USER MOD reduce.3.24.130724 H: found=0, std=0, add=879, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 881 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 114 THR OG1 : rot -120:sc= 0.475 USER MOD Set 1.2: A 135 ASN : amide:sc= 0.53 K(o=1,f=0.24) USER MOD Set 2.1: A 97 ASN : amide:sc= 0.101 K(o=0.9,f=-2.4!) USER MOD Set 2.2: A 102 THR OG1 : rot -69:sc= 0.796 USER MOD Set 3.1: A 81 SER OG : rot -21:sc= 0.611 USER MOD Set 3.2: A 82 GLN : amide:sc= 0.0483 X(o=0.66,f=0.45) USER MOD Set 4.1: A 70 THR OG1 : rot -170:sc= 0.606 USER MOD Set 4.2: A 72 SER OG : rot -68:sc= 1.12 USER MOD Set 5.1: A 2 GLN : amide:sc= 1.06 K(o=2.2,f=-1.6) USER MOD Set 5.2: A 20 SER OG : rot -83:sc= 1.18 USER MOD Single : A 4 THR OG1 : rot 180:sc= 0.0872 USER MOD Single : A 7 ASN : amide:sc= 0.501 K(o=0.5,f=-3!) USER MOD Single : A 13 SER OG : rot -66:sc= 0.711 USER MOD Single : A 18 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 47 THR OG1 : rot 140:sc= -0.035 USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 63 SER OG : rot 45:sc= 0.419 USER MOD Single : A 64 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 66 SER OG : rot -26:sc= 0.188 USER MOD Single : A 84 LYS NZ :NH3+ -136:sc= 1.43 (180deg=0.514) USER MOD Single : A 88 SER OG : rot 180:sc= 0.127 USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 115 TYR OH : rot 180:sc= 0 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 SER OG : rot -104:sc= 1.23 USER MOD Single : A 119 TYR OH : rot 180:sc= 0 USER MOD Single : A 127 SER OG : rot 25:sc= 0.0992 USER MOD Single : A 136 HIS : no HE2:sc= 0.376 K(o=0.38,f=-1.4) USER MOD Single : A 139 THR OG1 : rot 180:sc= -0.0519 USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 144 ASN : amide:sc= 0.811 K(o=0.81,f=-0.48) USER MOD ----------------------------------------------------------------- ATOM 13 N GLN A 2 -12.253 14.494 4.021 1.00 25.00 N ATOM 14 CA GLN A 2 -10.935 14.215 3.416 1.00 25.00 C ATOM 15 C GLN A 2 -9.857 15.060 4.112 1.00 25.00 C ATOM 16 O GLN A 2 -10.159 15.815 5.037 1.00 25.00 O ATOM 17 CB GLN A 2 -10.925 14.449 1.893 1.00 25.00 C ATOM 18 CG GLN A 2 -11.987 13.658 1.130 1.00 25.00 C ATOM 19 CD GLN A 2 -11.784 13.750 -0.360 1.00 25.00 C ATOM 20 OE1 GLN A 2 -11.298 12.821 -0.983 1.00 25.00 O ATOM 21 NE2 GLN A 2 -12.119 14.876 -0.929 1.00 25.00 N ATOM 0 HA GLN A 2 -10.716 13.158 3.565 1.00 25.00 H new ATOM 0 HB2 GLN A 2 -11.071 15.512 1.699 1.00 25.00 H new ATOM 0 HB3 GLN A 2 -9.942 14.186 1.503 1.00 25.00 H new ATOM 0 HG2 GLN A 2 -11.954 12.613 1.438 1.00 25.00 H new ATOM 0 HG3 GLN A 2 -12.977 14.035 1.387 1.00 25.00 H new ATOM 0 HE21 GLN A 2 -12.523 15.629 -0.372 1.00 25.00 H new ATOM 0 HE22 GLN A 2 -11.977 15.003 -1.931 1.00 25.00 H new ATOM 30 N GLY A 3 -8.614 14.881 3.703 1.00 25.00 N ATOM 31 CA GLY A 3 -7.508 15.596 4.313 1.00 25.00 C ATOM 32 C GLY A 3 -7.022 16.729 3.433 1.00 25.00 C ATOM 33 O GLY A 3 -7.516 16.924 2.324 1.00 25.00 O ATOM 0 H GLY A 3 -8.345 14.247 2.951 1.00 25.00 H new ATOM 0 HA2 GLY A 3 -7.820 15.993 5.279 1.00 25.00 H new ATOM 0 HA3 GLY A 3 -6.687 14.904 4.502 1.00 25.00 H new ATOM 37 N THR A 4 -6.033 17.450 3.924 1.00 25.00 N ATOM 38 CA THR A 4 -5.439 18.571 3.204 1.00 25.00 C ATOM 39 C THR A 4 -3.925 18.399 3.316 1.00 25.00 C ATOM 40 O THR A 4 -3.453 17.354 3.775 1.00 25.00 O ATOM 41 CB THR A 4 -5.958 19.924 3.787 1.00 25.00 C ATOM 42 OG1 THR A 4 -5.467 21.017 3.002 1.00 25.00 O ATOM 43 CG2 THR A 4 -5.536 20.130 5.247 1.00 25.00 C ATOM 0 H THR A 4 -5.613 17.278 4.838 1.00 25.00 H new ATOM 0 HA THR A 4 -5.721 18.588 2.151 1.00 25.00 H new ATOM 0 HB THR A 4 -7.047 19.888 3.752 1.00 25.00 H new ATOM 0 HG1 THR A 4 -5.798 21.861 3.373 1.00 25.00 H new ATOM 0 HG21 THR A 4 -5.921 21.084 5.606 1.00 25.00 H new ATOM 0 HG22 THR A 4 -5.938 19.323 5.859 1.00 25.00 H new ATOM 0 HG23 THR A 4 -4.448 20.129 5.315 1.00 25.00 H new ATOM 51 N ASP A 5 -3.149 19.375 2.893 1.00 25.00 N ATOM 52 CA ASP A 5 -1.701 19.279 3.012 1.00 25.00 C ATOM 53 C ASP A 5 -1.329 19.521 4.473 1.00 25.00 C ATOM 54 O ASP A 5 -1.961 20.299 5.163 1.00 25.00 O ATOM 55 CB ASP A 5 -1.009 20.274 2.079 1.00 25.00 C ATOM 56 CG ASP A 5 -1.034 19.818 0.631 1.00 25.00 C ATOM 57 OD1 ASP A 5 -1.453 18.648 0.378 1.00 25.00 O ATOM 58 OD2 ASP A 5 -0.594 20.578 -0.246 1.00 25.00 O ATOM 0 H ASP A 5 -3.488 20.238 2.467 1.00 25.00 H new ATOM 0 HA ASP A 5 -1.363 18.287 2.712 1.00 25.00 H new ATOM 0 HB2 ASP A 5 -1.497 21.245 2.160 1.00 25.00 H new ATOM 0 HB3 ASP A 5 0.025 20.409 2.397 1.00 25.00 H new ATOM 63 N GLY A 6 -0.363 18.759 4.959 1.00 25.00 N ATOM 64 CA GLY A 6 -0.052 18.732 6.383 1.00 25.00 C ATOM 65 C GLY A 6 -0.496 17.384 6.918 1.00 25.00 C ATOM 66 O GLY A 6 -0.926 16.539 6.131 1.00 25.00 O ATOM 0 H GLY A 6 0.222 18.149 4.388 1.00 25.00 H new ATOM 0 HA2 GLY A 6 1.016 18.877 6.546 1.00 25.00 H new ATOM 0 HA3 GLY A 6 -0.566 19.540 6.904 1.00 25.00 H new ATOM 70 N ASN A 7 -0.395 17.142 8.217 1.00 25.00 N ATOM 71 CA ASN A 7 -0.753 15.823 8.767 1.00 25.00 C ATOM 72 C ASN A 7 -2.234 15.784 9.130 1.00 25.00 C ATOM 73 O ASN A 7 -2.766 16.753 9.659 1.00 25.00 O ATOM 74 CB ASN A 7 0.088 15.518 10.009 1.00 25.00 C ATOM 75 CG ASN A 7 1.560 15.343 9.695 1.00 25.00 C ATOM 76 OD1 ASN A 7 1.987 15.380 8.546 1.00 25.00 O ATOM 77 ND2 ASN A 7 2.347 15.180 10.722 1.00 25.00 N ATOM 0 H ASN A 7 -0.075 17.822 8.907 1.00 25.00 H new ATOM 0 HA ASN A 7 -0.552 15.069 8.006 1.00 25.00 H new ATOM 0 HB2 ASN A 7 -0.031 16.327 10.730 1.00 25.00 H new ATOM 0 HB3 ASN A 7 -0.288 14.611 10.483 1.00 25.00 H new ATOM 0 HD21 ASN A 7 3.352 15.078 10.583 1.00 25.00 H new ATOM 0 HD22 ASN A 7 1.957 15.154 11.664 1.00 25.00 H new ATOM 84 N ASP A 8 -2.897 14.668 8.840 1.00 25.00 N ATOM 85 CA ASP A 8 -4.338 14.508 9.112 1.00 25.00 C ATOM 86 C ASP A 8 -4.634 13.176 9.795 1.00 25.00 C ATOM 87 O ASP A 8 -3.966 12.175 9.552 1.00 25.00 O ATOM 88 CB ASP A 8 -5.167 14.518 7.818 1.00 25.00 C ATOM 89 CG ASP A 8 -5.268 15.878 7.192 1.00 25.00 C ATOM 90 OD1 ASP A 8 -6.069 16.707 7.646 1.00 50.00 O ATOM 91 OD2 ASP A 8 -4.620 16.073 6.138 1.00 50.00 O ATOM 0 H ASP A 8 -2.462 13.850 8.413 1.00 25.00 H new ATOM 0 HA ASP A 8 -4.608 15.347 9.753 1.00 25.00 H new ATOM 0 HB2 ASP A 8 -4.720 13.828 7.102 1.00 25.00 H new ATOM 0 HB3 ASP A 8 -6.170 14.149 8.033 1.00 25.00 H new ATOM 96 N VAL A 9 -5.710 13.149 10.563 1.00 25.00 N ATOM 97 CA VAL A 9 -6.242 11.903 11.121 1.00 25.00 C ATOM 98 C VAL A 9 -7.687 11.873 10.654 1.00 25.00 C ATOM 99 O VAL A 9 -8.464 12.765 10.978 1.00 25.00 O ATOM 100 CB VAL A 9 -6.152 11.859 12.674 1.00 25.00 C ATOM 101 CG1 VAL A 9 -6.753 10.549 13.211 1.00 25.00 C ATOM 102 CG2 VAL A 9 -4.683 11.982 13.123 1.00 25.00 C ATOM 0 H VAL A 9 -6.241 13.981 10.820 1.00 25.00 H new ATOM 0 HA VAL A 9 -5.670 11.037 10.787 1.00 25.00 H new ATOM 0 HB VAL A 9 -6.721 12.697 13.077 1.00 25.00 H new ATOM 0 HG11 VAL A 9 -6.682 10.535 14.299 1.00 25.00 H new ATOM 0 HG12 VAL A 9 -7.800 10.481 12.915 1.00 25.00 H new ATOM 0 HG13 VAL A 9 -6.204 9.702 12.800 1.00 25.00 H new ATOM 0 HG21 VAL A 9 -4.631 11.950 14.211 1.00 25.00 H new ATOM 0 HG22 VAL A 9 -4.105 11.156 12.708 1.00 25.00 H new ATOM 0 HG23 VAL A 9 -4.272 12.927 12.768 1.00 25.00 H new ATOM 112 N LEU A 10 -8.016 10.910 9.808 1.00 25.00 N ATOM 113 CA LEU A 10 -9.327 10.845 9.179 1.00 25.00 C ATOM 114 C LEU A 10 -10.007 9.552 9.573 1.00 25.00 C ATOM 115 O LEU A 10 -9.394 8.496 9.511 1.00 25.00 O ATOM 116 CB LEU A 10 -9.171 10.897 7.656 1.00 25.00 C ATOM 117 CG LEU A 10 -8.443 12.135 7.108 1.00 25.00 C ATOM 118 CD1 LEU A 10 -8.187 11.955 5.623 1.00 25.00 C ATOM 119 CD2 LEU A 10 -9.236 13.426 7.352 1.00 25.00 C ATOM 0 H LEU A 10 -7.386 10.155 9.538 1.00 25.00 H new ATOM 0 HA LEU A 10 -9.930 11.691 9.508 1.00 25.00 H new ATOM 0 HB2 LEU A 10 -8.631 10.007 7.333 1.00 25.00 H new ATOM 0 HB3 LEU A 10 -10.162 10.850 7.205 1.00 25.00 H new ATOM 0 HG LEU A 10 -7.497 12.230 7.641 1.00 25.00 H new ATOM 0 HD11 LEU A 10 -7.671 12.833 5.234 1.00 25.00 H new ATOM 0 HD12 LEU A 10 -7.569 11.071 5.465 1.00 25.00 H new ATOM 0 HD13 LEU A 10 -9.137 11.832 5.102 1.00 25.00 H new ATOM 0 HD21 LEU A 10 -8.683 14.274 6.948 1.00 25.00 H new ATOM 0 HD22 LEU A 10 -10.205 13.356 6.858 1.00 25.00 H new ATOM 0 HD23 LEU A 10 -9.383 13.566 8.423 1.00 25.00 H new ATOM 131 N ILE A 11 -11.266 9.640 9.969 1.00 25.00 N ATOM 132 CA ILE A 11 -12.038 8.466 10.381 1.00 25.00 C ATOM 133 C ILE A 11 -13.333 8.436 9.571 1.00 25.00 C ATOM 134 O ILE A 11 -14.084 9.413 9.559 1.00 25.00 O ATOM 135 CB ILE A 11 -12.372 8.494 11.914 1.00 25.00 C ATOM 136 CG1 ILE A 11 -11.072 8.607 12.743 1.00 25.00 C ATOM 137 CG2 ILE A 11 -13.163 7.211 12.317 1.00 25.00 C ATOM 138 CD1 ILE A 11 -11.297 8.852 14.246 1.00 25.00 C ATOM 0 H ILE A 11 -11.784 10.517 10.016 1.00 25.00 H new ATOM 0 HA ILE A 11 -11.442 7.572 10.196 1.00 25.00 H new ATOM 0 HB ILE A 11 -12.993 9.365 12.121 1.00 25.00 H new ATOM 0 HG12 ILE A 11 -10.495 7.690 12.619 1.00 25.00 H new ATOM 0 HG13 ILE A 11 -10.468 9.421 12.341 1.00 25.00 H new ATOM 0 HG21 ILE A 11 -13.389 7.242 13.383 1.00 25.00 H new ATOM 0 HG22 ILE A 11 -14.093 7.164 11.750 1.00 25.00 H new ATOM 0 HG23 ILE A 11 -12.561 6.329 12.100 1.00 25.00 H new ATOM 0 HD11 ILE A 11 -10.334 8.918 14.752 1.00 25.00 H new ATOM 0 HD12 ILE A 11 -11.845 9.784 14.385 1.00 25.00 H new ATOM 0 HD13 ILE A 11 -11.872 8.027 14.667 1.00 25.00 H new ATOM 150 N GLY A 12 -13.566 7.334 8.873 1.00 25.00 N ATOM 151 CA GLY A 12 -14.754 7.186 8.053 1.00 25.00 C ATOM 152 C GLY A 12 -15.934 6.632 8.827 1.00 25.00 C ATOM 153 O GLY A 12 -15.778 5.961 9.845 1.00 25.00 O ATOM 0 H GLY A 12 -12.943 6.527 8.860 1.00 25.00 H new ATOM 0 HA2 GLY A 12 -15.023 8.155 7.632 1.00 25.00 H new ATOM 0 HA3 GLY A 12 -14.532 6.525 7.215 1.00 25.00 H new ATOM 157 N SER A 13 -17.120 6.910 8.321 1.00 25.00 N ATOM 158 CA SER A 13 -18.380 6.460 8.908 1.00 25.00 C ATOM 159 C SER A 13 -18.791 5.100 8.336 1.00 25.00 C ATOM 160 O SER A 13 -18.090 4.521 7.504 1.00 25.00 O ATOM 161 CB SER A 13 -19.470 7.490 8.609 1.00 25.00 C ATOM 162 OG SER A 13 -19.673 7.617 7.219 1.00 25.00 O ATOM 0 H SER A 13 -17.244 7.465 7.474 1.00 25.00 H new ATOM 0 HA SER A 13 -18.248 6.356 9.985 1.00 25.00 H new ATOM 0 HB2 SER A 13 -20.401 7.191 9.091 1.00 25.00 H new ATOM 0 HB3 SER A 13 -19.189 8.456 9.030 1.00 25.00 H new ATOM 0 HG SER A 13 -18.873 8.004 6.806 1.00 25.00 H new ATOM 168 N ASP A 14 -19.932 4.594 8.780 1.00 25.00 N ATOM 169 CA ASP A 14 -20.429 3.280 8.360 1.00 25.00 C ATOM 170 C ASP A 14 -20.764 3.147 6.873 1.00 25.00 C ATOM 171 O ASP A 14 -20.728 2.047 6.325 1.00 25.00 O ATOM 172 CB ASP A 14 -21.689 2.955 9.163 1.00 25.00 C ATOM 173 CG ASP A 14 -21.417 2.873 10.638 1.00 25.00 C ATOM 174 OD1 ASP A 14 -20.596 2.019 11.049 1.00 25.00 O ATOM 175 OD2 ASP A 14 -21.941 3.725 11.379 1.00 25.00 O ATOM 0 H ASP A 14 -20.542 5.076 9.440 1.00 25.00 H new ATOM 0 HA ASP A 14 -19.610 2.586 8.546 1.00 25.00 H new ATOM 0 HB2 ASP A 14 -22.444 3.719 8.976 1.00 25.00 H new ATOM 0 HB3 ASP A 14 -22.103 2.007 8.818 1.00 25.00 H new ATOM 180 N VAL A 15 -21.105 4.247 6.218 1.00 25.00 N ATOM 181 CA VAL A 15 -21.470 4.197 4.800 1.00 25.00 C ATOM 182 C VAL A 15 -20.205 4.121 3.942 1.00 25.00 C ATOM 183 O VAL A 15 -19.096 4.365 4.433 1.00 25.00 O ATOM 184 CB VAL A 15 -22.333 5.429 4.373 1.00 25.00 C ATOM 185 CG1 VAL A 15 -23.653 5.453 5.163 1.00 25.00 C ATOM 186 CG2 VAL A 15 -21.586 6.745 4.581 1.00 25.00 C ATOM 0 H VAL A 15 -21.138 5.177 6.635 1.00 25.00 H new ATOM 0 HA VAL A 15 -22.076 3.304 4.645 1.00 25.00 H new ATOM 0 HB VAL A 15 -22.544 5.326 3.309 1.00 25.00 H new ATOM 0 HG11 VAL A 15 -24.245 6.316 4.857 1.00 25.00 H new ATOM 0 HG12 VAL A 15 -24.213 4.539 4.964 1.00 25.00 H new ATOM 0 HG13 VAL A 15 -23.438 5.521 6.229 1.00 25.00 H new ATOM 0 HG21 VAL A 15 -22.220 7.576 4.272 1.00 25.00 H new ATOM 0 HG22 VAL A 15 -21.330 6.856 5.635 1.00 25.00 H new ATOM 0 HG23 VAL A 15 -20.674 6.744 3.985 1.00 25.00 H new ATOM 196 N GLY A 16 -20.360 3.787 2.670 1.00 25.00 N ATOM 197 CA GLY A 16 -19.221 3.761 1.768 1.00 25.00 C ATOM 198 C GLY A 16 -18.762 5.175 1.472 1.00 25.00 C ATOM 199 O GLY A 16 -19.592 6.076 1.352 1.00 25.00 O ATOM 0 H GLY A 16 -21.251 3.533 2.244 1.00 25.00 H new ATOM 0 HA2 GLY A 16 -18.406 3.191 2.214 1.00 25.00 H new ATOM 0 HA3 GLY A 16 -19.492 3.256 0.841 1.00 25.00 H new ATOM 203 N GLU A 17 -17.457 5.394 1.432 1.00 25.00 N ATOM 204 CA GLU A 17 -16.892 6.736 1.296 1.00 25.00 C ATOM 205 C GLU A 17 -15.659 6.732 0.400 1.00 25.00 C ATOM 206 O GLU A 17 -15.009 5.708 0.225 1.00 25.00 O ATOM 207 CB GLU A 17 -16.458 7.256 2.673 1.00 25.00 C ATOM 208 CG GLU A 17 -17.594 7.514 3.648 1.00 25.00 C ATOM 209 CD GLU A 17 -17.140 7.386 5.070 1.00 25.00 C ATOM 210 OE1 GLU A 17 -16.617 6.309 5.429 1.00 50.00 O ATOM 211 OE2 GLU A 17 -17.354 8.322 5.867 1.00 50.00 O ATOM 0 H GLU A 17 -16.759 4.653 1.492 1.00 25.00 H new ATOM 0 HA GLU A 17 -17.662 7.370 0.857 1.00 25.00 H new ATOM 0 HB2 GLU A 17 -15.774 6.534 3.118 1.00 25.00 H new ATOM 0 HB3 GLU A 17 -15.899 8.182 2.536 1.00 