USER MOD reduce.3.24.130724 H: found=0, std=0, add=1164, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1163 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 101 GLN :FLIP amide:sc= -0.277 X(o=-0.39,f=-0.28) USER MOD Set 1.2: A 140 ASN :FLIP amide:sc= 0 F(o=-1.1,f=-0.28) USER MOD Set 2.1: A 91 HIS :FLIP no HE2:sc= -0.0903 F(o=-0.6,f=-0.09) USER MOD Set 2.2: A 92 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 58 HIS : no HD1:sc= 0.0879 K(o=1.3,f=-9.2!) USER MOD Set 3.2: A 59 SER OG : rot 70:sc= 1.2 USER MOD Set 3.3: A 77 SER OG : rot 180:sc= 0 USER MOD Set 4.1: A 50 ASN : amide:sc= 0.0657 K(o=1.1,f=0.52) USER MOD Set 4.2: A 51 THR OG1 : rot -69:sc= 0.668 USER MOD Set 4.3: A 69 THR OG1 : rot -50:sc= 0.36 USER MOD Set 5.1: A 48 ASN :FLIP amide:sc= 0.415 F(o=-0.32,f=0.41) USER MOD Set 5.2: A 68 SER OG : rot 180:sc= 0 USER MOD Set 6.1: A 46 TYR OH : rot -44:sc= 0.772 USER MOD Set 6.2: A 123 TYR OH : rot -172:sc= 1.02 USER MOD Single : A 14 SER OG : rot 180:sc= -0.523 USER MOD Single : A 15 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 18 SER OG : rot -53:sc= 1.06 USER MOD Single : A 19 GLN : amide:sc= -0.228 X(o=-0.23,f=-0.21) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 29 HIS : no HD1:sc= -0.416 X(o=-0.42,f=-0.11) USER MOD Single : A 30 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 36 THR OG1 : rot 180:sc= -1.3 USER MOD Single : A 39 SER OG : rot 33:sc=0.000198 USER MOD Single : A 40 ASN : amide:sc= -0.317 X(o=-0.32,f=-0.07) USER MOD Single : A 41 CYS SG : rot 180:sc= -0.71 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ 178:sc= 0.373 (180deg=0.371) USER MOD Single : A 60 CYS SG : rot 31:sc= 0.667 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 CYS SG : rot -150:sc= -1.09 USER MOD Single : A 70 SER OG : rot 180:sc= -0.734 USER MOD Single : A 76 CYS SG : rot -8:sc= -1.01 USER MOD Single : A 79 CYS SG : rot -54:sc= -1.91 USER MOD Single : A 85 CYS SG : rot 117:sc= -0.195 USER MOD Single : A 86 GLN : amide:sc= -0.923 X(o=-0.92,f=-0.92) USER MOD Single : A 87 GLN : amide:sc= -0.218 X(o=-0.22,f=-0.067) USER MOD Single : A 93 THR OG1 : rot -80:sc= -1.84 USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 THR OG1 : rot 60:sc= -2.85 USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 111 CYS SG : rot 18:sc= 0.562 USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 115 GLN :FLIP amide:sc= 0 F(o=-0.84,f=0) USER MOD Single : A 119 TYR OH : rot 34:sc= 1.1 USER MOD Single : A 120 THR OG1 : rot -53:sc= 1.09 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 133 SER OG : rot 180:sc= 0 USER MOD Single : A 138 SER OG : rot 180:sc= 0 USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 ASN : amide:sc= 0 X(o=0,f=-0.028) USER MOD Single : A 143 ASN : amide:sc= 0 X(o=0,f=-0.005) USER MOD Single : A 157 SER OG : rot -147:sc= 0.0266 USER MOD Single : A 159 ASN : amide:sc= -1.75 K(o=-1.7,f=-7.8!) USER MOD Single : A 161 SER OG : rot 180:sc= 0 USER MOD Single : A 169 ASN : amide:sc= -0.0567 K(o=-0.057,f=-1.1) USER MOD ----------------------------------------------------------------- ATOM 130 N GLY A 12 -8.298 -15.985 0.480 1.00 0.00 N ATOM 131 CA GLY A 12 -7.894 -15.003 -0.509 1.00 0.00 C ATOM 132 C GLY A 12 -7.607 -15.626 -1.861 1.00 0.00 C ATOM 133 O GLY A 12 -7.652 -16.847 -2.012 1.00 0.00 O ATOM 0 HA2 GLY A 12 -8.680 -14.255 -0.616 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -7.004 -14.482 -0.156 1.00 0.00 H new ATOM 137 N PHE A 13 -7.308 -14.786 -2.845 1.00 0.00 N ATOM 138 CA PHE A 13 -7.011 -15.260 -4.192 1.00 0.00 C ATOM 139 C PHE A 13 -5.508 -15.268 -4.446 1.00 0.00 C ATOM 140 O PHE A 13 -4.817 -14.286 -4.174 1.00 0.00 O ATOM 141 CB PHE A 13 -7.712 -14.383 -5.231 1.00 0.00 C ATOM 142 CG PHE A 13 -9.168 -14.707 -5.408 1.00 0.00 C ATOM 143 CD1 PHE A 13 -9.560 -15.852 -6.081 1.00 0.00 C ATOM 144 CD2 PHE A 13 -10.145 -13.864 -4.902 1.00 0.00 C ATOM 145 CE1 PHE A 13 -10.899 -16.153 -6.245 1.00 0.00 C ATOM 146 CE2 PHE A 13 -11.485 -14.159 -5.062 1.00 0.00 C ATOM 147 CZ PHE A 13 -11.862 -15.305 -5.735 1.00 0.00 C ATOM 0 H PHE A 13 -7.265 -13.773 -2.736 1.00 0.00 H new ATOM 0 HA PHE A 13 -7.382 -16.281 -4.281 1.00 0.00 H new ATOM 0 HB2 PHE A 13 -7.614 -13.338 -4.937 1.00 0.00 H new ATOM 0 HB3 PHE A 13 -7.205 -14.494 -6.189 1.00 0.00 H new ATOM 0 HD1 PHE A 13 -8.810 -16.518 -6.483 1.00 0.00 H new ATOM 0 HD2 PHE A 13 -9.855 -12.966 -4.377 1.00 0.00 H new ATOM 0 HE1 PHE A 13 -11.191 -17.050 -6.771 1.00 0.00 H new ATOM 0 HE2 PHE A 13 -12.237 -13.495 -4.662 1.00 0.00 H new ATOM 0 HZ PHE A 13 -12.909 -15.537 -5.862 1.00 0.00 H new ATOM 157 N SER A 14 -5.007 -16.382 -4.970 1.00 0.00 N ATOM 158 CA SER A 14 -3.585 -16.518 -5.262 1.00 0.00 C ATOM 159 C SER A 14 -3.350 -17.575 -6.336 1.00 0.00 C ATOM 160 O SER A 14 -4.269 -18.297 -6.722 1.00 0.00 O ATOM 161 CB SER A 14 -2.816 -16.885 -3.991 1.00 0.00 C ATOM 162 OG SER A 14 -3.427 -16.319 -2.844 1.00 0.00 O ATOM 0 H SER A 14 -5.565 -17.204 -5.201 1.00 0.00 H new ATOM 0 HA SER A 14 -3.222 -15.560 -5.635 1.00 0.00 H new ATOM 0 HB2 SER A 14 -2.775 -17.969 -3.887 1.00 0.00 H new ATOM 0 HB3 SER A 14 -1.787 -16.533 -4.070 1.00 0.00 H new ATOM 0 HG SER A 14 -2.918 -16.569 -2.045 1.00 0.00 H new ATOM 168 N ASN A 15 -2.112 -17.661 -6.814 1.00 0.00 N ATOM 169 CA ASN A 15 -1.756 -18.631 -7.845 1.00 0.00 C ATOM 170 C ASN A 15 -2.522 -18.358 -9.136 1.00 0.00 C ATOM 171 O ASN A 15 -2.860 -19.282 -9.876 1.00 0.00 O ATOM 172 CB ASN A 15 -2.040 -20.055 -7.354 1.00 0.00 C ATOM 173 CG ASN A 15 -0.785 -20.901 -7.278 1.00 0.00 C ATOM 174 OD1 ASN A 15 -0.508 -21.704 -8.168 1.00 0.00 O ATOM 175 ND2 ASN A 15 -0.016 -20.723 -6.209 1.00 0.00 N ATOM 0 H ASN A 15 -1.339 -17.072 -6.504 1.00 0.00 H new ATOM 0 HA ASN A 15 -0.690 -18.533 -8.052 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -2.505 -20.011 -6.369 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -2.756 -20.531 -8.024 1.00 0.00 H new ATOM 0 HD21 ASN A 15 0.842 -21.263 -6.103 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -0.284 -20.046 -5.495 1.00 0.00 H new ATOM 182 N LEU A 16 -2.792 -17.083 -9.401 1.00 0.00 N ATOM 183 CA LEU A 16 -3.517 -16.690 -10.604 1.00 0.00 C ATOM 184 C LEU A 16 -2.706 -15.694 -11.427 1.00 0.00 C ATOM 185 O LEU A 16 -1.656 -15.223 -10.992 1.00 0.00 O ATOM 186 CB LEU A 16 -4.870 -16.080 -10.233 1.00 0.00 C ATOM 187 CG LEU A 16 -5.607 -16.782 -9.093 1.00 0.00 C ATOM 188 CD1 LEU A 16 -6.891 -16.041 -8.750 1.00 0.00 C ATOM 189 CD2 LEU A 16 -5.907 -18.228 -9.463 1.00 0.00 C ATOM 0 H LEU A 16 -2.520 -16.306 -8.799 1.00 0.00 H new ATOM 0 HA LEU A 16 -3.682 -17.583 -11.207 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -4.717 -15.036 -9.958 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -5.509 -16.087 -11.116 1.00 0.00 H new ATOM 0 HG LEU A 16 -4.963 -16.778 -8.213 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -7.402 -16.556 -7.936 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -6.652 -15.023 -8.442 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -7.540 -16.013 -9.625 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -6.432 -18.713 -8.640 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -6.531 -18.253 -10.356 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -4.973 -18.755 -9.658 1.00 0.00 H new ATOM 201 N GLU A 17 -3.202 -15.378 -12.619 1.00 0.00 N ATOM 202 CA GLU A 17 -2.525 -14.438 -13.505 1.00 0.00 C ATOM 203 C GLU A 17 -3.415 -14.063 -14.684 1.00 0.00 C ATOM 204 O GLU A 17 -4.047 -14.925 -15.296 1.00 0.00 O ATOM 205 CB GLU A 17 -1.213 -15.039 -14.012 1.00 0.00 C ATOM 206 CG GLU A 17 -0.399 -14.085 -14.873 1.00 0.00 C ATOM 207 CD GLU A 17 0.230 -14.773 -16.069 1.00 0.00 C ATOM 208 OE1 GLU A 17 -0.503 -15.071 -17.036 1.00 0.00 O ATOM 209 OE2 GLU A 17 1.455 -15.014 -16.039 1.00 0.00 O ATOM 0 H GLU A 17 -4.071 -15.759 -12.994 1.00 0.00 H new ATOM 0 HA GLU A 17 -2.307 -13.534 -12.937 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -0.611 -15.348 -13.158 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -1.433 -15.937 -14.589 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -1.042 -13.276 -15.220 1.00 0.00 H new ATOM 0 HG3 GLU A 17 0.384 -13.631 -14.266 1.00 0.00 H new ATOM 216 N SER A 18 -3.460 -12.773 -15.000 1.00 0.00 N ATOM 217 CA SER A 18 -4.272 -12.283 -16.107 1.00 0.00 C ATOM 218 C SER A 18 -5.742 -12.641 -15.907 1.00 0.00 C ATOM 219 O SER A 18 -6.462 -12.911 -16.869 1.00 0.00 O ATOM 220 CB SER A 18 -3.769 -12.862 -17.432 1.00 0.00 C ATOM 221 OG SER A 18 -4.282 -14.165 -17.647 1.00 0.00 O ATOM 0 H SER A 18 -2.943 -12.047 -14.504 1.00 0.00 H new ATOM 0 HA SER A 18 -4.183 -11.197 -16.136 1.00 0.00 H new ATOM 0 HB2 SER A 18 -4.067 -12.210 -18.253 1.00 0.00 H new ATOM 0 HB3 SER A 18 -2.679 -12.893 -17.429 1.00 0.00 H new ATOM 0 HG SER A 18 -4.088 -14.726 -16.867 1.00 0.00 H new ATOM 227 N GLN A 19 -6.180 -12.641 -14.653 1.00 0.00 N ATOM 228 CA GLN A 19 -7.563 -12.965 -14.326 1.00 0.00 C ATOM 229 C GLN A 19 -8.311 -11.729 -13.839 1.00 0.00 C ATOM 230 O GLN A 19 -7.713 -10.676 -13.616 1.00 0.00 O ATOM 231 CB GLN A 19 -7.615 -14.059 -13.258 1.00 0.00 C ATOM 232 CG GLN A 19 -7.194 -15.428 -13.768 1.00 0.00 C ATOM 233 CD GLN A 19 -8.042 -16.548 -13.197 1.00 0.00 C ATOM 234 OE1 GLN A 19 -9.271 -16.485 -13.217 1.00 0.00 O ATOM 235 NE2 GLN A 19 -7.387 -17.583 -12.684 1.00 0.00 N ATOM 0 H GLN A 19 -5.597 -12.420 -13.846 1.00 0.00 H new ATOM 0 HA GLN A 19 -8.048 -13.328 -15.232 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -6.969 -13.775 -12.428 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -8.630 -14.123 -12.865 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -7.263 -15.443 -14.856 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -6.149 -15.602 -13.512 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -6.367 -17.594 -12.688 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -7.904 -18.367 -12.286 1.00 0.00 H new ATOM 244 N VAL A 20 -9.624 -11.863 -13.678 1.00 0.00 N ATOM 245 CA VAL A 20 -10.455 -10.756 -13.219 1.00 0.00 C ATOM 246 C VAL A 20 -11.300 -11.167 -12.018 1.00 0.00 C ATOM 247 O VAL A 20 -12.308 -11.858 -12.163 1.00 0.00 O ATOM 248 CB VAL A 20 -11.383 -10.248 -14.338 1.00 0.00 C ATOM 249 CG1 VAL A 20 -12.092 -8.975 -13.906 1.00 0.00 C ATOM 250 CG2 VAL A 20 -10.598 -10.022 -15.620 1.00 0.00 C ATOM 0 H VAL A 20 -10.135 -12.727 -13.859 1.00 0.00 H new ATOM 0 HA VAL A 20 -9.780 -9.952 -12.927 1.00 0.00 H new ATOM 0 HB VAL A 20 -12.139 -11.009 -14.532 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -12.743 -8.631 -14.709 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -12.688 -9.175 -13.016 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -11.353 -8.205 -13.683 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -11.270 -9.663 -16.400 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -9.818 -9.281 -15.443 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -10.142 -10.960 -15.937 1.00 0.00 H new ATOM 260 N LEU A 21 -10.883 -10.736 -10.832 1.00 0.00 N ATOM 261 CA LEU A 21 -11.602 -11.058 -9.605 1.00 0.00 C ATOM 262 C LEU A 21 -12.613 -9.969 -9.264 1.00 0.00 C ATOM 263 O LEU A 21 -12.620 -8.901 -9.878 1.00 0.00 O ATOM 264 CB LEU A 21 -10.618 -11.239 -8.446 1.00 0.00 C ATOM 265 CG LEU A 21 -9.621 -12.386 -8.616 1.00 0.00 C ATOM 266 CD1 LEU A 21 -8.473 -12.246 -7.629 1.00 0.00 C ATOM 267 CD2 LEU A 21 -10.318 -13.726 -8.439 1.00 0.00 C ATOM 0 H LEU A 21 -10.051 -10.163 -10.695 1.00 0.00 H new ATOM 0 HA LEU A 21 -12.142 -11.991 -9.764 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -10.062 -10.311 -8.314 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -11.185 -11.404 -7.530 1.00 0.00 H new ATOM 0 HG LEU A 21 -9.212 -12.341 -9.625 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -7.774 -13.071 -7.765 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -7.958 -11.301 -7.802 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -8.864 -12.265 -6.612 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -9.594 -14.532 -8.563 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -10.754 -13.780 -7.442 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -11.106 -13.828 -9.185 1.00 0.00 H new ATOM 279 N GLU A 22 -13.464 -10.244 -8.281 1.00 0.00 N ATOM 280 CA GLU A 22 -14.479 -9.287 -7.858 1.00 0.00 C ATOM 281 C GLU A 22 -15.129 -9.727 -6.549 1.00 0.00 C ATOM 282 O GLU A 22 -15.487 -10.893 -6.383 1.00 0.00 O ATOM 283 CB GLU A 22 -15.544 -9.126 -8.945 1.00 0.00 C ATOM 284 CG GLU A 22 -15.430 -7.823 -9.719 1.00 0.00 C ATOM 285 CD GLU A 22 -16.448 -6.791 -9.278 1.00 0.00 C ATOM 286 OE1 GLU A 22 -16.623 -6.615 -8.053 1.00 0.00 O ATOM 287 OE2 GLU A 22 -17.071 -6.158 -10.155 1.00 0.00 O ATOM 0 H GLU A 22 -13.471 -11.122 -7.762 1.00 0.00 H new ATOM 0 HA GLU A 22 -13.992 -8.326 -7.694 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -15.469 -9.961 -9.642 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -16.531 -9.181 -8.486 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -14.427 -7.416 -9.591 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -15.560 -8.024 -10.782 1.00 0.00 H new ATOM 294 N LYS A 23 -15.278 -8.786 -5.624 1.00 0.00 N ATOM 295 CA LYS A 23 -15.884 -9.075 -4.329 1.00 0.00 C ATOM 296 C LYS A 23 -16.871 -7.981 -3.935 1.00 0.00 C ATOM 297 O LYS A 23 -16.904 -6.912 -4.544 1.00 0.00 O ATOM 298 CB LYS A 23 -14.803 -9.215 -3.256 1.00 0.00 C ATOM 299 CG LYS A 23 -13.816 -10.340 -3.529 1.00 0.00 C ATOM 300 CD LYS A 23 -14.092 -11.551 -2.652 1.00 0.00 C ATOM 301 CE LYS A 23 -12.805 -12.154 -2.114 1.00 0.00 C ATOM 302 NZ LYS A 23 -13.031 -13.491 -1.498 1.00 0.00 N ATOM 0 H LYS A 23 -14.988 -7.816 -5.746 1.00 0.00 H new ATOM 0 HA LYS A 23 -16.427 -10.017 -4.411 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -14.257 -8.275 -3.177 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -15.280 -9.388 -2.291 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -13.874 -10.629 -4.578 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -12.801 -9.985 -3.352 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -14.734 -11.261 -1.821 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -14.634 -12.302 -3.227 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -12.081 -12.245 -2.924 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -12.372 -11.482 -1.373 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -12.128 -13.867 -1.144 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -13.702 -13.401 -0.709 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -13.421 -14.140 -2.211 1.00 0.00 H new ATOM 316 N ARG A 24 -17.673 -8.256 -2.911 1.00 0.00 N ATOM 317 CA ARG A 24 -18.662 -7.295 -2.436 1.00 0.00 C ATOM 318 C ARG A 24 -18.876 -7.434 -0.931 1.00 0.00 C ATOM 319 O ARG A 24 -18.312 -8.323 -0.293 1.00 0.00 O ATOM 320 CB ARG A 24 -19.988 -7.486 -3.176 1.00 0.00 C ATOM 321 CG ARG A 24 -20.469 -6.235 -3.893 1.00 0.00 C ATOM 322 CD ARG A 24 -21.747 -6.497 -4.674 1.00 0.00 C ATOM 323 NE ARG A 24 -22.685 -5.380 -4.580 1.00 0.00 N ATOM 324 CZ ARG A 24 -22.447 -4.169 -5.081 1.00 0.00 C ATOM 325 NH1 ARG A 24 -21.307 -3.916 -5.711 1.00 0.00 N ATOM 326 NH2 ARG A 24 -23.353 -3.209 -4.950 1.00 0.00 N ATOM 0 H ARG A 24 -17.657 -9.136 -2.395 1.00 0.00 H new ATOM 0 HA ARG A 24 -18.285 -6.292 -2.639 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -19.877 -8.291 -3.902 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -20.750 -7.802 -2.464 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -20.642 -5.441 -3.166 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -19.692 -5.882 -4.572 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -21.502 -6.677 -5.721 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -22.223 -7.403 -4.298 1.00 0.00 H new ATOM 0 HE ARG A 24 -23.573 -5.537 -4.103 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -20.607 -4.651 -5.814 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -21.131 -2.987 -6.093 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -24.231 -3.399 -4.466 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -23.172 -2.281 -5.333 1.00 0.00 H new ATOM 340 N ALA A 25 -19.695 -6.549 -0.371 1.00 0.00 N ATOM 341 CA ALA A 25 -19.984 -6.573 1.057 1.00 0.00 C ATOM 342 C ALA A 25 -20.608 -7.902 1.471 1.00 0.00 C ATOM 343 O ALA A 25 -20.271 -8.458 2.516 1.00 0.00 O ATOM 344 CB ALA A 25 -20.905 -5.419 1.427 1.00 0.00 C ATOM 0 H ALA A 25 -20.170 -5.807 -0.885 1.00 0.00 H new ATOM 0 HA ALA A 25 -19.042 -6.461 1.594 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -21.113 -5.448 2.497 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -20.423 -4.474 1.177 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -21.839 -5.507 0.873 1.00 0.00 H new ATOM 350 N SER A 26 -21.518 -8.406 0.644 1.00 0.00 N ATOM 351 CA SER A 26 -22.189 -9.670 0.924 1.00 0.00 C ATOM 352 C SER A 26 -21.186 -10.818 0.977 1.00 0.00 C ATOM 353 O SER A 26 -21.375 -11.788 1.710 1.00 0.00 O ATOM 354 CB SER A 26 -23.252 -9.955 -0.138 1.00 0.00 C ATOM 355 OG SER A 26 -24.152 -10.959 0.296 1.00 0.00 O ATOM 0 H SER A 26 -21.808 -7.958 -0.226 1.00 0.00 H new ATOM 0 HA SER A 26 -22.672 -9.588 1.898 1.00 0.00 H new ATOM 0 HB2 SER A 26 -23.802 -9.041 -0.360 1.00 0.00 H new ATOM 0 HB3 SER A 26 -22.770 -10.270 -1.064 1.00 0.00 H new ATOM 0 HG SER A 26 -24.822 -11.121 -0.401 1.00 0.00 H new ATOM 361 N GLU A 27 -20.119 -10.701 0.193 1.00 0.00 N ATOM 362 CA GLU A 27 -19.085 -11.729 0.150 1.00 0.00 C ATOM 363 C GLU A 27 -18.017 -11.473 1.209 1.00 0.00 C ATOM 364 O GLU A 27 -17.505 -12.406 1.828 1.00 0.00 O ATOM 365 CB GLU A 27 -18.443 -11.778 -1.237 1.00 0.00 C ATOM 366 CG GLU A 27 -19.117 -12.756 -2.185 1.00 0.00 C ATOM 