USER MOD reduce.3.24.130724 H: found=0, std=0, add=1195, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1198 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 139 CYS SG : rot 172:sc= -0.0381 USER MOD Set 1.2: A 161 HIS : +bothHN:sc= -9.56! C(o=-11!,f=-14!) USER MOD Set 1.3: A 164 CYS SG : rot 180:sc= -0.81 USER MOD Set 1.4: A 172 CYS SG : rot 180:sc= -0.107 USER MOD Set 2.1: A 132 TYR OH : rot 180:sc= -0.0138 USER MOD Set 2.2: A 134 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 75 ASN : amide:sc= -0.114! C(o=-0.16!,f=-6.7!) USER MOD Set 3.2: A 152 HIS : no HE2:sc= -0.0434 K(o=-0.16,f=-11!) USER MOD Single : A 7 ASN : amide:sc= -0.332 K(o=-0.33,f=-1.8!) USER MOD Single : A 12 MET CE :methyl -133:sc= -4.47 (180deg=-13.6!) USER MOD Single : A 16 GLN : amide:sc= -0.312 K(o=-0.31,f=-1.3) USER MOD Single : A 17 CYS SG : rot 180:sc= 0 USER MOD Single : A 19 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 23 ASN :FLIP amide:sc= -0.058 F(o=-2.2!,f=-0.058) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 HIS : no HE2:sc= 0.0171 K(o=0.017,f=-2.6!) USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 45 SER OG : rot 22:sc= 0.154 USER MOD Single : A 49 SER OG : rot 82:sc= 0.217 USER MOD Single : A 52 GLN : amide:sc= -1.37 K(o=-1.4,f=-2.6) USER MOD Single : A 56 GLN : amide:sc= -0.0355 K(o=-0.036,f=-1.6!) USER MOD Single : A 59 ASN : amide:sc= -0.133 K(o=-0.13,f=-2.2!) USER MOD Single : A 60 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 63 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 67 LYS NZ :NH3+ 140:sc= 0.701 (180deg=0.0303) USER MOD Single : A 71 GLN : amide:sc= -0.264 K(o=-0.26,f=-2.9!) USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 81 HIS :FLIP no HD1:sc= -1.1 F(o=-2.7!,f=-1.1) USER MOD Single : A 82 THR OG1 : rot -46:sc= 0.577 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 SER OG : rot -147:sc= -1.7 USER MOD Single : A 96 MET CE :methyl -151:sc= 0 (180deg=-0.00806) USER MOD Single : A 99 HIS : no HD1:sc= 0 X(o=0,f=-0.012) USER MOD Single : A 103 HIS : no HD1:sc= -0.73 K(o=-0.73,f=-2.1) USER MOD Single : A 107 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 HIS : no HD1:sc= 0 X(o=0,f=-0.038) USER MOD Single : A 119 ASN :FLIP amide:sc= -0.0448 F(o=-2,f=-0.045) USER MOD Single : A 121 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 125 ASN : amide:sc= -0.114 X(o=-0.11,f=-0.056) USER MOD Single : A 126 ASN : amide:sc= -3.18! C(o=-3.2!,f=-5!) USER MOD Single : A 127 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 133 SER OG : rot 180:sc= -0.484 USER MOD Single : A 141 CYS SG : rot -10:sc= -0.816 USER MOD Single : A 151 GLN : amide:sc= 0 X(o=0,f=-0.0019) USER MOD Single : A 154 GLN :FLIP amide:sc= 0 F(o=-1.2!,f=0) USER MOD Single : A 155 GLN :FLIP amide:sc= -0.962 F(o=-1.5,f=-0.96) USER MOD Single : A 156 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 158 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : A 160 SER OG : rot 180:sc= 0 USER MOD Single : A 163 THR OG1 : rot 180:sc=-0.00559 USER MOD Single : A 165 MET CE :methyl -155:sc= -1.11 (180deg=-1.37) USER MOD Single : A 166 HIS : no HD1:sc= -3.59! C(o=-3.6!,f=-6.1!) USER MOD Single : A 167 THR OG1 : rot 180:sc= 0 USER MOD Single : A 171 HIS : no HD1:sc= -6.48! C(o=-6.5!,f=-10!) USER MOD Single : A 173 MET CE :methyl 151:sc= 0 (180deg=-0.00258) USER MOD Single : A 179 GLN : amide:sc= -0.668 K(o=-0.67,f=-2.1) USER MOD ----------------------------------------------------------------- ATOM 42 N GLY A 3 17.856 4.333 5.706 1.00 0.00 N ATOM 43 CA GLY A 3 16.406 4.141 5.820 1.00 0.00 C ATOM 44 C GLY A 3 15.721 4.203 4.458 1.00 0.00 C ATOM 45 O GLY A 3 15.459 5.287 3.935 1.00 0.00 O ATOM 0 HA2 GLY A 3 16.202 3.177 6.287 1.00 0.00 H new ATOM 0 HA3 GLY A 3 15.988 4.907 6.473 1.00 0.00 H new ATOM 49 N ILE A 4 15.424 3.039 3.889 1.00 0.00 N ATOM 50 CA ILE A 4 14.763 2.991 2.591 1.00 0.00 C ATOM 51 C ILE A 4 13.303 3.420 2.721 1.00 0.00 C ATOM 52 O ILE A 4 12.795 4.181 1.901 1.00 0.00 O ATOM 53 CB ILE A 4 14.844 1.571 2.018 1.00 0.00 C ATOM 54 CG1 ILE A 4 14.342 1.568 0.562 1.00 0.00 C ATOM 55 CG2 ILE A 4 13.975 0.631 2.854 1.00 0.00 C ATOM 56 CD1 ILE A 4 15.303 2.369 -0.336 1.00 0.00 C ATOM 0 H ILE A 4 15.627 2.128 4.300 1.00 0.00 H new ATOM 0 HA ILE A 4 15.269 3.680 1.914 1.00 0.00 H new ATOM 0 HB ILE A 4 15.880 1.233 2.045 1.00 0.00 H new ATOM 0 HG12 ILE A 4 14.264 0.543 0.199 1.00 0.00 H new ATOM 0 HG13 ILE A 4 13.343 2.001 0.514 1.00 0.00 H new ATOM 0 HG21 ILE A 4 14.033 -0.378 2.446 1.00 0.00 H new ATOM 0 HG22 ILE A 4 14.331 0.627 3.884 1.00 0.00 H new ATOM 0 HG23 ILE A 4 12.940 0.973 2.829 1.00 0.00 H new ATOM 0 HD11 ILE A 4 14.936 2.358 -1.362 1.00 0.00 H new ATOM 0 HD12 ILE A 4 15.360 3.398 0.019 1.00 0.00 H new ATOM 0 HD13 ILE A 4 16.295 1.918 -0.301 1.00 0.00 H new ATOM 68 N ILE A 5 12.637 2.933 3.766 1.00 0.00 N ATOM 69 CA ILE A 5 11.236 3.282 4.002 1.00 0.00 C ATOM 70 C ILE A 5 11.098 4.787 4.210 1.00 0.00 C ATOM 71 O ILE A 5 10.218 5.422 3.629 1.00 0.00 O ATOM 72 CB ILE A 5 10.698 2.547 5.242 1.00 0.00 C ATOM 73 CG1 ILE A 5 11.017 1.031 5.156 1.00 0.00 C ATOM 74 CG2 ILE A 5 9.184 2.758 5.349 1.00 0.00 C ATOM 75 CD1 ILE A 5 10.048 0.318 4.194 1.00 0.00 C ATOM 0 H ILE A 5 13.040 2.301 4.458 1.00 0.00 H new ATOM 0 HA ILE A 5 10.657 2.980 3.129 1.00 0.00 H new ATOM 0 HB ILE A 5 11.183 2.953 6.130 1.00 0.00 H new ATOM 0 HG12 ILE A 5 12.043 0.890 4.815 1.00 0.00 H new ATOM 0 HG13 ILE A 5 10.946 0.584 6.147 1.00 0.00 H new ATOM 0 HG21 ILE A 5 8.805 2.236 6.228 1.00 0.00 H new ATOM 0 HG22 ILE A 5 8.971 3.823 5.439 1.00 0.00 H new ATOM 0 HG23 ILE A 5 8.698 2.365 4.456 1.00 0.00 H new ATOM 0 HD11 ILE A 5 10.293 -0.743 4.151 1.00 0.00 H new ATOM 0 HD12 ILE A 5 9.025 0.441 4.551 1.00 0.00 H new ATOM 0 HD13 ILE A 5 10.139 0.752 3.198 1.00 0.00 H new ATOM 87 N PHE A 6 11.967 5.356 5.037 1.00 0.00 N ATOM 88 CA PHE A 6 11.918 6.788 5.299 1.00 0.00 C ATOM 89 C PHE A 6 12.285 7.577 4.041 1.00 0.00 C ATOM 90 O PHE A 6 11.803 8.688 3.835 1.00 0.00 O ATOM 91 CB PHE A 6 12.868 7.149 6.443 1.00 0.00 C ATOM 92 CG PHE A 6 12.475 6.375 7.676 1.00 0.00 C ATOM 93 CD1 PHE A 6 11.519 6.898 8.555 1.00 0.00 C ATOM 94 CD2 PHE A 6 13.064 5.134 7.940 1.00 0.00 C ATOM 95 CE1 PHE A 6 11.151 6.178 9.698 1.00 0.00 C ATOM 96 CE2 PHE A 6 12.696 4.414 9.082 1.00 0.00 C ATOM 97 CZ PHE A 6 11.739 4.936 9.961 1.00 0.00 C ATOM 0 H PHE A 6 12.705 4.855 5.532 1.00 0.00 H new ATOM 0 HA PHE A 6 10.901 7.051 5.589 1.00 0.00 H new ATOM 0 HB2 PHE A 6 13.896 6.916 6.165 1.00 0.00 H new ATOM 0 HB3 PHE A 6 12.826 8.220 6.642 1.00 0.00 H new ATOM 0 HD1 PHE A 6 11.065 7.857 8.351 1.00 0.00 H new ATOM 0 HD2 PHE A 6 13.803 4.732 7.263 1.00 0.00 H new ATOM 0 HE1 PHE A 6 10.414 6.581 10.376 1.00 0.00 H new ATOM 0 HE2 PHE A 6 13.150 3.455 9.286 1.00 0.00 H new ATOM 0 HZ PHE A 6 11.455 4.380 10.842 1.00 0.00 H new ATOM 107 N ASN A 7 13.138 6.995 3.204 1.00 0.00 N ATOM 108 CA ASN A 7 13.555 7.659 1.967 1.00 0.00 C ATOM 109 C ASN A 7 12.364 7.857 1.023 1.00 0.00 C ATOM 110 O ASN A 7 12.165 8.944 0.479 1.00 0.00 O ATOM 111 CB ASN A 7 14.628 6.824 1.266 1.00 0.00 C ATOM 112 CG ASN A 7 15.218 7.608 0.099 1.00 0.00 C ATOM 113 OD1 ASN A 7 14.788 8.727 -0.178 1.00 0.00 O ATOM 114 ND2 ASN A 7 16.184 7.084 -0.604 1.00 0.00 N ATOM 0 H ASN A 7 13.552 6.075 3.354 1.00 0.00 H new ATOM 0 HA ASN A 7 13.960 8.637 2.225 1.00 0.00 H new ATOM 0 HB2 ASN A 7 15.415 6.560 1.973 1.00 0.00 H new ATOM 0 HB3 ASN A 7 14.196 5.890 0.906 1.00 0.00 H new ATOM 0 HD21 ASN A 7 16.585 7.602 -1.386 1.00 0.00 H new ATOM 0 HD22 ASN A 7 16.538 6.156 -0.372 1.00 0.00 H new ATOM 121 N VAL A 8 11.579 6.800 0.837 1.00 0.00 N ATOM 122 CA VAL A 8 10.412 6.875 -0.045 1.00 0.00 C ATOM 123 C VAL A 8 9.346 7.782 0.564 1.00 0.00 C ATOM 124 O VAL A 8 8.569 8.415 -0.150 1.00 0.00 O ATOM 125 CB VAL A 8 9.813 5.477 -0.282 1.00 0.00 C ATOM 126 CG1 VAL A 8 8.720 5.563 -1.361 1.00 0.00 C ATOM 127 CG2 VAL A 8 10.908 4.507 -0.747 1.00 0.00 C ATOM 0 H VAL A 8 11.724 5.891 1.277 1.00 0.00 H new ATOM 0 HA VAL A 8 10.740 7.287 -1.000 1.00 0.00 H new ATOM 0 HB VAL A 8 9.383 5.113 0.651 1.00 0.00 H new ATOM 0 HG11 VAL A 8 8.296 4.573 -1.529 1.00 0.00 H new ATOM 0 HG12 VAL A 8 7.935 6.243 -1.030 1.00 0.00 H new ATOM 0 HG13 VAL A 8 9.154 5.934 -2.290 1.00 0.00 H new ATOM 0 HG21 VAL A 8 10.474 3.521 -0.912 1.00 0.00 H new ATOM 0 HG22 VAL A 8 11.346 4.871 -1.676 1.00 0.00 H new ATOM 0 HG23 VAL A 8 11.683 4.440 0.017 1.00 0.00 H new ATOM 137 N LEU A 9 9.315 7.824 1.888 1.00 0.00 N ATOM 138 CA LEU A 9 8.340 8.642 2.605 1.00 0.00 C ATOM 139 C LEU A 9 8.637 10.139 2.419 1.00 0.00 C ATOM 140 O LEU A 9 7.768 10.911 2.029 1.00 0.00 O ATOM 141 CB LEU A 9 8.374 8.259 4.094 1.00 0.00 C ATOM 142 CG LEU A 9 7.434 9.148 4.938 1.00 0.00 C ATOM 143 CD1 LEU A 9 6.100 9.363 4.228 1.00 0.00 C ATOM 144 CD2 LEU A 9 7.174 8.454 6.285 1.00 0.00 C ATOM 0 H LEU A 9 9.952 7.302 2.490 1.00 0.00 H new ATOM 0 HA LEU A 9 7.344 8.456 2.203 1.00 0.00 H new ATOM 0 HB2 LEU A 9 8.084 7.214 4.207 1.00 0.00 H new ATOM 0 HB3 LEU A 9 9.393 8.350 4.469 1.00 0.00 H new ATOM 0 HG LEU A 9 7.910 10.118 5.086 1.00 0.00 H new ATOM 0 HD11 LEU A 9 5.457 9.992 4.844 1.00 0.00 H new ATOM 0 HD12 LEU A 9 6.273 9.850 3.268 1.00 0.00 H new ATOM 0 HD13 LEU A 9 5.616 8.400 4.064 1.00 0.00 H new ATOM 0 HD21 LEU A 9 6.511 9.072 6.891 1.00 0.00 H new ATOM 0 HD22 LEU A 9 6.707 7.484 6.111 1.00 0.00 H new ATOM 0 HD23 LEU A 9 8.119 8.313 6.810 1.00 0.00 H new ATOM 156 N GLU A 10 9.853 10.543 2.684 1.00 0.00 N ATOM 157 CA GLU A 10 10.209 11.950 2.522 1.00 0.00 C ATOM 158 C GLU A 10 9.761 12.459 1.144 1.00 0.00 C ATOM 159 O GLU A 10 9.540 13.651 0.952 1.00 0.00 O ATOM 160 CB GLU A 10 11.723 12.129 2.670 1.00 0.00 C ATOM 161 CG GLU A 10 12.090 13.597 2.446 1.00 0.00 C ATOM 162 CD GLU A 10 13.547 13.834 2.827 1.00 0.00 C ATOM 163 OE1 GLU A 10 14.218 12.868 3.149 1.00 0.00 O ATOM 164 OE2 GLU A 10 13.969 14.978 2.791 1.00 0.00 O ATOM 0 H GLU A 10 10.609 9.939 3.008 1.00 0.00 H new ATOM 0 HA GLU A 10 9.701 12.527 3.295 1.00 0.00 H new ATOM 0 HB2 GLU A 10 12.042 11.811 3.663 1.00 0.00 H new ATOM 0 HB3 GLU A 10 12.246 11.499 1.951 1.00 0.00 H new ATOM 0 HG2 GLU A 10 11.930 13.865 1.402 1.00 0.00 H new ATOM 0 HG3 GLU A 10 11.441 14.238 3.042 1.00 0.00 H new ATOM 171 N ASP A 11 9.661 11.540 0.189 1.00 0.00 N ATOM 172 CA ASP A 11 9.274 11.895 -1.183 1.00 0.00 C ATOM 173 C ASP A 11 7.773 12.217 -1.321 1.00 0.00 C ATOM 174 O ASP A 11 7.398 13.129 -2.062 1.00 0.00 O ATOM 175 CB ASP A 11 9.630 10.748 -2.129 1.00 0.00 C ATOM 176 CG ASP A 11 9.460 11.195 -3.576 1.00 0.00 C ATOM 177 OD1 ASP A 11 10.389 11.779 -4.109 1.00 0.00 O ATOM 178 OD2 ASP A 11 8.401 10.947 -4.132 1.00 0.00 O ATOM 0 H ASP A 11 9.841 10.546 0.333 1.00 0.00 H new ATOM 0 HA ASP A 11 9.825 12.799 -1.443 1.00 0.00 H new ATOM 0 HB2 ASP A 11 10.658 10.429 -1.957 1.00 0.00 H new ATOM 0 HB3 ASP A 11 8.991 9.888 -1.928 1.00 0.00 H new ATOM 183 N MET A 12 6.922 11.471 -0.629 1.00 0.00 N ATOM 184 CA MET A 12 5.473 11.712 -0.729 1.00 0.00 C ATOM 185 C MET A 12 5.077 12.979 0.034 1.00 0.00 C ATOM 186 O MET A 12 4.349 13.819 -0.495 1.00 0.00 O ATOM 187 CB MET A 12 4.658 10.490 -0.214 1.00 0.00 C ATOM 188 CG MET A 12 5.606 9.402 0.250 1.00 0.00 C ATOM 189 SD MET A 12 4.674 7.910 0.669 1.00 0.00 S ATOM 190 CE MET A 12 3.748 8.576 2.073 1.00 0.00 C ATOM 0 H MET A 12 7.192 10.710 -0.005 1.00 0.00 H new ATOM 0 HA MET A 12 5.236 11.855 -1.783 1.00 0.00 H new ATOM 0 HB2 MET A 12 4.008 10.794 0.607 1.00 0.00 H new ATOM 0 HB3 MET A 12 4.014 10.110 -1.007 1.00 0.00 H new ATOM 0 HG2 MET A 12 6.330 9.180 -0.534 1.00 0.00 H new ATOM 0 HG3 MET A 12 6.170 9.745 1.118 1.00 0.00 H new ATOM 0 HE1 MET A 12 3.798 7.876 2.907 1.00 0.00 H new ATOM 0 HE2 MET A 12 4.180 9.531 2.374 1.00 0.00 H new ATOM 0 HE3 MET A 12 2.707 8.723 1.785 1.00 0.00 H new ATOM 200 N VAL A 13 5.557 13.127 1.272 1.00 0.00 N ATOM 201 CA VAL A 13 5.227 14.316 2.054 1.00 0.00 C ATOM 202 C VAL A 13 5.630 15.574 1.291 1.00 0.00 C ATOM 203 O VAL A 13 4.870 16.541 1.231 1.00 0.00 O ATOM 204 CB VAL A 13 5.947 14.264 3.399 1.00 0.00 C ATOM 205 CG1 VAL A 13 5.423 13.074 4.210 1.00 0.00 C ATOM 206 CG2 VAL A 13 7.453 14.100 3.161 1.00 0.00 C ATOM 0 H VAL A 13 6.161 12.454 1.744 1.00 0.00 H new ATOM 0 HA VAL A 13 4.151 14.342 2.227 1.00 0.00 H new ATOM 0 HB VAL A 13 5.764 15.187 3.950 1.00 0.00 H new ATOM 0 HG11 VAL A 13 5.936 13.035 5.171 1.00 0.00 H new ATOM 0 HG12 VAL A 13 4.352 13.189 4.375 1.00 0.00 H new ATOM 0 HG13 VAL A 13 5.608 12.150 3.662 1.00 0.00 H new ATOM 0 HG21 VAL A 13 7.971 14.062 4.119 1.00 0.00 H new ATOM 0 HG22 VAL A 13 7.636 13.176 2.613 1.00 0.00 H new ATOM 0 HG23 VAL A 13 7.824 14.945 2.581 1.00 0.00 H new ATOM 216 N VAL A 14 6.821 15.555 0.708 1.00 0.00 N ATOM 217 CA VAL A 14 7.302 16.703 -0.049 1.00 0.00 C ATOM 218 C VAL A 14 6.272 17.126 -1.095 1.00 0.00 C ATOM 219 O VAL A 14 6.196 18.297 -1.467 1.00 0.00 O ATOM 220 CB VAL A 14 8.640 16.357 -0.730 1.00 0.00 C ATOM 221 CG1 VAL A 14 8.964 17.399 -1.814 1.00 0.00 C ATOM 222 CG2 VAL A 14 9.764 16.353 0.321 1.00 0.00 C ATOM 0 H VAL A 14 7.466 14.766 0.744 1.00 0.00 H new ATOM 0 HA VAL A 14 7.456 17.535 0.638 1.00 0.00 H new ATOM 0 HB VAL A 14 8.560 15.372 -1.190 1.00 0.00 H new ATOM 0 HG11 VAL A 14 9.911 17.146 -2.290 1.00 0.00 H new ATOM 0 HG12 VAL A 14 8.172 17.404 -2.563 1.00 0.00 H new ATOM 0 HG13 VAL A 14 9.039 18.387 -1.359 1.00 0.00 H new ATOM 0 HG21 VAL A 14 10.711 16.108 -0.160 1.00 0.00 H new ATOM 0 HG22 VAL A 14 9.835 17.338 0.782 1.00 0.00 H new ATOM 0 HG23 VAL A 14 9.543 15.610 1.087 1.00 0.00 H new ATOM 232 N ALA A 15 5.493 16.165 -1.572 1.00 0.00 N ATOM 233 CA ALA A 15 4.480 16.451 -2.585 1.00 0.00 C ATOM 234 C ALA A 15 3.201 17.005 -1.951 1.00 0.00 C ATOM 235 O ALA A 15 2.352 17.568 -2.642 1.00 0.00 O ATOM 236 CB ALA A 15 4.148 15.174 -3.359 1.00 0.00 C ATOM 0 H ALA A 15 5.540 15.189 -1.279 1.00 0.00 H new ATOM 0 HA ALA A 15 4.884 17.204 -3.262 1.00 0.00 H new ATOM 0 HB1 ALA A 15 3.392 15.392 -4.113 1.00 0.00 H new ATOM 0 HB2 ALA A 15 5.048 14.799 -3.845 1.00 0.00 H new ATOM 0 HB3 ALA A 15 3.767 14.420 -2.670 1.00 0.00 H new ATOM 242 N GLN A 16 3.054 16.815 -0.638 1.00 0.00 N ATOM 243 CA GLN A 16 1.850 17.274 0.069 1.00 0.00 C ATOM 244 C GLN A 16 2.016 18.673 0.676 1.00 0.00 C ATOM 245 O GLN A 16 1.162 19.539 0.490 1.00 0.00 O ATOM 246 CB GLN A 16 1.514 16.290 1.192 1.00 0.00 C ATOM 247 CG GLN A 16 1.280 14.892 0.608 1.00 0.00 C ATOM 248 CD GLN A 16 0.455 14.049 1.579 1.00 0.00 C ATOM 249 OE1 GLN A 16 0.995 13.503 2.541 1.00 0.00 O ATOM 250 NE2 GLN A 16 -0.828 13.914 1.383 1.00 0.00 N ATOM 0 H GLN A 16 3.743 16.352 -0.046 1.00 0.00 H new ATOM 0 HA GLN A 16 1.047 17.323 -0.667 1.00 0.00 H new ATOM 0 HB2 GLN A 16 2.328 16.260 1.916 1.00 0.00 H new ATOM 0 HB3 GLN A 16 0.624 16.624 1.726 1.00 0.00 H new ATOM 0 HG2 GLN A 16 0.762 14.971 -0.348 1.00 0.00 H new ATOM 0 HG3 GLN A 16 2.236 14.406 0.414 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -1.273 14.368 0.585 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -1.386 13.355 2.028 1.00 0.00 H new ATOM 259 N CYS A 17 3.096 18.876 1.427 1.00 0.00 N ATOM 260 CA CYS A 17 3.331 20.177 2.087 1.00 0.00 C ATOM 261 C CYS A 17 4.745 20.715 1.820 1.00 0.00 C ATOM 262 O CYS A 17 5.025 21.883 2.093 1.00 0.00 O ATOM 263 CB CYS A 17 3.107 20.019 3.606 1.00 0.00 C ATOM 264 SG CYS A 17 1.413 20.507 4.030 1.00 0.00 S ATOM 0 H CYS A 17 3.817 18.175 1.598 1.00 0.00 H new ATOM 0 HA CYS A 17 2.628 20.899 1.672 1.00 0.00 H new ATOM 0 HB2 CYS A 17 3.283 18.985 3.903 1.00 0.00 H new ATOM 0 HB3 CYS A 17 3.821 20.634 4.154 1.00 0.00 H new ATOM 0 HG CYS A 17 1.229 20.370 5.310 1.00 0.00 H new ATOM 270 N GLY A 18 5.626 19.870 1.287 1.00 0.00 N ATOM 271 CA GLY A 18 7.005 20.299 0.991 1.00 0.00 C ATOM 272 C GLY A 18 8.014 19.588 1.891 1.00 0.00 C ATOM 273 O GLY A 18 7.653 18.721 2.679 1.00 0.00 O ATOM 0 H GLY A 18 5.421 18.899 1.052 1.00 0.00 H new ATOM 0 HA2 GLY A 18 7.236 20.091 -0.054 1.00 0.00 H new ATOM 0 HA3 GLY A 18 7.090 21.377 1.127 1.00 0.00 H new ATOM 277 N MET A 19 9.282 19.953 1.745 1.00 0.00 N ATOM 278 CA MET A 19 10.349 19.333 2.535 1.00 0.00 C ATOM 279 C MET A 19 10.416 19.937 3.943 1.00 0.00 C ATOM 280 O MET A 19 10.849 19.277 4.887 1.00 0.00 O ATOM 281 CB MET A 19 11.709 19.514 1.819 1.00 0.00 C ATOM 282 CG MET A 19 11.668 20.765 0.935 1.00 0.00 C ATOM 283 SD MET A 19 13.356 21.336 0.619 1.00 0.00 S ATOM 284 CE MET A 19 12.929 22.717 -0.469 1.00 0.00 C ATOM 0 H MET A 19 9.599 20.670 1.093 1.00 0.00 H new ATOM 0 HA MET A 19 10.128 18.270 2.630 1.00 0.00 H new ATOM 0 HB2 MET A 19 12.508 19.603 2.554 1.00 0.00 H new ATOM 0 HB3 MET A 19 11.931 18.636 1.212 1.00 0.00 H new ATOM 0 HG2 MET A 19 11.166 20.542 -0.006 1.00 0.00 H new ATOM 0 HG3 MET A 19 11.093 21.551 1.425 1.00 0.00 H new ATOM 0 HE1 MET A 19 13.840 23.222 -0.790 1.00 0.00 H new ATOM 0 HE2 MET A 19 12.395 22.341 -1.342 1.00 0.00 H new ATOM 0 HE3 MET A 19 12.294 23.421 0.069 1.00 0.00 H new ATOM 294 N SER A 20 10.002 21.192 4.073 1.00 0.00 N ATOM 295 CA SER A 20 10.041 21.860 5.372 1.00 0.00 C ATOM 296 C SER A 20 9.208 21.102 6.406 1.00 0.00 C ATOM 297 O SER A 20 9.579 21.038 7.578 1.00 0.00 O ATOM 298 CB SER A 20 9.528 23.294 5.243 1.00 0.00 C ATOM 299 OG SER A 20 9.707 23.971 6.482 1.00 0.00 O ATOM 0 H SER A 20 9.640 21.762 3.308 1.00 0.00 H new ATOM 0 HA SER A 20 11.077 21.877 5.711 1.00 0.00 H new ATOM 0 HB2 SER A 20 10.065 23.815 4.450 1.00 0.00 H new ATOM 0 HB3 SER A 20 8.474 23.292 4.966 1.00 0.00 H new