USER MOD reduce.3.24.130724 H: found=0, std=0, add=1040, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1034 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 117 HIS : no HE2:sc= -15.6! C(o=-19!,f=-25!) USER MOD Set 1.2: A 132 GLN : amide:sc= -3! C(o=-19!,f=-26!) USER MOD Set 2.1: A 111 MET CE :methyl -163:sc= -5.2! (180deg=-5.75!) USER MOD Set 2.2: A 115 HIS : no HD1:sc= -1.84 X(o=-7,f=-7.4) USER MOD Set 3.1: A 42 CYS SG : rot 180:sc= -0.12 USER MOD Set 3.2: A 69 CYS SG : rot -134:sc= 0.725 USER MOD Set 3.3: A 72 CYS SG : rot 126:sc= 0.0871 USER MOD Set 4.1: A 11 GLN : amide:sc= -1.02 K(o=-4.2,f=-3.2!) USER MOD Set 4.2: A 14 GLN : amide:sc= -3.19 K(o=-4.2,f=-0.46) USER MOD Single : A 8 THR OG1 : rot 35:sc= 0.426 USER MOD Single : A 15 SER OG : rot -117:sc= -5.28! USER MOD Single : A 22 ASN : amide:sc= -2.06! K(o=-2.1!,f=-0.67) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot -33:sc= 0.177 USER MOD Single : A 41 SER OG : rot -119:sc= 0.386 USER MOD Single : A 46 HIS : no HE2:sc= -9.33! C(o=-9.3!,f=-9.2!) USER MOD Single : A 51 ASN : amide:sc= -2.83! X(o=-2.8!,f=-3.1) USER MOD Single : A 53 SER OG : rot 180:sc= -2.58! USER MOD Single : A 55 TYR OH : rot 180:sc= -0.259 USER MOD Single : A 57 ASN : amide:sc= -3.77! C(o=-3.8!,f=-17!) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ -161:sc= 0 (180deg=-0.372) USER MOD Single : A 73 GLN : amide:sc= -0.408 K(o=-0.41,f=-2.2!) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 ASN : amide:sc= -12.6! C(o=-13!,f=-14!) USER MOD Single : A 81 GLN : amide:sc= -0.814 K(o=-0.81,f=-1.7!) USER MOD Single : A 82 HIS : no HD1:sc= -0.0846 X(o=-0.085,f=0) USER MOD Single : A 86 LYS NZ :NH3+ 143:sc= 0.502 (180deg=-0.0726) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0.0644 USER MOD Single : A 89 HIS : no HD1:sc= -0.024 X(o=-0.024,f=-0.0079) USER MOD Single : A 91 CYS SG : rot 119:sc= -4.21! USER MOD Single : A 96 GLN : amide:sc= -2.12 K(o=-2.1,f=-10!) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 THR OG1 : rot -76:sc= -0.896 USER MOD Single : A 108 GLN : amide:sc=-0.00653 X(o=-0.0065,f=-0.1) USER MOD Single : A 112 SER OG : rot 131:sc= -0.536 USER MOD Single : A 121 LYS NZ :NH3+ -160:sc= -0.318 (180deg=-0.923) USER MOD Single : A 123 THR OG1 : rot 180:sc= -0.0116 USER MOD Single : A 124 THR OG1 : rot 150:sc= 0 USER MOD Single : A 126 MET CE :methyl 142:sc= -0.284 (180deg=-1.41!) USER MOD Single : A 127 THR OG1 : rot -56:sc= -0.728! USER MOD Single : A 129 LYS NZ :NH3+ 145:sc= 0.471 (180deg=0.122) USER MOD Single : A 133 GLN : amide:sc= -0.164 K(o=-0.16,f=-2.6!) USER MOD ----------------------------------------------------------------- ATOM 118 N THR A 8 8.099 14.565 19.066 1.00 0.00 N ATOM 119 CA THR A 8 7.038 15.530 18.782 1.00 0.00 C ATOM 120 C THR A 8 7.617 16.939 18.801 1.00 0.00 C ATOM 121 O THR A 8 7.247 17.762 19.634 1.00 0.00 O ATOM 122 CB THR A 8 6.026 15.350 19.910 1.00 0.00 C ATOM 123 OG1 THR A 8 5.711 13.971 20.049 1.00 0.00 O ATOM 124 CG2 THR A 8 4.754 16.139 19.594 1.00 0.00 C ATOM 0 HA THR A 8 6.581 15.378 17.804 1.00 0.00 H new ATOM 0 HB THR A 8 6.454 15.720 20.842 1.00 0.00 H new ATOM 0 HG1 THR A 8 6.509 13.433 19.863 1.00 0.00 H new ATOM 0 HG21 THR A 8 4.034 16.008 20.402 1.00 0.00 H new ATOM 0 HG22 THR A 8 4.997 17.197 19.493 1.00 0.00 H new ATOM 0 HG23 THR A 8 4.323 15.776 18.661 1.00 0.00 H new ATOM 132 N ASP A 9 8.512 17.241 17.890 1.00 0.00 N ATOM 133 CA ASP A 9 9.101 18.623 17.848 1.00 0.00 C ATOM 134 C ASP A 9 7.989 19.653 18.039 1.00 0.00 C ATOM 135 O ASP A 9 8.195 20.722 18.609 1.00 0.00 O ATOM 136 CB ASP A 9 9.736 18.770 16.462 1.00 0.00 C ATOM 137 CG ASP A 9 8.674 18.589 15.371 1.00 0.00 C ATOM 138 OD1 ASP A 9 7.713 17.875 15.613 1.00 0.00 O ATOM 139 OD2 ASP A 9 8.841 19.169 14.311 1.00 0.00 O ATOM 0 H ASP A 9 8.859 16.598 17.178 1.00 0.00 H new ATOM 0 HA ASP A 9 9.839 18.779 18.635 1.00 0.00 H new ATOM 0 HB2 ASP A 9 10.200 19.752 16.369 1.00 0.00 H new ATOM 0 HB3 ASP A 9 10.527 18.031 16.336 1.00 0.00 H new ATOM 144 N ASP A 10 6.797 19.329 17.601 1.00 0.00 N ATOM 145 CA ASP A 10 5.663 20.242 17.781 1.00 0.00 C ATOM 146 C ASP A 10 5.489 20.516 19.273 1.00 0.00 C ATOM 147 O ASP A 10 5.368 21.663 19.706 1.00 0.00 O ATOM 148 CB ASP A 10 4.488 19.462 17.213 1.00 0.00 C ATOM 149 CG ASP A 10 4.489 19.573 15.687 1.00 0.00 C ATOM 150 OD1 ASP A 10 5.155 18.769 15.056 1.00 0.00 O ATOM 151 OD2 ASP A 10 3.825 20.460 15.177 1.00 0.00 O ATOM 0 H ASP A 10 6.575 18.456 17.122 1.00 0.00 H new ATOM 0 HA ASP A 10 5.778 21.210 17.294 1.00 0.00 H new ATOM 0 HB2 ASP A 10 4.554 18.416 17.512 1.00 0.00 H new ATOM 0 HB3 ASP A 10 3.552 19.850 17.615 1.00 0.00 H new ATOM 156 N GLN A 11 5.518 19.491 20.083 1.00 0.00 N ATOM 157 CA GLN A 11 5.398 19.745 21.535 1.00 0.00 C ATOM 158 C GLN A 11 6.742 20.200 22.073 1.00 0.00 C ATOM 159 O GLN A 11 6.789 21.033 22.966 1.00 0.00 O ATOM 160 CB GLN A 11 4.977 18.464 22.221 1.00 0.00 C ATOM 161 CG GLN A 11 5.009 18.735 23.725 1.00 0.00 C ATOM 162 CD GLN A 11 3.695 18.288 24.371 1.00 0.00 C ATOM 163 OE1 GLN A 11 2.866 17.648 23.731 1.00 0.00 O ATOM 164 NE2 GLN A 11 3.461 18.584 25.621 1.00 0.00 N ATOM 0 H GLN A 11 5.617 18.515 19.805 1.00 0.00 H new ATOM 0 HA GLN A 11 4.655 20.520 21.723 1.00 0.00 H new ATOM 0 HB2 GLN A 11 3.978 18.166 21.903 1.00 0.00 H new ATOM 0 HB3 GLN A 11 5.651 17.647 21.961 1.00 0.00 H new ATOM 0 HG2 GLN A 11 5.845 18.204 24.180 1.00 0.00 H new ATOM 0 HG3 GLN A 11 5.169 19.798 23.907 1.00 0.00 H new ATOM 0 HE21 GLN A 11 4.147 19.116 26.156 1.00 0.00 H new ATOM 0 HE22 GLN A 11 2.592 18.284 26.062 1.00 0.00 H new ATOM 173 N ARG A 12 7.846 19.718 21.541 1.00 0.00 N ATOM 174 CA ARG A 12 9.141 20.230 22.043 1.00 0.00 C ATOM 175 C ARG A 12 9.021 21.730 21.947 1.00 0.00 C ATOM 176 O ARG A 12 9.395 22.474 22.846 1.00 0.00 O ATOM 177 CB ARG A 12 10.208 19.713 21.092 1.00 0.00 C ATOM 178 CG ARG A 12 10.531 18.259 21.442 1.00 0.00 C ATOM 179 CD ARG A 12 11.053 17.522 20.206 1.00 0.00 C ATOM 180 NE ARG A 12 11.927 16.440 20.745 1.00 0.00 N ATOM 181 CZ ARG A 12 11.405 15.375 21.304 1.00 0.00 C ATOM 182 NH1 ARG A 12 10.107 15.237 21.401 1.00 0.00 N ATOM 183 NH2 ARG A 12 12.189 14.441 21.769 1.00 0.00 N ATOM 0 H ARG A 12 7.896 19.014 20.804 1.00 0.00 H new ATOM 0 HA ARG A 12 9.390 19.925 23.059 1.00 0.00 H new ATOM 0 HB2 ARG A 12 9.859 19.783 20.062 1.00 0.00 H new ATOM 0 HB3 ARG A 12 11.106 20.326 21.166 1.00 0.00 H new ATOM 0 HG2 ARG A 12 11.277 18.225 22.236 1.00 0.00 H new ATOM 0 HG3 ARG A 12 9.638 17.762 21.821 1.00 0.00 H new ATOM 0 HD2 ARG A 12 10.234 17.111 19.616 1.00 0.00 H new ATOM 0 HD3 ARG A 12 11.611 18.192 19.553 1.00 0.00 H new ATOM 0 HE ARG A 12 12.941 16.530 20.678 1.00 0.00 H new ATOM 0 HH11 ARG A 12 9.489 15.963 21.039 1.00 0.00 H new ATOM 0 HH12 ARG A 12 9.714 14.403 21.838 1.00 0.00 H new ATOM 0 HH21 ARG A 12 13.201 14.542 21.696 1.00 0.00 H new ATOM 0 HH22 ARG A 12 11.789 13.610 22.205 1.00 0.00 H new ATOM 197 N TRP A 13 8.420 22.176 20.872 1.00 0.00 N ATOM 198 CA TRP A 13 8.189 23.613 20.717 1.00 0.00 C ATOM 199 C TRP A 13 7.262 24.065 21.835 1.00 0.00 C ATOM 200 O TRP A 13 7.463 25.111 22.444 1.00 0.00 O ATOM 201 CB TRP A 13 7.491 23.796 19.374 1.00 0.00 C ATOM 202 CG TRP A 13 7.330 25.259 19.134 1.00 0.00 C ATOM 203 CD1 TRP A 13 6.191 25.874 18.747 1.00 0.00 C ATOM 204 CD2 TRP A 13 8.321 26.302 19.299 1.00 0.00 C ATOM 205 NE1 TRP A 13 6.427 27.232 18.655 1.00 0.00 N ATOM 206 CE2 TRP A 13 7.727 27.545 18.991 1.00 0.00 C ATOM 207 CE3 TRP A 13 9.669 26.286 19.680 1.00 0.00 C ATOM 208 CZ2 TRP A 13 8.447 28.734 19.067 1.00 0.00 C ATOM 209 CZ3 TRP A 13 10.396 27.475 19.755 1.00 0.00 C ATOM 210 CH2 TRP A 13 9.789 28.700 19.454 1.00 0.00 C ATOM 0 H TRP A 13 8.085 21.594 20.104 1.00 0.00 H new ATOM 0 HA TRP A 13 9.114 24.187 20.758 1.00 0.00 H new ATOM 0 HB2 TRP A 13 8.076 23.341 18.575 1.00 0.00 H new ATOM 0 HB3 TRP A 13 6.520 23.301 19.379 1.00 0.00 H new ATOM 0 HD1 TRP A 13 5.250 25.384 18.543 1.00 0.00 H new ATOM 0 HE1 TRP A 13 5.727 27.918 18.373 1.00 0.00 H new ATOM 0 HE3 TRP A 13 10.149 25.348 19.917 1.00 0.00 H new ATOM 0 HZ2 TRP A 13 7.972 29.674 18.829 1.00 0.00 H new ATOM 0 HZ3 TRP A 13 11.435 27.450 20.048 1.00 0.00 H new ATOM 0 HH2 TRP A 13 10.357 29.616 19.521 1.00 0.00 H new ATOM 221 N GLN A 14 6.264 23.271 22.152 1.00 0.00 N ATOM 222 CA GLN A 14 5.363 23.663 23.263 1.00 0.00 C ATOM 223 C GLN A 14 6.208 23.763 24.531 1.00 0.00 C ATOM 224 O GLN A 14 5.992 24.620 25.375 1.00 0.00 O ATOM 225 CB GLN A 14 4.310 22.546 23.364 1.00 0.00 C ATOM 226 CG GLN A 14 3.354 22.847 24.525 1.00 0.00 C ATOM 227 CD GLN A 14 3.559 21.840 25.664 1.00 0.00 C ATOM 228 OE1 GLN A 14 2.612 21.498 26.369 1.00 0.00 O ATOM 229 NE2 GLN A 14 4.746 21.344 25.889 1.00 0.00 N ATOM 0 H GLN A 14 6.044 22.387 21.694 1.00 0.00 H new ATOM 0 HA GLN A 14 4.869 24.622 23.111 1.00 0.00 H new ATOM 0 HB2 GLN A 14 3.753 22.472 22.430 1.00 0.00 H new ATOM 0 HB3 GLN A 14 4.798 21.584 23.521 1.00 0.00 H new ATOM 0 HG2 GLN A 14 3.525 23.859 24.891 1.00 0.00 H new ATOM 0 HG3 GLN A 14 2.323 22.804 24.175 1.00 0.00 H new ATOM 0 HE21 GLN A 14 5.535 21.625 25.307 1.00 0.00 H new ATOM 0 HE22 GLN A 14 4.884 20.676 26.647 1.00 0.00 H new ATOM 238 N SER A 15 7.205 22.922 24.645 1.00 0.00 N ATOM 239 CA SER A 15 8.111 22.981 25.818 1.00 0.00 C ATOM 240 C SER A 15 8.957 24.240 25.712 1.00 0.00 C ATOM 241 O SER A 15 9.384 24.827 26.709 1.00 0.00 O ATOM 242 CB SER A 15 8.986 21.732 25.721 1.00 0.00 C ATOM 243 OG SER A 15 10.245 21.994 26.324 1.00 0.00 O ATOM 0 H SER A 15 7.427 22.193 23.967 1.00 0.00 H new ATOM 0 HA SER A 15 7.578 23.011 26.768 1.00 0.00 H new ATOM 0 HB2 SER A 15 8.499 20.893 26.218 1.00 0.00 H new ATOM 0 HB3 SER A 15 9.121 21.449 24.677 1.00 0.00 H new ATOM 0 HG SER A 15 10.952 21.925 25.649 1.00 0.00 H new ATOM 249 N VAL A 16 9.202 24.659 24.506 1.00 0.00 N ATOM 250 CA VAL A 16 10.030 25.863 24.289 1.00 0.00 C ATOM 251 C VAL A 16 9.268 27.119 24.600 1.00 0.00 C ATOM 252 O VAL A 16 9.806 28.114 25.084 1.00 0.00 O ATOM 253 CB VAL A 16 10.404 25.829 22.809 1.00 0.00 C ATOM 254 CG1 VAL A 16 11.330 26.981 22.497 1.00 0.00 C ATOM 255 CG2 VAL A 16 11.119 24.530 22.470 1.00 0.00 C ATOM 0 H VAL A 16 8.859 24.212 23.656 1.00 0.00 H new ATOM 0 HA VAL A 16 10.903 25.864 24.942 1.00 0.00 H new ATOM 0 HB VAL A 16 9.490 25.904 22.220 1.00 0.00 H new ATOM 0 HG11 VAL A 16 11.597 26.957 21.441 1.00 0.00 H new ATOM 0 HG12 VAL A 16 10.829 27.922 22.723 1.00 0.00 H new ATOM 0 HG13 VAL A 16 12.233 26.896 23.102 1.00 0.00 H new ATOM 0 HG21 VAL A 16 11.378 24.523 21.411 1.00 0.00 H new ATOM 0 HG22 VAL A 16 12.028 24.448 23.067 1.00 0.00 H new ATOM 0 HG23 VAL A 16 10.464 23.686 22.689 1.00 0.00 H new ATOM 265 N LEU A 17 8.041 27.090 24.310 1.00 0.00 N ATOM 266 CA LEU A 17 7.188 28.255 24.542 1.00 0.00 C ATOM 267 C LEU A 17 6.591 28.173 25.935 1.00 0.00 C ATOM 268 O LEU A 17 6.315 29.175 26.591 1.00 0.00 O ATOM 269 CB LEU A 17 6.122 28.083 23.483 1.00 0.00 C ATOM 270 CG LEU A 17 6.738 27.923 22.077 1.00 0.00 C ATOM 271 CD1 LEU A 17 5.836 28.606 21.070 1.00 0.00 C ATOM 272 CD2 LEU A 17 8.140 28.548 21.975 1.00 0.00 C ATOM 0 H LEU A 17 7.564 26.284 23.906 1.00 0.00 H new ATOM 0 HA LEU A 17 7.701 29.215 24.483 1.00 0.00 H new ATOM 0 HB2 LEU A 17 5.514 27.209 23.716 1.00 0.00 H new ATOM 0 HB3 LEU A 17 5.456 28.946 23.493 1.00 0.00 H new ATOM 0 HG LEU A 17 6.831 26.855 21.877 1.00 0.00 H new ATOM 0 HD11 LEU A 17 6.260 28.500 20.071 1.00 0.00 H new ATOM 0 HD12 LEU A 17 4.848 28.146 21.095 1.00 0.00 H new ATOM 0 HD13 LEU A 17 5.750 29.664 21.318 1.00 0.00 H new ATOM 0 HD21 LEU A 17 8.528 28.408 20.966 1.00 0.00 H new ATOM 0 HD22 LEU A 17 8.080 29.614 22.196 1.00 0.00 H new ATOM 0 HD23 LEU A 17 8.806 28.066 22.690 1.00 0.00 H new ATOM 284 N ALA A 18 6.389 26.978 26.379 1.00 0.00 N ATOM 285 CA ALA A 18 5.802 26.761 27.731 1.00 0.00 C ATOM 286 C ALA A 18 6.838 26.995 28.826 1.00 0.00 C ATOM 287 O ALA A 18 6.476 27.271 29.957 1.00 0.00 O ATOM 288 CB ALA A 18 5.348 25.302 27.760 1.00 0.00 C ATOM 0 H ALA A 18 6.606 26.125 25.863 1.00 0.00 H new ATOM 0 HA ALA A 18 4.981 27.455 27.912 1.00 0.00 H new ATOM 0 HB1 ALA A 18 4.906 25.078 28.731 1.00 0.00 H new ATOM 0 HB2 ALA A 18 4.608 25.136 26.977 1.00 0.00 H new ATOM 0 HB3 ALA A 18 6.206 24.651 27.593 1.00 0.00 H new ATOM 294 N ARG A 19 8.112 26.857 28.513 1.00 0.00 N ATOM 295 CA ARG A 19 9.211 27.035 29.532 1.00 0.00 C ATOM 296 C ARG A 19 9.377 25.737 30.305 1.00 0.00 C ATOM 297 O ARG A 19 9.660 25.728 31.499 1.00 0.00 O ATOM 298 CB ARG A 19 8.844 28.225 30.458 1.00 0.00 C ATOM 299 CG ARG A 19 7.945 27.792 31.633 1.00 0.00 C ATOM 300 CD ARG A 19 8.699 27.979 32.955 1.00 0.00 C ATOM 301 NE ARG A 19 7.749 28.712 33.846 1.00 0.00 N ATOM 302 CZ ARG A 19 8.064 28.963 35.095 1.00 0.00 C ATOM 303 NH1 ARG A 19 9.214 28.576 35.585 1.00 0.00 N ATOM 304 NH2 ARG A 19 7.221 29.605 35.857 1.00 0.00 N ATOM 0 H ARG A 19 8.443 26.624 27.577 1.00 0.00 H new ATOM 0 HA ARG A 19 10.163 27.263 29.053 1.00 0.00 H new ATOM 0 HB2 ARG A 19 9.757 28.675 30.848 1.00 0.00 H new ATOM 0 HB3 ARG A 19 8.334 28.992 29.876 1.00 0.00 H new ATOM 0 HG2 ARG A 19 7.028 28.382 31.639 1.00 0.00 H new ATOM 0 HG3 ARG A 19 7.652 26.749 31.514 1.00 0.00 H new ATOM 0 HD2 ARG A 19 8.982 27.019 33.386 1.00 0.00 H new ATOM 0 HD3 ARG A 19 9.618 28.546 32.808 1.00 0.00 H new ATOM 0 HE ARG A 19 6.848 29.020 33.480 1.00 0.00 H new ATOM 0 HH11 ARG A 19 9.877 28.073 34.995 1.00 0.00 H new ATOM 0 HH12 ARG A 19 9.448 28.777 36.557 1.00 0.00 H new ATOM 0 HH21 ARG A 19 6.323 29.909 35.481 1.00 0.00 H new ATOM 0 HH22 ARG A 19 7.460 29.803 36.829 1.00 0.00 H new ATOM 318 N ASP A 20 9.214 24.638 29.626 1.00 0.00 N ATOM 319 CA ASP A 20 9.362 23.319 30.288 1.00 0.00 C ATOM 320 C ASP A 20 10.832 23.076 30.659 1.00 0.00 C ATOM 321 O ASP A 20 11.668 22.858 29.785 1.00 0.00 O ATOM 322 CB ASP A 20 8.895 22.302 29.247 1.00 0.00 C ATOM 323 CG ASP A 20 8.881 20.905 29.869 1.00 0.00 C ATOM 324 OD1 ASP A 20 8.501 20.796 31.023 1.00 0.00 O ATOM 325 OD2 ASP A 20 9.251 19.967 29.181 1.00 0.00 O ATOM 0 H ASP A 20 8.983 24.599 28.633 1.00 0.00 H new ATOM 0 HA ASP A 20 8.787 23.251 31.211 1.00 0.00 H new ATOM 0 HB2 ASP A 20 7.899 22.563 28.890 1.00 0.00 H new ATOM 0 HB3 ASP A 20 9.558 22.320 28.382 1.00 0.00 H new ATOM 330 N PRO A 21 11.107 23.103 31.940 1.00 0.00 N ATOM 331 CA PRO A 21 12.487 22.864 32.437 1.00 0.00 C ATOM 332 C PRO A 21 12.828 21.373 32.328 1.00 0.00 C ATOM 333 O PRO A 21 13.863 20.918 32.811 1.00 0.00 O ATOM 334 CB PRO A 21 12.428 23.294 33.899 1.00 0.00 C ATOM 335 CG PRO A 21 10.994 23.142 34.290 1.00 0.00 C ATOM 336 CD PRO A 21 10.168 23.350 33.048 1.00 0.00 C ATOM 0 HA PRO A 21 13.247 23.404 31.873 1.00 0.00 H new ATOM 0 HB2 PRO A 21 13.074 22.673 34.519 1.00 0.00 H new ATOM 0 HB3 PRO A 21 12.763 24.324 34.021 1.00 0.00 H new ATOM 0 HG2 PRO A 21 10.813 22.153 34.711 1.00 0.00 H new ATOM 0 HG3 PRO A 21 10.725 23.869 35.057 1.00 0.00 H new ATOM 0 HD2 PRO A 21 9.322 22.663 33.013 1.00 0.00 H new ATOM 0 HD3 PRO A 21 9.760 24.360 33.006 1.00 0.00 H new ATOM 344 N ASN A 22 11.960 20.604 31.727 1.00 