USER MOD reduce.3.24.130724 H: found=0, std=0, add=1011, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1011 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 87 MET CE :methyl -143:sc= -2.13 (180deg=-4.01!) USER MOD Set 1.2: A 106 MET CE :methyl -151:sc= -0.331 (180deg=-1.22) USER MOD Set 2.1: A 25 LYS NZ :NH3+ -164:sc= 0 (180deg=0) USER MOD Set 2.2: A 111 HIS : no HD1:sc= -0.246 X(o=-0.25,f=0) USER MOD Set 3.1: A 11 TYR OH : rot 180:sc= 0 USER MOD Set 3.2: A 15 MET CE :methyl -166:sc= 0 (180deg=-0.309) USER MOD Single : A 13 ASN : amide:sc= -0.103 X(o=-0.1,f=-0.36) USER MOD Single : A 26 ASN : amide:sc= -0.725 K(o=-0.72,f=-4.4!) USER MOD Single : A 29 SER OG : rot -53:sc= 0.873 USER MOD Single : A 30 GLN : amide:sc= -0.715 X(o=-0.72,f=-0.61) USER MOD Single : A 36 TYR OH : rot -37:sc= 0.923 USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 ASN : amide:sc= -3.66! C(o=-3.7!,f=-12!) USER MOD Single : A 46 THR OG1 : rot 180:sc= -0.37 USER MOD Single : A 49 LYS NZ :NH3+ -176:sc= -0.0206 (180deg=-0.0623) USER MOD Single : A 53 SER OG : rot -55:sc= 0.986 USER MOD Single : A 60 SER OG : rot -150:sc=-0.00991 USER MOD Single : A 63 SER OG : rot -50:sc= 0.00341 USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 65 SER OG : rot -140:sc= -0.37 USER MOD Single : A 67 THR OG1 : rot 180:sc= 0.013 USER MOD Single : A 72 THR OG1 : rot 97:sc= 1.24 USER MOD Single : A 73 GLN : amide:sc= -2.65 K(o=-2.6,f=-4!) USER MOD Single : A 74 LYS NZ :NH3+ -150:sc= -0.142 (180deg=-0.616) USER MOD Single : A 77 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 78 LYS NZ :NH3+ -114:sc= -0.136 (180deg=-1.4!) USER MOD Single : A 85 ASN : amide:sc= -1.34 K(o=-1.3,f=-0.027) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 GLN : amide:sc= -0.664 X(o=-0.66,f=-0.48) USER MOD Single : A 92 GLN : amide:sc= -5.04! C(o=-5!,f=-11!) USER MOD Single : A 93 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 96 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot 180:sc=-0.00741 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 GLN : amide:sc= -0.719 X(o=-0.72,f=-0.31) USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 SER OG : rot -54:sc= 0.976 USER MOD Single : A 112 THR OG1 : rot 180:sc= 0.0111 USER MOD Single : A 118 LYS NZ :NH3+ 152:sc= -1.07 (180deg=-1.81!) USER MOD Single : A 119 ASN : amide:sc= -0.429 K(o=-0.43,f=-1.3!) USER MOD Single : A 126 GLN : amide:sc= -0.277 X(o=-0.28,f=-0.2) USER MOD Single : A 128 LYS NZ :NH3+ 158:sc= -0.05 (180deg=-0.332) USER MOD ----------------------------------------------------------------- ATOM 106 N ASP A 8 17.688 -8.672 -8.967 1.00 51.23 N ATOM 107 CA ASP A 8 18.195 -10.035 -9.076 1.00 11.24 C ATOM 108 C ASP A 8 17.213 -10.921 -9.836 1.00 20.14 C ATOM 109 O ASP A 8 16.080 -11.127 -9.399 1.00 52.00 O ATOM 110 CB ASP A 8 18.456 -10.617 -7.685 1.00 54.34 C ATOM 111 CG ASP A 8 17.217 -10.606 -6.812 1.00 33.13 C ATOM 112 OD1 ASP A 8 17.000 -9.602 -6.102 1.00 4.11 O ATOM 113 OD2 ASP A 8 16.464 -11.602 -6.837 1.00 72.40 O ATOM 0 HA ASP A 8 19.133 -10.005 -9.631 1.00 11.24 H new ATOM 0 HB2 ASP A 8 18.818 -11.640 -7.784 1.00 54.34 H new ATOM 0 HB3 ASP A 8 19.246 -10.046 -7.197 1.00 54.34 H new ATOM 118 N LEU A 9 17.654 -11.442 -10.975 1.00 64.20 N ATOM 119 CA LEU A 9 16.814 -12.306 -11.797 1.00 62.13 C ATOM 120 C LEU A 9 17.077 -13.776 -11.488 1.00 23.32 C ATOM 121 O LEU A 9 16.843 -14.649 -12.324 1.00 32.24 O ATOM 122 CB LEU A 9 17.066 -12.033 -13.281 1.00 53.42 C ATOM 123 CG LEU A 9 18.426 -12.473 -13.824 1.00 11.23 C ATOM 124 CD1 LEU A 9 18.274 -13.097 -15.202 1.00 42.22 C ATOM 125 CD2 LEU A 9 19.387 -11.294 -13.873 1.00 24.23 C ATOM 0 H LEU A 9 18.589 -11.281 -11.351 1.00 64.20 H new ATOM 0 HA LEU A 9 15.772 -12.086 -11.564 1.00 62.13 H new ATOM 0 HB2 LEU A 9 16.288 -12.532 -13.859 1.00 53.42 H new ATOM 0 HB3 LEU A 9 16.956 -10.963 -13.457 1.00 53.42 H new ATOM 0 HG LEU A 9 18.839 -13.225 -13.151 1.00 11.23 H new ATOM 0 HD11 LEU A 9 19.252 -13.404 -15.572 1.00 42.22 H new ATOM 0 HD12 LEU A 9 17.621 -13.967 -15.137 1.00 42.22 H new ATOM 0 HD13 LEU A 9 17.840 -12.368 -15.886 1.00 42.22 H new ATOM 0 HD21 LEU A 9 20.350 -11.625 -14.262 1.00 24.23 H new ATOM 0 HD22 LEU A 9 18.980 -10.520 -14.523 1.00 24.23 H new ATOM 0 HD23 LEU A 9 19.520 -10.891 -12.869 1.00 24.23 H new ATOM 137 N VAL A 10 17.564 -14.044 -10.280 1.00 42.41 N ATOM 138 CA VAL A 10 17.856 -15.408 -9.858 1.00 61.43 C ATOM 139 C VAL A 10 16.629 -16.066 -9.237 1.00 51.11 C ATOM 140 O VAL A 10 16.325 -17.226 -9.517 1.00 15.31 O ATOM 141 CB VAL A 10 19.014 -15.447 -8.844 1.00 3.22 C ATOM 142 CG1 VAL A 10 19.294 -16.876 -8.406 1.00 33.41 C ATOM 143 CG2 VAL A 10 20.262 -14.808 -9.436 1.00 32.34 C ATOM 0 H VAL A 10 17.764 -13.333 -9.576 1.00 42.41 H new ATOM 0 HA VAL A 10 18.147 -15.960 -10.752 1.00 61.43 H new ATOM 0 HB VAL A 10 18.722 -14.874 -7.964 1.00 3.22 H new ATOM 0 HG11 VAL A 10 20.115 -16.883 -7.690 1.00 33.41 H new ATOM 0 HG12 VAL A 10 18.402 -17.295 -7.940 1.00 33.41 H new ATOM 0 HG13 VAL A 10 19.565 -17.476 -9.274 1.00 33.41 H new ATOM 0 HG21 VAL A 10 21.071 -14.844 -8.706 1.00 32.34 H new ATOM 0 HG22 VAL A 10 20.559 -15.352 -10.333 1.00 32.34 H new ATOM 0 HG23 VAL A 10 20.052 -13.770 -9.694 1.00 32.34 H new ATOM 153 N TYR A 11 15.927 -15.318 -8.393 1.00 42.43 N ATOM 154 CA TYR A 11 14.733 -15.828 -7.730 1.00 62.23 C ATOM 155 C TYR A 11 13.544 -15.843 -8.686 1.00 32.43 C ATOM 156 O TYR A 11 12.548 -16.528 -8.446 1.00 64.32 O ATOM 157 CB TYR A 11 14.404 -14.979 -6.502 1.00 12.34 C ATOM 158 CG TYR A 11 12.976 -14.482 -6.474 1.00 31.32 C ATOM 159 CD1 TYR A 11 11.963 -15.250 -5.913 1.00 23.24 C ATOM 160 CD2 TYR A 11 12.640 -13.244 -7.008 1.00 73.41 C ATOM 161 CE1 TYR A 11 10.657 -14.801 -5.886 1.00 3.22 C ATOM 162 CE2 TYR A 11 11.337 -12.786 -6.984 1.00 74.23 C ATOM 163 CZ TYR A 11 10.349 -13.568 -6.423 1.00 20.24 C ATOM 164 OH TYR A 11 9.049 -13.116 -6.397 1.00 25.44 O ATOM 0 H TYR A 11 16.165 -14.356 -8.152 1.00 42.43 H new ATOM 0 HA TYR A 11 14.934 -16.851 -7.412 1.00 62.23 H new ATOM 0 HB2 TYR A 11 14.593 -15.566 -5.603 1.00 12.34 H new ATOM 0 HB3 TYR A 11 15.078 -14.123 -6.471 1.00 12.34 H new ATOM 0 HD1 TYR A 11 12.201 -16.215 -5.491 1.00 23.24 H new ATOM 0 HD2 TYR A 11 13.411 -12.629 -7.449 1.00 73.41 H new ATOM 0 HE1 TYR A 11 9.882 -15.411 -5.447 1.00 3.22 H new ATOM 0 HE2 TYR A 11 11.093 -11.821 -7.402 1.00 74.23 H new ATOM 0 HH TYR A 11 9.002 -12.230 -6.814 1.00 25.44 H new ATOM 174 N LEU A 12 13.655 -15.084 -9.770 1.00 12.32 N ATOM 175 CA LEU A 12 12.590 -15.009 -10.764 1.00 13.12 C ATOM 176 C LEU A 12 12.527 -16.288 -11.592 1.00 62.03 C ATOM 177 O LEU A 12 11.517 -16.576 -12.232 1.00 53.01 O ATOM 178 CB LEU A 12 12.805 -13.804 -11.681 1.00 0.30 C ATOM 179 CG LEU A 12 11.960 -12.567 -11.374 1.00 1.14 C ATOM 180 CD1 LEU A 12 10.478 -12.906 -11.428 1.00 45.53 C ATOM 181 CD2 LEU A 12 12.328 -11.994 -10.013 1.00 23.24 C ATOM 0 H LEU A 12 14.472 -14.512 -9.983 1.00 12.32 H new ATOM 0 HA LEU A 12 11.643 -14.892 -10.237 1.00 13.12 H new ATOM 0 HB2 LEU A 12 13.857 -13.521 -11.635 1.00 0.30 H new ATOM 0 HB3 LEU A 12 12.602 -14.113 -12.707 1.00 0.30 H new ATOM 0 HG LEU A 12 12.167 -11.812 -12.132 1.00 1.14 H new ATOM 0 HD11 LEU A 12 9.892 -12.014 -11.207 1.00 45.53 H new ATOM 0 HD12 LEU A 12 10.224 -13.269 -12.424 1.00 45.53 H new ATOM 0 HD13 LEU A 12 10.254 -13.678 -10.692 1.00 45.53 H new ATOM 0 HD21 LEU A 12 11.717 -11.114 -9.811 1.00 23.24 H new ATOM 0 HD22 LEU A 12 12.150 -12.744 -9.242 1.00 23.24 H new ATOM 0 HD23 LEU A 12 13.381 -11.713 -10.009 1.00 23.24 H new ATOM 193 N ASN A 13 13.614 -17.053 -11.574 1.00 1.24 N ATOM 194 CA ASN A 13 13.682 -18.303 -12.322 1.00 2.31 C ATOM 195 C ASN A 13 13.431 -19.498 -11.408 1.00 61.30 C ATOM 196 O ASN A 13 12.653 -20.394 -11.738 1.00 44.45 O ATOM 197 CB ASN A 13 15.047 -18.442 -12.999 1.00 70.13 C ATOM 198 CG ASN A 13 15.247 -17.430 -14.111 1.00 10.24 C ATOM 199 OD1 ASN A 13 16.187 -16.636 -14.080 1.00 45.04 O ATOM 200 ND2 ASN A 13 14.360 -17.453 -15.099 1.00 22.42 N ATOM 0 H ASN A 13 14.460 -16.829 -11.050 1.00 1.24 H new ATOM 0 HA ASN A 13 12.905 -18.283 -13.086 1.00 2.31 H new ATOM 0 HB2 ASN A 13 15.833 -18.319 -12.254 1.00 70.13 H new ATOM 0 HB3 ASN A 13 15.147 -19.449 -13.405 1.00 70.13 H new ATOM 0 HD21 ASN A 13 14.442 -16.795 -15.874 1.00 22.42 H new ATOM 0 HD22 ASN A 13 13.596 -18.129 -15.083 1.00 22.42 H new ATOM 207 N VAL A 14 14.095 -19.505 -10.256 1.00 74.52 N ATOM 208 CA VAL A 14 13.943 -20.589 -9.293 1.00 74.51 C ATOM 209 C VAL A 14 12.473 -20.843 -8.978 1.00 54.41 C ATOM 210 O VAL A 14 12.079 -21.966 -8.666 1.00 10.14 O ATOM 211 CB VAL A 14 14.692 -20.285 -7.982 1.00 41.14 C ATOM 212 CG1 VAL A 14 16.131 -19.884 -8.271 1.00 13.34 C ATOM 213 CG2 VAL A 14 13.973 -19.197 -7.199 1.00 24.35 C ATOM 0 H VAL A 14 14.743 -18.772 -9.967 1.00 74.52 H new ATOM 0 HA VAL A 14 14.373 -21.480 -9.750 1.00 74.51 H new ATOM 0 HB VAL A 14 14.707 -21.189 -7.373 1.00 41.14 H new ATOM 0 HG11 VAL A 14 16.645 -19.673 -7.333 1.00 13.34 H new ATOM 0 HG12 VAL A 14 16.639 -20.698 -8.788 1.00 13.34 H new ATOM 0 HG13 VAL A 14 16.141 -18.993 -8.899 1.00 13.34 H new ATOM 0 HG21 VAL A 14 14.515 -18.994 -6.276 1.00 24.35 H new ATOM 0 HG22 VAL A 14 13.925 -18.288 -7.799 1.00 24.35 H new ATOM 0 HG23 VAL A 14 12.962 -19.528 -6.961 1.00 24.35 H new ATOM 223 N MET A 15 11.665 -19.790 -9.063 1.00 63.40 N ATOM 224 CA MET A 15 10.237 -19.899 -8.789 1.00 21.34 C ATOM 225 C MET A 15 9.579 -20.909 -9.724 1.00 2.12 C ATOM 226 O MET A 15 9.063 -21.934 -9.280 1.00 40.10 O ATOM 227 CB MET A 15 9.562 -18.534 -8.936 1.00 61.34 C ATOM 228 CG MET A 15 8.334 -18.365 -8.057 1.00 31.41 C ATOM 229 SD MET A 15 7.101 -17.271 -8.788 1.00 5.22 S ATOM 230 CE MET A 15 8.113 -15.854 -9.207 1.00 3.42 C ATOM 0 H MET A 15 11.975 -18.853 -9.319 1.00 63.40 H new ATOM 0 HA MET A 15 10.115 -20.248 -7.764 1.00 21.34 H new ATOM 0 HB2 MET A 15 10.283 -17.753 -8.693 1.00 61.34 H new ATOM 0 HB3 MET A 15 9.276 -18.390 -9.978 1.00 61.34 H new ATOM 0 HG2 MET A 15 7.885 -19.342 -7.875 1.00 31.41 H new ATOM 0 HG3 MET A 15 8.637 -17.968 -7.088 1.00 31.41 H new ATOM 0 HE1 MET A 15 7.471 -15.003 -9.435 1.00 3.42 H new ATOM 0 HE2 MET A 15 8.759 -15.606 -8.364 1.00 3.42 H new ATOM 0 HE3 MET A 15 8.726 -16.089 -10.077 1.00 3.42 H new ATOM 240 N GLU A 16 9.602 -20.611 -11.019 1.00 73.12 N ATOM 241 CA GLU A 16 9.006 -21.493 -12.016 1.00 31.54 C ATOM 242 C GLU A 16 9.523 -22.920 -11.857 1.00 70.44 C ATOM 243 O GLU A 16 8.822 -23.885 -12.168 1.00 4.12 O ATOM 244 CB GLU A 16 9.307 -20.983 -13.426 1.00 63.53 C ATOM 245 CG GLU A 16 8.880 -19.544 -13.657 1.00 44.42 C ATOM 246 CD GLU A 16 8.729 -19.209 -15.128 1.00 53.14 C ATOM 247 OE1 GLU A 16 8.377 -20.116 -15.911 1.00 33.23 O ATOM 248 OE2 GLU A 16 8.962 -18.039 -15.497 1.00 10.40 O ATOM 0 H GLU A 16 10.026 -19.766 -11.402 1.00 73.12 H new ATOM 0 HA GLU A 16 7.927 -21.497 -11.863 1.00 31.54 H new ATOM 0 HB2 GLU A 16 10.377 -21.070 -13.614 1.00 63.53 H new ATOM 0 HB3 GLU A 16 8.803 -21.623 -14.150 1.00 63.53 H new ATOM 0 HG2 GLU A 16 7.933 -19.364 -13.148 1.00 44.42 H new ATOM 0 HG3 GLU A 16 9.615 -18.875 -13.209 1.00 44.42 H new ATOM 255 N LEU A 17 10.754 -23.047 -11.373 1.00 75.03 N ATOM 256 CA LEU A 17 11.366 -24.356 -11.174 1.00 4.21 C ATOM 257 C LEU A 17 10.713 -25.091 -10.008 1.00 74.35 C ATOM 258 O LEU A 17 10.247 -26.221 -10.157 1.00 33.24 O ATOM 259 CB LEU A 17 12.867 -24.205 -10.919 1.00 1.51 C ATOM 260 CG LEU A 17 13.584 -25.443 -10.380 1.00 4.43 C ATOM 261 CD1 LEU A 17 13.605 -26.546 -11.426 1.00 41.34 C ATOM 262 CD2 LEU A 17 14.999 -25.092 -9.944 1.00 5.41 C ATOM 0 H LEU A 17 11.347 -22.260 -11.111 1.00 75.03 H new ATOM 0 HA LEU A 17 11.214 -24.942 -12.080 1.00 4.21 H new ATOM 0 HB2 LEU A 17 13.346 -23.910 -11.853 1.00 1.51 H new ATOM 0 HB3 LEU A 17 13.015 -23.388 -10.213 1.00 1.51 H new ATOM 0 HG LEU A 17 13.036 -25.806 -9.510 1.00 4.43 H new ATOM 0 HD11 LEU A 17 14.119 -27.419 -11.024 1.00 41.34 H new ATOM 0 HD12 LEU A 17 12.583 -26.817 -11.690 1.00 41.34 H new ATOM 0 HD13 LEU A 17 14.128 -26.194 -12.315 1.00 41.34 H new ATOM 0 HD21 LEU A 17 15.494 -25.985 -9.563 1.00 5.41 H new ATOM 0 HD22 LEU A 17 15.556 -24.703 -10.796 1.00 5.41 H new ATOM 0 HD23 LEU A 17 14.961 -24.336 -9.160 1.00 5.41 H new ATOM 274 N VAL A 18 10.680 -24.442 -8.849 1.00 54.21 N ATOM 275 CA VAL A 18 10.080 -25.032 -7.659 1.00 33.43 C ATOM 276 C VAL A 18 8.604 -25.342 -7.883 1.00 71.20 C ATOM 277 O VAL A 18 8.026 -26.189 -7.201 1.00 43.11 O ATOM 278 CB VAL A 18 10.218 -24.101 -6.440 1.00 20.34 C ATOM 279 CG1 VAL A 18 9.553 -24.718 -5.218 1.00 40.14 C ATOM 280 CG2 VAL A 18 11.683 -23.800 -6.164 1.00 3.43 C ATOM 0 H VAL A 18 11.062 -23.507 -8.709 1.00 54.21 H new ATOM 0 HA VAL A 18 10.617 -25.960 -7.461 1.00 33.43 H new ATOM 0 HB VAL A 18 9.713 -23.161 -6.663 1.00 20.34 H new ATOM 0 HG11 VAL A 18 9.661 -24.046 -4.367 1.00 40.14 H new ATOM 0 HG12 VAL A 18 8.494 -24.878 -5.422 1.00 40.14 H new ATOM 0 HG13 VAL A 18 10.027 -25.672 -4.989 1.00 40.14 H new ATOM 0 HG21 VAL A 18 11.762 -23.141 -5.300 1.00 3.43 H new ATOM 0 HG22 VAL A 18 12.214 -24.730 -5.961 1.00 3.43 H new ATOM 0 HG23 VAL A 18 12.124 -23.313 -7.033 1.00 3.43 H new ATOM 290 N ARG A 19 7.999 -24.651 -8.844 1.00 3.04 N ATOM 291 CA ARG A 19 6.590 -24.852 -9.158 1.00 12.32 C ATOM 292 C ARG A 19 6.399 -26.082 -10.040 1.00 43.01 C ATOM 293 O ARG A 19 5.602 -26.965 -9.727 1.00 21.44 O ATOM 294 CB ARG A 19 6.020 -23.616 -9.857 1.00 64.14 C ATOM 295 CG ARG A 19 5.782 -22.442 -8.922 1.00 23.11 C ATOM 296 CD ARG A 19 4.492 -22.610 -8.135 1.00 2.15 C ATOM 297 NE ARG A 19 3.338 -22.083 -8.857 1.00 14.42 N ATOM 298 CZ ARG A 19 3.023 -20.793 -8.899 1.00 4.43 C ATOM 299 NH1 ARG A 19 3.774 -19.903 -8.264 1.00 32.15 N ATOM 300 NH2 ARG A 19 1.957 -20.390 -9.578 1.00 33.04 N ATOM 0 H ARG A 19 8.463 -23.947 -9.418 1.00 3.04 H new ATOM 0 HA ARG A 19 6.054 -25.011 -8.222 1.00 12.32 H new ATOM 0 HB2 ARG A 19 6.705 -23.307 -10.647 1.00 64.14 H new ATOM 0 HB3 ARG A 19 5.079 -23.883 -10.338 1.00 64.14 H new ATOM 0 HG2 ARG A 19 6.621 -22.349 -8.232 1.00 23.11 H new ATOM 0 HG3 ARG A 19 5.740 -21.518 -9.499 1.00 23.11 H new ATOM 0 HD2 ARG A 19 4.333 -23.667 -7.920 1.00 2.15 H new ATOM 0 HD3 ARG A 19 4.583 -22.100 -7.176 1.00 2.15 H new ATOM 0 HE ARG A 19 2.741 -22.741 -9.357 1.00 14.42 H new ATOM 0 HH11 ARG A 19 4.595 -20.208 -7.742 1.00 32.15 H new ATOM 0 HH12 ARG A 19 3.530 -18.913 -8.298 1.00 32.15 H new ATOM 0 HH21 ARG A 19 1.378 -21.071 -10.069 1.00 33.04 H new ATOM 0 HH22 ARG A 19 1.717 -19.399 -9.609 1.00 33.04 H new ATOM 314 N ALA A 20 7.137 -26.131 -11.145 1.00 34.52 N ATOM 315 