25.00 H new ATOM 0 HG2 GLU A 17 -17.996 8.513 3.482 1.00 25.00 H new ATOM 0 HG3 GLU A 17 -18.404 6.809 3.459 1.00 25.00 H new ATOM 218 N GLN A 18 -15.310 7.906 -0.100 1.00 25.00 N ATOM 219 CA GLN A 18 -14.081 8.110 -0.859 1.00 25.00 C ATOM 220 C GLN A 18 -13.258 9.105 -0.048 1.00 25.00 C ATOM 221 O GLN A 18 -13.711 10.226 0.208 1.00 25.00 O ATOM 222 CB GLN A 18 -14.412 8.658 -2.250 1.00 25.00 C ATOM 223 CG GLN A 18 -13.196 8.888 -3.132 1.00 25.00 C ATOM 224 CD GLN A 18 -13.589 9.401 -4.500 1.00 25.00 C ATOM 225 OE1 GLN A 18 -14.175 8.690 -5.299 1.00 25.00 O ATOM 226 NE2 GLN A 18 -13.304 10.652 -4.758 1.00 25.00 N ATOM 0 H GLN A 18 -15.872 8.750 0.008 1.00 25.00 H new ATOM 0 HA GLN A 18 -13.528 7.183 -1.012 1.00 25.00 H new ATOM 0 HB2 GLN A 18 -15.085 7.963 -2.752 1.00 25.00 H new ATOM 0 HB3 GLN A 18 -14.950 9.599 -2.139 1.00 25.00 H new ATOM 0 HG2 GLN A 18 -12.528 9.604 -2.652 1.00 25.00 H new ATOM 0 HG3 GLN A 18 -12.641 7.956 -3.238 1.00 25.00 H new ATOM 0 HE21 GLN A 18 -12.813 11.216 -4.065 1.00 25.00 H new ATOM 0 HE22 GLN A 18 -13.573 11.063 -5.652 1.00 25.00 H new ATOM 235 N ILE A 19 -12.107 8.664 0.441 1.00 25.00 N ATOM 236 CA ILE A 19 -11.306 9.456 1.369 1.00 25.00 C ATOM 237 C ILE A 19 -9.871 9.581 0.859 1.00 25.00 C ATOM 238 O ILE A 19 -9.191 8.580 0.650 1.00 25.00 O ATOM 239 CB ILE A 19 -11.266 8.783 2.788 1.00 25.00 C ATOM 240 CG1 ILE A 19 -12.699 8.486 3.293 1.00 25.00 C ATOM 241 CG2 ILE A 19 -10.518 9.692 3.806 1.00 25.00 C ATOM 242 CD1 ILE A 19 -12.760 7.617 4.567 1.00 25.00 C ATOM 0 H ILE A 19 -11.704 7.756 0.209 1.00 25.00 H new ATOM 0 HA ILE A 19 -11.767 10.441 1.443 1.00 25.00 H new ATOM 0 HB ILE A 19 -10.726 7.841 2.699 1.00 25.00 H new ATOM 0 HG12 ILE A 19 -13.205 9.431 3.488 1.00 25.00 H new ATOM 0 HG13 ILE A 19 -13.254 7.985 2.500 1.00 25.00 H new ATOM 0 HG21 ILE A 19 -10.501 9.208 4.782 1.00 25.00 H new ATOM 0 HG22 ILE A 19 -9.496 9.856 3.465 1.00 25.00 H new ATOM 0 HG23 ILE A 19 -11.032 10.650 3.885 1.00 25.00 H new ATOM 0 HD11 ILE A 19 -13.801 7.459 4.850 1.00 25.00 H new ATOM 0 HD12 ILE A 19 -12.286 6.655 4.374 1.00 25.00 H new ATOM 0 HD13 ILE A 19 -12.237 8.123 5.378 1.00 25.00 H new ATOM 254 N SER A 20 -9.394 10.806 0.711 1.00 25.00 N ATOM 255 CA SER A 20 -7.997 11.049 0.338 1.00 25.00 C ATOM 256 C SER A 20 -7.297 11.768 1.487 1.00 25.00 C ATOM 257 O SER A 20 -7.899 12.594 2.166 1.00 25.00 O ATOM 258 CB SER A 20 -7.915 11.883 -0.942 1.00 25.00 C ATOM 259 OG SER A 20 -8.590 13.112 -0.801 1.00 25.00 O ATOM 0 H SER A 20 -9.948 11.652 0.842 1.00 25.00 H new ATOM 0 HA SER A 20 -7.504 10.096 0.147 1.00 25.00 H new ATOM 0 HB2 SER A 20 -6.870 12.067 -1.191 1.00 25.00 H new ATOM 0 HB3 SER A 20 -8.347 11.322 -1.771 1.00 25.00 H new ATOM 0 HG SER A 20 -9.547 12.981 -0.969 1.00 25.00 H new ATOM 265 N GLY A 21 -6.033 11.427 1.727 1.00 25.00 N ATOM 266 CA GLY A 21 -5.284 12.025 2.830 1.00 25.00 C ATOM 267 C GLY A 21 -4.521 13.283 2.451 1.00 25.00 C ATOM 268 O GLY A 21 -4.167 14.101 3.313 1.00 25.00 O ATOM 0 H GLY A 21 -5.509 10.746 1.178 1.00 25.00 H new ATOM 0 HA2 GLY A 21 -5.976 12.262 3.638 1.00 25.00 H new ATOM 0 HA3 GLY A 21 -4.580 11.289 3.218 1.00 25.00 H new ATOM 272 N GLY A 22 -4.241 13.446 1.164 1.00 25.00 N ATOM 273 CA GLY A 22 -3.450 14.578 0.702 1.00 25.00 C ATOM 274 C GLY A 22 -1.970 14.403 1.025 1.00 25.00 C ATOM 275 O GLY A 22 -1.518 13.289 1.360 1.00 25.00 O ATOM 0 H GLY A 22 -4.548 12.812 0.426 1.00 25.00 H new ATOM 0 HA2 GLY A 22 -3.576 14.694 -0.374 1.00 25.00 H new ATOM 0 HA3 GLY A 22 -3.818 15.493 1.167 1.00 25.00 H new ATOM 279 N ALA A 23 -1.195 15.476 0.944 1.00 25.00 N ATOM 280 CA ALA A 23 0.219 15.401 1.295 1.00 25.00 C ATOM 281 C ALA A 23 0.348 15.258 2.816 1.00 25.00 C ATOM 282 O ALA A 23 -0.632 15.388 3.547 1.00 25.00 O ATOM 283 CB ALA A 23 0.960 16.648 0.807 1.00 25.00 C ATOM 0 H ALA A 23 -1.514 16.397 0.643 1.00 25.00 H new ATOM 0 HA ALA A 23 0.668 14.534 0.810 1.00 25.00 H new ATOM 0 HB1 ALA A 23 2.013 16.575 1.078 1.00 25.00 H new ATOM 0 HB2 ALA A 23 0.868 16.725 -0.276 1.00 25.00 H new ATOM 0 HB3 ALA A 23 0.527 17.534 1.272 1.00 25.00 H new ATOM 289 N GLY A 24 1.557 14.987 3.282 1.00 25.00 N ATOM 290 CA GLY A 24 1.815 14.859 4.710 1.00 25.00 C ATOM 291 C GLY A 24 1.568 13.459 5.246 1.00 25.00 C ATOM 292 O GLY A 24 1.124 12.571 4.501 1.00 25.00 O ATOM 0 H GLY A 24 2.378 14.851 2.692 1.00 25.00 H new ATOM 0 HA2 GLY A 24 2.849 15.140 4.911 1.00 25.00 H new ATOM 0 HA3 GLY A 24 1.183 15.563 5.250 1.00 25.00 H new ATOM 296 N ASP A 25 1.873 13.265 6.521 1.00 25.00 N ATOM 297 CA ASP A 25 1.727 11.967 7.183 1.00 25.00 C ATOM 298 C ASP A 25 0.307 11.834 7.686 1.00 25.00 C ATOM 299 O ASP A 25 -0.114 12.597 8.554 1.00 25.00 O ATOM 300 CB ASP A 25 2.671 11.838 8.382 1.00 25.00 C ATOM 301 CG ASP A 25 4.087 11.464 7.985 1.00 25.00 C ATOM 302 OD1 ASP A 25 4.542 11.816 6.872 1.00 25.00 O ATOM 303 OD2 ASP A 25 4.762 10.781 8.804 1.00 25.00 O ATOM 0 H ASP A 25 2.229 14.001 7.130 1.00 25.00 H new ATOM 0 HA ASP A 25 1.970 11.188 6.460 1.00 25.00 H new ATOM 0 HB2 ASP A 25 2.690 12.782 8.926 1.00 25.00 H new ATOM 0 HB3 ASP A 25 2.280 11.084 9.066 1.00 25.00 H new ATOM 308 N ASP A 26 -0.446 10.887 7.144 1.00 25.00 N ATOM 309 CA ASP A 26 -1.857 10.765 7.495 1.00 25.00 C ATOM 310 C ASP A 26 -2.238 9.378 7.985 1.00 25.00 C ATOM 311 O ASP A 26 -1.661 8.364 7.561 1.00 25.00 O ATOM 312 CB ASP A 26 -2.718 11.096 6.274 1.00 25.00 C ATOM 313 CG ASP A 26 -2.308 12.393 5.604 1.00 25.00 C ATOM 314 OD1 ASP A 26 -2.235 13.440 6.276 1.00 50.00 O ATOM 315 OD2 ASP A 26 -2.068 12.392 4.376 1.00 50.00 O ATOM 0 H ASP A 26 -0.111 10.200 6.469 1.00 25.00 H new ATOM 0 HA ASP A 26 -2.032 11.465 8.312 1.00 25.00 H new ATOM 0 HB2 ASP A 26 -2.648 10.281 5.553 1.00 25.00 H new ATOM 0 HB3 ASP A 26 -3.762 11.163 6.578 1.00 25.00 H new ATOM 320 N ARG A 27 -3.286 9.320 8.797 1.00 25.00 N ATOM 321 CA ARG A 27 -3.937 8.050 9.125 1.00 25.00 C ATOM 322 C ARG A 27 -5.316 8.135 8.518 1.00 25.00 C ATOM 323 O ARG A 27 -6.016 9.118 8.720 1.00 25.00 O ATOM 324 CB ARG A 27 -4.060 7.807 10.634 1.00 25.00 C ATOM 325 CG ARG A 27 -4.701 6.426 10.935 1.00 25.00 C ATOM 326 CD ARG A 27 -5.142 6.254 12.382 1.00 25.00 C ATOM 327 NE ARG A 27 -5.994 5.055 12.515 1.00 25.00 N ATOM 328 CZ ARG A 27 -5.583 3.826 12.811 1.00 25.00 C ATOM 329 NH1 ARG A 27 -4.325 3.541 13.045 1.00 25.00 N ATOM 330 NH2 ARG A 27 -6.459 2.870 12.862 1.00 25.00 N ATOM 0 H ARG A 27 -3.706 10.136 9.243 1.00 25.00 H new ATOM 0 HA ARG A 27 -3.343 7.222 8.738 1.00 25.00 H new ATOM 0 HB2 ARG A 27 -3.073 7.860 11.094 1.00 25.00 H new ATOM 0 HB3 ARG A 27 -4.664 8.596 11.083 1.00 25.00 H new ATOM 0 HG2 ARG A 27 -5.564 6.287 10.283 1.00 25.00 H new ATOM 0 HG3 ARG A 27 -3.985 5.642 10.688 1.00 25.00 H new ATOM 0 HD2 ARG A 27 -4.269 6.162 13.028 1.00 25.00 H new ATOM 0 HD3 ARG A 27 -5.690 7.137 12.711 1.00 25.00 H new ATOM 0 HE ARG A 27 -6.995 5.182 12.365 1.00 25.00 H new ATOM 0 HH11 ARG A 27 -3.619 4.276 13.003 1.00 25.00 H new ATOM 0 HH12 ARG A 27 -4.052 2.584 13.269 1.00 25.00 H new ATOM 0 HH21 ARG A 27 -7.442 3.069 12.677 1.00 25.00 H new ATOM 0 HH22 ARG A 27 -6.164 1.920 13.087 1.00 25.00 H new ATOM 344 N LEU A 28 -5.704 7.108 7.783 1.00 25.00 N ATOM 345 CA LEU A 28 -7.030 7.028 7.198 1.00 25.00 C ATOM 346 C LEU A 28 -7.695 5.799 7.793 1.00 25.00 C ATOM 347 O LEU A 28 -7.086 4.730 7.854 1.00 25.00 O ATOM 348 CB LEU A 28 -6.969 6.898 5.667 1.00 25.00 C ATOM 349 CG LEU A 28 -6.443 8.081 4.832 1.00 25.00 C ATOM 350 CD1 LEU A 28 -4.902 8.167 4.792 1.00 25.00 C ATOM 351 CD2 LEU A 28 -6.971 7.948 3.403 1.00 25.00 C ATOM 0 H LEU A 28 -5.109 6.306 7.575 1.00 25.00 H new ATOM 0 HA LEU A 28 -7.589 7.938 7.416 1.00 25.00 H new ATOM 0 HB2 LEU A 28 -6.349 6.032 5.436 1.00 25.00 H new ATOM 0 HB3 LEU A 28 -7.976 6.671 5.317 1.00 25.00 H new ATOM 0 HG LEU A 28 -6.799 8.994 5.310 1.00 25.00 H new ATOM 0 HD11 LEU A 28 -4.601 9.022 4.187 1.00 25.00 H new ATOM 0 HD12 LEU A 28 -4.518 8.286 5.805 1.00 25.00 H new ATOM 0 HD13 LEU A 28 -4.498 7.254 4.355 1.00 25.00 H new ATOM 0 HD21 LEU A 28 -6.606 8.780 2.801 1.00 25.00 H new ATOM 0 HD22 LEU A 28 -6.624 7.009 2.973 1.00 25.00 H new ATOM 0 HD23 LEU A 28 -8.061 7.960 3.415 1.00 25.00 H new ATOM 363 N ASP A 29 -8.934 5.952 8.217 1.00 25.00 N ATOM 364 CA ASP A 29 -9.733 4.860 8.756 1.00 25.00 C ATOM 365 C ASP A 29 -11.007 4.834 7.937 1.00 25.00 C ATOM 366 O ASP A 29 -11.559 5.884 7.643 1.00 25.00 O ATOM 367 CB ASP A 29 -10.066 5.120 10.228 1.00 25.00 C ATOM 368 CG ASP A 29 -9.556 4.034 11.133 1.00 25.00 C ATOM 369 OD1 ASP A 29 -9.963 2.869 10.964 1.00 25.00 O ATOM 370 OD2 ASP A 29 -8.724 4.340 12.025 1.00 25.00 O ATOM 0 H ASP A 29 -9.423 6.847 8.198 1.00 25.00 H new ATOM 0 HA ASP A 29 -9.197 3.912 8.703 1.00 25.00 H new ATOM 0 HB2 ASP A 29 -9.635 6.074 10.532 1.00 25.00 H new ATOM 0 HB3 ASP A 29 -11.146 5.207 10.343 1.00 25.00 H new ATOM 375 N GLY A 30 -11.444 3.659 7.523 1.00 25.00 N ATOM 376 CA GLY A 30 -12.603 3.551 6.648 1.00 25.00 C ATOM 377 C GLY A 30 -13.880 3.112 7.339 1.00 25.00 C ATOM 378 O GLY A 30 -14.974 3.488 6.915 1.00 25.00 O ATOM 0 H GLY A 30 -11.018 2.767 7.776 1.00 25.00 H new ATOM 0 HA2 GLY A 30 -12.776 4.518 6.175 1.00 25.00 H new ATOM 0 HA3 GLY A 30 -12.375 2.843 5.851 1.00 25.00 H new ATOM 382 N GLY A 31 -13.759 2.314 8.386 1.00 25.00 N ATOM 383 CA GLY A 31 -14.946 1.792 9.059 1.00 25.00 C ATOM 384 C GLY A 31 -15.711 0.824 8.173 1.00 25.00 C ATOM 385 O GLY A 31 -15.139 0.198 7.260 1.00 25.00 O ATOM 0 H GLY A 31 -12.870 2.015 8.786 1.00 25.00 H new ATOM 0 HA2 GLY A 31 -14.651 1.288 9.979 1.00 25.00 H new ATOM 0 HA3 GLY A 31 -15.597 2.619 9.343 1.00 25.00 H new ATOM 389 N ALA A 32 -17.007 0.684 8.423 1.00 25.00 N ATOM 390 CA ALA A 32 -17.852 -0.200 7.621 1.00 25.00 C ATOM 391 C ALA A 32 -18.097 0.423 6.237 1.00 25.00 C ATOM 392 O ALA A 32 -17.655 1.554 5.950 1.00 25.00 O ATOM 393 CB ALA A 32 -19.180 -0.469 8.351 1.00 25.00 C ATOM 0 H ALA A 32 -17.498 1.170 9.174 1.00 25.00 H new ATOM 0 HA ALA A 32 -17.344 -1.154 7.481 1.00 25.00 H new ATOM 0 HB1 ALA A 32 -19.801 -1.128 7.745 1.00 25.00 H new ATOM 0 HB2 ALA A 32 -18.978 -0.943 9.312 1.00 25.00 H new ATOM 0 HB3 ALA A 32 -19.703 0.473 8.514 1.00 25.00 H new ATOM 399 N GLY A 33 -18.772 -0.331 5.381 1.00 25.00 N ATOM 400 CA GLY A 33 -19.044 0.122 4.030 1.00 25.00 C ATOM 401 C GLY A 33 -17.848 -0.097 3.132 1.00 25.00 C ATOM 402 O GLY A 33 -16.721 -0.284 3.616 1.00 25.00 O ATOM 0 H GLY A 33 -19.139 -1.257 5.600 1.00 25.00 H new ATOM 0 HA2 GLY A 33 -19.906 -0.413 3.630 1.00 25.00 H new ATOM 0 HA3 GLY A 33 -19.304 1.180 4.043 1.00 25.00 H new ATOM 406 N ASP A 34 -18.080 -0.091 1.834 1.00 0.00 N ATOM 407 CA ASP A 34 -17.006 -0.287 0.867 1.00 25.00 C ATOM 408 C ASP A 34 -16.364 1.083 0.656 1.00 25.00 C ATOM 409 O ASP A 34 -17.072 2.047 0.396 1.00 25.00 O ATOM 410 CB ASP A 34 -17.567 -0.838 -0.453 1.00 25.00 C ATOM 411 CG ASP A 34 -18.060 -2.280 -0.323 1.00 25.00 C ATOM 412 OD1 ASP A 34 -17.887 -2.891 0.761 1.00 25.00 O ATOM 413 OD2 ASP A 34 -18.662 -2.790 -1.290 1.00 25.00 O ATOM 0 H ASP A 34 -19.002 0.047 1.420 1.00 0.00 H new ATOM 0 HA ASP A 34 -16.274 -1.010 1.226 1.00 25.00 H new ATOM 0 HB2 ASP A 34 -18.389 -0.205 -0.787 1.00 25.00 H new ATOM 0 HB3 ASP A 34 -16.795 -0.789 -1.221 1.00 25.00 H new ATOM 418 N ASP A 35 -15.060 1.194 0.870 1.00 25.00 N ATOM 419 CA ASP A 35 -14.399 2.505 0.866 1.00 25.00 C ATOM 420 C ASP A 35 -13.244 2.592 -0.120 1.00 25.00 C ATOM 421 O ASP A 35 -12.554 1.604 -0.395 1.00 25.00 O ATOM 422 CB ASP A 35 -13.857 2.830 2.267 1.00 25.00 C ATOM 423 CG ASP A 35 -14.943 2.857 3.326 1.00 25.00 C ATOM 424 OD1 ASP A 35 -15.886 3.667 3.232 1.00 50.00 O ATOM 425 OD2 ASP A 35 -14.832 2.094 4.318 1.00 50.00 O ATOM 0 H ASP A 35 -14.439 0.405 1.047 1.00 25.00 H new ATOM 0 HA ASP A 35 -15.160 3.223 0.560 1.00 25.00 H new ATOM 0 HB2 ASP A 35 -13.106 2.089 2.542 1.00 25.00 H new ATOM 0 HB3 ASP A 35 -13.356 3.798 2.242 1.00 25.00 H new ATOM 430 N LEU A 36 -12.998 3.802 -0.605 1.00 25.00 N ATOM 431 CA LEU A 36 -11.870 4.086 -1.486 1.00 25.00 C ATOM 432 C LEU A 36 -10.907 4.966 -0.701 1.00 25.00 C ATOM 433 O LEU A 36 -11.321 5.994 -0.158 1.00 25.00 O ATOM 434 CB LEU A 36 -12.345 4.816 -2.748 1.00 25.00 C ATOM 435 CG LEU A 36 -13.377 4.083 -3.622 1.00 25.00 C ATOM 436 CD1 LEU A 36 -14.802 4.578 -3.345 1.00 25.00 C ATOM 437 CD2 LEU A 36 -13.051 4.301 -5.100 1.00 25.00 C ATOM 0 H LEU A 36 -13.576 4.617 -0.399 1.00 25.00 H new ATOM 0 HA LEU A 36 -11.386 3.163 -1.804 1.00 25.00 H new ATOM 0 HB2 LEU A 36 -12.772 5.773 -2.447 1.00 25.00 H new ATOM 0 HB3 LEU A 36 -11.472 5.035 -3.363 1.00 25.00 H new ATOM 0 HG LEU A 36 -13.326 3.022 -3.377 1.00 25.00 H new ATOM 0 HD11 LEU A 36 -15.505 4.038 -3.980 1.00 25.00 H new ATOM 0 HD12 LEU A 36 -15.051 4.403 -2.298 1.00 25.00 H new ATOM 0 HD13 LEU A 36 -14.865 5.645 -3.560 1.00 25.00 H new ATOM 0 HD21 LEU A 36 -13.785 3.780 -5.715 1.00 25.00 H new ATOM 0 HD22 LEU A 36 -13.080 5.367 -5.326 1.00 25.00 H new ATOM 0 HD23 LEU A 36 -12.056 3.912 -5.314 1.00 25.00 