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 -72:sc= -0.211 USER MOD Set 1.2: A 71 GLN : amide:sc= 0.435 K(o=0.22,f=-1.1) USER MOD Set 2.1: A 26 HIS : no HD1:sc= -0.0565 X(o=0.078,f=0) USER MOD Set 2.2: A 40 SER OG : rot -80:sc= 0.135 USER MOD Set 3.1: A 18 LYS NZ :NH3+ -112:sc= -0.2 (180deg=-1.97!) USER MOD Set 3.2: A 21 GLN : amide:sc= -0.999 K(o=-1.2,f=-3.8) USER MOD Single : A 4 GLN : amide:sc= 0 X(o=0,f=-0.043) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0.0154 USER MOD Single : A 15 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 28 THR OG1 : rot 180:sc= -0.544 USER MOD Single : A 30 THR OG1 : rot 80:sc= 0.87 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 SER OG : rot 162:sc= -3.31! USER MOD Single : A 50 THR OG1 : rot 180:sc= -0.202 USER MOD Single : A 66 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 67 MET CE :methyl 174:sc= -1.29 (180deg=-1.39) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 CYS SG : rot 20:sc= -0.259 USER MOD Single : A 78 SER OG : rot 71:sc= 0.0973 USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 TYR OH : rot -14:sc= 1.86 USER MOD Single : A 85 SER OG : rot 180:sc= 0.144 USER MOD Single : A 88 HIS : no HD1:sc= -0.604 K(o=-0.6,f=-1.9) USER MOD Single : A 95 ASN : amide:sc= -2.83 K(o=-2.8,f=-4.3!) USER MOD Single : A 97 THR OG1 : rot 180:sc= 0.00398 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 18 N GLY A 2 1.021 -0.469 -2.939 1.00 0.00 N ATOM 19 CA GLY A 2 0.473 -1.215 -4.056 1.00 0.00 C ATOM 20 C GLY A 2 -1.043 -1.195 -4.077 1.00 0.00 C ATOM 21 O GLY A 2 -1.660 -1.485 -5.102 1.00 0.00 O ATOM 0 HA2 GLY A 2 0.852 -0.798 -4.989 1.00 0.00 H new ATOM 0 HA3 GLY A 2 0.819 -2.247 -4.005 1.00 0.00 H new ATOM 25 N VAL A 3 -1.645 -0.855 -2.942 1.00 0.00 N ATOM 26 CA VAL A 3 -3.098 -0.800 -2.834 1.00 0.00 C ATOM 27 C VAL A 3 -3.537 0.324 -1.903 1.00 0.00 C ATOM 28 O VAL A 3 -3.089 0.406 -0.760 1.00 0.00 O ATOM 29 CB VAL A 3 -3.674 -2.133 -2.320 1.00 0.00 C ATOM 30 CG1 VAL A 3 -3.028 -2.519 -0.998 1.00 0.00 C ATOM 31 CG2 VAL A 3 -5.186 -2.040 -2.178 1.00 0.00 C ATOM 0 H VAL A 3 -1.149 -0.613 -2.084 1.00 0.00 H new ATOM 0 HA VAL A 3 -3.483 -0.609 -3.836 1.00 0.00 H new ATOM 0 HB VAL A 3 -3.448 -2.912 -3.048 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -3.447 -3.463 -0.650 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -1.952 -2.629 -1.137 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -3.221 -1.742 -0.258 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -5.576 -2.990 -1.814 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -5.437 -1.250 -1.471 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -5.629 -1.813 -3.148 1.00 0.00 H new ATOM 41 N GLN A 4 -4.418 1.187 -2.399 1.00 0.00 N ATOM 42 CA GLN A 4 -4.918 2.307 -1.610 1.00 0.00 C ATOM 43 C GLN A 4 -6.439 2.263 -1.506 1.00 0.00 C ATOM 44 O GLN A 4 -7.122 1.816 -2.427 1.00 0.00 O ATOM 45 CB GLN A 4 -4.476 3.633 -2.231 1.00 0.00 C ATOM 46 CG GLN A 4 -3.360 4.322 -1.462 1.00 0.00 C ATOM 47 CD GLN A 4 -1.982 3.873 -1.905 1.00 0.00 C ATOM 48 OE1 GLN A 4 -1.619 4.005 -3.075 1.00 0.00 O ATOM 49 NE2 GLN A 4 -1.205 3.337 -0.971 1.00 0.00 N ATOM 0 H GLN A 4 -4.800 1.132 -3.343 1.00 0.00 H new ATOM 0 HA GLN A 4 -4.501 2.227 -0.606 1.00 0.00 H new ATOM 0 HB2 GLN A 4 -4.144 3.453 -3.254 1.00 0.00 H new ATOM 0 HB3 GLN A 4 -5.334 4.302 -2.287 1.00 0.00 H new ATOM 0 HG2 GLN A 4 -3.446 5.401 -1.593 1.00 0.00 H new ATOM 0 HG3 GLN A 4 -3.479 4.120 -0.398 1.00 0.00 H new ATOM 0 HE21 GLN A 4 -1.546 3.247 -0.014 1.00 0.00 H new ATOM 0 HE22 GLN A 4 -0.267 3.015 -1.211 1.00 0.00 H new ATOM 58 N VAL A 5 -6.963 2.729 -0.377 1.00 0.00 N ATOM 59 CA VAL A 5 -8.404 2.744 -0.152 1.00 0.00 C ATOM 60 C VAL A 5 -8.906 4.161 0.098 1.00 0.00 C ATOM 61 O VAL A 5 -8.515 4.808 1.070 1.00 0.00 O ATOM 62 CB VAL A 5 -8.795 1.854 1.043 1.00 0.00 C ATOM 63 CG1 VAL A 5 -8.001 2.243 2.281 1.00 0.00 C ATOM 64 CG2 VAL A 5 -10.290 1.944 1.307 1.00 0.00 C ATOM 0 H VAL A 5 -6.412 3.101 0.396 1.00 0.00 H new ATOM 0 HA VAL A 5 -8.870 2.351 -1.056 1.00 0.00 H new ATOM 0 HB VAL A 5 -8.555 0.819 0.798 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -8.291 1.604 3.115 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -6.936 2.121 2.083 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -8.207 3.283 2.533 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -10.549 1.309 2.154 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -10.558 2.976 1.532 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -10.836 1.611 0.424 1.00 0.00 H new ATOM 74 N VAL A 6 -9.777 4.639 -0.785 1.00 0.00 N ATOM 75 CA VAL A 6 -10.336 5.980 -0.660 1.00 0.00 C ATOM 76 C VAL A 6 -11.741 5.937 -0.071 1.00 0.00 C ATOM 77 O VAL A 6 -12.718 5.701 -0.782 1.00 0.00 O ATOM 78 CB VAL A 6 -10.384 6.698 -2.022 1.00 0.00 C ATOM 79 CG1 VAL A 6 -10.787 8.154 -1.844 1.00 0.00 C ATOM 80 CG2 VAL A 6 -9.040 6.591 -2.728 1.00 0.00 C ATOM 0 H VAL A 6 -10.111 4.117 -1.595 1.00 0.00 H new ATOM 0 HA VAL A 6 -9.680 6.534 0.011 1.00 0.00 H new ATOM 0 HB VAL A 6 -11.135 6.211 -2.644 1.00 0.00 H new ATOM 0 HG11 VAL A 6 -10.816 8.645 -2.817 1.00 0.00 H new ATOM 0 HG12 VAL A 6 -11.773 8.205 -1.383 1.00 0.00 H new ATOM 0 HG13 VAL A 6 -10.061 8.657 -1.205 1.00 0.00 H new ATOM 0 HG21 VAL A 6 -9.092 7.104 -3.689 1.00 0.00 H new ATOM 0 HG22 VAL A 6 -8.268 7.052 -2.112 1.00 0.00 H new ATOM 0 HG23 VAL A 6 -8.797 5.541 -2.890 1.00 0.00 H new ATOM 90 N THR A 7 -11.837 6.169 1.235 1.00 0.00 N ATOM 91 CA THR A 7 -13.122 6.156 1.921 1.00 0.00 C ATOM 92 C THR A 7 -14.114 7.099 1.249 1.00 0.00 C ATOM 93 O THR A 7 -13.891 8.309 1.187 1.00 0.00 O ATOM 94 CB THR A 7 -12.973 6.556 3.401 1.00 0.00 C ATOM 95 OG1 THR A 7 -11.780 5.982 3.946 1.00 0.00 O ATOM 96 CG2 THR A 7 -14.177 6.098 4.210 1.00 0.00 C ATOM 0 H THR A 7 -11.039 6.368 1.838 1.00 0.00 H new ATOM 0 HA THR A 7 -13.500 5.135 1.864 1.00 0.00 H new ATOM 0 HB THR A 7 -12.911 7.643 3.456 1.00 0.00 H new ATOM 0 HG1 THR A 7 -11.692 6.242 4.887 1.00 0.00 H new ATOM 0 HG21 THR A 7 -14.049 6.392 5.252 1.00 0.00 H new ATOM 0 HG22 THR A 7 -15.080 6.560 3.811 1.00 0.00 H new ATOM 0 HG23 THR A 7 -14.266 5.013 4.147 1.00 0.00 H new ATOM 104 N LEU A 8 -15.209 6.539 0.748 1.00 0.00 N ATOM 105 CA LEU A 8 -16.236 7.330 0.080 1.00 0.00 C ATOM 106 C LEU A 8 -17.395 7.628 1.026 1.00 0.00 C ATOM 107 O LEU A 8 -17.827 8.773 1.154 1.00 0.00 O ATOM 108 CB LEU A 8 -16.750 6.595 -1.158 1.00 0.00 C ATOM 109 CG LEU A 8 -15.704 6.261 -2.223 1.00 0.00 C ATOM 110 CD1 LEU A 8 -16.068 4.972 -2.943 1.00 0.00 C ATOM 111 CD2 LEU A 8 -15.569 7.408 -3.215 1.00 0.00 C ATOM 0 H LEU A 8 -15.409 5.540 0.792 1.00 0.00 H new ATOM 0 HA LEU A 8 -15.789 8.275 -0.227 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -17.220 5.666 -0.835 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -17.528 7.203 -1.620 1.00 0.00 H new ATOM 0 HG LEU A 8 -14.743 6.118 -1.729 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -15.313 4.751 -3.697 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -16.114 4.154 -2.224 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -17.039 5.086 -3.425 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -14.821 7.154 -3.966 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -16.528 7.582 -3.703 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -15.261 8.311 -2.688 1.00 0.00 H new ATOM 123 N ALA A 9 -17.893 6.589 1.689 1.00 0.00 N ATOM 124 CA ALA A 9 -18.998 6.740 2.627 1.00 0.00 C ATOM 125 C ALA A 9 -18.840 5.801 3.818 1.00 0.00 C ATOM 126 O ALA A 9 -18.914 4.581 3.672 1.00 0.00 O ATOM 127 CB ALA A 9 -20.324 6.486 1.925 1.00 0.00 C ATOM 0 H ALA A 9 -17.548 5.634 1.594 1.00 0.00 H new ATOM 0 HA ALA A 9 -18.987 7.764 3.001 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -21.141 6.602 2.637 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -20.448 7.201 1.111 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -20.335 5.473 1.523 1.00 0.00 H new ATOM 133 N ALA A 10 -18.621 6.377 4.995 1.00 0.00 N ATOM 134 CA ALA A 10 -18.454 5.591 6.211 1.00 0.00 C ATOM 135 C ALA A 10 -19.598 4.598 6.384 1.00 0.00 C ATOM 136 O ALA A 10 -20.706 4.821 5.898 1.00 0.00 O ATOM 137 CB ALA A 10 -18.360 6.507 7.423 1.00 0.00 C ATOM 0 H ALA A 10 -18.555 7.386 5.132 1.00 0.00 H new ATOM 0 HA ALA A 10 -17.526 5.025 6.124 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -18.236 5.907 8.324 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -17.505 7.173 7.310 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -19.272 7.098 7.504 1.00 0.00 H new ATOM 143 N GLY A 11 -19.322 3.500 7.081 1.00 0.00 N ATOM 144 CA GLY A 11 -20.339 2.489 7.306 1.00 0.00 C ATOM 145 C GLY A 11 -20.479 2.122 8.770 1.00 0.00 C ATOM 146 O GLY A 11 -20.708 2.988 9.614 1.00 0.00 O ATOM 0 H GLY A 11 -18.413 3.292 7.494 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -21.297 2.852 6.933 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -20.092 1.595 6.733 1.00 0.00 H new ATOM 150 N ASP A 12 -20.342 0.835 9.071 1.00 0.00 N ATOM 151 CA ASP A 12 -20.456 0.356 10.444 1.00 0.00 C ATOM 152 C ASP A 12 -19.185 0.658 11.232 1.00 0.00 C ATOM 153 O ASP A 12 -19.221 0.804 12.453 1.00 0.00 O ATOM 154 CB ASP A 12 -20.735 -1.148 10.460 1.00 0.00 C ATOM 155 CG ASP A 12 -22.132 -1.482 9.973 1.00 0.00 C ATOM 156 OD1 ASP A 12 -22.808 -0.576 9.444 1.00 0.00 O ATOM 157 OD2 ASP A 12 -22.549 -2.650 10.123 1.00 0.00 O ATOM 0 H ASP A 12 -20.152 0.106 8.384 1.00 0.00 H new ATOM 0 HA ASP A 12 -21.288 0.878 10.917 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -20.003 -1.657 9.833 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -20.606 -1.528 11.473 1.00 0.00 H new ATOM 162 N GLU A 13 -18.063 0.748 10.524 1.00 0.00 N ATOM 163 CA GLU A 13 -16.781 1.030 11.159 1.00 0.00 C ATOM 164 C GLU A 13 -16.655 0.287 12.486 1.00 0.00 C ATOM 165 O GLU A 13 -16.169 0.837 13.473 1.00 0.00 O ATOM 166 CB GLU A 13 -16.620 2.534 11.386 1.00 0.00 C ATOM 167 CG GLU A 13 -17.641 3.117 12.349 1.00 0.00 C ATOM 168 CD GLU A 13 -17.220 4.466 12.899 1.00 0.00 C ATOM 169 OE1 GLU A 13 -17.194 5.443 12.122 1.00 0.00 O ATOM 170 OE2 GLU A 13 -16.917 4.544 14.108 1.00 0.00 O ATOM 0 H GLU A 13 -18.016 0.630 9.512 1.00 0.00 H new ATOM 0 HA GLU A 13 -15.991 0.684 10.493 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -15.619 2.730 11.769 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -16.701 3.048 10.428 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -18.599 3.220 11.839 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -17.793 2.423 13.176 1.00 0.00 H new ATOM 177 N ALA A 14 -17.099 -0.966 12.500 1.00 0.00 N ATOM 178 CA ALA A 14 -17.035 -1.785 13.704 1.00 0.00 C ATOM 179 C ALA A 14 -16.810 -3.253 13.358 1.00 0.00 C ATOM 180 O ALA A 14 -16.030 -3.944 14.014 1.00 0.00 O ATOM 181 CB ALA A 14 -18.308 -1.622 14.521 1.00 0.00 C ATOM 0 H ALA A 14 -17.507 -1.435 11.691 1.00 0.00 H new ATOM 0 HA ALA A 14 -16.188 -1.446 14.300 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -18.247 -2.239 15.417 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -18.425 -0.577 14.807 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -19.166 -1.933 13.924 1.00 0.00 H new ATOM 187 N THR A 15 -17.499 -3.725 12.324 1.00 0.00 N ATOM 188 CA THR A 15 -17.375 -5.111 11.892 1.00 0.00 C ATOM 189 C THR A 15 -16.507 -5.223 10.644 1.00 0.00 C ATOM 190 O THR A 15 -16.879 -4.745 9.572 1.00 0.00 O ATOM 191 CB THR A 15 -18.754 -5.734 11.601 1.00 0.00 C ATOM 192 OG1 THR