USER MOD reduce.3.24.130724 H: found=0, std=0, add=859, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 859 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 99 GLN : amide:sc= 0.979 K(o=1.8,f=-0.34) USER MOD Set 1.2: A 101 GLN : amide:sc= 0.845 K(o=1.8,f=-0.82) USER MOD Set 2.1: A 70 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 22 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 MET CE :methyl -141:sc= -0.0208 (180deg=-0.217) USER MOD Single : A 36 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 SER OG : rot 50:sc= 0.836 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ -175:sc= 1.76 (180deg=1.61) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 77 SER OG : rot 180:sc= 0.00587 USER MOD Single : A 78 SER OG : rot 50:sc= 0.562 USER MOD Single : A 79 ASN : amide:sc= 0 X(o=0,f=-0.037) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 ASN : amide:sc= 0 X(o=0,f=0.067) USER MOD Single : A 98 LYS NZ :NH3+ 142:sc= 1.19 (180deg=0.374) USER MOD Single : A 102 TYR OH : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot -90:sc= 0.549 USER MOD Single : A 111 TYR OH : rot 180:sc= 0 USER MOD Single : A 112 LYS NZ :NH3+ -160:sc= 1.24 (180deg=1.05) USER MOD Single : A 115 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 11 1.955 19.633 12.251 1.00 0.00 N ATOM 2 CA GLY A 11 1.694 21.076 12.457 1.00 0.00 C ATOM 3 C GLY A 11 1.560 21.804 11.128 1.00 0.00 C ATOM 4 O GLY A 11 0.603 21.573 10.387 1.00 0.00 O ATOM 0 HA2 GLY A 11 0.781 21.204 13.039 1.00 0.00 H new ATOM 0 HA3 GLY A 11 2.506 21.516 13.036 1.00 0.00 H new ATOM 8 N SER A 12 2.506 22.686 10.804 1.00 0.00 N ATOM 9 CA SER A 12 2.576 23.397 9.513 1.00 0.00 C ATOM 10 C SER A 12 3.100 22.509 8.360 1.00 0.00 C ATOM 11 O SER A 12 3.631 21.414 8.582 1.00 0.00 O ATOM 12 CB SER A 12 3.435 24.664 9.679 1.00 0.00 C ATOM 13 OG SER A 12 4.731 24.366 10.194 1.00 0.00 O ATOM 0 H SER A 12 3.263 22.936 11.440 1.00 0.00 H new ATOM 0 HA SER A 12 1.561 23.676 9.229 1.00 0.00 H new ATOM 0 HB2 SER A 12 3.534 25.164 8.716 1.00 0.00 H new ATOM 0 HB3 SER A 12 2.930 25.360 10.349 1.00 0.00 H new ATOM 0 HG SER A 12 5.246 25.195 10.283 1.00 0.00 H new ATOM 19 N GLU A 13 2.951 22.979 7.114 1.00 0.00 N ATOM 20 CA GLU A 13 3.308 22.267 5.878 1.00 0.00 C ATOM 21 C GLU A 13 3.424 23.270 4.705 1.00 0.00 C ATOM 22 O GLU A 13 3.044 24.439 4.839 1.00 0.00 O ATOM 23 CB GLU A 13 2.245 21.182 5.583 1.00 0.00 C ATOM 24 CG GLU A 13 2.760 19.960 4.808 1.00 0.00 C ATOM 25 CD GLU A 13 3.658 19.064 5.677 1.00 0.00 C ATOM 26 OE1 GLU A 13 3.129 18.184 6.396 1.00 0.00 O ATOM 27 OE2 GLU A 13 4.904 19.207 5.621 1.00 0.00 O ATOM 0 H GLU A 13 2.562 23.904 6.932 1.00 0.00 H new ATOM 0 HA GLU A 13 4.275 21.779 6.000 1.00 0.00 H new ATOM 0 HB2 GLU A 13 1.823 20.842 6.529 1.00 0.00 H new ATOM 0 HB3 GLU A 13 1.432 21.636 5.016 1.00 0.00 H new ATOM 0 HG2 GLU A 13 1.913 19.379 4.443 1.00 0.00 H new ATOM 0 HG3 GLU A 13 3.319 20.294 3.934 1.00 0.00 H new ATOM 34 N GLU A 14 3.927 22.824 3.549 1.00 0.00 N ATOM 35 CA GLU A 14 3.915 23.589 2.292 1.00 0.00 C ATOM 36 C GLU A 14 2.478 23.831 1.764 1.00 0.00 C ATOM 37 O GLU A 14 1.525 23.162 2.175 1.00 0.00 O ATOM 38 CB GLU A 14 4.769 22.870 1.224 1.00 0.00 C ATOM 39 CG GLU A 14 6.283 23.080 1.390 1.00 0.00 C ATOM 40 CD GLU A 14 6.861 22.427 2.654 1.00 0.00 C ATOM 41 OE1 GLU A 14 6.845 21.178 2.755 1.00 0.00 O ATOM 42 OE2 GLU A 14 7.359 23.156 3.546 1.00 0.00 O ATOM 0 H GLU A 14 4.362 21.906 3.456 1.00 0.00 H new ATOM 0 HA GLU A 14 4.347 24.567 2.502 1.00 0.00 H new ATOM 0 HB2 GLU A 14 4.554 21.802 1.260 1.00 0.00 H new ATOM 0 HB3 GLU A 14 4.470 23.222 0.237 1.00 0.00 H new ATOM 0 HG2 GLU A 14 6.795 22.676 0.516 1.00 0.00 H new ATOM 0 HG3 GLU A 14 6.492 24.149 1.416 1.00 0.00 H new ATOM 49 N VAL A 15 2.320 24.785 0.831 1.00 0.00 N ATOM 50 CA VAL A 15 1.009 25.174 0.256 1.00 0.00 C ATOM 51 C VAL A 15 0.315 24.036 -0.524 1.00 0.00 C ATOM 52 O VAL A 15 -0.913 23.994 -0.584 1.00 0.00 O ATOM 53 CB VAL A 15 1.138 26.459 -0.602 1.00 0.00 C ATOM 54 CG1 VAL A 15 1.892 26.238 -1.927 1.00 0.00 C ATOM 55 CG2 VAL A 15 -0.223 27.114 -0.883 1.00 0.00 C ATOM 0 H VAL A 15 3.102 25.316 0.447 1.00 0.00 H new ATOM 0 HA VAL A 15 0.356 25.389 1.102 1.00 0.00 H new ATOM 0 HB VAL A 15 1.735 27.138 0.007 1.00 0.00 H new ATOM 0 HG11 VAL A 15 1.945 27.178 -2.477 1.00 0.00 H new ATOM 0 HG12 VAL A 15 2.901 25.883 -1.717 1.00 0.00 H new ATOM 0 HG13 VAL A 15 1.364 25.496 -2.527 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -0.078 28.010 -1.487 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -0.860 26.412 -1.421 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -0.698 27.385 0.060 1.00 0.00 H new ATOM 65 N SER A 16 1.081 23.089 -1.077 1.00 0.00 N ATOM 66 CA SER A 16 0.569 21.820 -1.627 1.00 0.00 C ATOM 67 C SER A 16 0.799 20.663 -0.632 1.00 0.00 C ATOM 68 O SER A 16 1.861 20.577 -0.005 1.00 0.00 O ATOM 69 CB SER A 16 1.242 21.501 -2.969 1.00 0.00 C ATOM 70 OG SER A 16 0.905 22.467 -3.964 1.00 0.00 O ATOM 0 H SER A 16 2.094 23.181 -1.158 1.00 0.00 H new ATOM 0 HA SER A 16 -0.503 21.931 -1.791 1.00 0.00 H new ATOM 0 HB2 SER A 16 2.324 21.474 -2.838 1.00 0.00 H new ATOM 0 HB3 SER A 16 0.937 20.510 -3.304 1.00 0.00 H new ATOM 0 HG SER A 16 1.350 22.238 -4.807 1.00 0.00 H new ATOM 76 N GLU A 17 -0.196 19.778 -0.476 1.00 0.00 N ATOM 77 CA GLU A 17 -0.240 18.748 0.576 1.00 0.00 C ATOM 78 C GLU A 17 -0.704 17.377 0.033 1.00 0.00 C ATOM 79 O GLU A 17 -1.471 17.334 -0.941 1.00 0.00 O ATOM 80 CB GLU A 17 -1.205 19.191 1.694 1.00 0.00 C ATOM 81 CG GLU A 17 -0.743 20.446 2.443 1.00 0.00 C ATOM 82 CD GLU A 17 -1.710 20.780 3.589 1.00 0.00 C ATOM 83 OE1 GLU A 17 -1.523 20.264 4.717 1.00 0.00 O ATOM 84 OE2 GLU A 17 -2.674 21.552 3.371 1.00 0.00 O ATOM 0 H GLU A 17 -1.010 19.756 -1.090 1.00 0.00 H new ATOM 0 HA GLU A 17 0.773 18.635 0.961 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -2.188 19.378 1.261 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -1.321 18.375 2.407 1.00 0.00 H new ATOM 0 HG2 GLU A 17 0.260 20.290 2.840 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -0.685 21.287 1.752 1.00 0.00 H new ATOM 91 N PRO A 18 -0.292 16.258 0.670 1.00 0.00 N ATOM 92 CA PRO A 18 -0.767 14.911 0.352 1.00 0.00 C ATOM 93 C PRO A 18 -2.217 14.682 0.819 1.00 0.00 C ATOM 94 O PRO A 18 -2.735 15.399 1.678 1.00 0.00 O ATOM 95 CB PRO A 18 0.207 13.963 1.065 1.00 0.00 C ATOM 96 CG PRO A 18 0.638 14.767 2.287 1.00 0.00 C ATOM 97 CD PRO A 18 0.688 16.195 1.750 1.00 0.00 C ATOM 0 HA PRO A 18 -0.787 14.742 -0.725 1.00 0.00 H new ATOM 0 HB2 PRO A 18 -0.275 13.027 1.347 1.00 0.00 H new ATOM 0 HB3 PRO A 18 1.056 13.706 0.432 1.00 0.00 H new ATOM 0 HG2 PRO A 18 -0.072 14.668 3.108 1.00 0.00 H new ATOM 0 HG3 PRO A 18 1.608 14.442 2.664 1.00 0.00 H new ATOM 0 HD2 PRO A 18 0.450 16.914 2.534 1.00 0.00 H new ATOM 0 HD3 PRO A 18 1.686 16.439 1.385 1.00 0.00 H new ATOM 105 N GLY A 19 -2.849 13.641 0.265 1.00 0.00 N ATOM 106 CA GLY A 19 -4.152 13.105 0.682 1.00 0.00 C ATOM 107 C GLY A 19 -4.013 11.744 1.366 1.00 0.00 C ATOM 108 O GLY A 19 -3.016 11.048 1.186 1.00 0.00 O ATOM 0 H GLY A 19 -2.450 13.126 -0.520 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -4.633 13.807 1.363 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -4.801 13.010 -0.188 1.00 0.00 H new ATOM 112 N ASP A 20 -5.018 11.326 2.132 1.00 0.00 N ATOM 113 CA ASP A 20 -4.957 10.118 2.969 1.00 0.00 C ATOM 114 C ASP A 20 -6.313 9.387 3.036 1.00 0.00 C ATOM 115 O ASP A 20 -7.368 10.028 3.003 1.00 0.00 O ATOM 116 CB ASP A 20 -4.514 10.546 4.381 1.00 0.00 C ATOM 117 CG ASP A 20 -4.405 9.372 5.370 1.00 0.00 C ATOM 118 OD1 ASP A 20 -3.337 8.720 5.413 1.00 0.00 O ATOM 119 OD2 ASP A 20 -5.382 9.125 6.118 1.00 0.00 O ATOM 0 H ASP A 20 -5.909 11.818 2.194 1.00 0.00 H new ATOM 0 HA ASP A 20 -4.247 9.417 2.531 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -3.548 11.046 4.314 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -5.224 11.275 4.771 1.00 0.00 H new ATOM 124 N ALA A 21 -6.286 8.054 3.172 1.00 0.00 N ATOM 125 CA ALA A 21 -7.472 7.213 3.349 1.00 0.00 C ATOM 126 C ALA A 21 -7.142 5.900 4.092 1.00 0.00 C ATOM 127 O ALA A 21 -6.741 4.897 3.498 1.00 0.00 O ATOM 128 CB ALA A 21 -8.118 6.968 1.977 1.00 0.00 C ATOM 0 H ALA A 21 -5.417 7.520 3.161 1.00 0.00 H new ATOM 0 HA ALA A 21 -8.190 7.732 3.984 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -9.002 6.342 2.098 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -8.406 7.922 1.535 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -7.405 6.466 1.324 1.00 0.00 H new ATOM 134 N ASN A 22 -7.362 5.905 5.412 1.00 0.00 N ATOM 135 CA ASN A 22 -7.341 4.736 6.303 1.00 0.00 C ATOM 136 C ASN A 22 -5.998 3.966 6.273 1.00 0.00 C ATOM 137 O ASN A 22 -5.074 4.306 7.014 1.00 0.00 O ATOM 138 CB ASN A 22 -8.576 3.844 6.040 1.00 0.00 C ATOM 139 CG ASN A 22 -9.888 4.581 6.306 1.00 0.00 C ATOM 140 OD1 ASN A 22 -10.256 4.841 7.447 1.00 0.00 O ATOM 141 ND2 ASN A 22 -10.625 4.948 5.270 1.00 0.00 N ATOM 0 H ASN A 22 -7.570 6.768 5.914 1.00 0.00 H new ATOM 0 HA ASN A 22 -7.411 5.096 7.329 1.00 0.00 H new ATOM 0 HB2 ASN A 22 -8.559 3.498 5.006 1.00 0.00 H new ATOM 0 HB3 ASN A 22 -8.524 2.958 6.673 1.00 0.00 H new ATOM 0 HD21 ASN A 22 -11.501 5.448 5.419 1.00 0.00 H new ATOM 0 HD22 ASN A 22 -10.317 4.731 4.322 1.00 0.00 H new ATOM 148 N ILE A 23 -5.894 2.911 5.452 1.00 0.00 N ATOM 149 CA ILE A 23 -4.718 2.018 5.355 1.00 0.00 C ATOM 150 C ILE A 23 -3.682 2.551 4.340 1.00 0.00 C ATOM 151 O ILE A 23 -2.513 2.170 4.409 1.00 0.00 O ATOM 152 CB ILE A 23 -5.197 0.568 5.047 1.00 0.00 C ATOM 153 CG1 ILE A 23 -6.204 0.072 6.121 1.00 0.00 C ATOM 154 CG2 ILE A 23 -4.018 -0.424 4.958 1.00 0.00 C ATOM 155 CD1 ILE A 23 -6.838 -1.296 5.827 1.00 0.00 C ATOM 0 H ILE A 23 -6.645 2.643 4.816 1.00 0.00 H new ATOM 0 HA ILE A 23 -4.195 1.997 6.311 1.00 0.00 H new ATOM 0 HB ILE A 23 -5.691 0.604 4.076 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -5.692 0.021 7.082 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -6.999 0.811 6.222 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -4.398 -1.422 4.742 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -3.341 -0.114 4.163 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -3.481 -0.438 5.907 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -7.526 -1.559 6.631 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -7.383 -1.249 4.884 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -6.056 -2.052 5.757 1.00 0.00 H new ATOM 167 N PHE A 24 -4.065 3.451 3.423 1.00 0.00 N ATOM 168 CA PHE A 24 -3.184 4.014 2.398 1.00 0.00 C ATOM 169 C PHE A 24 -3.133 5.553 2.424 1.00 0.00 C ATOM 170 O PHE A 24 -4.013 6.217 2.975 1.00 0.00 O ATOM 171 CB PHE A 24 -3.603 3.471 1.022 1.00 0.00 C ATOM 172 CG PHE A 24 -5.020 3.772 0.565 1.00 0.00 C ATOM 173 CD1 PHE A 24 -6.089 2.958 0.992 1.00 0.00 C ATOM 174 CD2 PHE A 24 -5.267 4.833 -0.326 1.00 0.00 C ATOM 175 CE1 PHE A 24 -7.393 3.199 0.532 1.00 0.00 C ATOM 176 CE2 PHE A 24 -6.573 5.074 -0.786 1.00 0.00 C ATOM 177 CZ PHE A 24 -7.635 4.253 -0.365 1.00 0.00 C ATOM 0 H PHE A 24 -5.017 3.814 3.375 1.00 0.00 H new ATOM 0 HA PHE A 24 -2.164 3.697 2.614 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -2.915 3.869 0.277 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -3.472 2.389 1.031 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -5.903 2.144 1.677 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -4.453 5.462 -0.656 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -8.209 2.575 0.867 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -6.762 5.892 -1.465 1.00 0.00 H new ATOM 0 HZ PHE A 24 -8.635 4.433 -0.731 1.00 0.00 H new ATOM 187 N ARG A 25 -2.091 6.122 1.804 1.00 0.00 N ATOM 188 CA ARG A 25 -1.876 7.580 1.718 1.00 0.00 C ATOM 189 C ARG A 25 -1.331 7.947 0.342 1.00 0.00 C ATOM 190 O ARG A 25 -0.464 7.240 -0.149 1.00 0.00 O ATOM 191 CB ARG A 25 -0.913 8.024 2.839 1.00 0.00 C ATOM 192 CG ARG A 25 -0.820 9.547 3.010 1.00 0.00 C ATOM 193 CD ARG A 25 0.185 9.905 4.111 1.00 0.00 C ATOM 194 NE ARG A 25 0.116 11.337 4.458 1.00 0.00 N ATOM 195 CZ ARG A 25 1.052 12.042 5.089 1.00 0.00 C ATOM 196 NH1 ARG A 25 2.233 11.539 5.380 1.00 0.00 N ATOM 197 NH2 ARG A 25 0.804 13.284 5.449 1.00 0.00 N ATOM 0 H ARG A 25 -1.362 5.579 1.341 1.00 0.00 H new ATOM 0 HA ARG A 25 -2.824 8.101 1.851 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -1.238 7.581 3.781 1.00 0.00 H new ATOM 0 HB3 ARG A 25 0.081 7.630 2.628 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -0.516 10.006 2.069 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -1.801 