USER MOD reduce.3.24.130724 H: found=0, std=0, add=740, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 740 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 68 SER OG : rot -140:sc= -0.725 USER MOD Set 1.2: A 71 GLN : amide:sc= -0.0561 X(o=-0.78,f=-0.72) USER MOD Set 2.1: A 27 TYR OH : rot 165:sc= 0.2 USER MOD Set 2.2: A 40 SER OG : rot 110:sc= 1.99 USER MOD Single : A 4 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0.0119 USER MOD Single : A 15 THR OG1 : rot 97:sc= 0.107 USER MOD Single : A 16 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 GLN : amide:sc= -0.716 K(o=-0.72,f=-1.6) USER MOD Single : A 26 HIS : no HD1:sc= -1.61 K(o=-1.6,f=-0.28) USER MOD Single : A 28 THR OG1 : rot 180:sc= -0.619 USER MOD Single : A 30 THR OG1 : rot 74:sc= 0.838 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 GLN : amide:sc= -0.0776 X(o=-0.078,f=-0.02) USER MOD Single : A 67 MET CE :methyl -161:sc= -4.37! (180deg=-5.72!) USER MOD Single : A 74 LYS NZ :NH3+ -148:sc= 0 (180deg=-0.137) USER MOD Single : A 77 CYS SG : rot 140:sc= 0 USER MOD Single : A 78 SER OG : rot 180:sc= 0.0867 USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 TYR OH : rot -48:sc= 1.09 USER MOD Single : A 85 SER OG : rot 180:sc= 0.0619 USER MOD Single : A 88 HIS : no HD1:sc= 0 X(o=0,f=-0.48) USER MOD Single : A 95 ASN : amide:sc= -2.09 X(o=-2.1,f=-2.4!) USER MOD Single : A 97 THR OG1 : rot 180:sc= 0.00131 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 18 N GLY A 2 1.076 -0.617 -2.945 1.00 0.00 N ATOM 19 CA GLY A 2 0.550 -1.297 -4.114 1.00 0.00 C ATOM 20 C GLY A 2 -0.958 -1.181 -4.222 1.00 0.00 C ATOM 21 O GLY A 2 -1.529 -1.403 -5.290 1.00 0.00 O ATOM 0 HA2 GLY A 2 1.009 -0.880 -5.010 1.00 0.00 H new ATOM 0 HA3 GLY A 2 0.829 -2.350 -4.074 1.00 0.00 H new ATOM 25 N VAL A 3 -1.604 -0.834 -3.114 1.00 0.00 N ATOM 26 CA VAL A 3 -3.055 -0.690 -3.088 1.00 0.00 C ATOM 27 C VAL A 3 -3.478 0.440 -2.157 1.00 0.00 C ATOM 28 O VAL A 3 -3.022 0.521 -1.017 1.00 0.00 O ATOM 29 CB VAL A 3 -3.741 -1.994 -2.640 1.00 0.00 C ATOM 30 CG1 VAL A 3 -3.211 -2.438 -1.286 1.00 0.00 C ATOM 31 CG2 VAL A 3 -5.251 -1.814 -2.598 1.00 0.00 C ATOM 0 H VAL A 3 -1.146 -0.647 -2.222 1.00 0.00 H new ATOM 0 HA VAL A 3 -3.368 -0.455 -4.105 1.00 0.00 H new ATOM 0 HB VAL A 3 -3.511 -2.773 -3.366 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -3.707 -3.361 -0.986 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -2.137 -2.609 -1.354 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -3.409 -1.663 -0.546 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -5.720 -2.745 -2.280 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -5.503 -1.021 -1.894 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -5.613 -1.546 -3.591 1.00 0.00 H new ATOM 41 N GLN A 4 -4.354 1.310 -2.651 1.00 0.00 N ATOM 42 CA GLN A 4 -4.839 2.436 -1.862 1.00 0.00 C ATOM 43 C GLN A 4 -6.358 2.401 -1.739 1.00 0.00 C ATOM 44 O GLN A 4 -7.055 1.958 -2.652 1.00 0.00 O ATOM 45 CB GLN A 4 -4.397 3.757 -2.494 1.00 0.00 C ATOM 46 CG GLN A 4 -3.203 4.395 -1.801 1.00 0.00 C ATOM 47 CD GLN A 4 -1.917 3.626 -2.030 1.00 0.00 C ATOM 48 OE1 GLN A 4 -1.390 3.591 -3.142 1.00 0.00 O ATOM 49 NE2 GLN A 4 -1.403 3.005 -0.975 1.00 0.00 N ATOM 0 H GLN A 4 -4.742 1.256 -3.593 1.00 0.00 H new ATOM 0 HA GLN A 4 -4.410 2.358 -0.863 1.00 0.00 H new ATOM 0 HB2 GLN A 4 -4.149 3.584 -3.541 1.00 0.00 H new ATOM 0 HB3 GLN A 4 -5.233 4.456 -2.476 1.00 0.00 H new ATOM 0 HG2 GLN A 4 -3.081 5.416 -2.162 1.00 0.00 H new ATOM 0 HG3 GLN A 4 -3.399 4.457 -0.731 1.00 0.00 H new ATOM 0 HE21 GLN A 4 -1.873 3.060 -0.071 1.00 0.00 H new ATOM 0 HE22 GLN A 4 -0.538 2.472 -1.068 1.00 0.00 H new ATOM 58 N VAL A 5 -6.867 2.870 -0.604 1.00 0.00 N ATOM 59 CA VAL A 5 -8.304 2.893 -0.362 1.00 0.00 C ATOM 60 C VAL A 5 -8.800 4.315 -0.127 1.00 0.00 C ATOM 61 O VAL A 5 -8.312 5.015 0.760 1.00 0.00 O ATOM 62 CB VAL A 5 -8.683 2.022 0.850 1.00 0.00 C ATOM 63 CG1 VAL A 5 -7.909 2.459 2.085 1.00 0.00 C ATOM 64 CG2 VAL A 5 -10.182 2.082 1.102 1.00 0.00 C ATOM 0 H VAL A 5 -6.305 3.239 0.163 1.00 0.00 H new ATOM 0 HA VAL A 5 -8.781 2.488 -1.255 1.00 0.00 H new ATOM 0 HB VAL A 5 -8.416 0.988 0.630 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -8.190 1.832 2.931 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -6.840 2.359 1.899 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -8.142 3.500 2.311 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -10.432 1.461 1.962 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -10.477 3.112 1.301 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -10.714 1.716 0.224 1.00 0.00 H new ATOM 74 N VAL A 6 -9.774 4.737 -0.927 1.00 0.00 N ATOM 75 CA VAL A 6 -10.337 6.076 -0.806 1.00 0.00 C ATOM 76 C VAL A 6 -11.760 6.026 -0.260 1.00 0.00 C ATOM 77 O VAL A 6 -12.716 5.811 -1.005 1.00 0.00 O ATOM 78 CB VAL A 6 -10.345 6.807 -2.161 1.00 0.00 C ATOM 79 CG1 VAL A 6 -10.755 8.261 -1.982 1.00 0.00 C ATOM 80 CG2 VAL A 6 -8.981 6.708 -2.827 1.00 0.00 C ATOM 0 H VAL A 6 -10.190 4.170 -1.666 1.00 0.00 H new ATOM 0 HA VAL A 6 -9.702 6.624 -0.110 1.00 0.00 H new ATOM 0 HB VAL A 6 -11.077 6.325 -2.809 1.00 0.00 H new ATOM 0 HG11 VAL A 6 -10.755 8.761 -2.951 1.00 0.00 H new ATOM 0 HG12 VAL A 6 -11.755 8.307 -1.550 1.00 0.00 H new ATOM 0 HG13 VAL A 6 -10.050 8.759 -1.317 1.00 0.00 H new ATOM 0 HG21 VAL A 6 -9.004 7.230 -3.784 1.00 0.00 H new ATOM 0 HG22 VAL A 6 -8.228 7.163 -2.184 1.00 0.00 H new ATOM 0 HG23 VAL A 6 -8.732 5.660 -2.992 1.00 0.00 H new ATOM 90 N THR A 7 -11.894 6.226 1.048 1.00 0.00 N ATOM 91 CA THR A 7 -13.199 6.203 1.695 1.00 0.00 C ATOM 92 C THR A 7 -14.187 7.110 0.972 1.00 0.00 C ATOM 93 O THR A 7 -13.941 8.306 0.806 1.00 0.00 O ATOM 94 CB THR A 7 -13.103 6.639 3.169 1.00 0.00 C ATOM 95 OG1 THR A 7 -11.958 6.039 3.784 1.00 0.00 O ATOM 96 CG2 THR A 7 -14.359 6.247 3.932 1.00 0.00 C ATOM 0 H THR A 7 -11.114 6.406 1.680 1.00 0.00 H new ATOM 0 HA THR A 7 -13.555 5.174 1.651 1.00 0.00 H new ATOM 0 HB THR A 7 -13.003 7.724 3.198 1.00 0.00 H new ATOM 0 HG1 THR A 7 -11.903 6.323 4.720 1.00 0.00 H new ATOM 0 HG21 THR A 7 -14.268 6.565 4.971 1.00 0.00 H new ATOM 0 HG22 THR A 7 -15.225 6.729 3.479 1.00 0.00 H new ATOM 0 HG23 THR A 7 -14.485 5.165 3.894 1.00 0.00 H new ATOM 104 N LEU A 8 -15.306 6.536 0.543 1.00 0.00 N ATOM 105 CA LEU A 8 -16.333 7.295 -0.163 1.00 0.00 C ATOM 106 C LEU A 8 -17.543 7.538 0.734 1.00 0.00 C ATOM 107 O LEU A 8 -18.006 8.669 0.875 1.00 0.00 O ATOM 108 CB LEU A 8 -16.764 6.552 -1.429 1.00 0.00 C ATOM 109 CG LEU A 8 -15.683 6.357 -2.493 1.00 0.00 C ATOM 110 CD1 LEU A 8 -16.038 5.196 -3.408 1.00 0.00 C ATOM 111 CD2 LEU A 8 -15.491 7.634 -3.298 1.00 0.00 C ATOM 0 H LEU A 8 -15.525 5.548 0.672 1.00 0.00 H new ATOM 0 HA LEU A 8 -15.910 8.260 -0.441 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -17.142 5.571 -1.140 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -17.595 7.094 -1.879 1.00 0.00 H new ATOM 0 HG LEU A 8 -14.744 6.123 -1.991 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -15.257 5.072 -4.159 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -16.124 4.282 -2.820 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -16.988 5.400 -3.902 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -14.718 7.477 -4.050 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -16.427 7.899 -3.789 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -15.190 8.442 -2.632 1.00 0.00 H new ATOM 123 N ALA A 9 -18.049 6.468 1.339 1.00 0.00 N ATOM 124 CA ALA A 9 -19.202 6.566 2.225 1.00 0.00 C ATOM 125 C ALA A 9 -19.020 5.692 3.462 1.00 0.00 C ATOM 126 O ALA A 9 -19.077 4.465 3.380 1.00 0.00 O ATOM 127 CB ALA A 9 -20.472 6.177 1.484 1.00 0.00 C ATOM 0 H ALA A 9 -17.678 5.524 1.232 1.00 0.00 H new ATOM 0 HA ALA A 9 -19.289 7.602 2.554 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -21.325 6.255 2.158 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -20.618 6.846 0.636 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -20.385 5.151 1.126 1.00 0.00 H new ATOM 133 N ALA A 10 -18.801 6.331 4.606 1.00 0.00 N ATOM 134 CA ALA A 10 -18.612 5.612 5.859 1.00 0.00 C ATOM 135 C ALA A 10 -19.788 4.683 6.141 1.00 0.00 C ATOM 136 O ALA A 10 -20.932 4.999 5.818 1.00 0.00 O ATOM 137 CB ALA A 10 -18.423 6.592 7.007 1.00 0.00 C ATOM 0 H ALA A 10 -18.750 7.346 4.691 1.00 0.00 H new ATOM 0 HA ALA A 10 -17.714 5.001 5.767 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -18.283 6.041 7.937 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -17.546 7.211 6.816 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -19.304 7.228 7.091 1.00 0.00 H new ATOM 143 N GLY A 11 -19.498 3.535 6.746 1.00 0.00 N ATOM 144 CA GLY A 11 -20.542 2.578 7.061 1.00 0.00 C ATOM 145 C GLY A 11 -20.583 2.228 8.535 1.00 0.00 C ATOM 146 O GLY A 11 -20.699 3.110 9.387 1.00 0.00 O ATOM 0 H GLY A 11 -18.558 3.251 7.023 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -21.507 2.986 6.761 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -20.385 1.670 6.479 1.00 0.00 H new ATOM 150 N ASP A 12 -20.489 0.938 8.838 1.00 0.00 N ATOM 151 CA ASP A 12 -20.517 0.473 10.220 1.00 0.00 C ATOM 152 C ASP A 12 -19.213 0.815 10.934 1.00 0.00 C ATOM 153 O ASP A 12 -19.217 1.194 12.105 1.00 0.00 O ATOM 154 CB ASP A 12 -20.758 -1.037 10.268 1.00 0.00 C ATOM 155 CG ASP A 12 -21.358 -1.485 11.586 1.00 0.00 C ATOM 156 OD1 ASP A 12 -21.434 -0.656 12.516 1.00 0.00 O ATOM 157 OD2 ASP A 12 -21.751 -2.666 11.688 1.00 0.00 O ATOM 0 H ASP A 12 -20.393 0.196 8.145 1.00 0.00 H new ATOM 0 HA ASP A 12 -21.335 0.980 10.732 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -21.424 -1.322 9.453 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -19.814 -1.558 10.106 1.00 0.00 H new ATOM 162 N GLU A 13 -18.099 0.678 10.221 1.00 0.00 N ATOM 163 CA GLU A 13 -16.789 0.971 10.789 1.00 0.00 C ATOM 164 C GLU A 13 -16.591 0.235 12.111 1.00 0.00 C ATOM 165 O GLU A 13 -15.907 0.724 13.010 1.00 0.00 O ATOM 166 CB GLU A 13 -16.626 2.478 11.002 1.00 0.00 C ATOM 167 CG GLU A 13 -16.557 3.271 9.708 1.00 0.00 C ATOM 168 CD GLU A 13 -15.972 4.657 9.904 1.00 0.00 C ATOM 169 OE1 GLU A 13 -16.226 5.262 10.967 1.00 0.00 O ATOM 170 OE2 GLU A 13 -15.262 5.136 8.996 1.00 0.00 O ATOM 0 H GLU A 13 -18.078 0.366 9.250 1.00 0.00 H new ATOM 0 HA GLU A 13 -16.032 0.627 10.085 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -17.461 2.845 11.599 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -15.719 2.659 11.578 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -15.953 2.725 8.983 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -17.558 3.359 9.287 1.00 0.00 H new ATOM 177 N ALA A 14 -17.196 -0.943 12.221 1.00 0.00 N ATOM 178 CA ALA A 14 -17.086 -1.748 13.432 1.00 0.00 C ATOM 179 C ALA A 14 -16.904 -3.224 13.095 1.00 0.00 C ATOM 180 O ALA A 14 -16.110 -3.922 13.726 1.00 0.00 O ATOM 181 CB ALA A 14 -18.314 -1.552 14.309 1.00 0.00 C ATOM 0 H ALA A 14 -17.767 -1.361 11.487 1.00 0.00 H new ATOM 0 HA ALA A 14 -16.205 -1.416 13.981 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -18.219 -2.159 15.209 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -18.399 -0.501 14.587 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -19.205 -1.855 13.760 1.00 0.00 H new ATOM 187 N THR A 15 -17.645 -3.694 12.097 1.00 0.00 N ATOM 188 CA THR A 15 -17.567 -5.088 11.677 1.00 0.00 C ATOM 189 C THR A 15 -16.653 -5.247 10.468 1.00 0.00 C ATOM 190 O THR A 15 -17.000 -4.843 9.358 1.00 0.00 O ATOM 191 CB THR A 