USER MOD reduce.3.24.130724 H: found=0, std=0, add=938, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 940 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 64 THR OG1 : rot -160:sc= -1.02 USER MOD Set 1.2: A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 101 LYS NZ :NH3+ -111:sc= -0.17 (180deg=-0.147) USER MOD Set 2.2: A 105 HIS : no HD1:sc= -0.198 K(o=-0.37,f=0.53) USER MOD Set 3.1: A 95 HIS : no HD1:sc= 0.0019 X(o=0.0041,f=-0.12) USER MOD Set 3.2: A 99 THR OG1 : rot 83:sc= 0.00216 USER MOD Set 4.1: A 56 LYS NZ :NH3+ -132:sc= -0.0553 (180deg=0.0108) USER MOD Set 4.2: A 62 TYR OH : rot 39:sc= 0.684 USER MOD Single : A 8 ASN : amide:sc= -0.1 X(o=-0.1,f=-0.1) USER MOD Single : A 9 THR OG1 : rot 180:sc= 0.021 USER MOD Single : A 21 THR OG1 : rot -90:sc= -0.378 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0351) USER MOD Single : A 31 ASN : amide:sc= -3.46! C(o=-3.5!,f=-5.5!) USER MOD Single : A 34 SER OG : rot -92:sc= 1.25 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot -129:sc= -3.58! USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 45 LYS NZ :NH3+ 149:sc= -0.495 (180deg=-1.6!) USER MOD Single : A 48 MET CE :methyl 158:sc= -0.746 (180deg=-1.97) USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 THR OG1 : rot 74:sc= 0.0665 USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 HIS : no HD1:sc= 0 X(o=0,f=-0.015) USER MOD Single : A 61 ASN : amide:sc= -0.833 X(o=-0.83,f=-0.8) USER MOD Single : A 66 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.049) USER MOD Single : A 70 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.0749) USER MOD Single : A 76 CYS SG : rot 180:sc= -2.61 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 78 ASN : amide:sc= -1.03 K(o=-1,f=-10!) USER MOD Single : A 82 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 CYS SG : rot 83:sc= 0.00456 USER MOD Single : A 103 THR OG1 : rot 70:sc= 0.0982 USER MOD Single : A 117 ASN : amide:sc= -0.232 K(o=-0.23,f=-3!) USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 CYS SG : rot 2:sc= -0.358 USER MOD ----------------------------------------------------------------- ATOM 59 N GLY A 7 0.333 18.924 4.636 1.00 0.00 N ATOM 60 CA GLY A 7 1.390 18.169 5.284 1.00 0.00 C ATOM 61 C GLY A 7 0.862 17.230 6.349 1.00 0.00 C ATOM 62 O GLY A 7 1.052 16.017 6.266 1.00 0.00 O ATOM 0 HA2 GLY A 7 1.934 17.594 4.534 1.00 0.00 H new ATOM 0 HA3 GLY A 7 2.102 18.860 5.734 1.00 0.00 H new ATOM 66 N ASN A 8 0.197 17.791 7.355 1.00 0.00 N ATOM 67 CA ASN A 8 -0.358 16.994 8.443 1.00 0.00 C ATOM 68 C ASN A 8 -1.335 15.951 7.909 1.00 0.00 C ATOM 69 O ASN A 8 -1.228 14.765 8.224 1.00 0.00 O ATOM 70 CB ASN A 8 -1.063 17.899 9.456 1.00 0.00 C ATOM 71 CG ASN A 8 -0.181 19.040 9.925 1.00 0.00 C ATOM 72 OD1 ASN A 8 0.933 18.822 10.401 1.00 0.00 O ATOM 73 ND2 ASN A 8 -0.677 20.264 9.791 1.00 0.00 N ATOM 0 H ASN A 8 0.030 18.794 7.439 1.00 0.00 H new ATOM 0 HA ASN A 8 0.464 16.476 8.938 1.00 0.00 H new ATOM 0 HB2 ASN A 8 -1.969 18.305 9.007 1.00 0.00 H new ATOM 0 HB3 ASN A 8 -1.372 17.305 10.316 1.00 0.00 H new ATOM 0 HD21 ASN A 8 -0.129 21.072 10.088 1.00 0.00 H new ATOM 0 HD22 ASN A 8 -1.606 20.397 9.391 1.00 0.00 H new ATOM 80 N THR A 9 -2.288 16.400 7.099 1.00 0.00 N ATOM 81 CA THR A 9 -3.285 15.507 6.521 1.00 0.00 C ATOM 82 C THR A 9 -2.662 14.173 6.124 1.00 0.00 C ATOM 83 O THR A 9 -3.160 13.109 6.495 1.00 0.00 O ATOM 84 CB THR A 9 -3.955 16.136 5.286 1.00 0.00 C ATOM 85 OG1 THR A 9 -4.263 17.511 5.542 1.00 0.00 O ATOM 86 CG2 THR A 9 -5.227 15.386 4.920 1.00 0.00 C ATOM 0 H THR A 9 -2.391 17.378 6.828 1.00 0.00 H new ATOM 0 HA THR A 9 -4.041 15.339 7.288 1.00 0.00 H new ATOM 0 HB THR A 9 -3.259 16.070 4.450 1.00 0.00 H new ATOM 0 HG1 THR A 9 -4.687 17.904 4.751 1.00 0.00 H new ATOM 0 HG21 THR A 9 -5.683 15.848 4.045 1.00 0.00 H new ATOM 0 HG22 THR A 9 -4.985 14.347 4.697 1.00 0.00 H new ATOM 0 HG23 THR A 9 -5.925 15.425 5.756 1.00 0.00 H new ATOM 94 N LEU A 10 -1.572 14.236 5.368 1.00 0.00 N ATOM 95 CA LEU A 10 -0.880 13.032 4.920 1.00 0.00 C ATOM 96 C LEU A 10 -0.412 12.200 6.109 1.00 0.00 C ATOM 97 O LEU A 10 -0.775 11.031 6.243 1.00 0.00 O ATOM 98 CB LEU A 10 0.315 13.404 4.041 1.00 0.00 C ATOM 99 CG LEU A 10 0.028 13.550 2.546 1.00 0.00 C ATOM 100 CD1 LEU A 10 -0.317 12.201 1.934 1.00 0.00 C ATOM 101 CD2 LEU A 10 -1.098 14.547 2.314 1.00 0.00 C ATOM 0 H LEU A 10 -1.148 15.108 5.052 1.00 0.00 H new ATOM 0 HA LEU A 10 -1.581 12.436 4.336 1.00 0.00 H new ATOM 0 HB2 LEU A 10 0.729 14.344 4.405 1.00 0.00 H new ATOM 0 HB3 LEU A 10 1.086 12.645 4.170 1.00 0.00 H new ATOM 0 HG LEU A 10 0.927 13.927 2.058 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -0.518 12.325 0.870 1.00 0.00 H new ATOM 0 HD12 LEU A 10 0.520 11.516 2.068 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -1.201 11.794 2.425 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -1.289 14.638 1.245 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -2.001 14.199 2.815 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -0.812 15.519 2.716 1.00 0.00 H new ATOM 113 N ARG A 11 0.396 12.810 6.971 1.00 0.00 N ATOM 114 CA ARG A 11 0.913 12.125 8.149 1.00 0.00 C ATOM 115 C ARG A 11 -0.129 11.171 8.725 1.00 0.00 C ATOM 116 O ARG A 11 0.184 10.035 9.078 1.00 0.00 O ATOM 117 CB ARG A 11 1.333 13.141 9.213 1.00 0.00 C ATOM 118 CG ARG A 11 1.867 12.505 10.486 1.00 0.00 C ATOM 119 CD ARG A 11 0.754 12.250 11.490 1.00 0.00 C ATOM 120 NE ARG A 11 0.541 13.393 12.374 1.00 0.00 N ATOM 121 CZ ARG A 11 1.324 13.677 13.409 1.00 0.00 C ATOM 122 NH1 ARG A 11 2.366 12.906 13.688 1.00 0.00 N ATOM 123 NH2 ARG A 11 1.066 14.735 14.167 1.00 0.00 N ATOM 0 H ARG A 11 0.706 13.777 6.875 1.00 0.00 H new ATOM 0 HA ARG A 11 1.784 11.544 7.847 1.00 0.00 H new ATOM 0 HB2 ARG A 11 2.098 13.796 8.796 1.00 0.00 H new ATOM 0 HB3 ARG A 11 0.477 13.768 9.462 1.00 0.00 H new ATOM 0 HG2 ARG A 11 2.363 11.565 10.244 1.00 0.00 H new ATOM 0 HG3 ARG A 11 2.619 13.156 10.932 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -0.170 12.027 10.957 1.00 0.00 H new ATOM 0 HD3 ARG A 11 0.998 11.371 12.087 1.00 0.00 H new ATOM 0 HE ARG A 11 -0.252 14.007 12.187 1.00 0.00 H new ATOM 0 HH11 ARG A 11 2.568 12.092 13.107 1.00 0.00 H new ATOM 0 HH12 ARG A 11 2.965 13.127 14.483 1.00 0.00 H new ATOM 0 HH21 ARG A 11 0.266 15.331 13.955 1.00 0.00 H new ATOM 0 HH22 ARG A 11 1.668 14.952 14.961 1.00 0.00 H new ATOM 137 N GLU A 12 -1.368 11.642 8.817 1.00 0.00 N ATOM 138 CA GLU A 12 -2.456 10.831 9.352 1.00 0.00 C ATOM 139 C GLU A 12 -2.696 9.601 8.481 1.00 0.00 C ATOM 140 O GLU A 12 -2.662 8.468 8.964 1.00 0.00 O ATOM 141 CB GLU A 12 -3.739 11.659 9.449 1.00 0.00 C ATOM 142 CG GLU A 12 -3.799 12.546 10.681 1.00 0.00 C ATOM 143 CD GLU A 12 -5.131 13.256 10.824 1.00 0.00 C ATOM 144 OE1 GLU A 12 -5.292 14.342 10.229 1.00 0.00 O ATOM 145 OE2 GLU A 12 -6.013 12.725 11.531 1.00 0.00 O ATOM 0 H GLU A 12 -1.644 12.581 8.528 1.00 0.00 H new ATOM 0 HA GLU A 12 -2.171 10.499 10.350 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -3.828 12.282 8.559 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -4.596 10.986 9.454 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -3.617 11.941 11.569 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -3.000 13.286 10.630 1.00 0.00 H new ATOM 152 N LEU A 13 -2.938 9.832 7.196 1.00 0.00 N ATOM 153 CA LEU A 13 -3.185 8.743 6.256 1.00 0.00 C ATOM 154 C LEU A 13 -2.020 7.759 6.246 1.00 0.00 C ATOM 155 O LEU A 13 -2.212 6.553 6.404 1.00 0.00 O ATOM 156 CB LEU A 13 -3.410 9.299 4.849 1.00 0.00 C ATOM 157 CG LEU A 13 -3.540 8.264 3.731 1.00 0.00 C ATOM 158 CD1 LEU A 13 -4.848 7.499 3.863 1.00 0.00 C ATOM 159 CD2 LEU A 13 -3.448 8.935 2.369 1.00 0.00 C ATOM 0 H LEU A 13 -2.969 10.763 6.780 1.00 0.00 H new ATOM 0 HA LEU A 13 -4.082 8.213 6.578 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -4.314 9.907 4.861 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -2.582 9.964 4.606 1.00 0.00 H new ATOM 0 HG LEU A 13 -2.717 7.555 3.820 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -4.924 6.767 3.059 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -4.874 6.986 4.825 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -5.685 8.195 3.800 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -3.543 8.183 1.586 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -4.250 9.666 2.269 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -2.485 9.437 2.275 1.00 0.00 H new ATOM 171 N ARG A 14 -0.812 8.281 6.060 1.00 0.00 N ATOM 172 CA ARG A 14 0.384 7.448 6.031 1.00 0.00 C ATOM 173 C ARG A 14 0.327 6.375 7.114 1.00 0.00 C ATOM 174 O ARG A 14 0.414 5.181 6.826 1.00 0.00 O ATOM 175 CB ARG A 14 1.636 8.309 6.216 1.00 0.00 C ATOM 176 CG ARG A 14 2.933 7.564 5.942 1.00 0.00 C ATOM 177 CD ARG A 14 4.129 8.503 5.965 1.00 0.00 C ATOM 178 NE ARG A 14 4.625 8.725 7.320 1.00 0.00 N ATOM 179 CZ ARG A 14 5.785 9.313 7.591 1.00 0.00 C ATOM 180 NH1 ARG A 14 6.564 9.736 6.605 1.00 0.00 N ATOM 181 NH2 ARG A 14 6.168 9.478 8.851 1.00 0.00 N ATOM 0 H ARG A 14 -0.636 9.277 5.927 1.00 0.00 H new ATOM 0 HA ARG A 14 0.430 6.956 5.059 1.00 0.00 H new ATOM 0 HB2 ARG A 14 1.575 9.171 5.552 1.00 0.00 H new ATOM 0 HB3 ARG A 14 1.656 8.693 7.236 1.00 0.00 H new ATOM 0 HG2 ARG A 14 3.069 6.781 6.688 1.00 0.00 H new ATOM 0 HG3 ARG A 14 2.874 7.072 4.971 1.00 0.00 H new ATOM 0 HD2 ARG A 14 4.928 8.088 5.350 1.00 0.00 H new ATOM 0 HD3 ARG A 14 3.849 9.458 5.521 1.00 0.00 H new ATOM 0 HE ARG A 14 4.049 8.411 8.101 1.00 0.00 H new ATOM 0 HH11 ARG A 14 6.273 9.610 5.635 1.00 0.00 H new ATOM 0 HH12 ARG A 14 7.454 10.187 6.816 1.00 0.00 H new ATOM 0 HH21 ARG A 14 5.572 9.153 9.612 1.00 0.00 H new ATOM 0 HH22 ARG A 14 7.059 9.930 9.058 1.00 0.00 H new ATOM 195 N LEU A 15 0.181 6.809 8.362 1.00 0.00 N ATOM 196 CA LEU A 15 0.112 5.886 9.489 1.00 0.00 C ATOM 197 C LEU A 15 -1.151 5.033 9.419 1.00 0.00 C ATOM 198 O LEU A 15 -1.117 3.833 9.690 1.00 0.00 O ATOM 199 CB LEU A 15 0.146 6.659 10.809 1.00 0.00 C ATOM 200 CG LEU A 15 1.344 7.588 11.012 1.00 0.00 C ATOM 201 CD1 LEU A 15 1.171 8.412 12.278 1.00 0.00 C ATOM 202 CD2 LEU A 15 2.637 6.786 11.067 1.00 0.00 C ATOM 0 H LEU A 15 0.108 7.794 8.618 1.00 0.00 H new ATOM 0 HA LEU A 15 0.977 5.225 9.439 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -0.765 7.253 10.883 1.00 0.00 H new ATOM 0 HB3 LEU A 15 0.126 5.940 11.628 1.00 0.00 H new ATOM 0 HG LEU A 15 1.399 8.270 10.164 1.00 0.00 H new ATOM 0 HD11 LEU A 15 2.033 9.067 12.406 1.00 0.00 H new ATOM 0 HD12 LEU A 15 0.266 9.014 12.199 1.00 0.00 H new ATOM 0 HD13 LEU A 15 1.090 7.746 13.137 1.00 0.00 H new ATOM 0 HD21 LEU A 15 3.479 7.463 11.212 1.00 0.00 H new ATOM 0 HD22 LEU A 15 2.592 6.080 11.896 1.00 0.00 H new ATOM 0 HD23 LEU A 15 2.767 6.240 10.132 1.00 0.00 H new ATOM 214 N PHE A 16 -2.263 5.661 9.052 1.00 0.00 N ATOM 215 CA PHE A 16 -3.537 4.960 8.944 1.00 0.00 C ATOM 216 C PHE A 16 -3.385 3.679 8.129 1.00 0.00 C ATOM 217 O PHE A 16 -3.476 2.574 8.665 1.00 0.00 O ATOM 218 CB PHE A 16 -4.589 5.865 8.301 1.00 0.00 C ATOM 219 CG PHE A 16 -5.926 5.203 8.131 1.00 0.00 C ATOM 220 CD1 PHE A 16 -6.481 4.458 9.159 1.00 0.00 C ATOM 221 CD2 PHE A 16 -6.629 5.327 6.943 1.00 0.00 C ATOM 222 CE1 PHE A 16 -7.711 3.847 9.004 1.00 0.00 C ATOM 223 CE2 PHE A 16 -7.860 4.719 6.783 1.00 0.00 C ATOM 224 CZ PHE A 16 -8.402 3.978 7.816 1.00 0.00 C ATOM 0 H PHE A 16 -2.308 6.654 8.824 1.00 0.00 H new ATOM 0 HA PHE A 16 -3.863 4.694 9.949 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -4.710 6.759 8.913 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -4.228 6.192 7.326 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -5.947 4.354 10.092 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -6.210 5.905 6.133 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -8.132 3.267 9.812 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -8.398 4.823 5.852 1.00 0.00 H new ATOM 0 HZ PHE A 16 -9.364 3.502 7.694 1.00 0.00 H new ATOM 234 N LEU A 17 -3.154 3.835 6.830 1.00 0.00 N ATOM 235 CA LEU A 17 -2.990 2.692 5.939 1.00 0.00 C ATOM 236 C LEU A 17 -1.990 1.694 6.512 1.00 0.00 C ATOM 237 O LEU A 17 -2.346 0.561 6.838 1.00 0.00 O ATOM 238 CB LEU A 17 -2.528 3.159 4.558 1.00 0.00 C ATOM 239 CG LEU A 17 -3.335 4.295 3.928 1.00 0.00 C ATOM 240 CD1 LEU A 17 -2.736 4.696 2.589 1.00 0.00 C ATOM 241 CD2 LEU A 17 -4.791 3.886 3.762 1.00 0.00 C ATOM 0 H LEU A 17 -3.076 4.742 6.370 1.00 0.00 H new ATOM 0 HA LEU A 17 -3.956 2.196 5.843 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -1.488 3.477 4.633 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -2.552 2.305 3.881 1.00 0.00 H new ATOM 0 HG LEU A 17 -3.294 5.157 4.594 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -3.323 5.505 2.155 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -1.709 5.031 2.735 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -2.746 3.839 1.915 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -5.350 4.706 3.312 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -4.851 3.009 3.117 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -5.216 3.649 4.737 1.00 0.00 H new ATOM 253 N ARG A 18 -0.738 2.122 6.634 1.00 0.00 N ATOM 254 CA ARG A 18 0.314 1.266 7.170 1.00 0.00 C ATOM 255 C ARG A 18 -0.215 0.406 8.314 1.00 0.00 C ATOM 256 O ARG A 18 0.040 -0.797 8.368 1.00 0.00 O ATOM 257 CB ARG A 18 1.492 2.113 7.656 1.00 0.00 C ATOM 258 CG ARG A 18 2.818 1.371 7.650 1.00 0.00 C ATOM 259 CD ARG A 18 3.937 2.226 8.223 1.00 0.00 C ATOM 260 NE ARG A 18 5.045 1.416 8.723 1.00 0.00 N ATOM 261 CZ ARG A 18 6.118 1.925 9.318 1.00 0.00 C ATOM 262 NH1 ARG A 18 6.227 3.235 9.487 1.00 0.00 N ATOM 263 NH2 ARG A 18 7.084 1.122 9.746 1.00 0.00 N ATOM 0 H ARG A 18 -0.427 3.057 6.369 1.00 0.00 H new ATOM 0 HA ARG A 18 0.654 0.607 6.371 1.00 0.00 H new ATOM 0 HB2 ARG A 18 1.577 2.998 7.025 1.00 0.00 H new ATOM 0 HB3 ARG A 18 