CA ALA A 20 7.050 -27.253 -12.071 1.00 60.34 C ATOM 316 C ALA A 20 7.265 -28.579 -11.350 1.00 32.34 C ATOM 317 O ALA A 20 6.632 -29.584 -11.674 1.00 73.11 O ATOM 318 CB ALA A 20 8.065 -27.091 -13.193 1.00 53.44 C ATOM 0 H ALA A 20 7.801 -25.407 -11.420 1.00 34.52 H new ATOM 0 HA ALA A 20 6.048 -27.261 -12.499 1.00 60.34 H new ATOM 0 HB1 ALA A 20 7.989 -27.936 -13.877 1.00 53.44 H new ATOM 0 HB2 ALA A 20 7.864 -26.167 -13.734 1.00 53.44 H new ATOM 0 HB3 ALA A 20 9.070 -27.054 -12.772 1.00 53.44 H new ATOM 324 N VAL A 21 8.162 -28.576 -10.369 1.00 44.41 N ATOM 325 CA VAL A 21 8.460 -29.778 -9.601 1.00 25.41 C ATOM 326 C VAL A 21 7.370 -30.058 -8.572 1.00 43.34 C ATOM 327 O VAL A 21 7.205 -31.191 -8.119 1.00 2.14 O ATOM 328 CB VAL A 21 9.815 -29.661 -8.878 1.00 23.13 C ATOM 329 CG1 VAL A 21 9.744 -28.615 -7.775 1.00 73.35 C ATOM 330 CG2 VAL A 21 10.238 -31.011 -8.317 1.00 10.51 C ATOM 0 H VAL A 21 8.695 -27.753 -10.088 1.00 44.41 H new ATOM 0 HA VAL A 21 8.506 -30.603 -10.311 1.00 25.41 H new ATOM 0 HB VAL A 21 10.566 -29.342 -9.601 1.00 23.13 H new ATOM 0 HG11 VAL A 21 10.710 -28.547 -7.276 1.00 73.35 H new ATOM 0 HG12 VAL A 21 9.490 -27.647 -8.207 1.00 73.35 H new ATOM 0 HG13 VAL A 21 8.981 -28.901 -7.051 1.00 73.35 H new ATOM 0 HG21 VAL A 21 11.197 -30.910 -7.810 1.00 10.51 H new ATOM 0 HG22 VAL A 21 9.488 -31.362 -7.608 1.00 10.51 H new ATOM 0 HG23 VAL A 21 10.332 -31.730 -9.131 1.00 10.51 H new ATOM 340 N LEU A 22 6.628 -29.018 -8.208 1.00 72.15 N ATOM 341 CA LEU A 22 5.551 -29.151 -7.233 1.00 3.11 C ATOM 342 C LEU A 22 4.358 -29.886 -7.835 1.00 50.54 C ATOM 343 O LEU A 22 3.618 -30.570 -7.130 1.00 23.24 O ATOM 344 CB LEU A 22 5.116 -27.772 -6.733 1.00 65.11 C ATOM 345 CG LEU A 22 4.633 -27.705 -5.284 1.00 22.21 C ATOM 346 CD1 LEU A 22 4.472 -26.259 -4.841 1.00 71.23 C ATOM 347 CD2 LEU A 22 3.324 -28.463 -5.123 1.00 33.51 C ATOM 0 H LEU A 22 6.752 -28.074 -8.573 1.00 72.15 H new ATOM 0 HA LEU A 22 5.926 -29.734 -6.392 1.00 3.11 H new ATOM 0 HB2 LEU A 22 5.954 -27.085 -6.848 1.00 65.11 H new ATOM 0 HB3 LEU A 22 4.316 -27.409 -7.379 1.00 65.11 H new ATOM 0 HG LEU A 22 5.383 -28.176 -4.649 1.00 22.21 H new ATOM 0 HD11 LEU A 22 4.128 -26.231 -3.807 1.00 71.23 H new ATOM 0 HD12 LEU A 22 5.431 -25.746 -4.918 1.00 71.23 H new ATOM 0 HD13 LEU A 22 3.742 -25.762 -5.480 1.00 71.23 H new ATOM 0 HD21 LEU A 22 2.995 -28.405 -4.085 1.00 33.51 H new ATOM 0 HD22 LEU A 22 2.566 -28.021 -5.769 1.00 33.51 H new ATOM 0 HD23 LEU A 22 3.472 -29.507 -5.399 1.00 33.51 H new ATOM 359 N GLU A 23 4.179 -29.739 -9.145 1.00 31.44 N ATOM 360 CA GLU A 23 3.076 -30.391 -9.841 1.00 40.34 C ATOM 361 C GLU A 23 3.271 -31.904 -9.875 1.00 45.31 C ATOM 362 O GLU A 23 2.380 -32.665 -9.498 1.00 74.00 O ATOM 363 CB GLU A 23 2.954 -29.849 -11.267 1.00 72.34 C ATOM 364 CG GLU A 23 3.085 -28.338 -11.358 1.00 60.31 C ATOM 365 CD GLU A 23 1.967 -27.703 -12.162 1.00 43.10 C ATOM 366 OE1 GLU A 23 0.789 -28.019 -11.894 1.00 64.15 O ATOM 367 OE2 GLU A 23 2.271 -26.889 -13.059 1.00 44.30 O ATOM 0 H GLU A 23 4.782 -29.175 -9.744 1.00 31.44 H new ATOM 0 HA GLU A 23 2.157 -30.174 -9.296 1.00 40.34 H new ATOM 0 HB2 GLU A 23 3.722 -30.310 -11.889 1.00 72.34 H new ATOM 0 HB3 GLU A 23 1.990 -30.147 -11.678 1.00 72.34 H new ATOM 0 HG2 GLU A 23 3.090 -27.916 -10.353 1.00 60.31 H new ATOM 0 HG3 GLU A 23 4.043 -28.087 -11.813 1.00 60.31 H new ATOM 374 N LEU A 24 4.444 -32.333 -10.330 1.00 14.33 N ATOM 375 CA LEU A 24 4.758 -33.755 -10.414 1.00 14.12 C ATOM 376 C LEU A 24 4.656 -34.417 -9.043 1.00 74.05 C ATOM 377 O LEU A 24 4.479 -35.631 -8.940 1.00 35.01 O ATOM 378 CB LEU A 24 6.162 -33.954 -10.986 1.00 22.31 C ATOM 379 CG LEU A 24 7.313 -33.873 -9.983 1.00 3.23 C ATOM 380 CD1 LEU A 24 7.615 -35.246 -9.404 1.00 22.40 C ATOM 381 CD2 LEU A 24 8.553 -33.285 -10.640 1.00 43.23 C ATOM 0 H LEU A 24 5.193 -31.716 -10.646 1.00 14.33 H new ATOM 0 HA LEU A 24 4.032 -34.224 -11.078 1.00 14.12 H new ATOM 0 HB2 LEU A 24 6.199 -34.928 -11.473 1.00 22.31 H new ATOM 0 HB3 LEU A 24 6.327 -33.204 -11.760 1.00 22.31 H new ATOM 0 HG LEU A 24 7.012 -33.216 -9.167 1.00 3.23 H new ATOM 0 HD11 LEU A 24 8.437 -35.168 -8.692 1.00 22.40 H new ATOM 0 HD12 LEU A 24 6.730 -35.629 -8.896 1.00 22.40 H new ATOM 0 HD13 LEU A 24 7.895 -35.927 -10.208 1.00 22.40 H new ATOM 0 HD21 LEU A 24 9.362 -33.235 -9.911 1.00 43.23 H new ATOM 0 HD22 LEU A 24 8.856 -33.916 -11.476 1.00 43.23 H new ATOM 0 HD23 LEU A 24 8.331 -32.282 -11.005 1.00 43.23 H new ATOM 393 N LYS A 25 4.766 -33.611 -7.993 1.00 24.00 N ATOM 394 CA LYS A 25 4.683 -34.117 -6.628 1.00 3.41 C ATOM 395 C LYS A 25 3.253 -34.521 -6.284 1.00 4.14 C ATOM 396 O LYS A 25 2.955 -35.703 -6.123 1.00 34.41 O ATOM 397 CB LYS A 25 5.177 -33.058 -5.639 1.00 65.22 C ATOM 398 CG LYS A 25 6.650 -33.190 -5.293 1.00 25.01 C ATOM 399 CD LYS A 25 7.128 -32.028 -4.438 1.00 65.13 C ATOM 400 CE LYS A 25 6.811 -32.251 -2.967 1.00 44.44 C ATOM 401 NZ LYS A 25 6.593 -30.966 -2.247 1.00 3.14 N ATOM 0 H LYS A 25 4.913 -32.604 -8.061 1.00 24.00 H new ATOM 0 HA LYS A 25 5.319 -34.999 -6.554 1.00 3.41 H new ATOM 0 HB2 LYS A 25 4.998 -32.068 -6.060 1.00 65.22 H new ATOM 0 HB3 LYS A 25 4.590 -33.126 -4.723 1.00 65.22 H new ATOM 0 HG2 LYS A 25 6.817 -34.127 -4.762 1.00 25.01 H new ATOM 0 HG3 LYS A 25 7.238 -33.234 -6.210 1.00 25.01 H new ATOM 0 HD2 LYS A 25 8.203 -31.900 -4.564 1.00 65.13 H new ATOM 0 HD3 LYS A 25 6.655 -31.106 -4.778 1.00 65.13 H new ATOM 0 HE2 LYS A 25 5.921 -32.873 -2.877 1.00 44.44 H new ATOM 0 HE3 LYS A 25 7.630 -32.796 -2.497 1.00 44.44 H new ATOM 0 HZ1 LYS A 25 6.649 -31.129 -1.221 1.00 3.14 H new ATOM 0 HZ2 LYS A 25 7.323 -30.281 -2.530 1.00 3.14 H new ATOM 0 HZ3 LYS A 25 5.654 -30.589 -2.486 1.00 3.14 H new ATOM 415 N ASN A 26 2.374 -33.531 -6.173 1.00 54.12 N ATOM 416 CA ASN A 26 0.974 -33.784 -5.849 1.00 24.41 C ATOM 417 C ASN A 26 0.327 -34.682 -6.899 1.00 13.02 C ATOM 418 O ASN A 26 -0.635 -35.394 -6.612 1.00 61.20 O ATOM 419 CB ASN A 26 0.206 -32.465 -5.745 1.00 62.24 C ATOM 420 CG ASN A 26 0.989 -31.397 -5.007 1.00 41.42 C ATOM 421 OD1 ASN A 26 1.053 -30.247 -5.442 1.00 43.40 O ATOM 422 ND2 ASN A 26 1.590 -31.773 -3.884 1.00 54.11 N ATOM 0 H ASN A 26 2.606 -32.546 -6.302 1.00 54.12 H new ATOM 0 HA ASN A 26 0.936 -34.295 -4.887 1.00 24.41 H new ATOM 0 HB2 ASN A 26 -0.035 -32.108 -6.746 1.00 62.24 H new ATOM 0 HB3 ASN A 26 -0.740 -32.638 -5.232 1.00 62.24 H new ATOM 0 HD21 ASN A 26 2.132 -31.098 -3.345 1.00 54.11 H new ATOM 0 HD22 ASN A 26 1.510 -32.737 -3.561 1.00 54.11 H new ATOM 429 N GLU A 27 0.862 -34.642 -8.115 1.00 55.12 N ATOM 430 CA GLU A 27 0.335 -35.452 -9.207 1.00 51.25 C ATOM 431 C GLU A 27 1.108 -36.761 -9.336 1.00 31.34 C ATOM 432 O GLU A 27 1.089 -37.407 -10.385 1.00 10.44 O ATOM 433 CB GLU A 27 0.402 -34.676 -10.525 1.00 33.41 C ATOM 434 CG GLU A 27 -0.473 -33.434 -10.545 1.00 5.22 C ATOM 435 CD GLU A 27 -0.812 -32.982 -11.952 1.00 33.11 C ATOM 436 OE1 GLU A 27 -1.795 -33.501 -12.522 1.00 25.55 O ATOM 437 OE2 GLU A 27 -0.095 -32.108 -12.483 1.00 72.31 O ATOM 0 H GLU A 27 1.659 -34.058 -8.369 1.00 55.12 H new ATOM 0 HA GLU A 27 -0.706 -35.685 -8.983 1.00 51.25 H new ATOM 0 HB2 GLU A 27 1.435 -34.385 -10.714 1.00 33.41 H new ATOM 0 HB3 GLU A 27 0.102 -35.335 -11.340 1.00 33.41 H new ATOM 0 HG2 GLU A 27 -1.395 -33.635 -10.000 1.00 5.22 H new ATOM 0 HG3 GLU A 27 0.037 -32.626 -10.021 1.00 5.22 H new ATOM 444 N LEU A 28 1.788 -37.147 -8.262 1.00 34.54 N ATOM 445 CA LEU A 28 2.568 -38.380 -8.252 1.00 43.25 C ATOM 446 C LEU A 28 1.661 -39.598 -8.116 1.00 20.23 C ATOM 447 O LEU A 28 2.016 -40.699 -8.536 1.00 21.41 O ATOM 448 CB LEU A 28 3.584 -38.355 -7.109 1.00 11.12 C ATOM 449 CG LEU A 28 4.518 -39.561 -7.015 1.00 25.53 C ATOM 450 CD1 LEU A 28 3.834 -40.712 -6.292 1.00 43.42 C ATOM 451 CD2 LEU A 28 4.972 -39.994 -8.401 1.00 74.54 C ATOM 0 H LEU A 28 1.815 -36.624 -7.387 1.00 34.54 H new ATOM 0 HA LEU A 28 3.100 -38.452 -9.201 1.00 43.25 H new ATOM 0 HB2 LEU A 28 4.193 -37.456 -7.210 1.00 11.12 H new ATOM 0 HB3 LEU A 28 3.040 -38.268 -6.168 1.00 11.12 H new ATOM 0 HG LEU A 28 5.398 -39.270 -6.441 1.00 25.53 H new ATOM 0 HD11 LEU A 28 4.515 -41.562 -6.235 1.00 43.42 H new ATOM 0 HD12 LEU A 28 3.561 -40.398 -5.285 1.00 43.42 H new ATOM 0 HD13 LEU A 28 2.936 -41.002 -6.838 1.00 43.42 H new ATOM 0 HD21 LEU A 28 5.636 -40.854 -8.314 1.00 74.54 H new ATOM 0 HD22 LEU A 28 4.103 -40.266 -9.000 1.00 74.54 H new ATOM 0 HD23 LEU A 28 5.503 -39.173 -8.883 1.00 74.54 H new ATOM 463 N SER A 29 0.487 -39.392 -7.527 1.00 22.50 N ATOM 464 CA SER A 29 -0.471 -40.475 -7.333 1.00 40.54 C ATOM 465 C SER A 29 -1.665 -40.317 -8.270 1.00 11.31 C ATOM 466 O SER A 29 -2.813 -40.489 -7.862 1.00 73.01 O ATOM 467 CB SER A 29 -0.949 -40.507 -5.880 1.00 62.24 C ATOM 468 OG SER A 29 -1.864 -41.568 -5.668 1.00 53.24 O ATOM 0 H SER A 29 0.176 -38.486 -7.176 1.00 22.50 H new ATOM 0 HA SER A 29 0.029 -41.416 -7.564 1.00 40.54 H new ATOM 0 HB2 SER A 29 -0.093 -40.622 -5.215 1.00 62.24 H new ATOM 0 HB3 SER A 29 -1.423 -39.558 -5.629 1.00 62.24 H new ATOM 0 HG SER A 29 -2.592 -41.508 -6.322 1.00 53.24 H new ATOM 474 N GLN A 30 -1.384 -39.988 -9.527 1.00 10.24 N ATOM 475 CA GLN A 30 -2.435 -39.806 -10.521 1.00 44.13 C ATOM 476 C GLN A 30 -2.076 -40.509 -11.826 1.00 52.24 C ATOM 477 O GLN A 30 -2.927 -41.135 -12.461 1.00 3.43 O ATOM 478 CB GLN A 30 -2.670 -38.316 -10.778 1.00 72.54 C ATOM 479 CG GLN A 30 -2.705 -37.478 -9.511 1.00 34.33 C ATOM 480 CD GLN A 30 -3.864 -37.842 -8.603 1.00 1.41 C ATOM 481 OE1 GLN A 30 -4.986 -38.052 -9.064 1.00 32.24 O ATOM 482 NE2 GLN A 30 -3.598 -37.917 -7.304 1.00 65.32 N ATOM 0 H GLN A 30 -0.438 -39.842 -9.881 1.00 10.24 H new ATOM 0 HA GLN A 30 -3.351 -40.249 -10.131 1.00 44.13 H new ATOM 0 HB2 GLN A 30 -1.882 -37.940 -11.431 1.00 72.54 H new ATOM 0 HB3 GLN A 30 -3.612 -38.192 -11.312 1.00 72.54 H new ATOM 0 HG2 GLN A 30 -1.769 -37.607 -8.968 1.00 34.33 H new ATOM 0 HG3 GLN A 30 -2.775 -36.424 -9.779 1.00 34.33 H new ATOM 0 HE21 GLN A 30 -2.653 -37.735 -6.966 1.00 65.32 H new ATOM 0 HE22 GLN A 30 -4.339 -38.157 -6.645 1.00 65.32 H new ATOM 491 N LEU A 31 -0.813 -40.402 -12.223 1.00 2.44 N ATOM 492 CA LEU A 31 -0.341 -41.027 -13.453 1.00 72.13 C ATOM 493 C LEU A 31 0.650 -42.146 -13.150 1.00 44.23 C ATOM 494 O LEU A 31 1.241 -42.210 -12.072 1.00 43.31 O ATOM 495 CB LEU A 31 0.312 -39.983 -14.361 1.00 73.43 C ATOM 496 CG LEU A 31 -0.019 -38.523 -14.051 1.00 60.13 C ATOM 497 CD1 LEU A 31 0.827 -37.591 -14.905 1.00 21.30 C ATOM 498 CD2 LEU A 31 -1.500 -38.253 -14.272 1.00 33.35 C ATOM 0 H LEU A 31 -0.097 -39.888 -11.710 1.00 2.44 H new ATOM 0 HA LEU A 31 -1.201 -41.458 -13.966 1.00 72.13 H new ATOM 0 HB2 LEU A 31 1.393 -40.109 -14.307 1.00 73.43 H new ATOM 0 HB3 LEU A 31 0.018 -40.191 -15.390 1.00 73.43 H new ATOM 0 HG LEU A 31 0.212 -38.333 -13.003 1.00 60.13 H new ATOM 0 HD11 LEU A 31 0.578 -36.556 -14.671 1.00 21.30 H new ATOM 0 HD12 LEU A 31 1.883 -37.766 -14.698 1.00 21.30 H new ATOM 0 HD13 LEU A 31 0.628 -37.782 -15.959 1.00 21.30 H new ATOM 0 HD21 LEU A 31 -1.717 -37.209 -14.046 1.00 33.35 H new ATOM 0 HD22 LEU A 31 -1.757 -38.461 -15.311 1.00 33.35 H new ATOM 0 HD23 LEU A 31 -2.089 -38.896 -13.617 1.00 33.35 H new ATOM 510 N PRO A 32 0.840 -43.049 -14.124 1.00 42.50 N ATOM 511 CA PRO A 32 1.762 -44.180 -13.986 1.00 43.30 C ATOM 512 C PRO A 32 3.222 -43.740 -13.975 1.00 42.52 C ATOM 513 O PRO A 32 3.553 -42.594 -14.283 1.00 74.21 O ATOM 514 CB PRO A 32 1.469 -45.029 -15.225 1.00 62.40 C ATOM 515 CG PRO A 32 0.925 -44.068 -16.224 1.00 11.50 C ATOM 516 CD PRO A 32 0.170 -43.034 -15.435 1.00 34.11 C ATOM 0 HA PRO A 32 1.618 -44.711 -13.045 1.00 43.30 H new ATOM 0 HB2 PRO A 32 2.372 -45.515 -15.594 1.00 62.40 H new ATOM 0 HB3 PRO A 32 0.751 -45.818 -15.003 1.00 62.40 H new ATOM 0 HG2 PRO A 32 1.728 -43.609 -16.801 1.00 11.50 H new ATOM 0 HG3 PRO A 32 0.270 -44.572 -16.934 1.00 11.50 H new ATOM 0 HD2 PRO A 32 0.226 -42.051 -15.904 1.00 34.11 H new ATOM 0 HD3 PRO A 32 -0.887 -43.287 -15.349 1.00 34.11 H new ATOM 524 N PRO A 33 4.119 -44.669 -13.613 1.00 33.11 N ATOM 525 CA PRO A 33 5.559 -44.400 -13.554 1.00 55.14 C ATOM 526 C PRO A 33 6.169 -44.209 -14.939 1.00 23.45 C ATOM 527 O PRO A 33 7.331 -43.823 -15.066 1.00 55.10 O ATOM 528 CB PRO A 33 6.127 -45.655 -12.887 1.00 41.30 C ATOM 529 CG PRO A 33 5.140 -46.727 -13.194 1.00 61.43 C ATOM 530 CD PRO A 33 3.796 -46.055 -13.233 1.00 11.30 C ATOM 0 HA PRO A 33 5.781 -43.478 -13.016 1.00 55.14 H new ATOM 0 HB2 PRO A 33 7.113 -45.901 -13.281 1.00 41.30 H new ATOM 0 HB3 PRO A 33 6.239 -45.516 -11.812 1.00 41.30 H new ATOM 0 HG2 PRO A 33 5.366 -47.203 -14.148 1.00 61.43 H new ATOM 0 HG3 PRO A 33 5.164 -47.508 -12.434 1.00 61.43 H new ATOM 0 HD2 PRO A 33 3.132 -46.526 -13.958 1.00 11.30 H new ATOM 0 HD3 PRO A 33 3.296 -46.100 -12.266 1.00 11.30 H new ATOM 538 N GLU A 34 5.379 -44.483 -15.972 1.00 21.01 N ATOM 539 CA GLU A 34 5.844 -44.341 -17.347 1.00 20.53 C ATOM 540 C GLU A 34 5.412 -43.000 -17.932 1.00 32.11 C ATOM 541 O GLU A 34 5.327 -42.840 -19.149 1.00 0.43 O ATOM 542 CB GLU A 34 5.306 -45.484 -18.211 1.00 23.24 C ATOM 543 CG GLU A 34 3.797 -45.642 -18.140 1.00 53.15 C ATOM 544 CD GLU A 34 3.234 -46.406 -19.323 1.00 44.14 C ATOM 545 OE1 GLU A 34 3.241 -45.855 -20.444 1.00 4.01 O ATOM 546 OE2 GLU A 34 2.787 -47.556 -19.128 1.00 4.30 O ATOM 0 H GLU A 34 4.415 -44.804 -15.883 1.00 21.01 H new ATOM 0 HA GLU A 34 6.933 -44.381 -17.341 1.00 20.53 H new ATOM 0 HB2 GLU A 34 5.597 -45.313 -19.247 1.00 23.24 H new ATOM 0 HB3 GLU A 34 5.776 -46.417 -17.898 1.00 23.24 H new ATOM 0 HG2 GLU A 34 3.533 -46.161 -17.218 1.00 53.15 H new ATOM 0 HG3 GLU A 34 3.334 -44.656 -18.095 1.00 53.15 H new ATOM 553 N GLY A 35 5.139 -42.039 -17.055 1.00 13.32 N ATOM 554 CA GLY A 35 4.718 -40.724 -17.502 1.00 52.04 C ATOM 555 C GLY A 35 5.507 -39.608 -16.846 1.00 74.14 C ATOM 556 O GLY A 35 5.816 -38.600 -17.482 1.00 62.34 O ATOM 0 H GLY A 35 5.202 -42.148 -16.043 1.00 13.32 H new ATOM 0 HA2 GLY A 35 4.832 -40.658 -18.584 1.00 52.04 H new ATOM 0 HA3 GLY A 35 3.658 -40.592 -17.284 1.00 52.04 H new ATOM 560 N TYR A 36 5.831 -39.786 -15.571 1.00 23.32 N ATOM 561 CA TYR A 36 6.585 -38.784 -14.827 1.00 23.31 C ATOM 562 C TYR A 36 7.996 -38.635 -15.389 1.00 74.14 C ATOM 563 O TYR A 36 8.697 -37.669 -15.089 1.00 65.24 O ATOM 564 CB TYR A 36 6.652 -39.162 -13.346 1.00 2.50 C ATOM 565 CG TYR A 36 5.295 -39.356 -12.709 1.00 32.02 C ATOM 566 CD1 TYR A 36 4.294 -38.403 -12.855 1.00 4.24 C ATOM 567 CD2 TYR A 36 5.013 -40.492 -11.960 1.00 60.14 C ATOM 568 CE1 TYR A 36 3.053 -38.576 -12.274 1.00 11.23 C ATOM 569 CE2 TYR A 36 3.774 -40.674 -11.377 