USER MOD reduce.3.24.130724 H: found=0, std=0, add=1138, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1135 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 Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 148:sc= 0.643 (180deg=0.164) USER MOD Single : A 2 ASN : amide:sc= -0.191 X(o=-0.19,f=-0.21) USER MOD Single : A 9 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 11 THR OG1 : rot 180:sc= 0.0292 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 22 GLN : amide:sc= -1.51! C(o=-1.5!,f=-2.8!) USER MOD Single : A 27 THR OG1 : rot 180:sc= -0.739 USER MOD Single : A 30 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 31 MET CE :methyl -143:sc= -4.4 (180deg=-8.41!) USER MOD Single : A 32 ASN : amide:sc= -0.025 X(o=-0.025,f=-0.36) USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ 146:sc= -0.0154 (180deg=-0.514) USER MOD Single : A 38 MET CE :methyl 167:sc= -0.928 (180deg=-1.46) USER MOD Single : A 43 MET CE :methyl -132:sc= -0.351 (180deg=-5.07!) USER MOD Single : A 44 LYS NZ :NH3+ 145:sc= -0.229 (180deg=-1.55) USER MOD Single : A 45 LYS NZ :NH3+ -151:sc= 0.8 (180deg=0.431) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 47 LYS NZ :NH3+ -158:sc= -0.0215 (180deg=-0.222) USER MOD Single : A 51 LYS NZ :NH3+ 178:sc= 0.353 (180deg=0.35) USER MOD Single : A 52 THR OG1 : rot 180:sc= 0.48 USER MOD Single : A 53 ASN : amide:sc= -0.0234 K(o=-0.023,f=-1.2) USER MOD Single : A 54 LYS NZ :NH3+ -153:sc= -0.134 (180deg=-0.782) USER MOD Single : A 55 GLN : amide:sc= -0.0895 X(o=-0.089,f=-0.18) USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 66 ASN : amide:sc= -1.13 K(o=-1.1,f=-4.9!) USER MOD Single : A 72 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0243) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 THR OG1 : rot 180:sc= 0.0274 USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 THR OG1 : rot 180:sc= -0.0678 USER MOD Single : A 92 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 94 GLN : amide:sc= -3.06 X(o=-3.1,f=-3.5) USER MOD Single : A 100 SER OG : rot -140:sc= -0.349 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 CYS SG : rot 82:sc= -1.21 USER MOD Single : A 110 HIS : no HD1:sc= -1.46 K(o=-1.5,f=-3.1) USER MOD Single : A 119 CYS SG : rot 142:sc= -0.148 USER MOD Single : A 123 THR OG1 : rot 180:sc= -0.315 USER MOD Single : A 125 TYR OH : rot 86:sc= 0.951 USER MOD Single : A 126 TYR OH : rot -140:sc= -0.769 USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD Single : A 130 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -1.181 -1.288 -5.625 1.00 44.12 N ATOM 2 CA MET A 1 -0.084 -1.341 -6.586 1.00 14.25 C ATOM 3 C MET A 1 1.208 -0.822 -5.964 1.00 24.21 C ATOM 4 O MET A 1 1.892 0.020 -6.544 1.00 24.03 O ATOM 5 CB MET A 1 -0.429 -0.522 -7.831 1.00 72.32 C ATOM 6 CG MET A 1 -1.489 -1.168 -8.709 1.00 32.34 C ATOM 7 SD MET A 1 -3.165 -0.727 -8.212 1.00 34.43 S ATOM 8 CE MET A 1 -3.983 -2.317 -8.330 1.00 3.21 C ATOM 0 H1 MET A 1 -2.074 -1.109 -6.127 1.00 44.12 H new ATOM 0 H2 MET A 1 -1.244 -2.195 -5.119 1.00 44.12 H new ATOM 0 H3 MET A 1 -1.008 -0.522 -4.943 1.00 44.12 H new ATOM 0 HA MET A 1 0.064 -2.382 -6.874 1.00 14.25 H new ATOM 0 HB2 MET A 1 -0.776 0.464 -7.522 1.00 72.32 H new ATOM 0 HB3 MET A 1 0.476 -0.372 -8.419 1.00 72.32 H new ATOM 0 HG2 MET A 1 -1.330 -0.867 -9.745 1.00 32.34 H new ATOM 0 HG3 MET A 1 -1.376 -2.251 -8.671 1.00 32.34 H new ATOM 0 HE1 MET A 1 -5.031 -2.208 -8.052 1.00 3.21 H new ATOM 0 HE2 MET A 1 -3.915 -2.686 -9.353 1.00 3.21 H new ATOM 0 HE3 MET A 1 -3.501 -3.025 -7.656 1.00 3.21 H new ATOM 18 N ASN A 2 1.537 -1.331 -4.781 1.00 15.14 N ATOM 19 CA ASN A 2 2.747 -0.918 -4.080 1.00 42.32 C ATOM 20 C ASN A 2 3.837 -1.978 -4.205 1.00 73.42 C ATOM 21 O ASN A 2 3.550 -3.174 -4.258 1.00 31.52 O ATOM 22 CB ASN A 2 2.443 -0.655 -2.604 1.00 52.30 C ATOM 23 CG ASN A 2 1.606 -1.755 -1.981 1.00 72.33 C ATOM 24 OD1 ASN A 2 0.379 -1.663 -1.928 1.00 63.24 O ATOM 25 ND2 ASN A 2 2.267 -2.804 -1.506 1.00 21.14 N ATOM 0 H ASN A 2 0.982 -2.030 -4.288 1.00 15.14 H new ATOM 0 HA ASN A 2 3.106 0.003 -4.539 1.00 42.32 H new ATOM 0 HB2 ASN A 2 3.379 -0.559 -2.054 1.00 52.30 H new ATOM 0 HB3 ASN A 2 1.918 0.296 -2.508 1.00 52.30 H new ATOM 0 HD21 ASN A 2 1.757 -3.576 -1.076 1.00 21.14 H new ATOM 0 HD22 ASN A 2 3.284 -2.838 -1.571 1.00 21.14 H new ATOM 32 N ASP A 3 5.087 -1.532 -4.251 1.00 51.45 N ATOM 33 CA ASP A 3 6.220 -2.442 -4.368 1.00 43.24 C ATOM 34 C ASP A 3 7.078 -2.407 -3.107 1.00 74.01 C ATOM 35 O ASP A 3 7.738 -1.408 -2.821 1.00 52.31 O ATOM 36 CB ASP A 3 7.070 -2.079 -5.587 1.00 54.35 C ATOM 37 CG ASP A 3 6.239 -1.518 -6.725 1.00 63.45 C ATOM 38 OD1 ASP A 3 5.173 -2.097 -7.023 1.00 42.14 O ATOM 39 OD2 ASP A 3 6.655 -0.501 -7.318 1.00 1.24 O ATOM 0 H ASP A 3 5.342 -0.545 -4.209 1.00 51.45 H new ATOM 0 HA ASP A 3 5.831 -3.452 -4.494 1.00 43.24 H new ATOM 0 HB2 ASP A 3 7.824 -1.347 -5.296 1.00 54.35 H new ATOM 0 HB3 ASP A 3 7.603 -2.965 -5.932 1.00 54.35 H new ATOM 44 N ILE A 4 7.061 -3.503 -2.357 1.00 24.35 N ATOM 45 CA ILE A 4 7.837 -3.598 -1.126 1.00 42.42 C ATOM 46 C ILE A 4 8.859 -4.726 -1.206 1.00 24.30 C ATOM 47 O ILE A 4 8.688 -5.681 -1.965 1.00 14.44 O ATOM 48 CB ILE A 4 6.929 -3.828 0.096 1.00 72.41 C ATOM 49 CG1 ILE A 4 5.713 -4.670 -0.297 1.00 14.41 C ATOM 50 CG2 ILE A 4 6.490 -2.498 0.689 1.00 41.34 C ATOM 51 CD1 ILE A 4 6.072 -6.037 -0.834 1.00 31.41 C ATOM 0 H ILE A 4 6.519 -4.338 -2.580 1.00 24.35 H new ATOM 0 HA ILE A 4 8.357 -2.648 -1.007 1.00 42.42 H new ATOM 0 HB ILE A 4 7.495 -4.371 0.853 1.00 72.41 H new ATOM 0 HG12 ILE A 4 5.067 -4.789 0.573 1.00 14.41 H new ATOM 0 HG13 ILE A 4 5.137 -4.132 -1.050 1.00 14.41 H new ATOM 0 HG21 ILE A 4 5.849 -2.678 1.552 1.00 41.34 H new ATOM 0 HG22 ILE A 4 7.367 -1.931 1.001 1.00 41.34 H new ATOM 0 HG23 ILE A 4 5.939 -1.930 -0.060 1.00 41.34 H new ATOM 0 HD11 ILE A 4 5.161 -6.577 -1.092 1.00 31.41 H new ATOM 0 HD12 ILE A 4 6.693 -5.927 -1.723 1.00 31.41 H new ATOM 0 HD13 ILE A 4 6.621 -6.593 -0.075 1.00 31.41 H new ATOM 63 N ARG A 5 9.923 -4.611 -0.417 1.00 34.31 N ATOM 64 CA ARG A 5 10.973 -5.622 -0.398 1.00 33.54 C ATOM 65 C ARG A 5 10.388 -7.009 -0.142 1.00 41.40 C ATOM 66 O ARG A 5 9.279 -7.139 0.377 1.00 22.11 O ATOM 67 CB ARG A 5 12.011 -5.289 0.675 1.00 21.53 C ATOM 68 CG ARG A 5 13.045 -4.270 0.226 1.00 24.23 C ATOM 69 CD ARG A 5 12.398 -2.945 -0.144 1.00 75.45 C ATOM 70 NE ARG A 5 11.562 -2.424 0.934 1.00 74.23 N ATOM 71 CZ ARG A 5 10.790 -1.350 0.811 1.00 33.05 C ATOM 72 NH1 ARG A 5 10.747 -0.687 -0.336 1.00 25.01 N ATOM 73 NH2 ARG A 5 10.058 -0.937 1.838 1.00 35.43 N ATOM 0 H ARG A 5 10.080 -3.828 0.217 1.00 34.31 H new ATOM 0 HA ARG A 5 11.457 -5.625 -1.374 1.00 33.54 H new ATOM 0 HB2 ARG A 5 11.499 -4.909 1.559 1.00 21.53 H new ATOM 0 HB3 ARG A 5 12.521 -6.205 0.972 1.00 21.53 H new ATOM 0 HG2 ARG A 5 13.771 -4.111 1.023 1.00 24.23 H new ATOM 0 HG3 ARG A 5 13.593 -4.660 -0.631 1.00 24.23 H new ATOM 0 HD2 ARG A 5 13.173 -2.218 -0.385 1.00 75.45 H new ATOM 0 HD3 ARG A 5 11.793 -3.075 -1.041 1.00 75.45 H new ATOM 0 HE ARG A 5 11.571 -2.911 1.830 1.00 74.23 H new ATOM 0 HH11 ARG A 5 11.308 -1.001 -1.128 1.00 25.01 H new ATOM 0 HH12 ARG A 5 10.153 0.137 -0.427 1.00 25.01 H new ATOM 0 HH21 ARG A 5 10.088 -1.444 2.722 1.00 35.43 H new ATOM 0 HH22 ARG A 5 9.465 -0.112 1.743 1.00 35.43 H new ATOM 87 N ILE A 6 11.141 -8.040 -0.510 1.00 50.44 N ATOM 88 CA ILE A 6 10.698 -9.415 -0.320 1.00 74.05 C ATOM 89 C ILE A 6 11.573 -10.139 0.696 1.00 22.44 C ATOM 90 O ILE A 6 11.138 -11.097 1.337 1.00 52.44 O ATOM 91 CB ILE A 6 10.713 -10.200 -1.646 1.00 1.43 C ATOM 92 CG1 ILE A 6 11.927 -9.799 -2.487 1.00 30.14 C ATOM 93 CG2 ILE A 6 9.424 -9.960 -2.418 1.00 45.01 C ATOM 94 CD1 ILE A 6 11.671 -8.614 -3.392 1.00 32.45 C ATOM 0 H ILE A 6 12.061 -7.949 -0.941 1.00 50.44 H new ATOM 0 HA ILE A 6 9.675 -9.368 0.053 1.00 74.05 H new ATOM 0 HB ILE A 6 10.786 -11.264 -1.421 1.00 1.43 H new ATOM 0 HG12 ILE A 6 12.758 -9.565 -1.822 1.00 30.14 H new ATOM 0 HG13 ILE A 6 12.235 -10.650 -3.095 1.00 30.14 H new ATOM 0 HG21 ILE A 6 9.450 -10.521 -3.352 1.00 45.01 H new ATOM 0 HG22 ILE A 6 8.575 -10.290 -1.820 1.00 45.01 H new ATOM 0 HG23 ILE A 6 9.323 -8.897 -2.636 1.00 45.01 H new ATOM 0 HD11 ILE A 6 12.575 -8.386 -3.958 1.00 32.45 H new ATOM 0 HD12 ILE A 6 10.861 -8.851 -4.082 1.00 32.45 H new ATOM 0 HD13 ILE A 6 11.393 -7.749 -2.789 1.00 32.45 H new ATOM 106 N VAL A 7 12.810 -9.675 0.842 1.00 42.15 N ATOM 107 CA VAL A 7 13.747 -10.276 1.783 1.00 21.30 C ATOM 108 C VAL A 7 14.786 -9.262 2.248 1.00 14.15 C ATOM 109 O VAL A 7 15.772 -8.987 1.564 1.00 32.45 O ATOM 110 CB VAL A 7 14.470 -11.486 1.161 1.00 52.44 C ATOM 111 CG1 VAL A 7 13.516 -12.662 1.016 1.00 11.43 C ATOM 112 CG2 VAL A 7 15.074 -11.110 -0.184 1.00 60.51 C ATOM 0 H VAL A 7 13.187 -8.884 0.320 1.00 42.15 H new ATOM 0 HA VAL A 7 13.162 -10.612 2.639 1.00 21.30 H new ATOM 0 HB VAL A 7 15.279 -11.786 1.827 1.00 52.44 H new ATOM 0 HG11 VAL A 7 14.045 -13.507 0.575 1.00 11.43 H new ATOM 0 HG12 VAL A 7 13.135 -12.944 1.997 1.00 11.43 H new ATOM 0 HG13 VAL A 7 12.684 -12.378 0.372 1.00 11.43 H new ATOM 0 HG21 VAL A 7 15.581 -11.976 -0.610 1.00 60.51 H new ATOM 0 HG22 VAL A 7 14.283 -10.784 -0.860 1.00 60.51 H new ATOM 0 HG23 VAL A 7 15.791 -10.301 -0.047 1.00 60.51 H new ATOM 122 N PRO A 8 14.561 -8.690 3.441 1.00 25.51 N ATOM 123 CA PRO A 8 15.468 -7.698 4.026 1.00 14.40 C ATOM 124 C PRO A 8 16.796 -8.309 4.459 1.00 52.12 C ATOM 125 O PRO A 8 16.958 -9.529 4.455 1.00 50.25 O ATOM 126 CB PRO A 8 14.694 -7.184 5.243 1.00 75.32 C ATOM 127 CG PRO A 8 13.775 -8.299 5.605 1.00 33.53 C ATOM 128 CD PRO A 8 13.406 -8.970 4.311 1.00 65.13 C ATOM 0 HA PRO A 8 15.734 -6.919 3.312 1.00 14.40 H new ATOM 0 HB2 PRO A 8 15.366 -6.942 6.066 1.00 75.32 H new ATOM 0 HB3 PRO A 8 14.140 -6.276 5.005 1.00 75.32 H new ATOM 0 HG2 PRO A 8 14.261 -9.000 6.283 1.00 33.53 H new ATOM 0 HG3 PRO A 8 12.889 -7.923 6.116 1.00 33.53 H new ATOM 0 HD2 PRO A 8 13.252 -10.041 4.443 1.00 65.13 H new ATOM 0 HD3 PRO A 8 12.483 -8.564 3.897 1.00 65.13 H new ATOM 136 N GLN A 9 17.742 -7.453 4.832 1.00 61.42 N ATOM 137 CA GLN A 9 19.056 -7.911 5.267 1.00 4.11 C ATOM 138 C GLN A 9 18.959 -8.672 6.585 1.00 12.23 C ATOM 139 O GLN A 9 17.954 -8.582 7.292 1.00 62.33 O ATOM 140 CB GLN A 9 20.008 -6.723 5.419 1.00 25.43 C ATOM 141 CG GLN A 9 19.562 -5.716 6.466 1.00 12.22 C ATOM 142 CD GLN A 9 20.587 -4.624 6.700 1.00 51.52 C ATOM 143 OE1 GLN A 9 20.845 -3.800 5.821 1.00 14.04 O ATOM 144 NE2 GLN A 9 21.178 -4.611 7.889 1.00 42.43 N ATOM 0 H GLN A 9 17.623 -6.440 4.842 1.00 61.42 H new ATOM 0 HA GLN A 9 19.448 -8.587 4.507 1.00 4.11 H new ATOM 0 HB2 GLN A 9 20.999 -7.093 5.682 1.00 25.43 H new ATOM 0 HB3 GLN A 9 20.102 -6.218 4.458 1.00 25.43 H new ATOM 0 HG2 GLN A 9 18.621 -5.264 6.152 1.00 12.22 H new ATOM 0 HG3 GLN A 9 19.369 -6.235 7.405 1.00 12.22 H new ATOM 0 HE21 GLN A 9 20.934 -5.313 8.588 1.00 42.43 H new ATOM 0 HE22 GLN A 9 21.876 -3.899 8.104 1.00 42.43 H new ATOM 153 N ILE A 10 20.008 -9.420 6.910 1.00 52.03 N ATOM 154 CA ILE A 10 20.040 -10.196 8.143 1.00 11.34 C ATOM 155 C ILE A 10 21.243 -9.816 9.000 1.00 13.14 C ATOM 156 O ILE A 10 22.391 -10.032 8.611 1.00 73.53 O ATOM 157 CB ILE A 10 20.085 -11.708 7.856 1.00 23.14 C ATOM 158 CG1 ILE A 10 21.017 -11.998 6.678 1.00 41.01 C ATOM 159 CG2 ILE A 10 18.686 -12.236 7.575 1.00 65.00 C ATOM 160 CD1 ILE A 10 21.876 -13.228 6.875 1.00 52.42 C ATOM 0 H ILE A 10 20.847 -9.505 6.336 1.00 52.03 H new ATOM 0 HA ILE A 10 19.123 -9.965 8.685 1.00 11.34 H new ATOM 0 HB ILE A 10 20.474 -12.219 8.737 1.00 23.14 H new ATOM 0 HG12 ILE A 10 20.420 -12.123 5.775 1.00 41.01 H new ATOM 0 HG13 ILE A 10 21.663 -11.136 6.516 1.00 41.01 H new ATOM 0 HG21 ILE A 10 18.735 -13.306 7.374 1.00 65.00 H new ATOM 0 HG22 ILE A 10 18.049 -12.058 8.441 1.00 65.00 H new ATOM 0 HG23 ILE A 10 18.271 -11.722 6.708 1.00 65.00 H new ATOM 0 HD11 ILE A 10 22.511 -13.372 6.001 1.00 52.42 H new ATOM 0 HD12 ILE A 10 22.500 -13.098 7.759 1.00 52.42 H new ATOM 0 HD13 ILE A 10 21.237 -14.101 7.007 1.00 52.42 H new ATOM 172 N THR A 11 20.972 -9.249 10.172 1.00 23.12 N ATOM 173 CA THR A 11 22.031 -8.840 11.086 1.00 45.53 C ATOM 174 C THR A 11 22.531 -10.019 11.913 1.00 53.23 C ATOM 175 O THR A 11 22.149 -11.164 11.672 1.00 60.14 O ATOM 176 CB THR A 11 21.554 -7.726 12.037 1.00 52.24 C ATOM 177 OG1 THR A 11 20.283 -7.226 11.606 1.00 11.21 O ATOM 178 CG2 THR A 11 22.562 -6.588 12.086 1.00 11.45 C ATOM 0 H THR A 11 20.028 -9.063 10.510 1.00 23.12 H new ATOM 0 HA THR A 11 22.847 -8.459 10.472 1.00 45.53 H new ATOM 0 HB THR A 11 21.458 -8.148 13.037 1.00 52.24 H new ATOM 0 HG1 THR A 11 19.985 -6.519 12.216 1.00 11.21 H new ATOM 0 HG21 THR A 11 22.203 -5.813 12.764 1.00 11.45 H new ATOM 0 HG22 THR A 11 23.521 -6.966 12.442 1.00 11.45 H new ATOM 0 HG23 THR A 11 22.685 -6.168 11.088 1.00 11.45 H new ATOM 186 N ASP A 12 23.385 -9.731 12.889 1.00 71.34 N ATOM 187 CA ASP A 12 23.935 -10.769 13.753 1.00 2.32 C ATOM 188 C ASP A 12 22.820 -11.564 14.425 1.00 62.43 C ATOM 189 O ASP A 12 23.002 -12.729 14.778 1.00 45.03 O ATOM 190 CB ASP A 12 24.846 -10.148 14.814 1.00 70.41 C ATOM 191 CG ASP A 12 24.176 -10.056 16.171 1.00 73.54 C ATOM 192 OD1 ASP A 12 24.227 -11.049 16.927 1.00 65.21 O ATOM 193 OD2 ASP A 12 23.600 -8.992 16.477 1.00 40.45 O ATOM 0 H ASP A 12 23.711 -8.788 13.102 1.00 71.34 H new ATOM 0 HA ASP A 12 24.520 -11.450 13.135 1.00 2.32 H new ATOM 0 HB2 ASP A 12 25.755 -10.743 14.901 1.00 70.41 H new ATOM 0 HB3 ASP A 12 25.146 -9.151 14.492 1.00 70.41 H new ATOM 198 N GLU A 13 21.667 -10.927 14.598 1.00 12.44 N ATOM 199 CA GLU A 13 20.524 -11.575 15.230 1.00 75.34 C ATOM 200 C GLU A 13 20.084 -12.800 14.432 1.00 25.24 C ATOM 201 O GLU A 13 19.550 -13.758 14.991 1.00 41.51 O ATOM 202 CB GLU A 13 19.358 -10.592 15.358 1.00 20.31 C ATOM 203 CG GLU A 13 19.725 -9.304 16.076 1.00 74.22 C ATOM 204 CD GLU A 13 18.640 -8.250 15.973 1.00 53.24 C ATOM 205 OE1 GLU A 13 17.557 -8.452 16.561 1.00 61.00 O ATOM 206 OE2 GLU A 13 18.874 -7.222 15.303 1.00 1.10 O ATOM 0 H GLU A 13 21.499 -9.963 14.310 1.00 12.44 H new ATOM 0 HA GLU A 13 20.828 -11.899 16.225 1.00 75.34 H new ATOM 0 HB2 GLU A 13 18.987 -10.350 14.362 1.00 20.31 H new ATOM 0 HB3 GLU A 13 18.542 -11.077 15.894 1.00 20.31 H new ATOM 0 HG2 GLU A 13 19.918 -9.520 17.127 1.00 74.22 H new ATOM 0 HG3 GLU A 13 20.651 -8.910 15.657 1.00 74.22 H new ATOM 213 N GLU A 14 20.314 -12.761 13.124 1.00 40.35 N ATOM 214 CA GLU A 14 19.941 -13.867 12.249 1.00 11.45 C ATOM 215 C GLU A 14 21.177 -14.623 11.771 1.00 31.13 C ATOM 216 O GLU A 14 21.171 -15.851 11.681 1.00 54.13 O ATOM 217 CB GLU A 14 19.148 -13.350 11.047 1.00 65.33 C ATOM 218 CG GLU A 14 17.863 -12.634 11.427 1.00 44.05 C ATOM 219 CD GLU A 14 16.933 -13.503 12.250 1.00 54.11 C ATOM 220 OE1 GLU A 14 17.000 -14.742 12.110 1.00 70.15 O ATOM 221 OE2 GLU A 14 16.137 -12.944 13.034 1.00 62.52 O ATOM 0 H GLU A 14 20.757 -11.976 12.646 1.00 40.35 H new ATOM 0 HA GLU A 14 19.315 -14.553 12.819 1.00 11.45 H new ATOM 0 HB2 GLU A 14 19.777 -12.669 10.473 1.00 65.33 H new ATOM 0 HB3 GLU A 14 18.907 -14.189 10.394 1.00 65.33 H new ATOM 0 HG2 GLU A 14 18.106 -11.733 11.991 1.00 44.05 H new ATOM 0 HG3 GLU A 14 17.348 -12.314 10.521 1.00 44.05 H new ATOM 228 N PHE A 15 22.236 -13.881 11.466 1.00 42.01 N ATOM 229 CA PHE A 15 23.479 -14.480 10.995 1.00 25.33 C ATOM 230 C PHE A 15 23.988 -15.525 11.984 1.00 2.14 C ATOM 231 O PHE A 15 24.525 -16.560 11.590 1.00 22.54 O ATOM 232 CB PHE A 15 24.543 -13.401 10.784 1.00 0.45 C ATOM 233 CG PHE A 15 25.945 -13.939 10.751 1.00 50.32 C ATOM 234 CD1 PHE A 15 26.674 -14.082 11.920 1.00 22.22 C ATOM 235 CD2 PHE A 15 26.533 -14.301 9.550 1.00 23.41 C ATOM 236 CE1 PHE A 15 27.965 -14.576 11.892 1.00 74.21 C ATOM 237 CE2 PHE A 15 27.823 -14.797 9.516 1.00 44.55 C ATOM 238 CZ PHE A 15 28.539 -14.935 10.688 1.00 25.03 C ATOM 0 H PHE A 15 22.258 -12.864 11.537 1.00 42.01 H new ATOM 0 HA PHE A 15 23.278 -14.973 10.044 1.00 25.33 H new ATOM 0 HB2 PHE A 15 24.340 -12.880 9.848 1.00 0.45 H new ATOM 0 HB3 PHE A 15 24.464 -12.663 11.583 1.00 0.45 H new ATOM 0 HD1 PHE A 15 26.229 -13.804 12.864 1.00 22.22 H new ATOM 0 HD2 PHE A 15 25.977 -14.195 8.630 1.00 23.41 H new ATOM 0 HE1 PHE A 15 28.524 -14.681 12.810 1.00 74.21 H new ATOM 0 HE2 PHE A 15 28.270 -15.076 8.573 1.00 44.55 H new ATOM 0 HZ PHE A 