H new ATOM 449 N LEU A 37 -9.655 4.551 -0.591 1.00 25.00 N ATOM 450 CA LEU A 37 -8.675 5.267 0.230 1.00 25.00 C ATOM 451 C LEU A 37 -7.418 5.659 -0.556 1.00 25.00 C ATOM 452 O LEU A 37 -6.641 4.799 -0.979 1.00 25.00 O ATOM 453 CB LEU A 37 -8.265 4.411 1.442 1.00 25.00 C ATOM 454 CG LEU A 37 -9.364 4.017 2.451 1.00 25.00 C ATOM 455 CD1 LEU A 37 -10.001 2.664 2.115 1.00 25.00 C ATOM 456 CD2 LEU A 37 -8.765 3.941 3.857 1.00 25.00 C ATOM 0 H LEU A 37 -9.287 3.722 -1.058 1.00 25.00 H new ATOM 0 HA LEU A 37 -9.160 6.185 0.562 1.00 25.00 H new ATOM 0 HB2 LEU A 37 -7.812 3.494 1.066 1.00 25.00 H new ATOM 0 HB3 LEU A 37 -7.489 4.950 1.986 1.00 25.00 H new ATOM 0 HG LEU A 37 -10.140 4.781 2.399 1.00 25.00 H new ATOM 0 HD11 LEU A 37 -10.768 2.430 2.853 1.00 25.00 H new ATOM 0 HD12 LEU A 37 -10.453 2.711 1.124 1.00 25.00 H new ATOM 0 HD13 LEU A 37 -9.236 1.888 2.129 1.00 25.00 H new ATOM 0 HD21 LEU A 37 -9.542 3.663 4.569 1.00 25.00 H new ATOM 0 HD22 LEU A 37 -7.972 3.193 3.875 1.00 25.00 H new ATOM 0 HD23 LEU A 37 -8.354 4.913 4.130 1.00 25.00 H new ATOM 468 N ASP A 38 -7.211 6.958 -0.711 1.00 25.00 N ATOM 469 CA ASP A 38 -6.045 7.499 -1.428 1.00 25.00 C ATOM 470 C ASP A 38 -5.034 8.065 -0.424 1.00 25.00 C ATOM 471 O ASP A 38 -5.321 9.031 0.294 1.00 25.00 O ATOM 472 CB ASP A 38 -6.461 8.627 -2.378 1.00 25.00 C ATOM 473 CG ASP A 38 -6.934 8.125 -3.734 1.00 25.00 C ATOM 474 OD1 ASP A 38 -7.412 6.978 -3.848 1.00 25.00 O ATOM 475 OD2 ASP A 38 -6.835 8.913 -4.697 1.00 25.00 O ATOM 0 H ASP A 38 -7.840 7.674 -0.347 1.00 25.00 H new ATOM 0 HA ASP A 38 -5.600 6.687 -2.003 1.00 25.00 H new ATOM 0 HB2 ASP A 38 -7.258 9.208 -1.915 1.00 25.00 H new ATOM 0 HB3 ASP A 38 -5.617 9.302 -2.522 1.00 25.00 H new ATOM 480 N GLY A 39 -3.845 7.484 -0.365 1.00 25.00 N ATOM 481 CA GLY A 39 -2.851 7.928 0.608 1.00 25.00 C ATOM 482 C GLY A 39 -2.304 9.335 0.383 1.00 25.00 C ATOM 483 O GLY A 39 -2.160 10.135 1.330 1.00 25.00 O ATOM 0 H GLY A 39 -3.546 6.717 -0.967 1.00 25.00 H new ATOM 0 HA2 GLY A 39 -3.294 7.883 1.603 1.00 25.00 H new ATOM 0 HA3 GLY A 39 -2.018 7.226 0.598 1.00 25.00 H new ATOM 487 N GLY A 40 -1.966 9.650 -0.860 1.00 25.00 N ATOM 488 CA GLY A 40 -1.381 10.945 -1.172 1.00 25.00 C ATOM 489 C GLY A 40 0.089 10.989 -0.793 1.00 25.00 C ATOM 490 O GLY A 40 0.613 10.057 -0.177 1.00 25.00 O ATOM 0 H GLY A 40 -2.086 9.032 -1.662 1.00 25.00 H new ATOM 0 HA2 GLY A 40 -1.491 11.150 -2.237 1.00 25.00 H new ATOM 0 HA3 GLY A 40 -1.920 11.728 -0.639 1.00 25.00 H new ATOM 494 N ALA A 41 0.767 12.078 -1.128 1.00 25.00 N ATOM 495 CA ALA A 41 2.191 12.220 -0.820 1.00 25.00 C ATOM 496 C ALA A 41 2.461 12.064 0.684 1.00 25.00 C ATOM 497 O ALA A 41 1.575 12.282 1.520 1.00 25.00 O ATOM 498 CB ALA A 41 2.702 13.572 -1.327 1.00 25.00 C ATOM 0 H ALA A 41 0.358 12.877 -1.612 1.00 25.00 H new ATOM 0 HA ALA A 41 2.731 11.423 -1.330 1.00 25.00 H new ATOM 0 HB1 ALA A 41 3.762 13.671 -1.094 1.00 25.00 H new ATOM 0 HB2 ALA A 41 2.560 13.633 -2.406 1.00 25.00 H new ATOM 0 HB3 ALA A 41 2.148 14.376 -0.842 1.00 25.00 H new ATOM 504 N GLY A 42 3.672 11.643 1.016 1.00 25.00 N ATOM 505 CA GLY A 42 4.041 11.362 2.402 1.00 25.00 C ATOM 506 C GLY A 42 3.718 9.922 2.765 1.00 25.00 C ATOM 507 O GLY A 42 3.022 9.236 2.003 1.00 25.00 O ATOM 0 H GLY A 42 4.422 11.487 0.343 1.00 25.00 H new ATOM 0 HA2 GLY A 42 5.106 11.548 2.544 1.00 25.00 H new ATOM 0 HA3 GLY A 42 3.507 12.039 3.070 1.00 25.00 H new ATOM 511 N ARG A 43 4.223 9.464 3.904 1.00 25.00 N ATOM 512 CA ARG A 43 3.960 8.094 4.373 1.00 25.00 C ATOM 513 C ARG A 43 2.597 8.095 5.031 1.00 25.00 C ATOM 514 O ARG A 43 2.208 9.089 5.630 1.00 25.00 O ATOM 515 CB ARG A 43 5.042 7.636 5.365 1.00 25.00 C ATOM 516 CG ARG A 43 5.121 8.484 6.625 1.00 25.00 C ATOM 517 CD ARG A 43 6.385 8.211 7.435 1.00 25.00 C ATOM 518 NE ARG A 43 7.583 8.795 6.809 1.00 25.00 N ATOM 519 CZ ARG A 43 8.022 10.040 6.965 1.00 25.00 C ATOM 520 NH1 ARG A 43 7.404 10.926 7.708 1.00 25.00 N ATOM 521 NH2 ARG A 43 9.113 10.395 6.357 1.00 25.00 N ATOM 0 H ARG A 43 4.817 10.014 4.525 1.00 25.00 H new ATOM 0 HA ARG A 43 3.980 7.397 3.535 1.00 25.00 H new ATOM 0 HB2 ARG A 43 4.848 6.601 5.647 1.00 25.00 H new ATOM 0 HB3 ARG A 43 6.010 7.654 4.865 1.00 25.00 H new ATOM 0 HG2 ARG A 43 5.089 9.539 6.352 1.00 25.00 H new ATOM 0 HG3 ARG A 43 4.246 8.289 7.246 1.00 25.00 H new ATOM 0 HD2 ARG A 43 6.266 8.619 8.439 1.00 25.00 H new ATOM 0 HD3 ARG A 43 6.521 7.135 7.542 1.00 25.00 H new ATOM 0 HE ARG A 43 8.128 8.187 6.198 1.00 25.00 H new ATOM 0 HH11 ARG A 43 6.546 10.672 8.198 1.00 25.00 H new ATOM 0 HH12 ARG A 43 7.781 11.870 7.796 1.00 25.00 H new ATOM 0 HH21 ARG A 43 9.614 9.724 5.775 1.00 25.00 H new ATOM 0 HH22 ARG A 43 9.469 11.345 6.462 1.00 25.00 H new ATOM 535 N ASP A 44 1.849 7.019 4.904 1.00 25.00 N ATOM 536 CA ASP A 44 0.483 6.972 5.425 1.00 25.00 C ATOM 537 C ASP A 44 0.174 5.631 6.052 1.00 25.00 C ATOM 538 O ASP A 44 0.883 4.654 5.820 1.00 25.00 O ATOM 539 CB ASP A 44 -0.505 7.242 4.291 1.00 25.00 C ATOM 540 CG ASP A 44 -0.304 8.603 3.675 1.00 25.00 C ATOM 541 OD1 ASP A 44 -0.492 9.613 4.369 1.00 50.00 O ATOM 542 OD2 ASP A 44 0.074 8.696 2.482 1.00 50.00 O ATOM 0 H ASP A 44 2.156 6.161 4.446 1.00 25.00 H new ATOM 0 HA ASP A 44 0.389 7.737 6.196 1.00 25.00 H new ATOM 0 HB2 ASP A 44 -0.392 6.477 3.523 1.00 25.00 H new ATOM 0 HB3 ASP A 44 -1.523 7.164 4.672 1.00 25.00 H new ATOM 547 N ARG A 45 -0.887 5.597 6.855 1.00 25.00 N ATOM 548 CA ARG A 45 -1.351 4.361 7.499 1.00 25.00 C ATOM 549 C ARG A 45 -2.824 4.237 7.166 1.00 25.00 C ATOM 550 O ARG A 45 -3.610 5.112 7.519 1.00 25.00 O ATOM 551 CB ARG A 45 -1.164 4.409 9.023 1.00 25.00 C ATOM 552 CG ARG A 45 0.282 4.177 9.493 1.00 25.00 C ATOM 553 CD ARG A 45 1.114 5.462 9.456 1.00 25.00 C ATOM 554 NE ARG A 45 2.450 5.265 10.037 1.00 25.00 N ATOM 555 CZ ARG A 45 3.372 6.213 10.171 1.00 25.00 C ATOM 556 NH1 ARG A 45 3.166 7.452 9.776 1.00 25.00 N ATOM 557 NH2 ARG A 45 4.514 5.911 10.711 1.00 25.00 N ATOM 0 H ARG A 45 -1.449 6.418 7.079 1.00 25.00 H new ATOM 0 HA ARG A 45 -0.775 3.509 7.139 1.00 25.00 H new ATOM 0 HB2 ARG A 45 -1.500 5.379 9.388 1.00 25.00 H new ATOM 0 HB3 ARG A 45 -1.807 3.656 9.480 1.00 25.00 H new ATOM 0 HG2 ARG A 45 0.273 3.781 10.508 1.00 25.00 H new ATOM 0 HG3 ARG A 45 0.752 3.423 8.861 1.00 25.00 H new ATOM 0 HD2 ARG A 45 1.213 5.801 8.425 1.00 25.00 H new ATOM 0 HD3 ARG A 45 0.593 6.248 10.002 1.00 25.00 H new ATOM 0 HE ARG A 45 2.688 4.328 10.363 1.00 25.00 H new ATOM 0 HH11 ARG A 45 2.275 7.710 9.351 1.00 25.00 H new ATOM 0 HH12 ARG A 45 3.897 8.153 9.895 1.00 25.00 H new ATOM 0 HH21 ARG A 45 4.693 4.957 11.025 1.00 25.00 H new ATOM 0 HH22 ARG A 45 5.232 6.627 10.821 1.00 25.00 H new ATOM 571 N LEU A 46 -3.184 3.206 6.423 1.00 25.00 N ATOM 572 CA LEU A 46 -4.543 3.060 5.908 1.00 25.00 C ATOM 573 C LEU A 46 -5.248 1.860 6.538 1.00 25.00 C ATOM 574 O LEU A 46 -4.728 0.752 6.522 1.00 25.00 O ATOM 575 CB LEU A 46 -4.495 2.901 4.386 1.00 25.00 C ATOM 576 CG LEU A 46 -3.784 4.048 3.638 1.00 25.00 C ATOM 577 CD1 LEU A 46 -2.448 3.579 3.064 1.00 25.00 C ATOM 578 CD2 LEU A 46 -4.656 4.581 2.524 1.00 25.00 C ATOM 0 H LEU A 46 -2.553 2.450 6.159 1.00 25.00 H new ATOM 0 HA LEU A 46 -5.110 3.954 6.168 1.00 25.00 H new ATOM 0 HB2 LEU A 46 -3.991 1.964 4.148 1.00 25.00 H new ATOM 0 HB3 LEU A 46 -5.515 2.819 4.011 1.00 25.00 H new ATOM 0 HG LEU A 46 -3.597 4.846 4.356 1.00 25.00 H new ATOM 0 HD11 LEU A 46 -1.966 4.405 2.542 1.00 25.00 H new ATOM 0 HD12 LEU A 46 -1.804 3.237 3.874 1.00 25.00 H new ATOM 0 HD13 LEU A 46 -2.619 2.759 2.366 1.00 25.00 H new ATOM 0 HD21 LEU A 46 -4.136 5.389 2.010 1.00 25.00 H new ATOM 0 HD22 LEU A 46 -4.872 3.780 1.817 1.00 25.00 H new ATOM 0 HD23 LEU A 46 -5.589 4.958 2.942 1.00 25.00 H new ATOM 590 N THR A 47 -6.436 2.088 7.076 1.00 25.00 N ATOM 591 CA THR A 47 -7.221 1.041 7.734 1.00 25.00 C ATOM 592 C THR A 47 -8.553 0.911 7.006 1.00 25.00 C ATOM 593 O THR A 47 -9.334 1.856 6.967 1.00 25.00 O ATOM 594 CB THR A 47 -7.498 1.432 9.208 1.00 25.00 C ATOM 595 OG1 THR A 47 -6.440 2.270 9.679 1.00 25.00 O ATOM 596 CG2 THR A 47 -7.587 0.201 10.100 1.00 25.00 C ATOM 0 H THR A 47 -6.888 3.002 7.072 1.00 25.00 H new ATOM 0 HA THR A 47 -6.670 0.101 7.708 1.00 25.00 H new ATOM 0 HB THR A 47 -8.452 1.958 9.248 1.00 25.00 H new ATOM 0 HG1 THR A 47 -6.813 2.987 10.234 1.00 25.00 H new ATOM 0 HG21 THR A 47 -7.782 0.509 11.127 1.00 25.00 H new ATOM 0 HG22 THR A 47 -8.397 -0.441 9.754 1.00 25.00 H new ATOM 0 HG23 THR A 47 -6.646 -0.347 10.058 1.00 25.00 H new ATOM 604 N GLY A 48 -8.805 -0.231 6.381 1.00 25.00 N ATOM 605 CA GLY A 48 -10.019 -0.381 5.580 1.00 25.00 C ATOM 606 C GLY A 48 -11.282 -0.682 6.364 1.00 25.00 C ATOM 607 O GLY A 48 -12.362 -0.173 6.047 1.00 25.00 O ATOM 0 H GLY A 48 -8.202 -1.053 6.409 1.00 25.00 H new ATOM 0 HA2 GLY A 48 -10.174 0.536 5.011 1.00 25.00 H new ATOM 0 HA3 GLY A 48 -9.861 -1.181 4.857 1.00 25.00 H new ATOM 611 N GLY A 49 -11.172 -1.543 7.368 1.00 25.00 N ATOM 612 CA GLY A 49 -12.346 -1.963 8.122 1.00 25.00 C ATOM 613 C GLY A 49 -13.199 -2.943 7.327 1.00 25.00 C ATOM 614 O GLY A 49 -12.761 -3.458 6.285 1.00 25.00 O ATOM 0 H GLY A 49 -10.293 -1.960 7.676 1.00 25.00 H new ATOM 0 HA2 GLY A 49 -12.032 -2.427 9.057 1.00 25.00 H new ATOM 0 HA3 GLY A 49 -12.943 -1.089 8.385 1.00 25.00 H new ATOM 618 N LEU A 50 -14.419 -3.188 7.787 1.00 25.00 N ATOM 619 CA LEU A 50 -15.349 -4.100 7.114 1.00 25.00 C ATOM 620 C LEU A 50 -15.696 -3.602 5.715 1.00 25.00 C ATOM 621 O LEU A 50 -15.570 -2.402 5.425 1.00 25.00 O ATOM 622 CB LEU A 50 -16.644 -4.228 7.929 1.00 25.00 C ATOM 623 CG LEU A 50 -16.567 -5.032 9.236 1.00 25.00 C ATOM 624 CD1 LEU A 50 -17.837 -4.806 10.044 1.00 25.00 C ATOM 625 CD2 LEU A 50 -16.390 -6.533 8.955 1.00 25.00 C ATOM 0 H LEU A 50 -14.796 -2.764 8.635 1.00 25.00 H new ATOM 0 HA LEU A 50 -14.859 -5.070 7.033 1.00 25.00 H new ATOM 0 HB2 LEU A 50 -16.994 -3.224 8.169 1.00 25.00 H new ATOM 0 HB3 LEU A 50 -17.401 -4.687 7.293 1.00 25.00 H new ATOM 0 HG LEU A 50 -15.701 -4.689 9.802 1.00 25.00 H new ATOM 0 HD11 LEU A 50 -17.784 -5.376 10.972 1.00 25.00 H new ATOM 0 HD12 LEU A 50 -17.938 -3.745 10.275 1.00 25.00 H new ATOM 0 HD13 LEU A 50 -18.700 -5.135 9.465 1.00 25.00 H new ATOM 0 HD21 LEU A 50 -16.339 -7.076 9.899 1.00 25.00 H new ATOM 0 HD22 LEU A 50 -17.237 -6.896 8.373 1.00 25.00 H new ATOM 0 HD23 LEU A 50 -15.469 -6.692 8.394 1.00 25.00 H new ATOM 637 N GLY A 51 -16.136 -4.516 4.861 1.00 25.00 N ATOM 638 CA GLY A 51 -16.474 -4.180 3.487 1.00 25.00 C ATOM 639 C GLY A 51 -15.270 -4.359 2.578 1.00 25.00 C ATOM 640 O GLY A 51 -14.141 -4.535 3.069 1.00 25.00 O ATOM 0 H GLY A 51 -16.267 -5.499 5.098 1.00 25.00 H new ATOM 0 HA2 GLY A 51 -17.292 -4.813 3.144 1.00 25.00 H new ATOM 0 HA3 GLY A 51 -16.825 -3.149 3.435 1.00 25.00 H new ATOM 644 N ALA A 52 -15.497 -4.313 1.273 1.00 25.00 N ATOM 645 CA ALA A 52 -14.431 -4.417 0.287 1.00 25.00 C ATOM 646 C ALA A 52 -13.852 -3.013 0.143 1.00 25.00 C ATOM 647 O ALA A 52 -14.585 -2.062 -0.057 1.00 25.00 O ATOM 648 CB ALA A 52 -14.993 -4.921 -1.031 1.00 25.00 C ATOM 0 H ALA A 52 -16.426 -4.202 0.868 1.00 25.00 H new ATOM 0 HA ALA A 52 -13.658 -5.123 0.592 1.00 25.00 H new ATOM 0 HB1 ALA A 52 -14.190 -4.996 -1.764 1.00 25.00 H new ATOM 0 HB2 ALA A 52 -15.443 -5.903 -0.883 1.00 25.00 H new ATOM 0 HB3 ALA A 52 -15.751 -4.226 -1.393 1.00 25.00 H new ATOM 654 N ASP A 53 -12.557 -2.877 0.324 1.00 25.00 N ATOM 655 CA ASP A 53 -11.927 -1.565 0.300 1.00 25.00 C ATOM 656 C ASP A 53 -10.819 -1.560 -0.723 1.00 25.00 C ATOM 657 O ASP A 53 -10.145 -2.570 -0.908 1.00 25.00 O ATOM 658 CB ASP A 53 -11.345 -1.233 1.673 1.00 25.00 C ATOM 659 CG ASP A 53 -12.391 -1.266 2.762 1.00 25.00 C ATOM 660 OD1 ASP A 53 -13.365 -0.491 2.707 1.00 50.00 O ATOM 661 OD2 ASP A 53 -12.239 -2.057 3.714 1.00 50.00 O ATOM 0 H ASP A 53 -11.917 -3.653 0.489 1.00 25.00 H new ATOM 0 HA ASP A 53 -12.677 -0.818 0.040 1.00 25.00 H new ATOM 0 HB2 ASP A 53 -10.553 -1.943 1.911 1.00 25.00 H new ATOM 0 HB3 ASP A 53 -10.887 -0.244 1.642 1.00 25.00 H new ATOM 666 N THR A 54 -10.595 -0.429 -1.362 1.00 25.00 N ATOM 667 CA THR A 54 -9.510 -0.308 -2.321 1.00 25.00 C ATOM 668 C THR A 54 -8.562 0.777 -1.837 1.00 25.00 C ATOM 669 O THR A 54 -8.983 1.857 -1.402 1.00 25.00 O ATOM 670 CB THR A 54 -10.016 -0.068 -3.770 1.00 25.00 C ATOM 671 OG1 THR A 54 -8.889 0.027 -4.638 1.00 25.00 O ATOM 672 CG2 THR A 54 -10.840 1.194 -3.908 1.00 25.00 C ATOM 0 H THR A 54 -11.148 0.419 -1.236 1.00 25.00 H new ATOM 0 HA THR A 54 -8.970 -1.253 -2.376 1.00 25.00 H new ATOM 0 HB THR A 54 -10.660 -0.908 -4.032 1.00 25.00 H new ATOM 0 HG1 THR A 54 -9.195 0.177 -5.557 1.00 25.00 H new ATOM 0 HG21 THR A 54 -11.164 1.306 -4.943 1.00 25.00 H new ATOM 0 HG22 THR A 54 -11.714 1.131 -3.259 1.00 25.00 H new ATOM 0 HG23 THR A 54 -10.237 2.056 -3.622 1.00 25.00 H new ATOM 680 N PHE A 55 -7.277 0.463 -1.871 1.00 25.00 N ATOM 681 CA PHE A 55 -6.241 1.371 -1.413 1.00 25.00 C ATOM 682 C PHE A 55 -5.437 1.753 -2.644 1.00 25.00 C ATOM 