USER MOD reduce.3.24.130724 H: found=0, std=0, add=720, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 721 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 39 GLN : amide:sc= -0.563 X(o=-7.5,f=-7.1) USER MOD Set 1.2: A 66 HIS : no HE2:sc= -3.83 K(o=-7.5,f=-9.4) USER MOD Set 1.3: A 133 HIS : no HE2:sc= -3.1 K(o=-7.5,f=-9.1!) USER MOD Set 2.1: A 8 ASN : amide:sc= -2.79! K(o=-2.8!,f=-0.57) USER MOD Set 2.2: A 9 SER OG : rot -160:sc= 0.011 USER MOD Single : A 4 LYS NZ :NH3+ 149:sc= 1.39 (180deg=-0.0328) USER MOD Single : A 7 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.0562) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 GLN : amide:sc= -2.4 X(o=-2.4,f=-2.7!) USER MOD Single : A 15 THR OG1 : rot -91:sc= 0.619 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 GLN : amide:sc= -0.855 K(o=-0.86,f=-3!) USER MOD Single : A 22 LYS NZ :NH3+ -158:sc= -0.181 (180deg=-0.893) USER MOD Single : A 31 SER OG : rot -129:sc= -0.166 USER MOD Single : A 33 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 THR OG1 : rot 117:sc= 1.44 USER MOD Single : A 68 THR OG1 : rot 180:sc= -0.116 USER MOD Single : A 77 TYR OH : rot 40:sc= 0.163 USER MOD Single : A 79 ASN : amide:sc= -0.302 K(o=-0.3,f=-3.4!) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 ASN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 94 LYS NZ :NH3+ 136:sc= -0.607 (180deg=-1.55!) USER MOD Single : A 95 LYS NZ :NH3+ 154:sc= -0.138 (180deg=-0.617) USER MOD Single : A 99 GLN : amide:sc= -1.45! C(o=-1.4!,f=-1.3!) USER MOD Single : A 102 LYS NZ :NH3+ 154:sc= -0.0177 (180deg=-0.409) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 29 N PHE A 3 3.537 -4.010 -2.232 1.00 0.00 N ATOM 30 CA PHE A 3 3.360 -5.249 -1.484 1.00 0.00 C ATOM 31 C PHE A 3 4.559 -6.174 -1.671 1.00 0.00 C ATOM 32 O PHE A 3 5.328 -6.028 -2.622 1.00 0.00 O ATOM 33 CB PHE A 3 2.079 -5.959 -1.928 1.00 0.00 C ATOM 34 CG PHE A 3 1.517 -6.886 -0.889 1.00 0.00 C ATOM 35 CD1 PHE A 3 0.632 -6.419 0.069 1.00 0.00 C ATOM 36 CD2 PHE A 3 1.872 -8.225 -0.871 1.00 0.00 C ATOM 37 CE1 PHE A 3 0.112 -7.270 1.026 1.00 0.00 C ATOM 38 CE2 PHE A 3 1.355 -9.081 0.083 1.00 0.00 C ATOM 39 CZ PHE A 3 0.475 -8.602 1.034 1.00 0.00 C ATOM 0 HA PHE A 3 3.280 -4.997 -0.427 1.00 0.00 H new ATOM 0 HB2 PHE A 3 1.327 -5.211 -2.181 1.00 0.00 H new ATOM 0 HB3 PHE A 3 2.283 -6.525 -2.837 1.00 0.00 H new ATOM 0 HD1 PHE A 3 0.345 -5.378 0.068 1.00 0.00 H new ATOM 0 HD2 PHE A 3 2.561 -8.604 -1.611 1.00 0.00 H new ATOM 0 HE1 PHE A 3 -0.578 -6.893 1.767 1.00 0.00 H new ATOM 0 HE2 PHE A 3 1.639 -10.123 0.085 1.00 0.00 H new ATOM 0 HZ PHE A 3 0.072 -9.268 1.782 1.00 0.00 H new ATOM 49 N LYS A 4 4.713 -7.126 -0.758 1.00 0.00 N ATOM 50 CA LYS A 4 5.817 -8.077 -0.821 1.00 0.00 C ATOM 51 C LYS A 4 5.368 -9.463 -0.368 1.00 0.00 C ATOM 52 O LYS A 4 4.477 -9.594 0.471 1.00 0.00 O ATOM 53 CB LYS A 4 6.980 -7.596 0.050 1.00 0.00 C ATOM 54 CG LYS A 4 8.073 -8.636 0.232 1.00 0.00 C ATOM 55 CD LYS A 4 8.774 -8.944 -1.081 1.00 0.00 C ATOM 56 CE LYS A 4 9.467 -10.297 -1.039 1.00 0.00 C ATOM 57 NZ LYS A 4 10.128 -10.623 -2.333 1.00 0.00 N ATOM 0 H LYS A 4 4.087 -7.260 0.036 1.00 0.00 H new ATOM 0 HA LYS A 4 6.149 -8.143 -1.857 1.00 0.00 H new ATOM 0 HB2 LYS A 4 7.412 -6.701 -0.397 1.00 0.00 H new ATOM 0 HB3 LYS A 4 6.596 -7.309 1.029 1.00 0.00 H new ATOM 0 HG2 LYS A 4 8.801 -8.276 0.959 1.00 0.00 H new ATOM 0 HG3 LYS A 4 7.642 -9.551 0.639 1.00 0.00 H new ATOM 0 HD2 LYS A 4 8.048 -8.931 -1.894 1.00 0.00 H new ATOM 0 HD3 LYS A 4 9.506 -8.165 -1.295 1.00 0.00 H new ATOM 0 HE2 LYS A 4 10.210 -10.300 -0.241 1.00 0.00 H new ATOM 0 HE3 LYS A 4 8.738 -11.071 -0.799 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 10.969 -11.209 -2.155 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 9.464 -11.145 -2.940 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 10.413 -9.743 -2.809 1.00 0.00 H new ATOM 71 N PHE A 5 5.992 -10.494 -0.928 1.00 0.00 N ATOM 72 CA PHE A 5 5.657 -11.870 -0.582 1.00 0.00 C ATOM 73 C PHE A 5 5.668 -12.068 0.931 1.00 0.00 C ATOM 74 O PHE A 5 6.705 -11.928 1.579 1.00 0.00 O ATOM 75 CB PHE A 5 6.640 -12.838 -1.241 1.00 0.00 C ATOM 76 CG PHE A 5 6.783 -12.632 -2.722 1.00 0.00 C ATOM 77 CD1 PHE A 5 5.671 -12.385 -3.511 1.00 0.00 C ATOM 78 CD2 PHE A 5 8.030 -12.684 -3.325 1.00 0.00 C ATOM 79 CE1 PHE A 5 5.799 -12.194 -4.874 1.00 0.00 C ATOM 80 CE2 PHE A 5 8.164 -12.493 -4.688 1.00 0.00 C ATOM 81 CZ PHE A 5 7.047 -12.249 -5.463 1.00 0.00 C ATOM 0 H PHE A 5 6.733 -10.402 -1.623 1.00 0.00 H new ATOM 0 HA PHE A 5 4.652 -12.077 -0.951 1.00 0.00 H new ATOM 0 HB2 PHE A 5 7.617 -12.727 -0.771 1.00 0.00 H new ATOM 0 HB3 PHE A 5 6.311 -13.860 -1.055 1.00 0.00 H new ATOM 0 HD1 PHE A 5 4.693 -12.341 -3.056 1.00 0.00 H new ATOM 0 HD2 PHE A 5 8.906 -12.876 -2.724 1.00 0.00 H new ATOM 0 HE1 PHE A 5 4.924 -12.002 -5.478 1.00 0.00 H new ATOM 0 HE2 PHE A 5 9.141 -12.535 -5.146 1.00 0.00 H new ATOM 0 HZ PHE A 5 7.149 -12.101 -6.528 1.00 0.00 H new ATOM 91 N GLY A 6 4.505 -12.394 1.488 1.00 0.00 N ATOM 92 CA GLY A 6 4.402 -12.605 2.921 1.00 0.00 C ATOM 93 C GLY A 6 5.360 -13.669 3.420 1.00 0.00 C ATOM 94 O GLY A 6 6.137 -14.229 2.646 1.00 0.00 O ATOM 0 H GLY A 6 3.633 -12.516 0.973 1.00 0.00 H new ATOM 0 HA2 GLY A 6 4.603 -11.667 3.439 1.00 0.00 H new ATOM 0 HA3 GLY A 6 3.381 -12.894 3.170 1.00 0.00 H new ATOM 98 N LYS A 7 5.308 -13.947 4.718 1.00 0.00 N ATOM 99 CA LYS A 7 6.177 -14.950 5.322 1.00 0.00 C ATOM 100 C LYS A 7 5.970 -16.313 4.670 1.00 0.00 C ATOM 101 O LYS A 7 6.931 -17.011 4.350 1.00 0.00 O ATOM 102 CB LYS A 7 5.912 -15.046 6.826 1.00 0.00 C ATOM 103 CG LYS A 7 6.998 -15.785 7.589 1.00 0.00 C ATOM 104 CD LYS A 7 6.655 -17.255 7.763 1.00 0.00 C ATOM 105 CE LYS A 7 5.836 -17.491 9.023 1.00 0.00 C ATOM 106 NZ LYS A 7 6.671 -17.398 10.252 1.00 0.00 N ATOM 0 H LYS A 7 4.672 -13.491 5.373 1.00 0.00 H new ATOM 0 HA LYS A 7 7.210 -14.643 5.161 1.00 0.00 H new ATOM 0 HB2 LYS A 7 5.813 -14.040 7.234 1.00 0.00 H new ATOM 0 HB3 LYS A 7 4.959 -15.550 6.987 1.00 0.00 H new ATOM 0 HG2 LYS A 7 7.945 -15.692 7.058 1.00 0.00 H new ATOM 0 HG3 LYS A 7 7.135 -15.324 8.567 1.00 0.00 H new ATOM 0 HD2 LYS A 7 6.097 -17.605 6.894 1.00 0.00 H new ATOM 0 HD3 LYS A 7 7.573 -17.841 7.809 1.00 0.00 H new ATOM 0 HE2 LYS A 7 5.030 -16.759 9.075 1.00 0.00 H new ATOM 0 HE3 LYS A 7 5.370 -18.475 8.974 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 6.140 -17.776 11.062 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 7.543 -17.950 10.122 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 6.915 -16.403 10.432 1.00 0.00 H new ATOM 120 N ASN A 8 4.709 -16.685 4.476 1.00 0.00 N ATOM 121 CA ASN A 8 4.376 -17.965 3.861 1.00 0.00 C ATOM 122 C ASN A 8 4.572 -17.910 2.349 1.00 0.00 C ATOM 123 O ASN A 8 4.909 -18.913 1.720 1.00 0.00 O ATOM 124 CB ASN A 8 2.931 -18.350 4.186 1.00 0.00 C ATOM 125 CG ASN A 8 2.017 -17.143 4.272 1.00 0.00 C ATOM 126 OD1 ASN A 8 1.448 -16.855 5.325 1.00 0.00 O ATOM 127 ND2 ASN A 8 1.871 -16.431 3.160 1.00 0.00 N ATOM 0 H ASN A 8 3.901 -16.119 4.736 1.00 0.00 H new ATOM 0 HA ASN A 8 5.047 -18.721 4.269 1.00 0.00 H new ATOM 0 HB2 ASN A 8 2.558 -19.031 3.421 1.00 0.00 H new ATOM 0 HB3 ASN A 8 2.906 -18.890 5.133 1.00 0.00 H new ATOM 0 HD21 ASN A 8 1.268 -15.609 3.157 1.00 0.00 H new ATOM 0 HD22 ASN A 8 2.362 -16.707 2.310 1.00 0.00 H new ATOM 134 N SER A 9 4.358 -16.732 1.773 1.00 0.00 N ATOM 135 CA SER A 9 4.508 -16.546 0.334 1.00 0.00 C ATOM 136 C SER A 9 5.936 -16.848 -0.107 1.00 0.00 C ATOM 137 O SER A 9 6.163 -17.677 -0.987 1.00 0.00 O ATOM 138 CB SER A 9 4.132 -15.116 -0.058 1.00 0.00 C ATOM 139 OG SER A 9 2.934 -14.709 0.580 1.00 0.00 O ATOM 0 H SER A 9 4.080 -15.892 2.280 1.00 0.00 H new ATOM 0 HA SER A 9 3.837 -17.242 -0.170 1.00 0.00 H new ATOM 0 HB2 SER A 9 4.940 -14.437 0.213 1.00 0.00 H new ATOM 0 HB3 SER A 9 4.011 -15.052 -1.139 1.00 0.00 H new ATOM 0 HG SER A 9 2.546 -13.951 0.095 1.00 0.00 H new ATOM 145 N GLU A 10 6.897 -16.169 0.513 1.00 0.00 N ATOM 146 CA GLU A 10 8.304 -16.364 0.184 1.00 0.00 C ATOM 147 C GLU A 10 8.672 -17.844 0.226 1.00 0.00 C ATOM 148 O GLU A 10 9.522 -18.306 -0.535 1.00 0.00 O ATOM 149 CB GLU A 10 9.191 -15.578 1.152 1.00 0.00 C ATOM 150 CG GLU A 10 8.961 -15.933 2.612 1.00 0.00 C ATOM 151 CD GLU A 10 9.998 -15.319 3.532 1.00 0.00 C ATOM 152 OE1 GLU A 10 10.699 -14.382 3.093 1.00 0.00 O ATOM 153 OE2 GLU A 10 10.110 -15.775 4.689 1.00 0.00 O ATOM 0 H GLU A 10 6.726 -15.480 1.245 1.00 0.00 H new ATOM 0 HA GLU A 10 8.469 -15.995 -0.828 1.00 0.00 H new ATOM 0 HB2 GLU A 10 10.236 -15.760 0.903 1.00 0.00 H new ATOM 0 HB3 GLU A 10 9.011 -14.512 1.013 1.00 0.00 H new ATOM 0 HG2 GLU A 10 7.969 -15.595 2.912 1.00 0.00 H new ATOM 0 HG3 GLU A 10 8.977 -17.017 2.725 1.00 0.00 H new ATOM 160 N LYS A 11 8.027 -18.583 1.122 1.00 0.00 N ATOM 161 CA LYS A 11 8.284 -20.011 1.265 1.00 0.00 C ATOM 162 C LYS A 11 7.632 -20.798 0.133 1.00 0.00 C ATOM 163 O LYS A 11 8.189 -21.783 -0.351 1.00 0.00 O ATOM 164 CB LYS A 11 7.763 -20.512 2.614 1.00 0.00 C ATOM 165 CG LYS A 11 7.941 -22.006 2.818 1.00 0.00 C ATOM 166 CD LYS A 11 6.625 -22.682 3.168 1.00 0.00 C ATOM 167 CE LYS A 11 5.886 -23.141 1.920 1.00 0.00 C ATOM 168 NZ LYS A 11 4.461 -23.465 2.208 1.00 0.00 N ATOM 0 H LYS A 11 7.322 -18.216 1.761 1.00 0.00 H new ATOM 0 HA LYS A 11 9.362 -20.166 1.218 1.00 0.00 H new ATOM 0 HB2 LYS A 11 8.279 -19.981 3.413 1.00 0.00 H new ATOM 0 HB3 LYS A 11 6.705 -20.266 2.699 1.00 0.00 H new ATOM 0 HG2 LYS A 11 8.350 -22.452 1.911 1.00 0.00 H new ATOM 0 HG3 LYS A 11 8.664 -22.182 3.614 1.00 0.00 H new ATOM 0 HD2 LYS A 11 6.815 -23.538 3.815 1.00 0.00 H new ATOM 0 HD3 LYS A 11 5.998 -21.990 3.730 1.00 0.00 H new ATOM 0 HE2 LYS A 11 5.935 -22.360 1.161 1.00 0.00 H new ATOM 0 HE3 LYS A 11 6.382 -24.019 1.506 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 3.991 -23.774 1.333 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 4.414 -24.228 2.914 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 3.981 -22.620 2.579 1.00 0.00 H new ATOM 182 N GLN A 12 6.451 -20.355 -0.286 1.00 0.00 N ATOM 183 CA GLN A 12 5.725 -21.018 -1.363 1.00 0.00 C ATOM 184 C GLN A 12 6.538 -21.011 -2.653 1.00 0.00 C ATOM 185 O GLN A 12 6.683 -22.041 -3.313 1.00 0.00 O ATOM 186 CB GLN A 12 4.376 -20.334 -1.593 1.00 0.00 C ATOM 187 CG GLN A 12 3.330 -20.683 -0.545 1.00 0.00 C ATOM 188 CD GLN A 12 1.948 -20.180 -0.911 1.00 0.00 C ATOM 189 OE1 GLN A 12 0.954 -20.889 -0.750 1.00 0.00 O ATOM 190 NE2 GLN A 12 1.877 -18.950 -1.405 1.00 0.00 N ATOM 0 H GLN A 12 5.977 -19.540 0.104 1.00 0.00 H new ATOM 0 HA GLN A 12 5.554 -22.054 -1.068 1.00 0.00 H new ATOM 0 HB2 GLN A 12 4.523 -19.254 -1.602 1.00 0.00 H new ATOM 0 HB3 GLN A 12 4.000 -20.613 -2.577 1.00 0.00 H new ATOM 0 HG2 GLN A 12 3.297 -21.765 -0.417 1.00 0.00 H new ATOM 0 HG3 GLN A 12 3.625 -20.257 0.414 1.00 0.00 H new ATOM 0 HE21 GLN A 12 2.726 -18.397 -1.522 1.00 0.00 H new ATOM 0 HE22 GLN A 12 0.973 -18.557 -1.668 1.00 0.00 H new ATOM 199 N LEU A 13 7.067 -19.845 -3.007 1.00 0.00 N ATOM 200 CA LEU A 13 7.866 -19.704 -4.219 1.00 0.00 C ATOM 201 C LEU A 13 9.258 -20.297 -4.026 1.00 0.00 C ATOM 202 O LEU A 13 9.886 -20.754 -4.980 1.00 0.00 O ATOM 203 CB LEU A 13 7.978 -18.229 -4.611 1.00 0.00 C ATOM 204 CG LEU A 13 6.673 -17.541 -5.012 1.00 0.00 C ATOM 205 CD1 LEU A 13 5.853 -18.440 -5.924 1.00 0.00 C ATOM 206 CD2 LEU A 13 5.871 -17.157 -3.777 1.00 0.00 C ATOM 0 H LEU A 13 6.957 -18.984 -2.472 1.00 0.00 H new ATOM 0 HA LEU A 13 7.366 -20.250 -5.019 1.00 0.00 H new ATOM 0 HB2 LEU A 13 8.411 -17.683 -3.773 1.00 0.00 H new ATOM 0 HB3 LEU A 13 8.679 -18.147 -5.442 1.00 0.00 H new ATOM 0 HG LEU A 13 6.918 -16.631 -5.559 1.00 0.00 H new ATOM 0 HD11 LEU A 13 4.928 -17.933 -6.199 1.00 0.00 H new ATOM 0 HD12 LEU A 13 6.425 -18.664 -6.824 1.00 0.00 H new ATOM 0 HD13 LEU A 13 5.617 -19.368 -5.404 1.00 0.00 H new ATOM 0 HD21 LEU A 13 4.945 -16.668 -4.082 1.00 0.00 H new ATOM 0 HD22 LEU A 13 5.636 -18.053 -3.202 1.00 0.00 H new ATOM 0 HD23 LEU A 13 6.456 -16.474 -3.161 1.00 0.00 H new ATOM 218 N ALA A 14 9.732 -20.289 -2.784 1.00 0.00 N ATOM 219 CA ALA A 14 11.047 -20.830 -2.465 1.00 0.00 C ATOM 220 C ALA A 14 11.036 -22.355 -2.499 1.00 0.00 C ATOM 221 O ALA A 14 12.088 -22.995 -2.478 1.00 0.00 O ATOM 222 CB ALA A 14 11.505 -20.334 -1.102 1.00 0.00 C ATOM 0 H ALA A 14 9.225 -19.914 -1.983 1.00 0.00 H new ATOM 0 HA ALA A 14 11.750 -20.481 -3.221 1.00 0.00 H new ATOM 0 HB1 ALA A 14 12.489 -20.746 -0.877 1.00 0.00 H new ATOM 0 HB2 ALA A 14 11.561 -19.245 -1.111 1.00 0.00 H new ATOM 0 HB3 ALA A 14 10.794 -20.655 -0.340 1.00 0.00 H new ATOM 228 N THR A 15 9.840 -22.932 -2.552 1.00 0.00 N ATOM 229 CA THR A 15 9.692 -24.382 -2.587 1.00 0.00 C ATOM 230 C THR A 15 9.427 -24.874 -4.005 1.00 0.00 C ATOM 231 O THR A 15 9.292 -26.074 -4.242 1.00 0.00 O ATOM 232 CB THR A 15 8.546 -24.852 -1.671 1.00 0.00 C ATOM 233 OG1 THR A 15 7.484 -23.893 -1.684 1.00 0.00 O ATOM 234 CG2 THR A 15 9.040 -25.050 -0.245 1.00 0.00 C ATOM 0 H THR A 15 8.959 -22.418 -2.572 1.00 0.00 H new ATOM 0 HA THR A 15 10.631 -24.804 -2.228 1.00 0.00 H new ATOM 0 HB THR A 15 8.178 -25.806 -2.047 1.00 0.00 H new ATOM 0 HG1 THR A 15 7.623 -23.242 -0.965 1.00 0.00 H new ATOM 0 HG21 THR A 15 8.214 -25.382 0.384 1.00 0.00 H new ATOM 0 HG22 THR A 15 9.829 -25.802 -0.234 1.00 0.00 H new ATOM 0 HG23 THR A 15 9.432 -24.108 0.138 1.00 0.00 H new ATOM 242 N VAL A 16 9.356 -23.938 -4.947 1.00 0.00 N ATOM 243 CA VAL A 16 9.109 -24.277 -6.344 1.00 0.00 C ATOM 244 C VAL A 16 10.306 -24.996 -6.955 1.00 0.00 C ATOM 245 O VAL A 16 11.457 -24.675 -6.654 1.00 0.00 O ATOM 246 CB VAL A 16 8.797 -23.021 -7.179 1.00 0.00 C ATOM 247 CG1 VAL A 16 10.079 -22.289 -7.542 1.00 0.00 C ATOM 248 CG2 VAL A 16 8.013 -23.394 -8.429 1.00 0.00 C ATOM 0 H VAL A 16 9.466 -22.940 -4.768 1.00 0.00 H new ATOM 0 HA VAL A 16 8.244 -24.940 -6.361 1.00 0.00 H new ATOM 0 HB VAL A 16 8.182 -22.350 -6.579 1.00 0.00 H new ATOM 0 HG11 VAL A 16 9.838 -21.405 -8.132 1.00 0.00 H new ATOM 0 HG12 VAL A 16 10.597 -21.988 -6.631 1.00 0.00 H new ATOM 0 HG13 VAL A 16 10.723 -22.949 -8.124 1.00 0.00 H new ATOM 0 HG21 VAL A 16 7.801 -22.495 -9.007 1.00 0.00 H new ATOM 0 HG22 VAL A 16 8.600 -24.085 -9.034 1.00 0.00 H new ATOM 0 HG23 VAL A 16 7.075 -23.870 -8.142 1.00 0.00 H new ATOM 258 N LYS A 17 10.029 -25.970 -7.815 1.00 0.00 N ATOM 259 CA LYS A 17 11.083 -26.734 -8.471 1.00 0.00 C ATOM 260 C LYS A 17 11.819 -25.878 -9.497 1.00 0.00 C ATOM 261 O LYS A 17 13.028 -25.666 -9.411 1.00 0.00 O ATOM 262 CB LYS A 17 10.494 -27.972 -9.153 1.00 0.00 C ATOM 263 CG LYS A 17 11.067 -29.280 -8.637 1.00 0.00 C ATOM 264 CD LYS A 17 12.436 -29.563 -9.233 1.00 0.00 C ATOM 265 CE LYS A 17 12.998 -30.886 -8.735 1.00 0.00 C ATOM 266 NZ LYS A 17 14.483 -30.932 -8.840 1.00 0.00 N ATOM 0 H LYS A 17 9.083 -26.249 -8.074 1.00 0.00 H new ATOM 0 HA LYS A 17 11.796 -27.050 -7.709 1.00 0.00 H new ATOM 0 HB2 LYS A 17 9.414 -27.976 -9.009 1.00 0.00 H new ATOM 0 HB3 LYS A 17 10.672 -27.905 -10.226 1.00 0.00 H new ATOM 0 HG2 LYS A 17 11.143 -29.241 -7.550 1.00 0.00 H new ATOM 0 HG3 LYS A 17 10.387 -30.097 -8.880 1.00 0.00 H new ATOM 0 HD2 LYS A 17 12.363 -29.584 -10.320 1.00 0.00 H new ATOM 0 HD3 LYS A 17 13.121 -28.755 -8.974 1.00 0.00 H new ATOM 0 HE2 LYS A 17 12.702 -31.039 -7.697 1.00 0.00 H new ATOM 0 HE3 LYS A 17 12.567 -31.704 -9.313 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 14.827 -31.849 -8.491 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 14.765 -30.812 -9.834 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 14.895 -30.167 -8.268 1.00 0.00 H new ATOM 280 N PRO A 18 11.073 -25.371 -10.490 1.00 0.00 N ATOM 281 CA PRO A 18 11.634 -24.528 -11.550 1.00 0.00 C ATOM 282 C PRO A 18 12.057 -23.156 -11.036 1.00 0.00 C ATOM 283 O PRO A 18 12.182 -22.947 -9.830 1.00 0.00 O ATOM 284 CB PRO A 18 10.478 -24.393 -12.545 1.00 0.00 C ATOM 285 CG PRO A 18 9.249 -24.599 -11.728 1.00 0.00 C ATOM 286 CD PRO A 18 9.625 -25.582 -10.655 1.00 0.00 C ATOM 0 HA PRO A 18 12.537 -24.961 -11.981 1.00 0.00 H new ATOM 0 HB2 PRO A 18 10.477 -23.412 -13.021 1.00 0.00 H new ATOM 0 HB3 PRO A 18 10.553 -25.133 -13.341 1.00 0.00 H new ATOM 0 HG2 PRO A 18 8.907 -23.659 -11.294 1.00 0.00 H new ATOM 0 HG3 PRO A 18 8.433 -24.983 -12.340 1.00 0.00 H new ATOM 0 HD2 PRO A 18 9.083 -25.392 -9.728 1.00 0.00 H new ATOM 0 HD3 PRO A 18 9.400 -26.606 -10.952 1.00 0.00 H new ATOM 294 N GLU A 19 12.274 -22.224 -11.959 1.00 0.00 N ATOM 295 CA GLU A 19 12.683 -20.872 -11.597 1.00 0.00 C ATOM 296 C GLU A 19 11.588 -19.864 -11.934 1.00 0.00 C ATOM 297 O GLU A 19 11.857 -18.676 -12.117 1.00 0.00 O ATOM 298 CB GLU A 19 13.978 -20.496 -12.321 1.00 0.00 C ATOM 299 CG GLU A 19 13.967 -20.834 -13.803 1.00 0.00 C ATOM 300 CD GLU A 19 14.367 -22.270 -14.077 1.00 0.00 C ATOM 301 OE1 GLU A 19 15.580 -22.567 -14.038 1.00 0.00 O ATOM 302 OE2 GLU A 19 13.468 -23.099 -14.330 1.00 0.00 O ATOM 0 H GLU A 19 12.173 -22.380 -12.962 1.00 0.00 H new ATOM 0 HA GLU A 19 12.857 -20.848 -10.521 1.00 0.00 H new ATOM 0 HB2 GLU A 19 14.154 -19.427 -12.202 1.00 0.00 H new ATOM 0 HB3 GLU A 19 14.813 -21.011 -11.846 1.00 0.00 H new ATOM 0 HG2 GLU A 19 12.970 -20.656 -14.205 1.00 0.00 H new ATOM 0 HG3 GLU A 19 14.647 -20.165 -14.329 1.00 0.00 H new ATOM 309 N LEU A 20 10.353 -20.346 -12.015 1.00 0.00 N ATOM 310 CA LEU A 20 9.216 -19.488 -12.330 1.00 0.00 C ATOM 311 C LEU A 20 9.106 -18.341 -11.331 1.00 0.00 C ATOM 312 O LEU A 20 8.736 -17.225 -11.693 1.00 0.00 O ATOM 313 CB LEU A 20 7.922 -20.304 -12.333 1.00 0.00 C ATOM 314 CG LEU A 20 7.330 -20.628 -10.961 1.00 0.00 C ATOM 315 CD1 LEU A 20 6.454 -19.484 -10.474 1.00 0.00 C ATOM 316 CD2 LEU A 20 6.536 -21.925 -11.015 1.00 0.00 C ATOM 0 H LEU A 20 10.113 -21.326 -11.867 1.00 0.00 H new ATOM 0 HA LEU A 20 9.374 -19.066 -13.322 1.00 0.00 H new ATOM 0 HB2 LEU A 20 7.174 -19.760 -12.910 1.00 0.00 H new ATOM 0 HB3 LEU A 20 8.108 -21.242 -12.857 1.00 0.00 H new ATOM 0 HG LEU A 20 8.150 -20.757 -10.254 1.00 0.00 H new ATOM 0 HD11 LEU A 20 6.041 -19.732 -9.496 1.00 0.00 H new ATOM 0 HD12 LEU A 20 7.052 -18.576 -10.395 1.00 0.00 H new ATOM 0 HD13 LEU A 20 5.640 -19.323 -11.181 1.00 0.00 H new ATOM 0 HD21 LEU A 20 6.122 -22.140 -10.030 1.00 0.00 H new ATOM 0 HD22 LEU A 20 5.724 -21.825 -11.736 1.00 0.00 H new ATOM 0 HD23 LEU A 20 7.192 -22.741 -11.318 1.00 0.00 H new ATOM 328 N GLN A 21 9.431 -18.625 -10.074 1.00 0.00 N ATOM 329 CA GLN A 21 9.370 -17.616 -9.023 1.00 0.00 C ATOM 330 C GLN A 21 10.138 -16.362 -9.427 1.00 0.00 C ATOM 331 O GLN A 21 9.803 -15.254 -9.008 1.00 0.00 O ATOM 332 CB GLN A 21 9.935 -18.175 -7.716 1.00 0.00 C ATOM 333 CG GLN A 21 11.404 -18.556 -7.802 1.00 0.00 C ATOM 334 CD GLN A 21 12.325 -17.422 -7.395 1.00 0.00 C ATOM 335 OE1 GLN A 21 11.889 -16.436 -6.800 1.00 0.00 O ATOM 336 NE2 GLN A 21 13.607 -17.557 -7.713 1.00 0.00 N ATOM 0 H GLN A 21 9.739 -19.545 -9.759 1.00 0.00 H new ATOM 0 HA GLN A 21 8.324 -17.347 -8.873 1.00 0.00 H new ATOM 0 HB2 GLN A 21 9.806 -17.433 -6.928 1.00 0.00 H new ATOM 0 HB3 GLN A 21 9.357 -19.052 -7.426 1.00 0.00 H new ATOM 0 HG2 GLN A 21 11.590 -19.418 -7.161 1.00 0.00 H new ATOM 0 HG3 GLN A 21 11.638 -18.861 -8.822 1.00 0.00 H new ATOM 0 HE21 GLN A 21 13.925 -18.391 -8.206 1.00 0.00 H new ATOM 0 HE22 GLN A 21 14.274 -16.827 -7.464 1.00 0.00 H new ATOM 345 N LYS A 22 11.170 -16.544 -10.244 1.00 0.00 N ATOM 346 CA LYS A 22 11.987 -15.427 -10.706 1.00 0.00 C ATOM 347 C LYS A 22 11.124 -14.364 -11.377 1.00 0.00 C ATOM 348 O LYS A 22 11.138 -13.198 -10.982 1.00 0.00 O ATOM 349 CB LYS A 22 13.057 -15.921 -11.682 1.00 0.00 C ATOM 350 CG LYS A 22 14.128 -16.778 -11.028 1.00 0.00 C ATOM 351 CD LYS A 22 15.457 -16.659 -11.753 1.00 0.00 C ATOM 352 CE LYS A 22 16.298 -15.522 -11.192 1.00 0.00 C ATOM 353 NZ LYS A 22 15.947 -14.214 -11.813 1.00 0.00 N ATOM 0 H LYS A 22 11.461 -17.454 -10.600 1.00 0.00 H new ATOM 0 HA LYS A 22 12.473 -14.981 -9.838 1.00 0.00 H new ATOM 0 HB2 LYS A 22 12.577 -16.496 -12.474 1.00 0.00 H new ATOM 0 HB3 LYS A 22 13.531 -15.061 -12.155 1.00 0.00 H new ATOM 0 HG2 LYS A 22 14.252 -16.476 -9.988 1.00 0.00 H new ATOM 0 HG3 LYS A 22 13.808 -17.820 -11.022 1.00 0.00 H new ATOM 0 HD2 LYS A 22 16.006 -17.597 -11.665 1.00 0.00 H new ATOM 0 HD3 LYS A 22 15.279 -16.492 -12.815 1.00 0.00 H new ATOM 0 HE2 LYS A 22 16.154 -15.462 -10.113 1.00 0.00 H new ATOM 0 HE3 LYS A 22 17.354 -15.733 -11.362 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 16.744 -13.554 -11.706 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 15.745 -14.353 -12.824 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 15.107 -13.821 -11.343 1.00 0.00 H new ATOM 367 N VAL A 23 10.372 -14.773 -12.394 1.00 0.00 N ATOM 368 CA VAL A 23 9.501 -13.856 -13.119 1.00 0.00 C ATOM 369 C VAL A 23 8.504 -13.187 -12.179 1.00 0.00 C ATOM 370 O VAL A 23 8.215 -11.998 -12.308 1.00 0.00 O ATOM 371 CB VAL A 23 8.728 -14.580 -14.237 1.00 0.00 C ATOM 372 CG1 VAL A 23 7.473 -13.806 -14.608 1.00 0.00 C ATOM 373 CG2 VAL A 23 9.619 -14.783 -15.454 1.00 0.00 C ATOM 0 H VAL A 23 10.349 -15.734 -12.734 1.00 0.00 H new ATOM 0 HA VAL A 23 10.143 -13.096 -13.565 1.00 0.00 H new ATOM 0 HB VAL A 23 8.424 -15.560 -13.869 1.00 0.00 H new ATOM 0 HG11 VAL A 23 6.941 -14.334 -15.399 1.00 0.00 H new ATOM 0 HG12 VAL A 23 6.828 -13.718 -13.734 