15 -18.959 -5.650 11.333 1.00 0.00 C ATOM 192 OG1 THR A 15 -19.922 -5.191 12.287 1.00 0.00 O ATOM 193 CG2 THR A 15 -18.939 -7.171 11.315 1.00 0.00 C ATOM 0 H THR A 15 -18.307 -3.130 11.564 1.00 0.00 H new ATOM 0 HA THR A 15 -17.155 -5.649 12.516 1.00 0.00 H new ATOM 0 HB THR A 15 -19.235 -5.295 10.340 1.00 0.00 H new ATOM 0 HG1 THR A 15 -20.387 -4.406 11.930 1.00 0.00 H new ATOM 0 HG21 THR A 15 -19.933 -7.545 11.070 1.00 0.00 H new ATOM 0 HG22 THR A 15 -18.226 -7.517 10.566 1.00 0.00 H new ATOM 0 HG23 THR A 15 -18.643 -7.543 12.296 1.00 0.00 H new ATOM 201 N TYR A 16 -15.484 -5.839 10.689 1.00 0.00 N ATOM 202 CA TYR A 16 -14.520 -6.051 9.616 1.00 0.00 C ATOM 203 C TYR A 16 -14.331 -7.539 9.338 1.00 0.00 C ATOM 204 O TYR A 16 -14.531 -8.389 10.206 1.00 0.00 O ATOM 205 CB TYR A 16 -13.176 -5.414 9.977 1.00 0.00 C ATOM 206 CG TYR A 16 -13.249 -3.916 10.172 1.00 0.00 C ATOM 207 CD1 TYR A 16 -13.818 -3.372 11.317 1.00 0.00 C ATOM 208 CD2 TYR A 16 -12.750 -3.046 9.212 1.00 0.00 C ATOM 209 CE1 TYR A 16 -13.887 -2.004 11.500 1.00 0.00 C ATOM 210 CE2 TYR A 16 -12.814 -1.677 9.386 1.00 0.00 C ATOM 211 CZ TYR A 16 -13.383 -1.161 10.532 1.00 0.00 C ATOM 212 OH TYR A 16 -13.450 0.202 10.709 1.00 0.00 O ATOM 0 H TYR A 16 -15.182 -6.180 11.601 1.00 0.00 H new ATOM 0 HA TYR A 16 -14.909 -5.578 8.714 1.00 0.00 H new ATOM 0 HB2 TYR A 16 -12.800 -5.873 10.891 1.00 0.00 H new ATOM 0 HB3 TYR A 16 -12.456 -5.635 9.189 1.00 0.00 H new ATOM 0 HD1 TYR A 16 -14.213 -4.030 12.077 1.00 0.00 H new ATOM 0 HD2 TYR A 16 -12.304 -3.446 8.314 1.00 0.00 H new ATOM 0 HE1 TYR A 16 -14.333 -1.598 12.396 1.00 0.00 H new ATOM 0 HE2 TYR A 16 -12.421 -1.014 8.629 1.00 0.00 H new ATOM 0 HH TYR A 16 -13.050 0.652 9.936 1.00 0.00 H new ATOM 222 N PRO A 17 -13.936 -7.863 8.098 1.00 0.00 N ATOM 223 CA PRO A 17 -13.711 -9.248 7.676 1.00 0.00 C ATOM 224 C PRO A 17 -12.479 -9.861 8.333 1.00 0.00 C ATOM 225 O PRO A 17 -11.399 -9.271 8.325 1.00 0.00 O ATOM 226 CB PRO A 17 -13.505 -9.129 6.163 1.00 0.00 C ATOM 227 CG PRO A 17 -13.012 -7.738 5.956 1.00 0.00 C ATOM 228 CD PRO A 17 -13.679 -6.901 7.013 1.00 0.00 C ATOM 0 HA PRO A 17 -14.538 -9.899 7.958 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -12.784 -9.862 5.803 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -14.435 -9.304 5.622 1.00 0.00 H new ATOM 0 HG2 PRO A 17 -11.927 -7.691 6.048 1.00 0.00 H new ATOM 0 HG3 PRO A 17 -13.263 -7.379 4.958 1.00 0.00 H new ATOM 0 HD2 PRO A 17 -13.037 -6.085 7.344 1.00 0.00 H new ATOM 0 HD3 PRO A 17 -14.602 -6.452 6.647 1.00 0.00 H new ATOM 236 N LYS A 18 -12.649 -11.050 8.903 1.00 0.00 N ATOM 237 CA LYS A 18 -11.551 -11.745 9.565 1.00 0.00 C ATOM 238 C LYS A 18 -10.736 -12.555 8.561 1.00 0.00 C ATOM 239 O LYS A 18 -11.276 -13.072 7.583 1.00 0.00 O ATOM 240 CB LYS A 18 -12.091 -12.667 10.661 1.00 0.00 C ATOM 241 CG LYS A 18 -11.107 -12.907 11.793 1.00 0.00 C ATOM 242 CD LYS A 18 -11.745 -13.685 12.931 1.00 0.00 C ATOM 243 CE LYS A 18 -10.722 -14.062 13.991 1.00 0.00 C ATOM 244 NZ LYS A 18 -9.934 -15.264 13.599 1.00 0.00 N ATOM 0 H LYS A 18 -13.537 -11.552 8.920 1.00 0.00 H new ATOM 0 HA LYS A 18 -10.900 -10.997 10.016 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -13.004 -12.235 11.070 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -12.362 -13.625 10.217 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -10.244 -13.455 11.416 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -10.740 -11.951 12.166 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -12.536 -13.087 13.384 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -12.213 -14.588 12.538 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -10.046 -13.223 14.158 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -11.231 -14.254 14.935 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -9.248 -15.489 14.348 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -10.576 -16.071 13.464 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -9.427 -15.073 12.711 1.00 0.00 H new ATOM 258 N ALA A 19 -9.436 -12.662 8.811 1.00 0.00 N ATOM 259 CA ALA A 19 -8.548 -13.411 7.931 1.00 0.00 C ATOM 260 C ALA A 19 -8.989 -14.866 7.816 1.00 0.00 C ATOM 261 O ALA A 19 -8.920 -15.625 8.782 1.00 0.00 O ATOM 262 CB ALA A 19 -7.114 -13.331 8.435 1.00 0.00 C ATOM 0 H ALA A 19 -8.974 -12.239 9.616 1.00 0.00 H new ATOM 0 HA ALA A 19 -8.598 -12.963 6.938 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -6.462 -13.895 7.768 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -6.795 -12.289 8.459 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -7.057 -13.752 9.439 1.00 0.00 H new ATOM 268 N GLY A 20 -9.445 -15.249 6.627 1.00 0.00 N ATOM 269 CA GLY A 20 -9.893 -16.612 6.408 1.00 0.00 C ATOM 270 C GLY A 20 -11.403 -16.726 6.358 1.00 0.00 C ATOM 271 O GLY A 20 -11.941 -17.766 5.979 1.00 0.00 O ATOM 0 H GLY A 20 -9.512 -14.640 5.812 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -9.473 -16.983 5.473 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -9.510 -17.249 7.205 1.00 0.00 H new ATOM 275 N GLN A 21 -12.089 -15.654 6.743 1.00 0.00 N ATOM 276 CA GLN A 21 -13.547 -15.640 6.743 1.00 0.00 C ATOM 277 C GLN A 21 -14.086 -15.172 5.395 1.00 0.00 C ATOM 278 O GLN A 21 -13.364 -14.569 4.601 1.00 0.00 O ATOM 279 CB GLN A 21 -14.069 -14.732 7.858 1.00 0.00 C ATOM 280 CG GLN A 21 -14.392 -15.474 9.145 1.00 0.00 C ATOM 281 CD GLN A 21 -15.515 -14.823 9.927 1.00 0.00 C ATOM 282 OE1 GLN A 21 -16.485 -15.480 10.306 1.00 0.00 O ATOM 283 NE2 GLN A 21 -15.390 -13.524 10.174 1.00 0.00 N ATOM 0 H GLN A 21 -11.659 -14.785 7.059 1.00 0.00 H new ATOM 0 HA GLN A 21 -13.896 -16.657 6.920 1.00 0.00 H new ATOM 0 HB2 GLN A 21 -13.325 -13.964 8.068 1.00 0.00 H new ATOM 0 HB3 GLN A 21 -14.966 -14.220 7.509 1.00 0.00 H new ATOM 0 HG2 GLN A 21 -14.667 -16.502 8.908 1.00 0.00 H new ATOM 0 HG3 GLN A 21 -13.499 -15.519 9.768 1.00 0.00 H new ATOM 0 HE21 GLN A 21 -14.569 -13.018 9.841 1.00 0.00 H new ATOM 0 HE22 GLN A 21 -16.115 -13.032 10.697 1.00 0.00 H new ATOM 292 N VAL A 22 -15.361 -15.453 5.143 1.00 0.00 N ATOM 293 CA VAL A 22 -15.998 -15.060 3.892 1.00 0.00 C ATOM 294 C VAL A 22 -16.641 -13.683 4.012 1.00 0.00 C ATOM 295 O VAL A 22 -17.297 -13.377 5.007 1.00 0.00 O ATOM 296 CB VAL A 22 -17.070 -16.080 3.464 1.00 0.00 C ATOM 297 CG1 VAL A 22 -18.116 -16.245 4.556 1.00 0.00 C ATOM 298 CG2 VAL A 22 -17.717 -15.654 2.155 1.00 0.00 C ATOM 0 H VAL A 22 -15.973 -15.952 5.789 1.00 0.00 H new ATOM 0 HA VAL A 22 -15.215 -15.027 3.134 1.00 0.00 H new ATOM 0 HB VAL A 22 -16.587 -17.045 3.308 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -18.865 -16.969 4.236 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -17.636 -16.598 5.469 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -18.597 -15.286 4.747 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -18.472 -16.386 1.867 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -18.187 -14.679 2.282 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -16.957 -15.592 1.377 1.00 0.00 H new ATOM 308 N ALA A 23 -16.447 -12.855 2.990 1.00 0.00 N ATOM 309 CA ALA A 23 -17.010 -11.511 2.979 1.00 0.00 C ATOM 310 C ALA A 23 -17.667 -11.201 1.638 1.00 0.00 C ATOM 311 O ALA A 23 -17.195 -11.639 0.588 1.00 0.00 O ATOM 312 CB ALA A 23 -15.931 -10.484 3.290 1.00 0.00 C ATOM 0 H ALA A 23 -15.904 -13.092 2.160 1.00 0.00 H new ATOM 0 HA ALA A 23 -17.778 -11.460 3.750 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -16.366 -9.485 3.278 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -15.510 -10.685 4.275 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -15.143 -10.546 2.539 1.00 0.00 H new ATOM 318 N VAL A 24 -18.759 -10.444 1.679 1.00 0.00 N ATOM 319 CA VAL A 24 -19.480 -10.076 0.467 1.00 0.00 C ATOM 320 C VAL A 24 -19.483 -8.565 0.267 1.00 0.00 C ATOM 321 O VAL A 24 -19.894 -7.811 1.149 1.00 0.00 O ATOM 322 CB VAL A 24 -20.935 -10.581 0.504 1.00 0.00 C ATOM 323 CG1 VAL A 24 -21.601 -10.390 -0.850 1.00 0.00 C ATOM 324 CG2 VAL A 24 -20.981 -12.040 0.930 1.00 0.00 C ATOM 0 H VAL A 24 -19.164 -10.074 2.539 1.00 0.00 H new ATOM 0 HA VAL A 24 -18.960 -10.549 -0.366 1.00 0.00 H new ATOM 0 HB VAL A 24 -21.487 -9.995 1.239 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -22.628 -10.752 -0.805 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -21.601 -9.331 -1.109 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -21.052 -10.949 -1.608 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -22.016 -12.380 0.951 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -20.415 -12.644 0.221 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -20.545 -12.143 1.924 1.00 0.00 H new ATOM 334 N VAL A 25 -19.021 -8.127 -0.900 1.00 0.00 N ATOM 335 CA VAL A 25 -18.971 -6.705 -1.218 1.00 0.00 C ATOM 336 C VAL A 25 -19.288 -6.459 -2.689 1.00 0.00 C ATOM 337 O VAL A 25 -19.404 -7.399 -3.476 1.00 0.00 O ATOM 338 CB VAL A 25 -17.590 -6.105 -0.894 1.00 0.00 C ATOM 339 CG1 VAL A 25 -17.068 -6.649 0.427 1.00 0.00 C ATOM 340 CG2 VAL A 25 -16.609 -6.389 -2.022 1.00 0.00 C ATOM 0 H VAL A 25 -18.676 -8.737 -1.641 1.00 0.00 H new ATOM 0 HA VAL A 25 -19.725 -6.216 -0.600 1.00 0.00 H new ATOM 0 HB VAL A 25 -17.696 -5.024 -0.798 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -16.091 -6.214 0.639 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -17.762 -6.390 1.227 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -16.976 -7.733 0.363 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -15.638 -5.958 -1.777 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -16.506 -7.466 -2.152 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -16.980 -5.946 -2.947 1.00 0.00 H new ATOM 350 N HIS A 26 -19.427 -5.188 -3.054 1.00 0.00 N ATOM 351 CA HIS A 26 -19.729 -4.818 -4.432 1.00 0.00 C ATOM 352 C HIS A 26 -18.535 -4.128 -5.084 1.00 0.00 C ATOM 353 O HIS A 26 -18.019 -3.138 -4.565 1.00 0.00 O ATOM 354 CB HIS A 26 -20.952 -3.901 -4.479 1.00 0.00 C ATOM 355 CG HIS A 26 -22.241 -4.631 -4.697 1.00 0.00 C ATOM 356 ND1 HIS A 26 -22.471 -5.443 -5.788 1.00 0.00 N ATOM 357 CD2 HIS A 26 -23.372 -4.671 -3.955 1.00 0.00 C ATOM 358 CE1 HIS A 26 -23.689 -5.948 -5.708 1.00 0.00 C ATOM 359 NE2 HIS A 26 -24.257 -5.496 -4.605 1.00 0.00 N ATOM 0 H HIS A 26 -19.335 -4.398 -2.415 1.00 0.00 H new ATOM 0 HA HIS A 26 -19.946 -5.730 -4.988 1.00 0.00 H new ATOM 0 HB2 HIS A 26 -21.014 -3.343 -3.544 1.00 0.00 H new ATOM 0 HB3 HIS A 26 -20.818 -3.171 -5.277 1.00 0.00 H new ATOM 0 HD2 HIS A 26 -23.546 -4.151 -3.025 1.00 0.00 H new ATOM 0 HE1 HIS A 26 -24.143 -6.617 -6.424 1.00 0.00 H new ATOM 0 HE2 HIS A 26 -25.199 -5.723 -4.287 1.00 0.00 H new ATOM 367 N TYR A 27 -18.101 -4.657 -6.222 1.00 0.00 N ATOM 368 CA TYR A 27 -16.965 -4.094 -6.943 1.00 0.00 C ATOM 369 C TYR A 27 -17.429 -3.333 -8.181 1.00 0.00 C ATOM 370 O TYR A 27 -18.232 -3.834 -8.969 1.00 0.00 O ATOM 371 CB TYR A 27 -15.991 -5.201 -7.347 1.00 0.00 C ATOM 372 CG TYR A 27 -16.522 -6.109 -8.433 1.00 0.00 C ATOM 373 CD1 TYR A 27 -16.313 -5.816 -9.775 1.00 0.00 C ATOM 374 CD2 TYR A 27 -17.232 -7.261 -8.116 1.00 0.00 C ATOM 375 CE1 TYR A 27 -16.797 -6.643 -10.770 1.00 0.00 C ATOM 376 CE2 TYR A 27 -17.719 -8.094 -9.105 1.00 0.00 C ATOM 377 CZ TYR A 27 -17.499 -7.780 -10.430 1.00 0.00 C ATOM 378 OH TYR A 27 -17.982 -8.607 -11.419 1.00 0.00 O ATOM 0 H TYR A 27 -18.518 -5.475 -6.666 1.00 0.00 H new ATOM 0 HA TYR A 27 -16.456 -3.396 -6.279 1.00 0.00 H new ATOM 0 HB2 TYR A 27 -15.060 -4.748 -7.687 1.00 0.00 H new ATOM 0 HB3 TYR