A 15 -19.741 -5.167 12.471 1.00 0.00 O ATOM 193 CG2 THR A 15 -18.715 -7.243 11.785 1.00 0.00 C ATOM 0 H THR A 15 -18.149 -3.167 11.770 1.00 0.00 H new ATOM 0 HA THR A 15 -16.903 -5.655 12.710 1.00 0.00 H new ATOM 0 HB THR A 15 -19.016 -5.517 10.565 1.00 0.00 H new ATOM 0 HG1 THR A 15 -20.615 -5.567 12.279 1.00 0.00 H new ATOM 0 HG21 THR A 15 -19.699 -7.661 11.574 1.00 0.00 H new ATOM 0 HG22 THR A 15 -17.984 -7.674 11.101 1.00 0.00 H new ATOM 0 HG23 THR A 15 -18.434 -7.477 12.812 1.00 0.00 H new ATOM 201 N TYR A 16 -15.349 -5.857 10.791 1.00 0.00 N ATOM 202 CA TYR A 16 -14.426 -6.030 9.675 1.00 0.00 C ATOM 203 C TYR A 16 -14.272 -7.506 9.320 1.00 0.00 C ATOM 204 O TYR A 16 -14.468 -8.395 10.149 1.00 0.00 O ATOM 205 CB TYR A 16 -13.061 -5.431 10.018 1.00 0.00 C ATOM 206 CG TYR A 16 -13.091 -3.934 10.223 1.00 0.00 C ATOM 207 CD1 TYR A 16 -13.650 -3.381 11.368 1.00 0.00 C ATOM 208 CD2 TYR A 16 -12.562 -3.071 9.270 1.00 0.00 C ATOM 209 CE1 TYR A 16 -13.680 -2.013 11.560 1.00 0.00 C ATOM 210 CE2 TYR A 16 -12.586 -1.702 9.454 1.00 0.00 C ATOM 211 CZ TYR A 16 -13.147 -1.178 10.600 1.00 0.00 C ATOM 212 OH TYR A 16 -13.175 0.185 10.786 1.00 0.00 O ATOM 0 H TYR A 16 -15.027 -6.259 11.671 1.00 0.00 H new ATOM 0 HA TYR A 16 -14.838 -5.508 8.811 1.00 0.00 H new ATOM 0 HB2 TYR A 16 -12.682 -5.906 10.923 1.00 0.00 H new ATOM 0 HB3 TYR A 16 -12.359 -5.666 9.218 1.00 0.00 H new ATOM 0 HD1 TYR A 16 -14.069 -4.032 12.121 1.00 0.00 H new ATOM 0 HD2 TYR A 16 -12.125 -3.478 8.370 1.00 0.00 H new ATOM 0 HE1 TYR A 16 -14.118 -1.600 12.456 1.00 0.00 H new ATOM 0 HE2 TYR A 16 -12.168 -1.046 8.705 1.00 0.00 H new ATOM 0 HH TYR A 16 -12.758 0.629 10.018 1.00 0.00 H new ATOM 222 N PRO A 17 -13.910 -7.774 8.056 1.00 0.00 N ATOM 223 CA PRO A 17 -13.719 -9.141 7.561 1.00 0.00 C ATOM 224 C PRO A 17 -12.486 -9.808 8.159 1.00 0.00 C ATOM 225 O PRO A 17 -11.372 -9.297 8.041 1.00 0.00 O ATOM 226 CB PRO A 17 -13.545 -8.950 6.052 1.00 0.00 C ATOM 227 CG PRO A 17 -13.031 -7.560 5.903 1.00 0.00 C ATOM 228 CD PRO A 17 -13.659 -6.765 7.014 1.00 0.00 C ATOM 0 HA PRO A 17 -14.551 -9.792 7.830 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -12.846 -9.677 5.639 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -14.490 -9.081 5.525 1.00 0.00 H new ATOM 0 HG2 PRO A 17 -11.943 -7.537 5.973 1.00 0.00 H new ATOM 0 HG3 PRO A 17 -13.297 -7.148 4.930 1.00 0.00 H new ATOM 0 HD2 PRO A 17 -12.995 -5.977 7.369 1.00 0.00 H new ATOM 0 HD3 PRO A 17 -14.582 -6.283 6.691 1.00 0.00 H new ATOM 236 N LYS A 18 -12.691 -10.952 8.802 1.00 0.00 N ATOM 237 CA LYS A 18 -11.595 -11.691 9.418 1.00 0.00 C ATOM 238 C LYS A 18 -10.775 -12.428 8.364 1.00 0.00 C ATOM 239 O LYS A 18 -11.315 -12.906 7.367 1.00 0.00 O ATOM 240 CB LYS A 18 -12.138 -12.687 10.445 1.00 0.00 C ATOM 241 CG LYS A 18 -11.163 -12.997 11.567 1.00 0.00 C ATOM 242 CD LYS A 18 -11.839 -13.747 12.703 1.00 0.00 C ATOM 243 CE LYS A 18 -12.607 -12.802 13.614 1.00 0.00 C ATOM 244 NZ LYS A 18 -14.016 -12.624 13.167 1.00 0.00 N ATOM 0 H LYS A 18 -13.607 -11.388 8.910 1.00 0.00 H new ATOM 0 HA LYS A 18 -10.946 -10.975 9.923 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -13.057 -12.289 10.874 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -12.400 -13.615 9.936 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -10.337 -13.592 11.178 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -10.736 -12.068 11.946 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -12.520 -14.493 12.294 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -11.089 -14.284 13.283 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -12.595 -13.190 14.633 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -12.108 -11.833 13.636 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -14.152 -11.651 12.827 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -14.223 -13.292 12.397 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -14.659 -12.805 13.964 1.00 0.00 H new ATOM 258 N ALA A 19 -9.469 -12.517 8.592 1.00 0.00 N ATOM 259 CA ALA A 19 -8.576 -13.198 7.664 1.00 0.00 C ATOM 260 C ALA A 19 -8.975 -14.660 7.491 1.00 0.00 C ATOM 261 O ALA A 19 -8.865 -15.458 8.421 1.00 0.00 O ATOM 262 CB ALA A 19 -7.136 -13.096 8.145 1.00 0.00 C ATOM 0 H ALA A 19 -9.006 -12.126 9.412 1.00 0.00 H new ATOM 0 HA ALA A 19 -8.659 -12.708 6.694 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -6.480 -13.609 7.442 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -6.848 -12.047 8.210 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -7.047 -13.559 9.128 1.00 0.00 H new ATOM 268 N GLY A 20 -9.440 -15.004 6.294 1.00 0.00 N ATOM 269 CA GLY A 20 -9.849 -16.370 6.022 1.00 0.00 C ATOM 270 C GLY A 20 -11.356 -16.531 6.007 1.00 0.00 C ATOM 271 O GLY A 20 -11.869 -17.598 5.670 1.00 0.00 O ATOM 0 H GLY A 20 -9.541 -14.362 5.508 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -9.444 -16.683 5.060 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -9.423 -17.031 6.777 1.00 0.00 H new ATOM 275 N GLN A 21 -12.067 -15.470 6.375 1.00 0.00 N ATOM 276 CA GLN A 21 -13.525 -15.501 6.405 1.00 0.00 C ATOM 277 C GLN A 21 -14.107 -15.015 5.082 1.00 0.00 C ATOM 278 O GLN A 21 -13.435 -14.330 4.310 1.00 0.00 O ATOM 279 CB GLN A 21 -14.050 -14.639 7.554 1.00 0.00 C ATOM 280 CG GLN A 21 -14.604 -15.447 8.717 1.00 0.00 C ATOM 281 CD GLN A 21 -14.953 -14.584 9.914 1.00 0.00 C ATOM 282 OE1 GLN A 21 -14.603 -14.906 11.049 1.00 0.00 O ATOM 283 NE2 GLN A 21 -15.646 -13.479 9.665 1.00 0.00 N ATOM 0 H GLN A 21 -11.658 -14.579 6.656 1.00 0.00 H new ATOM 0 HA GLN A 21 -13.839 -16.533 6.561 1.00 0.00 H new ATOM 0 HB2 GLN A 21 -13.244 -14.002 7.917 1.00 0.00 H new ATOM 0 HB3 GLN A 21 -14.831 -13.980 7.175 1.00 0.00 H new ATOM 0 HG2 GLN A 21 -15.494 -15.984 8.390 1.00 0.00 H new ATOM 0 HG3 GLN A 21 -13.871 -16.196 9.016 1.00 0.00 H new ATOM 0 HE21 GLN A 21 -15.915 -13.251 8.708 1.00 0.00 H new ATOM 0 HE22 GLN A 21 -15.909 -12.859 10.431 1.00 0.00 H new ATOM 292 N VAL A 22 -15.361 -15.374 4.825 1.00 0.00 N ATOM 293 CA VAL A 22 -16.034 -14.974 3.595 1.00 0.00 C ATOM 294 C VAL A 22 -16.747 -13.638 3.769 1.00 0.00 C ATOM 295 O VAL A 22 -17.633 -13.501 4.612 1.00 0.00 O ATOM 296 CB VAL A 22 -17.056 -16.034 3.144 1.00 0.00 C ATOM 297 CG1 VAL A 22 -17.615 -15.688 1.773 1.00 0.00 C ATOM 298 CG2 VAL A 22 -16.421 -17.416 3.137 1.00 0.00 C ATOM 0 H VAL A 22 -15.931 -15.941 5.452 1.00 0.00 H new ATOM 0 HA VAL A 22 -15.264 -14.875 2.830 1.00 0.00 H new ATOM 0 HB VAL A 22 -17.883 -16.042 3.855 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -18.335 -16.448 1.471 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -18.109 -14.717 1.816 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -16.802 -15.650 1.048 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -17.157 -18.153 2.816 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -15.575 -17.424 2.449 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -16.075 -17.662 4.141 1.00 0.00 H new ATOM 308 N ALA A 23 -16.355 -12.655 2.965 1.00 0.00 N ATOM 309 CA ALA A 23 -16.959 -11.330 3.028 1.00 0.00 C ATOM 310 C ALA A 23 -17.732 -11.018 1.751 1.00 0.00 C ATOM 311 O ALA A 23 -17.329 -11.412 0.657 1.00 0.00 O ATOM 312 CB ALA A 23 -15.891 -10.274 3.271 1.00 0.00 C ATOM 0 H ALA A 23 -15.622 -12.751 2.262 1.00 0.00 H new ATOM 0 HA ALA A 23 -17.663 -11.318 3.860 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -16.356 -9.289 3.316 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -15.384 -10.479 4.214 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -15.166 -10.296 2.457 1.00 0.00 H new ATOM 318 N VAL A 24 -18.846 -10.307 1.898 1.00 0.00 N ATOM 319 CA VAL A 24 -19.676 -9.942 0.756 1.00 0.00 C ATOM 320 C VAL A 24 -19.646 -8.437 0.514 1.00 0.00 C ATOM 321 O VAL A 24 -19.990 -7.648 1.394 1.00 0.00 O ATOM 322 CB VAL A 24 -21.136 -10.389 0.958 1.00 0.00 C ATOM 323 CG1 VAL A 24 -21.941 -10.176 -0.315 1.00 0.00 C ATOM 324 CG2 VAL A 24 -21.192 -11.844 1.396 1.00 0.00 C ATOM 0 H VAL A 24 -19.194 -9.973 2.797 1.00 0.00 H new ATOM 0 HA VAL A 24 -19.263 -10.455 -0.112 1.00 0.00 H new ATOM 0 HB VAL A 24 -21.578 -9.779 1.746 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -22.970 -10.498 -0.153 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -21.929 -9.119 -0.581 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -21.502 -10.759 -1.125 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -22.231 -12.143 1.534 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -20.732 -12.472 0.633 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -20.653 -11.962 2.336 1.00 0.00 H new ATOM 334 N VAL A 25 -19.232 -8.045 -0.687 1.00 0.00 N ATOM 335 CA VAL A 25 -19.158 -6.634 -1.047 1.00 0.00 C ATOM 336 C VAL A 25 -19.492 -6.424 -2.520 1.00 0.00 C ATOM 337 O VAL A 25 -19.724 -7.383 -3.257 1.00 0.00 O ATOM 338 CB VAL A 25 -17.759 -6.055 -0.762 1.00 0.00 C ATOM 339 CG1 VAL A 25 -17.206 -6.610 0.541 1.00 0.00 C ATOM 340 CG2 VAL A 25 -16.816 -6.348 -1.919 1.00 0.00 C ATOM 0 H VAL A 25 -18.943 -8.685 -1.427 1.00 0.00 H new ATOM 0 HA VAL A 25 -19.892 -6.112 -0.433 1.00 0.00 H new ATOM 0 HB VAL A 25 -17.847 -4.973 -0.659 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -16.217 -6.189 0.725 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -17.872 -6.344 1.362 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -17.131 -7.695 0.472 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -15.832 -5.932 -1.701 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -16.732 -7.426 -2.056 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -17.207 -5.896 -2.831 1.00 0.00 H new ATOM 350 N HIS A 26 -19.515 -5.164 -2.942 1.00 0.00 N ATOM 351 CA HIS A 26 -19.820 -4.828 -4.328 1.00 0.00 C ATOM 352 C HIS A 26 -18.639 -4.125 -4.990 1.00 0.00 C ATOM 353 O HIS A 26 -18.181 -3.083 -4.520 1.00 0.00 O ATOM 354 CB HIS A 26 -21.062 -3.938 -4.398 1.00 0.00 C ATOM 355 CG HIS A 26 -22.322 -4.691 -4.696 1.00 0.00 C ATOM 356 ND1 HIS A 26 -22.682 -5.081 -5.969 1.00 0.00 N ATOM 357 CD2 HIS A 26 -23.308 -5.127 -3.877 1.00 0.00 C ATOM 358 CE1 HIS A 26 -23.836 -5.723 -5.920 1.00 0.00 C ATOM 359 NE2 HIS A 26 -24.237 -5.765 -4.662 1.00 0.00 N ATOM 0 H HIS A 26 -19.326 -4.359 -2.344 1.00 0.00 H new ATOM 0 HA HIS A 26 -20.016 -5.756 -4.866 1.00 0.00 H new ATOM 0 HB2 HIS A 26 -21.177 -3.414 -3.449 1.00 0.00 H new ATOM 0 HB3 HIS A 26 -20.912 -3.179 -5.165 1.00 0.00 H new ATOM 0 HD2 HIS A 26 -23.355 -4.997 -2.806 1.00 0.00 H new ATOM 0 HE1 HIS A 26 -24.362 -6.142 -6.765 1.00 0.00 H new ATOM 0 HE2 HIS A 26 -25.097 -6.200 -4.328 1.00 0.00 H new ATOM 367 N TYR A 27 -18.149 -4.702 -6.081 1.00 0.00 N ATOM 368 CA TYR A 27 -17.019 -4.133 -6.805 1.00 0.00 C ATOM 369 C TYR A 27 -17.488 -3.401 -8.059 1.00 0.00 C ATOM 370 O TYR A 27 -18.350 -3.888 -8.792 1.00 0.00 O ATOM 371 CB TYR A 27 -16.023 -5.231 -7.184 1.00 0.00 C ATOM 372 CG TYR A 27 -16.553 -6.198 -8.218 1.00 0.00 C ATOM 373 CD1 TYR A 27 -16.447 -5.923 -9.575 1.00 0.00 C ATOM 374 CD2 TYR A 27 -17.160 -7.389 -7.837 1.00 0.00 C ATOM 375 CE1 TYR A 27 -16.930 -6.803 -10.523 1.00 0.00 C ATOM 376 CE2 TYR A 27 -17.645 -8.276 -8.778 1.00 0.00 C ATOM 377 CZ TYR A 27 -17.529 -7.979 -10.120 1.00 0.00 C ATOM 378 OH TYR A 27 -18.010 -8.860 -11.061 1.00 0.00 O ATOM 0 H TYR A 27 -18.517 -5.564 -6.484 1.00 0.00 H new ATOM 0 HA TYR A 27 -16.526 -3.415 -6.150 1.00 0.00 H new ATOM 0 HB2 TYR A 27 -15.112 -4.768 -7.564 1.00 0.00 H new ATOM 0 HB3 TYR A 27 -15.748 -5.786 -6.287 1.00 0.00 H