.421 1.00 0.00 H new ATOM 0 HA VAL A 25 -19.810 -6.253 -0.367 1.00 0.00 H new ATOM 0 HB VAL A 25 -17.743 -5.124 -0.618 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -16.175 -6.339 0.839 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -17.848 -6.441 1.438 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -17.116 -7.831 0.601 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -15.726 -6.156 -1.584 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -16.650 -7.639 -1.920 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -17.072 -6.121 -2.748 1.00 0.00 H new ATOM 350 N HIS A 26 -19.528 -5.237 -2.822 1.00 0.00 N ATOM 351 CA HIS A 26 -19.840 -4.859 -4.196 1.00 0.00 C ATOM 352 C HIS A 26 -18.651 -4.160 -4.850 1.00 0.00 C ATOM 353 O HIS A 26 -18.190 -3.122 -4.373 1.00 0.00 O ATOM 354 CB HIS A 26 -21.065 -3.945 -4.230 1.00 0.00 C ATOM 355 CG HIS A 26 -22.316 -4.638 -4.677 1.00 0.00 C ATOM 356 ND1 HIS A 26 -22.397 -5.367 -5.845 1.00 0.00 N ATOM 357 CD2 HIS A 26 -23.540 -4.712 -4.104 1.00 0.00 C ATOM 358 CE1 HIS A 26 -23.617 -5.857 -5.971 1.00 0.00 C ATOM 359 NE2 HIS A 26 -24.330 -5.475 -4.928 1.00 0.00 N ATOM 0 H HIS A 26 -19.412 -4.450 -2.184 1.00 0.00 H new ATOM 0 HA HIS A 26 -20.059 -5.768 -4.756 1.00 0.00 H new ATOM 0 HB2 HIS A 26 -21.225 -3.529 -3.236 1.00 0.00 H new ATOM 0 HB3 HIS A 26 -20.865 -3.107 -4.898 1.00 0.00 H new ATOM 0 HD2 HIS A 26 -23.840 -4.256 -3.172 1.00 0.00 H new ATOM 0 HE1 HIS A 26 -23.971 -6.467 -6.789 1.00 0.00 H new ATOM 0 HE2 HIS A 26 -25.309 -5.709 -4.761 1.00 0.00 H new ATOM 367 N TYR A 27 -18.160 -4.735 -5.942 1.00 0.00 N ATOM 368 CA TYR A 27 -17.024 -4.169 -6.659 1.00 0.00 C ATOM 369 C TYR A 27 -17.484 -3.429 -7.911 1.00 0.00 C ATOM 370 O TYR A 27 -18.406 -3.864 -8.601 1.00 0.00 O ATOM 371 CB TYR A 27 -16.033 -5.270 -7.038 1.00 0.00 C ATOM 372 CG TYR A 27 -16.568 -6.236 -8.072 1.00 0.00 C ATOM 373 CD1 TYR A 27 -16.526 -5.928 -9.426 1.00 0.00 C ATOM 374 CD2 TYR A 27 -17.115 -7.456 -7.694 1.00 0.00 C ATOM 375 CE1 TYR A 27 -17.014 -6.807 -10.374 1.00 0.00 C ATOM 376 CE2 TYR A 27 -17.605 -8.341 -8.635 1.00 0.00 C ATOM 377 CZ TYR A 27 -17.553 -8.012 -9.973 1.00 0.00 C ATOM 378 OH TYR A 27 -18.039 -8.890 -10.914 1.00 0.00 O ATOM 0 H TYR A 27 -18.531 -5.593 -6.350 1.00 0.00 H new ATOM 0 HA TYR A 27 -16.529 -3.456 -5.999 1.00 0.00 H new ATOM 0 HB2 TYR A 27 -15.121 -4.811 -7.419 1.00 0.00 H new ATOM 0 HB3 TYR A 27 -15.759 -5.826 -6.141 1.00 0.00 H new ATOM 0 HD1 TYR A 27 -16.105 -4.985 -9.743 1.00 0.00 H new ATOM 0 HD2 TYR A 27 -17.158 -7.717 -6.647 1.00 0.00 H new ATOM 0 HE1 TYR A 27 -16.974 -6.552 -11.423 1.00 0.00 H new ATOM 0 HE2 TYR A 27 -18.027 -9.286 -8.324 1.00 0.00 H new ATOM 0 HH TYR A 27 -18.383 -9.692 -10.467 1.00 0.00 H new ATOM 388 N THR A 28 -16.832 -2.306 -8.200 1.00 0.00 N ATOM 389 CA THR A 28 -17.173 -1.504 -9.368 1.00 0.00 C ATOM 390 C THR A 28 -15.919 -1.047 -10.106 1.00 0.00 C ATOM 391 O THR A 28 -15.008 -0.477 -9.507 1.00 0.00 O ATOM 392 CB THR A 28 -18.005 -0.268 -8.978 1.00 0.00 C ATOM 393 OG1 THR A 28 -19.235 -0.677 -8.370 1.00 0.00 O ATOM 394 CG2 THR A 28 -18.298 0.594 -10.197 1.00 0.00 C ATOM 0 H THR A 28 -16.065 -1.932 -7.641 1.00 0.00 H new ATOM 0 HA THR A 28 -17.767 -2.139 -10.025 1.00 0.00 H new ATOM 0 HB THR A 28 -17.427 0.321 -8.266 1.00 0.00 H new ATOM 0 HG1 THR A 28 -19.757 0.115 -8.124 1.00 0.00 H new ATOM 0 HG21 THR A 28 -18.887 1.461 -9.897 1.00 0.00 H new ATOM 0 HG22 THR A 28 -17.360 0.928 -10.640 1.00 0.00 H new ATOM 0 HG23 THR A 28 -18.858 0.011 -10.929 1.00 0.00 H new ATOM 402 N GLY A 29 -15.880 -1.300 -11.410 1.00 0.00 N ATOM 403 CA GLY A 29 -14.734 -0.907 -12.208 1.00 0.00 C ATOM 404 C GLY A 29 -14.579 0.598 -12.298 1.00 0.00 C ATOM 405 O GLY A 29 -15.567 1.331 -12.339 1.00 0.00 O ATOM 0 H GLY A 29 -16.622 -1.770 -11.928 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -13.830 -1.337 -11.777 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -14.836 -1.319 -13.212 1.00 0.00 H new ATOM 409 N THR A 30 -13.333 1.063 -12.328 1.00 0.00 N ATOM 410 CA THR A 30 -13.051 2.490 -12.410 1.00 0.00 C ATOM 411 C THR A 30 -11.578 2.744 -12.708 1.00 0.00 C ATOM 412 O THR A 30 -10.702 2.043 -12.198 1.00 0.00 O ATOM 413 CB THR A 30 -13.432 3.214 -11.105 1.00 0.00 C ATOM 414 OG1 THR A 30 -13.991 2.282 -10.172 1.00 0.00 O ATOM 415 CG2 THR A 30 -14.431 4.329 -11.376 1.00 0.00 C ATOM 0 H THR A 30 -12.503 0.471 -12.297 1.00 0.00 H new ATOM 0 HA THR A 30 -13.656 2.885 -13.226 1.00 0.00 H new ATOM 0 HB THR A 30 -12.528 3.652 -10.682 1.00 0.00 H new ATOM 0 HG1 THR A 30 -13.272 1.874 -9.647 1.00 0.00 H new ATOM 0 HG21 THR A 30 -14.685 4.826 -10.440 1.00 0.00 H new ATOM 0 HG22 THR A 30 -13.991 5.052 -12.063 1.00 0.00 H new ATOM 0 HG23 THR A 30 -15.333 3.909 -11.820 1.00 0.00 H new ATOM 423 N LEU A 31 -11.311 3.749 -13.534 1.00 0.00 N ATOM 424 CA LEU A 31 -9.941 4.096 -13.899 1.00 0.00 C ATOM 425 C LEU A 31 -9.435 5.267 -13.063 1.00 0.00 C ATOM 426 O LEU A 31 -10.223 6.017 -12.487 1.00 0.00 O ATOM 427 CB LEU A 31 -9.862 4.443 -15.386 1.00 0.00 C ATOM 428 CG LEU A 31 -9.835 3.258 -16.352 1.00 0.00 C ATOM 429 CD1 LEU A 31 -9.785 3.744 -17.792 1.00 0.00 C ATOM 430 CD2 LEU A 31 -8.650 2.352 -16.052 1.00 0.00 C ATOM 0 H LEU A 31 -12.024 4.338 -13.964 1.00 0.00 H new ATOM 0 HA LEU A 31 -9.307 3.232 -13.700 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -10.716 5.072 -15.638 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -8.966 5.041 -15.552 1.00 0.00 H new ATOM 0 HG LEU A 31 -10.751 2.682 -16.216 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -9.766 2.887 -18.465 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -10.666 4.351 -18.002 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -8.887 4.343 -17.943 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -8.647 1.514 -16.749 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -7.724 2.917 -16.159 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -8.729 1.975 -15.032 1.00 0.00 H new ATOM 442 N ALA A 32 -8.116 5.419 -13.004 1.00 0.00 N ATOM 443 CA ALA A 32 -7.505 6.501 -12.243 1.00 0.00 C ATOM 444 C ALA A 32 -7.980 7.861 -12.744 1.00 0.00 C ATOM 445 O ALA A 32 -7.918 8.856 -12.021 1.00 0.00 O ATOM 446 CB ALA A 32 -5.988 6.409 -12.318 1.00 0.00 C ATOM 0 H ALA A 32 -7.450 4.806 -13.474 1.00 0.00 H new ATOM 0 HA ALA A 32 -7.813 6.398 -11.202 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -5.545 7.224 -11.745 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -5.660 5.455 -11.905 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -5.670 6.482 -13.358 1.00 0.00 H new ATOM 452 N ASP A 33 -8.453 7.897 -13.985 1.00 0.00 N ATOM 453 CA ASP A 33 -8.938 9.135 -14.583 1.00 0.00 C ATOM 454 C ASP A 33 -10.388 9.398 -14.186 1.00 0.00 C ATOM 455 O ASP A 33 -10.898 10.504 -14.358 1.00 0.00 O ATOM 456 CB ASP A 33 -8.817 9.073 -16.106 1.00 0.00 C ATOM 457 CG ASP A 33 -8.933 10.439 -16.752 1.00 0.00 C ATOM 458 OD1 ASP A 33 -8.090 11.310 -16.453 1.00 0.00 O ATOM 459 OD2 ASP A 33 -9.868 10.638 -17.557 1.00 0.00 O ATOM 0 H ASP A 33 -8.511 7.083 -14.596 1.00 0.00 H new ATOM 0 HA ASP A 33 -8.323 9.954 -14.211 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -7.859 8.628 -16.374 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -9.594 8.419 -16.503 1.00 0.00 H new ATOM 464 N GLY A 34 -11.046 8.372 -13.655 1.00 0.00 N ATOM 465 CA GLY A 34 -12.431 8.513 -13.243 1.00 0.00 C ATOM 466 C GLY A 34 -13.380 7.727 -14.125 1.00 0.00 C ATOM 467 O GLY A 34 -14.533 7.496 -13.759 1.00 0.00 O ATOM 0 H GLY A 34 -10.645 7.446 -13.503 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -12.536 8.177 -12.211 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -12.708 9.567 -13.265 1.00 0.00 H new ATOM 471 N LYS A 35 -12.897 7.315 -15.292 1.00 0.00 N ATOM 472 CA LYS A 35 -13.711 6.550 -16.230 1.00 0.00 C ATOM 473 C LYS A 35 -14.356 5.352 -15.541 1.00 0.00 C ATOM 474 O LYS A 35 -13.665 4.493 -14.993 1.00 0.00 O ATOM 475 CB LYS A 35 -12.857 6.075 -17.408 1.00 0.00 C ATOM 476 CG LYS A 35 -13.282 6.662 -18.743 1.00 0.00 C ATOM 477 CD LYS A 35 -14.670 6.191 -19.142 1.00 0.00 C ATOM 478 CE LYS A 35 -14.606 4.999 -20.084 1.00 0.00 C ATOM 479 NZ LYS A 35 -13.986 5.356 -21.390 1.00 0.00 N ATOM 0 H LYS A 35 -11.946 7.498 -15.611 1.00 0.00 H new ATOM 0 HA LYS A 35 -14.502 7.202 -16.601 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -11.816 6.337 -17.220 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -12.906 4.988 -17.466 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -13.269 7.750 -18.684 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -12.565 6.376 -19.512 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -15.234 5.920 -18.249 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -15.208 7.008 -19.623 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -14.033 4.198 -19.617 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -15.612 4.615 -20.253 