USER MOD reduce.3.24.130724 H: found=0, std=0, add=797, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 795 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot -52:sc= 0.409 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 13 SER OG : rot 180:sc= -1.04 USER MOD Single : A 17 LYS NZ :NH3+ -134:sc= 1.29 (180deg=-0.787) USER MOD Single : A 23 LYS NZ :NH3+ -112:sc= -1.01 (180deg=-4.36!) USER MOD Single : A 25 CYS SG : rot 180:sc= 0.0401 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 35 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 GLN : amide:sc= -1.61 K(o=-1.6,f=-0.12) USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 SER OG : rot 180:sc=-0.00243 USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 60 SER OG : rot -52:sc= -1.93! USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 73 ASN : amide:sc= -6.8! C(o=-6.8!,f=-11!) USER MOD Single : A 75 TYR OH : rot 180:sc= 0 USER MOD Single : A 76 CYS SG : rot 180:sc= 0 USER MOD Single : A 79 ASN : amide:sc= 0 X(o=0,f=-0.16) USER MOD Single : A 80 THR OG1 : rot -130:sc= -1.25 USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 HIS : no HD1:sc= -0.613 K(o=-0.61,f=-1.2) USER MOD Single : A 102 CYS SG : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 180:sc= -0.0117 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -3.708 -17.461 -22.311 1.00 0.00 N ATOM 2 CA GLY A 1 -5.089 -17.285 -21.902 1.00 0.00 C ATOM 3 C GLY A 1 -5.230 -17.089 -20.406 1.00 0.00 C ATOM 4 O GLY A 1 -5.647 -18.000 -19.690 1.00 0.00 O ATOM 0 H1 GLY A 1 -3.665 -17.591 -23.342 1.00 0.00 H new ATOM 0 H2 GLY A 1 -3.157 -16.620 -22.045 1.00 0.00 H new ATOM 0 H3 GLY A 1 -3.310 -18.298 -21.840 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -5.511 -16.423 -22.420 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -5.669 -18.156 -22.207 1.00 0.00 H new ATOM 8 N SER A 2 -4.880 -15.898 -19.930 1.00 0.00 N ATOM 9 CA SER A 2 -4.964 -15.588 -18.508 1.00 0.00 C ATOM 10 C SER A 2 -6.337 -15.024 -18.156 1.00 0.00 C ATOM 11 O SER A 2 -6.767 -14.013 -18.712 1.00 0.00 O ATOM 12 CB SER A 2 -3.874 -14.589 -18.117 1.00 0.00 C ATOM 13 OG SER A 2 -3.647 -14.603 -16.718 1.00 0.00 O ATOM 0 H SER A 2 -4.536 -15.132 -20.509 1.00 0.00 H new ATOM 0 HA SER A 2 -4.816 -16.513 -17.950 1.00 0.00 H new ATOM 0 HB2 SER A 2 -2.949 -14.831 -18.641 1.00 0.00 H new ATOM 0 HB3 SER A 2 -4.165 -13.587 -18.431 1.00 0.00 H new ATOM 0 HG SER A 2 -2.945 -13.957 -16.494 1.00 0.00 H new ATOM 19 N SER A 3 -7.021 -15.685 -17.227 1.00 0.00 N ATOM 20 CA SER A 3 -8.347 -15.253 -16.802 1.00 0.00 C ATOM 21 C SER A 3 -8.401 -15.074 -15.288 1.00 0.00 C ATOM 22 O SER A 3 -8.535 -16.044 -14.542 1.00 0.00 O ATOM 23 CB SER A 3 -9.404 -16.266 -17.246 1.00 0.00 C ATOM 24 OG SER A 3 -9.671 -16.151 -18.633 1.00 0.00 O ATOM 0 H SER A 3 -6.678 -16.522 -16.755 1.00 0.00 H new ATOM 0 HA SER A 3 -8.556 -14.292 -17.271 1.00 0.00 H new ATOM 0 HB2 SER A 3 -9.061 -17.276 -17.021 1.00 0.00 H new ATOM 0 HB3 SER A 3 -10.323 -16.108 -16.681 1.00 0.00 H new ATOM 0 HG SER A 3 -10.348 -16.810 -18.892 1.00 0.00 H new ATOM 30 N GLY A 4 -8.296 -13.827 -14.841 1.00 0.00 N ATOM 31 CA GLY A 4 -8.334 -13.543 -13.418 1.00 0.00 C ATOM 32 C GLY A 4 -9.719 -13.149 -12.943 1.00 0.00 C ATOM 33 O GLY A 4 -10.641 -13.964 -12.953 1.00 0.00 O ATOM 0 H GLY A 4 -8.185 -13.008 -15.439 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -8.000 -14.422 -12.866 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -7.633 -12.739 -13.192 1.00 0.00 H new ATOM 37 N SER A 5 -9.865 -11.896 -12.523 1.00 0.00 N ATOM 38 CA SER A 5 -11.146 -11.398 -12.037 1.00 0.00 C ATOM 39 C SER A 5 -11.540 -12.091 -10.736 1.00 0.00 C ATOM 40 O SER A 5 -12.700 -12.452 -10.539 1.00 0.00 O ATOM 41 CB SER A 5 -12.234 -11.610 -13.091 1.00 0.00 C ATOM 42 OG SER A 5 -13.434 -10.951 -12.726 1.00 0.00 O ATOM 0 H SER A 5 -9.112 -11.208 -12.510 1.00 0.00 H new ATOM 0 HA SER A 5 -11.042 -10.330 -11.843 1.00 0.00 H new ATOM 0 HB2 SER A 5 -11.889 -11.236 -14.055 1.00 0.00 H new ATOM 0 HB3 SER A 5 -12.424 -12.676 -13.213 1.00 0.00 H new ATOM 0 HG SER A 5 -13.688 -11.214 -11.817 1.00 0.00 H new ATOM 48 N SER A 6 -10.565 -12.274 -9.851 1.00 0.00 N ATOM 49 CA SER A 6 -10.808 -12.927 -8.570 1.00 0.00 C ATOM 50 C SER A 6 -9.793 -12.470 -7.527 1.00 0.00 C ATOM 51 O SER A 6 -8.587 -12.492 -7.766 1.00 0.00 O ATOM 52 CB SER A 6 -10.743 -14.447 -8.729 1.00 0.00 C ATOM 53 OG SER A 6 -10.748 -15.093 -7.467 1.00 0.00 O ATOM 0 H SER A 6 -9.600 -11.979 -9.998 1.00 0.00 H new ATOM 0 HA SER A 6 -11.805 -12.646 -8.230 1.00 0.00 H new ATOM 0 HB2 SER A 6 -11.592 -14.791 -9.320 1.00 0.00 H new ATOM 0 HB3 SER A 6 -9.841 -14.720 -9.277 1.00 0.00 H new ATOM 0 HG SER A 6 -10.707 -16.064 -7.596 1.00 0.00 H new ATOM 59 N GLY A 7 -10.293 -12.055 -6.367 1.00 0.00 N ATOM 60 CA GLY A 7 -9.419 -11.597 -5.303 1.00 0.00 C ATOM 61 C GLY A 7 -9.564 -10.113 -5.030 1.00 0.00 C ATOM 62 O GLY A 7 -9.087 -9.285 -5.805 1.00 0.00 O ATOM 0 H GLY A 7 -11.288 -12.028 -6.145 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -9.639 -12.154 -4.392 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -8.384 -11.815 -5.568 1.00 0.00 H new ATOM 66 N GLU A 8 -10.225 -9.778 -3.927 1.00 0.00 N ATOM 67 CA GLU A 8 -10.433 -8.383 -3.557 1.00 0.00 C ATOM 68 C GLU A 8 -9.895 -8.105 -2.156 1.00 0.00 C ATOM 69 O GLU A 8 -10.042 -8.924 -1.248 1.00 0.00 O ATOM 70 CB GLU A 8 -11.921 -8.031 -3.622 1.00 0.00 C ATOM 71 CG GLU A 8 -12.422 -7.760 -5.030 1.00 0.00 C ATOM 72 CD GLU A 8 -13.835 -7.212 -5.052 1.00 0.00 C ATOM 73 OE1 GLU A 8 -14.145 -6.336 -4.218 1.00 0.00 O ATOM 74 OE2 GLU A 8 -14.632 -7.659 -5.903 1.00 0.00 O ATOM 0 H GLU A 8 -10.625 -10.452 -3.275 1.00 0.00 H new ATOM 0 HA GLU A 8 -9.888 -7.761 -4.267 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -12.498 -8.849 -3.191 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -12.105 -7.152 -3.005 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -11.754 -7.051 -5.519 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -12.386 -8.683 -5.608 1.00 0.00 H new ATOM 81 N LEU A 9 -9.269 -6.945 -1.989 1.00 0.00 N ATOM 82 CA LEU A 9 -8.707 -6.558 -0.699 1.00 0.00 C ATOM 83 C LEU A 9 -9.680 -5.675 0.075 1.00 0.00 C ATOM 84 O LEU A 9 -10.383 -4.850 -0.507 1.00 0.00 O ATOM 85 CB LEU A 9 -7.381 -5.823 -0.899 1.00 0.00 C ATOM 86 CG LEU A 9 -6.126 -6.697 -0.919 1.00 0.00 C ATOM 87 CD1 LEU A 9 -4.915 -5.882 -1.348 1.00 0.00 C ATOM 88 CD2 LEU A 9 -5.891 -7.324 0.448 1.00 0.00 C ATOM 0 H LEU A 9 -9.138 -6.256 -2.730 1.00 0.00 H new ATOM 0 HA LEU A 9 -8.529 -7.464 -0.120 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -7.432 -5.273 -1.839 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -7.274 -5.086 -0.103 1.00 0.00 H new ATOM 0 HG LEU A 9 -6.275 -7.498 -1.643 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -4.031 -6.520 -1.356 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -5.082 -5.480 -2.347 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -4.763 -5.061 -0.648 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -4.994 -7.942 0.415 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -5.763 -6.538 1.192 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -6.748 -7.942 0.717 1.00 0.00 H new ATOM 100 N ALA A 10 -9.712 -5.852 1.392 1.00 0.00 N ATOM 101 CA ALA A 10 -10.594 -5.068 2.247 1.00 0.00 C ATOM 102 C ALA A 10 -9.801 -4.080 3.096 1.00 0.00 C ATOM 103 O ALA A 10 -10.286 -2.995 3.419 1.00 0.00 O ATOM 104 CB ALA A 10 -11.420 -5.986 3.136 1.00 0.00 C ATOM 0 H ALA A 10 -9.137 -6.532 1.890 1.00 0.00 H new ATOM 0 HA ALA A 10 -11.267 -4.498 1.607 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -12.074 -5.387 3.769 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -12.023 -6.648 2.515 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -10.755 -6.581 3.762 1.00 0.00 H new ATOM 110 N LEU A 11 -8.581 -4.462 3.455 1.00 0.00 N ATOM 111 CA LEU A 11 -7.720 -3.610 4.267 1.00 0.00 C ATOM 112 C LEU A 11 -7.445 -2.285 3.564 1.00 0.00 C ATOM 113 O LEU A 11 -7.355 -1.238 4.205 1.00 0.00 O ATOM 114 CB LEU A 11 -6.401 -4.323 4.569 1.00 0.00 C ATOM 115 CG LEU A 11 -6.405 -5.260 5.777 1.00 0.00 C ATOM 116 CD1 LEU A 11 -5.110 -6.055 5.841 1.00 0.00 C ATOM 117 CD2 LEU A 11 -6.613 -4.472 7.062 1.00 0.00 C ATOM 0 H LEU A 11 -8.165 -5.357 3.196 1.00 0.00 H new ATOM 0 HA LEU A 11 -8.237 -3.403 5.204 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -6.113 -4.898 3.689 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -5.630 -3.568 4.723 1.00 0.00 H new ATOM 0 HG LEU A 11 -7.232 -5.961 5.666 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -5.131 -6.716 6.707 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -5.003 -6.649 4.934 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -4.267 -5.370 5.928 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -6.613 -5.155 7.912 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -5.807 -3.747 7.179 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -7.568 -3.948 7.017 1.00 0.00 H new ATOM 129 N TRP A 12 -7.316 -2.338 2.243 1.00 0.00 N ATOM 130 CA TRP A 12 -7.055 -1.141 1.452 1.00 0.00 C ATOM 131 C TRP A 12 -8.161 -0.912 0.428 1.00 0.00 C ATOM 132 O TRP A 12 -9.124 -1.676 0.361 1.00 0.00 O ATOM 133 CB TRP A 12 -5.703 -1.257 0.745 1.00 0.00 C ATOM 134 CG TRP A 12 -4.577 -1.605 1.670 1.00 0.00 C ATOM 135 CD1 TRP A 12 -3.750 -0.734 2.319 1.00 0.00 C ATOM 136 CD2 TRP A 12 -4.153 -2.920 2.047 1.00 0.00 C ATOM 137 NE1 TRP A 12 -2.837 -1.427 3.077 1.00 0.00 N ATOM 138 CE2 TRP A 12 -3.064 -2.770 2.928 1.00 0.00 C ATOM 139 CE3 TRP A 12 -4.588 -4.209 1.728 1.00 0.00 C ATOM 140 CZ2 TRP A 12 -2.406 -3.860 3.490 1.00 0.00 C ATOM 141 CZ3 TRP A 12 -3.934 -5.290 2.287 1.00 0.00 C ATOM 142 CH2 TRP A 12 -2.853 -5.111 3.160 1.00 0.00 C ATOM 0 H TRP A 12 -7.388 -3.197 1.697 1.00 0.00 H new ATOM 0 HA TRP A 12 -7.031 -0.287 2.129 1.00 0.00 H new ATOM 0 HB2 TRP A 12 -5.772 -2.017 -0.033 1.00 0.00 H new ATOM 0 HB3 TRP A 12 -5.478 -0.313 0.250 1.00 0.00 H new ATOM 0 HD1 TRP A 12 -3.805 0.342 2.247 1.00 0.00 H new ATOM 0 HE1 TRP A 12 -2.109 -1.009 3.656 1.00 0.00 H new ATOM 0 HE3 TRP A 12 -5.421 -4.358 1.056 1.00 0.00 H new ATOM 0 HZ2 TRP A 12 -1.572 -3.724 4.163 1.00 0.00 H new ATOM 0 HZ3 TRP A 12 -4.262 -6.291 2.047 1.00 0.00 H new ATOM 0 HH2 TRP A 12 -2.363 -5.977 3.581 1.00 0.00 H new ATOM 153 N SER A 13 -8.015 0.142 -0.369 1.00 0.00 N ATOM 154 CA SER A 13 -9.005 0.472 -1.388 1.00 0.00 C ATOM 155 C SER A 13 -8.512 0.068 -2.774 1.00 0.00 C ATOM 156 O SER A 13 -7.332 0.191 -3.101 1.00 0.00 O ATOM 157 CB SER A 13 -9.316 1.970 -1.361 1.00 0.00 C ATOM 158 OG SER A 13 -10.537 2.249 -2.023 1.00 0.00 O ATOM 0 H SER A 13 -7.221 0.782 -0.329 1.00 0.00 H new ATOM 0 HA SER A 13 -9.916 -0.085 -1.169 1.00 0.00 H new ATOM 0 HB2 SER A 13 -9.372 2.315 -0.328 1.00 0.00 H new ATOM 0 HB3 SER A 13 -8.506 2.522 -1.838 1.00 0.00 H new ATOM 0 HG SER A 13 -10.714 3.212 -1.990 1.00 0.00 H new ATOM 164 N PRO A 14 -9.438 -0.426 -3.609 1.00 0.00 N ATOM 165 CA PRO A 14 -9.123 -0.857 -4.974 1.00 0.00 C ATOM 166 C PRO A 14 -8.782 0.314 -5.889 1.00 0.00 C ATOM 167 O PRO A 14 -8.536 0.131 -7.080 1.00 0.00 O ATOM 168 CB PRO A 14 -10.413 -1.539 -5.437 1.00 0.00 C ATOM 169 CG PRO A 14 -11.488 -0.912 -4.618 1.00 0.00 C ATOM 170 CD