USER MOD reduce.3.24.130724 H: found=0, std=0, add=1076, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 1069 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 74 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 88 GLN : amide:sc= -0.229 X(o=-0.23,f=-0.23) USER MOD Set 2.1: A 45 ASN : amide:sc= -0.97 K(o=-0.97,f=-9.1!) USER MOD Set 2.2: A 48 THR OG1 : rot -110:sc= 0 USER MOD Set 3.1: A 23 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 3.2: A 53 MET CE :methyl -156:sc= -0.102 (180deg=-0.823) USER MOD Single : A 1 SER N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 5 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 ASN : amide:sc= -0.302 X(o=-0.3,f=-0.36) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 11 ASN : amide:sc= 0.0853 K(o=0.085,f=-2.8!) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ -130:sc= 1.14 (180deg=-0.567) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 THR OG1 : rot -64:sc= 0.32 USER MOD Single : A 30 ASN : amide:sc= -0.19 K(o=-0.19,f=-3.9!) USER MOD Single : A 34 TYR OH : rot 180:sc= -0.0399 USER MOD Single : A 35 ASN : amide:sc= 0.355 K(o=0.36,f=-0.88) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 SER OG : rot -77:sc= 0.0844 USER MOD Single : A 57 THR OG1 : rot -26:sc= 0.153 USER MOD Single : A 58 LYS NZ :NH3+ -167:sc= 1.16 (180deg=0.845) USER MOD Single : A 60 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 61 MET CE :methyl -169:sc= -0.298 (180deg=-0.548) USER MOD Single : A 67 ASN : amide:sc=-0.00846 K(o=-0.0085,f=-1.2) USER MOD Single : A 69 HIS : no HD1:sc= -0.0277 X(o=-0.028,f=0) USER MOD Single : A 70 HIS : no HD1:sc= -0.155 X(o=-0.15,f=0.00057) USER MOD Single : A 72 ASN : amide:sc= -0.0582 K(o=-0.058,f=-1.3) USER MOD Single : A 78 LYS NZ :NH3+ -114:sc= -0.263 (180deg=-1.52!) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 HIS : no HD1:sc= 0.376 K(o=0.38,f=-5!) USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 89 GLN : amide:sc= -0.0213 K(o=-0.021,f=-1) USER MOD Single : A 95 HIS : no HD1:sc= -0.0591 X(o=-0.059,f=0) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 SER OG : rot 160:sc= 0.183 USER MOD Single : A 101 THR OG1 : rot 111:sc= 1.26 USER MOD Single : A 104 ASN : amide:sc= -2.82! K(o=-2.8!,f=0.14) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 THR OG1 : rot 84:sc= 1.24 USER MOD Single : A 116 THR OG1 : rot 84:sc= 0.016 USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 HIS : no HD1:sc= -0.123 X(o=-0.12,f=-0.017) USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 ASN : amide:sc= -0.568 X(o=-0.57,f=-0.58) USER MOD Single : A 130 SER OG : rot 180:sc= 0.0269 USER MOD Single : A 131 MET CE :methyl -166:sc= 0 (180deg=-0.426) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 11.036 19.146 19.914 1.00 0.00 N ATOM 2 CA SER A 1 9.672 18.997 19.384 1.00 0.00 C ATOM 3 C SER A 1 8.819 18.272 20.405 1.00 0.00 C ATOM 4 O SER A 1 9.089 17.100 20.694 1.00 0.00 O ATOM 5 CB SER A 1 9.620 18.213 18.067 1.00 0.00 C ATOM 6 OG SER A 1 10.250 18.877 16.988 1.00 0.00 O ATOM 0 H1 SER A 1 11.627 19.643 19.217 1.00 0.00 H new ATOM 0 H2 SER A 1 11.007 19.694 20.798 1.00 0.00 H new ATOM 0 H3 SER A 1 11.440 18.206 20.102 1.00 0.00 H new ATOM 0 HA SER A 1 9.298 20.002 19.186 1.00 0.00 H new ATOM 0 HB2 SER A 1 10.094 17.243 18.212 1.00 0.00 H new ATOM 0 HB3 SER A 1 8.578 18.023 17.808 1.00 0.00 H new ATOM 0 HG SER A 1 10.184 18.325 16.181 1.00 0.00 H new ATOM 12 N GLN A 2 7.794 18.926 20.951 1.00 0.00 N ATOM 13 CA GLN A 2 6.782 18.194 21.697 1.00 0.00 C ATOM 14 C GLN A 2 5.838 17.498 20.717 1.00 0.00 C ATOM 15 O GLN A 2 5.906 17.757 19.516 1.00 0.00 O ATOM 16 CB GLN A 2 6.084 19.100 22.719 1.00 0.00 C ATOM 17 CG GLN A 2 5.192 20.200 22.130 1.00 0.00 C ATOM 18 CD GLN A 2 4.756 21.167 23.229 1.00 0.00 C ATOM 19 OE1 GLN A 2 4.138 20.766 24.214 1.00 0.00 O ATOM 20 NE2 GLN A 2 5.090 22.442 23.106 1.00 0.00 N ATOM 0 H GLN A 2 7.647 19.934 20.892 1.00 0.00 H new ATOM 0 HA GLN A 2 7.245 17.410 22.296 1.00 0.00 H new ATOM 0 HB2 GLN A 2 5.476 18.477 23.375 1.00 0.00 H new ATOM 0 HB3 GLN A 2 6.846 19.569 23.341 1.00 0.00 H new ATOM 0 HG2 GLN A 2 5.733 20.740 21.353 1.00 0.00 H new ATOM 0 HG3 GLN A 2 4.316 19.755 21.658 1.00 0.00 H new ATOM 0 HE21 GLN A 2 5.603 22.758 22.283 1.00 0.00 H new ATOM 0 HE22 GLN A 2 4.835 23.109 23.835 1.00 0.00 H new ATOM 29 N GLU A 3 4.981 16.622 21.243 1.00 0.00 N ATOM 30 CA GLU A 3 3.915 15.922 20.543 1.00 0.00 C ATOM 31 C GLU A 3 4.358 15.317 19.205 1.00 0.00 C ATOM 32 O GLU A 3 3.920 15.710 18.123 1.00 0.00 O ATOM 33 CB GLU A 3 2.672 16.805 20.485 1.00 0.00 C ATOM 34 CG GLU A 3 2.046 16.954 21.882 1.00 0.00 C ATOM 35 CD GLU A 3 0.585 17.382 21.797 1.00 0.00 C ATOM 36 OE1 GLU A 3 -0.228 16.581 21.277 1.00 0.00 O ATOM 37 OE2 GLU A 3 0.232 18.478 22.271 1.00 0.00 O ATOM 0 H GLU A 3 5.019 16.370 22.231 1.00 0.00 H new ATOM 0 HA GLU A 3 3.639 15.036 21.115 1.00 0.00 H new ATOM 0 HB2 GLU A 3 2.935 17.787 20.092 1.00 0.00 H new ATOM 0 HB3 GLU A 3 1.944 16.372 19.799 1.00 0.00 H new ATOM 0 HG2 GLU A 3 2.118 16.007 22.417 1.00 0.00 H new ATOM 0 HG3 GLU A 3 2.609 17.689 22.457 1.00 0.00 H new ATOM 44 N VAL A 4 5.192 14.282 19.303 1.00 0.00 N ATOM 45 CA VAL A 4 5.746 13.526 18.186 1.00 0.00 C ATOM 46 C VAL A 4 5.331 12.070 18.403 1.00 0.00 C ATOM 47 O VAL A 4 6.130 11.238 18.833 1.00 0.00 O ATOM 48 CB VAL A 4 7.276 13.749 18.091 1.00 0.00 C ATOM 49 CG1 VAL A 4 7.917 13.010 16.905 1.00 0.00 C ATOM 50 CG2 VAL A 4 7.623 15.240 17.959 1.00 0.00 C ATOM 0 H VAL A 4 5.513 13.934 20.206 1.00 0.00 H new ATOM 0 HA VAL A 4 5.362 13.856 17.221 1.00 0.00 H new ATOM 0 HB VAL A 4 7.679 13.345 19.020 1.00 0.00 H new ATOM 0 HG11 VAL A 4 8.989 13.205 16.891 1.00 0.00 H new ATOM 0 HG12 VAL A 4 7.744 11.939 17.007 1.00 0.00 H new ATOM 0 HG13 VAL A 4 7.473 13.362 15.974 1.00 0.00 H new ATOM 0 HG21 VAL A 4 8.705 15.358 17.895 1.00 0.00 H new ATOM 0 HG22 VAL A 4 7.160 15.643 17.058 1.00 0.00 H new ATOM 0 HG23 VAL A 4 7.251 15.779 18.830 1.00 0.00 H new ATOM 60 N MET A 5 4.048 11.776 18.193 1.00 0.00 N ATOM 61 CA MET A 5 3.477 10.441 18.352 1.00 0.00 C ATOM 62 C MET A 5 2.508 10.039 17.241 1.00 0.00 C ATOM 63 O MET A 5 1.696 9.119 17.419 1.00 0.00 O ATOM 64 CB MET A 5 2.845 10.340 19.746 1.00 0.00 C ATOM 65 CG MET A 5 1.520 11.105 19.883 1.00 0.00 C ATOM 66 SD MET A 5 0.738 10.935 21.500 1.00 0.00 S ATOM 67 CE MET A 5 -1.008 11.144 21.050 1.00 0.00 C ATOM 0 H MET A 5 3.364 12.474 17.902 1.00 0.00 H new ATOM 0 HA MET A 5 4.287 9.718 18.262 1.00 0.00 H new ATOM 0 HB2 MET A 5 2.673 9.290 19.982 1.00 0.00 H new ATOM 0 HB3 MET A 5 3.552 10.721 20.483 1.00 0.00 H new ATOM 0 HG2 MET A 5 1.701 12.162 19.688 1.00 0.00 H new ATOM 0 HG3 MET A 5 0.828 10.753 19.118 1.00 0.00 H new ATOM 0 HE1 MET A 5 -1.626 11.065 21.944 1.00 0.00 H new ATOM 0 HE2 MET A 5 -1.152 12.124 20.595 1.00 0.00 H new ATOM 0 HE3 MET A 5 -1.296 10.368 20.340 1.00 0.00 H new ATOM 77 N LYS A 6 2.537 10.736 16.105 1.00 0.00 N ATOM 78 CA LYS A 6 1.682 10.375 14.991 1.00 0.00 C ATOM 79 C LYS A 6 2.059 8.988 14.512 1.00 0.00 C ATOM 80 O LYS A 6 3.229 8.597 14.497 1.00 0.00 O ATOM 81 CB LYS A 6 1.826 11.356 13.834 1.00 0.00 C ATOM 82 CG LYS A 6 1.440 12.793 14.205 1.00 0.00 C ATOM 83 CD LYS A 6 -0.086 12.938 14.160 1.00 0.00 C ATOM 84 CE LYS A 6 -0.574 14.340 14.515 1.00 0.00 C ATOM 85 NZ LYS A 6 -2.053 14.399 14.501 1.00 0.00 N ATOM 0 H LYS A 6 3.138 11.543 15.939 1.00 0.00 H new ATOM 0 HA LYS A 6 0.647 10.400 15.332 1.00 0.00 H new ATOM 0 HB2 LYS A 6 2.858 11.344 13.483 1.00 0.00 H new ATOM 0 HB3 LYS A 6 1.203 11.022 13.004 1.00 0.00 H new ATOM 0 HG2 LYS A 6 1.810 13.035 15.201 1.00 0.00 H new ATOM 0 HG3 LYS A 6 1.904 13.496 13.513 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -0.438 12.681 13.161 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -0.532 12.221 14.849 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -0.203 14.621 15.501 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -0.170 15.062 13.805 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -2.364 15.361 14.745 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -2.401 14.152 13.553 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -2.434 13.725 15.196 1.00 0.00 H new ATOM 99 N ASN A 7 1.038 8.305 14.037 1.00 0.00 N ATOM 100 CA ASN A 7 1.127 7.060 13.301 1.00 0.00 C ATOM 101 C ASN A 7 0.714 7.381 11.884 1.00 0.00 C ATOM 102 O ASN A 7 -0.207 8.179 11.707 1.00 0.00 O ATOM 103 CB ASN A 7 0.158 6.020 13.869 1.00 0.00 C ATOM 104 CG ASN A 7 -0.104 4.906 12.864 1.00 0.00 C ATOM 105 OD1 ASN A 7 0.805 4.166 12.512 1.00 0.00 O ATOM 106 ND2 ASN A 7 -1.309 4.802 12.320 1.00 0.00 N ATOM 0 H ASN A 7 0.075 8.619 14.160 1.00 0.00 H new ATOM 0 HA ASN A 7 2.136 6.651 13.363 1.00 0.00 H new ATOM 0 HB2 ASN A 7 0.570 5.597 14.785 1.00 0.00 H new ATOM 0 HB3 ASN A 7 -0.783 6.502 14.135 1.00 0.00 H new ATOM 0 HD21 ASN A 7 -1.485 4.100 11.601 1.00 0.00 H new ATOM 0 HD22 ASN A 7 -2.060 5.424 12.621 1.00 0.00 H new ATOM 113 N LEU A 8 1.313 6.659 10.938 1.00 0.00 N ATOM 114 CA LEU A 8 1.070 6.676 9.509 1.00 0.00 C ATOM 115 C LEU A 8 1.215 8.086 8.930 1.00 0.00 C ATOM 116 O LEU A 8 0.528 9.037 9.306 1.00 0.00 O ATOM 117 CB LEU A 8 -0.238 5.915 9.223 1.00 0.00 C ATOM 118 CG LEU A 8 -0.709 5.856 7.767 1.00 0.00 C ATOM 119 CD1 LEU A 8 -1.446 7.133 7.391 1.00 0.00 C ATOM 120 CD2 LEU A 8 0.395 5.534 6.753 1.00 0.00 C ATOM 0 H LEU A 8 2.044 5.991 11.181 1.00 0.00 H new ATOM 0 HA LEU A 8 1.838 6.133 8.957 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -0.119 4.892 9.581 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -1.031 6.371 9.816 1.00 0.00 H new ATOM 0 HG LEU A 8 -1.396 5.011 7.714 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -1.773 7.072 6.353 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -2.314 7.256 8.038 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -0.779 7.987 7.512 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -0.028 5.513 5.749 1.00 0.00 H new ATOM 0 HD22 LEU A 8 1.170 6.299 6.804 1.00 0.00 H new ATOM 0 HD23 LEU A 8 0.829 4.561 6.984 1.00 0.00 H new ATOM 132 N SER A 9 2.196 8.247 8.054 1.00 0.00 N ATOM 133 CA SER A 9 2.569 9.525 7.484 1.00 0.00 C ATOM 134 C SER A 9 1.994 9.713 6.079 1.00 0.00 C ATOM 135 O SER A 9 1.705 10.856 5.730 1.00 0.00 O ATOM 136 CB SER A 9 4.091 9.684 7.584 1.00 0.00 C ATOM 137 OG SER A 9 4.481 9.662 8.960 1.00 0.00 O ATOM 0 H SER A 9 2.766 7.472 7.715 1.00 0.00 H new ATOM 0 HA SER A 9 2.123 10.340 8.055 1.00 0.00 H new ATOM 0 HB2 SER A 9 4.588 8.880 7.041 1.00 0.00 H new ATOM 0 HB3 SER A 9 4.401 10.621 7.122 1.00 0.00 H new ATOM 0 HG SER A 9 5.454 9.762 9.026 1.00 0.00 H new ATOM 143 N LEU A 10 1.745 8.670 5.279 1.00 0.00 N ATOM 144 CA LEU A 10 1.054 8.823 3.990 1.00 0.00 C ATOM 145 C LEU A 10 -0.415 9.234 4.173 1.00 0.00 C ATOM 146 O LEU A 10 -1.040 8.788 5.123 1.00 0.00 O ATOM 147 CB LEU A 10 1.164 7.544 3.138 1.00 0.00 C ATOM 148 CG LEU A 10 2.508 7.239 2.435 1.00 0.00 C ATOM 149 CD1 LEU A 10 2.362 6.052 1.471 1.00 0.00 C ATOM 150 CD2 LEU A 10 3.042 8.447 1.659 1.00 0.00 C ATOM 0 H LEU A 10 2.011 7.710 5.500 1.00 0.00 H new ATOM 0 HA LEU A 10 1.556 9.629 3.455 1.00 0.00 H new ATOM 0 HB2 LEU A 10 0.926 6.696 3.780 1.00 0.00 H new ATOM 0 HB3 LEU A 10 0.391 7.589 2.371 1.00 0.00 H new ATOM 0 HG LEU A 10 3.220 6.992 3.222 1.00 0.00 H new ATOM 0 HD11 LEU A 10 3.319 5.856 0.988 1.00 0.00 H new ATOM 0 HD12 LEU A 10 2.048 5.168 2.027 1.00 0.00 H new ATOM 0 HD13 LEU A 10 1.615 6.288 0.713 1.00 0.00 H new ATOM 0 HD21 LEU A 10 3.987 8.185 1.183 1.00 0.00 H new ATOM 0 HD22 LEU A 10 2.320 8.738 0.896 1.00 0.00 H new ATOM 0 HD23 LEU A 10 3.200 9.279 2.345 1.00 0.00 H new ATOM 162 N ASN A 11 -1.040 10.035 3.295 1.00 0.00 N ATOM 163 CA ASN A 11 -2.458 10.412 3.500 1.00 0.00 C ATOM 164 C ASN A 11 -3.426 9.314 3.019 1.00 0.00 C ATOM 165 O ASN A 11 -4.286 9.539 2.162 1.00 0.00 O ATOM 166 CB ASN A 11 -2.849 11.797 2.955 1.00 0.00 C ATOM 167 CG ASN A 11 -4.048 12.371 3.721 1.00 0.00 C ATOM 168 OD1 ASN A 11 -4.847 11.656 4.331 1.00 0.00 O ATOM 169 ND2 ASN A 11 -4.186 13.686 3.754 1.00 0.00 N ATOM 0 H ASN A 11 -0.607 10.427 2.459 1.00 0.00 H new ATOM 0 HA ASN A 11 -2.559 10.502 4.582 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -2.001 12.477 3.038 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -3.093 11.719 1.896 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -4.951 14.105 4.283 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -3.527 14.281 3.251 1.00 0.00 H new ATOM 176 N PHE A 12 -3.277 8.097 3.552 1.00 0.00 N ATOM 177 CA PHE A 12 -4.159 6.975 3.286 1.00 0.00 C ATOM 178 C PHE A 12 -5.598 7.312 3.642 1.00 0.00 C ATOM 179 O PHE A 12 -6.484 6.945 2.878 1.00 0.00 O ATOM 180 CB PHE A 12 -3.716 5.739 4.067 1.00 0.00 C ATOM 181 CG PHE A 12 -2.598 4.960 3.424 1.00 0.00 C ATOM 182 CD1 PHE A 12 -2.880 4.012 2.428 1.00 0.00 C ATOM 183 CD2 PHE A 12 -1.277 5.165 3.842 1.00 0.00 C ATOM 184 CE1 PHE A 12 -1.829 3.294 1.832 1.00 0.00 C ATOM 185 CE2 PHE A 12 -0.230 4.432 3.257 1.00 0.00 C ATOM 186 CZ PHE A 12 -0.501 3.525 2.224 1.00 0.00 C ATOM 0 H PHE A 12 -2.519 7.868 4.195 1.00 0.00 H new ATOM 0 HA PHE A 12 -4.103 6.762 2.219 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -3.400 6.049 5.063 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -4.574 5.079 4.196 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -3.900 3.835 2.121 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -1.062 5.888 4.615 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -2.044 2.561 1.069 1.00 0.00 H new ATOM 0 HE2 PHE A 12 0.784 4.568 3.604 1.00 0.00 H new ATOM 0 HZ PHE A 12 0.308 3.006 1.732 1.00 0.00 H new ATOM 196 N GLY A 13 -5.841 8.013 4.752 1.00 0.00 N ATOM 197 CA GLY A 13 -7.188 8.312 5.217 1.00 0.00 C ATOM 198 C GLY A 13 -8.021 8.963 4.119 1.00 0.00 C ATOM 199 O GLY A 13 -9.077 8.463 3.732 1.00 0.00 O ATOM 0 H GLY A 13 -5.105 8.388 5.351 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -7.673 7.394 5.548 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -7.138 8.975 6.080 1.00 0.00 H new ATOM 203 N LYS A 14 -7.531 10.069 3.559 1.00 0.00 N ATOM 204 CA LYS A 14 -8.254 10.797 2.520 1.00 0.00 C ATOM 205 C LYS A 14 -8.375 10.003 1.226 1.00 0.00 C ATOM 206 O LYS A 14 -9.432 9.978 0.604 1.00 0.00 O ATOM 207 CB LYS A 14 -7.556 12.129 2.267 1.00 0.00 C ATOM 208 CG LYS A 14 -7.968 13.196 3.295 1.00 0.00 C ATOM 209 CD LYS A 14 -9.438 13.634 3.147 1.00 0.00 C ATOM 210 CE LYS A 14 -9.568 14.991 2.458 1.00 0.00 C ATOM 211 NZ LYS A 14 -9.256 16.120 3.358 1.00 0.00 N ATOM 0 H LYS A 14 -6.632 10.481 3.810 1.00 0.00 H new ATOM 0 HA LYS A 14 -9.271 10.967 2.874 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -6.476 11.986 2.305 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -7.796 12.480 1.263 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -7.810 12.805 4.300 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -7.322 14.067 3.186 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -9.983 12.884 2.574 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -9.902 13.682 4.132 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -8.900 15.022 1.597 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -10.583 15.105 2.078 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -9.360 17.016 2.840 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -9.910 16.110 4.167 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -8.279 16.030 3.702 1.00 0.00 H new ATOM 225 N ALA A 15 -7.280 9.387 0.799 1.00 0.00 N ATOM 226 CA ALA A 15 -7.261 8.494 -0.355 1.00 0.00 C ATOM 227 C ALA A 15 -8.330 7.397 -0.232 1.00 0.00 C ATOM 228 O ALA A 15 -9.096 7.194 -1.169 1.00 0.00 O ATOM 229 CB ALA A 15 -5.863 7.888 -0.492 1.00 0.00 C ATOM 0 H ALA A 15 -6.370 9.494 1.248 1.00 0.00 H new ATOM 0 HA ALA A 15 -7.497 9.066 -1.252 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -5.839 7.219 -1.352 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -5.133 8.685 -0.632 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -5.619 7.327 0.411 1.00 0.00 H new ATOM 235 N