new ATOM 0 HD1 TYR A 27 -15.978 -5.004 -9.895 1.00 0.00 H new ATOM 0 HD2 TYR A 27 -17.254 -7.625 -6.787 1.00 0.00 H new ATOM 0 HE1 TYR A 27 -16.839 -6.572 -11.574 1.00 0.00 H new ATOM 0 HE2 TYR A 27 -18.113 -9.198 -8.465 1.00 0.00 H new ATOM 0 HH TYR A 27 -18.400 -9.638 -10.611 1.00 0.00 H new ATOM 388 N THR A 28 -16.913 -2.227 -8.301 1.00 0.00 N ATOM 389 CA THR A 28 -17.270 -1.427 -9.466 1.00 0.00 C ATOM 390 C THR A 28 -16.028 -0.967 -10.219 1.00 0.00 C ATOM 391 O THR A 28 -15.118 -0.379 -9.636 1.00 0.00 O ATOM 392 CB THR A 28 -18.100 -0.192 -9.065 1.00 0.00 C ATOM 393 OG1 THR A 28 -19.340 -0.605 -8.478 1.00 0.00 O ATOM 394 CG2 THR A 28 -18.375 0.690 -10.273 1.00 0.00 C ATOM 0 H THR A 28 -16.198 -1.809 -7.706 1.00 0.00 H new ATOM 0 HA THR A 28 -17.870 -2.064 -10.116 1.00 0.00 H new ATOM 0 HB THR A 28 -17.527 0.383 -8.337 1.00 0.00 H new ATOM 0 HG1 THR A 28 -19.861 0.185 -8.224 1.00 0.00 H new ATOM 0 HG21 THR A 28 -18.962 1.555 -9.966 1.00 0.00 H new ATOM 0 HG22 THR A 28 -17.430 1.026 -10.701 1.00 0.00 H new ATOM 0 HG23 THR A 28 -18.930 0.122 -11.020 1.00 0.00 H new ATOM 402 N GLY A 29 -15.996 -1.238 -11.521 1.00 0.00 N ATOM 403 CA GLY A 29 -14.860 -0.843 -12.333 1.00 0.00 C ATOM 404 C GLY A 29 -14.699 0.662 -12.413 1.00 0.00 C ATOM 405 O GLY A 29 -15.684 1.397 -12.485 1.00 0.00 O ATOM 0 H GLY A 29 -16.736 -1.724 -12.027 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -13.952 -1.281 -11.919 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -14.978 -1.246 -13.339 1.00 0.00 H new ATOM 409 N THR A 30 -13.452 1.123 -12.398 1.00 0.00 N ATOM 410 CA THR A 30 -13.165 2.550 -12.466 1.00 0.00 C ATOM 411 C THR A 30 -11.684 2.801 -12.727 1.00 0.00 C ATOM 412 O THR A 30 -10.822 2.102 -12.193 1.00 0.00 O ATOM 413 CB THR A 30 -13.574 3.269 -11.167 1.00 0.00 C ATOM 414 OG1 THR A 30 -14.151 2.332 -10.250 1.00 0.00 O ATOM 415 CG2 THR A 30 -14.569 4.383 -11.455 1.00 0.00 C ATOM 0 H THR A 30 -12.625 0.529 -12.339 1.00 0.00 H new ATOM 0 HA THR A 30 -13.751 2.950 -13.294 1.00 0.00 H new ATOM 0 HB THR A 30 -12.680 3.708 -10.724 1.00 0.00 H new ATOM 0 HG1 THR A 30 -13.438 1.832 -9.802 1.00 0.00 H new ATOM 0 HG21 THR A 30 -14.843 4.876 -10.522 1.00 0.00 H new ATOM 0 HG22 THR A 30 -14.117 5.109 -12.130 1.00 0.00 H new ATOM 0 HG23 THR A 30 -15.461 3.963 -11.919 1.00 0.00 H new ATOM 423 N LEU A 31 -11.394 3.803 -13.550 1.00 0.00 N ATOM 424 CA LEU A 31 -10.016 4.146 -13.882 1.00 0.00 C ATOM 425 C LEU A 31 -9.530 5.322 -13.039 1.00 0.00 C ATOM 426 O LEU A 31 -10.330 6.049 -12.452 1.00 0.00 O ATOM 427 CB LEU A 31 -9.898 4.487 -15.368 1.00 0.00 C ATOM 428 CG LEU A 31 -9.847 3.297 -16.327 1.00 0.00 C ATOM 429 CD1 LEU A 31 -9.754 3.775 -17.768 1.00 0.00 C ATOM 430 CD2 LEU A 31 -8.675 2.387 -15.988 1.00 0.00 C ATOM 0 H LEU A 31 -12.095 4.392 -14.000 1.00 0.00 H new ATOM 0 HA LEU A 31 -9.390 3.281 -13.663 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -10.745 5.115 -15.645 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -8.998 5.084 -15.513 1.00 0.00 H new ATOM 0 HG LEU A 31 -10.768 2.726 -16.214 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -9.719 2.914 -18.435 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -10.626 4.383 -18.007 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -8.850 4.371 -17.896 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -8.655 1.546 -16.681 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -7.744 2.947 -16.070 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -8.786 2.015 -14.969 1.00 0.00 H new ATOM 442 N ALA A 32 -8.214 5.502 -12.987 1.00 0.00 N ATOM 443 CA ALA A 32 -7.622 6.591 -12.221 1.00 0.00 C ATOM 444 C ALA A 32 -8.091 7.946 -12.740 1.00 0.00 C ATOM 445 O ALA A 32 -8.000 8.955 -12.041 1.00 0.00 O ATOM 446 CB ALA A 32 -6.104 6.503 -12.265 1.00 0.00 C ATOM 0 H ALA A 32 -7.538 4.907 -13.466 1.00 0.00 H new ATOM 0 HA ALA A 32 -7.950 6.495 -11.186 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -5.675 7.323 -11.689 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -5.782 5.553 -11.839 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -5.765 6.570 -13.299 1.00 0.00 H new ATOM 452 N ASP A 33 -8.592 7.962 -13.971 1.00 0.00 N ATOM 453 CA ASP A 33 -9.075 9.194 -14.584 1.00 0.00 C ATOM 454 C ASP A 33 -10.516 9.477 -14.172 1.00 0.00 C ATOM 455 O ASP A 33 -11.013 10.590 -14.338 1.00 0.00 O ATOM 456 CB ASP A 33 -8.976 9.103 -16.108 1.00 0.00 C ATOM 457 CG ASP A 33 -7.557 8.856 -16.582 1.00 0.00 C ATOM 458 OD1 ASP A 33 -6.615 9.291 -15.886 1.00 0.00 O ATOM 459 OD2 ASP A 33 -7.389 8.228 -17.648 1.00 0.00 O ATOM 0 H ASP A 33 -8.674 7.136 -14.564 1.00 0.00 H new ATOM 0 HA ASP A 33 -8.448 10.015 -14.235 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -9.620 8.299 -16.464 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -9.348 10.028 -16.549 1.00 0.00 H new ATOM 464 N GLY A 34 -11.183 8.460 -13.633 1.00 0.00 N ATOM 465 CA GLY A 34 -12.561 8.620 -13.207 1.00 0.00 C ATOM 466 C GLY A 34 -13.531 7.850 -14.081 1.00 0.00 C ATOM 467 O GLY A 34 -14.676 7.614 -13.693 1.00 0.00 O ATOM 0 H GLY A 34 -10.794 7.529 -13.484 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -12.660 8.283 -12.175 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -12.823 9.678 -13.224 1.00 0.00 H new ATOM 471 N LYS A 35 -13.076 7.460 -15.266 1.00 0.00 N ATOM 472 CA LYS A 35 -13.911 6.713 -16.199 1.00 0.00 C ATOM 473 C LYS A 35 -14.531 5.496 -15.521 1.00 0.00 C ATOM 474 O LYS A 35 -13.831 4.692 -14.905 1.00 0.00 O ATOM 475 CB LYS A 35 -13.087 6.270 -17.411 1.00 0.00 C ATOM 476 CG LYS A 35 -13.341 7.102 -18.656 1.00 0.00 C ATOM 477 CD LYS A 35 -14.744 6.882 -19.197 1.00 0.00 C ATOM 478 CE LYS A 35 -14.747 5.899 -20.357 1.00 0.00 C ATOM 479 NZ LYS A 35 -16.091 5.789 -20.988 1.00 0.00 N ATOM 0 H LYS A 35 -12.132 7.649 -15.604 1.00 0.00 H new ATOM 0 HA LYS A 35 -14.715 7.369 -16.533 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -12.028 6.323 -17.159 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -13.311 5.226 -17.630 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -13.201 8.158 -18.424 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -12.610 6.844 -19.422 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -15.388 6.508 -18.401 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -15.162 7.834 -19.524 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -14.020 6.217 -21.104 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -14.431 4.918 -20.002 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -16.051 5.109 -21.774 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -16.780 5.461 -20.282 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -16.382 6.720 -21.349 1.00 0.00 H new ATOM 493 N VAL A 36 -15.849 5.366 -15.638 1.00 0.00 N ATOM 494 CA VAL A 36 -16.563 4.245 -15.038 1.00 0.00 C ATOM 495 C VAL A 36 -16.468 3.001 -15.913 1.00 0.00 C ATOM 496 O VAL A 36 -16.447 3.093 -17.141 1.00 0.00 O ATOM 497 CB VAL A 36 -18.047 4.585 -14.806 1.00 0.00 C ATOM 498 CG1 VAL A 36 -18.794 4.644 -16.129 1.00 0.00 C ATOM 499 CG2 VAL A 36 -18.685 3.571 -13.869 1.00 0.00 C ATOM 0 H VAL A 36 -16.444 6.023 -16.143 1.00 0.00 H new ATOM 0 HA VAL A 36 -16.089 4.046 -14.077 1.00 0.00 H new ATOM 0 HB VAL A 36 -18.108 5.567 -14.338 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -19.841 4.885 -15.945 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -18.351 5.412 -16.763 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -18.727 3.677 -16.628 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -19.734 3.826 -13.716 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -18.614 2.576 -14.307 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -18.165 3.583 -12.911 1.00 0.00 H new ATOM 509 N PHE A 37 -16.412 1.837 -15.274 1.00 0.00 N ATOM 510 CA PHE A 37 -16.320 0.573 -15.995 1.00 0.00 C ATOM 511 C PHE A 37 -17.384 -0.408 -15.512 1.00 0.00 C ATOM 512 O PHE A 37 -18.243 -0.059 -14.702 1.00 0.00 O ATOM 513 CB PHE A 37 -14.928 -0.039 -15.817 1.00 0.00 C ATOM 514 CG PHE A 37 -13.953 0.370 -16.884 1.00 0.00 C ATOM 515 CD1 PHE A 37 -13.493 1.675 -16.957 1.00 0.00 C ATOM 516 CD2 PHE A 37 -13.497 -0.550 -17.814 1.00 0.00 C ATOM 517 CE1 PHE A 37 -12.595 2.054 -17.937 1.00 0.00 C ATOM 518 CE2 PHE A 37 -12.599 -0.177 -18.796 1.00 0.00 C ATOM 519 CZ PHE A 37 -12.148 1.128 -18.858 1.00 0.00 C ATOM 0 H PHE A 37 -16.429 1.743 -14.258 1.00 0.00 H new ATOM 0 HA PHE A 37 -16.490 0.774 -17.053 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -14.533 0.253 -14.844 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -15.015 -1.125 -15.813 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -13.840 2.404 -16.240 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -13.847 -1.571 -17.771 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -12.243 3.074 -17.982 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -12.250 -0.904 -19.514 1.00 0.00 H new ATOM 0 HZ PHE A 37 -11.447 1.423 -19.625 1.00 0.00 H new ATOM 529 N ASP A 38 -17.321 -1.635 -16.016 1.00 0.00 N ATOM 530 CA ASP A 38 -18.279 -2.668 -15.636 1.00 0.00 C ATOM 531 C ASP A 38 -18.321 -2.839 -14.121 1.00 0.00 C ATOM 532 O ASP A 38 -17.286 -3.005 -13.476 1.00 0.00 O ATOM 533 CB ASP A 38 -17.919 -3.996 -16.303 1.00 0.00 C ATOM 534 CG ASP A 38 -19.132 -4.879 -16.526 1.00 0.00 C ATOM 535 OD1 ASP A 38 -20.153 -4.368 -17.032 1.00 0.00 O ATOM 536 OD2 ASP A 38 -19.059 -6.081 -16.195 1.00 0.00 O ATOM 0 H ASP A 38 -16.617 -1.939 -16.689 1.00 0.00 H new ATOM 0 HA ASP A 38 -19.267 -2.356 -15.975 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -17.435 -3.799 -17.260 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -17.196 -4.526 -15.683 1.00 0.00 H new ATOM 541 N SER A 39 -19.525 -2.797 -13.559 1.00 0.00 N ATOM 542 CA SER A 39 -19.702 -2.942 -12.119 1.00 0.00 C ATOM 543 C SER A 39 -20.649 -4.096 -11.802 1.00 0.00 C ATOM 544 O SER A 39 -21.634 -4.317 -12.507 1.00 0.00 O ATOM 545 CB SER A 39 -20.242 -1.644 -11.517 1.00 0.00 C ATOM 546 OG SER A 39 -19.965 -0.537 -12.357 1.00 0.00 O ATOM 0 H SER A 39 -20.392 -2.664 -14.079 1.00 0.00 H new ATOM 0 HA SER A 39 -18.729 -3.161 -11.678 1.00 0.00 H new ATOM 0 HB2 SER A 39 -21.318 -1.730 -11.366 1.00 0.00 H new ATOM 0 HB3 SER A 39 -19.795 -1.481 -10.536 1.00 0.00 H new ATOM 0 HG SER A 39 -20.549 0.212 -12.115 1.00 0.00 H new ATOM 552 N SER A 40 -20.342 -4.829 -10.737 1.00 0.00 N ATOM 553 CA SER A 40 -21.162 -5.963 -10.327 1.00 0.00 C ATOM 554 C SER A 40 -22.534 -5.496 -9.848 1.00 0.00 C ATOM 555 O SER A 40 -23.514 -6.238 -9.919 1.00 0.00 O ATOM 556 CB SER A 40 -20.463 -6.751 -9.217 1.00 0.00 C ATOM 557 OG SER A 40 -21.367 -7.074 -8.175 1.00 0.00 O ATOM 0 H SER A 40 -19.531 -4.658 -10.142 1.00 0.00 H new ATOM 0 HA SER A 40 -21.299 -6.612 -11.192 1.00 0.00 H new ATOM 0 HB2 SER A 40 -20.036 -7.665 -9.629 1.00 0.00 H new ATOM 0 HB3 SER A 40 -19.636 -6.165 -8.816 1.00 0.00 H new ATOM 0 HG SER A 40 -21.488 -6.294 -7.594 1.00 0.00 H new ATOM 668 N PHE A 47 -20.715 -9.533 -4.821 1.00 0.00 N ATOM 669 CA PHE A 47 -19.645 -10.516 -4.947 1.00 0.00 C ATOM 670 C PHE A 47 -19.063 -10.863 -3.580 1.00 0.00 C ATOM 671 O PHE A 47 -18.613 -9.985 -2.844 1.00 0.00 O ATOM 672 CB PHE A 47 -18.542 -9.985 -5.864 1.00 0.00 C ATOM 673 CG PHE A 47 -17.719 -11.069 -6.501 1.00 0.00 C ATOM 674 CD1 PHE A 47 -18.134 -11.672 -7.677 1.00 0.00 C ATOM 675 CD2 PHE A 47 -16.530 -11.484 -5.922 1.00 0.00 C ATOM 676 CE1 PHE A 47 -17.379 -12.669 -8.265 1.00 0.00 C ATOM 677 CE2 PHE A 47 -15.771 -12.480 -6.506 1.00 0.00 C ATOM 678 CZ PHE A 47 -16.196 -13.074 -7.678 1.00 0.00 C ATOM 0 HA PHE A 47 -20.066 -11.422 -5.384 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -18.993 -9.375 -6.647 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -17.886 -9.332 -5.289 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -19.058 -11.359 -8.140 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -16.193 -11.024 -5.005 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -17.713 -13.131 -9.182 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -14.846 -12.794 -6.046 1.00 0.00 H new ATOM 0 HZ PHE A 47 -15.605 -13.854 -8.135 1.00 0.00 H new ATOM 688 N ARG A 48 -19.075 -12.150 -3.248 1.00 0.00 N ATOM 689 CA ARG A 48 -18.550 -12.615 -1.970 1.00 0.00 C ATOM 690 C ARG A 48 -17.359 -13.546 -2.177 1.00 0.00 C ATOM 691 O ARG A 48 -17.305 -14.294 -3.154 1.00 0.00 O ATOM 692 CB ARG A 48 -19.642 -13.335 -1.177 1.00 0.00 C ATOM 693 CG ARG A 48 -20.171 -14.583 -1.864 1.00 0.00 C ATOM 694 CD ARG A 48 -20.487 -15.680 -0.860 1.00 0.00 C ATOM 695 NE ARG A 48 -20.775 -16.954 -1.514 1.00 0.00 N ATOM 696 CZ ARG A 48 -19.842 -17.728 -2.059 1.00 0.00 C ATOM 697 NH1 ARG A 48 -18.569 -17.359 -2.028 1.00 0.00 N ATOM 698 NH2 ARG A 48 -20.183 -18.873 -2.636 1.00 0.00 N ATOM 0 H ARG A 48 -19.443 -12.889 -3.847 1.00 0.00 H new ATOM 0 HA ARG A 48 -18.215 -11.745 -1.406 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -19.248 -13.609 -0.198 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -20.469 -12.646 -1.006 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -21.070 -14.335 -2.429 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -19.434 -14.945 -2.581 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -19.644 -15.804 -0.181 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -21.343 -15.382 -0.254 1.00 0.00 H new ATOM 0 HE ARG A 48 -21.745 -17.267 -1.555 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -18.304 -16.479 -1.585 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -17.855 -17.955 -2.447 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -21.162 -19.160 -2.662 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -19.467 -19.467 -3.054 1.00 0.00 H new ATOM 712 N PHE A 49 -16.406 -13.494 -1.253 1.00 0.00 N ATOM 713 CA PHE A 49 -15.215 -14.331 -1.335 1.00 0.00 C ATOM 714 C PHE A 49 -14.487 -14.375 0.005 1.00 0.00 C ATOM 715 O PHE A 49 -14.781 -13.594 0.911 1.00 0.00 O ATOM 716 CB PHE A 49 -14.273 -13.810 -2.423 1.00 0.00 C ATOM 717 CG PHE A 49 -13.726 -12.441 -2.136 1.00 0.00 C ATOM 718 CD1 PHE A 49 -12.580 -12.285 -1.373 1.00 0.00 C ATOM 719 CD2 PHE A 49 -14.356 -11.311 -2.631 1.00 0.00 C ATOM 720 CE1 PHE A 49 -12.075 -11.026 -1.107 1.00 0.00 C ATOM 721 CE2 PHE A 49 -13.855 -10.050 -2.369 1.00 0.00 C ATOM 722 CZ PHE A 49 -12.712 -9.907 -1.606 1.00 0.00 C ATOM 0 H PHE A 49 -16.435 -12.881 -0.438 1.00 0.00 H new ATOM 0 HA PHE A 49 -15.530 -15.343 -1.591 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -13.443 -14.507 -2.539 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -14.806 -13.788 -3.374 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -12.076 -13.156 -0.982 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -15.249 -11.417 -3.229 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -11.182 -10.918 -0.509 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -14.356 -9.177 -2.760 1.00 0.00 H new ATOM 0 HZ PHE A 49 -12.318 -8.923 -1.400 1.00 0.00 H new ATOM 732 N THR A 50 -13.535 -15.295 0.126 1.00 0.00 N ATOM 733 CA THR A 50 -12.766 -15.443 1.355 1.00 0.00 C ATOM 734 C THR A 50 -11.574 -14.493 1.375 1.00 0.00 C ATOM 735 O THR A 50 -10.610 -14.674 0.631 1.00 0.00 O ATOM 736 CB THR A 50 -12.260 -16.887 1.530 1.00 0.00 C ATOM 737 OG1 THR A 50 -13.366 -17.796 1.538 1.00 0.00 O ATOM 738 CG2 THR A 50 -11.470 -17.031 2.823 1.00 0.00 C ATOM 0 H THR A 50 -13.278 -15.949 -0.613 1.00 0.00 H new ATOM 0 HA THR A 50 -13.436 -15.198 2.179 1.00 0.00 H new ATOM 0 HB THR A 50 -11.603 -17.122 0.693 1.00 0.00 H new ATOM 0 HG1 THR A 50 -13.036 -18.712 1.648 1.00 0.00 H new ATOM 0 HG21 THR A 50 -11.123 -18.059 2.925 1.00 0.00 H new ATOM 0 HG22 THR A 50 -10.612 -16.359 2.802 1.00 0.00 H new ATOM 0 HG23 THR A 50 -12.108 -16.778 3.670 1.00 0.00 H new ATOM 746 N VAL A 51 -11.645 -13.480 2.232 1.00 0.00 N ATOM 747 CA VAL A 51 -10.571 -12.501 2.351 1.00 0.00 C ATOM 748 C VAL A 51 -9.283 -13.156 2.839 1.00 0.00 C ATOM 749 O VAL A 51 -9.150 -13.487 4.016 1.00 0.00 O ATOM 750 CB VAL A 51 -10.952 -11.363 3.315 1.00 0.00 C ATOM 751 CG1 VAL A 51 -9.907 -10.258 3.278 1.00 0.00 C ATOM 752 CG2 VAL A 51 -12.330 -10.815 2.974 1.00 0.00 C ATOM 0 H VAL A 51 -12.436 -13.316 2.855 1.00 0.00 H new ATOM 0 HA VAL A 51 -10.410 -12.085 1.356 1.00 0.00 H new ATOM 0 HB VAL A 51 -10.985 -11.765 4.328 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -10.194 -9.463 3.966 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -8.939 -10.662 3.574 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -9.838 -9.856 2.267 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -12.583 -10.011 3.665 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -12.326 -10.429 1.955 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -13.069 -11.612 3.057 1.00 0.00 H new ATOM 762 N GLY A 52 -8.335 -13.340 1.925 1.00 0.00 N ATOM 763 CA GLY A 52 -7.070 -13.954 2.281 1.00 0.00 C ATOM 764 C GLY A 52 -6.803 -15.226 1.501 1.00 0.00 C ATOM 765 O GLY A 52 -5.674 -15.718 1.470 1.00 0.00 O ATOM 0 H GLY A 52 -8.421 -13.074 0.944 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -6.262 -13.245 2.101 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -7.066 -14.178 3.348 1.00 0.00 H new ATOM 769 N ARG A 53 -7.844 -15.762 0.872 1.00 0.00 N ATOM 770 CA ARG A 53 -7.716 -16.987 0.091 1.00 0.00 C ATOM 771 C ARG A 53 -7.022 -16.713 -1.240 1.00 0.00 C ATOM 772 O ARG A 53 -6.661 -15.576 -1.541 1.00 0.00 O ATOM 773 CB ARG A 53 -9.094 -17.604 -0.158 1.00 0.00 C ATOM 774 CG ARG A 53 -9.497 -18.635 0.883 1.00 0.00 C ATOM 775 CD ARG A 53 -8.739 -19.940 0.697 1.00 0.00 C ATOM 776 NE ARG A 53 -9.460 -21.077 1.262 1.00 0.00 N ATOM 777 CZ ARG A 53 -9.020 -22.329 1.203 1.00 0.00 C ATOM 778 NH1 ARG A 53 -7.868 -22.603 0.608 1.00 0.00 N ATOM 779 NH2 ARG A 53 -9.734 -23.310 1.742 1.00 0.00 N ATOM 0 H ARG A 53 -8.785 -15.368 0.888 1.00 0.00 H new ATOM 0 HA ARG A 53 -7.108 -17.690 0.661 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -9.840 -16.810 -0.178 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -9.101 -18.072 -1.142 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -9.305 -18.240 1.881 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -10.569 -18.823 0.815 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -8.568 -20.111 -0.366 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -7.760 -19.861 1.169 1.00 0.00 H new ATOM 0 HE ARG A 53 -10.350 -20.900 1.727 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -7.317 -21.852 0.194 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -7.533 -23.565 0.564 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -10.621 -23.102 2.202 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -9.396 -24.271 1.697 1.00 0.00 H new ATOM 793 N GLY A 54 -6.837 -17.765 -2.032 1.00 0.00 N ATOM 794 CA GLY A 54 -6.186 -17.617 -3.321 1.00 0.00 C ATOM 795 C GLY A 54 -7.174 -17.592 -4.470 1.00 0.00 C ATOM 796 O GLY A 54 -6.838 -17.968 -5.593 1.00 0.00 O ATOM 0 H GLY A 54 -7.126 -18.716 -1.804 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -5.603 -16.696 -3.327 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -5.485 -18.439 -3.467 1.00 0.00 H new ATOM 800 N GLU A 55 -8.395 -17.149 -4.189 1.00 0.00 N ATOM 801 CA GLU A 55 -9.435 -17.079 -5.209 1.00 0.00 C ATOM 802 C GLU A 55 -9.565 -15.661 -5.757 1.00 0.00 C ATOM 803 O GLU A 55 -10.054 -15.455 -6.868 1.00 0.00 O ATOM 804 CB GLU A 55 -10.776 -17.539 -4.633 1.00 0.00 C ATOM 805 CG GLU A 55 -10.700 -18.868 -3.899 1.00 0.00 C ATOM 806 CD GLU A 55 -11.978 -19.195 -3.151 1.00 0.00 C ATOM 807 OE1 GLU A 55 -12.638 -18.255 -2.663 1.00 0.00 O ATOM 808 OE2 GLU A 55 -12.317 -20.393 -3.055 1.00 0.00 O ATOM 0 H GLU A 55 -8.688 -16.833 -3.264 1.00 0.00 H new ATOM 0 HA GLU A 55 -9.152 -17.742 -6.027 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -11.149 -16.777 -3.949 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -11.501 -17.622 -5.443 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -10.489 -19.663 -4.615 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -9.868 -18.843 -3.195 1.00 0.00 H new ATOM 815 N VAL A 56 -9.123 -14.685 -4.969 1.00 0.00 N ATOM 816 CA VAL A 56 -9.189 -13.286 -5.375 1.00 0.00 C ATOM 817 C VAL A 56 -7.795 -12.719 -5.620 1.00 0.00 C ATOM 818 O VAL A 56 -6.796 -13.430 -5.506 1.00 0.00 O ATOM 819 CB VAL A 56 -9.902 -12.427 -4.314 1.00 0.00 C ATOM 820 CG1 VAL A 56 -11.395 -12.715 -4.308 1.00 0.00 C ATOM 821 CG2 VAL A 56 -9.298 -12.670 -2.939 1.00 0.00 C ATOM 0 H VAL A 56 -8.716 -14.838 -4.046 1.00 0.00 H new ATOM 0 HA VAL A 56 -9.760 -13.252 -6.303 1.00 0.00 H new ATOM 0 HB VAL A 56 -9.761 -11.376 -4.568 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -11.881 -12.099 -3.552 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -11.814 -12.485 -5.288 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -11.562 -13.768 -4.080 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -9.814 -12.055 -2.201 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -9.407 -13.722 -2.675 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -8.240 -12.407 -2.955 1.00 0.00 H new ATOM 831 N ILE A 57 -7.736 -11.435 -5.956 1.00 0.00 N ATOM 832 CA ILE A 57 -6.464 -10.772 -6.216 1.00 0.00 C ATOM 833 C ILE A 57 -5.954 -10.054 -4.971 1.00 0.00 C ATOM 834 O ILE A 57 -6.725 -9.739 -4.064 1.00 0.00 O ATOM 835 CB ILE A 57 -6.583 -9.757 -7.368 1.00 0.00 C ATOM 836 CG1 ILE A 57 -7.726 -8.776 -7.096 1.00 0.00 C ATOM 837 CG2 ILE A 57 -6.800 -10.478 -8.689 1.00 0.00 C ATOM 838 CD1 ILE A 57 -7.477 -7.390 -7.648 1.00 0.00 C ATOM 0 H ILE A 57 -8.554 -10.833 -6.055 1.00 0.00 H new ATOM 0 HA ILE A 57 -5.755 -11.550 -6.500 1.00 0.00 H new ATOM 0 HB ILE A 57 -5.653 -9.193 -7.433 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -8.644 -9.171 -7.530 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -7.886 -8.706 -6.020 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -6.882 -9.747 -9.493 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -5.957 -11.140 -8.885 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -7.717 -11.065 -8.637 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -8.328 -6.749 -7.418 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -6.577 -6.974 -7.195 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -7.347 -7.447 -8.729 1.00 0.00 H new ATOM 850 N ARG A 58 -4.651 -9.797 -4.935 1.00 0.00 N ATOM 851 CA ARG A 58 -4.037 -9.115 -3.802 1.00 0.00 C ATOM 852 C ARG A 58 -4.784 -7.826 -3.474 1.00 0.00 C ATOM 853 O ARG A 58 -5.090 -7.550 -2.315 1.00 0.00 O ATOM 854 CB ARG A 58 -2.569 -8.806 -4.099 1.00 0.00 C ATOM 855 CG ARG A 58 -1.737 -10.040 -4.410 1.00 0.00 C ATOM 856 CD ARG A 58 -1.130 -10.634 -3.149 1.00 0.00 C ATOM 857 NE ARG A 58 -0.585 -11.969 -3.381 1.00 0.00 N ATOM 858 CZ ARG A 58 -1.337 -13.051 -3.552 1.00 0.00 C ATOM 859 NH1 ARG A 58 -2.659 -12.955 -3.518 1.00 0.00 N ATOM 860 NH2 ARG A 58 -0.766 -14.231 -3.759 1.00 0.00 N ATOM 0 H ARG A 58 -4.000 -10.051 -5.678 1.00 0.00 