USER MOD reduce.3.24.130724 H: found=0, std=0, add=1176, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1169 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 81 THR OG1 : rot 54:sc= 1.21 USER MOD Set 1.2: A 86 HIS : no HE2:sc= -0.792 X(o=0.42,f=0.2) USER MOD Set 2.1: A 12 ASN : amide:sc= -2.69! X(o=-3.2!,f=-2.8) USER MOD Set 2.2: A 63 HIS : no HE2:sc= -0.547 K(o=-3.2,f=-4.1) USER MOD Set 3.1: A 4 ASN : amide:sc= 1.42 K(o=2.5,f=-3.3) USER MOD Set 3.2: A 31 LYS NZ :NH3+ 177:sc= 1.05 (180deg=0) USER MOD Set 4.1: A 9 CYS SG : rot -111:sc= 1.52 USER MOD Set 4.2: A 16 SER OG : rot -29:sc= 1.33 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 ASN : amide:sc= 0.362 X(o=0.36,f=-0.13) USER MOD Single : A 14 CYS SG : rot 180:sc= 0.163 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0.0153 USER MOD Single : A 24 GLN : amide:sc= 0.566 K(o=0.57,f=-0.2) USER MOD Single : A 26 TYR OH : rot 180:sc= 0.487 USER MOD Single : A 27 HIS : no HD1:sc= -0.0372 X(o=-0.037,f=-0.12) USER MOD Single : A 34 SER OG : rot 140:sc= 0 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 THR OG1 : rot 87:sc= 1.21 USER MOD Single : A 51 SER OG : rot 73:sc= 1.26 USER MOD Single : A 56 HIS : no HD1:sc= -0.146 X(o=-0.15,f=0) USER MOD Single : A 57 GLN : amide:sc= 0.993 K(o=0.99,f=-0.00076) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 64 CYS SG : rot 10:sc= 0.0496 USER MOD Single : A 67 GLN : amide:sc= 0.876 K(o=0.88,f=0) USER MOD Single : A 69 SER OG : rot 180:sc= 0.338 USER MOD Single : A 73 CYS SG : rot 65:sc= -0.07 USER MOD Single : A 75 ASN : amide:sc= 0.974 K(o=0.97,f=-0.031) USER MOD Single : A 76 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 MET CE :methyl 172:sc= -0.113 (180deg=-0.19) USER MOD Single : A 84 LYS NZ :NH3+ -169:sc= 0.848 (180deg=0.757) USER MOD Single : A 91 CYS SG : rot 81:sc= 0.326 USER MOD Single : A 93 MET CE :methyl -173:sc= 0 (180deg=-0.0791) USER MOD Single : A 97 MET CE :methyl 165:sc= -0.0654 (180deg=-0.425) USER MOD Single : A 100 LYS NZ :NH3+ 147:sc= 0.975 (180deg=0.374) USER MOD Single : A 102 MET CE :methyl -135:sc= 0 (180deg=-0.0589) USER MOD Single : A 106 HIS : no HE2:sc= 1.04 K(o=1,f=-3.1!) USER MOD Single : A 109 ASN : amide:sc= -0.315 X(o=-0.31,f=-0.6) USER MOD Single : A 111 CYS SG : rot 85:sc= 0.26 USER MOD Single : A 117 TYR OH : rot 180:sc= 0 USER MOD Single : A 119 LYS NZ :NH3+ 167:sc= 1.02 (180deg=0.901) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 123 THR OG1 : rot -150:sc= 0.00562 USER MOD Single : A 128 TYR OH : rot 36:sc= 1.91 USER MOD Single : A 129 THR OG1 : rot 76:sc= 1.23 USER MOD Single : A 134 SER OG : rot 75:sc= 1.2 USER MOD Single : A 137 GLN : amide:sc= 0 K(o=0,f=-0.52) USER MOD Single : A 140 GLN : amide:sc= 0.7 K(o=0.7,f=0) USER MOD Single : A 143 ASN : amide:sc= -0.0127 X(o=-0.013,f=-0.013) USER MOD Single : A 146 GLN : amide:sc= 0.674 K(o=0.67,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -3.853 10.878 -15.148 1.00 0.00 N ATOM 2 CA MET A 1 -4.236 10.765 -13.718 1.00 0.00 C ATOM 3 C MET A 1 -4.923 9.411 -13.487 1.00 0.00 C ATOM 4 O MET A 1 -5.971 9.134 -14.075 1.00 0.00 O ATOM 5 CB MET A 1 -5.122 11.951 -13.272 1.00 0.00 C ATOM 6 CG MET A 1 -4.930 12.323 -11.795 1.00 0.00 C ATOM 7 SD MET A 1 -5.326 11.063 -10.552 1.00 0.00 S ATOM 8 CE MET A 1 -4.990 12.055 -9.071 1.00 0.00 C ATOM 0 H1 MET A 1 -3.387 11.793 -15.311 1.00 0.00 H new ATOM 0 H2 MET A 1 -3.199 10.108 -15.394 1.00 0.00 H new ATOM 0 H3 MET A 1 -4.704 10.812 -15.742 1.00 0.00 H new ATOM 0 HA MET A 1 -3.339 10.810 -13.101 1.00 0.00 H new ATOM 0 HB2 MET A 1 -4.896 12.819 -13.892 1.00 0.00 H new ATOM 0 HB3 MET A 1 -6.169 11.700 -13.444 1.00 0.00 H new ATOM 0 HG2 MET A 1 -3.890 12.617 -11.655 1.00 0.00 H new ATOM 0 HG3 MET A 1 -5.540 13.202 -11.588 1.00 0.00 H new ATOM 0 HE1 MET A 1 -5.176 11.454 -8.181 1.00 0.00 H new ATOM 0 HE2 MET A 1 -3.950 12.380 -9.079 1.00 0.00 H new ATOM 0 HE3 MET A 1 -5.642 12.928 -9.062 1.00 0.00 H new ATOM 18 N PHE A 2 -4.313 8.540 -12.673 1.00 0.00 N ATOM 19 CA PHE A 2 -4.734 7.144 -12.527 1.00 0.00 C ATOM 20 C PHE A 2 -6.119 7.017 -11.888 1.00 0.00 C ATOM 21 O PHE A 2 -6.939 6.211 -12.330 1.00 0.00 O ATOM 22 CB PHE A 2 -3.714 6.374 -11.669 1.00 0.00 C ATOM 23 CG PHE A 2 -2.260 6.620 -12.029 1.00 0.00 C ATOM 24 CD1 PHE A 2 -1.643 5.883 -13.058 1.00 0.00 C ATOM 25 CD2 PHE A 2 -1.521 7.594 -11.329 1.00 0.00 C ATOM 26 CE1 PHE A 2 -0.295 6.114 -13.382 1.00 0.00 C ATOM 27 CE2 PHE A 2 -0.173 7.821 -11.653 1.00 0.00 C ATOM 28 CZ PHE A 2 0.443 7.082 -12.677 1.00 0.00 C ATOM 0 H PHE A 2 -3.510 8.787 -12.095 1.00 0.00 H new ATOM 0 HA PHE A 2 -4.786 6.721 -13.530 1.00 0.00 H new ATOM 0 HB2 PHE A 2 -3.865 6.643 -10.623 1.00 0.00 H new ATOM 0 HB3 PHE A 2 -3.919 5.307 -11.757 1.00 0.00 H new ATOM 0 HD1 PHE A 2 -2.207 5.138 -13.600 1.00 0.00 H new ATOM 0 HD2 PHE A 2 -1.991 8.166 -10.543 1.00 0.00 H new ATOM 0 HE1 PHE A 2 0.175 5.548 -14.173 1.00 0.00 H new ATOM 0 HE2 PHE A 2 0.392 8.566 -11.113 1.00 0.00 H new ATOM 0 HZ PHE A 2 1.480 7.257 -12.922 1.00 0.00 H new ATOM 38 N ASN A 3 -6.355 7.799 -10.825 1.00 0.00 N ATOM 39 CA ASN A 3 -7.479 7.764 -9.879 1.00 0.00 C ATOM 40 C ASN A 3 -7.773 6.401 -9.219 1.00 0.00 C ATOM 41 O ASN A 3 -8.389 6.386 -8.158 1.00 0.00 O ATOM 42 CB ASN A 3 -8.746 8.397 -10.484 1.00 0.00 C ATOM 43 CG ASN A 3 -9.874 8.509 -9.450 1.00 0.00 C ATOM 44 OD1 ASN A 3 -10.857 7.777 -9.509 1.00 0.00 O ATOM 45 ND2 ASN A 3 -9.756 9.416 -8.490 1.00 0.00 N ATOM 0 H ASN A 3 -5.701 8.543 -10.583 1.00 0.00 H new ATOM 0 HA ASN A 3 -7.139 8.378 -9.045 1.00 0.00 H new ATOM 0 HB2 ASN A 3 -8.508 9.388 -10.872 1.00 0.00 H new ATOM 0 HB3 ASN A 3 -9.085 7.797 -11.329 1.00 0.00 H new ATOM 0 HD21 ASN A 3 -10.489 9.513 -7.787 1.00 0.00 H new ATOM 0 HD22 ASN A 3 -8.933 10.017 -8.455 1.00 0.00 H new ATOM 52 N ASN A 4 -7.303 5.281 -9.781 1.00 0.00 N ATOM 53 CA ASN A 4 -7.684 3.929 -9.379 1.00 0.00 C ATOM 54 C ASN A 4 -6.390 3.212 -9.040 1.00 0.00 C ATOM 55 O ASN A 4 -5.589 2.956 -9.943 1.00 0.00 O ATOM 56 CB ASN A 4 -8.400 3.204 -10.540 1.00 0.00 C ATOM 57 CG ASN A 4 -9.683 3.884 -10.995 1.00 0.00 C ATOM 58 OD1 ASN A 4 -10.777 3.499 -10.593 1.00 0.00 O ATOM 59 ND2 ASN A 4 -9.584 4.892 -11.847 1.00 0.00 N ATOM 0 H ASN A 4 -6.630 5.294 -10.547 1.00 0.00 H new ATOM 0 HA ASN A 4 -8.369 3.946 -8.532 1.00 0.00 H new ATOM 0 HB2 ASN A 4 -7.718 3.134 -11.387 1.00 0.00 H new ATOM 0 HB3 ASN A 4 -8.631 2.184 -10.231 1.00 0.00 H new ATOM 0 HD21 ASN A 4 -10.425 5.363 -12.180 1.00 0.00 H new ATOM 0 HD22 ASN A 4 -8.666 5.198 -12.170 1.00 0.00 H new ATOM 66 N ILE A 5 -6.177 2.896 -7.762 1.00 0.00 N ATOM 67 CA ILE A 5 -4.882 2.427 -7.278 1.00 0.00 C ATOM 68 C ILE A 5 -5.073 1.187 -6.394 1.00 0.00 C ATOM 69 O ILE A 5 -6.073 1.070 -5.683 1.00 0.00 O ATOM 70 CB ILE A 5 -4.193 3.613 -6.546 1.00 0.00 C ATOM 71 CG1 ILE A 5 -4.056 4.825 -7.510 1.00 0.00 C ATOM 72 CG2 ILE A 5 -2.833 3.225 -5.939 1.00 0.00 C ATOM 73 CD1 ILE A 5 -3.266 6.025 -6.988 1.00 0.00 C ATOM 0 H ILE A 5 -6.894 2.958 -7.039 1.00 0.00 H new ATOM 0 HA ILE A 5 -4.233 2.112 -8.095 1.00 0.00 H new ATOM 0 HB ILE A 5 -4.829 3.896 -5.708 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -3.583 4.478 -8.429 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -5.057 5.165 -7.775 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -2.397 4.091 -5.440 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -2.973 2.422 -5.215 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -2.164 2.887 -6.731 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -3.241 6.804 -7.750 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -3.745 6.413 -6.089 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -2.248 5.716 -6.752 1.00 0.00 H new ATOM 85 N LEU A 6 -4.083 0.290 -6.405 1.00 0.00 N ATOM 86 CA LEU A 6 -4.048 -0.902 -5.555 1.00 0.00 C ATOM 87 C LEU A 6 -2.703 -0.934 -4.835 1.00 0.00 C ATOM 88 O LEU A 6 -1.685 -0.616 -5.450 1.00 0.00 O ATOM 89 CB LEU A 6 -4.212 -2.149 -6.442 1.00 0.00 C ATOM 90 CG LEU A 6 -4.148 -3.510 -5.717 1.00 0.00 C ATOM 91 CD1 LEU A 6 -5.288 -3.688 -4.710 1.00 0.00 C ATOM 92 CD2 LEU A 6 -4.203 -4.658 -6.732 1.00 0.00 C ATOM 0 H LEU A 6 -3.270 0.374 -7.015 1.00 0.00 H new ATOM 0 HA LEU A 6 -4.853 -0.884 -4.821 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -5.170 -2.080 -6.958 1.00 0.00 H new ATOM 0 HB3 LEU A 6 -3.436 -2.131 -7.207 1.00 0.00 H new ATOM 0 HG LEU A 6 -3.204 -3.529 -5.172 1.00 0.00 H new ATOM 0 HD11 LEU A 6 -5.198 -4.661 -4.227 1.00 0.00 H new ATOM 0 HD12 LEU A 6 -5.234 -2.902 -3.956 1.00 0.00 H new ATOM 0 HD13 LEU A 6 -6.245 -3.628 -5.229 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -4.157 -5.611 -6.206 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -5.133 -4.600 -7.297 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -3.358 -4.580 -7.416 1.00 0.00 H new ATOM 104 N VAL A 7 -2.687 -1.361 -3.572 1.00 0.00 N ATOM 105 CA VAL A 7 -1.458 -1.537 -2.803 1.00 0.00 C ATOM 106 C VAL A 7 -1.399 -2.998 -2.349 1.00 0.00 C ATOM 107 O VAL A 7 -2.416 -3.555 -1.923 1.00 0.00 O ATOM 108 CB VAL A 7 -1.399 -0.540 -1.622 1.00 0.00 C ATOM 109 CG1 VAL A 7 -0.007 -0.574 -0.971 1.00 0.00 C ATOM 110 CG2 VAL A 7 -1.693 0.910 -2.053 1.00 0.00 C ATOM 0 H VAL A 7 -3.533 -1.596 -3.052 1.00 0.00 H new ATOM 0 HA VAL A 7 -0.582 -1.320 -3.414 1.00 0.00 H new ATOM 0 HB VAL A 7 -2.169 -0.852 -0.917 1.00 0.00 H new ATOM 0 HG11 VAL A 7 0.024 0.132 -0.141 1.00 0.00 H new ATOM 0 HG12 VAL A 7 0.197 -1.579 -0.601 1.00 0.00 H new ATOM 0 HG13 VAL A 7 0.747 -0.299 -1.709 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -1.638 1.566 -1.184 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -0.958 1.226 -2.793 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -2.691 0.965 -2.487 1.00 0.00 H new ATOM 120 N VAL A 8 -0.219 -3.616 -2.455 1.00 0.00 N ATOM 121 CA VAL A 8 -0.060 -5.055 -2.266 1.00 0.00 C ATOM 122 C VAL A 8 1.137 -5.311 -1.347 1.00 0.00 C ATOM 123 O VAL A 8 2.205 -4.738 -1.571 1.00 0.00 O ATOM 124 CB VAL A 8 0.128 -5.737 -3.642 1.00 0.00 C ATOM 125 CG1 VAL A 8 0.065 -7.264 -3.497 1.00 0.00 C ATOM 126 CG2 VAL A 8 -0.926 -5.308 -4.679 1.00 0.00 C ATOM 0 H VAL A 8 0.651 -3.130 -2.674 1.00 0.00 H new ATOM 0 HA VAL A 8 -0.949 -5.477 -1.798 1.00 0.00 H new ATOM 0 HB VAL A 8 1.107 -5.419 -4.001 1.00 0.00 H new ATOM 0 HG11 VAL A 8 0.199 -7.728 -4.474 1.00 0.00 H new ATOM 0 HG12 VAL A 8 0.855 -7.599 -2.825 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -0.904 -7.551 -3.089 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -0.739 -5.822 -5.622 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -1.920 -5.567 -4.316 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -0.866 -4.231 -4.834 1.00 0.00 H new ATOM 136 N CYS A 9 0.985 -6.196 -0.353 1.00 0.00 N ATOM 137 CA CYS A 9 2.067 -6.554 0.580 1.00 0.00 C ATOM 138 C CYS A 9 2.063 -8.064 0.861 1.00 0.00 C ATOM 139 O CYS A 9 1.203 -8.782 0.354 1.00 0.00 O ATOM 140 CB CYS A 9 1.893 -5.796 1.910 1.00 0.00 C ATOM 141 SG CYS A 9 1.601 -4.024 1.662 1.00 0.00 S ATOM 0 H CYS A 9 0.109 -6.685 -0.171 1.00 0.00 H new ATOM 0 HA CYS A 9 3.015 -6.277 0.120 1.00 0.00 H new ATOM 0 HB2 CYS A 9 1.058 -6.225 2.463 1.00 0.00 H new ATOM 0 HB3 CYS A 9 2.784 -5.932 2.522 1.00 0.00 H new ATOM 0 HG CYS A 9 2.631 -3.351 2.082 1.00 0.00 H new ATOM 147 N VAL A 10 3.014 -8.570 1.651 1.00 0.00 N ATOM 148 CA VAL A 10 2.914 -9.944 2.165 1.00 0.00 C ATOM 149 C VAL A 10 2.313 -9.811 3.569 1.00 0.00 C ATOM 150 O VAL A 10 2.507 -8.780 4.223 1.00 0.00 O ATOM 151 CB VAL A 10 4.262 -10.696 2.142 1.00 0.00 C ATOM 152 CG1 VAL A 10 4.629 -11.049 0.693 1.00 0.00 C ATOM 153 CG2 VAL A 10 5.412 -9.947 2.829 1.00 0.00 C ATOM 0 H VAL A 10 3.848 -8.062 1.946 1.00 0.00 H new ATOM 0 HA VAL A 10 2.280 -10.561 1.528 1.00 0.00 H new ATOM 0 HB VAL A 10 4.122 -11.604 2.728 1.00 0.00 H new ATOM 0 HG11 VAL A 10 5.581 -11.580 0.678 1.00 0.00 H new ATOM 0 HG12 VAL A 10 3.853 -11.683 0.265 1.00 0.00 H new ATOM 0 HG13 VAL A 10 4.714 -10.134 0.106 1.00 0.00 H new ATOM 0 HG21 VAL A 10 6.322 -10.544 2.768 1.00 0.00 H new ATOM 0 HG22 VAL A 10 5.571 -8.990 2.332 1.00 0.00 H new ATOM 0 HG23 VAL A 10 5.160 -9.775 3.875 1.00 0.00 H new ATOM 163 N GLY A 11 1.515 -10.792 3.999 1.00 0.00 N ATOM 164 CA GLY A 11 0.714 -10.689 5.216 1.00 0.00 C ATOM 165 C GLY A 11 -0.578 -9.910 4.961 1.00 0.00 C ATOM 166 O GLY A 11 -1.637 -10.339 5.415 1.00 0.00 O ATOM 0 H GLY A 11 1.408 -11.681 3.510 1.00 0.00 H new ATOM 0 HA2 GLY A 11 0.474 -11.687 5.583 1.00 0.00 H new ATOM 0 HA3 GLY A 11 1.293 -10.194 5.995 1.00 0.00 H new ATOM 170 N ASN A 12 -0.495 -8.818 4.179 1.00 0.00 N ATOM 171 CA ASN A 12 -1.597 -7.896 3.853 1.00 0.00 C ATOM 172 C ASN A 12 -2.104 -7.140 5.079 1.00 0.00 C ATOM 173 O ASN A 12 -2.087 -5.910 5.056 1.00 0.00 O ATOM 174 CB ASN A 12 -2.735 -8.595 3.064 1.00 0.00 C ATOM 175 CG ASN A 12 -3.980 -7.770 2.699 1.00 0.00 C ATOM 176 OD1 ASN A 12 -4.770 -8.210 1.868 1.00 0.00 O ATOM 177 ND2 ASN A 12 -4.259 -6.637 3.322 1.00 0.00 N ATOM 0 H ASN A 12 0.382 -8.542 3.737 1.00 0.00 H new ATOM 0 HA ASN A 12 -1.184 -7.141 3.184 1.00 0.00 H new ATOM 0 HB2 ASN A 12 -2.309 -8.982 2.138 1.00 0.00 H new ATOM 0 HB3 ASN A 12 -3.065 -9.455 3.647 1.00 0.00 H new ATOM 0 HD21 ASN A 12 -5.123 -6.138 3.110 1.00 0.00 H new ATOM 0 HD22 ASN A 12 -3.610 -6.262 4.014 1.00 0.00 H new ATOM 184 N ILE A 13 -2.572 -7.827 6.119 1.00 0.00 N ATOM 185 CA ILE A 13 -3.290 -7.260 7.265 1.00 0.00 C ATOM 186 C ILE A 13 -2.538 -6.139 8.000 1.00 0.00 C ATOM 187 O ILE A 13 -3.149 -5.392 8.763 1.00 0.00 O ATOM 188 CB ILE A 13 -3.684 -8.397 8.242 1.00 0.00 C ATOM 189 CG1 ILE A 13 -2.461 -9.090 8.895 1.00 0.00 C ATOM 190 CG2 ILE A 13 -4.573 -9.432 7.528 1.00 0.00 C ATOM 191 CD1 ILE A 13 -2.840 -9.995 10.075 1.00 0.00 C ATOM 0 H ILE A 13 -2.458 -8.838 6.192 1.00 0.00 H new ATOM 0 HA ILE A 13 -4.182 -6.779 6.863 1.00 0.00 H new ATOM 0 HB ILE A 13 -4.245 -7.932 9.053 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -1.942 -9.683 8.142 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -1.761 -8.329 9.239 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -4.842 -10.224 8.227 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -5.478 -8.945 7.165 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -4.029 -9.860 6.686 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -1.940 -10.450 10.488 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -3.333 -9.401 10.845 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -3.517 -10.777 9.731 1.00 0.00 H new ATOM 203 N CYS A 14 -1.227 -6.026 7.785 1.00 0.00 N ATOM 204 CA CYS A 14 -0.340 -5.170 8.556 1.00 0.00 C ATOM 205 C CYS A 14 0.054 -3.881 7.825 1.00 0.00 C ATOM 206 O CYS A 14 0.518 -2.949 8.483 1.00 0.00 O ATOM 207 CB CYS A 14 0.920 -5.983 8.908 1.00 0.00 C ATOM 208 SG CYS A 14 1.649 -6.739 7.414 1.00 0.00 S ATOM 0 H CYS A 14 -0.745 -6.543 7.049 1.00 0.00 H new ATOM 0 HA CYS A 14 -0.875 -4.853 9.451 1.00 0.00 H new ATOM 0 HB2 CYS A 14 1.654 -5.334 9.387 1.00 0.00 H new ATOM 0 HB3 CYS A 14 0.666 -6.762 9.627 1.00 0.00 H new ATOM 0 HG CYS A 14 2.710 -7.415 7.743 1.00 0.00 H new ATOM 214 N ARG A 15 -0.081 -3.824 6.491 1.00 0.00 N ATOM 215 CA ARG A 15 0.483 -2.722 5.702 1.00 0.00 C ATOM 216 C ARG A 15 -0.428 -2.231 4.588 1.00 0.00 C ATOM 217 O ARG A 15 -0.576 -1.016 4.457 1.00 0.00 O ATOM 218 CB ARG A 15 1.838 -3.150 5.117 1.00 0.00 C ATOM 219 CG ARG A 15 2.972 -3.149 6.154 1.00 0.00 C ATOM 220 CD ARG A 15 4.317 -3.522 5.521 1.00 0.00 C ATOM 221 NE ARG A 15 4.387 -4.945 5.138 1.00 0.00 N ATOM 222 CZ ARG A 15 5.359 -5.484 4.391 1.00 0.00 C ATOM 223 NH1 ARG A 15 6.426 -4.782 4.034 1.00 0.00 N ATOM 224 NH2 ARG A 15 5.293 -6.749 3.999 1.00 0.00 N ATOM 0 H ARG A 15 -0.574 -4.526 5.939 1.00 0.00 H new ATOM 0 HA ARG A 15 0.604 -1.882 6.387 1.00 0.00 H new ATOM 0 HB2 ARG A 15 1.744 -4.149 4.692 1.00 0.00 H new ATOM 0 HB3 ARG A 15 2.102 -2.479 4.299 1.00 0.00 H new ATOM 0 HG2 ARG A 15 3.046 -2.163 6.612 1.00 0.00 H new ATOM 0 HG3 ARG A 15 2.737 -3.854 6.952 1.00 0.00 H new ATOM 0 HD2 ARG A 15 4.484 -2.903 4.639 1.00 0.00 H new ATOM 0 HD3 ARG A 15 5.120 -3.298 6.224 1.00 0.00 H new ATOM 0 HE ARG A 15 3.643 -5.561 5.465 1.00 0.00 H new ATOM 0 HH11 ARG A 15 6.519 -3.810 4.329 1.00 0.00 H new ATOM 0 HH12 ARG A 15 7.154 -5.214 3.465 1.00 0.00 H new ATOM 0 HH21 ARG A 15 4.495 -7.325 4.266 1.00 0.00 H new ATOM 0 HH22 ARG A 15 6.041 -7.146 3.430 1.00 0.00 H new ATOM 238 N SER A 16 -1.046 -3.120 3.803 1.00 0.00 N ATOM 239 CA SER A 16 -1.877 -2.699 2.680 1.00 0.00 C ATOM 240 C SER A 16 -2.992 -1.724 3.113 1.00 0.00 C ATOM 241 O SER A 16 -3.030 -0.620 2.561 1.00 0.00 O ATOM 242 CB SER A 16 -2.420 -3.914 1.921 1.00 0.00 C ATOM 243 OG SER A 16 -1.432 -4.922 1.770 1.00 0.00 O ATOM 0 H SER A 16 -0.984 -4.131 3.927 1.00 0.00 H new ATOM 0 HA SER A 16 -1.246 -2.139 1.990 1.00 0.00 H new ATOM 0 HB2 SER A 16 -3.278 -4.323 2.454 1.00 0.00 H new ATOM 0 HB3 SER A 16 -2.774 -3.601 0.939 1.00 0.00 H new ATOM 0 HG SER A 16 -0.544 -4.509 1.750 1.00 0.00 H new ATOM 249 N PRO A 17 -3.828 -2.025 4.136 1.00 0.00 N ATOM 250 CA PRO A 17 -4.859 -1.089 4.565 1.00 0.00 C ATOM 251 C PRO A 17 -4.266 0.174 5.190 1.00 0.00 C ATOM 252 O PRO A 17 -4.895 1.227 5.114 1.00 0.00 O ATOM 253 CB PRO A 17 -5.740 -1.840 5.566 1.00 0.00 C ATOM 254 CG PRO A 17 -4.814 -2.915 6.126 1.00 0.00 C ATOM 255 CD PRO A 