0.00 N ATOM 345 CA ASN A 22 12.182 19.155 31.603 1.00 0.00 C ATOM 346 C ASN A 22 12.663 18.842 30.206 1.00 0.00 C ATOM 347 O ASN A 22 13.165 17.756 29.918 1.00 0.00 O ATOM 348 CB ASN A 22 10.782 18.626 31.807 1.00 0.00 C ATOM 349 CG ASN A 22 10.741 17.143 31.491 1.00 0.00 C ATOM 350 OD1 ASN A 22 10.728 16.300 32.385 1.00 0.00 O ATOM 351 ND2 ASN A 22 10.723 16.788 30.244 1.00 0.00 N ATOM 0 H ASN A 22 11.090 20.938 31.311 1.00 0.00 H new ATOM 0 HA ASN A 22 12.920 18.739 32.289 1.00 0.00 H new ATOM 0 HB2 ASN A 22 10.465 18.797 32.836 1.00 0.00 H new ATOM 0 HB3 ASN A 22 10.084 19.163 31.165 1.00 0.00 H new ATOM 0 HD21 ASN A 22 10.698 15.799 29.996 1.00 0.00 H new ATOM 0 HD22 ASN A 22 10.734 17.498 29.511 1.00 0.00 H new ATOM 358 N ALA A 23 12.567 19.801 29.351 1.00 0.00 N ATOM 359 CA ALA A 23 13.069 19.609 27.976 1.00 0.00 C ATOM 360 C ALA A 23 14.305 20.468 27.793 1.00 0.00 C ATOM 361 O ALA A 23 14.995 20.416 26.772 1.00 0.00 O ATOM 362 CB ALA A 23 11.970 20.097 27.051 1.00 0.00 C ATOM 0 H ALA A 23 12.160 20.717 29.543 1.00 0.00 H new ATOM 0 HA ALA A 23 13.324 18.569 27.771 1.00 0.00 H new ATOM 0 HB1 ALA A 23 12.287 19.979 26.015 1.00 0.00 H new ATOM 0 HB2 ALA A 23 11.065 19.514 27.222 1.00 0.00 H new ATOM 0 HB3 ALA A 23 11.767 21.149 27.250 1.00 0.00 H new ATOM 368 N ASP A 24 14.593 21.256 28.784 1.00 0.00 N ATOM 369 CA ASP A 24 15.769 22.130 28.727 1.00 0.00 C ATOM 370 C ASP A 24 16.966 21.243 29.013 1.00 0.00 C ATOM 371 O ASP A 24 16.962 20.527 29.982 1.00 0.00 O ATOM 372 CB ASP A 24 15.504 23.142 29.850 1.00 0.00 C ATOM 373 CG ASP A 24 16.320 24.406 29.632 1.00 0.00 C ATOM 374 OD1 ASP A 24 16.944 24.500 28.599 1.00 0.00 O ATOM 375 OD2 ASP A 24 16.292 25.266 30.496 1.00 0.00 O ATOM 0 H ASP A 24 14.047 21.326 29.643 1.00 0.00 H new ATOM 0 HA ASP A 24 15.952 22.643 27.783 1.00 0.00 H new ATOM 0 HB2 ASP A 24 14.443 23.388 29.882 1.00 0.00 H new ATOM 0 HB3 ASP A 24 15.758 22.700 30.813 1.00 0.00 H new ATOM 380 N GLY A 25 17.954 21.223 28.169 1.00 0.00 N ATOM 381 CA GLY A 25 19.118 20.290 28.399 1.00 0.00 C ATOM 382 C GLY A 25 18.903 19.090 27.470 1.00 0.00 C ATOM 383 O GLY A 25 19.846 18.449 27.013 1.00 0.00 O ATOM 0 H GLY A 25 18.019 21.802 27.332 1.00 0.00 H new ATOM 0 HA2 GLY A 25 20.063 20.787 28.179 1.00 0.00 H new ATOM 0 HA3 GLY A 25 19.160 19.972 29.441 1.00 0.00 H new ATOM 387 N GLU A 26 17.656 18.801 27.168 1.00 0.00 N ATOM 388 CA GLU A 26 17.329 17.684 26.257 1.00 0.00 C ATOM 389 C GLU A 26 17.396 18.177 24.809 1.00 0.00 C ATOM 390 O GLU A 26 17.921 17.499 23.930 1.00 0.00 O ATOM 391 CB GLU A 26 15.903 17.274 26.625 1.00 0.00 C ATOM 392 CG GLU A 26 15.634 15.853 26.125 1.00 0.00 C ATOM 393 CD GLU A 26 15.448 15.871 24.608 1.00 0.00 C ATOM 394 OE1 GLU A 26 14.760 16.756 24.126 1.00 0.00 O ATOM 395 OE2 GLU A 26 16.000 15.003 23.953 1.00 0.00 O ATOM 0 H GLU A 26 16.847 19.308 27.527 1.00 0.00 H new ATOM 0 HA GLU A 26 18.020 16.846 26.349 1.00 0.00 H new ATOM 0 HB2 GLU A 26 15.767 17.322 27.705 1.00 0.00 H new ATOM 0 HB3 GLU A 26 15.188 17.968 26.182 1.00 0.00 H new ATOM 0 HG2 GLU A 26 16.464 15.199 26.392 1.00 0.00 H new ATOM 0 HG3 GLU A 26 14.743 15.450 26.606 1.00 0.00 H new ATOM 402 N PHE A 27 16.892 19.362 24.549 1.00 0.00 N ATOM 403 CA PHE A 27 16.958 19.915 23.160 1.00 0.00 C ATOM 404 C PHE A 27 17.016 21.430 23.188 1.00 0.00 C ATOM 405 O PHE A 27 16.799 22.078 24.211 1.00 0.00 O ATOM 406 CB PHE A 27 15.695 19.464 22.408 1.00 0.00 C ATOM 407 CG PHE A 27 14.465 20.279 22.804 1.00 0.00 C ATOM 408 CD1 PHE A 27 14.292 21.601 22.346 1.00 0.00 C ATOM 409 CD2 PHE A 27 13.485 19.695 23.611 1.00 0.00 C ATOM 410 CE1 PHE A 27 13.140 22.320 22.709 1.00 0.00 C ATOM 411 CE2 PHE A 27 12.332 20.415 23.967 1.00 0.00 C ATOM 412 CZ PHE A 27 12.162 21.724 23.518 1.00 0.00 C ATOM 0 H PHE A 27 16.440 19.966 25.236 1.00 0.00 H new ATOM 0 HA PHE A 27 17.857 19.550 22.663 1.00 0.00 H new ATOM 0 HB2 PHE A 27 15.861 19.558 21.335 1.00 0.00 H new ATOM 0 HB3 PHE A 27 15.511 18.409 22.611 1.00 0.00 H new ATOM 0 HD1 PHE A 27 15.042 22.060 21.719 1.00 0.00 H new ATOM 0 HD2 PHE A 27 13.615 18.683 23.964 1.00 0.00 H new ATOM 0 HE1 PHE A 27 13.008 23.335 22.364 1.00 0.00 H new ATOM 0 HE2 PHE A 27 11.578 19.955 24.588 1.00 0.00 H new ATOM 0 HZ PHE A 27 11.277 22.279 23.793 1.00 0.00 H new ATOM 422 N VAL A 28 17.270 21.990 22.058 1.00 0.00 N ATOM 423 CA VAL A 28 17.318 23.463 21.926 1.00 0.00 C ATOM 424 C VAL A 28 16.449 23.836 20.762 1.00 0.00 C ATOM 425 O VAL A 28 15.964 22.975 20.033 1.00 0.00 O ATOM 426 CB VAL A 28 18.766 23.851 21.624 1.00 0.00 C ATOM 427 CG1 VAL A 28 19.681 22.689 21.930 1.00 0.00 C ATOM 428 CG2 VAL A 28 18.932 24.194 20.153 1.00 0.00 C ATOM 0 H VAL A 28 17.452 21.480 21.194 1.00 0.00 H new ATOM 0 HA VAL A 28 16.976 23.967 22.830 1.00 0.00 H new ATOM 0 HB VAL A 28 19.017 24.715 22.239 1.00 0.00 H new ATOM 0 HG11 VAL A 28 20.711 22.970 21.713 1.00 0.00 H new ATOM 0 HG12 VAL A 28 19.591 22.423 22.983 1.00 0.00 H new ATOM 0 HG13 VAL A 28 19.401 21.834 21.315 1.00 0.00 H new ATOM 0 HG21 VAL A 28 19.969 24.467 19.958 1.00 0.00 H new ATOM 0 HG22 VAL A 28 18.664 23.330 19.545 1.00 0.00 H new ATOM 0 HG23 VAL A 28 18.282 25.031 19.899 1.00 0.00 H new ATOM 438 N PHE A 29 16.291 25.085 20.531 1.00 0.00 N ATOM 439 CA PHE A 29 15.501 25.480 19.360 1.00 0.00 C ATOM 440 C PHE A 29 16.184 26.636 18.667 1.00 0.00 C ATOM 441 O PHE A 29 16.484 27.664 19.262 1.00 0.00 O ATOM 442 CB PHE A 29 14.092 25.766 19.859 1.00 0.00 C ATOM 443 CG PHE A 29 13.824 27.248 20.098 1.00 0.00 C ATOM 444 CD1 PHE A 29 13.422 28.075 19.038 1.00 0.00 C ATOM 445 CD2 PHE A 29 13.892 27.773 21.398 1.00 0.00 C ATOM 446 CE1 PHE A 29 13.103 29.423 19.279 1.00 0.00 C ATOM 447 CE2 PHE A 29 13.562 29.116 21.634 1.00 0.00 C ATOM 448 CZ PHE A 29 13.170 29.937 20.578 1.00 0.00 C ATOM 0 H PHE A 29 16.669 25.847 21.094 1.00 0.00 H new ATOM 0 HA PHE A 29 15.427 24.702 18.600 1.00 0.00 H new ATOM 0 HB2 PHE A 29 13.373 25.387 19.133 1.00 0.00 H new ATOM 0 HB3 PHE A 29 13.925 25.220 20.787 1.00 0.00 H new ATOM 0 HD1 PHE A 29 13.358 27.676 18.037 1.00 0.00 H new ATOM 0 HD2 PHE A 29 14.199 27.142 22.219 1.00 0.00 H new ATOM 0 HE1 PHE A 29 12.806 30.062 18.460 1.00 0.00 H new ATOM 0 HE2 PHE A 29 13.612 29.515 22.636 1.00 0.00 H new ATOM 0 HZ PHE A 29 12.918 30.971 20.763 1.00 0.00 H new ATOM 458 N ALA A 30 16.492 26.428 17.429 1.00 0.00 N ATOM 459 CA ALA A 30 17.252 27.449 16.653 1.00 0.00 C ATOM 460 C ALA A 30 16.371 28.301 15.750 1.00 0.00 C ATOM 461 O ALA A 30 15.814 27.832 14.760 1.00 0.00 O ATOM 462 CB ALA A 30 18.228 26.638 15.805 1.00 0.00 C ATOM 0 H ALA A 30 16.250 25.585 16.908 1.00 0.00 H new ATOM 0 HA ALA A 30 17.735 28.155 17.329 1.00 0.00 H new ATOM 0 HB1 ALA A 30 18.831 27.313 15.198 1.00 0.00 H new ATOM 0 HB2 ALA A 30 18.879 26.056 16.457 1.00 0.00 H new ATOM 0 HB3 ALA A 30 17.671 25.965 15.153 1.00 0.00 H new ATOM 468 N VAL A 31 16.289 29.559 16.053 1.00 0.00 N ATOM 469 CA VAL A 31 15.507 30.490 15.209 1.00 0.00 C ATOM 470 C VAL A 31 16.447 31.002 14.106 1.00 0.00 C ATOM 471 O VAL A 31 17.332 31.829 14.354 1.00 0.00 O ATOM 472 CB VAL A 31 15.096 31.629 16.141 1.00 0.00 C ATOM 473 CG1 VAL A 31 13.898 32.361 15.554 1.00 0.00 C ATOM 474 CG2 VAL A 31 14.715 31.073 17.503 1.00 0.00 C ATOM 0 H VAL A 31 16.738 29.988 16.862 1.00 0.00 H new ATOM 0 HA VAL A 31 14.631 30.038 14.744 1.00 0.00 H new ATOM 0 HB VAL A 31 15.935 32.316 16.249 1.00 0.00 H new ATOM 0 HG11 VAL A 31 13.606 33.173 16.220 1.00 0.00 H new ATOM 0 HG12 VAL A 31 14.163 32.769 14.579 1.00 0.00 H new ATOM 0 HG13 VAL A 31 13.066 31.666 15.443 1.00 0.00 H new ATOM 0 HG21 VAL A 31 14.423 31.891 18.161 1.00 0.00 H new ATOM 0 HG22 VAL A 31 13.880 30.381 17.393 1.00 0.00 H new ATOM 0 HG23 VAL A 31 15.568 30.548 17.933 1.00 0.00 H new ATOM 484 N ARG A 32 16.291 30.500 12.911 1.00 0.00 N ATOM 485 CA ARG A 32 17.169 30.912 11.776 1.00 0.00 C ATOM 486 C ARG A 32 16.967 32.382 11.433 1.00 0.00 C ATOM 487 O ARG A 32 17.807 33.026 10.807 1.00 0.00 O ATOM 488 CB ARG A 32 16.640 30.097 10.616 1.00 0.00 C ATOM 489 CG ARG A 32 17.200 28.675 10.663 1.00 0.00 C ATOM 490 CD ARG A 32 17.075 28.021 9.284 1.00 0.00 C ATOM 491 NE ARG A 32 15.612 28.025 8.984 1.00 0.00 N ATOM 492 CZ ARG A 32 15.079 28.947 8.215 1.00 0.00 C ATOM 493 NH1 ARG A 32 15.813 29.894 7.685 1.00 0.00 N ATOM 494 NH2 ARG A 32 13.797 28.919 7.974 1.00 0.00 N ATOM 0 H ARG A 32 15.580 29.810 12.669 1.00 0.00 H new ATOM 0 HA ARG A 32 18.224 30.763 12.004 1.00 0.00 H new ATOM 0 HB2 ARG A 32 15.551 30.067 10.651 1.00 0.00 H new ATOM 0 HB3 ARG A 32 16.915 30.572 9.674 1.00 0.00 H new ATOM 0 HG2 ARG A 32 18.245 28.696 10.972 1.00 0.00 H new ATOM 0 HG3 ARG A 32 16.660 28.086 11.405 1.00 0.00 H new ATOM 0 HD2 ARG A 32 17.633 28.578 8.531 1.00 0.00 H new ATOM 0 HD3 ARG A 32 17.473 27.006 9.291 1.00 0.00 H new ATOM 0 HE ARG A 32 15.016 27.299 9.383 1.00 0.00 H new ATOM 0 HH11 ARG A 32 16.816 29.924 7.867 1.00 0.00 H new ATOM 0 HH12 ARG A 32 15.381 30.601 7.090 1.00 0.00 H new ATOM 0 HH21 ARG A 32 13.217 28.185 8.382 1.00 0.00 H new ATOM 0 HH22 ARG A 32 13.374 29.631 7.378 1.00 0.00 H new ATOM 508 N THR A 33 15.860 32.911 11.838 1.00 0.00 N ATOM 509 CA THR A 33 15.554 34.345 11.560 1.00 0.00 C ATOM 510 C THR A 33 16.580 35.219 12.266 1.00 0.00 C ATOM 511 O THR A 33 16.921 36.312 11.818 1.00 0.00 O ATOM 512 CB THR A 33 14.151 34.571 12.137 1.00 0.00 C ATOM 513 OG1 THR A 33 13.575 35.722 11.536 1.00 0.00 O ATOM 514 CG2 THR A 33 14.221 34.778 13.654 1.00 0.00 C ATOM 0 H THR A 33 15.138 32.412 12.358 1.00 0.00 H new ATOM 0 HA THR A 33 15.591 34.592 10.499 1.00 0.00 H new ATOM 0 HB THR A 33 13.540 33.693 11.927 1.00 0.00 H new ATOM 0 HG1 THR A 33 12.678 35.868 11.902 1.00 0.00 H new ATOM 0 HG21 THR A 33 13.217 34.937 14.046 1.00 0.00 H new ATOM 0 HG22 THR A 33 14.658 33.896 14.122 1.00 0.00 H new ATOM 0 HG23 THR A 33 14.838 35.649 13.874 1.00 0.00 H new ATOM 522 N THR A 34 17.078 34.740 13.365 1.00 0.00 N ATOM 523 CA THR A 34 18.098 35.521 14.128 1.00 0.00 C ATOM 524 C THR A 34 19.391 34.712 14.262 1.00 0.00 C ATOM 525 O THR A 34 20.405 35.209 14.749 1.00 0.00 O ATOM 526 CB THR A 34 17.477 35.764 15.506 1.00 0.00 C ATOM 527 OG1 THR A 34 18.317 36.633 16.253 1.00 0.00 O ATOM 528 CG2 THR A 34 17.331 34.435 16.245 1.00 0.00 C ATOM 0 H THR A 34 16.826 33.840 13.774 1.00 0.00 H new ATOM 0 HA THR A 34 18.353 36.456 13.628 1.00 0.00 H new ATOM 0 HB THR A 34 16.494 36.219 15.387 1.00 0.00 H new ATOM 0 HG1 THR A 34 19.253 36.474 16.008 1.00 0.00 H new ATOM 0 HG21 THR A 34 16.889 34.611 17.226 1.00 0.00 H new ATOM 0 HG22 THR A 34 16.688 33.768 15.671 1.00 0.00 H new ATOM 0 HG23 THR A 34 18.312 33.977 16.366 1.00 0.00 H new ATOM 536 N GLY A 35 19.374 33.474 13.849 1.00 0.00 N ATOM 537 CA GLY A 35 20.592 32.637 13.960 1.00 0.00 C ATOM 538 C GLY A 35 20.844 32.303 15.430 1.00 0.00 C ATOM 539 O GLY A 35 21.981 32.081 15.842 1.00 0.00 O ATOM 0 H GLY A 35 18.564 33.009 13.439 1.00 0.00 H new ATOM 0 HA2 GLY A 35 20.471 31.720 13.383 1.00 0.00 H new ATOM 0 HA3 GLY A 35 21.449 33.165 13.543 1.00 0.00 H new ATOM 543 N ILE A 36 19.809 32.243 16.231 1.00 0.00 N ATOM 544 CA ILE A 36 20.018 31.900 17.674 1.00 0.00 C ATOM 545 C ILE A 36 19.327 30.582 17.975 1.00 0.00 C ATOM 546 O ILE A 36 18.439 30.147 17.252 1.00 0.00 O ATOM 547 CB ILE A 36 19.318 32.988 18.511 1.00 0.00 C ATOM 548 CG1 ILE A 36 20.047 34.321 18.399 1.00 0.00 C ATOM 549 CG2 ILE A 36 19.303 32.583 20.003 1.00 0.00 C ATOM 550 CD1 ILE A 36 19.260 35.361 19.204 1.00 0.00 C ATOM 0 H ILE A 36 18.842 32.414 15.955 1.00 0.00 H new ATOM 0 HA ILE A 36 21.082 31.832 17.899 1.00 0.00 H new ATOM 0 HB ILE A 36 18.303 33.090 18.128 1.00 0.00 H new ATOM 0 HG12 ILE A 36 21.064 34.233 18.782 1.00 0.00 H new ATOM 0 HG13 ILE A 36 20.125 34.626 17.355 1.00 0.00 H new ATOM 0 HG21 ILE A 36 18.806 33.359 20.586 1.00 0.00 H new ATOM 0 HG22 ILE A 36 18.766 31.642 20.119 1.00 0.00 H new ATOM 0 HG23 ILE A 36 20.327 32.463 20.358 1.00 0.00 H new ATOM 0 HD11 ILE A 36 19.762 36.326 19.140 1.00 0.00 H new ATOM 0 HD12 ILE A 36 18.252 35.448 18.798 1.00 0.00 H new ATOM 0 HD13 ILE A 36 19.206 35.049 20.247 1.00 0.00 H new ATOM 562 N PHE A 37 19.664 29.989 19.070 1.00 0.00 N ATOM 563 CA PHE A 37 18.974 28.751 19.490 1.00 0.00 C ATOM 564 C PHE A 37 18.928 28.757 21.002 1.00 0.00 C ATOM 565 O PHE A 37 19.954 28.832 21.676 1.00 0.00 O ATOM 566 CB PHE A 37 19.749 27.559 18.921 1.00 0.00 C ATOM 567 CG PHE A 37 20.910 27.185 19.796 1.00 0.00 C ATOM 568 CD1 PHE A 37 20.682 26.453 20.963 1.00 0.00 C ATOM 569 CD2 PHE A 37 22.210 27.531 19.427 1.00 0.00 C ATOM 570 CE1 PHE A 37 21.750 26.063 21.762 1.00 0.00 C ATOM 571 CE2 PHE A 37 23.282 27.148 20.232 1.00 0.00 C ATOM 572 CZ PHE A 37 23.050 26.408 21.400 1.00 0.00 C ATOM 0 H PHE A 37 20.397 30.311 19.702 1.00 0.00 H new ATOM 0 HA PHE A 37 17.952 28.683 19.117 1.00 0.00 H new ATOM 0 HB2 PHE A 37 19.080 26.705 18.819 1.00 0.00 H new ATOM 0 HB3 PHE A 37 20.110 27.803 17.922 1.00 0.00 H new ATOM 0 HD1 PHE A 37 19.673 26.189 21.245 1.00 0.00 H new ATOM 0 HD2 PHE A 37 22.385 28.093 18.522 1.00 0.00 H new ATOM 0 HE1 PHE A 37 21.572 25.493 22.662 1.00 0.00 H new ATOM 0 HE2 PHE A 37 24.290 27.421 19.956 1.00 0.00 H new ATOM 0 HZ PHE A 37 23.881 26.105 22.020 1.00 0.00 H new ATOM 596 N ARG A 39 17.057 27.544 24.895 1.00 0.00 N ATOM 597 CA ARG A 39 16.556 26.392 25.615 1.00 0.00 C ATOM 598 C ARG A 39 15.040 26.464 25.487 1.00 0.00 C ATOM 599 O ARG A 39 14.510 27.511 25.116 1.00 0.00 O ATOM 600 CB ARG A 39 17.024 26.673 27.032 1.00 0.00 C ATOM 601 CG ARG A 39 18.422 26.074 27.245 1.00 0.00 C ATOM 602 CD ARG A 39 18.919 26.388 28.665 1.00 0.00 C ATOM 603 NE ARG A 39 18.523 27.807 28.915 1.00 0.00 N ATOM 604 CZ ARG A 39 18.091 28.190 30.093 1.00 0.00 C ATOM 605 NH1 ARG A 39 17.995 27.344 31.087 1.00 0.00 N ATOM 606 NH2 ARG A 39 17.754 29.437 30.279 1.00 0.00 N ATOM 0 HA ARG A 39 16.883 25.408 25.278 1.00 0.00 H new ATOM 0 HB2 ARG A 39 17.048 27.748 27.211 1.00 0.00 H new ATOM 0 HB3 ARG A 39 16.322 26.246 27.748 1.00 0.00 H new ATOM 0 HG2 ARG A 39 18.391 24.995 27.092 1.00 0.00 H new ATOM 0 HG3 ARG A 39 19.116 26.481 26.510 1.00 0.00 H new ATOM 0 HD2 ARG A 39 18.467 25.719 29.397 1.00 0.00 H new ATOM 0 HD3 ARG A 39 19.999 26.262 28.741 1.00 0.00 H new ATOM 0 HE ARG A 39 18.590 28.488 28.158 1.00 0.00 H new ATOM 0 HH11 ARG A 39 18.258 26.368 30.953 1.00 0.00 H new ATOM 0 HH12 ARG A 39 17.657 27.661 31.996 1.00 0.00 H new ATOM 0 HH21 ARG A 39 17.828 30.105 29.512 1.00 0.00 H new ATOM 0 HH22 ARG A 39 17.417 29.744 31.192 1.00 0.00 H new ATOM 620 N PRO A 40 14.367 25.402 25.774 1.00 0.00 N ATOM 621 CA PRO A 40 12.900 25.423 25.656 1.00 0.00 C ATOM 622 C PRO A 40 12.289 26.409 26.653 1.00 0.00 C ATOM 623 O PRO A 40 11.101 26.718 26.593 1.00 0.00 O ATOM 624 CB PRO A 40 12.493 23.986 25.957 1.00 0.00 C ATOM 625 CG PRO A 40 13.627 23.436 26.755 1.00 0.00 C ATOM 626 CD PRO A 40 14.868 24.111 26.234 1.00 0.00 C ATOM 0 HA PRO A 40 12.552 25.752 24.677 1.00 0.00 H new ATOM 0 HB2 PRO A 40 11.558 23.947 26.516 1.00 0.00 H new ATOM 0 HB3 PRO A 40 12.340 23.417 25.040 1.00 0.00 H new ATOM 0 HG2 