USER MOD reduce.3.24.130724 H: found=0, std=0, add=986, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 989 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 64 SER OG : rot -102:sc= 1.26 USER MOD Set 1.2: A 135 HIS : no HD1:sc= 1.07 K(o=2.3,f=-1.5) USER MOD Set 2.1: A 117 ASN : amide:sc= -2.35! K(o=-2.3!,f=-0.05) USER MOD Set 2.2: A 122 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 18 LYS NZ :NH3+ 156:sc= 0.989 (180deg=-0.839) USER MOD Set 3.2: A 24 THR OG1 : rot 161:sc= 1.1 USER MOD Set 4.1: A 2 SER OG : rot -15:sc= 0.421 USER MOD Set 4.2: A 6 GLN : amide:sc= 0.171 K(o=0.59,f=1.8) USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 7 SER OG : rot 180:sc= 0.00912 USER MOD Single : A 8 ASN : amide:sc= -2.35! C(o=-2.3!,f=-3.7!) USER MOD Single : A 9 SER OG : rot 64:sc= -1.97! USER MOD Single : A 14 HIS : no HE2:sc= -3.61! C(o=-3.6!,f=-11!) USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 27 SER OG : rot 180:sc= -1.5 USER MOD Single : A 28 THR OG1 : rot 144:sc= 1.14 USER MOD Single : A 30 ASN : amide:sc= -0.838 K(o=-0.84,f=-0.17) USER MOD Single : A 31 ASN : amide:sc= 0.391 K(o=0.39,f=-0.94) USER MOD Single : A 33 LYS NZ :NH3+ -168:sc= 0.946 (180deg=0.755) USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 45 SER OG : rot 154:sc= -0.157 USER MOD Single : A 50 GLN : amide:sc= -1.13 K(o=-1.1,f=-5.5!) USER MOD Single : A 51 HIS : no HD1:sc= -1.13 K(o=-1.1,f=0.054) USER MOD Single : A 56 LYS NZ :NH3+ 167:sc= -0.0599 (180deg=-0.293) USER MOD Single : A 60 LYS NZ :NH3+ -176:sc= 1.21 (180deg=1.1) USER MOD Single : A 61 THR OG1 : rot 6:sc= -0.0883 USER MOD Single : A 62 THR OG1 : rot -133:sc= 1.3 USER MOD Single : A 75 SER OG : rot 26:sc= 0.0967 USER MOD Single : A 80 GLN : amide:sc= -1.82 K(o=-1.8,f=-2.7) USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 SER OG : rot 28:sc= 0.26 USER MOD Single : A 88 MET CE :methyl -164:sc= -0.112 (180deg=-0.497) USER MOD Single : A 99 MET CE :methyl 128:sc= -0.0997 (180deg=-0.942) USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 104 MET CE :methyl -108:sc= -0.106 (180deg=-1.26) USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 109 MET CE :methyl -117:sc= -0.484 (180deg=-3.56!) USER MOD Single : A 120 SER OG : rot 15:sc= 0.051 USER MOD Single : A 126 ASN : amide:sc= -0.0231 X(o=-0.023,f=0) USER MOD Single : A 133 THR OG1 : rot 25:sc= 0.186 USER MOD ----------------------------------------------------------------- ATOM 20 N SER A 2 22.711 -5.699 7.288 1.00 0.00 N ATOM 21 CA SER A 2 22.262 -4.916 6.150 1.00 0.00 C ATOM 22 C SER A 2 22.458 -3.431 6.434 1.00 0.00 C ATOM 23 O SER A 2 21.531 -2.738 6.855 1.00 0.00 O ATOM 24 CB SER A 2 20.789 -5.211 5.842 1.00 0.00 C ATOM 25 OG SER A 2 20.389 -4.643 4.606 1.00 0.00 O ATOM 0 HA SER A 2 22.855 -5.191 5.278 1.00 0.00 H new ATOM 0 HB2 SER A 2 20.631 -6.289 5.815 1.00 0.00 H new ATOM 0 HB3 SER A 2 20.164 -4.817 6.643 1.00 0.00 H new ATOM 0 HG SER A 2 21.057 -3.988 4.315 1.00 0.00 H new ATOM 31 N GLU A 3 23.677 -2.958 6.220 1.00 0.00 N ATOM 32 CA GLU A 3 24.007 -1.558 6.433 1.00 0.00 C ATOM 33 C GLU A 3 23.425 -0.718 5.308 1.00 0.00 C ATOM 34 O GLU A 3 23.065 0.442 5.497 1.00 0.00 O ATOM 35 CB GLU A 3 25.524 -1.375 6.487 1.00 0.00 C ATOM 36 CG GLU A 3 26.218 -2.328 7.437 1.00 0.00 C ATOM 37 CD GLU A 3 27.724 -2.194 7.391 1.00 0.00 C ATOM 38 OE1 GLU A 3 28.331 -2.567 6.363 1.00 0.00 O ATOM 39 OE2 GLU A 3 28.311 -1.711 8.378 1.00 0.00 O ATOM 0 H GLU A 3 24.458 -3.528 5.897 1.00 0.00 H new ATOM 0 HA GLU A 3 23.581 -1.234 7.382 1.00 0.00 H new ATOM 0 HB2 GLU A 3 25.933 -1.511 5.486 1.00 0.00 H new ATOM 0 HB3 GLU A 3 25.747 -0.351 6.786 1.00 0.00 H new ATOM 0 HG2 GLU A 3 25.870 -2.141 8.453 1.00 0.00 H new ATOM 0 HG3 GLU A 3 25.939 -3.352 7.188 1.00 0.00 H new ATOM 46 N SER A 4 23.329 -1.335 4.147 1.00 0.00 N ATOM 47 CA SER A 4 22.827 -0.686 2.950 1.00 0.00 C ATOM 48 C SER A 4 21.550 -1.383 2.494 1.00 0.00 C ATOM 49 O SER A 4 21.360 -2.575 2.751 1.00 0.00 O ATOM 50 CB SER A 4 23.897 -0.758 1.850 1.00 0.00 C ATOM 51 OG SER A 4 23.436 -0.207 0.625 1.00 0.00 O ATOM 0 H SER A 4 23.599 -2.308 4.006 1.00 0.00 H new ATOM 0 HA SER A 4 22.602 0.360 3.159 1.00 0.00 H new ATOM 0 HB2 SER A 4 24.789 -0.223 2.176 1.00 0.00 H new ATOM 0 HB3 SER A 4 24.188 -1.797 1.694 1.00 0.00 H new ATOM 0 HG SER A 4 24.145 -0.269 -0.049 1.00 0.00 H new ATOM 57 N VAL A 5 20.669 -0.638 1.839 1.00 0.00 N ATOM 58 CA VAL A 5 19.446 -1.207 1.302 1.00 0.00 C ATOM 59 C VAL A 5 19.754 -2.062 0.081 1.00 0.00 C ATOM 60 O VAL A 5 20.376 -1.600 -0.878 1.00 0.00 O ATOM 61 CB VAL A 5 18.416 -0.119 0.922 1.00 0.00 C ATOM 62 CG1 VAL A 5 17.182 -0.739 0.278 1.00 0.00 C ATOM 63 CG2 VAL A 5 18.020 0.682 2.147 1.00 0.00 C ATOM 0 H VAL A 5 20.781 0.361 1.668 1.00 0.00 H new ATOM 0 HA VAL A 5 19.008 -1.825 2.086 1.00 0.00 H new ATOM 0 HB VAL A 5 18.881 0.550 0.197 1.00 0.00 H new ATOM 0 HG11 VAL A 5 16.472 0.047 0.020 1.00 0.00 H new ATOM 0 HG12 VAL A 5 17.474 -1.276 -0.625 1.00 0.00 H new ATOM 0 HG13 VAL A 5 16.716 -1.433 0.978 1.00 0.00 H new ATOM 0 HG21 VAL A 5 17.294 1.444 1.864 1.00 0.00 H new ATOM 0 HG22 VAL A 5 17.578 0.017 2.889 1.00 0.00 H new ATOM 0 HG23 VAL A 5 18.903 1.161 2.570 1.00 0.00 H new ATOM 73 N GLN A 6 19.311 -3.304 0.128 1.00 0.00 N ATOM 74 CA GLN A 6 19.536 -4.242 -0.958 1.00 0.00 C ATOM 75 C GLN A 6 18.197 -4.698 -1.507 1.00 0.00 C ATOM 76 O GLN A 6 17.158 -4.450 -0.894 1.00 0.00 O ATOM 77 CB GLN A 6 20.360 -5.436 -0.487 1.00 0.00 C ATOM 78 CG GLN A 6 19.644 -6.298 0.521 1.00 0.00 C ATOM 79 CD GLN A 6 20.607 -7.040 1.411 1.00 0.00 C ATOM 80 OE1 GLN A 6 20.988 -8.179 1.137 1.00 0.00 O ATOM 81 NE2 GLN A 6 21.021 -6.388 2.476 1.00 0.00 N ATOM 0 H GLN A 6 18.788 -3.690 0.914 1.00 0.00 H new ATOM 0 HA GLN A 6 20.101 -3.745 -1.747 1.00 0.00 H new ATOM 0 HB2 GLN A 6 20.628 -6.046 -1.350 1.00 0.00 H new ATOM 0 HB3 GLN A 6 21.291 -5.075 -0.049 1.00 0.00 H new ATOM 0 HG2 GLN A 6 18.991 -5.675 1.132 1.00 0.00 H new ATOM 0 HG3 GLN A 6 19.007 -7.013 0.000 1.00 0.00 H new ATOM 0 HE21 GLN A 6 20.678 -5.446 2.662 1.00 0.00 H new ATOM 0 HE22 GLN A 6 21.685 -6.825 3.115 1.00 0.00 H new ATOM 90 N SER A 7 18.202 -5.339 -2.656 1.00 0.00 N ATOM 91 CA SER A 7 16.973 -5.848 -3.225 1.00 0.00 C ATOM 92 C SER A 7 16.374 -6.910 -2.302 1.00 0.00 C ATOM 93 O SER A 7 17.093 -7.782 -1.805 1.00 0.00 O ATOM 94 CB SER A 7 17.249 -6.404 -4.619 1.00 0.00 C ATOM 95 OG SER A 7 18.408 -7.224 -4.617 1.00 0.00 O ATOM 0 H SER A 7 19.038 -5.519 -3.212 1.00 0.00 H new ATOM 0 HA SER A 7 16.245 -5.042 -3.320 1.00 0.00 H new ATOM 0 HB2 SER A 7 16.390 -6.982 -4.961 1.00 0.00 H new ATOM 0 HB3 SER A 7 17.381 -5.582 -5.323 1.00 0.00 H new ATOM 0 HG SER A 7 18.565 -7.571 -5.520 1.00 0.00 H new ATOM 101 N ASN A 8 15.067 -6.802 -2.062 1.00 0.00 N ATOM 102 CA ASN A 8 14.341 -7.694 -1.145 1.00 0.00 C ATOM 103 C ASN A 8 14.670 -7.410 0.327 1.00 0.00 C ATOM 104 O ASN A 8 14.721 -8.328 1.148 1.00 0.00 O ATOM 105 CB ASN A 8 14.599 -9.176 -1.467 1.00 0.00 C ATOM 106 CG ASN A 8 13.793 -9.666 -2.654 1.00 0.00 C ATOM 107 OD1 ASN A 8 12.667 -10.135 -2.501 1.00 0.00 O ATOM 108 ND2 ASN A 8 14.362 -9.574 -3.844 1.00 0.00 N ATOM 0 H ASN A 8 14.477 -6.093 -2.497 1.00 0.00 H new ATOM 0 HA ASN A 8 13.282 -7.486 -1.298 1.00 0.00 H new ATOM 0 HB2 ASN A 8 15.660 -9.320 -1.669 1.00 0.00 H new ATOM 0 HB3 ASN A 8 14.356 -9.781 -0.593 1.00 0.00 H new ATOM 0 HD21 ASN A 8 13.865 -9.898 -4.674 1.00 0.00 H new ATOM 0 HD22 ASN A 8 15.298 -9.179 -3.932 1.00 0.00 H new ATOM 115 N SER A 9 14.890 -6.140 0.665 1.00 0.00 N ATOM 116 CA SER A 9 15.061 -5.745 2.061 1.00 0.00 C ATOM 117 C SER A 9 13.731 -5.319 2.669 1.00 0.00 C ATOM 118 O SER A 9 12.743 -5.120 1.963 1.00 0.00 O ATOM 119 CB SER A 9 16.048 -4.582 2.184 1.00 0.00 C ATOM 120 OG SER A 9 17.305 -4.917 1.642 1.00 0.00 O ATOM 0 H SER A 9 14.954 -5.373 -0.004 1.00 0.00 H new ATOM 0 HA SER A 9 15.450 -6.611 2.597 1.00 0.00 H new ATOM 0 HB2 SER A 9 15.649 -3.708 1.669 1.00 0.00 H new ATOM 0 HB3 SER A 9 16.163 -4.309 3.233 1.00 0.00 H new ATOM 0 HG SER A 9 17.213 -5.083 0.681 1.00 0.00 H new ATOM 126 N ALA A 10 13.717 -5.199 3.982 1.00 0.00 N ATOM 127 CA ALA A 10 12.593 -4.618 4.681 1.00 0.00 C ATOM 128 C ALA A 10 13.053 -3.335 5.355 1.00 0.00 C ATOM 129 O ALA A 10 13.935 -3.358 6.203 1.00 0.00 O ATOM 130 CB ALA A 10 12.036 -5.603 5.698 1.00 0.00 C ATOM 0 H ALA A 10 14.480 -5.500 4.589 1.00 0.00 H new ATOM 0 HA ALA A 10 11.793 -4.388 3.977 1.00 0.00 H new ATOM 0 HB1 ALA A 10 11.190 -5.151 6.216 1.00 0.00 H new ATOM 0 HB2 ALA A 10 11.707 -6.507 5.186 1.00 0.00 H new ATOM 0 HB3 ALA A 10 12.811 -5.857 6.421 1.00 0.00 H new ATOM 136 N VAL A 11 12.475 -2.212 4.974 1.00 0.00 N ATOM 137 CA VAL A 11 12.954 -0.934 5.481 1.00 0.00 C ATOM 138 C VAL A 11 11.813 -0.123 6.072 1.00 0.00 C ATOM 139 O VAL A 11 10.688 -0.164 5.580 1.00 0.00 O ATOM 140 CB VAL A 11 13.702 -0.098 4.408 1.00 0.00 C ATOM 141 CG1 VAL A 11 14.729 -0.949 3.675 1.00 0.00 C ATOM 142 CG2 VAL A 11 12.745 0.559 3.427 1.00 0.00 C ATOM 0 H VAL A 11 11.688 -2.154 4.328 1.00 0.00 H new ATOM 0 HA VAL A 11 13.674 -1.168 6.265 1.00 0.00 H new ATOM 0 HB VAL A 11 14.227 0.701 4.932 1.00 0.00 H new ATOM 0 HG11 VAL A 11 15.240 -0.341 2.929 1.00 0.00 H new ATOM 0 HG12 VAL A 11 15.457 -1.335 4.388 1.00 0.00 H new ATOM 0 HG13 VAL A 11 14.227 -1.782 3.183 1.00 0.00 H new ATOM 0 HG21 VAL A 11 13.312 1.133 2.695 1.00 0.00 H new ATOM 0 HG22 VAL A 11 12.165 -0.209 2.915 1.00 0.00 H new ATOM 0 HG23 VAL A 11 12.071 1.224 3.967 1.00 0.00 H new ATOM 152 N LEU A 12 12.106 0.581 7.152 1.00 0.00 N ATOM 153 CA LEU A 12 11.136 1.460 7.782 1.00 0.00 C ATOM 154 C LEU A 12 11.310 2.865 7.246 1.00 0.00 C ATOM 155 O LEU A 12 12.430 3.369 7.156 1.00 0.00 O ATOM 156 CB LEU A 12 11.300 1.462 9.303 1.00 0.00 C ATOM 157 CG LEU A 12 10.864 0.180 10.019 1.00 0.00 C ATOM 158 CD1 LEU A 12 11.250 0.231 11.490 1.00 0.00 C ATOM 159 CD2 LEU A 12 9.361 -0.028 9.875 1.00 0.00 C ATOM 0 H LEU A 12 13.015 0.560 7.614 1.00 0.00 H new ATOM 0 HA LEU A 12 10.135 1.095 7.550 1.00 0.00 H new ATOM 0 HB2 LEU A 12 12.348 1.649 9.537 1.00 0.00 H new ATOM 0 HB3 LEU A 12 10.729 2.296 9.711 1.00 0.00 H new ATOM 0 HG LEU A 12 11.378 -0.662 9.555 1.00 0.00 H new ATOM 0 HD11 LEU A 12 10.932 -0.688 11.982 1.00 0.00 H new ATOM 0 HD12 LEU A 12 12.331 0.335 11.579 1.00 0.00 H new ATOM 0 HD13 LEU A 12 10.763 1.083 11.964 1.00 0.00 H new ATOM 0 HD21 LEU A 12 9.069 -0.943 10.390 1.00 0.00 H new ATOM 0 HD22 LEU A 12 8.833 0.819 10.313 1.00 0.00 H new ATOM 0 HD23 LEU A 12 9.104 -0.108 8.819 1.00 0.00 H new ATOM 171 N VAL A 13 10.210 3.489 6.888 1.00 0.00 N ATOM 172 CA VAL A 13 10.252 4.795 6.258 1.00 0.00 C ATOM 173 C VAL A 13 9.287 5.776 6.902 1.00 0.00 C ATOM 174 O VAL A 13 8.405 5.398 7.679 1.00 0.00 O ATOM 175 CB VAL A 13 9.899 4.701 4.762 1.00 0.00 C ATOM 176 CG1 VAL A 13 10.984 3.980 3.991 1.00 0.00 C ATOM 177 CG2 VAL A 13 8.566 3.995 4.572 1.00 0.00 C ATOM 0 H VAL A 13 9.271 3.114 7.022 1.00 