1.00 61.13 C ATOM 570 CZ TYR A 36 2.797 -39.713 -11.537 1.00 25.25 C ATOM 571 OH TYR A 36 1.562 -39.890 -10.956 1.00 64.20 O ATOM 0 H TYR A 36 5.583 -40.615 -15.030 1.00 23.32 H new ATOM 0 HA TYR A 36 6.070 -37.829 -14.929 1.00 23.31 H new ATOM 0 HB2 TYR A 36 7.229 -40.081 -13.240 1.00 2.50 H new ATOM 0 HB3 TYR A 36 7.190 -38.384 -12.805 1.00 2.50 H new ATOM 0 HD1 TYR A 36 4.490 -37.512 -13.433 1.00 4.24 H new ATOM 0 HD2 TYR A 36 5.776 -41.246 -11.831 1.00 60.14 H new ATOM 0 HE1 TYR A 36 2.287 -37.825 -12.396 1.00 11.23 H new ATOM 0 HE2 TYR A 36 3.571 -41.564 -10.799 1.00 61.13 H new ATOM 0 HH TYR A 36 1.225 -39.028 -10.634 1.00 64.20 H new ATOM 581 N VAL A 37 8.404 -39.599 -16.208 1.00 61.33 N ATOM 582 CA VAL A 37 9.729 -39.576 -16.815 1.00 64.15 C ATOM 583 C VAL A 37 9.852 -38.439 -17.823 1.00 44.22 C ATOM 584 O VAL A 37 10.950 -38.108 -18.271 1.00 42.14 O ATOM 585 CB VAL A 37 10.047 -40.908 -17.520 1.00 63.31 C ATOM 586 CG1 VAL A 37 9.148 -41.099 -18.732 1.00 64.31 C ATOM 587 CG2 VAL A 37 11.514 -40.962 -17.920 1.00 61.21 C ATOM 0 H VAL A 37 7.836 -40.406 -16.466 1.00 61.33 H new ATOM 0 HA VAL A 37 10.444 -39.421 -16.007 1.00 64.15 H new ATOM 0 HB VAL A 37 9.854 -41.723 -16.823 1.00 63.31 H new ATOM 0 HG11 VAL A 37 9.387 -42.045 -19.217 1.00 64.31 H new ATOM 0 HG12 VAL A 37 8.105 -41.108 -18.414 1.00 64.31 H new ATOM 0 HG13 VAL A 37 9.306 -40.281 -19.435 1.00 64.31 H new ATOM 0 HG21 VAL A 37 11.721 -41.910 -18.417 1.00 61.21 H new ATOM 0 HG22 VAL A 37 11.736 -40.140 -18.600 1.00 61.21 H new ATOM 0 HG23 VAL A 37 12.137 -40.875 -17.030 1.00 61.21 H new ATOM 597 N VAL A 38 8.718 -37.843 -18.176 1.00 12.41 N ATOM 598 CA VAL A 38 8.698 -36.740 -19.130 1.00 31.30 C ATOM 599 C VAL A 38 8.757 -35.395 -18.416 1.00 45.52 C ATOM 600 O VAL A 38 9.344 -34.437 -18.921 1.00 71.02 O ATOM 601 CB VAL A 38 7.437 -36.785 -20.013 1.00 71.22 C ATOM 602 CG1 VAL A 38 7.479 -35.683 -21.061 1.00 61.40 C ATOM 603 CG2 VAL A 38 7.294 -38.150 -20.669 1.00 24.53 C ATOM 0 H VAL A 38 7.801 -38.105 -17.816 1.00 12.41 H new ATOM 0 HA VAL A 38 9.579 -36.852 -19.762 1.00 31.30 H new ATOM 0 HB VAL A 38 6.566 -36.619 -19.380 1.00 71.22 H new ATOM 0 HG11 VAL A 38 6.580 -35.731 -21.675 1.00 61.40 H new ATOM 0 HG12 VAL A 38 7.530 -34.713 -20.567 1.00 61.40 H new ATOM 0 HG13 VAL A 38 8.357 -35.815 -21.693 1.00 61.40 H new ATOM 0 HG21 VAL A 38 6.398 -38.164 -21.289 1.00 24.53 H new ATOM 0 HG22 VAL A 38 8.168 -38.349 -21.290 1.00 24.53 H new ATOM 0 HG23 VAL A 38 7.214 -38.917 -19.899 1.00 24.53 H new ATOM 613 N VAL A 39 8.147 -35.328 -17.237 1.00 73.54 N ATOM 614 CA VAL A 39 8.131 -34.100 -16.452 1.00 63.10 C ATOM 615 C VAL A 39 9.490 -33.840 -15.812 1.00 22.23 C ATOM 616 O VAL A 39 9.838 -32.699 -15.509 1.00 50.44 O ATOM 617 CB VAL A 39 7.058 -34.153 -15.349 1.00 12.22 C ATOM 618 CG1 VAL A 39 7.618 -34.795 -14.089 1.00 10.54 C ATOM 619 CG2 VAL A 39 6.527 -32.758 -15.056 1.00 12.33 C ATOM 0 H VAL A 39 7.657 -36.111 -16.804 1.00 73.54 H new ATOM 0 HA VAL A 39 7.895 -33.288 -17.139 1.00 63.10 H new ATOM 0 HB VAL A 39 6.229 -34.766 -15.702 1.00 12.22 H new ATOM 0 HG11 VAL A 39 6.845 -34.824 -13.321 1.00 10.54 H new ATOM 0 HG12 VAL A 39 7.945 -35.810 -14.313 1.00 10.54 H new ATOM 0 HG13 VAL A 39 8.466 -34.212 -13.729 1.00 10.54 H new ATOM 0 HG21 VAL A 39 5.770 -32.814 -14.274 1.00 12.33 H new ATOM 0 HG22 VAL A 39 7.345 -32.120 -14.723 1.00 12.33 H new ATOM 0 HG23 VAL A 39 6.085 -32.340 -15.960 1.00 12.33 H new ATOM 629 N VAL A 40 10.256 -34.907 -15.608 1.00 30.44 N ATOM 630 CA VAL A 40 11.579 -34.795 -15.004 1.00 74.15 C ATOM 631 C VAL A 40 12.497 -33.922 -15.852 1.00 12.30 C ATOM 632 O VAL A 40 13.515 -33.423 -15.372 1.00 51.20 O ATOM 633 CB VAL A 40 12.231 -36.178 -14.820 1.00 35.41 C ATOM 634 CG1 VAL A 40 13.590 -36.043 -14.151 1.00 33.25 C ATOM 635 CG2 VAL A 40 11.319 -37.093 -14.015 1.00 64.14 C ATOM 0 H VAL A 40 9.983 -35.859 -15.852 1.00 30.44 H new ATOM 0 HA VAL A 40 11.443 -34.333 -14.026 1.00 74.15 H new ATOM 0 HB VAL A 40 12.380 -36.624 -15.803 1.00 35.41 H new ATOM 0 HG11 VAL A 40 14.035 -37.030 -14.029 1.00 33.25 H new ATOM 0 HG12 VAL A 40 14.241 -35.425 -14.770 1.00 33.25 H new ATOM 0 HG13 VAL A 40 13.470 -35.576 -13.173 1.00 33.25 H new ATOM 0 HG21 VAL A 40 11.795 -38.066 -13.894 1.00 64.14 H new ATOM 0 HG22 VAL A 40 11.137 -36.654 -13.034 1.00 64.14 H new ATOM 0 HG23 VAL A 40 10.371 -37.215 -14.539 1.00 64.14 H new ATOM 645 N LYS A 41 12.130 -33.740 -17.116 1.00 42.11 N ATOM 646 CA LYS A 41 12.919 -32.925 -18.032 1.00 40.04 C ATOM 647 C LYS A 41 12.676 -31.439 -17.786 1.00 25.43 C ATOM 648 O LYS A 41 13.607 -30.689 -17.496 1.00 41.11 O ATOM 649 CB LYS A 41 12.577 -33.275 -19.482 1.00 54.34 C ATOM 650 CG LYS A 41 13.782 -33.687 -20.310 1.00 11.43 C ATOM 651 CD LYS A 41 13.901 -35.198 -20.407 1.00 70.24 C ATOM 652 CE LYS A 41 14.082 -35.833 -19.037 1.00 11.20 C ATOM 653 NZ LYS A 41 14.842 -37.111 -19.114 1.00 3.14 N ATOM 0 H LYS A 41 11.291 -34.146 -17.529 1.00 42.11 H new ATOM 0 HA LYS A 41 13.973 -33.137 -17.852 1.00 40.04 H new ATOM 0 HB2 LYS A 41 11.848 -34.085 -19.489 1.00 54.34 H new ATOM 0 HB3 LYS A 41 12.101 -32.414 -19.952 1.00 54.34 H new ATOM 0 HG2 LYS A 41 13.699 -33.263 -21.311 1.00 11.43 H new ATOM 0 HG3 LYS A 41 14.688 -33.278 -19.864 1.00 11.43 H new ATOM 0 HD2 LYS A 41 13.008 -35.604 -20.882 1.00 70.24 H new ATOM 0 HD3 LYS A 41 14.747 -35.457 -21.044 1.00 70.24 H new ATOM 0 HE2 LYS A 41 14.606 -35.138 -18.381 1.00 11.20 H new ATOM 0 HE3 LYS A 41 13.105 -36.018 -18.590 1.00 11.20 H new ATOM 0 HZ1 LYS A 41 14.944 -37.512 -18.160 1.00 3.14 H new ATOM 0 HZ2 LYS A 41 14.330 -37.784 -19.720 1.00 3.14 H new ATOM 0 HZ3 LYS A 41 15.784 -36.931 -19.516 1.00 3.14 H new ATOM 667 N ASN A 42 11.420 -31.022 -17.901 1.00 73.42 N ATOM 668 CA ASN A 42 11.055 -29.626 -17.690 1.00 22.34 C ATOM 669 C ASN A 42 11.257 -29.226 -16.231 1.00 65.23 C ATOM 670 O ASN A 42 11.390 -28.044 -15.913 1.00 74.30 O ATOM 671 CB ASN A 42 9.600 -29.390 -18.098 1.00 34.12 C ATOM 672 CG ASN A 42 8.643 -30.339 -17.402 1.00 71.01 C ATOM 673 OD1 ASN A 42 8.675 -30.485 -16.180 1.00 71.22 O ATOM 674 ND2 ASN A 42 7.785 -30.990 -18.180 1.00 3.32 N ATOM 0 H ASN A 42 10.637 -31.631 -18.139 1.00 73.42 H new ATOM 0 HA ASN A 42 11.704 -29.009 -18.311 1.00 22.34 H new ATOM 0 HB2 ASN A 42 9.322 -28.362 -17.864 1.00 34.12 H new ATOM 0 HB3 ASN A 42 9.504 -29.509 -19.177 1.00 34.12 H new ATOM 0 HD21 ASN A 42 7.117 -31.642 -17.769 1.00 3.32 H new ATOM 0 HD22 ASN A 42 7.794 -30.838 -19.189 1.00 3.32 H new ATOM 681 N VAL A 43 11.281 -30.220 -15.349 1.00 1.24 N ATOM 682 CA VAL A 43 11.469 -29.973 -13.924 1.00 40.50 C ATOM 683 C VAL A 43 12.949 -29.845 -13.579 1.00 35.42 C ATOM 684 O VAL A 43 13.317 -29.169 -12.619 1.00 60.15 O ATOM 685 CB VAL A 43 10.849 -31.097 -13.073 1.00 3.43 C ATOM 686 CG1 VAL A 43 11.284 -30.969 -11.621 1.00 4.22 C ATOM 687 CG2 VAL A 43 9.333 -31.076 -13.187 1.00 75.51 C ATOM 0 H VAL A 43 11.173 -31.204 -15.596 1.00 1.24 H new ATOM 0 HA VAL A 43 10.964 -29.035 -13.696 1.00 40.50 H new ATOM 0 HB VAL A 43 11.206 -32.055 -13.451 1.00 3.43 H new ATOM 0 HG11 VAL A 43 10.836 -31.772 -11.035 1.00 4.22 H new ATOM 0 HG12 VAL A 43 12.370 -31.037 -11.559 1.00 4.22 H new ATOM 0 HG13 VAL A 43 10.958 -30.006 -11.227 1.00 4.22 H new ATOM 0 HG21 VAL A 43 8.911 -31.877 -12.579 1.00 75.51 H new ATOM 0 HG22 VAL A 43 8.955 -30.116 -12.835 1.00 75.51 H new ATOM 0 HG23 VAL A 43 9.044 -31.220 -14.228 1.00 75.51 H new ATOM 697 N GLY A 44 13.794 -30.501 -14.369 1.00 14.20 N ATOM 698 CA GLY A 44 15.224 -30.448 -14.131 1.00 62.00 C ATOM 699 C GLY A 44 15.948 -29.579 -15.140 1.00 1.31 C ATOM 700 O GLY A 44 17.172 -29.451 -15.096 1.00 24.14 O ATOM 0 H GLY A 44 13.513 -31.068 -15.169 1.00 14.20 H new ATOM 0 HA2 GLY A 44 15.408 -30.064 -13.127 1.00 62.00 H new ATOM 0 HA3 GLY A 44 15.633 -31.458 -14.166 1.00 62.00 H new ATOM 704 N LEU A 45 15.192 -28.980 -16.053 1.00 74.23 N ATOM 705 CA LEU A 45 15.769 -28.119 -17.080 1.00 34.12 C ATOM 706 C LEU A 45 15.683 -26.652 -16.671 1.00 62.00 C ATOM 707 O LEU A 45 16.427 -25.810 -17.177 1.00 34.53 O ATOM 708 CB LEU A 45 15.051 -28.331 -18.414 1.00 30.31 C ATOM 709 CG LEU A 45 15.588 -29.461 -19.293 1.00 24.11 C ATOM 710 CD1 LEU A 45 14.484 -30.022 -20.176 1.00 45.40 C ATOM 711 CD2 LEU A 45 16.754 -28.970 -20.140 1.00 14.14 C ATOM 0 H LEU A 45 14.178 -29.074 -16.103 1.00 74.23 H new ATOM 0 HA LEU A 45 16.820 -28.385 -17.194 1.00 34.12 H new ATOM 0 HB2 LEU A 45 13.998 -28.525 -18.210 1.00 30.31 H new ATOM 0 HB3 LEU A 45 15.100 -27.402 -18.982 1.00 30.31 H new ATOM 0 HG LEU A 45 15.947 -30.260 -18.645 1.00 24.11 H new ATOM 0 HD11 LEU A 45 14.885 -30.825 -20.794 1.00 45.40 H new ATOM 0 HD12 LEU A 45 13.681 -30.412 -19.551 1.00 45.40 H new ATOM 0 HD13 LEU A 45 14.093 -29.231 -20.817 1.00 45.40 H new ATOM 0 HD21 LEU A 45 17.124 -29.787 -20.759 1.00 14.14 H new ATOM 0 HD22 LEU A 45 16.420 -28.153 -20.779 1.00 14.14 H new ATOM 0 HD23 LEU A 45 17.554 -28.618 -19.489 1.00 14.14 H new ATOM 723 N THR A 46 14.773 -26.352 -15.750 1.00 55.52 N ATOM 724 CA THR A 46 14.590 -24.987 -15.272 1.00 43.12 C ATOM 725 C THR A 46 15.705 -24.587 -14.313 1.00 2.13 C ATOM 726 O THR A 46 15.906 -23.403 -14.037 1.00 64.31 O ATOM 727 CB THR A 46 13.233 -24.816 -14.564 1.00 21.20 C ATOM 728 OG1 THR A 46 12.278 -25.734 -15.108 1.00 11.21 O ATOM 729 CG2 THR A 46 12.719 -23.392 -14.715 1.00 22.40 C ATOM 0 H THR A 46 14.151 -27.036 -15.320 1.00 55.52 H new ATOM 0 HA THR A 46 14.618 -24.339 -16.148 1.00 43.12 H new ATOM 0 HB THR A 46 13.373 -25.024 -13.503 1.00 21.20 H new ATOM 0 HG1 THR A 46 11.418 -25.620 -14.652 1.00 11.21 H new ATOM 0 HG21 THR A 46 11.760 -23.296 -14.207 1.00 22.40 H new ATOM 0 HG22 THR A 46 13.435 -22.698 -14.274 1.00 22.40 H new ATOM 0 HG23 THR A 46 12.594 -23.160 -15.773 1.00 22.40 H new ATOM 737 N LEU A 47 16.428 -25.580 -13.807 1.00 3.23 N ATOM 738 CA LEU A 47 17.525 -25.331 -12.877 1.00 60.24 C ATOM 739 C LEU A 47 18.849 -25.190 -13.622 1.00 74.33 C ATOM 740 O LEU A 47 19.657 -24.315 -13.312 1.00 54.33 O ATOM 741 CB LEU A 47 17.620 -26.465 -11.855 1.00 63.00 C ATOM 742 CG LEU A 47 17.907 -27.856 -12.421 1.00 34.54 C ATOM 743 CD1 LEU A 47 19.402 -28.131 -12.431 1.00 44.25 C ATOM 744 CD2 LEU A 47 17.173 -28.920 -11.617 1.00 23.32 C ATOM 0 H LEU A 47 16.275 -26.565 -14.025 1.00 3.23 H new ATOM 0 HA LEU A 47 17.322 -24.396 -12.355 1.00 60.24 H new ATOM 0 HB2 LEU A 47 18.404 -26.217 -11.139 1.00 63.00 H new ATOM 0 HB3 LEU A 47 16.683 -26.507 -11.300 1.00 63.00 H new ATOM 0 HG LEU A 47 17.546 -27.890 -13.449 1.00 34.54 H new ATOM 0 HD11 LEU A 47 19.586 -29.126 -12.837 1.00 44.25 H new ATOM 0 HD12 LEU A 47 19.905 -27.388 -13.050 1.00 44.25 H new ATOM 0 HD13 LEU A 47 19.789 -28.077 -11.413 1.00 44.25 H new ATOM 0 HD21 LEU A 47 17.388 -29.904 -12.034 1.00 23.32 H new ATOM 0 HD22 LEU A 47 17.504 -28.885 -10.579 1.00 23.32 H new ATOM 0 HD23 LEU A 47 16.100 -28.734 -11.662 1.00 23.32 H new ATOM 756 N ARG A 48 19.063 -26.057 -14.607 1.00 54.31 N ATOM 757 CA ARG A 48 20.288 -26.028 -15.397 1.00 75.21 C ATOM 758 C ARG A 48 20.346 -24.774 -16.264 1.00 61.03 C ATOM 759 O ARG A 48 21.396 -24.430 -16.808 1.00 31.20 O ATOM 760 CB ARG A 48 20.381 -27.275 -16.278 1.00 75.23 C ATOM 761 CG ARG A 48 19.382 -27.287 -17.424 1.00 34.42 C ATOM 762 CD ARG A 48 19.437 -28.596 -18.197 1.00 53.31 C ATOM 763 NE ARG A 48 19.845 -28.395 -19.585 1.00 3.53 N ATOM 764 CZ ARG A 48 20.046 -29.388 -20.443 1.00 71.21 C ATOM 765 NH1 ARG A 48 19.876 -30.646 -20.058 1.00 42.43 N ATOM 766 NH2 ARG A 48 20.417 -29.125 -21.690 1.00 13.03 N ATOM 0 H ARG A 48 18.404 -26.788 -14.877 1.00 54.31 H new ATOM 0 HA ARG A 48 21.134 -26.013 -14.710 1.00 75.21 H new ATOM 0 HB2 ARG A 48 21.389 -27.347 -16.685 1.00 75.23 H new ATOM 0 HB3 ARG A 48 20.223 -28.159 -15.660 1.00 75.23 H new ATOM 0 HG2 ARG A 48 18.376 -27.136 -17.033 1.00 34.42 H new ATOM 0 HG3 ARG A 48 19.590 -26.456 -18.098 1.00 34.42 H new ATOM 0 HD2 ARG A 48 20.135 -29.276 -17.709 1.00 53.31 H new ATOM 0 HD3 ARG A 48 18.457 -29.073 -18.173 1.00 53.31 H new ATOM 0 HE ARG A 48 19.983 -27.439 -19.913 1.00 3.53 H new ATOM 0 HH11 ARG A 48 19.590 -30.852 -19.101 1.00 42.43 H new ATOM 0 HH12 ARG A 48 20.031 -31.407 -20.719 1.00 42.43 H new ATOM 0 HH21 ARG A 48 20.548 -28.159 -21.990 1.00 13.03 H new ATOM 0 HH22 ARG A 48 20.571 -29.889 -22.348 1.00 13.03 H new ATOM 780 N LYS A 49 19.211 -24.094 -16.390 1.00 24.32 N ATOM 781 CA LYS A 49 19.132 -22.878 -17.190 1.00 1.23 C ATOM 782 C LYS A 49 19.265 -21.639 -16.310 1.00 55.42 C ATOM 783 O LYS A 49 19.920 -20.666 -16.686 1.00 11.45 O ATOM 784 CB LYS A 49 17.809 -22.833 -17.957 1.00 14.32 C ATOM 785 CG LYS A 49 16.584 -22.832 -17.058 1.00 3.11 C ATOM 786 CD LYS A 49 16.078 -21.421 -16.806 1.00 24.41 C ATOM 787 CE LYS A 49 14.949 -21.056 -17.757 1.00 63.03 C ATOM 788 NZ LYS A 49 15.451 -20.768 -19.129 1.00 44.42 N ATOM 0 H LYS A 49 18.333 -24.365 -15.948 1.00 24.32 H new ATOM 0 HA LYS A 49 19.957 -22.886 -17.902 1.00 1.23 H new ATOM 0 HB2 LYS A 49 17.791 -21.940 -18.582 1.00 14.32 H new ATOM 0 HB3 LYS A 49 17.757 -23.692 -18.626 1.00 14.32 H new ATOM 0 HG2 LYS A 49 15.794 -23.426 -17.517 1.00 3.11 H new ATOM 0 HG3 LYS A 49 16.828 -23.307 -16.108 1.00 3.11 H new ATOM 0 HD2 LYS A 49 15.730 -21.337 -15.777 1.00 24.41 H new ATOM 0 HD3 LYS A 49 16.898 -20.713 -16.924 1.00 24.41 H new ATOM 0 HE2 LYS A 49 14.230 -21.874 -17.798 1.00 63.03 H new ATOM 0 HE3 LYS A 49 14.419 -20.184 -17.374 1.00 63.03 H new ATOM 0 HZ1 LYS A 49 14.661 -20.458 -19.730 1.00 44.42 H new ATOM 0 HZ2 LYS A 49 16.169 -20.017 -19.085 1.00 44.42 H new ATOM 0 HZ3 LYS A 49 15.875 -21.628 -19.531 1.00 44.42 H new ATOM 802 N LEU A 50 18.640 -21.681 -15.138 1.00 61.15 N ATOM 803 CA LEU A 50 18.690 -20.562 -14.204 1.00 54.22 C ATOM 804 C LEU A 50 20.093 -20.392 -13.632 1.00 44.53 C ATOM 805 O LEU A 50 20.480 -19.295 -13.226 1.00 71.20 O ATOM 806 CB LEU A 50 17.686 -20.775 -13.069 1.00 45.41 C ATOM 807 CG LEU A 50 18.250 -21.369 -11.778 1.00 21.10 C ATOM 808 CD1 LEU A 50 18.780 -20.269 -10.871 1.00 34.54 C ATOM 809 CD2 LEU A 50 17.188 -22.190 -11.061 1.00 1.33 C ATOM 0 H LEU A 50 18.093 -22.478 -14.812 1.00 61.15 H new ATOM 0 HA LEU A 50 18.428 -19.655 -14.748 1.00 54.22 H new ATOM 0 HB2 LEU A 50 17.225 -19.816 -12.833 1.00 45.41 H new ATOM 0 HB3 LEU A 50 16.893 -21.429 -13.430 1.00 45.41 H new ATOM 0 HG LEU A 50 19.078 -22.029 -12.035 1.00 21.10 H new ATOM 0 HD11 LEU A 50 19.177 -20.711 -9.957 1.00 34.54 H new ATOM 0 HD12 LEU A 50 19.572 -19.724 -11.385 1.00 34.54 H new ATOM 0 HD13 LEU A 50 17.971 -19.583 -10.620 1.00 34.54 H new ATOM 0 HD21 LEU A 50 17.607 -22.605 -10.144 1.00 1.33 H new ATOM 0 HD22 LEU A 50 16.339 -21.552 -10.816 1.00 1.33 H new ATOM 0 HD23 LEU A 50 16.857 -23.002 -11.709 1.00 1.33 H new ATOM 821 N ILE A 51 20.852 -21.482 -13.606 1.00 21.02 N ATOM 822 CA ILE A 51 22.214 -21.452 -13.087 1.00 71.10 C ATOM 823 C ILE A 51 23.091 -20.505 -13.899 1.00 14.54 C ATOM 824 O ILE A 51 24.046 -19.928 -13.380 1.00 71.40 O ATOM 825 CB ILE A 51 22.850 -22.855 -13.094 1.00 51.31 C ATOM 826 CG1 ILE A 51 22.215 -23.732 -12.013 1.00 71.03 C ATOM 827 CG2 ILE A 51 24.354 -22.755 -12.887 1.00 71.33 C ATOM 828 CD1 ILE A 51 22.226 -25.207 -12.349 1.00 21.04 C ATOM 0 H ILE A 51 20.547 -22.397 -13.938 1.00 21.02 H new ATOM 0 HA ILE A 51 22.152 -21.095 -12.059 1.00 71.10 H new ATOM 0 HB ILE A 51 22.666 -23.317 -14.064 1.00 51.31 H new ATOM 0 HG12 ILE A 51 22.745 -23.578 -11.073 1.00 71.03 H new ATOM 0 HG13 ILE A 51 21.185 -23.411 -11.855 1.00 71.03 H new ATOM 0 HG21 ILE A 51 24.790 -23.754 -12.894 1.00 71.33 H new ATOM 0 HG22 ILE A 51 24.793 -22.162 -13.689 1.00 71.33 H new ATOM 0 HG23 ILE A 51 24.558 -22.277 -11.929 1.00 71.33 H new ATOM 0 HD11 ILE A 51 21.760 -25.768 -11.539 1.00 21.04 H new ATOM 0 HD12 ILE A 51 21.671 -25.374 -13.272 1.00 21.04 H new ATOM 0 HD13 ILE A 51 23.255 -25.543 -12.479 1.00 21.04 H new ATOM 840 N GLY A 52 22.757 -20.346 -15.176 1.00 64.42 N ATOM 841 CA GLY A 52 23.523 -19.466 -16.039 1.00 62.11 C ATOM 842 C GLY A 52 23.402 -18.010 -15.636 1.00 50.11 C ATOM 843 O GLY A 52 24.153 -17.161 -16.116 1.00 64.32 O ATOM 0 H GLY A 52 21.970 -20.811 -15.628 1.00 64.42 H new ATOM 0 HA2 GLY A 52 24.572 -19.761 -16.014 1.00 62.11 H new ATOM 0 HA3 GLY A 52 23.183 -19.585 -17.068 1.00 62.11 H new ATOM 847 N SER A 53 22.452 -17.719 -14.753 1.00 2.11 N ATOM 848 CA SER A 53 22.231 -16.354 -14.290 1.00 23.03 C ATOM 849 C SER A 53 23.153 -16.021 -13.120 1.00 61.44 C ATOM 850 O SER A 53 23.795 -14.971 -13.100 1.00 71.00 O ATOM 851 CB SER A 53 20.772 -16.164 -13.873 1.00 75.30 C ATOM 852 OG SER A 53 20.517 -16.770 -12.617 1.00 53.34 O ATOM 0 H SER A 53 21.823 -18.410 -14.344 1.00 2.11 H new ATOM 0 HA SER A 53 22.457 -15.677 -15.113 1.00 23.03 H new ATOM 0 HB2 SER A 53 20.541 -15.100 -13.820 1.00 75.30 H new ATOM 0 HB3 SER A 53 20.115 -16.596 -14.628 1.00 75.30 H new ATOM 0 HG SER A 53 20.774 -17.715 -12.652 1.00 53.34 H new ATOM 858 N VAL A 54 23.213 -16.925 -12.147 1.00 3.41 N ATOM 859 CA VAL A 54 24.057 -16.729 -10.974 1.00 33.13 C ATOM 860 C VAL A 54 25.517 -17.030 -11.291 1.00 2.04 C ATOM 861 O VAL A 54 26.419 -16.619 -10.560 1.00 41.54 O ATOM 862 CB VAL A 54 23.603 -17.620 -9.802 1.00 1.43 C ATOM 863 CG1 VAL A 54 24.174 -17.106 -8.489 1.00 21.33 C ATOM 864 CG2 VAL A 54 22.085 -17.688 -9.742 1.00 14.12 C ATOM 0 H VAL A 54 22.688 -17.799 -12.148 1.00 3.41 H new ATOM 0 HA VAL A 54 23.960 -15.683 -10.685 1.00 33.13 H new ATOM 0 HB VAL A 54 23.983 -18.628 -9.966 1.00 1.43 H new ATOM 0 HG11 VAL A 54 23.843 -17.747 -7.672 1.00 21.33 H new ATOM 0 HG12 VAL A 54 25.263 -17.114 -8.538 1.00 21.33 H new ATOM 0 HG13 VAL A 54 23.826 -16.088 -8.315 1.00 21.33 H new ATOM 0 HG21 VAL A 54 21.782 -18.321 -8.908 1.00 14.12 H new ATOM 0 HG22 VAL A 54 21.681 -16.685 -9.601 1.00 14.12 H new ATOM 0 HG23 VAL A 54 21.702 -18.106 -10.673 1.00 14.12 H new ATOM 874 N ASP A 55 25.743 -17.750 -12.384 1.00 44.30 N ATOM 875 CA ASP A 55 27.095 -18.105 -12.799 1.00 44.15 C ATOM 876 C ASP A 55 27.759 -16.946 -13.537 1.00 24.21 C ATOM 877 O ASP A 55 28.986 -16.862 -13.605 1.00 13.13 O ATOM 878 CB ASP A 55 27.068 -19.346 -13.693 1.00 53.33 C ATOM 879 CG ASP A 55 28.427 -20.008 -13.807 1.00 51.53 C ATOM 880 OD1 ASP A 55 29.375 -19.340 -14.271 1.00 15.41 O ATOM 881 OD2 ASP A 55 28.543 -21.194 -13.434 1.00 12.23 O ATOM 0 H ASP A 55 25.008 -18.099 -12.999 1.00 44.30 H new ATOM 0 HA ASP A 55 27.677 -18.324 -11.904 1.00 44.15 H new ATOM 0 HB2 ASP A 55 26.351 -20.063 -13.293 1.00 53.33 H new ATOM 0 HB3 ASP A 55 26.719 -19.066 -14.687 1.00 53.33 H new ATOM 886 N ASP A 56 26.942 -16.057 -14.089 1.00 15.45 N ATOM 887 CA ASP A 56 27.449 -14.903 -14.821 1.00 42.53 C ATOM 888 C ASP A 56 28.341 -14.043 -13.931 1.00 14.52 C ATOM 889 O ASP A 56 29.299 -13.428 -14.401 1.00 60.44 O ATOM 890 CB ASP A 56 26.290 -14.066 -15.364 1.00 13.42 C ATOM 891 CG ASP A 56 26.764 -12.882 -16.183 1.00 41.34 C ATOM 892 OD1 ASP A 56 27.953 -12.863 -16.564 1.00 50.44 O ATOM 893 OD2 ASP A 56 25.947 -11.974 -16.443 1.00 54.31 O ATOM 0 H ASP A 56 25.925 -16.113 -14.043 1.00 15.45 H new ATOM 0 HA ASP A 56 28.045 -15.268 -15.657 1.00 42.53 H new ATOM 0 HB2 ASP A 56 25.648 -14.696 -15.980 1.00 13.42 H new ATOM 0 HB3 ASP A 56 25.683 -13.709 -14.532 1.00 13.42 H new ATOM 898 N LEU A 57 28.018 -14.002 -12.643 1.00 22.03 N ATOM 899 CA LEU A 57 28.789 -13.216 -11.685 1.00 61.24 C ATOM 900 C LEU A 57 29.389 -14.110 -10.605 1.00 32.12 C ATOM 901 O LEU A 57 29.785 -13.634 -9.540 1.00 32.53 O ATOM 902 CB LEU A 57 27.904 -12.146 -11.045 1.00 1.43 C ATOM 903 CG LEU A 57 27.276 -11.132 -12.002 1.00 65.24 C ATOM 904 CD1 LEU A 57 28.296 -10.666 -13.030 1.00 61.51 C ATOM 905 CD2 LEU A 57 26.059 -11.732 -12.690 1.00 53.13 C ATOM 0 H LEU A 57 27.228 -14.504 -12.238 1.00 22.03 H new ATOM 0 HA LEU A 57 29.604 -12.731 -12.222 1.00 61.24 H new ATOM 0 HB2 LEU A 57 27.103 -12.645 -10.499 1.00 1.43 H new ATOM 0 HB3 LEU A 57 28.499 -11.602 -10.311 1.00 1.43 H new ATOM 0 HG LEU A 57 26.952 -10.267 -11.424 1.00 65.24 H new ATOM 0 HD11 LEU A 57 27.831 -9.945 -13.703 1.00 61.51 H new ATOM 0 HD12 LEU A 57 29.138 -10.197 -12.521 1.00 61.51 H new ATOM 0 HD13 LEU A 57 28.651 -11.522 -13.605 1.00 61.51 H new ATOM 0 HD21 LEU A 57 25.625 -10.997 -13.367 1.00 53.13 H new ATOM 0 HD22 LEU A 57 26.359 -12.614 -13.256 1.00 53.13 H new ATOM 0 HD23 LEU A 57 25.320 -12.016 -11.940 1.00 53.13 H new ATOM 917 N LEU A 58 29.455 -15.407 -10.886 1.00 51.43 N ATOM 918 CA LEU A 58 30.009 -16.368 -9.939 1.00 50.12 C ATOM 919 C LEU A 58 31.380 -15.917 -9.445 1.00 34.03 C ATOM 920 O LEU A 58 31.611 -15.750 -8.247 1.00 14.11 O ATOM 921 CB LEU A 58 30.117 -17.749 -10.588 1.00 43.24 C ATOM 922 CG LEU A 58 29.401 -18.889 -9.864 1.00 54.02 C ATOM 923 CD1 LEU A 58 29.749 -20.227 -10.498 1.00 40.43 C ATOM 924 CD2 LEU A 58 29.757 -18.889 -8.385 1.00 5.11 C ATOM 0 H LEU A 58 29.132 -15.817 -11.762 1.00 51.43 H new ATOM 0 HA LEU A 58 29.336 -16.427 -9.083 1.00 50.12 H new ATOM 0 HB2 LEU A 58 29.721 -17.684 -11.602 1.00 43.24 H new ATOM 0 HB3 LEU A 58 31.173 -18.006 -10.674 1.00 43.24 H new ATOM 0 HG LEU A 58 28.326 -18.734 -9.958 1.00 54.02 H new ATOM 0 HD11 LEU A 58 29.230 -21.026 -9.969 1.00 40.43 H new ATOM 0 HD12 LEU A 58 29.442 -20.225 -11.544 1.00 40.43 H new ATOM 0 HD13 LEU A 58 30.825 -20.390 -10.436 1.00 40.43 H new ATOM 0 HD21 LEU A 58 29.238 -19.707 -7.886 1.00 5.11 H new ATOM 0 HD22 LEU A 58 30.833 -19.018 -8.270 1.00 5.11 H new ATOM 0 HD23 LEU A 58 29.455 -17.942 -7.938 1.00 5.11 H new ATOM 936 N PRO A 59 32.311 -15.713 -10.388 1.00 5.24 N ATOM 937 CA PRO A 59 33.675 -15.276 -10.072 1.00 14.51 C ATOM 938 C PRO A 59 33.721 -13.835 -9.575 1.00 53.54 C ATOM 939 O PRO A 59 34.770 -13.346 -9.157 1.00 11.53 O ATOM 940 CB PRO A 59 34.407 -15.404 -11.410 1.00 1.11 C ATOM 941 CG PRO A 59 33.338 -15.280 -12.440 1.00 43.33 C ATOM 942 CD PRO A 59 32.106 -15.893 -11.835 1.00 11.44 C ATOM 0 HA PRO A 59 34.117 -15.867 -9.270 1.00 14.51 H new ATOM 0 HB2 PRO A 59 35.160 -14.625 -11.525 1.00 1.11 H new ATOM 0 HB3 PRO A 59 34.924 -16.361 -11.489 1.00 1.11 H new ATOM 0 HG2 PRO A 59 33.166 -14.236 -12.700 1.00 43.33 H new ATOM 0 HG3 PRO A 59 33.619 -15.795 -13.358 1.00 43.33 H new ATOM 0 HD2 PRO A 59 31.199 -15.394 -12.178 1.00 11.44 H new ATOM 0 HD3 PRO A 59 32.010 -16.946 -12.099 1.00 11.44 H new ATOM 950 N SER A 60 32.577 -13.160 -9.625 1.00 13.44 N ATOM 951 CA SER A 60 32.488 -11.773 -9.183 1.00 12.24 C ATOM 952 C SER A 60 32.097 -11.696 -7.710 1.00 2.02 C ATOM 953 O SER A 60 31.710 -10.638 -7.212 1.00 52.24 O ATOM 954 CB SER A 60 31.470 -11.009 -10.032 1.00 44.22 C ATOM 955 OG SER A 60 31.578 -11.364 -11.400 1.00 24.53 O ATOM 0 H SER A 60 31.699 -13.551 -9.967 1.00 13.44 H new ATOM 0 HA SER A 60 33.470 -11.315 -9.305 1.00 12.24 H new ATOM 0 HB2 SER A 60 30.462 -11.222 -9.676 1.00 44.22 H new ATOM 0 HB3 SER A 60 31.628 -9.937 -9.918 1.00 44.22 H new ATOM 0 HG SER A 60 31.315 -10.602 -11.957 1.00 24.53 H new ATOM 961 N LEU A 61 32.202 -12.825 -7.017 1.00 53.41 N ATOM 962 CA LEU A 61 31.860 -12.887 -5.600 1.00 72.33 C ATOM 963 C LEU A 61 33.110 -13.074 -4.746 1.00 73.43 C ATOM 964 O LEU A 61 34.137 -13.574 -5.206 1.00 74.12 O ATOM 965 CB LEU A 61 30.876 -14.030 -5.343 1.00 25.33 C ATOM 966 CG LEU A 61 29.807 -14.250 -6.413 1.00 50.43 C ATOM 967 CD1 LEU A 61 29.246 -15.661 -6.326 1.00 41.44 C ATOM 968 CD2 LEU A 61 28.694 -13.222 -6.273 1.00 53.34 C ATOM 0 H LEU A 61 32.521 -13.709 -7.413 1.00 53.41 H new ATOM 0 HA LEU A 61 31.391 -11.943 -5.322 1.00 72.33 H new ATOM 0 HB2 LEU A 61 31.444 -14.953 -5.231 1.00 25.33 H new ATOM 0 HB3 LEU A 61 30.377 -13.846 -4.392 1.00 25.33 H new ATOM 0 HG LEU A 61 30.269 -14.125 -7.392 1.00 50.43 H new ATOM 0 HD11 LEU A 61 28.486 -15.799 -7.096 1.00 41.44 H new ATOM 0 HD12 LEU A 61 30.050 -16.382 -6.476 1.00 41.44 H new ATOM 0 HD13 LEU A 61 28.799 -15.815 -5.344 1.00 41.44 H new ATOM 0 HD21 LEU A 61 27.941 -13.393 -7.043 1.00 53.34 H new ATOM 0 HD22 LEU A 61 28.234 -13.315 -5.289 1.00 53.34 H new ATOM 0 HD23 LEU A 61 29.108 -12.220 -6.387 1.00 53.34 H new ATOM 980 N PRO A 62 33.022 -12.666 -3.472 1.00 23.24 N ATOM 981 CA PRO A 62 34.136 -12.781 -2.525 1.00 61.34 C ATOM 982 C PRO A 62 34.426 -14.229 -2.145 1.00 21.14 C ATOM 983 O PRO A 62 33.908 -15.159 -2.763 1.00 25.10 O ATOM 984 CB PRO A 62 33.648 -11.995 -1.306 1.00 22.10 C ATOM 985 CG PRO A 62 32.162 -12.051 -1.389 1.00 51.22 C ATOM 986 CD PRO A 62 31.829 -12.062 -2.856 1.00 3.54 C ATOM 0 HA PRO A 62 35.069 -12.405 -2.945 1.00 61.34 H new ATOM 0 HB2 PRO A 62 34.010 -12.439 -0.378 1.00 22.10 H new ATOM 0 HB3 PRO A 62 34.007 -10.966 -1.329 1.00 22.10 H new ATOM 0 HG2 PRO A 62 31.777 -12.943 -0.895 1.00 51.22 H new ATOM 0 HG3 PRO A 62 31.711 -11.192 -0.893 1.00 51.22 H new ATOM 0 HD2 PRO A 62 30.932 -12.646 -3.060 1.00 3.54 H new ATOM 0 HD3 PRO A 62 31.647 -11.056 -3.234 1.00 3.54 H new ATOM 994 N SER A 63 35.256 -14.413 -1.123 1.00 3.51 N ATOM 995 CA SER A 63 35.618 -15.748 -0.662 1.00 14.11 C ATOM 996 C SER A 63 34.637 -16.241 0.397 1.00 15.14 C ATOM 997 O SER A 63 34.876 -17.251 1.059 1.00 2.44 O ATOM 998 CB SER A 63 37.039 -15.748 -0.096 1.00 41.12 C ATOM 999 OG SER A 63 37.631 -17.031 -0.204 1.00 32.13 O ATOM 0 H SER A 63 35.690 -13.654 -0.598 1.00 3.51 H new ATOM 0 HA SER A 63 35.575 -16.424 -1.516 1.00 14.11 H new ATOM 0 HB2 SER A 63 37.647 -15.018 -0.630 1.00 41.12 H new ATOM 0 HB3 SER A 63 37.017 -15.441 0.950 1.00 41.12 H new ATOM 0 HG SER A 63 37.018 -17.706 0.156 1.00 32.13 H new ATOM 1005 N SER A 64 33.530 -15.520 0.552 1.00 64.14 N ATOM 1006 CA SER A 64 32.514 -15.881 1.533 1.00 53.33 C ATOM 1007 C SER A 64 31.172 -16.142 0.854 1.00 4.01 C ATOM 1008 O SER A 64 30.280 -16.760 1.435 1.00 3.11 O ATOM 1009 CB SER A 64 32.363 -14.770 2.574 1.00 23.23 C ATOM 1010 OG SER A 64 31.704 -15.246 3.735 1.00 1.22 O ATOM 0 H SER A 64 33.315 -14.683 0.011 1.00 64.14 H new ATOM 0 HA SER A 64 32.834 -16.796 2.031 1.00 53.33 H new ATOM 0 HB2 SER A 64 33.346 -14.383 2.843 1.00 23.23 H new ATOM 0 HB3 SER A 64 31.800 -13.941 2.146 1.00 23.23 H new ATOM 0 HG SER A 64 31.621 -14.518 4.386 1.00 1.22 H new ATOM 1016 N SER A 65 31.038 -15.666 -0.380 1.00 21.42 N ATOM 1017 CA SER A 65 29.805 -15.844 -1.138 1.00 21.54 C ATOM 1018 C SER A 65 30.027 -16.777 -2.325 1.00 33.15 C ATOM 1019 O SER A 65 29.157 -17.576 -2.671 1.00 32.42 O ATOM 1020 CB SER A 65 29.283 -14.492 -1.627 1.00 71.54 C ATOM 1021 OG SER A 65 29.489 -13.483 -0.654 1.00 64.15 O ATOM 0 H SER A 65 31.768 -15.154 -0.876 1.00 21.42 H new ATOM 0 HA SER A 65 29.063 -16.294 -0.478 1.00 21.54 H new ATOM 0 HB2 SER A 65 29.788 -14.217 -2.553 1.00 71.54 H new ATOM 0 HB3 SER A 65 28.220 -14.570 -1.855 1.00 71.54 H new ATOM 0 HG SER A 65 28.707 -12.893 -0.625 1.00 64.15 H new ATOM 1027 N ARG A 66 31.198 -16.668 -2.944 1.00 34.42 N ATOM 1028 CA ARG A 66 31.534 -17.500 -4.093 1.00 24.33 C ATOM 1029 C ARG A 66 31.365 -18.980 -3.761 1.00 1.02 C ATOM 1030 O ARG A 66 30.762 -19.734 -4.525 1.00 32.33 O ATOM 1031 CB ARG A 66 32.971 -17.229 -4.542 1.00 42.43 C ATOM 1032 CG ARG A 66 33.338 -17.906 -5.853 1.00 32.25 C ATOM 1033 CD ARG A 66 34.801 -17.688 -6.202 1.00 44.43 C ATOM 1034 NE ARG A 66 35.462 -18.930 -6.593 1.00 4.04 N ATOM 1035 CZ ARG A 66 35.763 -19.902 -5.739 1.00 32.31 C ATOM 1036 NH1 ARG A 66 35.462 -19.777 -4.454 1.00 3.34 N ATOM 1037 NH2 ARG A 66 36.364 -21.003 -6.170 1.00 65.44 N ATOM 0 H ARG A 66 31.929 -16.012 -2.669 1.00 34.42 H new ATOM 0 HA ARG A 66 30.852 -17.247 -4.905 1.00 24.33 H new ATOM 0 HB2 ARG A 66 33.113 -16.153 -4.646 1.00 42.43 H new ATOM 0 HB3 ARG A 66 33.656 -17.567 -3.764 1.00 42.43 H new ATOM 0 HG2 ARG A 66 33.135 -18.975 -5.781 1.00 32.25 H new ATOM 0 HG3 ARG A 66 32.710 -17.516 -6.654 1.00 32.25 H new ATOM 0 HD2 ARG A 66 34.876 -16.966 -7.015 1.00 44.43 H new ATOM 0 HD3 ARG A 66 35.318 -17.257 -5.345 1.00 44.43 H new ATOM 0 HE ARG A 66 35.706 -19.058 -7.575 1.00 4.04 H new ATOM 0 HH11 ARG A 66 34.998 -18.933 -4.119 1.00 3.34 H new ATOM 0 HH12 ARG A 66 35.694 -20.525 -3.801 1.00 3.34 H new ATOM 0 HH21 ARG A 66 36.596 -21.104 -7.158 1.00 65.44 H new ATOM 0 HH22 ARG A 66 36.595 -21.749 -5.513 1.00 65.44 H new ATOM 1051 N THR A 67 31.902 -19.390 -2.616 1.00 4.32 N ATOM 1052 CA THR A 67 31.813 -20.779 -2.183 1.00 52.52 C ATOM 1053 C THR A 67 30.360 -21.212 -2.024 1.00 60.23 C ATOM 1054 O THR A 67 30.054 -22.404 -2.036 1.00 42.04 O ATOM 1055 CB THR A 67 32.552 -21.001 -0.850 1.00 53.50 C ATOM 1056 OG1 THR A 67 33.758 -20.229 -0.824 1.00 72.10 O ATOM 1057 CG2 THR A 67 32.881 -22.473 -0.652 1.00 51.54 C ATOM 0 H THR A 67 32.404 -18.779 -1.971 1.00 4.32 H new ATOM 0 HA THR A 67 32.287 -21.383 -2.957 1.00 52.52 H new ATOM 0 HB THR A 67 31.898 -20.679 -0.039 1.00 53.50 H new ATOM 0 HG1 THR A 67 34.221 -20.374 0.027 1.00 72.10 H new ATOM 0 HG21 THR A 67 33.403 -22.605 0.296 1.00 51.54 H new ATOM 0 HG22 THR A 67 31.959 -23.054 -0.643 1.00 51.54 H new ATOM 0 HG23 THR A 67 33.518 -22.816 -1.467 1.00 51.54 H new ATOM 1065 N GLU A 68 29.469 -20.237 -1.876 1.00 51.11 N ATOM 1066 CA GLU A 68 28.048 -20.520 -1.715 1.00 15.23 C ATOM 1067 C GLU A 68 27.420 -20.931 -3.044 1.00 24.44 C ATOM 1068 O GLU A 68 26.899 -22.039 -3.179 1.00 42.32 O ATOM 1069 CB GLU A 68 27.322 -19.296 -1.153 1.00 53.51 C