USER MOD reduce.3.24.130724 H: found=0, std=0, add=495, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 498 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 Single : A 89 MET CE :methyl -178:sc= 0 (180deg=-0.00617) USER MOD Single : A 90 GLN : amide:sc= -0.0449 X(o=-0.045,f=-0.061) USER MOD Single : A 91 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 100 TYR OH : rot -153:sc= 1.27 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 107 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 THR OG1 : rot -153:sc= 1.27 USER MOD Single : A 113 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 123 THR OG1 : rot 33:sc= 1.25 USER MOD Single : A 125 SER OG : rot -152:sc= 1.24 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 132 MET CE :methyl -137:sc= 0 (180deg=-1.65!) USER MOD Single : A 141 SER OG : rot 9:sc= 0.944 USER MOD Single : A 143 THR OG1 : rot -160:sc= -0.126 USER MOD Single : A 150 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 153 MET CE :methyl -163:sc= -0.267 (180deg=-0.712) USER MOD Single : A 154 THR OG1 : rot -72:sc= 0.81 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 89 4.820 10.571 -3.684 1.00 0.00 N ATOM 2 CA MET A 89 5.985 9.910 -4.308 1.00 0.00 C ATOM 3 C MET A 89 7.261 10.664 -3.952 1.00 0.00 C ATOM 4 O MET A 89 7.710 11.534 -4.699 1.00 0.00 O ATOM 5 CB MET A 89 5.812 9.848 -5.827 1.00 0.00 C ATOM 6 CG MET A 89 6.941 9.123 -6.544 1.00 0.00 C ATOM 7 SD MET A 89 6.715 9.099 -8.332 1.00 0.00 S ATOM 8 CE MET A 89 8.212 8.259 -8.855 1.00 0.00 C ATOM 0 HA MET A 89 6.058 8.891 -3.927 1.00 0.00 H new ATOM 0 HB2 MET A 89 4.870 9.350 -6.056 1.00 0.00 H new ATOM 0 HB3 MET A 89 5.739 10.863 -6.217 1.00 0.00 H new ATOM 0 HG2 MET A 89 7.888 9.607 -6.307 1.00 0.00 H new ATOM 0 HG3 MET A 89 7.004 8.099 -6.175 1.00 0.00 H new ATOM 0 HE1 MET A 89 8.235 8.200 -9.943 1.00 0.00 H new ATOM 0 HE2 MET A 89 9.082 8.813 -8.503 1.00 0.00 H new ATOM 0 HE3 MET A 89 8.230 7.253 -8.436 1.00 0.00 H new ATOM 20 N GLN A 90 7.828 10.334 -2.801 1.00 0.00 N ATOM 21 CA GLN A 90 9.033 10.997 -2.321 1.00 0.00 C ATOM 22 C GLN A 90 10.277 10.299 -2.859 1.00 0.00 C ATOM 23 O GLN A 90 11.060 10.882 -3.609 1.00 0.00 O ATOM 24 CB GLN A 90 9.055 11.004 -0.789 1.00 0.00 C ATOM 25 CG GLN A 90 7.803 11.604 -0.168 1.00 0.00 C ATOM 26 CD GLN A 90 7.591 13.051 -0.570 1.00 0.00 C ATOM 27 OE1 GLN A 90 6.953 13.340 -1.582 1.00 0.00 O ATOM 28 NE2 GLN A 90 8.114 13.966 0.227 1.00 0.00 N ATOM 0 H GLN A 90 7.472 9.608 -2.179 1.00 0.00 H new ATOM 0 HA GLN A 90 9.029 12.026 -2.681 1.00 0.00 H new ATOM 0 HB2 GLN A 90 9.175 9.982 -0.430 1.00 0.00 H new ATOM 0 HB3 GLN A 90 9.925 11.565 -0.448 1.00 0.00 H new ATOM 0 HG2 GLN A 90 6.935 11.016 -0.468 1.00 0.00 H new ATOM 0 HG3 GLN A 90 7.873 11.538 0.918 1.00 0.00 H new ATOM 0 HE21 GLN A 90 8.636 13.682 1.056 1.00 0.00 H new ATOM 0 HE22 GLN A 90 7.996 14.956 0.013 1.00 0.00 H new ATOM 37 N GLN A 91 10.440 9.037 -2.489 1.00 0.00 N ATOM 38 CA GLN A 91 11.581 8.249 -2.927 1.00 0.00 C ATOM 39 C GLN A 91 11.087 7.031 -3.689 1.00 0.00 C ATOM 40 O GLN A 91 11.372 5.895 -3.318 1.00 0.00 O ATOM 41 CB GLN A 91 12.425 7.807 -1.726 1.00 0.00 C ATOM 42 CG GLN A 91 12.961 8.957 -0.893 1.00 0.00 C ATOM 43 CD GLN A 91 13.889 8.496 0.209 1.00 0.00 C ATOM 44 OE1 GLN A 91 13.457 8.215 1.327 1.00 0.00 O ATOM 45 NE2 GLN A 91 15.168 8.391 -0.105 1.00 0.00 N ATOM 0 H GLN A 91 9.791 8.535 -1.883 1.00 0.00 H new ATOM 0 HA GLN A 91 12.205 8.861 -3.578 1.00 0.00 H new ATOM 0 HB2 GLN A 91 11.822 7.160 -1.089 1.00 0.00 H new ATOM 0 HB3 GLN A 91 13.263 7.209 -2.084 1.00 0.00 H new ATOM 0 HG2 GLN A 91 13.492 9.654 -1.542 1.00 0.00 H new ATOM 0 HG3 GLN A 91 12.126 9.503 -0.454 1.00 0.00 H new ATOM 0 HE21 GLN A 91 15.484 8.634 -1.044 1.00 0.00 H new ATOM 0 HE22 GLN A 91 15.839 8.067 0.591 1.00 0.00 H new ATOM 54 N GLU A 92 10.313 7.286 -4.742 1.00 0.00 N ATOM 55 CA GLU A 92 9.657 6.221 -5.504 1.00 0.00 C ATOM 56 C GLU A 92 8.640 5.502 -4.620 1.00 0.00 C ATOM 57 O GLU A 92 8.465 5.844 -3.450 1.00 0.00 O ATOM 58 CB GLU A 92 10.680 5.223 -6.069 1.00 0.00 C ATOM 59 CG GLU A 92 11.594 5.811 -7.132 1.00 0.00 C ATOM 60 CD GLU A 92 12.525 4.779 -7.736 1.00 0.00 C ATOM 61 OE1 GLU A 92 12.243 3.569 -7.614 1.00 0.00 O ATOM 62 OE2 GLU A 92 13.542 5.170 -8.349 1.00 0.00 O ATOM 0 H GLU A 92 10.123 8.226 -5.090 1.00 0.00 H new ATOM 0 HA GLU A 92 9.140 6.675 -6.349 1.00 0.00 H new ATOM 0 HB2 GLU A 92 11.290 4.841 -5.250 1.00 0.00 H new ATOM 0 HB3 GLU A 92 10.147 4.372 -6.493 1.00 0.00 H new ATOM 0 HG2 GLU A 92 10.988 6.255 -7.922 1.00 0.00 H new ATOM 0 HG3 GLU A 92 12.185 6.615 -6.694 1.00 0.00 H new ATOM 69 N LEU A 93 7.941 4.534 -5.183 1.00 0.00 N ATOM 70 CA LEU A 93 6.951 3.779 -4.431 1.00 0.00 C ATOM 71 C LEU A 93 7.511 2.417 -4.034 1.00 0.00 C ATOM 72 O LEU A 93 6.855 1.634 -3.349 1.00 0.00 O ATOM 73 CB LEU A 93 5.680 3.602 -5.262 1.00 0.00 C ATOM 74 CG LEU A 93 5.083 4.898 -5.822 1.00 0.00 C ATOM 75 CD1 LEU A 93 3.799 4.607 -6.578 1.00 0.00 C ATOM 76 CD2 LEU A 93 4.826 5.903 -4.708 1.00 0.00 C ATOM 0 H LEU A 93 8.039 4.251 -6.158 1.00 0.00 H new ATOM 0 HA LEU A 93 6.706 4.333 -3.525 1.00 0.00 H new ATOM 0 HB2 LEU A 93 5.899 2.932 -6.094 1.00 0.00 H new ATOM 0 HB3 LEU A 93 4.927 3.110 -4.646 1.00 0.00 H new ATOM 0 HG LEU A 93 5.804 5.333 -6.514 1.00 0.00 H new ATOM 0 HD11 LEU A 93 3.388 5.538 -6.969 1.00 0.00 H new ATOM 0 HD12 LEU A 93 4.009 3.928 -7.404 1.00 0.00 H new ATOM 0 HD13 LEU A 93 3.077 4.146 -5.904 1.00 0.00 H new ATOM 0 HD21 LEU A 93 4.402 6.814 -5.131 1.00 0.00 H new ATOM 0 HD22 LEU A 93 4.127 5.478 -3.988 1.00 0.00 H new ATOM 0 HD23 LEU A 93 5.765 6.138 -4.206 1.00 0.00 H new ATOM 88 N ARG A 94 8.741 2.150 -4.453 1.00 0.00 N ATOM 89 CA ARG A 94 9.353 0.840 -4.246 1.00 0.00 C ATOM 90 C ARG A 94 9.929 0.693 -2.842 1.00 0.00 C ATOM 91 O ARG A 94 9.871 -0.387 -2.266 1.00 0.00 O ATOM 92 CB ARG A 94 10.458 0.571 -5.272 1.00 0.00 C ATOM 93 CG ARG A 94 9.961 0.353 -6.693 1.00 0.00 C ATOM 94 CD ARG A 94 9.623 1.661 -7.384 1.00 0.00 C ATOM 95 NE ARG A 94 9.174 1.439 -8.753 1.00 0.00 N ATOM 96 CZ ARG A 94 9.849 1.833 -9.830 1.00 0.00 C ATOM 97 NH1 ARG A 94 10.988 2.502 -9.697 1.00 0.00 N ATOM 98 NH2 ARG A 94 9.377 1.568 -11.037 1.00 0.00 N ATOM 0 H ARG A 94 9.336 2.821 -4.938 1.00 0.00 H new ATOM 0 HA ARG A 94 8.556 0.108 -4.374 1.00 0.00 H new ATOM 0 HB2 ARG A 94 11.152 1.412 -5.268 1.00 0.00 H new ATOM 0 HB3 ARG A 94 11.021 -0.308 -4.959 1.00 0.00 H new ATOM 0 HG2 ARG A 94 10.723 -0.174 -7.267 1.00 0.00 H new ATOM 0 HG3 ARG A 94 9.078 -0.286 -6.674 1.00 0.00 H new ATOM 0 HD2 ARG A 94 8.845 2.180 -6.824 1.00 0.00 H new ATOM 0 HD3 ARG A 94 10.499 2.309 -7.387 1.00 0.00 H new ATOM 0 HE ARG A 94 8.289 0.952 -8.894 1.00 0.00 H new ATOM 0 HH11 ARG A 94 11.348 2.716 -8.767 1.00 0.00 H new ATOM 0 HH12 ARG A 94 11.503 2.802 -10.525 1.00 0.00 H new ATOM 0 HH21 ARG A 94 8.497 1.063 -11.141 1.00 0.00 H new ATOM 0 HH22 ARG A 94 9.893 1.869 -11.864 1.00 0.00 H new ATOM 112 N GLU A 95 10.468 1.778 -2.297 1.00 0.00 N ATOM 113 CA GLU A 95 11.175 1.733 -1.010 1.00 0.00 C ATOM 114 C GLU A 95 10.329 1.089 0.085 1.00 0.00 C ATOM 115 O GLU A 95 10.812 0.231 0.831 1.00 0.00 O ATOM 116 CB GLU A 95 11.588 3.141 -0.591 1.00 0.00 C ATOM 117 CG GLU A 95 12.552 3.801 -1.558 1.00 0.00 C ATOM 118 CD GLU A 95 13.915 3.141 -1.583 1.00 0.00 C ATOM 119 OE1 GLU A 95 14.012 1.968 -2.007 1.00 0.00 O ATOM 120 OE2 GLU A 95 14.901 3.801 -1.195 1.00 0.00 O ATOM 0 H GLU A 95 10.432 2.704 -2.723 