367 CD GLU A 27 -18.130 -13.458 -3.097 1.00 0.00 C ATOM 368 OE1 GLU A 27 -17.140 -12.816 -3.506 1.00 0.00 O ATOM 369 OE2 GLU A 27 -18.347 -14.649 -3.401 1.00 0.00 O ATOM 0 H GLU A 27 -19.948 -9.905 -0.421 1.00 0.00 H new ATOM 0 HA GLU A 27 -19.555 -12.690 0.360 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -18.471 -10.781 -1.677 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -17.393 -12.051 -1.133 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -19.663 -13.500 -1.605 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -19.850 -12.223 -2.791 1.00 0.00 H new ATOM 376 N LEU A 28 -17.688 -10.202 1.414 1.00 0.00 N ATOM 377 CA LEU A 28 -16.681 -9.822 2.398 1.00 0.00 C ATOM 378 C LEU A 28 -17.303 -9.673 3.783 1.00 0.00 C ATOM 379 O LEU A 28 -17.064 -10.488 4.673 1.00 0.00 O ATOM 380 CB LEU A 28 -16.005 -8.513 1.986 1.00 0.00 C ATOM 381 CG LEU A 28 -15.147 -8.597 0.721 1.00 0.00 C ATOM 382 CD1 LEU A 28 -15.332 -7.353 -0.135 1.00 0.00 C ATOM 383 CD2 LEU A 28 -13.681 -8.784 1.083 1.00 0.00 C ATOM 0 H LEU A 28 -18.104 -9.418 0.912 1.00 0.00 H new ATOM 0 HA LEU A 28 -15.932 -10.613 2.439 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -16.775 -7.756 1.835 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -15.378 -8.170 2.810 1.00 0.00 H new ATOM 0 HG LEU A 28 -15.472 -9.462 0.142 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -14.714 -7.432 -1.029 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -16.379 -7.263 -0.424 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -15.036 -6.472 0.434 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -13.086 -8.842 0.172 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -13.344 -7.939 1.684 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -13.562 -9.705 1.653 1.00 0.00 H new ATOM 395 N HIS A 29 -18.102 -8.624 3.956 1.00 0.00 N ATOM 396 CA HIS A 29 -18.760 -8.367 5.232 1.00 0.00 C ATOM 397 C HIS A 29 -17.733 -8.141 6.339 1.00 0.00 C ATOM 398 O HIS A 29 -17.804 -8.756 7.403 1.00 0.00 O ATOM 399 CB HIS A 29 -19.680 -9.532 5.600 1.00 0.00 C ATOM 400 CG HIS A 29 -20.942 -9.107 6.285 1.00 0.00 C ATOM 401 ND1 HIS A 29 -21.646 -9.901 7.162 1.00 0.00 N ATOM 402 CD2 HIS A 29 -21.626 -7.936 6.207 1.00 0.00 C ATOM 403 CE1 HIS A 29 -22.713 -9.205 7.580 1.00 0.00 C ATOM 404 NE2 HIS A 29 -22.747 -8.007 7.030 1.00 0.00 N ATOM 0 H HIS A 29 -18.309 -7.939 3.229 1.00 0.00 H new ATOM 0 HA HIS A 29 -19.358 -7.462 5.128 1.00 0.00 H new ATOM 0 HB2 HIS A 29 -19.936 -10.082 4.694 1.00 0.00 H new ATOM 0 HB3 HIS A 29 -19.139 -10.220 6.249 1.00 0.00 H new ATOM 0 HD2 HIS A 29 -21.345 -7.086 5.603 1.00 0.00 H new ATOM 0 HE1 HIS A 29 -23.449 -9.577 8.277 1.00 0.00 H new ATOM 0 HE2 HIS A 29 -23.449 -7.282 7.177 1.00 0.00 H new ATOM 412 N GLN A 30 -16.778 -7.253 6.080 1.00 0.00 N ATOM 413 CA GLN A 30 -15.736 -6.946 7.053 1.00 0.00 C ATOM 414 C GLN A 30 -14.925 -8.190 7.394 1.00 0.00 C ATOM 415 O GLN A 30 -15.147 -8.825 8.426 1.00 0.00 O ATOM 416 CB GLN A 30 -16.355 -6.362 8.324 1.00 0.00 C ATOM 417 CG GLN A 30 -17.327 -5.223 8.061 1.00 0.00 C ATOM 418 CD GLN A 30 -18.069 -4.790 9.310 1.00 0.00 C ATOM 419 OE1 GLN A 30 -17.537 -4.048 10.137 1.00 0.00 O ATOM 420 NE2 GLN A 30 -19.305 -5.253 9.455 1.00 0.00 N ATOM 0 H GLN A 30 -16.704 -6.734 5.205 1.00 0.00 H new ATOM 0 HA GLN A 30 -15.066 -6.209 6.610 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -16.875 -7.155 8.862 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -15.557 -6.005 8.975 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -16.782 -4.372 7.653 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -18.047 -5.532 7.304 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -19.707 -5.865 8.745 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -19.853 -4.996 10.276 1.00 0.00 H new ATOM 429 N ARG A 31 -13.983 -8.535 6.522 1.00 0.00 N ATOM 430 CA ARG A 31 -13.137 -9.705 6.731 1.00 0.00 C ATOM 431 C ARG A 31 -11.723 -9.452 6.219 1.00 0.00 C ATOM 432 O ARG A 31 -11.467 -8.462 5.535 1.00 0.00 O ATOM 433 CB ARG A 31 -13.736 -10.924 6.029 1.00 0.00 C ATOM 434 CG ARG A 31 -15.020 -11.426 6.669 1.00 0.00 C ATOM 435 CD ARG A 31 -14.739 -12.440 7.768 1.00 0.00 C ATOM 436 NE ARG A 31 -15.417 -12.097 9.015 1.00 0.00 N ATOM 437 CZ ARG A 31 -15.410 -12.868 10.100 1.00 0.00 C ATOM 438 NH1 ARG A 31 -14.761 -14.027 10.094 1.00 0.00 N ATOM 439 NH2 ARG A 31 -16.051 -12.482 11.194 1.00 0.00 N ATOM 0 H ARG A 31 -13.786 -8.021 5.663 1.00 0.00 H new ATOM 0 HA ARG A 31 -13.086 -9.900 7.802 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -13.934 -10.672 4.987 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -13.002 -11.729 6.028 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -15.574 -10.584 7.083 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -15.653 -11.880 5.907 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -15.061 -13.428 7.440 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -13.665 -12.497 7.943 1.00 0.00 H new ATOM 0 HE ARG A 31 -15.926 -11.214 9.057 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -14.265 -14.330 9.256 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -14.758 -14.614 10.928 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -16.551 -11.593 11.205 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -16.045 -13.074 12.025 1.00 0.00 H new ATOM 453 N ASP A 32 -10.808 -10.355 6.556 1.00 0.00 N ATOM 454 CA ASP A 32 -9.418 -10.230 6.131 1.00 0.00 C ATOM 455 C ASP A 32 -9.262 -10.617 4.664 1.00 0.00 C ATOM 456 O ASP A 32 -9.766 -11.652 4.227 1.00 0.00 O ATOM 457 CB ASP A 32 -8.516 -11.108 7.001 1.00 0.00 C ATOM 458 CG ASP A 32 -7.183 -10.451 7.296 1.00 0.00 C ATOM 459 OD1 ASP A 32 -7.160 -9.219 7.502 1.00 0.00 O ATOM 460 OD2 ASP A 32 -6.160 -11.168 7.323 1.00 0.00 O ATOM 0 H ASP A 32 -11.004 -11.181 7.122 1.00 0.00 H new ATOM 0 HA ASP A 32 -9.120 -9.188 6.247 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -9.025 -11.330 7.939 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -8.346 -12.060 6.498 1.00 0.00 H new ATOM 465 N VAL A 33 -8.562 -9.778 3.908 1.00 0.00 N ATOM 466 CA VAL A 33 -8.340 -10.032 2.489 1.00 0.00 C ATOM 467 C VAL A 33 -6.850 -10.083 2.167 1.00 0.00 C ATOM 468 O VAL A 33 -6.095 -9.179 2.529 1.00 0.00 O ATOM 469 CB VAL A 33 -9.006 -8.954 1.614 1.00 0.00 C ATOM 470 CG1 VAL A 33 -8.936 -9.339 0.144 1.00 0.00 C ATOM 471 CG2 VAL A 33 -10.447 -8.730 2.047 1.00 0.00 C ATOM 0 H VAL A 33 -8.139 -8.917 4.254 1.00 0.00 H new ATOM 0 HA VAL A 33 -8.791 -10.999 2.266 1.00 0.00 H new ATOM 0 HB VAL A 33 -8.462 -8.019 1.746 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -9.412 -8.565 -0.458 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -7.893 -9.442 -0.156 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -9.453 -10.286 -0.009 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -10.901 -7.965 1.417 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -11.006 -9.661 1.948 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -10.468 -8.404 3.087 1.00 0.00 H new ATOM 481 N LEU A 34 -6.433 -11.143 1.484 1.00 0.00 N ATOM 482 CA LEU A 34 -5.033 -11.312 1.113 1.00 0.00 C ATOM 483 C LEU A 34 -4.903 -11.681 -0.361 1.00 0.00 C ATOM 484 O LEU A 34 -5.617 -12.550 -0.860 1.00 0.00 O ATOM 485 CB LEU A 34 -4.379 -12.388 1.980 1.00 0.00 C ATOM 486 CG LEU A 34 -2.860 -12.501 1.838 1.00 0.00 C ATOM 487 CD1 LEU A 34 -2.181 -11.249 2.371 1.00 0.00 C ATOM 488 CD2 LEU A 34 -2.348 -13.737 2.560 1.00 0.00 C ATOM 0 H LEU A 34 -7.045 -11.899 1.176 1.00 0.00 H new ATOM 0 HA LEU A 34 -4.522 -10.364 1.279 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -4.617 -12.185 3.024 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -4.824 -13.352 1.733 1.00 0.00 H new ATOM 0 HG LEU A 34 -2.618 -12.598 0.780 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -1.101 -11.347 2.262 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -2.525 -10.381 1.809 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -2.429 -11.121 3.425 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -1.266 -13.801 2.448 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -2.600 -13.671 3.618 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -2.810 -14.626 2.132 1.00 0.00 H new ATOM 500 N LEU A 35 -3.985 -11.013 -1.054 1.00 0.00 N ATOM 501 CA LEU A 35 -3.760 -11.270 -2.472 1.00 0.00 C ATOM 502 C LEU A 35 -2.270 -11.379 -2.775 1.00 0.00 C ATOM 503 O LEU A 35 -1.531 -10.400 -2.669 1.00 0.00 O ATOM 504 CB LEU A 35 -4.385 -10.159 -3.317 1.00 0.00 C ATOM 505 CG LEU A 35 -5.874 -9.912 -3.065 1.00 0.00 C ATOM 506 CD1 LEU A 35 -6.192 -8.427 -3.148 1.00 0.00 C ATOM 507 CD2 LEU A 35 -6.719 -10.696 -4.057 1.00 0.00 C ATOM 0 H LEU A 35 -3.385 -10.290 -0.656 1.00 0.00 H new ATOM 0 HA LEU A 35 -4.233 -12.219 -2.724 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -3.842 -9.232 -3.130 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -4.246 -10.403 -4.370 1.00 0.00 H new ATOM 0 HG LEU A 35 -6.114 -10.257 -2.060 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -7.255 -8.272 -2.966 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -5.613 -7.888 -2.398 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -5.936 -8.055 -4.140 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -7.775 -10.509 -3.863 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -6.475 -10.381 -5.072 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -6.514 -11.761 -3.948 1.00 0.00 H new ATOM 519 N THR A 36 -1.834 -12.576 -3.153 1.00 0.00 N ATOM 520 CA THR A 36 -0.430 -12.813 -3.473 1.00 0.00 C ATOM 521 C THR A 36 -0.292 -13.838 -4.594 1.00 0.00 C ATOM 522 O THR A 36 -1.253 -14.525 -4.942 1.00 0.00 O ATOM 523 CB THR A 36 0.323 -13.292 -2.231 1.00 0.00 C ATOM 524 OG1 THR A 36 1.600 -13.795 -2.582 1.00 0.00 O ATOM 525 CG2 THR A 36 -0.405 -14.380 -1.472 1.00 0.00 C ATOM 0 H THR A 36 -2.432 -13.397 -3.245 1.00 0.00 H new ATOM 0 HA THR A 36 0.004 -11.872 -3.812 1.00 0.00 H new ATOM 0 HB THR A 36 0.406 -12.416 -1.588 1.00 0.00 H new ATOM 0 HG1 THR A 36 2.067 -14.095 -1.774 1.00 0.00 H new ATOM 0 HG21 THR A 36 0.184 -14.674 -0.603 1.00 0.00 H new ATOM 0 HG22 THR A 36 -1.375 -14.008 -1.144 1.00 0.00 H new ATOM 0 HG23 THR A 36 -0.548 -15.243 -2.122 1.00 0.00 H new ATOM 533 N GLU A 37 0.908 -13.934 -5.156 1.00 0.00 N ATOM 534 CA GLU A 37 1.172 -14.875 -6.239 1.00 0.00 C ATOM 535 C GLU A 37 0.280 -14.583 -7.441 1.00 0.00 C ATOM 536 O GLU A 37 -0.149 -15.496 -8.145 1.00 0.00 O ATOM 537 CB GLU A 37 0.949 -16.311 -5.761 1.00 0.00 C ATOM 538 CG GLU A 37 2.187 -16.947 -5.148 1.00 0.00 C ATOM 539 CD GLU A 37 2.435 -18.353 -5.659 1.00 0.00 C ATOM 540 OE1 GLU A 37 2.364 -18.559 -6.889 1.00 0.00 O ATOM 541 OE2 GLU A 37 2.701 -19.248 -4.829 1.00 0.00 O ATOM 0 H GLU A 37 1.713 -13.372 -4.880 1.00 0.00 H new ATOM 0 HA GLU A 37 2.212 -14.758 -6.543 1.00 0.00 H new ATOM 0 HB2 GLU A 37 0.144 -16.320 -5.026 1.00 0.00 H new ATOM 0 HB3 GLU A 37 0.618 -16.918 -6.603 1.00 0.00 H new ATOM 0 HG2 GLU A 37 3.056 -16.326 -5.367 1.00 0.00 H new ATOM 0 HG3 GLU A 37 2.079 -16.972 -4.064 1.00 0.00 H new ATOM 548 N LEU A 38 0.006 -13.303 -7.670 1.00 0.00 N ATOM 549 CA LEU A 38 -0.834 -12.887 -8.788 1.00 0.00 C ATOM 550 C LEU A 38 -0.068 -11.968 -9.734 1.00 0.00 C ATOM 551 O LEU A 38 0.840 -11.250 -9.316 1.00 0.00 O ATOM 552 CB LEU A 38 -2.088 -12.178 -8.272 1.00 0.00 C ATOM 553 CG LEU A 38 -2.906 -12.969 -7.251 1.00 0.00 C ATOM 554 CD1 LEU A 38 -3.476 -12.042 -6.188 1.00 0.00 C ATOM 555 CD2 LEU A 38 -4.022 -13.738 -7.944 1.00 0.00 C ATOM 0 H LEU A 38 0.354 -12.535 -7.096 1.00 0.00 H new ATOM 0 HA LEU A 38 -1.129 -13.779 -9.340 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -1.792 -11.231 -7.822 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -2.728 -11.941 -9.122 1.00 0.00 H new ATOM 0 HG LEU A 38 -2.246 -13.685 -6.762 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -4.055 -12.624 -5.471 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -2.660 -11.536 -5.671 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -4.122 -11.301 -6.660 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -4.594 -14.296 -7.203 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -4.680 -13.039 -8.460 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -3.592 -14.431 -8.667 1.00 0.00 H new ATOM 567 N SER A 39 -0.440 -11.996 -11.009 1.00 0.00 N ATOM 568 CA SER A 39 0.212 -11.165 -12.014 1.00 0.00 C ATOM 569 C SER A 39 -0.783 -10.723 -13.082 1.00 0.00 C ATOM 570 O SER A 39 -1.453 -11.549 -13.702 1.00 0.00 O ATOM 571 CB SER A 39 1.370 -11.926 -12.662 1.00 0.00 C ATOM 572 OG SER A 39 2.602 -11.610 -12.035 1.00 0.00 O ATOM 0 H SER A 39 -1.190 -12.585 -11.371 1.00 0.00 H new ATOM 0 HA SER A 39 0.603 -10.277 -11.518 1.00 0.00 H new ATOM 0 HB2 SER A 39 1.188 -12.999 -12.594 1.00 0.00 H new ATOM 0 HB3 SER A 39 1.424 -11.679 -13.722 1.00 0.00 H new ATOM 0 HG SER A 39 2.449 -11.433 -11.083 1.00 0.00 H new ATOM 578 N ASN A 40 -0.876 -9.413 -13.291 1.00 0.00 N ATOM 579 CA ASN A 40 -1.790 -8.860 -14.284 1.00 0.00 C ATOM 580 C ASN A 40 -3.235 -9.222 -13.954 1.00 0.00 C ATOM 581 O ASN A 40 -4.066 -9.376 -14.849 1.00 0.00 O ATOM 582 CB ASN A 40 -1.430 -9.371 -15.680 1.00 0.00 C ATOM 583 CG ASN A 40 -1.711 -8.345 -16.761 1.00 0.00 C ATOM 584 OD1 ASN A 40 -2.395 -8.634 -17.744 1.00 0.00 O ATOM 585 ND2 ASN A 40 -1.184 -7.140 -16.584 1.00 0.00 N ATOM 0 H ASN A 40 -0.330 -8.715 -12.786 1.00 0.00 H new ATOM 0 HA ASN A 40 -1.693 -7.774 -14.266 1.00 0.00 H new ATOM 0 HB2 ASN A 40 -0.374 -9.641 -15.704 1.00 0.00 H new ATOM 0 HB3 ASN A 40 -1.996 -10.279 -15.889 1.00 0.00 H new ATOM 0 HD21 ASN A 40 -1.339 -6.409 -17.278 1.00 0.00 H new ATOM 0 HD22 ASN A 40 -0.624 -6.945 -15.754 1.00 0.00 H new ATOM 592 N CYS A 41 -3.526 -9.354 -12.664 1.00 0.00 N ATOM 593 CA CYS A 41 -4.870 -9.698 -12.216 1.00 0.00 C ATOM 594 C CYS A 41 -5.531 -8.513 -11.519 1.00 0.00 C ATOM 595 O CYS A 41 -5.051 -8.039 -10.489 1.00 0.00 O ATOM 596 CB CYS A 41 -4.824 -10.898 -11.270 1.00 0.00 C ATOM 597 SG CYS A 41 -6.446 -11.603 -10.893 1.00 0.00 S ATOM 0 H CYS A 41 -2.849 -9.228 -11.911 1.00 0.00 H new ATOM 0 HA CYS A 41 -5.462 -9.958 -13.093 1.00 0.00 H new ATOM 0 HB2 CYS A 41 -4.197 -11.672 -11.713 1.00 0.00 H new ATOM 0 HB3 CYS A 41 -4.346 -10.595 -10.338 1.00 0.00 H new ATOM 0 HG CYS A 41 -6.303 -12.614 -10.088 1.00 0.00 H new ATOM 603 N THR A 42 -6.634 -8.038 -12.088 1.00 0.00 N ATOM 604 CA THR A 42 -7.361 -6.908 -11.522 1.00 0.00 C ATOM 605 C THR A 42 -8.378 -7.378 -10.487 1.00 0.00 C ATOM 606 O THR A 42 -8.969 -8.450 -10.626 1.00 0.00 O ATOM 607 CB THR A 42 -8.066 -6.122 -12.628 1.00 0.00 C ATOM 608 OG1 THR A 42 -7.225 -5.980 -13.758 1.00 0.00 O ATOM 609 CG2 THR A 42 -8.496 -4.737 -12.198 1.00 0.00 C ATOM 0 H THR A 42 -7.044 -8.418 -12.941 1.00 0.00 H new ATOM 0 HA THR A 42 -6.641 -6.257 -11.027 1.00 0.00 H new ATOM 0 HB THR A 42 -8.957 -6.702 -12.870 1.00 0.00 H new ATOM 0 HG1 THR A 42 -7.695 -5.476 -14.455 1.00 0.00 H new ATOM 0 HG21 THR A 42 -8.989 -4.234 -13.030 1.00 0.00 H new ATOM 0 HG22 THR A 42 -9.188 -4.815 -11.359 1.00 0.00 H new ATOM 0 HG23 THR A 42 -7.621 -4.162 -11.894 1.00 0.00 H new ATOM 617 N VAL A 43 -8.579 -6.571 -9.451 1.00 0.00 N ATOM 618 CA VAL A 43 -9.524 -6.905 -8.394 1.00 0.00 C ATOM 619 C VAL A 43 -10.381 -5.700 -8.022 1.00 0.00 C ATOM 620 O VAL A 43 -9.875 -4.586 -7.880 1.00 0.00 O ATOM 621 CB VAL A 43 -8.802 -7.415 -7.133 1.00 0.00 C ATOM 622 CG1 VAL A 43 -9.804 -7.945 -6.120 1.00 0.00 C ATOM 623 CG2 VAL A 43 -7.783 -8.484 -7.497 1.00 0.00 C ATOM 0 H VAL A 43 -8.099 -5.680 -9.321 1.00 0.00 H new ATOM 0 HA VAL A 43 -10.164 -7.698 -8.782 1.00 0.00 H new ATOM 0 HB VAL A 43 -8.270 -6.579 -6.678 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -9.274 -8.301 -5.236 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -10.490 -7.147 -5.835 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -10.367 -8.768 -6.561 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -7.283 -8.832 -6.593 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -8.290 -9.321 -7.977 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -7.045 -8.065 -8.182 1.00 0.00 H new ATOM 633 N ARG A 44 -11.680 -5.930 -7.865 1.00 0.00 N ATOM 634 CA ARG A 44 -12.608 -4.862 -7.510 1.00 0.00 C ATOM 635 C ARG A 44 -13.462 -5.262 -6.311 1.00 0.00 C ATOM 636 O ARG A 44 -14.328 -6.130 -6.414 1.00 0.00 O ATOM 637 CB ARG A 44 -13.507 -4.521 -8.700 1.00 0.00 C ATOM 638 CG ARG A 44 -12.740 -4.042 -9.922 1.00 0.00 C ATOM 639 CD ARG A 44 -13.439 -4.445 -11.211 1.00 0.00 C ATOM 640 NE ARG A 44 -14.342 -3.404 -11.694 1.00 0.00 N ATOM 641 CZ ARG A 44 -13.939 -2.324 -12.361 1.00 0.00 C ATOM 642 NH1 ARG A 44 -12.652 -2.139 -12.625 1.00 0.00 N ATOM 643 NH2 ARG A 44 -14.828 -1.426 -12.766 1.00 0.00 N ATOM 0 H ARG A 44 -12.114 -6.846 -7.978 1.00 0.00 H new ATOM 0 HA ARG A 44 -12.024 -3.981 -7.242 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -14.090 -5.402 -8.969 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -14.216 -3.749 -8.400 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -12.637 -2.957 -9.886 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -11.733 -4.459 -9.907 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -12.693 -4.661 -11.976 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -14.001 -5.364 -11.046 1.00 0.00 H new ATOM 0 HE ARG A 44 -15.340 -3.510 -11.510 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -11.964 -2.826 -12.317 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -12.350 -1.310 -13.136 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -15.819 -1.563 -12.566 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -14.521 -0.598 -13.277 1.00 0.00 