PRO A 14 -10.864 -0.600 -3.286 1.00 0.00 C ATOM 0 HA PRO A 14 -8.247 -1.505 -5.004 1.00 0.00 H new ATOM 0 HB2 PRO A 14 -10.584 -1.381 -6.502 1.00 0.00 H new ATOM 0 HB3 PRO A 14 -10.371 -2.616 -5.277 1.00 0.00 H new ATOM 0 HG2 PRO A 14 -11.864 -0.007 -5.095 1.00 0.00 H new ATOM 0 HG3 PRO A 14 -12.336 -1.588 -4.503 1.00 0.00 H new ATOM 0 HD2 PRO A 14 -11.289 0.302 -2.845 1.00 0.00 H new ATOM 0 HD3 PRO A 14 -11.018 -1.408 -2.571 1.00 0.00 H new ATOM 178 N GLU A 15 -8.768 1.517 -5.322 1.00 0.00 N ATOM 179 CA GLU A 15 -8.456 2.718 -6.088 1.00 0.00 C ATOM 180 C GLU A 15 -7.094 3.278 -5.691 1.00 0.00 C ATOM 181 O GLU A 15 -6.968 3.985 -4.691 1.00 0.00 O ATOM 182 CB GLU A 15 -9.538 3.779 -5.877 1.00 0.00 C ATOM 183 CG GLU A 15 -9.594 4.316 -4.456 1.00 0.00 C ATOM 184 CD GLU A 15 -10.959 4.868 -4.095 1.00 0.00 C ATOM 185 OE1 GLU A 15 -11.965 4.365 -4.638 1.00 0.00 O ATOM 186 OE2 GLU A 15 -11.022 5.803 -3.270 1.00 0.00 O ATOM 0 H GLU A 15 -8.969 1.685 -4.336 1.00 0.00 H new ATOM 0 HA GLU A 15 -8.424 2.447 -7.143 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -9.362 4.607 -6.563 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -10.508 3.353 -6.134 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -9.333 3.519 -3.760 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -8.846 5.100 -4.338 1.00 0.00 H new ATOM 193 N VAL A 16 -6.075 2.957 -6.483 1.00 0.00 N ATOM 194 CA VAL A 16 -4.721 3.428 -6.215 1.00 0.00 C ATOM 195 C VAL A 16 -4.544 4.873 -6.665 1.00 0.00 C ATOM 196 O VAL A 16 -5.057 5.278 -7.709 1.00 0.00 O ATOM 197 CB VAL A 16 -3.672 2.549 -6.921 1.00 0.00 C ATOM 198 CG1 VAL A 16 -3.880 2.574 -8.428 1.00 0.00 C ATOM 199 CG2 VAL A 16 -2.266 3.006 -6.562 1.00 0.00 C ATOM 0 H VAL A 16 -6.162 2.373 -7.315 1.00 0.00 H new ATOM 0 HA VAL A 16 -4.570 3.365 -5.137 1.00 0.00 H new ATOM 0 HB VAL A 16 -3.795 1.522 -6.578 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -3.129 1.947 -8.909 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -4.874 2.196 -8.664 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -3.785 3.597 -8.791 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -1.537 2.374 -7.070 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -2.129 4.041 -6.875 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -2.123 2.931 -5.484 1.00 0.00 H new ATOM 209 N LYS A 17 -3.812 5.649 -5.872 1.00 0.00 N ATOM 210 CA LYS A 17 -3.564 7.050 -6.188 1.00 0.00 C ATOM 211 C LYS A 17 -2.072 7.312 -6.365 1.00 0.00 C ATOM 212 O LYS A 17 -1.255 6.871 -5.556 1.00 0.00 O ATOM 213 CB LYS A 17 -4.123 7.950 -5.084 1.00 0.00 C ATOM 214 CG LYS A 17 -3.674 7.551 -3.688 1.00 0.00 C ATOM 215 CD LYS A 17 -3.843 8.693 -2.700 1.00 0.00 C ATOM 216 CE LYS A 17 -3.481 8.264 -1.286 1.00 0.00 C ATOM 217 NZ LYS A 17 -2.023 8.408 -1.019 1.00 0.00 N ATOM 0 H LYS A 17 -3.380 5.330 -5.005 1.00 0.00 H new ATOM 0 HA LYS A 17 -4.069 7.280 -7.126 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -3.816 8.978 -5.275 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -5.212 7.929 -5.126 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -4.251 6.689 -3.352 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -2.629 7.244 -3.715 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -3.214 9.531 -3.000 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -4.874 9.045 -2.722 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -4.042 8.864 -0.570 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -3.777 7.226 -1.134 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -1.669 7.549 -0.551 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -1.518 8.546 -1.917 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -1.863 9.230 -0.402 1.00 0.00 H new ATOM 231 N ILE A 18 -1.724 8.032 -7.427 1.00 0.00 N ATOM 232 CA ILE A 18 -0.330 8.353 -7.707 1.00 0.00 C ATOM 233 C ILE A 18 0.083 9.651 -7.022 1.00 0.00 C ATOM 234 O ILE A 18 -0.469 10.716 -7.300 1.00 0.00 O ATOM 235 CB ILE A 18 -0.076 8.482 -9.221 1.00 0.00 C ATOM 236 CG1 ILE A 18 -0.494 7.198 -9.941 1.00 0.00 C ATOM 237 CG2 ILE A 18 1.390 8.791 -9.487 1.00 0.00 C ATOM 238 CD1 ILE A 18 0.405 6.018 -9.645 1.00 0.00 C ATOM 0 H ILE A 18 -2.388 8.403 -8.107 1.00 0.00 H new ATOM 0 HA ILE A 18 0.269 7.531 -7.314 1.00 0.00 H new ATOM 0 HB ILE A 18 -0.677 9.305 -9.607 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -1.515 6.947 -9.655 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -0.500 7.379 -11.016 1.00 0.00 H new ATOM 0 HG21 ILE A 18 1.554 8.879 -10.561 1.00 0.00 H new ATOM 0 HG22 ILE A 18 1.658 9.729 -9.001 1.00 0.00 H new ATOM 0 HG23 ILE A 18 2.009 7.986 -9.090 1.00 0.00 H new ATOM 0 HD11 ILE A 18 0.048 5.143 -10.189 1.00 0.00 H new ATOM 0 HD12 ILE A 18 1.423 6.249 -9.957 1.00 0.00 H new ATOM 0 HD13 ILE A 18 0.392 5.810 -8.575 1.00 0.00 H new ATOM 250 N VAL A 19 1.059 9.556 -6.125 1.00 0.00 N ATOM 251 CA VAL A 19 1.550 10.723 -5.401 1.00 0.00 C ATOM 252 C VAL A 19 2.882 11.201 -5.968 1.00 0.00 C ATOM 253 O VAL A 19 3.805 10.411 -6.159 1.00 0.00 O ATOM 254 CB VAL A 19 1.721 10.421 -3.900 1.00 0.00 C ATOM 255 CG1 VAL A 19 2.215 11.655 -3.161 1.00 0.00 C ATOM 256 CG2 VAL A 19 0.414 9.921 -3.305 1.00 0.00 C ATOM 0 H VAL A 19 1.526 8.682 -5.882 1.00 0.00 H new ATOM 0 HA VAL A 19 0.804 11.509 -5.523 1.00 0.00 H new ATOM 0 HB VAL A 19 2.468 9.636 -3.788 1.00 0.00 H new ATOM 0 HG11 VAL A 19 2.330 11.423 -2.102 1.00 0.00 H new ATOM 0 HG12 VAL A 19 3.176 11.964 -3.571 1.00 0.00 H new ATOM 0 HG13 VAL A 19 1.493 12.463 -3.279 1.00 0.00 H new ATOM 0 HG21 VAL A 19 0.553 9.713 -2.244 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -0.356 10.683 -3.427 1.00 0.00 H new ATOM 0 HG23 VAL A 19 0.107 9.009 -3.817 1.00 0.00 H new ATOM 266 N GLU A 20 2.973 12.500 -6.234 1.00 0.00 N ATOM 267 CA GLU A 20 4.193 13.084 -6.779 1.00 0.00 C ATOM 268 C GLU A 20 5.142 13.504 -5.661 1.00 0.00 C ATOM 269 O GLU A 20 4.925 14.516 -4.994 1.00 0.00 O ATOM 270 CB GLU A 20 3.859 14.290 -7.659 1.00 0.00 C ATOM 271 CG GLU A 20 3.630 13.934 -9.119 1.00 0.00 C ATOM 272 CD GLU A 20 3.067 15.092 -9.920 1.00 0.00 C ATOM 273 OE1 GLU A 20 2.317 15.905 -9.342 1.00 0.00 O ATOM 274 OE2 GLU A 20 3.377 15.184 -11.126 1.00 0.00 O ATOM 0 H GLU A 20 2.217 13.168 -6.081 1.00 0.00 H new ATOM 0 HA GLU A 20 4.688 12.326 -7.386 1.00 0.00 H new ATOM 0 HB2 GLU A 20 2.966 14.778 -7.268 1.00 0.00 H new ATOM 0 HB3 GLU A 20 4.672 15.013 -7.593 1.00 0.00 H new ATOM 0 HG2 GLU A 20 4.572 13.614 -9.563 1.00 0.00 H new ATOM 0 HG3 GLU A 20 2.945 13.088 -9.180 1.00 0.00 H new ATOM 281 N LEU A 21 6.195 12.719 -5.461 1.00 0.00 N ATOM 282 CA LEU A 21 7.179 13.007 -4.423 1.00 0.00 C ATOM 283 C LEU A 21 8.507 13.438 -5.036 1.00 0.00 C ATOM 284 O LEU A 21 9.041 12.769 -5.920 1.00 0.00 O ATOM 285 CB LEU A 21 7.388 11.779 -3.536 1.00 0.00 C ATOM 286 CG LEU A 21 6.330 11.541 -2.458 1.00 0.00 C ATOM 287 CD1 LEU A 21 6.848 10.572 -1.406 1.00 0.00 C ATOM 288 CD2 LEU A 21 5.918 12.858 -1.815 1.00 0.00 C ATOM 0 H LEU A 21 6.389 11.878 -6.004 1.00 0.00 H new ATOM 0 HA LEU A 21 6.798 13.827 -3.814 1.00 0.00 H new ATOM 0 HB2 LEU A 21 7.431 10.897 -4.175 1.00 0.00 H new ATOM 0 HB3 LEU A 21 8.359 11.868 -3.050 1.00 0.00 H new ATOM 0 HG LEU A 21 5.452 11.099 -2.929 1.00 0.00 H new ATOM 0 HD11 LEU A 21 6.081 10.415 -0.647 1.00 0.00 H new ATOM 0 HD12 LEU A 21 7.093 9.620 -1.877 1.00 0.00 H new ATOM 0 HD13 LEU A 21 7.742 10.986 -0.939 1.00 0.00 H new ATOM 0 HD21 LEU A 21 5.164 12.670 -1.050 1.00 0.00 H new ATOM 0 HD22 LEU A 21 6.789 13.328 -1.358 1.00 0.00 H new ATOM 0 HD23 LEU A 21 5.505 13.521 -2.576 1.00 0.00 H new ATOM 300 N VAL A 22 9.037 14.561 -4.560 1.00 0.00 N ATOM 301 CA VAL A 22 10.304 15.080 -5.059 1.00 0.00 C ATOM 302 C VAL A 22 11.475 14.558 -4.233 1.00 0.00 C ATOM 303 O VAL A 22 11.752 15.059 -3.143 1.00 0.00 O ATOM 304 CB VAL A 22 10.325 16.620 -5.044 1.00 0.00 C ATOM 305 CG1 VAL A 22 11.668 17.140 -5.534 1.00 0.00 C ATOM 306 CG2 VAL A 22 9.188 17.176 -5.887 1.00 0.00 C ATOM 0 H VAL A 22 8.608 15.128 -3.829 1.00 0.00 H new ATOM 0 HA VAL A 22 10.405 14.733 -6.087 1.00 0.00 H new ATOM 0 HB VAL A 22 10.184 16.959 -4.018 1.00 0.00 H new ATOM 0 HG11 VAL A 22 11.664 18.230 -5.517 1.00 0.00 H new ATOM 0 HG12 VAL A 22 12.461 16.769 -4.884 1.00 0.00 H new ATOM 0 HG13 VAL A 22 11.842 16.794 -6.553 1.00 0.00 H new ATOM 0 HG21 VAL A 22 9.218 18.265 -5.865 1.00 0.00 H new ATOM 0 HG22 VAL A 22 9.295 16.831 -6.915 1.00 0.00 H new ATOM 0 HG23 VAL A 22 8.235 16.831 -5.486 1.00 0.00 H new ATOM 316 N LYS A 23 12.160 13.549 -4.759 1.00 0.00 N ATOM 317 CA LYS A 23 13.303 12.959 -4.072 1.00 0.00 C ATOM 318 C LYS A 23 14.506 13.896 -4.113 1.00 0.00 C ATOM 319 O LYS A 23 14.670 14.670 -5.057 1.00 0.00 O ATOM 320 CB LYS A 23 13.668 11.615 -4.708 1.00 0.00 C ATOM 321 CG LYS A 23 14.977 11.037 -4.198 1.00 0.00 C ATOM 322 CD LYS A 23 15.333 9.745 -4.915 1.00 0.00 C ATOM 323 CE LYS A 23 16.839 9.548 -4.994 1.00 0.00 C ATOM 324 NZ LYS A 23 17.369 8.842 -3.795 1.00 0.00 N ATOM 0 H LYS A 23 11.944 13.122 -5.660 1.00 0.00 H new ATOM 0 HA LYS A 23 13.026 12.798 -3.030 1.00 0.00 H new ATOM 0 HB2 LYS A 23 12.866 10.902 -4.516 1.00 0.00 H new ATOM 0 HB3 LYS A 23 13.732 11.739 -5.789 1.00 0.00 H new ATOM 0 HG2 LYS A 23 15.776 11.764 -4.339 1.00 0.00 H new ATOM 0 HG3 LYS A 23 14.901 10.851 -3.127 1.00 0.00 H new ATOM 0 HD2 LYS A 23 14.882 8.902 -4.393 1.00 0.00 H new ATOM 0 HD3 LYS A 23 14.914 9.758 -5.921 1.00 0.00 H new ATOM 0 HE2 LYS A 23 17.084 8.977 -5.890 1.00 0.00 H new ATOM 0 HE3 LYS A 23 17.328 10.518 -5.090 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 17.958 9.495 -3.240 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 16.576 8.508 -3.210 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 17.943 8.029 -4.096 1.00 0.00 H new ATOM 338 N ASP A 24 15.344 13.821 -3.086 1.00 0.00 N ATOM 339 CA ASP A 24 16.534 14.661 -3.006 1.00 0.00 C ATOM 340 C ASP A 24 17.796 13.809 -2.927 1.00 0.00 C ATOM 341 O ASP A 24 17.729 12.579 -2.933 1.00 0.00 O ATOM 342 CB ASP A 24 16.450 15.586 -1.791 1.00 0.00 C ATOM 343 CG ASP A 24 15.289 16.556 -1.881 1.00 0.00 C ATOM 344 OD1 ASP A 24 14.138 16.093 -2.028 1.00 0.00 O ATOM 345 OD2 ASP A 24 15.530 17.779 -1.802 1.00 0.00 O ATOM 0 H ASP A 24 15.222 13.187 -2.296 1.00 0.00 H new ATOM 0 HA ASP A 24 16.583 15.267 -3.911 1.00 0.00 H new ATOM 0 HB2 ASP A 24 16.349 14.985 -0.887 1.00 0.00 H new ATOM 0 HB3 ASP A 24 17.381 16.146 -1.699 1.00 0.00 H new ATOM 350 N CYS A 25 18.946 14.470 -2.853 1.00 0.00 N ATOM 351 CA CYS A 25 20.225 13.773 -2.774 1.00 0.00 C ATOM 352 C CYS A 25 20.151 12.610 -1.790 1.00 0.00 C ATOM 353 O CYS A 25 20.492 11.476 -2.126 1.00 0.00 O ATOM 354 CB CYS A 25 21.332 14.742 -2.355 1.00 0.00 C ATOM 355 SG CYS A 25 21.508 16.176 -3.442 1.00 0.00 S ATOM 0 H CYS A 25 19.019 15.487 -2.846 1.00 0.00 H new ATOM 0 HA CYS A 25 20.455 13.375 -3.762 1.00 0.00 H new ATOM 0 HB2 CYS A 25 21.131 15.090 -1.342 1.00 0.00 H new ATOM 0 HB3 CYS A 25 22.279 14.204 -2.325 1.00 0.00 H new ATOM 0 HG CYS A 25 22.467 16.937 -3.004 1.00 0.00 H new ATOM 361 N LYS A 26 19.705 12.900 -0.573 1.00 0.00 N ATOM 362 CA LYS A 26 19.587 11.879 0.462 1.00 0.00 C ATOM 363 C LYS A 26 18.593 10.798 0.049 1.00 0.00 C ATOM 364 O LYS A 26 18.830 9.610 0.260 1.00 0.00 O ATOM 365 CB LYS A 26 19.147 12.513 1.784 1.00 0.00 