1.00 0.00 H new ATOM 0 HG13 VAL A 23 7.749 -12.811 -14.957 1.00 0.00 H new ATOM 0 HG21 VAL A 23 9.057 -15.296 -16.235 1.00 0.00 H new ATOM 0 HG22 VAL A 23 9.954 -13.815 -15.825 1.00 0.00 H new ATOM 0 HG23 VAL A 23 10.484 -15.384 -15.175 1.00 0.00 H new ATOM 383 N ALA A 24 7.981 -13.960 -11.232 1.00 0.00 N ATOM 384 CA ALA A 24 7.018 -13.442 -10.268 1.00 0.00 C ATOM 385 C ALA A 24 7.616 -12.298 -9.456 1.00 0.00 C ATOM 386 O ALA A 24 7.023 -11.224 -9.350 1.00 0.00 O ATOM 387 CB ALA A 24 6.544 -14.555 -9.346 1.00 0.00 C ATOM 0 H ALA A 24 8.208 -14.947 -11.112 1.00 0.00 H new ATOM 0 HA ALA A 24 6.162 -13.053 -10.819 1.00 0.00 H new ATOM 0 HB1 ALA A 24 5.825 -14.154 -8.631 1.00 0.00 H new ATOM 0 HB2 ALA A 24 6.070 -15.339 -9.936 1.00 0.00 H new ATOM 0 HB3 ALA A 24 7.397 -14.970 -8.809 1.00 0.00 H new ATOM 393 N ARG A 25 8.791 -12.536 -8.884 1.00 0.00 N ATOM 394 CA ARG A 25 9.467 -11.525 -8.079 1.00 0.00 C ATOM 395 C ARG A 25 9.724 -10.262 -8.896 1.00 0.00 C ATOM 396 O ARG A 25 9.319 -9.167 -8.507 1.00 0.00 O ATOM 397 CB ARG A 25 10.789 -12.074 -7.539 1.00 0.00 C ATOM 398 CG ARG A 25 11.459 -11.160 -6.525 1.00 0.00 C ATOM 399 CD ARG A 25 12.704 -11.803 -5.933 1.00 0.00 C ATOM 400 NE ARG A 25 13.758 -11.974 -6.930 1.00 0.00 N ATOM 401 CZ ARG A 25 14.572 -10.997 -7.313 1.00 0.00 C ATOM 402 NH1 ARG A 25 14.455 -9.786 -6.786 1.00 0.00 N ATOM 403 NH2 ARG A 25 15.507 -11.230 -8.225 1.00 0.00 N ATOM 0 H ARG A 25 9.295 -13.419 -8.963 1.00 0.00 H new ATOM 0 HA ARG A 25 8.818 -11.269 -7.241 1.00 0.00 H new ATOM 0 HB2 ARG A 25 10.608 -13.045 -7.077 1.00 0.00 H new ATOM 0 HB3 ARG A 25 11.471 -12.240 -8.373 1.00 0.00 H new ATOM 0 HG2 ARG A 25 11.727 -10.218 -7.004 1.00 0.00 H new ATOM 0 HG3 ARG A 25 10.756 -10.923 -5.727 1.00 0.00 H new ATOM 0 HD2 ARG A 25 13.076 -11.187 -5.114 1.00 0.00 H new ATOM 0 HD3 ARG A 25 12.445 -12.773 -5.510 1.00 0.00 H new ATOM 0 HE ARG A 25 13.875 -12.894 -7.355 1.00 0.00 H new ATOM 0 HH11 ARG A 25 13.738 -9.602 -6.084 1.00 0.00 H new ATOM 0 HH12 ARG A 25 15.082 -9.038 -7.083 1.00 0.00 H new ATOM 0 HH21 ARG A 25 15.601 -12.160 -8.633 1.00 0.00 H new ATOM 0 HH22 ARG A 25 16.132 -10.479 -8.518 1.00 0.00 H new ATOM 417 N ARG A 26 10.400 -10.424 -10.029 1.00 0.00 N ATOM 418 CA ARG A 26 10.713 -9.297 -10.899 1.00 0.00 C ATOM 419 C ARG A 26 9.438 -8.593 -11.356 1.00 0.00 C ATOM 420 O ARG A 26 9.372 -7.364 -11.385 1.00 0.00 O ATOM 421 CB ARG A 26 11.511 -9.770 -12.115 1.00 0.00 C ATOM 422 CG ARG A 26 12.064 -8.634 -12.960 1.00 0.00 C ATOM 423 CD ARG A 26 13.562 -8.782 -13.180 1.00 0.00 C ATOM 424 NE ARG A 26 14.260 -7.505 -13.069 1.00 0.00 N ATOM 425 CZ ARG A 26 14.610 -6.956 -11.911 1.00 0.00 C ATOM 426 NH1 ARG A 26 14.328 -7.570 -10.771 1.00 0.00 N ATOM 427 NH2 ARG A 26 15.244 -5.790 -11.893 1.00 0.00 N ATOM 0 H ARG A 26 10.741 -11.324 -10.366 1.00 0.00 H new ATOM 0 HA ARG A 26 11.316 -8.588 -10.331 1.00 0.00 H new ATOM 0 HB2 ARG A 26 12.337 -10.395 -11.776 1.00 0.00 H new ATOM 0 HB3 ARG A 26 10.872 -10.397 -12.737 1.00 0.00 H new ATOM 0 HG2 ARG A 26 11.554 -8.614 -13.923 1.00 0.00 H new ATOM 0 HG3 ARG A 26 11.859 -7.682 -12.471 1.00 0.00 H new ATOM 0 HD2 ARG A 26 13.968 -9.482 -12.450 1.00 0.00 H new ATOM 0 HD3 ARG A 26 13.743 -9.210 -14.166 1.00 0.00 H new ATOM 0 HE ARG A 26 14.492 -7.006 -13.928 1.00 0.00 H new ATOM 0 HH11 ARG A 26 13.841 -8.466 -10.781 1.00 0.00 H new ATOM 0 HH12 ARG A 26 14.598 -7.146 -9.883 1.00 0.00 H new ATOM 0 HH21 ARG A 26 15.463 -5.315 -12.769 1.00 0.00 H new ATOM 0 HH22 ARG A 26 15.512 -5.369 -11.003 1.00 0.00 H new ATOM 441 N ALA A 27 8.429 -9.380 -11.712 1.00 0.00 N ATOM 442 CA ALA A 27 7.156 -8.833 -12.166 1.00 0.00 C ATOM 443 C ALA A 27 6.561 -7.892 -11.125 1.00 0.00 C ATOM 444 O ALA A 27 6.003 -6.847 -11.464 1.00 0.00 O ATOM 445 CB ALA A 27 6.181 -9.958 -12.483 1.00 0.00 C ATOM 0 H ALA A 27 8.468 -10.399 -11.695 1.00 0.00 H new ATOM 0 HA ALA A 27 7.338 -8.259 -13.074 1.00 0.00 H new ATOM 0 HB1 ALA A 27 5.235 -9.535 -12.821 1.00 0.00 H new ATOM 0 HB2 ALA A 27 6.597 -10.590 -13.268 1.00 0.00 H new ATOM 0 HB3 ALA A 27 6.012 -10.556 -11.588 1.00 0.00 H new ATOM 451 N LEU A 28 6.682 -8.268 -9.857 1.00 0.00 N ATOM 452 CA LEU A 28 6.155 -7.457 -8.765 1.00 0.00 C ATOM 453 C LEU A 28 6.594 -6.003 -8.905 1.00 0.00 C ATOM 454 O LEU A 28 5.830 -5.083 -8.613 1.00 0.00 O ATOM 455 CB LEU A 28 6.620 -8.015 -7.418 1.00 0.00 C ATOM 456 CG LEU A 28 5.618 -7.912 -6.267 1.00 0.00 C ATOM 457 CD1 LEU A 28 5.032 -9.278 -5.946 1.00 0.00 C ATOM 458 CD2 LEU A 28 6.281 -7.311 -5.036 1.00 0.00 C ATOM 0 H LEU A 28 7.140 -9.129 -9.559 1.00 0.00 H new ATOM 0 HA LEU A 28 5.067 -7.494 -8.810 1.00 0.00 H new ATOM 0 HB2 LEU A 28 6.881 -9.065 -7.553 1.00 0.00 H new ATOM 0 HB3 LEU A 28 7.532 -7.494 -7.127 1.00 0.00 H new ATOM 0 HG LEU A 28 4.805 -7.254 -6.575 1.00 0.00 H new ATOM 0 HD11 LEU A 28 4.321 -9.185 -5.125 1.00 0.00 H new ATOM 0 HD12 LEU A 28 4.521 -9.671 -6.825 1.00 0.00 H new ATOM 0 HD13 LEU A 28 5.833 -9.959 -5.658 1.00 0.00 H new ATOM 0 HD21 LEU A 28 5.554 -7.245 -4.227 1.00 0.00 H new ATOM 0 HD22 LEU A 28 7.113 -7.943 -4.726 1.00 0.00 H new ATOM 0 HD23 LEU A 28 6.652 -6.314 -5.273 1.00 0.00 H new ATOM 470 N GLU A 29 7.829 -5.804 -9.355 1.00 0.00 N ATOM 471 CA GLU A 29 8.368 -4.461 -9.535 1.00 0.00 C ATOM 472 C GLU A 29 8.093 -3.949 -10.946 1.00 0.00 C ATOM 473 O GLU A 29 7.707 -2.795 -11.136 1.00 0.00 O ATOM 474 CB GLU A 29 9.874 -4.452 -9.262 1.00 0.00 C ATOM 475 CG GLU A 29 10.276 -5.262 -8.041 1.00 0.00 C ATOM 476 CD GLU A 29 11.220 -4.507 -7.125 1.00 0.00 C ATOM 477 OE1 GLU A 29 12.228 -3.967 -7.626 1.00 0.00 O ATOM 478 OE2 GLU A 29 10.949 -4.458 -5.907 1.00 0.00 O ATOM 0 H GLU A 29 8.474 -6.555 -9.601 1.00 0.00 H new ATOM 0 HA GLU A 29 7.873 -3.800 -8.824 1.00 0.00 H new ATOM 0 HB2 GLU A 29 10.395 -4.844 -10.135 1.00 0.00 H new ATOM 0 HB3 GLU A 29 10.205 -3.422 -9.129 1.00 0.00 H new ATOM 0 HG2 GLU A 29 9.381 -5.541 -7.484 1.00 0.00 H new ATOM 0 HG3 GLU A 29 10.752 -6.188 -8.364 1.00 0.00 H new ATOM 485 N LEU A 30 8.295 -4.815 -11.933 1.00 0.00 N ATOM 486 CA LEU A 30 8.069 -4.451 -13.328 1.00 0.00 C ATOM 487 C LEU A 30 6.655 -3.917 -13.529 1.00 0.00 C ATOM 488 O LEU A 30 6.466 -2.796 -14.003 1.00 0.00 O ATOM 489 CB LEU A 30 8.304 -5.661 -14.235 1.00 0.00 C ATOM 490 CG LEU A 30 9.750 -6.142 -14.351 1.00 0.00 C ATOM 491 CD1 LEU A 30 9.851 -7.299 -15.333 1.00 0.00 C ATOM 492 CD2 LEU A 30 10.660 -4.999 -14.777 1.00 0.00 C ATOM 0 H LEU A 30 8.615 -5.774 -11.794 1.00 0.00 H new ATOM 0 HA LEU A 30 8.775 -3.664 -13.592 1.00 0.00 H new ATOM 0 HB2 LEU A 30 7.695 -6.488 -13.869 1.00 0.00 H new ATOM 0 HB3 LEU A 30 7.942 -5.417 -15.234 1.00 0.00 H new ATOM 0 HG LEU A 30 10.075 -6.494 -13.372 1.00 0.00 H new ATOM 0 HD11 LEU A 30 10.888 -7.628 -15.402 1.00 0.00 H new ATOM 0 HD12 LEU A 30 9.231 -8.125 -14.987 1.00 0.00 H new ATOM 0 HD13 LEU A 30 9.507 -6.974 -16.315 1.00 0.00 H new ATOM 0 HD21 LEU A 30 11.686 -5.360 -14.854 1.00 0.00 H new ATOM 0 HD22 LEU A 30 10.336 -4.617 -15.745 1.00 0.00 H new ATOM 0 HD23 LEU A 30 10.611 -4.200 -14.037 1.00 0.00 H new ATOM 504 N SER A 31 5.665 -4.725 -13.165 1.00 0.00 N ATOM 505 CA SER A 31 4.267 -4.334 -13.307 1.00 0.00 C ATOM 506 C SER A 31 4.002 -3.003 -12.611 1.00 0.00 C ATOM 507 O SER A 31 4.730 -2.589 -11.708 1.00 0.00 O ATOM 508 CB SER A 31 3.352 -5.416 -12.730 1.00 0.00 C ATOM 509 OG SER A 31 2.332 -4.846 -11.927 1.00 0.00 O ATOM 0 H SER A 31 5.805 -5.655 -12.769 1.00 0.00 H new ATOM 0 HA SER A 31 4.054 -4.217 -14.370 1.00 0.00 H new ATOM 0 HB2 SER A 31 2.903 -5.988 -13.542 1.00 0.00 H new ATOM 0 HB3 SER A 31 3.940 -6.115 -12.135 1.00 0.00 H new ATOM 0 HG SER A 31 2.313 -5.294 -11.056 1.00 0.00 H new ATOM 515 N PRO A 32 2.934 -2.314 -13.040 1.00 0.00 N ATOM 516 CA PRO A 32 2.546 -1.019 -12.472 1.00 0.00 C ATOM 517 C PRO A 32 2.015 -1.146 -11.049 1.00 0.00 C ATOM 518 O PRO A 32 2.433 -0.414 -10.152 1.00 0.00 O ATOM 519 CB PRO A 32 1.441 -0.535 -13.414 1.00 0.00 C ATOM 520 CG PRO A 32 0.875 -1.780 -14.005 1.00 0.00 C ATOM 521 CD PRO A 32 2.022 -2.747 -14.112 1.00 0.00 C ATOM 0 HA PRO A 32 3.392 -0.336 -12.399 1.00 0.00 H new ATOM 0 HB2 PRO A 32 0.680 0.029 -12.875 1.00 0.00 H new ATOM 0 HB3 PRO A 32 1.839 0.124 -14.186 1.00 0.00 H new ATOM 0 HG2 PRO A 32 0.081 -2.184 -13.377 1.00 0.00 H new ATOM 0 HG3 PRO A 32 0.438 -1.583 -14.984 1.00 0.00 H new ATOM 0 HD2 PRO A 32 1.694 -3.777 -13.969 1.00 0.00 H new ATOM 0 HD3 PRO A 32 2.500 -2.697 -15.091 1.00 0.00 H new ATOM 529 N TYR A 33 1.092 -2.080 -10.848 1.00 0.00 N ATOM 530 CA TYR A 33 0.502 -2.302 -9.533 1.00 0.00 C ATOM 531 C TYR A 33 1.008 -3.605 -8.921 1.00 0.00 C ATOM 532 O TYR A 33 0.878 -4.675 -9.516 1.00 0.00 O ATOM 533 CB TYR A 33 -1.024 -2.332 -9.634 1.00 0.00 C ATOM 534 CG TYR A 33 -1.561 -1.667 -10.881 1.00 0.00 C ATOM 535 CD1 TYR A 33 -1.572 -0.283 -11.005 1.00 0.00 C ATOM 536 CD2 TYR A 33 -2.059 -2.423 -11.936 1.00 0.00 C ATOM 537 CE1 TYR A 33 -2.063 0.329 -12.142 1.00 0.00 C ATOM 538 CE2 TYR A 33 -2.550 -1.820 -13.077 1.00 0.00 C ATOM 539 CZ TYR A 33 -2.550 -0.444 -13.176 1.00 0.00 C ATOM 540 OH TYR A 33 -3.040 0.161 -14.311 1.00 0.00 O ATOM 0 H TYR A 33 0.736 -2.696 -11.579 1.00 0.00 H new ATOM 0 HA TYR A 33 0.801 -1.478 -8.885 1.00 0.00 H new ATOM 0 HB2 TYR A 33 -1.361 -3.368 -9.611 1.00 0.00 H new ATOM 0 HB3 TYR A 33 -1.448 -1.840 -8.759 1.00 0.00 H new ATOM 0 HD1 TYR A 33 -1.190 0.325 -10.198 1.00 0.00 H new ATOM 0 HD2 TYR A 33 -2.062 -3.500 -11.862 1.00 0.00 H new ATOM 0 HE1 TYR A 33 -2.066 1.406 -12.221 1.00 0.00 H new ATOM 0 HE2 TYR A 33 -2.932 -2.422 -13.888 1.00 0.00 H new ATOM 0 HH TYR A 33 -3.343 -0.525 -14.942 1.00 0.00 H new ATOM 550 N ASP A 34 1.586 -3.505 -7.729 1.00 0.00 N ATOM 551 CA ASP A 34 2.111 -4.675 -7.034 1.00 0.00 C ATOM 552 C ASP A 34 1.062 -5.780 -6.961 1.00 0.00 C ATOM 553 O ASP A 34 -0.112 -5.556 -7.256 1.00 0.00 O ATOM 554 CB ASP A 34 2.569 -4.294 -5.625 1.00 0.00 C ATOM 555 CG ASP A 34 1.643 -3.289 -4.967 1.00 0.00 C ATOM 556 OD1 ASP A 34 1.633 -2.119 -5.403 1.00 0.00 O ATOM 557 OD2 ASP A 34 0.929 -3.674 -4.018 1.00 0.00 O ATOM 0 H ASP A 34 1.703 -2.627 -7.224 1.00 0.00 H new ATOM 0 HA ASP A 34 2.966 -5.049 -7.597 1.00 0.00 H new ATOM 0 HB2 ASP A 34 2.623 -5.191 -5.009 1.00 0.00 H new ATOM 0 HB3 ASP A 34 3.576 -3.879 -5.673 1.00 0.00 H new ATOM 562 N PHE A 35 1.493 -6.973 -6.566 1.00 0.00 N ATOM 563 CA PHE A 35 0.591 -8.114 -6.456 1.00 0.00 C ATOM 564 C PHE A 35 0.993 -9.014 -5.291 1.00 0.00 C ATOM 565 O PHE A 35 2.179 -9.235 -5.041 1.00 0.00 O ATOM 566 CB PHE A 35 0.589 -8.917 -7.758 1.00 0.00 C ATOM 567 CG PHE A 35 1.816 -9.764 -7.942 1.00 0.00 C ATOM 568 CD1 PHE A 35 1.920 -10.999 -7.321 1.00 0.00 C ATOM 569 