15 29.547 -15.323 10.664 1.00 25.03 H new ATOM 248 N LYS A 16 23.816 -15.245 13.272 1.00 72.32 N ATOM 249 CA LYS A 16 24.256 -16.159 14.319 1.00 33.13 C ATOM 250 C LYS A 16 23.165 -17.172 14.651 1.00 32.30 C ATOM 251 O LYS A 16 23.349 -18.042 15.503 1.00 34.31 O ATOM 252 CB LYS A 16 24.641 -15.378 15.578 1.00 54.23 C ATOM 253 CG LYS A 16 23.453 -15.002 16.447 1.00 2.11 C ATOM 254 CD LYS A 16 23.379 -15.867 17.694 1.00 20.10 C ATOM 255 CE LYS A 16 24.265 -15.323 18.804 1.00 40.51 C ATOM 256 NZ LYS A 16 23.544 -15.251 20.105 1.00 72.32 N ATOM 0 H LYS A 16 23.375 -14.392 13.615 1.00 72.32 H new ATOM 0 HA LYS A 16 25.129 -16.698 13.952 1.00 33.13 H new ATOM 0 HB2 LYS A 16 25.337 -15.975 16.167 1.00 54.23 H new ATOM 0 HB3 LYS A 16 25.168 -14.470 15.285 1.00 54.23 H new ATOM 0 HG2 LYS A 16 23.529 -13.953 16.734 1.00 2.11 H new ATOM 0 HG3 LYS A 16 22.533 -15.110 15.873 1.00 2.11 H new ATOM 0 HD2 LYS A 16 22.347 -15.917 18.042 1.00 20.10 H new ATOM 0 HD3 LYS A 16 23.683 -16.885 17.450 1.00 20.10 H new ATOM 0 HE2 LYS A 16 25.144 -15.958 18.911 1.00 40.51 H new ATOM 0 HE3 LYS A 16 24.621 -14.330 18.531 1.00 40.51 H new ATOM 0 HZ1 LYS A 16 24.182 -14.875 20.835 1.00 72.32 H new ATOM 0 HZ2 LYS A 16 22.719 -14.625 20.011 1.00 72.32 H new ATOM 0 HZ3 LYS A 16 23.226 -16.203 20.379 1.00 72.32 H new ATOM 270 N THR A 17 22.028 -17.055 13.971 1.00 21.25 N ATOM 271 CA THR A 17 20.908 -17.961 14.194 1.00 50.33 C ATOM 272 C THR A 17 21.130 -19.293 13.488 1.00 71.42 C ATOM 273 O THR A 17 20.325 -20.216 13.617 1.00 72.14 O ATOM 274 CB THR A 17 19.583 -17.347 13.703 1.00 43.24 C ATOM 275 OG1 THR A 17 18.527 -17.667 14.615 1.00 41.01 O ATOM 276 CG2 THR A 17 19.233 -17.858 12.313 1.00 15.43 C ATOM 0 H THR A 17 21.859 -16.342 13.262 1.00 21.25 H new ATOM 0 HA THR A 17 20.846 -18.129 15.269 1.00 50.33 H new ATOM 0 HB THR A 17 19.705 -16.265 13.655 1.00 43.24 H new ATOM 0 HG1 THR A 17 17.689 -17.272 14.296 1.00 41.01 H new ATOM 0 HG21 THR A 17 18.294 -17.411 11.987 1.00 15.43 H new ATOM 0 HG22 THR A 17 20.025 -17.587 11.615 1.00 15.43 H new ATOM 0 HG23 THR A 17 19.129 -18.943 12.340 1.00 15.43 H new ATOM 284 N ILE A 18 22.226 -19.388 12.743 1.00 50.43 N ATOM 285 CA ILE A 18 22.554 -20.609 12.018 1.00 32.00 C ATOM 286 C ILE A 18 23.846 -21.228 12.540 1.00 30.01 C ATOM 287 O ILE A 18 24.745 -20.537 13.019 1.00 3.11 O ATOM 288 CB ILE A 18 22.698 -20.346 10.507 1.00 15.04 C ATOM 289 CG1 ILE A 18 23.421 -19.020 10.265 1.00 13.40 C ATOM 290 CG2 ILE A 18 21.331 -20.340 9.838 1.00 22.53 C ATOM 291 CD1 ILE A 18 22.491 -17.881 9.909 1.00 0.44 C ATOM 0 H ILE A 18 22.902 -18.633 12.626 1.00 50.43 H new ATOM 0 HA ILE A 18 21.729 -21.303 12.181 1.00 32.00 H new ATOM 0 HB ILE A 18 23.292 -21.148 10.068 1.00 15.04 H new ATOM 0 HG12 ILE A 18 23.983 -18.753 11.160 1.00 13.40 H new ATOM 0 HG13 ILE A 18 24.145 -19.152 9.461 1.00 13.40 H new ATOM 0 HG21 ILE A 18 21.449 -20.153 8.771 1.00 22.53 H new ATOM 0 HG22 ILE A 18 20.849 -21.307 9.986 1.00 22.53 H new ATOM 0 HG23 ILE A 18 20.714 -19.556 10.278 1.00 22.53 H new ATOM 0 HD11 ILE A 18 23.072 -16.972 9.751 1.00 0.44 H new ATOM 0 HD12 ILE A 18 21.947 -18.127 8.997 1.00 0.44 H new ATOM 0 HD13 ILE A 18 21.783 -17.722 10.722 1.00 0.44 H new ATOM 303 N PRO A 19 23.944 -22.562 12.445 1.00 74.33 N ATOM 304 CA PRO A 19 25.123 -23.304 12.900 1.00 60.30 C ATOM 305 C PRO A 19 26.341 -23.054 12.018 1.00 64.11 C ATOM 306 O PRO A 19 26.212 -22.798 10.821 1.00 62.04 O ATOM 307 CB PRO A 19 24.682 -24.767 12.800 1.00 2.25 C ATOM 308 CG PRO A 19 23.616 -24.771 11.760 1.00 62.22 C ATOM 309 CD PRO A 19 22.910 -23.449 11.885 1.00 63.45 C ATOM 0 HA PRO A 19 25.431 -23.005 13.902 1.00 60.30 H new ATOM 0 HB2 PRO A 19 25.513 -25.413 12.517 1.00 2.25 H new ATOM 0 HB3 PRO A 19 24.305 -25.133 13.755 1.00 2.25 H new ATOM 0 HG2 PRO A 19 24.043 -24.893 10.764 1.00 62.22 H new ATOM 0 HG3 PRO A 19 22.924 -25.599 11.914 1.00 62.22 H new ATOM 0 HD2 PRO A 19 22.553 -23.091 10.919 1.00 63.45 H new ATOM 0 HD3 PRO A 19 22.041 -23.518 12.540 1.00 63.45 H new ATOM 317 N LYS A 20 27.525 -23.130 12.617 1.00 61.03 N ATOM 318 CA LYS A 20 28.768 -22.914 11.886 1.00 41.42 C ATOM 319 C LYS A 20 28.972 -23.993 10.828 1.00 60.04 C ATOM 320 O LYS A 20 29.696 -23.791 9.853 1.00 64.14 O ATOM 321 CB LYS A 20 29.956 -22.900 12.851 1.00 14.01 C ATOM 322 CG LYS A 20 31.300 -23.065 12.164 1.00 70.02 C ATOM 323 CD LYS A 20 32.398 -22.314 12.899 1.00 72.25 C ATOM 324 CE LYS A 20 32.485 -20.866 12.441 1.00 20.21 C ATOM 325 NZ LYS A 20 33.884 -20.356 12.479 1.00 54.04 N ATOM 0 H LYS A 20 27.650 -23.340 13.607 1.00 61.03 H new ATOM 0 HA LYS A 20 28.702 -21.948 11.386 1.00 41.42 H new ATOM 0 HB2 LYS A 20 29.953 -21.961 13.404 1.00 14.01 H new ATOM 0 HB3 LYS A 20 29.830 -23.700 13.581 1.00 14.01 H new ATOM 0 HG2 LYS A 20 31.555 -24.123 12.111 1.00 70.02 H new ATOM 0 HG3 LYS A 20 31.233 -22.701 11.139 1.00 70.02 H new ATOM 0 HD2 LYS A 20 32.207 -22.347 13.972 1.00 72.25 H new ATOM 0 HD3 LYS A 20 33.355 -22.808 12.730 1.00 72.25 H new ATOM 0 HE2 LYS A 20 32.095 -20.782 11.427 1.00 20.21 H new ATOM 0 HE3 LYS A 20 31.855 -20.245 13.077 1.00 20.21 H new ATOM 0 HZ1 LYS A 20 33.902 -19.366 12.160 1.00 54.04 H new ATOM 0 HZ2 LYS A 20 34.248 -20.413 13.452 1.00 54.04 H new ATOM 0 HZ3 LYS A 20 34.481 -20.932 11.852 1.00 54.04 H new ATOM 339 N TYR A 21 28.328 -25.138 11.025 1.00 2.13 N ATOM 340 CA TYR A 21 28.440 -26.249 10.088 1.00 30.42 C ATOM 341 C TYR A 21 27.896 -25.862 8.716 1.00 31.25 C ATOM 342 O TYR A 21 28.165 -26.531 7.719 1.00 4.02 O ATOM 343 CB TYR A 21 27.689 -27.471 10.621 1.00 13.41 C ATOM 344 CG TYR A 21 28.036 -27.819 12.051 1.00 41.12 C ATOM 345 CD1 TYR A 21 29.329 -28.190 12.402 1.00 55.34 C ATOM 346 CD2 TYR A 21 27.072 -27.778 13.051 1.00 63.35 C ATOM 347 CE1 TYR A 21 29.651 -28.509 13.706 1.00 34.54 C ATOM 348 CE2 TYR A 21 27.386 -28.095 14.358 1.00 14.01 C ATOM 349 CZ TYR A 21 28.676 -28.460 14.681 1.00 31.11 C ATOM 350 OH TYR A 21 28.992 -28.778 15.982 1.00 13.32 O ATOM 0 H TYR A 21 27.723 -25.321 11.825 1.00 2.13 H new ATOM 0 HA TYR A 21 29.496 -26.497 9.983 1.00 30.42 H new ATOM 0 HB2 TYR A 21 26.617 -27.287 10.551 1.00 13.41 H new ATOM 0 HB3 TYR A 21 27.908 -28.328 9.984 1.00 13.41 H new ATOM 0 HD1 TYR A 21 30.095 -28.229 11.641 1.00 55.34 H new ATOM 0 HD2 TYR A 21 26.060 -27.493 12.802 1.00 63.35 H new ATOM 0 HE1 TYR A 21 30.661 -28.795 13.962 1.00 34.54 H new ATOM 0 HE2 TYR A 21 26.625 -28.057 15.123 1.00 14.01 H new ATOM 0 HH TYR A 21 28.193 -28.692 16.543 1.00 13.32 H new ATOM 360 N GLN A 22 27.129 -24.777 8.676 1.00 62.31 N ATOM 361 CA GLN A 22 26.547 -24.300 7.427 1.00 32.32 C ATOM 362 C GLN A 22 27.252 -23.037 6.945 1.00 11.44 C ATOM 363 O GLN A 22 27.349 -22.787 5.743 1.00 21.31 O ATOM 364 CB GLN A 22 25.053 -24.027 7.608 1.00 34.33 C ATOM 365 CG GLN A 22 24.291 -25.193 8.217 1.00 75.41 C ATOM 366 CD GLN A 22 23.780 -26.166 7.172 1.00 52.30 C ATOM 367 OE1 GLN A 22 24.530 -26.612 6.304 1.00 72.35 O ATOM 368 NE2 GLN A 22 22.497 -26.500 7.250 1.00 11.45 N ATOM 0 H GLN A 22 26.896 -24.212 9.493 1.00 62.31 H new ATOM 0 HA GLN A 22 26.679 -25.077 6.674 1.00 32.32 H new ATOM 0 HB2 GLN A 22 24.927 -23.150 8.243 1.00 34.33 H new ATOM 0 HB3 GLN A 22 24.616 -23.785 6.639 1.00 34.33 H new ATOM 0 HG2 GLN A 22 24.941 -25.722 8.914 1.00 75.41 H new ATOM 0 HG3 GLN A 22 23.449 -24.810 8.794 1.00 75.41 H new ATOM 0 HE21 GLN A 22 21.911 -26.106 7.986 1.00 11.45 H new ATOM 0 HE22 GLN A 22 22.097 -27.150 6.574 1.00 11.45 H new ATOM 377 N LEU A 23 27.742 -22.242 7.890 1.00 11.13 N ATOM 378 CA LEU A 23 28.438 -21.003 7.562 1.00 4.35 C ATOM 379 C LEU A 23 29.686 -21.283 6.730 1.00 14.22 C ATOM 380 O LEU A 23 29.830 -20.775 5.619 1.00 72.00 O ATOM 381 CB LEU A 23 28.822 -20.256 8.841 1.00 31.45 C ATOM 382 CG LEU A 23 27.673 -19.921 9.793 1.00 51.21 C ATOM 383 CD1 LEU A 23 28.209 -19.351 11.097 1.00 51.30 C ATOM 384 CD2 LEU A 23 26.707 -18.944 9.139 1.00 52.22 C ATOM 0 H LEU A 23 27.670 -22.433 8.889 1.00 11.13 H new ATOM 0 HA LEU A 23 27.763 -20.381 6.974 1.00 4.35 H new ATOM 0 HB2 LEU A 23 29.553 -20.856 9.383 1.00 31.45 H new ATOM 0 HB3 LEU A 23 29.318 -19.327 8.560 1.00 31.45 H new ATOM 0 HG LEU A 23 27.133 -20.841 10.018 1.00 51.21 H new ATOM 0 HD11 LEU A 23 27.377 -19.119 11.762 1.00 51.30 H new ATOM 0 HD12 LEU A 23 28.861 -20.083 11.574 1.00 51.30 H new ATOM 0 HD13 LEU A 23 28.774 -18.442 10.892 1.00 51.30 H new ATOM 0 HD21 LEU A 23 25.896 -18.717 9.830 1.00 52.22 H new ATOM 0 HD22 LEU A 23 27.235 -18.025 8.885 1.00 52.22 H new ATOM 0 HD23 LEU A 23 26.297 -19.389 8.233 1.00 52.22 H new ATOM 396 N GLY A 24 30.584 -22.097 7.276 1.00 45.14 N ATOM 397 CA GLY A 24 31.807 -22.432 6.569 1.00 72.41 C ATOM 398 C GLY A 24 32.644 -21.211 6.247 1.00 42.32 C ATOM 399 O GLY A 24 32.772 -20.826 5.084 1.00 34.12 O ATOM 0 H GLY A 24 30.487 -22.530 8.194 1.00 45.14 H new ATOM 0 HA2 GLY A 24 32.395 -23.122 7.174 1.00 72.41 H new ATOM 0 HA3 GLY A 24 31.557 -22.952 5.644 1.00 72.41 H new ATOM 403 N ARG A 25 33.215 -20.598 7.279 1.00 44.15 N ATOM 404 CA ARG A 25 34.042 -19.411 7.100 1.00 45.33 C ATOM 405 C ARG A 25 33.202 -18.229 6.623 1.00 22.53 C ATOM 406 O ARG A 25 33.737 -17.206 6.194 1.00 61.44 O ATOM 407 CB ARG A 25 35.163 -19.690 6.097 1.00 64.31 C ATOM 408 CG ARG A 25 35.835 -21.039 6.295 1.00 70.44 C ATOM 409 CD ARG A 25 37.035 -21.204 5.375 1.00 21.44 C ATOM 410 NE ARG A 25 37.380 -22.609 5.172 1.00 55.14 N ATOM 411 CZ ARG A 25 36.756 -23.400 4.306 1.00 63.24 C ATOM 412 NH1 ARG A 25 35.762 -22.927 3.567 1.00 63.13 N ATOM 413 NH2 ARG A 25 37.127 -24.668 4.177 1.00 4.31 N ATOM 0 H ARG A 25 33.120 -20.904 8.247 1.00 44.15 H new ATOM 0 HA ARG A 25 34.481 -19.157 8.065 1.00 45.33 H new ATOM 0 HB2 ARG A 25 34.756 -19.641 5.087 1.00 64.31 H new ATOM 0 HB3 ARG A 25 35.914 -18.904 6.176 1.00 64.31 H new ATOM 0 HG2 ARG A 25 36.154 -21.139 7.332 1.00 70.44 H new ATOM 0 HG3 ARG A 25 35.117 -21.836 6.104 1.00 70.44 H new ATOM 0 HD2 ARG A 25 36.820 -20.741 4.412 1.00 21.44 H new ATOM 0 HD3 ARG A 25 37.891 -20.678 5.798 1.00 21.44 H new ATOM 0 HE ARG A 25 38.141 -23.004 5.725 1.00 55.14 H new ATOM 0 HH11 ARG A 25 35.474 -21.953 3.662 1.00 63.13 H new ATOM 0 HH12 ARG A 25 35.285 -23.537 2.903 1.00 63.13 H new ATOM 0 HH21 ARG A 25 37.892 -25.036 4.743 1.00 4.31 H new ATOM 0 HH22 ARG A 25 36.647 -25.275 3.512 1.00 4.31 H new ATOM 427 N LEU A 26 31.884 -18.378 6.702 1.00 45.22 N ATOM 428 CA LEU A 26 30.969 -17.324 6.278 1.00 3.43 C ATOM 429 C LEU A 26 30.988 -16.158 7.262 1.00 23.33 C ATOM 430 O LEU A 26 31.347 -16.322 8.429 1.00 12.21 O ATOM 431 CB LEU A 26 29.548 -17.875 6.151 1.00 23.42 C ATOM 432 CG LEU A 26 29.053 -18.132 4.728 1.00 72.34 C ATOM 433 CD1 LEU A 26 27.773 -18.953 4.748 1.00 73.02 C ATOM 434 CD2 LEU A 26 28.834 -16.817 3.994 1.00 71.33 C ATOM 0 H LEU A 26 31.425 -19.218 7.055 1.00 45.22 H new ATOM 0 HA LEU A 26 31.299 -16.960 5.305 1.00 3.43 H new ATOM 0 HB2 LEU A 26 29.491 -18.810 6.708 1.00 23.42 H new ATOM 0 HB3 LEU A 26 28.864 -17.175 6.631 1.00 23.42 H new ATOM 0 HG LEU A 26 29.816 -18.700 4.195 1.00 72.34 H new ATOM 0 HD11 LEU A 26 27.436 -19.126 3.726 1.00 73.02 H new ATOM 0 HD12 LEU A 26 27.962 -19.910 5.235 1.00 73.02 H new ATOM 0 HD13 LEU A 26 27.003 -18.412 5.298 1.00 73.02 H new ATOM 0 HD21 LEU A 26 28.482 -17.019 2.983 1.00 71.33 H new ATOM 0 HD22 LEU A 26 28.090 -16.223 4.525 1.00 71.33 H new ATOM 0 HD23 LEU A 26 29.773 -16.265 3.948 1.00 71.33 H new ATOM 446 N THR A 27 30.598 -14.981 6.785 1.00 50.53 N ATOM 447 CA THR A 27 30.569 -13.788 7.622 1.00 41.23 C ATOM 448 C THR A 27 29.322 -12.954 7.348 1.00 23.43 C ATOM 449 O THR A 27 28.765 -12.994 6.251 1.00 50.24 O ATOM 450 CB THR A 27 31.817 -12.913 7.397 1.00 71.32 C ATOM 451 OG1 THR A 27 32.375 -13.178 6.105 1.00 73.52 O ATOM 452 CG2 THR A 27 32.863 -13.176 8.470 1.00 74.21 C ATOM 0 H THR A 27 30.297 -14.828 5.822 1.00 50.53 H new ATOM 0 HA THR A 27 30.555 -14.129 8.657 1.00 41.23 H new ATOM 0 HB THR A 27 31.515 -11.867 7.454 1.00 71.32 H new ATOM 0 HG1 THR A 27 33.167 -12.617 5.969 1.00 73.52 H new ATOM 0 HG21 THR A 27 33.735 -12.547 8.290 1.00 74.21 H new ATOM 0 HG22 THR A 27 32.445 -12.945 9.450 1.00 74.21 H new ATOM 0 HG23 THR A 27 33.160 -14.224 8.440 1.00 74.21 H new ATOM 460 N LEU A 28 28.889 -12.200 8.352 1.00 2.21 N ATOM 461 CA LEU A 28 27.707 -11.355 8.220 1.00 43.15 C ATOM 462 C LEU A 28 27.786 -10.502 6.957 1.00 5.05 C ATOM 463 O LEU A 28 26.792 -10.322 6.256 1.00 52.40 O ATOM 464 CB LEU A 28 27.558 -10.456 9.448 1.00 5.20 C ATOM 465 CG LEU A 28 26.193 -10.481 10.137 1.00 45.44 C ATOM 466 CD1 LEU A 28 26.358 -10.582 11.645 1.00 23.50 C ATOM 467 CD2 LEU A 28 25.388 -9.243 9.769 1.00 71.13 C ATOM 0 H LEU A 28 29.338 -12.156 9.267 1.00 2.21 H new ATOM 0 HA LEU A 28 26.834 -12.003 8.145 1.00 43.15 H new ATOM 0 HB2 LEU A 28 28.316 -10.742 10.177 1.00 5.20 H new ATOM 0 HB3 LEU A 28 27.774 -9.430 9.150 1.00 5.20 H new ATOM 0 HG LEU A 28 25.649 -11.360 9.792 1.00 45.44 H new ATOM 0 HD11 LEU A 28 25.376 -10.598 12.118 1.00 23.50 H new ATOM 0 HD12 LEU A 28 26.895 -11.498 11.892 1.00 23.50 H new ATOM 0 HD13 LEU A 28 26.921 -9.722 12.008 1.00 23.50 H new ATOM 0 HD21 LEU A 28 24.420 -9.277 10.268 1.00 71.13 H new ATOM 0 HD22 LEU A 28 25.928 -8.351 10.085 1.00 71.13 H new ATOM 0 HD23 LEU A 28 25.239 -9.213 8.690 1.00 71.13 H new ATOM 479 N GLU A 29 28.977 -9.982 6.675 1.00 53.24 N ATOM 480 CA GLU A 29 29.185 -9.149 5.496 1.00 61.12 C ATOM 481 C GLU A 29 28.868 -9.924 4.220 1.00 43.43 C ATOM 482 O GLU A 29 28.316 -9.373 3.268 1.00 40.21 O ATOM 483 CB GLU A 29 30.627 -8.640 5.452 1.00 65.31 C ATOM 484 CG GLU A 29 30.947 -7.823 4.212 1.00 51.52 C ATOM 485 CD GLU A 29 31.305 -6.385 4.537 1.00 61.41 C ATOM 486 OE1 GLU A 29 32.503 -6.109 4.757 1.00 10.51 O ATOM 487 OE2 GLU A 29 30.389 -5.538 4.572 1.00 74.14 O ATOM 0 H GLU A 29 29.811 -10.123 7.246 1.00 53.24 H new ATOM 0 HA GLU A 29 28.509 -8.297 5.560 1.00 61.12 H new ATOM 0 HB2 GLU A 29 30.816 -8.031 6.336 1.00 65.31 H new ATOM 0 HB3 GLU A 29 31.306 -9.492 5.501 1.00 65.31 H new ATOM 0 HG2 GLU A 29 31.776 -8.288 3.679 1.00 51.52 H new ATOM 0 HG3 GLU A 29 30.088 -7.837 3.541 1.00 51.52 H new ATOM 494 N MET A 30 29.223 -11.204 4.208 1.00 21.44 N ATOM 495 CA MET A 30 28.976 -12.055 3.050 1.00 63.10 C ATOM 496 C MET A 30 27.480 -12.270 2.842 1.00 25.22 C ATOM 497 O MET A 30 26.980 -12.172 1.722 1.00 13.44 O ATOM 498 CB MET A 30 29.678 -13.404 3.222 1.00 42.41 C ATOM 499 CG MET A 30 31.194 -13.314 3.147 1.00 12.42 C ATOM 500 SD MET A 30 31.983 -14.933 3.083 1.00 24.33 S ATOM 501 CE MET A 30 33.681 -14.470 2.749 1.00 11.52 C ATOM 0 H MET A 30 29.683 -11.675 4.987 1.00 21.44 H new ATOM 0 HA MET A 30 29.379 -11.554 2.170 1.00 63.10 H new ATOM 0 HB2 MET A 30 29.395 -13.832 4.184 1.00 42.41 H new ATOM 0 HB3 MET A 30 29.324 -14.089 2.452 1.00 42.41 H new ATOM 0 HG2 MET A 30 31.477 -12.741 2.264 1.00 12.42 H new ATOM 0 HG3 MET A 30 31.565 -12.767 4.014 1.00 12.42 H new ATOM 0 HE1 MET A 30 34.296 -15.367 2.681 1.00 11.52 H new ATOM 0 HE2 MET A 30 33.731 -13.924 1.807 1.00 11.52 H new ATOM 0 HE3 MET A 30 34.051 -13.837 3.556 1.00 11.52 H new ATOM 511 N MET A 31 26.773 -12.565 3.928 1.00 0.41 N ATOM 512 CA MET A 31 25.334 -12.793 3.864 1.00 41.44 C ATOM 513 C MET A 31 24.582 -11.475 3.704 1.00 34.43 C ATOM 514 O MET A 31 23.503 -11.434 3.114 1.00 11.23 O ATOM 515 CB MET A 31 24.854 -13.519 5.122 1.00 43.41 C ATOM 516 CG MET A 31 25.456 -14.904 5.291 1.00 24.01 C ATOM 517 SD MET A 31 24.776 -15.789 6.707 1.00 73.11 S ATOM 518 CE MET A 31 23.102 -16.091 6.145 1.00 41.23 C ATOM 0 H MET A 31 27.173 -12.652 4.862 1.00 0.41 H new ATOM 0 HA MET A 31 25.128 -13.416 2.994 1.00 41.44 H new ATOM 0 HB2 MET A 31 25.100 -12.916 5.996 1.00 43.41 H new ATOM 0 HB3 MET A 31 23.768 -13.605 5.090 1.00 43.41 H new ATOM 0 HG2 MET A 31 25.280 -15.485 4.386 1.00 24.01 H new ATOM 0 HG3 MET A 31 26.536 -14.815 5.408 1.00 24.01 H new ATOM 0 HE1 MET A 31 22.414 -15.999 6.985 1.00 41.23 H new ATOM 0 HE2 MET A 31 22.838 -15.362 5.379 1.00 41.23 H new ATOM 0 HE3 MET A 31 23.034 -17.096 5.728 1.00 41.23 H new ATOM 528 N ASN A 32 25.158 -10.402 4.235 1.00 41.35 N ATOM 529 CA ASN A 32 24.541 -9.083 4.151 1.00 33.05 C ATOM 530 C ASN A 32 24.457 -8.612 2.703 1.00 42.22 C ATOM 531 O ASN A 32 23.449 -8.045 2.282 1.00 44.02 O ATOM 532 CB ASN A 32 25.333 -8.073 4.983 1.00 1.44 C ATOM 533 CG ASN A 32 24.991 -6.638 4.630 1.00 