C ATOM 366 CG LYS A 26 17.828 13.261 1.691 1.00 0.00 C ATOM 367 CD LYS A 26 17.300 13.634 3.066 1.00 0.00 C ATOM 368 CE LYS A 26 18.107 14.766 3.684 1.00 0.00 C ATOM 369 NZ LYS A 26 17.765 14.973 5.118 1.00 0.00 N ATOM 0 H LYS A 26 19.419 13.834 -0.279 1.00 0.00 H new ATOM 0 HA LYS A 26 20.565 11.417 0.595 1.00 0.00 H new ATOM 0 HB2 LYS A 26 19.060 11.733 2.540 1.00 0.00 H new ATOM 0 HB3 LYS A 26 19.922 13.201 2.123 1.00 0.00 H new ATOM 0 HG2 LYS A 26 17.962 14.163 1.095 1.00 0.00 H new ATOM 0 HG3 LYS A 26 17.094 12.643 1.174 1.00 0.00 H new ATOM 0 HD2 LYS A 26 16.254 13.932 2.987 1.00 0.00 H new ATOM 0 HD3 LYS A 26 17.335 12.762 3.719 1.00 0.00 H new ATOM 0 HE2 LYS A 26 19.171 14.546 3.593 1.00 0.00 H new ATOM 0 HE3 LYS A 26 17.924 15.687 3.130 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 18.336 15.753 5.502 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 16.756 15.208 5.204 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 17.964 14.103 5.651 1.00 0.00 H new ATOM 383 N GLY A 27 17.479 11.220 -0.543 1.00 0.00 N ATOM 384 CA GLY A 27 16.467 10.274 -0.978 1.00 0.00 C ATOM 385 C GLY A 27 15.081 10.644 -0.490 1.00 0.00 C ATOM 386 O GLY A 27 14.737 11.824 -0.408 1.00 0.00 O ATOM 0 H GLY A 27 17.260 12.199 -0.729 1.00 0.00 H new ATOM 0 HA2 GLY A 27 16.464 10.224 -2.067 1.00 0.00 H new ATOM 0 HA3 GLY A 27 16.724 9.279 -0.614 1.00 0.00 H new ATOM 390 N LEU A 28 14.281 9.634 -0.166 1.00 0.00 N ATOM 391 CA LEU A 28 12.922 9.858 0.315 1.00 0.00 C ATOM 392 C LEU A 28 12.920 10.188 1.804 1.00 0.00 C ATOM 393 O LEU A 28 13.971 10.242 2.440 1.00 0.00 O ATOM 394 CB LEU A 28 12.057 8.625 0.052 1.00 0.00 C ATOM 395 CG LEU A 28 11.604 8.418 -1.394 1.00 0.00 C ATOM 396 CD1 LEU A 28 11.109 9.727 -1.990 1.00 0.00 C ATOM 397 CD2 LEU A 28 12.737 7.843 -2.230 1.00 0.00 C ATOM 0 H LEU A 28 14.550 8.652 -0.228 1.00 0.00 H new ATOM 0 HA LEU A 28 12.506 10.707 -0.227 1.00 0.00 H new ATOM 0 HB2 LEU A 28 12.613 7.742 0.367 1.00 0.00 H new ATOM 0 HB3 LEU A 28 11.171 8.686 0.684 1.00 0.00 H new ATOM 0 HG LEU A 28 10.779 7.706 -1.399 1.00 0.00 H new ATOM 0 HD11 LEU A 28 10.791 9.561 -3.019 1.00 0.00 H new ATOM 0 HD12 LEU A 28 10.267 10.098 -1.405 1.00 0.00 H new ATOM 0 HD13 LEU A 28 11.914 10.462 -1.973 1.00 0.00 H new ATOM 0 HD21 LEU A 28 12.397 7.702 -3.256 1.00 0.00 H new ATOM 0 HD22 LEU A 28 13.583 8.531 -2.219 1.00 0.00 H new ATOM 0 HD23 LEU A 28 13.045 6.883 -1.815 1.00 0.00 H new ATOM 409 N GLY A 29 11.729 10.405 2.355 1.00 0.00 N ATOM 410 CA GLY A 29 11.612 10.724 3.766 1.00 0.00 C ATOM 411 C GLY A 29 10.617 9.832 4.482 1.00 0.00 C ATOM 412 O GLY A 29 9.997 10.242 5.463 1.00 0.00 O ATOM 0 H GLY A 29 10.844 10.366 1.850 1.00 0.00 H new ATOM 0 HA2 GLY A 29 12.589 10.626 4.240 1.00 0.00 H new ATOM 0 HA3 GLY A 29 11.307 11.765 3.876 1.00 0.00 H new ATOM 416 N PHE A 30 10.462 8.607 3.989 1.00 0.00 N ATOM 417 CA PHE A 30 9.533 7.655 4.586 1.00 0.00 C ATOM 418 C PHE A 30 10.156 6.264 4.664 1.00 0.00 C ATOM 419 O PHE A 30 11.271 6.044 4.193 1.00 0.00 O ATOM 420 CB PHE A 30 8.235 7.600 3.777 1.00 0.00 C ATOM 421 CG PHE A 30 8.451 7.328 2.316 1.00 0.00 C ATOM 422 CD1 PHE A 30 8.772 8.358 1.446 1.00 0.00 C ATOM 423 CD2 PHE A 30 8.333 6.043 1.812 1.00 0.00 C ATOM 424 CE1 PHE A 30 8.970 8.110 0.101 1.00 0.00 C ATOM 425 CE2 PHE A 30 8.530 5.789 0.467 1.00 0.00 C ATOM 426 CZ PHE A 30 8.850 6.824 -0.389 1.00 0.00 C ATOM 0 H PHE A 30 10.968 8.251 3.178 1.00 0.00 H new ATOM 0 HA PHE A 30 9.308 7.991 5.598 1.00 0.00 H new ATOM 0 HB2 PHE A 30 7.590 6.825 4.191 1.00 0.00 H new ATOM 0 HB3 PHE A 30 7.707 8.547 3.888 1.00 0.00 H new ATOM 0 HD1 PHE A 30 8.868 9.365 1.823 1.00 0.00 H new ATOM 0 HD2 PHE A 30 8.084 5.230 2.478 1.00 0.00 H new ATOM 0 HE1 PHE A 30 9.219 8.921 -0.567 1.00 0.00 H new ATOM 0 HE2 PHE A 30 8.434 4.783 0.087 1.00 0.00 H new ATOM 0 HZ PHE A 30 9.006 6.629 -1.440 1.00 0.00 H new ATOM 436 N SER A 31 9.426 5.329 5.264 1.00 0.00 N ATOM 437 CA SER A 31 9.908 3.960 5.409 1.00 0.00 C ATOM 438 C SER A 31 8.857 2.961 4.932 1.00 0.00 C ATOM 439 O SER A 31 7.711 3.327 4.673 1.00 0.00 O ATOM 440 CB SER A 31 10.272 3.677 6.868 1.00 0.00 C ATOM 441 OG SER A 31 11.551 4.200 7.184 1.00 0.00 O ATOM 0 H SER A 31 8.499 5.494 5.657 1.00 0.00 H new ATOM 0 HA SER A 31 10.799 3.847 4.791 1.00 0.00 H new ATOM 0 HB2 SER A 31 9.523 4.118 7.525 1.00 0.00 H new ATOM 0 HB3 SER A 31 10.261 2.602 7.047 1.00 0.00 H new ATOM 0 HG SER A 31 11.760 4.008 8.122 1.00 0.00 H new ATOM 447 N ILE A 32 9.258 1.699 4.820 1.00 0.00 N ATOM 448 CA ILE A 32 8.352 0.647 4.376 1.00 0.00 C ATOM 449 C ILE A 32 8.595 -0.648 5.144 1.00 0.00 C ATOM 450 O ILE A 32 9.681 -0.869 5.681 1.00 0.00 O ATOM 451 CB ILE A 32 8.503 0.374 2.868 1.00 0.00 C ATOM 452 CG1 ILE A 32 9.962 0.546 2.440 1.00 0.00 C ATOM 453 CG2 ILE A 32 7.598 1.299 2.069 1.00 0.00 C ATOM 454 CD1 ILE A 32 10.346 -0.302 1.248 1.00 0.00 C ATOM 0 H ILE A 32 10.204 1.380 5.031 1.00 0.00 H new ATOM 0 HA ILE A 32 7.339 0.998 4.573 1.00 0.00 H new ATOM 0 HB ILE A 32 8.205 -0.655 2.668 1.00 0.00 H new ATOM 0 HG12 ILE A 32 10.141 1.595 2.202 1.00 0.00 H new ATOM 0 HG13 ILE A 32 10.610 0.294 3.279 1.00 0.00 H new ATOM 0 HG21 ILE A 32 7.716 1.094 1.005 1.00 0.00 H new ATOM 0 HG22 ILE A 32 6.560 1.132 2.358 1.00 0.00 H new ATOM 0 HG23 ILE A 32 7.868 2.336 2.271 1.00 0.00 H new ATOM 0 HD11 ILE A 32 11.393 -0.129 1.001 1.00 0.00 H new ATOM 0 HD12 ILE A 32 10.199 -1.355 1.488 1.00 0.00 H new ATOM 0 HD13 ILE A 32 9.723 -0.034 0.395 1.00 0.00 H new ATOM 466 N LEU A 33 7.579 -1.502 5.189 1.00 0.00 N ATOM 467 CA LEU A 33 7.682 -2.778 5.889 1.00 0.00 C ATOM 468 C LEU A 33 6.938 -3.875 5.135 1.00 0.00 C ATOM 469 O LEU A 33 6.245 -3.606 4.153 1.00 0.00 O ATOM 470 CB LEU A 33 7.124 -2.650 7.308 1.00 0.00 C ATOM 471 CG LEU A 33 5.634 -2.949 7.473 1.00 0.00 C ATOM 472 CD1 LEU A 33 5.278 -3.092 8.944 1.00 0.00 C ATOM 473 CD2 LEU A 33 4.796 -1.858 6.822 1.00 0.00 C ATOM 0 H LEU A 33 6.674 -1.334 4.749 1.00 0.00 H new ATOM 0 HA LEU A 33 8.736 -3.051 5.942 1.00 0.00 H new ATOM 0 HB2 LEU A 33 7.683 -3.322 7.959 1.00 0.00 H new ATOM 0 HB3 LEU A 33 7.312 -1.636 7.661 1.00 0.00 H new ATOM 0 HG LEU A 33 5.415 -3.893 6.975 1.00 0.00 H new ATOM 0 HD11 LEU A 33 4.213 -3.305 9.042 1.00 0.00 H new ATOM 0 HD12 LEU A 33 5.853 -3.909 9.380 1.00 0.00 H new ATOM 0 HD13 LEU A 33 5.512 -2.165 9.467 1.00 0.00 H new ATOM 0 HD21 LEU A 33 3.738 -2.087 6.949 1.00 0.00 H new ATOM 0 HD22 LEU A 33 5.019 -0.900 7.291 1.00 0.00 H new ATOM 0 HD23 LEU A 33 5.030 -1.805 5.759 1.00 0.00 H new ATOM 485 N ASP A 34 7.084 -5.110 5.601 1.00 0.00 N ATOM 486 CA ASP A 34 6.423 -6.248 4.972 1.00 0.00 C ATOM 487 C ASP A 34 5.171 -6.645 5.747 1.00 0.00 C ATOM 488 O ASP A 34 5.218 -6.848 6.961 1.00 0.00 O ATOM 489 CB ASP A 34 7.381 -7.436 4.883 1.00 0.00 C ATOM 490 CG ASP A 34 7.885 -7.876 6.244 1.00 0.00 C ATOM 491 OD1 ASP A 34 7.155 -8.615 6.937 1.00 0.00 O ATOM 492 OD2 ASP A 34 9.011 -7.483 6.615 1.00 0.00 O ATOM 0 H ASP A 34 7.654 -5.349 6.412 1.00 0.00 H new ATOM 0 HA ASP A 34 6.127 -5.954 3.965 1.00 0.00 H new ATOM 0 HB2 ASP A 34 6.875 -8.271 4.398 1.00 0.00 H new ATOM 0 HB3 ASP A 34 8.230 -7.168 4.253 1.00 0.00 H new ATOM 497 N TYR A 35 4.052 -6.752 5.039 1.00 0.00 N ATOM 498 CA TYR A 35 2.786 -7.121 5.661 1.00 0.00 C ATOM 499 C TYR A 35 2.265 -8.439 5.096 1.00 0.00 C ATOM 500 O TYR A 35 2.563 -8.799 3.958 1.00 0.00 O ATOM 501 CB TYR A 35 1.748 -6.017 5.449 1.00 0.00 C ATOM 502 CG TYR A 35 0.716 -5.936 6.551 1.00 0.00 C ATOM 503 CD1 TYR A 35 -0.326 -6.852 6.621 1.00 0.00 C ATOM 504 CD2 TYR A 35 0.783 -4.944 7.521 1.00 0.00 C ATOM 505 CE1 TYR A 35 -1.272 -6.782 7.626 1.00 0.00 C ATOM 506 CE2 TYR A 35 -0.157 -4.867 8.530 1.00 0.00 C ATOM 507 CZ TYR A 35 -1.183 -5.788 8.578 1.00 0.00 C ATOM 508 OH TYR A 35 -2.123 -5.714 9.581 1.00 0.00 O ATOM 0 H TYR A 35 3.996 -6.588 4.034 1.00 0.00 H new ATOM 0 HA TYR A 35 2.959 -7.248 6.730 1.00 0.00 H new ATOM 0 HB2 TYR A 35 2.261 -5.058 5.372 1.00 0.00 H new ATOM 0 HB3 TYR A 35 1.240 -6.185 4.499 1.00 0.00 H new ATOM 0 HD1 TYR A 35 -0.398 -7.632 5.877 1.00 0.00 H new ATOM 0 HD2 TYR A 35 1.584 -4.220 7.486 1.00 0.00 H new ATOM 0 HE1 TYR A 35 -2.076 -7.502 7.666 1.00 0.00 H new ATOM 0 HE2 TYR A 35 -0.089 -4.090 9.277 1.00 0.00 H new ATOM 0 HH TYR A 35 -1.915 -4.958 10.169 1.00 0.00 H new ATOM 518 N GLN A 36 1.485 -9.153 5.901 1.00 0.00 N ATOM 519 CA GLN A 36 0.922 -10.431 5.482 1.00 0.00 C ATOM 520 C GLN A 36 -0.600 -10.417 5.589 1.00 0.00 C ATOM 521 O GLN A 36 -1.154 -10.209 6.668 1.00 0.00 O ATOM 522 CB GLN A 36 1.494 -11.567 6.331 1.00 0.00 C ATOM 523 CG GLN A 36 2.746 -12.197 5.741 1.00 0.00 C ATOM 524 CD GLN A 36 3.037 -13.568 6.318 1.00 0.00 C ATOM 525 OE1 GLN A 36 4.118 -13.812 6.855 1.00 0.00 O ATOM 526 NE2 GLN A 36 2.071 -14.474 6.209 1.00 0.00 N ATOM 0 H GLN A 36 1.229 -8.868 6.846 1.00 0.00 H new ATOM 0 HA GLN A 36 1.193 -10.594 4.439 1.00 0.00 H new ATOM 0 HB2 GLN A 36 1.724 -11.186 7.326 1.00 0.00 H new ATOM 0 HB3 GLN A 36 0.733 -12.337 6.453 1.00 0.00 H new ATOM 0 HG2 GLN A 36 2.632 -12.279 4.660 1.00 0.00 H new ATOM 0 HG3 GLN A 36 3.598 -11.542 5.923 1.00 0.00 H new ATOM 0 HE21 GLN A 36 1.190 -14.229 5.756 1.00 0.00 H new ATOM 0 HE22 GLN A 36 2.210 -15.415 6.578 1.00 0.00 H new ATOM 535 N ASP A 37 -1.269 -10.639 4.463 1.00 0.00 N ATOM 536 CA ASP A 37 -2.727 -10.653 4.430 1.00 0.00 C ATOM 537 C ASP A 37 -3.284 -11.622 5.468 1.00 0.00 C ATOM 538 O ASP A 37 -2.796 -12.739 5.636 1.00 0.00 O ATOM 539 CB ASP A 37 -3.223 -11.039 3.036 1.00 0.00 C ATOM 540 CG ASP A 37 -4.665 -10.633 2.801 1.00 0.00 C ATOM 541 OD1 ASP A 37 -5.556 -11.196 3.471 1.00 0.00 O ATOM 542 OD2 ASP A 37 -4.901 -9.751 1.949 1.00 0.00 O ATOM 0 H ASP A 37 -0.825 -10.812 3.561 1.00 0.00 H new ATOM 0 HA ASP A 37 -3.081 -9.650 4.668 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -2.589 -10.568 2.285 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -3.126 -12.117 2.905 1.00 0.00 H new ATOM 547 N PRO A 38 -4.332 -11.185 6.183 1.00 0.00 N ATOM 548 CA PRO A 38 -4.979 -11.997 7.217 1.00 0.00 C ATOM 549 C PRO A 38 -5.746 -13.178 6.632 1.00 0.00 C ATOM 550 O PRO A 38 -5.956 -14.189 7.303 1.00 0.00 O ATOM 551 CB PRO A 38 -5.941 -11.015 7.890 1.00 0.00 C ATOM 552 CG PRO A 38 -6.226 -9.990 6.847 1.00 0.00 C ATOM 553 CD PRO A 38 -4.966 -9.864 6.035 1.00 0.00 C ATOM 0 HA PRO A 38 -4.254 -12.440 7.900 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -6.854 -11.514 8.214 1.00 0.00 H new ATOM 0 HB3 PRO A 38 -5.492 -10.565 8.775 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -7.065 -10.293 6.221 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -6.495 -9.036 7.301 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -5.182 -9.636 4.991 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -4.325 -9.066 6.409 1.00 0.00 H new ATOM 561 N LEU A 39 -6.160 -13.044 5.377 1.00 0.00 N ATOM 562 CA LEU A 39 -6.904 -14.101 4.700 1.00 0.00 C ATOM 563 C LEU A 39 -5.967 -14.998 3.898 1.00 0.00 C ATOM 564 O LEU A 39 -6.265 -16.169 3.658 1.00 0.00 O ATOM 565 CB LEU A 39 -7.964 -13.496 3.777 1.00 0.00 C ATOM 566 CG LEU A 39 -8.724 -12.290 4.329 1.00 0.00 C ATOM 567 CD1 LEU A 39 -9.519 -11.610 3.225 1.00 0.00 C ATOM 568 CD2 LEU A 39 -9.642 -12.713 5.466 1.00 0.00 C ATOM 0 H LEU A 39 -5.993 -12.214 4.808 1.00 0.00 H new