9.951 3.260 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -0.015 9.304 4.998 1.00 0.00 H new ATOM 0 HD3 ARG A 25 1.193 9.658 3.780 1.00 0.00 H new ATOM 0 HE ARG A 25 -0.732 11.836 4.188 1.00 0.00 H new ATOM 0 HH11 ARG A 25 2.456 10.578 5.121 1.00 0.00 H new ATOM 0 HH12 ARG A 25 2.925 12.110 5.865 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -0.103 13.703 5.244 1.00 0.00 H new ATOM 0 HH22 ARG A 25 1.519 13.827 5.933 1.00 0.00 H new ATOM 211 N VAL A 26 -1.812 9.023 -0.276 1.00 0.00 N ATOM 212 CA VAL A 26 -1.350 9.476 -1.609 1.00 0.00 C ATOM 213 C VAL A 26 -0.526 10.764 -1.509 1.00 0.00 C ATOM 214 O VAL A 26 -0.968 11.737 -0.906 1.00 0.00 O ATOM 215 CB VAL A 26 -2.520 9.620 -2.612 1.00 0.00 C ATOM 216 CG1 VAL A 26 -3.631 10.592 -2.177 1.00 0.00 C ATOM 217 CG2 VAL A 26 -2.017 10.019 -4.011 1.00 0.00 C ATOM 0 H VAL A 26 -2.538 9.616 0.126 1.00 0.00 H new ATOM 0 HA VAL A 26 -0.694 8.699 -2.001 1.00 0.00 H new ATOM 0 HB VAL A 26 -2.969 8.627 -2.639 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -4.405 10.626 -2.943 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -4.065 10.251 -1.237 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -3.210 11.588 -2.042 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -2.865 10.111 -4.690 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -1.494 10.974 -3.951 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -1.335 9.255 -4.384 1.00 0.00 H new ATOM 227 N ASP A 27 0.649 10.792 -2.140 1.00 0.00 N ATOM 228 CA ASP A 27 1.427 12.015 -2.344 1.00 0.00 C ATOM 229 C ASP A 27 1.191 12.549 -3.765 1.00 0.00 C ATOM 230 O ASP A 27 1.487 11.873 -4.752 1.00 0.00 O ATOM 231 CB ASP A 27 2.911 11.746 -2.074 1.00 0.00 C ATOM 232 CG ASP A 27 3.735 13.040 -2.160 1.00 0.00 C ATOM 233 OD1 ASP A 27 4.066 13.467 -3.290 1.00 0.00 O ATOM 234 OD2 ASP A 27 4.032 13.630 -1.094 1.00 0.00 O ATOM 0 H ASP A 27 1.091 9.959 -2.527 1.00 0.00 H new ATOM 0 HA ASP A 27 1.100 12.781 -1.641 1.00 0.00 H new ATOM 0 HB2 ASP A 27 3.029 11.302 -1.086 1.00 0.00 H new ATOM 0 HB3 ASP A 27 3.289 11.022 -2.796 1.00 0.00 H new ATOM 239 N LYS A 28 0.636 13.762 -3.861 1.00 0.00 N ATOM 240 CA LYS A 28 0.238 14.392 -5.130 1.00 0.00 C ATOM 241 C LYS A 28 1.363 15.196 -5.814 1.00 0.00 C ATOM 242 O LYS A 28 1.284 15.457 -7.016 1.00 0.00 O ATOM 243 CB LYS A 28 -0.975 15.306 -4.857 1.00 0.00 C ATOM 244 CG LYS A 28 -2.251 14.590 -4.376 1.00 0.00 C ATOM 245 CD LYS A 28 -2.834 13.631 -5.430 1.00 0.00 C ATOM 246 CE LYS A 28 -4.205 13.065 -5.023 1.00 0.00 C ATOM 247 NZ LYS A 28 -5.300 14.072 -5.127 1.00 0.00 N ATOM 0 H LYS A 28 0.446 14.346 -3.046 1.00 0.00 H new ATOM 0 HA LYS A 28 -0.012 13.591 -5.826 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -0.690 16.045 -4.108 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -1.209 15.853 -5.771 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -2.027 14.031 -3.468 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -3.003 15.335 -4.115 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -2.930 14.157 -6.380 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -2.138 12.807 -5.590 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -4.442 12.210 -5.656 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -4.152 12.698 -3.998 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -6.200 13.637 -4.841 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -5.091 14.877 -4.503 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -5.373 14.405 -6.110 1.00 0.00 H new ATOM 261 N ASP A 29 2.402 15.592 -5.073 1.00 0.00 N ATOM 262 CA ASP A 29 3.523 16.402 -5.573 1.00 0.00 C ATOM 263 C ASP A 29 4.525 15.555 -6.372 1.00 0.00 C ATOM 264 O ASP A 29 4.896 15.917 -7.490 1.00 0.00 O ATOM 265 CB ASP A 29 4.225 17.093 -4.394 1.00 0.00 C ATOM 266 CG ASP A 29 3.376 18.235 -3.819 1.00 0.00 C ATOM 267 OD1 ASP A 29 3.463 19.364 -4.359 1.00 0.00 O ATOM 268 OD2 ASP A 29 2.635 18.007 -2.832 1.00 0.00 O ATOM 0 H ASP A 29 2.492 15.354 -4.085 1.00 0.00 H new ATOM 0 HA ASP A 29 3.122 17.155 -6.251 1.00 0.00 H new ATOM 0 HB2 ASP A 29 4.429 16.361 -3.612 1.00 0.00 H new ATOM 0 HB3 ASP A 29 5.188 17.485 -4.722 1.00 0.00 H new ATOM 273 N SER A 30 4.929 14.408 -5.827 1.00 0.00 N ATOM 274 CA SER A 30 5.794 13.425 -6.497 1.00 0.00 C ATOM 275 C SER A 30 4.997 12.315 -7.216 1.00 0.00 C ATOM 276 O SER A 30 5.580 11.563 -8.003 1.00 0.00 O ATOM 277 CB SER A 30 6.761 12.803 -5.478 1.00 0.00 C ATOM 278 OG SER A 30 7.645 13.780 -4.930 1.00 0.00 O ATOM 0 H SER A 30 4.660 14.125 -4.885 1.00 0.00 H new ATOM 0 HA SER A 30 6.352 13.960 -7.265 1.00 0.00 H new ATOM 0 HB2 SER A 30 6.192 12.334 -4.675 1.00 0.00 H new ATOM 0 HB3 SER A 30 7.341 12.016 -5.959 1.00 0.00 H new ATOM 0 HG SER A 30 8.246 13.352 -4.284 1.00 0.00 H new ATOM 284 N ARG A 31 3.678 12.221 -6.965 1.00 0.00 N ATOM 285 CA ARG A 31 2.717 11.305 -7.601 1.00 0.00 C ATOM 286 C ARG A 31 3.033 9.838 -7.250 1.00 0.00 C ATOM 287 O ARG A 31 3.544 9.078 -8.073 1.00 0.00 O ATOM 288 CB ARG A 31 2.610 11.589 -9.114 1.00 0.00 C ATOM 289 CG ARG A 31 1.400 10.888 -9.758 1.00 0.00 C ATOM 290 CD ARG A 31 1.211 11.295 -11.225 1.00 0.00 C ATOM 291 NE ARG A 31 2.341 10.862 -12.071 1.00 0.00 N ATOM 292 CZ ARG A 31 2.568 11.229 -13.329 1.00 0.00 C ATOM 293 NH1 ARG A 31 1.737 12.004 -13.994 1.00 0.00 N ATOM 294 NH2 ARG A 31 3.651 10.810 -13.946 1.00 0.00 N ATOM 0 H ARG A 31 3.229 12.819 -6.271 1.00 0.00 H new ATOM 0 HA ARG A 31 1.722 11.489 -7.196 1.00 0.00 H new ATOM 0 HB2 ARG A 31 2.531 12.664 -9.275 1.00 0.00 H new ATOM 0 HB3 ARG A 31 3.524 11.259 -9.609 1.00 0.00 H new ATOM 0 HG2 ARG A 31 1.532 9.808 -9.696 1.00 0.00 H new ATOM 0 HG3 ARG A 31 0.499 11.132 -9.196 1.00 0.00 H new ATOM 0 HD2 ARG A 31 0.287 10.860 -11.605 1.00 0.00 H new ATOM 0 HD3 ARG A 31 1.104 12.378 -11.290 1.00 0.00 H new ATOM 0 HE ARG A 31 3.012 10.220 -11.650 1.00 0.00 H new ATOM 0 HH11 ARG A 31 0.886 12.343 -13.545 1.00 0.00 H new ATOM 0 HH12 ARG A 31 1.944 12.265 -14.958 1.00 0.00 H new ATOM 0 HH21 ARG A 31 4.313 10.206 -13.460 1.00 0.00 H new ATOM 0 HH22 ARG A 31 3.829 11.089 -14.911 1.00 0.00 H new ATOM 308 N GLU A 32 2.733 9.446 -6.007 1.00 0.00 N ATOM 309 CA GLU A 32 3.084 8.138 -5.426 1.00 0.00 C ATOM 310 C GLU A 32 2.140 7.748 -4.269 1.00 0.00 C ATOM 311 O GLU A 32 1.318 8.570 -3.866 1.00 0.00 O ATOM 312 CB GLU A 32 4.574 8.123 -5.039 1.00 0.00 C ATOM 313 CG GLU A 32 5.003 9.114 -3.957 1.00 0.00 C ATOM 314 CD GLU A 32 6.522 9.011 -3.733 1.00 0.00 C ATOM 315 OE1 GLU A 32 6.962 8.190 -2.897 1.00 0.00 O ATOM 316 OE2 GLU A 32 7.289 9.751 -4.394 1.00 0.00 O ATOM 0 H GLU A 32 2.225 10.044 -5.356 1.00 0.00 H new ATOM 0 HA GLU A 32 2.938 7.363 -6.178 1.00 0.00 H new ATOM 0 HB2 GLU A 32 4.830 7.118 -4.703 1.00 0.00 H new ATOM 0 HB3 GLU A 32 5.162 8.319 -5.935 1.00 0.00 H new ATOM 0 HG2 GLU A 32 4.737 10.129 -4.253 1.00 0.00 H new ATOM 0 HG3 GLU A 32 4.473 8.904 -3.028 1.00 0.00 H new ATOM 323 N VAL A 33 2.206 6.508 -3.756 1.00 0.00 N ATOM 324 CA VAL A 33 1.176 5.956 -2.842 1.00 0.00 C ATOM 325 C VAL A 33 1.766 5.008 -1.789 1.00 0.00 C ATOM 326 O VAL A 33 2.533 4.104 -2.091 1.00 0.00 O ATOM 327 CB VAL A 33 -0.008 5.310 -3.620 1.00 0.00 C ATOM 328 CG1 VAL A 33 0.403 4.086 -4.459 1.00 0.00 C ATOM 329 CG2 VAL A 33 -1.178 4.923 -2.698 1.00 0.00 C ATOM 0 H VAL A 33 2.967 5.859 -3.958 1.00 0.00 H new ATOM 0 HA VAL A 33 0.768 6.803 -2.291 1.00 0.00 H new ATOM 0 HB VAL A 33 -0.338 6.091 -4.305 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -0.471 3.687 -4.973 1.00 0.00 H new ATOM 0 HG12 VAL A 33 1.152 4.383 -5.193 1.00 0.00 H new ATOM 0 HG13 VAL A 33 0.820 3.320 -3.805 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -1.977 4.477 -3.291 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -0.833 4.204 -1.955 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -1.554 5.813 -2.194 1.00 0.00 H new ATOM 339 N TYR A 34 1.405 5.210 -0.525 1.00 0.00 N ATOM 340 CA TYR A 34 1.873 4.448 0.630 1.00 0.00 C ATOM 341 C TYR A 34 0.832 3.407 1.053 1.00 0.00 C ATOM 342 O TYR A 34 -0.354 3.723 1.145 1.00 0.00 O ATOM 343 CB TYR A 34 2.111 5.387 1.826 1.00 0.00 C ATOM 344 CG TYR A 34 3.191 6.454 1.716 1.00 0.00 C ATOM 345 CD1 TYR A 34 3.061 7.531 0.815 1.00 0.00 C ATOM 346 CD2 TYR A 34 4.286 6.422 2.604 1.00 0.00 C ATOM 347 CE1 TYR A 34 4.021 8.560 0.790 1.00 0.00 C ATOM 348 CE2 TYR A 34 5.240 7.458 2.597 1.00 0.00 C ATOM 349 CZ TYR A 34 5.110 8.534 1.689 1.00 0.00 C ATOM 350 OH TYR A 34 6.024 9.545 1.677 1.00 0.00 O ATOM 0 H TYR A 34 0.747 5.945 -0.265 1.00 0.00 H new ATOM 0 HA TYR A 34 2.800 3.952 0.342 1.00 0.00 H new ATOM 0 HB2 TYR A 34 1.169 5.891 2.042 1.00 0.00 H new ATOM 0 HB3 TYR A 34 2.346 4.767 2.691 1.00 0.00 H new ATOM 0 HD1 TYR A 34 2.219 7.567 0.140 1.00 0.00 H new ATOM 0 HD2 TYR A 34 4.394 5.598 3.294 1.00 0.00 H new ATOM 0 HE1 TYR A 34 3.925 9.370 0.083 1.00 0.00 H new ATOM 0 HE2 TYR A 34 6.071 7.431 3.286 1.00 0.00 H new ATOM 0 HH TYR A 34 6.708 9.375 2.358 1.00 0.00 H new ATOM 360 N MET A 35 1.308 2.214 1.414 1.00 0.00 N ATOM 361 CA MET A 35 0.692 1.303 2.374 1.00 0.00 C ATOM 362 C MET A 35 1.138 1.691 3.784 1.00 0.00 C ATOM 363 O MET A 35 2.290 2.071 3.997 1.00 0.00 O ATOM 364 CB MET A 35 1.182 -0.137 2.104 1.00 0.00 C ATOM 365 CG MET A 35 0.083 -1.199 2.189 1.00 0.00 C ATOM 366 SD MET A 35 -0.612 -1.467 3.836 1.00 0.00 S ATOM 367 CE MET A 35 -1.708 -2.849 3.457 1.00 0.00 C ATOM 0 H MET A 35 2.174 1.841 1.025 1.00 0.00 H new ATOM 0 HA MET A 35 -0.392 1.360 2.280 1.00 0.00 H new ATOM 0 HB2 MET A 35 1.633 -0.176 1.113 1.00 0.00 H new ATOM 0 HB3 MET A 35 1.966 -0.383 2.821 1.00 0.00 H new ATOM 0 HG2 MET A 35 -0.725 -0.916 1.514 1.00 0.00 H new ATOM 0 HG3 MET A 35 0.486 -2.144 1.825 1.00 0.00 H new ATOM 0 HE1 MET A 35 -2.641 -2.736 4.010 1.00 0.00 H new ATOM 0 HE2 MET A 35 -1.919 -2.863 2.388 1.00 0.00 H new ATOM 0 HE3 MET A 35 -1.227 -3.784 3.744 1.00 0.00 H new ATOM 377 N HIS A 36 0.291 1.425 4.769 1.00 0.00 N ATOM 378 CA HIS A 36 0.669 1.381 6.188 1.00 0.00 C ATOM 379 C HIS A 36 1.892 0.463 6.449 1.00 0.00 C ATOM 380 O HIS A 36 2.683 0.726 7.358 1.00 0.00 O ATOM 381 CB HIS A 36 -0.562 0.923 6.982 1.00 0.00 C ATOM 382 CG HIS A 36 -0.324 0.849 8.467 1.00 0.00 C ATOM 383 ND1 HIS A 36 -0.034 -0.315 9.181 1.00 0.00 N ATOM 384 CD2 HIS A 36 -0.338 1.908 9.326 1.00 0.00 C ATOM 385 CE1 HIS A 36 0.119 0.075 10.458 1.00 0.00 C ATOM 386 NE2 HIS A 36 -0.058 1.403 10.577 1.00 0.00 N ATOM 0 H HIS A 36 -0.697 1.229 4.609 1.00 0.00 H new ATOM 0 HA HIS A 36 0.982 2.374 6.511 1.00 0.00 H new ATOM 0 HB2 HIS A 36 -1.386 1.609 6.788 1.00 0.00 H new ATOM 0 HB3 HIS A 36 -0.873 -0.058 6.622 1.00 0.00 H new ATOM 0 HD2 HIS A 36 -0.531 2.941 9.075 1.00 0.00 H new ATOM 0 HE1 HIS A 36 0.352 -0.588 11.278 1.00 0.00 H new ATOM 0 HE2 HIS A 36 0.004 1.941 11.441 1.00 0.00 H new ATOM 394 N GLU A 37 2.077 -0.572 5.616 1.00 0.00 N ATOM 395 CA GLU A 37 3.224 -1.481 5.676 1.00 0.00 C ATOM 396 C GLU A 37 4.506 -0.910 5.035 1.00 0.00 C ATOM 397 O GLU A 37 5.579 -1.258 5.512 1.00 0.00 O ATOM 398 CB GLU A 37 2.864 -2.845 5.045 1.00 0.00 C ATOM 399 CG GLU A 37 3.680 -4.011 5.622 1.00 0.00 C ATOM 400 CD GLU A 37 3.435 -4.219 7.128 1.00 0.00 C ATOM 401 OE1 GLU A 37 2.301 -4.584 7.518 1.00 0.00 O ATOM 402 OE2 GLU A 37 4.379 -4.045 7.935 1.00 0.00 O ATOM 0 H GLU A 37 1.421 -0.802 4.870 1.00 0.00 H new ATOM 0 HA GLU A 37 3.450 -1.613 6.734 1.00 0.00 H new ATOM 0 HB2 GLU A 37 1.803 -3.041 5.199 1.00 0.00 H new ATOM 0 HB3 GLU A 37 3.026 -2.794 3.968 1.00 0.00 H new ATOM 0 HG2 GLU A 37 3.427 -4.926 5.087 1.00 0.00 H new ATOM 0 HG3 GLU A 37 4.741 -3.826 5.453 1.00 0.00 H new ATOM 409 N LYS A 38 4.430 -0.043 4.005 1.00 0.00 N ATOM 410 CA LYS A 38 5.560 0.428 3.157 1.00 0.00 C ATOM 411 C LYS A 38 5.139 1.474 2.096 1.00 0.00 C ATOM 412 O LYS A 38 4.019 1.457 1.591 1.00 0.00 O ATOM 413 CB LYS A 38 6.259 -0.753 2.418 1.00 0.00 C ATOM 414 CG LYS A 38 7.432 -1.531 3.058 1.00 0.00 C ATOM 415 CD LYS A 38 8.565 -0.689 3.678 1.00 0.00 C ATOM 416 CE LYS A 38 8.256 -0.307 5.133 1.00 0.00 C ATOM 417 NZ LYS A 38 9.371 0.438 5.785 1.00 0.00 N ATOM 0 H LYS A 38 3.541 0.371 3.723 1.00 0.00 H new ATOM 0 HA LYS A 38 6.250 0.900 3.856 1.00 0.00 H new ATOM 0 HB2 LYS A 38 5.484 -1.484 2.187 1.00 0.00 H new ATOM 0 HB3 LYS A 38 6.621 -0.361 1.468 1.00 0.00 H new ATOM 0 HG2 LYS A 38 7.027 -2.180 3.834 1.00 0.00 H new ATOM 0 HG3 LYS A 38 7.867 -2.178 2.296 1.00 0.00 H new ATOM 0 HD2 LYS A 38 9.499 -1.250 3.639 1.00 0.00 H new ATOM 0 HD3 LYS A 38 8.712 0.215 3.087 1.00 0.00 H new ATOM 0 HE2 LYS A 38 7.353 0.303 5.160 1.00 0.00 H new ATOM 0 HE3 LYS A 38 8.046 -1.211 5.704 