63.01 C ATOM 534 OD1 ASN A 32 25.571 -6.058 3.711 1.00 31.44 O ATOM 535 ND2 ASN A 32 24.046 -6.058 5.360 1.00 73.10 N ATOM 0 H ASN A 32 26.051 -10.420 4.728 1.00 41.35 H new ATOM 0 HA ASN A 32 23.529 -9.157 4.549 1.00 33.05 H new ATOM 0 HB2 ASN A 32 25.133 -8.242 6.041 1.00 1.44 H new ATOM 0 HB3 ASN A 32 26.400 -8.238 4.830 1.00 1.44 H new ATOM 0 HD21 ASN A 32 23.774 -5.094 5.169 1.00 73.10 H new ATOM 0 HD22 ASN A 32 23.592 -6.577 6.112 1.00 73.10 H new ATOM 542 N GLU A 33 25.523 -8.851 1.946 1.00 65.21 N ATOM 543 CA GLU A 33 25.570 -8.451 0.545 1.00 41.25 C ATOM 544 C GLU A 33 24.813 -9.445 -0.331 1.00 22.40 C ATOM 545 O GLU A 33 24.274 -9.082 -1.377 1.00 34.54 O ATOM 546 CB GLU A 33 27.021 -8.339 0.071 1.00 12.11 C ATOM 547 CG GLU A 33 27.824 -9.615 0.262 1.00 55.22 C ATOM 548 CD GLU A 33 29.320 -9.379 0.192 1.00 12.34 C ATOM 549 OE1 GLU A 33 29.813 -9.017 -0.897 1.00 14.44 O ATOM 550 OE2 GLU A 33 29.998 -9.556 1.226 1.00 54.11 O ATOM 0 H GLU A 33 26.365 -9.320 2.279 1.00 65.21 H new ATOM 0 HA GLU A 33 25.090 -7.476 0.457 1.00 41.25 H new ATOM 0 HB2 GLU A 33 27.030 -8.069 -0.985 1.00 12.11 H new ATOM 0 HB3 GLU A 33 27.509 -7.528 0.611 1.00 12.11 H new ATOM 0 HG2 GLU A 33 27.574 -10.056 1.227 1.00 55.22 H new ATOM 0 HG3 GLU A 33 27.538 -10.338 -0.502 1.00 55.22 H new ATOM 557 N ILE A 34 24.779 -10.701 0.104 1.00 52.52 N ATOM 558 CA ILE A 34 24.088 -11.747 -0.639 1.00 62.24 C ATOM 559 C ILE A 34 22.576 -11.560 -0.576 1.00 42.01 C ATOM 560 O ILE A 34 21.890 -11.613 -1.597 1.00 11.12 O ATOM 561 CB ILE A 34 24.444 -13.146 -0.103 1.00 72.52 C ATOM 562 CG1 ILE A 34 25.860 -13.536 -0.531 1.00 42.24 C ATOM 563 CG2 ILE A 34 23.435 -14.174 -0.594 1.00 51.12 C ATOM 564 CD1 ILE A 34 26.465 -14.638 0.310 1.00 15.24 C ATOM 0 H ILE A 34 25.222 -11.018 0.967 1.00 52.52 H new ATOM 0 HA ILE A 34 24.418 -11.669 -1.675 1.00 62.24 H new ATOM 0 HB ILE A 34 24.408 -13.121 0.986 1.00 72.52 H new ATOM 0 HG12 ILE A 34 25.841 -13.855 -1.573 1.00 42.24 H new ATOM 0 HG13 ILE A 34 26.502 -12.656 -0.479 1.00 42.24 H new ATOM 0 HG21 ILE A 34 23.700 -15.158 -0.207 1.00 51.12 H new ATOM 0 HG22 ILE A 34 22.439 -13.902 -0.244 1.00 51.12 H new ATOM 0 HG23 ILE A 34 23.442 -14.199 -1.684 1.00 51.12 H new ATOM 0 HD11 ILE A 34 27.469 -14.862 -0.051 1.00 15.24 H new ATOM 0 HD12 ILE A 34 26.517 -14.315 1.350 1.00 15.24 H new ATOM 0 HD13 ILE A 34 25.846 -15.532 0.238 1.00 15.24 H new ATOM 576 N VAL A 35 22.063 -11.339 0.630 1.00 54.11 N ATOM 577 CA VAL A 35 20.632 -11.140 0.827 1.00 73.52 C ATOM 578 C VAL A 35 20.191 -9.773 0.317 1.00 62.04 C ATOM 579 O VAL A 35 19.061 -9.604 -0.142 1.00 22.44 O ATOM 580 CB VAL A 35 20.246 -11.271 2.312 1.00 2.43 C ATOM 581 CG1 VAL A 35 18.734 -11.290 2.472 1.00 74.51 C ATOM 582 CG2 VAL A 35 20.871 -12.519 2.917 1.00 12.10 C ATOM 0 H VAL A 35 22.617 -11.293 1.485 1.00 54.11 H new ATOM 0 HA VAL A 35 20.124 -11.918 0.257 1.00 73.52 H new ATOM 0 HB VAL A 35 20.632 -10.404 2.847 1.00 2.43 H new ATOM 0 HG11 VAL A 35 18.481 -11.383 3.528 1.00 74.51 H new ATOM 0 HG12 VAL A 35 18.315 -10.364 2.079 1.00 74.51 H new ATOM 0 HG13 VAL A 35 18.321 -12.137 1.924 1.00 74.51 H new ATOM 0 HG21 VAL A 35 20.588 -12.596 3.967 1.00 12.10 H new ATOM 0 HG22 VAL A 35 20.518 -13.400 2.381 1.00 12.10 H new ATOM 0 HG23 VAL A 35 21.956 -12.457 2.838 1.00 12.10 H new ATOM 592 N SER A 36 21.092 -8.799 0.399 1.00 54.32 N ATOM 593 CA SER A 36 20.795 -7.444 -0.052 1.00 0.13 C ATOM 594 C SER A 36 20.664 -7.393 -1.571 1.00 0.01 C ATOM 595 O SER A 36 19.685 -6.870 -2.105 1.00 23.34 O ATOM 596 CB SER A 36 21.889 -6.479 0.410 1.00 62.32 C ATOM 597 OG SER A 36 21.938 -5.330 -0.417 1.00 53.33 O ATOM 0 H SER A 36 22.033 -8.923 0.773 1.00 54.32 H new ATOM 0 HA SER A 36 19.844 -7.142 0.387 1.00 0.13 H new ATOM 0 HB2 SER A 36 21.703 -6.181 1.442 1.00 62.32 H new ATOM 0 HB3 SER A 36 22.855 -6.984 0.393 1.00 62.32 H new ATOM 0 HG SER A 36 22.644 -4.729 -0.100 1.00 53.33 H new ATOM 603 N LYS A 37 21.658 -7.940 -2.263 1.00 11.24 N ATOM 604 CA LYS A 37 21.656 -7.959 -3.721 1.00 31.34 C ATOM 605 C LYS A 37 20.474 -8.764 -4.252 1.00 65.33 C ATOM 606 O LYS A 37 19.701 -8.278 -5.076 1.00 52.25 O ATOM 607 CB LYS A 37 22.967 -8.550 -4.245 1.00 74.10 C ATOM 608 CG LYS A 37 23.314 -8.103 -5.654 1.00 64.13 C ATOM 609 CD LYS A 37 23.584 -6.609 -5.715 1.00 15.21 C ATOM 610 CE LYS A 37 24.882 -6.247 -5.010 1.00 60.41 C ATOM 611 NZ LYS A 37 24.642 -5.735 -3.633 1.00 15.22 N ATOM 0 H LYS A 37 22.476 -8.376 -1.837 1.00 11.24 H new ATOM 0 HA LYS A 37 21.561 -6.932 -4.074 1.00 31.34 H new ATOM 0 HB2 LYS A 37 23.777 -8.268 -3.573 1.00 74.10 H new ATOM 0 HB3 LYS A 37 22.900 -9.638 -4.224 1.00 74.10 H new ATOM 0 HG2 LYS A 37 24.192 -8.647 -6.003 1.00 64.13 H new ATOM 0 HG3 LYS A 37 22.495 -8.353 -6.328 1.00 64.13 H new ATOM 0 HD2 LYS A 37 23.633 -6.289 -6.756 1.00 15.21 H new ATOM 0 HD3 LYS A 37 22.756 -6.070 -5.255 1.00 15.21 H new ATOM 0 HE2 LYS A 37 25.527 -7.125 -4.964 1.00 60.41 H new ATOM 0 HE3 LYS A 37 25.412 -5.492 -5.591 1.00 60.41 H new ATOM 0 HZ1 LYS A 37 25.422 -6.030 -3.012 1.00 15.22 H new ATOM 0 HZ2 LYS A 37 24.589 -4.697 -3.653 1.00 15.22 H new ATOM 0 HZ3 LYS A 37 23.746 -6.120 -3.271 1.00 15.22 H new ATOM 625 N MET A 38 20.341 -9.997 -3.774 1.00 61.12 N ATOM 626 CA MET A 38 19.252 -10.868 -4.200 1.00 53.12 C ATOM 627 C MET A 38 17.906 -10.163 -4.062 1.00 2.25 C ATOM 628 O MET A 38 17.075 -10.207 -4.969 1.00 21.33 O ATOM 629 CB MET A 38 19.251 -12.159 -3.379 1.00 42.21 C ATOM 630 CG MET A 38 20.460 -13.044 -3.638 1.00 13.14 C ATOM 631 SD MET A 38 20.638 -14.352 -2.409 1.00 42.23 S ATOM 632 CE MET A 38 18.923 -14.676 -2.008 1.00 10.30 C ATOM 0 H MET A 38 20.974 -10.415 -3.092 1.00 61.12 H new ATOM 0 HA MET A 38 19.407 -11.114 -5.250 1.00 53.12 H new ATOM 0 HB2 MET A 38 19.216 -11.906 -2.319 1.00 42.21 H new ATOM 0 HB3 MET A 38 18.344 -12.721 -3.602 1.00 42.21 H new ATOM 0 HG2 MET A 38 20.373 -13.491 -4.629 1.00 13.14 H new ATOM 0 HG3 MET A 38 21.361 -12.430 -3.643 1.00 13.14 H new ATOM 0 HE1 MET A 38 18.851 -15.605 -1.443 1.00 10.30 H new ATOM 0 HE2 MET A 38 18.528 -13.855 -1.409 1.00 10.30 H new ATOM 0 HE3 MET A 38 18.345 -14.765 -2.928 1.00 10.30 H new ATOM 642 N ASP A 39 17.698 -9.514 -2.921 1.00 44.44 N ATOM 643 CA ASP A 39 16.454 -8.798 -2.665 1.00 33.44 C ATOM 644 C ASP A 39 16.265 -7.661 -3.664 1.00 35.04 C ATOM 645 O ASP A 39 15.138 -7.324 -4.029 1.00 44.41 O ATOM 646 CB ASP A 39 16.442 -8.248 -1.238 1.00 0.32 C ATOM 647 CG ASP A 39 15.120 -7.600 -0.878 1.00 55.42 C ATOM 648 OD1 ASP A 39 14.151 -7.758 -1.651 1.00 21.21 O ATOM 649 OD2 ASP A 39 15.053 -6.934 0.176 1.00 34.44 O ATOM 0 H ASP A 39 18.375 -9.469 -2.159 1.00 44.44 H new ATOM 0 HA ASP A 39 15.629 -9.500 -2.782 1.00 33.44 H new ATOM 0 HB2 ASP A 39 16.649 -9.058 -0.538 1.00 0.32 H new ATOM 0 HB3 ASP A 39 17.243 -7.518 -1.127 1.00 0.32 H new ATOM 654 N ASP A 40 17.373 -7.074 -4.100 1.00 41.42 N ATOM 655 CA ASP A 40 17.330 -5.974 -5.057 1.00 13.10 C ATOM 656 C ASP A 40 16.747 -6.435 -6.389 1.00 64.43 C ATOM 657 O ASP A 40 15.882 -5.774 -6.963 1.00 41.31 O ATOM 658 CB ASP A 40 18.731 -5.400 -5.270 1.00 41.42 C ATOM 659 CG ASP A 40 18.733 -4.212 -6.213 1.00 20.40 C ATOM 660 OD1 ASP A 40 17.996 -3.241 -5.945 1.00 34.23 O ATOM 661 OD2 ASP A 40 19.471 -4.255 -7.220 1.00 4.35 O ATOM 0 H ASP A 40 18.313 -7.341 -3.806 1.00 41.42 H new ATOM 0 HA ASP A 40 16.685 -5.195 -4.649 1.00 13.10 H new ATOM 0 HB2 ASP A 40 19.147 -5.098 -4.309 1.00 41.42 H new ATOM 0 HB3 ASP A 40 19.382 -6.178 -5.669 1.00 41.42 H new ATOM 666 N PHE A 41 17.229 -7.574 -6.877 1.00 33.11 N ATOM 667 CA PHE A 41 16.758 -8.123 -8.143 1.00 33.30 C ATOM 668 C PHE A 41 15.281 -8.499 -8.057 1.00 24.40 C ATOM 669 O PHE A 41 14.471 -8.073 -8.881 1.00 62.32 O ATOM 670 CB PHE A 41 17.586 -9.350 -8.531 1.00 43.40 C ATOM 671 CG PHE A 41 17.261 -9.885 -9.896 1.00 61.30 C ATOM 672 CD1 PHE A 41 16.648 -9.080 -10.843 1.00 22.53 C ATOM 673 CD2 PHE A 41 17.568 -11.194 -10.232 1.00 72.12 C ATOM 674 CE1 PHE A 41 16.348 -9.570 -12.100 1.00 31.20 C ATOM 675 CE2 PHE A 41 17.270 -11.689 -11.488 1.00 23.12 C ATOM 676 CZ PHE A 41 16.659 -10.877 -12.422 1.00 55.44 C ATOM 0 H PHE A 41 17.945 -8.134 -6.415 1.00 33.11 H new ATOM 0 HA PHE A 41 16.876 -7.356 -8.909 1.00 33.30 H new ATOM 0 HB2 PHE A 41 18.644 -9.091 -8.493 1.00 43.40 H new ATOM 0 HB3 PHE A 41 17.424 -10.136 -7.793 1.00 43.40 H new ATOM 0 HD1 PHE A 41 16.402 -8.058 -10.596 1.00 22.53 H new ATOM 0 HD2 PHE A 41 18.045 -11.834 -9.505 1.00 72.12 H new ATOM 0 HE1 PHE A 41 15.871 -8.932 -12.829 1.00 31.20 H new ATOM 0 HE2 PHE A 41 17.515 -12.711 -11.738 1.00 23.12 H new ATOM 0 HZ PHE A 41 16.424 -11.263 -13.403 1.00 55.44 H new ATOM 686 N LEU A 42 14.939 -9.301 -7.054 1.00 52.33 N ATOM 687 CA LEU A 42 13.560 -9.736 -6.859 1.00 41.14 C ATOM 688 C LEU A 42 12.647 -8.545 -6.583 1.00 62.54 C ATOM 689 O LEU A 42 11.486 -8.535 -6.989 1.00 55.42 O ATOM 690 CB LEU A 42 13.478 -10.735 -5.704 1.00 4.43 C ATOM 691 CG LEU A 42 12.906 -12.111 -6.045 1.00 42.12 C ATOM 692 CD1 LEU A 42 11.397 -12.034 -6.219 1.00 4.41 C ATOM 693 CD2 LEU A 42 13.562 -12.664 -7.302 1.00 30.20 C ATOM 0 H LEU A 42 15.597 -9.663 -6.364 1.00 52.33 H new ATOM 0 HA LEU A 42 13.225 -10.222 -7.775 1.00 41.14 H new ATOM 0 HB2 LEU A 42 14.480 -10.871 -5.296 1.00 4.43 H new ATOM 0 HB3 LEU A 42 12.869 -10.296 -4.914 1.00 4.43 H new ATOM 0 HG LEU A 42 13.121 -12.788 -5.218 1.00 42.12 H new ATOM 0 HD11 LEU A 42 11.008 -13.023 -6.461 1.00 4.41 H new ATOM 0 HD12 LEU A 42 10.942 -11.682 -5.294 1.00 4.41 H new ATOM 0 HD13 LEU A 42 11.159 -11.342 -7.027 1.00 4.41 H new ATOM 0 HD21 LEU A 42 13.143 -13.644 -7.530 1.00 30.20 H new ATOM 0 HD22 LEU A 42 13.378 -11.987 -8.136 1.00 30.20 H new ATOM 0 HD23 LEU A 42 14.636 -12.757 -7.141 1.00 30.20 H new ATOM 705 N MET A 43 13.182 -7.544 -5.893 1.00 30.05 N ATOM 706 CA MET A 43 12.416 -6.347 -5.566 1.00 11.14 C ATOM 707 C MET A 43 11.989 -5.612 -6.832 1.00 73.12 C ATOM 708 O MET A 43 10.872 -5.100 -6.919 1.00 22.31 O ATOM 709 CB MET A 43 13.240 -5.415 -4.675 1.00 63.40 C ATOM 710 CG MET A 43 12.569 -4.078 -4.409 1.00 43.43 C ATOM 711 SD MET A 43 10.908 -4.256 -3.732 1.00 31.33 S ATOM 712 CE MET A 43 10.487 -2.545 -3.411 1.00 61.02 C ATOM 0 H MET A 43 14.142 -7.537 -5.549 1.00 30.05 H new ATOM 0 HA MET A 43 11.521 -6.656 -5.027 1.00 11.14 H new ATOM 0 HB2 MET A 43 13.432 -5.911 -3.724 1.00 63.40 H new ATOM 0 HB3 MET A 43 14.208 -5.239 -5.144 1.00 63.40 H new ATOM 0 HG2 MET A 43 13.180 -3.501 -3.715 1.00 43.43 H new ATOM 0 HG3 MET A 43 12.519 -3.510 -5.338 1.00 43.43 H new ATOM 0 HE1 MET A 43 10.080 -2.453 -2.404 1.00 61.02 H new ATOM 0 HE2 MET A 43 11.381 -1.928 -3.499 1.00 61.02 H new ATOM 0 HE3 MET A 43 9.743 -2.211 -4.134 1.00 61.02 H new ATOM 722 N LYS A 44 12.884 -5.563 -7.813 1.00 32.21 N ATOM 723 CA LYS A 44 12.600 -4.892 -9.076 1.00 11.02 C ATOM 724 C LYS A 44 11.557 -5.663 -9.879 1.00 41.41 C ATOM 725 O LYS A 44 10.728 -5.070 -10.570 1.00 33.03 O ATOM 726 CB LYS A 44 13.883 -4.742 -9.897 1.00 13.43 C ATOM 727 CG LYS A 44 14.053 -5.812 -10.960 1.00 62.53 C ATOM 728 CD LYS A 44 15.476 -5.849 -11.492 1.00 2.21 C ATOM 729 CE LYS A 44 15.856 -4.535 -12.158 1.00 71.43 C ATOM 730 NZ LYS A 44 17.120 -4.653 -12.936 1.00 63.21 N ATOM 0 H LYS A 44 13.813 -5.980 -7.757 1.00 32.21 H new ATOM 0 HA LYS A 44 12.202 -3.902 -8.852 1.00 11.02 H new ATOM 0 HB2 LYS A 44 13.886 -3.763 -10.376 1.00 13.43 H new ATOM 0 HB3 LYS A 44 14.740 -4.771 -9.224 1.00 13.43 H new ATOM 0 HG2 LYS A 44 13.794 -6.785 -10.543 1.00 62.53 H new ATOM 0 HG3 LYS A 44 13.361 -5.623 -11.781 1.00 62.53 H new ATOM 0 HD2 LYS A 44 16.166 -6.057 -10.674 1.00 2.21 H new ATOM 0 HD3 LYS A 44 15.577 -6.664 -12.209 1.00 2.21 H new ATOM 0 HE2 LYS A 44 15.050 -4.217 -12.820 1.00 71.43 H new ATOM 0 HE3 LYS A 44 15.968 -3.762 -11.398 1.00 71.43 H new ATOM 0 HZ1 LYS A 44 17.063 -4.054 -13.784 1.00 63.21 H new ATOM 0 HZ2 LYS A 44 17.920 -4.345 -12.347 1.00 63.21 H new ATOM 0 HZ3 LYS A 44 17.261 -5.643 -13.221 1.00 63.21 H new ATOM 744 N LYS A 45 11.603 -6.987 -9.783 1.00 64.05 N ATOM 745 CA LYS A 45 10.661 -7.840 -10.499 1.00 4.33 C ATOM 746 C LYS A 45 9.231 -7.578 -10.037 1.00 5.15 C ATOM 747 O LYS A 45 8.351 -7.285 -10.846 1.00 4.02 O ATOM 748 CB LYS A 45 11.015 -9.314 -10.288 1.00 52.23 C ATOM 749 CG LYS A 45 9.906 -10.269 -10.694 1.00 71.04 C ATOM 750 CD LYS A 45 9.688 -10.264 -12.198 1.00 42.42 C ATOM 751 CE LYS A 45 8.939 -11.505 -12.657 1.00 54.13 C ATOM 752 NZ LYS A 45 9.168 -11.789 -14.101 1.00 22.20 N ATOM 0 H LYS A 45 12.283 -7.493 -9.216 1.00 64.05 H new ATOM 0 HA LYS A 45 10.730 -7.605 -11.561 1.00 4.33 H new ATOM 0 HB2 LYS A 45 11.913 -9.549 -10.860 1.00 52.23 H new ATOM 0 HB3 LYS A 45 11.255 -9.475 -9.237 1.00 52.23 H new ATOM 0 HG2 LYS A 45 10.155 -11.278 -10.365 1.00 71.04 H new ATOM 0 HG3 LYS A 45 8.981 -9.989 -10.190 1.00 71.04 H new ATOM 0 HD2 LYS A 45 9.127 -9.374 -12.482 1.00 42.42 H new ATOM 0 HD3 LYS A 45 10.651 -10.210 -12.706 1.00 42.42 H new ATOM 0 HE2 LYS A 45 9.258 -12.362 -12.063 1.00 54.13 H new ATOM 0 HE3 LYS A 45 7.872 -11.372 -12.478 1.00 54.13 H new ATOM 0 HZ1 LYS A 45 8.337 -12.275 -14.495 1.00 22.20 H new ATOM 0 HZ2 LYS A 45 9.320 -10.895 -14.611 1.00 22.20 H new ATOM 0 HZ3 LYS A 45 10.006 -12.395 -14.207 1.00 22.20 H new ATOM 766 N SER A 46 9.008 -7.684 -8.731 1.00 34.04 N ATOM 767 CA SER A 46 7.684 -7.461 -8.161 1.00 53.14 C ATOM 768 C SER A 46 7.230 -6.022 -8.388 1.00 44.21 C ATOM 769 O SER A 46 6.034 -5.730 -8.403 1.00 44.14 O ATOM 770 CB SER A 46 7.689 -7.776 -6.664 1.00 43.04 C ATOM 771 OG SER A 46 6.408 -8.194 -6.226 1.00 41.04 O ATOM 0 H SER A 46 9.727 -7.923 -8.048 1.00 34.04 H new ATOM 0 HA SER A 46 6.983 -8.128 -8.663 1.00 53.14 H new ATOM 0 HB2 SER A 46 8.420 -8.557 -6.456 1.00 43.04 H new ATOM 0 HB3 SER A 46 7.998 -6.893 -6.105 1.00 43.04 H new ATOM 0 HG SER A 46 6.438 -8.391 -5.266 1.00 41.04 H new ATOM 777 N LYS A 47 8.195 -5.125 -8.564 1.00 21.20 N ATOM 778 CA LYS A 47 7.898 -3.716 -8.791 1.00 42.13 C ATOM 779 C LYS A 47 7.341 -3.497 -10.194 1.00 41.33 C ATOM 780 O LYS A 47 6.556 -2.576 -10.423 1.00 42.14 O ATOM 781 CB LYS A 47 9.158 -2.870 -8.593 1.00 51.34 C ATOM 782 CG LYS A 47 9.726 -2.313 -9.887 1.00 51.42 C ATOM 783 CD LYS A 47 9.001 -1.047 -10.315 1.00 62.41 C ATOM 784 CE LYS A 47 9.979 0.053 -10.696 1.00 43.32 C ATOM 785 NZ LYS A 47 10.776 0.517 -9.527 1.00 13.15 N ATOM 0 H LYS A 47 9.190 -5.350 -8.554 1.00 21.20 H new ATOM 0 HA LYS A 47 7.143 -3.408 -8.067 1.00 42.13 H new ATOM 0 HB2 LYS A 47 8.928 -2.043 -7.921 1.00 51.34 H new ATOM 0 HB3 LYS A 47 9.920 -3.477 -8.103 1.00 51.34 H new ATOM 0 HG2 LYS A 47 10.787 -2.100 -9.758 1.00 51.42 H new ATOM 0 HG3 LYS A 47 9.645 -3.063 -10.674 1.00 51.42 H new ATOM 0 HD2 LYS A 47 8.351 -1.267 -11.162 1.00 62.41 H new ATOM 0 HD3 LYS A 47 8.361 -0.701 -9.504 1.00 62.41 H new ATOM 0 HE2 LYS A 47 10.652 -0.312 -11.472 1.00 43.32 H new ATOM 0 HE3 LYS A 47 9.431 0.895 -11.119 1.00 43.32 H new ATOM 0 HZ1 LYS A 47 11.141 1.473 -9.713 1.00 13.15 H new ATOM 0 HZ2 LYS A 47 10.172 0.535 -8.680 1.00 13.15 H new ATOM 0 HZ3 LYS A 47 11.573 -0.133 -9.370 1.00 13.15 H new ATOM 799 N ILE A 48 7.751 -4.348 -11.128 1.00 74.33 N ATOM 800 CA ILE A 48 7.290 -4.248 -12.508 1.00 32.35 C ATOM 801 C ILE A 48 5.929 -4.915 -12.682 1.00 44.33 C ATOM 802 O ILE A 48 5.115 -4.484 -13.500 1.00 42.01 O ATOM 803 CB ILE A 48 8.293 -4.891 -13.484 1.00 53.51 C ATOM 804 CG1 ILE A 48 9.371 -3.880 -13.880 1.00 3.15 C ATOM 805 CG2 ILE A 48 7.571 -5.413 -14.717 1.00 52.33 C ATOM 806 CD1 ILE A 48 10.707 -4.131 -13.215 1.00 40.23 C ATOM 0 H ILE A 48 8.401 -5.114 -10.955 1.00 74.33 H new ATOM 0 HA ILE A 48 7.203 -3.186 -12.736 1.00 32.35 H new ATOM 0 HB ILE A 48 8.775 -5.732 -12.986 1.00 53.51 H new ATOM 0 HG12 ILE A 48 9.502 -3.905 -14.962 1.00 3.15 H new ATOM 0 HG13 ILE A 48 9.029 -2.877 -13.624 1.00 3.15 H new ATOM 0 HG21 ILE A 48 8.293 -5.865 -15.397 1.00 52.33 H new ATOM 0 HG22 ILE A 48 6.836 -6.161 -14.419 1.00 52.33 H new ATOM 0 HG23 ILE A 48 7.066 -4.588 -15.219 1.00 52.33 H new ATOM 0 HD11 ILE A 48 11.423 -3.377 -13.541 1.00 40.23 H new ATOM 0 HD12 ILE A 48 10.591 -4.076 -12.133 1.00 40.23 H new ATOM 0 HD13 ILE A 48 11.071 -5.121 -13.491 1.00 40.23 H new ATOM 818 N LEU A 49 5.688 -5.967 -11.908 1.00 4.32 N ATOM 819 CA LEU A 49 4.425 -6.693 -11.975 1.00 12.22 C ATOM 820 C LEU A 49 3.260 -5.798 -11.563 1.00 22.13 C ATOM 821 O LEU A 