H new ATOM 657 N LEU A 45 -13.212 -4.622 -5.173 1.00 0.00 N ATOM 658 CA LEU A 45 -13.958 -4.910 -3.954 1.00 0.00 C ATOM 659 C LEU A 45 -14.889 -3.755 -3.601 1.00 0.00 C ATOM 660 O LEU A 45 -14.501 -2.589 -3.672 1.00 0.00 O ATOM 661 CB LEU A 45 -12.998 -5.179 -2.791 1.00 0.00 C ATOM 662 CG LEU A 45 -11.694 -5.883 -3.174 1.00 0.00 C ATOM 663 CD1 LEU A 45 -10.658 -5.722 -2.073 1.00 0.00 C ATOM 664 CD2 LEU A 45 -11.948 -7.356 -3.456 1.00 0.00 C ATOM 0 H LEU A 45 -12.498 -3.901 -5.070 1.00 0.00 H new ATOM 0 HA LEU A 45 -14.561 -5.801 -4.131 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -12.754 -4.229 -2.315 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -13.515 -5.785 -2.047 1.00 0.00 H new ATOM 0 HG LEU A 45 -11.306 -5.420 -4.081 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -9.738 -6.229 -2.363 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -10.455 -4.663 -1.916 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -11.038 -6.159 -1.149 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -11.010 -7.842 -3.727 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -12.359 -7.831 -2.565 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -12.657 -7.452 -4.278 1.00 0.00 H new ATOM 676 N TYR A 46 -16.118 -4.086 -3.219 1.00 0.00 N ATOM 677 CA TYR A 46 -17.104 -3.074 -2.856 1.00 0.00 C ATOM 678 C TYR A 46 -17.812 -3.446 -1.556 1.00 0.00 C ATOM 679 O TYR A 46 -18.703 -4.295 -1.544 1.00 0.00 O ATOM 680 CB TYR A 46 -18.129 -2.905 -3.978 1.00 0.00 C ATOM 681 CG TYR A 46 -17.514 -2.527 -5.307 1.00 0.00 C ATOM 682 CD1 TYR A 46 -16.822 -1.332 -5.458 1.00 0.00 C ATOM 683 CD2 TYR A 46 -17.626 -3.364 -6.410 1.00 0.00 C ATOM 684 CE1 TYR A 46 -16.259 -0.982 -6.671 1.00 0.00 C ATOM 685 CE2 TYR A 46 -17.066 -3.021 -7.625 1.00 0.00 C ATOM 686 CZ TYR A 46 -16.383 -1.830 -7.750 1.00 0.00 C ATOM 687 OH TYR A 46 -15.824 -1.485 -8.960 1.00 0.00 O ATOM 0 H TYR A 46 -16.455 -5.046 -3.153 1.00 0.00 H new ATOM 0 HA TYR A 46 -16.581 -2.130 -2.707 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -18.684 -3.836 -4.095 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -18.849 -2.139 -3.689 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -16.722 -0.666 -4.614 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -18.160 -4.298 -6.316 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -15.725 -0.049 -6.772 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -17.163 -3.683 -8.473 1.00 0.00 H new ATOM 0 HH TYR A 46 -16.018 -0.544 -9.153 1.00 0.00 H new ATOM 697 N GLY A 47 -17.408 -2.803 -0.465 1.00 0.00 N ATOM 698 CA GLY A 47 -18.013 -3.078 0.825 1.00 0.00 C ATOM 699 C GLY A 47 -17.290 -2.389 1.964 1.00 0.00 C ATOM 700 O GLY A 47 -17.350 -1.166 2.096 1.00 0.00 O ATOM 0 H GLY A 47 -16.672 -2.096 -0.451 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -19.054 -2.754 0.811 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -18.016 -4.154 0.999 1.00 0.00 H new ATOM 704 N ASN A 48 -16.601 -3.173 2.787 1.00 0.00 N ATOM 705 CA ASN A 48 -15.862 -2.630 3.921 1.00 0.00 C ATOM 706 C ASN A 48 -15.087 -3.732 4.643 1.00 0.00 C ATOM 707 O ASN A 48 -15.380 -4.061 5.793 1.00 0.00 O ATOM 708 CB ASN A 48 -16.819 -1.928 4.889 1.00 0.00 C ATOM 709 CG ASN A 48 -16.326 -0.551 5.291 1.00 0.00 C ATOM 710 OD1 ASN A 48 -15.117 -0.492 5.839 1.00 0.00 O flip ATOM 711 ND2 ASN A 48 -17.023 0.447 5.111 1.00 0.00 N flip ATOM 0 H ASN A 48 -16.539 -4.186 2.690 1.00 0.00 H new ATOM 0 HA ASN A 48 -15.144 -1.900 3.545 1.00 0.00 H new ATOM 0 HB2 ASN A 48 -17.801 -1.838 4.424 1.00 0.00 H new ATOM 0 HB3 ASN A 48 -16.944 -2.541 5.781 1.00 0.00 H new ATOM 0 HD21 ASN A 48 -17.946 0.355 4.686 1.00 0.00 H new ATOM 0 HD22 ASN A 48 -16.678 1.367 5.386 1.00 0.00 H new ATOM 718 N PRO A 49 -14.082 -4.320 3.973 1.00 0.00 N ATOM 719 CA PRO A 49 -13.263 -5.389 4.554 1.00 0.00 C ATOM 720 C PRO A 49 -12.682 -5.001 5.910 1.00 0.00 C ATOM 721 O PRO A 49 -12.710 -3.833 6.297 1.00 0.00 O ATOM 722 CB PRO A 49 -12.145 -5.581 3.528 1.00 0.00 C ATOM 723 CG PRO A 49 -12.724 -5.108 2.241 1.00 0.00 C ATOM 724 CD PRO A 49 -13.664 -3.990 2.597 1.00 0.00 C ATOM 0 HA PRO A 49 -13.845 -6.291 4.741 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -11.258 -5.007 3.797 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -11.841 -6.626 3.465 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -11.942 -4.761 1.566 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -13.251 -5.914 1.731 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -13.170 -3.019 2.549 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -14.515 -3.949 1.917 1.00 0.00 H new ATOM 732 N ASN A 50 -12.155 -5.989 6.625 1.00 0.00 N ATOM 733 CA ASN A 50 -11.564 -5.752 7.938 1.00 0.00 C ATOM 734 C ASN A 50 -10.172 -5.143 7.805 1.00 0.00 C ATOM 735 O ASN A 50 -9.931 -4.019 8.247 1.00 0.00 O ATOM 736 CB ASN A 50 -11.489 -7.058 8.731 1.00 0.00 C ATOM 737 CG ASN A 50 -11.340 -6.822 10.221 1.00 0.00 C ATOM 738 OD1 ASN A 50 -12.299 -6.467 10.905 1.00 0.00 O ATOM 739 ND2 ASN A 50 -10.129 -7.019 10.732 1.00 0.00 N ATOM 0 H ASN A 50 -12.125 -6.961 6.318 1.00 0.00 H new ATOM 0 HA ASN A 50 -12.200 -5.047 8.473 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -12.390 -7.644 8.547 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -10.646 -7.649 8.373 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -9.967 -6.876 11.729 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -9.362 -7.313 10.127 1.00 0.00 H new ATOM 746 N THR A 51 -9.261 -5.892 7.194 1.00 0.00 N ATOM 747 CA THR A 51 -7.892 -5.425 7.002 1.00 0.00 C ATOM 748 C THR A 51 -7.331 -5.920 5.673 1.00 0.00 C ATOM 749 O THR A 51 -7.083 -7.113 5.498 1.00 0.00 O ATOM 750 CB THR A 51 -7.004 -5.901 8.153 1.00 0.00 C ATOM 751 OG1 THR A 51 -7.735 -5.948 9.365 1.00 0.00 O ATOM 752 CG2 THR A 51 -5.796 -5.018 8.380 1.00 0.00 C ATOM 0 H THR A 51 -9.445 -6.824 6.823 1.00 0.00 H new ATOM 0 HA THR A 51 -7.904 -4.335 6.988 1.00 0.00 H new ATOM 0 HB THR A 51 -6.660 -6.893 7.861 1.00 0.00 H new ATOM 0 HG1 THR A 51 -7.948 -5.036 9.654 1.00 0.00 H new ATOM 0 HG21 THR A 51 -5.209 -5.411 9.210 1.00 0.00 H new ATOM 0 HG22 THR A 51 -5.184 -5.000 7.478 1.00 0.00 H new ATOM 0 HG23 THR A 51 -6.124 -4.006 8.616 1.00 0.00 H new ATOM 760 N LEU A 52 -7.134 -4.995 4.739 1.00 0.00 N ATOM 761 CA LEU A 52 -6.603 -5.337 3.425 1.00 0.00 C ATOM 762 C LEU A 52 -5.119 -5.679 3.510 1.00 0.00 C ATOM 763 O LEU A 52 -4.414 -5.212 4.405 1.00 0.00 O ATOM 764 CB LEU A 52 -6.816 -4.178 2.449 1.00 0.00 C ATOM 765 CG LEU A 52 -6.591 -4.523 0.975 1.00 0.00 C ATOM 766 CD1 LEU A 52 -7.787 -5.278 0.416 1.00 0.00 C ATOM 767 CD2 LEU A 52 -6.330 -3.260 0.167 1.00 0.00 C ATOM 0 H LEU A 52 -7.334 -4.003 4.868 1.00 0.00 H new ATOM 0 HA LEU A 52 -7.139 -6.213 3.061 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -7.833 -3.805 2.568 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -6.144 -3.364 2.723 1.00 0.00 H new ATOM 0 HG LEU A 52 -5.714 -5.166 0.901 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -7.610 -5.515 -0.633 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -7.929 -6.201 0.978 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -8.680 -4.659 0.502 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -6.172 -3.523 -0.879 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -7.188 -2.593 0.248 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -5.443 -2.758 0.553 1.00 0.00 H new ATOM 779 N ARG A 53 -4.651 -6.497 2.574 1.00 0.00 N ATOM 780 CA ARG A 53 -3.250 -6.902 2.542 1.00 0.00 C ATOM 781 C ARG A 53 -2.854 -7.389 1.153 1.00 0.00 C ATOM 782 O ARG A 53 -3.408 -8.362 0.643 1.00 0.00 O ATOM 783 CB ARG A 53 -2.992 -8.003 3.574 1.00 0.00 C ATOM 784 CG ARG A 53 -1.528 -8.150 3.954 1.00 0.00 C ATOM 785 CD ARG A 53 -1.344 -9.148 5.086 1.00 0.00 C ATOM 786 NE ARG A 53 -1.184 -8.486 6.379 1.00 0.00 N ATOM 787 CZ ARG A 53 -0.082 -7.838 6.749 1.00 0.00 C ATOM 788 NH1 ARG A 53 0.958 -7.761 5.927 1.00 0.00 N ATOM 789 NH2 ARG A 53 -0.019 -7.264 7.943 1.00 0.00 N ATOM 0 H ARG A 53 -5.221 -6.893 1.827 1.00 0.00 H new ATOM 0 HA ARG A 53 -2.642 -6.032 2.788 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -3.572 -7.791 4.472 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -3.353 -8.952 3.178 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -0.956 -8.475 3.085 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -1.130 -7.181 4.254 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -2.205 -9.815 5.124 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -0.470 -9.767 4.885 1.00 0.00 H new ATOM 0 HE ARG A 53 -1.963 -8.523 7.037 1.00 0.00 H new ATOM 0 HH11 ARG A 53 0.915 -8.200 5.007 1.00 0.00 H new ATOM 0 HH12 ARG A 53 1.800 -7.263 6.215 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -0.815 -7.319 8.578 1.00 0.00 H new ATOM 0 HH22 ARG A 53 0.826 -6.767 8.226 1.00 0.00 H new ATOM 803 N LEU A 54 -1.889 -6.705 0.545 1.00 0.00 N ATOM 804 CA LEU A 54 -1.416 -7.067 -0.786 1.00 0.00 C ATOM 805 C LEU A 54 0.097 -7.255 -0.789 1.00 0.00 C ATOM 806 O LEU A 54 0.845 -6.361 -0.390 1.00 0.00 O ATOM 807 CB LEU A 54 -1.811 -5.992 -1.801 1.00 0.00 C ATOM 808 CG LEU A 54 -1.436 -6.303 -3.251 1.00 0.00 C ATOM 809 CD1 LEU A 54 -2.574 -7.026 -3.953 1.00 0.00 C ATOM 810 CD2 LEU A 54 -1.076 -5.025 -3.994 1.00 0.00 C ATOM 0 H LEU A 54 -1.420 -5.897 0.954 1.00 0.00 H new ATOM 0 HA LEU A 54 -1.883 -8.010 -1.068 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -2.889 -5.839 -1.745 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -1.340 -5.052 -1.513 1.00 0.00 H new ATOM 0 HG LEU A 54 -0.564 -6.957 -3.248 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -2.289 -7.239 -4.983 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -2.786 -7.961 -3.434 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -3.464 -6.397 -3.945 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -0.812 -5.265 -5.024 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -1.930 -4.347 -3.987 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -0.228 -4.546 -3.504 1.00 0.00 H new ATOM 822 N THR A 55 0.544 -8.421 -1.243 1.00 0.00 N ATOM 823 CA THR A 55 1.969 -8.725 -1.296 1.00 0.00 C ATOM 824 C THR A 55 2.288 -9.643 -2.471 1.00 0.00 C ATOM 825 O THR A 55 1.431 -10.396 -2.934 1.00 0.00 O ATOM 826 CB THR A 55 2.422 -9.374 0.013 1.00 0.00 C ATOM 827 OG1 THR A 55 1.905 -10.688 0.125 1.00 0.00 O ATOM 828 CG2 THR A 55 1.993 -8.605 1.243 1.00 0.00 C ATOM 0 H THR A 55 -0.060 -9.171 -1.580 1.00 0.00 H new ATOM 0 HA THR A 55 2.509 -7.789 -1.435 1.00 0.00 H new ATOM 0 HB THR A 55 3.511 -9.380 -0.029 1.00 0.00 H new ATOM 0 HG1 THR A 55 2.207 -11.088 0.967 1.00 0.00 H new ATOM 0 HG21 THR A 55 2.347 -9.120 2.136 1.00 0.00 H new ATOM 0 HG22 THR A 55 2.417 -7.601 1.211 1.00 0.00 H new ATOM 0 HG23 THR A 55 0.905 -8.539 1.270 1.00 0.00 H new ATOM 836 N LYS A 56 3.527 -9.576 -2.948 1.00 0.00 N ATOM 837 CA LYS A 56 3.961 -10.402 -4.068 1.00 0.00 C ATOM 838 C LYS A 56 3.113 -10.131 -5.307 1.00 0.00 C ATOM 839 O LYS A 56 2.824 -11.039 -6.085 1.00 0.00 O ATOM 840 CB LYS A 56 3.882 -11.884 -3.696 1.00 0.00 C ATOM 841 CG LYS A 56 4.782 -12.267 -2.533 1.00 0.00 C ATOM 842 CD LYS A 56 6.206 -12.534 -2.994 1.00 0.00 C ATOM 843 CE LYS A 56 7.131 -12.807 -1.820 1.00 0.00 C ATOM 844 NZ LYS A 56 8.561 -12.836 -2.234 1.00 0.00 N ATOM 0 H LYS A 56 4.248 -8.958 -2.576 1.00 0.00 H new ATOM 0 HA LYS A 56 4.996 -10.146 -4.296 1.00 0.00 H new ATOM 0 HB2 LYS A 56 2.851 -12.133 -3.444 1.00 0.00 H new ATOM 0 HB3 LYS A 56 4.151 -12.483 -4.566 1.00 0.00 H new ATOM 0 HG2 LYS A 56 4.782 -11.467 -1.793 1.00 0.00 H new ATOM 0 HG3 LYS A 56 4.385 -13.155 -2.042 1.00 0.00 H new ATOM 0 HD2 LYS A 56 6.216 -13.387 -3.672 1.00 0.00 H new ATOM 0 HD3 LYS A 56 6.574 -11.676 -3.556 1.00 0.00 H new ATOM 0 HE2 LYS A 56 6.989 -12.039 -1.060 1.00 0.00 H new ATOM 0 HE3 LYS A 56 6.866 -13.761 -1.363 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 9.161 -12.991 -1.399 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 8.710 -13.608 -2.915 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 8.813 -11.929 -2.677 1.00 0.00 H new ATOM 858 N ALA A 57 2.718 -8.874 -5.482 1.00 0.00 N ATOM 859 CA ALA A 57 1.904 -8.483 -6.627 1.00 0.00 C ATOM 860 C ALA A 57 2.730 -7.707 -7.647 1.00 0.00 C ATOM 861 O ALA A 57 3.595 -6.912 -7.284 1.00 0.00 O ATOM 862 CB ALA A 57 0.714 -7.652 -6.168 1.00 0.00 C ATOM 0 H ALA A 57 2.948 -8.110 -4.847 1.00 0.00 H new ATOM 0 HA ALA A 57 1.537 -9.390 -7.108 1.00 0.00 H new ATOM 0 HB1 ALA A 57 0.114 -7.367 -7.032 1.00 0.00 H new ATOM 0 HB2 ALA A 57 0.104 -8.239 -5.481 1.00 0.00 H new ATOM 0 HB3 ALA A 57 1.070 -6.755 -5.661 1.00 0.00 H new ATOM 868 N HIS A 58 2.455 -7.944 -8.926 1.00 0.00 N ATOM 869 CA HIS A 58 3.174 -7.266 -9.999 1.00 0.00 C ATOM 870 C HIS A 58 2.252 -6.986 -11.181 1.00 0.00 C ATOM 871 O HIS A 58 1.585 -7.887 -11.688 1.00 0.00 O ATOM 872 CB HIS A 58 4.365 -8.110 -10.455 1.00 0.00 C ATOM 873 CG HIS A 58 5.367 -7.344 -11.263 1.00 0.00 C ATOM 874 ND1 HIS A 58 5.052 -6.624 -12.393 1.00 0.00 N ATOM 875 CD2 HIS A 58 6.703 -7.194 -11.083 1.00 0.00 C ATOM 876 CE1 HIS A 58 6.181 -6.070 -12.856 1.00 0.00 C ATOM 877 NE2 HIS A 58 7.212 -6.385 -12.096 1.00 0.00 N ATOM 0 H HIS A 58 1.741 -8.599 -9.244 1.00 0.00 H new ATOM 0 HA HIS A 58 3.538 -6.314 -9.613 1.00 0.00 H new ATOM 0 HB2 HIS A 58 4.860 -8.528 -9.579 1.00 0.00 H new ATOM 0 HB3 HIS A 58 4.000 -8.950 -11.046 1.00 0.00 H new ATOM 0 HD2 HIS A 58 7.280 -7.632 -10.282 1.00 0.00 H new ATOM 0 HE1 HIS A 58 6.239 -5.447 -13.736 1.00 0.00 H new ATOM 0 HE2 HIS A 58 8.182 -6.096 -12.224 1.00 0.00 H new ATOM 885 N SER A 59 2.223 -5.731 -11.617 1.00 0.00 N ATOM 886 CA SER A 59 1.384 -5.331 -12.742 1.00 0.00 C ATOM 887 C SER A 59 -0.086 -5.629 -12.462 1.00 0.00 C ATOM 888 O SER A 59 -0.860 -5.901 -13.379 1.00 0.00 O ATOM 889 CB SER A 59 1.827 -6.051 -14.017 1.00 0.00 C ATOM 890 OG SER A 59 3.225 -5.931 -14.211 1.00 0.00 O ATOM 0 H SER A 59 2.770 -4.973 -11.209 1.00 0.00 H new ATOM 0 HA SER A 59 1.497 -4.256 -12.880 1.00 0.00 H new ATOM 0 HB2 SER A 59 1.554 -7.105 -13.957 1.00 0.00 H new ATOM 0 HB3 SER A 59 1.300 -5.634 -14.875 1.00 0.00 H new ATOM 0 HG SER A 59 3.696 -6.467 -13.539 1.00 0.00 H new ATOM 896 N CYS A 60 -0.464 -5.578 -11.188 1.00 0.00 N ATOM 897 CA CYS A 60 -1.841 -5.843 -10.788 1.00 0.00 C ATOM 898 C CYS A 60 -2.501 -4.583 -10.239 1.00 0.00 C ATOM 899 O CYS A 60 -1.870 -3.798 -9.530 1.00 0.00 O ATOM 900 CB CYS A 60 -1.884 -6.955 -9.738 1.00 0.00 C ATOM 901 SG CYS A 60 -0.936 -8.428 -10.184 1.00 0.00 S ATOM 0 H CYS A 60 0.164 -5.356 -10.416 1.00 0.00 H new ATOM 0 HA CYS A 60 -2.394 -6.165 -11.671 1.00 0.00 H new ATOM 0 HB2 CYS A 60 -1.504 -6.564 -8.794 1.00 0.00 H new ATOM 0 HB3 CYS A 60 -2.922 -7.241 -9.570 1.00 0.00 H new ATOM 0 HG CYS A 60 0.077 -8.085 -10.923 1.00 0.00 H new ATOM 907 N LYS A 61 -3.776 -4.396 -10.569 1.00 0.00 N ATOM 908 CA LYS A 61 -4.522 -3.231 -10.108 1.00 0.00 C ATOM 909 C LYS A 61 -5.501 -3.615 -9.004 1.00 0.00 C ATOM 910 O LYS A 61 -6.279 -4.558 -9.150 1.00 0.00 O ATOM 911 CB LYS A 61 -5.278 -2.589 -11.273 1.00 0.00 C ATOM 912 CG LYS A 61 -4.385 -2.216 -12.446 1.00 0.00 C ATOM 913 CD LYS A 61 -5.038 -1.164 -13.329 1.00 0.00 C ATOM 914 CE LYS A 61 -6.242 -1.725 -14.066 1.00 0.00 C ATOM 915 NZ LYS A 61 -6.342 -1.192 -15.453 1.00 0.00 N ATOM 0 H LYS A 61 -4.313 -5.036 -11.154 1.00 0.00 H new ATOM 0 HA LYS A 61 -3.810 -2.511 -9.705 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -6.049 -3.278 -11.619 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -5.787 -1.694 -10.916 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -3.432 -1.840 -12.074 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -4.168 -3.106 -13.037 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -5.347 -0.316 -12.718 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -4.311 -0.790 -14.050 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -6.173 -2.812 -14.099 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -7.151 -1.480 -13.516 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -7.176 -1.599 -15.922 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -6.433 -0.157 -15.421 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -5.486 -1.448 -15.986 1.00 0.00 H new ATOM 929 N LEU A 62 -5.456 -2.878 -7.898 1.00 0.00 N ATOM 930 CA LEU A 62 -6.341 -3.143 -6.768 1.00 0.00 C ATOM 931 C LEU A 62 -7.217 -1.932 -6.467 1.00 0.00 C ATOM 932 O LEU A 62 -6.719 -0.816 -6.312 1.00 0.00 O ATOM 933 CB LEU A 62 -5.524 -3.516 -5.530 1.00 0.00 C ATOM 934 CG LEU A 62 -6.334 -4.116 -4.378 1.00 0.00 C ATOM 935 CD1 LEU A 62 -7.144 -5.309 -4.861 1.00 0.00 C ATOM 936 CD2 LEU A 62 -5.413 -4.520 -3.237 1.00 0.00 C ATOM 0 H LEU A 62 -4.818 -2.094 -7.760 1.00 0.00 H new ATOM 0 HA LEU A 62 -6.988 -3.979 -7.034 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -4.754 -4.229 -5.823 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -5.012 -2.624 -5.169 1.00 0.00 H new ATOM 0 HG LEU A 62 -7.026 -3.359 -4.010 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -7.714 -5.723 -4.029 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -7.829 -4.990 -5.646 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -6.471 -6.071 -5.254 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -6.004 -4.945 -2.426 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -4.698 -5.262 -3.592 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -4.876 -3.643 -2.875 1.00 0.00 H new ATOM 948 N LEU A 63 -8.523 -2.159 -6.387 1.00 0.00 N ATOM 949 CA LEU A 63 -9.469 -1.086 -6.104 1.00 0.00 C ATOM 950 C LEU A 63 -10.545 -1.555 -5.128 1.00 0.00 C ATOM 951 O LEU A 63 -11.273 -2.508 -5.404 1.00 0.00 O