A 27 -15.751 -5.801 -6.469 1.00 0.00 H new ATOM 0 HD1 TYR A 27 -15.763 -4.927 -10.045 1.00 0.00 H new ATOM 0 HD2 TYR A 27 -17.406 -7.509 -7.079 1.00 0.00 H new ATOM 0 HE1 TYR A 27 -16.626 -6.400 -11.808 1.00 0.00 H new ATOM 0 HE2 TYR A 27 -18.269 -8.986 -8.842 1.00 0.00 H new ATOM 0 HH TYR A 27 -18.236 -9.469 -11.029 1.00 0.00 H new ATOM 388 N THR A 28 -16.918 -2.117 -8.347 1.00 0.00 N ATOM 389 CA THR A 28 -17.278 -1.285 -9.487 1.00 0.00 C ATOM 390 C THR A 28 -16.038 -0.803 -10.231 1.00 0.00 C ATOM 391 O THR A 28 -15.124 -0.237 -9.632 1.00 0.00 O ATOM 392 CB THR A 28 -18.108 -0.062 -9.051 1.00 0.00 C ATOM 393 OG1 THR A 28 -19.306 -0.492 -8.395 1.00 0.00 O ATOM 394 CG2 THR A 28 -18.463 0.806 -10.249 1.00 0.00 C ATOM 0 H THR A 28 -16.253 -1.687 -7.705 1.00 0.00 H new ATOM 0 HA THR A 28 -17.879 -1.905 -10.152 1.00 0.00 H new ATOM 0 HB THR A 28 -17.508 0.529 -8.359 1.00 0.00 H new ATOM 0 HG1 THR A 28 -19.827 0.291 -8.119 1.00 0.00 H new ATOM 0 HG21 THR A 28 -19.049 1.663 -9.917 1.00 0.00 H new ATOM 0 HG22 THR A 28 -17.549 1.155 -10.729 1.00 0.00 H new ATOM 0 HG23 THR A 28 -19.046 0.222 -10.961 1.00 0.00 H new ATOM 402 N GLY A 29 -16.012 -1.031 -11.541 1.00 0.00 N ATOM 403 CA GLY A 29 -14.879 -0.614 -12.344 1.00 0.00 C ATOM 404 C GLY A 29 -14.718 0.893 -12.381 1.00 0.00 C ATOM 405 O GLY A 29 -15.703 1.630 -12.426 1.00 0.00 O ATOM 0 H GLY A 29 -16.756 -1.497 -12.060 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -13.970 -1.064 -11.945 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -15.000 -0.988 -13.360 1.00 0.00 H new ATOM 409 N THR A 30 -13.471 1.355 -12.360 1.00 0.00 N ATOM 410 CA THR A 30 -13.184 2.783 -12.389 1.00 0.00 C ATOM 411 C THR A 30 -11.702 3.041 -12.634 1.00 0.00 C ATOM 412 O THR A 30 -10.841 2.366 -12.068 1.00 0.00 O ATOM 413 CB THR A 30 -13.602 3.466 -11.073 1.00 0.00 C ATOM 414 OG1 THR A 30 -14.155 2.500 -10.173 1.00 0.00 O ATOM 415 CG2 THR A 30 -14.620 4.566 -11.334 1.00 0.00 C ATOM 0 H THR A 30 -12.644 0.760 -12.323 1.00 0.00 H new ATOM 0 HA THR A 30 -13.764 3.206 -13.210 1.00 0.00 H new ATOM 0 HB THR A 30 -12.715 3.913 -10.624 1.00 0.00 H new ATOM 0 HG1 THR A 30 -13.436 1.943 -9.809 1.00 0.00 H new ATOM 0 HG21 THR A 30 -14.900 5.034 -10.390 1.00 0.00 H new ATOM 0 HG22 THR A 30 -14.185 5.315 -11.995 1.00 0.00 H new ATOM 0 HG23 THR A 30 -15.506 4.138 -11.804 1.00 0.00 H new ATOM 423 N LEU A 31 -11.409 4.023 -13.480 1.00 0.00 N ATOM 424 CA LEU A 31 -10.029 4.372 -13.800 1.00 0.00 C ATOM 425 C LEU A 31 -9.559 5.557 -12.963 1.00 0.00 C ATOM 426 O LEU A 31 -10.370 6.320 -12.439 1.00 0.00 O ATOM 427 CB LEU A 31 -9.897 4.699 -15.288 1.00 0.00 C ATOM 428 CG LEU A 31 -9.862 3.502 -16.238 1.00 0.00 C ATOM 429 CD1 LEU A 31 -9.737 3.968 -17.681 1.00 0.00 C ATOM 430 CD2 LEU A 31 -8.716 2.568 -15.877 1.00 0.00 C ATOM 0 H LEU A 31 -12.109 4.592 -13.957 1.00 0.00 H new ATOM 0 HA LEU A 31 -9.399 3.514 -13.566 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -10.731 5.340 -15.574 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -8.985 5.279 -15.433 1.00 0.00 H new ATOM 0 HG LEU A 31 -10.798 2.954 -16.135 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -9.714 3.102 -18.342 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -10.591 4.596 -17.936 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -8.817 4.540 -17.800 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -8.706 1.722 -16.564 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -7.771 3.106 -15.951 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -8.849 2.206 -14.857 1.00 0.00 H new ATOM 442 N ALA A 32 -8.244 5.706 -12.843 1.00 0.00 N ATOM 443 CA ALA A 32 -7.666 6.800 -12.074 1.00 0.00 C ATOM 444 C ALA A 32 -8.116 8.152 -12.619 1.00 0.00 C ATOM 445 O ALA A 32 -8.091 9.157 -11.909 1.00 0.00 O ATOM 446 CB ALA A 32 -6.147 6.705 -12.080 1.00 0.00 C ATOM 0 H ALA A 32 -7.559 5.082 -13.269 1.00 0.00 H new ATOM 0 HA ALA A 32 -8.020 6.716 -11.047 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -5.729 7.529 -11.502 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -5.840 5.758 -11.637 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -5.783 6.760 -13.106 1.00 0.00 H new ATOM 452 N ASP A 33 -8.525 8.168 -13.882 1.00 0.00 N ATOM 453 CA ASP A 33 -8.981 9.397 -14.522 1.00 0.00 C ATOM 454 C ASP A 33 -10.442 9.676 -14.183 1.00 0.00 C ATOM 455 O ASP A 33 -10.938 10.782 -14.395 1.00 0.00 O ATOM 456 CB ASP A 33 -8.805 9.303 -16.039 1.00 0.00 C ATOM 457 CG ASP A 33 -7.354 9.133 -16.444 1.00 0.00 C ATOM 458 OD1 ASP A 33 -6.550 10.048 -16.169 1.00 0.00 O ATOM 459 OD2 ASP A 33 -7.023 8.084 -17.035 1.00 0.00 O ATOM 0 H ASP A 33 -8.550 7.345 -14.483 1.00 0.00 H new ATOM 0 HA ASP A 33 -8.375 10.221 -14.144 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -9.386 8.462 -16.418 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -9.206 10.203 -16.505 1.00 0.00 H new ATOM 464 N GLY A 34 -11.126 8.665 -13.657 1.00 0.00 N ATOM 465 CA GLY A 34 -12.523 8.822 -13.298 1.00 0.00 C ATOM 466 C GLY A 34 -13.446 8.024 -14.198 1.00 0.00 C ATOM 467 O GLY A 34 -14.609 7.796 -13.863 1.00 0.00 O ATOM 0 H GLY A 34 -10.738 7.740 -13.473 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -12.667 8.507 -12.264 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -12.792 9.877 -13.350 1.00 0.00 H new ATOM 471 N LYS A 35 -12.929 7.600 -15.346 1.00 0.00 N ATOM 472 CA LYS A 35 -13.713 6.823 -16.299 1.00 0.00 C ATOM 473 C LYS A 35 -14.373 5.630 -15.615 1.00 0.00 C ATOM 474 O LYS A 35 -13.695 4.709 -15.161 1.00 0.00 O ATOM 475 CB LYS A 35 -12.825 6.340 -17.447 1.00 0.00 C ATOM 476 CG LYS A 35 -13.568 6.175 -18.762 1.00 0.00 C ATOM 477 CD LYS A 35 -13.543 7.455 -19.581 1.00 0.00 C ATOM 478 CE LYS A 35 -14.795 8.288 -19.351 1.00 0.00 C ATOM 479 NZ LYS A 35 -15.163 9.080 -20.557 1.00 0.00 N ATOM 0 H LYS A 35 -11.969 7.782 -15.639 1.00 0.00 H new ATOM 0 HA LYS A 35 -14.495 7.468 -16.700 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -12.009 7.049 -17.587 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -12.375 5.386 -17.171 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -13.117 5.366 -19.336 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -14.601 5.889 -18.564 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -12.662 8.040 -19.317 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -13.457 7.209 -20.640 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -15.623 7.632 -19.080 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -14.634 8.962 -18.509 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -16.021 9.634 -20.360 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -14.383 9.724 -20.801 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -15.342 8.436 -21.354 1.00 0.00 H new ATOM 493 N VAL A 36 -15.700 5.652 -15.547 1.00 0.00 N ATOM 494 CA VAL A 36 -16.452 4.571 -14.921 1.00 0.00 C ATOM 495 C VAL A 36 -16.475 3.332 -15.809 1.00 0.00 C ATOM 496 O VAL A 36 -16.586 3.433 -17.031 1.00 0.00 O ATOM 497 CB VAL A 36 -17.901 4.997 -14.617 1.00 0.00 C ATOM 498 CG1 VAL A 36 -18.707 5.106 -15.902 1.00 0.00 C ATOM 499 CG2 VAL A 36 -18.551 4.019 -13.650 1.00 0.00 C ATOM 0 H VAL A 36 -16.277 6.407 -15.918 1.00 0.00 H new ATOM 0 HA VAL A 36 -15.946 4.335 -13.985 1.00 0.00 H new ATOM 0 HB VAL A 36 -17.882 5.980 -14.146 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -19.728 5.408 -15.667 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -18.250 5.849 -16.556 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -18.721 4.139 -16.406 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -19.574 4.335 -13.446 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -18.560 3.022 -14.092 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -17.985 3.998 -12.719 1.00 0.00 H new ATOM 509 N PHE A 37 -16.368 2.163 -15.187 1.00 0.00 N ATOM 510 CA PHE A 37 -16.376 0.902 -15.920 1.00 0.00 C ATOM 511 C PHE A 37 -17.516 0.005 -15.448 1.00 0.00 C ATOM 512 O PHE A 37 -18.331 0.405 -14.616 1.00 0.00 O ATOM 513 CB PHE A 37 -15.039 0.180 -15.749 1.00 0.00 C ATOM 514 CG PHE A 37 -14.063 0.453 -16.858 1.00 0.00 C ATOM 515 CD1 PHE A 37 -13.450 1.690 -16.970 1.00 0.00 C ATOM 516 CD2 PHE A 37 -13.760 -0.528 -17.789 1.00 0.00 C ATOM 517 CE1 PHE A 37 -12.552 1.945 -17.990 1.00 0.00 C ATOM 518 CE2 PHE A 37 -12.862 -0.279 -18.810 1.00 0.00 C ATOM 519 CZ PHE A 37 -12.258 0.959 -18.911 1.00 0.00 C ATOM 0 H PHE A 37 -16.275 2.062 -14.176 1.00 0.00 H new ATOM 0 HA PHE A 37 -16.528 1.126 -16.976 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -14.592 0.480 -14.801 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -15.220 -0.893 -15.691 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -13.676 2.465 -16.252 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -14.231 -1.497 -17.716 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -12.081 2.914 -18.066 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -12.633 -1.052 -19.528 1.00 0.00 H new ATOM 0 HZ PHE A 37 -11.557 1.156 -19.709 1.00 0.00 H new ATOM 529 N ASP A 38 -17.567 -1.209 -15.985 1.00 0.00 N ATOM 530 CA ASP A 38 -18.606 -2.164 -15.619 1.00 0.00 C ATOM 531 C ASP A 38 -18.603 -2.420 -14.115 1.00 0.00 C ATOM 532 O ASP A 38 -17.548 -2.604 -13.509 1.00 0.00 O ATOM 533 CB ASP A 38 -18.408 -3.480 -16.373 1.00 0.00 C ATOM 534 CG ASP A 38 -19.721 -4.100 -16.809 1.00 0.00 C ATOM 535 OD1 ASP A 38 -20.610 -4.271 -15.950 1.00 0.00 O ATOM 536 OD2 ASP A 38 -19.858 -4.417 -18.010 1.00 0.00 O ATOM 0 H ASP A 38 -16.901 -1.555 -16.675 1.00 0.00 H new ATOM 0 HA ASP A 38 -19.570 -1.738 -15.895 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -17.784 -3.303 -17.249 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -17.871 -4.183 -15.736 1.00 0.00 H new ATOM 541 N SER A 39 -19.792 -2.430 -13.519 1.00 0.00 N ATOM 542 CA SER A 39 -19.926 -2.659 -12.085 1.00 0.00 C ATOM 543 C SER A 39 -20.852 -3.839 -11.808 1.00 0.00 C ATOM 544 O SER A 39 -21.822 -4.064 -12.530 1.00 0.00 O ATOM 545 CB SER A 39 -20.461 -1.403 -11.395 1.00 0.00 C ATOM 546 OG SER A 39 -21.861 -1.490 -11.193 1.00 0.00 O ATOM 0 H SER A 39 -20.675 -2.282 -14.007 1.00 0.00 H new ATOM 0 HA SER A 39 -18.939 -2.892 -11.685 1.00 0.00 H new ATOM 0 HB2 SER A 39 -19.960 -1.269 -10.436 1.00 0.00 H new ATOM 0 HB3 SER A 39 -20.231 -0.526 -12.000 1.00 0.00 H new ATOM 0 HG SER A 39 -22.179 -0.676 -10.749 1.00 0.00 H new ATOM 552 N SER A 40 -20.543 -4.590 -10.755 1.00 0.00 N ATOM 553 CA SER A 40 -21.344 -5.750 -10.383 1.00 0.00 C ATOM 554 C SER A 40 -22.648 -5.320 -9.717 1.00 0.00 C ATOM 555 O SER A 40 -23.657 -6.021 -9.791 1.00 0.00 O ATOM 556 CB SER A 40 -20.554 -6.661 -9.441 1.00 0.00 C ATOM 557 OG SER A 40 -20.473 -7.979 -9.956 1.00 0.00 O ATOM 0 H SER A 40 -19.744 -4.416 -10.145 1.00 0.00 H new ATOM 0 HA SER A 40 -21.585 -6.300 -11.293 1.00 0.00 H new ATOM 0 HB2 SER A 40 -19.550 -6.260 -9.299 1.00 0.00 H new ATOM 0 HB3 SER A 40 -21.032 -6.679 -8.461 1.00 0.00 H new ATOM 0 HG SER A 40 -19.552 -8.166 -10.234 1.00 0.00 H new ATOM 668 N PHE A 47 -19.851 -9.567 -5.149 1.00 0.00 N ATOM 669 CA PHE A 47 -18.817 -10.596 -5.150 1.00 0.00 C ATOM 670 C PHE A 47 -18.477 -11.026 -3.726 1.00 0.00 C ATOM 671 O PHE A 47 -18.146 -10.197 -2.878 1.00 0.00 O ATOM 672 CB PHE A 47 -17.559 -10.085 -5.855 1.00 0.00 C ATOM 673 CG PHE A 47 -16.678 -11.183 -6.379 1.00 0.00 C ATOM 674 CD1 PHE A 47 -17.079 -11.957 -7.456 1.00 0.00 C ATOM 675 CD2 PHE A 47 -15.449 -11.441 -5.794 1.00 0.00 C ATOM 676 CE1 PHE A 47 -16.270 -12.968 -7.941 1.00 