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -14.336 4.712 -22.128 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -14.236 6.335 -21.637 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -12.952 5.271 -21.318 1.00 0.00 H new ATOM 493 N VAL A 36 -15.684 5.301 -15.573 1.00 0.00 N ATOM 494 CA VAL A 36 -16.422 4.207 -14.953 1.00 0.00 C ATOM 495 C VAL A 36 -16.366 2.949 -15.814 1.00 0.00 C ATOM 496 O VAL A 36 -16.427 3.021 -17.041 1.00 0.00 O ATOM 497 CB VAL A 36 -17.895 4.588 -14.714 1.00 0.00 C ATOM 498 CG1 VAL A 36 -18.657 4.626 -16.030 1.00 0.00 C ATOM 499 CG2 VAL A 36 -18.545 3.617 -13.740 1.00 0.00 C ATOM 0 H VAL A 36 -16.271 6.005 -16.022 1.00 0.00 H new ATOM 0 HA VAL A 36 -15.946 4.008 -13.993 1.00 0.00 H new ATOM 0 HB VAL A 36 -17.928 5.585 -14.274 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -19.696 4.897 -15.841 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -18.204 5.364 -16.692 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -18.618 3.644 -16.501 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -19.585 3.901 -13.583 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -18.502 2.608 -14.150 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -18.013 3.645 -12.789 1.00 0.00 H new ATOM 509 N PHE A 37 -16.251 1.797 -15.162 1.00 0.00 N ATOM 510 CA PHE A 37 -16.187 0.523 -15.867 1.00 0.00 C ATOM 511 C PHE A 37 -17.278 -0.425 -15.378 1.00 0.00 C ATOM 512 O PHE A 37 -18.118 -0.052 -14.558 1.00 0.00 O ATOM 513 CB PHE A 37 -14.813 -0.122 -15.676 1.00 0.00 C ATOM 514 CG PHE A 37 -13.838 0.209 -16.770 1.00 0.00 C ATOM 515 CD1 PHE A 37 -13.417 1.514 -16.970 1.00 0.00 C ATOM 516 CD2 PHE A 37 -13.344 -0.785 -17.600 1.00 0.00 C ATOM 517 CE1 PHE A 37 -12.520 1.822 -17.975 1.00 0.00 C ATOM 518 CE2 PHE A 37 -12.446 -0.483 -18.606 1.00 0.00 C ATOM 519 CZ PHE A 37 -12.035 0.822 -18.795 1.00 0.00 C ATOM 0 H PHE A 37 -16.200 1.720 -14.146 1.00 0.00 H new ATOM 0 HA PHE A 37 -16.346 0.716 -16.928 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -14.399 0.201 -14.721 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -14.933 -1.204 -15.622 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -13.795 2.300 -16.333 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -13.664 -1.807 -17.459 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -12.199 2.843 -18.119 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -12.066 -1.267 -19.244 1.00 0.00 H new ATOM 0 HZ PHE A 37 -11.336 1.060 -19.583 1.00 0.00 H new ATOM 529 N ASP A 38 -17.260 -1.652 -15.887 1.00 0.00 N ATOM 530 CA ASP A 38 -18.246 -2.655 -15.502 1.00 0.00 C ATOM 531 C ASP A 38 -18.247 -2.865 -13.991 1.00 0.00 C ATOM 532 O ASP A 38 -17.192 -3.013 -13.375 1.00 0.00 O ATOM 533 CB ASP A 38 -17.964 -3.979 -16.214 1.00 0.00 C ATOM 534 CG ASP A 38 -19.217 -4.807 -16.415 1.00 0.00 C ATOM 535 OD1 ASP A 38 -19.994 -4.493 -17.342 1.00 0.00 O ATOM 536 OD2 ASP A 38 -19.421 -5.770 -15.647 1.00 0.00 O ATOM 0 H ASP A 38 -16.573 -1.976 -16.568 1.00 0.00 H new ATOM 0 HA ASP A 38 -19.230 -2.294 -15.801 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -17.506 -3.777 -17.182 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -17.242 -4.553 -15.634 1.00 0.00 H new ATOM 541 N SER A 39 -19.437 -2.875 -13.400 1.00 0.00 N ATOM 542 CA SER A 39 -19.575 -3.061 -11.961 1.00 0.00 C ATOM 543 C SER A 39 -20.487 -4.245 -11.651 1.00 0.00 C ATOM 544 O SER A 39 -21.309 -4.642 -12.477 1.00 0.00 O ATOM 545 CB SER A 39 -20.130 -1.792 -11.311 1.00 0.00 C ATOM 546 OG SER A 39 -21.537 -1.716 -11.461 1.00 0.00 O ATOM 0 H SER A 39 -20.320 -2.756 -13.896 1.00 0.00 H new ATOM 0 HA SER A 39 -18.587 -3.268 -11.551 1.00 0.00 H new ATOM 0 HB2 SER A 39 -19.873 -1.780 -10.252 1.00 0.00 H new ATOM 0 HB3 SER A 39 -19.665 -0.915 -11.762 1.00 0.00 H new ATOM 0 HG SER A 39 -21.868 -0.897 -11.036 1.00 0.00 H new ATOM 552 N SER A 40 -20.335 -4.804 -10.455 1.00 0.00 N ATOM 553 CA SER A 40 -21.141 -5.945 -10.036 1.00 0.00 C ATOM 554 C SER A 40 -22.537 -5.497 -9.614 1.00 0.00 C ATOM 555 O SER A 40 -23.501 -6.257 -9.712 1.00 0.00 O ATOM 556 CB SER A 40 -20.459 -6.682 -8.883 1.00 0.00 C ATOM 557 OG SER A 40 -21.390 -7.013 -7.867 1.00 0.00 O ATOM 0 H SER A 40 -19.661 -4.485 -9.759 1.00 0.00 H new ATOM 0 HA SER A 40 -21.236 -6.623 -10.884 1.00 0.00 H new ATOM 0 HB2 SER A 40 -19.986 -7.590 -9.257 1.00 0.00 H new ATOM 0 HB3 SER A 40 -19.668 -6.059 -8.466 1.00 0.00 H new ATOM 0 HG SER A 40 -21.361 -6.332 -7.163 1.00 0.00 H new ATOM 668 N PHE A 47 -20.582 -9.641 -4.768 1.00 0.00 N ATOM 669 CA PHE A 47 -19.505 -10.615 -4.903 1.00 0.00 C ATOM 670 C PHE A 47 -18.987 -11.046 -3.534 1.00 0.00 C ATOM 671 O PHE A 47 -18.525 -10.221 -2.746 1.00 0.00 O ATOM 672 CB PHE A 47 -18.361 -10.029 -5.733 1.00 0.00 C ATOM 673 CG PHE A 47 -17.564 -11.067 -6.472 1.00 0.00 C ATOM 674 CD1 PHE A 47 -18.138 -11.796 -7.501 1.00 0.00 C ATOM 675 CD2 PHE A 47 -16.242 -11.312 -6.137 1.00 0.00 C ATOM 676 CE1 PHE A 47 -17.407 -12.751 -8.183 1.00 0.00 C ATOM 677 CE2 PHE A 47 -15.507 -12.265 -6.816 1.00 0.00 C ATOM 678 CZ PHE A 47 -16.091 -12.987 -7.839 1.00 0.00 C ATOM 0 HA PHE A 47 -19.903 -11.492 -5.414 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -18.770 -9.318 -6.450 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -17.695 -9.471 -5.076 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -19.168 -11.616 -7.773 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -15.781 -10.752 -5.337 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -17.865 -13.312 -8.984 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -14.477 -12.445 -6.547 1.00 0.00 H new ATOM 0 HZ PHE A 47 -15.519 -13.735 -8.369 1.00 0.00 H new ATOM 688 N ARG A 48 -19.068 -12.344 -3.259 1.00 0.00 N ATOM 689 CA ARG A 48 -18.610 -12.885 -1.986 1.00 0.00 C ATOM 690 C ARG A 48 -17.398 -13.791 -2.185 1.00 0.00 C ATOM 691 O ARG A 48 -17.357 -14.596 -3.115 1.00 0.00 O ATOM 692 CB ARG A 48 -19.735 -13.664 -1.303 1.00 0.00 C ATOM 693 CG ARG A 48 -20.325 -14.766 -2.169 1.00 0.00 C ATOM 694 CD ARG A 48 -20.638 -16.009 -1.352 1.00 0.00 C ATOM 695 NE ARG A 48 -22.049 -16.078 -0.979 1.00 0.00 N ATOM 696 CZ ARG A 48 -22.562 -17.039 -0.219 1.00 0.00 C ATOM 697 NH1 ARG A 48 -21.784 -18.006 0.248 1.00 0.00 N ATOM 698 NH2 ARG A 48 -23.855 -17.034 0.077 1.00 0.00 N ATOM 0 H ARG A 48 -19.447 -13.040 -3.901 1.00 0.00 H new ATOM 0 HA ARG A 48 -18.318 -12.050 -1.350 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -19.354 -14.103 -0.381 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -20.528 -12.970 -1.022 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -21.235 -14.406 -2.648 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -19.625 -15.019 -2.965 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -20.371 -16.897 -1.926 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -20.024 -16.015 -0.451 1.00 0.00 H new ATOM 0 HE ARG A 48 -22.674 -15.348 -1.321 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -20.789 -18.013 0.024 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -22.181 -18.743 0.831 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -24.457 -16.291 -0.279 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -24.247 -17.773 0.661 1.00 0.00 H new ATOM 712 N PHE A 49 -16.412 -13.653 -1.304 1.00 0.00 N ATOM 713 CA PHE A 49 -15.198 -14.457 -1.384 1.00 0.00 C ATOM 714 C PHE A 49 -14.461 -14.463 -0.048 1.00 0.00 C ATOM 715 O PHE A 49 -14.721 -13.631 0.822 1.00 0.00 O ATOM 716 CB PHE A 49 -14.278 -13.923 -2.484 1.00 0.00 C ATOM 717 CG PHE A 49 -13.717 -12.562 -2.188 1.00 0.00 C ATOM 718 CD1 PHE A 49 -12.555 -12.423 -1.446 1.00 0.00 C ATOM 719 CD2 PHE A 49 -14.352 -11.421 -2.652 1.00 0.00 C ATOM 720 CE1 PHE A 49 -12.037 -11.171 -1.172 1.00 0.00 C ATOM 721 CE2 PHE A 49 -13.838 -10.166 -2.382 1.00 0.00 C ATOM 722 CZ PHE A 49 -12.679 -10.042 -1.641 1.00 0.00 C ATOM 0 H PHE A 49 -16.430 -12.992 -0.527 1.00 0.00 H new ATOM 0 HA PHE A 49 -15.485 -15.480 -1.626 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -13.455 -14.623 -2.630 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -14.832 -13.883 -3.422 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -12.048 -13.303 -1.078 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -15.259 -11.513 -3.231 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -11.131 -11.076 -0.592 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -14.342 -9.284 -2.750 1.00 0.00 H new ATOM 0 HZ PHE A 49 -12.275 -9.063 -1.429 1.00 0.00 H new ATOM 732 N THR A 50 -13.540 -15.409 0.109 1.00 0.00 N ATOM 733 CA THR A 50 -12.766 -15.525 1.339 1.00 0.00 C ATOM 734 C THR A 50 -11.586 -14.560 1.339 1.00 0.00 C ATOM 735 O THR A 50 -10.641 -14.719 0.566 1.00 0.00 O ATOM 736 CB THR A 50 -12.242 -16.960 1.539 1.00 0.00 C ATOM 737 OG1 THR A 50 -13.339 -17.876 1.620 1.00 0.00 O ATOM 738 CG2 THR A 50 -11.399 -17.057 2.801 1.00 0.00 C ATOM 0 H THR A 50 -13.312 -16.106 -0.600 1.00 0.00 H new ATOM 0 HA THR A 50 -13.437 -15.273 2.160 1.00 0.00 H new ATOM 0 HB THR A 50 -11.618 -17.217 0.683 1.00 0.00 H new ATOM 0 HG1 THR A 50 -12.997 -18.786 1.745 1.00 0.00 H new ATOM 0 HG21 THR A 50 -11.040 -18.079 2.921 1.00 0.00 H new ATOM 0 HG22 THR A 50 -10.548 -16.380 2.723 1.00 0.00 H new ATOM 0 HG23 THR A 50 -12.004 -16.781 3.665 1.00 0.00 H new ATOM 746 N VAL A 51 -11.645 -13.560 2.213 1.00 0.00 N ATOM 747 CA VAL A 51 -10.580 -12.570 2.316 1.00 0.00 C ATOM 748 C VAL A 51 -9.269 -13.216 2.751 1.00 0.00 C ATOM 749 O VAL A 51 -9.090 -13.555 3.919 1.00 0.00 O ATOM 750 CB VAL A 51 -10.945 -11.454 3.312 1.00 0.00 C ATOM 751 CG1 VAL A 51 -9.935 -10.319 3.237 1.00 0.00 C ATOM 752 CG2 VAL A 51 -12.354 -10.944 3.047 1.00 0.00 C ATOM 0 H VAL A 51 -12.420 -13.414 2.860 1.00 0.00 H new ATOM 0 HA VAL A 51 -10.456 -12.135 1.324 1.00 0.00 H new ATOM 0 HB VAL A 51 -10.916 -11.867 4.320 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -10.210 -9.540 3.948 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -8.943 -10.698 3.480 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -9.928 -9.904 2.229 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -12.596 -10.156 3.760 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -12.413 -10.547 2.034 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -13.064 -11.763 3.157 1.00 0.00 H new ATOM 762 N GLY A 52 -8.354 -13.383 1.801 1.00 0.00 N ATOM 763 CA GLY A 52 -7.071 -13.988 2.105 1.00 0.00 C ATOM 764 C GLY A 52 -6.787 -15.208 1.250 1.00 0.00 C ATOM 765 O GLY A 52 -5.648 -15.669 1.174 1.00 0.00 O ATOM 0 H GLY A 52 -8.479 -13.110 0.826 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -6.281 -13.252 1.956 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -7.047 -14.272 3.157 1.00 0.00 H new ATOM 769 N ARG A 53 -7.825 -15.732 0.607 1.00 0.00 N ATOM 770 CA ARG A 53 -7.682 -16.907 -0.244 1.00 0.00 C ATOM 771 C ARG A 53 -7.061 -16.534 -1.586 1.00 0.00 C ATOM 772 O ARG A 53 -6.860 -15.357 -1.883 1.00 0.00 O ATOM 773 CB ARG A 53 -9.043 -17.571 -0.466 1.00 0.00 C ATOM 774 CG ARG A 53 -9.413 -18.577 0.611 1.00 0.00 C ATOM 775 CD ARG A 53 -8.575 -19.842 0.504 1.00 0.00 C ATOM 776 NE ARG A 53 -9.147 -20.799 -0.440 1.00 0.00 N ATOM 777 CZ ARG A 53 -8.661 -22.020 -0.633 1.00 0.00 C ATOM 778 NH1 ARG A 53 -7.601 -22.431 0.049 1.00 0.00 N ATOM 779 NH2 ARG A 53 -9.237 -22.833 -1.509 1.00 0.00 N ATOM 0 H ARG A 53 -8.774 -15.362 0.659 1.00 0.00 H new ATOM 0 HA ARG A 53 -7.020 -17.611 0.260 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -9.811 -16.799 -0.510 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -9.040 -18.072 -1.434 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -9.272 -18.128 1.594 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -10.470 -18.831 0.526 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -7.564 -19.582 0.189 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -8.493 -20.307 1.487 1.00 0.00 H new ATOM 0 HE ARG A 53 -9.964 -20.514 -0.980 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -7.156 -21.809 0.724 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -7.230 -23.369 -0.101 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -10.053 -22.520 -2.035 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -8.863 -23.771 -1.657 1.00 0.00 H new ATOM 793 N GLY A 54 -6.759 -17.546 -2.395 1.00 0.00 N ATOM 794 CA GLY A 54 -6.163 -17.304 -3.696 1.00 0.00 C ATOM 795 C GLY A 54 -7.198 -17.222 -4.801 1.00 0.00 C ATOM 796 O GLY A 54 -6.870 -17.373 -5.977 1.00 0.00 O ATOM 0 H GLY A 54 -6.917 -18.529 -2.172 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -5.595 -16.374 -3.665 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -5.456 -18.102 -3.923 1.00 0.00 H new ATOM 800 N GLU A 55 -8.449 -16.985 -4.421 1.00 0.00 N ATOM 801 CA GLU A 55 -9.535 -16.887 -5.390 1.00 0.00 C ATOM 802 C GLU A 55 -9.663 -15.462 -5.922 1.00 0.00 C ATOM 803 O GLU A 55 -10.169 -15.241 -7.022 1.00 0.00 O ATOM 804 CB GLU A 55 -10.856 -17.326 -4.756 1.00 0.00 C ATOM 805 CG GLU A 55 -10.821 -18.738 -4.194 1.00 0.00 C ATOM 806 CD GLU A 55 -10.945 -19.798 -5.271 1.00 0.00 C ATOM 807 OE1 GLU A 55 -11.996 -19.842 -5.943 1.00 0.00 O ATOM 808 OE2 GLU A 55 -9.989 -20.583 -5.442 1.00 0.00 O ATOM 0 H GLU A 55 -8.736 -16.857 -3.451 1.00 0.00 H new ATOM 0 HA GLU A 55 -9.303 -17.549 -6.224 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -11.114 -16.632 -3.956 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -11.647 -17.260 -5.503 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -9.888 -18.885 -3.650 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -11.631 -18.859 -3.475 1.00 0.00 H new ATOM 815 N VAL A 56 -9.200 -14.498 -5.131 1.00 0.00 N ATOM 816 CA VAL A 56 -9.262 -13.094 -5.521 1.00 0.00 C ATOM 817 C VAL A 56 -7.865 -12.524 -5.741 1.00 0.00 C ATOM 818 O VAL A 56 -6.867 -13.235 -5.621 1.00 0.00 O ATOM 819 CB VAL A 56 -9.989 -12.248 -4.459 1.00 0.00 C ATOM 820 CG1 VAL A 56 -11.481 -12.541 -4.473 1.00 0.00 C ATOM 821 CG2 VAL A 56 -9.400 -12.504 -3.080 1.00 0.00 C ATOM 0 H VAL A 56 -8.778 -14.664 -4.217 1.00 0.00 H new ATOM 0 HA VAL A 56 -9.822 -13.049 -6.455 1.00 0.00 H new ATOM 0 HB VAL A 56 -9.848 -11.194 -4.700 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -11.978 -11.934 -3.716 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -11.889 -12.303 -5.455 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -11.647 -13.597 -4.258 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -9.925 -11.898 -2.342 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -9.509 -13.559 -2.828 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -8.343 -12.239 -3.081 1.00 0.00 H new ATOM 831 N ILE A 57 -7.802 -11.236 -6.063 1.00 0.00 N ATOM 832 CA ILE A 57 -6.528 -10.569 -6.298 1.00 0.00 C ATOM 833 C ILE A 57 -6.034 -9.867 -5.038 1.00 0.00 C ATOM 834 O ILE A 57 -6.811 -9.592 -4.124 1.00 0.00 O ATOM 835 CB ILE A 57 -6.633 -9.539 -7.439 1.00 0.00 C ATOM 836 CG1 ILE A 57 -7.777 -8.561 -7.167 1.00 0.00 C ATOM 837 CG2 ILE A 57 -6.837 -10.244 -8.771 1.00 0.00 C ATOM 838 CD1 ILE A 57 -7.508 -7.161 -7.674 1.00 0.00 C ATOM 0 H ILE A 57 -8.619 -10.634 -6.167 1.00 0.00 H new ATOM 0 HA ILE A 57 -5.815 -11.343 -6.583 1.00 0.00 H new ATOM 0 HB ILE A 57 -5.701 -8.975 -7.488 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -8.686 -8.939 -7.634 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -7.963 -8.521 -6.094 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -6.909 -9.503 -9.567 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -5.993 -10.905 -8.966 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -7.756 -10.830 -8.736 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -8.361 -6.522 -7.447 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -6.617 -6.763 -7.189 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -7.352 -7.188 -8.752 1.00 0.00 H new ATOM 850 N ARG A 58 -4.738 -9.578 -4.998 1.00 0.00 N ATOM 851 CA ARG A 58 -4.140 -8.906 -3.850 1.00 0.00 C ATOM 852 C ARG A 58 -4.910 -7.636 -3.501 1.00 0.00 C ATOM 853 O ARG A 58 -5.203 -7.375 -2.335 1.00 0.00 O ATOM 854 CB ARG A 58 -2.676 -8.566 -4.136 1.00 0.00 C ATOM 855 CG ARG A 58 -1.822 -9.779 -4.465 1.00 0.00 C ATOM 856 CD ARG A 58 -1.727 -10.730 -3.282 1.00 0.00 C ATOM 857 NE ARG A 58 -1.186 -10.074 -2.094 1.00 0.00 N ATOM 858 CZ ARG A 58 -1.268 -10.585 -0.871 1.00 0.00 C ATOM 859 NH1 ARG A 58 -1.866 -11.752 -0.675 1.00 0.00 N ATOM 860 NH2 ARG A 58 -0.752 -9.928 0.160 1.00 0.00 N ATOM 0 H ARG A 58 -4.082 -9.798 -5.747 1.00 0.00 H new ATOM 0 HA ARG A 58 -4.188 -9.585 -2.998 1.00 0.00 H new ATOM 0 HB2 ARG A 58 -2.631 -7.864 -4.969 1.00 0.00 H new ATOM 0 HB3 ARG A 58 -2.253 -8.059 -3.268 1.00 0.00 H new ATOM 0 HG2 ARG A 58 -2.247 -10.303 -5.321 1.00 0.00 H new ATOM 0 HG3 ARG A 58 -0.822 -9.454 -4.754 1.00 0.00 H new ATOM 0 HD2 ARG A 58 -2.716 -11.129 -3.057 1.00 0.00 H new ATOM 0 HD3 ARG A 58 -1.095 -11.577 -3.548 1.00 0.00 H new ATOM 0 HE ARG A 58 -0.720 -9.174 -2.210 1.00 0.00 H new ATOM 0 HH11 ARG A 58 -2.265 -12.260 -1.465 1.00 0.00 H new ATOM 0 HH12 ARG A 58 -1.927 -12.142 0.266 1.00 0.00 H new ATOM 0 HH21 ARG A 58 -0.292 -9.030 0.014 1.00 0.00 H new ATOM 0 HH22 ARG A 58 -0.816 -10.321 1.099 1.00 0.00 H new ATOM 874 N GLY A 59 -5.234 -6.848 -4.522 1.00 0.00 N ATOM 875 CA GLY A 59 -5.966 -5.614 -4.303 1.00 0.00 C ATOM 876 C GLY A 59 -7.193 -5.814 -3.435 1.00 0.00 C ATOM 877 O GLY A 59 -7.293 -5.243 -2.349 1.00 0.00 O ATOM 0 H GLY A 59 -5.003 -7.042 -5.496 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -5.308 -4.883 -3.833 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -6.269 -5.199 -5.264 1.00 0.00 H new ATOM 881 N TRP A 60 -8.129 -6.624 -3.915 1.00 0.00 N ATOM 882 CA TRP A 60 -9.357 -6.897 -3.176 1.00 0.00 C ATOM 883 C TRP A 60 -9.045 -7.438 -1.785 1.00 0.00 C ATOM 884 O TRP A 60 -9.673 -7.046 -0.801 1.00 0.00 O ATOM 885 