683 O PHE A 55 -4.967 0.871 -3.377 1.00 25.00 O ATOM 684 CB PHE A 55 -5.348 0.678 -0.380 1.00 25.00 C ATOM 685 CG PHE A 55 -6.107 0.101 0.783 1.00 25.00 C ATOM 686 CD1 PHE A 55 -6.404 0.888 1.905 1.00 25.00 C ATOM 687 CD2 PHE A 55 -6.528 -1.245 0.757 1.00 25.00 C ATOM 688 CE1 PHE A 55 -7.110 0.334 3.009 1.00 25.00 C ATOM 689 CE2 PHE A 55 -7.237 -1.804 1.843 1.00 25.00 C ATOM 690 CZ PHE A 55 -7.526 -1.018 2.969 1.00 25.00 C ATOM 0 H PHE A 55 -6.924 -0.429 -2.217 1.00 25.00 H new ATOM 0 HA PHE A 55 -6.666 2.252 -0.932 1.00 25.00 H new ATOM 0 HB2 PHE A 55 -4.791 -0.120 -0.871 1.00 25.00 H new ATOM 0 HB3 PHE A 55 -4.616 1.394 -0.006 1.00 25.00 H new ATOM 0 HD1 PHE A 55 -6.095 1.922 1.931 1.00 25.00 H new ATOM 0 HD2 PHE A 55 -6.305 -1.856 -0.105 1.00 25.00 H new ATOM 0 HE1 PHE A 55 -7.328 0.943 3.874 1.00 25.00 H new ATOM 0 HE2 PHE A 55 -7.556 -2.835 1.807 1.00 25.00 H new ATOM 0 HZ PHE A 55 -8.064 -1.444 3.803 1.00 25.00 H new ATOM 700 N ARG A 56 -5.326 3.046 -2.907 1.00 25.00 N ATOM 701 CA ARG A 56 -4.727 3.499 -4.152 1.00 25.00 C ATOM 702 C ARG A 56 -3.671 4.574 -3.966 1.00 25.00 C ATOM 703 O ARG A 56 -3.722 5.394 -3.044 1.00 25.00 O ATOM 704 CB ARG A 56 -5.852 4.033 -5.053 1.00 25.00 C ATOM 705 CG ARG A 56 -5.534 3.997 -6.535 1.00 25.00 C ATOM 706 CD ARG A 56 -6.643 4.620 -7.342 1.00 25.00 C ATOM 707 NE ARG A 56 -6.350 4.557 -8.782 1.00 25.00 N ATOM 708 CZ ARG A 56 -6.599 3.519 -9.573 1.00 25.00 C ATOM 709 NH1 ARG A 56 -7.127 2.408 -9.134 1.00 25.00 N ATOM 710 NH2 ARG A 56 -6.304 3.600 -10.841 1.00 25.00 N ATOM 0 H ARG A 56 -5.638 3.791 -2.284 1.00 25.00 H new ATOM 0 HA ARG A 56 -4.214 2.648 -4.601 1.00 25.00 H new ATOM 0 HB2 ARG A 56 -6.754 3.449 -4.873 1.00 25.00 H new ATOM 0 HB3 ARG A 56 -6.075 5.061 -4.766 1.00 25.00 H new ATOM 0 HG2 ARG A 56 -4.601 4.528 -6.723 1.00 25.00 H new ATOM 0 HG3 ARG A 56 -5.384 2.965 -6.853 1.00 25.00 H new ATOM 0 HD2 ARG A 56 -7.581 4.104 -7.136 1.00 25.00 H new ATOM 0 HD3 ARG A 56 -6.777 5.659 -7.040 1.00 25.00 H new ATOM 0 HE ARG A 56 -5.920 5.378 -9.208 1.00 25.00 H new ATOM 0 HH11 ARG A 56 -7.366 2.312 -8.147 1.00 25.00 H new ATOM 0 HH12 ARG A 56 -7.301 1.636 -9.778 1.00 25.00 H new ATOM 0 HH21 ARG A 56 -5.887 4.453 -11.214 1.00 25.00 H new ATOM 0 HH22 ARG A 56 -6.490 2.810 -11.459 1.00 25.00 H new ATOM 724 N PHE A 57 -2.754 4.600 -4.914 1.00 25.00 N ATOM 725 CA PHE A 57 -1.823 5.706 -5.056 1.00 25.00 C ATOM 726 C PHE A 57 -2.611 6.923 -5.551 1.00 25.00 C ATOM 727 O PHE A 57 -3.612 6.773 -6.248 1.00 25.00 O ATOM 728 CB PHE A 57 -0.751 5.346 -6.100 1.00 25.00 C ATOM 729 CG PHE A 57 -1.331 4.909 -7.429 1.00 25.00 C ATOM 730 CD1 PHE A 57 -1.788 5.853 -8.367 1.00 25.00 C ATOM 731 CD2 PHE A 57 -1.455 3.548 -7.731 1.00 25.00 C ATOM 732 CE1 PHE A 57 -2.381 5.444 -9.588 1.00 25.00 C ATOM 733 CE2 PHE A 57 -2.048 3.126 -8.947 1.00 25.00 C ATOM 734 CZ PHE A 57 -2.507 4.077 -9.876 1.00 25.00 C ATOM 0 H PHE A 57 -2.632 3.860 -5.605 1.00 25.00 H new ATOM 0 HA PHE A 57 -1.339 5.918 -4.103 1.00 25.00 H new ATOM 0 HB2 PHE A 57 -0.105 6.209 -6.260 1.00 25.00 H new ATOM 0 HB3 PHE A 57 -0.123 4.547 -5.705 1.00 25.00 H new ATOM 0 HD1 PHE A 57 -1.685 6.907 -8.153 1.00 25.00 H new ATOM 0 HD2 PHE A 57 -1.095 2.811 -7.029 1.00 25.00 H new ATOM 0 HE1 PHE A 57 -2.734 6.182 -10.293 1.00 25.00 H new ATOM 0 HE2 PHE A 57 -2.148 2.072 -9.161 1.00 25.00 H new ATOM 0 HZ PHE A 57 -2.954 3.757 -10.806 1.00 25.00 H new ATOM 744 N ALA A 58 -2.098 8.114 -5.283 1.00 25.00 N ATOM 745 CA ALA A 58 -2.618 9.344 -5.886 1.00 25.00 C ATOM 746 C ALA A 58 -1.477 10.056 -6.633 1.00 25.00 C ATOM 747 O ALA A 58 -1.708 10.890 -7.497 1.00 25.00 O ATOM 748 CB ALA A 58 -3.215 10.243 -4.799 1.00 25.00 C ATOM 0 H ALA A 58 -1.315 8.261 -4.647 1.00 25.00 H new ATOM 0 HA ALA A 58 -3.409 9.109 -6.598 1.00 25.00 H new ATOM 0 HB1 ALA A 58 -3.600 11.156 -5.253 1.00 25.00 H new ATOM 0 HB2 ALA A 58 -4.027 9.717 -4.297 1.00 25.00 H new ATOM 0 HB3 ALA A 58 -2.443 10.497 -4.072 1.00 25.00 H new ATOM 754 N LEU A 59 -0.244 9.700 -6.284 1.00 25.00 N ATOM 755 CA LEU A 59 0.950 10.281 -6.904 1.00 25.00 C ATOM 756 C LEU A 59 1.849 9.127 -7.354 1.00 25.00 C ATOM 757 O LEU A 59 1.720 8.015 -6.867 1.00 25.00 O ATOM 758 CB LEU A 59 1.737 11.150 -5.889 1.00 25.00 C ATOM 759 CG LEU A 59 1.236 12.549 -5.464 1.00 25.00 C ATOM 760 CD1 LEU A 59 1.050 13.464 -6.671 1.00 25.00 C ATOM 761 CD2 LEU A 59 -0.048 12.515 -4.642 1.00 25.00 C ATOM 0 H LEU A 59 -0.041 9.004 -5.567 1.00 25.00 H new ATOM 0 HA LEU A 59 0.651 10.911 -7.741 1.00 25.00 H new ATOM 0 HB2 LEU A 59 1.838 10.560 -4.978 1.00 25.00 H new ATOM 0 HB3 LEU A 59 2.739 11.283 -6.296 1.00 25.00 H new ATOM 0 HG LEU A 59 2.018 12.950 -4.820 1.00 25.00 H new ATOM 0 HD11 LEU A 59 0.697 14.440 -6.337 1.00 25.00 H new ATOM 0 HD12 LEU A 59 2.002 13.580 -7.189 1.00 25.00 H new ATOM 0 HD13 LEU A 59 0.318 13.026 -7.350 1.00 25.00 H new ATOM 0 HD21 LEU A 59 -0.339 13.532 -4.380 1.00 25.00 H new ATOM 0 HD22 LEU A 59 -0.842 12.049 -5.226 1.00 25.00 H new ATOM 0 HD23 LEU A 59 0.118 11.939 -3.732 1.00 25.00 H new ATOM 773 N ARG A 60 2.816 9.407 -8.219 1.00 25.00 N ATOM 774 CA ARG A 60 3.812 8.398 -8.606 1.00 25.00 C ATOM 775 C ARG A 60 4.831 8.202 -7.470 1.00 25.00 C ATOM 776 O ARG A 60 5.561 7.238 -7.434 1.00 25.00 O ATOM 777 CB ARG A 60 4.539 8.841 -9.884 1.00 25.00 C ATOM 778 CG ARG A 60 5.439 10.049 -9.671 1.00 25.00 C ATOM 779 CD ARG A 60 5.924 10.658 -10.953 1.00 25.00 C ATOM 780 NE ARG A 60 6.687 11.881 -10.655 1.00 25.00 N ATOM 781 CZ ARG A 60 7.179 12.719 -11.554 1.00 25.00 C ATOM 782 NH1 ARG A 60 7.051 12.521 -12.847 1.00 25.00 N ATOM 783 NH2 ARG A 60 7.819 13.773 -11.134 1.00 25.00 N ATOM 0 H ARG A 60 2.937 10.315 -8.667 1.00 25.00 H new ATOM 0 HA ARG A 60 3.302 7.454 -8.795 1.00 25.00 H new ATOM 0 HB2 ARG A 60 5.138 8.011 -10.260 1.00 25.00 H new ATOM 0 HB3 ARG A 60 3.801 9.076 -10.651 1.00 25.00 H new ATOM 0 HG2 ARG A 60 4.896 10.803 -9.101 1.00 25.00 H new ATOM 0 HG3 ARG A 60 6.298 9.752 -9.069 1.00 25.00 H new ATOM 0 HD2 ARG A 60 6.551 9.947 -11.492 1.00 25.00 H new ATOM 0 HD3 ARG A 60 5.079 10.892 -11.600 1.00 25.00 H new ATOM 0 HE ARG A 60 6.850 12.101 -9.673 1.00 25.00 H new ATOM 0 HH11 ARG A 60 6.558 11.697 -13.190 1.00 25.00 H new ATOM 0 HH12 ARG A 60 7.445 13.191 -13.507 1.00 25.00 H new ATOM 0 HH21 ARG A 60 7.931 13.937 -10.133 1.00 25.00 H new ATOM 0 HH22 ARG A 60 8.208 14.435 -11.806 1.00 25.00 H new ATOM 797 N GLU A 61 4.859 9.155 -6.553 1.00 25.00 N ATOM 798 CA GLU A 61 5.813 9.177 -5.437 1.00 25.00 C ATOM 799 C GLU A 61 5.106 8.823 -4.133 1.00 25.00 C ATOM 800 O GLU A 61 5.616 9.057 -3.040 1.00 25.00 O ATOM 801 CB GLU A 61 6.403 10.589 -5.333 1.00 25.00 C ATOM 802 CG GLU A 61 7.430 10.903 -6.424 1.00 25.00 C ATOM 803 CD GLU A 61 7.484 12.380 -6.771 1.00 25.00 C ATOM 804 OE1 GLU A 61 7.743 13.201 -5.869 1.00 25.00 O ATOM 805 OE2 GLU A 61 7.248 12.723 -7.967 1.00 25.00 O ATOM 0 H GLU A 61 4.217 9.947 -6.555 1.00 25.00 H new ATOM 0 HA GLU A 61 6.603 8.447 -5.614 1.00 25.00 H new ATOM 0 HB2 GLU A 61 5.594 11.317 -5.386 1.00 25.00 H new ATOM 0 HB3 GLU A 61 6.874 10.707 -4.357 1.00 25.00 H new ATOM 0 HG2 GLU A 61 8.416 10.575 -6.094 1.00 25.00 H new ATOM 0 HG3 GLU A 61 7.188 10.332 -7.320 1.00 25.00 H new ATOM 812 N ASP A 62 3.892 8.305 -4.262 1.00 25.00 N ATOM 813 CA ASP A 62 3.031 8.034 -3.103 1.00 25.00 C ATOM 814 C ASP A 62 3.632 7.105 -2.056 1.00 25.00 C ATOM 815 O ASP A 62 3.356 7.255 -0.862 1.00 25.00 O ATOM 816 CB ASP A 62 1.712 7.447 -3.578 1.00 25.00 C ATOM 817 CG ASP A 62 0.550 7.911 -2.755 1.00 25.00 C ATOM 818 OD1 ASP A 62 0.466 7.570 -1.560 1.00 25.00 O ATOM 819 OD2 ASP A 62 -0.253 8.699 -3.288 1.00 25.00 O ATOM 0 H ASP A 62 3.473 8.061 -5.160 1.00 25.00 H new ATOM 0 HA ASP A 62 2.897 8.998 -2.611 1.00 25.00 H new ATOM 0 HB2 ASP A 62 1.549 7.723 -4.620 1.00 25.00 H new ATOM 0 HB3 ASP A 62 1.768 6.359 -3.542 1.00 25.00 H new ATOM 824 N SER A 63 4.441 6.149 -2.496 1.00 25.00 N ATOM 825 CA SER A 63 5.080 5.202 -1.589 1.00 25.00 C ATOM 826 C SER A 63 6.473 4.813 -2.086 1.00 25.00 C ATOM 827 O SER A 63 6.615 3.945 -2.942 1.00 25.00 O ATOM 828 CB SER A 63 4.200 3.951 -1.442 1.00 25.00 C ATOM 829 OG SER A 63 3.877 3.398 -2.707 1.00 25.00 O ATOM 0 H SER A 63 4.671 6.008 -3.480 1.00 25.00 H new ATOM 0 HA SER A 63 5.194 5.681 -0.617 1.00 25.00 H new ATOM 0 HB2 SER A 63 4.720 3.207 -0.839 1.00 25.00 H new ATOM 0 HB3 SER A 63 3.284 4.208 -0.910 1.00 25.00 H new ATOM 0 HG SER A 63 4.680 3.374 -3.268 1.00 25.00 H new ATOM 835 N HIS A 64 7.498 5.457 -1.547 1.00 25.00 N ATOM 836 CA HIS A 64 8.880 5.134 -1.913 1.00 25.00 C ATOM 837 C HIS A 64 9.780 5.220 -0.679 1.00 25.00 C ATOM 838 O HIS A 64 9.370 5.736 0.362 1.00 25.00 O ATOM 839 CB HIS A 64 9.392 6.057 -3.036 1.00 25.00 C ATOM 840 CG HIS A 64 10.092 7.289 -2.545 1.00 25.00 C ATOM 841 ND1 HIS A 64 9.460 8.448 -2.162 1.00 25.00 N ATOM 842 CD2 HIS A 64 11.428 7.548 -2.394 1.00 25.00 C ATOM 843 CE1 HIS A 64 10.393 9.328 -1.791 1.00 25.00 C ATOM 844 NE2 HIS A 64 11.611 8.834 -1.918 1.00 25.00 N ATOM 0 H HIS A 64 7.406 6.203 -0.858 1.00 25.00 H new ATOM 0 HA HIS A 64 8.906 4.113 -2.295 1.00 25.00 H new ATOM 0 HB2 HIS A 64 10.075 5.493 -3.672 1.00 25.00 H new ATOM 0 HB3 HIS A 64 8.549 6.355 -3.659 1.00 25.00 H new ATOM 0 HD2 HIS A 64 12.223 6.850 -2.614 1.00 25.00 H new ATOM 0 HE1 HIS A 64 10.178 10.323 -1.431 1.00 25.00 H new ATOM 0 HE2 HIS A 64 12.495 9.299 -1.710 1.00 25.00 H new ATOM 852 N ARG A 65 10.990 4.698 -0.786 1.00 25.00 N ATOM 853 CA ARG A 65 11.974 4.725 0.295 1.00 25.00 C ATOM 854 C ARG A 65 13.291 5.189 -0.299 1.00 25.00 C ATOM 855 O ARG A 65 13.521 5.044 -1.495 1.00 25.00 O ATOM 856 CB ARG A 65 12.111 3.332 0.924 1.00 25.00 C ATOM 857 CG ARG A 65 10.814 2.852 1.552 1.00 25.00 C ATOM 858 CD ARG A 65 10.981 1.562 2.321 1.00 25.00 C ATOM 859 NE ARG A 65 9.715 1.185 2.973 1.00 25.00 N ATOM 860 CZ ARG A 65 9.481 0.047 3.613 1.00 25.00 C ATOM 861 NH1 ARG A 65 10.383 -0.896 3.709 1.00 25.00 N ATOM 862 NH2 ARG A 65 8.311 -0.142 4.153 1.00 25.00 N ATOM 0 H ARG A 65 11.325 4.238 -1.632 1.00 25.00 H new ATOM 0 HA ARG A 65 11.662 5.406 1.087 1.00 25.00 H new ATOM 0 HB2 ARG A 65 12.427 2.621 0.161 1.00 25.00 H new ATOM 0 HB3 ARG A 65 12.893 3.354 1.683 1.00 25.00 H new ATOM 0 HG2 ARG A 65 10.432 3.623 2.222 1.00 25.00 H new ATOM 0 HG3 ARG A 65 10.067 2.710 0.771 1.00 25.00 H new ATOM 0 HD2 ARG A 65 11.300 0.768 1.646 1.00 25.00 H new ATOM 0 HD3 ARG A 65 11.764 1.677 3.071 1.00 25.00 H new ATOM 0 HE ARG A 65 8.951 1.859 2.928 1.00 25.00 H new ATOM 0 HH11 ARG A 65 11.301 -0.769 3.284 1.00 25.00 H new ATOM 0 HH12 ARG A 65 10.168 -1.759 4.209 1.00 25.00 H new ATOM 0 HH21 ARG A 65 7.593 0.579 4.080 1.00 25.00 H new ATOM 0 HH22 ARG A 65 8.113 -1.011 4.649 1.00 25.00 H new ATOM 876 N SER A 66 14.121 5.795 0.527 1.00 25.00 N ATOM 877 CA SER A 66 15.376 6.374 0.075 1.00 25.00 C ATOM 878 C SER A 66 16.290 6.408 1.289 1.00 25.00 C ATOM 879 O SER A 66 15.808 6.234 2.415 1.00 25.00 O ATOM 880 CB SER A 66 15.098 7.794 -0.426 1.00 25.00 C ATOM 881 OG SER A 66 14.664 8.613 0.644 1.00 25.00 O ATOM 0 H SER A 66 13.948 5.901 1.527 1.00 25.00 H new ATOM 0 HA SER A 66 15.834 5.804 -0.733 1.00 25.00 H new ATOM 0 HB2 SER A 66 16.000 8.213 -0.872 1.00 25.00 H new ATOM 0 HB3 SER A 66 14.338 7.770 -1.207 1.00 25.00 H new ATOM 0 HG SER A 66 14.249 8.056 1.335 1.00 25.00 H new ATOM 887 N PRO A 67 17.596 6.692 1.118 1.00 25.00 N ATOM 888 CA PRO A 67 18.396 6.818 2.343 1.00 25.00 C ATOM 889 C PRO A 67 18.049 8.076 3.156 1.00 25.00 C ATOM 890 O PRO A 67 18.448 8.213 4.300 1.00 25.00 O ATOM 891 CB PRO A 67 19.827 6.879 1.807 1.00 25.00 C ATOM 892 CG PRO A 67 19.685 7.526 0.479 1.00 25.00 C ATOM 893 CD PRO A 67 18.423 6.926 -0.088 1.00 25.00 C ATOM 0 HA PRO A 67 18.221 5.998 3.039 1.00 25.00 H new ATOM 0 HB2 PRO A 67 20.476 7.457 2.465 1.00 25.00 H new ATOM 0 HB3 PRO A 67 20.264 5.884 1.722 1.00 25.00 H new ATOM 0 HG2 PRO A 67 19.606 8.609 0.570 1.00 25.00 H new ATOM 0 HG3 PRO A 67 20.545 7.321 -0.158 1.00 25.00 H new ATOM 0 HD2 PRO A 67 17.933 7.603 -0.788 1.00 25.00 H new ATOM 0 HD3 PRO A 67 18.623 6.000 -0.627 1.00 25.00 H new ATOM 901 N LEU A 68 17.264 8.968 2.559 1.00 25.00 N ATOM 902 CA LEU A 68 16.805 10.183 3.232 1.00 25.00 C ATOM 903 C LEU A 68 15.622 9.871 4.156 1.00 25.00 C ATOM 904 O LEU A 68 15.141 10.737 4.882 1.00 25.00 O ATOM 905 CB LEU A 68 16.370 11.224 2.190 1.00 25.00 C ATOM 906 CG LEU A 68 17.424 11.636 1.148 1.00 25.00 C ATOM 907 CD1 LEU A 68 16.765 12.534 0.109 1.00 25.00 C ATOM 908 CD2 LEU A 68 18.602 12.362 1.792 1.00 25.00 C ATOM 0 H LEU A 68 16.929 8.872 1.601 1.00 25.00 H new ATOM 0 HA LEU A 68 17.628 10.579 3.827 1.00 25.00 H new ATOM 0 HB2 LEU A 68 15.501 10.833 1.660 1.00 25.00 H new ATOM 0 HB3 LEU A 68 16.045 12.120 2.719 1.00 25.00 H new ATOM 0 HG LEU A 68 17.815 10.735 0.676 1.00 25.00 H new ATOM 0 HD11 LEU A 68 17.504 12.832 -0.635 1.00 25.00 H new ATOM 0 HD12 LEU A 68 15.956 11.992 -0.380 1.00 25.00 H new ATOM 0 HD13 LEU A 68 16.363 13.422 0.598 1.00 25.00 