H new ATOM 0 HA ARG A 58 -4.093 -9.777 -2.938 1.00 0.00 H new ATOM 0 HB2 ARG A 58 -2.515 -8.119 -4.944 1.00 0.00 H new ATOM 0 HB3 ARG A 58 -2.134 -8.292 -3.242 1.00 0.00 H new ATOM 0 HG2 ARG A 58 -2.361 -10.787 -4.901 1.00 0.00 H new ATOM 0 HG3 ARG A 58 -0.943 -9.778 -5.109 1.00 0.00 H new ATOM 0 HD2 ARG A 58 -0.340 -9.978 -2.783 1.00 0.00 H new ATOM 0 HD3 ARG A 58 -1.890 -10.683 -2.369 1.00 0.00 H new ATOM 0 HE ARG A 58 0.429 -12.077 -3.414 1.00 0.00 H new ATOM 0 HH11 ARG A 58 -3.101 -12.049 -3.360 1.00 0.00 H new ATOM 0 HH12 ARG A 58 -3.234 -13.787 -3.650 1.00 0.00 H new ATOM 0 HH21 ARG A 58 0.251 -14.308 -3.787 1.00 0.00 H new ATOM 0 HH22 ARG A 58 -1.344 -15.061 -3.890 1.00 0.00 H new ATOM 874 N GLY A 59 -5.073 -7.037 -4.505 1.00 0.00 N ATOM 875 CA GLY A 59 -5.781 -5.786 -4.307 1.00 0.00 C ATOM 876 C GLY A 59 -7.023 -5.951 -3.454 1.00 0.00 C ATOM 877 O GLY A 59 -7.119 -5.377 -2.369 1.00 0.00 O ATOM 0 H GLY A 59 -4.829 -7.242 -5.474 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -5.113 -5.065 -3.835 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -6.062 -5.374 -5.276 1.00 0.00 H new ATOM 881 N TRP A 60 -7.975 -6.735 -3.945 1.00 0.00 N ATOM 882 CA TRP A 60 -9.219 -6.973 -3.220 1.00 0.00 C ATOM 883 C TRP A 60 -8.938 -7.476 -1.808 1.00 0.00 C ATOM 884 O TRP A 60 -9.574 -7.043 -0.847 1.00 0.00 O ATOM 885 CB TRP A 60 -10.087 -7.983 -3.972 1.00 0.00 C ATOM 886 CG TRP A 60 -10.938 -7.359 -5.035 1.00 0.00 C ATOM 887 CD1 TRP A 60 -10.855 -6.079 -5.506 1.00 0.00 C ATOM 888 CD2 TRP A 60 -12.003 -7.986 -5.759 1.00 0.00 C ATOM 889 NE1 TRP A 60 -11.804 -5.873 -6.478 1.00 0.00 N ATOM 890 CE2 TRP A 60 -12.520 -7.028 -6.653 1.00 0.00 C ATOM 891 CE3 TRP A 60 -12.567 -9.264 -5.741 1.00 0.00 C ATOM 892 CZ2 TRP A 60 -13.575 -7.310 -7.517 1.00 0.00 C ATOM 893 CZ3 TRP A 60 -13.614 -9.542 -6.599 1.00 0.00 C ATOM 894 CH2 TRP A 60 -14.109 -8.569 -7.477 1.00 0.00 C ATOM 0 H TRP A 60 -7.910 -7.217 -4.842 1.00 0.00 H new ATOM 0 HA TRP A 60 -9.756 -6.027 -3.148 1.00 0.00 H new ATOM 0 HB2 TRP A 60 -9.444 -8.736 -4.427 1.00 0.00 H new ATOM 0 HB3 TRP A 60 -10.729 -8.501 -3.260 1.00 0.00 H new ATOM 0 HD1 TRP A 60 -10.147 -5.338 -5.164 1.00 0.00 H new ATOM 0 HE1 TRP A 60 -11.952 -5.001 -6.987 1.00 0.00 H new ATOM 0 HE3 TRP A 60 -12.191 -10.021 -5.069 1.00 0.00 H new ATOM 0 HZ2 TRP A 60 -13.958 -6.561 -8.195 1.00 0.00 H new ATOM 0 HZ3 TRP A 60 -14.058 -10.526 -6.593 1.00 0.00 H new ATOM 0 HH2 TRP A 60 -14.928 -8.818 -8.135 1.00 0.00 H new ATOM 905 N ASP A 61 -7.984 -8.392 -1.690 1.00 0.00 N ATOM 906 CA ASP A 61 -7.619 -8.954 -0.395 1.00 0.00 C ATOM 907 C ASP A 61 -7.375 -7.848 0.627 1.00 0.00 C ATOM 908 O ASP A 61 -8.090 -7.743 1.623 1.00 0.00 O ATOM 909 CB ASP A 61 -6.370 -9.827 -0.527 1.00 0.00 C ATOM 910 CG ASP A 61 -6.347 -10.960 0.480 1.00 0.00 C ATOM 911 OD1 ASP A 61 -6.629 -10.703 1.668 1.00 0.00 O ATOM 912 OD2 ASP A 61 -6.045 -12.104 0.079 1.00 0.00 O ATOM 0 H ASP A 61 -7.449 -8.762 -2.476 1.00 0.00 H new ATOM 0 HA ASP A 61 -8.448 -9.570 -0.047 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -6.323 -10.239 -1.535 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -5.482 -9.209 -0.394 1.00 0.00 H new ATOM 917 N GLU A 62 -6.360 -7.027 0.374 1.00 0.00 N ATOM 918 CA GLU A 62 -6.022 -5.931 1.273 1.00 0.00 C ATOM 919 C GLU A 62 -7.154 -4.909 1.336 1.00 0.00 C ATOM 920 O GLU A 62 -7.551 -4.472 2.415 1.00 0.00 O ATOM 921 CB GLU A 62 -4.729 -5.249 0.819 1.00 0.00 C ATOM 922 CG GLU A 62 -3.474 -6.029 1.172 1.00 0.00 C ATOM 923 CD GLU A 62 -2.216 -5.190 1.061 1.00 0.00 C ATOM 924 OE1 GLU A 62 -1.677 -5.074 -0.060 1.00 0.00 O ATOM 925 OE2 GLU A 62 -1.769 -4.650 2.095 1.00 0.00 O ATOM 0 H GLU A 62 -5.758 -7.101 -0.446 1.00 0.00 H new ATOM 0 HA GLU A 62 -5.875 -6.346 2.270 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -4.765 -5.103 -0.261 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -4.671 -4.259 1.272 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -3.562 -6.412 2.189 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -3.390 -6.893 0.512 1.00 0.00 H new ATOM 932 N GLY A 63 -7.668 -4.532 0.169 1.00 0.00 N ATOM 933 CA GLY A 63 -8.748 -3.565 0.113 1.00 0.00 C ATOM 934 C GLY A 63 -9.898 -3.925 1.033 1.00 0.00 C ATOM 935 O GLY A 63 -10.200 -3.194 1.977 1.00 0.00 O ATOM 0 H GLY A 63 -7.356 -4.879 -0.738 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -8.365 -2.581 0.384 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -9.115 -3.494 -0.911 1.00 0.00 H new ATOM 939 N VAL A 64 -10.543 -5.054 0.758 1.00 0.00 N ATOM 940 CA VAL A 64 -11.667 -5.510 1.568 1.00 0.00 C ATOM 941 C VAL A 64 -11.239 -5.762 3.009 1.00 0.00 C ATOM 942 O VAL A 64 -12.015 -5.559 3.942 1.00 0.00 O ATOM 943 CB VAL A 64 -12.286 -6.798 0.994 1.00 0.00 C ATOM 944 CG1 VAL A 64 -11.353 -7.980 1.208 1.00 0.00 C ATOM 945 CG2 VAL A 64 -13.645 -7.061 1.624 1.00 0.00 C ATOM 0 H VAL A 64 -10.307 -5.670 -0.020 1.00 0.00 H new ATOM 0 HA VAL A 64 -12.414 -4.717 1.548 1.00 0.00 H new ATOM 0 HB VAL A 64 -12.427 -6.667 -0.079 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -11.807 -8.881 0.796 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -10.404 -7.790 0.706 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -11.178 -8.117 2.275 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -14.069 -7.975 1.207 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -13.531 -7.173 2.702 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -14.311 -6.224 1.415 1.00 0.00 H new ATOM 955 N ALA A 65 -9.998 -6.205 3.183 1.00 0.00 N ATOM 956 CA ALA A 65 -9.465 -6.483 4.511 1.00 0.00 C ATOM 957 C ALA A 65 -9.511 -5.239 5.392 1.00 0.00 C ATOM 958 O ALA A 65 -9.783 -5.326 6.589 1.00 0.00 O ATOM 959 CB ALA A 65 -8.041 -7.008 4.409 1.00 0.00 C ATOM 0 H ALA A 65 -9.343 -6.379 2.421 1.00 0.00 H new ATOM 0 HA ALA A 65 -10.089 -7.247 4.974 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -7.656 -7.211 5.408 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -8.033 -7.927 3.823 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -7.412 -6.262 3.922 1.00 0.00 H new ATOM 965 N GLN A 66 -9.242 -4.084 4.792 1.00 0.00 N ATOM 966 CA GLN A 66 -9.252 -2.823 5.524 1.00 0.00 C ATOM 967 C GLN A 66 -10.589 -2.109 5.360 1.00 0.00 C ATOM 968 O GLN A 66 -10.676 -0.891 5.512 1.00 0.00 O ATOM 969 CB GLN A 66 -8.116 -1.920 5.041 1.00 0.00 C ATOM 970 CG GLN A 66 -6.746 -2.578 5.106 1.00 0.00 C ATOM 971 CD GLN A 66 -5.689 -1.800 4.347 1.00 0.00 C ATOM 972 OE1 GLN A 66 -4.768 -1.239 4.941 1.00 0.00 O ATOM 973 NE2 GLN A 66 -5.815 -1.764 3.025 1.00 0.00 N ATOM 0 H GLN A 66 -9.015 -3.995 3.802 1.00 0.00 H new ATOM 0 HA GLN A 66 -9.106 -3.045 6.581 1.00 0.00 H new ATOM 0 HB2 GLN A 66 -8.316 -1.617 4.013 1.00 0.00 H new ATOM 0 HB3 GLN A 66 -8.103 -1.012 5.644 1.00 0.00 H new ATOM 0 HG2 GLN A 66 -6.442 -2.674 6.148 1.00 0.00 H new ATOM 0 HG3 GLN A 66 -6.812 -3.587 4.699 1.00 0.00 H new ATOM 0 HE21 GLN A 66 -6.594 -2.243 2.574 1.00 0.00 H new ATOM 0 HE22 GLN A 66 -5.133 -1.257 2.461 1.00 0.00 H new ATOM 982 N MET A 67 -11.630 -2.875 5.049 1.00 0.00 N ATOM 983 CA MET A 67 -12.964 -2.315 4.865 1.00 0.00 C ATOM 984 C MET A 67 -13.900 -2.763 5.983 1.00 0.00 C ATOM 985 O MET A 67 -13.657 -3.775 6.641 1.00 0.00 O ATOM 986 CB MET A 67 -13.533 -2.733 3.508 1.00 0.00 C ATOM 987 CG MET A 67 -12.941 -1.965 2.338 1.00 0.00 C ATOM 988 SD MET A 67 -13.791 -0.405 2.028 1.00 0.00 S ATOM 989 CE MET A 67 -15.205 -0.972 1.087 1.00 0.00 C ATOM 0 H MET A 67 -11.575 -3.885 4.919 1.00 0.00 H new ATOM 0 HA MET A 67 -12.883 -1.228 4.897 1.00 0.00 H new ATOM 0 HB2 MET A 67 -13.354 -3.798 3.361 1.00 0.00 H new ATOM 0 HB3 MET A 67 -14.613 -2.590 3.517 1.00 0.00 H new ATOM 0 HG2 MET A 67 -11.887 -1.767 2.535 1.00 0.00 H new ATOM 0 HG3 MET A 67 -12.987 -2.584 1.442 1.00 0.00 H new ATOM 0 HE1 MET A 67 -15.883 -0.137 0.911 1.00 0.00 H new ATOM 0 HE2 MET A 67 -14.869 -1.374 0.131 1.00 0.00 H new ATOM 0 HE3 MET A 67 -15.725 -1.751 1.645 1.00 0.00 H new ATOM 999 N SER A 68 -14.970 -2.004 6.193 1.00 0.00 N ATOM 1000 CA SER A 68 -15.941 -2.321 7.234 1.00 0.00 C ATOM 1001 C SER A 68 -17.331 -2.522 6.638 1.00 0.00 C ATOM 1002 O SER A 68 -17.681 -1.909 5.629 1.00 0.00 O ATOM 1003 CB SER A 68 -15.979 -1.206 8.281 1.00 0.00 C ATOM 1004 OG SER A 68 -15.980 0.071 7.667 1.00 0.00 O ATOM 0 H SER A 68 -15.187 -1.164 5.656 1.00 0.00 H new ATOM 0 HA SER A 68 -15.633 -3.250 7.713 1.00 0.00 H new ATOM 0 HB2 SER A 68 -16.869 -1.315 8.901 1.00 0.00 H new ATOM 0 HB3 SER A 68 -15.117 -1.294 8.942 1.00 0.00 H new ATOM 0 HG SER A 68 -15.095 0.251 7.286 1.00 0.00 H new ATOM 1010 N VAL A 69 -18.119 -3.386 7.269 1.00 0.00 N ATOM 1011 CA VAL A 69 -19.471 -3.669 6.804 1.00 0.00 C ATOM 1012 C VAL A 69 -20.272 -2.384 6.628 1.00 0.00 C ATOM 1013 O VAL A 69 -20.387 -1.580 7.553 1.00 0.00 O ATOM 1014 CB VAL A 69 -20.218 -4.597 7.780 1.00 0.00 C ATOM 1015 CG1 VAL A 69 -21.649 -4.821 7.315 1.00 0.00 C ATOM 1016 CG2 VAL A 69 -19.483 -5.921 7.924 1.00 0.00 C ATOM 0 H VAL A 69 -17.844 -3.903 8.104 1.00 0.00 H new ATOM 0 HA VAL A 69 -19.376 -4.169 5.840 1.00 0.00 H new ATOM 0 HB VAL A 69 -20.250 -4.117 8.758 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -22.161 -5.479 8.017 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -22.170 -3.865 7.268 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -21.643 -5.280 6.326 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -20.025 -6.564 8.617 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -19.418 -6.409 6.951 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -18.479 -5.740 8.307 1.00 0.00 H new ATOM 1026 N GLY A 70 -20.825 -2.196 5.434 1.00 0.00 N ATOM 1027 CA GLY A 70 -21.609 -1.006 5.158 1.00 0.00 C ATOM 1028 C GLY A 70 -20.745 0.190 4.811 1.00 0.00 C ATOM 1029 O GLY A 70 -21.226 1.322 4.780 1.00 0.00 O ATOM 0 H GLY A 70 -20.744 -2.847 4.653 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -22.292 -1.208 4.333 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -22.221 -0.768 6.028 1.00 0.00 H new ATOM 1033 N GLN A 71 -19.467 -0.062 4.550 1.00 0.00 N ATOM 1034 CA GLN A 71 -18.534 1.005 4.205 1.00 0.00 C ATOM 1035 C GLN A 71 -18.188 0.967 2.721 1.00 0.00 C ATOM 1036 O GLN A 71 -17.920 -0.098 2.163 1.00 0.00 O ATOM 1037 CB GLN A 71 -17.258 0.885 5.042 1.00 0.00 C ATOM 1038 CG GLN A 71 -16.514 2.200 5.207 1.00 0.00 C ATOM 1039 CD GLN A 71 -15.008 2.026 5.176 1.00 0.00 C ATOM 1040 OE1 GLN A 71 -14.379 1.780 6.205 1.00 0.00 O ATOM 1041 NE2 GLN A 71 -14.422 2.155 3.991 1.00 0.00 N ATOM 0 H GLN A 71 -19.054 -0.994 4.571 1.00 0.00 H new ATOM 0 HA GLN A 71 -19.015 1.959 4.422 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -17.515 0.496 6.027 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -16.594 0.157 4.575 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -16.813 2.885 4.413 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -16.803 2.661 6.151 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -14.983 2.359 3.164 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -13.411 2.050 3.908 1.00 0.00 H new ATOM 1050 N ARG A 72 -18.195 2.134 2.086 1.00 0.00 N ATOM 1051 CA ARG A 72 -17.883 2.234 0.665 1.00 0.00 C ATOM 1052 C ARG A 72 -16.613 3.049 0.444 1.00 0.00 C ATOM 1053 O ARG A 72 -16.418 4.095 1.063 1.00 0.00 O ATOM 1054 CB ARG A 72 -19.050 2.872 -0.091 1.00 0.00 C ATOM 1055 CG ARG A 72 -19.034 2.592 -1.585 1.00 0.00 C ATOM 1056 CD ARG A 72 -20.372 2.921 -2.228 1.00 0.00 C ATOM 1057 NE ARG A 72 -20.222 3.343 -3.618 