USER MOD reduce.3.24.130724 H: found=0, std=0, add=1241, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1240 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 107 LYS NZ :NH3+ 174:sc= -1.3 (180deg=-1.41) USER MOD Set 1.2: A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 92 LYS NZ :NH3+ -120:sc= 0.124 (180deg=-0.766) USER MOD Set 2.2: A 180 SER OG : rot 170:sc= 0.257 USER MOD Single : A 4 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 6 ASN : amide:sc= -0.0833 X(o=-0.083,f=-0.05) USER MOD Single : A 10 SER OG : rot 180:sc= 0.0982 USER MOD Single : A 11 ASN : amide:sc= -0.235 K(o=-0.23,f=-1.7!) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 ASN : amide:sc= -0.0525 X(o=-0.053,f=0) USER MOD Single : A 19 THR OG1 : rot 88:sc= 0.00282 USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 MET CE :methyl 167:sc= -0.13 (180deg=-0.238) USER MOD Single : A 45 LYS NZ :NH3+ 139:sc= -0.986 (180deg=-2.51!) USER MOD Single : A 53 THR OG1 : rot 95:sc= 1.26 USER MOD Single : A 57 THR OG1 : rot 73:sc= -0.0859 USER MOD Single : A 61 SER OG : rot 64:sc= -1.67! USER MOD Single : A 68 SER OG : rot 180:sc= -0.297 USER MOD Single : A 69 THR OG1 : rot -58:sc= 0.521 USER MOD Single : A 70 HIS : no HD1:sc= -0.114 K(o=-0.11,f=-0.64) USER MOD Single : A 75 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 77 GLN : amide:sc= -0.0486 K(o=-0.049,f=-2.1!) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 ASN : amide:sc= 0 X(o=0,f=-0.0095) USER MOD Single : A 82 SER OG : rot 180:sc= 0.175 USER MOD Single : A 89 ASN : amide:sc= -0.0594 X(o=-0.059,f=-0.29) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 MET CE :methyl -132:sc= -2.76 (180deg=-9.76!) USER MOD Single : A 95 GLN : amide:sc= -0.0167 X(o=-0.017,f=0) USER MOD Single : A 96 GLN : amide:sc= -0.0533 X(o=-0.053,f=0) USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 MET CE :methyl 179:sc= -2.13 (180deg=-2.19) USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 60:sc= -2.28! USER MOD Single : A 103 GLN : amide:sc= -4.61! C(o=-4.6!,f=-4.9!) USER MOD Single : A 104 GLN : amide:sc= -0.402 X(o=-0.4,f=-0.67) USER MOD Single : A 106 TYR OH : rot -128:sc= 0.351 USER MOD Single : A 109 GLN : amide:sc= -2.32 X(o=-2.3,f=-1.9) USER MOD Single : A 110 MET CE :methyl -150:sc= -2.98! (180deg=-5.64!) USER MOD Single : A 112 THR OG1 : rot 180:sc= 0.0535 USER MOD Single : A 115 HIS : no HD1:sc= -0.0451 X(o=-0.045,f=0) USER MOD Single : A 122 LYS NZ :NH3+ 134:sc= -0.516 (180deg=-2.57!) USER MOD Single : A 123 ASN : amide:sc= -0.64 K(o=-0.64,f=-1.4) USER MOD Single : A 130 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 MET CE :methyl -158:sc= 0 (180deg=-1) USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 138 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 139 SER OG : rot 180:sc= 0 USER MOD Single : A 142 HIS :FLIP no HD1:sc= -0.223 F(o=-0.84,f=-0.22) USER MOD Single : A 169 SER OG : rot 180:sc= 0 USER MOD Single : A 171 THR OG1 : rot 180:sc= 0 USER MOD Single : A 178 MET CE :methyl 159:sc= 0 (180deg=-0.31) USER MOD Single : A 182 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 4 9.248 -2.652 -9.150 1.00 71.24 N ATOM 2 CA MET A 4 8.183 -1.678 -8.939 1.00 24.20 C ATOM 3 C MET A 4 7.703 -1.101 -10.267 1.00 32.23 C ATOM 4 O MET A 4 8.266 -0.131 -10.773 1.00 22.32 O ATOM 5 CB MET A 4 8.668 -0.551 -8.025 1.00 43.14 C ATOM 6 CG MET A 4 8.908 -0.992 -6.591 1.00 25.22 C ATOM 7 SD MET A 4 7.474 -0.724 -5.532 1.00 75.43 S ATOM 8 CE MET A 4 6.928 -2.410 -5.269 1.00 11.11 C ATOM 0 HA MET A 4 7.347 -2.189 -8.462 1.00 24.20 H new ATOM 0 HB2 MET A 4 9.593 -0.139 -8.429 1.00 43.14 H new ATOM 0 HB3 MET A 4 7.932 0.253 -8.031 1.00 43.14 H new ATOM 0 HG2 MET A 4 9.170 -2.050 -6.580 1.00 25.22 H new ATOM 0 HG3 MET A 4 9.761 -0.448 -6.186 1.00 25.22 H new ATOM 0 HE1 MET A 4 6.045 -2.411 -4.630 1.00 11.11 H new ATOM 0 HE2 MET A 4 6.683 -2.867 -6.228 1.00 11.11 H new ATOM 0 HE3 MET A 4 7.724 -2.979 -4.789 1.00 11.11 H new ATOM 18 N ALA A 5 6.659 -1.704 -10.826 1.00 32.43 N ATOM 19 CA ALA A 5 6.102 -1.249 -12.094 1.00 20.15 C ATOM 20 C ALA A 5 5.216 -0.024 -11.895 1.00 74.25 C ATOM 21 O ALA A 5 5.025 0.440 -10.772 1.00 54.24 O ATOM 22 CB ALA A 5 5.316 -2.370 -12.758 1.00 1.13 C ATOM 0 H ALA A 5 6.182 -2.509 -10.421 1.00 32.43 H new ATOM 0 HA ALA A 5 6.929 -0.965 -12.745 1.00 20.15 H new ATOM 0 HB1 ALA A 5 4.906 -2.016 -13.704 1.00 1.13 H new ATOM 0 HB2 ALA A 5 5.976 -3.217 -12.943 1.00 1.13 H new ATOM 0 HB3 ALA A 5 4.502 -2.681 -12.103 1.00 1.13 H new ATOM 28 N ASN A 6 4.677 0.495 -12.994 1.00 63.13 N ATOM 29 CA ASN A 6 3.812 1.667 -12.941 1.00 12.52 C ATOM 30 C ASN A 6 4.539 2.852 -12.312 1.00 40.33 C ATOM 31 O ASN A 6 4.105 3.392 -11.293 1.00 64.44 O ATOM 32 CB ASN A 6 2.542 1.354 -12.146 1.00 42.23 C ATOM 33 CG ASN A 6 1.479 2.423 -12.310 1.00 41.13 C ATOM 34 OD1 ASN A 6 0.902 2.581 -13.386 1.00 63.35 O ATOM 35 ND2 ASN A 6 1.215 3.164 -11.240 1.00 62.03 N ATOM 0 H ASN A 6 4.824 0.122 -13.932 1.00 63.13 H new ATOM 0 HA ASN A 6 3.538 1.932 -13.962 1.00 12.52 H new ATOM 0 HB2 ASN A 6 2.141 0.394 -12.471 1.00 42.23 H new ATOM 0 HB3 ASN A 6 2.793 1.254 -11.090 1.00 42.23 H new ATOM 0 HD21 ASN A 6 0.509 3.899 -11.290 1.00 62.03 H new ATOM 0 HD22 ASN A 6 1.718 2.998 -10.368 1.00 62.03 H new ATOM 42 N LEU A 7 5.647 3.253 -12.927 1.00 34.13 N ATOM 43 CA LEU A 7 6.435 4.375 -12.429 1.00 32.25 C ATOM 44 C LEU A 7 6.001 5.680 -13.087 1.00 55.30 C ATOM 45 O LEU A 7 6.834 6.468 -13.537 1.00 34.55 O ATOM 46 CB LEU A 7 7.923 4.132 -12.685 1.00 21.54 C ATOM 47 CG LEU A 7 8.893 5.014 -11.897 1.00 73.51 C ATOM 48 CD1 LEU A 7 9.279 4.344 -10.587 1.00 42.42 C ATOM 49 CD2 LEU A 7 10.131 5.319 -12.728 1.00 14.04 C ATOM 0 H LEU A 7 6.020 2.818 -13.771 1.00 34.13 H new ATOM 0 HA LEU A 7 6.266 4.457 -11.355 1.00 32.25 H new ATOM 0 HB2 LEU A 7 8.145 3.089 -12.457 1.00 21.54 H new ATOM 0 HB3 LEU A 7 8.116 4.274 -13.748 1.00 21.54 H new ATOM 0 HG LEU A 7 8.394 5.955 -11.666 1.00 73.51 H new ATOM 0 HD11 LEU A 7 9.969 4.986 -10.040 1.00 42.42 H new ATOM 0 HD12 LEU A 7 8.385 4.177 -9.986 1.00 42.42 H new ATOM 0 HD13 LEU A 7 9.760 3.388 -10.795 1.00 42.42 H new ATOM 0 HD21 LEU A 7 10.810 5.947 -12.152 1.00 14.04 H new ATOM 0 HD22 LEU A 7 10.633 4.387 -12.989 1.00 14.04 H new ATOM 0 HD23 LEU A 7 9.838 5.841 -13.639 1.00 14.04 H new ATOM 61 N ASP A 8 4.692 5.904 -13.138 1.00 42.24 N ATOM 62 CA ASP A 8 4.147 7.116 -13.739 1.00 12.22 C ATOM 63 C ASP A 8 3.735 8.117 -12.664 1.00 2.31 C ATOM 64 O ASP A 8 2.776 8.869 -12.837 1.00 34.13 O ATOM 65 CB ASP A 8 2.946 6.777 -14.624 1.00 25.11 C ATOM 66 CG ASP A 8 1.735 6.353 -13.818 1.00 35.50 C ATOM 67 OD1 ASP A 8 1.921 5.784 -12.722 1.00 72.11 O ATOM 68 OD2 ASP A 8 0.600 6.588 -14.284 1.00 13.24 O ATOM 0 H ASP A 8 3.989 5.262 -12.771 1.00 42.24 H new ATOM 0 HA ASP A 8 4.925 7.569 -14.354 1.00 12.22 H new ATOM 0 HB2 ASP A 8 2.689 7.645 -15.231 1.00 25.11 H new ATOM 0 HB3 ASP A 8 3.219 5.977 -15.312 1.00 25.11 H new ATOM 73 N ARG A 9 4.467 8.120 -11.554 1.00 55.52 N ATOM 74 CA ARG A 9 4.176 9.027 -10.450 1.00 51.43 C ATOM 75 C ARG A 9 5.173 10.182 -10.419 1.00 15.51 C ATOM 76 O ARG A 9 4.788 11.344 -10.286 1.00 54.13 O ATOM 77 CB ARG A 9 4.211 8.273 -9.120 1.00 0.11 C ATOM 78 CG ARG A 9 5.439 7.394 -8.951 1.00 22.35 C ATOM 79 CD ARG A 9 5.399 6.628 -7.637 1.00 44.22 C ATOM 80 NE ARG A 9 6.326 5.500 -7.633 1.00 63.42 N ATOM 81 CZ ARG A 9 6.738 4.891 -6.527 1.00 20.23 C ATOM 82 NH1 ARG A 9 6.307 5.300 -5.341 1.00 71.45 N ATOM 83 NH2 ARG A 9 7.583 3.870 -6.605 1.00 14.34 N ATOM 0 H ARG A 9 5.265 7.505 -11.396 1.00 55.52 H new ATOM 0 HA ARG A 9 3.177 9.436 -10.602 1.00 51.43 H new ATOM 0 HB2 ARG A 9 4.175 8.993 -8.303 1.00 0.11 H new ATOM 0 HB3 ARG A 9 3.317 7.654 -9.039 1.00 0.11 H new ATOM 0 HG2 ARG A 9 5.502 6.691 -9.782 1.00 22.35 H new ATOM 0 HG3 ARG A 9 6.337 8.011 -8.987 1.00 22.35 H new ATOM 0 HD2 ARG A 9 5.645 7.302 -6.817 1.00 44.22 H new ATOM 0 HD3 ARG A 9 4.386 6.266 -7.459 1.00 44.22 H new ATOM 0 HE ARG A 9 6.676 5.161 -8.529 1.00 63.42 H new ATOM 0 HH11 ARG A 9 5.658 6.084 -5.277 1.00 71.45 H new ATOM 0 HH12 ARG A 9 6.625 4.831 -4.493 1.00 71.45 H new ATOM 0 HH21 ARG A 9 7.917 3.552 -7.515 1.00 14.34 H new ATOM 0 HH22 ARG A 9 7.899 3.403 -5.755 1.00 14.34 H new ATOM 97 N SER A 10 6.455 9.854 -10.541 1.00 52.53 N ATOM 98 CA SER A 10 7.507 10.864 -10.523 1.00 21.25 C ATOM 99 C SER A 10 7.621 11.555 -11.878 1.00 12.23 C ATOM 100 O SER A 10 7.816 12.768 -11.954 1.00 34.53 O ATOM 101 CB SER A 10 8.847 10.227 -10.148 1.00 51.10 C ATOM 102 OG SER A 10 8.804 8.819 -10.303 1.00 15.21 O ATOM 0 H SER A 10 6.790 8.897 -10.653 1.00 52.53 H new ATOM 0 HA SER A 10 7.246 11.612 -9.775 1.00 21.25 H new ATOM 0 HB2 SER A 10 9.638 10.641 -10.774 1.00 51.10 H new ATOM 0 HB3 SER A 10 9.095 10.475 -9.116 1.00 51.10 H new ATOM 0 HG SER A 10 9.672 8.436 -10.059 1.00 15.21 H new ATOM 108 N ASN A 11 7.498 10.774 -12.946 1.00 34.12 N ATOM 109 CA ASN A 11 7.587 11.310 -14.299 1.00 61.23 C ATOM 110 C ASN A 11 6.485 12.334 -14.553 1.00 4.45 C ATOM 111 O ASN A 11 6.640 13.236 -15.376 1.00 53.23 O ATOM 112 CB ASN A 11 7.493 10.179 -15.325 1.00 73.33 C ATOM 113 CG ASN A 11 7.899 10.625 -16.717 1.00 31.24 C ATOM 114 OD1 ASN A 11 8.609 11.617 -16.880 1.00 13.32 O ATOM 115 ND2 ASN A 11 7.449 9.891 -17.728 1.00 12.21 N ATOM 0 H ASN A 11 7.336 9.768 -12.901 1.00 34.12 H new ATOM 0 HA ASN A 11 8.551 11.807 -14.403 1.00 61.23 H new ATOM 0 HB2 ASN A 11 8.131 9.353 -15.011 1.00 73.33 H new ATOM 0 HB3 ASN A 11 6.471 9.800 -15.351 1.00 73.33 H new ATOM 0 HD21 ASN A 11 7.690 10.142 -18.687 1.00 12.21 H new ATOM 0 HD22 ASN A 11 6.863 9.076 -17.546 1.00 12.21 H new ATOM 122 N ASP A 12 5.375 12.189 -13.838 1.00 53.15 N ATOM 123 CA ASP A 12 4.247 13.103 -13.984 1.00 62.40 C ATOM 124 C ASP A 12 4.448 14.353 -13.134 1.00 11.21 C ATOM 125 O ASP A 12 3.966 15.434 -13.476 1.00 22.53 O ATOM 126 CB ASP A 12 2.944 12.406 -13.589 1.00 24.34 C ATOM 127 CG ASP A 12 1.724 13.080 -14.183 1.00 14.11 C ATOM 128 OD1 ASP A 12 1.869 13.766 -15.217 1.00 15.25 O ATOM 129 OD2 ASP A 12 0.623 12.921 -13.615 1.00 1.21 O ATOM 0 H ASP A 12 5.232 11.448 -13.152 1.00 53.15 H new ATOM 0 HA ASP A 12 4.186 13.403 -15.030 1.00 62.40 H new ATOM 0 HB2 ASP A 12 2.977 11.367 -13.917 1.00 24.34 H new ATOM 0 HB3 ASP A 12 2.856 12.395 -12.503 1.00 24.34 H new ATOM 134 N LYS A 13 5.161 14.199 -12.024 1.00 4.53 N ATOM 135 CA LYS A 13 5.427 15.315 -11.123 1.00 52.45 C ATOM 136 C LYS A 13 6.373 16.322 -11.769 1.00 42.33 C ATOM 137 O LYS A 13 6.120 17.527 -11.752 1.00 72.13 O ATOM 138 CB LYS A 13 6.025 14.807 -9.810 1.00 63.31 C ATOM 139 CG LYS A 13 6.622 15.905 -8.948 1.00 1.42 C ATOM 140 CD LYS A 13 6.171 15.786 -7.502 1.00 1.34 C ATOM 141 CE LYS A 13 6.577 17.006 -6.689 1.00 11.30 C ATOM 142 NZ LYS A 13 5.988 16.983 -5.321 1.00 61.44 N ATOM 0 H LYS A 13 5.566 13.311 -11.726 1.00 4.53 H new ATOM 0 HA LYS A 13 4.481 15.814 -10.914 1.00 52.45 H new ATOM 0 HB2 LYS A 13 5.250 14.293 -9.243 1.00 63.31 H new ATOM 0 HB3 LYS A 13 6.798 14.071 -10.033 1.00 63.31 H new ATOM 0 HG2 LYS A 13 7.710 15.856 -8.996 1.00 1.42 H new ATOM 0 HG3 LYS A 13 6.329 16.878 -9.342 1.00 1.42 H new ATOM 0 HD2 LYS A 13 5.088 15.668 -7.466 1.00 1.34 H new ATOM 0 HD3 LYS A 13 6.605 14.890 -7.057 1.00 1.34 H new ATOM 0 HE2 LYS A 13 7.664 17.048 -6.616 1.00 11.30 H new ATOM 0 HE3 LYS A 13 6.257 17.910 -7.207 1.00 11.30 H new ATOM 0 HZ1 LYS A 13 6.288 17.831 -4.799 1.00 61.44 H new ATOM 0 HZ2 LYS A 13 4.950 16.968 -5.390 1.00 61.44 H new ATOM 0 HZ3 LYS A 13 6.313 16.133 -4.817 1.00 61.44 H new ATOM 156 N VAL A 14 7.464 15.821 -12.340 1.00 21.22 N ATOM 157 CA VAL A 14 8.447 16.676 -12.994 1.00 10.42 C ATOM 158 C VAL A 14 7.854 17.353 -14.225 1.00 23.13 C ATOM 159 O VAL A 14 8.201 18.489 -14.549 1.00 14.12 O ATOM 160 CB VAL A 14 9.696 15.878 -13.412 1.00 2.23 C ATOM 161 CG1 VAL A 14 9.330 14.806 -14.426 1.00 62.24 C ATOM 162 CG2 VAL A 14 10.761 16.810 -13.969 1.00 44.13 C ATOM 0 H VAL A 14 7.689 14.826 -12.363 1.00 21.22 H new ATOM 0 HA VAL A 14 8.737 17.436 -12.269 1.00 10.42 H new ATOM 0 HB VAL A 14 10.103 15.385 -12.529 1.00 2.23 H new ATOM 0 HG11 VAL A 14 10.225 14.253 -14.710 1.00 62.24 H new ATOM 0 HG12 VAL A 14 8.604 14.122 -13.986 1.00 62.24 H new ATOM 0 HG13 VAL A 14 8.898 15.274 -15.310 1.00 62.24 H new ATOM 0 HG21 VAL A 14 11.637 16.230 -14.259 1.00 44.13 H new ATOM 0 HG22 VAL A 14 10.367 17.333 -14.840 1.00 44.13 H new ATOM 0 HG23 VAL A 14 11.044 17.536 -13.207 1.00 44.13 H new ATOM 172 N TYR A 15 6.959 16.648 -14.907 1.00 31.42 N ATOM 173 CA TYR A 15 6.319 17.179 -16.104 1.00 55.11 C ATOM 174 C TYR A 15 5.287 18.243 -15.743 1.00 53.43 C ATOM 175 O TYR A 15 4.938 19.089 -16.566 1.00 71.25 O ATOM 176 CB TYR A 15 5.650 16.052 -16.894 1.00 5.14 C ATOM 177 CG TYR A 15 4.856 16.536 -18.086 1.00 3.23 C ATOM 178 CD1 TYR A 15 5.441 17.344 -19.053 1.00 64.44 C ATOM 179 CD2 TYR A 15 3.521 16.187 -18.244 1.00 12.21 C ATOM 180 CE1 TYR A 15 4.720 17.789 -20.144 1.00 33.10 C ATOM 181 CE2 TYR A 15 2.792 16.627 -19.332 1.00 32.41 C ATOM 182 CZ TYR A 15 3.395 17.427 -20.279 1.00 5.30 C ATOM 183 OH TYR A 15 2.672 17.868 -21.363 1.00 43.35 O ATOM 0 H TYR A 15 6.660 15.707 -14.651 1.00 31.42 H new ATOM 0 HA TYR A 15 7.089 17.640 -16.723 1.00 55.11 H new ATOM 0 HB2 TYR A 15 6.416 15.356 -17.237 1.00 5.14 H new ATOM 0 HB3 TYR A 15 4.989 15.497 -16.229 1.00 5.14 H new ATOM 0 HD1 TYR A 15 6.478 17.629 -18.950 1.00 64.44 H new ATOM 0 HD2 TYR A 15 3.045 15.561 -17.504 1.00 12.21 H new ATOM 0 HE1 TYR A 15 5.190 18.416 -20.887 1.00 33.10 H new ATOM 0 HE2 TYR A 15 1.755 16.346 -19.440 1.00 32.41 H new ATOM 0 HH TYR A 15 1.756 17.523 -21.308 1.00 43.35 H new ATOM 193 N GLU A 16 4.803 18.194 -14.506 1.00 2.21 N ATOM 194 CA GLU A 16 3.811 19.154 -14.035 1.00 62.34 C ATOM 195 C GLU A 16 4.486 20.379 -13.425 1.00 31.33 C ATOM 196 O GLU A 16 4.285 21.503 -13.881 1.00 54.21 O ATOM 197 CB GLU A 16 2.886 18.501 -13.006 1.00 1.20 C ATOM 198 CG GLU A 16 1.926 17.488 -13.606 1.00 62.22 C ATOM 199 CD GLU A 16 0.528 18.045 -13.788 1.00 12.22 C ATOM 200 OE1 GLU A 16 0.395 19.279 -13.925 1.00 10.50 O ATOM 201 OE2 GLU A 16 -0.433 17.248 -13.792 1.00 53.05 O ATOM 0 H GLU A 16 5.081 17.500 -13.812 1.00 2.21 H new ATOM 0 HA GLU A 16 3.219 19.477 -14.892 1.00 62.34 H new ATOM 0 HB2 GLU A 16 3.492 18.008 -12.246 1.00 1.20 H new ATOM 0 HB3 GLU A 16 2.312 19.278 -12.501 1.00 1.20 H new ATOM 0 HG2 GLU A 16 2.310 17.157 -14.571 1.00 62.22 H new ATOM 0 HG3 GLU A 16 1.882 16.609 -12.962 1.00 62.22 H new ATOM 208 N ASN A 17 5.287 20.151 -12.389 1.00 62.11 N ATOM 209 CA ASN A 17 5.991 21.235 -11.714 1.00 42.44 C ATOM 210 C ASN A 17 6.761 22.090 -12.716 1.00 42.42 C ATOM 211 O ASN A 17 6.792 23.316 -12.608 1.00 41.41 O ATOM 212 CB ASN A 17 6.951 20.673 -10.664 1.00 34.33 C ATOM 213 CG ASN A 17 6.916 21.460 -9.368 1.00 53.22 C ATOM 214 OD1 ASN A 17 7.912 22.063 -8.968 1.00 53.34 O ATOM 215 ND2 ASN A 17 5.765 21.458 -8.705 1.00 61.32 N ATOM 0 H ASN A 17 5.465 19.225 -11.999 1.00 62.11 H new ATOM 0 HA ASN A 17 5.250 21.863 -11.220 1.00 42.44 H new ATOM 0 HB2 ASN A 17 6.695 19.633 -10.461 1.00 34.33 H new ATOM 0 HB3 ASN A 17 7.965 20.680 -11.063 1.00 34.33 H new ATOM 0 HD21 ASN A 17 5.681 21.970 -7.827 1.00 61.32 H new ATOM 0 HD22 ASN A 17 4.965 20.944 -9.074 1.00 61.32 H new ATOM 222 N VAL A 18 7.382 21.435 -13.692 1.00 74.30 N ATOM 223 CA VAL A 18 8.150 22.134 -14.715 1.00 2.03 C ATOM 224 C VAL A 18 7.315 23.221 -15.383 1.00 23.33 C ATOM 225 O VAL A 18 7.851 24.199 -15.905 1.00 1.14 O ATOM 226 CB VAL A 18 8.665 21.162 -15.793 1.00 31.22 C ATOM 227 CG1 VAL A 18 7.501 20.499 -16.514 1.00 41.31 C ATOM 228 CG2 VAL A 18 9.569 21.889 -16.777 1.00 72.42 C ATOM 0 H VAL A 18 7.368 20.420 -13.796 1.00 74.30 H new ATOM 0 HA VAL A 18 9.002 22.592 -14.213 1.00 2.03 H new ATOM 0 HB VAL A 18 9.250 20.382 -15.306 1.00 31.22 H new ATOM 0 HG11 VAL A 18 7.884 19.816 -17.272 1.00 41.31 H new ATOM 0 HG12 VAL A 18 6.897 19.943 -15.796 1.00 41.31 H new ATOM 0 HG13 VAL A 18 6.886 21.262 -16.991 1.00 41.31 H new ATOM 0 HG21 VAL A 18 9.924 21.187 -17.532 1.00 72.42 H new ATOM 0 HG22 VAL A 18 9.010 22.690 -17.261 1.00 72.42 H new ATOM 0 HG23 VAL A 18 10.421 22.311 -16.245 1.00 72.42 H new ATOM 238 N THR A 19 5.998 23.043 -15.363 1.00 12.20 N ATOM 239 CA THR A 19 5.088 24.008 -15.967 1.00 74.11 C ATOM 240 C THR A 19 4.533 24.970 -14.922 1.00 62.34 C ATOM 241 O THR A 19 4.539 26.184 -15.118 1.00 10.33 O ATOM 242 CB THR A 19 3.914 23.305 -16.676 1.00 0.53 C ATOM 243 OG1 THR A 19 4.391 22.167 -17.401 1.00 73.24 O ATOM 244 CG2 THR A 19 3.207 24.259 -17.627 1.00 11.45 C ATOM 0 H THR A 19 5.538 22.240 -14.935 1.00 12.20 H new ATOM 0 HA THR A 19 5.665 24.569 -16.703 1.00 74.11 H new ATOM 0 HB THR A 19 3.202 22.980 -15.917 1.00 0.53 H new ATOM 0 HG1 THR A 19 4.398 21.383 -16.812 1.00 73.24 H new ATOM 0 HG21 THR A 19 2.382 23.741 -18.116 1.00 11.45 H new ATOM 0 HG22 THR A 19 2.820 25.110 -17.067 1.00 11.45 H new ATOM 0 HG23 THR A 19 3.912 24.611 -18.380 1.00 11.45 H new ATOM 252 N GLY A 20 4.055 24.418 -13.811 1.00 52.02 N ATOM 253 CA GLY A 20 3.504 25.242 -12.752 1.00 12.35 C ATOM 254 C GLY A 20 4.423 26.385 -12.368 1.00 63.22 C ATOM 255 O GLY A 20 4.037 27.553 -12.438 1.00 23.55 O ATOM 0 H GLY A 20 4.040 23.415 -13.626 1.00 52.02 H new ATOM 0 HA2 GLY A 20 2.543 25.645 -13.072 1.00 12.35 H new ATOM 0 HA3 GLY A 20 3.314 24.623 -11.875 1.00 12.35 H new ATOM 259 N LEU A 21 5.643 26.050 -11.961 1.00 75.40 N ATOM 260 CA LEU A 21 6.620 27.057 -11.563 1.00 61.31 C ATOM 261 C LEU A 21 6.756 28.136 -12.632 1.00 50.12 C ATOM 262 O LEU A 21 6.880 29.321 -12.321 1.00 71.22 O ATOM 263 CB LEU A 21 7.979 26.403 -11.306 1.00 42.24 C ATOM 264 CG LEU A 21 8.637 25.728 -12.510 1.00 62.30 C ATOM 265 CD1 LEU A 21 9.576 26.693 -13.217 1.00 13.30 C ATOM 266 CD2 LEU A 21 9.385 24.476 -12.076 1.00 22.40 C ATOM 0 H LEU A 21 5.979 25.089 -11.898 1.00 75.40 H new ATOM 0 HA LEU A 21 6.269 27.525 -10.643 1.00 61.31 H new ATOM 0 HB2 LEU A 21 8.660 27.164 -10.924 1.00 42.24 H new ATOM 0 HB3 LEU A 21 7.859 25.659 -10.518 1.00 42.24 H new ATOM 0 HG LEU A 21 7.855 25.436 -13.211 1.00 62.30 H new ATOM 0 HD11 LEU A 21 10.035 26.194 -14.071 1.00 13.30 H new ATOM 0 HD12 LEU A 21 9.014 27.561 -13.562 1.00 13.30 H new ATOM 0 HD13 LEU A 21 10.354 27.017 -12.525 1.00 13.30 H new ATOM 0 HD21 LEU A 21 9.847 24.008 -12.945 1.00 22.40 H new ATOM 0 HD22 LEU A 21 10.157 24.745 -11.355 1.00 22.40 H new ATOM 0 HD23 LEU A 21 8.687 23.776 -11.616 1.00 22.40 H new ATOM 278 N VAL A 22 6.730 27.719 -13.894 1.00 73.30 N ATOM 279 CA VAL A 22 6.846 28.650 -15.010 1.00 25.21 C ATOM 280 C VAL A 22 5.631 29.567 -15.090 1.00 23.02 C ATOM 281 O VAL A 22 5.765 30.789 -15.164 1.00 30.43 O ATOM 282 CB VAL A 22 7.002 27.905 -16.349 1.00 24.42 C ATOM 283 CG1 VAL A 22 7.049 28.890 -17.506 1.00 55.24 C ATOM 284 CG2 VAL A 22 8.249 27.032 -16.330 1.00 54.35 C ATOM 0 H VAL A 22 6.630 26.742 -14.169 1.00 73.30 H new ATOM 0 HA VAL A 22 7.738 29.249 -14.830 1.00 25.21 H new ATOM 0 HB VAL A 22 6.135 27.259 -16.489 1.00 24.42 H new ATOM 0 HG11 VAL A 22 7.160 28.345 -18.444 1.00 55.24 H new ATOM 0 HG12 VAL A 22 6.125 29.468 -17.529 1.00 55.24 H new ATOM 0 HG13 VAL A 22 7.896 29.564 -17.376 1.00 55.24 H new ATOM 0 HG21 VAL A 22 8.344 26.513 -17.284 1.00 54.35 H new ATOM 0 HG22 VAL A 22 9.128 27.656 -16.167 1.00 54.35 H new ATOM 0 HG23 VAL A 22 8.169 26.301 -15.525 1.00 54.35 H new ATOM 294 N LYS A 23 4.444 28.970 -15.074 1.00 64.11 N ATOM 295 CA LYS A 23 3.203 29.732 -15.143 1.00 21.21 C ATOM 296 C LYS A 23 3.184 30.836 -14.091 1.00 14.21 C ATOM 297 O LYS A 23 2.583 31.891 -14.296 1.00 21.34 O ATOM 298 CB LYS A 23 2.001 28.806 -14.948 1.00 34.43 C ATOM 299 CG LYS A 23 2.027 27.578 -15.841 1.00 64.41 C ATOM 300 CD LYS A 23 0.672 27.321 -16.478 1.00 14.35 C ATOM 301 CE LYS A 23 0.286 25.852 -16.396 1.00 1.24 C ATOM 302 NZ LYS A 23 -0.237 25.343 -17.694 1.00 24.35 N ATOM 0 H LYS A 23 4.315 27.960 -15.014 1.00 64.11 H new ATOM 0 HA LYS A 23 3.143 30.193 -16.129 1.00 21.21 H new ATOM 0 HB2 LYS A 23 1.965 28.487 -13.906 1.00 34.43 H new ATOM 0 HB3 LYS A 23 1.086 29.366 -15.142 1.00 34.43 H new ATOM 0 HG2 LYS A 23 2.777 27.710 -16.621 1.00 64.41 H new ATOM 0 HG3 LYS A 23 2.325 26.708 -15.256 1.00 64.41 H new ATOM 0 HD2 LYS A 23 -0.086 27.926 -15.980 1.00 14.35 H new ATOM 0 HD3 LYS A 23 0.694 27.635 -17.522 1.00 14.35 H new ATOM 0 HE2 LYS A 23 1.155 25.264 -16.099 1.00 1.24 H new ATOM 0 HE3 LYS A 23 -0.470 25.718 -15.622 1.00 1.24 H new ATOM 0 HZ1 LYS A 23 -0.489 24.339 -17.597 1.00 24.35 H new ATOM 0 HZ2 LYS A 23 -1.081 25.887 -17.966 1.00 24.35 H new ATOM 0 HZ3 LYS A 23 0.493 25.447 -18.427 1.00 24.35 H new ATOM 316 N ALA A 24 3.845 30.587 -12.966 1.00 4.13 N ATOM 317 CA ALA A 24 3.907 31.562 -11.884 1.00 34.13 C ATOM 318 C ALA A 24 4.753 32.768 -12.278 1.00 74.33 C ATOM 319 O ALA A 24 4.329 33.913 -12.123 1.00 5.33 O ATOM 320 CB ALA A 24 4.461 30.916 -10.622 1.00 55.13 C ATOM 0 H ALA A 24 4.346 29.718 -12.780 1.00 4.13 H new ATOM 0 HA ALA A 24 2.894 31.912 -11.686 1.00 34.13 H new ATOM 0 HB1 ALA A 24 4.502 31.656 -9.822 1.00 55.13 H new ATOM 0 HB2 ALA A 24 3.814 30.092 -10.321 1.00 55.13 H new ATOM 0 HB3 ALA A 24 5.464 30.537 -10.817 1.00 55.13 H new ATOM 326 N VAL A 25 5.951 32.502 -12.789 1.00 53.52 N ATOM 327 CA VAL A 25 6.856 33.566 -13.207 1.00 4.24 C ATOM 328 C VAL A 25 6.168 34.528 -14.168 1.00 41.14 C ATOM 329 O VAL A 25 6.512 35.709 -14.233 1.00 34.20 O ATOM 330 CB VAL A 25 8.118 32.996 -13.883 1.00 14.44 C ATOM 331 CG1 VAL A 25 9.033 34.122 -14.341 1.00 34.20 C ATOM 332 CG2 VAL A 25 8.849 32.055 -12.938 1.00 10.14 C ATOM 0 H VAL A 25 6.317 31.559 -12.923 1.00 53.52 H new ATOM 0 HA VAL A 25 7.148 34.105 -12.306 1.00 4.24 H new ATOM 0 HB VAL A 25 7.813 32.427 -14.762 1.00 14.44 H new ATOM 0 HG11 VAL A 25 9.919 33.701 -14.816 1.00 34.20 H new ATOM 0 HG12 VAL A 25 8.504 34.753 -15.055 1.00 34.20 H new ATOM 0 HG13 VAL A 25 9.333 34.720 -13.480 1.00 34.20 H new ATOM 0 HG21 VAL A 25 9.738 31.662 -13.432 1.00 10.14 H new ATOM 0 HG22 VAL A 25 9.143 32.598 -12.040 1.00 10.14 H new ATOM 0 HG23 VAL A 25 8.191 31.230 -12.665 1.00 10.14 H new ATOM 342 N ILE A 26 5.195 34.015 -14.914 1.00 12.44 N ATOM 343 CA ILE A 26 4.457 34.830 -15.871 1.00 71.32 C ATOM 344 C ILE A 26 3.416 35.696 -15.170 1.00 4.05 C ATOM 345 O ILE A 26 3.407 36.917 -15.322 1.00 71.00 O ATOM 346 CB ILE A 26 3.754 33.958 -16.928 1.00 72.51 C ATOM 347 CG1 ILE A 26 4.739 32.954 -17.530 1.00 22.41 C ATOM 348 CG2 ILE A 26 3.147 34.830 -18.017 1.00 2.24 C ATOM 349 CD1 ILE A 26 4.118 32.045 -18.568 1.00 1.13 C ATOM 0 H ILE A 26 4.900 33.039 -14.874 1.00 12.44 H new ATOM 0 HA ILE A 26 5.186 35.472 -16.366 1.00 71.32 H new ATOM 0 HB ILE A 26 2.950 33.404 -16.443 1.00 72.51 H new ATOM 0 HG12 ILE A 26 5.567 33.498 -17.984 1.00 22.41 H new ATOM 0 HG13 ILE A 26 5.159 32.345 -16.730 1.00 22.41 H new ATOM 0 HG21 ILE A 26 2.654 34.199 -18.756 1.00 2.24 H new ATOM 0 HG22 ILE A 26 2.418 35.509 -17.575 1.00 2.24 H new ATOM 0 HG23 ILE A 26 3.934 35.408 -18.501 1.00 2.24 H new ATOM 0 HD11 ILE A 26 4.874 31.360 -18.951 1.00 1.13 H new ATOM 0 HD12 ILE A 26 3.308 31.474 -18.114 1.00 1.13 H new ATOM 0 HD13 ILE A 26 3.723 32.645 -19.388 1.00 1.13 H new ATOM 361 N GLU A 27 2.543 35.055 -14.399 1.00 1.21 N ATOM 362 CA GLU A 27 1.499 35.768 -13.673 1.00 11.34 C ATOM 363 C GLU A 27 2.089 36.918 -12.861 1.00 30.34 C ATOM 364 O GLU A 27 1.688 38.071 -13.015 1.00 74.32 O ATOM 365 CB GLU A 27 0.745 34.810 -12.748 1.00 12.51 C ATOM 366 CG GLU A 27 -0.509 34.221 -13.373 1.00 45.40 C ATOM 367 CD GLU A 27 -1.759 34.527 -12.571 1.00 70.44 C ATOM 368 OE1 GLU A 27 -1.765 34.248 -11.354 1.00 73.30 O ATOM 369 OE2 GLU A 27 -2.731 35.044 -13.161 1.00 22.42 O ATOM 0 H GLU A 27 2.538 34.044 -14.261 1.00 1.21 H new ATOM 0 HA GLU A 27 0.802 36.181 -14.402 1.00 11.34 H new ATOM 0 HB2 GLU A 27 1.412 33.998 -12.458 1.00 12.51 H new ATOM 0 HB3 GLU A 27 0.472 35.339 -11.835 1.00 12.51 H new ATOM 0 HG2 GLU A 27 -0.625 34.613 -14.384 1.00 45.40 H new ATOM 0 HG3 GLU A 27 -0.394 33.141 -13.461 1.00 45.40 H new ATOM 376 N MET A 28 3.044 36.594 -11.995 1.00 33.42 N ATOM 377 CA MET A 28 3.690 37.599 -11.159 1.00 33.45 C ATOM 378 C MET A 28 4.314 38.697 -12.013 1.00 51.31 C ATOM 379 O MET A 28 4.222 39.880 -11.684 1.00 61.13 O ATOM 380 CB MET A 28 4.761 36.950 -10.279 1.00 74.25 C ATOM 381 CG MET A 28 5.804 36.173 -11.066 1.00 42.51 C ATOM 382 SD MET A 28 7.341 37.093 -11.277 1.00 71.10 S ATOM 383 CE MET A 28 8.328 36.412 -9.947 1.00 1.14 C ATOM 0 H MET A 28 3.387 35.644 -11.854 1.00 33.42 H new ATOM 0 HA MET A 28 2.929 38.048 -10.521 1.00 33.45 H new ATOM 0 HB2 MET A 28 5.260 37.725 -9.697 1.00 74.25 H new ATOM 0 HB3 MET A 28 4.278 36.278 -9.569 1.00 74.25 H new ATOM 0 HG2 MET A 28 6.014 35.234 -10.555 1.00 42.51 H new ATOM 0 HG3 MET A 28 5.400 35.919 -12.046 1.00 42.51 H new ATOM 0 HE1 MET A 28 9.311 36.882 -9.946 1.00 1.14 H new ATOM 0 HE2 MET A 28 7.834 36.601 -8.994 1.00 1.14 H new ATOM 0 HE3 MET A 28 8.440 35.337 -10.091 1.00 1.14 H new ATOM 393 N SER A 29 4.949 38.298 -13.111 1.00 13.53 N ATOM 394 CA SER A 29 5.592 39.249 -14.010 1.00 54.40 C ATOM 395 C SER A 29 4.578 40.249 -14.558 1.00 40.40 C ATOM 396 O SER A 29 4.942 41.337 -15.005 1.00 71.02 O ATOM 397 CB SER A 29 6.272 38.512 -15.164 1.00 65.45 C ATOM 398 OG SER A 29 6.373 39.340 -16.310 1.00 60.51 O ATOM 0 H SER A 29 5.032 37.323 -13.399 1.00 13.53 H new ATOM 0 HA SER A 29 6.346 39.795 -13.443 1.00 54.40 H new ATOM 0 HB2 SER A 29 7.266 38.188 -14.857 1.00 65.45 H new ATOM 0 HB3 SER A 29 5.706 37.614 -15.410 1.00 65.45 H new ATOM 0 HG SER A 29 6.813 38.846 -17.033 1.00 60.51 H new ATOM 404 N SER A 30 3.304 39.872 -14.520 1.00 10.44 N ATOM 405 CA SER A 30 2.237 40.733 -15.015 1.00 53.55 C ATOM 406 C SER A 30 1.904 41.825 -14.003 1.00 25.04 C ATOM 407 O SER A 30 1.975 43.015 -14.309 1.00 54.40 O ATOM 408 CB SER A 30 0.986 39.907 -15.320 1.00 71.13 C ATOM 409 OG SER A 30 0.253 40.468 -16.396 1.00 2.34 O ATOM 0 H SER A 30 2.986 38.976 -14.151 1.00 10.44 H new ATOM 0 HA SER A 30 2.584 41.207 -15.933 1.00 53.55 H new ATOM 0 HB2 SER A 30 1.273 38.884 -15.565 1.00 71.13 H new ATOM 0 HB3 SER A 30 0.355 39.857 -14.433 1.00 71.13 H new ATOM 0 HG SER A 30 -0.541 39.920 -16.572 1.00 2.34 H new ATOM 415 N LYS A 31 1.542 41.411 -12.793 1.00 60.43 N ATOM 416 CA LYS A 31 1.199 42.351 -11.733 1.00 24.43 C ATOM 417 C LYS A 31 2.402 42.617 -10.832 1.00 74.42 C ATOM 418 O LYS A 31 2.247 42.940 -9.654 1.00 53.43 O ATOM 419 CB LYS A 31 0.035 41.810 -10.900 1.00 71.50 C ATOM 420 CG LYS A 31 0.312 40.453 -10.276 1.00 70.44 C ATOM 421 CD LYS A 31 -0.752 39.436 -10.657 1.00 44.31 C ATOM 422 CE LYS A 31 -0.541 38.113 -9.938 1.00 22.14 C ATOM 423 NZ LYS A 31 -1.352 38.023 -8.692 1.00 53.22 N ATOM 0 H LYS A 31 1.479 40.430 -12.522 1.00 60.43 H new ATOM 0 HA LYS A 31 0.899 43.290 -12.198 1.00 24.43 H new ATOM 0 HB2 LYS A 31 -0.197 42.523 -10.109 1.00 71.50 H new ATOM 0 HB3 LYS A 31 -0.850 41.736 -11.532 1.00 71.50 H new ATOM 0 HG2 LYS A 31 1.290 40.096 -10.599 1.00 70.44 H new ATOM 0 HG3 LYS A 31 0.351 40.551 -9.191 1.00 70.44 H new ATOM 0 HD2 LYS A 31 -1.738 39.831 -10.413 1.00 44.31 H new ATOM 0 HD3 LYS A 31 -0.732 39.273 -11.735 1.00 44.31 H new ATOM 0 HE2 LYS A 31 -0.806 37.292 -10.604 1.00 22.14 H new ATOM 0 HE3 LYS A 31 0.515 37.997 -9.693 1.00 22.14 H new ATOM 0 HZ1 LYS A 31 -1.180 37.107 -8.231 1.00 53.22 H new ATOM 0 HZ2 LYS A 31 -1.082 38.792 -8.046 1.00 53.22 H new ATOM 0 HZ3 LYS A 31 -2.361 38.108 -8.928 1.00 53.22 H new ATOM 437 N ILE A 32 3.598 42.479 -11.394 1.00 52.31 N ATOM 438 CA ILE A 32 4.825 42.708 -10.642 1.00 22.41 C ATOM 439 C ILE A 32 4.929 44.159 -10.186 1.00 13.00 C ATOM 440 O ILE A 32 5.379 44.440 -9.075 1.00 75.24 O ATOM 441 CB ILE A 32 6.071 42.353 -11.476 1.00 14.22 C ATOM 442 CG1 ILE A 32 7.343 42.600 -10.662 1.00 71.44 C ATOM 443 CG2 ILE A 32 6.094 43.163 -12.764 1.00 33.23 C ATOM 444 CD1 ILE A 32 8.182 41.357 -10.462 1.00 0.12 C ATOM 0 H ILE A 32 3.743 42.210 -12.367 1.00 52.31 H new ATOM 0 HA ILE A 32 4.785 42.058 -9.768 1.00 22.41 H new ATOM 0 HB ILE A 32 6.028 41.295 -11.736 1.00 14.22 H new ATOM 0 HG12 ILE A 32 7.945 43.358 -11.164 1.00 71.44 H new ATOM 0 HG13 ILE A 32 7.069 43.004 -9.688 1.00 71.44 H new ATOM 0 HG21 ILE A 32 6.980 42.901 -13.343 1.00 33.23 H new ATOM 0 HG22 ILE A 32 5.201 42.943 -13.348 1.00 33.23 H new ATOM 0 HG23 ILE A 32 6.118 44.226 -12.525 1.00 33.23 H new ATOM 0 HD11 ILE A 32 9.067 41.606 -9.877 1.00 0.12 H new ATOM 0 HD12 ILE A 32 7.597 40.605 -9.933 1.00 0.12 H new ATOM 0 HD13 ILE A 32 8.487 40.964 -11.432 1.00 0.12 H new ATOM 456 N GLN A 33 4.508 45.077 -11.050 1.00 75.54 N ATOM 457 CA GLN A 33 4.552 46.500 -10.735 1.00 70.54 C ATOM 458 C GLN A 33 3.734 46.806 -9.485 1.00 51.13 C ATOM 459 O GLN A 33 4.253 47.282 -8.475 1.00 70.33 O ATOM 460 CB GLN A 33 4.030 47.321 -11.915 1.00 53.13 C ATOM 461 CG GLN A 33 5.078 48.233 -12.533 1.00 73.20 C ATOM 462 CD GLN A 33 4.467 49.398 -13.287 1.00 34.52 C ATOM 463 OE1 GLN A 33 3.950 50.339 -12.685 1.00 3.43 O ATOM 464 NE2 GLN A 33 4.522 49.340 -14.612 1.00 61.33 N ATOM 0 H GLN A 33 4.133 44.861 -11.973 1.00 75.54 H new ATOM 0 HA GLN A 33 5.590 46.773 -10.543 1.00 70.54 H new ATOM 0 HB2 GLN A 33 3.654 46.643 -12.681 1.00 53.13 H new ATOM 0 HB3 GLN A 33 3.186 47.925 -11.582 1.00 53.13 H new ATOM 0 HG2 GLN A 33 5.730 48.615 -11.748 1.00 73.20 H new ATOM 0 HG3 GLN A 33 5.703 47.654 -13.212 1.00 73.20 H new ATOM 0 HE21 GLN A 33 4.960 48.541 -15.070 1.00 61.33 H new ATOM 0 HE22 GLN A 33 4.126 50.095 -15.172 1.00 61.33 H new ATOM 473 N PRO A 34 2.423 46.529 -9.552 1.00 63.44 N ATOM 474 CA PRO A 34 1.506 46.767 -8.434 1.00 75.34 C ATOM 475 C PRO A 34 1.748 45.811 -7.271 1.00 63.14 C ATOM 476 O PRO A 34 1.162 45.961 -6.200 1.00 31.41 O ATOM 477 CB PRO A 34 0.126 46.521 -9.050 1.00 33.43 C ATOM 478 CG PRO A 34 0.379 45.597 -10.190 1.00 71.54 C ATOM 479 CD PRO A 34 1.737 45.960 -10.725 1.00 13.44 C ATOM 0 HA PRO A 34 1.629 47.764 -8.011 1.00 75.34 H new ATOM 0 HB2 PRO A 34 -0.558 46.078 -8.326 1.00 33.43 H new ATOM 0 HB3 PRO A 34 -0.328 47.452 -9.389 1.00 33.43 H new ATOM 0 HG2 PRO A 34 0.354 44.558 -9.863 1.00 71.54 H new ATOM 0 HG3 PRO A 34 -0.386 45.708 -10.959 1.00 71.54 H new ATOM 0 HD2 PRO A 34 2.262 45.088 -11.114 1.00 13.44 H new ATOM 0 HD3 PRO A 34 1.669 46.681 -11.540 1.00 13.44 H new ATOM 487 N ALA A 35 2.617 44.829 -7.490 1.00 33.11 N ATOM 488 CA ALA A 35 2.939 43.850 -6.459 1.00 13.33 C ATOM 489 C ALA A 35 3.222 44.532 -5.124 1.00 74.12 C ATOM 490 O ALA A 35 4.264 45.156 -4.927 1.00 43.23 O ATOM 491 CB ALA A 35 4.131 43.006 -6.886 1.00 14.43 C ATOM 0 H ALA A 35 3.110 44.691 -8.372 1.00 33.11 H new ATOM 0 HA ALA A 35 2.075 43.198 -6.329 1.00 13.33 H new ATOM 0 HB1 ALA A 35 4.360 42.279 -6.107 1.00 14.43 H new ATOM 0 HB2 ALA A 35 3.893 42.482 -7.812 1.00 14.43 H new ATOM 0 HB3 ALA A 35 4.995 43.651 -7.046 1.00 14.43 H new ATOM 497 N PRO A 36 2.272 44.412 -4.185 1.00 20.35 N ATOM 498 CA PRO A 36 2.397 45.010 -2.852 1.00 52.11 C ATOM 499 C PRO A 36 3.461 44.321 -2.004 1.00 53.05 C ATOM 500 O PRO A 36 3.967 43.252 -2.348 1.00 55.52 O ATOM 501 CB PRO A 36 1.009 44.804 -2.240 1.00 1.44 C ATOM 502 CG PRO A 36 0.452 43.621 -2.953 1.00 11.02 C ATOM 503 CD PRO A 36 1.004 43.682 -4.350 1.00 52.02 C ATOM 0 HA PRO A 36 2.706 46.054 -2.901 1.00 52.11 H new ATOM 0 HB2 PRO A 36 1.072 44.626 -1.167 1.00 1.44 H new ATOM 0 HB3 PRO A 36 0.380 45.683 -2.380 1.00 1.44 H new ATOM 0 HG2 PRO A 36 0.743 42.694 -2.458 1.00 11.02 H new ATOM 0 HG3 PRO A 36 -0.638 43.648 -2.962 1.00 11.02 H new ATOM 0 HD2 PRO A 36 1.165 42.686 -4.762 1.00 52.02 H new ATOM 0 HD3 PRO A 36 0.326 44.202 -5.027 1.00 52.02 H new ATOM 511 N PRO A 37 3.810 44.945 -0.869 1.00 74.34 N ATOM 512 CA PRO A 37 4.816 44.408 0.051 1.00 3.23 C ATOM 513 C PRO A 37 4.332 43.155 0.773 1.00 5.21 C ATOM 514 O PRO A 37 5.134 42.375 1.285 1.00 64.33 O ATOM 515 CB PRO A 37 5.030 45.550 1.048 1.00 41.43 C ATOM 516 CG PRO A 37 3.759 46.326 1.013 1.00 13.22 C ATOM 517 CD PRO A 37 3.248 46.221 -0.397 1.00 52.31 C ATOM 0 HA PRO A 37 5.723 44.103 -0.470 1.00 3.23 H new ATOM 0 HB2 PRO A 37 5.234 45.169 2.049 1.00 41.43 H new ATOM 0 HB3 PRO A 37 5.880 46.170 0.764 1.00 41.43 H new ATOM 0 HG2 PRO A 37 3.036 45.922 1.721 1.00 13.22 H new ATOM 0 HG3 PRO A 37 3.929 47.366 1.290 1.00 13.22 H new ATOM 0 HD2 PRO A 37 2.159 46.217 -0.430 1.00 52.31 H new ATOM 0 HD3 PRO A 37 3.583 47.058 -1.009 1.00 52.31 H new ATOM 525 N GLU A 38 3.017 42.970 0.810 1.00 74.43 N ATOM 526 CA GLU A 38 2.427 41.811 1.470 1.00 64.52 C ATOM 527 C GLU A 38 2.365 40.617 0.520 1.00 15.45 C ATOM 528 O GLU A 38 2.261 39.471 0.955 1.00 24.21 O ATOM 529 CB GLU A 38 1.024 42.145 1.980 1.00 61.11 C ATOM 530 CG GLU A 38 0.794 41.754 3.430 1.00 63.51 C ATOM 531 CD GLU A 38 1.318 42.791 4.404 1.00 24.42 C ATOM 532 OE1 GLU A 38 0.558 43.720 4.746 1.00 15.14 O ATOM 533 OE2 GLU A 38 2.488 42.673 4.824 1.00 4.30 O ATOM 0 H GLU A 38 2.340 43.607 0.391 1.00 74.43 H new ATOM 0 HA GLU A 38 3.059 41.547 2.317 1.00 64.52 H new ATOM 0 HB2 GLU A 38 0.852 43.216 1.870 1.00 61.11 H new ATOM 0 HB3 GLU A 38 0.289 41.638 1.355 1.00 61.11 H new ATOM 0 HG2 GLU A 38 -0.273 41.609 3.598 1.00 63.51 H new ATOM 0 HG3 GLU A 38 1.280 40.798 3.626 1.00 63.51 H new ATOM 540 N GLU A 39 2.427 40.897 -0.778 1.00 12.44 N ATOM 541 CA GLU A 39 2.375 39.847 -1.788 1.00 44.52 C ATOM 542 C GLU A 39 3.776 39.336 -2.113 1.00 40.33 C ATOM 543 O GLU A 39 3.938 38.358 -2.843 1.00 34.32 O ATOM 544 CB GLU A 39 1.702 40.366 -3.060 1.00 72.04 C ATOM 545 CG GLU A 39 1.532 39.305 -4.135 1.00 43.20 C ATOM 546 CD GLU A 39 0.188 39.389 -4.831 1.00 13.22 C ATOM 547 OE1 GLU A 39 -0.068 40.406 -5.509 1.00 44.10 O ATOM 548 OE2 GLU A 39 -0.609 38.437 -4.697 1.00 14.01 O ATOM 0 H GLU A 39 2.513 41.841 -1.154 1.00 12.44 H new ATOM 0 HA GLU A 39 1.789 39.020 -1.387 1.00 44.52 H new ATOM 0 HB2 GLU A 39 0.723 40.772 -2.804 1.00 72.04 H new ATOM 0 HB3 GLU A 39 2.292 41.189 -3.463 1.00 72.04 H new ATOM 0 HG2 GLU A 39 2.327 39.411 -4.874 1.00 43.20 H new ATOM 0 HG3 GLU A 39 1.643 38.318 -3.687 1.00 43.20 H new ATOM 555 N TYR A 40 4.785 40.006 -1.567 1.00 60.24 N ATOM 556 CA TYR A 40 6.172 39.622 -1.801 1.00 42.21 C ATOM 557 C TYR A 40 6.558 38.423 -0.941 1.00 2.05 C ATOM 558 O TYR A 40 7.452 37.653 -1.292 1.00 43.44 O ATOM 559 CB TYR A 40 7.105 40.798 -1.505 1.00 62.35 C ATOM 560 CG TYR A 40 7.538 41.553 -2.742 1.00 11.13 C ATOM 561 CD1 TYR A 40 8.293 40.934 -3.730 1.00 24.24 C ATOM 562 CD2 TYR A 40 7.190 42.886 -2.922 1.00 41.31 C ATOM 563 CE1 TYR A 40 8.691 41.621 -4.860 1.00 65.51 C ATOM 564 CE2 TYR A 40 7.583 43.580 -4.050 1.00 55.52 C ATOM 565 CZ TYR A 40 8.333 42.943 -5.016 1.00 45.40 C ATOM 566 OH TYR A 40 8.727 43.631 -6.142 1.00 32.55 O ATOM 0 H TYR A 40 4.668 40.817 -0.960 1.00 60.24 H new ATOM 0 HA TYR A 40 6.273 39.341 -2.849 1.00 42.21 H new ATOM 0 HB2 TYR A 40 6.603 41.487 -0.826 1.00 62.35 H new ATOM 0 HB3 TYR A 40 7.990 40.428 -0.987 1.00 62.35 H new ATOM 0 HD1 TYR A 40 8.574 39.898 -3.613 1.00 24.24 H new ATOM 0 HD2 TYR A 40 6.602 43.388 -2.168 1.00 41.31 H new ATOM 0 HE1 TYR A 40 9.280 41.125 -5.618 1.00 65.51 H new ATOM 0 HE2 TYR A 40 7.304 44.616 -4.175 1.00 55.52 H new ATOM 0 HH TYR A 40 8.392 44.551 -6.097 1.00 32.55 H new ATOM 576 N VAL A 41 5.876 38.271 0.190 1.00 23.53 N ATOM 577 CA VAL A 41 6.145 37.165 1.102 1.00 70.21 C ATOM 578 C VAL A 41 5.912 35.821 0.420 1.00 13.31 C ATOM 579 O VAL A 41 6.802 34.975 0.340 1.00 22.20 O ATOM 580 CB VAL A 41 5.263 37.249 2.362 1.00 74.24 C ATOM 581 CG1 VAL A 41 4.964 35.857 2.898 1.00 13.31 C ATOM 582 CG2 VAL A 41 5.932 38.106 3.425 1.00 