17 -3.920 -3.247 4.931 1.00 0.00 C ATOM 0 HA PRO A 17 -5.439 -0.747 3.708 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -6.107 -1.179 6.351 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -6.614 -2.276 5.082 1.00 0.00 H new ATOM 0 HG2 PRO A 17 -4.236 -2.549 6.974 1.00 0.00 H new ATOM 0 HG3 PRO A 17 -5.369 -3.787 6.471 1.00 0.00 H new ATOM 0 HD2 PRO A 17 -2.933 -3.571 5.262 1.00 0.00 H new ATOM 0 HD3 PRO A 17 -4.343 -4.062 4.344 1.00 0.00 H new ATOM 263 N THR A 18 -3.075 0.097 5.785 1.00 0.00 N ATOM 264 CA THR A 18 -2.433 1.242 6.411 1.00 0.00 C ATOM 265 C THR A 18 -2.118 2.289 5.333 1.00 0.00 C ATOM 266 O THR A 18 -2.523 3.444 5.469 1.00 0.00 O ATOM 267 CB THR A 18 -1.181 0.763 7.178 1.00 0.00 C ATOM 268 OG1 THR A 18 -1.451 -0.470 7.829 1.00 0.00 O ATOM 269 CG2 THR A 18 -0.734 1.789 8.224 1.00 0.00 C ATOM 0 H THR A 18 -2.532 -0.764 5.844 1.00 0.00 H new ATOM 0 HA THR A 18 -3.090 1.718 7.139 1.00 0.00 H new ATOM 0 HB THR A 18 -0.380 0.637 6.450 1.00 0.00 H new ATOM 0 HG1 THR A 18 -0.651 -0.767 8.311 1.00 0.00 H new ATOM 0 HG21 THR A 18 0.149 1.418 8.744 1.00 0.00 H new ATOM 0 HG22 THR A 18 -0.495 2.731 7.731 1.00 0.00 H new ATOM 0 HG23 THR A 18 -1.537 1.949 8.943 1.00 0.00 H new ATOM 277 N ALA A 19 -1.475 1.881 4.229 1.00 0.00 N ATOM 278 CA ALA A 19 -1.218 2.775 3.102 1.00 0.00 C ATOM 279 C ALA A 19 -2.523 3.272 2.492 1.00 0.00 C ATOM 280 O ALA A 19 -2.676 4.465 2.244 1.00 0.00 O ATOM 281 CB ALA A 19 -0.434 2.051 2.010 1.00 0.00 C ATOM 0 H ALA A 19 -1.124 0.932 4.097 1.00 0.00 H new ATOM 0 HA ALA A 19 -0.642 3.618 3.484 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -0.252 2.733 1.179 1.00 0.00 H new ATOM 0 HB2 ALA A 19 0.519 1.708 2.413 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -1.008 1.194 1.657 1.00 0.00 H new ATOM 287 N GLU A 20 -3.454 2.355 2.235 1.00 0.00 N ATOM 288 CA GLU A 20 -4.688 2.674 1.541 1.00 0.00 C ATOM 289 C GLU A 20 -5.474 3.742 2.304 1.00 0.00 C ATOM 290 O GLU A 20 -5.853 4.765 1.729 1.00 0.00 O ATOM 291 CB GLU A 20 -5.462 1.366 1.354 1.00 0.00 C ATOM 292 CG GLU A 20 -6.795 1.535 0.624 1.00 0.00 C ATOM 293 CD GLU A 20 -8.000 1.365 1.558 1.00 0.00 C ATOM 294 OE1 GLU A 20 -8.376 2.338 2.251 1.00 0.00 O ATOM 295 OE2 GLU A 20 -8.567 0.249 1.602 1.00 0.00 O ATOM 0 H GLU A 20 -3.369 1.375 2.503 1.00 0.00 H new ATOM 0 HA GLU A 20 -4.494 3.106 0.559 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -4.841 0.664 0.798 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -5.648 0.922 2.332 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -6.832 2.523 0.165 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -6.859 0.805 -0.183 1.00 0.00 H new ATOM 302 N ARG A 21 -5.641 3.561 3.616 1.00 0.00 N ATOM 303 CA ARG A 21 -6.346 4.515 4.458 1.00 0.00 C ATOM 304 C ARG A 21 -5.563 5.814 4.595 1.00 0.00 C ATOM 305 O ARG A 21 -6.188 6.870 4.668 1.00 0.00 O ATOM 306 CB ARG A 21 -6.611 3.880 5.828 1.00 0.00 C ATOM 307 CG ARG A 21 -7.682 2.778 5.797 1.00 0.00 C ATOM 308 CD ARG A 21 -9.089 3.348 5.578 1.00 0.00 C ATOM 309 NE ARG A 21 -10.127 2.367 5.951 1.00 0.00 N ATOM 310 CZ ARG A 21 -10.689 1.454 5.145 1.00 0.00 C ATOM 311 NH1 ARG A 21 -10.348 1.355 3.867 1.00 0.00 N ATOM 312 NH2 ARG A 21 -11.607 0.617 5.616 1.00 0.00 N ATOM 0 H ARG A 21 -5.289 2.747 4.120 1.00 0.00 H new ATOM 0 HA ARG A 21 -7.299 4.765 3.991 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -5.681 3.461 6.211 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -6.921 4.658 6.526 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -7.450 2.070 5.001 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -7.658 2.223 6.735 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -9.213 4.255 6.170 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -9.211 3.630 4.532 1.00 0.00 H new ATOM 0 HE ARG A 21 -10.449 2.385 6.919 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -9.644 1.982 3.477 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -10.790 0.652 3.274 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -11.888 0.667 6.595 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -12.031 -0.075 4.998 1.00 0.00 H new ATOM 326 N LEU A 22 -4.226 5.778 4.607 1.00 0.00 N ATOM 327 CA LEU A 22 -3.429 7.002 4.623 1.00 0.00 C ATOM 328 C LEU A 22 -3.739 7.822 3.373 1.00 0.00 C ATOM 329 O LEU A 22 -3.971 9.026 3.478 1.00 0.00 O ATOM 330 CB LEU A 22 -1.926 6.685 4.717 1.00 0.00 C ATOM 331 CG LEU A 22 -1.430 6.445 6.154 1.00 0.00 C ATOM 332 CD1 LEU A 22 -0.067 5.747 6.118 1.00 0.00 C ATOM 333 CD2 LEU A 22 -1.305 7.771 6.910 1.00 0.00 C ATOM 0 H LEU A 22 -3.678 4.917 4.606 1.00 0.00 H new ATOM 0 HA LEU A 22 -3.691 7.584 5.506 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -1.713 5.801 4.117 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -1.362 7.510 4.281 1.00 0.00 H new ATOM 0 HG LEU A 22 -2.153 5.814 6.671 1.00 0.00 H new ATOM 0 HD11 LEU A 22 0.282 5.578 7.137 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -0.161 4.791 5.603 1.00 0.00 H new ATOM 0 HD13 LEU A 22 0.649 6.375 5.588 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -0.953 7.580 7.924 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -0.595 8.418 6.395 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -2.278 8.260 6.950 1.00 0.00 H new ATOM 345 N LEU A 23 -3.820 7.181 2.201 1.00 0.00 N ATOM 346 CA LEU A 23 -4.243 7.871 0.988 1.00 0.00 C ATOM 347 C LEU A 23 -5.689 8.356 1.107 1.00 0.00 C ATOM 348 O LEU A 23 -5.966 9.450 0.624 1.00 0.00 O ATOM 349 CB LEU A 23 -4.079 7.003 -0.275 1.00 0.00 C ATOM 350 CG LEU A 23 -2.703 7.005 -0.978 1.00 0.00 C ATOM 351 CD1 LEU A 23 -2.166 8.418 -1.250 1.00 0.00 C ATOM 352 CD2 LEU A 23 -1.644 6.190 -0.233 1.00 0.00 C ATOM 0 H LEU A 23 -3.599 6.194 2.072 1.00 0.00 H new ATOM 0 HA LEU A 23 -3.585 8.733 0.880 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -4.316 5.974 -0.007 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -4.826 7.324 -1.001 1.00 0.00 H new ATOM 0 HG LEU A 23 -2.893 6.521 -1.936 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -1.197 8.350 -1.745 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -2.864 8.955 -1.891 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -2.055 8.953 -0.307 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -0.702 6.232 -0.779 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -1.503 6.603 0.766 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -1.971 5.153 -0.154 1.00 0.00 H new ATOM 364 N GLN A 24 -6.603 7.620 1.755 1.00 0.00 N ATOM 365 CA GLN A 24 -7.973 8.103 1.963 1.00 0.00 C ATOM 366 C GLN A 24 -7.996 9.380 2.810 1.00 0.00 C ATOM 367 O GLN A 24 -8.790 10.271 2.514 1.00 0.00 O ATOM 368 CB GLN A 24 -8.901 7.048 2.600 1.00 0.00 C ATOM 369 CG GLN A 24 -9.171 5.798 1.751 1.00 0.00 C ATOM 370 CD GLN A 24 -9.648 6.148 0.343 1.00 0.00 C ATOM 371 OE1 GLN A 24 -10.788 6.552 0.134 1.00 0.00 O ATOM 372 NE2 GLN A 24 -8.769 6.035 -0.638 1.00 0.00 N ATOM 0 H GLN A 24 -6.419 6.694 2.141 1.00 0.00 H new ATOM 0 HA GLN A 24 -8.357 8.320 0.966 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -8.465 6.733 3.548 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -9.855 7.522 2.829 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -8.261 5.201 1.687 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -9.922 5.181 2.244 1.00 0.00 H new ATOM 0 HE21 GLN A 24 -7.827 5.697 -0.442 1.00 0.00 H new ATOM 0 HE22 GLN A 24 -9.033 6.286 -1.591 1.00 0.00 H new ATOM 381 N ARG A 25 -7.137 9.502 3.836 1.00 0.00 N ATOM 382 CA ARG A 25 -7.046 10.729 4.629 1.00 0.00 C ATOM 383 C ARG A 25 -6.704 11.901 3.705 1.00 0.00 C ATOM 384 O ARG A 25 -7.380 12.930 3.747 1.00 0.00 O ATOM 385 CB ARG A 25 -6.012 10.588 5.769 1.00 0.00 C ATOM 386 CG ARG A 25 -6.054 11.792 6.734 1.00 0.00 C ATOM 387 CD ARG A 25 -4.774 11.962 7.562 1.00 0.00 C ATOM 388 NE ARG A 25 -4.640 10.975 8.653 1.00 0.00 N ATOM 389 CZ ARG A 25 -3.486 10.459 9.105 1.00 0.00 C ATOM 390 NH1 ARG A 25 -2.339 10.700 8.474 1.00 0.00 N ATOM 391 NH2 ARG A 25 -3.477 9.702 10.195 1.00 0.00 N ATOM 0 H ARG A 25 -6.498 8.764 4.132 1.00 0.00 H new ATOM 0 HA ARG A 25 -8.009 10.919 5.102 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -6.206 9.670 6.324 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -5.012 10.498 5.344 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -6.228 12.702 6.159 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -6.901 11.675 7.410 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -3.911 11.881 6.902 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -4.757 12.966 7.987 1.00 0.00 H new ATOM 0 HE ARG A 25 -5.499 10.658 9.102 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -2.330 11.283 7.637 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -1.469 10.302 8.828 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -4.348 9.511 10.691 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -2.599 9.311 10.537 1.00 0.00 H new ATOM 405 N TYR A 26 -5.667 11.742 2.877 1.00 0.00 N ATOM 406 CA TYR A 26 -5.217 12.808 1.991 1.00 0.00 C ATOM 407 C TYR A 26 -6.242 13.113 0.892 1.00 0.00 C ATOM 408 O TYR A 26 -6.484 14.288 0.610 1.00 0.00 O ATOM 409 CB TYR A 26 -3.842 12.469 1.399 1.00 0.00 C ATOM 410 CG TYR A 26 -2.702 12.600 2.399 1.00 0.00 C ATOM 411 CD1 TYR A 26 -2.395 13.865 2.934 1.00 0.00 C ATOM 412 CD2 TYR A 26 -1.961 11.473 2.811 1.00 0.00 C ATOM 413 CE1 TYR A 26 -1.388 14.004 3.903 1.00 0.00 C ATOM 414 CE2 TYR A 26 -0.950 11.604 3.783 1.00 0.00 C ATOM 415 CZ TYR A 26 -0.669 12.872 4.345 1.00 0.00 C ATOM 416 OH TYR A 26 0.287 13.018 5.308 1.00 0.00 O ATOM 0 H TYR A 26 -5.125 10.881 2.805 1.00 0.00 H new ATOM 0 HA TYR A 26 -5.119 13.716 2.587 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -3.862 11.449 1.014 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -3.648 13.126 0.551 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -2.938 14.736 2.597 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -2.170 10.505 2.379 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -1.163 14.978 4.311 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -0.389 10.737 4.099 1.00 0.00 H new ATOM 0 HH TYR A 26 0.690 12.146 5.503 1.00 0.00 H new ATOM 426 N HIS A 27 -6.859 12.090 0.293 1.00 0.00 N ATOM 427 CA HIS A 27 -7.749 12.212 -0.854 1.00 0.00 C ATOM 428 C HIS A 27 -8.852 11.144 -0.771 1.00 0.00 C ATOM 429 O HIS A 27 -8.643 10.022 -1.237 1.00 0.00 O ATOM 430 CB HIS A 27 -6.953 12.047 -2.165 1.00 0.00 C ATOM 431 CG HIS A 27 -5.926 13.116 -2.435 1.00 0.00 C ATOM 432 ND1 HIS A 27 -6.173 14.450 -2.679 1.00 0.00 N ATOM 433 CD2 HIS A 27 -4.574 12.930 -2.535 1.00 0.00 C ATOM 434 CE1 HIS A 27 -4.994 15.053 -2.904 1.00 0.00 C ATOM 435 NE2 HIS A 27 -3.986 14.165 -2.831 1.00 0.00 N ATOM 0 H HIS A 27 -6.746 11.126 0.607 1.00 0.00 H new ATOM 0 HA HIS A 27 -8.207 13.201 -0.844 1.00 0.00 H new ATOM 0 HB2 HIS A 27 -6.450 11.080 -2.146 1.00 0.00 H new ATOM 0 HB3 HIS A 27 -7.657 12.024 -2.997 1.00 0.00 H new ATOM 0 HD2 HIS A 27 -4.052 11.993 -2.408 1.00 0.00 H new ATOM 0 HE1 HIS A 27 -4.872 16.105 -3.114 1.00 0.00 H new ATOM 0 HE2 HIS A 27 -2.993 14.354 -2.965 1.00 0.00 H new ATOM 443 N PRO A 28 -10.049 11.454 -0.246 1.00 0.00 N ATOM 444 CA PRO A 28 -11.170 10.514 -0.268 1.00 0.00 C ATOM 445 C PRO A 28 -11.729 10.301 -1.689 1.00 0.00 C ATOM 446 O PRO A 28 -12.450 9.331 -1.926 1.00 0.00 O ATOM 447 CB PRO A 28 -12.211 11.110 0.684 1.00 0.00 C ATOM 448 CG PRO A 28 -11.939 12.613 0.622 1.00 0.00 C ATOM 449 CD PRO A 28 -10.425 12.691 0.425 1.00 0.00 C ATOM 0 HA PRO A 28 -10.862 9.518 0.050 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -13.226 10.873 0.366 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -12.096 10.723 1.697 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -12.476 13.085 -0.201 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -12.252 13.116 1.537 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -10.153 13.560 -0.175 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -9.911 12.790 1.381 1.00 0.00 H new ATOM 457 N GLU A 29 -11.405 11.192 -2.638 1.00 0.00 N ATOM 458 CA GLU A 29 -11.810 11.060 -4.040 1.00 0.00 C ATOM 459 C GLU A 29 -10.872 10.107 -4.810 1.00 0.00 C ATOM 460 O GLU A 29 -11.202 9.653 -5.910 1.00 0.00 O ATOM 461 CB GLU A 29 -11.832 12.471 -4.656 1.00 0.00 C ATOM 462 CG GLU A 29 -12.473 12.535 -6.050 1.00 0.00 C ATOM 463 CD GLU A 29 -12.662 13.991 -6.517 1.00 0.00 C ATOM 464 OE1 GLU A 29 -11.711 14.588 -7.072 1.00 0.00 O ATOM 465 OE2 GLU A 29 -13.771 14.550 -6.354 1.00 0.00 O ATOM 0 H GLU A 29 -10.852 12.028 -2.450 1.00 0.00 H new ATOM 0 HA GLU A 29 -12.803 10.616 -4.106 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -12.374 13.140 -3.987 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -10.810 12.844 -4.720 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -11.847 12.001 -6.765 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -13.438 12.029 -6.032 1.00 0.00 H new ATOM 472 N LEU A 30 -9.699 9.791 -4.250 1.00 0.00 N ATOM 473 CA LEU A 30 -8.750 8.857 -4.843 1.00 0.00 C ATOM 474 C LEU A 30 -9.206 7.448 -4.466 1.00 0.00 C ATOM 475 O LEU A 30 -9.355 7.145 -3.276 1.00 0.00 O ATOM 476 CB LEU A 30 -7.346 9.178 -4.308 1.00 0.00 C ATOM 477 CG LEU A 30 -6.211 8.356 -4.935 1.00 0.00 C ATOM 478 CD1 LEU A 30 -6.029 8.700 -6.415 1.00 0.00 C ATOM 479 CD2 LEU A 30 -4.916 8.647 -4.169 1.00 0.00 C ATOM 0 H LEU A 30 -9.384 10.184 -3.363 1.00 0.00 H new ATOM 0 HA LEU A 30 -8.711 8.935 -5.929 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -7.143 10.236 -4.474 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -7.338 9.017 -3.230 1.00 0.00 H new ATOM 0 HG LEU A 30 -6.461 7.297 -4.869 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -5.218 8.102 -6.831 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -6.952 8.486 -6.954 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -5.787 9.758 -6.516 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -4.099 8.070 -4.603 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -4.685 9.710 -4.236 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -5.042 8.368 -3.123 1.00 0.00 H new ATOM 491 N LYS A 31 -9.434 6.580 -5.457 1.00 0.00 N ATOM 492 CA LYS A 31 -9.826 5.208 -5.161 1.00 0.00 C ATOM 493 C LYS A 31 -8.529 4.467 -4.883 1.00 0.00 C ATOM 494 O LYS A 31 -7.692 4.348 -5.781 1.00 0.00 O ATOM 495 CB LYS A 31 -10.581 4.610 -6.359 1.00 0.00 C ATOM 496 CG LYS A 31 -11.065 3.170 -6.101 1.00 0.00 C ATOM 497 CD LYS A 31 -11.603 2.498 -7.373 1.00 0.00 C ATOM 498 CE LYS A 31 -12.822 3.225 -7.962 1.00 0.00 C ATOM 499 NZ LYS A 31 -13.175 2.712 -9.307 1.00 0.00 N ATOM 0 H LYS A 31 -9.355 6.801 -6.450 1.00 0.00 H new ATOM 0 HA LYS A 31 -10.500 5.139 -4.307 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -11.439 5.240 -6.593 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -9.931 4.619 -7.234 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -10.241 2.579 -5.701 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -11.847 3.183 -5.341 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -10.811 2.461 -8.121 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -11.875 1.467 -7.146 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -13.674 3.106 -7.293 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -12.613 4.293 -8.024 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -14.032 3.192 -9.