ATOM 1070 CG GLU A 68 26.506 -19.591 0.094 1.00 14.31 C ATOM 1071 CD GLU A 68 27.328 -20.242 1.189 1.00 61.32 C ATOM 1072 OE1 GLU A 68 28.499 -19.847 1.367 1.00 10.31 O ATOM 1073 OE2 GLU A 68 26.800 -21.148 1.867 1.00 30.04 O ATOM 0 H GLU A 68 29.706 -19.245 -1.864 1.00 51.11 H new ATOM 0 HA GLU A 68 27.947 -21.348 -1.014 1.00 15.23 H new ATOM 0 HB2 GLU A 68 28.055 -18.523 -0.922 1.00 53.51 H new ATOM 0 HB3 GLU A 68 26.663 -18.891 -1.921 1.00 53.51 H new ATOM 0 HG2 GLU A 68 26.077 -18.663 0.471 1.00 14.31 H new ATOM 0 HG3 GLU A 68 25.674 -20.244 -0.167 1.00 14.31 H new ATOM 1080 N ILE A 69 27.475 -20.032 -4.020 1.00 74.12 N ATOM 1081 CA ILE A 69 26.913 -20.301 -5.338 1.00 32.41 C ATOM 1082 C ILE A 69 27.710 -21.379 -6.066 1.00 11.52 C ATOM 1083 O ILE A 69 27.139 -22.308 -6.635 1.00 22.33 O ATOM 1084 CB ILE A 69 26.878 -19.030 -6.206 1.00 2.42 C ATOM 1085 CG1 ILE A 69 25.966 -17.977 -5.571 1.00 64.43 C ATOM 1086 CG2 ILE A 69 26.411 -19.363 -7.615 1.00 44.50 C ATOM 1087 CD1 ILE A 69 26.205 -16.578 -6.092 1.00 42.43 C ATOM 0 H ILE A 69 27.903 -19.111 -3.923 1.00 74.12 H new ATOM 0 HA ILE A 69 25.893 -20.651 -5.180 1.00 32.41 H new ATOM 0 HB ILE A 69 27.887 -18.621 -6.266 1.00 2.42 H new ATOM 0 HG12 ILE A 69 24.927 -18.251 -5.753 1.00 64.43 H new ATOM 0 HG13 ILE A 69 26.113 -17.984 -4.491 1.00 64.43 H new ATOM 0 HG21 ILE A 69 26.392 -18.454 -8.216 1.00 44.50 H new ATOM 0 HG22 ILE A 69 27.096 -20.081 -8.065 1.00 44.50 H new ATOM 0 HG23 ILE A 69 25.410 -19.793 -7.575 1.00 44.50 H new ATOM 0 HD11 ILE A 69 25.524 -15.885 -5.598 1.00 42.43 H new ATOM 0 HD12 ILE A 69 27.234 -16.284 -5.886 1.00 42.43 H new ATOM 0 HD13 ILE A 69 26.029 -16.555 -7.167 1.00 42.43 H new ATOM 1099 N GLU A 70 29.033 -21.246 -6.041 1.00 75.44 N ATOM 1100 CA GLU A 70 29.908 -22.210 -6.698 1.00 40.35 C ATOM 1101 C GLU A 70 29.680 -23.615 -6.149 1.00 71.14 C ATOM 1102 O GLU A 70 29.992 -24.608 -6.805 1.00 43.13 O ATOM 1103 CB GLU A 70 31.373 -21.810 -6.514 1.00 3.35 C ATOM 1104 CG GLU A 70 32.284 -22.302 -7.626 1.00 54.42 C ATOM 1105 CD GLU A 70 32.974 -23.607 -7.281 1.00 10.21 C ATOM 1106 OE1 GLU A 70 33.579 -23.687 -6.191 1.00 71.01 O ATOM 1107 OE2 GLU A 70 32.910 -24.547 -8.100 1.00 32.44 O ATOM 0 H GLU A 70 29.521 -20.482 -5.574 1.00 75.44 H new ATOM 0 HA GLU A 70 29.670 -22.212 -7.762 1.00 40.35 H new ATOM 0 HB2 GLU A 70 31.439 -20.724 -6.456 1.00 3.35 H new ATOM 0 HB3 GLU A 70 31.731 -22.203 -5.562 1.00 3.35 H new ATOM 0 HG2 GLU A 70 31.700 -22.434 -8.537 1.00 54.42 H new ATOM 0 HG3 GLU A 70 33.037 -21.542 -7.837 1.00 54.42 H new ATOM 1114 N GLY A 71 29.133 -23.690 -4.940 1.00 32.12 N ATOM 1115 CA GLY A 71 28.873 -24.977 -4.322 1.00 34.21 C ATOM 1116 C GLY A 71 27.407 -25.359 -4.374 1.00 33.53 C ATOM 1117 O GLY A 71 27.043 -26.500 -4.083 1.00 3.44 O ATOM 0 H GLY A 71 28.865 -22.883 -4.377 1.00 32.12 H new ATOM 0 HA2 GLY A 71 29.463 -25.744 -4.824 1.00 34.21 H new ATOM 0 HA3 GLY A 71 29.202 -24.951 -3.283 1.00 34.21 H new ATOM 1121 N THR A 72 26.560 -24.404 -4.744 1.00 41.41 N ATOM 1122 CA THR A 72 25.125 -24.645 -4.830 1.00 44.33 C ATOM 1123 C THR A 72 24.711 -24.994 -6.255 1.00 62.11 C ATOM 1124 O THR A 72 23.991 -25.966 -6.480 1.00 62.44 O ATOM 1125 CB THR A 72 24.320 -23.419 -4.360 1.00 4.33 C ATOM 1126 OG1 THR A 72 24.581 -23.164 -2.975 1.00 13.31 O ATOM 1127 CG2 THR A 72 22.830 -23.637 -4.569 1.00 34.31 C ATOM 0 H THR A 72 26.843 -23.455 -4.989 1.00 41.41 H new ATOM 0 HA THR A 72 24.906 -25.487 -4.174 1.00 44.33 H new ATOM 0 HB THR A 72 24.631 -22.559 -4.953 1.00 4.33 H new ATOM 0 HG1 THR A 72 25.265 -22.467 -2.894 1.00 13.31 H new ATOM 0 HG21 THR A 72 22.283 -22.758 -4.230 1.00 34.31 H new ATOM 0 HG22 THR A 72 22.631 -23.802 -5.628 1.00 34.31 H new ATOM 0 HG23 THR A 72 22.506 -24.508 -3.999 1.00 34.31 H new ATOM 1135 N GLN A 73 25.171 -24.195 -7.213 1.00 21.52 N ATOM 1136 CA GLN A 73 24.847 -24.422 -8.616 1.00 43.34 C ATOM 1137 C GLN A 73 25.331 -25.794 -9.072 1.00 63.23 C ATOM 1138 O GLN A 73 24.837 -26.343 -10.057 1.00 62.24 O ATOM 1139 CB GLN A 73 25.473 -23.332 -9.488 1.00 41.41 C ATOM 1140 CG GLN A 73 25.131 -21.921 -9.037 1.00 51.20 C ATOM 1141 CD GLN A 73 23.668 -21.580 -9.245 1.00 64.12 C ATOM 1142 OE1 GLN A 73 23.320 -20.805 -10.136 1.00 5.50 O ATOM 1143 NE2 GLN A 73 22.802 -22.160 -8.422 1.00 44.23 N ATOM 0 H GLN A 73 25.768 -23.386 -7.043 1.00 21.52 H new ATOM 0 HA GLN A 73 23.763 -24.386 -8.723 1.00 43.34 H new ATOM 0 HB2 GLN A 73 26.556 -23.453 -9.485 1.00 41.41 H new ATOM 0 HB3 GLN A 73 25.140 -23.466 -10.517 1.00 41.41 H new ATOM 0 HG2 GLN A 73 25.379 -21.811 -7.981 1.00 51.20 H new ATOM 0 HG3 GLN A 73 25.748 -21.209 -9.585 1.00 51.20 H new ATOM 0 HE21 GLN A 73 23.135 -22.796 -7.697 1.00 44.23 H new ATOM 0 HE22 GLN A 73 21.804 -21.969 -8.515 1.00 44.23 H new ATOM 1152 N LYS A 74 26.301 -26.344 -8.350 1.00 24.03 N ATOM 1153 CA LYS A 74 26.853 -27.653 -8.678 1.00 71.24 C ATOM 1154 C LYS A 74 25.959 -28.769 -8.147 1.00 60.10 C ATOM 1155 O LYS A 74 25.751 -29.783 -8.815 1.00 22.23 O ATOM 1156 CB LYS A 74 28.263 -27.795 -8.100 1.00 74.41 C ATOM 1157 CG LYS A 74 28.321 -27.624 -6.592 1.00 65.20 C ATOM 1158 CD LYS A 74 28.348 -28.966 -5.879 1.00 42.21 C ATOM 1159 CE LYS A 74 29.301 -28.948 -4.694 1.00 21.23 C ATOM 1160 NZ LYS A 74 30.707 -28.700 -5.116 1.00 64.42 N ATOM 0 H LYS A 74 26.722 -25.903 -7.532 1.00 24.03 H new ATOM 0 HA LYS A 74 26.903 -27.737 -9.764 1.00 71.24 H new ATOM 0 HB2 LYS A 74 28.657 -28.777 -8.361 1.00 74.41 H new ATOM 0 HB3 LYS A 74 28.914 -27.056 -8.567 1.00 74.41 H new ATOM 0 HG2 LYS A 74 29.208 -27.051 -6.324 1.00 65.20 H new ATOM 0 HG3 LYS A 74 27.457 -27.050 -6.257 1.00 65.20 H new ATOM 0 HD2 LYS A 74 27.344 -29.217 -5.536 1.00 42.21 H new ATOM 0 HD3 LYS A 74 28.650 -29.745 -6.579 1.00 42.21 H new ATOM 0 HE2 LYS A 74 28.991 -28.175 -3.991 1.00 21.23 H new ATOM 0 HE3 LYS A 74 29.243 -29.900 -4.167 1.00 21.23 H new ATOM 0 HZ1 LYS A 74 31.356 -29.171 -4.454 1.00 64.42 H new ATOM 0 HZ2 LYS A 74 30.854 -29.079 -6.073 1.00 64.42 H new ATOM 0 HZ3 LYS A 74 30.894 -27.677 -5.116 1.00 64.42 H new ATOM 1174 N LEU A 75 25.431 -28.576 -6.943 1.00 44.43 N ATOM 1175 CA LEU A 75 24.558 -29.565 -6.323 1.00 32.53 C ATOM 1176 C LEU A 75 23.185 -29.572 -6.987 1.00 34.34 C ATOM 1177 O LEU A 75 22.423 -30.531 -6.852 1.00 52.12 O ATOM 1178 CB LEU A 75 24.412 -29.280 -4.827 1.00 4.10 C ATOM 1179 CG LEU A 75 23.267 -28.347 -4.430 1.00 23.51 C ATOM 1180 CD1 LEU A 75 21.998 -29.143 -4.167 1.00 51.35 C ATOM 1181 CD2 LEU A 75 23.648 -27.527 -3.206 1.00 34.10 C ATOM 0 H LEU A 75 25.593 -27.743 -6.377 1.00 44.43 H new ATOM 0 HA LEU A 75 25.011 -30.547 -6.457 1.00 32.53 H new ATOM 0 HB2 LEU A 75 24.277 -30.229 -4.308 1.00 4.10 H new ATOM 0 HB3 LEU A 75 25.346 -28.850 -4.467 1.00 4.10 H new ATOM 0 HG LEU A 75 23.077 -27.662 -5.257 1.00 23.51 H new ATOM 0 HD11 LEU A 75 21.194 -28.463 -3.886 1.00 51.35 H new ATOM 0 HD12 LEU A 75 21.715 -29.686 -5.069 1.00 51.35 H new ATOM 0 HD13 LEU A 75 22.174 -29.851 -3.357 1.00 51.35 H new ATOM 0 HD21 LEU A 75 22.822 -26.869 -2.937 1.00 34.10 H new ATOM 0 HD22 LEU A 75 23.865 -28.196 -2.373 1.00 34.10 H new ATOM 0 HD23 LEU A 75 24.531 -26.928 -3.430 1.00 34.10 H new ATOM 1193 N LEU A 76 22.875 -28.499 -7.705 1.00 3.51 N ATOM 1194 CA LEU A 76 21.594 -28.381 -8.393 1.00 21.13 C ATOM 1195 C LEU A 76 21.406 -29.519 -9.391 1.00 52.10 C ATOM 1196 O LEU A 76 20.280 -29.890 -9.719 1.00 14.20 O ATOM 1197 CB LEU A 76 21.501 -27.035 -9.113 1.00 1.20 C ATOM 1198 CG LEU A 76 20.333 -26.136 -8.707 1.00 53.21 C ATOM 1199 CD1 LEU A 76 20.372 -25.851 -7.214 1.00 32.54 C ATOM 1200 CD2 LEU A 76 20.359 -24.837 -9.500 1.00 35.21 C ATOM 0 H LEU A 76 23.494 -27.697 -7.826 1.00 3.51 H new ATOM 0 HA LEU A 76 20.802 -28.442 -7.647 1.00 21.13 H new ATOM 0 HB2 LEU A 76 22.429 -26.490 -8.943 1.00 1.20 H new ATOM 0 HB3 LEU A 76 21.433 -27.223 -10.185 1.00 1.20 H new ATOM 0 HG LEU A 76 19.403 -26.658 -8.932 1.00 53.21 H new ATOM 0 HD11 LEU A 76 19.533 -25.210 -6.944 1.00 32.54 H new ATOM 0 HD12 LEU A 76 20.304 -26.789 -6.663 1.00 32.54 H new ATOM 0 HD13 LEU A 76 21.307 -25.350 -6.964 1.00 32.54 H new ATOM 0 HD21 LEU A 76 19.520 -24.209 -9.198 1.00 35.21 H new ATOM 0 HD22 LEU A 76 21.294 -24.311 -9.306 1.00 35.21 H new ATOM 0 HD23 LEU A 76 20.281 -25.059 -10.564 1.00 35.21 H new ATOM 1212 N ASN A 77 22.517 -30.070 -9.869 1.00 32.01 N ATOM 1213 CA ASN A 77 22.474 -31.167 -10.829 1.00 21.23 C ATOM 1214 C ASN A 77 22.503 -32.515 -10.115 1.00 72.52 C ATOM 1215 O ASN A 77 22.560 -33.567 -10.753 1.00 33.10 O ATOM 1216 CB ASN A 77 23.651 -31.067 -11.802 1.00 34.33 C ATOM 1217 CG ASN A 77 23.465 -29.961 -12.822 1.00 12.21 C ATOM 1218 OD1 ASN A 77 22.986 -30.198 -13.931 1.00 50.10 O ATOM 1219 ND2 ASN A 77 23.844 -28.744 -12.450 1.00 43.31 N ATOM 0 H ASN A 77 23.458 -29.775 -9.607 1.00 32.01 H new ATOM 0 HA ASN A 77 21.542 -31.092 -11.388 1.00 21.23 H new ATOM 0 HB2 ASN A 77 24.569 -30.890 -11.241 1.00 34.33 H new ATOM 0 HB3 ASN A 77 23.773 -32.018 -12.320 1.00 34.33 H new ATOM 0 HD21 ASN A 77 23.743 -27.959 -13.094 1.00 43.31 H new ATOM 0 HD22 ASN A 77 24.236 -28.594 -11.520 1.00 43.31 H new ATOM 1226 N LYS A 78 22.462 -32.477 -8.788 1.00 25.13 N ATOM 1227 CA LYS A 78 22.482 -33.695 -7.986 1.00 12.44 C ATOM 1228 C LYS A 78 21.101 -33.988 -7.408 1.00 12.40 C ATOM 1229 O LYS A 78 20.780 -35.133 -7.091 1.00 63.34 O ATOM 1230 CB LYS A 78 23.503 -33.568 -6.853 1.00 45.23 C ATOM 1231 CG LYS A 78 24.883 -33.142 -7.324 1.00 64.11 C ATOM 1232 CD LYS A 78 25.560 -34.238 -8.130 1.00 25.24 C ATOM 1233 CE LYS A 78 26.281 -35.228 -7.228 1.00 22.53 C ATOM 1234 NZ LYS A 78 25.387 -36.338 -6.796 1.00 70.44 N ATOM 0 H LYS A 78 22.415 -31.615 -8.244 1.00 25.13 H new ATOM 0 HA LYS A 78 22.769 -34.522 -8.635 1.00 12.44 H new ATOM 0 HB2 LYS A 78 23.137 -32.844 -6.125 1.00 45.23 H new ATOM 0 HB3 LYS A 78 23.583 -34.525 -6.338 1.00 45.23 H new ATOM 0 HG2 LYS A 78 24.799 -32.241 -7.932 1.00 64.11 H new ATOM 0 HG3 LYS A 78 25.500 -32.889 -6.462 1.00 64.11 H new ATOM 0 HD2 LYS A 78 24.816 -34.764 -8.728 1.00 25.24 H new ATOM 0 HD3 LYS A 78 26.271 -33.793 -8.826 1.00 25.24 H new ATOM 0 HE2 LYS A 78 27.142 -35.639 -7.755 1.00 22.53 H new ATOM 0 HE3 LYS A 78 26.664 -34.707 -6.350 1.00 22.53 H new ATOM 0 HZ1 LYS A 78 25.234 -36.281 -5.769 1.00 70.44 H new ATOM 0 HZ2 LYS A 78 24.474 -36.259 -7.287 1.00 70.44 H new ATOM 0 HZ3 LYS A 78 25.828 -37.250 -7.030 1.00 70.44 H new ATOM 1248 N ASP A 79 20.287 -32.946 -7.275 1.00 2.12 N ATOM 1249 CA ASP A 79 18.939 -33.092 -6.738 1.00 23.33 C ATOM 1250 C ASP A 79 18.071 -33.931 -7.670 1.00 52.34 C ATOM 1251 O ASP A 79 17.076 -34.521 -7.246 1.00 64.25 O ATOM 1252 CB ASP A 79 18.301 -31.719 -6.523 1.00 71.02 C ATOM 1253 CG ASP A 79 19.261 -30.725 -5.899 1.00 71.41 C ATOM 1254 OD1 ASP A 79 20.082 -31.143 -5.056 1.00 2.13 O ATOM 1255 OD2 ASP A 79 19.191 -29.531 -6.255 1.00 5.54 O ATOM 0 H ASP A 79 20.537 -31.991 -7.532 1.00 2.12 H new ATOM 0 HA ASP A 79 19.010 -33.604 -5.779 1.00 23.33 H new ATOM 0 HB2 ASP A 79 17.951 -31.330 -7.479 1.00 71.02 H new ATOM 0 HB3 ASP A 79 17.425 -31.825 -5.883 1.00 71.02 H new ATOM 1260 N LEU A 80 18.452 -33.978 -8.942 1.00 52.31 N ATOM 1261 CA LEU A 80 17.707 -34.743 -9.936 1.00 63.11 C ATOM 1262 C LEU A 80 18.468 -36.003 -10.335 1.00 24.42 C ATOM 1263 O LEU A 80 17.929 -36.877 -11.013 1.00 65.23 O ATOM 1264 CB LEU A 80 17.437 -33.884 -11.173 1.00 23.04 C ATOM 1265 CG LEU A 80 18.544 -32.904 -11.564 1.00 61.31 C ATOM 1266 CD1 LEU A 80 19.858 -33.640 -11.775 1.00 62.22 C ATOM 1267 CD2 LEU A 80 18.155 -32.133 -12.817 1.00 63.21 C ATOM 0 H LEU A 80 19.272 -33.496 -9.309 1.00 52.31 H new ATOM 0 HA LEU A 80 16.756 -35.039 -9.492 1.00 63.11 H new ATOM 0 HB2 LEU A 80 17.251 -34.547 -12.018 1.00 23.04 H new ATOM 0 HB3 LEU A 80 16.521 -33.318 -11.005 1.00 23.04 H new ATOM 0 HG LEU A 80 18.677 -32.192 -10.750 1.00 61.31 H new ATOM 0 HD11 LEU A 80 20.634 -32.927 -12.053 1.00 62.22 H new ATOM 0 HD12 LEU A 80 20.144 -34.146 -10.853 1.00 62.22 H new ATOM 0 HD13 LEU A 80 19.739 -34.375 -12.571 1.00 62.22 H new ATOM 0 HD21 LEU A 80 18.954 -31.440 -13.081 1.00 63.21 H new ATOM 0 HD22 LEU A 80 17.994 -32.831 -13.638 1.00 63.21 H new ATOM 0 HD23 LEU A 80 17.238 -31.575 -12.630 1.00 63.21 H new ATOM 1279 N ALA A 81 19.723 -36.091 -9.907 1.00 5.23 N ATOM 1280 CA ALA A 81 20.557 -37.246 -10.215 1.00 61.03 C ATOM 1281 C ALA A 81 19.967 -38.522 -9.625 1.00 70.32 C ATOM 1282 O ALA A 81 20.191 -39.616 -10.142 1.00 31.43 O ATOM 1283 CB ALA A 81 21.972 -37.029 -9.699 1.00 51.24 C ATOM 0 H ALA A 81 20.185 -35.376 -9.345 1.00 5.23 H new ATOM 0 HA ALA A 81 20.591 -37.359 -11.299 1.00 61.03 H new ATOM 0 HB1 ALA A 81 22.583 -37.900 -9.936 1.00 51.24 H new ATOM 0 HB2 ALA A 81 22.400 -36.145 -10.172 1.00 51.24 H new ATOM 0 HB3 ALA A 81 21.947 -36.886 -8.619 1.00 51.24 H new ATOM 1289 N GLU A 82 19.213 -38.374 -8.540 1.00 41.24 N ATOM 1290 CA GLU A 82 18.593 -39.516 -7.880 1.00 34.20 C ATOM 1291 C GLU A 82 17.151 -39.698 -8.347 1.00 43.13 C ATOM 1292 O GLU A 82 16.626 -40.812 -8.358 1.00 52.11 O ATOM 1293 CB GLU A 82 18.629 -39.337 -6.361 1.00 30.02 C ATOM 1294 CG GLU A 82 19.840 -39.976 -5.701 1.00 75.14 C ATOM 1295 CD GLU A 82 19.765 -39.942 -4.187 1.00 71.13 C ATOM 1296 OE1 GLU A 82 18.638 -39.901 -3.650 1.00 61.22 O ATOM 1297 OE2 GLU A 82 20.832 -39.956 -3.540 1.00 24.24 O ATOM 0 H GLU A 82 19.017 -37.475 -8.100 1.00 41.24 H new ATOM 0 HA GLU A 82 19.159 -40.408 -8.147 1.00 34.20 H new ATOM 0 HB2 GLU A 82 18.619 -38.272 -6.129 1.00 30.02 H new ATOM 0 HB3 GLU A 82 17.723 -39.765 -5.932 1.00 30.02 H new ATOM 0 HG2 GLU A 82 19.927 -41.010 -6.034 1.00 75.14 H new ATOM 0 HG3 GLU A 82 20.742 -39.459 -6.028 1.00 75.14 H new ATOM 1304 N LEU A 83 16.517 -38.596 -8.732 1.00 42.11 N ATOM 1305 CA LEU A 83 15.136 -38.632 -9.200 1.00 50.13 C ATOM 1306 C LEU A 83 15.037 -39.334 -10.551 1.00 31.13 C ATOM 1307 O LEU A 83 14.154 -40.165 -10.766 1.00 12.21 O ATOM 1308 CB LEU A 83 14.576 -37.212 -9.309 1.00 23.45 C ATOM 1309 CG LEU A 83 13.336 -37.045 -10.187 1.00 63.04 C ATOM 1310 CD1 LEU A 83 12.255 -38.033 -9.778 1.00 54.50 C ATOM 1311 CD2 LEU A 83 12.815 -35.617 -10.108 1.00 63.44 C ATOM 0 H LEU A 83 16.937 -37.667 -8.729 1.00 42.11 H new ATOM 0 HA LEU A 83 14.547 -39.194 -8.475 1.00 50.13 H new ATOM 0 HB2 LEU A 83 14.336 -36.860 -8.306 1.00 23.45 H new ATOM 0 HB3 LEU A 83 15.361 -36.562 -9.696 1.00 23.45 H new ATOM 0 HG LEU A 83 13.615 -37.252 -11.220 1.00 63.04 H new ATOM 0 HD11 LEU A 83 11.380 -37.899 -10.414 1.00 54.50 H new ATOM 0 HD12 LEU A 83 12.631 -39.050 -9.888 1.00 54.50 H new ATOM 0 HD13 LEU A 83 11.978 -37.859 -8.738 1.00 54.50 H new