ATOM 0 HG SER A 20 9.380 24.891 6.402 1.00 0.00 H new ATOM 305 N VAL A 21 8.090 20.528 5.977 1.00 0.00 N ATOM 306 CA VAL A 21 7.233 19.778 6.897 1.00 0.00 C ATOM 307 C VAL A 21 7.925 18.491 7.337 1.00 0.00 C ATOM 308 O VAL A 21 7.867 18.109 8.505 1.00 0.00 O ATOM 309 CB VAL A 21 5.879 19.446 6.217 1.00 0.00 C ATOM 310 CG1 VAL A 21 5.998 18.158 5.374 1.00 0.00 C ATOM 311 CG2 VAL A 21 4.804 19.244 7.292 1.00 0.00 C ATOM 0 H VAL A 21 7.756 20.564 5.014 1.00 0.00 H new ATOM 0 HA VAL A 21 7.046 20.394 7.777 1.00 0.00 H new ATOM 0 HB VAL A 21 5.605 20.274 5.564 1.00 0.00 H new ATOM 0 HG11 VAL A 21 5.039 17.941 4.904 1.00 0.00 H new ATOM 0 HG12 VAL A 21 6.756 18.296 4.603 1.00 0.00 H new ATOM 0 HG13 VAL A 21 6.283 17.326 6.018 1.00 0.00 H new ATOM 0 HG21 VAL A 21 3.852 19.011 6.815 1.00 0.00 H new ATOM 0 HG22 VAL A 21 5.094 18.422 7.946 1.00 0.00 H new ATOM 0 HG23 VAL A 21 4.701 20.156 7.880 1.00 0.00 H new ATOM 321 N TRP A 22 8.566 17.825 6.386 1.00 0.00 N ATOM 322 CA TRP A 22 9.253 16.580 6.674 1.00 0.00 C ATOM 323 C TRP A 22 10.403 16.799 7.635 1.00 0.00 C ATOM 324 O TRP A 22 10.577 16.045 8.578 1.00 0.00 O ATOM 325 CB TRP A 22 9.802 15.966 5.389 1.00 0.00 C ATOM 326 CG TRP A 22 10.436 14.667 5.727 1.00 0.00 C ATOM 327 CD1 TRP A 22 11.753 14.397 5.636 1.00 0.00 C ATOM 328 CD2 TRP A 22 9.802 13.467 6.228 1.00 0.00 C ATOM 329 NE1 TRP A 22 11.969 13.098 6.056 1.00 0.00 N ATOM 330 CE2 TRP A 22 10.791 12.483 6.432 1.00 0.00 C ATOM 331 CE3 TRP A 22 8.468 13.141 6.525 1.00 0.00 C ATOM 332 CZ2 TRP A 22 10.473 11.219 6.915 1.00 0.00 C ATOM 333 CZ3 TRP A 22 8.141 11.872 7.010 1.00 0.00 C ATOM 334 CH2 TRP A 22 9.145 10.909 7.206 1.00 0.00 C ATOM 0 H TRP A 22 8.623 18.127 5.413 1.00 0.00 H new ATOM 0 HA TRP A 22 8.528 15.906 7.130 1.00 0.00 H new ATOM 0 HB2 TRP A 22 9.000 15.820 4.665 1.00 0.00 H new ATOM 0 HB3 TRP A 22 10.529 16.635 4.929 1.00 0.00 H new ATOM 0 HD1 TRP A 22 12.514 15.082 5.292 1.00 0.00 H new ATOM 0 HE1 TRP A 22 12.885 12.649 6.085 1.00 0.00 H new ATOM 0 HE3 TRP A 22 7.690 13.876 6.378 1.00 0.00 H new ATOM 0 HZ2 TRP A 22 11.249 10.482 7.064 1.00 0.00 H new ATOM 0 HZ3 TRP A 22 7.113 11.631 7.235 1.00 0.00 H new ATOM 0 HH2 TRP A 22 8.888 9.929 7.582 1.00 0.00 H new ATOM 345 N ASN A 23 11.180 17.833 7.386 1.00 0.00 N ATOM 346 CA ASN A 23 12.319 18.136 8.237 1.00 0.00 C ATOM 347 C ASN A 23 11.860 18.661 9.589 1.00 0.00 C ATOM 348 O ASN A 23 12.557 18.516 10.589 1.00 0.00 O ATOM 349 CB ASN A 23 13.214 19.174 7.562 1.00 0.00 C ATOM 350 CG ASN A 23 13.857 18.575 6.316 1.00 0.00 C ATOM 351 OD1 ASN A 23 13.582 17.345 5.979 1.00 0.00 O flip ATOM 352 ND2 ASN A 23 14.632 19.245 5.633 1.00 0.00 N flip ATOM 0 H ASN A 23 11.047 18.477 6.606 1.00 0.00 H new ATOM 0 HA ASN A 23 12.882 17.216 8.393 1.00 0.00 H new ATOM 0 HB2 ASN A 23 12.627 20.052 7.292 1.00 0.00 H new ATOM 0 HB3 ASN A 23 13.986 19.507 8.256 1.00 0.00 H new ATOM 0 HD21 ASN A 23 14.845 20.206 5.899 1.00 0.00 H new ATOM 0 HD22 ASN A 23 15.061 18.839 4.801 1.00 0.00 H new ATOM 359 N GLU A 24 10.704 19.301 9.609 1.00 0.00 N ATOM 360 CA GLU A 24 10.182 19.880 10.847 1.00 0.00 C ATOM 361 C GLU A 24 9.780 18.805 11.864 1.00 0.00 C ATOM 362 O GLU A 24 10.353 18.727 12.950 1.00 0.00 O ATOM 363 CB GLU A 24 8.963 20.778 10.515 1.00 0.00 C ATOM 364 CG GLU A 24 9.408 22.241 10.372 1.00 0.00 C ATOM 365 CD GLU A 24 8.202 23.126 10.078 1.00 0.00 C ATOM 366 OE1 GLU A 24 7.115 22.587 9.941 1.00 0.00 O ATOM 367 OE2 GLU A 24 8.381 24.331 9.994 1.00 0.00 O ATOM 0 H GLU A 24 10.108 19.435 8.792 1.00 0.00 H new ATOM 0 HA GLU A 24 10.975 20.473 11.302 1.00 0.00 H new ATOM 0 HB2 GLU A 24 8.494 20.441 9.591 1.00 0.00 H new ATOM 0 HB3 GLU A 24 8.214 20.693 11.302 1.00 0.00 H new ATOM 0 HG2 GLU A 24 9.898 22.572 11.288 1.00 0.00 H new ATOM 0 HG3 GLU A 24 10.140 22.330 9.569 1.00 0.00 H new ATOM 374 N LEU A 25 8.788 17.998 11.520 1.00 0.00 N ATOM 375 CA LEU A 25 8.319 16.961 12.428 1.00 0.00 C ATOM 376 C LEU A 25 9.369 15.853 12.586 1.00 0.00 C ATOM 377 O LEU A 25 9.351 15.108 13.565 1.00 0.00 O ATOM 378 CB LEU A 25 6.943 16.417 11.925 1.00 0.00 C ATOM 379 CG LEU A 25 7.070 15.077 11.139 1.00 0.00 C ATOM 380 CD1 LEU A 25 8.151 15.177 10.027 1.00 0.00 C ATOM 381 CD2 LEU A 25 7.392 13.908 12.110 1.00 0.00 C ATOM 0 H LEU A 25 8.296 18.039 10.628 1.00 0.00 H new ATOM 0 HA LEU A 25 8.171 17.383 13.422 1.00 0.00 H new ATOM 0 HB2 LEU A 25 6.282 16.270 12.779 1.00 0.00 H new ATOM 0 HB3 LEU A 25 6.475 17.165 11.285 1.00 0.00 H new ATOM 0 HG LEU A 25 6.113 14.877 10.657 1.00 0.00 H new ATOM 0 HD11 LEU A 25 8.216 14.227 9.496 1.00 0.00 H new ATOM 0 HD12 LEU A 25 7.880 15.966 9.326 1.00 0.00 H new ATOM 0 HD13 LEU A 25 9.116 15.408 10.478 1.00 0.00 H new ATOM 0 HD21 LEU A 25 7.477 12.979 11.546 1.00 0.00 H new ATOM 0 HD22 LEU A 25 8.333 14.109 12.622 1.00 0.00 H new ATOM 0 HD23 LEU A 25 6.592 13.814 12.844 1.00 0.00 H new ATOM 393 N LEU A 26 10.285 15.762 11.634 1.00 0.00 N ATOM 394 CA LEU A 26 11.338 14.750 11.698 1.00 0.00 C ATOM 395 C LEU A 26 12.350 15.109 12.781 1.00 0.00 C ATOM 396 O LEU A 26 12.796 14.249 13.528 1.00 0.00 O ATOM 397 CB LEU A 26 12.038 14.641 10.336 1.00 0.00 C ATOM 398 CG LEU A 26 13.285 13.755 10.430 1.00 0.00 C ATOM 399 CD1 LEU A 26 12.892 12.359 10.929 1.00 0.00 C ATOM 400 CD2 LEU A 26 13.916 13.642 9.038 1.00 0.00 C ATOM 0 H LEU A 26 10.325 16.368 10.814 1.00 0.00 H new ATOM 0 HA LEU A 26 10.890 13.788 11.946 1.00 0.00 H new ATOM 0 HB2 LEU A 26 11.348 14.227 9.600 1.00 0.00 H new ATOM 0 HB3 LEU A 26 12.319 15.635 9.987 1.00 0.00 H new ATOM 0 HG LEU A 26 13.998 14.195 11.128 1.00 0.00 H new ATOM 0 HD11 LEU A 26 13.781 11.732 10.994 1.00 0.00 H new ATOM 0 HD12 LEU A 26 12.432 12.441 11.914 1.00 0.00 H new ATOM 0 HD13 LEU A 26 12.182 11.910 10.234 1.00 0.00 H new ATOM 0 HD21 LEU A 26 14.805 13.014 9.091 1.00 0.00 H new ATOM 0 HD22 LEU A 26 13.198 13.198 8.348 1.00 0.00 H new ATOM 0 HD23 LEU A 26 14.194 14.634 8.683 1.00 0.00 H new ATOM 412 N GLU A 27 12.696 16.385 12.861 1.00 0.00 N ATOM 413 CA GLU A 27 13.654 16.847 13.865 1.00 0.00 C ATOM 414 C GLU A 27 13.015 16.869 15.251 1.00 0.00 C ATOM 415 O GLU A 27 13.697 16.684 16.259 1.00 0.00 O ATOM 416 CB GLU A 27 14.154 18.249 13.508 1.00 0.00 C ATOM 417 CG GLU A 27 15.111 18.164 12.319 1.00 0.00 C ATOM 418 CD GLU A 27 15.678 19.544 12.004 1.00 0.00 C ATOM 419 OE1 GLU A 27 15.219 20.502 12.605 1.00 0.00 O ATOM 420 OE2 GLU A 27 16.563 19.623 11.168 1.00 0.00 O ATOM 0 H GLU A 27 12.334 17.117 12.250 1.00 0.00 H new ATOM 0 HA GLU A 27 14.496 16.155 13.878 1.00 0.00 H new ATOM 0 HB2 GLU A 27 13.311 18.896 13.264 1.00 0.00 H new ATOM 0 HB3 GLU A 27 14.660 18.695 14.364 1.00 0.00 H new ATOM 0 HG2 GLU A 27 15.922 17.471 12.544 1.00 0.00 H new ATOM 0 HG3 GLU A 27 14.587 17.770 11.448 1.00 0.00 H new ATOM 427 N LYS A 28 11.714 17.107 15.297 1.00 0.00 N ATOM 428 CA LYS A 28 11.003 17.164 16.570 1.00 0.00 C ATOM 429 C LYS A 28 10.764 15.765 17.145 1.00 0.00 C ATOM 430 O LYS A 28 10.885 15.554 18.352 1.00 0.00 O ATOM 431 CB LYS A 28 9.656 17.865 16.374 1.00 0.00 C ATOM 432 CG LYS A 28 9.030 18.165 17.740 1.00 0.00 C ATOM 433 CD LYS A 28 7.816 19.085 17.560 1.00 0.00 C ATOM 434 CE LYS A 28 6.699 18.336 16.826 1.00 0.00 C ATOM 435 NZ LYS A 28 5.408 19.053 17.026 1.00 0.00 N ATOM 0 H LYS A 28 11.130 17.263 14.476 1.00 0.00 H new ATOM 0 HA LYS A 28 11.621 17.721 17.274 1.00 0.00 H new ATOM 0 HB2 LYS A 28 9.794 18.790 15.815 1.00 0.00 H new ATOM 0 HB3 LYS A 28 8.988 17.234 15.787 1.00 0.00 H new ATOM 0 HG2 LYS A 28 8.727 17.237 18.224 1.00 0.00 H new ATOM 0 HG3 LYS A 28 9.764 18.639 18.391 1.00 0.00 H new ATOM 0 HD2 LYS A 28 7.460 19.426 18.532 1.00 0.00 H new ATOM 0 HD3 LYS A 28 8.102 19.973 16.996 1.00 0.00 H new ATOM 0 HE2 LYS A 28 6.929 18.268 15.763 1.00 0.00 H new ATOM 0 HE3 LYS A 28 6.623 17.315 17.201 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 4.649 18.546 16.528 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 5.188 19.096 18.042 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 5.485 20.019 16.648 1.00 0.00 H new ATOM 449 N HIS A 29 10.399 14.818 16.279 1.00 0.00 N ATOM 450 CA HIS A 29 10.111 13.446 16.723 1.00 0.00 C ATOM 451 C HIS A 29 11.342 12.536 16.643 1.00 0.00 C ATOM 452 O HIS A 29 11.264 11.359 16.995 1.00 0.00 O ATOM 453 CB HIS A 29 8.995 12.851 15.862 1.00 0.00 C ATOM 454 CG HIS A 29 7.702 13.559 16.154 1.00 0.00 C ATOM 455 ND1 HIS A 29 7.325 14.716 15.489 1.00 0.00 N ATOM 456 CD2 HIS A 29 6.684 13.283 17.031 1.00 0.00 C ATOM 457 CE1 HIS A 29 6.124 15.088 15.973 1.00 0.00 C ATOM 458 NE2 HIS A 29 5.689 14.249 16.916 1.00 0.00 N ATOM 0 H HIS A 29 10.296 14.969 15.276 1.00 0.00 H new ATOM 0 HA HIS A 29 9.804 13.502 17.767 1.00 0.00 H new ATOM 0 HB2 HIS A 29 9.245 12.950 14.806 1.00 0.00 H new ATOM 0 HB3 HIS A 29 8.892 11.785 16.067 1.00 0.00 H new ATOM 0 HD1 HIS A 29 7.859 15.197 14.766 1.00 0.00 H new ATOM 0 HD2 HIS A 29 6.659 12.442 17.709 1.00 0.00 H new ATOM 0 HE1 HIS A 29 5.579 15.959 15.639 1.00 0.00 H new ATOM 565 N TYR A 36 18.453 7.742 9.993 1.00 0.00 N ATOM 566 CA TYR A 36 17.661 6.581 9.589 1.00 0.00 C ATOM 567 C TYR A 36 18.464 5.702 8.634 1.00 0.00 C ATOM 568 O TYR A 36 18.806 6.124 7.531 1.00 0.00 O ATOM 569 CB TYR A 36 16.372 7.046 8.900 1.00 0.00 C ATOM 570 CG TYR A 36 16.677 8.220 8.000 1.00 0.00 C ATOM 571 CD1 TYR A 36 16.638 9.523 8.513 1.00 0.00 C ATOM 572 CD2 TYR A 36 16.995 8.007 6.654 1.00 0.00 C ATOM 573 CE1 TYR A 36 16.919 10.611 7.679 1.00 0.00 C ATOM 574 CE2 TYR A 36 17.276 9.095 5.820 1.00 0.00 C ATOM 575 CZ TYR A 36 17.238 10.399 6.333 1.00 0.00 C ATOM 576 OH TYR A 36 17.515 11.472 5.510 1.00 0.00 O ATOM 0 HA TYR A 36 17.408 6.002 10.477 1.00 0.00 H new ATOM 0 HB2 TYR A 36 15.943 6.230 8.318 1.00 0.00 H new ATOM 0 HB3 TYR A 36 15.630 7.330 9.646 1.00 0.00 H new ATOM 0 HD1 TYR A 36 16.391 9.688 9.551 1.00 0.00 H new ATOM 0 HD2 TYR A 36 17.024 7.002 6.259 1.00 0.00 H new ATOM 0 HE1 TYR A 36 16.890 11.616 8.075 1.00 0.00 H new ATOM 0 HE2 TYR A 36 17.522 8.930 4.781 1.00 0.00 H new ATOM 0 HH TYR A 36 17.718 11.148 4.607 1.00 0.00 H new ATOM 586 N VAL A 37 18.767 4.477 9.069 1.00 0.00 N ATOM 587 CA VAL A 37 19.540 3.539 8.247 1.00 0.00 C ATOM 588 C VAL A 37 18.690 2.330 7.862 1.00 0.00 C ATOM 589 O VAL A 37 18.033 1.726 8.710 1.00 0.00 O ATOM 590 CB VAL A 37 20.774 3.070 9.022 1.00 0.00 C ATOM 591 CG1 VAL A 37 21.723 2.331 8.081 1.00 0.00 C ATOM 592 CG2 VAL A 37 21.490 4.283 9.619 1.00 0.00 C ATOM 0 H VAL A 37 18.491 4.111 9.980 1.00 0.00 H new ATOM 0 HA VAL A 37 19.850 4.052 7.337 1.00 0.00 H new ATOM 0 HB VAL A 37 20.464 2.398 9.822 1.00 0.00 H new ATOM 0 HG11 VAL A 37 22.600 1.999 8.636 1.00 0.00 H new ATOM 0 HG12 VAL A 37 21.214 1.466 7.656 1.00 0.00 H new ATOM 0 HG13 VAL A 37 22.034 3.000 7.278 1.00 0.00 H new ATOM 0 HG21 VAL A 37 22.369 3.951 10.171 1.00 0.00 H new ATOM 0 HG22 VAL A 37 21.797 4.955 8.818 1.00 0.00 H new ATOM 0 HG23 VAL A 37 20.814 4.808 10.294 1.00 0.00 H new ATOM 602 N SER A 38 18.708 1.981 6.577 1.00 0.00 N ATOM 603 CA SER A 38 17.936 0.840 6.090 1.00 0.00 C ATOM 604 C SER A 38 18.472 -0.461 6.682 1.00 0.00 C ATOM 605 O SER A 38 17.715 -1.397 6.934 1.00 0.00 O ATOM 606 CB SER A 38 18.008 0.776 4.565 1.00 0.00 C ATOM 607 OG SER A 38 19.309 0.355 4.172 1.00 0.00 O ATOM 0 H SER A 38 19.245 2.468 5.859 1.00 0.00 H new ATOM 0 HA SER A 38 16.899 0.967 6.400 1.00 0.00 H new ATOM 0 HB2 SER A 38 17.258 0.083 4.183 1.00 0.00 H new ATOM 0 HB3 SER A 38 17.785 1.754 4.138 1.00 0.00 H new ATOM 0 HG SER A 38 19.357 0.311 3.194 1.00 0.00 H new ATOM 702 N SER A 45 9.248 2.404 15.365 1.00 0.00 N ATOM 703 CA SER A 45 8.667 3.158 16.471 1.00 0.00 C ATOM 704 C SER A 45 8.470 4.618 16.081 1.00 0.00 C ATOM 705 O SER A 45 7.485 5.247 16.466 1.00 0.00 O ATOM 706 CB SER A 45 9.577 3.073 17.695 1.00 0.00 C ATOM 707 OG SER A 45 9.815 1.707 18.010 1.00 0.00 O ATOM 0 HA SER A 45 7.696 2.725 16.710 1.00 0.00 H new ATOM 0 HB2 SER A 45 10.520 3.582 17.497 1.00 0.00 H new ATOM 0 HB3 SER A 45 9.114 3.578 18.543 1.00 0.00 H new ATOM 0 HG SER A 45 9.661 1.156 17.214 1.00 0.00 H new ATOM 713 N GLU A 46 9.417 5.152 15.318 1.00 0.00 N ATOM 714 CA GLU A 46 9.343 6.542 14.882 1.00 0.00 C ATOM 715 C GLU A 46 8.418 6.687 13.676 1.00 0.00 C ATOM 716 O GLU A 46 7.747 7.702 13.521 1.00 0.00 O ATOM 717 CB GLU A 46 10.740 7.046 14.518 1.00 0.00 C ATOM 718 CG GLU A 46 11.613 7.091 15.774 1.00 0.00 C ATOM 719 CD GLU A 46 11.919 5.675 16.252 1.00 0.00 C ATOM 720 OE1 GLU A 46 11.798 4.762 15.454 1.00 0.00 O ATOM 721 OE2 GLU A 46 12.271 5.526 17.410 1.00 0.00 O ATOM 0 H GLU A 46 10.240 4.647 14.990 1.00 0.00 H new ATOM 0 HA GLU A 46 8.940 7.136 15.702 1.00 0.00 H new ATOM 0 HB2 GLU A 46 11.191 6.391 13.773 1.00 0.00 H new ATOM 0 HB3 GLU A 46 10.675 8.039 14.072 1.00 0.00 H new ATOM 0 HG2 GLU A 46 12.542 7.620 15.562 1.00 0.00 H new ATOM 0 HG3 GLU A 46 11.103 7.646 16.561 1.00 0.00 H new ATOM 728 N LEU A 47 8.393 5.669 12.823 1.00 0.00 N ATOM 729 CA LEU A 47 7.545 5.711 11.634 1.00 0.00 C ATOM 730 C LEU A 47 6.084 5.916 12.024 1.00 0.00 C ATOM 731 O LEU A 47 5.378 6.710 11.407 1.00 0.00 O ATOM 732 CB LEU A 47 7.684 4.415 10.830 1.00 0.00 C ATOM 733 CG LEU A 47 6.994 4.574 9.456 1.00 0.00 C ATOM 734 CD1 LEU A 47 7.873 5.409 8.507 1.00 0.00 C ATOM 735 CD2 LEU A 47 6.762 3.186 8.846 1.00 0.00 C ATOM 0 H LEU A 47 8.941 4.815 12.928 1.00 0.00 H new ATOM 0 HA LEU A 47 7.869 6.550 11.018 1.00 0.00 H new ATOM 0 HB2 LEU A 47 8.738 4.173 10.692 1.00 0.00 H new ATOM 0 HB3 LEU A 47 7.236 3.586 11.378 1.00 0.00 H new ATOM 0 HG LEU A 47 6.042 5.086 9.594 1.00 0.00 H new ATOM 0 HD11 LEU A 47 7.373 5.512 7.544 1.00 0.00 H new ATOM 0 HD12 LEU A 47 8.037 6.397 8.938 1.00 0.00 H new ATOM 0 HD13 LEU A 47 8.832 4.911 8.367 1.00 0.00 H new ATOM 0 HD21 LEU A 47 6.275 3.291 7.876 1.00 0.00 H new ATOM 0 HD22 LEU A 47 7.719 2.680 8.719 1.00 0.00 H new ATOM 0 HD23 LEU A 47 6.127 2.599 9.509 1.00 0.00 H new ATOM 747 N PHE A 48 5.637 5.196 13.047 1.00 0.00 N ATOM 748 CA PHE A 48 4.255 5.316 13.502 1.00 0.00 C ATOM 749 C PHE A 48 3.989 6.718 14.039 1.00 0.00 C ATOM 750 O PHE A 48 2.987 7.343 13.692 1.00 0.00 O ATOM 751 CB PHE A 48 3.964 4.280 14.588 1.00 0.00 C ATOM 752 CG PHE A 48 2.479 4.229 14.850 1.00 0.00 C ATOM 753 CD1 PHE A 48 1.646 3.487 14.005 1.00 0.00 C ATOM 754 CD2 PHE A 48 1.934 4.924 15.936 1.00 0.00 C ATOM 755 CE1 PHE A 48 0.268 3.438 14.246 1.00 0.00 C ATOM 756 CE2 PHE A 48 0.556 4.875 16.177 1.00 0.00 C ATOM 757 CZ PHE A 48 -0.278 4.133 15.333 1.00 0.00 C ATOM 0 H PHE A 48 6.203 4.530 13.572 1.00 0.00 H new ATOM 0 HA PHE A 48 3.597 5.135 12.652 1.00 0.00 H new ATOM 0 HB2 PHE A 48 4.323 3.299 14.275 1.00 0.00 H new ATOM 0 HB3 PHE A 48 4.497 4.538 15.503 1.00 0.00 H new ATOM 0 HD1 PHE A 48 2.067 2.952 13.166 1.00 0.00 H new ATOM 0 HD2 PHE A 48 2.576 5.498 16.588 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -0.374 2.864 13.594 1.00 0.00 H new ATOM 0 HE2 PHE A 48 0.136 5.411 17.015 1.00 0.00 H new ATOM 0 HZ PHE A 48 -1.341 4.096 15.519 1.00 0.00 H new ATOM 767 N SER A 49 4.891 7.213 14.879 1.00 0.00 N ATOM 768 CA SER A 49 4.735 8.549 15.441 1.00 0.00 C ATOM 769 C SER A 49 4.676 9.586 14.321 1.00 0.00 C ATOM 770 O SER A 49 3.995 10.606 14.433 1.00 0.00 O ATOM 771 CB SER A 49 5.906 8.866 16.370 1.00 0.00 C ATOM 772 OG SER A 49 6.013 7.846 17.356 1.00 0.00 O ATOM 0 H SER A 49 5.728 6.716 15.183 1.00 0.00 H new ATOM 0 HA SER A 49 3.806 8.583 16.010 1.00 0.00 H new ATOM 0 HB2 SER A 49 6.831 8.933 15.798 1.00 0.00 H new ATOM 0 HB3 SER A 49 5.755 9.834 16.847 1.00 0.00 H new ATOM 0 HG SER A 49 6.501 7.082 16.984 1.00 0.00 H new ATOM 778 N ILE A 50 5.405 9.312 13.247 1.00 0.00 N ATOM 779 CA ILE A 50 5.451 10.217 12.102 1.00 0.00 C ATOM 780 C ILE A 50 4.168 10.124 11.274 1.00 0.00 C ATOM 781 O ILE A 50 3.710 11.118 10.712 1.00 0.00 O ATOM 782 CB ILE A 50 6.662 9.865 11.220 1.00 0.00 C ATOM 783 CG1 ILE A 50 7.964 10.220 11.965 1.00 0.00 C ATOM 784 CG2 ILE A 50 6.594 10.650 9.902 1.00 0.00 C ATOM 785 CD1 ILE A 50 9.132 9.430 11.367 1.00 0.00 C ATOM 0 H ILE A 50 5.973 8.471 13.143 1.00 0.00 H new ATOM 0 HA ILE A 50 5.544 11.238 12.473 1.00 0.00 H new ATOM 0 HB ILE A 50 6.647 8.797 11.002 1.00 0.00 H new ATOM 0 HG12 ILE A 50 8.158 11.290 11.888 1.00 0.00 H new ATOM 0 HG13 ILE A 50 7.862 9.990 13.026 1.00 0.00 H new ATOM 0 HG21 ILE A 50 7.454 10.396 9.283 1.00 0.00 H new ATOM 0 HG22 ILE A 50 5.677 10.393 9.372 1.00 0.00 H new ATOM 0 HG23 ILE A 50 6.603 11.719 10.114 1.00 0.00 H new ATOM 0 HD11 ILE A 50 10.051 9.683 11.896 1.00 0.00 H new ATOM 0 HD12 ILE A 50 8.938 8.362 11.467 1.00 0.00 H new ATOM 0 HD13 ILE A 50 9.239 9.682 10.312 1.00 0.00 H new ATOM 797 N VAL A 51 3.606 8.928 11.190 1.00 0.00 N ATOM 798 CA VAL A 51 2.389 8.720 10.412 1.00 0.00 C ATOM 799 C VAL A 51 1.181 9.376 11.083 1.00 0.00 C ATOM 800 O VAL A 51 0.310 9.915 10.406 1.00 0.00 O ATOM 801 CB VAL A 51 2.141 7.211 10.231 1.00 0.00 C ATOM 802 CG1 VAL A 51 0.705 6.964 9.709 1.00 0.00 C ATOM 803 CG2 VAL A 51 3.157 6.650 9.224 1.00 0.00 C ATOM 0 H VAL A 51 3.968 8.091 11.646 1.00 0.00 H new ATOM 0 HA VAL A 51 2.522 9.187 9.436 1.00 0.00 H new ATOM 0 HB VAL A 51 2.257 6.711 11.192 1.00 0.00 H new ATOM 0 HG11 VAL A 51 0.542 5.893 9.585 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -0.015 7.360 10.425 1.00 0.00 H new ATOM 0 HG13 VAL A 51 0.576 7.464 8.749 1.00 0.00 H new ATOM 0 HG21 VAL A 51 2.986 5.582 9.092 1.00 0.00 H new ATOM 0 HG22 VAL A 51 3.039 7.158 8.267 1.00 0.00 H new ATOM 0 HG23 VAL A 51 4.168 6.812 9.598 1.00 0.00 H new ATOM 813 N GLN A 52 1.122 9.316 12.406 1.00 