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -12.391 2.895 -9.965 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -13.350 1.688 -9.253 1.00 0.00 H new ATOM 513 N VAL A 32 -8.365 3.961 -3.667 1.00 0.00 N ATOM 514 CA VAL A 32 -7.220 3.141 -3.312 1.00 0.00 C ATOM 515 C VAL A 32 -7.785 1.900 -2.633 1.00 0.00 C ATOM 516 O VAL A 32 -8.739 1.992 -1.857 1.00 0.00 O ATOM 517 CB VAL A 32 -6.208 3.918 -2.443 1.00 0.00 C ATOM 518 CG1 VAL A 32 -4.890 3.139 -2.307 1.00 0.00 C ATOM 519 CG2 VAL A 32 -5.890 5.296 -3.039 1.00 0.00 C ATOM 0 H VAL A 32 -9.023 4.109 -2.902 1.00 0.00 H new ATOM 0 HA VAL A 32 -6.642 2.850 -4.189 1.00 0.00 H new ATOM 0 HB VAL A 32 -6.672 4.045 -1.465 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -4.194 3.707 -1.690 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -5.084 2.174 -1.839 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -4.456 2.983 -3.295 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -5.174 5.813 -2.399 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -5.464 5.172 -4.034 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -6.806 5.883 -3.107 1.00 0.00 H new ATOM 529 N GLU A 33 -7.209 0.749 -2.959 1.00 0.00 N ATOM 530 CA GLU A 33 -7.661 -0.545 -2.475 1.00 0.00 C ATOM 531 C GLU A 33 -6.439 -1.362 -2.042 1.00 0.00 C ATOM 532 O GLU A 33 -5.298 -1.002 -2.351 1.00 0.00 O ATOM 533 CB GLU A 33 -8.460 -1.228 -3.600 1.00 0.00 C ATOM 534 CG GLU A 33 -9.888 -0.665 -3.743 1.00 0.00 C ATOM 535 CD GLU A 33 -10.790 -0.943 -2.526 1.00 0.00 C ATOM 536 OE1 GLU A 33 -10.634 -2.005 -1.881 1.00 0.00 O ATOM 537 OE2 GLU A 33 -11.698 -0.129 -2.241 1.00 0.00 O ATOM 0 H GLU A 33 -6.401 0.690 -3.578 1.00 0.00 H new ATOM 0 HA GLU A 33 -8.315 -0.449 -1.608 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -7.929 -1.104 -4.544 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -8.514 -2.299 -3.403 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -9.830 0.412 -3.902 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -10.350 -1.094 -4.632 1.00 0.00 H new ATOM 544 N SER A 34 -6.684 -2.467 -1.334 1.00 0.00 N ATOM 545 CA SER A 34 -5.631 -3.260 -0.700 1.00 0.00 C ATOM 546 C SER A 34 -5.703 -4.723 -1.142 1.00 0.00 C ATOM 547 O SER A 34 -6.796 -5.218 -1.437 1.00 0.00 O ATOM 548 CB SER A 34 -5.841 -3.188 0.815 1.00 0.00 C ATOM 549 OG SER A 34 -5.774 -1.862 1.294 1.00 0.00 O ATOM 0 H SER A 34 -7.623 -2.837 -1.184 1.00 0.00 H new ATOM 0 HA SER A 34 -4.657 -2.865 -0.988 1.00 0.00 H new ATOM 0 HB2 SER A 34 -6.811 -3.617 1.068 1.00 0.00 H new ATOM 0 HB3 SER A 34 -5.085 -3.793 1.315 1.00 0.00 H new ATOM 0 HG SER A 34 -6.462 -1.726 1.978 1.00 0.00 H new ATOM 555 N ALA A 35 -4.559 -5.414 -1.152 1.00 0.00 N ATOM 556 CA ALA A 35 -4.468 -6.863 -1.335 1.00 0.00 C ATOM 557 C ALA A 35 -3.095 -7.334 -0.823 1.00 0.00 C ATOM 558 O ALA A 35 -2.322 -6.554 -0.247 1.00 0.00 O ATOM 559 CB ALA A 35 -4.646 -7.210 -2.826 1.00 0.00 C ATOM 0 H ALA A 35 -3.649 -4.969 -1.030 1.00 0.00 H new ATOM 0 HA ALA A 35 -5.254 -7.368 -0.774 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -4.578 -8.290 -2.959 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -5.622 -6.863 -3.166 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -3.864 -6.723 -3.409 1.00 0.00 H new ATOM 565 N GLY A 36 -2.742 -8.596 -1.073 1.00 0.00 N ATOM 566 CA GLY A 36 -1.391 -9.077 -0.827 1.00 0.00 C ATOM 567 C GLY A 36 -0.986 -10.252 -1.701 1.00 0.00 C ATOM 568 O GLY A 36 -1.838 -10.969 -2.219 1.00 0.00 O ATOM 0 H GLY A 36 -3.378 -9.301 -1.446 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -0.690 -8.258 -0.988 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -1.305 -9.369 0.220 1.00 0.00 H new ATOM 572 N LEU A 37 0.324 -10.463 -1.847 1.00 0.00 N ATOM 573 CA LEU A 37 0.858 -11.659 -2.504 1.00 0.00 C ATOM 574 C LEU A 37 0.566 -12.866 -1.616 1.00 0.00 C ATOM 575 O LEU A 37 -0.076 -13.823 -2.048 1.00 0.00 O ATOM 576 CB LEU A 37 2.378 -11.513 -2.724 1.00 0.00 C ATOM 577 CG LEU A 37 2.744 -10.768 -4.021 1.00 0.00 C ATOM 578 CD1 LEU A 37 4.189 -10.267 -3.941 1.00 0.00 C ATOM 579 CD2 LEU A 37 2.594 -11.680 -5.247 1.00 0.00 C ATOM 0 H LEU A 37 1.040 -9.816 -1.516 1.00 0.00 H new ATOM 0 HA LEU A 37 0.387 -11.791 -3.478 1.00 0.00 H new ATOM 0 HB2 LEU A 37 2.810 -10.982 -1.876 1.00 0.00 H new ATOM 0 HB3 LEU A 37 2.831 -12.504 -2.744 1.00 0.00 H new ATOM 0 HG LEU A 37 2.061 -9.925 -4.129 1.00 0.00 H new ATOM 0 HD11 LEU A 37 4.443 -9.741 -4.861 1.00 0.00 H new ATOM 0 HD12 LEU A 37 4.292 -9.588 -3.094 1.00 0.00 H new ATOM 0 HD13 LEU A 37 4.861 -11.115 -3.811 1.00 0.00 H new ATOM 0 HD21 LEU A 37 2.859 -11.126 -6.147 1.00 0.00 H new ATOM 0 HD22 LEU A 37 3.254 -12.541 -5.143 1.00 0.00 H new ATOM 0 HD23 LEU A 37 1.562 -12.022 -5.322 1.00 0.00 H new ATOM 591 N GLY A 38 0.971 -12.764 -0.348 1.00 0.00 N ATOM 592 CA GLY A 38 0.733 -13.778 0.671 1.00 0.00 C ATOM 593 C GLY A 38 -0.269 -13.226 1.675 1.00 0.00 C ATOM 594 O GLY A 38 0.036 -13.129 2.864 1.00 0.00 O ATOM 0 H GLY A 38 1.484 -11.955 0.002 1.00 0.00 H new ATOM 0 HA2 GLY A 38 0.349 -14.691 0.215 1.00 0.00 H new ATOM 0 HA3 GLY A 38 1.666 -14.039 1.171 1.00 0.00 H new ATOM 598 N ALA A 39 -1.408 -12.740 1.171 1.00 0.00 N ATOM 599 CA ALA A 39 -2.480 -12.226 2.012 1.00 0.00 C ATOM 600 C ALA A 39 -3.131 -13.345 2.830 1.00 0.00 C ATOM 601 O ALA A 39 -2.922 -14.535 2.581 1.00 0.00 O ATOM 602 CB ALA A 39 -3.546 -11.562 1.139 1.00 0.00 C ATOM 0 H ALA A 39 -1.607 -12.694 0.172 1.00 0.00 H new ATOM 0 HA ALA A 39 -2.048 -11.499 2.700 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -4.347 -11.178 1.771 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -3.099 -10.739 0.581 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -3.953 -12.294 0.442 1.00 0.00 H new ATOM 608 N LEU A 40 -3.998 -12.934 3.756 1.00 0.00 N ATOM 609 CA LEU A 40 -4.690 -13.826 4.678 1.00 0.00 C ATOM 610 C LEU A 40 -6.175 -13.592 4.422 1.00 0.00 C ATOM 611 O LEU A 40 -6.831 -12.859 5.161 1.00 0.00 O ATOM 612 CB LEU A 40 -4.261 -13.504 6.124 1.00 0.00 C ATOM 613 CG LEU A 40 -2.761 -13.740 6.406 1.00 0.00 C ATOM 614 CD1 LEU A 40 -2.395 -13.186 7.785 1.00 0.00 C ATOM 615 CD2 LEU A 40 -2.378 -15.223 6.332 1.00 0.00 C ATOM 0 H LEU A 40 -4.241 -11.952 3.886 1.00 0.00 H new ATOM 0 HA LEU A 40 -4.451 -14.879 4.530 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -4.500 -12.462 6.339 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -4.849 -14.114 6.810 1.00 0.00 H new ATOM 0 HG LEU A 40 -2.203 -13.216 5.630 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -1.336 -13.356 7.976 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -2.601 -12.116 7.814 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -2.987 -13.690 8.549 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -1.313 -15.335 6.538 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -2.951 -15.784 7.070 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -2.597 -15.606 5.335 1.00 0.00 H new ATOM 627 N VAL A 41 -6.658 -14.108 3.289 1.00 0.00 N ATOM 628 CA VAL A 41 -7.989 -13.807 2.772 1.00 0.00 C ATOM 629 C VAL A 41 -9.069 -13.901 3.864 1.00 0.00 C ATOM 630 O VAL A 41 -9.171 -14.903 4.577 1.00 0.00 O ATOM 631 CB VAL A 41 -8.267 -14.647 1.503 1.00 0.00 C ATOM 632 CG1 VAL A 41 -8.202 -16.167 1.721 1.00 0.00 C ATOM 633 CG2 VAL A 41 -9.608 -14.275 0.856 1.00 0.00 C ATOM 0 H VAL A 41 -6.129 -14.752 2.702 1.00 0.00 H new ATOM 0 HA VAL A 41 -8.028 -12.764 2.458 1.00 0.00 H new ATOM 0 HB VAL A 41 -7.451 -14.392 0.826 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -8.409 -16.679 0.781 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -7.207 -16.442 2.072 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -8.943 -16.460 2.464 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -9.766 -14.887 -0.032 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -10.416 -14.451 1.566 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -9.596 -13.222 0.573 1.00 0.00 H new ATOM 643 N GLY A 42 -9.854 -12.828 3.996 1.00 0.00 N ATOM 644 CA GLY A 42 -10.978 -12.765 4.921 1.00 0.00 C ATOM 645 C GLY A 42 -10.622 -12.170 6.287 1.00 0.00 C ATOM 646 O GLY A 42 -11.537 -11.779 7.015 1.00 0.00 O ATOM 0 H GLY A 42 -9.722 -11.973 3.456 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -11.773 -12.170 4.472 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -11.375 -13.770 5.065 1.00 0.00 H new ATOM 650 N LYS A 43 -9.336 -12.076 6.659 1.00 0.00 N ATOM 651 CA LYS A 43 -8.948 -11.426 7.916 1.00 0.00 C ATOM 652 C LYS A 43 -9.201 -9.929 7.802 1.00 0.00 C ATOM 653 O LYS A 43 -9.148 -9.363 6.706 1.00 0.00 O ATOM 654 CB LYS A 43 -7.475 -11.700 8.281 1.00 0.00 C ATOM 655 CG LYS A 43 -7.247 -13.001 9.071 1.00 0.00 C ATOM 656 CD LYS A 43 -7.879 -14.241 8.422 1.00 0.00 C ATOM 657 CE LYS A 43 -7.672 -15.526 9.240 1.00 0.00 C ATOM 658 NZ LYS A 43 -6.261 -15.985 9.286 1.00 0.00 N ATOM 0 H LYS A 43 -8.555 -12.439 6.112 1.00 0.00 H new ATOM 0 HA LYS A 43 -9.554 -11.845 8.719 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -6.887 -11.739 7.364 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -7.097 -10.862 8.867 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -6.175 -13.166 9.179 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -7.654 -12.881 10.075 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -8.947 -14.070 8.291 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -7.454 -14.379 7.428 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -8.023 -15.358 10.258 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -8.289 -16.319 8.817 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -6.197 -16.854 9.853 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -5.927 -16.177 8.320 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -5.669 -15.246 9.717 1.00 0.00 H new ATOM 672 N GLY A 44 -9.446 -9.288 8.941 1.00 0.00 N ATOM 673 CA GLY A 44 -9.516 -7.843 9.014 1.00 0.00 C ATOM 674 C GLY A 44 -8.116 -7.241 9.041 1.00 0.00 C ATOM 675 O GLY A 44 -7.108 -7.939 8.906 1.00 0.00 O ATOM 0 H GLY A 44 -9.600 -9.759 9.833 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -10.068 -7.456 8.157 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -10.064 -7.544 9.908 1.00 0.00 H new ATOM 679 N ALA A 45 -8.065 -5.923 9.225 1.00 0.00 N ATOM 680 CA ALA A 45 -6.804 -5.241 9.501 1.00 0.00 C ATOM 681 C ALA A 45 -6.251 -5.762 10.837 1.00 0.00 C ATOM 682 O ALA A 45 -7.011 -6.159 11.725 1.00 0.00 O ATOM 683 CB ALA A 45 -7.018 -3.723 9.527 1.00 0.00 C ATOM 0 H ALA A 45 -8.879 -5.309 9.188 1.00 0.00 H new ATOM 0 HA ALA A 45 -6.078 -5.448 8.715 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -6.070 -3.225 9.734 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -7.398 -3.393 8.560 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -7.738 -3.470 10.305 1.00 0.00 H new ATOM 689 N ASP A 46 -4.927 -5.772 10.978 1.00 0.00 N ATOM 690 CA ASP A 46 -4.277 -6.321 12.165 1.00 0.00 C ATOM 691 C ASP A 46 -4.510 -5.405 13.373 1.00 0.00 C ATOM 692 O ASP A 46 -4.338 -4.193 13.225 1.00 0.00 O ATOM 693 CB ASP A 46 -2.774 -6.472 11.938 1.00 0.00 C ATOM 694 CG ASP A 46 -2.162 -7.130 13.171 1.00 0.00 C ATOM 695 OD1 ASP A 46 -2.316 -8.361 13.324 1.00 0.00 O ATOM 696 OD2 ASP A 46 -1.554 -6.417 13.995 1.00 0.00 O ATOM 0 H ASP A 46 -4.281 -5.404 10.280 1.00 0.00 H new ATOM 0 HA ASP A 46 -4.711 -7.302 12.360 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -2.584 -7.077 11.052 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -2.318 -5.498 11.763 1.00 0.00 H new ATOM 701 N PRO A 47 -4.850 -5.919 14.569 1.00 0.00 N ATOM 702 CA PRO A 47 -5.023 -5.108 15.771 1.00 0.00 C ATOM 703 C PRO A 47 -3.869 -4.146 16.078 1.00 0.00 C ATOM 704 O PRO A 47 -4.118 -3.062 16.609 1.00 0.00 O ATOM 705 CB PRO A 47 -5.226 -6.105 16.915 1.00 0.00 C ATOM 706 CG PRO A 47 -5.882 -7.294 16.219 1.00 0.00 C ATOM 707 CD PRO A 47 -5.204 -7.304 14.851 1.00 0.00 C ATOM 0 HA PRO A 47 -5.873 -4.441 15.628 1.00 0.00 H new ATOM 0 HB2 PRO A 47 -4.281 -6.382 17.382 1.00 0.00 H new ATOM 0 HB3 PRO A 47 -5.862 -5.695 17.700 1.00 0.00 H new ATOM 0 HG2 PRO A 47 -5.712 -8.224 16.761 1.00 0.00 H new ATOM 0 HG3 PRO A 47 -6.961 -7.168 16.134 1.00 0.00 H new ATOM 0 HD2 PRO A 47 -4.318 -7.939 14.859 1.00 0.00 H new ATOM 0 HD3 PRO A 47 -5.873 -7.699 14.087 1.00 0.00 H new ATOM 715 N THR A 48 -2.622 -4.488 15.752 1.00 0.00 N ATOM 716 CA THR A 48 -1.480 -3.628 16.046 1.00 0.00 C ATOM 717 C THR A 48 -1.457 -2.473 15.041 1.00 0.00 C ATOM 718 O THR A 48 -1.249 -1.323 15.430 1.00 0.00 O ATOM 719 CB THR A 48 -0.160 -4.428 15.991 1.00 0.00 C ATOM 720 OG1 THR A 48 -0.357 -5.808 16.237 1.00 0.00 O ATOM 721 CG2 THR A 48 0.856 -3.883 17.003 1.00 0.00 C ATOM 0 H THR A 48 -2.379 -5.360 15.282 1.00 0.00 H new ATOM 0 HA THR A 48 -1.579 -3.229 17.056 1.00 0.00 H new ATOM 0 HB THR A 48 0.226 -4.310 14.979 1.00 0.00 H new ATOM 0 HG1 THR A 48 -0.572 -6.263 15.396 1.00 0.00 H new ATOM 0 HG21 THR A 48 1.776 -4.464 16.944 1.00 0.00 H new ATOM 0 HG22 THR A 48 1.071 -2.839 16.776 1.00 0.00 H new ATOM 0 HG23 THR A 48 0.444 -3.958 18.009 1.00 0.00 H new ATOM 729 N ALA A 49 -1.744 -2.762 13.765 1.00 0.00 N ATOM 730 CA ALA A 49 -1.853 -1.742 12.735 1.00 0.00 C ATOM 731 C ALA A 49 -3.012 -0.796 13.056 1.00 0.00 C ATOM 732 O ALA A 49 -2.838 0.420 12.989 1.00 0.00 O ATOM 733 CB ALA A 49 -2.050 -2.415 11.372 1.00 0.00 C ATOM 0 H ALA A 49 -1.905 -3.711 13.426 1.00 0.00 H new ATOM 0 HA ALA A 49 -0.937 -1.152 12.702 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -2.132 -1.652 10.598 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -1.197 -3.059 11.158 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -2.961 -3.013 11.390 1.00 0.00 H new ATOM 739 N ILE A 50 -4.167 -1.340 13.458 1.00 0.00 N ATOM 740 CA ILE A 50 -5.319 -0.560 13.902 1.00 0.00 C ATOM 741 C ILE A 50 -4.888 0.331 15.068 1.00 0.00 C ATOM 742 O ILE A 50 -5.157 1.527 15.025 1.00 0.00 O ATOM 743 CB ILE A 50 -6.494 -1.491 14.291 1.00 0.00 C ATOM 744 CG1 ILE A 50 -7.070 -2.223 13.056 1.00 0.00 C ATOM 745 CG2 ILE A 50 -7.632 -0.721 14.997 1.00 0.00 C ATOM 746 CD1 ILE A 50 -7.981 -3.409 13.401 1.00 0.00 C ATOM 0 H ILE A 50 -4.326 -2.347 13.483 1.00 0.00 H new ATOM 0 HA ILE A 50 -5.676 0.073 13.090 1.00 0.00 H new ATOM 0 HB ILE A 50 -6.084 -2.225 14.985 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -7.632 -1.510 12.453 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -6.244 -2.580 12.440 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -8.435 -1.412 15.252 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -7.249 -0.258 15.907 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -8.016 0.052 14.331 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -8.344 -3.868 12.482 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -7.419 -4.144 13.977 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -8.828 -3.058 13.990 1.00 0.00 H new ATOM 758 N SER A 51 -4.220 -0.218 16.088 1.00 0.00 N ATOM 759 CA SER A 51 -3.849 0.544 17.276 1.00 0.00 C ATOM 760 C SER A 51 -2.930 1.710 16.905 1.00 0.00 C ATOM 761 O SER A 51 -3.211 2.851 17.268 1.00 0.00 O ATOM 762 CB SER A 51 -3.190 -0.373 18.314 1.00 0.00 C ATOM 763 OG SER A 51 -4.071 -1.411 18.708 1.00 0.00 O ATOM 0 H SER A 51 -3.925 -1.194 16.110 1.00 0.00 H new ATOM 0 HA SER A 51 -4.753 0.961 17.719 1.00 0.00 H new ATOM 0 HB2 SER A 51 -2.279 -0.803 17.898 1.00 0.00 H new ATOM 0 HB3 SER A 51 -2.897 0.211 19.187 1.00 0.00 H new ATOM 0 HG SER A 51 -4.147 -2.068 17.984 1.00 0.00 H new ATOM 769 N VAL A 52 -1.871 1.457 16.131 1.00 0.00 N ATOM 770 CA VAL A 52 -0.937 2.504 15.737 1.00 0.00 C ATOM 771 C VAL A 52 -1.640 3.535 14.845 1.00 0.00 C ATOM 772 O VAL A 52 -1.387 4.729 14.999 1.00 0.00 O ATOM 773 CB VAL A 52 0.315 1.861 15.102 1.00 0.00 C ATOM 774 CG1 VAL A 52 1.263 2.878 14.455 1.00 0.00 C ATOM 775 CG2 VAL A 52 1.101 1.110 16.192 1.00 0.00 C ATOM 0 H VAL A 52 -1.643 0.532 15.766 1.00 0.00 H new ATOM 0 HA VAL A 52 -0.590 3.061 16.607 1.00 0.00 H new ATOM 0 HB VAL A 52 -0.043 1.195 14.317 1.00 0.00 H new ATOM 0 HG11 VAL A 52 2.120 2.357 14.029 1.00 0.00 H new ATOM 0 HG12 VAL A 52 0.737 3.415 13.666 1.00 0.00 H new ATOM 0 HG13 VAL A 52 1.607 3.586 15.209 1.00 0.00 H new ATOM 0 HG21 VAL A 52 1.987 0.653 15.752 1.00 0.00 H new ATOM 0 HG22 VAL A 52 1.403 1.810 16.971 1.00 0.00 H new ATOM 0 HG23 VAL A 52 0.470 0.334 16.626 1.00 0.00 H new ATOM 785 N ALA A 53 -2.557 3.132 13.960 1.00 0.00 N ATOM 786 CA ALA A 53 -3.278 4.088 13.130 1.00 0.00 C ATOM 787 C ALA A 53 -4.287 4.895 13.966 1.00 0.00 C ATOM 788 O ALA A 53 -4.487 6.081 13.707 1.00 0.00 O ATOM 789 CB ALA A 53 -3.953 3.349 11.978 1.00 0.00 C ATOM 0 H ALA A 53 -2.813 2.157 13.804 1.00 0.00 H new ATOM 0 HA ALA A 53 -2.574 4.807 12.712 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -4.493 4.062 11.355 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -3.197 2.843 11.378 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -4.652 2.614 12.377 1.00 0.00 H new ATOM 795 N ALA A 54 -4.881 4.293 15.000 1.00 0.00 N ATOM 796 CA ALA A 54 -5.775 4.983 15.922 1.00 0.00 C ATOM 797 C ALA A 54 -5.015 6.017 16.757 1.00 0.00 C ATOM 798 O ALA A 54 -5.567 7.081 17.036 1.00 0.00 O ATOM 799 CB ALA A 54 -6.488 3.975 16.829 1.00 0.00 C ATOM 0 H ALA A 54 -4.751 3.305 15.219 1.00 0.00 H new ATOM 0 HA ALA A 54 -6.524 5.513 15.335 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -7.152 4.506 17.512 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -7.071 3.285 16.219 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -5.749 3.416 17.403 1.00 0.00 H new ATOM 805 N GLU A 55 -3.739 5.782 17.080 1.00 0.00 N ATOM 806 CA GLU A 55 -2.883 6.796 17.705 1.00 0.00 C ATOM 807 C GLU A 55 -2.685 8.033 16.797 1.00 0.00 C ATOM 808 O GLU A 55 -2.219 9.070 17.272 1.00 0.00 O ATOM 809 CB GLU A 55 -1.533 6.188 18.134 1.00 0.00 C ATOM 810 CG GLU A 55 -1.665 5.222 19.323 1.00 0.00 C ATOM 811 CD GLU A 55 -0.305 4.627 19.727 1.00 0.00 C ATOM 812 OE1 GLU A 55 0.536 5.361 20.290 1.00 0.00 O ATOM 813 OE2 GLU A 55 -0.060 3.415 19.533 1.00 0.00 O ATOM 0 H GLU A 55 -3.273 4.890 16.917 1.00 0.00 H new ATOM 0 HA GLU A 55 -3.396 7.145 18.601 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -1.093 5.658 17.289 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -0.846 6.991 18.399 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -2.099 5.749 20.173 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -2.352 4.416 19.063 1.00 0.00 H new ATOM 820 N HIS A 56 -3.094 7.957 15.523 1.00 0.00 N ATOM 821 CA HIS A 56 -3.130 9.053 14.555 1.00 0.00 C ATOM 822 C HIS A 56 -4.542 9.210 13.950 1.00 0.00 C ATOM 823 O HIS A 56 -4.697 9.739 12.846 1.00 0.00 O ATOM 824 CB HIS A 56 -2.056 8.809 13.492 1.00 0.00 C ATOM 825 CG HIS A 56 -0.648 8.838 14.038 1.00 0.00 C ATOM 826 ND1 HIS A 56 0.107 9.962 14.297 1.00 0.00 N ATOM 827 CD2 HIS A 56 0.113 7.754 14.386 1.00 0.00 C ATOM 828 CE1 HIS A 56 1.291 9.562 14.791 1.00 0.00 C ATOM 829 NE2 HIS A 56 1.345 8.218 14.868 1.00 0.00 N ATOM 0 H HIS A 56 -3.426 7.080 15.122 1.00 0.00 H new ATOM 0 HA HIS A 56 -2.910 9.998 15.052 1.00 0.00 H new ATOM 0 HB2 HIS A 56 -2.235 7.842 13.022 1.00 0.00 H new ATOM 0 HB3 HIS A 56 -2.150 9.565 12.712 1.00 0.00 H new ATOM 0 HD2 HIS A 56 -0.185 6.719 14.303 1.00 0.00 H new ATOM 0 HE1 HIS A 56 2.090 10.227 15.086 1.00 0.00 H new