ATOM 952 CB LEU A 63 -10.119 -0.597 -7.400 1.00 0.00 C ATOM 953 CG LEU A 63 -9.143 -0.061 -8.450 1.00 0.00 C ATOM 954 CD1 LEU A 63 -9.599 -0.444 -9.849 1.00 0.00 C ATOM 955 CD2 LEU A 63 -9.007 1.450 -8.326 1.00 0.00 C ATOM 0 H LEU A 63 -8.951 -3.076 -6.514 1.00 0.00 H new ATOM 0 HA LEU A 63 -8.921 -0.262 -5.647 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -10.685 -1.419 -7.838 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -10.835 0.188 -7.156 1.00 0.00 H new ATOM 0 HG LEU A 63 -8.166 -0.511 -8.274 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -8.892 -0.054 -10.582 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -9.645 -1.530 -9.932 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -10.587 -0.023 -10.038 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -8.310 1.816 -9.080 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -9.981 1.916 -8.476 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -8.633 1.701 -7.333 1.00 0.00 H new ATOM 967 N CYS A 64 -10.636 -0.881 -3.988 1.00 0.00 N ATOM 968 CA CYS A 64 -11.622 -1.230 -2.971 1.00 0.00 C ATOM 969 C CYS A 64 -11.954 -0.026 -2.096 1.00 0.00 C ATOM 970 O CYS A 64 -11.219 0.961 -2.075 1.00 0.00 O ATOM 971 CB CYS A 64 -11.104 -2.378 -2.103 1.00 0.00 C ATOM 972 SG CYS A 64 -9.575 -1.999 -1.215 1.00 0.00 S ATOM 0 H CYS A 64 -10.040 -0.090 -3.744 1.00 0.00 H new ATOM 0 HA CYS A 64 -12.533 -1.548 -3.479 1.00 0.00 H new ATOM 0 HB2 CYS A 64 -11.874 -2.649 -1.380 1.00 0.00 H new ATOM 0 HB3 CYS A 64 -10.938 -3.251 -2.735 1.00 0.00 H new ATOM 0 HG CYS A 64 -8.889 -3.090 -1.046 1.00 0.00 H new ATOM 978 N GLY A 65 -13.066 -0.116 -1.374 1.00 0.00 N ATOM 979 CA GLY A 65 -13.477 0.971 -0.505 1.00 0.00 C ATOM 980 C GLY A 65 -12.561 1.132 0.694 1.00 0.00 C ATOM 981 O GLY A 65 -11.597 0.382 0.844 1.00 0.00 O ATOM 0 H GLY A 65 -13.690 -0.923 -1.375 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -13.493 1.901 -1.074 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -14.495 0.791 -0.159 1.00 0.00 H new ATOM 985 N PRO A 66 -12.840 2.108 1.574 1.00 0.00 N ATOM 986 CA PRO A 66 -12.025 2.352 2.769 1.00 0.00 C ATOM 987 C PRO A 66 -12.004 1.152 3.709 1.00 0.00 C ATOM 988 O PRO A 66 -13.052 0.646 4.109 1.00 0.00 O ATOM 989 CB PRO A 66 -12.709 3.548 3.442 1.00 0.00 C ATOM 990 CG PRO A 66 -14.089 3.576 2.877 1.00 0.00 C ATOM 991 CD PRO A 66 -13.970 3.048 1.478 1.00 0.00 C ATOM 0 HA PRO A 66 -10.981 2.535 2.514 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -12.729 3.432 4.526 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -12.178 4.476 3.231 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -14.767 2.962 3.470 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -14.492 4.589 2.880 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -14.884 2.549 1.156 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -13.772 3.845 0.761 1.00 0.00 H new ATOM 999 N VAL A 67 -10.803 0.702 4.057 1.00 0.00 N ATOM 1000 CA VAL A 67 -10.644 -0.440 4.950 1.00 0.00 C ATOM 1001 C VAL A 67 -11.111 -0.103 6.362 1.00 0.00 C ATOM 1002 O VAL A 67 -11.016 1.044 6.801 1.00 0.00 O ATOM 1003 CB VAL A 67 -9.177 -0.912 5.000 1.00 0.00 C ATOM 1004 CG1 VAL A 67 -8.276 0.186 5.543 1.00 0.00 C ATOM 1005 CG2 VAL A 67 -9.048 -2.179 5.833 1.00 0.00 C ATOM 0 H VAL A 67 -9.926 1.111 3.734 1.00 0.00 H new ATOM 0 HA VAL A 67 -11.262 -1.244 4.551 1.00 0.00 H new ATOM 0 HB VAL A 67 -8.857 -1.140 3.983 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -7.246 -0.169 5.570 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -8.342 1.062 4.898 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -8.594 0.452 6.551 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -8.005 -2.495 5.855 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -9.390 -1.983 6.849 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -9.657 -2.968 5.392 1.00 0.00 H new ATOM 1015 N SER A 68 -11.616 -1.108 7.070 1.00 0.00 N ATOM 1016 CA SER A 68 -12.099 -0.918 8.432 1.00 0.00 C ATOM 1017 C SER A 68 -10.980 -0.422 9.342 1.00 0.00 C ATOM 1018 O SER A 68 -11.126 0.589 10.029 1.00 0.00 O ATOM 1019 CB SER A 68 -12.675 -2.225 8.979 1.00 0.00 C ATOM 1020 OG SER A 68 -14.069 -2.308 8.739 1.00 0.00 O ATOM 0 H SER A 68 -11.701 -2.063 6.722 1.00 0.00 H new ATOM 0 HA SER A 68 -12.886 -0.164 8.409 1.00 0.00 H new ATOM 0 HB2 SER A 68 -12.171 -3.071 8.512 1.00 0.00 H new ATOM 0 HB3 SER A 68 -12.483 -2.291 10.050 1.00 0.00 H new ATOM 0 HG SER A 68 -14.413 -3.153 9.097 1.00 0.00 H new ATOM 1026 N THR A 69 -9.862 -1.142 9.343 1.00 0.00 N ATOM 1027 CA THR A 69 -8.718 -0.775 10.171 1.00 0.00 C ATOM 1028 C THR A 69 -7.636 -0.094 9.335 1.00 0.00 C ATOM 1029 O THR A 69 -7.506 1.129 9.349 1.00 0.00 O ATOM 1030 CB THR A 69 -8.144 -2.012 10.863 1.00 0.00 C ATOM 1031 OG1 THR A 69 -8.339 -3.167 10.068 1.00 0.00 O ATOM 1032 CG2 THR A 69 -8.760 -2.279 12.219 1.00 0.00 C ATOM 0 H THR A 69 -9.724 -1.982 8.781 1.00 0.00 H new ATOM 0 HA THR A 69 -9.061 -0.071 10.929 1.00 0.00 H new ATOM 0 HB THR A 69 -7.083 -1.801 10.999 1.00 0.00 H new ATOM 0 HG1 THR A 69 -9.275 -3.213 9.781 1.00 0.00 H new ATOM 0 HG21 THR A 69 -8.308 -3.170 12.655 1.00 0.00 H new ATOM 0 HG22 THR A 69 -8.583 -1.425 12.873 1.00 0.00 H new ATOM 0 HG23 THR A 69 -9.833 -2.434 12.107 1.00 0.00 H new ATOM 1040 N SER A 70 -6.862 -0.896 8.609 1.00 0.00 N ATOM 1041 CA SER A 70 -5.792 -0.371 7.770 1.00 0.00 C ATOM 1042 C SER A 70 -5.346 -1.408 6.743 1.00 0.00 C ATOM 1043 O SER A 70 -5.873 -2.519 6.700 1.00 0.00 O ATOM 1044 CB SER A 70 -4.601 0.055 8.631 1.00 0.00 C ATOM 1045 OG SER A 70 -5.000 0.302 9.968 1.00 0.00 O ATOM 0 H SER A 70 -6.957 -1.911 8.586 1.00 0.00 H new ATOM 0 HA SER A 70 -6.177 0.499 7.238 1.00 0.00 H new ATOM 0 HB2 SER A 70 -3.839 -0.724 8.614 1.00 0.00 H new ATOM 0 HB3 SER A 70 -4.148 0.953 8.212 1.00 0.00 H new ATOM 0 HG SER A 70 -4.221 0.571 10.498 1.00 0.00 H new ATOM 1051 N VAL A 71 -4.371 -1.036 5.920 1.00 0.00 N ATOM 1052 CA VAL A 71 -3.852 -1.933 4.895 1.00 0.00 C ATOM 1053 C VAL A 71 -2.354 -2.158 5.070 1.00 0.00 C ATOM 1054 O VAL A 71 -1.666 -1.356 5.700 1.00 0.00 O ATOM 1055 CB VAL A 71 -4.115 -1.383 3.481 1.00 0.00 C ATOM 1056 CG1 VAL A 71 -3.744 -2.416 2.428 1.00 0.00 C ATOM 1057 CG2 VAL A 71 -5.569 -0.961 3.334 1.00 0.00 C ATOM 0 H VAL A 71 -3.925 -0.119 5.943 1.00 0.00 H new ATOM 0 HA VAL A 71 -4.376 -2.882 5.010 1.00 0.00 H new ATOM 0 HB VAL A 71 -3.488 -0.504 3.331 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -3.937 -2.009 1.435 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -2.687 -2.665 2.519 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -4.342 -3.315 2.574 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -5.736 -0.575 2.328 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -6.217 -1.821 3.505 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -5.798 -0.184 4.063 1.00 0.00 H new ATOM 1067 N PHE A 72 -1.855 -3.254 4.508 1.00 0.00 N ATOM 1068 CA PHE A 72 -0.438 -3.583 4.603 1.00 0.00 C ATOM 1069 C PHE A 72 0.111 -4.024 3.249 1.00 0.00 C ATOM 1070 O PHE A 72 -0.478 -4.867 2.574 1.00 0.00 O ATOM 1071 CB PHE A 72 -0.218 -4.687 5.639 1.00 0.00 C ATOM 1072 CG PHE A 72 -0.313 -4.204 7.058 1.00 0.00 C ATOM 1073 CD1 PHE A 72 -1.537 -4.156 7.706 1.00 0.00 C ATOM 1074 CD2 PHE A 72 0.821 -3.797 7.743 1.00 0.00 C ATOM 1075 CE1 PHE A 72 -1.628 -3.712 9.012 1.00 0.00 C ATOM 1076 CE2 PHE A 72 0.736 -3.353 9.048 1.00 0.00 C ATOM 1077 CZ PHE A 72 -0.490 -3.309 9.684 1.00 0.00 C ATOM 0 H PHE A 72 -2.411 -3.929 3.982 1.00 0.00 H new ATOM 0 HA PHE A 72 0.097 -2.687 4.917 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -0.955 -5.474 5.481 1.00 0.00 H new ATOM 0 HB3 PHE A 72 0.764 -5.133 5.480 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -2.430 -4.469 7.185 1.00 0.00 H new ATOM 0 HD2 PHE A 72 1.782 -3.827 7.251 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -2.588 -3.680 9.507 1.00 0.00 H new ATOM 0 HE2 PHE A 72 1.627 -3.040 9.571 1.00 0.00 H new ATOM 0 HZ PHE A 72 -0.559 -2.960 10.704 1.00 0.00 H new ATOM 1087 N LEU A 73 1.244 -3.448 2.860 1.00 0.00 N ATOM 1088 CA LEU A 73 1.874 -3.780 1.587 1.00 0.00 C ATOM 1089 C LEU A 73 3.299 -4.281 1.802 1.00 0.00 C ATOM 1090 O LEU A 73 4.030 -3.760 2.645 1.00 0.00 O ATOM 1091 CB LEU A 73 1.885 -2.559 0.665 1.00 0.00 C ATOM 1092 CG LEU A 73 2.113 -2.869 -0.815 1.00 0.00 C ATOM 1093 CD1 LEU A 73 0.786 -3.076 -1.528 1.00 0.00 C ATOM 1094 CD2 LEU A 73 2.904 -1.749 -1.477 1.00 0.00 C ATOM 0 H LEU A 73 1.745 -2.749 3.408 1.00 0.00 H new ATOM 0 HA LEU A 73 1.294 -4.575 1.118 1.00 0.00 H new ATOM 0 HB2 LEU A 73 0.935 -2.035 0.769 1.00 0.00 H new ATOM 0 HB3 LEU A 73 2.664 -1.875 1.002 1.00 0.00 H new ATOM 0 HG LEU A 73 2.690 -3.791 -0.889 1.00 0.00 H new ATOM 0 HD11 LEU A 73 0.969 -3.295 -2.580 1.00 0.00 H new ATOM 0 HD12 LEU A 73 0.253 -3.910 -1.070 1.00 0.00 H new ATOM 0 HD13 LEU A 73 0.184 -2.171 -1.445 1.00 0.00 H new ATOM 0 HD21 LEU A 73 3.058 -1.985 -2.530 1.00 0.00 H new ATOM 0 HD22 LEU A 73 2.351 -0.814 -1.392 1.00 0.00 H new ATOM 0 HD23 LEU A 73 3.870 -1.645 -0.984 1.00 0.00 H new ATOM 1106 N GLU A 74 3.686 -5.296 1.037 1.00 0.00 N ATOM 1107 CA GLU A 74 5.024 -5.867 1.144 1.00 0.00 C ATOM 1108 C GLU A 74 5.349 -6.728 -0.072 1.00 0.00 C ATOM 1109 O GLU A 74 4.520 -7.515 -0.527 1.00 0.00 O ATOM 1110 CB GLU A 74 5.141 -6.703 2.421 1.00 0.00 C ATOM 1111 CG GLU A 74 6.567 -7.118 2.747 1.00 0.00 C ATOM 1112 CD GLU A 74 6.650 -7.995 3.980 1.00 0.00 C ATOM 1113 OE1 GLU A 74 6.458 -7.470 5.098 1.00 0.00 O ATOM 1114 OE2 GLU A 74 6.906 -9.208 3.830 1.00 0.00 O ATOM 0 H GLU A 74 3.093 -5.740 0.336 1.00 0.00 H new ATOM 0 HA GLU A 74 5.740 -5.046 1.186 1.00 0.00 H new ATOM 0 HB2 GLU A 74 4.737 -6.132 3.257 1.00 0.00 H new ATOM 0 HB3 GLU A 74 4.526 -7.597 2.318 1.00 0.00 H new ATOM 0 HG2 GLU A 74 6.990 -7.652 1.896 1.00 0.00 H new ATOM 0 HG3 GLU A 74 7.176 -6.226 2.898 1.00 0.00 H new ATOM 1121 N ASP A 75 6.562 -6.573 -0.594 1.00 0.00 N ATOM 1122 CA ASP A 75 6.998 -7.337 -1.757 1.00 0.00 C ATOM 1123 C ASP A 75 6.144 -7.004 -2.979 1.00 0.00 C ATOM 1124 O ASP A 75 5.792 -7.888 -3.761 1.00 0.00 O ATOM 1125 CB ASP A 75 6.932 -8.838 -1.463 1.00 0.00 C ATOM 1126 CG ASP A 75 8.215 -9.556 -1.830 1.00 0.00 C ATOM 1127 OD1 ASP A 75 8.358 -9.952 -3.006 1.00 0.00 O ATOM 1128 OD2 ASP A 75 9.077 -9.723 -0.942 1.00 0.00 O ATOM 0 H ASP A 75 7.260 -5.925 -0.230 1.00 0.00 H new ATOM 0 HA ASP A 75 8.031 -7.064 -1.974 1.00 0.00 H new ATOM 0 HB2 ASP A 75 6.725 -8.989 -0.404 1.00 0.00 H new ATOM 0 HB3 ASP A 75 6.102 -9.278 -2.016 1.00 0.00 H new ATOM 1133 N CYS A 76 5.816 -5.726 -3.135 1.00 0.00 N ATOM 1134 CA CYS A 76 5.003 -5.279 -4.261 1.00 0.00 C ATOM 1135 C CYS A 76 5.811 -4.381 -5.193 1.00 0.00 C ATOM 1136 O CYS A 76 6.540 -3.497 -4.742 1.00 0.00 O ATOM 1137 CB CYS A 76 3.768 -4.531 -3.759 1.00 0.00 C ATOM 1138 SG CYS A 76 2.474 -5.605 -3.094 1.00 0.00 S ATOM 0 H CYS A 76 6.100 -4.982 -2.497 1.00 0.00 H new ATOM 0 HA CYS A 76 4.685 -6.159 -4.819 1.00 0.00 H new ATOM 0 HB2 CYS A 76 4.073 -3.826 -2.986 1.00 0.00 H new ATOM 0 HB3 CYS A 76 3.353 -3.945 -4.579 1.00 0.00 H new ATOM 0 HG CYS A 76 2.778 -6.847 -3.329 1.00 0.00 H new ATOM 1144 N SER A 77 5.674 -4.613 -6.495 1.00 0.00 N ATOM 1145 CA SER A 77 6.391 -3.823 -7.492 1.00 0.00 C ATOM 1146 C SER A 77 5.560 -3.670 -8.761 1.00 0.00 C ATOM 1147 O SER A 77 4.951 -4.628 -9.236 1.00 0.00 O ATOM 1148 CB SER A 77 7.734 -4.478 -7.821 1.00 0.00 C ATOM 1149 OG SER A 77 7.550 -5.767 -8.381 1.00 0.00 O ATOM 0 H SER A 77 5.074 -5.340 -6.884 1.00 0.00 H new ATOM 0 HA SER A 77 6.572 -2.832 -7.076 1.00 0.00 H new ATOM 0 HB2 SER A 77 8.287 -3.850 -8.520 1.00 0.00 H new ATOM 0 HB3 SER A 77 8.336 -4.554 -6.916 1.00 0.00 H new ATOM 0 HG SER A 77 8.423 -6.163 -8.584 1.00 0.00 H new ATOM 1155 N ASP A 78 5.539 -2.458 -9.306 1.00 0.00 N ATOM 1156 CA ASP A 78 4.782 -2.179 -10.521 1.00 0.00 C ATOM 1157 C ASP A 78 3.298 -2.465 -10.311 1.00 0.00 C ATOM 1158 O ASP A 78 2.615 -2.952 -11.212 1.00 0.00 O ATOM 1159 CB ASP A 78 5.316 -3.018 -11.684 1.00 0.00 C ATOM 1160 CG ASP A 78 6.704 -2.589 -12.116 1.00 0.00 C ATOM 1161 OD1 ASP A 78 7.450 -2.052 -11.271 1.00 0.00 O ATOM 1162 OD2 ASP A 78 7.045 -2.789 -13.302 1.00 0.00 O ATOM 0 H ASP A 78 6.037 -1.653 -8.926 1.00 0.00 H new ATOM 0 HA ASP A 78 4.901 -1.122 -10.761 1.00 0.00 H new ATOM 0 HB2 ASP A 78 5.338 -4.068 -11.391 1.00 0.00 H new ATOM 0 HB3 ASP A 78 4.634 -2.937 -12.530 1.00 0.00 H new ATOM 1167 N CYS A 79 2.807 -2.159 -9.115 1.00 0.00 N ATOM 1168 CA CYS A 79 1.404 -2.383 -8.783 1.00 0.00 C ATOM 1169 C CYS A 79 0.685 -1.061 -8.533 1.00 0.00 C ATOM 1170 O CYS A 79 1.312 -0.054 -8.200 1.00 0.00 O ATOM 1171 CB CYS A 79 1.290 -3.282 -7.549 1.00 0.00 C ATOM 1172 SG CYS A 79 0.755 -4.971 -7.914 1.00 0.00 S ATOM 0 H CYS A 79 3.360 -1.755 -8.359 1.00 0.00 H new ATOM 0 HA CYS A 79 0.929 -2.877 -9.631 1.00 0.00 H new ATOM 0 HB2 CYS A 79 2.258 -3.319 -7.049 1.00 0.00 H new ATOM 0 HB3 CYS A 79 0.586 -2.832 -6.849 1.00 0.00 H new ATOM 0 HG CYS A 79 -0.360 -4.938 -8.581 1.00 0.00 H new ATOM 1178 N VAL A 80 -0.634 -1.072 -8.695 1.00 0.00 N ATOM 1179 CA VAL A 80 -1.440 0.125 -8.485 1.00 0.00 C ATOM 1180 C VAL A 80 -2.485 -0.103 -7.399 1.00 0.00 C ATOM 1181 O VAL A 80 -3.604 -0.533 -7.681 1.00 0.00 O ATOM 1182 CB VAL A 80 -2.150 0.561 -9.781 1.00 0.00 C ATOM 1183 CG1 VAL A 80 -2.821 1.912 -9.594 1.00 0.00 C ATOM 1184 CG2 VAL A 80 -1.166 0.601 -10.940 1.00 0.00 C ATOM 0 H VAL A 80 -1.167 -1.896 -8.971 1.00 0.00 H new ATOM 0 HA VAL A 80 -0.758 0.915 -8.172 1.00 0.00 H new ATOM 0 HB VAL A 80 -2.922 -0.172 -10.015 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -3.317 2.203 -10.520 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -3.558 1.845 -8.793 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -2.070 2.658 -9.334 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -1.685 0.911 -11.847 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -0.370 1.311 -10.717 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -0.737 -0.390 -11.088 1.00 0.00 H new ATOM 1194 N LEU A 81 -2.113 0.185 -6.157 1.00 0.00 N ATOM 1195 CA LEU A 81 -3.019 0.010 -5.027 1.00 0.00 C ATOM 1196 C LEU A 81 -3.924 1.225 -4.859 1.00 0.00 C ATOM 1197 O LEU A 81 -3.545 2.346 -5.194 1.00 0.00 O ATOM 1198 CB LEU A 81 -2.225 -0.231 -3.741 1.00 0.00 C ATOM 1199 CG LEU A 81 -3.075 -0.469 -2.492 1.00 0.00 C ATOM 1200 CD1 LEU A 81 -3.661 -1.871 -2.505 1.00 0.00 C ATOM 1201 CD2 LEU A 81 -2.246 -0.247 -1.235 1.00 0.00 C ATOM 0 H LEU A 81 -1.190 0.541 -5.907 1.00 0.00 H new ATOM 0 HA LEU A 81 -3.644 -0.860 -5.228 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -1.575 -1.093 -3.889 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -1.579 0.629 -3.564 1.00 0.00 H new ATOM 0 HG LEU A 81 -3.898 0.246 -2.493 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -4.263 -2.022 -1.609 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -4.288 -1.995 -3.388 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -2.853 -2.603 -2.528 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -2.866 -0.420 -0.355 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -1.404 -0.939 -1.228 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -1.874 0.777 -1.221 1.00 0.00 H new ATOM 1213 N ALA A 82 -5.123 0.992 -4.337 1.00 0.00 N ATOM 1214 CA ALA A 82 -6.086 2.064 -4.120 1.00 0.00 C ATOM 1215 C ALA A 82 -7.068 1.699 -3.013 1.00 0.00 C ATOM 1216 O ALA A 82 -7.999 0.922 -3.227 1.00 0.00 O ATOM 1217 CB ALA A 82 -6.830 2.374 -5.410 1.00 0.00 C ATOM 0 H ALA A 82 -5.451 0.068 -4.056 1.00 0.00 H new ATOM 0 HA ALA A 82 -5.540 2.954 -3.808 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -7.546 3.177 -5.233 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -6.118 2.685 -6.175 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -7.360 1.483 -5.748 1.00 0.00 H new ATOM 1223 N VAL A 83 -6.852 2.260 -1.828 1.00 0.00 N ATOM 1224 CA VAL A 83 -7.717 1.990 -0.687 1.00 0.00 C ATOM 1225 C VAL A 83 -7.508 3.021 0.419 1.00 0.00 C ATOM 1226 O VAL A 83 -6.408 3.160 0.952 1.00 0.00 O ATOM 1227 CB VAL A 83 -7.467 0.578 -0.117 1.00 0.00 C ATOM 1228 CG1 VAL A 83 -6.035 0.442 0.378 1.00 0.00 C ATOM 1229 CG2 VAL A 83 -8.457 0.264 0.995 1.00 0.00 C ATOM 0 H VAL A 83 -6.085 2.904 -1.633 1.00 0.00 H new ATOM 0 HA VAL A 83 -8.745 2.053 -1.045 1.00 0.00 H new ATOM 0 HB VAL A 83 -7.617 -0.145 -0.919 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -5.881 -0.561 0.776 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -5.346 0.614 -0.449 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -5.850 1.176 1.163 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -8.263 -0.736 1.383 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -8.345 0.993 1.798 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -9.473 0.310 0.602 1.00 0.00 H new ATOM 1239 N ALA A 84 -8.572 3.742 0.756 1.00 0.00 N ATOM 1240 CA ALA A 84 -8.507 4.759 1.798 1.00 0.00 C ATOM 1241 C ALA A 84 -8.390 4.125 3.180 1.00 0.00 C ATOM 1242 O ALA A 84 -9.353 3.558 3.696 1.00 0.00 O ATOM 1243 CB ALA A 84 -9.730 5.662 1.731 1.00 0.00 C ATOM 0 H ALA A 84 -9.490 3.641 0.322 1.00 0.00 H new ATOM 0 HA ALA A 84 -7.614 5.361 1.628 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -9.668 6.417 2.515 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -9.768 6.152 0.758 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -10.631 5.065 1.872 1.00 0.00 H new ATOM 1249 N CYS A 85 -7.205 4.223 3.771 1.00 0.00 N ATOM 1250 CA CYS A 85 -6.961 3.658 5.094 1.00 0.00 C ATOM 1251 C CYS A 85 -6.338 4.694 6.022 1.00 0.00 C ATOM 1252 O CYS A 85 -5.587 5.565 5.582 1.00 0.00 O ATOM 1253 CB CYS A 85 -6.048 2.435 4.989 1.00 0.00 C ATOM 1254 