1.00 0.00 H new ATOM 0 HA GLU A 95 12.063 1.116 -1.145 1.00 0.00 H new ATOM 0 HB2 GLU A 95 10.696 3.761 -0.500 1.00 0.00 H new ATOM 0 HB3 GLU A 95 12.048 3.098 0.396 1.00 0.00 H new ATOM 0 HG2 GLU A 95 12.125 3.777 -2.561 1.00 0.00 H new ATOM 0 HG3 GLU A 95 12.668 4.850 -1.286 1.00 0.00 H new ATOM 127 N ALA A 96 9.066 1.489 0.161 1.00 0.00 N ATOM 128 CA ALA A 96 8.148 0.953 1.160 1.00 0.00 C ATOM 129 C ALA A 96 7.942 -0.546 0.967 1.00 0.00 C ATOM 130 O ALA A 96 7.911 -1.308 1.931 1.00 0.00 O ATOM 131 CB ALA A 96 6.815 1.684 1.097 1.00 0.00 C ATOM 0 H ALA A 96 8.652 2.185 -0.459 1.00 0.00 H new ATOM 0 HA ALA A 96 8.589 1.109 2.145 1.00 0.00 H new ATOM 0 HB1 ALA A 96 6.139 1.274 1.848 1.00 0.00 H new ATOM 0 HB2 ALA A 96 6.972 2.745 1.291 1.00 0.00 H new ATOM 0 HB3 ALA A 96 6.377 1.557 0.107 1.00 0.00 H new ATOM 137 N PHE A 97 7.826 -0.963 -0.287 1.00 0.00 N ATOM 138 CA PHE A 97 7.607 -2.365 -0.609 1.00 0.00 C ATOM 139 C PHE A 97 8.871 -3.176 -0.339 1.00 0.00 C ATOM 140 O PHE A 97 8.806 -4.242 0.257 1.00 0.00 O ATOM 141 CB PHE A 97 7.183 -2.513 -2.080 1.00 0.00 C ATOM 142 CG PHE A 97 6.701 -3.895 -2.446 1.00 0.00 C ATOM 143 CD1 PHE A 97 7.600 -4.912 -2.709 1.00 0.00 C ATOM 144 CD2 PHE A 97 5.344 -4.170 -2.528 1.00 0.00 C ATOM 145 CE1 PHE A 97 7.160 -6.180 -3.039 1.00 0.00 C ATOM 146 CE2 PHE A 97 4.898 -5.436 -2.862 1.00 0.00 C ATOM 147 CZ PHE A 97 5.808 -6.445 -3.115 1.00 0.00 C ATOM 0 H PHE A 97 7.880 -0.348 -1.099 1.00 0.00 H new ATOM 0 HA PHE A 97 6.807 -2.747 0.026 1.00 0.00 H new ATOM 0 HB2 PHE A 97 6.391 -1.795 -2.293 1.00 0.00 H new ATOM 0 HB3 PHE A 97 8.028 -2.254 -2.718 1.00 0.00 H new ATOM 0 HD1 PHE A 97 8.660 -4.713 -2.656 1.00 0.00 H new ATOM 0 HD2 PHE A 97 4.628 -3.387 -2.329 1.00 0.00 H new ATOM 0 HE1 PHE A 97 7.875 -6.964 -3.238 1.00 0.00 H new ATOM 0 HE2 PHE A 97 3.839 -5.636 -2.925 1.00 0.00 H new ATOM 0 HZ PHE A 97 5.463 -7.436 -3.371 1.00 0.00 H new ATOM 157 N ARG A 98 10.015 -2.633 -0.745 1.00 0.00 N ATOM 158 CA ARG A 98 11.300 -3.341 -0.678 1.00 0.00 C ATOM 159 C ARG A 98 11.635 -3.849 0.728 1.00 0.00 C ATOM 160 O ARG A 98 12.274 -4.890 0.877 1.00 0.00 O ATOM 161 CB ARG A 98 12.428 -2.437 -1.183 1.00 0.00 C ATOM 162 CG ARG A 98 12.375 -2.193 -2.683 1.00 0.00 C ATOM 163 CD ARG A 98 13.413 -1.172 -3.123 1.00 0.00 C ATOM 164 NE ARG A 98 13.439 -1.012 -4.578 1.00 0.00 N ATOM 165 CZ ARG A 98 13.891 0.080 -5.207 1.00 0.00 C ATOM 166 NH1 ARG A 98 14.264 1.148 -4.514 1.00 0.00 N ATOM 167 NH2 ARG A 98 13.935 0.109 -6.535 1.00 0.00 N ATOM 0 H ARG A 98 10.083 -1.691 -1.130 1.00 0.00 H new ATOM 0 HA ARG A 98 11.205 -4.217 -1.319 1.00 0.00 H new ATOM 0 HB2 ARG A 98 12.378 -1.480 -0.664 1.00 0.00 H new ATOM 0 HB3 ARG A 98 13.387 -2.888 -0.929 1.00 0.00 H new ATOM 0 HG2 ARG A 98 12.542 -3.132 -3.211 1.00 0.00 H new ATOM 0 HG3 ARG A 98 11.380 -1.844 -2.960 1.00 0.00 H new ATOM 0 HD2 ARG A 98 13.198 -0.211 -2.656 1.00 0.00 H new ATOM 0 HD3 ARG A 98 14.398 -1.482 -2.774 1.00 0.00 H new ATOM 0 HE ARG A 98 13.090 -1.782 -5.149 1.00 0.00 H new ATOM 0 HH11 ARG A 98 14.207 1.140 -3.496 1.00 0.00 H new ATOM 0 HH12 ARG A 98 14.607 1.977 -5.000 1.00 0.00 H new ATOM 0 HH21 ARG A 98 13.625 -0.700 -7.073 1.00 0.00 H new ATOM 0 HH22 ARG A 98 14.279 0.940 -7.016 1.00 0.00 H new ATOM 181 N LEU A 99 11.209 -3.123 1.753 1.00 0.00 N ATOM 182 CA LEU A 99 11.497 -3.518 3.134 1.00 0.00 C ATOM 183 C LEU A 99 10.656 -4.722 3.550 1.00 0.00 C ATOM 184 O LEU A 99 11.145 -5.635 4.211 1.00 0.00 O ATOM 185 CB LEU A 99 11.248 -2.352 4.091 1.00 0.00 C ATOM 186 CG LEU A 99 12.175 -1.148 3.899 1.00 0.00 C ATOM 187 CD1 LEU A 99 11.810 -0.043 4.874 1.00 0.00 C ATOM 188 CD2 LEU A 99 13.628 -1.561 4.078 1.00 0.00 C ATOM 0 H LEU A 99 10.667 -2.264 1.661 1.00 0.00 H new ATOM 0 HA LEU A 99 12.549 -3.799 3.185 1.00 0.00 H new ATOM 0 HB2 LEU A 99 10.217 -2.020 3.974 1.00 0.00 H new ATOM 0 HB3 LEU A 99 11.353 -2.713 5.114 1.00 0.00 H new ATOM 0 HG LEU A 99 12.049 -0.770 2.884 1.00 0.00 H new ATOM 0 HD11 LEU A 99 12.477 0.807 4.727 1.00 0.00 H new ATOM 0 HD12 LEU A 99 10.780 0.269 4.701 1.00 0.00 H new ATOM 0 HD13 LEU A 99 11.911 -0.411 5.895 1.00 0.00 H new ATOM 0 HD21 LEU A 99 14.273 -0.693 3.938 1.00 0.00 H new ATOM 0 HD22 LEU A 99 13.771 -1.962 5.082 1.00 0.00 H new ATOM 0 HD23 LEU A 99 13.882 -2.324 3.343 1.00 0.00 H new ATOM 200 N TYR A 100 9.400 -4.715 3.143 1.00 0.00 N ATOM 201 CA TYR A 100 8.456 -5.768 3.503 1.00 0.00 C ATOM 202 C TYR A 100 8.272 -6.732 2.335 1.00 0.00 C ATOM 203 O TYR A 100 7.309 -7.500 2.281 1.00 0.00 O ATOM 204 CB TYR A 100 7.118 -5.150 3.917 1.00 0.00 C ATOM 205 CG TYR A 100 7.254 -4.101 5.000 1.00 0.00 C ATOM 206 CD1 TYR A 100 7.517 -4.462 6.316 1.00 0.00 C ATOM 207 CD2 TYR A 100 7.133 -2.751 4.702 1.00 0.00 C ATOM 208 CE1 TYR A 100 7.655 -3.504 7.302 1.00 0.00 C ATOM 209 CE2 TYR A 100 7.265 -1.787 5.683 1.00 0.00 C ATOM 210 CZ TYR A 100 7.529 -2.168 6.982 1.00 0.00 C ATOM 211 OH TYR A 100 7.677 -1.214 7.963 1.00 0.00 O ATOM 0 H TYR A 100 9.002 -3.983 2.555 1.00 0.00 H new ATOM 0 HA TYR A 100 8.852 -6.330 4.348 1.00 0.00 H new ATOM 0 HB2 TYR A 100 6.647 -4.701 3.043 1.00 0.00 H new ATOM 0 HB3 TYR A 100 6.453 -5.940 4.267 1.00 0.00 H new ATOM 0 HD1 TYR A 100 7.615 -5.507 6.572 1.00 0.00 H new ATOM 0 HD2 TYR A 100 6.932 -2.448 3.685 1.00 0.00 H new ATOM 0 HE1 TYR A 100 7.861 -3.800 8.320 1.00 0.00 H new ATOM 0 HE2 TYR A 100 7.162 -0.741 5.434 1.00 0.00 H new ATOM 0 HH TYR A 100 7.164 -0.414 7.722 1.00 0.00 H new ATOM 221 N ASP A 101 9.198 -6.644 1.392 1.00 0.00 N ATOM 222 CA ASP A 101 9.133 -7.360 0.121 1.00 0.00 C ATOM 223 C ASP A 101 9.146 -8.876 0.294 1.00 0.00 C ATOM 224 O ASP A 101 10.177 -9.477 0.599 1.00 0.00 O ATOM 225 CB ASP A 101 10.306 -6.908 -0.757 1.00 0.00 C ATOM 226 CG ASP A 101 10.394 -7.626 -2.090 1.00 0.00 C ATOM 227 OD1 ASP A 101 10.767 -8.816 -2.108 1.00 0.00 O ATOM 228 OD2 ASP A 101 10.126 -6.993 -3.128 1.00 0.00 O ATOM 0 H ASP A 101 10.031 -6.064 1.488 1.00 0.00 H new ATOM 0 HA ASP A 101 8.183 -7.118 -0.356 1.00 0.00 H new ATOM 0 HB2 ASP A 101 10.218 -5.837 -0.939 1.00 0.00 H new ATOM 0 HB3 ASP A 101 11.236 -7.064 -0.210 1.00 0.00 H new ATOM 233 N LYS A 102 7.976 -9.473 0.144 1.00 0.00 N ATOM 234 CA LYS A 102 7.839 -10.924 0.047 1.00 0.00 C ATOM 235 C LYS A 102 8.153 -11.417 -1.362 1.00 0.00 C ATOM 236 O LYS A 102 8.129 -12.621 -1.609 1.00 0.00 O ATOM 237 CB LYS A 102 6.430 -11.380 0.438 1.00 0.00 C ATOM 238 CG LYS A 102 6.269 -11.753 1.906 1.00 0.00 C ATOM 239 CD LYS A 102 6.406 -10.549 2.819 1.00 0.00 C ATOM 240 CE LYS A 102 6.187 -10.928 4.276 1.00 0.00 C ATOM 241 NZ LYS A 102 6.280 -9.746 5.168 1.00 0.00 N ATOM 0 H LYS A 102 7.091 -8.969 0.086 1.00 0.00 H new ATOM 0 HA LYS A 102 8.557 -11.355 0.744 1.00 0.00 H new ATOM 0 HB2 LYS A 102 5.725 -10.583 0.200 1.00 0.00 H new ATOM 0 HB3 LYS A 102 6.158 -12.240 -0.174 1.00 0.00 H new ATOM 0 HG2 LYS A 102 5.293 -12.213 2.058 1.00 0.00 H new ATOM 0 HG3 LYS A 102 7.018 -12.498 2.175 1.00 0.00 H new ATOM 0 HD2 LYS A 102 7.397 -10.112 2.700 1.00 0.00 H new ATOM 0 HD3 LYS A 102 5.684 -9.786 2.528 1.00 0.00 H new ATOM 0 HE2 LYS A 102 5.208 -11.393 4.388 1.00 0.00 H new ATOM 0 HE3 LYS A 102 6.928 -11.669 4.575 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 6.126 -10.042 6.153 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 7.223 -9.317 5.079 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 5.556 -9.050 4.898 1.00 0.00 H new ATOM 255 N GLU A 103 8.415 -10.480 -2.278 1.00 0.00 N ATOM 256 