0.00 N ATOM 814 CA GLN A 52 -0.003 9.906 13.128 1.00 0.00 C ATOM 815 C GLN A 52 0.108 11.432 13.175 1.00 0.00 C ATOM 816 O GLN A 52 -0.896 12.135 13.073 1.00 0.00 O ATOM 817 CB GLN A 52 -0.062 9.352 14.551 1.00 0.00 C ATOM 818 CG GLN A 52 1.256 9.633 15.263 1.00 0.00 C ATOM 819 CD GLN A 52 1.292 8.902 16.601 1.00 0.00 C ATOM 820 OE1 GLN A 52 0.946 7.723 16.674 1.00 0.00 O ATOM 821 NE2 GLN A 52 1.691 9.535 17.670 1.00 0.00 N ATOM 0 H GLN A 52 1.826 8.873 12.996 1.00 0.00 H new ATOM 0 HA GLN A 52 -0.917 9.644 12.596 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -0.887 9.810 15.097 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -0.253 8.279 14.527 1.00 0.00 H new ATOM 0 HG2 GLN A 52 2.091 9.311 14.641 1.00 0.00 H new ATOM 0 HG3 GLN A 52 1.372 10.705 15.422 1.00 0.00 H new ATOM 0 HE21 GLN A 52 1.977 10.512 17.607 1.00 0.00 H new ATOM 0 HE22 GLN A 52 1.717 9.053 18.568 1.00 0.00 H new ATOM 830 N ASP A 53 1.332 11.937 13.332 1.00 0.00 N ATOM 831 CA ASP A 53 1.547 13.386 13.394 1.00 0.00 C ATOM 832 C ASP A 53 1.364 14.017 12.020 1.00 0.00 C ATOM 833 O ASP A 53 0.548 14.921 11.850 1.00 0.00 O ATOM 834 CB ASP A 53 2.952 13.692 13.924 1.00 0.00 C ATOM 835 CG ASP A 53 3.028 15.138 14.403 1.00 0.00 C ATOM 836 OD1 ASP A 53 2.621 15.391 15.524 1.00 0.00 O ATOM 837 OD2 ASP A 53 3.493 15.970 13.641 1.00 0.00 O ATOM 0 H ASP A 53 2.179 11.375 13.418 1.00 0.00 H new ATOM 0 HA ASP A 53 0.809 13.811 14.074 1.00 0.00 H new ATOM 0 HB2 ASP A 53 3.195 13.016 14.744 1.00 0.00 H new ATOM 0 HB3 ASP A 53 3.690 13.521 13.140 1.00 0.00 H new ATOM 842 N VAL A 54 2.113 13.538 11.038 1.00 0.00 N ATOM 843 CA VAL A 54 1.996 14.074 9.691 1.00 0.00 C ATOM 844 C VAL A 54 0.520 14.163 9.294 1.00 0.00 C ATOM 845 O VAL A 54 0.117 15.049 8.542 1.00 0.00 O ATOM 846 CB VAL A 54 2.763 13.177 8.703 1.00 0.00 C ATOM 847 CG1 VAL A 54 1.934 11.922 8.387 1.00 0.00 C ATOM 848 CG2 VAL A 54 3.041 13.960 7.405 1.00 0.00 C ATOM 0 H VAL A 54 2.798 12.790 11.146 1.00 0.00 H new ATOM 0 HA VAL A 54 2.428 15.075 9.663 1.00 0.00 H new ATOM 0 HB VAL A 54 3.709 12.874 9.151 1.00 0.00 H new ATOM 0 HG11 VAL A 54 2.482 11.291 7.687 1.00 0.00 H new ATOM 0 HG12 VAL A 54 1.748 11.368 9.307 1.00 0.00 H new ATOM 0 HG13 VAL A 54 0.983 12.216 7.942 1.00 0.00 H new ATOM 0 HG21 VAL A 54 3.584 13.324 6.706 1.00 0.00 H new ATOM 0 HG22 VAL A 54 2.097 14.268 6.957 1.00 0.00 H new ATOM 0 HG23 VAL A 54 3.639 14.842 7.633 1.00 0.00 H new ATOM 858 N ALA A 55 -0.274 13.237 9.820 1.00 0.00 N ATOM 859 CA ALA A 55 -1.701 13.208 9.536 1.00 0.00 C ATOM 860 C ALA A 55 -2.407 14.387 10.202 1.00 0.00 C ATOM 861 O ALA A 55 -3.385 14.915 9.672 1.00 0.00 O ATOM 862 CB ALA A 55 -2.301 11.889 10.044 1.00 0.00 C ATOM 0 H ALA A 55 0.048 12.498 10.445 1.00 0.00 H new ATOM 0 HA ALA A 55 -1.844 13.283 8.458 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -3.370 11.869 9.830 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -1.815 11.052 9.543 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -2.145 11.809 11.120 1.00 0.00 H new ATOM 868 N GLN A 56 -1.909 14.795 11.367 1.00 0.00 N ATOM 869 CA GLN A 56 -2.509 15.912 12.091 1.00 0.00 C ATOM 870 C GLN A 56 -2.327 17.218 11.328 1.00 0.00 C ATOM 871 O GLN A 56 -3.289 17.954 11.112 1.00 0.00 O ATOM 872 CB GLN A 56 -1.882 16.042 13.478 1.00 0.00 C ATOM 873 CG GLN A 56 -2.348 14.884 14.361 1.00 0.00 C ATOM 874 CD GLN A 56 -1.601 14.908 15.691 1.00 0.00 C ATOM 875 OE1 GLN A 56 -0.526 15.499 15.788 1.00 0.00 O ATOM 876 NE2 GLN A 56 -2.109 14.298 16.726 1.00 0.00 N ATOM 0 H GLN A 56 -1.101 14.374 11.825 1.00 0.00 H new ATOM 0 HA GLN A 56 -3.576 15.711 12.192 1.00 0.00 H new ATOM 0 HB2 GLN A 56 -0.795 16.038 13.399 1.00 0.00 H new ATOM 0 HB3 GLN A 56 -2.165 16.993 13.929 1.00 0.00 H new ATOM 0 HG2 GLN A 56 -3.421 14.958 14.536 1.00 0.00 H new ATOM 0 HG3 GLN A 56 -2.173 13.935 13.853 1.00 0.00 H new ATOM 0 HE21 GLN A 56 -3.000 13.809 16.643 1.00 0.00 H new ATOM 0 HE22 GLN A 56 -1.615 14.310 17.618 1.00 0.00 H new ATOM 885 N ARG A 57 -1.094 17.509 10.920 1.00 0.00 N ATOM 886 CA ARG A 57 -0.834 18.741 10.184 1.00 0.00 C ATOM 887 C ARG A 57 -1.476 18.679 8.805 1.00 0.00 C ATOM 888 O ARG A 57 -2.068 19.653 8.340 1.00 0.00 O ATOM 889 CB ARG A 57 0.671 18.991 10.058 1.00 0.00 C ATOM 890 CG ARG A 57 1.369 17.764 9.457 1.00 0.00 C ATOM 891 CD ARG A 57 2.846 17.791 9.844 1.00 0.00 C ATOM 892 NE ARG A 57 3.397 19.131 9.625 1.00 0.00 N ATOM 893 CZ ARG A 57 4.367 19.621 10.399 1.00 0.00 C ATOM 894 NH1 ARG A 57 4.856 18.904 11.375 1.00 0.00 N ATOM 895 NH2 ARG A 57 4.832 20.820 10.179 1.00 0.00 N ATOM 0 H ARG A 57 -0.276 16.922 11.082 1.00 0.00 H new ATOM 0 HA ARG A 57 -1.274 19.570 10.739 1.00 0.00 H new ATOM 0 HB2 ARG A 57 0.850 19.863 9.429 1.00 0.00 H new ATOM 0 HB3 ARG A 57 1.092 19.213 11.038 1.00 0.00 H new ATOM 0 HG2 ARG A 57 0.901 16.849 9.821 1.00 0.00 H new ATOM 0 HG3 ARG A 57 1.264 17.765 8.372 1.00 0.00 H new ATOM 0 HD2 ARG A 57 2.962 17.508 10.890 1.00 0.00 H new ATOM 0 HD3 ARG A 57 3.399 17.061 9.253 1.00 0.00 H new ATOM 0 HE ARG A 57 3.031 19.702 8.863 1.00 0.00 H new ATOM 0 HH11 ARG A 57 4.496 17.965 11.548 1.00 0.00 H new ATOM 0 HH12 ARG A 57 5.598 19.283 11.964 1.00 0.00 H new ATOM 0 HH21 ARG A 57 4.454 21.382 9.416 1.00 0.00 H new ATOM 0 HH22 ARG A 57 5.574 21.196 10.770 1.00 0.00 H new ATOM 909 N LEU A 58 -1.371 17.520 8.160 1.00 0.00 N ATOM 910 CA LEU A 58 -1.968 17.345 6.840 1.00 0.00 C ATOM 911 C LEU A 58 -3.492 17.335 6.959 1.00 0.00 C ATOM 912 O LEU A 58 -4.207 17.381 5.958 1.00 0.00 O ATOM 913 CB LEU A 58 -1.499 16.026 6.206 1.00 0.00 C ATOM 914 CG LEU A 58 -0.020 16.120 5.786 1.00 0.00 C ATOM 915 CD1 LEU A 58 0.429 14.758 5.240 1.00 0.00 C ATOM 916 CD2 LEU A 58 0.160 17.196 4.687 1.00 0.00 C ATOM 0 H LEU A 58 -0.886 16.700 8.523 1.00 0.00 H new ATOM 0 HA LEU A 58 -1.653 18.174 6.206 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -1.630 15.209 6.916 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -2.115 15.795 5.337 1.00 0.00 H new ATOM 0 HG LEU A 58 0.582 16.397 6.652 1.00 0.00 H new ATOM 0 HD11 LEU A 58 1.475 14.813 4.940 1.00 0.00 H new ATOM 0 HD12 LEU A 58 0.314 14.000 6.014 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -0.182 14.492 4.378 1.00 0.00 H new ATOM 0 HD21 LEU A 58 1.210 17.251 4.400 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -0.440 16.931 3.817 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -0.163 18.164 5.069 1.00 0.00 H new ATOM 928 N ASN A 59 -3.975 17.269 8.198 1.00 0.00 N ATOM 929 CA ASN A 59 -5.413 17.243 8.461 1.00 0.00 C ATOM 930 C ASN A 59 -6.049 16.024 7.805 1.00 0.00 C ATOM 931 O ASN A 59 -6.930 16.142 6.952 1.00 0.00 O ATOM 932 CB ASN A 59 -6.073 18.518 7.943 1.00 0.00 C ATOM 933 CG ASN A 59 -7.439 18.707 8.597 1.00 0.00 C ATOM 934 OD1 ASN A 59 -7.704 18.140 9.658 1.00 0.00 O ATOM 935 ND2 ASN A 59 -8.326 19.474 8.025 1.00 0.00 N ATOM 0 H ASN A 59 -3.393 17.233 9.035 1.00 0.00 H new ATOM 0 HA ASN A 59 -5.565 17.183 9.539 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -5.438 19.378 8.156 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -6.184 18.465 6.860 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -9.241 19.605 8.456 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -8.104 19.943 7.146 1.00 0.00 H new ATOM 942 N MET A 60 -5.584 14.858 8.219 1.00 0.00 N ATOM 943 CA MET A 60 -6.087 13.589 7.690 1.00 0.00 C ATOM 944 C MET A 60 -6.129 12.538 8.797 1.00 0.00 C ATOM 945 O MET A 60 -5.328 12.588 9.726 1.00 0.00 O ATOM 946 CB MET A 60 -5.165 13.103 6.561 1.00 0.00 C ATOM 947 CG MET A 60 -4.737 14.292 5.706 1.00 0.00 C ATOM 948 SD MET A 60 -3.983 13.695 4.173 1.00 0.00 S ATOM 949 CE MET A 60 -5.504 13.584 3.199 1.00 0.00 C ATOM 0 H MET A 60 -4.854 14.757 8.924 1.00 0.00 H new ATOM 0 HA MET A 60 -7.095 13.741 7.303 1.00 0.00 H new ATOM 0 HB2 MET A 60 -4.289 12.609 6.980 1.00 0.00 H new ATOM 0 HB3 MET A 60 -5.682 12.367 5.946 1.00 0.00 H new ATOM 0 HG2 MET A 60 -5.599 14.919 5.479 1.00 0.00 H new ATOM 0 HG3 MET A 60 -4.028 14.911 6.255 1.00 0.00 H new ATOM 0 HE1 MET A 60 -5.269 13.228 2.196 1.00 0.00 H new ATOM 0 HE2 MET A 60 -6.193 12.889 3.678 1.00 0.00 H new ATOM 0 HE3 MET A 60 -5.968 14.568 3.135 1.00 0.00 H new ATOM 959 N PRO A 61 -7.027 11.583 8.719 1.00 0.00 N ATOM 960 CA PRO A 61 -7.120 10.511 9.740 1.00 0.00 C ATOM 961 C PRO A 61 -5.992 9.487 9.563 1.00 0.00 C ATOM 962 O PRO A 61 -5.700 9.053 8.450 1.00 0.00 O ATOM 963 CB PRO A 61 -8.495 9.893 9.486 1.00 0.00 C ATOM 964 CG PRO A 61 -8.756 10.113 8.036 1.00 0.00 C ATOM 965 CD PRO A 61 -8.051 11.422 7.664 1.00 0.00 C ATOM 0 HA PRO A 61 -7.013 10.878 10.761 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -8.502 8.831 9.731 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -9.260 10.367 10.101 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -8.373 9.283 7.442 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -9.826 10.179 7.839 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -7.600 11.366 6.673 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -8.747 12.261 7.650 1.00 0.00 H new ATOM 973 N ILE A 62 -5.352 9.134 10.667 1.00 0.00 N ATOM 974 CA ILE A 62 -4.237 8.189 10.641 1.00 0.00 C ATOM 975 C ILE A 62 -4.541 6.954 9.780 1.00 0.00 C ATOM 976 O ILE A 62 -3.643 6.408 9.147 1.00 0.00 O ATOM 977 CB ILE A 62 -3.905 7.754 12.068 1.00 0.00 C ATOM 978 CG1 ILE A 62 -2.591 6.975 12.070 1.00 0.00 C ATOM 979 CG2 ILE A 62 -5.025 6.868 12.611 1.00 0.00 C ATOM 980 CD1 ILE A 62 -2.204 6.623 13.511 1.00 0.00 C ATOM 0 H ILE A 62 -5.583 9.486 11.596 1.00 0.00 H new ATOM 0 HA ILE A 62 -3.383 8.697 10.192 1.00 0.00 H new ATOM 0 HB ILE A 62 -3.806 8.636 12.700 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -2.695 6.066 11.478 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -1.804 7.569 11.606 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -4.784 6.560 13.629 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -5.962 7.426 12.612 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -5.129 5.985 11.980 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -1.266 6.067 13.510 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -2.083 7.539 14.089 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -2.988 6.012 13.959 1.00 0.00 H new ATOM 992 N GLN A 63 -5.797 6.510 9.772 1.00 0.00 N ATOM 993 CA GLN A 63 -6.173 5.323 8.986 1.00 0.00 C ATOM 994 C GLN A 63 -6.039 5.576 7.482 1.00 0.00 C ATOM 995 O GLN A 63 -5.726 4.662 6.720 1.00 0.00 O ATOM 996 CB GLN A 63 -7.610 4.908 9.310 1.00 0.00 C ATOM 997 CG GLN A 63 -8.488 6.149 9.434 1.00 0.00 C ATOM 998 CD GLN A 63 -9.959 5.749 9.423 1.00 0.00 C ATOM 999 OE1 GLN A 63 -10.497 5.330 10.448 1.00 0.00 O ATOM 1000 NE2 GLN A 63 -10.647 5.854 8.319 1.00 0.00 N ATOM 0 H GLN A 63 -6.563 6.941 10.289 1.00 0.00 H new ATOM 0 HA GLN A 63 -5.489 4.519 9.258 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -7.995 4.255 8.527 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -7.634 4.340 10.240 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -8.254 6.680 10.357 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -8.283 6.834 8.611 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -10.200 6.201 7.471 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -11.632 5.589 8.305 1.00 0.00 H new ATOM 1009 N ASP A 64 -6.275 6.809 7.061 1.00 0.00 N ATOM 1010 CA ASP A 64 -6.165 7.145 5.638 1.00 0.00 C ATOM 1011 C ASP A 64 -4.718 7.418 5.264 1.00 0.00 C ATOM 1012 O ASP A 64 -4.289 7.127 4.148 1.00 0.00 O ATOM 1013 CB ASP A 64 -7.002 8.374 5.319 1.00 0.00 C ATOM 1014 CG ASP A 64 -6.848 8.742 3.847 1.00 0.00 C ATOM 1015 OD1 ASP A 64 -6.276 7.951 3.116 1.00 0.00 O ATOM 1016 OD2 ASP A 64 -7.303 9.810 3.473 1.00 0.00 O ATOM 0 H ASP A 64 -6.540 7.586 7.667 1.00 0.00 H new ATOM 0 HA ASP A 64 -6.531 6.295 5.062 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -8.050 8.179 5.546 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -6.690 9.209 5.946 1.00 0.00 H new ATOM 1021 N VAL A 65 -3.972 7.982 6.200 1.00 0.00 N ATOM 1022 CA VAL A 65 -2.570 8.296 5.958 1.00 0.00 C ATOM 1023 C VAL A 65 -1.736 7.025 5.852 1.00 0.00 C ATOM 1024 O VAL A 65 -0.902 6.900 4.961 1.00 0.00 O ATOM 1025 CB VAL A 65 -2.029 9.180 7.082 1.00 0.00 C ATOM 1026 CG1 VAL A 65 -0.538 9.448 6.852 1.00 0.00 C ATOM 1027 CG2 VAL A 65 -2.789 10.515 7.096 1.00 0.00 C ATOM 0 H VAL A 65 -4.310 8.231 7.130 1.00 0.00 H new ATOM 0 HA VAL A 65 -2.500 8.832 5.012 1.00 0.00 H new ATOM 0 HB VAL A 65 -2.165 8.672 8.037 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -0.154 10.078 7.654 1.00 0.00 H new ATOM 0 HG12 VAL A 65 0.004 8.503 6.842 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -0.403 9.954 5.896 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -2.403 11.145 7.897 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -2.654 11.021 6.140 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -3.850 10.328 7.261 1.00 0.00 H new ATOM 1037 N VAL A 66 -1.965 6.080 6.756 1.00 0.00 N ATOM 1038 CA VAL A 66 -1.218 4.830 6.724 1.00 0.00 C ATOM 1039 C VAL A 66 -1.510 4.091 5.429 1.00 0.00 C ATOM 1040 O VAL A 66 -0.632 3.447 4.854 1.00 0.00 O ATOM 1041 CB VAL A 66 -1.595 3.952 7.919 1.00 0.00 C ATOM 1042 CG1 VAL A 66 -3.100 3.686 7.898 1.00 0.00 C ATOM 1043 CG2 VAL A 66 -0.842 2.618 7.834 1.00 0.00 C ATOM 0 H VAL A 66 -2.650 6.153 7.508 1.00 0.00 H new ATOM 0 HA VAL A 66 -0.153 5.056 6.779 1.00 0.00 H new ATOM 0 HB VAL A 66 -1.326 4.463 8.844 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -3.371 3.061 8.749 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -3.638 4.632 7.958 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -3.366 3.175 6.973 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -1.111 1.993 8.686 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -1.111 2.107 6.910 1.00 0.00 H new ATOM 0 HG23 VAL A 66 0.232 2.805 7.846 1.00 0.00 H new ATOM 1053 N LYS A 67 -2.752 4.200 4.968 1.00 0.00 N ATOM 1054 CA LYS A 67 -3.154 3.550 3.730 1.00 0.00 C ATOM 1055 C LYS A 67 -2.443 4.192 2.543 1.00 0.00 C ATOM 1056 O LYS A 67 -1.657 3.542 1.852 1.00 0.00 O ATOM 1057 CB LYS A 67 -4.670 3.671 3.550 1.00 0.00 C ATOM 1058 CG LYS A 67 -5.102 2.904 2.295 1.00 0.00 C ATOM 1059 CD LYS A 67 -6.619 2.635 2.345 1.00 0.00 C ATOM 1060 CE LYS A 67 -6.950 1.620 3.463 1.00 0.00 C ATOM 1061 NZ LYS A 67 -8.123 0.798 3.049 1.00 0.00 N ATOM 0 H LYS A 67 -3.491 4.729 5.431 1.00 0.00 H new ATOM 0 HA LYS A 67 -2.879 2.497 3.780 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -5.183 3.274 4.426 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -4.953 4.720 3.463 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -4.854 3.479 1.403 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -4.558 1.962 2.228 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -7.154 3.568 2.522 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -6.958 2.250 1.383 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -6.090 0.978 3.654 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -7.169 2.144 4.393 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -7.972 -0.191 3.335 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -8.982 1.164 3.507 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -8.234 0.847 2.016 1.00 0.00 H new ATOM 1075 N ALA A 68 -2.720 5.472 2.316 1.00 0.00 N ATOM 1076 CA ALA A 68 -2.097 6.195 1.213 1.00 0.00 C ATOM 1077 C ALA A 68 -0.585 6.006 1.237 1.00 0.00 C ATOM 1078 O ALA A 68 0.064 5.949 0.193 1.00 0.00 O ATOM 1079 CB ALA A 68 -2.424 7.685 1.323 1.00 0.00 C ATOM 0 H ALA A 68 -3.367 6.027 2.877 1.00 0.00 H new ATOM 0 HA ALA A 68 -2.487 5.801 0.275 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -1.957 8.222 0.497 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -3.504 7.824 1.282 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -2.044 8.072 2.269 1.00 0.00 H new ATOM 1085 N PHE A 69 -0.032 5.916 2.439 1.00 0.00 N ATOM 1086 CA PHE A 69 1.406 5.743 2.605 1.00 0.00 C ATOM 1087 C PHE A 69 1.885 4.480 1.885 1.00 0.00 C ATOM 1088 O PHE A 69 2.916 4.495 1.216 1.00 0.00 O ATOM 1089 CB PHE A 69 1.749 5.661 4.118 1.00 0.00 C ATOM 1090 CG PHE A 69 2.143 7.034 4.640 1.00 0.00 C ATOM 1091 CD1 PHE A 69 1.480 8.181 4.177 1.00 0.00 C ATOM 1092 CD2 PHE A 69 3.184 7.159 5.574 1.00 0.00 C ATOM 1093 CE1 PHE A 69 1.858 9.444 4.643 1.00 0.00 C ATOM 1094 CE2 PHE A 69 3.555 8.427 6.042 1.00 0.00 C ATOM 1095 CZ PHE A 69 2.892 9.567 5.574 1.00 0.00 C ATOM 0 H PHE A 69 -0.556 5.960 3.313 1.00 0.00 H new ATOM 0 HA PHE A 69 1.917 6.600 2.165 1.00 0.00 H new ATOM 0 HB2 PHE A 69 0.890 5.285 4.674 1.00 0.00 H new ATOM 0 HB3 PHE A 69 2.565 4.955 4.276 1.00 0.00 H new ATOM 0 HD1 PHE A 69 0.677 8.088 3.460 1.00 0.00 H new ATOM 0 HD2 PHE A 69 3.698 6.279 5.931 1.00 0.00 H new ATOM 0 HE1 PHE A 69 1.350 10.326 4.282 1.00 0.00 H new ATOM 0 HE2 PHE A 69 4.353 8.524 6.764 1.00 0.00 H new ATOM 0 HZ PHE A 69 3.180 10.544 5.933 1.00 0.00 H new ATOM 1105 N GLY A 70 1.138 3.395 2.031 1.00 0.00 N ATOM 1106 CA GLY A 70 1.509 2.136 1.394 1.00 0.00 C ATOM 1107 C GLY A 70 1.468 2.243 -0.131 1.00 0.00 C ATOM 1108 O GLY A 70 2.284 1.640 -0.825 1.00 0.00 O ATOM 0 H GLY A 70 0.279 3.359 2.579 1.00 0.00 H new ATOM 0 HA2 GLY A 70 2.511 1.848 1.712 1.00 0.00 H new ATOM 0 HA3 GLY A 70 0.831 1.348 1.722 1.00 0.00 H new ATOM 1112 N GLN A 71 0.512 3.006 -0.649 1.00 0.00 N ATOM 1113 CA GLN A 71 0.379 3.165 -2.094 1.00 0.00 C ATOM 1114 C GLN A 71 1.657 3.744 -2.708 1.00 0.00 C ATOM 1115 O GLN A 71 2.191 3.201 -3.675 1.00 0.00 O ATOM 1116 CB GLN A 71 -0.812 