ATOM 0 HD21 LEU A 83 11.932 -35.516 -10.739 1.00 63.44 H new ATOM 0 HD22 LEU A 83 12.552 -35.382 -9.077 1.00 63.44 H new ATOM 0 HD23 LEU A 83 13.587 -34.928 -10.452 1.00 63.44 H new ATOM 1323 N ILE A 84 15.949 -38.996 -11.456 1.00 23.43 N ATOM 1324 CA ILE A 84 15.966 -39.597 -12.784 1.00 23.14 C ATOM 1325 C ILE A 84 16.277 -41.088 -12.709 1.00 20.15 C ATOM 1326 O ILE A 84 15.765 -41.880 -13.499 1.00 11.32 O ATOM 1327 CB ILE A 84 17.001 -38.914 -13.697 1.00 51.04 C ATOM 1328 CG1 ILE A 84 16.666 -37.430 -13.864 1.00 74.51 C ATOM 1329 CG2 ILE A 84 17.051 -39.607 -15.051 1.00 2.40 C ATOM 1330 CD1 ILE A 84 17.885 -36.550 -14.028 1.00 73.21 C ATOM 0 H ILE A 84 16.686 -38.309 -11.294 1.00 23.43 H new ATOM 0 HA ILE A 84 14.971 -39.457 -13.207 1.00 23.14 H new ATOM 0 HB ILE A 84 17.984 -38.995 -13.232 1.00 51.04 H new ATOM 0 HG12 ILE A 84 16.020 -37.307 -14.733 1.00 74.51 H new ATOM 0 HG13 ILE A 84 16.099 -37.094 -12.996 1.00 74.51 H new ATOM 0 HG21 ILE A 84 17.787 -39.113 -15.686 1.00 2.40 H new ATOM 0 HG22 ILE A 84 17.332 -40.651 -14.915 1.00 2.40 H new ATOM 0 HG23 ILE A 84 16.070 -39.553 -15.524 1.00 2.40 H new ATOM 0 HD11 ILE A 84 17.572 -35.512 -14.141 1.00 73.21 H new ATOM 0 HD12 ILE A 84 18.522 -36.643 -13.148 1.00 73.21 H new ATOM 0 HD13 ILE A 84 18.441 -36.860 -14.913 1.00 73.21 H new ATOM 1342 N ASN A 85 17.119 -41.464 -11.751 1.00 74.10 N ATOM 1343 CA ASN A 85 17.497 -42.861 -11.571 1.00 70.12 C ATOM 1344 C ASN A 85 16.295 -43.700 -11.147 1.00 4.25 C ATOM 1345 O ASN A 85 15.957 -44.692 -11.792 1.00 24.41 O ATOM 1346 CB ASN A 85 18.610 -42.979 -10.528 1.00 70.51 C ATOM 1347 CG ASN A 85 19.985 -42.732 -11.119 1.00 33.42 C ATOM 1348 OD1 ASN A 85 20.933 -43.467 -10.842 1.00 73.51 O ATOM 1349 ND2 ASN A 85 20.099 -41.693 -11.937 1.00 54.04 N ATOM 0 H ASN A 85 17.552 -40.821 -11.088 1.00 74.10 H new ATOM 0 HA ASN A 85 17.862 -43.239 -12.526 1.00 70.12 H new ATOM 0 HB2 ASN A 85 18.429 -42.264 -9.725 1.00 70.51 H new ATOM 0 HB3 ASN A 85 18.582 -43.973 -10.082 1.00 70.51 H new ATOM 0 HD21 ASN A 85 21.000 -41.477 -12.364 1.00 54.04 H new ATOM 0 HD22 ASN A 85 19.286 -41.111 -12.138 1.00 54.04 H new ATOM 1356 N LYS A 86 15.653 -43.294 -10.057 1.00 11.43 N ATOM 1357 CA LYS A 86 14.487 -44.005 -9.545 1.00 64.02 C ATOM 1358 C LYS A 86 13.300 -43.855 -10.491 1.00 63.52 C ATOM 1359 O LYS A 86 12.323 -44.598 -10.398 1.00 2.21 O ATOM 1360 CB LYS A 86 14.115 -43.483 -8.156 1.00 12.13 C ATOM 1361 CG LYS A 86 13.138 -44.377 -7.412 1.00 23.23 C ATOM 1362 CD LYS A 86 13.787 -45.687 -6.996 1.00 0.21 C ATOM 1363 CE LYS A 86 14.905 -45.460 -5.990 1.00 64.22 C ATOM 1364 NZ LYS A 86 15.346 -46.733 -5.355 1.00 45.11 N ATOM 0 H LYS A 86 15.921 -42.475 -9.510 1.00 11.43 H new ATOM 0 HA LYS A 86 14.740 -45.063 -9.473 1.00 64.02 H new ATOM 0 HB2 LYS A 86 15.023 -43.377 -7.562 1.00 12.13 H new ATOM 0 HB3 LYS A 86 13.681 -42.488 -8.255 1.00 12.13 H new ATOM 0 HG2 LYS A 86 12.767 -43.857 -6.529 1.00 23.23 H new ATOM 0 HG3 LYS A 86 12.276 -44.582 -8.046 1.00 23.23 H new ATOM 0 HD2 LYS A 86 13.034 -46.346 -6.563 1.00 0.21 H new ATOM 0 HD3 LYS A 86 14.185 -46.193 -7.876 1.00 0.21 H new ATOM 0 HE2 LYS A 86 15.753 -44.990 -6.489 1.00 64.22 H new ATOM 0 HE3 LYS A 86 14.565 -44.768 -5.219 1.00 64.22 H new ATOM 0 HZ1 LYS A 86 16.109 -46.536 -4.676 1.00 45.11 H new ATOM 0 HZ2 LYS A 86 14.544 -47.169 -4.857 1.00 45.11 H new ATOM 0 HZ3 LYS A 86 15.694 -47.384 -6.088 1.00 45.11 H new ATOM 1378 N MET A 87 13.393 -42.892 -11.402 1.00 71.10 N ATOM 1379 CA MET A 87 12.327 -42.648 -12.367 1.00 31.02 C ATOM 1380 C MET A 87 12.238 -43.786 -13.378 1.00 71.42 C ATOM 1381 O MET A 87 11.262 -44.536 -13.398 1.00 71.41 O ATOM 1382 CB MET A 87 12.561 -41.322 -13.093 1.00 61.01 C ATOM 1383 CG MET A 87 11.518 -41.019 -14.156 1.00 53.12 C ATOM 1384 SD MET A 87 9.970 -40.413 -13.457 1.00 41.54 S ATOM 1385 CE MET A 87 9.125 -41.955 -13.118 1.00 12.34 C ATOM 0 H MET A 87 14.195 -42.268 -11.492 1.00 71.10 H new ATOM 0 HA MET A 87 11.384 -42.595 -11.823 1.00 31.02 H new ATOM 0 HB2 MET A 87 12.568 -40.513 -12.362 1.00 61.01 H new ATOM 0 HB3 MET A 87 13.547 -41.341 -13.558 1.00 61.01 H new ATOM 0 HG2 MET A 87 11.915 -40.276 -14.848 1.00 53.12 H new ATOM 0 HG3 MET A 87 11.322 -41.921 -14.735 1.00 53.12 H new ATOM 0 HE1 MET A 87 8.060 -41.839 -13.321 1.00 12.34 H new ATOM 0 HE2 MET A 87 9.532 -42.740 -13.755 1.00 12.34 H new ATOM 0 HE3 MET A 87 9.268 -42.226 -12.072 1.00 12.34 H new ATOM 1395 N ARG A 88 13.262 -43.909 -14.216 1.00 41.02 N ATOM 1396 CA ARG A 88 13.298 -44.955 -15.231 1.00 70.10 C ATOM 1397 C ARG A 88 13.192 -46.337 -14.592 1.00 14.52 C ATOM 1398 O ARG A 88 12.802 -47.306 -15.244 1.00 61.02 O ATOM 1399 CB ARG A 88 14.587 -44.858 -16.049 1.00 40.30 C ATOM 1400 CG ARG A 88 15.849 -44.870 -15.201 1.00 54.14 C ATOM 1401 CD ARG A 88 17.100 -44.912 -16.065 1.00 14.31 C ATOM 1402 NE ARG A 88 18.213 -45.567 -15.384 1.00 71.32 N ATOM 1403 CZ ARG A 88 18.337 -46.886 -15.280 1.00 15.25 C ATOM 1404 NH1 ARG A 88 17.421 -47.685 -15.809 1.00 14.11 N ATOM 1405 NH2 ARG A 88 19.378 -47.407 -14.645 1.00 25.43 N ATOM 0 H ARG A 88 14.078 -43.297 -14.212 1.00 41.02 H new ATOM 0 HA ARG A 88 12.444 -44.813 -15.893 1.00 70.10 H new ATOM 0 HB2 ARG A 88 14.624 -45.690 -16.753 1.00 40.30 H new ATOM 0 HB3 ARG A 88 14.565 -43.942 -16.639 1.00 40.30 H new ATOM 0 HG2 ARG A 88 15.872 -43.983 -14.568 1.00 54.14 H new ATOM 0 HG3 ARG A 88 15.835 -45.735 -14.537 1.00 54.14 H new ATOM 0 HD2 ARG A 88 16.882 -45.440 -16.993 1.00 14.31 H new ATOM 0 HD3 ARG A 88 17.388 -43.896 -16.336 1.00 14.31 H new ATOM 0 HE ARG A 88 18.935 -44.980 -14.965 1.00 71.32 H new ATOM 0 HH11 ARG A 88 16.618 -47.288 -16.297 1.00 14.11 H new ATOM 0 HH12 ARG A 88 17.519 -48.697 -15.728 1.00 14.11 H new ATOM 0 HH21 ARG A 88 20.084 -46.795 -14.236 1.00 25.43 H new ATOM 0 HH22 ARG A 88 19.472 -48.420 -14.566 1.00 25.43 H new ATOM 1419 N LEU A 89 13.541 -46.419 -13.313 1.00 31.22 N ATOM 1420 CA LEU A 89 13.485 -47.682 -12.585 1.00 24.14 C ATOM 1421 C LEU A 89 12.128 -47.865 -11.914 1.00 12.54 C ATOM 1422 O LEU A 89 11.762 -48.972 -11.521 1.00 61.13 O ATOM 1423 CB LEU A 89 14.597 -47.738 -11.535 1.00 42.25 C ATOM 1424 CG LEU A 89 14.454 -48.818 -10.463 1.00 2.13 C ATOM 1425 CD1 LEU A 89 14.563 -50.203 -11.082 1.00 13.23 C ATOM 1426 CD2 LEU A 89 15.504 -48.633 -9.377 1.00 21.42 C ATOM 0 H LEU A 89 13.866 -45.627 -12.759 1.00 31.22 H new ATOM 0 HA LEU A 89 13.628 -48.492 -13.301 1.00 24.14 H new ATOM 0 HB2 LEU A 89 15.547 -47.888 -12.048 1.00 42.25 H new ATOM 0 HB3 LEU A 89 14.651 -46.768 -11.040 1.00 42.25 H new ATOM 0 HG LEU A 89 13.468 -48.723 -10.008 1.00 2.13 H new ATOM 0 HD11 LEU A 89 14.459 -50.959 -10.303 1.00 13.23 H new ATOM 0 HD12 LEU A 89 13.774 -50.334 -11.823 1.00 13.23 H new ATOM 0 HD13 LEU A 89 15.535 -50.311 -11.564 1.00 13.23 H new ATOM 0 HD21 LEU A 89 15.387 -49.411 -8.622 1.00 21.42 H new ATOM 0 HD22 LEU A 89 16.499 -48.701 -9.817 1.00 21.42 H new ATOM 0 HD23 LEU A 89 15.379 -47.655 -8.913 1.00 21.42 H new ATOM 1438 N ALA A 90 11.384 -46.770 -11.787 1.00 61.32 N ATOM 1439 CA ALA A 90 10.065 -46.810 -11.168 1.00 22.41 C ATOM 1440 C ALA A 90 9.062 -47.533 -12.060 1.00 34.20 C ATOM 1441 O ALA A 90 8.172 -48.229 -11.571 1.00 23.21 O ATOM 1442 CB ALA A 90 9.583 -45.400 -10.862 1.00 73.22 C ATOM 0 H ALA A 90 11.673 -45.845 -12.105 1.00 61.32 H new ATOM 0 HA ALA A 90 10.146 -47.365 -10.233 1.00 22.41 H new ATOM 0 HB1 ALA A 90 8.597 -45.445 -10.400 1.00 73.22 H new ATOM 0 HB2 ALA A 90 10.282 -44.917 -10.179 1.00 73.22 H new ATOM 0 HB3 ALA A 90 9.525 -44.827 -11.787 1.00 73.22 H new ATOM 1448 N GLN A 91 9.211 -47.363 -13.370 1.00 14.54 N ATOM 1449 CA GLN A 91 8.315 -47.998 -14.329 1.00 64.30 C ATOM 1450 C GLN A 91 8.902 -49.312 -14.833 1.00 64.43 C ATOM 1451 O GLN A 91 8.570 -49.772 -15.925 1.00 61.24 O ATOM 1452 CB GLN A 91 8.047 -47.060 -15.507 1.00 62.43 C ATOM 1453 CG GLN A 91 9.189 -47.000 -16.509 1.00 60.11 C ATOM 1454 CD GLN A 91 9.300 -45.649 -17.187 1.00 0.31 C ATOM 1455 OE1 GLN A 91 9.009 -45.512 -18.375 1.00 55.54 O ATOM 1456 NE2 GLN A 91 9.723 -44.641 -16.433 1.00 1.12 N ATOM 0 H GLN A 91 9.943 -46.791 -13.791 1.00 14.54 H new ATOM 0 HA GLN A 91 7.373 -48.212 -13.823 1.00 64.30 H new ATOM 0 HB2 GLN A 91 7.141 -47.384 -16.020 1.00 62.43 H new ATOM 0 HB3 GLN A 91 7.856 -46.057 -15.126 1.00 62.43 H new ATOM 0 HG2 GLN A 91 10.126 -47.225 -16.000 1.00 60.11 H new ATOM 0 HG3 GLN A 91 9.044 -47.771 -17.266 1.00 60.11 H new ATOM 0 HE21 GLN A 91 9.953 -44.800 -15.452 1.00 1.12 H new ATOM 0 HE22 GLN A 91 9.817 -43.708 -16.835 1.00 1.12 H new ATOM 1465 N GLN A 92 9.776 -49.911 -14.031 1.00 25.03 N ATOM 1466 CA GLN A 92 10.410 -51.172 -14.397 1.00 63.02 C ATOM 1467 C GLN A 92 9.366 -52.257 -14.635 1.00 34.40 C ATOM 1468 O GLN A 92 8.296 -52.246 -14.028 1.00 31.55 O ATOM 1469 CB GLN A 92 11.383 -51.615 -13.303 1.00 42.01 C ATOM 1470 CG GLN A 92 10.702 -51.980 -11.994 1.00 53.12 C ATOM 1471 CD GLN A 92 11.226 -53.274 -11.404 1.00 61.22 C ATOM 1472 OE1 GLN A 92 10.462 -54.087 -10.884 1.00 32.41 O ATOM 1473 NE2 GLN A 92 12.537 -53.472 -11.482 1.00 72.54 N ATOM 0 H GLN A 92 10.061 -49.543 -13.123 1.00 25.03 H new ATOM 0 HA GLN A 92 10.963 -51.016 -15.323 1.00 63.02 H new ATOM 0 HB2 GLN A 92 11.951 -52.475 -13.660 1.00 42.01 H new ATOM 0 HB3 GLN A 92 12.099 -50.814 -13.119 1.00 42.01 H new ATOM 0 HG2 GLN A 92 10.847 -51.173 -11.276 1.00 53.12 H new ATOM 0 HG3 GLN A 92 9.628 -52.069 -12.160 1.00 53.12 H new ATOM 0 HE21 GLN A 92 13.133 -52.771 -11.922 1.00 72.54 H new ATOM 0 HE22 GLN A 92 12.947 -54.325 -11.102 1.00 72.54 H new ATOM 1482 N ASN A 93 9.684 -53.193 -15.523 1.00 74.44 N ATOM 1483 CA ASN A 93 8.772 -54.286 -15.842 1.00 54.24 C ATOM 1484 C ASN A 93 9.181 -55.565 -15.119 1.00 31.04 C ATOM 1485 O ASN A 93 9.811 -56.446 -15.702 1.00 44.13 O ATOM 1486 CB ASN A 93 8.742 -54.528 -17.353 1.00 34.43 C ATOM 1487 CG ASN A 93 8.625 -53.239 -18.143 1.00 72.51 C ATOM 1488 OD1 ASN A 93 9.575 -52.812 -18.799 1.00 72.43 O ATOM 1489 ND2 ASN A 93 7.455 -52.613 -18.083 1.00 45.13 N ATOM 0 H ASN A 93 10.566 -53.217 -16.035 1.00 74.44 H new ATOM 0 HA ASN A 93 7.774 -54.003 -15.506 1.00 54.24 H new ATOM 0 HB2 ASN A 93 9.649 -55.053 -17.652 1.00 34.43 H new ATOM 0 HB3 ASN A 93 7.902 -55.178 -17.597 1.00 34.43 H new ATOM 0 HD21 ASN A 93 7.316 -51.741 -18.594 1.00 45.13 H new ATOM 0 HD22 ASN A 93 6.695 -53.004 -17.526 1.00 45.13 H new ATOM 1496 N ALA A 94 8.817 -55.659 -13.844 1.00 31.41 N ATOM 1497 CA ALA A 94 9.144 -56.831 -13.041 1.00 35.30 C ATOM 1498 C ALA A 94 8.024 -57.152 -12.056 1.00 41.53 C ATOM 1499 O ALA A 94 7.316 -56.257 -11.593 1.00 63.01 O ATOM 1500 CB ALA A 94 10.455 -56.615 -12.300 1.00 52.22 C ATOM 0 H ALA A 94 8.296 -54.938 -13.345 1.00 31.41 H new ATOM 0 HA ALA A 94 9.256 -57.681 -13.714 1.00 35.30 H new ATOM 0 HB1 ALA A 94 10.686 -57.498 -11.705 1.00 52.22 H new ATOM 0 HB2 ALA A 94 11.255 -56.443 -13.019 1.00 52.22 H new ATOM 0 HB3 ALA A 94 10.364 -55.749 -11.644 1.00 52.22 H new ATOM 1506 N VAL A 95 7.869 -58.433 -11.741 1.00 35.45 N ATOM 1507 CA VAL A 95 6.835 -58.872 -10.810 1.00 50.42 C ATOM 1508 C VAL A 95 7.132 -58.394 -9.393 1.00 44.34 C ATOM 1509 O VAL A 95 6.233 -58.294 -8.558 1.00 3.43 O ATOM 1510 CB VAL A 95 6.699 -60.406 -10.805 1.00 14.22 C ATOM 1511 CG1 VAL A 95 5.510 -60.833 -9.957 1.00 61.42 C ATOM 1512 CG2 VAL A 95 6.568 -60.934 -12.225 1.00 42.35 C ATOM 0 H VAL A 95 8.446 -59.186 -12.116 1.00 35.45 H new ATOM 0 HA VAL A 95 5.897 -58.433 -11.149 1.00 50.42 H new ATOM 0 HB VAL A 95 7.601 -60.832 -10.366 1.00 14.22 H new ATOM 0 HG11 VAL A 95 5.429 -61.920 -9.965 1.00 61.42 H new ATOM 0 HG12 VAL A 95 5.650 -60.487 -8.933 1.00 61.42 H new ATOM 0 HG13 VAL A 95 4.597 -60.398 -10.365 1.00 61.42 H new ATOM 0 HG21 VAL A 95 6.473 -62.020 -12.202 1.00 42.35 H new ATOM 0 HG22 VAL A 95 5.684 -60.502 -12.694 1.00 42.35 H new ATOM 0 HG23 VAL A 95 7.453 -60.659 -12.798 1.00 42.35 H new ATOM 1522 N THR A 96 8.401 -58.099 -9.128 1.00 43.43 N ATOM 1523 CA THR A 96 8.819 -57.632 -7.812 1.00 54.43 C ATOM 1524 C THR A 96 7.963 -56.458 -7.348 1.00 71.45 C ATOM 1525 O THR A 96 7.693 -55.534 -8.115 1.00 15.22 O ATOM 1526 CB THR A 96 10.299 -57.205 -7.811 1.00 13.02 C ATOM 1527 OG1 THR A 96 10.728 -56.929 -6.473 1.00 34.02 O ATOM 1528 CG2 THR A 96 10.508 -55.974 -8.680 1.00 31.11 C ATOM 0 H THR A 96 9.157 -58.175 -9.808 1.00 43.43 H new ATOM 0 HA THR A 96 8.689 -58.468 -7.124 1.00 54.43 H new ATOM 0 HB THR A 96 10.891 -58.024 -8.220 1.00 13.02 H new ATOM 0 HG1 THR A 96 11.670 -56.660 -6.481 1.00 34.02 H new ATOM 0 HG21 THR A 96 11.561 -55.691 -8.664 1.00 31.11 H new ATOM 0 HG22 THR A 96 10.208 -56.196 -9.704 1.00 31.11 H new ATOM 0 HG23 THR A 96 9.905 -55.151 -8.296 1.00 31.11 H new ATOM 1536 N SER A 97 7.540 -56.502 -6.089 1.00 52.12 N ATOM 1537 CA SER A 97 6.712 -55.443 -5.524 1.00 74.10 C ATOM 1538 C SER A 97 7.556 -54.221 -5.174 1.00 72.41 C ATOM 1539 O SER A 97 7.030 -53.127 -4.967 1.00 34.12 O ATOM 1540 CB SER A 97 5.983 -55.947 -4.277 1.00 75.52 C ATOM 1541 OG SER A 97 5.633 -54.873 -3.422 1.00 35.44 O ATOM 0 H SER A 97 7.757 -57.259 -5.441 1.00 52.12 H new ATOM 0 HA SER A 97 5.976 -55.152 -6.274 1.00 74.10 H new ATOM 0 HB2 SER A 97 5.084 -56.489 -4.571 1.00 75.52 H new ATOM 0 HB3 SER A 97 6.619 -56.651 -3.740 1.00 75.52 H new ATOM 0 HG SER A 97 5.167 -55.221 -2.633 1.00 35.44 H new ATOM 1547 N LEU A 98 8.868 -54.416 -5.110 1.00 3.01 N ATOM 1548 CA LEU A 98 9.788 -53.331 -4.785 1.00 54.11 C ATOM 1549 C LEU A 98 9.542 -52.122 -5.682 1.00 62.15 C ATOM 1550 O LEU A 98 9.772 -50.981 -5.281 1.00 20.51 O ATOM 1551 CB LEU A 98 11.236 -53.802 -4.930 1.00 34.31 C ATOM 1552 CG LEU A 98 12.273 -53.050 -4.096 1.00 42.43 C ATOM 1553 CD1 LEU A 98 13.536 -53.882 -3.937 1.00 51.02 C ATOM 1554 CD2 LEU A 98 12.595 -51.705 -4.733 1.00 20.25 C ATOM 0 H LEU A 98 9.319 -55.315 -5.279 1.00 3.01 H new ATOM 0 HA LEU A 98 9.611 -53.035 -3.751 1.00 54.11 H new ATOM 0 HB2 LEU A 98 11.282 -54.858 -4.664 1.00 34.31 H new ATOM 0 HB3 LEU A 98 11.519 -53.725 -5.980 1.00 34.31 H new ATOM 0 HG LEU A 98 11.854 -52.871 -3.106 1.00 42.43 H new ATOM 0 HD11 LEU A 98 14.263 -53.330 -3.341 1.00 51.02 H new ATOM 0 HD12 LEU A 98 13.293 -54.820 -3.437 1.00 51.02 H new ATOM 0 HD13 LEU A 98 13.959 -54.093 -4.919 1.00 51.02 H new ATOM 0 HD21 LEU A 98 13.335 -51.183 -4.126 1.00 20.25 H new ATOM 0 HD22 LEU A 98 12.994 -51.863 -5.735 1.00 20.25 H new ATOM 0 HD23 LEU A 98 11.687 -51.105 -4.794 1.00 20.25 H new ATOM 1566 N SER A 99 9.072 -52.380 -6.899 1.00 31.24 N ATOM 1567 CA SER A 99 8.796 -51.314 -7.854 1.00 3.51 C ATOM 1568 C SER A 99 7.909 -50.241 -7.230 1.00 34.24 C ATOM 1569 