49 2.104 -6.089 -11.865 1.00 14.22 O ATOM 822 CB LEU A 49 4.476 -7.929 -11.076 1.00 21.23 C ATOM 823 CG LEU A 49 5.731 -8.794 -11.195 1.00 22.30 C ATOM 824 CD1 LEU A 49 5.456 -10.205 -10.698 1.00 24.11 C ATOM 825 CD2 LEU A 49 6.226 -8.821 -12.634 1.00 10.32 C ATOM 0 H LEU A 49 6.351 -6.336 -11.226 1.00 4.32 H new ATOM 0 HA LEU A 49 4.270 -7.008 -13.007 1.00 12.22 H new ATOM 0 HB2 LEU A 49 4.380 -7.604 -10.040 1.00 21.23 H new ATOM 0 HB3 LEU A 49 3.608 -8.551 -11.297 1.00 21.23 H new ATOM 0 HG LEU A 49 6.511 -8.356 -10.572 1.00 22.30 H new ATOM 0 HD11 LEU A 49 6.361 -10.806 -10.790 1.00 24.11 H new ATOM 0 HD12 LEU A 49 5.149 -10.169 -9.653 1.00 24.11 H new ATOM 0 HD13 LEU A 49 4.661 -10.652 -11.294 1.00 24.11 H new ATOM 0 HD21 LEU A 49 7.120 -9.441 -12.700 1.00 10.32 H new ATOM 0 HD22 LEU A 49 5.450 -9.234 -13.278 1.00 10.32 H new ATOM 0 HD23 LEU A 49 6.464 -7.807 -12.956 1.00 10.32 H new ATOM 837 N GLY A 50 3.575 -4.706 -10.872 1.00 33.31 N ATOM 838 CA GLY A 50 2.544 -3.785 -10.431 1.00 50.45 C ATOM 839 C GLY A 50 2.586 -2.467 -11.180 1.00 2.03 C ATOM 840 O GLY A 50 1.549 -1.851 -11.428 1.00 23.24 O ATOM 0 H GLY A 50 4.525 -4.443 -10.610 1.00 33.31 H new ATOM 0 HA2 GLY A 50 1.566 -4.246 -10.568 1.00 50.45 H new ATOM 0 HA3 GLY A 50 2.661 -3.597 -9.364 1.00 50.45 H new ATOM 844 N LYS A 51 3.789 -2.031 -11.540 1.00 33.23 N ATOM 845 CA LYS A 51 3.964 -0.778 -12.264 1.00 14.32 C ATOM 846 C LYS A 51 3.069 -0.733 -13.498 1.00 70.24 C ATOM 847 O LYS A 51 2.451 -1.733 -13.867 1.00 41.32 O ATOM 848 CB LYS A 51 5.427 -0.602 -12.675 1.00 22.41 C ATOM 849 CG LYS A 51 6.081 0.634 -12.083 1.00 24.02 C ATOM 850 CD LYS A 51 6.033 0.617 -10.564 1.00 53.41 C ATOM 851 CE LYS A 51 6.726 1.835 -9.971 1.00 32.50 C ATOM 852 NZ LYS A 51 6.147 2.215 -8.653 1.00 32.12 N ATOM 0 H LYS A 51 4.657 -2.528 -11.342 1.00 33.23 H new ATOM 0 HA LYS A 51 3.679 0.038 -11.600 1.00 14.32 H new ATOM 0 HB2 LYS A 51 5.990 -1.483 -12.368 1.00 22.41 H new ATOM 0 HB3 LYS A 51 5.486 -0.549 -13.762 1.00 22.41 H new ATOM 0 HG2 LYS A 51 7.118 0.692 -12.415 1.00 24.02 H new ATOM 0 HG3 LYS A 51 5.577 1.526 -12.454 1.00 24.02 H new ATOM 0 HD2 LYS A 51 4.995 0.590 -10.232 1.00 53.41 H new ATOM 0 HD3 LYS A 51 6.510 -0.291 -10.194 1.00 53.41 H new ATOM 0 HE2 LYS A 51 7.790 1.627 -9.854 1.00 32.50 H new ATOM 0 HE3 LYS A 51 6.639 2.674 -10.661 1.00 32.50 H new ATOM 0 HZ1 LYS A 51 6.668 3.028 -8.266 1.00 32.12 H new ATOM 0 HZ2 LYS A 51 5.146 2.471 -8.774 1.00 32.12 H new ATOM 0 HZ3 LYS A 51 6.222 1.412 -7.996 1.00 32.12 H new ATOM 866 N THR A 52 3.005 0.432 -14.135 1.00 55.04 N ATOM 867 CA THR A 52 2.186 0.607 -15.329 1.00 21.54 C ATOM 868 C THR A 52 3.026 1.090 -16.506 1.00 32.45 C ATOM 869 O THR A 52 4.247 1.201 -16.404 1.00 53.44 O ATOM 870 CB THR A 52 1.042 1.608 -15.083 1.00 50.45 C ATOM 871 OG1 THR A 52 1.532 2.949 -15.197 1.00 40.02 O ATOM 872 CG2 THR A 52 0.428 1.402 -13.707 1.00 0.51 C ATOM 0 H THR A 52 3.511 1.269 -13.844 1.00 55.04 H new ATOM 0 HA THR A 52 1.760 -0.368 -15.567 1.00 21.54 H new ATOM 0 HB THR A 52 0.272 1.438 -15.835 1.00 50.45 H new ATOM 0 HG1 THR A 52 0.798 3.580 -15.041 1.00 40.02 H new ATOM 0 HG21 THR A 52 -0.378 2.121 -13.557 1.00 0.51 H new ATOM 0 HG22 THR A 52 0.030 0.390 -13.634 1.00 0.51 H new ATOM 0 HG23 THR A 52 1.191 1.547 -12.943 1.00 0.51 H new ATOM 880 N ASN A 53 2.363 1.375 -17.622 1.00 1.44 N ATOM 881 CA ASN A 53 3.050 1.847 -18.819 1.00 14.13 C ATOM 882 C ASN A 53 3.593 3.258 -18.614 1.00 14.10 C ATOM 883 O ASN A 53 4.373 3.759 -19.424 1.00 54.13 O ATOM 884 CB ASN A 53 2.101 1.823 -20.019 1.00 20.21 C ATOM 885 CG ASN A 53 1.841 0.416 -20.522 1.00 44.13 C ATOM 886 OD1 ASN A 53 2.709 -0.454 -20.442 1.00 12.11 O ATOM 887 ND2 ASN A 53 0.643 0.187 -21.045 1.00 74.24 N ATOM 0 H ASN A 53 1.352 1.287 -17.723 1.00 1.44 H new ATOM 0 HA ASN A 53 3.889 1.179 -19.014 1.00 14.13 H new ATOM 0 HB2 ASN A 53 1.155 2.287 -19.740 1.00 20.21 H new ATOM 0 HB3 ASN A 53 2.524 2.422 -20.825 1.00 20.21 H new ATOM 0 HD21 ASN A 53 0.411 -0.740 -21.401 1.00 74.24 H new ATOM 0 HD22 ASN A 53 -0.046 0.938 -21.091 1.00 74.24 H new ATOM 894 N LYS A 54 3.175 3.894 -17.525 1.00 3.42 N ATOM 895 CA LYS A 54 3.620 5.247 -17.211 1.00 21.04 C ATOM 896 C LYS A 54 5.004 5.230 -16.570 1.00 64.42 C ATOM 897 O LYS A 54 5.873 6.023 -16.929 1.00 45.51 O ATOM 898 CB LYS A 54 2.621 5.930 -16.273 1.00 64.52 C ATOM 899 CG LYS A 54 1.199 5.944 -16.806 1.00 21.31 C ATOM 900 CD LYS A 54 0.237 6.568 -15.809 1.00 74.23 C ATOM 901 CE LYS A 54 -1.010 7.101 -16.498 1.00 14.02 C ATOM 902 NZ LYS A 54 -0.688 8.179 -17.473 1.00 4.20 N ATOM 0 H LYS A 54 2.529 3.494 -16.845 1.00 3.42 H new ATOM 0 HA LYS A 54 3.677 5.809 -18.143 1.00 21.04 H new ATOM 0 HB2 LYS A 54 2.634 5.421 -15.309 1.00 64.52 H new ATOM 0 HB3 LYS A 54 2.944 6.956 -16.096 1.00 64.52 H new ATOM 0 HG2 LYS A 54 1.166 6.501 -17.743 1.00 21.31 H new ATOM 0 HG3 LYS A 54 0.883 4.925 -17.029 1.00 21.31 H new ATOM 0 HD2 LYS A 54 -0.047 5.826 -15.063 1.00 74.23 H new ATOM 0 HD3 LYS A 54 0.736 7.379 -15.279 1.00 74.23 H new ATOM 0 HE2 LYS A 54 -1.517 6.285 -17.013 1.00 14.02 H new ATOM 0 HE3 LYS A 54 -1.703 7.484 -15.749 1.00 14.02 H new ATOM 0 HZ1 LYS A 54 -1.508 8.811 -17.576 1.00 4.20 H new ATOM 0 HZ2 LYS A 54 0.128 8.724 -17.130 1.00 4.20 H new ATOM 0 HZ3 LYS A 54 -0.459 7.756 -18.395 1.00 4.20 H new ATOM 916 N GLN A 55 5.202 4.319 -15.622 1.00 74.14 N ATOM 917 CA GLN A 55 6.481 4.199 -14.933 1.00 60.25 C ATOM 918 C GLN A 55 7.382 3.186 -15.632 1.00 23.22 C ATOM 919 O GLN A 55 8.607 3.245 -15.516 1.00 1.01 O ATOM 920 CB GLN A 55 6.263 3.786 -13.477 1.00 1.23 C ATOM 921 CG GLN A 55 6.238 4.959 -12.510 1.00 22.25 C ATOM 922 CD GLN A 55 7.588 5.636 -12.378 1.00 62.31 C ATOM 923 OE1 GLN A 55 8.607 4.978 -12.162 1.00 51.25 O ATOM 924 NE2 GLN A 55 7.603 6.957 -12.508 1.00 4.13 N ATOM 0 H GLN A 55 4.493 3.654 -15.314 1.00 74.14 H new ATOM 0 HA GLN A 55 6.971 5.172 -14.957 1.00 60.25 H new ATOM 0 HB2 GLN A 55 5.322 3.241 -13.399 1.00 1.23 H new ATOM 0 HB3 GLN A 55 7.055 3.098 -13.181 1.00 1.23 H new ATOM 0 HG2 GLN A 55 5.502 5.688 -12.848 1.00 22.25 H new ATOM 0 HG3 GLN A 55 5.914 4.610 -11.530 1.00 22.25 H new ATOM 0 HE21 GLN A 55 6.735 7.462 -12.686 1.00 4.13 H new ATOM 0 HE22 GLN A 55 8.483 7.467 -12.429 1.00 4.13 H new ATOM 933 N LEU A 56 6.769 2.257 -16.356 1.00 71.45 N ATOM 934 CA LEU A 56 7.516 1.229 -17.074 1.00 51.40 C ATOM 935 C LEU A 56 8.567 1.856 -17.985 1.00 14.31 C ATOM 936 O LEU A 56 8.246 2.666 -18.856 1.00 61.53 O ATOM 937 CB LEU A 56 6.564 0.360 -17.897 1.00 51.14 C ATOM 938 CG LEU A 56 7.221 -0.623 -18.867 1.00 43.51 C ATOM 939 CD1 LEU A 56 6.369 -1.873 -19.019 1.00 42.03 C ATOM 940 CD2 LEU A 56 7.451 0.036 -20.219 1.00 44.15 C ATOM 0 H LEU A 56 5.756 2.194 -16.462 1.00 71.45 H new ATOM 0 HA LEU A 56 8.025 0.604 -16.340 1.00 51.40 H new ATOM 0 HB2 LEU A 56 5.934 -0.205 -17.210 1.00 51.14 H new ATOM 0 HB3 LEU A 56 5.906 1.016 -18.466 1.00 51.14 H new ATOM 0 HG LEU A 56 8.188 -0.916 -18.458 1.00 43.51 H new ATOM 0 HD11 LEU A 56 6.852 -2.561 -19.713 1.00 42.03 H new ATOM 0 HD12 LEU A 56 6.256 -2.356 -18.049 1.00 42.03 H new ATOM 0 HD13 LEU A 56 5.387 -1.599 -19.405 1.00 42.03 H new ATOM 0 HD21 LEU A 56 7.919 -0.678 -20.897 1.00 44.15 H new ATOM 0 HD22 LEU A 56 6.496 0.358 -20.634 1.00 44.15 H new ATOM 0 HD23 LEU A 56 8.103 0.901 -20.096 1.00 44.15 H new ATOM 952 N THR A 57 9.824 1.476 -17.779 1.00 72.13 N ATOM 953 CA THR A 57 10.922 1.999 -18.582 1.00 53.40 C ATOM 954 C THR A 57 11.770 0.871 -19.156 1.00 61.51 C ATOM 955 O THR A 57 11.435 -0.305 -19.012 1.00 23.33 O ATOM 956 CB THR A 57 11.824 2.936 -17.757 1.00 23.13 C ATOM 957 OG1 THR A 57 12.399 2.220 -16.658 1.00 31.40 O ATOM 958 CG2 THR A 57 11.035 4.127 -17.235 1.00 32.12 C ATOM 0 H THR A 57 10.107 0.808 -17.062 1.00 72.13 H new ATOM 0 HA THR A 57 10.474 2.564 -19.399 1.00 53.40 H new ATOM 0 HB THR A 57 12.618 3.304 -18.407 1.00 23.13 H new ATOM 0 HG1 THR A 57 12.972 2.822 -16.139 1.00 31.40 H new ATOM 0 HG21 THR A 57 11.694 4.774 -16.656 1.00 32.12 H new ATOM 0 HG22 THR A 57 10.623 4.687 -18.075 1.00 32.12 H new ATOM 0 HG23 THR A 57 10.222 3.775 -16.600 1.00 32.12 H new ATOM 966 N ARG A 58 12.870 1.235 -19.807 1.00 51.30 N ATOM 967 CA ARG A 58 13.766 0.252 -20.403 1.00 42.25 C ATOM 968 C ARG A 58 14.159 -0.814 -19.385 1.00 11.01 C ATOM 969 O ARG A 58 14.135 -2.008 -19.681 1.00 70.52 O ATOM 970 CB ARG A 58 15.020 0.938 -20.949 1.00 0.33 C ATOM 971 CG ARG A 58 15.981 -0.012 -21.644 1.00 73.13 C ATOM 972 CD ARG A 58 15.552 -0.287 -23.077 1.00 64.22 C ATOM 973 NE ARG A 58 16.694 -0.561 -23.947 1.00 15.43 N ATOM 974 CZ ARG A 58 16.629 -0.535 -25.273 1.00 65.03 C ATOM 975 NH1 ARG A 58 15.485 -0.249 -25.880 1.00 25.44 N ATOM 976 NH2 ARG A 58 17.711 -0.795 -25.996 1.00 44.01 N ATOM 0 H ARG A 58 13.162 2.204 -19.935 1.00 51.30 H new ATOM 0 HA ARG A 58 13.238 -0.232 -21.224 1.00 42.25 H new ATOM 0 HB2 ARG A 58 14.721 1.717 -21.651 1.00 0.33 H new ATOM 0 HB3 ARG A 58 15.540 1.431 -20.128 1.00 0.33 H new ATOM 0 HG2 ARG A 58 16.984 0.415 -21.639 1.00 73.13 H new ATOM 0 HG3 ARG A 58 16.031 -0.950 -21.091 1.00 73.13 H new ATOM 0 HD2 ARG A 58 14.870 -1.137 -23.095 1.00 64.22 H new ATOM 0 HD3 ARG A 58 15.001 0.571 -23.462 1.00 64.22 H new ATOM 0 HE ARG A 58 17.589 -0.784 -23.512 1.00 15.43 H new ATOM 0 HH11 ARG A 58 14.651 -0.048 -25.328 1.00 25.44 H new ATOM 0 HH12 ARG A 58 15.439 -0.230 -26.899 1.00 25.44 H new ATOM 0 HH21 ARG A 58 18.593 -1.015 -25.533 1.00 44.01 H new ATOM 0 HH22 ARG A 58 17.661 -0.775 -27.015 1.00 44.01 H new ATOM 990 N SER A 59 14.521 -0.373 -18.184 1.00 74.22 N ATOM 991 CA SER A 59 14.923 -1.289 -17.123 1.00 53.00 C ATOM 992 C SER A 59 13.881 -2.387 -16.929 1.00 11.52 C ATOM 993 O SER A 59 14.216 -3.525 -16.600 1.00 0.53 O ATOM 994 CB SER A 59 15.127 -0.526 -15.813 1.00 21.44 C ATOM 995 OG SER A 59 16.426 0.037 -15.747 1.00 71.43 O ATOM 0 H SER A 59 14.544 0.612 -17.922 1.00 74.22 H new ATOM 0 HA SER A 59 15.865 -1.754 -17.415 1.00 53.00 H new ATOM 0 HB2 SER A 59 14.380 0.264 -15.729 1.00 21.44 H new ATOM 0 HB3 SER A 59 14.976 -1.199 -14.969 1.00 21.44 H new ATOM 0 HG SER A 59 16.530 0.521 -14.901 1.00 71.43 H new ATOM 1001 N ASP A 60 12.616 -2.036 -17.135 1.00 3.11 N ATOM 1002 CA ASP A 60 11.524 -2.990 -16.984 1.00 30.21 C ATOM 1003 C ASP A 60 11.471 -3.948 -18.170 1.00 24.10 C ATOM 1004 O ASP A 60 11.127 -5.120 -18.019 1.00 33.30 O ATOM 1005 CB ASP A 60 10.190 -2.254 -16.848 1.00 3.05 C ATOM 1006 CG ASP A 60 9.047 -2.999 -17.508 1.00 63.40 C ATOM 1007 OD1 ASP A 60 8.995 -3.021 -18.756 1.00 12.32 O ATOM 1008 OD2 ASP A 60 8.206 -3.562 -16.777 1.00 72.32 O ATOM 0 H ASP A 60 12.322 -1.098 -17.407 1.00 3.11 H new ATOM 0 HA ASP A 60 11.704 -3.570 -16.079 1.00 30.21 H new ATOM 0 HB2 ASP A 60 9.964 -2.110 -15.791 1.00 3.05 H new ATOM 0 HB3 ASP A 60 10.278 -1.263 -17.293 1.00 3.05 H new ATOM 1013 N ARG A 61 11.814 -3.441 -19.349 1.00 45.25 N ATOM 1014 CA ARG A 61 11.804 -4.251 -20.562 1.00 1.43 C ATOM 1015 C ARG A 61 12.970 -5.235 -20.568 1.00 42.31 C ATOM 1016 O ARG A 61 12.826 -6.379 -20.997 1.00 21.02 O ATOM 1017 CB ARG A 61 11.872 -3.355 -21.800 1.00 2.42 C ATOM 1018 CG ARG A 61 10.703 -3.542 -22.752 1.00 73.14 C ATOM 1019 CD ARG A 61 10.055 -2.213 -23.108 1.00 44.12 C ATOM 1020 NE ARG A 61 9.173 -2.326 -24.266 1.00 62.45 N ATOM 1021 CZ ARG A 61 8.658 -1.281 -24.903 1.00 51.41 C ATOM 1022 NH1 ARG A 61 8.936 -0.050 -24.496 1.00 53.31 N ATOM 1023 NH2 ARG A 61 7.863 -1.465 -25.950 1.00 2.04 N ATOM 0 H ARG A 61 12.102 -2.473 -19.491 1.00 45.25 H new ATOM 0 HA ARG A 61 10.873 -4.817 -20.583 1.00 1.43 H new ATOM 0 HB2 ARG A 61 11.908 -2.313 -21.482 1.00 2.42 H new ATOM 0 HB3 ARG A 61 12.800 -3.557 -22.334 1.00 2.42 H new ATOM 0 HG2 ARG A 61 11.048 -4.035 -23.661 1.00 73.14 H new ATOM 0 HG3 ARG A 61 9.962 -4.198 -22.295 1.00 73.14 H new ATOM 0 HD2 ARG A 61 9.486 -1.847 -22.253 1.00 44.12 H new ATOM 0 HD3 ARG A 61 10.831 -1.475 -23.314 1.00 44.12 H new ATOM 0 HE ARG A 61 8.939 -3.259 -24.604 1.00 62.45 H new ATOM 0 HH11 ARG A 61 9.547 0.096 -23.692 1.00 53.31 H new ATOM 0 HH12 ARG A 61 8.539 0.751 -24.987 1.00 53.31 H new ATOM 0 HH21 ARG A 61 7.647 -2.410 -26.266 1.00 2.04 H new ATOM 0 HH22 ARG A 61 7.468 -0.661 -26.438 1.00 2.04 H new ATOM 1037 N GLU A 62 14.124 -4.780 -20.090 1.00 44.14 N ATOM 1038 CA GLU A 62 15.315 -5.620 -20.043 1.00 20.51 C ATOM 1039 C GLU A 62 15.155 -6.732 -19.010 1.00 62.30 C ATOM 1040 O GLU A 62 15.548 -7.875 -19.246 1.00 32.14 O ATOM 1041 CB GLU A 62 16.549 -4.777 -19.714 1.00 72.40 C ATOM 1042 CG GLU A 62 16.483 -4.107 -18.352 1.00 55.01 C ATOM 1043 CD GLU A 62 17.713 -3.273 -18.052 1.00 13.30 C ATOM 1044 OE1 GLU A 62 18.437 -2.920 -19.007 1.00 30.35 O ATOM 1045 OE2 GLU A 62 17.951 -2.973 -16.864 1.00 3.53 O ATOM 0 H GLU A 62 14.259 -3.835 -19.730 1.00 44.14 H new ATOM 0 HA GLU A 62 15.447 -6.075 -21.025 1.00 20.51 H new ATOM 0 HB2 GLU A 62 17.434 -5.412 -19.755 1.00 72.40 H new ATOM 0 HB3 GLU A 62 16.671 -4.012 -20.481 1.00 72.40 H new ATOM 0 HG2 GLU A 62 15.598 -3.472 -18.306 1.00 55.01 H new ATOM 0 HG3 GLU A 62 16.369 -4.869 -17.581 1.00 55.01 H new ATOM 1052 N VAL A 63 14.576 -6.389 -17.864 1.00 1.41 N ATOM 1053 CA VAL A 63 14.363 -7.356 -16.794 1.00 63.44 C ATOM 1054 C VAL A 63 13.285 -8.365 -17.173 1.00 35.04 C ATOM 1055 O VAL A 63 13.388 -9.550 -16.854 1.00 61.41 O ATOM 1056 CB VAL A 63 13.962 -6.661 -15.480 1.00 24.22 C ATOM 1057 CG1 VAL A 63 15.070 -5.732 -15.008 1.00 0.51 C ATOM 1058 CG2 VAL A 63 12.656 -5.901 -15.656 1.00 64.42 C ATOM 0 H VAL A 63 14.246 -5.447 -17.653 1.00 1.41 H new ATOM 0 HA VAL A 63 15.309 -7.877 -16.645 1.00 63.44 H new ATOM 0 HB VAL A 63 13.811 -7.424 -14.717 1.00 24.22 H new ATOM 0 HG11 VAL A 63 14.769 -5.250 -14.078 1.00 0.51 H new ATOM 0 HG12 VAL A 63 15.980 -6.307 -14.840 1.00 0.51 H new ATOM 0 HG13 VAL A 63 15.256 -4.972 -15.767 1.00 0.51 H new ATOM 0 HG21 VAL A 63 12.388 -5.416 -14.717 1.00 64.42 H new ATOM 0 HG22 VAL A 63 12.776 -5.146 -16.433 1.00 64.42 H new ATOM 0 HG23 VAL A 63 11.867 -6.596 -15.944 1.00 64.42 H new ATOM 1068 N LEU A 64 12.249 -7.888 -17.854 1.00 41.43 N ATOM 1069 CA LEU A 64 11.150 -8.748 -18.278 1.00 14.24 C ATOM 1070 C LEU A 64 11.635 -9.807 -19.262 1.00 73.02 C ATOM 1071 O LEU A 64 11.270 -10.978 -19.159 1.00 74.32 O ATOM 1072 CB LEU A 64 10.039 -7.912 -18.916 1.00 71.13 C ATOM 1073 CG LEU A 64 8.715 -7.859 -18.153 1.00 22.13 C ATOM 1074 CD1 LEU A 64 8.965 -7.842 -16.653 1.00 14.44 C ATOM 1075 CD2 LEU A 64 7.904 -6.642 -18.575 1.00 24.53 C ATOM 0 H LEU A 64 12.147 -6.910 -18.124 1.00 41.43 H new ATOM 0 HA LEU A 64 10.755 -9.253 -17.396 1.00 14.24 H new ATOM 0 HB2 LEU A 64 10.405 -6.893 -19.040 1.00 71.13 H new ATOM 0 HB3 LEU A 64 9.844 -8.304 -19.914 1.00 71.13 H new ATOM 0 HG LEU A 64 8.141 -8.754 -18.395 1.00 22.13 H new ATOM 0 HD11 LEU A 64 8.012 -7.804 -16.126 1.00 14.44 H new ATOM 0 HD12 LEU A 64 9.504 -8.744 -16.364 1.00 14.44 H new ATOM 0 HD13 LEU A 64 9.558 -6.966 -16.393 1.00 14.44 H new ATOM 0 HD21 LEU A 64 6.965 -6.621 -18.022 1.00 24.53 H new ATOM 0 HD22 LEU A 64 8.471 -5.736 -18.363 1.00 24.53 H new ATOM 0 HD23 LEU A 64 7.694 -6.697 -19.643 1.00 24.53 H new ATOM 1087 N ASP A 65 12.461 -9.388 -20.214 1.00 54.14 N ATOM 1088 CA ASP A 65 12.999 -10.301 -21.216 1.00 1.01 C ATOM 1089 C ASP A 65 13.917 -11.335 -20.571 1.00 42.32 C ATOM 1090 O ASP A 65 13.834 -12.525 -20.870 1.00 62.12 O ATOM 1091 CB ASP A 65 13.761 -9.523 -22.289 1.00 44.44 C ATOM 1092 CG ASP A 65 13.382 -9.950 -23.694 1.00 23.24 C ATOM 1093 OD1 ASP A 65 12.307 -9.531 -24.172 1.00 20.42 O ATOM 1094 OD2 ASP A 65 14.161 -10.703 -24.315 1.00 1.13 O ATOM 0 H ASP A 65 12.773 -8.422 -20.313 1.00 54.14 H new ATOM 0 HA ASP A 65 12.164 -10.823 -21.682 1.00 1.01 H new ATOM 0 HB2 ASP A 65 13.563 -8.458 -22.170 1.00 44.44 H new ATOM 0 HB3 ASP A 65 14.832 -9.666 -22.146 1.00 44.44 H new ATOM 1099 N ASN A 66 14.793 -10.870 -19.686 1.00 31.43 N ATOM 1100 CA ASN A 66 15.728 -11.755 -19.000 1.00 2.42 C ATOM 1101 C ASN A 66 14.987 -12.732 -18.093 1.00 10.04 C ATOM 1102 O ASN A 66 15.280 -13.927 -18.080 1.00 65.43 O ATOM 1103 CB ASN A 66 16.727 -10.937 -18.179 1.00 0.52 C ATOM 1104 CG ASN A 66 17.773 -11.806 -17.508 1.00 12.25 C ATOM 1105 OD1 ASN A 66 17.445 -12.696 -16.723 1.00 23.02 O ATOM 1106 ND2 ASN A 66 19.039 -11.550 -17.814 1.00 24.42 N ATOM 0 H ASN A 66 14.875 -9.887 -19.427 1.00 31.43 H new ATOM 0 HA ASN A 66 