H new ATOM 0 HD21 LEU A 68 19.324 12.636 1.023 1.00 25.00 H new ATOM 0 HD22 LEU A 68 18.245 13.262 2.292 1.00 25.00 H new ATOM 0 HD23 LEU A 68 19.079 11.707 2.521 1.00 25.00 H new ATOM 920 N GLY A 69 15.143 8.634 4.101 1.00 25.00 N ATOM 921 CA GLY A 69 14.021 8.211 4.917 1.00 25.00 C ATOM 922 C GLY A 69 13.010 7.397 4.140 1.00 25.00 C ATOM 923 O GLY A 69 13.054 7.308 2.910 1.00 25.00 O ATOM 0 H GLY A 69 15.520 7.905 3.495 1.00 25.00 H new ATOM 0 HA2 GLY A 69 14.389 7.621 5.756 1.00 25.00 H new ATOM 0 HA3 GLY A 69 13.530 9.089 5.336 1.00 25.00 H new ATOM 927 N THR A 70 12.072 6.804 4.859 1.00 25.00 N ATOM 928 CA THR A 70 11.002 6.034 4.242 1.00 25.00 C ATOM 929 C THR A 70 9.779 6.934 4.092 1.00 25.00 C ATOM 930 O THR A 70 9.450 7.716 4.993 1.00 25.00 O ATOM 931 CB THR A 70 10.645 4.760 5.071 1.00 25.00 C ATOM 932 OG1 THR A 70 9.485 4.145 4.514 1.00 25.00 O ATOM 933 CG2 THR A 70 10.363 5.078 6.542 1.00 25.00 C ATOM 0 H THR A 70 12.029 6.841 5.877 1.00 25.00 H new ATOM 0 HA THR A 70 11.339 5.688 3.265 1.00 25.00 H new ATOM 0 HB THR A 70 11.508 4.095 5.027 1.00 25.00 H new ATOM 0 HG1 THR A 70 9.165 3.442 5.118 1.00 25.00 H new ATOM 0 HG21 THR A 70 10.120 4.158 7.073 1.00 25.00 H new ATOM 0 HG22 THR A 70 11.245 5.534 6.991 1.00 25.00 H new ATOM 0 HG23 THR A 70 9.523 5.769 6.610 1.00 25.00 H new ATOM 941 N PHE A 71 9.119 6.826 2.951 1.00 25.00 N ATOM 942 CA PHE A 71 7.917 7.601 2.663 1.00 25.00 C ATOM 943 C PHE A 71 6.869 6.619 2.147 1.00 25.00 C ATOM 944 O PHE A 71 5.943 6.985 1.436 1.00 25.00 O ATOM 945 CB PHE A 71 8.239 8.687 1.628 1.00 25.00 C ATOM 946 CG PHE A 71 9.354 9.606 2.056 1.00 25.00 C ATOM 947 CD1 PHE A 71 9.086 10.738 2.849 1.00 25.00 C ATOM 948 CD2 PHE A 71 10.691 9.336 1.681 1.00 25.00 C ATOM 949 CE1 PHE A 71 10.135 11.600 3.275 1.00 25.00 C ATOM 950 CE2 PHE A 71 11.747 10.180 2.104 1.00 25.00 C ATOM 951 CZ PHE A 71 11.473 11.309 2.905 1.00 25.00 C ATOM 0 H PHE A 71 9.399 6.199 2.196 1.00 25.00 H new ATOM 0 HA PHE A 71 7.539 8.109 3.550 1.00 25.00 H new ATOM 0 HB2 PHE A 71 8.511 8.212 0.685 1.00 25.00 H new ATOM 0 HB3 PHE A 71 7.342 9.278 1.440 1.00 25.00 H new ATOM 0 HD1 PHE A 71 8.069 10.956 3.138 1.00 25.00 H new ATOM 0 HD2 PHE A 71 10.909 8.476 1.065 1.00 25.00 H new ATOM 0 HE1 PHE A 71 9.914 12.470 3.876 1.00 25.00 H new ATOM 0 HE2 PHE A 71 12.763 9.959 1.813 1.00 25.00 H new ATOM 0 HZ PHE A 71 12.278 11.949 3.235 1.00 25.00 H new ATOM 961 N SER A 72 7.074 5.347 2.461 1.00 25.00 N ATOM 962 CA SER A 72 6.185 4.280 2.014 1.00 25.00 C ATOM 963 C SER A 72 4.930 4.246 2.856 1.00 25.00 C ATOM 964 O SER A 72 4.939 4.692 3.999 1.00 25.00 O ATOM 965 CB SER A 72 6.877 2.932 2.159 1.00 25.00 C ATOM 966 OG SER A 72 7.202 2.686 3.516 1.00 25.00 O ATOM 0 H SER A 72 7.857 5.025 3.030 1.00 25.00 H new ATOM 0 HA SER A 72 5.931 4.472 0.972 1.00 25.00 H new ATOM 0 HB2 SER A 72 6.227 2.141 1.785 1.00 25.00 H new ATOM 0 HB3 SER A 72 7.783 2.914 1.553 1.00 25.00 H new ATOM 0 HG SER A 72 7.901 3.310 3.803 1.00 25.00 H new ATOM 972 N ASP A 73 3.879 3.648 2.320 1.00 25.00 N ATOM 973 CA ASP A 73 2.629 3.518 3.055 1.00 25.00 C ATOM 974 C ASP A 73 2.517 2.146 3.680 1.00 25.00 C ATOM 975 O ASP A 73 3.130 1.177 3.205 1.00 25.00 O ATOM 976 CB ASP A 73 1.443 3.763 2.129 1.00 25.00 C ATOM 977 CG ASP A 73 1.319 5.212 1.731 1.00 25.00 C ATOM 978 OD1 ASP A 73 2.132 6.040 2.187 1.00 50.00 O ATOM 979 OD2 ASP A 73 0.426 5.559 0.945 1.00 50.00 O ATOM 0 H ASP A 73 3.865 3.246 1.383 1.00 25.00 H new ATOM 0 HA ASP A 73 2.622 4.265 3.849 1.00 25.00 H new ATOM 0 HB2 ASP A 73 1.551 3.150 1.234 1.00 25.00 H new ATOM 0 HB3 ASP A 73 0.526 3.445 2.625 1.00 25.00 H new ATOM 984 N LEU A 74 1.729 2.072 4.742 1.00 25.00 N ATOM 985 CA LEU A 74 1.452 0.823 5.436 1.00 25.00 C ATOM 986 C LEU A 74 -0.057 0.663 5.459 1.00 25.00 C ATOM 987 O LEU A 74 -0.783 1.618 5.750 1.00 25.00 O ATOM 988 CB LEU A 74 1.987 0.858 6.871 1.00 25.00 C ATOM 989 CG LEU A 74 3.509 1.025 7.005 1.00 25.00 C ATOM 990 CD1 LEU A 74 3.899 2.491 7.281 1.00 25.00 C ATOM 991 CD2 LEU A 74 4.023 0.140 8.132 1.00 25.00 C ATOM 0 H LEU A 74 1.261 2.882 5.149 1.00 25.00 H new ATOM 0 HA LEU A 74 1.939 -0.008 4.927 1.00 25.00 H new ATOM 0 HB2 LEU A 74 1.501 1.677 7.402 1.00 25.00 H new ATOM 0 HB3 LEU A 74 1.695 -0.065 7.372 1.00 25.00 H new ATOM 0 HG LEU A 74 3.963 0.729 6.059 1.00 25.00 H new ATOM 0 HD11 LEU A 74 4.983 2.569 7.369 1.00 25.00 H new ATOM 0 HD12 LEU A 74 3.556 3.120 6.459 1.00 25.00 H new ATOM 0 HD13 LEU A 74 3.434 2.822 8.210 1.00 25.00 H new ATOM 0 HD21 LEU A 74 5.102 0.260 8.225 1.00 25.00 H new ATOM 0 HD22 LEU A 74 3.544 0.427 9.068 1.00 25.00 H new ATOM 0 HD23 LEU A 74 3.791 -0.902 7.911 1.00 25.00 H new ATOM 1003 N ILE A 75 -0.538 -0.531 5.166 1.00 25.00 N ATOM 1004 CA ILE A 75 -1.965 -0.810 5.259 1.00 25.00 C ATOM 1005 C ILE A 75 -2.067 -1.695 6.479 1.00 25.00 C ATOM 1006 O ILE A 75 -1.128 -2.431 6.787 1.00 25.00 O ATOM 1007 CB ILE A 75 -2.542 -1.484 3.995 1.00 25.00 C ATOM 1008 CG1 ILE A 75 -2.179 -0.645 2.749 1.00 25.00 C ATOM 1009 CG2 ILE A 75 -4.087 -1.629 4.101 1.00 25.00 C ATOM 1010 CD1 ILE A 75 -2.544 -1.287 1.409 1.00 25.00 C ATOM 0 H ILE A 75 0.032 -1.321 4.863 1.00 25.00 H new ATOM 0 HA ILE A 75 -2.556 0.102 5.341 1.00 25.00 H new ATOM 0 HB ILE A 75 -2.109 -2.480 3.905 1.00 25.00 H new ATOM 0 HG12 ILE A 75 -2.680 0.320 2.821 1.00 25.00 H new ATOM 0 HG13 ILE A 75 -1.107 -0.449 2.761 1.00 25.00 H new ATOM 0 HG21 ILE A 75 -4.470 -2.106 3.199 1.00 25.00 H new ATOM 0 HG22 ILE A 75 -4.336 -2.240 4.969 1.00 25.00 H new ATOM 0 HG23 ILE A 75 -4.538 -0.643 4.209 1.00 25.00 H new ATOM 0 HD11 ILE A 75 -2.250 -0.623 0.596 1.00 25.00 H new ATOM 0 HD12 ILE A 75 -2.022 -2.239 1.307 1.00 25.00 H new ATOM 0 HD13 ILE A 75 -3.620 -1.457 1.368 1.00 25.00 H new ATOM 1022 N LEU A 76 -3.150 -1.540 7.214 1.00 25.00 N ATOM 1023 CA LEU A 76 -3.322 -2.208 8.498 1.00 25.00 C ATOM 1024 C LEU A 76 -4.396 -3.278 8.425 1.00 25.00 C ATOM 1025 O LEU A 76 -5.469 -3.044 7.843 1.00 25.00 O ATOM 1026 CB LEU A 76 -3.706 -1.175 9.560 1.00 25.00 C ATOM 1027 CG LEU A 76 -2.730 0.001 9.758 1.00 25.00 C ATOM 1028 CD1 LEU A 76 -3.289 0.956 10.808 1.00 25.00 C ATOM 1029 CD2 LEU A 76 -1.327 -0.463 10.185 1.00 25.00 C ATOM 0 H LEU A 76 -3.937 -0.950 6.943 1.00 25.00 H new ATOM 0 HA LEU A 76 -2.380 -2.688 8.762 1.00 25.00 H new ATOM 0 HB2 LEU A 76 -4.684 -0.768 9.302 1.00 25.00 H new ATOM 0 HB3 LEU A 76 -3.817 -1.691 10.514 1.00 25.00 H new ATOM 0 HG LEU A 76 -2.629 0.505 8.797 1.00 25.00 H new ATOM 0 HD11 LEU A 76 -2.598 1.788 10.948 1.00 25.00 H new ATOM 0 HD12 LEU A 76 -4.254 1.338 10.475 1.00 25.00 H new ATOM 0 HD13 LEU A 76 -3.414 0.426 11.752 1.00 25.00 H new ATOM 0 HD21 LEU A 76 -0.679 0.405 10.311 1.00 25.00 H new ATOM 0 HD22 LEU A 76 -1.394 -1.005 11.128 1.00 25.00 H new ATOM 0 HD23 LEU A 76 -0.912 -1.118 9.419 1.00 25.00 H new ATOM 1041 N ASP A 77 -4.082 -4.419 9.033 1.00 25.00 N ATOM 1042 CA ASP A 77 -4.958 -5.604 9.181 1.00 25.00 C ATOM 1043 C ASP A 77 -5.315 -6.313 7.865 1.00 25.00 C ATOM 1044 O ASP A 77 -4.943 -7.462 7.672 1.00 25.00 O ATOM 1045 CB ASP A 77 -6.221 -5.242 9.968 1.00 25.00 C ATOM 1046 CG ASP A 77 -5.906 -4.520 11.277 1.00 25.00 C ATOM 1047 OD1 ASP A 77 -5.016 -4.984 12.025 1.00 25.00 O ATOM 1048 OD2 ASP A 77 -6.522 -3.463 11.544 1.00 25.00 O ATOM 0 H ASP A 77 -3.167 -4.561 9.461 1.00 25.00 H new ATOM 0 HA ASP A 77 -4.369 -6.331 9.740 1.00 25.00 H new ATOM 0 HB2 ASP A 77 -6.860 -4.609 9.352 1.00 25.00 H new ATOM 0 HB3 ASP A 77 -6.784 -6.150 10.184 1.00 25.00 H new ATOM 1053 N PHE A 78 -5.963 -5.584 6.964 1.00 25.00 N ATOM 1054 CA PHE A 78 -6.291 -6.014 5.591 1.00 25.00 C ATOM 1055 C PHE A 78 -7.165 -7.280 5.429 1.00 25.00 C ATOM 1056 O PHE A 78 -6.900 -8.327 5.994 1.00 25.00 O ATOM 1057 CB PHE A 78 -4.990 -6.173 4.794 1.00 25.00 C ATOM 1058 CG PHE A 78 -5.196 -6.199 3.308 1.00 25.00 C ATOM 1059 CD1 PHE A 78 -5.431 -5.008 2.596 1.00 25.00 C ATOM 1060 CD2 PHE A 78 -5.159 -7.418 2.609 1.00 25.00 C ATOM 1061 CE1 PHE A 78 -5.627 -5.033 1.194 1.00 25.00 C ATOM 1062 CE2 PHE A 78 -5.359 -7.456 1.210 1.00 25.00 C ATOM 1063 CZ PHE A 78 -5.596 -6.263 0.503 1.00 25.00 C ATOM 0 H PHE A 78 -6.291 -4.640 7.168 1.00 25.00 H new ATOM 0 HA PHE A 78 -6.928 -5.219 5.205 1.00 25.00 H new ATOM 0 HB2 PHE A 78 -4.317 -5.353 5.045 1.00 25.00 H new ATOM 0 HB3 PHE A 78 -4.496 -7.095 5.100 1.00 25.00 H new ATOM 0 HD1 PHE A 78 -5.462 -4.066 3.124 1.00 25.00 H new ATOM 0 HD2 PHE A 78 -4.976 -8.336 3.147 1.00 25.00 H new ATOM 0 HE1 PHE A 78 -5.800 -4.113 0.655 1.00 25.00 H new ATOM 0 HE2 PHE A 78 -5.330 -8.399 0.685 1.00 25.00 H new ATOM 0 HZ PHE A 78 -5.754 -6.288 -0.565 1.00 25.00 H new ATOM 1073 N ASP A 79 -8.203 -7.185 4.599 1.00 25.00 N ATOM 1074 CA ASP A 79 -9.061 -8.347 4.309 1.00 25.00 C ATOM 1075 C ASP A 79 -8.692 -8.923 2.942 1.00 25.00 C ATOM 1076 O ASP A 79 -9.198 -8.452 1.921 1.00 25.00 O ATOM 1077 CB ASP A 79 -10.541 -7.950 4.248 1.00 25.00 C ATOM 1078 CG ASP A 79 -11.062 -7.419 5.549 1.00 25.00 C ATOM 1079 OD1 ASP A 79 -11.044 -8.129 6.564 1.00 25.00 O ATOM 1080 OD2 ASP A 79 -11.593 -6.279 5.523 1.00 25.00 O ATOM 0 H ASP A 79 -8.473 -6.328 4.117 1.00 25.00 H new ATOM 0 HA ASP A 79 -8.908 -9.073 5.107 1.00 25.00 H new ATOM 0 HB2 ASP A 79 -10.677 -7.195 3.474 1.00 25.00 H new ATOM 0 HB3 ASP A 79 -11.132 -8.818 3.954 1.00 25.00 H new ATOM 1085 N PRO A 80 -7.837 -9.963 2.886 1.00 25.00 N ATOM 1086 CA PRO A 80 -7.437 -10.455 1.561 1.00 25.00 C ATOM 1087 C PRO A 80 -8.539 -11.144 0.767 1.00 25.00 C ATOM 1088 O PRO A 80 -8.396 -11.371 -0.424 1.00 25.00 O ATOM 1089 CB PRO A 80 -6.315 -11.427 1.892 1.00 25.00 C ATOM 1090 CG PRO A 80 -6.652 -11.927 3.225 1.00 25.00 C ATOM 1091 CD PRO A 80 -7.160 -10.724 3.952 1.00 25.00 C ATOM 0 HA PRO A 80 -7.155 -9.629 0.908 1.00 25.00 H new ATOM 0 HB2 PRO A 80 -6.263 -12.237 1.165 1.00 25.00 H new ATOM 0 HB3 PRO A 80 -5.344 -10.931 1.887 1.00 25.00 H new ATOM 0 HG2 PRO A 80 -7.407 -12.711 3.177 1.00 25.00 H new ATOM 0 HG3 PRO A 80 -5.781 -12.354 3.722 1.00 25.00 H new ATOM 0 HD2 PRO A 80 -7.846 -10.995 4.754 1.00 25.00 H new ATOM 0 HD3 PRO A 80 -6.350 -10.153 4.405 1.00 25.00 H new ATOM 1099 N SER A 81 -9.663 -11.435 1.403 1.00 25.00 N ATOM 1100 CA SER A 81 -10.799 -12.021 0.703 1.00 25.00 C ATOM 1101 C SER A 81 -11.604 -10.976 -0.077 1.00 25.00 C ATOM 1102 O SER A 81 -12.494 -11.338 -0.847 1.00 25.00 O ATOM 1103 CB SER A 81 -11.736 -12.692 1.707 1.00 25.00 C ATOM 1104 OG SER A 81 -12.830 -13.294 1.049 1.00 25.00 O ATOM 0 H SER A 81 -9.814 -11.276 2.399 1.00 25.00 H new ATOM 0 HA SER A 81 -10.395 -12.746 -0.003 1.00 25.00 H new ATOM 0 HB2 SER A 81 -11.189 -13.445 2.275 1.00 25.00 H new ATOM 0 HB3 SER A 81 -12.098 -11.954 2.423 1.00 25.00 H new ATOM 0 HG SER A 81 -12.946 -12.885 0.166 1.00 25.00 H new ATOM 1110 N GLN A 82 -11.378 -9.698 0.203 1.00 25.00 N ATOM 1111 CA GLN A 82 -12.239 -8.624 -0.328 1.00 25.00 C ATOM 1112 C GLN A 82 -11.504 -7.374 -0.830 1.00 25.00 C ATOM 1113 O GLN A 82 -11.995 -6.680 -1.713 1.00 25.00 O ATOM 1114 CB GLN A 82 -13.202 -8.164 0.782 1.00 25.00 C ATOM 1115 CG GLN A 82 -14.205 -9.221 1.268 1.00 25.00 C ATOM 1116 CD GLN A 82 -15.330 -9.466 0.284 1.00 25.00 C ATOM 1117 OE1 GLN A 82 -16.175 -8.613 0.071 1.00 25.00 O ATOM 1118 NE2 GLN A 82 -15.370 -10.637 -0.290 1.00 25.00 N ATOM 0 H GLN A 82 -10.612 -9.371 0.791 1.00 25.00 H new ATOM 0 HA GLN A 82 -12.739 -9.065 -1.190 1.00 25.00 H new ATOM 0 HB2 GLN A 82 -12.612 -7.829 1.635 1.00 25.00 H new ATOM 0 HB3 GLN A 82 -13.759 -7.299 0.421 1.00 25.00 H new ATOM 0 HG2 GLN A 82 -13.678 -10.158 1.449 1.00 25.00 H new ATOM 0 HG3 GLN A 82 -14.627 -8.903 2.221 1.00 25.00 H new ATOM 0 HE21 GLN A 82 -14.647 -11.328 -0.090 1.00 25.00 H new ATOM 0 HE22 GLN A 82 -16.124 -10.861 -0.939 1.00 25.00 H new ATOM 1127 N ASP A 83 -10.389 -7.028 -0.200 1.00 25.00 N ATOM 1128 CA ASP A 83 -9.742 -5.733 -0.449 1.00 25.00 C ATOM 1129 C ASP A 83 -8.781 -5.740 -1.652 1.00 25.00 C ATOM 1130 O ASP A 83 -8.282 -6.791 -2.077 1.00 25.00 O ATOM 1131 CB ASP A 83 -8.992 -5.288 0.811 1.00 25.00 C ATOM 1132 CG ASP A 83 -9.933 -4.953 1.972 1.00 25.00 C ATOM 1133 OD1 ASP A 83 -11.160 -4.872 1.773 1.00 50.00 O ATOM 1134 OD2 ASP A 83 -9.463 -4.768 3.125 1.00 50.00 O ATOM 0 H ASP A 83 -9.912 -7.616 0.483 1.00 25.00 H new ATOM 0 HA ASP A 83 -10.537 -5.030 -0.697 1.00 25.00 H new ATOM 0 HB2 ASP A 83 -8.308 -6.078 1.120 1.00 25.00 H new ATOM 0 HB3 ASP A 83 -8.384 -4.414 0.577 1.00 25.00 H new ATOM 1139 N LYS A 84 -8.518 -4.553 -2.194 1.00 25.00 N ATOM 1140 CA LYS A 84 -7.678 -4.377 -3.388 1.00 25.00 C ATOM 1141 C LYS A 84 -6.587 -3.323 -3.157 1.00 25.00 C ATOM 1142 O LYS A 84 -6.821 -2.335 -2.481 1.00 25.00 O ATOM 1143 CB LYS A 84 -8.578 -3.941 -4.552 1.00 25.00 C ATOM 1144 CG LYS A 84 -7.928 -3.984 -5.937 1.00 25.00 C ATOM 1145 CD LYS A 84 -7.798 -5.406 -6.453 1.00 25.00 C ATOM 1146 CE LYS A 84 -6.995 -5.410 -7.744 1.00 25.00 C ATOM 1147 NZ LYS A 84 -6.917 -6.800 -8.308 1.00 25.00 N ATOM 0 H LYS A 84 -8.882 -3.677 -1.818 1.00 25.00 H new ATOM 0 HA LYS