CA GLU A 103 8.421 -10.745 -3.719 1.00 0.00 C ATOM 257 C GLU A 103 9.402 -11.821 -4.179 1.00 0.00 C ATOM 258 O GLU A 103 10.484 -11.544 -4.700 1.00 0.00 O ATOM 259 CB GLU A 103 8.649 -9.464 -4.513 1.00 0.00 C ATOM 260 CG GLU A 103 7.367 -8.900 -5.093 1.00 0.00 C ATOM 261 CD GLU A 103 6.642 -9.915 -5.949 1.00 0.00 C ATOM 262 OE1 GLU A 103 5.857 -10.712 -5.397 1.00 0.00 O ATOM 263 OE2 GLU A 103 6.873 -9.938 -7.178 1.00 0.00 O ATOM 0 H GLU A 103 8.630 -9.512 -2.039 1.00 0.00 H new ATOM 0 HA GLU A 103 7.427 -11.144 -3.922 1.00 0.00 H new ATOM 0 HB2 GLU A 103 9.110 -8.717 -3.866 1.00 0.00 H new ATOM 0 HB3 GLU A 103 9.352 -9.663 -5.322 1.00 0.00 H new ATOM 0 HG2 GLU A 103 6.714 -8.575 -4.283 1.00 0.00 H new ATOM 0 HG3 GLU A 103 7.596 -8.018 -5.691 1.00 0.00 H new ATOM 270 N GLY A 104 8.993 -13.047 -3.958 1.00 0.00 N ATOM 271 CA GLY A 104 9.472 -14.176 -4.709 1.00 0.00 C ATOM 272 C GLY A 104 8.268 -14.818 -5.348 1.00 0.00 C ATOM 273 O GLY A 104 8.008 -16.008 -5.166 1.00 0.00 O ATOM 0 H GLY A 104 8.309 -13.289 -3.241 1.00 0.00 H new ATOM 0 HA2 GLY A 104 10.189 -13.860 -5.467 1.00 0.00 H new ATOM 0 HA3 GLY A 104 9.987 -14.883 -4.058 1.00 0.00 H new ATOM 277 N ASN A 105 7.531 -13.984 -6.093 1.00 0.00 N ATOM 278 CA ASN A 105 6.132 -14.239 -6.436 1.00 0.00 C ATOM 279 C ASN A 105 5.328 -14.219 -5.144 1.00 0.00 C ATOM 280 O ASN A 105 4.521 -15.107 -4.873 1.00 0.00 O ATOM 281 CB ASN A 105 5.937 -15.576 -7.156 1.00 0.00 C ATOM 282 CG ASN A 105 6.644 -15.643 -8.496 1.00 0.00 C ATOM 283 OD1 ASN A 105 6.101 -15.229 -9.520 1.00 0.00 O ATOM 284 ND2 ASN A 105 7.853 -16.178 -8.504 1.00 0.00 N ATOM 0 H ASN A 105 7.893 -13.110 -6.475 1.00 0.00 H new ATOM 0 HA ASN A 105 5.793 -13.467 -7.127 1.00 0.00 H new ATOM 0 HB2 ASN A 105 6.303 -16.381 -6.519 1.00 0.00 H new ATOM 0 HB3 ASN A 105 4.871 -15.748 -7.306 1.00 0.00 H new ATOM 0 HD21 ASN A 105 8.369 -16.259 -9.380 1.00 0.00 H new ATOM 0 HD22 ASN A 105 8.270 -16.510 -7.634 1.00 0.00 H new ATOM 291 N GLY A 106 5.559 -13.178 -4.361 1.00 0.00 N ATOM 292 CA GLY A 106 5.092 -13.150 -2.994 1.00 0.00 C ATOM 293 C GLY A 106 3.945 -12.199 -2.770 1.00 0.00 C ATOM 294 O GLY A 106 3.013 -12.523 -2.032 1.00 0.00 O ATOM 0 H GLY A 106 6.068 -12.343 -4.653 1.00 0.00 H new ATOM 0 HA2 GLY A 106 4.783 -14.154 -2.703 1.00 0.00 H new ATOM 0 HA3 GLY A 106 5.919 -12.869 -2.342 1.00 0.00 H new ATOM 298 N TYR A 107 3.999 -11.040 -3.427 1.00 0.00 N ATOM 299 CA TYR A 107 3.049 -9.951 -3.160 1.00 0.00 C ATOM 300 C TYR A 107 3.170 -9.507 -1.697 1.00 0.00 C ATOM 301 O TYR A 107 4.097 -9.913 -0.994 1.00 0.00 O ATOM 302 CB TYR A 107 1.620 -10.417 -3.468 1.00 0.00 C ATOM 303 CG TYR A 107 1.472 -10.984 -4.857 1.00 0.00 C ATOM 304 CD1 TYR A 107 1.731 -10.205 -5.979 1.00 0.00 C ATOM 305 CD2 TYR A 107 1.101 -12.308 -5.046 1.00 0.00 C ATOM 306 CE1 TYR A 107 1.622 -10.732 -7.247 1.00 0.00 C ATOM 307 CE2 TYR A 107 0.987 -12.841 -6.313 1.00 0.00 C ATOM 308 CZ TYR A 107 1.252 -12.049 -7.410 1.00 0.00 C ATOM 309 OH TYR A 107 1.147 -12.576 -8.674 1.00 0.00 O ATOM 0 H TYR A 107 4.689 -10.828 -4.148 1.00 0.00 H new ATOM 0 HA TYR A 107 3.281 -9.102 -3.803 1.00 0.00 H new ATOM 0 HB2 TYR A 107 1.325 -11.173 -2.740 1.00 0.00 H new ATOM 0 HB3 TYR A 107 0.936 -9.576 -3.350 1.00 0.00 H new ATOM 0 HD1 TYR A 107 2.022 -9.172 -5.855 1.00 0.00 H new ATOM 0 HD2 TYR A 107 0.898 -12.931 -4.187 1.00 0.00 H new ATOM 0 HE1 TYR A 107 1.826 -10.115 -8.110 1.00 0.00 H new ATOM 0 HE2 TYR A 107 0.692 -13.872 -6.445 1.00 0.00 H new ATOM 0 HH TYR A 107 0.878 -13.516 -8.615 1.00 0.00 H new ATOM 319 N ILE A 108 2.263 -8.659 -1.240 1.00 0.00 N ATOM 320 CA ILE A 108 2.228 -8.291 0.172 1.00 0.00 C ATOM 321 C ILE A 108 0.812 -8.369 0.700 1.00 0.00 C ATOM 322 O ILE A 108 -0.142 -8.052 -0.004 1.00 0.00 O ATOM 323 CB ILE A 108 2.803 -6.879 0.448 1.00 0.00 C ATOM 324 CG1 ILE A 108 2.082 -5.825 -0.397 1.00 0.00 C ATOM 325 CG2 ILE A 108 4.310 -6.849 0.195 1.00 0.00 C ATOM 326 CD1 ILE A 108 2.459 -4.402 -0.040 1.00 0.00 C ATOM 0 H ILE A 108 1.548 -8.215 -1.816 1.00 0.00 H new ATOM 0 HA ILE A 108 2.865 -9.007 0.691 1.00 0.00 H new ATOM 0 HB ILE A 108 2.634 -6.640 1.498 1.00 0.00 H new ATOM 0 HG12 ILE A 108 2.307 -5.999 -1.449 1.00 0.00 H new ATOM 0 HG13 ILE A 108 1.006 -5.948 -0.276 1.00 0.00 H new ATOM 0 HG21 ILE A 108 4.693 -5.848 0.395 1.00 0.00 H new ATOM 0 HG22 ILE A 108 4.804 -7.564 0.853 1.00 0.00 H new ATOM 0 HG23 ILE A 108 4.510 -7.113 -0.843 1.00 0.00 H new ATOM 0 HD11 ILE A 108 1.910 -3.709 -0.678 1.00 0.00 H new ATOM 0 HD12 ILE A 108 2.209 -4.210 1.003 1.00 0.00 H new ATOM 0 HD13 ILE A 108 3.530 -4.261 -0.188 1.00 0.00 H new ATOM 338 N SER A 109 0.683 -8.816 1.936 1.00 0.00 N ATOM 339 CA SER A 109 -0.616 -8.997 2.553 1.00 0.00 C ATOM 340 C SER A 109 -1.279 -7.652 2.840 1.00 0.00 C ATOM 341 O SER A 109 -0.620 -6.682 3.215 1.00 0.00 O ATOM 342 CB SER A 109 -0.460 -9.801 3.841 1.00 0.00 C ATOM 343 OG SER A 109 0.271 -10.993 3.602 1.00 0.00 O ATOM 0 H SER A 109 1.470 -9.062 2.536 1.00 0.00 H new ATOM 0 HA SER A 109 -1.259 -9.543 1.862 1.00 0.00 H new ATOM 0 HB2 SER A 109 0.052 -9.199 4.592 1.00 0.00 H new ATOM 0 HB3 SER A 109 -1.443 -10.046 4.244 1.00 0.00 H new ATOM 0 HG SER A 109 0.362 -11.494 4.439 1.00 0.00 H new ATOM 349 N THR A 110 -2.592 -7.616 2.644 1.00 0.00 N ATOM 350 CA THR A 110 -3.398 -6.430 2.907 1.00 0.00 C ATOM 351 C THR A 110 -3.279 -6.002 4.364 1.00 0.00 C ATOM 352 O THR A 110 -3.351 -4.817 4.683 1.00 0.00 O ATOM 353 CB THR A 110 -4.877 -6.695 2.576 1.00 0.00 C ATOM 354 OG1 THR A 110 -5.284 -7.945 3.142 1.00 0.00 O ATOM 355 CG2 THR A 110 -5.104 -6.719 1.076 1.00 0.00 C ATOM 0 H THR A 110 -3.129 -8.411 2.297 1.00 0.00 H new ATOM 0 HA THR A 110 -3.023 -5.629 2.270 1.00 0.00 H new ATOM 0 HB THR A 110 -5.471 -5.887 3.002 1.00 0.00 H new ATOM 0 HG1 THR A 110 -6.017 -8.321 2.612 1.00 0.00 H new ATOM 0 HG21 THR A 110 -6.158 -6.908 0.870 1.00 0.00 H new ATOM 0 HG22 THR A 110 -4.818 -5.758 0.649 1.00 0.00 H new ATOM 0 HG23 THR A 110 -4.500 -7.509 0.629 1.00 0.00 H new ATOM 363 N ASP A 111 -3.095 -6.982 5.238 1.00 0.00 N ATOM 364 CA ASP A 111 -2.839 -6.720 6.647 1.00 0.00 C ATOM 365 C ASP A 111 -1.577 -5.881 6.807 1.00 0.00 C ATOM 366 O ASP A 111 -1.567 -4.888 7.536 1.00 0.00 O ATOM 367 CB ASP A 111 -2.693 -8.035 7.411 1.00 0.00 C ATOM 368 CG ASP A 111 -2.280 -7.821 8.851 1.00 0.00 C ATOM 369 OD1 ASP A 111 -3.105 -7.318 9.640 1.00 0.00 O ATOM 370 OD2 ASP A 111 -1.136 -8.166 9.200 1.00 0.00 O ATOM 0 H ASP A 111 -3.119 -7.972 4.993 1.00 0.00 H new ATOM 0 HA ASP A 111 -3.684 -6.166 7.057 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -3.639 -8.575 7.383 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -1.953 -8.662 6.913 1.00 0.00 H new ATOM 375 N VAL A 112 -0.531 -6.274 6.088 1.00 0.00 N ATOM 376 CA VAL A 112 0.726 -5.538 6.078 1.00 0.00 C ATOM 377 C VAL A 112 0.517 -4.143 5.507 1.00 0.00 C ATOM 378 O VAL A 112 1.020 -3.160 6.045 1.00 0.00 O ATOM 379 CB VAL A 112 1.794 -6.263 5.238 1.00 0.00 C ATOM 380 CG1 VAL A 112 3.104 -5.495 5.253 1.00 0.00 C ATOM 381 CG2 VAL A 112 2.000 -7.687 5.732 1.00 0.00 C ATOM 0 H VAL A 112 -0.531 -7.107 5.499 1.00 0.00 H new ATOM 0 HA VAL A 112 1.072 -5.471 7.109 1.00 0.00 H new ATOM 0 HB VAL A 112 1.438 -6.310 4.209 1.00 0.00 H new ATOM 0 HG11 VAL A 112 3.844 -6.026 4.653 1.00 0.00 H new ATOM 0 HG12 VAL A 112 2.947 -4.499 4.838 1.00 0.00 H new ATOM 0 HG13 VAL A 112 3.463 -5.408 6.278 1.00 0.00 H new ATOM 0 HG21 VAL A 112 2.759 -8.177 5.122 1.00 0.00 H new ATOM 