LEU A 16 -8.413 6.700 0.906 1.00 0.00 N ATOM 236 CA LEU A 16 -9.425 5.681 1.213 1.00 0.00 C ATOM 237 C LEU A 16 -10.813 6.308 1.173 1.00 0.00 C ATOM 238 O LEU A 16 -11.745 5.732 0.611 1.00 0.00 O ATOM 239 CB LEU A 16 -9.196 5.080 2.612 1.00 0.00 C ATOM 240 CG LEU A 16 -8.016 4.099 2.703 1.00 0.00 C ATOM 241 CD1 LEU A 16 -7.726 3.760 4.160 1.00 0.00 C ATOM 242 CD2 LEU A 16 -8.275 2.759 2.015 1.00 0.00 C ATOM 0 H LEU A 16 -7.751 6.835 1.670 1.00 0.00 H new ATOM 0 HA LEU A 16 -9.344 4.890 0.468 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -9.031 5.893 3.319 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -10.104 4.565 2.925 1.00 0.00 H new ATOM 0 HG LEU A 16 -7.189 4.609 2.208 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -6.888 3.064 4.212 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -7.475 4.671 4.703 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -8.607 3.301 4.609 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -7.398 2.120 2.121 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -9.136 2.274 2.476 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -8.476 2.926 0.957 1.00 0.00 H new ATOM 254 N ASP A 17 -10.946 7.505 1.742 1.00 0.00 N ATOM 255 CA ASP A 17 -12.198 8.245 1.793 1.00 0.00 C ATOM 256 C ASP A 17 -12.707 8.632 0.401 1.00 0.00 C ATOM 257 O ASP A 17 -13.904 8.833 0.224 1.00 0.00 O ATOM 258 CB ASP A 17 -12.043 9.479 2.692 1.00 0.00 C ATOM 259 CG ASP A 17 -13.320 10.294 2.913 1.00 0.00 C ATOM 260 OD1 ASP A 17 -14.445 9.754 2.952 1.00 0.00 O ATOM 261 OD2 ASP A 17 -13.180 11.517 3.154 1.00 0.00 O ATOM 0 H ASP A 17 -10.170 7.994 2.188 1.00 0.00 H new ATOM 0 HA ASP A 17 -12.953 7.587 2.223 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -11.666 9.156 3.662 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -11.286 10.132 2.257 1.00 0.00 H new ATOM 266 N GLU A 18 -11.857 8.636 -0.628 1.00 0.00 N ATOM 267 CA GLU A 18 -12.298 8.759 -2.016 1.00 0.00 C ATOM 268 C GLU A 18 -12.355 7.407 -2.738 1.00 0.00 C ATOM 269 O GLU A 18 -13.173 7.201 -3.636 1.00 0.00 O ATOM 270 CB GLU A 18 -11.418 9.784 -2.734 1.00 0.00 C ATOM 271 CG GLU A 18 -11.766 11.183 -2.212 1.00 0.00 C ATOM 272 CD GLU A 18 -11.162 12.326 -3.018 1.00 0.00 C ATOM 273 OE1 GLU A 18 -9.965 12.641 -2.830 1.00 0.00 O ATOM 274 OE2 GLU A 18 -11.901 13.011 -3.759 1.00 0.00 O ATOM 0 H GLU A 18 -10.846 8.554 -0.521 1.00 0.00 H new ATOM 0 HA GLU A 18 -13.326 9.121 -2.028 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -10.364 9.566 -2.558 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -11.579 9.732 -3.811 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -12.850 11.295 -2.203 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -11.429 11.266 -1.179 1.00 0.00 H new ATOM 281 N CYS A 19 -11.546 6.442 -2.313 1.00 0.00 N ATOM 282 CA CYS A 19 -11.527 5.101 -2.879 1.00 0.00 C ATOM 283 C CYS A 19 -12.755 4.263 -2.627 1.00 0.00 C ATOM 284 O CYS A 19 -13.199 3.536 -3.519 1.00 0.00 O ATOM 285 CB CYS A 19 -10.287 4.328 -2.436 1.00 0.00 C ATOM 286 SG CYS A 19 -8.968 4.323 -3.661 1.00 0.00 S ATOM 0 H CYS A 19 -10.876 6.573 -1.555 1.00 0.00 H new ATOM 0 HA CYS A 19 -11.508 5.280 -3.954 1.00 0.00 H new ATOM 0 HB2 CYS A 19 -9.910 4.762 -1.510 1.00 0.00 H new ATOM 0 HB3 CYS A 19 -10.570 3.299 -2.214 1.00 0.00 H new ATOM 291 N LYS A 20 -13.349 4.370 -1.444 1.00 0.00 N ATOM 292 CA LYS A 20 -14.508 3.622 -1.140 1.00 0.00 C ATOM 293 C LYS A 20 -15.652 4.206 -1.970 1.00 0.00 C ATOM 294 O LYS A 20 -16.665 3.533 -2.141 1.00 0.00 O ATOM 295 CB LYS A 20 -14.626 3.680 0.397 1.00 0.00 C ATOM 296 CG LYS A 20 -15.650 4.678 0.903 1.00 0.00 C ATOM 297 CD LYS A 20 -15.387 6.181 0.815 1.00 0.00 C ATOM 298 CE LYS A 20 -15.214 6.823 2.204 1.00 0.00 C ATOM 299 NZ LYS A 20 -16.373 6.751 3.116 1.00 0.00 N ATOM 0 H LYS A 20 -13.025 4.978 -0.692 1.00 0.00 H new ATOM 0 HA LYS A 20 -14.504 2.565 -1.406 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -14.887 2.689 0.768 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -13.652 3.931 0.816 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -16.579 4.483 0.367 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -15.833 4.446 1.952 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -14.490 6.357 0.221 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -16.214 6.663 0.294 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -14.364 6.348 2.695 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -14.956 7.873 2.064 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -16.571 7.697 3.501 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -17.205 6.408 2.594 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -16.160 6.097 3.897 1.00 0.00 H new ATOM 313 N LYS A 21 -15.541 5.454 -2.457 1.00 0.00 N ATOM 314 CA LYS A 21 -16.623 6.066 -3.196 1.00 0.00 C ATOM 315 C LYS A 21 -16.773 5.365 -4.539 1.00 0.00 C ATOM 316 O LYS A 21 -17.894 5.034 -4.907 1.00 0.00 O ATOM 317 CB LYS A 21 -16.435 7.570 -3.387 1.00 0.00 C ATOM 318 CG LYS A 21 -16.317 8.292 -2.052 1.00 0.00 C ATOM 319 CD LYS A 21 -16.561 9.793 -2.182 1.00 0.00 C ATOM 320 CE LYS A 21 -16.273 10.409 -0.814 1.00 0.00 C ATOM 321 NZ LYS A 21 -16.911 11.727 -0.642 1.00 0.00 N ATOM 0 H LYS A 21 -14.715 6.042 -2.346 1.00 0.00 H new ATOM 0 HA LYS A 21 -17.535 5.947 -2.611 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -15.540 7.753 -3.981 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -17.278 7.975 -3.947 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -17.034 7.869 -1.348 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -15.324 8.122 -1.636 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -15.913 10.225 -2.944 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -17.588 9.992 -2.487 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -16.625 9.734 -0.034 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -15.196 10.511 -0.685 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -16.685 12.102 0.302 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -16.557 12.382 -1.368 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -17.942 11.629 -0.738 1.00 0.00 H new ATOM 335 N GLU A 22 -15.664 5.117 -5.245 1.00 0.00 N ATOM 336 CA GLU A 22 -15.692 4.709 -6.651 1.00 0.00 C ATOM 337 C GLU A 22 -16.451 3.402 -6.871 1.00 0.00 C ATOM 338 O GLU A 22 -17.127 3.266 -7.890 1.00 0.00 O ATOM 339 CB GLU A 22 -14.271 4.616 -7.233 1.00 0.00 C ATOM 340 CG GLU A 22 -13.628 6.004 -7.278 1.00 0.00 C ATOM 341 CD GLU A 22 -12.289 6.044 -8.019 1.00 0.00 C ATOM 342 OE1 GLU A 22 -12.250 5.809 -9.251 1.00 0.00 O ATOM 343 OE2 GLU A 22 -11.308 6.499 -7.387 1.00 0.00 O ATOM 0 H GLU A 22 -14.724 5.194 -4.857 1.00 0.00 H new ATOM 0 HA GLU A 22 -16.236 5.487 -7.186 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -13.664 3.945 -6.625 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -14.308 4.191 -8.236 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -14.318 6.698 -7.758 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -13.478 6.357 -6.258 1.00 0.00 H new ATOM 350 N MET A 23 -16.363 2.467 -5.922 1.00 0.00 N ATOM 351 CA MET A 23 -17.013 1.169 -6.005 1.00 0.00 C ATOM 352 C MET A 23 -18.246 1.076 -5.092 1.00 0.00 C ATOM 353 O MET A 23 -18.947 0.066 -5.130 1.00 0.00 O ATOM 354 CB MET A 23 -16.009 0.048 -5.664 1.00 0.00 C ATOM 355 CG MET A 23 -14.508 0.358 -5.814 1.00 0.00 C ATOM 356 SD MET A 23 -13.436 -1.102 -5.959 1.00 0.00 S ATOM 357 CE MET A 23 -13.459 -1.315 -7.755 1.00 0.00 C ATOM 0 H MET A 23 -15.828 2.598 -5.063 1.00 0.00 H new ATOM 0 HA MET A 23 -17.361 1.045 -7.031 1.00 0.00 H new ATOM 0 HB2 MET A 23 -16.186 -0.258 -4.633 1.00 0.00 H new ATOM 0 HB3 MET A 23 -16.238 -0.810 -6.295 1.00 0.00 H new ATOM 0 HG2 MET A 23 -14.367 0.983 -6.696 1.00 0.00 H new ATOM 0 HG3 MET A 23 -14.185 0.944 -4.953 1.00 0.00 H new ATOM 0 HE1 MET A 23 -12.847 -2.175 -8.027 1.00 0.00 H new ATOM 0 HE2 MET A 23 -14.484 -1.479 -8.089 1.00 0.00 H new ATOM 0 HE3 MET A 23 -13.061 -0.420 -8.233 1.00 0.00 H new ATOM 367 N THR A 24 -18.487 2.075 -4.235 1.00 0.00 N ATOM 368 CA THR A 24 -19.196 1.928 -2.963 1.00 0.00 C ATOM 369 C THR A 24 -18.832 0.596 -2.288 1.00 0.00 C ATOM 370 O THR A 24 -19.631 -0.338 -2.193 1.00 0.00 O ATOM 371 CB THR A 24 -20.675 2.334 -3.087 1.00 0.00 C ATOM 372 OG1 THR A 24 -20.702 3.697 -3.476 1.00 0.00 O ATOM 373 CG2 THR A 24 -21.454 2.238 -1.771 1.00 0.00 C ATOM 0 H THR A 24 -18.185 3.033 -4.414 1.00 0.00 H new ATOM 0 HA THR A 24 -18.850 2.653 -2.226 1.00 0.00 H new ATOM 0 HB THR A 24 -21.140 1.653 -3.800 1.00 0.00 H new ATOM 0 HG1 THR A 24 -21.632 3.993 -3.567 1.00 0.00 H new ATOM 0 HG21 THR A 24 -22.488 2.540 -1.937 1.00 0.00 H new ATOM 0 HG22 THR A 24 -21.430 1.211 -1.408 1.00 0.00 H new ATOM 0 HG23 THR A 24 -20.999 2.895 -1.030 1.00 0.00 H new ATOM 381 N LEU A 25 -17.570 0.550 -1.838 1.00 0.00 N ATOM 382 CA LEU A 25 -17.080 -0.412 -0.847 1.00 0.00 C ATOM 383 C LEU A 25 -17.680 -0.020 0.509 1.00 0.00 C ATOM 384 O LEU A 25 -18.376 1.000 0.607 1.00 0.00 O ATOM 385 CB LEU A 25 -15.534 -0.409 -0.747 1.00 0.00 C ATOM 386 CG LEU A 25 -14.767 -0.520 -2.084 1.00 0.00 C ATOM 387 CD1 LEU A 25 -13.285 -0.156 -1.957 1.00 0.00 C ATOM 388 CD2 LEU A 25 -14.840 -1.948 -2.625 1.00 0.00 C ATOM 0 H LEU A 25 -16.849 1.195 -2.161 1.00 0.00 H new ATOM 0 HA LEU A 25 -17.379 -1.416 -1.146 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -15.224 0.510 -0.249 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -15.230 -1.237 -0.107 1.00 0.00 H new ATOM 0 HG LEU A 25 -15.248 0.189 -2.758 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -12.802 -0.254 -2.929 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -13.192 0.872 -1.607 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -12.805 -0.827 -1.244 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -14.295 -2.009 -3.567 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -14.395 -2.634 -1.904 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -15.882 -2.221 -2.791 1.00 0.00 H new ATOM 400 N THR A 26 -17.392 -0.778 1.567 1.00 0.00 N ATOM 401 CA THR A 26 -17.823 -0.393 2.916 1.00 0.00 C ATOM 402 C THR A 26 -17.042 0.818 3.451 1.00 0.00 C ATOM 403 O THR A 26 -16.136 1.318 2.787 1.00 0.00 O ATOM 404 CB THR A 26 -17.813 -1.585 3.886 1.00 0.00 C ATOM 405 OG1 THR A 26 -16.669 -2.418 3.820 1.00 0.00 O ATOM 406 CG2 THR A 26 -19.024 -2.464 3.593 1.00 0.00 C ATOM 0 H THR A 26 -16.869 -1.652 1.521 1.00 0.00 H new ATOM 0 HA THR A 26 -18.862 -0.072 2.839 1.00 0.00 H new ATOM 0 HB THR A 26 -17.821 -1.140 4.881 1.00 0.00 H new ATOM 0 HG1 THR A 26 -16.628 -2.849 2.941 1.00 0.00 H new ATOM 0 HG21 THR A 26 -19.030 -3.315 4.275 1.00 0.00 H new ATOM 0 HG22 THR A 26 -19.936 -1.884 3.730 1.00 0.00 H new ATOM 0 HG23 THR A 26 -18.973 -2.823 2.565 1.00 0.00 H new ATOM 414 N ASP A 27 -17.393 1.290 4.654 1.00 0.00 N ATOM 415 CA ASP A 27 -16.898 2.547 5.222 1.00 0.00 C ATOM 416 C ASP A 27 -15.896 2.312 6.357 1.00 0.00 C ATOM 417 O ASP A 27 -14.946 3.079 6.516 1.00 0.00 O ATOM 418 CB ASP A 27 -18.102 3.355 5.718 1.00 0.00 C ATOM 419 CG ASP A 27 -17.842 4.853 5.883 1.00 0.00 C ATOM 420 OD1 ASP A 27 -16.814 5.378 5.402 1.00 0.00 O ATOM 421 OD2 ASP A 27 -18.777 5.526 6.385 1.00 0.00 O ATOM 0 H ASP A 27 -18.041 0.799 5.270 1.00 0.00 H new ATOM 0 HA ASP A 27 -16.362 3.099 4.450 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -18.927 3.218 5.019 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -18.425 2.948 6.676 1.00 0.00 H new ATOM 426 N ALA A 28 -16.032 1.194 7.086 1.00 0.00 N ATOM 427 CA ALA A 28 -15.096 0.766 8.130 1.00 0.00 C ATOM 428 C ALA A 28 -13.672 0.551 7.594 1.00 0.00 C ATOM 429 O ALA A 28 -12.729 0.423 8.366 1.00 0.00 O ATOM 430 CB ALA A 28 -15.597 -0.540 8.757 1.00 0.00 C ATOM 0 H ALA A 28 -16.813 0.550 6.961 1.00 0.00 H new ATOM 0 HA ALA A 28 -15.052 1.563 8.872 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -14.903 -0.861 9.534 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -16.582 -0.379 9.195 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -15.663 -1.311 7.989 1.00 0.00 H new ATOM 436 N ILE A 29 -13.514 0.520 6.271 1.00 0.00 N ATOM 437 CA ILE A 29 -12.293 0.347 5.496 1.00 0.00 C ATOM 438 C ILE A 29 -11.184 1.328 5.857 1.00 0.00 C ATOM 439 O ILE A 29 -10.047 1.054 5.487 1.00 0.00 O ATOM 440 CB ILE A 29 -12.666 0.303 3.995 1.00 0.00 C ATOM 441 CG1 ILE A 29 -13.173 1.639 3.421 1.00 0.00 C ATOM 442 CG2 ILE A 29 -13.741 -0.773 3.731 1.00 0.00 C ATOM 443 CD1 ILE A 29 -12.089 2.706 3.371 1.00 0.00 C ATOM 0 H ILE A 29 -14.322 0.626 5.657 1.00 0.00 H new ATOM 0 HA ILE A 29 -11.836 -0.607 5.757 1.00 0.00 H new ATOM 0 HB ILE A 29 -11.731 0.066 3.487 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -13.561 1.474 2.416 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -14.004 1.999 4.028 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -13.989 -0.787 2.670 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -13.359 -1.750 4.027 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -14.636 -0.543 4.309 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -12.503 3.626 2.958 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -11.718 2.895 4.378 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -11.269 2.362 2.741 1.00 0.00 H new ATOM 455 N ASN A 30 -11.480 2.420 6.566 1.00 0.00 N ATOM 456 CA ASN A 30 -10.448 3.280 7.121 1.00 0.00 C ATOM 457 C ASN A 30 -9.710 2.470 8.180 1.00 0.00 C ATOM 458 O ASN A 30 -8.564 2.061 8.016 1.00 0.00 O ATOM 459 CB ASN A 30 -11.049 4.582 7.674 1.00 0.00 C ATOM 460 CG ASN A 30 -10.127 5.794 7.527 1.00 0.00 C ATOM 461 OD1 ASN A 30 -9.107 5.761 6.853 1.00 0.00 O ATOM 462 ND2 ASN A 30 -10.481 6.918 8.129 1.00 0.00 N ATOM 0 H ASN A 30 -12.432 2.725 6.766 1.00 0.00 H new ATOM 0 HA ASN A 30 -9.743 3.596 6.352 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -11.988 4.786 7.159 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -11.287 4.443 8.729 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -9.904 7.753 8.030 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -11.331 6.949 8.692 1.00 0.00 H new ATOM 469 N GLU A 31 -10.426 2.160 9.254 1.00 0.00 N ATOM 470 CA GLU A 31 -9.846 1.513 10.418 1.00 0.00 C ATOM 471 C GLU A 31 -9.492 0.065 10.117 1.00 0.00 C ATOM 472 O GLU A 31 -8.494 -0.424 10.634 1.00 0.00 O ATOM 473 CB GLU A 31 -10.806 1.555 11.604 1.00 0.00 C ATOM 474 CG GLU A 31 -10.985 2.965 12.175 1.00 0.00 C ATOM 475 CD GLU A 31 -11.674 2.866 13.531 1.00 0.00 C ATOM 476 OE1 GLU A 31 -12.885 2.550 13.548 1.00 0.00 O ATOM 477 OE2 GLU A 31 -10.967 2.992 14.558 1.00 0.00 O ATOM 0 H GLU A 31 -11.424 2.351 9.340 1.00 0.00 H new ATOM 0 HA GLU A 31 -8.938 2.060 10.672 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -11.777 1.168 11.293 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -10.436 0.895 12.388 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -10.017 3.455 12.279 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -11.579 3.575 11.494 1.00 0.00 H new ATOM 484 N ASP A 32 -10.277 -0.635 9.296 1.00 0.00 N ATOM 485 CA ASP A 32 -10.088 -2.068 9.092 1.00 0.00 C ATOM 486 C ASP A 32 -8.957 -2.371 8.111 1.00 0.00 C ATOM 487 O ASP A 32 -8.325 -3.425 8.179 1.00 0.00 O ATOM 488 CB ASP A 32 -11.397 -2.751 8.691 1.00 0.00 C ATOM 489 CG ASP A 32 -11.326 -4.250 8.992 1.00 0.00 C ATOM 490 OD1 ASP A 32 -11.013 -4.588 10.160 1.00 0.00 O ATOM 491 OD2 ASP A 32 -11.655 -5.043 8.077 1.00 0.00 O ATOM 0 H ASP A 32 -11.048 -0.232 8.763 1.00 0.00 H new ATOM 0 HA ASP A 32 -9.782 -2.490 10.049 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -12.230 -2.303 9.233 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -11.587 -2.595 7.629 1.00 0.00 H new ATOM 496 N PHE A 33 -8.612 -1.405 7.253 1.00 0.00 N ATOM 497 CA PHE A 33 -7.341 -1.438 6.545 1.00 0.00 C ATOM 498 C PHE A 33 -6.200 -1.249 7.547 1.00 0.00 C ATOM 499 O PHE A 33 -5.244 -2.019 7.556 1.00 0.00 O ATOM 500 CB PHE A 33 -7.331 -0.358 5.458 1.00 0.00 C ATOM 501 CG PHE A 33 -6.073 -0.352 4.604 1.00 0.00 C ATOM 502 CD1 PHE A 33 -5.687 -1.494 3.872 1.00 0.00 C ATOM 503 CD2 PHE A 33 -5.245 