A 84 -7.183 -5.321 -3.614 1.00 25.00 H new ATOM 0 HB2 LYS A 84 -9.462 -4.579 -4.564 1.00 25.00 H new ATOM 0 HB3 LYS A 84 -8.922 -2.924 -4.362 1.00 25.00 H new ATOM 0 HG2 LYS A 84 -8.523 -3.396 -6.636 1.00 25.00 H new ATOM 0 HG3 LYS A 84 -6.942 -3.522 -5.891 1.00 25.00 H new ATOM 0 HD2 LYS A 84 -7.308 -6.031 -5.706 1.00 25.00 H new ATOM 0 HD3 LYS A 84 -8.786 -5.832 -6.626 1.00 25.00 H new ATOM 0 HE2 LYS A 84 -7.458 -4.742 -8.470 1.00 25.00 H new ATOM 0 HE3 LYS A 84 -5.991 -5.030 -7.556 1.00 25.00 H new ATOM 0 HZ1 LYS A 84 -5.945 -6.993 -8.624 1.00 25.00 H new ATOM 0 HZ2 LYS A 84 -7.186 -7.487 -7.575 1.00 25.00 H new ATOM 0 HZ3 LYS A 84 -7.566 -6.884 -9.116 1.00 25.00 H new ATOM 1161 N ILE A 85 -5.411 -3.534 -3.733 1.00 25.00 N ATOM 1162 CA ILE A 85 -4.303 -2.585 -3.636 1.00 25.00 C ATOM 1163 C ILE A 85 -3.829 -2.281 -5.057 1.00 25.00 C ATOM 1164 O ILE A 85 -3.503 -3.205 -5.817 1.00 25.00 O ATOM 1165 CB ILE A 85 -3.100 -3.171 -2.823 1.00 25.00 C ATOM 1166 CG1 ILE A 85 -3.565 -3.699 -1.447 1.00 25.00 C ATOM 1167 CG2 ILE A 85 -1.992 -2.084 -2.636 1.00 25.00 C ATOM 1168 CD1 ILE A 85 -2.513 -4.556 -0.718 1.00 25.00 C ATOM 0 H ILE A 85 -5.195 -4.367 -4.281 1.00 25.00 H new ATOM 0 HA ILE A 85 -4.651 -1.691 -3.119 1.00 25.00 H new ATOM 0 HB ILE A 85 -2.686 -4.007 -3.387 1.00 25.00 H new ATOM 0 HG12 ILE A 85 -3.830 -2.852 -0.815 1.00 25.00 H new ATOM 0 HG13 ILE A 85 -4.470 -4.291 -1.583 1.00 25.00 H new ATOM 0 HG21 ILE A 85 -1.162 -2.505 -2.069 1.00 25.00 H new ATOM 0 HG22 ILE A 85 -1.636 -1.756 -3.612 1.00 25.00 H new ATOM 0 HG23 ILE A 85 -2.405 -1.232 -2.096 1.00 25.00 H new ATOM 0 HD11 ILE A 85 -2.915 -4.889 0.239 1.00 25.00 H new ATOM 0 HD12 ILE A 85 -2.264 -5.424 -1.329 1.00 25.00 H new ATOM 0 HD13 ILE A 85 -1.615 -3.963 -0.548 1.00 25.00 H new ATOM 1180 N ASP A 86 -3.756 -1.004 -5.411 1.00 25.00 N ATOM 1181 CA ASP A 86 -3.278 -0.605 -6.727 1.00 25.00 C ATOM 1182 C ASP A 86 -1.927 0.089 -6.589 1.00 25.00 C ATOM 1183 O ASP A 86 -1.757 0.959 -5.741 1.00 25.00 O ATOM 1184 CB ASP A 86 -4.276 0.341 -7.383 1.00 25.00 C ATOM 1185 CG ASP A 86 -5.539 -0.364 -7.839 1.00 25.00 C ATOM 1186 OD1 ASP A 86 -5.434 -1.319 -8.639 1.00 25.00 O ATOM 1187 OD2 ASP A 86 -6.645 0.098 -7.486 1.00 25.00 O ATOM 0 H ASP A 86 -4.022 -0.228 -4.805 1.00 25.00 H new ATOM 0 HA ASP A 86 -3.170 -1.492 -7.351 1.00 25.00 H new ATOM 0 HB2 ASP A 86 -4.539 1.130 -6.679 1.00 25.00 H new ATOM 0 HB3 ASP A 86 -3.805 0.823 -8.239 1.00 25.00 H new ATOM 1192 N VAL A 87 -0.960 -0.323 -7.413 1.00 25.00 N ATOM 1193 CA VAL A 87 0.419 0.198 -7.346 1.00 25.00 C ATOM 1194 C VAL A 87 0.945 0.606 -8.729 1.00 25.00 C ATOM 1195 O VAL A 87 2.137 0.829 -8.925 1.00 25.00 O ATOM 1196 CB VAL A 87 1.382 -0.877 -6.740 1.00 25.00 C ATOM 1197 CG1 VAL A 87 0.988 -1.193 -5.291 1.00 25.00 C ATOM 1198 CG2 VAL A 87 1.370 -2.171 -7.570 1.00 25.00 C ATOM 0 H VAL A 87 -1.103 -1.022 -8.142 1.00 25.00 H new ATOM 0 HA VAL A 87 0.392 1.081 -6.708 1.00 25.00 H new ATOM 0 HB VAL A 87 2.390 -0.463 -6.760 1.00 25.00 H new ATOM 0 HG11 VAL A 87 1.667 -1.942 -4.884 1.00 25.00 H new ATOM 0 HG12 VAL A 87 1.048 -0.285 -4.691 1.00 25.00 H new ATOM 0 HG13 VAL A 87 -0.032 -1.577 -5.267 1.00 25.00 H new ATOM 0 HG21 VAL A 87 2.049 -2.897 -7.122 1.00 25.00 H new ATOM 0 HG22 VAL A 87 0.361 -2.582 -7.589 1.00 25.00 H new ATOM 0 HG23 VAL A 87 1.692 -1.953 -8.588 1.00 25.00 H new ATOM 1208 N SER A 88 0.054 0.653 -9.703 1.00 25.00 N ATOM 1209 CA SER A 88 0.423 0.877 -11.103 1.00 25.00 C ATOM 1210 C SER A 88 1.214 2.147 -11.429 1.00 25.00 C ATOM 1211 O SER A 88 1.978 2.152 -12.380 1.00 25.00 O ATOM 1212 CB SER A 88 -0.860 0.876 -11.927 1.00 25.00 C ATOM 1213 OG SER A 88 -1.905 0.284 -11.173 1.00 25.00 O ATOM 0 H SER A 88 -0.948 0.538 -9.553 1.00 25.00 H new ATOM 0 HA SER A 88 1.113 0.069 -11.345 1.00 25.00 H new ATOM 0 HB2 SER A 88 -1.129 1.896 -12.203 1.00 25.00 H new ATOM 0 HB3 SER A 88 -0.709 0.324 -12.855 1.00 25.00 H new ATOM 0 HG SER A 88 -2.730 0.285 -11.701 1.00 25.00 H new ATOM 1219 N ALA A 89 1.030 3.221 -10.668 1.00 25.00 N ATOM 1220 CA ALA A 89 1.728 4.476 -10.953 1.00 25.00 C ATOM 1221 C ALA A 89 3.196 4.478 -10.520 1.00 25.00 C ATOM 1222 O ALA A 89 3.929 5.404 -10.849 1.00 25.00 O ATOM 1223 CB ALA A 89 1.009 5.635 -10.290 1.00 25.00 C ATOM 0 H ALA A 89 0.411 3.252 -9.858 1.00 25.00 H new ATOM 0 HA ALA A 89 1.718 4.585 -12.038 1.00 25.00 H new ATOM 0 HB1 ALA A 89 1.537 6.563 -10.508 1.00 25.00 H new ATOM 0 HB2 ALA A 89 -0.010 5.698 -10.673 1.00 25.00 H new ATOM 0 HB3 ALA A 89 0.983 5.478 -9.212 1.00 25.00 H new ATOM 1229 N LEU A 90 3.608 3.477 -9.758 1.00 25.00 N ATOM 1230 CA LEU A 90 5.000 3.399 -9.311 1.00 25.00 C ATOM 1231 C LEU A 90 5.764 2.709 -10.428 1.00 25.00 C ATOM 1232 O LEU A 90 6.840 3.132 -10.837 1.00 25.00 O ATOM 1233 CB LEU A 90 5.122 2.566 -8.026 1.00 25.00 C ATOM 1234 CG LEU A 90 4.102 2.870 -6.920 1.00 25.00 C ATOM 1235 CD1 LEU A 90 4.277 1.884 -5.776 1.00 25.00 C ATOM 1236 CD2 LEU A 90 4.205 4.303 -6.385 1.00 25.00 C ATOM 0 H LEU A 90 3.012 2.714 -9.437 1.00 25.00 H new ATOM 0 HA LEU A 90 5.389 4.394 -9.096 1.00 25.00 H new ATOM 0 HB2 LEU A 90 5.035 1.512 -8.292 1.00 25.00 H new ATOM 0 HB3 LEU A 90 6.122 2.710 -7.618 1.00 25.00 H new ATOM 0 HG LEU A 90 3.112 2.767 -7.365 1.00 25.00 H new ATOM 0 HD11 LEU A 90 3.551 2.103 -4.993 1.00 25.00 H new ATOM 0 HD12 LEU A 90 4.120 0.870 -6.143 1.00 25.00 H new ATOM 0 HD13 LEU A 90 5.285 1.972 -5.371 1.00 25.00 H new ATOM 0 HD21 LEU A 90 3.458 4.455 -5.606 1.00 25.00 H new ATOM 0 HD22 LEU A 90 5.200 4.466 -5.970 1.00 25.00 H new ATOM 0 HD23 LEU A 90 4.031 5.008 -7.198 1.00 25.00 H new ATOM 1248 N GLY A 91 5.146 1.654 -10.940 1.00 25.00 N ATOM 1249 CA GLY A 91 5.727 0.863 -12.009 1.00 25.00 C ATOM 1250 C GLY A 91 6.747 -0.140 -11.497 1.00 25.00 C ATOM 1251 O GLY A 91 7.460 0.126 -10.542 1.00 25.00 O ATOM 0 H GLY A 91 4.233 1.326 -10.626 1.00 25.00 H new ATOM 0 HA2 GLY A 91 4.934 0.334 -12.538 1.00 25.00 H new ATOM 0 HA3 GLY A 91 6.204 1.526 -12.731 1.00 25.00 H new ATOM 1327 N ASN A 97 11.403 -11.169 -8.057 1.00 25.00 N ATOM 1328 CA ASN A 97 12.844 -11.190 -7.731 1.00 25.00 C ATOM 1329 C ASN A 97 13.186 -10.258 -6.557 1.00 25.00 C ATOM 1330 O ASN A 97 13.804 -10.696 -5.590 1.00 25.00 O ATOM 1331 CB ASN A 97 13.691 -10.859 -8.967 1.00 25.00 C ATOM 1332 CG ASN A 97 15.135 -10.602 -8.629 1.00 25.00 C ATOM 1333 OD1 ASN A 97 15.508 -9.501 -8.274 1.00 25.00 O ATOM 1334 ND2 ASN A 97 15.951 -11.612 -8.750 1.00 25.00 N ATOM 0 HA ASN A 97 13.087 -12.204 -7.413 1.00 25.00 H new ATOM 0 HB2 ASN A 97 13.629 -11.684 -9.676 1.00 25.00 H new ATOM 0 HB3 ASN A 97 13.276 -9.981 -9.462 1.00 25.00 H new ATOM 0 HD21 ASN A 97 16.943 -11.494 -8.544 1.00 25.00 H new ATOM 0 HD22 ASN A 97 15.597 -12.520 -9.051 1.00 25.00 H new ATOM 1341 N GLY A 98 12.702 -9.024 -6.590 1.00 25.00 N ATOM 1342 CA GLY A 98 12.824 -8.135 -5.441 1.00 25.00 C ATOM 1343 C GLY A 98 13.927 -7.101 -5.508 1.00 25.00 C ATOM 1344 O GLY A 98 14.094 -6.316 -4.568 1.00 25.00 O ATOM 0 H GLY A 98 12.224 -8.617 -7.394 1.00 25.00 H new ATOM 0 HA2 GLY A 98 11.875 -7.615 -5.308 1.00 25.00 H new ATOM 0 HA3 GLY A 98 12.980 -8.745 -4.551 1.00 25.00 H new ATOM 1348 N TYR A 99 14.662 -7.087 -6.608 1.00 25.00 N ATOM 1349 CA TYR A 99 15.746 -6.130 -6.786 1.00 25.00 C ATOM 1350 C TYR A 99 15.666 -5.489 -8.163 1.00 25.00 C ATOM 1351 O TYR A 99 15.066 -6.060 -9.079 1.00 25.00 O ATOM 1352 CB TYR A 99 17.102 -6.831 -6.612 1.00 25.00 C ATOM 1353 CG TYR A 99 17.265 -7.486 -5.254 1.00 25.00 C ATOM 1354 CD1 TYR A 99 17.802 -6.760 -4.167 1.00 25.00 C ATOM 1355 CD2 TYR A 99 16.874 -8.829 -5.041 1.00 25.00 C ATOM 1356 CE1 TYR A 99 17.949 -7.371 -2.893 1.00 25.00 C ATOM 1357 CE2 TYR A 99 17.022 -9.435 -3.764 1.00 25.00 C ATOM 1358 CZ TYR A 99 17.552 -8.701 -2.707 1.00 25.00 C ATOM 1359 OH TYR A 99 17.692 -9.291 -1.476 1.00 25.00 O ATOM 0 H TYR A 99 14.529 -7.726 -7.392 1.00 25.00 H new ATOM 0 HA TYR A 99 15.649 -5.350 -6.031 1.00 25.00 H new ATOM 0 HB2 TYR A 99 17.215 -7.587 -7.389 1.00 25.00 H new ATOM 0 HB3 TYR A 99 17.901 -6.104 -6.756 1.00 25.00 H new ATOM 0 HD1 TYR A 99 18.103 -5.732 -4.306 1.00 25.00 H new ATOM 0 HD2 TYR A 99 16.458 -9.400 -5.858 1.00 25.00 H new ATOM 0 HE1 TYR A 99 18.366 -6.811 -2.069 1.00 25.00 H new ATOM 0 HE2 TYR A 99 16.724 -10.462 -3.614 1.00 25.00 H new ATOM 0 HH TYR A 99 17.368 -10.215 -1.517 1.00 25.00 H new ATOM 1369 N ALA A 100 16.288 -4.326 -8.307 1.00 25.00 N ATOM 1370 CA ALA A 100 16.373 -3.620 -9.592 1.00 25.00 C ATOM 1371 C ALA A 100 15.003 -3.393 -10.251 1.00 25.00 C ATOM 1372 O ALA A 100 14.843 -3.577 -11.452 1.00 25.00 O ATOM 1373 CB ALA A 100 17.327 -4.366 -10.549 1.00 25.00 C ATOM 0 H ALA A 100 16.750 -3.840 -7.539 1.00 25.00 H new ATOM 0 HA ALA A 100 16.775 -2.629 -9.381 1.00 25.00 H new ATOM 0 HB1 ALA A 100 17.381 -3.832 -11.498 1.00 25.00 H new ATOM 0 HB2 ALA A 100 18.321 -4.418 -10.105 1.00 25.00 H new ATOM 0 HB3 ALA A 100 16.954 -5.375 -10.721 1.00 25.00 H new ATOM 1379 N GLY A 101 14.022 -2.986 -9.460 1.00 25.00 N ATOM 1380 CA GLY A 101 12.725 -2.618 -10.005 1.00 25.00 C ATOM 1381 C GLY A 101 11.769 -3.780 -10.163 1.00 25.00 C ATOM 1382 O GLY A 101 10.646 -3.609 -10.649 1.00 25.00 O ATOM 0 H GLY A 101 14.098 -2.903 -8.446 1.00 25.00 H new ATOM 0 HA2 GLY A 101 12.268 -1.872 -9.355 1.00 25.00 H new ATOM 0 HA3 GLY A 101 12.872 -2.147 -10.977 1.00 25.00 H new ATOM 1386 N THR A 102 12.175 -4.963 -9.734 1.00 25.00 N ATOM 1387 CA THR A 102 11.296 -6.122 -9.772 1.00 25.00 C ATOM 1388 C THR A 102 10.747 -6.306 -8.373 1.00 25.00 C ATOM 1389 O THR A 102 11.462 -6.113 -7.400 1.00 25.00 O ATOM 1390 CB THR A 102 12.036 -7.405 -10.183 1.00 25.00 C ATOM 1391 OG1 THR A 102 13.016 -7.714 -9.200 1.00 25.00 O ATOM 1392 CG2 THR A 102 12.740 -7.245 -11.513 1.00 25.00 C ATOM 0 H THR A 102 13.104 -5.147 -9.356 1.00 25.00 H new ATOM 0 HA THR A 102 10.514 -5.949 -10.511 1.00 25.00 H new ATOM 0 HB THR A 102 11.296 -8.200 -10.271 1.00 25.00 H new ATOM 0 HG1 THR A 102 13.734 -7.048 -9.233 1.00 25.00 H new ATOM 0 HG21 THR A 102 13.251 -8.173 -11.768 1.00 25.00 H new ATOM 0 HG22 THR A 102 12.008 -7.009 -12.286 1.00 25.00 H new ATOM 0 HG23 THR A 102 13.468 -6.437 -11.444 1.00 25.00 H new ATOM 1400 N LEU A 103 9.484 -6.676 -8.248 1.00 25.00 N ATOM 1401 CA LEU A 103 8.886 -6.877 -6.926 1.00 25.00 C ATOM 1402 C LEU A 103 9.203 -8.251 -6.364 1.00 25.00 C ATOM 1403 O LEU A 103 9.471 -9.196 -7.104 1.00 25.00 O ATOM 1404 CB LEU A 103 7.358 -6.730 -7.005 1.00 25.00 C ATOM 1405 CG LEU A 103 6.797 -5.315 -6.817 1.00 25.00 C ATOM 1406 CD1 LEU A 103 5.304 -5.343 -7.124 1.00 25.00 C ATOM 1407 CD2 LEU A 103 7.023 -4.778 -5.391 1.00 25.00 C ATOM 0 H LEU A 103 8.853 -6.843 -9.032 1.00 25.00 H new ATOM 0 HA LEU A 103 9.311 -6.119 -6.268 1.00 25.00 H new ATOM 0 HB2 LEU A 103 7.029 -7.101 -7.976 1.00 25.00 H new ATOM 0 HB3 LEU A 103 6.913 -7.377 -6.249 1.00 25.00 H new ATOM 0 HG LEU A 103 7.324 -4.646 -7.497 1.00 25.00 H new ATOM 0 HD11 LEU A 103 4.887 -4.344 -6.995 1.00 25.00 H new ATOM 0 HD12 LEU A 103 5.150 -5.671 -8.152 1.00 25.00 H new ATOM 0 HD13 LEU A 103 4.806 -6.034 -6.444 1.00 25.00 H new ATOM 0 HD21 LEU A 103 6.608 -3.773 -5.310 1.00 25.00 H new ATOM 0 HD22 LEU A 103 6.530 -5.433 -4.673 1.00 25.00 H new ATOM 0 HD23 LEU A 103 8.092 -4.747 -5.179 1.00 25.00 H new ATOM 1419 N ALA A 104 9.053 -8.360 -5.055 1.00 25.00 N ATOM 1420 CA ALA A 104 9.028 -9.622 -4.336 1.00 25.00 C ATOM 1421 C ALA A 104 8.221 -9.336 -3.072 1.00 25.00 C ATOM 1422 O ALA A 104 7.987 -8.165 -2.731 1.00 25.00 O ATOM 1423 CB ALA A 104 10.437 -10.096 -3.971 1.00 25.00 C ATOM 0 H ALA A 104 8.942 -7.549 -4.446 1.00 25.00 H new ATOM 0 HA ALA A 104 8.593 -10.416 -4.944 1.00 25.00 H new ATOM 0 HB1 ALA A 104 10.375 -11.043 -3.434 1.00 25.00 H new ATOM 0 HB2 ALA A 104 11.022 -10.232 -4.881 1.00 25.00 H new ATOM 0 HB3 ALA A 104 10.919 -9.351 -3.338 1.00 25.00 H new ATOM 1429 N VAL A 105 7.841 -10.395 -2.370 1.00 25.00 N ATOM 1430 CA VAL A 105 7.108 -10.271 -1.116 1.00 25.00 C ATOM 1431 C VAL A 105 7.984 -10.860 -0.015 1.00 25.00 C ATOM 1432 O VAL A 105 8.806 -11.742 -0.271 1.00 25.00 O ATOM 1433 CB VAL A 105 5.706 -10.970 -1.221 1.00 25.00 C ATOM 1434 CG1 VAL A 105 5.836 -12.497 -1.357 1.00 25.00 C ATOM 1435 CG2 VAL A 105 4.807 -10.612 -0.026 1.00 25.00 C ATOM 0 H VAL A 105 8.030 -11.357 -2.650 1.00 25.00 H new ATOM 0 HA VAL A 105 6.898 -9.227 -0.882 1.00 25.00 H new ATOM 0 HB VAL A 105 5.234 -10.592 -2.128 1.00 25.00 H new ATOM 0 HG11 VAL A 105 4.843 -12.942 -1.427 1.00 25.00 H new ATOM 0 HG12 VAL A 105 6.404 -12.735 -2.256 1.00 25.00 H new ATOM 0 HG13 VAL A 105 6.353 -12.897 -0.485 1.00 25.00 H new ATOM 0 HG21 VAL A 105 3.845 -11.113 -0.132 1.00 25.00 H new ATOM 0 HG22 VAL A 105 5.285 -10.935 0.899 1.00 25.00 H new ATOM 0 HG23 VAL A 105 4.653 -9.533 0.003 1.00 25.00 H new ATOM 1445 N SER A 106 7.857 -10.340 1.191 1.00 25.00 N ATOM 1446 CA SER A 106 8.626 -10.816 2.333 1.00 25.00 C ATOM 1447 C SER A 106 7.703 -10.808 3.533 1.00 25.00 C ATOM 1448 O SER A 106 6.679 -10.132 