ATOM 0 HA LEU A 39 -7.397 -14.708 5.459 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -7.480 -13.201 2.846 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -8.687 -14.273 3.528 1.00 0.00 H new ATOM 0 HG LEU A 39 -7.999 -11.576 4.720 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -10.054 -10.754 3.636 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -8.839 -11.272 2.443 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -10.234 -12.316 2.804 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -10.175 -11.842 5.847 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -10.360 -13.446 5.100 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -9.049 -13.154 6.267 1.00 0.00 H new ATOM 580 N ASP A 40 -4.833 -14.443 3.487 1.00 0.00 N ATOM 581 CA ASP A 40 -3.850 -15.193 2.714 1.00 0.00 C ATOM 582 C ASP A 40 -2.441 -14.951 3.246 1.00 0.00 C ATOM 583 O ASP A 40 -1.814 -13.927 2.973 1.00 0.00 O ATOM 584 CB ASP A 40 -3.924 -14.803 1.237 1.00 0.00 C ATOM 585 CG ASP A 40 -3.482 -15.924 0.318 1.00 0.00 C ATOM 586 OD1 ASP A 40 -4.093 -17.012 0.373 1.00 0.00 O ATOM 587 OD2 ASP A 40 -2.525 -15.715 -0.456 1.00 0.00 O ATOM 0 H ASP A 40 -4.571 -13.476 3.676 1.00 0.00 H new ATOM 0 HA ASP A 40 -4.080 -16.254 2.813 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -4.947 -14.518 0.991 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -3.298 -13.927 1.064 1.00 0.00 H new ATOM 592 N PRO A 41 -1.929 -15.915 4.026 1.00 0.00 N ATOM 593 CA PRO A 41 -0.588 -15.830 4.613 1.00 0.00 C ATOM 594 C PRO A 41 0.513 -15.957 3.566 1.00 0.00 C ATOM 595 O PRO A 41 1.597 -15.392 3.718 1.00 0.00 O ATOM 596 CB PRO A 41 -0.548 -17.018 5.578 1.00 0.00 C ATOM 597 CG PRO A 41 -1.532 -17.989 5.025 1.00 0.00 C ATOM 598 CD PRO A 41 -2.619 -17.163 4.393 1.00 0.00 C ATOM 0 HA PRO A 41 -0.413 -14.867 5.093 1.00 0.00 H new ATOM 0 HB2 PRO A 41 0.450 -17.452 5.630 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -0.817 -16.715 6.590 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -1.063 -18.644 4.291 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -1.934 -18.628 5.811 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -3.044 -17.659 3.520 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -3.439 -16.980 5.087 1.00 0.00 H new ATOM 606 N THR A 42 0.229 -16.702 2.502 1.00 0.00 N ATOM 607 CA THR A 42 1.195 -16.903 1.430 1.00 0.00 C ATOM 608 C THR A 42 1.324 -15.655 0.565 1.00 0.00 C ATOM 609 O THR A 42 2.034 -15.656 -0.441 1.00 0.00 O ATOM 610 CB THR A 42 0.803 -18.095 0.537 1.00 0.00 C ATOM 611 OG1 THR A 42 -0.523 -17.910 0.028 1.00 0.00 O ATOM 612 CG2 THR A 42 0.876 -19.401 1.314 1.00 0.00 C ATOM 0 H THR A 42 -0.663 -17.176 2.360 1.00 0.00 H new ATOM 0 HA THR A 42 2.154 -17.114 1.904 1.00 0.00 H new ATOM 0 HB THR A 42 1.507 -18.146 -0.294 1.00 0.00 H new ATOM 0 HG1 THR A 42 -0.764 -18.671 -0.540 1.00 0.00 H new ATOM 0 HG21 THR A 42 0.595 -20.228 0.662 1.00 0.00 H new ATOM 0 HG22 THR A 42 1.893 -19.553 1.675 1.00 0.00 H new ATOM 0 HG23 THR A 42 0.192 -19.359 2.162 1.00 0.00 H new ATOM 620 N ARG A 43 0.635 -14.590 0.963 1.00 0.00 N ATOM 621 CA ARG A 43 0.672 -13.335 0.223 1.00 0.00 C ATOM 622 C ARG A 43 1.082 -12.180 1.131 1.00 0.00 C ATOM 623 O ARG A 43 0.516 -11.993 2.208 1.00 0.00 O ATOM 624 CB ARG A 43 -0.694 -13.046 -0.403 1.00 0.00 C ATOM 625 CG ARG A 43 -0.858 -13.620 -1.800 1.00 0.00 C ATOM 626 CD ARG A 43 -2.026 -12.978 -2.533 1.00 0.00 C ATOM 627 NE ARG A 43 -2.509 -13.812 -3.629 1.00 0.00 N ATOM 628 CZ ARG A 43 -3.700 -13.660 -4.199 1.00 0.00 C ATOM 629 NH1 ARG A 43 -4.523 -12.710 -3.778 1.00 0.00 N ATOM 630 NH2 ARG A 43 -4.068 -14.459 -5.192 1.00 0.00 N ATOM 0 H ARG A 43 0.044 -14.572 1.794 1.00 0.00 H new ATOM 0 HA ARG A 43 1.414 -13.432 -0.570 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -1.473 -13.453 0.242 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -0.845 -11.967 -0.443 1.00 0.00 H new ATOM 0 HG2 ARG A 43 0.059 -13.465 -2.368 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -1.015 -14.697 -1.736 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -2.839 -12.796 -1.830 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -1.720 -12.008 -2.924 1.00 0.00 H new ATOM 0 HE ARG A 43 -1.899 -14.552 -3.977 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -4.243 -12.094 -3.015 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -5.437 -12.595 -4.217 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -3.437 -15.191 -5.519 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -4.982 -14.342 -5.629 1.00 0.00 H new ATOM 644 N SER A 44 2.071 -11.409 0.690 1.00 0.00 N ATOM 645 CA SER A 44 2.560 -10.275 1.465 1.00 0.00 C ATOM 646 C SER A 44 2.523 -8.994 0.637 1.00 0.00 C ATOM 647 O SER A 44 2.474 -9.037 -0.592 1.00 0.00 O ATOM 648 CB SER A 44 3.986 -10.540 1.952 1.00 0.00 C ATOM 649 OG SER A 44 4.075 -11.789 2.614 1.00 0.00 O ATOM 0 H SER A 44 2.549 -11.549 -0.200 1.00 0.00 H new ATOM 0 HA SER A 44 1.907 -10.148 2.328 1.00 0.00 H new ATOM 0 HB2 SER A 44 4.672 -10.524 1.105 1.00 0.00 H new ATOM 0 HB3 SER A 44 4.297 -9.744 2.628 1.00 0.00 H new ATOM 0 HG SER A 44 4.996 -11.935 2.914 1.00 0.00 H new ATOM 655 N VAL A 45 2.546 -7.854 1.320 1.00 0.00 N ATOM 656 CA VAL A 45 2.517 -6.560 0.650 1.00 0.00 C ATOM 657 C VAL A 45 3.296 -5.514 1.438 1.00 0.00 C ATOM 658 O VAL A 45 3.369 -5.574 2.666 1.00 0.00 O ATOM 659 CB VAL A 45 1.072 -6.064 0.450 1.00 0.00 C ATOM 660 CG1 VAL A 45 0.286 -7.042 -0.410 1.00 0.00 C ATOM 661 CG2 VAL A 45 0.390 -5.857 1.794 1.00 0.00 C ATOM 0 H VAL A 45 2.585 -7.801 2.338 1.00 0.00 H new ATOM 0 HA VAL A 45 2.985 -6.699 -0.325 1.00 0.00 H new ATOM 0 HB VAL A 45 1.103 -5.105 -0.068 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -0.732 -6.675 -0.540 1.00 0.00 H new ATOM 0 HG12 VAL A 45 0.765 -7.136 -1.384 1.00 0.00 H new ATOM 0 HG13 VAL A 45 0.261 -8.016 0.078 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -0.630 -5.507 1.634 1.00 0.00 H new ATOM 0 HG22 VAL A 45 0.368 -6.800 2.340 1.00 0.00 H new ATOM 0 HG23 VAL A 45 0.942 -5.116 2.372 1.00 0.00 H new ATOM 671 N ILE A 46 3.878 -4.555 0.725 1.00 0.00 N ATOM 672 CA ILE A 46 4.651 -3.495 1.359 1.00 0.00 C ATOM 673 C ILE A 46 3.757 -2.327 1.760 1.00 0.00 C ATOM 674 O ILE A 46 3.008 -1.794 0.941 1.00 0.00 O ATOM 675 CB ILE A 46 5.765 -2.978 0.429 1.00 0.00 C ATOM 676 CG1 ILE A 46 6.802 -4.075 0.181 1.00 0.00 C ATOM 677 CG2 ILE A 46 6.423 -1.743 1.027 1.00 0.00 C ATOM 678 CD1 ILE A 46 7.549 -4.493 1.428 1.00 0.00 C ATOM 0 H ILE A 46 3.829 -4.491 -0.292 1.00 0.00 H new ATOM 0 HA ILE A 46 5.104 -3.926 2.252 1.00 0.00 H new ATOM 0 HB ILE A 46 5.321 -2.702 -0.527 1.00 0.00 H new ATOM 0 HG12 ILE A 46 6.303 -4.946 -0.243 1.00 0.00 H new ATOM 0 HG13 ILE A 46 7.519 -3.725 -0.562 1.00 0.00 H new ATOM 0 HG21 ILE A 46 7.208 -1.389 0.359 1.00 0.00 H new ATOM 0 HG22 ILE A 46 5.676 -0.960 1.156 1.00 0.00 H new ATOM 0 HG23 ILE A 46 6.857 -1.994 1.995 1.00 0.00 H new ATOM 0 HD11 ILE A 46 8.267 -5.274 1.177 1.00 0.00 H new ATOM 0 HD12 ILE A 46 8.077 -3.633 1.841 1.00 0.00 H new ATOM 0 HD13 ILE A 46 6.842 -4.874 2.165 1.00 0.00 H new ATOM 690 N VAL A 47 3.841 -1.932 3.027 1.00 0.00 N ATOM 691 CA VAL A 47 3.042 -0.825 3.537 1.00 0.00 C ATOM 692 C VAL A 47 3.920 0.371 3.888 1.00 0.00 C ATOM 693 O VAL A 47 5.147 0.274 3.887 1.00 0.00 O ATOM 694 CB VAL A 47 2.238 -1.241 4.783 1.00 0.00 C ATOM 695 CG1 VAL A 47 0.923 -0.478 4.850 1.00 0.00 C ATOM 696 CG2 VAL A 47 1.993 -2.742 4.782 1.00 0.00 C ATOM 0 H VAL A 47 4.455 -2.363 3.719 1.00 0.00 H new ATOM 0 HA VAL A 47 2.349 -0.543 2.744 1.00 0.00 H new ATOM 0 HB VAL A 47 2.821 -0.991 5.670 1.00 0.00 H new ATOM 0 HG11 VAL A 47 0.369 -0.785 5.737 1.00 0.00 H new ATOM 0 HG12 VAL A 47 1.125 0.592 4.901 1.00 0.00 H new ATOM 0 HG13 VAL A 47 0.332 -0.693 3.960 1.00 0.00 H new ATOM 0 HG21 VAL A 47 1.424 -3.018 5.669 1.00 0.00 H new ATOM 0 HG22 VAL A 47 1.431 -3.018 3.890 1.00 0.00 H new ATOM 0 HG23 VAL A 47 2.948 -3.267 4.786 1.00 0.00 H new ATOM 706 N ILE A 48 3.283 1.498 4.189 1.00 0.00 N ATOM 707 CA ILE A 48 4.006 2.712 4.544 1.00 0.00 C ATOM 708 C ILE A 48 4.333 2.742 6.033 1.00 0.00 C ATOM 709 O ILE A 48 3.543 3.227 6.843 1.00 0.00 O ATOM 710 CB ILE A 48 3.201 3.974 4.182 1.00 0.00 C ATOM 711 CG1 ILE A 48 2.907 4.004 2.680 1.00 0.00 C ATOM 712 CG2 ILE A 48 3.957 5.225 4.604 1.00 0.00 C ATOM 713 CD1 ILE A 48 4.150 4.075 1.822 1.00 0.00 C ATOM 0 H ILE A 48 2.268 1.595 4.194 1.00 0.00 H new ATOM 0 HA ILE A 48 4.933 2.705 3.970 1.00 0.00 H new ATOM 0 HB ILE A 48 2.253 3.948 4.719 1.00 0.00 H new ATOM 0 HG12 ILE A 48 2.340 3.113 2.411 1.00 0.00 H new ATOM 0 HG13 ILE A 48 2.273 4.863 2.459 1.00 0.00 H new ATOM 0 HG21 ILE A 48 3.375 6.108 4.341 1.00 0.00 H new ATOM 0 HG22 ILE A 48 4.120 5.205 5.682 1.00 0.00 H new ATOM 0 HG23 ILE A 48 4.919 5.259 4.092 1.00 0.00 H new ATOM 0 HD11 ILE A 48 3.865 4.093 0.770 1.00 0.00 H new ATOM 0 HD12 ILE A 48 4.707 4.980 2.063 1.00 0.00 H new ATOM 0 HD13 ILE A 48 4.775 3.203 2.014 1.00 0.00 H new ATOM 725 N ARG A 49 5.504 2.222 6.387 1.00 0.00 N ATOM 726 CA ARG A 49 5.936 2.189 7.779 1.00 0.00 C ATOM 727 C ARG A 49 5.571 3.488 8.492 1.00 0.00 C ATOM 728 O ARG A 49 4.785 3.487 9.440 1.00 0.00 O ATOM 729 CB ARG A 49 7.446 1.956 7.861 1.00 0.00 C ATOM 730 CG ARG A 49 7.975 1.889 9.284 1.00 0.00 C ATOM 731 CD ARG A 49 7.831 0.492 9.866 1.00 0.00 C ATOM 732 NE ARG A 49 8.334 0.415 11.235 1.00 0.00 N ATOM 733 CZ ARG A 49 8.489 -0.726 11.898 1.00 0.00 C ATOM 734 NH1 ARG A 49 8.182 -1.879 11.320 1.00 0.00 N ATOM 735 NH2 ARG A 49 8.953 -0.714 13.141 1.00 0.00 N ATOM 0 H ARG A 49 6.170 1.818 5.729 1.00 0.00 H new ATOM 0 HA ARG A 49 5.421 1.366 8.274 1.00 0.00 H new ATOM 0 HB2 ARG A 49 7.690 1.026 7.347 1.00 0.00 H new ATOM 0 HB3 ARG A 49 7.958 2.758 7.329 1.00 0.00 H new ATOM 0 HG2 ARG A 49 9.024 2.184 9.298 1.00 0.00 H new ATOM 0 HG3 ARG A 49 7.436 2.602 9.908 1.00 0.00 H new ATOM 0 HD2 ARG A 49 6.781 0.198 9.848 1.00 0.00 H new ATOM 0 HD3 ARG A 49 8.371 -0.219 9.241 1.00 0.00 H new ATOM 0 HE ARG A 49 8.580 1.285 11.708 1.00 0.00 H new ATOM 0 HH11 ARG A 49 7.826 -1.891 10.364 1.00 0.00 H new ATOM 0 HH12 ARG A 49 8.302 -2.754 11.831 1.00 0.00 H new ATOM 0 HH21 ARG A 49 9.191 0.171 13.588 1.00 0.00 H new ATOM 0 HH22 ARG A 49 9.072 -1.590 13.650 1.00 0.00 H new ATOM 749 N SER A 50 6.148 4.593 8.030 1.00 0.00 N ATOM 750 CA SER A 50 5.887 5.897 8.626 1.00 0.00 C ATOM 751 C SER A 50 6.576 7.004 7.835 1.00 0.00 C ATOM 752 O SER A 50 7.528 6.753 7.094 1.00 0.00 O ATOM 753 CB SER A 50 6.363 5.922 10.080 1.00 0.00 C ATOM 754 OG SER A 50 5.626 6.862 10.842 1.00 0.00 O ATOM 0 H SER A 50 6.799 4.611 7.245 1.00 0.00 H new ATOM 0 HA SER A 50 4.811 6.071 8.600 1.00 0.00 H new ATOM 0 HB2 SER A 50 6.255 4.930 10.518 1.00 0.00 H new ATOM 0 HB3 SER A 50 7.423 6.173 10.115 1.00 0.00 H new ATOM 0 HG SER A 50 5.948 6.857 11.768 1.00 0.00 H new ATOM 760 N LEU A 51 6.090 8.230 7.997 1.00 0.00 N ATOM 761 CA LEU A 51 6.658 9.377 7.297 1.00 0.00 C ATOM 762 C LEU A 51 7.560 10.187 8.224 1.00 0.00 C ATOM 763 O LEU A 51 7.110 10.712 9.242 1.00 0.00 O ATOM 764 CB LEU A 51 5.543 10.267 6.746 1.00 0.00 C ATOM 765 CG LEU A 51 4.272 9.548 6.295 1.00 0.00 C ATOM 766 CD1 LEU A 51 3.171 10.552 5.986 1.00 0.00 C ATOM 767 CD2 LEU A 51 4.555 8.675 5.081 1.00 0.00 C