PRO A 40 13.490 23.638 27.817 1.00 0.00 H new ATOM 0 HG3 PRO A 40 13.695 22.354 26.642 1.00 0.00 H new ATOM 0 HD2 PRO A 40 15.623 24.224 27.012 1.00 0.00 H new ATOM 0 HD3 PRO A 40 15.327 23.544 25.424 1.00 0.00 H new ATOM 634 N SER A 41 13.051 26.894 27.589 1.00 0.00 N ATOM 635 CA SER A 41 12.479 27.818 28.574 1.00 0.00 C ATOM 636 C SER A 41 13.089 29.237 28.491 1.00 0.00 C ATOM 637 O SER A 41 13.156 29.945 29.495 1.00 0.00 O ATOM 638 CB SER A 41 12.754 27.122 29.903 1.00 0.00 C ATOM 639 OG SER A 41 14.153 27.116 30.155 1.00 0.00 O ATOM 0 H SER A 41 14.042 26.685 27.706 1.00 0.00 H new ATOM 0 HA SER A 41 11.417 28.004 28.413 1.00 0.00 H new ATOM 0 HB2 SER A 41 12.231 27.636 30.710 1.00 0.00 H new ATOM 0 HB3 SER A 41 12.374 26.101 29.876 1.00 0.00 H new ATOM 0 HG SER A 41 14.469 26.191 30.224 1.00 0.00 H new ATOM 645 N CYS A 42 13.514 29.688 27.323 1.00 0.00 N ATOM 646 CA CYS A 42 14.082 31.072 27.221 1.00 0.00 C ATOM 647 C CYS A 42 13.076 32.082 27.764 1.00 0.00 C ATOM 648 O CYS A 42 11.873 31.986 27.536 1.00 0.00 O ATOM 649 CB CYS A 42 14.330 31.357 25.743 1.00 0.00 C ATOM 650 SG CYS A 42 15.157 32.973 25.598 1.00 0.00 S ATOM 0 H CYS A 42 13.490 29.161 26.450 1.00 0.00 H new ATOM 0 HA CYS A 42 15.005 31.150 27.795 1.00 0.00 H new ATOM 0 HB2 CYS A 42 14.949 30.574 25.305 1.00 0.00 H new ATOM 0 HB3 CYS A 42 13.388 31.363 25.195 1.00 0.00 H new ATOM 0 HG CYS A 42 15.380 33.235 24.344 1.00 0.00 H new ATOM 655 N ARG A 43 13.559 33.030 28.490 1.00 0.00 N ATOM 656 CA ARG A 43 12.665 34.063 29.092 1.00 0.00 C ATOM 657 C ARG A 43 12.680 35.390 28.308 1.00 0.00 C ATOM 658 O ARG A 43 12.061 36.362 28.733 1.00 0.00 O ATOM 659 CB ARG A 43 13.235 34.277 30.504 1.00 0.00 C ATOM 660 CG ARG A 43 14.375 35.311 30.475 1.00 0.00 C ATOM 661 CD ARG A 43 15.725 34.632 30.728 1.00 0.00 C ATOM 662 NE ARG A 43 16.241 34.240 29.380 1.00 0.00 N ATOM 663 CZ ARG A 43 16.531 35.144 28.468 1.00 0.00 C ATOM 664 NH1 ARG A 43 16.378 36.422 28.708 1.00 0.00 N ATOM 665 NH2 ARG A 43 16.981 34.759 27.305 1.00 0.00 N ATOM 0 H ARG A 43 14.550 33.145 28.702 1.00 0.00 H new ATOM 0 HA ARG A 43 11.625 33.736 29.085 1.00 0.00 H new ATOM 0 HB2 ARG A 43 12.445 34.617 31.174 1.00 0.00 H new ATOM 0 HB3 ARG A 43 13.604 33.331 30.901 1.00 0.00 H new ATOM 0 HG2 ARG A 43 14.391 35.816 29.509 1.00 0.00 H new ATOM 0 HG3 ARG A 43 14.199 36.076 31.231 1.00 0.00 H new ATOM 0 HD2 ARG A 43 16.416 35.310 31.230 1.00 0.00 H new ATOM 0 HD3 ARG A 43 15.610 33.760 31.372 1.00 0.00 H new ATOM 0 HE ARG A 43 16.371 33.252 29.163 1.00 0.00 H new ATOM 0 HH11 ARG A 43 16.029 36.732 29.615 1.00 0.00 H new ATOM 0 HH12 ARG A 43 16.608 37.107 27.988 1.00 0.00 H new ATOM 0 HH21 ARG A 43 17.105 33.766 27.110 1.00 0.00 H new ATOM 0 HH22 ARG A 43 17.209 35.451 26.592 1.00 0.00 H new ATOM 679 N ALA A 44 13.413 35.496 27.229 1.00 0.00 N ATOM 680 CA ALA A 44 13.474 36.828 26.542 1.00 0.00 C ATOM 681 C ALA A 44 12.327 37.056 25.562 1.00 0.00 C ATOM 682 O ALA A 44 11.658 38.087 25.603 1.00 0.00 O ATOM 683 CB ALA A 44 14.805 36.818 25.797 1.00 0.00 C ATOM 0 H ALA A 44 13.957 34.746 26.802 1.00 0.00 H new ATOM 0 HA ALA A 44 13.387 37.635 27.270 1.00 0.00 H new ATOM 0 HB1 ALA A 44 14.931 37.761 25.264 1.00 0.00 H new ATOM 0 HB2 ALA A 44 15.620 36.692 26.510 1.00 0.00 H new ATOM 0 HB3 ALA A 44 14.817 35.994 25.084 1.00 0.00 H new ATOM 689 N ARG A 45 12.094 36.133 24.684 1.00 0.00 N ATOM 690 CA ARG A 45 10.999 36.301 23.676 1.00 0.00 C ATOM 691 C ARG A 45 11.020 35.069 22.750 1.00 0.00 C ATOM 692 O ARG A 45 11.914 34.231 22.859 1.00 0.00 O ATOM 693 CB ARG A 45 11.357 37.602 22.924 1.00 0.00 C ATOM 694 CG ARG A 45 10.120 38.193 22.230 1.00 0.00 C ATOM 695 CD ARG A 45 9.967 39.672 22.627 1.00 0.00 C ATOM 696 NE ARG A 45 10.690 40.447 21.566 1.00 0.00 N ATOM 697 CZ ARG A 45 10.823 41.743 21.653 1.00 0.00 C ATOM 698 NH1 ARG A 45 10.329 42.402 22.668 1.00 0.00 N ATOM 699 NH2 ARG A 45 11.457 42.384 20.712 1.00 0.00 N ATOM 0 H ARG A 45 12.614 35.258 24.613 1.00 0.00 H new ATOM 0 HA ARG A 45 9.998 36.372 24.101 1.00 0.00 H new ATOM 0 HB2 ARG A 45 11.769 38.329 23.624 1.00 0.00 H new ATOM 0 HB3 ARG A 45 12.131 37.398 22.184 1.00 0.00 H new ATOM 0 HG2 ARG A 45 10.219 38.104 21.148 1.00 0.00 H new ATOM 0 HG3 ARG A 45 9.228 37.635 22.515 1.00 0.00 H new ATOM 0 HD2 ARG A 45 8.917 39.959 22.676 1.00 0.00 H new ATOM 0 HD3 ARG A 45 10.395 39.861 23.612 1.00 0.00 H new ATOM 0 HE ARG A 45 11.084 39.954 20.764 1.00 0.00 H new ATOM 0 HH11 ARG A 45 9.832 41.904 23.406 1.00 0.00 H new ATOM 0 HH12 ARG A 45 10.441 43.414 22.722 1.00 0.00 H new ATOM 0 HH21 ARG A 45 11.843 41.873 19.918 1.00 0.00 H new ATOM 0 HH22 ARG A 45 11.567 43.396 20.769 1.00 0.00 H new ATOM 713 N HIS A 46 10.062 34.908 21.870 1.00 0.00 N ATOM 714 CA HIS A 46 10.069 33.689 20.997 1.00 0.00 C ATOM 715 C HIS A 46 9.661 33.950 19.561 1.00 0.00 C ATOM 716 O HIS A 46 8.933 34.882 19.250 1.00 0.00 O ATOM 717 CB HIS A 46 9.049 32.758 21.607 1.00 0.00 C ATOM 718 CG HIS A 46 9.722 31.876 22.591 1.00 0.00 C ATOM 719 ND1 HIS A 46 10.120 30.608 22.250 1.00 0.00 N ATOM 720 CD2 HIS A 46 10.054 32.041 23.907 1.00 0.00 C ATOM 721 CE1 HIS A 46 10.645 30.050 23.333 1.00 0.00 C ATOM 722 NE2 HIS A 46 10.639 30.876 24.381 1.00 0.00 N ATOM 0 H HIS A 46 9.288 35.554 21.718 1.00 0.00 H new ATOM 0 HA HIS A 46 11.084 33.295 20.956 1.00 0.00 H new ATOM 0 HB2 HIS A 46 8.261 33.332 22.094 1.00 0.00 H new ATOM 0 HB3 HIS A 46 8.574 32.160 20.829 1.00 0.00 H new ATOM 0 HD1 HIS A 46 10.029 30.174 21.332 1.00 0.00 H new ATOM 0 HD2 HIS A 46 9.887 32.937 24.486 1.00 0.00 H new ATOM 0 HE1 HIS A 46 11.033 29.043 23.363 1.00 0.00 H new ATOM 730 N ALA A 47 10.089 33.071 18.699 1.00 0.00 N ATOM 731 CA ALA A 47 9.741 33.155 17.263 1.00 0.00 C ATOM 732 C ALA A 47 8.990 31.892 16.841 1.00 0.00 C ATOM 733 O ALA A 47 9.208 30.810 17.384 1.00 0.00 O ATOM 734 CB ALA A 47 11.077 33.256 16.532 1.00 0.00 C ATOM 0 H ALA A 47 10.682 32.278 18.942 1.00 0.00 H new ATOM 0 HA ALA A 47 9.097 34.005 17.039 1.00 0.00 H new ATOM 0 HB1 ALA A 47 10.900 33.322 15.458 1.00 0.00 H new ATOM 0 HB2 ALA A 47 11.609 34.146 16.868 1.00 0.00 H new ATOM 0 HB3 ALA A 47 11.677 32.372 16.747 1.00 0.00 H new ATOM 740 N LEU A 48 8.099 32.012 15.898 1.00 0.00 N ATOM 741 CA LEU A 48 7.315 30.842 15.444 1.00 0.00 C ATOM 742 C LEU A 48 8.217 29.638 15.145 1.00 0.00 C ATOM 743 O LEU A 48 9.421 29.772 14.933 1.00 0.00 O ATOM 744 CB LEU A 48 6.611 31.311 14.169 1.00 0.00 C ATOM 745 CG LEU A 48 5.460 32.254 14.536 1.00 0.00 C ATOM 746 CD1 LEU A 48 5.413 33.419 13.546 1.00 0.00 C ATOM 747 CD2 LEU A 48 4.137 31.487 14.482 1.00 0.00 C ATOM 0 H LEU A 48 7.881 32.886 15.419 1.00 0.00 H new ATOM 0 HA LEU A 48 6.615 30.510 16.211 1.00 0.00 H new ATOM 0 HB2 LEU A 48 7.320 31.822 13.517 1.00 0.00 H new ATOM 0 HB3 LEU A 48 6.230 30.453 13.615 1.00 0.00 H new ATOM 0 HG LEU A 48 5.618 32.641 15.543 1.00 0.00 H new ATOM 0 HD11 LEU A 48 4.594 34.088 13.810 1.00 0.00 H new ATOM 0 HD12 LEU A 48 6.355 33.967 13.584 1.00 0.00 H new ATOM 0 HD13 LEU A 48 5.257 33.034 12.538 1.00 0.00 H new ATOM 0 HD21 LEU A 48 3.317 32.157 14.743 1.00 0.00 H new ATOM 0 HD22 LEU A 48 3.982 31.099 13.475 1.00 0.00 H new ATOM 0 HD23 LEU A 48 4.168 30.658 15.189 1.00 0.00 H new ATOM 759 N ARG A 49 7.643 28.466 15.105 1.00 0.00 N ATOM 760 CA ARG A 49 8.429 27.232 14.800 1.00 0.00 C ATOM 761 C ARG A 49 9.059 27.374 13.424 1.00 0.00 C ATOM 762 O ARG A 49 10.120 26.835 13.119 1.00 0.00 O ATOM 763 CB ARG A 49 7.367 26.158 14.739 1.00 0.00 C ATOM 764 CG ARG A 49 8.005 24.782 14.945 1.00 0.00 C ATOM 765 CD ARG A 49 6.910 23.734 15.159 1.00 0.00 C ATOM 766 NE ARG A 49 6.637 23.176 13.802 1.00 0.00 N ATOM 767 CZ ARG A 49 7.521 22.418 13.198 1.00 0.00 C ATOM 768 NH1 ARG A 49 8.662 22.133 13.769 1.00 0.00 N ATOM 769 NH2 ARG A 49 7.258 21.942 12.012 1.00 0.00 N ATOM 0 H ARG A 49 6.649 28.308 15.273 1.00 0.00 H new ATOM 0 HA ARG A 49 9.221 27.029 15.521 1.00 0.00 H new ATOM 0 HB2 ARG A 49 6.612 26.337 15.505 1.00 0.00 H new ATOM 0 HB3 ARG A 49 6.858 26.192 13.776 1.00 0.00 H new ATOM 0 HG2 ARG A 49 8.611 24.518 14.078 1.00 0.00 H new ATOM 0 HG3 ARG A 49 8.673 24.805 15.806 1.00 0.00 H new ATOM 0 HD2 ARG A 49 7.239 22.955 15.847 1.00 0.00 H new ATOM 0 HD3 ARG A 49 6.014 24.182 15.589 1.00 0.00 H new ATOM 0 HE ARG A 49 5.753 23.386 13.339 1.00 0.00 H new ATOM 0 HH11 ARG A 49 8.874 22.501 14.696 1.00 0.00 H new ATOM 0 HH12 ARG A 49 9.340 21.542 13.287 1.00 0.00 H new ATOM 0 HH21 ARG A 49 6.370 22.160 11.560 1.00 0.00 H new ATOM 0 HH22 ARG A 49 7.941 21.352 11.536 1.00 0.00 H new ATOM 783 N GLU A 50 8.375 28.100 12.601 1.00 0.00 N ATOM 784 CA GLU A 50 8.797 28.366 11.208 1.00 0.00 C ATOM 785 C GLU A 50 10.304 28.547 11.089 1.00 0.00 C ATOM 786 O GLU A 50 11.000 27.781 10.425 1.00 0.00 O ATOM 787 CB GLU A 50 8.094 29.678 10.930 1.00 0.00 C ATOM 788 CG GLU A 50 8.080 29.936 9.452 1.00 0.00 C ATOM 789 CD GLU A 50 9.425 30.499 8.993 1.00 0.00 C ATOM 790 OE1 GLU A 50 10.291 29.712 8.648 1.00 0.00 O ATOM 791 OE2 GLU A 50 9.565 31.711 8.986 1.00 0.00 O ATOM 0 H GLU A 50 7.492 28.544 12.852 1.00 0.00 H new ATOM 0 HA GLU A 50 8.555 27.554 10.523 1.00 0.00 H new ATOM 0 HB2 GLU A 50 7.074 29.645 11.314 1.00 0.00 H new ATOM 0 HB3 GLU A 50 8.603 30.492 11.447 1.00 0.00 H new ATOM 0 HG2 GLU A 50 7.865 29.011 8.918 1.00 0.00 H new ATOM 0 HG3 GLU A 50 7.283 30.638 9.207 1.00 0.00 H new ATOM 798 N ASN A 51 10.808 29.547 11.735 1.00 0.00 N ATOM 799 CA ASN A 51 12.268 29.811 11.698 1.00 0.00 C ATOM 800 C ASN A 51 12.914 29.146 12.899 1.00 0.00 C ATOM 801 O ASN A 51 14.018 29.475 13.288 1.00 0.00 O ATOM 802 CB ASN A 51 12.395 31.327 11.834 1.00 0.00 C ATOM 803 CG ASN A 51 11.745 32.019 10.637 1.00 0.00 C ATOM 804 OD1 ASN A 51 12.090 31.746 9.490 1.00 0.00 O ATOM 805 ND2 ASN A 51 10.812 32.907 10.848 1.00 0.00 N ATOM 0 H ASN A 51 10.266 30.204 12.296 1.00 0.00 H new ATOM 0 HA ASN A 51 12.743 29.434 10.792 1.00 0.00 H new ATOM 0 HB2 ASN A 51 11.919 31.658 12.757 1.00 0.00 H new ATOM 0 HB3 ASN A 51 13.446 31.607 11.899 1.00 0.00 H new ATOM 0 HD21 ASN A 51 10.367 33.377 10.059 1.00 0.00 H new ATOM 0 HD22 ASN A 51 10.528 33.131 11.802 1.00 0.00 H new ATOM 812 N VAL A 52 12.225 28.232 13.502 1.00 0.00 N ATOM 813 CA VAL A 52 12.764 27.555 14.706 1.00 0.00 C ATOM 814 C VAL A 52 12.958 26.048 14.467 1.00 0.00 C ATOM 815 O VAL A 52 12.073 25.360 13.963 1.00 0.00 O ATOM 816 CB VAL A 52 11.681 27.806 15.759 1.00 0.00 C ATOM 817 CG1 VAL A 52 11.634 26.654 16.755 1.00 0.00 C ATOM 818 CG2 VAL A 52 11.994 29.100 16.512 1.00 0.00 C ATOM 0 H VAL A 52 11.299 27.919 13.210 1.00 0.00 H new ATOM 0 HA VAL A 52 13.746 27.928 14.997 1.00 0.00 H new ATOM 0 HB VAL A 52 10.717 27.887 15.257 1.00 0.00 H new ATOM 0 HG11 VAL A 52 10.860 26.846 17.498 1.00 0.00 H new ATOM 0 HG12 VAL A 52 11.409 25.727 16.228 1.00 0.00 H new ATOM 0 HG13 VAL A 52 12.599 26.564 17.253 1.00 0.00 H new ATOM 0 HG21 VAL A 52 11.224 29.280 17.262 1.00 0.00 H new ATOM 0 HG22 VAL A 52 12.964 29.010 17.002 1.00 0.00 H new ATOM 0 HG23 VAL A 52 12.018 29.933 15.809 1.00 0.00 H new ATOM 828 N SER A 53 14.090 25.526 14.855 1.00 0.00 N ATOM 829 CA SER A 53 14.349 24.069 14.699 1.00 0.00 C ATOM 830 C SER A 53 14.802 23.510 16.042 1.00 0.00 C ATOM 831 O SER A 53 14.944 24.252 17.005 1.00 0.00 O ATOM 832 CB SER A 53 15.462 23.957 13.663 1.00 0.00 C ATOM 833 OG SER A 53 16.456 24.937 13.931 1.00 0.00 O ATOM 0 H SER A 53 14.853 26.054 15.278 1.00 0.00 H new ATOM 0 HA SER A 53 13.467 23.512 14.382 1.00 0.00 H new ATOM 0 HB2 SER A 53 15.901 22.960 13.691 1.00 0.00 H new ATOM 0 HB3 SER A 53 15.057 24.098 12.661 1.00 0.00 H new ATOM 0 HG SER A 53 17.173 24.866 13.267 1.00 0.00 H new ATOM 839 N PHE A 54 14.992 22.226 16.148 1.00 0.00 N ATOM 840 CA PHE A 54 15.386 21.649 17.438 1.00 0.00 C ATOM 841 C PHE A 54 16.698 20.890 17.342 1.00 0.00 C ATOM 842 O PHE A 54 17.056 20.328 16.309 1.00 0.00 O ATOM 843 CB PHE A 54 14.246 20.715 17.763 1.00 0.00 C ATOM 844 CG PHE A 54 12.997 21.539 17.855 1.00 0.00 C ATOM 845 CD1 PHE A 54 12.824 22.411 18.934 1.00 0.00 C ATOM 846 CD2 PHE A 54 12.037 21.470 16.843 1.00 0.00 C ATOM 847 CE1 PHE A 54 11.685 23.211 19.004 1.00 0.00 C ATOM 848 CE2 PHE A 54 10.901 22.278 16.909 1.00 0.00 C ATOM 849 CZ PHE A 54 10.727 23.146 17.990 1.00 0.00 C ATOM 0 H PHE A 54 14.888 21.556 15.386 1.00 0.00 H new ATOM 0 HA PHE A 54 15.554 22.410 18.201 1.00 0.00 H new ATOM 0 HB2 PHE A 54 14.145 19.951 16.992 1.00 0.00 H new ATOM 0 HB3 PHE A 54 14.432 20.196 18.703 1.00 0.00 H new ATOM 0 HD1 PHE A 54 13.571 22.465 19.712 1.00 0.00 H new ATOM 0 HD2 PHE A 54 12.173 20.794 16.012 1.00 0.00 H new ATOM 0 HE1 PHE A 54 11.544 23.880 19.840 1.00 0.00 H new ATOM 0 HE2 PHE A 54 10.158 22.232 16.126 1.00 0.00 H new ATOM 0 HZ PHE A 54 9.847 23.770 18.042 1.00 0.00 H new ATOM 859 N TYR A 55 17.410 20.871 18.420 1.00 0.00 N ATOM 860 CA TYR A 55 18.712 20.158 18.462 1.00 0.00 C ATOM 861 C TYR A 55 18.772 19.280 19.701 1.00 0.00 C ATOM 862 O TYR A 55 18.124 19.566 20.702 1.00 0.00 O ATOM 863 CB TYR A 55 19.760 21.263 18.570 1.00 0.00 C ATOM 864 CG TYR A 55 19.910 21.942 17.235 1.00 0.00 C ATOM 865 CD1 TYR A 55 20.136 21.170 16.098 1.00 0.00 C ATOM 866 CD2 TYR A 55 19.825 23.334 17.133 1.00 0.00 C ATOM 867 CE1 TYR A 55 20.278 21.782 14.851 1.00 0.00 C ATOM 868 CE2 TYR A 55 19.966 23.950 15.887 1.00 0.00 C ATOM 869 CZ TYR A 55 20.193 23.175 14.743 1.00 0.00 C ATOM 870 OH TYR A 55 20.331 23.783 13.510 1.00 0.00 O ATOM 0 H TYR A 55 17.144 21.327 19.293 1.00 0.00 H new ATOM 0 HA TYR A 55 18.865 19.522 17.590 1.00 0.00 H new ATOM 0 HB2 TYR A 55 19.463 21.988 19.328 1.00 0.00 H new ATOM 0 HB3 TYR A 55 20.715 20.844 18.887 1.00 0.00 H new ATOM 0 HD1 TYR A 55 20.202 20.095 16.181 1.00 0.00 H new ATOM 0 HD2 TYR A 55 19.651 23.932 18.016 1.00 0.00 H new ATOM 0 HE1 TYR A 55 20.453 21.181 13.971 1.00 0.00 H new ATOM 0 HE2 TYR A 55 19.900 25.025 15.806 1.00 0.00 H new ATOM 0 HH TYR A 55 20.244 24.754 13.612 1.00 0.00 H new ATOM 880 N ALA A 56 19.556 18.242 19.677 1.00 0.00 N ATOM 881 CA ALA A 56 19.667 17.389 20.887 1.00 0.00 C ATOM 882 C ALA A 56 20.371 18.201 21.966 1.00 0.00 C ATOM 883 O ALA A 56 20.011 18.163 23.138 1.00 0.00 O ATOM 884 CB ALA A 56 20.508 16.190 20.472 1.00 0.00 C ATOM 0 H ALA A 56 20.120 17.950 18.879 1.00 0.00 H new ATOM 0 HA ALA A 56 18.703 17.061 21.276 1.00 0.00 H new ATOM 0 HB1 ALA A 56 20.629 15.518 21.322 1.00 0.00 H new ATOM 0 HB2 ALA A 56 20.011 15.661 19.659 1.00 0.00 H new ATOM 0 HB3 ALA A 56 21.488 16.531 20.137 1.00 0.00 H new ATOM 890 N ASN A 57 21.366 18.954 21.584 1.00 0.00 N ATOM 891 CA ASN A 57 22.080 19.784 22.568 1.00 0.00 C ATOM 892 C ASN A 57 22.437 21.132 21.968 1.00 0.00 C ATOM 893 O ASN A 57 22.387 21.351 20.751 1.00 0.00 O ATOM 894 CB ASN A 57 23.359 19.041 22.887 1.00 0.00 C ATOM 895 CG ASN A 57 24.115 18.754 21.599 1.00 0.00 C ATOM 896 OD1 ASN A 57 24.974 19.534 21.202 1.00 0.00 O ATOM 897 ND2 ASN A 57 23.833 17.681 20.918 1.00 0.00 N ATOM 0 H ASN A 57 21.709 19.024 20.626 1.00 0.00 H new ATOM 0 HA ASN A 57 21.464 19.957 23.450 1.00 0.00 H new ATOM 0 HB2 ASN A 57 23.978 19.634 23.560 1.00 