0.00 H new ATOM 0 HA VAL A 13 11.272 5.156 6.387 1.00 0.00 H new ATOM 0 HB VAL A 13 9.819 5.716 4.373 1.00 0.00 H new ATOM 0 HG11 VAL A 13 10.709 3.928 2.938 1.00 0.00 H new ATOM 0 HG12 VAL A 13 11.924 4.521 4.094 1.00 0.00 H new ATOM 0 HG13 VAL A 13 11.101 2.971 4.386 1.00 0.00 H new ATOM 0 HG21 VAL A 13 8.333 3.938 3.509 1.00 0.00 H new ATOM 0 HG22 VAL A 13 8.625 2.988 4.985 1.00 0.00 H new ATOM 0 HG23 VAL A 13 7.783 4.552 5.086 1.00 0.00 H new ATOM 187 N HIS A 14 9.463 7.041 6.559 1.00 0.00 N ATOM 188 CA HIS A 14 8.481 8.080 6.827 1.00 0.00 C ATOM 189 C HIS A 14 8.348 8.888 5.544 1.00 0.00 C ATOM 190 O HIS A 14 9.311 9.512 5.105 1.00 0.00 O ATOM 191 CB HIS A 14 8.922 9.005 7.966 1.00 0.00 C ATOM 192 CG HIS A 14 8.174 8.811 9.250 1.00 0.00 C ATOM 193 ND1 HIS A 14 6.831 8.513 9.308 1.00 0.00 N ATOM 194 CD2 HIS A 14 8.591 8.883 10.535 1.00 0.00 C ATOM 195 CE1 HIS A 14 6.458 8.410 10.568 1.00 0.00 C ATOM 196 NE2 HIS A 14 7.508 8.628 11.332 1.00 0.00 N ATOM 0 H HIS A 14 10.299 7.379 6.082 1.00 0.00 H new ATOM 0 HA HIS A 14 7.538 7.627 7.133 1.00 0.00 H new ATOM 0 HB2 HIS A 14 9.985 8.850 8.152 1.00 0.00 H new ATOM 0 HB3 HIS A 14 8.803 10.039 7.644 1.00 0.00 H new ATOM 0 HD1 HIS A 14 6.219 8.391 8.501 1.00 0.00 H new ATOM 0 HD2 HIS A 14 9.594 9.102 10.870 1.00 0.00 H new ATOM 0 HE1 HIS A 14 5.460 8.185 10.915 1.00 0.00 H new ATOM 205 N PHE A 15 7.179 8.862 4.933 1.00 0.00 N ATOM 206 CA PHE A 15 7.016 9.444 3.606 1.00 0.00 C ATOM 207 C PHE A 15 5.634 10.052 3.455 1.00 0.00 C ATOM 208 O PHE A 15 4.709 9.661 4.161 1.00 0.00 O ATOM 209 CB PHE A 15 7.221 8.359 2.540 1.00 0.00 C ATOM 210 CG PHE A 15 6.179 7.275 2.571 1.00 0.00 C ATOM 211 CD1 PHE A 15 6.287 6.203 3.445 1.00 0.00 C ATOM 212 CD2 PHE A 15 5.086 7.335 1.725 1.00 0.00 C ATOM 213 CE1 PHE A 15 5.321 5.218 3.471 1.00 0.00 C ATOM 214 CE2 PHE A 15 4.122 6.353 1.747 1.00 0.00 C ATOM 215 CZ PHE A 15 4.237 5.292 2.620 1.00 0.00 C ATOM 0 H PHE A 15 6.333 8.449 5.326 1.00 0.00 H new ATOM 0 HA PHE A 15 7.759 10.231 3.477 1.00 0.00 H new ATOM 0 HB2 PHE A 15 7.218 8.825 1.555 1.00 0.00 H new ATOM 0 HB3 PHE A 15 8.204 7.909 2.677 1.00 0.00 H new ATOM 0 HD1 PHE A 15 7.135 6.139 4.111 1.00 0.00 H new ATOM 0 HD2 PHE A 15 4.988 8.163 1.039 1.00 0.00 H new ATOM 0 HE1 PHE A 15 5.413 4.389 4.157 1.00 0.00 H new ATOM 0 HE2 PHE A 15 3.275 6.414 1.080 1.00 0.00 H new ATOM 0 HZ PHE A 15 3.481 4.521 2.638 1.00 0.00 H new ATOM 225 N THR A 16 5.482 11.009 2.551 1.00 0.00 N ATOM 226 CA THR A 16 4.170 11.561 2.259 1.00 0.00 C ATOM 227 C THR A 16 3.827 11.384 0.778 1.00 0.00 C ATOM 228 O THR A 16 4.645 11.670 -0.100 1.00 0.00 O ATOM 229 CB THR A 16 4.106 13.060 2.616 1.00 0.00 C ATOM 230 OG1 THR A 16 4.463 13.259 3.995 1.00 0.00 O ATOM 231 CG2 THR A 16 2.712 13.618 2.363 1.00 0.00 C ATOM 0 H THR A 16 6.246 11.416 2.011 1.00 0.00 H new ATOM 0 HA THR A 16 3.446 11.019 2.867 1.00 0.00 H new ATOM 0 HB THR A 16 4.815 13.590 1.980 1.00 0.00 H new ATOM 0 HG1 THR A 16 4.420 14.214 4.209 1.00 0.00 H new ATOM 0 HG21 THR A 16 2.691 14.677 2.622 1.00 0.00 H new ATOM 0 HG22 THR A 16 2.457 13.497 1.310 1.00 0.00 H new ATOM 0 HG23 THR A 16 1.988 13.080 2.976 1.00 0.00 H new ATOM 239 N LEU A 17 2.627 10.880 0.516 1.00 0.00 N ATOM 240 CA LEU A 17 2.145 10.687 -0.845 1.00 0.00 C ATOM 241 C LEU A 17 1.240 11.813 -1.310 1.00 0.00 C ATOM 242 O LEU A 17 0.189 12.076 -0.720 1.00 0.00 O ATOM 243 CB LEU A 17 1.409 9.364 -0.940 1.00 0.00 C ATOM 244 CG LEU A 17 2.315 8.177 -1.200 1.00 0.00 C ATOM 245 CD1 LEU A 17 1.730 6.916 -0.641 1.00 0.00 C ATOM 246 CD2 LEU A 17 2.521 8.015 -2.679 1.00 0.00 C ATOM 0 H LEU A 17 1.964 10.595 1.237 1.00 0.00 H new ATOM 0 HA LEU A 17 3.016 10.684 -1.501 1.00 0.00 H new ATOM 0 HB2 LEU A 17 0.862 9.196 -0.012 1.00 0.00 H new ATOM 0 HB3 LEU A 17 0.670 9.427 -1.739 1.00 0.00 H new ATOM 0 HG LEU A 17 3.269 8.363 -0.707 1.00 0.00 H new ATOM 0 HD11 LEU A 17 2.402 6.082 -0.843 1.00 0.00 H new ATOM 0 HD12 LEU A 17 1.597 7.023 0.436 1.00 0.00 H new ATOM 0 HD13 LEU A 17 0.764 6.725 -1.108 1.00 0.00 H new ATOM 0 HD21 LEU A 17 3.173 7.161 -2.864 1.00 0.00 H new ATOM 0 HD22 LEU A 17 1.559 7.849 -3.164 1.00 0.00 H new ATOM 0 HD23 LEU A 17 2.981 8.917 -3.083 1.00 0.00 H new ATOM 258 N LYS A 18 1.648 12.444 -2.398 1.00 0.00 N ATOM 259 CA LYS A 18 0.918 13.560 -2.981 1.00 0.00 C ATOM 260 C LYS A 18 0.664 13.306 -4.466 1.00 0.00 C ATOM 261 O LYS A 18 1.506 12.731 -5.158 1.00 0.00 O ATOM 262 CB LYS A 18 1.728 14.849 -2.809 1.00 0.00 C ATOM 263 CG LYS A 18 1.111 15.869 -1.861 1.00 0.00 C ATOM 264 CD LYS A 18 0.880 15.297 -0.469 1.00 0.00 C ATOM 265 CE LYS A 18 0.736 16.404 0.566 1.00 0.00 C ATOM 266 NZ LYS A 18 0.203 15.906 1.861 1.00 0.00 N ATOM 0 H LYS A 18 2.498 12.197 -2.905 1.00 0.00 H new ATOM 0 HA LYS A 18 -0.040 13.662 -2.472 1.00 0.00 H new ATOM 0 HB2 LYS A 18 2.723 14.591 -2.445 1.00 0.00 H new ATOM 0 HB3 LYS A 18 1.857 15.314 -3.787 1.00 0.00 H new ATOM 0 HG2 LYS A 18 1.765 16.738 -1.790 1.00 0.00 H new ATOM 0 HG3 LYS A 18 0.163 16.216 -2.271 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -0.018 14.679 -0.472 1.00 0.00 H new ATOM 0 HD3 LYS A 18 1.712 14.648 -0.197 1.00 0.00 H new ATOM 0 HE2 LYS A 18 1.707 16.871 0.732 1.00 0.00 H new ATOM 0 HE3 LYS A 18 0.073 17.177 0.177 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 0.492 16.549 2.626 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -0.835 15.865 1.816 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 0.579 14.955 2.048 1.00 0.00 H new ATOM 280 N LEU A 19 -0.501 13.716 -4.946 1.00 0.00 N ATOM 281 CA LEU A 19 -0.827 13.611 -6.363 1.00 0.00 C ATOM 282 C LEU A 19 -0.381 14.877 -7.082 1.00 0.00 C ATOM 283 O LEU A 19 -0.041 15.868 -6.432 1.00 0.00 O ATOM 284 CB LEU A 19 -2.337 13.406 -6.585 1.00 0.00 C ATOM 285 CG LEU A 19 -2.929 12.072 -6.118 1.00 0.00 C ATOM 286 CD1 LEU A 19 -2.138 10.914 -6.694 1.00 0.00 C ATOM 287 CD2 LEU A 19 -2.988 11.986 -4.602 1.00 0.00 C ATOM 0 H LEU A 19 -1.239 14.126 -4.374 1.00 0.00 H new ATOM 0 HA LEU A 19 -0.304 12.743 -6.764 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -2.868 14.210 -6.075 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -2.542 13.514 -7.650 1.00 0.00 H new ATOM 0 HG LEU A 19 -3.953 12.013 -6.487 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -2.570 9.973 -6.354 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -2.172 10.956 -7.783 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -1.102 10.979 -6.360 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -3.413 11.026 -4.308 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -1.982 12.077 -4.193 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -3.611 12.793 -4.216 1.00 0.00 H new ATOM 299 N ASP A 20 -0.396 14.865 -8.410 1.00 0.00 N ATOM 300 CA ASP A 20 -0.042 16.059 -9.175 1.00 0.00 C ATOM 301 C ASP A 20 -1.093 17.142 -8.965 1.00 0.00 C ATOM 302 O ASP A 20 -0.825 18.332 -9.114 1.00 0.00 O ATOM 303 CB ASP A 20 0.107 15.744 -10.667 1.00 0.00 C ATOM 304 CG ASP A 20 -1.214 15.589 -11.401 1.00 0.00 C ATOM 305 OD1 ASP A 20 -1.749 16.604 -11.896 1.00 0.00 O ATOM 306 OD2 ASP A 20 -1.709 14.449 -11.511 1.00 0.00 O ATOM 0 H ASP A 20 -0.646 14.054 -8.975 1.00 0.00 H new ATOM 0 HA ASP A 20 0.922 16.419 -8.814 1.00 0.00 H new ATOM 0 HB2 ASP A 20 0.682 16.540 -11.140 1.00 0.00 H new ATOM 0 HB3 ASP A 20 0.683 14.825 -10.778 1.00 0.00 H new ATOM 311 N ASP A 21 -2.288 16.703 -8.597 1.00 0.00 N ATOM 312 CA ASP A 21 -3.388 17.610 -8.266 1.00 0.00 C ATOM 313 C ASP A 21 -3.177 18.270 -6.907 1.00 0.00 C ATOM 314 O ASP A 21 -4.006 19.056 -6.457 1.00 0.00 O ATOM 315 CB ASP A 21 -4.723 16.863 -8.245 1.00 0.00 C ATOM 316 CG ASP A 21 -5.158 16.379 -9.609 1.00 0.00 C ATOM 317 OD1 ASP A 21 -5.513 17.222 -10.459 1.00 0.00 O ATOM 318 OD2 ASP A 21 -5.156 15.153 -9.833 1.00 0.00 O ATOM 0 H ASP A 21 -2.526 15.714 -8.518 1.00 0.00 H new ATOM 0 HA ASP A 21 -3.408 18.379 -9.038 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -4.643 16.009 -7.572 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -5.492 17.519 -7.837 1.00 0.00 H new ATOM 323 N GLY A 22 -2.077 17.931 -6.246 1.00 0.00 N ATOM 324 CA GLY A 22 -1.791 18.486 -4.938 1.00 0.00 C ATOM 325 C GLY A 22 -2.675 17.887 -3.864 1.00 0.00 C ATOM 326 O GLY A 22 -2.791 18.425 -2.763 1.00 0.00 O ATOM 0 H GLY A 22 -1.375 17.278 -6.595 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -0.745 18.307 -4.689 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -1.932 19.567 -4.963 1.00 0.00 H new ATOM 330 N THR A 23 -3.304 16.777 -4.204 1.00 0.00 N ATOM 331 CA THR A 23 -4.125 16.028 -3.271 1.00 0.00 C ATOM 332 C THR A 23 -3.256 15.021 -2.521 1.00 0.00 C ATOM 333 O THR A 23 -2.230 14.583 -3.036 1.00 0.00 O ATOM 334 CB THR A 23 -5.247 15.292 -4.032 1.00 0.00 C ATOM 335 OG1 THR A 23 -5.948 16.222 -4.869 1.00 0.00 O ATOM 336 CG2 THR A 23 -6.229 14.620 -3.079 1.00 0.00 C ATOM 0 H THR A 23 -3.260 16.369 -5.138 1.00 0.00 H new ATOM 0 HA THR A 23 -4.577 16.716 -2.556 1.00 0.00 H new ATOM 0 HB THR A 23 -4.786 14.514 -4.640 1.00 0.00 H new ATOM 0 HG1 THR A 23 -6.660 15.754 -5.354 1.00 0.00 H new ATOM 0 HG21 THR A 23 -7.004 14.112 -3.653 1.00 0.00 H new ATOM 0 HG22 THR A 23 -5.699 13.893 -2.463 1.00 0.00 H new ATOM 0 HG23 THR A 23 -6.687 15.373 -2.438 1.00 0.00 H new ATOM 344 N THR A 24 -3.645 14.679 -1.305 1.00 0.00 N ATOM 345 CA THR A 24 -2.910 13.700 -0.525 1.00 0.00 C ATOM 346 C THR A 24 -3.518 12.310 -0.681 1.00 0.00 C ATOM 347 O THR A 24 -4.726 12.126 -0.518 1.00 0.00 O ATOM 348 CB THR A 24 -2.891 14.075 0.967 1.00 0.00 C ATOM 349 OG1 THR A 24 -2.392 15.408 1.127 1.00 0.00 O ATOM 350 CG2 THR A 24 -2.017 13.113 1.752 1.00 0.00 C ATOM 0 H THR A 24 -4.465 15.065 -0.837 1.00 0.00 H new ATOM 0 HA THR A 24 -1.888 13.692 -0.903 1.00 0.00 H new ATOM 0 HB THR A 24 -3.910 14.015 1.348 1.00 0.00 H new ATOM 0 HG1 THR A 24 -2.658 15.754 2.005 1.00 0.00 H new ATOM 0 HG21 THR A 24 -2.018 13.397 2.804 1.00 0.00 H new ATOM 0 HG22 THR A 24 -2.407 12.100 1.649 1.00 0.00 H new ATOM 0 HG23 THR A 24 -0.998 13.150 1.367 1.00 0.00 H new ATOM 358 N ALA A 25 -2.674 11.339 -1.009 1.00 0.00 N ATOM 359 CA ALA A 25 -3.105 9.952 -1.109 1.00 0.00 C ATOM 360 C ALA A 25 -2.906 9.246 0.228 1.00 0.00 C ATOM 361 O ALA A 25 -3.810 8.585 0.741 1.00 0.00 O ATOM 362 CB ALA A 25 -2.342 9.230 -2.214 1.00 0.00 C ATOM 0 H ALA A 25 -1.685 11.488 -1.210 1.00 0.00 H new ATOM 0 HA ALA A 25 -4.165 9.933 -1.361 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -2.679 8.195 -2.272 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -2.526 9.726 -3.167 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -1.275 9.252 -1.994 1.00 0.00 H new ATOM 368 N GLU A 26 -1.715 9.399 0.792 1.00 0.00 N ATOM 369 CA GLU A 26 -1.387 8.815 2.085 1.00 0.00 C ATOM 370 C GLU A 26 -0.177 9.523 2.681 1.00 0.00 C ATOM 371 O GLU A 26 0.895 9.534 2.083 1.00 0.00 O ATOM 372 CB GLU A 26 -1.095 7.317 1.936 1.00 0.00 C ATOM 373 CG GLU A 26 -0.610 6.647 3.215 1.00 0.00 C ATOM 