ATOM 0 H LEU A 51 5.304 8.455 8.607 1.00 0.00 H new ATOM 0 HA LEU A 51 7.260 9.005 6.468 1.00 0.00 H new ATOM 0 HB2 LEU A 51 5.273 10.993 7.513 1.00 0.00 H new ATOM 0 HB3 LEU A 51 5.939 10.829 5.900 1.00 0.00 H new ATOM 0 HG LEU A 51 3.933 8.906 7.108 1.00 0.00 H new ATOM 0 HD11 LEU A 51 2.274 10.021 5.667 1.00 0.00 H new ATOM 0 HD12 LEU A 51 2.949 11.135 6.880 1.00 0.00 H new ATOM 0 HD13 LEU A 51 3.500 11.220 5.190 1.00 0.00 H new ATOM 0 HD21 LEU A 51 3.639 8.171 4.774 1.00 0.00 H new ATOM 0 HD22 LEU A 51 4.919 9.296 4.263 1.00 0.00 H new ATOM 0 HD23 LEU A 51 5.310 7.932 5.336 1.00 0.00 H new ATOM 779 N VAL A 52 8.836 10.285 7.862 1.00 0.00 N ATOM 780 CA VAL A 52 9.800 11.034 8.658 1.00 0.00 C ATOM 781 C VAL A 52 9.345 12.474 8.863 1.00 0.00 C ATOM 782 O VAL A 52 8.739 13.076 7.977 1.00 0.00 O ATOM 783 CB VAL A 52 11.192 11.036 7.998 1.00 0.00 C ATOM 784 CG1 VAL A 52 12.165 11.882 8.805 1.00 0.00 C ATOM 785 CG2 VAL A 52 11.710 9.614 7.844 1.00 0.00 C ATOM 0 H VAL A 52 9.225 9.855 7.023 1.00 0.00 H new ATOM 0 HA VAL A 52 9.865 10.536 9.626 1.00 0.00 H new ATOM 0 HB VAL A 52 11.103 11.476 7.005 1.00 0.00 H new ATOM 0 HG11 VAL A 52 13.143 11.871 8.323 1.00 0.00 H new ATOM 0 HG12 VAL A 52 11.798 12.907 8.859 1.00 0.00 H new ATOM 0 HG13 VAL A 52 12.252 11.475 9.812 1.00 0.00 H new ATOM 0 HG21 VAL A 52 12.694 9.634 7.376 1.00 0.00 H new ATOM 0 HG22 VAL A 52 11.784 9.146 8.825 1.00 0.00 H new ATOM 0 HG23 VAL A 52 11.023 9.042 7.220 1.00 0.00 H new ATOM 795 N ALA A 53 9.641 13.022 10.037 1.00 0.00 N ATOM 796 CA ALA A 53 9.264 14.393 10.357 1.00 0.00 C ATOM 797 C ALA A 53 9.741 15.360 9.278 1.00 0.00 C ATOM 798 O ALA A 53 10.935 15.643 9.168 1.00 0.00 O ATOM 799 CB ALA A 53 9.828 14.792 11.713 1.00 0.00 C ATOM 0 H ALA A 53 10.141 12.537 10.782 1.00 0.00 H new ATOM 0 HA ALA A 53 8.176 14.444 10.398 1.00 0.00 H new ATOM 0 HB1 ALA A 53 9.539 15.818 11.940 1.00 0.00 H new ATOM 0 HB2 ALA A 53 9.434 14.126 12.481 1.00 0.00 H new ATOM 0 HB3 ALA A 53 10.915 14.718 11.691 1.00 0.00 H new ATOM 805 N ASP A 54 8.803 15.862 8.484 1.00 0.00 N ATOM 806 CA ASP A 54 9.128 16.798 7.413 1.00 0.00 C ATOM 807 C ASP A 54 9.837 16.086 6.266 1.00 0.00 C ATOM 808 O ASP A 54 10.700 16.660 5.604 1.00 0.00 O ATOM 809 CB ASP A 54 10.005 17.931 7.947 1.00 0.00 C ATOM 810 CG ASP A 54 9.801 19.228 7.188 1.00 0.00 C ATOM 811 OD1 ASP A 54 8.652 19.717 7.146 1.00 0.00 O ATOM 812 OD2 ASP A 54 10.790 19.754 6.636 1.00 0.00 O ATOM 0 H ASP A 54 7.811 15.637 8.561 1.00 0.00 H new ATOM 0 HA ASP A 54 8.196 17.218 7.035 1.00 0.00 H new ATOM 0 HB2 ASP A 54 9.783 18.092 9.002 1.00 0.00 H new ATOM 0 HB3 ASP A 54 11.053 17.637 7.883 1.00 0.00 H new ATOM 817 N GLY A 55 9.466 14.830 6.036 1.00 0.00 N ATOM 818 CA GLY A 55 10.077 14.059 4.969 1.00 0.00 C ATOM 819 C GLY A 55 9.341 14.207 3.652 1.00 0.00 C ATOM 820 O GLY A 55 8.138 14.467 3.631 1.00 0.00 O ATOM 0 H GLY A 55 8.753 14.333 6.570 1.00 0.00 H new ATOM 0 HA2 GLY A 55 11.112 14.378 4.841 1.00 0.00 H new ATOM 0 HA3 GLY A 55 10.100 13.007 5.253 1.00 0.00 H new ATOM 824 N VAL A 56 10.065 14.043 2.550 1.00 0.00 N ATOM 825 CA VAL A 56 9.474 14.160 1.222 1.00 0.00 C ATOM 826 C VAL A 56 8.039 13.646 1.213 1.00 0.00 C ATOM 827 O VAL A 56 7.171 14.212 0.549 1.00 0.00 O ATOM 828 CB VAL A 56 10.292 13.384 0.173 1.00 0.00 C ATOM 829 CG1 VAL A 56 9.622 13.461 -1.191 1.00 0.00 C ATOM 830 CG2 VAL A 56 11.716 13.918 0.107 1.00 0.00 C ATOM 0 H VAL A 56 11.062 13.829 2.550 1.00 0.00 H new ATOM 0 HA VAL A 56 9.480 15.219 0.965 1.00 0.00 H new ATOM 0 HB VAL A 56 10.334 12.337 0.472 1.00 0.00 H new ATOM 0 HG11 VAL A 56 10.214 12.907 -1.919 1.00 0.00 H new ATOM 0 HG12 VAL A 56 8.623 13.028 -1.131 1.00 0.00 H new ATOM 0 HG13 VAL A 56 9.548 14.503 -1.501 1.00 0.00 H new ATOM 0 HG21 VAL A 56 12.280 13.358 -0.639 1.00 0.00 H new ATOM 0 HG22 VAL A 56 11.697 14.973 -0.168 1.00 0.00 H new ATOM 0 HG23 VAL A 56 12.192 13.806 1.081 1.00 0.00 H new ATOM 840 N ALA A 57 7.796 12.571 1.954 1.00 0.00 N ATOM 841 CA ALA A 57 6.465 11.982 2.033 1.00 0.00 C ATOM 842 C ALA A 57 5.456 12.979 2.593 1.00 0.00 C ATOM 843 O ALA A 57 4.478 13.324 1.930 1.00 0.00 O ATOM 844 CB ALA A 57 6.495 10.723 2.887 1.00 0.00 C ATOM 0 H ALA A 57 8.504 12.090 2.509 1.00 0.00 H new ATOM 0 HA ALA A 57 6.152 11.716 1.023 1.00 0.00 H new ATOM 0 HB1 ALA A 57 5.494 10.294 2.937 1.00 0.00 H new ATOM 0 HB2 ALA A 57 7.179 9.999 2.444 1.00 0.00 H new ATOM 0 HB3 ALA A 57 6.833 10.973 3.892 1.00 0.00 H new ATOM 850 N GLU A 58 5.700 13.437 3.817 1.00 0.00 N ATOM 851 CA GLU A 58 4.811 14.394 4.465 1.00 0.00 C ATOM 852 C GLU A 58 4.791 15.718 3.708 1.00 0.00 C ATOM 853 O GLU A 58 3.741 16.343 3.555 1.00 0.00 O ATOM 854 CB GLU A 58 5.246 14.628 5.913 1.00 0.00 C ATOM 855 CG GLU A 58 4.118 15.091 6.820 1.00 0.00 C ATOM 856 CD GLU A 58 4.623 15.695 8.116 1.00 0.00 C ATOM 857 OE1 GLU A 58 5.665 15.228 8.622 1.00 0.00 O ATOM 858 OE2 GLU A 58 3.976 16.634 8.625 1.00 0.00 O ATOM 0 H GLU A 58 6.505 13.161 4.379 1.00 0.00 H new ATOM 0 HA GLU A 58 3.804 13.977 4.458 1.00 0.00 H new ATOM 0 HB2 GLU A 58 5.665 13.704 6.311 1.00 0.00 H new ATOM 0 HB3 GLU A 58 6.042 15.372 5.929 1.00 0.00 H new ATOM 0 HG2 GLU A 58 3.511 15.827 6.292 1.00 0.00 H new ATOM 0 HG3 GLU A 58 3.468 14.246 7.046 1.00 0.00 H new ATOM 865 N ARG A 59 5.960 16.141 3.237 1.00 0.00 N ATOM 866 CA ARG A 59 6.078 17.392 2.497 1.00 0.00 C ATOM 867 C ARG A 59 4.989 17.500 1.434 1.00 0.00 C ATOM 868 O ARG A 59 4.174 18.422 1.457 1.00 0.00 O ATOM 869 CB ARG A 59 7.457 17.493 1.842 1.00 0.00 C ATOM 870 CG ARG A 59 8.600 17.583 2.840 1.00 0.00 C ATOM 871 CD ARG A 59 9.859 18.142 2.196 1.00 0.00 C ATOM 872 NE ARG A 59 9.835 19.601 2.125 1.00 0.00 N ATOM 873 CZ ARG A 59 10.912 20.343 1.894 1.00 0.00 C ATOM 874 NH1 ARG A 59 12.092 19.766 1.712 1.00 0.00 N ATOM 875 NH2 ARG A 59 10.810 21.665 1.843 1.00 0.00 N ATOM 0 H ARG A 59 6.838 15.636 3.355 1.00 0.00 H new ATOM 0 HA ARG A 59 5.956 18.215 3.202 1.00 0.00 H new ATOM 0 HB2 ARG A 59 7.611 16.623 1.203 1.00 0.00 H new ATOM 0 HB3 ARG A 59 7.480 18.371 1.196 1.00 0.00 H new ATOM 0 HG2 ARG A 59 8.305 18.217 3.676 1.00 0.00 H new ATOM 0 HG3 ARG A 59 8.807 16.594 3.248 1.00 0.00 H new ATOM 0 HD2 ARG A 59 10.731 17.821 2.766 1.00 0.00 H new ATOM 0 HD3 ARG A 59 9.966 17.732 1.192 1.00 0.00 H new ATOM 0 HE ARG A 59 8.942 20.076 2.260 1.00 0.00 H new ATOM 0 HH11 ARG A 59 12.174 18.750 1.749 1.00 0.00 H new ATOM 0 HH12 ARG A 59 12.918 20.338 1.535 1.00 0.00 H new ATOM 0 HH21 ARG A 59 9.904 22.112 1.981 1.00 0.00 H new ATOM 0 HH22 ARG A 59 11.638 22.234 1.666 1.00 0.00 H new ATOM 889 N SER A 60 4.982 16.551 0.502 1.00 0.00 N ATOM 890 CA SER A 60 3.997 16.542 -0.572 1.00 0.00 C ATOM 891 C SER A 60 2.579 16.547 -0.009 1.00 0.00 C ATOM 892 O SER A 60 1.697 17.234 -0.522 1.00 0.00 O ATOM 893 CB SER A 60 4.198 15.318 -1.467 1.00 0.00 C ATOM 894 OG SER A 60 3.674 14.150 -0.859 1.00 0.00 O ATOM 0 H SER A 60 5.648 15.779 0.470 1.00 0.00 H new ATOM 0 HA SER A 60 4.136 17.445 -1.167 1.00 0.00 H new ATOM 0 HB2 SER A 60 3.710 15.482 -2.428 1.00 0.00 H new ATOM 0 HB3 SER A 60 5.260 15.181 -1.669 1.00 0.00 H new ATOM 0 HG SER A 60 4.041 14.059 0.045 1.00 0.00 H new ATOM 900 N GLY A 61 2.368 15.773 1.052 1.00 0.00 N ATOM 901 CA GLY A 61 1.056 15.702 1.669 1.00 0.00 C ATOM 902 C GLY A 61 0.130 14.738 0.953 1.00 0.00 C ATOM 903 O GLY A 61 -1.032 15.054 0.701 1.00 0.00 O ATOM 0 H GLY A 61 3.082 15.194 1.495 1.00 0.00 H new ATOM 0 HA2 GLY A 61 1.163 15.393 2.709 1.00 0.00 H new ATOM 0 HA3 GLY A 61 0.607 16.695 1.676 1.00 0.00 H new ATOM 907 N GLY A 62 0.647 13.558 0.623 1.00 0.00 N ATOM 908 CA GLY A 62 -0.154 12.564 -0.066 1.00 0.00 C ATOM 909 C GLY A 62 -0.004 11.180 0.534 1.00 0.00 C ATOM 910 O GLY A 62 -0.947 10.387 0.527 1.00 0.00 O ATOM 0 H GLY A 62 1.606 13.273 0.821 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -1.203 12.860 -0.032 1.00 0.00 H new ATOM 0 HA3 GLY A 62 0.135 12.534 -1.117 1.00 0.00 H new ATOM 914 N LEU A 63 1.182 10.888 1.055 1.00 0.00 N ATOM 915 CA LEU A 63 1.453 9.590 1.662 1.00 0.00 C ATOM 916 C LEU A 63 1.070 9.588 3.138 1.00 0.00 C ATOM 917 O LEU A 63 0.976 10.642 3.768 1.00 0.00 O ATOM 918 CB LEU A 63 2.932 9.231 1.507 1.00 0.00 C ATOM 919 CG LEU A 63 3.307 8.466 0.237 1.00 0.00 C ATOM 920 CD1 LEU A 63 3.261 9.386 -0.973 1.00 0.00 C ATOM 921 CD2 LEU A 63 4.687 7.840 0.379 1.00 0.00 C ATOM 0 H LEU A 63 1.972 11.533 1.069 1.00 0.00 H new ATOM 0 HA LEU A 63 0.848 8.843 1.148 1.00 0.00 H new ATOM 0 HB2 LEU A 63 3.514 10.152 1.538 1.00 0.00 H new ATOM 0 HB3 LEU A 63 3.233 8.635 2.369 1.00 0.00 H new ATOM 0 HG LEU A 63 2.580 7.667 0.090 1.00 0.00 H new ATOM 0 HD11 LEU A 63 3.531 8.824 -1.867 1.00 0.00 H new ATOM 0 HD12 LEU A 63 2.254 9.788 -1.087 1.00 0.00 H new ATOM 0 HD13 LEU A 63 3.965 10.206 -0.833 1.00 0.00 H new ATOM 0 HD21 LEU A 63 4.937 7.300 -0.534 1.00 0.00 H new ATOM 0 HD22 LEU A 63 5.426 8.623 0.551 1.00 0.00 H new ATOM 0 HD23 LEU A 63 4.688 7.148 1.222 1.00 0.00 H new ATOM 933 N LEU A 64 0.851 8.397 3.686 1.00 0.00 N ATOM 934 CA LEU A 64 0.480 8.257 5.089 1.00 0.00 C ATOM 935 C LEU A 64 0.837 6.869 5.611 1.00 0.00 C ATOM 936 O LEU A 64 0.904 5.895 4.861 1.00 0.00 O ATOM 937 CB LEU A 64 -1.018 8.512 5.270 1.00 0.00 C ATOM 938 CG LEU A 64 -1.489 9.946 5.024 1.00 0.00 C ATOM 939 CD1 LEU A 64 -3.006 10.026 5.073 1.00 0.00 C ATOM 940 CD2 LEU A 64 -0.870 10.893 6.043 1.00 0.00 C ATOM 0 H LEU A 64 0.924 7.515 3.179 1.00 0.00 H new ATOM 0 HA LEU A 64 1.040 8.996 5.662 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -1.563 7.851 4.596 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -1.294 8.229 6.286 1.00 0.00 H new ATOM 0 HG LEU A 64 -1.162 10.249 4.029 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -3.322 11.054 4.896 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -3.429 9.379 4.305 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -3.356 9.703 6.053 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -1.216 11.909 5.853 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -1.166 10.591 7.047 1.00 0.00 H new ATOM 0 HD23 LEU A 64 0.216 10.858 5.959 1.00 0.00 H new ATOM 952 N PRO A 65 1.071 6.774 6.929 1.00 0.00 N ATOM 953 CA PRO A 65 1.423 5.509 7.581 1.00 0.00 C ATOM 954 C PRO A 65 0.253 4.532 7.619 1.00 0.00 C ATOM 955 O PRO A 65 -0.769 4.796 8.251 1.00 0.00 O ATOM 956 CB PRO A 65 1.808 5.937 8.999 1.00 0.00 C ATOM 957 CG PRO A 65 1.075 7.214 9.223 1.00 0.00 C ATOM 958 CD PRO A 65 1.010 7.894 7.883 1.00 0.00 C ATOM 0 HA PRO A 65 2.216 4.983 7.049 1.00 0.00 H new ATOM 0 HB2 PRO A 65 1.521 5.183 9.732 1.00 0.00 H new ATOM 0 HB3 PRO A 65 2.885 6.078 9.091 1.00 0.00 H new ATOM 0 HG2 PRO A 65 0.075 7.027 9.615 1.00 0.00 H new ATOM 0 HG3 PRO A 65 1.591 7.838 9.953 1.00 0.00 H new ATOM 0 HD2 PRO A 65 0.092 8.470 7.769 1.00 0.00 H new ATOM 0 HD3 PRO A 65 1.840 8.587 7.743 1.00 0.00 H new ATOM 966 N GLY A 66 0.410 3.401 6.937 1.00 0.00 N ATOM 967 CA GLY A 66 -0.641 2.401 6.907 1.00 0.00 C ATOM 968 C GLY A 66 -1.055 2.038 5.494 1.00 0.00 C ATOM 969 O GLY A 66 -1.577 0.950 5.254 1.00 0.00 O ATOM 0 H GLY A 66 1.246 3.160 6.405 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -0.300 1.504 7.424 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -1.508 2.773 7.452 1.00 0.00 H new ATOM 973 N ASP A 67 -0.823 2.952 