0.787 4.585 1.00 0.00 C ATOM 504 CE1 PHE A 33 -4.460 -1.512 3.184 1.00 0.00 C ATOM 505 CE2 PHE A 33 -4.036 0.778 3.871 1.00 0.00 C ATOM 506 CZ PHE A 33 -3.623 -0.385 3.210 1.00 0.00 C ATOM 0 H PHE A 33 -9.196 -0.597 7.037 1.00 0.00 H new ATOM 0 HA PHE A 33 -7.204 -2.402 6.056 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -8.196 -0.500 4.811 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -7.443 0.618 5.929 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -6.335 -2.357 3.840 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -5.542 1.674 5.124 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -4.162 -2.393 2.636 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -3.425 1.668 3.832 1.00 0.00 H new ATOM 0 HZ PHE A 33 -2.661 -0.415 2.720 1.00 0.00 H new ATOM 516 N TYR A 34 -6.317 -0.256 8.429 1.00 0.00 N ATOM 517 CA TYR A 34 -5.287 0.063 9.413 1.00 0.00 C ATOM 518 C TYR A 34 -5.155 -1.049 10.480 1.00 0.00 C ATOM 519 O TYR A 34 -4.155 -1.127 11.200 1.00 0.00 O ATOM 520 CB TYR A 34 -5.616 1.409 10.074 1.00 0.00 C ATOM 521 CG TYR A 34 -5.327 2.678 9.265 1.00 0.00 C ATOM 522 CD1 TYR A 34 -5.689 2.773 7.903 1.00 0.00 C ATOM 523 CD2 TYR A 34 -4.735 3.801 9.885 1.00 0.00 C ATOM 524 CE1 TYR A 34 -5.513 3.957 7.173 1.00 0.00 C ATOM 525 CE2 TYR A 34 -4.562 5.001 9.168 1.00 0.00 C ATOM 526 CZ TYR A 34 -4.967 5.085 7.816 1.00 0.00 C ATOM 527 OH TYR A 34 -4.816 6.242 7.125 1.00 0.00 O ATOM 0 H TYR A 34 -7.134 0.352 8.480 1.00 0.00 H new ATOM 0 HA TYR A 34 -4.328 0.133 8.900 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -6.675 1.408 10.333 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -5.059 1.471 11.009 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -6.113 1.910 7.411 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -4.413 3.739 10.914 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -5.793 4.004 6.131 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -4.119 5.859 9.652 1.00 0.00 H new ATOM 0 HH TYR A 34 -4.427 6.925 7.711 1.00 0.00 H new ATOM 537 N ASN A 35 -6.194 -1.867 10.655 1.00 0.00 N ATOM 538 CA ASN A 35 -6.241 -3.108 11.438 1.00 0.00 C ATOM 539 C ASN A 35 -5.417 -4.185 10.759 1.00 0.00 C ATOM 540 O ASN A 35 -4.540 -4.741 11.407 1.00 0.00 O ATOM 541 CB ASN A 35 -7.658 -3.693 11.586 1.00 0.00 C ATOM 542 CG ASN A 35 -8.580 -2.978 12.553 1.00 0.00 C ATOM 543 OD1 ASN A 35 -8.130 -2.249 13.443 1.00 0.00 O ATOM 544 ND2 ASN A 35 -9.873 -3.218 12.427 1.00 0.00 N ATOM 0 H ASN A 35 -7.095 -1.666 10.221 1.00 0.00 H new ATOM 0 HA ASN A 35 -5.858 -2.836 12.422 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -8.130 -3.699 10.604 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -7.568 -4.732 11.903 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -10.536 -2.796 13.077 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -10.208 -3.826 11.679 1.00 0.00 H new ATOM 551 N PHE A 36 -5.717 -4.492 9.489 1.00 0.00 N ATOM 552 CA PHE A 36 -5.133 -5.588 8.713 1.00 0.00 C ATOM 553 C PHE A 36 -3.612 -5.654 8.862 1.00 0.00 C ATOM 554 O PHE A 36 -3.053 -6.739 8.992 1.00 0.00 O ATOM 555 CB PHE A 36 -5.549 -5.412 7.242 1.00 0.00 C ATOM 556 CG PHE A 36 -4.768 -6.197 6.202 1.00 0.00 C ATOM 557 CD1 PHE A 36 -4.451 -7.560 6.385 1.00 0.00 C ATOM 558 CD2 PHE A 36 -4.311 -5.527 5.049 1.00 0.00 C ATOM 559 CE1 PHE A 36 -3.676 -8.239 5.430 1.00 0.00 C ATOM 560 CE2 PHE A 36 -3.537 -6.207 4.097 1.00 0.00 C ATOM 561 CZ PHE A 36 -3.217 -7.562 4.290 1.00 0.00 C ATOM 0 H PHE A 36 -6.403 -3.959 8.954 1.00 0.00 H new ATOM 0 HA PHE A 36 -5.510 -6.537 9.094 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -6.600 -5.686 7.153 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -5.473 -4.353 6.994 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -4.805 -8.082 7.261 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -4.558 -4.486 4.898 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -3.434 -9.282 5.573 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -3.187 -5.690 3.216 1.00 0.00 H new ATOM 0 HZ PHE A 36 -2.616 -8.083 3.559 1.00 0.00 H new ATOM 571 N TRP A 37 -2.952 -4.496 8.898 1.00 0.00 N ATOM 572 CA TRP A 37 -1.512 -4.399 9.049 1.00 0.00 C ATOM 573 C TRP A 37 -0.969 -5.119 10.286 1.00 0.00 C ATOM 574 O TRP A 37 0.178 -5.567 10.270 1.00 0.00 O ATOM 575 CB TRP A 37 -1.137 -2.923 9.188 1.00 0.00 C ATOM 576 CG TRP A 37 -1.636 -1.961 8.155 1.00 0.00 C ATOM 577 CD1 TRP A 37 -2.051 -2.245 6.899 1.00 0.00 C ATOM 578 CD2 TRP A 37 -1.813 -0.529 8.320 1.00 0.00 C ATOM 579 NE1 TRP A 37 -2.480 -1.088 6.282 1.00 0.00 N ATOM 580 CE2 TRP A 37 -2.337 0.004 7.111 1.00 0.00 C ATOM 581 CE3 TRP A 37 -1.634 0.363 9.399 1.00 0.00 C ATOM 582 CZ2 TRP A 37 -2.646 1.363 6.981 1.00 0.00 C ATOM 583 CZ3 TRP A 37 -1.939 1.729 9.277 1.00 0.00 C ATOM 584 CH2 TRP A 37 -2.426 2.231 8.060 1.00 0.00 C ATOM 0 H TRP A 37 -3.415 -3.590 8.822 1.00 0.00 H new ATOM 0 HA TRP A 37 -1.078 -4.873 8.169 1.00 0.00 H new ATOM 0 HB2 TRP A 37 -1.492 -2.580 10.160 1.00 0.00 H new ATOM 0 HB3 TRP A 37 -0.049 -2.857 9.205 1.00 0.00 H new ATOM 0 HD1 TRP A 37 -2.047 -3.227 6.449 1.00 0.00 H new ATOM 0 HE1 TRP A 37 -2.855 -1.046 5.334 1.00 0.00 H new ATOM 0 HE3 TRP A 37 -1.255 -0.012 10.338 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 -3.052 1.741 6.054 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 -1.799 2.392 10.118 1.00 0.00 H new ATOM 0 HH2 TRP A 37 -2.631 3.286 7.955 1.00 0.00 H new ATOM 595 N LYS A 38 -1.715 -5.130 11.388 1.00 0.00 N ATOM 596 CA LYS A 38 -1.239 -5.504 12.715 1.00 0.00 C ATOM 597 C LYS A 38 -1.090 -7.025 12.794 1.00 0.00 C ATOM 598 O LYS A 38 -1.716 -7.761 12.031 1.00 0.00 O ATOM 599 CB LYS A 38 -2.242 -4.957 13.746 1.00 0.00 C ATOM 600 CG LYS A 38 -2.330 -3.416 13.723 1.00 0.00 C ATOM 601 CD LYS A 38 -3.499 -2.888 14.573 1.00 0.00 C ATOM 602 CE LYS A 38 -3.088 -1.645 15.378 1.00 0.00 C ATOM 603 NZ LYS A 38 -3.711 -1.623 16.715 1.00 0.00 N ATOM 0 H LYS A 38 -2.701 -4.870 11.380 1.00 0.00 H new ATOM 0 HA LYS A 38 -0.258 -5.078 12.925 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -3.228 -5.377 13.548 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -1.950 -5.286 14.743 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -1.395 -2.995 14.093 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -2.448 -3.076 12.694 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -4.340 -2.642 13.925 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -3.838 -3.669 15.254 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -2.003 -1.623 15.483 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -3.373 -0.747 14.830 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -3.408 -0.769 17.225 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -4.746 -1.618 16.616 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -3.419 -2.467 17.248 1.00 0.00 H new ATOM 617 N GLU A 39 -0.247 -7.529 13.693 1.00 0.00 N ATOM 618 CA GLU A 39 -0.113 -8.972 13.848 1.00 0.00 C ATOM 619 C GLU A 39 -1.381 -9.530 14.492 1.00 0.00 C ATOM 620 O GLU A 39 -2.018 -8.861 15.314 1.00 0.00 O ATOM 621 CB GLU A 39 1.146 -9.318 14.656 1.00 0.00 C ATOM 622 CG GLU A 39 2.373 -9.201 13.749 1.00 0.00 C ATOM 623 CD GLU A 39 3.645 -9.688 14.444 1.00 0.00 C ATOM 624 OE1 GLU A 39 4.240 -8.889 15.199 1.00 0.00 O ATOM 625 OE2 GLU A 39 4.086 -10.838 14.195 1.00 0.00 O ATOM 0 H GLU A 39 0.341 -6.972 14.312 1.00 0.00 H new ATOM 0 HA GLU A 39 0.006 -9.437 12.869 1.00 0.00 H new ATOM 0 HB2 GLU A 39 1.243 -8.645 15.508 1.00 0.00 H new ATOM 0 HB3 GLU A 39 1.070 -10.329 15.056 1.00 0.00 H new ATOM 0 HG2 GLU A 39 2.210 -9.782 12.841 1.00 0.00 H new ATOM 0 HG3 GLU A 39 2.501 -8.162 13.444 1.00 0.00 H new ATOM 632 N GLY A 40 -1.730 -10.765 14.129 1.00 0.00 N ATOM 633 CA GLY A 40 -2.914 -11.454 14.624 1.00 0.00 C ATOM 634 C GLY A 40 -4.214 -10.956 13.993 1.00 0.00 C ATOM 635 O GLY A 40 -5.285 -11.235 14.536 1.00 0.00 O ATOM 0 H GLY A 40 -1.185 -11.321 13.470 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -2.811 -12.522 14.431 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -2.972 -11.329 15.705 1.00 0.00 H new ATOM 639 N TYR A 41 -4.159 -10.201 12.894 1.00 0.00 N ATOM 640 CA TYR A 41 -5.314 -9.773 12.135 1.00 0.00 C ATOM 641 C TYR A 41 -5.358 -10.576 10.845 1.00 0.00 C ATOM 642 O TYR A 41 -4.778 -10.201 9.825 1.00 0.00 O ATOM 643 CB TYR A 41 -5.261 -8.267 11.899 1.00 0.00 C ATOM 644 CG TYR A 41 -6.163 -7.494 12.832 1.00 0.00 C ATOM 645 CD1 TYR A 41 -7.550 -7.465 12.608 1.00 0.00 C ATOM 646 CD2 TYR A 41 -5.624 -6.834 13.944 1.00 0.00 C ATOM 647 CE1 TYR A 41 -8.397 -6.728 13.449 1.00 0.00 C ATOM 648 CE2 TYR A 41 -6.458 -6.103 14.803 1.00 0.00 C ATOM 649 CZ TYR A 41 -7.846 -6.033 14.548 1.00 0.00 C ATOM 650 OH TYR A 41 -8.626 -5.260 15.347 1.00 0.00 O ATOM 0 H TYR A 41 -3.278 -9.866 12.504 1.00 0.00 H new ATOM 0 HA TYR A 41 -6.237 -9.960 12.684 1.00 0.00 H new ATOM 0 HB2 TYR A 41 -4.235 -7.921 12.024 1.00 0.00 H new ATOM 0 HB3 TYR A 41 -5.546 -8.056 10.868 1.00 0.00 H new ATOM 0 HD1 TYR A 41 -7.969 -8.016 11.779 1.00 0.00 H new ATOM 0 HD2 TYR A 41 -4.563 -6.888 14.140 1.00 0.00 H new ATOM 0 HE1 TYR A 41 -9.459 -6.692 13.258 1.00 0.00 H new ATOM 0 HE2 TYR A 41 -6.039 -5.594 15.659 1.00 0.00 H new ATOM 0 HH TYR A 41 -8.076 -4.860 16.053 1.00 0.00 H new ATOM 660 N GLU A 42 -6.117 -11.668 10.869 1.00 0.00 N ATOM 661 CA GLU A 42 -6.556 -12.354 9.662 1.00 0.00 C ATOM 662 C GLU A 42 -7.672 -11.502 9.036 1.00 0.00 C ATOM 663 O GLU A 42 -8.844 -11.877 9.049 1.00 0.00 O ATOM 664 CB GLU A 42 -6.993 -13.800 9.997 1.00 0.00 C ATOM 665 CG GLU A 42 -5.936 -14.854 9.654 1.00 0.00 C ATOM 666 CD GLU A 42 -4.625 -14.691 10.424 1.00 0.00 C ATOM 667 OE1 GLU A 42 -3.694 -14.050 9.892 1.00 0.00 O ATOM 668 OE2 GLU A 42 -4.455 -15.344 11.478 1.00 0.00 O ATOM 0 H GLU A 42 -6.445 -12.102 11.732 1.00 0.00 H new ATOM 0 HA GLU A 42 -5.751 -12.457 8.935 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -7.226 -13.863 11.060 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -7.911 -14.028 9.455 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -6.345 -15.844 9.858 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -5.726 -14.809 8.585 1.00 0.00 H new ATOM 675 N ILE A 43 -7.340 -10.317 8.518 1.00 0.00 N ATOM 676 CA ILE A 43 -8.197 -9.622 7.570 1.00 0.00 C ATOM 677 C ILE A 43 -7.887 -10.245 6.214 1.00 0.00 C ATOM 678 O ILE A 43 -7.019 -9.781 5.474 1.00 0.00 O ATOM 679 CB ILE A 43 -8.019 -8.107 7.633 1.00 0.00 C ATOM 680 CG1 ILE A 43 -8.347 -7.582 9.039 1.00 0.00 C ATOM 681 CG2 ILE A 43 -8.906 -7.399 6.600 1.00 0.00 C ATOM 682 CD1 ILE A 43 -9.621 -8.100 9.719 1.00 0.00 C ATOM 0 H ILE A 43 -6.478 -9.821 8.744 1.00 0.00 H new ATOM 0 HA ILE A 43 -9.256 -9.745 7.799 1.00 0.00 H new ATOM 0 HB ILE A 43 -6.976 -7.890 7.402 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -7.503 -7.815 9.688 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -8.416 -6.496 8.983 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -8.757 -6.322 6.670 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -8.640 -7.738 5.599 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -9.952 -7.634 6.797 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -9.720 -7.642 10.703 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -10.488 -7.843 9.111 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -9.561 -9.183 9.827 1.00 0.00 H new ATOM 694 N LYS A 44 -8.558 -11.350 5.904 1.00 0.00 N ATOM 695 CA LYS A 44 -8.424 -12.072 4.640 1.00 0.00 C ATOM 696 C LYS A 44 -9.290 -11.436 3.551 1.00 0.00 C ATOM 697 O LYS A 44 -9.329 -11.942 2.427 1.00 0.00 O ATOM 698 CB LYS A 44 -8.849 -13.532 4.877 1.00 0.00 C ATOM 699 CG LYS A 44 -7.879 -14.294 5.796 1.00 0.00 C ATOM 700 CD LYS A 44 -6.612 -14.755 5.065 1.00 0.00 C ATOM 701 CE LYS A 44 -6.924 -15.998 4.227 1.00 0.00 C ATOM 702 NZ LYS A 44 -5.765 -16.429 3.429 1.00 0.00 N ATOM 0 H LYS A 44 -9.228 -11.781 6.541 1.00 0.00 H new ATOM 0 HA LYS A 44 -7.389 -12.029 4.300 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -9.847 -13.548 5.316 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -8.914 -14.047 3.918 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -7.599 -13.654 6.632 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -8.388 -15.162 6.215 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -6.239 -13.956 4.424 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -5.825 -14.978 5.786 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -7.234 -16.810 4.884 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -7.763 -15.787 3.564 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -6.018 -17.273 2.877 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -5.484 -15.664 2.783 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -4.972 -16.655 4.063 1.00 0.00 H new ATOM 716 N ASN A 45 -10.020 -10.375 3.887 1.00 0.00 N ATOM 717 CA ASN A 45 -11.198 -9.925 3.165 1.00 0.00 C ATOM 718 C ASN A 45 -10.860 -9.420 1.770 1.00 0.00 C ATOM 719 O ASN A 45 -9.826 -8.815 1.494 1.00 0.00 O ATOM 720 CB ASN A 45 -11.993 -8.884 3.967 1.00 0.00 C ATOM 721 CG ASN A 45 -12.906 -8.030 3.104 1.00 0.00 C ATOM 722 OD1 ASN A 45 -12.562 -6.902 2.821 1.00 0.00 O ATOM 723 ND2 ASN A 45 -13.990 -8.569 2.555 1.00 0.00 N ATOM 0 H ASN A 45 -9.798 -9.791 4.693 1.00 0.00 H new ATOM 0 HA ASN A 45 -11.840 -10.797 3.038 1.00 0.00 H new ATOM 0 HB2 ASN A 45 -12.591 -9.396 4.721 1.00 0.00 H new ATOM 0 HB3 ASN A 45 -11.296 -8.236 4.499 1.00 0.00 H new ATOM 0 HD21 ASN A 45 -14.544 -8.033 1.887 1.00 0.00 H new ATOM 0 HD22 ASN A 45 -14.268 -9.519 2.802 1.00 0.00 H new ATOM 730 N ARG A 46 -11.811 -9.675 0.885 1.00 0.00 N ATOM 731 CA ARG A 46 -11.800 -9.336 -0.528 1.00 0.00 C ATOM 732 C ARG A 46 -11.637 -7.826 -0.696 1.00 0.00 C ATOM 733 O ARG A 46 -10.762 -7.365 -1.424 1.00 0.00 O ATOM 734 CB ARG A 46 -13.107 -9.812 -1.177 1.00 0.00 C ATOM 735 CG ARG A 46 -13.579 -11.221 -0.786 1.00 0.00 C ATOM 736 CD ARG A 46 -15.005 -11.385 -1.306 1.00 0.00 C ATOM 737 NE ARG A 46 -15.360 -12.795 -1.536 1.00 0.00 N ATOM 738 CZ ARG A 46 -16.580 -13.271 -1.819 1.00 0.00 C ATOM 739 NH1 ARG A 46 -17.640 -12.475 -1.867 1.00 0.00 N ATOM 740 NH2 ARG A 46 -16.739 -14.568 -2.051 1.00 0.00 N ATOM 0 H ARG A 46 -12.669 -10.157 1.154 1.00 0.00 H new ATOM 0 HA ARG A 46 -10.962 -9.832 -1.018 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -13.895 -9.103 -0.923 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -12.985 -9.779 -2.260 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -12.924 -11.978 -1.216 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -13.548 -11.350 0.296 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -15.702 -10.950 -0.590 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -15.116 -10.829 -2.237 1.00 0.00 H new ATOM 0 HE ARG A 46 -14.603 -13.476 -1.474 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -17.537 -11.476 -1.686 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -18.559 -12.861 -2.085 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -15.935 -15.195 -2.013 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -17.665 -14.938 -2.267 1.00 0.00 H new ATOM 754 N GLU A 47 -12.475 -7.061 -0.003 1.00 0.00 N ATOM 755 CA GLU A 47 -12.599 -5.616 -0.095 1.00 0.00 C ATOM 756 C GLU A 47 -11.370 -4.888 0.461 1.00 0.00 C ATOM 757 O GLU A 47 -11.059 -3.800 -0.021 1.00 0.00 O ATOM 758 CB GLU A 47 -13.913 -5.190 0.601 1.00 0.00 C ATOM 759 CG GLU A 47 -15.042 -5.023 -0.434 1.00 0.00 C ATOM 760 CD GLU A 47 -16.149 -4.025 -0.064 1.00 0.00 C ATOM 761 OE1 GLU A 47 -16.168 -3.464 1.057 1.00 0.00 O ATOM 762 OE2 GLU A 47 -17.035 -3.825 -0.923 1.00 0.00 O ATOM 0 H GLU A 47 -13.122 -7.460 0.677 1.00 0.00 H new ATOM 0 HA GLU A 47 -12.644 -5.324 -1.144 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -14.198 -5.937 1.342 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -13.761 -4.253 1.136 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -14.599 -4.710 -1.379 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -15.500 -5.997 -0.604 1.00 0.00 H new ATOM 769 N THR A 48 -10.608 -5.476 