45.55 C ATOM 0 H VAL A 41 5.133 38.899 0.497 1.00 23.53 H new ATOM 0 HA VAL A 41 7.192 37.244 1.395 1.00 70.21 H new ATOM 0 HB VAL A 41 4.318 37.719 2.092 1.00 74.24 H new ATOM 0 HG11 VAL A 41 4.340 35.936 3.788 1.00 13.31 H new ATOM 0 HG12 VAL A 41 4.439 35.279 2.137 1.00 13.31 H new ATOM 0 HG13 VAL A 41 5.898 35.357 3.153 1.00 13.31 H new ATOM 0 HG21 VAL A 41 5.295 38.154 4.308 1.00 45.55 H new ATOM 0 HG22 VAL A 41 6.893 37.667 3.695 1.00 45.55 H new ATOM 0 HG23 VAL A 41 6.089 39.112 3.036 1.00 45.55 H new ATOM 592 N PRO A 42 4.686 35.619 -0.085 1.00 34.15 N ATOM 593 CA PRO A 42 4.306 34.380 -0.770 1.00 63.10 C ATOM 594 C PRO A 42 4.994 34.232 -2.123 1.00 22.12 C ATOM 595 O PRO A 42 5.343 33.126 -2.535 1.00 34.24 O ATOM 596 CB PRO A 42 2.793 34.524 -0.952 1.00 44.34 C ATOM 597 CG PRO A 42 2.551 35.994 -0.954 1.00 54.13 C ATOM 598 CD PRO A 42 3.575 36.584 -0.025 1.00 42.33 C ATOM 0 HA PRO A 42 4.598 33.495 -0.204 1.00 63.10 H new ATOM 0 HB2 PRO A 42 2.461 34.067 -1.884 1.00 44.34 H new ATOM 0 HB3 PRO A 42 2.249 34.034 -0.145 1.00 44.34 H new ATOM 0 HG2 PRO A 42 2.653 36.405 -1.958 1.00 54.13 H new ATOM 0 HG3 PRO A 42 1.540 36.223 -0.617 1.00 54.13 H new ATOM 0 HD2 PRO A 42 3.887 37.577 -0.349 1.00 42.33 H new ATOM 0 HD3 PRO A 42 3.186 36.687 0.988 1.00 42.33 H new ATOM 606 N MET A 43 5.187 35.353 -2.809 1.00 41.42 N ATOM 607 CA MET A 43 5.835 35.347 -4.115 1.00 45.55 C ATOM 608 C MET A 43 7.166 34.603 -4.059 1.00 13.02 C ATOM 609 O MET A 43 7.385 33.647 -4.802 1.00 64.33 O ATOM 610 CB MET A 43 6.060 36.780 -4.604 1.00 32.12 C ATOM 611 CG MET A 43 5.061 37.225 -5.660 1.00 44.20 C ATOM 612 SD MET A 43 5.817 38.238 -6.946 1.00 54.05 S ATOM 613 CE MET A 43 4.728 39.660 -6.941 1.00 14.13 C ATOM 0 H MET A 43 4.904 36.277 -2.483 1.00 41.42 H new ATOM 0 HA MET A 43 5.179 34.830 -4.815 1.00 45.55 H new ATOM 0 HB2 MET A 43 6.004 37.459 -3.753 1.00 32.12 H new ATOM 0 HB3 MET A 43 7.068 36.862 -5.011 1.00 32.12 H new ATOM 0 HG2 MET A 43 4.604 36.347 -6.116 1.00 44.20 H new ATOM 0 HG3 MET A 43 4.260 37.789 -5.182 1.00 44.20 H new ATOM 0 HE1 MET A 43 5.185 40.470 -7.509 1.00 14.13 H new ATOM 0 HE2 MET A 43 3.775 39.390 -7.396 1.00 14.13 H new ATOM 0 HE3 MET A 43 4.560 39.986 -5.915 1.00 14.13 H new ATOM 623 N VAL A 44 8.051 35.048 -3.172 1.00 54.03 N ATOM 624 CA VAL A 44 9.359 34.423 -3.018 1.00 51.34 C ATOM 625 C VAL A 44 9.226 32.929 -2.749 1.00 31.33 C ATOM 626 O VAL A 44 9.953 32.116 -3.321 1.00 35.11 O ATOM 627 CB VAL A 44 10.159 35.071 -1.873 1.00 0.22 C ATOM 628 CG1 VAL A 44 11.508 34.388 -1.710 1.00 62.14 C ATOM 629 CG2 VAL A 44 10.334 36.562 -2.122 1.00 73.31 C ATOM 0 H VAL A 44 7.886 35.839 -2.549 1.00 54.03 H new ATOM 0 HA VAL A 44 9.894 34.574 -3.956 1.00 51.34 H new ATOM 0 HB VAL A 44 9.600 34.944 -0.946 1.00 0.22 H new ATOM 0 HG11 VAL A 44 12.059 34.860 -0.896 1.00 62.14 H new ATOM 0 HG12 VAL A 44 11.356 33.333 -1.482 1.00 62.14 H new ATOM 0 HG13 VAL A 44 12.077 34.481 -2.635 1.00 62.14 H new ATOM 0 HG21 VAL A 44 10.902 37.004 -1.303 1.00 73.31 H new ATOM 0 HG22 VAL A 44 10.871 36.714 -3.059 1.00 73.31 H new ATOM 0 HG23 VAL A 44 9.355 37.038 -2.183 1.00 73.31 H new ATOM 639 N LYS A 45 8.292 32.572 -1.873 1.00 61.14 N ATOM 640 CA LYS A 45 8.061 31.174 -1.528 1.00 12.43 C ATOM 641 C LYS A 45 7.700 30.360 -2.766 1.00 15.21 C ATOM 642 O LYS A 45 8.029 29.178 -2.860 1.00 42.50 O ATOM 643 CB LYS A 45 6.944 31.063 -0.487 1.00 40.13 C ATOM 644 CG LYS A 45 7.219 31.845 0.786 1.00 75.23 C ATOM 645 CD LYS A 45 8.177 31.101 1.701 1.00 14.21 C ATOM 646 CE LYS A 45 8.227 31.731 3.085 1.00 65.14 C ATOM 647 NZ LYS A 45 9.626 31.882 3.574 1.00 52.50 N ATOM 0 H LYS A 45 7.683 33.232 -1.389 1.00 61.14 H new ATOM 0 HA LYS A 45 8.983 30.772 -1.108 1.00 12.43 H new ATOM 0 HB2 LYS A 45 6.012 31.418 -0.927 1.00 40.13 H new ATOM 0 HB3 LYS A 45 6.798 30.013 -0.234 1.00 40.13 H new ATOM 0 HG2 LYS A 45 7.639 32.819 0.533 1.00 75.23 H new ATOM 0 HG3 LYS A 45 6.282 32.029 1.311 1.00 75.23 H new ATOM 0 HD2 LYS A 45 7.867 30.059 1.785 1.00 14.21 H new ATOM 0 HD3 LYS A 45 9.175 31.102 1.263 1.00 14.21 H new ATOM 0 HE2 LYS A 45 7.744 32.708 3.057 1.00 65.14 H new ATOM 0 HE3 LYS A 45 7.662 31.116 3.785 1.00 65.14 H new ATOM 0 HZ1 LYS A 45 9.731 32.801 4.049 1.00 52.50 H new ATOM 0 HZ2 LYS A 45 9.843 31.119 4.246 1.00 52.50 H new ATOM 0 HZ3 LYS A 45 10.282 31.831 2.769 1.00 52.50 H new ATOM 661 N GLU A 46 7.022 31.001 -3.713 1.00 53.01 N ATOM 662 CA GLU A 46 6.617 30.335 -4.945 1.00 61.25 C ATOM 663 C GLU A 46 7.836 29.879 -5.743 1.00 33.43 C ATOM 664 O GLU A 46 7.995 28.692 -6.030 1.00 50.22 O ATOM 665 CB GLU A 46 5.757 31.270 -5.798 1.00 70.22 C ATOM 666 CG GLU A 46 4.570 31.855 -5.051 1.00 42.15 C ATOM 667 CD GLU A 46 3.241 31.424 -5.639 1.00 74.24 C ATOM 668 OE1 GLU A 46 2.925 30.217 -5.569 1.00 42.44 O ATOM 669 OE2 GLU A 46 2.516 32.292 -6.169 1.00 61.34 O ATOM 0 H GLU A 46 6.742 31.980 -3.651 1.00 53.01 H new ATOM 0 HA GLU A 46 6.030 29.457 -4.677 1.00 61.25 H new ATOM 0 HB2 GLU A 46 6.379 32.084 -6.169 1.00 70.22 H new ATOM 0 HB3 GLU A 46 5.394 30.723 -6.668 1.00 70.22 H new ATOM 0 HG2 GLU A 46 4.617 31.549 -4.006 1.00 42.15 H new ATOM 0 HG3 GLU A 46 4.635 32.943 -5.068 1.00 42.15 H new ATOM 676 N VAL A 47 8.694 30.830 -6.098 1.00 15.05 N ATOM 677 CA VAL A 47 9.898 30.527 -6.861 1.00 42.30 C ATOM 678 C VAL A 47 10.873 29.689 -6.041 1.00 15.32 C ATOM 679 O VAL A 47 11.421 28.702 -6.528 1.00 20.20 O ATOM 680 CB VAL A 47 10.608 31.814 -7.323 1.00 72.24 C ATOM 681 CG1 VAL A 47 11.700 31.489 -8.331 1.00 22.33 C ATOM 682 CG2 VAL A 47 9.604 32.794 -7.911 1.00 74.32 C ATOM 0 H VAL A 47 8.577 31.817 -5.869 1.00 15.05 H new ATOM 0 HA VAL A 47 9.583 29.959 -7.737 1.00 42.30 H new ATOM 0 HB VAL A 47 11.074 32.282 -6.456 1.00 72.24 H new ATOM 0 HG11 VAL A 47 12.190 32.410 -8.646 1.00 22.33 H new ATOM 0 HG12 VAL A 47 12.433 30.826 -7.872 1.00 22.33 H new ATOM 0 HG13 VAL A 47 11.260 30.997 -9.199 1.00 22.33 H new ATOM 0 HG21 VAL A 47 10.123 33.697 -8.232 1.00 74.32 H new ATOM 0 HG22 VAL A 47 9.108 32.337 -8.767 1.00 74.32 H new ATOM 0 HG23 VAL A 47 8.861 33.051 -7.156 1.00 74.32 H new ATOM 692 N GLY A 48 11.083 30.091 -4.791 1.00 21.43 N ATOM 693 CA GLY A 48 11.991 29.365 -3.922 1.00 4.32 C ATOM 694 C GLY A 48 11.644 27.893 -3.819 1.00 42.43 C ATOM 695 O GLY A 48 12.529 27.046 -3.691 1.00 44.40 O ATOM 0 H GLY A 48 10.641 30.906 -4.365 1.00 21.43 H new ATOM 0 HA2 GLY A 48 13.009 29.470 -4.297 1.00 4.32 H new ATOM 0 HA3 GLY A 48 11.971 29.810 -2.927 1.00 4.32 H new ATOM 699 N LEU A 49 10.353 27.587 -3.874 1.00 71.40 N ATOM 700 CA LEU A 49 9.890 26.206 -3.785 1.00 10.12 C ATOM 701 C LEU A 49 10.203 25.443 -5.068 1.00 31.22 C ATOM 702 O LEU A 49 10.572 24.269 -5.029 1.00 53.43 O ATOM 703 CB LEU A 49 8.386 26.169 -3.510 1.00 33.44 C ATOM 704 CG LEU A 49 7.762 24.779 -3.377 1.00 60.21 C ATOM 705 CD1 LEU A 49 8.077 24.180 -2.015 1.00 50.10 C ATOM 706 CD2 LEU A 49 6.258 24.846 -3.597 1.00 52.12 C ATOM 0 H LEU A 49 9.608 28.276 -3.980 1.00 71.40 H new ATOM 0 HA LEU A 49 10.416 25.725 -2.961 1.00 10.12 H new ATOM 0 HB2 LEU A 49 8.191 26.722 -2.591 1.00 33.44 H new ATOM 0 HB3 LEU A 49 7.877 26.699 -4.315 1.00 33.44 H new ATOM 0 HG LEU A 49 8.193 24.134 -4.143 1.00 60.21 H new ATOM 0 HD11 LEU A 49 7.625 23.191 -1.939 1.00 50.10 H new ATOM 0 HD12 LEU A 49 9.157 24.095 -1.896 1.00 50.10 H new ATOM 0 HD13 LEU A 49 7.675 24.824 -1.233 1.00 50.10 H new ATOM 0 HD21 LEU A 49 5.831 23.848 -3.499 1.00 52.12 H new ATOM 0 HD22 LEU A 49 5.811 25.507 -2.854 1.00 52.12 H new ATOM 0 HD23 LEU A 49 6.053 25.231 -4.596 1.00 52.12 H new ATOM 718 N ALA A 50 10.055 26.118 -6.203 1.00 21.01 N ATOM 719 CA ALA A 50 10.326 25.505 -7.497 1.00 60.12 C ATOM 720 C ALA A 50 11.815 25.224 -7.671 1.00 12.21 C ATOM 721 O ALA A 50 12.203 24.185 -8.207 1.00 11.22 O ATOM 722 CB ALA A 50 9.821 26.398 -8.620 1.00 51.25 C ATOM 0 H ALA A 50 9.749 27.090 -6.252 1.00 21.01 H new ATOM 0 HA ALA A 50 9.796 24.553 -7.538 1.00 60.12 H new ATOM 0 HB1 ALA A 50 10.030 25.928 -9.581 1.00 51.25 H new ATOM 0 HB2 ALA A 50 8.746 26.544 -8.514 1.00 51.25 H new ATOM 0 HB3 ALA A 50 10.324 27.364 -8.571 1.00 51.25 H new ATOM 728 N LEU A 51 12.645 26.156 -7.216 1.00 13.25 N ATOM 729 CA LEU A 51 14.092 26.009 -7.321 1.00 43.31 C ATOM 730 C LEU A 51 14.582 24.830 -6.487 1.00 3.23 C ATOM 731 O LEU A 51 15.192 23.898 -7.010 1.00 62.40 O ATOM 732 CB LEU A 51 14.789 27.294 -6.869 1.00 23.42 C ATOM 733 CG LEU A 51 14.986 28.365 -7.942 1.00 73.44 C ATOM 734 CD1 LEU A 51 15.724 27.790 -9.141 1.00 25.20 C ATOM 735 CD2 LEU A 51 13.645 28.945 -8.368 1.00 50.11 C ATOM 0 H LEU A 51 12.340 27.022 -6.771 1.00 13.25 H new ATOM 0 HA LEU A 51 14.338 25.818 -8.365 1.00 43.31 H new ATOM 0 HB2 LEU A 51 14.212 27.728 -6.053 1.00 23.42 H new ATOM 0 HB3 LEU A 51 15.766 27.030 -6.464 1.00 23.42 H new ATOM 0 HG LEU A 51 15.590 29.168 -7.520 1.00 73.44 H new ATOM 0 HD11 LEU A 51 15.855 28.567 -9.894 1.00 25.20 H new ATOM 0 HD12 LEU A 51 16.700 27.422 -8.825 1.00 25.20 H new ATOM 0 HD13 LEU A 51 15.146 26.968 -9.564 1.00 25.20 H new ATOM 0 HD21 LEU A 51 13.804 29.706 -9.132 1.00 50.11 H new ATOM 0 HD22 LEU A 51 13.017 28.151 -8.772 1.00 50.11 H new ATOM 0 HD23 LEU A 51 13.152 29.394 -7.506 1.00 50.11 H new ATOM 747 N ARG A 52 14.310 24.878 -5.187 1.00 35.01 N ATOM 748 CA ARG A 52 14.722 23.813 -4.280 1.00 53.41 C ATOM 749 C ARG A 52 14.162 22.468 -4.731 1.00 73.44 C ATOM 750 O ARG A 52 14.889 21.477 -4.818 1.00 54.32 O ATOM 751 CB ARG A 52 14.257 24.119 -2.855 1.00 54.42 C ATOM 752 CG ARG A 52 14.999 23.330 -1.789 1.00 42.24 C ATOM 753 CD ARG A 52 14.318 23.445 -0.435 1.00 12.41 C ATOM 754 NE ARG A 52 13.008 22.799 -0.424 1.00 64.21 N ATOM 755 CZ ARG A 52 12.293 22.606 0.678 1.00 21.35 C ATOM 756 NH1 ARG A 52 12.758 23.008 1.853 1.00 0.01 N ATOM 757 NH2 ARG A 52 11.110 22.010 0.607 1.00 32.42 N ATOM 0 H ARG A 52 13.806 25.643 -4.738 1.00 35.01 H new ATOM 0 HA ARG A 52 15.810 23.758 -4.296 1.00 53.41 H new ATOM 0 HB2 ARG A 52 14.385 25.184 -2.661 1.00 54.42 H new ATOM 0 HB3 ARG A 52 13.191 23.906 -2.776 1.00 54.42 H new ATOM 0 HG2 ARG A 52 15.053 22.282 -2.082 1.00 42.24 H new ATOM 0 HG3 ARG A 52 16.024 23.693 -1.714 1.00 42.24 H new ATOM 0 HD2 ARG A 52 14.951 22.993 0.329 1.00 12.41 H new ATOM 0 HD3 ARG A 52 14.205 24.497 -0.174 1.00 12.41 H new ATOM 0 HE ARG A 52 12.621 22.479 -1.312 1.00 64.21 H new ATOM 0 HH11 ARG A 52 13.667 23.467 1.912 1.00 0.01 H new ATOM 0 HH12 ARG A 52 12.207 22.858 2.698 1.00 0.01 H new ATOM 0 HH21 ARG A 52 10.749 21.699 -0.295 1.00 32.42 H new ATOM 0 HH22 ARG A 52 10.562 21.862 1.454 1.00 32.42 H new ATOM 771 N THR A 53 12.864 22.438 -5.018 1.00 13.44 N ATOM 772 CA THR A 53 12.205 21.215 -5.458 1.00 45.01 C ATOM 773 C THR A 53 12.795 20.716 -6.773 1.00 13.35 C ATOM 774 O THR A 53 12.966 19.513 -6.971 1.00 22.31 O ATOM 775 CB THR A 53 10.690 21.425 -5.635 1.00 32.00 C ATOM 776 OG1 THR A 53 10.098 21.800 -4.386 1.00 41.42 O ATOM 777 CG2 THR A 53 10.025 20.160 -6.157 1.00 25.24 C ATOM 0 H THR A 53 12.248 23.248 -4.953 1.00 13.44 H new ATOM 0 HA THR A 53 12.372 20.469 -4.681 1.00 45.01 H new ATOM 0 HB THR A 53 10.539 22.223 -6.363 1.00 32.00 H new ATOM 0 HG1 THR A 53 10.044 22.777 -4.330 1.00 41.42 H new ATOM 0 HG21 THR A 53 8.955 20.333 -6.274 1.00 25.24 H new ATOM 0 HG22 THR A 53 10.457 19.893 -7.122 1.00 25.24 H new ATOM 0 HG23 THR A 53 10.186 19.346 -5.450 1.00 25.24 H new ATOM 785 N LEU A 54 13.104 21.648 -7.668 1.00 31.41 N ATOM 786 CA LEU A 54 13.676 21.302 -8.965 1.00 14.22 C ATOM 787 C LEU A 54 14.889 20.393 -8.800 1.00 42.02 C ATOM 788 O LEU A 54 15.042 19.407 -9.523 1.00 3.23 O ATOM 789 CB LEU A 54 14.073 22.570 -9.723 1.00 11.00 C ATOM 790 CG LEU A 54 13.087 23.052 -10.788 1.00 22.10 C ATOM 791 CD1 LEU A 54 13.420 24.472 -11.220 1.00 32.32 C ATOM 792 CD2 LEU A 54 13.094 22.113 -11.985 1.00 64.23 C ATOM 0 H LEU A 54 12.968 22.648 -7.520 1.00 31.41 H new ATOM 0 HA LEU A 54 12.919 20.766 -9.537 1.00 14.22 H new ATOM 0 HB2 LEU A 54 14.216 23.372 -8.999 1.00 11.00 H new ATOM 0 HB3 LEU A 54 15.037 22.397 -10.201 1.00 11.00 H new ATOM 0 HG LEU A 54 12.086 23.051 -10.356 1.00 22.10 H new ATOM 0 HD11 LEU A 54 12.708 24.798 -11.978 1.00 32.32 H new ATOM 0 HD12 LEU A 54 13.363 25.137 -10.358 1.00 32.32 H new ATOM 0 HD13 LEU A 54 14.428 24.500 -11.633 1.00 32.32 H new ATOM 0 HD21 LEU A 54 12.387 22.471 -12.733 1.00 64.23 H new ATOM 0 HD22 LEU A 54 14.094 22.082 -12.417 1.00 64.23 H new ATOM 0 HD23 LEU A 54 12.806 21.112 -11.664 1.00 64.23 H new ATOM 804 N LEU A 55 15.748 20.729 -7.844 1.00 43.25 N ATOM 805 CA LEU A 55 16.948 19.942 -7.583 1.00 22.23 C ATOM 806 C LEU A 55 16.602 18.468 -7.397 1.00 23.22 C ATOM 807 O LEU A 55 17.235 17.593 -7.987 1.00 33.51 O ATOM 808 CB LEU A 55 17.667 20.469 -6.340 1.00 2.41 C ATOM 809 CG LEU A 55 19.164 20.168 -6.251 1.00 74.43 C ATOM 810 CD1 LEU A 55 19.967 21.458 -6.213 1.00 40.20 C ATOM 811 CD2 LEU A 55 19.464 19.314 -5.028 1.00 70.41 C ATOM 0 H LEU A 55 15.636 21.541 -7.237 1.00 43.25 H new ATOM 0 HA LEU A 55 17.609 20.036 -8.445 1.00 22.23 H new ATOM 0 HB2 LEU A 55 17.531 21.550 -6.297 1.00 2.41 H new ATOM 0 HB3 LEU A 55 17.180 20.051 -5.459 1.00 2.41 H new ATOM 0 HG LEU A 55 19.456 19.609 -7.140 1.00 74.43 H new ATOM 0 HD11 LEU A 55 21.030 21.223 -6.150 1.00 40.20 H new ATOM 0 HD12 LEU A 55 19.776 22.033 -7.119 1.00 40.20 H new ATOM 0 HD13 LEU A 55 19.672 22.044 -5.343 1.00 40.20 H new ATOM 0 HD21 LEU A 55 20.534 19.110 -4.981 1.00 70.41 H new ATOM 0 HD22 LEU A 55 19.156 19.846 -4.128 1.00 70.41 H new ATOM 0 HD23 LEU A 55 18.918 18.373 -5.098 1.00 70.41 H new ATOM 823 N ALA A 56 15.593 18.201 -6.574 1.00 40.42 N ATOM 824 CA ALA A 56 15.160 16.834 -6.314 1.00 42.01 C ATOM 825 C ALA A 56 14.404 16.261 -7.508 1.00 1.00 C ATOM 826 O ALA A 56 14.568 15.091 -7.857 1.00 54.31 O ATOM 827 CB ALA A 56 14.294 16.784 -5.064 1.00 74.55 C ATOM 0 H ALA A 56 15.060 18.914 -6.076 1.00 40.42 H new ATOM 0 HA ALA A 56 16.047 16.222 -6.152 1.00 42.01 H new ATOM 0 HB1 ALA A 56 13.977 15.757 -4.882 1.00 74.55 H new ATOM 0 HB2 ALA A 56 14.867 17.144 -4.210 1.00 74.55 H new ATOM 0 HB3 ALA A 56 13.416 17.415 -5.204 1.00 74.55 H new ATOM 833 N THR A 57 13.574 17.092 -8.132 1.00 25.14 N ATOM 834 CA THR A 57 12.792 16.667 -9.285 1.00 54.42 C ATOM 835 C THR A 57 13.694 16.179 -10.413 1.00 1.24 C ATOM 836 O THR A 57 13.611 15.025 -10.832 1.00 70.23 O ATOM 837 CB THR A 57 11.903 17.810 -9.812 1.00 61.24 C ATOM 838 OG1 THR A 57 11.317 18.520 -8.716 1.00 55.10 O ATOM 839 CG2 THR A 57 10.807 17.269 -10.718 1.00 34.04 C ATOM 0 H THR A 57 13.427 18.063 -7.857 1.00 25.14 H new ATOM 0 HA THR A 57 12.157 15.846 -8.951 1.00 54.42 H new ATOM 0 HB THR A 57 12.528 18.490 -10.391 1.00 61.24 H new ATOM 0 HG1 THR A 57 12.004 19.058 -8.270 1.00 55.10 H new ATOM 0 HG21 THR A 57 10.192 18.094 -11.078 1.00 34.04 H new ATOM 0 HG22 THR A 57 11.258 16.755 -11.567 1.00 34.04 H new ATOM 0 HG23 THR A 57 10.185 16.570 -10.159 1.00 34.04 H new ATOM 847 N VAL A 58 14.557 17.065 -10.899 1.00 43.23 N ATOM 848 CA VAL A 58 15.477 16.724 -11.978 1.00 23.55 C ATOM 849 C VAL A 58 16.313 15.500 -11.620 1.00 31.32 C ATOM 850 O VAL A 58 16.608 14.665 -12.475 1.00 45.35 O ATOM 851 CB VAL A 58 16.420 17.897 -12.304 1.00 54.34 C ATOM 852 CG1 VAL A 58 17.223 18.296 -11.076 1.00 34.35 C ATOM 853 CG2 VAL A 58 17.341 17.535 -13.459 1.00 61.50 C ATOM 0 H VAL A 58 14.639 18.025 -10.563 1.00 43.23 H new ATOM 0 HA VAL A 58 14.868 16.502 -12.855 1.00 23.55 H new ATOM 0 HB VAL A 58 15.815 18.752 -12.606 1.00 54.34 H new ATOM 0 HG11 VAL A 58 17.883 19.126 -11.327 1.00 34.35 H new ATOM 0 HG12 VAL A 58 16.543 18.601 -10.280 1.00 34.35 H new ATOM 0 HG13 VAL A 58 17.819 17.448 -10.739 1.00 34.35 H new ATOM 0 HG21 VAL A 58 18.000 18.375 -13.676 1.00 61.50 H new ATOM 0 HG22 VAL A 58 17.939 16.665 -13.188 1.00 61.50 H new ATOM 0 HG23 VAL A 58 16.744 17.305 -14.342 1.00 61.50 H new ATOM 863 N ASP A 59 16.691 15.399 -10.350 1.00 75.32 N ATOM 864 CA ASP A 59 17.491 14.275 -9.878 1.00 4.33 C ATOM 865 C ASP A 59 16.803 12.949 -10.186 1.00 41.33 C ATOM 866 O ASP A 59 17.459 11.961 -10.513 1.00 33.31 O ATOM 867 CB ASP A 59 17.741 14.396 -8.374 1.00 5.53 C ATOM 868 CG ASP A 59 18.442 13.179 -7.803 1.00 44.24 C ATOM 869 OD1 ASP A 59 19.621 12.956 -8.150 1.00 44.13 O ATOM 870 OD2 ASP A 59 17.812 12.450 -7.010 1.00 23.05 O ATOM 0 H ASP A 59 16.456 16.082 -9.629 1.00 75.32 H new ATOM 0 HA ASP A 59 18.447 14.297 -10.401 1.00 4.33 H new ATOM 0 HB2 ASP A 59 18.343 15.283 -8.179 1.00 5.53 H new ATOM 0 HB3 ASP A 59 16.790 14.538 -7.861 1.00 5.53 H new ATOM 875 N GLU A 60 15.478 12.937 -10.079 1.00 41.11 N ATOM 876 CA GLU A 60 14.702 11.732 -10.345 1.00 30.40 C ATOM 877 C GLU A 60 14.432 11.577 -11.839 1.00 20.21 C ATOM 878 O GLU A 60 14.112 10.487 -12.313 1.00 61.11 O ATOM 879 CB GLU A 60 13.379 11.771 -9.578 1.00 33.42 C ATOM 880 CG GLU A 60 12.568 10.491 -9.698 1.00 15.51 C ATOM 881 CD GLU A 60 12.290 9.848 -8.353 1.00 42.11 C ATOM 882 OE1 GLU A 60 13.197 9.855 -7.495 1.00 23.24 O ATOM 883 OE2 GLU A 60 11.167 9.338 -8.159 1.00 61.11 O ATOM 0 H GLU A 60 14.920 13.748 -9.810 1.00 41.11 H new ATOM 0 HA GLU A 60 15.284 10.874 -10.008 1.00 30.40 H new ATOM 0 HB2 GLU A 60 13.585 11.964 -8.525 1.00 33.42 H new ATOM 0 HB3 GLU A 60 12.781 12.606 -9.944 1.00 33.42 H new ATOM 0 HG2 GLU A 60 11.622 10.710 -10.194 1.00 15.51 H new ATOM 0 HG3 GLU A 60 13.104 9.784 -10.331 1.00 15.51 H new ATOM 890 N SER A 61 14.563 12.676 -12.575 1.00 31.11 N ATOM 891 CA SER A 61 14.329 12.664 -14.014 1.00 40.42 C ATOM 892 C SER A 61 15.474 11.969 -14.745 1.00 53.20 C ATOM 893 O SER A 61 15.300 11.460 -15.853 1.00 20.31 O ATOM 894 CB SER A 61 14.168 14.093 -14.537 1.00 72.04 C ATOM 895 OG SER A 61 13.081 14.748 -13.906 1.00 72.45 O ATOM 0 H SER A 61 14.830 13.586 -12.199 1.00 31.11 H new ATOM 0 HA SER A 61 13.410 12.109 -14.203 