4.558 1.00 0.00 N ATOM 974 CA ASP A 67 -1.175 2.722 3.162 1.00 0.00 C ATOM 975 C ASP A 67 -0.250 1.687 2.531 1.00 0.00 C ATOM 976 O ASP A 67 0.907 1.550 2.927 1.00 0.00 O ATOM 977 CB ASP A 67 -1.108 4.032 2.375 1.00 0.00 C ATOM 978 CG ASP A 67 -1.705 5.198 3.139 1.00 0.00 C ATOM 979 OD1 ASP A 67 -2.730 4.996 3.823 1.00 0.00 O ATOM 980 OD2 ASP A 67 -1.146 6.311 3.053 1.00 0.00 O ATOM 0 H ASP A 67 -0.393 3.859 4.741 1.00 0.00 H new ATOM 0 HA ASP A 67 -2.195 2.339 3.129 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -0.069 4.254 2.133 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -1.637 3.912 1.430 1.00 0.00 H new ATOM 985 N ARG A 68 -0.769 0.959 1.547 1.00 0.00 N ATOM 986 CA ARG A 68 0.010 -0.066 0.862 1.00 0.00 C ATOM 987 C ARG A 68 0.655 0.495 -0.402 1.00 0.00 C ATOM 988 O ARG A 68 -0.023 1.073 -1.254 1.00 0.00 O ATOM 989 CB ARG A 68 -0.878 -1.260 0.508 1.00 0.00 C ATOM 990 CG ARG A 68 -0.131 -2.391 -0.179 1.00 0.00 C ATOM 991 CD ARG A 68 -1.049 -3.193 -1.089 1.00 0.00 C ATOM 992 NE ARG A 68 -0.309 -4.149 -1.908 1.00 0.00 N ATOM 993 CZ ARG A 68 -0.853 -4.841 -2.903 1.00 0.00 C ATOM 994 NH1 ARG A 68 -2.136 -4.683 -3.200 1.00 0.00 N ATOM 995 NH2 ARG A 68 -0.115 -5.693 -3.602 1.00 0.00 N ATOM 0 H ARG A 68 -1.725 1.060 1.207 1.00 0.00 H new ATOM 0 HA ARG A 68 0.800 -0.397 1.536 1.00 0.00 H new ATOM 0 HB2 ARG A 68 -1.340 -1.641 1.419 1.00 0.00 H new ATOM 0 HB3 ARG A 68 -1.685 -0.922 -0.141 1.00 0.00 H new ATOM 0 HG2 ARG A 68 0.694 -1.982 -0.762 1.00 0.00 H new ATOM 0 HG3 ARG A 68 0.305 -3.050 0.572 1.00 0.00 H new ATOM 0 HD2 ARG A 68 -1.783 -3.726 -0.485 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -1.602 -2.513 -1.737 1.00 0.00 H new ATOM 0 HE ARG A 68 0.680 -4.293 -1.705 1.00 0.00 H new ATOM 0 HH11 ARG A 68 -2.707 -4.029 -2.664 1.00 0.00 H new ATOM 0 HH12 ARG A 68 -2.552 -5.215 -3.964 1.00 0.00 H new ATOM 0 HH21 ARG A 68 0.872 -5.818 -3.376 1.00 0.00 H new ATOM 0 HH22 ARG A 68 -0.534 -6.224 -4.366 1.00 0.00 H new ATOM 1009 N LEU A 69 1.967 0.322 -0.518 1.00 0.00 N ATOM 1010 CA LEU A 69 2.703 0.811 -1.679 1.00 0.00 C ATOM 1011 C LEU A 69 2.593 -0.166 -2.845 1.00 0.00 C ATOM 1012 O LEU A 69 3.014 -1.318 -2.745 1.00 0.00 O ATOM 1013 CB LEU A 69 4.174 1.029 -1.319 1.00 0.00 C ATOM 1014 CG LEU A 69 5.029 1.722 -2.380 1.00 0.00 C ATOM 1015 CD1 LEU A 69 4.281 2.900 -2.983 1.00 0.00 C ATOM 1016 CD2 LEU A 69 6.354 2.177 -1.785 1.00 0.00 C ATOM 0 H LEU A 69 2.543 -0.153 0.177 1.00 0.00 H new ATOM 0 HA LEU A 69 2.264 1.761 -1.983 1.00 0.00 H new ATOM 0 HB2 LEU A 69 4.220 1.618 -0.403 1.00 0.00 H new ATOM 0 HB3 LEU A 69 4.621 0.060 -1.097 1.00 0.00 H new ATOM 0 HG LEU A 69 5.238 1.006 -3.175 1.00 0.00 H new ATOM 0 HD11 LEU A 69 4.906 3.381 -3.736 1.00 0.00 H new ATOM 0 HD12 LEU A 69 3.360 2.547 -3.447 1.00 0.00 H new ATOM 0 HD13 LEU A 69 4.040 3.618 -2.199 1.00 0.00 H new ATOM 0 HD21 LEU A 69 6.949 2.668 -2.555 1.00 0.00 H new ATOM 0 HD22 LEU A 69 6.166 2.877 -0.971 1.00 0.00 H new ATOM 0 HD23 LEU A 69 6.897 1.313 -1.403 1.00 0.00 H new ATOM 1028 N VAL A 70 2.027 0.304 -3.952 1.00 0.00 N ATOM 1029 CA VAL A 70 1.864 -0.527 -5.139 1.00 0.00 C ATOM 1030 C VAL A 70 3.149 -0.573 -5.958 1.00 0.00 C ATOM 1031 O VAL A 70 3.603 -1.644 -6.360 1.00 0.00 O ATOM 1032 CB VAL A 70 0.718 -0.013 -6.031 1.00 0.00 C ATOM 1033 CG1 VAL A 70 0.486 -0.958 -7.200 1.00 0.00 C ATOM 1034 CG2 VAL A 70 -0.554 0.163 -5.216 1.00 0.00 C ATOM 0 H VAL A 70 1.674 1.256 -4.052 1.00 0.00 H new ATOM 0 HA VAL A 70 1.622 -1.531 -4.792 1.00 0.00 H new ATOM 0 HB VAL A 70 1.002 0.960 -6.432 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -0.327 -0.578 -7.819 1.00 0.00 H new ATOM 0 HG12 VAL A 70 1.395 -1.027 -7.798 1.00 0.00 H new ATOM 0 HG13 VAL A 70 0.224 -1.946 -6.822 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -1.353 0.527 -5.862 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -0.845 -0.794 -4.784 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -0.377 0.883 -4.417 1.00 0.00 H new ATOM 1044 N SER A 71 3.732 0.597 -6.200 1.00 0.00 N ATOM 1045 CA SER A 71 4.965 0.691 -6.974 1.00 0.00 C ATOM 1046 C SER A 71 5.666 2.022 -6.720 1.00 0.00 C ATOM 1047 O SER A 71 5.081 2.947 -6.155 1.00 0.00 O ATOM 1048 CB SER A 71 4.668 0.534 -8.467 1.00 0.00 C ATOM 1049 OG SER A 71 3.477 1.213 -8.824 1.00 0.00 O ATOM 0 H SER A 71 3.371 1.493 -5.872 1.00 0.00 H new ATOM 0 HA SER A 71 5.627 -0.114 -6.656 1.00 0.00 H new ATOM 0 HB2 SER A 71 5.502 0.925 -9.050 1.00 0.00 H new ATOM 0 HB3 SER A 71 4.575 -0.524 -8.713 1.00 0.00 H new ATOM 0 HG SER A 71 3.310 1.099 -9.783 1.00 0.00 H new ATOM 1055 N VAL A 72 6.923 2.112 -7.142 1.00 0.00 N ATOM 1056 CA VAL A 72 7.705 3.329 -6.962 1.00 0.00 C ATOM 1057 C VAL A 72 8.530 3.641 -8.206 1.00 0.00 C ATOM 1058 O VAL A 72 9.494 2.943 -8.514 1.00 0.00 O ATOM 1059 CB VAL A 72 8.647 3.217 -5.749 1.00 0.00 C ATOM 1060 CG1 VAL A 72 9.491 4.475 -5.611 1.00 0.00 C ATOM 1061 CG2 VAL A 72 7.851 2.957 -4.479 1.00 0.00 C ATOM 0 H VAL A 72 7.422 1.356 -7.611 1.00 0.00 H new ATOM 0 HA VAL A 72 6.996 4.138 -6.788 1.00 0.00 H new ATOM 0 HB VAL A 72 9.319 2.373 -5.909 1.00 0.00 H new ATOM 0 HG11 VAL A 72 10.151 4.378 -4.749 1.00 0.00 H new ATOM 0 HG12 VAL A 72 10.089 4.612 -6.512 1.00 0.00 H new ATOM 0 HG13 VAL A 72 8.839 5.337 -5.474 1.00 0.00 H new ATOM 0 HG21 VAL A 72 8.532 2.881 -3.632 1.00 0.00 H new ATOM 0 HG22 VAL A 72 7.154 3.779 -4.312 1.00 0.00 H new ATOM 0 HG23 VAL A 72 7.295 2.025 -4.582 1.00 0.00 H new ATOM 1071 N ASN A 73 8.143 4.696 -8.916 1.00 0.00 N ATOM 1072 CA ASN A 73 8.848 5.101 -10.127 1.00 0.00 C ATOM 1073 C ASN A 73 8.778 4.007 -11.189 1.00 0.00 C ATOM 1074 O ASN A 73 9.752 3.753 -11.896 1.00 0.00 O ATOM 1075 CB ASN A 73 10.308 5.426 -9.808 1.00 0.00 C ATOM 1076 CG ASN A 73 10.490 6.848 -9.315 1.00 0.00 C ATOM 1077 OD1 ASN A 73 9.600 7.415 -8.681 1.00 0.00 O ATOM 1078 ND2 ASN A 73 11.647 7.432 -9.606 1.00 0.00 N ATOM 0 H ASN A 73 7.346 5.285 -8.674 1.00 0.00 H new ATOM 0 HA ASN A 73 8.362 5.994 -10.519 1.00 0.00 H new ATOM 0 HB2 ASN A 73 10.675 4.732 -9.051 1.00 0.00 H new ATOM 0 HB3 ASN A 73 10.915 5.274 -10.701 1.00 0.00 H new ATOM 0 HD21 ASN A 73 11.826 8.389 -9.301 1.00 0.00 H new ATOM 0 HD22 ASN A 73 12.356 6.924 -10.134 1.00 0.00 H new ATOM 1085 N GLU A 74 7.619 3.364 -11.293 1.00 0.00 N ATOM 1086 CA GLU A 74 7.423 2.298 -12.268 1.00 0.00 C ATOM 1087 C GLU A 74 8.166 1.033 -11.848 1.00 0.00 C ATOM 1088 O GLU A 74 8.950 0.475 -12.616 1.00 0.00 O ATOM 1089 CB GLU A 74 7.901 2.747 -13.651 1.00 0.00 C ATOM 1090 CG GLU A 74 7.270 1.970 -14.795 1.00 0.00 C ATOM 1091 CD GLU A 74 7.187 2.781 -16.074 1.00 0.00 C ATOM 1092 OE1 GLU A 74 8.231 2.951 -16.737 1.00 0.00 O ATOM 1093 OE2 GLU A 74 6.077 3.244 -16.411 1.00 0.00 O ATOM 0 H GLU A 74 6.803 3.563 -10.715 1.00 0.00 H new ATOM 0 HA GLU A 74 6.357 2.075 -12.314 1.00 0.00 H new ATOM 0 HB2 GLU A 74 7.679 3.807 -13.777 1.00 0.00 H new ATOM 0 HB3 GLU A 74 8.984 2.640 -13.704 1.00 0.00 H new ATOM 0 HG2 GLU A 74 7.850 1.066 -14.979 1.00 0.00 H new ATOM 0 HG3 GLU A 74 6.269 1.652 -14.505 1.00 0.00 H new ATOM 1100 N TYR A 75 7.914 0.586 -10.622 1.00 0.00 N ATOM 1101 CA TYR A 75 8.560 -0.611 -10.097 1.00 0.00 C ATOM 1102 C TYR A 75 7.553 -1.501 -9.374 1.00 0.00 C ATOM 1103 O TYR A 75 7.091 -1.173 -8.281 1.00 0.00 O ATOM 1104 CB TYR A 75 9.694 -0.228 -9.145 1.00 0.00 C ATOM 1105 CG TYR A 75 11.032 -0.066 -9.832 1.00 0.00 C ATOM 1106 CD1 TYR A 75 11.866 -1.157 -10.037 1.00 0.00 C ATOM 1107 CD2 TYR A 75 11.461 1.179 -10.274 1.00 0.00 C ATOM 1108 CE1 TYR A 75 13.089 -1.014 -10.663 1.00 0.00 C ATOM 1109 CE2 TYR A 75 12.682 1.332 -10.902 1.00 0.00 C ATOM 1110 CZ TYR A 75 13.493 0.233 -11.094 1.00 0.00 C ATOM 1111 OH TYR A 75 14.710 0.381 -11.718 1.00 0.00 O ATOM 0 H TYR A 75 7.267 1.035 -9.974 1.00 0.00 H new ATOM 0 HA TYR A 75 8.973 -1.169 -10.938 1.00 0.00 H new ATOM 0 HB2 TYR A 75 9.437 0.705 -8.644 1.00 0.00 H new ATOM 0 HB3 TYR A 75 9.782 -0.991 -8.372 1.00 0.00 H new ATOM 0 HD1 TYR A 75 11.553 -2.135 -9.701 1.00 0.00 H new ATOM 0 HD2 TYR A 75 10.829 2.042 -10.124 1.00 0.00 H new ATOM 0 HE1 TYR A 75 13.725 -1.873 -10.814 1.00 0.00 H new ATOM 0 HE2 TYR A 75 13.000 2.307 -11.241 1.00 0.00 H new ATOM 0 HH TYR A 75 14.842 1.322 -11.960 1.00 0.00 H new ATOM 1121 N CYS A 76 7.218 -2.627 -9.993 1.00 0.00 N ATOM 1122 CA CYS A 76 6.266 -3.566 -9.410 1.00 0.00 C ATOM 1123 C CYS A 76 6.764 -4.079 -8.063 1.00 0.00 C ATOM 1124 O CYS A 76 7.717 -4.857 -7.996 1.00 0.00 O ATOM 1125 CB CYS A 76 6.029 -4.741 -10.361 1.00 0.00 C ATOM 1126 SG CYS A 76 5.405 -4.259 -11.988 1.00 0.00 S ATOM 0 H CYS A 76 7.591 -2.912 -10.898 1.00 0.00 H new ATOM 0 HA CYS A 76 5.324 -3.040 -9.252 1.00 0.00 H new ATOM 0 HB2 CYS A 76 6.965 -5.285 -10.489 1.00 0.00 H new ATOM 0 HB3 CYS A 76 5.320 -5.430 -9.901 1.00 0.00 H new ATOM 0 HG CYS A 76 5.239 -5.320 -12.721 1.00 0.00 H new ATOM 1132 N LEU A 77 6.115 -3.638 -6.991 1.00 0.00 N ATOM 1133 CA LEU A 77 6.493 -4.051 -5.644 1.00 0.00 C ATOM 1134 C LEU A 77 5.517 -5.090 -5.099 1.00 0.00 C ATOM 1135 O LEU A 77 5.556 -5.433 -3.918 1.00 0.00 O ATOM 1136 CB LEU A 77 6.539 -2.839 -4.712 1.00 0.00 C ATOM 1137 CG LEU A 77 7.504 -1.722 -5.110 1.00 0.00 C ATOM 1138 CD1 LEU A 77 7.600 -0.681 -4.006 1.00 0.00 C ATOM 1139 CD2 LEU A 77 8.878 -2.293 -5.428 1.00 0.00 C ATOM 0 H LEU A 77 5.325 -2.994 -7.028 1.00 0.00 H new ATOM 0 HA LEU A 77 7.484 -4.501 -5.693 1.00 0.00 H new ATOM 0 HB2 LEU A 77 5.536 -2.418 -4.646 1.00 0.00 H new ATOM 0 HB3 LEU A 77 6.806 -3.184 -3.713 1.00 0.00 H new ATOM 0 HG LEU A 77 7.118 -1.236 -6.006 1.00 0.00 H new ATOM 0 HD11 LEU A 77 8.291 0.106 -4.307 1.00 0.00 H new ATOM 0 HD12 LEU A 77 6.615 -0.250 -3.826 1.00 0.00 H new ATOM 0 HD13 LEU A 77 7.962 -1.152 -3.092 1.00 0.00 H new ATOM 0 HD21 LEU A 77 9.552 -1.484 -5.709 1.00 0.00 H new ATOM 0 HD22 LEU A 77 9.272 -2.804 -4.550 1.00 0.00 H new ATOM 0 HD23 LEU A 77 8.796 -3.000 -6.253 1.00 0.00 H new ATOM 1151 N ASP A 78 4.644 -5.586 -5.969 1.00 0.00 N ATOM 1152 CA ASP A 78 3.660 -6.588 -5.576 1.00 0.00 C ATOM 1153 C ASP A 78 4.345 -7.863 -5.092 1.00 0.00 C ATOM 1154 O ASP A 78 5.267 -8.364 -5.733 1.00 0.00 O ATOM 1155 CB ASP A 78 2.730 -6.908 -6.748 1.00 0.00 C ATOM 1156 CG ASP A 78 3.434 -7.667 -7.855 1.00 0.00 C ATOM 1157 OD1 ASP A 78 4.504 -7.205 -8.305 1.00 0.00 O ATOM 1158 OD2 ASP A 78 2.916 -8.724 -8.271 1.00 0.00 O ATOM 0 H ASP A 78 4.598 -5.311 -6.950 1.00 0.00 H new ATOM 0 HA ASP A 78 3.071 -6.179 -4.755 1.00 0.00 H new ATOM 0 HB2 ASP A 78 1.886 -7.496 -6.388 1.00 0.00 H new ATOM 0 HB3 ASP A 78 2.324 -5.980 -7.149 1.00 0.00 H new ATOM 1163 N ASN A 79 3.887 -8.380 -3.957 1.00 0.00 N ATOM 1164 CA ASN A 79 4.457 -9.595 -3.386 1.00 0.00 C ATOM 1165 C ASN A 79 5.982 -9.550 -3.422 1.00 0.00 C ATOM 1166 O ASN A 79 6.636 -10.533 -3.771 1.00 0.00 O ATOM 1167 CB ASN A 79 3.955 -10.825 -4.145 1.00 0.00 C ATOM 1168 CG ASN A 79 2.471 -11.063 -3.941 1.00 0.00 C ATOM 1169 OD1 ASN A 79 2.031 -11.412 -2.846 1.00 0.00 O ATOM 1170 ND2 ASN A 79 1.691 -10.875 -5.000 1.00 0.00 N ATOM 0 H ASN A 79 3.123 -7.977 -3.414 1.00 0.00 H new ATOM 0 HA ASN A 79 4.137 -9.662 -2.346 1.00 0.00 H new ATOM 0 HB2 ASN A 79 4.158 -10.700 -5.209 1.00 0.00 H new ATOM 0 HB3 ASN A 79 4.510 -11.703 -3.816 1.00 0.00 H new ATOM 0 HD21 ASN A 79 0.684 -11.020 -4.924 1.00 0.00 