1.00 0.00 N ATOM 1058 CZ ARG A 72 -21.141 4.039 -4.277 1.00 0.00 C ATOM 1059 NH1 ARG A 72 -22.269 4.391 -3.676 1.00 0.00 N ATOM 1060 NH2 ARG A 72 -20.932 4.386 -5.541 1.00 0.00 N ATOM 0 H ARG A 72 -18.413 3.024 2.533 1.00 0.00 H new ATOM 0 HA ARG A 72 -17.719 1.227 0.282 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -19.987 2.506 0.329 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -19.029 3.950 0.068 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -18.247 3.180 -2.058 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -18.795 1.543 -1.757 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -21.021 2.046 -2.183 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -20.863 3.712 -1.660 1.00 0.00 H new ATOM 0 HE ARG A 72 -19.365 3.089 -4.109 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -22.433 4.127 -2.704 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -22.973 4.926 -4.185 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -20.065 4.118 -6.007 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -21.638 4.921 -6.047 1.00 0.00 H new ATOM 1074 N ALA A 73 -15.751 2.562 -0.443 1.00 0.00 N ATOM 1075 CA ALA A 73 -14.500 3.246 -0.748 1.00 0.00 C ATOM 1076 C ALA A 73 -13.937 2.788 -2.089 1.00 0.00 C ATOM 1077 O ALA A 73 -14.364 1.773 -2.640 1.00 0.00 O ATOM 1078 CB ALA A 73 -13.486 3.009 0.361 1.00 0.00 C ATOM 0 H ALA A 73 -15.896 1.697 -0.963 1.00 0.00 H new ATOM 0 HA ALA A 73 -14.705 4.314 -0.816 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -12.557 3.525 0.121 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -13.880 3.391 1.302 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -13.293 1.940 0.456 1.00 0.00 H new ATOM 1084 N LYS A 74 -12.975 3.542 -2.610 1.00 0.00 N ATOM 1085 CA LYS A 74 -12.352 3.215 -3.887 1.00 0.00 C ATOM 1086 C LYS A 74 -11.086 2.390 -3.678 1.00 0.00 C ATOM 1087 O LYS A 74 -10.182 2.795 -2.946 1.00 0.00 O ATOM 1088 CB LYS A 74 -12.019 4.493 -4.659 1.00 0.00 C ATOM 1089 CG LYS A 74 -13.126 5.533 -4.620 1.00 0.00 C ATOM 1090 CD LYS A 74 -12.817 6.710 -5.530 1.00 0.00 C ATOM 1091 CE LYS A 74 -12.007 7.775 -4.807 1.00 0.00 C ATOM 1092 NZ LYS A 74 -11.657 8.910 -5.706 1.00 0.00 N ATOM 0 H LYS A 74 -12.609 4.385 -2.167 1.00 0.00 H new ATOM 0 HA LYS A 74 -13.060 2.623 -4.467 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -11.108 4.929 -4.248 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -11.810 4.236 -5.697 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -14.068 5.075 -4.923 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -13.258 5.887 -3.598 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -12.265 6.361 -6.403 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -13.748 7.144 -5.894 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -12.576 8.148 -3.955 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -11.094 7.331 -4.411 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -11.105 9.615 -5.177 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -11.093 8.558 -6.506 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -12.528 9.350 -6.064 1.00 0.00 H new ATOM 1106 N LEU A 75 -11.026 1.232 -4.327 1.00 0.00 N ATOM 1107 CA LEU A 75 -9.869 0.351 -4.214 1.00 0.00 C ATOM 1108 C LEU A 75 -8.914 0.552 -5.386 1.00 0.00 C ATOM 1109 O LEU A 75 -9.091 -0.036 -6.453 1.00 0.00 O ATOM 1110 CB LEU A 75 -10.320 -1.110 -4.154 1.00 0.00 C ATOM 1111 CG LEU A 75 -9.497 -2.029 -3.250 1.00 0.00 C ATOM 1112 CD1 LEU A 75 -10.024 -3.454 -3.317 1.00 0.00 C ATOM 1113 CD2 LEU A 75 -8.027 -1.984 -3.639 1.00 0.00 C ATOM 0 H LEU A 75 -11.765 0.882 -4.937 1.00 0.00 H new ATOM 0 HA LEU A 75 -9.342 0.601 -3.293 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -11.357 -1.136 -3.818 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -10.302 -1.517 -5.165 1.00 0.00 H new ATOM 0 HG LEU A 75 -9.591 -1.676 -2.223 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -9.426 -4.094 -2.668 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -11.063 -3.473 -2.989 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -9.961 -3.818 -4.343 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -7.457 -2.644 -2.985 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -7.914 -2.311 -4.673 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -7.655 -0.964 -3.539 1.00 0.00 H new ATOM 1125 N VAL A 76 -7.900 1.387 -5.180 1.00 0.00 N ATOM 1126 CA VAL A 76 -6.915 1.664 -6.219 1.00 0.00 C ATOM 1127 C VAL A 76 -5.631 0.876 -5.982 1.00 0.00 C ATOM 1128 O VAL A 76 -4.833 1.218 -5.109 1.00 0.00 O ATOM 1129 CB VAL A 76 -6.578 3.165 -6.286 1.00 0.00 C ATOM 1130 CG1 VAL A 76 -6.227 3.697 -4.905 1.00 0.00 C ATOM 1131 CG2 VAL A 76 -5.441 3.412 -7.266 1.00 0.00 C ATOM 0 H VAL A 76 -7.739 1.883 -4.303 1.00 0.00 H new ATOM 0 HA VAL A 76 -7.358 1.356 -7.166 1.00 0.00 H new ATOM 0 HB VAL A 76 -7.458 3.701 -6.642 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -5.992 4.759 -4.973 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -7.074 3.555 -4.234 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -5.363 3.158 -4.516 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -5.216 4.478 -7.301 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -4.556 2.865 -6.942 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -5.735 3.071 -8.258 1.00 0.00 H new ATOM 1141 N CYS A 77 -5.439 -0.179 -6.766 1.00 0.00 N ATOM 1142 CA CYS A 77 -4.251 -1.016 -6.642 1.00 0.00 C ATOM 1143 C CYS A 77 -3.546 -1.162 -7.987 1.00 0.00 C ATOM 1144 O CYS A 77 -4.128 -0.890 -9.037 1.00 0.00 O ATOM 1145 CB CYS A 77 -4.628 -2.395 -6.099 1.00 0.00 C ATOM 1146 SG CYS A 77 -5.690 -3.358 -7.202 1.00 0.00 S ATOM 0 H CYS A 77 -6.090 -0.475 -7.493 1.00 0.00 H new ATOM 0 HA CYS A 77 -3.567 -0.533 -5.944 1.00 0.00 H new ATOM 0 HB2 CYS A 77 -3.716 -2.960 -5.906 1.00 0.00 H new ATOM 0 HB3 CYS A 77 -5.134 -2.271 -5.142 1.00 0.00 H new ATOM 0 HG CYS A 77 -5.605 -2.883 -8.409 1.00 0.00 H new ATOM 1152 N SER A 78 -2.288 -1.590 -7.946 1.00 0.00 N ATOM 1153 CA SER A 78 -1.501 -1.766 -9.161 1.00 0.00 C ATOM 1154 C SER A 78 -1.844 -3.087 -9.844 1.00 0.00 C ATOM 1155 O SER A 78 -2.479 -3.968 -9.264 1.00 0.00 O ATOM 1156 CB SER A 78 -0.006 -1.719 -8.837 1.00 0.00 C ATOM 1157 OG SER A 78 0.211 -1.699 -7.437 1.00 0.00 O ATOM 0 H SER A 78 -1.792 -1.821 -7.085 1.00 0.00 H new ATOM 0 HA SER A 78 -1.743 -0.951 -9.843 1.00 0.00 H new ATOM 0 HB2 SER A 78 0.491 -2.585 -9.273 1.00 0.00 H new ATOM 0 HB3 SER A 78 0.440 -0.834 -9.290 1.00 0.00 H new ATOM 0 HG SER A 78 -0.012 -2.575 -7.059 1.00 0.00 H new ATOM 1163 N PRO A 79 -1.413 -3.228 -11.106 1.00 0.00 N ATOM 1164 CA PRO A 79 -1.662 -4.438 -11.897 1.00 0.00 C ATOM 1165 C PRO A 79 -0.868 -5.636 -11.388 1.00 0.00 C ATOM 1166 O PRO A 79 -1.292 -6.782 -11.537 1.00 0.00 O ATOM 1167 CB PRO A 79 -1.197 -4.045 -13.301 1.00 0.00 C ATOM 1168 CG PRO A 79 -0.193 -2.967 -13.081 1.00 0.00 C ATOM 1169 CD PRO A 79 -0.651 -2.219 -11.860 1.00 0.00 C ATOM 0 HA PRO A 79 -2.706 -4.749 -11.850 1.00 0.00 H new ATOM 0 HB2 PRO A 79 -0.758 -4.894 -13.824 1.00 0.00 H new ATOM 0 HB3 PRO A 79 -2.030 -3.692 -13.909 1.00 0.00 H new ATOM 0 HG2 PRO A 79 0.803 -3.385 -12.932 1.00 0.00 H new ATOM 0 HG3 PRO A 79 -0.135 -2.305 -13.945 1.00 0.00 H new ATOM 0 HD2 PRO A 79 0.192 -1.838 -11.283 1.00 0.00 H new ATOM 0 HD3 PRO A 79 -1.271 -1.362 -12.123 1.00 0.00 H new ATOM 1177 N ASP A 80 0.285 -5.363 -10.787 1.00 0.00 N ATOM 1178 CA ASP A 80 1.138 -6.420 -10.255 1.00 0.00 C ATOM 1179 C ASP A 80 0.428 -7.181 -9.140 1.00 0.00 C ATOM 1180 O ASP A 80 0.731 -8.346 -8.879 1.00 0.00 O ATOM 1181 CB ASP A 80 2.449 -5.831 -9.732 1.00 0.00 C ATOM 1182 CG ASP A 80 2.224 -4.716 -8.730 1.00 0.00 C ATOM 1183 OD1 ASP A 80 1.632 -4.986 -7.664 1.00 0.00 O ATOM 1184 OD2 ASP A 80 2.641 -3.573 -9.011 1.00 0.00 O ATOM 0 H ASP A 80 0.650 -4.420 -10.656 1.00 0.00 H new ATOM 0 HA ASP A 80 1.358 -7.117 -11.063 1.00 0.00 H new ATOM 0 HB2 ASP A 80 3.038 -6.621 -9.266 1.00 0.00 H new ATOM 0 HB3 ASP A 80 3.033 -5.450 -10.570 1.00 0.00 H new ATOM 1189 N TYR A 81 -0.517 -6.516 -8.485 1.00 0.00 N ATOM 1190 CA TYR A 81 -1.268 -7.129 -7.396 1.00 0.00 C ATOM 1191 C TYR A 81 -2.689 -7.465 -7.835 1.00 0.00 C ATOM 1192 O TYR A 81 -3.562 -7.723 -7.007 1.00 0.00 O ATOM 1193 CB TYR A 81 -1.303 -6.196 -6.184 1.00 0.00 C ATOM 1194 CG TYR A 81 -0.233 -6.494 -5.159 1.00 0.00 C ATOM 1195 CD1 TYR A 81 1.039 -6.893 -5.549 1.00 0.00 C ATOM 1196 CD2 TYR A 81 -0.494 -6.374 -3.799 1.00 0.00 C ATOM 1197 CE1 TYR A 81 2.020 -7.167 -4.615 1.00 0.00 C ATOM 1198 CE2 TYR A 81 0.481 -6.644 -2.858 1.00 0.00 C ATOM 1199 CZ TYR A 81 1.736 -7.041 -3.271 1.00 0.00 C ATOM 1200 OH TYR A 81 2.710 -7.311 -2.338 1.00 0.00 O ATOM 0 H TYR A 81 -0.781 -5.552 -8.689 1.00 0.00 H new ATOM 0 HA TYR A 81 -0.765 -8.055 -7.118 1.00 0.00 H new ATOM 0 HB2 TYR A 81 -1.191 -5.167 -6.525 1.00 0.00 H new ATOM 0 HB3 TYR A 81 -2.281 -6.269 -5.708 1.00 0.00 H new ATOM 0 HD1 TYR A 81 1.265 -6.991 -6.600 1.00 0.00 H new ATOM 0 HD2 TYR A 81 -1.476 -6.064 -3.472 1.00 0.00 H new ATOM 0 HE1 TYR A 81 3.003 -7.478 -4.935 1.00 0.00 H new ATOM 0 HE2 TYR A 81 0.262 -6.545 -1.805 1.00 0.00 H new ATOM 0 HH TYR A 81 2.348 -7.173 -1.438 1.00 0.00 H new ATOM 1210 N ALA A 82 -2.913 -7.460 -9.145 1.00 0.00 N ATOM 1211 CA ALA A 82 -4.227 -7.767 -9.697 1.00 0.00 C ATOM 1212 C ALA A 82 -4.110 -8.365 -11.095 1.00 0.00 C ATOM 1213 O ALA A 82 -3.026 -8.762 -11.521 1.00 0.00 O ATOM 1214 CB ALA A 82 -5.092 -6.515 -9.727 1.00 0.00 C ATOM 0 H ALA A 82 -2.201 -7.247 -9.844 1.00 0.00 H new ATOM 0 HA ALA A 82 -4.700 -8.508 -9.052 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -6.070 -6.759 -10.141 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -5.212 -6.132 -8.714 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -4.614 -5.757 -10.347 1.00 0.00 H new ATOM 1220 N TYR A 83 -5.232 -8.426 -11.803 1.00 0.00 N ATOM 1221 CA TYR A 83 -5.256 -8.979 -13.152 1.00 0.00 C ATOM 1222 C TYR A 83 -5.024 -7.888 -14.192 1.00 0.00 C ATOM 1223 O TYR A 83 -5.294 -8.076 -15.377 1.00 0.00 O ATOM 1224 CB TYR A 83 -6.591 -9.676 -13.416 1.00 0.00 C ATOM 1225 CG TYR A 83 -7.792 -8.880 -12.958 1.00 0.00 C ATOM 1226 CD1 TYR A 83 -8.074 -7.634 -13.506 1.00 0.00 C ATOM 1227 CD2 TYR A 83 -8.644 -9.373 -11.978 1.00 0.00 C ATOM 1228 CE1 TYR A 83 -9.169 -6.903 -13.089 1.00 0.00 C ATOM 1229 CE2 TYR A 83 -9.743 -8.649 -11.556 1.00 0.00 C ATOM 1230 CZ TYR A 83 -10.001 -7.414 -12.115 1.00 0.00 C ATOM 1231 OH TYR A 83 -11.094 -6.689 -11.698 1.00 0.00 O ATOM 0 H TYR A 83 -6.137 -8.099 -11.465 1.00 0.00 H new ATOM 0 HA TYR A 83 -4.451 -9.709 -13.233 1.00 0.00 H new ATOM 0 HB2 TYR A 83 -6.683 -9.874 -14.484 1.00 0.00 H new ATOM 0 HB3 TYR A 83 -6.593 -10.642 -12.912 1.00 0.00 H new ATOM 0 HD1 TYR A 83 -7.426 -7.231 -14.270 1.00 0.00 H new ATOM 0 HD2 TYR A 83 -8.444 -10.339 -11.538 1.00 0.00 H new ATOM 0 HE1 TYR A 83 -9.373 -5.936 -13.524 1.00 0.00 H new ATOM 0 HE2 TYR A 83 -10.396 -9.047 -10.793 1.00 0.00 H new ATOM 0 HH TYR A 83 -11.010 -5.763 -12.008 1.00 0.00 H new ATOM 1241 N GLY A 84 -4.520 -6.744 -13.738 1.00 0.00 N ATOM 1242 CA GLY A 84 -4.259 -5.638 -14.641 1.00 0.00 C ATOM 1243 C GLY A 84 -3.106 -5.919 -15.583 1.00 0.00 C ATOM 1244 O GLY A 84 -3.014 -5.323 -16.657 1.00 0.00 O ATOM 0 H GLY A 84 -4.288 -6.564 -12.761 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -5.157 -5.428 -15.223 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -4.039 -4.742 -14.060 1.00 0.00 H new ATOM 1248 N SER A 85 -2.223 -6.827 -15.182 1.00 0.00 N ATOM 1249 CA SER A 85 -1.067 -7.182 -15.996 1.00 0.00 C ATOM 1250 C SER A 85 -1.484 -7.471 -17.435 1.00 0.00 C ATOM 1251 O SER A 85 -1.202 -6.689 -18.343 1.00 0.00 O ATOM 1252 CB SER A 85 -0.354 -8.400 -15.405 1.00 0.00 C ATOM 1253 OG SER A 85 -1.283 -9.404 -15.035 1.00 0.00 O ATOM 0 H SER A 85 -2.286 -7.331 -14.297 1.00 0.00 H new ATOM 0 HA SER A 85 -0.381 -6.335 -15.998 1.00 0.00 H new ATOM 0 HB2 SER A 85 0.350 -8.802 -16.133 1.00 0.00 H new ATOM 0 HB3 SER A 85 0.227 -8.098 -14.533 1.00 0.00 H new ATOM 0 HG SER A 85 -0.803 -10.172 -14.662 1.00 0.00 H new ATOM 1259 N ARG A 86 -2.156 -8.600 -17.634 1.00 0.00 N ATOM 1260 CA ARG A 86 -2.611 -8.994 -18.962 1.00 0.00 C ATOM 1261 C ARG A 86 -3.709 -8.059 -19.460 1.00 0.00 C ATOM 1262 O ARG A 86 -3.570 -7.420 -20.502 1.00 0.00 O ATOM 1263 CB ARG A 86 -3.123 -10.435 -18.942 1.00 0.00 C ATOM 1264 CG ARG A 86 -3.891 -10.826 -20.194 1.00 0.00 C ATOM 1265 CD ARG A 86 -3.090 -10.533 -21.453 1.00 0.00 C ATOM 1266 NE ARG A 86 -3.187 -11.616 -22.428 1.00 0.00 N ATOM 1267 CZ ARG A 86 -2.736 -11.525 -23.675 1.00 0.00 C ATOM 1268 NH1 ARG A 86 -2.161 -10.407 -24.095 1.00 0.00 N ATOM 1269 NH2 ARG A 86 -2.861 -12.554 -24.503 1.00 0.00 N ATOM 0 H ARG A 86 -2.397 -9.258 -16.893 1.00 0.00 H new ATOM 0 HA ARG A 86 -1.763 -8.926 -19.644 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -2.277 -11.111 -18.819 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -3.767 -10.571 -18.073 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -4.135 -11.888 -20.156 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -4.835 -10.283 -20.228 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -3.448 -9.607 -21.903 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -2.044 -10.376 -21.189 1.00 0.00 H new ATOM 0 HE ARG A 86 -3.625 -12.490 -22.136 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -2.064 -9.614 -23.461 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -1.816 -10.340 -25.052 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -3.303 -13.415 -24.183 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -2.515 -12.484 -25.460 1.00 0.00 H new ATOM 1283 N GLY A 87 -4.803 -7.986 -18.707 1.00 0.00 N ATOM 1284 CA GLY A 87 -5.910 -7.128 -19.089 1.00 0.00 C ATOM 1285 C GLY A 87 -6.554 -7.558 -20.392 1.00 0.00 C ATOM 1286 O GLY A 87 -6.316 -8.665 -20.875 1.00 0.00 O ATOM 0 H GLY A 87 -4.942 -8.505 -17.840 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -6.660 -7.133 -18.298 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -5.554 -6.102 -19.184 1.00 0.00 H new ATOM 1290 N HIS A 88 -7.375 -6.681 -20.962 1.00 0.00 N ATOM 1291 CA HIS A 88 -8.057 -6.976 -22.216 1.00 0.00 C ATOM 1292 C HIS A 88 -8.374 -5.692 -22.978 1.00 0.00 C ATOM 1293 O HIS A 88 -8.434 -4.603 -22.408 1.00 0.00 O ATOM 1294 CB HIS A 88 -9.345 -7.755 -21.950 1.00 0.00 C ATOM 1295 CG HIS A 88 -9.185 -9.239 -22.078 1.00 0.00 C ATOM 1296 ND1 HIS A 88 -8.508 -9.836 -23.121 1.00 0.00 N ATOM 1297 CD2 HIS A 88 -9.618 -10.248 -21.286 1.00 0.00 C ATOM 1298 CE1 HIS A 88 -8.533 -11.147 -22.965 1.00 0.00 C ATOM 1299 NE2 HIS A 88 -9.200 -11.424 -21.859 1.00 0.00 N ATOM 0 H HIS A 88 -7.584 -5.761 -20.575 1.00 0.00 H new ATOM 0 HA HIS A 88 -7.392 -7.586 -22.827 1.00 0.00 H new ATOM 0 HB2 HIS A 88 -9.700 -7.521 -20.946 1.00 0.00 H new ATOM 0 HB3 HIS A 88 -10.113 -7.419 -22.646 1.00 0.00 H new ATOM 0 HD2 HIS A 88 -10.186 -10.147 -20.373 1.00 0.00 H new ATOM 0 HE1 HIS A 88 -8.084 -11.870 -23.629 1.00 0.00 H new ATOM 0 HE2 HIS A 88 -9.376 -12.359 -21.491 1.00 0.00 H new ATOM 1307 N PRO A 89 -8.580 -5.822 -24.297 1.00 0.00 N ATOM 1308 CA PRO A 89 -8.894 -4.683 -25.165 1.00 0.00 C ATOM 1309 C PRO A 89 -10.286 -4.120 -24.902 1.00 0.00 C ATOM 1310 O PRO A 89 -11.290 -4.803 -25.103 1.00 0.00 O ATOM 1311 CB PRO A 89 -8.814 -5.277 -26.573 1.00 0.00 C ATOM 1312 CG PRO A 89 -9.091 -6.729 -26.388 1.00 0.00 C ATOM 1313 CD PRO A 89 -8.525 -7.090 -25.043 1.00 0.00 C ATOM 0 HA PRO A 89 -8.214 -3.847 -25.002 1.00 0.00 H new ATOM 0 HB2 PRO A 89 -9.544 -4.817 -27.239 1.00 0.00 H new ATOM 0 HB3 PRO A 89 -7.831 -5.115 -27.016 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -10.162 -6.930 -26.428 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -8.626 -7.319 -27.178 1.00 0.00 H new ATOM 0 HD2 PRO A 89 -9.112 -7.868 -24.556 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -7.505 -7.464 -25.124 1.00 0.00 H new ATOM 1321 N GLY A 90 -10.340 -2.870 -24.453 1.00 0.00 N ATOM 1322 CA GLY A 90 -11.615 -2.237 -24.171 1.00 0.00 C ATOM 1323 C GLY A 90 -12.155 -2.605 -22.803 1.00 0.00 C ATOM 1324 O GLY A 90 -13.285 -2.258 -22.460 1.00 0.00 O ATOM 0 H GLY A 90 -9.523 -2.284 -24.279 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -11.502 -1.155 -24.234 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -12.338 -2.527 -24.934 1.00 0.00 H new ATOM 1328 N VAL A 91 -11.346 -3.311 -22.020 1.00 0.00 N ATOM 1329 CA VAL A 91 -11.750 -3.727 -20.682 1.00 0.00 C ATOM 1330 C VAL A 91 -10.697 -3.347 -19.647 1.00 0.00 C ATOM 1331 O VAL A 91 -10.982 -2.619 -18.696 1.00 0.00 O ATOM 1332 CB VAL A 91 -11.992 -5.247 -20.616 1.00 0.00 C ATOM 1333 CG1 VAL A 91 -12.584 -5.636 -19.270 1.00 0.00 C ATOM 1334 CG2 VAL A 91 -12.899 -5.691 -21.754 1.00 0.00 C ATOM 0 H VAL A 91 -10.408 -3.607 -22.289 1.00 0.00 H new ATOM 0 HA VAL A 91 -12.681 -3.207 -20.457 1.00 0.00 H new ATOM 0 HB VAL A 91 -11.034 -5.755 -20.725 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -12.748 -6.713 -19.242 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -11.895 -5.353 -18.474 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -13.534 -5.121 -19.128 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -13.060 -6.767 -21.692 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -13.857 -5.176 -21.678 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -12.431 -5.448 -22.708 1.00 0.00 H new ATOM 1344 N ILE A 92 -9.479 -3.843 -19.840 1.00 0.00 N ATOM 1345 CA ILE A 92 -8.383 -3.553 -18.924 1.00 0.00 C ATOM 1346 C ILE A 92 -7.098 -3.243 -19.685 1.00 0.00 C ATOM 1347 O ILE A 92 -6.720 -3.942 -20.625 1.00 0.00 O ATOM 1348 CB ILE A 92 -8.126 -4.729 -17.963 1.00 0.00 C ATOM 1349 CG1 ILE A 92 -9.377 -5.018 -17.130 1.00 0.00 C ATOM 1350 CG2 ILE A 92 -6.940 -4.427 -17.061 1.00 0.00 C ATOM 1351 CD1 ILE A 92 -9.225 -6.205 -16.204 1.00 0.00 C ATOM 0 H ILE A 92 -9.227 -4.447 -20.622 1.00 0.00 H new ATOM 0 HA ILE A 92 -8.679 -2.679 -18.344 1.00 0.00 H new ATOM 0 HB ILE A 92 -7.892 -5.616 -18.552 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -9.622 -4.135 -16.539 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -10.217 -5.196 -17.801 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -6.771 -5.268 -16.388 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -6.051 -4.266 -17.671 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -7.146 -3.530 -16.477 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -10.149 -6.351 -15.645 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -9.010 -7.099 -16.790 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -8.406 -6.022 -15.509 1.00 0.00 H new ATOM 1363 N PRO A 93 -6.409 -2.171 -19.269 1.00 0.00 N ATOM 1364 CA PRO A 93 -5.154 -1.745 -19.896 1.00 0.00 C ATOM 1365 C PRO A 93 -4.009 -2.712 -19.617 1.00 0.00 C ATOM 1366 O PRO A 93 -4.047 -3.501 -18.672 1.00 0.00 O ATOM 1367 CB PRO A 93 -4.877 -0.386 -19.248 1.00 0.00 C ATOM 1368 CG PRO A 93 -5.578 -0.443 -17.935 1.00 0.00 C ATOM 1369 CD PRO A 93 -6.800 -1.292 -18.154 1.00 0.00 C ATOM 0 HA PRO A 93 -5.234 -1.706 -20.982 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -3.808 -0.219 -19.119 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -5.255 0.430 -19.863 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -4.935 -0.875 -17.168 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -5.853 0.556 -17.596 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -7.057 -1.864 -17.262 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -7.670 -0.686 -18.406 1.00 0.00 H new ATOM 1377 N PRO A 94 -2.964 -2.652 -20.456 1.00 0.00 N ATOM 1378 CA PRO A 94 -1.787 -3.515 -20.318 1.00 0.00 C ATOM 1379 C PRO A 94 -0.949 -3.162 -19.094 1.00 0.00 C ATOM 1380 O PRO A 94 -0.189 -2.195 -19.109 1.00 0.00 O ATOM 1381 CB PRO A 94 -0.998 -3.246 -21.602 1.00 0.00 C ATOM 1382 CG PRO A 94 -1.414 -1.879 -22.023 1.00 0.00 C ATOM 1383 CD PRO A 94 -2.851 -1.736 -21.603 1.00 0.00 C ATOM 0 HA PRO A 94 -2.062 -4.561 -20.181 1.00 0.00 H new ATOM 0 HB2 PRO A 94 0.076 -3.296 -21.424 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -1.228 -3.984 -22.370 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -0.792 -1.119 -21.551 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -1.308 -1.753 -23.101 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -3.087 -0.710 -21.322 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -3.534 -2.012 -22.406 1.00 0.00 H new ATOM 1391 N ASN A 95 -1.093 -3.954 -18.036 1.00 0.00 N ATOM 1392 CA ASN A 95 -0.349 -3.724 -16.803 1.00 0.00 C ATOM 1393 C ASN A 95 -0.445 -2.264 -16.374 1.00 0.00 C ATOM 1394 O ASN A 95 0.561 -1.557 -16.312 1.00 0.00 O ATOM 1395 CB ASN A 95 1.118 -4.118 -16.988 1.00 0.00 C ATOM 1396 CG ASN A 95 1.287 -5.297 -17.927 1.00 0.00 C ATOM 1397 OD1 ASN A 95 1.351 -6.447 -17.491 1.00 0.00 O ATOM 1398 ND2 ASN A 95 1.360 -5.016 -19.222 1.00 0.00 N ATOM 0 H ASN A 95 -1.718 -4.760 -18.008 1.00 0.00 H new ATOM 0 HA ASN A 95 -0.789 -4.343 -16.021 1.00 0.00 H new ATOM 0 HB2 ASN A 95 1.674 -3.265 -17.377 1.00 0.00 H new ATOM 0 HB3 ASN A 95 1.550 -4.365 -16.018 1.00 0.00 H new ATOM 0 HD21 ASN A 95 1.474 -5.768 -19.901 1.00 0.00 H new ATOM 0 HD22 ASN A 95 1.302 -4.048 -19.538 1.00 0.00 H new ATOM 1405 N ALA A 96 -1.662 -1.819 -16.077 1.00 0.00 N ATOM 1406 CA ALA A 96 -1.889 -0.444 -15.651 1.00 0.00 C ATOM 1407 C ALA A 96 -2.711 -0.396 -14.367 1.00 0.00 C ATOM 1408 O ALA A 96 -3.543 -1.268 -14.117 1.00 0.00 O ATOM 1409 CB ALA A 96 -2.583 0.343 -16.753 1.00 0.00 C ATOM 0 H ALA A 96 -2.505 -2.391 -16.124 1.00 0.00 H new ATOM 0 HA ALA A 96 -0.920 0.012 -15.449 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -2.746 1.368 -16.421 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -1.959 0.346 -17.646 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -3.542 -0.121 -16.983 1.00 0.00 H new ATOM 1415 N THR A 97 -2.471 0.629 -13.554 1.00 0.00 N ATOM 1416 CA THR A 97 -3.188 0.789 -12.295 1.00 0.00 C ATOM 1417 C THR A 97 -4.696 0.793 -12.517 1.00 0.00 C ATOM 1418 O THR A 97 -5.184 1.304 -13.526 1.00 0.00 O ATOM 1419 CB THR A 97 -2.782 2.092 -11.580 1.00 0.00 C ATOM 1420 OG1 THR A 97 -1.359 2.248 -11.616 1.00 0.00 O ATOM 1421 CG2 THR A 97 -3.261 2.088 -10.136 1.00 0.00 C ATOM 0 H THR A 97 -1.786 1.360 -13.745 1.00 0.00 H new ATOM 0 HA THR A 97 -2.919 -0.061 -11.668 1.00 0.00 H new ATOM 0 HB THR A 97 -3.251 2.927 -12.100 1.00 0.00 H new ATOM 0 HG1 THR A 97 -1.109 3.079 -11.161 1.00 0.00 H new ATOM 0 HG21 THR A 97 -2.963 3.018 -9.651 1.00 0.00 H new ATOM 0 HG22 THR A 97 -4.347 1.999 -10.113 1.00 0.00 H new ATOM 0 HG23 THR A 97 -2.817 1.245 -9.608 1.00 0.00 H new ATOM 1429 N LEU A 98 -5.430 0.221 -11.569 1.00 0.00 N ATOM 1430 CA LEU A 98 -6.885 0.160 -11.661 1.00 0.00 C ATOM 1431 C LEU A 98 -7.530 0.539 -10.332 1.00 0.00 C ATOM 1432 O LEU A 98 -6.970 0.292 -9.263 1.00 0.00 O ATOM 1433 CB LEU A 98 -7.330 -1.244 -12.075 1.00 0.00 C ATOM 1434 CG LEU A 98 -6.650 -1.825 -13.315 1.00 0.00 C ATOM 