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 9.108 0.670 6.764 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 10.228 -0.151 5.787 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 9.556 1.316 5.259 1.00 0.00 H new ATOM 431 N LYS A 39 6.074 2.330 1.661 1.00 0.00 N ATOM 432 CA LYS A 39 5.878 3.291 0.554 1.00 0.00 C ATOM 433 C LYS A 39 5.964 2.612 -0.834 1.00 0.00 C ATOM 434 O LYS A 39 6.761 1.693 -1.006 1.00 0.00 O ATOM 435 CB LYS A 39 6.926 4.408 0.721 1.00 0.00 C ATOM 436 CG LYS A 39 6.639 5.632 -0.167 1.00 0.00 C ATOM 437 CD LYS A 39 7.629 6.776 0.092 1.00 0.00 C ATOM 438 CE LYS A 39 8.991 6.503 -0.562 1.00 0.00 C ATOM 439 NZ LYS A 39 9.892 7.683 -0.461 1.00 0.00 N ATOM 0 H LYS A 39 7.006 2.379 2.072 1.00 0.00 H new ATOM 0 HA LYS A 39 4.873 3.712 0.600 1.00 0.00 H new ATOM 0 HB2 LYS A 39 6.954 4.721 1.765 1.00 0.00 H new ATOM 0 HB3 LYS A 39 7.913 4.013 0.480 1.00 0.00 H new ATOM 0 HG2 LYS A 39 6.690 5.339 -1.216 1.00 0.00 H new ATOM 0 HG3 LYS A 39 5.624 5.983 0.017 1.00 0.00 H new ATOM 0 HD2 LYS A 39 7.219 7.708 -0.296 1.00 0.00 H new ATOM 0 HD3 LYS A 39 7.760 6.908 1.166 1.00 0.00 H new ATOM 0 HE2 LYS A 39 9.460 5.644 -0.082 1.00 0.00 H new ATOM 0 HE3 LYS A 39 8.846 6.243 -1.611 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 10.803 7.464 -0.913 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 9.455 8.496 -0.940 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 10.049 7.915 0.541 1.00 0.00 H new ATOM 453 N LEU A 40 5.191 3.062 -1.830 1.00 0.00 N ATOM 454 CA LEU A 40 5.262 2.614 -3.233 1.00 0.00 C ATOM 455 C LEU A 40 5.129 3.800 -4.200 1.00 0.00 C ATOM 456 O LEU A 40 4.529 4.828 -3.892 1.00 0.00 O ATOM 457 CB LEU A 40 4.153 1.570 -3.507 1.00 0.00 C ATOM 458 CG LEU A 40 4.519 0.129 -3.110 1.00 0.00 C ATOM 459 CD1 LEU A 40 3.254 -0.729 -3.094 1.00 0.00 C ATOM 460 CD2 LEU A 40 5.521 -0.481 -4.106 1.00 0.00 C ATOM 0 H LEU A 40 4.474 3.772 -1.680 1.00 0.00 H new ATOM 0 HA LEU A 40 6.236 2.155 -3.399 1.00 0.00 H new ATOM 0 HB2 LEU A 40 3.253 1.865 -2.967 1.00 0.00 H new ATOM 0 HB3 LEU A 40 3.908 1.589 -4.569 1.00 0.00 H new ATOM 0 HG LEU A 40 4.977 0.153 -2.121 1.00 0.00 H new ATOM 0 HD11 LEU A 40 3.511 -1.750 -2.813 1.00 0.00 H new ATOM 0 HD12 LEU A 40 2.547 -0.321 -2.372 1.00 0.00 H new ATOM 0 HD13 LEU A 40 2.801 -0.728 -4.086 1.00 0.00 H new ATOM 0 HD21 LEU A 40 5.762 -1.499 -3.802 1.00 0.00 H new ATOM 0 HD22 LEU A 40 5.080 -0.495 -5.103 1.00 0.00 H new ATOM 0 HD23 LEU A 40 6.431 0.119 -4.120 1.00 0.00 H new ATOM 472 N ASP A 41 5.674 3.637 -5.402 1.00 0.00 N ATOM 473 CA ASP A 41 5.740 4.667 -6.439 1.00 0.00 C ATOM 474 C ASP A 41 5.553 4.023 -7.822 1.00 0.00 C ATOM 475 O ASP A 41 6.170 3.002 -8.129 1.00 0.00 O ATOM 476 CB ASP A 41 7.087 5.403 -6.302 1.00 0.00 C ATOM 477 CG ASP A 41 7.396 6.395 -7.440 1.00 0.00 C ATOM 478 OD1 ASP A 41 6.459 7.031 -7.972 1.00 0.00 O ATOM 479 OD2 ASP A 41 8.592 6.549 -7.786 1.00 0.00 O ATOM 0 H ASP A 41 6.097 2.755 -5.693 1.00 0.00 H new ATOM 0 HA ASP A 41 4.939 5.398 -6.323 1.00 0.00 H new ATOM 0 HB2 ASP A 41 7.096 5.943 -5.355 1.00 0.00 H new ATOM 0 HB3 ASP A 41 7.887 4.664 -6.255 1.00 0.00 H new ATOM 484 N LEU A 42 4.673 4.624 -8.631 1.00 0.00 N ATOM 485 CA LEU A 42 4.242 4.219 -9.978 1.00 0.00 C ATOM 486 C LEU A 42 3.310 5.321 -10.540 1.00 0.00 C ATOM 487 O LEU A 42 3.142 6.368 -9.908 1.00 0.00 O ATOM 488 CB LEU A 42 3.635 2.783 -9.950 1.00 0.00 C ATOM 489 CG LEU A 42 4.035 1.790 -11.079 1.00 0.00 C ATOM 490 CD1 LEU A 42 5.530 1.810 -11.405 1.00 0.00 C ATOM 491 CD2 LEU A 42 3.723 0.354 -10.615 1.00 0.00 C ATOM 0 H LEU A 42 4.203 5.480 -8.337 1.00 0.00 H new ATOM 0 HA LEU A 42 5.084 4.140 -10.666 1.00 0.00 H new ATOM 0 HB2 LEU A 42 3.903 2.328 -8.997 1.00 0.00 H new ATOM 0 HB3 LEU A 42 2.549 2.881 -9.963 1.00 0.00 H new ATOM 0 HG LEU A 42 3.473 2.095 -11.962 1.00 0.00 H new ATOM 0 HD11 LEU A 42 5.739 1.094 -12.200 1.00 0.00 H new ATOM 0 HD12 LEU A 42 5.818 2.809 -11.732 1.00 0.00 H new ATOM 0 HD13 LEU A 42 6.100 1.541 -10.516 1.00 0.00 H new ATOM 0 HD21 LEU A 42 4.000 -0.350 -11.400 1.00 0.00 H new ATOM 0 HD22 LEU A 42 4.291 0.132 -9.711 1.00 0.00 H new ATOM 0 HD23 LEU A 42 2.657 0.263 -10.405 1.00 0.00 H new ATOM 503 N THR A 43 2.729 5.127 -11.730 1.00 0.00 N ATOM 504 CA THR A 43 2.037 6.197 -12.492 1.00 0.00 C ATOM 505 C THR A 43 0.544 6.199 -12.145 1.00 0.00 C ATOM 506 O THR A 43 0.070 5.275 -11.497 1.00 0.00 O ATOM 507 CB THR A 43 2.354 6.054 -13.994 1.00 0.00 C ATOM 508 OG1 THR A 43 3.760 5.995 -14.148 1.00 0.00 O ATOM 509 CG2 THR A 43 1.858 7.202 -14.880 1.00 0.00 C ATOM 0 H THR A 43 2.720 4.223 -12.202 1.00 0.00 H new ATOM 0 HA THR A 43 2.404 7.183 -12.207 1.00 0.00 H new ATOM 0 HB THR A 43 1.832 5.154 -14.317 1.00 0.00 H new ATOM 0 HG1 THR A 43 3.981 5.902 -15.098 1.00 0.00 H new ATOM 0 HG21 THR A 43 2.131 7.006 -15.917 1.00 0.00 H new ATOM 0 HG22 THR A 43 0.774 7.282 -14.799 1.00 0.00 H new ATOM 0 HG23 THR A 43 2.316 8.136 -14.555 1.00 0.00 H new ATOM 517 N ARG A 44 -0.213 7.238 -12.518 1.00 0.00 N ATOM 518 CA ARG A 44 -1.574 7.501 -12.006 1.00 0.00 C ATOM 519 C ARG A 44 -2.526 6.290 -12.056 1.00 0.00 C ATOM 520 O ARG A 44 -3.234 6.024 -11.084 1.00 0.00 O ATOM 521 CB ARG A 44 -2.169 8.698 -12.766 1.00 0.00 C ATOM 522 CG ARG A 44 -3.448 9.235 -12.095 1.00 0.00 C ATOM 523 CD ARG A 44 -3.942 10.548 -12.716 1.00 0.00 C ATOM 524 NE ARG A 44 -4.425 10.368 -14.098 1.00 0.00 N ATOM 525 CZ ARG A 44 -4.800 11.336 -14.930 1.00 0.00 C ATOM 526 NH1 ARG A 44 -4.771 12.607 -14.585 1.00 0.00 N ATOM 527 NH2 ARG A 44 -5.217 11.032 -16.140 1.00 0.00 N ATOM 0 H ARG A 44 0.103 7.933 -13.194 1.00 0.00 H new ATOM 0 HA ARG A 44 -1.472 7.726 -10.944 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -1.428 9.495 -12.822 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -2.395 8.400 -13.790 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -4.235 8.484 -12.171 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -3.257 9.390 -11.033 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -4.745 10.957 -12.103 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -3.132 11.278 -12.709 1.00 0.00 H new ATOM 0 HE ARG A 44 -4.476 9.412 -14.449 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -4.453 12.876 -13.654 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -5.066 13.323 -15.249 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -5.252 10.057 -16.437 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -5.505 11.771 -16.781 1.00 0.00 H new ATOM 541 N ALA A 45 -2.526 5.527 -13.151 1.00 0.00 N ATOM 542 CA ALA A 45 -3.357 4.326 -13.297 1.00 0.00 C ATOM 543 C ALA A 45 -2.889 3.179 -12.379 1.00 0.00 C ATOM 544 O ALA A 45 -3.720 2.523 -11.748 1.00 0.00 O ATOM 545 CB ALA A 45 -3.359 3.934 -14.778 1.00 0.00 C ATOM 0 H ALA A 45 -1.947 5.725 -13.967 1.00 0.00 H new ATOM 0 HA ALA A 45 -4.377 4.539 -12.978 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -3.970 3.042 -14.918 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -3.770 4.752 -15.370 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -2.339 3.729 -15.101 1.00 0.00 H new ATOM 551 N GLU A 46 -1.576 2.979 -12.238 1.00 0.00 N ATOM 552 CA GLU A 46 -0.965 2.022 -11.316 1.00 0.00 C ATOM 553 C GLU A 46 -1.240 2.364 -9.842 1.00 0.00 C ATOM 554 O GLU A 46 -1.535 1.516 -8.997 1.00 0.00 O ATOM 555 CB GLU A 46 0.536 2.002 -11.560 1.00 0.00 C ATOM 556 CG GLU A 46 0.886 1.391 -12.912 1.00 0.00 C ATOM 557 CD GLU A 46 1.177 2.453 -13.986 1.00 0.00 C ATOM 558 OE1 GLU A 46 0.264 3.239 -14.327 1.00 0.00 O ATOM 559 OE2 GLU A 46 2.326 2.496 -14.483 1.00 0.00 O ATOM 0 H GLU A 46 -0.887 3.498 -12.782 1.00 0.00 H new ATOM 0 HA GLU A 46 -1.407 1.044 -11.506 1.00 0.00 H new ATOM 0 HB2 GLU A 46 0.925 3.019 -11.510 1.00 0.00 H new ATOM 0 HB3 GLU A 46 1.025 1.434 -10.768 1.00 0.00 H new ATOM 0 HG2 GLU A 46 1.757 0.746 -12.800 1.00 0.00 H new ATOM 0 HG3 GLU A 46 0.062 0.760 -13.245 1.00 0.00 H new ATOM 566 N TYR A 47 -1.202 3.654 -9.549 1.00 0.00 N ATOM 567 CA TYR A 47 -1.673 4.197 -8.282 1.00 0.00 C ATOM 568 C TYR A 47 -3.154 3.858 -8.071 1.00 0.00 C ATOM 569 O TYR A 47 -3.480 3.302 -7.021 1.00 0.00 O ATOM 570 CB TYR A 47 -1.350 5.703 -8.200 1.00 0.00 C ATOM 571 CG TYR A 47 -2.324 6.562 -7.397 1.00 0.00 C ATOM 572 CD1 TYR A 47 -2.767 6.166 -6.118 1.00 0.00 C ATOM 573 CD2 TYR A 47 -2.830 7.751 -7.957 1.00 0.00 C ATOM 574 CE1 TYR A 47 -3.722 6.928 -5.419 1.00 0.00 C ATOM 575 CE2 TYR A 47 -3.789 8.518 -7.270 1.00 0.00 C ATOM 576 CZ TYR A 47 -4.252 8.101 -6.002 1.00 0.00 C ATOM 577 OH TYR A 47 -5.203 8.831 -5.353 1.00 0.00 O ATOM 0 H TYR A 47 -0.840 4.361 -10.189 1.00 0.00 H new ATOM 0 HA TYR A 47 -1.144 3.729 -7.452 1.00 0.00 H new ATOM 0 HB2 TYR A 47 -0.356 5.816 -7.766 1.00 0.00 H new ATOM 0 HB3 TYR A 47 -1.302 6.098 -9.215 1.00 0.00 H new ATOM 0 HD1 TYR A 47 -2.369 5.268 -5.670 1.00 0.00 H new ATOM 0 HD2 TYR A 47 -2.478 8.078 -8.924 1.00 0.00 H new ATOM 0 HE1 TYR A 47 -4.049 6.616 -4.438 1.00 0.00 H new ATOM 0 HE2 TYR A 47 -4.171 9.426 -7.712 1.00 0.00 H new ATOM 0 HH TYR A 47 -5.451 9.605 -5.900 1.00 0.00 H new ATOM 587 N GLU A 48 -4.025 4.112 -9.053 1.00 0.00 N ATOM 588 CA GLU A 48 -5.450 3.791 -8.941 1.00 0.00 C ATOM 589 C GLU A 48 -5.678 2.312 -8.600 1.00 0.00 C ATOM 590 O GLU A 48 -6.427 2.022 -7.669 1.00 0.00 O ATOM 591 CB GLU A 48 -6.222 4.133 -10.226 1.00 0.00 C ATOM 592 CG GLU A 48 -7.710 4.341 -9.934 1.00 0.00 C ATOM 593 CD GLU A 48 -7.985 5.723 -9.318 1.00 0.00 C ATOM 594 OE1 GLU A 48 -8.030 6.725 -10.070 1.00 0.00 O ATOM 595 OE2 GLU A 48 -8.182 5.818 -8.083 1.00 0.00 O ATOM 0 H GLU A 48 -3.764 4.542 -9.940 1.00 0.00 H new ATOM 0 HA GLU A 48 -5.830 4.407 -8.126 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -5.806 5.035 -10.675 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -6.099 3.330 -10.953 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -8.280 4.235 -10.857 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -8.059 3.564 -9.254 1.00 0.00 H new ATOM 602 N ILE A 49 -5.016 1.371 -9.294 1.00 0.00 N ATOM 603 CA ILE A 49 -5.199 -0.058 -9.026 1.00 0.00 C ATOM 604 C ILE A 49 -4.735 -0.416 -7.615 1.00 0.00 C ATOM 605 O ILE A 49 -5.468 -1.100 -6.904 1.00 0.00 O ATOM 606 CB ILE A 49 -4.521 -0.948 -10.099 1.00 0.00 C ATOM 607 CG1 ILE A 49 -3.035 -0.649 -10.315 1.00 0.00 C ATOM 608 CG2 ILE A 49 -5.277 -0.877 -11.419 1.00 0.00 C ATOM 609 CD1 ILE A 49 -2.207 -1.589 -11.190 1.00 0.00 C ATOM 0 H ILE A 49 -4.353 1.577 -10.041 1.00 0.00 H new ATOM 0 HA ILE A 49 -6.268 -0.264 -9.086 1.00 0.00 H new ATOM 0 HB ILE A 49 -4.567 -1.964 -9.706 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -2.960 0.350 -10.744 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -2.562 -0.611 -9.334 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -4.782 -1.510 -12.156 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -6.300 -1.223 -11.272 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -5.291 0.153 -11.776 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -1.178 -1.231 -11.237 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -2.223 -2.592 -10.763 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -2.628 -1.615 -12.195 1.00 0.00 H new ATOM 621 N LEU A 50 -3.542 0.028 -7.190 1.00 0.00 N ATOM 622 CA LEU A 50 -2.982 -0.441 -5.920 1.00 0.00 C ATOM 623 C LEU A 50 -3.671 0.249 -4.720 1.00 0.00 C ATOM 624 O LEU A 50 -3.961 -0.392 -3.713 1.00 0.00 O ATOM 625 CB LEU A 50 -1.454 -0.262 -5.998 1.00 0.00 C ATOM 626 CG LEU A 50 -0.690 -0.963 -4.855 1.00 0.00 C ATOM 627 CD1 LEU A 50 0.568 -1.660 -5.389 1.00 0.00 C ATOM 628 CD2 LEU A 50 -0.314 0.048 -3.763 1.00 0.00 C ATOM 0 H LEU A 50 -2.960 0.696 -7.696 1.00 0.00 H new ATOM 0 HA LEU A 50 -3.179 -1.500 -5.750 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -1.099 -0.651 -6.953 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -1.220 0.802 -5.981 1.00 0.00 H new ATOM 0 HG LEU A 50 -1.344 -1.719 -4.422 1.00 0.00 H new ATOM 0 HD11 LEU A 50 1.091 -2.147 -4.566 1.00 0.00 H new ATOM 0 HD12 LEU A 50 0.283 -2.406 -6.131 1.00 0.00 H new ATOM 0 HD13 LEU A 50 1.225 -0.922 -5.850 1.00 0.00 H new ATOM 0 HD21 LEU A 50 0.224 -0.462 -2.964 1.00 0.00 H new ATOM 0 HD22 LEU A 50 0.321 0.825 -4.189 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -1.219 0.501 -3.359 1.00 0.00 H new ATOM 640 N SER A 51 -4.035 1.526 -4.859 1.00 0.00 N ATOM 641 CA SER A 51 -4.961 2.240 -3.965 1.00 0.00 C ATOM 642 C SER A 51 -6.299 1.505 -3.790 1.00 0.00 C ATOM 643 O SER A 51 -6.665 1.152 -2.662 1.00 0.00 O ATOM 644 CB SER A 51 -5.200 3.644 -4.541 1.00 0.00 C ATOM 645 OG SER A 51 -6.126 4.389 -3.770 1.00 