1.381 1.00 0.00 N ATOM 770 CA THR A 48 -9.301 -4.967 1.784 1.00 0.00 C ATOM 771 C THR A 48 -8.367 -4.968 0.567 1.00 0.00 C ATOM 772 O THR A 48 -7.680 -3.981 0.309 1.00 0.00 O ATOM 773 CB THR A 48 -8.772 -5.810 2.959 1.00 0.00 C ATOM 774 OG1 THR A 48 -9.785 -5.892 3.947 1.00 0.00 O ATOM 775 CG2 THR A 48 -7.526 -5.206 3.607 1.00 0.00 C ATOM 0 H THR A 48 -10.884 -6.327 1.871 1.00 0.00 H new ATOM 0 HA THR A 48 -9.366 -3.937 2.136 1.00 0.00 H new ATOM 0 HB THR A 48 -8.503 -6.789 2.563 1.00 0.00 H new ATOM 0 HG1 THR A 48 -9.519 -5.370 4.733 1.00 0.00 H new ATOM 0 HG21 THR A 48 -7.198 -5.843 4.429 1.00 0.00 H new ATOM 0 HG22 THR A 48 -6.730 -5.132 2.866 1.00 0.00 H new ATOM 0 HG23 THR A 48 -7.760 -4.212 3.989 1.00 0.00 H new ATOM 783 N GLY A 49 -8.403 -6.027 -0.248 1.00 0.00 N ATOM 784 CA GLY A 49 -7.682 -6.072 -1.510 1.00 0.00 C ATOM 785 C GLY A 49 -8.186 -5.026 -2.498 1.00 0.00 C ATOM 786 O GLY A 49 -7.382 -4.464 -3.238 1.00 0.00 O ATOM 0 H GLY A 49 -8.935 -6.874 -0.045 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -6.620 -5.913 -1.325 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -7.784 -7.064 -1.950 1.00 0.00 H new ATOM 790 N CYS A 50 -9.493 -4.737 -2.513 1.00 0.00 N ATOM 791 CA CYS A 50 -10.038 -3.670 -3.339 1.00 0.00 C ATOM 792 C CYS A 50 -9.476 -2.317 -2.910 1.00 0.00 C ATOM 793 O CYS A 50 -9.121 -1.517 -3.771 1.00 0.00 O ATOM 794 CB CYS A 50 -11.565 -3.626 -3.266 1.00 0.00 C ATOM 795 SG CYS A 50 -12.498 -5.082 -3.832 1.00 0.00 S ATOM 0 H CYS A 50 -10.190 -5.234 -1.957 1.00 0.00 H new ATOM 0 HA CYS A 50 -9.744 -3.879 -4.368 1.00 0.00 H new ATOM 0 HB2 CYS A 50 -11.843 -3.435 -2.229 1.00 0.00 H new ATOM 0 HB3 CYS A 50 -11.901 -2.769 -3.849 1.00 0.00 H new ATOM 800 N ALA A 51 -9.378 -2.056 -1.600 1.00 0.00 N ATOM 801 CA ALA A 51 -8.792 -0.817 -1.105 1.00 0.00 C ATOM 802 C ALA A 51 -7.372 -0.665 -1.627 1.00 0.00 C ATOM 803 O ALA A 51 -7.036 0.387 -2.157 1.00 0.00 O ATOM 804 CB ALA A 51 -8.789 -0.747 0.433 1.00 0.00 C ATOM 0 H ALA A 51 -9.699 -2.690 -0.869 1.00 0.00 H new ATOM 0 HA ALA A 51 -9.412 0.001 -1.472 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -8.343 0.194 0.754 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -9.813 -0.807 0.802 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -8.209 -1.578 0.834 1.00 0.00 H new ATOM 810 N ILE A 52 -6.547 -1.704 -1.489 1.00 0.00 N ATOM 811 CA ILE A 52 -5.161 -1.704 -1.945 1.00 0.00 C ATOM 812 C ILE A 52 -5.134 -1.386 -3.446 1.00 0.00 C ATOM 813 O ILE A 52 -4.451 -0.455 -3.859 1.00 0.00 O ATOM 814 CB ILE A 52 -4.504 -3.052 -1.588 1.00 0.00 C ATOM 815 CG1 ILE A 52 -4.461 -3.195 -0.052 1.00 0.00 C ATOM 816 CG2 ILE A 52 -3.084 -3.157 -2.173 1.00 0.00 C ATOM 817 CD1 ILE A 52 -4.111 -4.600 0.421 1.00 0.00 C ATOM 0 H ILE A 52 -6.829 -2.581 -1.051 1.00 0.00 H new ATOM 0 HA ILE A 52 -4.576 -0.933 -1.443 1.00 0.00 H new ATOM 0 HB ILE A 52 -5.096 -3.858 -2.021 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -3.730 -2.493 0.349 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -5.431 -2.914 0.358 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -2.649 -4.119 -1.903 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -3.131 -3.072 -3.259 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -2.465 -2.354 -1.772 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -4.099 -4.625 1.511 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -4.855 -5.305 0.050 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -3.128 -4.877 0.041 1.00 0.00 H new ATOM 829 N MET A 53 -5.912 -2.121 -4.241 1.00 0.00 N ATOM 830 CA MET A 53 -6.006 -1.976 -5.688 1.00 0.00 C ATOM 831 C MET A 53 -6.367 -0.537 -6.085 1.00 0.00 C ATOM 832 O MET A 53 -5.608 0.098 -6.813 1.00 0.00 O ATOM 833 CB MET A 53 -7.011 -3.020 -6.193 1.00 0.00 C ATOM 834 CG MET A 53 -7.166 -3.056 -7.710 1.00 0.00 C ATOM 835 SD MET A 53 -8.740 -2.404 -8.339 1.00 0.00 S ATOM 836 CE MET A 53 -9.931 -3.522 -7.560 1.00 0.00 C ATOM 0 H MET A 53 -6.515 -2.860 -3.879 1.00 0.00 H new ATOM 0 HA MET A 53 -5.042 -2.160 -6.162 1.00 0.00 H new ATOM 0 HB2 MET A 53 -6.699 -4.005 -5.847 1.00 0.00 H new ATOM 0 HB3 MET A 53 -7.984 -2.818 -5.744 1.00 0.00 H new ATOM 0 HG2 MET A 53 -6.350 -2.487 -8.157 1.00 0.00 H new ATOM 0 HG3 MET A 53 -7.057 -4.087 -8.046 1.00 0.00 H new ATOM 0 HE1 MET A 53 -10.850 -3.541 -8.147 1.00 0.00 H new ATOM 0 HE2 MET A 53 -9.510 -4.526 -7.512 1.00 0.00 H new ATOM 0 HE3 MET A 53 -10.152 -3.173 -6.551 1.00 0.00 H new ATOM 846 N CYS A 54 -7.468 0.012 -5.561 1.00 0.00 N ATOM 847 CA CYS A 54 -7.904 1.380 -5.841 1.00 0.00 C ATOM 848 C CYS A 54 -6.826 2.378 -5.420 1.00 0.00 C ATOM 849 O CYS A 54 -6.525 3.356 -6.110 1.00 0.00 O ATOM 850 CB CYS A 54 -9.215 1.655 -5.088 1.00 0.00 C ATOM 851 SG CYS A 54 -9.816 3.356 -5.243 1.00 0.00 S ATOM 0 H CYS A 54 -8.087 -0.489 -4.923 1.00 0.00 H new ATOM 0 HA CYS A 54 -8.072 1.495 -6.912 1.00 0.00 H new ATOM 0 HB2 CYS A 54 -9.983 0.975 -5.457 1.00 0.00 H new ATOM 0 HB3 CYS A 54 -9.069 1.428 -4.032 1.00 0.00 H new ATOM 856 N LEU A 55 -6.221 2.138 -4.259 1.00 0.00 N ATOM 857 CA LEU A 55 -5.165 3.000 -3.759 1.00 0.00 C ATOM 858 C LEU A 55 -3.937 3.046 -4.664 1.00 0.00 C ATOM 859 O LEU A 55 -3.194 4.026 -4.571 1.00 0.00 O ATOM 860 CB LEU A 55 -4.762 2.586 -2.341 1.00 0.00 C ATOM 861 CG LEU A 55 -5.711 3.089 -1.246 1.00 0.00 C ATOM 862 CD1 LEU A 55 -5.259 2.472 0.082 1.00 0.00 C ATOM 863 CD2 LEU A 55 -5.685 4.616 -1.165 1.00 0.00 C ATOM 0 H LEU A 55 -6.448 1.352 -3.650 1.00 0.00 H new ATOM 0 HA LEU A 55 -5.577 4.009 -3.745 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -4.713 1.498 -2.292 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -3.759 2.960 -2.137 1.00 0.00 H new ATOM 0 HG LEU A 55 -6.736 2.794 -1.472 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -5.916 2.811 0.883 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -5.304 1.385 0.012 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -4.236 2.780 0.297 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -6.365 4.950 -0.382 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -4.674 4.951 -0.934 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -5.997 5.036 -2.121 1.00 0.00 H new ATOM 875 N SER A 56 -3.720 2.075 -5.560 1.00 0.00 N ATOM 876 CA SER A 56 -2.536 2.093 -6.411 1.00 0.00 C ATOM 877 C SER A 56 -2.597 3.247 -7.418 1.00 0.00 C ATOM 878 O SER A 56 -1.586 3.632 -8.000 1.00 0.00 O ATOM 879 CB SER A 56 -2.290 0.707 -7.024 1.00 0.00 C ATOM 880 OG SER A 56 -2.880 0.507 -8.279 1.00 0.00 O ATOM 0 H SER A 56 -4.342 1.280 -5.709 1.00 0.00 H new ATOM 0 HA SER A 56 -1.653 2.300 -5.807 1.00 0.00 H new ATOM 0 HB2 SER A 56 -1.215 0.551 -7.114 1.00 0.00 H new ATOM 0 HB3 SER A 56 -2.666 -0.051 -6.336 1.00 0.00 H new ATOM 0 HG SER A 56 -3.841 0.349 -8.167 1.00 0.00 H new ATOM 886 N THR A 57 -3.759 3.889 -7.563 1.00 0.00 N ATOM 887 CA THR A 57 -3.960 4.995 -8.485 1.00 0.00 C ATOM 888 C THR A 57 -4.285 6.282 -7.691 1.00 0.00 C ATOM 889 O THR A 57 -4.802 7.266 -8.223 1.00 0.00 O ATOM 890 CB THR A 57 -4.883 4.505 -9.628 1.00 0.00 C ATOM 891 OG1 THR A 57 -5.118 5.505 -10.600 1.00 0.00 O ATOM 892 CG2 THR A 57 -6.206 3.876 -9.167 1.00 0.00 C ATOM 0 H THR A 57 -4.596 3.647 -7.032 1.00 0.00 H new ATOM 0 HA THR A 57 -3.073 5.320 -9.029 1.00 0.00 H new ATOM 0 HB THR A 57 -4.315 3.697 -10.090 1.00 0.00 H new ATOM 0 HG1 THR A 57 -5.019 6.390 -10.190 1.00 0.00 H new ATOM 0 HG21 THR A 57 -6.783 3.564 -10.037 1.00 0.00 H new ATOM 0 HG22 THR A 57 -5.998 3.009 -8.540 1.00 0.00 H new ATOM 0 HG23 THR A 57 -6.777 4.608 -8.596 1.00 0.00 H new ATOM 900 N LYS A 58 -3.937 6.314 -6.396 1.00 0.00 N ATOM 901 CA LYS A 58 -4.183 7.425 -5.467 1.00 0.00 C ATOM 902 C LYS A 58 -2.891 8.016 -4.906 1.00 0.00 C ATOM 903 O LYS A 58 -2.944 8.715 -3.897 1.00 0.00 O ATOM 904 CB LYS A 58 -5.126 6.951 -4.347 1.00 0.00 C ATOM 905 CG LYS A 58 -6.568 6.778 -4.830 1.00 0.00 C ATOM 906 CD LYS A 58 -7.343 8.076 -4.883 1.00 0.00 C ATOM 907 CE LYS A 58 -8.752 7.787 -5.394 1.00 0.00 C ATOM 908 NZ LYS A 58 -8.770 7.287 -6.793 1.00 0.00 N ATOM 0 H LYS A 58 -3.456 5.533 -5.950 1.00 0.00 H new ATOM 0 HA LYS A 58 -4.661 8.234 -6.019 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -4.764 6.004 -3.948 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -5.104 7.671 -3.529 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -6.559 6.328 -5.823 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -7.084 6.082 -4.169 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -7.386 8.530 -3.893 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -6.842 8.788 -5.539 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -9.224 7.050 -4.744 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -9.349 8.697 -5.331 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -9.743 7.317 -7.160 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -8.158 7.886 -7.384 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -8.422 6.307 -6.816 1.00 0.00 H new ATOM 922 N LEU A 59 -1.735 7.777 -5.523 1.00 0.00 N ATOM 923 CA LEU A 59 -0.440 8.246 -5.026 1.00 0.00 C ATOM 924 C LEU A 59 -0.442 9.750 -4.746 1.00 0.00 C ATOM 925 O LEU A 59 0.112 10.169 -3.738 1.00 0.00 O ATOM 926 CB LEU A 59 0.686 7.896 -6.011 1.00 0.00 C ATOM 927 CG LEU A 59 0.654 6.468 -6.589 1.00 0.00 C ATOM 928 CD1 LEU A 59 1.846 6.293 -7.525 1.00 0.00 C ATOM 929 CD2 LEU A 59 0.649 5.370 -5.521 1.00 0.00 C ATOM 0 H LEU A 59 -1.669 7.247 -6.392 1.00 0.00 H new ATOM 0 HA LEU A 59 -0.259 7.731 -4.082 1.00 0.00 H new ATOM 0 HB2 LEU A 59 0.651 8.603 -6.839 1.00 0.00 H new ATOM 0 HB3 LEU A 59 1.642 8.042 -5.507 1.00 0.00 H new ATOM 0 HG LEU A 59 -0.286 6.356 -7.129 1.00 0.00 H new ATOM 0 HD11 LEU A 59 1.836 5.286 -7.942 1.00 0.00 H new ATOM 0 HD12 LEU A 59 1.784 7.021 -8.334 1.00 0.00 H new ATOM 0 HD13 LEU A 59 2.771 6.447 -6.969 1.00 0.00 H new ATOM 0 HD21 LEU A 59 0.626 4.393 -6.004 1.00 0.00 H new ATOM 0 HD22 LEU A 59 1.548 5.452 -4.911 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -0.231 5.483 -4.888 1.00 0.00 H new ATOM 941 N ASN A 60 -1.120 10.558 -5.570 1.00 0.00 N ATOM 942 CA ASN A 60 -1.196 12.016 -5.395 1.00 0.00 C ATOM 943 C ASN A 60 -1.929 12.446 -4.118 1.00 0.00 C ATOM 944 O ASN A 60 -1.770 13.581 -3.668 1.00 0.00 O ATOM 945 CB ASN A 60 -1.863 12.670 -6.619 1.00 0.00 C ATOM 946 CG ASN A 60 -3.361 12.912 -6.465 1.00 0.00 C ATOM 947 OD1 ASN A 60 -3.789 14.057 -6.431 1.00 0.00 O ATOM 948 ND2 ASN A 60 -4.179 11.877 -6.446 1.00 0.00 N ATOM 0 H ASN A 60 -1.635 10.218 -6.382 1.00 0.00 H new ATOM 0 HA ASN A 60 -0.166 12.359 -5.297 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -1.372 13.622 -6.820 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -1.697 12.036 -7.490 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -5.187 12.025 -6.402 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -3.803 10.929 -6.475 1.00 0.00 H new ATOM 955 N MET A 61 -2.740 11.557 -3.545 1.00 0.00 N ATOM 956 CA MET A 61 -3.359 11.759 -2.250 1.00 0.00 C ATOM 957 C MET A 61 -2.324 11.483 -1.172 1.00 0.00 C ATOM 958 O MET A 61 -2.173 12.266 -0.239 1.00 0.00 O ATOM 959 CB MET A 61 -4.530 10.790 -2.059 1.00 0.00 C ATOM 960 CG MET A 61 -5.633 10.936 -3.106 1.00 0.00 C ATOM 961 SD MET A 61 -6.474 12.533 -3.105 1.00 0.00 S ATOM 962 CE MET A 61 -7.291 12.431 -1.494 1.00 0.00 C ATOM 0 H MET A 61 -2.984 10.667 -3.979 1.00 0.00 H new ATOM 0 HA MET A 61 -3.728 12.783 -2.186 1.00 0.00 H new ATOM 0 HB2 MET A 61 -4.151 9.768 -2.085 1.00 0.00 H new ATOM 0 HB3 MET A 61 -4.959 10.945 -1.069 1.00 0.00 H new ATOM 0 HG2 MET A 61 -5.201 10.769 -4.093 1.00 0.00 H new ATOM 0 HG3 MET A 61 -6.373 10.152 -2.945 1.00 0.00 H new ATOM 0 HE1 MET A 61 -8.014 13.242 -1.401 1.00 0.00 H new ATOM 0 HE2 MET A 61 -7.806 11.474 -1.407 1.00 0.00 H new ATOM 0 HE3 MET A 61 -6.546 12.516 -0.702 1.00 0.00 H new ATOM 972 N LEU A 62 -1.631 10.346 -1.279 1.00 0.00 N ATOM 973 CA LEU A 62 -0.732 9.833 -0.262 1.00 0.00 C ATOM 974 C LEU A 62 0.444 10.785 -0.087 1.00 0.00 C ATOM 975 O LEU A 62 0.876 11.050 1.041 1.00 0.00 O ATOM 976 CB LEU A 62 -0.253 8.438 -0.702 1.00 0.00 C ATOM 977 CG LEU A 62 -1.379 7.434 -0.985 1.00 0.00 C ATOM 978 CD1 LEU A 62 -0.815 6.172 -1.622 1.00 0.00 C ATOM 979 CD2 LEU A 62 -2.168 7.070 0.275 1.00 0.00 C ATOM 0 H LEU A 62 -1.687 9.746 -2.102 1.00 0.00 H new ATOM 0 HA LEU A 62 -1.243 9.753 0.698 1.00 0.00 H new ATOM 0 HB2 LEU A 62 0.355 8.544 -1.600 1.00 0.00 H new ATOM 0 HB3 LEU A 62 0.394 8.029 0.074 1.00 0.00 H new ATOM 0 HG LEU A 62 -2.069 7.918 -1.676 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -1.625 5.469 -1.817 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -0.322 6.427 -2.560 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -0.093 5.715 -0.946 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -2.952 6.357 0.020 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -1.497 6.624 1.008 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -2.618 7.970 0.695 1.00 0.00 H new ATOM 991 N ASP A 63 0.916 11.306 -1.215 1.00 0.00 N ATOM 992 CA ASP A 63 2.136 12.078 -1.354 1.00 0.00 C ATOM 993 C ASP A 63 1.819 13.452 -1.956 1.00 0.00 C ATOM 994 O ASP A 63 1.565 13.541 -3.160 1.00 0.00 O ATOM 995 CB ASP A 63 3.143 11.291 -2.188 1.00 0.00 C ATOM 996 CG ASP A 63 4.514 11.951 -2.165 1.00 0.00 C ATOM 997 OD1 ASP A 63 4.628 13.192 -2.079 1.00 0.00 O ATOM 998 OD2 ASP A 63 5.499 11.196 -2.272 1.00 0.00 O ATOM 0 H ASP A 63 0.427 11.192 -2.103 1.00 0.00 H new ATOM 0 HA ASP A 63 2.586 12.254 -0.377 1.00 0.00 H new ATOM 0 HB2 ASP A 63 3.220 10.274 -1.805 1.00 0.00 H new ATOM 0 HB3 ASP A 63 2.789 11.218 -3.216 1.00 0.00 H new ATOM 1003 N PRO A 64 1.766 14.522 -1.138 1.00 0.00 N ATOM 1004 CA PRO A 64 1.451 15.863 -1.614 1.00 0.00 C ATOM 1005 C PRO A 64 2.606 16.529 -2.351 1.00 0.00 C ATOM 1006 O PRO A 64 2.370 17.408 -3.181 1.00 0.00 O ATOM 1007 CB PRO A 64 1.156 16.680 -0.358 1.00 0.00 C ATOM 1008 CG PRO A 64 1.973 15.989 0.730 1.00 0.00 C ATOM 1009 CD PRO A 64 1.984 14.526 0.303 1.00 0.00 C ATOM 0 HA PRO A 64 0.622 15.808 -2.320 1.00 0.00 H new ATOM 0 HB2 PRO A 64 1.453 17.722 -0.480 1.00 0.00 H new ATOM 0 HB3 PRO A 64 0.092 16.678 -0.121 1.00 0.00 H new ATOM 0 HG2 PRO A 64 2.983 16.395 0.791 1.00 0.00 H new ATOM 0 HG3 PRO A 64 1.519 16.115 1.713 1.00 0.00 H new ATOM 0 HD2 PRO A 64 2.934 14.054 0.554 1.00 0.00 H new ATOM 0 HD3 PRO A 64 1.203 13.965 0.816 1.00 0.00 H new ATOM 1017 N GLU A 65 3.844 16.177 -2.007 1.00 0.00 N ATOM 1018 CA GLU A 65 5.023 16.647 -2.722 1.00 0.00 C ATOM 1019 C GLU A 65 5.081 15.983 -4.104 1.00 0.00 C ATOM 1020 O GLU A 65 5.655 16.542 -5.040 1.00 0.00 O ATOM 1021 CB GLU A 65 6.298 16.434 -1.884 1.00 0.00 C ATOM 1022 CG GLU A 65 6.155 17.217 -0.566 1.00 0.00 C ATOM 1023 CD GLU A 65 7.458 17.484 0.192 1.00 0.00 C ATOM 1024 OE1 GLU A 65 8.288 18.272 -0.316 1.00 0.00 O ATOM 1025 OE2 GLU A 65 7.562 17.121 1.387 1.00 0.00 O ATOM 0 H GLU A 65 4.055 15.558 -1.224 1.00 0.00 H new ATOM 0 HA GLU A 65 4.955 17.723 -2.883 1.00 0.00 H new ATOM 0 HB2 GLU A 65 6.444 15.373 -1.680 1.00 0.00 H new ATOM 0 HB3 GLU A 65 7.174 16.776 -2.434 1.00 0.00 H new ATOM 0 HG2 GLU A 65 5.680 18.174 -0.783 1.00 0.00 H new ATOM 0 HG3 GLU A 65 5.480 16.667 0.090 1.00 0.00 H new ATOM 1032 N GLY A 66 4.407 14.842 -4.259 1.00 0.00 N ATOM 1033 CA GLY A 66 4.205 14.116 -5.489 1.00 0.00 C ATOM 1034 C GLY A 66 5.358 13.175 -5.824 1.00 0.00 C ATOM 1035 O GLY A 66 5.454 12.787 -6.989 1.00 0.00 O ATOM 0 H GLY A 66 3.962 14.379 -3.467 1.00 0.00 H new ATOM 0 HA2 GLY A 66 3.283 13.540 -5.417 1.00 0.00 H new ATOM 0 HA3 GLY A 66 4.074 14.826 -6.306 1.00 0.00 H new ATOM 1039 N ASN A 67 6.219 12.829 -4.859 1.00 0.00 N ATOM 1040 CA ASN A 67 7.404 11.981 -5.052 1.00 0.00 C ATOM 1041 C ASN A 67 7.020 10.555 -5.440 1.00 0.00 C ATOM 1042 O ASN A 67 7.592 9.985 -6.367 1.00 0.00 O ATOM 1043 CB ASN A 67 8.257 11.951 -3.770 1.00 0.00 C ATOM 1044 CG ASN A 67 9.348 13.000 -3.797 1.00 0.00 C ATOM 1045 OD1 ASN A 67 10.474 12.759 -4.211 1.00 0.00 O ATOM 1046 ND2 ASN A 67 9.036 14.215 -3.377 1.00 0.00 N ATOM 0 H ASN A 67 6.108 13.140 -3.894 1.00 0.00 H new ATOM 0 HA