0.00 H new ATOM 0 HB3 ASN A 57 23.131 18.108 23.403 1.00 0.00 H new ATOM 0 HD21 ASN A 57 24.328 17.484 20.048 1.00 0.00 H new ATOM 0 HD22 ASN A 57 23.117 17.037 21.254 1.00 0.00 H new ATOM 904 N ALA A 58 22.824 22.026 22.810 1.00 0.00 N ATOM 905 CA ALA A 58 23.223 23.362 22.340 1.00 0.00 C ATOM 906 C ALA A 58 24.465 23.261 21.458 1.00 0.00 C ATOM 907 O ALA A 58 24.707 24.128 20.637 1.00 0.00 O ATOM 908 CB ALA A 58 23.532 24.145 23.611 1.00 0.00 C ATOM 0 H ALA A 58 22.882 21.887 23.819 1.00 0.00 H new ATOM 0 HA ALA A 58 22.448 23.841 21.742 1.00 0.00 H new ATOM 0 HB1 ALA A 58 23.839 25.158 23.349 1.00 0.00 H new ATOM 0 HB2 ALA A 58 22.642 24.187 24.238 1.00 0.00 H new ATOM 0 HB3 ALA A 58 24.337 23.651 24.156 1.00 0.00 H new ATOM 914 N SER A 59 25.258 22.222 21.589 1.00 0.00 N ATOM 915 CA SER A 59 26.469 22.134 20.721 1.00 0.00 C ATOM 916 C SER A 59 26.035 21.825 19.295 1.00 0.00 C ATOM 917 O SER A 59 26.596 22.344 18.333 1.00 0.00 O ATOM 918 CB SER A 59 27.327 21.008 21.299 1.00 0.00 C ATOM 919 OG SER A 59 28.665 21.162 20.845 1.00 0.00 O ATOM 0 H SER A 59 25.122 21.451 22.243 1.00 0.00 H new ATOM 0 HA SER A 59 27.035 23.065 20.697 1.00 0.00 H new ATOM 0 HB2 SER A 59 27.295 21.032 22.388 1.00 0.00 H new ATOM 0 HB3 SER A 59 26.934 20.039 20.990 1.00 0.00 H new ATOM 0 HG SER A 59 29.220 20.444 21.214 1.00 0.00 H new ATOM 925 N GLU A 60 25.019 21.021 19.138 1.00 0.00 N ATOM 926 CA GLU A 60 24.522 20.725 17.776 1.00 0.00 C ATOM 927 C GLU A 60 24.048 22.044 17.179 1.00 0.00 C ATOM 928 O GLU A 60 24.433 22.447 16.075 1.00 0.00 O ATOM 929 CB GLU A 60 23.362 19.750 17.980 1.00 0.00 C ATOM 930 CG GLU A 60 22.924 19.182 16.631 1.00 0.00 C ATOM 931 CD GLU A 60 24.100 18.472 15.957 1.00 0.00 C ATOM 932 OE1 GLU A 60 24.550 17.472 16.493 1.00 0.00 O ATOM 933 OE2 GLU A 60 24.529 18.939 14.915 1.00 0.00 O ATOM 0 H GLU A 60 24.516 20.560 19.896 1.00 0.00 H new ATOM 0 HA GLU A 60 25.265 20.292 17.106 1.00 0.00 H new ATOM 0 HB2 GLU A 60 23.666 18.941 18.644 1.00 0.00 H new ATOM 0 HB3 GLU A 60 22.526 20.259 18.460 1.00 0.00 H new ATOM 0 HG2 GLU A 60 22.099 18.484 16.771 1.00 0.00 H new ATOM 0 HG3 GLU A 60 22.557 19.984 15.991 1.00 0.00 H new ATOM 940 N ALA A 61 23.261 22.760 17.931 1.00 0.00 N ATOM 941 CA ALA A 61 22.799 24.092 17.462 1.00 0.00 C ATOM 942 C ALA A 61 24.018 24.964 17.233 1.00 0.00 C ATOM 943 O ALA A 61 24.145 25.659 16.227 1.00 0.00 O ATOM 944 CB ALA A 61 21.994 24.648 18.619 1.00 0.00 C ATOM 0 H ALA A 61 22.918 22.479 18.850 1.00 0.00 H new ATOM 0 HA ALA A 61 22.219 24.047 16.540 1.00 0.00 H new ATOM 0 HB1 ALA A 61 21.613 25.635 18.356 1.00 0.00 H new ATOM 0 HB2 ALA A 61 21.158 23.982 18.834 1.00 0.00 H new ATOM 0 HB3 ALA A 61 22.631 24.727 19.500 1.00 0.00 H new ATOM 950 N LEU A 62 24.931 24.909 18.158 1.00 0.00 N ATOM 951 CA LEU A 62 26.175 25.692 18.031 1.00 0.00 C ATOM 952 C LEU A 62 26.905 25.225 16.769 1.00 0.00 C ATOM 953 O LEU A 62 27.643 25.977 16.136 1.00 0.00 O ATOM 954 CB LEU A 62 26.956 25.337 19.300 1.00 0.00 C ATOM 955 CG LEU A 62 26.359 26.047 20.525 1.00 0.00 C ATOM 956 CD1 LEU A 62 27.001 25.486 21.795 1.00 0.00 C ATOM 957 CD2 LEU A 62 26.607 27.555 20.465 1.00 0.00 C ATOM 0 H LEU A 62 24.862 24.346 19.006 1.00 0.00 H new ATOM 0 HA LEU A 62 26.030 26.769 17.940 1.00 0.00 H new ATOM 0 HB2 LEU A 62 26.937 24.258 19.454 1.00 0.00 H new ATOM 0 HB3 LEU A 62 28.001 25.624 19.181 1.00 0.00 H new ATOM 0 HG LEU A 62 25.283 25.873 20.532 1.00 0.00 H new ATOM 0 HD11 LEU A 62 26.581 25.987 22.667 1.00 0.00 H new ATOM 0 HD12 LEU A 62 26.803 24.416 21.861 1.00 0.00 H new ATOM 0 HD13 LEU A 62 28.077 25.655 21.764 1.00 0.00 H new ATOM 0 HD21 LEU A 62 26.173 28.030 21.345 1.00 0.00 H new ATOM 0 HD22 LEU A 62 27.680 27.747 20.441 1.00 0.00 H new ATOM 0 HD23 LEU A 62 26.145 27.964 19.567 1.00 0.00 H new ATOM 969 N ALA A 63 26.687 23.990 16.384 1.00 0.00 N ATOM 970 CA ALA A 63 27.328 23.458 15.166 1.00 0.00 C ATOM 971 C ALA A 63 26.569 23.936 13.924 1.00 0.00 C ATOM 972 O ALA A 63 27.094 23.915 12.812 1.00 0.00 O ATOM 973 CB ALA A 63 27.249 21.935 15.296 1.00 0.00 C ATOM 0 H ALA A 63 26.084 23.330 16.875 1.00 0.00 H new ATOM 0 HA ALA A 63 28.359 23.797 15.061 1.00 0.00 H new ATOM 0 HB1 ALA A 63 27.708 21.471 14.423 1.00 0.00 H new ATOM 0 HB2 ALA A 63 27.778 21.619 16.195 1.00 0.00 H new ATOM 0 HB3 ALA A 63 26.205 21.629 15.363 1.00 0.00 H new ATOM 979 N ALA A 64 25.346 24.384 14.091 1.00 0.00 N ATOM 980 CA ALA A 64 24.572 24.879 12.905 1.00 0.00 C ATOM 981 C ALA A 64 25.026 26.279 12.525 1.00 0.00 C ATOM 982 O ALA A 64 24.532 26.890 11.579 1.00 0.00 O ATOM 983 CB ALA A 64 23.093 24.893 13.314 1.00 0.00 C ATOM 0 H ALA A 64 24.855 24.429 14.984 1.00 0.00 H new ATOM 0 HA ALA A 64 24.732 24.236 12.040 1.00 0.00 H new ATOM 0 HB1 ALA A 64 22.488 25.248 12.480 1.00 0.00 H new ATOM 0 HB2 ALA A 64 22.781 23.885 13.585 1.00 0.00 H new ATOM 0 HB3 ALA A 64 22.958 25.557 14.168 1.00 0.00 H new ATOM 989 N GLY A 65 25.959 26.783 13.250 1.00 0.00 N ATOM 990 CA GLY A 65 26.488 28.148 12.974 1.00 0.00 C ATOM 991 C GLY A 65 25.578 29.199 13.618 1.00 0.00 C ATOM 992 O GLY A 65 25.381 30.285 13.074 1.00 0.00 O ATOM 0 H GLY A 65 26.394 26.307 14.041 1.00 0.00 H new ATOM 0 HA2 GLY A 65 27.501 28.241 13.366 1.00 0.00 H new ATOM 0 HA3 GLY A 65 26.546 28.314 11.898 1.00 0.00 H new ATOM 996 N PHE A 66 25.031 28.909 14.770 1.00 0.00 N ATOM 997 CA PHE A 66 24.146 29.903 15.449 1.00 0.00 C ATOM 998 C PHE A 66 24.815 30.494 16.681 1.00 0.00 C ATOM 999 O PHE A 66 25.744 29.924 17.250 1.00 0.00 O ATOM 1000 CB PHE A 66 22.885 29.146 15.875 1.00 0.00 C ATOM 1001 CG PHE A 66 22.046 28.801 14.674 1.00 0.00 C ATOM 1002 CD1 PHE A 66 22.559 28.010 13.645 1.00 0.00 C ATOM 1003 CD2 PHE A 66 20.737 29.290 14.599 1.00 0.00 C ATOM 1004 CE1 PHE A 66 21.760 27.708 12.536 1.00 0.00 C ATOM 1005 CE2 PHE A 66 19.941 28.991 13.493 1.00 0.00 C ATOM 1006 CZ PHE A 66 20.451 28.202 12.462 1.00 0.00 C ATOM 0 H PHE A 66 25.158 28.029 15.269 1.00 0.00 H new ATOM 0 HA PHE A 66 23.923 30.727 14.772 1.00 0.00 H new ATOM 0 HB2 PHE A 66 23.162 28.235 16.406 1.00 0.00 H new ATOM 0 HB3 PHE A 66 22.305 29.755 16.568 1.00 0.00 H new ATOM 0 HD1 PHE A 66 23.569 27.632 13.704 1.00 0.00 H new ATOM 0 HD2 PHE A 66 20.342 29.900 15.398 1.00 0.00 H new ATOM 0 HE1 PHE A 66 22.152 27.095 11.738 1.00 0.00 H new ATOM 0 HE2 PHE A 66 18.931 29.370 13.435 1.00 0.00 H new ATOM 0 HZ PHE A 66 19.836 27.971 11.605 1.00 0.00 H new ATOM 1016 N ARG A 67 24.321 31.614 17.120 1.00 0.00 N ATOM 1017 CA ARG A 67 24.871 32.249 18.339 1.00 0.00 C ATOM 1018 C ARG A 67 23.941 31.903 19.503 1.00 0.00 C ATOM 1019 O ARG A 67 22.780 32.304 19.510 1.00 0.00 O ATOM 1020 CB ARG A 67 24.856 33.752 18.054 1.00 0.00 C ATOM 1021 CG ARG A 67 25.831 34.463 18.997 1.00 0.00 C ATOM 1022 CD ARG A 67 26.695 35.446 18.202 1.00 0.00 C ATOM 1023 NE ARG A 67 27.981 35.525 18.955 1.00 0.00 N ATOM 1024 CZ ARG A 67 29.013 36.159 18.453 1.00 0.00 C ATOM 1025 NH1 ARG A 67 28.939 36.736 17.281 1.00 0.00 N ATOM 1026 NH2 ARG A 67 30.127 36.215 19.131 1.00 0.00 N ATOM 0 H ARG A 67 23.552 32.120 16.680 1.00 0.00 H new ATOM 0 HA ARG A 67 25.878 31.916 18.592 1.00 0.00 H new ATOM 0 HB2 ARG A 67 25.136 33.939 17.017 1.00 0.00 H new ATOM 0 HB3 ARG A 67 23.850 34.148 18.189 1.00 0.00 H new ATOM 0 HG2 ARG A 67 25.279 34.994 19.773 1.00 0.00 H new ATOM 0 HG3 ARG A 67 26.464 33.732 19.500 1.00 0.00 H new ATOM 0 HD2 ARG A 67 26.855 35.095 17.182 1.00 0.00 H new ATOM 0 HD3 ARG A 67 26.218 36.424 18.132 1.00 0.00 H new ATOM 0 HE ARG A 67 28.058 35.081 19.870 1.00 0.00 H new ATOM 0 HH11 ARG A 67 28.071 36.696 16.747 1.00 0.00 H new ATOM 0 HH12 ARG A 67 29.749 37.226 16.902 1.00 0.00 H new ATOM 0 HH21 ARG A 67 30.191 35.767 20.045 1.00 0.00 H new ATOM 0 HH22 ARG A 67 30.934 36.707 18.747 1.00 0.00 H new ATOM 1040 N PRO A 68 24.450 31.149 20.437 1.00 0.00 N ATOM 1041 CA PRO A 68 23.623 30.726 21.591 1.00 0.00 C ATOM 1042 C PRO A 68 23.166 31.943 22.404 1.00 0.00 C ATOM 1043 O PRO A 68 23.926 32.881 22.641 1.00 0.00 O ATOM 1044 CB PRO A 68 24.548 29.786 22.367 1.00 0.00 C ATOM 1045 CG PRO A 68 25.931 30.171 21.951 1.00 0.00 C ATOM 1046 CD PRO A 68 25.824 30.637 20.526 1.00 0.00 C ATOM 0 HA PRO A 68 22.695 30.227 21.314 1.00 0.00 H new ATOM 0 HB2 PRO A 68 24.414 29.900 23.443 1.00 0.00 H new ATOM 0 HB3 PRO A 68 24.340 28.743 22.129 1.00 0.00 H new ATOM 0 HG2 PRO A 68 26.325 30.961 22.591 1.00 0.00 H new ATOM 0 HG3 PRO A 68 26.613 29.324 22.034 1.00 0.00 H new ATOM 0 HD2 PRO A 68 26.557 31.412 20.301 1.00 0.00 H new ATOM 0 HD3 PRO A 68 25.995 29.822 19.823 1.00 0.00 H new ATOM 1054 N CYS A 69 21.919 31.949 22.805 1.00 0.00 N ATOM 1055 CA CYS A 69 21.365 33.101 23.571 1.00 0.00 C ATOM 1056 C CYS A 69 22.210 33.345 24.829 1.00 0.00 C ATOM 1057 O CYS A 69 22.375 32.467 25.673 1.00 0.00 O ATOM 1058 CB CYS A 69 19.924 32.678 23.860 1.00 0.00 C ATOM 1059 SG CYS A 69 19.181 33.580 25.257 1.00 0.00 S ATOM 0 H CYS A 69 21.256 31.194 22.631 1.00 0.00 H new ATOM 0 HA CYS A 69 21.386 34.054 23.042 1.00 0.00 H new ATOM 0 HB2 CYS A 69 19.319 32.839 22.968 1.00 0.00 H new ATOM 0 HB3 CYS A 69 19.901 31.609 24.072 1.00 0.00 H new ATOM 0 HG CYS A 69 18.566 32.741 26.037 1.00 0.00 H new ATOM 1064 N LYS A 70 22.764 34.525 24.945 1.00 0.00 N ATOM 1065 CA LYS A 70 23.655 34.859 26.112 1.00 0.00 C ATOM 1066 C LYS A 70 22.944 34.650 27.452 1.00 0.00 C ATOM 1067 O LYS A 70 23.511 34.878 28.514 1.00 0.00 O ATOM 1068 CB LYS A 70 24.017 36.337 25.924 1.00 0.00 C ATOM 1069 CG LYS A 70 25.413 36.612 26.507 1.00 0.00 C ATOM 1070 CD LYS A 70 25.344 36.700 28.033 1.00 0.00 C ATOM 1071 CE LYS A 70 26.494 37.567 28.556 1.00 0.00 C ATOM 1072 NZ LYS A 70 27.732 36.818 28.199 1.00 0.00 N ATOM 0 H LYS A 70 22.639 35.284 24.276 1.00 0.00 H new ATOM 0 HA LYS A 70 24.532 34.212 26.136 1.00 0.00 H new ATOM 0 HB2 LYS A 70 23.999 36.593 24.865 1.00 0.00 H new ATOM 0 HB3 LYS A 70 23.277 36.967 26.417 1.00 0.00 H new ATOM 0 HG2 LYS A 70 26.100 35.819 26.213 1.00 0.00 H new ATOM 0 HG3 LYS A 70 25.808 37.543 26.100 1.00 0.00 H new ATOM 0 HD2 LYS A 70 24.388 37.125 28.339 1.00 0.00 H new ATOM 0 HD3 LYS A 70 25.403 35.702 28.467 1.00 0.00 H new ATOM 0 HE2 LYS A 70 26.484 38.555 28.097 1.00 0.00 H new ATOM 0 HE3 LYS A 70 26.419 37.715 29.633 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 28.523 37.157 28.782 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 27.585 35.803 28.371 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 27.952 36.970 27.194 1.00 0.00 H new ATOM 1086 N ARG A 71 21.719 34.233 27.434 1.00 0.00 N ATOM 1087 CA ARG A 71 20.992 34.024 28.708 1.00 0.00 C ATOM 1088 C ARG A 71 20.694 32.538 28.870 1.00 0.00 C ATOM 1089 O ARG A 71 20.675 31.992 29.970 1.00 0.00 O ATOM 1090 CB ARG A 71 19.701 34.788 28.508 1.00 0.00 C ATOM 1091 CG ARG A 71 19.204 35.339 29.852 1.00 0.00 C ATOM 1092 CD ARG A 71 18.865 36.830 29.705 1.00 0.00 C ATOM 1093 NE ARG A 71 20.029 37.563 30.285 1.00 0.00 N ATOM 1094 CZ ARG A 71 20.198 37.632 31.584 1.00 0.00 C ATOM 1095 NH1 ARG A 71 19.351 37.057 32.402 1.00 0.00 N ATOM 1096 NH2 ARG A 71 21.223 38.278 32.069 1.00 0.00 N ATOM 0 H ARG A 71 21.186 34.026 26.589 1.00 0.00 H new ATOM 0 HA ARG A 71 21.546 34.351 29.588 1.00 0.00 H new ATOM 0 HB2 ARG A 71 19.858 35.607 27.806 1.00 0.00 H new ATOM 0 HB3 ARG A 71 18.946 34.134 28.072 1.00 0.00 H new ATOM 0 HG2 ARG A 71 18.324 34.786 30.180 1.00 0.00 H new ATOM 0 HG3 ARG A 71 19.968 35.203 30.617 1.00 0.00 H new ATOM 0 HD2 ARG A 71 18.715 37.097 28.659 1.00 0.00 H new ATOM 0 HD3 ARG A 71 17.944 37.077 30.232 1.00 0.00 H new ATOM 0 HE ARG A 71 20.700 38.015 29.664 1.00 0.00 H new ATOM 0 HH11 ARG A 71 18.549 36.548 32.031 1.00 0.00 H new ATOM 0 HH12 ARG A 71 19.494 37.118 33.410 1.00 0.00 H new ATOM 0 HH21 ARG A 71 21.888 38.726 31.439 1.00 0.00 H new ATOM 0 HH22 ARG A 71 21.359 38.335 33.078 1.00 0.00 H new ATOM 1110 N CYS A 72 20.460 31.889 27.768 1.00 0.00 N ATOM 1111 CA CYS A 72 20.149 30.423 27.783 1.00 0.00 C ATOM 1112 C CYS A 72 21.435 29.606 27.668 1.00 0.00 C ATOM 1113 O CYS A 72 21.488 28.436 28.040 1.00 0.00 O ATOM 1114 CB CYS A 72 19.296 30.180 26.535 1.00 0.00 C ATOM 1115 SG CYS A 72 17.562 30.533 26.874 1.00 0.00 S ATOM 0 H CYS A 72 20.470 32.312 26.840 1.00 0.00 H new ATOM 0 HA CYS A 72 19.645 30.132 28.705 1.00 0.00 H new ATOM 0 HB2 CYS A 72 19.648 30.811 25.719 1.00 0.00 H new ATOM 0 HB3 CYS A 72 19.405 29.146 26.209 1.00 0.00 H new ATOM 0 HG CYS A 72 17.117 31.394 26.007 1.00 0.00 H new ATOM 1120 N GLN A 73 22.457 30.196 27.122 1.00 0.00 N ATOM 1121 CA GLN A 73 23.739 29.467 26.929 1.00 0.00 C ATOM 1122 C GLN A 73 24.575 29.401 28.221 1.00 0.00 C ATOM 1123 O GLN A 73 25.111 28.343 28.544 1.00 0.00 O ATOM 1124 CB GLN A 73 24.453 30.263 25.835 1.00 0.00 C ATOM 1125 CG GLN A 73 25.799 29.608 25.504 1.00 0.00 C ATOM 1126 CD GLN A 73 26.841 30.696 25.231 1.00 0.00 C ATOM 1127 OE1 GLN A 73 26.494 31.838 24.941 1.00 0.00 O ATOM 1128 NE2 GLN A 73 28.110 30.400 25.309 1.00 0.00 N ATOM 0 H GLN A 73 22.460 31.163 26.797 1.00 0.00 H new ATOM 0 HA GLN A 73 23.580 28.424 26.656 1.00 0.00 H new ATOM 0 HB2 GLN A 73 23.831 30.307 24.941 1.00 0.00 H new ATOM 0 HB3 GLN A 73 24.610 31.290 26.165 1.00 0.00 H new ATOM 0 HG2 GLN A 73 26.123 28.979 26.333 1.00 0.00 H new ATOM 0 HG3 GLN A 73 25.696 28.961 24.633 1.00 0.00 H new ATOM 0 HE21 GLN A 73 28.399 29.452 25.550 1.00 0.00 H new ATOM 0 HE22 GLN A 73 28.813 31.117 25.129 1.00 0.00 H new ATOM 1137 N PRO A 74 24.687 30.502 28.930 1.00 0.00 N ATOM 1138 CA PRO A 74 25.489 30.497 30.179 1.00 0.00 C ATOM 1139 C PRO A 74 24.763 29.741 31.297 1.00 0.00 C ATOM 1140 O PRO A 74 25.381 29.006 32.064 1.00 0.00 O ATOM 1141 CB PRO A 74 25.636 31.974 30.524 1.00 0.00 C ATOM 1142 CG PRO A 74 24.472 32.644 29.872 1.00 0.00 C ATOM 1143 CD PRO A 74 24.103 31.825 28.659 1.00 0.00 C ATOM 0 HA PRO A 74 26.449 29.995 30.059 1.00 0.00 H new ATOM 0 HB2 PRO A 74 25.627 32.130 31.603 1.00 0.00 H new ATOM 0 HB3 PRO A 74 26.580 32.374 30.152 1.00 0.00 H new ATOM 0 HG2 PRO A 74 23.631 32.709 30.562 1.00 0.00 H new ATOM 0 HG3 PRO A 74 24.728 33.664 29.584 1.00 0.00 H new ATOM 0 HD2 PRO A 74 23.022 31.765 28.532 1.00 0.00 H new ATOM 0 HD3 PRO A 74 24.508 32.260 27.745 1.00 0.00 H new ATOM 1151 N ASP A 75 23.469 29.901 31.412 1.00 0.00 N ATOM 1152 CA ASP A 75 22.731 29.182 32.491 1.00 0.00 C ATOM 1153 C ASP A 75 22.582 27.698 32.126 1.00 0.00 C ATOM 1154 O ASP A 75 23.041 27.251 31.077 1.00 0.00 O ATOM 1155 CB ASP A 75 21.373 29.893 32.610 1.00 0.00 C ATOM 1156 CG ASP A 75 20.329 29.225 31.715 1.00 0.00 C ATOM 1157 OD1 ASP A 75 19.908 28.127 32.043 1.00 0.00 O ATOM 1158 OD2 ASP A 75 19.962 29.828 30.724 1.00 0.00 O ATOM 0 H ASP A 75 22.897 30.493 30.810 1.00 0.00 H new ATOM 0 HA ASP A 75 23.256 29.206 33.446 1.00 0.00 H new ATOM 0 HB2 ASP A 75 21.036 29.872 33.647 1.00 0.00 H new ATOM 0 HB3 ASP A 75 21.481 30.941 32.331 1.00 0.00 H new ATOM 1163 N LYS A 76 21.987 26.922 32.992 1.00 0.00 N ATOM 1164 CA LYS A 76 21.847 25.463 32.730 1.00 0.00 C ATOM 1165 C LYS A 76 20.410 25.072 32.349 1.00 0.00 C ATOM 1166 O LYS A 76 19.438 25.571 32.907 1.00 