SG CYS A 85 -4.459 2.767 4.191 1.00 0.00 S ATOM 0 H CYS A 85 -6.398 4.688 3.356 1.00 0.00 H new ATOM 0 HA CYS A 85 -7.920 3.352 5.513 1.00 0.00 H new ATOM 0 HB2 CYS A 85 -5.865 2.044 5.990 1.00 0.00 H new ATOM 0 HB3 CYS A 85 -6.566 1.655 4.432 1.00 0.00 H new ATOM 0 HG CYS A 85 -3.496 2.561 5.039 1.00 0.00 H new ATOM 1260 N GLN A 86 -6.654 4.594 7.309 1.00 0.00 N ATOM 1261 CA GLN A 86 -6.125 5.523 8.302 1.00 0.00 C ATOM 1262 C GLN A 86 -4.601 5.484 8.326 1.00 0.00 C ATOM 1263 O GLN A 86 -3.943 6.525 8.367 1.00 0.00 O ATOM 1264 CB GLN A 86 -6.677 5.190 9.688 1.00 0.00 C ATOM 1265 CG GLN A 86 -8.164 5.469 9.834 1.00 0.00 C ATOM 1266 CD GLN A 86 -8.757 4.840 11.080 1.00 0.00 C ATOM 1267 OE1 GLN A 86 -8.909 5.500 12.109 1.00 0.00 O ATOM 1268 NE2 GLN A 86 -9.093 3.559 10.994 1.00 0.00 N ATOM 0 H GLN A 86 -7.274 3.879 7.689 1.00 0.00 H new ATOM 0 HA GLN A 86 -6.440 6.529 8.025 1.00 0.00 H new ATOM 0 HB2 GLN A 86 -6.491 4.137 9.901 1.00 0.00 H new ATOM 0 HB3 GLN A 86 -6.132 5.767 10.435 1.00 0.00 H new ATOM 0 HG2 GLN A 86 -8.326 6.546 9.863 1.00 0.00 H new ATOM 0 HG3 GLN A 86 -8.688 5.091 8.956 1.00 0.00 H new ATOM 0 HE21 GLN A 86 -8.949 3.052 10.121 1.00 0.00 H new ATOM 0 HE22 GLN A 86 -9.495 3.082 11.801 1.00 0.00 H new ATOM 1277 N GLN A 87 -4.044 4.277 8.301 1.00 0.00 N ATOM 1278 CA GLN A 87 -2.596 4.104 8.322 1.00 0.00 C ATOM 1279 C GLN A 87 -2.148 3.141 7.225 1.00 0.00 C ATOM 1280 O GLN A 87 -2.863 2.200 6.882 1.00 0.00 O ATOM 1281 CB GLN A 87 -2.142 3.589 9.690 1.00 0.00 C ATOM 1282 CG GLN A 87 -1.133 4.495 10.376 1.00 0.00 C ATOM 1283 CD GLN A 87 -0.912 4.126 11.830 1.00 0.00 C ATOM 1284 OE1 GLN A 87 -0.823 2.948 12.178 1.00 0.00 O ATOM 1285 NE2 GLN A 87 -0.824 5.135 12.689 1.00 0.00 N ATOM 0 H GLN A 87 -4.573 3.406 8.266 1.00 0.00 H new ATOM 0 HA GLN A 87 -2.135 5.075 8.138 1.00 0.00 H new ATOM 0 HB2 GLN A 87 -3.014 3.476 10.334 1.00 0.00 H new ATOM 0 HB3 GLN A 87 -1.705 2.598 9.569 1.00 0.00 H new ATOM 0 HG2 GLN A 87 -0.183 4.444 9.844 1.00 0.00 H new ATOM 0 HG3 GLN A 87 -1.477 5.527 10.315 1.00 0.00 H new ATOM 0 HE21 GLN A 87 -0.903 6.096 12.357 1.00 0.00 H new ATOM 0 HE22 GLN A 87 -0.677 4.949 13.681 1.00 0.00 H new ATOM 1294 N LEU A 88 -0.961 3.385 6.680 1.00 0.00 N ATOM 1295 CA LEU A 88 -0.418 2.540 5.623 1.00 0.00 C ATOM 1296 C LEU A 88 1.015 2.124 5.942 1.00 0.00 C ATOM 1297 O LEU A 88 1.859 2.962 6.259 1.00 0.00 O ATOM 1298 CB LEU A 88 -0.460 3.276 4.281 1.00 0.00 C ATOM 1299 CG LEU A 88 0.054 2.471 3.086 1.00 0.00 C ATOM 1300 CD1 LEU A 88 -1.049 1.588 2.524 1.00 0.00 C ATOM 1301 CD2 LEU A 88 0.592 3.403 2.011 1.00 0.00 C ATOM 0 H LEU A 88 -0.357 4.160 6.953 1.00 0.00 H new ATOM 0 HA LEU A 88 -1.033 1.642 5.557 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -1.488 3.578 4.081 1.00 0.00 H new ATOM 0 HB3 LEU A 88 0.130 4.189 4.366 1.00 0.00 H new ATOM 0 HG LEU A 88 0.867 1.829 3.425 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -0.665 1.023 1.675 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -1.391 0.897 3.295 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -1.883 2.210 2.199 1.00 0.00 H new ATOM 0 HD21 LEU A 88 0.954 2.815 1.168 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -0.203 4.068 1.675 1.00 0.00 H new ATOM 0 HD23 LEU A 88 1.412 3.995 2.419 1.00 0.00 H new ATOM 1313 N ARG A 89 1.282 0.825 5.856 1.00 0.00 N ATOM 1314 CA ARG A 89 2.613 0.297 6.136 1.00 0.00 C ATOM 1315 C ARG A 89 3.190 -0.402 4.908 1.00 0.00 C ATOM 1316 O ARG A 89 2.713 -1.461 4.502 1.00 0.00 O ATOM 1317 CB ARG A 89 2.559 -0.676 7.317 1.00 0.00 C ATOM 1318 CG ARG A 89 3.506 -0.312 8.448 1.00 0.00 C ATOM 1319 CD ARG A 89 4.872 -0.951 8.258 1.00 0.00 C ATOM 1320 NE ARG A 89 5.480 -1.334 9.531 1.00 0.00 N ATOM 1321 CZ ARG A 89 5.049 -2.342 10.285 1.00 0.00 C ATOM 1322 NH1 ARG A 89 4.011 -3.073 9.898 1.00 0.00 N ATOM 1323 NH2 ARG A 89 5.658 -2.622 11.429 1.00 0.00 N ATOM 0 H ARG A 89 0.595 0.118 5.595 1.00 0.00 H new ATOM 0 HA ARG A 89 3.264 1.133 6.393 1.00 0.00 H new ATOM 0 HB2 ARG A 89 1.540 -0.709 7.704 1.00 0.00 H new ATOM 0 HB3 ARG A 89 2.798 -1.679 6.962 1.00 0.00 H new ATOM 0 HG2 ARG A 89 3.614 0.771 8.499 1.00 0.00 H new ATOM 0 HG3 ARG A 89 3.081 -0.635 9.398 1.00 0.00 H new ATOM 0 HD2 ARG A 89 4.775 -1.832 7.623 1.00 0.00 H new ATOM 0 HD3 ARG A 89 5.529 -0.254 7.738 1.00 0.00 H new ATOM 0 HE ARG A 89 6.282 -0.797 9.861 1.00 0.00 H new ATOM 0 HH11 ARG A 89 3.539 -2.863 9.018 1.00 0.00 H new ATOM 0 HH12 ARG A 89 3.685 -3.845 10.480 1.00 0.00 H new ATOM 0 HH21 ARG A 89 6.457 -2.065 11.731 1.00 0.00 H new ATOM 0 HH22 ARG A 89 5.327 -3.395 12.007 1.00 0.00 H new ATOM 1337 N ILE A 90 4.220 0.200 4.323 1.00 0.00 N ATOM 1338 CA ILE A 90 4.864 -0.364 3.142 1.00 0.00 C ATOM 1339 C ILE A 90 6.262 -0.877 3.473 1.00 0.00 C ATOM 1340 O ILE A 90 6.893 -0.419 4.425 1.00 0.00 O ATOM 1341 CB ILE A 90 4.967 0.675 2.008 1.00 0.00 C ATOM 1342 CG1 ILE A 90 3.606 1.330 1.758 1.00 0.00 C ATOM 1343 CG2 ILE A 90 5.488 0.023 0.736 1.00 0.00 C ATOM 1344 CD1 ILE A 90 3.690 2.821 1.514 1.00 0.00 C ATOM 0 H ILE A 90 4.627 1.078 4.647 1.00 0.00 H new ATOM 0 HA ILE A 90 4.243 -1.195 2.808 1.00 0.00 H new ATOM 0 HB ILE A 90 5.671 1.450 2.311 1.00 0.00 H new ATOM 0 HG12 ILE A 90 3.136 0.855 0.897 1.00 0.00 H new ATOM 0 HG13 ILE A 90 2.960 1.146 2.616 1.00 0.00 H new ATOM 0 HG21 ILE A 90 5.555 0.770 -0.055 1.00 0.00 H new ATOM 0 HG22 ILE A 90 6.476 -0.398 0.921 1.00 0.00 H new ATOM 0 HG23 ILE A 90 4.807 -0.771 0.429 1.00 0.00 H new ATOM 0 HD11 ILE A 90 2.689 3.219 1.344 1.00 0.00 H new ATOM 0 HD12 ILE A 90 4.131 3.308 2.384 1.00 0.00 H new ATOM 0 HD13 ILE A 90 4.310 3.012 0.638 1.00 0.00 H new ATOM 1356 N HIS A 91 6.739 -1.833 2.682 1.00 0.00 N ATOM 1357 CA HIS A 91 8.062 -2.408 2.894 1.00 0.00 C ATOM 1358 C HIS A 91 8.487 -3.255 1.698 1.00 0.00 C ATOM 1359 O HIS A 91 7.679 -3.979 1.119 1.00 0.00 O ATOM 1360 CB HIS A 91 8.073 -3.260 4.164 1.00 0.00 C ATOM 1361 CG HIS A 91 9.422 -3.814 4.503 1.00 0.00 C ATOM 1362 ND1 HIS A 91 10.446 -3.259 5.202 1.00 0.00 N flip ATOM 1363 CD2 HIS A 91 9.855 -5.065 4.125 1.00 0.00 C flip ATOM 1364 CE1 HIS A 91 11.503 -4.161 5.256 1.00 0.00 C flip ATOM 1365 NE2 HIS A 91 11.099 -5.229 4.595 1.00 0.00 N flip ATOM 0 H HIS A 91 6.230 -2.225 1.890 1.00 0.00 H new ATOM 0 HA HIS A 91 8.772 -1.588 3.007 1.00 0.00 H new ATOM 0 HB2 HIS A 91 7.717 -2.657 4.999 1.00 0.00 H new ATOM 0 HB3 HIS A 91 7.370 -4.085 4.044 1.00 0.00 H new ATOM 0 HD1 HIS A 91 10.440 -2.329 5.621 1.00 0.00 H new ATOM 0 HD2 HIS A 91 9.292 -5.786 3.551 1.00 0.00 H new ATOM 0 HE1 HIS A 91 12.458 -4.017 5.739 1.00 0.00 H new ATOM 1373 N SER A 92 9.763 -3.159 1.334 1.00 0.00 N ATOM 1374 CA SER A 92 10.297 -3.916 0.207 1.00 0.00 C ATOM 1375 C SER A 92 9.524 -3.608 -1.072 1.00 0.00 C ATOM 1376 O SER A 92 9.389 -4.462 -1.948 1.00 0.00 O ATOM 1377 CB SER A 92 10.240 -5.416 0.502 1.00 0.00 C ATOM 1378 OG SER A 92 11.283 -5.803 1.381 1.00 0.00 O ATOM 0 H SER A 92 10.446 -2.564 1.803 1.00 0.00 H new ATOM 0 HA SER A 92 11.336 -3.619 0.062 1.00 0.00 H new ATOM 0 HB2 SER A 92 9.276 -5.666 0.944 1.00 0.00 H new ATOM 0 HB3 SER A 92 10.319 -5.976 -0.430 1.00 0.00 H new ATOM 0 HG SER A 92 11.224 -6.766 1.555 1.00 0.00 H new ATOM 1384 N THR A 93 9.018 -2.384 -1.171 1.00 0.00 N ATOM 1385 CA THR A 93 8.258 -1.963 -2.343 1.00 0.00 C ATOM 1386 C THR A 93 9.105 -1.083 -3.255 1.00 0.00 C ATOM 1387 O THR A 93 9.869 -0.240 -2.787 1.00 0.00 O ATOM 1388 CB THR A 93 6.998 -1.210 -1.914 1.00 0.00 C ATOM 1389 OG1 THR A 93 6.250 -1.973 -0.985 1.00 0.00 O ATOM 1390 CG2 THR A 93 6.083 -0.866 -3.069 1.00 0.00 C ATOM 0 H THR A 93 9.120 -1.666 -0.454 1.00 0.00 H new ATOM 0 HA THR A 93 7.969 -2.856 -2.898 1.00 0.00 H new ATOM 0 HB THR A 93 7.355 -0.282 -1.467 1.00 0.00 H new ATOM 0 HG1 THR A 93 5.724 -2.647 -1.464 1.00 0.00 H new ATOM 0 HG21 THR A 93 5.209 -0.333 -2.695 1.00 0.00 H new ATOM 0 HG22 THR A 93 6.616 -0.235 -3.780 1.00 0.00 H new ATOM 0 HG23 THR A 93 5.764 -1.782 -3.566 1.00 0.00 H new ATOM 1398 N LYS A 94 8.967 -1.287 -4.561 1.00 0.00 N ATOM 1399 CA LYS A 94 9.721 -0.514 -5.540 1.00 0.00 C ATOM 1400 C LYS A 94 8.904 -0.299 -6.811 1.00 0.00 C ATOM 1401 O LYS A 94 8.383 -1.249 -7.393 1.00 0.00 O ATOM 1402 CB LYS A 94 11.034 -1.224 -5.876 1.00 0.00 C ATOM 1403 CG LYS A 94 11.873 -0.495 -6.912 1.00 0.00 C ATOM 1404 CD LYS A 94 13.043 -1.345 -7.379 1.00 0.00 C ATOM 1405 CE LYS A 94 14.061 -0.519 -8.147 1.00 0.00 C ATOM 1406 NZ LYS A 94 13.631 -0.271 -9.551 1.00 0.00 N ATOM 0 H LYS A 94 8.339 -1.982 -4.966 1.00 0.00 H new ATOM 0 HA LYS A 94 9.943 0.461 -5.105 1.00 0.00 H new ATOM 0 HB2 LYS A 94 11.619 -1.339 -4.963 1.00 0.00 H new ATOM 0 HB3 LYS A 94 10.812 -2.227 -6.241 1.00 0.00 H new ATOM 0 HG2 LYS A 94 11.250 -0.231 -7.766 1.00 0.00 H new ATOM 0 HG3 LYS A 94 12.246 0.438 -6.489 1.00 0.00 H new ATOM 0 HD2 LYS A 94 13.524 -1.808 -6.517 1.00 0.00 H new ATOM 0 HD3 LYS A 94 12.677 -2.153 -8.012 1.00 0.00 H new ATOM 0 HE2 LYS A 94 14.212 0.434 -7.640 1.00 0.00 H new ATOM 0 HE3 LYS A 94 15.021 -1.035 -8.147 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 14.353 0.296 -10.040 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 13.512 -1.179 -10.043 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 12.728 0.244 -9.552 1.00 0.00 H new ATOM 1420 N ASP A 95 8.801 0.956 -7.236 1.00 0.00 N ATOM 1421 CA ASP A 95 8.049 1.297 -8.439 1.00 0.00 C ATOM 1422 C ASP A 95 6.586 0.883 -8.303 1.00 0.00 C ATOM 1423 O ASP A 95 5.971 0.407 -9.258 1.00 0.00 O ATOM 1424 CB ASP A 95 8.678 0.623 -9.662 1.00 0.00 C ATOM 1425 CG ASP A 95 9.377 1.614 -10.572 1.00 0.00 C ATOM 1426 OD1 ASP A 95 10.078 2.507 -10.052 1.00 0.00 O ATOM 1427 OD2 ASP A 95 9.222 1.497 -11.806 1.00 0.00 O ATOM 0 H ASP A 95 9.229 1.754 -6.766 1.00 0.00 H new ATOM 0 HA ASP A 95 8.086 2.378 -8.571 1.00 0.00 H new ATOM 0 HB2 ASP A 95 9.394 -0.130 -9.331 1.00 0.00 H new ATOM 0 HB3 ASP A 95 7.904 0.101 -10.224 1.00 0.00 H new ATOM 1432 N THR A 96 6.032 1.069 -7.109 1.00 0.00 N ATOM 1433 CA THR A 96 4.641 0.716 -6.848 1.00 0.00 C ATOM 1434 C THR A 96 3.806 1.961 -6.564 1.00 0.00 C ATOM 1435 O THR A 96 3.995 2.629 -5.548 1.00 0.00 O ATOM 1436 CB THR A 96 4.551 -0.251 -5.668 1.00 0.00 C ATOM 1437 OG1 THR A 96 5.574 -1.229 -5.741 1.00 0.00 O ATOM 1438 CG2 THR A 96 3.225 -0.976 -5.588 1.00 0.00 C ATOM 0 H THR A 96 6.525 1.462 -6.307 1.00 0.00 H new ATOM 0 HA THR A 96 4.244 0.230 -7.739 1.00 0.00 H new ATOM 0 HB THR A 96 4.661 0.368 -4.778 1.00 0.00 H new ATOM 0 HG1 THR A 96 6.449 -0.789 -5.724 1.00 0.00 H new ATOM 0 HG21 THR A 96 3.228 -1.646 -4.728 1.00 0.00 H new ATOM 0 HG22 THR A 96 2.419 -0.250 -5.479 1.00 0.00 H new ATOM 0 HG23 THR A 96 3.071 -1.555 -6.499 1.00 0.00 H new ATOM 1446 N ARG A 97 2.879 2.265 -7.468 1.00 0.00 N ATOM 1447 CA ARG A 97 2.012 3.426 -7.311 1.00 0.00 C ATOM 1448 C ARG A 97 0.870 3.123 -6.349 1.00 0.00 C ATOM 1449 O ARG A 97 0.132 2.155 -6.531 1.00 0.00 O ATOM 1450 CB ARG A 97 1.451 3.857 -8.669 1.00 0.00 C ATOM 1451 CG ARG A 97 2.523 4.165 -9.701 1.00 0.00 C ATOM 1452 CD ARG A 97 1.921 4.728 -10.977 1.00 0.00 C ATOM 1453 NE ARG A 97 2.895 5.496 -11.750 1.00 0.00 N ATOM 1454 CZ ARG A 97 3.892 4.947 -12.439 1.00 0.00 C ATOM 1455 NH1 ARG A 97 4.053 3.629 -12.454 1.00 0.00 N ATOM 1456 NH2 ARG A 97 4.733 5.718 -13.115 1.00 0.00 N ATOM 0 H ARG A 97 2.710 1.723 -8.316 1.00 0.00 H new ATOM 0 HA ARG A 97 2.606 4.240 -6.897 1.00 0.00 H new ATOM 0 HB2 ARG A 97 0.805 3.067 -9.053 1.00 0.00 H new ATOM 0 HB3 ARG A 97 0.827 4.740 -8.531 1.00 0.00 H new ATOM 0 HG2 ARG A 97 3.234 4.880 -9.287 1.00 0.00 H new ATOM 0 HG3 ARG A 97 3.081 3.257 -9.930 1.00 0.00 H new ATOM 0 HD2 ARG A 97 1.537 3.911 -11.588 1.00 0.00 H new ATOM 0 HD3 ARG A 97 1.073 5.365 -10.727 1.00 0.00 H new ATOM 0 HE ARG A 97 2.805 6.512 -11.762 1.00 0.00 H new ATOM 0 HH11 ARG A 97 3.410 3.031 -11.935 1.00 0.00 H new ATOM 0 HH12 ARG A 97 4.820 3.215 -12.984 1.00 0.00 H new ATOM 0 HH21 ARG A 97 4.615 6.731 -13.106 1.00 0.00 H new ATOM 0 HH22 ARG A 97 5.498 5.298 -13.643 1.00 0.00 H new ATOM 1470 N ILE A 98 0.730 3.955 -5.321 1.00 0.00 N ATOM 1471 CA ILE A 98 -0.322 3.772 -4.328 1.00 0.00 C ATOM 1472 C ILE A 98 -1.197 5.017 -4.216 1.00 0.00 C ATOM 1473 O ILE A 98 -0.743 6.067 -3.760 1.00 0.00 O ATOM 1474 CB ILE A 98 0.263 3.443 -2.941 1.00 0.00 C ATOM 1475 CG1 ILE A 98 1.336 2.355 -3.057 1.00 0.00 C ATOM 1476 CG2 ILE A 98 -0.842 3.009 -1.989 1.00 0.00 C ATOM 1477 CD1 ILE A 98 2.701 2.799 -2.579 1.00 0.00 C ATOM 0 H ILE A 98 1.332 4.762 -5.155 1.00 0.00 H new ATOM 0 HA ILE A 98 -0.930 2.933 -4.665 1.00 0.00 H new ATOM 0 HB ILE A 98 0.730 4.342 -2.538 1.00 0.00 H new ATOM 0 HG12 ILE A 98 1.023 1.485 -2.480 1.00 0.00 H new ATOM 0 HG13 ILE A 98 1.410 2.038 -4.097 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -0.413 2.780 -1.014 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -1.570 3.814 -1.885 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -1.336 2.122 -2.385 1.00 0.00 H new ATOM 0 HD11 ILE A 98 3.410 1.979 -2.690 1.00 0.00 H new ATOM 0 HD12 ILE A 98 3.035 3.650 -3.172 1.00 0.00 H new ATOM 0 HD13 ILE A 98 2.643 3.088 -1.530 1.00 0.00 H new ATOM 1489 N PHE A 99 -2.453 4.890 -4.632 1.00 0.00 N ATOM 1490 CA PHE A 99 -3.393 6.003 -4.576 1.00 0.00 C ATOM 1491 C PHE A 99 -4.398 5.808 -3.445 1.00 0.00 C ATOM 1492 O PHE A 99 -5.441 5.182 -3.632 1.00 0.00 O ATOM 1493 CB PHE A 99 -4.128 6.145 -5.909 1.00 0.00 C ATOM 1494 CG PHE A 99 -3.211 6.311 -7.087 1.00 0.00 C ATOM 1495 CD1 PHE A 99 -2.483 5.237 -7.572 1.00 0.00 C ATOM 1496 CD2 PHE A 99 -3.078 7.542 -7.710 1.00 0.00 C ATOM 1497 CE1 PHE A 99 -1.639 5.386 -8.657 1.00 0.00 C ATOM 1498 CE2 PHE A 99 -2.235 7.699 -8.794 1.00 0.00 C ATOM 1499 CZ PHE A 99 -1.515 6.619 -9.268 1.00 0.00 C ATOM 0 H PHE A 99 -2.843 4.027 -5.012 1.00 0.00 H new ATOM 0 HA PHE A 99 -2.828 6.915 -4.383 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -4.752 5.265 -6.066 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -4.797 7.004 -5.856 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -2.576 4.272 -7.097 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -3.640 8.389 -7.344 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -1.078 4.540 -9.026 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -2.139 8.664 -9.270 1.00 0.00 H new ATOM 0 HZ PHE A 99 -0.856 6.739 -10.115 1.00 0.00 H new ATOM 1509 N LEU A 100 -4.077 6.346 -2.274 1.00 0.00 N ATOM 1510 CA LEU A 100 -4.953 6.228 -1.114 1.00 0.00 C ATOM 1511 C LEU A 100 -5.097 7.567 -0.400 1.00 0.00 C ATOM 1512 O LEU A 100 -4.452 8.551 -0.766 1.00 0.00 O ATOM 1513 CB LEU A 100 -4.412 5.175 -0.144 1.00 0.00 C ATOM 1514 CG LEU A 100 -3.104 5.551 0.555 1.00 0.00 C ATOM 1515 CD1 LEU A 100 -2.804 4.575 1.683 1.00 0.00 C ATOM 1516 CD2 LEU A 100 -1.957 5.585 -0.443 1.00 0.00 C ATOM 0 H LEU A 100 -3.217 6.868 -2.103 1.00 0.00 H new ATOM 0 HA LEU A 100 -5.937 5.917 -1.465 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -5.169 4.979 0.615 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -4.260 4.244 -0.690 1.00 0.00 H new ATOM 0 HG LEU A 100 -3.215 6.547 0.983 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -1.870 4.857 2.170 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -3.615 4.600 2.411 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -2.712 3.567 1.277 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -1.035 5.854 0.072 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -1.844 4.602 -0.901 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -2.169 6.323 -1.216 1.00 0.00 H new ATOM 1528 N GLN A 101 -5.944 7.598 0.624 1.00 0.00 N ATOM 1529 CA GLN A 101 -6.173 8.817 1.392 1.00 0.00 C ATOM 1530 C GLN A 101 -5.971 8.564 2.882 1.00 0.00 C ATOM 1531 O GLN A 101 -6.909 8.206 3.595 1.00 0.00 O ATOM 1532 CB GLN A 101 -7.585 9.347 1.140 1.00 0.00 C ATOM 1533 CG GLN A 101 -7.876 10.663 1.842 1.00 0.00 C ATOM 1534 CD GLN A 101 -9.143 11.326 1.337 1.00 0.00 C ATOM 1535 OE1 GLN A 101 -9.999 11.745 2.261 1.00 0.00 O flip ATOM 1536 NE2 GLN A 101 -9.348 11.460 0.131 1.00 0.00 N flip ATOM 0 H GLN A 101 -6.483 6.793 0.941 1.00 0.00 H new ATOM 0 HA GLN A 101 -5.450 9.564 1.066 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -7.729 9.478 0.067 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -8.308 8.601 1.470 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -7.965 10.487 2.914 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -7.034 11.341 1.699 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -8.661 11.122 -0.544 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -10.204 11.909 -0.194 1.00 0.00 H new ATOM 1545 N VAL A 102 -4.740 8.750 3.347 1.00 0.00 N ATOM 1546 CA VAL A 102 -4.415 8.540 4.753 1.00 0.00 C ATOM 1547 C VAL A 102 -4.880 9.715 5.607 1.00 0.00 C ATOM 1548 O VAL A 102 -4.693 10.875 5.239 1.00 0.00 O ATOM 1549 CB VAL A 102 -2.901 8.340 4.958 1.00 0.00 C ATOM 1550 CG1 VAL A 102 -2.471 6.970 4.453 1.00 0.00 C ATOM 1551 CG2 VAL A 102 -2.116 9.443 4.264 1.00 0.00 C ATOM 0 H VAL A 102 -3.952 9.046 2.771 1.00 0.00 H new ATOM 0 HA VAL A 102 -4.939 7.637 5.065 1.00 0.00 H new ATOM 0 HB VAL A 102 -2.688 8.392 6.026 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -1.399 6.846 4.606 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -3.008 6.195 5.001 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -2.698 6.886 3.390 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -1.049 9.284 4.420 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -2.332 9.427 3.196 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -2.403 10.410 4.678 1.00 0.00 H new ATOM 1561 N THR A 103 -5.486 9.406 6.748 1.00 0.00 N ATOM 1562 CA THR A 103 -5.979 10.436 7.657 1.00 0.00 C ATOM 1563 C THR A 103 -5.079 