ATOM 0 HE2 HIS A 56 2.123 7.653 15.208 1.00 0.00 H new ATOM 837 N GLN A 57 -5.560 8.759 14.697 1.00 0.00 N ATOM 838 CA GLN A 57 -6.978 8.961 14.389 1.00 0.00 C ATOM 839 C GLN A 57 -7.341 8.587 12.944 1.00 0.00 C ATOM 840 O GLN A 57 -8.064 9.317 12.260 1.00 0.00 O ATOM 841 CB GLN A 57 -7.406 10.389 14.794 1.00 0.00 C ATOM 842 CG GLN A 57 -7.158 10.743 16.271 1.00 0.00 C ATOM 843 CD GLN A 57 -8.082 9.981 17.222 1.00 0.00 C ATOM 844 OE1 GLN A 57 -9.175 10.438 17.550 1.00 0.00 O ATOM 845 NE2 GLN A 57 -7.684 8.807 17.687 1.00 0.00 N ATOM 0 H GLN A 57 -5.412 8.229 15.556 1.00 0.00 H new ATOM 0 HA GLN A 57 -7.562 8.264 14.990 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -6.871 11.104 14.169 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -8.468 10.509 14.580 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -6.121 10.523 16.524 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -7.300 11.814 16.413 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -6.776 8.431 17.413 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -8.285 8.279 18.320 1.00 0.00 H new ATOM 854 N LEU A 58 -6.848 7.432 12.489 1.00 0.00 N ATOM 855 CA LEU A 58 -7.175 6.882 11.183 1.00 0.00 C ATOM 856 C LEU A 58 -7.621 5.442 11.393 1.00 0.00 C ATOM 857 O LEU A 58 -6.819 4.584 11.752 1.00 0.00 O ATOM 858 CB LEU A 58 -5.947 6.994 10.271 1.00 0.00 C ATOM 859 CG LEU A 58 -6.140 6.367 8.883 1.00 0.00 C ATOM 860 CD1 LEU A 58 -7.356 6.959 8.156 1.00 0.00 C ATOM 861 CD2 LEU A 58 -4.858 6.602 8.081 1.00 0.00 C ATOM 0 H LEU A 58 -6.205 6.851 13.027 1.00 0.00 H new ATOM 0 HA LEU A 58 -7.983 7.428 10.696 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -5.692 8.047 10.150 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -5.099 6.514 10.760 1.00 0.00 H new ATOM 0 HG LEU A 58 -6.333 5.299 8.988 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -7.459 6.490 7.178 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -8.256 6.775 8.743 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -7.218 8.033 8.031 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -4.965 6.166 7.088 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -4.677 7.673 7.990 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -4.017 6.134 8.593 1.00 0.00 H new ATOM 873 N SER A 59 -8.915 5.188 11.222 1.00 0.00 N ATOM 874 CA SER A 59 -9.500 3.896 11.530 1.00 0.00 C ATOM 875 C SER A 59 -9.278 2.938 10.349 1.00 0.00 C ATOM 876 O SER A 59 -9.866 3.122 9.280 1.00 0.00 O ATOM 877 CB SER A 59 -10.992 4.083 11.843 1.00 0.00 C ATOM 878 OG SER A 59 -11.180 5.124 12.791 1.00 0.00 O ATOM 0 H SER A 59 -9.582 5.873 10.867 1.00 0.00 H new ATOM 0 HA SER A 59 -9.022 3.458 12.406 1.00 0.00 H new ATOM 0 HB2 SER A 59 -11.534 4.317 10.927 1.00 0.00 H new ATOM 0 HB3 SER A 59 -11.407 3.152 12.230 1.00 0.00 H new ATOM 0 HG SER A 59 -12.137 5.229 12.976 1.00 0.00 H new ATOM 884 N LEU A 60 -8.463 1.892 10.534 1.00 0.00 N ATOM 885 CA LEU A 60 -8.290 0.830 9.527 1.00 0.00 C ATOM 886 C LEU A 60 -9.453 -0.180 9.566 1.00 0.00 C ATOM 887 O LEU A 60 -9.328 -1.292 9.050 1.00 0.00 O ATOM 888 CB LEU A 60 -6.942 0.091 9.685 1.00 0.00 C ATOM 889 CG LEU A 60 -5.676 0.951 9.833 1.00 0.00 C ATOM 890 CD1 LEU A 60 -4.445 0.040 9.831 1.00 0.00 C ATOM 891 CD2 LEU A 60 -5.523 2.010 8.739 1.00 0.00 C ATOM 0 H LEU A 60 -7.907 1.755 11.378 1.00 0.00 H new ATOM 0 HA LEU A 60 -8.290 1.325 8.556 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -7.013 -0.556 10.559 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -6.810 -0.557 8.818 1.00 0.00 H new ATOM 0 HG LEU A 60 -5.769 1.488 10.777 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -3.544 0.645 9.936 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -4.510 -0.661 10.663 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -4.403 -0.513 8.893 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -4.608 2.578 8.908 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -5.473 1.523 7.765 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -6.379 2.685 8.763 1.00 0.00 H new ATOM 903 N GLU A 61 -10.559 0.165 10.232 1.00 0.00 N ATOM 904 CA GLU A 61 -11.675 -0.756 10.422 1.00 0.00 C ATOM 905 C GLU A 61 -12.339 -1.072 9.076 1.00 0.00 C ATOM 906 O GLU A 61 -12.312 -0.253 8.153 1.00 0.00 O ATOM 907 CB GLU A 61 -12.677 -0.194 11.449 1.00 0.00 C ATOM 908 CG GLU A 61 -13.427 1.068 10.994 1.00 0.00 C ATOM 909 CD GLU A 61 -14.424 1.545 12.068 1.00 0.00 C ATOM 910 OE1 GLU A 61 -14.035 2.315 12.973 1.00 0.00 O ATOM 911 OE2 GLU A 61 -15.616 1.164 12.007 1.00 0.00 O ATOM 0 H GLU A 61 -10.702 1.084 10.650 1.00 0.00 H new ATOM 0 HA GLU A 61 -11.297 -1.694 10.828 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -13.407 -0.968 11.685 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -12.142 0.031 12.372 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -12.711 1.862 10.781 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -13.960 0.862 10.066 1.00 0.00 H new ATOM 918 N GLY A 62 -12.959 -2.252 8.977 1.00 0.00 N ATOM 919 CA GLY A 62 -13.753 -2.634 7.814 1.00 0.00 C ATOM 920 C GLY A 62 -12.935 -3.150 6.628 1.00 0.00 C ATOM 921 O GLY A 62 -13.522 -3.542 5.617 1.00 0.00 O ATOM 0 H GLY A 62 -12.922 -2.967 9.704 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -14.463 -3.405 8.112 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -14.336 -1.772 7.489 1.00 0.00 H new ATOM 925 N HIS A 63 -11.601 -3.172 6.725 1.00 0.00 N ATOM 926 CA HIS A 63 -10.749 -3.824 5.743 1.00 0.00 C ATOM 927 C HIS A 63 -11.021 -5.330 5.760 1.00 0.00 C ATOM 928 O HIS A 63 -11.267 -5.902 6.824 1.00 0.00 O ATOM 929 CB HIS A 63 -9.273 -3.555 6.071 1.00 0.00 C ATOM 930 CG HIS A 63 -8.337 -4.312 5.161 1.00 0.00 C ATOM 931 ND1 HIS A 63 -8.230 -4.152 3.796 1.00 0.00 N ATOM 932 CD2 HIS A 63 -7.543 -5.375 5.508 1.00 0.00 C ATOM 933 CE1 HIS A 63 -7.401 -5.100 3.336 1.00 0.00 C ATOM 934 NE2 HIS A 63 -6.930 -5.853 4.344 1.00 0.00 N ATOM 0 H HIS A 63 -11.088 -2.735 7.491 1.00 0.00 H new ATOM 0 HA HIS A 63 -10.967 -3.427 4.752 1.00 0.00 H new ATOM 0 HB2 HIS A 63 -9.073 -2.487 5.987 1.00 0.00 H new ATOM 0 HB3 HIS A 63 -9.076 -3.835 7.106 1.00 0.00 H new ATOM 0 HD1 HIS A 63 -8.698 -3.440 3.236 1.00 0.00 H new ATOM 0 HD2 HIS A 63 -7.414 -5.773 6.504 1.00 0.00 H new ATOM 0 HE1 HIS A 63 -7.146 -5.239 2.296 1.00 0.00 H new ATOM 942 N CYS A 64 -10.913 -5.965 4.591 1.00 0.00 N ATOM 943 CA CYS A 64 -10.924 -7.413 4.452 1.00 0.00 C ATOM 944 C CYS A 64 -9.769 -7.780 3.517 1.00 0.00 C ATOM 945 O CYS A 64 -9.756 -7.358 2.356 1.00 0.00 O ATOM 946 CB CYS A 64 -12.272 -7.863 3.880 1.00 0.00 C ATOM 947 SG CYS A 64 -13.615 -7.610 5.079 1.00 0.00 S ATOM 0 H CYS A 64 -10.814 -5.474 3.702 1.00 0.00 H new ATOM 0 HA CYS A 64 -10.797 -7.912 5.413 1.00 0.00 H new ATOM 0 HB2 CYS A 64 -12.486 -7.307 2.968 1.00 0.00 H new ATOM 0 HB3 CYS A 64 -12.220 -8.917 3.606 1.00 0.00 H new ATOM 0 HG CYS A 64 -13.174 -6.913 6.084 1.00 0.00 H new ATOM 953 N ALA A 65 -8.792 -8.528 4.031 1.00 0.00 N ATOM 954 CA ALA A 65 -7.622 -8.947 3.274 1.00 0.00 C ATOM 955 C ALA A 65 -8.010 -9.933 2.172 1.00 0.00 C ATOM 956 O ALA A 65 -9.019 -10.636 2.287 1.00 0.00 O ATOM 957 CB ALA A 65 -6.609 -9.570 4.240 1.00 0.00 C ATOM 0 H ALA A 65 -8.795 -8.861 4.995 1.00 0.00 H new ATOM 0 HA ALA A 65 -7.173 -8.082 2.787 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -5.726 -9.889 3.686 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -6.320 -8.833 4.990 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -7.059 -10.432 4.733 1.00 0.00 H new ATOM 963 N ARG A 66 -7.191 -10.007 1.119 1.00 0.00 N ATOM 964 CA ARG A 66 -7.457 -10.845 -0.056 1.00 0.00 C ATOM 965 C ARG A 66 -6.171 -10.985 -0.860 1.00 0.00 C ATOM 966 O ARG A 66 -5.364 -10.054 -0.894 1.00 0.00 O ATOM 967 CB ARG A 66 -8.577 -10.229 -0.922 1.00 0.00 C ATOM 968 CG ARG A 66 -8.254 -8.804 -1.400 1.00 0.00 C ATOM 969 CD ARG A 66 -9.450 -8.123 -2.064 1.00 0.00 C ATOM 970 NE ARG A 66 -9.133 -6.702 -2.237 1.00 0.00 N ATOM 971 CZ ARG A 66 -9.989 -5.680 -2.266 1.00 0.00 C ATOM 972 NH1 ARG A 66 -11.302 -5.860 -2.366 1.00 0.00 N ATOM 973 NH2 ARG A 66 -9.469 -4.467 -2.179 1.00 0.00 N ATOM 0 H ARG A 66 -6.318 -9.483 1.057 1.00 0.00 H new ATOM 0 HA ARG A 66 -7.794 -11.830 0.267 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -8.750 -10.866 -1.789 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -9.504 -10.212 -0.349 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -7.925 -8.205 -0.551 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -7.424 -8.840 -2.105 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -9.663 -8.585 -3.028 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -10.343 -8.241 -1.450 1.00 0.00 H new ATOM 0 HE ARG A 66 -8.146 -6.469 -2.348 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -11.684 -6.804 -2.423 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -11.927 -5.054 -2.385 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -8.459 -4.350 -2.095 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -10.078 -3.649 -2.196 1.00 0.00 H new ATOM 987 N GLN A 67 -5.976 -12.133 -1.508 1.00 0.00 N ATOM 988 CA GLN A 67 -4.830 -12.309 -2.385 1.00 0.00 C ATOM 989 C GLN A 67 -5.004 -11.516 -3.671 1.00 0.00 C ATOM 990 O GLN A 67 -6.115 -11.335 -4.179 1.00 0.00 O ATOM 991 CB GLN A 67 -4.547 -13.789 -2.681 1.00 0.00 C ATOM 992 CG GLN A 67 -3.898 -14.497 -1.484 1.00 0.00 C ATOM 993 CD GLN A 67 -3.318 -15.850 -1.896 1.00 0.00 C ATOM 994 OE1 GLN A 67 -3.999 -16.873 -1.873 1.00 0.00 O ATOM 995 NE2 GLN A 67 -2.056 -15.887 -2.298 1.00 0.00 N ATOM 0 H GLN A 67 -6.591 -12.944 -1.441 1.00 0.00 H new ATOM 0 HA GLN A 67 -3.959 -11.920 -1.858 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -5.479 -14.292 -2.939 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -3.891 -13.867 -3.548 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -3.108 -13.870 -1.070 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -4.638 -14.639 -0.696 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -1.500 -15.032 -2.313 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -1.640 -16.771 -2.592 1.00 0.00 H new ATOM 1004 N ILE A 68 -3.862 -11.063 -4.184 1.00 0.00 N ATOM 1005 CA ILE A 68 -3.769 -10.484 -5.506 1.00 0.00 C ATOM 1006 C ILE A 68 -4.174 -11.567 -6.516 1.00 0.00 C ATOM 1007 O ILE A 68 -3.947 -12.764 -6.306 1.00 0.00 O ATOM 1008 CB ILE A 68 -2.344 -9.919 -5.730 1.00 0.00 C ATOM 1009 CG1 ILE A 68 -2.331 -8.979 -6.958 1.00 0.00 C ATOM 1010 CG2 ILE A 68 -1.267 -11.016 -5.823 1.00 0.00 C ATOM 1011 CD1 ILE A 68 -0.959 -8.382 -7.287 1.00 0.00 C ATOM 0 H ILE A 68 -2.974 -11.091 -3.684 1.00 0.00 H new ATOM 0 HA ILE A 68 -4.444 -9.638 -5.633 1.00 0.00 H new ATOM 0 HB ILE A 68 -2.080 -9.336 -4.848 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -2.690 -9.531 -7.826 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -3.035 -8.165 -6.784 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -0.291 -10.556 -5.980 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -1.252 -11.591 -4.897 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -1.494 -11.679 -6.658 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -1.043 -7.736 -8.161 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -0.603 -7.798 -6.438 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -0.253 -9.186 -7.496 1.00 0.00 H new ATOM 1023 N SER A 69 -4.735 -11.129 -7.632 1.00 0.00 N ATOM 1024 CA SER A 69 -4.991 -11.970 -8.790 1.00 0.00 C ATOM 1025 C SER A 69 -4.660 -11.144 -10.032 1.00 0.00 C ATOM 1026 O SER A 69 -4.589 -9.912 -9.957 1.00 0.00 O ATOM 1027 CB SER A 69 -6.456 -12.429 -8.751 1.00 0.00 C ATOM 1028 OG SER A 69 -7.338 -11.327 -8.899 1.00 0.00 O ATOM 0 H SER A 69 -5.030 -10.161 -7.760 1.00 0.00 H new ATOM 0 HA SER A 69 -4.375 -12.870 -8.800 1.00 0.00 H new ATOM 0 HB2 SER A 69 -6.636 -13.152 -9.546 1.00 0.00 H new ATOM 0 HB3 SER A 69 -6.657 -12.936 -7.807 1.00 0.00 H new ATOM 0 HG SER A 69 -8.265 -11.644 -8.873 1.00 0.00 H new ATOM 1034 N ARG A 70 -4.482 -11.782 -11.194 1.00 0.00 N ATOM 1035 CA ARG A 70 -4.279 -11.034 -12.439 1.00 0.00 C ATOM 1036 C ARG A 70 -5.502 -10.165 -12.749 1.00 0.00 C ATOM 1037 O ARG A 70 -5.341 -9.056 -13.258 1.00 0.00 O ATOM 1038 CB ARG A 70 -3.912 -11.999 -13.580 1.00 0.00 C ATOM 1039 CG ARG A 70 -3.471 -11.251 -14.847 1.00 0.00 C ATOM 1040 CD ARG A 70 -2.852 -12.215 -15.865 1.00 0.00 C ATOM 1041 NE ARG A 70 -2.430 -11.496 -17.078 1.00 0.00 N ATOM 1042 CZ ARG A 70 -1.573 -11.922 -18.009 1.00 0.00 C ATOM 1043 NH1 ARG A 70 -0.931 -13.081 -17.885 1.00 0.00 N ATOM 1044 NH2 ARG A 70 -1.379 -11.144 -19.065 1.00 0.00 N ATOM 0 H ARG A 70 -4.474 -12.797 -11.298 1.00 0.00 H new ATOM 0 HA ARG A 70 -3.439 -10.349 -12.325 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -3.110 -12.660 -13.252 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -4.770 -12.630 -13.812 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -4.328 -10.746 -15.293 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -2.747 -10.479 -14.585 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -1.995 -12.720 -15.420 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -3.575 -12.987 -16.128 1.00 0.00 H new ATOM 0 HE ARG A 70 -2.836 -10.572 -17.223 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -1.089 -13.666 -17.065 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -0.281 -13.384 -18.610 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -1.876 -10.257 -19.143 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -0.732 -11.433 -19.799 1.00 0.00 H new ATOM 1058 N ARG A 71 -6.709 -10.618 -12.380 1.00 0.00 N ATOM 1059 CA ARG A 71 -7.919 -9.802 -12.478 1.00 0.00 C ATOM 1060 C ARG A 71 -7.763 -8.532 -11.649 1.00 0.00 C ATOM 1061 O ARG A 71 -7.966 -7.447 -12.190 1.00 0.00 O ATOM 1062 CB ARG A 71 -9.164 -10.596 -12.041 1.00 0.00 C ATOM 1063 CG ARG A 71 -9.480 -11.768 -12.983 1.00 0.00 C ATOM 1064 CD ARG A 71 -10.751 -12.497 -12.531 1.00 0.00 C ATOM 1065 NE ARG A 71 -11.074 -13.630 -13.417 1.00 0.00 N ATOM 1066 CZ ARG A 71 -12.129 -14.446 -13.287 1.00 0.00 C ATOM 1067 NH1 ARG A 71 -13.003 -14.275 -12.296 1.00 0.00 N ATOM 1068 NH2 ARG A 71 -12.307 -15.436 -14.156 1.00 0.00 N ATOM 0 H ARG A 71 -6.869 -11.554 -12.008 1.00 0.00 H new ATOM 0 HA ARG A 71 -8.060 -9.521 -13.522 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -9.011 -10.978 -11.032 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -10.022 -9.925 -12.001 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -9.608 -11.399 -14.001 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -8.642 -12.464 -13.000 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -10.620 -12.858 -11.511 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -11.586 -11.797 -12.516 1.00 0.00 H new ATOM 0 HE ARG A 71 -10.440 -13.808 -14.196 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -12.873 -13.517 -11.626 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -13.802 -14.902 -12.207 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -11.642 -15.572 -14.917 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -13.108 -16.060 -14.061 1.00 0.00 H new ATOM 1082 N LEU A 72 -7.352 -8.635 -10.378 1.00 0.00 N ATOM 1083 CA LEU A 72 -7.099 -7.455 -9.556 1.00 0.00 C ATOM 1084 C LEU A 72 -6.043 -6.567 -10.198 1.00 0.00 C ATOM 1085 O LEU A 72 -6.219 -5.353 -10.202 1.00 0.00 O ATOM 1086 CB LEU A 72 -6.650 -7.818 -8.128 1.00 0.00 C ATOM 1087 CG LEU A 72 -7.784 -7.677 -7.103 1.00 0.00 C ATOM 1088 CD1 LEU A 72 -8.872 -8.742 -7.267 1.00 0.00 C ATOM 1089 CD2 LEU A 72 -7.223 -7.736 -5.678 1.00 0.00 C ATOM 0 H LEU A 72 -7.189 -9.523 -9.902 1.00 0.00 H new ATOM 0 HA LEU A 72 -8.045 -6.919 -9.489 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -6.279 -8.843 -8.116 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -5.819 -7.175 -7.837 1.00 0.00 H new ATOM 0 HG LEU A 72 -8.247 -6.707 -7.285 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -9.646 -8.590 -6.515 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -9.312 -8.663 -8.261 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -8.434 -9.732 -7.142 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -8.038 -7.635 -4.962 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -6.721 -8.691 -5.524 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -6.510 -6.924 -5.534 1.00 0.00 H new ATOM 1101 N CYS A 73 -4.973 -7.144 -10.753 1.00 0.00 N ATOM 1102 CA CYS A 73 -3.908 -6.351 -11.348 1.00 0.00 C ATOM 1103 C CYS A 73 -4.467 -5.447 -12.448 1.00 0.00 C ATOM 1104 O CYS A 73 -4.205 -4.249 -12.430 1.00 0.00 O ATOM 1105 CB CYS A 73 -2.792 -7.238 -11.913 1.00 0.00 C ATOM 1106 SG CYS A 73 -2.000 -8.228 -10.617 1.00 0.00 S ATOM 0 H CYS A 73 -4.827 -8.152 -10.800 1.00 0.00 H new ATOM 0 HA CYS A 73 -3.479 -5.733 -10.560 1.00 0.00 H new ATOM 0 HB2 CYS A 73 -3.204 -7.899 -12.675 1.00 0.00 H new ATOM 0 HB3 CYS A 73 -2.044 -6.614 -12.402 1.00 0.00 H new ATOM 0 HG CYS A 73 -2.863 -9.064 -10.121 1.00 0.00 H new ATOM 1112 N ARG A 74 -5.256 -5.980 -13.389 1.00 0.00 N ATOM 1113 CA ARG A 74 -5.815 -5.159 -14.467 1.00 0.00 C ATOM 1114 C ARG A 74 -6.986 -4.284 -14.007 1.00 0.00 C ATOM 1115 O ARG A 74 -7.368 -3.368 -14.734 1.00 0.00 O ATOM 1116 CB ARG A 74 -6.171 -6.018 -15.693 1.00 0.00 C ATOM 1117 CG ARG A 74 -7.337 -6.999 -15.486 1.00 0.00 C ATOM 1118 CD ARG A 74 -7.745 -7.683 -16.798 1.00 0.00 C ATOM 1119 NE ARG A 74 -6.663 -8.519 -17.354 1.00 0.00 N ATOM 1120 CZ ARG A 74 -6.653 -9.849 -17.491 1.00 0.00 C ATOM 1121 NH1 ARG A 74 -7.683 -10.595 -17.093 1.00 0.00 N ATOM 1122 NH2 ARG A 74 -5.592 -10.432 -18.034 1.00 0.00 N ATOM 0 H ARG A 74 -5.519 -6.965 -13.425 1.00 0.00 H new ATOM 0 HA ARG A 74 -5.034 -4.463 -14.771 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -6.417 -5.355 -16.522 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -5.288 -6.585 -15.989 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -7.050 -7.755 -14.755 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -8.193 -6.465 -15.073 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -8.626 -8.301 -16.624 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -8.027 -6.924 -17.528 1.00 0.00 H new ATOM 0 HE ARG A 74 -5.828 -8.026 -17.670 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -8.501 -10.153 -16.674 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -7.653 -11.608 -17.208 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -4.800 -9.867 -18.340 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -5.568 -11.446 -18.146 1.00 0.00 H new ATOM 1136 N ASN A 75 -7.584 -4.558 -12.840 1.00 0.00 N ATOM 1137 CA ASN A 75 -8.755 -3.832 -12.353 1.00 0.00 C ATOM 1138 C ASN A 75 -8.440 -2.374 -12.004 1.00 0.00 C ATOM 1139 O ASN A 75 -9.336 -1.532 -12.086 1.00 0.00 O ATOM 1140 CB ASN A 75 -9.361 -4.530 -11.126 1.00 0.00 C ATOM 1141 CG ASN A 75 -10.658 -3.851 -10.696 1.00 0.00 C ATOM 1142 OD1 ASN A 75 -11.702 -4.043 -11.312 1.00 0.00 O ATOM 1143 ND2 ASN A 75 -10.633 -3.056 -9.639 1.00 0.00 N ATOM 0 H ASN A 75 -7.265 -5.293 -12.208 1.00 0.00 H new ATOM 0 HA ASN A 75 -9.477 -3.833 -13.170 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -9.554 -5.577 -11.357 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -8.647 -4.512 -10.303 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -11.488 -2.595 -9.328 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -9.759 -2.904 -9.135 1.00 0.00 H new ATOM 1150 N TYR A 76 -7.192 -2.065 -11.637 1.00 0.00 N ATOM 1151 CA TYR A 76 -6.782 -0.708 -11.262 1.00 0.00 C ATOM 1152 C TYR A 76 -5.721 -0.210 -12.252 1.00 0.00 C ATOM 1153 O TYR A 76 -5.244 -0.980 -13.088 1.00 0.00 O ATOM 1154 CB TYR A 76 -6.306 -0.676 -9.801 1.00 0.00 C ATOM 1155 CG TYR A 76 -7.257 -1.337 -8.815 1.00 0.00 C ATOM 1156 CD1 TYR A 76 -8.287 -0.603 -8.197 1.00 0.00 C ATOM 1157 CD2 TYR A 76 -7.111 -2.705 -8.524 1.00 0.00 C ATOM 1158 CE1 TYR A 76 -9.156 -1.235 -7.289 1.00 0.00 C ATOM 1159 CE2 TYR A 76 -7.967 -3.342 -7.612 1.00 0.00 C ATOM 1160 CZ TYR A 76 -8.992 -2.606 -6.979 1.00 0.00 C ATOM 1161 OH TYR A 76 -9.851 -3.220 -6.120 1.00 0.00 O ATOM 0 H TYR A 76 -6.437 -2.749 -11.592 1.00 0.00 H new ATOM 0 HA TYR A 76 -7.630 -0.026 -11.320 1.00 0.00 H new ATOM 0 HB2 TYR A 76 -5.336 -1.169 -9.737 1.00 0.00 H new ATOM 0 HB3 TYR A 76 -6.157 0.362 -9.503 1.00 0.00 H new ATOM 0 HD1 TYR A 76 -8.410 0.446 -8.420 1.00 0.00 H new ATOM 0 HD2 TYR A 76 -6.330 -3.273 -9.008 1.00 0.00 H new ATOM 0 HE1 TYR A 76 -9.952 -0.671 -6.826 1.00 0.00 H new ATOM 0 HE2 TYR A 76 -7.842 -4.393 -7.395 1.00 0.00 H new ATOM 0 HH TYR A 76 -9.596 -4.161 -6.019 1.00 0.00 H new ATOM 1171 N ASP A 77 -5.353 1.074 -12.177 1.00 0.00 N ATOM 1172 CA ASP A 77 -4.522 1.718 -13.205 1.00 0.00 C ATOM 1173 C ASP A 77 -3.123 2.093 -12.703 1.00 0.00 C ATOM 1174 O ASP A 77 -2.252 2.436 -13.501 1.00 0.00 O ATOM 1175 CB ASP A 77 -5.263 2.937 -13.769 1.00 0.00 C ATOM 1176 CG ASP A 77 -4.606 3.467 -15.058 1.00 0.00 C ATOM 1177 OD1 ASP A 77 -4.479 2.698 -16.039 1.00 0.00 O ATOM 1178 OD2 ASP A 77 -4.292 4.674 -15.128 1.00 0.00 O ATOM 0 H ASP A 77 -5.619 1.692 -11.411 1.00 0.00 H new ATOM 0 HA ASP A 77 -4.358 0.992 -14.001 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -6.299 2.668 -13.974 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -5.282 3.728 -13.020 1.00 0.00 H new ATOM 1183 N LEU A 78 -2.875 1.963 -11.397 1.00 0.00 N ATOM 1184 CA LEU A 78 -1.558 2.070 -10.777 1.00 0.00 C ATOM 1185 C LEU A 78 -1.515 0.982 -9.713 1.00 0.00 C ATOM 1186 O LEU A 78 -2.472 0.856 -8.944 1.00 0.00 O ATOM 1187 CB LEU A 78 -1.382 3.453 -10.123 1.00 0.00 C ATOM 1188 CG LEU A 78 0.046 4.030 -10.151 1.00 0.00 C ATOM 1189 CD1 LEU A 78 0.101 5.253 -9.230 1.00 0.00 C ATOM 1190 CD2 LEU A 78 1.150 3.061 -9.722 1.00 0.00 C ATOM 0 H LEU A 78 -3.615 1.774 -10.721 1.00 0.00 H new ATOM 0 HA LEU A 78 -0.760 1.954 -11.511 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -2.048 4.157 -10.621 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -1.707 3.387 -9.085 1.00 0.00 H new ATOM 0 HG LEU A 78 0.243 4.273 -11.195 1.00 0.00 H new ATOM 0 HD11 LEU A 78 1.107 5.671 -9.241 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -0.608 6.004 -9.579 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -0.157 4.955 -8.214 1.00 0.00 H new ATOM 0 HD21 LEU A 78 2.116 3.563 -9.776 1.00 0.00 H new ATOM 0 HD22 LEU A 78 0.969 2.733 -8.698 1.00 0.00 H new ATOM 0 HD23 LEU A 78 1.153 2.196 -10.385 1.00 0.00 H new ATOM 1202 N ILE A 79 -0.437 0.210 -9.643 1.00 0.00 N ATOM 1203 CA ILE A 79 -0.302 -0.857 -8.664 1.00 0.00 C ATOM 1204 C ILE A 79 0.977 -0.540 -7.898 1.00 0.00 C ATOM 1205 O ILE A 79 2.014 -0.268 -8.506 1.00 0.00 O ATOM 1206 CB ILE A 79 -0.245 -2.239 -9.360 1.00 0.00 C ATOM 1207 CG1 ILE A 79 -1.289 -2.459 -10.484 1.00 0.00 C ATOM 1208 CG2 ILE A 79 -0.359 -3.354 -8.303 1.00 0.00 C ATOM 1209 CD1 ILE A 79 -2.753 -2.441 -10.033 1.00 0.00 C ATOM 0 H ILE A 79 0.367 0.308 -10.264 1.00 0.00 H new ATOM 0 HA ILE A 79 -1.156 -0.911 -7.988 1.00 0.00 H new ATOM 0 HB ILE A 79 0.720 -2.272 -9.865 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -1.150 -1.688 -11.242 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -1.086 -3.417 -10.963 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -0.319 -4.326 -8.794 1.00 0.00 H new ATOM 0 HG22 ILE A 79 0.466 -3.270 -7.595 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -1.305 -3.255 -7.771 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -3.401 -2.604 -10.894 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -2.918 -3.231 -9.300 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -2.983 -1.475 -9.583 1.00 0.00 H new ATOM 1221 N LEU A 80 0.916 -0.572 -6.571 1.00 0.00 N ATOM 1222 CA LEU A 80 2.068 -0.339 -5.720 1.00 0.00 C ATOM 1223 C LEU A 80 2.299 -1.571 -4.872 1.00 0.00 C ATOM 1224 O LEU A 80 1.368 -2.294 -4.511 1.00 0.00 O ATOM 1225 CB LEU A 80 1.900 0.874 -4.782 1.00 0.00 C ATOM 1226 CG LEU A 80 1.844 2.287 -5.392 1.00 0.00 C ATOM 1227 CD1 LEU A 80 2.907 2.525 -6.464 1.00 0.00 C ATOM 1228 CD2 LEU A 80 0.447 2.621 -5.912 1.00 0.00 C ATOM 0 H LEU A 80 0.057 -0.762 -6.056 1.00 0.00 H new ATOM 0 HA LEU A 80 2.913 -0.127 -6.375 1.00 0.00 H new ATOM 0 HB2 LEU A 80 0.983 0.725 -4.212 1.00 0.00 H new ATOM 0 HB3 LEU A 80 2.725 0.856 -4.069 1.00 0.00 H new ATOM 0 HG LEU A 80 2.075 2.973 -4.577 1.00 0.00 H new ATOM 0 HD11 LEU A 80 2.812 3.539 -6.852 1.00 0.00 H new ATOM 0 HD12 LEU A 80 3.898 2.394 -6.029 1.00 0.00 H new ATOM 0 HD13 LEU A 80 2.771 1.811 -7.277 1.00 0.00 H new ATOM 0 HD21 LEU A 80 0.447 3.626 -6.335 1.00 0.00 H new ATOM 0 HD22 LEU A 80 0.164 1.903 -6.682 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -0.268 2.573 -5.091 1.00 0.00 H new ATOM 1240 N THR A 81 3.553 -1.759 -4.499 1.00 0.00 N ATOM 1241 CA THR A 81 3.934 -2.739 -3.505 1.00 0.00 C ATOM 1242 C THR A 81 5.083 -2.132 -2.701 1.00 0.00 C ATOM 1243 O THR A 81 5.590 -1.064 -3.057 1.00 0.00 O ATOM 1244 CB THR A 81 4.157 -4.105 -4.165 1.00 0.00 C ATOM 1245 OG1 THR A 81 4.331 -5.078 -3.166 1.00 0.00 O ATOM 1246 CG2 THR A 81 5.340 -4.138 -5.129 1.00 0.00 C ATOM 0 H THR A 81 4.338 -1.231 -4.881 1.00 0.00 H new ATOM 0 HA THR A 81 3.154 -2.965 -2.778 1.00 0.00 H new ATOM 0 HB THR A 81 3.271 -4.313 -4.765 1.00 0.00 H new ATOM 0 HG1 THR A 81 3.574 -5.048 -2.545 1.00 0.00 H new ATOM 0 HG21 THR A 81 5.434 -5.137 -5.556 1.00 0.00 H new ATOM 0 HG22 THR A 81 5.178 -3.415 -5.929 1.00 0.00 H new ATOM 0 HG23 THR A 81 6.254 -3.886 -4.592 1.00 0.00 H new ATOM 1254 N MET A 82 5.499 -2.764 -1.606 1.00 0.00 N ATOM 1255 CA MET A 82 6.399 -2.137 -0.643 1.00 0.00 C ATOM 1256 C MET A 82 7.816 -2.698 -0.632 1.00 0.00 C ATOM 1257 O MET A 82 8.672 -2.110 0.028 1.00 0.00 O ATOM 1258 CB MET A 82 5.747 -2.265 0.738 1.00 0.00 C ATOM 1259 CG MET A 82 4.437 -1.475 0.793 1.00 0.00 C ATOM 1260 SD MET A 82 3.764 -1.315 2.455 1.00 0.00 S ATOM 1261 CE MET A 82 2.192 -0.509 2.049 1.00 0.00 C ATOM 0 H MET A 82 5.225 -3.716 -1.363 1.00 0.00 H new ATOM 0 HA MET A 82 6.532 -1.096 -0.937 1.00 0.00 H new ATOM 0 HB2 MET A 82 5.554 -3.315 0.959 1.00 0.00 H new ATOM 0 HB3 MET A 82 6.431 -1.899 1.504 1.00 0.00 H new ATOM 0 HG2 MET A 82 4.604 -0.480 0.380 1.00 0.00 H new ATOM 0 HG3 MET A 82 3.700 -1.965 0.157 1.00 0.00 H new ATOM 0 HE1 MET A 82 1.569 -0.456 2.942 1.00 0.00 H new ATOM 0 HE2 MET A 82 2.384 0.498 1.680 1.00 0.00 H new ATOM 0 HE3 MET A 82 1.676 -1.085 1.281 1.00 0.00 H new ATOM 1271 N GLU A 83 8.082 -3.792 -1.350 1.00 0.00 N ATOM 1272 CA GLU A 83 9.385 -4.451 -1.333 1.00 0.00 C ATOM 1273 C GLU A 83 9.746 -4.805 -2.773 1.00 0.00 C ATOM 1274 O GLU A 83 8.881 -5.183 -3.566 1.00 0.00 O ATOM 1275 CB GLU A 83 9.344 -5.704 -0.437 1.00 0.00 C ATOM 1276 CG GLU A 83 8.975 -5.407 1.031 1.00 0.00 C ATOM 1277 CD GLU A 83 8.833 -6.672 1.894 1.00 0.00 C ATOM 1278 OE1 GLU A 83 9.632 -7.622 1.732 1.00 0.00 O ATOM 1279 OE2 GLU A 83 7.944 -6.698 2.778 1.00 0.00 O ATOM 0 H GLU A 83 7.399 -4.244 -1.958 1.00 0.00 H new ATOM 0 HA GLU A 83 10.145 -3.790 -0.917 1.00 0.00 H new ATOM 0 HB2 GLU A 83 8.622 -6.410 -0.848 1.00 0.00 H new ATOM 0 HB3 GLU A 83 10.318 -6.192 -0.466 1.00 0.00 H new ATOM 0 HG2 GLU A 83 9.739 -4.763 1.467 1.00 0.00 H new ATOM 0 HG3 GLU A 83 8.037 -4.852 1.057 1.00 0.00 H new ATOM 1286 N LYS A 84 11.021 -4.685 -3.141 1.00 0.00 N ATOM 1287 CA LYS A 84 11.442 -4.828 -4.538 1.00 0.00 C ATOM 1288 C LYS A 84 11.275 -6.269 -5.025 1.00 0.00 C ATOM 1289 O LYS A 84 10.929 -6.489 -6.186 1.00 0.00 O ATOM 1290 CB LYS A 84 12.874 -4.291 -4.704 1.00 0.00 C ATOM 1291 CG LYS A 84 12.892 -2.770 -4.460 1.00 0.00 C ATOM 1292 CD LYS A 84 14.304 -2.175 -4.413 1.00 0.00 C ATOM 1293 CE LYS A 84 14.173 -0.690 -4.050 1.00 0.00 C ATOM 1294 NZ LYS A 84 15.478 -0.012 -3.865 1.00 0.00 N ATOM 0 H LYS A 84 11.783 -4.489 -2.492 1.00 0.00 H new ATOM 0 HA LYS A 84 10.794 -4.228 -5.177 1.00 0.00 H new ATOM 0 HB2 LYS A 84 13.543 -4.789 -4.002 1.00 0.00 H new ATOM 0 HB3 LYS A 84 13.241 -4.512 -5.706 1.00 0.00 H new ATOM 0 HG2 LYS A 84 12.325 -2.277 -5.249 1.00 0.00 H new ATOM 0 HG3 LYS A 84 12.384 -2.555 -3.520 1.00 0.00 H new ATOM 0 HD2 LYS A 84 14.914 -2.696 -3.676 1.00 0.00 H new ATOM 0 HD3 LYS A 84 14.800 -2.291 -5.377 1.00 0.00 H new ATOM 0 HE2 LYS A 84 13.615 -0.180 -4.835 1.00 0.00 H new ATOM 0 HE3 LYS A 84 13.591 -0.598 -3.133 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 15.325 0.927 -3.444 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 16.078 -0.581 -3.234 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 15.948 0.095 -4.787 1.00 0.00 H new ATOM 1308 N ARG A 85 11.407 -7.258 -4.132 1.00 0.00 N ATOM 1309 CA ARG A 85 11.054 -8.645 -4.446 1.00 0.00 C ATOM 1310 C ARG A 85 9.577 -8.781 -4.836 1.00 0.00 C ATOM 1311 O ARG A 85 9.251 -9.605 -5.688 1.00 0.00 O ATOM 1312 CB ARG A 85 11.435 -9.590 -3.287 1.00 0.00 C ATOM 1313 CG ARG A 85 10.807 -9.229 -1.927 1.00 0.00 C ATOM 1314 CD ARG A 85 11.081 -10.304 -0.871 1.00 0.00 C ATOM 1315 NE ARG A 85 10.436 -9.956 0.406 1.00 0.00 N ATOM 1316 CZ ARG A 85 10.046 -10.792 1.373 1.00 0.00 C ATOM 1317 NH1 ARG A 85 10.227 -12.107 1.271 1.00 0.00 N ATOM 1318 NH2 ARG A 85 9.463 -10.267 2.440 1.00 0.00 N ATOM 0 H ARG A 85 11.757 -7.121 -3.184 1.00 0.00 H new ATOM 0 HA ARG A 85 11.636 -8.946 -5.317 1.00 0.00 H new ATOM 0 HB2 ARG A 85 11.137 -10.605 -3.551 1.00 0.00 H new ATOM 0 HB3 ARG A 85 12.520 -9.594 -3.181 1.00 0.00 H new ATOM 0 HG2 ARG A 85 11.205 -8.274 -1.585 1.00 0.00 H new ATOM 0 HG3 ARG A 85 9.731 -9.102 -2.046 1.00 0.00 H new ATOM 0 HD2 ARG A 85 10.710 -11.267 -1.221 1.00 0.00 H new ATOM 0 HD3 ARG A 85 12.156 -10.411 -0.724 1.00 0.00 H new ATOM 0 HE ARG A 85 10.268 -8.964 0.572 1.00 0.00 H new ATOM 0 HH11 ARG A 85 10.672 -12.498 0.441 1.00 0.00 H new ATOM 0 HH12 ARG A 85 9.920 -12.724 2.023 1.00 0.00 H new ATOM 0 HH21 ARG A 85 9.326 -9.258 2.502 1.00 0.00 H new ATOM 0 HH22 ARG A 85 9.151 -10.872 3.200 1.00 0.00 H new ATOM 1332 N HIS A 86 8.678 -7.982 -4.253 1.00 0.00 N ATOM 1333 CA HIS A 86 7.262 -8.057 -4.586 1.00 0.00 C ATOM 1334 C HIS A 86 7.033 -7.463 -5.971 1.00 0.00 C ATOM 1335 O HIS A 86 6.217 -8.006 -6.709 1.00 0.00 O ATOM 1336 CB HIS A 86 6.386 -7.310 -3.574 1.00 0.00 C ATOM 1337 CG HIS A 86 6.464 -7.734 -2.128 1.00 0.00 C ATOM 1338 ND1 HIS A 86 7.070 -8.854 -1.600 1.00 0.00 N ATOM 1339 CD2 HIS A 86 5.930 -7.036 -1.079 1.00 0.00 C ATOM 1340 CE1 HIS A 86 6.934 -8.801 -0.264 1.00 0.00 C ATOM 1341 NE2 HIS A 86 6.226 -7.718 0.102 1.00 0.00 N ATOM 0 H HIS A 86 8.910 -7.279 -3.551 1.00 0.00 H new ATOM 0 HA HIS A 86 6.978 -9.109 -4.564 1.00 0.00 H new ATOM 0 HB2 HIS A 86 6.641 -6.252 -3.627 1.00 0.00 H new ATOM 0 HB3 HIS A 86 5.349 -7.404 -3.895 1.00 0.00 H new ATOM 0 HD1 HIS A 86 7.538 -9.591 -2.128 1.00 0.00 H new ATOM 0 HD2 HIS A 86 5.374 -6.113 -1.153 1.00 0.00 H new ATOM 0 HE1 HIS A 86 7.339 -9.530 0.423 1.00 0.00 H new ATOM 1349 N ILE A 87 7.755 -6.396 -6.353 1.00 0.00 N ATOM 1350 CA ILE A 87 7.652 -5.818 -7.697 1.00 0.00 C ATOM 1351 C ILE A 87 7.923 -6.925 -8.715 1.00 0.00 C ATOM 1352 O ILE A 87 7.158 -7.071 -9.667 1.00 0.00 O ATOM 1353 CB ILE A 87 8.608 -4.608 -7.878 1.00 0.00 C ATOM 1354 CG1 ILE A 87 8.237 -3.476 -6.895 1.00 0.00 C ATOM 1355 CG2 ILE A 87 8.602 -4.086 -9.330 1.00 0.00 C ATOM 1356 CD1 ILE A 87 9.178 -2.269 -6.925 1.00 0.00 C ATOM 0 H ILE A 87 8.418 -5.917 -5.744 1.00 0.00 H new ATOM 0 HA ILE A 87 6.648 -5.423 -7.852 1.00 0.00 H new ATOM 0 HB ILE A 87 9.619 -4.951 -7.657 1.00 0.00 H new ATOM 0 HG12 ILE A 87 7.225 -3.137 -7.118 1.00 0.00 H new ATOM 0 HG13 ILE A 87 8.221 -3.882 -5.884 1.00 0.00 H new ATOM 0 HG21 ILE A 87 9.283 -3.240 -9.415 1.00 0.00 H new ATOM 0 HG22 ILE A 87 8.924 -4.880 -10.004 1.00 0.00 H new ATOM 0 HG23 ILE A 87 7.594 -3.769 -9.599 1.00 0.00 H new ATOM 0 HD11 ILE A 87 8.840 -1.526 -6.203 1.00 0.00 H new ATOM 0 HD12 ILE A 87 10.188 -2.589 -6.670 1.00 0.00 H new ATOM 0 HD13 ILE A 87 9.177 -1.832 -7.923 1.00 0.00 H new ATOM 1368 N GLU A 88 8.963 -7.736 -8.492 1.00 0.00 N ATOM 1369 CA GLU A 88 9.315 -8.812 -9.406 1.00 0.00 C ATOM 1370 C GLU A 88 8.155 -9.814 -9.530 1.00 0.00 C ATOM 1371 O GLU A 88 7.775 -10.192 -10.640 1.00 0.00 O ATOM 1372 CB GLU A 88 10.609 -9.472 -8.905 1.00 0.00 C ATOM 1373 CG GLU A 88 11.224 -10.451 -9.909 1.00 0.00 C ATOM 1374 CD GLU A 88 11.813 -9.742 -11.144 1.00 0.00 C ATOM 1375 OE1 GLU A 88 12.994 -9.325 -11.104 1.00 0.00 O ATOM 1376 OE2 GLU A 88 11.115 -9.614 -12.174 1.00 0.00 O ATOM 0 H GLU A 88 9.575 -7.661 -7.679 1.00 0.00 H new ATOM 0 HA GLU A 88 9.492 -8.420 -10.408 1.00 0.00 H new ATOM 0 HB2 GLU A 88 11.338 -8.695 -8.674 1.00 0.00 H new ATOM 0 HB3 GLU A 88 10.401 -10.001 -7.975 1.00 0.00 H new ATOM 0 HG2 GLU A 88 12.008 -11.026 -9.416 1.00 0.00 H new ATOM 0 HG3 GLU A 88 10.463 -11.161 -10.231 1.00 0.00 H new ATOM 1383 N ARG A 89 7.542 -10.207 -8.406 1.00 0.00 N ATOM 1384 CA ARG A 89 6.414 -11.141 -8.431 1.00 0.00 C ATOM 1385 C ARG A 89 5.187 -10.526 -9.100 1.00 0.00 C ATOM 1386 O ARG A 89 4.507 -11.217 -9.851 1.00 0.00 O ATOM 1387 CB ARG A 89 6.065 -11.656 -7.032 1.00 0.00 C ATOM 1388 CG ARG A 89 7.194 -12.480 -6.394 1.00 0.00 C ATOM 1389 CD ARG A 89 7.750 -13.664 -7.206 1.00 0.00 C ATOM 1390 NE ARG A 89 6.723 -14.515 -7.839 1.00 0.00 N ATOM 1391 CZ ARG A 89 5.829 -15.317 -7.256 1.00 0.00 C ATOM 1392 NH1 ARG A 89 5.715 -15.400 -5.932 1.00 0.00 N ATOM 1393 NH2 ARG A 89 5.054 -16.039 -8.052 1.00 0.00 N ATOM 0 H ARG A 89 7.808 -9.893 -7.473 1.00 0.00 H new ATOM 0 HA ARG A 89 6.731 -11.995 -9.029 1.00 0.00 H new ATOM 0 HB2 ARG A 89 5.833 -10.809 -6.387 1.00 0.00 H new ATOM 0 HB3 ARG A 89 5.165 -12.268 -7.091 1.00 0.00 H new ATOM 0 HG2 ARG A 89 8.021 -11.805 -6.173 1.00 0.00 H new ATOM 0 HG3 ARG A 89 6.833 -12.865 -5.440 1.00 0.00 H new ATOM 0 HD2 ARG A 89 8.410 -13.276 -7.982 1.00 0.00 H new ATOM 0 HD3 ARG A 89 8.360 -14.283 -6.548 1.00 0.00 H new ATOM 0 HE ARG A 89 6.692 -14.486 -8.858 1.00 0.00 H new ATOM 0 HH11 ARG A 89 6.321 -14.841 -5.332 1.00 0.00 H new ATOM 0 HH12 ARG A 89 5.021 -16.023 -5.518 1.00 0.00 H new ATOM 0 HH21 ARG A 89 5.155 -15.968 -9.064 1.00 0.00 H new ATOM 0 HH22 ARG A 89 4.356 -16.666 -7.652 1.00 0.00 H new ATOM 1407 N LEU A 90 4.893 -9.244 -8.879 1.00 0.00 N ATOM 1408 CA LEU A 90 3.763 -8.570 -9.519 1.00 0.00 C ATOM 1409 C LEU A 90 3.972 -8.514 -11.034 1.00 0.00 C ATOM 1410 O LEU A 90 3.041 -8.781 -11.794 1.00 0.00 O ATOM 1411 CB LEU A 90 3.577 -7.151 -8.947 1.00 0.00 C ATOM 1412 CG LEU A 90 2.528 -7.056 -7.825 1.00 0.00 C ATOM 1413 CD1 LEU A 90 2.891 -7.868 -6.579 1.00 0.00 C ATOM 1414 CD2 LEU A 90 2.343 -5.594 -7.413 1.00 0.00 C ATOM 0 H LEU A 90 5.430 -8.645 -8.253 1.00 0.00 H new ATOM 0 HA LEU A 90 2.858 -9.140 -9.311 1.00 0.00 H new ATOM 0 HB2 LEU A 90 4.534 -6.797 -8.565 1.00 0.00 H new ATOM 