1.285 2.462 8.668 1.00 0.00 H new ATOM 0 HG2 ARG A 18 2.725 0.454 8.231 1.00 0.00 H new ATOM 0 HG3 ARG A 18 3.068 1.078 6.630 1.00 0.00 H new ATOM 0 HD2 ARG A 18 4.304 2.906 7.454 1.00 0.00 H new ATOM 0 HD3 ARG A 18 3.544 2.842 9.032 1.00 0.00 H new ATOM 0 HE ARG A 18 4.992 0.404 8.609 1.00 0.00 H new ATOM 0 HH11 ARG A 18 5.486 3.855 9.160 1.00 0.00 H new ATOM 0 HH12 ARG A 18 7.052 3.623 9.944 1.00 0.00 H new ATOM 0 HH21 ARG A 18 7.003 0.113 9.618 1.00 0.00 H new ATOM 0 HH22 ARG A 18 7.908 1.514 10.203 1.00 0.00 H new ATOM 277 N ASP A 19 -0.951 1.031 9.226 1.00 0.00 N ATOM 278 CA ASP A 19 -1.517 0.324 10.368 1.00 0.00 C ATOM 279 C ASP A 19 -2.446 -0.796 9.909 1.00 0.00 C ATOM 280 O ASP A 19 -2.306 -1.944 10.329 1.00 0.00 O ATOM 281 CB ASP A 19 -2.276 1.296 11.273 1.00 0.00 C ATOM 282 CG ASP A 19 -2.489 0.742 12.668 1.00 0.00 C ATOM 283 OD1 ASP A 19 -1.585 0.045 13.173 1.00 0.00 O ATOM 284 OD2 ASP A 19 -3.560 1.006 13.254 1.00 0.00 O ATOM 0 H ASP A 19 -1.170 2.027 9.196 1.00 0.00 H new ATOM 0 HA ASP A 19 -0.696 -0.119 10.932 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -1.724 2.234 11.338 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -3.243 1.526 10.825 1.00 0.00 H new ATOM 289 N VAL A 20 -3.396 -0.452 9.045 1.00 0.00 N ATOM 290 CA VAL A 20 -4.349 -1.427 8.529 1.00 0.00 C ATOM 291 C VAL A 20 -3.637 -2.543 7.771 1.00 0.00 C ATOM 292 O VAL A 20 -3.644 -3.699 8.194 1.00 0.00 O ATOM 293 CB VAL A 20 -5.380 -0.765 7.596 1.00 0.00 C ATOM 294 CG1 VAL A 20 -6.224 -1.820 6.898 1.00 0.00 C ATOM 295 CG2 VAL A 20 -6.258 0.202 8.375 1.00 0.00 C ATOM 0 H VAL A 20 -3.526 0.495 8.688 1.00 0.00 H new ATOM 0 HA VAL A 20 -4.868 -1.849 9.390 1.00 0.00 H new ATOM 0 HB VAL A 20 -4.844 -0.200 6.833 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -6.947 -1.333 6.243 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -5.579 -2.470 6.307 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -6.753 -2.415 7.643 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -6.981 0.661 7.701 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -6.787 -0.338 9.160 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -5.637 0.977 8.823 1.00 0.00 H new ATOM 305 N THR A 21 -3.022 -2.188 6.647 1.00 0.00 N ATOM 306 CA THR A 21 -2.305 -3.159 5.829 1.00 0.00 C ATOM 307 C THR A 21 -1.468 -4.094 6.693 1.00 0.00 C ATOM 308 O THR A 21 -1.503 -5.313 6.522 1.00 0.00 O ATOM 309 CB THR A 21 -1.388 -2.463 4.807 1.00 0.00 C ATOM 310 OG1 THR A 21 -2.175 -1.742 3.853 1.00 0.00 O ATOM 311 CG2 THR A 21 -0.513 -3.478 4.086 1.00 0.00 C ATOM 0 H THR A 21 -3.006 -1.236 6.282 1.00 0.00 H new ATOM 0 HA THR A 21 -3.057 -3.740 5.295 1.00 0.00 H new ATOM 0 HB THR A 21 -0.744 -1.768 5.345 1.00 0.00 H new ATOM 0 HG1 THR A 21 -2.386 -2.326 3.095 1.00 0.00 H new ATOM 0 HG21 THR A 21 0.126 -2.963 3.369 1.00 0.00 H new ATOM 0 HG22 THR A 21 0.107 -4.005 4.812 1.00 0.00 H new ATOM 0 HG23 THR A 21 -1.144 -4.194 3.560 1.00 0.00 H new ATOM 319 N LYS A 22 -0.714 -3.517 7.623 1.00 0.00 N ATOM 320 CA LYS A 22 0.132 -4.299 8.517 1.00 0.00 C ATOM 321 C LYS A 22 -0.702 -5.272 9.343 1.00 0.00 C ATOM 322 O LYS A 22 -0.352 -6.445 9.479 1.00 0.00 O ATOM 323 CB LYS A 22 0.922 -3.373 9.444 1.00 0.00 C ATOM 324 CG LYS A 22 2.073 -4.063 10.156 1.00 0.00 C ATOM 325 CD LYS A 22 2.365 -3.416 11.500 1.00 0.00 C ATOM 326 CE LYS A 22 1.315 -3.784 12.536 1.00 0.00 C ATOM 327 NZ LYS A 22 1.668 -3.273 13.890 1.00 0.00 N ATOM 0 H LYS A 22 -0.672 -2.510 7.777 1.00 0.00 H new ATOM 0 HA LYS A 22 0.829 -4.873 7.907 1.00 0.00 H new ATOM 0 HB2 LYS A 22 1.314 -2.538 8.863 1.00 0.00 H new ATOM 0 HB3 LYS A 22 0.245 -2.953 10.188 1.00 0.00 H new ATOM 0 HG2 LYS A 22 1.833 -5.116 10.303 1.00 0.00 H new ATOM 0 HG3 LYS A 22 2.965 -4.024 9.531 1.00 0.00 H new ATOM 0 HD2 LYS A 22 3.348 -3.730 11.850 1.00 0.00 H new ATOM 0 HD3 LYS A 22 2.399 -2.333 11.384 1.00 0.00 H new ATOM 0 HE2 LYS A 22 0.350 -3.377 12.235 1.00 0.00 H new ATOM 0 HE3 LYS A 22 1.207 -4.868 12.574 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 0.927 -3.545 14.568 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 2.577 -3.681 14.189 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 1.747 -2.236 13.860 1.00 0.00 H new ATOM 341 N ARG A 23 -1.807 -4.779 9.892 1.00 0.00 N ATOM 342 CA ARG A 23 -2.692 -5.605 10.705 1.00 0.00 C ATOM 343 C ARG A 23 -3.109 -6.862 9.948 1.00 0.00 C ATOM 344 O ARG A 23 -3.484 -7.869 10.552 1.00 0.00 O ATOM 345 CB ARG A 23 -3.932 -4.810 11.118 1.00 0.00 C ATOM 346 CG ARG A 23 -4.861 -5.572 12.048 1.00 0.00 C ATOM 347 CD ARG A 23 -5.791 -4.631 12.799 1.00 0.00 C ATOM 348 NE ARG A 23 -6.396 -5.273 13.963 1.00 0.00 N ATOM 349 CZ ARG A 23 -5.767 -5.435 15.122 1.00 0.00 C ATOM 350 NH1 ARG A 23 -4.522 -5.004 15.270 1.00 0.00 N ATOM 351 NH2 ARG A 23 -6.384 -6.029 16.136 1.00 0.00 N ATOM 0 H ARG A 23 -2.111 -3.811 9.789 1.00 0.00 H new ATOM 0 HA ARG A 23 -2.147 -5.904 11.600 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -3.616 -3.889 11.608 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -4.483 -4.522 10.223 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -5.451 -6.285 11.471 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -4.272 -6.149 12.761 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -5.234 -3.750 13.119 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -6.576 -4.285 12.127 1.00 0.00 H new ATOM 0 HE ARG A 23 -7.353 -5.616 13.882 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -4.045 -4.547 14.493 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -4.041 -5.130 16.161 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -7.342 -6.362 16.026 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -5.900 -6.153 17.025 1.00 0.00 H new ATOM 365 N LEU A 24 -3.043 -6.798 8.622 1.00 0.00 N ATOM 366 CA LEU A 24 -3.414 -7.930 7.781 1.00 0.00 C ATOM 367 C LEU A 24 -2.190 -8.768 7.425 1.00 0.00 C ATOM 368 O LEU A 24 -2.238 -9.997 7.453 1.00 0.00 O ATOM 369 CB LEU A 24 -4.100 -7.440 6.505 1.00 0.00 C ATOM 370 CG LEU A 24 -5.203 -6.398 6.694 1.00 0.00 C ATOM 371 CD1 LEU A 24 -5.449 -5.640 5.399 1.00 0.00 C ATOM 372 CD2 LEU A 24 -6.485 -7.059 7.179 1.00 0.00 C ATOM 0 H LEU A 24 -2.736 -5.973 8.107 1.00 0.00 H new ATOM 0 HA LEU A 24 -4.109 -8.555 8.342 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -3.340 -7.020 5.846 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -4.526 -8.302 5.991 1.00 0.00 H new ATOM 0 HG LEU A 24 -4.877 -5.686 7.452 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -6.237 -4.903 5.553 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -4.533 -5.134 5.094 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -5.753 -6.339 4.620 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -7.259 -6.302 7.308 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -6.815 -7.794 6.445 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -6.301 -7.555 8.132 1.00 0.00 H new ATOM 384 N ALA A 25 -1.095 -8.094 7.091 1.00 0.00 N ATOM 385 CA ALA A 25 0.143 -8.776 6.733 1.00 0.00 C ATOM 386 C ALA A 25 0.674 -9.598 7.902 1.00 0.00 C ATOM 387 O ALA A 25 1.206 -10.693 7.714 1.00 0.00 O ATOM 388 CB ALA A 25 1.187 -7.768 6.276 1.00 0.00 C ATOM 0 H ALA A 25 -1.040 -7.076 7.061 1.00 0.00 H new ATOM 0 HA ALA A 25 -0.071 -9.459 5.911 1.00 0.00 H new ATOM 0 HB1 ALA A 25 2.106 -8.291 6.012 1.00 0.00 H new ATOM 0 HB2 ALA A 25 0.814 -7.227 5.406 1.00 0.00 H new ATOM 0 HB3 ALA A 25 1.389 -7.063 7.082 1.00 0.00 H new ATOM 394 N THR A 26 0.529 -9.063 9.111 1.00 0.00 N ATOM 395 CA THR A 26 0.996 -9.747 10.310 1.00 0.00 C ATOM 396 C THR A 26 0.255 -11.063 10.517 1.00 0.00 C ATOM 397 O THR A 26 0.771 -11.984 11.150 1.00 0.00 O ATOM 398 CB THR A 26 0.817 -8.868 11.563 1.00 0.00 C ATOM 399 OG1 THR A 26 0.945 -9.667 12.744 1.00 0.00 O ATOM 400 CG2 THR A 26 -0.540 -8.182 11.553 1.00 0.00 C ATOM 0 H THR A 26 0.092 -8.158 9.285 1.00 0.00 H new ATOM 0 HA THR A 26 2.057 -9.950 10.165 1.00 0.00 H new ATOM 0 HB THR A 26 1.593 -8.103 11.557 1.00 0.00 H new ATOM 0 HG1 THR A 26 0.832 -9.101 13.536 1.00 0.00 H new ATOM 0 HG21 THR A 26 -0.643 -7.567 12.447 1.00 0.00 H new ATOM 0 HG22 THR A 26 -0.623 -7.552 10.668 1.00 0.00 H new ATOM 0 HG23 THR A 26 -1.328 -8.935 11.537 1.00 0.00 H new ATOM 408 N ASP A 27 -0.957 -11.145 9.979 1.00 0.00 N ATOM 409 CA ASP A 27 -1.768 -12.350 10.103 1.00 0.00 C ATOM 410 C ASP A 27 -1.445 -13.340 8.988 1.00 0.00 C ATOM 411 O ASP A 27 -1.469 -12.991 7.807 1.00 0.00 O ATOM 412 CB ASP A 27 -3.256 -11.995 10.072 1.00 0.00 C ATOM 413 CG ASP A 27 -4.121 -13.070 10.699 1.00 0.00 C ATOM 414 OD1 ASP A 27 -3.573 -14.126 11.078 1.00 0.00 O ATOM 415 OD2 ASP A 27 -5.346 -12.856 10.810 1.00 0.00 O ATOM 0 H ASP A 27 -1.399 -10.391 9.453 1.00 0.00 H new ATOM 0 HA ASP A 27 -1.534 -12.818 11.059 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -3.413 -11.054 10.599 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -3.568 -11.838 9.039 1.00 0.00 H new ATOM 420 N LYS A 28 -1.143 -14.576 9.370 1.00 0.00 N ATOM 421 CA LYS A 28 -0.815 -15.618 8.404 1.00 0.00 C ATOM 422 C LYS A 28 -1.973 -15.847 7.437 1.00 0.00 C ATOM 423 O LYS A 28 -1.807 -16.478 6.393 1.00 0.00 O ATOM 424 CB LYS A 28 -0.474 -16.923 9.126 1.00 0.00 C ATOM 425 CG LYS A 28 0.969 -17.000 9.593 1.00 0.00 C ATOM 426 CD LYS A 28 1.201 -16.148 10.830 1.00 0.00 C ATOM 427 CE LYS A 28 2.576 -16.399 11.430 1.00 0.00 C ATOM 428 NZ LYS A 28 2.637 -17.701 12.151 1.00 0.00 N ATOM 0 H LYS A 28 -1.119 -14.881 10.343 1.00 0.00 H new ATOM 0 HA LYS A 28 0.053 -15.289 7.833 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -1.132 -17.035 9.987 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -0.677 -17.761 8.459 1.00 0.00 H new ATOM 0 HG2 LYS A 28 1.227 -18.036 9.810 1.00 0.00 H new ATOM 0 HG3 LYS A 28 1.630 -16.668 8.792 1.00 0.00 H new ATOM 0 HD2 LYS A 28 1.103 -15.094 10.571 1.00 0.00 H new ATOM 0 HD3 LYS A 28 0.433 -16.366 11.573 1.00 0.00 H new ATOM 0 HE2 LYS A 28 3.325 -16.387 10.639 1.00 0.00 H new ATOM 0 HE3 LYS A 28 2.825 -15.591 12.118 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 3.549 -17.782 12.645 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 1.863 -17.751 12.844 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 2.542 -18.480 11.469 1.00 0.00 H new ATOM 442 N ARG A 29 -3.145 -15.329 7.791 1.00 0.00 N ATOM 443 CA ARG A 29 -4.330 -15.478 6.955 1.00 0.00 C ATOM 444 C ARG A 29 -4.201 -14.652 5.678 1.00 0.00 C ATOM 445 O ARG A 29 -4.659 -15.063 4.612 1.00 0.00 O ATOM 446 CB ARG A 29 -5.581 -15.053 7.725 1.00 0.00 C ATOM 447 CG ARG A 29 -6.177 -16.162 8.577 1.00 0.00 C ATOM 448 CD ARG A 29 -5.225 -16.587 9.684 1.00 0.00 C ATOM 449 NE ARG A 29 -5.931 -17.185 10.814 1.00 0.00 N ATOM 450 CZ ARG A 29 -6.589 -16.479 11.727 1.00 0.00 C ATOM 451 NH1 ARG A 29 -6.631 -15.157 11.644 1.00 0.00 N ATOM 452 NH2 ARG A 29 -7.207 -17.096 12.726 1.00 0.00 N ATOM 0 H ARG A 29 -3.299 -14.803 8.651 1.00 0.00 H new ATOM 0 HA ARG A 29 -4.420 -16.529 6.681 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -5.333 -14.207 8.366 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -6.333 -14.706 7.017 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -7.116 -15.822 9.014 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -6.411 -17.020 7.947 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -4.504 -17.302 9.287 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -4.659 -15.721 10.027 1.00 0.00 H new ATOM 0 HE ARG A 29 -5.918 -18.201 10.907 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -6.157 -14.679 10.878 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -7.137 -14.618 12.347 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -7.177 -18.113 12.794 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -7.712 -16.553 13.426 1.00 0.00 H new ATOM 466 N PHE A 30 -3.575 -13.486 5.795 1.00 0.00 N ATOM 467 CA PHE A 30 -3.387 -12.601 4.651 1.00 0.00 C ATOM 468 C PHE A 30 -1.906 -12.307 4.428 1.00 0.00 C ATOM 469 O PHE A 30 -1.544 -11.262 3.889 1.00 0.00 O ATOM 470 CB PHE A 30 -4.153 -11.293 4.859 1.00 0.00 C ATOM 471 CG PHE A 30 -5.598 -11.495 5.216 1.00 0.00 C ATOM 472 CD1 PHE A 30 -6.449 -12.171 4.357 1.00 0.00 C ATOM 473 CD2 PHE A 30 -6.105 -11.008 6.410 1.00 0.00 C ATOM 474 CE1 PHE A 30 -7.779 -12.358 4.682 1.00 0.00 C ATOM 475 CE2 PHE A 30 -7.434 -11.193 6.741 1.00 0.00 C ATOM 476 CZ PHE A 30 -8.272 -11.868 5.875 1.00 0.00 C ATOM 0 H PHE A 30 -3.189 -13.132 6.670 1.00 0.00 H new ATOM 0 HA PHE A 30 -3.776 -13.105 3.766 1.00 0.00 H new ATOM 0 HB2 PHE A 30 -3.669 -10.719 5.649 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -4.092 -10.697 3.949 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -6.069 -12.556 3.423 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -5.454 -10.478 7.090 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -8.432 -12.887 4.004 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -7.817 -10.810 7.676 1.00 0.00 H new ATOM 0 HZ PHE A 30 -9.311 -12.012 6.131 1.00 0.00 H new ATOM 486 N ASN A 31 -1.054 -13.236 4.849 1.00 0.00 N ATOM 487 CA ASN A 31 0.387 -13.077 4.697 1.00 0.00 C ATOM 488 C ASN A 31 0.875 -13.733 3.409 1.00 0.00 C ATOM 489 O ASN A 31 1.934 -13.386 2.885 1.00 0.00 O ATOM 490 CB ASN A 31 1.118 -13.681 5.898 1.00 0.00 C ATOM 491 CG ASN A 31 1.305 -15.180 5.767 1.00 0.00 C ATOM 492 OD1 ASN A 31 0.353 -15.916 5.509 1.00 0.00 O ATOM 493 ND2 ASN A 31 2.538 -15.640 5.945 1.00 0.00 N ATOM 0 H ASN A 31 -1.337 -14.107 5.298 1.00 0.00 H new ATOM 0 HA ASN A 31 0.605 -12.010 4.646 1.00 0.00 H new ATOM 0 HB2 ASN A 31 2.092 -13.204 6.004 1.00 0.00 H new ATOM 0 HB3 ASN A 31 0.557 -13.466 6.807 1.00 0.00 H new ATOM 0 HD21 ASN A 31 2.725 -16.640 5.869 1.00 0.00 H new ATOM 0 HD22 ASN A 31 3.298 -14.993 6.157 1.00 0.00 H new ATOM 500 N ILE A 32 0.095 -14.683 2.903 1.00 0.00 N ATOM 501 CA ILE A 32 0.446 -15.386 1.676 1.00 0.00 C ATOM 502 C ILE A 32 0.518 -14.426 0.494 1.00 0.00 C ATOM 503 O ILE A 32 1.302 -14.625 -0.435 1.00 0.00 O ATOM 504 CB ILE A 32 -0.568 -16.501 1.356 1.00 0.00 C ATOM 505 CG1 ILE A 32 -1.900 -15.896 0.910 1.00 0.00 C ATOM 506 CG2 ILE A 32 -0.767 -17.399 2.568 1.00 0.00 C ATOM 507 CD1 ILE A 32 -2.838 -16.900 0.277 1.00 0.00 C ATOM 0 H ILE A 32 -0.784 -14.983 3.324 1.00 0.00 H new ATOM 0 HA ILE A 32 1.427 -15.833 1.838 1.00 0.00 H new ATOM 0 HB ILE A 32 -0.175 -17.107 0.540 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -2.392 -15.445 1.772 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -1.705 -15.094 0.198 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -1.486 -18.182 2.327 1.00 0.00 H new ATOM 0 HG22 ILE A 32 0.185 -17.853 2.845 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -1.142 -16.806 3.402 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -3.762 -16.401 -0.015 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -2.366 -17.334 -0.605 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -3.063 -17.690 0.994 1.00 0.00 H new ATOM 519 N PHE A 33 -0.303 -13.382 0.535 1.00 0.00 N ATOM 520 CA PHE A 33 -0.332 -12.389 -0.533 1.00 0.00 C ATOM 521 C PHE A 33 0.797 -11.377 -0.365 1.00 0.00 C ATOM 522 O PHE A 33 1.189 -10.704 -1.318 1.00 0.00 O ATOM 523 CB PHE A 33 -1.682 -11.668 -0.550 1.00 0.00 C ATOM 524 CG PHE A 33 -2.859 -12.594 -0.441 1.00 0.00 C ATOM 525 CD1 PHE A 33 -3.280 -13.333 -1.535 1.00 0.00 C ATOM 526 CD2 PHE A 33 -3.543 -12.727 0.756 1.00 0.00 C ATOM 527 CE1 PHE A 33 -4.363 -14.187 -1.437 1.00 0.00 C ATOM 528 CE2 PHE A 33 -4.626 -13.580 0.860 1.00 0.00 C ATOM 529 CZ PHE A 33 -5.037 -14.309 -0.238 1.00 0.00 C ATOM 0 H PHE A 33 -0.957 -13.201 1.296 1.00 0.00 H new ATOM 0 HA PHE A 33 -0.193 -12.907 -1.482 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -1.714 -10.955 0.274 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -1.766 -11.094 -1.473 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -2.756 -13.241 -2.475 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -3.227 -12.158 1.618 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -4.681 -14.758 -2.297 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -5.150 -13.676 1.799 1.00 0.00 H new ATOM 0 HZ PHE A 33 -5.885 -14.974 -0.159 1.00 0.00 H new ATOM 539 N SER A 34 1.314 -11.274 0.855 1.00 0.00 N ATOM 540 CA SER A 34 2.395 -10.341 1.151 1.00 0.00 C ATOM 541 C SER A 34 3.617 -10.632 0.284 1.00 0.00 C ATOM 542 O SER A 34 4.374 -9.727 -0.068 1.00 0.00 O ATOM 543 CB SER A 34 2.775 -10.419 2.630 1.00 0.00 C ATOM 544 OG SER A 34 3.662 -11.498 2.873 1.00 0.00 O ATOM 0 H SER A 34 1.002 -11.825 1.655 1.00 0.00 H new ATOM 0 HA SER A 34 2.043 -9.334 0.927 1.00 0.00 H new ATOM 0 HB2 SER A 34 3.242 -9.484 2.938 1.00 0.00 H new ATOM 0 HB3 SER A 34 1.876 -10.540 3.234 1.00 0.00 H new ATOM 0 HG SER A 34 3.148 -12.296 3.117 1.00 0.00 H new ATOM 550 N LYS A 35 3.803 -11.903 -0.057 1.00 0.00 N ATOM 551 CA LYS A 35 4.930 -12.316 -0.883 1.00 0.00 C ATOM 552 C LYS A 35 4.448 -12.928 -2.195 1.00 0.00 C ATOM 553 O LYS A 35 3.313 -13.388 -2.313 1.00 0.00 O ATOM 554 CB LYS A 35 5.800 -13.324 -0.128 1.00 0.00 C ATOM 555 CG LYS A 35 6.788 -12.678 0.828 1.00 0.00 C ATOM 556 CD LYS A 35 7.407 -13.701 1.765 1.00 0.00 C ATOM 557 CE LYS A 35 8.145 -13.030 2.913 1.00 0.00 C ATOM 558 NZ LYS A 35 9.537 -12.658 2.536 1.00 0.00 N ATOM 0 H LYS A 35 3.187 -12.665 0.227 1.00 0.00 H new ATOM 0 HA LYS A 35 5.524 -11.431 -1.111 1.00 0.00 H new ATOM 0 HB2 LYS A 35 5.155 -14.001 0.432 1.00 0.00 H new ATOM 0 HB3 LYS A 35 6.348 -13.930 -0.849 1.00 0.00 H new ATOM 0 HG2 LYS A 35 7.574 -12.181 0.259 1.00 0.00 H new ATOM 0 HG3 LYS A 35 6.282 -11.909 1.411 1.00 0.00 H new ATOM 0 HD2 LYS A 35 6.627 -14.351 2.163 1.00 0.00 H new ATOM 0 HD3 LYS A 35 8.097 -14.335 1.208 1.00 0.00 H new ATOM 0 HE2 LYS A 35 7.601 -12.137 3.221 1.00 0.00 H new ATOM 0 HE3 LYS A 35 8.168 -13.701 3.771 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 10.006 -12.204 3.345 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 10.064 -13.513 2.266 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 9.514 -11.997 1.733 1.00 0.00 H new ATOM 572 N PRO A 36 5.331 -12.935 -3.205 1.00 0.00 N ATOM 573 CA PRO A 36 5.018 -13.489 -4.526 1.00 0.00 C ATOM 574 C PRO A 36 4.886 -15.008 -4.501 1.00 0.00 C ATOM 575 O PRO A 36 5.884 -15.727 -4.452 1.00 0.00 O ATOM 576 CB PRO A 36 6.217 -13.071 -5.380 1.00 0.00 C ATOM 577 CG PRO A 36 7.333 -12.900 -4.407 1.00 0.00 C ATOM 578 CD PRO A 36 6.702 -12.403 -3.136 1.00 0.00 C ATOM 0 HA PRO A 36 4.062 -13.127 -4.903 1.00 0.00 H new ATOM 0 HB2 PRO A 36 6.455 -13.829 -6.126 1.00 0.00 H new ATOM 0 HB3 PRO A 36 6.016 -12.145 -5.919 1.00 0.00 H new ATOM 0 HG2 PRO A 36 7.854 -13.843 -4.241 1.00 0.00 H new ATOM 0 HG3 PRO A 36 8.071 -12.190 -4.780 1.00 0.00 H new ATOM 0 HD2 PRO A 36 7.231 -12.768 -2.255 1.00 0.00 H new ATOM 0 HD3 PRO A 36 6.708 -11.314 -3.083 1.00 0.00 H new ATOM 586 N VAL A 37 3.648 -15.491 -4.535 1.00 0.00 N ATOM 587 CA VAL A 37 3.386 -16.925 -4.518 1.00 0.00 C ATOM 588 C VAL A 37 3.818 -17.579 -5.825 1.00 0.00 C ATOM 589 O VAL A 37 3.926 -18.802 -5.914 1.00 0.00 O ATOM 590 CB VAL A 37 1.893 -17.220 -4.277 1.00 0.00 C ATOM 591 CG1 VAL A 37 1.473 -16.755 -2.891 1.00 0.00 C ATOM 592 CG2 VAL A 37 1.041 -16.561 -5.351 1.00 0.00 C ATOM 0 H VAL A 37 2.811 -14.910 -4.574 1.00 0.00 H new ATOM 0 HA VAL A 37 3.968 -17.343 -3.697 1.00 0.00 H new ATOM 0 HB VAL A 37 1.739 -18.298 -4.333 1.00 0.00 H new ATOM 0 HG11 VAL A 37 0.416 -16.972 -2.739 1.00 0.00 H new ATOM 0 HG12 VAL A 37 2.062 -17.278 -2.138 1.00 0.00 H new ATOM 0 HG13 VAL A 37 1.640 -15.682 -2.801 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -0.011 -16.779 -5.166 1.00 0.00 H new ATOM 0 HG22 VAL A 37 1.197 -15.482 -5.328 1.00 0.00 H new ATOM 0 HG23 VAL A 37 1.325 -16.948 -6.329 1.00 0.00 H new ATOM 602 N SER A 38 4.063 -16.755 -6.839 1.00 0.00 N ATOM 603 CA SER A 38 4.481 -17.252 -8.145 1.00 0.00 C ATOM 604 C SER A 38 5.874 -17.868 -8.071 1.00 0.00 C ATOM 605 O SER A 38 6.538 -17.808 -7.036 1.00 0.00 O ATOM 606 CB SER A 38 4.464 -16.121 -9.175 1.00 0.00 C ATOM 607 OG SER A 38 3.146 -15.858 -9.623 1.00 0.00 O ATOM 0 H SER A 38 3.979 -15.740 -6.781 1.00 0.00 H new ATOM 0 HA SER A 38 3.777 -18.025 -8.454 1.00 0.00 H new ATOM 0 HB2 SER A 38 4.889 -15.218 -8.735 1.00 0.00 H new ATOM 0 HB3 SER A 38 5.093 -16.389 -10.024 1.00 0.00 H new ATOM 0 HG SER A 38 3.128 -15.856 -10.603 1.00 0.00 H new ATOM 613 N ASP A 39 6.312 -18.460 -9.177 1.00 0.00 N ATOM 614 CA ASP A 39 7.627 -19.087 -9.240 1.00 0.00 C ATOM 615 C ASP A 39 8.537 -18.344 -10.214 1.00 0.00 C ATOM 616 O ASP A 39 9.471 -17.656 -9.804 1.00 0.00 O ATOM 617 CB ASP A 39 7.498 -20.552 -9.660 1.00 0.00 C ATOM 618 CG ASP A 39 7.140 -21.458 -8.498 1.00 0.00 C ATOM 619 OD1 ASP A 39 7.831 -21.392 -7.459 1.00 0.00 O ATOM 620 OD2 ASP A 39 6.170 -22.232 -8.627 1.00 0.00 O ATOM 0 H ASP A 39 5.775 -18.519 -10.042 1.00 0.00 H new ATOM 0 HA ASP A 39 8.072 -19.040 -8.246 1.00 0.00 H new ATOM 0 HB2 ASP A 39 6.735 -20.639 -10.434 1.00 0.00 H new ATOM 0 HB3 ASP A 39 8.438 -20.885 -10.100 1.00 0.00 H new ATOM 625 N TYR A 40 8.258 -18.490 -11.505 1.00 0.00 N ATOM 626 CA TYR A 40 9.053 -17.836 -12.537 1.00 0.00 C ATOM 627 C TYR A 40 9.382 -16.399 -12.143 1.00 0.00 C ATOM 628 O TYR A 40 8.567 -15.709 -11.528 1.00 0.00 O ATOM 629 CB TYR A 40 8.306 -17.852 -13.872 1.00 0.00 C ATOM 630 CG TYR A 40 9.137 -17.361 -15.036 1.00 0.00 C ATOM 631 CD1 TYR A 40 9.592 -16.050 -15.086 1.00 0.00 C ATOM 632 CD2 TYR A 40 9.465 -18.209 -16.087 1.00 0.00 C ATOM 633 CE1 TYR A 40 10.351 -15.596 -16.147 1.00 0.00 C ATOM 634 CE2 TYR A 40 10.224 -17.764 -17.152 1.00 0.00 C ATOM 635 CZ TYR A 40 10.664 -16.457 -17.178 1.00 0.00 C ATOM 636 OH TYR A 40 11.420 -16.011 -18.238 1.00 0.00 O ATOM 0 H TYR A 40 7.487 -19.055 -11.861 1.00 0.00 H new ATOM 0 HA TYR A 40 9.987 -18.387 -12.644 1.00 0.00 H new ATOM 0 HB2 TYR A 40 7.970 -18.868 -14.079 1.00 0.00 H new ATOM 0 HB3 TYR A 40 7.413 -17.233 -13.787 1.00 0.00 H new ATOM 0 HD1 TYR A 40 9.348 -15.373 -14.281 1.00 0.00 H new ATOM 0 HD2 TYR A 40 9.121 -19.233 -16.071 1.00 0.00 H new ATOM 0 HE1 TYR A 40 10.697 -14.573 -16.169 1.00 0.00 H new ATOM 0 HE2 TYR A 40 10.472 -18.436 -17.960 1.00 0.00 H new ATOM 0 HH TYR A 40 11.551 -16.742 -18.877 1.00 0.00 H new ATOM 646 N LEU A 41 10.581 -15.954 -12.502 1.00 0.00 N ATOM 647 CA LEU A 41 11.019 -14.599 -12.188 1.00 0.00 C ATOM 648 C LEU A 41 9.866 -13.610 -12.315 1.00 0.00 C ATOM 649 O LEU A 41 9.616 -13.069 -13.391 1.00 0.00 O ATOM 650 CB LEU A 41 12.165 -14.185 -13.113 1.00 0.00 C ATOM 651 CG LEU A 41 13.205 -13.239 -12.511 1.00 0.00 C ATOM 652 CD1 LEU A 41 14.026 -12.581 -13.609 1.00 0.00 C ATOM 653 CD2 LEU A 41 12.530 -12.187 -11.644 1.00 0.00 C ATOM 0 H LEU A 41 11.267 -16.512 -13.011 1.00 0.00 H new ATOM 0 HA LEU A 41 11.370 -14.588 -11.156 1.00 0.00 H new ATOM 0 HB2 LEU A 41 12.676 -15.086 -13.451 1.00 0.00 H new ATOM 0 HB3 LEU A 41 11.739 -13.709 -13.996 1.00 0.00 H new ATOM 0 HG LEU A 41 13.878 -13.822 -11.882 1.00 0.00 H new ATOM 0 HD11 LEU A 41 14.761 -11.911 -13.162 1.00 0.00 H new ATOM 0 HD12 LEU A 41 14.539 -13.348 -14.189 1.00 0.00 H new ATOM 0 HD13 LEU A 41 13.367 -12.011 -14.264 1.00 0.00 H new ATOM 0 HD21 LEU A 41 13.285 -11.523 -11.224 1.00 0.00 H new ATOM 0 HD22 LEU A 41 11.834 -11.608 -12.251 1.00 0.00 H new ATOM 0 HD23 LEU A 41 11.987 -12.676 -10.835 1.00 0.00 H new ATOM 665 N GLU A 42 9.167 -13.377 -11.208 1.00 0.00 N ATOM 666 CA GLU A 42 8.040 -12.452 -11.197 1.00 0.00 C ATOM 667 C GLU A 42 7.342 -12.428 -12.553 1.00 0.00 C ATOM 668 O GLU A 42 6.910 -11.376 -13.024 1.00 0.00 O ATOM 669 CB GLU A 42 8.512 -11.043 -10.829 1.00 0.00 C ATOM 670 CG GLU A 42 8.729 -10.844 -9.339 1.00 0.00 C ATOM 671 CD GLU A 42 7.428 -10.698 -8.574 1.00 0.00 C ATOM 672 OE1 GLU A 42 6.771 -11.729 -8.319 1.00 0.00 O ATOM 673 OE2 GLU A 42 7.067 -9.553 -8.231 1.00 0.00 O ATOM 0 H GLU A 42 9.361 -13.816 -10.308 1.00 0.00 H new ATOM 0 HA GLU A 42 7.328 -12.797 -10.447 1.00 0.00 H new ATOM 0 HB2 GLU A 42 9.443 -10.832 -11.355 1.00 0.00 H new ATOM 0 HB3 GLU A 42 7.777 -10.319 -11.180 1.00 0.00 H new ATOM 0 HG2 GLU A 42 9.287 -11.691 -8.941 1.00 0.00 H new ATOM 0 HG3 GLU A 42 9.341 -9.956 -9.180 1.00 0.00 H new ATOM 680 N VAL A 43 7.235 -13.597 -13.177 1.00 0.00 N ATOM 681 CA VAL A 43 6.588 -13.712 -14.479 1.00 0.00 C ATOM 682 C VAL A 43 5.386 -12.780 -14.580 1.00 0.00 C ATOM 683 O VAL A 43 5.145 -12.172 -15.624 1.00 0.00 O ATOM 684 CB VAL A 43 6.129 -15.157 -14.752 1.00 0.00 C ATOM 685 CG1 VAL A 43 5.544 -15.778 -13.493 1.00 0.00 C ATOM 686 CG2 VAL A 43 5.120 -15.188 -15.890 1.00 0.00 C ATOM 0 H VAL A 43 7.588 -14.478 -12.802 1.00 0.00 H new ATOM 0 HA VAL A 43 7.328 -13.427 -15.227 1.00 0.00 H new ATOM 0 HB VAL A 43 6.997 -15.746 -15.049 1.00 0.00 H new ATOM 0 HG11 VAL A 43 5.225 -16.799 -13.705 1.00 0.00 H new ATOM 0 HG12 VAL A 43 6.300 -15.790 -12.708 1.00 0.00 H new ATOM 0 HG13 VAL A 43 4.687 -15.191 -13.162 1.00 0.00 H new ATOM 0 HG21 VAL A 43 4.806 -16.216 -16.070 1.00 0.00 H new ATOM 0 HG22 VAL A 43 4.252 -14.585 -15.623 1.00 0.00 H new ATOM 0 HG23 VAL A 43 5.578 -14.785 -16.793 1.00 0.00 H new ATOM 696 N ILE A 44 4.635 -12.672 -13.490 1.00 0.00 N ATOM 697 CA ILE A 44 3.458 -11.813 -13.455 1.00 0.00 C ATOM 698 C ILE A 44 3.734 -10.475 -14.133 1.00 0.00 C ATOM 699 O ILE A 44 4.848 -9.953 -14.072 1.00 0.00 O ATOM 700 CB ILE A 44 2.990 -11.556 -12.011 1.00 0.00 C ATOM 701 CG1 ILE A 44 2.765 -12.883 -11.282 1.00 0.00 C ATOM 702 CG2 ILE A 44 1.720 -10.720 -12.006 1.00 0.00 C ATOM 703 CD1 ILE A 44 3.994 -13.395 -10.564 1.00 0.00 C ATOM 0 H ILE A 44 4.821 -13.169 -12.619 1.00 0.00 H new ATOM 0 HA ILE A 44 2.670 -12.337 -13.996 1.00 0.00 H new ATOM 0 HB ILE A 44 3.767 -11.001 -11.486 1.00 0.00 H new ATOM 0 HG12 ILE A 44 1.958 -12.759 -10.560 1.00 0.00 H new ATOM 0 HG13 ILE A 44 2.436 -13.632 -12.002 1.00 0.00 H new ATOM 0 HG21 ILE A 44 1.402 -10.547 -10.978 1.00 0.00 H new ATOM 0 HG22 ILE A 44 1.912 -9.763 -12.492 1.00 0.00 H new ATOM 0 HG23 ILE A 44 0.934 -11.249 -12.545 1.00 0.00 H new ATOM 0 HD11 ILE A 44 3.760 -14.338 -10.070 1.00 0.00 H new ATOM 0 HD12 ILE A 44 4.797 -13.551 -11.284 1.00 0.00 H new ATOM 0 HD13 ILE A 44 4.311 -12.665 -9.820 1.00 0.00 H new ATOM 715 N LYS A 45 2.713 -9.923 -14.779 1.00 0.00 N ATOM 716 CA LYS A 45 2.842 -8.644 -15.466 1.00 0.00 C ATOM 717 C LYS A 45 2.630 -7.483 -14.500 1.00 0.00 C ATOM 718 O LYS A 45 3.394 -6.519 -14.497 1.00 0.00 O ATOM 719 CB LYS A 45 1.837 -8.555 -16.616 1.00 0.00 C ATOM 720 CG LYS A 45 1.962 -9.686 -17.623 1.00 0.00 C ATOM 721 CD LYS A 45 3.021 -9.386 -18.670 1.00 0.00 C ATOM 722 CE LYS A 45 2.445 -8.597 -19.835 1.00 0.00 C ATOM 723 NZ LYS A 45 2.388 -7.138 -19.544 1.00 0.00 N ATOM 0 H LYS A 45 1.785 -10.342 -14.841 1.00 0.00 H new ATOM 0 HA LYS A 45 3.852 -8.578 -15.869 1.00 0.00 H new ATOM 0 HB2 LYS A 45 0.827 -8.555 -16.206 1.00 0.00 H new ATOM 0 HB3 LYS A 45 1.971 -7.604 -17.132 1.00 0.00 H new ATOM 0 HG2 LYS A 45 2.214 -10.611 -17.104 1.00 0.00 H new ATOM 0 HG3 LYS A 45 1.001 -9.847 -18.112 1.00 0.00 H new ATOM 0 HD2 LYS A 45 3.835 -8.822 -18.214 1.00 0.00 H new ATOM 0 HD3 LYS A 45 3.446 -10.320 -19.037 1.00 0.00 H new ATOM 0 HE2 LYS A 45 3.053 -8.766 -20.724 1.00 0.00 H new ATOM 0 HE3 LYS A 45 1.443 -8.962 -20.060 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 2.508 -6.603 -20.428 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 1.467 -6.904 -19.120 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 3.148 -6.886 -18.881 1.00 0.00 H new ATOM 737 N GLU A 46 1.587 -7.583 -13.682 1.00 0.00 N ATOM 738 CA GLU A 46 1.275 -6.541 -12.711 1.00 0.00 C ATOM 739 C GLU A 46 1.379 -7.076 -11.286 1.00 0.00 C ATOM 740 O GLU A 46 0.381 -7.418 -10.650 1.00 0.00 O ATOM 741 CB GLU A 46 -0.129 -5.986 -12.958 1.00 0.00 C ATOM 742 CG GLU A 46 -1.133 -7.041 -13.392 1.00 0.00 C ATOM 743 CD GLU A 46 -1.141 -7.256 -14.893 1.00 0.00 C ATOM 744 OE1 GLU A 46 -0.224 -6.746 -15.570 1.00 0.00 O ATOM 745 OE2 GLU A 46 -2.065 -7.933 -15.391 1.00 0.00 O ATOM 0 H GLU A 46 0.944 -8.375 -13.672 1.00 0.00 H new ATOM 0 HA GLU A 46 2.002 -5.738 -12.833 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -0.488 -5.509 -12.046 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -0.075 -5.211 -13.723 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -0.902 -7.983 -12.895 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -2.130 -6.745 -13.066 1.00 0.00 H new ATOM 752 N PRO A 47 2.615 -7.152 -10.771 1.00 0.00 N ATOM 753 CA PRO A 47 2.879 -7.645 -9.416 1.00 0.00 C ATOM 754 C PRO A 47 2.385 -6.681 -8.342 1.00 0.00 C ATOM 755 O PRO A 47 2.596 -5.472 -8.435 1.00 0.00 O ATOM 756 CB PRO A 47 4.405 -7.759 -9.371 1.00 0.00 C ATOM 757 CG PRO A 47 4.888 -6.779 -10.384 1.00 0.00 C ATOM 758 CD PRO A 47 3.850 -6.762 -11.472 1.00 0.00 C ATOM 0 HA PRO A 47 2.362 -8.583 -9.216 1.00 0.00 H new ATOM 0 HB2 PRO A 47 4.790 -7.525 -8.379 1.00 0.00 H new ATOM 0 HB3 PRO A 47 4.734 -8.770 -9.610 1.00 0.00 H new ATOM 0 HG2 PRO A 47 5.008 -5.789 -9.943 1.00 0.00 H new ATOM 0 HG3 PRO A 47 5.861 -7.072 -10.778 1.00 0.00 H new ATOM 0 HD2 PRO A 47 3.760 -5.775 -11.926 1.00 0.00 H new ATOM 0 HD3 PRO A 47 4.095 -7.460 -12.272 1.00 0.00 H new ATOM 766 N MET A 48 1.728 -7.225 -7.323 1.00 0.00 N ATOM 767 CA MET A 48 1.205 -6.412 -6.230 1.00 0.00 C ATOM 768 C MET A 48 1.021 -7.250 -4.969 1.00 0.00 C ATOM 769 O MET A 48 0.316 -8.260 -4.981 1.00 0.00 O ATOM 770 CB MET A 48 -0.126 -5.775 -6.632 1.00 0.00 C ATOM 771 CG MET A 48 -0.759 -4.943 -5.528 1.00 0.00 C ATOM 772 SD MET A 48 0.253 -3.527 -5.057 1.00 0.00 S ATOM 773 CE MET A 48 0.872 -3.008 -6.655 1.00 0.00 C ATOM 0 H MET A 48 1.545 -8.224 -7.231 1.00 0.00 H new ATOM 0 HA MET A 48 1.928 -5.624 -6.019 1.00 0.00 H new ATOM 0 HB2 MET A 48 0.032 -5.144 -7.506 1.00 0.00 H new ATOM 0 HB3 MET A 48 -0.821 -6.561 -6.928 1.00 0.00 H new ATOM 0 HG2 MET A 48 -1.737 -4.592 -5.858 1.00 0.00 H new ATOM 0 HG3 MET A 48 -0.925 -5.573 -4.654 1.00 0.00 H new ATOM 0 HE1 MET A 48 1.175 -1.962 -6.606 1.00 0.00 H new ATOM 0 HE2 MET A 48 1.730 -3.622 -6.930 1.00 0.00 H new ATOM 0 HE3 MET A 48 0.089 -3.124 -7.404 1.00 0.00 H new ATOM 783 N ASP A 49 1.659 -6.827 -3.884 1.00 0.00 N ATOM 784 CA ASP A 49 1.565 -7.538 -2.615 1.00 0.00 C ATOM 785 C ASP A 49 1.513 -6.559 -1.446 1.00 0.00 C ATOM 786 O ASP A 49 1.834 -5.380 -1.595 1.00 0.00 O ATOM 787 CB ASP A 49 2.752 -8.488 -2.449 1.00 0.00 C ATOM 788 CG ASP A 49 4.033 -7.921 -3.027 1.00 0.00 C ATOM 789 OD1 ASP A 49 4.344 -6.745 -2.740 1.00 0.00 O ATOM 790 OD2 ASP A 49 4.726 -8.652 -3.764 1.00 0.00 O ATOM 0 H ASP A 49 2.248 -5.994 -3.858 1.00 0.00 H new ATOM 0 HA ASP A 49 0.643 -8.119 -2.620 1.00 0.00 H new ATOM 0 HB2 ASP A 49 2.898 -8.701 -1.390 1.00 0.00 H new ATOM 0 HB3 ASP A 49 2.526 -9.436 -2.936 1.00 0.00 H new ATOM 795 N LEU A 50 1.107 -7.056 -0.282 1.00 0.00 N ATOM 796 CA LEU A 50 1.013 -6.226 0.913 1.00 0.00 C ATOM 797 C LEU A 50 2.368 -5.621 1.265 1.00 0.00 C ATOM 798 O LEU A 50 2.445 -4.591 1.934 1.00 0.00 O ATOM 799 CB LEU A 50 0.488 -7.049 2.090 1.00 0.00 C ATOM 800 CG LEU A 50 -0.909 -7.647 1.921 1.00 0.00 C ATOM 801 CD1 LEU A 50 -1.113 -8.807 2.883 1.00 0.00 C ATOM 802 CD2 LEU A 50 -1.975 -6.582 2.133 1.00 0.00 C ATOM 0 H LEU A 50 0.838 -8.030 -0.141 1.00 0.00 H new ATOM 0 HA LEU A 50 0.316 -5.414 0.706 1.00 0.00 H new ATOM 0 HB2 LEU A 50 1.189 -7.862 2.280 1.00 0.00 H new ATOM 0 HB3 LEU A 50 0.486 -6.416 2.977 1.00 0.00 H new ATOM 0 HG LEU A 50 -1.000 -8.026 0.903 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -2.113 -9.220 2.748 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -0.371 -9.580 2.683 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -1.002 -8.454 3.908 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -2.963 -7.026 2.009 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -1.885 -6.173 3.139 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -1.842 -5.783 1.403 1.00 0.00 H new ATOM 814 N SER A 51 3.436 -6.268 0.807 1.00 0.00 N ATOM 815 CA SER A 51 4.789 -5.795 1.075 1.00 0.00 C ATOM 816 C SER A 51 5.013 -4.415 0.464 1.00 0.00 C ATOM 817 O SER A 51 5.317 -3.452 1.169 1.00 0.00 O ATOM 818 CB SER A 51 5.816 -6.784 0.520 1.00 0.00 C ATOM 819 OG SER A 51 7.128 -6.252 0.594 1.00 0.00 O ATOM 0 H SER A 51 3.390 -7.121 0.249 1.00 0.00 H new ATOM 0 HA SER A 51 4.914 -5.719 2.155 1.00 0.00 H new ATOM 0 HB2 SER A 51 5.767 -7.717 1.081 1.00 0.00 H new ATOM 0 HB3 SER A 51 5.574 -7.021 -0.516 1.00 0.00 H new ATOM 0 HG SER A 51 7.766 -6.903 0.235 1.00 0.00 H new ATOM 825 N THR A 52 4.860 -4.326 -0.854 1.00 0.00 N ATOM 826 CA THR A 52 5.047 -3.066 -1.561 1.00 0.00 C ATOM 827 C THR A 52 4.085 -2.000 -1.049 1.00 0.00 C ATOM 828 O THR A 52 4.379 -0.806 -1.102 1.00 0.00 O ATOM 829 CB THR A 52 4.844 -3.237 -3.078 1.00 0.00 C ATOM 830 OG1 THR A 52 5.510 -2.184 -3.784 1.00 0.00 O ATOM 831 CG2 THR A 52 3.364 -3.234 -3.430 1.00 0.00 C ATOM 0 H THR A 52 4.607 -5.112 -1.453 1.00 0.00 H new ATOM 0 HA THR A 52 6.072 -2.748 -1.372 1.00 0.00 H new ATOM 0 HB THR A 52 5.269 -4.196 -3.373 1.00 0.00 H new ATOM 0 HG1 THR A 52 5.377 -2.301 -4.748 1.00 0.00 H new ATOM 0 HG21 THR A 52 3.246 -3.356 -4.507 1.00 0.00 H new ATOM 0 HG22 THR A 52 2.866 -4.055 -2.915 1.00 0.00 H new ATOM 0 HG23 THR A 52 2.918 -2.288 -3.121 1.00 0.00 H new ATOM 839 N VAL A 53 2.933 -2.439 -0.551 1.00 0.00 N ATOM 840 CA VAL A 53 1.927 -1.523 -0.027 1.00 0.00 C ATOM 841 C VAL A 53 2.409 -0.853 1.255 1.00 0.00 C ATOM 842 O VAL A 53 2.420 0.374 1.360 1.00 0.00 O ATOM 843 CB VAL A 53 0.598 -2.248 0.254 1.00 0.00 C ATOM 844 CG1 VAL A 53 -0.380 -1.318 0.954 1.00 0.00 C ATOM 845 CG2 VAL A 53 0.003 -2.788 -1.038 1.00 0.00 C ATOM 0 H VAL A 53 2.673 -3.424 -0.500 1.00 0.00 H new ATOM 0 HA VAL A 53 1.762 -0.764 -0.791 1.00 0.00 H new ATOM 0 HB VAL A 53 0.796 -3.091 0.916 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -1.313 -1.848 1.144 1.00 0.00 H new ATOM 0 HG12 VAL A 53 0.048 -0.985 1.900 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -0.577 -0.453 0.320 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -0.936 -3.297 -0.821 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -0.182 -1.963 -1.726 1.00 0.00 H new ATOM 0 HG23 VAL A 53 0.700 -3.491 -1.494 1.00 0.00 H new ATOM 855 N ILE A 54 2.807 -1.667 2.227 1.00 0.00 N ATOM 856 CA ILE A 54 3.292 -1.153 3.502 1.00 0.00 C ATOM 857 C ILE A 54 4.415 -0.142 3.297 1.00 0.00 C ATOM 858 O ILE A 54 4.475 0.884 3.976 1.00 0.00 O ATOM 859 CB ILE A 54 3.800 -2.289 4.411 1.00 0.00 C ATOM 860 CG1 ILE A 54 2.639 -3.194 4.829 1.00 0.00 C ATOM 861 CG2 ILE A 54 4.500 -1.716 5.634 1.00 0.00 C ATOM 862 CD1 ILE A 54 3.068 -4.378 5.667 1.00 0.00 C ATOM 0 H ILE A 54 2.803 -2.685 2.156 1.00 0.00 H new ATOM 0 HA ILE A 54 2.447 -0.662 3.985 1.00 0.00 H new ATOM 0 HB ILE A 54 4.520 -2.888 3.853 1.00 0.00 H new ATOM 0 HG12 ILE A 54 1.914 -2.605 5.391 1.00 0.00 H new ATOM 0 HG13 ILE A 54 2.131 -3.557 3.935 1.00 0.00 H new ATOM 0 HG21 ILE A 54 4.853 -2.531 6.266 1.00 0.00 H new ATOM 0 HG22 ILE A 54 5.348 -1.109 5.317 1.00 0.00 H new ATOM 0 HG23 ILE A 54 3.801 -1.097 6.197 1.00 0.00 H new ATOM 0 HD11 ILE A 54 2.194 -4.975 5.927 1.00 0.00 H new ATOM 0 HD12 ILE A 54 3.770 -4.989 5.100 1.00 0.00 H new ATOM 0 HD13 ILE A 54 3.549 -4.023 6.578 1.00 0.00 H new ATOM 874 N THR A 55 5.303 -0.436 2.352 1.00 0.00 N ATOM 875 CA THR A 55 6.424 0.448 2.056 1.00 0.00 C ATOM 876 C THR A 55 5.953 1.715 1.352 1.00 0.00 C ATOM 877 O THR A 55 6.182 2.826 1.832 1.00 0.00 O ATOM 878 CB THR A 55 7.475 -0.255 1.175 1.00 0.00 C ATOM 879 OG1 THR A 55 7.839 -1.512 1.755 1.00 0.00 O ATOM 880 CG2 THR A 55 8.713 0.614 1.014 1.00 0.00 C ATOM 0 H THR A 55 5.268 -1.279 1.779 1.00 0.00 H new ATOM 0 HA THR A 55 6.879 0.714 3.010 1.00 0.00 H new ATOM 0 HB THR A 55 7.039 -0.424 0.191 1.00 0.00 H new ATOM 0 HG1 THR A 55 7.108 -2.153 1.631 1.00 0.00 H new ATOM 0 HG21 THR A 55 9.441 0.098 0.389 1.00 0.00 H new ATOM 0 HG22 THR A 55 8.436 1.558 0.545 1.00 0.00 H new ATOM 0 HG23 THR A 55 9.150 0.810 1.993 1.00 0.00 H new ATOM 888 N LYS A 56 5.294 1.544 0.212 1.00 0.00 N ATOM 889 CA LYS A 56 4.788 2.674 -0.558 1.00 0.00 C ATOM 890 C LYS A 56 4.222 3.750 0.363 1.00 0.00 C ATOM 891 O LYS A 56 4.453 4.941 0.156 1.00 0.00 O ATOM 892 CB LYS A 56 3.710 2.208 -1.539 1.00 0.00 C ATOM 893 CG LYS A 56 4.266 1.706 -2.861 1.00 0.00 C ATOM 894 CD LYS A 56 3.155 1.294 -3.812 1.00 0.00 C ATOM 895 CE LYS A 56 2.485 2.504 -4.444 1.00 0.00 C ATOM 896 NZ LYS A 56 1.606 2.120 -5.583 1.00 0.00 N ATOM 0 H LYS A 56 5.097 0.632 -0.200 1.00 0.00 H new ATOM 0 HA LYS A 56 5.620 3.101 -1.118 1.00 0.00 H new ATOM 0 HB2 LYS A 56 3.127 1.413 -1.074 1.00 0.00 H new ATOM 0 HB3 LYS A 56 3.025 3.034 -1.733 1.00 0.00 H new ATOM 0 HG2 LYS A 56 4.871 2.487 -3.323 1.00 0.00 H new ATOM 0 HG3 LYS A 56 4.925 0.857 -2.681 1.00 0.00 H new ATOM 0 HD2 LYS A 56 3.563 0.653 -4.594 1.00 0.00 H new ATOM 0 HD3 LYS A 56 2.412 0.706 -3.273 1.00 0.00 H new ATOM 0 HE2 LYS A 56 1.896 3.027 -3.691 1.00 0.00 H new ATOM 0 HE3 LYS A 56 3.248 3.200 -4.793 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 1.807 2.733 -6.399 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 1.786 1.129 -5.842 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 0.610 2.230 -5.305 1.00 0.00 H new ATOM 910 N ILE A 57 3.481 3.322 1.379 1.00 0.00 N ATOM 911 CA ILE A 57 2.884 4.249 2.333 1.00 0.00 C ATOM 912 C ILE A 57 3.948 5.121 2.991 1.00 0.00 C ATOM 913 O ILE A 57 3.800 6.340 3.076 1.00 0.00 O ATOM 914 CB ILE A 57 2.099 3.503 3.428 1.00 0.00 C ATOM 915 CG1 ILE A 57 0.951 2.704 2.808 1.00 0.00 C ATOM 916 CG2 ILE A 57 1.570 4.485 4.463 1.00 0.00 C ATOM 917 CD1 ILE A 57 0.538 1.502 3.629 1.00 0.00 C ATOM 0 H ILE A 57 3.279 2.339 1.563 1.00 0.00 H new ATOM 0 HA ILE A 57 2.196 4.880 1.771 1.00 0.00 H new ATOM 0 HB ILE A 57 2.773 2.807 3.928 1.00 0.00 H new ATOM 0 HG12 ILE A 57 0.090 3.360 2.681 1.00 0.00 H new ATOM 0 HG13 ILE A 57 1.247 2.370 1.814 1.00 0.00 H new ATOM 0 HG21 ILE A 57 1.017 3.943 5.230 1.00 0.00 H new ATOM 0 HG22 ILE A 57 2.405 5.014 4.923 1.00 0.00 H new ATOM 0 HG23 ILE A 57 0.908 5.203 3.979 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -0.280 0.984 3.129 1.00 0.00 H new ATOM 0 HD12 ILE A 57 1.386 0.825 3.735 1.00 0.00 H new ATOM 0 HD13 ILE A 57 0.210 1.830 4.615 1.00 0.00 H new ATOM 929 N ASP A 58 5.021 4.488 3.453 1.00 0.00 N ATOM 930 CA ASP A 58 6.112 5.206 4.101 1.00 0.00 C ATOM 931 C ASP A 58 6.997 5.898 3.068 1.00 0.00 C ATOM 932 O ASP A 58 7.959 6.583 3.416 1.00 0.00 O ATOM 933 CB ASP A 58 6.951 4.248 4.948 1.00 0.00 C ATOM 934 CG ASP A 58 7.767 4.969 6.002 1.00 0.00 C ATOM 935 OD1 ASP A 58 7.184 5.370 7.031 1.00 0.00 O ATOM 936 OD2 ASP A 58 8.988 5.133 5.798 1.00 0.00 O ATOM 0 H ASP A 58 5.158 3.479 3.391 1.00 0.00 H new ATOM 0 HA ASP A 58 5.677 5.967 4.750 1.00 0.00 H new ATOM 0 HB2 ASP A 58 6.294 3.526 5.433 1.00 0.00 H new ATOM 0 HB3 ASP A 58 7.620 3.684 4.298 1.00 0.00 H new ATOM 941 N LYS A 59 6.665 5.714 1.794 1.00 0.00 N ATOM 942 CA LYS A 59 7.427 6.320 0.709 1.00 0.00 C ATOM 943 C LYS A 59 6.668 7.495 0.100 1.00 0.00 C ATOM 944 O LYS A 59 7.082 8.054 -0.916 1.00 0.00 O ATOM 945 CB LYS A 59 7.730 5.280 -0.371 1.00 0.00 C ATOM 946 CG LYS A 59 8.822 4.298 0.018 1.00 0.00 C ATOM 947 CD LYS A 59 10.146 5.004 0.261 1.00 0.00 C ATOM 948 CE LYS A 59 11.291 4.012 0.394 1.00 0.00 C ATOM 949 NZ LYS A 59 12.377 4.532 1.270 1.00 0.00 N ATOM 0 H LYS A 59 5.872 5.149 1.488 1.00 0.00 H new ATOM 0 HA LYS A 59 8.365 6.691 1.121 1.00 0.00 H new ATOM 0 HB2 LYS A 59 6.819 4.726 -0.596 1.00 0.00 H new ATOM 0 HB3 LYS A 59 8.025 5.794 -1.286 1.00 0.00 H new ATOM 0 HG2 LYS A 59 8.525 3.760 0.918 1.00 0.00 H new ATOM 0 HG3 LYS A 59 8.944 3.556 -0.771 1.00 0.00 H new ATOM 0 HD2 LYS A 59 10.351 5.689 -0.562 1.00 0.00 H new ATOM 0 HD3 LYS A 59 10.078 5.606 1.167 1.00 0.00 H new ATOM 0 HE2 LYS A 59 10.913 3.074 0.802 1.00 0.00 H new ATOM 0 HE3 LYS A 59 11.696 3.790 -0.593 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 13.138 3.827 1.335 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 12.755 5.414 0.868 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 11.997 4.720 2.220 1.00 0.00 H new ATOM 963 N HIS A 60 5.557 7.865 0.729 1.00 0.00 N ATOM 964 CA HIS A 60 4.742 8.975 0.249 1.00 0.00 C ATOM 965 C HIS A 60 4.182 8.678 -1.139 1.00 0.00 C ATOM 966 O HIS A 60 4.254 9.513 -2.039 1.00 0.00 O ATOM 967 CB HIS A 60 5.565 10.263 0.215 1.00 0.00 C ATOM 968 CG HIS A 60 5.534 11.028 1.502 1.00 0.00 C ATOM 969 ND1 HIS A 60 4.910 12.250 1.636 1.00 0.00 N ATOM 970 CD2 HIS A 60 6.054 10.737 2.718 1.00 0.00 C ATOM 971 CE1 HIS A 60 5.049 12.679 2.878 1.00 0.00 C ATOM 972 NE2 HIS A 60 5.738 11.779 3.555 1.00 0.00 N ATOM 0 H HIS A 60 5.201 7.413 1.571 1.00 0.00 H new ATOM 0 HA HIS A 60 3.907 9.105 0.938 1.00 0.00 H new ATOM 0 HB2 HIS A 60 6.599 10.017 -0.027 1.00 0.00 H new ATOM 0 HB3 HIS A 60 5.193 10.901 -0.586 1.00 0.00 H new ATOM 0 HD2 HIS A 60 6.613 9.851 2.981 1.00 0.00 H new ATOM 0 HE1 HIS A 60 4.664 13.608 3.272 1.00 0.00 H new ATOM 0 HE2 HIS A 60 5.994 11.847 4.540 1.00 0.00 H new ATOM 981 N ASN A 61 3.624 7.483 -1.303 1.00 0.00 N ATOM 982 CA ASN A 61 3.053 7.076 -2.582 1.00 0.00 C ATOM 983 C ASN A 61 1.532 7.191 -2.560 1.00 0.00 C ATOM 984 O ASN A 61 0.921 7.676 -3.512 1.00 0.00 O ATOM 985 CB ASN A 61 3.462 5.639 -2.912 1.00 0.00 C ATOM 986 CG ASN A 61 4.841 5.560 -3.539 1.00 0.00 C ATOM 987 OD1 ASN A 61 4.997 5.092 -4.666 1.00 0.00 O ATOM 988 ND2 ASN A 61 5.850 6.019 -2.807 1.00 0.00 N ATOM 0 H ASN A 61 3.555 6.780 -0.567 1.00 0.00 H new ATOM 0 HA ASN A 61 3.439 7.743 -3.353 1.00 0.00 H new ATOM 0 HB2 ASN A 61 3.445 5.041 -2.001 1.00 0.00 H new ATOM 0 HB3 ASN A 61 2.731 5.203 -3.593 1.00 0.00 H new ATOM 