16.269 -12.326 -19.754 1.00 2.42 H new ATOM 0 HB2 ASN A 66 17.221 -10.214 -18.828 1.00 0.52 H new ATOM 0 HB3 ASN A 66 16.190 -10.368 -17.420 1.00 0.52 H new ATOM 0 HD21 ASN A 66 19.787 -12.101 -17.393 1.00 24.42 H new ATOM 0 HD22 ASN A 66 19.264 -10.802 -18.470 1.00 24.42 H new ATOM 1113 N TRP A 67 14.026 -12.215 -17.336 1.00 32.21 N ATOM 1114 CA TRP A 67 13.242 -13.043 -16.426 1.00 12.52 C ATOM 1115 C TRP A 67 12.595 -14.206 -17.169 1.00 35.04 C ATOM 1116 O TRP A 67 12.700 -15.358 -16.748 1.00 63.44 O ATOM 1117 CB TRP A 67 12.167 -12.201 -15.736 1.00 42.40 C ATOM 1118 CG TRP A 67 12.525 -11.814 -14.333 1.00 30.32 C ATOM 1119 CD1 TRP A 67 13.283 -10.747 -13.945 1.00 4.04 C ATOM 1120 CD2 TRP A 67 12.140 -12.493 -13.132 1.00 64.55 C ATOM 1121 NE1 TRP A 67 13.393 -10.722 -12.575 1.00 45.32 N ATOM 1122 CE2 TRP A 67 12.700 -11.782 -12.053 1.00 45.15 C ATOM 1123 CE3 TRP A 67 11.376 -13.632 -12.864 1.00 12.11 C ATOM 1124 CZ2 TRP A 67 12.520 -12.174 -10.730 1.00 31.02 C ATOM 1125 CZ3 TRP A 67 11.198 -14.020 -11.550 1.00 11.03 C ATOM 1126 CH2 TRP A 67 11.767 -13.292 -10.496 1.00 20.50 C ATOM 0 H TRP A 67 13.771 -11.227 -17.334 1.00 32.21 H new ATOM 0 HA TRP A 67 13.916 -13.449 -15.671 1.00 12.52 H new ATOM 0 HB2 TRP A 67 11.992 -11.298 -16.321 1.00 42.40 H new ATOM 0 HB3 TRP A 67 11.231 -12.759 -15.724 1.00 42.40 H new ATOM 0 HD1 TRP A 67 13.730 -10.028 -14.616 1.00 4.04 H new ATOM 0 HE1 TRP A 67 13.907 -10.027 -12.035 1.00 45.32 H new ATOM 0 HE3 TRP A 67 10.933 -14.199 -13.669 1.00 12.11 H new ATOM 0 HZ2 TRP A 67 12.959 -11.615 -9.917 1.00 31.02 H new ATOM 0 HZ3 TRP A 67 10.610 -14.899 -11.331 1.00 11.03 H new ATOM 0 HH2 TRP A 67 11.608 -13.620 -9.479 1.00 20.50 H new ATOM 1137 N ARG A 68 11.925 -13.897 -18.274 1.00 72.43 N ATOM 1138 CA ARG A 68 11.260 -14.918 -19.075 1.00 34.43 C ATOM 1139 C ARG A 68 12.275 -15.892 -19.666 1.00 34.51 C ATOM 1140 O ARG A 68 11.934 -17.023 -20.012 1.00 25.21 O ATOM 1141 CB ARG A 68 10.447 -14.268 -20.196 1.00 64.43 C ATOM 1142 CG ARG A 68 11.210 -14.139 -21.505 1.00 22.34 C ATOM 1143 CD ARG A 68 10.773 -12.910 -22.285 1.00 40.24 C ATOM 1144 NE ARG A 68 9.828 -13.243 -23.348 1.00 30.44 N ATOM 1145 CZ ARG A 68 9.419 -12.376 -24.267 1.00 10.13 C ATOM 1146 NH1 ARG A 68 9.870 -11.129 -24.254 1.00 22.24 N ATOM 1147 NH2 ARG A 68 8.557 -12.755 -25.202 1.00 1.14 N ATOM 0 H ARG A 68 11.828 -12.948 -18.635 1.00 72.43 H new ATOM 0 HA ARG A 68 10.586 -15.474 -18.423 1.00 34.43 H new ATOM 0 HB2 ARG A 68 9.545 -14.856 -20.367 1.00 64.43 H new ATOM 0 HB3 ARG A 68 10.126 -13.278 -19.873 1.00 64.43 H new ATOM 0 HG2 ARG A 68 12.279 -14.080 -21.300 1.00 22.34 H new ATOM 0 HG3 ARG A 68 11.050 -15.031 -22.110 1.00 22.34 H new ATOM 0 HD2 ARG A 68 10.315 -12.193 -21.604 1.00 40.24 H new ATOM 0 HD3 ARG A 68 11.648 -12.425 -22.717 1.00 40.24 H new ATOM 0 HE ARG A 68 9.462 -14.194 -23.387 1.00 30.44 H new ATOM 0 HH11 ARG A 68 10.533 -10.834 -23.537 1.00 22.24 H new ATOM 0 HH12 ARG A 68 9.554 -10.465 -24.961 1.00 22.24 H new ATOM 0 HH21 ARG A 68 8.208 -13.713 -25.215 1.00 1.14 H new ATOM 0 HH22 ARG A 68 8.244 -12.088 -25.907 1.00 1.14 H new ATOM 1161 N GLU A 69 13.521 -15.444 -19.778 1.00 61.45 N ATOM 1162 CA GLU A 69 14.584 -16.277 -20.329 1.00 44.41 C ATOM 1163 C GLU A 69 15.009 -17.349 -19.330 1.00 34.21 C ATOM 1164 O GLU A 69 15.361 -18.466 -19.712 1.00 41.35 O ATOM 1165 CB GLU A 69 15.790 -15.415 -20.712 1.00 72.50 C ATOM 1166 CG GLU A 69 17.017 -15.670 -19.853 1.00 63.44 C ATOM 1167 CD GLU A 69 18.184 -14.774 -20.222 1.00 74.44 C ATOM 1168 OE1 GLU A 69 17.998 -13.877 -21.071 1.00 21.23 O ATOM 1169 OE2 GLU A 69 19.282 -14.971 -19.662 1.00 3.11 O ATOM 0 H GLU A 69 13.819 -14.511 -19.495 1.00 61.45 H new ATOM 0 HA GLU A 69 14.199 -16.769 -21.222 1.00 44.41 H new ATOM 0 HB2 GLU A 69 16.042 -15.601 -21.756 1.00 72.50 H new ATOM 0 HB3 GLU A 69 15.514 -14.363 -20.634 1.00 72.50 H new ATOM 0 HG2 GLU A 69 16.761 -15.514 -18.805 1.00 63.44 H new ATOM 0 HG3 GLU A 69 17.318 -16.713 -19.956 1.00 63.44 H new ATOM 1176 N LEU A 70 14.972 -17.002 -18.048 1.00 64.41 N ATOM 1177 CA LEU A 70 15.353 -17.934 -16.992 1.00 63.33 C ATOM 1178 C LEU A 70 14.255 -18.965 -16.753 1.00 55.12 C ATOM 1179 O LEU A 70 14.526 -20.159 -16.636 1.00 61.34 O ATOM 1180 CB LEU A 70 15.647 -17.176 -15.697 1.00 4.30 C ATOM 1181 CG LEU A 70 16.404 -15.855 -15.849 1.00 74.42 C ATOM 1182 CD1 LEU A 70 15.877 -14.822 -14.866 1.00 15.01 C ATOM 1183 CD2 LEU A 70 17.897 -16.070 -15.651 1.00 31.22 C ATOM 0 H LEU A 70 14.682 -16.083 -17.715 1.00 64.41 H new ATOM 0 HA LEU A 70 16.254 -18.458 -17.312 1.00 63.33 H new ATOM 0 HB2 LEU A 70 14.701 -16.974 -15.195 1.00 4.30 H new ATOM 0 HB3 LEU A 70 16.223 -17.828 -15.041 1.00 4.30 H new ATOM 0 HG LEU A 70 16.243 -15.480 -16.860 1.00 74.42 H new ATOM 0 HD11 LEU A 70 16.427 -13.889 -14.989 1.00 15.01 H new ATOM 0 HD12 LEU A 70 14.818 -14.646 -15.056 1.00 15.01 H new ATOM 0 HD13 LEU A 70 16.007 -15.189 -13.848 1.00 15.01 H new ATOM 0 HD21 LEU A 70 18.419 -15.120 -15.763 1.00 31.22 H new ATOM 0 HD22 LEU A 70 18.078 -16.468 -14.653 1.00 31.22 H new ATOM 0 HD23 LEU A 70 18.265 -16.776 -16.396 1.00 31.22 H new ATOM 1195 N GLU A 71 13.013 -18.494 -16.684 1.00 3.12 N ATOM 1196 CA GLU A 71 11.874 -19.376 -16.460 1.00 53.22 C ATOM 1197 C GLU A 71 11.673 -20.316 -17.645 1.00 31.31 C ATOM 1198 O GLU A 71 11.164 -21.426 -17.490 1.00 60.14 O ATOM 1199 CB GLU A 71 10.604 -18.555 -16.225 1.00 72.15 C ATOM 1200 CG GLU A 71 10.108 -17.832 -17.467 1.00 5.25 C ATOM 1201 CD GLU A 71 9.252 -18.715 -18.354 1.00 2.35 C ATOM 1202 OE1 GLU A 71 8.748 -19.744 -17.858 1.00 3.01 O ATOM 1203 OE2 GLU A 71 9.086 -18.375 -19.544 1.00 22.30 O ATOM 0 H GLU A 71 12.771 -17.508 -16.780 1.00 3.12 H new ATOM 0 HA GLU A 71 12.080 -19.976 -15.573 1.00 53.22 H new ATOM 0 HB2 GLU A 71 9.817 -19.215 -15.860 1.00 72.15 H new ATOM 0 HB3 GLU A 71 10.795 -17.823 -15.440 1.00 72.15 H new ATOM 0 HG2 GLU A 71 9.531 -16.957 -17.167 1.00 5.25 H new ATOM 0 HG3 GLU A 71 10.963 -17.470 -18.038 1.00 5.25 H new ATOM 1210 N MET A 72 12.076 -19.863 -18.827 1.00 61.35 N ATOM 1211 CA MET A 72 11.941 -20.664 -20.039 1.00 22.13 C ATOM 1212 C MET A 72 13.163 -21.555 -20.240 1.00 50.14 C ATOM 1213 O MET A 72 13.120 -22.523 -21.000 1.00 41.44 O ATOM 1214 CB MET A 72 11.750 -19.758 -21.256 1.00 52.13 C ATOM 1215 CG MET A 72 13.049 -19.181 -21.795 1.00 30.20 C ATOM 1216 SD MET A 72 12.794 -18.109 -23.222 1.00 61.32 S ATOM 1217 CE MET A 72 12.812 -19.308 -24.553 1.00 52.32 C ATOM 0 H MET A 72 12.499 -18.946 -18.972 1.00 61.35 H new ATOM 0 HA MET A 72 11.063 -21.301 -19.928 1.00 22.13 H new ATOM 0 HB2 MET A 72 11.258 -20.325 -22.047 1.00 52.13 H new ATOM 0 HB3 MET A 72 11.082 -18.939 -20.988 1.00 52.13 H new ATOM 0 HG2 MET A 72 13.546 -18.617 -21.006 1.00 30.20 H new ATOM 0 HG3 MET A 72 13.717 -19.997 -22.073 1.00 30.20 H new ATOM 0 HE1 MET A 72 12.666 -18.797 -25.505 1.00 52.32 H new ATOM 0 HE2 MET A 72 13.771 -19.826 -24.563 1.00 52.32 H new ATOM 0 HE3 MET A 72 12.010 -20.031 -24.402 1.00 52.32 H new ATOM 1227 N LYS A 73 14.252 -21.222 -19.555 1.00 72.14 N ATOM 1228 CA LYS A 73 15.486 -21.992 -19.658 1.00 11.20 C ATOM 1229 C LYS A 73 15.490 -23.148 -18.663 1.00 60.45 C ATOM 1230 O LYS A 73 16.284 -24.081 -18.785 1.00 1.43 O ATOM 1231 CB LYS A 73 16.696 -21.089 -19.411 1.00 45.32 C ATOM 1232 CG LYS A 73 17.292 -20.508 -20.682 1.00 74.45 C ATOM 1233 CD LYS A 73 18.764 -20.859 -20.819 1.00 51.53 C ATOM 1234 CE LYS A 73 18.960 -22.337 -21.117 1.00 32.34 C ATOM 1235 NZ LYS A 73 20.355 -22.778 -20.842 1.00 24.14 N ATOM 0 H LYS A 73 14.305 -20.424 -18.922 1.00 72.14 H new ATOM 0 HA LYS A 73 15.546 -22.403 -20.666 1.00 11.20 H new ATOM 0 HB2 LYS A 73 16.401 -20.272 -18.752 1.00 45.32 H new ATOM 0 HB3 LYS A 73 17.463 -21.659 -18.888 1.00 45.32 H new ATOM 0 HG2 LYS A 73 16.745 -20.885 -21.546 1.00 74.45 H new ATOM 0 HG3 LYS A 73 17.174 -19.424 -20.678 1.00 74.45 H new ATOM 0 HD2 LYS A 73 19.208 -20.264 -21.617 1.00 51.53 H new ATOM 0 HD3 LYS A 73 19.288 -20.600 -19.899 1.00 51.53 H new ATOM 0 HE2 LYS A 73 18.268 -22.924 -20.513 1.00 32.34 H new ATOM 0 HE3 LYS A 73 18.717 -22.532 -22.161 1.00 32.34 H new ATOM 0 HZ1 LYS A 73 20.427 -23.807 -20.976 1.00 24.14 H new ATOM 0 HZ2 LYS A 73 21.006 -22.297 -21.495 1.00 24.14 H new ATOM 0 HZ3 LYS A 73 20.608 -22.538 -19.862 1.00 24.14 H new ATOM 1249 N ALA A 74 14.597 -23.082 -17.681 1.00 40.44 N ATOM 1250 CA ALA A 74 14.496 -24.125 -16.669 1.00 10.04 C ATOM 1251 C ALA A 74 13.860 -25.387 -17.242 1.00 12.32 C ATOM 1252 O ALA A 74 13.664 -26.373 -16.531 1.00 2.41 O ATOM 1253 CB ALA A 74 13.698 -23.625 -15.474 1.00 34.02 C ATOM 0 H ALA A 74 13.933 -22.316 -17.565 1.00 40.44 H new ATOM 0 HA ALA A 74 15.504 -24.376 -16.340 1.00 10.04 H new ATOM 0 HB1 ALA A 74 13.630 -24.415 -14.726 1.00 34.02 H new ATOM 0 HB2 ALA A 74 14.196 -22.757 -15.042 1.00 34.02 H new ATOM 0 HB3 ALA A 74 12.695 -23.345 -15.797 1.00 34.02 H new ATOM 1259 N ARG A 75 13.538 -25.349 -18.531 1.00 3.42 N ATOM 1260 CA ARG A 75 12.922 -26.489 -19.199 1.00 2.24 C ATOM 1261 C ARG A 75 11.709 -26.986 -18.418 1.00 1.23 C ATOM 1262 O ARG A 75 11.393 -28.176 -18.431 1.00 4.24 O ATOM 1263 CB ARG A 75 13.937 -27.622 -19.360 1.00 42.12 C ATOM 1264 CG ARG A 75 13.803 -28.378 -20.672 1.00 55.41 C ATOM 1265 CD ARG A 75 14.321 -27.558 -21.843 1.00 40.31 C ATOM 1266 NE ARG A 75 14.047 -28.200 -23.125 1.00 75.45 N ATOM 1267 CZ ARG A 75 14.568 -27.794 -24.278 1.00 22.34 C ATOM 1268 NH1 ARG A 75 15.388 -26.753 -24.307 1.00 52.45 N ATOM 1269 NH2 ARG A 75 14.271 -28.431 -25.403 1.00 74.11 N ATOM 0 H ARG A 75 13.694 -24.541 -19.134 1.00 3.42 H new ATOM 0 HA ARG A 75 12.590 -26.165 -20.185 1.00 2.24 H new ATOM 0 HB2 ARG A 75 14.943 -27.210 -19.289 1.00 42.12 H new ATOM 0 HB3 ARG A 75 13.821 -28.323 -18.533 1.00 42.12 H new ATOM 0 HG2 ARG A 75 14.355 -29.316 -20.611 1.00 55.41 H new ATOM 0 HG3 ARG A 75 12.757 -28.634 -20.840 1.00 55.41 H new ATOM 0 HD2 ARG A 75 13.860 -26.571 -21.826 1.00 40.31 H new ATOM 0 HD3 ARG A 75 15.395 -27.410 -21.734 1.00 40.31 H new ATOM 0 HE ARG A 75 13.421 -29.005 -23.136 1.00 75.45 H new ATOM 0 HH11 ARG A 75 15.620 -26.262 -23.443 1.00 52.45 H new ATOM 0 HH12 ARG A 75 15.787 -26.443 -25.193 1.00 52.45 H new ATOM 0 HH21 ARG A 75 13.642 -29.234 -25.384 1.00 74.11 H new ATOM 0 HH22 ARG A 75 14.672 -28.118 -26.287 1.00 74.11 H new ATOM 1283 N LYS A 76 11.033 -26.066 -17.738 1.00 34.44 N ATOM 1284 CA LYS A 76 9.854 -26.409 -16.951 1.00 73.21 C ATOM 1285 C LYS A 76 9.207 -25.158 -16.366 1.00 40.31 C ATOM 1286 O LYS A 76 9.773 -24.067 -16.432 1.00 3.50 O ATOM 1287 CB LYS A 76 10.230 -27.376 -15.826 1.00 14.45 C ATOM 1288 CG LYS A 76 9.259 -28.533 -15.668 1.00 14.01 C ATOM 1289 CD LYS A 76 9.328 -29.484 -16.851 1.00 54.32 C ATOM 1290 CE LYS A 76 8.504 -30.739 -16.606 1.00 42.03 C ATOM 1291 NZ LYS A 76 8.737 -31.769 -17.656 1.00 45.13 N ATOM 0 H LYS A 76 11.281 -25.077 -17.716 1.00 34.44 H new ATOM 0 HA LYS A 76 9.135 -26.893 -17.612 1.00 73.21 H new ATOM 0 HB2 LYS A 76 11.227 -27.773 -16.018 1.00 14.45 H new ATOM 0 HB3 LYS A 76 10.281 -26.825 -14.887 1.00 14.45 H new ATOM 0 HG2 LYS A 76 9.485 -29.076 -14.750 1.00 14.01 H new ATOM 0 HG3 LYS A 76 8.244 -28.147 -15.569 1.00 14.01 H new ATOM 0 HD2 LYS A 76 8.966 -28.979 -17.747 1.00 54.32 H new ATOM 0 HD3 LYS A 76 10.366 -29.760 -17.038 1.00 54.32 H new ATOM 0 HE2 LYS A 76 8.754 -31.153 -15.629 1.00 42.03 H new ATOM 0 HE3 LYS A 76 7.446 -30.479 -16.580 1.00 42.03 H new ATOM 0 HZ1 LYS A 76 8.158 -32.609 -17.453 1.00 45.13 H new ATOM 0 HZ2 LYS A 76 8.474 -31.383 -18.585 1.00 45.13 H new ATOM 0 HZ3 LYS A 76 9.742 -32.036 -17.664 1.00 45.13 H new ATOM 1305 N ARG A 77 8.019 -25.323 -15.793 1.00 64.51 N ATOM 1306 CA ARG A 77 7.297 -24.207 -15.196 1.00 54.23 C ATOM 1307 C ARG A 77 7.252 -24.338 -13.677 1.00 32.13 C ATOM 1308 O ARG A 77 6.338 -24.950 -13.122 1.00 71.23 O ATOM 1309 CB ARG A 77 5.874 -24.136 -15.755 1.00 2.52 C ATOM 1310 CG ARG A 77 5.817 -23.777 -17.231 1.00 14.13 C ATOM 1311 CD ARG A 77 5.963 -22.279 -17.446 1.00 41.31 C ATOM 1312 NE ARG A 77 6.212 -21.949 -18.847 1.00 14.21 N ATOM 1313 CZ ARG A 77 7.374 -22.155 -19.455 1.00 44.33 C ATOM 1314 NH1 ARG A 77 8.390 -22.687 -18.789 1.00 74.33 N ATOM 1315 NH2 ARG A 77 7.523 -21.828 -20.733 1.00 21.22 N ATOM 0 H ARG A 77 7.536 -26.219 -15.730 1.00 64.51 H new ATOM 0 HA ARG A 77 7.826 -23.288 -15.448 1.00 54.23 H new ATOM 0 HB2 ARG A 77 5.385 -25.099 -15.605 1.00 2.52 H new ATOM 0 HB3 ARG A 77 5.306 -23.398 -15.188 1.00 2.52 H new ATOM 0 HG2 ARG A 77 6.610 -24.301 -17.765 1.00 14.13 H new ATOM 0 HG3 ARG A 77 4.871 -24.116 -17.653 1.00 14.13 H new ATOM 0 HD2 ARG A 77 5.057 -21.775 -17.110 1.00 41.31 H new ATOM 0 HD3 ARG A 77 6.783 -21.903 -16.834 1.00 41.31 H new ATOM 0 HE ARG A 77 5.451 -21.538 -19.388 1.00 14.21 H new ATOM 0 HH11 ARG A 77 8.280 -22.939 -17.807 1.00 74.33 H new ATOM 0 HH12 ARG A 77 9.282 -22.844 -19.259 1.00 74.33 H new ATOM 0 HH21 ARG A 77 6.744 -21.418 -21.249 1.00 21.22 H new ATOM 0 HH22 ARG A 77 8.416 -21.987 -21.199 1.00 21.22 H new ATOM 1329 N LEU A 78 8.244 -23.760 -13.009 1.00 22.41 N ATOM 1330 CA LEU A 78 8.319 -23.813 -11.553 1.00 0.21 C ATOM 1331 C LEU A 78 7.011 -23.345 -10.923 1.00 51.12 C ATOM 1332 O LEU A 78 6.192 -22.678 -11.556 1.00 45.33 O ATOM 1333 CB LEU A 78 9.478 -22.949 -11.051 1.00 34.43 C ATOM 1334 CG LEU A 78 10.817 -23.664 -10.869 1.00 44.42 C ATOM 1335 CD1 LEU A 78 11.099 -24.578 -12.051 1.00 44.24 C ATOM 1336 CD2 LEU A 78 11.941 -22.653 -10.695 1.00 3.45 C ATOM 0 H LEU A 78 9.008 -23.249 -13.452 1.00 22.41 H new ATOM 0 HA LEU A 78 8.492 -24.849 -11.260 1.00 0.21 H new ATOM 0 HB2 LEU A 78 9.621 -22.125 -11.751 1.00 34.43 H new ATOM 0 HB3 LEU A 78 9.190 -22.510 -10.096 1.00 34.43 H new ATOM 0 HG LEU A 78 10.761 -24.275 -9.968 1.00 44.42 H new ATOM 0 HD11 LEU A 78 12.056 -25.078 -11.904 1.00 44.24 H new ATOM 0 HD12 LEU A 78 10.308 -25.324 -12.131 1.00 44.24 H new ATOM 0 HD13 LEU A 78 11.135 -23.988 -12.967 1.00 44.24 H new ATOM 0 HD21 LEU A 78 12.887 -23.179 -10.567 1.00 3.45 H new ATOM 0 HD22 LEU A 78 11.997 -22.016 -11.578 1.00 3.45 H new ATOM 0 HD23 LEU A 78 11.745 -22.039 -9.816 1.00 3.45 H new ATOM 1348 N PRO A 79 6.808 -23.700 -9.646 1.00 25.13 N ATOM 1349 CA PRO A 79 5.603 -23.325 -8.901 1.00 53.13 C ATOM 1350 C PRO A 79 5.551 -21.832 -8.597 1.00 14.42 C ATOM 1351 O PRO A 79 4.473 -21.239 -8.522 1.00 24.44 O ATOM 1352 CB PRO A 79 5.721 -24.131 -7.605 1.00 74.15 C ATOM 1353 CG PRO A 79 7.182 -24.370 -7.439 1.00 53.25 C ATOM 1354 CD PRO A 79 7.741 -24.495 -8.829 1.00 44.05 C ATOM 0 HA PRO A 79 4.694 -23.532 -9.466 1.00 53.13 H new ATOM 0 HB2 PRO A 79 5.311 -23.581 -6.758 1.00 74.15 H new ATOM 0 HB3 PRO A 79 5.171 -25.070 -7.671 1.00 74.15 H new ATOM 0 HG2 PRO A 79 7.653 -23.547 -6.901 1.00 53.25 H new ATOM 0 HG3 PRO A 79 7.366 -25.276 -6.861 1.00 53.25 H new ATOM 0 HD2 PRO A 79 8.758 -24.108 -8.889 1.00 44.05 H new ATOM 0 HD3 PRO A 79 7.776 -25.534 -9.156 1.00 44.05 H new ATOM 1362 N THR A 80 6.722 -21.227 -8.423 1.00 15.54 N ATOM 1363 CA THR A 80 6.809 -19.802 -8.126 1.00 22.44 C ATOM 1364 C THR A 80 7.299 -19.017 -9.337 1.00 23.31 C ATOM 1365 O THR A 80 8.161 -19.482 -10.084 1.00 41.42 O ATOM 1366 CB THR A 80 7.752 -19.533 -6.938 1.00 23.22 C ATOM 1367 OG1 THR A 80 7.854 -18.124 -6.702 1.00 72.54 O ATOM 1368 CG2 THR A 80 9.135 -20.109 -7.203 1.00 60.14 C ATOM 0 H THR A 80 7.623 -21.701 -8.483 1.00 15.54 H new ATOM 0 HA THR A 80 5.804 -19.471 -7.865 1.00 22.44 H new ATOM 0 HB THR A 80 7.336 -20.020 -6.056 1.00 23.22 H new ATOM 0 HG1 THR A 80 8.454 -17.962 -5.944 1.00 72.54 H new ATOM 0 HG21 THR A 80 9.783 -19.907 -6.350 1.00 60.14 H new ATOM 0 HG22 THR A 80 9.058 -21.186 -7.353 1.00 60.14 H new ATOM 0 HG23 THR A 80 9.556 -19.648 -8.096 1.00 60.14 H new ATOM 1376 N THR A 81 6.745 -17.824 -9.527 1.00 3.35 N ATOM 1377 CA THR A 81 7.126 -16.974 -10.648 1.00 12.13 C ATOM 1378 C THR A 81 8.000 -15.813 -10.186 1.00 72.42 C ATOM 1379 O THR A 81 8.089 -14.785 -10.858 1.00 4.31 O ATOM 1380 CB THR A 81 5.888 -16.413 -11.373 1.00 10.23 C ATOM 1381 OG1 THR A 81 4.854 -17.403 -11.415 1.00 3.21 O ATOM 1382 CG2 THR A 81 6.240 -15.979 -12.788 1.00 30.22 C ATOM 0 H THR A 81 6.030 -17.424 -8.919 1.00 3.35 H new ATOM 0 HA THR A 81 7.692 -17.598 -11.340 1.00 12.13 H new ATOM 0 HB THR A 81 5.534 -15.543 -10.821 1.00 10.23 H new ATOM 0 HG1 THR A 81 4.070 -17.038 -11.876 1.00 