0 HG22 VAL A 112 2.326 -7.668 6.772 1.00 0.00 H new ATOM 0 HG23 VAL A 112 1.062 -8.238 5.656 1.00 0.00 H new ATOM 391 N MET A 113 -0.242 -4.070 4.415 1.00 0.00 N ATOM 392 CA MET A 113 -0.545 -2.802 3.758 1.00 0.00 C ATOM 393 C MET A 113 -1.150 -1.808 4.746 1.00 0.00 C ATOM 394 O MET A 113 -0.865 -0.613 4.691 1.00 0.00 O ATOM 395 CB MET A 113 -1.500 -3.022 2.577 1.00 0.00 C ATOM 396 CG MET A 113 -1.864 -1.751 1.838 1.00 0.00 C ATOM 397 SD MET A 113 -0.422 -0.946 1.121 1.00 0.00 S ATOM 398 CE MET A 113 -1.217 0.383 0.237 1.00 0.00 C ATOM 0 H MET A 113 -0.661 -4.883 3.964 1.00 0.00 H new ATOM 0 HA MET A 113 0.389 -2.386 3.380 1.00 0.00 H new ATOM 0 HB2 MET A 113 -1.041 -3.719 1.876 1.00 0.00 H new ATOM 0 HB3 MET A 113 -2.413 -3.492 2.943 1.00 0.00 H new ATOM 0 HG2 MET A 113 -2.579 -1.984 1.048 1.00 0.00 H new ATOM 0 HG3 MET A 113 -2.359 -1.063 2.523 1.00 0.00 H new ATOM 0 HE1 MET A 113 -0.463 0.986 -0.269 1.00 0.00 H new ATOM 0 HE2 MET A 113 -1.905 -0.031 -0.500 1.00 0.00 H new ATOM 0 HE3 MET A 113 -1.769 1.008 0.939 1.00 0.00 H new ATOM 408 N ARG A 114 -1.967 -2.316 5.662 1.00 0.00 N ATOM 409 CA ARG A 114 -2.558 -1.478 6.696 1.00 0.00 C ATOM 410 C ARG A 114 -1.471 -0.860 7.564 1.00 0.00 C ATOM 411 O ARG A 114 -1.476 0.338 7.812 1.00 0.00 O ATOM 412 CB ARG A 114 -3.534 -2.273 7.567 1.00 0.00 C ATOM 413 CG ARG A 114 -4.736 -2.805 6.806 1.00 0.00 C ATOM 414 CD ARG A 114 -5.774 -3.409 7.739 1.00 0.00 C ATOM 415 NE ARG A 114 -5.250 -4.537 8.511 1.00 0.00 N ATOM 416 CZ ARG A 114 -5.977 -5.225 9.388 1.00 0.00 C ATOM 417 NH1 ARG A 114 -7.241 -4.898 9.605 1.00 0.00 N ATOM 418 NH2 ARG A 114 -5.446 -6.242 10.046 1.00 0.00 N ATOM 0 H ARG A 114 -2.234 -3.299 5.709 1.00 0.00 H new ATOM 0 HA ARG A 114 -3.115 -0.683 6.200 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -3.003 -3.110 8.021 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -3.882 -1.637 8.381 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -5.190 -1.997 6.232 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -4.408 -3.559 6.090 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -6.132 -2.640 8.424 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -6.632 -3.741 7.155 1.00 0.00 H new ATOM 0 HE ARG A 114 -4.277 -4.810 8.369 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -7.660 -4.117 9.100 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -7.796 -5.427 10.278 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -4.474 -6.503 9.883 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -6.009 -6.765 10.717 1.00 0.00 H new ATOM 432 N GLU A 115 -0.524 -1.680 7.998 1.00 0.00 N ATOM 433 CA GLU A 115 0.574 -1.200 8.826 1.00 0.00 C ATOM 434 C GLU A 115 1.466 -0.243 8.039 1.00 0.00 C ATOM 435 O GLU A 115 1.844 0.815 8.538 1.00 0.00 O ATOM 436 CB GLU A 115 1.390 -2.375 9.370 1.00 0.00 C ATOM 437 CG GLU A 115 2.539 -1.950 10.269 1.00 0.00 C ATOM 438 CD GLU A 115 3.207 -3.118 10.960 1.00 0.00 C ATOM 439 OE1 GLU A 115 4.105 -3.742 10.359 1.00 0.00 O ATOM 440 OE2 GLU A 115 2.852 -3.408 12.121 1.00 0.00 O ATOM 0 H GLU A 115 -0.494 -2.678 7.791 1.00 0.00 H new ATOM 0 HA GLU A 115 0.153 -0.655 9.670 1.00 0.00 H new ATOM 0 HB2 GLU A 115 0.729 -3.039 9.928 1.00 0.00 H new ATOM 0 HB3 GLU A 115 1.787 -2.950 8.533 1.00 0.00 H new ATOM 0 HG2 GLU A 115 3.279 -1.414 9.675 1.00 0.00 H new ATOM 0 HG3 GLU A 115 2.168 -1.253 11.021 1.00 0.00 H new ATOM 447 N ILE A 116 1.770 -0.611 6.796 1.00 0.00 N ATOM 448 CA ILE A 116 2.599 0.216 5.918 1.00 0.00 C ATOM 449 C ILE A 116 1.997 1.609 5.734 1.00 0.00 C ATOM 450 O ILE A 116 2.712 2.614 5.726 1.00 0.00 O ATOM 451 CB ILE A 116 2.781 -0.439 4.527 1.00 0.00 C ATOM 452 CG1 ILE A 116 3.480 -1.794 4.652 1.00 0.00 C ATOM 453 CG2 ILE A 116 3.569 0.475 3.595 1.00 0.00 C ATOM 454 CD1 ILE A 116 3.623 -2.525 3.332 1.00 0.00 C ATOM 0 H ILE A 116 1.453 -1.482 6.371 1.00 0.00 H new ATOM 0 HA ILE A 116 3.572 0.305 6.402 1.00 0.00 H new ATOM 0 HB ILE A 116 1.791 -0.597 4.100 1.00 0.00 H new ATOM 0 HG12 ILE A 116 4.469 -1.645 5.085 1.00 0.00 H new ATOM 0 HG13 ILE A 116 2.920 -2.420 5.346 1.00 0.00 H new ATOM 0 HG21 ILE A 116 3.684 -0.007 2.624 1.00 0.00 H new ATOM 0 HG22 ILE A 116 3.035 1.417 3.472 1.00 0.00 H new ATOM 0 HG23 ILE A 116 4.553 0.669 4.022 1.00 0.00 H new ATOM 0 HD11 ILE A 116 4.127 -3.477 3.496 1.00 0.00 H new ATOM 0 HD12 ILE A 116 2.636 -2.706 2.907 1.00 0.00 H new ATOM 0 HD13 ILE A 116 4.209 -1.918 2.642 1.00 0.00 H new ATOM 466 N LEU A 117 0.685 1.677 5.595 1.00 0.00 N ATOM 467 CA LEU A 117 0.025 2.954 5.389 1.00 0.00 C ATOM 468 C LEU A 117 -0.161 3.686 6.719 1.00 0.00 C ATOM 469 O LEU A 117 -0.155 4.916 6.763 1.00 0.00 O ATOM 470 CB LEU A 117 -1.311 2.756 4.654 1.00 0.00 C ATOM 471 CG LEU A 117 -2.533 2.469 5.517 1.00 0.00 C ATOM 472 CD1 LEU A 117 -3.183 3.778 5.921 1.00 0.00 C ATOM 473 CD2 LEU A 117 -3.520 1.586 4.767 1.00 0.00 C ATOM 0 H LEU A 117 0.060 0.871 5.621 1.00 0.00 H new ATOM 0 HA LEU A 117 0.658 3.579 4.759 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -1.512 3.652 4.067 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -1.192 1.933 3.949 1.00 0.00 H new ATOM 0 HG LEU A 117 -2.222 1.935 6.415 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -4.058 3.574 6.539 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -2.471 4.378 6.487 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -3.488 4.323 5.028 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -4.387 1.391 5.399 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -3.841 2.091 3.856 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -3.040 0.642 4.508 1.00 0.00 H new ATOM 485 N ALA A 118 -0.300 2.925 7.802 1.00 0.00 N ATOM 486 CA ALA A 118 -0.514 3.506 9.123 1.00 0.00 C ATOM 487 C ALA A 118 0.789 4.026 9.715 1.00 0.00 C ATOM 488 O ALA A 118 0.784 4.872 10.611 1.00 0.00 O ATOM 489 CB ALA A 118 -1.160 2.493 10.055 1.00 0.00 C ATOM 0 H ALA A 118 -0.268 1.906 7.790 1.00 0.00 H new ATOM 0 HA ALA A 118 -1.191 4.353 9.010 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -1.311 2.945 11.035 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -2.122 2.184 9.646 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -0.511 1.623 10.153 1.00 0.00 H new ATOM 495 N GLU A 119 1.910 3.510 9.235 1.00 0.00 N ATOM 496 CA GLU A 119 3.198 4.061 9.615 1.00 0.00 C ATOM 497 C GLU A 119 3.496 5.282 8.753 1.00 0.00 C ATOM 498 O GLU A 119 4.213 6.192 9.165 1.00 0.00 O ATOM 499 CB GLU A 119 4.316 3.019 9.486 1.00 0.00 C ATOM 500 CG GLU A 119 4.627 2.613 8.057 1.00 0.00 C ATOM 501 CD GLU A 119 5.853 1.736 7.956 1.00 0.00 C ATOM 502 OE1 GLU A 119 5.724 0.506 8.113 1.00 0.00 O ATOM 503 OE2 GLU A 119 6.953 2.279 7.720 1.00 0.00 O ATOM 0 H GLU A 119 1.953 2.721 8.590 1.00 0.00 H new ATOM 0 HA GLU A 119 3.155 4.357 10.663 1.00 0.00 H new ATOM 0 HB2 GLU A 119 5.222 3.416 9.944 1.00 0.00 H new ATOM 0 HB3 GLU A 119 4.036 2.130 10.051 1.00 0.00 H new ATOM 0 HG2 GLU A 119 3.771 2.084 7.639 1.00 0.00 H new ATOM 0 HG3 GLU A 119 4.774 3.508 7.453 1.00 0.00 H new ATOM 510 N LEU A 120 2.909 5.300 7.562 1.00 0.00 N ATOM 511 CA LEU A 120 3.063 6.417 6.643 1.00 0.00 C ATOM 512 C LEU A 120 2.263 7.615 7.152 1.00 0.00 C ATOM 513 O LEU A 120 2.820 8.695 7.363 1.00 0.00 O ATOM 514 CB LEU A 120 2.610 5.993 5.233 1.00 0.00 C ATOM 515 CG LEU A 120 3.008 6.921 4.073 1.00 0.00 C ATOM 516 CD1 LEU A 120 2.144 8.176 4.041 1.00 0.00 C ATOM 517 CD2 LEU A 120 4.482 7.294 4.169 1.00 0.00 C ATOM 0 H LEU A 120 2.318 4.547 7.210 1.00 0.00 