CB TRP A 60 -10.227 -7.894 -3.942 1.00 0.00 C ATOM 886 CG TRP A 60 -10.981 -7.273 -5.079 1.00 0.00 C ATOM 887 CD1 TRP A 60 -11.056 -5.944 -5.384 1.00 0.00 C ATOM 888 CD2 TRP A 60 -11.767 -7.957 -6.061 1.00 0.00 C ATOM 889 NE1 TRP A 60 -11.842 -5.761 -6.496 1.00 0.00 N ATOM 890 CE2 TRP A 60 -12.289 -6.980 -6.931 1.00 0.00 C ATOM 891 CE3 TRP A 60 -12.079 -9.300 -6.291 1.00 0.00 C ATOM 892 CZ2 TRP A 60 -13.106 -7.306 -8.011 1.00 0.00 C ATOM 893 CZ3 TRP A 60 -12.890 -9.621 -7.363 1.00 0.00 C ATOM 894 CH2 TRP A 60 -13.395 -8.628 -8.212 1.00 0.00 C ATOM 0 H TRP A 60 -8.062 -7.104 -4.813 1.00 0.00 H new ATOM 0 HA TRP A 60 -9.903 -5.960 -3.067 1.00 0.00 H new ATOM 0 HB2 TRP A 60 -9.596 -8.694 -4.328 1.00 0.00 H new ATOM 0 HB3 TRP A 60 -10.936 -8.352 -3.252 1.00 0.00 H new ATOM 0 HD1 TRP A 60 -10.569 -5.153 -4.832 1.00 0.00 H new ATOM 0 HE1 TRP A 60 -12.058 -4.862 -6.928 1.00 0.00 H new ATOM 0 HE3 TRP A 60 -11.693 -10.073 -5.643 1.00 0.00 H new ATOM 0 HZ2 TRP A 60 -13.497 -6.542 -8.667 1.00 0.00 H new ATOM 0 HZ3 TRP A 60 -13.139 -10.655 -7.549 1.00 0.00 H new ATOM 0 HH2 TRP A 60 -14.025 -8.912 -9.042 1.00 0.00 H new ATOM 905 N ASP A 61 -8.073 -8.340 -1.710 1.00 0.00 N ATOM 906 CA ASP A 61 -7.678 -8.935 -0.438 1.00 0.00 C ATOM 907 C ASP A 61 -7.442 -7.857 0.615 1.00 0.00 C ATOM 908 O ASP A 61 -8.145 -7.797 1.623 1.00 0.00 O ATOM 909 CB ASP A 61 -6.414 -9.778 -0.616 1.00 0.00 C ATOM 910 CG ASP A 61 -6.342 -10.927 0.370 1.00 0.00 C ATOM 911 OD1 ASP A 61 -7.043 -10.869 1.402 1.00 0.00 O ATOM 912 OD2 ASP A 61 -5.583 -11.885 0.110 1.00 0.00 O ATOM 0 H ASP A 61 -7.544 -8.676 -2.515 1.00 0.00 H new ATOM 0 HA ASP A 61 -8.489 -9.579 -0.098 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -6.384 -10.172 -1.632 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -5.537 -9.143 -0.494 1.00 0.00 H new ATOM 917 N GLU A 62 -6.447 -7.009 0.374 1.00 0.00 N ATOM 918 CA GLU A 62 -6.117 -5.935 1.304 1.00 0.00 C ATOM 919 C GLU A 62 -7.259 -4.926 1.397 1.00 0.00 C ATOM 920 O GLU A 62 -7.638 -4.501 2.487 1.00 0.00 O ATOM 921 CB GLU A 62 -4.832 -5.228 0.867 1.00 0.00 C ATOM 922 CG GLU A 62 -3.566 -5.971 1.259 1.00 0.00 C ATOM 923 CD GLU A 62 -3.112 -5.647 2.669 1.00 0.00 C ATOM 924 OE1 GLU A 62 -3.191 -4.463 3.059 1.00 0.00 O ATOM 925 OE2 GLU A 62 -2.677 -6.576 3.381 1.00 0.00 O ATOM 0 H GLU A 62 -5.856 -7.045 -0.456 1.00 0.00 H new ATOM 0 HA GLU A 62 -5.963 -6.376 2.289 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -4.848 -5.100 -0.215 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -4.809 -4.231 1.306 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -3.738 -7.044 1.174 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -2.770 -5.720 0.558 1.00 0.00 H new ATOM 932 N GLY A 63 -7.802 -4.548 0.243 1.00 0.00 N ATOM 933 CA GLY A 63 -8.894 -3.593 0.216 1.00 0.00 C ATOM 934 C GLY A 63 -10.025 -3.977 1.149 1.00 0.00 C ATOM 935 O GLY A 63 -10.335 -3.250 2.093 1.00 0.00 O ATOM 0 H GLY A 63 -7.505 -4.886 -0.672 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -8.518 -2.608 0.493 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -9.278 -3.514 -0.801 1.00 0.00 H new ATOM 939 N VAL A 64 -10.644 -5.123 0.885 1.00 0.00 N ATOM 940 CA VAL A 64 -11.748 -5.603 1.708 1.00 0.00 C ATOM 941 C VAL A 64 -11.286 -5.893 3.132 1.00 0.00 C ATOM 942 O VAL A 64 -12.040 -5.715 4.088 1.00 0.00 O ATOM 943 CB VAL A 64 -12.378 -6.877 1.115 1.00 0.00 C ATOM 944 CG1 VAL A 64 -11.426 -8.056 1.249 1.00 0.00 C ATOM 945 CG2 VAL A 64 -13.708 -7.177 1.789 1.00 0.00 C ATOM 0 H VAL A 64 -10.400 -5.737 0.108 1.00 0.00 H new ATOM 0 HA VAL A 64 -12.497 -4.811 1.726 1.00 0.00 H new ATOM 0 HB VAL A 64 -12.564 -6.709 0.054 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -11.888 -8.947 0.825 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -10.500 -7.839 0.716 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -11.206 -8.228 2.303 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -14.139 -8.080 1.358 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -13.549 -7.325 2.857 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -14.390 -6.341 1.636 1.00 0.00 H new ATOM 955 N ALA A 65 -10.042 -6.340 3.265 1.00 0.00 N ATOM 956 CA ALA A 65 -9.478 -6.652 4.572 1.00 0.00 C ATOM 957 C ALA A 65 -9.533 -5.440 5.497 1.00 0.00 C ATOM 958 O ALA A 65 -9.805 -5.572 6.690 1.00 0.00 O ATOM 959 CB ALA A 65 -8.045 -7.142 4.426 1.00 0.00 C ATOM 0 H ALA A 65 -9.405 -6.494 2.483 1.00 0.00 H new ATOM 0 HA ALA A 65 -10.077 -7.445 5.019 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -7.637 -7.371 5.410 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -8.029 -8.040 3.808 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -7.442 -6.366 3.955 1.00 0.00 H new ATOM 965 N GLN A 66 -9.271 -4.263 4.939 1.00 0.00 N ATOM 966 CA GLN A 66 -9.290 -3.029 5.715 1.00 0.00 C ATOM 967 C GLN A 66 -10.605 -2.282 5.519 1.00 0.00 C ATOM 968 O GLN A 66 -10.667 -1.063 5.675 1.00 0.00 O ATOM 969 CB GLN A 66 -8.116 -2.133 5.316 1.00 0.00 C ATOM 970 CG GLN A 66 -8.232 -1.571 3.908 1.00 0.00 C ATOM 971 CD GLN A 66 -6.937 -0.953 3.418 1.00 0.00 C ATOM 972 OE1 GLN A 66 -6.453 0.030 3.980 1.00 0.00 O ATOM 973 NE2 GLN A 66 -6.367 -1.529 2.365 1.00 0.00 N ATOM 0 H GLN A 66 -9.043 -4.138 3.953 1.00 0.00 H new ATOM 0 HA GLN A 66 -9.196 -3.291 6.769 1.00 0.00 H new ATOM 0 HB2 GLN A 66 -8.043 -1.307 6.023 1.00 0.00 H new ATOM 0 HB3 GLN A 66 -7.191 -2.703 5.396 1.00 0.00 H new ATOM 0 HG2 GLN A 66 -8.531 -2.367 3.226 1.00 0.00 H new ATOM 0 HG3 GLN A 66 -9.021 -0.819 3.885 1.00 0.00 H new ATOM 0 HE21 GLN A 66 -6.803 -2.342 1.930 1.00 0.00 H new ATOM 0 HE22 GLN A 66 -5.493 -1.158 1.991 1.00 0.00 H new ATOM 982 N MET A 67 -11.655 -3.022 5.177 1.00 0.00 N ATOM 983 CA MET A 67 -12.969 -2.429 4.960 1.00 0.00 C ATOM 984 C MET A 67 -13.931 -2.818 6.078 1.00 0.00 C ATOM 985 O MET A 67 -13.703 -3.791 6.797 1.00 0.00 O ATOM 986 CB MET A 67 -13.535 -2.869 3.609 1.00 0.00 C ATOM 987 CG MET A 67 -12.970 -2.092 2.431 1.00 0.00 C ATOM 988 SD MET A 67 -13.975 -0.660 1.997 1.00 0.00 S ATOM 989 CE MET A 67 -15.410 -1.457 1.282 1.00 0.00 C ATOM 0 H MET A 67 -11.621 -4.033 5.044 1.00 0.00 H new ATOM 0 HA MET A 67 -12.855 -1.345 4.962 1.00 0.00 H new ATOM 0 HB2 MET A 67 -13.329 -3.930 3.466 1.00 0.00 H new ATOM 0 HB3 MET A 67 -14.619 -2.754 3.623 1.00 0.00 H new ATOM 0 HG2 MET A 67 -11.959 -1.762 2.670 1.00 0.00 H new ATOM 0 HG3 MET A 67 -12.894 -2.753 1.568 1.00 0.00 H new ATOM 0 HE1 MET A 67 -16.086 -0.700 0.884 1.00 0.00 H new ATOM 0 HE2 MET A 67 -15.094 -2.121 0.477 1.00 0.00 H new ATOM 0 HE3 MET A 67 -15.925 -2.036 2.049 1.00 0.00 H new ATOM 999 N SER A 68 -15.008 -2.051 6.220 1.00 0.00 N ATOM 1000 CA SER A 68 -16.002 -2.313 7.254 1.00 0.00 C ATOM 1001 C SER A 68 -17.391 -2.473 6.643 1.00 0.00 C ATOM 1002 O SER A 68 -17.707 -1.863 5.622 1.00 0.00 O ATOM 1003 CB SER A 68 -16.013 -1.179 8.281 1.00 0.00 C ATOM 1004 OG SER A 68 -16.060 0.086 7.644 1.00 0.00 O ATOM 0 H SER A 68 -15.214 -1.243 5.632 1.00 0.00 H new ATOM 0 HA SER A 68 -15.733 -3.244 7.754 1.00 0.00 H new ATOM 0 HB2 SER A 68 -16.874 -1.290 8.940 1.00 0.00 H new ATOM 0 HB3 SER A 68 -15.122 -1.242 8.906 1.00 0.00 H new ATOM 0 HG SER A 68 -15.205 0.260 7.198 1.00 0.00 H new ATOM 1010 N VAL A 69 -18.218 -3.299 7.276 1.00 0.00 N ATOM 1011 CA VAL A 69 -19.573 -3.541 6.797 1.00 0.00 C ATOM 1012 C VAL A 69 -20.328 -2.231 6.601 1.00 0.00 C ATOM 1013 O VAL A 69 -20.378 -1.391 7.498 1.00 0.00 O ATOM 1014 CB VAL A 69 -20.363 -4.434 7.773 1.00 0.00 C ATOM 1015 CG1 VAL A 69 -21.796 -4.610 7.295 1.00 0.00 C ATOM 1016 CG2 VAL A 69 -19.677 -5.782 7.934 1.00 0.00 C ATOM 0 H VAL A 69 -17.973 -3.812 8.123 1.00 0.00 H new ATOM 0 HA VAL A 69 -19.483 -4.053 5.839 1.00 0.00 H new ATOM 0 HB VAL A 69 -20.388 -3.945 8.747 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -22.338 -5.244 7.997 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -22.282 -3.636 7.235 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -21.796 -5.077 6.310 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -20.248 -6.400 8.627 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -19.620 -6.279 6.966 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -18.671 -5.634 8.325 1.00 0.00 H new ATOM 1026 N GLY A 70 -20.916 -2.064 5.420 1.00 0.00 N ATOM 1027 CA GLY A 70 -21.661 -0.853 5.127 1.00 0.00 C ATOM 1028 C GLY A 70 -20.762 0.297 4.719 1.00 0.00 C ATOM 1029 O GLY A 70 -21.214 1.436 4.609 1.00 0.00 O ATOM 0 H GLY A 70 -20.890 -2.745 4.661 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -22.374 -1.054 4.328 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -22.239 -0.564 6.005 1.00 0.00 H new ATOM 1033 N GLN A 71 -19.486 -0.002 4.496 1.00 0.00 N ATOM 1034 CA GLN A 71 -18.522 1.017 4.100 1.00 0.00 C ATOM 1035 C GLN A 71 -18.165 0.886 2.623 1.00 0.00 C ATOM 1036 O GLN A 71 -18.017 -0.222 2.107 1.00 0.00 O ATOM 1037 CB GLN A 71 -17.257 0.911 4.954 