4.085 -2.412 1.00 0.00 C ATOM 1117 CG GLN A 71 -2.113 3.282 -2.357 1.00 0.00 C ATOM 1118 CD GLN A 71 -3.309 4.228 -2.323 1.00 0.00 C ATOM 1119 OE1 GLN A 71 -3.155 5.413 -2.027 1.00 0.00 O ATOM 1120 NE2 GLN A 71 -4.498 3.772 -2.610 1.00 0.00 N ATOM 0 H GLN A 71 -0.176 3.519 -0.098 1.00 0.00 H new ATOM 0 HA GLN A 71 0.207 2.180 -2.528 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -0.850 4.907 -1.697 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -0.688 4.528 -3.400 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -2.182 2.626 -3.225 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -2.119 2.643 -1.474 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -4.622 2.790 -2.855 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -5.303 4.398 -2.589 1.00 0.00 H new ATOM 1129 N PHE A 72 2.136 4.847 -2.149 1.00 0.00 N ATOM 1130 CA PHE A 72 3.346 5.490 -2.661 1.00 0.00 C ATOM 1131 C PHE A 72 4.592 4.650 -2.340 1.00 0.00 C ATOM 1132 O PHE A 72 5.474 4.492 -3.182 1.00 0.00 O ATOM 1133 CB PHE A 72 3.491 6.897 -2.036 1.00 0.00 C ATOM 1134 CG PHE A 72 2.927 7.949 -2.974 1.00 0.00 C ATOM 1135 CD1 PHE A 72 3.497 8.129 -4.241 1.00 0.00 C ATOM 1136 CD2 PHE A 72 1.842 8.742 -2.575 1.00 0.00 C ATOM 1137 CE1 PHE A 72 2.983 9.100 -5.107 1.00 0.00 C ATOM 1138 CE2 PHE A 72 1.331 9.712 -3.443 1.00 0.00 C ATOM 1139 CZ PHE A 72 1.902 9.890 -4.708 1.00 0.00 C ATOM 0 H PHE A 72 1.712 5.315 -1.348 1.00 0.00 H new ATOM 0 HA PHE A 72 3.259 5.576 -3.744 1.00 0.00 H new ATOM 0 HB2 PHE A 72 2.968 6.934 -1.080 1.00 0.00 H new ATOM 0 HB3 PHE A 72 4.541 7.106 -1.833 1.00 0.00 H new ATOM 0 HD1 PHE A 72 4.333 7.518 -4.549 1.00 0.00 H new ATOM 0 HD2 PHE A 72 1.401 8.604 -1.599 1.00 0.00 H new ATOM 0 HE1 PHE A 72 3.422 9.239 -6.084 1.00 0.00 H new ATOM 0 HE2 PHE A 72 0.495 10.324 -3.137 1.00 0.00 H new ATOM 0 HZ PHE A 72 1.506 10.640 -5.377 1.00 0.00 H new ATOM 1149 N LEU A 73 4.664 4.133 -1.117 1.00 0.00 N ATOM 1150 CA LEU A 73 5.818 3.335 -0.711 1.00 0.00 C ATOM 1151 C LEU A 73 6.147 2.279 -1.763 1.00 0.00 C ATOM 1152 O LEU A 73 7.312 2.059 -2.090 1.00 0.00 O ATOM 1153 CB LEU A 73 5.553 2.654 0.647 1.00 0.00 C ATOM 1154 CG LEU A 73 6.893 2.448 1.396 1.00 0.00 C ATOM 1155 CD1 LEU A 73 7.238 3.708 2.202 1.00 0.00 C ATOM 1156 CD2 LEU A 73 6.774 1.253 2.347 1.00 0.00 C ATOM 0 H LEU A 73 3.949 4.249 -0.399 1.00 0.00 H new ATOM 0 HA LEU A 73 6.671 4.006 -0.612 1.00 0.00 H new ATOM 0 HB2 LEU A 73 4.880 3.266 1.247 1.00 0.00 H new ATOM 0 HB3 LEU A 73 5.059 1.694 0.494 1.00 0.00 H new ATOM 0 HG LEU A 73 7.682 2.257 0.668 1.00 0.00 H new ATOM 0 HD11 LEU A 73 8.181 3.557 2.727 1.00 0.00 H new ATOM 0 HD12 LEU A 73 7.330 4.558 1.526 1.00 0.00 H new ATOM 0 HD13 LEU A 73 6.447 3.904 2.926 1.00 0.00 H new ATOM 0 HD21 LEU A 73 7.718 1.111 2.872 1.00 0.00 H new ATOM 0 HD22 LEU A 73 5.981 1.441 3.071 1.00 0.00 H new ATOM 0 HD23 LEU A 73 6.538 0.355 1.776 1.00 0.00 H new ATOM 1168 N PHE A 74 5.117 1.632 -2.286 1.00 0.00 N ATOM 1169 CA PHE A 74 5.313 0.601 -3.299 1.00 0.00 C ATOM 1170 C PHE A 74 5.937 1.189 -4.560 1.00 0.00 C ATOM 1171 O PHE A 74 6.852 0.608 -5.140 1.00 0.00 O ATOM 1172 CB PHE A 74 3.972 -0.042 -3.657 1.00 0.00 C ATOM 1173 CG PHE A 74 4.221 -1.300 -4.445 1.00 0.00 C ATOM 1174 CD1 PHE A 74 4.409 -1.233 -5.830 1.00 0.00 C ATOM 1175 CD2 PHE A 74 4.272 -2.536 -3.791 1.00 0.00 C ATOM 1176 CE1 PHE A 74 4.648 -2.401 -6.561 1.00 0.00 C ATOM 1177 CE2 PHE A 74 4.508 -3.704 -4.519 1.00 0.00 C ATOM 1178 CZ PHE A 74 4.697 -3.637 -5.906 1.00 0.00 C ATOM 0 H PHE A 74 4.144 1.799 -2.030 1.00 0.00 H new ATOM 0 HA PHE A 74 5.987 -0.151 -2.889 1.00 0.00 H new ATOM 0 HB2 PHE A 74 3.412 -0.271 -2.751 1.00 0.00 H new ATOM 0 HB3 PHE A 74 3.366 0.652 -4.239 1.00 0.00 H new ATOM 0 HD1 PHE A 74 4.370 -0.279 -6.335 1.00 0.00 H new ATOM 0 HD2 PHE A 74 4.129 -2.587 -2.722 1.00 0.00 H new ATOM 0 HE1 PHE A 74 4.795 -2.349 -7.630 1.00 0.00 H new ATOM 0 HE2 PHE A 74 4.545 -4.658 -4.014 1.00 0.00 H new ATOM 0 HZ PHE A 74 4.881 -4.540 -6.470 1.00 0.00 H new ATOM 1188 N ASN A 75 5.426 2.335 -4.985 1.00 0.00 N ATOM 1189 CA ASN A 75 5.927 2.988 -6.189 1.00 0.00 C ATOM 1190 C ASN A 75 7.435 3.249 -6.099 1.00 0.00 C ATOM 1191 O ASN A 75 8.183 2.929 -7.022 1.00 0.00 O ATOM 1192 CB ASN A 75 5.181 4.321 -6.398 1.00 0.00 C ATOM 1193 CG ASN A 75 3.859 4.080 -7.126 1.00 0.00 C ATOM 1194 OD1 ASN A 75 3.844 3.900 -8.344 1.00 0.00 O ATOM 1195 ND2 ASN A 75 2.744 4.065 -6.448 1.00 0.00 N ATOM 0 H ASN A 75 4.668 2.832 -4.517 1.00 0.00 H new ATOM 0 HA ASN A 75 5.750 2.324 -7.035 1.00 0.00 H new ATOM 0 HB2 ASN A 75 4.992 4.795 -5.435 1.00 0.00 H new ATOM 0 HB3 ASN A 75 5.802 5.007 -6.975 1.00 0.00 H new ATOM 0 HD21 ASN A 75 1.858 3.904 -6.927 1.00 0.00 H new ATOM 0 HD22 ASN A 75 2.759 4.214 -5.439 1.00 0.00 H new ATOM 1202 N GLY A 76 7.869 3.845 -4.996 1.00 0.00 N ATOM 1203 CA GLY A 76 9.285 4.156 -4.818 1.00 0.00 C ATOM 1204 C GLY A 76 10.126 2.897 -4.656 1.00 0.00 C ATOM 1205 O GLY A 76 11.208 2.788 -5.231 1.00 0.00 O ATOM 0 H GLY A 76 7.270 4.121 -4.218 1.00 0.00 H new ATOM 0 HA2 GLY A 76 9.643 4.724 -5.677 1.00 0.00 H new ATOM 0 HA3 GLY A 76 9.410 4.792 -3.941 1.00 0.00 H new ATOM 1209 N LEU A 77 9.633 1.951 -3.873 1.00 0.00 N ATOM 1210 CA LEU A 77 10.366 0.711 -3.653 1.00 0.00 C ATOM 1211 C LEU A 77 10.643 0.015 -4.983 1.00 0.00 C ATOM 1212 O LEU A 77 11.789 -0.307 -5.301 1.00 0.00 O ATOM 1213 CB LEU A 77 9.558 -0.219 -2.731 1.00 0.00 C ATOM 1214 CG LEU A 77 9.792 0.166 -1.257 1.00 0.00 C ATOM 1215 CD1 LEU A 77 8.817 -0.619 -0.371 1.00 0.00 C ATOM 1216 CD2 LEU A 77 11.252 -0.163 -0.844 1.00 0.00 C ATOM 0 H LEU A 77 8.740 2.014 -3.384 1.00 0.00 H new ATOM 0 HA LEU A 77 11.318 0.946 -3.177 1.00 0.00 H new ATOM 0 HB2 LEU A 77 8.497 -0.149 -2.970 1.00 0.00 H new ATOM 0 HB3 LEU A 77 9.854 -1.255 -2.896 1.00 0.00 H new ATOM 0 HG LEU A 77 9.624 1.236 -1.133 1.00 0.00 H new ATOM 0 HD11 LEU A 77 8.978 -0.351 0.673 1.00 0.00 H new ATOM 0 HD12 LEU A 77 7.793 -0.377 -0.654 1.00 0.00 H new ATOM 0 HD13 LEU A 77 8.987 -1.688 -0.501 1.00 0.00 H new ATOM 0 HD21 LEU A 77 11.406 0.113 0.199 1.00 0.00 H new ATOM 0 HD22 LEU A 77 11.433 -1.231 -0.967 1.00 0.00 H new ATOM 0 HD23 LEU A 77 11.943 0.397 -1.473 1.00 0.00 H new ATOM 1228 N ALA A 78 9.590 -0.211 -5.753 1.00 0.00 N ATOM 1229 CA ALA A 78 9.729 -0.865 -7.046 1.00 0.00 C ATOM 1230 C ALA A 78 10.876 -0.252 -7.837 1.00 0.00 C ATOM 1231 O ALA A 78 11.629 -0.955 -8.505 1.00 0.00 O ATOM 1232 CB ALA A 78 8.434 -0.721 -7.839 1.00 0.00 C ATOM 0 H ALA A 78 8.634 0.047 -5.507 1.00 0.00 H new ATOM 0 HA ALA A 78 9.942 -1.921 -6.877 1.00 0.00 H new ATOM 0 HB1 ALA A 78 8.543 -1.212 -8.806 1.00 0.00 H new ATOM 0 HB2 ALA A 78 7.616 -1.184 -7.287 1.00 0.00 H new ATOM 0 HB3 ALA A 78 8.216 0.336 -7.991 1.00 0.00 H new ATOM 1238 N SER A 79 10.994 1.067 -7.764 1.00 0.00 N ATOM 1239 CA SER A 79 12.046 1.774 -8.486 1.00 0.00 C ATOM 1240 C SER A 79 13.422 1.444 -7.907 1.00 0.00 C ATOM 1241 O SER A 79 14.440 1.590 -8.585 1.00 0.00 O ATOM 1242 CB SER A 79 11.801 3.281 -8.412 1.00 0.00 C ATOM 1243 OG SER A 79 10.765 3.633 -9.321 1.00 0.00 O ATOM 0 H SER A 79 10.378 1.667 -7.215 1.00 0.00 H new ATOM 0 HA SER A 79 12.025 1.452 -9.527 1.00 0.00 H new ATOM 0 HB2 SER A 79 11.523 3.567 -7.397 1.00 0.00 H new ATOM 0 HB3 SER A 79 12.715 3.822 -8.657 1.00 0.00 H new ATOM 0 HG SER A 79 10.604 4.599 -9.275 1.00 0.00 H new ATOM 1249 N ARG A 80 13.448 1.005 -6.650 1.00 0.00 N ATOM 1250 CA ARG A 80 14.710 0.663 -5.990 1.00 0.00 C ATOM 1251 C ARG A 80 15.011 -0.822 -6.148 1.00 0.00 C ATOM 1252 O ARG A 80 16.170 -1.222 -6.260 1.00 0.00 O ATOM 1253 CB ARG A 80 14.631 1.009 -4.497 1.00 0.00 C ATOM 1254 CG ARG A 80 14.294 2.502 -4.317 1.00 0.00 C ATOM 1255 CD ARG A 80 15.573 3.345 -4.419 1.00 0.00 C ATOM 1256 NE ARG A 80 16.555 2.897 -3.439 1.00 0.00 N ATOM 1257 CZ ARG A 80 17.718 3.523 -3.296 1.00 0.00 C ATOM 1258 NH1 ARG A 80 17.996 4.560 -4.037 1.00 0.00 N ATOM 1259 NH2 ARG A 80 18.582 3.102 -2.412 1.00 0.00 N ATOM 0 H ARG A 80 12.618 0.878 -6.071 1.00 0.00 H new ATOM 0 HA ARG A 80 15.509 1.239 -6.457 1.00 0.00 H new ATOM 0 HB2 ARG A 80 13.871 0.396 -4.013 1.00 0.00 H new ATOM 0 HB3 ARG A 80 15.580 0.781 -4.012 1.00 0.00 H new ATOM 0 HG2 ARG A 80 13.580 2.816 -5.078 1.00 0.00 H new ATOM 0 HG3 ARG A 80 13.819 2.662 -3.349 1.00 0.00 H new ATOM 0 HD2 ARG A 80 15.989 3.266 -5.423 1.00 0.00 H new ATOM 0 HD3 ARG A 80 15.338 4.396 -4.253 1.00 0.00 H new ATOM 0 HE ARG A 80 16.345 2.089 -2.853 1.00 0.00 H new ATOM 0 HH11 ARG A 80 17.320 4.890 -4.726 1.00 0.00 H new ATOM 0 HH12 ARG A 80 18.889 5.041 -3.927 1.00 0.00 H new ATOM 0 HH21 ARG A 80 18.364 2.292 -1.831 1.00 0.00 H new ATOM 0 HH22 ARG A 80 19.475 3.583 -2.302 1.00 0.00 H new ATOM 1273 N HIS A 81 13.956 -1.635 -6.158 1.00 0.00 N ATOM 1274 CA HIS A 81 14.106 -3.088 -6.302 1.00 0.00 C ATOM 1275 C HIS A 81 13.444 -3.557 -7.600 1.00 0.00 C ATOM 1276 O HIS A 81 13.035 -4.713 -7.722 1.00 0.00 O ATOM 1277 CB HIS A 81 13.460 -3.800 -5.096 1.00 0.00 C ATOM 1278 CG HIS A 81 14.442 -3.870 -3.949 1.00 0.00 C ATOM 1279 ND1 HIS A 81 15.487 -3.060 -3.578 1.00 0.00 N flip ATOM 1280 CD2 HIS A 81 14.401 -4.888 -3.006 1.00 0.00 C flip ATOM 1281 CE1 HIS A 81 16.085 -3.562 -2.428 1.00 0.00 C flip ATOM 1282 NE2 HIS A 81 15.393 -4.663 -2.125 1.00 0.00 N flip ATOM 0 H HIS A 81 12.991 -1.317 -6.069 1.00 0.00 H new ATOM 0 HA HIS A 81 15.167 -3.335 -6.338 1.00 0.00 H new ATOM 0 HB2 HIS A 81 12.563 -3.265 -4.785 1.00 0.00 H new ATOM 0 HB3 HIS A 81 13.149 -4.805 -5.381 1.00 0.00 H new ATOM 0 HD2 HIS A 81 13.701 -5.710 -2.984 1.00 0.00 H new ATOM 0 HE1 HIS A 81 16.928 -3.150 -1.894 1.00 0.00 H new ATOM 0 HE2 HIS A 81 15.592 -5.261 -1.323 1.00 0.00 H new ATOM 1291 N THR A 82 13.344 -2.649 -8.562 1.00 0.00 N ATOM 1292 CA THR A 82 12.734 -2.958 -9.848 1.00 0.00 C ATOM 1293 C THR A 82 13.181 -4.333 -10.353 1.00 0.00 C ATOM 1294 O THR A 82 12.443 -5.013 -11.064 1.00 0.00 O ATOM 1295 CB THR A 82 13.128 -1.881 -10.873 1.00 0.00 C ATOM 1296 OG1 THR A 82 13.224 -0.623 -10.219 1.00 0.00 O ATOM 1297 CG2 THR A 82 12.069 -1.803 -11.973 1.00 0.00 C ATOM 0 H THR A 82 13.679 -1.689 -8.475 1.00 0.00 H new ATOM 0 HA THR A 82 11.652 -2.974 -9.721 1.00 0.00 H new ATOM 0 HB THR A 82 14.089 -2.139 -11.317 1.00 0.00 H new ATOM 0 HG1 THR A 82 12.446 -0.497 -9.636 1.00 0.00 H new ATOM 0 HG21 THR A 82 12.352 -1.039 -12.697 1.00 0.00 H new ATOM 0 HG22 THR A 82 11.994 -2.768 -12.475 1.00 0.00 H new ATOM 0 HG23 THR A 82 11.105 -1.547 -11.533 1.00 0.00 H new ATOM 1305 N ASP A 83 14.395 -4.727 -9.985 1.00 0.00 N ATOM 1306 CA ASP A 83 14.934 -6.014 -10.414 1.00 0.00 C ATOM 1307 C ASP A 83 14.134 -7.168 -9.823 1.00 0.00 C ATOM 1308 O ASP A 83 13.806 -8.128 -10.520 1.00 0.00 O ATOM 1309 CB ASP A 83 16.397 -6.134 -9.983 1.00 0.00 C ATOM 1310 CG ASP A 83 16.976 -7.458 -10.468 1.00 0.00 C ATOM 1311 OD1 ASP A 83 16.277 -8.163 -11.178 1.00 0.00 O ATOM 1312 OD2 ASP A 83 18.111 -7.747 -10.125 1.00 0.00 O ATOM 0 H ASP A 83 15.021 -4.179 -9.395 1.00 0.00 H new ATOM 0 HA ASP A 83 14.864 -6.066 -11.501 1.00 0.00 H new ATOM 0 HB2 ASP A 83 16.974 -5.304 -10.391 1.00 0.00 H new ATOM 0 HB3 ASP A 83 16.471 -6.071 -8.897 1.00 0.00 H new ATOM 1317 N VAL A 84 13.824 -7.071 -8.538 1.00 0.00 N ATOM 1318 CA VAL A 84 13.064 -8.117 -7.869 1.00 0.00 C ATOM 1319 C VAL A 84 11.617 -8.118 -8.342 1.00 0.00 C ATOM 1320 O VAL A 84 11.060 -9.164 -8.672 1.00 0.00 O ATOM 1321 CB VAL A 84 13.103 -7.903 -6.357 1.00 0.00 C ATOM 1322 CG1 VAL A 84 12.258 -8.978 -5.671 1.00 0.00 C ATOM 1323 CG2 VAL A 84 14.549 -8.001 -5.867 1.00 0.00 C ATOM 0 H VAL A 84 14.084 -6.285 -7.942 1.00 0.00 H new ATOM 0 HA VAL A 84 13.515 -9.078 -8.115 1.00 0.00 H new ATOM 0 HB VAL A 84 12.704 -6.918 -6.117 1.00 0.00 H new ATOM 0 HG11 VAL A 84 12.284 -8.828 -4.592 1.00 0.00 H new ATOM 0 HG12 VAL A 84 11.228 -8.910 -6.022 1.00 0.00 H new ATOM 0 HG13 VAL A 84 12.659 -9.963 -5.910 1.00 0.00 H new ATOM 0 HG21 VAL A 84 14.579 -7.848 -4.788 1.00 0.00 H new ATOM 0 HG22 VAL A 84 14.948 -8.987 -6.105 1.00 0.00 H new ATOM 0 HG23 VAL A 84 15.152 -7.237 -6.358 1.00 0.00 H new ATOM 1333 N VAL A 85 11.011 -6.940 -8.352 1.00 0.00 N ATOM 1334 CA VAL A 85 9.620 -6.801 -8.766 1.00 0.00 C ATOM 1335 C VAL A 85 9.418 -7.211 -10.223 1.00 0.00 C ATOM 1336 O VAL A 85 8.536 -7.998 -10.526 1.00 0.00 O ATOM 1337 CB VAL A 85 9.179 -5.346 -8.592 1.00 0.00 C ATOM 1338 CG1 VAL A 85 7.710 -5.202 -8.991 1.00 0.00 C ATOM 1339 CG2 VAL A 85 9.351 -4.927 -7.129 1.00 0.00 C ATOM 0 H VAL A 85 11.459 -6.066 -8.078 1.00 0.00 H new ATOM 0 HA VAL A 85 9.020 -7.461 -8.140 1.00 0.00 H new ATOM 0 HB VAL A 85 9.792 -4.708 -9.228 1.00 0.00 H new ATOM 0 HG11 VAL A 85 7.399 -4.165 -8.866 1.00 0.00 H new ATOM 0 HG12 VAL A 85 7.586 -5.495 -10.034 1.00 0.00 H new ATOM 0 HG13 VAL A 85 7.097 -5.843 -8.358 1.00 0.00 H new ATOM 0 HG21 VAL A 85 9.036 -3.890 -7.008 1.00 0.00 H new ATOM 0 HG22 VAL A 85 8.741 -5.568 -6.493 1.00 0.00 H new ATOM 0 HG23 VAL A 85 10.399 -5.024 -6.844 1.00 0.00 H new ATOM 1349 N ASP A 86 10.232 -6.648 -11.113 1.00 0.00 N ATOM 1350 CA ASP A 86 10.119 -6.927 -12.555 1.00 0.00 C ATOM 1351 C ASP A 86 9.961 -8.424 -12.868 1.00 0.00 C ATOM 1352 O ASP A 86 9.736 -8.794 -14.020 1.00 0.00 O ATOM 1353 CB ASP A 86 11.349 -6.385 -13.286 1.00 0.00 C ATOM 1354 CG ASP A 86 11.252 -6.700 -14.775 1.00 0.00 C ATOM 1355 OD1 ASP A 86 10.140 -6.818 -15.264 1.00 0.00 O ATOM 1356 OD2 ASP A 86 12.290 -6.816 -15.405 1.00 0.00 O ATOM 0 H ASP A 86 10.978 -5.996 -10.868 1.00 0.00 H new ATOM 0 HA ASP A 86 9.214 -6.427 -12.901 1.00 0.00 H new ATOM 0 HB2 ASP A 86 11.425 -5.308 -13.138 1.00 0.00 H new ATOM 0 HB3 ASP A 86 12.254 -6.828 -12.870 1.00 0.00 H new ATOM 1361 N LYS A 87 10.076 -9.279 -11.861 1.00 0.00 N ATOM 1362 CA LYS A 87 9.938 -10.724 -12.088 1.00 0.00 C ATOM 1363 C LYS A 87 8.458 -11.131 -12.143 1.00 0.00 C ATOM 1364 O LYS A 87 8.133 -12.285 -12.423 1.00 0.00 O ATOM 1365 CB LYS A 87 10.652 -11.502 -10.965 1.00 0.00 C ATOM 1366 CG LYS A 87 12.165 -11.576 -11.261 1.00 0.00 C ATOM 1367 CD LYS A 87 12.948 -11.794 -9.956 1.00 0.00 C ATOM 1368 CE LYS A 87 12.331 -12.950 -9.153 1.00 0.00 C ATOM 1369 NZ LYS A 87 13.374 -13.556 -8.278 1.00 0.00 N ATOM 0 H LYS A 87 10.261 -9.012 -10.894 1.00 0.00 H new ATOM 0 HA LYS A 87 10.398 -10.966 -13.046 1.00 0.00 H new ATOM 0 HB2 LYS A 87 10.483 -11.012 -10.006 1.00 0.00 H new ATOM 0 HB3 LYS A 87 10.238 -12.507 -10.886 1.00 0.00 H new ATOM 0 HG2 LYS A 87 12.368 -12.390 -11.957 1.00 0.00 H new ATOM 0 HG3 LYS A 87 12.495 -10.656 -11.743 1.00 0.00 H new ATOM 0 HD2 LYS A 87 13.991 -12.015 -10.182 1.00 0.00 H new ATOM 0 HD3 LYS A 87 12.937 -10.881 -9.360 1.00 0.00 H new ATOM 0 HE2 LYS A 87 11.501 -12.585 -8.549 1.00 0.00 H new ATOM 0 HE3 LYS A 87 11.926 -13.702 -9.830 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 12.959 -14.339 -7.734 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 14.152 -13.918 -8.865 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 13.740 -12.835 -7.624 1.00 0.00 H new ATOM 1383 N PHE A 88 7.571 -10.181 -11.855 1.00 0.00 N ATOM 1384 CA PHE A 88 6.124 -10.450 -11.850 1.00 0.00 C ATOM 1385 C PHE A 88 5.467 -10.101 -13.199 1.00 0.00 C ATOM 1386 O PHE A 88 4.519 -10.757 -13.624 1.00 0.00 O ATOM 1387 CB PHE A 88 5.456 -9.627 -10.714 1.00 0.00 C ATOM 1388 CG PHE A 88 5.071 -8.231 -11.217 1.00 0.00 C ATOM 1389 CD1 PHE A 88 6.017 -7.431 -11.872 1.00 0.00 C ATOM 1390 CD2 PHE A 88 3.768 -7.751 -11.033 1.00 0.00 C ATOM 1391 CE1 PHE A 88 5.663 -6.163 -12.336 1.00 0.00 C ATOM 1392 CE2 PHE A 88 3.416 -6.483 -11.500 1.00 0.00 C ATOM 1393 CZ PHE A 88 4.364 -5.688 -12.150 1.00 0.00 C ATOM 0 H PHE A 88 7.822 -9.220 -11.622 1.00 0.00 H new ATOM 0 HA PHE A 88 5.980 -11.517 -11.682 1.00 0.00 H new ATOM 0 HB2 PHE A 88 4.569 -10.147 -10.353 1.00 0.00 H new ATOM 0 HB3 PHE A 88 6.140 -9.540 -9.870 1.00 0.00 H new ATOM 0 HD1 PHE A 88 7.023 -7.797 -12.018 1.00 0.00 H new ATOM 0 HD2 PHE A 88 3.034 -8.363 -10.529 1.00 0.00 H new ATOM 0 HE1 PHE A 88 6.395 -5.549 -12.839 1.00 0.00 H new ATOM 0 HE2 PHE A 88 2.410 -6.116 -11.359 1.00 0.00 H new ATOM 0 HZ PHE A 88 4.091 -4.706 -12.508 1.00 0.00 H new ATOM 1403 N ASP A 89 5.986 -9.086 -13.855 1.00 0.00 N ATOM 1404 CA ASP A 89 5.452 -8.651 -15.147 1.00 0.00 C ATOM 1405 C ASP A 89 3.913 -8.408 -15.085 1.00 0.00 C ATOM 1406 O ASP A 89 3.343 -7.808 -15.996 1.00 0.00 O ATOM 1407 CB ASP A 89 5.755 -9.703 -16.214 1.00 0.00 C ATOM 1408 CG ASP A 89 7.256 -9.767 -16.472 1.00 0.00 C ATOM 1409 OD1 ASP A 89 7.946 -8.845 -16.069 1.00 0.00 O ATOM 1410 OD2 ASP A 89 7.694 -10.736 -17.070 1.00 0.00 O ATOM 0 H ASP A 89 6.780 -8.539 -13.522 1.00 0.00 H new ATOM 0 HA ASP A 89 5.934 -7.707 -15.402 1.00 0.00 H new ATOM 0 HB2 ASP A 89 5.392 -10.678 -15.889 1.00 0.00 H new ATOM 0 HB3 ASP A 89 5.229 -9.459 -17.137 1.00 0.00 H new ATOM 1415 N ASP A 90 3.255 -8.889 -14.013 1.00 0.00 N ATOM 1416 CA ASP A 90 1.803 -8.724 -13.868 1.00 0.00 C ATOM 1417 C ASP A 90 1.370 -8.905 -12.405 1.00 0.00 C ATOM 1418 O ASP A 90 1.845 -9.802 -11.708 1.00 0.00 O ATOM 1419 CB ASP A 90 1.072 -9.741 -14.747 1.00 0.00 C ATOM 1420 CG ASP A 90 1.430 -11.158 -14.312 1.00 0.00 C ATOM 1421 OD1 ASP A 90 0.863 -11.617 -13.335 1.00 0.00 O ATOM 1422 OD2 ASP A 90 2.263 -11.764 -14.965 1.00 0.00 O ATOM 0 H ASP A 90 3.703 -9.389 -13.245 1.00 0.00 H new ATOM 0 HA ASP A 90 1.544 -7.713 -14.183 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -0.005 -9.590 -14.673 1.00 0.00 H new ATOM 0 HB3 ASP A 90 1.344 -9.593 -15.792 1.00 0.00 H new ATOM 1427 N PHE A 91 0.465 -8.034 -11.967 1.00 0.00 N ATOM 1428 CA PHE