3.21 H new ATOM 0 HG21 THR A 81 5.350 -15.586 -13.280 1.00 30.22 H new ATOM 0 HG22 THR A 81 7.006 -15.204 -12.751 1.00 30.22 H new ATOM 0 HG23 THR A 81 6.617 -16.835 -13.348 1.00 30.22 H new ATOM 1390 N LEU A 82 8.644 -15.985 -9.037 1.00 13.51 N ATOM 1391 CA LEU A 82 9.513 -14.951 -8.485 1.00 54.44 C ATOM 1392 C LEU A 82 10.862 -15.533 -8.078 1.00 60.53 C ATOM 1393 O LEU A 82 11.241 -15.491 -6.908 1.00 10.43 O ATOM 1394 CB LEU A 82 8.846 -14.287 -7.279 1.00 42.31 C ATOM 1395 CG LEU A 82 7.881 -13.143 -7.591 1.00 11.51 C ATOM 1396 CD1 LEU A 82 7.348 -12.529 -6.306 1.00 12.43 C ATOM 1397 CD2 LEU A 82 8.565 -12.085 -8.445 1.00 61.43 C ATOM 0 H LEU A 82 8.581 -16.830 -8.469 1.00 13.51 H new ATOM 0 HA LEU A 82 9.681 -14.201 -9.258 1.00 54.44 H new ATOM 0 HB2 LEU A 82 8.304 -15.051 -6.723 1.00 42.31 H new ATOM 0 HB3 LEU A 82 9.627 -13.907 -6.620 1.00 42.31 H new ATOM 0 HG LEU A 82 7.039 -13.547 -8.154 1.00 11.51 H new ATOM 0 HD11 LEU A 82 6.663 -11.716 -6.548 1.00 12.43 H new ATOM 0 HD12 LEU A 82 6.820 -13.290 -5.731 1.00 12.43 H new ATOM 0 HD13 LEU A 82 8.178 -12.140 -5.717 1.00 12.43 H new ATOM 0 HD21 LEU A 82 7.863 -11.279 -8.657 1.00 61.43 H new ATOM 0 HD22 LEU A 82 9.426 -11.685 -7.909 1.00 61.43 H new ATOM 0 HD23 LEU A 82 8.897 -12.532 -9.382 1.00 61.43 H new ATOM 1409 N PHE A 83 11.584 -16.076 -9.053 1.00 25.33 N ATOM 1410 CA PHE A 83 12.893 -16.667 -8.796 1.00 51.23 C ATOM 1411 C PHE A 83 13.946 -16.083 -9.733 1.00 43.32 C ATOM 1412 O PHE A 83 13.618 -15.478 -10.754 1.00 63.24 O ATOM 1413 CB PHE A 83 12.832 -18.186 -8.964 1.00 32.54 C ATOM 1414 CG PHE A 83 12.307 -18.622 -10.302 1.00 45.42 C ATOM 1415 CD1 PHE A 83 13.041 -18.394 -11.456 1.00 14.14 C ATOM 1416 CD2 PHE A 83 11.081 -19.258 -10.407 1.00 41.10 C ATOM 1417 CE1 PHE A 83 12.561 -18.793 -12.689 1.00 22.41 C ATOM 1418 CE2 PHE A 83 10.597 -19.660 -11.637 1.00 52.04 C ATOM 1419 CZ PHE A 83 11.337 -19.426 -12.780 1.00 21.31 C ATOM 0 H PHE A 83 11.285 -16.119 -10.027 1.00 25.33 H new ATOM 0 HA PHE A 83 13.175 -16.433 -7.769 1.00 51.23 H new ATOM 0 HB2 PHE A 83 13.831 -18.599 -8.823 1.00 32.54 H new ATOM 0 HB3 PHE A 83 12.200 -18.605 -8.181 1.00 32.54 H new ATOM 0 HD1 PHE A 83 13.999 -17.899 -11.391 1.00 14.14 H new ATOM 0 HD2 PHE A 83 10.497 -19.442 -9.517 1.00 41.10 H new ATOM 0 HE1 PHE A 83 13.143 -18.610 -13.580 1.00 22.41 H new ATOM 0 HE2 PHE A 83 9.641 -20.157 -11.705 1.00 52.04 H new ATOM 0 HZ PHE A 83 10.959 -19.737 -13.743 1.00 21.31 H new ATOM 1429 N PHE A 84 15.213 -16.267 -9.378 1.00 23.25 N ATOM 1430 CA PHE A 84 16.316 -15.758 -10.185 1.00 11.34 C ATOM 1431 C PHE A 84 17.453 -16.773 -10.255 1.00 12.01 C ATOM 1432 O PHE A 84 17.411 -17.814 -9.599 1.00 32.04 O ATOM 1433 CB PHE A 84 16.831 -14.438 -9.607 1.00 52.44 C ATOM 1434 CG PHE A 84 17.432 -14.576 -8.238 1.00 13.02 C ATOM 1435 CD1 PHE A 84 18.625 -15.257 -8.056 1.00 15.14 C ATOM 1436 CD2 PHE A 84 16.803 -14.026 -7.132 1.00 42.43 C ATOM 1437 CE1 PHE A 84 19.180 -15.386 -6.797 1.00 3.23 C ATOM 1438 CE2 PHE A 84 17.354 -14.151 -5.871 1.00 44.12 C ATOM 1439 CZ PHE A 84 18.544 -14.833 -5.703 1.00 13.11 C ATOM 0 H PHE A 84 15.502 -16.765 -8.536 1.00 23.25 H new ATOM 0 HA PHE A 84 15.945 -15.585 -11.195 1.00 11.34 H new ATOM 0 HB2 PHE A 84 17.578 -14.022 -10.283 1.00 52.44 H new ATOM 0 HB3 PHE A 84 16.008 -13.724 -9.563 1.00 52.44 H new ATOM 0 HD1 PHE A 84 19.127 -15.692 -8.908 1.00 15.14 H new ATOM 0 HD2 PHE A 84 15.872 -13.494 -7.257 1.00 42.43 H new ATOM 0 HE1 PHE A 84 20.111 -15.919 -6.669 1.00 3.23 H new ATOM 0 HE2 PHE A 84 16.855 -13.716 -5.018 1.00 44.12 H new ATOM 0 HZ PHE A 84 18.976 -14.933 -4.718 1.00 13.11 H new ATOM 1449 N ILE A 85 18.467 -16.462 -11.056 1.00 33.25 N ATOM 1450 CA ILE A 85 19.615 -17.346 -11.212 1.00 30.34 C ATOM 1451 C ILE A 85 20.840 -16.789 -10.494 1.00 15.11 C ATOM 1452 O ILE A 85 21.045 -15.577 -10.448 1.00 3.40 O ATOM 1453 CB ILE A 85 19.960 -17.565 -12.697 1.00 15.13 C ATOM 1454 CG1 ILE A 85 20.435 -16.256 -13.330 1.00 54.25 C ATOM 1455 CG2 ILE A 85 18.754 -18.115 -13.445 1.00 23.14 C ATOM 1456 CD1 ILE A 85 20.928 -16.417 -14.751 1.00 44.42 C ATOM 0 H ILE A 85 18.516 -15.605 -11.607 1.00 33.25 H new ATOM 0 HA ILE A 85 19.339 -18.302 -10.767 1.00 30.34 H new ATOM 0 HB ILE A 85 20.768 -18.294 -12.764 1.00 15.13 H new ATOM 0 HG12 ILE A 85 19.616 -15.537 -13.317 1.00 54.25 H new ATOM 0 HG13 ILE A 85 21.236 -15.837 -12.721 1.00 54.25 H new ATOM 0 HG21 ILE A 85 19.013 -18.265 -14.493 1.00 23.14 H new ATOM 0 HG22 ILE A 85 18.456 -19.067 -13.005 1.00 23.14 H new ATOM 0 HG23 ILE A 85 17.928 -17.408 -13.373 1.00 23.14 H new ATOM 0 HD11 ILE A 85 21.249 -15.449 -15.137 1.00 44.42 H new ATOM 0 HD12 ILE A 85 21.768 -17.111 -14.768 1.00 44.42 H new ATOM 0 HD13 ILE A 85 20.123 -16.807 -15.374 1.00 44.42 H new ATOM 1468 N GLU A 86 21.650 -17.683 -9.936 1.00 61.15 N ATOM 1469 CA GLU A 86 22.855 -17.280 -9.222 1.00 4.42 C ATOM 1470 C GLU A 86 23.777 -16.465 -10.125 1.00 55.33 C ATOM 1471 O GLU A 86 24.557 -15.638 -9.653 1.00 0.34 O ATOM 1472 CB GLU A 86 23.598 -18.509 -8.694 1.00 32.10 C ATOM 1473 CG GLU A 86 24.806 -18.169 -7.838 1.00 20.34 C ATOM 1474 CD GLU A 86 24.766 -18.842 -6.479 1.00 50.02 C ATOM 1475 OE1 GLU A 86 23.656 -19.005 -5.931 1.00 75.23 O ATOM 1476 OE2 GLU A 86 25.844 -19.205 -5.964 1.00 50.30 O ATOM 0 H GLU A 86 21.493 -18.691 -9.965 1.00 61.15 H new ATOM 0 HA GLU A 86 22.555 -16.656 -8.380 1.00 4.42 H new ATOM 0 HB2 GLU A 86 22.908 -19.116 -8.109 1.00 32.10 H new ATOM 0 HB3 GLU A 86 23.921 -19.118 -9.538 1.00 32.10 H new ATOM 0 HG2 GLU A 86 25.714 -18.469 -8.361 1.00 20.34 H new ATOM 0 HG3 GLU A 86 24.859 -17.089 -7.703 1.00 20.34 H new ATOM 1483 N THR A 87 23.681 -16.705 -11.429 1.00 54.34 N ATOM 1484 CA THR A 87 24.505 -15.996 -12.400 1.00 2.23 C ATOM 1485 C THR A 87 24.010 -14.569 -12.604 1.00 13.32 C ATOM 1486 O THR A 87 24.650 -13.771 -13.290 1.00 32.34 O ATOM 1487 CB THR A 87 24.522 -16.721 -13.759 1.00 0.43 C ATOM 1488 OG1 THR A 87 23.776 -17.940 -13.673 1.00 51.31 O ATOM 1489 CG2 THR A 87 25.948 -17.022 -14.193 1.00 63.44 C ATOM 0 H THR A 87 23.040 -17.386 -11.837 1.00 54.34 H new ATOM 0 HA THR A 87 25.517 -15.972 -11.997 1.00 2.23 H new ATOM 0 HB THR A 87 24.064 -16.067 -14.501 1.00 0.43 H new ATOM 0 HG1 THR A 87 23.790 -18.394 -14.541 1.00 51.31 H new ATOM 0 HG21 THR A 87 25.935 -17.534 -15.155 1.00 63.44 H new ATOM 0 HG22 THR A 87 26.505 -16.089 -14.286 1.00 63.44 H new ATOM 0 HG23 THR A 87 26.428 -17.659 -13.450 1.00 63.44 H new ATOM 1497 N ASP A 88 22.867 -14.253 -12.004 1.00 42.32 N ATOM 1498 CA ASP A 88 22.287 -12.920 -12.119 1.00 14.11 C ATOM 1499 C ASP A 88 22.635 -12.069 -10.902 1.00 14.14 C ATOM 1500 O ASP A 88 22.600 -10.839 -10.961 1.00 65.54 O ATOM 1501 CB ASP A 88 20.768 -13.014 -12.274 1.00 11.51 C ATOM 1502 CG ASP A 88 20.133 -11.671 -12.579 1.00 2.00 C ATOM 1503 OD1 ASP A 88 20.098 -10.813 -11.673 1.00 14.50 O ATOM 1504 OD2 ASP A 88 19.671 -11.479 -13.723 1.00 42.04 O ATOM 0 H ASP A 88 22.324 -14.901 -11.434 1.00 42.32 H new ATOM 0 HA ASP A 88 22.706 -12.443 -13.005 1.00 14.11 H new ATOM 0 HB2 ASP A 88 20.530 -13.715 -13.074 1.00 11.51 H new ATOM 0 HB3 ASP A 88 20.336 -13.417 -11.358 1.00 11.51 H new ATOM 1509 N ILE A 89 22.968 -12.731 -9.799 1.00 32.21 N ATOM 1510 CA ILE A 89 23.322 -12.035 -8.568 1.00 73.30 C ATOM 1511 C ILE A 89 24.817 -12.138 -8.289 1.00 23.00 C ATOM 1512 O ILE A 89 25.427 -11.205 -7.765 1.00 72.51 O ATOM 1513 CB ILE A 89 22.546 -12.596 -7.361 1.00 40.14 C ATOM 1514 CG1 ILE A 89 21.089 -12.862 -7.743 1.00 74.44 C ATOM 1515 CG2 ILE A 89 22.624 -11.632 -6.187 1.00 52.53 C ATOM 1516 CD1 ILE A 89 20.320 -11.610 -8.104 1.00 32.45 C ATOM 0 H ILE A 89 23.000 -13.748 -9.733 1.00 32.21 H new ATOM 0 HA ILE A 89 23.052 -10.988 -8.708 1.00 73.30 H new ATOM 0 HB ILE A 89 23.002 -13.540 -7.062 1.00 40.14 H new ATOM 0 HG12 ILE A 89 21.063 -13.550 -8.588 1.00 74.44 H new ATOM 0 HG13 ILE A 89 20.589 -13.359 -6.912 1.00 74.44 H new ATOM 0 HG21 ILE A 89 22.071 -12.042 -5.342 1.00 52.53 H new ATOM 0 HG22 ILE A 89 23.666 -11.488 -5.903 1.00 52.53 H new ATOM 0 HG23 ILE A 89 22.190 -10.674 -6.474 1.00 52.53 H new ATOM 0 HD11 ILE A 89 19.295 -11.875 -8.364 1.00 32.45 H new ATOM 0 HD12 ILE A 89 20.314 -10.929 -7.253 1.00 32.45 H new ATOM 0 HD13 ILE A 89 20.796 -11.123 -8.955 1.00 32.45 H new ATOM 1528 N ARG A 90 25.403 -13.277 -8.644 1.00 40.10 N ATOM 1529 CA ARG A 90 26.828 -13.502 -8.433 1.00 11.45 C ATOM 1530 C ARG A 90 27.647 -12.322 -8.948 1.00 53.30 C ATOM 1531 O ARG A 90 28.399 -11.686 -8.209 1.00 20.40 O ATOM 1532 CB ARG A 90 27.272 -14.788 -9.131 1.00 22.34 C ATOM 1533 CG ARG A 90 28.722 -14.765 -9.586 1.00 40.43 C ATOM 1534 CD ARG A 90 29.296 -16.169 -9.691 1.00 41.20 C ATOM 1535 NE ARG A 90 29.594 -16.737 -8.379 1.00 63.43 N ATOM 1536 CZ ARG A 90 29.811 -18.031 -8.171 1.00 61.43 C ATOM 1537 NH1 ARG A 90 29.763 -18.886 -9.184 1.00 24.13 N ATOM 1538 NH2 ARG A 90 30.077 -18.473 -6.948 1.00 53.44 N ATOM 0 H ARG A 90 24.913 -14.058 -9.079 1.00 40.10 H new ATOM 0 HA ARG A 90 27.000 -13.601 -7.361 1.00 11.45 H new ATOM 0 HB2 ARG A 90 27.126 -15.628 -8.452 1.00 22.34 H new ATOM 0 HB3 ARG A 90 26.631 -14.962 -9.996 1.00 22.34 H new ATOM 0 HG2 ARG A 90 28.793 -14.269 -10.554 1.00 40.43 H new ATOM 0 HG3 ARG A 90 29.316 -14.180 -8.884 1.00 40.43 H new ATOM 0 HD2 ARG A 90 28.587 -16.812 -10.212 1.00 41.20 H new ATOM 0 HD3 ARG A 90 30.206 -16.145 -10.291 1.00 41.20 H new ATOM 0 HE ARG A 90 29.638 -16.106 -7.579 1.00 63.43 H new ATOM 0 HH11 ARG A 90 29.559 -18.550 -10.125 1.00 24.13 H new ATOM 0 HH12 ARG A 90 29.930 -19.879 -9.022 1.00 24.13 H new ATOM 0 HH21 ARG A 90 30.115 -17.819 -6.166 1.00 53.44 H new ATOM 0 HH22 ARG A 90 30.243 -19.467 -6.790 1.00 53.44 H new ATOM 1552 N PRO A 91 27.499 -12.021 -10.247 1.00 12.12 N ATOM 1553 CA PRO A 91 28.216 -10.916 -10.890 1.00 63.32 C ATOM 1554 C PRO A 91 27.725 -9.552 -10.417 1.00 72.44 C ATOM 1555 O PRO A 91 28.150 -8.517 -10.929 1.00 64.44 O ATOM 1556 CB PRO A 91 27.907 -11.110 -12.377 1.00 32.43 C ATOM 1557 CG PRO A 91 26.613 -11.848 -12.401 1.00 71.30 C ATOM 1558 CD PRO A 91 26.619 -12.736 -11.187 1.00 2.40 C ATOM 0 HA PRO A 91 29.281 -10.931 -10.656 1.00 63.32 H new ATOM 0 HB2 PRO A 91 27.827 -10.153 -12.893 1.00 32.43 H new ATOM 0 HB3 PRO A 91 28.695 -11.676 -12.875 1.00 32.43 H new ATOM 0 HG2 PRO A 91 25.770 -11.158 -12.375 1.00 71.30 H new ATOM 0 HG3 PRO A 91 26.516 -12.436 -13.314 1.00 71.30 H new ATOM 0 HD2 PRO A 91 25.617 -12.866 -10.779 1.00 2.40 H new ATOM 0 HD3 PRO A 91 27.001 -13.730 -11.418 1.00 2.40 H new ATOM 1566 N MET A 92 26.827 -9.559 -9.438 1.00 20.14 N ATOM 1567 CA MET A 92 26.279 -8.321 -8.895 1.00 23.20 C ATOM 1568 C MET A 92 26.801 -8.069 -7.484 1.00 14.32 C ATOM 1569 O MET A 92 26.899 -6.923 -7.043 1.00 44.55 O ATOM 1570 CB MET A 92 24.750 -8.376 -8.884 1.00 65.52 C ATOM 1571 CG MET A 92 24.107 -7.638 -10.047 1.00 5.22 C ATOM 1572 SD MET A 92 22.629 -6.729 -9.559 1.00 53.53 S ATOM 1573 CE MET A 92 21.347 -7.883 -10.043 1.00 0.53 C ATOM 0 H MET A 92 26.463 -10.407 -9.004 1.00 20.14 H new ATOM 0 HA MET A 92 26.601 -7.499 -9.535 1.00 23.20 H new ATOM 0 HB2 MET A 92 24.432 -9.418 -8.905 1.00 65.52 H new ATOM 0 HB3 MET A 92 24.386 -7.951 -7.949 1.00 65.52 H new ATOM 0 HG2 MET A 92 24.830 -6.945 -10.477 1.00 5.22 H new ATOM 0 HG3 MET A 92 23.848 -8.353 -10.828 1.00 5.22 H new ATOM 0 HE1 MET A 92 20.370 -7.462 -9.805 1.00 0.53 H new ATOM 0 HE2 MET A 92 21.410 -8.069 -11.115 1.00 0.53 H new ATOM 0 HE3 MET A 92 21.479 -8.821 -9.504 1.00 0.53 H new ATOM 1583 N LEU A 93 27.132 -9.145 -6.779 1.00 44.22 N ATOM 1584 CA LEU A 93 27.644 -9.040 -5.417 1.00 14.41 C ATOM 1585 C LEU A 93 29.004 -8.349 -5.397 1.00 74.35 C ATOM 1586 O LEU A 93 29.113 -7.164 -5.710 1.00 35.01 O ATOM 1587 CB LEU A 93 27.754 -10.428 -4.784 1.00 44.12 C ATOM 1588 CG LEU A 93 26.442 -11.192 -4.608 1.00 13.23 C ATOM 1589 CD1 LEU A 93 26.712 -12.623 -4.171 1.00 73.55 C ATOM 1590 CD2 LEU A 93 25.545 -10.486 -3.601 1.00 50.21 C ATOM 0 H LEU A 93 27.055 -10.100 -7.128 1.00 44.22 H new ATOM 0 HA LEU A 93 26.944 -8.438 -4.838 1.00 14.41 H new ATOM 0 HB2 LEU A 93 28.424 -11.032 -5.396 1.00 44.12 H new ATOM 0 HB3 LEU A 93 28.224 -10.323 -3.806 1.00 44.12 H new ATOM 0 HG LEU A 93 25.927 -11.218 -5.569 1.00 13.23 H new ATOM 0 HD11 LEU A 93 25.766 -13.151 -4.051 1.00 73.55 H new ATOM 0 HD12 LEU A 93 27.315 -13.126 -4.926 1.00 73.55 H new ATOM 0 HD13 LEU A 93 27.248 -12.619 -3.222 1.00 73.55 H new ATOM 0 HD21 LEU A 93 24.615 -11.044 -3.488 1.00 50.21 H new ATOM 0 HD22 LEU A 93 26.053 -10.429 -2.638 1.00 50.21 H new ATOM 0 HD23 LEU A 93 25.323 -9.479 -3.954 1.00 50.21 H new ATOM 1602 N GLN A 94 30.037 -9.100 -5.031 1.00 3.04 N ATOM 1603 CA GLN A 94 31.390 -8.560 -4.972 1.00 44.13 C ATOM 1604 C GLN A 94 32.403 -9.571 -5.499 1.00 43.04 C ATOM 1605 O GLN A 94 32.266 -10.774 -5.278 1.00 64.43 O ATOM 1606 CB GLN A 94 31.744 -8.167 -3.537 1.00 10.11 C ATOM 1607 CG GLN A 94 33.239 -8.043 -3.291 1.00 11.22 C ATOM 1608 CD GLN A 94 33.576 -6.972 -2.272 1.00 52.10 C ATOM 1609 OE1 GLN A 94 33.567 -7.221 -1.066 1.00 73.02 O ATOM 1610 NE2 GLN A 94 33.876 -5.771 -2.752 1.00 52.25 N ATOM 0 H GLN A 94 29.963 -10.084 -4.771 1.00 3.04 H new ATOM 0 HA GLN A 94 31.427 -7.672 -5.604 1.00 44.13 H new ATOM 0 HB2 GLN A 94 31.265 -7.217 -3.301 1.00 10.11 H new ATOM 0 HB3 GLN A 94 31.332 -8.910 -2.854 1.00 10.11 H new ATOM 0 HG2 GLN A 94 33.627 -9.002 -2.947 1.00 11.22 H new ATOM 0 HG3 GLN A 94 33.740 -7.815 -4.232 1.00 11.22 H new ATOM 0 HE21 GLN A 94 33.871 -5.608 -3.759 1.00 52.25 H new ATOM 0 HE22 GLN A 94 34.111 -5.011 -2.114 1.00 52.25 H new ATOM 1619 N ASP A 95 33.419 -9.075 -6.197 1.00 52.42 N ATOM 1620 CA ASP A 95 34.456 -9.935 -6.756 1.00 13.24 C ATOM 1621 C ASP A 95 35.265 -10.601 -5.647 1.00 15.22 C ATOM 1622 O ASP A 95 35.617 -11.777 -5.743 1.00 13.45 O ATOM 1623 CB ASP A 95 35.383 -9.127 -7.666 1.00 33.35 C ATOM 1624 CG ASP A 95 35.909 -9.945 -8.829 1.00 35.23 C ATOM 1625 OD1 ASP A 95 35.165 -10.817 -9.324 1.00 70.24 O ATOM 1626 OD2 ASP A 95 37.064 -9.714 -9.243 1.00 1.13 O ATOM 0 H ASP A 95 33.547 -8.081 -6.389 1.00 52.42 H new ATOM 0 HA ASP A 95 33.970 -10.713 -7.345 1.00 13.24 H new ATOM 0 HB2 ASP A 95 34.846 -8.260 -8.049 1.00 33.35 H new ATOM 0 HB3 ASP A 95 36.222 -8.750 -7.082 1.00 33.35 H new ATOM 1631 N ARG A 96 35.556 -9.841 -4.596 1.00 64.02 N ATOM 1632 CA ARG A 96 36.326 -10.357 -3.470 1.00 52.14 C ATOM 1633 C ARG A 96 35.406 -10.973 -2.420 1.00 61.43 C ATOM 1634 O ARG A 96 35.776 -11.099 -1.252 1.00 62.22 O ATOM 1635 CB ARG A 96 37.160 -9.240 -2.841 1.00 11.14 C ATOM 1636 CG ARG A 96 36.325 -8.155 -2.180 1.00 22.25 C ATOM 1637 CD ARG A 96 37.081 -7.486 -1.043 1.00 2.34 C ATOM 1638 NE ARG A 96 38.431 -7.093 -1.439 1.00 54.53 N ATOM 1639 CZ ARG A 96 39.392 -6.790 -0.574 1.00 63.32 C ATOM 1640 NH1 ARG A 96 39.154 -6.836 0.729 1.00 24.43 N ATOM 1641 NH2 ARG A 96 40.595 -6.442 -1.013 1.00 1.54 N ATOM 0 H ARG A 96 35.270 -8.866 -4.501 1.00 64.02 H new ATOM 0 HA ARG A 96 36.994 -11.133 -3.843 1.00 52.14 H new ATOM 0 HB2 ARG A 96 37.831 -9.673 -2.099 1.00 11.14 H new ATOM 0 HB3 ARG A 96 37.785 -8.787 -3.611 1.00 11.14 H new ATOM 0 HG2 ARG A 96 36.045 -7.407 -2.922 1.00 22.25 H new ATOM 0 HG3 ARG A 96 35.400 -8.588 -1.799 1.00 22.25 H new ATOM 0 HD2 ARG A 96 36.530 -6.606 -0.710 1.00 2.34 H new ATOM 0 HD3 ARG A 96 37.136 -8.168 -0.194 1.00 2.34 H new ATOM 0 HE ARG A 96 38.647 -7.049 -2.435 1.00 54.53 H new ATOM 0 HH11 ARG A 96 38.231 -7.105 1.070 1.00 24.43 H new ATOM 0 HH12 ARG A 96 39.894 -6.603 1.391 1.00 24.43 H new ATOM 0 HH21 ARG A 96 40.782 -6.407 -2.015 1.00 1.54 H new ATOM 0 HH22 ARG A 96 41.333 -6.209 -0.348 1.00 1.54 H new ATOM 1655 N LEU A 97 34.206 -11.356 -2.844 1.00 3.55 N ATOM 1656 CA LEU A 97 33.233 -11.959 -1.940 1.00 14.30 C ATOM 1657 C LEU A 97 33.502 -13.450 -1.767 1.00 34.15 C ATOM 1658 O LEU A 97 33.050 -14.064 -0.800 1.00 32.02 O ATOM 1659 CB LEU A 97 31.814 -11.743 -2.470 1.00 11.03 C ATOM 1660 CG LEU A 97 30.682 -12.281 -1.594 1.00 74.13 C ATOM 1661 CD1 LEU A 97 30.933 -11.948 -0.132 1.00 12.20 C ATOM 1662 CD2 LEU A 97 29.343 -11.719 -2.049 1.00 54.21 C ATOM 0 H LEU A 97 33.884 -11.260 -3.807 1.00 3.55 H new ATOM 0 HA LEU A 97 33.329 -11.476 -0.967 1.00 14.30 H new ATOM 0 HB2 LEU A 97 31.660 -10.673 -2.612 1.00 11.03 H new ATOM 0 HB3 LEU A 97 31.739 -12.209 -3.452 1.00 11.03 H new ATOM 0 HG LEU A 97 30.653 -13.366 -1.698 1.00 74.13 H new ATOM 0 HD11 LEU A 97 30.117 -12.339 0.476 1.00 12.20 H new ATOM 0 HD12 LEU A 97 31.872 -12.399 0.188 1.00 12.20 H new ATOM 0 HD13 LEU A 97 30.990 -10.866 -0.010 1.00 12.20 H new ATOM 0 HD21 LEU A 97 28.549 -12.112 -1.415 1.00 54.21 H new ATOM 0 HD22 LEU A 97 29.361 -10.632 -1.976 1.00 54.21 H new ATOM 0 HD23 LEU A 97 29.159 -12.010 -3.083 1.00 54.21 H new ATOM 1674 N ARG A 98 34.242 -14.026 -2.708 1.00 73.02 N ATOM 1675 CA ARG A 98 34.572 -15.445 -2.659 1.00 31.21 C ATOM 1676 C ARG A 98 33.315 -16.301 -2.785 1.00 53.45 C ATOM 1677 O ARG A 98 32.196 -15.840 -2.559 1.00 35.31 O ATOM 1678 CB ARG A 98 35.298 -15.777 -1.354 1.00 11.33 C ATOM 1679 CG ARG A 98 36.215 -14.666 -0.868 1.00 64.42 C ATOM 1680 CD ARG A 98 37.187 -14.232 -1.954 1.00 64.11 C ATOM 1681 NE ARG A 98 38.488 -13.856 -1.406 1.00 60.52 N ATOM 1682 CZ ARG A 98 39.604 -13.817 -2.125 1.00 5.32 C ATOM 1683 NH1 ARG A 98 39.579 -14.127 -3.414 1.00 32.45 N ATOM 1684 NH2 ARG A 98 40.750 -13.465 -1.555 1.00 12.14 N ATOM 0 H ARG A 98 34.625 -13.532 -3.514 1.00 73.02 H new ATOM 0 HA ARG A 98 35.229 -15.668 -3.500 1.00 31.21 H new ATOM 0 HB2 ARG A 98 34.559 -15.991 -0.581 1.00 11.33 H new ATOM 0 HB3 ARG A 98 35.884 -16.685 -1.495 1.00 11.33 H new ATOM 0 HG2 ARG A 98 35.617 -13.812 -0.551 1.00 64.42 H new ATOM 0 HG3 ARG A 98 36.771 -15.008 0.005 1.00 64.42 H new ATOM 0 HD2 ARG A 98 37.316 -15.043 -2.670 1.00 64.11 H new ATOM 0 HD3 ARG A 98 36.766 -13.388 -2.501 1.00 64.11 H new ATOM 0 HE ARG A 98 38.542 -13.610 -0.418 1.00 60.52 H new ATOM 0 HH11 ARG A 98 38.701 -14.397 -3.857 1.00 32.45 H new ATOM 0 HH12 ARG A 98 40.438 -14.096 -3.963 1.00 32.45 H new ATOM 0 HH21 ARG A 98 40.774 -13.224 -0.564 1.00 12.14 H new ATOM 0 HH22 ARG A 98 41.607 -13.435 -2.108 1.00 12.14 H new ATOM 1698 N PRO A 99 33.501 -17.576 -3.157 1.00 4.04 N ATOM 1699 CA PRO A 99 32.394 -18.522 -3.322 1.00 22.52 C ATOM 1700 C PRO A 99 31.752 -18.901 -1.992 1.00 13.13 C ATOM 1701 O PRO A 99 31.901 -20.027 -1.518 1.00 31.14 O ATOM 1702 CB PRO A 99 33.063 -19.743 -3.959 1.00 61.00 C ATOM 1703 CG PRO A 99 34.488 -19.659 -3.534 1.00 24.02 C ATOM 1704 CD PRO A 99 34.808 -18.192 -3.443 1.00 33.40 C ATOM 0 HA PRO A 99 31.585 -18.102 -3.919 1.00 22.52 H new ATOM 0 HB2 PRO A 99 32.602 -20.670 -3.618 1.00 61.00 H new ATOM 0 HB3 PRO A 99 32.972 -19.723 -5.045 1.00 61.00 H new ATOM 0 HG2 PRO A 99 34.638 -20.151 -2.573 1.00 24.02 H new ATOM 0 HG3 PRO A 99 35.139 -20.157 -4.252 1.00 24.02 H new ATOM 0 HD2 PRO A 99 35.531 -17.986 -2.653 1.00 33.40 H new ATOM 0 HD3 PRO A 99 35.235 -17.815 -4.372 1.00 33.40 H new ATOM 1712 N SER A 100 31.036 -17.953 -1.394 1.00 63.24 N ATOM 1713 CA SER A 100 30.374 -18.187 -0.117 1.00 14.33 C ATOM 1714 C SER A 100 28.901 -18.529 -0.323 1.00 63.40 C ATOM 1715 O SER A 100 28.262 -19.121 0.547 1.00 71.21 O ATOM 1716 CB SER A 100 30.501 -16.954 0.781 1.00 61.22 C ATOM 1717 OG SER A 100 29.402 -16.078 0.603 1.00 34.01 O ATOM 0 H SER A 100 30.900 -17.016 -1.774 1.00 63.24 H new ATOM 0 HA SER A 100 30.862 -19.033 0.367 1.00 14.33 H new ATOM 0 HB2 SER A 100 30.557 -17.264 1.824 1.00 61.22 H new ATOM 0 HB3 SER A 100 31.429 -16.429 0.554 1.00 61.22 H new ATOM 0 HG SER A 100 29.718 -15.150 0.612 1.00 34.01 H new ATOM 1723 N PHE A 101 28.369 -18.153 -1.481 1.00 44.12 N ATOM 1724 CA PHE A 101 26.972 -18.419 -1.803 1.00 41.31 C ATOM 1725 C PHE A 101 26.624 -19.882 -1.548 1.00 20.25 C ATOM 1726 O PHE A 101 25.665 -20.189 -0.840 1.00 53.35 O ATOM 1727 CB PHE A 101 26.686 -18.062 -3.263 1.00 65.34 C ATOM 1728 CG PHE A 101 25.289 -17.564 -3.497 1.00 33.45 C ATOM 1729 CD1 PHE A 101 24.195 -18.341 -3.149 1.00 64.31 C ATOM 1730 CD2 PHE A 101 25.068 -16.320 -4.064 1.00 2.43 C ATOM 1731 CE1 PHE A 101 22.908 -17.886 -3.362 1.00 32.11 C ATOM 1732 CE2 PHE A 101 23.783 -15.859 -4.279 1.00 10.15 C ATOM 1733 CZ PHE A 101 22.701 -16.644 -3.928 1.00 45.54 C ATOM 0 H PHE A 101 28.884 -17.663 -2.212 1.00 44.12 H new ATOM 0 HA PHE A 101 26.352 -17.798 -1.156 1.00 41.31 H new ATOM 0 HB2 PHE A 101 27.394 -17.299 -3.587 1.00 65.34 H new ATOM 0 HB3 PHE A 101 26.858 -18.941 -3.884 1.00 65.34 H new ATOM 0 HD1 PHE A 101 24.351 -19.314 -2.706 1.00 64.31 H new ATOM 0 HD2 PHE A 101 25.910 -15.703 -4.341 1.00 2.43 H new ATOM 0 HE1 PHE A 101 22.065 -18.501 -3.086 1.00 32.11 H new ATOM 0 HE2 PHE A 101 23.624 -14.886 -4.721 1.00 10.15 H new ATOM 0 HZ PHE A 101 21.696 -16.287 -4.096 1.00 45.54 H new ATOM 1743 N ALA A 102 27.411 -20.782 -2.129 1.00 51.41 N ATOM 1744 CA ALA A 102 27.188 -22.212 -1.964 1.00 33.51 C ATOM 1745 C ALA A 102 27.156 -22.596 -0.488 1.00 72.44 C ATOM 1746 O ALA A 102 26.600 -23.630 -0.117 1.00 33.12 O ATOM 1747 CB ALA A 102 28.264 -23.002 -2.694 1.00 22.24 C ATOM 0 H ALA A 102 28.209 -20.545 -2.718 1.00 51.41 H new ATOM 0 HA ALA A 102 26.218 -22.456 -2.397 1.00 33.51 H new ATOM 0 HB1 ALA A 102 28.085 -24.069 -2.562 1.00 22.24 H new ATOM 0 HB2 ALA A 102 28.237 -22.758 -3.756 1.00 22.24 H new ATOM 0 HB3 ALA A 102 29.242 -22.746 -2.288 1.00 22.24 H new ATOM 1753 N LYS A 103 27.756 -21.758 0.349 1.00 25.03 N ATOM 1754 CA LYS A 103 27.797 -22.008 1.785 1.00 30.42 C ATOM 1755 C LYS A 103 26.686 -21.247 2.502 1.00 44.02 C ATOM 1756 O LYS A 103 26.305 -21.593 3.619 1.00 32.33 O ATOM 1757 CB LYS A 103 29.158 -21.604 2.356 1.00 11.31 C ATOM 1758 CG LYS A 103 30.163 -22.741 2.397 1.00 63.53 C ATOM 1759 CD LYS A 103 30.428 -23.302 1.009 1.00 14.22 C ATOM 1760 CE LYS A 103 31.412 -24.461 1.054 1.00 12.43 C ATOM 1761 NZ LYS A 103 32.064 -24.686 -0.265 1.00 72.24 N ATOM 0 H LYS A 103 28.221 -20.898 0.058 1.00 25.03 H new ATOM 0 HA LYS A 103 27.645 -23.075 1.947 1.00 30.42 H new ATOM 0 HB2 LYS A 103 29.567 -20.791 1.757 1.00 11.31 H new ATOM 0 HB3 LYS A 103 29.019 -21.217 3.365 1.00 11.31 H new ATOM 0 HG2 LYS A 103 31.098 -22.386 2.831 1.00 63.53 H new ATOM 0 HG3 LYS A 103 29.791 -23.534 3.046 1.00 63.53 H new ATOM 0 HD2 LYS A 103 29.490 -23.637 0.566 1.00 14.22 H new ATOM 0 HD3 LYS A 103 30.821 -22.514 0.366 1.00 14.22 H new ATOM 0 HE2 LYS A 103 32.175 -24.261 1.807 1.00 12.43 H new ATOM 0 HE3 LYS A 103 30.891 -25.368 1.361 1.00 12.43 H new ATOM 0 HZ1 LYS A 103 32.727 -25.484 -0.193 1.00 72.24 H new ATOM 0 HZ2 LYS A 103 31.339 -24.902 -0.978 1.00 72.24 H new ATOM 0 HZ3 LYS A 103 32.582 -23.829 -0.547 1.00 72.24 H new ATOM 1775 N ALA A 104 26.171 -20.209 1.851 1.00 60.55 N ATOM 1776 CA ALA A 104 25.102 -19.402 2.424 1.00 11.24 C ATOM 1777 C ALA A 104 23.735 -20.007 2.123 1.00 11.34 C ATOM 1778 O ALA A 104 22.750 -19.704 2.797 1.00 12.24 O ATOM 1779 CB ALA A 104 25.178 -17.976 1.899 1.00 15.10 C ATOM 0 H ALA A 104 26.477 -19.908 0.926 1.00 60.55 H new ATOM 0 HA ALA A 104 25.232 -19.386 3.506 1.00 11.24 H new ATOM 0 HB1 ALA A 104 24.373 -17.384 2.335 1.00 15.10 H new ATOM 0 HB2 ALA A 104 26.139 -17.539 2.171 1.00 15.10 H new ATOM 0 HB3 ALA A 104 25.077 -17.982 0.814 1.00 15.10 H new ATOM 1785 N ILE A 105 23.682 -20.862 1.108 1.00 41.23 N ATOM 1786 CA ILE A 105 22.435 -21.509 0.719 1.00 44.14 C ATOM 1787 C ILE A 105 21.714 -22.087 1.931 1.00 22.05 C ATOM 1788 O ILE A 105 20.532 -21.832 2.162 1.00 41.40 O ATOM 1789 CB ILE A 105 22.681 -22.635 -0.303 1.00 55.45 C ATOM 1790 CG1 ILE A 105 23.143 -22.049 -1.639 1.00 53.42 C ATOM 1791 CG2 ILE A 105 21.419 -23.464 -0.491 1.00 12.21 C ATOM 1792 CD1 ILE A 105 22.302 -20.883 -2.111 1.00 10.11 C ATOM 0 H ILE A 105 24.488 -21.123 0.540 1.00 41.23 H new ATOM 0 HA ILE A 105 21.811 -20.742 0.260 1.00 44.14 H new ATOM 0 HB ILE A 105 23.467 -23.286 0.078 1.00 55.45 H new ATOM 0 HG12 ILE A 105 24.179 -21.724 -1.545 1.00 53.42 H new ATOM 0 HG13 ILE A 105 23.122 -22.832 -2.397 1.00 53.42 H new ATOM 0 HG21 ILE A 105 21.608 -24.256 -1.216 1.00 12.21 H new ATOM 0 HG22 ILE A 105 21.129 -23.906 0.462 1.00 12.21 H new ATOM 0 HG23 ILE A 105 20.614 -22.825 -0.854 1.00 12.21 H new ATOM 0 HD11 ILE A 105 22.687 -20.519 -3.063 1.00 10.11 H new ATOM 0 HD12 ILE A 105 21.269 -21.207 -2.237 1.00 10.11 H new ATOM 0 HD13 ILE A 105 22.343 -20.082 -1.373 1.00 10.11 H new ATOM 1804 N PRO A 106 22.442 -22.884 2.728 1.00 73.20 N ATOM 1805 CA PRO A 106 21.893 -23.513 3.933 1.00 74.53 C ATOM 1806 C PRO A 106 21.611 -22.502 5.038 1.00 10.32 C ATOM 1807 O PRO A 106 20.651 -22.648 5.796 1.00 4.45 O ATOM 1808 CB PRO A 106 22.998 -24.481 4.362 1.00 32.35 C ATOM 1809 CG PRO A 106 24.250 -23.899 3.803 1.00 32.11 C ATOM 1810 CD PRO A 106 23.856 -23.232 2.514 1.00 24.11 C ATOM 0 HA PRO A 106 20.935 -23.996 3.740 1.00 74.53 H new ATOM 0 HB2 PRO A 106 23.051 -24.565 5.447 1.00 32.35 H new ATOM 0 HB3 PRO A 106 22.819 -25.483 3.973 1.00 32.35 H new ATOM 0 HG2 PRO A 106 24.690 -23.181 4.495 1.00 32.11 H new ATOM 0 HG3 PRO A 106 24.997 -24.674 3.629 1.00 32.11 H new ATOM 0 HD2 PRO A 106 24.462 -22.348 2.318 1.00 24.11 H new ATOM 0 HD3 PRO A 106 23.981 -23.900 1.662 1.00 24.11 H new ATOM 1818 N CYS A 107 22.452 -21.477 5.124 1.00 52.10 N ATOM 1819 CA CYS A 107 22.293 -20.440 6.138 1.00 70.41 C ATOM 1820 C CYS A 107 21.149 -19.498 5.778 1.00 71.23 C ATOM 1821 O CYS A 107 20.687 -18.717 6.611 1.00 25.42 O ATOM 1822 CB CYS A 107 23.592 -19.648 6.295 1.00 32.41 C ATOM 1823 SG CYS A 107 25.083 -20.671 6.307 1.00 0.21 S ATOM 0 H CYS A 107 23.251 -21.342 4.504 1.00 52.10 H new ATOM 0 HA CYS A 107 22.055 -20.925 7.085 1.00 70.41 H new ATOM 0 HB2 CYS A 107 23.666 -18.927 5.481 1.00 32.41 H new ATOM 0 HB3 CYS A 107 23.548 -19.078 7.223 1.00 32.41 H new ATOM 0 HG CYS A 107 25.428 -20.949 5.085 1.00 0.21 H new ATOM 1829 N LEU A 108 20.696 -19.575 4.531 1.00 24.32 N ATOM 1830 CA LEU A 108 19.607 -18.728 4.059 1.00 34.01 C ATOM 1831 C LEU A 108 18.268 -19.452 4.167 1.00 43.13 C ATOM 1832 O LEU A 108 17.232 -18.830 4.399 1.00 12.41 O ATOM 1833 CB LEU A 108 19.855 -18.304 2.611 1.00 51.24 C ATOM 1834 CG LEU A 108 20.489 -16.926 2.414 1.00 74.22 C ATOM 1835 CD1 LEU A 108 19.482 -15.827 2.719 1.00 64.40 C ATOM 1836 CD2 LEU A 108 21.725 -16.778 3.289 1.00 52.13 C ATOM 0 H LEU A 108 21.066 -20.216 3.829 1.00 24.32 H new ATOM 0 HA LEU A 108 19.571 -17.840 4.690 1.00 34.01 H new ATOM 0 HB2 LEU A 108 20.498 -19.048 2.141 1.00 51.24 H new ATOM 0 HB3 LEU A 108 18.903 -18.323 2.080 1.00 51.24 H new ATOM 0 HG LEU A 108 20.793 -16.832 1.372 1.00 74.22 H new ATOM 0 HD11 LEU A 108 19.951 -14.854 2.574 1.00 64.40 H new ATOM 0 HD12 LEU A 108 18.627 -15.922 2.050 1.00 64.40 H new ATOM 0 HD13 LEU A 108 19.147 -15.917 3.752 1.00 64.40 H new ATOM 0 HD21 LEU A 108 22.163 -15.792 3.136 1.00 52.13 H new ATOM 0 HD22 LEU A 108 21.445 -16.892 4.336 1.00 52.13 H new ATOM 0 HD23 LEU A 108 22.453 -17.544 3.022 1.00 52.13 H new ATOM 1848 N ARG A 109 18.299 -20.770 3.998 1.00 0.23 N ATOM 1849 CA ARG A 109 17.089 -21.579 4.077 1.00 14.55 C ATOM 1850 C ARG A 109 16.813 -22.005 5.516 1.00 31.14 C ATOM 1851 O ARG A 109 15.660 -22.176 5.914 1.00 21.53 O ATOM 1852 CB ARG A 109 17.215 -22.814 3.184 1.00 44.54 C ATOM 1853 CG ARG A 109 18.377 -23.719 3.558 1.00 61.53 C ATOM 1854 CD ARG A 109 18.720 -24.680 2.430 1.00 71.21 C ATOM 1855 NE ARG A 109 19.314 -25.918 2.927 1.00 23.11 N ATOM 1856 CZ ARG A 109 18.618 -26.880 3.523 1.00 3.22 C ATOM 1857 NH1 ARG A 109 17.310 -26.747 3.695 1.00 64.11 N ATOM 1858 NH2 ARG A 109 19.231 -27.977 3.949 1.00 72.45 N ATOM 0 H ARG A 109 19.149 -21.300 3.806 1.00 0.23 H new ATOM 0 HA ARG A 109 16.254 -20.972 3.729 1.00 14.55 H new ATOM 0 HB2 ARG A 109 16.289 -23.386 3.236 1.00 44.54 H new ATOM 0 HB3 ARG A 109 17.334 -22.493 2.149 1.00 44.54 H new ATOM 0 HG2 ARG A 109 19.250 -23.112 3.798 1.00 61.53 H new ATOM 0 HG3 ARG A 109 18.125 -24.284 4.455 1.00 61.53 H new ATOM 0 HD2 ARG A 109 17.817 -24.912 1.865 1.00 71.21 H new ATOM 0 HD3 ARG A 109 19.412 -24.197 1.740 1.00 71.21 H new ATOM 0 HE ARG A 109 20.318 -26.051 2.810 1.00 23.11 H new ATOM 0 HH11 ARG A 109 16.836 -25.905 3.369 1.00 64.11 H new ATOM 0 HH12 ARG A 109 16.778 -27.487 4.153 1.00 64.11 H new ATOM 0 HH21 ARG A 109 20.237 -28.082 3.819 1.00 72.45 H new ATOM 0 HH22 ARG A 109 18.696 -28.715 4.407 1.00 72.45 H new ATOM 1872 N HIS A 110 17.879 -22.175 6.292 1.00 33.33 N ATOM 1873 CA HIS A 110 17.752 -22.582 7.687 1.00 13.13 C ATOM 1874 C HIS A 110 16.862 -21.611 8.457 1.00 0.44 C ATOM 1875 O HIS A 110 16.276 -21.968 9.480 1.00 71.34 O ATOM 1876 CB HIS A 110 19.130 -22.660 8.345 1.00 33.51 C ATOM 1877 CG HIS A 110 19.091 -23.153 9.759 1.00 63.10 C ATOM 1878 ND1 HIS A 110 18.699 -22.365 10.820 1.00 13.11 N ATOM 1879 CD2 HIS A 110 19.398 -24.363 10.284 1.00 54.42 C ATOM 1880 CE1 HIS A 110 18.767 -23.068 11.937 1.00 50.43 C ATOM 1881 NE2 HIS A 110 19.188 -24.284 11.639 1.00 50.44 N ATOM 0 H HIS A 110 18.840 -22.037 5.979 1.00 33.33 H new ATOM 0 HA HIS A 110 17.290 -23.569 7.711 1.00 13.13 H new ATOM 0 HB2 HIS A 110 19.768 -23.319 7.756 1.00 33.51 H new ATOM 0 HB3 HIS A 110 19.589 -21.672 8.326 1.00 33.51 H new ATOM 0 HD2 HIS A 110 19.744 -25.229 9.739 1.00 54.42 H new ATOM 0 HE1 HIS A 110 18.520 -22.709 12.925 1.00 50.43 H new ATOM 0 HE2 HIS A 110 19.333 -25.041 12.307 1.00 50.44 H new ATOM 1889 N ILE A 111 16.767 -20.382 7.961 1.00 50.04 N ATOM 1890 CA ILE A 111 15.949 -19.360 8.602 1.00 32.30 C ATOM 1891 C ILE A 111 14.619 -19.186 7.877 1.00 52.22 C ATOM 1892 O ILE A 111 13.751 -18.434 8.322 1.00 23.42 O ATOM 1893 CB ILE A 111 16.677 -18.004 8.649 1.00 13.14 C ATOM 1894 CG1 ILE A 111 16.929 -17.486 7.232 1.00 60.11 C ATOM 1895 CG2 ILE A 111 17.986 -18.132 9.413 1.00 2.13 C ATOM 1896 CD1 ILE A 111 18.169 -16.628 7.114 1.00 63.22 C ATOM 0 H ILE A 111 17.247 -20.070 7.117 1.00 50.04 H new ATOM 0 HA ILE A 111 15.763 -19.698 9.621 1.00 32.30 H new ATOM 0 HB ILE A 111 16.044 -17.286 9.170 1.00 13.14 H new ATOM 0 HG12 ILE A 111 17.019 -18.335 6.554 1.00 60.11 H new ATOM 0 HG13 ILE A 111 16.064 -16.908 6.906 1.00 60.11 H new ATOM 0 HG21 ILE A 111 18.489 -17.165 9.438 1.00 2.13 H new ATOM 0 HG22 ILE A 111 17.782 -18.461 10.432 1.00 2.13 H new ATOM 0 HG23 ILE A 111 18.627 -18.862 8.918 1.00 2.13 H new ATOM 0 HD11 ILE A 111 18.285 -16.296 6.082 1.00 63.22 H new ATOM 0 HD12 ILE A 111 18.074 -15.760 7.766 1.00 63.22 H new ATOM 0 HD13 ILE A 111 19.043 -17.209 7.409 1.00 63.22 H new ATOM 1908 N ARG A 112 14.465 -19.886 6.758 1.00 32.40 N ATOM 1909 CA ARG A 112 13.240 -19.810 5.971 1.00 50.50 C ATOM 1910 C ARG A 112 13.078 -18.425 5.351 1.00 42.22 C ATOM 1911 O ARG A 112 12.072 -17.749 5.570 1.00 64.43 O ATOM 1912 CB ARG A 112 12.026 -20.134 6.844 1.00 64.10 C ATOM 1913 CG ARG A 112 11.488 -21.541 6.640 1.00 2.21 C ATOM 1914 CD ARG A 112 12.103 -22.521 7.627 1.00 13.12 C ATOM 1915 NE ARG A 112 11.832 -22.145 9.012 1.00 10.22 N ATOM 1916 CZ ARG A 112 12.116 -22.920 10.053 1.00 4.41 C ATOM 1917 NH1 ARG A 112 12.678 -24.106 9.867 1.00 74.33 N ATOM 1918 NH2 ARG A 112 11.840 -22.507 11.284 1.00 70.43 N ATOM 0 H ARG A 112 15.173 -20.512 6.376 1.00 32.40 H new ATOM 0 HA ARG A 112 13.308 -20.544 5.168 1.00 50.50 H new ATOM 0 HB2 ARG A 112 12.298 -20.006 7.892 1.00 64.10 H new ATOM 0 HB3 ARG A 112 11.234 -19.417 6.631 1.00 64.10 H new ATOM 0 HG2 ARG A 112 10.404 -21.538 6.756 1.00 2.21 H new ATOM 0 HG3 ARG A 112 11.698 -21.868 5.622 1.00 2.21 H new ATOM 0 HD2 ARG A 112 11.710 -23.520 7.439 1.00 13.12 H new ATOM 0 HD3 ARG A 112 13.180 -22.568 7.468 1.00 13.12 H new ATOM 0 HE ARG A 112 11.401 -21.238 9.190 1.00 10.22 H new ATOM 0 HH11 ARG A 112 12.894 -24.426 8.923 1.00 74.33 H new ATOM 0 HH12 ARG A 112 12.895 -24.699 10.668 1.00 74.33 H new ATOM 0 HH21 ARG A 112 11.410 -21.594 11.431 1.00 70.43 H new ATOM 0 HH22 ARG A 112 12.058 -23.103 12.083 1.00 70.43 H new ATOM 1932 N ARG A 113 14.075 -18.008 4.577 1.00 62.50 N ATOM 1933 CA ARG A 113 14.044 -16.704 3.927 1.00 43.12 C ATOM 1934 C ARG A 113 14.031 -16.853 2.408 1.00 20.53 C ATOM 1935 O ARG A 113 13.463 -16.023 1.698 1.00 21.21 O ATOM 1936 CB ARG A 113 15.251 -15.867 4.357 1.00 35.21 C ATOM 1937 CG ARG A 113 15.371 -14.546 3.616 1.00 51.15 C ATOM 1938 CD ARG A 113 14.261 -13.584 4.008 1.00 10.54 C ATOM 1939 NE ARG A 113 14.173 -13.411 5.456 1.00 71.21 N ATOM 1940 CZ ARG A 113 14.958 -12.593 6.148 1.00 54.53 C ATOM 1941 NH1 ARG A 113 15.884 -11.875 5.527 1.00 13.21 N ATOM 1942 NH2 ARG A 113 14.816 -12.490 7.463 1.00 24.21 N ATOM 0 H ARG A 113 14.914 -18.555 4.385 1.00 62.50 H new ATOM 0 HA ARG A 113 13.130 -16.196 4.233 1.00 43.12 H new ATOM 0 HB2 ARG A 113 15.183 -15.669 5.427 1.00 35.21 H new ATOM 0 HB3 ARG A 113 16.160 -16.447 4.198 1.00 35.21 H new ATOM 0 