0 HB3 LEU A 90 3.289 -6.480 -9.756 1.00 0.00 H new ATOM 0 HG LEU A 90 1.608 -7.475 -8.233 1.00 0.00 H new ATOM 0 HD11 LEU A 90 2.107 -7.755 -5.830 1.00 0.00 H new ATOM 0 HD12 LEU A 90 2.988 -8.920 -6.846 1.00 0.00 H new ATOM 0 HD13 LEU A 90 3.836 -7.508 -6.173 1.00 0.00 H new ATOM 0 HD21 LEU A 90 1.599 -5.531 -6.618 1.00 0.00 H new ATOM 0 HD22 LEU A 90 3.292 -5.194 -7.055 1.00 0.00 H new ATOM 0 HD23 LEU A 90 2.006 -5.014 -8.272 1.00 0.00 H new ATOM 1426 N CYS A 91 5.196 -8.208 -11.477 1.00 0.00 N ATOM 1427 CA CYS A 91 5.532 -8.159 -12.896 1.00 0.00 C ATOM 1428 C CYS A 91 5.435 -9.544 -13.550 1.00 0.00 C ATOM 1429 O CYS A 91 5.181 -9.623 -14.754 1.00 0.00 O ATOM 1430 CB CYS A 91 6.944 -7.585 -13.060 1.00 0.00 C ATOM 1431 SG CYS A 91 6.966 -5.847 -12.526 1.00 0.00 S ATOM 0 H CYS A 91 5.978 -7.988 -10.860 1.00 0.00 H new ATOM 0 HA CYS A 91 4.812 -7.515 -13.400 1.00 0.00 H new ATOM 0 HB2 CYS A 91 7.654 -8.165 -12.470 1.00 0.00 H new ATOM 0 HB3 CYS A 91 7.258 -7.660 -14.101 1.00 0.00 H new ATOM 0 HG CYS A 91 7.046 -5.792 -11.230 1.00 0.00 H new ATOM 1437 N GLU A 92 5.645 -10.623 -12.794 1.00 0.00 N ATOM 1438 CA GLU A 92 5.434 -11.992 -13.246 1.00 0.00 C ATOM 1439 C GLU A 92 3.931 -12.312 -13.306 1.00 0.00 C ATOM 1440 O GLU A 92 3.468 -12.897 -14.285 1.00 0.00 O ATOM 1441 CB GLU A 92 6.183 -12.941 -12.293 1.00 0.00 C ATOM 1442 CG GLU A 92 6.035 -14.425 -12.656 1.00 0.00 C ATOM 1443 CD GLU A 92 6.738 -15.316 -11.621 1.00 0.00 C ATOM 1444 OE1 GLU A 92 6.236 -15.420 -10.478 1.00 0.00 O ATOM 1445 OE2 GLU A 92 7.783 -15.927 -11.945 1.00 0.00 O ATOM 0 H GLU A 92 5.974 -10.564 -11.830 1.00 0.00 H new ATOM 0 HA GLU A 92 5.826 -12.122 -14.255 1.00 0.00 H new ATOM 0 HB2 GLU A 92 7.241 -12.680 -12.293 1.00 0.00 H new ATOM 0 HB3 GLU A 92 5.816 -12.786 -11.278 1.00 0.00 H new ATOM 0 HG2 GLU A 92 4.978 -14.687 -12.709 1.00 0.00 H new ATOM 0 HG3 GLU A 92 6.458 -14.606 -13.644 1.00 0.00 H new ATOM 1452 N MET A 93 3.171 -11.919 -12.276 1.00 0.00 N ATOM 1453 CA MET A 93 1.741 -12.215 -12.176 1.00 0.00 C ATOM 1454 C MET A 93 0.936 -11.530 -13.282 1.00 0.00 C ATOM 1455 O MET A 93 -0.013 -12.125 -13.793 1.00 0.00 O ATOM 1456 CB MET A 93 1.203 -11.779 -10.800 1.00 0.00 C ATOM 1457 CG MET A 93 1.586 -12.748 -9.673 1.00 0.00 C ATOM 1458 SD MET A 93 0.797 -14.385 -9.736 1.00 0.00 S ATOM 1459 CE MET A 93 -0.921 -13.953 -9.335 1.00 0.00 C ATOM 0 H MET A 93 3.535 -11.385 -11.487 1.00 0.00 H new ATOM 0 HA MET A 93 1.624 -13.292 -12.294 1.00 0.00 H new ATOM 0 HB2 MET A 93 1.586 -10.786 -10.564 1.00 0.00 H new ATOM 0 HB3 MET A 93 0.117 -11.698 -10.849 1.00 0.00 H new ATOM 0 HG2 MET A 93 2.667 -12.886 -9.689 1.00 0.00 H new ATOM 0 HG3 MET A 93 1.338 -12.282 -8.719 1.00 0.00 H new ATOM 0 HE1 MET A 93 -1.506 -14.864 -9.212 1.00 0.00 H new ATOM 0 HE2 MET A 93 -0.945 -13.379 -8.409 1.00 0.00 H new ATOM 0 HE3 MET A 93 -1.344 -13.356 -10.143 1.00 0.00 H new ATOM 1469 N ALA A 94 1.302 -10.298 -13.655 1.00 0.00 N ATOM 1470 CA ALA A 94 0.572 -9.522 -14.649 1.00 0.00 C ATOM 1471 C ALA A 94 1.556 -8.743 -15.527 1.00 0.00 C ATOM 1472 O ALA A 94 1.778 -7.555 -15.285 1.00 0.00 O ATOM 1473 CB ALA A 94 -0.435 -8.604 -13.939 1.00 0.00 C ATOM 0 H ALA A 94 2.115 -9.815 -13.272 1.00 0.00 H new ATOM 0 HA ALA A 94 0.009 -10.183 -15.308 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -0.983 -8.022 -14.680 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -1.135 -9.209 -13.363 1.00 0.00 H new ATOM 0 HB3 ALA A 94 0.098 -7.929 -13.269 1.00 0.00 H new ATOM 1479 N PRO A 95 2.151 -9.373 -16.558 1.00 0.00 N ATOM 1480 CA PRO A 95 3.018 -8.686 -17.511 1.00 0.00 C ATOM 1481 C PRO A 95 2.348 -7.467 -18.162 1.00 0.00 C ATOM 1482 O PRO A 95 3.018 -6.470 -18.425 1.00 0.00 O ATOM 1483 CB PRO A 95 3.418 -9.736 -18.552 1.00 0.00 C ATOM 1484 CG PRO A 95 3.226 -11.066 -17.824 1.00 0.00 C ATOM 1485 CD PRO A 95 2.053 -10.786 -16.890 1.00 0.00 C ATOM 0 HA PRO A 95 3.889 -8.276 -17.000 1.00 0.00 H new ATOM 0 HB2 PRO A 95 2.793 -9.674 -19.443 1.00 0.00 H new ATOM 0 HB3 PRO A 95 4.450 -9.604 -18.877 1.00 0.00 H new ATOM 0 HG2 PRO A 95 3.003 -11.876 -18.518 1.00 0.00 H new ATOM 0 HG3 PRO A 95 4.120 -11.356 -17.272 1.00 0.00 H new ATOM 0 HD2 PRO A 95 1.103 -11.011 -17.375 1.00 0.00 H new ATOM 0 HD3 PRO A 95 2.108 -11.405 -15.994 1.00 0.00 H new ATOM 1493 N GLU A 96 1.024 -7.498 -18.367 1.00 0.00 N ATOM 1494 CA GLU A 96 0.272 -6.359 -18.905 1.00 0.00 C ATOM 1495 C GLU A 96 0.312 -5.124 -17.986 1.00 0.00 C ATOM 1496 O GLU A 96 0.064 -4.006 -18.445 1.00 0.00 O ATOM 1497 CB GLU A 96 -1.171 -6.800 -19.211 1.00 0.00 C ATOM 1498 CG GLU A 96 -2.009 -7.099 -17.958 1.00 0.00 C ATOM 1499 CD GLU A 96 -3.271 -7.897 -18.301 1.00 0.00 C ATOM 1500 OE1 GLU A 96 -3.177 -9.142 -18.388 1.00 0.00 O ATOM 1501 OE2 GLU A 96 -4.367 -7.316 -18.446 1.00 0.00 O ATOM 0 H GLU A 96 0.446 -8.313 -18.164 1.00 0.00 H new ATOM 0 HA GLU A 96 0.754 -6.043 -19.830 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -1.665 -6.018 -19.788 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -1.143 -7.691 -19.839 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -1.407 -7.659 -17.242 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -2.290 -6.163 -17.475 1.00 0.00 H new ATOM 1508 N MET A 97 0.666 -5.306 -16.708 1.00 0.00 N ATOM 1509 CA MET A 97 0.808 -4.241 -15.720 1.00 0.00 C ATOM 1510 C MET A 97 2.279 -3.985 -15.377 1.00 0.00 C ATOM 1511 O MET A 97 2.557 -3.153 -14.519 1.00 0.00 O ATOM 1512 CB MET A 97 -0.021 -4.552 -14.460 1.00 0.00 C ATOM 1513 CG MET A 97 -1.525 -4.685 -14.740 1.00 0.00 C ATOM 1514 SD MET A 97 -2.319 -3.278 -15.576 1.00 0.00 S ATOM 1515 CE MET A 97 -2.314 -2.039 -14.251 1.00 0.00 C ATOM 0 H MET A 97 0.867 -6.230 -16.325 1.00 0.00 H new ATOM 0 HA MET A 97 0.418 -3.323 -16.159 1.00 0.00 H new ATOM 0 HB2 MET A 97 0.342 -5.478 -14.014 1.00 0.00 H new ATOM 0 HB3 MET A 97 0.136 -3.762 -13.726 1.00 0.00 H new ATOM 0 HG2 MET A 97 -1.682 -5.576 -15.347 1.00 0.00 H new ATOM 0 HG3 MET A 97 -2.036 -4.852 -13.792 1.00 0.00 H new ATOM 0 HE1 MET A 97 -2.517 -1.055 -14.673 1.00 0.00 H new ATOM 0 HE2 MET A 97 -3.083 -2.286 -13.519 1.00 0.00 H new ATOM 0 HE3 MET A 97 -1.339 -2.031 -13.764 1.00 0.00 H new ATOM 1525 N ARG A 98 3.239 -4.634 -16.047 1.00 0.00 N ATOM 1526 CA ARG A 98 4.671 -4.503 -15.749 1.00 0.00 C ATOM 1527 C ARG A 98 5.146 -3.046 -15.803 1.00 0.00 C ATOM 1528 O ARG A 98 5.965 -2.644 -14.979 1.00 0.00 O ATOM 1529 CB ARG A 98 5.436 -5.419 -16.718 1.00 0.00 C ATOM 1530 CG ARG A 98 6.941 -5.547 -16.445 1.00 0.00 C ATOM 1531 CD ARG A 98 7.562 -6.694 -17.258 1.00 0.00 C ATOM 1532 NE ARG A 98 7.027 -8.019 -16.873 1.00 0.00 N ATOM 1533 CZ ARG A 98 7.376 -9.193 -17.414 1.00 0.00 C ATOM 1534 NH1 ARG A 98 8.276 -9.256 -18.391 1.00 0.00 N ATOM 1535 NH2 ARG A 98 6.805 -10.304 -16.961 1.00 0.00 N ATOM 0 H ARG A 98 3.042 -5.271 -16.819 1.00 0.00 H new ATOM 0 HA ARG A 98 4.869 -4.816 -14.724 1.00 0.00 H new ATOM 0 HB2 ARG A 98 4.990 -6.413 -16.681 1.00 0.00 H new ATOM 0 HB3 ARG A 98 5.297 -5.045 -17.732 1.00 0.00 H new ATOM 0 HG2 ARG A 98 7.439 -4.610 -16.695 1.00 0.00 H new ATOM 0 HG3 ARG A 98 7.106 -5.721 -15.382 1.00 0.00 H new ATOM 0 HD2 ARG A 98 7.375 -6.525 -18.319 1.00 0.00 H new ATOM 0 HD3 ARG A 98 8.643 -6.689 -17.120 1.00 0.00 H new ATOM 0 HE ARG A 98 6.330 -8.040 -16.129 1.00 0.00 H new ATOM 0 HH11 ARG A 98 8.712 -8.402 -18.739 1.00 0.00 H new ATOM 0 HH12 ARG A 98 8.531 -10.158 -18.792 1.00 0.00 H new ATOM 0 HH21 ARG A 98 6.113 -10.253 -16.213 1.00 0.00 H new ATOM 0 HH22 ARG A 98 7.058 -11.207 -17.361 1.00 0.00 H new ATOM 1549 N GLY A 99 4.586 -2.237 -16.710 1.00 0.00 N ATOM 1550 CA GLY A 99 4.897 -0.814 -16.831 1.00 0.00 C ATOM 1551 C GLY A 99 4.114 0.080 -15.860 1.00 0.00 C ATOM 1552 O GLY A 99 4.267 1.302 -15.916 1.00 0.00 O ATOM 0 H GLY A 99 3.896 -2.560 -17.388 1.00 0.00 H new ATOM 0 HA2 GLY A 99 5.964 -0.670 -16.661 1.00 0.00 H new ATOM 0 HA3 GLY A 99 4.690 -0.493 -17.852 1.00 0.00 H new ATOM 1556 N LYS A 100 3.269 -0.490 -14.990 1.00 0.00 N ATOM 1557 CA LYS A 100 2.363 0.229 -14.086 1.00 0.00 C ATOM 1558 C LYS A 100 2.484 -0.275 -12.640 1.00 0.00 C ATOM 1559 O LYS A 100 1.713 0.168 -11.787 1.00 0.00 O ATOM 1560 CB LYS A 100 0.900 0.121 -14.567 1.00 0.00 C ATOM 1561 CG LYS A 100 0.613 0.564 -16.017 1.00 0.00 C ATOM 1562 CD LYS A 100 0.619 -0.616 -17.003 1.00 0.00 C ATOM 1563 CE LYS A 100 0.228 -0.188 -18.422 1.00 0.00 C ATOM 1564 NZ LYS A 100 0.342 -1.308 -19.391 1.00 0.00 N ATOM 0 H LYS A 100 3.196 -1.503 -14.894 1.00 0.00 H new ATOM 0 HA LYS A 100 2.660 1.278 -14.103 1.00 0.00 H new ATOM 0 HB2 LYS A 100 0.582 -0.916 -14.459 1.00 0.00 H new ATOM 0 HB3 LYS A 100 0.277 0.717 -13.900 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -0.356 1.062 -16.057 1.00 0.00 H new ATOM 0 HG3 LYS A 100 1.360 1.295 -16.325 1.00 0.00 H new ATOM 0 HD2 LYS A 100 1.611 -1.066 -17.022 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -0.072 -1.383 -16.653 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -0.796 0.186 -18.419 1.00 0.00 H new ATOM 0 HE3 LYS A 100 0.867 0.635 -18.742 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -0.390 -1.209 -20.124 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 1.282 -1.288 -19.836 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 0.213 -2.212 -18.893 1.00 0.00 H new ATOM 1578 N VAL A 101 3.418 -1.186 -12.347 1.00 0.00 N ATOM 1579 CA VAL A 101 3.754 -1.563 -10.979 1.00 0.00 C ATOM 1580 C VAL A 101 4.964 -0.708 -10.580 1.00 0.00 C ATOM 1581 O VAL A 101 5.897 -0.576 -11.378 1.00 0.00 O ATOM 1582 CB VAL A 101 4.076 -3.073 -10.915 1.00 0.00 C ATOM 1583 CG1 VAL A 101 4.575 -3.500 -9.524 1.00 0.00 C ATOM 1584 CG2 VAL A 101 2.855 -3.947 -11.252 1.00 0.00 C ATOM 0 H VAL A 101 3.960 -1.680 -13.056 1.00 0.00 H new ATOM 0 HA VAL A 101 2.926 -1.389 -10.292 1.00 0.00 H new ATOM 0 HB VAL A 101 4.858 -3.225 -11.659 1.00 0.00 H new ATOM 0 HG11 VAL A 101 4.789 -4.569 -9.526 1.00 0.00 H new ATOM 0 HG12 VAL A 101 5.483 -2.949 -9.278 1.00 0.00 H new ATOM 0 HG13 VAL A 101 3.808 -3.285 -8.780 1.00 0.00 H new ATOM 0 HG21 VAL A 101 3.133 -4.999 -11.193 1.00 0.00 H new ATOM 0 HG22 VAL A 101 2.054 -3.743 -10.541 1.00 0.00 H new ATOM 0 HG23 VAL A 101 2.511 -3.719 -12.261 1.00 0.00 H new ATOM 1594 N MET A 102 4.986 -0.155 -9.361 1.00 0.00 N ATOM 1595 CA MET A 102 6.187 0.484 -8.814 1.00 0.00 C ATOM 1596 C MET A 102 6.208 0.412 -7.283 1.00 0.00 C ATOM 1597 O MET A 102 5.272 -0.090 -6.654 1.00 0.00 O ATOM 1598 CB MET A 102 6.355 1.923 -9.345 1.00 0.00 C ATOM 1599 CG MET A 102 5.381 2.949 -8.756 1.00 0.00 C ATOM 1600 SD MET A 102 5.693 4.649 -9.305 1.00 0.00 S ATOM 1601 CE MET A 102 4.974 4.596 -10.969 1.00 0.00 C ATOM 0 H MET A 102 4.182 -0.138 -8.734 1.00 0.00 H new ATOM 0 HA MET A 102 7.054 -0.076 -9.165 1.00 0.00 H new ATOM 0 HB2 MET A 102 7.374 2.253 -9.141 1.00 0.00 H new ATOM 0 HB3 MET A 102 6.235 1.911 -10.428 1.00 0.00 H new ATOM 0 HG2 MET A 102 4.363 2.669 -9.029 1.00 0.00 H new ATOM 0 HG3 MET A 102 5.441 2.911 -7.668 1.00 0.00 H new ATOM 0 HE1 MET A 102 5.652 5.077 -11.674 1.00 0.00 H new ATOM 0 HE2 MET A 102 4.818 3.559 -11.265 1.00 0.00 H new ATOM 0 HE3 MET A 102 4.019 5.121 -10.969 1.00 0.00 H new ATOM 1611 N LEU A 103 7.298 0.891 -6.681 1.00 0.00 N ATOM 1612 CA LEU A 103 7.478 0.880 -5.234 1.00 0.00 C ATOM 1613 C LEU A 103 6.624 1.975 -4.586 1.00 0.00 C ATOM 1614 O LEU A 103 6.628 3.116 -5.047 1.00 0.00 O ATOM 1615 CB LEU A 103 8.969 1.122 -4.939 1.00 0.00 C ATOM 1616 CG LEU A 103 9.402 0.765 -3.507 1.00 0.00 C ATOM 1617 CD1 LEU A 103 9.373 -0.746 -3.243 1.00 0.00 C ATOM 1618 CD2 LEU A 103 10.824 1.287 -3.304 1.00 0.00 C ATOM 0 H LEU A 103 8.083 1.299 -7.189 1.00 0.00 H new ATOM 0 HA LEU A 103 7.164 -0.079 -4.822 1.00 0.00 H new ATOM 0 HB2 LEU A 103 9.565 0.539 -5.641 1.00 0.00 H new ATOM 0 HB3 LEU A 103 9.197 2.172 -5.123 1.00 0.00 H new ATOM 0 HG LEU A 103 8.700 1.223 -2.810 1.00 0.00 H new ATOM 0 HD11 LEU A 103 9.687 -0.942 -2.218 1.00 0.00 H new ATOM 0 HD12 LEU A 103 8.360 -1.122 -3.390 1.00 0.00 H new ATOM 0 HD13 LEU A 103 10.051 -1.249 -3.933 1.00 0.00 H new ATOM 0 HD21 LEU A 103 11.159 1.048 -2.295 1.00 0.00 H new ATOM 0 HD22 LEU A 103 11.490 0.818 -4.028 1.00 0.00 H new ATOM 0 HD23 LEU A 103 10.838 2.368 -3.444 1.00 0.00 H new ATOM 1630 N PHE A 104 5.947 1.662 -3.480 1.00 0.00 N ATOM 1631 CA PHE A 104 5.166 2.639 -2.725 1.00 0.00 C ATOM 1632 C PHE A 104 6.061 3.771 -2.203 1.00 0.00 C ATOM 1633 O PHE A 104 5.697 4.941 -2.303 1.00 0.00 O ATOM 1634 CB PHE A 104 4.436 1.933 -1.570 1.00 0.00 C ATOM 1635 CG PHE A 104 3.366 2.789 -0.918 1.00 0.00 C ATOM 1636 CD1 PHE A 104 2.102 2.899 -1.527 1.00 0.00 C ATOM 1637 CD2 PHE A 104 3.624 3.486 0.278 1.00 0.00 C ATOM 1638 CE1 PHE A 104 1.114 3.723 -0.970 1.00 0.00 C ATOM 1639 CE2 PHE A 104 2.623 4.293 0.852 1.00 0.00 C ATOM 1640 CZ PHE A 104 1.377 4.423 0.218 1.00 0.00 C ATOM 0 H PHE A 104 5.926 0.723 -3.083 1.00 0.00 H new ATOM 0 HA PHE A 104 4.425 3.088 -3.387 1.00 0.00 H new ATOM 0 HB2 PHE A 104 3.979 1.017 -1.945 1.00 0.00 H new ATOM 0 HB3 PHE A 104 5.165 1.639 -0.815 1.00 0.00 H new ATOM 0 HD1 PHE A 104 1.892 2.345 -2.430 1.00 0.00 H new ATOM 0 HD2 PHE A 104 4.589 3.402 0.755 1.00 0.00 H new ATOM 0 HE1 PHE A 104 0.153 3.819 -1.454 1.00 0.00 H new ATOM 0 HE2 PHE A 104 2.814 4.812 1.780 1.00 0.00 H new ATOM 0 HZ PHE A 104 0.619 5.063 0.645 1.00 0.00 H new ATOM 1650 N GLY A 105 7.262 3.429 -1.723 1.00 0.00 N ATOM 1651 CA GLY A 105 8.216 4.390 -1.174 1.00 0.00 C ATOM 1652 C GLY A 105 9.101 5.041 -2.240 1.00 0.00 C ATOM 1653 O GLY A 105 10.175 5.537 -1.905 1.00 0.00 O ATOM 0 H GLY A 105 7.599 2.466 -1.706 1.00 0.00 H new ATOM 0 HA2 GLY A 105 7.671 5.168 -0.640 1.00 0.00 H new ATOM 0 HA3 GLY A 105 8.849 3.886 -0.444 1.00 0.00 H new ATOM 1657 N HIS A 106 8.706 5.004 -3.521 1.00 0.00 N ATOM 1658 CA HIS A 106 9.505 5.493 -4.646 1.00 0.00 C ATOM 1659 C HIS A 106 10.062 6.904 -4.413 1.00 0.00 C ATOM 1660 O HIS A 106 11.250 7.138 -4.647 1.00 0.00 O ATOM 1661 CB HIS A 106 8.664 5.413 -5.927 1.00 0.00 C ATOM 1662 CG HIS A 106 9.208 6.187 -7.104 1.00 0.00 C ATOM 1663 ND1 HIS A 106 10.198 5.789 -7.976 1.00 0.00 N ATOM 1664 CD2 HIS A 106 8.794 7.431 -7.509 1.00 0.00 C ATOM 1665 CE1 HIS A 106 10.381 6.770 -8.874 1.00 0.00 C ATOM 1666 NE2 HIS A 106 9.546 7.799 -8.632 1.00 0.00 N ATOM 0 H HIS A 106 7.803 4.625 -3.806 1.00 0.00 H new ATOM 0 HA HIS A 106 10.382 4.853 -4.749 1.00 0.00 H new ATOM 0 HB2 HIS A 106 8.568 4.366 -6.214 1.00 0.00 H new ATOM 0 HB3 HIS A 106 7.660 5.776 -5.707 1.00 0.00 H new ATOM 0 HD1 HIS A 106 10.704 4.904 -7.945 1.00 0.00 H new ATOM 0 HD2 HIS A 106 8.021 8.024 -7.042 1.00 0.00 H new ATOM 0 HE1 HIS A 106 11.099 6.739 -9.680 1.00 0.00 H new ATOM 1674 N TRP A 107 9.228 7.828 -3.923 1.00 0.00 N ATOM 1675 CA TRP A 107 9.624 9.223 -3.729 1.00 0.00 C ATOM 1676 C TRP A 107 10.778 9.367 -2.734 1.00 0.00 C ATOM 1677 O TRP A 107 11.599 10.277 -2.865 1.00 0.00 O ATOM 1678 CB TRP A 107 8.426 10.027 -3.217 1.00 0.00 C ATOM 1679 CG TRP A 107 7.152 9.838 -3.977 1.00 0.00 C ATOM 1680 CD1 TRP A 107 6.126 9.050 -3.591 1.00 0.00 C ATOM 1681 CD2 TRP A 107 6.739 10.437 -5.245 1.00 0.00 C ATOM 1682 NE1 TRP A 107 5.120 9.115 -4.524 1.00 0.00 N ATOM 1683 CE2 TRP A 107 5.435 9.956 -5.567 1.00 0.00 C ATOM 1684 CE3 TRP A 107 7.332 11.336 -6.157 1.00 0.00 C ATOM 1685 CZ2 TRP A 107 4.756 10.344 -6.731 1.00 0.00 C ATOM 1686 CZ3 TRP A 107 6.660 11.736 -7.328 1.00 0.00 C ATOM 1687 CH2 TRP A 107 5.375 11.242 -7.617 1.00 0.00 C ATOM 0 H TRP A 107 8.265 7.629 -3.652 1.00 0.00 H new ATOM 0 HA TRP A 107 9.963 9.601 -4.693 1.00 0.00 H new ATOM 0 HB2 TRP A 107 8.250 9.760 -2.175 1.00 0.00 H new ATOM 0 HB3 TRP A 107 8.686 11.085 -3.235 1.00 0.00 H new ATOM 0 HD1 TRP A 107 6.100 8.459 -2.687 1.00 0.00 H new ATOM 0 HE1 TRP A 107 4.242 8.600 -4.452 1.00 0.00 H new ATOM 0 HE3 TRP A 107 8.319 11.724 -5.953 1.00 0.00 H new ATOM 0 HZ2 TRP A 107 3.770 9.958 -6.944 1.00 0.00 H new ATOM 0 HZ3 TRP A 107 7.135 12.427 -8.009 1.00 0.00 H new ATOM 0 HH2 TRP A 107 4.866 11.552 -8.517 1.00 0.00 H new ATOM 1698 N ASP A 108 10.848 8.469 -1.748 1.00 0.00 N ATOM 1699 CA ASP A 108 11.883 8.476 -0.723 1.00 0.00 C ATOM 1700 C ASP A 108 13.099 7.710 -1.230 1.00 0.00 C ATOM 1701 O ASP A 108 13.505 6.708 -0.646 1.00 0.00 O ATOM 1702 CB ASP A 108 11.319 7.915 0.590 1.00 0.00 C ATOM 1703 CG ASP A 108 12.309 8.071 1.753 1.00 0.00 C ATOM 1704 OD1 ASP A 108 13.006 9.108 1.828 1.00 0.00 O ATOM 1705 OD2 ASP A 108 12.261 7.261 2.705 1.00 0.00 O ATOM 0 H ASP A 108 10.176 7.709 -1.642 1.00 0.00 H new ATOM 0 HA ASP A 108 12.210 9.494 -0.512 1.00 0.00 H new ATOM 0 HB2 ASP A 108 10.389 8.428 0.834 1.00 0.00 H new ATOM 0 HB3 ASP A 108 11.076 6.860 0.459 1.00 0.00 H new ATOM 1710 N ASN A 109 13.652 8.177 -2.357 1.00 0.00 N ATOM 1711 CA ASN A 109 14.860 7.616 -2.967 1.00 0.00 C ATOM 1712 C ASN A 109 14.758 6.090 -3.154 1.00 0.00 C ATOM 1713 O ASN A 109 15.703 5.342 -2.898 1.00 0.00 O ATOM 1714 CB ASN A 109 16.076 8.086 -2.153 1.00 0.00 C ATOM 1715 CG ASN A 109 17.409 7.659 -2.752 1.00 0.00 C ATOM 1716 OD1 ASN A 109 17.608 7.657 -3.965 1.00 0.00 O ATOM 1717 ND2 ASN A 109 18.356 7.320 -1.898 1.00 0.00 N ATOM 0 H ASN A 109 13.266 8.966 -2.876 1.00 0.00 H new ATOM 0 HA ASN A 109 14.983 7.988 -3.984 1.00 0.00 H new ATOM 0 HB2 ASN A 109 16.053 9.173 -2.075 1.00 0.00 H new ATOM 0 HB3 ASN A 109 15.999 7.692 -1.140 