3.508 1.00 25.00 O ATOM 1449 CB SER A 106 9.815 -9.899 2.586 1.00 25.00 C ATOM 1450 OG SER A 106 10.603 -9.784 1.416 1.00 25.00 O ATOM 0 H SER A 106 7.219 -9.575 1.410 1.00 25.00 H new ATOM 0 HA SER A 106 9.009 -11.819 2.145 1.00 25.00 H new ATOM 0 HB2 SER A 106 9.464 -8.914 2.895 1.00 25.00 H new ATOM 0 HB3 SER A 106 10.420 -10.293 3.403 1.00 25.00 H new ATOM 0 HG SER A 106 11.363 -9.191 1.591 1.00 25.00 H new ATOM 1456 N LEU A 107 8.069 -11.532 4.576 1.00 25.00 N ATOM 1457 CA LEU A 107 7.267 -11.614 5.793 1.00 25.00 C ATOM 1458 C LEU A 107 8.176 -11.350 6.976 1.00 25.00 C ATOM 1459 O LEU A 107 9.396 -11.498 6.867 1.00 25.00 O ATOM 1460 CB LEU A 107 6.661 -13.019 5.942 1.00 25.00 C ATOM 1461 CG LEU A 107 5.578 -13.420 4.926 1.00 25.00 C ATOM 1462 CD1 LEU A 107 5.317 -14.918 4.994 1.00 25.00 C ATOM 1463 CD2 LEU A 107 4.282 -12.665 5.198 1.00 25.00 C ATOM 0 H LEU A 107 8.928 -12.080 4.607 1.00 25.00 H new ATOM 0 HA LEU A 107 6.460 -10.883 5.746 1.00 25.00 H new ATOM 0 HB2 LEU A 107 7.471 -13.746 5.880 1.00 25.00 H new ATOM 0 HB3 LEU A 107 6.235 -13.101 6.942 1.00 25.00 H new ATOM 0 HG LEU A 107 5.936 -13.163 3.929 1.00 25.00 H new ATOM 0 HD11 LEU A 107 4.548 -15.187 4.269 1.00 25.00 H new ATOM 0 HD12 LEU A 107 6.236 -15.458 4.766 1.00 25.00 H new ATOM 0 HD13 LEU A 107 4.980 -15.183 5.996 1.00 25.00 H new ATOM 0 HD21 LEU A 107 3.528 -12.962 4.469 1.00 25.00 H new ATOM 0 HD22 LEU A 107 3.928 -12.899 6.202 1.00 25.00 H new ATOM 0 HD23 LEU A 107 4.462 -11.593 5.118 1.00 25.00 H new ATOM 1534 N ARG A 113 3.613 -9.397 9.875 1.00 25.00 N ATOM 1535 CA ARG A 113 3.812 -8.256 8.980 1.00 25.00 C ATOM 1536 C ARG A 113 4.274 -8.785 7.642 1.00 25.00 C ATOM 1537 O ARG A 113 4.894 -9.842 7.558 1.00 25.00 O ATOM 1538 CB ARG A 113 4.832 -7.267 9.559 1.00 25.00 C ATOM 1539 CG ARG A 113 4.407 -6.707 10.914 1.00 25.00 C ATOM 1540 CD ARG A 113 5.366 -5.659 11.430 1.00 25.00 C ATOM 1541 NE ARG A 113 4.962 -5.229 12.780 1.00 25.00 N ATOM 1542 CZ ARG A 113 5.545 -4.273 13.490 1.00 25.00 C ATOM 1543 NH1 ARG A 113 6.581 -3.606 13.044 1.00 25.00 N ATOM 1544 NH2 ARG A 113 5.078 -3.989 14.676 1.00 25.00 N ATOM 0 HA ARG A 113 2.875 -7.712 8.864 1.00 25.00 H new ATOM 0 HB2 ARG A 113 5.796 -7.765 9.663 1.00 25.00 H new ATOM 0 HB3 ARG A 113 4.972 -6.444 8.858 1.00 25.00 H new ATOM 0 HG2 ARG A 113 3.411 -6.273 10.829 1.00 25.00 H new ATOM 0 HG3 ARG A 113 4.340 -7.521 11.636 1.00 25.00 H new ATOM 0 HD2 ARG A 113 6.379 -6.061 11.455 1.00 25.00 H new ATOM 0 HD3 ARG A 113 5.380 -4.803 10.755 1.00 25.00 H new ATOM 0 HE ARG A 113 4.167 -5.707 13.204 1.00 25.00 H new ATOM 0 HH11 ARG A 113 6.965 -3.816 12.123 1.00 25.00 H new ATOM 0 HH12 ARG A 113 7.004 -2.877 13.618 1.00 25.00 H new ATOM 0 HH21 ARG A 113 4.276 -4.500 15.044 1.00 25.00 H new ATOM 0 HH22 ARG A 113 5.516 -3.256 15.234 1.00 25.00 H new ATOM 1558 N THR A 114 3.952 -8.053 6.591 1.00 25.00 N ATOM 1559 CA THR A 114 4.260 -8.448 5.225 1.00 25.00 C ATOM 1560 C THR A 114 4.848 -7.224 4.536 1.00 25.00 C ATOM 1561 O THR A 114 4.493 -6.100 4.866 1.00 25.00 O ATOM 1562 CB THR A 114 2.976 -8.917 4.510 1.00 25.00 C ATOM 1563 OG1 THR A 114 2.320 -9.903 5.319 1.00 25.00 O ATOM 1564 CG2 THR A 114 3.265 -9.530 3.147 1.00 25.00 C ATOM 0 H THR A 114 3.465 -7.159 6.660 1.00 25.00 H new ATOM 0 HA THR A 114 4.967 -9.277 5.200 1.00 25.00 H new ATOM 0 HB THR A 114 2.346 -8.040 4.363 1.00 25.00 H new ATOM 0 HG1 THR A 114 2.250 -10.743 4.819 1.00 25.00 H new ATOM 0 HG21 THR A 114 2.330 -9.844 2.684 1.00 25.00 H new ATOM 0 HG22 THR A 114 3.754 -8.791 2.512 1.00 25.00 H new ATOM 0 HG23 THR A 114 3.919 -10.394 3.268 1.00 25.00 H new ATOM 1572 N TYR A 115 5.777 -7.431 3.618 1.00 25.00 N ATOM 1573 CA TYR A 115 6.445 -6.323 2.941 1.00 25.00 C ATOM 1574 C TYR A 115 6.488 -6.592 1.455 1.00 25.00 C ATOM 1575 O TYR A 115 6.599 -7.739 1.036 1.00 25.00 O ATOM 1576 CB TYR A 115 7.874 -6.186 3.482 1.00 25.00 C ATOM 1577 CG TYR A 115 7.940 -6.240 5.003 1.00 25.00 C ATOM 1578 CD1 TYR A 115 7.562 -5.130 5.787 1.00 25.00 C ATOM 1579 CD2 TYR A 115 8.369 -7.415 5.671 1.00 25.00 C ATOM 1580 CE1 TYR A 115 7.606 -5.190 7.210 1.00 25.00 C ATOM 1581 CE2 TYR A 115 8.413 -7.469 7.090 1.00 25.00 C ATOM 1582 CZ TYR A 115 8.036 -6.356 7.837 1.00 25.00 C ATOM 1583 OH TYR A 115 8.086 -6.406 9.200 1.00 25.00 O ATOM 0 H TYR A 115 6.089 -8.356 3.321 1.00 25.00 H new ATOM 0 HA TYR A 115 5.897 -5.399 3.123 1.00 25.00 H new ATOM 0 HB2 TYR A 115 8.492 -6.983 3.068 1.00 25.00 H new ATOM 0 HB3 TYR A 115 8.298 -5.243 3.138 1.00 25.00 H new ATOM 0 HD1 TYR A 115 7.235 -4.222 5.302 1.00 25.00 H new ATOM 0 HD2 TYR A 115 8.666 -8.279 5.094 1.00 25.00 H new ATOM 0 HE1 TYR A 115 7.307 -4.335 7.799 1.00 25.00 H new ATOM 0 HE2 TYR A 115 8.738 -8.371 7.588 1.00 25.00 H new ATOM 0 HH TYR A 115 8.405 -7.288 9.483 1.00 25.00 H new ATOM 1593 N LEU A 116 6.444 -5.533 0.663 1.00 25.00 N ATOM 1594 CA LEU A 116 6.587 -5.629 -0.787 1.00 25.00 C ATOM 1595 C LEU A 116 7.796 -4.770 -1.088 1.00 25.00 C ATOM 1596 O LEU A 116 7.816 -3.594 -0.732 1.00 25.00 O ATOM 1597 CB LEU A 116 5.354 -5.077 -1.529 1.00 25.00 C ATOM 1598 CG LEU A 116 4.096 -5.956 -1.590 1.00 25.00 C ATOM 1599 CD1 LEU A 116 3.332 -6.011 -0.260 1.00 25.00 C ATOM 1600 CD2 LEU A 116 3.174 -5.414 -2.686 1.00 25.00 C ATOM 0 H LEU A 116 6.308 -4.581 1.004 1.00 25.00 H new ATOM 0 HA LEU A 116 6.690 -6.664 -1.113 1.00 25.00 H new ATOM 0 HB2 LEU A 116 5.078 -4.132 -1.062 1.00 25.00 H new ATOM 0 HB3 LEU A 116 5.654 -4.851 -2.552 1.00 25.00 H new ATOM 0 HG LEU A 116 4.417 -6.975 -1.808 1.00 25.00 H new ATOM 0 HD11 LEU A 116 2.454 -6.648 -0.371 1.00 25.00 H new ATOM 0 HD12 LEU A 116 3.981 -6.418 0.516 1.00 25.00 H new ATOM 0 HD13 LEU A 116 3.018 -5.006 0.021 1.00 25.00 H new ATOM 0 HD21 LEU A 116 2.275 -6.028 -2.742 1.00 25.00 H new ATOM 0 HD22 LEU A 116 2.897 -4.386 -2.453 1.00 25.00 H new ATOM 0 HD23 LEU A 116 3.693 -5.442 -3.644 1.00 25.00 H new ATOM 1612 N LYS A 117 8.823 -5.366 -1.674 1.00 25.00 N ATOM 1613 CA LYS A 117 10.091 -4.658 -1.896 1.00 25.00 C ATOM 1614 C LYS A 117 10.537 -4.780 -3.330 1.00 25.00 C ATOM 1615 O LYS A 117 10.154 -5.725 -4.010 1.00 25.00 O ATOM 1616 CB LYS A 117 11.170 -5.230 -0.985 1.00 25.00 C ATOM 1617 CG LYS A 117 10.945 -4.906 0.475 1.00 25.00 C ATOM 1618 CD LYS A 117 12.222 -5.108 1.231 1.00 25.00 C ATOM 1619 CE LYS A 117 12.068 -4.723 2.685 1.00 25.00 C ATOM 1620 NZ LYS A 117 13.399 -4.816 3.369 1.00 25.00 N ATOM 0 H LYS A 117 8.812 -6.331 -2.005 1.00 25.00 H new ATOM 0 HA LYS A 117 9.932 -3.604 -1.668 1.00 25.00 H new ATOM 0 HB2 LYS A 117 11.206 -6.312 -1.110 1.00 25.00 H new ATOM 0 HB3 LYS A 117 12.141 -4.841 -1.292 1.00 25.00 H new ATOM 0 HG2 LYS A 117 10.605 -3.876 0.582 1.00 25.00 H new ATOM 0 HG3 LYS A 117 10.162 -5.544 0.884 1.00 25.00 H new ATOM 0 HD2 LYS A 117 12.528 -6.152 1.160 1.00 25.00 H new ATOM 0 HD3 LYS A 117 13.014 -4.512 0.777 1.00 25.00 H new ATOM 0 HE2 LYS A 117 11.676 -3.709 2.764 1.00 25.00 H new ATOM 0 HE3 LYS A 117 11.349 -5.382 3.173 1.00 25.00 H new ATOM 0 HZ1 LYS A 117 13.294 -4.551 4.369 1.00 25.00 H new ATOM 0 HZ2 LYS A 117 13.755 -5.791 3.304 1.00 25.00 H new ATOM 0 HZ3 LYS A 117 14.072 -4.170 2.909 1.00 25.00 H new ATOM 1634 N SER A 118 11.324 -3.813 -3.781 1.00 25.00 N ATOM 1635 CA SER A 118 11.782 -3.787 -5.171 1.00 25.00 C ATOM 1636 C SER A 118 13.226 -3.351 -5.395 1.00 25.00 C ATOM 1637 O SER A 118 13.761 -3.574 -6.481 1.00 25.00 O ATOM 1638 CB SER A 118 10.897 -2.835 -5.969 1.00 25.00 C ATOM 1639 OG SER A 118 11.020 -1.511 -5.460 1.00 25.00 O ATOM 0 H SER A 118 11.660 -3.037 -3.210 1.00 25.00 H new ATOM 0 HA SER A 118 11.719 -4.825 -5.496 1.00 25.00 H new ATOM 0 HB2 SER A 118 11.182 -2.857 -7.021 1.00 25.00 H new ATOM 0 HB3 SER A 118 9.858 -3.159 -5.914 1.00 25.00 H new ATOM 0 HG SER A 118 10.225 -1.288 -4.933 1.00 25.00 H new ATOM 1645 N TYR A 119 13.821 -2.665 -4.416 1.00 25.00 N ATOM 1646 CA TYR A 119 15.152 -2.055 -4.570 1.00 25.00 C ATOM 1647 C TYR A 119 15.314 -1.366 -5.944 1.00 25.00 C ATOM 1648 O TYR A 119 16.293 -1.579 -6.658 1.00 25.00 O ATOM 1649 CB TYR A 119 16.257 -3.093 -4.330 1.00 25.00 C ATOM 1650 CG TYR A 119 17.604 -2.493 -3.969 1.00 25.00 C ATOM 1651 CD1 TYR A 119 17.837 -1.955 -2.686 1.00 25.00 C ATOM 1652 CD2 TYR A 119 18.656 -2.456 -4.910 1.00 25.00 C ATOM 1653 CE1 TYR A 119 19.099 -1.379 -2.353 1.00 25.00 C ATOM 1654 CE2 TYR A 119 19.914 -1.885 -4.582 1.00 25.00 C ATOM 1655 CZ TYR A 119 20.123 -1.355 -3.305 1.00 25.00 C ATOM 1656 OH TYR A 119 21.341 -0.812 -2.985 1.00 25.00 O ATOM 0 H TYR A 119 13.401 -2.515 -3.499 1.00 25.00 H new ATOM 0 HA TYR A 119 15.248 -1.277 -3.812 1.00 25.00 H new ATOM 0 HB2 TYR A 119 15.944 -3.763 -3.529 1.00 25.00 H new ATOM 0 HB3 TYR A 119 16.371 -3.701 -5.228 1.00 25.00 H new ATOM 0 HD1 TYR A 119 17.050 -1.979 -1.947 1.00 25.00 H new ATOM 0 HD2 TYR A 119 18.501 -2.869 -5.896 1.00 25.00 H new ATOM 0 HE1 TYR A 119 19.263 -0.963 -1.370 1.00 25.00 H new ATOM 0 HE2 TYR A 119 20.706 -1.860 -5.316 1.00 25.00 H new ATOM 0 HH TYR A 119 21.941 -0.875 -3.758 1.00 25.00 H new ATOM 1758 N SER A 127 13.853 3.439 -4.294 1.00 25.00 N ATOM 1759 CA SER A 127 13.118 2.188 -4.281 1.00 25.00 C ATOM 1760 C SER A 127 11.652 2.406 -3.937 1.00 25.00 C ATOM 1761 O SER A 127 11.330 3.093 -2.977 1.00 25.00 O ATOM 1762 CB SER A 127 13.759 1.238 -3.276 1.00 25.00 C ATOM 1763 OG SER A 127 15.153 1.146 -3.534 1.00 25.00 O ATOM 0 HA SER A 127 13.160 1.753 -5.279 1.00 25.00 H new ATOM 0 HB2 SER A 127 13.589 1.597 -2.261 1.00 25.00 H new ATOM 0 HB3 SER A 127 13.299 0.252 -3.347 1.00 25.00 H new ATOM 0 HG SER A 127 15.456 1.960 -3.988 1.00 25.00 H new ATOM 1769 N PHE A 128 10.760 1.804 -4.700 1.00 25.00 N ATOM 1770 CA PHE A 128 9.326 1.910 -4.433 1.00 25.00 C ATOM 1771 C PHE A 128 8.868 0.656 -3.698 1.00 25.00 C ATOM 1772 O PHE A 128 8.836 -0.432 -4.264 1.00 25.00 O ATOM 1773 CB PHE A 128 8.563 2.114 -5.742 1.00 25.00 C ATOM 1774 CG PHE A 128 8.875 3.427 -6.408 1.00 25.00 C ATOM 1775 CD1 PHE A 128 8.151 4.586 -6.066 1.00 25.00 C ATOM 1776 CD2 PHE A 128 9.901 3.531 -7.363 1.00 25.00 C ATOM 1777 CE1 PHE A 128 8.448 5.832 -6.665 1.00 25.00 C ATOM 1778 CE2 PHE A 128 10.206 4.776 -7.964 1.00 25.00 C ATOM 1779 CZ PHE A 128 9.479 5.926 -7.611 1.00 25.00 C ATOM 0 H PHE A 128 10.997 1.234 -5.512 1.00 25.00 H new ATOM 0 HA PHE A 128 9.121 2.774 -3.802 1.00 25.00 H new ATOM 0 HB2 PHE A 128 8.803 1.300 -6.426 1.00 25.00 H new ATOM 0 HB3 PHE A 128 7.493 2.059 -5.544 1.00 25.00 H new ATOM 0 HD1 PHE A 128 7.358 4.522 -5.336 1.00 25.00 H new ATOM 0 HD2 PHE A 128 10.463 2.652 -7.641 1.00 25.00 H new ATOM 0 HE1 PHE A 128 7.881 6.711 -6.394 1.00 25.00 H new ATOM 0 HE2 PHE A 128 10.998 4.842 -8.695 1.00 25.00 H new ATOM 0 HZ PHE A 128 9.713 6.877 -8.066 1.00 25.00 H new ATOM 1789 N GLU A 129 8.608 0.798 -2.404 1.00 25.00 N ATOM 1790 CA GLU A 129 8.310 -0.341 -1.532 1.00 25.00 C ATOM 1791 C GLU A 129 7.083 -0.040 -0.674 1.00 25.00 C ATOM 1792 O GLU A 129 6.786 1.126 -0.399 1.00 25.00 O ATOM 1793 CB GLU A 129 9.512 -0.626 -0.621 1.00 25.00 C ATOM 1794 CG GLU A 129 10.814 -0.806 -1.391 1.00 25.00 C ATOM 1795 CD GLU A 129 11.880 -1.516 -0.586 1.00 25.00 C ATOM 1796 OE1 GLU A 129 11.914 -1.387 0.670 1.00 25.00 O ATOM 1797 OE2 GLU A 129 12.688 -2.236 -1.220 1.00 25.00 O ATOM 0 H GLU A 129 8.597 1.700 -1.927 1.00 25.00 H new ATOM 0 HA GLU A 129 8.107 -1.214 -2.152 1.00 25.00 H new ATOM 0 HB2 GLU A 129 9.626 0.194 0.088 1.00 25.00 H new ATOM 0 HB3 GLU A 129 9.314 -1.526 -0.038 1.00 25.00 H new ATOM 0 HG2 GLU A 129 10.617 -1.371 -2.302 1.00 25.00 H new ATOM 0 HG3 GLU A 129 11.187 0.171 -1.697 1.00 25.00 H new ATOM 1804 N LEU A 130 6.386 -1.084 -0.241 1.00 25.00 N ATOM 1805 CA LEU A 130 5.167 -0.959 0.578 1.00 25.00 C ATOM 1806 C LEU A 130 5.234 -1.955 1.737 1.00 25.00 C ATOM 1807 O LEU A 130 6.071 -2.858 1.732 1.00 25.00 O ATOM 1808 CB LEU A 130 3.914 -1.260 -0.264 1.00 25.00 C ATOM 1809 CG LEU A 130 3.640 -0.327 -1.456 1.00 25.00 C ATOM 1810 CD1 LEU A 130 4.141 -0.925 -2.777 1.00 25.00 C ATOM 1811 CD2 LEU A 130 2.144 -0.053 -1.562 1.00 25.00 C ATOM 0 H LEU A 130 6.645 -2.049 -0.444 1.00 25.00 H new ATOM 0 HA LEU A 130 5.105 0.061 0.956 1.00 25.00 H new ATOM 0 HB2 LEU A 130 3.995 -2.279 -0.642 1.00 25.00 H new ATOM 0 HB3 LEU A 130 3.047 -1.233 0.396 1.00 25.00 H new ATOM 0 HG LEU A 130 4.182 0.602 -1.279 1.00 25.00 H new ATOM 0 HD11 LEU A 130 3.928 -0.234 -3.593 1.00 25.00 H new ATOM 0 HD12 LEU A 130 5.216 -1.093 -2.716 1.00 25.00 H new ATOM 0 HD13 LEU A 130 3.635 -1.873 -2.962 1.00 25.00 H new ATOM 0 HD21 LEU A 130 1.954 0.608 -2.407 1.00 25.00 H new ATOM 0 HD22 LEU A 130 1.612 -0.993 -1.709 1.00 25.00 H new ATOM 0 HD23 LEU A 130 1.795 0.422 -0.645 1.00 25.00 H new ATOM 1823 N ALA A 131 4.343 -1.816 2.710 1.00 25.00 N ATOM 1824 CA ALA A 131 4.264 -2.759 3.824 1.00 25.00 C ATOM 1825 C ALA A 131 2.806 -2.967 4.253 1.00 25.00 C ATOM 1826 O ALA A 131 1.949 -2.117 4.016 1.00 25.00 O ATOM 1827 CB ALA A 131 5.096 -2.243 5.000 1.00 25.00 C ATOM 0 H ALA A 131 3.662 -1.058 2.752 