374 CD GLU A 26 -1.596 6.776 4.357 1.00 0.00 C ATOM 375 OE1 GLU A 26 -2.627 6.076 4.338 1.00 0.00 O ATOM 376 OE2 GLU A 26 -1.344 7.576 5.280 1.00 0.00 O ATOM 0 H GLU A 26 -0.953 9.929 0.368 1.00 0.00 H new ATOM 0 HA GLU A 26 -2.240 8.940 2.752 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -2.000 6.814 1.596 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -0.343 7.180 1.159 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -0.425 5.591 3.019 1.00 0.00 H new ATOM 0 HG3 GLU A 26 0.342 7.087 3.512 1.00 0.00 H new ATOM 383 N SER A 27 -0.339 10.116 3.847 1.00 0.00 N ATOM 384 CA SER A 27 0.783 10.758 4.501 1.00 0.00 C ATOM 385 C SER A 27 1.268 9.913 5.665 1.00 0.00 C ATOM 386 O SER A 27 0.741 9.999 6.770 1.00 0.00 O ATOM 387 CB SER A 27 0.382 12.138 5.006 1.00 0.00 C ATOM 388 OG SER A 27 -0.089 12.955 3.956 1.00 0.00 O ATOM 0 H SER A 27 -1.222 10.167 4.355 1.00 0.00 H new ATOM 0 HA SER A 27 1.589 10.863 3.775 1.00 0.00 H new ATOM 0 HB2 SER A 27 -0.393 12.038 5.766 1.00 0.00 H new ATOM 0 HB3 SER A 27 1.238 12.615 5.484 1.00 0.00 H new ATOM 0 HG SER A 27 -0.340 13.833 4.312 1.00 0.00 H new ATOM 394 N THR A 28 2.322 9.157 5.432 1.00 0.00 N ATOM 395 CA THR A 28 2.872 8.283 6.445 1.00 0.00 C ATOM 396 C THR A 28 3.956 9.010 7.230 1.00 0.00 C ATOM 397 O THR A 28 5.119 8.599 7.280 1.00 0.00 O ATOM 398 CB THR A 28 3.448 7.014 5.807 1.00 0.00 C ATOM 399 OG1 THR A 28 2.455 6.396 4.979 1.00 0.00 O ATOM 400 CG2 THR A 28 3.899 6.040 6.869 1.00 0.00 C ATOM 0 H THR A 28 2.818 9.132 4.541 1.00 0.00 H new ATOM 0 HA THR A 28 2.071 7.996 7.126 1.00 0.00 H new ATOM 0 HB THR A 28 4.310 7.292 5.201 1.00 0.00 H new ATOM 0 HG1 THR A 28 2.884 6.005 4.190 1.00 0.00 H new ATOM 0 HG21 THR A 28 4.304 5.146 6.395 1.00 0.00 H new ATOM 0 HG22 THR A 28 4.669 6.504 7.485 1.00 0.00 H new ATOM 0 HG23 THR A 28 3.050 5.765 7.495 1.00 0.00 H new ATOM 408 N ARG A 29 3.572 10.124 7.807 1.00 0.00 N ATOM 409 CA ARG A 29 4.467 10.898 8.643 1.00 0.00 C ATOM 410 C ARG A 29 3.682 11.561 9.766 1.00 0.00 C ATOM 411 O ARG A 29 3.966 11.337 10.937 1.00 0.00 O ATOM 412 CB ARG A 29 5.214 11.937 7.801 1.00 0.00 C ATOM 413 CG ARG A 29 6.417 12.549 8.498 1.00 0.00 C ATOM 414 CD ARG A 29 7.259 13.361 7.524 1.00 0.00 C ATOM 415 NE ARG A 29 8.476 13.879 8.148 1.00 0.00 N ATOM 416 CZ ARG A 29 9.683 13.843 7.577 1.00 0.00 C ATOM 417 NH1 ARG A 29 9.841 13.307 6.373 1.00 0.00 N ATOM 418 NH2 ARG A 29 10.737 14.344 8.212 1.00 0.00 N ATOM 0 H ARG A 29 2.637 10.520 7.713 1.00 0.00 H new ATOM 0 HA ARG A 29 5.207 10.234 9.089 1.00 0.00 H new ATOM 0 HB2 ARG A 29 5.544 11.469 6.874 1.00 0.00 H new ATOM 0 HB3 ARG A 29 4.522 12.733 7.527 1.00 0.00 H new ATOM 0 HG2 ARG A 29 6.082 13.188 9.315 1.00 0.00 H new ATOM 0 HG3 ARG A 29 7.026 11.760 8.940 1.00 0.00 H new ATOM 0 HD2 ARG A 29 7.527 12.738 6.670 1.00 0.00 H new ATOM 0 HD3 ARG A 29 6.667 14.192 7.139 1.00 0.00 H new ATOM 0 HE ARG A 29 8.398 14.293 9.077 1.00 0.00 H new ATOM 0 HH11 ARG A 29 9.038 12.919 5.878 1.00 0.00 H new ATOM 0 HH12 ARG A 29 10.766 13.283 5.943 1.00 0.00 H new ATOM 0 HH21 ARG A 29 10.626 14.757 9.138 1.00 0.00 H new ATOM 0 HH22 ARG A 29 11.658 14.315 7.774 1.00 0.00 H new ATOM 432 N ASN A 30 2.657 12.336 9.411 1.00 0.00 N ATOM 433 CA ASN A 30 1.834 13.005 10.421 1.00 0.00 C ATOM 434 C ASN A 30 0.845 12.031 11.056 1.00 0.00 C ATOM 435 O ASN A 30 0.086 12.402 11.947 1.00 0.00 O ATOM 436 CB ASN A 30 1.078 14.210 9.839 1.00 0.00 C ATOM 437 CG ASN A 30 -0.029 13.822 8.874 1.00 0.00 C ATOM 438 OD1 ASN A 30 -1.154 13.532 9.279 1.00 0.00 O ATOM 439 ND2 ASN A 30 0.271 13.845 7.587 1.00 0.00 N ATOM 0 H ASN A 30 2.379 12.515 8.446 1.00 0.00 H new ATOM 0 HA ASN A 30 2.515 13.371 11.189 1.00 0.00 H new ATOM 0 HB2 ASN A 30 0.650 14.790 10.657 1.00 0.00 H new ATOM 0 HB3 ASN A 30 1.786 14.859 9.325 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -0.441 13.618 6.893 1.00 0.00 H new ATOM 0 HD22 ASN A 30 1.215 14.090 7.288 1.00 0.00 H new ATOM 446 N ASN A 31 0.852 10.782 10.596 1.00 0.00 N ATOM 447 CA ASN A 31 0.017 9.746 11.203 1.00 0.00 C ATOM 448 C ASN A 31 0.600 9.317 12.540 1.00 0.00 C ATOM 449 O ASN A 31 -0.049 8.615 13.316 1.00 0.00 O ATOM 450 CB ASN A 31 -0.106 8.508 10.306 1.00 0.00 C ATOM 451 CG ASN A 31 -0.863 8.760 9.022 1.00 0.00 C ATOM 452 OD1 ASN A 31 -1.673 9.682 8.929 1.00 0.00 O ATOM 453 ND2 ASN A 31 -0.621 7.918 8.031 1.00 0.00 N ATOM 0 H ASN A 31 1.421 10.464 9.812 1.00 0.00 H new ATOM 0 HA ASN A 31 -0.974 10.178 11.340 1.00 0.00 H new ATOM 0 HB2 ASN A 31 0.893 8.146 10.063 1.00 0.00 H new ATOM 0 HB3 ASN A 31 -0.606 7.715 10.863 1.00 0.00 H new ATOM 0 HD21 ASN A 31 -1.115 8.019 7.144 1.00 0.00 H new ATOM 0 HD22 ASN A 31 0.060 7.168 8.154 1.00 0.00 H new ATOM 460 N GLY A 32 1.845 9.714 12.787 1.00 0.00 N ATOM 461 CA GLY A 32 2.523 9.335 14.007 1.00 0.00 C ATOM 462 C GLY A 32 3.021 7.913 13.936 1.00 0.00 C ATOM 463 O GLY A 32 3.596 7.394 14.889 1.00 0.00 O ATOM 0 H GLY A 32 2.397 10.296 12.157 1.00 0.00 H new ATOM 0 HA2 GLY A 32 3.362 10.008 14.184 1.00 0.00 H new ATOM 0 HA3 GLY A 32 1.843 9.443 14.852 1.00 0.00 H new ATOM 467 N LYS A 33 2.806 7.287 12.788 1.00 0.00 N ATOM 468 CA LYS A 33 3.123 5.884 12.609 1.00 0.00 C ATOM 469 C LYS A 33 3.919 5.676 11.325 1.00 0.00 C ATOM 470 O LYS A 33 3.424 5.952 10.231 1.00 0.00 O ATOM 471 CB LYS A 33 1.831 5.057 12.557 1.00 0.00 C ATOM 472 CG LYS A 33 0.974 5.167 13.813 1.00 0.00 C ATOM 473 CD LYS A 33 -0.326 4.381 13.681 1.00 0.00 C ATOM 474 CE LYS A 33 -1.280 5.019 12.678 1.00 0.00 C ATOM 475 NZ LYS A 33 -1.782 6.342 13.144 1.00 0.00 N ATOM 0 H LYS A 33 2.410 7.736 11.962 1.00 0.00 H new ATOM 0 HA LYS A 33 3.728 5.555 13.454 1.00 0.00 H new ATOM 0 HB2 LYS A 33 1.241 5.377 11.698 1.00 0.00 H new ATOM 0 HB3 LYS A 33 2.088 4.010 12.395 1.00 0.00 H new ATOM 0 HG2 LYS A 33 1.537 4.798 14.671 1.00 0.00 H new ATOM 0 HG3 LYS A 33 0.747 6.215 14.008 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -0.103 3.360 13.370 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -0.812 4.318 14.655 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -0.771 5.141 11.722 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -2.124 4.351 12.507 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -2.573 6.645 12.541 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -2.108 6.262 14.128 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -1.016 7.043 13.089 1.00 0.00 H new ATOM 489 N PRO A 34 5.178 5.230 11.443 1.00 0.00 N ATOM 490 CA PRO A 34 5.999 4.858 10.289 1.00 0.00 C ATOM 491 C PRO A 34 5.493 3.593 9.614 1.00 0.00 C ATOM 492 O PRO A 34 4.680 2.850 10.169 1.00 0.00 O ATOM 493 CB PRO A 34 7.392 4.608 10.885 1.00 0.00 C ATOM 494 CG PRO A 34 7.346 5.211 12.243 1.00 0.00 C ATOM 495 CD PRO A 34 5.923 5.081 12.701 1.00 0.00 C ATOM 0 HA PRO A 34 5.985 5.633 9.523 1.00 0.00 H new ATOM 0 HB2 PRO A 34 7.614 3.542 10.934 1.00 0.00 H new ATOM 0 HB3 PRO A 34 8.170 5.068 10.276 1.00 0.00 H new ATOM 0 HG2 PRO A 34 8.024 4.695 12.923 1.00 0.00 H new ATOM 0 HG3 PRO A 34 7.654 6.256 12.217 1.00 0.00 H new ATOM 0 HD2 PRO A 34 5.734 4.118 13.175 1.00 0.00 H new ATOM 0 HD3 PRO A 34 5.656 5.850 13.426 1.00 0.00 H new ATOM 503 N ALA A 35 6.002 3.343 8.427 1.00 0.00 N ATOM 504 CA ALA A 35 5.579 2.199 7.644 1.00 0.00 C ATOM 505 C ALA A 35 6.780 1.431 7.139 1.00 0.00 C ATOM 506 O ALA A 35 7.875 1.983 7.022 1.00 0.00 O ATOM 507 CB ALA A 35 4.707 2.642 6.479 1.00 0.00 C ATOM 0 H ALA A 35 6.714 3.920 7.980 1.00 0.00 H new ATOM 0 HA ALA A 35 4.991 1.542 8.286 1.00 0.00 H new ATOM 0 HB1 ALA A 35 4.399 1.770 5.903 1.00 0.00 H new ATOM 0 HB2 ALA A 35 3.824 3.155 6.860 1.00 0.00 H new ATOM 0 HB3 ALA A 35 5.272 3.319 5.838 1.00 0.00 H new ATOM 513 N LEU A 36 6.575 0.160 6.866 1.00 0.00 N ATOM 514 CA LEU A 36 7.620 -0.684 6.332 1.00 0.00 C ATOM 515 C LEU A 36 7.440 -0.864 4.834 1.00 0.00 C ATOM 516 O LEU A 36 6.321 -0.979 4.337 1.00 0.00 O ATOM 517 CB LEU A 36 7.633 -2.049 7.005 1.00 0.00 C ATOM 518 CG LEU A 36 8.803 -2.942 6.596 1.00 0.00 C ATOM 519 CD1 LEU A 36 9.930 -2.860 7.613 1.00 0.00 C ATOM 520 CD2 LEU A 36 8.334 -4.368 6.406 1.00 0.00 C ATOM 0 H LEU A 36 5.683 -0.315 7.007 1.00 0.00 H new ATOM 0 HA LEU A 36 8.572 -0.191 6.531 1.00 0.00 H new ATOM 0 HB2 LEU A 36 7.660 -1.908 8.085 1.00 0.00 H new ATOM 0 HB3 LEU A 36 6.700 -2.564 6.774 1.00 0.00 H new ATOM 0 HG LEU A 36 9.196 -2.585 5.644 1.00 0.00 H new ATOM 0 HD11 LEU A 36 10.751 -3.505 7.299 1.00 0.00 H new ATOM 0 HD12 LEU A 36 10.283 -1.831 7.683 1.00 0.00 H new ATOM 0 HD13 LEU A 36 9.565 -3.185 8.587 1.00 0.00 H new ATOM 0 HD21 LEU A 36 9.178 -4.993 6.115 1.00 0.00 H new ATOM 0 HD22 LEU A 36 7.912 -4.740 7.340 1.00 0.00 H new ATOM 0 HD23 LEU A 36 7.573 -4.400 5.626 1.00 0.00 H new ATOM 532 N PHE A 37 8.548 -0.891 4.132 1.00 0.00 N ATOM 533 CA PHE A 37 8.536 -1.103 2.702 1.00 0.00 C ATOM 534 C PHE A 37 9.102 -2.478 2.419 1.00 0.00 C ATOM 535 O PHE A 37 10.294 -2.715 2.609 1.00 0.00 O ATOM 536 CB PHE A 37 9.341 -0.027 1.968 1.00 0.00 C ATOM 537 CG PHE A 37 8.572 1.234 1.679 1.00 0.00 C ATOM 538 CD1 PHE A 37 7.268 1.401 2.121 1.00 0.00 C ATOM 539 CD2 PHE A 37 9.158 2.251 0.945 1.00 0.00 C ATOM 540 CE1 PHE A 37 6.569 2.555 1.837 1.00 0.00 C ATOM 541 CE2 PHE A 37 8.464 3.409 0.660 1.00 0.00 C ATOM 542 CZ PHE A 37 7.168 3.561 1.105 1.00 0.00 C ATOM 0 H PHE A 37 9.478 -0.768 4.532 1.00 0.00 H new ATOM 0 HA PHE A 37 7.511 -1.036 2.338 1.00 0.00 H new ATOM 0 HB2 PHE A 37 10.217 0.225 2.565 1.00 0.00 H new ATOM 0 HB3 PHE A 37 9.704 -0.440 1.027 1.00 0.00 H new ATOM 0 HD1 PHE A 37 6.795 0.618 2.694 1.00 0.00 H new ATOM 0 HD2 PHE A 37 10.172 2.136 0.591 1.00 0.00 H new ATOM 0 HE1 PHE A 37 5.554 2.672 2.187 1.00 0.00 H new ATOM 0 HE2 PHE A 37 8.935 4.195 0.089 1.00 0.00 H new ATOM 0 HZ PHE A 37 6.622 4.466 0.881 1.00 0.00 H new ATOM 552 N ARG A 38 8.242 -3.399 2.023 1.00 0.00 N ATOM 553 CA ARG A 38 8.684 -4.747 1.736 1.00 0.00 C ATOM 554 C ARG A 38 9.157 -4.838 0.298 1.00 0.00 C ATOM 555 O ARG A 38 8.355 -4.810 -0.641 1.00 0.00 O ATOM 556 CB ARG A 38 7.563 -5.750 1.979 1.00 0.00 C ATOM 557 CG ARG A 38 8.050 -7.097 2.482 1.00 0.00 C ATOM 558 CD ARG A 38 8.423 -7.036 3.953 1.00 0.00 C ATOM 559 NE ARG A 38 7.244 -6.859 4.802 1.00 0.00 N ATOM 560 CZ ARG A 38 7.070 -7.469 5.972 1.00 0.00 C ATOM 561 NH1 ARG A 38 7.978 -8.327 6.421 1.00 0.00 N ATOM 562 NH2 ARG A 38 5.990 -7.218 6.697 1.00 0.00 N ATOM 0 H ARG A 38 7.243 -3.238 1.894 1.00 0.00 H new ATOM 0 HA ARG A 38 9.510 -4.988 2.405 1.00 0.00 H new ATOM 0 HB2 ARG A 38 6.864 -5.332 2.704 1.00 0.00 H new ATOM 0 HB3 ARG A 38 7.010 -5.896 1.051 1.00 0.00 H new ATOM 0 HG2 ARG A 38 7.272 -7.846 2.333 1.00 0.00 H new ATOM 0 HG3 ARG A 38 8.914 -7.414 1.899 1.00 0.00 H new ATOM 0 HD2 ARG A 38 8.941 -7.952 4.236 1.00 0.00 H new ATOM 0 HD3 ARG A 38 9.118 -6.213 4.119 1.00 0.00 H new ATOM 0 HE ARG A 38 6.510 -6.229 4.477 1.00 0.00 H new ATOM 0 HH11 ARG A 38 8.813 -8.521 5.869 1.00 0.00 H new ATOM 0 HH12 ARG A 38 7.840 -8.792 7.318 