1.00 0.00 C ATOM 1038 CG GLN A 71 -16.481 2.214 5.056 1.00 0.00 C ATOM 1039 CD GLN A 71 -14.988 2.021 4.874 1.00 0.00 C ATOM 1040 OE1 GLN A 71 -14.268 1.725 5.828 1.00 0.00 O ATOM 1041 NE2 GLN A 71 -14.515 2.186 3.644 1.00 0.00 N ATOM 0 H GLN A 71 -19.097 -0.941 4.583 1.00 0.00 H new ATOM 0 HA GLN A 71 -18.979 1.994 4.258 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -17.532 0.582 5.956 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -16.608 0.143 4.533 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -16.848 2.911 4.302 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -16.669 2.669 6.029 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -15.148 2.431 2.883 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -13.519 2.067 3.461 1.00 0.00 H new ATOM 1050 N ARG A 72 -18.030 2.022 1.948 1.00 0.00 N ATOM 1051 CA ARG A 72 -17.692 2.034 0.530 1.00 0.00 C ATOM 1052 C ARG A 72 -16.507 2.956 0.261 1.00 0.00 C ATOM 1053 O ARG A 72 -16.443 4.069 0.781 1.00 0.00 O ATOM 1054 CB ARG A 72 -18.898 2.480 -0.299 1.00 0.00 C ATOM 1055 CG ARG A 72 -18.586 2.666 -1.775 1.00 0.00 C ATOM 1056 CD ARG A 72 -19.857 2.766 -2.604 1.00 0.00 C ATOM 1057 NE ARG A 72 -20.585 4.005 -2.343 1.00 0.00 N ATOM 1058 CZ ARG A 72 -21.657 4.386 -3.028 1.00 0.00 C ATOM 1059 NH1 ARG A 72 -22.125 3.627 -4.010 1.00 0.00 N ATOM 1060 NH2 ARG A 72 -22.265 5.527 -2.732 1.00 0.00 N ATOM 0 H ARG A 72 -18.150 2.947 2.361 1.00 0.00 H new ATOM 0 HA ARG A 72 -17.414 1.021 0.240 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -19.693 1.742 -0.194 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -19.279 3.418 0.104 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -17.989 3.568 -1.911 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -17.984 1.829 -2.129 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -19.604 2.710 -3.663 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -20.501 1.914 -2.385 1.00 0.00 H new ATOM 0 HE ARG A 72 -20.252 4.611 -1.593 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -21.661 2.748 -4.241 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -22.949 3.922 -4.534 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -21.909 6.114 -1.977 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -23.088 5.818 -3.259 1.00 0.00 H new ATOM 1074 N ALA A 73 -15.570 2.484 -0.556 1.00 0.00 N ATOM 1075 CA ALA A 73 -14.388 3.266 -0.896 1.00 0.00 C ATOM 1076 C ALA A 73 -13.779 2.797 -2.213 1.00 0.00 C ATOM 1077 O ALA A 73 -14.124 1.731 -2.723 1.00 0.00 O ATOM 1078 CB ALA A 73 -13.360 3.182 0.223 1.00 0.00 C ATOM 0 H ALA A 73 -15.607 1.564 -0.994 1.00 0.00 H new ATOM 0 HA ALA A 73 -14.693 4.305 -1.017 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -12.482 3.771 -0.044 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -13.792 3.573 1.144 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -13.068 2.142 0.372 1.00 0.00 H new ATOM 1084 N LYS A 74 -12.873 3.600 -2.760 1.00 0.00 N ATOM 1085 CA LYS A 74 -12.215 3.268 -4.018 1.00 0.00 C ATOM 1086 C LYS A 74 -10.895 2.546 -3.767 1.00 0.00 C ATOM 1087 O LYS A 74 -10.029 3.046 -3.047 1.00 0.00 O ATOM 1088 CB LYS A 74 -11.967 4.536 -4.838 1.00 0.00 C ATOM 1089 CG LYS A 74 -13.099 4.873 -5.793 1.00 0.00 C ATOM 1090 CD LYS A 74 -13.266 6.375 -5.952 1.00 0.00 C ATOM 1091 CE LYS A 74 -12.420 6.911 -7.096 1.00 0.00 C ATOM 1092 NZ LYS A 74 -12.896 8.244 -7.561 1.00 0.00 N ATOM 0 H LYS A 74 -12.577 4.487 -2.351 1.00 0.00 H new ATOM 0 HA LYS A 74 -12.872 2.603 -4.579 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -11.814 5.374 -4.158 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -11.046 4.416 -5.408 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -12.902 4.423 -6.766 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -14.029 4.440 -5.424 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -14.315 6.608 -6.133 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -12.984 6.874 -5.025 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -11.381 6.988 -6.774 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -12.445 6.206 -7.927 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -12.293 8.575 -8.341 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -13.879 8.166 -7.892 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -12.848 8.923 -6.775 1.00 0.00 H new ATOM 1106 N LEU A 75 -10.747 1.369 -4.365 1.00 0.00 N ATOM 1107 CA LEU A 75 -9.531 0.579 -4.208 1.00 0.00 C ATOM 1108 C LEU A 75 -8.608 0.754 -5.410 1.00 0.00 C ATOM 1109 O LEU A 75 -8.762 0.077 -6.427 1.00 0.00 O ATOM 1110 CB LEU A 75 -9.879 -0.900 -4.029 1.00 0.00 C ATOM 1111 CG LEU A 75 -8.740 -1.807 -3.563 1.00 0.00 C ATOM 1112 CD1 LEU A 75 -8.360 -1.491 -2.125 1.00 0.00 C ATOM 1113 CD2 LEU A 75 -9.131 -3.270 -3.704 1.00 0.00 C ATOM 0 H LEU A 75 -11.454 0.941 -4.963 1.00 0.00 H new ATOM 0 HA LEU A 75 -9.010 0.934 -3.319 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -10.694 -0.976 -3.310 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -10.255 -1.281 -4.978 1.00 0.00 H new ATOM 0 HG LEU A 75 -7.872 -1.621 -4.196 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -7.548 -2.147 -1.811 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -8.036 -0.453 -2.054 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -9.223 -1.647 -1.478 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -8.308 -3.901 -3.368 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -10.014 -3.471 -3.097 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -9.352 -3.489 -4.749 1.00 0.00 H new ATOM 1125 N VAL A 76 -7.649 1.665 -5.286 1.00 0.00 N ATOM 1126 CA VAL A 76 -6.699 1.926 -6.361 1.00 0.00 C ATOM 1127 C VAL A 76 -5.369 1.227 -6.102 1.00 0.00 C ATOM 1128 O VAL A 76 -4.567 1.681 -5.285 1.00 0.00 O ATOM 1129 CB VAL A 76 -6.447 3.436 -6.532 1.00 0.00 C ATOM 1130 CG1 VAL A 76 -6.098 4.075 -5.197 1.00 0.00 C ATOM 1131 CG2 VAL A 76 -5.347 3.680 -7.554 1.00 0.00 C ATOM 0 H VAL A 76 -7.509 2.235 -4.452 1.00 0.00 H new ATOM 0 HA VAL A 76 -7.141 1.532 -7.276 1.00 0.00 H new ATOM 0 HB VAL A 76 -7.362 3.900 -6.900 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -5.924 5.142 -5.339 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -6.922 3.932 -4.498 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -5.197 3.610 -4.796 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -5.182 4.752 -7.662 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -4.426 3.203 -7.218 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -5.643 3.260 -8.515 1.00 0.00 H new ATOM 1141 N CYS A 77 -5.142 0.122 -6.802 1.00 0.00 N ATOM 1142 CA CYS A 77 -3.909 -0.642 -6.648 1.00 0.00 C ATOM 1143 C CYS A 77 -3.239 -0.870 -7.999 1.00 0.00 C ATOM 1144 O CYS A 77 -3.867 -0.724 -9.047 1.00 0.00 O ATOM 1145 CB CYS A 77 -4.196 -1.984 -5.974 1.00 0.00 C ATOM 1146 SG CYS A 77 -5.477 -2.962 -6.793 1.00 0.00 S ATOM 0 H CYS A 77 -5.796 -0.266 -7.482 1.00 0.00 H new ATOM 0 HA CYS A 77 -3.230 -0.066 -6.019 1.00 0.00 H new ATOM 0 HB2 CYS A 77 -3.275 -2.566 -5.941 1.00 0.00 H new ATOM 0 HB3 CYS A 77 -4.496 -1.803 -4.942 1.00 0.00 H new ATOM 0 HG CYS A 77 -5.539 -2.632 -8.049 1.00 0.00 H new ATOM 1152 N SER A 78 -1.959 -1.228 -7.965 1.00 0.00 N ATOM 1153 CA SER A 78 -1.201 -1.471 -9.187 1.00 0.00 C ATOM 1154 C SER A 78 -1.720 -2.710 -9.910 1.00 0.00 C ATOM 1155 O SER A 78 -2.467 -3.516 -9.356 1.00 0.00 O ATOM 1156 CB SER A 78 0.285 -1.639 -8.866 1.00 0.00 C ATOM 1157 OG SER A 78 1.043 -0.556 -9.376 1.00 0.00 O ATOM 0 H SER A 78 -1.426 -1.356 -7.105 1.00 0.00 H new ATOM 0 HA SER A 78 -1.328 -0.609 -9.842 1.00 0.00 H new ATOM 0 HB2 SER A 78 0.422 -1.706 -7.787 1.00 0.00 H new ATOM 0 HB3 SER A 78 0.649 -2.574 -9.292 1.00 0.00 H new ATOM 0 HG SER A 78 1.989 -0.687 -9.156 1.00 0.00 H new ATOM 1163 N PRO A 79 -1.314 -2.867 -11.179 1.00 0.00 N ATOM 1164 CA PRO A 79 -1.725 -4.005 -12.007 1.00 0.00 C ATOM 1165 C PRO A 79 -1.099 -5.315 -11.542 1.00 0.00 C ATOM 1166 O PRO A 79 -1.667 -6.390 -11.738 1.00 0.00 O ATOM 1167 CB PRO A 79 -1.213 -3.633 -13.401 1.00 0.00 C ATOM 1168 CG PRO A 79 -0.072 -2.708 -13.151 1.00 0.00 C ATOM 1169 CD PRO A 79 -0.423 -1.945 -11.904 1.00 0.00 C ATOM 0 HA PRO A 79 -2.801 -4.173 -11.964 1.00 0.00 H new ATOM 0 HB2 PRO A 79 -0.893 -4.516 -13.954 1.00 0.00 H new ATOM 0 HB3 PRO A 79 -1.991 -3.151 -13.993 1.00 0.00 H new ATOM 0 HG2 PRO A 79 0.858 -3.262 -13.021 1.00 0.00 H new ATOM 0 HG3 PRO A 79 0.074 -2.032 -13.994 1.00 0.00 H new ATOM 0 HD2 PRO A 79 0.464 -1.701 -11.319 1.00 0.00 H new ATOM 0 HD3 PRO A 79 -0.921 -1.004 -12.136 1.00 0.00 H new ATOM 1177 N ASP A 80 0.074 -5.219 -10.926 1.00 0.00 N ATOM 1178 CA ASP A 80 0.776 -6.398 -10.431 1.00 0.00 C ATOM 1179 C ASP A 80 -0.024 -7.085 -9.329 1.00 0.00 C ATOM 1180 O ASP A 80 0.146 -8.278 -9.077 1.00 0.00 O ATOM 1181 CB ASP A 80 2.160 -6.011 -9.907 1.00 0.00 C ATOM 1182 CG ASP A 80 3.006 -5.322 -10.960 1.00 0.00 C ATOM 1183 OD1 ASP A 80 