CD2 PHE A 35 2.864 -9.327 -8.735 1.00 0.00 C ATOM 570 CE1 PHE A 35 3.047 -11.781 -7.488 1.00 0.00 C ATOM 571 CE2 PHE A 35 3.994 -10.104 -8.906 1.00 0.00 C ATOM 572 CZ PHE A 35 4.085 -11.333 -8.282 1.00 0.00 C ATOM 0 H PHE A 35 2.461 -7.175 -6.317 1.00 0.00 H new ATOM 0 HA PHE A 35 -0.414 -7.735 -6.270 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -0.292 -9.559 -7.778 1.00 0.00 H new ATOM 0 HB3 PHE A 35 0.502 -8.230 -8.599 1.00 0.00 H new ATOM 0 HD1 PHE A 35 1.111 -11.354 -6.700 1.00 0.00 H new ATOM 0 HD2 PHE A 35 2.797 -8.367 -9.226 1.00 0.00 H new ATOM 0 HE1 PHE A 35 3.116 -12.741 -6.998 1.00 0.00 H new ATOM 0 HE2 PHE A 35 4.804 -9.751 -9.526 1.00 0.00 H new ATOM 0 HZ PHE A 35 4.966 -11.943 -8.415 1.00 0.00 H new ATOM 582 N THR A 36 -0.004 -9.530 -4.579 1.00 0.00 N ATOM 583 CA THR A 36 0.244 -10.404 -3.439 1.00 0.00 C ATOM 584 C THR A 36 0.089 -11.871 -3.827 1.00 0.00 C ATOM 585 O THR A 36 -0.945 -12.276 -4.358 1.00 0.00 O ATOM 586 CB THR A 36 -0.712 -10.090 -2.272 1.00 0.00 C ATOM 587 OG1 THR A 36 -0.436 -10.958 -1.167 1.00 0.00 O ATOM 588 CG2 THR A 36 -2.162 -10.252 -2.702 1.00 0.00 C ATOM 0 H THR A 36 -0.991 -9.358 -4.772 1.00 0.00 H new ATOM 0 HA THR A 36 1.270 -10.222 -3.118 1.00 0.00 H new ATOM 0 HB THR A 36 -0.554 -9.055 -1.969 1.00 0.00 H new ATOM 0 HG1 THR A 36 -0.142 -10.426 -0.399 1.00 0.00 H new ATOM 0 HG21 THR A 36 -2.818 -10.025 -1.862 1.00 0.00 H new ATOM 0 HG22 THR A 36 -2.376 -9.569 -3.524 1.00 0.00 H new ATOM 0 HG23 THR A 36 -2.332 -11.278 -3.029 1.00 0.00 H new ATOM 596 N ILE A 37 1.122 -12.661 -3.558 1.00 0.00 N ATOM 597 CA ILE A 37 1.100 -14.083 -3.877 1.00 0.00 C ATOM 598 C ILE A 37 0.012 -14.806 -3.090 1.00 0.00 C ATOM 599 O ILE A 37 -0.198 -14.535 -1.908 1.00 0.00 O ATOM 600 CB ILE A 37 2.457 -14.748 -3.584 1.00 0.00 C ATOM 601 CG1 ILE A 37 3.477 -14.373 -4.661 1.00 0.00 C ATOM 602 CG2 ILE A 37 2.300 -16.259 -3.499 1.00 0.00 C ATOM 603 CD1 ILE A 37 3.274 -15.108 -5.967 1.00 0.00 C ATOM 0 H ILE A 37 1.985 -12.340 -3.120 1.00 0.00 H new ATOM 0 HA ILE A 37 0.889 -14.163 -4.943 1.00 0.00 H new ATOM 0 HB ILE A 37 2.822 -14.386 -2.623 1.00 0.00 H new ATOM 0 HG12 ILE A 37 3.421 -13.300 -4.845 1.00 0.00 H new ATOM 0 HG13 ILE A 37 4.480 -14.581 -4.288 1.00 0.00 H new ATOM 0 HG21 ILE A 37 3.268 -16.714 -3.291 1.00 0.00 H new ATOM 0 HG22 ILE A 37 1.603 -16.508 -2.699 1.00 0.00 H new ATOM 0 HG23 ILE A 37 1.916 -16.639 -4.446 1.00 0.00 H new ATOM 0 HD11 ILE A 37 4.032 -14.793 -6.684 1.00 0.00 H new ATOM 0 HD12 ILE A 37 3.359 -16.181 -5.797 1.00 0.00 H new ATOM 0 HD13 ILE A 37 2.284 -14.880 -6.363 1.00 0.00 H new ATOM 615 N VAL A 38 -0.678 -15.728 -3.754 1.00 0.00 N ATOM 616 CA VAL A 38 -1.742 -16.493 -3.117 1.00 0.00 C ATOM 617 C VAL A 38 -1.303 -17.928 -2.848 1.00 0.00 C ATOM 618 O VAL A 38 -1.540 -18.468 -1.768 1.00 0.00 O ATOM 619 CB VAL A 38 -3.016 -16.512 -3.982 1.00 0.00 C ATOM 620 CG1 VAL A 38 -4.112 -17.319 -3.303 1.00 0.00 C ATOM 621 CG2 VAL A 38 -3.486 -15.093 -4.268 1.00 0.00 C ATOM 0 H VAL A 38 -0.518 -15.963 -4.734 1.00 0.00 H new ATOM 0 HA VAL A 38 -1.962 -16.000 -2.170 1.00 0.00 H new ATOM 0 HB VAL A 38 -2.782 -16.992 -4.932 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -5.004 -17.321 -3.930 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -3.771 -18.344 -3.155 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -4.348 -16.872 -2.337 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -4.387 -15.125 -4.880 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -3.703 -14.585 -3.328 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -2.704 -14.551 -4.801 1.00 0.00 H new ATOM 631 N GLN A 39 -0.662 -18.540 -3.838 1.00 0.00 N ATOM 632 CA GLN A 39 -0.189 -19.913 -3.708 1.00 0.00 C ATOM 633 C GLN A 39 1.006 -20.167 -4.621 1.00 0.00 C ATOM 634 O GLN A 39 1.135 -19.549 -5.677 1.00 0.00 O ATOM 635 CB GLN A 39 -1.314 -20.896 -4.038 1.00 0.00 C ATOM 636 CG GLN A 39 -0.984 -22.338 -3.691 1.00 0.00 C ATOM 637 CD GLN A 39 -2.054 -23.309 -4.150 1.00 0.00 C ATOM 638 OE1 GLN A 39 -3.223 -22.945 -4.282 1.00 0.00 O ATOM 639 NE2 GLN A 39 -1.660 -24.553 -4.396 1.00 0.00 N ATOM 0 H GLN A 39 -0.458 -18.107 -4.739 1.00 0.00 H new ATOM 0 HA GLN A 39 0.127 -20.065 -2.676 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -2.214 -20.599 -3.500 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -1.542 -20.830 -5.102 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -0.033 -22.609 -4.149 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -0.856 -22.428 -2.612 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -0.681 -24.812 -4.273 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -2.336 -25.250 -4.708 1.00 0.00 H new ATOM 648 N GLY A 40 1.879 -21.080 -4.206 1.00 0.00 N ATOM 649 CA GLY A 40 3.053 -21.398 -4.998 1.00 0.00 C ATOM 650 C GLY A 40 3.310 -22.890 -5.080 1.00 0.00 C ATOM 651 O GLY A 40 3.340 -23.462 -6.170 1.00 0.00 O ATOM 0 H GLY A 40 1.794 -21.605 -3.336 1.00 0.00 H new ATOM 0 HA2 GLY A 40 2.928 -20.998 -6.004 1.00 0.00 H new ATOM 0 HA3 GLY A 40 3.924 -20.906 -4.565 1.00 0.00 H new ATOM 655 N ILE A 41 3.497 -23.521 -3.926 1.00 0.00 N ATOM 656 CA ILE A 41 3.754 -24.954 -3.872 1.00 0.00 C ATOM 657 C ILE A 41 2.882 -25.630 -2.820 1.00 0.00 C ATOM 658 O ILE A 41 2.612 -25.059 -1.763 1.00 0.00 O ATOM 659 CB ILE A 41 5.233 -25.251 -3.564 1.00 0.00 C ATOM 660 CG1 ILE A 41 5.950 -25.743 -4.823 1.00 0.00 C ATOM 661 CG2 ILE A 41 5.346 -26.277 -2.447 1.00 0.00 C ATOM 662 CD1 ILE A 41 5.439 -27.074 -5.327 1.00 0.00 C ATOM 0 H ILE A 41 3.475 -23.062 -3.015 1.00 0.00 H new ATOM 0 HA ILE A 41 3.509 -25.355 -4.856 1.00 0.00 H new ATOM 0 HB ILE A 41 5.712 -24.330 -3.233 1.00 0.00 H new ATOM 0 HG12 ILE A 41 5.837 -24.998 -5.610 1.00 0.00 H new ATOM 0 HG13 ILE A 41 7.017 -25.828 -4.615 1.00 0.00 H new ATOM 0 HG21 ILE A 41 6.398 -26.476 -2.241 1.00 0.00 H new ATOM 0 HG22 ILE A 41 4.867 -25.890 -1.548 1.00 0.00 H new ATOM 0 HG23 ILE A 41 4.854 -27.201 -2.751 1.00 0.00 H new ATOM 0 HD11 ILE A 41 5.992 -27.361 -6.221 1.00 0.00 H new ATOM 0 HD12 ILE A 41 5.577 -27.832 -4.556 1.00 0.00 H new ATOM 0 HD13 ILE A 41 4.379 -26.989 -5.567 1.00 0.00 H new ATOM 674 N ARG A 42 2.444 -26.850 -3.115 1.00 0.00 N ATOM 675 CA ARG A 42 1.603 -27.604 -2.194 1.00 0.00 C ATOM 676 C ARG A 42 2.450 -28.493 -1.288 1.00 0.00 C ATOM 677 O ARG A 42 3.537 -28.930 -1.669 1.00 0.00 O ATOM 678 CB ARG A 42 0.599 -28.458 -2.970 1.00 0.00 C ATOM 679 CG ARG A 42 -0.582 -27.668 -3.511 1.00 0.00 C ATOM 680 CD ARG A 42 -1.899 -28.378 -3.239 1.00 0.00 C ATOM 681 NE ARG A 42 -2.978 -27.437 -2.949 1.00 0.00 N ATOM 682 CZ ARG A 42 -4.267 -27.743 -3.052 1.00 0.00 C ATOM 683 NH1 ARG A 42 -4.635 -28.958 -3.436 1.00 0.00 N ATOM 684 NH2 ARG A 42 -5.190 -26.833 -2.771 1.00 0.00 N ATOM 0 H ARG A 42 2.658 -27.337 -3.985 1.00 0.00 H new ATOM 0 HA ARG A 42 1.060 -26.893 -1.572 1.00 0.00 H new ATOM 0 HB2 ARG A 42 1.112 -28.943 -3.801 1.00 0.00 H new ATOM 0 HB3 ARG A 42 0.228 -29.250 -2.319 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -0.600 -26.679 -3.054 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -0.462 -27.521 -4.584 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -2.169 -28.984 -4.104 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -1.776 -29.060 -2.397 1.00 0.00 H new ATOM 0 HE ARG A 42 -2.728 -26.494 -2.651 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -3.928 -29.660 -3.653 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -5.625 -29.190 -3.514 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -4.911 -25.898 -2.476 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -6.179 -27.069 -2.850 1.00 0.00 H new ATOM 1035 N HIS A 66 0.301 -26.636 -9.359 1.00 0.00 N ATOM 1036 CA HIS A 66 0.933 -26.449 -8.058 1.00 0.00 C ATOM 1037 C HIS A 66 1.560 -27.750 -7.566 1.00 0.00 C ATOM 1038 O HIS A 66 2.609 -27.740 -6.922 1.00 0.00 O ATOM 1039 CB HIS A 66 -0.089 -25.945 -7.039 1.00 0.00 C ATOM 1040 CG HIS A 66 -0.460 -24.505 -7.224 1.00 0.00 C ATOM 1041 ND1 HIS A 66 0.130 -23.479 -6.516 1.00 0.00 N ATOM 1042 CD2 HIS A 66 -1.365 -23.923 -8.044 1.00 0.00 C ATOM 1043 CE1 HIS A 66 -0.398 -22.328 -6.892 1.00 0.00 C ATOM 1044 NE2 HIS A 66 -1.307 -22.569 -7.819 1.00 0.00 N ATOM 0 HA HIS A 66 1.722 -25.705 -8.169 1.00 0.00 H new ATOM 0 HB2 HIS A 66 -0.990 -26.555 -7.108 1.00 0.00 H new ATOM 0 HB3 HIS A 66 0.313 -26.082 -6.035 1.00 0.00 H new ATOM 0 HD1 HIS A 66 0.860 -23.591 -5.812 1.00 0.00 H new ATOM 0 HD2 HIS A 66 -2.013 -24.429 -8.745 1.00 0.00 H new ATOM 0 HE1 HIS A 66 -0.131 -21.355 -6.507 1.00 0.00 H new ATOM 1052 N ILE A 67 0.909 -28.867 -7.873 1.00 0.00 N ATOM 1053 CA ILE A 67 1.403 -30.176 -7.463 1.00 0.00 C ATOM 1054 C ILE A 67 2.787 -30.448 -8.043 1.00 0.00 C ATOM 1055 O ILE A 67 3.649 -31.024 -7.380 1.00 0.00 O ATOM 1056 CB ILE A 67 0.446 -31.301 -7.898 1.00 0.00 C ATOM 1057 CG1 ILE A 67 -1.007 -30.881 -7.668 1.00 0.00 C ATOM 1058 CG2 ILE A 67 0.758 -32.584 -7.141 1.00 0.00 C ATOM 1059 CD1 ILE A 67 -1.241 -30.224 -6.326 1.00 0.00 C ATOM 0 H ILE A 67 0.039 -28.892 -8.404 1.00 0.00 H new ATOM 0 HA ILE A 67 1.464 -30.163 -6.375 1.00 0.00 H new ATOM 0 HB ILE A 67 0.587 -31.487 -8.963 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -1.307 -30.192 -8.458 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -1.648 -31.759 -7.750 1.00 0.00 H new ATOM 0 HG21 ILE A 67 0.073 -33.370 -7.459 1.00 0.00 H new ATOM 0 HG22 ILE A 67 1.783 -32.889 -7.350 1.00 0.00 H new ATOM 0 HG23 ILE A 67 0.641 -32.413 -6.071 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -2.293 -29.953 -6.232 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -0.973 -30.918 -5.529 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -0.627 -29.327 -6.248 1.00 0.00 H new ATOM 1071 N THR A 68 2.994 -30.028 -9.288 1.00 0.00 N ATOM 1072 CA THR A 68 4.272 -30.226 -9.959 1.00 0.00 C ATOM 1073 C THR A 68 5.156 -28.990 -9.833 1.00 0.00 C ATOM 1074 O THR A 68 6.209 -28.901 -10.462 1.00 0.00 O ATOM 1075 CB THR A 68 4.079 -30.555 -11.451 1.00 0.00 C ATOM 1076 OG1 THR A 68 3.361 -29.498 -12.097 1.00 0.00 O ATOM 1077 CG2 THR A 68 3.325 -31.865 -11.622 1.00 0.00 C ATOM 0 H THR A 68 2.292 -29.548 -9.851 1.00 0.00 H new ATOM 0 HA THR A 68 4.759 -31.069 -9.469 1.00 0.00 H new ATOM 0 HB THR A 68 5.063 -30.657 -11.908 1.00 0.00 H new ATOM 0 HG1 THR A 68 3.244 -29.714 -13.046 1.00 0.00 H new ATOM 0 HG21 THR A 68 3.200 -32.077 -12.684 1.00 0.00 H new ATOM 0 HG22 THR A 68 3.888 -32.673 -11.154 1.00 0.00 H new ATOM 0 HG23 THR A 68 2.345 -31.785 -11.150 1.00 0.00 H new ATOM 1085 N GLY A 69 4.719 -28.036 -9.016 1.00 0.00 N ATOM 1086 CA GLY A 69 5.483 -26.817 -8.823 1.00 0.00 C ATOM 1087 C GLY A 69 5.819 -26.130 -10.131 1.00 0.00 C ATOM 1088 O GLY A 69 6.790 -25.378 -10.214 1.00 0.00 O ATOM 0 H GLY A 69 3.850 -28.086 -8.485 1.00 0.00 H new ATOM 0 HA2 GLY A 69 4.916 -26.133 -8.192 1.00 0.00 H new ATOM 0 HA3 GLY A 69 6.405 -27.050 -8.291 1.00 0.00 H new ATOM 1092 N ASP A 70 5.014 -26.388 -11.156 1.00 0.00 N ATOM 1093 CA ASP A 70 5.231 -25.789 -12.468 1.00 0.00 C ATOM 1094 C ASP A 70 4.273 -24.624 -12.698 1.00 0.00 C ATOM 1095 O ASP A 70 4.002 -24.247 -13.838 1.00 0.00 O ATOM 1096 CB ASP A 70 5.052 -26.837 -13.567 1.00 0.00 C ATOM 1097 CG ASP A 70 6.336 -27.586 -13.867 1.00 0.00 C ATOM 1098 OD1 ASP A 70 7.401 -26.938 -13.925 1.00 0.00 O ATOM 1099 OD2 ASP A 70 6.275 -28.821 -14.045 1.00 0.00 O ATOM 0 H ASP A 70 4.206 -27.008 -11.104 1.00 0.00 H new ATOM 0 HA ASP A 70 6.252 -25.409 -12.502 1.00 0.00 H new ATOM 0 HB2 ASP A 70 4.282 -27.547 -13.266 1.00 0.00 H new ATOM 0 HB3 ASP A 70 4.698 -26.350 -14.476 1.00 0.00 H new ATOM 1104 N ALA A 71 3.764 -24.060 -11.609 1.00 0.00 N ATOM 1105 CA ALA A 71 2.837 -22.937 -11.692 1.00 0.00 C ATOM 1106 C ALA A 71 2.546 -22.362 -10.310 1.00 0.00 C ATOM 1107 O ALA A 71 2.763 -23.023 -9.294 1.00 0.00 O ATOM 1108 CB ALA A 71 1.545 -23.369 -12.369 1.00 0.00 C ATOM 0 H ALA A 71 3.977 -24.362 -10.658 1.00 0.00 H new ATOM 0 HA ALA A 71 3.304 -22.155 -12.291 1.00 0.00 H new ATOM 0 HB1 ALA A 71 0.862 -22.521 -12.424 1.00 0.00 H new ATOM 0 HB2 ALA A 71 1.763 -23.725 -13.376 1.00 0.00 H new ATOM 0 HB3 ALA A 71 1.083 -24.170 -11.793 1.00 0.00 H new ATOM 1114 N ILE A 72 2.055 -21.128 -10.280 1.00 0.00 N ATOM 1115 CA ILE A 72 1.735 -20.464 -9.022 1.00 0.00 C ATOM 1116 C ILE A 72 0.589 -19.474 -9.199 1.00 0.00 C ATOM 1117 O ILE A 72 0.331 -18.999 -10.305 1.00 0.00 O ATOM 1118 CB ILE A 72 2.956 -19.721 -8.450 1.00 0.00 C ATOM 1119 CG1 ILE A 72 3.351 -18.562 -9.367 1.00 0.00 C ATOM 1120 CG2 ILE A 72 4.123 -20.681 -8.268 1.00 0.00 C ATOM 1121 CD1 ILE A 72 2.697 -17.249 -8.998 1.00 0.00 C ATOM 0 H ILE A 72 1.870 -20.568 -11.112 1.00 0.00 H new ATOM 0 HA ILE A 72 1.434 -21.244 -8.322 1.00 0.00 H new ATOM 0 HB ILE A 72 2.690 -19.313 -7.475 1.00 0.00 H new ATOM 0 HG12 ILE A 72 4.434 -18.440 -9.339 1.00 0.00 H new ATOM 0 HG13 ILE A 72 3.086 -18.815 -10.393 1.00 0.00 H new ATOM 0 HG21 ILE A 72 4.979 -20.141 -7.863 1.00 0.00 H new ATOM 0 HG22 ILE A 72 3.836 -21.476 -7.579 1.00 0.00 H new ATOM 0 HG23 ILE A 72 4.391 -21.115 -9.231 1.00 0.00 H new ATOM 0 HD11 ILE A 72 3.023 -16.473 -9.690 1.00 0.00 H new ATOM 0 HD12 ILE A 72 1.614 -17.354 -9.054 1.00 0.00 H new ATOM 0 HD13 ILE A 72 2.983 -16.973 -7.983 1.00 0.00 H new ATOM 1133 N ASP A 73 -0.094 -19.166 -8.102 1.00 0.00 N ATOM 1134 CA ASP A 73 -1.212 -18.229 -8.135 1.00 0.00 C ATOM 1135 C ASP A 73 -0.853 -16.930 -7.421 1.00 0.00 C ATOM 1136 O ASP A 73 -0.056 -16.925 -6.482 1.00 0.00 O ATOM 1137 CB ASP A 73 -2.449 -18.855 -7.490 1.00 0.00 C ATOM 1138 CG ASP A 73 -3.739 -18.228 -7.983 1.00 0.00 C ATOM 1139 OD1 ASP A 73 -3.920 -17.010 -7.780 1.00 0.00 O ATOM 1140 OD2 ASP A 73 -4.567 -18.956 -8.570 1.00 0.00 O ATOM 0 H ASP A 73 0.106 -19.551 -7.179 1.00 0.00 H new ATOM 0 HA ASP A 73 -1.432 -18.001 -9.178 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -2.464 -19.924 -7.702 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -2.386 -18.745 -6.407 1.00 0.00 H new ATOM 1145 N PHE A 74 -1.446 -15.830 -7.871 1.00 0.00 N ATOM 1146 CA PHE A 74 -1.187 -14.523 -7.276 1.00 0.00 C ATOM 1147 C PHE A 74 -2.443 -13.657 -7.299 1.00 0.00 C ATOM 1148 O PHE A 74 -3.464 -14.040 -7.870 1.00 0.00 O ATOM 1149 CB PHE A 74 -0.052 -13.816 -8.020 1.00 0.00 C ATOM 1150 CG PHE A 74 -0.491 -13.160 -9.298 1.00 0.00 C ATOM 1151 CD1 PHE A 74 -0.965 -11.858 -9.296 1.00 0.00 C ATOM 1152 CD2 PHE A 74 -0.429 -13.844 -10.501 1.00 0.00 C ATOM 1153 CE1 PHE A 74 -1.369 -11.250 -10.470 1.00 0.00 C ATOM 1154 CE2 PHE A 74 -0.831 -13.242 -11.678 1.00 0.00 C ATOM 1155 CZ PHE A 74 -1.303 -11.944 -11.662 1.00 0.00 C ATOM 0 H PHE A 74 -2.109 -15.817 -8.646 1.00 0.00 H new ATOM 0 HA PHE A 74 -0.891 -14.676 -6.238 1.00 0.00 H new ATOM 0 HB2 PHE A 74 0.387 -13.062 -7.366 1.00 0.00 H new ATOM 0 HB3 PHE A 74 0.732 -14.540 -8.243 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -1.020 -11.312 -8.366 1.00 0.00 H new ATOM 0 HD2 PHE A 74 -0.062 -14.860 -10.519 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -1.736 -10.234 -10.455 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -0.776 -13.786 -12.609 1.00 0.00 H new ATOM 0 HZ PHE A 74 -1.620 -11.473 -12.580 1.00 0.00 H new ATOM 1165 N ALA A 75 -2.359 -12.487 -6.674 1.00 0.00 N ATOM 1166 CA ALA A 75 -3.487 -11.566 -6.623 1.00 0.00 C ATOM 1167 C ALA A 75 -3.050 -10.144 -6.961 1.00 0.00 C ATOM 1168 O ALA A 75 -2.047 -9.641 -6.454 1.00 0.00 O ATOM 1169 CB ALA A 75 -4.141 -11.607 -5.250 1.00 0.00 C ATOM 0 H ALA A 75 -1.521 -12.155 -6.196 1.00 0.00 H new ATOM 0 HA ALA A 75 -4.216 -11.882 -7.369 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -4.982 -10.914 -5.227 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -4.497 -12.617 -5.047 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -3.413 -11.320 -4.491 1.00 0.00 H new ATOM 1175 N PRO A 76 -3.818 -9.480 -7.837 1.00 0.00 N ATOM 1176 CA PRO A 76 -3.529 -8.107 -8.262 1.00 0.00 C ATOM 1177 C PRO A 76 -3.758 -7.095 -7.145 1.00 0.00 C ATOM 1178 O PRO A 76 -4.885 -6.909 -6.684 1.00 0.00 O ATOM 1179 CB PRO A 76 -4.519 -7.874 -9.407 1.00 0.00 C ATOM 1180 CG PRO A 76 -5.644 -8.811 -9.131 1.00 0.00 C ATOM 1181 CD PRO A 76 -5.028 -10.019 -8.481 1.00 0.00 C ATOM 0 HA PRO A 76 -2.486 -7.980 -8.551 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -4.862 -6.840 -9.430 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -4.061 -8.079 -10.375 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -6.384 -8.350 -8.476 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -6.159 -9.084 -10.052 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -5.702 -10.472 -7.754 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -4.785 -10.789 -9.213 1.00 0.00 H new ATOM 1189 N TYR A 77 -2.684 -6.442 -6.715 1.00 0.00 N ATOM 1190 CA TYR A 77 -2.769 -5.449 -5.651 1.00 0.00 C ATOM 1191 C TYR A 77 -2.914 -4.044 -6.227 1.00 0.00 C ATOM 1192 O TYR A 77 -2.199 -3.665 -7.155 1.00 0.00 O ATOM 1193 CB TYR A 77 -1.529 -5.521 -4.758 1.00 0.00 C ATOM 1194 CG TYR A 77 -1.849 -5.649 -3.286 1.00 0.00 C ATOM 1195 CD1 TYR A 77 -2.245 -6.865 -2.744 1.00 0.00 C ATOM 1196 CD2 TYR A 77 -1.756 -4.553 -2.437 1.00 0.00 C ATOM 1197 CE1 TYR A 77 -2.539 -6.987 -1.400 1.00 0.00 C ATOM 1198 CE2 TYR A 77 -2.047 -4.665 -1.091 1.00 0.00 C ATOM 1199 CZ TYR A 77 -2.438 -5.884 -0.577 1.00 0.00 C ATOM 1200 OH TYR A 77 -2.730 -5.999 0.762 1.00 0.00 O ATOM 0 H TYR A 77 -1.745 -6.583 -7.087 1.00 0.00 H new ATOM 0 HA TYR A 77 -3.653 -5.669 -5.053 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -0.920 -6.372 -5.064 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -0.927 -4.626 -4.914 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -2.324 -7.731 -3.385 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -1.451 -3.597 -2.836 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -2.846 -7.940 -0.996 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -1.969 -3.803 -0.445 1.00 0.00 H new ATOM 0 HH TYR A 77 -2.379 -6.849 1.101 1.00 0.00 H new ATOM 1210 N ILE A 78 -3.843 -3.276 -5.669 1.00 0.00 N ATOM 1211 CA ILE A 78 -4.082 -1.913 -6.125 1.00 0.00 C ATOM 1212 C ILE A 78 -4.605 -1.037 -4.991 1.00 0.00 C ATOM 1213 O ILE A 78 -5.429 -1.472 -4.187 1.00 0.00 O ATOM 1214 CB ILE A 78 -5.086 -1.877 -7.291 1.00 0.00 C ATOM 1215 CG1 ILE A 78 -4.444 -2.433 -8.563 1.00 0.00 C ATOM 1216 CG2 ILE A 78 -5.582 -0.457 -7.520 1.00 0.00 C ATOM 1217 CD1 ILE A 78 -4.682 -3.914 -8.763 1.00 0.00 C ATOM 0 H ILE A 78 -4.443 -3.575 -4.900 1.00 0.00 H new ATOM 0 HA ILE A 78 -3.124 -1.524 -6.469 1.00 0.00 H new ATOM 0 HB ILE A 78 -5.941 -2.503 -7.034 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -4.835 -1.891 -9.424 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -3.370 -2.247 -8.530 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -6.291 -0.448 -8.348 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -6.073 -0.093 -6.618 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -4.737 0.189 -7.759 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -4.198 -4.239 -9.684 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -4.266 -4.466 -7.920 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -5.753 -4.105 -8.829 1.00 0.00 H new ATOM 1229 N ASN A 79 -4.122 0.199 -4.934 1.00 0.00 N ATOM 1230 CA ASN A 79 -4.542 1.137 -3.899 1.00 0.00 C ATOM 1231 C ASN A 79 -4.228 0.591 -2.509 1.00 0.00 C ATOM 1232 O ASN A 79 -4.960 0.840 -1.553 1.00 0.00 O ATOM 1233 CB ASN A 79 -6.040 1.424 -4.019 1.00 0.00 C ATOM 1234 CG ASN A 79 -6.344 2.481 -5.064 1.00 0.00 C ATOM 1235 OD1 ASN A 79 -6.726 2.163 -6.191 1.00 0.00 O ATOM 1236 ND2 ASN A 79 -6.175 3.745 -4.694 1.00 0.00 N ATOM 0 H ASN A 79 -3.439 0.575 -5.592 1.00 0.00 H new ATOM 0 HA ASN A 79 -3.988 2.065 -4.039 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -6.564 0.503 -4.274 1.00 0.00 H new ATOM 0 HB3 ASN A 79 -6.423 1.752 -3.053 1.00 0.00 H new ATOM 0 HD21 ASN A 79 -6.363 4.499 -5.354 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -5.857 3.962 -3.749 1.00 0.00 H new ATOM 1243 N GLY A 80 -3.132 -0.156 -2.407 1.00 0.00 N ATOM 1244 CA GLY A 80 -2.740 -0.725 -1.131 1.00 0.00 C ATOM 1245 C GLY A 80 -3.713 -1.780 -0.643 1.00 0.00 C ATOM 1246 O GLY A 80 -3.735 -2.115 0.542 1.00 0.00 O ATOM 0 H GLY A 80 -2.510 -0.377 -3.184 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -1.747 -1.166 -1.223 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -2.669 0.070 -0.389 1.00 0.00 H new ATOM 1250 N LYS A 81 -4.522 -2.305 -1.557 1.00 0.00 N ATOM 1251 CA LYS A 81 -5.503 -3.328 -1.215 1.00 0.00 C ATOM 1252 C LYS A 81 -5.712 -4.292 -2.379 1.00 0.00 C ATOM 1253 O LYS A 81 -5.445 -3.954 -3.532 1.00 0.00 O ATOM 1254 CB LYS A 81 -6.834 -2.679 -0.830 1.00 0.00 C ATOM 1255 CG LYS A 81 -7.358 -1.703 -1.870 1.00 0.00 C ATOM 1256 CD LYS A 81 -8.786 -1.280 -1.569 1.00 0.00 C ATOM 1257 CE LYS A 81 -9.146 0.014 -2.281 1.00 0.00 C ATOM 1258 NZ LYS A 81 -8.896 1.207 -1.426 1.00 0.00 N ATOM 0 H LYS A 81 -4.517 -2.038 -2.542 1.00 0.00 H new ATOM 0 HA LYS A 81 -5.122 -3.892 -0.364 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -7.577 -3.460 -0.670 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -6.713 -2.156 0.119 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -6.716 -0.823 -1.900 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -7.314 -2.164 -2.857 