A 91 -0.058 -8.043 -10.591 1.00 0.00 C ATOM 1429 C PHE A 91 -0.376 -9.452 -10.066 1.00 0.00 C ATOM 1430 O PHE A 91 -0.200 -9.724 -8.880 1.00 0.00 O ATOM 1431 CB PHE A 91 -1.335 -7.203 -10.556 1.00 0.00 C ATOM 1432 CG PHE A 91 -1.768 -6.973 -9.133 1.00 0.00 C ATOM 1433 CD1 PHE A 91 -1.226 -5.912 -8.403 1.00 0.00 C ATOM 1434 CD2 PHE A 91 -2.723 -7.812 -8.547 1.00 0.00 C ATOM 1435 CE1 PHE A 91 -1.639 -5.688 -7.084 1.00 0.00 C ATOM 1436 CE2 PHE A 91 -3.133 -7.590 -7.229 1.00 0.00 C ATOM 1437 CZ PHE A 91 -2.592 -6.527 -6.496 1.00 0.00 C ATOM 0 H PHE A 91 0.069 -7.298 -12.552 1.00 0.00 H new ATOM 0 HA PHE A 91 0.719 -7.634 -9.946 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -1.164 -6.247 -11.051 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -2.127 -7.709 -11.107 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -0.489 -5.265 -8.856 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -3.143 -8.630 -9.113 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -1.222 -4.867 -6.520 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -3.868 -8.239 -6.776 1.00 0.00 H new ATOM 0 HZ PHE A 91 -2.910 -6.355 -5.478 1.00 0.00 H new ATOM 1447 N THR A 92 -0.864 -10.326 -10.930 1.00 0.00 N ATOM 1448 CA THR A 92 -1.223 -11.682 -10.503 1.00 0.00 C ATOM 1449 C THR A 92 -0.009 -12.471 -10.004 1.00 0.00 C ATOM 1450 O THR A 92 -0.084 -13.163 -8.987 1.00 0.00 O ATOM 1451 CB THR A 92 -1.873 -12.435 -11.666 1.00 0.00 C ATOM 1452 OG1 THR A 92 -3.062 -11.763 -12.060 1.00 0.00 O ATOM 1453 CG2 THR A 92 -2.211 -13.863 -11.229 1.00 0.00 C ATOM 0 H THR A 92 -1.022 -10.132 -11.919 1.00 0.00 H new ATOM 0 HA THR A 92 -1.924 -11.588 -9.674 1.00 0.00 H new ATOM 0 HB THR A 92 -1.181 -12.470 -12.507 1.00 0.00 H new ATOM 0 HG1 THR A 92 -3.478 -12.244 -12.806 1.00 0.00 H new ATOM 0 HG21 THR A 92 -2.674 -14.397 -12.059 1.00 0.00 H new ATOM 0 HG22 THR A 92 -1.298 -14.378 -10.930 1.00 0.00 H new ATOM 0 HG23 THR A 92 -2.902 -13.832 -10.387 1.00 0.00 H new ATOM 1461 N SER A 93 1.088 -12.389 -10.736 1.00 0.00 N ATOM 1462 CA SER A 93 2.296 -13.130 -10.370 1.00 0.00 C ATOM 1463 C SER A 93 2.949 -12.580 -9.094 1.00 0.00 C ATOM 1464 O SER A 93 3.631 -13.314 -8.378 1.00 0.00 O ATOM 1465 CB SER A 93 3.299 -13.067 -11.511 1.00 0.00 C ATOM 1466 OG SER A 93 3.608 -11.712 -11.779 1.00 0.00 O ATOM 0 H SER A 93 1.174 -11.824 -11.581 1.00 0.00 H new ATOM 0 HA SER A 93 2.000 -14.161 -10.177 1.00 0.00 H new ATOM 0 HB2 SER A 93 4.204 -13.614 -11.247 1.00 0.00 H new ATOM 0 HB3 SER A 93 2.887 -13.542 -12.401 1.00 0.00 H new ATOM 0 HG SER A 93 3.782 -11.599 -12.737 1.00 0.00 H new ATOM 1472 N LEU A 94 2.754 -11.291 -8.821 1.00 0.00 N ATOM 1473 CA LEU A 94 3.356 -10.676 -7.634 1.00 0.00 C ATOM 1474 C LEU A 94 2.638 -11.101 -6.359 1.00 0.00 C ATOM 1475 O LEU A 94 3.255 -11.667 -5.466 1.00 0.00 O ATOM 1476 CB LEU A 94 3.338 -9.143 -7.758 1.00 0.00 C ATOM 1477 CG LEU A 94 3.926 -8.489 -6.477 1.00 0.00 C ATOM 1478 CD1 LEU A 94 4.808 -7.297 -6.864 1.00 0.00 C ATOM 1479 CD2 LEU A 94 2.791 -7.994 -5.563 1.00 0.00 C ATOM 0 H LEU A 94 2.194 -10.659 -9.393 1.00 0.00 H new ATOM 0 HA LEU A 94 4.388 -11.021 -7.572 1.00 0.00 H new ATOM 0 HB2 LEU A 94 3.916 -8.835 -8.629 1.00 0.00 H new ATOM 0 HB3 LEU A 94 2.317 -8.796 -7.915 1.00 0.00 H new ATOM 0 HG LEU A 94 4.519 -9.234 -5.947 1.00 0.00 H new ATOM 0 HD11 LEU A 94 5.219 -6.841 -5.963 1.00 0.00 H new ATOM 0 HD12 LEU A 94 5.623 -7.639 -7.501 1.00 0.00 H new ATOM 0 HD13 LEU A 94 4.210 -6.562 -7.403 1.00 0.00 H new ATOM 0 HD21 LEU A 94 3.216 -7.538 -4.669 1.00 0.00 H new ATOM 0 HD22 LEU A 94 2.190 -7.257 -6.096 1.00 0.00 H new ATOM 0 HD23 LEU A 94 2.161 -8.836 -5.276 1.00 0.00 H new ATOM 1491 N VAL A 95 1.343 -10.817 -6.266 1.00 0.00 N ATOM 1492 CA VAL A 95 0.580 -11.176 -5.061 1.00 0.00 C ATOM 1493 C VAL A 95 1.005 -12.550 -4.523 1.00 0.00 C ATOM 1494 O VAL A 95 1.228 -12.714 -3.327 1.00 0.00 O ATOM 1495 CB VAL A 95 -0.923 -11.191 -5.369 1.00 0.00 C ATOM 1496 CG1 VAL A 95 -1.699 -11.679 -4.140 1.00 0.00 C ATOM 1497 CG2 VAL A 95 -1.389 -9.776 -5.720 1.00 0.00 C ATOM 0 H VAL A 95 0.802 -10.348 -6.992 1.00 0.00 H new ATOM 0 HA VAL A 95 0.789 -10.425 -4.299 1.00 0.00 H new ATOM 0 HB VAL A 95 -1.107 -11.861 -6.209 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -2.766 -11.688 -4.363 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -1.374 -12.687 -3.881 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -1.510 -11.010 -3.301 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -2.457 -9.788 -5.939 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -1.199 -9.111 -4.878 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -0.844 -9.420 -6.594 1.00 0.00 H new ATOM 1507 N MET A 96 1.097 -13.531 -5.405 1.00 0.00 N ATOM 1508 CA MET A 96 1.476 -14.881 -4.989 1.00 0.00 C ATOM 1509 C MET A 96 2.984 -14.992 -4.744 1.00 0.00 C ATOM 1510 O MET A 96 3.447 -15.946 -4.119 1.00 0.00 O ATOM 1511 CB MET A 96 1.054 -15.890 -6.062 1.00 0.00 C ATOM 1512 CG MET A 96 1.733 -15.548 -7.394 1.00 0.00 C ATOM 1513 SD MET A 96 3.420 -16.205 -7.400 1.00 0.00 S ATOM 1514 CE MET A 96 3.011 -17.876 -7.964 1.00 0.00 C ATOM 0 H MET A 96 0.918 -13.426 -6.404 1.00 0.00 H new ATOM 0 HA MET A 96 0.965 -15.099 -4.051 1.00 0.00 H new ATOM 0 HB2 MET A 96 1.327 -16.899 -5.753 1.00 0.00 H new ATOM 0 HB3 MET A 96 -0.029 -15.876 -6.182 1.00 0.00 H new ATOM 0 HG2 MET A 96 1.164 -15.970 -8.223 1.00 0.00 H new ATOM 0 HG3 MET A 96 1.752 -14.468 -7.538 1.00 0.00 H new ATOM 0 HE1 MET A 96 3.743 -18.582 -7.572 1.00 0.00 H new ATOM 0 HE2 MET A 96 2.018 -18.148 -7.607 1.00 0.00 H new ATOM 0 HE3 MET A 96 3.025 -17.906 -9.053 1.00 0.00 H new ATOM 1524 N GLY A 97 3.746 -14.028 -5.257 1.00 0.00 N ATOM 1525 CA GLY A 97 5.210 -14.054 -5.099 1.00 0.00 C ATOM 1526 C GLY A 97 5.677 -13.165 -3.947 1.00 0.00 C ATOM 1527 O GLY A 97 6.871 -13.087 -3.663 1.00 0.00 O ATOM 0 H GLY A 97 3.387 -13.228 -5.779 1.00 0.00 H new ATOM 0 HA2 GLY A 97 5.537 -15.078 -4.922 1.00 0.00 H new ATOM 0 HA3 GLY A 97 5.681 -13.724 -6.025 1.00 0.00 H new ATOM 1531 N ILE A 98 4.739 -12.494 -3.293 1.00 0.00 N ATOM 1532 CA ILE A 98 5.085 -11.612 -2.186 1.00 0.00 C ATOM 1533 C ILE A 98 6.072 -12.283 -1.240 1.00 0.00 C ATOM 1534 O ILE A 98 7.285 -12.124 -1.382 1.00 0.00 O ATOM 1535 CB ILE A 98 3.827 -11.203 -1.425 1.00 0.00 C ATOM 1536 CG1 ILE A 98 2.919 -10.400 -2.358 1.00 0.00 C ATOM 1537 CG2 ILE A 98 4.218 -10.339 -0.229 1.00 0.00 C ATOM 1538 CD1 ILE A 98 1.559 -10.177 -1.694 1.00 0.00 C ATOM 0 H ILE A 98 3.743 -12.542 -3.506 1.00 0.00 H new ATOM 0 HA ILE A 98 5.559 -10.721 -2.598 1.00 0.00 H new ATOM 0 HB ILE A 98 3.302 -12.091 -1.074 1.00 0.00 H new ATOM 0 HG12 ILE A 98 3.381 -9.441 -2.593 1.00 0.00 H new ATOM 0 HG13 ILE A 98 2.791 -10.931 -3.301 1.00 0.00 H new ATOM 0 HG21 ILE A 98 3.321 -10.045 0.316 1.00 0.00 H new ATOM 0 HG22 ILE A 98 4.874 -10.906 0.431 1.00 0.00 H new ATOM 0 HG23 ILE A 98 4.738 -9.447 -0.579 1.00 0.00 H new ATOM 0 HD11 ILE A 98 0.917 -9.605 -2.363 1.00 0.00 H new ATOM 0 HD12 ILE A 98 1.095 -11.140 -1.482 1.00 0.00 H new ATOM 0 HD13 ILE A 98 1.695 -9.627 -0.763 1.00 0.00 H new ATOM 1550 N HIS A 99 5.557 -13.031 -0.279 1.00 0.00 N ATOM 1551 CA HIS A 99 6.415 -13.713 0.680 1.00 0.00 C ATOM 1552 C HIS A 99 7.611 -14.353 -0.024 1.00 0.00 C ATOM 1553 O HIS A 99 8.761 -14.173 0.376 1.00 0.00 O ATOM 1554 CB HIS A 99 5.618 -14.796 1.405 1.00 0.00 C ATOM 1555 CG HIS A 99 6.463 -15.398 2.494 1.00 0.00 C ATOM 1556 ND1 HIS A 99 6.843 -14.678 3.617 1.00 0.00 N ATOM 1557 CD2 HIS A 99 7.010 -16.646 2.645 1.00 0.00 C ATOM 1558 CE1 HIS A 99 7.587 -15.496 4.388 1.00 0.00 C ATOM 1559 NE2 HIS A 99 7.719 -16.707 3.840 1.00 0.00 N ATOM 0 H HIS A 99 4.558 -13.182 -0.141 1.00 0.00 H new ATOM 0 HA HIS A 99 6.781 -12.979 1.398 1.00 0.00 H new ATOM 0 HB2 HIS A 99 4.709 -14.370 1.829 1.00 0.00 H new ATOM 0 HB3 HIS A 99 5.310 -15.568 0.700 1.00 0.00 H new ATOM 0 HD2 HIS A 99 6.906 -17.459 1.942 1.00 0.00 H new ATOM 0 HE1 HIS A 99 8.023 -15.208 5.333 1.00 0.00 H new ATOM 0 HE2 HIS A 99 8.230 -17.505 4.217 1.00 0.00 H new ATOM 1568 N ASP A 100 7.308 -15.115 -1.057 1.00 0.00 N ATOM 1569 CA ASP A 100 8.320 -15.828 -1.830 1.00 0.00 C ATOM 1570 C ASP A 100 9.602 -15.011 -2.079 1.00 0.00 C ATOM 1571 O ASP A 100 10.479 -14.938 -1.228 1.00 0.00 O ATOM 1572 CB ASP A 100 7.727 -16.241 -3.176 1.00 0.00 C ATOM 1573 CG ASP A 100 6.507 -17.130 -2.958 1.00 0.00 C ATOM 1574 OD1 ASP A 100 6.431 -17.752 -1.911 1.00 0.00 O ATOM 1575 OD2 ASP A 100 5.667 -17.176 -3.841 1.00 0.00 O ATOM 0 H ASP A 100 6.354 -15.261 -1.388 1.00 0.00 H new ATOM 0 HA ASP A 100 8.609 -16.695 -1.236 1.00 0.00 H new ATOM 0 HB2 ASP A 100 7.445 -15.355 -3.745 1.00 0.00 H new ATOM 0 HB3 ASP A 100 8.475 -16.773 -3.764 1.00 0.00 H new ATOM 1580 N VAL A 101 9.713 -14.470 -3.295 1.00 0.00 N ATOM 1581 CA VAL A 101 10.909 -13.731 -3.727 1.00 0.00 C ATOM 1582 C VAL A 101 11.022 -12.309 -3.155 1.00 0.00 C ATOM 1583 O VAL A 101 12.095 -11.895 -2.718 1.00 0.00 O ATOM 1584 CB VAL A 101 10.898 -13.652 -5.268 1.00 0.00 C ATOM 1585 CG1 VAL A 101 10.444 -14.999 -5.842 1.00 0.00 C ATOM 1586 CG2 VAL A 101 9.924 -12.558 -5.739 1.00 0.00 C ATOM 0 H VAL A 101 8.984 -14.529 -4.006 1.00 0.00 H new ATOM 0 HA VAL A 101 11.770 -14.278 -3.343 1.00 0.00 H new ATOM 0 HB VAL A 101 11.903 -13.413 -5.615 1.00 0.00 H new ATOM 0 HG11 VAL A 101 10.435 -14.946 -6.931 1.00 0.00 H new ATOM 0 HG12 VAL A 101 11.132 -15.781 -5.522 1.00 0.00 H new ATOM 0 HG13 VAL A 101 9.441 -15.229 -5.482 1.00 0.00 H new ATOM 0 HG21 VAL A 101 9.926 -12.513 -6.828 1.00 0.00 H new ATOM 0 HG22 VAL A 101 8.919 -12.790 -5.387 1.00 0.00 H new ATOM 0 HG23 VAL A 101 10.236 -11.595 -5.336 1.00 0.00 H new ATOM 1596 N ILE A 102 9.945 -11.561 -3.218 1.00 0.00 N ATOM 1597 CA ILE A 102 9.960 -10.174 -2.768 1.00 0.00 C ATOM 1598 C ILE A 102 10.431 -10.015 -1.312 1.00 0.00 C ATOM 1599 O ILE A 102 11.238 -9.133 -1.021 1.00 0.00 O ATOM 1600 CB ILE A 102 8.558 -9.571 -2.964 1.00 0.00 C ATOM 1601 CG1 ILE A 102 8.314 -9.280 -4.489 1.00 0.00 C ATOM 1602 CG2 ILE A 102 8.424 -8.266 -2.153 1.00 0.00 C ATOM 1603 CD1 ILE A 102 7.047 -9.994 -4.957 1.00 0.00 C ATOM 0 H ILE A 102 9.045 -11.882 -3.575 1.00 0.00 H new ATOM 0 HA ILE A 102 10.689 -9.634 -3.373 1.00 0.00 H new ATOM 0 HB ILE A 102 7.813 -10.283 -2.611 1.00 0.00 H new ATOM 0 HG12 ILE A 102 8.219 -8.207 -4.653 1.00 0.00 H new ATOM 0 HG13 ILE A 102 9.170 -9.617 -5.074 1.00 0.00 H new ATOM 0 HG21 ILE A 102 7.428 -7.848 -2.299 1.00 0.00 H new ATOM 0 HG22 ILE A 102 8.577 -8.478 -1.095 1.00 0.00 H new ATOM 0 HG23 ILE A 102 9.172 -7.549 -2.491 1.00 0.00 H new ATOM 0 HD11 ILE A 102 6.883 -9.788 -6.015 1.00 0.00 H new ATOM 0 HD12 ILE A 102 7.159 -11.068 -4.809 1.00 0.00 H new ATOM 0 HD13 ILE A 102 6.194 -9.636 -4.381 1.00 0.00 H new ATOM 1615 N HIS A 103 9.929 -10.837 -0.401 1.00 0.00 N ATOM 1616 CA HIS A 103 10.329 -10.711 1.010 1.00 0.00 C ATOM 1617 C HIS A 103 11.541 -11.587 1.333 1.00 0.00 C ATOM 1618 O HIS A 103 12.088 -11.511 2.433 1.00 0.00 O ATOM 1619 CB HIS A 103 9.145 -11.082 1.919 1.00 0.00 C ATOM 1620 CG HIS A 103 8.290 -9.854 2.205 1.00 0.00 C ATOM 1621 ND1 HIS A 103 7.248 -9.880 3.120 1.00 0.00 N ATOM 1622 CD2 HIS A 103 8.315 -8.566 1.708 1.00 0.00 C ATOM 1623 CE1 HIS A 103 6.698 -8.648 3.145 1.00 0.00 C ATOM 1624 NE2 HIS A 103 7.313 -7.811 2.302 1.00 0.00 N ATOM 0 H HIS A 103 9.261 -11.582 -0.597 1.00 0.00 H new ATOM 0 HA HIS A 103 10.616 -9.675 1.190 1.00 0.00 H new ATOM 0 HB2 HIS A 103 8.539 -11.852 1.441 1.00 0.00 H new ATOM 0 HB3 HIS A 103 9.514 -11.502 2.855 1.00 0.00 H new ATOM 0 HD2 HIS A 103 9.011 -8.200 0.967 1.00 0.00 H new ATOM 0 HE1 HIS A 103 5.862 -8.371 3.770 1.00 0.00 H new ATOM 0 HE2 HIS A 103 7.093 -6.830 2.132 1.00 0.00 H new ATOM 1632 N LEU A 104 11.967 -12.404 0.379 1.00 0.00 N ATOM 1633 CA LEU A 104 13.129 -13.264 0.601 1.00 0.00 C ATOM 1634 C LEU A 104 14.414 -12.508 0.256 1.00 0.00 C ATOM 1635 O LEU A 104 15.475 -12.774 0.821 1.00 0.00 O ATOM 1636 CB LEU A 104 13.013 -14.546 -0.255 1.00 0.00 C ATOM 1637 CG LEU A 104 14.373 -15.303 -0.298 1.00 0.00 C ATOM 1638 CD1 LEU A 104 14.126 -16.819 -0.272 1.00 0.00 C ATOM 1639 CD2 LEU A 104 15.139 -14.940 -1.589 1.00 0.00 C ATOM 0 H LEU A 104 11.537 -12.492 -0.542 1.00 0.00 H new ATOM 0 HA LEU A 104 13.163 -13.549 1.652 1.00 0.00 H new ATOM 0 HB2 LEU A 104 12.242 -15.196 0.158 1.00 0.00 H new ATOM 0 HB3 LEU A 104 12.703 -14.287 -1.267 1.00 0.00 H new ATOM 0 HG LEU A 104 14.964 -15.011 0.570 1.00 0.00 H new ATOM 0 HD11 LEU A 104 15.081 -17.344 -0.302 1.00 0.00 H new ATOM 0 HD12 LEU A 104 13.594 -17.085 0.641 1.00 0.00 H new ATOM 0 HD13 LEU A 104 13.527 -17.105 -1.137 1.00 0.00 H new ATOM 0 HD21 LEU A 104 16.089 -15.474 -1.611 1.00 0.00 H new ATOM 0 HD22 LEU A 104 14.544 -15.223 -2.457 1.00 0.00 H new ATOM 0 HD23 LEU A 104 15.326 -13.866 -1.612 1.00 0.00 H new ATOM 1651 N GLU A 105 14.307 -11.565 -0.679 1.00 0.00 N ATOM 1652 CA GLU A 105 15.464 -10.779 -1.099 1.00 0.00 C ATOM 1653 C GLU A 105 15.738 -9.636 -0.116 1.00 0.00 C ATOM 1654 O GLU A 105 16.890 -9.276 0.117 1.00 0.00 O ATOM 1655 CB GLU A 105 15.225 -10.222 -2.513 1.00 0.00 C ATOM 1656 CG GLU A 105 16.317 -9.200 -2.879 1.00 0.00 C ATOM 1657 CD GLU A 105 15.956 -7.814 -2.343 1.00 0.00 C ATOM 1658 OE1 GLU A 105 14.943 -7.702 -1.673 1.00 0.00 O ATOM 1659 OE2 GLU A 105 16.699 -6.886 -2.616 1.00 0.00 O ATOM 0 H GLU A 105 13.437 -11.328 -1.157 1.00 0.00 H new ATOM 0 HA GLU A 105 16.340 -11.428 -1.110 1.00 0.00 H new ATOM 0 HB2 GLU A 105 15.224 -11.037 -3.236 1.00 0.00 H new ATOM 0 HB3 GLU A 105 14.244 -9.749 -2.564 1.00 0.00 H new ATOM 0 HG2 GLU A 105 17.274 -9.518 -2.466 1.00 0.00 H new ATOM 0 HG3 GLU A 105 16.436 -9.158 -3.962 1.00 0.00 H new ATOM 1666 N VAL A 106 14.679 -9.070 0.458 1.00 0.00 N ATOM 1667 CA VAL A 106 14.842 -7.971 1.413 1.00 0.00 C ATOM 1668 C VAL A 106 15.438 -8.485 2.723 1.00 0.00 C ATOM 1669 O VAL A 106 16.120 -7.751 3.439 1.00 0.00 O ATOM 1670 CB VAL A 106 13.486 -7.307 1.703 1.00 0.00 C ATOM 1671 CG1 VAL A 106 12.793 -6.926 0.384 1.00 0.00 C ATOM 1672 CG2 VAL A 106 12.600 -8.280 2.491 1.00 0.00 C ATOM 0 H VAL A 106 13.713 -9.347 0.284 1.00 0.00 H new ATOM 0 HA VAL A 106 15.517 -7.238 0.972 1.00 0.00 H new ATOM 0 HB VAL A 106 13.647 -6.403 2.291 1.00 0.00 H new ATOM 0 HG11 VAL A 106 11.833 -6.456 0.600 1.00 0.00 H new ATOM 0 HG12 VAL A 106 13.422 -6.229 -0.169 1.00 0.00 H new ATOM 0 HG13 VAL A 106 12.632 -7.823 -0.215 1.00 0.00 H new ATOM 0 HG21 VAL A 106 11.638 -7.811 2.697 1.00 0.00 H new ATOM 0 HG22 VAL A 106 12.443 -9.186 1.905 1.00 0.00 H new ATOM 0 HG23 VAL A 106 13.088 -8.536 3.431 1.00 0.00 H new ATOM 1682 N ASN A 107 15.164 -9.747 3.034 1.00 0.00 N ATOM 1683 CA ASN A 107 15.669 -10.350 4.263 1.00 0.00 C ATOM 1684 C ASN A 107 17.183 -10.516 4.204 1.00 0.00 C ATOM 1685 O ASN A 107 17.892 -10.164 5.147 1.00 0.00 O ATOM 1686 CB ASN A 107 15.013 -11.716 4.479 1.00 0.00 C ATOM 1687 CG ASN A 107 15.221 -12.174 5.919 1.00 0.00 C ATOM 1688 OD1 ASN A 107 14.471 -11.780 6.811 1.00 0.00 O ATOM 1689 ND2 ASN A 107 16.202 -12.988 6.199 1.00 0.00 N ATOM 0 H ASN A 107 14.599 -10.369 2.457 1.00 0.00 H new ATOM 0 HA ASN A 107 15.423 -9.689 5.094 1.00 0.00 H new ATOM 0 HB2 ASN A 107 13.947 -11.656 4.259 1.00 0.00 H new ATOM 0 HB3 ASN A 107 15.440 -12.446 3.791 1.00 0.00 H new ATOM 0 HD21 ASN A 107 16.348 -13.299 7.159 1.00 0.00 H new ATOM 0 HD22 ASN A 107 16.822 -13.313 5.457 1.00 0.00 H new ATOM 1696 N LYS A 108 17.674 -11.060 3.094 1.00 0.00 N ATOM 1697 CA LYS A 108 19.105 -11.271 2.931 1.00 0.00 C ATOM 1698 C LYS A 108 19.841 -9.939 2.846 1.00 0.00 C ATOM 1699 O LYS A 108 21.027 -9.851 3.161 1.00 0.00 O ATOM 1700 CB LYS A 108 19.370 -12.085 1.672 1.00 0.00 C ATOM 1701 CG LYS A 108 18.733 -13.472 1.823 1.00 0.00 C ATOM 1702 CD LYS A 108 19.285 -14.417 0.747 1.00 0.00 C ATOM 1703 CE LYS A 108 20.577 -15.086 1.243 1.00 0.00 C ATOM 1704 NZ LYS A 108 20.232 -16.234 2.127 1.00 0.00 N ATOM 0 H LYS A 108 17.106 -11.360 2.302 1.00 0.00 H new ATOM 0 HA LYS A 108 19.473 -11.817 3.800 1.00 0.00 H new ATOM 0 HB2 LYS A 108 18.957 -11.575 0.802 1.00 0.00 H new ATOM 0 HB3 LYS A 108 20.443 -12.181 1.506 1.00 0.00 H new ATOM 0 HG2 LYS A 108 18.943 -13.873 2.815 1.00 0.00 H new ATOM 0 HG3 LYS A 108 17.649 -13.397 1.733 1.00 0.00 H new ATOM 0 HD2 LYS A 108 18.543 -15.177 0.504 1.00 0.00 H new ATOM 0 HD3 LYS A 108 19.483 -13.861 -0.169 1.00 0.00 H new ATOM 0 HE2 LYS A 108 21.170 -15.431 0.396 1.00 0.00 H new ATOM 0 HE3 LYS A 108 21.187 -14.365 1.787 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 21.105 -16.688 2.463 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 19.683 -15.892 2.942 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 19.666 -16.925 1.594 1.00 0.00 H new ATOM 1835 N PRO A 116 7.123 -9.851 8.135 1.00 0.00 N ATOM 1836 CA PRO A 116 5.723 -10.247 8.490 1.00 0.00 C ATOM 1837 C PRO A 116 5.330 -11.595 7.879 1.00 0.00 C ATOM 1838 O PRO A 116 6.094 -12.186 7.116 1.00 0.00 O ATOM 1839 CB PRO A 116 4.872 -9.108 7.912 1.00 0.00 C ATOM 1840 CG PRO A 116 5.773 -7.916 7.914 1.00 0.00 C ATOM 1841 CD PRO A 116 7.187 -8.448 7.672 1.00 0.00 C ATOM 0 HA PRO A 116 5.592 -10.381 9.564 1.00 0.00 H new ATOM 0 HB2 PRO A 116 4.530 -9.343 6.904 1.00 0.00 H new ATOM 0 HB3 PRO A 116 3.983 -8.932 8.518 1.00 0.00 H new ATOM 0 HG2 PRO A 116 5.485 -7.209 7.136 1.00 0.00 H new ATOM 0 HG3 PRO A 116 5.714 -7.385 8.864 1.00 0.00 H new ATOM 0 HD2 PRO A 116 7.462 -8.387 6.619 1.00 0.00 H new ATOM 0 HD3 PRO A 116 7.930 -7.877 8.229 1.00 0.00 H new ATOM 1849 N HIS A 117 4.131 -12.073 8.218 1.00 