1.00 0.00 H new ATOM 0 HH21 ARG A 38 5.291 -6.557 6.359 1.00 0.00 H new ATOM 0 HH22 ARG A 38 5.858 -7.686 7.594 1.00 0.00 H new ATOM 576 N LEU A 39 10.460 -4.946 0.142 1.00 0.00 N ATOM 577 CA LEU A 39 11.076 -5.042 -1.172 1.00 0.00 C ATOM 578 C LEU A 39 11.000 -6.478 -1.678 1.00 0.00 C ATOM 579 O LEU A 39 10.941 -7.420 -0.885 1.00 0.00 O ATOM 580 CB LEU A 39 12.538 -4.574 -1.125 1.00 0.00 C ATOM 581 CG LEU A 39 12.771 -3.055 -1.065 1.00 0.00 C ATOM 582 CD1 LEU A 39 12.179 -2.436 0.190 1.00 0.00 C ATOM 583 CD2 LEU A 39 14.255 -2.753 -1.141 1.00 0.00 C ATOM 0 H LEU A 39 11.123 -4.970 0.917 1.00 0.00 H new ATOM 0 HA LEU A 39 10.532 -4.392 -1.857 1.00 0.00 H new ATOM 0 HB2 LEU A 39 13.013 -5.027 -0.255 1.00 0.00 H new ATOM 0 HB3 LEU A 39 13.049 -4.963 -2.006 1.00 0.00 H new ATOM 0 HG LEU A 39 12.262 -2.612 -1.921 1.00 0.00 H new ATOM 0 HD11 LEU A 39 12.367 -1.362 0.190 1.00 0.00 H new ATOM 0 HD12 LEU A 39 11.104 -2.616 0.212 1.00 0.00 H new ATOM 0 HD13 LEU A 39 12.640 -2.885 1.070 1.00 0.00 H new ATOM 0 HD21 LEU A 39 14.410 -1.675 -1.098 1.00 0.00 H new ATOM 0 HD22 LEU A 39 14.766 -3.227 -0.303 1.00 0.00 H new ATOM 0 HD23 LEU A 39 14.658 -3.140 -2.077 1.00 0.00 H new ATOM 595 N GLY A 40 10.991 -6.645 -2.991 1.00 0.00 N ATOM 596 CA GLY A 40 10.883 -7.970 -3.563 1.00 0.00 C ATOM 597 C GLY A 40 9.461 -8.313 -3.943 1.00 0.00 C ATOM 598 O GLY A 40 9.067 -9.482 -3.905 1.00 0.00 O ATOM 0 H GLY A 40 11.057 -5.887 -3.671 1.00 0.00 H new ATOM 0 HA2 GLY A 40 11.519 -8.036 -4.446 1.00 0.00 H new ATOM 0 HA3 GLY A 40 11.253 -8.704 -2.848 1.00 0.00 H new ATOM 602 N ASP A 41 8.685 -7.278 -4.282 1.00 0.00 N ATOM 603 CA ASP A 41 7.289 -7.433 -4.712 1.00 0.00 C ATOM 604 C ASP A 41 6.442 -8.088 -3.614 1.00 0.00 C ATOM 605 O ASP A 41 5.323 -8.536 -3.850 1.00 0.00 O ATOM 606 CB ASP A 41 7.224 -8.247 -6.015 1.00 0.00 C ATOM 607 CG ASP A 41 5.865 -8.197 -6.695 1.00 0.00 C ATOM 608 OD1 ASP A 41 5.541 -7.162 -7.313 1.00 0.00 O ATOM 609 OD2 ASP A 41 5.134 -9.212 -6.645 1.00 0.00 O ATOM 0 H ASP A 41 9.005 -6.310 -4.266 1.00 0.00 H new ATOM 0 HA ASP A 41 6.875 -6.442 -4.900 1.00 0.00 H new ATOM 0 HB2 ASP A 41 7.981 -7.874 -6.705 1.00 0.00 H new ATOM 0 HB3 ASP A 41 7.475 -9.285 -5.798 1.00 0.00 H new ATOM 614 N ALA A 42 6.973 -8.105 -2.397 1.00 0.00 N ATOM 615 CA ALA A 42 6.309 -8.766 -1.279 1.00 0.00 C ATOM 616 C ALA A 42 5.205 -7.883 -0.708 1.00 0.00 C ATOM 617 O ALA A 42 4.373 -8.334 0.078 1.00 0.00 O ATOM 618 CB ALA A 42 7.322 -9.120 -0.206 1.00 0.00 C ATOM 0 H ALA A 42 7.863 -7.668 -2.159 1.00 0.00 H new ATOM 0 HA ALA A 42 5.850 -9.686 -1.642 1.00 0.00 H new ATOM 0 HB1 ALA A 42 6.816 -9.613 0.624 1.00 0.00 H new ATOM 0 HB2 ALA A 42 8.074 -9.791 -0.622 1.00 0.00 H new ATOM 0 HB3 ALA A 42 7.805 -8.211 0.152 1.00 0.00 H new ATOM 624 N SER A 43 5.222 -6.620 -1.105 1.00 0.00 N ATOM 625 CA SER A 43 4.181 -5.675 -0.739 1.00 0.00 C ATOM 626 C SER A 43 4.226 -4.493 -1.695 1.00 0.00 C ATOM 627 O SER A 43 3.231 -4.157 -2.338 1.00 0.00 O ATOM 628 CB SER A 43 4.350 -5.201 0.711 1.00 0.00 C ATOM 629 OG SER A 43 3.301 -4.325 1.086 1.00 0.00 O ATOM 0 H SER A 43 5.957 -6.223 -1.689 1.00 0.00 H new ATOM 0 HA SER A 43 3.212 -6.168 -0.812 1.00 0.00 H new ATOM 0 HB2 SER A 43 4.365 -6.062 1.379 1.00 0.00 H new ATOM 0 HB3 SER A 43 5.309 -4.694 0.822 1.00 0.00 H new ATOM 0 HG SER A 43 3.430 -4.038 2.014 1.00 0.00 H new ATOM 635 N LEU A 44 5.397 -3.882 -1.803 1.00 0.00 N ATOM 636 CA LEU A 44 5.600 -2.788 -2.735 1.00 0.00 C ATOM 637 C LEU A 44 6.096 -3.333 -4.063 1.00 0.00 C ATOM 638 O LEU A 44 6.773 -4.363 -4.106 1.00 0.00 O ATOM 639 CB LEU A 44 6.599 -1.762 -2.178 1.00 0.00 C ATOM 640 CG LEU A 44 6.068 -0.813 -1.092 1.00 0.00 C ATOM 641 CD1 LEU A 44 4.850 -0.055 -1.589 1.00 0.00 C ATOM 642 CD2 LEU A 44 5.745 -1.568 0.188 1.00 0.00 C ATOM 0 H LEU A 44 6.221 -4.128 -1.254 1.00 0.00 H new ATOM 0 HA LEU A 44 4.646 -2.281 -2.883 1.00 0.00 H new ATOM 0 HB2 LEU A 44 7.454 -2.303 -1.771 1.00 0.00 H new ATOM 0 HB3 LEU A 44 6.969 -1.159 -3.008 1.00 0.00 H new ATOM 0 HG LEU A 44 6.853 -0.092 -0.866 1.00 0.00 H new ATOM 0 HD11 LEU A 44 4.491 0.611 -0.804 1.00 0.00 H new ATOM 0 HD12 LEU A 44 5.120 0.532 -2.467 1.00 0.00 H new ATOM 0 HD13 LEU A 44 4.064 -0.762 -1.853 1.00 0.00 H new ATOM 0 HD21 LEU A 44 5.372 -0.870 0.938 1.00 0.00 H new ATOM 0 HD22 LEU A 44 4.985 -2.322 -0.016 1.00 0.00 H new ATOM 0 HD23 LEU A 44 6.647 -2.053 0.561 1.00 0.00 H new ATOM 654 N SER A 45 5.749 -2.640 -5.135 1.00 0.00 N ATOM 655 CA SER A 45 6.100 -3.069 -6.477 1.00 0.00 C ATOM 656 C SER A 45 7.598 -2.909 -6.732 1.00 0.00 C ATOM 657 O SER A 45 8.254 -2.088 -6.082 1.00 0.00 O ATOM 658 CB SER A 45 5.293 -2.264 -7.499 1.00 0.00 C ATOM 659 OG SER A 45 5.598 -2.645 -8.829 1.00 0.00 O ATOM 0 H SER A 45 5.219 -1.769 -5.099 1.00 0.00 H new ATOM 0 HA SER A 45 5.858 -4.127 -6.580 1.00 0.00 H new ATOM 0 HB2 SER A 45 4.228 -2.407 -7.315 1.00 0.00 H new ATOM 0 HB3 SER A 45 5.499 -1.202 -7.369 1.00 0.00 H new ATOM 0 HG SER A 45 4.829 -2.459 -9.407 1.00 0.00 H new ATOM 665 N GLU A 46 8.130 -3.692 -7.669 1.00 0.00 N ATOM 666 CA GLU A 46 9.536 -3.658 -8.021 1.00 0.00 C ATOM 667 C GLU A 46 10.021 -2.235 -8.287 1.00 0.00 C ATOM 668 O GLU A 46 11.114 -1.857 -7.870 1.00 0.00 O ATOM 669 CB GLU A 46 9.762 -4.503 -9.267 1.00 0.00 C ATOM 670 CG GLU A 46 11.216 -4.811 -9.507 1.00 0.00 C ATOM 671 CD GLU A 46 11.462 -5.475 -10.841 1.00 0.00 C ATOM 672 OE1 GLU A 46 11.570 -4.755 -11.856 1.00 0.00 O ATOM 673 OE2 GLU A 46 11.549 -6.718 -10.884 1.00 0.00 O ATOM 0 H GLU A 46 7.588 -4.370 -8.205 1.00 0.00 H new ATOM 0 HA GLU A 46 10.102 -4.055 -7.178 1.00 0.00 H new ATOM 0 HB2 GLU A 46 9.208 -5.437 -9.172 1.00 0.00 H new ATOM 0 HB3 GLU A 46 9.358 -3.980 -10.134 1.00 0.00 H new ATOM 0 HG2 GLU A 46 11.792 -3.887 -9.455 1.00 0.00 H new ATOM 0 HG3 GLU A 46 11.581 -5.460 -8.711 1.00 0.00 H new ATOM 680 N GLY A 47 9.193 -1.444 -8.958 1.00 0.00 N ATOM 681 CA GLY A 47 9.593 -0.102 -9.326 1.00 0.00 C ATOM 682 C GLY A 47 10.004 0.727 -8.129 1.00 0.00 C ATOM 683 O GLY A 47 10.929 1.530 -8.217 1.00 0.00 O ATOM 0 H GLY A 47 8.253 -1.709 -9.253 1.00 0.00 H new ATOM 0 HA2 GLY A 47 10.423 -0.154 -10.031 1.00 0.00 H new ATOM 0 HA3 GLY A 47 8.768 0.392 -9.840 1.00 0.00 H new ATOM 687 N LEU A 48 9.328 0.535 -7.004 1.00 0.00 N ATOM 688 CA LEU A 48 9.698 1.230 -5.785 1.00 0.00 C ATOM 689 C LEU A 48 11.081 0.824 -5.303 1.00 0.00 C ATOM 690 O LEU A 48 11.944 1.680 -5.089 1.00 0.00 O ATOM 691 CB LEU A 48 8.685 0.965 -4.679 1.00 0.00 C ATOM 692 CG LEU A 48 9.069 1.554 -3.322 1.00 0.00 C ATOM 693 CD1 LEU A 48 7.913 2.332 -2.745 1.00 0.00 C ATOM 694 CD2 LEU A 48 9.517 0.462 -2.363 1.00 0.00 C ATOM 0 H LEU A 48 8.528 -0.091 -6.913 1.00 0.00 H new ATOM 0 HA LEU A 48 9.710 2.294 -6.020 1.00 0.00 H new ATOM 0 HB2 LEU A 48 7.720 1.374 -4.980 1.00 0.00 H new ATOM 0 HB3 LEU A 48 8.555 -0.112 -4.571 1.00 0.00 H new ATOM 0 HG LEU A 48 9.907 2.235 -3.467 1.00 0.00 H new ATOM 0 HD11 LEU A 48 8.200 2.746 -1.778 1.00 0.00 H new ATOM 0 HD12 LEU A 48 7.646 3.143 -3.423 1.00 0.00 H new ATOM 0 HD13 LEU A 48 7.057 1.670 -2.616 1.00 0.00 H new ATOM 0 HD21 LEU A 48 9.785 0.907 -1.405 1.00 0.00 H new ATOM 0 HD22 LEU A 48 8.705 -0.251 -2.218 1.00 0.00 H new ATOM 0 HD23 LEU A 48 10.383 -0.054 -2.778 1.00 0.00 H new ATOM 706 N GLU A 49 11.308 -0.479 -5.156 1.00 0.00 N ATOM 707 CA GLU A 49 12.541 -0.973 -4.567 1.00 0.00 C ATOM 708 C GLU A 49 13.739 -0.609 -5.426 1.00 0.00 C ATOM 709 O GLU A 49 14.830 -0.381 -4.910 1.00 0.00 O ATOM 710 CB GLU A 49 12.479 -2.488 -4.347 1.00 0.00 C ATOM 711 CG GLU A 49 12.476 -3.311 -5.621 1.00 0.00 C ATOM 712 CD GLU A 49 12.431 -4.796 -5.340 1.00 0.00 C ATOM 713 OE1 GLU A 49 13.478 -5.367 -4.968 1.00 0.00 O ATOM 714 OE2 GLU A 49 11.345 -5.399 -5.475 1.00 0.00 O ATOM 0 H GLU A 49 10.652 -1.208 -5.438 1.00 0.00 H new ATOM 0 HA GLU A 49 12.658 -0.493 -3.596 1.00 0.00 H new ATOM 0 HB2 GLU A 49 13.331 -2.789 -3.738 1.00 0.00 H new ATOM 0 HB3 GLU A 49 11.581 -2.723 -3.776 1.00 0.00 H new ATOM 0 HG2 GLU A 49 11.616 -3.032 -6.230 1.00 0.00 H new ATOM 0 HG3 GLU A 49 13.368 -3.080 -6.203 1.00 0.00 H new ATOM 721 N GLN A 50 13.519 -0.506 -6.733 1.00 0.00 N ATOM 722 CA GLN A 50 14.604 -0.292 -7.674 1.00 0.00 C ATOM 723 C GLN A 50 15.245 1.072 -7.452 1.00 0.00 C ATOM 724 O GLN A 50 16.362 1.322 -7.899 1.00 0.00 O ATOM 725 CB GLN A 50 14.086 -0.393 -9.108 1.00 0.00 C ATOM 726 CG GLN A 50 13.671 -1.794 -9.525 1.00 0.00 C ATOM 727 CD GLN A 50 14.842 -2.745 -9.675 1.00 0.00 C ATOM 728 OE1 GLN A 50 15.853 -2.634 -8.982 1.00 0.00 O ATOM 729 NE2 GLN A 50 14.717 -3.684 -10.596 1.00 0.00 N ATOM 0 H GLN A 50 12.596 -0.568 -7.162 1.00 0.00 H new ATOM 0 HA GLN A 50 15.357 -1.063 -7.510 1.00 0.00 H new ATOM 0 HB2 GLN A 50 13.232 0.275 -9.222 1.00 0.00 H new ATOM 0 HB3 GLN A 50 14.861 -0.039 -9.788 1.00 0.00 H new ATOM 0 HG2 GLN A 50 12.978 -2.196 -8.786 1.00 0.00 H new ATOM 0 HG3 GLN A 50 13.132 -1.740 -10.471 1.00 0.00 H new ATOM 0 HE21 GLN A 50 13.863 -3.744 -11.151 1.00 0.00 H new ATOM 0 HE22 GLN A 50 15.474 -4.349 -10.752 1.00 0.00 H new ATOM 738 N HIS A 51 14.543 1.951 -6.743 1.00 0.00 N ATOM 739 CA HIS A 51 15.033 3.299 -6.530 1.00 0.00 C ATOM 740 C HIS A 51 15.495 3.463 -5.094 1.00 0.00 C ATOM 741 O HIS A 51 16.013 4.510 -4.710 1.00 0.00 O ATOM 742 CB HIS A 51 13.943 4.324 -6.860 1.00 0.00 C ATOM 743 CG HIS A 51 13.511 4.309 -8.298 1.00 0.00 C ATOM 744 ND1 HIS A 51 13.508 5.429 -9.101 1.00 0.00 N ATOM 745 CD2 HIS A 51 13.048 3.299 -9.068 1.00 0.00 C ATOM 746 CE1 HIS A 51 13.055 5.107 -10.300 1.00 0.00 C ATOM 747 NE2 HIS A 51 12.770 3.820 -10.304 1.00 0.00 N ATOM 0 H HIS A 51 13.641 1.752 -6.311 1.00 0.00 H new ATOM 0 HA HIS A 51 15.880 3.472 -7.194 1.00 0.00 H new ATOM 0 HB2 HIS A 51 13.076 4.134 -6.228 1.00 0.00 H new ATOM 0 HB3 HIS A 51 14.307 5.321 -6.610 1.00 0.00 H new ATOM 0 HD2 HIS A 51 12.921 2.270 -8.764 1.00 0.00 H new ATOM 0 HE1 HIS A 51 12.938 5.783 -11.134 1.00 0.00 H new ATOM 0 HE2 HIS A 51 12.402 3.297 -11.099 1.00 0.00 H new ATOM 756 N LEU A 52 15.303 2.416 -4.307 1.00 0.00 N ATOM 757 CA LEU A 52 15.672 2.435 -2.904 1.00 0.00 C ATOM 758 C LEU A 52 16.970 1.664 -2.661 1.00 0.00 C ATOM 759 O LEU A 52 17.639 1.867 -1.648 1.00 0.00 O ATOM 760 CB LEU A 52 14.536 1.860 -2.057 1.00 0.00 C ATOM 761 CG LEU A 52 13.279 2.733 -1.958 1.00 0.00 C ATOM 762 CD1 LEU A 52 12.268 2.080 -1.037 1.00 0.00 C ATOM 763 CD2 LEU A 52 13.628 4.126 -1.453 1.00 0.00 C ATOM 0 H LEU A 52 14.891 1.537 -4.621 1.00 0.00 H new ATOM 0 HA LEU A 52 15.844 3.470 -2.609 1.00 0.00 H new ATOM 0 HB2 LEU A 52 14.253 0.892 -2.469 1.00 0.00 H new ATOM 0 HB3 LEU A 52 14.912 1.680 -1.050 1.00 0.00 H new ATOM 0 HG LEU A 52 12.845 2.830 -2.953 1.00 0.00 H new ATOM 0 HD11 LEU A 52 11.378 2.706 -0.972 1.00 0.00 H new ATOM 0 HD12 LEU A 52 11.995 1.101 -1.432 1.00 0.00 H new ATOM 0 HD13 LEU A 52 12.703 1.963 -0.044 1.00 0.00 H new ATOM 0 HD21 LEU A 52 12.722 4.728 -1.391 1.00 0.00 H new ATOM 0 HD22 LEU A 52 14.083 4.052 -0.465 1.00 0.00 H new ATOM 0 HD23 LEU A 52 14.330 4.597 -2.141 1.00 0.00 H new ATOM 775 N LEU A 53 17.322 0.779 -3.590 1.00 0.00 N ATOM 776 CA LEU A 53 18.557 0.016 -3.497 1.00 0.00 C ATOM 777 C LEU A 53 19.776 0.935 -3.481 1.00 0.00 C ATOM 778 O LEU A 53 19.860 1.889 -4.259 1.00 0.00 O ATOM 779 CB LEU A 53 18.654 -0.941 -4.684 1.00 0.00 C ATOM 780 CG LEU A 53 17.793 -2.209 -4.617 1.00 0.00 C ATOM 781 CD1 LEU A 53 16.798 -2.172 -3.468 1.00 0.00 C ATOM 782 CD2 LEU A 53 17.067 -2.420 -5.932 1.00 0.00 C ATOM 0 H LEU A 53 16.764 0.574 -4.419 1.00 0.00 H new ATOM 0 HA LEU A 53 18.542 -0.546 -2.563 1.00 0.00 H new ATOM 0 HB2 LEU A 53 18.383 -0.393 -5.586 1.00 0.00 H new ATOM 0 HB3 LEU A 53 19.696 -1.242 -4.794 1.00 0.00 H new ATOM 0 HG LEU A 53 18.466 -3.047 -4.435 1.00 0.00 H new ATOM 0 HD11 LEU A 53 16.213 -3.092 -3.464 1.00 0.00 H new ATOM 0 HD12 LEU A 53 17.335 -2.079 -2.524 1.00 0.00 H new ATOM 0 HD13 LEU A 53 16.131 -1.318 -3.591 1.00 0.00 H new ATOM 0 HD21 LEU A 53 16.460 -3.323 -5.871 1.00 0.00 H new ATOM 0 HD22 LEU A 53 16.424 -1.563 -6.134 1.00 0.00 H new ATOM 0 HD23 LEU A 53 17.795 -2.526 -6.737 1.00 0.00 H new ATOM 794 N GLY A 54 20.714 0.639 -2.592 1.00 0.00 N ATOM 795 CA GLY A 54 21.930 1.423 -2.496 1.00 0.00 C ATOM 796 C GLY A 54 21.828 2.535 -1.474 1.00 0.00 C ATOM 797 O GLY A 54 22.812 3.225 -1.199 1.00 0.00 O ATOM 0 H GLY A 54 20.654 -0.136 -1.931 1.00 0.00 H new ATOM 0 HA2 GLY A 54 22.760 0.768 -2.232 1.00 0.00 H new ATOM 0 HA3 GLY A 54 22.159 1.851 -3.472 1.00 0.00 H new ATOM 801 N LEU A 55 20.640 2.717 -0.913 1.00 0.00 N ATOM 802 CA LEU A 55 20.425 3.747 0.093 1.00 0.00 C ATOM 803 C LEU A 55 20.812 3.255 1.477 1.00 0.00 C ATOM 804 O LEU A 55 20.965 2.055 1.708 1.00 0.00 O ATOM 805 CB LEU A 55 18.964 4.199 0.106 1.00 0.00 C ATOM 806 CG LEU A 55 18.534 5.069 -1.073 1.00 0.00 C ATOM 807 CD1 LEU A 55 17.050 5.368 -0.987 1.00 0.00 C ATOM 808 CD2 LEU A 55 19.336 6.362 -1.098 1.00 0.00 C ATOM 0 H LEU A 55 19.812 2.165 -1.137 1.00 0.00 H new ATOM 0 HA LEU A 55 21.060 4.593 -0.170 1.00 0.00 H new ATOM 0 HB2 LEU A 55 18.328 3.314 0.133 1.00 0.00 H new ATOM 0 HB3 LEU A 55 18.781 4.751 1.028 1.00 0.00 H new ATOM 0 HG LEU A 55 18.728 4.526 -1.998 1.00 0.00 H new ATOM 0 HD11 LEU A 55 16.754 5.989 -1.833 1.00 0.00 H new ATOM 0 HD12 LEU A 55 16.489 4.434 -1.009 1.00 0.00 H new ATOM 0 HD13 LEU A 55 16.839 5.896 -0.057 1.00 0.00 H new ATOM 0 HD21 LEU A 55 19.018 6.971 -1.944 1.00 0.00 H new ATOM 0 HD22 LEU A 55 19.169 6.912 -0.172 1.00 0.00 H new ATOM 0 HD23 LEU A 55 20.397 6.130 -1.196 1.00 0.00 H new ATOM 820 N LYS A 56 20.976 4.198 2.386 1.00 0.00 N ATOM 821 CA LYS A 56 21.263 3.905 3.777 1.00 0.00 C ATOM 822 C LYS A 56 20.266 4.631 4.663 1.00 0.00 C ATOM 823 O LYS A 56 19.500 5.470 4.189 1.00 0.00 O ATOM 824 CB LYS A 56 22.687 4.337 4.143 1.00 0.00 C ATOM 825 CG LYS A 56 23.702 3.207 4.212 1.00 0.00 C ATOM 826 CD LYS A 56 23.991 2.616 2.843 1.00 0.00 C ATOM 827 CE LYS A 56 24.613 3.637 1.899 1.00 0.00 C ATOM 828 NZ LYS A 56 25.837 4.262 2.471 1.00 0.00 N ATOM 0 H LYS A 56 20.913 5.195 2.178 1.00 0.00 H new ATOM 0 HA LYS A 56 21.179 2.829 3.930 1.00 0.00 H new ATOM 0 HB2 LYS A 56 23.029 5.068 3.410 1.00 0.00 H new ATOM 0 HB3 LYS A 56 22.661 4.842 5.109 1.00 0.00 H new ATOM 0 HG2 LYS A 56 24.629 3.579 4.649 1.00 0.00 H new ATOM 0 HG3 LYS A 56 23.329 2.425 4.873 1.00 0.00 H new ATOM 0 HD2 LYS A 56 24.664 1.765 2.950 1.00 0.00 H new ATOM 0 HD3 LYS A 56 23.065 2.238 2.409 1.00 0.00 H new ATOM 0 HE2 LYS A 56 24.862 3.152 0.955 1.00 0.00 H new ATOM 0 HE3 LYS A 56 23.882 4.414 1.674 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 26.346 4.777 1.724 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 25.568 4.925 3.226 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 26.454 3.522 2.863 1.00 0.00 H new ATOM 842 N VAL A 57 20.266 4.294 5.936 1.00 0.00 N ATOM 843 CA VAL A 57 19.420 4.975 6.901 1.00 0.00 C ATOM 844 C VAL A 57 19.770 6.464 6.966 1.00 0.00 C ATOM 845 O VAL A 57 20.938 6.848 6.870 1.00 0.00 O ATOM 846 CB VAL A 57 19.547 4.342 8.305 1.00 0.00 C ATOM 847 CG1 VAL A 57 18.938 5.242 9.369 1.00 0.00 C ATOM 848 CG2 VAL A 57 18.890 2.972 8.337 1.00 0.00 C ATOM 0 H VAL A 57 20.843 3.551 6.330 1.00 0.00 H new ATOM 0 HA VAL A 57 18.387 4.866 6.569 1.00 0.00 H new ATOM 0 HB VAL A 57 20.609 4.226 8.523 1.00 0.00 H new ATOM 0 HG11 VAL A 57 19.042 4.771 10.347 1.00 0.00 H new ATOM 0 HG12 VAL A 57 19.454 6.202 9.372 1.00 0.00 H new ATOM 0 HG13 VAL A 57 17.881 5.398 9.152 1.00 0.00 H new ATOM 0 HG21 VAL A 57 18.990 2.543 9.334 1.00 0.00 H new ATOM 0 HG22 VAL A 57 17.833 3.069 8.089 1.00 0.00 H new ATOM 0 HG23 VAL A 57 19.375 2.319 7.611 1.00 0.00 H new ATOM 858 N GLY A 58 18.744 7.289 7.130 1.00 0.00 N ATOM 859 CA GLY A 58 18.929 8.725 7.164 1.00 0.00 C ATOM 860 C GLY A 58 19.047 9.331 5.781 1.00 0.00 C ATOM 861 O GLY A 58 19.399 10.504 5.636 1.00 0.00 O ATOM 0 H GLY A 58 17.777 6.984 7.241 1.00 0.00 H new ATOM 0 HA2 GLY A 58 18.089 9.183 7.687 1.00 0.00 H new ATOM 0 HA3 GLY A 58 19.827 8.958 7.736 1.00 0.00 H new ATOM 865 N ASP A 59 18.766 8.539 4.758 1.00 0.00 N ATOM 866 CA ASP A 59 18.769 9.049 3.393 1.00 0.00 C ATOM 867 C ASP A 59 17.368 9.367 2.926 1.00 0.00 C ATOM 868 O ASP A 59 16.397 8.745 3.359 1.00 0.00 O ATOM 869 CB ASP A 59 19.420 8.068 2.418 1.00 0.00 C ATOM 870 CG ASP A 59 20.915 8.259 2.313 1.00 0.00 C ATOM 871 OD1 ASP A 59 21.350 9.339 1.854 1.00 0.00 O ATOM 872 OD2 ASP A 59 21.667 7.336 2.683 1.00 0.00 O ATOM 0 H ASP A 59 18.535 7.549 4.844 1.00 0.00 H new ATOM 0 HA ASP A 59 19.360 9.965 3.405 1.00 0.00 H new ATOM 0 HB2 ASP A 59 19.209 7.048 2.740 1.00 0.00 H new ATOM 0 HB3 ASP A 59 18.972 8.190 1.432 1.00 0.00 H new ATOM 877 N LYS A 60 17.279 10.340 2.036 1.00 0.00 N ATOM 878 CA LYS A 60 16.013 10.790 1.496 1.00 0.00 C ATOM 879 C LYS A 60 16.020 10.621 -0.009 1.00 0.00 C ATOM 880 O LYS A 60 16.962 11.034 -0.687 1.00 0.00 O ATOM 881 CB LYS A 60 15.775 12.259 1.853 1.00 0.00 C ATOM 882 CG LYS A 60 16.987 12.950 2.453 1.00 0.00 C ATOM 883 CD LYS A 60 16.766 13.308 3.909 1.00 0.00 C ATOM 884 CE LYS A 60 15.682 14.365 4.067 1.00 0.00 C ATOM 885 NZ LYS A 60 15.457 14.724 5.492 1.00 0.00 N ATOM 0 H LYS A 60 18.088 10.841 1.668 1.00 0.00 H new ATOM 0 HA LYS A 60 15.209 10.193 1.927 1.00 0.00 H new ATOM 0 HB2 LYS A 60 15.470 12.796 0.955 1.00 0.00 H new ATOM 0 HB3 LYS A 60 14.947 12.322 2.559 1.00 0.00 H new ATOM 0 HG2 LYS A 60 17.857 12.299 2.367 1.00 0.00 H new ATOM 0 HG3 LYS A 60 17.208 13.854 1.886 1.00 0.00 H new ATOM 0 HD2 LYS A 60 16.487 12.414 4.466 1.00 0.00 H new ATOM 0 HD3 LYS A 60 17.698 13.674 4.340 1.00 0.00 H new ATOM 0 HE2 LYS A 60 15.962 15.258 3.508 1.00 0.00 H new ATOM 0 HE3 LYS A 60 14.751 13.997 3.635 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 14.666 15.396 5.560 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 15.231 13.866 6.035 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 16.317 15.162 5.880 1.00 0.00 H new ATOM 899 N THR A 61 14.992 9.996 -0.531 1.00 0.00 N ATOM 900 CA THR A 61 14.898 9.758 -1.941 1.00 0.00 C ATOM 901 C THR A 61 13.461 9.915 -2.413 1.00 0.00 C ATOM 902 O THR A 61 12.551 9.248 -1.918 1.00 0.00 O ATOM 903 CB THR A 61 15.443 8.365 -2.279 1.00 0.00 C ATOM 904 OG1 THR A 61 16.875 8.377 -2.204 1.00 0.00 O ATOM 905 CG2 THR A 61 14.989 7.921 -3.650 1.00 0.00 C ATOM 0 H THR A 61 14.204 9.642 0.011 1.00 0.00 H new ATOM 0 HA THR A 61 15.504 10.497 -2.465 1.00 0.00 H new ATOM 0 HB THR A 61 15.051 7.653 -1.553 1.00 0.00 H new ATOM 0 HG1 THR A 61 17.178 9.245 -1.864 1.00 0.00 H new ATOM 0 HG21 THR A 61 15.390 6.930 -3.863 1.00 0.00 H new ATOM 0 HG22 THR A 61 13.900 7.885 -3.679 1.00 0.00 H new ATOM 0 HG23 THR A 61 15.349 8.627 -4.399 1.00 0.00 H new ATOM 913 N THR A 62 13.261 10.823 -3.344 1.00 0.00 N ATOM 914 CA THR A 62 11.954 11.028 -3.917 1.00 0.00 C ATOM 915 C THR A 62 11.946 10.565 -5.363 1.00 0.00 C ATOM 916 O THR A 62 12.853 10.883 -6.134 1.00 0.00 O ATOM 917 CB THR A 62 11.554 12.507 -3.854 1.00 0.00 C ATOM 918 OG1 THR A 62 11.798 13.016 -2.535 1.00 0.00 O ATOM 919 CG2 THR A 62 10.085 12.691 -4.208 1.00 0.00 C ATOM 0 H THR A 62 13.990 11.430 -3.719 1.00 0.00 H new ATOM 0 HA THR A 62 11.235 10.447 -3.340 1.00 0.00 H new ATOM 0 HB THR A 62 12.154 13.056 -4.579 1.00 0.00 H new ATOM 0 HG1 THR A 62 11.016 13.522 -2.230 1.00 0.00 H new ATOM 0 HG21 THR A 62 9.828 13.749 -4.156 1.00 0.00 H new ATOM 0 HG22 THR A 62 9.905 12.324 -5.218 1.00 0.00 H new ATOM 0 HG23 THR A 62 9.468 12.132 -3.504 1.00 0.00 H new ATOM 927 N PHE A 63 10.935 9.806 -5.720 1.00 0.00 N ATOM 928 CA PHE A 63 10.798 9.315 -7.075 1.00 0.00 C ATOM 929 C PHE A 63 9.329 9.215 -7.452 1.00 0.00 C ATOM 930 O PHE A 63 8.450 9.393 -6.607 1.00 0.00 O ATOM 931 CB PHE A 63 11.529 7.970 -7.264 1.00 0.00 C ATOM 932 CG PHE A 63 11.141 6.880 -6.301 1.00 0.00 C ATOM 933 CD1 PHE A 63 9.999 6.134 -6.510 1.00 0.00 C ATOM 934 CD2 PHE A 63 11.928 6.590 -5.194 1.00 0.00 C ATOM 935 CE1 PHE A 63 9.645 5.127 -5.640 1.00 0.00 C ATOM 936 CE2 PHE A 63 11.578 5.583 -4.321 1.00 0.00 C ATOM 937 CZ PHE A 63 10.434 4.851 -4.544 1.00 0.00 C ATOM 0 H PHE A 63 10.190 9.513 -5.087 1.00 0.00 H new ATOM 0 HA PHE A 63 11.272 10.028 -7.749 1.00 0.00 H new ATOM 0 HB2 PHE A 63 11.346 7.616 -8.279 1.00 0.00 H new ATOM 0 HB3 PHE A 63 12.601 8.144 -7.176 1.00 0.00 H new ATOM 0 HD1 PHE A 63 9.375 6.343 -7.367 1.00 0.00 H new ATOM 0 HD2 PHE A 63 12.827 7.162 -5.015 1.00 0.00 H new ATOM 0 HE1 PHE A 63 8.748 4.553 -5.817 1.00 0.00 H new ATOM 0 HE2 PHE A 63 12.200 5.369 -3.464 1.00 0.00 H new ATOM 0 HZ PHE A 63 10.155 4.062 -3.862 1.00 0.00 H new ATOM 947 N SER A 64 9.067 8.920 -8.712 1.00 0.00 N ATOM 948 CA SER A 64 7.714 8.954 -9.235 1.00 0.00 C ATOM 949 C SER A 64 7.447 7.662 -9.983 1.00 0.00 C ATOM 950 O SER A 64 8.294 7.200 -10.748 1.00 0.00 O ATOM 951 CB SER A 64 7.525 10.162 -10.155 1.00 0.00 C ATOM 952 OG SER A 64 7.795 11.369 -9.462 1.00 0.00 O ATOM 0 H SER A 64 9.777 8.653 -9.394 1.00 0.00 H new ATOM 0 HA SER A 64 7.005 9.050 -8.413 1.00 0.00 H new ATOM 0 HB2 SER A 64 8.187 10.076 -11.017 1.00 0.00 H new ATOM 0 HB3 SER A 64 6.504 10.177 -10.538 1.00 0.00 H new ATOM 0 HG SER A 64 6.950 11.799 -9.212 1.00 0.00 H new ATOM 958 N LEU A 65 6.282 7.077 -9.765 1.00 0.00 N ATOM 959 CA LEU A 65 6.001 5.756 -10.297 1.00 0.00 C ATOM 960 C LEU A 65 4.583 5.662 -10.824 1.00 0.00 C ATOM 961 O LEU A 65 3.647 6.214 -10.240 1.00 0.00 O ATOM 962 CB LEU A 65 6.221 4.692 -9.220 1.00 0.00 C ATOM 963 CG LEU A 65 7.671 4.448 -8.810 1.00 0.00 C ATOM 964 CD1 LEU A 65 7.738 3.360 -7.757 1.00 0.00 C ATOM 965 CD2 LEU A 65 8.524 4.072 -10.012 1.00 0.00 C ATOM 0 H LEU A 65 5.521 7.492 -9.228 1.00 0.00 H new ATOM 0 HA LEU A 65 6.687 5.581 -11.126 1.00 0.00 H new ATOM 0 HB2 LEU A 65 5.656 4.979 -8.333 1.00 0.00 H new ATOM 0 HB3 LEU A 65 5.801 3.751 -9.575 1.00 0.00 H new ATOM 0 HG LEU A 65 8.067 5.373 -8.392 1.00 0.00 H new ATOM 0 HD11 LEU A 65 8.777 3.194 -7.471 