1.00 40.42 H new ATOM 0 HB2 SER A 61 15.086 14.654 -14.361 1.00 72.04 H new ATOM 0 HB3 SER A 61 14.008 14.073 -15.615 1.00 72.04 H new ATOM 0 HG SER A 61 13.266 14.840 -12.948 1.00 72.45 H new ATOM 901 N LEU A 62 16.644 11.952 -14.117 1.00 42.31 N ATOM 902 CA LEU A 62 17.819 11.320 -14.706 1.00 64.22 C ATOM 903 C LEU A 62 17.502 9.899 -15.163 1.00 0.43 C ATOM 904 O LEU A 62 17.609 9.561 -16.342 1.00 4.43 O ATOM 905 CB LEU A 62 18.970 11.299 -13.699 1.00 24.20 C ATOM 906 CG LEU A 62 20.047 12.369 -13.887 1.00 74.42 C ATOM 907 CD1 LEU A 62 21.112 12.250 -12.808 1.00 72.22 C ATOM 908 CD2 LEU A 62 20.671 12.259 -15.270 1.00 44.14 C ATOM 0 H LEU A 62 16.804 12.369 -13.200 1.00 42.31 H new ATOM 0 HA LEU A 62 18.117 11.904 -15.577 1.00 64.22 H new ATOM 0 HB2 LEU A 62 18.552 11.405 -12.698 1.00 24.20 H new ATOM 0 HB3 LEU A 62 19.447 10.320 -13.743 1.00 24.20 H new ATOM 0 HG LEU A 62 19.578 13.349 -13.799 1.00 74.42 H new ATOM 0 HD11 LEU A 62 21.870 13.019 -12.958 1.00 72.22 H new ATOM 0 HD12 LEU A 62 20.653 12.379 -11.828 1.00 72.22 H new ATOM 0 HD13 LEU A 62 21.578 11.266 -12.864 1.00 72.22 H new ATOM 0 HD21 LEU A 62 21.435 13.028 -15.387 1.00 44.14 H new ATOM 0 HD22 LEU A 62 21.125 11.275 -15.387 1.00 44.14 H new ATOM 0 HD23 LEU A 62 19.900 12.395 -16.029 1.00 44.14 H new ATOM 920 N PRO A 63 17.099 9.047 -14.209 1.00 24.04 N ATOM 921 CA PRO A 63 16.755 7.650 -14.489 1.00 62.12 C ATOM 922 C PRO A 63 15.462 7.520 -15.288 1.00 5.55 C ATOM 923 O PRO A 63 15.375 6.722 -16.221 1.00 14.33 O ATOM 924 CB PRO A 63 16.586 7.039 -13.096 1.00 4.54 C ATOM 925 CG PRO A 63 16.226 8.189 -12.220 1.00 13.14 C ATOM 926 CD PRO A 63 16.949 9.381 -12.783 1.00 14.55 C ATOM 0 HA PRO A 63 17.515 7.158 -15.096 1.00 62.12 H new ATOM 0 HB2 PRO A 63 15.807 6.277 -13.090 1.00 4.54 H new ATOM 0 HB3 PRO A 63 17.505 6.558 -12.760 1.00 4.54 H new ATOM 0 HG2 PRO A 63 15.148 8.353 -12.215 1.00 13.14 H new ATOM 0 HG3 PRO A 63 16.525 8.002 -11.189 1.00 13.14 H new ATOM 0 HD2 PRO A 63 16.379 10.300 -12.643 1.00 14.55 H new ATOM 0 HD3 PRO A 63 17.915 9.529 -12.301 1.00 14.55 H new ATOM 934 N VAL A 64 14.461 8.311 -14.915 1.00 74.22 N ATOM 935 CA VAL A 64 13.173 8.285 -15.598 1.00 14.51 C ATOM 936 C VAL A 64 13.347 8.428 -17.106 1.00 31.53 C ATOM 937 O VAL A 64 12.598 7.839 -17.887 1.00 15.53 O ATOM 938 CB VAL A 64 12.247 9.407 -15.091 1.00 53.33 C ATOM 939 CG1 VAL A 64 10.982 9.477 -15.933 1.00 34.41 C ATOM 940 CG2 VAL A 64 11.909 9.197 -13.623 1.00 63.30 C ATOM 0 H VAL A 64 14.517 8.977 -14.144 1.00 74.22 H new ATOM 0 HA VAL A 64 12.717 7.320 -15.378 1.00 14.51 H new ATOM 0 HB VAL A 64 12.772 10.358 -15.187 1.00 53.33 H new ATOM 0 HG11 VAL A 64 10.340 10.275 -15.560 1.00 34.41 H new ATOM 0 HG12 VAL A 64 11.246 9.679 -16.971 1.00 34.41 H new ATOM 0 HG13 VAL A 64 10.451 8.527 -15.872 1.00 34.41 H new ATOM 0 HG21 VAL A 64 11.254 9.999 -13.282 1.00 63.30 H new ATOM 0 HG22 VAL A 64 11.404 8.239 -13.499 1.00 63.30 H new ATOM 0 HG23 VAL A 64 12.826 9.202 -13.034 1.00 63.30 H new ATOM 950 N LEU A 65 14.341 9.211 -17.509 1.00 53.24 N ATOM 951 CA LEU A 65 14.615 9.431 -18.925 1.00 61.23 C ATOM 952 C LEU A 65 15.837 8.635 -19.373 1.00 73.31 C ATOM 953 O LEU A 65 16.678 8.236 -18.567 1.00 41.35 O ATOM 954 CB LEU A 65 14.835 10.920 -19.197 1.00 72.14 C ATOM 955 CG LEU A 65 13.572 11.761 -19.385 1.00 40.43 C ATOM 956 CD1 LEU A 65 12.865 11.381 -20.677 1.00 14.41 C ATOM 957 CD2 LEU A 65 12.639 11.595 -18.195 1.00 55.41 C ATOM 0 H LEU A 65 14.971 9.704 -16.876 1.00 53.24 H new ATOM 0 HA LEU A 65 13.751 9.088 -19.494 1.00 61.23 H new ATOM 0 HB2 LEU A 65 15.407 11.340 -18.369 1.00 72.14 H new ATOM 0 HB3 LEU A 65 15.450 11.019 -20.092 1.00 72.14 H new ATOM 0 HG LEU A 65 13.863 12.810 -19.449 1.00 40.43 H new ATOM 0 HD11 LEU A 65 11.968 11.990 -20.794 1.00 14.41 H new ATOM 0 HD12 LEU A 65 13.533 11.553 -21.521 1.00 14.41 H new ATOM 0 HD13 LEU A 65 12.586 10.328 -20.643 1.00 14.41 H new ATOM 0 HD21 LEU A 65 11.745 12.201 -18.346 1.00 55.41 H new ATOM 0 HD22 LEU A 65 12.355 10.547 -18.099 1.00 55.41 H new ATOM 0 HD23 LEU A 65 13.147 11.918 -17.286 1.00 55.41 H new ATOM 969 N PRO A 66 15.939 8.398 -20.689 1.00 42.14 N ATOM 970 CA PRO A 66 17.056 7.650 -21.275 1.00 11.33 C ATOM 971 C PRO A 66 18.368 8.425 -21.212 1.00 61.52 C ATOM 972 O PRO A 66 18.403 9.627 -21.469 1.00 53.45 O ATOM 973 CB PRO A 66 16.623 7.448 -22.729 1.00 65.50 C ATOM 974 CG PRO A 66 15.683 8.570 -23.005 1.00 24.23 C ATOM 975 CD PRO A 66 14.973 8.843 -21.708 1.00 1.12 C ATOM 0 HA PRO A 66 17.249 6.720 -20.741 1.00 11.33 H new ATOM 0 HB2 PRO A 66 17.479 7.474 -23.404 1.00 65.50 H new ATOM 0 HB3 PRO A 66 16.137 6.482 -22.867 1.00 65.50 H new ATOM 0 HG2 PRO A 66 16.220 9.454 -23.349 1.00 24.23 H new ATOM 0 HG3 PRO A 66 14.975 8.302 -23.789 1.00 24.23 H new ATOM 0 HD2 PRO A 66 14.731 9.900 -21.597 1.00 1.12 H new ATOM 0 HD3 PRO A 66 14.035 8.292 -21.640 1.00 1.12 H new ATOM 983 N ALA A 67 19.446 7.727 -20.869 1.00 72.42 N ATOM 984 CA ALA A 67 20.761 8.349 -20.776 1.00 32.54 C ATOM 985 C ALA A 67 21.196 8.917 -22.122 1.00 2.22 C ATOM 986 O ALA A 67 21.433 8.173 -23.073 1.00 41.14 O ATOM 987 CB ALA A 67 21.785 7.344 -20.269 1.00 31.13 C ATOM 0 H ALA A 67 19.434 6.731 -20.651 1.00 72.42 H new ATOM 0 HA ALA A 67 20.696 9.174 -20.067 1.00 32.54 H new ATOM 0 HB1 ALA A 67 22.763 7.822 -20.204 1.00 31.13 H new ATOM 0 HB2 ALA A 67 21.489 6.989 -19.282 1.00 31.13 H new ATOM 0 HB3 ALA A 67 21.838 6.500 -20.957 1.00 31.13 H new ATOM 993 N SER A 68 21.299 10.240 -22.195 1.00 0.43 N ATOM 994 CA SER A 68 21.702 10.909 -23.426 1.00 53.14 C ATOM 995 C SER A 68 21.624 12.425 -23.272 1.00 21.10 C ATOM 996 O SER A 68 22.413 13.163 -23.863 1.00 71.04 O ATOM 997 CB SER A 68 20.816 10.458 -24.590 1.00 25.43 C ATOM 998 OG SER A 68 19.534 10.066 -24.132 1.00 71.52 O ATOM 0 H SER A 68 21.109 10.870 -21.416 1.00 0.43 H new ATOM 0 HA SER A 68 22.736 10.635 -23.637 1.00 53.14 H new ATOM 0 HB2 SER A 68 20.716 11.270 -25.311 1.00 25.43 H new ATOM 0 HB3 SER A 68 21.290 9.626 -25.111 1.00 25.43 H new ATOM 0 HG SER A 68 18.987 9.784 -24.894 1.00 71.52 H new ATOM 1004 N THR A 69 20.666 12.884 -22.472 1.00 25.21 N ATOM 1005 CA THR A 69 20.483 14.311 -22.239 1.00 64.24 C ATOM 1006 C THR A 69 20.630 14.650 -20.761 1.00 1.24 C ATOM 1007 O THR A 69 19.805 15.367 -20.193 1.00 20.11 O ATOM 1008 CB THR A 69 19.103 14.787 -22.729 1.00 51.34 C ATOM 1009 OG1 THR A 69 18.954 16.190 -22.485 1.00 51.33 O ATOM 1010 CG2 THR A 69 17.988 14.024 -22.030 1.00 52.53 C ATOM 0 H THR A 69 20.005 12.287 -21.975 1.00 25.21 H new ATOM 0 HA THR A 69 21.259 14.826 -22.805 1.00 64.24 H new ATOM 0 HB THR A 69 19.036 14.596 -23.800 1.00 51.34 H new ATOM 0 HG1 THR A 69 19.070 16.370 -21.529 1.00 51.33 H new ATOM 0 HG21 THR A 69 17.023 14.377 -22.392 1.00 52.53 H new ATOM 0 HG22 THR A 69 18.087 12.959 -22.242 1.00 52.53 H new ATOM 0 HG23 THR A 69 18.054 14.188 -20.954 1.00 52.53 H new ATOM 1018 N HIS A 70 21.686 14.132 -20.141 1.00 33.20 N ATOM 1019 CA HIS A 70 21.941 14.382 -18.727 1.00 20.42 C ATOM 1020 C HIS A 70 23.158 15.284 -18.546 1.00 21.45 C ATOM 1021 O HIS A 70 23.387 15.823 -17.463 1.00 23.33 O ATOM 1022 CB HIS A 70 22.155 13.062 -17.985 1.00 14.04 C ATOM 1023 CG HIS A 70 23.256 12.224 -18.558 1.00 33.15 C ATOM 1024 ND1 HIS A 70 24.592 12.487 -18.342 1.00 11.13 N ATOM 1025 CD2 HIS A 70 23.213 11.121 -19.341 1.00 53.11 C ATOM 1026 CE1 HIS A 70 25.323 11.584 -18.969 1.00 63.52 C ATOM 1027 NE2 HIS A 70 24.510 10.743 -19.583 1.00 64.30 N ATOM 0 H HIS A 70 22.378 13.537 -20.596 1.00 33.20 H new ATOM 0 HA HIS A 70 21.070 14.888 -18.310 1.00 20.42 H new ATOM 0 HB2 HIS A 70 22.378 13.275 -16.939 1.00 14.04 H new ATOM 0 HB3 HIS A 70 21.227 12.490 -18.003 1.00 14.04 H new ATOM 0 HD2 HIS A 70 22.324 10.630 -19.707 1.00 53.11 H new ATOM 0 HE1 HIS A 70 26.402 11.540 -18.978 1.00 63.52 H new ATOM 0 HE2 HIS A 70 24.799 9.943 -20.146 1.00 64.30 H new ATOM 1035 N ARG A 71 23.935 15.442 -19.612 1.00 1.30 N ATOM 1036 CA ARG A 71 25.130 16.277 -19.570 1.00 14.14 C ATOM 1037 C ARG A 71 24.804 17.664 -19.022 1.00 65.12 C ATOM 1038 O ARG A 71 25.176 18.000 -17.898 1.00 40.24 O ATOM 1039 CB ARG A 71 25.742 16.399 -20.966 1.00 3.10 C ATOM 1040 CG ARG A 71 27.069 15.673 -21.114 1.00 45.22 C ATOM 1041 CD ARG A 71 28.054 16.477 -21.949 1.00 52.14 C ATOM 1042 NE ARG A 71 27.665 16.526 -23.356 1.00 43.43 N ATOM 1043 CZ ARG A 71 28.447 17.003 -24.318 1.00 45.24 C ATOM 1044 NH1 ARG A 71 29.654 17.469 -24.027 1.00 22.44 N ATOM 1045 NH2 ARG A 71 28.023 17.015 -25.576 1.00 21.55 N ATOM 0 H ARG A 71 23.759 15.003 -20.516 1.00 1.30 H new ATOM 0 HA ARG A 71 25.852 15.803 -18.905 1.00 14.14 H new ATOM 0 HB2 ARG A 71 25.038 16.004 -21.698 1.00 3.10 H new ATOM 0 HB3 ARG A 71 25.886 17.454 -21.199 1.00 3.10 H new ATOM 0 HG2 ARG A 71 27.494 15.485 -20.128 1.00 45.22 H new ATOM 0 HG3 ARG A 71 26.904 14.702 -21.580 1.00 45.22 H new ATOM 0 HD2 ARG A 71 28.120 17.491 -21.555 1.00 52.14 H new ATOM 0 HD3 ARG A 71 29.047 16.036 -21.862 1.00 52.14 H new ATOM 0 HE ARG A 71 26.743 16.175 -23.614 1.00 43.43 H new ATOM 0 HH11 ARG A 71 29.984 17.462 -23.062 1.00 22.44 H new ATOM 0 HH12 ARG A 71 30.252 17.835 -24.768 1.00 22.44 H new ATOM 0 HH21 ARG A 71 27.096 16.658 -25.805 1.00 21.55 H new ATOM 0 HH22 ARG A 71 28.625 17.382 -26.314 1.00 21.55 H new ATOM 1059 N GLU A 72 24.109 18.463 -19.825 1.00 44.51 N ATOM 1060 CA GLU A 72 23.736 19.814 -19.421 1.00 21.22 C ATOM 1061 C GLU A 72 22.924 19.790 -18.129 1.00 52.12 C ATOM 1062 O GLU A 72 23.136 20.610 -17.235 1.00 60.12 O ATOM 1063 CB GLU A 72 22.933 20.498 -20.529 1.00 13.12 C ATOM 1064 CG GLU A 72 21.718 19.704 -20.979 1.00 63.13 C ATOM 1065 CD GLU A 72 21.528 19.732 -22.483 1.00 53.44 C ATOM 1066 OE1 GLU A 72 22.063 20.655 -23.132 1.00 54.24 O ATOM 1067 OE2 GLU A 72 20.843 18.831 -23.011 1.00 62.22 O ATOM 0 H GLU A 72 23.793 18.199 -20.758 1.00 44.51 H new ATOM 0 HA GLU A 72 24.651 20.379 -19.244 1.00 21.22 H new ATOM 0 HB2 GLU A 72 22.607 21.477 -20.178 1.00 13.12 H new ATOM 0 HB3 GLU A 72 23.584 20.667 -21.387 1.00 13.12 H new ATOM 0 HG2 GLU A 72 21.821 18.670 -20.649 1.00 63.13 H new ATOM 0 HG3 GLU A 72 20.827 20.105 -20.496 1.00 63.13 H new ATOM 1074 N ILE A 73 21.994 18.846 -18.040 1.00 34.44 N ATOM 1075 CA ILE A 73 21.150 18.715 -16.858 1.00 61.51 C ATOM 1076 C ILE A 73 21.992 18.606 -15.591 1.00 74.21 C ATOM 1077 O ILE A 73 21.662 19.196 -14.563 1.00 51.22 O ATOM 1078 CB ILE A 73 20.230 17.483 -16.957 1.00 0.40 C ATOM 1079 CG1 ILE A 73 19.007 17.801 -17.820 1.00 1.52 C ATOM 1080 CG2 ILE A 73 19.802 17.029 -15.569 1.00 64.05 C ATOM 1081 CD1 ILE A 73 19.343 18.065 -19.271 1.00 24.01 C ATOM 0 H ILE A 73 21.805 18.161 -18.771 1.00 34.44 H new ATOM 0 HA ILE A 73 20.536 19.614 -16.807 1.00 61.51 H new ATOM 0 HB ILE A 73 20.783 16.671 -17.429 1.00 0.40 H new ATOM 0 HG12 ILE A 73 18.306 16.968 -17.764 1.00 1.52 H new ATOM 0 HG13 ILE A 73 18.499 18.673 -17.409 1.00 1.52 H new ATOM 0 HG21 ILE A 73 19.152 16.158 -15.655 1.00 64.05 H new ATOM 0 HG22 ILE A 73 20.684 16.768 -14.984 1.00 64.05 H new ATOM 0 HG23 ILE A 73 19.263 17.836 -15.072 1.00 64.05 H new ATOM 0 HD11 ILE A 73 18.428 18.283 -19.822 1.00 24.01 H new ATOM 0 HD12 ILE A 73 20.020 18.917 -19.339 1.00 24.01 H new ATOM 0 HD13 ILE A 73 19.824 17.185 -19.699 1.00 24.01 H new ATOM 1093 N GLU A 74 23.081 17.848 -15.674 1.00 11.21 N ATOM 1094 CA GLU A 74 23.970 17.663 -14.533 1.00 45.43 C ATOM 1095 C GLU A 74 24.547 18.999 -14.071 1.00 35.43 C ATOM 1096 O GLU A 74 24.491 19.334 -12.888 1.00 13.10 O ATOM 1097 CB GLU A 74 25.106 16.703 -14.894 1.00 51.22 C ATOM 1098 CG GLU A 74 24.953 15.322 -14.280 1.00 23.12 C ATOM 1099 CD GLU A 74 26.225 14.501 -14.366 1.00 45.32 C ATOM 1100 OE1 GLU A 74 27.273 15.070 -14.739 1.00 62.32 O ATOM 1101 OE2 GLU A 74 26.174 13.292 -14.061 1.00 73.43 O ATOM 0 H GLU A 74 23.368 17.353 -16.518 1.00 11.21 H new ATOM 0 HA GLU A 74 23.388 17.236 -13.717 1.00 45.43 H new ATOM 0 HB2 GLU A 74 25.158 16.606 -15.978 1.00 51.22 H new ATOM 0 HB3 GLU A 74 26.052 17.134 -14.567 1.00 51.22 H new ATOM 0 HG2 GLU A 74 24.661 15.424 -13.235 1.00 23.12 H new ATOM 0 HG3 GLU A 74 24.147 14.791 -14.786 1.00 23.12 H new ATOM 1108 N MET A 75 25.100 19.756 -15.012 1.00 62.53 N ATOM 1109 CA MET A 75 25.686 21.054 -14.702 1.00 1.43 C ATOM 1110 C MET A 75 24.606 22.060 -14.317 1.00 12.04 C ATOM 1111 O MET A 75 24.873 23.031 -13.610 1.00 13.41 O ATOM 1112 CB MET A 75 26.483 21.578 -15.898 1.00 61.53 C ATOM 1113 CG MET A 75 27.587 20.636 -16.352 1.00 0.03 C ATOM 1114 SD MET A 75 29.216 21.409 -16.320 1.00 54.23 S ATOM 1115 CE MET A 75 30.229 20.042 -15.761 1.00 13.11 C ATOM 0 H MET A 75 25.155 19.493 -15.996 1.00 62.53 H new ATOM 0 HA MET A 75 26.359 20.927 -13.854 1.00 1.43 H new ATOM 0 HB2 MET A 75 25.801 21.753 -16.730 1.00 61.53 H new ATOM 0 HB3 MET A 75 26.922 22.541 -15.638 1.00 61.53 H new ATOM 0 HG2 MET A 75 27.594 19.755 -15.710 1.00 0.03 H new ATOM 0 HG3 MET A 75 27.372 20.292 -17.364 1.00 0.03 H new ATOM 0 HE1 MET A 75 31.268 20.364 -15.691 1.00 13.11 H new ATOM 0 HE2 MET A 75 29.885 19.711 -14.781 1.00 13.11 H new ATOM 0 HE3 MET A 75 30.152 19.218 -16.470 1.00 13.11 H new ATOM 1125 N ALA A 76 23.386 21.820 -14.786 1.00 51.33 N ATOM 1126 CA ALA A 76 22.266 22.704 -14.489 1.00 54.23 C ATOM 1127 C ALA A 76 21.932 22.686 -13.001 1.00 54.25 C ATOM 1128 O ALA A 76 21.537 23.704 -12.433 1.00 5.01 O ATOM 1129 CB ALA A 76 21.048 22.307 -15.310 1.00 52.04 C ATOM 0 H ALA A 76 23.148 21.021 -15.373 1.00 51.33 H new ATOM 0 HA ALA A 76 22.556 23.720 -14.757 1.00 54.23 H new ATOM 0 HB1 ALA A 76 20.219 22.976 -15.078 1.00 52.04 H new ATOM 0 HB2 ALA A 76 21.286 22.378 -16.371 1.00 52.04 H new ATOM 0 HB3 ALA A 76 20.765 21.282 -15.070 1.00 52.04 H new ATOM 1135 N GLN A 77 22.091 21.523 -12.378 1.00 2.41 N ATOM 1136 CA GLN A 77 21.805 21.374 -10.956 1.00 54.00 C ATOM 1137 C GLN A 77 22.537 22.433 -10.139 1.00 1.21 C ATOM 1138 O GLN A 77 21.920 23.198 -9.397 1.00 74.33 O ATOM 1139 CB GLN A 77 22.204 19.977 -10.478 1.00 4.23 C ATOM 1140 CG GLN A 77 21.475 18.855 -11.199 1.00 42.21 C ATOM 1141 CD GLN A 77 21.880 17.482 -10.702 1.00 32.44 C ATOM 1142 OE1 GLN A 77 22.319 16.632 -11.477 1.00 41.23 O ATOM 1143 NE2 GLN A 77 21.734 17.256 -9.401 1.00 72.02 N ATOM 0 H GLN A 77 22.416 20.671 -12.835 1.00 2.41 H new ATOM 0 HA GLN A 77 20.733 21.507 -10.811 1.00 54.00 H new ATOM 0 HB2 GLN A 77 23.278 19.848 -10.615 1.00 4.23 H new ATOM 0 HB3 GLN A 77 22.008 19.898 -9.409 1.00 4.23 H new ATOM 0 HG2 GLN A 77 20.400 18.982 -11.068 1.00 42.21 H new ATOM 0 HG3 GLN A 77 21.676 18.924 -12.268 1.00 42.21 H new ATOM 0 HE21 GLN A 77 21.366 17.989 -8.794 1.00 72.02 H new ATOM 0 HE22 GLN A 77 21.990 16.350 -9.009 1.00 72.02 H new ATOM 1152 N LYS A 78 23.858 22.473 -10.279 1.00 72.31 N ATOM 1153 CA LYS A 78 24.676 23.438 -9.555 1.00 50.41 C ATOM 1154 C LYS A 78 24.238 24.866 -9.868 1.00 34.55 C ATOM 1155 O LYS A 78 24.124 25.702 -8.970 1.00 60.50 O ATOM 1156 CB LYS A 78 26.153 23.257 -9.914 1.00 13.13 C ATOM 1157 CG LYS A 78 26.983 22.661 -8.790 1.00 73.10 C ATOM 1158 CD LYS A 78 27.597 21.332 -9.195 1.00 62.35 C ATOM 1159 CE LYS A 78 26.653 20.173 -8.916 1.00 32.41 C ATOM 1160 NZ LYS A 78 27.375 18.984 -8.383 1.00 44.52 N ATOM 0 H LYS A 78 24.385 21.847 -10.888 1.00 72.31 H new ATOM 0 HA LYS A 78 24.543 23.261 -8.488 1.00 50.41 H new ATOM 0 HB2 LYS A 78 26.229 22.614 -10.791 1.00 13.13 H new ATOM 0 HB3 LYS A 78 26.572 24.224 -10.191 1.00 13.13 H new ATOM 0 HG2 LYS A 78 27.773 23.358 -8.511 1.00 73.10 H new ATOM 0 HG3 LYS A 78 26.357 22.520 -7.909 1.00 73.10 H new ATOM 0 HD2 LYS A 78 27.845 21.353 -10.256 1.00 62.35 H new ATOM 0 HD3 LYS A 78 28.530 21.181 -8.653 1.00 62.35 H new ATOM 0 HE2 LYS A 78 25.894 20.488 -8.200 1.00 32.41 H new ATOM 0 HE3 LYS A 78 26.132 19.900 -9.834 1.00 32.41 H new ATOM 0 HZ1 LYS A 78 26.696 18.216 -8.206 1.00 44.52 H new ATOM 0 HZ2 LYS A 78 28.082 18.668 -9.077 1.00 44.52 H new ATOM 0 HZ3 LYS A 78 27.851 19.237 -7.494 1.00 44.52 H new ATOM 1174 N LEU A 79 23.991 25.138 -11.144 1.00 62.32 N ATOM 1175 CA LEU A 79 23.563 26.464 -11.575 1.00 2.21 C ATOM 1176 C LEU A 79 22.307 26.900 -10.828 1.00 53.11 C ATOM 1177 O LEU A 79 22.205 28.041 -10.374 1.00 64.24 O ATOM 1178 CB LEU A 79 23.303 26.473 -13.082 1.00 44.33 C ATOM 1179 CG LEU A 79 23.782 27.713 -13.838 1.00 41.24 C ATOM 1180 CD1 LEU A 79 25.190 27.501 -14.374 1.00 54.41 C ATOM 1181 CD2 LEU A 79 22.823 28.050 -14.971 1.00 45.22 C ATOM 0 H LEU A 79 24.080 24.458 -11.899 1.00 62.32 H new ATOM 0 HA LEU A 79 24.362 27.169 -11.347 1.00 2.21 H new ATOM 0 HB2 LEU A 79 23.784 25.598 -13.519 1.00 44.33 H new ATOM 0 HB3 LEU A 79 22.231 26.363 -13.246 1.00 44.33 H new ATOM 0 HG LEU A 79 23.803 28.553 -13.144 1.00 41.24 H new ATOM 0 HD11 LEU A 79 25.514 28.394 -14.909 1.00 54.41 H new ATOM 0 HD12 LEU A 79 25.870 27.308 -13.544 1.00 54.41 H new ATOM 0 HD13 LEU A 79 25.196 26.649 -15.053 1.00 54.41 H new ATOM 0 HD21 LEU A 79 23.179 28.935 -15.498 1.00 45.22 H new ATOM 0 HD22 LEU A 79 22.770 27.211 -15.665 1.00 45.22 H new ATOM 0 HD23 LEU A 79 21.832 28.246 -14.562 1.00 45.22 H new ATOM 1193 N LEU A 80 21.352 25.985 -10.702 1.00 62.22 N ATOM 1194 CA LEU A 80 20.102 26.274 -10.008 1.00 21.52 C ATOM 1195 C LEU A 80 20.369 26.785 -8.596 1.00 1.40 C ATOM 1196 O LEU A 80 19.789 27.782 -8.167 1.00 24.24 O ATOM 1197 CB LEU A 80 19.226 25.021 -9.951 1.00 62.32 C ATOM 1198 CG LEU A 80 18.096 25.038 -8.921 1.00 24.30 C ATOM 1199 CD1 LEU A 80 16.851 24.371 -9.484 1.00 13.12 C ATOM 1200 CD2 LEU A 80 18.536 24.352 -7.636 1.00 22.42 C ATOM 0 H LEU A 80 21.419 25.037 -11.071 1.00 62.22 H new ATOM 0 HA LEU A 80 19.578 27.052 -10.564 1.00 21.52 H new ATOM 0 HB2 LEU A 80 18.789 24.862 -10.937 1.00 62.32 H new ATOM 0 HB3 LEU A 80 19.866 24.164 -9.744 1.00 62.32 H new ATOM 0 HG LEU A 80 17.855 26.076 -8.691 1.00 24.30 H new