H new ATOM 0 HD22 ASN A 79 2.099 -10.585 -5.889 1.00 0.00 H new ATOM 1177 N THR A 80 6.543 -8.401 -3.057 1.00 0.00 N ATOM 1178 CA THR A 80 7.990 -8.226 -3.048 1.00 0.00 C ATOM 1179 C THR A 80 8.548 -8.333 -1.634 1.00 0.00 C ATOM 1180 O THR A 80 7.848 -8.064 -0.658 1.00 0.00 O ATOM 1181 CB THR A 80 8.395 -6.865 -3.646 1.00 0.00 C ATOM 1182 OG1 THR A 80 7.825 -6.714 -4.950 1.00 0.00 O ATOM 1183 CG2 THR A 80 9.909 -6.741 -3.731 1.00 0.00 C ATOM 0 H THR A 80 6.017 -7.578 -2.764 1.00 0.00 H new ATOM 0 HA THR A 80 8.409 -9.023 -3.662 1.00 0.00 H new ATOM 0 HB THR A 80 8.018 -6.079 -2.992 1.00 0.00 H new ATOM 0 HG1 THR A 80 8.522 -6.439 -5.582 1.00 0.00 H new ATOM 0 HG21 THR A 80 10.171 -5.772 -4.156 1.00 0.00 H new ATOM 0 HG22 THR A 80 10.338 -6.827 -2.733 1.00 0.00 H new ATOM 0 HG23 THR A 80 10.304 -7.535 -4.365 1.00 0.00 H new ATOM 1191 N SER A 81 9.813 -8.728 -1.530 1.00 0.00 N ATOM 1192 CA SER A 81 10.464 -8.874 -0.233 1.00 0.00 C ATOM 1193 C SER A 81 10.929 -7.520 0.297 1.00 0.00 C ATOM 1194 O SER A 81 11.512 -6.721 -0.436 1.00 0.00 O ATOM 1195 CB SER A 81 11.655 -9.828 -0.341 1.00 0.00 C ATOM 1196 OG SER A 81 11.232 -11.134 -0.691 1.00 0.00 O ATOM 0 H SER A 81 10.407 -8.953 -2.328 1.00 0.00 H new ATOM 0 HA SER A 81 9.738 -9.289 0.466 1.00 0.00 H new ATOM 0 HB2 SER A 81 12.356 -9.457 -1.089 1.00 0.00 H new ATOM 0 HB3 SER A 81 12.189 -9.858 0.609 1.00 0.00 H new ATOM 0 HG SER A 81 12.012 -11.724 -0.755 1.00 0.00 H new ATOM 1202 N LEU A 82 10.665 -7.271 1.575 1.00 0.00 N ATOM 1203 CA LEU A 82 11.056 -6.014 2.205 1.00 0.00 C ATOM 1204 C LEU A 82 12.410 -5.543 1.686 1.00 0.00 C ATOM 1205 O LEU A 82 12.556 -4.401 1.251 1.00 0.00 O ATOM 1206 CB LEU A 82 11.109 -6.179 3.725 1.00 0.00 C ATOM 1207 CG LEU A 82 11.709 -5.009 4.506 1.00 0.00 C ATOM 1208 CD1 LEU A 82 10.852 -3.763 4.344 1.00 0.00 C ATOM 1209 CD2 LEU A 82 11.856 -5.370 5.977 1.00 0.00 C ATOM 0 H LEU A 82 10.183 -7.922 2.195 1.00 0.00 H new ATOM 0 HA LEU A 82 10.309 -5.261 1.952 1.00 0.00 H new ATOM 0 HB2 LEU A 82 10.095 -6.350 4.088 1.00 0.00 H new ATOM 0 HB3 LEU A 82 11.685 -7.076 3.953 1.00 0.00 H new ATOM 0 HG LEU A 82 12.700 -4.798 4.103 1.00 0.00 H new ATOM 0 HD11 LEU A 82 11.295 -2.941 4.907 1.00 0.00 H new ATOM 0 HD12 LEU A 82 10.798 -3.493 3.289 1.00 0.00 H new ATOM 0 HD13 LEU A 82 9.848 -3.961 4.720 1.00 0.00 H new ATOM 0 HD21 LEU A 82 12.284 -4.526 6.518 1.00 0.00 H new ATOM 0 HD22 LEU A 82 10.877 -5.608 6.393 1.00 0.00 H new ATOM 0 HD23 LEU A 82 12.512 -6.235 6.076 1.00 0.00 H new ATOM 1221 N ALA A 83 13.398 -6.430 1.732 1.00 0.00 N ATOM 1222 CA ALA A 83 14.739 -6.106 1.263 1.00 0.00 C ATOM 1223 C ALA A 83 14.705 -5.558 -0.160 1.00 0.00 C ATOM 1224 O ALA A 83 15.328 -4.540 -0.457 1.00 0.00 O ATOM 1225 CB ALA A 83 15.635 -7.334 1.336 1.00 0.00 C ATOM 0 H ALA A 83 13.295 -7.380 2.090 1.00 0.00 H new ATOM 0 HA ALA A 83 15.148 -5.332 1.913 1.00 0.00 H new ATOM 0 HB1 ALA A 83 16.634 -7.077 0.983 1.00 0.00 H new ATOM 0 HB2 ALA A 83 15.693 -7.681 2.368 1.00 0.00 H new ATOM 0 HB3 ALA A 83 15.221 -8.124 0.710 1.00 0.00 H new ATOM 1231 N GLU A 84 13.975 -6.242 -1.035 1.00 0.00 N ATOM 1232 CA GLU A 84 13.862 -5.823 -2.427 1.00 0.00 C ATOM 1233 C GLU A 84 13.189 -4.458 -2.532 1.00 0.00 C ATOM 1234 O GLU A 84 13.622 -3.597 -3.297 1.00 0.00 O ATOM 1235 CB GLU A 84 13.072 -6.857 -3.232 1.00 0.00 C ATOM 1236 CG GLU A 84 13.940 -7.939 -3.853 1.00 0.00 C ATOM 1237 CD GLU A 84 13.303 -8.567 -5.077 1.00 0.00 C ATOM 1238 OE1 GLU A 84 12.736 -7.818 -5.900 1.00 0.00 O ATOM 1239 OE2 GLU A 84 13.370 -9.806 -5.212 1.00 0.00 O ATOM 0 H GLU A 84 13.453 -7.088 -0.805 1.00 0.00 H new ATOM 0 HA GLU A 84 14.868 -5.745 -2.838 1.00 0.00 H new ATOM 0 HB2 GLU A 84 12.334 -7.325 -2.581 1.00 0.00 H new ATOM 0 HB3 GLU A 84 12.522 -6.346 -4.022 1.00 0.00 H new ATOM 0 HG2 GLU A 84 14.904 -7.512 -4.129 1.00 0.00 H new ATOM 0 HG3 GLU A 84 14.134 -8.714 -3.111 1.00 0.00 H new ATOM 1246 N ALA A 85 12.125 -4.268 -1.758 1.00 0.00 N ATOM 1247 CA ALA A 85 11.392 -3.009 -1.762 1.00 0.00 C ATOM 1248 C ALA A 85 12.303 -1.842 -1.393 1.00 0.00 C ATOM 1249 O ALA A 85 12.340 -0.827 -2.088 1.00 0.00 O ATOM 1250 CB ALA A 85 10.212 -3.082 -0.804 1.00 0.00 C ATOM 0 H ALA A 85 11.752 -4.971 -1.120 1.00 0.00 H new ATOM 0 HA ALA A 85 11.017 -2.839 -2.771 1.00 0.00 H new ATOM 0 HB1 ALA A 85 9.673 -2.134 -0.817 1.00 0.00 H new ATOM 0 HB2 ALA A 85 9.542 -3.885 -1.112 1.00 0.00 H new ATOM 0 HB3 ALA A 85 10.574 -3.279 0.205 1.00 0.00 H new ATOM 1256 N VAL A 86 13.037 -1.994 -0.295 1.00 0.00 N ATOM 1257 CA VAL A 86 13.948 -0.954 0.165 1.00 0.00 C ATOM 1258 C VAL A 86 14.999 -0.636 -0.893 1.00 0.00 C ATOM 1259 O VAL A 86 15.257 0.529 -1.195 1.00 0.00 O ATOM 1260 CB VAL A 86 14.657 -1.365 1.469 1.00 0.00 C ATOM 1261 CG1 VAL A 86 15.617 -0.275 1.922 1.00 0.00 C ATOM 1262 CG2 VAL A 86 13.637 -1.673 2.555 1.00 0.00 C ATOM 0 H VAL A 86 13.018 -2.828 0.292 1.00 0.00 H new ATOM 0 HA VAL A 86 13.345 -0.066 0.352 1.00 0.00 H new ATOM 0 HB VAL A 86 15.236 -2.269 1.278 1.00 0.00 H new ATOM 0 HG11 VAL A 86 16.108 -0.583 2.845 1.00 0.00 H new ATOM 0 HG12 VAL A 86 16.368 -0.107 1.150 1.00 0.00 H new ATOM 0 HG13 VAL A 86 15.064 0.648 2.097 1.00 0.00 H new ATOM 0 HG21 VAL A 86 14.155 -1.962 3.469 1.00 0.00 H new ATOM 0 HG22 VAL A 86 13.030 -0.788 2.746 1.00 0.00 H new ATOM 0 HG23 VAL A 86 12.994 -2.490 2.229 1.00 0.00 H new ATOM 1272 N GLU A 87 15.603 -1.680 -1.452 1.00 0.00 N ATOM 1273 CA GLU A 87 16.626 -1.512 -2.477 1.00 0.00 C ATOM 1274 C GLU A 87 16.084 -0.720 -3.663 1.00 0.00 C ATOM 1275 O GLU A 87 16.825 -0.001 -4.334 1.00 0.00 O ATOM 1276 CB GLU A 87 17.135 -2.875 -2.950 1.00 0.00 C ATOM 1277 CG GLU A 87 18.321 -3.392 -2.152 1.00 0.00 C ATOM 1278 CD GLU A 87 19.240 -4.272 -2.977 1.00 0.00 C ATOM 1279 OE1 GLU A 87 19.692 -3.817 -4.049 1.00 0.00 O ATOM 1280 OE2 GLU A 87 19.507 -5.415 -2.551 1.00 0.00 O ATOM 0 H GLU A 87 15.401 -2.651 -1.212 1.00 0.00 H new ATOM 0 HA GLU A 87 17.454 -0.955 -2.039 1.00 0.00 H new ATOM 0 HB2 GLU A 87 16.322 -3.599 -2.887 1.00 0.00 H new ATOM 0 HB3 GLU A 87 17.418 -2.803 -4.000 1.00 0.00 H new ATOM 0 HG2 GLU A 87 18.888 -2.547 -1.761 1.00 0.00 H new ATOM 0 HG3 GLU A 87 17.958 -3.957 -1.293 1.00 0.00 H new ATOM 1287 N ILE A 88 14.786 -0.857 -3.915 1.00 0.00 N ATOM 1288 CA ILE A 88 14.144 -0.155 -5.019 1.00 0.00 C ATOM 1289 C ILE A 88 14.040 1.340 -4.733 1.00 0.00 C ATOM 1290 O ILE A 88 14.162 2.166 -5.638 1.00 0.00 O ATOM 1291 CB ILE A 88 12.736 -0.712 -5.298 1.00 0.00 C ATOM 1292 CG1 ILE A 88 12.831 -2.078 -5.981 1.00 0.00 C ATOM 1293 CG2 ILE A 88 11.942 0.261 -6.156 1.00 0.00 C ATOM 1294 CD1 ILE A 88 11.662 -2.989 -5.675 1.00 0.00 C ATOM 0 H ILE A 88 14.159 -1.448 -3.369 1.00 0.00 H new ATOM 0 HA ILE A 88 14.768 -0.312 -5.899 1.00 0.00 H new ATOM 0 HB ILE A 88 12.216 -0.837 -4.348 1.00 0.00 H new ATOM 0 HG12 ILE A 88 12.895 -1.932 -7.059 1.00 0.00 H new ATOM 0 HG13 ILE A 88 13.754 -2.567 -5.670 1.00 0.00 H new ATOM 0 HG21 ILE A 88 10.949 -0.147 -6.345 1.00 0.00 H new ATOM 0 HG22 ILE A 88 11.850 1.214 -5.635 1.00 0.00 H new ATOM 0 HG23 ILE A 88 12.457 0.414 -7.104 1.00 0.00 H new ATOM 0 HD11 ILE A 88 11.796 -3.939 -6.192 1.00 0.00 H new ATOM 0 HD12 ILE A 88 11.609 -3.165 -4.601 1.00 0.00 H new ATOM 0 HD13 ILE A 88 10.737 -2.520 -6.012 1.00 0.00 H new ATOM 1306 N LEU A 89 13.815 1.680 -3.469 1.00 0.00 N ATOM 1307 CA LEU A 89 13.696 3.076 -3.062 1.00 0.00 C ATOM 1308 C LEU A 89 15.067 3.741 -2.991 1.00 0.00 C ATOM 1309 O LEU A 89 15.189 4.956 -3.148 1.00 0.00 O ATOM 1310 CB LEU A 89 12.998 3.174 -1.705 1.00 0.00 C ATOM 1311 CG LEU A 89 11.471 3.249 -1.739 1.00 0.00 C ATOM 1312 CD1 LEU A 89 10.890 2.935 -0.370 1.00 0.00 C ATOM 1313 CD2 LEU A 89 11.015 4.622 -2.212 1.00 0.00 C ATOM 0 H LEU A 89 13.711 1.009 -2.708 1.00 0.00 H new ATOM 0 HA LEU A 89 13.098 3.597 -3.810 1.00 0.00 H new ATOM 0 HB2 LEU A 89 13.286 2.309 -1.108 1.00 0.00 H new ATOM 0 HB3 LEU A 89 13.374 4.057 -1.189 1.00 0.00 H new ATOM 0 HG LEU A 89 11.106 2.503 -2.445 1.00 0.00 H new ATOM 0 HD11 LEU A 89 9.802 2.993 -0.414 1.00 0.00 H new ATOM 0 HD12 LEU A 89 11.188 1.930 -0.070 1.00 0.00 H new ATOM 0 HD13 LEU A 89 11.263 3.656 0.358 1.00 0.00 H new ATOM 0 HD21 LEU A 89 9.926 4.657 -2.230 1.00 0.00 H new ATOM 0 HD22 LEU A 89 11.392 5.385 -1.531 1.00 0.00 H new ATOM 0 HD23 LEU A 89 11.401 4.808 -3.214 1.00 0.00 H new ATOM 1325 N LYS A 90 16.098 2.936 -2.755 1.00 0.00 N ATOM 1326 CA LYS A 90 17.461 3.445 -2.666 1.00 0.00 C ATOM 1327 C LYS A 90 18.091 3.558 -4.051 1.00 0.00 C ATOM 1328 O LYS A 90 18.948 4.409 -4.285 1.00 0.00 O ATOM 1329 CB LYS A 90 18.312 2.531 -1.781 1.00 0.00 C ATOM 1330 CG LYS A 90 18.280 2.909 -0.310 1.00 0.00 C ATOM 1331 CD LYS A 90 17.155 2.198 0.424 1.00 0.00 C ATOM 1332 CE LYS A 90 15.864 3.001 0.376 1.00 0.00 C ATOM 1333 NZ LYS A 90 15.827 4.056 1.426 1.00 0.00 N ATOM 0 H LYS A 90 16.015 1.928 -2.622 1.00 0.00 H new ATOM 0 HA LYS A 90 17.422 4.439 -2.221 1.00 0.00 H new ATOM 0 HB2 LYS A 90 17.963 1.504 -1.892 1.00 0.00 H new ATOM 0 HB3 LYS A 90 19.344 2.557 -2.132 1.00 0.00 H new ATOM 0 HG2 LYS A 90 19.234 2.656 0.152 1.00 0.00 H new ATOM 0 HG3 LYS A 90 18.154 3.987 -0.213 1.00 0.00 H new ATOM 0 HD2 LYS A 90 16.991 1.217 -0.022 1.00 0.00 H new ATOM 0 HD3 LYS A 90 17.444 2.033 1.462 1.00 0.00 H new ATOM 0 HE2 LYS A 90 15.760 3.462 -0.606 1.00 0.00 H new ATOM 0 HE3 LYS A 90 15.014 2.330 0.505 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 14.931 4.581 1.360 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 15.901 3.614 2.365 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 16.623 4.711 1.288 1.00 0.00 H new ATOM 1347 N ALA A 91 17.658 2.696 -4.965 1.00 0.00 N ATOM 1348 CA ALA A 91 18.177 2.702 -6.327 1.00 0.00 C ATOM 1349 C ALA A 91 17.444 3.723 -7.189 1.00 0.00 C ATOM 1350 O ALA A 91 17.971 4.193 -8.197 1.00 0.00 O ATOM 1351 CB ALA A 91 18.067 1.314 -6.940 1.00 0.00 C ATOM 0 H ALA A 91 16.949 1.985 -4.787 1.00 0.00 H new ATOM 0 HA ALA A 91 19.228 2.987 -6.288 1.00 0.00 H new ATOM 0 HB1 ALA A 91 18.458 1.333 -7.957 1.00 0.00 H new ATOM 0 HB2 ALA A 91 18.642 0.606 -6.343 1.00 0.00 H new ATOM 0 HB3 ALA A 91 17.021 1.007 -6.959 1.00 0.00 H new ATOM 1357 N VAL A 92 16.223 4.062 -6.787 1.00 0.00 N ATOM 1358 CA VAL A 92 15.416 5.028 -7.524 1.00 0.00 C ATOM 1359 C VAL A 92 16.129 6.372 -7.630 1.00 0.00 C ATOM 1360 O VAL A 92 16.667 6.896 -6.654 1.00 0.00 O ATOM 1361 CB VAL A 92 14.044 5.239 -6.856 1.00 0.00 C ATOM 1362 CG1 VAL A 92 14.173 6.149 -5.644 1.00 0.00 C ATOM 1363 CG2 VAL A 92 13.047 5.806 -7.855 1.00 0.00 C ATOM 0 H VAL A 92 15.771 3.682 -5.955 1.00 0.00 H new ATOM 0 HA VAL A 92 15.266 4.619 -8.523 1.00 0.00 H new ATOM 0 HB VAL A 92 13.673 4.272 -6.516 1.00 0.00 H new ATOM 0 HG11 VAL A 92 13.193 6.286 -5.186 1.00 0.00 H new ATOM 0 HG12 VAL A 92 14.852 5.697 -4.921 1.00 0.00 H new ATOM 0 HG13 VAL A 92 14.566 7.117 -5.956 1.00 0.00 H new ATOM 0 HG21 VAL A 92 12.083 5.949 -7.366 1.00 0.00 H new ATOM 0 HG22 VAL A 92 13.410 6.764 -8.228 1.00 0.00 H new ATOM 0 HG23 VAL A 92 12.932 5.112 -8.688 1.00 0.00 H new ATOM 1373 N PRO A 93 16.134 6.945 -8.842 1.00 0.00 N ATOM 1374 CA PRO A 93 16.776 8.236 -9.105 1.00 0.00 C ATOM 1375 C PRO A 93 16.034 9.397 -8.452 1.00 0.00 C ATOM 1376 O PRO A 93 14.844 9.311 -8.146 1.00 0.00 O ATOM 1377 CB PRO A 93 