0.00 O ATOM 0 H SER A 51 -3.686 2.112 -5.617 1.00 0.00 H new ATOM 0 HA SER A 51 -4.508 2.296 -2.975 1.00 0.00 H new ATOM 0 HB2 SER A 51 -4.253 4.182 -4.587 1.00 0.00 H new ATOM 0 HB3 SER A 51 -5.568 3.557 -5.563 1.00 0.00 H new ATOM 0 HG SER A 51 -5.873 4.347 -2.824 1.00 0.00 H new ATOM 651 N LEU A 52 -7.022 1.210 -4.882 1.00 0.00 N ATOM 652 CA LEU A 52 -8.321 0.539 -4.785 1.00 0.00 C ATOM 653 C LEU A 52 -8.207 -0.913 -4.336 1.00 0.00 C ATOM 654 O LEU A 52 -9.183 -1.478 -3.848 1.00 0.00 O ATOM 655 CB LEU A 52 -9.055 0.572 -6.128 1.00 0.00 C ATOM 656 CG LEU A 52 -10.569 0.840 -5.952 1.00 0.00 C ATOM 657 CD1 LEU A 52 -10.848 2.282 -5.490 1.00 0.00 C ATOM 658 CD2 LEU A 52 -11.322 0.606 -7.264 1.00 0.00 C ATOM 0 H LEU A 52 -6.729 1.425 -5.835 1.00 0.00 H new ATOM 0 HA LEU A 52 -8.882 1.090 -4.030 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -8.620 1.346 -6.760 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -8.912 -0.378 -6.643 1.00 0.00 H new ATOM 0 HG LEU A 52 -10.917 0.145 -5.188 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -11.923 2.427 -5.379 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -10.357 2.459 -4.533 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -10.462 2.982 -6.231 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -12.384 0.801 -7.114 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -10.935 1.277 -8.031 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -11.184 -0.427 -7.583 1.00 0.00 H new ATOM 670 N LEU A 53 -7.049 -1.538 -4.528 1.00 0.00 N ATOM 671 CA LEU A 53 -6.747 -2.831 -3.945 1.00 0.00 C ATOM 672 C LEU A 53 -6.685 -2.733 -2.422 1.00 0.00 C ATOM 673 O LEU A 53 -7.366 -3.491 -1.741 1.00 0.00 O ATOM 674 CB LEU A 53 -5.469 -3.359 -4.596 1.00 0.00 C ATOM 675 CG LEU A 53 -4.962 -4.619 -3.893 1.00 0.00 C ATOM 676 CD1 LEU A 53 -4.215 -5.499 -4.881 1.00 0.00 C ATOM 677 CD2 LEU A 53 -4.018 -4.331 -2.709 1.00 0.00 C ATOM 0 H LEU A 53 -6.293 -1.155 -5.096 1.00 0.00 H new ATOM 0 HA LEU A 53 -7.538 -3.553 -4.145 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -5.658 -3.578 -5.647 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -4.698 -2.589 -4.565 1.00 0.00 H new ATOM 0 HG LEU A 53 -5.850 -5.115 -3.500 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -3.857 -6.394 -4.373 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -4.885 -5.785 -5.692 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -3.366 -4.949 -5.288 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -3.700 -5.272 -2.260 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -3.144 -3.785 -3.065 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -4.542 -3.732 -1.964 1.00 0.00 H new ATOM 689 N ILE A 54 -5.902 -1.804 -1.872 1.00 0.00 N ATOM 690 CA ILE A 54 -5.836 -1.621 -0.408 1.00 0.00 C ATOM 691 C ILE A 54 -7.220 -1.212 0.137 1.00 0.00 C ATOM 692 O ILE A 54 -7.631 -1.690 1.192 1.00 0.00 O ATOM 693 CB ILE A 54 -4.712 -0.625 -0.028 1.00 0.00 C ATOM 694 CG1 ILE A 54 -3.314 -1.096 -0.504 1.00 0.00 C ATOM 695 CG2 ILE A 54 -4.668 -0.455 1.503 1.00 0.00 C ATOM 696 CD1 ILE A 54 -2.288 0.043 -0.570 1.00 0.00 C ATOM 0 H ILE A 54 -5.308 -1.169 -2.405 1.00 0.00 H new ATOM 0 HA ILE A 54 -5.575 -2.567 0.066 1.00 0.00 H new ATOM 0 HB ILE A 54 -4.943 0.317 -0.525 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -2.948 -1.869 0.172 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -3.406 -1.552 -1.490 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -3.877 0.246 1.769 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -5.626 -0.071 1.854 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -4.470 -1.420 1.971 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -1.330 -0.350 -0.910 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -2.635 0.806 -1.267 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -2.169 0.484 0.420 1.00 0.00 H new ATOM 708 N SER A 55 -7.979 -0.412 -0.617 1.00 0.00 N ATOM 709 CA SER A 55 -9.380 -0.086 -0.303 1.00 0.00 C ATOM 710 C SER A 55 -10.319 -1.316 -0.273 1.00 0.00 C ATOM 711 O SER A 55 -11.101 -1.464 0.671 1.00 0.00 O ATOM 712 CB SER A 55 -9.899 0.959 -1.302 1.00 0.00 C ATOM 713 OG SER A 55 -11.071 1.617 -0.830 1.00 0.00 O ATOM 0 H SER A 55 -7.639 0.033 -1.470 1.00 0.00 H new ATOM 0 HA SER A 55 -9.388 0.317 0.710 1.00 0.00 H new ATOM 0 HB2 SER A 55 -9.120 1.698 -1.490 1.00 0.00 H new ATOM 0 HB3 SER A 55 -10.115 0.474 -2.254 1.00 0.00 H new ATOM 0 HG SER A 55 -11.367 2.274 -1.494 1.00 0.00 H new ATOM 719 N LYS A 56 -10.266 -2.214 -1.275 1.00 0.00 N ATOM 720 CA LYS A 56 -11.134 -3.409 -1.335 1.00 0.00 C ATOM 721 C LYS A 56 -10.667 -4.571 -0.424 1.00 0.00 C ATOM 722 O LYS A 56 -11.477 -5.452 -0.127 1.00 0.00 O ATOM 723 CB LYS A 56 -11.339 -3.858 -2.806 1.00 0.00 C ATOM 724 CG LYS A 56 -10.269 -4.826 -3.351 1.00 0.00 C ATOM 725 CD LYS A 56 -10.495 -5.300 -4.801 1.00 0.00 C ATOM 726 CE LYS A 56 -9.677 -4.557 -5.873 1.00 0.00 C ATOM 727 NZ LYS A 56 -10.152 -3.170 -6.109 1.00 0.00 N ATOM 0 H LYS A 56 -9.624 -2.134 -2.063 1.00 0.00 H new ATOM 0 HA LYS A 56 -12.101 -3.113 -0.927 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -12.315 -4.335 -2.891 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -11.361 -2.972 -3.440 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -9.296 -4.338 -3.292 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -10.227 -5.700 -2.701 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -10.258 -6.362 -4.859 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -11.554 -5.196 -5.039 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -8.631 -4.530 -5.569 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -9.723 -5.115 -6.808 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -9.620 -2.750 -6.898 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -11.165 -3.185 -6.344 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -10.005 -2.602 -5.251 1.00 0.00 H new ATOM 741 N LYS A 57 -9.381 -4.556 -0.039 1.00 0.00 N ATOM 742 CA LYS A 57 -8.534 -5.557 0.658 1.00 0.00 C ATOM 743 C LYS A 57 -7.618 -6.308 -0.336 1.00 0.00 C ATOM 744 O LYS A 57 -7.974 -6.495 -1.500 1.00 0.00 O ATOM 745 CB LYS A 57 -9.309 -6.563 1.529 1.00 0.00 C ATOM 746 CG LYS A 57 -10.021 -5.909 2.728 1.00 0.00 C ATOM 747 CD LYS A 57 -10.850 -6.912 3.543 1.00 0.00 C ATOM 748 CE LYS A 57 -12.074 -7.418 2.763 1.00 0.00 C ATOM 749 NZ LYS A 57 -12.897 -8.355 3.575 1.00 0.00 N ATOM 0 H LYS A 57 -8.826 -3.723 -0.235 1.00 0.00 H new ATOM 0 HA LYS A 57 -7.927 -4.971 1.348 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -10.048 -7.074 0.911 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -8.619 -7.323 1.895 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -9.279 -5.445 3.377 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -10.673 -5.113 2.368 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -10.223 -7.759 3.822 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -11.180 -6.441 4.469 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -12.686 -6.570 2.456 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -11.744 -7.919 1.853 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -13.713 -8.675 3.015 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -12.321 -9.177 3.847 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -13.233 -7.869 4.431 1.00 0.00 H new ATOM 763 N GLY A 58 -6.459 -6.769 0.163 1.00 0.00 N ATOM 764 CA GLY A 58 -5.320 -7.320 -0.595 1.00 0.00 C ATOM 765 C GLY A 58 -5.683 -8.266 -1.740 1.00 0.00 C ATOM 766 O GLY A 58 -5.707 -7.838 -2.894 1.00 0.00 O ATOM 0 H GLY A 58 -6.280 -6.767 1.167 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -4.743 -6.490 -1.003 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -4.668 -7.851 0.099 1.00 0.00 H new ATOM 770 N TYR A 59 -5.935 -9.545 -1.427 1.00 0.00 N ATOM 771 CA TYR A 59 -6.398 -10.574 -2.361 1.00 0.00 C ATOM 772 C TYR A 59 -5.349 -10.838 -3.466 1.00 0.00 C ATOM 773 O TYR A 59 -4.188 -10.438 -3.347 1.00 0.00 O ATOM 774 CB TYR A 59 -7.821 -10.185 -2.830 1.00 0.00 C ATOM 775 CG TYR A 59 -8.568 -11.209 -3.663 1.00 0.00 C ATOM 776 CD1 TYR A 59 -8.869 -12.475 -3.125 1.00 0.00 C ATOM 777 CD2 TYR A 59 -8.916 -10.916 -4.997 1.00 0.00 C ATOM 778 CE1 TYR A 59 -9.509 -13.448 -3.916 1.00 0.00 C ATOM 779 CE2 TYR A 59 -9.554 -11.884 -5.794 1.00 0.00 C ATOM 780 CZ TYR A 59 -9.855 -13.156 -5.255 1.00 0.00 C ATOM 781 OH TYR A 59 -10.476 -14.101 -6.018 1.00 0.00 O ATOM 0 H TYR A 59 -5.816 -9.902 -0.479 1.00 0.00 H new ATOM 0 HA TYR A 59 -6.492 -11.551 -1.887 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -8.421 -9.961 -1.948 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -7.749 -9.264 -3.408 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -8.608 -12.700 -2.102 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -8.692 -9.943 -5.409 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -9.736 -14.418 -3.499 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -9.814 -11.656 -6.817 1.00 0.00 H new ATOM 0 HH TYR A 59 -10.645 -13.739 -6.913 1.00 0.00 H new ATOM 791 N VAL A 60 -5.729 -11.553 -4.522 1.00 0.00 N ATOM 792 CA VAL A 60 -4.899 -11.754 -5.716 1.00 0.00 C ATOM 793 C VAL A 60 -5.303 -10.732 -6.787 1.00 0.00 C ATOM 794 O VAL A 60 -6.464 -10.640 -7.184 1.00 0.00 O ATOM 795 CB VAL A 60 -4.984 -13.204 -6.215 1.00 0.00 C ATOM 796 CG1 VAL A 60 -4.138 -13.408 -7.483 1.00 0.00 C ATOM 797 CG2 VAL A 60 -4.485 -14.184 -5.138 1.00 0.00 C ATOM 0 H VAL A 60 -6.635 -12.018 -4.577 1.00 0.00 H new ATOM 0 HA VAL A 60 -3.851 -11.587 -5.468 1.00 0.00 H new ATOM 0 HB VAL A 60 -6.032 -13.401 -6.441 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -4.219 -14.444 -7.812 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -4.499 -12.748 -8.272 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -3.095 -13.177 -7.266 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -4.555 -15.205 -5.514 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -3.447 -13.958 -4.893 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -5.099 -14.085 -4.243 1.00 0.00 H new ATOM 807 N PHE A 61 -4.317 -9.943 -7.207 1.00 0.00 N ATOM 808 CA PHE A 61 -4.425 -8.759 -8.057 1.00 0.00 C ATOM 809 C PHE A 61 -4.269 -9.185 -9.529 1.00 0.00 C ATOM 810 O PHE A 61 -3.169 -9.509 -9.978 1.00 0.00 O ATOM 811 CB PHE A 61 -3.314 -7.822 -7.551 1.00 0.00 C ATOM 812 CG PHE A 61 -3.318 -6.336 -7.836 1.00 0.00 C ATOM 813 CD1 PHE A 61 -4.450 -5.613 -8.257 1.00 0.00 C ATOM 814 CD2 PHE A 61 -2.165 -5.634 -7.453 1.00 0.00 C ATOM 815 CE1 PHE A 61 -4.395 -4.213 -8.339 1.00 0.00 C ATOM 816 CE2 PHE A 61 -2.079 -4.244 -7.592 1.00 0.00 C ATOM 817 CZ PHE A 61 -3.200 -3.535 -8.036 1.00 0.00 C ATOM 0 H PHE A 61 -3.349 -10.128 -6.943 1.00 0.00 H new ATOM 0 HA PHE A 61 -5.386 -8.247 -8.009 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -3.281 -7.933 -6.467 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -2.374 -8.213 -7.940 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -5.359 -6.135 -8.516 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -1.327 -6.177 -7.043 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -5.271 -3.655 -8.635 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -1.160 -3.726 -7.360 1.00 0.00 H new ATOM 0 HZ PHE A 61 -3.148 -2.462 -8.147 1.00 0.00 H new ATOM 827 N SER A 62 -5.388 -9.280 -10.247 1.00 0.00 N ATOM 828 CA SER A 62 -5.513 -10.027 -11.514 1.00 0.00 C ATOM 829 C SER A 62 -5.472 -9.148 -12.773 1.00 0.00 C ATOM 830 O SER A 62 -6.051 -8.066 -12.780 1.00 0.00 O ATOM 831 CB SER A 62 -6.890 -10.710 -11.540 1.00 0.00 C ATOM 832 OG SER A 62 -7.106 -11.558 -10.416 1.00 0.00 O ATOM 0 H SER A 62 -6.259 -8.831 -9.963 1.00 0.00 H new ATOM 0 HA SER A 62 -4.666 -10.712 -11.538 1.00 0.00 H new ATOM 0 HB2 SER A 62 -7.668 -9.948 -11.569 1.00 0.00 H new ATOM 0 HB3 SER A 62 -6.983 -11.296 -12.455 1.00 0.00 H new ATOM 0 HG SER A 62 -7.995 -11.966 -10.480 1.00 0.00 H new ATOM 838 N ARG A 63 -4.937 -9.663 -13.893 1.00 0.00 N ATOM 839 CA ARG A 63 -4.919 -8.992 -15.211 1.00 0.00 C ATOM 840 C ARG A 63 -6.262 -8.343 -15.632 1.00 0.00 C ATOM 841 O ARG A 63 -6.266 -7.216 -16.121 1.00 0.00 O ATOM 842 CB ARG A 63 -4.359 -9.977 -16.259 1.00 0.00 C ATOM 843 CG ARG A 63 -5.383 -10.944 -16.880 1.00 0.00 C ATOM 844 CD ARG A 63 -4.716 -12.057 -17.702 1.00 0.00 C ATOM 845 NE ARG A 63 -4.334 -13.205 -16.852 1.00 0.00 N ATOM 846 CZ ARG A 63 -5.120 -14.218 -16.491 1.00 0.00 C ATOM 847 NH1 ARG A 63 -6.381 -14.299 -16.864 1.00 0.00 N ATOM 848 NH2 ARG A 63 -4.644 -15.179 -15.733 1.00 0.00 N ATOM 0 H ARG A 63 -4.493 -10.581 -13.911 1.00 0.00 H new ATOM 0 HA ARG A 63 -4.258 -8.129 -15.135 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -3.897 -9.402 -17.061 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -3.568 -10.565 -15.792 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -5.983 -11.392 -16.087 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -6.066 -10.384 -17.519 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -5.398 -12.393 -18.483 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -3.831 -11.662 -18.200 1.00 0.00 H new ATOM 0 HE ARG A 63 -3.374 -13.223 -16.508 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -6.787 -13.570 -17.450 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -6.951 -15.091 -16.567 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -3.673 -15.149 -15.421 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -5.245 -15.955 -15.456 1.00 0.00 H new ATOM 862 N GLU A 64 -7.397 -9.008 -15.371 1.00 0.00 N ATOM 863 CA GLU A 64 -8.745 -8.484 -15.657 1.00 0.00 C ATOM 864 C GLU A 64 -9.120 -7.327 -14.721 1.00 0.00 C ATOM 865 O GLU A 64 -9.489 -6.247 -15.171 1.00 0.00 O ATOM 866 CB GLU A 64 -9.770 -9.621 -15.532 1.00 0.00 C ATOM 867 CG GLU A 64 -11.111 -9.263 -16.181 1.00 0.00 C ATOM 868 CD GLU A 64 -12.094 -10.439 -16.082 1.00 0.00 C ATOM 869 OE1 GLU A 64 -12.089 -11.318 -16.977 1.00 0.00 O ATOM 870 OE2 GLU A 64 -12.880 -10.496 -15.106 1.00 0.00 O ATOM 0 H GLU A 64 -7.407 -9.937 -14.950 1.00 0.00 H new ATOM 0 HA GLU A 64 -8.748 -8.091 -16.674 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -9.371 -10.521 -15.999 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -9.928 -9.852 -14.478 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -11.535 -8.386 -15.691 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -10.955 -9.000 -17.227 1.00 0.00 H new ATOM 877 N SER A 65 -8.984 -7.517 -13.410 1.00 0.00 N ATOM 878 CA SER A 65 -9.209 -6.454 -12.414 1.00 0.00 C ATOM 879 C SER A 65 -8.330 -5.223 -12.696 1.00 0.00 C ATOM 880 O SER A 65 -8.795 -4.086 -12.637 1.00 0.00 O ATOM 881 CB SER A 65 -8.931 -6.982 -10.998 1.00 0.00 C ATOM 882 OG SER A 65 -9.689 -8.158 -10.736 1.00 0.00 O ATOM 0 H SER A 65 -8.714 -8.412 -13.001 1.00 0.00 H new ATOM 0 HA SER A 65 -10.253 -6.149 -12.486 1.00 0.00 H new ATOM 0 HB2 SER A 65 -7.868 -7.198 -10.888 1.00 0.00 H new ATOM 0 HB3 SER A 65 -9.178 -6.215 -10.264 1.00 0.00 H new ATOM 0 HG SER A 65 -9.495 -8.477 -9.830 1.00 0.00 H new ATOM 888 N ILE A 66 -7.072 -5.447 -13.092 1.00 0.00 N ATOM 889 CA ILE A 66 -6.134 -4.400 -13.548 1.00 0.00 C ATOM 890 C ILE A 66 -6.644 -3.684 -14.812 1.00 0.00 C ATOM 891 O ILE A 66 -6.628 -2.455 -14.869 1.00 0.00 O ATOM 892 CB ILE A 66 -4.737 -5.021 -13.777 1.00 0.00 C ATOM 893 CG1 ILE A 66 -4.176 -5.656 -12.483 1.00 0.00 C ATOM 894 CG2 ILE A 66 -3.760 -4.001 -14.386 1.00 0.00 C ATOM 895 CD1 ILE A 66 -3.383 -4.730 -11.568 1.00 0.00 C ATOM 0 H ILE A 66 -6.663 -6.381 -13.107 1.00 0.00 H new ATOM 0 HA ILE A 66 -6.061 -3.640 -12.770 1.00 0.00 H new ATOM 0 HB ILE A 66 -4.853 -5.827 -14.502 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -5.010 -6.068 -11.914 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -3.536 -6.493 -12.762 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -2.788 -4.472 -14.533 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -4.145 -3.656 -15.345 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -3.653 -3.152 -13.711 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -3.041 -5.286 -10.695 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -2.522 -4.336 -12.107 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -4.018 -3.905 -11.247 1.00 0.00 H new ATOM 907 N ALA A 67 -7.140 -4.426 -15.803 1.00 0.00 N ATOM 908 CA ALA A 67 -7.765 -3.885 -17.013 1.00 0.00 C ATOM 909 C ALA A 67 -9.024 -3.059 -16.701 1.00 0.00 C ATOM 910 O ALA A 67 -9.344 -2.128 -17.438 1.00 0.00 O ATOM 911 CB ALA A 67 -8.116 -5.039 -17.962 1.00 0.00 C ATOM 0 H ALA A 67 -7.118 -5.446 -15.787 1.00 0.00 H new ATOM 0 HA ALA A 67 -7.050 -3.212 -17.486 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -8.581 -4.640 -18.863 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -7.208 -5.578 -18.231 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -8.809 -5.719 -17.467 1.00 0.00 H new ATOM 917 N ILE A 68 -9.729 -3.377 -15.609 1.00 0.00 N ATOM 918 CA ILE A 68 -10.888 -2.599 -15.140 1.00 0.00 C ATOM 919 C ILE A 68 -10.457 -1.334 -14.376 1.00 0.00 C ATOM 920 O ILE A 68 -11.035 -0.269 -14.604 1.00 0.00 O ATOM 921 CB ILE A 68 -11.846 -3.504 -14.323 1.00 0.00 C ATOM 922 CG1 ILE A 68 -12.507 -4.608 -15.188 1.00 0.00 C ATOM 923 CG2 ILE A 68 -12.937 -2.697 -13.593 1.00 0.00 C ATOM 924 CD1 ILE A 68 -13.438 -4.126 -16.311 1.00 0.00 C ATOM 0 H ILE A 68 -9.513 -4.183 -15.022 1.00 0.00 H new ATOM 0 HA ILE A 68 -11.441 -2.241 -16.008 1.00 0.00 H new ATOM 0 HB ILE A 68 -11.215 -3.987 -13.577 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -11.717 -5.212 -15.634 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -13.076 -5.264 -14.529 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -13.581 -3.377 -13.036 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -12.470 -1.994 -12.904 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -13.533 -2.148 -14.322 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -13.840 -4.987 -16.845 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -14.258 -3.550 -15.882 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -12.878 -3.498 -17.004 1.00 0.00 H new ATOM 936 N GLU A 69 -9.459 -1.420 -13.485 1.00 0.00 N ATOM 937 CA GLU A 69 -9.115 -0.334 -12.561 1.00 0.00 C ATOM 938 C GLU A 69 -7.951 0.573 -13.013 1.00 0.00 C ATOM 939 O GLU A 69 -7.923 1.737 -12.612 1.00 0.00 O ATOM 940 CB GLU A 69 -8.857 -0.942 -11.175 1.00 0.00 C ATOM 941 CG GLU A 69 -10.151 -1.042 -10.370 1.00 0.00 C ATOM 942 CD GLU A 69 -10.079 -2.118 -9.273 1.00 0.00 C ATOM 943 OE1 GLU A 69 -9.094 -2.165 -8.503 1.00 0.00 O ATOM 944 OE2 GLU A 69 -11.048 -2.902 -9.125 1.00 0.00 O ATOM 0 H GLU A 69 -8.868 -2.246 -13.386 1.00 0.00 H new ATOM 0 HA GLU A 69 -9.967 0.346 -12.536 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -8.416 -1.933 -11.285 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -8.135 -0.330 -10.634 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -10.367 -0.076 -9.914 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -10.978 -1.269 -11.043 1.00 0.00 H new ATOM 951 N SER A 70 -7.014 0.111 -13.851 1.00 0.00 N ATOM 952 CA SER A 70 -6.015 0.997 -14.486 1.00 0.00 C ATOM 953 C SER A 70 -6.508 1.423 -15.880 1.00 0.00 C ATOM 954 O SER A 70 -6.618 2.623 -16.149 1.00 0.00 O ATOM 955 CB SER A 70 -4.601 0.367 -14.496 1.00 0.00 C ATOM 956 OG SER A 70 -3.935 0.514 -15.746 1.00 0.00 O ATOM 0 H SER A 70 -6.922 -0.872 -14.109 1.00 0.00 H new ATOM 0 HA SER A 70 -5.913 1.902 -13.887 1.00 0.00 H new ATOM 0 HB2 SER A 70 -3.998 0.828 -13.713 1.00 0.00 H new ATOM 0 HB3 SER A 70 -4.680 -0.693 -14.255 1.00 0.00 H new ATOM 0 HG SER A 70 -3.048 0.100 -15.695 1.00 0.00 H new ATOM 962 N GLU A 71 -6.869 0.450 -16.735 1.00 0.00 N ATOM 963 CA GLU A 71 -7.630 0.652 -17.982 1.00 0.00 C ATOM 964 C GLU A 71 -6.850 1.435 -19.071 1.00 0.00 C ATOM 965 O GLU A 71 -7.420 1.872 -20.074 1.00 0.00 O ATOM 966 CB GLU A 71 -9.014 1.254 -17.638 1.00 0.00 C ATOM 967 CG GLU A 71 -10.098 1.033 -18.704 1.00 0.00 C ATOM 968 CD GLU A 71 -11.483 1.469 -18.199 1.00 0.00 C ATOM 969 OE1 GLU A 71 -11.677 2.674 -17.903 1.00 0.00 O ATOM 970 OE2 GLU A 71 -12.409 0.626 -18.140 1.00 0.00 O ATOM 0 H GLU A 71 -6.632 -0.529 -16.573 1.00 0.00 H new ATOM 0 HA GLU A 71 -7.790 -0.319 -18.451 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -9.357 0.824 -16.697 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -8.898 2.326 -17.475 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -9.845 1.594 -19.604 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -10.126 -0.020 -18.983 1.00 0.00 H new ATOM 977 N SER A 72 -5.532 1.610 -18.919 1.00 0.00 N ATOM 978 CA SER A 72 -4.692 2.347 -19.882 1.00 0.00 C ATOM 979 C SER A 72 -4.553 1.659 -21.256 1.00 0.00 C ATOM 980 O SER A 72 -4.243 2.324 -22.249 1.00 0.00 O ATOM 981 CB SER A 72 -3.286 2.558 -19.299 1.00 0.00 C ATOM 982 OG SER A 72 -3.324 3.360 -18.124 1.00 0.00 O ATOM 0 H SER A 72 -5.012 1.244 -18.122 1.00 0.00 H new ATOM 0 HA SER A 72 -5.203 3.295 -20.048 1.00 0.00 H new ATOM 0 HB2 SER A 72 -2.838 1.592 -19.067 1.00 0.00 H new ATOM 0 HB3 SER A 72 -2.649 3.033 -20.045 1.00 0.00 H new ATOM 0 HG SER A 72 -2.415 3.474 -17.776 1.00 0.00 H new ATOM 988 N ILE A 73 -4.777 0.338 -21.330 1.00 0.00 N ATOM 989 CA ILE A 73 -4.708 -0.478 -22.557 1.00 0.00 C ATOM 990 C ILE A 73 -6.117 -1.015 -22.894 1.00 0.00 C ATOM 991 O ILE A 73 -6.907 -1.315 -21.997 1.00 0.00 O ATOM 992 CB ILE A 73 -3.679 -1.636 -22.412 1.00 0.00 C ATOM 993 CG1 ILE A 73 -2.434 -1.335 -21.537 1.00 0.00 C ATOM 994 CG2 ILE A 73 -3.207 -2.100 -23.803 1.00 0.00 C ATOM 995 CD1 ILE A 73 -1.487 -0.235 -22.038 1.00 0.00 C ATOM 0 H ILE A 73 -5.020 -0.214 -20.507 1.00 0.00 H new ATOM 0 HA ILE A 73 -4.362 0.149 -23.379 1.00 0.00 H new ATOM 0 HB ILE A 73 -4.227 -2.416 -21.883 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -2.778 -1.060 -20.540 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -1.861 -2.256 -21.433 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -2.487 -2.911 -23.691 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -4.063 -2.452 -24.379 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -2.737 -1.266 -24.324 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -0.658 -0.122 -21.339 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -1.099 -0.508 -23.019 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -2.030 0.707 -22.112 1.00 0.00 H new ATOM 1007 N ASN A 74 -6.448 -1.134 -24.184 1.00 0.00 N ATOM 1008 CA ASN A 74 -7.822 -1.387 -24.649 1.00 0.00 C ATOM 1009 C ASN A 74 -8.465 -2.750 -24.258 1.00 0.00 C ATOM 1010 O ASN A 74 -9.651 -2.733 -23.901 1.00 0.00 O ATOM 1011 CB ASN A 74 -7.887 -1.175 -26.174 1.00 0.00 C ATOM 1012 CG ASN A 74 -7.581 0.267 -26.574 1.00 0.00 C ATOM 1013 OD1 ASN A 74 -6.452 0.611 -26.908 1.00 0.00 O ATOM 1014 ND2 ASN A 74 -8.563 1.152 -26.535 1.00 0.00 N ATOM 0 H ASN A 74 -5.769 -1.058 -24.941 1.00 0.00 H new ATOM 0 HA ASN A 74 -8.433 -0.664 -24.109 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -7.177 -1.843 -26.662 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -8.879 -1.446 -26.534 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -8.383 2.125 -26.783 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -9.500 0.862 -26.257 1.00 0.00 H new ATOM 1021 N PRO A 75 -7.782 -3.916 -24.349 1.00 0.00 N ATOM 1022 CA PRO A 75 -8.418 -5.223 -24.169 1.00 0.00 C ATOM 1023 C PRO A 75 -8.508 -5.624 -22.690 1.00 0.00 C ATOM 1024 O PRO A 75 -7.718 -5.175 -21.859 1.00 0.00 O ATOM 1025 CB PRO A 75 -7.553 -6.200 -24.969 1.00 0.00 C ATOM 1026 CG PRO A 75 -6.151 -5.618 -24.815 1.00 0.00 C ATOM 1027 CD PRO A 75 -6.396 -4.110 -24.761 1.00 0.00 C ATOM 0 HA PRO A 75 -9.451 -5.215 -24.518 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -7.616 -7.213 -24.572 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -7.858 -6.247 -26.014 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -5.664 -5.978 -23.909 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -5.509 -5.891 -25.652 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -5.714 -3.634 -24.056 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -6.216 -3.655 -25.735 1.00 0.00 H new ATOM 1035 N GLU A 76 -9.448 -6.521 -22.373 1.00 0.00 N ATOM 1036 CA GLU A 76 -9.705 -7.008 -21.009 1.00 0.00 C ATOM 1037 C GLU A 76 -8.592 -7.930 -20.463 1.00 0.00 C ATOM 1038 O GLU A 76 -8.569 -8.243 -19.273 1.00 0.00 O ATOM 1039 CB GLU A 76 -11.057 -7.740 -20.990 1.00 0.00 C ATOM 1040 CG GLU A 76 -12.244 -6.805 -21.255 1.00 0.00 C ATOM 1041 CD GLU A 76 -13.569 -7.579 -21.213 1.00 0.00 C ATOM 1042 OE1 GLU A 76 -13.984 -8.134 -22.259 1.00 0.00 O ATOM 1043 OE2 GLU A 76 -14.214 -7.635 -20.139 1.00 0.00 O ATOM 0 H GLU A 76 -10.065 -6.938 -23.070 1.00 0.00 H new ATOM 0 HA GLU A 76 -9.724 -6.139 -20.351 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -11.048 -8.530 -21.741 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -11.190 -8.223 -20.022 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -12.259 -6.009 -20.510 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -12.127 -6.328 -22.228 1.00 0.00 H new ATOM 1050 N SER A 77 -7.661 -8.373 -21.310 1.00 0.00 N ATOM 1051 CA SER A 77 -6.468 -9.131 -20.910 1.00 0.00 C ATOM 1052 C SER A 77 -5.347 -8.226 -20.363 1.00 0.00 C ATOM 1053 O SER A 77 -4.733 -8.560 -19.353 1.00 0.00 O ATOM 1054 CB SER A 77 -5.957 -9.927 -22.122 1.00 0.00 C ATOM 1055 OG SER A 77 -5.761 -9.080 -23.255 1.00 0.00 O ATOM 0 H SER A 77 -7.714 -8.213 -22.316 1.00 0.00 H new ATOM 0 HA SER A 77 -6.752 -9.803 -20.100 1.00 0.00 H new ATOM 0 HB2 SER A 77 -5.019 -10.419 -21.867 1.00 0.00 H new ATOM 0 HB3 SER A 77 -6.671 -10.712 -22.371 1.00 0.00 H new ATOM 0 HG SER A 77 -5.434 -9.613 -24.010 1.00 0.00 H new ATOM 1061 N SER A 78 -5.081 -7.083 -21.015 1.00 0.00 N ATOM 1062 CA SER A 78 -4.109 -6.051 -20.597 1.00 0.00 C ATOM 1063 C SER A 78 -2.704 -6.597 -20.256 1.00 0.00 C ATOM 1064 O SER A 78 -2.035 -6.110 -19.342 1.00 0.00 O ATOM 1065 CB SER A 78 -4.707 -5.190 -19.471 1.00 0.00 C ATOM 1066 OG SER A 78 -5.637 -4.252 -19.992 1.00 0.00 O ATOM 0 H SER A 78 -5.555 -6.839 -21.885 1.00 0.00 H new ATOM 0 HA SER A 78 -3.931 -5.414 -21.464 1.00 0.00 H new ATOM 0 HB2 SER A 78 -5.201 -5.831 -18.741 1.00 0.00 H new ATOM 0 HB3 SER A 78 -3.909 -4.665 -18.946 1.00 0.00 H new ATOM 0 HG SER A 78 -6.270 -4.712 -20.583 1.00 0.00 H new ATOM 1072 N ASN A 79 -2.218 -7.594 -21.005 1.00 0.00 N ATOM 1073 CA ASN A 79 -0.964 -8.300 -20.703 1.00 0.00 C ATOM 1074 C ASN A 79 0.269 -7.367 -20.642 1.00 0.00 C ATOM 1075 O ASN A 79 1.136 -7.530 -19.788 1.00 0.00 O ATOM 1076 CB ASN A 79 -0.778 -9.421 -21.739 1.00 0.00 C ATOM 1077 CG ASN A 79 0.436 -10.299 -21.429 1.00 0.00 C ATOM 1078 OD1 ASN A 79 0.547 -10.882 -20.357 1.00 0.00 O ATOM 1079 ND2 ASN A 79 1.379 -10.416 -22.348 1.00 0.00 N ATOM 0 H ASN A 79 -2.686 -7.937 -21.844 1.00 0.00 H new ATOM 0 HA ASN A 79 -1.042 -8.722 -19.701 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -1.675 -10.040 -21.767 1.00 0.00 H new ATOM 0 HB3 ASN A 79 -0.663 -8.982 -22.730 1.00 0.00 H new ATOM 0 HD21 ASN A 79 2.201 -10.992 -22.165 1.00 0.00 H new ATOM 0 HD22 ASN A 79 1.285 -9.930 -23.240 1.00 0.00 H new ATOM 1086 N LYS A 80 0.325 -6.332 -21.494 1.00 0.00 N ATOM 1087 CA LYS A 80 1.376 -5.295 -21.431 1.00 0.00 C ATOM 1088 C LYS A 80 1.205 -4.341 -20.235 1.00 0.00 C ATOM 1089 O LYS A 80 2.198 -3.839 -19.715 1.00 0.00 O ATOM 1090 CB LYS A 80 1.441 -4.527 -22.769 1.00 0.00 C ATOM 1091 CG LYS A 80 2.402 -5.158 -23.796 1.00 0.00 C ATOM 1092 CD LYS A 80 1.988 -6.531 -24.357 1.00 0.00 C ATOM 1093 CE LYS A 80 0.720 -6.504 -25.230 1.00 0.00 C ATOM 1094 NZ LYS A 80 0.942 -5.824 -26.539 1.00 0.00 N ATOM 0 H LYS A 80 -0.351 -6.187 -22.244 1.00 0.00 H new ATOM 0 HA LYS A 80 2.328 -5.802 -21.270 1.00 0.00 H new ATOM 0 HB2 LYS A 80 0.441 -4.480 -23.200 1.00 0.00 H new ATOM 0 HB3 LYS A 80 1.753 -3.501 -22.575 1.00 0.00 H new ATOM 0 HG2 LYS A 80 2.514 -4.466 -24.631 1.00 0.00 H new ATOM 0 HG3 LYS A 80 3.383 -5.259 -23.331 1.00 0.00 H new ATOM 0 HD2 LYS A 80 2.812 -6.933 -24.947 1.00 0.00 H new ATOM 0 HD3 LYS A 80 1.827 -7.217 -23.525 1.00 0.00 H new ATOM 0 HE2 LYS A 80 0.383 -7.525 -25.407 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -0.078 -5.994 -24.690 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 0.059 -5.832 -27.089 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 1.238 -4.841 -26.374 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 1.684 -6.324 -27.069 1.00 0.00 H new ATOM 1108 N SER A 81 -0.020 -4.148 -19.737 1.00 0.00 N ATOM 1109 CA SER A 81 -0.242 -3.427 -18.476 1.00 0.00 C ATOM 1110 C SER A 81 0.392 -4.210 -17.326 1.00 0.00 C ATOM 1111 O SER A 81 1.347 -3.719 -16.739 1.00 0.00 O ATOM 1112 CB SER A 81 -1.729 -3.156 -18.216 1.00 0.00 C ATOM 1113 OG SER A 81 -1.872 -2.110 -17.265 1.00 0.00 O ATOM 0 H SER A 81 -0.874 -4.480 -20.186 1.00 0.00 H new ATOM 0 HA SER A 81 0.236 -2.450 -18.551 1.00 0.00 H new ATOM 0 HB2 SER A 81 -2.226 -2.883 -19.147 1.00 0.00 H new ATOM 0 HB3 SER A 81 -2.214 -4.061 -17.850 1.00 0.00 H new ATOM 0 HG SER A 81 -2.824 -1.941 -17.105 1.00 0.00 H new ATOM 1119 N ILE A 82 -0.020 -5.457 -17.048 1.00 0.00 N ATOM 1120 CA ILE A 82 0.567 -6.218 -15.928 1.00 0.00 C ATOM 1121 C ILE A 82 2.094 -6.362 -16.021 1.00 0.00 C ATOM 1122 O ILE A 82 2.774 -6.254 -15.007 1.00 0.00 O ATOM 1123 CB ILE A 82 -0.121 -7.579 -15.728 1.00 0.00 C ATOM 1124 CG1 ILE A 82 -0.103 -8.488 -16.970 1.00 0.00 C ATOM 1125 CG2 ILE A 82 -1.552 -7.378 -15.199 1.00 0.00 C ATOM 1126 CD1 ILE A 82 -0.397 -9.956 -16.648 1.00 0.00 C ATOM 0 H ILE A 82 -0.742 -5.954 -17.570 1.00 0.00 H new ATOM 0 HA ILE A 82 0.375 -5.620 -15.037 1.00 0.00 H new ATOM 0 HB ILE A 82 0.470 -8.112 -14.983 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -0.839 -8.126 -17.688 1.00 0.00 H new ATOM 0 HG13 ILE A 82 0.873 -8.417 -17.450 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -2.029 -8.349 -15.061 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -1.517 -6.853 -14.245 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -2.126 -6.790 -15.916 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -0.369 -10.543 -17.566 1.00 0.00 H new ATOM 0 HD12 ILE A 82 0.353 -10.333 -15.953 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -1.385 -10.038 -16.195 1.00 0.00 H new ATOM 1138 N ASP A 83 2.639 -6.511 -17.227 1.00 0.00 N ATOM 1139 CA ASP A 83 4.082 -6.474 -17.503 1.00 0.00 C ATOM 1140 C ASP A 83 4.748 -5.131 -17.117 1.00 0.00 C ATOM 1141 O ASP A 83 5.741 -5.152 -16.383 1.00 0.00 O ATOM 1142 CB ASP A 83 4.330 -6.809 -18.978 1.00 0.00 C ATOM 1143 CG ASP A 83 5.832 -6.894 -19.296 1.00 0.00 C ATOM 1144 OD1 ASP A 83 6.468 -7.908 -18.922 1.00 0.00 O ATOM 1145 OD2 ASP A 83 6.364 -5.957 -19.935 1.00 0.00 O ATOM 0 H ASP A 83 2.078 -6.665 -18.065 1.00 0.00 H new ATOM 0 HA ASP A 83 4.552 -7.226 -16.870 1.00 0.00 H new ATOM 0 HB2 ASP A 83 3.852 -7.758 -19.221 1.00 0.00 H new ATOM 0 HB3 ASP A 83 3.867 -6.049 -19.607 1.00 0.00 H new ATOM 1150 N VAL A 84 4.203 -3.978 -17.548 1.00 0.00 N ATOM 1151 CA VAL A 84 4.675 -2.651 -17.074 1.00 0.00 C ATOM 1152 C VAL A 84 4.553 -2.556 -15.559 1.00 0.00 C ATOM 1153 O VAL A 84 5.493 -2.113 -14.908 1.00 0.00 O ATOM 1154 CB VAL A 84 3.919 -1.444 -17.690 1.00 0.00 C ATOM 1155 CG1 VAL A 84 4.186 -0.090 -17.001 1.00 0.00 C ATOM 1156 CG2 VAL A 84 4.338 -1.290 -19.163 1.00 0.00 C ATOM 0 H VAL A 84 3.438 -3.932 -18.221 1.00 0.00 H new ATOM 0 HA VAL A 84 5.713 -2.589 -17.401 1.00 0.00 H new ATOM 0 HB VAL A 84 2.861 -1.671 -17.561 1.00 0.00 H new ATOM 0 HG11 VAL A 84 3.615 0.692 -17.501 1.00 0.00 H new ATOM 0 HG12 VAL A 84 3.884 -0.148 -15.955 1.00 0.00 H new ATOM 0 HG13 VAL A 84 5.249 0.144 -17.059 1.00 0.00 H new ATOM 0 HG21 VAL A 84 3.812 -0.444 -19.604 1.00 0.00 H new ATOM 0 HG22 VAL A 84 5.413 -1.118 -19.219 1.00 0.00 H new ATOM 0 HG23 VAL A 84 4.087 -2.199 -19.710 1.00 0.00 H new ATOM 1166 N ILE A 85 3.411 -2.955 -14.999 1.00 0.00 N ATOM 1167 CA ILE A 85 3.124 -2.776 -13.576 1.00 0.00 C ATOM 1168 C ILE A 85 4.113 -3.609 -12.762 1.00 0.00 C ATOM 1169 O ILE A 85 4.835 -3.037 -11.952 1.00 0.00 O ATOM 1170 CB ILE A 85 1.639 -3.087 -13.260 1.00 0.00 C ATOM 1171 CG1 ILE A 85 0.546 -2.307 -14.055 1.00 0.00 C ATOM 1172 CG2 ILE A 85 1.388 -2.874 -11.752 1.00 0.00 C ATOM 1173 CD1 ILE A 85 0.966 -1.143 -14.970 1.00 0.00 C ATOM 0 H ILE A 85 2.660 -3.411 -15.518 1.00 0.00 H new ATOM 0 HA ILE A 85 3.262 -1.733 -13.292 1.00 0.00 H new ATOM 0 HB ILE A 85 1.522 -4.121 -13.585 1.00 0.00 H new ATOM 0 HG12 ILE A 85 0.010 -3.030 -14.670 1.00 0.00 H new ATOM 0 HG13 ILE A 85 -0.167 -1.913 -13.331 1.00 0.00 H new ATOM 0 HG21 ILE A 85 0.345 -3.091 -11.523 1.00 0.00 H new ATOM 0 HG22 ILE A 85 2.032 -3.540 -11.178 1.00 0.00 H new ATOM 0 HG23 ILE A 85 1.610 -1.840 -11.489 1.00 0.00 H new ATOM 0 HD11 ILE A 85 0.082 -0.715 -15.444 1.00 0.00 H new ATOM 0 HD12 ILE A 85 1.467 -0.377 -14.378 1.00 0.00 H new ATOM 0 HD13 ILE A 85 1.647 -1.511 -15.738 1.00 0.00 H new ATOM 1185 N ILE A 86 4.242 -4.915 -13.025 1.00 0.00 N ATOM 1186 CA ILE A 86 5.217 -5.788 -12.345 1.00 0.00 C ATOM 1187 C ILE A 86 6.636 -5.242 -12.473 1.00 0.00 C ATOM 1188 O ILE A 86 7.331 -5.171 -11.456 1.00 0.00 O ATOM 1189 CB ILE A 86 5.121 -7.252 -12.860 1.00 0.00 C ATOM 1190 CG1 ILE A 86 3.834 -7.903 -12.303 1.00 0.00 C ATOM 1191 CG2 ILE A 86 6.355 -8.108 -12.485 1.00 0.00 C ATOM 1192 CD1 ILE A 86 3.629 -9.348 -12.775 1.00 0.00 C ATOM 0 H ILE A 86 3.673 -5.402 -13.717 1.00 0.00 H new ATOM 0 HA ILE A 86 4.966 -5.798 -11.284 1.00 0.00 H new ATOM 0 HB ILE A 86 5.090 -7.214 -13.949 1.00 0.00 H new ATOM 0 HG12 ILE A 86 3.869 -7.886 -11.214 1.00 0.00 H new ATOM 0 HG13 ILE A 86 2.974 -7.305 -12.604 1.00 0.00 H new ATOM 0 HG21 ILE A 86 6.228 -9.119 -12.872 1.00 0.00 H new ATOM 0 HG22 ILE A 86 7.251 -7.664 -12.918 1.00 0.00 H new ATOM 0 HG23 ILE A 86 6.456 -8.145 -11.400 1.00 0.00 H new ATOM 0 HD11 ILE A 86 2.708 -9.743 -12.347 1.00 0.00 H new ATOM 0 HD12 ILE A 86 3.562 -9.369 -13.863 1.00 0.00 H new ATOM 0 HD13 ILE A 86 4.471 -9.959 -12.451 1.00 0.00 H new ATOM 1204 N GLY A 87 7.057 -4.873 -13.687 1.00 0.00 N ATOM 1205 CA GLY A 87 8.447 -4.530 -14.003 1.00 0.00 C ATOM 1206 C GLY A 87 8.874 -3.176 -13.453 1.00 0.00 C ATOM 1207 O GLY A 87 9.967 -3.057 -12.903 1.00 0.00 O ATOM 0 H GLY A 87 6.432 -4.803 -14.490 1.00 0.00 H new ATOM 0 HA2 GLY A 87 9.104 -5.301 -13.601 1.00 0.00 H new ATOM 0 HA3 GLY A 87 8.577 -4.532 -15.085 1.00 0.00 H new ATOM 1211 N ARG A 88 8.021 -2.148 -13.536 1.00 0.00 N ATOM 1212 CA ARG A 88 8.327 -0.813 -13.031 1.00 0.00 C ATOM 1213 C ARG A 88 8.076 -0.702 -11.514 1.00 0.00 C ATOM 1214 O ARG A 88 8.810 0.032 -10.860 1.00 0.00 O ATOM 1215 CB ARG A 88 7.572 0.235 -13.864 1.00 0.00 C ATOM 1216 CG ARG A 88 8.218 0.601 -15.214 1.00 0.00 C ATOM 1217 CD ARG A 88 8.304 -0.535 -16.243 1.00 0.00 C ATOM 1218 NE ARG A 88 8.739 -0.024 -17.558 1.00 0.00 N ATOM 1219 CZ ARG A 88 9.985 0.194 -17.972 1.00 0.00 C ATOM 1220 NH1 ARG A 88 11.036 -0.045 -17.214 1.00 0.00 N ATOM 1221 NH2 ARG A 88 10.192 0.672 -19.180 1.00 0.00 N ATOM 0 H ARG A 88 7.096 -2.224 -13.958 1.00 0.00 H new ATOM 0 HA ARG A 88 9.392 -0.615 -13.150 1.00 0.00 H new ATOM 0 HB2 ARG A 88 6.564 -0.134 -14.052 1.00 0.00 H new ATOM 0 HB3 ARG A 88 7.474 1.144 -13.270 1.00 0.00 H new ATOM 0 HG2 ARG A 88 7.654 1.423 -15.654 1.00 0.00 H new ATOM 0 HG3 ARG A 88 9.225 0.972 -15.025 1.00 0.00 H new ATOM 0 HD2 ARG A 88 9.004 -1.295 -15.894 1.00 0.00 H new ATOM 0 HD3 ARG A 88 7.331 -1.018 -16.340 1.00 0.00 H new ATOM 0 HE ARG A 88 7.998 0.186 -18.227 1.00 0.00 H new ATOM 0 HH11 ARG A 88 10.911 -0.411 -16.270 1.00 0.00 H new ATOM 0 HH12 ARG A 88 11.974 0.136 -17.571 1.00 0.00 H new ATOM 0 HH21 ARG A 88 9.401 0.873 -19.792 1.00 0.00 H new ATOM 0 HH22 ARG A 88 11.144 0.842 -19.505 1.00 0.00 H new ATOM 1235 N LEU A 89 7.177 -1.502 -10.915 1.00 0.00 N ATOM 1236 CA LEU A 89 7.149 -1.745 -9.462 1.00 0.00 C ATOM 1237 C LEU A 89 8.476 -2.383 -9.017 1.00 0.00 C ATOM 1238 O LEU A 89 9.119 -1.847 -8.119 1.00 0.00 O ATOM 1239 CB LEU A 89 5.889 -2.586 -9.148 1.00 0.00 C ATOM 1240 CG LEU A 89 5.380 -2.584 -7.696 1.00 0.00 C ATOM 1241 CD1 LEU A 89 3.978 -3.212 -7.653 1.00 0.00 C ATOM 1242 CD2 LEU A 89 6.288 -3.353 -6.726 1.00 0.00 C ATOM 0 H LEU A 89 6.448 -1.999 -11.426 1.00 0.00 H new ATOM 0 HA LEU A 89 7.071 -0.822 -8.888 1.00 0.00 H new ATOM 0 HB2 LEU A 89 5.081 -2.234 -9.789 1.00 0.00 H new ATOM 0 HB3 LEU A 89 6.094 -3.618 -9.432 1.00 0.00 H new ATOM 0 HG LEU A 89 5.369 -1.543 -7.372 1.00 0.00 H new ATOM 0 HD11 LEU A 89 3.611 -3.214 -6.627 1.00 0.00 H new ATOM 0 HD12 LEU A 89 3.300 -2.632 -8.279 1.00 0.00 H new ATOM 0 HD13 LEU A 89 4.027 -4.236 -8.023 1.00 0.00 H new ATOM 0 HD21 LEU A 89 5.867 -3.309 -5.721 1.00 0.00 H new ATOM 0 HD22 LEU A 89 6.362 -4.393 -7.044 1.00 0.00 H new ATOM 0 HD23 LEU A 89 7.281 -2.903 -6.723 1.00 0.00 H new ATOM 1254 N ARG A 90 8.951 -3.433 -9.716 1.00 0.00 N ATOM 1255 CA ARG A 90 10.302 -4.013 -9.514 1.00 0.00 C ATOM 1256 C ARG A 90 11.397 -2.941 -9.568 1.00 0.00 C ATOM 1257 O ARG A 90 12.221 -2.854 -8.665 1.00 0.00 O ATOM 1258 CB ARG A 90 10.602 -5.128 -10.545 1.00 0.00 C ATOM 1259 CG ARG A 90 10.941 -6.501 -9.935 1.00 0.00 C ATOM 1260 CD ARG A 90 9.938 -7.054 -8.911 1.00 0.00 C ATOM 1261 NE ARG A 90 8.540 -6.817 -9.312 1.00 0.00 N ATOM 1262 CZ ARG A 90 7.456 -7.199 -8.653 1.00 0.00 C ATOM 1263 NH1 ARG A 90 7.490 -8.004 -7.614 1.00 0.00 N ATOM 1264 NH2 ARG A 90 6.289 -6.758 -9.053 1.00 0.00 N ATOM 0 H ARG A 90 8.410 -3.907 -10.439 1.00 0.00 H new ATOM 0 HA ARG A 90 10.305 -4.453 -8.517 1.00 0.00 H new ATOM 0 HB2 ARG A 90 9.737 -5.241 -11.199 1.00 0.00 H new ATOM 0 HB3 ARG A 90 11.435 -4.809 -11.171 1.00 0.00 H new ATOM 0 HG2 ARG A 90 11.035 -7.223 -10.746 1.00 0.00 H new ATOM 0 HG3 ARG A 90 11.917 -6.431 -9.455 1.00 0.00 H new ATOM 0 HD2 ARG A 90 10.102 -8.125 -8.787 1.00 0.00 H new ATOM 0 HD3 ARG A 90 10.119 -6.590 -7.941 1.00 0.00 H new ATOM 0 HE ARG A 90 8.392 -6.308 -10.184 1.00 0.00 H new ATOM 0 HH11 ARG A 90 8.383 -8.366 -7.279 1.00 0.00 H new ATOM 0 HH12 ARG A 90 6.624 -8.266 -7.143 1.00 0.00 H new ATOM 0 HH21 ARG A 90 6.228 -6.133 -9.857 1.00 0.00 H new ATOM 0 HH22 ARG A 90 5.441 -7.039 -8.560 1.00 0.00 H new ATOM 1278 N SER A 91 11.368 -2.087 -10.592 1.00 0.00 N ATOM 1279 CA SER A 91 12.323 -0.980 -10.751 1.00 0.00 C ATOM 1280 C SER A 91 12.312 -0.034 -9.547 1.00 0.00 C ATOM 1281 O SER A 91 13.364 0.219 -8.957 1.00 0.00 O ATOM 1282 CB SER A 91 12.055 -0.228 -12.062 1.00 0.00 C ATOM 1283 OG SER A 91 13.104 0.686 -12.351 1.00 0.00 O ATOM 0 H SER A 91 10.678 -2.141 -11.341 1.00 0.00 H new ATOM 0 HA SER A 91 13.324 -1.408 -10.800 1.00 0.00 H new ATOM 0 HB2 SER A 91 11.954 -0.941 -12.880 1.00 0.00 H new ATOM 0 HB3 SER A 91 11.110 0.310 -11.990 1.00 0.00 H new ATOM 0 HG SER A 91 12.910 1.151 -13.192 1.00 0.00 H new ATOM 1289 N LYS A 92 11.135 0.418 -9.094 1.00 0.00 N ATOM 1290 CA LYS A 92 11.070 1.274 -7.901 1.00 0.00 C ATOM 1291 C LYS A 92 11.557 0.565 -6.623 1.00 0.00 C ATOM 1292 O LYS A 92 12.352 1.139 -5.882 1.00 0.00 O ATOM 1293 CB LYS A 92 9.660 1.877 -7.766 1.00 0.00 C ATOM 1294 CG LYS A 92 9.564 3.256 -8.445 1.00 0.00 C ATOM 1295 CD LYS A 92 9.737 3.252 -9.970 1.00 0.00 C ATOM 1296 CE LYS A 92 9.586 4.690 -10.489 1.00 0.00 C ATOM 1297 NZ LYS A 92 9.825 4.792 -11.956 1.00 0.00 N ATOM 0 H LYS A 92 10.233 0.212 -9.524 1.00 0.00 H new ATOM 0 HA LYS A 92 11.772 2.097 -8.034 1.00 0.00 H new ATOM 0 HB2 LYS A 92 8.930 1.200 -8.211 1.00 0.00 H new ATOM 0 HB3 LYS A 92 9.404 1.972 -6.711 1.00 0.00 H new ATOM 0 HG2 LYS A 92 8.594 3.692 -8.207 1.00 0.00 H new ATOM 0 HG3 LYS A 92 10.322 3.909 -8.012 1.00 0.00 H new ATOM 0 HD2 LYS A 92 10.716 2.855 -10.238 1.00 0.00 H new ATOM 0 HD3 LYS A 92 8.993 2.604 -10.433 1.00 0.00 H new ATOM 0 HE2 LYS A 92 8.584 5.052 -10.261 1.00 0.00 H new ATOM 0 HE3 LYS A 92 10.287 5.339 -9.963 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 9.712 5.781 -12.258 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 10.790 4.472 -12.174 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 9.140 4.195 -12.462 1.00 0.00 H new ATOM 1311 N ILE A 93 11.170 -0.693 -6.365 1.00 0.00 N ATOM 1312 CA ILE A 93 11.608 -1.417 -5.142 1.00 0.00 C ATOM 1313 C ILE A 93 13.066 -1.916 -5.199 1.00 0.00 C ATOM 1314 O ILE A 93 13.637 -2.250 -4.162 1.00 0.00 O ATOM 1315 CB ILE A 93 10.584 -2.493 -4.694 1.00 0.00 C ATOM 1316 CG1 ILE A 93 10.455 -3.745 -5.592 1.00 0.00 C ATOM 1317 CG2 ILE A 93 9.196 -1.835 -4.572 1.00 0.00 C ATOM 1318 CD1 ILE A 93 11.616 -4.745 -5.522 1.00 0.00 C ATOM 0 H ILE A 93 10.559 -1.235 -6.976 1.00 0.00 H new ATOM 0 HA ILE A 93 11.621 -0.675 -4.344 1.00 0.00 H new ATOM 0 HB ILE A 93 10.973 -2.866 -3.746 1.00 0.00 H new ATOM 0 HG12 ILE A 93 9.536 -4.266 -5.325 1.00 0.00 H new ATOM 0 HG13 ILE A 93 10.346 -3.417 -6.626 1.00 0.00 H new ATOM 0 HG21 ILE A 93 8.466 -2.581 -4.258 1.00 0.00 H new ATOM 0 HG22 ILE A 93 9.237 -1.034 -3.834 1.00 0.00 H new ATOM 0 HG23 ILE A 93 8.902 -1.424 -5.538 1.00 0.00 H new ATOM 0 HD11 ILE A 93 11.417 -5.581 -6.192 1.00 0.00 H new ATOM 0 HD12 ILE A 93 12.540 -4.251 -5.823 1.00 0.00 H new ATOM 0 HD13 ILE A 93 11.717 -5.114 -4.501 1.00 0.00 H new ATOM 1330 N GLU A 94 13.688 -1.928 -6.383 1.00 0.00 N ATOM 1331 CA GLU A 94 15.128 -2.148 -6.562 1.00 0.00 C ATOM 1332 C GLU A 94 15.932 -0.860 -6.297 1.00 0.00 C ATOM 1333 O GLU A 94 16.951 -0.895 -5.601 1.00 0.00 O ATOM 1334 CB GLU A 94 15.380 -2.679 -7.985 1.00 0.00 C ATOM 1335 CG GLU A 94 16.851 -3.015 -8.250 1.00 0.00 C ATOM 1336 CD GLU A 94 17.026 -3.631 -9.646 1.00 0.00 C ATOM 1337 OE1 GLU A 94 17.167 -2.873 -10.635 1.00 0.00 O ATOM 1338 OE2 GLU A 94 17.034 -4.880 -9.765 1.00 0.00 O ATOM 0 H GLU A 94 13.194 -1.782 -7.263 1.00 0.00 H new ATOM 0 HA GLU A 94 15.469 -2.886 -5.836 1.00 0.00 H new ATOM 0 HB2 GLU A 94 14.775 -3.571 -8.146 1.00 0.00 H new ATOM 0 HB3 GLU A 94 15.048 -1.934 -8.708 1.00 0.00 H new ATOM 0 HG2 GLU A 94 17.456 -2.112 -8.168 1.00 0.00 H new ATOM 0 HG3 GLU A 94 17.212 -3.711 -7.493 1.00 0.00 H new ATOM 1345 N LYS A 95 15.487 0.283 -6.839 1.00 0.00 N ATOM 1346 CA LYS A 95 16.199 1.568 -6.743 1.00 0.00 C ATOM 1347 C LYS A 95 16.049 2.250 -5.369 1.00 0.00 C ATOM 1348 O LYS A 95 17.026 2.784 -4.835 1.00 0.00 O ATOM 1349 CB LYS A 95 15.713 2.483 -7.882 1.00 0.00 C ATOM 1350 CG LYS A 95 16.182 1.981 -9.258 1.00 0.00 C ATOM 1351 CD LYS A 95 15.594 2.836 -10.390 1.00 0.00 C ATOM 1352 CE LYS A 95 15.940 2.286 -11.783 1.00 0.00 C ATOM 1353 NZ LYS A 95 17.391 2.387 -12.106 1.00 0.00 N ATOM 0 H LYS A 95 14.613 0.343 -7.362 1.00 0.00 H new ATOM 0 HA LYS A 95 17.266 1.373 -6.846 1.00 0.00 H new ATOM 0 HB2 LYS A 95 14.624 2.536 -7.866 1.00 0.00 H new ATOM 0 HB3 LYS A 95 16.084 3.495 -7.719 1.00 0.00 H new ATOM 0 HG2 LYS A 95 17.271 2.008 -9.306 1.00 0.00 H new ATOM 0 HG3 LYS A 95 15.882 0.941 -9.390 1.00 0.00 H new ATOM 0 HD2 LYS A 95 14.511 2.883 -10.280 1.00 0.00 H new ATOM 0 HD3 LYS A 95 15.968 3.856 -10.302 1.00 0.00 H new ATOM 0 HE2 LYS A 95 15.632 1.242 -11.842 1.00 0.00 H new ATOM 0 HE3 LYS A 95 15.368 2.830 -12.535 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 17.563 2.001 -13.056 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 17.684 3.385 -12.079 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 17.940 1.846 -11.408 1.00 0.00 H new ATOM 1367 N ASN A 96 14.849 2.229 -4.777 1.00 0.00 N ATOM 1368 CA ASN A 96 14.587 2.725 -3.417 1.00 0.00 C ATOM 1369 C ASN A 96 15.003 1.686 -2.340 1.00 0.00 C ATOM 1370 O ASN A 96 15.036 0.487 -2.639 1.00 0.00 O ATOM 1371 CB ASN A 96 13.096 3.111 -3.299 1.00 0.00 C ATOM 1372 CG ASN A 96 12.702 4.263 -4.227 1.00 0.00 C ATOM 1373 OD1 ASN A 96 11.936 4.102 -5.168 1.00 0.00 O ATOM 1374 ND2 ASN A 96 13.211 5.462 -3.991 1.00 0.00 N ATOM 0 H ASN A 96 14.016 1.860 -5.237 1.00 0.00 H new ATOM 0 HA ASN A 96 15.195 3.611 -3.236 1.00 0.00 H new ATOM 0 HB2 ASN A 96 12.482 2.240 -3.528 1.00 0.00 H new ATOM 0 HB3 ASN A 96 12.879 3.391 -2.268 1.00 0.00 H new ATOM 0 HD21 ASN A 96 12.965 6.248 -4.592 1.00 0.00 H new ATOM 0 HD22 ASN A 96 13.850 5.600 -3.208 1.00 0.00 H new ATOM 1381 N PRO A 97 15.288 2.110 -1.086 1.00 0.00 N ATOM 1382 CA PRO A 97 15.664 1.205 0.008 1.00 0.00 C ATOM 1383 C PRO A 97 14.495 0.354 0.535 1.00 0.00 C ATOM 1384 O PRO A 97 14.730 -0.637 1.225 1.00 0.00 O ATOM 1385 CB PRO A 97 16.238 2.113 1.102 1.00 0.00 C ATOM 1386 CG PRO A 97 15.501 3.433 0.890 1.00 0.00 C ATOM 1387 CD PRO A 97 15.367 3.496 -0.631 1.00 0.00 C ATOM 0 HA PRO A 97 16.386 0.467 -0.342 1.00 0.00 H new ATOM 0 HB2 PRO A 97 16.057 1.707 2.097 1.00 0.00 H new ATOM 0 HB3 PRO A 97 17.316 2.234 0.999 1.00 0.00 H new ATOM 0 HG2 PRO A 97 14.529 3.439 1.384 1.00 0.00 H new ATOM 0 HG3 PRO A 97 16.064 4.280 1.283 1.00 0.00 H new ATOM 0 HD2 PRO A 97 14.476 4.053 -0.921 1.00 0.00 H new ATOM 0 HD3 PRO A 97 16.221 4.005 -1.077 1.00 0.00 H new ATOM 1395 N LYS A 98 13.241 0.701 0.207 1.00 0.00 N ATOM 1396 CA LYS A 98 12.045 -0.091 0.531 1.00 0.00 C ATOM 1397 C LYS A 98 12.131 -1.534 -0.024 1.00 0.00 C ATOM 1398 O LYS A 98 12.170 -1.740 -1.237 1.00 0.00 O ATOM 1399 CB LYS A 98 10.817 0.691 0.012 1.00 0.00 C ATOM 1400 CG LYS A 98 9.469 -0.051 0.123 1.00 0.00 C ATOM 1401 CD LYS A 98 8.984 -0.555 -1.248 1.00 0.00 C ATOM 1402 CE LYS A 98 7.586 -1.198 -1.207 1.00 0.00 C ATOM 1403 NZ LYS A 98 7.604 -2.642 -0.822 1.00 0.00 N ATOM 0 H LYS A 98 13.026 1.558 -0.302 1.00 0.00 H new ATOM 0 HA LYS A 98 11.957 -0.224 1.609 1.00 0.00 H new ATOM 0 HB2 LYS A 98 10.744 1.628 0.564 1.00 0.00 H new ATOM 0 HB3 LYS A 98 10.986 0.949 -1.033 1.00 0.00 H new ATOM 0 HG2 LYS A 98 9.573 -0.895 0.805 1.00 0.00 H new ATOM 0 HG3 LYS A 98 8.721 0.615 0.552 1.00 0.00 H new ATOM 0 HD2 LYS A 98 8.971 0.280 -1.949 1.00 0.00 H new ATOM 0 HD3 LYS A 98 9.699 -1.283 -1.632 1.00 0.00 H new ATOM 0 HE2 LYS A 98 6.963 -0.650 -0.500 1.00 0.00 H new ATOM 0 HE3 LYS A 98 7.120 -1.097 -2.187 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 6.785 -2.850 -0.216 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 7.559 -3.230 -1.678 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 8.481 -2.852 -0.303 1.00 0.00 H new ATOM 1417 N GLN A 99 12.096 -2.535 0.862 1.00 0.00 N ATOM 1418 CA GLN A 99 12.046 -3.964 0.506 1.00 0.00 C ATOM 1419 C GLN A 99 10.603 -4.424 0.198 1.00 0.00 C ATOM 1420 O GLN A 99 9.657 -3.788 0.672 1.00 0.00 O ATOM 1421 CB GLN A 99 12.671 -4.801 1.645 1.00 0.00 C ATOM 1422 CG GLN A 99 11.853 -4.819 2.954 1.00 0.00 C ATOM 1423 CD GLN A 99 12.463 -5.694 4.056 1.00 0.00 C ATOM 1424 OE1 GLN A 99 13.602 -6.150 3.999 1.00 0.00 O ATOM 1425 NE2 GLN A 99 11.727 -5.958 5.114 1.00 0.00 N ATOM 0 H GLN A 99 12.102 -2.375 1.869 1.00 0.00 H new ATOM 0 HA GLN A 99 12.625 -4.117 -0.405 1.00 0.00 H new ATOM 0 HB2 GLN A 99 12.797 -5.826 1.297 1.00 0.00 H new ATOM 0 HB3 GLN A 99 13.666 -4.412 1.860 1.00 0.00 H new ATOM 0 HG2 GLN A 99 11.757 -3.799 3.325 1.00 0.00 H new ATOM 0 HG3 GLN A 99 10.846 -5.175 2.737 1.00 0.00 H new ATOM 0 HE21 GLN A 99 10.779 -5.589 5.181 1.00 0.00 H new ATOM 0 HE22 GLN A 99 12.105 -6.532 5.868 1.00 0.00 H new ATOM 1434 N PRO A 100 10.399 -5.534 -0.540 1.00 0.00 N ATOM 1435 CA PRO A 100 9.125 -6.251 -0.580 1.00 0.00 C ATOM 1436 C PRO A 100 8.940 -7.110 0.679 1.00 0.00 C ATOM 1437 O PRO A 100 9.907 -7.524 1.318 1.00 0.00 O ATOM 1438 CB PRO A 100 9.189 -7.099 -1.854 1.00 0.00 C ATOM 1439 CG PRO A 100 10.675 -7.444 -1.959 1.00 0.00 C ATOM 1440 CD PRO A 100 11.376 -6.206 -1.392 1.00 0.00 C ATOM 0 HA PRO A 100 8.268 -5.578 -0.597 1.00 0.00 H new ATOM 0 HB2 PRO A 100 8.571 -7.993 -1.776 1.00 0.00 H new ATOM 0 HB3 PRO A 100 8.840 -6.546 -2.726 1.00 0.00 H new ATOM 0 HG2 PRO A 100 10.920 -8.339 -1.388 1.00 0.00 H new ATOM 0 HG3 PRO A 100 10.970 -7.634 -2.991 1.00 0.00 H new ATOM 0 HD2 PRO A 100 12.261 -6.488 -0.821 1.00 0.00 H new ATOM 0 HD3 PRO A 100 11.710 -5.548 -2.194 1.00 0.00 H new ATOM 1448 N GLN A 101 7.672 -7.385 1.003 1.00 0.00 N ATOM 1449 CA GLN A 101 7.235 -8.201 2.146 1.00 0.00 C ATOM 1450 C GLN A 101 5.726 -8.491 2.099 1.00 0.00 C ATOM 1451 O GLN A 101 5.333 -9.644 2.272 1.00 0.00 O ATOM 1452 CB GLN A 101 7.671 -7.584 3.497 1.00 0.00 C ATOM 1453 CG GLN A 101 7.309 -6.101 3.719 1.00 0.00 C ATOM 1454 CD GLN A 101 7.916 -5.565 5.020 1.00 0.00 C ATOM 1455 OE1 GLN A 101 9.017 -5.024 5.050 1.00 0.00 O ATOM 1456 NE2 GLN A 101 7.260 -5.727 6.152 1.00 0.00 N ATOM 0 H GLN A 101 6.888 -7.031 0.455 1.00 0.00 H new ATOM 0 HA GLN A 101 7.742 -9.163 2.064 1.00 0.00 H new ATOM 0 HB2 GLN A 101 7.224 -8.169 4.301 1.00 0.00 H new ATOM 0 HB3 GLN A 101 8.752 -7.690 3.589 1.00 0.00 H new ATOM 0 HG2 GLN A 101 7.667 -5.508 2.877 1.00 0.00 H new ATOM 0 HG3 GLN A 101 6.225 -5.990 3.749 1.00 0.00 H new ATOM 0 HE21 GLN A 101 6.343 -6.174 6.151 1.00 0.00 H new ATOM 0 HE22 GLN A 101 7.669 -5.405 7.029 1.00 0.00 H new ATOM 1465 N TYR A 102 4.876 -7.488 1.815 1.00 0.00 N ATOM 1466 CA TYR A 102 3.407 -7.686 1.775 1.00 0.00 C ATOM 1467 C TYR A 102 2.830 -8.010 0.389 1.00 0.00 C ATOM 1468 O TYR A 102 1.643 -8.307 0.256 1.00 0.00 O ATOM 1469 CB TYR A 102 2.713 -6.470 2.418 1.00 0.00 C ATOM 1470 CG TYR A 102 2.200 -5.405 1.462 1.00 0.00 C ATOM 1471 CD1 TYR A 102 3.093 -4.554 0.782 1.00 0.00 C ATOM 1472 CD2 TYR A 102 0.817 -5.286 1.238 1.00 0.00 C ATOM 1473 CE1 TYR A 102 2.603 -3.598 -0.130 1.00 0.00 C ATOM 1474 CE2 TYR A 102 0.319 -4.335 0.330 1.00 0.00 C ATOM 1475 CZ TYR A 102 1.213 -3.490 -0.363 1.00 0.00 C ATOM 1476 OH TYR A 102 0.726 -2.561 -1.229 1.00 0.00 O ATOM 0 H TYR A 102 5.175 -6.534 1.610 1.00 0.00 H new ATOM 0 HA TYR A 102 3.199 -8.586 2.354 1.00 0.00 H new ATOM 0 HB2 TYR A 102 1.873 -6.830 3.012 1.00 0.00 H new ATOM 0 HB3 TYR A 102 3.414 -6.001 3.108 1.00 0.00 H new ATOM 0 HD1 TYR A 102 4.155 -4.634 0.960 1.00 0.00 H new ATOM 0 HD2 TYR A 102 0.131 -5.931 1.768 1.00 0.00 H new ATOM 0 HE1 TYR A 102 3.290 -2.948 -0.651 1.00 0.00 H new ATOM 0 HE2 TYR A 102 -0.745 -4.251 0.163 1.00 0.00 H new ATOM 0 HH TYR A 102 -0.251 -2.630 -1.267 1.00 0.00 H new ATOM 1486 N ILE A 103 3.665 -7.942 -0.649 1.00 0.00 N ATOM 1487 CA ILE A 103 3.314 -8.172 -2.053 1.00 0.00 C ATOM 1488 C ILE A 103 4.137 -9.342 -2.621 1.00 0.00 C ATOM 1489 O ILE A 103 5.367 -9.303 -2.636 1.00 0.00 O ATOM 1490 CB ILE A 103 3.484 -6.851 -2.854 1.00 0.00 C ATOM 1491 CG1 ILE A 103 3.176 -7.107 -4.345 1.00 0.00 C ATOM 1492 CG2 ILE A 103 4.853 -6.155 -2.684 1.00 0.00 C ATOM 1493 CD1 ILE A 103 3.006 -5.837 -5.190 1.00 0.00 C ATOM 0 H ILE A 103 4.652 -7.714 -0.529 1.00 0.00 H new ATOM 0 HA ILE A 103 2.268 -8.464 -2.140 1.00 0.00 H new ATOM 0 HB ILE A 103 2.766 -6.148 -2.431 1.00 0.00 H new ATOM 0 HG12 ILE A 103 3.981 -7.706 -4.771 1.00 0.00 H new ATOM 0 HG13 ILE A 103 2.265 -7.700 -4.417 1.00 0.00 H new ATOM 0 HG21 ILE A 103 4.874 -5.243 -3.281 1.00 0.00 H new ATOM 0 HG22 ILE A 103 5.006 -5.905 -1.634 1.00 0.00 H new ATOM 0 HG23 ILE A 103 5.646 -6.825 -3.017 1.00 0.00 H new ATOM 0 HD11 ILE A 103 2.792 -6.113 -6.223 1.00 0.00 H new ATOM 0 HD12 ILE A 103 2.181 -5.245 -4.795 1.00 0.00 H new ATOM 0 HD13 ILE A 103 3.924 -5.250 -5.154 1.00 0.00 H new ATOM 1505 N ILE A 104 3.452 -10.380 -3.109 1.00 0.00 N ATOM 1506 CA ILE A 104 4.048 -11.507 -3.860 1.00 0.00 C ATOM 1507 C ILE A 104 3.504 -11.520 -5.296 1.00 0.00 C ATOM 1508 O ILE A 104 2.357 -11.877 -5.537 1.00 0.00 O ATOM 1509 CB ILE A 104 3.775 -12.861 -3.157 1.00 0.00 C ATOM 1510 CG1 ILE A 104 4.122 -12.818 -1.647 1.00 0.00 C ATOM 1511 CG2 ILE A 104 4.562 -13.983 -3.869 1.00 0.00 C ATOM 1512 CD1 ILE A 104 3.814 -14.116 -0.889 1.00 0.00 C ATOM 0 H ILE A 104 2.442 -10.469 -2.994 1.00 0.00 H new ATOM 0 HA ILE A 104 5.129 -11.368 -3.890 1.00 0.00 H new ATOM 0 HB ILE A 104 2.707 -13.066 -3.227 1.00 0.00 H new ATOM 0 HG12 ILE A 104 5.182 -12.590 -1.537 1.00 0.00 H new ATOM 0 HG13 ILE A 104 3.570 -12.001 -1.183 1.00 0.00 H new ATOM 0 HG21 ILE A 104 4.369 -14.934 -3.373 1.00 0.00 H new ATOM 0 HG22 ILE A 104 4.245 -14.046 -4.910 1.00 0.00 H new ATOM 0 HG23 ILE A 104 5.629 -13.762 -3.827 1.00 0.00 H new ATOM 0 HD11 ILE A 104 4.087 -13.998 0.160 1.00 0.00 H new ATOM 0 HD12 ILE A 104 2.749 -14.337 -0.964 1.00 0.00 H new ATOM 0 HD13 ILE A 104 4.387 -14.936 -1.323 1.00 0.00 H new ATOM 1524 N SER A 105 4.316 -11.145 -6.276 1.00 0.00 N ATOM 1525 CA SER A 105 3.923 -11.120 -7.695 1.00 0.00 C ATOM 1526 C SER A 105 4.078 -12.512 -8.346 1.00 0.00 C ATOM 1527 O SER A 105 5.192 -12.897 -8.711 1.00 0.00 O ATOM 1528 CB SER A 105 4.729 -10.040 -8.439 1.00 0.00 C ATOM 1529 OG SER A 105 4.644 -8.781 -7.767 1.00 0.00 O ATOM 0 H SER A 105 5.278 -10.845 -6.115 1.00 0.00 H new ATOM 0 HA SER A 105 2.866 -10.863 -7.765 1.00 0.00 H new ATOM 0 HB2 SER A 105 5.772 -10.347 -8.513 1.00 0.00 H new ATOM 0 HB3 SER A 105 4.354 -9.938 -9.457 1.00 0.00 H new ATOM 0 HG SER A 105 3.878 -8.277 -8.112 1.00 0.00 H new ATOM 1535 N VAL A 106 2.984 -13.281 -8.504 1.00 0.00 N ATOM 1536 CA VAL A 106 3.003 -14.626 -9.114 1.00 0.00 C ATOM 1537 C VAL A 106 2.627 -14.496 -10.594 1.00 0.00 C ATOM 1538 O VAL A 106 1.449 -14.382 -10.937 1.00 0.00 O ATOM 1539 CB VAL A 106 2.072 -15.620 -8.371 1.00 0.00 C ATOM 1540 CG1 VAL A 106 2.214 -17.040 -8.948 1.00 0.00 C ATOM 1541 CG2 VAL A 106 2.381 -15.670 -6.864 1.00 0.00 C ATOM 0 H VAL A 106 2.054 -12.984 -8.210 1.00 0.00 H new ATOM 0 HA VAL A 106 4.007 -15.041 -9.028 1.00 0.00 H new ATOM 0 HB VAL A 106 1.053 -15.261 -8.514 1.00 0.00 H new ATOM 0 HG11 VAL A 106 1.552 -17.719 -8.411 1.00 0.00 H new ATOM 0 HG12 VAL A 106 1.946 -17.032 -10.005 1.00 0.00 H new ATOM 0 HG13 VAL A 106 3.245 -17.376 -8.838 1.00 0.00 H new ATOM 0 HG21 VAL A 106 1.709 -16.377 -6.378 1.00 0.00 H new ATOM 0 HG22 VAL A 106 3.413 -15.989 -6.714 1.00 0.00 H new ATOM 0 HG23 VAL A 106 2.241 -14.680 -6.431 1.00 0.00 H new ATOM 1551 N ARG A 107 3.638 -14.481 -11.472 1.00 0.00 N ATOM 1552 CA ARG A 107 3.487 -14.179 -12.904 1.00 0.00 C ATOM 1553 C ARG A 107 2.452 -15.092 -13.587 1.00 0.00 C ATOM 1554 O ARG A 107 2.520 -16.317 -13.487 1.00 0.00 O ATOM 1555 CB ARG A 107 4.865 -14.245 -13.587 1.00 0.00 C ATOM 1556 CG ARG A 107 4.822 -13.732 -15.036 1.00 0.00 C ATOM 1557 CD ARG A 107 6.219 -13.734 -15.671 1.00 0.00 C ATOM 1558 NE ARG A 107 6.176 -13.229 -17.056 1.00 0.00 N ATOM 1559 CZ ARG A 107 5.907 -13.923 -18.158 1.00 0.00 C ATOM 1560 NH1 ARG A 107 5.630 -15.212 -18.131 1.00 0.00 N ATOM 1561 NH2 ARG A 107 5.913 -13.316 -19.325 1.00 0.00 N ATOM 0 H ARG A 107 4.601 -14.682 -11.204 1.00 0.00 H new ATOM 0 HA ARG A 107 3.095 -13.167 -13.008 1.00 0.00 H new ATOM 0 HB2 ARG A 107 5.580 -13.654 -13.015 1.00 0.00 H new ATOM 0 HB3 ARG A 107 5.224 -15.274 -13.579 1.00 0.00 H new ATOM 0 HG2 ARG A 107 4.152 -14.357 -15.625 1.00 0.00 H new ATOM 0 HG3 ARG A 107 4.414 -12.722 -15.054 1.00 0.00 H new ATOM 0 HD2 ARG A 107 6.892 -13.116 -15.077 1.00 0.00 H new ATOM 0 HD3 ARG A 107 6.624 -14.746 -15.663 1.00 0.00 H new ATOM 0 HE ARG A 107 6.375 -12.237 -17.183 1.00 0.00 H new ATOM 0 HH11 ARG A 107 5.617 -15.712 -17.242 1.00 0.00 H new ATOM 0 HH12 ARG A 107 5.429 -15.709 -18.999 1.00 0.00 H new ATOM 0 HH21 ARG A 107 6.123 -12.319 -19.380 1.00 0.00 H new ATOM 0 HH22 ARG A 107 5.708 -13.842 -20.174 1.00 0.00 H new ATOM 1575 N GLY A 108 1.468 -14.474 -14.249 1.00 0.00 N ATOM 1576 CA GLY A 108 0.351 -15.130 -14.955 1.00 0.00 C ATOM 1577 C GLY A 108 -0.897 -15.353 -14.095 1.00 0.00 C ATOM 1578 O GLY A 108 -2.008 -15.293 -14.619 1.00 0.00 O ATOM 0 H GLY A 108 1.422 -13.457 -14.313 1.00 0.00 H new ATOM 0 HA2 GLY A 108 0.078 -14.525 -15.820 1.00 0.00 H new ATOM 0 HA3 GLY A 108 0.693 -16.093 -15.335 1.00 0.00 H new ATOM 1582 N ILE A 109 -0.740 -15.578 -12.785 1.00 0.00 N ATOM 1583 CA ILE A 109 -1.851 -15.781 -11.828 1.00 0.00 C ATOM 1584 C ILE A 109 -2.364 -14.419 -11.332 1.00 0.00 C ATOM 1585 O ILE A 109 -3.563 -14.139 -11.397 1.00 0.00 O ATOM 1586 CB ILE A 109 -1.391 -16.704 -10.663 1.00 0.00 C ATOM 1587 CG1 ILE A 109 -1.305 -18.200 -11.057 1.00 0.00 C ATOM 1588 CG2 ILE A 109 -2.335 -16.620 -9.447 1.00 0.00 C ATOM 1589 CD1 ILE A 109 -0.278 -18.557 -12.138 1.00 0.00 C ATOM 0 H ILE A 109 0.179 -15.626 -12.345 1.00 0.00 H new ATOM 0 HA ILE A 109 -2.682 -16.282 -12.324 1.00 0.00 H new ATOM 0 HB ILE A 109 -0.397 -16.333 -10.413 1.00 0.00 H new ATOM 0 HG12 ILE A 109 -1.075 -18.777 -10.162 1.00 0.00 H new ATOM 0 HG13 ILE A 109 -2.289 -18.521 -11.399 1.00 0.00 H new ATOM 0 HG21 ILE A 109 -1.974 -17.281 -8.659 1.00 0.00 H new ATOM 0 HG22 ILE A 109 -2.361 -15.595 -9.077 1.00 0.00 H new ATOM 0 HG23 ILE A 109 -3.339 -16.924 -9.744 1.00 0.00 H new ATOM 0 HD11 ILE A 109 -0.309 -19.630 -12.329 1.00 0.00 H new ATOM 0 HD12 ILE A 109 -0.513 -18.018 -13.056 1.00 0.00 H new ATOM 0 HD13 ILE A 109 0.719 -18.278 -11.799 1.00 0.00 H new ATOM 1601 N GLY A 110 -1.445 -13.573 -10.857 1.00 0.00 N ATOM 1602 CA GLY A 110 -1.706 -12.268 -10.245 1.00 0.00 C ATOM 1603 C GLY A 110 -0.774 -11.990 -9.071 1.00 0.00 C ATOM 1604 O GLY A 110 0.099 -12.794 -8.740 1.00 0.00 O ATOM 0 H GLY A 110 -0.449 -13.791 -10.891 1.00 0.00 H new ATOM 0 HA2 GLY A 110 -1.587 -11.486 -10.995 1.00 0.00 H new ATOM 0 HA3 GLY A 110 -2.740 -12.228 -9.904 1.00 0.00 H new ATOM 1608 N TYR A 111 -0.918 -10.820 -8.450 1.00 0.00 N ATOM 1609 CA TYR A 111 -0.059 -10.431 -7.322 1.00 0.00 C ATOM 1610 C TYR A 111 -0.825 -10.632 -6.005 1.00 0.00 C ATOM 1611 O TYR A 111 -1.836 -9.976 -5.778 1.00 0.00 O ATOM 1612 CB TYR A 111 0.510 -8.993 -7.451 1.00 0.00 C ATOM 1613 CG TYR A 111 0.605 -8.287 -8.805 1.00 0.00 C ATOM 1614 CD1 TYR A 111 0.705 -8.963 -10.041 1.00 0.00 C ATOM 1615 CD2 TYR A 111 0.544 -6.879 -8.807 1.00 0.00 C ATOM 1616 CE1 TYR A 111 0.560 -8.254 -11.251 1.00 0.00 C ATOM 1617 CE2 TYR A 111 0.417 -6.161 -10.008 1.00 0.00 C ATOM 1618 CZ TYR A 111 0.386 -6.855 -11.235 1.00 0.00 C ATOM 1619 OH TYR A 111 0.190 -6.178 -12.399 1.00 0.00 O ATOM 0 H TYR A 111 -1.618 -10.124 -8.705 1.00 0.00 H new ATOM 0 HA TYR A 111 0.816 -11.080 -7.330 1.00 0.00 H new ATOM 0 HB2 TYR A 111 -0.092 -8.355 -6.803 1.00 0.00 H new ATOM 0 HB3 TYR A 111 1.517 -9.012 -7.033 1.00 0.00 H new ATOM 0 HD1 TYR A 111 0.893 -10.026 -10.059 1.00 0.00 H new ATOM 0 HD2 TYR A 111 0.596 -6.343 -7.871 1.00 0.00 H new ATOM 0 HE1 TYR A 111 0.582 -8.784 -12.192 1.00 0.00 H new ATOM 0 HE2 TYR A 111 0.344 -5.084 -9.991 1.00 0.00 H new ATOM 0 HH TYR A 111 0.087 -5.222 -12.208 1.00 0.00 H new ATOM 1629 N LYS A 112 -0.374 -11.521 -5.116 1.00 0.00 N ATOM 1630 CA LYS A 112 -0.990 -11.675 -3.795 1.00 0.00 C ATOM 1631 C LYS A 112 -0.549 -10.528 -2.884 1.00 0.00 C ATOM 1632 O LYS A 112 0.635 -10.397 -2.561 1.00 0.00 O ATOM 1633 CB LYS A 112 -0.650 -13.042 -3.183 1.00 0.00 C ATOM 1634 CG LYS A 112 -1.611 -13.428 -2.037 1.00 0.00 C ATOM 1635 CD LYS A 112 -0.908 -13.864 -0.739 1.00 0.00 C ATOM 1636 CE LYS A 112 -0.348 -12.668 0.053 1.00 0.00 C ATOM 1637 NZ LYS A 112 0.183 -13.090 1.381 1.00 0.00 N ATOM 0 H LYS A 112 0.415 -12.145 -5.287 1.00 0.00 H new ATOM 0 HA LYS A 112 -2.074 -11.634 -3.903 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -0.690 -13.805 -3.960 1.00 0.00 H new ATOM 0 HB3 LYS A 112 0.373 -13.024 -2.806 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -2.257 -12.578 -1.818 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -2.256 -14.239 -2.377 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -1.612 -14.413 -0.114 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -0.095 -14.549 -0.981 1.00 0.00 H new ATOM 0 HE2 LYS A 112 0.445 -12.190 -0.521 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -1.133 -11.924 0.194 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 0.235 -12.265 2.012 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -0.449 -13.804 1.796 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 1.133 -13.495 1.262 1.00 0.00 H new ATOM 1651 N LEU A 113 -1.500 -9.703 -2.467 1.00 0.00 N ATOM 1652 CA LEU A 113 -1.318 -8.647 -1.470 1.00 0.00 C ATOM 1653 C LEU A 113 -2.164 -8.962 -0.227 1.00 0.00 C ATOM 1654 O LEU A 113 -2.962 -9.900 -0.218 1.00 0.00 O ATOM 1655 CB LEU A 113 -1.654 -7.264 -2.081 1.00 0.00 C ATOM 1656 CG LEU A 113 -0.539 -6.655 -2.963 1.00 0.00 C ATOM 1657 CD1 LEU A 113 -0.478 -7.295 -4.355 1.00 0.00 C ATOM 1658 CD2 LEU A 113 -0.720 -5.143 -3.164 1.00 0.00 C ATOM 0 H LEU A 113 -2.454 -9.749 -2.824 1.00 0.00 H new ATOM 0 HA LEU A 113 -0.274 -8.608 -1.158 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -2.560 -7.358 -2.679 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -1.877 -6.569 -1.271 1.00 0.00 H new ATOM 0 HG LEU A 113 0.385 -6.855 -2.421 1.00 0.00 H new ATOM 0 HD11 LEU A 113 0.321 -6.832 -4.934 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -0.282 -8.363 -4.256 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -1.429 -7.146 -4.866 1.00 0.00 H new ATOM 0 HD21 LEU A 113 0.086 -4.760 -3.790 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -1.677 -4.952 -3.649 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -0.698 -4.642 -2.196 1.00 0.00 H new ATOM 1670 N GLU A 114 -1.994 -8.163 0.820 1.00 0.00 N ATOM 1671 CA GLU A 114 -2.724 -8.275 2.089 1.00 0.00 C ATOM 1672 C GLU A 114 -2.956 -6.901 2.744 1.00 0.00 C ATOM 1673 O GLU A 114 -2.420 -5.891 2.283 1.00 0.00 O ATOM 1674 CB GLU A 114 -1.992 -9.270 3.007 1.00 0.00 C ATOM 1675 CG GLU A 114 -0.540 -8.898 3.341 1.00 0.00 C ATOM 1676 CD GLU A 114 0.185 -10.092 3.979 1.00 0.00 C ATOM 1677 OE1 GLU A 114 0.586 -11.019 3.233 1.00 0.00 O ATOM 1678 OE2 GLU A 114 0.350 -10.120 5.222 1.00 0.00 O ATOM 0 H GLU A 114 -1.325 -7.393 0.815 1.00 0.00 H new ATOM 0 HA GLU A 114 -3.723 -8.666 1.897 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -2.551 -9.361 3.938 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -2.000 -10.252 2.533 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -0.019 -8.590 2.434 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -0.523 -8.048 4.023 1.00 0.00 H new ATOM 1685 N TYR A 115 -3.792 -6.869 3.789 1.00 0.00 N ATOM 1686 CA TYR A 115 -4.219 -5.665 4.523 1.00 0.00 C ATOM 1687 C TYR A 115 -3.941 -5.752 6.041 1.00 0.00 C ATOM 1688 O TYR A 115 -3.815 -4.685 6.685 1.00 0.00 O ATOM 1689 CB TYR A 115 -5.705 -5.381 4.235 1.00 0.00 C ATOM 1690 CG TYR A 115 -6.694 -6.322 4.904 1.00 0.00 C ATOM 1691 CD1 TYR A 115 -6.911 -7.618 4.391 1.00 0.00 C ATOM 1692 CD2 TYR A 115 -7.400 -5.896 6.047 1.00 0.00 C ATOM 1693 CE1 TYR A 115 -7.810 -8.493 5.033 1.00 0.00 C ATOM 1694 CE2 TYR A 115 -8.310 -6.763 6.684 1.00 0.00 C ATOM 1695 CZ TYR A 115 -8.513 -8.066 6.184 1.00 0.00 C ATOM 1696 OH TYR A 115 -9.390 -8.898 6.811 1.00 0.00 O ATOM 1697 OXT TYR A 115 -3.819 -6.876 6.590 1.00 0.00 O ATOM 0 H TYR A 115 -4.210 -7.720 4.166 1.00 0.00 H new ATOM 0 HA TYR A 115 -3.619 -4.830 4.163 1.00 0.00 H new ATOM 0 HB2 TYR A 115 -5.930 -4.362 4.550 1.00 0.00 H new ATOM 0 HB3 TYR A 115 -5.862 -5.423 3.157 1.00 0.00 H new ATOM 0 HD1 TYR A 115 -6.387 -7.941 3.504 1.00 0.00 H new ATOM 0 HD2 TYR A 115 -7.243 -4.901 6.436 1.00 0.00 H new ATOM 0 HE1 TYR A 115 -7.962 -9.490 4.646 1.00 0.00 H new ATOM 0 HE2 TYR A 115 -8.853 -6.429 7.556 1.00 0.00 H new ATOM 0 HH TYR A 115 -9.781 -8.439 7.584 1.00 0.00 H new TER 1707 TYR A 115