ATOM 0 HD11 LEU A 80 16.057 24.392 -8.737 1.00 13.12 H new ATOM 0 HD12 LEU A 80 16.524 24.905 -10.376 1.00 13.12 H new ATOM 0 HD13 LEU A 80 17.078 23.337 -9.743 1.00 13.12 H new ATOM 0 HD21 LEU A 80 17.720 24.373 -6.914 1.00 22.42 H new ATOM 0 HD22 LEU A 80 18.805 23.317 -7.849 1.00 22.42 H new ATOM 0 HD23 LEU A 80 19.399 24.873 -7.223 1.00 22.42 H new ATOM 1212 N ASN A 81 21.252 26.097 -7.880 1.00 4.42 N ATOM 1213 CA ASN A 81 21.598 26.483 -6.516 1.00 52.55 C ATOM 1214 C ASN A 81 21.996 27.955 -6.452 1.00 73.11 C ATOM 1215 O ASN A 81 21.317 28.765 -5.821 1.00 41.10 O ATOM 1216 CB ASN A 81 22.740 25.611 -5.991 1.00 52.30 C ATOM 1217 CG ASN A 81 23.131 25.965 -4.569 1.00 54.31 C ATOM 1218 OD1 ASN A 81 24.036 26.768 -4.344 1.00 42.21 O ATOM 1219 ND2 ASN A 81 22.447 25.366 -3.601 1.00 62.42 N ATOM 0 H ASN A 81 21.741 25.269 -8.221 1.00 4.42 H new ATOM 0 HA ASN A 81 20.719 26.335 -5.889 1.00 52.55 H new ATOM 0 HB2 ASN A 81 22.442 24.563 -6.033 1.00 52.30 H new ATOM 0 HB3 ASN A 81 23.607 25.722 -6.642 1.00 52.30 H new ATOM 0 HD21 ASN A 81 22.664 25.565 -2.625 1.00 62.42 H new ATOM 0 HD22 ASN A 81 21.704 24.707 -3.834 1.00 62.42 H new ATOM 1226 N SER A 82 23.100 28.293 -7.110 1.00 41.02 N ATOM 1227 CA SER A 82 23.591 29.666 -7.125 1.00 53.14 C ATOM 1228 C SER A 82 22.493 30.630 -7.566 1.00 45.14 C ATOM 1229 O SER A 82 22.301 31.687 -6.964 1.00 63.34 O ATOM 1230 CB SER A 82 24.798 29.788 -8.058 1.00 13.55 C ATOM 1231 OG SER A 82 25.206 28.517 -8.533 1.00 53.51 O ATOM 0 H SER A 82 23.672 27.635 -7.640 1.00 41.02 H new ATOM 0 HA SER A 82 23.896 29.929 -6.112 1.00 53.14 H new ATOM 0 HB2 SER A 82 24.546 30.431 -8.901 1.00 13.55 H new ATOM 0 HB3 SER A 82 25.624 30.264 -7.529 1.00 13.55 H new ATOM 0 HG SER A 82 25.977 28.622 -9.128 1.00 53.51 H new ATOM 1237 N ASP A 83 21.777 30.258 -8.621 1.00 72.02 N ATOM 1238 CA ASP A 83 20.698 31.088 -9.144 1.00 14.02 C ATOM 1239 C ASP A 83 19.666 31.384 -8.059 1.00 42.35 C ATOM 1240 O ASP A 83 19.242 32.528 -7.887 1.00 72.32 O ATOM 1241 CB ASP A 83 20.024 30.398 -10.331 1.00 10.10 C ATOM 1242 CG ASP A 83 20.692 30.733 -11.650 1.00 54.03 C ATOM 1243 OD1 ASP A 83 21.174 31.875 -11.797 1.00 51.25 O ATOM 1244 OD2 ASP A 83 20.731 29.853 -12.536 1.00 0.11 O ATOM 0 H ASP A 83 21.924 29.387 -9.131 1.00 72.02 H new ATOM 0 HA ASP A 83 21.128 32.032 -9.479 1.00 14.02 H new ATOM 0 HB2 ASP A 83 20.045 29.319 -10.180 1.00 10.10 H new ATOM 0 HB3 ASP A 83 18.976 30.694 -10.372 1.00 10.10 H new ATOM 1249 N LEU A 84 19.266 30.347 -7.332 1.00 1.53 N ATOM 1250 CA LEU A 84 18.283 30.496 -6.264 1.00 61.11 C ATOM 1251 C LEU A 84 18.686 31.611 -5.304 1.00 60.40 C ATOM 1252 O LEU A 84 17.941 32.569 -5.102 1.00 34.53 O ATOM 1253 CB LEU A 84 18.129 29.180 -5.500 1.00 34.12 C ATOM 1254 CG LEU A 84 17.229 29.223 -4.264 1.00 52.12 C ATOM 1255 CD1 LEU A 84 15.874 29.820 -4.611 1.00 52.12 C ATOM 1256 CD2 LEU A 84 17.065 27.830 -3.675 1.00 74.41 C ATOM 0 H LEU A 84 19.607 29.394 -7.462 1.00 1.53 H new ATOM 0 HA LEU A 84 17.327 30.760 -6.717 1.00 61.11 H new ATOM 0 HB2 LEU A 84 17.736 28.429 -6.185 1.00 34.12 H new ATOM 0 HB3 LEU A 84 19.119 28.844 -5.192 1.00 34.12 H new ATOM 0 HG LEU A 84 17.702 29.859 -3.516 1.00 52.12 H new ATOM 0 HD11 LEU A 84 15.247 29.843 -3.719 1.00 52.12 H new ATOM 0 HD12 LEU A 84 16.009 30.835 -4.986 1.00 52.12 H new ATOM 0 HD13 LEU A 84 15.394 29.211 -5.377 1.00 52.12 H new ATOM 0 HD21 LEU A 84 16.422 27.880 -2.796 1.00 74.41 H new ATOM 0 HD22 LEU A 84 16.614 27.172 -4.418 1.00 74.41 H new ATOM 0 HD23 LEU A 84 18.041 27.439 -3.388 1.00 74.41 H new ATOM 1268 N ALA A 85 19.871 31.479 -4.717 1.00 0.21 N ATOM 1269 CA ALA A 85 20.375 32.477 -3.782 1.00 0.14 C ATOM 1270 C ALA A 85 20.303 33.877 -4.381 1.00 42.34 C ATOM 1271 O ALA A 85 19.720 34.786 -3.791 1.00 31.41 O ATOM 1272 CB ALA A 85 21.804 32.147 -3.377 1.00 20.12 C ATOM 0 H ALA A 85 20.500 30.691 -4.872 1.00 0.21 H new ATOM 0 HA ALA A 85 19.744 32.458 -2.894 1.00 0.14 H new ATOM 0 HB1 ALA A 85 22.168 32.901 -2.679 1.00 20.12 H new ATOM 0 HB2 ALA A 85 21.830 31.167 -2.900 1.00 20.12 H new ATOM 0 HB3 ALA A 85 22.440 32.136 -4.262 1.00 20.12 H new ATOM 1278 N GLU A 86 20.901 34.044 -5.557 1.00 72.12 N ATOM 1279 CA GLU A 86 20.905 35.335 -6.235 1.00 70.11 C ATOM 1280 C GLU A 86 19.481 35.838 -6.456 1.00 4.11 C ATOM 1281 O GLU A 86 19.222 37.041 -6.410 1.00 51.44 O ATOM 1282 CB GLU A 86 21.634 35.229 -7.576 1.00 41.42 C ATOM 1283 CG GLU A 86 22.970 35.953 -7.601 1.00 70.13 C ATOM 1284 CD GLU A 86 23.005 37.078 -8.617 1.00 50.21 C ATOM 1285 OE1 GLU A 86 22.422 38.147 -8.338 1.00 20.11 O ATOM 1286 OE2 GLU A 86 23.614 36.891 -9.691 1.00 25.54 O ATOM 0 H GLU A 86 21.388 33.302 -6.059 1.00 72.12 H new ATOM 0 HA GLU A 86 21.429 36.049 -5.600 1.00 70.11 H new ATOM 0 HB2 GLU A 86 21.796 34.177 -7.810 1.00 41.42 H new ATOM 0 HB3 GLU A 86 20.995 35.635 -8.360 1.00 41.42 H new ATOM 0 HG2 GLU A 86 23.179 36.357 -6.610 1.00 70.13 H new ATOM 0 HG3 GLU A 86 23.762 35.239 -7.828 1.00 70.13 H new ATOM 1293 N LEU A 87 18.563 34.909 -6.696 1.00 15.23 N ATOM 1294 CA LEU A 87 17.164 35.257 -6.924 1.00 44.14 C ATOM 1295 C LEU A 87 16.512 35.763 -5.642 1.00 3.32 C ATOM 1296 O LEU A 87 16.006 36.885 -5.592 1.00 73.52 O ATOM 1297 CB LEU A 87 16.397 34.045 -7.456 1.00 42.21 C ATOM 1298 CG LEU A 87 15.264 34.346 -8.437 1.00 53.04 C ATOM 1299 CD1 LEU A 87 15.801 35.049 -9.674 1.00 50.22 C ATOM 1300 CD2 LEU A 87 14.538 33.065 -8.823 1.00 11.33 C ATOM 0 H LEU A 87 18.761 33.909 -6.738 1.00 15.23 H new ATOM 0 HA LEU A 87 17.130 36.055 -7.666 1.00 44.14 H new ATOM 0 HB2 LEU A 87 17.106 33.377 -7.945 1.00 42.21 H new ATOM 0 HB3 LEU A 87 15.981 33.502 -6.607 1.00 42.21 H new ATOM 0 HG LEU A 87 14.552 35.010 -7.947 1.00 53.04 H new ATOM 0 HD11 LEU A 87 14.980 35.255 -10.361 1.00 50.22 H new ATOM 0 HD12 LEU A 87 16.275 35.987 -9.383 1.00 50.22 H new ATOM 0 HD13 LEU A 87 16.534 34.410 -10.166 1.00 50.22 H new ATOM 0 HD21 LEU A 87 13.735 33.298 -9.522 1.00 11.33 H new ATOM 0 HD22 LEU A 87 15.240 32.377 -9.294 1.00 11.33 H new ATOM 0 HD23 LEU A 87 14.119 32.601 -7.930 1.00 11.33 H new ATOM 1312 N ILE A 88 16.531 34.931 -4.606 1.00 72.34 N ATOM 1313 CA ILE A 88 15.944 35.296 -3.323 1.00 24.42 C ATOM 1314 C ILE A 88 16.484 36.635 -2.833 1.00 25.25 C ATOM 1315 O ILE A 88 15.782 37.391 -2.163 1.00 41.12 O ATOM 1316 CB ILE A 88 16.218 34.222 -2.253 1.00 61.23 C ATOM 1317 CG1 ILE A 88 15.693 32.862 -2.718 1.00 54.12 C ATOM 1318 CG2 ILE A 88 15.580 34.618 -0.930 1.00 24.21 C ATOM 1319 CD1 ILE A 88 14.190 32.821 -2.890 1.00 3.50 C ATOM 0 H ILE A 88 16.947 34.000 -4.630 1.00 72.34 H new ATOM 0 HA ILE A 88 14.868 35.376 -3.479 1.00 24.42 H new ATOM 0 HB ILE A 88 17.295 34.143 -2.106 1.00 61.23 H new ATOM 0 HG12 ILE A 88 16.166 32.603 -3.665 1.00 54.12 H new ATOM 0 HG13 ILE A 88 15.989 32.101 -1.996 1.00 54.12 H new ATOM 0 HG21 ILE A 88 15.782 33.849 -0.184 1.00 24.21 H new ATOM 0 HG22 ILE A 88 15.997 35.568 -0.595 1.00 24.21 H new ATOM 0 HG23 ILE A 88 14.503 34.721 -1.062 1.00 24.21 H new ATOM 0 HD11 ILE A 88 13.889 31.827 -3.221 1.00 3.50 H new ATOM 0 HD12 ILE A 88 13.709 33.048 -1.939 1.00 3.50 H new ATOM 0 HD13 ILE A 88 13.889 33.558 -3.634 1.00 3.50 H new ATOM 1331 N ASN A 89 17.737 36.922 -3.172 1.00 71.34 N ATOM 1332 CA ASN A 89 18.372 38.171 -2.768 1.00 34.12 C ATOM 1333 C ASN A 89 17.646 39.370 -3.370 1.00 73.15 C ATOM 1334 O ASN A 89 17.222 40.278 -2.655 1.00 31.44 O ATOM 1335 CB ASN A 89 19.841 38.182 -3.195 1.00 13.51 C ATOM 1336 CG ASN A 89 20.762 37.656 -2.111 1.00 70.15 C ATOM 1337 OD1 ASN A 89 20.661 38.050 -0.950 1.00 12.04 O ATOM 1338 ND2 ASN A 89 21.667 36.760 -2.488 1.00 41.35 N ATOM 0 H ASN A 89 18.333 36.306 -3.726 1.00 71.34 H new ATOM 0 HA ASN A 89 18.316 38.243 -1.682 1.00 34.12 H new ATOM 0 HB2 ASN A 89 19.960 37.577 -4.094 1.00 13.51 H new ATOM 0 HB3 ASN A 89 20.134 39.199 -3.454 1.00 13.51 H new ATOM 0 HD21 ASN A 89 22.314 36.370 -1.803 1.00 41.35 H new ATOM 0 HD22 ASN A 89 21.715 36.462 -3.462 1.00 41.35 H new ATOM 1345 N LYS A 90 17.505 39.367 -4.692 1.00 23.43 N ATOM 1346 CA LYS A 90 16.829 40.452 -5.393 1.00 23.15 C ATOM 1347 C LYS A 90 15.459 40.724 -4.781 1.00 10.55 C ATOM 1348 O LYS A 90 15.125 41.867 -4.467 1.00 23.32 O ATOM 1349 CB LYS A 90 16.678 40.112 -6.877 1.00 22.00 C ATOM 1350 CG LYS A 90 18.001 39.866 -7.582 1.00 73.32 C ATOM 1351 CD LYS A 90 18.345 41.000 -8.533 1.00 62.42 C ATOM 1352 CE LYS A 90 19.127 42.098 -7.830 1.00 44.41 C ATOM 1353 NZ LYS A 90 20.563 41.738 -7.664 1.00 34.04 N ATOM 0 H LYS A 90 17.851 38.624 -5.299 1.00 23.43 H new ATOM 0 HA LYS A 90 17.437 41.351 -5.293 1.00 23.15 H new ATOM 0 HB2 LYS A 90 16.053 39.225 -6.976 1.00 22.00 H new ATOM 0 HB3 LYS A 90 16.156 40.928 -7.377 1.00 22.00 H new ATOM 0 HG2 LYS A 90 18.794 39.757 -6.842 1.00 73.32 H new ATOM 0 HG3 LYS A 90 17.951 38.928 -8.135 1.00 73.32 H new ATOM 0 HD2 LYS A 90 18.930 40.612 -9.367 1.00 62.42 H new ATOM 0 HD3 LYS A 90 17.429 41.416 -8.952 1.00 62.42 H new ATOM 0 HE2 LYS A 90 19.048 43.023 -8.402 1.00 44.41 H new ATOM 0 HE3 LYS A 90 18.685 42.289 -6.852 1.00 44.41 H new ATOM 0 HZ1 LYS A 90 21.061 42.512 -7.181 1.00 34.04 H new ATOM 0 HZ2 LYS A 90 20.640 40.870 -7.097 1.00 34.04 H new ATOM 0 HZ3 LYS A 90 20.992 41.580 -8.598 1.00 34.04 H new ATOM 1367 N MET A 91 14.670 39.668 -4.612 1.00 42.15 N ATOM 1368 CA MET A 91 13.337 39.794 -4.035 1.00 40.51 C ATOM 1369 C MET A 91 13.414 40.283 -2.592 1.00 34.50 C ATOM 1370 O MET A 91 12.667 41.174 -2.187 1.00 23.14 O ATOM 1371 CB MET A 91 12.603 38.453 -4.094 1.00 3.30 C ATOM 1372 CG MET A 91 12.251 38.015 -5.506 1.00 62.32 C ATOM 1373 SD MET A 91 10.543 38.391 -5.945 1.00 22.12 S ATOM 1374 CE MET A 91 9.709 36.924 -5.345 1.00 34.00 C ATOM 0 H MET A 91 14.931 38.715 -4.867 1.00 42.15 H new ATOM 0 HA MET A 91 12.783 40.528 -4.620 1.00 40.51 H new ATOM 0 HB2 MET A 91 13.224 37.687 -3.629 1.00 3.30 H new ATOM 0 HB3 MET A 91 11.688 38.522 -3.505 1.00 3.30 H new ATOM 0 HG2 MET A 91 12.920 38.507 -6.212 1.00 62.32 H new ATOM 0 HG3 MET A 91 12.419 36.942 -5.602 1.00 62.32 H new ATOM 0 HE1 MET A 91 9.039 36.545 -6.117 1.00 34.00 H new ATOM 0 HE2 MET A 91 10.447 36.161 -5.099 1.00 34.00 H new ATOM 0 HE3 MET A 91 9.133 37.172 -4.454 1.00 34.00 H new ATOM 1384 N LYS A 92 14.320 39.693 -1.820 1.00 21.20 N ATOM 1385 CA LYS A 92 14.495 40.068 -0.422 1.00 24.52 C ATOM 1386 C LYS A 92 14.879 41.539 -0.297 1.00 31.41 C ATOM 1387 O LYS A 92 14.627 42.171 0.730 1.00 45.22 O ATOM 1388 CB LYS A 92 15.568 39.193 0.231 1.00 32.34 C ATOM 1389 CG LYS A 92 15.020 37.918 0.849 1.00 73.22 C ATOM 1390 CD LYS A 92 15.950 37.372 1.919 1.00 13.03 C ATOM 1391 CE LYS A 92 15.806 38.138 3.225 1.00 4.24 C ATOM 1392 NZ LYS A 92 14.725 37.577 4.082 1.00 41.21 N ATOM 0 H LYS A 92 14.945 38.953 -2.139 1.00 21.20 H new ATOM 0 HA LYS A 92 13.546 39.914 0.091 1.00 24.52 H new ATOM 0 HB2 LYS A 92 16.317 38.932 -0.517 1.00 32.34 H new ATOM 0 HB3 LYS A 92 16.077 39.771 1.002 1.00 32.34 H new ATOM 0 HG2 LYS A 92 14.040 38.115 1.284 1.00 73.22 H new ATOM 0 HG3 LYS A 92 14.878 37.167 0.071 1.00 73.22 H new ATOM 0 HD2 LYS A 92 15.732 36.317 2.088 1.00 13.03 H new ATOM 0 HD3 LYS A 92 16.981 37.433 1.572 1.00 13.03 H new ATOM 0 HE2 LYS A 92 16.751 38.110 3.768 1.00 4.24 H new ATOM 0 HE3 LYS A 92 15.592 39.185 3.010 1.00 4.24 H new ATOM 0 HZ1 LYS A 92 14.005 38.307 4.255 1.00 41.21 H new ATOM 0 HZ2 LYS A 92 14.287 36.765 3.601 1.00 41.21 H new ATOM 0 HZ3 LYS A 92 15.127 37.266 4.989 1.00 41.21 H new ATOM 1406 N LEU A 93 15.487 42.078 -1.348 1.00 20.05 N ATOM 1407 CA LEU A 93 15.904 43.476 -1.356 1.00 32.00 C ATOM 1408 C LEU A 93 14.708 44.400 -1.562 1.00 75.41 C ATOM 1409 O LEU A 93 14.489 45.331 -0.788 1.00 30.43 O ATOM 1410 CB LEU A 93 16.941 43.713 -2.455 1.00 71.22 C ATOM 1411 CG LEU A 93 18.320 43.094 -2.222 1.00 13.44 C ATOM 1412 CD1 LEU A 93 18.907 42.589 -3.530 1.00 74.13 C ATOM 1413 CD2 LEU A 93 19.254 44.104 -1.571 1.00 12.21 C ATOM 0 H LEU A 93 15.702 41.569 -2.205 1.00 20.05 H new ATOM 0 HA LEU A 93 16.351 43.701 -0.388 1.00 32.00 H new ATOM 0 HB2 LEU A 93 16.543 43.323 -3.392 1.00 71.22 H new ATOM 0 HB3 LEU A 93 17.065 44.788 -2.584 1.00 71.22 H new ATOM 0 HG LEU A 93 18.207 42.245 -1.547 1.00 13.44 H new ATOM 0 HD11 LEU A 93 19.888 42.152 -3.344 1.00 74.13 H new ATOM 0 HD12 LEU A 93 18.248 41.833 -3.957 1.00 74.13 H new ATOM 0 HD13 LEU A 93 19.006 43.420 -4.229 1.00 74.13 H new ATOM 0 HD21 LEU A 93 20.231 43.647 -1.412 1.00 12.21 H new ATOM 0 HD22 LEU A 93 19.361 44.972 -2.221 1.00 12.21 H new ATOM 0 HD23 LEU A 93 18.840 44.417 -0.613 1.00 12.21 H new ATOM 1425 N ALA A 94 13.935 44.134 -2.610 1.00 70.33 N ATOM 1426 CA ALA A 94 12.758 44.938 -2.916 1.00 4.13 C ATOM 1427 C ALA A 94 11.825 45.024 -1.713 1.00 11.20 C ATOM 1428 O ALA A 94 11.076 45.989 -1.566 1.00 12.40 O ATOM 1429 CB ALA A 94 12.023 44.363 -4.117 1.00 31.31 C ATOM 0 H ALA A 94 14.103 43.367 -3.262 1.00 70.33 H new ATOM 0 HA ALA A 94 13.091 45.947 -3.158 1.00 4.13 H new ATOM 0 HB1 ALA A 94 11.146 44.974 -4.334 1.00 31.31 H new ATOM 0 HB2 ALA A 94 12.686 44.360 -4.982 1.00 31.31 H new ATOM 0 HB3 ALA A 94 11.709 43.343 -3.897 1.00 31.31 H new ATOM 1435 N GLN A 95 11.875 44.009 -0.857 1.00 5.03 N ATOM 1436 CA GLN A 95 11.032 43.971 0.332 1.00 25.35 C ATOM 1437 C GLN A 95 11.427 45.069 1.315 1.00 73.32 C ATOM 1438 O GLN A 95 10.583 45.600 2.037 1.00 63.14 O ATOM 1439 CB GLN A 95 11.133 42.603 1.011 1.00 52.24 C ATOM 1440 CG GLN A 95 10.509 42.564 2.396 1.00 35.11 C ATOM 1441 CD GLN A 95 9.627 41.348 2.605 1.00 5.10 C ATOM 1442 OE1 GLN A 95 9.917 40.494 3.443 1.00 23.31 O ATOM 1443 NE2 GLN A 95 8.544 41.264 1.842 1.00 31.31 N ATOM 0 H GLN A 95 12.490 43.202 -0.964 1.00 5.03 H new ATOM 0 HA GLN A 95 10.001 44.140 0.021 1.00 25.35 H new ATOM 0 HB2 GLN A 95 10.647 41.857 0.382 1.00 52.24 H new ATOM 0 HB3 GLN A 95 12.183 42.321 1.087 1.00 52.24 H new ATOM 0 HG2 GLN A 95 11.299 42.568 3.147 1.00 35.11 H new ATOM 0 HG3 GLN A 95 9.918 43.467 2.550 1.00 35.11 H new ATOM 0 HE21 GLN A 95 8.343 41.995 1.160 1.00 31.31 H new ATOM 0 HE22 GLN A 95 7.913 40.468 1.938 1.00 31.31 H new ATOM 1452 N GLN A 96 12.713 45.403 1.336 1.00 31.23 N ATOM 1453 CA GLN A 96 13.218 46.437 2.231 1.00 1.14 C ATOM 1454 C GLN A 96 13.364 47.767 1.499 1.00 65.20 C ATOM 1455 O GLN A 96 13.354 48.832 2.117 1.00 72.31 O ATOM 1456 CB GLN A 96 14.565 46.016 2.823 1.00 55.22 C ATOM 1457 CG GLN A 96 15.675 45.905 1.790 1.00 35.32 C ATOM 1458 CD GLN A 96 17.055 45.883 2.417 1.00 53.41 C ATOM 1459 OE1 GLN A 96 17.795 44.909 2.283 1.00 61.32 O ATOM 1460 NE2 GLN A 96 17.409 46.962 3.106 1.00 32.44 N ATOM 0 H GLN A 96 13.424 44.973 0.744 1.00 31.23 H new ATOM 0 HA GLN A 96 12.498 46.565 3.039 1.00 1.14 H new ATOM 0 HB2 GLN A 96 14.859 46.738 3.585 1.00 55.22 H new ATOM 0 HB3 GLN A 96 14.448 45.055 3.323 1.00 55.22 H new ATOM 0 HG2 GLN A 96 15.532 44.997 1.204 1.00 35.32 H new ATOM 0 HG3 GLN A 96 15.608 46.745 1.098 1.00 35.32 H new ATOM 0 HE21 GLN A 96 16.763 47.747 3.191 1.00 32.44 H new ATOM 0 HE22 GLN A 96 18.326 47.006 3.550 1.00 32.44 H new ATOM 1469 N TYR A 97 13.501 47.698 0.180 1.00 64.24 N ATOM 1470 CA TYR A 97 13.653 48.896 -0.637 1.00 11.31 C ATOM 1471 C TYR A 97 12.308 49.343 -1.203 1.00 5.42 C ATOM 1472 O TYR A 97 12.230 49.846 -2.324 1.00 34.11 O ATOM 1473 CB TYR A 97 14.639 48.640 -1.778 1.00 3.44 C ATOM 1474 CG TYR A 97 16.088 48.762 -1.364 1.00 4.43 C ATOM 1475 CD1 TYR A 97 16.719 50.000 -1.326 1.00 62.35 C ATOM 1476 CD2 TYR A 97 16.827 47.640 -1.009 1.00 34.11 C ATOM 1477 CE1 TYR A 97 18.043 50.115 -0.950 1.00 1.53 C ATOM 1478 CE2 TYR A 97 18.151 47.746 -0.629 1.00 53.44 C ATOM 1479 CZ TYR A 97 18.755 48.986 -0.602 1.00 14.21 C ATOM 1480 OH TYR A 97 20.073 49.098 -0.225 1.00 22.53 O ATOM 0 H TYR A 97 13.510 46.825 -0.347 1.00 64.24 H new ATOM 0 HA TYR A 97 14.042 49.691 -0.001 1.00 11.31 H new ATOM 0 HB2 TYR A 97 14.467 47.641 -2.178 1.00 3.44 H new ATOM 0 HB3 TYR A 97 14.440 49.345 -2.585 1.00 3.44 H new ATOM 0 HD1 TYR A 97 16.165 50.887 -1.595 1.00 62.35 H new ATOM 0 HD2 TYR A 97 16.358 46.667 -1.031 1.00 34.11 H new ATOM 0 HE1 TYR A 97 18.519 51.084 -0.929 1.00 1.53 H new ATOM 0 HE2 TYR A 97 18.710 46.863 -0.355 1.00 53.44 H new ATOM 0 HH TYR A 97 20.429 48.210 -0.011 1.00 22.53 H new ATOM 1490 N VAL A 98 11.252 49.157 -0.418 1.00 11.11 N ATOM 1491 CA VAL A 98 9.910 49.542 -0.838 1.00 50.22 C ATOM 1492 C VAL A 98 9.438 50.788 -0.097 1.00 21.24 C ATOM 1493 O VAL A 98 8.741 51.631 -0.660 1.00 42.22 O ATOM 1494 CB VAL A 98 8.900 48.404 -0.602 1.00 34.10 C ATOM 1495 CG1 VAL A 98 8.946 47.940 0.846 1.00 42.20 C ATOM 1496 CG2 VAL A 98 7.496 48.850 -0.982 1.00 40.55 C ATOM 0 H VAL A 98 11.300 48.742 0.513 1.00 11.11 H new ATOM 0 HA VAL A 98 9.962 49.756 -1.906 1.00 50.22 H new ATOM 0 HB VAL A 98 9.174 47.562 -1.238 1.00 34.10 H new ATOM 0 HG11 VAL A 98 8.225 47.136 0.993 1.00 42.20 H new ATOM 0 HG12 VAL A 98 9.947 47.578 1.080 1.00 42.20 H new ATOM 0 HG13 VAL A 98 8.699 48.774 1.503 1.00 42.20 H new ATOM 0 HG21 VAL A 98 6.795 48.033 -0.809 1.00 40.55 H new ATOM 0 HG22 VAL A 98 7.210 49.708 -0.374 1.00 40.55 H new ATOM 0 HG23 VAL A 98 7.475 49.128 -2.036 1.00 40.55 H new ATOM 1506 N MET A 99 9.823 50.897 1.171 1.00 63.24 N ATOM 1507 CA MET A 99 9.441 52.041 1.990 1.00 52.35 C ATOM 1508 C MET A 99 10.253 53.276 1.612 1.00 60.14 C ATOM 1509 O MET A 99 9.877 54.403 1.936 1.00 72.13 O ATOM 1510 CB MET A 99 9.636 51.722 3.473 1.00 43.21 C ATOM 1511 CG MET A 99 8.824 52.614 4.398 1.00 22.44 C ATOM 1512 SD MET A 99 9.838 53.418 5.654 1.00 60.00 S ATOM 1513 CE MET A 99 10.979 54.341 4.627 1.00 2.04 C ATOM 0 H MET A 99 10.399 50.207 1.653 1.00 63.24 H new ATOM 0 HA MET A 99 8.387 52.251 1.807 1.00 52.35 H new ATOM 0 HB2 MET A 99 9.362 50.682 3.652 1.00 43.21 H new ATOM 0 HB3 MET A 99 10.693 51.821 3.722 1.00 43.21 H new ATOM 0 HG2 MET A 99 8.313 53.375 3.807 