0.00 N ATOM 1850 CA HIS A 117 3.641 -13.353 7.695 1.00 0.00 C ATOM 1851 C HIS A 117 2.604 -13.121 6.600 1.00 0.00 C ATOM 1852 O HIS A 117 1.514 -12.614 6.863 1.00 0.00 O ATOM 1853 CB HIS A 117 3.014 -14.172 8.824 1.00 0.00 C ATOM 1854 CG HIS A 117 2.749 -15.572 8.340 1.00 0.00 C ATOM 1855 ND1 HIS A 117 3.775 -16.449 8.020 1.00 0.00 N ATOM 1856 CD2 HIS A 117 1.583 -16.260 8.114 1.00 0.00 C ATOM 1857 CE1 HIS A 117 3.209 -17.605 7.624 1.00 0.00 C ATOM 1858 NE2 HIS A 117 1.875 -17.542 7.662 1.00 0.00 N ATOM 0 H HIS A 117 3.484 -11.598 8.848 1.00 0.00 H new ATOM 0 HA HIS A 117 4.485 -13.899 7.274 1.00 0.00 H new ATOM 0 HB2 HIS A 117 3.681 -14.194 9.686 1.00 0.00 H new ATOM 0 HB3 HIS A 117 2.084 -13.707 9.152 1.00 0.00 H new ATOM 0 HD2 HIS A 117 0.589 -15.865 8.265 1.00 0.00 H new ATOM 0 HE1 HIS A 117 3.766 -18.477 7.314 1.00 0.00 H new ATOM 0 HE2 HIS A 117 1.213 -18.277 7.413 1.00 0.00 H new ATOM 1867 N ILE A 118 2.953 -13.495 5.368 1.00 0.00 N ATOM 1868 CA ILE A 118 2.045 -13.324 4.227 1.00 0.00 C ATOM 1869 C ILE A 118 1.917 -14.631 3.446 1.00 0.00 C ATOM 1870 O ILE A 118 2.917 -15.217 3.036 1.00 0.00 O ATOM 1871 CB ILE A 118 2.575 -12.221 3.290 1.00 0.00 C ATOM 1872 CG1 ILE A 118 3.138 -11.035 4.126 1.00 0.00 C ATOM 1873 CG2 ILE A 118 1.431 -11.722 2.397 1.00 0.00 C ATOM 1874 CD1 ILE A 118 4.651 -11.215 4.337 1.00 0.00 C ATOM 0 H ILE A 118 3.852 -13.916 5.133 1.00 0.00 H new ATOM 0 HA ILE A 118 1.065 -13.038 4.609 1.00 0.00 H new ATOM 0 HB ILE A 118 3.374 -12.629 2.671 1.00 0.00 H new ATOM 0 HG12 ILE A 118 2.943 -10.093 3.614 1.00 0.00 H new ATOM 0 HG13 ILE A 118 2.631 -10.985 5.090 1.00 0.00 H new ATOM 0 HG21 ILE A 118 1.802 -10.942 1.733 1.00 0.00 H new ATOM 0 HG22 ILE A 118 1.045 -12.551 1.803 1.00 0.00 H new ATOM 0 HG23 ILE A 118 0.632 -11.319 3.020 1.00 0.00 H new ATOM 0 HD11 ILE A 118 5.038 -10.381 4.923 1.00 0.00 H new ATOM 0 HD12 ILE A 118 4.836 -12.149 4.868 1.00 0.00 H new ATOM 0 HD13 ILE A 118 5.153 -11.243 3.370 1.00 0.00 H new ATOM 1886 N ASN A 119 0.676 -15.082 3.243 1.00 0.00 N ATOM 1887 CA ASN A 119 0.430 -16.328 2.503 1.00 0.00 C ATOM 1888 C ASN A 119 -0.586 -16.096 1.386 1.00 0.00 C ATOM 1889 O ASN A 119 -1.792 -16.056 1.628 1.00 0.00 O ATOM 1890 CB ASN A 119 -0.088 -17.414 3.457 1.00 0.00 C ATOM 1891 CG ASN A 119 0.142 -18.798 2.854 1.00 0.00 C ATOM 1892 OD1 ASN A 119 0.517 -18.903 1.608 1.00 0.00 O flip ATOM 1893 ND2 ASN A 119 -0.024 -19.809 3.536 1.00 0.00 N flip ATOM 0 H ASN A 119 -0.166 -14.612 3.575 1.00 0.00 H new ATOM 0 HA ASN A 119 1.370 -16.657 2.060 1.00 0.00 H new ATOM 0 HB2 ASN A 119 0.422 -17.338 4.417 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -1.151 -17.264 3.648 1.00 0.00 H new ATOM 0 HD21 ASN A 119 -0.317 -19.725 4.509 1.00 0.00 H new ATOM 0 HD22 ASN A 119 0.131 -20.731 3.128 1.00 0.00 H new ATOM 1900 N GLY A 120 -0.086 -15.946 0.162 1.00 0.00 N ATOM 1901 CA GLY A 120 -0.948 -15.720 -0.991 1.00 0.00 C ATOM 1902 C GLY A 120 -1.382 -17.042 -1.600 1.00 0.00 C ATOM 1903 O GLY A 120 -0.552 -17.901 -1.900 1.00 0.00 O ATOM 0 H GLY A 120 0.910 -15.977 -0.055 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -1.825 -15.147 -0.690 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -0.419 -15.126 -1.736 1.00 0.00 H new ATOM 1907 N GLN A 121 -2.687 -17.202 -1.779 1.00 0.00 N ATOM 1908 CA GLN A 121 -3.238 -18.433 -2.358 1.00 0.00 C ATOM 1909 C GLN A 121 -4.169 -18.100 -3.520 1.00 0.00 C ATOM 1910 O GLN A 121 -5.158 -17.405 -3.342 1.00 0.00 O ATOM 1911 CB GLN A 121 -4.006 -19.195 -1.282 1.00 0.00 C ATOM 1912 CG GLN A 121 -4.527 -20.512 -1.857 1.00 0.00 C ATOM 1913 CD GLN A 121 -4.994 -21.425 -0.728 1.00 0.00 C ATOM 1914 OE1 GLN A 121 -5.915 -21.078 0.010 1.00 0.00 O ATOM 1915 NE2 GLN A 121 -4.409 -22.579 -0.551 1.00 0.00 N ATOM 0 H GLN A 121 -3.386 -16.501 -1.534 1.00 0.00 H new ATOM 0 HA GLN A 121 -2.421 -19.050 -2.732 1.00 0.00 H new ATOM 0 HB2 GLN A 121 -3.357 -19.391 -0.428 1.00 0.00 H new ATOM 0 HB3 GLN A 121 -4.838 -18.591 -0.919 1.00 0.00 H new ATOM 0 HG2 GLN A 121 -5.351 -20.318 -2.543 1.00 0.00 H new ATOM 0 HG3 GLN A 121 -3.742 -21.003 -2.432 1.00 0.00 H new ATOM 0 HE21 GLN A 121 -3.646 -22.863 -1.165 1.00 0.00 H new ATOM 0 HE22 GLN A 121 -4.715 -23.196 0.201 1.00 0.00 H new ATOM 1924 N LEU A 122 -3.840 -18.587 -4.713 1.00 0.00 N ATOM 1925 CA LEU A 122 -4.655 -18.308 -5.886 1.00 0.00 C ATOM 1926 C LEU A 122 -5.965 -19.106 -5.848 1.00 0.00 C ATOM 1927 O LEU A 122 -5.973 -20.301 -5.552 1.00 0.00 O ATOM 1928 CB LEU A 122 -3.850 -18.659 -7.169 1.00 0.00 C ATOM 1929 CG LEU A 122 -3.695 -17.422 -8.071 1.00 0.00 C ATOM 1930 CD1 LEU A 122 -2.661 -16.464 -7.468 1.00 0.00 C ATOM 1931 CD2 LEU A 122 -3.216 -17.870 -9.452 1.00 0.00 C ATOM 0 H LEU A 122 -3.023 -19.171 -4.890 1.00 0.00 H new ATOM 0 HA LEU A 122 -4.908 -17.248 -5.892 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -2.866 -19.040 -6.894 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -4.358 -19.453 -7.717 1.00 0.00 H new ATOM 0 HG LEU A 122 -4.654 -16.911 -8.153 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -2.556 -15.590 -8.111 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -2.991 -16.148 -6.478 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -1.700 -16.971 -7.385 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -3.103 -16.999 -10.098 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -2.256 -18.378 -9.357 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -3.946 -18.552 -9.887 1.00 0.00 H new ATOM 1943 N LEU A 123 -7.063 -18.421 -6.155 1.00 0.00 N ATOM 1944 CA LEU A 123 -8.394 -19.045 -6.168 1.00 0.00 C ATOM 1945 C LEU A 123 -8.911 -19.131 -7.613 1.00 0.00 C ATOM 1946 O LEU A 123 -8.506 -18.338 -8.463 1.00 0.00 O ATOM 1947 CB LEU A 123 -9.387 -18.200 -5.320 1.00 0.00 C ATOM 1948 CG LEU A 123 -8.637 -17.442 -4.205 1.00 0.00 C ATOM 1949 CD1 LEU A 123 -9.566 -16.382 -3.568 1.00 0.00 C ATOM 1950 CD2 LEU A 123 -8.170 -18.442 -3.124 1.00 0.00 C ATOM 0 H LEU A 123 -7.063 -17.431 -6.400 1.00 0.00 H new ATOM 0 HA LEU A 123 -8.318 -20.046 -5.744 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -9.910 -17.491 -5.962 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -10.143 -18.850 -4.880 1.00 0.00 H new ATOM 0 HG LEU A 123 -7.770 -16.941 -4.635 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -9.028 -15.852 -2.782 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -9.885 -15.672 -4.331 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -10.440 -16.874 -3.141 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -7.640 -17.906 -2.337 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -9.036 -18.949 -2.698 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -7.504 -19.178 -3.573 1.00 0.00 H new ATOM 1962 N PRO A 124 -9.801 -20.059 -7.908 1.00 0.00 N ATOM 1963 CA PRO A 124 -10.368 -20.201 -9.277 1.00 0.00 C ATOM 1964 C PRO A 124 -10.699 -18.838 -9.890 1.00 0.00 C ATOM 1965 O PRO A 124 -10.680 -17.821 -9.199 1.00 0.00 O ATOM 1966 CB PRO A 124 -11.636 -21.031 -9.054 1.00 0.00 C ATOM 1967 CG PRO A 124 -11.344 -21.871 -7.846 1.00 0.00 C ATOM 1968 CD PRO A 124 -10.356 -21.068 -6.980 1.00 0.00 C ATOM 0 HA PRO A 124 -9.672 -20.667 -9.975 1.00 0.00 H new ATOM 0 HB2 PRO A 124 -12.503 -20.391 -8.889 1.00 0.00 H new ATOM 0 HB3 PRO A 124 -11.859 -21.652 -9.922 1.00 0.00 H new ATOM 0 HG2 PRO A 124 -12.258 -22.085 -7.293 1.00 0.00 H new ATOM 0 HG3 PRO A 124 -10.915 -22.830 -8.136 1.00 0.00 H new ATOM 0 HD2 PRO A 124 -10.858 -20.598 -6.134 1.00 0.00 H new ATOM 0 HD3 PRO A 124 -9.573 -21.707 -6.571 1.00 0.00 H new ATOM 1976 N ASN A 125 -10.996 -18.825 -11.184 1.00 0.00 N ATOM 1977 CA ASN A 125 -11.322 -17.575 -11.863 1.00 0.00 C ATOM 1978 C ASN A 125 -10.145 -16.613 -11.791 1.00 0.00 C ATOM 1979 O ASN A 125 -9.027 -16.957 -12.177 1.00 0.00 O ATOM 1980 CB ASN A 125 -12.559 -16.936 -11.219 1.00 0.00 C ATOM 1981 CG ASN A 125 -13.639 -17.990 -11.008 1.00 0.00 C ATOM 1982 OD1 ASN A 125 -14.247 -18.052 -9.939 1.00 0.00 O ATOM 1983 ND2 ASN A 125 -13.918 -18.829 -11.969 1.00 0.00 N ATOM 0 H ASN A 125 -11.018 -19.654 -11.778 1.00 0.00 H new ATOM 0 HA ASN A 125 -11.536 -17.791 -12.910 1.00 0.00 H new ATOM 0 HB2 ASN A 125 -12.290 -16.483 -10.265 1.00 0.00 H new ATOM 0 HB3 ASN A 125 -12.939 -16.137 -11.855 1.00 0.00 H new ATOM 0 HD21 ASN A 125 -14.640 -19.537 -11.835 1.00 0.00 H new ATOM 0 HD22 ASN A 125 -13.414 -18.777 -12.854 1.00 0.00 H new ATOM 1990 N ASN A 126 -10.401 -15.406 -11.301 1.00 0.00 N ATOM 1991 CA ASN A 126 -9.353 -14.393 -11.187 1.00 0.00 C ATOM 1992 C ASN A 126 -9.396 -13.722 -9.812 1.00 0.00 C ATOM 1993 O ASN A 126 -9.459 -12.497 -9.709 1.00 0.00 O ATOM 1994 CB ASN A 126 -9.536 -13.344 -12.281 1.00 0.00 C ATOM 1995 CG ASN A 126 -9.601 -14.019 -13.647 1.00 0.00 C ATOM 1996 OD1 ASN A 126 -9.219 -15.181 -13.785 1.00 0.00 O ATOM 1997 ND2 ASN A 126 -10.063 -13.355 -14.672 1.00 0.00 N ATOM 0 H ASN A 126 -11.320 -15.104 -10.977 1.00 0.00 H new ATOM 0 HA ASN A 126 -8.384 -14.878 -11.303 1.00 0.00 H new ATOM 0 HB2 ASN A 126 -10.450 -12.777 -12.103 1.00 0.00 H new ATOM 0 HB3 ASN A 126 -8.710 -12.633 -12.257 1.00 0.00 H new ATOM 0 HD21 ASN A 126 -10.108 -13.799 -15.589 1.00 0.00 H new ATOM 0 HD22 ASN A 126 -10.379 -12.392 -14.556 1.00 0.00 H new ATOM 2004 N GLN A 127 -9.348 -14.541 -8.756 1.00 0.00 N ATOM 2005 CA GLN A 127 -9.366 -14.028 -7.378 1.00 0.00 C ATOM 2006 C GLN A 127 -8.173 -14.583 -6.610 1.00 0.00 C ATOM 2007 O GLN A 127 -7.708 -15.688 -6.886 1.00 0.00 O ATOM 2008 CB GLN A 127 -10.667 -14.432 -6.685 1.00 0.00 C ATOM 2009 CG GLN A 127 -11.847 -13.762 -7.387 1.00 0.00 C ATOM 2010 CD GLN A 127 -13.149 -14.142 -6.695 1.00 0.00 C ATOM 2011 OE1 GLN A 127 -13.634 -13.407 -5.834 1.00 0.00 O ATOM 2012 NE2 GLN A 127 -13.747 -15.253 -7.020 1.00 0.00 N ATOM 0 H GLN A 127 -9.297 -15.557 -8.826 1.00 0.00 H new ATOM 0 HA GLN A 127 -9.304 -12.940 -7.401 1.00 0.00 H new ATOM 0 HB2 GLN A 127 -10.783 -15.516 -6.709 1.00 0.00 H new ATOM 0 HB3 GLN A 127 -10.639 -14.138 -5.636 1.00 0.00 H new ATOM 0 HG2 GLN A 127 -11.721 -12.679 -7.374 1.00 0.00 H new ATOM 0 HG3 GLN A 127 -11.879 -14.067 -8.433 1.00 0.00 H new ATOM 0 HE21 GLN A 127 -13.343 -15.860 -7.733 1.00 0.00 H new ATOM 0 HE22 GLN A 127 -14.619 -15.516 -6.561 1.00 0.00 H new ATOM 2021 N ILE A 128 -7.667 -13.802 -5.658 1.00 0.00 N ATOM 2022 CA ILE A 128 -6.505 -14.221 -4.870 1.00 0.00 C ATOM 2023 C ILE A 128 -6.747 -14.000 -3.381 1.00 0.00 C ATOM 2024 O ILE A 128 -7.110 -12.907 -2.960 1.00 0.00 O ATOM 2025 CB ILE A 128 -5.267 -13.429 -5.313 1.00 0.00 C ATOM 2026 CG1 ILE A 128 -5.085 -13.574 -6.834 1.00 0.00 C ATOM 2027 CG2 ILE A 128 -4.018 -13.967 -4.589 1.00 0.00 C ATOM 2028 CD1 ILE A 128 -4.002 -12.607 -7.320 1.00 0.00 C ATOM 0 H ILE A 128 -8.037 -12.884 -5.413 1.00 0.00 H new ATOM 0 HA ILE A 128 -6.342 -15.285 -5.039 1.00 0.00 H new ATOM 0 HB ILE A 128 -5.401 -12.377 -5.061 1.00 0.00 H new ATOM 0 HG12 ILE A 128 -4.808 -14.599 -7.080 1.00 0.00 H new ATOM 0 HG13 ILE A 128 -6.026 -13.367 -7.344 1.00 0.00 H new ATOM 0 HG21 ILE A 128 -3.142 -13.402 -4.907 1.00 0.00 H new ATOM 0 HG22 ILE A 128 -4.148 -13.861 -3.512 1.00 0.00 H new ATOM 0 HG23 ILE A 128 -3.880 -15.020 -4.836 1.00 0.00 H new ATOM 0 HD11 ILE A 128 -3.876 -12.713 -8.398 1.00 0.00 H new ATOM 0 HD12 ILE A 128 -4.297 -11.584 -7.088 1.00 0.00 H new ATOM 0 HD13 ILE A 128 -3.060 -12.835 -6.821 1.00 0.00 H new ATOM 2040 N ALA A 129 -6.524 -15.043 -2.587 1.00 0.00 N ATOM 2041 CA ALA A 129 -6.700 -14.953 -1.138 1.00 0.00 C ATOM 2042 C ALA A 129 -5.358 -14.703 -0.475 1.00 0.00 C ATOM 2043 O ALA A 129 -4.471 -15.556 -0.498 1.00 0.00 O ATOM 2044 CB ALA A 129 -7.299 -16.250 -0.600 1.00 0.00 C ATOM 0 H ALA A 129 -6.222 -15.959 -2.920 1.00 0.00 H new ATOM 0 HA ALA A 129 -7.377 -14.128 -0.915 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -7.426 -16.172 0.480 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -8.268 -16.425 -1.067 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -6.631 -17.081 -0.828 1.00 0.00 H new ATOM 2050 N LEU A 130 -5.210 -13.523 0.100 1.00 0.00 N ATOM 2051 CA LEU A 130 -3.975 -13.139 0.755 1.00 0.00 C ATOM 2052 C LEU A 130 -4.164 -13.062 2.267 1.00 0.00 C ATOM 2053 O LEU A 130 -4.865 -12.186 2.772 1.00 0.00 O ATOM 2054 CB LEU A 130 -3.552 -11.777 0.219 1.00 0.00 C ATOM 2055 CG LEU A 130 -2.200 -11.334 0.845 1.00 0.00 C ATOM 2056 CD1 LEU A 130 -1.071 -11.491 -0.179 1.00 0.00 C ATOM 2057 CD2 LEU A 130 -2.302 -9.869 1.257 1.00 0.00 C ATOM 0 H LEU A 130 -5.938 -12.809 0.126 1.00 0.00 H new ATOM 0 HA LEU A 130 -3.208 -13.886 0.549 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -3.459 -11.821 -0.866 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -4.321 -11.038 0.443 1.00 0.00 H new ATOM 0 HG LEU A 130 -1.983 -11.956 1.714 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -0.128 -11.178 0.269 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -0.999 -12.535 -0.484 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -1.282 -10.872 -1.051 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -1.358 -9.548 1.698 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -2.519 -9.259 0.380 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -3.102 -9.751 1.988 1.00 0.00 H new ATOM 2069 N ARG A 131 -3.522 -13.978 2.981 1.00 0.00 N ATOM 2070 CA ARG A 131 -3.611 -14.002 4.444 1.00 0.00 C ATOM 2071 C ARG A 131 -2.473 -13.187 5.053 1.00 0.00 C ATOM 2072 O ARG A 131 -1.366 -13.155 4.517 1.00 0.00 O ATOM 2073 CB ARG A 131 -3.536 -15.442 4.949 1.00 0.00 C ATOM 2074 CG ARG A 131 -3.785 -15.474 6.458 1.00 0.00 C ATOM 2075 CD ARG A 131 -3.619 -16.905 6.971 1.00 0.00 C ATOM 2076 NE ARG A 131 -3.509 -16.914 8.425 1.00 0.00 N ATOM 2077 CZ ARG A 131 -3.172 -18.019 9.082 1.00 0.00 C ATOM 2078 NH1 ARG A 131 -2.936 -19.122 8.424 1.00 0.00 N ATOM 2079 NH2 ARG A 131 -3.075 -18.003 10.383 1.00 0.00 N ATOM 0 H ARG A 131 -2.937 -14.711 2.579 1.00 0.00 H new ATOM 0 HA ARG A 131 -4.564 -13.565 4.743 1.00 0.00 H new ATOM 0 HB2 ARG A 131 -4.276 -16.056 4.436 1.00 0.00 H new ATOM 0 HB3 ARG A 131 -2.558 -15.866 4.723 1.00 0.00 H new ATOM 0 HG2 ARG A 131 -3.086 -14.810 6.967 1.00 0.00 H new ATOM 0 HG3 ARG A 131 -4.788 -15.111 6.680 1.00 0.00 H new ATOM 0 HD2 ARG A 131 -4.471 -17.510 6.661 1.00 0.00 H new ATOM 0 HD3 ARG A 131 -2.730 -17.355 6.530 1.00 0.00 H new ATOM 0 HE ARG A 131 -3.694 -16.057 8.947 1.00 0.00 H new ATOM 0 HH11 ARG A 131 -3.010 -19.135 7.407 1.00 0.00 H new ATOM 0 HH12 ARG A 131 -2.677 -19.971 8.927 1.00 0.00 H new ATOM 0 HH21 ARG A 131 -3.258 -17.141 10.897 1.00 0.00 H new ATOM 0 HH22 ARG A 131 -2.816 -18.852 10.886 1.00 0.00 H new ATOM 2093 N TYR A 132 -2.753 -12.527 6.177 1.00 0.00 N ATOM 2094 CA TYR A 132 -1.738 -11.709 6.852 1.00 0.00 C ATOM 2095 C TYR A 132 -1.840 -11.867 8.367 1.00 0.00 C ATOM 2096 O TYR A 132 -2.931 -12.042 8.910 1.00 0.00 O ATOM 2097 CB TYR A 132 -1.923 -10.237 6.478 1.00 0.00 C ATOM 2098 CG TYR A 132 -0.904 -9.399 7.212 1.00 0.00 C ATOM 2099 CD1 TYR A 132 0.382 -9.238 6.683 1.00 0.00 C ATOM 2100 CD2 TYR A 132 -1.245 -8.783 8.421 1.00 0.00 C ATOM 2101 CE1 TYR A 132 1.327 -8.460 7.364 1.00 0.00 C ATOM 2102 CE2 TYR A 132 -0.300 -8.005 9.102 1.00 0.00 C ATOM 2103 CZ TYR A 132 0.985 -7.843 8.573 1.00 0.00 C ATOM 2104 OH TYR A 132 1.916 -7.076 9.243 1.00 0.00 O ATOM 0 H TYR A 132 -3.663 -12.540 6.637 1.00 0.00 H new ATOM 0 HA TYR A 132 -0.753 -12.047 6.529 1.00 0.00 H new ATOM 0 HB2 TYR A 132 -1.809 -10.107 5.402 1.00 0.00 H new ATOM 0 HB3 TYR A 132 -2.931 -9.910 6.734 1.00 0.00 H new ATOM 0 HD1 TYR A 132 0.646 -9.714 5.750 1.00 0.00 H new ATOM 0 HD2 TYR A 132 -2.237 -8.907 8.829 1.00 0.00 H new ATOM 0 HE1 TYR A 132 2.319 -8.336 6.956 1.00 0.00 H new ATOM 0 HE2 TYR A 132 -0.563 -7.530 10.036 1.00 0.00 H new ATOM 0 HH TYR A 132 1.516 -6.719 10.064 1.00 0.00 H new ATOM 2114 N SER A 133 -0.696 -11.800 9.044 1.00 0.00 N ATOM 2115 CA SER A 133 -0.668 -11.932 10.496 1.00 0.00 C ATOM 2116 C SER A 133 0.601 -11.308 11.068 1.00 0.00 C ATOM 2117 O SER A 133 1.685 -11.454 10.504 1.00 0.00 O ATOM 2118 CB SER A 133 -0.733 -13.408 10.883 1.00 0.00 C ATOM 2119 OG SER A 133 0.586 -13.940 10.931 1.00 0.00 O ATOM 0 H SER A 133 0.217 -11.656 8.613 1.00 0.00 H new ATOM 0 HA SER A 133 -1.531 -11.409 10.908 1.00 0.00 H new ATOM 0 HB2 SER A 133 -1.218 -13.521 11.852 1.00 0.00 H new ATOM 0 HB3 SER A 133 -1.334 -13.959 10.160 1.00 0.00 H new ATOM 0 HG SER A 133 0.548 -14.887 11.181 1.00 0.00 H new ATOM 2125 N SER A 134 0.460 -10.614 12.194 1.00 0.00 N ATOM 2126 CA SER A 134 1.604 -9.975 12.837 1.00 0.00 C ATOM 2127 C SER A 134 1.132 -8.997 13.922 1.00 0.00 C ATOM 2128 O SER A 134 0.028 -8.460 13.841 1.00 0.00 O ATOM 2129 CB SER A 134 2.436 -9.221 11.789 1.00 0.00 C ATOM 2130 OG SER A 134 3.017 -8.066 12.385 1.00 0.00 O ATOM 0 H SER A 134 -0.428 -10.480 12.677 1.00 0.00 H new ATOM 0 HA SER A 134 2.218 -10.746 13.302 1.00 0.00 H new ATOM 0 HB2 SER A 134 3.217 -9.871 11.393 1.00 0.00 H new ATOM 0 HB3 SER A 134 1.805 -8.931 10.948 1.00 0.00 H new ATOM 0 HG SER A 134 3.549 -7.586 11.717 1.00 0.00 H new ATOM 2217 N CYS A 139 -1.263 -4.114 9.107 1.00 0.00 N ATOM 2218 CA CYS A 139 -1.886 -4.711 7.929 1.00 0.00 C ATOM 2219 C CYS A 139 -2.460 -3.632 7.011 1.00 0.00 C ATOM 2220 O CYS A 139 -2.510 -3.803 5.794 1.00 0.00 O ATOM 2221 CB CYS A 139 -3.002 -5.666 8.357 1.00 0.00 C ATOM 2222 SG CYS A 139 -4.134 -4.806 9.477 1.00 0.00 S ATOM 0 HA CYS A 139 -1.122 -5.263 7.382 1.00 0.00 H new ATOM 0 HB2 CYS A 139 -3.543 -6.026 7.482 1.00 0.00 H new ATOM 0 HB3 CYS A 139 -2.578 -6.540 8.852 1.00 0.00 H new ATOM 0 