0.00 O ATOM 1167 CB LYS A 76 22.242 24.811 34.052 1.00 0.00 C ATOM 1168 CG LYS A 76 23.686 25.184 34.402 1.00 0.00 C ATOM 1169 CD LYS A 76 24.647 24.526 33.409 1.00 0.00 C ATOM 1170 CE LYS A 76 26.063 25.060 33.641 1.00 0.00 C ATOM 1171 NZ LYS A 76 26.960 23.914 33.329 1.00 0.00 N ATOM 0 H LYS A 76 21.590 27.240 33.876 1.00 0.00 H new ATOM 0 HA LYS A 76 22.463 25.147 31.888 1.00 0.00 H new ATOM 0 HB2 LYS A 76 21.570 25.138 34.845 1.00 0.00 H new ATOM 0 HB3 LYS A 76 22.144 23.728 33.978 1.00 0.00 H new ATOM 0 HG2 LYS A 76 23.808 26.267 34.377 1.00 0.00 H new ATOM 0 HG3 LYS A 76 23.919 24.861 35.416 1.00 0.00 H new ATOM 0 HD2 LYS A 76 24.630 23.443 33.533 1.00 0.00 H new ATOM 0 HD3 LYS A 76 24.331 24.735 32.387 1.00 0.00 H new ATOM 0 HE2 LYS A 76 26.274 25.914 32.997 1.00 0.00 H new ATOM 0 HE3 LYS A 76 26.195 25.396 34.669 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 27.950 24.201 33.465 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 26.740 23.119 33.962 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 26.817 23.620 32.342 1.00 0.00 H new ATOM 1185 N ALA A 77 20.279 24.172 31.405 1.00 0.00 N ATOM 1186 CA ALA A 77 18.931 23.688 30.965 1.00 0.00 C ATOM 1187 C ALA A 77 18.511 22.497 31.860 1.00 0.00 C ATOM 1188 O ALA A 77 18.272 22.677 33.046 1.00 0.00 O ATOM 1189 CB ALA A 77 19.169 23.274 29.515 1.00 0.00 C ATOM 0 H ALA A 77 21.063 23.745 30.912 1.00 0.00 H new ATOM 0 HA ALA A 77 18.129 24.422 31.045 1.00 0.00 H new ATOM 0 HB1 ALA A 77 18.240 22.899 29.086 1.00 0.00 H new ATOM 0 HB2 ALA A 77 19.511 24.136 28.942 1.00 0.00 H new ATOM 0 HB3 ALA A 77 19.926 22.491 29.480 1.00 0.00 H new ATOM 1195 N ASN A 78 18.481 21.269 31.368 1.00 0.00 N ATOM 1196 CA ASN A 78 18.160 20.138 32.300 1.00 0.00 C ATOM 1197 C ASN A 78 19.243 20.087 33.358 1.00 0.00 C ATOM 1198 O ASN A 78 18.972 19.747 34.508 1.00 0.00 O ATOM 1199 CB ASN A 78 18.148 18.812 31.516 1.00 0.00 C ATOM 1200 CG ASN A 78 16.815 18.620 30.781 1.00 0.00 C ATOM 1201 OD1 ASN A 78 16.791 18.154 29.644 1.00 0.00 O ATOM 1202 ND2 ASN A 78 15.694 18.945 31.377 1.00 0.00 N ATOM 0 H ASN A 78 18.659 21.012 30.397 1.00 0.00 H new ATOM 0 HA ASN A 78 17.182 20.287 32.758 1.00 0.00 H new ATOM 0 HB2 ASN A 78 18.968 18.803 30.798 1.00 0.00 H new ATOM 0 HB3 ASN A 78 18.314 17.980 32.200 1.00 0.00 H new ATOM 0 HD21 ASN A 78 14.804 18.811 30.897 1.00 0.00 H new ATOM 0 HD22 ASN A 78 15.712 19.332 32.321 1.00 0.00 H new ATOM 1209 N PRO A 79 20.436 20.489 32.979 1.00 0.00 N ATOM 1210 CA PRO A 79 21.536 20.544 33.979 1.00 0.00 C ATOM 1211 C PRO A 79 21.124 21.552 35.070 1.00 0.00 C ATOM 1212 O PRO A 79 21.642 21.540 36.184 1.00 0.00 O ATOM 1213 CB PRO A 79 22.705 21.026 33.105 1.00 0.00 C ATOM 1214 CG PRO A 79 22.048 21.773 32.015 1.00 0.00 C ATOM 1215 CD PRO A 79 20.895 20.916 31.652 1.00 0.00 C ATOM 0 HA PRO A 79 21.780 19.622 34.507 1.00 0.00 H new ATOM 0 HB2 PRO A 79 23.390 21.660 33.668 1.00 0.00 H new ATOM 0 HB3 PRO A 79 23.288 20.189 32.721 1.00 0.00 H new ATOM 0 HG2 PRO A 79 21.726 22.761 32.343 1.00 0.00 H new ATOM 0 HG3 PRO A 79 22.719 21.922 31.169 1.00 0.00 H new ATOM 0 HD2 PRO A 79 20.128 21.466 31.107 1.00 0.00 H new ATOM 0 HD3 PRO A 79 21.188 20.073 31.026 1.00 0.00 H new ATOM 1223 N ARG A 80 20.163 22.406 34.761 1.00 0.00 N ATOM 1224 CA ARG A 80 19.669 23.391 35.752 1.00 0.00 C ATOM 1225 C ARG A 80 19.148 22.644 36.989 1.00 0.00 C ATOM 1226 O ARG A 80 19.690 22.764 38.087 1.00 0.00 O ATOM 1227 CB ARG A 80 18.515 24.137 35.087 1.00 0.00 C ATOM 1228 CG ARG A 80 18.282 25.468 35.807 1.00 0.00 C ATOM 1229 CD ARG A 80 16.781 25.763 35.863 1.00 0.00 C ATOM 1230 NE ARG A 80 16.479 26.485 34.591 1.00 0.00 N ATOM 1231 CZ ARG A 80 15.339 27.112 34.433 1.00 0.00 C ATOM 1232 NH1 ARG A 80 14.441 27.118 35.385 1.00 0.00 N ATOM 1233 NH2 ARG A 80 15.096 27.737 33.313 1.00 0.00 N ATOM 0 H ARG A 80 19.705 22.451 33.851 1.00 0.00 H new ATOM 0 HA ARG A 80 20.458 24.077 36.062 1.00 0.00 H new ATOM 0 HB2 ARG A 80 18.741 24.315 34.036 1.00 0.00 H new ATOM 0 HB3 ARG A 80 17.610 23.531 35.120 1.00 0.00 H new ATOM 0 HG2 ARG A 80 18.693 25.425 36.816 1.00 0.00 H new ATOM 0 HG3 ARG A 80 18.802 26.272 35.285 1.00 0.00 H new ATOM 0 HD2 ARG A 80 16.201 24.843 35.942 1.00 0.00 H new ATOM 0 HD3 ARG A 80 16.531 26.373 36.731 1.00 0.00 H new ATOM 0 HE ARG A 80 17.167 26.490 33.838 1.00 0.00 H new ATOM 0 HH11 ARG A 80 14.625 26.631 36.262 1.00 0.00 H new ATOM 0 HH12 ARG A 80 13.558 27.610 35.250 1.00 0.00 H new ATOM 0 HH21 ARG A 80 15.791 27.736 32.567 1.00 0.00 H new ATOM 0 HH22 ARG A 80 14.211 28.227 33.184 1.00 0.00 H new ATOM 1247 N GLN A 81 18.102 21.869 36.823 1.00 0.00 N ATOM 1248 CA GLN A 81 17.517 21.091 37.967 1.00 0.00 C ATOM 1249 C GLN A 81 18.604 20.304 38.735 1.00 0.00 C ATOM 1250 O GLN A 81 18.524 20.131 39.950 1.00 0.00 O ATOM 1251 CB GLN A 81 16.519 20.129 37.322 1.00 0.00 C ATOM 1252 CG GLN A 81 15.161 20.820 37.185 1.00 0.00 C ATOM 1253 CD GLN A 81 14.227 19.953 36.340 1.00 0.00 C ATOM 1254 OE1 GLN A 81 14.274 19.992 35.113 1.00 0.00 O ATOM 1255 NE2 GLN A 81 13.373 19.164 36.935 1.00 0.00 N ATOM 0 H GLN A 81 17.621 21.740 35.933 1.00 0.00 H new ATOM 0 HA GLN A 81 17.049 21.751 38.698 1.00 0.00 H new ATOM 0 HB2 GLN A 81 16.880 19.816 36.342 1.00 0.00 H new ATOM 0 HB3 GLN A 81 16.421 19.229 37.928 1.00 0.00 H new ATOM 0 HG2 GLN A 81 14.726 20.987 38.170 1.00 0.00 H new ATOM 0 HG3 GLN A 81 15.285 21.798 36.721 1.00 0.00 H new ATOM 0 HE21 GLN A 81 13.333 19.131 37.954 1.00 0.00 H new ATOM 0 HE22 GLN A 81 12.746 18.581 36.381 1.00 0.00 H new ATOM 1264 N HIS A 82 19.611 19.815 38.041 1.00 0.00 N ATOM 1265 CA HIS A 82 20.690 19.029 38.724 1.00 0.00 C ATOM 1266 C HIS A 82 21.517 19.970 39.624 1.00 0.00 C ATOM 1267 O HIS A 82 21.817 19.655 40.782 1.00 0.00 O ATOM 1268 CB HIS A 82 21.547 18.464 37.582 1.00 0.00 C ATOM 1269 CG HIS A 82 22.876 17.994 38.114 1.00 0.00 C ATOM 1270 ND1 HIS A 82 23.065 16.716 38.616 1.00 0.00 N ATOM 1271 CD2 HIS A 82 24.091 18.624 38.227 1.00 0.00 C ATOM 1272 CE1 HIS A 82 24.349 16.619 39.005 1.00 0.00 C ATOM 1273 NE2 HIS A 82 25.020 17.754 38.790 1.00 0.00 N ATOM 0 H HIS A 82 19.730 19.927 37.034 1.00 0.00 H new ATOM 0 HA HIS A 82 20.302 18.235 39.362 1.00 0.00 H new ATOM 0 HB2 HIS A 82 21.026 17.636 37.101 1.00 0.00 H new ATOM 0 HB3 HIS A 82 21.701 19.228 36.821 1.00 0.00 H new ATOM 0 HD2 HIS A 82 24.295 19.641 37.925 1.00 0.00 H new ATOM 0 HE1 HIS A 82 24.785 15.731 39.439 1.00 0.00 H new ATOM 0 HE2 HIS A 82 26.001 17.942 38.994 1.00 0.00 H new ATOM 1281 N ARG A 83 21.859 21.133 39.134 1.00 0.00 N ATOM 1282 CA ARG A 83 22.631 22.096 39.973 1.00 0.00 C ATOM 1283 C ARG A 83 21.739 22.584 41.117 1.00 0.00 C ATOM 1284 O ARG A 83 22.215 22.982 42.191 1.00 0.00 O ATOM 1285 CB ARG A 83 22.993 23.253 39.040 1.00 0.00 C ATOM 1286 CG ARG A 83 23.845 24.274 39.798 1.00 0.00 C ATOM 1287 CD ARG A 83 24.433 25.289 38.813 1.00 0.00 C ATOM 1288 NE ARG A 83 23.637 26.535 39.018 1.00 0.00 N ATOM 1289 CZ ARG A 83 23.985 27.655 38.433 1.00 0.00 C ATOM 1290 NH1 ARG A 83 25.038 27.704 37.656 1.00 0.00 N ATOM 1291 NH2 ARG A 83 23.275 28.733 38.626 1.00 0.00 N ATOM 0 H ARG A 83 21.638 21.457 38.192 1.00 0.00 H new ATOM 0 HA ARG A 83 23.524 21.651 40.412 1.00 0.00 H new ATOM 0 HB2 ARG A 83 23.540 22.879 38.175 1.00 0.00 H new ATOM 0 HB3 ARG A 83 22.087 23.728 38.664 1.00 0.00 H new ATOM 0 HG2 ARG A 83 23.238 24.787 40.544 1.00 0.00 H new ATOM 0 HG3 ARG A 83 24.647 23.766 40.334 1.00 0.00 H new ATOM 0 HD2 ARG A 83 25.491 25.461 39.009 1.00 0.00 H new ATOM 0 HD3 ARG A 83 24.352 24.934 37.786 1.00 0.00 H new ATOM 0 HE ARG A 83 22.814 26.515 39.620 1.00 0.00 H new ATOM 0 HH11 ARG A 83 25.597 26.865 37.501 1.00 0.00 H new ATOM 0 HH12 ARG A 83 25.299 28.581 37.206 1.00 0.00 H new ATOM 0 HH21 ARG A 83 22.454 28.701 39.230 1.00 0.00 H new ATOM 0 HH22 ARG A 83 23.542 29.607 38.173 1.00 0.00 H new ATOM 1305 N LEU A 84 20.443 22.524 40.931 1.00 0.00 N ATOM 1306 CA LEU A 84 19.549 22.953 42.011 1.00 0.00 C ATOM 1307 C LEU A 84 19.492 21.841 43.053 1.00 0.00 C ATOM 1308 O LEU A 84 19.399 22.096 44.255 1.00 0.00 O ATOM 1309 CB LEU A 84 18.194 23.185 41.406 1.00 0.00 C ATOM 1310 CG LEU A 84 17.317 23.893 42.446 1.00 0.00 C ATOM 1311 CD1 LEU A 84 18.051 25.096 43.102 1.00 0.00 C ATOM 1312 CD2 LEU A 84 16.082 24.385 41.738 1.00 0.00 C ATOM 0 H LEU A 84 19.984 22.197 40.081 1.00 0.00 H new ATOM 0 HA LEU A 84 19.897 23.867 42.492 1.00 0.00 H new ATOM 0 HB2 LEU A 84 18.279 23.792 40.505 1.00 0.00 H new ATOM 0 HB3 LEU A 84 17.743 22.238 41.111 1.00 0.00 H new ATOM 0 HG LEU A 84 17.071 23.192 43.243 1.00 0.00 H new ATOM 0 HD11 LEU A 84 17.394 25.569 43.832 1.00 0.00 H new ATOM 0 HD12 LEU A 84 18.954 24.743 43.601 1.00 0.00 H new ATOM 0 HD13 LEU A 84 18.321 25.821 42.334 1.00 0.00 H new ATOM 0 HD21 LEU A 84 15.433 24.895 42.450 1.00 0.00 H new ATOM 0 HD22 LEU A 84 16.368 25.078 40.947 1.00 0.00 H new ATOM 0 HD23 LEU A 84 15.550 23.538 41.304 1.00 0.00 H new ATOM 1324 N ASP A 85 19.617 20.609 42.625 1.00 0.00 N ATOM 1325 CA ASP A 85 19.646 19.488 43.610 1.00 0.00 C ATOM 1326 C ASP A 85 20.866 19.691 44.511 1.00 0.00 C ATOM 1327 O ASP A 85 20.827 19.472 45.728 1.00 0.00 O ATOM 1328 CB ASP A 85 19.814 18.226 42.770 1.00 0.00 C ATOM 1329 CG ASP A 85 18.441 17.669 42.393 1.00 0.00 C ATOM 1330 OD1 ASP A 85 17.867 18.160 41.434 1.00 0.00 O ATOM 1331 OD2 ASP A 85 17.986 16.761 43.069 1.00 0.00 O ATOM 0 H ASP A 85 19.699 20.334 41.646 1.00 0.00 H new ATOM 0 HA ASP A 85 18.754 19.431 44.234 1.00 0.00 H new ATOM 0 HB2 ASP A 85 20.385 18.451 41.869 1.00 0.00 H new ATOM 0 HB3 ASP A 85 20.379 17.479 43.328 1.00 0.00 H new ATOM 1336 N LYS A 86 21.939 20.152 43.930 1.00 0.00 N ATOM 1337 CA LYS A 86 23.174 20.424 44.729 1.00 0.00 C ATOM 1338 C LYS A 86 22.871 21.455 45.836 1.00 0.00 C ATOM 1339 O LYS A 86 23.207 21.257 47.010 1.00 0.00 O ATOM 1340 CB LYS A 86 24.183 20.992 43.730 1.00 0.00 C ATOM 1341 CG LYS A 86 25.560 21.089 44.395 1.00 0.00 C ATOM 1342 CD LYS A 86 25.793 22.521 44.883 1.00 0.00 C ATOM 1343 CE LYS A 86 26.814 22.511 46.022 1.00 0.00 C ATOM 1344 NZ LYS A 86 26.025 22.177 47.240 1.00 0.00 N ATOM 0 H LYS A 86 22.017 20.354 42.933 1.00 0.00 H new ATOM 0 HA LYS A 86 23.553 19.528 45.220 1.00 0.00 H new ATOM 0 HB2 LYS A 86 24.237 20.353 42.848 1.00 0.00 H new ATOM 0 HB3 LYS A 86 23.861 21.977 43.391 1.00 0.00 H new ATOM 0 HG2 LYS A 86 25.621 20.394 45.232 1.00 0.00 H new ATOM 0 HG3 LYS A 86 26.338 20.804 43.687 1.00 0.00 H new ATOM 0 HD2 LYS A 86 26.153 23.142 44.063 1.00 0.00 H new ATOM 0 HD3 LYS A 86 24.855 22.957 45.225 1.00 0.00 H new ATOM 0 HE2 LYS A 86 27.597 21.774 45.844 1.00 0.00 H new ATOM 0 HE3 LYS A 86 27.304 23.479 46.122 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 26.591 21.566 47.863 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 25.778 23.052 47.744 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 25.155 21.679 46.964 1.00 0.00 H new ATOM 1358 N ILE A 87 22.238 22.551 45.495 1.00 0.00 N ATOM 1359 CA ILE A 87 21.918 23.590 46.543 1.00 0.00 C ATOM 1360 C ILE A 87 21.036 22.974 47.663 1.00 0.00 C ATOM 1361 O ILE A 87 21.251 23.213 48.848 1.00 0.00 O ATOM 1362 CB ILE A 87 21.207 24.752 45.824 1.00 0.00 C ATOM 1363 CG1 ILE A 87 21.692 24.863 44.366 1.00 0.00 C ATOM 1364 CG2 ILE A 87 21.557 26.050 46.560 1.00 0.00 C ATOM 1365 CD1 ILE A 87 21.370 26.251 43.798 1.00 0.00 C ATOM 0 H ILE A 87 21.929 22.776 44.549 1.00 0.00 H new ATOM 0 HA ILE A 87 22.822 23.955 47.029 1.00 0.00 H new ATOM 0 HB ILE A 87 20.131 24.576 45.823 1.00 0.00 H new ATOM 0 HG12 ILE A 87 22.766 24.684 44.319 1.00 0.00 H new ATOM 0 HG13 ILE A 87 21.214 24.095 43.758 1.00 0.00 H new ATOM 0 HG21 ILE A 87 21.065 26.890 46.070 1.00 0.00 H new ATOM 0 HG22 ILE A 87 21.219 25.984 47.594 1.00 0.00 H new ATOM 0 HG23 ILE A 87 22.636 26.200 46.540 1.00 0.00 H new ATOM 0 HD11 ILE A 87 21.719 26.312 42.767 1.00 0.00 H new ATOM 0 HD12 ILE A 87 20.293 26.415 43.826 1.00 0.00 H new ATOM 0 HD13 ILE A 87 21.869 27.014 44.396 1.00 0.00 H new ATOM 1377 N THR A 88 20.074 22.151 47.318 1.00 0.00 N ATOM 1378 CA THR A 88 19.236 21.485 48.368 1.00 0.00 C ATOM 1379 C THR A 88 20.186 20.799 49.358 1.00 0.00 C ATOM 1380 O THR A 88 20.038 20.895 50.575 1.00 0.00 O ATOM 1381 CB THR A 88 18.392 20.451 47.617 1.00 0.00 C ATOM 1382 OG1 THR A 88 17.882 21.034 46.426 1.00 0.00 O ATOM 1383 CG2 THR A 88 17.232 19.994 48.502 1.00 0.00 C ATOM 0 H THR A 88 19.833 21.911 46.356 1.00 0.00 H new ATOM 0 HA THR A 88 18.599 22.174 48.922 1.00 0.00 H new ATOM 0 HB THR A 88 19.012 19.591 47.364 1.00 0.00 H new ATOM 0 HG1 THR A 88 17.343 20.373 45.943 1.00 0.00 H new ATOM 0 HG21 THR A 88 16.633 19.258 47.965 1.00 0.00 H new ATOM 0 HG22 THR A 88 17.625 19.546 49.415 1.00 0.00 H new ATOM 0 HG23 THR A 88 16.610 20.852 48.758 1.00 0.00 H new ATOM 1391 N HIS A 89 21.208 20.153 48.850 1.00 0.00 N ATOM 1392 CA HIS A 89 22.208 19.530 49.762 1.00 0.00 C ATOM 1393 C HIS A 89 22.758 20.641 50.663 1.00 0.00 C ATOM 1394 O HIS A 89 22.937 20.465 51.866 1.00 0.00 O ATOM 1395 CB HIS A 89 23.304 18.969 48.854 1.00 0.00 C ATOM 1396 CG HIS A 89 24.121 17.968 49.621 1.00 0.00 C ATOM 1397 ND1 HIS A 89 25.478 18.138 49.847 1.00 0.00 N ATOM 1398 CD2 HIS A 89 23.788 16.779 50.221 1.00 0.00 C ATOM 1399 CE1 HIS A 89 25.907 17.079 50.557 1.00 0.00 C ATOM 1400 NE2 HIS A 89 24.917 16.220 50.812 1.00 0.00 N ATOM 0 H HIS A 89 21.389 20.033 47.853 1.00 0.00 H new ATOM 0 HA HIS A 89 21.797 18.740 50.391 1.00 0.00 H new ATOM 0 HB2 HIS A 89 22.860 18.498 47.977 1.00 0.00 H new ATOM 0 HB3 HIS A 89 23.942 19.776 48.493 1.00 0.00 H new ATOM 0 HD2 HIS A 89 22.800 16.344 50.233 1.00 0.00 H new ATOM 0 HE1 HIS A 89 26.928 16.940 50.881 1.00 0.00 H new ATOM 0 HE2 HIS A 89 24.976 15.343 51.329 1.00 0.00 H new ATOM 1408 N ALA A 90 22.976 21.812 50.094 1.00 0.00 N ATOM 1409 CA ALA A 90 23.453 22.971 50.912 1.00 0.00 C ATOM 1410 C ALA A 90 22.472 23.164 52.064 1.00 0.00 C ATOM 1411 O ALA A 90 22.848 23.503 53.181 1.00 0.00 O ATOM 1412 CB ALA A 90 23.429 24.205 49.984 1.00 0.00 C ATOM 0 H ALA A 90 22.843 22.009 49.102 1.00 0.00 H new ATOM 0 HA ALA A 90 24.454 22.816 51.314 1.00 0.00 H new ATOM 0 HB1 ALA A 90 23.770 25.081 50.535 1.00 0.00 H new ATOM 0 HB2 ALA A 90 24.088 24.033 49.133 1.00 0.00 H new ATOM 0 HB3 ALA A 90 22.413 24.373 49.628 1.00 0.00 H new ATOM 1418 N CYS A 91 21.212 22.918 51.812 1.00 0.00 N ATOM 1419 CA CYS A 91 20.189 23.060 52.893 1.00 0.00 C ATOM 1420 C CYS A 91 20.511 22.056 54.011 1.00 0.00 C ATOM 1421 O CYS A 91 20.739 22.421 55.172 1.00 0.00 O ATOM 1422 CB CYS A 91 18.850 22.706 52.211 1.00 0.00 C ATOM 1423 SG CYS A 91 17.668 22.006 53.402 1.00 0.00 S ATOM 0 H CYS A 91 20.847 22.625 50.906 1.00 0.00 H new ATOM 0 HA CYS A 91 20.162 24.055 53.338 1.00 0.00 H new ATOM 0 HB2 CYS A 91 18.424 23.600 51.755 1.00 0.00 H new ATOM 0 HB3 CYS A 91 19.026 21.991 51.407 1.00 0.00 H new ATOM 0 HG CYS A 91 16.615 22.766 53.466 1.00 0.00 H new ATOM 1429 N ARG A 92 20.545 20.793 53.672 1.00 0.00 N ATOM 1430 CA ARG A 92 20.858 19.738 54.685 1.00 0.00 C ATOM 1431 C ARG A 92 22.088 20.146 55.509 1.00 0.00 C ATOM 1432 O ARG