1.00 22.44 H new ATOM 0 HG3 MET A 99 8.053 52.018 4.886 1.00 22.44 H new ATOM 0 HE1 MET A 99 11.662 54.907 5.260 1.00 2.04 H new ATOM 0 HE2 MET A 99 11.549 53.651 4.005 1.00 2.04 H new ATOM 0 HE3 MET A 99 10.421 55.028 3.990 1.00 2.04 H new ATOM 1523 N THR A 100 11.370 53.057 0.924 1.00 32.34 N ATOM 1524 CA THR A 100 12.236 54.151 0.504 1.00 73.01 C ATOM 1525 C THR A 100 11.733 54.784 -0.788 1.00 40.53 C ATOM 1526 O THR A 100 11.159 55.873 -0.775 1.00 2.43 O ATOM 1527 CB THR A 100 13.685 53.673 0.298 1.00 64.11 C ATOM 1528 OG1 THR A 100 14.216 53.173 1.530 1.00 3.13 O ATOM 1529 CG2 THR A 100 14.561 54.806 -0.215 1.00 2.10 C ATOM 0 H THR A 100 11.696 52.131 0.646 1.00 32.34 H new ATOM 0 HA THR A 100 12.217 54.894 1.301 1.00 73.01 H new ATOM 0 HB THR A 100 13.679 52.875 -0.445 1.00 64.11 H new ATOM 0 HG1 THR A 100 15.137 52.869 1.390 1.00 3.13 H new ATOM 0 HG21 THR A 100 15.580 54.444 -0.353 1.00 2.10 H new ATOM 0 HG22 THR A 100 14.171 55.165 -1.168 1.00 2.10 H new ATOM 0 HG23 THR A 100 14.560 55.622 0.507 1.00 2.10 H new ATOM 1537 N SER A 101 11.952 54.095 -1.904 1.00 14.52 N ATOM 1538 CA SER A 101 11.523 54.593 -3.206 1.00 21.12 C ATOM 1539 C SER A 101 11.936 53.632 -4.317 1.00 14.30 C ATOM 1540 O SER A 101 11.237 53.489 -5.321 1.00 72.11 O ATOM 1541 CB SER A 101 12.117 55.978 -3.467 1.00 5.20 C ATOM 1542 OG SER A 101 13.353 56.139 -2.792 1.00 21.51 O ATOM 0 H SER A 101 12.424 53.191 -1.933 1.00 14.52 H new ATOM 0 HA SER A 101 10.436 54.668 -3.199 1.00 21.12 H new ATOM 0 HB2 SER A 101 12.263 56.118 -4.538 1.00 5.20 H new ATOM 0 HB3 SER A 101 11.417 56.745 -3.138 1.00 5.20 H new ATOM 0 HG SER A 101 13.987 55.461 -3.105 1.00 21.51 H new ATOM 1548 N LEU A 102 13.075 52.976 -4.130 1.00 45.30 N ATOM 1549 CA LEU A 102 13.583 52.028 -5.116 1.00 2.23 C ATOM 1550 C LEU A 102 12.798 50.721 -5.069 1.00 3.22 C ATOM 1551 O LEU A 102 13.328 49.683 -4.674 1.00 73.32 O ATOM 1552 CB LEU A 102 15.068 51.754 -4.871 1.00 30.32 C ATOM 1553 CG LEU A 102 15.908 52.953 -4.429 1.00 63.45 C ATOM 1554 CD1 LEU A 102 17.377 52.570 -4.339 1.00 4.32 C ATOM 1555 CD2 LEU A 102 15.717 54.119 -5.387 1.00 41.54 C ATOM 0 H LEU A 102 13.665 53.083 -3.305 1.00 45.30 H new ATOM 0 HA LEU A 102 13.460 52.469 -6.105 1.00 2.23 H new ATOM 0 HB2 LEU A 102 15.153 50.977 -4.112 1.00 30.32 H new ATOM 0 HB3 LEU A 102 15.499 51.352 -5.788 1.00 30.32 H new ATOM 0 HG LEU A 102 15.573 53.263 -3.439 1.00 63.45 H new ATOM 0 HD11 LEU A 102 17.960 53.435 -4.023 1.00 4.32 H new ATOM 0 HD12 LEU A 102 17.500 51.766 -3.614 1.00 4.32 H new ATOM 0 HD13 LEU A 102 17.726 52.234 -5.316 1.00 4.32 H new ATOM 0 HD21 LEU A 102 16.322 54.964 -5.057 1.00 41.54 H new ATOM 0 HD22 LEU A 102 16.025 53.821 -6.389 1.00 41.54 H new ATOM 0 HD23 LEU A 102 14.666 54.409 -5.402 1.00 41.54 H new ATOM 1567 N GLN A 103 11.534 50.781 -5.476 1.00 25.10 N ATOM 1568 CA GLN A 103 10.678 49.601 -5.481 1.00 54.25 C ATOM 1569 C GLN A 103 10.659 48.948 -6.860 1.00 11.43 C ATOM 1570 O GLN A 103 11.257 47.893 -7.064 1.00 60.42 O ATOM 1571 CB GLN A 103 9.255 49.976 -5.062 1.00 41.13 C ATOM 1572 CG GLN A 103 8.226 48.901 -5.372 1.00 62.14 C ATOM 1573 CD GLN A 103 7.273 48.655 -4.219 1.00 51.44 C ATOM 1574 OE1 GLN A 103 7.296 47.595 -3.595 1.00 22.43 O ATOM 1575 NE2 GLN A 103 6.427 49.638 -3.931 1.00 23.33 N ATOM 0 H GLN A 103 11.081 51.633 -5.806 1.00 25.10 H new ATOM 0 HA GLN A 103 11.084 48.886 -4.766 1.00 54.25 H new ATOM 0 HB2 GLN A 103 9.243 50.181 -3.992 1.00 41.13 H new ATOM 0 HB3 GLN A 103 8.968 50.898 -5.567 1.00 41.13 H new ATOM 0 HG2 GLN A 103 7.656 49.193 -6.254 1.00 62.14 H new ATOM 0 HG3 GLN A 103 8.740 47.972 -5.618 1.00 62.14 H new ATOM 0 HE21 GLN A 103 6.443 50.501 -4.475 1.00 23.33 H new ATOM 0 HE22 GLN A 103 5.761 49.530 -3.166 1.00 23.33 H new ATOM 1584 N GLN A 104 9.968 49.584 -7.801 1.00 22.03 N ATOM 1585 CA GLN A 104 9.871 49.064 -9.159 1.00 62.53 C ATOM 1586 C GLN A 104 11.254 48.758 -9.725 1.00 61.12 C ATOM 1587 O GLN A 104 11.442 47.765 -10.427 1.00 74.21 O ATOM 1588 CB GLN A 104 9.148 50.065 -10.061 1.00 40.24 C ATOM 1589 CG GLN A 104 7.841 50.576 -9.478 1.00 33.03 C ATOM 1590 CD GLN A 104 7.964 51.975 -8.906 1.00 72.40 C ATOM 1591 OE1 GLN A 104 8.489 52.879 -9.556 1.00 13.42 O ATOM 1592 NE2 GLN A 104 7.479 52.160 -7.684 1.00 20.33 N ATOM 0 H GLN A 104 9.468 50.459 -7.647 1.00 22.03 H new ATOM 0 HA GLN A 104 9.299 48.137 -9.126 1.00 62.53 H new ATOM 0 HB2 GLN A 104 9.807 50.912 -10.251 1.00 40.24 H new ATOM 0 HB3 GLN A 104 8.947 49.595 -11.024 1.00 40.24 H new ATOM 0 HG2 GLN A 104 7.075 50.571 -10.254 1.00 33.03 H new ATOM 0 HG3 GLN A 104 7.506 49.896 -8.695 1.00 33.03 H new ATOM 0 HE21 GLN A 104 7.052 51.382 -7.182 1.00 20.33 H new ATOM 0 HE22 GLN A 104 7.533 53.080 -7.248 1.00 20.33 H new ATOM 1601 N GLU A 105 12.219 49.619 -9.415 1.00 34.51 N ATOM 1602 CA GLU A 105 13.584 49.440 -9.894 1.00 61.12 C ATOM 1603 C GLU A 105 14.088 48.032 -9.590 1.00 73.22 C ATOM 1604 O GLU A 105 14.417 47.269 -10.499 1.00 32.12 O ATOM 1605 CB GLU A 105 14.512 50.475 -9.254 1.00 63.55 C ATOM 1606 CG GLU A 105 14.642 51.756 -10.060 1.00 1.40 C ATOM 1607 CD GLU A 105 16.058 52.299 -10.069 1.00 61.32 C ATOM 1608 OE1 GLU A 105 16.801 52.033 -9.101 1.00 14.43 O ATOM 1609 OE2 GLU A 105 16.424 52.988 -11.044 1.00 14.20 O ATOM 0 H GLU A 105 12.080 50.446 -8.835 1.00 34.51 H new ATOM 0 HA GLU A 105 13.584 49.581 -10.975 1.00 61.12 H new ATOM 0 HB2 GLU A 105 14.140 50.718 -8.259 1.00 63.55 H new ATOM 0 HB3 GLU A 105 15.501 50.034 -9.126 1.00 63.55 H new ATOM 0 HG2 GLU A 105 14.322 51.570 -11.085 1.00 1.40 H new ATOM 0 HG3 GLU A 105 13.971 52.510 -9.648 1.00 1.40 H new ATOM 1616 N TYR A 106 14.145 47.695 -8.307 1.00 3.14 N ATOM 1617 CA TYR A 106 14.611 46.381 -7.882 1.00 24.55 C ATOM 1618 C TYR A 106 13.846 45.273 -8.599 1.00 62.22 C ATOM 1619 O TYR A 106 14.373 44.183 -8.825 1.00 40.23 O ATOM 1620 CB TYR A 106 14.455 46.226 -6.368 1.00 31.42 C ATOM 1621 CG TYR A 106 15.747 46.406 -5.604 1.00 23.51 C ATOM 1622 CD1 TYR A 106 16.717 45.411 -5.596 1.00 30.41 C ATOM 1623 CD2 TYR A 106 15.999 47.571 -4.891 1.00 0.31 C ATOM 1624 CE1 TYR A 106 17.899 45.570 -4.899 1.00 13.54 C ATOM 1625 CE2 TYR A 106 17.179 47.741 -4.192 1.00 34.51 C ATOM 1626 CZ TYR A 106 18.125 46.737 -4.198 1.00 40.15 C ATOM 1627 OH TYR A 106 19.302 46.901 -3.504 1.00 34.12 O ATOM 0 H TYR A 106 13.874 48.314 -7.543 1.00 3.14 H new ATOM 0 HA TYR A 106 15.666 46.297 -8.143 1.00 24.55 H new ATOM 0 HB2 TYR A 106 13.727 46.954 -6.010 1.00 31.42 H new ATOM 0 HB3 TYR A 106 14.050 45.237 -6.152 1.00 31.42 H new ATOM 0 HD1 TYR A 106 16.544 44.497 -6.145 1.00 30.41 H new ATOM 0 HD2 TYR A 106 15.260 48.358 -4.883 1.00 0.31 H new ATOM 0 HE1 TYR A 106 18.642 44.786 -4.903 1.00 13.54 H new ATOM 0 HE2 TYR A 106 17.359 48.654 -3.644 1.00 34.51 H new ATOM 0 HH TYR A 106 19.104 47.159 -2.580 1.00 34.12 H new ATOM 1637 N LYS A 107 12.599 45.560 -8.956 1.00 71.00 N ATOM 1638 CA LYS A 107 11.759 44.591 -9.650 1.00 51.21 C ATOM 1639 C LYS A 107 12.206 44.422 -11.099 1.00 3.15 C ATOM 1640 O LYS A 107 12.135 43.327 -11.658 1.00 2.44 O ATOM 1641 CB LYS A 107 10.294 45.031 -9.606 1.00 11.32 C ATOM 1642 CG LYS A 107 9.710 45.342 -10.973 1.00 45.13 C ATOM 1643 CD LYS A 107 8.305 45.909 -10.864 1.00 71.12 C ATOM 1644 CE LYS A 107 7.755 46.302 -12.227 1.00 30.41 C ATOM 1645 NZ LYS A 107 8.126 47.696 -12.594 1.00 3.32 N ATOM 0 H LYS A 107 12.147 46.457 -8.776 1.00 71.00 H new ATOM 0 HA LYS A 107 11.860 43.632 -9.143 1.00 51.21 H new ATOM 0 HB2 LYS A 107 9.701 44.245 -9.138 1.00 11.32 H new ATOM 0 HB3 LYS A 107 10.208 45.915 -8.974 1.00 11.32 H new ATOM 0 HG2 LYS A 107 10.352 46.055 -11.490 1.00 45.13 H new ATOM 0 HG3 LYS A 107 9.691 44.434 -11.576 1.00 45.13 H new ATOM 0 HD2 LYS A 107 7.648 45.170 -10.405 1.00 71.12 H new ATOM 0 HD3 LYS A 107 8.313 46.780 -10.209 1.00 71.12 H new ATOM 0 HE2 LYS A 107 8.134 45.614 -12.983 1.00 30.41 H new ATOM 0 HE3 LYS A 107 6.669 46.204 -12.222 1.00 30.41 H new ATOM 0 HZ1 LYS A 107 7.821 47.891 -13.569 1.00 3.32 H new ATOM 0 HZ2 LYS A 107 7.660 48.362 -11.945 1.00 3.32 H new ATOM 0 HZ3 LYS A 107 9.157 47.810 -12.525 1.00 3.32 H new ATOM 1659 N LYS A 108 12.669 45.512 -11.701 1.00 53.22 N ATOM 1660 CA LYS A 108 13.131 45.485 -13.084 1.00 32.01 C ATOM 1661 C LYS A 108 14.296 44.514 -13.249 1.00 54.12 C ATOM 1662 O LYS A 108 14.186 43.515 -13.960 1.00 12.24 O ATOM 1663 CB LYS A 108 13.554 46.887 -13.529 1.00 61.55 C ATOM 1664 CG LYS A 108 12.417 47.893 -13.532 1.00 52.23 C ATOM 1665 CD LYS A 108 11.789 48.021 -14.910 1.00 51.31 C ATOM 1666 CE LYS A 108 10.565 48.923 -14.883 1.00 15.30 C ATOM 1667 NZ LYS A 108 9.469 48.397 -15.743 1.00 35.22 N ATOM 0 H LYS A 108 12.734 46.426 -11.253 1.00 53.22 H new ATOM 0 HA LYS A 108 12.306 45.145 -13.710 1.00 32.01 H new ATOM 0 HB2 LYS A 108 14.344 47.246 -12.869 1.00 61.55 H new ATOM 0 HB3 LYS A 108 13.979 46.828 -14.531 1.00 61.55 H new ATOM 0 HG2 LYS A 108 11.658 47.587 -12.812 1.00 52.23 H new ATOM 0 HG3 LYS A 108 12.789 48.865 -13.209 1.00 52.23 H new ATOM 0 HD2 LYS A 108 12.522 48.422 -15.609 1.00 51.31 H new ATOM 0 HD3 LYS A 108 11.507 47.034 -15.276 1.00 51.31 H new ATOM 0 HE2 LYS A 108 10.208 49.019 -13.858 1.00 15.30 H new ATOM 0 HE3 LYS A 108 10.843 49.922 -15.219 1.00 15.30 H new ATOM 0 HZ1 LYS A 108 8.653 49.040 -15.697 1.00 35.22 H new ATOM 0 HZ2 LYS A 108 9.801 48.329 -16.726 1.00 35.22 H new ATOM 0 HZ3 LYS A 108 9.186 47.454 -15.407 1.00 35.22 H new ATOM 1681 N GLN A 109 15.409 44.814 -12.588 1.00 13.21 N ATOM 1682 CA GLN A 109 16.593 43.967 -12.662 1.00 32.40 C ATOM 1683 C GLN A 109 16.248 42.520 -12.325 1.00 24.41 C ATOM 1684 O GLN A 109 16.763 41.589 -12.944 1.00 74.22 O ATOM 1685 CB GLN A 109 17.674 44.481 -11.710 1.00 64.24 C ATOM 1686 CG GLN A 109 17.166 44.758 -10.305 1.00 24.03 C ATOM 1687 CD GLN A 109 17.470 46.169 -9.842 1.00 54.42 C ATOM 1688 OE1 GLN A 109 17.989 46.378 -8.745 1.00 61.54 O ATOM 1689 NE2 GLN A 109 17.146 47.149 -10.678 1.00 42.04 N ATOM 0 H GLN A 109 15.516 45.637 -11.995 1.00 13.21 H new ATOM 0 HA GLN A 109 16.972 44.003 -13.683 1.00 32.40 H new ATOM 0 HB2 GLN A 109 18.479 43.748 -11.658 1.00 64.24 H new ATOM 0 HB3 GLN A 109 18.102 45.396 -12.120 1.00 64.24 H new ATOM 0 HG2 GLN A 109 16.089 44.593 -10.273 1.00 24.03 H new ATOM 0 HG3 GLN A 109 17.618 44.047 -9.613 1.00 24.03 H new ATOM 0 HE21 GLN A 109 16.717 46.931 -11.578 1.00 42.04 H new ATOM 0 HE22 GLN A 109 17.326 48.119 -10.420 1.00 42.04 H new ATOM 1698 N MET A 110 15.376 42.339 -11.339 1.00 74.52 N ATOM 1699 CA MET A 110 14.962 41.004 -10.921 1.00 2.14 C ATOM 1700 C MET A 110 14.257 40.272 -12.058 1.00 35.04 C ATOM 1701 O MET A 110 14.528 39.099 -12.317 1.00 60.11 O ATOM 1702 CB MET A 110 14.039 41.091 -9.704 1.00 11.22 C ATOM 1703 CG MET A 110 14.035 39.832 -8.853 1.00 31.14 C ATOM 1704 SD MET A 110 12.468 38.944 -8.934 1.00 32.33 S ATOM 1705 CE MET A 110 13.043 37.260 -9.141 1.00 2.21 C ATOM 0 H MET A 110 14.942 43.099 -10.815 1.00 74.52 H new ATOM 0 HA MET A 110 15.856 40.442 -10.651 1.00 2.14 H new ATOM 0 HB2 MET A 110 14.344 41.936 -9.087 1.00 11.22 H new ATOM 0 HB3 MET A 110 13.023 41.294 -10.043 1.00 11.22 H new ATOM 0 HG2 MET A 110 14.839 39.173 -9.182 1.00 31.14 H new ATOM 0 HG3 MET A 110 14.244 40.098 -7.817 1.00 31.14 H new ATOM 0 HE1 MET A 110 12.310 36.693 -9.714 1.00 2.21 H new ATOM 0 HE2 MET A 110 13.995 37.263 -9.672 1.00 2.21 H new ATOM 0 HE3 MET A 110 13.175 36.798 -8.163 1.00 2.21 H new ATOM 1715 N LEU A 111 13.350 40.970 -12.732 1.00 41.43 N ATOM 1716 CA LEU A 111 12.605 40.386 -13.842 1.00 52.21 C ATOM 1717 C LEU A 111 13.549 39.751 -14.858 1.00 21.14 C ATOM 1718 O LEU A 111 13.295 38.654 -15.357 1.00 42.34 O ATOM 1719 CB LEU A 111 11.747 41.454 -14.524 1.00 62.42 C ATOM 1720 CG LEU A 111 10.239 41.350 -14.295 1.00 10.21 C ATOM 1721 CD1 LEU A 111 9.518 42.517 -14.952 1.00 71.20 C ATOM 1722 CD2 LEU A 111 9.708 40.026 -14.825 1.00 4.11 C ATOM 0 H LEU A 111 13.113 41.941 -12.529 1.00 41.43 H new ATOM 0 HA LEU A 111 11.956 39.608 -13.441 1.00 52.21 H new ATOM 0 HB2 LEU A 111 12.080 42.433 -14.180 1.00 62.42 H new ATOM 0 HB3 LEU A 111 11.935 41.412 -15.597 1.00 62.42 H new ATOM 0 HG LEU A 111 10.051 41.390 -13.222 1.00 10.21 H new ATOM 0 HD11 LEU A 111 8.446 42.426 -14.779 1.00 71.20 H new ATOM 0 HD12 LEU A 111 9.877 43.453 -14.525 1.00 71.20 H new ATOM 0 HD13 LEU A 111 9.714 42.509 -16.024 1.00 71.20 H new ATOM 0 HD21 LEU A 111 8.633 39.970 -14.653 1.00 4.11 H new ATOM 0 HD22 LEU A 111 9.909 39.955 -15.894 1.00 4.11 H new ATOM 0 HD23 LEU A 111 10.201 39.203 -14.308 1.00 4.11 H new ATOM 1734 N THR A 112 14.642 40.446 -15.158 1.00 11.12 N ATOM 1735 CA THR A 112 15.625 39.950 -16.112 1.00 41.14 C ATOM 1736 C THR A 112 16.197 38.609 -15.666 1.00 52.24 C ATOM 1737 O THR A 112 16.043 37.599 -16.352 1.00 54.12 O ATOM 1738 CB THR A 112 16.781 40.951 -16.300 1.00 13.10 C ATOM 1739 OG1 THR A 112 16.310 42.288 -16.094 1.00 34.51 O ATOM 1740 CG2 THR A 112 17.382 40.829 -17.692 1.00 70.10 C ATOM 0 H THR A 112 14.868 41.355 -14.753 1.00 11.12 H new ATOM 0 HA THR A 112 15.106 39.823 -17.062 1.00 41.14 H new ATOM 0 HB THR A 112 17.554 40.721 -15.566 1.00 13.10 H new ATOM 0 HG1 THR A 112 17.051 42.918 -16.214 1.00 34.51 H new ATOM 0 HG21 THR A 112 18.196 41.546 -17.801 1.00 70.10 H new ATOM 0 HG22 THR A 112 17.766 39.819 -17.835 1.00 70.10 H new ATOM 0 HG23 THR A 112 16.615 41.035 -18.439 1.00 70.10 H new ATOM 1748 N ALA A 113 16.857 38.607 -14.513 1.00 32.11 N ATOM 1749 CA ALA A 113 17.449 37.389 -13.974 1.00 61.21 C ATOM 1750 C ALA A 113 16.409 36.281 -13.850 1.00 33.11 C ATOM 1751 O ALA A 113 16.636 35.151 -14.282 1.00 43.52 O ATOM 1752 CB ALA A 113 18.091 37.667 -12.623 1.00 33.12 C ATOM 0 H ALA A 113 16.995 39.435 -13.934 1.00 32.11 H new ATOM 0 HA ALA A 113 18.220 37.052 -14.667 1.00 61.21 H new ATOM 0 HB1 ALA A 113 18.529 36.748 -12.232 1.00 33.12 H new ATOM 0 HB2 ALA A 113 18.870 38.420 -12.739 1.00 33.12 H new ATOM 0 HB3 ALA A 113 17.334 38.032 -11.929 1.00 33.12 H new ATOM 1758 N ALA A 114 15.267 36.612 -13.256 1.00 32.31 N ATOM 1759 CA ALA A 114 14.191 35.645 -13.076 1.00 60.31 C ATOM 1760 C ALA A 114 13.728 35.083 -14.416 1.00 52.42 C ATOM 1761 O ALA A 114 13.402 33.901 -14.526 1.00 72.01 O ATOM 1762 CB ALA A 114 13.024 36.284 -12.338 1.00 4.21 C ATOM 0 H ALA A 114 15.063 37.543 -12.891 1.00 32.31 H new ATOM 0 HA ALA A 114 14.575 34.819 -12.478 1.00 60.31 H new ATOM 0 HB1 ALA A 114 12.228 35.550 -12.211 1.00 4.21 H new ATOM 0 HB2 ALA A 114 13.358 36.630 -11.360 1.00 4.21 H new ATOM 0 HB3 ALA A 114 12.649 37.130 -12.914 1.00 4.21 H new ATOM 1768 N HIS A 115 13.700 35.939 -15.433 1.00 63.13 N ATOM 1769 CA HIS A 115 13.276 35.528 -16.767 1.00 24.41 C ATOM 1770 C HIS A 115 14.068 34.311 -17.237 1.00 75.32 C ATOM 1771 O HIS A 115 13.491 33.284 -17.596 1.00 10.25 O ATOM 1772 CB HIS A 115 13.451 36.678 -17.758 1.00 44.42 C ATOM 1773 CG HIS A 115 12.849 36.408 -19.103 1.00 22.34 C ATOM 1774 ND1 HIS A 115 13.131 37.165 -20.220 1.00 13.53 N ATOM 1775 CD2 HIS A 115 11.977 35.455 -19.506 1.00 71.33 C ATOM 1776 CE1 HIS A 115 12.456 36.691 -21.252 1.00 3.30 C ATOM 1777 NE2 HIS A 115 11.749 35.653 -20.846 1.00 34.42 N ATOM 0 H HIS A 115 13.966 36.921 -15.359 1.00 63.13 H new ATOM 0 HA HIS A 115 12.221 35.258 -16.719 1.00 24.41 H new ATOM 0 HB2 HIS A 115 12.999 37.578 -17.341 1.00 44.42 H new ATOM 0 HB3 HIS A 115 14.515 36.883 -17.880 1.00 44.42 H new ATOM 0 HD2 HIS A 115 11.542 34.683 -18.889 1.00 71.33 H new ATOM 0 HE1 HIS A 115 12.479 37.086 -22.257 1.00 3.30 H new ATOM 0 HE2 HIS A 115 11.133 35.089 -21.432 1.00 34.42 H new ATOM 1785 N ALA A 116 15.391 34.434 -17.234 1.00 32.21 N ATOM 1786 CA ALA A 116 16.260 33.344 -17.659 1.00 24.12 C ATOM 1787 C ALA A 116 16.159 32.157 -16.706 1.00 42.52 C ATOM 1788 O ALA A 116 16.360 31.009 -17.105 1.00 1.34 O ATOM 1789 CB ALA A 116 17.701 33.825 -17.755 1.00 32.22 C ATOM 0 H ALA A 116 15.884 35.278 -16.942 1.00 32.21 H new ATOM 0 HA ALA A 116 15.932 33.014 -18.645 1.00 24.12 H new ATOM 0 HB1 ALA A 116 18.339 33.001 -18.073 1.00 32.22 H new ATOM 0 HB2 ALA A 116 17.766 34.636 -18.481 1.00 32.22 H new ATOM 0 HB3 ALA A 116 18.031 34.183 -16.780 1.00 32.22 H new ATOM 1795 N LEU A 117 15.847 32.441 -15.446 1.00 45.35 N ATOM 1796 CA LEU A 117 15.720 31.397 -14.436 1.00 22.11 C ATOM 1797 C LEU A 117 14.558 30.463 -14.761 1.00 4.42 C ATOM 1798 O LEU A 117 14.753 29.269 -14.983 1.00 34.34 O ATOM 1799 CB LEU A 117 15.518 32.020 -13.053 1.00 73.54 C ATOM 1800 CG LEU A 117 16.551 31.645 -11.991 1.00 22.24 C ATOM 1801 CD1 LEU A 117 16.409 30.182 -11.600 1.00 60.23 C ATOM 1802 CD2 LEU A 117 17.959 31.931 -12.492 1.00 23.42 C ATOM 0 H LEU A 117 15.677 33.385 -15.100 1.00 45.35 H new ATOM 0 HA LEU A 117 16.641 30.814 -14.434 1.00 22.11 H new ATOM 0 HB2 LEU A 117 15.516 33.105 -13.162 1.00 73.54 H new ATOM 0 HB3 LEU A 117 14.531 31.734 -12.688 1.00 73.54 H new ATOM 0 HG LEU A 117 16.371 32.255 -11.106 1.00 22.24 H new ATOM 0 HD11 LEU A 117 17.153 29.934 -10.843 1.00 60.23 H new ATOM 0 HD12 LEU A 117 15.411 30.008 -11.199 1.00 60.23 H new ATOM 0 HD13 LEU A 117 16.561 29.554 -12.478 1.00 60.23 H new ATOM 0 HD21 LEU A 117 18.681 31.658 -11.723 1.00 23.42 H new ATOM 0 HD22 LEU A 117 18.150 31.348 -13.393 1.00 23.42 H new ATOM 0 HD23 LEU A 117 18.055 32.993 -12.720 1.00 23.42 H new ATOM 1814 N ALA A 118 13.351 31.018 -14.789 1.00 72.31 N ATOM 1815 CA ALA A 118 12.158 30.236 -15.091 1.00 64.14 C ATOM 1816 C ALA A 118 12.330 29.453 -16.388 1.00 74.45 C ATOM 1817 O ALA A 118 11.993 28.271 -16.461 1.00 34.30 O ATOM 1818 CB ALA A 118 10.940 31.143 -15.177 1.00 41.35 C ATOM 0 H ALA A 118 13.173 32.006 -14.606 1.00 72.31 H new ATOM 0 HA ALA A 118 12.008 29.521 -14.282 1.00 64.14 H new ATOM 0 HB1 ALA A 118 10.057 30.546 -15.403 1.00 41.35 H new ATOM 0 HB2 ALA A 118 10.799 31.654 -14.224 1.00 41.35 H new ATOM 0 