10.556 8.881 1.00 0.00 C ATOM 1564 O THR A 103 -4.929 11.637 9.451 1.00 0.00 O ATOM 1565 CB THR A 103 -7.411 10.120 8.091 1.00 0.00 C ATOM 1566 OG1 THR A 103 -7.427 9.062 9.034 1.00 0.00 O ATOM 1567 CG2 THR A 103 -8.311 9.721 6.941 1.00 0.00 C ATOM 0 H THR A 103 -5.648 8.451 7.066 1.00 0.00 H new ATOM 0 HA THR A 103 -5.970 11.388 7.127 1.00 0.00 H new ATOM 0 HB THR A 103 -7.791 11.044 8.526 1.00 0.00 H new ATOM 0 HG1 THR A 103 -8.351 8.876 9.301 1.00 0.00 H new ATOM 0 HG21 THR A 103 -9.312 9.511 7.318 1.00 0.00 H new ATOM 0 HG22 THR A 103 -8.360 10.535 6.218 1.00 0.00 H new ATOM 0 HG23 THR A 103 -7.911 8.830 6.458 1.00 0.00 H new ATOM 1575 N SER A 104 -4.482 9.438 9.283 1.00 0.00 N ATOM 1576 CA SER A 104 -3.596 9.418 10.441 1.00 0.00 C ATOM 1577 C SER A 104 -2.151 9.675 10.026 1.00 0.00 C ATOM 1578 O SER A 104 -1.604 10.748 10.278 1.00 0.00 O ATOM 1579 CB SER A 104 -3.701 8.075 11.164 1.00 0.00 C ATOM 1580 OG SER A 104 -4.626 8.143 12.237 1.00 0.00 O ATOM 0 H SER A 104 -4.596 8.534 8.824 1.00 0.00 H new ATOM 0 HA SER A 104 -3.906 10.213 11.119 1.00 0.00 H new ATOM 0 HB2 SER A 104 -4.012 7.303 10.460 1.00 0.00 H new ATOM 0 HB3 SER A 104 -2.721 7.785 11.543 1.00 0.00 H new ATOM 0 HG SER A 104 -4.676 7.271 12.682 1.00 0.00 H new ATOM 1586 N ARG A 105 -1.538 8.682 9.389 1.00 0.00 N ATOM 1587 CA ARG A 105 -0.155 8.801 8.940 1.00 0.00 C ATOM 1588 C ARG A 105 0.250 7.595 8.099 1.00 0.00 C ATOM 1589 O ARG A 105 -0.482 6.609 8.016 1.00 0.00 O ATOM 1590 CB ARG A 105 0.781 8.938 10.141 1.00 0.00 C ATOM 1591 CG ARG A 105 0.552 7.886 11.214 1.00 0.00 C ATOM 1592 CD ARG A 105 1.532 8.043 12.367 1.00 0.00 C ATOM 1593 NE ARG A 105 0.901 7.786 13.660 1.00 0.00 N ATOM 1594 CZ ARG A 105 1.577 7.508 14.772 1.00 0.00 C ATOM 1595 NH1 ARG A 105 2.903 7.450 14.755 1.00 0.00 N ATOM 1596 NH2 ARG A 105 0.926 7.289 15.906 1.00 0.00 N ATOM 0 H ARG A 105 -1.977 7.787 9.172 1.00 0.00 H new ATOM 0 HA ARG A 105 -0.075 9.695 8.321 1.00 0.00 H new ATOM 0 HB2 ARG A 105 1.813 8.874 9.796 1.00 0.00 H new ATOM 0 HB3 ARG A 105 0.652 9.927 10.580 1.00 0.00 H new ATOM 0 HG2 ARG A 105 -0.468 7.964 11.589 1.00 0.00 H new ATOM 0 HG3 ARG A 105 0.657 6.892 10.779 1.00 0.00 H new ATOM 0 HD2 ARG A 105 2.368 7.357 12.229 1.00 0.00 H new ATOM 0 HD3 ARG A 105 1.943 9.052 12.358 1.00 0.00 H new ATOM 0 HE ARG A 105 -0.117 7.822 13.713 1.00 0.00 H new ATOM 0 HH11 ARG A 105 3.410 7.619 13.886 1.00 0.00 H new ATOM 0 HH12 ARG A 105 3.415 7.236 15.611 1.00 0.00 H new ATOM 0 HH21 ARG A 105 -0.093 7.334 15.926 1.00 0.00 H new ATOM 0 HH22 ARG A 105 1.444 7.076 16.758 1.00 0.00 H new ATOM 1610 N ALA A 106 1.423 7.680 7.479 1.00 0.00 N ATOM 1611 CA ALA A 106 1.927 6.596 6.645 1.00 0.00 C ATOM 1612 C ALA A 106 3.376 6.269 6.990 1.00 0.00 C ATOM 1613 O ALA A 106 4.167 7.159 7.302 1.00 0.00 O ATOM 1614 CB ALA A 106 1.801 6.961 5.173 1.00 0.00 C ATOM 0 H ALA A 106 2.042 8.489 7.539 1.00 0.00 H new ATOM 0 HA ALA A 106 1.325 5.708 6.840 1.00 0.00 H new ATOM 0 HB1 ALA A 106 2.181 6.143 4.561 1.00 0.00 H new ATOM 0 HB2 ALA A 106 0.753 7.139 4.931 1.00 0.00 H new ATOM 0 HB3 ALA A 106 2.378 7.863 4.971 1.00 0.00 H new ATOM 1620 N ILE A 107 3.718 4.986 6.931 1.00 0.00 N ATOM 1621 CA ILE A 107 5.073 4.542 7.238 1.00 0.00 C ATOM 1622 C ILE A 107 5.709 3.850 6.037 1.00 0.00 C ATOM 1623 O ILE A 107 5.018 3.233 5.226 1.00 0.00 O ATOM 1624 CB ILE A 107 5.090 3.578 8.441 1.00 0.00 C ATOM 1625 CG1 ILE A 107 4.328 4.184 9.621 1.00 0.00 C ATOM 1626 CG2 ILE A 107 6.521 3.251 8.840 1.00 0.00 C ATOM 1627 CD1 ILE A 107 3.584 3.160 10.450 1.00 0.00 C ATOM 0 H ILE A 107 3.076 4.236 6.674 1.00 0.00 H new ATOM 0 HA ILE A 107 5.649 5.433 7.488 1.00 0.00 H new ATOM 0 HB ILE A 107 4.594 2.652 8.150 1.00 0.00 H new ATOM 0 HG12 ILE A 107 5.031 4.717 10.262 1.00 0.00 H new ATOM 0 HG13 ILE A 107 3.618 4.920 9.245 1.00 0.00 H new ATOM 0 HG21 ILE A 107 6.515 2.569 9.691 1.00 0.00 H new ATOM 0 HG22 ILE A 107 7.034 2.780 8.001 1.00 0.00 H new ATOM 0 HG23 ILE A 107 7.041 4.169 9.114 1.00 0.00 H new ATOM 0 HD11 ILE A 107 3.067 3.661 11.269 1.00 0.00 H new ATOM 0 HD12 ILE A 107 2.857 2.643 9.823 1.00 0.00 H new ATOM 0 HD13 ILE A 107 4.292 2.437 10.856 1.00 0.00 H new ATOM 1639 N VAL A 108 7.029 3.957 5.929 1.00 0.00 N ATOM 1640 CA VAL A 108 7.759 3.341 4.828 1.00 0.00 C ATOM 1641 C VAL A 108 9.143 2.882 5.274 1.00 0.00 C ATOM 1642 O VAL A 108 9.977 3.693 5.677 1.00 0.00 O ATOM 1643 CB VAL A 108 7.911 4.312 3.642 1.00 0.00 C ATOM 1644 CG1 VAL A 108 6.564 4.569 2.985 1.00 0.00 C ATOM 1645 CG2 VAL A 108 8.547 5.616 4.099 1.00 0.00 C ATOM 0 H VAL A 108 7.615 4.465 6.591 1.00 0.00 H new ATOM 0 HA VAL A 108 7.178 2.476 4.508 1.00 0.00 H new ATOM 0 HB VAL A 108 8.567 3.853 2.902 1.00 0.00 H new ATOM 0 HG11 VAL A 108 6.692 5.257 2.149 1.00 0.00 H new ATOM 0 HG12 VAL A 108 6.152 3.628 2.620 1.00 0.00 H new ATOM 0 HG13 VAL A 108 5.881 5.006 3.714 1.00 0.00 H new ATOM 0 HG21 VAL A 108 8.647 6.290 3.248 1.00 0.00 H new ATOM 0 HG22 VAL A 108 7.918 6.081 4.858 1.00 0.00 H new ATOM 0 HG23 VAL A 108 9.532 5.413 4.518 1.00 0.00 H new ATOM 1655 N GLU A 109 9.380 1.576 5.200 1.00 0.00 N ATOM 1656 CA GLU A 109 10.664 1.009 5.598 1.00 0.00 C ATOM 1657 C GLU A 109 11.263 0.176 4.469 1.00 0.00 C ATOM 1658 O GLU A 109 10.599 -0.695 3.906 1.00 0.00 O ATOM 1659 CB GLU A 109 10.498 0.147 6.850 1.00 0.00 C ATOM 1660 CG GLU A 109 10.155 0.947 8.097 1.00 0.00 C ATOM 1661 CD GLU A 109 10.852 0.421 9.337 1.00 0.00 C ATOM 1662 OE1 GLU A 109 11.025 -0.812 9.442 1.00 0.00 O ATOM 1663 OE2 GLU A 109 11.226 1.241 10.201 1.00 0.00 O ATOM 0 H GLU A 109 8.701 0.891 4.869 1.00 0.00 H new ATOM 0 HA GLU A 109 11.344 1.832 5.819 1.00 0.00 H new ATOM 0 HB2 GLU A 109 9.714 -0.589 6.673 1.00 0.00 H new ATOM 0 HB3 GLU A 109 11.421 -0.406 7.025 1.00 0.00 H new ATOM 0 HG2 GLU A 109 10.433 1.990 7.943 1.00 0.00 H new ATOM 0 HG3 GLU A 109 9.077 0.924 8.254 1.00 0.00 H new ATOM 1670 N ASP A 110 12.523 0.447 4.144 1.00 0.00 N ATOM 1671 CA ASP A 110 13.211 -0.279 3.084 1.00 0.00 C ATOM 1672 C ASP A 110 12.506 -0.085 1.744 1.00 0.00 C ATOM 1673 O ASP A 110 12.515 -0.973 0.892 1.00 0.00 O ATOM 1674 CB ASP A 110 13.287 -1.769 3.422 1.00 0.00 C ATOM 1675 CG ASP A 110 14.385 -2.481 2.656 1.00 0.00 C ATOM 1676 OD1 ASP A 110 15.568 -2.137 2.857 1.00 0.00 O ATOM 1677 OD2 ASP A 110 14.059 -3.383 1.854 1.00 0.00 O ATOM 0 H ASP A 110 13.088 1.164 4.600 1.00 0.00 H new ATOM 0 HA ASP A 110 14.222 0.120 3.003 1.00 0.00 H new ATOM 0 HB2 ASP A 110 13.459 -1.888 4.492 1.00 0.00 H new ATOM 0 HB3 ASP A 110 12.329 -2.239 3.199 1.00 0.00 H new ATOM 1682 N CYS A 111 11.896 1.082 1.567 1.00 0.00 N ATOM 1683 CA CYS A 111 11.187 1.394 0.331 1.00 0.00 C ATOM 1684 C CYS A 111 11.997 2.352 -0.534 1.00 0.00 C ATOM 1685 O CYS A 111 12.967 2.953 -0.072 1.00 0.00 O ATOM 1686 CB CYS A 111 9.818 2.002 0.644 1.00 0.00 C ATOM 1687 SG CYS A 111 8.863 1.079 1.871 1.00 0.00 S ATOM 0 H CYS A 111 11.878 1.827 2.263 1.00 0.00 H new ATOM 0 HA CYS A 111 11.046 0.466 -0.223 1.00 0.00 H new ATOM 0 HB2 CYS A 111 9.959 3.022 1.001 1.00 0.00 H new ATOM 0 HB3 CYS A 111 9.241 2.064 -0.278 1.00 0.00 H new ATOM 0 HG CYS A 111 9.655 0.290 2.533 1.00 0.00 H new ATOM 1693 N SER A 112 11.592 2.491 -1.793 1.00 0.00 N ATOM 1694 CA SER A 112 12.282 3.377 -2.724 1.00 0.00 C ATOM 1695 C SER A 112 11.482 3.543 -4.012 1.00 0.00 C ATOM 1696 O SER A 112 10.859 2.597 -4.493 1.00 0.00 O ATOM 1697 CB SER A 112 13.676 2.832 -3.041 1.00 0.00 C ATOM 1698 OG SER A 112 14.604 3.886 -3.234 1.00 0.00 O ATOM 0 H SER A 112 10.790 2.002 -2.191 1.00 0.00 H new ATOM 0 HA SER A 112 12.381 4.354 -2.251 1.00 0.00 H new ATOM 0 HB2 SER A 112 14.013 2.191 -2.226 1.00 0.00 H new ATOM 0 HB3 SER A 112 13.633 2.213 -3.937 1.00 0.00 H new ATOM 0 HG SER A 112 15.487 3.512 -3.433 1.00 0.00 H new ATOM 1704 N GLY A 113 11.507 4.750 -4.567 1.00 0.00 N ATOM 1705 CA GLY A 113 10.781 5.016 -5.795 1.00 0.00 C ATOM 1706 C GLY A 113 9.287 4.814 -5.642 1.00 0.00 C ATOM 1707 O GLY A 113 8.614 4.378 -6.577 1.00 0.00 O ATOM 0 H GLY A 113 12.017 5.548 -4.189 1.00 0.00 H new ATOM 0 HA2 GLY A 113 10.975 6.040 -6.113 1.00 0.00 H new ATOM 0 HA3 GLY A 113 11.154 4.361 -6.583 1.00 0.00 H new ATOM 1711 N ILE A 114 8.767 5.129 -4.461 1.00 0.00 N ATOM 1712 CA ILE A 114 7.342 4.979 -4.188 1.00 0.00 C ATOM 1713 C ILE A 114 6.563 6.208 -4.645 1.00 0.00 C ATOM 1714 O ILE A 114 7.023 7.339 -4.494 1.00 0.00 O ATOM 1715 CB ILE A 114 7.078 4.748 -2.689 1.00 0.00 C ATOM 1716 CG1 ILE A 114 8.006 3.659 -2.146 1.00 0.00 C ATOM 1717 CG2 ILE A 114 5.621 4.373 -2.459 1.00 0.00 C ATOM 1718 CD1 ILE A 114 7.878 2.338 -2.873 1.00 0.00 C ATOM 0 H ILE A 114 9.311 5.490 -3.677 1.00 0.00 H new ATOM 0 HA ILE A 114 7.003 4.107 -4.748 1.00 0.00 H new ATOM 0 HB ILE A 114 7.284 5.674 -2.153 1.00 0.00 H new ATOM 0 HG12 ILE A 114 9.038 4.004 -2.215 1.00 0.00 H new ATOM 0 HG13 ILE A 114 7.792 3.505 -1.088 1.00 0.00 H new ATOM 0 HG21 ILE A 114 5.450 4.213 -1.394 1.00 0.00 H new ATOM 0 HG22 ILE A 114 4.978 5.179 -2.813 1.00 0.00 H new ATOM 0 HG23 ILE A 114 5.390 3.458 -3.005 1.00 0.00 H new ATOM 0 HD11 ILE A 114 8.565 1.614 -2.435 1.00 0.00 H new ATOM 0 HD12 ILE A 114 6.856 1.970 -2.782 1.00 0.00 H new ATOM 0 HD13 ILE A 114 8.121 2.477 -3.926 1.00 0.00 H new ATOM 1730 N GLN A 115 5.380 5.978 -5.205 1.00 0.00 N ATOM 1731 CA GLN A 115 4.535 7.066 -5.685 1.00 0.00 C ATOM 1732 C GLN A 115 3.260 7.170 -4.854 1.00 0.00 C ATOM 1733 O GLN A 115 2.401 6.291 -4.904 1.00 0.00 O ATOM 1734 CB GLN A 115 4.185 6.854 -7.160 1.00 0.00 C ATOM 1735 CG GLN A 115 4.864 7.844 -8.093 1.00 0.00 C ATOM 1736 CD GLN A 115 5.816 7.174 -9.065 1.00 0.00 C ATOM 1737 OE1 GLN A 115 5.260 6.468 -10.043 1.00 0.00 O flip ATOM 1738 NE2 GLN A 115 7.034 7.290 -8.939 1.00 0.00 N flip ATOM 0 H GLN A 115 4.984 5.047 -5.338 1.00 0.00 H new ATOM 0 HA GLN A 115 5.090 7.999 -5.582 1.00 0.00 H new ATOM 0 HB2 GLN A 115 4.467 5.842 -7.450 1.00 0.00 H new ATOM 0 HB3 GLN A 115 3.105 6.932 -7.284 1.00 0.00 H new ATOM 0 HG2 GLN A 115 4.104 8.389 -8.653 1.00 0.00 H new ATOM 0 HG3 GLN A 115 5.412 8.577 -7.501 1.00 0.00 H new ATOM 0 HE21 GLN A 115 7.417 7.843 -8.172 1.00 0.00 H new ATOM 0 HE22 GLN A 115 7.661 6.834 -9.602 1.00 0.00 H new ATOM 1747 N PHE A 116 3.145 8.252 -4.091 1.00 0.00 N ATOM 1748 CA PHE A 116 1.975 8.473 -3.249 1.00 0.00 C ATOM 1749 C PHE A 116 0.963 9.372 -3.951 1.00 0.00 C ATOM 1750 O PHE A 116 1.328 10.207 -4.779 1.00 0.00 O ATOM 1751 CB PHE A 116 2.389 9.096 -1.915 1.00 0.00 C ATOM 1752 CG PHE A 116 3.128 8.149 -1.014 1.00 0.00 C ATOM 1753 CD1 PHE A 116 2.468 7.092 -0.406 1.00 0.00 C ATOM 1754 CD2 PHE A 116 4.484 8.312 -0.775 1.00 0.00 C ATOM 1755 CE1 PHE A 116 3.145 6.219 0.423 1.00 0.00 C ATOM 1756 CE2 PHE A 116 5.166 7.442 0.053 1.00 0.00 C ATOM 1757 CZ PHE A 116 4.495 6.394 0.653 1.00 0.00 C ATOM 0 H PHE A 116 3.848 8.989 -4.038 1.00 0.00 H new ATOM 0 HA PHE A 116 1.507 7.507 -3.060 1.00 0.00 H new ATOM 0 HB2 PHE A 116 3.017 9.965 -2.109 1.00 0.00 H new ATOM 0 HB3 PHE A 116 1.498 9.455 -1.399 1.00 0.00 H new ATOM 0 HD1 PHE A 116 1.412 6.950 -0.583 1.00 0.00 H new ATOM 0 HD2 PHE A 116 5.013 9.129 -1.242 1.00 0.00 H new ATOM 0 HE1 PHE A 116 2.619 5.400 0.891 1.00 0.00 H new ATOM 0 HE2 PHE A 116 6.222 7.581 0.231 1.00 0.00 H new ATOM 0 HZ PHE A 116 5.026 5.712 1.301 1.00 0.00 H new ATOM 1767 N ALA A 117 -0.311 9.196 -3.615 1.00 0.00 N ATOM 1768 CA ALA A 117 -1.375 9.993 -4.214 1.00 0.00 C ATOM 1769 C ALA A 117 -2.693 9.801 -3.466 1.00 0.00 C ATOM 1770 O ALA A 117 -2.909 8.771 -2.827 1.00 0.00 O ATOM 1771 CB ALA A 117 -1.542 9.631 -5.681 1.00 0.00 C ATOM 0 H ALA A 117 -0.631 8.509 -2.932 1.00 0.00 H new ATOM 0 HA ALA A 117 -1.095 11.044 -4.140 1.00 0.00 H new ATOM 0 HB1 ALA A 117 -2.340 10.233 -6.116 1.00 0.00 H new ATOM 0 HB2 ALA A 117 -0.610 9.825 -6.212 1.00 0.00 H new ATOM 0 HB3 ALA A 117 -1.796 8.575 -5.768 1.00 0.00 H new ATOM 1777 N PRO A 118 -3.594 10.795 -3.538 1.00 0.00 N ATOM 1778 CA PRO A 118 -4.895 10.731 -2.864 1.00 0.00 C ATOM 1779 C PRO A 118 -5.828 9.707 -3.504 1.00 0.00 C ATOM 1780 O PRO A 118 -5.483 9.079 -4.506 1.00 0.00 O ATOM 1781 CB PRO A 118 -5.455 12.144 -3.036 1.00 0.00 C ATOM 1782 CG PRO A 118 -4.790 12.669 -4.260 1.00 0.00 C ATOM 1783 CD PRO A 118 -3.417 12.058 -4.279 1.00 0.00 C ATOM 0 HA PRO A 118 -4.800 10.420 -1.824 1.00 0.00 H new ATOM 0 HB2 PRO A 118 -6.539 12.129 -3.150 1.00 0.00 H new ATOM 0 HB3 PRO A 118 -5.234 12.766 -2.168 1.00 0.00 H new ATOM 0 HG2 PRO A 118 -5.350 12.398 -5.155 1.00 0.00 H new ATOM 0 HG3 PRO A 118 -4.733 13.757 -4.237 1.00 0.00 H new ATOM 0 HD2 PRO A 118 -3.070 11.881 -5.297 1.00 0.00 H new ATOM 0 HD3 PRO A 118 -2.683 12.705 -3.800 1.00 0.00 H new ATOM 1791 N TYR A 119 -7.009 9.544 -2.919 1.00 0.00 N ATOM 1792 CA TYR A 119 -7.992 8.596 -3.433 1.00 0.00 C ATOM 1793 C TYR A 119 -8.745 9.184 -4.621 1.00 0.00 C ATOM 1794 O TYR A 119 -9.631 10.022 -4.454 1.00 0.00 O ATOM 1795 CB TYR A 119 -8.978 8.205 -2.330 1.00 0.00 C ATOM 1796 CG TYR A 119 -9.641 6.865 -2.557 1.00 0.00 C ATOM 1797 CD1 TYR A 119 -8.911 5.686 -2.480 1.00 0.00 C ATOM 1798 CD2 TYR A 119 -10.996 6.780 -2.849 1.00 0.00 C ATOM 1799 CE1 TYR A 119 -9.512 4.459 -2.687 1.00 0.00 C ATOM 1800 CE2 TYR A 119 -11.606 5.557 -3.056 1.00 0.00 C ATOM 1801 CZ TYR A 119 -10.859 4.400 -2.974 1.00 0.00 C ATOM 1802 OH TYR A 119 -11.462 3.180 -3.181 1.00 0.00 O ATOM 0 H TYR A 119 -7.310 10.055 -2.089 1.00 0.00 H new ATOM 0 HA TYR A 119 -7.461 7.705 -3.769 1.00 0.00 H new ATOM 0 HB2 TYR A 119 -8.452 8.184 -1.375 1.00 0.00 H new ATOM 0 HB3 TYR A 119 -9.747 8.973 -2.253 1.00 0.00 H new ATOM 0 HD1 TYR A 119 -7.856 5.729 -2.255 1.00 0.00 H new ATOM 0 HD2 TYR A 119 -11.583 7.684 -2.915 1.00 0.00 H new ATOM 0 HE1 TYR A 119 -8.930 3.552 -2.624 1.00 0.00 H new ATOM 0 HE2 TYR A 119 -12.661 5.507 -3.281 1.00 0.00 H new ATOM 0 HH TYR A 119 -11.041 2.505 -2.609 1.00 0.00 H new ATOM 1812 N THR A 120 -8.388 8.738 -5.821 1.00 0.00 N ATOM 1813 CA THR A 120 -9.031 9.219 -7.037 1.00 0.00 C ATOM 1814 C THR A 120 -10.134 8.264 -7.485 1.00 0.00 C ATOM 1815 O THR A 120 -10.286 7.988 -8.675 1.00 0.00 O ATOM 1816 CB THR A 120 -7.998 9.382 -8.154 1.00 0.00 C ATOM 1817 OG1 THR A 120 -8.617 9.819 -9.350 1.00 0.00 O ATOM 1818 CG2 THR A 120 -7.246 8.106 -8.465 1.00 0.00 C ATOM 0 H THR A 120 -7.657 8.044 -5.977 1.00 0.00 H new ATOM 0 HA THR A 120 -9.480 10.188 -6.821 1.00 0.00 H new ATOM 0 HB THR A 120 -7.288 10.122 -7.784 1.00 0.00 H new ATOM 0 HG1 THR A 120 -9.358 9.217 -9.574 1.00 0.00 H new ATOM 0 HG21 THR A 120 -6.530 8.292 -9.266 1.00 0.00 H new ATOM 0 HG22 THR A 120 -6.715 7.770 -7.574 1.00 0.00 H new ATOM 0 HG23 THR A 120 -7.950 7.336 -8.780 1.00 0.00 H new ATOM 1826 N TRP A 121 -10.902 7.765 -6.522 1.00 0.00 N ATOM 1827 CA TRP A 121 -11.992 6.841 -6.816 1.00 0.00 C ATOM 1828 C TRP A 121 -13.277 7.276 -6.117 1.00 0.00 C ATOM 1829 O TRP A 121 -13.277 7.560 -4.919 1.00 0.00 O ATOM 1830 CB TRP A 121 -11.615 5.422 -6.386 1.00 0.00 C ATOM 1831 CG TRP A 121 -11.930 4.384 -7.420 1.00 0.00 C ATOM 1832 CD1 TRP A 121 -11.814 4.516 -8.774 1.00 0.00 C ATOM 1833 CD2 TRP A 121 -12.411 3.057 -7.184 1.00 0.00 C ATOM 1834 NE1 TRP A 121 -12.195 3.352 -9.395 1.00 0.00 N ATOM 1835 CE2 TRP A 121 -12.566 2.440 -8.441 1.00 0.00 C ATOM 1836 CE3 TRP A 121 -12.727 2.329 -6.034 1.00 0.00 C ATOM 1837 CZ2 TRP A 121 -13.022 1.131 -8.577 1.00 0.00 C ATOM 1838 CZ3 TRP A 121 -13.179 1.030 -6.170 1.00 0.00 C ATOM 1839 CH2 TRP A 121 -13.322 0.443 -7.434 1.00 0.00 C ATOM 0 H TRP A 121 -10.790 7.985 -5.532 1.00 0.00 H new ATOM 0 HA TRP A 121 -12.165 6.851 -7.892 1.00 0.00 H new ATOM 0 HB2 TRP A 121 -10.549 5.389 -6.162 1.00 0.00 H new ATOM 0 HB3 TRP A 121 -12.142 5.177 -5.464 1.00 0.00 H new ATOM 0 HD1 TRP A 121 -11.473 5.406 -9.282 1.00 0.00 H new ATOM 0 HE1 TRP A 121 -12.201 3.192 -10.402 1.00 0.00 H new ATOM 0 HE3 TRP A 121 -12.620 2.774 -5.056 1.00 0.00 H new ATOM 0 HZ2 TRP A 121 -13.135 0.676 -9.550 1.00 0.00 H new ATOM 0 HZ3 TRP A 121 -13.426 0.458 -5.288 1.00 0.00 H new ATOM 0 HH2 TRP A 121 -13.677 -0.574 -7.507 1.00 0.00 H new ATOM 1850 N SER A 122 -14.368 7.328 -6.874 1.00 0.00 N ATOM 1851 CA SER A 122 -15.659 7.729 -6.327 1.00 0.00 C ATOM 1852 C SER A 122 -16.774 6.822 -6.838 1.00 0.00 C ATOM 1853 O SER A 122 -16.649 6.201 -7.892 1.00 0.00 O ATOM 1854 CB SER A 122 -15.960 9.183 -6.692 1.00 0.00 C ATOM 1855 OG SER A 122 -16.914 9.745 -5.806 1.00 0.00 O ATOM 0 H SER A 122 -14.384 7.098 -7.868 1.00 0.00 H new ATOM 0 HA SER A 122 -15.610 7.636 -5.242 1.00 0.00 H new ATOM 0 HB2 SER A 122 -15.040 9.767 -6.659 1.00 0.00 H new ATOM 0 HB3 SER A 122 -16.334 9.235 -7.714 1.00 0.00 H new ATOM 0 HG SER A 122 -17.088 10.675 -6.060 1.00 0.00 H new ATOM 1861 N TYR A 123 -17.866 6.754 -6.082 1.00 0.00 N ATOM 1862 CA TYR A 123 -19.006 5.924 -6.458 1.00 0.00 C ATOM 1863 C TYR A 123 -20.298 6.472 -5.858 1.00 0.00 C ATOM 1864 O TYR A 123 -20.267 7.312 -4.959 1.00 0.00 O ATOM 1865 CB TYR A 123 -18.787 4.482 -5.998 1.00 0.00 C ATOM 1866 CG TYR A 123 -18.094 3.615 -7.025 1.00 0.00 C ATOM 1867 CD1 TYR A 123 -18.818 2.959 -8.011 1.00 0.00 C ATOM 1868 CD2 TYR A 123 -16.714 3.456 -7.008 1.00 0.00 C ATOM 1869 CE1 TYR A 123 -18.188 2.166 -8.951 1.00 0.00 C ATOM 1870 CE2 TYR A 123 -16.076 2.666 -7.945 1.00 0.00 C ATOM 1871 CZ TYR A 123 -16.816 2.024 -8.915 1.00 0.00 C ATOM 1872 OH TYR A 123 -16.185 1.235 -9.849 1.00 0.00 O ATOM 0 H TYR A 123 -17.985 7.263 -5.206 1.00 0.00 H new ATOM 0 HA TYR A 123 -19.095 5.941 -7.544 1.00 0.00 H new ATOM 0 HB2 TYR A 123 -18.196 4.488 -5.082 1.00 0.00 H new ATOM 0 HB3 TYR A 123 -19.752 4.038 -5.752 1.00 0.00 H new ATOM 0 HD1 TYR A 123 -19.892 3.070 -8.044 1.00 0.00 H new ATOM 0 HD2 TYR A 123 -16.131 3.958 -6.250 1.00 0.00 H new ATOM 0 HE1 TYR A 