1.00 25.00 H new ATOM 0 HA ALA A 131 4.664 -3.720 3.499 1.00 25.00 H new ATOM 0 HB1 ALA A 131 5.034 -2.950 5.828 1.00 25.00 H new ATOM 0 HB2 ALA A 131 6.136 -2.137 4.691 1.00 25.00 H new ATOM 0 HB3 ALA A 131 4.712 -1.274 5.320 1.00 25.00 H new ATOM 1833 N LEU A 132 2.551 -4.092 4.899 1.00 25.00 N ATOM 1834 CA LEU A 132 1.239 -4.424 5.439 1.00 25.00 C ATOM 1835 C LEU A 132 1.495 -4.890 6.874 1.00 25.00 C ATOM 1836 O LEU A 132 2.255 -5.833 7.077 1.00 25.00 O ATOM 1837 CB LEU A 132 0.582 -5.572 4.641 1.00 25.00 C ATOM 1838 CG LEU A 132 0.461 -5.451 3.112 1.00 25.00 C ATOM 1839 CD1 LEU A 132 -0.026 -6.780 2.532 1.00 25.00 C ATOM 1840 CD2 LEU A 132 -0.497 -4.351 2.707 1.00 25.00 C ATOM 0 H LEU A 132 3.256 -4.810 5.066 1.00 25.00 H new ATOM 0 HA LEU A 132 0.567 -3.567 5.386 1.00 25.00 H new ATOM 0 HB2 LEU A 132 1.142 -6.482 4.855 1.00 25.00 H new ATOM 0 HB3 LEU A 132 -0.423 -5.715 5.039 1.00 25.00 H new ATOM 0 HG LEU A 132 1.447 -5.201 2.720 1.00 25.00 H new ATOM 0 HD11 LEU A 132 -0.112 -6.695 1.449 1.00 25.00 H new ATOM 0 HD12 LEU A 132 0.686 -7.567 2.779 1.00 25.00 H new ATOM 0 HD13 LEU A 132 -1.000 -7.026 2.955 1.00 25.00 H new ATOM 0 HD21 LEU A 132 -0.553 -4.299 1.620 1.00 25.00 H new ATOM 0 HD22 LEU A 132 -1.487 -4.563 3.112 1.00 25.00 H new ATOM 0 HD23 LEU A 132 -0.142 -3.397 3.098 1.00 25.00 H new ATOM 1852 N ASP A 133 0.889 -4.243 7.857 1.00 25.00 N ATOM 1853 CA ASP A 133 1.118 -4.618 9.263 1.00 25.00 C ATOM 1854 C ASP A 133 -0.179 -5.184 9.827 1.00 25.00 C ATOM 1855 O ASP A 133 -1.245 -4.609 9.639 1.00 25.00 O ATOM 1856 CB ASP A 133 1.557 -3.407 10.102 1.00 25.00 C ATOM 1857 CG ASP A 133 3.064 -3.111 9.989 1.00 25.00 C ATOM 1858 OD1 ASP A 133 3.760 -3.709 9.141 1.00 25.00 O ATOM 1859 OD2 ASP A 133 3.555 -2.298 10.805 1.00 25.00 O ATOM 0 H ASP A 133 0.242 -3.466 7.722 1.00 25.00 H new ATOM 0 HA ASP A 133 1.916 -5.360 9.306 1.00 25.00 H new ATOM 0 HB2 ASP A 133 0.995 -2.529 9.784 1.00 25.00 H new ATOM 0 HB3 ASP A 133 1.305 -3.586 11.147 1.00 25.00 H new ATOM 1864 N GLY A 134 -0.088 -6.340 10.484 1.00 25.00 N ATOM 1865 CA GLY A 134 -1.272 -7.003 11.010 1.00 25.00 C ATOM 1866 C GLY A 134 -1.951 -7.826 9.931 1.00 25.00 C ATOM 1867 O GLY A 134 -3.060 -8.306 10.103 1.00 25.00 O ATOM 0 H GLY A 134 0.788 -6.831 10.662 1.00 25.00 H new ATOM 0 HA2 GLY A 134 -0.994 -7.647 11.844 1.00 25.00 H new ATOM 0 HA3 GLY A 134 -1.968 -6.260 11.399 1.00 25.00 H new ATOM 1871 N ASN A 135 -1.279 -7.935 8.793 1.00 25.00 N ATOM 1872 CA ASN A 135 -1.831 -8.594 7.609 1.00 25.00 C ATOM 1873 C ASN A 135 -2.248 -10.036 7.860 1.00 25.00 C ATOM 1874 O ASN A 135 -1.486 -10.811 8.445 1.00 25.00 O ATOM 1875 CB ASN A 135 -0.782 -8.585 6.497 1.00 25.00 C ATOM 1876 CG ASN A 135 -1.316 -9.132 5.197 1.00 25.00 C ATOM 1877 OD1 ASN A 135 -2.413 -8.822 4.785 1.00 25.00 O ATOM 1878 ND2 ASN A 135 -0.540 -9.956 4.551 1.00 25.00 N ATOM 0 H ASN A 135 -0.336 -7.570 8.661 1.00 25.00 H new ATOM 0 HA ASN A 135 -2.726 -8.037 7.329 1.00 25.00 H new ATOM 0 HB2 ASN A 135 -0.430 -7.565 6.341 1.00 25.00 H new ATOM 0 HB3 ASN A 135 0.080 -9.175 6.809 1.00 25.00 H new ATOM 0 HD21 ASN A 135 -0.850 -10.363 3.668 1.00 25.00 H new ATOM 0 HD22 ASN A 135 0.377 -10.194 4.928 1.00 25.00 H new ATOM 1885 N HIS A 136 -3.399 -10.429 7.322 1.00 25.00 N ATOM 1886 CA HIS A 136 -3.839 -11.826 7.331 1.00 25.00 C ATOM 1887 C HIS A 136 -3.081 -12.613 6.271 1.00 25.00 C ATOM 1888 O HIS A 136 -3.642 -13.078 5.284 1.00 25.00 O ATOM 1889 CB HIS A 136 -5.348 -11.905 7.109 1.00 25.00 C ATOM 1890 CG HIS A 136 -6.149 -11.354 8.245 1.00 25.00 C ATOM 1891 ND1 HIS A 136 -6.474 -10.025 8.403 1.00 25.00 N ATOM 1892 CD2 HIS A 136 -6.701 -11.980 9.318 1.00 25.00 C ATOM 1893 CE1 HIS A 136 -7.175 -9.904 9.523 1.00 25.00 C ATOM 1894 NE2 HIS A 136 -7.349 -11.064 10.121 1.00 25.00 N ATOM 0 H HIS A 136 -4.054 -9.792 6.868 1.00 25.00 H new ATOM 0 HA HIS A 136 -3.621 -12.268 8.303 1.00 25.00 H new ATOM 0 HB2 HIS A 136 -5.602 -11.362 6.199 1.00 25.00 H new ATOM 0 HB3 HIS A 136 -5.629 -12.946 6.948 1.00 25.00 H new ATOM 0 HD1 HIS A 136 -6.220 -9.267 7.770 1.00 25.00 H new ATOM 0 HD2 HIS A 136 -6.641 -13.040 9.514 1.00 25.00 H new ATOM 0 HE1 HIS A 136 -7.557 -8.966 9.899 1.00 25.00 H new ATOM 1902 N ALA A 137 -1.788 -12.779 6.511 1.00 25.00 N ATOM 1903 CA ALA A 137 -0.913 -13.515 5.614 1.00 25.00 C ATOM 1904 C ALA A 137 -1.365 -14.976 5.526 1.00 25.00 C ATOM 1905 O ALA A 137 -1.190 -15.633 4.505 1.00 25.00 O ATOM 1906 CB ALA A 137 0.535 -13.429 6.119 1.00 25.00 C ATOM 0 H ALA A 137 -1.317 -12.406 7.335 1.00 25.00 H new ATOM 0 HA ALA A 137 -0.964 -13.076 4.618 1.00 25.00 H new ATOM 0 HB1 ALA A 137 1.189 -13.982 5.445 1.00 25.00 H new ATOM 0 HB2 ALA A 137 0.847 -12.385 6.153 1.00 25.00 H new ATOM 0 HB3 ALA A 137 0.598 -13.859 7.119 1.00 25.00 H new ATOM 1912 N ALA A 138 -2.000 -15.449 6.589 1.00 25.00 N ATOM 1913 CA ALA A 138 -2.532 -16.806 6.645 1.00 25.00 C ATOM 1914 C ALA A 138 -3.594 -17.048 5.565 1.00 25.00 C ATOM 1915 O ALA A 138 -3.808 -18.185 5.156 1.00 25.00 O ATOM 1916 CB ALA A 138 -3.119 -17.072 8.035 1.00 25.00 C ATOM 0 H ALA A 138 -2.162 -14.905 7.437 1.00 25.00 H new ATOM 0 HA ALA A 138 -1.711 -17.498 6.455 1.00 25.00 H new ATOM 0 HB1 ALA A 138 -3.516 -18.086 8.074 1.00 25.00 H new ATOM 0 HB2 ALA A 138 -2.339 -16.958 8.787 1.00 25.00 H new ATOM 0 HB3 ALA A 138 -3.921 -16.361 8.234 1.00 25.00 H new ATOM 1922 N THR A 139 -4.270 -15.991 5.128 1.00 25.00 N ATOM 1923 CA THR A 139 -5.311 -16.119 4.101 1.00 25.00 C ATOM 1924 C THR A 139 -5.059 -15.215 2.881 1.00 25.00 C ATOM 1925 O THR A 139 -5.985 -14.903 2.136 1.00 25.00 O ATOM 1926 CB THR A 139 -6.701 -15.783 4.694 1.00 25.00 C ATOM 1927 OG1 THR A 139 -6.673 -14.487 5.285 1.00 25.00 O ATOM 1928 CG2 THR A 139 -7.086 -16.778 5.785 1.00 25.00 C ATOM 0 H THR A 139 -4.121 -15.039 5.463 1.00 25.00 H new ATOM 0 HA THR A 139 -5.282 -17.155 3.764 1.00 25.00 H new ATOM 0 HB THR A 139 -7.425 -15.827 3.881 1.00 25.00 H new ATOM 0 HG1 THR A 139 -7.555 -14.278 5.657 1.00 25.00 H new ATOM 0 HG21 THR A 139 -8.066 -16.519 6.184 1.00 25.00 H new ATOM 0 HG22 THR A 139 -7.119 -17.783 5.365 1.00 25.00 H new ATOM 0 HG23 THR A 139 -6.347 -16.744 6.586 1.00 25.00 H new ATOM 1936 N LEU A 140 -3.812 -14.789 2.677 1.00 25.00 N ATOM 1937 CA LEU A 140 -3.500 -13.874 1.572 1.00 25.00 C ATOM 1938 C LEU A 140 -3.764 -14.537 0.221 1.00 25.00 C ATOM 1939 O LEU A 140 -3.624 -15.750 0.074 1.00 25.00 O ATOM 1940 CB LEU A 140 -2.050 -13.356 1.669 1.00 25.00 C ATOM 1941 CG LEU A 140 -0.870 -14.231 1.184 1.00 25.00 C ATOM 1942 CD1 LEU A 140 -0.584 -14.056 -0.316 1.00 25.00 C ATOM 1943 CD2 LEU A 140 0.400 -13.851 1.955 1.00 25.00 C ATOM 0 H LEU A 140 -3.012 -15.056 3.250 1.00 25.00 H new ATOM 0 HA LEU A 140 -4.162 -13.012 1.654 1.00 25.00 H new ATOM 0 HB2 LEU A 140 -2.005 -12.419 1.114 1.00 25.00 H new ATOM 0 HB3 LEU A 140 -1.863 -13.116 2.716 1.00 25.00 H new ATOM 0 HG LEU A 140 -1.151 -15.269 1.363 1.00 25.00 H new ATOM 0 HD11 LEU A 140 0.253 -14.692 -0.603 1.00 25.00 H new ATOM 0 HD12 LEU A 140 -1.467 -14.337 -0.890 1.00 25.00 H new ATOM 0 HD13 LEU A 140 -0.335 -13.015 -0.520 1.00 25.00 H new ATOM 0 HD21 LEU A 140 1.231 -14.468 1.613 1.00 25.00 H new ATOM 0 HD22 LEU A 140 0.631 -12.800 1.780 1.00 25.00 H new ATOM 0 HD23 LEU A 140 0.241 -14.015 3.021 1.00 25.00 H new ATOM 1955 N SER A 141 -4.134 -13.734 -0.765 1.00 25.00 N ATOM 1956 CA SER A 141 -4.383 -14.238 -2.115 1.00 25.00 C ATOM 1957 C SER A 141 -3.863 -13.246 -3.149 1.00 25.00 C ATOM 1958 O SER A 141 -3.834 -12.045 -2.914 1.00 25.00 O ATOM 1959 CB SER A 141 -5.882 -14.464 -2.310 1.00 25.00 C ATOM 1960 OG SER A 141 -6.350 -15.501 -1.463 1.00 25.00 O ATOM 0 H SER A 141 -4.270 -12.729 -0.659 1.00 25.00 H new ATOM 0 HA SER A 141 -3.859 -15.185 -2.246 1.00 25.00 H new ATOM 0 HB2 SER A 141 -6.424 -13.542 -2.097 1.00 25.00 H new ATOM 0 HB3 SER A 141 -6.083 -14.719 -3.350 1.00 25.00 H new ATOM 0 HG SER A 141 -7.312 -15.628 -1.602 1.00 25.00 H new ATOM 1966 N ALA A 142 -3.450 -13.746 -4.305 1.00 25.00 N ATOM 1967 CA ALA A 142 -2.884 -12.893 -5.355 1.00 25.00 C ATOM 1968 C ALA A 142 -3.921 -11.957 -5.998 1.00 25.00 C ATOM 1969 O ALA A 142 -3.568 -11.071 -6.769 1.00 25.00 O ATOM 1970 CB ALA A 142 -2.243 -13.765 -6.421 1.00 25.00 C ATOM 0 H ALA A 142 -3.494 -14.736 -4.545 1.00 25.00 H new ATOM 0 HA ALA A 142 -2.138 -12.254 -4.883 1.00 25.00 H new ATOM 0 HB1 ALA A 142 -1.821 -13.133 -7.203 1.00 25.00 H new ATOM 0 HB2 ALA A 142 -1.451 -14.365 -5.973 1.00 25.00 H new ATOM 0 HB3 ALA A 142 -2.996 -14.424 -6.854 1.00 25.00 H new ATOM 1976 N GLY A 143 -5.191 -12.150 -5.678 1.00 25.00 N ATOM 1977 CA GLY A 143 -6.244 -11.310 -6.239 1.00 25.00 C ATOM 1978 C GLY A 143 -6.178 -9.873 -5.749 1.00 25.00 C ATOM 1979 O GLY A 143 -6.694 -8.960 -6.394 1.00 25.00 O ATOM 0 H GLY A 143 -5.519 -12.874 -5.038 1.00 25.00 H new ATOM 0 HA2 GLY A 143 -6.170 -11.322 -7.326 1.00 25.00 H new ATOM 0 HA3 GLY A 143 -7.215 -11.732 -5.981 1.00 25.00 H new ATOM 1983 N ASN A 144 -5.549 -9.663 -4.600 1.00 25.00 N ATOM 1984 CA ASN A 144 -5.473 -8.340 -3.984 1.00 25.00 C ATOM 1985 C ASN A 144 -4.660 -7.315 -4.766 1.00 25.00 C ATOM 1986 O ASN A 144 -4.902 -6.123 -4.643 1.00 25.00 O ATOM 1987 CB ASN A 144 -4.867 -8.470 -2.581 1.00 25.00 C ATOM 1988 CG ASN A 144 -5.629 -9.435 -1.713 1.00 25.00 C ATOM 1989 OD1 ASN A 144 -5.053 -10.241 -1.005 1.00 25.00 O ATOM 1990 ND2 ASN A 144 -6.919 -9.376 -1.787 1.00 25.00 N ATOM 0 H ASN A 144 -5.080 -10.397 -4.070 1.00 25.00 H new ATOM 0 HA ASN A 144 -6.498 -7.969 -3.961 1.00 25.00 H new ATOM 0 HB2 ASN A 144 -3.832 -8.801 -2.665 1.00 25.00 H new ATOM 0 HB3 ASN A 144 -4.851 -7.490 -2.103 1.00 25.00 H new ATOM 0 HD21 ASN A 144 -7.491 -10.019 -1.240 1.00 25.00 H new ATOM 0 HD22 ASN A 144 -7.364 -8.686 -2.392 1.00 25.00 H new ATOM 1997 N ILE A 145 -3.682 -7.752 -5.542 1.00 25.00 N ATOM 1998 CA ILE A 145 -2.819 -6.805 -6.261 1.00 25.00 C ATOM 1999 C ILE A 145 -3.364 -6.517 -7.660 1.00 25.00 C ATOM 2000 O ILE A 145 -4.097 -7.321 -8.231 1.00 25.00 O ATOM 2001 CB ILE A 145 -1.345 -7.320 -6.332 1.00 25.00 C ATOM 2002 CG1 ILE A 145 -1.264 -8.654 -7.105 1.00 25.00 C ATOM 2003 CG2 ILE A 145 -0.784 -7.487 -4.893 1.00 25.00 C ATOM 2004 CD1 ILE A 145 0.158 -9.188 -7.332 1.00 25.00 C ATOM 0 H ILE A 145 -3.461 -8.736 -5.695 1.00 25.00 H new ATOM 0 HA ILE A 145 -2.818 -5.870 -5.700 1.00 25.00 H new ATOM 0 HB ILE A 145 -0.741 -6.588 -6.869 1.00 25.00 H new ATOM 0 HG12 ILE A 145 -1.836 -9.406 -6.562 1.00 25.00 H new ATOM 0 HG13 ILE A 145 -1.746 -8.525 -8.074 1.00 25.00 H new ATOM 0 HG21 ILE A 145 0.244 -7.846 -4.943 1.00 25.00 H new ATOM 0 HG22 ILE A 145 -0.808 -6.526 -4.379 1.00 25.00 H new ATOM 0 HG23 ILE A 145 -1.394 -8.206 -4.346 1.00 25.00 H new ATOM 0 HD11 ILE A 145 0.110 -10.128 -7.883 1.00 25.00 H new ATOM 0 HD12 ILE A 145 0.733 -8.460 -7.905 1.00 25.00 H new ATOM 0 HD13 ILE A 145 0.642 -9.356 -6.370 1.00 25.00 H new ATOM 2016 N VAL A 146 -3.023 -5.346 -8.192 1.00 25.00 N ATOM 2017 CA VAL A 146 -3.535 -4.891 -9.495 1.00 25.00 C ATOM 2018 C VAL A 146 -3.208 -5.859 -10.639 1.00 25.00 C ATOM 2019 O VAL A 146 -3.987 -6.007 -11.571 1.00 25.00 O ATOM 2020 CB VAL A 146 -3.000 -3.443 -9.827 1.00 25.00 C ATOM 2021 CG1 VAL A 146 -1.471 -3.417 -10.065 1.00 25.00 C ATOM 2022 CG2 VAL A 146 -3.729 -2.851 -11.032 1.00 25.00 C ATOM 0 H VAL A 146 -2.389 -4.686 -7.741 1.00 25.00 H new ATOM 0 HA VAL A 146 -4.621 -4.863 -9.409 1.00 25.00 H new ATOM 0 HB VAL A 146 -3.206 -2.829 -8.950 1.00 25.00 H new ATOM 0 HG11 VAL A 146 -1.155 -2.398 -10.289 1.00 25.00 H new ATOM 0 HG12 VAL A 146 -0.957 -3.767 -9.170 1.00 25.00 H new ATOM 0 HG13 VAL A 146 -1.222 -4.067 -10.904 1.00 25.00 H new ATOM 0 HG21 VAL A 146 -3.341 -1.854 -11.238 1.00 25.00 H new ATOM 0 HG22 VAL A 146 -3.572 -3.489 -11.902 1.00 25.00 H new ATOM 0 HG23 VAL A 146 -4.796 -2.788 -10.817 1.00 25.00 H new ATOM 2032 N PHE A 147 -2.077 -6.546 -10.549 1.00 25.00 N ATOM 2033 CA PHE A 147 -1.655 -7.451 -11.614 1.00 25.00 C ATOM 2034 C PHE A 147 -2.524 -8.704 -11.658 1.00 25.00 C ATOM 2035 O PHE A 147 -2.842 -9.200 -12.735 1.00 25.00 O ATOM 2036 CB PHE A 147 -0.188 -7.834 -11.400 1.00 25.00 C ATOM 2037 CG PHE A 147 0.724 -6.642 -11.234 1.00 25.00 C ATOM 2038 CD1 PHE A 147 1.135 -5.895 -12.353 1.00 25.00 C ATOM 2039 CD2 PHE A 147 1.158 -6.245 -9.953 1.00 25.00 C ATOM 2040 CE1 PHE A 147 1.971 -4.764 -12.201 1.00 25.00 C ATOM 2041 CE2 PHE A 147 2.005 -5.121 -9.788 1.00 25.00 C ATOM 2042 CZ PHE A 147 2.408 -4.375 -10.915 1.00 25.00 C ATOM 0 H PHE A 147 -1.438 -6.496 -9.756 1.00 25.00 H new ATOM 0 HA PHE A 147 -1.768 -6.938 -12.569 1.00 25.00 H new ATOM 0 HB2 PHE A 147 -0.111 -8.467 -10.516 1.00 25.00 H new ATOM 0 HB3 PHE A 147 0.153 -8.428 -12.248 1.00 25.00 H new ATOM 0 HD1 PHE A 147 0.808 -6.188 -13.340 1.00 25.00 H new ATOM 0 HD2 PHE A 147 0.841 -6.805 -9.086 1.00 25.00 H new ATOM 0 HE1 PHE A 147 2.275 -4.197 -13.069 1.00 25.00 H new ATOM 0 HE2 PHE A 147 2.341 -4.836 -8.802 1.00 25.00 H new ATOM 0 HZ PHE A 147 3.046 -3.512 -10.796 1.00 25.00 H new