1435 CD1 LEU A 98 -7.039 -3.283 -13.504 1.00 0.00 C ATOM 1436 CD2 LEU A 98 -7.008 -1.011 -14.550 1.00 0.00 C ATOM 0 H LEU A 98 -5.042 -0.207 -10.728 1.00 0.00 H new ATOM 0 HA LEU A 98 -7.208 0.875 -12.418 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -7.155 -1.920 -11.238 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -8.406 -1.226 -12.250 1.00 0.00 H new ATOM 0 HG LEU A 98 -5.571 -1.774 -13.171 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -6.545 -3.679 -14.391 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -6.731 -3.858 -12.630 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -8.120 -3.358 -13.626 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -6.515 -1.439 -15.423 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -8.088 -1.029 -14.697 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -6.678 0.019 -14.415 1.00 0.00 H new ATOM 1448 N THR A 99 -8.714 1.139 -10.405 1.00 0.00 N ATOM 1449 CA THR A 99 -9.438 1.551 -9.209 1.00 0.00 C ATOM 1450 C THR A 99 -10.844 0.963 -9.186 1.00 0.00 C ATOM 1451 O THR A 99 -11.742 1.449 -9.874 1.00 0.00 O ATOM 1452 CB THR A 99 -9.534 3.085 -9.111 1.00 0.00 C ATOM 1453 OG1 THR A 99 -8.226 3.664 -9.187 1.00 0.00 O ATOM 1454 CG2 THR A 99 -10.204 3.504 -7.811 1.00 0.00 C ATOM 0 H THR A 99 -9.192 1.351 -11.281 1.00 0.00 H new ATOM 0 HA THR A 99 -8.876 1.174 -8.355 1.00 0.00 H new ATOM 0 HB THR A 99 -10.139 3.442 -9.945 1.00 0.00 H new ATOM 0 HG1 THR A 99 -8.296 4.640 -9.126 1.00 0.00 H new ATOM 0 HG21 THR A 99 -10.260 4.592 -7.765 1.00 0.00 H new ATOM 0 HG22 THR A 99 -11.210 3.086 -7.769 1.00 0.00 H new ATOM 0 HG23 THR A 99 -9.622 3.135 -6.966 1.00 0.00 H new ATOM 1462 N PHE A 100 -11.029 -0.085 -8.391 1.00 0.00 N ATOM 1463 CA PHE A 100 -12.327 -0.740 -8.279 1.00 0.00 C ATOM 1464 C PHE A 100 -13.038 -0.323 -6.995 1.00 0.00 C ATOM 1465 O PHE A 100 -12.564 -0.599 -5.892 1.00 0.00 O ATOM 1466 CB PHE A 100 -12.159 -2.261 -8.311 1.00 0.00 C ATOM 1467 CG PHE A 100 -11.569 -2.772 -9.594 1.00 0.00 C ATOM 1468 CD1 PHE A 100 -10.196 -2.798 -9.779 1.00 0.00 C ATOM 1469 CD2 PHE A 100 -12.387 -3.225 -10.616 1.00 0.00 C ATOM 1470 CE1 PHE A 100 -9.650 -3.268 -10.958 1.00 0.00 C ATOM 1471 CE2 PHE A 100 -11.847 -3.696 -11.798 1.00 0.00 C ATOM 1472 CZ PHE A 100 -10.477 -3.717 -11.969 1.00 0.00 C ATOM 0 H PHE A 100 -10.297 -0.499 -7.815 1.00 0.00 H new ATOM 0 HA PHE A 100 -12.936 -0.430 -9.128 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -11.522 -2.566 -7.481 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -13.131 -2.729 -8.155 1.00 0.00 H new ATOM 0 HD1 PHE A 100 -9.545 -2.447 -8.992 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -13.459 -3.210 -10.488 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -8.578 -3.284 -11.089 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -12.496 -4.047 -12.587 1.00 0.00 H new ATOM 0 HZ PHE A 100 -10.053 -4.084 -12.892 1.00 0.00 H new ATOM 1482 N ASP A 101 -14.177 0.344 -7.147 1.00 0.00 N ATOM 1483 CA ASP A 101 -14.955 0.799 -6.000 1.00 0.00 C ATOM 1484 C ASP A 101 -15.561 -0.383 -5.250 1.00 0.00 C ATOM 1485 O ASP A 101 -16.406 -1.102 -5.782 1.00 0.00 O ATOM 1486 CB ASP A 101 -16.061 1.753 -6.454 1.00 0.00 C ATOM 1487 CG ASP A 101 -15.706 3.207 -6.216 1.00 0.00 C ATOM 1488 OD1 ASP A 101 -14.605 3.624 -6.632 1.00 0.00 O ATOM 1489 OD2 ASP A 101 -16.528 3.928 -5.613 1.00 0.00 O ATOM 0 H ASP A 101 -14.582 0.582 -8.053 1.00 0.00 H new ATOM 0 HA ASP A 101 -14.284 1.328 -5.324 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -16.256 1.599 -7.515 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -16.982 1.515 -5.922 1.00 0.00 H new ATOM 1494 N VAL A 102 -15.122 -0.578 -4.010 1.00 0.00 N ATOM 1495 CA VAL A 102 -15.621 -1.673 -3.187 1.00 0.00 C ATOM 1496 C VAL A 102 -16.646 -1.176 -2.174 1.00 0.00 C ATOM 1497 O VAL A 102 -16.461 -0.131 -1.551 1.00 0.00 O ATOM 1498 CB VAL A 102 -14.475 -2.378 -2.437 1.00 0.00 C ATOM 1499 CG1 VAL A 102 -15.020 -3.485 -1.547 1.00 0.00 C ATOM 1500 CG2 VAL A 102 -13.453 -2.928 -3.421 1.00 0.00 C ATOM 0 H VAL A 102 -14.422 0.008 -3.554 1.00 0.00 H new ATOM 0 HA VAL A 102 -16.097 -2.385 -3.862 1.00 0.00 H new ATOM 0 HB VAL A 102 -13.976 -1.646 -1.801 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -14.196 -3.971 -1.025 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -15.710 -3.059 -0.818 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -15.545 -4.218 -2.159 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -12.651 -3.423 -2.874 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -13.936 -3.646 -4.084 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -13.039 -2.110 -4.011 1.00 0.00 H new ATOM 1510 N GLU A 103 -17.728 -1.932 -2.016 1.00 0.00 N ATOM 1511 CA GLU A 103 -18.784 -1.567 -1.078 1.00 0.00 C ATOM 1512 C GLU A 103 -19.160 -2.753 -0.195 1.00 0.00 C ATOM 1513 O GLU A 103 -19.861 -3.667 -0.629 1.00 0.00 O ATOM 1514 CB GLU A 103 -20.017 -1.067 -1.834 1.00 0.00 C ATOM 1515 CG GLU A 103 -21.237 -0.875 -0.948 1.00 0.00 C ATOM 1516 CD GLU A 103 -21.067 0.263 0.040 1.00 0.00 C ATOM 1517 OE1 GLU A 103 -20.137 0.193 0.870 1.00 0.00 O ATOM 1518 OE2 GLU A 103 -21.864 1.222 -0.017 1.00 0.00 O ATOM 0 H GLU A 103 -17.896 -2.800 -2.525 1.00 0.00 H new ATOM 0 HA GLU A 103 -18.409 -0.766 -0.440 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -19.777 -0.120 -2.318 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -20.261 -1.776 -2.625 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -22.109 -0.681 -1.573 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -21.434 -1.798 -0.403 1.00 0.00 H new ATOM 1525 N LEU A 104 -18.690 -2.730 1.047 1.00 0.00 N ATOM 1526 CA LEU A 104 -18.976 -3.803 1.994 1.00 0.00 C ATOM 1527 C LEU A 104 -20.464 -3.855 2.323 1.00 0.00 C ATOM 1528 O LEU A 104 -21.063 -2.848 2.702 1.00 0.00 O ATOM 1529 CB LEU A 104 -18.165 -3.609 3.276 1.00 0.00 C ATOM 1530 CG LEU A 104 -17.747 -4.886 4.006 1.00 0.00 C ATOM 1531 CD1 LEU A 104 -18.875 -5.906 3.985 1.00 0.00 C ATOM 1532 CD2 LEU A 104 -16.487 -5.469 3.383 1.00 0.00 C ATOM 0 H LEU A 104 -18.109 -1.980 1.422 1.00 0.00 H new ATOM 0 HA LEU A 104 -18.691 -4.748 1.532 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -17.266 -3.044 3.031 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -18.750 -2.997 3.963 1.00 0.00 H new ATOM 0 HG LEU A 104 -17.531 -4.634 5.044 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -18.560 -6.808 4.509 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -19.753 -5.488 4.478 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -19.122 -6.154 2.953 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -16.205 -6.377 3.915 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -16.675 -5.706 2.336 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -15.678 -4.742 3.451 1.00 0.00 H new ATOM 1544 N LEU A 105 -21.056 -5.036 2.179 1.00 0.00 N ATOM 1545 CA LEU A 105 -22.474 -5.222 2.463 1.00 0.00 C ATOM 1546 C LEU A 105 -22.673 -6.148 3.659 1.00 0.00 C ATOM 1547 O LEU A 105 -23.435 -5.840 4.575 1.00 0.00 O ATOM 1548 CB LEU A 105 -23.190 -5.791 1.238 1.00 0.00 C ATOM 1549 CG LEU A 105 -23.812 -4.767 0.287 1.00 0.00 C ATOM 1550 CD1 LEU A 105 -22.730 -4.024 -0.479 1.00 0.00 C ATOM 1551 CD2 LEU A 105 -24.777 -5.448 -0.673 1.00 0.00 C ATOM 0 H LEU A 105 -20.575 -5.880 1.867 1.00 0.00 H new ATOM 0 HA LEU A 105 -22.901 -4.249 2.705 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -22.479 -6.395 0.675 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -23.977 -6.463 1.581 1.00 0.00 H new ATOM 0 HG LEU A 105 -24.371 -4.042 0.879 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -23.192 -3.300 -1.150 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -22.079 -3.504 0.223 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -22.142 -4.735 -1.060 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -25.210 -4.704 -1.342 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -24.241 -6.195 -1.259 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -25.572 -5.933 -0.107 1.00 0.00 H new ATOM 1563 N ARG A 106 -21.982 -7.282 3.643 1.00 0.00 N ATOM 1564 CA ARG A 106 -22.082 -8.253 4.726 1.00 0.00 C ATOM 1565 C ARG A 106 -20.721 -8.874 5.028 1.00 0.00 C ATOM 1566 O ARG A 106 -19.791 -8.776 4.227 1.00 0.00 O ATOM 1567 CB ARG A 106 -23.086 -9.350 4.366 1.00 0.00 C ATOM 1568 CG ARG A 106 -24.465 -8.820 4.010 1.00 0.00 C ATOM 1569 CD ARG A 106 -24.693 -8.825 2.507 1.00 0.00 C ATOM 1570 NE ARG A 106 -25.889 -8.076 2.132 1.00 0.00 N ATOM 1571 CZ ARG A 106 -27.126 -8.493 2.378 1.00 0.00 C ATOM 1572 NH1 ARG A 106 -27.328 -9.649 2.997 1.00 0.00 N ATOM 1573 NH2 ARG A 106 -28.163 -7.755 2.006 1.00 0.00 N ATOM 0 H ARG A 106 -21.347 -7.552 2.892 1.00 0.00 H new ATOM 0 HA ARG A 106 -22.429 -7.730 5.617 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -22.698 -9.924 3.524 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -23.176 -10.038 5.206 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -25.227 -9.429 4.497 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -24.576 -7.805 4.392 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -23.825 -8.395 2.007 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -24.785 -9.853 2.158 1.00 0.00 H new ATOM 0 HE ARG A 106 -25.768 -7.183 1.655 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -26.533 -10.219 3.285 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -28.279 -9.968 3.185 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -28.011 -6.866 1.530 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -29.112 -8.077 2.196 1.00 0.00 H new ATOM 1587 N VAL A 107 -20.611 -9.512 6.189 1.00 0.00 N ATOM 1588 CA VAL A 107 -19.364 -10.149 6.596 1.00 0.00 C ATOM 1589 C VAL A 107 -19.626 -11.503 7.246 1.00 0.00 C ATOM 1590 O VAL A 107 -20.498 -11.631 8.105 1.00 0.00 O ATOM 1591 CB VAL A 107 -18.577 -9.263 7.580 1.00 0.00 C ATOM 1592 CG1 VAL A 107 -19.353 -9.083 8.875 1.00 0.00 C ATOM 1593 CG2 VAL A 107 -17.203 -9.859 7.850 1.00 0.00 C ATOM 0 H VAL A 107 -21.370 -9.601 6.864 1.00 0.00 H new ATOM 0 HA VAL A 107 -18.771 -10.291 5.693 1.00 0.00 H new ATOM 0 HB VAL A 107 -18.440 -8.281 7.128 1.00 0.00 H new ATOM 0 HG11 VAL A 107 -18.781 -8.454 9.557 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -20.311 -8.609 8.662 1.00 0.00 H new ATOM 0 HG13 VAL A 107 -19.524 -10.056 9.335 1.00 0.00 H new ATOM 0 HG21 VAL A 107 -16.660 -9.221 8.547 1.00 0.00 H new ATOM 0 HG22 VAL A 107 -17.316 -10.854 8.281 1.00 0.00 H new ATOM 0 HG23 VAL A 107 -16.647 -9.930 6.915 1.00 0.00 H new ATOM 1603 N GLU A 108 -18.864 -12.510 6.830 1.00 0.00 N ATOM 1604 CA GLU A 108 -19.015 -13.855 7.372 1.00 0.00 C ATOM 1605 C GLU A 108 -17.655 -14.523 7.556 1.00 0.00 C ATOM 1606 O GLU A 108 -17.266 -15.387 6.771 1.00 0.00 O ATOM 1607 CB GLU A 108 -19.892 -14.705 6.451 1.00 0.00 C ATOM 1608 CG GLU A 108 -21.303 -14.165 6.285 1.00 0.00 C ATOM 1609 CD GLU A 108 -22.206 -14.525 7.449 1.00 0.00 C ATOM 1610 OE1 GLU A 108 -22.366 -15.733 7.723 1.00 0.00 O ATOM 1611 OE2 GLU A 108 -22.753 -13.600 8.085 1.00 0.00 O ATOM 0 H GLU A 108 -18.137 -12.420 6.120 1.00 0.00 H new ATOM 0 HA GLU A 108 -19.496 -13.774 8.347 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -19.419 -14.770 5.471 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -19.944 -15.719 6.847 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -21.263 -13.081 6.183 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -21.732 -14.557 5.363 1.00 0.00 H new