H new ATOM 0 HA LEU A 120 4.111 6.711 6.587 1.00 0.00 H new ATOM 0 HB2 LEU A 120 3.014 5.001 5.030 1.00 0.00 H new ATOM 0 HB3 LEU A 120 1.524 5.900 5.238 1.00 0.00 H new ATOM 0 HG LEU A 120 2.842 6.378 3.143 1.00 0.00 H new ATOM 0 HD11 LEU A 120 2.453 8.809 3.209 1.00 0.00 H new ATOM 0 HD12 LEU A 120 1.098 7.895 3.915 1.00 0.00 H new ATOM 0 HD13 LEU A 120 2.262 8.723 4.976 1.00 0.00 H new ATOM 0 HD21 LEU A 120 4.746 7.951 3.340 1.00 0.00 H new ATOM 0 HD22 LEU A 120 4.667 7.808 5.112 1.00 0.00 H new ATOM 0 HD23 LEU A 120 5.090 6.390 4.123 1.00 0.00 H new ATOM 529 N ASP A 121 0.970 7.419 7.368 1.00 0.00 N ATOM 530 CA ASP A 121 0.122 8.485 7.884 1.00 0.00 C ATOM 531 C ASP A 121 -0.246 8.217 9.335 1.00 0.00 C ATOM 532 O ASP A 121 -0.489 7.080 9.725 1.00 0.00 O ATOM 533 CB ASP A 121 -1.147 8.645 7.050 1.00 0.00 C ATOM 534 CG ASP A 121 -1.977 9.813 7.532 1.00 0.00 C ATOM 535 OD1 ASP A 121 -1.669 10.961 7.154 1.00 0.00 O ATOM 536 OD2 ASP A 121 -2.913 9.598 8.329 1.00 0.00 O ATOM 0 H ASP A 121 0.487 6.537 7.195 1.00 0.00 H new ATOM 0 HA ASP A 121 0.689 9.414 7.822 1.00 0.00 H new ATOM 0 HB2 ASP A 121 -0.881 8.793 6.003 1.00 0.00 H new ATOM 0 HB3 ASP A 121 -1.737 7.730 7.103 1.00 0.00 H new ATOM 541 N GLU A 122 -0.298 9.272 10.127 1.00 0.00 N ATOM 542 CA GLU A 122 -0.486 9.144 11.563 1.00 0.00 C ATOM 543 C GLU A 122 -1.938 9.398 11.970 1.00 0.00 C ATOM 544 O GLU A 122 -2.321 9.168 13.120 1.00 0.00 O ATOM 545 CB GLU A 122 0.425 10.141 12.266 1.00 0.00 C ATOM 546 CG GLU A 122 0.527 9.946 13.765 1.00 0.00 C ATOM 547 CD GLU A 122 0.884 11.227 14.475 1.00 0.00 C ATOM 548 OE1 GLU A 122 1.649 12.033 13.908 1.00 0.00 O ATOM 549 OE2 GLU A 122 0.366 11.452 15.587 1.00 0.00 O ATOM 0 H GLU A 122 -0.212 10.234 9.799 1.00 0.00 H new ATOM 0 HA GLU A 122 -0.237 8.124 11.855 1.00 0.00 H new ATOM 0 HB2 GLU A 122 1.423 10.070 11.834 1.00 0.00 H new ATOM 0 HB3 GLU A 122 0.062 11.149 12.067 1.00 0.00 H new ATOM 0 HG2 GLU A 122 -0.422 9.571 14.148 1.00 0.00 H new ATOM 0 HG3 GLU A 122 1.280 9.188 13.982 1.00 0.00 H new ATOM 556 N THR A 123 -2.749 9.866 11.034 1.00 0.00 N ATOM 557 CA THR A 123 -4.111 10.262 11.355 1.00 0.00 C ATOM 558 C THR A 123 -5.142 9.236 10.890 1.00 0.00 C ATOM 559 O THR A 123 -6.288 9.256 11.337 1.00 0.00 O ATOM 560 CB THR A 123 -4.443 11.645 10.761 1.00 0.00 C ATOM 561 OG1 THR A 123 -3.918 11.761 9.428 1.00 0.00 O ATOM 562 CG2 THR A 123 -3.874 12.752 11.633 1.00 0.00 C ATOM 0 H THR A 123 -2.491 9.980 10.054 1.00 0.00 H new ATOM 0 HA THR A 123 -4.166 10.318 12.442 1.00 0.00 H new ATOM 0 HB THR A 123 -5.528 11.745 10.725 1.00 0.00 H new ATOM 0 HG1 THR A 123 -3.946 10.886 8.988 1.00 0.00 H new ATOM 0 HG21 THR A 123 -4.119 13.721 11.197 1.00 0.00 H new ATOM 0 HG22 THR A 123 -4.303 12.685 12.633 1.00 0.00 H new ATOM 0 HG23 THR A 123 -2.791 12.646 11.696 1.00 0.00 H new ATOM 570 N LEU A 124 -4.741 8.347 9.996 1.00 0.00 N ATOM 571 CA LEU A 124 -5.624 7.284 9.534 1.00 0.00 C ATOM 572 C LEU A 124 -5.675 6.156 10.559 1.00 0.00 C ATOM 573 O LEU A 124 -4.658 5.528 10.857 1.00 0.00 O ATOM 574 CB LEU A 124 -5.157 6.753 8.175 1.00 0.00 C ATOM 575 CG LEU A 124 -5.177 7.777 7.037 1.00 0.00 C ATOM 576 CD1 LEU A 124 -4.653 7.160 5.750 1.00 0.00 C ATOM 577 CD2 LEU A 124 -6.585 8.318 6.831 1.00 0.00 C ATOM 0 H LEU A 124 -3.812 8.339 9.575 1.00 0.00 H new ATOM 0 HA LEU A 124 -6.628 7.692 9.417 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -4.142 6.370 8.281 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -5.788 5.909 7.895 1.00 0.00 H new ATOM 0 HG LEU A 124 -4.524 8.605 7.312 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -4.676 7.904 4.954 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -3.628 6.820 5.900 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -5.279 6.312 5.472 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -6.580 9.044 6.018 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -7.257 7.497 6.580 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -6.927 8.800 7.747 1.00 0.00 H new ATOM 589 N SER A 125 -6.859 5.910 11.109 1.00 0.00 N ATOM 590 CA SER A 125 -7.022 4.892 12.135 1.00 0.00 C ATOM 591 C SER A 125 -7.138 3.512 11.499 1.00 0.00 C ATOM 592 O SER A 125 -7.549 3.382 10.346 1.00 0.00 O ATOM 593 CB SER A 125 -8.257 5.189 12.990 1.00 0.00 C ATOM 594 OG SER A 125 -8.149 4.588 14.270 1.00 0.00 O ATOM 0 H SER A 125 -7.717 6.402 10.861 1.00 0.00 H new ATOM 0 HA SER A 125 -6.143 4.905 12.779 1.00 0.00 H new ATOM 0 HB2 SER A 125 -8.376 6.267 13.100 1.00 0.00 H new ATOM 0 HB3 SER A 125 -9.150 4.819 12.486 1.00 0.00 H new ATOM 0 HG SER A 125 -9.045 4.392 14.616 1.00 0.00 H new ATOM 600 N SER A 126 -6.788 2.486 12.264 1.00 0.00 N ATOM 601 CA SER A 126 -6.782 1.116 11.770 1.00 0.00 C ATOM 602 C SER A 126 -8.181 0.708 11.297 1.00 0.00 C ATOM 603 O SER A 126 -8.329 -0.076 10.355 1.00 0.00 O ATOM 604 CB SER A 126 -6.291 0.174 12.874 1.00 0.00 C ATOM 605 OG SER A 126 -5.706 -1.000 12.334 1.00 0.00 O ATOM 0 H SER A 126 -6.502 2.579 13.239 1.00 0.00 H new ATOM 0 HA SER A 126 -6.105 1.048 10.918 1.00 0.00 H new ATOM 0 HB2 SER A 126 -5.562 0.691 13.497 1.00 0.00 H new ATOM 0 HB3 SER A 126 -7.126 -0.098 13.519 1.00 0.00 H new ATOM 0 HG SER A 126 -5.401 -1.579 13.064 1.00 0.00 H new ATOM 611 N GLU A 127 -9.201 1.254 11.955 1.00 0.00 N ATOM 612 CA GLU A 127 -10.593 1.019 11.579 1.00 0.00 C ATOM 613 C GLU A 127 -10.839 1.464 10.140 1.00 0.00 C ATOM 614 O GLU A 127 -11.372 0.710 9.325 1.00 0.00 O ATOM 615 CB GLU A 127 -11.550 1.772 12.516 1.00 0.00 C ATOM 616 CG GLU A 127 -11.383 1.443 13.997 1.00 0.00 C ATOM 617 CD GLU A 127 -10.168 2.106 14.618 1.00 0.00 C ATOM 618 OE1 GLU A 127 -10.291 3.250 15.104 1.00 0.00 O ATOM 619 OE2 GLU A 127 -9.082 1.495 14.614 1.00 0.00 O ATOM 0 H GLU A 127 -9.087 1.869 12.761 1.00 0.00 H new ATOM 0 HA GLU A 127 -10.785 -0.051 11.665 1.00 0.00 H new ATOM 0 HB2 GLU A 127 -11.405 2.843 12.377 1.00 0.00 H new ATOM 0 HB3 GLU A 127 -12.575 1.549 12.222 1.00 0.00 H new ATOM 0 HG2 GLU A 127 -12.277 1.757 14.536 1.00 0.00 H new ATOM 0 HG3 GLU A 127 -11.301 0.363 14.117 1.00 0.00 H new ATOM 626 N ASP A 128 -10.420 2.690 9.836 1.00 0.00 N ATOM 627 CA ASP A 128 -10.564 3.253 8.495 1.00 0.00 C ATOM 628 C ASP A 128 -9.845 2.399 7.463 1.00 0.00 C ATOM 629 O ASP A 128 -10.305 2.254 6.329 1.00 0.00 O ATOM 630 CB ASP A 128 -10.005 4.681 8.439 1.00 0.00 C ATOM 631 CG ASP A 128 -10.889 5.693 9.136 1.00 0.00 C ATOM 632 OD1 ASP A 128 -10.782 5.833 10.374 1.00 0.00 O ATOM 633 OD2 ASP A 128 -11.691 6.357 8.442 1.00 0.00 O ATOM 0 H ASP A 128 -9.975 3.317 10.506 1.00 0.00 H new ATOM 0 HA ASP A 128 -11.629 3.272 8.265 1.00 0.00 H new ATOM 0 HB2 ASP A 128 -9.016 4.696 8.896 1.00 0.00 H new ATOM 0 HB3 ASP A 128 -9.879 4.975 7.397 1.00 0.00 H new ATOM 638 N LEU A 129 -8.725 1.822 7.865 1.00 0.00 N ATOM 639 CA LEU A 129 -7.898 1.058 6.945 1.00 0.00 C ATOM 640 C LEU A 129 -8.596 -0.234 6.533 1.00 0.00 C ATOM 641 O LEU A 129 -8.356 -0.757 5.445 1.00 0.00 O ATOM 642 CB LEU A 129 -6.534 0.747 7.570 1.00 0.00 C ATOM 643 CG LEU A 129 -5.827 1.930 8.247 1.00 0.00 C ATOM 644 CD1 LEU A 129 -4.349 1.634 8.441 1.00 0.00 C ATOM 645 CD2 LEU A 129 -6.007 3.211 7.449 1.00 0.00 C ATOM 0 H LEU A 129 -8.368 1.867 8.819 1.00 0.00 H new ATOM 0 HA LEU A 129 -7.740 1.665 6.053 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -6.665 -0.045 8.308 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -5.880 0.353 6.792 1.00 0.00 H new ATOM 0 HG LEU A 129 -6.286 2.073 9.225 