A 92 22.062 20.174 56.737 1.00 0.00 O ATOM 1433 CB ARG A 92 21.160 18.487 53.855 1.00 0.00 C ATOM 1434 CG ARG A 92 20.769 17.234 54.642 1.00 0.00 C ATOM 1435 CD ARG A 92 19.463 16.662 54.080 1.00 0.00 C ATOM 1436 NE ARG A 92 19.764 16.317 52.659 1.00 0.00 N ATOM 1437 CZ ARG A 92 18.816 15.878 51.865 1.00 0.00 C ATOM 1438 NH1 ARG A 92 17.591 15.736 52.301 1.00 0.00 N ATOM 1439 NH2 ARG A 92 19.097 15.581 50.627 1.00 0.00 N ATOM 0 H ARG A 92 20.368 20.444 52.730 1.00 0.00 H new ATOM 0 HA ARG A 92 20.043 19.579 55.391 1.00 0.00 H new ATOM 0 HB2 ARG A 92 20.611 18.523 52.914 1.00 0.00 H new ATOM 0 HB3 ARG A 92 22.220 18.453 53.604 1.00 0.00 H new ATOM 0 HG2 ARG A 92 21.562 16.489 54.577 1.00 0.00 H new ATOM 0 HG3 ARG A 92 20.647 17.478 55.697 1.00 0.00 H new ATOM 0 HD2 ARG A 92 19.146 15.782 54.640 1.00 0.00 H new ATOM 0 HD3 ARG A 92 18.654 17.390 54.145 1.00 0.00 H new ATOM 0 HE ARG A 92 20.714 16.423 52.303 1.00 0.00 H new ATOM 0 HH11 ARG A 92 17.364 15.967 53.268 1.00 0.00 H new ATOM 0 HH12 ARG A 92 16.863 15.394 51.674 1.00 0.00 H new ATOM 0 HH21 ARG A 92 20.050 15.690 50.280 1.00 0.00 H new ATOM 0 HH22 ARG A 92 18.364 15.239 50.005 1.00 0.00 H new ATOM 1453 N LEU A 93 23.158 20.471 54.841 1.00 0.00 N ATOM 1454 CA LEU A 93 24.410 20.891 55.540 1.00 0.00 C ATOM 1455 C LEU A 93 24.158 22.081 56.479 1.00 0.00 C ATOM 1456 O LEU A 93 24.773 22.179 57.546 1.00 0.00 O ATOM 1457 CB LEU A 93 25.373 21.293 54.420 1.00 0.00 C ATOM 1458 CG LEU A 93 26.344 20.142 54.128 1.00 0.00 C ATOM 1459 CD1 LEU A 93 27.205 19.865 55.365 1.00 0.00 C ATOM 1460 CD2 LEU A 93 25.552 18.881 53.764 1.00 0.00 C ATOM 0 H LEU A 93 23.222 20.464 53.823 1.00 0.00 H new ATOM 0 HA LEU A 93 24.805 20.089 56.164 1.00 0.00 H new ATOM 0 HB2 LEU A 93 24.813 21.545 53.520 1.00 0.00 H new ATOM 0 HB3 LEU A 93 25.929 22.185 54.709 1.00 0.00 H new ATOM 0 HG LEU A 93 26.989 20.420 53.294 1.00 0.00 H new ATOM 0 HD11 LEU A 93 27.893 19.047 55.153 1.00 0.00 H new ATOM 0 HD12 LEU A 93 27.773 20.760 55.621 1.00 0.00 H new ATOM 0 HD13 LEU A 93 26.562 19.591 56.202 1.00 0.00 H new ATOM 0 HD21 LEU A 93 26.243 18.064 53.557 1.00 0.00 H new ATOM 0 HD22 LEU A 93 24.904 18.606 54.596 1.00 0.00 H new ATOM 0 HD23 LEU A 93 24.945 19.075 52.880 1.00 0.00 H new ATOM 1472 N LEU A 94 23.286 22.991 56.087 1.00 0.00 N ATOM 1473 CA LEU A 94 23.020 24.217 56.911 1.00 0.00 C ATOM 1474 C LEU A 94 22.313 23.828 58.207 1.00 0.00 C ATOM 1475 O LEU A 94 22.249 24.612 59.151 1.00 0.00 O ATOM 1476 CB LEU A 94 22.070 25.064 56.025 1.00 0.00 C ATOM 1477 CG LEU A 94 22.815 26.222 55.343 1.00 0.00 C ATOM 1478 CD1 LEU A 94 23.781 25.676 54.289 1.00 0.00 C ATOM 1479 CD2 LEU A 94 21.795 27.130 54.642 1.00 0.00 C ATOM 0 H LEU A 94 22.745 22.933 55.224 1.00 0.00 H new ATOM 0 HA LEU A 94 23.930 24.749 57.186 1.00 0.00 H new ATOM 0 HB2 LEU A 94 21.614 24.427 55.267 1.00 0.00 H new ATOM 0 HB3 LEU A 94 21.260 25.462 56.636 1.00 0.00 H new ATOM 0 HG LEU A 94 23.372 26.779 56.097 1.00 0.00 H new ATOM 0 HD11 LEU A 94 24.304 26.504 53.811 1.00 0.00 H new ATOM 0 HD12 LEU A 94 24.505 25.016 54.766 1.00 0.00 H new ATOM 0 HD13 LEU A 94 23.222 25.118 53.538 1.00 0.00 H new ATOM 0 HD21 LEU A 94 22.316 27.955 54.155 1.00 0.00 H new ATOM 0 HD22 LEU A 94 21.249 26.554 53.895 1.00 0.00 H new ATOM 0 HD23 LEU A 94 21.095 27.527 55.377 1.00 0.00 H new ATOM 1491 N GLU A 95 21.862 22.609 58.309 1.00 0.00 N ATOM 1492 CA GLU A 95 21.257 22.155 59.599 1.00 0.00 C ATOM 1493 C GLU A 95 21.855 20.800 59.978 1.00 0.00 C ATOM 1494 O GLU A 95 21.463 20.184 60.967 1.00 0.00 O ATOM 1495 CB GLU A 95 19.749 22.036 59.380 1.00 0.00 C ATOM 1496 CG GLU A 95 19.021 21.927 60.732 1.00 0.00 C ATOM 1497 CD GLU A 95 19.551 22.972 61.722 1.00 0.00 C ATOM 1498 OE1 GLU A 95 19.999 24.014 61.275 1.00 0.00 O ATOM 1499 OE2 GLU A 95 19.500 22.708 62.912 1.00 0.00 O ATOM 0 H GLU A 95 21.884 21.911 57.565 1.00 0.00 H new ATOM 0 HA GLU A 95 21.460 22.859 60.406 1.00 0.00 H new ATOM 0 HB2 GLU A 95 19.384 22.905 58.832 1.00 0.00 H new ATOM 0 HB3 GLU A 95 19.531 21.159 58.770 1.00 0.00 H new ATOM 0 HG2 GLU A 95 17.950 22.068 60.586 1.00 0.00 H new ATOM 0 HG3 GLU A 95 19.157 20.927 61.144 1.00 0.00 H new ATOM 1506 N GLN A 96 22.810 20.329 59.214 1.00 0.00 N ATOM 1507 CA GLN A 96 23.443 19.026 59.532 1.00 0.00 C ATOM 1508 C GLN A 96 24.630 19.244 60.467 1.00 0.00 C ATOM 1509 O GLN A 96 24.670 18.695 61.567 1.00 0.00 O ATOM 1510 CB GLN A 96 23.912 18.457 58.191 1.00 0.00 C ATOM 1511 CG GLN A 96 24.418 17.025 58.389 1.00 0.00 C ATOM 1512 CD GLN A 96 25.948 17.016 58.397 1.00 0.00 C ATOM 1513 OE1 GLN A 96 26.578 18.019 58.720 1.00 0.00 O ATOM 1514 NE2 GLN A 96 26.584 15.929 58.055 1.00 0.00 N ATOM 0 H GLN A 96 23.174 20.797 58.384 1.00 0.00 H new ATOM 0 HA GLN A 96 22.755 18.346 60.033 1.00 0.00 H new ATOM 0 HB2 GLN A 96 23.092 18.468 57.473 1.00 0.00 H new ATOM 0 HB3 GLN A 96 24.705 19.080 57.778 1.00 0.00 H new ATOM 0 HG2 GLN A 96 24.037 16.621 59.327 1.00 0.00 H new ATOM 0 HG3 GLN A 96 24.045 16.383 57.591 1.00 0.00 H new ATOM 0 HE21 GLN A 96 26.061 15.095 57.787 1.00 0.00 H new ATOM 0 HE22 GLN A 96 27.604 15.913 58.056 1.00 0.00 H new ATOM 1523 N GLU A 97 25.603 20.033 60.071 1.00 0.00 N ATOM 1524 CA GLU A 97 26.763 20.247 60.995 1.00 0.00 C ATOM 1525 C GLU A 97 26.479 21.418 61.949 1.00 0.00 C ATOM 1526 O GLU A 97 25.327 21.774 62.193 1.00 0.00 O ATOM 1527 CB GLU A 97 27.979 20.503 60.076 1.00 0.00 C ATOM 1528 CG GLU A 97 28.154 21.995 59.740 1.00 0.00 C ATOM 1529 CD GLU A 97 26.922 22.521 59.011 1.00 0.00 C ATOM 1530 OE1 GLU A 97 25.880 22.616 59.637 1.00 0.00 O ATOM 1531 OE2 GLU A 97 27.045 22.828 57.837 1.00 0.00 O ATOM 0 H GLU A 97 25.646 20.523 59.178 1.00 0.00 H new ATOM 0 HA GLU A 97 26.951 19.389 61.641 1.00 0.00 H new ATOM 0 HB2 GLU A 97 28.882 20.134 60.561 1.00 0.00 H new ATOM 0 HB3 GLU A 97 27.859 19.937 59.152 1.00 0.00 H new ATOM 0 HG2 GLU A 97 28.314 22.565 60.655 1.00 0.00 H new ATOM 0 HG3 GLU A 97 29.039 22.134 59.119 1.00 0.00 H new ATOM 1538 N THR A 98 27.503 22.039 62.465 1.00 0.00 N ATOM 1539 CA THR A 98 27.295 23.206 63.369 1.00 0.00 C ATOM 1540 C THR A 98 27.635 24.497 62.599 1.00 0.00 C ATOM 1541 O THR A 98 26.757 25.326 62.370 1.00 0.00 O ATOM 1542 CB THR A 98 28.229 22.968 64.568 1.00 0.00 C ATOM 1543 OG1 THR A 98 27.615 22.043 65.457 1.00 0.00 O ATOM 1544 CG2 THR A 98 28.490 24.282 65.308 1.00 0.00 C ATOM 0 H THR A 98 28.478 21.788 62.299 1.00 0.00 H new ATOM 0 HA THR A 98 26.267 23.312 63.716 1.00 0.00 H new ATOM 0 HB THR A 98 29.178 22.571 64.208 1.00 0.00 H new ATOM 0 HG1 THR A 98 28.205 21.885 66.223 1.00 0.00 H new ATOM 0 HG21 THR A 98 29.152 24.098 66.154 1.00 0.00 H new ATOM 0 HG22 THR A 98 28.958 24.995 64.629 1.00 0.00 H new ATOM 0 HG23 THR A 98 27.546 24.690 65.669 1.00 0.00 H new ATOM 1552 N PRO A 99 28.863 24.616 62.139 1.00 0.00 N ATOM 1553 CA PRO A 99 29.244 25.786 61.294 1.00 0.00 C ATOM 1554 C PRO A 99 28.475 25.693 59.962 1.00 0.00 C ATOM 1555 O PRO A 99 28.303 24.606 59.431 1.00 0.00 O ATOM 1556 CB PRO A 99 30.750 25.619 61.098 1.00 0.00 C ATOM 1557 CG PRO A 99 30.996 24.162 61.300 1.00 0.00 C ATOM 1558 CD PRO A 99 30.001 23.706 62.335 1.00 0.00 C ATOM 0 HA PRO A 99 29.008 26.757 61.729 1.00 0.00 H new ATOM 0 HB2 PRO A 99 31.058 25.939 60.103 1.00 0.00 H new ATOM 0 HB3 PRO A 99 31.312 26.219 61.814 1.00 0.00 H new ATOM 0 HG2 PRO A 99 30.867 23.613 60.367 1.00 0.00 H new ATOM 0 HG3 PRO A 99 32.017 23.983 61.637 1.00 0.00 H new ATOM 0 HD2 PRO A 99 29.714 22.665 62.185 1.00 0.00 H new ATOM 0 HD3 PRO A 99 30.407 23.782 63.344 1.00 0.00 H new ATOM 1566 N VAL A 100 27.992 26.777 59.409 1.00 0.00 N ATOM 1567 CA VAL A 100 27.219 26.657 58.121 1.00 0.00 C ATOM 1568 C VAL A 100 28.172 26.477 56.930 1.00 0.00 C ATOM 1569 O VAL A 100 29.330 26.886 56.978 1.00 0.00 O ATOM 1570 CB VAL A 100 26.450 27.971 57.983 1.00 0.00 C ATOM 1571 CG1 VAL A 100 25.483 27.872 56.801 1.00 0.00 C ATOM 1572 CG2 VAL A 100 25.658 28.245 59.265 1.00 0.00 C ATOM 0 H VAL A 100 28.092 27.723 59.778 1.00 0.00 H new ATOM 0 HA VAL A 100 26.556 25.792 58.133 1.00 0.00 H new ATOM 0 HB VAL A 100 27.155 28.785 57.814 1.00 0.00 H new ATOM 0 HG11 VAL A 100 24.934 28.808 56.701 1.00 0.00 H new ATOM 0 HG12 VAL A 100 26.045 27.681 55.886 1.00 0.00 H new ATOM 0 HG13 VAL A 100 24.781 27.056 56.973 1.00 0.00 H new ATOM 0 HG21 VAL A 100 25.112 29.183 59.162 1.00 0.00 H new ATOM 0 HG22 VAL A 100 24.953 27.432 59.438 1.00 0.00 H new ATOM 0 HG23 VAL A 100 26.345 28.316 60.109 1.00 0.00 H new ATOM 1582 N THR A 101 27.715 25.838 55.871 1.00 0.00 N ATOM 1583 CA THR A 101 28.619 25.604 54.704 1.00 0.00 C ATOM 1584 C THR A 101 27.959 25.936 53.352 1.00 0.00 C ATOM 1585 O THR A 101 27.220 25.144 52.773 1.00 0.00 O ATOM 1586 CB THR A 101 28.945 24.119 54.746 1.00 0.00 C ATOM 1587 OG1 THR A 101 28.194 23.481 55.770 1.00 0.00 O ATOM 1588 CG2 THR A 101 30.430 23.940 55.032 1.00 0.00 C ATOM 0 H THR A 101 26.767 25.475 55.770 1.00 0.00 H new ATOM 0 HA THR A 101 29.494 26.250 54.778 1.00 0.00 H new ATOM 0 HB THR A 101 28.691 23.672 53.785 1.00 0.00 H new ATOM 0 HG1 THR A 101 28.586 23.693 56.643 1.00 0.00 H new ATOM 0 HG21 THR A 101 30.669 22.877 55.063 1.00 0.00 H new ATOM 0 HG22 THR A 101 31.012 24.420 54.246 1.00 0.00 H new ATOM 0 HG23 THR A 101 30.673 24.395 55.992 1.00 0.00 H new ATOM 1596 N LEU A 102 28.269 27.084 52.846 1.00 0.00 N ATOM 1597 CA LEU A 102 27.773 27.541 51.550 1.00 0.00 C ATOM 1598 C LEU A 102 28.994 28.028 50.783 1.00 0.00 C ATOM 1599 O LEU A 102 28.935 28.305 49.591 1.00 0.00 O ATOM 1600 CB LEU A 102 26.808 28.684 51.871 1.00 0.00 C ATOM 1601 CG LEU A 102 25.417 28.369 51.304 1.00 0.00 C ATOM 1602 CD1 LEU A 102 24.937 27.009 51.821 1.00 0.00 C ATOM 1603 CD2 LEU A 102 24.433 29.457 51.744 1.00 0.00 C ATOM 0 H LEU A 102 28.881 27.754 53.312 1.00 0.00 H new ATOM 0 HA LEU A 102 27.261 26.785 50.955 1.00 0.00 H new ATOM 0 HB2 LEU A 102 26.746 28.827 52.950 1.00 0.00 H new ATOM 0 HB3 LEU A 102 27.181 29.616 51.446 1.00 0.00 H new ATOM 0 HG LEU A 102 25.471 28.338 50.216 1.00 0.00 H new ATOM 0 HD11 LEU A 102 23.949 26.793 51.414 1.00 0.00 H new ATOM 0 HD12 LEU A 102 25.636 26.233 51.508 1.00 0.00 H new ATOM 0 HD13 LEU A 102 24.884 27.032 52.909 1.00 0.00 H new ATOM 0 HD21 LEU A 102 23.444 29.237 51.343 1.00 0.00 H new ATOM 0 HD22 LEU A 102 24.385 29.486 52.833 1.00 0.00 H new ATOM 0 HD23 LEU A 102 24.769 30.424 51.370 1.00 0.00 H new ATOM 1615 N GLU A 103 30.129 28.106 51.465 1.00 0.00 N ATOM 1616 CA GLU A 103 31.404 28.535 50.830 1.00 0.00 C ATOM 1617 C GLU A 103 31.571 27.933 49.434 1.00 0.00 C ATOM 1618 O GLU A 103 31.958 28.628 48.498 1.00 0.00 O ATOM 1619 CB GLU A 103 32.502 28.023 51.764 1.00 0.00 C ATOM 1620 CG GLU A 103 33.818 28.730 51.440 1.00 0.00 C ATOM 1621 CD GLU A 103 33.756 30.177 51.931 1.00 0.00 C ATOM 1622 OE1 GLU A 103 33.800 30.376 53.134 1.00 0.00 O ATOM 1623 OE2 GLU A 103 33.665 31.062 51.096 1.00 0.00 O ATOM 0 H GLU A 103 30.210 27.882 52.457 1.00 0.00 H new ATOM 0 HA GLU A 103 31.436 29.616 50.697 1.00 0.00 H new ATOM 0 HB2 GLU A 103 32.225 28.205 52.802 1.00 0.00 H new ATOM 0 HB3 GLU A 103 32.618 26.945 51.650 1.00 0.00 H new ATOM 0 HG2 GLU A 103 34.649 28.209 51.915 1.00 0.00 H new ATOM 0 HG3 GLU A 103 34.000 28.707 50.366 1.00 0.00 H new ATOM 1630 N ALA A 104 31.309 26.655 49.261 1.00 0.00 N ATOM 1631 CA ALA A 104 31.492 26.061 47.901 1.00 0.00 C ATOM 1632 C ALA A 104 30.443 26.667 46.967 1.00 0.00 C ATOM 1633 O ALA A 104 30.710 26.979 45.808 1.00 0.00 O ATOM 1634 CB ALA A 104 31.262 24.560 48.080 1.00 0.00 C ATOM 0 H ALA A 104 30.984 26.014 49.985 1.00 0.00 H new ATOM 0 HA ALA A 104 32.476 26.254 47.474 1.00 0.00 H new ATOM 0 HB1 ALA A 104 31.380 24.057 47.120 1.00 0.00 H new ATOM 0 HB2 ALA A 104 31.988 24.163 48.790 1.00 0.00 H new ATOM 0 HB3 ALA A 104 30.254 24.389 48.458 1.00 0.00 H new ATOM 1640 N LEU A 105 29.254 26.862 47.476 1.00 0.00 N ATOM 1641 CA LEU A 105 28.169 27.474 46.660 1.00 0.00 C ATOM 1642 C LEU A 105 28.536 28.927 46.333 1.00 0.00 C ATOM 1643 O LEU A 105 28.620 29.315 45.170 1.00 0.00 O ATOM 1644 CB LEU A 105 26.916 27.412 47.546 1.00 0.00 C ATOM 1645 CG LEU A 105 25.645 27.625 46.705 1.00 0.00 C ATOM 1646 CD1 LEU A 105 25.672 29.008 46.055 1.00 0.00 C ATOM 1647 CD2 LEU A 105 25.556 26.559 45.608 1.00 0.00 C ATOM 0 H LEU A 105 28.988 26.620 48.431 1.00 0.00 H new ATOM 0 HA LEU A 105 28.011 26.959 45.713 1.00 0.00 H new ATOM 0 HB2 LEU A 105 26.868 26.446 48.049 1.00 0.00 H new ATOM 0 HB3 LEU A 105 26.976 28.174 48.323 1.00 0.00 H new ATOM 0 HG LEU A 105 24.778 27.547 47.361 1.00 0.00 H new ATOM 0 HD11 LEU A 105 24.768 29.149 45.462 1.00 0.00 H new ATOM 0 HD12 LEU A 105 25.721 29.773 46.830 1.00 0.00 H new ATOM 0 HD13 LEU A 105 26.546 29.089 45.409 1.00 0.00 H new ATOM 0 HD21 LEU A 105 24.653 26.718 45.018 1.00 0.00 H new ATOM 0 HD22 LEU A 105 26.430 26.630 44.960 1.00 0.00 H new ATOM 0 HD23 LEU A 105 25.522 25.570 46.064 1.00 0.00 H new ATOM 1659 N ALA A 106 28.763 29.738 47.338 1.00 0.00 N ATOM 1660 CA ALA A 106 29.129 31.166 47.088 1.00 0.00 C ATOM 1661 C ALA A 106 30.351 31.246 46.168 1.00 0.00 C ATOM 1662 O ALA A 106 30.446 32.127 45.308 1.00 0.00 O ATOM 1663 CB ALA A 106 29.456 31.739 48.467 1.00 0.00 C ATOM 0 H ALA A 106 28.710 29.472 48.321 1.00 0.00 H new ATOM 0 HA ALA A 106 28.327 31.718 46.598 1.00 0.00 H new ATOM 0 HB1 ALA A 106 29.735 32.788 48.368 1.00 0.00 H new ATOM 0 HB2 ALA A 106 28.582 31.655 49.112 1.00 0.00 H new ATOM 0 HB3 ALA A 106 30.285 31.183 48.905 1.00 0.00 H new ATOM 1669 N ASP A 107 31.279 30.333 46.326 1.00 0.00 N ATOM 1670 CA ASP A 107 32.485 30.325 45.465 1.00 0.00 C ATOM 1671 C ASP A 107 32.079 30.027 44.016 1.00 0.00 C ATOM 1672 O ASP A 107 32.620 30.593 43.069 1.00 0.00 O ATOM 1673 CB ASP A 107 33.334 29.197 46.040 1.00 0.00 C ATOM 1674 CG ASP A 107 34.265 29.755 47.118 1.00 0.00 C ATOM 1675 OD1 ASP A 107 33.763 30.371 48.045 1.00 0.00 O ATOM 1676 OD2 ASP A 107 35.463 29.556 47.001 1.00 0.00 O ATOM 0 H ASP A 107 31.245 29.590 47.023 1.00 0.00 H new ATOM 0 HA ASP A 107 33.019 31.275 45.451 1.00 0.00 H new ATOM 0 HB2 ASP A 107 32.692 28.425 46.464 1.00 0.00 H new ATOM 0 HB3 ASP A 107 33.918 28.727 45.248 1.00 0.00 H new ATOM 1681 N GLN A 108 31.125 29.150 43.837 1.00 0.00 N ATOM 1682 CA GLN A 108 30.661 28.806 42.463 1.00 0.00 C ATOM 1683 C GLN A 108 29.941 30.002 41.838 1.00 0.00 C ATOM 1684 O GLN A 108 30.193 30.366 40.690 1.00 0.00 O ATOM 1685 CB GLN A 108 29.692 27.636 42.653 1.00 0.00 C ATOM 1686 CG GLN A 108 29.200 27.147 41.288 1.00 0.00 C ATOM 1687 CD GLN A 108 27.743 27.570 41.087 1.00 0.00 C ATOM 1688 OE1 GLN A 108 27.468 28.578 40.439 1.00 0.00 O ATOM 1689 NE2 GLN A 108 26.789 26.850 41.610 1.00 0.00 N ATOM 0 H GLN A 108 30.646 28.655 44.589 1.00 0.00 H new ATOM 0 HA GLN A 108 31.486 28.547 41.799 1.00 0.00 H new ATOM 0 HB2 GLN A 108 30.187 26.823 43.184 1.00 0.00 H new ATOM 0 HB3 GLN A 108 28.846 27.948 43.265 1.00 0.00 H new ATOM 0 HG2 GLN A 108 29.823 27.562 40.495 1.00 0.00 H new ATOM 0 HG3 GLN A 108 29.286 26.062 41.226 1.00 0.00 H new ATOM 0 HE21 GLN A 108 27.017 26.014 42.148 1.00 0.00 H new ATOM 0 