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -9.473 -2.069 -1.876 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -8.909 -1.151 -0.494 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -8.564 0.097 -3.199 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -10.197 -0.011 -2.571 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -9.154 2.069 -1.948 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -9.470 1.141 -0.561 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -7.889 1.246 -1.170 1.00 0.00 H new ATOM 1272 N ILE A 82 -6.193 -5.491 -2.068 1.00 0.00 N ATOM 1273 CA ILE A 82 -6.441 -6.502 -3.089 1.00 0.00 C ATOM 1274 C ILE A 82 -7.569 -6.075 -4.022 1.00 0.00 C ATOM 1275 O ILE A 82 -8.629 -5.640 -3.573 1.00 0.00 O ATOM 1276 CB ILE A 82 -6.797 -7.862 -2.460 1.00 0.00 C ATOM 1277 CG1 ILE A 82 -5.869 -8.161 -1.281 1.00 0.00 C ATOM 1278 CG2 ILE A 82 -6.712 -8.966 -3.503 1.00 0.00 C ATOM 1279 CD1 ILE A 82 -6.542 -8.031 0.067 1.00 0.00 C ATOM 0 H ILE A 82 -6.419 -5.786 -1.118 1.00 0.00 H new ATOM 0 HA ILE A 82 -5.519 -6.606 -3.661 1.00 0.00 H new ATOM 0 HB ILE A 82 -7.821 -7.818 -2.089 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -5.476 -9.172 -1.386 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -5.017 -7.483 -1.319 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -6.966 -9.921 -3.043 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -7.410 -8.756 -4.313 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -5.698 -9.013 -3.901 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -5.824 -8.257 0.855 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -6.910 -7.013 0.193 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -7.377 -8.729 0.125 1.00 0.00 H new ATOM 1291 N ASP A 83 -7.333 -6.205 -5.323 1.00 0.00 N ATOM 1292 CA ASP A 83 -8.331 -5.836 -6.321 1.00 0.00 C ATOM 1293 C ASP A 83 -8.877 -7.074 -7.027 1.00 0.00 C ATOM 1294 O ASP A 83 -8.428 -7.427 -8.118 1.00 0.00 O ATOM 1295 CB ASP A 83 -7.726 -4.875 -7.346 1.00 0.00 C ATOM 1296 CG ASP A 83 -8.211 -3.450 -7.158 1.00 0.00 C ATOM 1297 OD1 ASP A 83 -8.678 -3.123 -6.047 1.00 0.00 O ATOM 1298 OD2 ASP A 83 -8.122 -2.662 -8.123 1.00 0.00 O ATOM 0 H ASP A 83 -6.460 -6.563 -5.711 1.00 0.00 H new ATOM 0 HA ASP A 83 -9.155 -5.339 -5.809 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -6.639 -4.900 -7.266 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -7.980 -5.213 -8.351 1.00 0.00 H new ATOM 1303 N TRP A 84 -9.846 -7.728 -6.398 1.00 0.00 N ATOM 1304 CA TRP A 84 -10.452 -8.927 -6.966 1.00 0.00 C ATOM 1305 C TRP A 84 -11.620 -8.567 -7.877 1.00 0.00 C ATOM 1306 O TRP A 84 -12.078 -9.389 -8.668 1.00 0.00 O ATOM 1307 CB TRP A 84 -10.928 -9.859 -5.851 1.00 0.00 C ATOM 1308 CG TRP A 84 -9.836 -10.718 -5.288 1.00 0.00 C ATOM 1309 CD1 TRP A 84 -9.344 -10.689 -4.014 1.00 0.00 C ATOM 1310 CD2 TRP A 84 -9.099 -11.731 -5.982 1.00 0.00 C ATOM 1311 NE1 TRP A 84 -8.346 -11.623 -3.874 1.00 0.00 N ATOM 1312 CE2 TRP A 84 -8.177 -12.276 -5.067 1.00 0.00 C ATOM 1313 CE3 TRP A 84 -9.130 -12.232 -7.286 1.00 0.00 C ATOM 1314 CZ2 TRP A 84 -7.295 -13.295 -5.417 1.00 0.00 C ATOM 1315 CZ3 TRP A 84 -8.253 -13.243 -7.632 1.00 0.00 C ATOM 1316 CH2 TRP A 84 -7.347 -13.767 -6.700 1.00 0.00 C ATOM 0 H TRP A 84 -10.229 -7.449 -5.495 1.00 0.00 H new ATOM 0 HA TRP A 84 -9.696 -9.439 -7.561 1.00 0.00 H new ATOM 0 HB2 TRP A 84 -11.361 -9.262 -5.048 1.00 0.00 H new ATOM 0 HB3 TRP A 84 -11.722 -10.499 -6.236 1.00 0.00 H new ATOM 0 HD1 TRP A 84 -9.689 -10.029 -3.232 1.00 0.00 H new ATOM 0 HE1 TRP A 84 -7.817 -11.801 -3.021 1.00 0.00 H new ATOM 0 HE3 TRP A 84 -9.827 -11.837 -8.010 1.00 0.00 H new ATOM 0 HZ2 TRP A 84 -6.595 -13.699 -4.701 1.00 0.00 H new ATOM 0 HZ3 TRP A 84 -8.266 -13.636 -8.638 1.00 0.00 H new ATOM 0 HH2 TRP A 84 -6.677 -14.559 -7.000 1.00 0.00 H new ATOM 1327 N ASN A 85 -12.098 -7.332 -7.760 1.00 0.00 N ATOM 1328 CA ASN A 85 -13.213 -6.863 -8.574 1.00 0.00 C ATOM 1329 C ASN A 85 -12.740 -5.860 -9.621 1.00 0.00 C ATOM 1330 O ASN A 85 -13.548 -5.192 -10.266 1.00 0.00 O ATOM 1331 CB ASN A 85 -14.285 -6.225 -7.688 1.00 0.00 C ATOM 1332 CG ASN A 85 -15.674 -6.342 -8.286 1.00 0.00 C ATOM 1333 OD1 ASN A 85 -16.136 -7.438 -8.603 1.00 0.00 O ATOM 1334 ND2 ASN A 85 -16.348 -5.208 -8.443 1.00 0.00 N ATOM 0 H ASN A 85 -11.730 -6.638 -7.109 1.00 0.00 H new ATOM 0 HA ASN A 85 -13.641 -7.723 -9.089 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -14.273 -6.701 -6.708 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -14.046 -5.173 -7.534 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -17.287 -5.224 -8.840 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -15.926 -4.322 -8.166 1.00 0.00 H new ATOM 1341 N ASP A 86 -11.425 -5.760 -9.784 1.00 0.00 N ATOM 1342 CA ASP A 86 -10.843 -4.839 -10.754 1.00 0.00 C ATOM 1343 C ASP A 86 -10.052 -5.598 -11.815 1.00 0.00 C ATOM 1344 O ASP A 86 -8.829 -5.717 -11.727 1.00 0.00 O ATOM 1345 CB ASP A 86 -9.936 -3.829 -10.049 1.00 0.00 C ATOM 1346 CG ASP A 86 -10.610 -2.486 -9.851 1.00 0.00 C ATOM 1347 OD1 ASP A 86 -11.043 -1.886 -10.857 1.00 0.00 O ATOM 1348 OD2 ASP A 86 -10.703 -2.034 -8.690 1.00 0.00 O ATOM 0 H ASP A 86 -10.742 -6.305 -9.257 1.00 0.00 H new ATOM 0 HA ASP A 86 -11.656 -4.304 -11.245 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -9.636 -4.228 -9.080 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -9.026 -3.693 -10.633 1.00 0.00 H new ATOM 1353 N LEU A 87 -10.757 -6.109 -12.818 1.00 0.00 N ATOM 1354 CA LEU A 87 -10.122 -6.857 -13.897 1.00 0.00 C ATOM 1355 C LEU A 87 -9.213 -5.953 -14.724 1.00 0.00 C ATOM 1356 O LEU A 87 -8.301 -6.427 -15.402 1.00 0.00 O ATOM 1357 CB LEU A 87 -11.183 -7.493 -14.797 1.00 0.00 C ATOM 1358 CG LEU A 87 -12.242 -6.545 -15.360 1.00 0.00 C ATOM 1359 CD1 LEU A 87 -11.692 -5.780 -16.555 1.00 0.00 C ATOM 1360 CD2 LEU A 87 -13.495 -7.315 -15.748 1.00 0.00 C ATOM 0 H LEU A 87 -11.769 -6.019 -12.907 1.00 0.00 H new ATOM 0 HA LEU A 87 -9.514 -7.644 -13.451 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -10.678 -7.979 -15.632 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -11.689 -8.276 -14.231 1.00 0.00 H new ATOM 0 HG LEU A 87 -12.508 -5.826 -14.585 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -12.459 -5.110 -16.943 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -10.824 -5.197 -16.246 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -11.398 -6.484 -17.334 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -14.238 -6.624 -16.147 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -13.246 -8.057 -16.506 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -13.901 -7.816 -14.869 1.00 0.00 H new ATOM 1372 N GLU A 88 -9.467 -4.650 -14.661 1.00 0.00 N ATOM 1373 CA GLU A 88 -8.670 -3.681 -15.404 1.00 0.00 C ATOM 1374 C GLU A 88 -7.185 -3.842 -15.089 1.00 0.00 C ATOM 1375 O GLU A 88 -6.389 -4.186 -15.962 1.00 0.00 O ATOM 1376 CB GLU A 88 -9.120 -2.256 -15.073 1.00 0.00 C ATOM 1377 CG GLU A 88 -10.423 -1.858 -15.747 1.00 0.00 C ATOM 1378 CD GLU A 88 -10.565 -0.356 -15.900 1.00 0.00 C ATOM 1379 OE1 GLU A 88 -9.791 0.382 -15.256 1.00 0.00 O ATOM 1380 OE2 GLU A 88 -11.452 0.080 -16.664 1.00 0.00 O ATOM 0 H GLU A 88 -10.217 -4.241 -14.104 1.00 0.00 H new ATOM 0 HA GLU A 88 -8.821 -3.865 -16.468 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -9.236 -2.162 -13.993 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -8.338 -1.558 -15.372 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -10.477 -2.326 -16.730 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -11.261 -2.241 -15.165 1.00 0.00 H new ATOM 1387 N ALA A 89 -6.821 -3.590 -13.836 1.00 0.00 N ATOM 1388 CA ALA A 89 -5.434 -3.708 -13.405 1.00 0.00 C ATOM 1389 C ALA A 89 -4.887 -5.103 -13.690 1.00 0.00 C ATOM 1390 O ALA A 89 -3.679 -5.290 -13.834 1.00 0.00 O ATOM 1391 CB ALA A 89 -5.312 -3.384 -11.924 1.00 0.00 C ATOM 0 H ALA A 89 -7.468 -3.303 -13.102 1.00 0.00 H new ATOM 0 HA ALA A 89 -4.841 -2.991 -13.973 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -4.271 -3.476 -11.616 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -5.654 -2.365 -11.745 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -5.924 -4.079 -11.348 1.00 0.00 H new ATOM 1397 N PHE A 90 -5.785 -6.080 -13.769 1.00 0.00 N ATOM 1398 CA PHE A 90 -5.392 -7.459 -14.035 1.00 0.00 C ATOM 1399 C PHE A 90 -4.648 -7.566 -15.363 1.00 0.00 C ATOM 1400 O PHE A 90 -3.823 -8.460 -15.554 1.00 0.00 O ATOM 1401 CB PHE A 90 -6.623 -8.368 -14.053 1.00 0.00 C ATOM 1402 CG PHE A 90 -6.345 -9.762 -13.568 1.00 0.00 C ATOM 1403 CD1 PHE A 90 -5.645 -10.658 -14.358 1.00 0.00 C ATOM 1404 CD2 PHE A 90 -6.786 -10.176 -12.321 1.00 0.00 C ATOM 1405 CE1 PHE A 90 -5.387 -11.942 -13.914 1.00 0.00 C ATOM 1406 CE2 PHE A 90 -6.531 -11.458 -11.872 1.00 0.00 C ATOM 1407 CZ PHE A 90 -5.832 -12.342 -12.670 1.00 0.00 C ATOM 0 H PHE A 90 -6.789 -5.942 -13.653 1.00 0.00 H new ATOM 0 HA PHE A 90 -4.723 -7.780 -13.237 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -7.402 -7.924 -13.432 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -7.014 -8.417 -15.069 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -5.296 -10.350 -15.333 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -7.335 -9.489 -11.693 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -4.838 -12.631 -14.539 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -6.878 -11.768 -10.898 1.00 0.00 H new ATOM 0 HZ PHE A 90 -5.634 -13.345 -12.321 1.00 0.00 H new ATOM 1417 N TRP A 91 -4.946 -6.650 -16.277 1.00 0.00 N ATOM 1418 CA TRP A 91 -4.306 -6.641 -17.588 1.00 0.00 C ATOM 1419 C TRP A 91 -2.870 -6.139 -17.489 1.00 0.00 C ATOM 1420 O TRP A 91 -1.942 -6.787 -17.972 1.00 0.00 O ATOM 1421 CB TRP A 91 -5.100 -5.766 -18.559 1.00 0.00 C ATOM 1422 CG TRP A 91 -4.445 -5.622 -19.900 1.00 0.00 C ATOM 1423 CD1 TRP A 91 -3.647 -6.538 -20.524 1.00 0.00 C ATOM 1424 CD2 TRP A 91 -4.530 -4.495 -20.779 1.00 0.00 C ATOM 1425 NE1 TRP A 91 -3.231 -6.048 -21.739 1.00 0.00 N ATOM 1426 CE2 TRP A 91 -3.760 -4.797 -21.919 1.00 0.00 C ATOM 1427 CE3 TRP A 91 -5.184 -3.262 -20.715 1.00 0.00 C ATOM 1428 CZ2 TRP A 91 -3.627 -3.910 -22.983 1.00 0.00 C ATOM 1429 CZ3 TRP A 91 -5.050 -2.382 -21.772 1.00 0.00 C ATOM 1430 CH2 TRP A 91 -4.277 -2.709 -22.894 1.00 0.00 C ATOM 0 H TRP A 91 -5.627 -5.904 -16.135 1.00 0.00 H new ATOM 0 HA TRP A 91 -4.288 -7.664 -17.964 1.00 0.00 H new ATOM 0 HB2 TRP A 91 -6.094 -6.193 -18.692 1.00 0.00 H new ATOM 0 HB3 TRP A 91 -5.234 -4.777 -18.120 1.00 0.00 H new ATOM 0 HD1 TRP A 91 -3.382 -7.505 -20.122 1.00 0.00 H new ATOM 0 HE1 TRP A 91 -2.626 -6.537 -22.400 1.00 0.00 H new ATOM 0 HE3 TRP A 91 -5.783 -3.001 -19.855 1.00 0.00 H