1.00 0.00 H new ATOM 0 HD21 ASN A 109 19.278 7.048 -2.240 1.00 0.00 H new ATOM 0 HD22 ASN A 109 18.166 7.330 -0.896 1.00 0.00 H new ATOM 1724 N GLU A 110 13.569 5.645 -3.581 1.00 0.00 N ATOM 1725 CA GLU A 110 13.220 4.234 -3.769 1.00 0.00 C ATOM 1726 C GLU A 110 13.619 3.330 -2.596 1.00 0.00 C ATOM 1727 O GLU A 110 14.098 2.208 -2.783 1.00 0.00 O ATOM 1728 CB GLU A 110 13.678 3.722 -5.147 1.00 0.00 C ATOM 1729 CG GLU A 110 13.156 4.630 -6.267 1.00 0.00 C ATOM 1730 CD GLU A 110 13.160 3.942 -7.639 1.00 0.00 C ATOM 1731 OE1 GLU A 110 14.248 3.690 -8.208 1.00 0.00 O ATOM 1732 OE2 GLU A 110 12.056 3.678 -8.167 1.00 0.00 O ATOM 0 H GLU A 110 12.802 6.277 -3.811 1.00 0.00 H new ATOM 0 HA GLU A 110 12.131 4.178 -3.766 1.00 0.00 H new ATOM 0 HB2 GLU A 110 14.767 3.683 -5.182 1.00 0.00 H new ATOM 0 HB3 GLU A 110 13.318 2.705 -5.300 1.00 0.00 H new ATOM 0 HG2 GLU A 110 12.141 4.948 -6.028 1.00 0.00 H new ATOM 0 HG3 GLU A 110 13.769 5.530 -6.315 1.00 0.00 H new ATOM 1739 N CYS A 111 13.421 3.831 -1.378 1.00 0.00 N ATOM 1740 CA CYS A 111 13.568 3.028 -0.176 1.00 0.00 C ATOM 1741 C CYS A 111 12.376 2.074 -0.076 1.00 0.00 C ATOM 1742 O CYS A 111 11.226 2.522 -0.049 1.00 0.00 O ATOM 1743 CB CYS A 111 13.620 3.937 1.054 1.00 0.00 C ATOM 1744 SG CYS A 111 15.202 4.826 1.104 1.00 0.00 S ATOM 0 H CYS A 111 13.156 4.800 -1.202 1.00 0.00 H new ATOM 0 HA CYS A 111 14.494 2.455 -0.222 1.00 0.00 H new ATOM 0 HB2 CYS A 111 12.795 4.648 1.026 1.00 0.00 H new ATOM 0 HB3 CYS A 111 13.498 3.344 1.960 1.00 0.00 H new ATOM 0 HG CYS A 111 15.119 5.900 0.376 1.00 0.00 H new ATOM 1750 N GLU A 112 12.638 0.765 -0.016 1.00 0.00 N ATOM 1751 CA GLU A 112 11.596 -0.207 0.300 1.00 0.00 C ATOM 1752 C GLU A 112 11.254 -0.121 1.792 1.00 0.00 C ATOM 1753 O GLU A 112 12.025 0.418 2.594 1.00 0.00 O ATOM 1754 CB GLU A 112 11.978 -1.621 -0.164 1.00 0.00 C ATOM 1755 CG GLU A 112 13.327 -2.169 0.321 1.00 0.00 C ATOM 1756 CD GLU A 112 13.562 -3.633 -0.116 1.00 0.00 C ATOM 1757 OE1 GLU A 112 12.863 -4.139 -1.025 1.00 0.00 O ATOM 1758 OE2 GLU A 112 14.469 -4.283 0.456 1.00 0.00 O ATOM 0 H GLU A 112 13.559 0.359 -0.182 1.00 0.00 H new ATOM 0 HA GLU A 112 10.691 0.036 -0.257 1.00 0.00 H new ATOM 0 HB2 GLU A 112 11.196 -2.308 0.161 1.00 0.00 H new ATOM 0 HB3 GLU A 112 11.979 -1.632 -1.254 1.00 0.00 H new ATOM 0 HG2 GLU A 112 14.131 -1.544 -0.068 1.00 0.00 H new ATOM 0 HG3 GLU A 112 13.372 -2.106 1.408 1.00 0.00 H new ATOM 1765 N ILE A 113 10.086 -0.651 2.158 1.00 0.00 N ATOM 1766 CA ILE A 113 9.505 -0.453 3.483 1.00 0.00 C ATOM 1767 C ILE A 113 9.571 -1.786 4.251 1.00 0.00 C ATOM 1768 O ILE A 113 9.271 -2.829 3.658 1.00 0.00 O ATOM 1769 CB ILE A 113 8.075 0.120 3.324 1.00 0.00 C ATOM 1770 CG1 ILE A 113 8.125 1.422 2.479 1.00 0.00 C ATOM 1771 CG2 ILE A 113 7.375 0.333 4.679 1.00 0.00 C ATOM 1772 CD1 ILE A 113 6.800 2.173 2.340 1.00 0.00 C ATOM 0 H ILE A 113 9.517 -1.231 1.541 1.00 0.00 H new ATOM 0 HA ILE A 113 10.062 0.275 4.073 1.00 0.00 H new ATOM 0 HB ILE A 113 7.469 -0.614 2.793 1.00 0.00 H new ATOM 0 HG12 ILE A 113 8.858 2.095 2.925 1.00 0.00 H new ATOM 0 HG13 ILE A 113 8.487 1.172 1.481 1.00 0.00 H new ATOM 0 HG21 ILE A 113 6.376 0.736 4.513 1.00 0.00 H new ATOM 0 HG22 ILE A 113 7.300 -0.620 5.203 1.00 0.00 H new ATOM 0 HG23 ILE A 113 7.953 1.034 5.281 1.00 0.00 H new ATOM 0 HD11 ILE A 113 6.949 3.065 1.732 1.00 0.00 H new ATOM 0 HD12 ILE A 113 6.064 1.527 1.862 1.00 0.00 H new ATOM 0 HD13 ILE A 113 6.441 2.463 3.327 1.00 0.00 H new ATOM 1784 N PRO A 114 9.975 -1.782 5.540 1.00 0.00 N ATOM 1785 CA PRO A 114 10.006 -2.977 6.381 1.00 0.00 C ATOM 1786 C PRO A 114 8.650 -3.686 6.485 1.00 0.00 C ATOM 1787 O PRO A 114 7.610 -3.152 6.086 1.00 0.00 O ATOM 1788 CB PRO A 114 10.483 -2.517 7.766 1.00 0.00 C ATOM 1789 CG PRO A 114 11.195 -1.195 7.502 1.00 0.00 C ATOM 1790 CD PRO A 114 10.457 -0.630 6.292 1.00 0.00 C ATOM 0 HA PRO A 114 10.675 -3.714 5.937 1.00 0.00 H new ATOM 0 HB2 PRO A 114 9.646 -2.387 8.452 1.00 0.00 H new ATOM 0 HB3 PRO A 114 11.155 -3.247 8.218 1.00 0.00 H new ATOM 0 HG2 PRO A 114 11.131 -0.526 8.360 1.00 0.00 H new ATOM 0 HG3 PRO A 114 12.254 -1.344 7.293 1.00 0.00 H new ATOM 0 HD2 PRO A 114 9.629 0.007 6.603 1.00 0.00 H new ATOM 0 HD3 PRO A 114 11.120 -0.016 5.682 1.00 0.00 H new ATOM 1798 N ASP A 115 8.653 -4.870 7.098 1.00 0.00 N ATOM 1799 CA ASP A 115 7.454 -5.662 7.354 1.00 0.00 C ATOM 1800 C ASP A 115 7.264 -5.811 8.865 1.00 0.00 C ATOM 1801 O ASP A 115 8.060 -6.508 9.504 1.00 0.00 O ATOM 1802 CB ASP A 115 7.552 -7.040 6.695 1.00 0.00 C ATOM 1803 CG ASP A 115 6.344 -7.918 7.066 1.00 0.00 C ATOM 1804 OD1 ASP A 115 5.271 -7.366 7.403 1.00 0.00 O ATOM 1805 OD2 ASP A 115 6.482 -9.160 7.011 1.00 0.00 O ATOM 0 H ASP A 115 9.507 -5.313 7.437 1.00 0.00 H new ATOM 0 HA ASP A 115 6.595 -5.148 6.923 1.00 0.00 H new ATOM 0 HB2 ASP A 115 7.604 -6.926 5.612 1.00 0.00 H new ATOM 0 HB3 ASP A 115 8.473 -7.532 7.008 1.00 0.00 H new ATOM 1810 N PRO A 116 6.259 -5.149 9.462 1.00 0.00 N ATOM 1811 CA PRO A 116 6.036 -5.170 10.893 1.00 0.00 C ATOM 1812 C PRO A 116 5.194 -6.375 11.349 1.00 0.00 C ATOM 1813 O PRO A 116 4.944 -6.457 12.545 1.00 0.00 O ATOM 1814 CB PRO A 116 5.325 -3.846 11.183 1.00 0.00 C ATOM 1815 CG PRO A 116 4.436 -3.674 9.954 1.00 0.00 C ATOM 1816 CD PRO A 116 5.298 -4.255 8.831 1.00 0.00 C ATOM 0 HA PRO A 116 6.972 -5.275 11.441 1.00 0.00 H new ATOM 0 HB2 PRO A 116 4.742 -3.891 12.103 1.00 0.00 H new ATOM 0 HB3 PRO A 116 6.030 -3.022 11.293 1.00 0.00 H new ATOM 0 HG2 PRO A 116 3.493 -4.210 10.059 1.00 0.00 H new ATOM 0 HG3 PRO A 116 4.190 -2.627 9.775 1.00 0.00 H new ATOM 0 HD2 PRO A 116 4.683 -4.794 8.110 1.00 0.00 H new ATOM 0 HD3 PRO A 116 5.808 -3.462 8.285 1.00 0.00 H new ATOM 1824 N TYR A 117 4.773 -7.291 10.457 1.00 0.00 N ATOM 1825 CA TYR A 117 3.799 -8.368 10.679 1.00 0.00 C ATOM 1826 C TYR A 117 3.547 -8.782 12.139 1.00 0.00 C ATOM 1827 O TYR A 117 2.454 -8.528 12.641 1.00 0.00 O ATOM 1828 CB TYR A 117 4.160 -9.563 9.785 1.00 0.00 C ATOM 1829 CG TYR A 117 3.193 -10.730 9.857 1.00 0.00 C ATOM 1830 CD1 TYR A 117 1.827 -10.527 9.580 1.00 0.00 C ATOM 1831 CD2 TYR A 117 3.661 -12.017 10.181 1.00 0.00 C ATOM 1832 CE1 TYR A 117 0.923 -11.600 9.657 1.00 0.00 C ATOM 1833 CE2 TYR A 117 2.765 -13.098 10.244 1.00 0.00 C ATOM 1834 CZ TYR A 117 1.388 -12.893 9.999 1.00 0.00 C ATOM 1835 OH TYR A 117 0.526 -13.944 10.108 1.00 0.00 O ATOM 0 H TYR A 117 5.129 -7.296 9.501 1.00 0.00 H new ATOM 0 HA TYR A 117 2.832 -7.954 10.395 1.00 0.00 H new ATOM 0 HB2 TYR A 117 4.217 -9.221 8.752 1.00 0.00 H new ATOM 0 HB3 TYR A 117 5.154 -9.916 10.059 1.00 0.00 H new ATOM 0 HD1 TYR A 117 1.473 -9.544 9.308 1.00 0.00 H new ATOM 0 HD2 TYR A 117 4.710 -12.174 10.382 1.00 0.00 H new ATOM 0 HE1 TYR A 117 -0.126 -11.439 9.455 1.00 0.00 H new ATOM 0 HE2 TYR A 117 3.129 -14.087 10.480 1.00 0.00 H new ATOM 0 HH TYR A 117 1.025 -14.752 10.349 1.00 0.00 H new ATOM 1845 N ARG A 118 4.515 -9.387 12.844 1.00 0.00 N ATOM 1846 CA ARG A 118 4.398 -9.677 14.289 1.00 0.00 C ATOM 1847 C ARG A 118 5.599 -9.091 15.053 1.00 0.00 C ATOM 1848 O ARG A 118 6.014 -9.602 16.096 1.00 0.00 O ATOM 1849 CB ARG A 118 4.154 -11.188 14.542 1.00 0.00 C ATOM 1850 CG ARG A 118 2.664 -11.569 14.641 1.00 0.00 C ATOM 1851 CD ARG A 118 1.994 -11.825 13.286 1.00 0.00 C ATOM 1852 NE ARG A 118 0.527 -11.942 13.404 1.00 0.00 N ATOM 1853 CZ ARG A 118 -0.334 -10.916 13.458 1.00 0.00 C ATOM 1854 NH1 ARG A 118 0.078 -9.658 13.442 1.00 0.00 N ATOM 1855 NH2 ARG A 118 -1.643 -11.109 13.532 1.00 0.00 N ATOM 0 H ARG A 118 5.399 -9.690 12.435 1.00 0.00 H new ATOM 0 HA ARG A 118 3.515 -9.178 14.689 1.00 0.00 H new ATOM 0 HB2 ARG A 118 4.613 -11.761 13.736 1.00 0.00 H new ATOM 0 HB3 ARG A 118 4.656 -11.478 15.465 1.00 0.00 H new ATOM 0 HG2 ARG A 118 2.568 -12.463 15.257 1.00 0.00 H new ATOM 0 HG3 ARG A 118 2.129 -10.770 15.154 1.00 0.00 H new ATOM 0 HD2 ARG A 118 2.238 -11.012 12.602 1.00 0.00 H new ATOM 0 HD3 ARG A 118 2.396 -12.740 12.850 1.00 0.00 H new ATOM 0 HE ARG A 118 0.136 -12.883 13.448 1.00 0.00 H new ATOM 0 HH11 ARG A 118 1.075 -9.448 13.387 1.00 0.00 H new ATOM 0 HH12 ARG A 118 -0.601 -8.898 13.484 1.00 0.00 H new ATOM 0 HH21 ARG A 118 -2.019 -12.057 13.549 1.00 0.00 H new ATOM 0 HH22 ARG A 118 -2.275 -10.309 13.572 1.00 0.00 H new ATOM 1869 N LYS A 119 6.176 -8.016 14.512 1.00 0.00 N ATOM 1870 CA LYS A 119 7.221 -7.250 15.181 1.00 0.00 C ATOM 1871 C LYS A 119 6.581 -6.393 16.286 1.00 0.00 C ATOM 1872 O LYS A 119 5.356 -6.372 16.447 1.00 0.00 O ATOM 1873 CB LYS A 119 7.946 -6.365 14.149 1.00 0.00 C ATOM 1874 CG LYS A 119 8.420 -7.069 12.863 1.00 0.00 C ATOM 1875 CD LYS A 119 9.509 -8.130 13.073 1.00 0.00 C ATOM 1876 CE LYS A 119 9.796 -8.921 11.783 1.00 0.00 C ATOM 1877 NZ LYS A 119 10.193 -8.067 10.632 1.00 0.00 N ATOM 0 H LYS A 119 5.927 -7.653 13.592 1.00 0.00 H new ATOM 0 HA LYS A 119 7.952 -7.920 15.634 1.00 0.00 H new ATOM 0 HB2 LYS A 119 7.279 -5.550 13.868 1.00 0.00 H new ATOM 0 HB3 LYS A 119 8.813 -5.915 14.633 1.00 0.00 H new ATOM 0 HG2 LYS A 119 7.561 -7.540 12.386 1.00 0.00 H new ATOM 0 HG3 LYS A 119 8.795 -6.316 12.171 1.00 0.00 H new ATOM 0 HD2 LYS A 119 10.425 -7.648 13.414 1.00 0.00 H new ATOM 0 HD3 LYS A 119 9.199 -8.818 13.859 1.00 0.00 H new ATOM 0 HE2 LYS A 119 10.589 -9.642 11.979 1.00 0.00 H new ATOM 0 HE3 LYS A 119 8.907 -9.490 11.512 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 10.580 -8.664 9.874 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 9.361 -7.553 10.278 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 10.916 -7.386 10.939 1.00 0.00 H new ATOM 1891 N SER A 120 7.413 -5.689 17.050 1.00 0.00 N ATOM 1892 CA SER A 120 6.971 -4.839 18.150 1.00 0.00 C ATOM 1893 C SER A 120 6.117 -3.655 17.665 1.00 0.00 C ATOM 1894 O SER A 120 6.188 -3.254 16.498 1.00 0.00 O ATOM 1895 CB SER A 120 8.222 -4.345 18.889 1.00 0.00 C ATOM 1896 OG SER A 120 9.067 -5.436 19.232 1.00 0.00 O ATOM 0 H SER A 120 8.425 -5.694 16.920 1.00 0.00 H new ATOM 0 HA SER A 120 6.332 -5.417 18.817 1.00 0.00 H new ATOM 0 HB2 SER A 120 8.767 -3.640 18.261 1.00 0.00 H new ATOM 0 HB3 SER A 120 7.929 -3.808 19.791 1.00 0.00 H new ATOM 0 HG SER A 120 9.860 -5.101 19.701 1.00 0.00 H new ATOM 1902 N ARG A 121 5.356 -3.032 18.579 1.00 0.00 N ATOM 1903 CA ARG A 121 4.587 -1.818 18.274 1.00 0.00 C ATOM 1904 C ARG A 121 5.494 -0.706 17.750 1.00 0.00 C ATOM 1905 O ARG A 121 5.085 0.019 16.849 1.00 0.00 O ATOM 1906 CB ARG A 121 3.777 -1.366 19.511 1.00 0.00 C ATOM 1907 CG ARG A 121 3.075 -0.008 19.308 1.00 0.00 C ATOM 1908 CD ARG A 121 2.169 0.376 20.489 1.00 0.00 C ATOM 1909 NE ARG A 121 2.040 1.840 20.623 1.00 0.00 N ATOM 1910 CZ ARG A 121 2.891 2.642 21.278 1.00 0.00 C ATOM 1911 NH1 ARG A 121 3.967 2.149 21.891 1.00 0.00 N ATOM 1912 NH2 ARG A 121 2.667 3.949 21.317 1.00 0.00 N ATOM 0 H ARG A 121 5.258 -3.353 19.542 1.00 0.00 H new ATOM 0 HA ARG A 121 3.878 -2.050 17.479 1.00 0.00 H new ATOM 0 HB2 ARG A 121 3.029 -2.124 19.746 1.00 0.00 H new ATOM 0 HB3 ARG A 121 4.444 -1.299 20.371 1.00 0.00 H new ATOM 0 HG2 ARG A 121 3.828 0.767 19.166 1.00 0.00 H new ATOM 0 HG3 ARG A 121 2.479 -0.045 18.396 1.00 0.00 H new ATOM 0 HD2 ARG A 121 1.182 -0.065 20.349 1.00 0.00 H new ATOM 0 HD3 ARG A 121 2.576 -0.040 21.411 1.00 0.00 H new ATOM 0 HE ARG A 121 1.234 2.279 20.179 1.00 0.00 H new ATOM 0 HH11 ARG A 121 4.154 1.147 21.866 1.00 0.00 H new ATOM 0 HH12 ARG A 121 4.604 2.774 22.385 1.00 0.00 H new ATOM 0 HH21 ARG A 121 1.849 4.340 20.850 1.00 0.00 H new ATOM 0 HH22 ARG A 121 3.312 4.562 21.815 1.00 0.00 H new ATOM 1926 N GLU A 122 6.720 -0.573 18.261 1.00 0.00 N ATOM 1927 CA GLU A 122 7.654 0.439 17.766 1.00 0.00 C ATOM 1928 C GLU A 122 8.003 0.207 16.288 1.00 0.00 C ATOM 1929 O GLU A 122 8.196 1.170 15.547 1.00 0.00 O ATOM 1930 CB GLU A 122 8.902 0.528 18.662 1.00 0.00 C ATOM 1931 CG GLU A 122 9.733 -0.762 18.737 1.00 0.00 C ATOM 1932 CD GLU A 122 10.968 -0.582 19.638 1.00 0.00 C ATOM 1933 OE1 GLU A 122 12.040 -0.173 19.137 1.00 0.00 O ATOM 1934 OE2 GLU A 122 10.888 -0.863 20.856 1.00 0.00 O ATOM 0 H GLU A 122 7.088 -1.152 19.016 1.00 0.00 H new ATOM 0 HA GLU A 122 7.160 1.409 17.817 1.00 0.00 H new ATOM 0 HB2 GLU A 122 9.539 1.333 18.296 1.00 0.00 H new ATOM 0 HB3 GLU A 122 8.590 0.802 19.670 1.00 0.00 H new ATOM 0 HG2 GLU A 122 9.115 -1.573 19.122 1.00 0.00 H new ATOM 0 HG3 GLU A 122 10.050 -1.051 17.735 1.00 0.00 H new ATOM 1941 N THR A 123 8.023 -1.046 15.826 1.00 0.00 N ATOM 1942 CA THR A 123 8.252 -1.359 14.424 1.00 0.00 C ATOM 1943 C THR A 123 7.017 -0.975 13.600 1.00 0.00 C ATOM 1944 O THR A 123 7.163 -0.372 12.537 1.00 0.00 O ATOM 1945 CB THR A 123 8.589 -2.853 14.276 1.00 0.00 C ATOM 1946 OG1 THR A 123 9.387 -3.317 15.355 1.00 0.00 O ATOM 1947 CG2 THR A 123 9.317 -3.138 12.958 1.00 0.00 C ATOM 0 H THR A 123 7.881 -1.866 16.416 1.00 0.00 H new ATOM 0 HA THR A 123 9.098 -0.784 14.048 1.00 0.00 H new ATOM 0 HB THR A 123 7.638 -3.386 14.281 1.00 0.00 H new ATOM 0 HG1 THR A 123 9.962 -4.048 15.046 1.00 0.00 H new ATOM 0 HG21 THR A 123 9.539 -4.203 12.888 1.00 0.00 H new ATOM 0 HG22 THR A 123 8.683 -2.844 12.121 1.00 0.00 H new ATOM 0 HG23 THR A 123 10.247 -2.571 12.926 1.00 0.00 H new ATOM 1955 N PHE A 124 5.802 -1.243 14.100 1.00 0.00 N ATOM 1956 CA PHE A 124 4.582 -0.750 13.461 1.00 0.00 C ATOM 1957 C PHE A 124 4.591 0.779 13.390 1.00 0.00 C ATOM 1958 O PHE A 124 4.201 1.320 12.362 1.00 0.00 O ATOM 1959 CB PHE A 124 3.315 -1.243 14.176 1.00 0.00 C ATOM 1960 CG PHE A 124 2.836 -2.619 13.760 1.00 0.00 C ATOM 1961 CD1 PHE A 124 1.970 -2.749 12.655 1.00 0.00 C ATOM 1962 CD2 PHE A 124 3.233 -3.764 14.475 1.00 0.00 C ATOM 1963 CE1 PHE A 124 1.502 -4.016 12.272 1.00 0.00 C ATOM 1964 CE2 PHE A 124 2.757 -5.030 14.092 1.00 0.00 C ATOM 1965 CZ PHE A 124 1.892 -5.157 12.992 1.00 0.00 C ATOM 0 H PHE A 124 5.642 -1.797 14.942 1.00 0.00 H new ATOM 0 HA PHE A 124 4.564 -1.153 12.449 1.00 0.00 H new ATOM 0 HB2 PHE A 124 3.502 -1.250 15.250 1.00 0.00 H new ATOM 0 HB3 PHE A 124 2.513 -0.527 13.997 1.00 0.00 H new ATOM 0 HD1 PHE A 124 1.666 -1.872 12.102 1.00 0.00 H new ATOM 0 HD2 PHE A 124 3.903 -3.670 15.317 1.00 0.00 H new ATOM 0 HE1 PHE A 124 0.842 -4.113 11.423 1.00 0.00 H new ATOM 0 HE2 PHE A 124 3.057 -5.908 14.645 1.00 0.00 H new ATOM 0 HZ PHE A 124 1.527 -6.131 12.701 1.00 0.00 H new ATOM 1975 N ALA A 125 5.050 1.483 14.430 1.00 0.00 N ATOM 1976 CA ALA A 125 5.128 2.940 14.431 1.00 0.00 C ATOM 1977 C ALA A 125 6.134 3.444 13.391 1.00 0.00 C ATOM 1978 O ALA A 125 5.836 4.398 12.669 1.00 0.00 O ATOM 1979 CB ALA A 125 5.483 3.445 15.835 1.00 0.00 C ATOM 0 H ALA A 125 5.378 1.053 15.295 1.00 0.00 H new ATOM 0 HA ALA A 125 4.152 3.338 14.155 1.00 0.00 H new ATOM 0 HB1 ALA A 125 5.539 4.534 15.827 1.00 0.00 H new ATOM 0 HB2 ALA A 125 4.716 3.127 16.541 1.00 0.00 H new ATOM 0 HB3 ALA A 125 6.447 3.034 16.137 1.00 0.00 H new ATOM 1985 N ALA A 126 7.300 2.801 13.275 1.00 0.00 N ATOM 1986 CA ALA A 126 8.295 3.154 12.269 1.00 0.00 C ATOM 1987 C ALA A 126 7.718 2.967 10.862 1.00 0.00 C ATOM 1988 O ALA A 126 7.784 3.885 10.043 1.00 0.00 O ATOM 1989 CB ALA A 126 9.560 2.311 12.467 1.00 0.00 C ATOM 0 H ALA A 126 7.576 2.024 13.876 1.00 0.00 H new ATOM 0 HA ALA A 126 8.564 4.204 12.383 1.00 0.00 H new ATOM 0 HB1 ALA A 126 10.299 2.580 11.712 1.00 0.00 H new ATOM 0 HB2 ALA A 126 9.971 2.498 13.459 1.00 0.00 H new ATOM 0 HB3 ALA A 126 9.312 1.254 12.371 1.00 0.00 H new ATOM 1995 N VAL A 127 7.113 1.807 10.595 1.00 0.00 N ATOM 1996 CA VAL A 127 6.506 1.521 9.300 1.00 0.00 C ATOM 1997 C VAL A 127 5.353 2.493 9.037 1.00 0.00 C ATOM 1998 O VAL A 127 5.279 3.032 7.937 1.00 0.00 O ATOM 1999 CB VAL A 127 6.097 0.034 9.229 1.00 0.00 C ATOM 2000 CG1 VAL A 127 5.262 -0.286 7.980 1.00 0.00 C ATOM 2001 CG2 VAL A 127 7.361 -0.842 9.200 1.00 0.00 C ATOM 0 H VAL A 127 7.032 1.046 11.269 1.00 0.00 H new ATOM 0 HA VAL A 127 7.227 1.679 8.498 1.00 0.00 H new ATOM 0 HB VAL A 127 5.489 -0.174 10.109 1.00 0.00 H new ATOM 0 HG11 VAL A 127 5.001 -1.344 7.978 1.00 0.00 H new ATOM 0 HG12 VAL A 127 4.351 0.313 7.988 1.00 0.00 H new ATOM 0 HG13 VAL A 127 5.841 -0.054 7.086 1.00 0.00 H new ATOM 0 HG21 VAL A 127 7.075 -1.892 9.150 1.00 0.00 H new ATOM 0 HG22 VAL A 127 7.960 -0.587 8.326 1.00 0.00 H new ATOM 0 HG23 VAL A 127 7.945 -0.668 10.104 1.00 0.00 H new ATOM 2011 N TYR A 128 4.503 2.786 10.026 1.00 0.00 N ATOM 2012 CA TYR A 128 3.431 3.763 9.879 1.00 0.00 C ATOM 2013 C TYR A 128 4.006 5.123 9.479 1.00 0.00 C ATOM 2014 O TYR A 128 3.483 5.752 8.565 1.00 0.00 O ATOM 2015 CB TYR A 128 2.606 3.864 11.177 1.00 0.00 C ATOM 2016 CG TYR A 128 1.566 4.970 11.134 1.00 0.00 C ATOM 2017 CD1 TYR A 128 1.950 6.294 11.428 1.00 0.00 C ATOM 2018 CD2 TYR A 128 0.248 4.700 10.711 1.00 0.00 C ATOM 2019 CE1 TYR A 128 1.061 7.354 11.204 1.00 0.00 C ATOM 2020 CE2 TYR A 128 -0.665 5.756 10.532 1.00 0.00 C ATOM 2021 CZ TYR A 128 -0.245 7.090 10.740 1.00 0.00 C ATOM 2022 OH TYR A 128 -1.077 8.123 10.449 1.00 0.00 O ATOM 0 H TYR A 128 4.542 2.351 10.948 1.00 0.00 H new ATOM 0 HA TYR A 128 2.761 3.432 9.086 1.00 0.00 H new ATOM 0 HB2 TYR A 128 2.108 2.912 11.360 1.00 0.00 H new ATOM 0 HB3 TYR A 128 3.279 4.038 12.016 1.00 0.00 H new ATOM 0 HD1 TYR A 128 2.934 6.492 11.828 1.00 0.00 H new ATOM 0 HD2 TYR A 128 -0.061 3.682 10.524 1.00 0.00 H new ATOM 0 HE1 TYR A 128 1.375 8.371 11.386 1.00 0.00 H new