123 -18.766 1.660 -9.710 1.00 0.00 H new ATOM 0 HE2 TYR A 123 -15.002 2.552 -7.918 1.00 0.00 H new ATOM 0 HH TYR A 123 -15.240 1.135 -9.608 1.00 0.00 H new ATOM 1882 N PRO A 124 -21.457 6.002 -6.352 1.00 0.00 N ATOM 1883 CA PRO A 124 -22.764 6.449 -5.859 1.00 0.00 C ATOM 1884 C PRO A 124 -22.899 6.286 -4.349 1.00 0.00 C ATOM 1885 O PRO A 124 -23.636 7.027 -3.698 1.00 0.00 O ATOM 1886 CB PRO A 124 -23.754 5.533 -6.585 1.00 0.00 C ATOM 1887 CG PRO A 124 -23.033 5.086 -7.810 1.00 0.00 C ATOM 1888 CD PRO A 124 -21.583 4.999 -7.425 1.00 0.00 C ATOM 0 HA PRO A 124 -22.928 7.510 -6.048 1.00 0.00 H new ATOM 0 HB2 PRO A 124 -24.038 4.685 -5.962 1.00 0.00 H new ATOM 0 HB3 PRO A 124 -24.672 6.064 -6.838 1.00 0.00 H new ATOM 0 HG2 PRO A 124 -23.405 4.120 -8.152 1.00 0.00 H new ATOM 0 HG3 PRO A 124 -23.178 5.791 -8.628 1.00 0.00 H new ATOM 0 HD2 PRO A 124 -21.319 4.001 -7.076 1.00 0.00 H new ATOM 0 HD3 PRO A 124 -20.929 5.226 -8.267 1.00 0.00 H new ATOM 1896 N GLU A 125 -22.184 5.310 -3.798 1.00 0.00 N ATOM 1897 CA GLU A 125 -22.225 5.050 -2.364 1.00 0.00 C ATOM 1898 C GLU A 125 -20.821 5.073 -1.765 1.00 0.00 C ATOM 1899 O GLU A 125 -20.329 4.060 -1.266 1.00 0.00 O ATOM 1900 CB GLU A 125 -22.889 3.699 -2.089 1.00 0.00 C ATOM 1901 CG GLU A 125 -24.298 3.590 -2.647 1.00 0.00 C ATOM 1902 CD GLU A 125 -24.832 2.171 -2.610 1.00 0.00 C ATOM 1903 OE1 GLU A 125 -25.176 1.695 -1.508 1.00 0.00 O ATOM 1904 OE2 GLU A 125 -24.905 1.535 -3.683 1.00 0.00 O ATOM 0 H GLU A 125 -21.570 4.687 -4.323 1.00 0.00 H new ATOM 0 HA GLU A 125 -22.813 5.838 -1.893 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -22.275 2.907 -2.518 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -22.919 3.531 -1.013 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -24.962 4.239 -2.076 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -24.306 3.951 -3.676 1.00 0.00 H new ATOM 1911 N ILE A 126 -20.179 6.235 -1.821 1.00 0.00 N ATOM 1912 CA ILE A 126 -18.833 6.391 -1.285 1.00 0.00 C ATOM 1913 C ILE A 126 -18.869 6.941 0.138 1.00 0.00 C ATOM 1914 O ILE A 126 -17.994 6.644 0.952 1.00 0.00 O ATOM 1915 CB ILE A 126 -17.979 7.325 -2.169 1.00 0.00 C ATOM 1916 CG1 ILE A 126 -16.539 7.376 -1.658 1.00 0.00 C ATOM 1917 CG2 ILE A 126 -18.583 8.722 -2.210 1.00 0.00 C ATOM 1918 CD1 ILE A 126 -15.826 6.042 -1.724 1.00 0.00 C ATOM 0 H ILE A 126 -20.570 7.083 -2.232 1.00 0.00 H new ATOM 0 HA ILE A 126 -18.378 5.400 -1.276 1.00 0.00 H new ATOM 0 HB ILE A 126 -17.970 6.926 -3.183 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -15.980 8.107 -2.243 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -16.540 7.727 -0.626 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -17.967 9.366 -2.838 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -19.591 8.671 -2.621 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -18.623 9.131 -1.200 1.00 0.00 H new ATOM 0 HD11 ILE A 126 -14.810 6.153 -1.346 1.00 0.00 H new ATOM 0 HD12 ILE A 126 -16.362 5.313 -1.116 1.00 0.00 H new ATOM 0 HD13 ILE A 126 -15.793 5.698 -2.758 1.00 0.00 H new ATOM 1930 N ASP A 127 -19.887 7.745 0.429 1.00 0.00 N ATOM 1931 CA ASP A 127 -20.040 8.338 1.753 1.00 0.00 C ATOM 1932 C ASP A 127 -20.508 7.301 2.771 1.00 0.00 C ATOM 1933 O ASP A 127 -20.327 7.476 3.975 1.00 0.00 O ATOM 1934 CB ASP A 127 -21.030 9.502 1.701 1.00 0.00 C ATOM 1935 CG ASP A 127 -20.345 10.837 1.488 1.00 0.00 C ATOM 1936 OD1 ASP A 127 -19.189 10.842 1.016 1.00 0.00 O ATOM 1937 OD2 ASP A 127 -20.965 11.877 1.793 1.00 0.00 O ATOM 0 H ASP A 127 -20.618 8.001 -0.234 1.00 0.00 H new ATOM 0 HA ASP A 127 -19.065 8.710 2.068 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -21.745 9.331 0.896 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -21.599 9.533 2.630 1.00 0.00 H new ATOM 1942 N LYS A 128 -21.111 6.220 2.281 1.00 0.00 N ATOM 1943 CA LYS A 128 -21.601 5.160 3.153 1.00 0.00 C ATOM 1944 C LYS A 128 -20.448 4.313 3.678 1.00 0.00 C ATOM 1945 O LYS A 128 -20.499 3.800 4.797 1.00 0.00 O ATOM 1946 CB LYS A 128 -22.598 4.275 2.403 1.00 0.00 C ATOM 1947 CG LYS A 128 -23.990 4.878 2.299 1.00 0.00 C ATOM 1948 CD LYS A 128 -24.760 4.302 1.121 1.00 0.00 C ATOM 1949 CE LYS A 128 -26.220 4.062 1.473 1.00 0.00 C ATOM 1950 NZ LYS A 128 -27.132 4.481 0.372 1.00 0.00 N ATOM 0 H LYS A 128 -21.271 6.057 1.287 1.00 0.00 H new ATOM 0 HA LYS A 128 -22.104 5.624 4.001 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -22.218 4.084 1.399 1.00 0.00 H new ATOM 0 HB3 LYS A 128 -22.666 3.311 2.907 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -24.539 4.689 3.221 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -23.912 5.960 2.190 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -24.696 4.985 0.274 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -24.301 3.364 0.809 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -26.373 3.004 1.688 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -26.470 4.611 2.381 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 -28.118 4.301 0.650 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -27.005 5.496 0.183 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 -26.911 3.939 -0.487 1.00 0.00 H new ATOM 1964 N ASP A 129 -19.408 4.172 2.864 1.00 0.00 N ATOM 1965 CA ASP A 129 -18.240 3.389 3.245 1.00 0.00 C ATOM 1966 C ASP A 129 -17.509 4.037 4.415 1.00 0.00 C ATOM 1967 O ASP A 129 -17.120 3.361 5.368 1.00 0.00 O ATOM 1968 CB ASP A 129 -17.291 3.240 2.054 1.00 0.00 C ATOM 1969 CG ASP A 129 -18.002 2.754 0.806 1.00 0.00 C ATOM 1970 OD1 ASP A 129 -18.584 1.649 0.845 1.00 0.00 O ATOM 1971 OD2 ASP A 129 -17.978 3.478 -0.212 1.00 0.00 O ATOM 0 H ASP A 129 -19.351 4.590 1.935 1.00 0.00 H new ATOM 0 HA ASP A 129 -18.580 2.401 3.556 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -16.817 4.200 1.848 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -16.496 2.540 2.312 1.00 0.00 H new ATOM 1976 N PHE A 130 -17.326 5.351 4.337 1.00 0.00 N ATOM 1977 CA PHE A 130 -16.642 6.091 5.392 1.00 0.00 C ATOM 1978 C PHE A 130 -17.472 6.107 6.671 1.00 0.00 C ATOM 1979 O PHE A 130 -16.928 6.140 7.774 1.00 0.00 O ATOM 1980 CB PHE A 130 -16.361 7.524 4.936 1.00 0.00 C ATOM 1981 CG PHE A 130 -15.013 7.697 4.293 1.00 0.00 C ATOM 1982 CD1 PHE A 130 -14.721 7.077 3.089 1.00 0.00 C ATOM 1983 CD2 PHE A 130 -14.039 8.478 4.895 1.00 0.00 C ATOM 1984 CE1 PHE A 130 -13.483 7.235 2.495 1.00 0.00 C ATOM 1985 CE2 PHE A 130 -12.799 8.637 4.307 1.00 0.00 C ATOM 1986 CZ PHE A 130 -12.520 8.015 3.106 1.00 0.00 C ATOM 0 H PHE A 130 -17.641 5.925 3.555 1.00 0.00 H new ATOM 0 HA PHE A 130 -15.697 5.590 5.600 1.00 0.00 H new ATOM 0 HB2 PHE A 130 -17.133 7.830 4.230 1.00 0.00 H new ATOM 0 HB3 PHE A 130 -16.433 8.191 5.795 1.00 0.00 H new ATOM 0 HD1 PHE A 130 -15.469 6.463 2.609 1.00 0.00 H new ATOM 0 HD2 PHE A 130 -14.252 8.968 5.834 1.00 0.00 H new ATOM 0 HE1 PHE A 130 -13.269 6.749 1.554 1.00 0.00 H new ATOM 0 HE2 PHE A 130 -12.048 9.248 4.786 1.00 0.00 H new ATOM 0 HZ PHE A 130 -11.551 8.138 2.645 1.00 0.00 H new ATOM 1996 N GLU A 131 -18.792 6.083 6.515 1.00 0.00 N ATOM 1997 CA GLU A 131 -19.696 6.095 7.659 1.00 0.00 C ATOM 1998 C GLU A 131 -19.705 4.740 8.360 1.00 0.00 C ATOM 1999 O GLU A 131 -19.750 4.667 9.588 1.00 0.00 O ATOM 2000 CB GLU A 131 -21.114 6.459 7.210 1.00 0.00 C ATOM 2001 CG GLU A 131 -21.967 7.055 8.318 1.00 0.00 C ATOM 2002 CD GLU A 131 -23.160 7.824 7.785 1.00 0.00 C ATOM 2003 OE1 GLU A 131 -22.974 8.636 6.853 1.00 0.00 O ATOM 2004 OE2 GLU A 131 -24.279 7.614 8.297 1.00 0.00 O ATOM 0 H GLU A 131 -19.259 6.055 5.608 1.00 0.00 H new ATOM 0 HA GLU A 131 -19.340 6.846 8.364 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -21.054 7.170 6.386 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -21.605 5.565 6.825 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -22.317 6.256 8.972 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -21.353 7.719 8.927 1.00 0.00 H new ATOM 2011 N SER A 132 -19.661 3.671 7.573 1.00 0.00 N ATOM 2012 CA SER A 132 -19.663 2.319 8.120 1.00 0.00 C ATOM 2013 C SER A 132 -18.457 2.097 9.026 1.00 0.00 C ATOM 2014 O SER A 132 -18.583 1.549 10.121 1.00 0.00 O ATOM 2015 CB SER A 132 -19.662 1.289 6.989 1.00 0.00 C ATOM 2016 OG SER A 132 -20.982 0.911 6.640 1.00 0.00 O ATOM 0 H SER A 132 -19.624 3.714 6.555 1.00 0.00 H new ATOM 0 HA SER A 132 -20.569 2.196 8.714 1.00 0.00 H new ATOM 0 HB2 SER A 132 -19.157 1.703 6.117 1.00 0.00 H new ATOM 0 HB3 SER A 132 -19.098 0.408 7.296 1.00 0.00 H new ATOM 0 HG SER A 132 -20.953 0.253 5.914 1.00 0.00 H new ATOM 2022 N SER A 133 -17.288 2.526 8.562 1.00 0.00 N ATOM 2023 CA SER A 133 -16.058 2.375 9.330 1.00 0.00 C ATOM 2024 C SER A 133 -15.928 3.480 10.372 1.00 0.00 C ATOM 2025 O SER A 133 -15.352 3.275 11.441 1.00 0.00 O ATOM 2026 CB SER A 133 -14.845 2.392 8.397 1.00 0.00 C ATOM 2027 OG SER A 133 -14.824 3.570 7.608 1.00 0.00 O ATOM 0 H SER A 133 -17.167 2.981 7.657 1.00 0.00 H new ATOM 0 HA SER A 133 -16.097 1.416 9.847 1.00 0.00 H new ATOM 0 HB2 SER A 133 -13.929 2.328 8.985 1.00 0.00 H new ATOM 0 HB3 SER A 133 -14.869 1.516 7.748 1.00 0.00 H new ATOM 0 HG SER A 133 -14.039 3.557 7.022 1.00 0.00 H new ATOM 2033 N GLY A 134 -16.468 4.653 10.056 1.00 0.00 N ATOM 2034 CA GLY A 134 -16.401 5.772 10.977 1.00 0.00 C ATOM 2035 C GLY A 134 -15.293 6.746 10.627 1.00 0.00 C ATOM 2036 O GLY A 134 -14.752 7.421 11.503 1.00 0.00 O ATOM 0 H GLY A 134 -16.951 4.848 9.179 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -17.356 6.297 10.976 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -16.245 5.397 11.989 1.00 0.00 H new ATOM 2040 N LEU A 135 -14.954 6.819 9.345 1.00 0.00 N ATOM 2041 CA LEU A 135 -13.903 7.717 8.881 1.00 0.00 C ATOM 2042 C LEU A 135 -14.490 9.041 8.403 1.00 0.00 C ATOM 2043 O LEU A 135 -15.662 9.115 8.035 1.00 0.00 O ATOM 2044 CB LEU A 135 -13.104 7.063 7.752 1.00 0.00 C ATOM 2045 CG LEU A 135 -12.281 5.842 8.164 1.00 0.00 C ATOM 2046 CD1 LEU A 135 -11.554 5.257 6.964 1.00 0.00 C ATOM 2047 CD2 LEU A 135 -11.291 6.213 9.259 1.00 0.00 C ATOM 0 H LEU A 135 -15.392 6.267 8.608 1.00 0.00 H new ATOM 0 HA LEU A 135 -13.236 7.917 9.719 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -13.795 6.767 6.963 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -12.432 7.807 7.325 1.00 0.00 H new ATOM 0 HG LEU A 135 -12.961 5.085 8.555 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -10.974 4.389 7.278 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -12.281 4.955 6.210 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -10.885 6.007 6.543 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -10.713 5.333 9.541 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -10.617 6.988 8.893 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -11.833 6.585 10.129 1.00 0.00 H new ATOM 2059 N ASP A 136 -13.666 10.084 8.410 1.00 0.00 N ATOM 2060 CA ASP A 136 -14.104 11.406 7.978 1.00 0.00 C ATOM 2061 C ASP A 136 -13.640 11.694 6.553 1.00 0.00 C ATOM 2062 O ASP A 136 -12.673 11.102 6.074 1.00 0.00 O ATOM 2063 CB ASP A 136 -13.568 12.480 8.927 1.00 0.00 C ATOM 2064 CG ASP A 136 -14.560 13.606 9.145 1.00 0.00 C ATOM 2065 OD1 ASP A 136 -15.707 13.318 9.545 1.00 0.00 O ATOM 2066 OD2 ASP A 136 -14.189 14.777 8.914 1.00 0.00 O ATOM 0 H ASP A 136 -12.692 10.039 8.710 1.00 0.00 H new ATOM 0 HA ASP A 136 -15.194 11.424 7.998 1.00 0.00 H new ATOM 0 HB2 ASP A 136 -13.323 12.024 9.886 1.00 0.00 H new ATOM 0 HB3 ASP A 136 -12.642 12.889 8.523 1.00 0.00 H new ATOM 2071 N ARG A 137 -14.335 12.606 5.882 1.00 0.00 N ATOM 2072 CA ARG A 137 -13.994 12.972 4.513 1.00 0.00 C ATOM 2073 C ARG A 137 -13.208 14.279 4.477 1.00 0.00 C ATOM 2074 O ARG A 137 -12.353 14.478 3.614 1.00 0.00 O ATOM 2075 CB ARG A 137 -15.261 13.103 3.667 1.00 0.00 C ATOM 2076 CG ARG A 137 -15.890 11.767 3.303 1.00 0.00 C ATOM 2077 CD ARG A 137 -16.811 11.268 4.404 1.00 0.00 C ATOM 2078 NE ARG A 137 -17.957 12.153 4.606 1.00 0.00 N ATOM 2079 CZ ARG A 137 -19.070 11.792 5.239 1.00 0.00 C ATOM 2080 NH1 ARG A 137 -19.193 10.566 5.734 1.00 0.00 N ATOM 2081 NH2 ARG A 137 -20.064 12.659 5.377 1.00 0.00 N ATOM 0 H ARG A 137 -15.138 13.105 6.264 1.00 0.00 H new ATOM 0 HA ARG A 137 -13.368 12.182 4.099 1.00 0.00 H new ATOM 0 HB2 ARG A 137 -15.991 13.703 4.211 1.00 0.00 H new ATOM 0 HB3 ARG A 137 -15.022 13.644 2.752 1.00 0.00 H new ATOM 0 HG2 ARG A 137 -16.452 11.869 2.375 1.00 0.00 H new ATOM 0 HG3 ARG A 137 -15.106 11.032 3.122 1.00 0.00 H new ATOM 0 HD2 ARG A 137 -17.165 10.268 4.154 1.00 0.00 H new ATOM 0 HD3 ARG A 137 -16.250 11.184 5.335 1.00 0.00 H new ATOM 0 HE ARG A 137 -17.900 13.103 4.240 1.00 0.00 H new ATOM 0 HH11 ARG A 137 -18.432 9.895 5.630 1.00 0.00 H new ATOM 0 HH12 ARG A 137 -20.049 10.295 6.218 1.00 0.00 H new ATOM 0 HH21 ARG A 137 -19.975 13.602 4.998 1.00 0.00 H new ATOM 0 HH22 ARG A 137 -20.918 12.383 5.862 1.00 0.00 H new ATOM 2095 N SER A 138 -13.503 15.166 5.421 1.00 0.00 N ATOM 2096 CA SER A 138 -12.824 16.455 5.499 1.00 0.00 C ATOM 2097 C SER A 138 -11.328 16.269 5.734 1.00 0.00 C ATOM 2098 O SER A 138 -10.503 16.895 5.069 1.00 0.00 O ATOM 2099 CB SER A 138 -13.427 17.306 6.618 1.00 0.00 C ATOM 2100 OG SER A 138 -14.406 18.197 6.110 1.00 0.00 O ATOM 0 H SER A 138 -14.208 15.016 6.143 1.00 0.00 H new ATOM 0 HA SER A 138 -12.962 16.969 4.548 1.00 0.00 H new ATOM 0 HB2 SER A 138 -13.876 16.658 7.370 1.00 0.00 H new ATOM 0 HB3 SER A 138 -12.638 17.872 7.114 1.00 0.00 H new ATOM 0 HG SER A 138 -14.778 18.728 6.845 1.00 0.00 H new ATOM 2106 N LYS A 139 -10.987 15.405 6.684 1.00 0.00 N ATOM 2107 CA LYS A 139 -9.590 15.136 7.008 1.00 0.00 C ATOM 2108 C LYS A 139 -8.849 14.580 5.797 1.00 0.00 C ATOM 2109 O LYS A 139 -9.237 13.556 5.236 1.00 0.00 O ATOM 2110 CB LYS A 139 -9.497 14.153 8.176 1.00 0.00 C ATOM 2111 CG LYS A 139 -10.118 14.672 9.461 1.00 0.00 C ATOM 2112 CD LYS A 139 -9.708 13.831 10.659 1.00 0.00 C ATOM 2113 CE LYS A 139 -10.435 12.496 10.679 1.00 0.00 C ATOM 2114 NZ LYS A 139 -10.812 12.089 12.060 1.00 0.00 N ATOM 0 H LYS A 139 -11.658 14.879 7.243 1.00 0.00 H new ATOM 0 HA LYS A 139 -9.121 16.077 7.297 1.00 0.00 H new ATOM 0 HB2 LYS A 139 -9.989 13.222 7.896 1.00 0.00 H new ATOM 0 HB3 LYS A 139 -8.449 13.918 8.359 1.00 0.00 H new ATOM 0 HG2 LYS A 139 -9.814 15.707 9.621 1.00 0.00 H new ATOM 0 HG3 LYS A 139 -11.204 14.669 9.368 1.00 0.00 H new ATOM 0 HD2 LYS A 139 -8.632 13.660 10.633 1.00 0.00 H new ATOM 0 HD3 LYS A 139 -9.922 14.377 11.578 1.00 0.00 H new ATOM 0 HE2 LYS A 139 -11.332 12.562 10.063 1.00 0.00 H new ATOM 0 HE3 LYS A 139 -9.799 11.730 10.236 1.00 0.00 H new ATOM 0 HZ1 LYS A 139 -11.305 11.174 12.030 1.00 0.00 H new ATOM 0 HZ2 LYS A 139 -9.955 12.001 12.642 1.00 0.00 H new ATOM 0 HZ3 LYS A 139 -11.440 12.807 12.474 1.00 0.00 H new ATOM 2128 N ASN A 140 -7.781 15.263 5.399 1.00 0.00 N ATOM 2129 CA ASN A 140 -6.983 14.837 4.254 1.00 0.00 C ATOM 2130 C ASN A 140 -5.499 15.085 4.502 1.00 0.00 C ATOM 2131 O ASN A 140 -4.959 16.121 4.115 1.00 0.00 O ATOM 2132 CB ASN A 140 -7.435 15.574 2.990 1.00 0.00 C ATOM 2133 CG ASN A 140 -8.138 14.658 2.007 1.00 0.00 C ATOM 2134 OD1 ASN A 140 -7.359 13.896 1.249 1.00 0.00 O flip ATOM 2135 ND2 ASN A 140 -9.366 14.636 1.930 1.00 0.00 N flip ATOM 0 H ASN A 140 -7.448 16.114 5.852 1.00 0.00 H new ATOM 0 HA ASN A 140 -7.133 13.766 4.115 1.00 0.00 H new ATOM 0 HB2 ASN A 140 -8.105 16.388 3.267 1.00 0.00 H new ATOM 0 HB3 ASN A 140 -6.569 16.025 2.506 1.00 0.00 H new ATOM 0 HD21 ASN A 140 -9.926 15.239 2.533 1.00 0.00 H new ATOM 0 HD22 ASN A 140 -9.824 14.014 1.264 1.00 0.00 H new ATOM 2142 N ASN A 141 -4.844 14.126 5.150 1.00 0.00 N ATOM 2143 CA ASN A 141 -3.422 14.240 5.451 1.00 0.00 C ATOM 2144 C ASN A 141 -2.618 13.198 4.677 1.00 0.00 C ATOM 2145 O ASN A 141 -2.312 12.125 5.196 1.00 0.00 O ATOM 2146 CB ASN A 141 -3.183 14.079 6.955 1.00 0.00 C ATOM 2147 CG ASN A 141 -2.539 15.304 7.573 1.00 0.00 C ATOM 2148 OD1 ASN A 141 -1.481 15.753 7.131 1.00 0.00 O ATOM 2149 ND2 ASN A 141 -3.176 15.853 8.601 1.00 0.00 N ATOM 0 H ASN A 141 -5.276 13.262 5.476 1.00 0.00 H new ATOM 0 HA ASN A 141 -3.087 15.231 5.143 1.00 0.00 H new ATOM 0 HB2 ASN A 141 -4.133 13.882 7.452 1.00 0.00 H new ATOM 0 HB3 ASN A 141 -2.547 13.211 7.128 1.00 0.00 H new ATOM 0 HD21 ASN A 141 -2.791 16.680 9.057 1.00 0.00 H new ATOM 0 HD22 ASN A 141 -4.051 15.448 8.934 1.00 0.00 H new ATOM 2156 N TRP A 142 -2.280 13.523 3.434 1.00 0.00 N ATOM 2157 CA TRP A 142 -1.513 12.617 2.588 1.00 0.00 C ATOM 2158 C TRP A 142 -0.072 13.096 2.443 1.00 0.00 C ATOM 2159 O TRP A 142 0.541 12.940 1.387 1.00 0.00 O ATOM 2160 CB TRP A 142 -2.165 12.497 1.209 1.00 0.00 C ATOM 2161 CG TRP A 142 -2.501 13.821 0.594 1.00 0.00 C ATOM 2162 CD1 TRP A 142 -3.617 14.573 0.825 1.00 0.00 C ATOM 2163 CD2 TRP A 142 -1.715 14.550 -0.356 1.00 0.00 C ATOM 2164 NE1 TRP A 142 -3.573 15.725 0.078 1.00 0.00 N ATOM 2165 CE2 TRP A 142 -2.416 15.734 -0.655 1.00 0.00 C ATOM 2166 CE3 TRP A 142 -0.487 14.317 -0.982 1.00 0.00 C ATOM 2167 CZ2 TRP A 142 -1.928 16.681 -1.553 1.00 0.00 C ATOM 2168 CZ3 TRP A 142 -0.005 15.258 -1.873 1.00 0.00 C ATOM 2169 CH2 TRP A 142 -0.724 16.427 -2.150 1.00 0.00 C ATOM 0 H TRP A 142 -2.525 14.408 2.990 1.00 0.00 H new ATOM 0 HA TRP A 142 -1.504 11.636 3.064 1.00 0.00 H new ATOM 0 HB2 TRP A 142 -1.493 11.955 0.543 1.00 0.00 H new ATOM 0 HB3 TRP A 142 -3.075 11.903 1.296 1.00 0.00 H new ATOM 0 HD1 TRP A 142 -4.418 14.302 1.497 1.00 0.00 H new ATOM 0 HE1 TRP A 142 -4.286 16.455 0.070 1.00 0.00 H new ATOM 0 HE3 TRP A 142 0.075 13.419 -0.774 1.00 0.00 H new ATOM 0 HZ2 TRP A 142 -2.481 17.583 -1.770 1.00 0.00 H new ATOM 0 HZ3 TRP A 142 0.942 15.088 -2.364 1.00 0.00 H new ATOM 0 HH2 TRP A 142 -0.319 17.143 -2.850 1.00 0.00 H new ATOM 