0 HD21 ASN A 61 6.801 5.992 -3.175 1.00 0.00 H new ATOM 0 HD22 ASN A 61 5.674 6.399 -1.877 1.00 0.00 H new ATOM 995 N TYR A 62 0.926 6.741 -1.466 1.00 0.00 N ATOM 996 CA TYR A 62 -0.524 6.792 -1.320 1.00 0.00 C ATOM 997 C TYR A 62 -0.955 8.067 -0.601 1.00 0.00 C ATOM 998 O TYR A 62 -0.729 8.224 0.599 1.00 0.00 O ATOM 999 CB TYR A 62 -1.023 5.567 -0.552 1.00 0.00 C ATOM 1000 CG TYR A 62 -0.770 4.259 -1.268 1.00 0.00 C ATOM 1001 CD1 TYR A 62 -1.443 3.945 -2.442 1.00 0.00 C ATOM 1002 CD2 TYR A 62 0.144 3.338 -0.770 1.00 0.00 C ATOM 1003 CE1 TYR A 62 -1.215 2.751 -3.098 1.00 0.00 C ATOM 1004 CE2 TYR A 62 0.379 2.142 -1.421 1.00 0.00 C ATOM 1005 CZ TYR A 62 -0.303 1.853 -2.584 1.00 0.00 C ATOM 1006 OH TYR A 62 -0.072 0.663 -3.236 1.00 0.00 O ATOM 0 H TYR A 62 1.416 6.337 -0.668 1.00 0.00 H new ATOM 0 HA TYR A 62 -0.964 6.792 -2.317 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -0.537 5.537 0.423 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -2.093 5.672 -0.372 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -2.157 4.646 -2.849 1.00 0.00 H new ATOM 0 HD2 TYR A 62 0.680 3.561 0.141 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -1.748 2.522 -4.009 1.00 0.00 H new ATOM 0 HE2 TYR A 62 1.093 1.437 -1.021 1.00 0.00 H new ATOM 0 HH TYR A 62 -0.074 0.815 -4.204 1.00 0.00 H new ATOM 1016 N LEU A 63 -1.578 8.975 -1.344 1.00 0.00 N ATOM 1017 CA LEU A 63 -2.043 10.237 -0.780 1.00 0.00 C ATOM 1018 C LEU A 63 -3.548 10.204 -0.539 1.00 0.00 C ATOM 1019 O LEU A 63 -4.091 11.037 0.188 1.00 0.00 O ATOM 1020 CB LEU A 63 -1.689 11.396 -1.713 1.00 0.00 C ATOM 1021 CG LEU A 63 -2.728 11.738 -2.782 1.00 0.00 C ATOM 1022 CD1 LEU A 63 -3.742 12.734 -2.242 1.00 0.00 C ATOM 1023 CD2 LEU A 63 -2.049 12.287 -4.028 1.00 0.00 C ATOM 0 H LEU A 63 -1.773 8.861 -2.339 1.00 0.00 H new ATOM 0 HA LEU A 63 -1.544 10.385 0.178 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -1.515 12.285 -1.106 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -0.748 11.161 -2.211 1.00 0.00 H new ATOM 0 HG LEU A 63 -3.257 10.824 -3.053 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -4.473 12.965 -3.017 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -4.251 12.304 -1.380 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -3.230 13.648 -1.942 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -2.803 12.525 -4.778 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -1.494 13.190 -3.772 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -1.363 11.540 -4.427 1.00 0.00 H new ATOM 1035 N THR A 64 -4.220 9.234 -1.152 1.00 0.00 N ATOM 1036 CA THR A 64 -5.663 9.091 -1.004 1.00 0.00 C ATOM 1037 C THR A 64 -6.035 7.673 -0.588 1.00 0.00 C ATOM 1038 O THR A 64 -5.448 6.702 -1.064 1.00 0.00 O ATOM 1039 CB THR A 64 -6.399 9.441 -2.310 1.00 0.00 C ATOM 1040 OG1 THR A 64 -5.585 9.099 -3.438 1.00 0.00 O ATOM 1041 CG2 THR A 64 -6.743 10.922 -2.358 1.00 0.00 C ATOM 0 H THR A 64 -3.787 8.535 -1.756 1.00 0.00 H new ATOM 0 HA THR A 64 -5.971 9.788 -0.225 1.00 0.00 H new ATOM 0 HB THR A 64 -7.325 8.868 -2.343 1.00 0.00 H new ATOM 0 HG1 THR A 64 -5.893 9.594 -4.226 1.00 0.00 H new ATOM 0 HG21 THR A 64 -7.262 11.145 -3.290 1.00 0.00 H new ATOM 0 HG22 THR A 64 -7.386 11.174 -1.515 1.00 0.00 H new ATOM 0 HG23 THR A 64 -5.827 11.510 -2.304 1.00 0.00 H new ATOM 1049 N ALA A 65 -7.014 7.560 0.303 1.00 0.00 N ATOM 1050 CA ALA A 65 -7.467 6.259 0.781 1.00 0.00 C ATOM 1051 C ALA A 65 -7.978 5.399 -0.370 1.00 0.00 C ATOM 1052 O ALA A 65 -7.871 4.173 -0.338 1.00 0.00 O ATOM 1053 CB ALA A 65 -8.550 6.432 1.835 1.00 0.00 C ATOM 0 H ALA A 65 -7.509 8.354 0.709 1.00 0.00 H new ATOM 0 HA ALA A 65 -6.616 5.748 1.231 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -8.879 5.453 2.183 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -8.152 7.001 2.675 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -9.396 6.966 1.403 1.00 0.00 H new ATOM 1059 N LYS A 66 -8.536 6.050 -1.386 1.00 0.00 N ATOM 1060 CA LYS A 66 -9.064 5.345 -2.548 1.00 0.00 C ATOM 1061 C LYS A 66 -7.933 4.805 -3.418 1.00 0.00 C ATOM 1062 O LYS A 66 -8.027 3.705 -3.962 1.00 0.00 O ATOM 1063 CB LYS A 66 -9.956 6.277 -3.373 1.00 0.00 C ATOM 1064 CG LYS A 66 -10.666 5.580 -4.521 1.00 0.00 C ATOM 1065 CD LYS A 66 -11.182 6.577 -5.544 1.00 0.00 C ATOM 1066 CE LYS A 66 -11.866 5.877 -6.708 1.00 0.00 C ATOM 1067 NZ LYS A 66 -10.892 5.150 -7.568 1.00 0.00 N ATOM 0 H LYS A 66 -8.634 7.064 -1.428 1.00 0.00 H new ATOM 0 HA LYS A 66 -9.658 4.503 -2.192 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -10.700 6.729 -2.717 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -9.348 7.089 -3.772 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -9.981 4.883 -5.004 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -11.498 4.992 -4.133 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -11.884 7.260 -5.066 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -10.354 7.180 -5.916 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -12.607 5.175 -6.325 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -12.403 6.611 -7.308 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -11.378 4.787 -8.412 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -10.133 5.799 -7.858 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -10.484 4.356 -7.035 1.00 0.00 H new ATOM 1081 N ASP A 67 -6.865 5.586 -3.543 1.00 0.00 N ATOM 1082 CA ASP A 67 -5.715 5.184 -4.344 1.00 0.00 C ATOM 1083 C ASP A 67 -4.960 4.039 -3.676 1.00 0.00 C ATOM 1084 O ASP A 67 -4.090 3.417 -4.285 1.00 0.00 O ATOM 1085 CB ASP A 67 -4.777 6.373 -4.559 1.00 0.00 C ATOM 1086 CG ASP A 67 -5.266 7.306 -5.650 1.00 0.00 C ATOM 1087 OD1 ASP A 67 -6.479 7.289 -5.947 1.00 0.00 O ATOM 1088 OD2 ASP A 67 -4.435 8.054 -6.207 1.00 0.00 O ATOM 0 H ASP A 67 -6.772 6.500 -3.100 1.00 0.00 H new ATOM 0 HA ASP A 67 -6.080 4.838 -5.311 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -4.680 6.929 -3.626 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -3.783 6.006 -4.817 1.00 0.00 H new ATOM 1093 N PHE A 68 -5.298 3.768 -2.420 1.00 0.00 N ATOM 1094 CA PHE A 68 -4.651 2.699 -1.668 1.00 0.00 C ATOM 1095 C PHE A 68 -5.415 1.387 -1.820 1.00 0.00 C ATOM 1096 O PHE A 68 -4.853 0.372 -2.232 1.00 0.00 O ATOM 1097 CB PHE A 68 -4.551 3.076 -0.188 1.00 0.00 C ATOM 1098 CG PHE A 68 -4.525 1.889 0.732 1.00 0.00 C ATOM 1099 CD1 PHE A 68 -3.356 1.173 0.928 1.00 0.00 C ATOM 1100 CD2 PHE A 68 -5.671 1.490 1.401 1.00 0.00 C ATOM 1101 CE1 PHE A 68 -3.328 0.081 1.775 1.00 0.00 C ATOM 1102 CE2 PHE A 68 -5.650 0.398 2.249 1.00 0.00 C ATOM 1103 CZ PHE A 68 -4.477 -0.308 2.435 1.00 0.00 C ATOM 0 H PHE A 68 -6.016 4.274 -1.901 1.00 0.00 H new ATOM 0 HA PHE A 68 -3.647 2.563 -2.070 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -3.648 3.667 -0.032 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -5.397 3.711 0.075 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -2.455 1.471 0.413 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -6.591 2.038 1.259 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -2.409 -0.467 1.920 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -6.550 0.097 2.765 1.00 0.00 H new ATOM 0 HZ PHE A 68 -4.459 -1.162 3.095 1.00 0.00 H new ATOM 1113 N LEU A 69 -6.700 1.416 -1.484 1.00 0.00 N ATOM 1114 CA LEU A 69 -7.543 0.230 -1.582 1.00 0.00 C ATOM 1115 C LEU A 69 -7.475 -0.373 -2.981 1.00 0.00 C ATOM 1116 O LEU A 69 -7.448 -1.593 -3.144 1.00 0.00 O ATOM 1117 CB LEU A 69 -8.991 0.579 -1.234 1.00 0.00 C ATOM 1118 CG LEU A 69 -9.341 0.588 0.254 1.00 0.00 C ATOM 1119 CD1 LEU A 69 -10.735 1.156 0.471 1.00 0.00 C ATOM 1120 CD2 LEU A 69 -9.238 -0.815 0.835 1.00 0.00 C ATOM 0 H LEU A 69 -7.181 2.248 -1.141 1.00 0.00 H new ATOM 0 HA LEU A 69 -7.173 -0.508 -0.870 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -9.215 1.563 -1.645 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -9.646 -0.133 -1.736 1.00 0.00 H new ATOM 0 HG LEU A 69 -8.626 1.227 0.772 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -10.967 1.154 1.536 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -10.775 2.177 0.092 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -11.464 0.544 -0.060 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -9.491 -0.789 1.895 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -9.929 -1.477 0.313 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -8.220 -1.185 0.713 1.00 0.00 H new ATOM 1132 N LYS A 70 -7.445 0.491 -3.991 1.00 0.00 N ATOM 1133 CA LYS A 70 -7.377 0.046 -5.378 1.00 0.00 C ATOM 1134 C LYS A 70 -6.267 -0.984 -5.564 1.00 0.00 C ATOM 1135 O LYS A 70 -6.458 -2.003 -6.227 1.00 0.00 O ATOM 1136 CB LYS A 70 -7.141 1.239 -6.307 1.00 0.00 C ATOM 1137 CG LYS A 70 -5.709 1.744 -6.297 1.00 0.00 C ATOM 1138 CD LYS A 70 -5.569 3.040 -7.077 1.00 0.00 C ATOM 1139 CE LYS A 70 -5.439 2.780 -8.570 1.00 0.00 C ATOM 1140 NZ LYS A 70 -4.092 2.255 -8.927 1.00 0.00 N ATOM 0 H LYS A 70 -7.467 1.504 -3.874 1.00 0.00 H new ATOM 0 HA LYS A 70 -8.329 -0.421 -5.631 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -7.410 0.955 -7.324 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -7.806 2.052 -6.016 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -5.385 1.901 -5.268 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -5.052 0.987 -6.726 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -6.436 3.673 -6.891 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -4.694 3.586 -6.724 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -6.201 2.066 -8.882 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -5.625 3.704 -9.117 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -3.965 2.298 -9.958 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -3.361 2.831 -8.463 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -4.008 1.268 -8.609 1.00 0.00 H new ATOM 1154 N ASP A 71 -5.108 -0.712 -4.974 1.00 0.00 N ATOM 1155 CA ASP A 71 -3.968 -1.616 -5.073 1.00 0.00 C ATOM 1156 C ASP A 71 -4.264 -2.941 -4.377 1.00 0.00 C ATOM 1157 O ASP A 71 -3.755 -3.989 -4.775 1.00 0.00 O ATOM 1158 CB ASP A 71 -2.724 -0.971 -4.462 1.00 0.00 C ATOM 1159 CG ASP A 71 -1.956 -0.130 -5.464 1.00 0.00 C ATOM 1160 OD1 ASP A 71 -2.599 0.640 -6.207 1.00 0.00 O ATOM 1161 OD2 ASP A 71 -0.713 -0.243 -5.504 1.00 0.00 O ATOM 0 H ASP A 71 -4.933 0.128 -4.422 1.00 0.00 H new ATOM 0 HA ASP A 71 -3.783 -1.814 -6.129 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -3.019 -0.347 -3.619 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -2.070 -1.750 -4.069 1.00 0.00 H new ATOM 1166 N ILE A 72 -5.088 -2.885 -3.336 1.00 0.00 N ATOM 1167 CA ILE A 72 -5.451 -4.081 -2.585 1.00 0.00 C ATOM 1168 C ILE A 72 -6.358 -4.991 -3.405 1.00 0.00 C ATOM 1169 O ILE A 72 -6.304 -6.215 -3.279 1.00 0.00 O ATOM 1170 CB ILE A 72 -6.159 -3.723 -1.265 1.00 0.00 C ATOM 1171 CG1 ILE A 72 -5.267 -2.820 -0.411 1.00 0.00 C ATOM 1172 CG2 ILE A 72 -6.528 -4.987 -0.503 1.00 0.00 C ATOM 1173 CD1 ILE A 72 -4.315 -3.583 0.484 1.00 0.00 C ATOM 0 H ILE A 72 -5.517 -2.025 -2.994 1.00 0.00 H new ATOM 0 HA ILE A 72 -4.523 -4.606 -2.359 1.00 0.00 H new ATOM 0 HB ILE A 72 -7.076 -3.181 -1.496 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -4.692 -2.167 -1.067 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -5.897 -2.179 0.205 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -7.028 -4.718 0.428 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -7.197 -5.596 -1.111 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -5.624 -5.554 -0.279 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -3.714 -2.879 1.060 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -4.884 -4.216 1.165 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -3.660 -4.204 -0.127 1.00 0.00 H new ATOM 1185 N ASP A 73 -7.189 -4.386 -4.247 1.00 0.00 N ATOM 1186 CA ASP A 73 -8.107 -5.142 -5.091 1.00 0.00 C ATOM 1187 C ASP A 73 -7.350 -5.884 -6.188 1.00 0.00 C ATOM 1188 O ASP A 73 -7.859 -6.844 -6.769 1.00 0.00 O ATOM 1189 CB ASP A 73 -9.147 -4.210 -5.713 1.00 0.00 C ATOM 1190 CG ASP A 73 -10.348 -4.961 -6.254 1.00 0.00 C ATOM 1191 OD1 ASP A 73 -10.278 -6.204 -6.348 1.00 0.00 O ATOM 1192 OD2 ASP A 73 -11.359 -4.305 -6.581 1.00 0.00 O ATOM 0 H ASP A 73 -7.246 -3.374 -4.363 1.00 0.00 H new ATOM 0 HA ASP A 73 -8.616 -5.875 -4.466 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -9.479 -3.490 -4.965 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -8.685 -3.641 -6.520 1.00 0.00 H new ATOM 1197 N LEU A 74 -6.132 -5.433 -6.468 1.00 0.00 N ATOM 1198 CA LEU A 74 -5.304 -6.053 -7.497 1.00 0.00 C ATOM 1199 C LEU A 74 -4.610 -7.301 -6.959 1.00 0.00 C ATOM 1200 O LEU A 74 -4.310 -8.229 -7.711 1.00 0.00 O ATOM 1201 CB LEU A 74 -4.263 -5.058 -8.010 1.00 0.00 C ATOM 1202 CG LEU A 74 -3.209 -5.621 -8.964 1.00 0.00 C ATOM 1203 CD1 LEU A 74 -3.868 -6.207 -10.203 1.00 0.00 C ATOM 1204 CD2 LEU A 74 -2.208 -4.541 -9.350 1.00 0.00 C ATOM 0 H LEU A 74 -5.696 -4.640 -5.997 1.00 0.00 H new ATOM 0 HA LEU A 74 -5.953 -6.348 -8.322 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -4.785 -4.245 -8.516 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -3.752 -4.623 -7.151 1.00 0.00 H new ATOM 0 HG LEU A 74 -2.673 -6.420 -8.451 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -3.102 -6.603 -10.870 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -4.544 -7.010 -9.910 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -4.431 -5.429 -10.718 1.00 0.00 H new ATOM 0 HD21 LEU A 74 -1.465 -4.959 -10.029 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -2.730 -3.721 -9.843 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -1.711 -4.168 -8.454 1.00 0.00 H new ATOM 1216 N ILE A 75 -4.361 -7.316 -5.654 1.00 0.00 N ATOM 1217 CA ILE A 75 -3.705 -8.451 -5.016 1.00 0.00 C ATOM 1218 C ILE A 75 -4.571 -9.703 -5.099 1.00 0.00 C ATOM 1219 O ILE A 75 -4.057 -10.820 -5.187 1.00 0.00 O ATOM 1220 CB ILE