2.671 -4.179 -11.336 1.00 0.00 O ATOM 1184 OD2 ASP A 80 4.003 -5.925 -11.407 1.00 0.00 O ATOM 0 H ASP A 80 0.559 -4.338 -10.757 1.00 0.00 H new ATOM 0 HA ASP A 80 0.891 -7.096 -11.260 1.00 0.00 H new ATOM 0 HB2 ASP A 80 2.048 -5.352 -9.046 1.00 0.00 H new ATOM 0 HB3 ASP A 80 2.676 -6.905 -9.558 1.00 0.00 H new ATOM 1189 N TYR A 81 -0.896 -6.325 -8.676 1.00 0.00 N ATOM 1190 CA TYR A 81 -1.721 -6.860 -7.599 1.00 0.00 C ATOM 1191 C TYR A 81 -3.165 -7.037 -8.056 1.00 0.00 C ATOM 1192 O TYR A 81 -4.062 -7.262 -7.243 1.00 0.00 O ATOM 1193 CB TYR A 81 -1.668 -5.936 -6.382 1.00 0.00 C ATOM 1194 CG TYR A 81 -0.515 -6.228 -5.449 1.00 0.00 C ATOM 1195 CD1 TYR A 81 0.716 -6.641 -5.942 1.00 0.00 C ATOM 1196 CD2 TYR A 81 -0.656 -6.089 -4.073 1.00 0.00 C ATOM 1197 CE1 TYR A 81 1.772 -6.910 -5.093 1.00 0.00 C ATOM 1198 CE2 TYR A 81 0.395 -6.355 -3.217 1.00 0.00 C ATOM 1199 CZ TYR A 81 1.607 -6.765 -3.732 1.00 0.00 C ATOM 1200 OH TYR A 81 2.657 -7.031 -2.883 1.00 0.00 O ATOM 0 H TYR A 81 -1.050 -5.336 -8.874 1.00 0.00 H new ATOM 0 HA TYR A 81 -1.325 -7.837 -7.322 1.00 0.00 H new ATOM 0 HB2 TYR A 81 -1.595 -4.903 -6.723 1.00 0.00 H new ATOM 0 HB3 TYR A 81 -2.603 -6.024 -5.829 1.00 0.00 H new ATOM 0 HD1 TYR A 81 0.850 -6.754 -7.008 1.00 0.00 H new ATOM 0 HD2 TYR A 81 -1.603 -5.768 -3.666 1.00 0.00 H new ATOM 0 HE1 TYR A 81 2.722 -7.232 -5.493 1.00 0.00 H new ATOM 0 HE2 TYR A 81 0.268 -6.243 -2.150 1.00 0.00 H new ATOM 0 HH TYR A 81 2.375 -6.879 -1.957 1.00 0.00 H new ATOM 1210 N ALA A 82 -3.383 -6.934 -9.363 1.00 0.00 N ATOM 1211 CA ALA A 82 -4.717 -7.085 -9.929 1.00 0.00 C ATOM 1212 C ALA A 82 -4.667 -7.819 -11.265 1.00 0.00 C ATOM 1213 O ALA A 82 -3.665 -8.451 -11.600 1.00 0.00 O ATOM 1214 CB ALA A 82 -5.377 -5.725 -10.097 1.00 0.00 C ATOM 0 H ALA A 82 -2.652 -6.747 -10.050 1.00 0.00 H new ATOM 0 HA ALA A 82 -5.312 -7.682 -9.238 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -6.373 -5.854 -10.521 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -5.456 -5.237 -9.126 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -4.775 -5.109 -10.765 1.00 0.00 H new ATOM 1220 N TYR A 83 -5.753 -7.731 -12.025 1.00 0.00 N ATOM 1221 CA TYR A 83 -5.833 -8.389 -13.323 1.00 0.00 C ATOM 1222 C TYR A 83 -5.110 -7.576 -14.392 1.00 0.00 C ATOM 1223 O TYR A 83 -5.064 -7.963 -15.559 1.00 0.00 O ATOM 1224 CB TYR A 83 -7.295 -8.594 -13.725 1.00 0.00 C ATOM 1225 CG TYR A 83 -8.214 -8.855 -12.553 1.00 0.00 C ATOM 1226 CD1 TYR A 83 -8.333 -10.128 -12.009 1.00 0.00 C ATOM 1227 CD2 TYR A 83 -8.964 -7.829 -11.992 1.00 0.00 C ATOM 1228 CE1 TYR A 83 -9.173 -10.371 -10.939 1.00 0.00 C ATOM 1229 CE2 TYR A 83 -9.805 -8.063 -10.921 1.00 0.00 C ATOM 1230 CZ TYR A 83 -9.906 -9.335 -10.398 1.00 0.00 C ATOM 1231 OH TYR A 83 -10.743 -9.572 -9.332 1.00 0.00 O ATOM 0 H TYR A 83 -6.590 -7.210 -11.764 1.00 0.00 H new ATOM 0 HA TYR A 83 -5.346 -9.360 -13.240 1.00 0.00 H new ATOM 0 HB2 TYR A 83 -7.643 -7.710 -14.259 1.00 0.00 H new ATOM 0 HB3 TYR A 83 -7.358 -9.432 -14.419 1.00 0.00 H new ATOM 0 HD1 TYR A 83 -7.760 -10.941 -12.429 1.00 0.00 H new ATOM 0 HD2 TYR A 83 -8.888 -6.832 -12.400 1.00 0.00 H new ATOM 0 HE1 TYR A 83 -9.255 -11.367 -10.528 1.00 0.00 H new ATOM 0 HE2 TYR A 83 -10.380 -7.254 -10.496 1.00 0.00 H new ATOM 0 HH TYR A 83 -11.522 -8.980 -9.390 1.00 0.00 H new ATOM 1241 N GLY A 84 -4.543 -6.444 -13.983 1.00 0.00 N ATOM 1242 CA GLY A 84 -3.829 -5.593 -14.916 1.00 0.00 C ATOM 1243 C GLY A 84 -2.824 -6.363 -15.750 1.00 0.00 C ATOM 1244 O GLY A 84 -2.542 -5.995 -16.891 1.00 0.00 O ATOM 0 H GLY A 84 -4.566 -6.102 -13.022 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -4.544 -5.102 -15.576 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -3.313 -4.807 -14.365 1.00 0.00 H new ATOM 1248 N SER A 85 -2.281 -7.434 -15.181 1.00 0.00 N ATOM 1249 CA SER A 85 -1.297 -8.254 -15.878 1.00 0.00 C ATOM 1250 C SER A 85 -1.800 -8.645 -17.264 1.00 0.00 C ATOM 1251 O SER A 85 -1.305 -8.153 -18.278 1.00 0.00 O ATOM 1252 CB SER A 85 -0.982 -9.511 -15.064 1.00 0.00 C ATOM 1253 OG SER A 85 -0.011 -10.310 -15.717 1.00 0.00 O ATOM 0 H SER A 85 -2.506 -7.754 -14.239 1.00 0.00 H new ATOM 0 HA SER A 85 -0.386 -7.666 -15.993 1.00 0.00 H new ATOM 0 HB2 SER A 85 -0.620 -9.227 -14.076 1.00 0.00 H new ATOM 0 HB3 SER A 85 -1.894 -10.090 -14.915 1.00 0.00 H new ATOM 0 HG SER A 85 0.175 -11.106 -15.177 1.00 0.00 H new ATOM 1259 N ARG A 86 -2.788 -9.534 -17.299 1.00 0.00 N ATOM 1260 CA ARG A 86 -3.358 -9.993 -18.560 1.00 0.00 C ATOM 1261 C ARG A 86 -3.882 -8.818 -19.380 1.00 0.00 C ATOM 1262 O ARG A 86 -3.448 -8.593 -20.509 1.00 0.00 O ATOM 1263 CB ARG A 86 -4.488 -10.991 -18.299 1.00 0.00 C ATOM 1264 CG ARG A 86 -5.404 -11.199 -19.495 1.00 0.00 C ATOM 1265 CD ARG A 86 -4.616 -11.566 -20.743 1.00 0.00 C ATOM 1266 NE ARG A 86 -5.158 -12.750 -21.404 1.00 0.00 N ATOM 1267 CZ ARG A 86 -4.992 -13.987 -20.948 1.00 0.00 C ATOM 1268 NH1 ARG A 86 -4.304 -14.200 -19.835 1.00 0.00 N ATOM 1269 NH2 ARG A 86 -5.515 -15.013 -21.605 1.00 0.00 N ATOM 0 H ARG A 86 -3.210 -9.950 -16.469 1.00 0.00 H new ATOM 0 HA ARG A 86 -2.570 -10.487 -19.128 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -4.056 -11.950 -18.012 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -5.081 -10.643 -17.454 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -6.122 -11.988 -19.272 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -5.976 -10.290 -19.679 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -4.626 -10.726 -21.438 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -3.575 -11.745 -20.475 1.00 0.00 H new ATOM 0 HE ARG A 86 -5.693 -12.620 -22.263 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -3.901 -13.413 -19.326 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -4.178 -15.151 -19.487 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -6.045 -14.853 -22.461 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -5.387 -15.962 -21.254 1.00 0.00 H new ATOM 1283 N GLY A 87 -4.818 -8.071 -18.803 1.00 0.00 N ATOM 1284 CA GLY A 87 -5.386 -6.928 -19.494 1.00 0.00 C ATOM 1285 C GLY A 87 -6.202 -7.331 -20.707 1.00 0.00 C ATOM 1286 O GLY A 87 -5.858 -8.285 -21.406 1.00 0.00 O ATOM 0 H GLY A 87 -5.193 -8.237 -17.869 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -6.018 -6.368 -18.805 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -4.583 -6.260 -19.806 1.00 0.00 H new ATOM 1290 N HIS A 88 -7.286 -6.604 -20.957 1.00 0.00 N ATOM 1291 CA HIS A 88 -8.154 -6.892 -22.093 1.00 0.00 C ATOM 1292 C HIS A 88 -8.565 -5.605 -22.803 1.00 0.00 C ATOM 1293 O HIS A 88 -8.558 -4.519 -22.223 1.00 0.00 O ATOM 1294 CB HIS A 88 -9.397 -7.654 -21.632 1.00 0.00 C ATOM 1295 CG HIS A 88 -9.245 -9.142 -21.693 1.00 0.00 C ATOM 1296 ND1 HIS A 88 -8.807 -9.809 -22.818 1.00 0.00 N ATOM 1297 CD2 HIS A 88 -9.473 -10.095 -20.759 1.00 0.00 C ATOM 1298 CE1 HIS A 88 -8.774 -11.106 -22.574 1.00 0.00 C ATOM 1299 NE2 HIS A 88 -9.173 -11.306 -21.331 1.00 0.00 N ATOM 0 H HIS A 88 -7.584 -5.811 -20.388 1.00 0.00 H new ATOM 0 HA HIS A 88 -7.598 -7.512 -22.796 1.00 0.00 H new ATOM 0 HB2 HIS A 88 -9.632 -7.363 -20.608 1.00 0.00 H new ATOM 0 HB3 HIS A 88 -10.244 -7.358 -22.250 1.00 0.00 H new ATOM 0 HD2 HIS A 88 -9.825 -9.933 -19.751 1.00 0.00 H new ATOM 0 HE1 HIS A 88 -8.472 -11.873 -23.272 1.00 0.00 H new ATOM 0 HE2 HIS A 88 -9.246 -12.213 -20.871 1.00 0.00 H new ATOM 1307 N PRO A 89 -8.932 -5.728 -24.087 1.00 0.00 N ATOM 1308 CA PRO A 89 -9.352 -4.585 -24.903 1.00 0.00 C ATOM 1309 C PRO A 89 -10.704 -4.029 -24.469 1.00 0.00 C ATOM 1310 O PRO A 89 -11.724 -4.711 -24.557 1.00 0.00 O ATOM 1311 CB PRO A 89 -9.443 -5.171 -26.314 1.00 0.00 C ATOM 1312 CG PRO A 89 -9.692 -6.625 -26.105 1.00 0.00 C ATOM 1313 CD PRO A 89 -8.964 -6.992 -24.842 1.00 0.00 C ATOM 0 HA PRO A 89 -8.660 -3.747 -24.818 1.00 0.00 H new ATOM 0 HB2 PRO A 89 -10.250 -4.709 -26.883 1.00 0.00 H new ATOM 0 HB3 PRO A 89 -8.522 -5.003 -26.872 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -10.759 -6.829 -26.014 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -9.327 -7.209 -26.950 1.00 0.00 H new ATOM 0 HD2 PRO A 89 -9.484 -7.776 -24.292 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -7.960 -7.361 -25.050 1.00 0.00 H new ATOM 1321 N GLY A 90 -10.704 -2.785 -24.000 1.00 0.00 N ATOM 1322 CA GLY A 90 -11.937 -2.158 -23.560 1.00 0.00 C ATOM 1323 C GLY A 90 -12.386 -2.655 -22.200 1.00 0.00 C ATOM 1324 O GLY A 90 -13.503 -2.374 -21.766 1.00 0.00 O ATOM 0 H GLY A 90 -9.872 -2.200 -23.917 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -11.798 -1.078 -23.521 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -12.721 -2.352 -24.292 1.00 0.00 H new ATOM 1328 N VAL A 91 -11.514 -3.397 -21.525 1.00 0.00 N ATOM 1329 CA VAL A 91 -11.827 -3.935 -20.206 1.00 0.00 C ATOM 1330 C VAL A 91 -10.742 -3.579 -19.196 1.00 0.00 C ATOM 1331 O VAL A 91 -11.022 -2.989 -18.152 1.00 0.00 O ATOM 1332 CB VAL A 91 -11.990 -5.466 -20.249 1.00 0.00 C ATOM 1333 CG1 VAL A 91 -12.499 -5.987 -18.914 1.00 0.00 C ATOM 1334 CG2 VAL A 91 -12.924 -5.870 -21.380 1.00 0.00 C ATOM 0 H VAL A 91 -10.585 -3.639 -21.870 1.00 0.00 H new ATOM 0 HA VAL A 91 -12.770 -3.485 -19.896 1.00 0.00 H new ATOM 0 HB VAL A 91 -11.014 -5.913 -20.437 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -12.608 -7.070 -18.964 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -11.789 -5.729 -18.128 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -13.466 -5.535 -18.692 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -13.028 -6.955 -21.396 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -13.902 -5.414 -21.225 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -12.512 -5.531 -22.331 1.00 0.00 H new ATOM 1344 N ILE A 92 -9.504 -3.940 -19.513 1.00 0.00 N ATOM 1345 CA ILE A 92 -8.376 -3.656 -18.634 1.00 0.00 C ATOM 1346 C ILE A 92 -7.125 -3.318 -19.436 1.00 0.00 C ATOM 1347 O ILE A 92 -6.779 -3.990 -20.407 1.00 0.00 O ATOM 1348 CB ILE A 92 -8.072 -4.848 -17.707 1.00 0.00 C ATOM 1349 CG1 ILE A 92 -9.299 -5.189 -16.858 1.00 0.00 C ATOM 1350 CG2 ILE A 92 -6.876 -4.537 -16.819 1.00 0.00 C ATOM 1351 CD1 ILE A 92 -9.076 -6.348 -15.912 1.00 0.00 C ATOM 0 H ILE A 92 -9.256 -4.430 -20.372 1.00 0.00 H new ATOM 0 HA ILE A 92 -8.658 -2.796 -18.027 1.00 0.00 H new ATOM 0 HB ILE A 92 -7.828 -5.714 -18.322 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -9.587 -4.310 -16.281 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -10.134 -5.425 -17.518 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -6.674 -5.389 -16.170 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -6.003 -4.339 -17.441 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -7.094 -3.660 -16.210 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -9.987 -6.533 -15.343 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -8.817 -7.239 -16.483 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -8.263 -6.107 -15.227 1.00 0.00 H new ATOM 1363 N PRO A 93 -6.426 -2.251 -19.020 1.00 0.00 N ATOM 1364 CA PRO A 93 -5.200 -1.800 -19.684 1.00 0.00 C ATOM 1365 C PRO A 93 -4.038 -2.765 -19.474 1.00 0.00 C ATOM 1366 O PRO A 93 -4.028 -3.569 -18.542 1.00 0.00 O ATOM 1367 CB PRO A 93 -4.906 -0.456 -19.013 1.00 0.00 C ATOM 1368 CG PRO A 93 -5.556 -0.551 -17.676 1.00 0.00 C ATOM 1369 CD PRO A 93 -6.780 -1.403 -17.869 1.00 0.00 C ATOM 0 HA PRO A 93 -5.323 -1.734 -20.765 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -3.833 -0.286 -18.921 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -5.312 0.373 -19.593 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -4.881 -0.997 -16.945 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -5.824 0.437 -17.301 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -6.999 -1.999 -16.983 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -7.663 -0.798 -18.072 1.00 0.00 H new ATOM 1377 N PRO A 94 -3.034 -2.685 -20.359 1.00 0.00 N ATOM 1378 CA PRO A 94 -1.848 -3.544 -20.291 1.00 0.00 C ATOM 1379 C PRO A 94 -0.956 -3.207 -19.101 1.00 0.00 C ATOM 1380 O PRO A 94 -0.203 -2.234 -19.133 1.00 0.00 O ATOM 1381 CB PRO A 94 -1.120 -3.250 -21.605 1.00 0.00 C ATOM 1382 CG PRO A 94 -1.562 -1.878 -21.984 1.00 0.00 C ATOM 1383 CD PRO A 94 -2.978 -1.750 -21.495 1.00 0.00 C ATOM 0 HA PRO A 94 -2.112 -4.593 -20.160 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -0.038 -3.296 -21.477 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -1.382 -3.977 -22.374 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -0.922 -1.122 -21.529 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -1.507 -1.734 -23.063 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -3.206 -0.730 -21.187 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -3.696 -2.017 -22.270 1.00 0.00 H new ATOM 1391 N ASN A 95 -1.045 -4.017 -18.051 1.00 0.00 N ATOM 1392 CA ASN A 95 -0.246 -3.804 -16.850 1.00 0.00 C ATOM 1393 C ASN A 95 -0.310 -2.346 -16.406 1.00 0.00 C ATOM 1394 O ASN A 95 0.712 -1.666 -16.323 1.00 0.00 O ATOM 1395 CB ASN A 95 1.208 -4.208 -17.102 1.00 0.00 C ATOM 1396 CG ASN A 95 1.321 -5.469 -17.938 1.00 0.00 C ATOM 1397 OD1 ASN A 95 1.353 -6.579 -17.406 1.00 0.00 O ATOM 1398 ND2 ASN A 95 1.383 -5.302 -19.254 1.00 0.00 N ATOM 0 H ASN A 95 -1.663 -4.827 -18.008 1.00 0.00 H new ATOM 0 HA ASN A 95 -0.657 -4.426 -16.055 1.00 0.00 H new ATOM 0 HB2 ASN A 95 1.726 -3.393 -17.607 1.00 0.00 H new ATOM 0 HB3 ASN A 95 1.710 -4.362 -16.147 1.00 0.00 H new ATOM 0 HD21 ASN A 95 1.461 -6.113 -19.868 1.00 0.00 H new ATOM 0 HD22 ASN A 95 1.353 -4.363 -19.651 1.00 0.00 H new ATOM 1405 N ALA A 96 -1.519 -1.873 -16.121 1.00 0.00 N ATOM 1406 CA ALA A 96 -1.717 -0.497 -15.683 1.00 0.00 C ATOM 1407 C ALA A 96 -2.535 -0.443 -14.397 1.00 0.00 C ATOM 1408 O ALA A 96 -3.365 -1.315 -14.139 1.00 0.00 O ATOM 1409 CB ALA A 96 -2.395 0.314 -16.777 1.00 0.00 C ATOM 0 H ALA A 96 -2.376 -2.423 -16.186 1.00 0.00 H new ATOM 0 HA ALA A 96 -0.738 -0.063 -15.479 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -2.536 1.339 -16.435 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -1.771 0.312 -17.671 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -3.364 -0.128 -17.010 1.00 0.00 H new ATOM 1415 N THR A 97 -2.296 0.588 -13.591 1.00 0.00 N ATOM 1416 CA THR A 97 -3.009 0.755 -12.332 1.00 0.00 C ATOM 1417 C THR A 97 -4.518 0.751 -12.549 1.00 0.00 C ATOM 1418 O THR A 97 -5.010 1.235 -13.569 1.00 0.00 O ATOM 1419 CB THR A 97 -2.607 2.064 -11.628 1.00 0.00 C ATOM 1420 OG1 THR A 97 -1.216 2.329 -11.843 1.00 0.00 O ATOM 1421 CG2 THR A 97 -2.888 1.985 -10.135 1.00 0.00 C ATOM 0 H THR A 97 -1.613 1.320 -13.789 1.00 0.00 H new ATOM 0 HA THR A 97 -2.734 -0.089 -11.699 1.00 0.00 H new ATOM 0 HB THR A 97 -3.201 2.874 -12.051 1.00 0.00 H new ATOM 0 HG1 THR A 97 -0.969 3.164 -11.394 1.00 0.00 H new ATOM 0 HG21 THR A 97 -2.596 2.921 -9.660 1.00 0.00 H new ATOM 0 HG22 THR A 97 -3.952 1.813 -9.974 1.00 0.00 H new ATOM 0 HG23 THR A 97 -2.318 1.164 -9.700 1.00 0.00 H new ATOM 1429 N LEU A 98 -5.248 0.201 -11.585 1.00 0.00 N ATOM 1430 CA LEU A 98 -6.703 0.135 -11.671 1.00 0.00 C ATOM 1431 C LEU A 98 -7.346 0.547 -10.350 1.00 0.00 C ATOM 1432 O LEU A 98 -6.766 0.361 -9.280 1.00 0.00 O ATOM 1433 CB LEU A 98 -7.147 -1.279 -12.048 1.00 0.00 C ATOM 1434 CG LEU A 98 -6.411 -1.923 -13.223 1.00 0.00 C ATOM 1435 CD1 LEU A 98 -6.787 -3.391 -13.350 1.00 0.00 C ATOM 1436 CD2 LEU A 98 -6.714 -1.179 -14.516 1.00 0.00 C ATOM 0 H LEU A 98 -4.857 -0.205 -10.735 1.00 0.00 H new ATOM 0 HA LEU A 98 -7.029 0.830 -12.445 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -7.028 -1.921 -11.175 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -8.211 -1.254 -12.282 1.00 0.00 H new ATOM 0 HG LEU A 98 -5.340 -1.859 -13.033 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -6.253 -3.832 -14.192 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -6.517 -3.916 -12.434 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -7.861 -3.479 -13.515 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -6.181 -1.652 -15.341 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -7.786 -1.210 -14.711 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -6.392 -0.142 -14.423 1.00 0.00 H new ATOM 1448 N THR A 99 -8.550 1.105 -10.433 1.00 0.00 N ATOM 1449 CA THR A 99 -9.272 1.542 -9.245 1.00 0.00 C ATOM 1450 C THR A 99 -10.668 0.932 -9.195 1.00 0.00 C ATOM 1451 O THR A 99 -11.578 1.380 -9.892 1.00 0.00 O ATOM 1452 CB THR A 99 -9.394 3.077 -9.194 1.00 0.00 C ATOM 1453 OG1 THR A 99 -8.106 3.677 -9.375 1.00 0.00 O ATOM 1454 CG2 THR A 99 -9.988 3.529 -7.869 1.00 0.00 C ATOM 0 H THR A 99 -9.045 1.265 -11.310 1.00 0.00 H new ATOM 0 HA THR A 99 -8.698 1.201 -8.383 1.00 0.00 H new ATOM 0 HB THR A 99 -10.058 3.394 -9.998 1.00 0.00 H new ATOM 0 HG1 THR A 99 -8.192 4.653 -9.343 1.00 0.00 H new ATOM 0 HG21 THR A 99 -10.064 4.616 -7.857 1.00 0.00 H new ATOM 0 HG22 THR A 99 -10.980 3.094 -7.748 1.00 0.00 H new ATOM 0 HG23 THR A 99 -9.346 3.201 -7.052 1.00 0.00 H new ATOM 1462 N PHE A 100 -10.831 -0.093 -8.364 1.00 0.00 N ATOM 1463 CA PHE A 100 -12.117 -0.766 -8.223 1.00 0.00 C ATOM 1464 C PHE A 100 -12.800 -0.365 -6.919 1.00 0.00 C ATOM 1465 O PHE A 100 -12.277 -0.609 -5.832 1.00 0.00 O ATOM 1466 CB PHE A 100 -11.930 -2.284 -8.269 1.00 0.00 C ATOM 1467 CG PHE A 100 -11.364 -2.779 -9.569 1.00 0.00 C ATOM 1468 CD1 PHE A 100 -9.993 -2.840 -9.765 1.00 0.00 C ATOM 1469 CD2 PHE A 100 -12.202 -3.184 -10.596 1.00 0.00 C ATOM 1470 CE1 PHE A 100 -9.469 -3.296 -10.960 1.00 0.00 C ATOM 1471 CE2 PHE A 100 -11.683 -3.641 -11.792 1.00 0.00 C ATOM 1472 CZ PHE A 100 -10.315 -3.696 -11.975 1.00 0.00 C ATOM 0 H PHE A 100 -10.089 -0.475 -7.778 1.00 0.00 H new ATOM 0 HA PHE A 100 -12.752 -0.460 -9.054 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -11.269 -2.585 -7.456 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -12.892 -2.766 -8.094 1.00 0.00 