HG2 ARG A 113 16.339 -14.093 3.831 1.00 51.15 H new ATOM 0 HG3 ARG A 113 15.335 -14.726 2.542 1.00 51.15 H new ATOM 0 HD2 ARG A 113 14.437 -12.617 3.537 1.00 10.54 H new ATOM 0 HD3 ARG A 113 13.309 -13.955 3.629 1.00 10.54 H new ATOM 0 HE ARG A 113 13.470 -13.948 5.964 1.00 71.21 H new ATOM 0 HH11 ARG A 113 15.995 -11.950 4.516 1.00 13.21 H new ATOM 0 HH12 ARG A 113 16.486 -11.247 6.061 1.00 13.21 H new ATOM 0 HH21 ARG A 113 14.103 -13.039 7.944 1.00 24.21 H new ATOM 0 HH22 ARG A 113 15.419 -11.862 7.993 1.00 24.21 H new ATOM 1956 N ILE A 114 14.660 -17.916 1.918 1.00 24.12 N ATOM 1957 CA ILE A 114 14.720 -18.174 0.485 1.00 62.12 C ATOM 1958 C ILE A 114 14.782 -19.670 0.198 1.00 61.53 C ATOM 1959 O ILE A 114 14.760 -20.490 1.116 1.00 73.42 O ATOM 1960 CB ILE A 114 15.939 -17.488 -0.160 1.00 70.23 C ATOM 1961 CG1 ILE A 114 17.229 -18.203 0.247 1.00 31.22 C ATOM 1962 CG2 ILE A 114 15.992 -16.021 0.237 1.00 44.53 C ATOM 1963 CD1 ILE A 114 17.757 -19.146 -0.811 1.00 44.12 C ATOM 0 H ILE A 114 15.135 -18.612 2.492 1.00 24.12 H new ATOM 0 HA ILE A 114 13.809 -17.761 0.052 1.00 62.12 H new ATOM 0 HB ILE A 114 15.840 -17.548 -1.244 1.00 70.23 H new ATOM 0 HG12 ILE A 114 17.992 -17.458 0.472 1.00 31.22 H new ATOM 0 HG13 ILE A 114 17.050 -18.763 1.165 1.00 31.22 H new ATOM 0 HG21 ILE A 114 16.859 -15.550 -0.226 1.00 44.53 H new ATOM 0 HG22 ILE A 114 15.084 -15.520 -0.099 1.00 44.53 H new ATOM 0 HG23 ILE A 114 16.071 -15.940 1.321 1.00 44.53 H new ATOM 0 HD11 ILE A 114 18.673 -19.617 -0.454 1.00 44.12 H new ATOM 0 HD12 ILE A 114 17.011 -19.913 -1.019 1.00 44.12 H new ATOM 0 HD13 ILE A 114 17.968 -18.588 -1.723 1.00 44.12 H new ATOM 1975 N ARG A 115 14.862 -20.019 -1.082 1.00 53.03 N ATOM 1976 CA ARG A 115 14.928 -21.417 -1.491 1.00 13.03 C ATOM 1977 C ARG A 115 15.822 -21.584 -2.716 1.00 2.24 C ATOM 1978 O ARG A 115 16.300 -20.603 -3.285 1.00 21.13 O ATOM 1979 CB ARG A 115 13.526 -21.949 -1.794 1.00 14.43 C ATOM 1980 CG ARG A 115 12.768 -22.406 -0.558 1.00 73.53 C ATOM 1981 CD ARG A 115 11.610 -23.323 -0.923 1.00 23.14 C ATOM 1982 NE ARG A 115 12.050 -24.477 -1.702 1.00 44.02 N ATOM 1983 CZ ARG A 115 11.220 -25.378 -2.214 1.00 75.13 C ATOM 1984 NH1 ARG A 115 9.912 -25.259 -2.030 1.00 51.14 N ATOM 1985 NH2 ARG A 115 11.696 -26.401 -2.912 1.00 43.24 N ATOM 0 H ARG A 115 14.883 -19.353 -1.854 1.00 53.03 H new ATOM 0 HA ARG A 115 15.357 -21.990 -0.669 1.00 13.03 H new ATOM 0 HB2 ARG A 115 12.951 -21.170 -2.295 1.00 14.43 H new ATOM 0 HB3 ARG A 115 13.606 -22.784 -2.490 1.00 14.43 H new ATOM 0 HG2 ARG A 115 13.448 -22.927 0.116 1.00 73.53 H new ATOM 0 HG3 ARG A 115 12.390 -21.537 -0.019 1.00 73.53 H new ATOM 0 HD2 ARG A 115 11.119 -23.666 -0.013 1.00 23.14 H new ATOM 0 HD3 ARG A 115 10.869 -22.762 -1.493 1.00 23.14 H new ATOM 0 HE ARG A 115 13.050 -24.598 -1.862 1.00 44.02 H new ATOM 0 HH11 ARG A 115 9.542 -24.474 -1.494 1.00 51.14 H new ATOM 0 HH12 ARG A 115 9.276 -25.952 -2.424 1.00 51.14 H new ATOM 0 HH21 ARG A 115 12.701 -26.496 -3.056 1.00 43.24 H new ATOM 0 HH22 ARG A 115 11.057 -27.092 -3.304 1.00 43.24 H new ATOM 1999 N GLU A 116 16.044 -22.832 -3.115 1.00 30.45 N ATOM 2000 CA GLU A 116 16.882 -23.127 -4.271 1.00 3.32 C ATOM 2001 C GLU A 116 16.366 -24.352 -5.019 1.00 70.33 C ATOM 2002 O GLU A 116 16.183 -25.418 -4.433 1.00 32.34 O ATOM 2003 CB GLU A 116 18.331 -23.355 -3.834 1.00 33.34 C ATOM 2004 CG GLU A 116 18.465 -23.833 -2.397 1.00 52.53 C ATOM 2005 CD GLU A 116 17.739 -25.140 -2.147 1.00 21.22 C ATOM 2006 OE1 GLU A 116 18.144 -26.166 -2.733 1.00 10.23 O ATOM 2007 OE2 GLU A 116 16.766 -25.137 -1.364 1.00 71.31 O ATOM 0 H GLU A 116 15.655 -23.655 -2.655 1.00 30.45 H new ATOM 0 HA GLU A 116 16.844 -22.270 -4.943 1.00 3.32 H new ATOM 0 HB2 GLU A 116 18.790 -24.089 -4.496 1.00 33.34 H new ATOM 0 HB3 GLU A 116 18.888 -22.426 -3.952 1.00 33.34 H new ATOM 0 HG2 GLU A 116 19.521 -23.956 -2.156 1.00 52.53 H new ATOM 0 HG3 GLU A 116 18.072 -23.069 -1.726 1.00 52.53 H new ATOM 2014 N GLU A 117 16.133 -24.191 -6.318 1.00 42.41 N ATOM 2015 CA GLU A 117 15.637 -25.283 -7.146 1.00 73.23 C ATOM 2016 C GLU A 117 16.686 -25.711 -8.169 1.00 33.14 C ATOM 2017 O GLU A 117 16.969 -24.987 -9.123 1.00 61.01 O ATOM 2018 CB GLU A 117 14.351 -24.866 -7.863 1.00 13.11 C ATOM 2019 CG GLU A 117 13.680 -26.000 -8.619 1.00 73.20 C ATOM 2020 CD GLU A 117 12.517 -26.603 -7.855 1.00 52.11 C ATOM 2021 OE1 GLU A 117 11.388 -26.085 -7.988 1.00 2.52 O ATOM 2022 OE2 GLU A 117 12.735 -27.592 -7.125 1.00 13.02 O ATOM 0 H GLU A 117 16.280 -23.315 -6.819 1.00 42.41 H new ATOM 0 HA GLU A 117 15.423 -26.130 -6.494 1.00 73.23 H new ATOM 0 HB2 GLU A 117 13.651 -24.465 -7.131 1.00 13.11 H new ATOM 0 HB3 GLU A 117 14.579 -24.060 -8.561 1.00 13.11 H new ATOM 0 HG2 GLU A 117 13.325 -25.630 -9.581 1.00 73.20 H new ATOM 0 HG3 GLU A 117 14.415 -26.777 -8.828 1.00 73.20 H new ATOM 2029 N ARG A 118 17.259 -26.892 -7.961 1.00 34.12 N ATOM 2030 CA ARG A 118 18.277 -27.416 -8.862 1.00 64.24 C ATOM 2031 C ARG A 118 17.651 -27.902 -10.166 1.00 64.14 C ATOM 2032 O ARG A 118 17.069 -28.986 -10.221 1.00 11.12 O ATOM 2033 CB ARG A 118 19.041 -28.561 -8.193 1.00 50.43 C ATOM 2034 CG ARG A 118 19.747 -29.479 -9.177 1.00 41.13 C ATOM 2035 CD ARG A 118 20.638 -28.696 -10.129 1.00 71.02 C ATOM 2036 NE ARG A 118 21.864 -29.421 -10.453 1.00 12.24 N ATOM 2037 CZ ARG A 118 22.846 -29.628 -9.583 1.00 22.12 C ATOM 2038 NH1 ARG A 118 22.747 -29.168 -8.343 1.00 74.22 N ATOM 2039 NH2 ARG A 118 23.931 -30.297 -9.952 1.00 71.12 N ATOM 0 H ARG A 118 17.035 -27.504 -7.176 1.00 34.12 H new ATOM 0 HA ARG A 118 18.973 -26.609 -9.091 1.00 64.24 H new ATOM 0 HB2 ARG A 118 19.777 -28.143 -7.507 1.00 50.43 H new ATOM 0 HB3 ARG A 118 18.346 -29.150 -7.595 1.00 50.43 H new ATOM 0 HG2 ARG A 118 20.347 -30.207 -8.631 1.00 41.13 H new ATOM 0 HG3 ARG A 118 19.007 -30.040 -9.748 1.00 41.13 H new ATOM 0 HD2 ARG A 118 20.089 -28.483 -11.047 1.00 71.02 H new ATOM 0 HD3 ARG A 118 20.893 -27.736 -9.680 1.00 71.02 H new ATOM 0 HE ARG A 118 21.972 -29.788 -11.399 1.00 12.24 H new ATOM 0 HH11 ARG A 118 21.915 -28.653 -8.055 1.00 74.22 H new ATOM 0 HH12 ARG A 118 23.503 -29.329 -7.677 1.00 74.22 H new ATOM 0 HH21 ARG A 118 24.011 -30.653 -10.905 1.00 71.12 H new ATOM 0 HH22 ARG A 118 24.685 -30.455 -9.283 1.00 71.12 H new ATOM 2053 N CYS A 119 17.775 -27.094 -11.213 1.00 42.21 N ATOM 2054 CA CYS A 119 17.220 -27.440 -12.517 1.00 25.52 C ATOM 2055 C CYS A 119 18.329 -27.622 -13.549 1.00 11.53 C ATOM 2056 O CYS A 119 18.617 -26.717 -14.331 1.00 12.31 O ATOM 2057 CB CYS A 119 16.245 -26.359 -12.983 1.00 12.00 C ATOM 2058 SG CYS A 119 15.021 -25.884 -11.740 1.00 12.50 S ATOM 0 H CYS A 119 18.255 -26.194 -11.185 1.00 42.21 H new ATOM 0 HA CYS A 119 16.683 -28.383 -12.417 1.00 25.52 H new ATOM 0 HB2 CYS A 119 16.812 -25.475 -13.276 1.00 12.00 H new ATOM 0 HB3 CYS A 119 15.725 -26.713 -13.873 1.00 12.00 H new ATOM 0 HG CYS A 119 14.810 -24.603 -11.806 1.00 12.50 H new ATOM 2064 N GLY A 120 18.949 -28.798 -13.543 1.00 44.41 N ATOM 2065 CA GLY A 120 20.021 -29.075 -14.482 1.00 32.53 C ATOM 2066 C GLY A 120 21.270 -28.268 -14.191 1.00 3.00 C ATOM 2067 O GLY A 120 21.643 -28.055 -13.037 1.00 51.21 O ATOM 0 H GLY A 120 18.729 -29.563 -12.906 1.00 44.41 H new ATOM 0 HA2 GLY A 120 20.263 -30.137 -14.449 1.00 32.53 H new ATOM 0 HA3 GLY A 120 19.679 -28.857 -15.494 1.00 32.53 H new ATOM 2071 N PRO A 121 21.941 -27.805 -15.256 1.00 3.30 N ATOM 2072 CA PRO A 121 23.167 -27.010 -15.135 1.00 1.01 C ATOM 2073 C PRO A 121 22.902 -25.617 -14.573 1.00 70.32 C ATOM 2074 O PRO A 121 23.808 -24.788 -14.489 1.00 45.43 O ATOM 2075 CB PRO A 121 23.674 -26.918 -16.576 1.00 51.33 C ATOM 2076 CG PRO A 121 22.456 -27.085 -17.418 1.00 13.35 C ATOM 2077 CD PRO A 121 21.555 -28.021 -16.660 1.00 53.34 C ATOM 0 HA PRO A 121 23.880 -27.463 -14.446 1.00 1.01 H new ATOM 0 HB2 PRO A 121 24.157 -25.960 -16.765 1.00 51.33 H new ATOM 0 HB3 PRO A 121 24.410 -27.694 -16.787 1.00 51.33 H new ATOM 0 HG2 PRO A 121 21.967 -26.127 -17.591 1.00 13.35 H new ATOM 0 HG3 PRO A 121 22.710 -27.494 -18.396 1.00 13.35 H new ATOM 0 HD2 PRO A 121 20.503 -27.790 -16.828 1.00 53.34 H new ATOM 0 HD3 PRO A 121 21.706 -29.057 -16.963 1.00 53.34 H new ATOM 2085 N LEU A 122 21.655 -25.367 -14.189 1.00 41.14 N ATOM 2086 CA LEU A 122 21.271 -24.074 -13.635 1.00 15.34 C ATOM 2087 C LEU A 122 20.734 -24.228 -12.215 1.00 74.12 C ATOM 2088 O LEU A 122 20.567 -25.343 -11.720 1.00 72.41 O ATOM 2089 CB LEU A 122 20.216 -23.409 -14.521 1.00 60.45 C ATOM 2090 CG LEU A 122 20.649 -23.086 -15.952 1.00 1.12 C ATOM 2091 CD1 LEU A 122 19.444 -23.048 -16.879 1.00 22.42 C ATOM 2092 CD2 LEU A 122 21.399 -21.763 -15.995 1.00 44.35 C ATOM 0 H LEU A 122 20.893 -26.042 -14.251 1.00 41.14 H new ATOM 0 HA LEU A 122 22.159 -23.443 -13.602 1.00 15.34 H new ATOM 0 HB2 LEU A 122 19.344 -24.061 -14.565 1.00 60.45 H new ATOM 0 HB3 LEU A 122 19.898 -22.483 -14.041 1.00 60.45 H new ATOM 0 HG LEU A 122 21.320 -23.873 -16.295 1.00 1.12 H new ATOM 0 HD11 LEU A 122 19.772 -22.817 -17.893 1.00 22.42 H new ATOM 0 HD12 LEU A 122 18.948 -24.018 -16.871 1.00 22.42 H new ATOM 0 HD13 LEU A 122 18.748 -22.281 -16.539 1.00 22.42 H new ATOM 0 HD21 LEU A 122 21.700 -21.548 -17.020 1.00 44.35 H new ATOM 0 HD22 LEU A 122 20.751 -20.965 -15.633 1.00 44.35 H new ATOM 0 HD23 LEU A 122 22.285 -21.826 -15.363 1.00 44.35 H new ATOM 2104 N THR A 123 20.462 -23.101 -11.565 1.00 2.23 N ATOM 2105 CA THR A 123 19.943 -23.110 -10.203 1.00 20.31 C ATOM 2106 C THR A 123 19.168 -21.833 -9.901 1.00 75.13 C ATOM 2107 O THR A 123 19.729 -20.738 -9.908 1.00 43.51 O ATOM 2108 CB THR A 123 21.076 -23.265 -9.171 1.00 31.32 C ATOM 2109 OG1 THR A 123 22.049 -24.201 -9.648 1.00 71.22 O ATOM 2110 CG2 THR A 123 20.528 -23.735 -7.832 1.00 14.22 C ATOM 0 H THR A 123 20.593 -22.170 -11.960 1.00 2.23 H new ATOM 0 HA THR A 123 19.272 -23.966 -10.127 1.00 20.31 H new ATOM 0 HB THR A 123 21.546 -22.291 -9.032 1.00 31.32 H new ATOM 0 HG1 THR A 123 22.767 -24.293 -8.987 1.00 71.22 H new ATOM 0 HG21 THR A 123 21.347 -23.837 -7.120 1.00 14.22 H new ATOM 0 HG22 THR A 123 19.809 -23.006 -7.457 1.00 14.22 H new ATOM 0 HG23 THR A 123 20.035 -24.699 -7.959 1.00 14.22 H new ATOM 2118 N PHE A 124 17.874 -21.981 -9.636 1.00 53.41 N ATOM 2119 CA PHE A 124 17.021 -20.838 -9.332 1.00 15.21 C ATOM 2120 C PHE A 124 16.868 -20.659 -7.824 1.00 42.22 C ATOM 2121 O PHE A 124 17.257 -21.527 -7.043 1.00 4.15 O ATOM 2122 CB PHE A 124 15.645 -21.016 -9.977 1.00 54.43 C ATOM 2123 CG PHE A 124 15.702 -21.219 -11.464 1.00 52.13 C ATOM 2124 CD1 PHE A 124 15.921 -22.479 -11.997 1.00 30.24 C ATOM 2125 CD2 PHE A 124 15.537 -20.150 -12.330 1.00 11.41 C ATOM 2126 CE1 PHE A 124 15.974 -22.670 -13.365 1.00 12.14 C ATOM 2127 CE2 PHE A 124 15.588 -20.334 -13.699 1.00 22.34 C ATOM 2128 CZ PHE A 124 15.808 -21.596 -14.217 1.00 2.34 C ATOM 0 H PHE A 124 17.394 -22.881 -9.626 1.00 53.41 H new ATOM 0 HA PHE A 124 17.494 -19.945 -9.740 1.00 15.21 H new ATOM 0 HB2 PHE A 124 15.146 -21.871 -9.520 1.00 54.43 H new ATOM 0 HB3 PHE A 124 15.035 -20.139 -9.761 1.00 54.43 H new ATOM 0 HD1 PHE A 124 16.052 -23.322 -11.335 1.00 30.24 H new ATOM 0 HD2 PHE A 124 15.367 -19.161 -11.931 1.00 11.41 H new ATOM 0 HE1 PHE A 124 16.145 -23.658 -13.767 1.00 12.14 H new ATOM 0 HE2 PHE A 124 15.456 -19.492 -14.363 1.00 22.34 H new ATOM 0 HZ PHE A 124 15.850 -21.742 -15.286 1.00 2.34 H new ATOM 2138 N TYR A 125 16.300 -19.527 -7.423 1.00 42.05 N ATOM 2139 CA TYR A 125 16.099 -19.232 -6.010 1.00 12.51 C ATOM 2140 C TYR A 125 14.879 -18.337 -5.809 1.00 24.14 C ATOM 2141 O TYR A 125 14.779 -17.262 -6.401 1.00 20.31 O ATOM 2142 CB TYR A 125 17.342 -18.557 -5.426 1.00 74.51 C ATOM 2143 CG TYR A 125 18.635 -19.244 -5.801 1.00 24.42 C ATOM 2144 CD1 TYR A 125 19.276 -18.955 -6.999 1.00 63.33 C ATOM 2145 CD2 TYR A 125 19.216 -20.183 -4.957 1.00 44.02 C ATOM 2146 CE1 TYR A 125 20.458 -19.581 -7.346 1.00 42.23 C ATOM 2147 CE2 TYR A 125 20.399 -20.812 -5.295 1.00 72.22 C ATOM 2148 CZ TYR A 125 21.016 -20.508 -6.491 1.00 33.02 C ATOM 2149 OH TYR A 125 22.193 -21.134 -6.832 1.00 11.21 O ATOM 0 H TYR A 125 15.971 -18.799 -8.057 1.00 42.05 H new ATOM 0 HA TYR A 125 15.927 -20.174 -5.489 1.00 12.51 H new ATOM 0 HB2 TYR A 125 17.378 -17.522 -5.767 1.00 74.51 H new ATOM 0 HB3 TYR A 125 17.255 -18.532 -4.340 1.00 74.51 H new ATOM 0 HD1 TYR A 125 18.843 -18.229 -7.671 1.00 63.33 H new ATOM 0 HD2 TYR A 125 18.735 -20.425 -4.021 1.00 44.02 H new ATOM 0 HE1 TYR A 125 20.942 -19.345 -8.282 1.00 42.23 H new ATOM 0 HE2 TYR A 125 20.838 -21.538 -4.627 1.00 72.22 H new ATOM 0 HH TYR A 125 22.951 -20.583 -6.547 1.00 11.21 H new ATOM 2159 N TYR A 126 13.955 -18.789 -4.968 1.00 41.33 N ATOM 2160 CA TYR A 126 12.741 -18.032 -4.689 1.00 12.51 C ATOM 2161 C TYR A 126 12.571 -17.808 -3.189 1.00 71.42 C ATOM 2162 O TYR A 126 12.965 -18.633 -2.364 1.00 45.41 O ATOM 2163 CB TYR A 126 11.519 -18.762 -5.249 1.00 1.12 C ATOM 2164 CG TYR A 126 11.683 -20.264 -5.300 1.00 74.20 C ATOM 2165 CD1 TYR A 126 12.248 -20.884 -6.408 1.00 3.42 C ATOM 2166 CD2 TYR A 126 11.271 -21.064 -4.242 1.00 33.35 C ATOM 2167 CE1 TYR A 126 12.399 -22.256 -6.460 1.00 2.25 C ATOM 2168 CE2 TYR A 126 11.419 -22.437 -4.284 1.00 30.11 C ATOM 2169 CZ TYR A 126 11.983 -23.028 -5.395 1.00 65.10 C ATOM 2170 OH TYR A 126 12.132 -24.395 -5.442 1.00 34.43 O ATOM 0 H TYR A 126 14.024 -19.675 -4.468 1.00 41.33 H new ATOM 0 HA TYR A 126 12.830 -17.061 -5.175 1.00 12.51 H new ATOM 0 HB2 TYR A 126 10.650 -18.520 -4.637 1.00 1.12 H new ATOM 0 HB3 TYR A 126 11.314 -18.393 -6.254 1.00 1.12 H new ATOM 0 HD1 TYR A 126 12.575 -20.282 -7.243 1.00 3.42 H new ATOM 0 HD2 TYR A 126 10.827 -20.605 -3.371 1.00 33.35 H new ATOM 0 HE1 TYR A 126 12.840 -22.722 -7.329 1.00 2.25 H new ATOM 0 HE2 TYR A 126 11.095 -23.044 -3.452 1.00 30.11 H new ATOM 0 HH TYR A 126 11.340 -24.824 -5.055 1.00 34.43 H new ATOM 2180 N PRO A 127 11.968 -16.666 -2.827 1.00 21.33 N ATOM 2181 CA PRO A 127 11.730 -16.307 -1.426 1.00 21.15 C ATOM 2182 C PRO A 127 10.670 -17.188 -0.773 1.00 62.12 C ATOM 2183 O PRO A 127 9.481 -16.875 -0.809 1.00 20.11 O ATOM 2184 CB PRO A 127 11.244 -14.858 -1.509 1.00 33.04 C ATOM 2185 CG PRO A 127 10.660 -14.732 -2.873 1.00 74.23 C ATOM 2186 CD PRO A 127 11.472 -15.638 -3.757 1.00 21.03 C ATOM 0 HA PRO A 127 12.623 -16.437 -0.815 1.00 21.15 H new ATOM 0 HB2 PRO A 127 10.502 -14.645 -0.739 1.00 33.04 H new ATOM 0 HB3 PRO A 127 12.065 -14.156 -1.364 1.00 33.04 H new ATOM 0 HG2 PRO A 127 9.610 -15.023 -2.876 1.00 74.23 H new ATOM 0 HG3 PRO A 127 10.706 -13.701 -3.224 1.00 74.23 H new ATOM 0 HD2 PRO A 127 10.866 -16.073 -4.551 1.00 21.03 H new ATOM 0 HD3 PRO A 127 12.291 -15.102 -4.238 1.00 21.03 H new ATOM 2194 N GLY A 128 11.110 -18.292 -0.177 1.00 30.14 N ATOM 2195 CA GLY A 128 10.186 -19.201 0.476 1.00 72.22 C ATOM 2196 C GLY A 128 8.969 -19.502 -0.377 1.00 0.52 C ATOM 2197 O GLY A 128 7.917 -18.885 -0.208 1.00 41.13 O ATOM 0 H GLY A 128 12.090 -18.573 -0.135 1.00 30.14 H new ATOM 0 HA2 GLY A 128 10.702 -20.133 0.710 1.00 72.22 H new ATOM 0 HA3 GLY A 128 9.864 -18.769 1.423 1.00 72.22 H new ATOM 2201 N SER A 129 9.112 -20.451 -1.296 1.00 43.43 N ATOM 2202 CA SER A 129 8.017 -20.828 -2.183 1.00 5.34 C ATOM 2203 C SER A 129 6.765 -21.173 -1.383 1.00 1.35 C ATOM 2204 O SER A 129 5.645 -20.902 -1.815 1.00 12.44 O ATOM 2205 CB SER A 129 8.425 -22.018 -3.053 1.00 34.33 C ATOM 2206 OG SER A 129 7.341 -22.913 -3.232 1.00 74.31 O ATOM 0 H SER A 129 9.975 -20.973 -1.446 1.00 43.43 H new ATOM 0 HA SER A 129 7.793 -19.977 -2.826 1.00 5.34 H new ATOM 0 HB2 SER A 129 8.771 -21.662 -4.023 1.00 34.33 H new ATOM 0 HB3 SER A 129 9.261 -22.542 -2.589 1.00 34.33 H new ATOM 0 HG SER A 129 7.626 -23.664 -3.793 1.00 74.31 H new ATOM 2212 N SER A 130 6.964 -21.773 -0.213 1.00 41.23 N ATOM 2213 CA SER A 130 5.852 -22.159 0.647 1.00 73.12 C ATOM 2214 C SER A 130 5.280 -20.946 1.374 1.00 4.30 C ATOM 2215 O SER A 130 5.944 -19.919 1.504 1.00 3.51 O ATOM 2216 CB SER A 130 6.306 -23.210 1.662 1.00 14.53 C ATOM 2217 OG SER A 130 6.099 -24.521 1.167 1.00 51.14 O ATOM 0 H SER A 130 7.885 -22.002 0.160 1.00 41.23 H new ATOM 0 HA SER A 130 5.070 -22.585 0.019 1.00 73.12 H new ATOM 0 HB2 SER A 130 7.362 -23.067 1.890 1.00 14.53 H new ATOM 0 HB3 SER A 130 5.758 -23.080 2.595 1.00 14.53 H new ATOM 0 HG SER A 130 6.399 -25.174 1.834 1.00 51.14 H new TER 2223 SER A 130