new ATOM 0 HZ2 TRP A 91 -3.032 -4.161 -23.849 1.00 0.00 H new ATOM 0 HZ3 TRP A 91 -5.550 -1.425 -21.733 1.00 0.00 H new ATOM 0 HH2 TRP A 91 -4.193 -2.000 -23.704 1.00 0.00 H new ATOM 1441 N ALA A 92 -2.694 -4.981 -16.860 1.00 0.00 N ATOM 1442 CA ALA A 92 -1.370 -4.394 -16.696 1.00 0.00 C ATOM 1443 C ALA A 92 -0.435 -5.346 -15.958 1.00 0.00 C ATOM 1444 O ALA A 92 0.777 -5.333 -16.173 1.00 0.00 O ATOM 1445 CB ALA A 92 -1.468 -3.068 -15.956 1.00 0.00 C ATOM 0 H ALA A 92 -3.452 -4.431 -16.456 1.00 0.00 H new ATOM 0 HA ALA A 92 -0.954 -4.214 -17.687 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -0.472 -2.641 -15.841 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -2.094 -2.380 -16.524 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -1.908 -3.232 -14.973 1.00 0.00 H new ATOM 1451 N VAL A 93 -1.006 -6.172 -15.086 1.00 0.00 N ATOM 1452 CA VAL A 93 -0.223 -7.131 -14.316 1.00 0.00 C ATOM 1453 C VAL A 93 0.136 -8.350 -15.159 1.00 0.00 C ATOM 1454 O VAL A 93 1.303 -8.731 -15.254 1.00 0.00 O ATOM 1455 CB VAL A 93 -0.983 -7.595 -13.060 1.00 0.00 C ATOM 1456 CG1 VAL A 93 -0.306 -8.811 -12.445 1.00 0.00 C ATOM 1457 CG2 VAL A 93 -1.083 -6.462 -12.049 1.00 0.00 C ATOM 0 H VAL A 93 -2.008 -6.196 -14.896 1.00 0.00 H new ATOM 0 HA VAL A 93 0.691 -6.622 -14.011 1.00 0.00 H new ATOM 0 HB VAL A 93 -1.993 -7.881 -13.353 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -0.857 -9.125 -11.558 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -0.291 -9.625 -13.170 1.00 0.00 H new ATOM 0 HG13 VAL A 93 0.716 -8.556 -12.165 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -1.623 -6.808 -11.168 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -0.082 -6.143 -11.759 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -1.616 -5.622 -12.495 1.00 0.00 H new ATOM 1467 N LYS A 94 -0.875 -8.958 -15.770 1.00 0.00 N ATOM 1468 CA LYS A 94 -0.667 -10.134 -16.607 1.00 0.00 C ATOM 1469 C LYS A 94 0.291 -9.824 -17.753 1.00 0.00 C ATOM 1470 O LYS A 94 1.016 -10.700 -18.224 1.00 0.00 O ATOM 1471 CB LYS A 94 -2.003 -10.630 -17.165 1.00 0.00 C ATOM 1472 CG LYS A 94 -1.887 -11.915 -17.966 1.00 0.00 C ATOM 1473 CD LYS A 94 -2.377 -13.114 -17.171 1.00 0.00 C ATOM 1474 CE LYS A 94 -1.521 -13.350 -15.935 1.00 0.00 C ATOM 1475 NZ LYS A 94 -2.036 -12.604 -14.754 1.00 0.00 N ATOM 0 H LYS A 94 -1.847 -8.656 -15.701 1.00 0.00 H new ATOM 0 HA LYS A 94 -0.225 -10.916 -15.989 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -2.696 -10.788 -16.339 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -2.433 -9.854 -17.798 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -2.466 -11.825 -18.885 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -0.848 -12.071 -18.258 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -3.413 -12.955 -16.873 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -2.360 -14.002 -17.802 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -1.496 -14.416 -15.709 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -0.495 -13.043 -16.139 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -2.020 -13.223 -13.918 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -1.436 -11.772 -14.580 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -3.012 -12.295 -14.937 1.00 0.00 H new ATOM 1489 N LYS A 95 0.290 -8.571 -18.196 1.00 0.00 N ATOM 1490 CA LYS A 95 1.161 -8.144 -19.285 1.00 0.00 C ATOM 1491 C LYS A 95 2.612 -8.062 -18.821 1.00 0.00 C ATOM 1492 O LYS A 95 3.537 -8.205 -19.619 1.00 0.00 O ATOM 1493 CB LYS A 95 0.709 -6.784 -19.823 1.00 0.00 C ATOM 1494 CG LYS A 95 1.664 -6.186 -20.842 1.00 0.00 C ATOM 1495 CD LYS A 95 0.973 -5.148 -21.710 1.00 0.00 C ATOM 1496 CE LYS A 95 0.971 -3.778 -21.048 1.00 0.00 C ATOM 1497 NZ LYS A 95 2.351 -3.247 -20.871 1.00 0.00 N ATOM 0 H LYS A 95 -0.304 -7.833 -17.818 1.00 0.00 H new ATOM 0 HA LYS A 95 1.094 -8.884 -20.082 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -0.275 -6.892 -20.279 1.00 0.00 H new ATOM 0 HB3 LYS A 95 0.600 -6.091 -18.989 1.00 0.00 H new ATOM 0 HG2 LYS A 95 2.508 -5.727 -20.326 1.00 0.00 H new ATOM 0 HG3 LYS A 95 2.068 -6.978 -21.472 1.00 0.00 H new ATOM 0 HD2 LYS A 95 1.476 -5.086 -22.675 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -0.053 -5.460 -21.905 1.00 0.00 H new ATOM 0 HE2 LYS A 95 0.389 -3.083 -21.653 1.00 0.00 H new ATOM 0 HE3 LYS A 95 0.480 -3.844 -20.077 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 2.322 -2.208 -20.845 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 2.749 -3.605 -19.979 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 2.947 -3.557 -21.665 1.00 0.00 H new ATOM 1511 N ALA A 96 2.802 -7.832 -17.526 1.00 0.00 N ATOM 1512 CA ALA A 96 4.140 -7.736 -16.956 1.00 0.00 C ATOM 1513 C ALA A 96 4.781 -9.113 -16.823 1.00 0.00 C ATOM 1514 O ALA A 96 6.003 -9.249 -16.895 1.00 0.00 O ATOM 1515 CB ALA A 96 4.088 -7.043 -15.602 1.00 0.00 C ATOM 0 H ALA A 96 2.046 -7.709 -16.852 1.00 0.00 H new ATOM 0 HA ALA A 96 4.754 -7.142 -17.633 1.00 0.00 H new ATOM 0 HB1 ALA A 96 5.094 -6.978 -15.188 1.00 0.00 H new ATOM 0 HB2 ALA A 96 3.680 -6.040 -15.722 1.00 0.00 H new ATOM 0 HB3 ALA A 96 3.453 -7.614 -14.925 1.00 0.00 H new ATOM 1521 N PHE A 97 3.950 -10.131 -16.630 1.00 0.00 N ATOM 1522 CA PHE A 97 4.437 -11.498 -16.486 1.00 0.00 C ATOM 1523 C PHE A 97 4.927 -12.045 -17.823 1.00 0.00 C ATOM 1524 O PHE A 97 6.038 -12.565 -17.923 1.00 0.00 O ATOM 1525 CB PHE A 97 3.333 -12.399 -15.928 1.00 0.00 C ATOM 1526 CG PHE A 97 3.401 -12.578 -14.438 1.00 0.00 C ATOM 1527 CD1 PHE A 97 2.940 -11.588 -13.586 1.00 0.00 C ATOM 1528 CD2 PHE A 97 3.926 -13.738 -13.890 1.00 0.00 C ATOM 1529 CE1 PHE A 97 3.002 -11.750 -12.215 1.00 0.00 C ATOM 1530 CE2 PHE A 97 3.991 -13.906 -12.519 1.00 0.00 C ATOM 1531 CZ PHE A 97 3.527 -12.911 -11.681 1.00 0.00 C ATOM 0 H PHE A 97 2.936 -10.036 -16.570 1.00 0.00 H new ATOM 0 HA PHE A 97 5.275 -11.487 -15.789 1.00 0.00 H new ATOM 0 HB2 PHE A 97 2.363 -11.977 -16.191 1.00 0.00 H new ATOM 0 HB3 PHE A 97 3.396 -13.376 -16.407 1.00 0.00 H new ATOM 0 HD1 PHE A 97 2.527 -10.679 -13.998 1.00 0.00 H new ATOM 0 HD2 PHE A 97 4.288 -14.520 -14.541 1.00 0.00 H new ATOM 0 HE1 PHE A 97 2.640 -10.970 -11.562 1.00 0.00 H new ATOM 0 HE2 PHE A 97 4.404 -14.814 -12.104 1.00 0.00 H new ATOM 0 HZ PHE A 97 3.575 -13.040 -10.610 1.00 0.00 H new ATOM 1541 N GLU A 98 4.090 -11.923 -18.848 1.00 0.00 N ATOM 1542 CA GLU A 98 4.437 -12.406 -20.180 1.00 0.00 C ATOM 1543 C GLU A 98 5.758 -11.802 -20.650 1.00 0.00 C ATOM 1544 O GLU A 98 6.596 -12.492 -21.229 1.00 0.00 O ATOM 1545 CB GLU A 98 3.326 -12.068 -21.175 1.00 0.00 C ATOM 1546 CG GLU A 98 2.816 -10.641 -21.058 1.00 0.00 C ATOM 1547 CD GLU A 98 1.876 -10.263 -22.186 1.00 0.00 C ATOM 1548 OE1 GLU A 98 0.808 -10.898 -22.306 1.00 0.00 O ATOM 1549 OE2 GLU A 98 2.209 -9.331 -22.947 1.00 0.00 O ATOM 0 H GLU A 98 3.167 -11.494 -18.782 1.00 0.00 H new ATOM 0 HA GLU A 98 4.550 -13.489 -20.128 1.00 0.00 H new ATOM 0 HB2 GLU A 98 3.695 -12.231 -22.188 1.00 0.00 H new ATOM 0 HB3 GLU A 98 2.494 -12.756 -21.025 1.00 0.00 H new ATOM 0 HG2 GLU A 98 2.301 -10.520 -20.105 1.00 0.00 H new ATOM 0 HG3 GLU A 98 3.664 -9.956 -21.051 1.00 0.00 H new ATOM 1556 N GLN A 99 5.934 -10.509 -20.396 1.00 0.00 N ATOM 1557 CA GLN A 99 7.151 -9.812 -20.794 1.00 0.00 C ATOM 1558 C GLN A 99 8.316 -10.189 -19.885 1.00 0.00 C ATOM 1559 O GLN A 99 9.446 -10.351 -20.344 1.00 0.00 O ATOM 1560 CB GLN A 99 6.931 -8.299 -20.761 1.00 0.00 C ATOM 1561 CG GLN A 99 6.501 -7.776 -19.399 1.00 0.00 C ATOM 1562 CD GLN A 99 6.224 -6.286 -19.407 1.00 0.00 C ATOM 1563 OE1 GLN A 99 6.789 -5.534 -18.612 1.00 0.00 O ATOM 1564 NE2 GLN A 99 5.351 -5.850 -20.307 1.00 0.00 N ATOM 0 H GLN A 99 5.250 -9.924 -19.917 1.00 0.00 H new ATOM 0 HA GLN A 99 7.396 -10.114 -21.812 1.00 0.00 H new ATOM 0 HB2 GLN A 99 7.853 -7.800 -21.058 1.00 0.00 H new ATOM 0 HB3 GLN A 99 6.173 -8.034 -21.498 1.00 0.00 H new ATOM 0 HG2 GLN A 99 5.605 -8.307 -19.077 1.00 0.00 H new ATOM 0 HG3 GLN A 99 7.280 -7.993 -18.668 1.00 0.00 H new ATOM 0 HE21 GLN A 99 4.906 -6.508 -20.947 1.00 0.00 H new ATOM 0 HE22 GLN A 99 5.125 -4.857 -20.359 1.00 0.00 H new ATOM 1573 N ALA A 100 8.033 -10.326 -18.594 1.00 0.00 N ATOM 1574 CA ALA A 100 9.057 -10.685 -17.621 1.00 0.00 C ATOM 1575 C ALA A 100 9.776 -11.967 -18.028 1.00 0.00 C ATOM 1576 O ALA A 100 11.000 -12.057 -17.948 1.00 0.00 O ATOM 1577 CB ALA A 100 8.441 -10.839 -16.239 1.00 0.00 C ATOM 0 H ALA A 100 7.103 -10.194 -18.198 1.00 0.00 H new ATOM 0 HA ALA A 100 9.792 -9.881 -17.591 1.00 0.00 H new ATOM 0 HB1 ALA A 100 9.217 -11.107 -15.522 1.00 0.00 H new ATOM 0 HB2 ALA A 100 7.980 -9.898 -15.939 1.00 0.00 H new ATOM 0 HB3 ALA A 100 7.684 -11.622 -16.264 1.00 0.00 H new ATOM 1583 N GLY A 101 9.005 -12.958 -18.466 1.00 0.00 N ATOM 1584 CA GLY A 101 9.586 -14.223 -18.878 1.00 0.00 C ATOM 1585 C GLY A 101 10.390 -14.102 -20.157 1.00 0.00 C ATOM 1586 O GLY A 101 11.230 -14.952 -20.454 1.00 0.00 O ATOM 0 H GLY A 101 7.989 -12.908 -18.543 1.00 0.00 H new ATOM 0 HA2 GLY A 101 10.229 -14.600 -18.083 1.00 0.00 H new ATOM 0 HA3 GLY A 101 8.791 -14.955 -19.020 1.00 0.00 H new ATOM 1590 N LYS A 102 10.133 -13.043 -20.918 1.00 0.00 N ATOM 1591 CA LYS A 102 10.839 -12.813 -22.173 1.00 0.00 C ATOM 1592 C LYS A 102 12.212 -12.200 -21.920 1.00 0.00 C ATOM 1593 O LYS A 102 13.200 -12.589 -22.543 1.00 0.00 O ATOM 1594 CB LYS A 102 10.019 -11.896 -23.082 1.00 0.00 C ATOM 1595 CG LYS A 102 10.762 -11.453 -24.330 1.00 0.00 C ATOM 1596 CD LYS A 102 11.394 -10.083 -24.147 1.00 0.00 C ATOM 1597 CE LYS A 102 10.668 -9.022 -24.961 1.00 0.00 C ATOM 1598 NZ LYS A 102 9.201 -9.035 -24.706 1.00 0.00 N ATOM 0 H LYS A 102 9.441 -12.330 -20.687 1.00 0.00 H new ATOM 0 HA LYS A 102 10.976 -13.775 -22.666 1.00 0.00 H new ATOM 0 HB2 LYS A 102 9.106 -12.413 -23.377 1.00 0.00 H new ATOM 0 HB3 LYS A 102 9.717 -11.014 -22.517 1.00 0.00 H new ATOM 0 HG2 LYS A 102 11.535 -12.182 -24.572 1.00 0.00 H new ATOM 0 HG3 LYS A 102 10.073 -11.427 -25.174 1.00 0.00 H new ATOM 0 HD2 LYS A 102 11.375 -9.810 -23.092 1.00 0.00 H new ATOM 0 HD3 LYS A 102 12.441 -10.121 -24.448 1.00 0.00 H new ATOM 0 HE2 LYS A 102 11.070 -8.039 -24.717 1.00 0.00 H new ATOM 0 HE3 LYS A 102 10.854 -9.188 -26.022 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 8.807 -8.091 -24.895 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 8.746 -9.731 -25.331 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 9.023 -9.292 -23.714 1.00 0.00 H new ATOM 1612 N GLU A 103 12.267 -11.240 -21.001 1.00 0.00 N ATOM 1613 CA GLU A 103 13.521 -10.575 -20.666 1.00 0.00 C ATOM 1614 C GLU A 103 14.342 -11.418 -19.695 1.00 0.00 C ATOM 1615 O GLU A 103 