HG CYS A 139 -5.172 -5.555 9.704 1.00 0.00 H new ATOM 2228 N PHE A 140 -2.893 -2.523 7.604 1.00 0.00 N ATOM 2229 CA PHE A 140 -3.463 -1.427 6.826 1.00 0.00 C ATOM 2230 C PHE A 140 -2.470 -0.955 5.766 1.00 0.00 C ATOM 2231 O PHE A 140 -2.861 -0.586 4.658 1.00 0.00 O ATOM 2232 CB PHE A 140 -3.842 -0.254 7.767 1.00 0.00 C ATOM 2233 CG PHE A 140 -5.346 -0.218 7.977 1.00 0.00 C ATOM 2234 CD1 PHE A 140 -6.048 -1.405 8.221 1.00 0.00 C ATOM 2235 CD2 PHE A 140 -6.034 1.002 7.922 1.00 0.00 C ATOM 2236 CE1 PHE A 140 -7.433 -1.374 8.412 1.00 0.00 C ATOM 2237 CE2 PHE A 140 -7.421 1.032 8.113 1.00 0.00 C ATOM 2238 CZ PHE A 140 -8.120 -0.155 8.358 1.00 0.00 C ATOM 0 H PHE A 140 -2.861 -2.360 8.610 1.00 0.00 H new ATOM 0 HA PHE A 140 -4.362 -1.782 6.323 1.00 0.00 H new ATOM 0 HB2 PHE A 140 -3.336 -0.368 8.726 1.00 0.00 H new ATOM 0 HB3 PHE A 140 -3.504 0.690 7.339 1.00 0.00 H new ATOM 0 HD1 PHE A 140 -5.519 -2.346 8.262 1.00 0.00 H new ATOM 0 HD2 PHE A 140 -5.495 1.918 7.732 1.00 0.00 H new ATOM 0 HE1 PHE A 140 -7.973 -2.290 8.601 1.00 0.00 H new ATOM 0 HE2 PHE A 140 -7.951 1.972 8.071 1.00 0.00 H new ATOM 0 HZ PHE A 140 -9.190 -0.131 8.505 1.00 0.00 H new ATOM 2248 N CYS A 141 -1.188 -0.981 6.103 1.00 0.00 N ATOM 2249 CA CYS A 141 -0.163 -0.567 5.160 1.00 0.00 C ATOM 2250 C CYS A 141 -0.138 -1.523 3.978 1.00 0.00 C ATOM 2251 O CYS A 141 0.106 -1.120 2.841 1.00 0.00 O ATOM 2252 CB CYS A 141 1.206 -0.553 5.842 1.00 0.00 C ATOM 2253 SG CYS A 141 2.488 -0.203 4.615 1.00 0.00 S ATOM 0 H CYS A 141 -0.837 -1.281 7.013 1.00 0.00 H new ATOM 0 HA CYS A 141 -0.392 0.439 4.807 1.00 0.00 H new ATOM 0 HB2 CYS A 141 1.225 0.202 6.628 1.00 0.00 H new ATOM 0 HB3 CYS A 141 1.397 -1.515 6.318 1.00 0.00 H new ATOM 0 HG CYS A 141 1.973 -0.254 3.423 1.00 0.00 H new ATOM 2259 N ALA A 142 -0.396 -2.798 4.261 1.00 0.00 N ATOM 2260 CA ALA A 142 -0.405 -3.818 3.221 1.00 0.00 C ATOM 2261 C ALA A 142 -1.482 -3.527 2.185 1.00 0.00 C ATOM 2262 O ALA A 142 -1.283 -3.764 0.994 1.00 0.00 O ATOM 2263 CB ALA A 142 -0.648 -5.188 3.840 1.00 0.00 C ATOM 0 H ALA A 142 -0.600 -3.146 5.198 1.00 0.00 H new ATOM 0 HA ALA A 142 0.566 -3.809 2.725 1.00 0.00 H new ATOM 0 HB1 ALA A 142 -0.653 -5.946 3.056 1.00 0.00 H new ATOM 0 HB2 ALA A 142 0.145 -5.410 4.554 1.00 0.00 H new ATOM 0 HB3 ALA A 142 -1.610 -5.190 4.353 1.00 0.00 H new ATOM 2269 N GLU A 143 -2.622 -3.001 2.634 1.00 0.00 N ATOM 2270 CA GLU A 143 -3.698 -2.681 1.708 1.00 0.00 C ATOM 2271 C GLU A 143 -3.224 -1.633 0.712 1.00 0.00 C ATOM 2272 O GLU A 143 -3.287 -1.839 -0.499 1.00 0.00 O ATOM 2273 CB GLU A 143 -4.922 -2.158 2.472 1.00 0.00 C ATOM 2274 CG GLU A 143 -5.673 -3.331 3.106 1.00 0.00 C ATOM 2275 CD GLU A 143 -6.830 -2.812 3.955 1.00 0.00 C ATOM 2276 OE1 GLU A 143 -6.941 -1.606 4.096 1.00 0.00 O ATOM 2277 OE2 GLU A 143 -7.587 -3.630 4.452 1.00 0.00 O ATOM 0 H GLU A 143 -2.818 -2.793 3.613 1.00 0.00 H new ATOM 0 HA GLU A 143 -3.981 -3.587 1.172 1.00 0.00 H new ATOM 0 HB2 GLU A 143 -4.608 -1.455 3.243 1.00 0.00 H new ATOM 0 HB3 GLU A 143 -5.581 -1.615 1.795 1.00 0.00 H new ATOM 0 HG2 GLU A 143 -6.051 -3.995 2.328 1.00 0.00 H new ATOM 0 HG3 GLU A 143 -4.993 -3.918 3.723 1.00 0.00 H new ATOM 2284 N GLY A 144 -2.738 -0.510 1.234 1.00 0.00 N ATOM 2285 CA GLY A 144 -2.245 0.564 0.383 1.00 0.00 C ATOM 2286 C GLY A 144 -1.162 0.057 -0.562 1.00 0.00 C ATOM 2287 O GLY A 144 -1.128 0.426 -1.734 1.00 0.00 O ATOM 0 H GLY A 144 -2.676 -0.323 2.235 1.00 0.00 H new ATOM 0 HA2 GLY A 144 -3.069 0.983 -0.194 1.00 0.00 H new ATOM 0 HA3 GLY A 144 -1.846 1.369 1.001 1.00 0.00 H new ATOM 2291 N LEU A 145 -0.277 -0.793 -0.043 1.00 0.00 N ATOM 2292 CA LEU A 145 0.804 -1.344 -0.856 1.00 0.00 C ATOM 2293 C LEU A 145 0.239 -2.085 -2.068 1.00 0.00 C ATOM 2294 O LEU A 145 0.723 -1.923 -3.188 1.00 0.00 O ATOM 2295 CB LEU A 145 1.658 -2.314 -0.019 1.00 0.00 C ATOM 2296 CG LEU A 145 2.558 -1.526 0.963 1.00 0.00 C ATOM 2297 CD1 LEU A 145 2.958 -2.427 2.151 1.00 0.00 C ATOM 2298 CD2 LEU A 145 3.833 -1.043 0.236 1.00 0.00 C ATOM 0 H LEU A 145 -0.287 -1.112 0.926 1.00 0.00 H new ATOM 0 HA LEU A 145 1.426 -0.518 -1.201 1.00 0.00 H new ATOM 0 HB2 LEU A 145 1.011 -2.994 0.535 1.00 0.00 H new ATOM 0 HB3 LEU A 145 2.275 -2.927 -0.677 1.00 0.00 H new ATOM 0 HG LEU A 145 2.003 -0.664 1.333 1.00 0.00 H new ATOM 0 HD11 LEU A 145 3.591 -1.865 2.837 1.00 0.00 H new ATOM 0 HD12 LEU A 145 2.061 -2.759 2.674 1.00 0.00 H new ATOM 0 HD13 LEU A 145 3.504 -3.295 1.782 1.00 0.00 H new ATOM 0 HD21 LEU A 145 4.462 -0.489 0.933 1.00 0.00 H new ATOM 0 HD22 LEU A 145 4.383 -1.904 -0.144 1.00 0.00 H new ATOM 0 HD23 LEU A 145 3.555 -0.395 -0.595 1.00 0.00 H new ATOM 2310 N LEU A 146 -0.780 -2.905 -1.832 1.00 0.00 N ATOM 2311 CA LEU A 146 -1.395 -3.678 -2.910 1.00 0.00 C ATOM 2312 C LEU A 146 -1.984 -2.762 -3.983 1.00 0.00 C ATOM 2313 O LEU A 146 -1.868 -3.045 -5.176 1.00 0.00 O ATOM 2314 CB LEU A 146 -2.502 -4.575 -2.347 1.00 0.00 C ATOM 2315 CG LEU A 146 -1.888 -5.679 -1.466 1.00 0.00 C ATOM 2316 CD1 LEU A 146 -2.982 -6.296 -0.589 1.00 0.00 C ATOM 2317 CD2 LEU A 146 -1.263 -6.781 -2.348 1.00 0.00 C ATOM 0 H LEU A 146 -1.196 -3.052 -0.912 1.00 0.00 H new ATOM 0 HA LEU A 146 -0.618 -4.291 -3.366 1.00 0.00 H new ATOM 0 HB2 LEU A 146 -3.202 -3.979 -1.762 1.00 0.00 H new ATOM 0 HB3 LEU A 146 -3.069 -5.023 -3.163 1.00 0.00 H new ATOM 0 HG LEU A 146 -1.111 -5.240 -0.840 1.00 0.00 H new ATOM 0 HD11 LEU A 146 -2.550 -7.078 0.036 1.00 0.00 H new ATOM 0 HD12 LEU A 146 -3.418 -5.524 0.045 1.00 0.00 H new ATOM 0 HD13 LEU A 146 -3.758 -6.725 -1.223 1.00 0.00 H new ATOM 0 HD21 LEU A 146 -0.833 -7.555 -1.713 1.00 0.00 H new ATOM 0 HD22 LEU A 146 -2.033 -7.219 -2.983 1.00 0.00 H new ATOM 0 HD23 LEU A 146 -0.481 -6.348 -2.972 1.00 0.00 H new ATOM 2329 N PHE A 147 -2.621 -1.672 -3.561 1.00 0.00 N ATOM 2330 CA PHE A 147 -3.225 -0.739 -4.510 1.00 0.00 C ATOM 2331 C PHE A 147 -2.156 0.029 -5.280 1.00 0.00 C ATOM 2332 O PHE A 147 -2.338 0.354 -6.453 1.00 0.00 O ATOM 2333 CB PHE A 147 -4.125 0.251 -3.765 1.00 0.00 C ATOM 2334 CG PHE A 147 -5.349 -0.473 -3.244 1.00 0.00 C ATOM 2335 CD1 PHE A 147 -6.287 -0.996 -4.142 1.00 0.00 C ATOM 2336 CD2 PHE A 147 -5.543 -0.622 -1.864 1.00 0.00 C ATOM 2337 CE1 PHE A 147 -7.418 -1.667 -3.662 1.00 0.00 C ATOM 2338 CE2 PHE A 147 -6.675 -1.293 -1.383 1.00 0.00 C ATOM 2339 CZ PHE A 147 -7.611 -1.815 -2.283 1.00 0.00 C ATOM 0 H PHE A 147 -2.732 -1.415 -2.580 1.00 0.00 H new ATOM 0 HA PHE A 147 -3.818 -1.315 -5.220 1.00 0.00 H new ATOM 0 HB2 PHE A 147 -3.578 0.705 -2.938 1.00 0.00 H new ATOM 0 HB3 PHE A 147 -4.424 1.060 -4.432 1.00 0.00 H new ATOM 0 HD1 PHE A 147 -6.138 -0.882 -5.206 1.00 0.00 H new ATOM 0 HD2 PHE A 147 -4.819 -0.219 -1.171 1.00 0.00 H new ATOM 0 HE1 PHE A 147 -8.141 -2.070 -4.355 1.00 0.00 H new ATOM 0 HE2 PHE A 147 -6.825 -1.407 -0.320 1.00 0.00 H new ATOM 0 HZ PHE A 147 -8.484 -2.333 -1.913 1.00 0.00 H new ATOM 2349 N GLY A 148 -1.046 0.323 -4.615 1.00 0.00 N ATOM 2350 CA GLY A 148 0.040 1.057 -5.255 1.00 0.00 C ATOM 2351 C GLY A 148 0.607 0.275 -6.431 1.00 0.00 C ATOM 2352 O GLY A 148 0.861 0.834 -7.497 1.00 0.00 O ATOM 0 H GLY A 148 -0.874 0.068 -3.643 1.00 0.00 H new ATOM 0 HA2 GLY A 148 -0.324 2.025 -5.599 1.00 0.00 H new ATOM 0 HA3 GLY A 148 0.829 1.252 -4.529 1.00 0.00 H new ATOM 2356 N ALA A 149 0.807 -1.020 -6.227 1.00 0.00 N ATOM 2357 CA ALA A 149 1.352 -1.877 -7.273 1.00 0.00 C ATOM 2358 C ALA A 149 0.330 -2.094 -8.391 1.00 0.00 C ATOM 2359 O ALA A 149 0.691 -2.195 -9.562 1.00 0.00 O ATOM 2360 CB ALA A 149 1.755 -3.230 -6.674 1.00 0.00 C ATOM 0 H ALA A 149 0.601 -1.499 -5.351 1.00 0.00 H new ATOM 0 HA ALA A 149 2.228 -1.386 -7.697 1.00 0.00 H new ATOM 0 HB1 ALA A 149 2.162 -3.868 -7.458 1.00 0.00 H new ATOM 0 HB2 ALA A 149 2.510 -3.076 -5.903 1.00 0.00 H new ATOM 0 HB3 ALA A 149 0.880 -3.708 -6.234 1.00 0.00 H new ATOM 2366 N ALA A 150 -0.943 -2.166 -8.020 1.00 0.00 N ATOM 2367 CA ALA A 150 -2.002 -2.376 -9.002 1.00 0.00 C ATOM 2368 C ALA A 150 -2.118 -1.181 -9.947 1.00 0.00 C ATOM 2369 O ALA A 150 -2.130 -1.342 -11.168 1.00 0.00 O ATOM 2370 CB ALA A 150 -3.338 -2.604 -8.286 1.00 0.00 C ATOM 0 H ALA A 150 -1.266 -2.083 -7.056 1.00 0.00 H new ATOM 0 HA ALA A 150 -1.751 -3.257 -9.593 1.00 0.00 H new ATOM 0 HB1 ALA A 150 -4.125 -2.760 -9.024 1.00 0.00 H new ATOM 0 HB2 ALA A 150 -3.262 -3.483 -7.645 1.00 0.00 H new ATOM 0 HB3 ALA A 150 -3.579 -1.732 -7.678 1.00 0.00 H new ATOM 2376 N GLN A 151 -2.201 0.016 -9.378 1.00 0.00 N ATOM 2377 CA GLN A 151 -2.313 1.227 -10.185 1.00 0.00 C ATOM 2378 C GLN A 151 -1.076 1.395 -11.060 1.00 0.00 C ATOM 2379 O GLN A 151 -1.180 1.617 -12.263 1.00 0.00 O ATOM 2380 CB GLN A 151 -2.469 2.450 -9.278 1.00 0.00 C ATOM 2381 CG GLN A 151 -3.799 2.363 -8.527 1.00 0.00 C ATOM 2382 CD GLN A 151 -3.967 3.581 -7.625 1.00 0.00 C ATOM 2383 OE1 GLN A 151 -3.124 3.840 -6.765 1.00 0.00 O ATOM 2384 NE2 GLN A 151 -5.012 4.349 -7.769 1.00 0.00 N ATOM 0 H GLN A 151 -2.193 0.175 -8.370 1.00 0.00 H new ATOM 0 HA GLN A 151 -3.192 1.138 -10.824 1.00 0.00 H new ATOM 0 HB2 GLN A 151 -1.642 2.498 -8.570 1.00 0.00 H new ATOM 0 HB3 GLN A 151 -2.434 3.363 -9.872 1.00 0.00 H new ATOM 0 HG2 GLN A 151 -4.624 2.309 -9.237 1.00 0.00 H new ATOM 0 HG3 GLN A 151 -3.831 1.451 -7.931 1.00 0.00 H new ATOM 0 HE21 GLN A 151 -5.709 4.133 -8.482 1.00 0.00 H new ATOM 0 HE22 GLN A 151 -5.132 5.165 -7.169 1.00 0.00 H new ATOM 2393 N HIS A 152 0.092 1.290 -10.439 1.00 0.00 N ATOM 2394 CA HIS A 152 1.354 1.435 -11.161 1.00 0.00 C ATOM 2395 C HIS A 152 1.281 0.739 -12.523 1.00 0.00 C ATOM 2396 O HIS A 152 1.952 1.145 -13.473 1.00 0.00 O ATOM 2397 CB HIS A 152 2.499 0.833 -10.333 1.00 0.00 C ATOM 2398 CG HIS A 152 3.818 1.394 -10.799 1.00 0.00 C ATOM 2399 ND1 HIS A 152 4.600 2.205 -9.990 1.00 0.00 N ATOM 2400 CD2 HIS A 152 4.503 1.272 -11.981 1.00 0.00 C ATOM 2401 CE1 HIS A 152 5.702 2.534 -10.692 1.00 0.00 C ATOM 2402 NE2 HIS A 152 5.691 1.991 -11.912 1.00 0.00 N ATOM 0 H HIS A 152 0.194 1.106 -9.441 1.00 0.00 H new ATOM 0 HA HIS A 152 1.540 2.497 -11.322 1.00 0.00 H new ATOM 0 HB2 HIS A 152 2.352 1.056 -9.276 1.00 0.00 H new ATOM 0 HB3 HIS A 152 2.500 -0.252 -10.432 1.00 0.00 H new ATOM 0 HD1 HIS A 152 4.381 2.499 -9.038 1.00 0.00 H new ATOM 0 HD2 HIS A 152 4.170 0.703 -12.836 1.00 0.00 H new ATOM 0 HE1 HIS A 152 6.497 3.160 -10.314 1.00 0.00 H new ATOM 2411 N PHE A 153 0.459 -0.312 -12.607 1.00 0.00 N ATOM 2412 CA PHE A 153 0.301 -1.065 -13.865 1.00 0.00 C ATOM 2413 C PHE A 153 -1.126 -0.927 -14.407 1.00 0.00 C ATOM 2414 O PHE A 153 -1.671 -1.864 -14.991 1.00 0.00 O ATOM 2415 CB PHE A 153 0.623 -2.549 -13.628 1.00 0.00 C ATOM 2416 CG PHE A 153 1.736 -2.666 -12.611 1.00 0.00 C ATOM 2417 CD1 PHE A 153 2.881 -1.867 -12.727 1.00 0.00 C ATOM 2418 CD2 PHE A 153 1.621 -3.570 -11.551 1.00 0.00 C ATOM 2419 CE1 PHE A 153 3.907 -1.973 -11.782 1.00 0.00 C ATOM 2420 CE2 PHE A 153 2.646 -3.676 -10.605 1.00 0.00 C ATOM 2421 CZ PHE A 153 3.790 -2.877 -10.720 1.00 0.00 C ATOM 0 H PHE A 153 -0.103 -0.661 -11.831 1.00 0.00 H new ATOM 0 HA PHE A 153 0.992 -0.654 -14.601 1.00 0.00 H new ATOM 0 HB2 PHE A 153 -0.265 -3.073 -13.274 1.00 0.00 H new ATOM 0 HB3 PHE A 153 0.920 -3.022 -14.564 1.00 0.00 H new ATOM 0 HD1 PHE A 153 2.972 -1.169 -13.546 1.00 0.00 H new ATOM 0 HD2 PHE A 153 0.739 -4.188 -11.462 1.00 0.00 H new ATOM 0 HE1 PHE A 153 4.790 -1.357 -11.872 1.00 0.00 H new ATOM 0 HE2 PHE A 153 2.555 -4.374 -9.786 1.00 0.00 H new ATOM 0 HZ PHE A 153 4.582 -2.958 -9.990 1.00 0.00 H new ATOM 2431 N GLN A 154 -1.720 0.248 -14.213 1.00 0.00 N ATOM 2432 CA GLN A 154 -3.082 0.508 -14.688 1.00 0.00 C ATOM 2433 C GLN A 154 -3.977 -0.721 -14.507 1.00 0.00 C ATOM 2434 O GLN A 154 -4.735 -1.085 -15.406 1.00 0.00 O ATOM 2435 CB GLN A 154 -3.049 0.910 -16.169 1.00 0.00 C ATOM 2436 CG GLN A 154 -4.339 1.654 -16.533 1.00 0.00 C ATOM 2437 CD GLN A 154 -4.367 1.946 -18.030 1.00 0.00 C ATOM 2438 OE1 GLN A 154 -3.324 1.660 -18.760 1.00 0.00 O flip ATOM 2439 NE2 GLN A 154 -5.365 2.448 -18.548 1.00 0.00 N flip ATOM 0 H GLN A 154 -1.284 1.035 -13.732 1.00 0.00 H new ATOM 0 HA GLN A 154 -3.497 1.323 -14.095 1.00 0.00 H new ATOM 0 HB2 GLN A 154 -2.185 1.545 -16.364 1.00 0.00 H new ATOM 0 HB3 GLN A 154 -2.941 0.023 -16.794 1.00 0.00 H new ATOM 0 HG2 GLN A 154 -5.206 1.054 -16.255 1.00 0.00 H new ATOM 0 HG3 GLN A 154 -4.402 2.586 -15.971 1.00 0.00 H new ATOM 0 HE21 GLN A 154 -6.179 2.671 -17.976 1.00 0.00 H new ATOM 0 HE22 GLN A 154 -5.377 2.641 -19.550 1.00 0.00 H new ATOM 2448 N GLN A 155 -3.882 -1.356 -13.337 1.00 0.00 N ATOM 2449 CA GLN A 155 -4.684 -2.542 -13.039 1.00 0.00 C ATOM 2450 C GLN A 155 -5.588 -2.274 -11.834 1.00 0.00 C ATOM 2451 O GLN A 155 -5.111 -2.137 -10.708 1.00 0.00 O ATOM 2452 CB GLN A 155 -3.747 -3.723 -12.744 1.00 0.00 C ATOM 2453 CG GLN A 155 -4.551 -4.926 -12.253 1.00 0.00 C ATOM 2454 CD GLN A 155 -5.694 -5.231 -13.216 1.00 0.00 C ATOM 2455 OE1 GLN A 155 -6.907 -4.857 -12.914 1.00 0.00 O flip ATOM 2456 NE2 GLN A 155 -5.475 -5.826 -14.272 1.00 0.00 N flip ATOM 0 H GLN A 155 -3.259 -1.069 -12.582 1.00 0.00 H new ATOM 0 HA GLN A 155 -5.312 -2.782 -13.897 1.00 0.00 H new ATOM 0 HB2 GLN A 155 -3.192 -3.990 -13.644 1.00 0.00 H new ATOM 0 HB3 GLN A 155 -3.013 -3.435 -11.991 1.00 0.00 H new ATOM 0 HG2 GLN A 155 -3.899 -5.795 -12.165 1.00 0.00 H new ATOM 0 HG3 GLN A 155 -4.949 -4.724 -11.259 1.00 0.00 H new ATOM 0 HE21 GLN A 155 -4.526 -6.117 -14.506 1.00 0.00 H new ATOM 0 HE22 GLN A 155 -6.243 -6.027 -14.913 1.00 0.00 H new ATOM 2465 N LYS A 156 -6.892 -2.190 -12.081 1.00 0.00 N ATOM 2466 CA LYS A 156 -7.855 -1.926 -11.008 1.00 0.00 C ATOM 2467 C LYS A 156 -8.214 -3.213 -10.264 1.00 0.00 C ATOM 2468 O LYS A 156 -8.359 -4.273 -10.873 1.00 0.00 O ATOM 2469 CB LYS A 156 -9.127 -1.305 -11.591 1.00 0.00 C ATOM 2470 CG LYS A 156 -8.774 -0.005 -12.318 1.00 0.00 C ATOM 2471 CD LYS A 156 -10.055 0.786 -12.604 1.00 0.00 C ATOM 2472 CE LYS A 156 -10.944 -0.001 -13.572 1.00 0.00 C ATOM 2473 NZ LYS A 156 -11.962 0.913 -14.165 1.00 0.00 N ATOM 0 H LYS A 156 -7.307 -2.299 -13.006 1.00 0.00 H new ATOM 0 HA LYS A 156 -7.395 -1.233 -10.303 1.00 0.00 H new ATOM 0 HB2 LYS A 156 -9.602 -2.003 -12.281 1.00 0.00 H new ATOM 0 HB3 LYS A 156 -9.845 -1.106 -10.795 1.00 0.00 H new ATOM 0 HG2 LYS A 156 -8.094 0.591 -11.709 1.00 0.00 H new ATOM 0 HG3 LYS A 156 -8.255 -0.227 -13.251 1.00 0.00 H new ATOM 0 HD2 LYS A 156 -10.592 0.975 -11.674 1.00 0.00 H new ATOM 0 HD3 LYS A 156 -9.806 1.757 -13.032 1.00 0.00 H new ATOM 0 HE2 LYS A 156 -10.337 -0.447 -14.360 1.00 0.00 H new ATOM 0 HE3 LYS A 156 -11.436 -0.820 -13.047 1.00 0.00 H new ATOM 0 HZ1 LYS A 156 -12.566 0.380 -14.822 1.00 0.00 H new ATOM 0 HZ2 LYS A 156 -12.548 1.318 -13.407 1.00 0.00 H new ATOM 0 HZ3 LYS A 156 -11.483 1.679 -14.679 1.00 0.00 H new ATOM 2487 N ILE A 157 -8.353 -3.110 -8.939 1.00 0.00 N ATOM 2488 CA ILE A 157 -8.692 -4.273 -8.114 1.00 0.00 C ATOM 2489 C ILE A 157 -9.507 -3.862 -6.892 1.00 0.00 C ATOM 2490 O ILE A 157 -9.615 -2.679 -6.570 1.00 0.00 O ATOM 2491 CB ILE A 157 -7.415 -4.974 -7.642 1.00 0.00 C ATOM 2492 CG1 ILE A 157 -6.498 -3.965 -6.914 1.00 0.00 C ATOM 2493 CG2 ILE A 157 -6.679 -5.556 -8.849 1.00 0.00 C ATOM 2494 CD1 ILE A 157 -5.568 -4.720 -5.961 1.00 0.00 C ATOM 0 H ILE A 157 -8.237 -2.241 -8.418 1.00 0.00 H new ATOM 0 HA ILE A 157 -9.287 -4.951 -8.726 1.00 0.00 H new ATOM 0 HB ILE A 157 -7.680 -5.776 -6.953 1.00 0.00 H new ATOM 0 HG12 ILE A 157 -5.913 -3.400 -7.639 1.00 0.00 H new ATOM 0 HG13 ILE A 157 -7.099 -3.245 -6.359 1.00 0.00 H new ATOM 0 HG21 ILE A 157 -5.770 -6.055 -8.515 1.00 0.00 H new ATOM 0 HG22 ILE A 157 -7.323 -6.275 -9.356 1.00 0.00 H new ATOM 0 HG23 ILE A 157 -6.419 -4.753 -9.539 1.00 0.00 H new ATOM 0 HD11 ILE A 157 -4.920 -4.010 -5.446 1.00 0.00 H new ATOM 0 HD12 ILE A 157 -6.163 -5.266 -5.228 1.00 0.00 H new ATOM 0 HD13 ILE A 157 -4.958 -5.423 -6.529 1.00 0.00 H new ATOM 2506 N GLN A 158 -10.062 -4.858 -6.207 1.00 0.00 N ATOM 2507 CA GLN A 158 -10.853 -4.616 -4.999 1.00 0.00 C ATOM 2508 C GLN A 158 -10.387 -5.547 -3.888 1.00 0.00 C ATOM 2509 O GLN A 158 -10.050 -6.698 -4.144 1.00 0.00 O ATOM 2510 CB GLN A 158 -12.337 -4.857 -5.287 1.00 0.00 C ATOM 2511 CG GLN A 158 -13.168 -4.427 -4.078 1.00 0.00 C ATOM 2512 CD GLN A 158 -14.649 -4.666 -4.353 1.00 0.00 C ATOM 2513 OE1 GLN A 158 -15.030 -4.967 -5.485 1.00 0.00 O ATOM 2514 NE2 GLN A 158 -15.511 -4.550 -3.381 1.00 0.00 N ATOM 0 H GLN A 158 -9.980 -5.841 -6.466 1.00 0.00 H new ATOM 0 HA GLN A 158 -10.717 -3.581 -4.685 1.00 0.00 H new ATOM 0 HB2 GLN A 158 -12.643 -4.296 -6.170 1.00 0.00 H new ATOM 0 HB3 GLN A 158 -12.510 -5.911 -5.504 1.00 0.00 H new ATOM 0 HG2 GLN A 158 -12.858 -4.987 -3.196 1.00 0.00 H new ATOM 0 HG3 GLN A 158 -12.995 -3.372 -3.863 1.00 0.00 H new ATOM 0 HE21 GLN A 158 -15.193 -4.301 -2.444 1.00 0.00 H new ATOM 0 HE22 GLN A 158 -16.503 -4.709 -3.557 1.00 0.00 H new ATOM 2523 N ILE A 159 -10.365 -5.044 -2.650 1.00 0.00 N ATOM 2524 CA ILE A 159 -9.924 -5.860 -1.506 1.00 0.00 C ATOM 2525 C ILE A 159 -10.990 -5.927 -0.425 1.00 0.00 C ATOM 2526 O ILE A 159 -11.500 -4.903 0.031 1.00 0.00 O ATOM 2527 CB ILE A 159 -8.625 -5.294 -0.913 1.00 0.00 C ATOM 2528 CG1 ILE A 159 -7.513 -5.390 -1.970 1.00 0.00 C ATOM 2529 CG2 ILE A 159 -8.228 -6.113 0.335 1.00 0.00 C ATOM 2530 CD1 ILE A 159 -6.181 -4.946 -1.367 1.00 0.00 C ATOM 0 H ILE A 159 -10.642 -4.092 -2.412 1.00 0.00 H new ATOM 0 HA ILE A 159 -9.746 -6.870 -1.875 1.00 0.00 H new ATOM 0 HB ILE A 159 -8.771 -4.253 -0.625 1.00 0.00 H new ATOM 0 HG12 ILE A 159 -7.433 -6.414 -2.335 1.00 0.00 H new ATOM 0 HG13 ILE