ASN A 67 7.983 12.414 -5.868 1.00 0.00 H new ATOM 0 HB2 ASN A 67 7.617 12.115 -2.903 1.00 0.00 H new ATOM 0 HB3 ASN A 67 8.704 10.964 -3.654 1.00 0.00 H new ATOM 0 HD21 ASN A 67 9.736 14.957 -3.397 1.00 0.00 H new ATOM 0 HD22 ASN A 67 8.096 14.410 -3.033 1.00 0.00 H new ATOM 1053 N LEU A 68 6.083 9.950 -4.712 1.00 0.00 N ATOM 1054 CA LEU A 68 5.585 8.604 -4.956 1.00 0.00 C ATOM 1055 C LEU A 68 4.906 8.563 -6.329 1.00 0.00 C ATOM 1056 O LEU A 68 3.888 9.230 -6.531 1.00 0.00 O ATOM 1057 CB LEU A 68 4.625 8.219 -3.817 1.00 0.00 C ATOM 1058 CG LEU A 68 4.089 6.779 -3.895 1.00 0.00 C ATOM 1059 CD1 LEU A 68 5.207 5.734 -3.871 1.00 0.00 C ATOM 1060 CD2 LEU A 68 3.136 6.531 -2.719 1.00 0.00 C ATOM 0 H LEU A 68 5.638 10.400 -3.912 1.00 0.00 H new ATOM 0 HA LEU A 68 6.398 7.878 -4.969 1.00 0.00 H new ATOM 0 HB2 LEU A 68 5.139 8.351 -2.865 1.00 0.00 H new ATOM 0 HB3 LEU A 68 3.781 8.908 -3.822 1.00 0.00 H new ATOM 0 HG LEU A 68 3.567 6.675 -4.846 1.00 0.00 H new ATOM 0 HD11 LEU A 68 4.773 4.736 -3.928 1.00 0.00 H new ATOM 0 HD12 LEU A 68 5.870 5.891 -4.722 1.00 0.00 H new ATOM 0 HD13 LEU A 68 5.775 5.830 -2.946 1.00 0.00 H new ATOM 0 HD21 LEU A 68 2.753 5.512 -2.770 1.00 0.00 H new ATOM 0 HD22 LEU A 68 3.672 6.671 -1.780 1.00 0.00 H new ATOM 0 HD23 LEU A 68 2.304 7.234 -2.770 1.00 0.00 H new ATOM 1072 N HIS A 69 5.476 7.824 -7.279 1.00 0.00 N ATOM 1073 CA HIS A 69 5.062 7.765 -8.680 1.00 0.00 C ATOM 1074 C HIS A 69 4.717 6.324 -9.078 1.00 0.00 C ATOM 1075 O HIS A 69 4.990 5.399 -8.323 1.00 0.00 O ATOM 1076 CB HIS A 69 6.221 8.278 -9.533 1.00 0.00 C ATOM 1077 CG HIS A 69 6.514 9.754 -9.484 1.00 0.00 C ATOM 1078 ND1 HIS A 69 5.600 10.766 -9.658 1.00 0.00 N ATOM 1079 CD2 HIS A 69 7.760 10.321 -9.453 1.00 0.00 C ATOM 1080 CE1 HIS A 69 6.283 11.909 -9.789 1.00 0.00 C ATOM 1081 NE2 HIS A 69 7.603 11.689 -9.706 1.00 0.00 N ATOM 0 H HIS A 69 6.276 7.222 -7.084 1.00 0.00 H new ATOM 0 HA HIS A 69 4.173 8.377 -8.833 1.00 0.00 H new ATOM 0 HB2 HIS A 69 7.123 7.745 -9.232 1.00 0.00 H new ATOM 0 HB3 HIS A 69 6.022 8.008 -10.570 1.00 0.00 H new ATOM 0 HD2 HIS A 69 8.692 9.808 -9.268 1.00 0.00 H new ATOM 0 HE1 HIS A 69 5.832 12.878 -9.941 1.00 0.00 H new ATOM 0 HE2 HIS A 69 8.345 12.381 -9.807 1.00 0.00 H new ATOM 1089 N HIS A 70 4.130 6.136 -10.263 1.00 0.00 N ATOM 1090 CA HIS A 70 3.597 4.868 -10.780 1.00 0.00 C ATOM 1091 C HIS A 70 4.730 4.004 -11.330 1.00 0.00 C ATOM 1092 O HIS A 70 4.874 3.800 -12.538 1.00 0.00 O ATOM 1093 CB HIS A 70 2.508 5.173 -11.813 1.00 0.00 C ATOM 1094 CG HIS A 70 1.790 4.026 -12.499 1.00 0.00 C ATOM 1095 ND1 HIS A 70 1.035 4.129 -13.652 1.00 0.00 N ATOM 1096 CD2 HIS A 70 1.823 2.701 -12.159 1.00 0.00 C ATOM 1097 CE1 HIS A 70 0.623 2.894 -13.993 1.00 0.00 C ATOM 1098 NE2 HIS A 70 1.096 1.993 -13.121 1.00 0.00 N ATOM 0 H HIS A 70 4.006 6.903 -10.924 1.00 0.00 H new ATOM 0 HA HIS A 70 3.136 4.287 -9.981 1.00 0.00 H new ATOM 0 HB2 HIS A 70 1.752 5.784 -11.320 1.00 0.00 H new ATOM 0 HB3 HIS A 70 2.959 5.789 -12.591 1.00 0.00 H new ATOM 0 HD2 HIS A 70 2.322 2.277 -11.300 1.00 0.00 H new ATOM 0 HE1 HIS A 70 0.002 2.663 -14.845 1.00 0.00 H new ATOM 0 HE2 HIS A 70 0.953 0.984 -13.153 1.00 0.00 H new ATOM 1106 N GLY A 71 5.513 3.496 -10.393 1.00 0.00 N ATOM 1107 CA GLY A 71 6.631 2.583 -10.581 1.00 0.00 C ATOM 1108 C GLY A 71 7.969 3.189 -10.165 1.00 0.00 C ATOM 1109 O GLY A 71 8.995 2.511 -10.247 1.00 0.00 O ATOM 0 H GLY A 71 5.375 3.727 -9.409 1.00 0.00 H new ATOM 0 HA2 GLY A 71 6.454 1.676 -10.004 1.00 0.00 H new ATOM 0 HA3 GLY A 71 6.681 2.289 -11.629 1.00 0.00 H new ATOM 1113 N ASN A 72 7.978 4.448 -9.716 1.00 0.00 N ATOM 1114 CA ASN A 72 9.180 5.181 -9.343 1.00 0.00 C ATOM 1115 C ASN A 72 9.021 5.725 -7.927 1.00 0.00 C ATOM 1116 O ASN A 72 8.771 6.911 -7.723 1.00 0.00 O ATOM 1117 CB ASN A 72 9.477 6.299 -10.353 1.00 0.00 C ATOM 1118 CG ASN A 72 10.805 6.979 -10.054 1.00 0.00 C ATOM 1119 OD1 ASN A 72 11.599 6.539 -9.222 1.00 0.00 O ATOM 1120 ND2 ASN A 72 11.057 8.116 -10.673 1.00 0.00 N ATOM 0 H ASN A 72 7.125 4.995 -9.601 1.00 0.00 H new ATOM 0 HA ASN A 72 10.035 4.505 -9.360 1.00 0.00 H new ATOM 0 HB2 ASN A 72 9.497 5.885 -11.361 1.00 0.00 H new ATOM 0 HB3 ASN A 72 8.675 7.037 -10.328 1.00 0.00 H new ATOM 0 HD21 ASN A 72 11.911 8.633 -10.463 1.00 0.00 H new ATOM 0 HD22 ASN A 72 10.398 8.479 -11.362 1.00 0.00 H new ATOM 1127 N ALA A 73 9.141 4.851 -6.933 1.00 0.00 N ATOM 1128 CA ALA A 73 8.991 5.185 -5.524 1.00 0.00 C ATOM 1129 C ALA A 73 10.357 5.454 -4.878 1.00 0.00 C ATOM 1130 O ALA A 73 10.503 5.271 -3.673 1.00 0.00 O ATOM 1131 CB ALA A 73 8.263 4.028 -4.832 1.00 0.00 C ATOM 0 H ALA A 73 9.351 3.865 -7.091 1.00 0.00 H new ATOM 0 HA ALA A 73 8.406 6.099 -5.416 1.00 0.00 H new ATOM 0 HB1 ALA A 73 8.139 4.257 -3.774 1.00 0.00 H new ATOM 0 HB2 ALA A 73 7.284 3.889 -5.290 1.00 0.00 H new ATOM 0 HB3 ALA A 73 8.847 3.114 -4.940 1.00 0.00 H new ATOM 1137 N MET A 74 11.389 5.808 -5.651 1.00 0.00 N ATOM 1138 CA MET A 74 12.775 5.723 -5.218 1.00 0.00 C ATOM 1139 C MET A 74 13.240 6.969 -4.472 1.00 0.00 C ATOM 1140 O MET A 74 13.998 6.856 -3.510 1.00 0.00 O ATOM 1141 CB MET A 74 13.665 5.504 -6.440 1.00 0.00 C ATOM 1142 CG MET A 74 13.546 4.082 -6.983 1.00 0.00 C ATOM 1143 SD MET A 74 14.742 3.743 -8.295 1.00 0.00 S ATOM 1144 CE MET A 74 14.535 1.947 -8.399 1.00 0.00 C ATOM 0 H MET A 74 11.278 6.163 -6.601 1.00 0.00 H new ATOM 0 HA MET A 74 12.850 4.887 -4.523 1.00 0.00 H new ATOM 0 HB2 MET A 74 13.392 6.215 -7.220 1.00 0.00 H new ATOM 0 HB3 MET A 74 14.703 5.706 -6.174 1.00 0.00 H new ATOM 0 HG2 MET A 74 13.693 3.372 -6.169 1.00 0.00 H new ATOM 0 HG3 MET A 74 12.537 3.925 -7.365 1.00 0.00 H new ATOM 0 HE1 MET A 74 15.199 1.548 -9.165 1.00 0.00 H new ATOM 0 HE2 MET A 74 14.779 1.496 -7.437 1.00 0.00 H new ATOM 0 HE3 MET A 74 13.502 1.714 -8.657 1.00 0.00 H new ATOM 1154 N GLU A 75 12.825 8.161 -4.899 1.00 0.00 N ATOM 1155 CA GLU A 75 13.089 9.375 -4.137 1.00 0.00 C ATOM 1156 C GLU A 75 12.275 9.341 -2.843 1.00 0.00 C ATOM 1157 O GLU A 75 12.804 9.691 -1.791 1.00 0.00 O ATOM 1158 CB GLU A 75 12.776 10.634 -4.958 1.00 0.00 C ATOM 1159 CG GLU A 75 13.845 10.962 -6.010 1.00 0.00 C ATOM 1160 CD GLU A 75 13.690 12.379 -6.577 1.00 0.00 C ATOM 1161 OE1 GLU A 75 14.286 13.320 -5.998 1.00 0.00 O ATOM 1162 OE2 GLU A 75 13.015 12.542 -7.625 1.00 0.00 O ATOM 0 H GLU A 75 12.307 8.309 -5.765 1.00 0.00 H new ATOM 0 HA GLU A 75 14.150 9.416 -3.892 1.00 0.00 H new ATOM 0 HB2 GLU A 75 11.815 10.503 -5.456 1.00 0.00 H new ATOM 0 HB3 GLU A 75 12.671 11.482 -4.282 1.00 0.00 H new ATOM 0 HG2 GLU A 75 14.834 10.858 -5.564 1.00 0.00 H new ATOM 0 HG3 GLU A 75 13.785 10.239 -6.824 1.00 0.00 H new ATOM 1169 N PHE A 76 11.035 8.841 -2.893 1.00 0.00 N ATOM 1170 CA PHE A 76 10.233 8.522 -1.732 1.00 0.00 C ATOM 1171 C PHE A 76 10.999 7.543 -0.843 1.00 0.00 C ATOM 1172 O PHE A 76 11.212 7.840 0.325 1.00 0.00 O ATOM 1173 CB PHE A 76 8.885 7.991 -2.225 1.00 0.00 C ATOM 1174 CG PHE A 76 8.008 7.348 -1.177 1.00 0.00 C ATOM 1175 CD1 PHE A 76 7.400 8.134 -0.194 1.00 0.00 C ATOM 1176 CD2 PHE A 76 7.776 5.967 -1.211 1.00 0.00 C ATOM 1177 CE1 PHE A 76 6.512 7.549 0.727 1.00 0.00 C ATOM 1178 CE2 PHE A 76 6.844 5.380 -0.334 1.00 0.00 C ATOM 1179 CZ PHE A 76 6.207 6.179 0.632 1.00 0.00 C ATOM 0 H PHE A 76 10.558 8.646 -3.773 1.00 0.00 H new ATOM 0 HA PHE A 76 10.034 9.397 -1.113 1.00 0.00 H new ATOM 0 HB2 PHE A 76 8.334 8.816 -2.676 1.00 0.00 H new ATOM 0 HB3 PHE A 76 9.070 7.262 -3.014 1.00 0.00 H new ATOM 0 HD1 PHE A 76 7.612 9.192 -0.141 1.00 0.00 H new ATOM 0 HD2 PHE A 76 8.315 5.349 -1.914 1.00 0.00 H new ATOM 0 HE1 PHE A 76 6.065 8.150 1.505 1.00 0.00 H new ATOM 0 HE2 PHE A 76 6.620 4.326 -0.403 1.00 0.00 H new ATOM 0 HZ PHE A 76 5.482 5.740 1.302 1.00 0.00 H new ATOM 1189 N ALA A 77 11.507 6.431 -1.378 1.00 0.00 N ATOM 1190 CA ALA A 77 12.256 5.451 -0.601 1.00 0.00 C ATOM 1191 C ALA A 77 13.391 6.149 0.140 1.00 0.00 C ATOM 1192 O ALA A 77 13.483 6.093 1.376 1.00 0.00 O ATOM 1193 CB ALA A 77 12.817 4.332 -1.501 1.00 0.00 C ATOM 0 H ALA A 77 11.409 6.188 -2.364 1.00 0.00 H new ATOM 0 HA ALA A 77 11.578 4.990 0.118 1.00 0.00 H new ATOM 0 HB1 ALA A 77 13.370 3.618 -0.891 1.00 0.00 H new ATOM 0 HB2 ALA A 77 11.995 3.821 -2.002 1.00 0.00 H new ATOM 0 HB3 ALA A 77 13.483 4.765 -2.247 1.00 0.00 H new ATOM 1199 N LYS A 78 14.219 6.890 -0.607 1.00 0.00 N ATOM 1200 CA LYS A 78 15.345 7.588 -0.016 1.00 0.00 C ATOM 1201 C LYS A 78 14.876 8.609 1.001 1.00 0.00 C ATOM 1202 O LYS A 78 15.585 8.787 1.996 1.00 0.00 O ATOM 1203 CB LYS A 78 16.246 8.222 -1.076 1.00 0.00 C ATOM 1204 CG LYS A 78 17.173 7.188 -1.733 1.00 0.00 C ATOM 1205 CD LYS A 78 18.430 7.803 -2.367 1.00 0.00 C ATOM 1206 CE LYS A 78 19.406 8.375 -1.321 1.00 0.00 C ATOM 1207 NZ LYS A 78 19.221 9.822 -1.070 1.00 0.00 N ATOM 0 H LYS A 78 14.123 7.015 -1.615 1.00 0.00 H new ATOM 0 HA LYS A 78 15.950 6.848 0.508 1.00 0.00 H new ATOM 0 HB2 LYS A 78 15.630 8.695 -1.841 1.00 0.00 H new ATOM 0 HB3 LYS A 78 16.846 9.009 -0.619 1.00 0.00 H new ATOM 0 HG2 LYS A 78 17.475 6.456 -0.984 1.00 0.00 H new ATOM 0 HG3 LYS A 78 16.616 6.649 -2.500 1.00 0.00 H new ATOM 0 HD2 LYS A 78 18.942 7.044 -2.958 1.00 0.00 H new ATOM 0 HD3 LYS A 78 18.134 8.596 -3.054 1.00 0.00 H new ATOM 0 HE2 LYS A 78 19.280 7.833 -0.384 1.00 0.00 H new ATOM 0 HE3 LYS A 78 20.428 8.200 -1.656 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 20.061 10.341 -1.396 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 18.384 10.160 -1.587 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 19.088 9.983 -0.051 1.00 0.00 H new ATOM 1221 N LYS A 79 13.699 9.220 0.842 1.00 0.00 N ATOM 1222 CA LYS A 79 13.161 10.102 1.863 1.00 0.00 C ATOM 1223 C LYS A 79 13.088 9.425 3.211 1.00 0.00 C ATOM 1224 O LYS A 79 13.500 10.035 4.200 1.00 0.00 O ATOM 1225 CB LYS A 79 11.843 10.778 1.480 1.00 0.00 C ATOM 1226 CG LYS A 79 12.182 12.006 0.623 1.00 0.00 C ATOM 1227 CD LYS A 79 11.827 13.348 1.274 1.00 0.00 C ATOM 1228 CE LYS A 79 12.513 13.422 2.647 1.00 0.00 C ATOM 1229 NZ LYS A 79 13.016 14.760 2.995 1.00 0.00 N ATOM 0 H LYS A 79 13.108 9.116 0.017 1.00 0.00 H new ATOM 0 HA LYS A 79 13.879 10.918 1.944 1.00 0.00 H new ATOM 0 HB2 LYS A 79 11.206 10.089 0.926 1.00 0.00 H new ATOM 0 HB3 LYS A 79 11.291 11.074 2.372 1.00 0.00 H new ATOM 0 HG2 LYS A 79 13.249 11.995 0.399 1.00 0.00 H new ATOM 0 HG3 LYS A 79 11.656 11.927 -0.328 1.00 0.00 H new ATOM 0 HD2 LYS A 79 12.155 14.174 0.642 1.00 0.00 H new ATOM 0 HD3 LYS A 79 10.747 13.441 1.385 1.00 0.00 H new ATOM 0 HE2 LYS A 79 11.806 13.101 3.412 1.00 0.00 H new ATOM 0 HE3 LYS A 79 13.344 12.717 2.665 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 13.464 14.729 3.933 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 13.715 15.063 2.287 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 12.225 15.435 3.011 1.00 0.00 H new ATOM 1243 N HIS A 80 12.668 8.165 3.277 1.00 0.00 N ATOM 1244 CA HIS A 80 12.458 7.521 4.566 1.00 0.00 C ATOM 1245 C HIS A 80 13.722 6.803 5.038 1.00 0.00 C ATOM 1246 O HIS A 80 13.762 6.313 6.171 1.00 0.00 O ATOM 1247 CB HIS A 80 11.209 6.654 4.477 1.00 0.00 C ATOM 1248 CG HIS A 80 10.048 7.496 4.008 1.00 0.00 C ATOM 1249 ND1 HIS A 80 9.396 8.491 4.709 1.00 0.00 N ATOM 1250 CD2 HIS A 80 9.594 7.539 2.723 1.00 0.00 C ATOM 1251 CE1 HIS A 80 8.555 9.106 3.858 1.00 0.00 C ATOM 1252 NE2 HIS A 80 8.635 8.548 2.649 1.00 0.00 N ATOM 0 H HIS A 80 12.469 7.579 2.466 1.00 0.00 H new ATOM 0 HA HIS A 80 12.272 8.257 5.348 1.00 0.00 H new ATOM 0 HB2 HIS A 80 11.375 5.827 3.787 1.00 0.00 H new ATOM 0 HB3 HIS A 80 10.986 6.217 5.450 1.00 0.00 H new ATOM 0 HD2 HIS A 80 9.918 6.906 1.910 1.00 0.00 H new ATOM 0 HE1 HIS A 80 7.909 9.932 4.116 1.00 0.00 H new ATOM 0 HE2 HIS A 80 8.095 8.811 1.824 1.00 0.00 H new ATOM 1260 N GLY A 81 14.778 6.818 4.218 1.00 0.00 N ATOM 1261 CA GLY A 81 16.067 6.196 4.492 1.00 0.00 C ATOM 1262 C GLY A 81 16.383 5.026 3.569 1.00 0.00 C ATOM 1263 O GLY A 81 17.539 4.597 3.514 1.00 0.00 O ATOM 0 H GLY A 81 14.752 7.283 3.311 1.00 0.00 H new ATOM 0 HA2 GLY A 81 16.852 6.946 4.397 1.00 0.00 H new ATOM 0 HA3 GLY A 81 16.082 5.849 5.525 1.00 0.00 H new ATOM 1267 N ALA A 82 15.385 4.505 2.861 1.00 0.00 N ATOM 1268 CA ALA A 82 15.534 3.319 2.028 1.00 0.00 C ATOM 1269 C ALA A 82 16.323 3.688 0.766 1.00 0.00 C ATOM 1270 O ALA A 82 15.853 4.466 -0.056 1.00 0.00 O ATOM 1271 CB ALA A 82 14.157 2.714 1.724 1.00 0.00 C ATOM 0 H ALA A 82 14.444 4.898 2.850 1.00 0.00 H new ATOM 0 HA ALA A 82 16.100 2.549 2.552 1.00 0.00 H new ATOM 0 HB1 ALA A 82 14.278 1.828 1.101 1.00 0.00 H new ATOM 0 HB2 ALA A 82 13.667 2.437 2.657 1.00 0.00 H new ATOM 0 HB3 ALA A 82 13.546 3.447 1.197 1.00 0.00 H new ATOM 1277 N ASP A 83 17.547 3.180 0.617 1.00 0.00 N ATOM 1278 CA ASP A 83 18.364 3.394 -0.565 1.00 0.00 C ATOM 1279 C ASP A 83 17.826 2.672 -1.806 1.00 0.00 C ATOM 1280 O ASP A 83 16.828 1.955 -1.761 1.00 0.00 O ATOM 1281 CB ASP A 83 19.808 2.994 -0.324 1.00 0.00 C ATOM 1282 CG ASP A 83 20.480 3.467 0.957 1.00 0.00 C ATOM 1283 OD1 ASP A 83 20.553 4.698 1.193 1.00 0.00 O ATOM 1284 OD2 ASP A 83 21.033 2.603 1.676 1.00 0.00 O ATOM 0 H ASP A 83 17.999 2.602 1.326 1.00 0.00 H new ATOM 0 HA ASP A 83 18.318 4.465 -0.763 1.00 0.00 H new ATOM 0 HB2 ASP A 83 19.860 1.905 -0.345 1.00 0.00 H new ATOM 0 HB3 ASP A 83 20.399 3.358 -1.164 1.00 0.00 H new ATOM 1289 N GLU A 84 18.547 2.800 -2.922 1.00 0.00 N ATOM 1290 CA GLU A 84 18.203 2.195 -4.199 1.00 0.00 C ATOM 1291 C GLU A 84 18.067 0.687 -4.057 1.00 0.00 C ATOM 1292 O GLU A 84 17.058 0.140 -4.473 1.00 0.00 O ATOM 1293 CB GLU A 84 19.266 2.525 -5.254 1.00 0.00 C ATOM 1294 CG GLU A 84 19.617 4.015 -5.287 1.00 0.00 C ATOM 1295 CD GLU A 84 19.900 4.505 -6.707 1.00 0.00 C ATOM 1296 OE1 GLU A 84 21.043 4.366 -7.198 1.00 0.00 O ATOM 1297 OE2 GLU A 84 18.956 5.013 -7.358 1.00 0.00 O ATOM 0 H GLU A 84 19.409 3.344 -2.957 1.00 0.00 H new ATOM 0 HA GLU A 84 17.246 2.605 -4.522 1.00 0.00 H new ATOM 0 HB2 GLU A 84 20.167 1.947 -5.050 1.00 0.00 H new ATOM 0 HB3 GLU A 84 18.906 2.218 -6.236 1.00 0.00 H new ATOM 0 HG2 GLU A 84 18.795 4.591 -4.862 1.00 0.00 H new ATOM 0 HG3 GLU A 84 20.490 4.196 -4.660 1.00 0.00 H new ATOM 1304 N THR A 85 19.043 0.025 -3.431 1.00 0.00 N ATOM 1305 CA THR A 85 18.964 -1.412 -3.175 1.00 0.00 C ATOM 1306 C THR A 85 17.712 -1.764 -2.376 1.00 0.00 C ATOM 1307 O THR A 85 17.087 -2.782 -2.644 1.00 0.00 O ATOM 1308 CB THR A 85 20.205 -1.914 -2.410 1.00 0.00 C ATOM 1309 OG1 THR A 85 21.380 -1.773 -3.190 1.00 0.00 O ATOM 1310 CG2 THR A 85 20.115 -3.363 -1.928 1.00 0.00 C ATOM 0 H THR A 85 19.899 0.464 -3.092 1.00 0.00 H new ATOM 0 HA THR A 85 18.919 -1.903 -4.147 1.00 0.00 H new ATOM 0 HB THR A 85 20.247 -1.281 -1.524 1.00 0.00 H new ATOM 0 HG1 THR A 85 22.152 -2.097 -2.680 1.00 0.00 H new ATOM 0 HG21 THR A 85 21.031 -3.629 -1.401 1.00 0.00 H new ATOM 0 HG22 THR A 85 19.265 -3.470 -1.254 1.00 0.00 H new ATOM 0 HG23 THR A 85 19.984 -4.024 -2.785 1.00 0.00 H new ATOM 1318 N MET A 86 17.377 -0.975 -1.358 1.00 0.00 N ATOM 1319 CA MET A 86 16.280 -1.259 -0.455 1.00 0.00 C ATOM 1320 C MET A 86 14.962 -1.174 -1.220 1.00 0.00 C ATOM 1321 O MET A 86 14.168 -2.104 -1.115 1.00 0.00 O ATOM 1322 CB MET A 86 16.383 -0.257 0.700 1.00 0.00 C ATOM 1323 CG MET A 86 17.489 -0.636 1.687 1.00 0.00 C ATOM 1324 SD MET A 86 17.905 0.714 2.815 1.00 0.00 S ATOM 1325 CE MET A 86 19.222 -0.045 3.786 1.00 0.00 C ATOM 0 H MET A 86 17.871 -0.110 -1.140 1.00 0.00 H new ATOM 0 HA MET A 86 16.324 -2.267 -0.042 1.00 0.00 H new ATOM 0 HB2 MET A 86 16.578 0.738 0.301 1.00 0.00 H new ATOM 0 HB3 MET A 86 15.429 -0.209 1.225 1.00 0.00 H new ATOM 0 HG2 MET A 86 17.173 -1.504 2.266 1.00 0.00 H new ATOM 0 HG3 MET A 86 18.381 -0.930 1.133 1.00 0.00 H new ATOM 0 HE1 MET A 86 19.584 0.667 4.528 1.00 0.00 H new ATOM 0 HE2 MET A 86 18.837 -0.931 4.291 1.00 0.00 H new ATOM 0 HE3 MET A 86 20.042 -0.330 3.127 1.00 0.00 H new ATOM 1335 N ALA A 87 14.761 -0.142 -2.043 1.00 0.00 N ATOM 1336 CA ALA A 87 13.626 -0.117 -2.954 1.00 0.00 C ATOM 1337 C ALA A 87 13.703 -1.317 -3.904 1.00 0.00 C ATOM 1338 O ALA A 87 12.760 -2.086 -4.012 1.00 0.00 O ATOM 1339 CB ALA A 87 13.588 1.215 -3.711 1.00 0.00 C ATOM 0 H ALA A 87 15.366 0.678 -2.094 1.00 0.00 H new ATOM 0 HA ALA A 87 12.696 -0.197 -2.391 1.00 0.00 H new ATOM 0 HB1 ALA A 87 12.735 1.223 -4.390 1.00 0.00 H new ATOM 0 HB2 ALA A 87 13.494 2.035 -2.999 1.00 0.00 H new ATOM 0 HB3 ALA A 87 14.508 1.335 -4.283 1.00 0.00 H new ATOM 1345 N GLN A 88 14.828 -1.516 -4.591 1.00 0.00 N ATOM 1346 CA GLN A 88 14.960 -2.489 -5.669 1.00 0.00 C ATOM 1347 C GLN A 88 14.790 -3.938 -5.189 1.00 0.00 C ATOM 1348 O GLN A 88 14.417 -4.808 -5.977 1.00 0.00 O ATOM 1349 CB GLN A 88 16.327 -2.276 -6.342 1.00 0.00 C ATOM 1350 CG GLN A 88 16.434 -2.927 -7.720 1.00 0.00 C ATOM 1351 CD GLN A 88 15.419 -2.361 -8.717 1.00 0.00 C ATOM 1352 OE1 GLN A 88 15.429 -1.169 -9.030 1.00 0.00 O ATOM 1353 NE2 GLN A 88 14.517 -3.193 -9.210 1.00 0.00 N ATOM 0 H GLN A 88 15.686 -0.995 -4.409 1.00 0.00 H new ATOM 0 HA GLN A 88 14.156 -2.328 -6.387 1.00 0.00 H new ATOM 0 HB2 GLN A 88 16.513 -1.206 -6.438 1.00 0.00 H new ATOM 0 HB3 GLN A 88 17.108 -2.679 -5.697 1.00 0.00 H new ATOM 0 HG2 GLN A 88 17.441 -2.781 -8.110 1.00 0.00 H new ATOM 0 HG3 GLN A 88 16.282 -4.002 -7.623 1.00 0.00 H new ATOM 0 HE21 GLN A 88 14.527 -4.176 -8.937 1.00 0.00 H new ATOM 0 HE22 GLN A 88 13.811 -2.852 -9.863 1.00 0.00 H new ATOM 1362 N GLN A 89 15.071 -4.210 -3.916 1.00 0.00 N ATOM 1363 CA GLN A 89 14.701 -5.421 -3.202 1.00 0.00 C ATOM 1364 C GLN A 89 13.181 -5.553 -3.190 1.00 0.00 C ATOM 1365 O GLN A 89 12.645 -6.559 -3.649 1.00 0.00 O ATOM 1366 CB GLN A 89 15.281 -5.362 -1.769 1.00 0.00 C ATOM 1367 CG GLN A 89 16.668 -6.008 -1.680 1.00 0.00 C ATOM 1368 CD GLN A 89 16.623 -7.536 -1.664 1.00 0.00 C ATOM 1369 OE1 GLN A 89 15.580 -8.162 -1.818 1.00 0.00 O ATOM 1370 NE2 GLN A 89 17.746 -8.190 -1.427 1.00 0.00 N ATOM 0 H GLN A 89 15.589 -3.556 -3.329 1.00 0.00 H new ATOM 0 HA GLN A 89 15.112 -6.300 -3.698 1.00 0.00 H new ATOM 0 HB2 GLN A 89 15.345 -4.323 -1.447 1.00 0.00 H new ATOM 0 HB3 GLN A 89 14.602 -5.867 -1.083 1.00 0.00 H new ATOM 0 HG2 GLN A 89 17.270 -5.678 -2.527 1.00 0.00 H new ATOM 0 HG3 GLN A 89 17.168 -5.657 -0.777 1.00 0.00 H new ATOM 0 HE21 GLN A 89 18.618 -7.676 -1.298 1.00 0.00 H new ATOM 0 HE22 GLN A 89 17.741 -9.209 -1.373 1.00 0.00 H new ATOM 1379 N LEU A 90 12.491 -4.544 -2.662 1.00 0.00 N ATOM 1380 CA LEU A 90 11.047 -4.552 -2.490 1.00 0.00 C ATOM 1381 C LEU A 90 10.303 -4.616 -3.818 1.00 0.00 C ATOM 1382 O LEU A 90 9.338 -5.361 -3.906 1.00 0.00 O ATOM 1383 CB LEU A 90 10.619 -3.305 -1.710 1.00 0.00 C ATOM 1384 CG LEU A 90 11.098 -3.273 -0.248 1.00 0.00 C ATOM 1385 CD1 LEU A 90 10.682 -1.935 0.374 1.00 0.00 C ATOM 1386 CD2 LEU A 90 10.581 -4.434 0.621 1.00 0.00 C ATOM 0 H LEU A 90 12.932 -3.684 -2.337 1.00 0.00 H new ATOM 0 HA LEU A 90 10.786 -5.452 -1.933 1.00 0.00 H new ATOM 0 HB2 LEU A 90 11.000 -2.422 -2.223 1.00 0.00 H new ATOM 0 HB3 LEU A 90 9.531 -3.238 -1.725 1.00 0.00 H new ATOM 0 HG LEU A 90 12.182 -3.388 -0.272 1.00 0.00 H new ATOM 0 HD11 LEU A 90 11.015 -1.897 1.411 1.00 0.00 H new ATOM 0 HD12 LEU A 90 11.138 -1.117 -0.184 1.00 0.00 H new ATOM 0 HD13 LEU A 90 9.597 -1.838 0.337 1.00 0.00 H new ATOM 0 HD21 LEU A 90 10.968 -4.330 1.635 1.00 0.00 H new ATOM 0 HD22 LEU A 90 9.491 -4.413 0.645 1.00 0.00 H new ATOM 0 HD23 LEU A 90 10.917 -5.381 0.199 1.00 0.00 H new ATOM 1398 N ILE A 91 10.755 -3.890 -4.834 1.00 0.00 N ATOM 1399 CA ILE A 91 10.187 -3.895 -6.177 1.00 0.00 C ATOM 1400 C ILE A 91 10.209 -5.323 -6.742 1.00 0.00 C ATOM 1401 O ILE A 91 9.217 -5.822 -7.276 1.00 0.00 O ATOM 1402 CB ILE A 91 10.985 -2.861 -7.008 1.00 0.00 C ATOM 1403 CG1 ILE A 91 10.494 -1.430 -6.679 1.00 0.00 C ATOM 1404 CG2 ILE A 91 10.925 -3.106 -8.521 1.00 0.00 C ATOM 1405 CD1 ILE A 91 11.597 -0.376 -6.713 1.00 0.00 C ATOM 0 H ILE A 91 11.553 -3.261 -4.743 1.00 0.00 H new ATOM 0 HA ILE A 91 9.138 -3.600 -6.196 1.00 0.00 H new ATOM 0 HB ILE A 91 12.031 -2.977 -6.724 1.00 0.00 H new ATOM 0 HG12 ILE A 91 9.716 -1.151 -7.389 1.00 0.00 H new ATOM 0 HG13 ILE A 91 10.037 -1.432 -5.690 1.00 0.00 H new ATOM 0 HG21 ILE A 91 11.507 -2.342 -9.037 1.00 0.00 H new ATOM 0 HG22 ILE A 91 11.336 -4.090 -8.747 1.00 0.00 H new ATOM 0 HG23 ILE A 91 9.889 -3.060 -8.856 1.00 0.00 H new ATOM 0 HD11 ILE A 91 11.175 0.600 -6.472 1.00 0.00 H new ATOM 0 HD12 ILE A 91 12.365 -0.630 -5.982 1.00 0.00 H new ATOM 0 HD13 ILE A 91 12.039 -0.344 -7.709 1.00 0.00 H new ATOM 1417 N ASP A 92 11.341 -6.019 -6.589 1.00 0.00 N ATOM 1418 CA ASP A 92 11.478 -7.395 -7.058 1.00 0.00 C ATOM 1419 C ASP A 92 10.468 -8.291 -6.379 1.00 0.00 C ATOM 1420 O ASP A 92 9.819 -9.120 -7.014 1.00 0.00 O ATOM 1421 CB ASP A 92 12.863 -7.930 -6.704 1.00 0.00 C ATOM 1422 CG ASP A 92 13.218 -9.157 -7.537 1.00 0.00 C ATOM 1423 OD1 ASP A 92 13.633 -9.014 -8.705 1.00 0.00 O ATOM 1424 OD2 ASP A 92 13.093 -10.299 -7.036 1.00 0.00 O ATOM 0 H ASP A 92 12.178 -5.646 -6.141 1.00 0.00 H new ATOM 0 HA ASP A 92 11.322 -7.394 -8.137 1.00 0.00 H new ATOM 0 HB2 ASP A 92 13.608 -7.151 -6.867 1.00 0.00 H new ATOM 0 HB3 ASP A 92 12.896 -8.186 -5.645 1.00 0.00 H new ATOM 1429 N ILE A 93 10.381 -8.133 -5.067 1.00 0.00 N ATOM 1430 CA ILE A 93 9.398 -8.786 -4.230 1.00 0.00 C ATOM 1431 C ILE A 93 7.969 -8.482 -4.696 1.00 0.00 C ATOM 1432 O ILE A 93 7.195 -9.437 -4.754 1.00 0.00 O ATOM 1433 CB ILE A 93 9.672 -8.426 -2.755 1.00 0.00 C ATOM 1434 CG1 ILE A 93 10.978 -9.120 -2.315 1.00 0.00 C ATOM 1435 CG2 ILE A 93 8.492 -8.828 -1.870 1.00 0.00 C ATOM 1436 CD1 ILE A 93 11.386 -8.863 -0.860 1.00 0.00 C ATOM 0 H ILE A 93 11.014 -7.528 -4.544 1.00 0.00 H new ATOM 0 HA ILE A 93 9.490 -9.868 -4.320 1.00 0.00 H new ATOM 0 HB ILE A 93 9.789 -7.347 -2.650 1.00 0.00 H new ATOM 0 HG12 ILE A 93 10.869 -10.194 -2.462 1.00 0.00 H new ATOM 0 HG13 ILE A 93 11.786 -8.789 -2.968 1.00 0.00 H new ATOM 0 HG21 ILE A 93 8.708 -8.565 -0.834 1.00 0.00 H new ATOM 0 HG22 ILE A 93 7.595 -8.303 -2.199 1.00 0.00 H new ATOM 0 HG23 ILE A 93 8.331 -9.903 -1.945 1.00 0.00 H new ATOM 0 HD11 ILE A 93 12.315 -9.391 -0.644 1.00 0.00 H new ATOM 0 HD12 ILE A 93 11.533 -7.794 -0.707 1.00 0.00 H new ATOM 0 HD13 ILE A 93 10.601 -9.221 -0.193 1.00 0.00 H new ATOM 1448 N VAL A 94 7.593 -7.236 -5.021 1.00 0.00 N ATOM 1449 CA VAL A 94 6.220 -6.927 -5.433 1.00 0.00 C ATOM 1450 C VAL A 94 5.841 -7.843 -6.588 1.00 0.00 C ATOM 1451 O VAL A 94 4.816 -8.530 -6.503 1.00 0.00 O ATOM 1452 CB VAL A 94 5.985 -5.434 -5.784 1.00 0.00 C ATOM 1453 CG1 VAL A 94 4.623 -5.137 -6.463 1.00 0.00 C ATOM 1454 CG2 VAL A 94 5.994 -4.585 -4.509 1.00 0.00 C ATOM 0 H VAL A 94 8.219 -6.431 -5.006 1.00 0.00 H new ATOM 0 HA VAL A 94 5.569 -7.109 -4.578 1.00 0.00 H new ATOM 0 HB VAL A 94 6.791 -5.192 -6.477 1.00 0.00 H new ATOM 0 HG11 VAL A 94 4.546 -4.070 -6.672 1.00 0.00 H new ATOM 0 HG12 VAL A 94 4.552 -5.696 -7.396 1.00 0.00 H new ATOM 0 HG13 VAL A 94 3.812 -5.436 -5.799 1.00 0.00 H new ATOM 0 HG21 VAL A 94 5.828 -3.539 -4.767 1.00 0.00 H new ATOM 0 HG22 VAL A 94 5.202 -4.924 -3.841 1.00 0.00 H new ATOM 0 HG23 VAL A 94 6.958 -4.687 -4.011 1.00 0.00 H new ATOM 1464 N HIS A 95 6.667 -7.897 -7.634 1.00 0.00 N ATOM 1465 CA HIS A 95 6.328 -8.686 -8.805 1.00 0.00 C ATOM 1466 C HIS A 95 6.559 -10.169 -8.533 1.00 0.00 C ATOM 1467 O HIS A 95 5.779 -10.999 -8.985 1.00 0.00 O ATOM 1468 CB HIS A 95 7.103 -8.155 -10.006 1.00 0.00 C ATOM 1469 CG HIS A 95 6.806 -6.699 -10.286 1.00 0.00 C ATOM 1470 ND1 HIS A 95 7.678 -5.816 -10.869 1.00 0.00 N ATOM 1471 CD2 HIS A 95 5.667 -6.002 -9.964 1.00 0.00 C ATOM 1472 CE1 HIS A 95 7.066 -4.620 -10.920 1.00 0.00 C ATOM 1473 NE2 HIS A 95 5.819 -4.691 -10.425 1.00 0.00 N ATOM 0 H HIS A 95 7.561 -7.409 -7.689 1.00 0.00 H new ATOM 0 HA HIS A 95 5.268 -8.590 -9.039 1.00 0.00 H new ATOM 0 HB2 HIS A 95 8.171 -8.277 -9.828 1.00 0.00 H new ATOM 0 HB3 HIS A 95 6.856 -8.749 -10.886 1.00 0.00 H new ATOM 0 HD2 HIS A 95 4.806 -6.397 -9.446 1.00 0.00 H new ATOM 0 HE1 HIS A 95 7.518 -3.719 -11.308 1.00 0.00 H new ATOM 0 HE2 HIS A 95 5.126 -3.943 -10.392 1.00 0.00 H new ATOM 1481 N GLY A 96 7.535 -10.520 -7.699 1.00 0.00 N ATOM 1482 CA GLY A 96 7.741 -11.879 -7.209 1.00 0.00 C ATOM 1483 C GLY A 96 6.501 -12.440 -6.507 1.00 0.00 C ATOM 1484 O GLY A 96 6.285 -13.654 -6.489 1.00 0.00 O ATOM 0 H GLY A 96 8.218 -9.854 -7.338 1.00 0.00 H new ATOM 0 HA2 GLY A 96 8.007 -12.527 -8.044 1.00 0.00 H new ATOM 0 HA3 GLY A 96 8.583 -11.889 -6.517 1.00 0.00 H new ATOM 1488 N CYS A 97 5.665 -11.551 -5.972 1.00 0.00 N ATOM 1489 CA CYS A 97 4.483 -11.859 -5.196 1.00 0.00 C ATOM 1490 C CYS A 97 3.222 -11.794 -6.033 1.00 0.00 C ATOM 1491 O CYS A 97 2.224 -12.407 -5.645 1.00 0.00 O ATOM 1492 CB CYS A 97 4.387 -10.925 -3.992 1.00 0.00 C ATOM 1493 SG CYS A 97 5.322 -11.526 -2.571 1.00 0.00 S ATOM 0 H CYS A 97 5.809 -10.547 -6.079 1.00 0.00 H new ATOM 0 HA CYS A 97 4.576 -12.885 -4.841 1.00 0.00 H new ATOM 0 HB2 CYS A 97 4.754 -9.938 -4.273 1.00 0.00 H new ATOM 0 HB3 CYS A 97 3.341 -10.808 -3.710 1.00 0.00 H new ATOM 1498 N GLU A 98 3.273 -11.158 -7.207 1.00 0.00 N ATOM 1499 CA GLU A 98 2.320 -11.470 -8.245 1.00 0.00 C ATOM 1500 C GLU A 98 2.469 -12.953 -8.576 1.00 0.00 C ATOM 1501 O GLU A 98 1.478 -13.672 -8.596 1.00 0.00 O ATOM 1502 CB GLU A 98 2.554 -10.679 -9.524 1.00 0.00 C ATOM 1503 CG GLU A 98 2.311 -9.187 -9.386 1.00 0.00 C ATOM 1504 CD GLU A 98 2.449 -8.540 -10.773 1.00 0.00 C ATOM 1505 OE1 GLU A 98 3.589 -8.402 -11.275 1.00 0.00 O ATOM 1506 OE2 GLU A 98 1.402 -8.301 -11.423 1.00 0.00 O ATOM 0 H GLU A 98 3.955 -10.439 -7.448 1.00 0.00 H new ATOM 0 HA GLU A 98 1.327 -11.213 -7.877 1.00 0.00 H new ATOM 0 HB2 GLU A 98 3.580 -10.840 -9.855 1.00 0.00 H new ATOM 0 HB3 GLU A 98 1.902 -11.071 -10.305 1.00 0.00 H new ATOM 0 HG2 GLU A 98 1.317 -9.001 -8.979 1.00 0.00 H new ATOM 0 HG3 GLU A 98 3.027 -8.749 -8.691 1.00 0.00 H new ATOM 1513 N LYS A 99 3.704 -13.407 -8.847 1.00 0.00 N ATOM 1514 CA LYS A 99 3.924 -14.715 -9.460 1.00 0.00 C ATOM 1515 C LYS A 99 3.545 -15.859 -8.533 1.00 0.00 C ATOM 1516 O LYS A 99 2.983 -16.852 -8.995 1.00 0.00 O ATOM 1517 CB LYS A 99 5.350 -14.912 -9.965 1.00 0.00 C ATOM 1518 CG LYS A 99 5.887 -13.819 -10.878 1.00 0.00 C ATOM 1519 CD LYS A 99 5.028 -13.510 -12.096 1.00 0.00 C ATOM 1520 CE LYS A 99 5.121 -14.596 -13.161 1.00 0.00 C ATOM 1521 NZ LYS A 99 4.284 -14.255 -14.317 1.00 0.00 N ATOM 0 H LYS A 99 4.558 -12.885 -8.650 1.00 0.00 H new ATOM 0 HA LYS A 99 3.261 -14.732 -10.325 1.00 0.00 H new ATOM 0 HB2 LYS A 99 6.012 -14.997 -9.103 1.00 0.00 H new ATOM 0 HB3 LYS A 99 5.398 -15.861 -10.499 1.00 0.00 H new ATOM 0 HG2 LYS A 99 6.004 -12.906 -10.295 1.00 0.00 H new ATOM 0 HG3 LYS A 99 6.881 -14.109 -11.219 1.00 0.00 H new ATOM 0 HD2 LYS A 99 3.989 -13.397 -11.786 1.00 0.00 H new ATOM 0 HD3 LYS A 99 5.338 -12.557 -12.524 1.00 0.00 H new ATOM 0 HE2 LYS A 99 6.157 -14.716 -13.477 1.00 0.00 H new ATOM 0 HE3 LYS A 99 4.803 -15.551 -12.743 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 4.359 -15.005 -15.033 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 3.293 -14.164 -14.014 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 4.606 -13.354 -14.725 1.00 0.00 H new ATOM 1535 N SER A 100 3.891 -15.779 -7.248 1.00 0.00 N ATOM 1536 CA SER A 100 3.553 -16.839 -6.305 1.00 0.00 C ATOM 1537 C SER A 100 2.042 -16.904 -6.065 1.00 0.00 C ATOM 1538 O SER A 100 1.509 -17.980 -5.769 1.00 0.00 O ATOM 1539 CB SER A 100 4.307 -16.608 -4.996 1.00 0.00 C ATOM 1540 OG SER A 100 4.145 -15.280 -4.543 1.00 0.00 O ATOM 0 H SER A 100 4.402 -14.996 -6.841 1.00 0.00 H new ATOM 0 HA SER A 100 3.853 -17.798 -6.726 1.00 0.00 H new ATOM 0 HB2 SER A 100 3.945 -17.301 -4.237 1.00 0.00 H new ATOM 0 HB3 SER A 100 5.366 -16.819 -5.141 1.00 0.00 H new ATOM 0 HG SER A 100 4.351 -15.233 -3.586 1.00 0.00 H new ATOM 1546 N THR A 101 1.347 -15.772 -6.186 1.00 0.00 N ATOM 1547 CA THR A 101 -0.082 -15.683 -5.954 1.00 0.00 C ATOM 1548 C THR A 101 -0.795 -16.074 -7.257 1.00 0.00 C ATOM 1549 O THR A 101 -0.619 -15.408 -8.276 1.00 0.00 O ATOM 1550 CB THR A 101 -0.445 -14.277 -5.456 1.00 0.00 C ATOM 1551 OG1 THR A 101 0.403 -13.916 -4.376 1.00 0.00 O ATOM 1552 CG2 THR A 101 -1.890 -14.252 -4.949 1.00 0.00 C ATOM 0 H THR A 101 1.773 -14.884 -6.452 1.00 0.00 H new ATOM 0 HA THR A 101 -0.407 -16.369 -5.172 1.00 0.00 H new ATOM 0 HB THR A 101 -0.326 -13.580 -6.285 1.00 0.00 H new ATOM 0 HG1 THR A 101 1.013 -13.205 -4.663 1.00 0.00 H new ATOM 0 HG21 THR A 101 -2.135 -13.249 -4.599 1.00 0.00 H new ATOM 0 HG22 THR A 101 -2.565 -14.528 -5.759 1.00 0.00 H new ATOM 0 HG23 THR A 101 -2.000 -14.960 -4.128 1.00 0.00 H new ATOM 1560 N PRO A 102 -1.583 -17.161 -7.280 1.00 0.00 N ATOM 1561 CA PRO A 102 -2.222 -17.598 -8.509 1.00 0.00 C ATOM 1562 C PRO A 102 -3.205 -16.525 -8.971 1.00 0.00 C ATOM 1563 O PRO A 102 -3.851 -15.872 -8.143 1.00 0.00 O ATOM 1564 CB PRO A 102 -2.878 -18.932 -8.177 1.00 0.00 C ATOM 1565 CG PRO A 102 -3.156 -18.837 -6.680 1.00 0.00 C ATOM 1566 CD PRO A 102 -2.011 -17.973 -6.156 1.00 0.00 C ATOM 0 HA PRO A 102 -1.530 -17.737 -9.339 1.00 0.00 H new ATOM 0 HB2 PRO A 102 -3.796 -19.079 -8.746 1.00 0.00 H new ATOM 0 HB3 PRO A 102 -2.221 -19.770 -8.410 1.00 0.00 H new ATOM 0 HG2 PRO A 102 -4.126 -18.381 -6.481 1.00 0.00 H new ATOM 0 HG3 PRO A 102 -3.163 -19.821 -6.210 1.00 0.00 H new ATOM 0 HD2 PRO A 102 -2.340 -17.349 -5.325 1.00 0.00 H new ATOM 0 HD3 PRO A 102 -1.193 -18.591 -5.786 1.00 0.00 H new ATOM 1574 N ALA A 103 -3.256 -16.315 -10.285 1.00 0.00 N ATOM 1575 CA ALA A 103 -3.936 -15.231 -10.970 1.00 0.00 C ATOM 1576 C ALA A 103 -5.449 -15.398 -10.818 1.00 0.00 C ATOM 1577 O ALA A 103 -6.121 -15.959 -11.691 1.00 0.00 O ATOM 1578 CB ALA A 103 -3.476 -15.215 -12.433 1.00 0.00 C ATOM 0 H ALA A 103 -2.790 -16.944 -10.939 1.00 0.00 H new ATOM 0 HA ALA A 103 -3.684 -14.265 -10.533 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -3.978 -14.406 -12.963 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -2.398 -15.062 -12.474 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -3.725 -16.166 -12.903 1.00 0.00 H new ATOM 1584 N ASN A 104 -5.966 -14.945 -9.677 1.00 0.00 N ATOM 1585 CA ASN A 104 -7.330 -15.192 -9.244 1.00 0.00 C ATOM 1586 C ASN A 104 -8.337 -14.643 -10.239 1.00 0.00 C ATOM 1587 O ASN A 104 -8.057 -13.711 -10.997 1.00 0.00 O ATOM 1588 CB ASN A 104 -7.579 -14.600 -7.853 1.00 0.00 C ATOM 1589 CG ASN A 104 -8.756 -15.281 -7.194 1.00 0.00 C ATOM 1590 OD1 ASN A 104 -8.775 -16.496 -7.016 1.00 0.00 O ATOM 1591 ND2 ASN A 104 -9.740 -14.518 -6.792 1.00 0.00 N ATOM 0 H ASN A 104 -5.430 -14.383 -9.016 1.00 0.00 H new ATOM 0 HA ASN A 104 -7.464 -16.272 -9.190 1.00 0.00 H new ATOM 0 HB2 ASN A 104 -6.689 -14.719 -7.235 1.00 0.00 H new ATOM 0 HB3 ASN A 104 -7.769 -13.530 -7.935 1.00 0.00 H new ATOM 0 HD21 ASN A 104 -10.545 -14.930 -6.320 1.00 0.00 H new ATOM 0 HD22 ASN A 104 -9.702 -13.511 -6.951 1.00 0.00 H new ATOM 1598 N ASP A 105 -9.532 -15.217 -10.177 1.00 0.00 N ATOM 1599 CA ASP A 105 -10.712 -14.756 -10.874 1.00 0.00 C ATOM 1600 C ASP A 105 -11.053 -13.330 -10.447 1.00 0.00 C ATOM 1601 O ASP A 105 -11.399 -12.479 -11.266 1.00 0.00 O ATOM 1602 CB ASP A 105 -11.861 -15.696 -10.529 1.00 0.00 C ATOM 1603 CG ASP A 105 -13.067 -15.462 -11.426 1.00 0.00 C ATOM 1604 OD1 ASP A 105 -12.960 -15.768 -12.632 1.00 0.00 O ATOM 1605 OD2 ASP A 105 -14.165 -15.144 -10.922 1.00 0.00 O ATOM 0 H ASP A 105 -9.706 -16.050 -9.615 1.00 0.00 H new ATOM 0 HA ASP A 105 -10.537 -14.754 -11.950 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -11.528 -16.729 -10.628 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -12.149 -15.552 -9.487 1.00 0.00 H new ATOM 1610 N ASP A 106 -10.880 -13.051 -9.150 1.00 0.00 N ATOM 1611 CA ASP A 106 -11.212 -11.758 -8.543 1.00 0.00 C ATOM 1612 C ASP A 106 -9.929 -10.945 -8.389 1.00 0.00 C ATOM 1613 O ASP A 106 -8.999 -11.404 -7.712 1.00 0.00 O ATOM 1614 CB ASP A 106 -11.837 -11.905 -7.149 1.00 0.00 C ATOM 1615 CG ASP A 106 -12.547 -10.630 -6.711 1.00 0.00 C ATOM 1616 OD1 ASP A 106 -11.819 -9.653 -6.444 1.00 0.00 O ATOM 1617 OD2 ASP A 106 -13.794 -10.572 -6.646 1.00 0.00 O ATOM 0 H ASP A 106 -10.501 -13.725 -8.485 1.00 0.00 H new ATOM 0 HA ASP A 106 -11.936 -11.270 -9.196 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -12.546 -12.733 -7.154 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -11.060 -12.155 -6.427 1.00 0.00 H new ATOM 1622 N LYS A 107 -9.865 -9.746 -8.971 1.00 0.00 N ATOM 1623 CA LYS A 107 -8.694 -8.888 -8.893 1.00 0.00 C ATOM 1624 C LYS A 107 -8.417 -8.467 -7.459 1.00 0.00 C ATOM 1625 O LYS A 107 -7.266 -8.478 -7.034 1.00 0.00 O ATOM 1626 CB LYS A 107 -8.890 -7.625 -9.742 1.00 0.00 C ATOM 1627 CG LYS A 107 -7.541 -7.188 -10.332 1.00 0.00 C ATOM 1628 CD LYS A 107 -7.277 -7.802 -11.719 1.00 0.00 C ATOM 1629 CE LYS A 107 -6.821 -6.699 -12.684 1.00 0.00 C ATOM 1630 NZ LYS A 107 -6.524 -7.198 -14.041 1.00 0.00 N ATOM 0 H LYS A 107 -10.632 -9.346 -9.512 1.00 0.00 H new ATOM 0 HA LYS A 107 -7.848 -9.462 -9.272 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -9.603 -7.820 -10.543 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -9.308 -6.825 -9.131 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -7.517 -6.101 -10.409 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -6.740 -7.477 -9.652 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -6.513 -8.577 -11.647 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -8.181 -8.280 -12.096 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -7.597 -5.936 -12.746 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -5.932 -6.216 -12.279 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -6.222 -6.406 -14.644 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -5.763 -7.906 -13.992 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -7.377 -7.634 -14.445 1.00 0.00 H new ATOM 1644 N CYS A 108 -9.446 -8.070 -6.714 1.00 0.00 N ATOM 1645 CA CYS A 108 -9.298 -7.672 -5.328 1.00 0.00 C ATOM 1646 C CYS A 108 -8.731 -8.830 -4.503 1.00 0.00 C ATOM 1647 O CYS A 108 -7.783 -8.629 -3.747 1.00 0.00 O ATOM 1648 CB CYS A 108 -10.630 -7.227 -4.729 1.00 0.00 C ATOM 1649 SG CYS A 108 -11.488 -5.810 -5.452 1.00 0.00 S ATOM 0 H CYS A 108 -10.404 -8.017 -7.060 1.00 0.00 H new ATOM 0 HA CYS A 108 -8.609 -6.828 -5.300 1.00 0.00 H new ATOM 0 HB2 CYS A 108 -11.309 -8.078 -4.769 1.00 0.00 H new ATOM 0 HB3 CYS A 108 -10.459 -7.005 -3.676 1.00 0.00 H new ATOM 1654 N ILE A 109 -9.282 -10.043 -4.626 1.00 0.00 N ATOM 1655 CA ILE A 109 -8.798 -11.199 -3.867 1.00 0.00 C ATOM 1656 C ILE A 109 -7.350 -11.523 -4.259 1.00 0.00 C ATOM 1657 O ILE A 109 -6.535 -11.776 -3.370 1.00 0.00 O ATOM 1658 CB ILE A 109 -9.780 -12.391 -3.995 1.00 0.00 C ATOM 1659 CG1 ILE A 109 -11.151 -11.981 -3.420 1.00 0.00 C ATOM 1660 CG2 ILE A 109 -9.216 -13.647 -3.318 1.00 0.00 C ATOM 1661 CD1 ILE A 109 -12.247 -13.035 -3.555 1.00 0.00 C ATOM 0 H ILE A 109 -10.065 -10.249 -5.246 1.00 0.00 H new ATOM 0 HA ILE A 109 -8.773 -10.961 -2.804 1.00 0.00 H new ATOM 0 HB ILE A 109 -9.912 -12.645 -5.047 1.00 0.00 H new ATOM 0 HG12 ILE A 109 -11.028 -11.739 -2.364 1.00 0.00 H new ATOM 0 HG13 ILE A 109 -11.480 -11.070 -3.920 1.00 0.00 H new ATOM 0 HG21 ILE A 109 -9.926 -14.467 -3.424 1.00 0.00 H new ATOM 0 HG22 ILE A 109 -8.272 -13.921 -3.789 1.00 0.00 H new ATOM 0 HG23 ILE A 109 -9.049 -13.446 -2.260 1.00 0.00 H new ATOM 0 HD11 ILE A 109 -13.172 -12.655 -3.122 1.00 0.00 H new ATOM 0 HD12 ILE A 109 -12.406 -13.262 -4.609 1.00 0.00 H new ATOM 0 HD13 ILE A 109 -11.947 -13.942 -3.030 1.00 0.00 H new ATOM 1673 N TRP A 110 -7.010 -11.461 -5.552 1.00 0.00 N ATOM 1674 CA TRP A 110 -5.623 -11.537 -6.002 1.00 0.00 C ATOM 1675 C TRP A 110 -4.776 -10.503 -5.255 1.00 0.00 C ATOM 1676 O TRP A 110 -3.828 -10.878 -4.572 1.00 0.00 O ATOM 1677 CB TRP A 110 -5.523 -11.380 -7.529 1.00 0.00 C ATOM 1678 CG TRP A 110 -4.132 -11.431 -8.078 1.00 0.00 C ATOM 1679 CD1 TRP A 110 -3.412 -12.553 -8.294 1.00 0.00 C ATOM 1680 CD2 TRP A 110 -3.266 -10.327 -8.471 1.00 0.00 C ATOM 1681 NE1 TRP A 110 -2.194 -12.234 -8.859 1.00 0.00 N ATOM 1682 CE2 TRP A 110 -2.070 -10.872 -9.033 1.00 0.00 C ATOM 1683 CE3 TRP A 110 -3.366 -8.920 -8.398 1.00 0.00 C ATOM 1684 CZ2 TRP A 110 -1.062 -10.057 -9.567 1.00 0.00 C ATOM 1685 CZ3 TRP A 110 -2.338 -8.094 -8.884 1.00 0.00 C ATOM 1686 CH2 TRP A 110 -1.214 -8.659 -9.499 1.00 0.00 C ATOM 0 H TRP A 110 -7.687 -11.357 -6.308 1.00 0.00 H new ATOM 0 HA TRP A 110 -5.228 -12.525 -5.768 1.00 0.00 H new ATOM 0 HB2 TRP A 110 -6.113 -12.166 -8.000 1.00 0.00 H new ATOM 0 HB3 TRP A 110 -5.975 -10.430 -7.812 1.00 0.00 H new ATOM 0 HD1 TRP A 110 -3.741 -13.554 -8.059 1.00 0.00 H new ATOM 0 HE1 TRP A 110 -1.480 -12.916 -9.114 1.00 0.00 H new ATOM 0 HE3 TRP A 110 -4.246 -8.472 -7.962 1.00 0.00 H new ATOM 0 HZ2 TRP A 110 -0.185 -10.493 -10.022 1.00 0.00 H new ATOM 0 HZ3 TRP A 110 -2.415 -7.022 -8.783 1.00 0.00 H new ATOM 0 HH2 TRP A 110 -0.457 -8.017 -9.925 1.00 0.00 H new ATOM 1697 N THR A 111 -5.149 -9.226 -5.323 1.00 0.00 N ATOM 1698 CA THR A 111 -4.436 -8.102 -4.726 1.00 0.00 C ATOM 1699 C THR A 111 -4.225 -8.303 -3.215 1.00 0.00 C ATOM 1700 O THR A 111 -3.143 -8.010 -2.707 1.00 0.00 O ATOM 1701 CB THR A 111 -5.187 -6.795 -5.063 1.00 0.00 C ATOM 1702 OG1 THR A 111 -5.393 -6.689 -6.459 1.00 0.00 O ATOM 1703 CG2 THR A 111 -4.426 -5.539 -4.643 1.00 0.00 C ATOM 0 H THR A 111 -5.993 -8.936 -5.817 1.00 0.00 H new ATOM 0 HA THR A 111 -3.434 -8.036 -5.150 1.00 0.00 H new ATOM 0 HB THR A 111 -6.125 -6.852 -4.511 1.00 0.00 H new ATOM 0 HG1 THR A 111 -6.201 -7.184 -6.709 1.00 0.00 H new ATOM 0 HG21 THR A 111 -5.007 -4.656 -4.908 1.00 0.00 H new ATOM 0 HG22 THR A 111 -4.262 -5.556 -3.566 1.00 0.00 H new ATOM 0 HG23 THR A 111 -3.465 -5.508 -5.156 1.00 0.00 H new ATOM 1711 N LEU A 112 -5.209 -8.852 -2.487 1.00 0.00 N ATOM 1712 CA LEU A 112 -5.112 -9.150 -1.068 1.00 0.00 C ATOM 1713 C LEU A 112 -4.018 -10.199 -0.844 1.00 0.00 C ATOM 1714 O LEU A 112 -3.143 -10.004 0.001 1.00 0.00 O ATOM 1715 CB LEU A 112 -6.510 -9.584 -0.592 1.00 0.00 C ATOM 1716 CG LEU A 112 -6.724 -9.946 0.886 1.00 0.00 C ATOM 1717 CD1 LEU A 112 -6.178 -11.322 1.235 1.00 0.00 C ATOM 1718 CD2 LEU A 112 -6.265 -8.903 1.901 1.00 0.00 C ATOM 0 H LEU A 112 -6.113 -9.104 -2.888 1.00 0.00 H new ATOM 0 HA LEU A 112 -4.815 -8.284 -0.476 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -7.203 -8.779 -0.835 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -6.804 -10.449 -1.187 1.00 0.00 H new ATOM 0 HG LEU A 112 -7.810 -9.966 0.977 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -6.356 -11.527 2.291 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -6.680 -12.077 0.629 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -5.107 -11.350 1.035 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -6.465 -9.264 2.910 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -5.196 -8.727 1.784 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -6.806 -7.971 1.736 1.00 0.00 H new ATOM 1730 N GLY A 113 -4.046 -11.291 -1.616 1.00 0.00 N ATOM 1731 CA GLY A 113 -3.038 -12.345 -1.568 1.00 0.00 C ATOM 1732 C GLY A 113 -1.635 -11.829 -1.901 1.00 0.00 C ATOM 1733 O GLY A 113 -0.687 -12.149 -1.180 1.00 0.00 O ATOM 0 H GLY A 113 -4.782 -11.466 -2.300 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -3.031 -12.792 -0.574 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -3.308 -13.134 -2.270 1.00 0.00 H new ATOM 1737 N VAL A 114 -1.509 -11.029 -2.963 1.00 0.00 N ATOM 1738 CA VAL A 114 -0.283 -10.382 -3.429 1.00 0.00 C ATOM 1739 C VAL A 114 0.293 -9.529 -2.291 1.00 0.00 C ATOM 1740 O VAL A 114 1.416 -9.760 -1.851 1.00 0.00 O ATOM 1741 CB VAL A 114 -0.611 -9.584 -4.713 1.00 0.00 C ATOM 1742 CG1 VAL A 114 0.477 -8.608 -5.161 1.00 0.00 C ATOM 1743 CG2 VAL A 114 -0.838 -10.539 -5.889 1.00 0.00 C ATOM 0 H VAL A 114 -2.309 -10.803 -3.555 1.00 0.00 H new ATOM 0 HA VAL A 114 0.490 -11.103 -3.693 1.00 0.00 H new ATOM 0 HB VAL A 114 -1.499 -9.010 -4.449 1.00 0.00 H new ATOM 0 HG11 VAL A 114 0.156 -8.096 -6.068 1.00 0.00 H new ATOM 0 HG12 VAL A 114 0.654 -7.875 -4.374 1.00 0.00 H new ATOM 0 HG13 VAL A 114 1.398 -9.156 -5.361 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -1.068 -9.964 -6.786 1.00 0.00 H new ATOM 0 HG22 VAL A 114 0.063 -11.129 -6.058 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -1.671 -11.205 -5.662 1.00 0.00 H new ATOM 1753 N ALA A 115 -0.477 -8.585 -1.742 1.00 0.00 N ATOM 1754 CA ALA A 115 0.019 -7.702 -0.693 1.00 0.00 C ATOM 1755 C ALA A 115 0.358 -8.449 0.604 1.00 0.00 C ATOM 1756 O ALA A 115 1.319 -8.058 1.275 1.00 0.00 O ATOM 1757 CB ALA A 115 -0.986 -6.579 -0.441 1.00 0.00 C ATOM 0 H ALA A 115 -1.447 -8.416 -2.010 1.00 0.00 H new ATOM 0 HA ALA A 115 0.957 -7.271 -1.044 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -0.609 -5.923 0.344 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -1.128 -6.005 -1.357 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -1.939 -7.007 -0.130 1.00 0.00 H new ATOM 1763 N THR A 116 -0.370 -9.514 0.962 1.00 0.00 N ATOM 1764 CA THR A 116 0.035 -10.401 2.053 1.00 0.00 C ATOM 1765 C THR A 116 1.383 -11.054 1.730 1.00 0.00 C ATOM 1766 O THR A 116 2.260 -11.076 2.594 1.00 0.00 O ATOM 1767 CB THR A 116 -1.071 -11.434 2.348 1.00 0.00 C ATOM 1768 OG1 THR A 116 -2.176 -10.786 2.960 1.00 0.00 O ATOM 1769 CG2 THR A 116 -0.619 -12.555 3.293 1.00 0.00 C ATOM 0 H THR A 116 -1.244 -9.781 0.509 1.00 0.00 H new ATOM 0 HA THR A 116 0.171 -9.818 2.964 1.00 0.00 H new ATOM 0 HB THR A 116 -1.333 -11.878 1.388 1.00 0.00 H new ATOM 0 HG1 THR A 116 -2.746 -10.388 2.269 1.00 0.00 H new ATOM 0 HG21 THR A 116 -1.445 -13.247 3.458 1.00 0.00 H new ATOM 0 HG22 THR A 116 0.219 -13.091 2.847 1.00 0.00 H new ATOM 0 HG23 THR A 116 -0.310 -12.125 4.246 1.00 0.00 H new ATOM 1777 N CYS A 117 1.569 -11.565 0.508 1.00 0.00 N ATOM 1778 CA CYS A 117 2.836 -12.145 0.090 1.00 0.00 C ATOM 1779 C CYS A 117 3.957 -11.133 0.279 1.00 0.00 C ATOM 1780 O CYS A 117 4.979 -11.497 0.845 1.00 0.00 O ATOM 1781 CB CYS A 117 2.768 -12.647 -1.354 1.00 0.00 C ATOM 1782 SG CYS A 117 4.334 -13.235 -2.053 1.00 0.00 S ATOM 0 H CYS A 117 0.846 -11.585 -0.211 1.00 0.00 H new ATOM 0 HA CYS A 117 3.047 -13.011 0.717 1.00 0.00 H new ATOM 0 HB2 CYS A 117 2.041 -13.458 -1.404 1.00 0.00 H new ATOM 0 HB3 CYS A 117 2.390 -11.841 -1.983 1.00 0.00 H new ATOM 1787 N PHE A 118 3.775 -9.873 -0.129 1.00 0.00 N ATOM 1788 CA PHE A 118 4.814 -8.864 0.003 1.00 0.00 C ATOM 1789 C PHE A 118 5.324 -8.802 1.454 1.00 0.00 C ATOM 1790 O PHE A 118 6.480 -9.087 1.762 1.00 0.00 O ATOM 1791 CB PHE A 118 4.256 -7.518 -0.492 1.00 0.00 C ATOM 1792 CG PHE A 118 5.229 -6.358 -0.511 1.00 0.00 C ATOM 1793 CD1 PHE A 118 6.599 -6.560 -0.310 1.00 0.00 C ATOM 1794 CD2 PHE A 118 4.772 -5.067 -0.802 1.00 0.00 C ATOM 1795 CE1 PHE A 118 7.511 -5.517 -0.494 1.00 0.00 C ATOM 1796 CE2 PHE A 118 5.675 -3.998 -0.909 1.00 0.00 C ATOM 1797 CZ PHE A 118 7.045 -4.220 -0.756 1.00 0.00 C ATOM 0 H PHE A 118 2.912 -9.533 -0.554 1.00 0.00 H new ATOM 0 HA PHE A 118 5.677 -9.120 -0.611 1.00 0.00 H new ATOM 0 HB2 PHE A 118 3.870 -7.658 -1.502 1.00 0.00 H new ATOM 0 HB3 PHE A 118 3.410 -7.245 0.138 1.00 0.00 H new ATOM 0 HD1 PHE A 118 6.956 -7.534 -0.009 1.00 0.00 H new ATOM 0 HD2 PHE A 118 3.716 -4.892 -0.945 1.00 0.00 H new ATOM 0 HE1 PHE A 118 8.572 -5.709 -0.435 1.00 0.00 H new ATOM 0 HE2 PHE A 118 5.310 -3.002 -1.110 1.00 0.00 H new ATOM 0 HZ PHE A 118 7.741 -3.399 -0.839 1.00 0.00 H new ATOM 1807 N LYS A 119 4.418 -8.476 2.363 1.00 0.00 N ATOM 1808 CA LYS A 119 4.573 -8.473 3.819 1.00 0.00 C ATOM 1809 C LYS A 119 5.312 -9.716 4.322 1.00 0.00 C ATOM 1810 O LYS A 119 6.209 -9.609 5.166 1.00 0.00 O ATOM 1811 CB LYS A 119 3.157 -8.406 4.420 1.00 0.00 C ATOM 1812 CG LYS A 119 3.003 -7.493 5.640 1.00 0.00 C ATOM 1813 CD LYS A 119 3.598 -8.066 6.929 1.00 0.00 C ATOM 1814 CE LYS A 119 2.832 -7.485 8.121 1.00 0.00 C ATOM 1815 NZ LYS A 119 3.299 -8.005 9.419 1.00 0.00 N ATOM 0 H LYS A 119 3.481 -8.183 2.086 1.00 0.00 H new ATOM 0 HA LYS A 119 5.176 -7.618 4.125 1.00 0.00 H new ATOM 0 HB2 LYS A 119 2.468 -8.069 3.646 1.00 0.00 H new ATOM 0 HB3 LYS A 119 2.852 -9.414 4.701 1.00 0.00 H new ATOM 0 HG2 LYS A 119 3.479 -6.536 5.427 1.00 0.00 H new ATOM 0 HG3 LYS A 119 1.943 -7.293 5.799 1.00 0.00 H new ATOM 0 HD2 LYS A 119 3.527 -9.154 6.928 1.00 0.00 H new ATOM 0 HD3 LYS A 119 4.656 -7.816 7.001 1.00 0.00 H new ATOM 0 HE2 LYS A 119 2.931 -6.400 8.115 1.00 0.00 H new ATOM 0 HE3 LYS A 119 1.771 -7.709 8.007 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 2.743 -7.575 10.186 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 3.180 -9.038 9.442 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 4.304 -7.769 9.546 1.00 0.00 H new ATOM 1829 N ALA A 120 4.916 -10.882 3.817 1.00 0.00 N ATOM 1830 CA ALA A 120 5.513 -12.165 4.149 1.00 0.00 C ATOM 1831 C ALA A 120 6.969 -12.253 3.692 1.00 0.00 C ATOM 1832 O ALA A 120 7.814 -12.652 4.490 1.00 0.00 O ATOM 1833 CB ALA A 120 4.681 -13.302 3.545 1.00 0.00 C ATOM 0 H ALA A 120 4.150 -10.958 3.148 1.00 0.00 H new ATOM 0 HA ALA A 120 5.514 -12.263 5.235 1.00 0.00 H new ATOM 0 HB1 ALA A 120 5.135 -14.260 3.799 1.00 0.00 H new ATOM 0 HB2 ALA A 120 3.668 -13.264 3.945 1.00 0.00 H new ATOM 0 HB3 ALA A 120 4.647 -13.192 2.461 1.00 0.00 H new ATOM 1839 N GLU A 121 7.287 -11.874 2.451 1.00 0.00 N ATOM 1840 CA GLU A 121 8.647 -11.894 1.915 1.00 0.00 C ATOM 1841 C GLU A 121 9.560 -10.980 2.725 1.00 0.00 C ATOM 1842 O GLU A 121 10.707 -11.333 2.988 1.00 0.00 O ATOM 1843 CB GLU A 121 8.685 -11.413 0.461 1.00 0.00 C ATOM 1844 CG GLU A 121 7.995 -12.353 -0.537 1.00 0.00 C ATOM 1845 CD GLU A 121 8.681 -13.704 -0.697 1.00 0.00 C ATOM 1846 OE1 GLU A 121 9.884 -13.731 -1.038 1.00 0.00 O ATOM 1847 OE2 GLU A 121 8.032 -14.760 -0.501 1.00 0.00 O ATOM 0 H GLU A 121 6.594 -11.540 1.781 1.00 0.00 H new ATOM 0 HA GLU A 121 8.989 -12.927 1.972 1.00 0.00 H new ATOM 0 HB2 GLU A 121 8.213 -10.432 0.403 1.00 0.00 H new ATOM 0 HB3 GLU A 121 9.725 -11.284 0.161 1.00 0.00 H new ATOM 0 HG2 GLU A 121 6.967 -12.516 -0.215 1.00 0.00 H new ATOM 0 HG3 GLU A 121 7.950 -11.863 -1.510 1.00 0.00 H new ATOM 1854 N ILE A 122 9.066 -9.815 3.158 1.00 0.00 N ATOM 1855 CA ILE A 122 9.826 -8.925 4.019 1.00 0.00 C ATOM 1856 C ILE A 122 10.215 -9.625 5.323 1.00 0.00 C ATOM 1857 O ILE A 122 11.264 -9.311 5.879 1.00 0.00 O ATOM 1858 CB ILE A 122 9.048 -7.618 4.264 1.00 0.00 C ATOM 1859 CG1 ILE A 122 8.749 -6.894 2.934 1.00 0.00 C ATOM 1860 CG2 ILE A 122 9.834 -6.705 5.221 1.00 0.00 C ATOM 1861 CD1 ILE A 122 7.815 -5.692 3.085 1.00 0.00 C ATOM 0 H ILE A 122 8.136 -9.472 2.920 1.00 0.00 H new ATOM 0 HA ILE A 122 10.756 -8.659 3.516 1.00 0.00 H new ATOM 0 HB ILE A 122 8.093 -7.867 4.727 1.00 0.00 H new ATOM 0 HG12 ILE A 122 9.688 -6.560 2.493 1.00 0.00 H new ATOM 0 HG13 ILE A 122 8.304 -7.603 2.236 1.00 0.00 H new ATOM 0 HG21 ILE A 122 9.275 -5.784 5.387 1.00 0.00 H new ATOM 0 HG22 ILE A 122 9.982 -7.216 6.172 1.00 0.00 H new ATOM 0 HG23 ILE A 122 10.803 -6.467 4.783 1.00 0.00 H new ATOM 0 HD11 ILE A 122 7.651 -5.234 2.110 1.00 0.00 H new ATOM 0 HD12 ILE A 122 6.861 -6.022 3.496 1.00 0.00 H new ATOM 0 HD13 ILE A 122 8.267 -4.962 3.757 1.00 0.00 H new ATOM 1873 N HIS A 123 9.440 -10.594 5.815 1.00 0.00 N ATOM 1874 CA HIS A 123 9.873 -11.342 6.987 1.00 0.00 C ATOM 1875 C HIS A 123 11.142 -12.152 6.698 1.00 0.00 C ATOM 1876 O HIS A 123 11.953 -12.388 7.591 1.00 0.00 O ATOM 1877 CB HIS A 123 8.759 -12.260 7.488 1.00 0.00 C ATOM 1878 CG HIS A 123 9.018 -12.660 8.911 1.00 0.00 C ATOM 1879 ND1 HIS A 123 9.357 -13.913 9.363 1.00 0.00 N ATOM 1880 CD2 HIS A 123 9.144 -11.789 9.955 1.00 0.00 C ATOM 1881 CE1 HIS A 123 9.658 -13.807 10.667 1.00 0.00 C ATOM 1882 NE2 HIS A 123 9.517 -12.532 11.083 1.00 0.00 N ATOM 0 H HIS A 123 8.536 -10.870 5.431 1.00 0.00 H new ATOM 0 HA HIS A 123 10.106 -10.619 7.769 1.00 0.00 H new ATOM 0 HB2 HIS A 123 7.798 -11.751 7.415 1.00 0.00 H new ATOM 0 HB3 HIS A 123 8.698 -13.148 6.858 1.00 0.00 H new ATOM 0 HD2 HIS A 123 8.985 -10.721 9.918 1.00 0.00 H new ATOM 0 HE1 HIS A 123 9.970 -14.628 11.295 1.00 0.00 H new ATOM 0 HE2 HIS A 123 9.654 -12.179 12.030 1.00 0.00 H new ATOM 1890 N LYS A 124 11.335 -12.561 5.444 1.00 0.00 