1.00 0.00 H new ATOM 0 HD12 LEU A 65 7.165 3.665 -6.881 1.00 0.00 H new ATOM 0 HD13 LEU A 65 7.320 2.437 -8.160 1.00 0.00 H new ATOM 0 HD21 LEU A 65 9.552 3.904 -9.690 1.00 0.00 H new ATOM 0 HD22 LEU A 65 8.132 3.162 -10.466 1.00 0.00 H new ATOM 0 HD23 LEU A 65 8.500 4.881 -10.742 1.00 0.00 H new ATOM 977 N GLU A 66 4.446 4.968 -11.945 1.00 0.00 N ATOM 978 CA GLU A 66 3.148 4.681 -12.525 1.00 0.00 C ATOM 979 C GLU A 66 2.457 3.580 -11.728 1.00 0.00 C ATOM 980 O GLU A 66 3.122 2.876 -10.976 1.00 0.00 O ATOM 981 CB GLU A 66 3.318 4.252 -13.984 1.00 0.00 C ATOM 982 CG GLU A 66 3.935 5.326 -14.856 1.00 0.00 C ATOM 983 CD GLU A 66 3.979 4.937 -16.319 1.00 0.00 C ATOM 984 OE1 GLU A 66 2.909 4.879 -16.959 1.00 0.00 O ATOM 985 OE2 GLU A 66 5.083 4.688 -16.841 1.00 0.00 O ATOM 0 H GLU A 66 5.232 4.590 -12.475 1.00 0.00 H new ATOM 0 HA GLU A 66 2.531 5.579 -12.491 1.00 0.00 H new ATOM 0 HB2 GLU A 66 3.942 3.359 -14.023 1.00 0.00 H new ATOM 0 HB3 GLU A 66 2.345 3.978 -14.391 1.00 0.00 H new ATOM 0 HG2 GLU A 66 3.365 6.249 -14.747 1.00 0.00 H new ATOM 0 HG3 GLU A 66 4.947 5.533 -14.509 1.00 0.00 H new ATOM 992 N PRO A 67 1.128 3.423 -11.868 1.00 0.00 N ATOM 993 CA PRO A 67 0.344 2.428 -11.119 1.00 0.00 C ATOM 994 C PRO A 67 1.010 1.056 -10.995 1.00 0.00 C ATOM 995 O PRO A 67 1.006 0.453 -9.924 1.00 0.00 O ATOM 996 CB PRO A 67 -0.924 2.312 -11.949 1.00 0.00 C ATOM 997 CG PRO A 67 -1.114 3.666 -12.536 1.00 0.00 C ATOM 998 CD PRO A 67 0.264 4.231 -12.755 1.00 0.00 C ATOM 0 HA PRO A 67 0.202 2.743 -10.085 1.00 0.00 H new ATOM 0 HB2 PRO A 67 -0.821 1.554 -12.726 1.00 0.00 H new ATOM 0 HB3 PRO A 67 -1.776 2.024 -11.333 1.00 0.00 H new ATOM 0 HG2 PRO A 67 -1.664 3.608 -13.475 1.00 0.00 H new ATOM 0 HG3 PRO A 67 -1.693 4.302 -11.866 1.00 0.00 H new ATOM 0 HD2 PRO A 67 0.570 4.144 -13.798 1.00 0.00 H new ATOM 0 HD3 PRO A 67 0.307 5.289 -12.498 1.00 0.00 H new ATOM 1006 N ASP A 68 1.588 0.570 -12.085 1.00 0.00 N ATOM 1007 CA ASP A 68 2.207 -0.754 -12.096 1.00 0.00 C ATOM 1008 C ASP A 68 3.395 -0.823 -11.138 1.00 0.00 C ATOM 1009 O ASP A 68 3.818 -1.908 -10.735 1.00 0.00 O ATOM 1010 CB ASP A 68 2.650 -1.133 -13.511 1.00 0.00 C ATOM 1011 CG ASP A 68 3.739 -0.228 -14.054 1.00 0.00 C ATOM 1012 OD1 ASP A 68 3.416 0.883 -14.526 1.00 0.00 O ATOM 1013 OD2 ASP A 68 4.919 -0.629 -14.028 1.00 0.00 O ATOM 0 H ASP A 68 1.643 1.069 -12.973 1.00 0.00 H new ATOM 0 HA ASP A 68 1.457 -1.469 -11.758 1.00 0.00 H new ATOM 0 HB2 ASP A 68 3.008 -2.163 -13.510 1.00 0.00 H new ATOM 0 HB3 ASP A 68 1.788 -1.096 -14.178 1.00 0.00 H new ATOM 1018 N ALA A 69 3.917 0.336 -10.765 1.00 0.00 N ATOM 1019 CA ALA A 69 5.038 0.407 -9.845 1.00 0.00 C ATOM 1020 C ALA A 69 4.635 1.071 -8.524 1.00 0.00 C ATOM 1021 O ALA A 69 5.408 1.077 -7.566 1.00 0.00 O ATOM 1022 CB ALA A 69 6.188 1.157 -10.495 1.00 0.00 C ATOM 0 H ALA A 69 3.579 1.243 -11.088 1.00 0.00 H new ATOM 0 HA ALA A 69 5.360 -0.609 -9.614 1.00 0.00 H new ATOM 0 HB1 ALA A 69 7.027 1.208 -9.801 1.00 0.00 H new ATOM 0 HB2 ALA A 69 6.497 0.635 -11.401 1.00 0.00 H new ATOM 0 HB3 ALA A 69 5.866 2.167 -10.750 1.00 0.00 H new ATOM 1028 N ALA A 70 3.418 1.605 -8.468 1.00 0.00 N ATOM 1029 CA ALA A 70 2.948 2.321 -7.286 1.00 0.00 C ATOM 1030 C ALA A 70 1.460 2.090 -7.050 1.00 0.00 C ATOM 1031 O ALA A 70 0.641 2.325 -7.940 1.00 0.00 O ATOM 1032 CB ALA A 70 3.224 3.810 -7.420 1.00 0.00 C ATOM 0 H ALA A 70 2.739 1.555 -9.228 1.00 0.00 H new ATOM 0 HA ALA A 70 3.494 1.931 -6.427 1.00 0.00 H new ATOM 0 HB1 ALA A 70 2.867 4.328 -6.530 1.00 0.00 H new ATOM 0 HB2 ALA A 70 4.296 3.973 -7.529 1.00 0.00 H new ATOM 0 HB3 ALA A 70 2.707 4.198 -8.297 1.00 0.00 H new ATOM 1095 N SER A 75 -8.039 -3.675 -11.602 1.00 0.00 N ATOM 1096 CA SER A 75 -8.377 -4.777 -12.474 1.00 0.00 C ATOM 1097 C SER A 75 -9.885 -4.953 -12.581 1.00 0.00 C ATOM 1098 O SER A 75 -10.565 -5.162 -11.581 1.00 0.00 O ATOM 1099 CB SER A 75 -7.732 -6.059 -11.948 1.00 0.00 C ATOM 1100 OG SER A 75 -6.324 -5.918 -11.849 1.00 0.00 O ATOM 0 HA SER A 75 -7.996 -4.559 -13.472 1.00 0.00 H new ATOM 0 HB2 SER A 75 -8.146 -6.303 -10.970 1.00 0.00 H new ATOM 0 HB3 SER A 75 -7.972 -6.890 -12.612 1.00 0.00 H new ATOM 0 HG SER A 75 -6.098 -4.972 -11.727 1.00 0.00 H new ATOM 1106 N PRO A 76 -10.435 -4.867 -13.797 1.00 0.00 N ATOM 1107 CA PRO A 76 -11.863 -5.091 -14.024 1.00 0.00 C ATOM 1108 C PRO A 76 -12.242 -6.553 -13.830 1.00 0.00 C ATOM 1109 O PRO A 76 -13.412 -6.887 -13.636 1.00 0.00 O ATOM 1110 CB PRO A 76 -12.068 -4.665 -15.475 1.00 0.00 C ATOM 1111 CG PRO A 76 -10.732 -4.827 -16.115 1.00 0.00 C ATOM 1112 CD PRO A 76 -9.718 -4.536 -15.044 1.00 0.00 C ATOM 0 HA PRO A 76 -12.486 -4.536 -13.322 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -12.819 -5.284 -15.966 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -12.414 -3.633 -15.539 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -10.607 -5.837 -16.506 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -10.617 -4.143 -16.956 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -8.820 -5.142 -15.165 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -9.403 -3.493 -15.062 1.00 0.00 H new ATOM 1120 N ASP A 77 -11.235 -7.418 -13.873 1.00 0.00 N ATOM 1121 CA ASP A 77 -11.442 -8.848 -13.712 1.00 0.00 C ATOM 1122 C ASP A 77 -11.669 -9.214 -12.253 1.00 0.00 C ATOM 1123 O ASP A 77 -12.099 -10.327 -11.953 1.00 0.00 O ATOM 1124 CB ASP A 77 -10.256 -9.639 -14.269 1.00 0.00 C ATOM 1125 CG ASP A 77 -8.963 -9.353 -13.535 1.00 0.00 C ATOM 1126 OD1 ASP A 77 -8.314 -8.334 -13.854 1.00 0.00 O ATOM 1127 OD2 ASP A 77 -8.584 -10.147 -12.646 1.00 0.00 O ATOM 0 H ASP A 77 -10.262 -7.149 -14.019 1.00 0.00 H new ATOM 0 HA ASP A 77 -12.337 -9.111 -14.276 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -10.475 -10.705 -14.208 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -10.130 -9.400 -15.325 1.00 0.00 H new ATOM 1132 N LEU A 78 -11.390 -8.288 -11.338 1.00 0.00 N ATOM 1133 CA LEU A 78 -11.636 -8.569 -9.930 1.00 0.00 C ATOM 1134 C LEU A 78 -13.026 -8.114 -9.536 1.00 0.00 C ATOM 1135 O LEU A 78 -13.450 -8.295 -8.397 1.00 0.00 O ATOM 1136 CB LEU A 78 -10.567 -7.974 -9.001 1.00 0.00 C ATOM 1137 CG LEU A 78 -10.316 -6.477 -9.098 1.00 0.00 C ATOM 1138 CD1 LEU A 78 -11.423 -5.707 -8.411 1.00 0.00 C ATOM 1139 CD2 LEU A 78 -8.974 -6.146 -8.478 1.00 0.00 C ATOM 0 H LEU A 78 -11.005 -7.365 -11.539 1.00 0.00 H new ATOM 0 HA LEU A 78 -11.571 -9.650 -9.805 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -10.847 -8.203 -7.973 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -9.626 -8.488 -9.197 1.00 0.00 H new ATOM 0 HG LEU A 78 -10.304 -6.186 -10.148 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -11.226 -4.638 -8.491 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -12.376 -5.937 -8.887 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -11.465 -5.991 -7.359 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -8.795 -5.073 -8.548 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -8.973 -6.446 -7.430 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -8.186 -6.680 -9.009 1.00 0.00 H new ATOM 1151 N ILE A 79 -13.717 -7.472 -10.463 1.00 0.00 N ATOM 1152 CA ILE A 79 -15.127 -7.189 -10.305 1.00 0.00 C ATOM 1153 C ILE A 79 -15.944 -8.424 -10.649 1.00 0.00 C ATOM 1154 O ILE A 79 -15.653 -9.119 -11.626 1.00 0.00 O ATOM 1155 CB ILE A 79 -15.539 -6.025 -11.232 1.00 0.00 C ATOM 1156 CG1 ILE A 79 -14.585 -4.845 -11.034 1.00 0.00 C ATOM 1157 CG2 ILE A 79 -16.981 -5.602 -10.978 1.00 0.00 C ATOM 1158 CD1 ILE A 79 -14.830 -3.698 -11.986 1.00 0.00 C ATOM 0 H ILE A 79 -13.317 -7.136 -11.339 1.00 0.00 H new ATOM 0 HA ILE A 79 -15.316 -6.908 -9.269 1.00 0.00 H new ATOM 0 HB ILE A 79 -15.475 -6.365 -12.266 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -14.678 -4.482 -10.010 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -13.560 -5.194 -11.156 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -17.242 -4.781 -11.645 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -17.646 -6.446 -11.163 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -17.088 -5.277 -9.943 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -14.116 -2.899 -11.785 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -14.708 -4.044 -13.012 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -15.844 -3.321 -11.849 1.00 0.00 H new ATOM 1170 N GLN A 80 -16.968 -8.684 -9.855 1.00 0.00 N ATOM 1171 CA GLN A 80 -17.804 -9.859 -10.043 1.00 0.00 C ATOM 1172 C GLN A 80 -19.252 -9.513 -9.750 1.00 0.00 C ATOM 1173 O GLN A 80 -19.538 -8.731 -8.841 1.00 0.00 O ATOM 1174 CB GLN A 80 -17.331 -11.019 -9.160 1.00 0.00 C ATOM 1175 CG GLN A 80 -15.945 -11.534 -9.532 1.00 0.00 C ATOM 1176 CD GLN A 80 -14.902 -11.260 -8.467 1.00 0.00 C ATOM 1177 OE1 GLN A 80 -15.198 -11.252 -7.276 1.00 0.00 O ATOM 1178 NE2 GLN A 80 -13.670 -11.034 -8.891 1.00 0.00 N ATOM 0 H GLN A 80 -17.242 -8.094 -9.069 1.00 0.00 H new ATOM 0 HA GLN A 80 -17.722 -10.181 -11.081 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -17.323 -10.695 -8.119 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -18.047 -11.838 -9.233 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -15.999 -12.608 -9.711 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -15.631 -11.070 -10.467 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -13.464 -11.049 -9.890 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -12.926 -10.845 -8.219 1.00 0.00 H new ATOM 1187 N TYR A 81 -20.167 -10.084 -10.519 1.00 0.00 N ATOM 1188 CA TYR A 81 -21.576 -9.777 -10.352 1.00 0.00 C ATOM 1189 C TYR A 81 -22.322 -11.009 -9.861 1.00 0.00 C ATOM 1190 O TYR A 81 -22.475 -11.993 -10.586 1.00 0.00 O ATOM 1191 CB TYR A 81 -22.178 -9.302 -11.679 1.00 0.00 C ATOM 1192 CG TYR A 81 -21.412 -8.172 -12.339 1.00 0.00 C ATOM 1193 CD1 TYR A 81 -20.331 -8.434 -13.173 1.00 0.00 C ATOM 1194 CD2 TYR A 81 -21.770 -6.846 -12.130 1.00 0.00 C ATOM 1195 CE1 TYR A 81 -19.628 -7.409 -13.778 1.00 0.00 C ATOM 1196 CE2 TYR A 81 -21.070 -5.817 -12.732 1.00 0.00 C ATOM 1197 CZ TYR A 81 -20.002 -6.103 -13.554 1.00 0.00 C ATOM 1198 OH TYR A 81 -19.305 -5.079 -14.156 1.00 0.00 O ATOM 0 H TYR A 81 -19.960 -10.756 -11.258 1.00 0.00 H new ATOM 0 HA TYR A 81 -21.674 -8.980 -9.615 1.00 0.00 H new ATOM 0 HB2 TYR A 81 -22.223 -10.146 -12.367 1.00 0.00 H new ATOM 0 HB3 TYR A 81 -23.204 -8.977 -11.504 1.00 0.00 H new ATOM 0 HD1 TYR A 81 -20.035 -9.457 -13.351 1.00 0.00 H new ATOM 0 HD2 TYR A 81 -22.607 -6.616 -11.488 1.00 0.00 H new ATOM 0 HE1 TYR A 81 -18.790 -7.631 -14.423 1.00 0.00 H new ATOM 0 HE2 TYR A 81 -21.360 -4.791 -12.558 1.00 0.00 H new ATOM 0 HH TYR A 81 -19.697 -4.219 -13.896 1.00 0.00 H new ATOM 1208 N PHE A 82 -22.785 -10.935 -8.630 1.00 0.00 N ATOM 1209 CA PHE A 82 -23.569 -12.004 -8.027 1.00 0.00 C ATOM 1210 C PHE A 82 -25.012 -11.560 -7.864 1.00 0.00 C ATOM 1211 O PHE A 82 -25.331 -10.400 -8.098 1.00 0.00 O ATOM 1212 CB PHE A 82 -22.984 -12.387 -6.668 1.00 0.00 C