15.565 -11.506 -19.813 1.00 0.00 O ATOM 1616 CB GLU A 103 13.246 -9.198 -20.057 1.00 0.00 C ATOM 1617 CG GLU A 103 12.406 -9.249 -18.792 1.00 0.00 C ATOM 1618 CD GLU A 103 12.082 -7.870 -18.251 1.00 0.00 C ATOM 1619 OE1 GLU A 103 11.160 -7.223 -18.791 1.00 0.00 O ATOM 1620 OE2 GLU A 103 12.750 -7.438 -17.289 1.00 0.00 O ATOM 0 H GLU A 103 11.459 -10.906 -20.476 1.00 0.00 H new ATOM 0 HA GLU A 103 14.094 -10.451 -21.585 1.00 0.00 H new ATOM 0 HB2 GLU A 103 14.196 -8.713 -19.833 1.00 0.00 H new ATOM 0 HB3 GLU A 103 12.738 -8.578 -20.796 1.00 0.00 H new ATOM 0 HG2 GLU A 103 11.478 -9.782 -18.998 1.00 0.00 H new ATOM 0 HG3 GLU A 103 12.938 -9.818 -18.030 1.00 0.00 H new ATOM 1627 N LEU A 104 13.662 -12.036 -18.736 1.00 0.00 N ATOM 1628 CA LEU A 104 14.327 -12.872 -17.744 1.00 0.00 C ATOM 1629 C LEU A 104 14.692 -14.231 -18.333 1.00 0.00 C ATOM 1630 O LEU A 104 15.607 -14.901 -17.855 1.00 0.00 O ATOM 1631 CB LEU A 104 13.428 -13.060 -16.520 1.00 0.00 C ATOM 1632 CG LEU A 104 13.163 -11.807 -15.684 1.00 0.00 C ATOM 1633 CD1 LEU A 104 11.735 -11.806 -15.162 1.00 0.00 C ATOM 1634 CD2 LEU A 104 14.154 -11.716 -14.533 1.00 0.00 C ATOM 0 H LEU A 104 12.650 -11.974 -18.625 1.00 0.00 H new ATOM 0 HA LEU A 104 15.245 -12.369 -17.440 1.00 0.00 H new ATOM 0 HB2 LEU A 104 12.470 -13.458 -16.855 1.00 0.00 H new ATOM 0 HB3 LEU A 104 13.879 -13.814 -15.875 1.00 0.00 H new ATOM 0 HG LEU A 104 13.295 -10.933 -16.321 1.00 0.00 H new ATOM 0 HD11 LEU A 104 11.565 -10.907 -14.569 1.00 0.00 H new ATOM 0 HD12 LEU A 104 11.041 -11.824 -16.002 1.00 0.00 H new ATOM 0 HD13 LEU A 104 11.574 -12.686 -14.540 1.00 0.00 H new ATOM 0 HD21 LEU A 104 13.951 -10.819 -13.948 1.00 0.00 H new ATOM 0 HD22 LEU A 104 14.053 -12.595 -13.896 1.00 0.00 H new ATOM 0 HD23 LEU A 104 15.168 -11.669 -14.929 1.00 0.00 H new ATOM 1646 N GLY A 105 13.972 -14.631 -19.377 1.00 0.00 N ATOM 1647 CA GLY A 105 14.237 -15.907 -20.016 1.00 0.00 C ATOM 1648 C GLY A 105 13.487 -17.050 -19.361 1.00 0.00 C ATOM 1649 O GLY A 105 13.435 -18.156 -19.900 1.00 0.00 O ATOM 0 H GLY A 105 13.210 -14.094 -19.792 1.00 0.00 H new ATOM 0 HA2 GLY A 105 13.957 -15.848 -21.068 1.00 0.00 H new ATOM 0 HA3 GLY A 105 15.307 -16.112 -19.982 1.00 0.00 H new ATOM 1653 N ILE A 106 12.908 -16.784 -18.195 1.00 0.00 N ATOM 1654 CA ILE A 106 12.158 -17.800 -17.466 1.00 0.00 C ATOM 1655 C ILE A 106 10.832 -18.104 -18.154 1.00 0.00 C ATOM 1656 O ILE A 106 10.130 -17.197 -18.602 1.00 0.00 O ATOM 1657 CB ILE A 106 11.884 -17.364 -16.015 1.00 0.00 C ATOM 1658 CG1 ILE A 106 13.147 -17.515 -15.166 1.00 0.00 C ATOM 1659 CG2 ILE A 106 10.742 -18.178 -15.424 1.00 0.00 C ATOM 1660 CD1 ILE A 106 14.025 -16.283 -15.165 1.00 0.00 C ATOM 0 H ILE A 106 12.944 -15.874 -17.735 1.00 0.00 H new ATOM 0 HA ILE A 106 12.773 -18.700 -17.456 1.00 0.00 H new ATOM 0 HB ILE A 106 11.594 -16.313 -16.016 1.00 0.00 H new ATOM 0 HG12 ILE A 106 12.860 -17.748 -14.141 1.00 0.00 H new ATOM 0 HG13 ILE A 106 13.724 -18.362 -15.536 1.00 0.00 H new ATOM 0 HG21 ILE A 106 10.560 -17.858 -14.398 1.00 0.00 H new ATOM 0 HG22 ILE A 106 9.841 -18.024 -16.017 1.00 0.00 H new ATOM 0 HG23 ILE A 106 11.006 -19.235 -15.433 1.00 0.00 H new ATOM 0 HD11 ILE A 106 14.902 -16.462 -14.543 1.00 0.00 H new ATOM 0 HD12 ILE A 106 14.342 -16.061 -16.184 1.00 0.00 H new ATOM 0 HD13 ILE A 106 13.464 -15.437 -14.767 1.00 0.00 H new ATOM 1672 N LYS A 107 10.493 -19.386 -18.233 1.00 0.00 N ATOM 1673 CA LYS A 107 9.248 -19.812 -18.863 1.00 0.00 C ATOM 1674 C LYS A 107 8.047 -19.153 -18.193 1.00 0.00 C ATOM 1675 O LYS A 107 8.026 -18.968 -16.976 1.00 0.00 O ATOM 1676 CB LYS A 107 9.113 -21.335 -18.794 1.00 0.00 C ATOM 1677 CG LYS A 107 9.482 -22.037 -20.089 1.00 0.00 C ATOM 1678 CD LYS A 107 10.977 -22.297 -20.176 1.00 0.00 C ATOM 1679 CE LYS A 107 11.713 -21.118 -20.795 1.00 0.00 C ATOM 1680 NZ LYS A 107 12.029 -21.354 -22.231 1.00 0.00 N ATOM 0 H LYS A 107 11.063 -20.149 -17.868 1.00 0.00 H new ATOM 0 HA LYS A 107 9.274 -19.503 -19.908 1.00 0.00 H new ATOM 0 HB2 LYS A 107 9.748 -21.712 -17.992 1.00 0.00 H new ATOM 0 HB3 LYS A 107 8.086 -21.589 -18.533 1.00 0.00 H new ATOM 0 HG2 LYS A 107 8.943 -22.982 -20.158 1.00 0.00 H new ATOM 0 HG3 LYS A 107 9.168 -21.428 -20.937 1.00 0.00 H new ATOM 0 HD2 LYS A 107 11.372 -22.491 -19.179 1.00 0.00 H new ATOM 0 HD3 LYS A 107 11.158 -23.193 -20.770 1.00 0.00 H new ATOM 0 HE2 LYS A 107 11.104 -20.219 -20.700 1.00 0.00 H new ATOM 0 HE3 LYS A 107 12.636 -20.937 -20.245 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 12.530 -20.528 -22.616 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 12.631 -22.197 -22.320 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 11.146 -21.502 -22.761 1.00 0.00 H new ATOM 1694 N LEU A 108 7.047 -18.803 -18.995 1.00 0.00 N ATOM 1695 CA LEU A 108 5.840 -18.166 -18.479 1.00 0.00 C ATOM 1696 C LEU A 108 4.754 -18.111 -19.549 1.00 0.00 C ATOM 1697 O LEU A 108 4.967 -17.577 -20.637 1.00 0.00 O ATOM 1698 CB LEU A 108 6.156 -16.754 -17.984 1.00 0.00 C ATOM 1699 CG LEU A 108 5.287 -16.234 -16.839 1.00 0.00 C ATOM 1700 CD1 LEU A 108 3.813 -16.453 -17.145 1.00 0.00 C ATOM 1701 CD2 LEU A 108 5.668 -16.910 -15.530 1.00 0.00 C ATOM 0 H LEU A 108 7.048 -18.949 -20.004 1.00 0.00 H new ATOM 0 HA LEU A 108 5.472 -18.763 -17.644 1.00 0.00 H new ATOM 0 HB2 LEU A 108 7.198 -16.727 -17.664 1.00 0.00 H new ATOM 0 HB3 LEU A 108 6.063 -16.067 -18.825 1.00 0.00 H new ATOM 0 HG LEU A 108 5.460 -15.163 -16.735 1.00 0.00 H new ATOM 0 HD11 LEU A 108 3.210 -16.077 -16.319 1.00 0.00 H new ATOM 0 HD12 LEU A 108 3.548 -15.921 -18.059 1.00 0.00 H new ATOM 0 HD13 LEU A 108 3.623 -17.518 -17.277 1.00 0.00 H new ATOM 0 HD21 LEU A 108 5.039 -16.527 -14.726 1.00 0.00 H new ATOM 0 HD22 LEU A 108 5.525 -17.987 -15.621 1.00 0.00 H new ATOM 0 HD23 LEU A 108 6.713 -16.701 -15.303 1.00 0.00 H new ATOM 2062 N HIS A 133 -3.406 -17.558 -13.092 1.00 0.00 N ATOM 2063 CA HIS A 133 -2.479 -18.636 -12.766 1.00 0.00 C ATOM 2064 C HIS A 133 -1.370 -18.734 -13.809 1.00 0.00 C ATOM 2065 O HIS A 133 -1.633 -18.962 -14.990 1.00 0.00 O ATOM 2066 CB HIS A 133 -3.225 -19.968 -12.671 1.00 0.00 C ATOM 2067 CG HIS A 133 -2.391 -21.084 -12.122 1.00 0.00 C ATOM 2068 ND1 HIS A 133 -1.529 -20.926 -11.057 1.00 0.00 N ATOM 2069 CD2 HIS A 133 -2.290 -22.381 -12.496 1.00 0.00 C ATOM 2070 CE1 HIS A 133 -0.934 -22.077 -10.800 1.00 0.00 C ATOM 2071 NE2 HIS A 133 -1.379 -22.976 -11.659 1.00 0.00 N ATOM 0 HA HIS A 133 -2.026 -18.412 -11.800 1.00 0.00 H new ATOM 0 HB2 HIS A 133 -4.104 -19.838 -12.040 1.00 0.00 H new ATOM 0 HB3 HIS A 133 -3.582 -20.246 -13.662 1.00 0.00 H new ATOM 0 HD1 HIS A 133 -1.375 -20.056 -10.547 1.00 0.00 H new ATOM 0 HD2 HIS A 133 -2.826 -22.859 -13.303 1.00 0.00 H new ATOM 0 HE1 HIS A 133 -0.208 -22.253 -10.020 1.00 0.00 H new ATOM 2079 N VAL A 134 -0.129 -18.558 -13.365 1.00 0.00 N ATOM 2080 CA VAL A 134 1.020 -18.627 -14.260 1.00 0.00 C ATOM 2081 C VAL A 134 1.746 -19.960 -14.122 1.00 0.00 C ATOM 2082 O VAL A 134 1.973 -20.441 -13.012 1.00 0.00 O ATOM 2083 CB VAL A 134 2.013 -17.482 -13.986 1.00 0.00 C ATOM 2084 CG1 VAL A 134 1.312 -16.135 -14.063 1.00 0.00 C ATOM 2085 CG2 VAL A 134 2.679 -17.669 -12.630 1.00 0.00 C ATOM 0 H VAL A 134 0.106 -18.367 -12.391 1.00 0.00 H new ATOM 0 HA VAL A 134 0.637 -18.530 -15.276 1.00 0.00 H new ATOM 0 HB VAL A 134 2.787 -17.505 -14.753 1.00 0.00 H new ATOM 0 HG11 VAL A 134 2.030 -15.339 -13.866 1.00 0.00 H new ATOM 0 HG12 VAL A 134 0.887 -16.002 -15.058 1.00 0.00 H new ATOM 0 HG13 VAL A 134 0.516 -16.096 -13.320 1.00 0.00 H new ATOM 0 HG21 VAL A 134 3.378 -16.851 -12.452 1.00 0.00 H new ATOM 0 HG22 VAL A 134 1.919 -17.673 -11.849 1.00 0.00 H new ATOM 0 HG23 VAL A 134 3.218 -18.616 -12.617 1.00 0.00 H new ATOM 2095 N GLU A 135 2.107 -20.552 -15.256 1.00 0.00 N ATOM 2096 CA GLU A 135 2.807 -21.831 -15.260 1.00 0.00 C ATOM 2097 C GLU A 135 3.938 -21.828 -16.285 1.00 0.00 C ATOM 2098 O GLU A 135 4.009 -20.950 -17.146 1.00 0.00 O ATOM 2099 CB GLU A 135 1.832 -22.970 -15.563 1.00 0.00 C ATOM 2100 CG GLU A 135 1.382 -23.016 -17.014 1.00 0.00 C ATOM 2101 CD GLU A 135 1.855 -24.265 -17.732 1.00 0.00 C ATOM 2102 OE1 GLU A 135 1.896 -25.337 -17.092 1.00 0.00 O ATOM 2103 OE2 GLU A 135 2.184 -24.171 -18.933 1.00 0.00 O ATOM 0 H GLU A 135 1.926 -20.167 -16.183 1.00 0.00 H new ATOM 0 HA GLU A 135 3.237 -21.985 -14.270 1.00 0.00 H new ATOM 0 HB2 GLU A 135 2.304 -23.919 -15.307 1.00 0.00 H new ATOM 0 HB3 GLU A 135 0.956 -22.867 -14.923 1.00 0.00 H new ATOM 0 HG2 GLU A 135 0.294 -22.968 -17.055 1.00 0.00 H new ATOM 0 HG3 GLU A 135 1.760 -22.137 -17.536 1.00 0.00 H new ATOM 2110 N LEU A 136 4.820 -22.816 -16.185 1.00 0.00 N ATOM 2111 CA LEU A 136 5.949 -22.929 -17.102 1.00 0.00 C ATOM 2112 C LEU A 136 5.562 -23.717 -18.349 1.00 0.00 C ATOM 2113 O LEU A 136 4.823 -24.699 -18.270 1.00 0.00 O ATOM 2114 CB LEU A 136 7.132 -23.603 -16.406 1.00 0.00 C ATOM 2115 CG LEU A 136 7.682 -22.886 -15.172 1.00 0.00 C ATOM 2116 CD1 LEU A 136 7.777 -21.389 -15.422 1.00 0.00 C ATOM 2117 CD2 LEU A 136 6.811 -23.172 -13.957 1.00 0.00 C ATOM 0 H LEU A 136 4.775 -23.550 -15.478 1.00 0.00 H new ATOM 0 HA LEU A 136 6.239 -21.923 -17.406 1.00 0.00 H new ATOM 0 HB2 LEU A 136 6.831 -24.609 -16.113 1.00 0.00 H new ATOM 0 HB3 LEU A 136 7.940 -23.711 -17.129 1.00 0.00 H new ATOM 0 HG LEU A 136 8.685 -23.264 -14.973 1.00 0.00 H new ATOM 0 HD11 LEU A 136 8.170 -20.896 -14.533 1.00 0.00 H new ATOM 0 HD12 LEU A 136 8.443 -21.202 -16.265 1.00 0.00 H new ATOM 0 HD13 LEU A 136 6.786 -20.994 -15.648 1.00 0.00 H new ATOM 0 HD21 LEU A 136 7.217 -22.654 -13.088 1.00 0.00 H new ATOM 0 HD22 LEU A 136 5.796 -22.822 -14.146 1.00 0.00 H new ATOM 0 HD23 LEU A 136 6.795 -24.245 -13.765 1.00 0.00 H new ATOM 2129 N VAL A 137 6.067 -23.283 -19.499 1.00 0.00 N ATOM 2130 CA VAL A 137 5.777 -23.950 -20.762 1.00 0.00 C ATOM 2131 C VAL A 137 7.060 -24.371 -21.470 1.00 0.00 C ATOM 2132 O VAL A 137 6.992 -25.098 -22.459 1.00 0.00 O ATOM 2133 CB VAL A 137 4.959 -23.043 -21.701 1.00 0.00 C ATOM 2134 CG1 VAL A 137 3.500 -23.009 -21.274 1.00 0.00 C ATOM 2135 CG2 VAL A 137 5.547 -21.641 -21.731 1.00 0.00 C ATOM 0 H VAL A 137 6.680 -22.472 -19.582 1.00 0.00 H new ATOM 0 HA VAL A 137 5.190 -24.837 -20.523 1.00 0.00 H new ATOM 0 HB VAL A 137 5.007 -23.455 -22.709 1.00 0.00 H new ATOM 0 HG11 VAL A 137 2.938 -22.363 -21.949 1.00 0.00 H new ATOM 0 HG12 VAL A 137 3.087 -24.017 -21.309 1.00 0.00 H new ATOM 0 HG13 VAL A 137 3.427 -22.622 -20.258 1.00 0.00 H new ATOM 0 HG21 VAL A 137 4.957 -21.013 -22.399 1.00 0.00 H new ATOM 0 HG22 VAL A 137 5.530 -21.218 -20.727 1.00 0.00 H new ATOM 0 HG23 VAL A 137 6.576 -21.685 -22.089 1.00 0.00 H new