HE22 GLN A 108 25.815 27.123 41.481 1.00 0.00 H new ATOM 1698 N VAL A 109 29.057 30.630 42.569 1.00 0.00 N ATOM 1699 CA VAL A 109 28.336 31.813 42.004 1.00 0.00 C ATOM 1700 C VAL A 109 29.301 33.003 41.938 1.00 0.00 C ATOM 1701 O VAL A 109 29.111 33.934 41.159 1.00 0.00 O ATOM 1702 CB VAL A 109 27.164 32.111 42.950 1.00 0.00 C ATOM 1703 CG1 VAL A 109 26.081 32.862 42.176 1.00 0.00 C ATOM 1704 CG2 VAL A 109 26.568 30.806 43.492 1.00 0.00 C ATOM 0 H VAL A 109 28.804 30.379 43.525 1.00 0.00 H new ATOM 0 HA VAL A 109 27.967 31.623 40.996 1.00 0.00 H new ATOM 0 HB VAL A 109 27.526 32.712 43.784 1.00 0.00 H new ATOM 0 HG11 VAL A 109 25.244 33.079 42.839 1.00 0.00 H new ATOM 0 HG12 VAL A 109 26.490 33.796 41.791 1.00 0.00 H new ATOM 0 HG13 VAL A 109 25.736 32.248 41.345 1.00 0.00 H new ATOM 0 HG21 VAL A 109 25.738 31.035 44.161 1.00 0.00 H new ATOM 0 HG22 VAL A 109 26.208 30.198 42.662 1.00 0.00 H new ATOM 0 HG23 VAL A 109 27.334 30.256 44.039 1.00 0.00 H new ATOM 1714 N ALA A 110 30.349 32.966 42.733 1.00 0.00 N ATOM 1715 CA ALA A 110 31.384 34.055 42.738 1.00 0.00 C ATOM 1716 C ALA A 110 30.923 35.274 43.543 1.00 0.00 C ATOM 1717 O ALA A 110 31.343 36.397 43.271 1.00 0.00 O ATOM 1718 CB ALA A 110 31.617 34.433 41.270 1.00 0.00 C ATOM 0 H ALA A 110 30.534 32.210 43.392 1.00 0.00 H new ATOM 0 HA ALA A 110 32.301 33.708 43.214 1.00 0.00 H new ATOM 0 HB1 ALA A 110 32.364 35.225 41.212 1.00 0.00 H new ATOM 0 HB2 ALA A 110 31.970 33.560 40.721 1.00 0.00 H new ATOM 0 HB3 ALA A 110 30.683 34.783 40.832 1.00 0.00 H new ATOM 1724 N MET A 111 30.084 35.095 44.532 1.00 0.00 N ATOM 1725 CA MET A 111 29.644 36.284 45.326 1.00 0.00 C ATOM 1726 C MET A 111 29.542 35.970 46.825 1.00 0.00 C ATOM 1727 O MET A 111 29.916 34.895 47.288 1.00 0.00 O ATOM 1728 CB MET A 111 28.287 36.688 44.749 1.00 0.00 C ATOM 1729 CG MET A 111 27.258 35.581 44.974 1.00 0.00 C ATOM 1730 SD MET A 111 26.034 35.588 43.631 1.00 0.00 S ATOM 1731 CE MET A 111 26.030 37.364 43.268 1.00 0.00 C ATOM 0 H MET A 111 29.692 34.199 44.820 1.00 0.00 H new ATOM 0 HA MET A 111 30.370 37.093 45.251 1.00 0.00 H new ATOM 0 HB2 MET A 111 27.946 37.611 45.219 1.00 0.00 H new ATOM 0 HB3 MET A 111 28.385 36.890 43.682 1.00 0.00 H new ATOM 0 HG2 MET A 111 27.757 34.613 45.017 1.00 0.00 H new ATOM 0 HG3 MET A 111 26.759 35.726 45.932 1.00 0.00 H new ATOM 0 HE1 MET A 111 25.140 37.616 42.691 1.00 0.00 H new ATOM 0 HE2 MET A 111 26.028 37.926 44.202 1.00 0.00 H new ATOM 0 HE3 MET A 111 26.919 37.620 42.692 1.00 0.00 H new ATOM 1741 N SER A 112 29.047 36.912 47.586 1.00 0.00 N ATOM 1742 CA SER A 112 28.910 36.724 49.065 1.00 0.00 C ATOM 1743 C SER A 112 27.827 35.683 49.384 1.00 0.00 C ATOM 1744 O SER A 112 27.091 35.252 48.499 1.00 0.00 O ATOM 1745 CB SER A 112 28.518 38.105 49.605 1.00 0.00 C ATOM 1746 OG SER A 112 27.332 38.000 50.385 1.00 0.00 O ATOM 0 H SER A 112 28.727 37.817 47.242 1.00 0.00 H new ATOM 0 HA SER A 112 29.830 36.355 49.518 1.00 0.00 H new ATOM 0 HB2 SER A 112 29.328 38.512 50.211 1.00 0.00 H new ATOM 0 HB3 SER A 112 28.360 38.797 48.778 1.00 0.00 H new ATOM 0 HG SER A 112 27.462 38.457 51.242 1.00 0.00 H new ATOM 1752 N PRO A 113 27.762 35.304 50.640 1.00 0.00 N ATOM 1753 CA PRO A 113 26.762 34.300 51.084 1.00 0.00 C ATOM 1754 C PRO A 113 25.346 34.849 50.919 1.00 0.00 C ATOM 1755 O PRO A 113 24.404 34.098 50.652 1.00 0.00 O ATOM 1756 CB PRO A 113 27.112 34.068 52.554 1.00 0.00 C ATOM 1757 CG PRO A 113 27.829 35.309 52.970 1.00 0.00 C ATOM 1758 CD PRO A 113 28.589 35.778 51.758 1.00 0.00 C ATOM 0 HA PRO A 113 26.788 33.377 50.505 1.00 0.00 H new ATOM 0 HB2 PRO A 113 26.216 33.907 53.154 1.00 0.00 H new ATOM 0 HB3 PRO A 113 27.741 33.186 52.678 1.00 0.00 H new ATOM 0 HG2 PRO A 113 27.126 36.070 53.308 1.00 0.00 H new ATOM 0 HG3 PRO A 113 28.506 35.108 53.801 1.00 0.00 H new ATOM 0 HD2 PRO A 113 28.699 36.862 51.746 1.00 0.00 H new ATOM 0 HD3 PRO A 113 29.593 35.355 51.724 1.00 0.00 H new ATOM 1766 N PHE A 114 25.169 36.142 51.024 1.00 0.00 N ATOM 1767 CA PHE A 114 23.803 36.689 50.832 1.00 0.00 C ATOM 1768 C PHE A 114 23.381 36.556 49.378 1.00 0.00 C ATOM 1769 O PHE A 114 22.285 36.063 49.101 1.00 0.00 O ATOM 1770 CB PHE A 114 23.825 38.160 51.255 1.00 0.00 C ATOM 1771 CG PHE A 114 23.948 38.292 52.760 1.00 0.00 C ATOM 1772 CD1 PHE A 114 24.139 37.166 53.570 1.00 0.00 C ATOM 1773 CD2 PHE A 114 23.843 39.557 53.345 1.00 0.00 C ATOM 1774 CE1 PHE A 114 24.228 37.307 54.959 1.00 0.00 C ATOM 1775 CE2 PHE A 114 23.933 39.700 54.734 1.00 0.00 C ATOM 1776 CZ PHE A 114 24.128 38.575 55.542 1.00 0.00 C ATOM 0 H PHE A 114 25.898 36.826 51.230 1.00 0.00 H new ATOM 0 HA PHE A 114 23.083 36.136 51.435 1.00 0.00 H new ATOM 0 HB2 PHE A 114 24.660 38.668 50.773 1.00 0.00 H new ATOM 0 HB3 PHE A 114 22.914 38.653 50.917 1.00 0.00 H new ATOM 0 HD1 PHE A 114 24.218 36.187 53.122 1.00 0.00 H new ATOM 0 HD2 PHE A 114 23.692 40.427 52.723 1.00 0.00 H new ATOM 0 HE1 PHE A 114 24.374 36.437 55.582 1.00 0.00 H new ATOM 0 HE2 PHE A 114 23.852 40.679 55.182 1.00 0.00 H new ATOM 0 HZ PHE A 114 24.201 38.685 56.614 1.00 0.00 H new ATOM 1786 N HIS A 115 24.173 36.972 48.419 1.00 0.00 N ATOM 1787 CA HIS A 115 23.656 36.808 47.052 1.00 0.00 C ATOM 1788 C HIS A 115 23.646 35.308 46.649 1.00 0.00 C ATOM 1789 O HIS A 115 22.877 34.904 45.778 1.00 0.00 O ATOM 1790 CB HIS A 115 24.411 37.680 46.069 1.00 0.00 C ATOM 1791 CG HIS A 115 23.366 38.031 45.040 1.00 0.00 C ATOM 1792 ND1 HIS A 115 22.500 39.090 45.269 1.00 0.00 N ATOM 1793 CD2 HIS A 115 22.881 37.387 43.927 1.00 0.00 C ATOM 1794 CE1 HIS A 115 21.538 39.046 44.335 1.00 0.00 C ATOM 1795 NE2 HIS A 115 21.714 38.030 43.487 1.00 0.00 N ATOM 0 H HIS A 115 25.097 37.391 48.523 1.00 0.00 H new ATOM 0 HA HIS A 115 22.621 37.150 47.026 1.00 0.00 H new ATOM 0 HB2 HIS A 115 24.816 38.570 46.550 1.00 0.00 H new ATOM 0 HB3 HIS A 115 25.251 37.148 45.623 1.00 0.00 H new ATOM 0 HD2 HIS A 115 23.329 36.521 43.463 1.00 0.00 H new ATOM 0 HE1 HIS A 115 20.719 39.748 44.276 1.00 0.00 H new ATOM 0 HE2 HIS A 115 21.128 37.776 42.692 1.00 0.00 H new ATOM 1803 N LEU A 116 24.420 34.459 47.304 1.00 0.00 N ATOM 1804 CA LEU A 116 24.355 32.996 46.979 1.00 0.00 C ATOM 1805 C LEU A 116 22.957 32.523 47.382 1.00 0.00 C ATOM 1806 O LEU A 116 22.317 31.740 46.685 1.00 0.00 O ATOM 1807 CB LEU A 116 25.485 32.332 47.796 1.00 0.00 C ATOM 1808 CG LEU A 116 24.938 31.511 48.976 1.00 0.00 C ATOM 1809 CD1 LEU A 116 24.255 30.233 48.463 1.00 0.00 C ATOM 1810 CD2 LEU A 116 26.102 31.130 49.898 1.00 0.00 C ATOM 0 H LEU A 116 25.082 34.716 48.037 1.00 0.00 H new ATOM 0 HA LEU A 116 24.500 32.750 45.927 1.00 0.00 H new ATOM 0 HB2 LEU A 116 26.071 31.684 47.144 1.00 0.00 H new ATOM 0 HB3 LEU A 116 26.160 33.101 48.172 1.00 0.00 H new ATOM 0 HG LEU A 116 24.206 32.107 49.521 1.00 0.00 H new ATOM 0 HD11 LEU A 116 23.872 29.661 49.308 1.00 0.00 H new ATOM 0 HD12 LEU A 116 23.430 30.501 47.803 1.00 0.00 H new ATOM 0 HD13 LEU A 116 24.978 29.630 47.914 1.00 0.00 H new ATOM 0 HD21 LEU A 116 25.725 30.547 50.738 1.00 0.00 H new ATOM 0 HD22 LEU A 116 26.828 30.537 49.342 1.00 0.00 H new ATOM 0 HD23 LEU A 116 26.582 32.035 50.270 1.00 0.00 H new ATOM 1822 N HIS A 117 22.447 33.050 48.466 1.00 0.00 N ATOM 1823 CA HIS A 117 21.060 32.709 48.884 1.00 0.00 C ATOM 1824 C HIS A 117 20.101 33.214 47.784 1.00 0.00 C ATOM 1825 O HIS A 117 19.179 32.518 47.352 1.00 0.00 O ATOM 1826 CB HIS A 117 20.854 33.463 50.190 1.00 0.00 C ATOM 1827 CG HIS A 117 21.684 32.824 51.270 1.00 0.00 C ATOM 1828 ND1 HIS A 117 22.490 33.565 52.120 1.00 0.00 N ATOM 1829 CD2 HIS A 117 21.845 31.517 51.650 1.00 0.00 C ATOM 1830 CE1 HIS A 117 23.091 32.706 52.960 1.00 0.00 C ATOM 1831 NE2 HIS A 117 22.732 31.445 52.718 1.00 0.00 N ATOM 0 H HIS A 117 22.935 33.703 49.079 1.00 0.00 H new ATOM 0 HA HIS A 117 20.882 31.642 49.021 1.00 0.00 H new ATOM 0 HB2 HIS A 117 21.138 34.508 50.068 1.00 0.00 H new ATOM 0 HB3 HIS A 117 19.800 33.449 50.469 1.00 0.00 H new ATOM 0 HD1 HIS A 117 22.606 34.578 52.110 1.00 0.00 H new ATOM 0 HD2 HIS A 117 21.357 30.671 51.189 1.00 0.00 H new ATOM 0 HE1 HIS A 117 23.781 33.001 53.737 1.00 0.00 H new ATOM 1839 N ARG A 118 20.357 34.406 47.282 1.00 0.00 N ATOM 1840 CA ARG A 118 19.532 34.982 46.162 1.00 0.00 C ATOM 1841 C ARG A 118 19.600 34.050 44.931 1.00 0.00 C ATOM 1842 O ARG A 118 18.618 33.879 44.211 1.00 0.00 O ATOM 1843 CB ARG A 118 20.167 36.337 45.849 1.00 0.00 C ATOM 1844 CG ARG A 118 19.220 37.453 46.295 1.00 0.00 C ATOM 1845 CD ARG A 118 18.156 37.676 45.220 1.00 0.00 C ATOM 1846 NE ARG A 118 16.853 37.686 45.950 1.00 0.00 N ATOM 1847 CZ ARG A 118 15.731 37.413 45.319 1.00 0.00 C ATOM 1848 NH1 ARG A 118 15.734 37.126 44.043 1.00 0.00 N ATOM 1849 NH2 ARG A 118 14.601 37.428 45.972 1.00 0.00 N ATOM 0 H ARG A 118 21.112 35.011 47.605 1.00 0.00 H new ATOM 0 HA ARG A 118 18.481 35.086 46.431 1.00 0.00 H new ATOM 0 HB2 ARG A 118 21.124 36.430 46.361 1.00 0.00 H new ATOM 0 HB3 ARG A 118 20.368 36.420 44.781 1.00 0.00 H new ATOM 0 HG2 ARG A 118 18.747 37.188 47.241 1.00 0.00 H new ATOM 0 HG3 ARG A 118 19.779 38.373 46.465 1.00 0.00 H new ATOM 0 HD2 ARG A 118 18.319 38.617 44.694 1.00 0.00 H new ATOM 0 HD3 ARG A 118 18.181 36.884 44.472 1.00 0.00 H new ATOM 0 HE ARG A 118 16.833 37.906 46.946 1.00 0.00 H new ATOM 0 HH11 ARG A 118 16.613 37.112 43.525 1.00 0.00 H new ATOM 0 HH12 ARG A 118 14.857 36.916 43.565 1.00 0.00 H new ATOM 0 HH21 ARG A 118 14.590 37.651 46.967 1.00 0.00 H new ATOM 0 HH22 ARG A 118 13.729 37.217 45.487 1.00 0.00 H new ATOM 1863 N LEU A 119 20.726 33.403 44.712 1.00 0.00 N ATOM 1864 CA LEU A 119 20.856 32.427 43.571 1.00 0.00 C ATOM 1865 C LEU A 119 19.992 31.184 43.892 1.00 0.00 C ATOM 1866 O LEU A 119 19.214 30.716 43.063 1.00 0.00 O ATOM 1867 CB LEU A 119 22.357 32.081 43.534 1.00 0.00 C ATOM 1868 CG LEU A 119 22.640 30.862 42.638 1.00 0.00 C ATOM 1869 CD1 LEU A 119 22.453 29.573 43.444 1.00 0.00 C ATOM 1870 CD2 LEU A 119 21.697 30.856 41.430 1.00 0.00 C ATOM 0 H LEU A 119 21.568 33.509 45.278 1.00 0.00 H new ATOM 0 HA LEU A 119 20.519 32.816 42.610 1.00 0.00 H new ATOM 0 HB2 LEU A 119 22.919 32.940 43.168 1.00 0.00 H new ATOM 0 HB3 LEU A 119 22.708 31.878 44.546 1.00 0.00 H new ATOM 0 HG LEU A 119 23.668 30.922 42.281 1.00 0.00 H new ATOM 0 HD11 LEU A 119 22.654 28.712 42.806 1.00 0.00 H new ATOM 0 HD12 LEU A 119 23.143 29.568 44.288 1.00 0.00 H new ATOM 0 HD13 LEU A 119 21.429 29.520 43.813 1.00 0.00 H new ATOM 0 HD21 LEU A 119 21.910 29.988 40.806 1.00 0.00 H new ATOM 0 HD22 LEU A 119 20.664 30.810 41.775 1.00 0.00 H new ATOM 0 HD23 LEU A 119 21.845 31.766 40.848 1.00 0.00 H new ATOM 1882 N PHE A 120 20.078 30.681 45.113 1.00 0.00 N ATOM 1883 CA PHE A 120 19.231 29.506 45.546 1.00 0.00 C ATOM 1884 C PHE A 120 17.749 29.812 45.172 1.00 0.00 C ATOM 1885 O PHE A 120 17.031 28.940 44.688 1.00 0.00 O ATOM 1886 CB PHE A 120 19.457 29.419 47.094 1.00 0.00 C ATOM 1887 CG PHE A 120 19.401 27.975 47.642 1.00 0.00 C ATOM 1888 CD1 PHE A 120 18.748 26.970 46.918 1.00 0.00 C ATOM 1889 CD2 PHE A 120 19.963 27.649 48.918 1.00 0.00 C ATOM 1890 CE1 PHE A 120 18.651 25.671 47.428 1.00 0.00 C ATOM 1891 CE2 PHE A 120 19.848 26.344 49.424 1.00 0.00 C ATOM 1892 CZ PHE A 120 19.193 25.360 48.677 1.00 0.00 C ATOM 0 H PHE A 120 20.705 31.038 45.834 1.00 0.00 H new ATOM 0 HA PHE A 120 19.485 28.559 45.070 1.00 0.00 H new ATOM 0 HB2 PHE A 120 20.426 29.855 47.337 1.00 0.00 H new ATOM 0 HB3 PHE A 120 18.701 30.021 47.599 1.00 0.00 H new ATOM 0 HD1 PHE A 120 18.315 27.200 45.956 1.00 0.00 H new ATOM 0 HD2 PHE A 120 20.476 28.407 49.492 1.00 0.00 H new ATOM 0 HE1 PHE A 120 18.154 24.904 46.852 1.00 0.00 H new ATOM 0 HE2 PHE A 120 20.265 26.100 50.390 1.00 0.00 H new ATOM 0 HZ PHE A 120 19.106 24.357 49.067 1.00 0.00 H new ATOM 1902 N LYS A 121 17.296 31.051 45.334 1.00 0.00 N ATOM 1903 CA LYS A 121 15.884 31.424 44.929 1.00 0.00 C ATOM 1904 C LYS A 121 15.775 31.501 43.399 1.00 0.00 C ATOM 1905 O LYS A 121 14.781 31.090 42.810 1.00 0.00 O ATOM 1906 CB LYS A 121 15.627 32.820 45.479 1.00 0.00 C ATOM 1907 CG LYS A 121 14.290 33.347 44.925 1.00 0.00 C ATOM 1908 CD LYS A 121 14.532 34.585 44.058 1.00 0.00 C ATOM 1909 CE LYS A 121 14.043 34.315 42.631 1.00 0.00 C ATOM 1910 NZ LYS A 121 13.463 35.605 42.158 1.00 0.00 N ATOM 0 H LYS A 121 17.843 31.816 45.728 1.00 0.00 H new ATOM 0 HA LYS A 121 15.176 30.686 45.305 1.00 0.00 H new ATOM 0 HB2 LYS A 121 15.598 32.795 46.568 1.00 0.00 H new ATOM 0 HB3 LYS A 121 16.440 33.490 45.198 1.00 0.00 H new ATOM 0 HG2 LYS A 121 13.800 32.571 44.336 1.00 0.00 H new ATOM 0 HG3 LYS A 121 13.619 33.595 45.747 1.00 0.00 H new ATOM 0 HD2 LYS A 121 14.007 35.443 44.477 1.00 0.00 H new ATOM 0 HD3 LYS A 121 15.593 34.834 44.049 1.00 0.00 H new ATOM 0 HE2 LYS A 121 14.864 33.995 41.989 1.00 0.00 H new ATOM 0 HE3 LYS A 121 13.297 33.520 42.615 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 12.822 35.425 41.359 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 12.933 36.052 42.933 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 14.229 36.239 41.852 1.00 0.00 H new ATOM 1924 N ALA A 122 16.785 32.025 42.747 1.00 0.00 N ATOM 1925 CA ALA A 122 16.745 32.125 41.256 1.00 0.00 C ATOM 1926 C ALA A 122 16.582 30.723 40.675 1.00 0.00 C ATOM 1927 O ALA A 122 15.687 30.456 39.875 1.00 0.00 O ATOM 1928 CB ALA A 122 18.092 32.725 40.851 1.00 0.00 C ATOM 0 H ALA A 122 17.633 32.387 43.183 1.00 0.00 H new ATOM 0 HA ALA A 122 15.919 32.737 40.893 1.00 0.00 H new ATOM 0 HB1 ALA A 122 18.133 32.827 39.767 1.00 0.00 H new ATOM 0 HB2 ALA A 122 18.207 33.706 41.313 1.00 0.00 H new ATOM 0 HB3 ALA A 122 18.897 32.070 41.185 1.00 0.00 H new ATOM 1934 N THR A 123 17.437 29.823 41.071 1.00 0.00 N ATOM 1935 CA THR A 123 17.343 28.418 40.551 1.00 0.00 C ATOM 1936 C THR A 123 16.079 27.708 41.105 1.00 0.00 C ATOM 1937 O THR A 123 15.187 27.333 40.349 1.00 0.00 O ATOM 1938 CB THR A 123 18.607 27.716 41.046 1.00 0.00 C ATOM 1939 OG1 THR A 123 19.714 28.596 40.923 1.00 0.00 O ATOM 1940 CG2 THR A 123 18.855 26.462 40.206 1.00 0.00 C ATOM 0 H THR A 123 18.197 29.992 41.730 1.00 0.00 H new ATOM 0 HA THR A 123 17.263 28.398 39.464 1.00 0.00 H new ATOM 0 HB THR A 123 18.482 27.433 42.091 1.00 0.00 H new ATOM 0 HG1 THR A 123 20.525 28.148 41.242 1.00 0.00 H new ATOM 0 HG21 THR A 123 19.756 25.961 40.558 1.00 0.00 H new ATOM 0 HG22 THR A 123 18.004 25.787 40.300 1.00 0.00 H new ATOM 0 HG23 THR A 123 18.981 26.743 39.161 1.00 0.00 H new ATOM 1948 N THR A 124 15.962 27.564 42.411 1.00 0.00 N ATOM 1949 CA THR A 124 14.727 26.935 43.021 1.00 0.00 C ATOM 1950 C THR A 124 13.495 27.679 42.493 1.00 0.00 C ATOM 1951 O THR A 124 12.431 27.101 42.282 1.00 0.00 O ATOM 1952 CB THR A 124 14.885 27.091 44.542 1.00 0.00 C ATOM 1953 OG1 THR A 124 14.129 26.080 45.195 1.00 0.00 O ATOM 1954 CG2 THR A 124 14.390 28.465 44.998 1.00 0.00 C ATOM 0 H THR A 124 16.669 27.855 43.086 1.00 0.00 H new ATOM 0 HA THR A 124 14.606 25.882 42.766 1.00 0.00 H new ATOM 0 HB THR A 124 15.940 26.997 44.798 1.00 0.00 H new ATOM 0 HG1 THR A 124 14.557 25.849 46.046 1.00 0.00 H new