ATOM 0 HE2 TYR A 128 -1.683 5.548 10.237 1.00 0.00 H new ATOM 0 HH TYR A 128 -0.560 8.862 10.065 1.00 0.00 H new ATOM 2032 N THR A 129 5.086 5.572 10.121 1.00 0.00 N ATOM 2033 CA THR A 129 5.685 6.871 9.827 1.00 0.00 C ATOM 2034 C THR A 129 6.238 6.886 8.393 1.00 0.00 C ATOM 2035 O THR A 129 5.993 7.831 7.643 1.00 0.00 O ATOM 2036 CB THR A 129 6.764 7.182 10.884 1.00 0.00 C ATOM 2037 OG1 THR A 129 6.224 7.070 12.190 1.00 0.00 O ATOM 2038 CG2 THR A 129 7.322 8.601 10.738 1.00 0.00 C ATOM 0 H THR A 129 5.566 5.049 10.854 1.00 0.00 H new ATOM 0 HA THR A 129 4.932 7.657 9.881 1.00 0.00 H new ATOM 0 HB THR A 129 7.565 6.460 10.727 1.00 0.00 H new ATOM 0 HG1 THR A 129 6.128 6.123 12.424 1.00 0.00 H new ATOM 0 HG21 THR A 129 8.078 8.775 11.503 1.00 0.00 H new ATOM 0 HG22 THR A 129 7.771 8.716 9.751 1.00 0.00 H new ATOM 0 HG23 THR A 129 6.514 9.323 10.855 1.00 0.00 H new ATOM 2046 N LEU A 130 6.940 5.825 7.983 1.00 0.00 N ATOM 2047 CA LEU A 130 7.494 5.697 6.637 1.00 0.00 C ATOM 2048 C LEU A 130 6.376 5.639 5.586 1.00 0.00 C ATOM 2049 O LEU A 130 6.491 6.250 4.520 1.00 0.00 O ATOM 2050 CB LEU A 130 8.407 4.457 6.626 1.00 0.00 C ATOM 2051 CG LEU A 130 9.087 4.108 5.288 1.00 0.00 C ATOM 2052 CD1 LEU A 130 9.774 5.301 4.612 1.00 0.00 C ATOM 2053 CD2 LEU A 130 10.151 3.035 5.552 1.00 0.00 C ATOM 0 H LEU A 130 7.140 5.025 8.584 1.00 0.00 H new ATOM 0 HA LEU A 130 8.089 6.571 6.371 1.00 0.00 H new ATOM 0 HB2 LEU A 130 9.185 4.601 7.375 1.00 0.00 H new ATOM 0 HB3 LEU A 130 7.816 3.597 6.942 1.00 0.00 H new ATOM 0 HG LEU A 130 8.301 3.766 4.615 1.00 0.00 H new ATOM 0 HD11 LEU A 130 10.229 4.976 3.676 1.00 0.00 H new ATOM 0 HD12 LEU A 130 9.037 6.077 4.407 1.00 0.00 H new ATOM 0 HD13 LEU A 130 10.545 5.699 5.272 1.00 0.00 H new ATOM 0 HD21 LEU A 130 10.645 2.774 4.616 1.00 0.00 H new ATOM 0 HD22 LEU A 130 10.889 3.420 6.256 1.00 0.00 H new ATOM 0 HD23 LEU A 130 9.677 2.148 5.972 1.00 0.00 H new ATOM 2065 N LEU A 131 5.268 4.962 5.893 1.00 0.00 N ATOM 2066 CA LEU A 131 4.093 4.929 5.034 1.00 0.00 C ATOM 2067 C LEU A 131 3.420 6.290 4.979 1.00 0.00 C ATOM 2068 O LEU A 131 2.996 6.687 3.902 1.00 0.00 O ATOM 2069 CB LEU A 131 3.079 3.873 5.512 1.00 0.00 C ATOM 2070 CG LEU A 131 3.510 2.423 5.240 1.00 0.00 C ATOM 2071 CD1 LEU A 131 2.523 1.450 5.894 1.00 0.00 C ATOM 2072 CD2 LEU A 131 3.565 2.132 3.741 1.00 0.00 C ATOM 0 H LEU A 131 5.165 4.420 6.751 1.00 0.00 H new ATOM 0 HA LEU A 131 4.433 4.660 4.034 1.00 0.00 H new ATOM 0 HB2 LEU A 131 2.917 3.998 6.583 1.00 0.00 H new ATOM 0 HB3 LEU A 131 2.123 4.055 5.022 1.00 0.00 H new ATOM 0 HG LEU A 131 4.506 2.291 5.663 1.00 0.00 H new ATOM 0 HD11 LEU A 131 2.837 0.425 5.696 1.00 0.00 H new ATOM 0 HD12 LEU A 131 2.502 1.621 6.970 1.00 0.00 H new ATOM 0 HD13 LEU A 131 1.527 1.610 5.482 1.00 0.00 H new ATOM 0 HD21 LEU A 131 3.873 1.099 3.582 1.00 0.00 H new ATOM 0 HD22 LEU A 131 2.579 2.288 3.304 1.00 0.00 H new ATOM 0 HD23 LEU A 131 4.282 2.801 3.266 1.00 0.00 H new ATOM 2084 N GLU A 132 3.322 7.013 6.095 1.00 0.00 N ATOM 2085 CA GLU A 132 2.699 8.330 6.125 1.00 0.00 C ATOM 2086 C GLU A 132 3.509 9.306 5.270 1.00 0.00 C ATOM 2087 O GLU A 132 2.915 10.041 4.485 1.00 0.00 O ATOM 2088 CB GLU A 132 2.515 8.799 7.579 1.00 0.00 C ATOM 2089 CG GLU A 132 1.762 10.136 7.667 1.00 0.00 C ATOM 2090 CD GLU A 132 1.356 10.471 9.112 1.00 0.00 C ATOM 2091 OE1 GLU A 132 2.183 11.041 9.861 1.00 0.00 O ATOM 2092 OE2 GLU A 132 0.195 10.188 9.492 1.00 0.00 O ATOM 0 H GLU A 132 3.673 6.700 7.000 1.00 0.00 H new ATOM 0 HA GLU A 132 1.701 8.283 5.690 1.00 0.00 H new ATOM 0 HB2 GLU A 132 1.969 8.039 8.138 1.00 0.00 H new ATOM 0 HB3 GLU A 132 3.492 8.902 8.052 1.00 0.00 H new ATOM 0 HG2 GLU A 132 2.391 10.934 7.272 1.00 0.00 H new ATOM 0 HG3 GLU A 132 0.871 10.093 7.040 1.00 0.00 H new ATOM 2099 N ARG A 133 4.848 9.262 5.333 1.00 0.00 N ATOM 2100 CA ARG A 133 5.695 10.049 4.432 1.00 0.00 C ATOM 2101 C ARG A 133 5.410 9.681 2.986 1.00 0.00 C ATOM 2102 O ARG A 133 5.140 10.559 2.174 1.00 0.00 O ATOM 2103 CB ARG A 133 7.188 9.825 4.726 1.00 0.00 C ATOM 2104 CG ARG A 133 7.617 10.508 6.026 1.00 0.00 C ATOM 2105 CD ARG A 133 9.096 10.267 6.361 1.00 0.00 C ATOM 2106 NE ARG A 133 10.013 10.781 5.322 1.00 0.00 N ATOM 2107 CZ ARG A 133 10.815 10.057 4.526 1.00 0.00 C ATOM 2108 NH1 ARG A 133 10.822 8.728 4.585 1.00 0.00 N ATOM 2109 NH2 ARG A 133 11.612 10.671 3.660 1.00 0.00 N ATOM 0 H ARG A 133 5.365 8.689 6.000 1.00 0.00 H new ATOM 0 HA ARG A 133 5.462 11.101 4.598 1.00 0.00 H new ATOM 0 HB2 ARG A 133 7.389 8.756 4.793 1.00 0.00 H new ATOM 0 HB3 ARG A 133 7.784 10.210 3.899 1.00 0.00 H new ATOM 0 HG2 ARG A 133 7.437 11.580 5.945 1.00 0.00 H new ATOM 0 HG3 ARG A 133 6.999 10.142 6.845 1.00 0.00 H new ATOM 0 HD2 ARG A 133 9.330 10.744 7.313 1.00 0.00 H new ATOM 0 HD3 ARG A 133 9.264 9.198 6.490 1.00 0.00 H new ATOM 0 HE ARG A 133 10.039 11.793 5.197 1.00 0.00 H new ATOM 0 HH11 ARG A 133 10.211 8.243 5.243 1.00 0.00 H new ATOM 0 HH12 ARG A 133 11.438 8.194 3.972 1.00 0.00 H new ATOM 0 HH21 ARG A 133 11.613 11.689 3.601 1.00 0.00 H new ATOM 0 HH22 ARG A 133 12.223 10.124 3.053 1.00 0.00 H new ATOM 2123 N SER A 134 5.455 8.393 2.666 1.00 0.00 N ATOM 2124 CA SER A 134 5.286 7.915 1.299 1.00 0.00 C ATOM 2125 C SER A 134 3.911 8.330 0.758 1.00 0.00 C ATOM 2126 O SER A 134 3.817 8.867 -0.345 1.00 0.00 O ATOM 2127 CB SER A 134 5.487 6.397 1.261 1.00 0.00 C ATOM 2128 OG SER A 134 6.757 6.037 1.779 1.00 0.00 O ATOM 0 H SER A 134 5.610 7.650 3.348 1.00 0.00 H new ATOM 0 HA SER A 134 6.036 8.369 0.651 1.00 0.00 H new ATOM 0 HB2 SER A 134 4.703 5.909 1.840 1.00 0.00 H new ATOM 0 HB3 SER A 134 5.395 6.040 0.235 1.00 0.00 H new ATOM 0 HG SER A 134 6.748 6.122 2.755 1.00 0.00 H new ATOM 2134 N ALA A 135 2.857 8.155 1.558 1.00 0.00 N ATOM 2135 CA ALA A 135 1.506 8.564 1.203 1.00 0.00 C ATOM 2136 C ALA A 135 1.416 10.080 1.023 1.00 0.00 C ATOM 2137 O ALA A 135 0.749 10.536 0.098 1.00 0.00 O ATOM 2138 CB ALA A 135 0.526 8.102 2.285 1.00 0.00 C ATOM 0 H ALA A 135 2.923 7.721 2.478 1.00 0.00 H new ATOM 0 HA ALA A 135 1.244 8.098 0.253 1.00 0.00 H new ATOM 0 HB1 ALA A 135 -0.484 8.410 2.016 1.00 0.00 H new ATOM 0 HB2 ALA A 135 0.564 7.016 2.370 1.00 0.00 H new ATOM 0 HB3 ALA A 135 0.800 8.551 3.240 1.00 0.00 H new ATOM 2144 N ARG A 136 2.090 10.866 1.867 1.00 0.00 N ATOM 2145 CA ARG A 136 2.106 12.322 1.739 1.00 0.00 C ATOM 2146 C ARG A 136 2.804 12.738 0.451 1.00 0.00 C ATOM 2147 O ARG A 136 2.332 13.653 -0.216 1.00 0.00 O ATOM 2148 CB ARG A 136 2.788 12.938 2.971 1.00 0.00 C ATOM 2149 CG ARG A 136 2.508 14.439 3.118 1.00 0.00 C ATOM 2150 CD ARG A 136 3.102 14.938 4.442 1.00 0.00 C ATOM 2151 NE ARG A 136 2.712 16.329 4.730 1.00 0.00 N ATOM 2152 CZ ARG A 136 1.674 16.720 5.484 1.00 0.00 C ATOM 2153 NH1 ARG A 136 0.814 15.835 5.987 1.00 0.00 N ATOM 2154 NH2 ARG A 136 1.501 18.014 5.735 1.00 0.00 N ATOM 0 H ARG A 136 2.636 10.512 2.653 1.00 0.00 H new ATOM 0 HA ARG A 136 1.082 12.692 1.689 1.00 0.00 H new ATOM 0 HB2 ARG A 136 2.446 12.420 3.867 1.00 0.00 H new ATOM 0 HB3 ARG A 136 3.864 12.779 2.902 1.00 0.00 H new ATOM 0 HG2 ARG A 136 2.944 14.986 2.282 1.00 0.00 H new ATOM 0 HG3 ARG A 136 1.434 14.624 3.095 1.00 0.00 H new ATOM 0 HD2 ARG A 136 2.770 14.292 5.255 1.00 0.00 H new ATOM 0 HD3 ARG A 136 4.189 14.867 4.402 1.00 0.00 H new ATOM 0 HE ARG A 136 3.286 17.064 4.317 1.00 0.00 H new ATOM 0 HH11 ARG A 136 0.939 14.840 5.801 1.00 0.00 H new ATOM 0 HH12 ARG A 136 0.031 16.153 6.558 1.00 0.00 H new ATOM 0 HH21 ARG A 136 2.154 18.699 5.355 1.00 0.00 H new ATOM 0 HH22 ARG A 136 0.715 18.322 6.307 1.00 0.00 H new ATOM 2168 N GLN A 137 3.900 12.077 0.075 1.00 0.00 N ATOM 2169 CA GLN A 137 4.609 12.359 -1.164 1.00 0.00 C ATOM 2170 C GLN A 137 3.724 11.998 -2.364 1.00 0.00 C ATOM 2171 O GLN A 137 3.608 12.796 -3.295 1.00 0.00 O ATOM 2172 CB GLN A 137 5.938 11.591 -1.205 1.00 0.00 C ATOM 2173 CG GLN A 137 6.943 11.983 -0.106 1.00 0.00 C ATOM 2174 CD GLN A 137 7.800 13.213 -0.411 1.00 0.00 C ATOM 2175 OE1 GLN A 137 7.504 14.029 -1.280 1.00 0.00 O ATOM 2176 NE2 GLN A 137 8.894 13.372 0.320 1.00 0.00 N ATOM 0 H GLN A 137 4.319 11.329 0.627 1.00 0.00 H new ATOM 0 HA GLN A 137 4.837 13.424 -1.213 1.00 0.00 H new ATOM 0 HB2 GLN A 137 5.728 10.525 -1.123 1.00 0.00 H new ATOM 0 HB3 GLN A 137 6.404 11.750 -2.178 1.00 0.00 H new ATOM 0 HG2 GLN A 137 6.394 12.164 0.818 1.00 0.00 H new ATOM 0 HG3 GLN A 137 7.604 11.136 0.077 1.00 0.00 H new ATOM 0 HE21 GLN A 137 9.131 12.688 1.039 1.00 0.00 H new ATOM 0 HE22 GLN A 137 9.499 14.178 0.163 1.00 0.00 H new ATOM 2185 N TRP A 138 3.045 10.842 -2.323 1.00 0.00 N ATOM 2186 CA TRP A 138 2.063 10.484 -3.346 1.00 0.00 C ATOM 2187 C TRP A 138 0.970 11.549 -3.438 1.00 0.00 C ATOM 2188 O TRP A 138 0.680 12.022 -4.535 1.00 0.00 O ATOM 2189 CB TRP A 138 1.467 9.089 -3.087 1.00 0.00 C ATOM 2190 CG TRP A 138 2.265 7.970 -3.682 1.00 0.00 C ATOM 2191 CD1 TRP A 138 3.082 7.120 -3.023 1.00 0.00 C ATOM 2192 CD2 TRP A 138 2.378 7.610 -5.091 1.00 0.00 C ATOM 2193 NE1 TRP A 138 3.736 6.306 -3.924 1.00 0.00 N ATOM 2194 CE2 TRP A 138 3.349 6.572 -5.223 1.00 0.00 C ATOM 2195 CE3 TRP A 138 1.802 8.115 -6.274 1.00 0.00 C ATOM 2196 CZ2 TRP A 138 3.748 6.083 -6.476 1.00 0.00 C ATOM 2197 CZ3 TRP A 138 2.180 7.618 -7.534 1.00 0.00 C ATOM 2198 CH2 TRP A 138 3.152 6.608 -7.635 1.00 0.00 C ATOM 0 H TRP A 138 3.161 10.142 -1.590 1.00 0.00 H new ATOM 0 HA TRP A 138 2.576 10.442 -4.307 1.00 0.00 H new ATOM 0 HB2 TRP A 138 1.386 8.933 -2.011 1.00 0.00 H new ATOM 0 HB3 TRP A 138 0.455 9.056 -3.491 1.00 0.00 H new ATOM 0 HD1 TRP A 138 3.205 7.083 -1.951 1.00 0.00 H new ATOM 0 HE1 TRP A 138 4.420 5.596 -3.664 1.00 0.00 H new ATOM 0 HE3 TRP A 138 1.059 8.896 -6.212 1.00 0.00 H new ATOM 0 HZ2 TRP A 138 4.503 5.314 -6.549 1.00 0.00 H new ATOM 0 HZ3 TRP A 138 1.721 8.014 -8.428 1.00 0.00 H new ATOM 0 HH2 TRP A 138 3.442 6.234 -8.606 1.00 0.00 H new ATOM 2209 N ALA A 139 0.402 11.963 -2.304 1.00 0.00 N ATOM 2210 CA ALA A 139 -0.631 12.985 -2.270 1.00 0.00 C ATOM 2211 C ALA A 139 -0.118 14.304 -2.849 1.00 0.00 C ATOM 2212 O ALA A 139 -0.805 14.921 -3.651 1.00 0.00 O ATOM 2213 CB ALA A 139 -1.121 13.175 -0.832 1.00 0.00 C ATOM 0 H ALA A 139 0.650 11.595 -1.385 1.00 0.00 H new ATOM 0 HA ALA A 139 -1.467 12.659 -2.889 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -1.895 13.942 -0.810 1.00 0.00 H new ATOM 0 HB2 ALA A 139 -1.530 12.236 -0.460 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -0.287 13.483 -0.201 1.00 0.00 H new ATOM 2219 N GLN A 140 1.097 14.729 -2.497 1.00 0.00 N ATOM 2220 CA GLN A 140 1.682 15.980 -2.964 1.00 0.00 C ATOM 2221 C GLN A 140 1.771 16.004 -4.495 1.00 0.00 C ATOM 2222 O GLN A 140 1.540 17.056 -5.095 1.00 0.00 O ATOM 2223 CB GLN A 140 3.050 16.166 -2.280 1.00 0.00 C ATOM 2224 CG GLN A 140 3.874 17.384 -2.727 1.00 0.00 C ATOM 2225 CD GLN A 140 3.184 18.719 -2.437 1.00 0.00 C ATOM 2226 OE1 GLN A 140 3.416 19.348 -1.407 1.00 0.00 O ATOM 2227 NE2 GLN A 140 2.323 19.187 -3.328 1.00 0.00 N ATOM 0 H GLN A 140 1.708 14.204 -1.871 1.00 0.00 H new ATOM 0 HA GLN A 140 1.046 16.822 -2.691 1.00 0.00 H new ATOM 0 HB2 GLN A 140 2.888 16.238 -1.205 1.00 0.00 H new ATOM 0 HB3 GLN A 140 3.644 15.269 -2.453 1.00 0.00 H new ATOM 0 HG2 GLN A 140 4.840 17.365 -2.223 1.00 0.00 H new ATOM 0 HG3 GLN A 140 4.070 17.309 -3.797 1.00 0.00 H new ATOM 0 HE21 GLN A 140 2.135 18.660 -4.181 1.00 0.00 H new ATOM 0 HE22 GLN A 140 1.848 20.074 -3.161 1.00 0.00 H new ATOM 2236 N ALA A 141 2.079 14.866 -5.125 1.00 0.00 N ATOM 2237 CA ALA A 141 2.108 14.765 -6.578 1.00 0.00 C ATOM 2238 C ALA A 141 0.684 14.717 -7.146 1.00 0.00 C ATOM 2239 O ALA A 141 0.312 15.545 -7.978 1.00 0.00 O ATOM 2240 CB ALA A 141 2.908 13.522 -6.975 1.00 0.00 C ATOM 0 H ALA A 141 2.313 13.998 -4.642 1.00 0.00 H new ATOM 0 HA ALA A 141 2.593 15.647 -6.997 1.00 0.00 H new ATOM 0 HB1 ALA A 141 2.935 13.438 -8.061 1.00 0.00 H new ATOM 0 HB2 ALA A 141 3.925 13.606 -6.592 1.00 0.00 H new ATOM 0 HB3 ALA A 141 2.434 12.635 -6.554 1.00 0.00 H new ATOM 2246 N LEU A 142 -0.134 13.774 -6.669 1.00 0.00 N ATOM 2247 CA LEU A 142 -1.479 13.517 -7.187 1.00 0.00 C ATOM 2248 C LEU A 142 -2.404 14.729 -7.014 1.00 0.00 C ATOM 2249 O LEU A 142 -3.269 14.955 -7.860 1.00 0.00 O ATOM 2250 CB LEU A 142 -2.080 12.271 -6.508 1.00 0.00 C ATOM 2251 CG LEU A 142 -1.385 10.940 -6.873 1.00 0.00 C ATOM 2252 CD1 LEU A 142 -1.930 9.816 -5.987 1.00 0.00 C ATOM 2253 CD2 LEU A 142 -1.569 10.542 -8.344 1.00 0.00 C ATOM 0 H LEU A 142 0.125 13.158 -5.899 1.00 0.00 H new ATOM 0 HA LEU A 142 -1.392 13.332 -8.258 1.00 0.00 H new ATOM 0 HB2 LEU A 142 -2.034 12.405 -5.427 1.00 0.00 H new ATOM 0 HB3 LEU A 142 -3.134 12.200 -6.776 1.00 0.00 H new ATOM 0 HG LEU A 142 -0.318 11.092 -6.708 1.00 0.00 H new ATOM 0 HD11 LEU A 142 -1.439 8.878 -6.246 1.00 0.00 H new ATOM 0 HD12 LEU A 142 -1.735 10.051 -4.941 1.00 0.00 H new ATOM 0 HD13 LEU A 142 -3.004 9.718 -6.143 1.00 0.00 H new ATOM 0 HD21 LEU A 142 -1.056 9.599 -8.533 1.00 0.00 H new ATOM 0 HD22 LEU A 142 -2.631 10.427 -8.560 1.00 0.00 H new ATOM 0 HD23 LEU A 142 -1.150 11.317 -8.986 1.00 0.00 H new ATOM 2265 N ASN A 143 -2.190 15.549 -5.982 1.00 0.00 N ATOM 2266 CA ASN A 143 -2.895 16.810 -5.743 1.00 0.00 C ATOM 2267 C ASN A 143 -2.723 17.804 -6.898 1.00 0.00 C ATOM 2268 O ASN A 143 -3.596 18.645 -7.111 1.00 0.00 O ATOM 2269 CB ASN A 143 -2.383 17.443 -4.440 1.00 0.00 C ATOM 2270 CG ASN A 143 -3.047 18.784 -4.146 1.00 0.00 C ATOM 2271 OD1 ASN A 143 -4.263 18.869 -3.995 1.00 0.00 O ATOM 2272 ND2 ASN A 143 -2.269 19.850 -4.038 1.00 0.00 N ATOM 0 H ASN A 143 -1.495 15.345 -5.264 1.00 0.00 H new ATOM 0 HA ASN A 143 -3.958 16.582 -5.665 1.00 0.00 H new ATOM 0 HB2 ASN A 143 -2.567 16.760 -3.611 1.00 0.00 H new ATOM 0 HB3 ASN A 143 -1.304 17.582 -4.506 1.00 0.00 H new ATOM 0 HD21 ASN A 143 -2.678 20.760 -3.826 1.00 0.00 H new ATOM 0 HD22 ASN A 143 -1.261 19.761 -4.167 1.00 0.00 H new ATOM 2279 N ALA A 144 -1.630 17.694 -7.664 1.00 0.00 N ATOM 2280 CA ALA A 144 -1.355 18.510 -8.844 1.00 0.00 C ATOM 2281 C ALA A 144 -1.401 17.682 -10.132 1.00 0.00 C ATOM 2282 O ALA A 144 -0.903 18.110 -11.171 1.00 0.00 O ATOM 2283 CB ALA A 144 -0.028 19.254 -8.651 1.00 0.00 C ATOM 0 H ALA A 144 -0.894 17.014 -7.471 1.00 0.00 H new ATOM 0 HA ALA A 144 -2.141 19.256 -8.957 1.00 0.00 H new ATOM 0 HB1 ALA A 144 0.179 19.863 -9.531 1.00 0.00 H new ATOM 0 HB2 ALA A 144 -0.095 19.896 -7.773 1.00 0.00 H new ATOM 0 HB3 ALA A 144 0.777 18.532 -8.512 1.00 0.00 H new ATOM 2289 N GLU A 145 -2.040 16.515 -10.036 1.00 0.00 N ATOM 2290 CA GLU A 145 -2.372 15.549 -11.085 1.00 0.00 C ATOM 2291 C GLU A 145 -1.281 15.334 -12.147 1.00 0.00 C ATOM 2292 O GLU A 145 -1.575 15.114 -13.324 1.00 0.00 O ATOM 2293 CB GLU A 145 -3.795 15.812 -11.626 1.00 0.00 C ATOM 2294 CG GLU A 145 -4.017 17.180 -12.287 1.00 0.00 C ATOM 2295 CD GLU A 145 -5.459 17.327 -12.801 1.00 0.00 C ATOM 2296 OE1 GLU A 145 -6.336 17.808 -12.045 1.00 0.00 O ATOM 2297 OE2 GLU A 145 -5.734 16.987 -13.975 1.00 0.00 O ATOM 0 H GLU A 145 -2.372 16.190 -9.128 1.00 0.00 H new ATOM 0 HA GLU A 145 -2.394 14.563 -10.621 1.00 0.00 H new ATOM 0 HB2 GLU A 145 -4.036 15.036 -12.352 1.00 0.00 H new ATOM 0 HB3 GLU A 145 -4.501 15.709 -10.802 1.00 0.00 H new ATOM 0 HG2 GLU A 145 -3.802 17.972 -11.569 1.00 0.00 H new ATOM 0 HG3 GLU A 145 -3.319 17.303 -13.115 1.00 0.00 H new ATOM 2304 N GLN A 146 -0.016 15.366 -11.726 1.00 0.00 N ATOM 2305 CA GLN A 146 1.151 14.987 -12.501 1.00 0.00 C ATOM 2306 C GLN A 146 2.111 14.275 -11.551 1.00 0.00 C ATOM 2307 O GLN A 146 2.099 14.499 -10.339 1.00 0.00 O ATOM 2308 CB GLN A 146 1.836 16.201 -13.162 1.00 0.00 C ATOM 2309 CG GLN A 146 1.204 16.641 -14.494 1.00 0.00 C ATOM 2310 CD GLN A 146 0.310 17.877 -14.374 1.00 0.00 C ATOM 2311 OE1 GLN A 146 0.784 19.012 -14.374 1.00 0.00 O ATOM 2312 NE2 GLN A 146 -0.996 17.693 -14.317 1.00 0.00 N ATOM 0 H GLN A 146 0.228 15.674 -10.785 1.00 0.00 H new ATOM 0 HA GLN A 146 0.849 14.333 -13.319 1.00 0.00 H new ATOM 0 HB2 GLN A 146 1.810 17.040 -12.467 1.00 0.00 H new ATOM 0 HB3 GLN A 146 2.885 15.962 -13.334 1.00 0.00 H new ATOM 0 HG2 GLN A 146 1.998 16.847 -15.212 1.00 0.00 H new ATOM 0 HG3 GLN A 146 0.616 15.816 -14.897 1.00 0.00 H new ATOM 0 HE21 GLN A 146 -1.378 16.747 -14.318 1.00 0.00 H new ATOM 0 HE22 GLN A 146 -1.623 18.496 -14.272 1.00 0.00 H new ATOM 2321 N VAL A 147 2.933 13.403 -12.126 1.00 0.00 N ATOM 2322 CA VAL A 147 3.792 12.449 -11.442 1.00 0.00 C ATOM 2323 C VAL A 147 5.091 12.320 -12.241 1.00 0.00 C ATOM 2324 O VAL A 147 6.142 12.049 -11.627 1.00 0.00 O ATOM 2325 CB VAL A 147 3.055 11.095 -11.288 1.00 0.00 C ATOM 2326 CG1 VAL A 147 2.011 11.151 -10.159 1.00 0.00 C ATOM 2327 CG2 VAL A 147 2.347 10.633 -12.579 1.00 0.00 C ATOM 2328 OXT VAL A 147 5.074 12.535 -13.474 1.00 0.00 O ATOM 0 H VAL A 147 3.021 13.342 -13.140 1.00 0.00 H new ATOM 0 HA VAL A 147 4.037 12.790 -10.436 1.00 0.00 H new ATOM 0 HB VAL A 147 3.836 10.373 -11.049 1.00 0.00 H new ATOM 0 HG11 VAL A 147 1.512 10.186 -10.077 1.00 0.00 H new ATOM 0 HG12 VAL A 147 2.506 11.385 -9.217 1.00 0.00 H new ATOM 0 HG13 VAL A 147 1.274 11.923 -10.383 1.00 0.00 H new ATOM 0 HG21 VAL A 147 1.851 9.679 -12.401 1.00 0.00 H new ATOM 0 HG22 VAL A 147 1.607 11.377 -12.874 1.00 0.00 H new ATOM 0 HG23 VAL A 147 3.082 10.517 -13.375 1.00 0.00 H new TER 2338 VAL A 147