2180 N ASN A 143 0.461 13.681 3.510 1.00 0.00 N ATOM 2181 CA ASN A 143 1.830 14.185 3.502 1.00 0.00 C ATOM 2182 C ASN A 143 2.629 13.614 4.671 1.00 0.00 C ATOM 2183 O ASN A 143 3.784 13.220 4.512 1.00 0.00 O ATOM 2184 CB ASN A 143 1.833 15.715 3.561 1.00 0.00 C ATOM 2185 CG ASN A 143 2.234 16.343 2.241 1.00 0.00 C ATOM 2186 OD1 ASN A 143 3.366 16.189 1.785 1.00 0.00 O ATOM 2187 ND2 ASN A 143 1.303 17.057 1.618 1.00 0.00 N ATOM 0 H ASN A 143 -0.034 13.818 4.391 1.00 0.00 H new ATOM 0 HA ASN A 143 2.303 13.864 2.574 1.00 0.00 H new ATOM 0 HB2 ASN A 143 0.840 16.067 3.841 1.00 0.00 H new ATOM 0 HB3 ASN A 143 2.520 16.045 4.341 1.00 0.00 H new ATOM 0 HD21 ASN A 143 1.515 17.503 0.726 1.00 0.00 H new ATOM 0 HD22 ASN A 143 0.376 17.159 2.032 1.00 0.00 H new ATOM 2194 N ASP A 144 2.006 13.576 5.845 1.00 0.00 N ATOM 2195 CA ASP A 144 2.659 13.054 7.041 1.00 0.00 C ATOM 2196 C ASP A 144 3.143 11.625 6.823 1.00 0.00 C ATOM 2197 O ASP A 144 2.342 10.694 6.743 1.00 0.00 O ATOM 2198 CB ASP A 144 1.701 13.103 8.232 1.00 0.00 C ATOM 2199 CG ASP A 144 1.736 14.440 8.948 1.00 0.00 C ATOM 2200 OD1 ASP A 144 2.846 14.980 9.140 1.00 0.00 O ATOM 2201 OD2 ASP A 144 0.655 14.945 9.316 1.00 0.00 O ATOM 0 H ASP A 144 1.050 13.900 5.994 1.00 0.00 H new ATOM 0 HA ASP A 144 3.525 13.681 7.252 1.00 0.00 H new ATOM 0 HB2 ASP A 144 0.686 12.905 7.887 1.00 0.00 H new ATOM 0 HB3 ASP A 144 1.959 12.311 8.935 1.00 0.00 H new ATOM 2206 N VAL A 145 4.458 11.459 6.727 1.00 0.00 N ATOM 2207 CA VAL A 145 5.049 10.143 6.518 1.00 0.00 C ATOM 2208 C VAL A 145 6.361 10.004 7.286 1.00 0.00 C ATOM 2209 O VAL A 145 7.104 10.971 7.444 1.00 0.00 O ATOM 2210 CB VAL A 145 5.306 9.874 5.021 1.00 0.00 C ATOM 2211 CG1 VAL A 145 6.270 10.901 4.447 1.00 0.00 C ATOM 2212 CG2 VAL A 145 5.830 8.460 4.812 1.00 0.00 C ATOM 0 H VAL A 145 5.134 12.220 6.791 1.00 0.00 H new ATOM 0 HA VAL A 145 4.335 9.409 6.891 1.00 0.00 H new ATOM 0 HB VAL A 145 4.359 9.966 4.489 1.00 0.00 H new ATOM 0 HG11 VAL A 145 6.437 10.692 3.390 1.00 0.00 H new ATOM 0 HG12 VAL A 145 5.846 11.899 4.557 1.00 0.00 H new ATOM 0 HG13 VAL A 145 7.218 10.848 4.982 1.00 0.00 H new ATOM 0 HG21 VAL A 145 6.005 8.290 3.750 1.00 0.00 H new ATOM 0 HG22 VAL A 145 6.765 8.334 5.358 1.00 0.00 H new ATOM 0 HG23 VAL A 145 5.096 7.742 5.178 1.00 0.00 H new ATOM 2222 N ASP A 146 6.637 8.792 7.760 1.00 0.00 N ATOM 2223 CA ASP A 146 7.858 8.528 8.511 1.00 0.00 C ATOM 2224 C ASP A 146 8.864 7.758 7.662 1.00 0.00 C ATOM 2225 O ASP A 146 8.578 6.660 7.185 1.00 0.00 O ATOM 2226 CB ASP A 146 7.538 7.739 9.783 1.00 0.00 C ATOM 2227 CG ASP A 146 6.669 8.523 10.747 1.00 0.00 C ATOM 2228 OD1 ASP A 146 7.213 9.379 11.475 1.00 0.00 O ATOM 2229 OD2 ASP A 146 5.444 8.281 10.772 1.00 0.00 O ATOM 0 H ASP A 146 6.032 7.980 7.637 1.00 0.00 H new ATOM 0 HA ASP A 146 8.300 9.486 8.786 1.00 0.00 H new ATOM 0 HB2 ASP A 146 7.032 6.812 9.514 1.00 0.00 H new ATOM 0 HB3 ASP A 146 8.468 7.463 10.279 1.00 0.00 H new ATOM 2234 N ASP A 147 10.044 8.341 7.478 1.00 0.00 N ATOM 2235 CA ASP A 147 11.093 7.711 6.686 1.00 0.00 C ATOM 2236 C ASP A 147 12.112 7.018 7.587 1.00 0.00 C ATOM 2237 O ASP A 147 12.683 7.638 8.484 1.00 0.00 O ATOM 2238 CB ASP A 147 11.791 8.751 5.806 1.00 0.00 C ATOM 2239 CG ASP A 147 11.561 8.505 4.328 1.00 0.00 C ATOM 2240 OD1 ASP A 147 10.417 8.171 3.953 1.00 0.00 O ATOM 2241 OD2 ASP A 147 12.523 8.648 3.544 1.00 0.00 O ATOM 0 H ASP A 147 10.297 9.249 7.867 1.00 0.00 H new ATOM 0 HA ASP A 147 10.631 6.959 6.047 1.00 0.00 H new ATOM 0 HB2 ASP A 147 11.429 9.745 6.067 1.00 0.00 H new ATOM 0 HB3 ASP A 147 12.861 8.737 6.012 1.00 0.00 H new ATOM 2246 N PHE A 148 12.333 5.731 7.342 1.00 0.00 N ATOM 2247 CA PHE A 148 13.281 4.955 8.131 1.00 0.00 C ATOM 2248 C PHE A 148 14.502 4.574 7.297 1.00 0.00 C ATOM 2249 O PHE A 148 15.022 3.464 7.411 1.00 0.00 O ATOM 2250 CB PHE A 148 12.610 3.694 8.680 1.00 0.00 C ATOM 2251 CG PHE A 148 11.780 3.941 9.906 1.00 0.00 C ATOM 2252 CD1 PHE A 148 10.523 4.516 9.805 1.00 0.00 C ATOM 2253 CD2 PHE A 148 12.257 3.598 11.162 1.00 0.00 C ATOM 2254 CE1 PHE A 148 9.757 4.744 10.931 1.00 0.00 C ATOM 2255 CE2 PHE A 148 11.495 3.824 12.293 1.00 0.00 C ATOM 2256 CZ PHE A 148 10.243 4.398 12.177 1.00 0.00 C ATOM 0 H PHE A 148 11.868 5.204 6.603 1.00 0.00 H new ATOM 0 HA PHE A 148 13.612 5.574 8.965 1.00 0.00 H new ATOM 0 HB2 PHE A 148 11.978 3.262 7.904 1.00 0.00 H new ATOM 0 HB3 PHE A 148 13.378 2.956 8.914 1.00 0.00 H new ATOM 0 HD1 PHE A 148 10.138 4.789 8.834 1.00 0.00 H new ATOM 0 HD2 PHE A 148 13.235 3.149 11.258 1.00 0.00 H new ATOM 0 HE1 PHE A 148 8.779 5.192 10.838 1.00 0.00 H new ATOM 0 HE2 PHE A 148 11.877 3.552 13.266 1.00 0.00 H new ATOM 0 HZ PHE A 148 9.646 4.576 13.059 1.00 0.00 H new ATOM 2396 N SER A 157 14.303 14.559 1.127 1.00 0.00 N ATOM 2397 CA SER A 157 14.608 13.136 1.214 1.00 0.00 C ATOM 2398 C SER A 157 14.460 12.463 -0.149 1.00 0.00 C ATOM 2399 O SER A 157 13.363 12.052 -0.530 1.00 0.00 O ATOM 2400 CB SER A 157 13.689 12.458 2.232 1.00 0.00 C ATOM 2401 OG SER A 157 14.269 11.265 2.728 1.00 0.00 O ATOM 0 HA SER A 157 15.642 13.031 1.541 1.00 0.00 H new ATOM 0 HB2 SER A 157 13.491 13.140 3.058 1.00 0.00 H new ATOM 0 HB3 SER A 157 12.729 12.233 1.767 1.00 0.00 H new ATOM 0 HG SER A 157 13.562 10.615 2.925 1.00 0.00 H new ATOM 2407 N PRO A 158 15.565 12.340 -0.907 1.00 0.00 N ATOM 2408 CA PRO A 158 15.545 11.712 -2.233 1.00 0.00 C ATOM 2409 C PRO A 158 15.282 10.212 -2.160 1.00 0.00 C ATOM 2410 O PRO A 158 16.130 9.403 -2.537 1.00 0.00 O ATOM 2411 CB PRO A 158 16.949 11.987 -2.779 1.00 0.00 C ATOM 2412 CG PRO A 158 17.799 12.165 -1.570 1.00 0.00 C ATOM 2413 CD PRO A 158 16.915 12.801 -0.533 1.00 0.00 C ATOM 0 HA PRO A 158 14.746 12.108 -2.860 1.00 0.00 H new ATOM 0 HB2 PRO A 158 17.304 11.159 -3.393 1.00 0.00 H new ATOM 0 HB3 PRO A 158 16.962 12.878 -3.406 1.00 0.00 H new ATOM 0 HG2 PRO A 158 18.185 11.208 -1.220 1.00 0.00 H new ATOM 0 HG3 PRO A 158 18.661 12.796 -1.788 1.00 0.00 H new ATOM 0 HD2 PRO A 158 17.184 12.483 0.474 1.00 0.00 H new ATOM 0 HD3 PRO A 158 16.989 13.888 -0.554 1.00 0.00 H new ATOM 2421 N ASN A 159 14.101 9.847 -1.672 1.00 0.00 N ATOM 2422 CA ASN A 159 13.724 8.444 -1.549 1.00 0.00 C ATOM 2423 C ASN A 159 12.294 8.222 -2.030 1.00 0.00 C ATOM 2424 O ASN A 159 12.021 7.298 -2.797 1.00 0.00 O ATOM 2425 CB ASN A 159 13.864 7.981 -0.098 1.00 0.00 C ATOM 2426 CG ASN A 159 15.312 7.866 0.336 1.00 0.00 C ATOM 2427 OD1 ASN A 159 16.162 8.651 -0.084 1.00 0.00 O ATOM 2428 ND2 ASN A 159 15.600 6.884 1.182 1.00 0.00 N ATOM 0 H ASN A 159 13.388 10.504 -1.355 1.00 0.00 H new ATOM 0 HA ASN A 159 14.395 7.857 -2.176 1.00 0.00 H new ATOM 0 HB2 ASN A 159 13.346 8.683 0.556 1.00 0.00 H new ATOM 0 HB3 ASN A 159 13.374 7.014 0.021 1.00 0.00 H new ATOM 0 HD21 ASN A 159 16.558 6.757 1.509 1.00 0.00 H new ATOM 0 HD22 ASN A 159 14.864 6.256 1.504 1.00 0.00 H new ATOM 2435 N TRP A 160 11.383 9.078 -1.575 1.00 0.00 N ATOM 2436 CA TRP A 160 9.980 8.978 -1.958 1.00 0.00 C ATOM 2437 C TRP A 160 9.514 10.257 -2.646 1.00 0.00 C ATOM 2438 O TRP A 160 9.944 11.355 -2.294 1.00 0.00 O ATOM 2439 CB TRP A 160 9.113 8.702 -0.728 1.00 0.00 C ATOM 2440 CG TRP A 160 9.232 9.756 0.330 1.00 0.00 C ATOM 2441 CD1 TRP A 160 10.311 9.996 1.131 1.00 0.00 C ATOM 2442 CD2 TRP A 160 8.234 10.713 0.703 1.00 0.00 C ATOM 2443 NE1 TRP A 160 10.047 11.042 1.979 1.00 0.00 N ATOM 2444 CE2 TRP A 160 8.778 11.501 1.736 1.00 0.00 C ATOM 2445 CE3 TRP A 160 6.935 10.982 0.265 1.00 0.00 C ATOM 2446 CZ2 TRP A 160 8.067 12.537 2.336 1.00 0.00 C ATOM 2447 CZ3 TRP A 160 6.230 12.011 0.861 1.00 0.00 C ATOM 2448 CH2 TRP A 160 6.798 12.778 1.886 1.00 0.00 C ATOM 0 H TRP A 160 11.593 9.849 -0.940 1.00 0.00 H new ATOM 0 HA TRP A 160 9.877 8.150 -2.659 1.00 0.00 H new ATOM 0 HB2 TRP A 160 8.071 8.623 -1.037 1.00 0.00 H new ATOM 0 HB3 TRP A 160 9.393 7.738 -0.304 1.00 0.00 H new ATOM 0 HD1 TRP A 160 11.238 9.443 1.102 1.00 0.00 H new ATOM 0 HE1 TRP A 160 10.690 11.417 2.676 1.00 0.00 H new ATOM 0 HE3 TRP A 160 6.489 10.396 -0.525 1.00 0.00 H new ATOM 0 HZ2 TRP A 160 8.502 13.129 3.128 1.00 0.00 H new ATOM 0 HZ3 TRP A 160 5.225 12.227 0.531 1.00 0.00 H new ATOM 0 HH2 TRP A 160 6.222 13.576 2.330 1.00 0.00 H new ATOM 2459 N SER A 161 8.633 10.107 -3.629 1.00 0.00 N ATOM 2460 CA SER A 161 8.110 11.250 -4.367 1.00 0.00 C ATOM 2461 C SER A 161 6.612 11.103 -4.612 1.00 0.00 C ATOM 2462 O SER A 161 6.082 9.991 -4.634 1.00 0.00 O ATOM 2463 CB SER A 161 8.844 11.402 -5.700 1.00 0.00 C ATOM 2464 OG SER A 161 10.110 10.768 -5.662 1.00 0.00 O ATOM 0 H SER A 161 8.266 9.205 -3.933 1.00 0.00 H new ATOM 0 HA SER A 161 8.274 12.144 -3.765 1.00 0.00 H new ATOM 0 HB2 SER A 161 8.243 10.972 -6.501 1.00 0.00 H new ATOM 0 HB3 SER A 161 8.971 12.460 -5.930 1.00 0.00 H new ATOM 0 HG SER A 161 10.557 10.879 -6.527 1.00 0.00 H new ATOM 2470 N ILE A 162 5.934 12.231 -4.797 1.00 0.00 N ATOM 2471 CA ILE A 162 4.497 12.229 -5.043 1.00 0.00 C ATOM 2472 C ILE A 162 4.199 12.177 -6.536 1.00 0.00 C ATOM 2473 O ILE A 162 4.943 12.728 -7.347 1.00 0.00 O ATOM 2474 CB ILE A 162 3.821 13.474 -4.436 1.00 0.00 C ATOM 2475 CG1 ILE A 162 4.222 13.638 -2.968 1.00 0.00 C ATOM 2476 CG2 ILE A 162 2.308 13.374 -4.569 1.00 0.00 C ATOM 2477 CD1 ILE A 162 4.334 15.082 -2.530 1.00 0.00 C ATOM 0 H ILE A 162 6.357 13.159 -4.781 1.00 0.00 H new ATOM 0 HA ILE A 162 4.093 11.338 -4.563 1.00 0.00 H new ATOM 0 HB ILE A 162 4.158 14.354 -4.985 1.00 0.00 H new ATOM 0 HG12 ILE A 162 3.488 13.132 -2.341 1.00 0.00 H new ATOM 0 HG13 ILE A 162 5.178 13.142 -2.803 1.00 0.00 H new ATOM 0 HG21 ILE A 162 1.845 14.261 -4.136 1.00 0.00 H new ATOM 0 HG22 ILE A 162 2.039 13.303 -5.623 1.00 0.00 H new ATOM 0 HG23 ILE A 162 1.954 12.487 -4.044 1.00 0.00 H new ATOM 0 HD11 ILE A 162 4.621 15.122 -1.479 1.00 0.00 H new ATOM 0 HD12 ILE A 162 5.089 15.587 -3.132 1.00 0.00 H new ATOM 0 HD13 ILE A 162 3.372 15.578 -2.662 1.00 0.00 H new ATOM 2489 N LEU A 163 3.105 11.512 -6.894 1.00 0.00 N ATOM 2490 CA LEU A 163 2.709 11.389 -8.292 1.00 0.00 C ATOM 2491 C LEU A 163 2.115 12.698 -8.808 1.00 0.00 C ATOM 2492 O LEU A 163 1.280 13.312 -8.142 1.00 0.00 O ATOM 2493 CB LEU A 163 1.695 10.255 -8.458 1.00 0.00 C ATOM 2494 CG LEU A 163 1.649 9.628 -9.853 1.00 0.00 C ATOM 2495 CD1 LEU A 163 1.338 8.142 -9.759 1.00 0.00 C ATOM 2496 CD2 LEU A 163 0.619 10.337 -10.720 1.00 0.00 C ATOM 0 H LEU A 163 2.477 11.050 -6.236 1.00 0.00 H new ATOM 0 HA LEU A 163 3.600 11.160 -8.877 1.00 0.00 H new ATOM 0 HB2 LEU A 163 1.924 9.474 -7.733 1.00 0.00 H new ATOM 0 HB3 LEU A 163 0.703 10.636 -8.214 1.00 0.00 H new ATOM 0 HG LEU A 163 2.628 9.744 -10.317 1.00 0.00 H new ATOM 0 HD11 LEU A 163 1.309 7.712 -10.760 1.00 0.00 H new ATOM 0 HD12 LEU A 163 2.111 7.645 -9.173 1.00 0.00 H new ATOM 0 HD13 LEU A 163 0.371 8.003 -9.276 1.00 0.00 H new ATOM 0 HD21 LEU A 163 0.599 9.879 -11.709 1.00 0.00 H new ATOM 0 HD22 LEU A 163 -0.365 10.251 -10.260 1.00 0.00 H new ATOM 0 HD23 LEU A 163 0.885 11.390 -10.813 1.00 0.00 H new ATOM 2508 N PRO A 164 2.536 13.148 -10.004 1.00 0.00 N ATOM 2509 CA PRO A 164 2.037 14.390 -10.598 1.00 0.00 C ATOM 2510 C PRO A 164 0.641 14.230 -11.190 1.00 0.00 C ATOM 2511 O PRO A 164 0.239 13.130 -11.569 1.00 0.00 O ATOM 2512 CB PRO A 164 3.054 14.680 -11.701 1.00 0.00 C ATOM 2513 CG PRO A 164 3.553 13.338 -12.111 1.00 0.00 C ATOM 2514 CD PRO A 164 3.530 12.483 -10.871 1.00 0.00 C ATOM 0 HA PRO A 164 1.942 15.188 -9.862 1.00 0.00 H new ATOM 0 HB2 PRO A 164 2.593 15.205 -12.538 1.00 0.00 H new ATOM 0 HB3 PRO A 164 3.865 15.311 -11.337 1.00 0.00 H new ATOM 0 HG2 PRO A 164 2.923 12.910 -12.890 1.00 0.00 H new ATOM 0 HG3 PRO A 164 4.562 13.406 -12.518 1.00 0.00 H new ATOM 0 HD2 PRO A 164 3.240 11.457 -11.098 1.00 0.00 H new ATOM 0 HD3 PRO A 164 4.510 12.440 -10.396 1.00 0.00 H new ATOM 2522 N GLU A 165 -0.095 15.333 -11.268 1.00 0.00 N ATOM 2523 CA GLU A 165 -1.447 15.315 -11.814 1.00 0.00 C ATOM 2524 C GLU A 165 -1.430 14.969 -13.299 1.00 0.00 C ATOM 2525 O GLU A 165 -2.376 14.376 -13.818 1.00 0.00 O ATOM 2526 CB GLU A 165 -2.123 16.671 -11.603 1.00 0.00 C ATOM 2527 CG GLU A 165 -2.532 16.930 -10.162 1.00 0.00 C ATOM 2528 CD GLU A 165 -1.562 17.838 -9.435 1.00 0.00 C ATOM 2529 OE1 GLU A 165 -0.381 17.891 -9.838 1.00 0.00 O ATOM 2530 OE2 GLU A 165 -1.981 18.498 -8.461 1.00 0.00 O ATOM 0 H GLU A 165 0.222 16.252 -10.960 1.00 0.00 H new ATOM 0 HA GLU A 165 -2.014 14.548 -11.287 1.00 0.00 H new ATOM 0 HB2 GLU A 165 -1.444 17.460 -11.927 1.00 0.00 H new ATOM 0 HB3 GLU A 165 -3.006 16.730 -12.239 1.00 0.00 H new ATOM 0 HG2 GLU A 165 -3.525 17.378 -10.145 1.00 0.00 H new ATOM 0 HG3 GLU A 165 -2.602 15.980 -9.632 1.00 0.00 H new ATOM 2537 N GLU A 166 -0.349 15.342 -13.976 1.00 0.00 N ATOM 2538 CA GLU A 166 -0.210 15.072 -15.403 1.00 0.00 C ATOM 2539 C GLU A 166 -0.088 13.573 -15.668 1.00 0.00 C ATOM 2540 O GLU A 166 -0.452 13.094 -16.742 1.00 0.00 O ATOM 2541 CB GLU A 166 1.013 15.801 -15.963 1.00 0.00 C ATOM 2542 CG GLU A 166 0.995 17.300 -15.711 1.00 0.00 C ATOM 2543 CD GLU A 166 0.136 18.049 -16.711 1.00 0.00 C ATOM 2544 OE1 GLU A 166 -1.106 17.949 -16.620 1.00 0.00 O ATOM 2545 OE2 GLU A 166 0.706 18.736 -17.586 1.00 0.00 O ATOM 0 H GLU A 166 0.443 15.832 -13.560 1.00 0.00 H new ATOM 0 HA GLU A 166 -1.106 15.438 -15.904 1.00 0.00 H new ATOM 0 HB2 GLU A 166 1.914 15.377 -15.519 1.00 0.00 H new ATOM 0 HB3 GLU A 166 1.072 15.622 -17.037 1.00 0.00 H new ATOM 0 HG2 GLU A 166 0.624 17.491 -14.704 1.00 0.00 H new ATOM 0 HG3 GLU A 166 2.014 17.684 -15.753 1.00 0.00 H new ATOM 2552 N GLU A 167 0.429 12.840 -14.688 1.00 0.00 N ATOM 2553 CA GLU A 167 0.598 11.398 -14.823 1.00 0.00 C ATOM 2554 C GLU A 167 -0.459 10.642 -14.021 1.00 0.00 C ATOM 2555 O GLU A 167 -0.224 9.522 -13.568 1.00 0.00 O ATOM 2556 CB GLU A 167 1.996 10.982 -14.361 1.00 0.00 C ATOM 2557 CG GLU A 167 3.115 11.742 -15.054 1.00 0.00 C ATOM 2558 CD GLU A 167 4.490 11.321 -14.573 1.00 0.00 C ATOM 2559 OE1 GLU A 167 4.759 10.102 -14.536 1.00 0.00 O ATOM 2560 OE2 GLU A 167 5.297 12.212 -14.232 1.00 0.00 O ATOM 0 H GLU A 167 0.738 13.220 -13.793 1.00 0.00 H new ATOM 0 HA GLU A 167 0.477 11.144 -15.876 1.00 0.00 H new ATOM 0 HB2 GLU A 167 2.075 11.136 -13.285 1.00 0.00 H new ATOM 0 HB3 GLU A 167 2.127 9.915 -14.541 1.00 0.00 H new ATOM 0 HG2 GLU A 167 3.046 11.582 -16.130 1.00 0.00 H new ATOM 0 HG3 GLU A 167 2.985 12.810 -14.881 1.00 0.00 H new ATOM 2567 N ARG A 168 -1.623 11.261 -13.852 1.00 0.00 N ATOM 2568 CA ARG A 168 -2.715 10.644 -13.107 1.00 0.00 C ATOM 2569 C ARG A 168 -3.814 10.162 -14.048 1.00 0.00 C ATOM 2570 O ARG A 168 -4.994 10.179 -13.702 1.00 0.00 O ATOM 2571 CB ARG A 168 -3.293 11.634 -12.094 1.00 0.00 C ATOM 2572 CG ARG A 168 -2.521 11.685 -10.787 1.00 0.00 C ATOM 2573 CD ARG A 168 -3.440 11.967 -9.608 1.00 0.00 C ATOM 2574 NE ARG A 168 -4.027 13.303 -9.679 1.00 0.00 N ATOM 2575 CZ ARG A 168 -5.062 13.698 -8.941 1.00 0.00 C ATOM 2576 NH1 ARG A 168 -5.628 12.863 -8.079 1.00 0.00 N ATOM 2577 NH2 ARG A 168 -5.533 14.931 -9.066 1.00 0.00 N ATOM 0 H ARG A 168 -1.834 12.188 -14.220 1.00 0.00 H new ATOM 0 HA ARG A 168 -2.315 9.781 -12.574 1.00 0.00 H new ATOM 0 HB2 ARG A 168 -3.306 12.629 -12.538 1.00 0.00 H new ATOM 0 HB3 ARG A 168 -4.328 11.365 -11.885 1.00 0.00 H new ATOM 0 HG2 ARG A 168 -2.006 10.737 -10.630 1.00 0.00 H new ATOM 0 HG3 ARG A 168 -1.755 12.458 -10.846 1.00 0.00 H new ATOM 0 HD2 ARG A 168 -4.236 11.222 -9.582 1.00 0.00 H new ATOM 0 HD3 ARG A 168 -2.879 11.866 -8.679 1.00 0.00 H new ATOM 0 HE ARG A 168 -3.620 13.972 -10.332 1.00 0.00 H new ATOM 0 HH11 ARG A 168 -5.270 11.913 -7.979 1.00 0.00 H new ATOM 0 HH12 ARG A 168 -6.421 13.171 -7.516 1.00 0.00 H new ATOM 0 HH21 ARG A 168 -5.102 15.577 -9.728 1.00 0.00 H new ATOM 0 HH22 ARG A 168 -6.326 15.234 -8.501 1.00 0.00 H new ATOM 2591 N ASN A 169 -3.417 9.734 -15.242 1.00 0.00 N ATOM 2592 CA ASN A 169 -4.368 9.248 -16.235 1.00 0.00 C ATOM 2593 C ASN A 169 -4.386 7.723 -16.272 1.00 0.00 C ATOM 2594 O ASN A 169 -3.652 7.102 -17.040 1.00 0.00 O ATOM 2595 CB ASN A 169 -4.020 9.799 -17.619 1.00 0.00 C ATOM 2596 CG ASN A 169 -5.253 10.186 -18.413 1.00 0.00 C ATOM 2597 OD1 ASN A 169 -6.364 9.759 -18.104 1.00 0.00 O ATOM 2598 ND2 ASN A 169 -5.060 11.000 -19.444 1.00 0.00 N ATOM 0 H ASN A 169 -2.443 9.714 -15.545 1.00 0.00 H new ATOM 0 HA ASN A 169 -5.360 9.598 -15.951 1.00 0.00 H new ATOM 0 HB2 ASN A 169 -3.374 10.670 -17.509 1.00 0.00 H new ATOM 0 HB3 ASN A 169 -3.454 9.050 -18.174 1.00 0.00 H new ATOM 0 HD21 ASN A 169 -5.851 11.295 -20.016 1.00 0.00 H new ATOM 0 HD22 ASN A 169 -4.120 11.330 -19.664 1.00 0.00 H new ATOM 2605 N ILE A 170 -5.229 7.125 -15.436 1.00 0.00 N ATOM 2606 CA ILE A 170 -5.343 5.674 -15.372 1.00 0.00 C ATOM 2607 C ILE A 170 -6.671 5.202 -15.955 1.00 0.00 C ATOM 2608 O ILE A 170 -7.713 5.814 -15.724 1.00 0.00 O ATOM 2609 CB ILE A 170 -5.219 5.161 -13.925 1.00 0.00 C ATOM 2610 CG1 ILE A 170 -3.994 5.775 -13.245 1.00 0.00 C ATOM 2611 CG2 ILE A 170 -5.138 3.642 -13.905 1.00 0.00 C ATOM 2612 CD1 ILE A 170 -4.021 5.666 -11.736 1.00 0.00 C ATOM 0 H ILE A 170 -5.843 7.625 -14.793 1.00 0.00 H new ATOM 0 HA ILE A 170 -4.523 5.267 -15.963 1.00 0.00 H new ATOM 0 HB ILE A 170 -6.108 5.464 -13.372 1.00 0.00 H new ATOM 0 HG12 ILE A 170 -3.096 5.284 -13.620 1.00 0.00 H new ATOM 0 HG13 ILE A 170 -3.923 6.826 -13.524 1.00 0.00 H new ATOM 0 HG21 ILE A 170 -5.051 3.296 -12.875 1.00 0.00 H new ATOM 0 HG22 ILE A 170 -6.039 3.224 -14.353 1.00 0.00 H new ATOM 0 HG23 ILE A 170 -4.266 3.317 -14.472 1.00 0.00 H new ATOM 0 HD11 ILE A 170 -3.122 6.122 -11.322 1.00 0.00 H new ATOM 0 HD12 ILE A 170 -4.900 6.182 -11.350 1.00 0.00 H new ATOM 0 HD13 ILE A 170 -4.061 4.616 -11.448 1.00 0.00 H new