0.00 C ATOM 677 CE2 PHE A 47 -14.636 -12.450 -6.275 1.00 0.00 C ATOM 678 CZ PHE A 47 -15.047 -13.215 -7.349 1.00 0.00 C ATOM 0 HA PHE A 47 -19.201 -11.461 -5.690 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -17.853 -9.439 -6.683 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -16.986 -9.471 -5.160 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -18.035 -11.768 -7.922 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -15.123 -10.847 -4.953 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -16.594 -13.564 -8.782 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -13.679 -12.640 -5.811 1.00 0.00 H new ATOM 0 HZ PHE A 47 -14.413 -14.005 -7.725 1.00 0.00 H new ATOM 688 N ARG A 48 -18.561 -12.327 -3.471 1.00 0.00 N ATOM 689 CA ARG A 48 -18.264 -12.868 -2.150 1.00 0.00 C ATOM 690 C ARG A 48 -17.119 -13.875 -2.219 1.00 0.00 C ATOM 691 O ARG A 48 -17.032 -14.667 -3.157 1.00 0.00 O ATOM 692 CB ARG A 48 -19.507 -13.533 -1.556 1.00 0.00 C ATOM 693 CG ARG A 48 -20.053 -14.670 -2.403 1.00 0.00 C ATOM 694 CD ARG A 48 -20.384 -15.888 -1.555 1.00 0.00 C ATOM 695 NE ARG A 48 -20.415 -17.115 -2.347 1.00 0.00 N ATOM 696 CZ ARG A 48 -19.327 -17.789 -2.701 1.00 0.00 C ATOM 697 NH1 ARG A 48 -18.128 -17.358 -2.335 1.00 0.00 N ATOM 698 NH2 ARG A 48 -19.436 -18.897 -3.422 1.00 0.00 N ATOM 0 H ARG A 48 -18.832 -13.027 -4.162 1.00 0.00 H new ATOM 0 HA ARG A 48 -17.960 -12.042 -1.507 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -19.266 -13.914 -0.564 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -20.285 -12.781 -1.428 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -20.948 -14.337 -2.928 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -19.321 -14.943 -3.163 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -19.645 -15.988 -0.760 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -21.351 -15.743 -1.074 1.00 0.00 H new ATOM 0 HE ARG A 48 -21.322 -17.474 -2.644 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -18.040 -16.507 -1.780 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -17.294 -17.878 -2.608 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -20.357 -19.233 -3.705 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -18.599 -19.413 -3.693 1.00 0.00 H new ATOM 712 N PHE A 49 -16.244 -13.837 -1.220 1.00 0.00 N ATOM 713 CA PHE A 49 -15.104 -14.745 -1.168 1.00 0.00 C ATOM 714 C PHE A 49 -14.423 -14.686 0.196 1.00 0.00 C ATOM 715 O PHE A 49 -14.785 -13.875 1.050 1.00 0.00 O ATOM 716 CB PHE A 49 -14.098 -14.397 -2.268 1.00 0.00 C ATOM 717 CG PHE A 49 -13.519 -13.018 -2.136 1.00 0.00 C ATOM 718 CD1 PHE A 49 -14.134 -11.933 -2.741 1.00 0.00 C ATOM 719 CD2 PHE A 49 -12.359 -12.805 -1.409 1.00 0.00 C ATOM 720 CE1 PHE A 49 -13.604 -10.662 -2.621 1.00 0.00 C ATOM 721 CE2 PHE A 49 -11.825 -11.536 -1.285 1.00 0.00 C ATOM 722 CZ PHE A 49 -12.447 -10.464 -1.894 1.00 0.00 C ATOM 0 H PHE A 49 -16.302 -13.188 -0.436 1.00 0.00 H new ATOM 0 HA PHE A 49 -15.471 -15.759 -1.327 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -13.288 -15.126 -2.252 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -14.587 -14.486 -3.238 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -15.038 -12.082 -3.313 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -11.866 -13.640 -0.934 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -14.094 -9.825 -3.095 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -10.922 -11.383 -0.712 1.00 0.00 H new ATOM 0 HZ PHE A 49 -12.029 -9.472 -1.802 1.00 0.00 H new ATOM 732 N THR A 50 -13.435 -15.553 0.396 1.00 0.00 N ATOM 733 CA THR A 50 -12.705 -15.602 1.656 1.00 0.00 C ATOM 734 C THR A 50 -11.535 -14.624 1.652 1.00 0.00 C ATOM 735 O THR A 50 -10.581 -14.784 0.891 1.00 0.00 O ATOM 736 CB THR A 50 -12.173 -17.019 1.942 1.00 0.00 C ATOM 737 OG1 THR A 50 -13.264 -17.942 2.038 1.00 0.00 O ATOM 738 CG2 THR A 50 -11.367 -17.044 3.232 1.00 0.00 C ATOM 0 H THR A 50 -13.122 -16.231 -0.299 1.00 0.00 H new ATOM 0 HA THR A 50 -13.408 -15.320 2.440 1.00 0.00 H new ATOM 0 HB THR A 50 -11.521 -17.311 1.119 1.00 0.00 H new ATOM 0 HG1 THR A 50 -12.917 -18.841 2.218 1.00 0.00 H new ATOM 0 HG21 THR A 50 -11.002 -18.055 3.413 1.00 0.00 H new ATOM 0 HG22 THR A 50 -10.521 -16.362 3.146 1.00 0.00 H new ATOM 0 HG23 THR A 50 -12.000 -16.733 4.063 1.00 0.00 H new ATOM 746 N VAL A 51 -11.614 -13.611 2.509 1.00 0.00 N ATOM 747 CA VAL A 51 -10.561 -12.607 2.605 1.00 0.00 C ATOM 748 C VAL A 51 -9.252 -13.228 3.080 1.00 0.00 C ATOM 749 O VAL A 51 -9.072 -13.488 4.269 1.00 0.00 O ATOM 750 CB VAL A 51 -10.955 -11.470 3.566 1.00 0.00 C ATOM 751 CG1 VAL A 51 -9.966 -10.319 3.466 1.00 0.00 C ATOM 752 CG2 VAL A 51 -12.371 -10.994 3.275 1.00 0.00 C ATOM 0 H VAL A 51 -12.396 -13.464 3.147 1.00 0.00 H new ATOM 0 HA VAL A 51 -10.424 -12.196 1.605 1.00 0.00 H new ATOM 0 HB VAL A 51 -10.927 -11.853 4.586 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -10.261 -9.525 4.152 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -8.969 -10.673 3.727 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -9.959 -9.933 2.447 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -12.633 -10.190 3.963 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -12.428 -10.627 2.250 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -13.067 -11.823 3.403 1.00 0.00 H new ATOM 762 N GLY A 52 -8.340 -13.464 2.142 1.00 0.00 N ATOM 763 CA GLY A 52 -7.059 -14.053 2.485 1.00 0.00 C ATOM 764 C GLY A 52 -6.748 -15.286 1.660 1.00 0.00 C ATOM 765 O GLY A 52 -5.605 -15.741 1.618 1.00 0.00 O ATOM 0 H GLY A 52 -8.465 -13.258 1.151 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -6.272 -13.314 2.338 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -7.055 -14.317 3.543 1.00 0.00 H new ATOM 769 N ARG A 53 -7.768 -15.829 1.003 1.00 0.00 N ATOM 770 CA ARG A 53 -7.599 -17.019 0.178 1.00 0.00 C ATOM 771 C ARG A 53 -6.949 -16.667 -1.157 1.00 0.00 C ATOM 772 O ARG A 53 -6.788 -15.494 -1.491 1.00 0.00 O ATOM 773 CB ARG A 53 -8.950 -17.695 -0.063 1.00 0.00 C ATOM 774 CG ARG A 53 -9.331 -18.696 1.015 1.00 0.00 C ATOM 775 CD ARG A 53 -8.490 -19.959 0.924 1.00 0.00 C ATOM 776 NE ARG A 53 -9.183 -21.120 1.478 1.00 0.00 N ATOM 777 CZ ARG A 53 -10.179 -21.745 0.860 1.00 0.00 C ATOM 778 NH1 ARG A 53 -10.595 -21.324 -0.326 1.00 0.00 N ATOM 779 NH2 ARG A 53 -10.759 -22.794 1.428 1.00 0.00 N ATOM 0 H ARG A 53 -8.720 -15.464 1.026 1.00 0.00 H new ATOM 0 HA ARG A 53 -6.945 -17.710 0.710 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -9.724 -16.930 -0.126 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -8.925 -18.204 -1.027 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -9.202 -18.241 1.997 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -10.386 -18.952 0.919 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -8.237 -20.151 -0.119 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -7.551 -19.809 1.457 1.00 0.00 H new ATOM 0 HE ARG A 53 -8.886 -21.470 2.389 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -10.150 -20.519 -0.766 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -11.360 -21.806 -0.799 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -10.440 -23.121 2.340 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -11.524 -23.273 0.953 1.00 0.00 H new ATOM 793 N GLY A 54 -6.575 -17.693 -1.916 1.00 0.00 N ATOM 794 CA GLY A 54 -5.946 -17.471 -3.205 1.00 0.00 C ATOM 795 C GLY A 54 -6.948 -17.447 -4.343 1.00 0.00 C ATOM 796 O GLY A 54 -6.578 -17.597 -5.506 1.00 0.00 O ATOM 0 H GLY A 54 -6.696 -18.673 -1.661 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -5.403 -16.526 -3.183 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -5.212 -18.256 -3.388 1.00 0.00 H new ATOM 800 N GLU A 55 -8.220 -17.260 -4.005 1.00 0.00 N ATOM 801 CA GLU A 55 -9.278 -17.221 -5.008 1.00 0.00 C ATOM 802 C GLU A 55 -9.403 -15.825 -5.612 1.00 0.00 C ATOM 803 O GLU A 55 -9.879 -15.662 -6.735 1.00 0.00 O ATOM 804 CB GLU A 55 -10.613 -17.643 -4.391 1.00 0.00 C ATOM 805 CG GLU A 55 -10.598 -19.048 -3.812 1.00 0.00 C ATOM 806 CD GLU A 55 -10.565 -20.120 -4.883 1.00 0.00 C ATOM 807 OE1 GLU A 55 -11.548 -20.229 -5.645 1.00 0.00 O ATOM 808 OE2 GLU A 55 -9.555 -20.851 -4.959 1.00 0.00 O ATOM 0 H GLU A 55 -8.543 -17.133 -3.046 1.00 0.00 H new ATOM 0 HA GLU A 55 -9.016 -17.920 -5.802 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -10.879 -16.937 -3.604 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -11.391 -17.581 -5.152 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -9.729 -19.160 -3.164 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -11.481 -19.189 -3.189 1.00 0.00 H new ATOM 815 N VAL A 56 -8.973 -14.819 -4.856 1.00 0.00 N ATOM 816 CA VAL A 56 -9.036 -13.437 -5.315 1.00 0.00 C ATOM 817 C VAL A 56 -7.639 -12.853 -5.496 1.00 0.00 C ATOM 818 O VAL A 56 -6.638 -13.541 -5.294 1.00 0.00 O ATOM 819 CB VAL A 56 -9.826 -12.554 -4.331 1.00 0.00 C ATOM 820 CG1 VAL A 56 -11.316 -12.840 -4.435 1.00 0.00 C ATOM 821 CG2 VAL A 56 -9.331 -12.768 -2.909 1.00 0.00 C ATOM 0 H VAL A 56 -8.577 -14.936 -3.923 1.00 0.00 H new ATOM 0 HA VAL A 56 -9.550 -13.446 -6.276 1.00 0.00 H new ATOM 0 HB VAL A 56 -9.662 -11.509 -4.595 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -11.858 -12.207 -3.732 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -11.657 -12.631 -5.449 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -11.503 -13.887 -4.198 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -9.900 -12.136 -2.227 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -9.463 -13.814 -2.631 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -8.274 -12.508 -2.849 1.00 0.00 H new ATOM 831 N ILE A 57 -7.579 -11.582 -5.876 1.00 0.00 N ATOM 832 CA ILE A 57 -6.305 -10.905 -6.082 1.00 0.00 C ATOM 833 C ILE A 57 -5.862 -10.171 -4.820 1.00 0.00 C ATOM 834 O ILE A 57 -6.678 -9.858 -3.954 1.00 0.00 O ATOM 835 CB ILE A 57 -6.382 -9.901 -7.246 1.00 0.00 C ATOM 836 CG1 ILE A 57 -7.541 -8.925 -7.031 1.00 0.00 C ATOM 837 CG2 ILE A 57 -6.540 -10.635 -8.570 1.00 0.00 C ATOM 838 CD1 ILE A 57 -7.252 -7.525 -7.526 1.00 0.00 C ATOM 0 H ILE A 57 -8.399 -10.999 -6.048 1.00 0.00 H new ATOM 0 HA ILE A 57 -5.574 -11.676 -6.327 1.00 0.00 H new ATOM 0 HB ILE A 57 -5.453 -9.332 -7.277 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -8.426 -9.306 -7.541 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -7.778 -8.884 -5.968 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -6.593 -9.911 -9.383 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -5.685 -11.293 -8.725 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -7.455 -11.227 -8.551 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -8.117 -6.888 -7.341 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -6.387 -7.124 -6.999 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -7.044 -7.553 -8.596 1.00 0.00 H new ATOM 850 N ARG A 58 -4.565 -9.898 -4.726 1.00 0.00 N ATOM 851 CA ARG A 58 -4.013 -9.200 -3.571 1.00 0.00 C ATOM 852 C ARG A 58 -4.786 -7.913 -3.294 1.00 0.00 C ATOM 853 O ARG A 58 -5.109 -7.606 -2.147 1.00 0.00 O ATOM 854 CB ARG A 58 -2.535 -8.880 -3.800 1.00 0.00 C ATOM 855 CG ARG A 58 -1.679 -10.109 -4.061 1.00 0.00 C ATOM 856 CD ARG A 58 -1.400 -10.876 -2.777 1.00 0.00 C ATOM 857 NE ARG A 58 -0.575 -10.107 -1.849 1.00 0.00 N ATOM 858 CZ ARG A 58 -0.452 -10.400 -0.559 1.00 0.00 C ATOM 859 NH1 ARG A 58 -1.095 -11.440 -0.048 1.00 0.00 N ATOM 860 NH2 ARG A 58 0.318 -9.653 0.222 1.00 0.00 N ATOM 0 H ARG A 58 -3.877 -10.149 -5.436 1.00 0.00 H new ATOM 0 HA ARG A 58 -4.106 -9.854 -2.704 1.00 0.00 H new ATOM 0 HB2 ARG A 58 -2.446 -8.199 -4.647 1.00 0.00 H new ATOM 0 HB3 ARG A 58 -2.146 -8.355 -2.927 1.00 0.00 H new ATOM 0 HG2 ARG A 58 -2.184 -10.761 -4.773 1.00 0.00 H new ATOM 0 HG3 ARG A 58 -0.737 -9.807 -4.518 1.00 0.00 H new ATOM 0 HD2 ARG A 58 -2.344 -11.133 -2.296 1.00 0.00 H new ATOM 0 HD3 ARG A 58 -0.899 -11.814 -3.016 1.00 0.00 H new ATOM 0 HE ARG A 58 -0.065 -9.301 -2.211 1.00 0.00 H new ATOM 0 HH11 ARG A 58 -1.686 -12.018 -0.645 1.00 0.00 H new ATOM 0 HH12 ARG A 58 -0.999 -11.663 0.943 1.00 0.00 H new ATOM 0 HH21 ARG A 58 0.816 -8.853 -0.168 1.00 0.00 H new ATOM 0 HH22 ARG A 58 0.412 -9.879 1.212 1.00 0.00 H new ATOM 874 N GLY A 59 -5.078 -7.164 -4.353 1.00 0.00 N ATOM 875 CA GLY A 59 -5.809 -5.919 -4.202 1.00 0.00 C ATOM 876 C GLY A 59 -7.069 -6.084 -3.376 1.00 0.00 C ATOM 877 O GLY A 59 -7.224 -5.447 -2.335 1.00 0.00 O ATOM 0 H GLY A 59 -4.822 -7.397 -5.312 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -5.164 -5.177 -3.731 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -6.072 -5.534 -5.187 1.00 0.00 H new ATOM 881 N TRP A 60 -7.972 -6.939 -3.843 1.00 0.00 N ATOM 882 CA TRP A 60 -9.227 -7.183 -3.140 1.00 0.00 C ATOM 883 C TRP A 60 -8.969 -7.677 -1.721 1.00 0.00 C ATOM 884 O TRP A 60 -9.623 -7.240 -0.774 1.00 0.00 O ATOM 885 CB TRP A 60 -10.072 -8.205 -3.903 1.00 0.00 C ATOM 886 CG TRP A 60 -10.762 -7.629 -5.102 1.00 0.00 C ATOM 887 CD1 TRP A 60 -10.830 -6.311 -5.454 1.00 0.00 C ATOM 888 CD2 TRP A 60 -11.484 -8.352 -6.105 1.00 0.00 C ATOM 889 NE1 TRP A 60 -11.550 -6.171 -6.615 1.00 0.00 N ATOM 890 CE2 TRP A 60 -11.962 -7.408 -7.036 1.00 0.00 C ATOM 891 CE3 TRP A 60 -11.771 -9.704 -6.310 1.00 0.00 C ATOM 892 CZ2 TRP A 60 -12.711 -7.776 -8.150 1.00 0.00 C ATOM 893 CZ3 TRP A 60 -12.514 -10.067 -7.416 1.00 0.00 C ATOM 894 CH2 TRP A 60 -12.977 -9.106 -8.325 1.00 0.00 C ATOM 0 H TRP A 60 -7.859 -7.474 -4.704 1.00 0.00 H new ATOM 0 HA TRP A 60 -9.772 -6.241 -3.083 1.00 0.00 H new ATOM 0 HB2 TRP A 60 -9.433 -9.029 -4.221 1.00 0.00 H new ATOM 0 HB3 TRP A 60 -10.819 -8.623 -3.229 1.00 0.00 H new ATOM 0 HD1 TRP A 60 -10.383 -5.498 -4.901 1.00 0.00 H new ATOM 0 HE1 TRP A 60 -11.746 -5.289 -7.088 1.00 0.00 H new ATOM 0 HE3 TRP A 60 -11.418 -10.452 -5.616 1.00 0.00 H new ATOM 0 HZ2 TRP A 60 -13.069 -7.037 -8.851 1.00 0.00 H new ATOM 0 HZ3 TRP A 60 -12.742 -11.109 -7.583 1.00 0.00 H new ATOM 0 HH2 TRP A 60 -13.555 -9.422 -9.181 1.00 0.00 H new ATOM 905 N ASP A 61 -8.013 -8.588 -1.581 1.00 0.00 N ATOM 906 CA ASP A 61 -7.668 -9.140 -0.276 1.00 0.00 C ATOM 907 C ASP A 61 -7.460 -8.027 0.747 1.00 0.00 C ATOM 908 O ASP A 61 -8.199 -7.925 1.725 1.00 0.00 O ATOM 909 CB ASP A 61 -6.406 -9.998 -0.378 1.00 0.00 C ATOM 910 CG ASP A 61 -6.374 -11.107 0.654 1.00 0.00 C ATOM 911 OD1 ASP A 61 -7.152 -11.033 1.628 1.00 0.00 O ATOM 912 OD2 ASP A 61 -5.572 -12.050 0.489 1.00 0.00 O ATOM 0 H ASP A 61 -7.463 -8.960 -2.355 1.00 0.00 H new ATOM 0 HA ASP A 61 -8.497 -9.765 0.057 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -6.346 -10.433 -1.376 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -5.528 -9.364 -0.253 1.00 0.00 H new ATOM 917 N GLU A 62 -6.449 -7.197 0.513 1.00 0.00 N ATOM 918 CA GLU A 62 -6.143 -6.093 1.416 1.00 0.00 C ATOM 919 C GLU A 62 -7.271 -5.066 1.420 1.00 0.00 C ATOM 920 O GLU A 62 -7.691 -4.592 2.475 1.00 0.00 O ATOM 921 CB GLU A 62 -4.829 -5.422 1.010 1.00 0.00 C ATOM 922 CG GLU A 62 -3.601 -6.276 1.281 1.00 0.00 C ATOM 923 CD GLU A 62 -2.337 -5.450 1.425 1.00 0.00 C ATOM 924 OE1 GLU A 62 -1.860 -4.915 0.403 1.00 0.00 O ATOM 925 OE2 GLU A 62 -1.826 -5.339 2.559 1.00 0.00 O ATOM 0 H GLU A 62 -5.828 -7.267 -0.293 1.00 0.00 H new ATOM 0 HA GLU A 62 -6.040 -6.498 2.423 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -4.867 -5.181 -0.052 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -4.731 -4.479 1.547 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -3.759 -6.854 2.192 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -3.473 -6.991 0.468 1.00 0.00 H new ATOM 932 N GLY A 63 -7.758 -4.725 0.230 1.00 0.00 N ATOM 933 CA GLY A 63 -8.832 -3.755 0.118 1.00 0.00 C ATOM 934 C GLY A 63 -10.002 -4.078 1.027 1.00 0.00 C ATOM 935 O GLY A 63 -10.345 -3.294 1.911 1.00 0.00 O ATOM 0 H GLY A 63 -7.428 -5.103 -0.658 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -8.449 -2.764 0.362 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -9.178 -3.718 -0.915 1.00 0.00 H new ATOM 939 N VAL A 64 -10.617 -5.236 0.807 1.00 0.00 N ATOM 940 CA VAL A 64 -11.756 -5.661 1.613 1.00 0.00 C ATOM 941 C VAL A 64 -11.345 -5.903 3.061 1.00 0.00 C ATOM 942 O VAL A 64 -12.127 -5.678 3.984 1.00 0.00 O ATOM 943 CB VAL A 64 -12.392 -6.946 1.050 1.00 0.00 C ATOM 944 CG1 VAL A 64 -11.463 -8.134 1.249 1.00 0.00 C ATOM 945 CG2 VAL A 64 -13.743 -7.200 1.702 1.00 0.00 C ATOM 0 H VAL A 64 -10.346 -5.896 0.078 1.00 0.00 H new ATOM 0 HA VAL A 64 -12.489 -4.855 1.577 1.00 0.00 H new ATOM 0 HB VAL A 64 -12.549 -6.814 -0.021 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -11.930 -9.032 0.845 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -10.521 -7.950 0.732 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -11.271 -8.272 2.313 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -14.179 -8.112 1.293 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -13.612 -7.312 2.778 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -14.407 -6.359 1.502 1.00 0.00 H new ATOM 955 N ALA A 65 -10.112 -6.361 3.252 1.00 0.00 N ATOM 956 CA ALA A 65 -9.596 -6.630 4.589 1.00 0.00 C ATOM 957 C ALA A 65 -9.653 -5.381 5.461 1.00 0.00 C ATOM 958 O ALA A 65 -9.937 -5.460 6.656 1.00 0.00 O ATOM 959 CB ALA A 65 -8.171 -7.156 4.508 1.00 0.00 C ATOM 0 H ALA A 65 -9.452 -6.553 2.498 1.00 0.00 H new ATOM 0 HA ALA A 65 -10.227 -7.391 5.049 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -7.798 -7.353 5.513 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -8.156 -8.079 3.928 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -7.536 -6.414 4.024 1.00 0.00 H new ATOM 965 N GLN A 66 -9.380 -4.229 4.856 1.00 0.00 N ATOM 966 CA GLN A 66 -9.399 -2.964 5.580 1.00 0.00 C ATOM 967 C GLN A 66 -10.716 -2.229 5.357 1.00 0.00 C ATOM 968 O GLN A 66 -10.779 -1.004 5.455 1.00 0.00 O ATOM 969 CB GLN A 66 -8.229 -2.082 5.139 1.00 0.00 C ATOM 970 CG GLN A 66 -8.297 -1.667 3.678 1.00 0.00 C ATOM 971 CD GLN A 66 -6.998 -1.063 3.182 1.00 0.00 C ATOM 972 OE1 GLN A 66 -6.503 -0.083 3.739 1.00 0.00 O ATOM 973 NE2 GLN A 66 -6.437 -1.647 2.129 1.00 0.00 N ATOM 0 H GLN A 66 -9.143 -4.146 3.867 1.00 0.00 H new ATOM 0 HA GLN A 66 -9.301 -3.182 6.643 1.00 0.00 H new ATOM 0 HB2 GLN A 66 -8.204 -1.188 5.761 1.00 0.00 H new ATOM 0 HB3 GLN A 66 -7.296 -2.617 5.313 1.00 0.00 H new ATOM 0 HG2 GLN A 66 -8.545 -2.536 3.069 1.00 0.00 H new ATOM 0 HG3 GLN A 66 -9.103 -0.945 3.546 1.00 0.00 H new ATOM 0 HE21 GLN A 66 -6.882 -2.458 1.698 1.00 0.00 H new ATOM 0 HE22 GLN A 66 -5.561 -1.285 1.751 1.00 0.00 H new ATOM 982 N MET A 67 -11.767 -2.985 5.057 1.00 0.00 N ATOM 983 CA MET A 67 -13.084 -2.405 4.821 1.00 0.00 C ATOM 984 C MET A 67 -14.056 -2.797 5.929 1.00 0.00 C ATOM 985 O MET A 67 -13.861 -3.801 6.613 1.00 0.00 O ATOM 986 CB MET A 67 -13.629 -2.857 3.465 1.00 0.00 C ATOM 987 CG MET A 67 -13.022 -2.111 2.287 1.00 0.00 C ATOM 988 SD MET A 67 -13.939 -0.617 1.865 1.00 0.00 S ATOM 989 CE MET A 67 -15.529 -1.310 1.418 1.00 0.00 C ATOM 0 H MET A 67 -11.732 -4.001 4.972 1.00 0.00 H new ATOM 0 HA MET A 67 -12.981 -1.320 4.819 1.00 0.00 H new ATOM 0 HB2 MET A 67 -13.441 -3.924 3.345 1.00 0.00 H new ATOM 0 HB3 MET A 67 -14.710 -2.720 3.453 1.00 0.00 H new ATOM 0 HG2 MET A 67 -11.991 -1.846 2.522 1.00 0.00 H new ATOM 0 HG3 MET A 67 -12.992 -2.771 1.420 1.00 0.00 H new ATOM 0 HE1 MET A 67 -16.088 -0.586 0.825 1.00 0.00 H new ATOM 0 HE2 MET A 67 -15.379 -2.219 0.835 1.00 0.00 H new ATOM 0 HE3 MET A 67 -16.089 -1.548 2.322 1.00 0.00 H new ATOM 999 N SER A 68 -15.105 -1.997 6.100 1.00 0.00 N ATOM 1000 CA SER A 68 -16.105 -2.258 7.128 1.00 0.00 C ATOM 1001 C SER A 68 -17.483 -2.465 6.505 1.00 0.00 C ATOM 1002 O SER A 68 -17.812 -1.862 5.483 1.00 0.00 O ATOM 1003 CB SER A 68 -16.154 -1.102 8.128 1.00 0.00 C ATOM 1004 OG SER A 68 -16.198 0.148 7.461 1.00 0.00 O ATOM 0 H SER A 68 -15.283 -1.164 5.540 1.00 0.00 H new ATOM 0 HA SER A 68 -15.821 -3.170 7.652 1.00 0.00 H new ATOM 0 HB2 SER A 68 -17.030 -1.207 8.768 1.00 0.00 H new ATOM 0 HB3 SER A 68 -15.279 -1.141 8.777 1.00 0.00 H new ATOM 0 HG SER A 68 -15.632 0.792 7.935 1.00 0.00 H new ATOM 1010 N VAL A 69 -18.285 -3.322 7.128 1.00 0.00 N ATOM 1011 CA VAL A 69 -19.627 -3.609 6.637 1.00 0.00 C ATOM 1012 C VAL A 69 -20.429 -2.326 6.448 1.00 0.00 C ATOM 1013 O VAL A 69 -20.510 -1.493 7.350 1.00 0.00 O ATOM 1014 CB VAL A 69 -20.389 -4.541 7.598 1.00 0.00 C ATOM 1015 CG1 VAL A 69 -21.804 -4.785 7.095 1.00 0.00 C ATOM 1016 CG2 VAL A 69 -19.642 -5.854 7.771 1.00 0.00 C ATOM 0 H VAL A 69 -18.028 -3.830 7.974 1.00 0.00 H new ATOM 0 HA VAL A 69 -19.512 -4.107 5.674 1.00 0.00 H new ATOM 0 HB VAL A 69 -20.454 -4.056 8.572 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -22.327 -5.446 7.786 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -22.335 -3.836 7.028 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -21.765 -5.249 6.109 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -20.195 -6.500 8.453 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -19.544 -6.347 6.804 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -18.651 -5.658 8.180 1.00 0.00 H new ATOM 1026 N GLY A 70 -21.021 -2.173 5.268 1.00 0.00 N ATOM 1027 CA GLY A 70 -21.810 -0.989 4.981 1.00 0.00 C ATOM 1028 C GLY A 70 -20.953 0.194 4.576 1.00 0.00 C ATOM 1029 O GLY A 70 -21.449 1.313 4.452 1.00 0.00 O ATOM 0 H GLY A 70 -20.968 -2.848 4.505 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -22.517 -1.212 4.182 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -22.396 -0.725 5.861 1.00 0.00 H new ATOM 1033 N GLN A 71 -19.663 -0.054 4.370 1.00 0.00 N ATOM 1034 CA GLN A 71 -18.736 1.001 3.979 1.00 0.00 C ATOM 1035 C GLN A 71 -18.377 0.889 2.501 1.00 0.00 C ATOM 1036 O GLN A 71 -18.201 -0.211 1.976 1.00 0.00 O ATOM 1037 CB GLN A 71 -17.467 0.935 4.831 1.00 0.00 C ATOM 1038 CG GLN A 71 -16.689 2.241 4.864 1.00 0.00 C ATOM 1039 CD GLN A 71 -15.222 2.054 4.531 1.00 0.00 C ATOM 1040 OE1 GLN A 71 -14.408 1.753 5.404 1.00 0.00 O ATOM 1041 NE2 GLN A 71 -14.876 2.233 3.261 1.00 0.00 N ATOM 0 H GLN A 71 -19.237 -0.976 4.467 1.00 0.00 H new ATOM 0 HA GLN A 71 -19.226 1.961 4.143 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -17.737 0.657 5.850 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -16.821 0.146 4.446 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -17.132 2.942 4.156 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -16.779 2.688 5.854 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -15.584 2.482 2.570 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -13.903 2.121 2.977 1.00 0.00 H new ATOM 1050 N ARG A 72 -18.269 2.034 1.835 1.00 0.00 N ATOM 1051 CA ARG A 72 -17.932 2.064 0.417 1.00 0.00 C ATOM 1052 C ARG A 72 -16.717 2.953 0.165 1.00 0.00 C ATOM 1053 O ARG A 72 -16.625 4.060 0.696 1.00 0.00 O ATOM 1054 CB ARG A 72 -19.123 2.566 -0.402 1.00 0.00 C ATOM 1055 CG ARG A 72 -18.811 2.758 -1.877 1.00 0.00 C ATOM 1056 CD ARG A 72 -20.067 2.671 -2.728 1.00 0.00 C ATOM 1057 NE ARG A 72 -21.023 3.726 -2.403 1.00 0.00 N ATOM 1058 CZ ARG A 72 -22.087 4.009 -3.146 1.00 0.00 C ATOM 1059 NH1 ARG A 72 -22.330 3.318 -4.251 1.00 0.00 N ATOM 1060 NH2 ARG A 72 -22.911 4.984 -2.784 1.00 0.00 N ATOM 0 H ARG A 72 -18.410 2.953 2.255 1.00 0.00 H new ATOM 0 HA ARG A 72 -17.688 1.048 0.106 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -19.946 1.858 -0.303 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -19.466 3.513 0.014 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -18.336 3.727 -2.026 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -18.098 2.000 -2.201 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -19.796 2.739 -3.782 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -20.537 1.698 -2.582 1.00 0.00 H new ATOM 0 HE ARG A 72 -20.865 4.276 -1.559 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -21.699 2.567 -4.532 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -23.148 3.537 -4.820 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -22.728 5.517 -1.934 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -23.728 5.200 -3.356 1.00 0.00 H new ATOM 1074 N ALA A 73 -15.788 2.460 -0.646 1.00 0.00 N ATOM 1075 CA ALA A 73 -14.580 3.210 -0.969 1.00 0.00 C ATOM 1076 C ALA A 73 -13.976 2.736 -2.287 1.00 0.00 C ATOM 1077 O ALA A 73 -14.358 1.694 -2.819 1.00 0.00 O ATOM 1078 CB ALA A 73 -13.563 3.083 0.156 1.00 0.00 C ATOM 0 H ALA A 73 -15.848 1.545 -1.092 1.00 0.00 H new ATOM 0 HA ALA A 73 -14.852 4.260 -1.081 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -12.666 3.648 -0.099 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -13.990 3.476 1.079 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -13.303 2.034 0.295 1.00 0.00 H new ATOM 1084 N LYS A 74 -13.030 3.509 -2.810 1.00 0.00 N ATOM 1085 CA LYS A 74 -12.371 3.169 -4.066 1.00 0.00 C ATOM 1086 C LYS A 74 -11.085 2.389 -3.812 1.00 0.00 C ATOM 1087 O LYS A 74 -10.246 2.800 -3.009 1.00 0.00 O ATOM 1088 CB LYS A 74 -12.062 4.438 -4.863 1.00 0.00 C ATOM 1089 CG LYS A 74 -13.211 5.432 -4.895 1.00 0.00 C ATOM 1090 CD LYS A 74 -12.953 6.551 -5.890 1.00 0.00 C ATOM 1091 CE LYS A 74 -13.282 6.120 -7.311 1.00 0.00 C ATOM 1092 NZ LYS A 74 -14.717 6.346 -7.641 1.00 0.00 N ATOM 0 H LYS A 74 -12.702 4.376 -2.383 1.00 0.00 H new ATOM 0 HA LYS A 74 -13.048 2.540 -4.644 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -11.185 4.923 -4.433 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -11.804 4.161 -5.885 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -14.133 4.915 -5.159 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -13.356 5.854 -3.901 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -13.553 7.421 -5.624 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -11.908 6.856 -5.834 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -12.657 6.673 -8.012 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -13.043 5.064 -7.435 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -15.038 5.617 -8.310 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -15.286 6.293 -6.772 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -14.830 7.286 -8.072 1.00 0.00 H new ATOM 1106 N LEU A 75 -10.935 1.264 -4.502 1.00 0.00 N ATOM 1107 CA LEU A 75 -9.749 0.428 -4.353 1.00 0.00 C ATOM 1108 C LEU A 75 -8.804 0.606 -5.536 1.00 0.00 C ATOM 1109 O LEU A 75 -8.957 -0.046 -6.570 1.00 0.00 O ATOM 1110 CB LEU A 75 -10.152 -1.043 -4.223 1.00 0.00 C ATOM 1111 CG LEU A 75 -9.099 -1.977 -3.626 1.00 0.00 C ATOM 1112 CD1 LEU A 75 -8.684 -1.499 -2.243 1.00 0.00 C ATOM 1113 CD2 LEU A 75 -9.625 -3.403 -3.564 1.00 0.00 C ATOM 0 H LEU A 75 -11.620 0.910 -5.170 1.00 0.00 H new ATOM 0 HA LEU A 75 -9.228 0.738 -3.447 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -11.050 -1.100 -3.608 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -10.419 -1.415 -5.212 1.00 0.00 H new ATOM 0 HG LEU A 75 -8.221 -1.963 -4.271 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -7.934 -2.176 -1.834 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -8.266 -0.495 -2.315 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -9.555 -1.483 -1.587 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -8.862 -4.054 -3.136 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -10.519 -3.434 -2.941 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -9.871 -3.744 -4.570 1.00 0.00 H new ATOM 1125 N VAL A 76 -7.826 1.491 -5.378 1.00 0.00 N ATOM 1126 CA VAL A 76 -6.853 1.753 -6.432 1.00 0.00 C ATOM 1127 C VAL A 76 -5.562 0.979 -6.193 1.00 0.00 C ATOM 1128 O VAL A 76 -4.740 1.365 -5.360 1.00 0.00 O ATOM 1129 CB VAL A 76 -6.527 3.255 -6.535 1.00 0.00 C ATOM 1130 CG1 VAL A 76 -6.167 3.818 -5.168 1.00 0.00 C ATOM 1131 CG2 VAL A 76 -5.401 3.488 -7.530 1.00 0.00 C ATOM 0 H VAL A 76 -7.686 2.039 -4.529 1.00 0.00 H new ATOM 0 HA VAL A 76 -7.304 1.422 -7.368 1.00 0.00 H new ATOM 0 HB VAL A 76 -7.413 3.778 -6.895 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -5.940 4.880 -5.260 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -7.007 3.685 -4.487 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -5.296 3.293 -4.776 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -5.184 4.554 -7.590 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -4.509 2.954 -7.202 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -5.702 3.123 -8.512 1.00 0.00 H new ATOM 1141 N CYS A 77 -5.389 -0.114 -6.927 1.00 0.00 N ATOM 1142 CA CYS A 77 -4.196 -0.944 -6.795 1.00 0.00 C ATOM 1143 C CYS A 77 -3.528 -1.154 -8.150 1.00 0.00 C ATOM 1144 O CYS A 77 -4.137 -0.929 -9.196 1.00 0.00 O ATOM 1145 CB CYS A 77 -4.556 -2.295 -6.175 1.00 0.00 C ATOM 1146 SG CYS A 77 -5.783 -3.235 -7.113 1.00 0.00 S ATOM 0 H CYS A 77 -6.059 -0.447 -7.620 1.00 0.00 H new ATOM 0 HA CYS A 77 -3.494 -0.428 -6.140 1.00 0.00 H new ATOM 0 HB2 CYS A 77 -3.649 -2.893 -6.082 1.00 0.00 H new ATOM 0 HB3 CYS A 77 -4.934 -2.130 -5.166 1.00 0.00 H new ATOM 0 HG CYS A 77 -5.456 -4.493 -7.117 1.00 0.00 H new ATOM 1152 N SER A 78 -2.271 -1.586 -8.123 1.00 0.00 N ATOM 1153 CA SER A 78 -1.517 -1.821 -9.348 1.00 0.00 C ATOM 1154 C SER A 78 -1.856 -3.186 -9.941 1.00 0.00 C ATOM 1155 O SER A 78 -2.485 -4.030 -9.302 1.00 0.00 O ATOM 1156 CB SER A 78 -0.015 -1.732 -9.073 1.00 0.00 C ATOM 1157 OG SER A 78 0.240 -1.509 -7.697 1.00 0.00 O ATOM 0 H SER A 78 -1.754 -1.780 -7.266 1.00 0.00 H new ATOM 0 HA SER A 78 -1.794 -1.051 -10.069 1.00 0.00 H new ATOM 0 HB2 SER A 78 0.471 -2.654 -9.391 1.00 0.00 H new ATOM 0 HB3 SER A 78 0.418 -0.924 -9.662 1.00 0.00 H new ATOM 0 HG SER A 78 1.207 -1.458 -7.548 1.00 0.00 H new ATOM 1163 N PRO A 79 -1.431 -3.408 -11.194 1.00 0.00 N ATOM 1164 CA PRO A 79 -1.677 -4.668 -11.901 1.00 0.00 C ATOM 1165 C PRO A 79 -0.875 -5.826 -11.319 1.00 0.00 C ATOM 1166 O PRO A 79 -1.269 -6.987 -11.435 1.00 0.00 O ATOM 1167 CB PRO A 79 -1.220 -4.367 -13.331 1.00 0.00 C ATOM 1168 CG PRO A 79 -0.220 -3.272 -13.186 1.00 0.00 C ATOM 1169 CD PRO A 79 -0.676 -2.447 -12.015 1.00 0.00 C ATOM 0 HA PRO A 79 -2.719 -4.979 -11.828 1.00 0.00 H new ATOM 0 HB2 PRO A 79 -0.779 -5.247 -13.799 1.00 0.00 H new ATOM 0 HB3 PRO A 79 -2.057 -4.059 -13.958 1.00 0.00 H new ATOM 0 HG2 PRO A 79 0.778 -3.675 -13.014 1.00 0.00 H new ATOM 0 HG3 PRO A 79 -0.168 -2.668 -14.092 1.00 0.00 H new ATOM 0 HD2 PRO A 79 0.167 -2.026 -11.467 1.00 0.00 H new ATOM 0 HD3 PRO A 79 -1.300 -1.611 -12.331 1.00 0.00 H new ATOM 1177 N ASP A 80 0.251 -5.504 -10.692 1.00 0.00 N ATOM 1178 CA ASP A 80 1.107 -6.519 -10.089 1.00 0.00 C ATOM 1179 C ASP A 80 0.366 -7.272 -8.989 1.00 0.00 C ATOM 1180 O ASP A 80 0.678 -8.427 -8.695 1.00 0.00 O ATOM 1181 CB ASP A 80 2.373 -5.875 -9.520 1.00 0.00 C ATOM 1182 CG ASP A 80 3.312 -5.386 -10.605 1.00 0.00 C ATOM 1183 OD1 ASP A 80 3.145 -5.809 -11.769 1.00 0.00 O ATOM 1184 OD2 ASP A 80 4.213 -4.581 -10.291 1.00 0.00 O ATOM 0 H ASP A 80 0.592 -4.548 -10.588 1.00 0.00 H new ATOM 0 HA ASP A 80 1.387 -7.231 -10.865 1.00 0.00 H new ATOM 0 HB2 ASP A 80 2.095 -5.038 -8.880 1.00 0.00 H new ATOM 0 HB3 ASP A 80 2.894 -6.598 -8.892 1.00 0.00 H new ATOM 1189 N TYR A 81 -0.614 -6.611 -8.383 1.00 0.00 N ATOM 1190 CA TYR A 81 -1.397 -7.217 -7.313 1.00 0.00 C ATOM 1191 C TYR A 81 -2.817 -7.518 -7.781 1.00 0.00 C ATOM 1192 O TYR A 81 -3.715 -7.745 -6.970 1.00 0.00 O ATOM 1193 CB TYR A 81 -1.434 -6.294 -6.094 1.00 0.00 C ATOM 1194 CG TYR A 81 -0.298 -6.526 -5.124 1.00 0.00 C ATOM 1195 CD1 TYR A 81 0.973 -6.855 -5.577 1.00 0.00 C ATOM 1196 CD2 TYR A 81 -0.496 -6.414 -3.753 1.00 0.00 C ATOM 1197 CE1 TYR A 81 2.013 -7.068 -4.694 1.00 0.00 C ATOM 1198 CE2 TYR A 81 0.539 -6.624 -2.862 1.00 0.00 C ATOM 1199 CZ TYR A 81 1.792 -6.952 -3.338 1.00 0.00 C ATOM 1200 OH TYR A 81 2.826 -7.162 -2.455 1.00 0.00 O ATOM 0 H TYR A 81 -0.885 -5.655 -8.615 1.00 0.00 H new ATOM 0 HA TYR A 81 -0.919 -8.156 -7.034 1.00 0.00 H new ATOM 0 HB2 TYR A 81 -1.406 -5.258 -6.432 1.00 0.00 H new ATOM 0 HB3 TYR A 81 -2.381 -6.433 -5.572 1.00 0.00 H new ATOM 0 HD1 TYR A 81 1.151 -6.946 -6.638 1.00 0.00 H new ATOM 0 HD2 TYR A 81 -1.476 -6.158 -3.377 1.00 0.00 H new ATOM 0 HE1 TYR A 81 2.995 -7.324 -5.064 1.00 0.00 H new ATOM 0 HE2 TYR A 81 0.368 -6.532 -1.800 1.00 0.00 H new ATOM 0 HH TYR A 81 2.503 -7.040 -1.538 1.00 0.00 H new ATOM 1210 N ALA A 82 -3.013 -7.519 -9.095 1.00 0.00 N ATOM 1211 CA ALA A 82 -4.322 -7.795 -9.673 1.00 0.00 C ATOM 1212 C ALA A 82 -4.191 -8.400 -11.066 1.00 0.00 C ATOM 1213 O ALA A 82 -3.108 -8.822 -11.471 1.00 0.00 O ATOM 1214 CB ALA A 82 -5.155 -6.523 -9.724 1.00 0.00 C ATOM 0 H ALA A 82 -2.281 -7.332 -9.780 1.00 0.00 H new ATOM 0 HA ALA A 82 -4.827 -8.522 -9.036 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -6.130 -6.744 -10.158 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -5.287 -6.134 -8.714 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -4.646 -5.779 -10.336 1.00 0.00 H new ATOM 1220 N TYR A 83 -5.301 -8.440 -11.796 1.00 0.00 N ATOM 1221 CA TYR A 83 -5.311 -8.997 -13.143 1.00 0.00 C ATOM 1222 C TYR A 83 -5.078 -7.906 -14.185 1.00 0.00 C ATOM 1223 O TYR A 83 -5.349 -8.096 -15.370 1.00 0.00 O ATOM 1224 CB TYR A 83 -6.639 -9.703 -13.416 1.00 0.00 C ATOM 1225 CG TYR A 83 -7.846 -8.933 -12.929 1.00 0.00 C ATOM 1226 CD1 TYR A 83 -8.127 -7.662 -13.414 1.00 0.00 C ATOM 1227 CD2 TYR A 83 -8.706 -9.478 -11.983 1.00 0.00 C ATOM 1228 CE1 TYR A 83 -9.227 -6.955 -12.971 1.00 0.00 C ATOM 1229 CE2 TYR A 83 -9.810 -8.779 -11.535 1.00 0.00 C ATOM 1230 CZ TYR A 83 -10.066 -7.518 -12.032 1.00 0.00 C ATOM 1231 OH TYR A 83 -11.165 -6.817 -11.589 1.00 0.00 O ATOM 0 H TYR A 83 -6.205 -8.093 -11.477 1.00 0.00 H new ATOM 0 HA TYR A 83 -4.501 -9.722 -13.215 1.00 0.00 H new ATOM 0 HB2 TYR A 83 -6.736 -9.874 -14.488 1.00 0.00 H new ATOM 0 HB3 TYR A 83 -6.626 -10.682 -12.937 1.00 0.00 H new ATOM 0 HD1 TYR A 83 -7.473 -7.219 -14.151 1.00 0.00 H new ATOM 0 HD2 TYR A 83 -8.508 -10.465 -11.591 1.00 0.00 H new ATOM 0 HE1 TYR A 83 -9.429 -5.967 -13.357 1.00 0.00 H new ATOM 0 HE2 TYR A 83 -10.469 -9.217 -10.800 1.00 0.00 H new ATOM 0 HH TYR A 83 -10.898 -5.904 -11.353 1.00 0.00 H new ATOM 1241 N GLY A 84 -4.573 -6.763 -13.732 1.00 0.00 N ATOM 1242 CA GLY A 84 -4.311 -5.658 -14.637 1.00 0.00 C ATOM 1243 C GLY A 84 -3.165 -5.946 -15.587 1.00 0.00 C ATOM 1244 O GLY A 84 -3.076 -5.351 -16.661 1.00 0.00 O ATOM 0 H GLY A 84 -4.341 -6.582 -12.755 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -5.211 -5.443 -15.213 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -4.082 -4.764 -14.057 1.00 0.00 H new ATOM 1248 N SER A 85 -2.284 -6.859 -15.190 1.00 0.00 N ATOM 1249 CA SER A 85 -1.135 -7.220 -16.012 1.00 0.00 C ATOM 1250 C SER A 85 -1.569 -7.559 -17.434 1.00 0.00 C ATOM 1251 O SER A 85 -1.320 -6.797 -18.369 1.00 0.00 O ATOM 1252 CB SER A 85 -0.394 -8.408 -15.395 1.00 0.00 C ATOM 1253 OG SER A 85 -1.303 -9.345 -14.844 1.00 0.00 O ATOM 0 H SER A 85 -2.344 -7.362 -14.305 1.00 0.00 H new ATOM 0 HA SER A 85 -0.463 -6.362 -16.051 1.00 0.00 H new ATOM 0 HB2 SER A 85 0.218 -8.894 -16.155 1.00 0.00 H new ATOM 0 HB3 SER A 85 0.284 -8.054 -14.618 1.00 0.00 H new ATOM 0 HG SER A 85 -0.805 -10.095 -14.458 1.00 0.00 H new ATOM 1259 N ARG A 86 -2.220 -8.707 -17.590 1.00 0.00 N ATOM 1260 CA ARG A 86 -2.688 -9.149 -18.898 1.00 0.00 C ATOM 1261 C ARG A 86 -3.798 -8.238 -19.414 1.00 0.00 C ATOM 1262 O ARG A 86 -3.793 -7.834 -20.576 1.00 0.00 O ATOM 1263 CB ARG A 86 -3.191 -10.592 -18.823 1.00 0.00 C ATOM 1264 CG ARG A 86 -4.192 -10.830 -17.704 1.00 0.00 C ATOM 1265 CD ARG A 86 -5.606 -10.973 -18.243 1.00 0.00 C ATOM 1266 NE ARG A 86 -5.754 -12.156 -19.087 1.00 0.00 N ATOM 1267 CZ ARG A 86 -5.804 -13.396 -18.613 1.00 0.00 C ATOM 1268 NH1 ARG A 86 -5.720 -13.614 -17.308 1.00 0.00 N ATOM 1269 NH2 ARG A 86 -5.939 -14.420 -19.445 1.00 0.00 N ATOM 0 H ARG A 86 -2.435 -9.348 -16.826 1.00 0.00 H new ATOM 0 HA ARG A 86 -1.849 -9.100 -19.592 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -3.652 -10.857 -19.774 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -2.339 -11.258 -18.685 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -3.918 -11.731 -17.155 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -4.153 -10.001 -16.997 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -6.307 -11.032 -17.410 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -5.867 -10.084 -18.817 1.00 0.00 H new ATOM 0 HE ARG A 86 -5.823 -12.023 -20.096 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -5.617 -12.829 -16.665 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -5.759 -14.567 -16.947 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -6.004 -14.256 -20.450 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -5.977 -15.372 -19.080 1.00 0.00 H new ATOM 1283 N GLY A 87 -4.749 -7.920 -18.541 1.00 0.00 N ATOM 1284 CA GLY A 87 -5.853 -7.060 -18.927 1.00 0.00 C ATOM 1285 C GLY A 87 -6.590 -7.575 -20.148 1.00 0.00 C ATOM 1286 O GLY A 87 -6.391 -8.716 -20.566 1.00 0.00 O ATOM 0 H GLY A 87 -4.775 -8.242 -17.574 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -6.551 -6.974 -18.094 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -5.475 -6.058 -19.130 1.00 0.00 H new ATOM 1290 N HIS A 88 -7.444 -6.733 -20.720 1.00 0.00 N ATOM 1291 CA HIS A 88 -8.215 -7.110 -21.900 1.00 0.00 C ATOM 1292 C HIS A 88 -8.527 -5.888 -22.758 1.00 0.00 C ATOM 1293 O HIS A 88 -8.556 -4.754 -22.280 1.00 0.00 O ATOM 1294 CB HIS A 88 -9.513 -7.804 -21.487 1.00 0.00 C ATOM 1295 CG HIS A 88 -9.362 -9.278 -21.269 1.00 0.00 C ATOM 1296 ND1 HIS A 88 -9.339 -10.193 -22.300 1.00 0.00 N ATOM 1297 CD2 HIS A 88 -9.224 -9.994 -20.129 1.00 0.00 C ATOM 1298 CE1 HIS A 88 -9.195 -11.409 -21.804 1.00 0.00 C ATOM 1299 NE2 HIS A 88 -9.122 -11.316 -20.488 1.00 0.00 N ATOM 0 H HIS A 88 -7.620 -5.785 -20.386 1.00 0.00 H new ATOM 0 HA HIS A 88 -7.615 -7.802 -22.490 1.00 0.00 H new ATOM 0 HB2 HIS A 88 -9.884 -7.346 -20.570 1.00 0.00 H new ATOM 0 HB3 HIS A 88 -10.267 -7.634 -22.256 1.00 0.00 H new ATOM 0 HD2 HIS A 88 -9.199 -9.599 -19.124 1.00 0.00 H new ATOM 0 HE1 HIS A 88 -9.145 -12.323 -22.377 1.00 0.00 H new ATOM 0 HE2 HIS A 88 -9.008 -12.098 -19.844 1.00 0.00 H new ATOM 1307 N PRO A 89 -8.767 -6.122 -24.057 1.00 0.00 N ATOM 1308 CA PRO A 89 -9.081 -5.053 -25.009 1.00 0.00 C ATOM 1309 C PRO A 89 -10.458 -4.445 -24.764 1.00 0.00 C ATOM 1310 O PRO A 89 -11.478 -5.122 -24.888 1.00 0.00 O ATOM 1311 CB PRO A 89 -9.044 -5.762 -26.365 1.00 0.00 C ATOM 1312 CG PRO A 89 -9.341 -7.189 -26.054 1.00 0.00 C ATOM 1313 CD PRO A 89 -8.749 -7.449 -24.696 1.00 0.00 C ATOM 0 HA PRO A 89 -8.383 -4.219 -24.930 1.00 0.00 H new ATOM 0 HB2 PRO A 89 -9.781 -5.344 -27.050 1.00 0.00 H new ATOM 0 HB3 PRO A 89 -8.069 -5.655 -26.841 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -10.415 -7.373 -26.053 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -8.905 -7.850 -26.803 1.00 0.00 H new ATOM 0 HD2 PRO A 89 -9.337 -8.174 -24.133 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -7.737 -7.847 -24.768 1.00 0.00 H new ATOM 1321 N GLY A 90 -10.480 -3.162 -24.415 1.00 0.00 N ATOM 1322 CA GLY A 90 -11.738 -2.485 -24.158 1.00 0.00 C ATOM 1323 C GLY A 90 -12.284 -2.780 -22.775 1.00 0.00 C ATOM 1324 O GLY A 90 -13.413 -2.411 -22.454 1.00 0.00 O ATOM 0 H GLY A 90 -9.650 -2.580 -24.306 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -11.597 -1.410 -24.268 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -12.470 -2.789 -24.906 1.00 0.00 H new ATOM 1328 N VAL A 91 -11.481 -3.449 -21.954 1.00 0.00 N ATOM 1329 CA VAL A 91 -11.890 -3.795 -20.598 1.00 0.00 C ATOM 1330 C VAL A 91 -10.833 -3.378 -19.582 1.00 0.00 C ATOM 1331 O VAL A 91 -11.104 -2.586 -18.679 1.00 0.00 O ATOM 1332 CB VAL A 91 -12.152 -5.307 -20.459 1.00 0.00 C ATOM 1333 CG1 VAL A 91 -12.746 -5.623 -19.095 1.00 0.00 C ATOM 1334 CG2 VAL A 91 -13.066 -5.793 -21.574 1.00 0.00 C ATOM 0 H VAL A 91 -10.543 -3.762 -22.204 1.00 0.00 H new ATOM 0 HA VAL A 91 -12.815 -3.254 -20.399 1.00 0.00 H new ATOM 0 HB VAL A 91 -11.201 -5.833 -20.544 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -12.924 -6.695 -19.015 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -12.052 -5.312 -18.315 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -13.689 -5.089 -18.976 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -13.241 -6.863 -21.461 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -14.017 -5.263 -21.522 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -12.596 -5.602 -22.539 1.00 0.00 H new ATOM 1344 N ILE A 92 -9.628 -3.915 -19.736 1.00 0.00 N ATOM 1345 CA ILE A 92 -8.529 -3.597 -18.833 1.00 0.00 C ATOM 1346 C ILE A 92 -7.261 -3.255 -19.608 1.00 0.00 C ATOM 1347 O ILE A 92 -6.873 -3.947 -20.549 1.00 0.00 O ATOM 1348 CB ILE A 92 -8.231 -4.766 -17.875 1.00 0.00 C ATOM 1349 CG1 ILE A 92 -9.472 -5.102 -17.044 1.00 0.00 C ATOM 1350 CG2 ILE A 92 -7.058 -4.424 -16.969 1.00 0.00 C ATOM 1351 CD1 ILE A 92 -9.260 -6.247 -16.078 1.00 0.00 C ATOM 0 H ILE A 92 -9.388 -4.573 -20.478 1.00 0.00 H new ATOM 0 HA ILE A 92 -8.841 -2.730 -18.250 1.00 0.00 H new ATOM 0 HB ILE A 92 -7.964 -5.642 -18.467 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -9.776 -4.217 -16.485 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -10.293 -5.352 -17.716 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -6.860 -5.260 -16.298 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -6.174 -4.229 -17.576 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -7.298 -3.537 -16.382 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -10.180 -6.430 -15.523 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -8.986 -7.145 -16.632 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -8.461 -5.992 -15.382 1.00 0.00 H new ATOM 1363 N PRO A 93 -6.598 -2.161 -19.204 1.00 0.00 N ATOM 1364 CA PRO A 93 -5.363 -1.702 -19.845 1.00 0.00 C ATOM 1365 C PRO A 93 -4.187 -2.635 -19.573 1.00 0.00 C ATOM 1366 O PRO A 93 -4.187 -3.409 -18.616 1.00 0.00 O ATOM 1367 CB PRO A 93 -5.118 -0.333 -19.206 1.00 0.00 C ATOM 1368 CG PRO A 93 -5.805 -0.403 -17.886 1.00 0.00 C ATOM 1369 CD PRO A 93 -7.004 -1.288 -18.089 1.00 0.00 C ATOM 0 HA PRO A 93 -5.455 -1.670 -20.931 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -4.052 -0.136 -19.088 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -5.524 0.470 -19.822 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -5.143 -0.812 -17.123 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -6.105 0.589 -17.549 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -7.236 -1.863 -17.192 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -7.894 -0.709 -18.335 1.00 0.00 H new ATOM 1377 N PRO A 94 -3.161 -2.561 -20.434 1.00 0.00 N ATOM 1378 CA PRO A 94 -1.960 -3.392 -20.305 1.00 0.00 C ATOM 1379 C PRO A 94 -1.108 -2.998 -19.104 1.00 0.00 C ATOM 1380 O PRO A 94 -0.372 -2.013 -19.149 1.00 0.00 O ATOM 1381 CB PRO A 94 -1.203 -3.124 -21.609 1.00 0.00 C ATOM 1382 CG PRO A 94 -1.662 -1.775 -22.043 1.00 0.00 C ATOM 1383 CD PRO A 94 -3.094 -1.662 -21.597 1.00 0.00 C ATOM 0 HA PRO A 94 -2.206 -4.442 -20.146 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -0.125 -3.144 -21.452 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -1.429 -3.880 -22.361 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -1.051 -0.992 -21.595 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -1.580 -1.664 -23.124 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -3.351 -0.638 -21.328 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -3.785 -1.969 -22.382 1.00 0.00 H new ATOM 1391 N ASN A 95 -1.214 -3.773 -18.030 1.00 0.00 N ATOM 1392 CA ASN A 95 -0.452 -3.504 -16.815 1.00 0.00 C ATOM 1393 C ASN A 95 -0.583 -2.041 -16.403 1.00 0.00 C ATOM 1394 O ASN A 95 0.401 -1.304 -16.373 1.00 0.00 O ATOM 1395 CB ASN A 95 1.022 -3.857 -17.024 1.00 0.00 C ATOM 1396 CG ASN A 95 1.206 -5.059 -17.930 1.00 0.00 C ATOM 1397 OD1 ASN A 95 1.326 -6.191 -17.462 1.00 0.00 O ATOM 1398 ND2 ASN A 95 1.230 -4.816 -19.236 1.00 0.00 N ATOM 0 H ASN A 95 -1.820 -4.592 -17.976 1.00 0.00 H new ATOM 0 HA ASN A 95 -0.858 -4.125 -16.017 1.00 0.00 H new ATOM 0 HB2 ASN A 95 1.541 -3.000 -17.453 1.00 0.00 H new ATOM 0 HB3 ASN A 95 1.485 -4.059 -16.058 1.00 0.00 H new ATOM 0 HD21 ASN A 95 1.352 -5.584 -19.896 1.00 0.00 H new ATOM 0 HD22 ASN A 95 1.127 -3.861 -19.579 1.00 0.00 H new ATOM 1405 N ALA A 96 -1.806 -1.628 -16.087 1.00 0.00 N ATOM 1406 CA ALA A 96 -2.066 -0.255 -15.675 1.00 0.00 C ATOM 1407 C ALA A 96 -2.872 -0.213 -14.381 1.00 0.00 C ATOM 1408 O ALA A 96 -3.738 -1.057 -14.149 1.00 0.00 O ATOM 1409 CB ALA A 96 -2.796 0.498 -16.778 1.00 0.00 C ATOM 0 H ALA A 96 -2.632 -2.225 -16.109 1.00 0.00 H new ATOM 0 HA ALA A 96 -1.107 0.230 -15.491 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -2.984 1.522 -16.456 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -2.183 0.507 -17.679 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -3.745 0.004 -16.989 1.00 0.00 H new ATOM 1415 N THR A 97 -2.581 0.774 -13.540 1.00 0.00 N ATOM 1416 CA THR A 97 -3.277 0.925 -12.268 1.00 0.00 C ATOM 1417 C THR A 97 -4.786 0.997 -12.472 1.00 0.00 C ATOM 1418 O THR A 97 -5.271 1.713 -13.349 1.00 0.00 O ATOM 1419 CB THR A 97 -2.812 2.187 -11.518 1.00 0.00 C ATOM 1420 OG1 THR A 97 -1.381 2.255 -11.516 1.00 0.00 O ATOM 1421 CG2 THR A 97 -3.327 2.188 -10.087 1.00 0.00 C ATOM 0 H THR A 97 -1.868 1.481 -13.717 1.00 0.00 H new ATOM 0 HA THR A 97 -3.035 0.046 -11.670 1.00 0.00 H new ATOM 0 HB THR A 97 -3.217 3.059 -12.032 1.00 0.00 H new ATOM 0 HG1 THR A 97 -1.092 3.061 -11.039 1.00 0.00 H new ATOM 0 HG21 THR A 97 -2.985 3.089 -9.578 1.00 0.00 H new ATOM 0 HG22 THR A 97 -4.417 2.165 -10.092 1.00 0.00 H new ATOM 0 HG23 THR A 97 -2.949 1.310 -9.563 1.00 0.00 H new ATOM 1429 N LEU A 98 -5.525 0.251 -11.658 1.00 0.00 N ATOM 1430 CA LEU A 98 -6.981 0.230 -11.749 1.00 0.00 C ATOM 1431 C LEU A 98 -7.615 0.591 -10.410 1.00 0.00 C ATOM 1432 O LEU A 98 -7.047 0.326 -9.350 1.00 0.00 O ATOM 1433 CB LEU A 98 -7.464 -1.149 -12.200 1.00 0.00 C ATOM 1434 CG LEU A 98 -7.424 -1.416 -13.705 1.00 0.00 C ATOM 1435 