HB3 ALA A 118 11.091 31.881 -15.965 1.00 41.35 H new ATOM 1824 N VAL A 119 12.855 30.119 -17.412 1.00 20.22 N ATOM 1825 CA VAL A 119 13.071 29.485 -18.707 1.00 24.43 C ATOM 1826 C VAL A 119 13.878 28.199 -18.561 1.00 43.32 C ATOM 1827 O VAL A 119 13.628 27.215 -19.258 1.00 5.24 O ATOM 1828 CB VAL A 119 13.802 30.429 -19.679 1.00 42.32 C ATOM 1829 CG1 VAL A 119 14.131 29.709 -20.978 1.00 21.22 C ATOM 1830 CG2 VAL A 119 12.964 31.671 -19.946 1.00 65.30 C ATOM 0 H VAL A 119 13.139 31.098 -17.369 1.00 20.22 H new ATOM 0 HA VAL A 119 12.087 29.249 -19.112 1.00 24.43 H new ATOM 0 HB VAL A 119 14.739 30.742 -19.218 1.00 42.32 H new ATOM 0 HG11 VAL A 119 14.647 30.392 -21.652 1.00 21.22 H new ATOM 0 HG12 VAL A 119 14.773 28.853 -20.767 1.00 21.22 H new ATOM 0 HG13 VAL A 119 13.209 29.365 -21.447 1.00 21.22 H new ATOM 0 HG21 VAL A 119 13.496 32.327 -20.635 1.00 65.30 H new ATOM 0 HG22 VAL A 119 12.010 31.379 -20.386 1.00 65.30 H new ATOM 0 HG23 VAL A 119 12.785 32.198 -19.009 1.00 65.30 H new ATOM 1840 N ASP A 120 14.846 28.215 -17.652 1.00 4.03 N ATOM 1841 CA ASP A 120 15.690 27.050 -17.413 1.00 21.31 C ATOM 1842 C ASP A 120 14.861 25.872 -16.911 1.00 14.03 C ATOM 1843 O ASP A 120 14.868 24.796 -17.508 1.00 33.14 O ATOM 1844 CB ASP A 120 16.786 27.386 -16.401 1.00 22.03 C ATOM 1845 CG ASP A 120 18.139 26.838 -16.809 1.00 44.02 C ATOM 1846 OD1 ASP A 120 18.183 25.726 -17.377 1.00 10.14 O ATOM 1847 OD2 ASP A 120 19.155 27.521 -16.562 1.00 51.44 O ATOM 0 H ASP A 120 15.066 29.022 -17.068 1.00 4.03 H new ATOM 0 HA ASP A 120 16.154 26.768 -18.358 1.00 21.31 H new ATOM 0 HB2 ASP A 120 16.854 28.468 -16.290 1.00 22.03 H new ATOM 0 HB3 ASP A 120 16.513 26.982 -15.426 1.00 22.03 H new ATOM 1852 N ALA A 121 14.148 26.084 -15.809 1.00 74.14 N ATOM 1853 CA ALA A 121 13.312 25.041 -15.228 1.00 25.45 C ATOM 1854 C ALA A 121 12.389 24.428 -16.275 1.00 43.24 C ATOM 1855 O ALA A 121 12.070 23.240 -16.219 1.00 43.40 O ATOM 1856 CB ALA A 121 12.501 25.599 -14.068 1.00 52.43 C ATOM 0 H ALA A 121 14.133 26.968 -15.301 1.00 74.14 H new ATOM 0 HA ALA A 121 13.966 24.253 -14.854 1.00 25.45 H new ATOM 0 HB1 ALA A 121 11.881 24.809 -13.644 1.00 52.43 H new ATOM 0 HB2 ALA A 121 13.176 25.981 -13.302 1.00 52.43 H new ATOM 0 HB3 ALA A 121 11.863 26.408 -14.426 1.00 52.43 H new ATOM 1862 N LYS A 122 11.962 25.246 -17.231 1.00 42.23 N ATOM 1863 CA LYS A 122 11.076 24.786 -18.293 1.00 74.34 C ATOM 1864 C LYS A 122 11.856 24.032 -19.365 1.00 43.24 C ATOM 1865 O LYS A 122 11.449 22.957 -19.802 1.00 61.23 O ATOM 1866 CB LYS A 122 10.340 25.971 -18.922 1.00 0.52 C ATOM 1867 CG LYS A 122 9.066 25.580 -19.651 1.00 3.02 C ATOM 1868 CD LYS A 122 9.114 25.987 -21.114 1.00 14.41 C ATOM 1869 CE LYS A 122 9.974 25.035 -21.930 1.00 74.22 C ATOM 1870 NZ LYS A 122 9.977 25.391 -23.376 1.00 51.11 N ATOM 0 H LYS A 122 12.216 26.232 -17.292 1.00 42.23 H new ATOM 0 HA LYS A 122 10.347 24.106 -17.853 1.00 74.34 H new ATOM 0 HB2 LYS A 122 10.095 26.691 -18.141 1.00 0.52 H new ATOM 0 HB3 LYS A 122 11.009 26.473 -19.621 1.00 0.52 H new ATOM 0 HG2 LYS A 122 8.919 24.502 -19.577 1.00 3.02 H new ATOM 0 HG3 LYS A 122 8.210 26.052 -19.169 1.00 3.02 H new ATOM 0 HD2 LYS A 122 8.103 26.005 -21.521 1.00 14.41 H new ATOM 0 HD3 LYS A 122 9.510 26.999 -21.198 1.00 14.41 H new ATOM 0 HE2 LYS A 122 10.995 25.052 -21.550 1.00 74.22 H new ATOM 0 HE3 LYS A 122 9.605 24.017 -21.807 1.00 74.22 H new ATOM 0 HZ1 LYS A 122 10.952 25.366 -23.738 1.00 51.11 H new ATOM 0 HZ2 LYS A 122 9.394 24.709 -23.903 1.00 51.11 H new ATOM 0 HZ3 LYS A 122 9.587 26.347 -23.499 1.00 51.11 H new ATOM 1884 N ASN A 123 12.981 24.604 -19.784 1.00 31.12 N ATOM 1885 CA ASN A 123 13.819 23.985 -20.804 1.00 42.13 C ATOM 1886 C ASN A 123 14.324 22.622 -20.341 1.00 33.13 C ATOM 1887 O ASN A 123 14.717 21.784 -21.153 1.00 72.13 O ATOM 1888 CB ASN A 123 15.004 24.893 -21.140 1.00 23.13 C ATOM 1889 CG ASN A 123 15.515 24.678 -22.551 1.00 45.33 C ATOM 1890 OD1 ASN A 123 14.736 24.471 -23.481 1.00 34.41 O ATOM 1891 ND2 ASN A 123 16.832 24.728 -22.717 1.00 61.54 N ATOM 0 H ASN A 123 13.333 25.495 -19.433 1.00 31.12 H new ATOM 0 HA ASN A 123 13.213 23.843 -21.699 1.00 42.13 H new ATOM 0 HB2 ASN A 123 14.706 25.934 -21.019 1.00 23.13 H new ATOM 0 HB3 ASN A 123 15.812 24.709 -20.432 1.00 23.13 H new ATOM 0 HD21 ASN A 123 17.235 24.592 -23.644 1.00 61.54 H new ATOM 0 HD22 ASN A 123 17.441 24.902 -21.917 1.00 61.54 H new ATOM 1898 N LEU A 124 14.309 22.406 -19.030 1.00 2.51 N ATOM 1899 CA LEU A 124 14.764 21.145 -18.457 1.00 24.51 C ATOM 1900 C LEU A 124 14.109 19.960 -19.159 1.00 71.32 C ATOM 1901 O LEU A 124 14.758 19.235 -19.915 1.00 2.22 O ATOM 1902 CB LEU A 124 14.454 21.100 -16.960 1.00 11.13 C ATOM 1903 CG LEU A 124 15.421 21.859 -16.051 1.00 25.22 C ATOM 1904 CD1 LEU A 124 14.985 21.751 -14.598 1.00 21.40 C ATOM 1905 CD2 LEU A 124 16.839 21.334 -16.224 1.00 61.53 C ATOM 0 H LEU A 124 13.986 23.088 -18.344 1.00 2.51 H new ATOM 0 HA LEU A 124 15.842 21.078 -18.600 1.00 24.51 H new ATOM 0 HB2 LEU A 124 13.452 21.499 -16.805 1.00 11.13 H new ATOM 0 HB3 LEU A 124 14.434 20.057 -16.645 1.00 11.13 H new ATOM 0 HG LEU A 124 15.407 22.911 -16.336 1.00 25.22 H new ATOM 0 HD11 LEU A 124 15.685 22.297 -13.966 1.00 21.40 H new ATOM 0 HD12 LEU A 124 13.987 22.175 -14.485 1.00 21.40 H new ATOM 0 HD13 LEU A 124 14.969 20.703 -14.300 1.00 21.40 H new ATOM 0 HD21 LEU A 124 17.514 21.886 -15.569 1.00 61.53 H new ATOM 0 HD22 LEU A 124 16.869 20.275 -15.967 1.00 61.53 H new ATOM 0 HD23 LEU A 124 17.151 21.464 -17.260 1.00 61.53 H new ATOM 1917 N LEU A 125 12.819 19.769 -18.907 1.00 13.21 N ATOM 1918 CA LEU A 125 12.074 18.673 -19.517 1.00 15.32 C ATOM 1919 C LEU A 125 11.848 18.929 -21.003 1.00 54.34 C ATOM 1920 O LEU A 125 11.744 17.993 -21.796 1.00 43.01 O ATOM 1921 CB LEU A 125 10.730 18.488 -18.809 1.00 52.35 C ATOM 1922 CG LEU A 125 10.247 17.046 -18.652 1.00 71.05 C ATOM 1923 CD1 LEU A 125 9.617 16.840 -17.284 1.00 23.14 C ATOM 1924 CD2 LEU A 125 9.260 16.691 -19.755 1.00 15.23 C ATOM 0 H LEU A 125 12.267 20.359 -18.284 1.00 13.21 H new ATOM 0 HA LEU A 125 12.663 17.762 -19.410 1.00 15.32 H new ATOM 0 HB2 LEU A 125 10.799 18.937 -17.818 1.00 52.35 H new ATOM 0 HB3 LEU A 125 9.972 19.046 -19.359 1.00 52.35 H new ATOM 0 HG LEU A 125 11.108 16.383 -18.736 1.00 71.05 H new ATOM 0 HD11 LEU A 125 9.279 15.808 -17.191 1.00 23.14 H new ATOM 0 HD12 LEU A 125 10.353 17.052 -16.509 1.00 23.14 H new ATOM 0 HD13 LEU A 125 8.766 17.512 -17.170 1.00 23.14 H new ATOM 0 HD21 LEU A 125 8.927 15.661 -19.627 1.00 15.23 H new ATOM 0 HD22 LEU A 125 8.401 17.359 -19.703 1.00 15.23 H new ATOM 0 HD23 LEU A 125 9.745 16.798 -20.725 1.00 15.23 H new ATOM 1936 N ASP A 126 11.774 20.203 -21.374 1.00 71.34 N ATOM 1937 CA ASP A 126 11.564 20.583 -22.767 1.00 32.54 C ATOM 1938 C ASP A 126 12.668 20.019 -23.656 1.00 52.41 C ATOM 1939 O ASP A 126 12.401 19.488 -24.734 1.00 35.52 O ATOM 1940 CB ASP A 126 11.511 22.105 -22.900 1.00 4.32 C ATOM 1941 CG ASP A 126 10.733 22.553 -24.121 1.00 43.24 C ATOM 1942 OD1 ASP A 126 9.486 22.514 -24.077 1.00 1.20 O ATOM 1943 OD2 ASP A 126 11.372 22.942 -25.122 1.00 75.12 O ATOM 0 H ASP A 126 11.856 20.990 -20.730 1.00 71.34 H new ATOM 0 HA ASP A 126 10.611 20.165 -23.093 1.00 32.54 H new ATOM 0 HB2 ASP A 126 11.054 22.529 -22.006 1.00 4.32 H new ATOM 0 HB3 ASP A 126 12.526 22.497 -22.956 1.00 4.32 H new ATOM 1948 N VAL A 127 13.910 20.141 -23.198 1.00 73.00 N ATOM 1949 CA VAL A 127 15.055 19.644 -23.952 1.00 14.22 C ATOM 1950 C VAL A 127 15.034 18.123 -24.043 1.00 70.45 C ATOM 1951 O VAL A 127 14.995 17.557 -25.137 1.00 12.23 O ATOM 1952 CB VAL A 127 16.383 20.091 -23.314 1.00 3.14 C ATOM 1953 CG1 VAL A 127 17.559 19.407 -23.994 1.00 23.12 C ATOM 1954 CG2 VAL A 127 16.524 21.604 -23.382 1.00 2.34 C ATOM 0 H VAL A 127 14.149 20.580 -22.309 1.00 73.00 H new ATOM 0 HA VAL A 127 14.982 20.066 -24.954 1.00 14.22 H new ATOM 0 HB VAL A 127 16.379 19.796 -22.265 1.00 3.14 H new ATOM 0 HG11 VAL A 127 18.489 19.735 -23.530 1.00 23.12 H new ATOM 0 HG12 VAL A 127 17.462 18.326 -23.888 1.00 23.12 H new ATOM 0 HG13 VAL A 127 17.570 19.668 -25.052 1.00 23.12 H new ATOM 0 HG21 VAL A 127 17.468 21.902 -22.927 1.00 2.34 H new ATOM 0 HG22 VAL A 127 16.506 21.925 -24.424 1.00 2.34 H new ATOM 0 HG23 VAL A 127 15.699 22.071 -22.845 1.00 2.34 H new ATOM 1964 N ILE A 128 15.060 17.465 -22.889 1.00 10.51 N ATOM 1965 CA ILE A 128 15.043 16.009 -22.839 1.00 75.21 C ATOM 1966 C ILE A 128 13.820 15.449 -23.559 1.00 24.21 C ATOM 1967 O ILE A 128 13.801 14.284 -23.957 1.00 22.35 O ATOM 1968 CB ILE A 128 15.049 15.495 -21.387 1.00 43.12 C ATOM 1969 CG1 ILE A 128 13.680 15.711 -20.740 1.00 52.42 C ATOM 1970 CG2 ILE A 128 16.137 16.193 -20.584 1.00 32.53 C ATOM 1971 CD1 ILE A 128 13.650 15.382 -19.264 1.00 40.11 C ATOM 0 H ILE A 128 15.093 17.918 -21.976 1.00 10.51 H new ATOM 0 HA ILE A 128 15.947 15.665 -23.341 1.00 75.21 H new ATOM 0 HB ILE A 128 15.260 14.426 -21.396 1.00 43.12 H new ATOM 0 HG12 ILE A 128 13.382 16.750 -20.878 1.00 52.42 H new ATOM 0 HG13 ILE A 128 12.942 15.096 -21.256 1.00 52.42 H new ATOM 0 HG21 ILE A 128 16.129 15.820 -19.560 1.00 32.53 H new ATOM 0 HG22 ILE A 128 17.108 15.992 -21.036 1.00 32.53 H new ATOM 0 HG23 ILE A 128 15.954 17.267 -20.580 1.00 32.53 H new ATOM 0 HD11 ILE A 128 12.648 15.559 -18.872 1.00 40.11 H new ATOM 0 HD12 ILE A 128 13.917 14.335 -19.119 1.00 40.11 H new ATOM 0 HD13 ILE A 128 14.363 16.015 -18.736 1.00 40.11 H new ATOM 1983 N ASP A 129 12.803 16.287 -23.725 1.00 31.54 N ATOM 1984 CA ASP A 129 11.577 15.876 -24.400 1.00 0.53 C ATOM 1985 C ASP A 129 11.888 15.225 -25.743 1.00 65.24 C ATOM 1986 O ASP A 129 11.199 14.299 -26.169 1.00 32.43 O ATOM 1987 CB ASP A 129 10.655 17.080 -24.604 1.00 30.42 C ATOM 1988 CG ASP A 129 9.204 16.754 -24.308 1.00 22.03 C ATOM 1989 OD1 ASP A 129 8.585 16.020 -25.107 1.00 4.02 O ATOM 1990 OD2 ASP A 129 8.688 17.232 -23.276 1.00 52.44 O ATOM 0 H ASP A 129 12.803 17.254 -23.402 1.00 31.54 H new ATOM 0 HA ASP A 129 11.072 15.143 -23.770 1.00 0.53 H new ATOM 0 HB2 ASP A 129 10.980 17.896 -23.959 1.00 30.42 H new ATOM 0 HB3 ASP A 129 10.743 17.432 -25.632 1.00 30.42 H new ATOM 1995 N GLN A 130 12.930 15.716 -26.406 1.00 43.43 N ATOM 1996 CA GLN A 130 13.331 15.183 -27.703 1.00 22.54 C ATOM 1997 C GLN A 130 13.641 13.692 -27.606 1.00 15.25 C ATOM 1998 O GLN A 130 13.396 12.935 -28.544 1.00 51.34 O ATOM 1999 CB GLN A 130 14.553 15.936 -28.232 1.00 72.42 C ATOM 2000 CG GLN A 130 14.319 16.606 -29.576 1.00 55.22 C ATOM 2001 CD GLN A 130 15.260 17.769 -29.820 1.00 65.45 C ATOM 2002 OE1 GLN A 130 14.827 18.880 -30.126 1.00 3.24 O ATOM 2003 NE2 GLN A 130 16.558 17.518 -29.687 1.00 73.22 N ATOM 0 H GLN A 130 13.512 16.482 -26.067 1.00 43.43 H new ATOM 0 HA GLN A 130 12.501 15.319 -28.396 1.00 22.54 H new ATOM 0 HB2 GLN A 130 14.846 16.693 -27.504 1.00 72.42 H new ATOM 0 HB3 GLN A 130 15.387 15.240 -28.322 1.00 72.42 H new ATOM 0 HG2 GLN A 130 14.443 15.870 -30.371 1.00 55.22 H new ATOM 0 HG3 GLN A 130 13.289 16.960 -29.627 1.00 55.22 H new ATOM 0 HE21 GLN A 130 16.873 16.582 -29.432 1.00 73.22 H new ATOM 0 HE22 GLN A 130 17.239 18.261 -29.840 1.00 73.22 H new ATOM 2012 N ALA A 131 14.180 13.278 -26.464 1.00 1.12 N ATOM 2013 CA ALA A 131 14.521 11.878 -26.244 1.00 3.23 C ATOM 2014 C ALA A 131 13.269 11.034 -26.036 1.00 75.11 C ATOM 2015 O ALA A 131 13.166 9.921 -26.553 1.00 53.42 O ATOM 2016 CB ALA A 131 15.454 11.744 -25.049 1.00 64.14 C ATOM 0 H ALA A 131 14.390 13.892 -25.677 1.00 1.12 H new ATOM 0 HA ALA A 131 15.032 11.510 -27.134 1.00 3.23 H new ATOM 0 HB1 ALA A 131 15.701 10.693 -24.896 1.00 64.14 H new ATOM 0 HB2 ALA A 131 16.368 12.308 -25.236 1.00 64.14 H new ATOM 0 HB3 ALA A 131 14.963 12.135 -24.158 1.00 64.14 H new ATOM 2022 N ARG A 132 12.319 11.569 -25.276 1.00 51.41 N ATOM 2023 CA ARG A 132 11.074 10.864 -24.999 1.00 33.32 C ATOM 2024 C ARG A 132 10.427 10.373 -26.291 1.00 45.12 C ATOM 2025 O ARG A 132 10.008 9.219 -26.389 1.00 64.12 O ATOM 2026 CB ARG A 132 10.103 11.775 -24.245 1.00 23.32 C ATOM 2027 CG ARG A 132 10.540 12.086 -22.823 1.00 24.13 C ATOM 2028 CD ARG A 132 9.388 12.630 -21.992 1.00 45.13 C ATOM 2029 NE ARG A 132 8.629 13.650 -22.711 1.00 65.12 N ATOM 2030 CZ ARG A 132 7.387 13.998 -22.398 1.00 15.23 C ATOM 2031 NH1 ARG A 132 6.766 13.412 -21.383 1.00 61.12 N ATOM 2032 NH2 ARG A 132 6.762 14.935 -23.099 1.00 52.34 N ATOM 0 H ARG A 132 12.388 12.489 -24.841 1.00 51.41 H new ATOM 0 HA ARG A 132 11.307 9.999 -24.378 1.00 33.32 H new ATOM 0 HB2 ARG A 132 9.993 12.710 -24.795 1.00 23.32 H new ATOM 0 HB3 ARG A 132 9.121 11.303 -24.219 1.00 23.32 H new ATOM 0 HG2 ARG A 132 10.932 11.183 -22.356 1.00 24.13 H new ATOM 0 HG3 ARG A 132 11.352 12.813 -22.842 1.00 24.13 H new ATOM 0 HD2 ARG A 132 8.723 11.812 -21.714 1.00 45.13 H new ATOM 0 HD3 ARG A 132 9.777 13.053 -21.066 1.00 45.13 H new ATOM 0 HE ARG A 132 9.078 14.121 -23.497 1.00 65.12 H new ATOM 0 HH11 ARG A 132 7.243 12.692 -20.841 1.00 61.12 H new ATOM 0 HH12 ARG A 132 5.812 13.682 -21.145 1.00 61.12 H new ATOM 0 HH21 ARG A 132 7.236 15.389 -23.880 1.00 52.34 H new ATOM 0 HH22 ARG A 132 5.808 15.201 -22.857 1.00 52.34 H new ATOM 2046 N LEU A 133 10.350 11.257 -27.280 1.00 34.31 N ATOM 2047 CA LEU A 133 9.754 10.914 -28.567 1.00 11.41 C ATOM 2048 C LEU A 133 10.590 9.864 -29.292 1.00 13.24 C ATOM 2049 O LEU A 133 10.055 8.903 -29.845 1.00 22.10 O ATOM 2050 CB LEU A 133 9.619 12.165 -29.437 1.00 71.15 C ATOM 2051 CG LEU A 133 8.497 13.131 -29.056 1.00 33.35 C ATOM 2052 CD1 LEU A 133 8.670 14.461 -29.773 1.00 33.53 C ATOM 2053 CD2 LEU A 133 7.139 12.523 -29.375 1.00 15.11 C ATOM 0 H LEU A 133 10.692 12.216 -27.216 1.00 34.31 H new ATOM 0 HA LEU A 133 8.764 10.498 -28.382 1.00 11.41 H new ATOM 0 HB2 LEU A 133 10.564 12.708 -29.407 1.00 71.15 H new ATOM 0 HB3 LEU A 133 9.465 11.850 -30.469 1.00 71.15 H new ATOM 0 HG LEU A 133 8.549 13.312 -27.982 1.00 33.35 H new ATOM 0 HD11 LEU A 133 7.862 15.135 -29.489 1.00 33.53 H new ATOM 0 HD12 LEU A 133 9.626 14.903 -29.494 1.00 33.53 H new ATOM 0 HD13 LEU A 133 8.646 14.299 -30.851 1.00 33.53 H new ATOM 0 HD21 LEU A 133 6.352 13.224 -29.097 1.00 15.11 H new ATOM 0 HD22 LEU A 133 7.077 12.312 -30.443 1.00 15.11 H new ATOM 0 HD23 LEU A 133 7.014 11.597 -28.814 1.00 15.11 H new ATOM 2065 N LYS A 134 11.905 10.053 -29.283 1.00 31.13 N ATOM 2066 CA LYS A 134 12.817 9.121 -29.936 1.00 35.03 C ATOM 2067 C LYS A 134 12.627 7.707 -29.397 1.00 34.40 C ATOM 2068 O LYS A 134 12.906 6.727 -30.087 1.00 71.05 O ATOM 2069 CB LYS A 134 14.266 9.566 -29.731 1.00 24.21 C ATOM 2070 CG LYS A 134 14.763 10.528 -30.795 1.00 45.53 C ATOM 2071 CD LYS A 134 16.187 10.981 -30.517 1.00 40.00 C ATOM 2072 CE LYS A 134 16.490 12.312 -31.189 1.00 23.43 C ATOM 2073 NZ LYS A 134 17.885 12.762 -30.923 1.00 72.35 N ATOM 0 H LYS A 134 12.364 10.844 -28.830 1.00 31.13 H new ATOM 0 HA LYS A 134 12.592 9.118 -31.003 1.00 35.03 H new ATOM 0 HB2 LYS A 134 14.357 10.040 -28.754 1.00 24.21 H new ATOM 0 HB3 LYS A 134 14.909 8.686 -29.720 1.00 24.21 H new ATOM 0 HG2 LYS A 134 14.718 10.046 -31.772 1.00 45.53 H new ATOM 0 HG3 LYS A 134 14.106 11.397 -30.837 1.00 45.53 H new ATOM 0 HD2 LYS A 134 16.337 11.073 -29.441 1.00 40.00 H new ATOM 0 HD3 LYS A 134 16.887 10.225 -30.873 1.00 40.00 H new ATOM 0 HE2 LYS A 134 16.337 12.219 -32.264 1.00 23.43 H new ATOM 0 HE3 LYS A 134 15.790 13.067 -30.831 1.00 23.43 H new ATOM 0 HZ1 LYS A 134 18.053 13.672 -31.398 1.00 72.35 H new ATOM 0 HZ2 LYS A 134 18.024 12.875 -29.899 1.00 72.35 H new ATOM 0 HZ3 LYS A 134 18.554 12.053 -31.287 1.00 72.35 H new ATOM 2087 N MET A 135 12.149 7.608 -28.161 1.00 11.33 N ATOM 2088 CA MET A 135 11.919 6.313 -27.531 1.00 63.04 C ATOM 2089 C MET A 135 10.639 5.673 -28.057 1.00 35.40 C ATOM 2090 O MET A 135 10.610 4.480 -28.362 1.00 21.11 O ATOM 2091 CB MET A 135 11.840 6.467 -26.011 1.00 55.54 C ATOM 2092 CG MET A 135 13.126 6.092 -25.294 1.00 42.51 C ATOM 2093 SD MET A 135 12.831 5.392 -23.659 1.00 1.20 S ATOM 2094 CE MET A 135 11.957 6.740 -22.866 1.00 64.11 C ATOM 0 H MET A 135 11.913 8.409 -27.576 1.00 11.33 H new ATOM 0 HA MET A 135 12.758 5.662 -27.779 1.00 63.04 H new ATOM 0 HB2 MET A 135 11.588 7.500 -25.771 1.00 55.54 H new ATOM 0 HB3 MET A 135 11.028 5.845 -25.633 1.00 55.54 H new ATOM 0 HG2 MET A 135 13.678 5.373 -25.899 1.00 42.51 H new ATOM 0 HG3 MET A 135 13.755 6.977 -25.198 1.00 42.51 H new ATOM 0 HE1 MET A 135 12.045 6.644 -21.784 1.00 64.11 H new ATOM 0 HE2 MET A 135 12.389 7.690 -23.183 1.00 64.11 H new ATOM 0 HE3 MET A 135 10.905 6.708 -23.149 1.00 64.11 H new ATOM 2104 N ILE A 136 9.582 6.472 -28.160 1.00 31.42 N ATOM 2105 CA ILE A 136 8.299 5.982 -28.649 1.00 62.23 C ATOM 2106 C ILE A 136 8.460 5.254 -29.980 1.00 0.23 C ATOM 2107 O ILE A 136 8.102 4.083 -30.106 1.00 15.41 O ATOM 2108 CB ILE A 136 7.288 7.130 -28.824 1.00 12.00 C ATOM 2109 CG1 ILE A 136 7.093 7.873 -27.501 1.00 0.03 C ATOM 2110 CG2 ILE A 136 5.960 6.593 -29.336 1.00 71.34 C ATOM 2111 CD1 ILE A 136 6.536 7.003 -26.396 1.00 0.24 C ATOM 0 H ILE A 136 9.589 7.461 -27.911 1.00 31.42 H new ATOM 0 HA ILE A 136 7.920 5.286 -27.900 1.00 62.23 H new ATOM 0 HB ILE A 136 7.682 7.832 -29.559 1.00 12.00 H new ATOM 0 HG12 ILE A 136 8.050 8.285 -27.181 1.00 0.03 H new ATOM 0 HG13 ILE A 136 6.421 8.716 -27.663 1.00 0.03 H new ATOM 0 HG21 ILE A 136 5.256 7.417 -29.455 1.00 71.34 H new ATOM 0 HG22 ILE A 136 6.112 6.104 -30.298 1.00 71.34 H new ATOM 0 HG23 ILE A 136 5.559 5.873 -28.623 1.00 71.34 H new ATOM 0 HD11 ILE A 136 6.424 7.595 -25.488 1.00 0.24 H new ATOM 0 HD12 ILE A 136 5.564 6.612 -26.696 1.00 0.24 H new ATOM 0 HD13 ILE A 136 7.218 6.174 -26.207 1.00 0.24 H new ATOM 2123 N SER A 137 9.003 5.955 -30.970 1.00 2.43 N ATOM 2124 CA SER A 137 9.210 5.377 -32.292 1.00 42.01 C ATOM 2125 C SER A 137 10.470 