A 75 -3.387 -8.158 -3.537 1.00 0.00 C ATOM 1221 CG1 ILE A 75 -2.382 -7.010 -3.427 1.00 0.00 C ATOM 1222 CG2 ILE A 75 -2.850 -9.407 -2.854 1.00 0.00 C ATOM 1223 CD1 ILE A 75 -2.129 -6.563 -2.004 1.00 0.00 C ATOM 0 H ILE A 75 -4.603 -6.556 -5.018 1.00 0.00 H new ATOM 0 HA ILE A 75 -2.772 -8.620 -5.554 1.00 0.00 H new ATOM 0 HB ILE A 75 -4.307 -7.860 -3.034 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -1.438 -7.320 -3.875 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -2.747 -6.162 -4.006 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -2.630 -9.185 -1.810 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -3.596 -10.200 -2.907 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -1.939 -9.733 -3.356 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -1.407 -5.747 -2.002 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -3.063 -6.222 -1.558 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -1.734 -7.398 -1.425 1.00 0.00 H new ATOM 1235 N CYS A 76 -5.885 -9.511 -5.074 1.00 0.00 N ATOM 1236 CA CYS A 76 -6.822 -10.626 -5.148 1.00 0.00 C ATOM 1237 C CYS A 76 -6.915 -11.165 -6.572 1.00 0.00 C ATOM 1238 O CYS A 76 -7.232 -12.335 -6.784 1.00 0.00 O ATOM 1239 CB CYS A 76 -8.206 -10.189 -4.664 1.00 0.00 C ATOM 1240 SG CYS A 76 -9.467 -11.480 -4.770 1.00 0.00 S ATOM 0 H CYS A 76 -6.326 -8.594 -5.003 1.00 0.00 H new ATOM 0 HA CYS A 76 -6.453 -11.422 -4.501 1.00 0.00 H new ATOM 0 HB2 CYS A 76 -8.129 -9.856 -3.629 1.00 0.00 H new ATOM 0 HB3 CYS A 76 -8.530 -9.330 -5.252 1.00 0.00 H new ATOM 0 HG CYS A 76 -10.601 -11.015 -4.337 1.00 0.00 H new ATOM 1246 N SER A 77 -6.637 -10.303 -7.544 1.00 0.00 N ATOM 1247 CA SER A 77 -6.694 -10.690 -8.949 1.00 0.00 C ATOM 1248 C SER A 77 -5.617 -11.722 -9.272 1.00 0.00 C ATOM 1249 O SER A 77 -5.918 -12.873 -9.581 1.00 0.00 O ATOM 1250 CB SER A 77 -6.526 -9.462 -9.846 1.00 0.00 C ATOM 1251 OG SER A 77 -6.656 -9.809 -11.214 1.00 0.00 O ATOM 0 H SER A 77 -6.370 -9.332 -7.385 1.00 0.00 H new ATOM 0 HA SER A 77 -7.670 -11.137 -9.138 1.00 0.00 H new ATOM 0 HB2 SER A 77 -7.273 -8.712 -9.585 1.00 0.00 H new ATOM 0 HB3 SER A 77 -5.548 -9.012 -9.673 1.00 0.00 H new ATOM 0 HG SER A 77 -6.546 -9.007 -11.767 1.00 0.00 H new ATOM 1257 N ASN A 78 -4.359 -11.298 -9.198 1.00 0.00 N ATOM 1258 CA ASN A 78 -3.236 -12.183 -9.483 1.00 0.00 C ATOM 1259 C ASN A 78 -3.205 -13.355 -8.505 1.00 0.00 C ATOM 1260 O ASN A 78 -2.706 -14.432 -8.827 1.00 0.00 O ATOM 1261 CB ASN A 78 -1.918 -11.410 -9.410 1.00 0.00 C ATOM 1262 CG ASN A 78 -1.920 -10.367 -8.310 1.00 0.00 C ATOM 1263 OD1 ASN A 78 -2.524 -10.562 -7.255 1.00 0.00 O ATOM 1264 ND2 ASN A 78 -1.242 -9.251 -8.551 1.00 0.00 N ATOM 0 H ASN A 78 -4.092 -10.347 -8.943 1.00 0.00 H new ATOM 0 HA ASN A 78 -3.363 -12.576 -10.492 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -1.099 -12.109 -9.243 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -1.732 -10.924 -10.368 1.00 0.00 H new ATOM 0 HD21 ASN A 78 -1.207 -8.513 -7.847 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -0.756 -9.131 -9.440 1.00 0.00 H new ATOM 1271 N ALA A 79 -3.743 -13.135 -7.310 1.00 0.00 N ATOM 1272 CA ALA A 79 -3.780 -14.172 -6.286 1.00 0.00 C ATOM 1273 C ALA A 79 -4.770 -15.272 -6.655 1.00 0.00 C ATOM 1274 O ALA A 79 -4.748 -16.360 -6.078 1.00 0.00 O ATOM 1275 CB ALA A 79 -4.137 -13.569 -4.936 1.00 0.00 C ATOM 0 H ALA A 79 -4.159 -12.248 -7.027 1.00 0.00 H new ATOM 0 HA ALA A 79 -2.788 -14.619 -6.220 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -4.161 -14.355 -4.181 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -3.390 -12.825 -4.661 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -5.116 -13.095 -4.997 1.00 0.00 H new ATOM 1281 N LEU A 80 -5.638 -14.982 -7.618 1.00 0.00 N ATOM 1282 CA LEU A 80 -6.637 -15.947 -8.063 1.00 0.00 C ATOM 1283 C LEU A 80 -6.383 -16.367 -9.508 1.00 0.00 C ATOM 1284 O LEU A 80 -5.907 -17.470 -9.768 1.00 0.00 O ATOM 1285 CB LEU A 80 -8.041 -15.355 -7.931 1.00 0.00 C ATOM 1286 CG LEU A 80 -8.512 -15.056 -6.507 1.00 0.00 C ATOM 1287 CD1 LEU A 80 -9.720 -14.133 -6.528 1.00 0.00 C ATOM 1288 CD2 LEU A 80 -8.837 -16.347 -5.770 1.00 0.00 C ATOM 0 H LEU A 80 -5.670 -14.087 -8.105 1.00 0.00 H new ATOM 0 HA LEU A 80 -6.561 -16.830 -7.429 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -8.079 -14.430 -8.507 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -8.749 -16.045 -8.389 1.00 0.00 H new ATOM 0 HG LEU A 80 -7.704 -14.552 -5.976 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -10.041 -13.931 -5.506 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -9.453 -13.196 -7.016 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -10.533 -14.610 -7.076 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -9.170 -16.115 -4.759 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -9.627 -16.879 -6.299 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -7.946 -16.973 -5.723 1.00 0.00 H new ATOM 1300 N GLU A 81 -6.704 -15.476 -10.442 1.00 0.00 N ATOM 1301 CA GLU A 81 -6.509 -15.755 -11.860 1.00 0.00 C ATOM 1302 C GLU A 81 -5.254 -16.594 -12.082 1.00 0.00 C ATOM 1303 O GLU A 81 -5.335 -17.761 -12.465 1.00 0.00 O ATOM 1304 CB GLU A 81 -6.408 -14.448 -12.649 1.00 0.00 C ATOM 1305 CG GLU A 81 -6.717 -14.605 -14.129 1.00 0.00 C ATOM 1306 CD GLU A 81 -6.445 -13.341 -14.920 1.00 0.00 C ATOM 1307 OE1 GLU A 81 -6.790 -12.246 -14.427 1.00 0.00 O ATOM 1308 OE2 GLU A 81 -5.886 -13.446 -16.031 1.00 0.00 O ATOM 0 H GLU A 81 -7.099 -14.557 -10.242 1.00 0.00 H new ATOM 0 HA GLU A 81 -7.370 -16.321 -12.215 1.00 0.00 H new ATOM 0 HB2 GLU A 81 -7.095 -13.719 -12.218 1.00 0.00 H new ATOM 0 HB3 GLU A 81 -5.402 -14.043 -12.537 1.00 0.00 H new ATOM 0 HG2 GLU A 81 -6.119 -15.420 -14.537 1.00 0.00 H new ATOM 0 HG3 GLU A 81 -7.763 -14.886 -14.250 1.00 0.00 H new ATOM 1315 N TYR A 82 -4.096 -15.991 -11.840 1.00 0.00 N ATOM 1316 CA TYR A 82 -2.823 -16.681 -12.016 1.00 0.00 C ATOM 1317 C TYR A 82 -2.794 -17.982 -11.221 1.00 0.00 C ATOM 1318 O TYR A 82 -2.287 -18.999 -11.693 1.00 0.00 O ATOM 1319 CB TYR A 82 -1.666 -15.779 -11.582 1.00 0.00 C ATOM 1320 CG TYR A 82 -1.115 -14.921 -12.698 1.00 0.00 C ATOM 1321 CD1 TYR A 82 -1.749 -13.743 -13.073 1.00 0.00 C ATOM 1322 CD2 TYR A 82 0.039 -15.289 -13.380 1.00 0.00 C ATOM 1323 CE1 TYR A 82 -1.249 -12.956 -14.092 1.00 0.00 C ATOM 1324 CE2 TYR A 82 0.546 -14.508 -14.400 1.00 0.00 C ATOM 1325 CZ TYR A 82 -0.102 -13.342 -14.752 1.00 0.00 C ATOM 1326 OH TYR A 82 0.400 -12.562 -15.769 1.00 0.00 O ATOM 0 H TYR A 82 -4.012 -15.026 -11.521 1.00 0.00 H new ATOM 0 HA TYR A 82 -2.712 -16.920 -13.074 1.00 0.00 H new ATOM 0 HB2 TYR A 82 -2.004 -15.133 -10.772 1.00 0.00 H new ATOM 0 HB3 TYR A 82 -0.864 -16.399 -11.182 1.00 0.00 H new ATOM 0 HD1 TYR A 82 -2.648 -13.437 -12.559 1.00 0.00 H new ATOM 0 HD2 TYR A 82 0.548 -16.202 -13.107 1.00 0.00 H new ATOM 0 HE1 TYR A 82 -1.754 -12.043 -14.370 1.00 0.00 H new ATOM 0 HE2 TYR A 82 1.444 -14.808 -14.919 1.00 0.00 H new ATOM 0 HH TYR A 82 1.213 -12.976 -16.128 1.00 0.00 H new ATOM 1431 N ASP A 90 -6.210 -24.738 -3.607 1.00 0.00 N ATOM 1432 CA ASP A 90 -6.859 -23.598 -4.244 1.00 0.00 C ATOM 1433 C ASP A 90 -8.175 -23.265 -3.550 1.00 0.00 C ATOM 1434 O ASP A 90 -8.509 -22.096 -3.355 1.00 0.00 O ATOM 1435 CB ASP A 90 -7.107 -23.888 -5.725 1.00 0.00 C ATOM 1436 CG ASP A 90 -7.931 -22.807 -6.396 1.00 0.00 C ATOM 1437 OD1 ASP A 90 -9.024 -22.488 -5.883 1.00 0.00 O ATOM 1438 OD2 ASP A 90 -7.481 -22.278 -7.434 1.00 0.00 O ATOM 0 HA ASP A 90 -6.196 -22.737 -4.157 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -6.150 -23.983 -6.239 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -7.619 -24.845 -5.824 1.00 0.00 H new ATOM 1443 N LYS A 91 -8.922 -24.300 -3.179 1.00 0.00 N ATOM 1444 CA LYS A 91 -10.203 -24.119 -2.507 1.00 0.00 C ATOM 1445 C LYS A 91 -10.090 -23.082 -1.393 1.00 0.00 C ATOM 1446 O LYS A 91 -10.968 -22.233 -1.233 1.00 0.00 O ATOM 1447 CB LYS A 91 -10.693 -25.449 -1.931 1.00 0.00 C ATOM 1448 CG LYS A 91 -11.114 -26.452 -2.992 1.00 0.00 C ATOM 1449 CD LYS A 91 -12.571 -26.272 -3.382 1.00 0.00 C ATOM 1450 CE LYS A 91 -13.505 -26.878 -2.346 1.00 0.00 C ATOM 1451 NZ LYS A 91 -14.883 -27.058 -2.879 1.00 0.00 N ATOM 0 H LYS A 91 -8.661 -25.274 -3.333 1.00 0.00 H new ATOM 0 HA LYS A 91 -10.924 -23.761 -3.242 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -9.901 -25.886 -1.323 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -11.536 -25.259 -1.267 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -10.483 -26.337 -3.874 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -10.959 -27.464 -2.619 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -12.790 -25.210 -3.494 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -12.749 -26.738 -4.351 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -13.112 -27.842 -2.023 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -13.537 -26.235 -1.466 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -15.489 -27.473 -2.143 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -15.268 -26.135 -3.164 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -14.856 -27.692 -3.703 1.00 0.00 H new ATOM 1465 N ILE A 92 -9.006 -23.156 -0.629 1.00 0.00 N ATOM 1466 CA ILE A 92 -8.779 -22.222 0.467 1.00 0.00 C ATOM 1467 C ILE A 92 -8.446 -20.830 -0.058 1.00 0.00 C ATOM 1468 O ILE A 92 -9.264 -19.913 0.022 1.00 0.00 O ATOM 1469 CB ILE A 92 -7.639 -22.699 1.386 1.00 0.00 C ATOM 1470 CG1 ILE A 92 -8.017 -24.019 2.061 1.00 0.00 C ATOM 1471 CG2 ILE A 92 -7.320 -21.638 2.428 1.00 0.00 C ATOM 1472 CD1 ILE A 92 -7.663 -25.240 1.241 1.00 0.00 C ATOM 0 H ILE A 92 -8.271 -23.853 -0.749 1.00 0.00 H new ATOM 0 HA ILE A 92 -9.704 -22.179 1.042 1.00 0.00 H new ATOM 0 HB ILE A 92 -6.749 -22.865 0.780 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -7.514 -24.081 3.026 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -9.089 -24.023 2.259 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -6.512 -21.990 3.070 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -7.013 -20.719 1.929 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -8.206 -21.444 3.033 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -7.959 -26.139 1.781 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -8.187 -25.201 0.286 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -6.588 -25.261 1.065 1.00 0.00 H new ATOM 1484 N ILE A 93 -7.240 -20.679 -0.596 1.00 0.00 N ATOM 1485 CA ILE A 93 -6.800 -19.399 -1.136 1.00 0.00 C ATOM 1486 C ILE A 93 -7.935 -18.693 -1.871 1.00 0.00 C ATOM 1487 O ILE A 93 -8.223 -17.525 -1.612 1.00 0.00 O ATOM 1488 CB ILE A 93 -5.611 -19.574 -2.099 1.00 0.00 C ATOM 1489 CG1 ILE A 93 -4.399 -20.133 -1.351 1.00 0.00 C ATOM 1490 CG2 ILE A 93 -5.266 -18.249 -2.762 1.00 0.00 C ATOM 1491 CD1 ILE A 93 -3.460 -20.928 -2.231 1.00 0.00 C ATOM 0 H ILE A 93 -6.551 -21.427 -0.669 1.00 0.00 H new ATOM 0 HA ILE A 93 -6.485 -18.790 -0.289 1.00 0.00 H new ATOM 0 HB ILE A 93 -5.894 -20.284 -2.876 1.00 0.00 H new ATOM 0 HG12 ILE A 93 -3.849 -19.308 -0.899 1.00 0.00 H new ATOM 0 HG13 ILE A 93 -4.746 -20.769 -0.537 1.00 0.00 H new ATOM 0 HG21 ILE A 93 -4.424 -18.390 -3.439 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -6.127 -17.888 -3.324 1.00 0.00 H new ATOM 0 HG23 ILE A 93 -4.999 -17.519 -1.998 1.00 0.00 H new ATOM 0 HD11 ILE A 93 -2.624 -21.293 -1.634 1.00 0.00 H new ATOM 0 HD12 ILE A 93 -3.995 -21.774 -2.663 1.00 0.00 H new ATOM 0 HD13 ILE A 93 -3.083 -20.290 -3.031 1.00 0.00 H new ATOM 1503 N ARG A 94 -8.577 -19.411 -2.786 1.00 0.00 N ATOM 1504 CA ARG A 94 -9.681 -18.854 -3.558 1.00 0.00 C ATOM 1505 C ARG A 94 -10.578 -17.989 -2.677 1.00 0.00 C ATOM 1506 O ARG A 94 -10.907 -16.856 -3.031 1.00 0.00 O ATOM 1507 CB ARG A 94 -10.503 -19.975 -4.196 1.00 0.00 C ATOM 1508 CG ARG A 94 -11.633 -19.475 -5.080 1.00 0.00 C ATOM 1509 CD ARG A 94 -12.909 -19.256 -4.282 1.00 0.00 C ATOM 1510 NE ARG A 94 -14.089 -19.200 -5.142 1.00 0.00 N ATOM 1511 CZ ARG A 94 -15.319 -19.472 -4.720 1.00 0.00 C ATOM 1512 NH1 ARG A 94 -15.529 -19.817 -3.457 1.00 0.00 N ATOM 1513 NH2 ARG A 94 -16.342 -19.399 -5.562 1.00 0.00 N ATOM 0 H ARG A 94 -8.352 -20.380 -3.011 1.00 0.00 H new ATOM 0 HA ARG A 94 -9.261 -18.228 -4.345 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -9.842 -20.607 -4.789 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -10.920 -20.602 -3.408 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -11.337 -18.541 -5.558 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -11.820 -20.196 -5.876 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -13.026 -20.062 -3.557 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -12.828 -18.328 -3.716 1.00 0.00 H new ATOM 0 HE ARG A 94 -13.961 -18.938 -6.119 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -14.745 -19.874 -2.807 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -16.474 -20.025 -3.136 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -16.184 -19.134 -6.534 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -17.286 -19.608 -5.237 1.00 0.00 H new ATOM 1527 N HIS A 95 -10.970 -18.531 -1.528 1.00 0.00 N ATOM 1528 CA HIS A 95 -11.829 -17.809 -0.596 1.00 0.00 C ATOM 1529 C HIS A 95 -11.045 -16.726 0.138 1.00 0.00 C ATOM 1530 O HIS A 95 -11.374 -15.542 0.053 1.00 0.00 O ATOM 1531 CB HIS A 95 -12.450 -18.776 0.411 1.00 0.00 C ATOM 1532 CG HIS A 95 -13.794 -18.341 0.910 1.00 0.00 C ATOM 1533 ND1 HIS A 95 -14.012 -17.123 1.519 1.00 0.00 N ATOM 1534 CD2 HIS A 95 -14.993 -18.968 0.886 1.00 0.00 C ATOM 1535 CE1 HIS A 95 -15.287 -17.021 1.849 1.00 0.00 C ATOM 1536 NE2 HIS A 95 -15.904 -18.127 1.475 1.00 0.00 N ATOM 0 H HIS A 95 -10.707 -19.467 -1.220 1.00 0.00 H new ATOM 0 HA HIS A 95 -12.624 -17.332 -1.169 1.00 0.00 H new ATOM 0 HB2 HIS A 95 -12.544 -19.758 -0.052 1.00 0.00 H new ATOM 0 HB3 HIS A 95 -11.775 -18.887 1.260 1.00 0.00 H new ATOM 0 HD2 HIS A 95 -15.195 -19.948 0.479 1.00 0.00 H new ATOM 0 HE1 HIS A 95 -15.747 -16.177 2.341 1.00 0.00 H new ATOM 0 HE2 HIS A 95 -16.897 -18.324 1.603 1.00 0.00 H new ATOM 1545 N ARG A 96 -10.007 -17.138 0.858 1.00 0.00 N ATOM 1546 CA ARG A 96 -9.177 -16.203 1.608 1.00 0.00 C ATOM 1547 C ARG A 96 -9.052 -14.874 0.869 1.00 0.00 C ATOM 1548 O ARG A 96 -9.321 -13.813 1.431 1.00 0.00 O ATOM 1549 CB ARG A 96 -7.789 -16.799 1.848 1.00 0.00 C ATOM 1550 CG ARG A 96 -7.781 -17.942 2.850 1.00 0.00 C ATOM 1551 CD ARG A 96 -7.580 -17.436 4.270 1.00 0.00 C ATOM 1552 NE ARG A 96 -8.623 -16.494 4.668 1.00 0.00 N ATOM 1553 CZ ARG A 96 -9.816 -16.865 5.118 1.00 0.00 C ATOM 1554 NH1 ARG A 96 -10.116 -18.152 5.227 1.00 0.00 N ATOM 1555 NH2 ARG A 96 -10.712 -15.949 5.460 1.00 0.00 N ATOM 0 H ARG A 96 -9.721 -18.114 0.938 1.00 0.00 H new ATOM 0 HA ARG A 96 -9.657 -16.020 2.570 1.00 0.00 H new ATOM 0 HB2 ARG A 96 -7.387 -17.156 0.900 1.00 0.00 H new ATOM 0 HB3 ARG A 96 -7.122 -16.013 2.201 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -8.722 -18.489 2.787 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -6.986 -18.644 2.597 1.00 0.00 H new ATOM 0 HD2 ARG A 96 -7.573 -18.281 4.958 1.00 0.00 H new ATOM 0 HD3 ARG A 96 -6.606 -16.953 4.348 1.00 0.00 H new ATOM 0 HE ARG A 96 -8.424 -15.496 4.596 1.00 0.00 H new ATOM 0 HH11 ARG A 96 -9.430 -18.860 4.965 1.00 0.00 H new ATOM 0 HH12 ARG A 96 -11.033 -18.434 5.573 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -10.485 -14.958 5.378 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -11.628 -16.236 5.805 1.00 0.00 H new ATOM 1569 N ALA A 97 -8.641 -14.941 -0.393 1.00 0.00 N ATOM 1570 CA ALA A 97 -8.481 -13.744 -1.209 1.00 0.00 C ATOM 1571 C ALA A 97 -9.744 -12.889 -1.182 1.00 0.00 C ATOM 1572 O ALA A 97 -9.721 -11.746 -0.724 1.00 0.00 O ATOM 1573 CB ALA A 97 -8.129 -14.123 -2.639 1.00 0.00 C ATOM 0 H ALA A 97 -8.413 -15.812 -0.872 1.00 0.00 H new ATOM 0 HA ALA A 97 -7.665 -13.155 -0.790 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -8.013 -13.219 -3.237 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -7.196 -14.686 -2.647 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -8.926 -14.736 -3.060 1.00 0.00 H new ATOM 1579 N CYS A 98 -10.842 -13.449 -1.676 1.00 0.00 N ATOM 1580 CA CYS A 98 -12.115 -12.737 -1.710 1.00 0.00 C ATOM 1581 C CYS A 98 -12.385 -12.043 -0.379 1.00 0.00 C ATOM 1582 O CYS A 98 -12.718 -10.858 -0.339 1.00 0.00 O ATOM 1583 CB CYS A 98 -13.255 -13.702 -2.037 1.00 0.00 C ATOM 1584 SG CYS A 98 -13.267 -14.276 -3.751 1.00 0.00 S ATOM 0 H CYS A 98 -10.877 -14.394 -2.059 1.00 0.00 H new ATOM 0 HA CYS A 98 -12.058 -11.978 -2.490 1.00 0.00 H new ATOM 0 HB2 CYS A 98 -13.186 -14.566 -1.376 1.00 0.00 H new ATOM 0 HB3 CYS A 98 -14.205 -13.212 -1.823 1.00 0.00 H new ATOM 0 HG CYS A 98 -12.441 -15.272 -3.881 1.00 0.00 H new ATOM 1590 N THR A 99 -12.241 -12.789 0.712 1.00 0.00 N ATOM 1591 CA THR A 99 -12.473 -12.248 2.045 1.00 0.00 C ATOM 1592 C THR A 99 -11.567 -11.052 2.318 1.00 0.00 C ATOM 1593 O THR A 99 -12.039 -9.970 2.669 1.00 0.00 O ATOM 1594 CB THR A 99 -12.239 -13.313 3.133 1.00 0.00 C ATOM 1595 OG1 THR A 99 -13.184 -14.379 2.986 1.00 0.00 O ATOM 1596 CG2 THR A 99 -12.364 -12.705 4.521 1.00 0.00 C ATOM 0 H THR A 99 -11.964 -13.771 0.698 1.00 0.00 H new ATOM 0 HA THR A 99 -13.514 -11.928 2.079 1.00 0.00 H new ATOM 0 HB THR A 99 -11.229 -13.705 3.016 1.00 0.00 H new ATOM 0 HG1 THR A 99 -12.866 -15.006 2.304 1.00 0.00 H new ATOM 0 HG21 THR A 99 -12.195 -13.476 5.273 1.00 0.00 H new ATOM 0 HG22 THR A 99 -11.624 -11.914 4.640 1.00 0.00 H new ATOM 0 HG23 THR A 99 -13.363 -12.289 4.647 1.00 0.00 H new ATOM 1604 N LEU A 100 -10.264 -11.254 2.153 1.00 0.00 N ATOM 1605 CA LEU A 100 -9.291 -10.191 2.380 1.00 0.00 C ATOM 1606 C LEU A 100 -9.820 -8.851 1.877 1.00 0.00 C ATOM 1607 O LEU A 100 -10.058 -7.932 2.660 1.00 0.00 O ATOM 1608 CB LEU A 100 -7.970 -10.524 1.685 1.00 0.00 C ATOM 1609 CG LEU A 100 -7.007 -9.355 1.477 1.00 0.00 C ATOM 1610 CD1 LEU A 100 -6.198 -9.098 2.739 1.00 0.00 C ATOM 1611 CD2 LEU A 100 -6.086 -9.626 0.296 1.00 0.00 C ATOM 0 H LEU A 100 -9.857 -12.143 1.863 1.00 0.00 H new ATOM 0 HA LEU A 100 -9.120 -10.113 3.454 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -7.459 -11.290 2.268 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -8.195 -10.961 0.712 1.00 0.00 H new ATOM 0 HG LEU A 100 -7.592 -8.462 1.258 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -5.518 -8.263 2.572 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -6.872 -8.858 3.561 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -5.623 -9.989 2.990 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -5.408 -8.783 0.163 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -5.508 -10.531 0.485 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -6.682 -9.758 -0.607 1.00 0.00 H new ATOM 1623 N LYS A 101 -10.003 -8.749 0.565 1.00 0.00 N ATOM 1624 CA LYS A 101 -10.508 -7.524 -0.044 1.00 0.00 C ATOM 1625 C LYS A 101 -11.642 -6.931 0.786 1.00 0.00 C ATOM 1626 O LYS A 101 -11.566 -5.786 1.231 1.00 0.00 O ATOM 1627 CB LYS A 101 -10.994 -7.801 -1.468 1.00 0.00 C ATOM 1628 CG LYS A 101 -11.057 -6.559 -2.341 1.00 0.00 C ATOM 1629 CD LYS A 101 -12.100 -6.701 -3.437 1.00 0.00 C ATOM 1630 CE LYS A 101 -13.502 -6.431 -2.911 1.00 0.00 C ATOM 1631 NZ LYS A 101 -13.720 -4.985 -2.632 1.00 0.00 N ATOM 0 H LYS A 101 -9.809 -9.500 -0.097 1.00 0.00 H new ATOM 0 HA LYS A 101 -9.692 -6.802 -0.079 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -10.331 -8.529 -1.934 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -11.984 -8.254 -1.423 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -11.291 -5.691 -1.725 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -10.080 -6.378 -2.789 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -11.875 -6.008 -4.247 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -12.055 -7.706 -3.856 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -14.236 -6.775 -3.640 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -13.665 -7.006 -1.999 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -13.801 -4.838 -1.606 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -12.917 -4.436 -2.999 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -14.595 -4.670 -3.097 1.00 0.00 H new ATOM 1645 N ASP A 102 -12.693 -7.718 0.990 1.00 0.00 N ATOM 1646 CA ASP A 102 -13.842 -7.271 1.769 1.00 0.00 C ATOM 1647 C ASP A 102 -13.402 -6.722 3.122 1.00 0.00 C ATOM 1648 O ASP A 102 -13.824 -5.641 3.534 1.00 0.00 O ATOM 1649 CB ASP A 102 -14.829 -8.423 1.968 1.00 0.00 C ATOM 1650 CG ASP A 102 -15.638 -8.278 3.241 1.00 0.00 C ATOM 1651 OD1 ASP A 102 -16.299 -7.232 3.409 1.00 0.00 O ATOM 1652 OD2 ASP A 102 -15.611 -9.211 4.072 1.00 0.00 O ATOM 0 H ASP A 102 -12.773 -8.668 0.627 1.00 0.00 H new ATOM 0 HA ASP A 102 -14.335 -6.471 1.217 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -15.505 -8.470 1.114 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -14.282 -9.366 1.994 1.00 0.00 H new ATOM 1657 N THR A 103 -12.552 -7.476 3.813 1.00 0.00 N ATOM 1658 CA THR A 103 -12.056 -7.067 5.120 1.00 0.00 C ATOM 1659 C THR A 103 -11.515 -5.642 5.083 1.00 0.00 C ATOM 1660 O THR A 103 -11.910 -4.797 5.885 1.00 0.00 O ATOM 1661 CB THR A 103 -10.947 -8.011 5.621 1.00 0.00 C ATOM 1662 OG1 THR A 103 -11.455 -9.344 5.741 1.00 0.00 O ATOM 1663 CG2 THR A 103 -10.406 -7.546 6.965 1.00 0.00 C ATOM 0 H THR A 103 -12.193 -8.374 3.488 1.00 0.00 H new ATOM 0 HA THR A 103 -12.901 -7.114 5.806 1.00 0.00 H new ATOM 0 HB THR A 103 -10.134 -7.997 4.895 1.00 0.00 H new ATOM 0 HG1 THR A 103 -11.629 -9.709 4.848 1.00 0.00 H new ATOM 0 HG21 THR A 103 -9.624 -8.228 7.298 1.00 0.00 H new ATOM 0 HG22 THR A 103 -9.993 -6.543 6.863 1.00 0.00 H new ATOM 0 HG23 THR A 103 -11.213 -7.534 7.697 1.00 0.00 H new ATOM 1671 N ALA A 104 -10.610 -5.382 4.145 1.00 0.00 N ATOM 1672 CA ALA A 104 -10.018 -4.058 4.001 1.00 0.00 C ATOM 1673 C ALA A 104 -11.090 -2.999 3.766 1.00 0.00 C ATOM 1674 O ALA A 104 -11.335 -2.148 4.622 1.00 0.00 O ATOM 1675 CB ALA A 104 -9.010 -4.052 2.862 1.00 0.00 C ATOM 0 H ALA A 104 -10.271 -6.071 3.474 1.00 0.00 H new ATOM 0 HA ALA A 104 -9.502 -3.815 4.930 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -8.576 -3.057 2.766 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -8.220 -4.774 3.071 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -9.510 -4.321 1.932 1.00 0.00 H new ATOM 1681 N HIS A 105 -11.727 -3.057 2.601 1.00 0.00 N ATOM 1682 CA HIS A 105 -12.774 -2.102 2.254 1.00 0.00 C ATOM 1683 C HIS A 105 -13.698 -1.853 3.442 1.00 0.00 C ATOM 1684 O HIS A 105 -14.141 -0.728 3.672 1.00 0.00 O ATOM 1685 CB HIS A 105 -13.584 -2.613 1.062 1.00 0.00 C ATOM 1686 CG HIS A 105 -12.932 -2.352 -0.261 1.00 0.00 C ATOM 1687 ND1 HIS A 105 -13.260 -1.281 -1.064 1.00 0.00 N ATOM 1688 CD2 HIS A 105 -11.963 -3.031 -0.919 1.00 0.00 C ATOM 1689 CE1 HIS A 105 -12.523 -1.312 -2.160 1.00 0.00 C ATOM 1690 NE2 HIS A 105 -11.728 -2.365 -2.097 1.00 0.00 N ATOM 0 H HIS A 105 -11.537 -3.755 1.882 1.00 0.00 H new ATOM 0 HA HIS A 105 -12.297 -1.160 1.983 1.00 0.00 H new ATOM 0 HB2 HIS A 105 -13.743 -3.685 1.174 1.00 0.00 H new ATOM 0 HB3 HIS A 105 -14.567 -2.142 1.073 1.00 0.00 H new ATOM 0 HD2 HIS A 105 -11.467 -3.929 -0.581 1.00 0.00 H new ATOM 0 HE1 HIS A 105 -12.564 -0.598 -2.969 1.00 0.00 H new ATOM 0 HE2 HIS A 105 -11.050 -2.639 -2.808 1.00 0.00 H new ATOM 1699 N ALA A 106 -13.985 -2.911 4.194 1.00 0.00 N ATOM 1700 CA ALA A 106 -14.855 -2.806 5.359 1.00 0.00 C ATOM 1701 C ALA A 106 -14.250 -1.887 6.415 1.00 0.00 C ATOM 1702 O ALA A 106 -14.863 -0.897 6.814 1.00 0.00 O ATOM 1703 CB ALA A 106 -15.120 -4.185 5.946 1.00 0.00 C ATOM 0 H ALA A 106 -13.628 -3.850 4.017 1.00 0.00 H new ATOM 0 HA ALA A 106 -15.802 -2.372 5.037 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -15.771 -4.091 6.815 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -15.603 -4.813 5.197 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -14.176 -4.640 6.247 1.00 0.00 H new ATOM 1709 N ILE A 107 -13.046 -2.223 6.865 1.00 0.00 N ATOM 1710 CA ILE A 107 -12.359 -1.427 7.874 1.00 0.00 C ATOM 1711 C ILE A 107 -12.273 0.037 7.456 1.00 0.00 C ATOM 1712 O ILE A 107 -12.516 0.938 8.259 1.00 0.00 O ATOM 1713 CB ILE A 107 -10.937 -1.957 8.138 1.00 0.00 C ATOM 1714 CG1 ILE A 107 -10.998 -3.326 8.818 1.00 0.00 C ATOM 1715 CG2 ILE A 107 -10.153 -0.971 8.991 1.00 0.00 C ATOM 1716 CD1 ILE A 107 -9.811 -4.210 8.505 1.00 0.00 C ATOM 0 H ILE A 107 -12.526 -3.041 6.547 1.00 0.00 H new ATOM 0 HA ILE A 107 -12.944 -1.507 8.790 1.00 0.00 H new ATOM 0 HB ILE A 107 -10.424 -2.068 7.183 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -11.061 -3.184 9.897 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -11.911 -3.835 8.510 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -9.150 -1.360 9.168 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -10.084 -0.015 8.472 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -10.662 -0.830 9.945 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -9.922 -5.164 9.021 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -9.759 -4.383 7.430 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -8.895 -3.721 8.839 1.00 0.00 H new ATOM 1728 N ILE A 108 -11.928 0.267 6.193 1.00 0.00 N ATOM 1729 CA ILE A 108 -11.814 1.621 5.667 1.00 0.00 C ATOM 1730 C ILE A 108 -13.166 2.326 5.666 1.00 0.00 C ATOM 1731 O ILE A 108 -13.284 3.466 6.116 1.00 0.00 O ATOM 1732 CB ILE A 108 -11.245 1.623 4.236 1.00 0.00 C ATOM 1733 CG1 ILE A 108 -9.887 0.919 4.203 1.00 0.00 C ATOM 1734 CG2 ILE A 108 -11.122 3.048 3.717 1.00 0.00 C ATOM 1735 CD1 ILE A 108 -8.772 1.727 4.829 1.00 0.00 C ATOM 0 H ILE A 108 -11.723 -0.467 5.516 1.00 0.00 H new ATOM 0 HA ILE A 108 -11.128 2.157 6.322 1.00 0.00 H new ATOM 0 HB ILE A 108 -11.931 1.079 3.587 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -9.969 -0.036 4.723 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -9.627 0.697 3.168 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -10.718 3.033 2.705 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -12.105 3.518 3.709 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -10.454 3.615 4.365 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -7.839 1.166 4.770 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -8.663 2.671 4.295 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -9.010 1.927 5.874 1.00 0.00 H new ATOM 1747 N ALA A 109 -14.185 1.640 5.159 1.00 0.00 N ATOM 1748 CA ALA A 109 -15.530 2.199 5.103 1.00 0.00 C ATOM 1749 C ALA A 109 -16.079 2.450 6.503 1.00 0.00 C ATOM 1750 O ALA A 109 -16.939 3.308 6.698 1.00 0.00 O ATOM 1751 CB ALA A 109 -16.455 1.271 4.329 1.00 0.00 C ATOM 0 H ALA A 109 -14.105 0.696 4.781 1.00 0.00 H new ATOM 0 HA ALA A 109 -15.478 3.157 4.585 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -17.456 1.701 4.295 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -16.079 1.146 3.314 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -16.493 0.300 4.823 1.00 0.00 H new ATOM 1757 N ALA A 110 -15.578 1.694 7.474 1.00 0.00 N ATOM 1758 CA ALA A 110 -16.017 1.835 8.857 1.00 0.00 C ATOM 1759 C ALA A 110 -15.209 2.905 9.583 1.00 0.00 C ATOM 1760 O ALA A 110 -15.686 3.512 10.541 1.00 0.00 O ATOM 1761 CB ALA A 110 -15.909 0.503 9.584 1.00 0.00 C ATOM 0 H ALA A 110 -14.867 0.977 7.328 1.00 0.00 H new ATOM 0 HA ALA A 110 -17.061 2.148 8.851 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -16.240 0.624 10.615 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -16.537 -0.236 9.085 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -14.873 0.165 9.573 1.00 0.00 H new ATOM 1767 N GLU A 111 -13.982 3.128 9.122 1.00 0.00 N ATOM 1768 CA GLU A 111 -13.107 4.123 9.730 1.00 0.00 C ATOM 1769 C GLU A 111 -13.096 5.411 8.911 1.00 0.00 C ATOM 1770 O GLU A 111 -13.558 