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -3.868 2.485 8.922 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -4.234 0.750 9.068 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -3.884 1.454 7.472 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -5.495 4.030 7.955 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -5.587 3.081 6.452 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -7.069 3.443 7.367 1.00 0.00 H new ATOM 657 N ASP A 130 -9.473 -0.732 7.395 1.00 0.00 N ATOM 658 CA ASP A 130 -10.247 -1.928 7.084 1.00 0.00 C ATOM 659 C ASP A 130 -11.213 -1.638 5.944 1.00 0.00 C ATOM 660 O ASP A 130 -11.341 -2.427 5.008 1.00 0.00 O ATOM 661 CB ASP A 130 -11.022 -2.417 8.308 1.00 0.00 C ATOM 662 CG ASP A 130 -11.866 -3.640 8.005 1.00 0.00 C ATOM 663 OD1 ASP A 130 -11.327 -4.769 8.058 1.00 0.00 O ATOM 664 OD2 ASP A 130 -13.070 -3.484 7.715 1.00 0.00 O ATOM 0 H ASP A 130 -9.666 -0.329 8.312 1.00 0.00 H new ATOM 0 HA ASP A 130 -9.553 -2.713 6.783 1.00 0.00 H new ATOM 0 HB2 ASP A 130 -10.321 -2.652 9.109 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -11.665 -1.616 8.672 1.00 0.00 H new ATOM 669 N ALA A 131 -11.865 -0.483 6.020 1.00 0.00 N ATOM 670 CA ALA A 131 -12.797 -0.054 4.978 1.00 0.00 C ATOM 671 C ALA A 131 -12.066 0.144 3.653 1.00 0.00 C ATOM 672 O ALA A 131 -12.640 -0.035 2.577 1.00 0.00 O ATOM 673 CB ALA A 131 -13.512 1.224 5.392 1.00 0.00 C ATOM 0 H ALA A 131 -11.767 0.175 6.793 1.00 0.00 H new ATOM 0 HA ALA A 131 -13.544 -0.836 4.843 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -14.201 1.527 4.604 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -14.069 1.048 6.312 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -12.779 2.014 5.557 1.00 0.00 H new ATOM 679 N MET A 132 -10.794 0.509 3.743 1.00 0.00 N ATOM 680 CA MET A 132 -9.954 0.639 2.560 1.00 0.00 C ATOM 681 C MET A 132 -9.659 -0.738 1.979 1.00 0.00 C ATOM 682 O MET A 132 -9.897 -0.989 0.800 1.00 0.00 O ATOM 683 CB MET A 132 -8.640 1.345 2.898 1.00 0.00 C ATOM 684 CG MET A 132 -8.817 2.745 3.458 1.00 0.00 C ATOM 685 SD MET A 132 -7.243 3.527 3.863 1.00 0.00 S ATOM 686 CE MET A 132 -7.804 5.074 4.567 1.00 0.00 C ATOM 0 H MET A 132 -10.322 0.720 4.622 1.00 0.00 H new ATOM 0 HA MET A 132 -10.491 1.239 1.825 1.00 0.00 H new ATOM 0 HB2 MET A 132 -8.091 0.742 3.622 1.00 0.00 H new ATOM 0 HB3 MET A 132 -8.027 1.400 1.998 1.00 0.00 H new ATOM 0 HG2 MET A 132 -9.349 3.360 2.732 1.00 0.00 H new ATOM 0 HG3 MET A 132 -9.438 2.700 4.353 1.00 0.00 H new ATOM 0 HE1 MET A 132 -7.188 5.890 4.190 1.00 0.00 H new ATOM 0 HE2 MET A 132 -8.844 5.245 4.288 1.00 0.00 H new ATOM 0 HE3 MET A 132 -7.723 5.030 5.653 1.00 0.00 H new ATOM 696 N ILE A 133 -9.161 -1.634 2.827 1.00 0.00 N ATOM 697 CA ILE A 133 -8.815 -2.992 2.414 1.00 0.00 C ATOM 698 C ILE A 133 -10.031 -3.711 1.837 1.00 0.00 C ATOM 699 O ILE A 133 -9.913 -4.510 0.908 1.00 0.00 O ATOM 700 CB ILE A 133 -8.231 -3.799 3.597 1.00 0.00 C ATOM 701 CG1 ILE A 133 -6.924 -3.164 4.080 1.00 0.00 C ATOM 702 CG2 ILE A 133 -8.005 -5.255 3.209 1.00 0.00 C ATOM 703 CD1 ILE A 133 -5.868 -3.039 3.002 1.00 0.00 C ATOM 0 H ILE A 133 -8.987 -1.442 3.813 1.00 0.00 H new ATOM 0 HA ILE A 133 -8.054 -2.918 1.637 1.00 0.00 H new ATOM 0 HB ILE A 133 -8.954 -3.777 4.412 1.00 0.00 H new ATOM 0 HG12 ILE A 133 -7.139 -2.173 4.481 1.00 0.00 H new ATOM 0 HG13 ILE A 133 -6.523 -3.760 4.900 1.00 0.00 H new ATOM 0 HG21 ILE A 133 -7.594 -5.799 4.060 1.00 0.00 H new ATOM 0 HG22 ILE A 133 -8.953 -5.705 2.915 1.00 0.00 H new ATOM 0 HG23 ILE A 133 -7.306 -5.305 2.374 1.00 0.00 H new ATOM 0 HD11 ILE A 133 -4.972 -2.581 3.421 1.00 0.00 H new ATOM 0 HD12 ILE A 133 -5.623 -4.029 2.617 1.00 0.00 H new ATOM 0 HD13 ILE A 133 -6.248 -2.418 2.191 1.00 0.00 H new ATOM 715 N ASP A 134 -11.200 -3.393 2.374 1.00 0.00 N ATOM 716 CA ASP A 134 -12.468 -3.927 1.874 1.00 0.00 C ATOM 717 C ASP A 134 -12.627 -3.677 0.372 1.00 0.00 C ATOM 718 O ASP A 134 -13.275 -4.449 -0.335 1.00 0.00 O ATOM 719 CB ASP A 134 -13.629 -3.282 2.638 1.00 0.00 C ATOM 720 CG ASP A 134 -14.992 -3.637 2.075 1.00 0.00 C ATOM 721 OD1 ASP A 134 -15.522 -4.714 2.419 1.00 0.00 O ATOM 722 OD2 ASP A 134 -15.551 -2.831 1.305 1.00 0.00 O ATOM 0 H ASP A 134 -11.301 -2.759 3.167 1.00 0.00 H new ATOM 0 HA ASP A 134 -12.473 -5.005 2.034 1.00 0.00 H new ATOM 0 HB2 ASP A 134 -13.584 -3.592 3.682 1.00 0.00 H new ATOM 0 HB3 ASP A 134 -13.508 -2.199 2.621 1.00 0.00 H new ATOM 727 N GLU A 135 -12.001 -2.615 -0.116 1.00 0.00 N ATOM 728 CA GLU A 135 -12.123 -2.221 -1.511 1.00 0.00 C ATOM 729 C GLU A 135 -10.801 -2.443 -2.262 1.00 0.00 C ATOM 730 O GLU A 135 -10.638 -2.006 -3.400 1.00 0.00 O ATOM 731 CB GLU A 135 -12.534 -0.748 -1.574 1.00 0.00 C ATOM 732 CG GLU A 135 -13.039 -0.297 -2.928 1.00 0.00 C ATOM 733 CD GLU A 135 -13.276 1.195 -2.992 1.00 0.00 C ATOM 734 OE1 GLU A 135 -12.322 1.939 -3.314 1.00 0.00 O ATOM 735 OE2 GLU A 135 -14.409 1.639 -2.714 1.00 0.00 O ATOM 0 H GLU A 135 -11.399 -2.007 0.439 1.00 0.00 H new ATOM 0 HA GLU A 135 -12.883 -2.836 -1.993 1.00 0.00 H new ATOM 0 HB2 GLU A 135 -13.311 -0.568 -0.832 1.00 0.00 H new ATOM 0 HB3 GLU A 135 -11.679 -0.132 -1.295 1.00 0.00 H new ATOM 0 HG2 GLU A 135 -12.317 -0.580 -3.694 1.00 0.00 H new ATOM 0 HG3 GLU A 135 -13.968 -0.819 -3.158 1.00 0.00 H new ATOM 742 N ILE A 136 -9.857 -3.134 -1.623 1.00 0.00 N ATOM 743 CA ILE A 136 -8.522 -3.311 -2.203 1.00 0.00 C ATOM 744 C ILE A 136 -8.096 -4.782 -2.238 1.00 0.00 C ATOM 745 O ILE A 136 -7.449 -5.222 -3.192 1.00 0.00 O ATOM 746 CB ILE A 136 -7.461 -2.497 -1.420 1.00 0.00 C ATOM 747 CG1 ILE A 136 -7.789 -1.005 -1.474 1.00 0.00 C ATOM 748 CG2 ILE A 136 -6.064 -2.751 -1.979 1.00 0.00 C ATOM 749 CD1 ILE A 136 -6.850 -0.145 -0.652 1.00 0.00 C ATOM 0 H ILE A 136 -9.987 -3.577 -0.713 1.00 0.00 H new ATOM 0 HA ILE A 136 -8.583 -2.944 -3.228 1.00 0.00 H new ATOM 0 HB ILE A 136 -7.480 -2.823 -0.380 1.00 0.00 H new ATOM 0 HG12 ILE A 136 -7.758 -0.672 -2.512 1.00 0.00 H new ATOM 0 HG13 ILE A 136 -8.809 -0.853 -1.121 1.00 0.00 H new ATOM 0 HG21 ILE A 136 -5.335 -2.170 -1.415 1.00 0.00 H new ATOM 0 HG22 ILE A 136 -5.826 -3.811 -1.895 1.00 0.00 H new ATOM 0 HG23 ILE A 136 -6.032 -2.454 -3.027 1.00 0.00 H new ATOM 0 HD11 ILE A 136 -7.145 0.901 -0.739 1.00 0.00 H new ATOM 0 HD12 ILE A 136 -6.898 -0.450 0.393 1.00 0.00 H new ATOM 0 HD13 ILE A 136 -5.831 -0.266 -1.019 1.00 0.00 H new ATOM 761 N ASP A 137 -8.461 -5.529 -1.197 1.00 0.00 N ATOM 762 CA ASP A 137 -8.009 -6.915 -1.019 1.00 0.00 C ATOM 763 C ASP A 137 -8.231 -7.751 -2.275 1.00 0.00 C ATOM 764 O ASP A 137 -9.340 -7.808 -2.814 1.00 0.00 O ATOM 765 CB ASP A 137 -8.735 -7.564 0.162 1.00 0.00 C ATOM 766 CG ASP A 137 -7.999 -8.775 0.695 1.00 0.00 C ATOM 767 OD1 ASP A 137 -7.840 -9.763 -0.053 1.00 0.00 O ATOM 768 OD2 ASP A 137 -7.575 -8.738 1.870 1.00 0.00 O ATOM 0 H ASP A 137 -9.076 -5.196 -0.454 1.00 0.00 H new ATOM 0 HA ASP A 137 -6.938 -6.882 -0.819 1.00 0.00 H new ATOM 0 HB2 ASP A 137 -8.851 -6.832 0.961 1.00 0.00 H new ATOM 0 HB3 ASP A 137 -9.737 -7.859 -0.148 1.00 0.00 H new ATOM 773 N ALA A 138 -7.163 -8.397 -2.736 1.00 0.00 N ATOM 774 CA ALA A 138 -7.207 -9.175 -3.968 1.00 0.00 C ATOM 775 C ALA A 138 -7.538 -10.643 -3.711 1.00 0.00 C ATOM 776 O ALA A 138 -7.284 -11.491 -4.567 1.00 0.00 O ATOM 777 CB ALA A 138 -5.886 -9.058 -4.711 1.00 0.00 C ATOM 0 H ALA A 138 -6.255 -8.396 -2.272 1.00 0.00 H new ATOM 0 HA ALA A 138 -8.007 -8.764 -4.583 1.00 0.00 H new ATOM 0 HB1 ALA A 138 -5.932 -9.644 -5.629 1.00 0.00 H new ATOM 0 HB2 ALA A 138 -5.698 -8.013 -4.956 1.00 0.00 H new ATOM 0 HB3 ALA A 138 -5.080 -9.434 -4.081 1.00 0.00 H new ATOM 783 N ASP A 139 -8.046 -10.939 -2.508 1.00 0.00 N ATOM 784 CA ASP A 139 -8.642 -12.250 -2.194 1.00 0.00 C ATOM 785 C ASP A 139 -7.587 -13.304 -1.855 1.00 0.00 C ATOM 786 O ASP A 139 -7.889 -14.307 -1.207 1.00 0.00 O ATOM 787 CB ASP A 139 -9.533 -12.732 -3.353 1.00 0.00 C ATOM 788 CG ASP A 139 -10.083 -14.132 -3.153 1.00 0.00 C ATOM 789 OD1 ASP A 139 -9.417 -15.107 -3.563 1.00 0.00 O ATOM 790 OD2 ASP A 139 -11.198 -14.262 -2.606 1.00 0.00 O ATOM 0 H ASP A 139 -8.057 -10.283 -1.727 1.00 0.00 H new ATOM 0 HA ASP A 139 -9.258 -12.115 -1.305 1.00 0.00 H new ATOM 0 HB2 ASP A 139 -10.364 -12.038 -3.474 1.00 0.00 H new ATOM 0 HB3 ASP A 139 -8.958 -12.705 -4.278 1.00 0.00 H new ATOM 795 N GLY A 140 -6.346 -13.057 -2.246 1.00 0.00 N ATOM 796 CA GLY A 140 -5.303 -14.052 -2.064 1.00 0.00 C ATOM 797 C GLY A 140 -4.760 -14.041 -0.655 1.00 0.00 C ATOM 798 O GLY A 140 -3.698 -13.480 -0.404 1.00 0.00 O ATOM 0 H GLY A 140 -6.040 -12.189 -2.685 1.00 0.00 H new ATOM 0 HA2 GLY A 140 -5.700 -15.041 -2.293 1.00 0.00 H new ATOM 0 HA3 GLY A 140 -4.493 -13.863 -2.768 1.00 0.00 H new ATOM 802 N SER A 141 -5.516 -14.654 0.258 1.00 0.00 N ATOM 803 CA SER A 141 -5.226 -14.636 1.695 1.00 0.00 C ATOM 804 C SER A 141 -5.018 -13.203 2.173 1.00 0.00 C ATOM 805 O SER A 141 -4.282 -12.941 3.126 1.00 0.00 O ATOM 806 CB SER A 141 -4.017 -15.528 2.046 1.00 0.00 C ATOM 807 OG SER A 141 -2.839 -15.146 1.351 1.00 0.00 O ATOM 0 H SER A 141 -6.355 -15.182 0.019 1.00 0.00 H new ATOM 0 HA SER A 141 -6.087 -15.052 2.218 1.00 0.00 H new ATOM 0 HB2 SER A 141 -3.833 -15.480 3.119 1.00 0.00 H new ATOM 0 HB3 SER A 141 -4.254 -16.565 1.810 1.00 0.00 H new ATOM 0 HG SER A 141 -2.995 -14.298 0.885 1.00 0.00 H new ATOM 813 N GLY A 142 -5.700 -12.279 1.503 1.00 0.00 N ATOM 814 CA GLY A 142 -5.510 -10.879 1.776 1.00 0.00 C ATOM 815 C GLY A 142 -4.228 -10.370 1.166 1.00 0.00 C ATOM 816 O GLY A 142 -3.269 -10.088 1.878 1.00 0.00 O ATOM 0 H GLY A 142 -6.383 -12.484 0.773 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -6.353 -10.312 1.381 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -5.492 -10.716 2.854 1.00 0.00 H new ATOM 820 N THR A 143 -4.190 -10.266 -0.157 1.00 0.00 N ATOM 821 CA THR A 143 -2.976 -9.825 -0.835 1.00 0.00 C ATOM 822 C THR A 143 -3.193 -8.532 -1.614 1.00 0.00 C ATOM 823 O THR A 143 -4.301 -8.241 -2.071 1.00 0.00 O ATOM 824 CB THR A 143 -2.410 -10.905 -1.791 1.00 0.00 C ATOM 825 OG1 THR A 143 -1.198 -10.442 -2.387 1.00 0.00 O ATOM 826 CG2 THR A 143 -3.403 -11.252 -2.887 1.00 0.00 C ATOM 0 H THR A 143 -4.973 -10.477 -0.775 1.00 0.00 H new ATOM 0 HA THR A 143 -2.249 -9.644 -0.043 1.00 0.00 H new ATOM 0 HB THR A 143 -2.218 -11.801 -1.201 1.00 0.00 H new ATOM 0 HG1 THR A 143 -1.015 -10.958 -3.200 1.00 0.00 H new ATOM 0 HG21 THR A 143 -2.974 -12.012 -3.539 1.00 0.00 H new ATOM 0 HG22 THR A 143 -4.320 -11.634 -2.439 1.00 0.00 H new ATOM 0 HG23 THR A 143 -3.628 -10.359 -3.470 1.00 0.00 H new ATOM 834 N VAL A 144 -2.127 -7.752 -1.719 1.00 0.00 N ATOM 835 CA VAL A 144 -2.086 -6.579 -2.573 1.00 0.00 C ATOM 836 C VAL A 144 -1.004 -6.778 -3.627 1.00 0.00 C ATOM 837 O VAL A 144 0.171 -6.963 -3.296 1.00 0.00 O ATOM 838 CB VAL A 144 -1.771 -5.290 -1.780 1.00 0.00 C ATOM 839 CG1 VAL A 144 -1.743 -4.081 -2.703 1.00 0.00 C ATOM 840 CG2 VAL A 144 -2.780 -5.072 -0.670 1.00 0.00 C ATOM 0 H VAL A 144 -1.260 -7.919 -1.208 1.00 0.00 H new ATOM 0 HA VAL A 144 -3.070 -6.463 -3.028 1.00 0.00 H new ATOM 0 HB VAL A 144 -0.785 -5.411 -1.331 1.00 0.00 H new ATOM 0 HG11 VAL A 144 -1.520 -3.186 -2.123 1.00 0.00 H new ATOM 0 HG12 VAL A 144 -0.975 -4.222 -3.464 1.00 0.00 H new ATOM 0 HG13 VAL A 144 -2.714 -3.968 -3.185 1.00 0.00 H new ATOM 0 HG21 VAL A 144 -2.534 -4.158 -0.129 1.00 0.00 H new ATOM 0 HG22 VAL A 144 -3.778 -4.982 -1.098 1.00 0.00 H new ATOM 0 HG23 VAL A 144 -2.754 -5.918 0.016 1.00 0.00 H new ATOM 850 N ASP A 145 -1.402 -6.770 -4.890 1.00 0.00 N ATOM 851 CA ASP A 145 -0.452 -6.907 -5.986 1.00 0.00 C ATOM 852 C ASP A 145 0.405 -5.658 -6.095 1.00 0.00 C ATOM 853 O ASP A 145 -0.016 -4.565 -5.720 1.00 0.00 O ATOM 854 CB ASP A 145 -1.184 -7.119 -7.316 1.00 0.00 C ATOM 855 CG ASP A 145 -1.879 -8.461 -7.414 1.00 0.00 C ATOM 856 OD1 ASP A 145 -3.008 -8.595 -6.899 1.00 0.00 O ATOM 857 OD2 ASP A 145 -1.309 -9.379 -8.036 1.00 0.00 O ATOM 0 H ASP A 145 -2.374 -6.670 -5.182 1.00 0.00 H new ATOM 0 HA ASP A 145 0.177 -7.773 -5.778 1.00 0.00 H new ATOM 0 HB2 ASP A 145 -1.921 -6.326 -7.447 1.00 0.00 H new ATOM 0 HB3 ASP A 145 -0.469 -7.028 -8.134 1.00 0.00 H new ATOM 862 N PHE A 146 1.602 -5.829 -6.637 1.00 0.00 N ATOM 863 CA PHE A 146 2.520 -4.718 -6.859 1.00 0.00 C ATOM 864 C PHE A 146 1.959 -3.747 -7.897 1.00 0.00 C ATOM 865 O PHE A 146 2.461 -2.639 -8.058 1.00 0.00 O ATOM 866 CB PHE A 146 3.894 -5.243 -7.295 1.00 0.00 C ATOM 867 CG PHE A 146 3.831 -6.294 -8.368 1.00 0.00 C ATOM 868 CD1 PHE A 146 3.747 -5.940 -9.705 1.00 0.00 C ATOM 869 CD2 PHE A 146 3.860 -7.636 -8.034 1.00 0.00 C ATOM 870 CE1 PHE A 146 3.691 -6.908 -10.687 1.00 0.00 C ATOM 871 CE2 PHE A 146 3.806 -8.608 -9.014 1.00 0.00 C ATOM 872 CZ PHE A 146 3.720 -8.243 -10.342 1.00 0.00 C ATOM 0 H PHE A 146 1.964 -6.735 -6.934 1.00 0.00 H new ATOM 0 HA PHE A 146 2.637 -4.176 -5.921 1.00 0.00 H new ATOM 0 HB2 PHE A 146 4.495 -4.407 -7.653 1.00 0.00 H new ATOM 0 HB3 PHE A 146 4.407 -5.655 -6.426 1.00 0.00 H new ATOM 0 HD1 PHE A 146 3.725 -4.896 -9.981 1.00 0.00 H new ATOM 0 HD2 PHE A 146 3.926 -7.927 -6.996 1.00 0.00 H new ATOM 0 HE1 PHE A 146 3.624 -6.620 -11.726 1.00 0.00 H new ATOM 0 HE2 PHE A 146 3.831 -9.653 -8.741 1.00 0.00 H new ATOM 0 HZ PHE A 146 3.675 -9.001 -11.110 1.00 0.00 H new ATOM 882 N GLU A 147 0.916 -4.181 -8.599 1.00 0.00 N ATOM 883 CA GLU A 147 0.214 -3.329 -9.547 1.00 0.00 C ATOM 884 C GLU A 147 -0.748 -2.403 -8.811 1.00 0.00 C ATOM 885 O GLU A 147 -0.892 -1.233 -9.156 1.00 0.00 O ATOM 886 CB GLU A 147 -0.552 -4.187 -10.551 1.00 0.00 C ATOM 887 CG GLU A 147 0.347 -5.053 -11.413 1.00 0.00 C ATOM 888 CD GLU A 147 1.190 -4.233 -12.362 1.00 0.00 C ATOM 889 OE1 GLU A 147 2.304 -3.830 -11.983 1.00 0.00 O ATOM 890 OE2 GLU A 147 0.734 -3.979 -13.495 1.00 0.00 O ATOM 0 H GLU A 147 0.538 -5.126 -8.526 1.00 0.00 H new ATOM 0 HA GLU A 147 0.944 -2.722 -10.082 1.00 0.00 H new ATOM 0 HB2 GLU A 147 -1.252 -4.826 -10.012 1.00 0.00 H new ATOM 0 HB3 GLU A 147 -1.145 -3.537 -11.195 1.00 0.00 H new ATOM 0 HG2 GLU A 147 0.998 -5.648 -10.773 1.00 0.00 H new ATOM 0 HG3 GLU A 147 -0.264 -5.752 -11.984 1.00 0.00 H new ATOM 897 N GLU A 148 -1.392 -2.943 -7.783 1.00 0.00 N ATOM 898 CA GLU A 148 -2.339 -2.182 -6.988 1.00 0.00 C ATOM 899 C GLU A 148 -1.584 -1.294 -6.010 1.00 0.00 C ATOM 900 O GLU A 148 -2.055 -0.220 -5.631 1.00 0.00 O ATOM 901 CB GLU A 148 -3.275 -3.123 -6.232 1.00 0.00 C ATOM 902 CG GLU A 148 -4.533 -2.444 -5.723 1.00 0.00 C ATOM 903 CD GLU A 148 -5.315 -1.789 -6.844 1.00 0.00 C ATOM 904 OE1 GLU A 148 -5.856 -2.521 -7.697 1.00 0.00 O ATOM 905 OE2 GLU A 148 -5.363 -0.545 -6.896 1.00 0.00 O ATOM 0 H GLU A 148 -1.272 -3.910 -7.482 1.00 0.00 H new ATOM 0 HA GLU A 148 -2.940 -1.558 -7.650 1.00 0.00 H new ATOM 0 HB2 GLU A 148 -3.556 -3.947 -6.888 1.00 0.00 H new ATOM 0 HB3 GLU A 148 -2.738 -3.556 -5.388 1.00 0.00 H new ATOM 0 HG2 GLU A 148 -5.164 -3.178 -5.221 1.00 0.00 H new ATOM 0 HG3 GLU A 148 -4.265 -1.693 -4.980 1.00 0.00 H new ATOM 912 N PHE A 149 -0.405 -1.752 -5.606 1.00 0.00 N ATOM 913 CA PHE A 149 0.479 -0.957 -4.767 1.00 0.00 C ATOM 914 C PHE A 149 1.111 0.156 -5.601 1.00 0.00 C ATOM 915 O PHE A 149 2.309 0.151 -5.884 1.00 0.00 O ATOM 916 CB PHE A 149 1.557 -1.848 -4.138 1.00 0.00 C ATOM 917 CG PHE A 149 2.411 -1.146 -3.121 1.00 0.00 C ATOM 918 CD1 PHE A 149 1.897 -0.812 -1.878 1.00 0.00 C ATOM 919 CD2 PHE A 149 3.724 -0.820 -3.407 1.00 0.00 C ATOM 920 CE1 PHE A 149 2.679 -0.165 -0.941 1.00 0.00 C ATOM 921 CE2 PHE A 149 4.511 -0.173 -2.474 1.00 0.00 C ATOM 922 CZ PHE A 149 3.988 0.156 -1.239 1.00 0.00 C ATOM 0 H PHE A 149 -0.040 -2.673 -5.848 1.00 0.00 H new ATOM 0 HA PHE A 149 -0.098 -0.505 -3.960 1.00 0.00 H new ATOM 0 HB2 PHE A 149 1.076 -2.704 -3.665 1.00 0.00 H new ATOM 0 HB3 PHE A 149 2.198 -2.239 -4.928 1.00 0.00 H new ATOM 0 HD1 PHE A 149 0.873 -1.060 -1.639 1.00 0.00 H new ATOM 0 HD2 PHE A 149 4.139 -1.074 -4.371 1.00 0.00 H new ATOM 0 HE1 PHE A 149 2.266 0.090 0.024 1.00 0.00 H new ATOM 0 HE2 PHE A 149 5.535 0.075 -2.710 1.00 0.00 H new ATOM 0 HZ PHE A 149 4.601 0.663 -0.509 1.00 0.00 H new ATOM 932 N MET A 150 0.272 1.085 -6.026 1.00 0.00 N ATOM 933 CA MET A 150 0.703 2.226 -6.808 1.00 0.00 C ATOM 934 C MET A 150 -0.400 3.276 -6.812 1.00 0.00 C ATOM 935 O MET A 150 -0.286 4.302 -6.143 1.00 0.00 O ATOM 936 CB MET A 150 1.054 1.792 -8.241 1.00 0.00 C ATOM 937 CG MET A 150 1.778 2.854 -9.063 1.00 0.00 C ATOM 938 SD MET A 150 0.696 4.178 -9.649 1.00 0.00 S ATOM 939 CE MET A 150 1.881 5.254 -10.457 1.00 0.00 C ATOM 0 H MET A 150 -0.730 1.067 -5.837 1.00 0.00 H new ATOM 0 HA MET A 150 1.600 2.656 -6.362 1.00 0.00 H new ATOM 0 HB2 MET A 150 1.677 0.899 -8.195 1.00 0.00 H new ATOM 0 HB3 MET A 150 0.136 1.513 -8.758 1.00 0.00 H new ATOM 0 HG2 MET A 150 2.575 3.288 -8.459 1.00 0.00 H new ATOM 0 HG3 MET A 150 2.252 2.377 -9.921 1.00 0.00 H new ATOM 0 HE1 MET A 150 1.364 6.120 -10.871 1.00 0.00 H new ATOM 0 HE2 MET A 150 2.623 5.587 -9.732 1.00 0.00 H new ATOM 0 HE3 MET A 150 2.378 4.710 -11.261 1.00 0.00 H new ATOM 949 N GLY A 151 -1.498 2.979 -7.508 1.00 0.00 N ATOM 950 CA GLY A 151 -2.574 3.944 -7.666 1.00 0.00 C ATOM 951 C GLY A 151 -3.288 4.253 -6.365 1.00 0.00 C ATOM 952 O GLY A 151 -3.833 5.342 -6.193 1.00 0.00 O ATOM 0 H GLY A 151 -1.661 2.083 -7.967 1.00 0.00 H new ATOM 0 HA2 GLY A 151 -2.169 4.867 -8.080 1.00 0.00 H new ATOM 0 HA3 GLY A 151 -3.295 3.561 -8.388 1.00 0.00 H new ATOM 956 N VAL A 152 -3.275 3.295 -5.446 1.00 0.00 N ATOM 957 CA VAL A 152 -3.914 3.468 -4.146 1.00 0.00 C ATOM 958 C VAL A 152 -3.286 4.626 -3.363 1.00 0.00 C ATOM 959 O VAL A 152 -3.981 5.373 -2.676 1.00 0.00 O ATOM 960 CB VAL A 152 -3.828 2.177 -3.303 1.00 0.00 C ATOM 961 CG1 VAL A 152 -4.417 2.384 -1.914 1.00 0.00 C ATOM 962 CG2 VAL A 152 -4.536 1.033 -4.011 1.00 0.00 C ATOM 0 H VAL A 152 -2.828 2.388 -5.577 1.00 0.00 H new ATOM 0 HA VAL A 152 -4.962 3.699 -4.338 1.00 0.00 H new ATOM 0 HB VAL A 152 -2.774 1.922 -3.188 1.00 0.00 H new ATOM 0 HG11 VAL A 152 -4.342 1.457 -1.345 1.00 0.00 H new ATOM 0 HG12 VAL A 152 -3.867 3.172 -1.399 1.00 0.00 H new ATOM 0 HG13 VAL A 152 -5.465 2.671 -2.002 1.00 0.00 H new ATOM 0 HG21 VAL A 152 -4.466 0.130 -3.404 1.00 0.00 H new ATOM 0 HG22 VAL A 152 -5.585 1.290 -4.159 1.00 0.00 H new ATOM 0 HG23 VAL A 152 -4.065 0.857 -4.978 1.00 0.00 H new ATOM 972 N MET A 153 -1.974 4.791 -3.492 1.00 0.00 N ATOM 973 CA MET A 153 -1.267 5.796 -2.705 1.00 0.00 C ATOM 974 C MET A 153 -1.051 7.082 -3.498 1.00 0.00 C ATOM 975 O MET A 153 -0.760 8.126 -2.917 1.00 0.00 O ATOM 976 CB MET A 153 0.070 5.245 -2.195 1.00 0.00 C ATOM 977 CG MET A 153 1.068 4.902 -3.288 1.00 0.00 C ATOM 978 SD MET A 153 2.539 4.082 -2.642 1.00 0.00 S ATOM 979 CE MET A 153 3.135 5.300 -1.470 1.00 0.00 C ATOM 0 H MET A 153 -1.385 4.250 -4.125 1.00 0.00 H new ATOM 0 HA MET A 153 -1.893 6.039 -1.846 1.00 0.00 H new ATOM 0 HB2 MET A 153 0.520 5.979 -1.527 1.00 0.00 H new ATOM 0 HB3 MET A 153 -0.122 4.351 -1.602 1.00 0.00 H new ATOM 0 HG2 MET A 153 0.589 4.256 -4.024 1.00 0.00 H new ATOM 0 HG3 MET A 153 1.362 5.814 -3.807 1.00 0.00 H new ATOM 0 HE1 MET A 153 4.173 5.085 -1.218 1.00 0.00 H new ATOM 0 HE2 MET A 153 3.067 6.294 -1.912 1.00 0.00 H new ATOM 0 HE3 MET A 153 2.527 5.263 -0.566 1.00 0.00 H new ATOM 989 N THR A 154 -1.203 7.008 -4.814 1.00 0.00 N ATOM 990 CA THR A 154 -1.072 8.178 -5.669 1.00 0.00 C ATOM 991 C THR A 154 -2.444 8.642 -6.153 1.00 0.00 C ATOM 992 O THR A 154 -2.739 8.621 -7.353 1.00 0.00 O ATOM 993 CB THR A 154 -0.170 7.886 -6.885 1.00 0.00 C ATOM 994 OG1 THR A 154 -0.646 6.723 -7.577 1.00 0.00 O ATOM 995 CG2 THR A 154 1.271 7.665 -6.457 1.00 0.00 C ATOM 0 H THR A 154 -1.418 6.145 -5.313 1.00 0.00 H new ATOM 0 HA THR A 154 -0.610 8.967 -5.076 1.00 0.00 H new ATOM 0 HB THR A 154 -0.206 8.751 -7.548 1.00 0.00 H new ATOM 0 HG1 THR A 154 -0.460 5.924 -7.041 1.00 0.00 H new ATOM 0 HG21 THR A 154 1.884 7.461 -7.335 1.00 0.00 H new ATOM 0 HG22 THR A 154 1.642 8.558 -5.954 1.00 0.00 H new ATOM 0 HG23 THR A 154 1.322 6.817 -5.774 1.00 0.00 H new ATOM 1003 N GLY A 155 -3.283 9.054 -5.215 1.00 0.00 N ATOM 1004 CA GLY A 155 -4.637 9.451 -5.549 1.00 0.00 C ATOM 1005 C GLY A 155 -4.709 10.842 -6.142 1.00 0.00 C ATOM 1006 O GLY A 155 -4.537 11.023 -7.348 1.00 0.00 O ATOM 0 H GLY A 155 -3.050 9.121 -4.224 1.00 0.00 H new ATOM 0 HA2 GLY A 155 -5.056 8.736 -6.257 1.00 0.00 H new ATOM 0 HA3 GLY A 155 -5.255 9.411 -4.652 1.00 0.00 H new ATOM 1010 N GLY A 156 -4.961 11.827 -5.293 1.00 0.00 N ATOM 1011 CA GLY A 156 -5.065 13.197 -5.757 1.00 0.00 C ATOM 1012 C GLY A 156 -3.719 13.890 -5.796 1.00 0.00 C ATOM 1013 O GLY A 156 -3.600 15.017 -6.276 1.00 0.00 O ATOM 0 H GLY A 156 -5.096 11.703 -4.290 1.00 0.00 H new ATOM 0 HA2 GLY A 156 -5.507 13.209 -6.753 1.00 0.00 H new ATOM 0 HA3 GLY A 156 -5.738 13.751 -5.103 1.00 0.00 H new ATOM 1017 N ASP A 157 -2.703 13.212 -5.284 1.00 0.00 N ATOM 1018 CA ASP A 157 -1.353 13.756 -5.228 1.00 0.00 C ATOM 1019 C ASP A 157 -0.517 13.256 -6.398 1.00 0.00 C ATOM 1020 O ASP A 157 -0.980 12.445 -7.200 1.00 0.00 O ATOM 1021 CB ASP A 157 -0.679 13.388 -3.905 1.00 0.00 C ATOM 1022 CG ASP A 157 -0.667 11.894 -3.654 1.00 0.00 C ATOM 1023 OD1 ASP A 157 -1.746 11.331 -3.356 1.00 0.00 O ATOM 1024 OD2 ASP A 157 0.414 11.281 -3.743 1.00 0.00 O ATOM 0 H ASP A 157 -2.790 12.272 -4.897 1.00 0.00 H new ATOM 0 HA ASP A 157 -1.425 14.842 -5.295 1.00 0.00 H new ATOM 0 HB2 ASP A 157 0.345 13.761 -3.907 1.00 0.00 H new ATOM 0 HB3 ASP A 157 -1.198 13.886 -3.086 1.00 0.00 H new ATOM 1029 N GLU A 158 0.706 13.755 -6.496 1.00 0.00 N ATOM 1030 CA GLU A 158 1.589 13.403 -7.593 1.00 0.00 C ATOM 1031 C GLU A 158 2.952 12.984 -7.050 1.00 0.00 C ATOM 1032 O GLU A 158 3.749 13.875 -6.692 1.00 0.00 O ATOM 1033 CB GLU A 158 1.743 14.595 -8.543 1.00 0.00 C ATOM 1034 CG GLU A 158 2.330 14.235 -9.896 1.00 0.00 C ATOM 1035 CD GLU A 158 1.383 13.403 -10.734 1.00 0.00 C ATOM 1036 OE1 GLU A 158 0.290 13.903 -11.070 1.00 0.00 O ATOM 1037 OE2 GLU A 158 1.720 12.246 -11.055 1.00 0.00 O ATOM 1038 OXT GLU A 158 3.219 11.771 -6.968 1.00 0.00 O ATOM 0 H GLU A 158 1.109 14.408 -5.824 1.00 0.00 H new ATOM 0 HA GLU A 158 1.157 12.567 -8.144 1.00 0.00 H new ATOM 0 HB2 GLU A 158 0.766 15.055 -8.693 1.00 0.00 H new ATOM 0 HB3 GLU A 158 2.379 15.343 -8.070 1.00 0.00 H new ATOM 0 HG2 GLU A 158 2.580 15.149 -10.435 1.00 0.00 H new ATOM 0 HG3 GLU A 158 3.260 13.686 -9.751 1.00 0.00 H new TER 1045 GLU A 158