4.516 -32.317 1.00 55.14 C ATOM 2126 O SER A 137 11.409 4.794 -33.062 1.00 53.34 O ATOM 2127 CB SER A 137 9.313 6.482 -33.345 1.00 1.20 C ATOM 2128 OG SER A 137 8.250 7.411 -33.215 1.00 62.55 O ATOM 0 H SER A 137 9.308 6.924 -30.881 1.00 2.43 H new ATOM 0 HA SER A 137 8.353 4.744 -32.523 1.00 42.01 H new ATOM 0 HB2 SER A 137 10.267 6.999 -33.242 1.00 1.20 H new ATOM 0 HB3 SER A 137 9.295 6.042 -34.342 1.00 1.20 H new ATOM 0 HG SER A 137 8.339 8.108 -33.898 1.00 62.55 H new ATOM 2134 N GLN A 138 10.480 3.470 -31.498 1.00 20.13 N ATOM 2135 CA GLN A 138 11.624 2.568 -31.425 1.00 52.42 C ATOM 2136 C GLN A 138 11.370 1.446 -30.424 1.00 53.22 C ATOM 2137 O GLN A 138 11.347 0.270 -30.788 1.00 12.34 O ATOM 2138 CB GLN A 138 12.885 3.341 -31.034 1.00 72.11 C ATOM 2139 CG GLN A 138 14.076 3.058 -31.936 1.00 33.24 C ATOM 2140 CD GLN A 138 14.932 4.286 -32.174 1.00 71.12 C ATOM 2141 OE1 GLN A 138 14.635 5.104 -33.045 1.00 42.03 O ATOM 2142 NE2 GLN A 138 16.002 4.422 -31.399 1.00 73.34 N ATOM 0 H GLN A 138 9.710 3.226 -30.876 1.00 20.13 H new ATOM 0 HA GLN A 138 11.769 2.125 -32.410 1.00 52.42 H new ATOM 0 HB2 GLN A 138 12.668 4.409 -31.057 1.00 72.11 H new ATOM 0 HB3 GLN A 138 13.150 3.091 -30.007 1.00 72.11 H new ATOM 0 HG2 GLN A 138 14.688 2.274 -31.489 1.00 33.24 H new ATOM 0 HG3 GLN A 138 13.720 2.677 -32.893 1.00 33.24 H new ATOM 0 HE21 GLN A 138 16.210 3.720 -30.689 1.00 73.34 H new ATOM 0 HE22 GLN A 138 16.615 5.229 -31.513 1.00 73.34 H new ATOM 2151 N SER A 139 11.180 1.817 -29.162 1.00 54.41 N ATOM 2152 CA SER A 139 10.931 0.841 -28.107 1.00 43.54 C ATOM 2153 C SER A 139 10.588 1.537 -26.794 1.00 35.03 C ATOM 2154 O SER A 139 11.257 2.487 -26.388 1.00 52.42 O ATOM 2155 CB SER A 139 12.155 -0.057 -27.917 1.00 35.41 C ATOM 2156 OG SER A 139 13.351 0.637 -28.225 1.00 53.05 O ATOM 0 H SER A 139 11.194 2.786 -28.845 1.00 54.41 H new ATOM 0 HA SER A 139 10.081 0.227 -28.405 1.00 43.54 H new ATOM 0 HB2 SER A 139 12.192 -0.413 -26.887 1.00 35.41 H new ATOM 0 HB3 SER A 139 12.067 -0.936 -28.555 1.00 35.41 H new ATOM 0 HG SER A 139 14.118 0.041 -28.094 1.00 53.05 H new ATOM 2162 N ARG A 140 9.539 1.056 -26.134 1.00 22.15 N ATOM 2163 CA ARG A 140 9.105 1.631 -24.866 1.00 53.24 C ATOM 2164 C ARG A 140 10.104 1.318 -23.756 1.00 54.22 C ATOM 2165 O ARG A 140 10.915 0.398 -23.859 1.00 30.11 O ATOM 2166 CB ARG A 140 7.722 1.099 -24.488 1.00 35.54 C ATOM 2167 CG ARG A 140 6.593 2.076 -24.774 1.00 22.14 C ATOM 2168 CD ARG A 140 5.540 2.047 -23.677 1.00 50.20 C ATOM 2169 NE ARG A 140 4.186 1.970 -24.220 1.00 65.30 N ATOM 2170 CZ ARG A 140 3.606 2.959 -24.891 1.00 20.43 C ATOM 2171 NH1 ARG A 140 4.258 4.094 -25.100 1.00 53.02 N ATOM 2172 NH2 ARG A 140 2.371 2.812 -25.354 1.00 1.52 N ATOM 0 H ARG A 140 8.974 0.270 -26.456 1.00 22.15 H new ATOM 0 HA ARG A 140 9.050 2.713 -24.986 1.00 53.24 H new ATOM 0 HB2 ARG A 140 7.537 0.174 -25.033 1.00 35.54 H new ATOM 0 HB3 ARG A 140 7.716 0.850 -23.427 1.00 35.54 H new ATOM 0 HG2 ARG A 140 6.997 3.084 -24.865 1.00 22.14 H new ATOM 0 HG3 ARG A 140 6.131 1.830 -25.730 1.00 22.14 H new ATOM 0 HD2 ARG A 140 5.719 1.191 -23.026 1.00 50.20 H new ATOM 0 HD3 ARG A 140 5.633 2.941 -23.061 1.00 50.20 H new ATOM 0 HE ARG A 140 3.657 1.110 -24.076 1.00 65.30 H new ATOM 0 HH11 ARG A 140 5.207 4.210 -24.745 1.00 53.02 H new ATOM 0 HH12 ARG A 140 3.810 4.852 -25.616 1.00 53.02 H new ATOM 0 HH21 ARG A 140 1.867 1.940 -25.195 1.00 1.52 H new ATOM 0 HH22 ARG A 140 1.926 3.571 -25.869 1.00 1.52 H new ATOM 2186 N PRO A 141 10.045 2.102 -22.669 1.00 21.40 N ATOM 2187 CA PRO A 141 10.937 1.927 -21.519 1.00 2.41 C ATOM 2188 C PRO A 141 10.634 0.653 -20.738 1.00 11.53 C ATOM 2189 O PRO A 141 9.828 -0.173 -21.167 1.00 64.10 O ATOM 2190 CB PRO A 141 10.653 3.162 -20.660 1.00 23.04 C ATOM 2191 CG PRO A 141 9.267 3.567 -21.025 1.00 42.54 C ATOM 2192 CD PRO A 141 9.103 3.217 -22.479 1.00 2.35 C ATOM 0 HA PRO A 141 11.980 1.832 -21.822 1.00 2.41 H new ATOM 0 HB2 PRO A 141 10.731 2.932 -19.597 1.00 23.04 H new ATOM 0 HB3 PRO A 141 11.366 3.960 -20.866 1.00 23.04 H new ATOM 0 HG2 PRO A 141 8.533 3.043 -20.412 1.00 42.54 H new ATOM 0 HG3 PRO A 141 9.116 4.634 -20.861 1.00 42.54 H new ATOM 0 HD2 PRO A 141 8.079 2.922 -22.708 1.00 2.35 H new ATOM 0 HD3 PRO A 141 9.344 4.061 -23.125 1.00 2.35 H new ATOM 2200 N HIS A 142 11.284 0.501 -19.588 1.00 73.21 N ATOM 2201 CA HIS A 142 11.082 -0.673 -18.746 1.00 61.11 C ATOM 2202 C HIS A 142 10.271 -0.318 -17.504 1.00 12.32 C ATOM 2203 O HIS A 142 9.925 -1.213 -16.734 1.00 50.04 O ATOM 2204 CB HIS A 142 12.429 -1.270 -18.336 1.00 73.24 C ATOM 2205 CG HIS A 142 13.348 -0.284 -17.685 1.00 42.40 C ATOM 2206 ND1 HIS A 142 13.136 0.590 -16.673 1.00 2.41 N flip ATOM 2207 CD2 HIS A 142 14.662 -0.114 -18.067 1.00 22.53 C flip ATOM 2208 CE1 HIS A 142 14.314 1.263 -16.463 1.00 42.15 C flip ATOM 2209 NE2 HIS A 142 15.219 0.820 -17.316 1.00 1.34 N flip ATOM 0 H HIS A 142 11.954 1.175 -19.218 1.00 73.21 H new ATOM 0 HA HIS A 142 10.525 -1.412 -19.323 1.00 61.11 H new ATOM 0 HB2 HIS A 142 12.256 -2.100 -17.651 1.00 73.24 H new ATOM 0 HB3 HIS A 142 12.918 -1.682 -19.219 1.00 73.24 H new ATOM 0 HD2 HIS A 142 15.158 -0.659 -18.856 1.00 22.53 H new ATOM 0 HE1 HIS A 142 14.474 2.031 -15.720 1.00 42.15 H new ATOM 0 HE2 HIS A 142 16.184 1.144 -17.384 1.00 1.34 H new ATOM 2217 N SER A 169 26.575 21.579 2.061 1.00 14.15 N ATOM 2218 CA SER A 169 27.078 22.666 1.229 1.00 31.33 C ATOM 2219 C SER A 169 25.937 23.355 0.487 1.00 70.31 C ATOM 2220 O SER A 169 25.538 24.466 0.834 1.00 72.22 O ATOM 2221 CB SER A 169 28.106 22.135 0.228 1.00 2.43 C ATOM 2222 OG SER A 169 29.426 22.304 0.716 1.00 62.25 O ATOM 0 HA SER A 169 27.558 23.397 1.879 1.00 31.33 H new ATOM 0 HB2 SER A 169 27.919 21.079 0.035 1.00 2.43 H new ATOM 0 HB3 SER A 169 27.996 22.657 -0.722 1.00 2.43 H new ATOM 0 HG SER A 169 30.065 21.956 0.059 1.00 62.25 H new ATOM 2228 N ALA A 170 25.417 22.686 -0.537 1.00 13.00 N ATOM 2229 CA ALA A 170 24.321 23.232 -1.328 1.00 34.31 C ATOM 2230 C ALA A 170 23.033 23.293 -0.513 1.00 60.32 C ATOM 2231 O ALA A 170 22.455 24.364 -0.324 1.00 61.33 O ATOM 2232 CB ALA A 170 24.113 22.401 -2.586 1.00 12.23 C ATOM 0 H ALA A 170 25.737 21.765 -0.838 1.00 13.00 H new ATOM 0 HA ALA A 170 24.586 24.249 -1.617 1.00 34.31 H new ATOM 0 HB1 ALA A 170 23.292 22.820 -3.167 1.00 12.23 H new ATOM 0 HB2 ALA A 170 25.024 22.413 -3.185 1.00 12.23 H new ATOM 0 HB3 ALA A 170 23.874 21.374 -2.309 1.00 12.23 H new ATOM 2238 N THR A 171 22.587 22.136 -0.032 1.00 51.34 N ATOM 2239 CA THR A 171 21.366 22.058 0.760 1.00 5.13 C ATOM 2240 C THR A 171 21.395 23.055 1.913 1.00 54.42 C ATOM 2241 O THR A 171 20.353 23.555 2.339 1.00 23.03 O ATOM 2242 CB THR A 171 21.155 20.642 1.327 1.00 33.43 C ATOM 2243 OG1 THR A 171 19.929 20.588 2.065 1.00 31.45 O ATOM 2244 CG2 THR A 171 22.313 20.241 2.228 1.00 21.51 C ATOM 0 H THR A 171 23.053 21.241 -0.177 1.00 51.34 H new ATOM 0 HA THR A 171 20.539 22.302 0.093 1.00 5.13 H new ATOM 0 HB THR A 171 21.107 19.944 0.492 1.00 33.43 H new ATOM 0 HG1 THR A 171 19.801 19.684 2.421 1.00 31.45 H new ATOM 0 HG21 THR A 171 22.141 19.237 2.616 1.00 21.51 H new ATOM 0 HG22 THR A 171 23.241 20.255 1.656 1.00 21.51 H new ATOM 0 HG23 THR A 171 22.388 20.943 3.058 1.00 21.51 H new ATOM 2252 N ARG A 172 22.592 23.342 2.412 1.00 24.34 N ATOM 2253 CA ARG A 172 22.755 24.280 3.516 1.00 23.25 C ATOM 2254 C ARG A 172 22.218 25.658 3.143 1.00 50.14 C ATOM 2255 O ARG A 172 21.346 26.200 3.821 1.00 22.55 O ATOM 2256 CB ARG A 172 24.230 24.385 3.911 1.00 54.12 C ATOM 2257 CG ARG A 172 24.589 23.577 5.147 1.00 14.43 C ATOM 2258 CD ARG A 172 25.301 24.432 6.184 1.00 54.31 C ATOM 2259 NE ARG A 172 24.361 25.178 7.017 1.00 21.45 N ATOM 2260 CZ ARG A 172 23.592 24.614 7.942 1.00 31.11 C ATOM 2261 NH1 ARG A 172 23.651 23.306 8.151 1.00 73.13 N ATOM 2262 NH2 ARG A 172 22.762 25.359 8.661 1.00 51.12 N ATOM 0 H ARG A 172 23.464 22.938 2.069 1.00 24.34 H new ATOM 0 HA ARG A 172 22.184 23.905 4.365 1.00 23.25 H new ATOM 0 HB2 ARG A 172 24.846 24.049 3.076 1.00 54.12 H new ATOM 0 HB3 ARG A 172 24.476 25.432 4.088 1.00 54.12 H new ATOM 0 HG2 ARG A 172 23.684 23.154 5.582 1.00 14.43 H new ATOM 0 HG3 ARG A 172 25.227 22.740 4.863 1.00 14.43 H new ATOM 0 HD2 ARG A 172 25.919 23.795 6.816 1.00 54.31 H new ATOM 0 HD3 ARG A 172 25.972 25.129 5.681 1.00 54.31 H new ATOM 0 HE ARG A 172 24.291 26.186 6.881 1.00 21.45 H new ATOM 0 HH11 ARG A 172 24.288 22.730 7.601 1.00 73.13 H new ATOM 0 HH12 ARG A 172 23.059 22.876 8.862 1.00 73.13 H new ATOM 0 HH21 ARG A 172 22.714 26.366 8.504 1.00 51.12 H new ATOM 0 HH22 ARG A 172 22.172 24.925 9.371 1.00 51.12 H new ATOM 2276 N GLU A 173 22.745 26.219 2.059 1.00 43.30 N ATOM 2277 CA GLU A 173 22.319 27.535 1.597 1.00 61.15 C ATOM 2278 C GLU A 173 20.801 27.596 1.455 1.00 51.24 C ATOM 2279 O GLU A 173 20.171 28.589 1.821 1.00 2.25 O ATOM 2280 CB GLU A 173 22.981 27.869 0.258 1.00 23.21 C ATOM 2281 CG GLU A 173 24.460 28.199 0.376 1.00 14.42 C ATOM 2282 CD GLU A 173 24.705 29.643 0.770 1.00 31.03 C ATOM 2283 OE1 GLU A 173 24.219 30.055 1.845 1.00 74.25 O ATOM 2284 OE2 GLU A 173 25.382 30.361 0.005 1.00 23.44 O ATOM 0 H GLU A 173 23.467 25.783 1.485 1.00 43.30 H new ATOM 0 HA GLU A 173 22.627 28.270 2.340 1.00 61.15 H new ATOM 0 HB2 GLU A 173 22.859 27.024 -0.419 1.00 23.21 H new ATOM 0 HB3 GLU A 173 22.463 28.716 -0.193 1.00 23.21 H new ATOM 0 HG2 GLU A 173 24.917 27.542 1.116 1.00 14.42 H new ATOM 0 HG3 GLU A 173 24.951 27.998 -0.576 1.00 14.42 H new ATOM 2291 N LEU A 174 20.219 26.528 0.920 1.00 43.54 N ATOM 2292 CA LEU A 174 18.775 26.460 0.728 1.00 73.51 C ATOM 2293 C LEU A 174 18.040 26.659 2.050 1.00 50.34 C ATOM 2294 O LEU A 174 17.062 27.404 2.121 1.00 4.25 O ATOM 2295 CB LEU A 174 18.386 25.114 0.113 1.00 34.13 C ATOM 2296 CG LEU A 174 19.177 24.687 -1.124 1.00 15.31 C ATOM 2297 CD1 LEU A 174 18.780 23.283 -1.553 1.00 3.12 C ATOM 2298 CD2 LEU A 174 18.961 25.675 -2.261 1.00 41.13 C ATOM 0 H LEU A 174 20.725 25.698 0.612 1.00 43.54 H new ATOM 0 HA LEU A 174 18.485 27.261 0.048 1.00 73.51 H new ATOM 0 HB2 LEU A 174 18.498 24.343 0.875 1.00 34.13 H new ATOM 0 HB3 LEU A 174 17.329 25.150 -0.151 1.00 34.13 H new ATOM 0 HG LEU A 174 20.237 24.681 -0.870 1.00 15.31 H new ATOM 0 HD11 LEU A 174 19.353 22.996 -2.435 1.00 3.12 H new ATOM 0 HD12 LEU A 174 18.986 22.583 -0.743 1.00 3.12 H new ATOM 0 HD13 LEU A 174 17.716 23.262 -1.789 1.00 3.12 H new ATOM 0 HD21 LEU A 174 19.531 25.356 -3.133 1.00 41.13 H new ATOM 0 HD22 LEU A 174 17.901 25.713 -2.514 1.00 41.13 H new ATOM 0 HD23 LEU A 174 19.296 26.665 -1.951 1.00 41.13 H new ATOM 2310 N ASP A 175 18.518 25.991 3.093 1.00 24.12 N ATOM 2311 CA ASP A 175 17.909 26.097 4.414 1.00 42.31 C ATOM 2312 C ASP A 175 18.169 27.472 5.023 1.00 73.31 C ATOM 2313 O ASP A 175 17.290 28.056 5.656 1.00 23.34 O ATOM 2314 CB ASP A 175 18.451 25.006 5.338 1.00 34.33 C ATOM 2315 CG ASP A 175 17.501 24.688 6.477 1.00 63.33 C ATOM 2316 OD1 ASP A 175 17.480 25.454 7.462 1.00 32.03 O ATOM 2317 OD2 ASP A 175 16.780 23.672 6.383 1.00 65.05 O ATOM 0 H ASP A 175 19.326 25.370 3.050 1.00 24.12 H new ATOM 0 HA ASP A 175 16.833 25.966 4.302 1.00 42.31 H new ATOM 0 HB2 ASP A 175 18.635 24.101 4.759 1.00 34.33 H new ATOM 0 HB3 ASP A 175 19.410 25.323 5.747 1.00 34.33 H new ATOM 2322 N GLU A 176 19.381 27.981 4.827 1.00 70.00 N ATOM 2323 CA GLU A 176 19.756 29.286 5.359 1.00 32.20 C ATOM 2324 C GLU A 176 18.783 30.364 4.890 1.00 45.41 C ATOM 2325 O GLU A 176 18.171 31.060 5.701 1.00 21.14 O ATOM 2326 CB GLU A 176 21.180 29.646 4.931 1.00 52.24 C ATOM 2327 CG GLU A 176 21.888 30.580 5.897 1.00 24.14 C ATOM 2328 CD GLU A 176 22.351 29.874 7.157 1.00 62.10 C ATOM 2329 OE1 GLU A 176 22.812 28.718 7.055 1.00 73.23 O ATOM 2330 OE2 GLU A 176 22.253 30.479 8.245 1.00 32.54 O ATOM 0 H GLU A 176 20.120 27.510 4.304 1.00 70.00 H new ATOM 0 HA GLU A 176 19.715 29.232 6.447 1.00 32.20 H new ATOM 0 HB2 GLU A 176 21.763 28.730 4.831 1.00 52.24 H new ATOM 0 HB3 GLU A 176 21.147 30.112 3.946 1.00 52.24 H new ATOM 0 HG2 GLU A 176 22.748 31.028 5.399 1.00 24.14 H new ATOM 0 HG3 GLU A 176 21.216 31.395 6.167 1.00 24.14 H new ATOM 2337 N LEU A 177 18.647 30.498 3.575 1.00 2.23 N ATOM 2338 CA LEU A 177 17.750 31.492 2.996 1.00 10.24 C ATOM 2339 C LEU A 177 16.327 31.309 3.514 1.00 20.42 C ATOM 2340 O LEU A 177 15.620 32.282 3.772 1.00 33.14 O ATOM 2341 CB LEU A 177 17.766 31.395 1.470 1.00 70.11 C ATOM 2342 CG LEU A 177 19.031 31.903 0.778 1.00 25.02 C ATOM 2343 CD1 LEU A 177 19.224 31.207 -0.560 1.00 64.11 C ATOM 2344 CD2 LEU A 177 18.968 33.412 0.592 1.00 4.04 C ATOM 0 H LEU A 177 19.146 29.931 2.890 1.00 2.23 H new ATOM 0 HA LEU A 177 18.101 32.480 3.295 1.00 10.24 H new ATOM 0 HB2 LEU A 177 17.617 30.352 1.191 1.00 70.11 H new ATOM 0 HB3 LEU A 177 16.914 31.954 1.082 1.00 70.11 H new ATOM 0 HG LEU A 177 19.887 31.670 1.412 1.00 25.02 H new ATOM 0 HD11 LEU A 177 20.129 31.582 -1.038 1.00 64.11 H new ATOM 0 HD12 LEU A 177 19.315 30.132 -0.401 1.00 64.11 H new ATOM 0 HD13 LEU A 177 18.366 31.407 -1.201 1.00 64.11 H new ATOM 0 HD21 LEU A 177 19.877 33.756 0.098 1.00 4.04 H new ATOM 0 HD22 LEU A 177 18.103 33.667 -0.020 1.00 4.04 H new ATOM 0 HD23 LEU A 177 18.879 33.895 1.565 1.00 4.04 H new ATOM 2356 N MET A 178 15.915 30.054 3.665 1.00 2.13 N ATOM 2357 CA MET A 178 14.578 29.743 4.156 1.00 55.21 C ATOM 2358 C MET A 178 14.334 30.388 5.516 1.00 11.54 C ATOM 2359 O MET A 178 13.233 30.857 5.803 1.00 34.23 O ATOM 2360 CB MET A 178 14.387 28.228 4.255 1.00 12.53 C ATOM 2361 CG MET A 178 12.978 27.818 4.651 1.00 54.14 C ATOM 2362 SD MET A 178 12.946 26.764 6.113 1.00 74.41 S ATOM 2363 CE MET A 178 11.711 27.599 7.106 1.00 74.44 C ATOM 0 H MET A 178 16.488 29.237 3.454 1.00 2.13 H new ATOM 0 HA MET A 178 13.855 30.147 3.447 1.00 55.21 H new ATOM 0 HB2 MET A 178 14.632 27.776 3.294 1.00 12.53 H new ATOM 0 HB3 MET A 178 15.092 27.828 4.984 1.00 12.53 H new ATOM 0 HG2 MET A 178 12.383 28.712 4.839 1.00 54.14 H new ATOM 0 HG3 MET A 178 12.509 27.293 3.819 1.00 54.14 H new ATOM 0 HE1 MET A 178 11.307 26.905 7.843 1.00 74.44 H new ATOM 0 HE2 MET A 178 12.167 28.447 7.617 1.00 74.44 H new ATOM 0 HE3 MET A 178 10.906 27.954 6.463 1.00 74.44 H new ATOM 2373 N ALA A 179 15.368 30.409 6.350 1.00 24.15 N ATOM 2374 CA ALA A 179 15.266 30.998 7.680 1.00 44.23 C ATOM 2375 C ALA A 179 15.055 32.506 7.597 1.00 40.20 C ATOM 2376 O ALA A 179 14.237 33.069 8.325 1.00 63.20 O ATOM 2377 CB ALA A 179 16.512 30.682 8.494 1.00 31.23 C ATOM 0 H ALA A 179 16.287 30.025 6.128 1.00 24.15 H new ATOM 0 HA ALA A 179 14.400 30.563 8.178 1.00 44.23 H new ATOM 0 HB1 ALA A 179 16.422 31.128 9.485 1.00 31.23 H new ATOM 0 HB2 ALA A 179 16.619 29.602 8.591 1.00 31.23 H new ATOM 0 HB3 ALA A 179 17.389 31.090 7.991 1.00 31.23 H new ATOM 2383 N SER A 180 15.798 33.155 6.706 1.00 12.21 N ATOM 2384 CA SER A 180 15.695 34.599 6.532 1.00 53.34 C ATOM 2385 C SER A 180 14.314 34.986 6.010 1.00 42.21 C ATOM 2386 O SER A 180 13.790 36.052 6.337 1.00 21.11 O ATOM 2387 CB SER A 180 16.774 35.096 5.568 1.00 3.32 C ATOM 2388 OG SER A 180 16.953 36.497 5.682 1.00 44.42 O ATOM 0 H SER A 180 16.478 32.704 6.094 1.00 12.21 H new ATOM 0 HA SER A 180 15.842 35.069 7.505 1.00 53.34 H new ATOM 0 HB2 SER A 180 17.715 34.588 5.777 1.00 3.32 H new ATOM 0 HB3 SER A 180 16.496 34.844 4.545 1.00 3.32 H new ATOM 0 HG SER A 180 17.750 36.767 5.180 1.00 44.42 H new ATOM 2394 N LEU A 181 13.730 34.113 5.196 1.00 3.35 N ATOM 2395 CA LEU A 181 12.410 34.362 4.628 1.00 30.11 C ATOM 2396 C LEU A 181 11.312 34.010 5.627 1.00 61.33 C ATOM 2397 O LEU A 181 10.213 34.561 5.576 1.00 53.02 O ATOM 2398 CB LEU A 181 12.225 33.552 3.343 1.00 4.44 C ATOM 2399 CG LEU A 181 13.215 33.848 2.216 1.00 52.33 C ATOM 2400 CD1 LEU A 181 13.198 32.731 1.184 1.00 23.22 C ATOM 2401 CD2 LEU A 181 12.894 35.185 1.562 1.00 25.41 C ATOM 0 H LEU A 181 14.150 33.227 4.915 1.00 3.35 H new ATOM 0 HA LEU A 181 12.336 35.424 4.395 1.00 30.11 H new ATOM 0 HB2 LEU A 181 12.294 32.493 3.591 1.00 4.44 H new ATOM 0 HB3 LEU A 181 11.216 33.727 2.969 1.00 4.44 H new ATOM 0 HG LEU A 181 14.216 33.906 2.643 1.00 52.33 H new ATOM 0 HD11 LEU A 181 13.909 32.959 0.390 1.00 23.22 H new ATOM 0 HD12 LEU A 181 13.476 31.791 1.661 1.00 23.22 H new ATOM 0 HD13 LEU A 181 12.197 32.642 0.761 1.00 23.22 H new ATOM 0 HD21 LEU A 181 13.608 35.380 0.762 1.00 25.41 H new ATOM 0 HD22 LEU A 181 11.886 35.155 1.149 1.00 25.41 H new ATOM 0 HD23 LEU A 181 12.958 35.979 2.306 1.00 25.41 H new ATOM 2413 N SER A 182 11.619 33.089 6.535 1.00 12.34 N ATOM 2414 CA SER A 182 10.658 32.662 7.545 1.00 13.34 C ATOM 2415 C SER A 182 10.379 33.785 8.540 1.00 44.42 C ATOM 2416 O SER A 182 9.230 34.171 8.752 1.00 74.12 O ATOM 2417 CB SER A 182 11.178 31.428 8.285 1.00 14.11 C ATOM 2418 OG SER A 182 10.165 30.853 9.093 1.00 51.33 O ATOM 0 H SER A 182 12.525 32.624 6.592 1.00 12.34 H new ATOM 0 HA SER A 182 9.726 32.408 7.039 1.00 13.34 H new ATOM 0 HB2 SER A 182 11.535 30.692 7.565 1.00 14.11 H new ATOM 0 HB3 SER A 182 12.030 31.705 8.906 1.00 14.11 H new ATOM 0 HG SER A 182 10.522 30.065 9.554 1.00 51.33 H new ATOM 2424 N ASP A 183 11.440 34.306 9.147 1.00 63.15 N ATOM 2425 CA ASP A 183 11.312 35.386 10.118 1.00 22.22 C ATOM 2426 C ASP A 183 12.644 36.104 10.312 1.00 63.43 C ATOM 2427 O ASP A 183 13.077 36.337 11.441 1.00 34.44 O ATOM 2428 CB ASP A 183 10.814 34.839 11.457 1.00 11.30 C ATOM 2429 CG ASP A 183 9.970 35.845 12.215 1.00 3.41 C ATOM 2430 OD1 ASP A 183 8.948 36.300 11.660 1.00 22.22 O ATOM 2431 OD2 ASP A 183 10.333 36.179 13.363 1.00 53.11 O ATOM 0 H ASP A 183 12.398 33.998 8.983 1.00 63.15 H new ATOM 0 HA ASP A 183 10.586 36.103 9.734 1.00 22.22 H new ATOM 0 HB2 ASP A 183 10.229 33.936 11.282 1.00 11.30 H new ATOM 0 HB3 ASP A 183 11.669 34.551 12.069 1.00 11.30 H new TER 2436 ASP A 183