O SER A 99 7.992 -49.067 -7.587 1.00 2.31 O ATOM 1570 CB SER A 99 8.125 -51.882 -9.106 1.00 2.03 C ATOM 1571 OG SER A 99 7.700 -50.844 -9.972 1.00 62.43 O ATOM 0 H SER A 99 8.875 -53.319 -7.246 1.00 31.24 H new ATOM 0 HA SER A 99 9.745 -50.858 -8.135 1.00 3.51 H new ATOM 0 HB2 SER A 99 8.822 -52.536 -9.631 1.00 2.03 H new ATOM 0 HB3 SER A 99 7.270 -52.493 -8.818 1.00 2.03 H new ATOM 0 HG SER A 99 7.276 -51.233 -10.765 1.00 62.43 H new ATOM 1577 N GLU A 100 7.059 -50.656 -6.295 1.00 11.40 N ATOM 1578 CA GLU A 100 6.155 -49.731 -5.621 1.00 52.24 C ATOM 1579 C GLU A 100 6.923 -48.807 -4.681 1.00 42.30 C ATOM 1580 O GLU A 100 6.620 -47.619 -4.578 1.00 11.31 O ATOM 1581 CB GLU A 100 5.090 -50.503 -4.839 1.00 5.44 C ATOM 1582 CG GLU A 100 4.018 -51.123 -5.718 1.00 41.24 C ATOM 1583 CD GLU A 100 3.143 -50.084 -6.392 1.00 10.42 C ATOM 1584 OE1 GLU A 100 3.226 -48.899 -6.006 1.00 1.33 O ATOM 1585 OE2 GLU A 100 2.375 -50.455 -7.304 1.00 43.40 O ATOM 0 H GLU A 100 6.978 -51.625 -5.988 1.00 11.40 H new ATOM 0 HA GLU A 100 5.666 -49.122 -6.381 1.00 52.24 H new ATOM 0 HB2 GLU A 100 5.575 -51.291 -4.262 1.00 5.44 H new ATOM 0 HB3 GLU A 100 4.617 -49.830 -4.124 1.00 5.44 H new ATOM 0 HG2 GLU A 100 4.491 -51.743 -6.479 1.00 41.24 H new ATOM 0 HG3 GLU A 100 3.394 -51.781 -5.114 1.00 41.24 H new ATOM 1592 N GLU A 101 7.919 -49.362 -3.997 1.00 73.43 N ATOM 1593 CA GLU A 101 8.729 -48.588 -3.065 1.00 23.54 C ATOM 1594 C GLU A 101 9.406 -47.419 -3.773 1.00 44.31 C ATOM 1595 O GLU A 101 9.714 -46.400 -3.156 1.00 4.32 O ATOM 1596 CB GLU A 101 9.785 -49.482 -2.409 1.00 15.43 C ATOM 1597 CG GLU A 101 10.804 -48.714 -1.583 1.00 73.15 C ATOM 1598 CD GLU A 101 11.720 -49.627 -0.792 1.00 61.01 C ATOM 1599 OE1 GLU A 101 11.502 -50.856 -0.822 1.00 72.40 O ATOM 1600 OE2 GLU A 101 12.655 -49.113 -0.143 1.00 14.20 O ATOM 0 H GLU A 101 8.184 -50.344 -4.071 1.00 73.43 H new ATOM 0 HA GLU A 101 8.069 -48.190 -2.294 1.00 23.54 H new ATOM 0 HB2 GLU A 101 9.286 -50.210 -1.770 1.00 15.43 H new ATOM 0 HB3 GLU A 101 10.307 -50.043 -3.184 1.00 15.43 H new ATOM 0 HG2 GLU A 101 11.403 -48.087 -2.243 1.00 73.15 H new ATOM 0 HG3 GLU A 101 10.282 -48.047 -0.897 1.00 73.15 H new ATOM 1607 N ALA A 102 9.635 -47.574 -5.073 1.00 24.41 N ATOM 1608 CA ALA A 102 10.274 -46.532 -5.866 1.00 43.32 C ATOM 1609 C ALA A 102 9.369 -45.312 -6.000 1.00 45.41 C ATOM 1610 O ALA A 102 9.842 -44.197 -6.223 1.00 12.43 O ATOM 1611 CB ALA A 102 10.647 -47.068 -7.240 1.00 63.04 C ATOM 0 H ALA A 102 9.387 -48.412 -5.599 1.00 24.41 H new ATOM 0 HA ALA A 102 11.183 -46.223 -5.350 1.00 43.32 H new ATOM 0 HB1 ALA A 102 11.123 -46.279 -7.821 1.00 63.04 H new ATOM 0 HB2 ALA A 102 11.337 -47.904 -7.129 1.00 63.04 H new ATOM 0 HB3 ALA A 102 9.748 -47.406 -7.755 1.00 63.04 H new ATOM 1617 N LYS A 103 8.066 -45.530 -5.864 1.00 11.20 N ATOM 1618 CA LYS A 103 7.094 -44.448 -5.969 1.00 75.41 C ATOM 1619 C LYS A 103 7.415 -43.330 -4.983 1.00 40.10 C ATOM 1620 O LYS A 103 7.642 -42.187 -5.379 1.00 54.43 O ATOM 1621 CB LYS A 103 5.681 -44.978 -5.713 1.00 31.44 C ATOM 1622 CG LYS A 103 4.612 -44.288 -6.542 1.00 43.13 C ATOM 1623 CD LYS A 103 3.248 -44.925 -6.337 1.00 24.31 C ATOM 1624 CE LYS A 103 2.547 -44.359 -5.112 1.00 41.50 C ATOM 1625 NZ LYS A 103 1.185 -44.934 -4.937 1.00 54.32 N ATOM 0 H LYS A 103 7.658 -46.447 -5.681 1.00 11.20 H new ATOM 0 HA LYS A 103 7.147 -44.043 -6.980 1.00 75.41 H new ATOM 0 HB2 LYS A 103 5.659 -46.047 -5.925 1.00 31.44 H new ATOM 0 HB3 LYS A 103 5.443 -44.858 -4.656 1.00 31.44 H new ATOM 0 HG2 LYS A 103 4.566 -43.233 -6.272 1.00 43.13 H new ATOM 0 HG3 LYS A 103 4.882 -44.336 -7.597 1.00 43.13 H new ATOM 0 HD2 LYS A 103 2.631 -44.758 -7.220 1.00 24.31 H new ATOM 0 HD3 LYS A 103 3.362 -46.003 -6.227 1.00 24.31 H new ATOM 0 HE2 LYS A 103 3.145 -44.565 -4.224 1.00 41.50 H new ATOM 0 HE3 LYS A 103 2.475 -43.275 -5.203 1.00 41.50 H new ATOM 0 HZ1 LYS A 103 0.741 -44.523 -4.091 1.00 54.32 H new ATOM 0 HZ2 LYS A 103 0.606 -44.716 -5.773 1.00 54.32 H new ATOM 0 HZ3 LYS A 103 1.256 -45.965 -4.824 1.00 54.32 H new ATOM 1639 N ARG A 104 7.434 -43.668 -3.698 1.00 5.32 N ATOM 1640 CA ARG A 104 7.729 -42.692 -2.656 1.00 12.43 C ATOM 1641 C ARG A 104 9.200 -42.287 -2.689 1.00 73.04 C ATOM 1642 O ARG A 104 9.549 -41.156 -2.354 1.00 42.44 O ATOM 1643 CB ARG A 104 7.377 -43.261 -1.280 1.00 53.30 C ATOM 1644 CG ARG A 104 8.280 -44.403 -0.844 1.00 40.21 C ATOM 1645 CD ARG A 104 7.977 -44.840 0.581 1.00 43.33 C ATOM 1646 NE ARG A 104 6.549 -45.059 0.794 1.00 24.22 N ATOM 1647 CZ ARG A 104 6.012 -45.293 1.986 1.00 30.32 C ATOM 1648 NH1 ARG A 104 6.780 -45.338 3.066 1.00 11.41 N ATOM 1649 NH2 ARG A 104 4.704 -45.483 2.100 1.00 74.22 N ATOM 0 H ARG A 104 7.249 -44.610 -3.354 1.00 5.32 H new ATOM 0 HA ARG A 104 7.122 -41.806 -2.842 1.00 12.43 H new ATOM 0 HB2 ARG A 104 7.433 -42.462 -0.541 1.00 53.30 H new ATOM 0 HB3 ARG A 104 6.345 -43.610 -1.294 1.00 53.30 H new ATOM 0 HG2 ARG A 104 8.152 -45.248 -1.520 1.00 40.21 H new ATOM 0 HG3 ARG A 104 9.322 -44.092 -0.917 1.00 40.21 H new ATOM 0 HD2 ARG A 104 8.522 -45.758 0.802 1.00 43.33 H new ATOM 0 HD3 ARG A 104 8.335 -44.081 1.277 1.00 43.33 H new ATOM 0 HE ARG A 104 5.930 -45.031 -0.017 1.00 24.22 H new ATOM 0 HH11 ARG A 104 7.786 -45.193 2.983 1.00 11.41 H new ATOM 0 HH12 ARG A 104 6.365 -45.518 3.980 1.00 11.41 H new ATOM 0 HH21 ARG A 104 4.110 -45.449 1.272 1.00 74.22 H new ATOM 0 HH22 ARG A 104 4.293 -45.663 3.016 1.00 74.22 H new ATOM 1663 N GLN A 105 10.055 -43.219 -3.095 1.00 64.53 N ATOM 1664 CA GLN A 105 11.488 -42.960 -3.171 1.00 42.32 C ATOM 1665 C GLN A 105 11.819 -42.080 -4.372 1.00 50.31 C ATOM 1666 O GLN A 105 12.956 -41.638 -4.536 1.00 30.34 O ATOM 1667 CB GLN A 105 12.263 -44.276 -3.260 1.00 15.13 C ATOM 1668 CG GLN A 105 12.324 -45.035 -1.944 1.00 62.22 C ATOM 1669 CD GLN A 105 12.834 -44.181 -0.801 1.00 11.55 C ATOM 1670 OE1 GLN A 105 14.008 -43.812 -0.761 1.00 50.43 O ATOM 1671 NE2 GLN A 105 11.951 -43.861 0.139 1.00 43.53 N ATOM 0 H GLN A 105 9.781 -44.160 -3.376 1.00 64.53 H new ATOM 0 HA GLN A 105 11.784 -42.433 -2.264 1.00 42.32 H new ATOM 0 HB2 GLN A 105 11.800 -44.911 -4.015 1.00 15.13 H new ATOM 0 HB3 GLN A 105 13.278 -44.068 -3.598 1.00 15.13 H new ATOM 0 HG2 GLN A 105 11.330 -45.408 -1.698 1.00 62.22 H new ATOM 0 HG3 GLN A 105 12.971 -45.904 -2.060 1.00 62.22 H new ATOM 0 HE21 GLN A 105 10.988 -44.188 0.066 1.00 43.53 H new ATOM 0 HE22 GLN A 105 12.237 -43.288 0.933 1.00 43.53 H new ATOM 1680 N MET A 106 10.818 -41.829 -5.210 1.00 31.24 N ATOM 1681 CA MET A 106 11.003 -41.001 -6.395 1.00 42.14 C ATOM 1682 C MET A 106 10.639 -39.548 -6.106 1.00 74.22 C ATOM 1683 O MET A 106 11.429 -38.637 -6.358 1.00 33.32 O ATOM 1684 CB MET A 106 10.154 -41.531 -7.552 1.00 60.51 C ATOM 1685 CG MET A 106 10.320 -40.742 -8.840 1.00 43.32 C ATOM 1686 SD MET A 106 8.766 -40.526 -9.728 1.00 50.22 S ATOM 1687 CE MET A 106 8.080 -42.177 -9.616 1.00 11.50 C ATOM 0 H MET A 106 9.871 -42.187 -5.090 1.00 31.24 H new ATOM 0 HA MET A 106 12.055 -41.044 -6.676 1.00 42.14 H new ATOM 0 HB2 MET A 106 10.417 -42.572 -7.737 1.00 60.51 H new ATOM 0 HB3 MET A 106 9.104 -41.515 -7.259 1.00 60.51 H new ATOM 0 HG2 MET A 106 10.742 -39.763 -8.610 1.00 43.32 H new ATOM 0 HG3 MET A 106 11.034 -41.253 -9.485 1.00 43.32 H new ATOM 0 HE1 MET A 106 7.445 -42.366 -10.481 1.00 11.50 H new ATOM 0 HE2 MET A 106 8.889 -42.907 -9.594 1.00 11.50 H new ATOM 0 HE3 MET A 106 7.488 -42.264 -8.705 1.00 11.50 H new ATOM 1697 N LEU A 107 9.438 -39.338 -5.577 1.00 64.40 N ATOM 1698 CA LEU A 107 8.969 -37.996 -5.254 1.00 11.53 C ATOM 1699 C LEU A 107 9.857 -37.348 -4.196 1.00 44.14 C ATOM 1700 O LEU A 107 9.930 -36.123 -4.095 1.00 53.35 O ATOM 1701 CB LEU A 107 7.522 -38.045 -4.760 1.00 0.13 C ATOM 1702 CG LEU A 107 7.015 -36.793 -4.042 1.00 74.53 C ATOM 1703 CD1 LEU A 107 5.574 -36.502 -4.432 1.00 72.01 C ATOM 1704 CD2 LEU A 107 7.139 -36.956 -2.534 1.00 53.04 C ATOM 0 H LEU A 107 8.772 -40.080 -5.363 1.00 64.40 H new ATOM 0 HA LEU A 107 9.017 -37.394 -6.161 1.00 11.53 H new ATOM 0 HB2 LEU A 107 6.874 -38.237 -5.615 1.00 0.13 H new ATOM 0 HB3 LEU A 107 7.418 -38.894 -4.084 1.00 0.13 H new ATOM 0 HG LEU A 107 7.631 -35.947 -4.347 1.00 74.53 H new ATOM 0 HD11 LEU A 107 5.230 -35.608 -3.912 1.00 72.01 H new ATOM 0 HD12 LEU A 107 5.514 -36.341 -5.508 1.00 72.01 H new ATOM 0 HD13 LEU A 107 4.944 -37.348 -4.156 1.00 72.01 H new ATOM 0 HD21 LEU A 107 6.774 -36.056 -2.039 1.00 53.04 H new ATOM 0 HD22 LEU A 107 6.548 -37.813 -2.211 1.00 53.04 H new ATOM 0 HD23 LEU A 107 8.184 -37.116 -2.270 1.00 53.04 H new ATOM 1716 N THR A 108 10.535 -38.179 -3.410 1.00 51.12 N ATOM 1717 CA THR A 108 11.420 -37.688 -2.361 1.00 53.03 C ATOM 1718 C THR A 108 12.619 -36.956 -2.952 1.00 24.11 C ATOM 1719 O THR A 108 13.225 -36.108 -2.297 1.00 72.12 O ATOM 1720 CB THR A 108 11.923 -38.837 -1.467 1.00 72.14 C ATOM 1721 OG1 THR A 108 12.602 -38.307 -0.324 1.00 44.30 O ATOM 1722 CG2 THR A 108 12.859 -39.754 -2.240 1.00 42.32 C ATOM 0 H THR A 108 10.488 -39.195 -3.480 1.00 51.12 H new ATOM 0 HA THR A 108 10.837 -36.995 -1.754 1.00 53.03 H new ATOM 0 HB THR A 108 11.061 -39.417 -1.139 1.00 72.14 H new ATOM 0 HG1 THR A 108 12.917 -39.044 0.240 1.00 44.30 H new ATOM 0 HG21 THR A 108 13.201 -40.558 -1.588 1.00 42.32 H new ATOM 0 HG22 THR A 108 12.330 -40.179 -3.093 1.00 42.32 H new ATOM 0 HG23 THR A 108 13.718 -39.183 -2.594 1.00 42.32 H new ATOM 1730 N ALA A 109 12.957 -37.289 -4.193 1.00 43.03 N ATOM 1731 CA ALA A 109 14.083 -36.661 -4.873 1.00 4.20 C ATOM 1732 C ALA A 109 13.640 -35.415 -5.633 1.00 65.20 C ATOM 1733 O ALA A 109 14.368 -34.424 -5.697 1.00 34.11 O ATOM 1734 CB ALA A 109 14.748 -37.650 -5.819 1.00 34.31 C ATOM 0 H ALA A 109 12.467 -37.990 -4.748 1.00 43.03 H new ATOM 0 HA ALA A 109 14.807 -36.356 -4.117 1.00 4.20 H new ATOM 0 HB1 ALA A 109 15.587 -37.167 -6.320 1.00 34.31 H new ATOM 0 HB2 ALA A 109 15.109 -38.509 -5.253 1.00 34.31 H new ATOM 0 HB3 ALA A 109 14.025 -37.984 -6.563 1.00 34.31 H new ATOM 1740 N SER A 110 12.444 -35.473 -6.209 1.00 33.14 N ATOM 1741 CA SER A 110 11.906 -34.351 -6.969 1.00 11.25 C ATOM 1742 C SER A 110 11.883 -33.082 -6.121 1.00 65.14 C ATOM 1743 O SER A 110 12.366 -32.031 -6.544 1.00 55.23 O ATOM 1744 CB SER A 110 10.494 -34.672 -7.463 1.00 64.34 C ATOM 1745 OG SER A 110 9.578 -34.738 -6.384 1.00 42.33 O ATOM 0 H SER A 110 11.829 -36.285 -6.164 1.00 33.14 H new ATOM 0 HA SER A 110 12.555 -34.182 -7.829 1.00 11.25 H new ATOM 0 HB2 SER A 110 10.171 -33.909 -8.172 1.00 64.34 H new ATOM 0 HB3 SER A 110 10.500 -35.622 -7.998 1.00 64.34 H new ATOM 0 HG SER A 110 9.909 -35.370 -5.712 1.00 42.33 H new ATOM 1751 N HIS A 111 11.320 -33.189 -4.922 1.00 52.33 N ATOM 1752 CA HIS A 111 11.234 -32.051 -4.014 1.00 2.31 C ATOM 1753 C HIS A 111 12.607 -31.420 -3.802 1.00 42.03 C ATOM 1754 O HIS A 111 12.725 -30.207 -3.624 1.00 71.12 O ATOM 1755 CB HIS A 111 10.648 -32.486 -2.671 1.00 34.22 C ATOM 1756 CG HIS A 111 10.146 -31.347 -1.839 1.00 13.44 C ATOM 1757 ND1 HIS A 111 9.752 -31.490 -0.525 1.00 24.12 N ATOM 1758 CD2 HIS A 111 9.976 -30.038 -2.140 1.00 11.12 C ATOM 1759 CE1 HIS A 111 9.361 -30.319 -0.054 1.00 75.54 C ATOM 1760 NE2 HIS A 111 9.487 -29.421 -1.015 1.00 32.24 N ATOM 0 H HIS A 111 10.917 -34.052 -4.557 1.00 52.33 H new ATOM 0 HA HIS A 111 10.577 -31.307 -4.465 1.00 2.31 H new ATOM 0 HB2 HIS A 111 9.829 -33.183 -2.850 1.00 34.22 H new ATOM 0 HB3 HIS A 111 11.410 -33.027 -2.110 1.00 34.22 H new ATOM 0 HD2 HIS A 111 10.186 -29.567 -3.089 1.00 11.12 H new ATOM 0 HE1 HIS A 111 9.000 -30.128 0.946 1.00 75.54 H new ATOM 0 HE2 HIS A 111 9.258 -28.430 -0.934 1.00 32.24 H new ATOM 1768 N THR A 112 13.645 -32.251 -3.822 1.00 74.31 N ATOM 1769 CA THR A 112 15.009 -31.776 -3.631 1.00 12.24 C ATOM 1770 C THR A 112 15.338 -30.646 -4.599 1.00 44.04 C ATOM 1771 O THR A 112 15.984 -29.665 -4.228 1.00 43.24 O ATOM 1772 CB THR A 112 16.031 -32.912 -3.818 1.00 64.43 C ATOM 1773 OG1 THR A 112 15.579 -34.094 -3.148 1.00 73.34 O ATOM 1774 CG2 THR A 112 17.395 -32.508 -3.278 1.00 70.14 C ATOM 0 H THR A 112 13.566 -33.257 -3.969 1.00 74.31 H new ATOM 0 HA THR A 112 15.074 -31.405 -2.608 1.00 12.24 H new ATOM 0 HB THR A 112 16.125 -33.113 -4.885 1.00 64.43 H new ATOM 0 HG1 THR A 112 16.234 -34.812 -3.274 1.00 73.34 H new ATOM 0 HG21 THR A 112 18.100 -33.327 -3.421 1.00 70.14 H new ATOM 0 HG22 THR A 112 17.750 -31.626 -3.810 1.00 70.14 H new ATOM 0 HG23 THR A 112 17.313 -32.282 -2.215 1.00 70.14 H new ATOM 1782 N LEU A 113 14.891 -30.789 -5.842 1.00 32.01 N ATOM 1783 CA LEU A 113 15.138 -29.779 -6.865 1.00 53.11 C ATOM 1784 C LEU A 113 14.548 -28.433 -6.455 1.00 64.11 C ATOM 1785 O LEU A 113 15.008 -27.382 -6.900 1.00 52.21 O ATOM 1786 CB LEU A 113 14.542 -30.223 -8.202 1.00 65.13 C ATOM 1787 CG LEU A 113 15.286 -31.345 -8.928 1.00 73.03 C ATOM 1788 CD1 LEU A 113 14.788 -32.704 -8.462 1.00 21.24 C ATOM 1789 CD2 LEU A 113 15.124 -31.204 -10.435 1.00 32.31 C ATOM 0 H LEU A 113 14.356 -31.595 -6.166 1.00 32.01 H new ATOM 0 HA LEU A 113 16.216 -29.664 -6.974 1.00 53.11 H new ATOM 0 HB2 LEU A 113 13.515 -30.547 -8.030 1.00 65.13 H new ATOM 0 HB3 LEU A 113 14.497 -29.357 -8.863 1.00 65.13 H new ATOM 0 HG LEU A 113 16.346 -31.267 -8.687 1.00 73.03 H new ATOM 0 HD11 LEU A 113 15.329 -33.490 -8.989 1.00 21.24 H new ATOM 0 HD12 LEU A 113 14.956 -32.805 -7.390 1.00 21.24 H new ATOM 0 HD13 LEU A 113 13.722 -32.793 -8.673 1.00 21.24 H new ATOM 0 HD21 LEU A 113 15.660 -32.011 -10.936 1.00 32.31 H new ATOM 0 HD22 LEU A 113 14.066 -31.256 -10.694 1.00 32.31 H new ATOM 0 HD23 LEU A 113 15.530 -30.245 -10.756 1.00 32.31 H new ATOM 1801 N ALA A 114 13.530 -28.474 -5.602 1.00 72.14 N ATOM 1802 CA ALA A 114 12.881 -27.258 -5.129 1.00 14.01 C ATOM 1803 C ALA A 114 13.489 -26.788 -3.812 1.00 41.11 C ATOM 1804 O ALA A 114 13.760 -25.601 -3.631 1.00 3.24 O ATOM 1805 CB ALA A 114 11.385 -27.486 -4.970 1.00 13.03 C ATOM 0 H ALA A 114 13.137 -29.336 -5.224 1.00 72.14 H new ATOM 0 HA ALA A 114 13.042 -26.477 -5.872 1.00 14.01 H new ATOM 0 HB1 ALA A 114 10.913 -26.570 -4.616 1.00 13.03 H new ATOM 0 HB2 ALA A 114 10.956 -27.767 -5.932 1.00 13.03 H new ATOM 0 HB3 ALA A 114 11.213 -28.285 -4.248 1.00 13.03 H new ATOM 1811 N VAL A 115 13.701 -27.726 -2.895 1.00 31.42 N ATOM 1812 CA VAL A 115 14.278 -27.408 -1.594 1.00 72.02 C ATOM 1813 C VAL A 115 15.643 -26.747 -1.746 1.00 1.23 C ATOM 1814 O VAL A 115 16.098 -26.028 -0.856 1.00 25.33 O ATOM 1815 CB VAL A 115 14.424 -28.669 -0.721 1.00 42.44 C ATOM 1816 CG1 VAL A 115 14.852 -28.295 0.690 1.00 54.53 C ATOM 1817 CG2 VAL A 115 13.123 -29.457 -0.702 1.00 1.41 C ATOM 0 H VAL A 115 13.482 -28.713 -3.029 1.00 31.42 H new ATOM 0 HA VAL A 115 13.594 -26.714 -1.105 1.00 72.02 H new ATOM 0 HB VAL A 115 15.199 -29.302 -1.154 1.00 42.44 H new ATOM 0 HG11 VAL A 115 14.950 -29.198 1.292 1.00 54.53 H new ATOM 0 HG12 VAL A 115 15.810 -27.777 0.654 1.00 54.53 H new ATOM 0 HG13 VAL A 115 14.103 -27.641 1.136 1.00 54.53 H new ATOM 0 HG21 VAL A 115 13.244 -30.344 -0.081 1.00 1.41 H new ATOM 0 HG22 VAL A 115 12.327 -28.835 -0.294 1.00 1.41 H new ATOM 0 HG23 VAL A 115 12.865 -29.758 -1.717 1.00 1.41 H new ATOM 1827 N ASP A 116 16.291 -26.994 -2.879 1.00 4.14 N ATOM 1828 CA ASP A 116 17.605 -26.421 -3.148 1.00 61.13 C ATOM 1829 C ASP A 116 17.476 -25.073 -3.850 1.00 3.42 C ATOM 1830 O ASP A 116 18.437 -24.307 -3.925 1.00 53.11 O ATOM 1831 CB ASP A 116 18.436 -27.378 -4.004 1.00 43.04 C ATOM 1832 CG ASP A 116 19.126 -28.444 -3.177 1.00 23.52 C ATOM 1833 OD1 ASP A 116 19.994 -28.087 -2.352 1.00 74.20 O ATOM 1834 OD2 ASP A 116 18.798 -29.636 -3.353 1.00 64.22 O ATOM 0 H ASP A 116 15.928 -27.587 -3.626 1.00 4.14 H new ATOM 0 HA ASP A 116 18.110 -26.267 -2.194 1.00 61.13 H new ATOM 0 HB2 ASP A 116 17.790 -27.855 -4.741 1.00 43.04 H new ATOM 0 HB3 ASP A 116 19.184 -26.810 -4.556 1.00 43.04 H new ATOM 1839 N ALA A 117 16.283 -24.790 -4.363 1.00 3.45 N ATOM 1840 CA ALA A 117 16.029 -23.534 -5.057 1.00 12.40 C ATOM 1841 C ALA A 117 15.449 -22.490 -4.109 1.00 1.45 C ATOM 1842 O ALA A 117 14.807 -21.532 -4.540 1.00 52.00 O ATOM 1843 CB ALA A 117 15.090 -23.761 -6.232 1.00 75.21 C ATOM 0 H ALA A 117 15.478 -25.414 -4.311 1.00 3.45 H new ATOM 0 HA ALA A 117 16.980 -23.157 -5.433 1.00 12.40 H new ATOM 0 HB1 ALA A 117 14.909 -22.814 -6.741 1.00 75.21 H new ATOM 0 HB2 ALA A 117 15.543 -24.467 -6.928 1.00 75.21 H new ATOM 0 HB3 ALA A 117 14.145 -24.165 -5.870 1.00 75.21 H new ATOM 1849 N LYS A 118 15.679 -22.681 -2.814 1.00 2.41 N ATOM 1850 CA LYS A 118 15.181 -21.756 -1.803 1.00 53.41 C ATOM 1851 C LYS A 118 16.329 -21.175 -0.983 1.00 74.41 C ATOM 1852 O LYS A 118 16.536 -19.963 -0.959 1.00 53.03 O ATOM 1853 CB LYS A 118 14.187 -22.464 -0.879 1.00 62.04 C ATOM 1854 CG LYS A 118 12.736 -22.125 -1.172 1.00 40.42 C ATOM 1855 CD LYS A 118 12.194 -22.946 -2.330 1.00 50.32 C ATOM 1856 CE LYS A 118 10.916 -23.676 -1.946 1.00 1.32 C ATOM 1857 NZ LYS A 118 9.701 -22.890 -2.298 1.00 42.11 N ATOM 0 H LYS A 118 16.208 -23.469 -2.440 1.00 2.41 H new ATOM 0 HA LYS A 118 14.673 -20.938 -2.314 1.00 53.41 H new ATOM 0 HB2 LYS A 118 14.325 -23.542 -0.969 1.00 62.04 H new ATOM 0 HB3 LYS A 118 14.412 -22.199 0.154 1.00 62.04 H new ATOM 0 HG2 LYS A 118 12.132 -22.306 -0.283 1.00 40.42 H new ATOM 0 HG3 LYS A 118 12.649 -21.064 -1.405 1.00 40.42 H new ATOM 0 HD2 LYS A 118 12.000 -22.293 -3.181 1.00 50.32 H new ATOM 0 HD3 LYS A 118 12.945 -23.669 -2.648 1.00 50.32 H new ATOM 0 HE2 LYS A 118 10.883 -24.641 -2.452 1.00 1.32 H new ATOM 0 HE3 LYS A 118 10.921 -23.877 -0.875 1.00 1.32 H new ATOM 0 HZ1 LYS A 118 8.908 -23.538 -2.477 1.00 42.11 H new ATOM 0 HZ2 LYS A 118 9.459 -22.255 -1.511 1.00 42.11 H new ATOM 0 HZ3 LYS A 118 9.887 -22.327 -3.153 1.00 42.11 H new ATOM 1871 N ASN A 119 17.073 -22.050 -0.313 1.00 55.24 N ATOM 1872 CA ASN A 119 18.200 -21.624 0.507 1.00 4.50 C ATOM 1873 C ASN A 119 19.259 -20.928 -0.343 1.00 64.32 C ATOM 1874 O ASN A 119 20.110 -20.204 0.175 1.00 1.31 O ATOM 1875 CB ASN A 119 18.817 -22.825 1.227 1.00 15.54 C ATOM 1876 CG ASN A 119 19.797 -23.583 0.353 1.00 12.43 C ATOM 1877 OD1 ASN A 119 20.922 -23.135 0.131 1.00 21.22 O ATOM 1878 ND2 ASN A 119 19.372 -24.737 -0.148 1.00 5.22 N ATOM 0 H ASN A 119 16.915 -23.058 -0.322 1.00 55.24 H new ATOM 0 HA ASN A 119 17.830 -20.915 1.248 1.00 4.50 H new ATOM 0 HB2 ASN A 119 19.327 -22.482 2.127 1.00 15.54 H new ATOM 0 HB3 ASN A 119 18.023 -23.500 1.548 1.00 15.54 H new ATOM 0 HD21 ASN A 119 19.987 -25.291 -0.744 1.00 5.22 H new ATOM 0 HD22 ASN A 119 18.431 -25.069 0.063 1.00 5.22 H new ATOM 1885 N LEU A 120 19.201 -21.153 -1.651 1.00 42.01 N ATOM 1886 CA LEU A 120 20.155 -20.548 -2.575 1.00 14.24 C ATOM 1887 C LEU A 120 19.796 -19.091 -2.851 1.00 33.31 C ATOM 1888 O LEU A 120 20.671 -18.262 -3.103 1.00 72.13 O ATOM 1889 CB LEU A 120 20.193 -21.333 -3.887 1.00 33.33 C ATOM 1890 CG LEU A 120 21.201 -20.850 -4.929 1.00 64.03 C ATOM 1891 CD1 LEU A 120 20.637 -19.676 -5.714 1.00 2.33 C ATOM 1892 CD2 LEU A 120 22.515 -20.467 -4.263 1.00 51.11 C ATOM 0 H LEU A 120 18.504 -21.750 -2.096 1.00 42.01 H new ATOM 0 HA LEU A 120 21.141 -20.579 -2.112 1.00 14.24 H new ATOM 0 HB2 LEU A 120 20.410 -22.376 -3.657 1.00 33.33 H new ATOM 0 HB3 LEU A 120 19.199 -21.305 -4.333 1.00 33.33 H new ATOM 0 HG LEU A 120 21.394 -21.666 -5.625 1.00 64.03 H new ATOM 0 HD11 LEU A 120 21.369 -19.346 -6.451 1.00 2.33 H new ATOM 0 HD12 LEU A 120 19.723 -19.984 -6.223 1.00 2.33 H new ATOM 0 HD13 LEU A 120 20.414 -18.856 -5.032 1.00 2.33 H new ATOM 0 HD21 LEU A 120 23.221 -20.125 -5.020 1.00 51.11 H new ATOM 0 HD22 LEU A 120 22.339 -19.667 -3.544 1.00 51.11 H new ATOM 0 HD23 LEU A 120 22.928 -21.334 -3.747 1.00 51.11 H new ATOM 1904 N LEU A 121 18.504 -18.786 -2.799 1.00 51.14 N ATOM 1905 CA LEU A 121 18.028 -17.428 -3.042 1.00 24.21 C ATOM 1906 C LEU A 121 18.663 -16.446 -2.062 1.00 73.02 C ATOM 1907 O LEU A 121 19.052 -15.341 -2.440 1.00 64.13 O ATOM 1908 CB LEU A 121 16.504 -17.372 -2.923 1.00 44.35 C ATOM 1909 CG LEU A 121 15.895 -15.979 -2.759 1.00 41.12 C ATOM 1910 CD1 LEU A 121 16.401 -15.043 -3.846 1.00 71.44 C ATOM 1911 CD2 LEU A 121 14.375 -16.055 -2.783 1.00 65.34 C ATOM 0 H LEU A 121 17.767 -19.460 -2.591 1.00 51.14 H new ATOM 0 HA LEU A 121 18.318 -17.142 -4.053 1.00 24.21 H new ATOM 0 HB2 LEU A 121 16.073 -17.833 -3.812 1.00 44.35 H new ATOM 0 HB3 LEU A 121 16.203 -17.981 -2.070 1.00 44.35 H new ATOM 0 HG LEU A 121 16.204 -15.580 -1.793 1.00 41.12 H new ATOM 0 HD11 LEU A 121 15.957 -14.057 -3.713 1.00 71.44 H new ATOM 0 HD12 LEU A 121 17.486 -14.964 -3.782 1.00 71.44 H new ATOM 0 HD13 LEU A 121 16.123 -15.437 -4.824 1.00 71.44 H new ATOM 0 HD21 LEU A 121 13.959 -15.055 -2.665 1.00 65.34 H new ATOM 0 HD22 LEU A 121 14.047 -16.475 -3.734 1.00 65.34 H new ATOM 0 HD23 LEU A 121 14.030 -16.690 -1.967 1.00 65.34 H new ATOM 1923 N ASP A 122 18.765 -16.857 -0.803 1.00 73.22 N ATOM 1924 CA ASP A 122 19.355 -16.015 0.231 1.00 61.13 C ATOM 1925 C ASP A 122 20.862 -15.886 0.032 1.00 61.41 C ATOM 1926 O ASP A 122 21.467 -14.891 0.428 1.00 45.23 O ATOM 1927 CB ASP A 122 19.058 -16.589 1.617 1.00 2.00 C ATOM 1928 CG ASP A 122 19.082 -15.528 2.700 1.00 72.21 C ATOM 1929 OD1 ASP A 122 18.464 -14.462 2.499 1.00 34.21 O ATOM 1930 OD2 ASP A 122 19.719 -15.764 3.748 1.00 42.20 O ATOM 0 H ASP A 122 18.447 -17.768 -0.474 1.00 73.22 H new ATOM 0 HA ASP A 122 18.910 -15.023 0.155 1.00 61.13 H new ATOM 0 HB2 ASP A 122 18.080 -17.071 1.606 1.00 2.00 H new ATOM 0 HB3 ASP A 122 19.791 -17.361 1.852 1.00 2.00 H new ATOM 1935 N ALA A 123 21.461 -16.901 -0.583 1.00 4.21 N ATOM 1936 CA ALA A 123 22.897 -16.901 -0.835 1.00 1.40 C ATOM 1937 C ALA A 123 23.273 -15.844 -1.869 1.00 31.43 C ATOM 1938 O ALA A 123 24.181 -15.043 -1.650 1.00 44.12 O ATOM 1939 CB ALA A 123 23.352 -18.278 -1.295 1.00 44.40 C ATOM 0 H ALA A 123 20.974 -17.733 -0.916 1.00 4.21 H new ATOM 0 HA ALA A 123 23.405 -16.656 0.098 1.00 1.40 H new ATOM 0 HB1 ALA A 123 24.426 -18.263 -1.480 1.00 44.40 H new ATOM 0 HB2 ALA A 123 23.127 -19.013 -0.522 1.00 44.40 H new ATOM 0 HB3 ALA A 123 22.830 -18.546 -2.213 1.00 44.40 H new ATOM 1945 N VAL A 124 22.568 -15.849 -2.996 1.00 65.30 N ATOM 1946 CA VAL A 124 22.828 -14.891 -4.064 1.00 21.12 C ATOM 1947 C VAL A 124 22.542 -13.466 -3.605 1.00 3.34 C ATOM 1948 O VAL A 124 23.205 -12.520 -4.032 1.00 22.33 O ATOM 1949 CB VAL A 124 21.978 -15.197 -5.311 1.00 61.03 C ATOM 1950 CG1 VAL A 124 20.501 -15.248 -4.952 1.00 10.11 C ATOM 1951 CG2 VAL A 124 22.236 -14.164 -6.398 1.00 14.45 C ATOM 0 H VAL A 124 21.813 -16.506 -3.193 1.00 65.30 H new ATOM 0 HA VAL A 124 23.883 -14.982 -4.321 1.00 21.12 H new ATOM 0 HB VAL A 124 22.267 -16.175 -5.695 1.00 61.03 H new ATOM 0 HG11 VAL A 124 19.917 -15.465 -5.846 1.00 10.11 H new ATOM 0 HG12 VAL A 124 20.334 -16.029 -4.210 1.00 10.11 H new ATOM 0 HG13 VAL A 124 20.193 -14.286 -4.542 1.00 10.11 H new ATOM 0 HG21 VAL A 124 21.627 -14.396 -7.272 1.00 14.45 H new ATOM 0 HG22 VAL A 124 21.976 -13.173 -6.027 1.00 14.45 H new ATOM 0 HG23 VAL A 124 23.290 -14.183 -6.675 1.00 14.45 H new ATOM 1961 N ASP A 125 21.552 -13.319 -2.732 1.00 13.22 N ATOM 1962 CA ASP A 125 21.178 -12.008 -2.212 1.00 63.25 C ATOM 1963 C ASP A 125 22.364 -11.338 -1.525 1.00 31.30 C ATOM 1964 O ASP A 125 22.461 -10.112 -1.490 1.00 52.14 O ATOM 1965 CB ASP A 125 20.011 -12.138 -1.233 1.00 2.15 C ATOM 1966 CG ASP A 125 19.265 -10.832 -1.045 1.00 55.13 C ATOM 1967 OD1 ASP A 125 18.935 -10.187 -2.062 1.00 52.51 O ATOM 1968 OD2 ASP A 125 19.011 -10.455 0.118 1.00 54.40 O ATOM 0 H ASP A 125 20.993 -14.091 -2.369 1.00 13.22 H new ATOM 0 HA ASP A 125 20.869 -11.386 -3.052 1.00 63.25 H new ATOM 0 HB2 ASP A 125 19.320 -12.899 -1.595 1.00 2.15 H new ATOM 0 HB3 ASP A 125 20.386 -12.481 -0.269 1.00 2.15 H new ATOM 1973 N GLN A 126 23.262 -12.152 -0.979 1.00 12.23 N ATOM 1974 CA GLN A 126 24.440 -11.637 -0.291 1.00 13.04 C ATOM 1975 C GLN A 126 25.687 -11.792 -1.155 1.00 75.41 C ATOM 1976 O GLN A 126 26.803 -11.544 -0.701 1.00 61.32 O ATOM 1977 CB GLN A 126 24.635 -12.362 1.042 1.00 2.32 C ATOM 1978 CG GLN A 126 23.484 -12.167 2.015 1.00 12.44 C ATOM 1979 CD GLN A 126 23.040 -10.720 2.112 1.00 71.21 C ATOM 1980 OE1 GLN A 126 21.857 -10.411 1.968 1.00 34.14 O ATOM 1981 NE2 GLN A 126 23.989 -9.824 2.356 1.00 21.43 N ATOM 0 H GLN A 126 23.196 -13.170 -1.000 1.00 12.23 H new ATOM 0 HA GLN A 126 24.283 -10.575 -0.100 1.00 13.04 H new ATOM 0 HB2 GLN A 126 24.762 -13.428 0.851 1.00 2.32 H new ATOM 0 HB3 GLN A 126 25.556 -12.009 1.506 1.00 2.32 H new ATOM 0 HG2 GLN A 126 22.640 -12.782 1.702 1.00 12.44 H new ATOM 0 HG3 GLN A 126 23.785 -12.518 3.002 1.00 12.44 H new ATOM 0 HE21 GLN A 126 24.957 -10.124 2.469 1.00 21.43 H new ATOM 0 HE22 GLN A 126 23.750 -8.835 2.431 1.00 21.43 H new ATOM 1990 N ALA A 127 25.488 -12.205 -2.403 1.00 12.13 N ATOM 1991 CA ALA A 127 26.596 -12.392 -3.331 1.00 51.21 C ATOM 1992 C ALA A 127 26.601 -11.309 -4.405 1.00 3.34 C ATOM 1993 O ALA A 127 27.655 -10.787 -4.770 1.00 61.31 O ATOM 1994 CB ALA A 127 26.522 -13.771 -3.970 1.00 41.42 C ATOM 0 H ALA A 127 24.570 -12.416 -2.794 1.00 12.13 H new ATOM 0 HA ALA A 127 27.526 -12.314 -2.768 1.00 51.21 H new ATOM 0 HB1 ALA A 127 27.356 -13.897 -4.661 1.00 41.42 H new ATOM 0 HB2 ALA A 127 26.575 -14.535 -3.194 1.00 41.42 H new ATOM 0 HB3 ALA A 127 25.582 -13.870 -4.513 1.00 41.42 H new ATOM 2000 N LYS A 128 25.418 -10.975 -4.907 1.00 53.53 N ATOM 2001 CA LYS A 128 25.285 -9.953 -5.939 1.00 51.20 C ATOM 2002 C LYS A 128 25.563 -8.565 -5.370 1.00 30.33 C ATOM 2003 O LYS A 128 25.913 -7.641 -6.104 1.00 11.14 O ATOM 2004 CB LYS A 128 23.882 -9.994 -6.549 1.00 12.23 C ATOM 2005 CG LYS A 128 23.866 -9.780 -8.052 1.00 55.23 C ATOM 2006 CD LYS A 128 24.230 -11.051 -8.800 1.00 72.24 C ATOM 2007 CE LYS A 128 22.994 -11.869 -9.144 1.00 63.12 C ATOM 2008 NZ LYS A 128 22.144 -11.189 -10.161 1.00 24.43 N ATOM 0 H LYS A 128 24.536 -11.397 -4.616 1.00 53.53 H new ATOM 0 HA LYS A 128 26.019 -10.161 -6.717 1.00 51.20 H new ATOM 0 HB2 LYS A 128 23.425 -10.957 -6.323 1.00 12.23 H new ATOM 0 HB3 LYS A 128 23.266 -9.230 -6.075 1.00 12.23 H new ATOM 0 HG2 LYS A 128 22.876 -9.445 -8.362 1.00 55.23 H new ATOM 0 HG3 LYS A 128 24.567 -8.988 -8.315 1.00 55.23 H new ATOM 0 HD2 LYS A 128 24.765 -10.796 -9.715 1.00 72.24 H new ATOM 0 HD3 LYS A 128 24.907 -11.651 -8.192 1.00 72.24 H new ATOM 0 HE2 LYS A 128 23.298 -12.846 -9.519 1.00 63.12 H new ATOM 0 HE3 LYS A 128 22.410 -12.042 -8.240 1.00 63.12 H new ATOM 0 HZ1 LYS A 128 21.545 -11.892 -10.639 1.00 24.43 H new ATOM 0 HZ2 LYS A 128 21.542 -10.481 -9.693 1.00 24.43 H new ATOM 0 HZ3 LYS A 128 22.751 -10.718 -10.862 1.00 24.43 H new ATOM 2022 N VAL A 129 25.406 -8.427 -4.057 1.00 4.11 N ATOM 2023 CA VAL A 129 25.643 -7.153 -3.389 1.00 2.31 C ATOM 2024 C VAL A 129 27.121 -6.969 -3.064 1.00 23.12 C ATOM 2025 O VAL A 129 27.663 -5.870 -3.186 1.00 3.44 O ATOM 2026 CB VAL A 129 24.825 -7.040 -2.089 1.00 21.02 C ATOM 2027 CG1 VAL A 129 25.110 -5.719 -1.391 1.00 4.10 C ATOM 2028 CG2 VAL A 129 23.339 -7.189 -2.380 1.00 44.52 C ATOM 0 H VAL A 129 25.116 -9.182 -3.435 1.00 4.11 H new ATOM 0 HA VAL A 129 25.326 -6.371 -4.078 1.00 2.31 H new ATOM 0 HB VAL A 129 25.124 -7.848 -1.421 1.00 21.02 H new ATOM 0 HG11 VAL A 129 24.523 -5.658 -0.475 1.00 4.10 H new ATOM 0 HG12 VAL A 129 26.171 -5.658 -1.147 1.00 4.10 H new ATOM 0 HG13 VAL A 129 24.841 -4.894 -2.050 1.00 4.10 H new ATOM 0 HG21 VAL A 129 22.776 -7.107 -1.450 1.00 44.52 H new ATOM 0 HG22 VAL A 129 23.022 -6.404 -3.067 1.00 44.52 H new ATOM 0 HG23 VAL A 129 23.153 -8.163 -2.832 1.00 44.52 H new ATOM 2038 N LEU A 130 27.769 -8.052 -2.650 1.00 63.41 N ATOM 2039 CA LEU A 130 29.187 -8.012 -2.307 1.00 52.15 C ATOM 2040 C LEU A 130 30.027 -7.601 -3.513 1.00 13.15 C ATOM 2041 O LEU A 130 31.134 -7.086 -3.363 1.00 24.01 O ATOM 2042 CB LEU A 130 29.646 -9.377 -1.793 1.00 24.12 C ATOM 2043 CG LEU A 130 29.596 -9.575 -0.277 1.00 52.24 C ATOM 2044 CD1 LEU A 130 30.678 -8.752 0.405 1.00 55.22 C ATOM 2045 CD2 LEU A 130 28.222 -9.206 0.263 1.00 11.10 C ATOM 0 H LEU A 130 27.335 -8.969 -2.544 1.00 63.41 H new ATOM 0 HA LEU A 130 29.325 -7.270 -1.521 1.00 52.15 H new ATOM 0 HB2 LEU A 130 29.029 -10.145 -2.260 1.00 24.12 H new ATOM 0 HB3 LEU A 130 30.670 -9.543 -2.127 1.00 24.12 H new ATOM 0 HG LEU A 130 29.779 -10.627 -0.061 1.00 52.24 H new ATOM 0 HD11 LEU A 130 30.627 -8.906 1.483 1.00 55.22 H new ATOM 0 HD12 LEU A 130 31.657 -9.064 0.040 1.00 55.22 H new ATOM 0 HD13 LEU A 130 30.527 -7.696 0.181 1.00 55.22 H new ATOM 0 HD21 LEU A 130 28.204 -9.353 1.343 1.00 11.10 H new ATOM 0 HD22 LEU A 130 28.010 -8.161 0.035 1.00 11.10 H new ATOM 0 HD23 LEU A 130 27.466 -9.839 -0.202 1.00 11.10 H new ATOM 2057 N ALA A 131 29.491 -7.830 -4.707 1.00 33.22 N ATOM 2058 CA ALA A 131 30.189 -7.480 -5.937 1.00 51.15 C ATOM 2059 C ALA A 131 29.984 -6.009 -6.286 1.00 32.55 C ATOM 2060 O ALA A 131 30.791 -5.412 -6.996 1.00 11.21 O ATOM 2061 CB ALA A 131 29.719 -8.366 -7.082 1.00 15.34 C ATOM 0 H ALA A 131 28.575 -8.257 -4.848 1.00 33.22 H new ATOM 0 HA ALA A 131 31.255 -7.644 -5.779 1.00 51.15 H new ATOM 0 HB1 ALA A 131 30.249 -8.093 -7.994 1.00 15.34 H new ATOM 0 HB2 ALA A 131 29.923 -9.409 -6.842 1.00 15.34 H new ATOM 0 HB3 ALA A 131 28.648 -8.231 -7.231 1.00 15.34 H new