H new ATOM 0 HD1 PHE A 100 -9.327 -2.528 -8.975 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -13.273 -3.142 -10.460 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -8.399 -3.339 -11.100 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -12.347 -3.955 -12.584 1.00 0.00 H new ATOM 0 HZ PHE A 100 -9.908 -4.051 -12.910 1.00 0.00 H new ATOM 1482 N ASP A 101 -13.971 0.251 -7.037 1.00 0.00 N ATOM 1483 CA ASP A 101 -14.727 0.685 -5.868 1.00 0.00 C ATOM 1484 C ASP A 101 -15.375 -0.505 -5.167 1.00 0.00 C ATOM 1485 O ASP A 101 -16.200 -1.208 -5.749 1.00 0.00 O ATOM 1486 CB ASP A 101 -15.799 1.698 -6.275 1.00 0.00 C ATOM 1487 CG ASP A 101 -16.943 1.760 -5.283 1.00 0.00 C ATOM 1488 OD1 ASP A 101 -16.784 2.420 -4.235 1.00 0.00 O ATOM 1489 OD2 ASP A 101 -17.998 1.149 -5.554 1.00 0.00 O ATOM 0 H ASP A 101 -14.417 0.461 -7.930 1.00 0.00 H new ATOM 0 HA ASP A 101 -14.034 1.160 -5.173 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -15.346 2.685 -6.365 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -16.189 1.435 -7.258 1.00 0.00 H new ATOM 1494 N VAL A 102 -14.994 -0.725 -3.912 1.00 0.00 N ATOM 1495 CA VAL A 102 -15.537 -1.829 -3.131 1.00 0.00 C ATOM 1496 C VAL A 102 -16.451 -1.321 -2.022 1.00 0.00 C ATOM 1497 O VAL A 102 -16.137 -0.342 -1.346 1.00 0.00 O ATOM 1498 CB VAL A 102 -14.415 -2.680 -2.506 1.00 0.00 C ATOM 1499 CG1 VAL A 102 -13.879 -3.682 -3.517 1.00 0.00 C ATOM 1500 CG2 VAL A 102 -13.298 -1.788 -1.984 1.00 0.00 C ATOM 0 H VAL A 102 -14.311 -0.153 -3.415 1.00 0.00 H new ATOM 0 HA VAL A 102 -16.114 -2.448 -3.818 1.00 0.00 H new ATOM 0 HB VAL A 102 -14.829 -3.235 -1.664 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -13.087 -4.274 -3.058 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -14.685 -4.341 -3.838 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -13.480 -3.150 -4.380 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -12.514 -2.406 -1.546 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -12.884 -1.205 -2.806 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -13.695 -1.114 -1.225 1.00 0.00 H new ATOM 1510 N GLU A 103 -17.583 -1.993 -1.841 1.00 0.00 N ATOM 1511 CA GLU A 103 -18.544 -1.608 -0.813 1.00 0.00 C ATOM 1512 C GLU A 103 -18.979 -2.820 0.006 1.00 0.00 C ATOM 1513 O GLU A 103 -19.671 -3.707 -0.496 1.00 0.00 O ATOM 1514 CB GLU A 103 -19.766 -0.944 -1.450 1.00 0.00 C ATOM 1515 CG GLU A 103 -20.895 -0.679 -0.468 1.00 0.00 C ATOM 1516 CD GLU A 103 -22.040 0.096 -1.090 1.00 0.00 C ATOM 1517 OE1 GLU A 103 -22.340 -0.140 -2.279 1.00 0.00 O ATOM 1518 OE2 GLU A 103 -22.636 0.940 -0.388 1.00 0.00 O ATOM 0 H GLU A 103 -17.858 -2.806 -2.392 1.00 0.00 H new ATOM 0 HA GLU A 103 -18.059 -0.896 -0.146 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -19.461 -0.001 -1.904 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -20.137 -1.580 -2.254 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -21.269 -1.629 -0.086 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -20.506 -0.123 0.385 1.00 0.00 H new ATOM 1525 N LEU A 104 -18.568 -2.851 1.269 1.00 0.00 N ATOM 1526 CA LEU A 104 -18.914 -3.954 2.159 1.00 0.00 C ATOM 1527 C LEU A 104 -20.420 -4.011 2.395 1.00 0.00 C ATOM 1528 O LEU A 104 -21.041 -3.010 2.752 1.00 0.00 O ATOM 1529 CB LEU A 104 -18.182 -3.806 3.494 1.00 0.00 C ATOM 1530 CG LEU A 104 -17.804 -5.109 4.200 1.00 0.00 C ATOM 1531 CD1 LEU A 104 -18.958 -6.098 4.149 1.00 0.00 C ATOM 1532 CD2 LEU A 104 -16.555 -5.712 3.574 1.00 0.00 C ATOM 0 H LEU A 104 -17.995 -2.125 1.700 1.00 0.00 H new ATOM 0 HA LEU A 104 -18.604 -4.884 1.683 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -17.272 -3.231 3.325 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -18.809 -3.220 4.166 1.00 0.00 H new ATOM 0 HG LEU A 104 -17.590 -4.885 5.245 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -18.671 -7.019 4.656 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -19.828 -5.667 4.644 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -19.203 -6.317 3.110 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -16.301 -6.638 4.089 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -16.741 -5.922 2.521 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -15.727 -5.008 3.663 1.00 0.00 H new ATOM 1544 N LEU A 105 -21.000 -5.189 2.195 1.00 0.00 N ATOM 1545 CA LEU A 105 -22.434 -5.379 2.389 1.00 0.00 C ATOM 1546 C LEU A 105 -22.705 -6.339 3.543 1.00 0.00 C ATOM 1547 O LEU A 105 -23.482 -6.033 4.448 1.00 0.00 O ATOM 1548 CB LEU A 105 -23.075 -5.910 1.106 1.00 0.00 C ATOM 1549 CG LEU A 105 -23.407 -4.866 0.039 1.00 0.00 C ATOM 1550 CD1 LEU A 105 -22.434 -4.966 -1.125 1.00 0.00 C ATOM 1551 CD2 LEU A 105 -24.840 -5.034 -0.445 1.00 0.00 C ATOM 0 H LEU A 105 -20.500 -6.027 1.899 1.00 0.00 H new ATOM 0 HA LEU A 105 -22.874 -4.413 2.635 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -22.404 -6.648 0.667 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -23.994 -6.433 1.372 1.00 0.00 H new ATOM 0 HG LEU A 105 -23.309 -3.876 0.484 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -22.685 -4.216 -1.875 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -21.419 -4.795 -0.766 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -22.499 -5.959 -1.569 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -25.058 -4.283 -1.204 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -24.965 -6.029 -0.873 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -25.524 -4.911 0.394 1.00 0.00 H new ATOM 1563 N ARG A 106 -22.059 -7.499 3.504 1.00 0.00 N ATOM 1564 CA ARG A 106 -22.230 -8.504 4.547 1.00 0.00 C ATOM 1565 C ARG A 106 -20.909 -9.205 4.849 1.00 0.00 C ATOM 1566 O ARG A 106 -19.939 -9.072 4.103 1.00 0.00 O ATOM 1567 CB ARG A 106 -23.282 -9.532 4.126 1.00 0.00 C ATOM 1568 CG ARG A 106 -24.598 -8.913 3.686 1.00 0.00 C ATOM 1569 CD ARG A 106 -24.675 -8.785 2.173 1.00 0.00 C ATOM 1570 NE ARG A 106 -25.344 -9.929 1.560 1.00 0.00 N ATOM 1571 CZ ARG A 106 -26.661 -10.106 1.576 1.00 0.00 C ATOM 1572 NH1 ARG A 106 -27.445 -9.217 2.169 1.00 0.00 N ATOM 1573 NH2 ARG A 106 -27.195 -11.174 0.996 1.00 0.00 N ATOM 0 H ARG A 106 -21.412 -7.767 2.762 1.00 0.00 H new ATOM 0 HA ARG A 106 -22.567 -7.999 5.452 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -22.883 -10.134 3.310 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -23.470 -10.209 4.959 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -25.426 -9.525 4.043 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -24.709 -7.929 4.142 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -25.209 -7.871 1.913 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -23.668 -8.693 1.765 1.00 0.00 H new ATOM 0 HE ARG A 106 -24.769 -10.631 1.094 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -27.038 -8.395 2.614 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -28.456 -9.355 2.180 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -26.594 -11.859 0.538 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -28.206 -11.309 1.009 1.00 0.00 H new ATOM 1587 N VAL A 107 -20.879 -9.952 5.948 1.00 0.00 N ATOM 1588 CA VAL A 107 -19.678 -10.675 6.348 1.00 0.00 C ATOM 1589 C VAL A 107 -20.025 -12.050 6.908 1.00 0.00 C ATOM 1590 O VAL A 107 -21.011 -12.207 7.626 1.00 0.00 O ATOM 1591 CB VAL A 107 -18.876 -9.890 7.404 1.00 0.00 C ATOM 1592 CG1 VAL A 107 -17.664 -10.690 7.857 1.00 0.00 C ATOM 1593 CG2 VAL A 107 -18.456 -8.536 6.854 1.00 0.00 C ATOM 0 H VAL A 107 -21.673 -10.072 6.577 1.00 0.00 H new ATOM 0 HA VAL A 107 -19.067 -10.794 5.453 1.00 0.00 H new ATOM 0 HB VAL A 107 -19.515 -9.722 8.271 1.00 0.00 H new ATOM 0 HG11 VAL A 107 -17.110 -10.120 8.603 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -17.993 -11.634 8.292 1.00 0.00 H new ATOM 0 HG13 VAL A 107 -17.020 -10.890 7.001 1.00 0.00 H new ATOM 0 HG21 VAL A 107 -17.891 -7.995 7.613 1.00 0.00 H new ATOM 0 HG22 VAL A 107 -17.833 -8.679 5.971 1.00 0.00 H new ATOM 0 HG23 VAL A 107 -19.342 -7.962 6.584 1.00 0.00 H new ATOM 1603 N GLU A 108 -19.206 -13.043 6.574 1.00 0.00 N ATOM 1604 CA GLU A 108 -19.427 -14.405 7.044 1.00 0.00 C ATOM 1605 C GLU A 108 -18.105 -15.081 7.395 1.00 0.00 C ATOM 1606 O GLU A 108 -17.427 -15.628 6.526 1.00 0.00 O ATOM 1607 CB GLU A 108 -20.164 -15.222 5.981 1.00 0.00 C ATOM 1608 CG GLU A 108 -21.560 -14.705 5.675 1.00 0.00 C ATOM 1609 CD GLU A 108 -22.595 -15.195 6.669 1.00 0.00 C ATOM 1610 OE1 GLU A 108 -22.340 -15.095 7.888 1.00 0.00 O ATOM 1611 OE2 GLU A 108 -23.658 -15.680 6.229 1.00 0.00 O ATOM 0 H GLU A 108 -18.384 -12.929 5.980 1.00 0.00 H new ATOM 0 HA GLU A 108 -20.040 -14.356 7.944 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -19.576 -15.222 5.063 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -20.234 -16.257 6.315 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -21.548 -13.615 5.676 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -21.848 -15.019 4.672 1.00 0.00 H new