6.456 9.370 1.00 0.00 O ATOM 1771 CB GLU A 111 -11.685 3.575 9.858 1.00 0.00 C ATOM 1772 CG GLU A 111 -11.499 2.635 11.037 1.00 0.00 C ATOM 1773 CD GLU A 111 -10.075 2.627 11.558 1.00 0.00 C ATOM 1774 OE1 GLU A 111 -9.686 3.597 12.241 1.00 0.00 O ATOM 1775 OE2 GLU A 111 -9.348 1.649 11.282 1.00 0.00 O ATOM 0 H GLU A 111 -13.572 2.633 8.330 1.00 0.00 H new ATOM 0 HA GLU A 111 -13.492 4.348 10.725 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -11.423 3.049 8.940 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -10.991 4.409 9.956 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -12.174 2.928 11.841 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -11.778 1.625 10.739 1.00 0.00 H new ATOM 1782 N LEU A 112 -12.563 5.328 7.697 1.00 0.00 N ATOM 1783 CA LEU A 112 -12.490 6.486 6.812 1.00 0.00 C ATOM 1784 C LEU A 112 -13.775 7.306 6.881 1.00 0.00 C ATOM 1785 O LEU A 112 -14.850 6.825 6.523 1.00 0.00 O ATOM 1786 CB LEU A 112 -12.235 6.037 5.372 1.00 0.00 C ATOM 1787 CG LEU A 112 -11.823 7.134 4.391 1.00 0.00 C ATOM 1788 CD1 LEU A 112 -10.446 7.676 4.741 1.00 0.00 C ATOM 1789 CD2 LEU A 112 -11.843 6.608 2.963 1.00 0.00 C ATOM 0 H LEU A 112 -12.175 4.471 7.303 1.00 0.00 H new ATOM 0 HA LEU A 112 -11.662 7.113 7.143 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -11.455 5.275 5.383 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -13.140 5.561 4.995 1.00 0.00 H new ATOM 0 HG LEU A 112 -12.542 7.950 4.467 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -10.171 8.456 4.031 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -10.464 8.092 5.748 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -9.715 6.869 4.695 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -11.547 7.403 2.278 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -11.147 5.774 2.873 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -12.849 6.270 2.714 1.00 0.00 H new ATOM 1801 N ASP A 113 -13.655 8.545 7.342 1.00 0.00 N ATOM 1802 CA ASP A 113 -14.805 9.434 7.455 1.00 0.00 C ATOM 1803 C ASP A 113 -15.157 10.043 6.101 1.00 0.00 C ATOM 1804 O ASP A 113 -14.311 10.184 5.218 1.00 0.00 O ATOM 1805 CB ASP A 113 -14.523 10.544 8.469 1.00 0.00 C ATOM 1806 CG ASP A 113 -14.700 10.078 9.901 1.00 0.00 C ATOM 1807 OD1 ASP A 113 -15.777 9.530 10.218 1.00 0.00 O ATOM 1808 OD2 ASP A 113 -13.762 10.262 10.704 1.00 0.00 O ATOM 0 H ASP A 113 -12.772 8.957 7.644 1.00 0.00 H new ATOM 0 HA ASP A 113 -15.654 8.845 7.801 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -13.505 10.908 8.331 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -15.190 11.385 8.278 1.00 0.00 H new ATOM 1813 N PRO A 114 -16.435 10.411 5.931 1.00 0.00 N ATOM 1814 CA PRO A 114 -16.928 11.010 4.687 1.00 0.00 C ATOM 1815 C PRO A 114 -16.390 12.420 4.470 1.00 0.00 C ATOM 1816 O PRO A 114 -16.535 12.989 3.389 1.00 0.00 O ATOM 1817 CB PRO A 114 -18.446 11.041 4.885 1.00 0.00 C ATOM 1818 CG PRO A 114 -18.634 11.070 6.363 1.00 0.00 C ATOM 1819 CD PRO A 114 -17.498 10.272 6.941 1.00 0.00 C ATOM 0 HA PRO A 114 -16.611 10.447 3.810 1.00 0.00 H new ATOM 0 HB2 PRO A 114 -18.889 11.917 4.412 1.00 0.00 H new ATOM 0 HB3 PRO A 114 -18.921 10.165 4.442 1.00 0.00 H new ATOM 0 HG2 PRO A 114 -18.622 12.093 6.738 1.00 0.00 H new ATOM 0 HG3 PRO A 114 -19.595 10.639 6.643 1.00 0.00 H new ATOM 0 HD2 PRO A 114 -17.185 10.662 7.910 1.00 0.00 H new ATOM 0 HD3 PRO A 114 -17.775 9.229 7.091 1.00 0.00 H new ATOM 1827 N GLU A 115 -15.770 12.978 5.505 1.00 0.00 N ATOM 1828 CA GLU A 115 -15.211 14.323 5.426 1.00 0.00 C ATOM 1829 C GLU A 115 -13.709 14.273 5.165 1.00 0.00 C ATOM 1830 O GLU A 115 -13.162 15.119 4.456 1.00 0.00 O ATOM 1831 CB GLU A 115 -15.490 15.092 6.719 1.00 0.00 C ATOM 1832 CG GLU A 115 -14.711 14.574 7.915 1.00 0.00 C ATOM 1833 CD GLU A 115 -15.310 15.013 9.237 1.00 0.00 C ATOM 1834 OE1 GLU A 115 -14.933 16.097 9.729 1.00 0.00 O ATOM 1835 OE2 GLU A 115 -16.158 14.273 9.779 1.00 0.00 O ATOM 0 H GLU A 115 -15.642 12.520 6.407 1.00 0.00 H new ATOM 0 HA GLU A 115 -15.690 14.840 4.594 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -15.247 16.144 6.566 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -16.556 15.040 6.940 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -14.679 13.485 7.879 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -13.681 14.925 7.853 1.00 0.00 H new ATOM 1842 N PHE A 116 -13.046 13.276 5.742 1.00 0.00 N ATOM 1843 CA PHE A 116 -11.607 13.116 5.574 1.00 0.00 C ATOM 1844 C PHE A 116 -11.274 12.632 4.166 1.00 0.00 C ATOM 1845 O PHE A 116 -10.326 13.108 3.543 1.00 0.00 O ATOM 1846 CB PHE A 116 -11.058 12.130 6.607 1.00 0.00 C ATOM 1847 CG PHE A 116 -9.561 12.012 6.587 1.00 0.00 C ATOM 1848 CD1 PHE A 116 -8.936 11.098 5.755 1.00 0.00 C ATOM 1849 CD2 PHE A 116 -8.778 12.816 7.401 1.00 0.00 C ATOM 1850 CE1 PHE A 116 -7.558 10.987 5.735 1.00 0.00 C ATOM 1851 CE2 PHE A 116 -7.400 12.710 7.385 1.00 0.00 C ATOM 1852 CZ PHE A 116 -6.789 11.794 6.550 1.00 0.00 C ATOM 0 H PHE A 116 -13.483 12.567 6.330 1.00 0.00 H new ATOM 0 HA PHE A 116 -11.139 14.089 5.725 1.00 0.00 H new ATOM 0 HB2 PHE A 116 -11.376 12.443 7.601 1.00 0.00 H new ATOM 0 HB3 PHE A 116 -11.494 11.147 6.427 1.00 0.00 H new ATOM 0 HD1 PHE A 116 -9.532 10.465 5.114 1.00 0.00 H new ATOM 0 HD2 PHE A 116 -9.250 13.534 8.055 1.00 0.00 H new ATOM 0 HE1 PHE A 116 -7.083 10.269 5.082 1.00 0.00 H new ATOM 0 HE2 PHE A 116 -6.802 13.342 8.024 1.00 0.00 H new ATOM 0 HZ PHE A 116 -5.712 11.709 6.535 1.00 0.00 H new ATOM 1862 N ASN A 117 -12.062 11.682 3.672 1.00 0.00 N ATOM 1863 CA ASN A 117 -11.851 11.132 2.337 1.00 0.00 C ATOM 1864 C ASN A 117 -11.792 12.244 1.294 1.00 0.00 C ATOM 1865 O ASN A 117 -11.029 12.167 0.330 1.00 0.00 O ATOM 1866 CB ASN A 117 -12.968 10.147 1.987 1.00 0.00 C ATOM 1867 CG ASN A 117 -12.846 9.615 0.572 1.00 0.00 C ATOM 1868 OD1 ASN A 117 -12.073 8.695 0.307 1.00 0.00 O ATOM 1869 ND2 ASN A 117 -13.612 10.194 -0.345 1.00 0.00 N ATOM 0 H ASN A 117 -12.852 11.277 4.175 1.00 0.00 H new ATOM 0 HA ASN A 117 -10.897 10.605 2.334 1.00 0.00 H new ATOM 0 HB2 ASN A 117 -12.947 9.313 2.689 1.00 0.00 H new ATOM 0 HB3 ASN A 117 -13.933 10.639 2.105 1.00 0.00 H new ATOM 0 HD21 ASN A 117 -13.574 9.879 -1.314 1.00 0.00 H new ATOM 0 HD22 ASN A 117 -14.239 10.954 -0.080 1.00 0.00 H new ATOM 1876 N LYS A 118 -12.602 13.278 1.493 1.00 0.00 N ATOM 1877 CA LYS A 118 -12.642 14.408 0.571 1.00 0.00 C ATOM 1878 C LYS A 118 -11.442 15.325 0.783 1.00 0.00 C ATOM 1879 O LYS A 118 -11.028 16.043 -0.128 1.00 0.00 O ATOM 1880 CB LYS A 118 -13.940 15.197 0.756 1.00 0.00 C ATOM 1881 CG LYS A 118 -15.187 14.329 0.743 1.00 0.00 C ATOM 1882 CD LYS A 118 -16.448 15.162 0.893 1.00 0.00 C ATOM 1883 CE LYS A 118 -16.263 16.276 1.912 1.00 0.00 C ATOM 1884 NZ LYS A 118 -17.565 16.855 2.344 1.00 0.00 N ATOM 0 H LYS A 118 -13.240 13.357 2.285 1.00 0.00 H new ATOM 0 HA LYS A 118 -12.603 14.018 -0.446 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -13.894 15.739 1.701 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -14.018 15.942 -0.035 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -15.230 13.767 -0.190 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -15.133 13.601 1.552 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -16.718 15.591 -0.072 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -17.274 14.521 1.200 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -15.732 15.888 2.781 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -15.641 17.061 1.482 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -17.396 17.611 3.038 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -18.061 17.248 1.519 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -18.149 16.111 2.777 1.00 0.00 H new ATOM 1898 N LEU A 119 -10.887 15.297 1.990 1.00 0.00 N ATOM 1899 CA LEU A 119 -9.733 16.126 2.321 1.00 0.00 C ATOM 1900 C LEU A 119 -8.482 15.627 1.605 1.00 0.00 C ATOM 1901 O LEU A 119 -7.867 16.357 0.827 1.00 0.00 O ATOM 1902 CB LEU A 119 -9.502 16.132 3.833 1.00 0.00 C ATOM 1903 CG LEU A 119 -10.368 17.100 4.640 1.00 0.00 C ATOM 1904 CD1 LEU A 119 -10.014 17.028 6.117 1.00 0.00 C ATOM 1905 CD2 LEU A 119 -10.206 18.521 4.120 1.00 0.00 C ATOM 0 H LEU A 119 -11.217 14.709 2.755 1.00 0.00 H new ATOM 0 HA LEU A 119 -9.939 17.143 1.988 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -9.671 15.123 4.210 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -8.455 16.371 4.020 1.00 0.00 H new ATOM 0 HG LEU A 119 -11.412 16.808 4.523 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -10.640 17.724 6.676 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -10.182 16.015 6.482 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -8.966 17.294 6.253 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -10.830 19.196 4.706 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -9.162 18.823 4.207 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -10.510 18.563 3.074 1.00 0.00 H new ATOM 1917 N CYS A 120 -8.111 14.380 1.873 1.00 0.00 N ATOM 1918 CA CYS A 120 -6.934 13.782 1.254 1.00 0.00 C ATOM 1919 C CYS A 120 -6.923 14.036 -0.250 1.00 0.00 C ATOM 1920 O CYS A 120 -5.956 14.572 -0.791 1.00 0.00 O ATOM 1921 CB CYS A 120 -6.894 12.279 1.530 1.00 0.00 C ATOM 1922 SG CYS A 120 -8.485 11.447 1.317 1.00 0.00 S ATOM 0 H CYS A 120 -8.609 13.763 2.515 1.00 0.00 H new ATOM 0 HA CYS A 120 -6.049 14.247 1.689 1.00 0.00 H new ATOM 0 HB2 CYS A 120 -6.163 11.818 0.866 1.00 0.00 H new ATOM 0 HB3 CYS A 120 -6.545 12.117 2.550 1.00 0.00 H new ATOM 0 HG CYS A 120 -9.375 12.308 0.921 1.00 0.00 H new ATOM 1928 N GLU A 121 -8.003 13.645 -0.919 1.00 0.00 N ATOM 1929 CA GLU A 121 -8.115 13.828 -2.361 1.00 0.00 C ATOM 1930 C GLU A 121 -8.073 15.309 -2.727 1.00 0.00 C ATOM 1931 O GLU A 121 -7.814 15.668 -3.875 1.00 0.00 O ATOM 1932 CB GLU A 121 -9.412 13.201 -2.878 1.00 0.00 C ATOM 1933 CG GLU A 121 -10.662 13.956 -2.460 1.00 0.00 C ATOM 1934 CD GLU A 121 -11.862 13.622 -3.325 1.00 0.00 C ATOM 1935 OE1 GLU A 121 -12.096 12.421 -3.576 1.00 0.00 O ATOM 1936 OE2 GLU A 121 -12.567 14.561 -3.751 1.00 0.00 O ATOM 0 H GLU A 121 -8.812 13.200 -0.486 1.00 0.00 H new ATOM 0 HA GLU A 121 -7.266 13.331 -2.831 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -9.374 13.153 -3.966 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -9.479 12.175 -2.516 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -10.892 13.723 -1.420 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -10.469 15.028 -2.511 1.00 0.00 H new ATOM 1943 N GLU A 122 -8.330 16.163 -1.741 1.00 0.00 N ATOM 1944 CA GLU A 122 -8.323 17.605 -1.959 1.00 0.00 C ATOM 1945 C GLU A 122 -6.953 18.076 -2.437 1.00 0.00 C ATOM 1946 O GLU A 122 -6.851 18.924 -3.325 1.00 0.00 O ATOM 1947 CB GLU A 122 -8.707 18.340 -0.673 1.00 0.00 C ATOM 1948 CG GLU A 122 -9.314 19.712 -0.914 1.00 0.00 C ATOM 1949 CD GLU A 122 -8.265 20.779 -1.159 1.00 0.00 C ATOM 1950 OE1 GLU A 122 -7.453 21.034 -0.245 1.00 0.00 O ATOM 1951 OE2 GLU A 122 -8.256 21.359 -2.265 1.00 0.00 O ATOM 0 H GLU A 122 -8.545 15.882 -0.785 1.00 0.00 H new ATOM 0 HA GLU A 122 -9.057 17.833 -2.732 1.00 0.00 H new ATOM 0 HB2 GLU A 122 -9.418 17.731 -0.115 1.00 0.00 H new ATOM 0 HB3 GLU A 122 -7.821 18.449 -0.048 1.00 0.00 H new ATOM 0 HG2 GLU A 122 -9.984 19.663 -1.772 1.00 0.00 H new ATOM 0 HG3 GLU A 122 -9.919 19.994 -0.052 1.00 0.00 H new ATOM 1958 N ILE A 123 -5.902 17.521 -1.843 1.00 0.00 N ATOM 1959 CA ILE A 123 -4.538 17.884 -2.208 1.00 0.00 C ATOM 1960 C ILE A 123 -4.215 17.443 -3.631 1.00 0.00 C ATOM 1961 O ILE A 123 -3.587 18.179 -4.393 1.00 0.00 O ATOM 1962 CB ILE A 123 -3.513 17.259 -1.243 1.00 0.00 C ATOM 1963 CG1 ILE A 123 -3.749 17.761 0.183 1.00 0.00 C ATOM 1964 CG2 ILE A 123 -2.096 17.581 -1.696 1.00 0.00 C ATOM 1965 CD1 ILE A 123 -3.238 16.817 1.248 1.00 0.00 C ATOM 0 H ILE A 123 -5.969 16.818 -1.107 1.00 0.00 H new ATOM 0 HA ILE A 123 -4.471 18.970 -2.143 1.00 0.00 H new ATOM 0 HB ILE A 123 -3.640 16.177 -1.252 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -3.263 18.729 0.304 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -4.817 17.920 0.332 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -1.382 17.133 -1.005 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -1.934 17.179 -2.696 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -1.956 18.662 -1.712 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -3.439 17.237 2.233 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -3.742 15.855 1.154 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -2.164 16.677 1.126 1.00 0.00 H new ATOM 1977 N LYS A 124 -4.649 16.238 -3.985 1.00 0.00 N ATOM 1978 CA LYS A 124 -4.409 15.699 -5.318 1.00 0.00 C ATOM 1979 C LYS A 124 -4.886 16.671 -6.392 1.00 0.00 C ATOM 1980 O LYS A 124 -4.093 17.157 -7.198 1.00 0.00 O ATOM 1981 CB LYS A 124 -5.119 14.353 -5.482 1.00 0.00 C ATOM 1982 CG LYS A 124 -4.489 13.456 -6.533 1.00 0.00 C ATOM 1983 CD LYS A 124 -5.023 12.036 -6.448 1.00 0.00 C ATOM 1984 CE LYS A 124 -6.361 11.900 -7.159 1.00 0.00 C ATOM 1985 NZ LYS A 124 -7.148 10.746 -6.644 1.00 0.00 N ATOM 0 H LYS A 124 -5.169 15.616 -3.366 1.00 0.00 H new ATOM 0 HA LYS A 124 -3.335 15.553 -5.436 1.00 0.00 H new ATOM 0 HB2 LYS A 124 -5.118 13.832 -4.524 1.00 0.00 H new ATOM 0 HB3 LYS A 124 -6.161 14.532 -5.747 1.00 0.00 H new ATOM 0 HG2 LYS A 124 -4.688 13.862 -7.525 1.00 0.00 H new ATOM 0 HG3 LYS A 124 -3.407 13.447 -6.403 1.00 0.00 H new ATOM 0 HD2 LYS A 124 -4.303 11.348 -6.891 1.00 0.00 H new ATOM 0 HD3 LYS A 124 -5.135 11.750 -5.402 1.00 0.00 H new ATOM 0 HE2 LYS A 124 -6.935 12.817 -7.031 1.00 0.00 H new ATOM 0 HE3 LYS A 124 -6.193 11.776 -8.229 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 -8.053 10.688 -7.154 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 -6.611 9.867 -6.789 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 -7.331 10.876 -5.628 1.00 0.00 H new