N ATOM 1891 CA LYS A 124 12.522 -13.249 4.967 1.00 0.00 C ATOM 1892 C LYS A 124 13.674 -12.267 4.713 1.00 0.00 C ATOM 1893 O LYS A 124 14.826 -12.704 4.787 1.00 0.00 O ATOM 1894 CB LYS A 124 12.113 -14.143 3.778 1.00 0.00 C ATOM 1895 CG LYS A 124 12.850 -13.887 2.462 1.00 0.00 C ATOM 1896 CD LYS A 124 11.934 -14.203 1.285 1.00 0.00 C ATOM 1897 CE LYS A 124 12.718 -14.259 -0.025 1.00 0.00 C ATOM 1898 NZ LYS A 124 12.499 -15.544 -0.711 1.00 0.00 N ATOM 0 H LYS A 124 10.641 -12.414 4.711 1.00 0.00 H new ATOM 0 HA LYS A 124 12.936 -13.915 5.725 1.00 0.00 H new ATOM 0 HB2 LYS A 124 12.268 -15.184 4.062 1.00 0.00 H new ATOM 0 HB3 LYS A 124 11.045 -14.016 3.604 1.00 0.00 H new ATOM 0 HG2 LYS A 124 13.174 -12.848 2.413 1.00 0.00 H new ATOM 0 HG3 LYS A 124 13.747 -14.504 2.412 1.00 0.00 H new ATOM 0 HD2 LYS A 124 11.435 -15.157 1.455 1.00 0.00 H new ATOM 0 HD3 LYS A 124 11.155 -13.444 1.213 1.00 0.00 H new ATOM 0 HE2 LYS A 124 12.411 -13.438 -0.673 1.00 0.00 H new ATOM 0 HE3 LYS A 124 13.781 -14.125 0.176 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 13.041 -15.561 -1.599 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 12.814 -16.323 -0.098 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 11.487 -15.657 -0.921 1.00 0.00 H new ATOM 1912 N LEU A 125 13.419 -10.982 4.421 1.00 0.00 N ATOM 1913 CA LEU A 125 14.482 -9.983 4.307 1.00 0.00 C ATOM 1914 C LEU A 125 15.238 -9.894 5.630 1.00 0.00 C ATOM 1915 O LEU A 125 14.750 -10.233 6.707 1.00 0.00 O ATOM 1916 CB LEU A 125 13.959 -8.571 3.952 1.00 0.00 C ATOM 1917 CG LEU A 125 13.655 -8.293 2.468 1.00 0.00 C ATOM 1918 CD1 LEU A 125 12.878 -6.978 2.326 1.00 0.00 C ATOM 1919 CD2 LEU A 125 14.966 -8.149 1.685 1.00 0.00 C ATOM 0 H LEU A 125 12.481 -10.614 4.260 1.00 0.00 H new ATOM 0 HA LEU A 125 15.129 -10.311 3.494 1.00 0.00 H new ATOM 0 HB2 LEU A 125 13.048 -8.393 4.524 1.00 0.00 H new ATOM 0 HB3 LEU A 125 14.695 -7.842 4.290 1.00 0.00 H new ATOM 0 HG LEU A 125 13.067 -9.124 2.079 1.00 0.00 H new ATOM 0 HD11 LEU A 125 12.668 -6.791 1.273 1.00 0.00 H new ATOM 0 HD12 LEU A 125 11.939 -7.049 2.876 1.00 0.00 H new ATOM 0 HD13 LEU A 125 13.473 -6.158 2.728 1.00 0.00 H new ATOM 0 HD21 LEU A 125 14.744 -7.953 0.636 1.00 0.00 H new ATOM 0 HD22 LEU A 125 15.545 -7.321 2.094 1.00 0.00 H new ATOM 0 HD23 LEU A 125 15.542 -9.071 1.767 1.00 0.00 H new ATOM 1931 N ASN A 126 16.440 -9.341 5.539 1.00 0.00 N ATOM 1932 CA ASN A 126 17.325 -9.018 6.651 1.00 0.00 C ATOM 1933 C ASN A 126 17.005 -7.656 7.270 1.00 0.00 C ATOM 1934 O ASN A 126 17.652 -7.269 8.245 1.00 0.00 O ATOM 1935 CB ASN A 126 18.790 -9.049 6.183 1.00 0.00 C ATOM 1936 CG ASN A 126 19.005 -8.695 4.732 1.00 0.00 C ATOM 1937 OD1 ASN A 126 19.081 -9.553 3.860 1.00 0.00 O ATOM 1938 ND2 ASN A 126 19.057 -7.427 4.432 1.00 0.00 N ATOM 0 H ASN A 126 16.847 -9.092 4.637 1.00 0.00 H new ATOM 0 HA ASN A 126 17.167 -9.772 7.422 1.00 0.00 H new ATOM 0 HB2 ASN A 126 19.367 -8.359 6.799 1.00 0.00 H new ATOM 0 HB3 ASN A 126 19.191 -10.047 6.361 1.00 0.00 H new ATOM 0 HD21 ASN A 126 19.162 -7.137 3.460 1.00 0.00 H new ATOM 0 HD22 ASN A 126 18.992 -6.725 5.170 1.00 0.00 H new ATOM 1945 N TRP A 127 16.044 -6.918 6.727 1.00 0.00 N ATOM 1946 CA TRP A 127 15.611 -5.630 7.246 1.00 0.00 C ATOM 1947 C TRP A 127 14.096 -5.522 7.182 1.00 0.00 C ATOM 1948 O TRP A 127 13.430 -6.311 6.515 1.00 0.00 O ATOM 1949 CB TRP A 127 16.277 -4.483 6.472 1.00 0.00 C ATOM 1950 CG TRP A 127 15.922 -4.369 5.018 1.00 0.00 C ATOM 1951 CD1 TRP A 127 16.208 -5.281 4.060 1.00 0.00 C ATOM 1952 CD2 TRP A 127 15.216 -3.287 4.333 1.00 0.00 C ATOM 1953 NE1 TRP A 127 15.708 -4.859 2.849 1.00 0.00 N ATOM 1954 CE2 TRP A 127 15.036 -3.667 2.971 1.00 0.00 C ATOM 1955 CE3 TRP A 127 14.717 -2.022 4.712 1.00 0.00 C ATOM 1956 CZ2 TRP A 127 14.322 -2.886 2.061 1.00 0.00 C ATOM 1957 CZ3 TRP A 127 14.039 -1.202 3.789 1.00 0.00 C ATOM 1958 CH2 TRP A 127 13.816 -1.644 2.474 1.00 0.00 C ATOM 0 H TRP A 127 15.533 -7.208 5.893 1.00 0.00 H new ATOM 0 HA TRP A 127 15.917 -5.552 8.289 1.00 0.00 H new ATOM 0 HB2 TRP A 127 16.019 -3.544 6.962 1.00 0.00 H new ATOM 0 HB3 TRP A 127 17.358 -4.598 6.552 1.00 0.00 H new ATOM 0 HD1 TRP A 127 16.748 -6.202 4.222 1.00 0.00 H new ATOM 0 HE1 TRP A 127 15.822 -5.367 1.972 1.00 0.00 H new ATOM 0 HE3 TRP A 127 14.857 -1.677 5.726 1.00 0.00 H new ATOM 0 HZ2 TRP A 127 14.161 -3.233 1.051 1.00 0.00 H new ATOM 0 HZ3 TRP A 127 13.688 -0.227 4.094 1.00 0.00 H new ATOM 0 HH2 TRP A 127 13.257 -1.030 1.783 1.00 0.00 H new ATOM 1969 N ALA A 128 13.582 -4.499 7.858 1.00 0.00 N ATOM 1970 CA ALA A 128 12.176 -4.159 7.921 1.00 0.00 C ATOM 1971 C ALA A 128 12.042 -2.724 7.411 1.00 0.00 C ATOM 1972 O ALA A 128 12.412 -1.797 8.144 1.00 0.00 O ATOM 1973 CB ALA A 128 11.649 -4.301 9.351 1.00 0.00 C ATOM 0 H ALA A 128 14.165 -3.860 8.399 1.00 0.00 H new ATOM 0 HA ALA A 128 11.581 -4.834 7.306 1.00 0.00 H new ATOM 0 HB1 ALA A 128 10.591 -4.041 9.376 1.00 0.00 H new ATOM 0 HB2 ALA A 128 11.778 -5.330 9.686 1.00 0.00 H new ATOM 0 HB3 ALA A 128 12.203 -3.633 10.011 1.00 0.00 H new ATOM 1979 N PRO A 129 11.538 -2.518 6.184 1.00 0.00 N ATOM 1980 CA PRO A 129 11.126 -1.204 5.725 1.00 0.00 C ATOM 1981 C PRO A 129 10.090 -0.627 6.685 1.00 0.00 C ATOM 1982 O PRO A 129 9.375 -1.376 7.370 1.00 0.00 O ATOM 1983 CB PRO A 129 10.515 -1.389 4.332 1.00 0.00 C ATOM 1984 CG PRO A 129 10.820 -2.834 3.947 1.00 0.00 C ATOM 1985 CD PRO A 129 11.064 -3.534 5.271 1.00 0.00 C ATOM 0 HA PRO A 129 11.970 -0.515 5.686 1.00 0.00 H new ATOM 0 HB2 PRO A 129 9.441 -1.204 4.346 1.00 0.00 H new ATOM 0 HB3 PRO A 129 10.949 -0.691 3.616 1.00 0.00 H new ATOM 0 HG2 PRO A 129 9.988 -3.285 3.406 1.00 0.00 H new ATOM 0 HG3 PRO A 129 11.693 -2.896 3.298 1.00 0.00 H new ATOM 0 HD2 PRO A 129 10.148 -3.994 5.642 1.00 0.00 H new ATOM 0 HD3 PRO A 129 11.799 -4.331 5.160 1.00 0.00 H new ATOM 1993 N SER A 130 9.959 0.693 6.691 1.00 0.00 N ATOM 1994 CA SER A 130 8.827 1.362 7.305 1.00 0.00 C ATOM 1995 C SER A 130 7.561 0.884 6.587 1.00 0.00 C ATOM 1996 O SER A 130 7.610 0.535 5.403 1.00 0.00 O ATOM 1997 CB SER A 130 8.990 2.879 7.156 1.00 0.00 C ATOM 1998 OG SER A 130 10.347 3.285 7.285 1.00 0.00 O ATOM 0 H SER A 130 10.637 1.328 6.269 1.00 0.00 H new ATOM 0 HA SER A 130 8.763 1.129 8.368 1.00 0.00 H new ATOM 0 HB2 SER A 130 8.609 3.191 6.183 1.00 0.00 H new ATOM 0 HB3 SER A 130 8.387 3.384 7.911 1.00 0.00 H new ATOM 0 HG SER A 130 10.409 4.258 7.182 1.00 0.00 H new ATOM 2004 N MET A 131 6.415 0.900 7.266 1.00 0.00 N ATOM 2005 CA MET A 131 5.168 0.583 6.594 1.00 0.00 C ATOM 2006 C MET A 131 4.847 1.624 5.536 1.00 0.00 C ATOM 2007 O MET A 131 4.345 1.261 4.482 1.00 0.00 O ATOM 2008 CB MET A 131 4.008 0.467 7.582 1.00 0.00 C ATOM 2009 CG MET A 131 3.790 -0.985 7.987 1.00 0.00 C ATOM 2010 SD MET A 131 2.054 -1.360 8.298 1.00 0.00 S ATOM 2011 CE MET A 131 1.809 -0.477 9.857 1.00 0.00 C ATOM 0 H MET A 131 6.329 1.124 8.257 1.00 0.00 H new ATOM 0 HA MET A 131 5.298 -0.385 6.111 1.00 0.00 H new ATOM 0 HB2 MET A 131 4.215 1.069 8.466 1.00 0.00 H new ATOM 0 HB3 MET A 131 3.099 0.865 7.131 1.00 0.00 H new ATOM 0 HG2 MET A 131 4.164 -1.639 7.199 1.00 0.00 H new ATOM 0 HG3 MET A 131 4.371 -1.200 8.883 1.00 0.00 H new ATOM 0 HE1 MET A 131 0.875 -0.802 10.316 1.00 0.00 H new ATOM 0 HE2 MET A 131 2.639 -0.691 10.531 1.00 0.00 H new ATOM 0 HE3 MET A 131 1.765 0.595 9.665 1.00 0.00 H new ATOM 2021 N ASP A 132 5.133 2.903 5.766 1.00 0.00 N ATOM 2022 CA ASP A 132 4.856 3.932 4.769 1.00 0.00 C ATOM 2023 C ASP A 132 5.592 3.605 3.468 1.00 0.00 C ATOM 2024 O ASP A 132 4.966 3.630 2.413 1.00 0.00 O ATOM 2025 CB ASP A 132 5.174 5.326 5.310 1.00 0.00 C ATOM 2026 CG ASP A 132 4.259 5.721 6.450 1.00 0.00 C ATOM 2027 OD1 ASP A 132 4.475 5.203 7.570 1.00 0.00 O ATOM 2028 OD2 ASP A 132 3.331 6.528 6.241 1.00 0.00 O ATOM 0 H ASP A 132 5.554 3.250 6.628 1.00 0.00 H new ATOM 0 HA ASP A 132 3.790 3.940 4.542 1.00 0.00 H new ATOM 0 HB2 ASP A 132 6.209 5.354 5.651 1.00 0.00 H new ATOM 0 HB3 ASP A 132 5.084 6.055 4.505 1.00 0.00 H new ATOM 2033 N VAL A 133 6.859 3.181 3.547 1.00 0.00 N ATOM 2034 CA VAL A 133 7.646 2.674 2.425 1.00 0.00 C ATOM 2035 C VAL A 133 6.939 1.443 1.836 1.00 0.00 C ATOM 2036 O VAL A 133 6.400 1.517 0.738 1.00 0.00 O ATOM 2037 CB VAL A 133 9.112 2.445 2.880 1.00 0.00 C ATOM 2038 CG1 VAL A 133 9.961 1.633 1.892 1.00 0.00 C ATOM 2039 CG2 VAL A 133 9.820 3.790 3.137 1.00 0.00 C ATOM 0 H VAL A 133 7.379 3.183 4.425 1.00 0.00 H new ATOM 0 HA VAL A 133 7.711 3.396 1.611 1.00 0.00 H new ATOM 0 HB VAL A 133 9.031 1.861 3.797 1.00 0.00 H new ATOM 0 HG11 VAL A 133 10.970 1.520 2.287 1.00 0.00 H new ATOM 0 HG12 VAL A 133 9.514 0.649 1.751 1.00 0.00 H new ATOM 0 HG13 VAL A 133 10.002 2.153 0.935 1.00 0.00 H new ATOM 0 HG21 VAL A 133 10.846 3.606 3.455 1.00 0.00 H new ATOM 0 HG22 VAL A 133 9.824 4.380 2.220 1.00 0.00 H new ATOM 0 HG23 VAL A 133 9.291 4.336 3.918 1.00 0.00 H new ATOM 2049 N ALA A 134 6.877 0.306 2.538 1.00 0.00 N ATOM 2050 CA ALA A 134 6.442 -0.952 1.917 1.00 0.00 C ATOM 2051 C ALA A 134 4.943 -1.020 1.583 1.00 0.00 C ATOM 2052 O ALA A 134 4.521 -1.899 0.838 1.00 0.00 O ATOM 2053 CB ALA A 134 6.812 -2.123 2.821 1.00 0.00 C ATOM 0 H ALA A 134 7.119 0.230 3.526 1.00 0.00 H new ATOM 0 HA ALA A 134 6.964 -1.005 0.962 1.00 0.00 H new ATOM 0 HB1 ALA A 134 6.489 -3.056 2.359 1.00 0.00 H new ATOM 0 HB2 ALA A 134 7.892 -2.145 2.965 1.00 0.00 H new ATOM 0 HB3 ALA A 134 6.320 -2.007 3.787 1.00 0.00 H new ATOM 2059 N VAL A 135 4.108 -0.140 2.122 1.00 0.00 N ATOM 2060 CA VAL A 135 2.711 -0.003 1.722 1.00 0.00 C ATOM 2061 C VAL A 135 2.599 1.070 0.621 1.00 0.00 C ATOM 2062 O VAL A 135 1.651 1.031 -0.153 1.00 0.00 O ATOM 2063 CB VAL A 135 1.827 0.253 2.970 1.00 0.00 C ATOM 2064 CG1 VAL A 135 0.332 0.193 2.639 1.00 0.00 C ATOM 2065 CG2 VAL A 135 2.032 -0.797 4.091 1.00 0.00 C ATOM 0 H VAL A 135 4.385 0.508 2.859 1.00 0.00 H new ATOM 0 HA VAL A 135 2.333 -0.926 1.283 1.00 0.00 H new ATOM 0 HB VAL A 135 2.134 1.244 3.304 1.00 0.00 H new ATOM 0 HG11 VAL A 135 -0.248 0.378 3.543 1.00 0.00 H new ATOM 0 HG12 VAL A 135 0.094 0.951 1.893 1.00 0.00 H new ATOM 0 HG13 VAL A 135 0.086 -0.793 2.245 1.00 0.00 H new ATOM 0 HG21 VAL A 135 1.384 -0.560 4.935 1.00 0.00 H new ATOM 0 HG22 VAL A 135 1.784 -1.788 3.711 1.00 0.00 H new ATOM 0 HG23 VAL A 135 3.072 -0.783 4.417 1.00 0.00 H new ATOM 2075 N GLY A 136 3.569 1.975 0.498 1.00 0.00 N ATOM 2076 CA GLY A 136 3.725 2.922 -0.595 1.00 0.00 C ATOM 2077 C GLY A 136 4.177 2.235 -1.888 1.00 0.00 C ATOM 2078 O GLY A 136 3.584 2.474 -2.937 1.00 0.00 O ATOM 0 H GLY A 136 4.305 2.069 1.198 1.00 0.00 H new ATOM 0 HA2 GLY A 136 2.779 3.435 -0.768 1.00 0.00 H new ATOM 0 HA3 GLY A 136 4.453 3.683 -0.315 1.00 0.00 H new ATOM 2082 N GLU A 137 5.188 1.363 -1.818 1.00 0.00 N ATOM 2083 CA GLU A 137 5.884 0.786 -2.976 1.00 0.00 C ATOM 2084 C GLU A 137 4.902 -0.055 -3.781 1.00 0.00 C ATOM 2085 O GLU A 137 4.702 0.141 -4.974 1.00 0.00 O ATOM 2086 CB GLU A 137 7.085 -0.056 -2.524 1.00 0.00 C ATOM 2087 CG GLU A 137 8.131 0.834 -1.832 1.00 0.00 C ATOM 2088 CD GLU A 137 9.528 0.886 -2.462 1.00 0.00 C ATOM 2089 OE1 GLU A 137 9.642 0.894 -3.705 1.00 0.00 O ATOM 2090 OE2 GLU A 137 10.479 1.095 -1.670 1.00 0.00 O ATOM 0 H GLU A 137 5.557 1.028 -0.928 1.00 0.00 H new ATOM 0 HA GLU A 137 6.266 1.590 -3.605 1.00 0.00 H new ATOM 0 HB2 GLU A 137 6.753 -0.837 -1.840 1.00 0.00 H new ATOM 0 HB3 GLU A 137 7.533 -0.554 -3.384 1.00 0.00 H new ATOM 0 HG2 GLU A 137 7.739 1.850 -1.794 1.00 0.00 H new ATOM 0 HG3 GLU A 137 8.237 0.494 -0.802 1.00 0.00 H new ATOM 2097 N ILE A 138 4.165 -0.920 -3.083 1.00 0.00 N ATOM 2098 CA ILE A 138 3.217 -1.809 -3.750 1.00 0.00 C ATOM 2099 C ILE A 138 2.133 -1.032 -4.506 1.00 0.00 C ATOM 2100 O ILE A 138 1.554 -1.547 -5.455 1.00 0.00 O ATOM 2101 CB ILE A 138 2.638 -2.816 -2.739 1.00 0.00 C ATOM 2102 CG1 ILE A 138 1.750 -3.864 -3.439 1.00 0.00 C ATOM 2103 CG2 ILE A 138 1.918 -2.130 -1.557 1.00 0.00 C ATOM 2104 CD1 ILE A 138 1.560 -5.169 -2.656 1.00 0.00 C ATOM 0 H ILE A 138 4.206 -1.023 -2.069 1.00 0.00 H new ATOM 0 HA ILE A 138 3.751 -2.376 -4.512 1.00 0.00 H new ATOM 0 HB ILE A 138 3.483 -3.347 -2.301 1.00 0.00 H new ATOM 0 HG12 ILE A 138 0.771 -3.423 -3.627 1.00 0.00 H new ATOM 0 HG13 ILE A 138 2.186 -4.099 -4.410 1.00 0.00 H new ATOM 0 HG21 ILE A 138 1.531 -2.889 -0.877 1.00 0.00 H new ATOM 0 HG22 ILE A 138 2.622 -1.491 -1.024 1.00 0.00 H new ATOM 0 HG23 ILE A 138 1.093 -1.526 -1.935 1.00 0.00 H new ATOM 0 HD11 ILE A 138 0.922 -5.845 -3.225 1.00 0.00 H new ATOM 0 HD12 ILE A 138 2.530 -5.638 -2.490 1.00 0.00 H new ATOM 0 HD13 ILE A 138 1.093 -4.952 -1.695 1.00 0.00 H new ATOM 2116 N LEU A 139 1.839 0.204 -4.102 1.00 0.00 N ATOM 2117 CA LEU A 139 0.840 1.041 -4.747 1.00 0.00 C ATOM 2118 C LEU A 139 1.405 1.777 -5.944 1.00 0.00 C ATOM 2119 O LEU A 139 0.724 1.931 -6.954 1.00 0.00 O ATOM 2120 CB LEU A 139 0.329 2.062 -3.742 1.00 0.00 C ATOM 2121 CG LEU A 139 -0.500 1.436 -2.610 1.00 0.00 C ATOM 2122 CD1 LEU A 139 -1.041 2.567 -1.738 1.00 0.00 C ATOM 2123 CD2 LEU A 139 -1.642 0.539 -3.091 1.00 0.00 C ATOM 0 H LEU A 139 2.296 0.653 -3.308 1.00 0.00 H new ATOM 0 HA LEU A 139 0.035 0.394 -5.096 1.00 0.00 H new ATOM 0 HB2 LEU A 139 1.177 2.594 -3.311 1.00 0.00 H new ATOM 0 HB3 LEU A 139 -0.279 2.801 -4.263 1.00 0.00 H new ATOM 0 HG LEU A 139 0.159 0.776 -2.046 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -1.634 2.148 -0.925 1.00 0.00 H new ATOM 0 HD12 LEU A 139 -0.209 3.137 -1.324 1.00 0.00 H new ATOM 0 HD13 LEU A 139 -1.666 3.225 -2.342 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -2.177 0.137 -2.230 1.00 0.00 H new ATOM 0 HD22 LEU A 139 -2.329 1.122 -3.705 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -1.236 -0.282 -3.681 1.00 0.00 H new ATOM 2135 N ALA A 140 2.645 2.234 -5.831 1.00 0.00 N ATOM 2136 CA ALA A 140 3.428 2.637 -6.989 1.00 0.00 C ATOM 2137 C ALA A 140 3.370 1.569 -8.088 1.00 0.00 C ATOM 2138 O ALA A 140 3.381 1.928 -9.260 1.00 0.00 O ATOM 2139 CB ALA A 140 4.875 2.959 -6.595 1.00 0.00 C ATOM 0 H ALA A 140 3.133 2.335 -4.941 1.00 0.00 H new ATOM 0 HA ALA A 140 2.989 3.550 -7.391 1.00 0.00 H new ATOM 0 HB1 ALA A 140 5.436 3.257 -7.481 1.00 0.00 H new ATOM 0 HB2 ALA A 140 4.882 3.773 -5.870 1.00 0.00 H new ATOM 0 HB3 ALA A 140 5.337 2.076 -6.153 1.00 0.00 H new ATOM 2145 N GLU A 141 3.266 0.283 -7.751 1.00 0.00 N ATOM 2146 CA GLU A 141 3.555 -0.800 -8.681 1.00 0.00 C ATOM 2147 C GLU A 141 2.316 -1.563 -9.176 1.00 0.00 C ATOM 2148 O GLU A 141 2.152 -1.694 -10.394 1.00 0.00 O ATOM 2149 CB GLU A 141 4.582 -1.711 -8.001 1.00 0.00 C ATOM 2150 CG GLU A 141 5.953 -1.026 -8.009 1.00 0.00 C ATOM 2151 CD GLU A 141 7.013 -1.788 -7.233 1.00 0.00 C ATOM 2152 OE1 GLU A 141 7.713 -2.570 -7.910 1.00 0.00 O ATOM 2153 OE2 GLU A 141 7.213 -1.485 -6.035 1.00 0.00 O ATOM 0 H GLU A 141 2.979 -0.033 -6.825 1.00 0.00 H new ATOM 0 HA GLU A 141 3.960 -0.379 -9.602 1.00 0.00 H new ATOM 0 HB2 GLU A 141 4.275 -1.923 -6.977 1.00 0.00 H new ATOM 0 HB3 GLU A 141 4.638 -2.667 -8.521 1.00 0.00 H new ATOM 0 HG2 GLU A 141 6.285 -0.906 -9.040 1.00 0.00 H new ATOM 0 HG3 GLU A 141 5.854 -0.026 -7.587 1.00 0.00 H new ATOM 2160 N VAL A 142 1.493 -2.117 -8.276 1.00 0.00 N ATOM 2161 CA VAL A 142 0.403 -3.051 -8.587 1.00 0.00 C ATOM 2162 C VAL A 142 -0.662 -2.339 -9.423 1.00 0.00 C ATOM 2163 O VAL A 142 -0.783 -2.630 -10.631 1.00 0.00 O ATOM 2164 CB VAL A 142 -0.131 -3.680 -7.277 1.00 0.00 C ATOM 2165 CG1 VAL A 142 -1.512 -4.337 -7.403 1.00 0.00 C ATOM 2166 CG2 VAL A 142 0.868 -4.745 -6.793 1.00 0.00 C ATOM 0 H VAL A 142 1.570 -1.921 -7.278 1.00 0.00 H new ATOM 0 HA VAL A 142 0.760 -3.881 -9.197 1.00 0.00 H new ATOM 0 HB VAL A 142 -0.240 -2.857 -6.570 1.00 0.00 H new ATOM 0 HG11 VAL A 142 -1.807 -4.751 -6.439 1.00 0.00 H new ATOM 0 HG12 VAL A 142 -2.242 -3.591 -7.717 1.00 0.00 H new ATOM 0 HG13 VAL A 142 -1.469 -5.136 -8.143 1.00 0.00 H new ATOM 0 HG21 VAL A 142 0.502 -5.195 -5.870 1.00 0.00 H new ATOM 0 HG22 VAL A 142 0.975 -5.517 -7.555 1.00 0.00 H new ATOM 0 HG23 VAL A 142 1.836 -4.279 -6.610 1.00 0.00 H new TER 2176 VAL A 142