ATOM 0 HG21 THR A 124 14.510 28.555 46.078 1.00 0.00 H new ATOM 0 HG22 THR A 124 14.969 29.244 44.502 1.00 0.00 H new ATOM 0 HG23 THR A 124 13.337 28.576 44.740 1.00 0.00 H new ATOM 1962 N GLY A 125 13.647 28.962 42.250 1.00 0.00 N ATOM 1963 CA GLY A 125 12.524 29.781 41.704 1.00 0.00 C ATOM 1964 C GLY A 125 11.927 30.816 42.688 1.00 0.00 C ATOM 1965 O GLY A 125 11.589 31.908 42.238 1.00 0.00 O ATOM 0 H GLY A 125 14.512 29.478 42.410 1.00 0.00 H new ATOM 0 HA2 GLY A 125 12.877 30.307 40.817 1.00 0.00 H new ATOM 0 HA3 GLY A 125 11.729 29.109 41.381 1.00 0.00 H new ATOM 1969 N MET A 126 11.758 30.576 43.974 1.00 0.00 N ATOM 1970 CA MET A 126 11.140 31.691 44.794 1.00 0.00 C ATOM 1971 C MET A 126 11.468 31.686 46.306 1.00 0.00 C ATOM 1972 O MET A 126 10.567 31.843 47.128 1.00 0.00 O ATOM 1973 CB MET A 126 9.628 31.509 44.610 1.00 0.00 C ATOM 1974 CG MET A 126 9.159 32.214 43.331 1.00 0.00 C ATOM 1975 SD MET A 126 8.851 30.990 42.031 1.00 0.00 S ATOM 1976 CE MET A 126 7.465 30.149 42.835 1.00 0.00 C ATOM 0 H MET A 126 12.001 29.718 44.470 1.00 0.00 H new ATOM 0 HA MET A 126 11.545 32.640 44.444 1.00 0.00 H new ATOM 0 HB2 MET A 126 9.386 30.447 44.558 1.00 0.00 H new ATOM 0 HB3 MET A 126 9.098 31.915 45.472 1.00 0.00 H new ATOM 0 HG2 MET A 126 8.250 32.782 43.531 1.00 0.00 H new ATOM 0 HG3 MET A 126 9.914 32.927 43.000 1.00 0.00 H new ATOM 0 HE1 MET A 126 6.722 29.875 42.086 1.00 0.00 H new ATOM 0 HE2 MET A 126 7.825 29.250 43.335 1.00 0.00 H new ATOM 0 HE3 MET A 126 7.012 30.815 43.569 1.00 0.00 H new ATOM 1986 N THR A 127 12.712 31.575 46.707 1.00 0.00 N ATOM 1987 CA THR A 127 13.033 31.630 48.166 1.00 0.00 C ATOM 1988 C THR A 127 14.551 31.725 48.376 1.00 0.00 C ATOM 1989 O THR A 127 15.204 30.712 48.597 1.00 0.00 O ATOM 1990 CB THR A 127 12.521 30.320 48.753 1.00 0.00 C ATOM 1991 OG1 THR A 127 11.334 29.902 48.097 1.00 0.00 O ATOM 1992 CG2 THR A 127 12.229 30.553 50.220 1.00 0.00 C ATOM 0 H THR A 127 13.514 31.449 46.090 1.00 0.00 H new ATOM 0 HA THR A 127 12.577 32.499 48.639 1.00 0.00 H new ATOM 0 HB THR A 127 13.272 29.541 48.621 1.00 0.00 H new ATOM 0 HG1 THR A 127 10.662 30.613 48.151 1.00 0.00 H new ATOM 0 HG21 THR A 127 11.860 29.631 50.668 1.00 0.00 H new ATOM 0 HG22 THR A 127 13.142 30.863 50.728 1.00 0.00 H new ATOM 0 HG23 THR A 127 11.474 31.333 50.321 1.00 0.00 H new ATOM 2000 N PRO A 128 15.097 32.916 48.294 1.00 0.00 N ATOM 2001 CA PRO A 128 16.570 33.046 48.440 1.00 0.00 C ATOM 2002 C PRO A 128 17.070 32.772 49.857 1.00 0.00 C ATOM 2003 O PRO A 128 17.067 31.632 50.316 1.00 0.00 O ATOM 2004 CB PRO A 128 16.819 34.493 48.014 1.00 0.00 C ATOM 2005 CG PRO A 128 15.536 35.209 48.286 1.00 0.00 C ATOM 2006 CD PRO A 128 14.430 34.209 48.096 1.00 0.00 C ATOM 0 HA PRO A 128 17.112 32.311 47.844 1.00 0.00 H new ATOM 0 HB2 PRO A 128 17.642 34.933 48.577 1.00 0.00 H new ATOM 0 HB3 PRO A 128 17.087 34.552 46.959 1.00 0.00 H new ATOM 0 HG2 PRO A 128 15.525 35.610 49.300 1.00 0.00 H new ATOM 0 HG3 PRO A 128 15.414 36.054 47.608 1.00 0.00 H new ATOM 0 HD2 PRO A 128 13.625 34.359 48.816 1.00 0.00 H new ATOM 0 HD3 PRO A 128 13.988 34.284 47.103 1.00 0.00 H new ATOM 2014 N LYS A 129 17.549 33.778 50.549 1.00 0.00 N ATOM 2015 CA LYS A 129 18.097 33.536 51.904 1.00 0.00 C ATOM 2016 C LYS A 129 17.011 32.953 52.835 1.00 0.00 C ATOM 2017 O LYS A 129 17.316 32.318 53.845 1.00 0.00 O ATOM 2018 CB LYS A 129 18.655 34.886 52.374 1.00 0.00 C ATOM 2019 CG LYS A 129 19.857 34.620 53.300 1.00 0.00 C ATOM 2020 CD LYS A 129 19.995 35.706 54.377 1.00 0.00 C ATOM 2021 CE LYS A 129 21.129 36.659 54.000 1.00 0.00 C ATOM 2022 NZ LYS A 129 20.866 37.903 54.777 1.00 0.00 N ATOM 0 H LYS A 129 17.581 34.746 50.230 1.00 0.00 H new ATOM 0 HA LYS A 129 18.892 32.790 51.910 1.00 0.00 H new ATOM 0 HB2 LYS A 129 18.961 35.488 51.519 1.00 0.00 H new ATOM 0 HB3 LYS A 129 17.887 35.451 52.903 1.00 0.00 H new ATOM 0 HG2 LYS A 129 19.741 33.647 53.777 1.00 0.00 H new ATOM 0 HG3 LYS A 129 20.771 34.577 52.707 1.00 0.00 H new ATOM 0 HD2 LYS A 129 19.060 36.257 54.474 1.00 0.00 H new ATOM 0 HD3 LYS A 129 20.197 35.249 55.346 1.00 0.00 H new ATOM 0 HE2 LYS A 129 22.101 36.235 54.253 1.00 0.00 H new ATOM 0 HE3 LYS A 129 21.137 36.858 52.928 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 21.770 38.330 55.065 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 20.337 38.576 54.186 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 20.307 37.672 55.623 1.00 0.00 H new ATOM 2036 N ALA A 130 15.757 33.106 52.487 1.00 0.00 N ATOM 2037 CA ALA A 130 14.661 32.516 53.326 1.00 0.00 C ATOM 2038 C ALA A 130 14.723 30.985 53.212 1.00 0.00 C ATOM 2039 O ALA A 130 14.556 30.274 54.201 1.00 0.00 O ATOM 2040 CB ALA A 130 13.359 33.042 52.719 1.00 0.00 C ATOM 0 H ALA A 130 15.442 33.613 51.660 1.00 0.00 H new ATOM 0 HA ALA A 130 14.743 32.782 54.380 1.00 0.00 H new ATOM 0 HB1 ALA A 130 12.511 32.651 53.282 1.00 0.00 H new ATOM 0 HB2 ALA A 130 13.352 34.131 52.761 1.00 0.00 H new ATOM 0 HB3 ALA A 130 13.285 32.719 51.681 1.00 0.00 H new ATOM 2046 N TRP A 131 15.014 30.456 52.034 1.00 0.00 N ATOM 2047 CA TRP A 131 15.137 28.972 51.915 1.00 0.00 C ATOM 2048 C TRP A 131 16.323 28.534 52.761 1.00 0.00 C ATOM 2049 O TRP A 131 16.265 27.532 53.468 1.00 0.00 O ATOM 2050 CB TRP A 131 15.415 28.701 50.438 1.00 0.00 C ATOM 2051 CG TRP A 131 14.424 27.734 49.860 1.00 0.00 C ATOM 2052 CD1 TRP A 131 14.675 26.953 48.784 1.00 0.00 C ATOM 2053 CD2 TRP A 131 13.052 27.424 50.276 1.00 0.00 C ATOM 2054 NE1 TRP A 131 13.559 26.185 48.513 1.00 0.00 N ATOM 2055 CE2 TRP A 131 12.534 26.438 49.399 1.00 0.00 C ATOM 2056 CE3 TRP A 131 12.213 27.889 51.310 1.00 0.00 C ATOM 2057 CZ2 TRP A 131 11.240 25.936 49.543 1.00 0.00 C ATOM 2058 CZ3 TRP A 131 10.911 27.385 51.454 1.00 0.00 C ATOM 2059 CH2 TRP A 131 10.425 26.410 50.574 1.00 0.00 C ATOM 0 H TRP A 131 15.167 30.982 51.174 1.00 0.00 H new ATOM 0 HA TRP A 131 14.248 28.438 52.250 1.00 0.00 H new ATOM 0 HB2 TRP A 131 15.378 29.638 49.882 1.00 0.00 H new ATOM 0 HB3 TRP A 131 16.423 28.302 50.324 1.00 0.00 H new ATOM 0 HD1 TRP A 131 15.600 26.933 48.226 1.00 0.00 H new ATOM 0 HE1 TRP A 131 13.501 25.512 47.749 1.00 0.00 H new ATOM 0 HE3 TRP A 131 12.576 28.639 51.997 1.00 0.00 H new ATOM 0 HZ2 TRP A 131 10.870 25.185 48.861 1.00 0.00 H new ATOM 0 HZ3 TRP A 131 10.279 27.752 52.249 1.00 0.00 H new ATOM 0 HH2 TRP A 131 9.423 26.025 50.692 1.00 0.00 H new ATOM 2070 N GLN A 132 17.391 29.286 52.729 1.00 0.00 N ATOM 2071 CA GLN A 132 18.574 28.928 53.566 1.00 0.00 C ATOM 2072 C GLN A 132 18.136 28.836 55.031 1.00 0.00 C ATOM 2073 O GLN A 132 18.556 27.947 55.767 1.00 0.00 O ATOM 2074 CB GLN A 132 19.571 30.075 53.359 1.00 0.00 C ATOM 2075 CG GLN A 132 20.674 30.020 54.429 1.00 0.00 C ATOM 2076 CD GLN A 132 20.659 31.311 55.250 1.00 0.00 C ATOM 2077 OE1 GLN A 132 21.237 32.318 54.847 1.00 0.00 O ATOM 2078 NE2 GLN A 132 20.024 31.341 56.389 1.00 0.00 N ATOM 0 H GLN A 132 17.496 30.128 52.163 1.00 0.00 H new ATOM 0 HA GLN A 132 19.017 27.969 53.297 1.00 0.00 H new ATOM 0 HB2 GLN A 132 20.014 30.006 52.366 1.00 0.00 H new ATOM 0 HB3 GLN A 132 19.051 31.032 53.411 1.00 0.00 H new ATOM 0 HG2 GLN A 132 20.519 29.161 55.081 1.00 0.00 H new ATOM 0 HG3 GLN A 132 21.647 29.890 53.956 1.00 0.00 H new ATOM 0 HE21 GLN A 132 19.543 30.507 56.727 1.00 0.00 H new ATOM 0 HE22 GLN A 132 20.008 32.198 56.942 1.00 0.00 H new ATOM 2087 N GLN A 133 17.295 29.739 55.465 1.00 0.00 N ATOM 2088 CA GLN A 133 16.827 29.695 56.880 1.00 0.00 C ATOM 2089 C GLN A 133 15.965 28.447 57.102 1.00 0.00 C ATOM 2090 O GLN A 133 16.202 27.663 58.027 1.00 0.00 O ATOM 2091 CB GLN A 133 15.999 30.967 57.074 1.00 0.00 C ATOM 2092 CG GLN A 133 15.465 31.019 58.507 1.00 0.00 C ATOM 2093 CD GLN A 133 15.167 32.470 58.891 1.00 0.00 C ATOM 2094 OE1 GLN A 133 15.676 33.401 58.269 1.00 0.00 O ATOM 2095 NE2 GLN A 133 14.366 32.716 59.891 1.00 0.00 N ATOM 0 H GLN A 133 16.915 30.501 54.903 1.00 0.00 H new ATOM 0 HA GLN A 133 17.653 29.646 57.589 1.00 0.00 H new ATOM 0 HB2 GLN A 133 16.611 31.846 56.871 1.00 0.00 H new ATOM 0 HB3 GLN A 133 15.171 30.985 56.366 1.00 0.00 H new ATOM 0 HG2 GLN A 133 14.560 30.417 58.591 1.00 0.00 H new ATOM 0 HG3 GLN A 133 16.196 30.593 59.194 1.00 0.00 H new ATOM 0 HE21 GLN A 133 13.943 31.945 60.408 1.00 0.00 H new ATOM 0 HE22 GLN A 133 14.162 33.680 60.156 1.00 0.00 H new ATOM 2104 N ALA A 134 14.974 28.235 56.269 1.00 0.00 N ATOM 2105 CA ALA A 134 14.112 27.026 56.439 1.00 0.00 C ATOM 2106 C ALA A 134 14.991 25.786 56.500 1.00 0.00 C ATOM 2107 O ALA A 134 14.815 24.913 57.347 1.00 0.00 O ATOM 2108 CB ALA A 134 13.199 26.994 55.214 1.00 0.00 C ATOM 0 H ALA A 134 14.728 28.841 55.487 1.00 0.00 H new ATOM 0 HA ALA A 134 13.527 27.055 57.358 1.00 0.00 H new ATOM 0 HB1 ALA A 134 12.538 26.129 55.275 1.00 0.00 H new ATOM 0 HB2 ALA A 134 12.602 27.905 55.182 1.00 0.00 H new ATOM 0 HB3 ALA A 134 13.805 26.925 54.310 1.00 0.00 H new ATOM 2114 N TRP A 135 15.968 25.723 55.649 1.00 0.00 N ATOM 2115 CA TRP A 135 16.917 24.575 55.675 1.00 0.00 C ATOM 2116 C TRP A 135 17.500 24.460 57.075 1.00 0.00 C ATOM 2117 O TRP A 135 17.443 23.423 57.731 1.00 0.00 O ATOM 2118 CB TRP A 135 18.005 25.010 54.715 1.00 0.00 C ATOM 2119 CG TRP A 135 17.455 25.132 53.338 1.00 0.00 C ATOM 2120 CD1 TRP A 135 18.117 25.700 52.319 1.00 0.00 C ATOM 2121 CD2 TRP A 135 16.189 24.641 52.790 1.00 0.00 C ATOM 2122 NE1 TRP A 135 17.341 25.619 51.178 1.00 0.00 N ATOM 2123 CE2 TRP A 135 16.148 24.965 51.416 1.00 0.00 C ATOM 2124 CE3 TRP A 135 15.084 23.959 53.342 1.00 0.00 C ATOM 2125 CZ2 TRP A 135 15.059 24.623 50.617 1.00 0.00 C ATOM 2126 CZ3 TRP A 135 13.986 23.617 52.538 1.00 0.00 C ATOM 2127 CH2 TRP A 135 13.975 23.945 51.178 1.00 0.00 C ATOM 0 H TRP A 135 16.155 26.421 54.929 1.00 0.00 H new ATOM 0 HA TRP A 135 16.465 23.619 55.413 1.00 0.00 H new ATOM 0 HB2 TRP A 135 18.421 25.965 55.034 1.00 0.00 H new ATOM 0 HB3 TRP A 135 18.821 24.287 54.726 1.00 0.00 H new ATOM 0 HD1 TRP A 135 19.098 26.148 52.380 1.00 0.00 H new ATOM 0 HE1 TRP A 135 17.616 25.996 50.271 1.00 0.00 H new ATOM 0 HE3 TRP A 135 15.083 23.699 54.390 1.00 0.00 H new ATOM 0 HZ2 TRP A 135 15.053 24.881 49.568 1.00 0.00 H new ATOM 0 HZ3 TRP A 135 13.144 23.097 52.972 1.00 0.00 H new ATOM 0 HH2 TRP A 135 13.129 23.674 50.563 1.00 0.00 H new ATOM 2138 N ARG A 136 18.047 25.542 57.545 1.00 0.00 N ATOM 2139 CA ARG A 136 18.648 25.552 58.912 1.00 0.00 C ATOM 2140 C ARG A 136 17.579 25.289 59.977 1.00 0.00 C ATOM 2141 O ARG A 136 17.883 25.026 61.137 1.00 0.00 O ATOM 2142 CB ARG A 136 19.245 26.952 59.077 1.00 0.00 C ATOM 2143 CG ARG A 136 20.141 26.985 60.319 1.00 0.00 C ATOM 2144 CD ARG A 136 20.688 28.402 60.523 1.00 0.00 C ATOM 2145 NE ARG A 136 19.487 29.290 60.557 1.00 0.00 N ATOM 2146 CZ ARG A 136 18.715 29.332 61.616 1.00 0.00 C ATOM 2147 NH1 ARG A 136 18.976 28.599 62.668 1.00 0.00 N ATOM 2148 NH2 ARG A 136 17.671 30.117 61.622 1.00 0.00 N ATOM 0 H ARG A 136 18.106 26.427 57.041 1.00 0.00 H new ATOM 0 HA ARG A 136 19.400 24.772 59.031 1.00 0.00 H new ATOM 0 HB2 ARG A 136 19.823 27.219 58.192 1.00 0.00 H new ATOM 0 HB3 ARG A 136 18.448 27.690 59.171 1.00 0.00 H new ATOM 0 HG2 ARG A 136 19.574 26.674 61.197 1.00 0.00 H new ATOM 0 HG3 ARG A 136 20.964 26.280 60.204 1.00 0.00 H new ATOM 0 HD2 ARG A 136 21.256 28.474 61.450 1.00 0.00 H new ATOM 0 HD3 ARG A 136 21.362 28.683 59.714 1.00 0.00 H new ATOM 0 HE ARG A 136 19.265 29.870 59.748 1.00 0.00 H new ATOM 0 HH11 ARG A 136 19.790 27.984 62.672 1.00 0.00 H new ATOM 0 HH12 ARG A 136 18.366 28.643 63.484 1.00 0.00 H new ATOM 0 HH21 ARG A 136 17.461 30.692 60.806 1.00 0.00 H new ATOM 0 HH22 ARG A 136 17.066 30.155 62.442 1.00 0.00 H new ATOM 2162 N ALA A 137 16.332 25.342 59.606 1.00 0.00 N ATOM 2163 CA ALA A 137 15.259 25.075 60.589 1.00 0.00 C ATOM 2164 C ALA A 137 15.026 23.569 60.676 1.00 0.00 C ATOM 2165 O ALA A 137 15.065 22.981 61.756 1.00 0.00 O ATOM 2166 CB ALA A 137 14.023 25.783 60.034 1.00 0.00 C ATOM 0 H ALA A 137 16.013 25.559 58.662 1.00 0.00 H new ATOM 0 HA ALA A 137 15.503 25.429 61.591 1.00 0.00 H new ATOM 0 HB1 ALA A 137 13.182 25.630 60.710 1.00 0.00 H new ATOM 0 HB2 ALA A 137 14.226 26.850 59.942 1.00 0.00 H new ATOM 0 HB3 ALA A 137 13.779 25.374 59.054 1.00 0.00 H new ATOM 2172 N ARG A 138 14.781 22.928 59.562 1.00 0.00 N ATOM 2173 CA ARG A 138 14.540 21.457 59.592 1.00 0.00 C ATOM 2174 C ARG A 138 15.786 20.671 59.165 1.00 0.00 C ATOM 2175 O ARG A 138 16.182 19.705 59.815 1.00 0.00 O ATOM 2176 CB ARG A 138 13.402 21.230 58.597 1.00 0.00 C ATOM 2177 CG ARG A 138 12.607 19.987 59.004 1.00 0.00 C ATOM 2178 CD ARG A 138 11.595 19.643 57.908 1.00 0.00 C ATOM 2179 NE ARG A 138 12.221 18.526 57.140 1.00 0.00 N ATOM 2180 CZ ARG A 138 11.521 17.836 56.272 1.00 0.00 C ATOM 2181 NH1 ARG A 138 10.260 18.113 56.059 1.00 0.00 N ATOM 2182 NH2 ARG A 138 12.088 16.863 55.612 1.00 0.00 N ATOM 0 H ARG A 138 14.738 23.358 58.638 1.00 0.00 H new ATOM 0 HA ARG A 138 14.297 21.112 60.597 1.00 0.00 H new ATOM 0 HB2 ARG A 138 12.747 22.101 58.572 1.00 0.00 H new ATOM 0 HB3 ARG A 138 13.804 21.104 57.592 1.00 0.00 H new ATOM 0 HG2 ARG A 138 13.283 19.147 59.165 1.00 0.00 H new ATOM 0 HG3 ARG A 138 12.090 20.166 59.947 1.00 0.00 H new ATOM 0 HD2 ARG A 138 10.639 19.341 58.335 1.00 0.00 H new ATOM 0 HD3 ARG A 138 11.401 20.503 57.267 1.00 0.00 H new ATOM 0 HE ARG A 138 13.203 18.297 57.292 1.00 0.00 H new ATOM 0 HH11 ARG A 138 9.811 18.873 56.571 1.00 0.00 H new ATOM 0 HH12 ARG A 138 9.726 17.569 55.381 1.00 0.00 H new ATOM 0 HH21 ARG A 138 13.071 16.643 55.773 1.00 0.00 H new ATOM 0 HH22 ARG A 138 11.548 16.323 54.936 1.00 0.00 H new ATOM 2196 N ARG A 139 16.392 21.045 58.061 1.00 0.00 N ATOM 2197 CA ARG A 139 17.589 20.287 57.579 1.00 0.00 C ATOM 2198 C ARG A 139 18.542 21.191 56.790 1.00 0.00 C ATOM 2199 O ARG A 139 19.739 20.983 56.882 1.00 0.00 O ATOM 2200 CB ARG A 139 17.014 19.201 56.673 1.00 0.00 C ATOM 2201 CG ARG A 139 17.917 17.969 56.715 1.00 0.00 C ATOM 2202 CD ARG A 139 17.074 16.717 56.464 1.00 0.00 C ATOM 2203 NE ARG A 139 17.938 15.574 56.879 1.00 0.00 N ATOM 2204 CZ ARG A 139 18.188 15.350 58.147 1.00 0.00 C ATOM 2205 NH1 ARG A 139 17.687 16.124 59.075 1.00 0.00 N ATOM 2206 NH2 ARG A 139 18.945 14.343 58.484 1.00 0.00 N ATOM 2207 OXT ARG A 139 18.058 22.060 56.096 1.00 0.00 O ATOM 0 H ARG A 139 16.112 21.835 57.479 1.00 0.00 H new ATOM 0 HA ARG A 139 18.172 19.882 58.406 1.00 0.00 H new ATOM 0 HB2 ARG A 139 16.007 18.938 56.997 1.00 0.00 H new ATOM 0 HB3 ARG A 139 16.933 19.571 55.651 1.00 0.00 H new ATOM 0 HG2 ARG A 139 18.700 18.052 55.961 1.00 0.00 H new ATOM 0 HG3 ARG A 139 18.413 17.900 57.683 1.00 0.00 H new ATOM 0 HD2 ARG A 139 16.150 16.742 57.042 1.00 0.00 H new ATOM 0 HD3 ARG A 139 16.792 16.636 55.414 1.00 0.00 H new ATOM 0 HE ARG A 139 18.338 14.960 56.169 1.00 0.00 H new ATOM 0 HH11 ARG A 139 17.094 16.913 58.816 1.00 0.00 H new ATOM 0 HH12 ARG A 139 17.889 15.939 60.057 1.00 0.00 H new ATOM 0 HH21 ARG A 139 19.338 13.737 57.764 1.00 0.00 H new ATOM 0 HH22 ARG A 139 19.144 14.162 59.468 1.00 0.00 H new