16.721 8.356 -10.630 1.00 0.00 C ATOM 1378 CG PRO A 93 15.561 7.513 -11.034 1.00 0.00 C ATOM 1379 CD PRO A 93 15.513 6.377 -10.050 1.00 0.00 C ATOM 0 HA PRO A 93 17.786 8.279 -8.697 1.00 0.00 H new ATOM 0 HB2 PRO A 93 16.585 9.392 -10.941 1.00 0.00 H new ATOM 0 HB3 PRO A 93 17.645 8.004 -11.089 1.00 0.00 H new ATOM 0 HG2 PRO A 93 14.635 8.087 -11.013 1.00 0.00 H new ATOM 0 HG3 PRO A 93 15.683 7.143 -12.052 1.00 0.00 H new ATOM 0 HD2 PRO A 93 14.490 6.052 -9.861 1.00 0.00 H new ATOM 0 HD3 PRO A 93 16.061 5.508 -10.413 1.00 0.00 H new ATOM 1387 N PRO A 94 16.749 10.510 -8.232 1.00 0.00 N ATOM 1388 CA PRO A 94 16.177 11.710 -7.614 1.00 0.00 C ATOM 1389 C PRO A 94 15.180 12.413 -8.528 1.00 0.00 C ATOM 1390 O PRO A 94 15.005 12.030 -9.684 1.00 0.00 O ATOM 1391 CB PRO A 94 17.399 12.599 -7.370 1.00 0.00 C ATOM 1392 CG PRO A 94 18.398 12.157 -8.382 1.00 0.00 C ATOM 1393 CD PRO A 94 18.172 10.683 -8.571 1.00 0.00 C ATOM 0 HA PRO A 94 15.616 11.475 -6.709 1.00 0.00 H new ATOM 0 HB2 PRO A 94 17.152 13.654 -7.492 1.00 0.00 H new ATOM 0 HB3 PRO A 94 17.781 12.477 -6.357 1.00 0.00 H new ATOM 0 HG2 PRO A 94 18.267 12.695 -9.321 1.00 0.00 H new ATOM 0 HG3 PRO A 94 19.414 12.355 -8.040 1.00 0.00 H new ATOM 0 HD2 PRO A 94 18.382 10.372 -9.594 1.00 0.00 H new ATOM 0 HD3 PRO A 94 18.815 10.091 -7.920 1.00 0.00 H new ATOM 1401 N GLY A 95 14.528 13.446 -8.001 1.00 0.00 N ATOM 1402 CA GLY A 95 13.556 14.186 -8.784 1.00 0.00 C ATOM 1403 C GLY A 95 12.136 13.710 -8.548 1.00 0.00 C ATOM 1404 O GLY A 95 11.842 13.097 -7.521 1.00 0.00 O ATOM 0 H GLY A 95 14.656 13.783 -7.047 1.00 0.00 H new ATOM 0 HA2 GLY A 95 13.626 15.245 -8.537 1.00 0.00 H new ATOM 0 HA3 GLY A 95 13.797 14.089 -9.843 1.00 0.00 H new ATOM 1408 N LEU A 96 11.253 13.993 -9.499 1.00 0.00 N ATOM 1409 CA LEU A 96 9.855 13.591 -9.389 1.00 0.00 C ATOM 1410 C LEU A 96 9.738 12.088 -9.152 1.00 0.00 C ATOM 1411 O LEU A 96 10.336 11.287 -9.870 1.00 0.00 O ATOM 1412 CB LEU A 96 9.091 13.979 -10.656 1.00 0.00 C ATOM 1413 CG LEU A 96 7.566 13.964 -10.551 1.00 0.00 C ATOM 1414 CD1 LEU A 96 7.075 12.597 -10.100 1.00 0.00 C ATOM 1415 CD2 LEU A 96 7.086 15.047 -9.595 1.00 0.00 C ATOM 0 H LEU A 96 11.480 14.499 -10.355 1.00 0.00 H new ATOM 0 HA LEU A 96 9.419 14.111 -8.536 1.00 0.00 H new ATOM 0 HB2 LEU A 96 9.405 14.980 -10.953 1.00 0.00 H new ATOM 0 HB3 LEU A 96 9.387 13.301 -11.457 1.00 0.00 H new ATOM 0 HG LEU A 96 7.151 14.169 -11.538 1.00 0.00 H new ATOM 0 HD11 LEU A 96 5.987 12.606 -10.031 1.00 0.00 H new ATOM 0 HD12 LEU A 96 7.387 11.842 -10.822 1.00 0.00 H new ATOM 0 HD13 LEU A 96 7.499 12.362 -9.124 1.00 0.00 H new ATOM 0 HD21 LEU A 96 5.998 15.021 -9.533 1.00 0.00 H new ATOM 0 HD22 LEU A 96 7.510 14.873 -8.606 1.00 0.00 H new ATOM 0 HD23 LEU A 96 7.406 16.023 -9.961 1.00 0.00 H new ATOM 1427 N VAL A 97 8.962 11.713 -8.140 1.00 0.00 N ATOM 1428 CA VAL A 97 8.763 10.307 -7.810 1.00 0.00 C ATOM 1429 C VAL A 97 7.297 9.912 -7.948 1.00 0.00 C ATOM 1430 O VAL A 97 6.459 10.302 -7.135 1.00 0.00 O ATOM 1431 CB VAL A 97 9.235 9.995 -6.377 1.00 0.00 C ATOM 1432 CG1 VAL A 97 8.965 8.538 -6.031 1.00 0.00 C ATOM 1433 CG2 VAL A 97 10.711 10.324 -6.219 1.00 0.00 C ATOM 0 H VAL A 97 8.461 12.363 -7.535 1.00 0.00 H new ATOM 0 HA VAL A 97 9.360 9.729 -8.515 1.00 0.00 H new ATOM 0 HB VAL A 97 8.671 10.619 -5.683 1.00 0.00 H new ATOM 0 HG11 VAL A 97 9.305 8.336 -5.015 1.00 0.00 H new ATOM 0 HG12 VAL A 97 7.896 8.339 -6.102 1.00 0.00 H new ATOM 0 HG13 VAL A 97 9.501 7.893 -6.728 1.00 0.00 H new ATOM 0 HG21 VAL A 97 11.027 10.097 -5.201 1.00 0.00 H new ATOM 0 HG22 VAL A 97 11.294 9.728 -6.921 1.00 0.00 H new ATOM 0 HG23 VAL A 97 10.871 11.383 -6.422 1.00 0.00 H new ATOM 1443 N HIS A 98 6.995 9.135 -8.983 1.00 0.00 N ATOM 1444 CA HIS A 98 5.629 8.685 -9.228 1.00 0.00 C ATOM 1445 C HIS A 98 5.399 7.298 -8.637 1.00 0.00 C ATOM 1446 O HIS A 98 5.789 6.288 -9.225 1.00 0.00 O ATOM 1447 CB HIS A 98 5.337 8.667 -10.729 1.00 0.00 C ATOM 1448 CG HIS A 98 4.976 10.011 -11.285 1.00 0.00 C ATOM 1449 ND1 HIS A 98 5.567 10.541 -12.413 1.00 0.00 N ATOM 1450 CD2 HIS A 98 4.079 10.932 -10.863 1.00 0.00 C ATOM 1451 CE1 HIS A 98 5.049 11.731 -12.659 1.00 0.00 C ATOM 1452 NE2 HIS A 98 4.143 11.992 -11.734 1.00 0.00 N ATOM 0 H HIS A 98 7.677 8.804 -9.665 1.00 0.00 H new ATOM 0 HA HIS A 98 4.950 9.385 -8.741 1.00 0.00 H new ATOM 0 HB2 HIS A 98 6.212 8.288 -11.257 1.00 0.00 H new ATOM 0 HB3 HIS A 98 4.521 7.971 -10.924 1.00 0.00 H new ATOM 0 HD2 HIS A 98 3.433 10.849 -10.002 1.00 0.00 H new ATOM 0 HE1 HIS A 98 5.320 12.381 -13.478 1.00 0.00 H new ATOM 0 HE2 HIS A 98 3.582 12.842 -11.676 1.00 0.00 H new ATOM 1461 N LEU A 99 4.766 7.255 -7.470 1.00 0.00 N ATOM 1462 CA LEU A 99 4.485 5.991 -6.798 1.00 0.00 C ATOM 1463 C LEU A 99 3.001 5.869 -6.466 1.00 0.00 C ATOM 1464 O LEU A 99 2.381 6.817 -5.987 1.00 0.00 O ATOM 1465 CB LEU A 99 5.316 5.875 -5.519 1.00 0.00 C ATOM 1466 CG LEU A 99 5.137 6.999 -4.498 1.00 0.00 C ATOM 1467 CD1 LEU A 99 3.915 6.742 -3.630 1.00 0.00 C ATOM 1468 CD2 LEU A 99 6.384 7.141 -3.637 1.00 0.00 C ATOM 0 H LEU A 99 4.438 8.081 -6.969 1.00 0.00 H new ATOM 0 HA LEU A 99 4.755 5.180 -7.475 1.00 0.00 H new ATOM 0 HB2 LEU A 99 5.071 4.929 -5.035 1.00 0.00 H new ATOM 0 HB3 LEU A 99 6.369 5.828 -5.797 1.00 0.00 H new ATOM 0 HG LEU A 99 4.984 7.933 -5.038 1.00 0.00 H new ATOM 0 HD11 LEU A 99 3.804 7.552 -2.909 1.00 0.00 H new ATOM 0 HD12 LEU A 99 3.026 6.691 -4.259 1.00 0.00 H new ATOM 0 HD13 LEU A 99 4.038 5.798 -3.099 1.00 0.00 H new ATOM 0 HD21 LEU A 99 6.239 7.946 -2.916 1.00 0.00 H new ATOM 0 HD22 LEU A 99 6.568 6.207 -3.106 1.00 0.00 H new ATOM 0 HD23 LEU A 99 7.240 7.372 -4.271 1.00 0.00 H new ATOM 1480 N GLY A 100 2.438 4.692 -6.722 1.00 0.00 N ATOM 1481 CA GLY A 100 1.032 4.466 -6.443 1.00 0.00 C ATOM 1482 C GLY A 100 0.792 3.989 -5.024 1.00 0.00 C ATOM 1483 O GLY A 100 1.514 3.127 -4.522 1.00 0.00 O ATOM 0 H GLY A 100 2.931 3.891 -7.118 1.00 0.00 H new ATOM 0 HA2 GLY A 100 0.478 5.390 -6.611 1.00 0.00 H new ATOM 0 HA3 GLY A 100 0.640 3.728 -7.142 1.00 0.00 H new ATOM 1487 N ILE A 101 -0.223 4.551 -4.377 1.00 0.00 N ATOM 1488 CA ILE A 101 -0.555 4.178 -3.007 1.00 0.00 C ATOM 1489 C ILE A 101 -1.955 3.578 -2.925 1.00 0.00 C ATOM 1490 O ILE A 101 -2.748 3.696 -3.860 1.00 0.00 O ATOM 1491 CB ILE A 101 -0.470 5.388 -2.058 1.00 0.00 C ATOM 1492 CG1 ILE A 101 0.856 6.125 -2.254 1.00 0.00 C ATOM 1493 CG2 ILE A 101 -0.625 4.938 -0.612 1.00 0.00 C ATOM 1494 CD1 ILE A 101 2.062 5.326 -1.814 1.00 0.00 C ATOM 0 H ILE A 101 -0.830 5.266 -4.779 1.00 0.00 H new ATOM 0 HA ILE A 101 0.176 3.432 -2.697 1.00 0.00 H new ATOM 0 HB ILE A 101 -1.283 6.075 -2.293 1.00 0.00 H new ATOM 0 HG12 ILE A 101 0.966 6.384 -3.307 1.00 0.00 H new ATOM 0 HG13 ILE A 101 0.828 7.061 -1.697 1.00 0.00 H new ATOM 0 HG21 ILE A 101 -0.563 5.804 0.047 1.00 0.00 H new ATOM 0 HG22 ILE A 101 -1.593 4.453 -0.484 1.00 0.00 H new ATOM 0 HG23 ILE A 101 0.169 4.234 -0.363 1.00 0.00 H new ATOM 0 HD11 ILE A 101 2.967 5.910 -1.982 1.00 0.00 H new ATOM 0 HD12 ILE A 101 1.975 5.089 -0.754 1.00 0.00 H new ATOM 0 HD13 ILE A 101 2.115 4.401 -2.389 1.00 0.00 H new ATOM 1506 N CYS A 102 -2.252 2.937 -1.800 1.00 0.00 N ATOM 1507 CA CYS A 102 -3.558 2.319 -1.595 1.00 0.00 C ATOM 1508 C CYS A 102 -4.107 2.657 -0.213 1.00 0.00 C ATOM 1509 O CYS A 102 -3.627 2.147 0.799 1.00 0.00 O ATOM 1510 CB CYS A 102 -3.459 0.802 -1.760 1.00 0.00 C ATOM 1511 SG CYS A 102 -3.656 0.232 -3.465 1.00 0.00 S ATOM 0 H CYS A 102 -1.607 2.832 -1.017 1.00 0.00 H new ATOM 0 HA CYS A 102 -4.242 2.715 -2.346 1.00 0.00 H new ATOM 0 HB2 CYS A 102 -2.491 0.469 -1.386 1.00 0.00 H new ATOM 0 HB3 CYS A 102 -4.220 0.329 -1.140 1.00 0.00 H new ATOM 0 HG CYS A 102 -3.555 -1.063 -3.504 1.00 0.00 H new ATOM 1517 N SER A 103 -5.116 3.522 -0.178 1.00 0.00 N ATOM 1518 CA SER A 103 -5.728 3.933 1.080 1.00 0.00 C ATOM 1519 C SER A 103 -5.900 2.741 2.016 1.00 0.00 C ATOM 1520 O SER A 103 -6.707 1.847 1.759 1.00 0.00 O ATOM 1521 CB SER A 103 -7.084 4.593 0.821 1.00 0.00 C ATOM 1522 OG SER A 103 -7.534 5.300 1.963 1.00 0.00 O ATOM 0 H SER A 103 -5.527 3.952 -1.007 1.00 0.00 H new ATOM 0 HA SER A 103 -5.066 4.655 1.558 1.00 0.00 H new ATOM 0 HB2 SER A 103 -7.004 5.276 -0.025 1.00 0.00 H new ATOM 0 HB3 SER A 103 -7.816 3.833 0.549 1.00 0.00 H new ATOM 0 HG SER A 103 -8.401 5.714 1.771 1.00 0.00 H new ATOM 1528 N GLY A 104 -5.135 2.734 3.103 1.00 0.00 N ATOM 1529 CA GLY A 104 -5.217 1.647 4.061 1.00 0.00 C ATOM 1530 C GLY A 104 -5.630 2.120 5.441 1.00 0.00 C ATOM 1531 O GLY A 104 -6.235 3.180 5.601 1.00 0.00 O ATOM 0 H GLY A 104 -4.460 3.462 3.337 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -5.933 0.906 3.705 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -4.249 1.150 4.125 1.00 0.00 H new ATOM 1535 N PRO A 105 -5.303 1.321 6.467 1.00 0.00 N ATOM 1536 CA PRO A 105 -5.636 1.642 7.858 1.00 0.00 C ATOM 1537 C PRO A 105 -4.827 2.821 8.390 1.00 0.00 C ATOM 1538 O PRO A 105 -3.716 2.647 8.892 1.00 0.00 O ATOM 1539 CB PRO A 105 -5.275 0.361 8.614 1.00 0.00 C ATOM 1540 CG PRO A 105 -4.236 -0.296 7.772 1.00 0.00 C ATOM 1541 CD PRO A 105 -4.583 0.042 6.349 1.00 0.00 C ATOM 0 HA PRO A 105 -6.679 1.939 7.970 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -4.894 0.584 9.611 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -6.146 -0.282 8.742 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -3.240 0.066 8.028 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -4.233 -1.375 7.927 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -3.691 0.139 5.730 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -5.205 -0.729 5.893 1.00 0.00 H new ATOM 1549 N SER A 106 -5.391 4.019 8.277 1.00 0.00 N ATOM 1550 CA SER A 106 -4.720 5.227 8.743 1.00 0.00 C ATOM 1551 C SER A 106 -5.451 5.825 9.941 1.00 0.00 C ATOM 1552 O SER A 106 -6.680 5.869 9.974 1.00 0.00 O ATOM 1553 CB SER A 106 -4.636 6.257 7.616 1.00 0.00 C ATOM 1554 OG SER A 106 -5.899 6.442 6.999 1.00 0.00 O ATOM 0 H SER A 106 -6.311 4.179 7.867 1.00 0.00 H new ATOM 0 HA SER A 106 -3.711 4.956 9.053 1.00 0.00 H new ATOM 0 HB2 SER A 106 -4.279 7.207 8.013 1.00 0.00 H new ATOM 0 HB3 SER A 106 -3.909 5.929 6.873 1.00 0.00 H new ATOM 0 HG SER A 106 -5.819 7.106 6.283 1.00 0.00 H new ATOM 1560 N SER A 107 -4.683 6.286 10.924 1.00 0.00 N ATOM 1561 CA SER A 107 -5.256 6.879 12.127 1.00 0.00 C ATOM 1562 C SER A 107 -5.280 8.401 12.024 1.00 0.00 C ATOM 1563 O SER A 107 -4.496 8.996 11.286 1.00 0.00 O ATOM 1564 CB SER A 107 -4.459 6.452 13.361 1.00 0.00 C ATOM 1565 OG SER A 107 -4.983 7.045 14.537 1.00 0.00 O ATOM 0 H SER A 107 -3.663 6.260 10.911 1.00 0.00 H new ATOM 0 HA SER A 107 -6.282 6.523 12.225 1.00 0.00 H new ATOM 0 HB2 SER A 107 -4.483 5.366 13.456 1.00 0.00 H new ATOM 0 HB3 SER A 107 -3.414 6.738 13.240 1.00 0.00 H new ATOM 0 HG SER A 107 -4.457 6.755 15.312 1.00 0.00 H new ATOM 1571 N GLY A 108 -6.185 9.025 12.772 1.00 0.00 N ATOM 1572 CA GLY A 108 -6.295 10.472 12.751 1.00 0.00 C ATOM 1573 C GLY A 108 -6.902 11.025 14.024 1.00 0.00 C ATOM 1574 O GLY A 108 -7.673 11.984 13.987 1.00 0.00 O ATOM 0 H GLY A 108 -6.844 8.554 13.392 1.00 0.00 H new ATOM 0 HA2 GLY A 108 -5.306 10.906 12.605 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -6.905 10.775 11.900 1.00 0.00 H new TER 1578 GLY A 108