A 159 -7.760 -4.765 -2.828 1.00 0.00 H new ATOM 0 HG21 ILE A 159 -7.306 -5.711 0.756 1.00 0.00 H new ATOM 0 HG22 ILE A 159 -9.023 -6.052 1.078 1.00 0.00 H new ATOM 0 HG23 ILE A 159 -8.074 -7.155 0.053 1.00 0.00 H new ATOM 0 HD11 ILE A 159 -5.398 -5.017 -2.122 1.00 0.00 H new ATOM 0 HD12 ILE A 159 -6.263 -3.914 -1.025 1.00 0.00 H new ATOM 0 HD13 ILE A 159 -5.931 -5.590 -0.524 1.00 0.00 H new ATOM 2542 N SER A 160 -11.304 -7.152 -0.004 1.00 0.00 N ATOM 2543 CA SER A 160 -12.294 -7.375 1.047 1.00 0.00 C ATOM 2544 C SER A 160 -11.597 -7.839 2.318 1.00 0.00 C ATOM 2545 O SER A 160 -11.172 -8.990 2.426 1.00 0.00 O ATOM 2546 CB SER A 160 -13.311 -8.423 0.600 1.00 0.00 C ATOM 2547 OG SER A 160 -14.199 -8.706 1.676 1.00 0.00 O ATOM 0 H SER A 160 -10.886 -8.005 -0.376 1.00 0.00 H new ATOM 0 HA SER A 160 -12.818 -6.440 1.244 1.00 0.00 H new ATOM 0 HB2 SER A 160 -13.870 -8.059 -0.262 1.00 0.00 H new ATOM 0 HB3 SER A 160 -12.799 -9.333 0.287 1.00 0.00 H new ATOM 0 HG SER A 160 -14.854 -9.377 1.392 1.00 0.00 H new ATOM 2553 N HIS A 161 -11.474 -6.925 3.276 1.00 0.00 N ATOM 2554 CA HIS A 161 -10.814 -7.227 4.550 1.00 0.00 C ATOM 2555 C HIS A 161 -11.837 -7.359 5.674 1.00 0.00 C ATOM 2556 O HIS A 161 -12.082 -6.408 6.417 1.00 0.00 O ATOM 2557 CB HIS A 161 -9.820 -6.112 4.886 1.00 0.00 C ATOM 2558 CG HIS A 161 -9.024 -6.496 6.098 1.00 0.00 C ATOM 2559 ND1 HIS A 161 -8.028 -5.683 6.618 1.00 0.00 N ATOM 2560 CD2 HIS A 161 -9.063 -7.603 6.905 1.00 0.00 C ATOM 2561 CE1 HIS A 161 -7.513 -6.310 7.692 1.00 0.00 C ATOM 2562 NE2 HIS A 161 -8.110 -7.485 7.910 1.00 0.00 N ATOM 0 H HIS A 161 -11.821 -5.969 3.198 1.00 0.00 H new ATOM 0 HA HIS A 161 -10.286 -8.176 4.452 1.00 0.00 H new ATOM 0 HB2 HIS A 161 -9.154 -5.938 4.041 1.00 0.00 H new ATOM 0 HB3 HIS A 161 -10.353 -5.179 5.069 1.00 0.00 H new ATOM 0 HD1 HIS A 161 -7.739 -4.776 6.253 1.00 0.00 H new ATOM 0 HD2 HIS A 161 -9.733 -8.441 6.779 1.00 0.00 H new ATOM 0 HE1 HIS A 161 -6.716 -5.912 8.302 1.00 0.00 H new ATOM 0 HE2 HIS A 161 -7.909 -8.153 8.655 1.00 0.00 H new ATOM 2571 N ASP A 162 -12.431 -8.547 5.797 1.00 0.00 N ATOM 2572 CA ASP A 162 -13.428 -8.794 6.840 1.00 0.00 C ATOM 2573 C ASP A 162 -12.760 -9.334 8.100 1.00 0.00 C ATOM 2574 O ASP A 162 -13.186 -9.028 9.213 1.00 0.00 O ATOM 2575 CB ASP A 162 -14.475 -9.792 6.342 1.00 0.00 C ATOM 2576 CG ASP A 162 -15.594 -9.930 7.370 1.00 0.00 C ATOM 2577 OD1 ASP A 162 -15.458 -10.757 8.256 1.00 0.00 O ATOM 2578 OD2 ASP A 162 -16.568 -9.205 7.256 1.00 0.00 O ATOM 0 H ASP A 162 -12.241 -9.347 5.193 1.00 0.00 H new ATOM 0 HA ASP A 162 -13.918 -7.850 7.079 1.00 0.00 H new ATOM 0 HB2 ASP A 162 -14.885 -9.457 5.389 1.00 0.00 H new ATOM 0 HB3 ASP A 162 -14.010 -10.762 6.166 1.00 0.00 H new ATOM 2583 N THR A 163 -11.702 -10.129 7.926 1.00 0.00 N ATOM 2584 CA THR A 163 -10.983 -10.684 9.075 1.00 0.00 C ATOM 2585 C THR A 163 -9.763 -9.829 9.385 1.00 0.00 C ATOM 2586 O THR A 163 -8.873 -9.681 8.552 1.00 0.00 O ATOM 2587 CB THR A 163 -10.541 -12.127 8.789 1.00 0.00 C ATOM 2588 OG1 THR A 163 -11.581 -12.812 8.104 1.00 0.00 O ATOM 2589 CG2 THR A 163 -10.237 -12.844 10.109 1.00 0.00 C ATOM 0 H THR A 163 -11.329 -10.400 7.016 1.00 0.00 H new ATOM 0 HA THR A 163 -11.654 -10.686 9.934 1.00 0.00 H new ATOM 0 HB THR A 163 -9.643 -12.116 8.171 1.00 0.00 H new ATOM 0 HG1 THR A 163 -11.300 -13.732 7.919 1.00 0.00 H new ATOM 0 HG21 THR A 163 -9.924 -13.868 9.903 1.00 0.00 H new ATOM 0 HG22 THR A 163 -9.439 -12.318 10.633 1.00 0.00 H new ATOM 0 HG23 THR A 163 -11.132 -12.857 10.731 1.00 0.00 H new ATOM 2597 N CYS A 164 -9.729 -9.257 10.587 1.00 0.00 N ATOM 2598 CA CYS A 164 -8.608 -8.406 10.988 1.00 0.00 C ATOM 2599 C CYS A 164 -8.246 -8.640 12.448 1.00 0.00 C ATOM 2600 O CYS A 164 -9.106 -8.597 13.329 1.00 0.00 O ATOM 2601 CB CYS A 164 -8.973 -6.935 10.783 1.00 0.00 C ATOM 2602 SG CYS A 164 -7.476 -5.923 10.886 1.00 0.00 S ATOM 0 H CYS A 164 -10.456 -9.365 11.294 1.00 0.00 H new ATOM 0 HA CYS A 164 -7.747 -8.660 10.370 1.00 0.00 H new ATOM 0 HB2 CYS A 164 -9.451 -6.799 9.813 1.00 0.00 H new ATOM 0 HB3 CYS A 164 -9.692 -6.619 11.539 1.00 0.00 H new ATOM 0 HG CYS A 164 -7.785 -4.673 10.710 1.00 0.00 H new ATOM 2608 N MET A 165 -6.964 -8.877 12.697 1.00 0.00 N ATOM 2609 CA MET A 165 -6.487 -9.104 14.052 1.00 0.00 C ATOM 2610 C MET A 165 -6.933 -7.973 14.969 1.00 0.00 C ATOM 2611 O MET A 165 -6.834 -8.072 16.192 1.00 0.00 O ATOM 2612 CB MET A 165 -4.957 -9.190 14.055 1.00 0.00 C ATOM 2613 CG MET A 165 -4.458 -9.422 15.483 1.00 0.00 C ATOM 2614 SD MET A 165 -2.731 -9.962 15.437 1.00 0.00 S ATOM 2615 CE MET A 165 -3.052 -11.731 15.235 1.00 0.00 C ATOM 0 H MET A 165 -6.240 -8.917 11.980 1.00 0.00 H new ATOM 0 HA MET A 165 -6.907 -10.041 14.416 1.00 0.00 H new ATOM 0 HB2 MET A 165 -4.627 -10.002 13.407 1.00 0.00 H new ATOM 0 HB3 MET A 165 -4.530 -8.270 13.655 1.00 0.00 H new ATOM 0 HG2 MET A 165 -4.548 -8.505 16.065 1.00 0.00 H new ATOM 0 HG3 MET A 165 -5.073 -10.175 15.977 1.00 0.00 H new ATOM 0 HE1 MET A 165 -2.204 -12.300 15.615 1.00 0.00 H new ATOM 0 HE2 MET A 165 -3.950 -12.003 15.790 1.00 0.00 H new ATOM 0 HE3 MET A 165 -3.196 -11.956 14.178 1.00 0.00 H new ATOM 2625 N HIS A 166 -7.420 -6.896 14.367 1.00 0.00 N ATOM 2626 CA HIS A 166 -7.871 -5.746 15.131 1.00 0.00 C ATOM 2627 C HIS A 166 -9.212 -6.029 15.810 1.00 0.00 C ATOM 2628 O HIS A 166 -9.580 -5.354 16.771 1.00 0.00 O ATOM 2629 CB HIS A 166 -8.002 -4.529 14.209 1.00 0.00 C ATOM 2630 CG HIS A 166 -8.588 -3.375 14.973 1.00 0.00 C ATOM 2631 ND1 HIS A 166 -9.901 -3.377 15.416 1.00 0.00 N ATOM 2632 CD2 HIS A 166 -8.057 -2.177 15.381 1.00 0.00 C ATOM 2633 CE1 HIS A 166 -10.114 -2.212 16.059 1.00 0.00 C ATOM 2634 NE2 HIS A 166 -9.020 -1.445 16.066 1.00 0.00 N ATOM 0 H HIS A 166 -7.512 -6.797 13.356 1.00 0.00 H new ATOM 0 HA HIS A 166 -7.133 -5.539 15.906 1.00 0.00 H new ATOM 0 HB2 HIS A 166 -7.025 -4.255 13.811 1.00 0.00 H new ATOM 0 HB3 HIS A 166 -8.636 -4.773 13.357 1.00 0.00 H new ATOM 0 HD2 HIS A 166 -7.044 -1.852 15.198 1.00 0.00 H new ATOM 0 HE1 HIS A 166 -11.053 -1.933 16.513 1.00 0.00 H new ATOM 0 HE2 HIS A 166 -8.914 -0.521 16.484 1.00 0.00 H new ATOM 2643 N THR A 167 -9.947 -7.027 15.305 1.00 0.00 N ATOM 2644 CA THR A 167 -11.252 -7.372 15.882 1.00 0.00 C ATOM 2645 C THR A 167 -11.133 -8.586 16.809 1.00 0.00 C ATOM 2646 O THR A 167 -12.113 -9.289 17.052 1.00 0.00 O ATOM 2647 CB THR A 167 -12.259 -7.670 14.756 1.00 0.00 C ATOM 2648 OG1 THR A 167 -12.009 -6.799 13.661 1.00 0.00 O ATOM 2649 CG2 THR A 167 -13.689 -7.453 15.263 1.00 0.00 C ATOM 0 H THR A 167 -9.667 -7.602 14.511 1.00 0.00 H new ATOM 0 HA THR A 167 -11.605 -6.524 16.469 1.00 0.00 H new ATOM 0 HB THR A 167 -12.146 -8.706 14.437 1.00 0.00 H new ATOM 0 HG1 THR A 167 -12.647 -6.987 12.941 1.00 0.00 H new ATOM 0 HG21 THR A 167 -14.396 -7.666 14.461 1.00 0.00 H new ATOM 0 HG22 THR A 167 -13.882 -8.120 16.103 1.00 0.00 H new ATOM 0 HG23 THR A 167 -13.807 -6.419 15.586 1.00 0.00 H new ATOM 2657 N GLY A 168 -9.931 -8.814 17.332 1.00 0.00 N ATOM 2658 CA GLY A 168 -9.701 -9.936 18.244 1.00 0.00 C ATOM 2659 C GLY A 168 -9.291 -11.200 17.491 1.00 0.00 C ATOM 2660 O GLY A 168 -8.864 -12.180 18.100 1.00 0.00 O ATOM 0 H GLY A 168 -9.107 -8.244 17.144 1.00 0.00 H new ATOM 0 HA2 GLY A 168 -8.923 -9.670 18.960 1.00 0.00 H new ATOM 0 HA3 GLY A 168 -10.608 -10.131 18.817 1.00 0.00 H new ATOM 2664 N ALA A 169 -9.420 -11.175 16.168 1.00 0.00 N ATOM 2665 CA ALA A 169 -9.051 -12.335 15.361 1.00 0.00 C ATOM 2666 C ALA A 169 -7.573 -12.661 15.553 1.00 0.00 C ATOM 2667 O ALA A 169 -6.782 -11.792 15.916 1.00 0.00 O ATOM 2668 CB ALA A 169 -9.335 -12.062 13.879 1.00 0.00 C ATOM 0 H ALA A 169 -9.772 -10.378 15.638 1.00 0.00 H new ATOM 0 HA ALA A 169 -9.648 -13.188 15.685 1.00 0.00 H new ATOM 0 HB1 ALA A 169 -9.056 -12.934 13.288 1.00 0.00 H new ATOM 0 HB2 ALA A 169 -10.397 -11.857 13.744 1.00 0.00 H new ATOM 0 HB3 ALA A 169 -8.755 -11.200 13.550 1.00 0.00 H new ATOM 2674 N ASP A 170 -7.204 -13.917 15.313 1.00 0.00 N ATOM 2675 CA ASP A 170 -5.812 -14.337 15.469 1.00 0.00 C ATOM 2676 C ASP A 170 -5.044 -14.113 14.172 1.00 0.00 C ATOM 2677 O ASP A 170 -3.822 -14.250 14.129 1.00 0.00 O ATOM 2678 CB ASP A 170 -5.752 -15.817 15.851 1.00 0.00 C ATOM 2679 CG ASP A 170 -4.329 -16.194 16.251 1.00 0.00 C ATOM 2680 OD1 ASP A 170 -3.521 -15.295 16.411 1.00 0.00 O ATOM 2681 OD2 ASP A 170 -4.069 -17.378 16.394 1.00 0.00 O ATOM 0 H ASP A 170 -7.841 -14.655 15.013 1.00 0.00 H new ATOM 0 HA ASP A 170 -5.356 -13.741 16.260 1.00 0.00 H new ATOM 0 HB2 ASP A 170 -6.436 -16.016 16.676 1.00 0.00 H new ATOM 0 HB3 ASP A 170 -6.078 -16.431 15.012 1.00 0.00 H new ATOM 2686 N HIS A 171 -5.774 -13.767 13.117 1.00 0.00 N ATOM 2687 CA HIS A 171 -5.161 -13.523 11.814 1.00 0.00 C ATOM 2688 C HIS A 171 -6.015 -12.557 11.002 1.00 0.00 C ATOM 2689 O HIS A 171 -6.934 -11.932 11.530 1.00 0.00 O ATOM 2690 CB HIS A 171 -5.012 -14.840 11.053 1.00 0.00 C ATOM 2691 CG HIS A 171 -4.478 -15.897 11.979 1.00 0.00 C ATOM 2692 ND1 HIS A 171 -3.167 -15.893 12.428 1.00 0.00 N ATOM 2693 CD2 HIS A 171 -5.067 -16.996 12.551 1.00 0.00 C ATOM 2694 CE1 HIS A 171 -3.011 -16.962 13.233 1.00 0.00 C ATOM 2695 NE2 HIS A 171 -4.140 -17.667 13.342 1.00 0.00 N ATOM 0 H HIS A 171 -6.787 -13.649 13.137 1.00 0.00 H new ATOM 0 HA HIS A 171 -4.176 -13.082 11.969 1.00 0.00 H new ATOM 0 HB2 HIS A 171 -5.976 -15.149 10.648 1.00 0.00 H new ATOM 0 HB3 HIS A 171 -4.338 -14.709 10.207 1.00 0.00 H new ATOM 0 HD2 HIS A 171 -6.095 -17.295 12.409 1.00 0.00 H new ATOM 0 HE1 HIS A 171 -2.086 -17.217 13.729 1.00 0.00 H new ATOM 0 HE2 HIS A 171 -4.290 -18.515 13.888 1.00 0.00 H new ATOM 2704 N CYS A 172 -5.706 -12.438 9.712 1.00 0.00 N ATOM 2705 CA CYS A 172 -6.456 -11.542 8.831 1.00 0.00 C ATOM 2706 C CYS A 172 -6.699 -12.202 7.479 1.00 0.00 C ATOM 2707 O CYS A 172 -5.964 -13.105 7.080 1.00 0.00 O ATOM 2708 CB CYS A 172 -5.683 -10.237 8.632 1.00 0.00 C ATOM 2709 SG CYS A 172 -5.187 -9.580 10.244 1.00 0.00 S ATOM 0 H CYS A 172 -4.948 -12.946 9.256 1.00 0.00 H new ATOM 0 HA CYS A 172 -7.418 -11.327 9.296 1.00 0.00 H new ATOM 0 HB2 CYS A 172 -4.804 -10.413 8.013 1.00 0.00 H new ATOM 0 HB3 CYS A 172 -6.303 -9.511 8.106 1.00 0.00 H new ATOM 0 HG CYS A 172 -4.528 -8.472 10.077 1.00 0.00 H new ATOM 2715 N MET A 173 -7.740 -11.746 6.774 1.00 0.00 N ATOM 2716 CA MET A 173 -8.072 -12.309 5.460 1.00 0.00 C ATOM 2717 C MET A 173 -8.356 -11.197 4.451 1.00 0.00 C ATOM 2718 O MET A 173 -9.351 -10.481 4.569 1.00 0.00 O ATOM 2719 CB MET A 173 -9.301 -13.213 5.578 1.00 0.00 C ATOM 2720 CG MET A 173 -9.685 -13.733 4.196 1.00 0.00 C ATOM 2721 SD MET A 173 -10.858 -15.101 4.369 1.00 0.00 S ATOM 2722 CE MET A 173 -9.640 -16.425 4.566 1.00 0.00 C ATOM 0 H MET A 173 -8.360 -10.999 7.086 1.00 0.00 H new ATOM 0 HA MET A 173 -7.219 -12.891 5.111 1.00 0.00 H new ATOM 0 HB2 MET A 173 -9.089 -14.048 6.246 1.00 0.00 H new ATOM 0 HB3 MET A 173 -10.133 -12.659 6.014 1.00 0.00 H new ATOM 0 HG2 MET A 173 -10.129 -12.932 3.605 1.00 0.00 H new ATOM 0 HG3 MET A 173 -8.796 -14.068 3.662 1.00 0.00 H new ATOM 0 HE1 MET A 173 -10.066 -17.224 5.173 1.00 0.00 H new ATOM 0 HE2 MET A 173 -9.369 -16.819 3.586 1.00 0.00 H new ATOM 0 HE3 MET A 173 -8.750 -16.031 5.057 1.00 0.00 H new ATOM 2732 N LEU A 174 -7.479 -11.065 3.454 1.00 0.00 N ATOM 2733 CA LEU A 174 -7.646 -10.040 2.413 1.00 0.00 C ATOM 2734 C LEU A 174 -7.822 -10.704 1.049 1.00 0.00 C ATOM 2735 O LEU A 174 -6.894 -11.299 0.519 1.00 0.00 O ATOM 2736 CB LEU A 174 -6.407 -9.109 2.385 1.00 0.00 C ATOM 2737 CG LEU A 174 -6.664 -7.860 3.241 1.00 0.00 C ATOM 2738 CD1 LEU A 174 -6.812 -8.263 4.712 1.00 0.00 C ATOM 2739 CD2 LEU A 174 -5.484 -6.892 3.093 1.00 0.00 C ATOM 0 H LEU A 174 -6.650 -11.649 3.342 1.00 0.00 H new ATOM 0 HA LEU A 174 -8.533 -9.449 2.639 1.00 0.00 H new ATOM 0 HB2 LEU A 174 -5.533 -9.642 2.760 1.00 0.00 H new ATOM 0 HB3 LEU A 174 -6.186 -8.816 1.359 1.00 0.00 H new ATOM 0 HG LEU A 174 -7.581 -7.374 2.907 1.00 0.00 H new ATOM 0 HD11 LEU A 174 -6.994 -7.374 5.316 1.00 0.00 H new ATOM 0 HD12 LEU A 174 -7.650 -8.952 4.818 1.00 0.00 H new ATOM 0 HD13 LEU A 174 -5.897 -8.750 5.050 1.00 0.00 H new ATOM 0 HD21 LEU A 174 -5.663 -6.004 3.699 1.00 0.00 H new ATOM 0 HD22 LEU A 174 -4.569 -7.381 3.427 1.00 0.00 H new ATOM 0 HD23 LEU A 174 -5.380 -6.602 2.047 1.00 0.00 H new ATOM 2751 N ILE A 175 -9.017 -10.588 0.488 1.00 0.00 N ATOM 2752 CA ILE A 175 -9.307 -11.182 -0.825 1.00 0.00 C ATOM 2753 C ILE A 175 -9.218 -10.117 -1.908 1.00 0.00 C ATOM 2754 O ILE A 175 -9.966 -9.145 -1.889 1.00 0.00 O ATOM 2755 CB ILE A 175 -10.711 -11.790 -0.818 1.00 0.00 C ATOM 2756 CG1 ILE A 175 -10.925 -12.592 0.474 1.00 0.00 C ATOM 2757 CG2 ILE A 175 -10.880 -12.710 -2.027 1.00 0.00 C ATOM 2758 CD1 ILE A 175 -9.790 -13.604 0.659 1.00 0.00 C ATOM 0 H ILE A 175 -9.802 -10.093 0.912 1.00 0.00 H new ATOM 0 HA ILE A 175 -8.575 -11.963 -1.031 1.00 0.00 H new ATOM 0 HB ILE A 175 -11.448 -10.988 -0.869 1.00 0.00 H new ATOM 0 HG12 ILE A 175 -10.963 -11.916 1.329 1.00 0.00 H new ATOM 0 HG13 ILE A 175 -11.883 -13.111 0.435 1.00 0.00 H new ATOM 0 HG21 ILE A 175 -11.881 -13.141 -2.019 1.00 0.00 H new ATOM 0 HG22 ILE A 175 -10.739 -12.136 -2.943 1.00 0.00 H new ATOM 0 HG23 ILE A 175 -10.140 -13.509 -1.982 1.00 0.00 H new ATOM 0 HD11 ILE A 175 -9.951 -14.168 1.578 1.00 0.00 H new ATOM 0 HD12 ILE A 175 -9.772 -14.289 -0.188 1.00 0.00 H new ATOM 0 HD13 ILE A 175 -8.838 -13.076 0.719 1.00 0.00 H new ATOM 2770 N ILE A 176 -8.294 -10.302 -2.854 1.00 0.00 N ATOM 2771 CA ILE A 176 -8.116 -9.335 -3.935 1.00 0.00 C ATOM 2772 C ILE A 176 -8.801 -9.811 -5.208 1.00 0.00 C ATOM 2773 O ILE A 176 -8.298 -10.693 -5.904 1.00 0.00 O ATOM 2774 CB ILE A 176 -6.617 -9.120 -4.210 1.00 0.00 C ATOM 2775 CG1 ILE A 176 -5.863 -8.841 -2.870 1.00 0.00 C ATOM 2776 CG2 ILE A 176 -6.443 -7.925 -5.164 1.00 0.00 C ATOM 2777 CD1 ILE A 176 -5.087 -10.090 -2.440 1.00 0.00 C ATOM 0 H ILE A 176 -7.665 -11.104 -2.892 1.00 0.00 H new ATOM 0 HA ILE A 176 -8.569 -8.394 -3.625 1.00 0.00 H new ATOM 0 HB ILE A 176 -6.201 -10.017 -4.668 1.00 0.00 H new ATOM 0 HG12 ILE A 176 -5.179 -8.002 -2.995 1.00 0.00 H new ATOM 0 HG13 ILE A 176 -6.574 -8.559 -2.094 1.00 0.00 H new ATOM 0 HG21 ILE A 176 -5.383 -7.769 -5.362 1.00 0.00 H new ATOM 0 HG22 ILE A 176 -6.961 -8.129 -6.101 1.00 0.00 H new ATOM 0 HG23 ILE A 176 -6.862 -7.029 -4.706 1.00 0.00 H new ATOM 0 HD11 ILE A 176 -4.563 -9.889 -1.505 1.00 0.00 H new ATOM 0 HD12 ILE A 176 -5.781 -10.918 -2.297 1.00 0.00 H new ATOM 0 HD13 ILE A 176 -4.364 -10.353 -3.212 1.00 0.00 H new ATOM 2789 N GLU A 177 -9.947 -9.212 -5.513 1.00 0.00 N ATOM 2790 CA GLU A 177 -10.691 -9.570 -6.714 1.00 0.00 C ATOM 2791 C GLU A 177 -10.168 -8.770 -7.901 1.00 0.00 C ATOM 2792 O GLU A 177 -10.036 -7.549 -7.826 1.00 0.00 O ATOM 2793 CB GLU A 177 -12.185 -9.282 -6.510 1.00 0.00 C ATOM 2794 CG GLU A 177 -12.976 -9.718 -7.754 1.00 0.00 C ATOM 2795 CD GLU A 177 -12.861 -8.664 -8.858 1.00 0.00 C ATOM 2796 OE1 GLU A 177 -12.403 -7.572 -8.566 1.00 0.00 O ATOM 2797 OE2 GLU A 177 -13.235 -8.969 -9.979 1.00 0.00 O ATOM 0 H GLU A 177 -10.379 -8.480 -4.948 1.00 0.00 H new ATOM 0 HA GLU A 177 -10.558 -10.634 -6.912 1.00 0.00 H new ATOM 0 HB2 GLU A 177 -12.550 -9.814 -5.631 1.00 0.00 H new ATOM 0 HB3 GLU A 177 -12.338 -8.219 -6.325 1.00 0.00 H new ATOM 0 HG2 GLU A 177 -12.599 -10.675 -8.115 1.00 0.00 H new ATOM 0 HG3 GLU A 177 -14.024 -9.867 -7.493 1.00 0.00 H new ATOM 2804 N LEU A 178 -9.863 -9.464 -8.993 1.00 0.00 N ATOM 2805 CA LEU A 178 -9.343 -8.803 -10.192 1.00 0.00 C ATOM 2806 C LEU A 178 -10.479 -8.473 -11.152 1.00 0.00 C ATOM 2807 O LEU A 178 -11.305 -9.330 -11.466 1.00 0.00 O ATOM 2808 CB LEU A 178 -8.338 -9.716 -10.901 1.00 0.00 C ATOM 2809 CG LEU A 178 -7.286 -10.227 -9.900 1.00 0.00 C ATOM 2810 CD1 LEU A 178 -6.577 -11.449 -10.486 1.00 0.00 C ATOM 2811 CD2 LEU A 178 -6.254 -9.127 -9.622 1.00 0.00 C ATOM 0 H LEU A 178 -9.965 -10.476 -9.076 1.00 0.00 H new ATOM 0 HA LEU A 178 -8.849 -7.880 -9.887 1.00 0.00 H new ATOM 0 HB2 LEU A 178 -8.859 -10.559 -11.355 1.00 0.00 H new ATOM 0 HB3 LEU A 178 -7.848 -9.172 -11.709 1.00 0.00 H new ATOM 0 HG LEU A 178 -7.781 -10.501 -8.968 1.00 0.00 H new ATOM 0 HD11 LEU A 178 -5.832 -11.812 -9.778 1.00 0.00 H new ATOM 0 HD12 LEU A 178 -7.307 -12.235 -10.679 1.00 0.00 H new ATOM 0 HD13 LEU A 178 -6.086 -11.172 -11.419 1.00 0.00 H new ATOM 0 HD21 LEU A 178 -5.512 -9.495 -8.913 1.00 0.00 H new ATOM 0 HD22 LEU A 178 -5.760 -8.848 -10.553 1.00 0.00 H new ATOM 0 HD23 LEU A 178 -6.756 -8.255 -9.203 1.00 0.00 H new ATOM 2823 N GLN A 179 -10.520 -7.228 -11.621 1.00 0.00 N ATOM 2824 CA GLN A 179 -11.565 -6.810 -12.548 1.00 0.00 C ATOM 2825 C GLN A 179 -11.239 -7.277 -13.964 1.00 0.00 C ATOM 2826 O GLN A 179 -10.107 -7.143 -14.425 1.00 0.00 O ATOM 2827 CB GLN A 179 -11.703 -5.287 -12.530 1.00 0.00 C ATOM 2828 CG GLN A 179 -12.314 -4.846 -11.199 1.00 0.00 C ATOM 2829 CD GLN A 179 -12.520 -3.336 -11.194 1.00 0.00 C ATOM 2830 OE1 GLN A 179 -11.643 -2.590 -10.756 1.00 0.00 O ATOM 2831 NE2 GLN A 179 -13.634 -2.837 -11.657 1.00 0.00 N ATOM 0 H GLN A 179 -9.849 -6.499 -11.377 1.00 0.00 H new ATOM 0 HA GLN A 179 -12.506 -7.262 -12.234 1.00 0.00 H new ATOM 0 HB2 GLN A 179 -10.727 -4.821 -12.666 1.00 0.00 H new ATOM 0 HB3 GLN A 179 -12.332 -4.958 -13.358 1.00 0.00 H new ATOM 0 HG2 GLN A 179 -13.267 -5.352 -11.042 1.00 0.00 H new ATOM 0 HG3 GLN A 179 -11.660 -5.135 -10.376 1.00 0.00 H new ATOM 0 HE21 GLN A 179 -14.359 -3.457 -12.019 1.00 0.00 H new ATOM 0 HE22 GLN A 179 -13.780 -1.827 -11.657 1.00 0.00 H new