CD1 LEU A 98 -6.300 -2.382 -14.047 1.00 0.00 C ATOM 1436 CD2 LEU A 98 -8.761 -1.959 -14.187 1.00 0.00 C ATOM 0 H LEU A 98 -5.140 -0.347 -10.927 1.00 0.00 H new ATOM 0 HA LEU A 98 -7.285 0.973 -12.486 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -6.858 -1.905 -11.701 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -8.489 -1.283 -11.855 1.00 0.00 H new ATOM 0 HG LEU A 98 -7.232 -0.472 -14.216 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -6.288 -2.560 -15.122 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -5.346 -1.954 -13.739 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -6.460 -3.326 -13.525 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -8.713 -2.143 -15.260 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -8.983 -2.892 -13.669 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -9.546 -1.232 -13.978 1.00 0.00 H new ATOM 1448 N THR A 99 -8.798 1.196 -10.465 1.00 0.00 N ATOM 1449 CA THR A 99 -9.511 1.592 -9.257 1.00 0.00 C ATOM 1450 C THR A 99 -10.896 0.958 -9.203 1.00 0.00 C ATOM 1451 O THR A 99 -11.820 1.401 -9.886 1.00 0.00 O ATOM 1452 CB THR A 99 -9.655 3.122 -9.166 1.00 0.00 C ATOM 1453 OG1 THR A 99 -8.387 3.748 -9.391 1.00 0.00 O ATOM 1454 CG2 THR A 99 -10.196 3.535 -7.806 1.00 0.00 C ATOM 0 H THR A 99 -9.282 1.422 -11.334 1.00 0.00 H new ATOM 0 HA THR A 99 -8.920 1.239 -8.412 1.00 0.00 H new ATOM 0 HB THR A 99 -10.360 3.444 -9.933 1.00 0.00 H new ATOM 0 HG1 THR A 99 -8.488 4.721 -9.333 1.00 0.00 H new ATOM 0 HG21 THR A 99 -10.289 4.620 -7.766 1.00 0.00 H new ATOM 0 HG22 THR A 99 -11.175 3.081 -7.651 1.00 0.00 H new ATOM 0 HG23 THR A 99 -9.513 3.200 -7.026 1.00 0.00 H new ATOM 1462 N PHE A 100 -11.035 -0.082 -8.386 1.00 0.00 N ATOM 1463 CA PHE A 100 -12.308 -0.777 -8.244 1.00 0.00 C ATOM 1464 C PHE A 100 -13.018 -0.355 -6.960 1.00 0.00 C ATOM 1465 O PHE A 100 -12.498 -0.543 -5.860 1.00 0.00 O ATOM 1466 CB PHE A 100 -12.090 -2.292 -8.244 1.00 0.00 C ATOM 1467 CG PHE A 100 -11.369 -2.793 -9.463 1.00 0.00 C ATOM 1468 CD1 PHE A 100 -11.710 -2.331 -10.724 1.00 0.00 C ATOM 1469 CD2 PHE A 100 -10.351 -3.725 -9.347 1.00 0.00 C ATOM 1470 CE1 PHE A 100 -11.048 -2.791 -11.847 1.00 0.00 C ATOM 1471 CE2 PHE A 100 -9.686 -4.189 -10.467 1.00 0.00 C ATOM 1472 CZ PHE A 100 -10.034 -3.720 -11.718 1.00 0.00 C ATOM 0 H PHE A 100 -10.281 -0.461 -7.813 1.00 0.00 H new ATOM 0 HA PHE A 100 -12.937 -0.507 -9.093 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -11.522 -2.570 -7.356 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -13.057 -2.790 -8.173 1.00 0.00 H new ATOM 0 HD1 PHE A 100 -12.501 -1.604 -10.831 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -10.073 -4.094 -8.371 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -11.324 -2.424 -12.825 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -8.895 -4.917 -10.363 1.00 0.00 H new ATOM 0 HZ PHE A 100 -9.514 -4.079 -12.594 1.00 0.00 H new ATOM 1482 N ASP A 101 -14.207 0.217 -7.110 1.00 0.00 N ATOM 1483 CA ASP A 101 -14.989 0.666 -5.964 1.00 0.00 C ATOM 1484 C ASP A 101 -15.539 -0.522 -5.182 1.00 0.00 C ATOM 1485 O ASP A 101 -16.428 -1.231 -5.652 1.00 0.00 O ATOM 1486 CB ASP A 101 -16.138 1.565 -6.424 1.00 0.00 C ATOM 1487 CG ASP A 101 -16.381 2.725 -5.479 1.00 0.00 C ATOM 1488 OD1 ASP A 101 -16.510 2.481 -4.261 1.00 0.00 O ATOM 1489 OD2 ASP A 101 -16.440 3.877 -5.957 1.00 0.00 O ATOM 0 H ASP A 101 -14.651 0.381 -8.014 1.00 0.00 H new ATOM 0 HA ASP A 101 -14.331 1.237 -5.308 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -15.917 1.951 -7.419 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -17.048 0.972 -6.507 1.00 0.00 H new ATOM 1494 N VAL A 102 -15.002 -0.735 -3.984 1.00 0.00 N ATOM 1495 CA VAL A 102 -15.438 -1.838 -3.136 1.00 0.00 C ATOM 1496 C VAL A 102 -16.383 -1.351 -2.044 1.00 0.00 C ATOM 1497 O VAL A 102 -16.061 -0.426 -1.298 1.00 0.00 O ATOM 1498 CB VAL A 102 -14.239 -2.551 -2.482 1.00 0.00 C ATOM 1499 CG1 VAL A 102 -14.718 -3.651 -1.547 1.00 0.00 C ATOM 1500 CG2 VAL A 102 -13.308 -3.112 -3.546 1.00 0.00 C ATOM 0 H VAL A 102 -14.265 -0.158 -3.579 1.00 0.00 H new ATOM 0 HA VAL A 102 -15.964 -2.543 -3.779 1.00 0.00 H new ATOM 0 HB VAL A 102 -13.682 -1.823 -1.892 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -13.858 -4.144 -1.094 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -15.341 -3.218 -0.765 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -15.299 -4.381 -2.111 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -12.467 -3.612 -3.066 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -13.851 -3.827 -4.164 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -12.938 -2.299 -4.171 1.00 0.00 H new ATOM 1510 N GLU A 103 -17.551 -1.979 -1.955 1.00 0.00 N ATOM 1511 CA GLU A 103 -18.544 -1.609 -0.953 1.00 0.00 C ATOM 1512 C GLU A 103 -18.978 -2.826 -0.142 1.00 0.00 C ATOM 1513 O GLU A 103 -19.659 -3.716 -0.652 1.00 0.00 O ATOM 1514 CB GLU A 103 -19.761 -0.967 -1.622 1.00 0.00 C ATOM 1515 CG GLU A 103 -20.915 -0.711 -0.668 1.00 0.00 C ATOM 1516 CD GLU A 103 -22.145 -0.170 -1.371 1.00 0.00 C ATOM 1517 OE1 GLU A 103 -22.236 -0.319 -2.608 1.00 0.00 O ATOM 1518 OE2 GLU A 103 -23.017 0.403 -0.684 1.00 0.00 O ATOM 0 H GLU A 103 -17.833 -2.747 -2.565 1.00 0.00 H new ATOM 0 HA GLU A 103 -18.088 -0.887 -0.276 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -19.460 -0.023 -2.076 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -20.105 -1.614 -2.429 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -21.172 -1.639 -0.157 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -20.598 -0.003 0.098 1.00 0.00 H new ATOM 1525 N LEU A 104 -18.578 -2.858 1.125 1.00 0.00 N ATOM 1526 CA LEU A 104 -18.925 -3.965 2.009 1.00 0.00 C ATOM 1527 C LEU A 104 -20.432 -4.028 2.237 1.00 0.00 C ATOM 1528 O LEU A 104 -21.062 -3.025 2.575 1.00 0.00 O ATOM 1529 CB LEU A 104 -18.200 -3.821 3.348 1.00 0.00 C ATOM 1530 CG LEU A 104 -17.815 -5.126 4.046 1.00 0.00 C ATOM 1531 CD1 LEU A 104 -18.966 -6.118 3.997 1.00 0.00 C ATOM 1532 CD2 LEU A 104 -16.567 -5.722 3.411 1.00 0.00 C ATOM 0 H LEU A 104 -18.013 -2.130 1.563 1.00 0.00 H new ATOM 0 HA LEU A 104 -18.610 -4.892 1.531 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -17.294 -3.237 3.187 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -18.834 -3.245 4.022 1.00 0.00 H new ATOM 0 HG LEU A 104 -17.597 -4.906 5.091 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -18.673 -7.040 4.499 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -19.835 -5.692 4.499 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -19.216 -6.334 2.958 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -16.307 -6.650 3.920 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -16.757 -5.927 2.357 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -15.741 -5.016 3.500 1.00 0.00 H new ATOM 1544 N LEU A 105 -21.004 -5.213 2.054 1.00 0.00 N ATOM 1545 CA LEU A 105 -22.437 -5.408 2.242 1.00 0.00 C ATOM 1546 C LEU A 105 -22.710 -6.326 3.429 1.00 0.00 C ATOM 1547 O LEU A 105 -23.716 -6.178 4.123 1.00 0.00 O ATOM 1548 CB LEU A 105 -23.063 -5.994 0.975 1.00 0.00 C ATOM 1549 CG LEU A 105 -23.638 -4.984 -0.018 1.00 0.00 C ATOM 1550 CD1 LEU A 105 -22.526 -4.148 -0.633 1.00 0.00 C ATOM 1551 CD2 LEU A 105 -24.433 -5.696 -1.103 1.00 0.00 C ATOM 0 H LEU A 105 -20.497 -6.053 1.776 1.00 0.00 H new ATOM 0 HA LEU A 105 -22.887 -4.437 2.446 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -22.307 -6.588 0.462 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -23.859 -6.677 1.270 1.00 0.00 H new ATOM 0 HG LEU A 105 -24.311 -4.317 0.521 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -22.954 -3.435 -1.337 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -21.998 -3.609 0.154 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -21.828 -4.800 -1.157 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -24.835 -4.961 -1.801 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -23.781 -6.386 -1.638 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -25.253 -6.251 -0.648 1.00 0.00 H new ATOM 1563 N ARG A 106 -21.807 -7.274 3.658 1.00 0.00 N ATOM 1564 CA ARG A 106 -21.950 -8.216 4.762 1.00 0.00 C ATOM 1565 C ARG A 106 -20.689 -9.059 4.924 1.00 0.00 C ATOM 1566 O ARG A 106 -19.798 -9.032 4.075 1.00 0.00 O ATOM 1567 CB ARG A 106 -23.158 -9.126 4.530 1.00 0.00 C ATOM 1568 CG ARG A 106 -23.229 -9.697 3.124 1.00 0.00 C ATOM 1569 CD ARG A 106 -24.527 -10.457 2.896 1.00 0.00 C ATOM 1570 NE ARG A 106 -24.439 -11.840 3.356 1.00 0.00 N ATOM 1571 CZ ARG A 106 -25.492 -12.640 3.486 1.00 0.00 C ATOM 1572 NH1 ARG A 106 -26.706 -12.195 3.192 1.00 0.00 N ATOM 1573 NH2 ARG A 106 -25.332 -13.887 3.910 1.00 0.00 N ATOM 0 H ARG A 106 -20.968 -7.410 3.094 1.00 0.00 H new ATOM 0 HA ARG A 106 -22.104 -7.644 5.677 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -23.126 -9.948 5.246 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -24.070 -8.564 4.731 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -23.147 -8.889 2.397 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -22.382 -10.363 2.957 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -25.339 -9.952 3.419 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -24.774 -10.443 1.834 1.00 0.00 H new ATOM 0 HE ARG A 106 -23.519 -12.212 3.590 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -26.833 -11.237 2.865 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -27.513 -12.811 3.292 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -24.400 -14.233 4.137 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -26.141 -14.500 4.009 1.00 0.00 H new ATOM 1587 N VAL A 107 -20.619 -9.805 6.022 1.00 0.00 N ATOM 1588 CA VAL A 107 -19.468 -10.657 6.296 1.00 0.00 C ATOM 1589 C VAL A 107 -19.862 -11.857 7.149 1.00 0.00 C ATOM 1590 O VAL A 107 -20.827 -11.799 7.910 1.00 0.00 O ATOM 1591 CB VAL A 107 -18.351 -9.876 7.013 1.00 0.00 C ATOM 1592 CG1 VAL A 107 -18.771 -9.525 8.433 1.00 0.00 C ATOM 1593 CG2 VAL A 107 -17.057 -10.676 7.014 1.00 0.00 C ATOM 0 H VAL A 107 -21.346 -9.836 6.736 1.00 0.00 H new ATOM 0 HA VAL A 107 -19.097 -11.007 5.333 1.00 0.00 H new ATOM 0 HB VAL A 107 -18.176 -8.947 6.471 1.00 0.00 H new ATOM 0 HG11 VAL A 107 -17.969 -8.973 8.924 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -19.670 -8.910 8.405 1.00 0.00 H new ATOM 0 HG13 VAL A 107 -18.975 -10.440 8.989 1.00 0.00 H new ATOM 0 HG21 VAL A 107 -16.279 -10.109 7.525 1.00 0.00 H new ATOM 0 HG22 VAL A 107 -17.215 -11.622 7.531 1.00 0.00 H new ATOM 0 HG23 VAL A 107 -16.749 -10.871 5.987 1.00 0.00 H new ATOM 1603 N GLU A 108 -19.109 -12.944 7.015 1.00 0.00 N ATOM 1604 CA GLU A 108 -19.381 -14.159 7.774 1.00 0.00 C ATOM 1605 C GLU A 108 -18.108 -14.981 7.960 1.00 0.00 C ATOM 1606 O GLU A 108 -17.267 -15.051 7.064 1.00 0.00 O ATOM 1607 CB GLU A 108 -20.446 -15.000 7.068 1.00 0.00 C ATOM 1608 CG GLU A 108 -21.847 -14.423 7.174 1.00 0.00 C ATOM 1609 CD GLU A 108 -22.923 -15.435 6.832 1.00 0.00 C ATOM 1610 OE1 GLU A 108 -22.577 -16.613 6.602 1.00 0.00 O ATOM 1611 OE2 GLU A 108 -24.110 -15.049 6.793 1.00 0.00 O ATOM 0 H GLU A 108 -18.307 -13.008 6.389 1.00 0.00 H new ATOM 0 HA GLU A 108 -19.751 -13.868 8.757 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -20.181 -15.097 6.015 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -20.443 -16.004 7.491 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -22.009 -14.055 8.187 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -21.934 -13.566 6.506 1.00 0.00 H new