ATOM 1213 CG PHE A 82 -21.673 -13.124 -6.746 1.00 0.00 C ATOM 1214 CD1 PHE A 82 -20.488 -12.450 -7.001 1.00 0.00 C ATOM 1215 CD2 PHE A 82 -21.628 -14.496 -6.547 1.00 0.00 C ATOM 1216 CE1 PHE A 82 -19.287 -13.131 -7.058 1.00 0.00 C ATOM 1217 CE2 PHE A 82 -20.429 -15.182 -6.605 1.00 0.00 C ATOM 1218 CZ PHE A 82 -19.257 -14.498 -6.861 1.00 0.00 C ATOM 0 H PHE A 82 -22.631 -10.135 -8.016 1.00 0.00 H new ATOM 0 HA PHE A 82 -23.536 -12.875 -8.681 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -22.845 -11.482 -6.077 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -23.706 -13.007 -6.136 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -20.504 -11.381 -7.157 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -22.541 -15.035 -6.344 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -18.371 -12.594 -7.257 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -20.409 -16.251 -6.450 1.00 0.00 H new ATOM 0 HZ PHE A 82 -18.319 -15.031 -6.907 1.00 0.00 H new ATOM 1228 N SER A 83 -25.887 -12.479 -7.497 1.00 0.00 N ATOM 1229 CA SER A 83 -27.283 -12.138 -7.291 1.00 0.00 C ATOM 1230 C SER A 83 -27.476 -11.530 -5.908 1.00 0.00 C ATOM 1231 O SER A 83 -26.718 -11.801 -4.978 1.00 0.00 O ATOM 1232 CB SER A 83 -28.180 -13.371 -7.442 1.00 0.00 C ATOM 1233 OG SER A 83 -29.549 -13.017 -7.373 1.00 0.00 O ATOM 0 H SER A 83 -25.658 -13.460 -7.336 1.00 0.00 H new ATOM 0 HA SER A 83 -27.567 -11.409 -8.050 1.00 0.00 H new ATOM 0 HB2 SER A 83 -27.975 -13.859 -8.395 1.00 0.00 H new ATOM 0 HB3 SER A 83 -27.948 -14.092 -6.658 1.00 0.00 H new ATOM 0 HG SER A 83 -29.664 -12.095 -7.684 1.00 0.00 H new ATOM 1239 N ARG A 84 -28.512 -10.721 -5.785 1.00 0.00 N ATOM 1240 CA ARG A 84 -28.862 -10.089 -4.521 1.00 0.00 C ATOM 1241 C ARG A 84 -29.363 -11.144 -3.542 1.00 0.00 C ATOM 1242 O ARG A 84 -29.232 -11.014 -2.327 1.00 0.00 O ATOM 1243 CB ARG A 84 -29.948 -9.048 -4.764 1.00 0.00 C ATOM 1244 CG ARG A 84 -31.130 -9.606 -5.537 1.00 0.00 C ATOM 1245 CD ARG A 84 -32.204 -8.567 -5.733 1.00 0.00 C ATOM 1246 NE ARG A 84 -32.726 -8.114 -4.452 1.00 0.00 N ATOM 1247 CZ ARG A 84 -33.096 -6.854 -4.211 1.00 0.00 C ATOM 1248 NH1 ARG A 84 -33.072 -5.958 -5.192 1.00 0.00 N ATOM 1249 NH2 ARG A 84 -33.487 -6.489 -2.997 1.00 0.00 N ATOM 0 H ARG A 84 -29.136 -10.482 -6.556 1.00 0.00 H new ATOM 0 HA ARG A 84 -27.983 -9.603 -4.098 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -30.295 -8.661 -3.806 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -29.524 -8.207 -5.313 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -30.792 -9.969 -6.508 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -31.544 -10.462 -5.003 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -31.799 -7.719 -6.286 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -33.013 -8.983 -6.334 1.00 0.00 H new ATOM 0 HE ARG A 84 -32.814 -8.796 -3.698 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -32.771 -6.233 -6.127 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -33.354 -4.995 -5.010 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -33.506 -7.173 -2.240 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -33.768 -5.525 -2.820 1.00 0.00 H new ATOM 1263 N ARG A 85 -29.950 -12.179 -4.115 1.00 0.00 N ATOM 1264 CA ARG A 85 -30.446 -13.316 -3.352 1.00 0.00 C ATOM 1265 C ARG A 85 -29.286 -14.032 -2.671 1.00 0.00 C ATOM 1266 O ARG A 85 -29.412 -14.518 -1.549 1.00 0.00 O ATOM 1267 CB ARG A 85 -31.228 -14.284 -4.248 1.00 0.00 C ATOM 1268 CG ARG A 85 -32.553 -13.742 -4.771 1.00 0.00 C ATOM 1269 CD ARG A 85 -32.374 -12.917 -6.037 1.00 0.00 C ATOM 1270 NE ARG A 85 -33.646 -12.416 -6.562 1.00 0.00 N ATOM 1271 CZ ARG A 85 -33.955 -12.374 -7.862 1.00 0.00 C ATOM 1272 NH1 ARG A 85 -33.140 -12.904 -8.769 1.00 0.00 N ATOM 1273 NH2 ARG A 85 -35.095 -11.818 -8.253 1.00 0.00 N ATOM 0 H ARG A 85 -30.097 -12.258 -5.121 1.00 0.00 H new ATOM 0 HA ARG A 85 -31.130 -12.946 -2.588 1.00 0.00 H new ATOM 0 HB2 ARG A 85 -30.602 -14.556 -5.098 1.00 0.00 H new ATOM 0 HB3 ARG A 85 -31.421 -15.199 -3.688 1.00 0.00 H new ATOM 0 HG2 ARG A 85 -33.230 -14.572 -4.973 1.00 0.00 H new ATOM 0 HG3 ARG A 85 -33.022 -13.128 -4.002 1.00 0.00 H new ATOM 0 HD2 ARG A 85 -31.714 -12.075 -5.828 1.00 0.00 H new ATOM 0 HD3 ARG A 85 -31.885 -13.525 -6.798 1.00 0.00 H new ATOM 0 HE ARG A 85 -34.339 -12.078 -5.894 1.00 0.00 H new ATOM 0 HH11 ARG A 85 -32.270 -13.348 -8.475 1.00 0.00 H new ATOM 0 HH12 ARG A 85 -33.385 -12.867 -9.758 1.00 0.00 H new ATOM 0 HH21 ARG A 85 -35.733 -11.424 -7.562 1.00 0.00 H new ATOM 0 HH22 ARG A 85 -35.333 -11.785 -9.244 1.00 0.00 H new ATOM 1287 N GLU A 86 -28.142 -14.042 -3.341 1.00 0.00 N ATOM 1288 CA GLU A 86 -26.932 -14.654 -2.799 1.00 0.00 C ATOM 1289 C GLU A 86 -26.313 -13.760 -1.725 1.00 0.00 C ATOM 1290 O GLU A 86 -25.421 -14.177 -0.986 1.00 0.00 O ATOM 1291 CB GLU A 86 -25.922 -14.906 -3.925 1.00 0.00 C ATOM 1292 CG GLU A 86 -26.444 -15.847 -4.999 1.00 0.00 C ATOM 1293 CD GLU A 86 -25.491 -16.002 -6.167 1.00 0.00 C ATOM 1294 OE1 GLU A 86 -25.444 -15.097 -7.028 1.00 0.00 O ATOM 1295 OE2 GLU A 86 -24.804 -17.043 -6.248 1.00 0.00 O ATOM 0 H GLU A 86 -28.024 -13.631 -4.267 1.00 0.00 H new ATOM 0 HA GLU A 86 -27.199 -15.607 -2.342 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -25.654 -13.954 -4.384 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -25.009 -15.322 -3.499 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -26.630 -16.826 -4.557 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -27.401 -15.476 -5.365 1.00 0.00 H new ATOM 1302 N PHE A 87 -26.820 -12.537 -1.635 1.00 0.00 N ATOM 1303 CA PHE A 87 -26.332 -11.563 -0.663 1.00 0.00 C ATOM 1304 C PHE A 87 -27.300 -11.444 0.498 1.00 0.00 C ATOM 1305 O PHE A 87 -26.922 -11.059 1.601 1.00 0.00 O ATOM 1306 CB PHE A 87 -26.100 -10.203 -1.315 1.00 0.00 C ATOM 1307 CG PHE A 87 -24.789 -10.115 -2.040 1.00 0.00 C ATOM 1308 CD1 PHE A 87 -24.382 -11.127 -2.893 1.00 0.00 C ATOM 1309 CD2 PHE A 87 -23.955 -9.027 -1.854 1.00 0.00 C ATOM 1310 CE1 PHE A 87 -23.173 -11.054 -3.546 1.00 0.00 C ATOM 1311 CE2 PHE A 87 -22.745 -8.949 -2.507 1.00 0.00 C ATOM 1312 CZ PHE A 87 -22.354 -9.965 -3.355 1.00 0.00 C ATOM 0 H PHE A 87 -27.575 -12.193 -2.228 1.00 0.00 H new ATOM 0 HA PHE A 87 -25.374 -11.916 -0.281 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -26.910 -9.999 -2.015 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -26.138 -9.428 -0.549 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -25.021 -11.984 -3.048 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -24.256 -8.230 -1.190 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -22.867 -11.851 -4.208 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -22.103 -8.094 -2.356 1.00 0.00 H new ATOM 0 HZ PHE A 87 -21.406 -9.905 -3.868 1.00 0.00 H new ATOM 1322 N MET A 88 -28.550 -11.817 0.240 1.00 0.00 N ATOM 1323 CA MET A 88 -29.575 -11.923 1.278 1.00 0.00 C ATOM 1324 C MET A 88 -29.141 -12.948 2.328 1.00 0.00 C ATOM 1325 O MET A 88 -29.684 -13.021 3.429 1.00 0.00 O ATOM 1326 CB MET A 88 -30.912 -12.319 0.638 1.00 0.00 C ATOM 1327 CG MET A 88 -32.033 -12.553 1.635 1.00 0.00 C ATOM 1328 SD MET A 88 -33.549 -13.148 0.854 1.00 0.00 S ATOM 1329 CE MET A 88 -33.948 -11.769 -0.221 1.00 0.00 C ATOM 0 H MET A 88 -28.883 -12.055 -0.694 1.00 0.00 H new ATOM 0 HA MET A 88 -29.702 -10.961 1.774 1.00 0.00 H new ATOM 0 HB2 MET A 88 -31.216 -11.536 -0.056 1.00 0.00 H new ATOM 0 HB3 MET A 88 -30.767 -13.226 0.052 1.00 0.00 H new ATOM 0 HG2 MET A 88 -31.705 -13.277 2.381 1.00 0.00 H new ATOM 0 HG3 MET A 88 -32.243 -11.623 2.164 1.00 0.00 H new ATOM 0 HE1 MET A 88 -34.984 -11.852 -0.551 1.00 0.00 H new ATOM 0 HE2 MET A 88 -33.814 -10.834 0.322 1.00 0.00 H new ATOM 0 HE3 MET A 88 -33.289 -11.782 -1.089 1.00 0.00 H new ATOM 1339 N ASP A 89 -28.118 -13.701 1.958 1.00 0.00 N ATOM 1340 CA ASP A 89 -27.490 -14.663 2.851 1.00 0.00 C ATOM 1341 C ASP A 89 -26.916 -13.938 4.067 1.00 0.00 C ATOM 1342 O ASP A 89 -26.875 -14.476 5.174 1.00 0.00 O ATOM 1343 CB ASP A 89 -26.383 -15.430 2.137 1.00 0.00 C ATOM 1344 CG ASP A 89 -25.769 -16.497 3.018 1.00 0.00 C ATOM 1345 OD1 ASP A 89 -26.347 -17.601 3.103 1.00 0.00 O ATOM 1346 OD2 ASP A 89 -24.719 -16.235 3.641 1.00 0.00 O ATOM 0 H ASP A 89 -27.699 -13.663 1.029 1.00 0.00 H new ATOM 0 HA ASP A 89 -28.247 -15.377 3.174 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -26.786 -15.892 1.236 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -25.608 -14.733 1.818 1.00 0.00 H new ATOM 1351 N ALA A 90 -26.480 -12.705 3.845 1.00 0.00 N ATOM 1352 CA ALA A 90 -25.942 -11.871 4.910 1.00 0.00 C ATOM 1353 C ALA A 90 -26.724 -10.565 5.020 1.00 0.00 C ATOM 1354 O ALA A 90 -26.276 -9.613 5.660 1.00 0.00 O ATOM 1355 CB ALA A 90 -24.467 -11.590 4.667 1.00 0.00 C ATOM 0 H ALA A 90 -26.489 -12.258 2.928 1.00 0.00 H new ATOM 0 HA ALA A 90 -26.043 -12.409 5.853 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -24.078 -10.965 5.471 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -23.917 -12.531 4.640 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -24.347 -11.072 3.715 1.00 0.00 H new ATOM 1361 N GLY A 91 -27.901 -10.531 4.412 1.00 0.00 N ATOM 1362 CA GLY A 91 -28.686 -9.312 4.391 1.00 0.00 C ATOM 1363 C GLY A 91 -28.489 -8.534 3.105 1.00 0.00 C ATOM 1364 O GLY A 91 -27.372 -8.435 2.595 1.00 0.00 O ATOM 0 H GLY A 91 -28.327 -11.325 3.933 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -29.741 -9.558 4.508 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -28.408 -8.687 5.240 1.00 0.00 H new ATOM 1368 N GLU A 92 -29.572 -7.976 2.585 1.00 0.00 N ATOM 1369 CA GLU A 92 -29.542 -7.296 1.297 1.00 0.00 C ATOM 1370 C GLU A 92 -28.722 -6.003 1.364 1.00 0.00 C ATOM 1371 O GLU A 92 -28.981 -5.119 2.183 1.00 0.00 O ATOM 1372 CB GLU A 92 -30.965 -7.045 0.801 1.00 0.00 C ATOM 1373 CG GLU A 92 -31.739 -8.339 0.592 1.00 0.00 C ATOM 1374 CD GLU A 92 -33.095 -8.132 -0.045 1.00 0.00 C ATOM 1375 OE1 GLU A 92 -34.025 -7.684 0.656 1.00 0.00 O ATOM 1376 OE2 GLU A 92 -33.241 -8.423 -1.250 1.00 0.00 O ATOM 0 H GLU A 92 -30.486 -7.981 3.037 1.00 0.00 H new ATOM 0 HA GLU A 92 -29.043 -7.943 0.576 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -31.494 -6.420 1.521 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -30.928 -6.490 -0.137 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -31.150 -9.009 -0.035 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -31.870 -8.835 1.554 1.00 0.00 H new ATOM 1383 N PRO A 93 -27.719 -5.908 0.479 1.00 0.00 N ATOM 1384 CA PRO A 93 -26.674 -4.872 0.506 1.00 0.00 C ATOM 1385 C PRO A 93 -27.101 -3.515 -0.038 1.00 0.00 C ATOM 1386 O PRO A 93 -28.173 -3.361 -0.632 1.00 0.00 O ATOM 1387 CB PRO A 93 -25.591 -5.482 -0.374 1.00 0.00 C ATOM 1388 CG PRO A 93 -26.344 -6.260 -1.385 1.00 0.00 C ATOM 1389 CD PRO A 93 -27.534 -6.826 -0.663 1.00 0.00 C ATOM 0 HA PRO A 93 -26.374 -4.643 1.529 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -24.976 -4.713 -0.840 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -24.921 -6.120 0.202 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -26.656 -5.625 -2.214 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -25.728 -7.054 -1.806 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -28.416 -6.852 -1.303 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -27.352 -7.848 -0.330 1.00 0.00 H new ATOM 1397 N GLU A 94 -26.235 -2.536 0.199 1.00 0.00 N ATOM 1398 CA GLU A 94 -26.494 -1.144 -0.131 1.00 0.00 C ATOM 1399 C GLU A 94 -25.496 -0.640 -1.177 1.00 0.00 C ATOM 1400 O GLU A 94 -24.461 -1.261 -1.404 1.00 0.00 O ATOM 1401 CB GLU A 94 -26.363 -0.288 1.132 1.00 0.00 C ATOM 1402 CG GLU A 94 -26.704 -1.007 2.434 1.00 0.00 C ATOM 1403 CD GLU A 94 -25.576 -1.858 2.979 1.00 0.00 C ATOM 1404 OE1 GLU A 94 -24.595 -1.286 3.489 1.00 0.00 O ATOM 1405 OE2 GLU A 94 -25.671 -3.101 2.921 1.00 0.00 O ATOM 0 H GLU A 94 -25.324 -2.691 0.631 1.00 0.00 H new ATOM 0 HA GLU A 94 -27.503 -1.068 -0.537 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -25.341 0.084 1.197 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -27.013 0.581 1.033 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -26.983 -0.267 3.184 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -27.577 -1.639 2.271 1.00 0.00 H new ATOM 1412 N ILE A 95 -25.801 0.490 -1.803 1.00 0.00 N ATOM 1413 CA ILE A 95 -24.914 1.066 -2.807 1.00 0.00 C ATOM 1414 C ILE A 95 -23.804 1.884 -2.149 1.00 0.00 C ATOM 1415 O ILE A 95 -24.055 2.673 -1.236 1.00 0.00 O ATOM 1416 CB ILE A 95 -25.682 1.945 -3.819 1.00 0.00 C ATOM 1417 CG1 ILE A 95 -26.802 1.131 -4.461 1.00 0.00 C ATOM 1418 CG2 ILE A 95 -24.742 2.486 -4.890 1.00 0.00 C ATOM 1419 CD1 ILE A 95 -27.483 1.820 -5.619 1.00 0.00 C ATOM 0 H ILE A 95 -26.653 1.025 -1.634 1.00 0.00 H new ATOM 0 HA ILE A 95 -24.469 0.233 -3.352 1.00 0.00 H new ATOM 0 HB ILE A 95 -26.113 2.793 -3.288 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -26.393 0.182 -4.807 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -27.548 0.899 -3.701 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -25.305 3.102 -5.591 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -23.965 3.089 -4.421 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -24.283 1.655 -5.425 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -28.265 1.174 -6.018 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -27.924 2.756 -5.277 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -26.751 2.028 -6.400 1.00 0.00 H new ATOM 1431 N GLY A 96 -22.578 1.673 -2.612 1.00 0.00 N ATOM 1432 CA GLY A 96 -21.430 2.369 -2.066 1.00 0.00 C ATOM 1433 C GLY A 96 -21.092 1.895 -0.673 1.00 0.00 C ATOM 1434 O GLY A 96 -20.570 2.657 0.141 1.00 0.00 O ATOM 0 H GLY A 96 -22.358 1.023 -3.366 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -20.570 2.218 -2.719 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -21.631 3.440 -2.046 1.00 0.00 H new ATOM 1438 N ALA A 97 -21.389 0.635 -0.395 1.00 0.00 N ATOM 1439 CA ALA A 97 -21.119 0.061 0.908 1.00 0.00 C ATOM 1440 C ALA A 97 -19.931 -0.885 0.820 1.00 0.00 C ATOM 1441 O ALA A 97 -19.774 -1.609 -0.161 1.00 0.00 O ATOM 1442 CB ALA A 97 -22.355 -0.656 1.442 1.00 0.00 C ATOM 0 H ALA A 97 -21.819 -0.009 -1.059 1.00 0.00 H new ATOM 0 HA ALA A 97 -20.871 0.861 1.606 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -22.134 -1.081 2.421 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -23.177 0.054 1.531 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -22.638 -1.454 0.755 1.00 0.00 H new ATOM 1448 N ILE A 98 -19.080 -0.852 1.825 1.00 0.00 N ATOM 1449 CA ILE A 98 -17.911 -1.708 1.850 1.00 0.00 C ATOM 1450 C ILE A 98 -18.259 -3.044 2.488 1.00 0.00 C ATOM 1451 O ILE A 98 -18.499 -3.125 3.691 1.00 0.00 O ATOM 1452 CB ILE A 98 -16.745 -1.044 2.612 1.00 0.00 C ATOM 1453 CG1 ILE A 98 -16.416 0.309 1.975 1.00 0.00 C ATOM 1454 CG2 ILE A 98 -15.518 -1.951 2.608 1.00 0.00 C ATOM 1455 CD1 ILE A 98 -15.440 1.145 2.773 1.00 0.00 C ATOM 0 H ILE A 98 -19.176 -0.241 2.636 1.00 0.00 H new ATOM 0 HA ILE A 98 -17.590 -1.872 0.821 1.00 0.00 H new ATOM 0 HB ILE A 98 -17.044 -0.884 3.648 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -16.004 0.140 0.980 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -17.340 0.872 1.846 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -14.706 -1.467 3.150 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -15.763 -2.897 3.091 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -15.207 -2.138 1.580 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -15.259 2.087 2.255 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -15.856 1.348 3.760 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -14.500 0.604 2.880 1.00 0.00 H new ATOM 1467 N MET A 99 -18.322 -4.084 1.673 1.00 0.00 N ATOM 1468 CA MET A 99 -18.632 -5.402 2.170 1.00 0.00 C ATOM 1469 C MET A 99 -17.375 -6.223 2.355 1.00 0.00 C ATOM 1470 O MET A 99 -16.561 -6.340 1.446 1.00 0.00 O ATOM 1471 CB MET A 99 -19.539 -6.165 1.228 1.00 0.00 C ATOM 1472 CG MET A 99 -20.902 -5.553 1.041 1.00 0.00 C ATOM 1473 SD MET A 99 -21.982 -6.579 0.022 1.00 0.00 S ATOM 1474 CE MET A 99 -22.256 -7.969 1.116 1.00 0.00 C ATOM 0 H MET A 99 -18.162 -4.035 0.667 1.00 0.00 H new ATOM 0 HA MET A 99 -19.137 -5.252 3.124 1.00 0.00 H new ATOM 0 HB2 MET A 99 -19.052 -6.240 0.256 1.00 0.00 H new ATOM 0 HB3 MET A 99 -19.659 -7.181 1.603 1.00 0.00 H new ATOM 0 HG2 MET A 99 -21.365 -5.399 2.016 1.00 0.00 H new ATOM 0 HG3 MET A 99 -20.796 -4.571 0.580 1.00 0.00 H new ATOM 0 HE1 MET A 99 -23.326 -8.151 1.212 1.00 0.00 H new ATOM 0 HE2 MET A 99 -21.773 -8.856 0.706 1.00 0.00 H new ATOM 0 HE3 MET A 99 -21.836 -7.748 2.097 1.00 0.00 H new ATOM 1484 N LEU A 100 -17.206 -6.749 3.540 1.00 0.00 N ATOM 1485 CA LEU A 100 -16.253 -7.828 3.712 1.00 0.00 C ATOM 1486 C LEU A 100 -16.775 -9.050 2.971 1.00 0.00 C ATOM 1487 O LEU A 100 -17.985 -9.271 2.888 1.00 0.00 O ATOM 1488 CB LEU A 100 -16.000 -8.131 5.190 1.00 0.00 C ATOM 1489 CG LEU A 100 -14.932 -7.258 5.860 1.00 0.00 C ATOM 1490 CD1 LEU A 100 -13.608 -7.388 5.127 1.00 0.00 C ATOM 1491 CD2 LEU A 100 -15.367 -5.803 5.903 1.00 0.00 C ATOM 0 H LEU A 100 -17.699 -6.461 4.385 1.00 0.00 H new ATOM 0 HA LEU A 100 -15.290 -7.532 3.296 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -16.937 -8.013 5.734 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -15.705 -9.176 5.285 1.00 0.00 H new ATOM 0 HG LEU A 100 -14.804 -7.606 6.885 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -12.860 -6.763 5.614 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -13.281 -8.428 5.148 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -13.732 -7.067 4.093 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -14.592 -5.206 6.383 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -15.527 -5.441 4.887 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -16.294 -5.717 6.470 1.00 0.00 H new ATOM 1503 N PHE A 101 -15.856 -9.847 2.445 1.00 0.00 N ATOM 1504 CA PHE A 101 -16.166 -10.703 1.304 1.00 0.00 C ATOM 1505 C PHE A 101 -15.329 -11.958 1.360 1.00 0.00 C ATOM 1506 O PHE A 101 -14.408 -12.065 2.162 1.00 0.00 O ATOM 1507 CB PHE A 101 -15.943 -10.016 -0.038 1.00 0.00 C ATOM 1508 CG PHE A 101 -17.140 -9.288 -0.565 1.00 0.00 C ATOM 1509 CD1 PHE A 101 -18.400 -9.861 -0.533 1.00 0.00 C ATOM 1510 CD2 PHE A 101 -16.998 -8.025 -1.089 1.00 0.00 C ATOM 1511 CE1 PHE A 101 -19.496 -9.180 -1.022 1.00 0.00 C ATOM 1512 CE2 PHE A 101 -18.087 -7.333 -1.579 1.00 0.00 C ATOM 1513 CZ PHE A 101 -19.339 -7.913 -1.546 1.00 0.00 C ATOM 0 H PHE A 101 -14.897 -9.920 2.785 1.00 0.00 H new ATOM 0 HA PHE A 101 -17.227 -10.942 1.376 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -15.118 -9.310 0.061 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -15.637 -10.764 -0.769 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -18.526 -10.851 -0.121 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -16.020 -7.568 -1.118 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -20.474 -9.637 -0.995 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -17.960 -6.341 -1.987 1.00 0.00 H new ATOM 0 HZ PHE A 101 -20.194 -7.376 -1.930 1.00 0.00 H new ATOM 1523 N THR A 102 -15.654 -12.904 0.514 1.00 0.00 N ATOM 1524 CA THR A 102 -14.806 -14.055 0.342 1.00 0.00 C ATOM 1525 C THR A 102 -14.486 -14.214 -1.132 1.00 0.00 C ATOM 1526 O THR A 102 -15.386 -14.206 -1.973 1.00 0.00 O ATOM 1527 CB THR A 102 -15.418 -15.342 0.903 1.00 0.00 C ATOM 1528 OG1 THR A 102 -16.044 -15.066 2.164 1.00 0.00 O ATOM 1529 CG2 THR A 102 -14.324 -16.388 1.093 1.00 0.00 C ATOM 0 H THR A 102 -16.495 -12.899 -0.063 1.00 0.00 H new ATOM 0 HA THR A 102 -13.893 -13.884 0.913 1.00 0.00 H new ATOM 0 HB THR A 102 -16.164 -15.722 0.205 1.00 0.00 H new ATOM 0 HG1 THR A 102 -16.437 -15.890 2.521 1.00 0.00 H new ATOM 0 HG21 THR A 102 -14.761 -17.303 1.492 1.00 0.00 H new ATOM 0 HG22 THR A 102 -13.852 -16.600 0.133 1.00 0.00 H new ATOM 0 HG23 THR A 102 -13.576 -16.009 1.789 1.00 0.00 H new ATOM 1537 N ALA A 103 -13.214 -14.351 -1.442 1.00 0.00 N ATOM 1538 CA ALA A 103 -12.777 -14.422 -2.819 1.00 0.00 C ATOM 1539 C ALA A 103 -12.598 -15.880 -3.208 1.00 0.00 C ATOM 1540 O ALA A 103 -12.372 -16.734 -2.350 1.00 0.00 O ATOM 1541 CB ALA A 103 -11.487 -13.636 -2.998 1.00 0.00 C ATOM 0 H ALA A 103 -12.462 -14.416 -0.756 1.00 0.00 H new ATOM 0 HA ALA A 103 -13.527 -13.977 -3.473 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -11.166 -13.695 -4.038 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -11.656 -12.593 -2.730 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -10.713 -14.055 -2.355 1.00 0.00 H new ATOM 1547 N MET A 104 -12.710 -16.159 -4.502 1.00 0.00 N ATOM 1548 CA MET A 104 -12.685 -17.531 -5.004 1.00 0.00 C ATOM 1549 C MET A 104 -11.334 -18.198 -4.772 1.00 0.00 C ATOM 1550 O MET A 104 -11.200 -19.411 -4.928 1.00 0.00 O ATOM 1551 CB MET A 104 -13.034 -17.575 -6.494 1.00 0.00 C ATOM 1552 CG MET A 104 -14.507 -17.328 -6.793 1.00 0.00 C ATOM 1553 SD MET A 104 -15.015 -15.617 -6.535 1.00 0.00 S ATOM 1554 CE MET A 104 -14.084 -14.783 -7.819 1.00 0.00 C ATOM 0 H MET A 104 -12.820 -15.450 -5.227 1.00 0.00 H new ATOM 0 HA MET A 104 -13.437 -18.086 -4.444 1.00 0.00 H new ATOM 0 HB2 MET A 104 -12.437 -16.829 -7.019 1.00 0.00 H new ATOM 0 HB3 MET A 104 -12.751 -18.548 -6.894 1.00 0.00 H new ATOM 0 HG2 MET A 104 -14.712 -17.608 -7.826 1.00 0.00 H new ATOM 0 HG3 MET A 104 -15.112 -17.978 -6.161 1.00 0.00 H new ATOM 0 HE1 MET A 104 -13.275 -14.209 -7.367 1.00 0.00 H new ATOM 0 HE2 MET A 104 -13.667 -15.521 -8.504 1.00 0.00 H new ATOM 0 HE3 MET A 104 -14.743 -14.111 -8.368 1.00 0.00 H new ATOM 1564 N ASP A 105 -10.335 -17.405 -4.416 1.00 0.00 N ATOM 1565 CA ASP A 105 -9.013 -17.937 -4.109 1.00 0.00 C ATOM 1566 C ASP A 105 -8.849 -18.158 -2.605 1.00 0.00 C ATOM 1567 O ASP A 105 -7.760 -18.476 -2.132 1.00 0.00 O ATOM 1568 CB ASP A 105 -7.917 -17.006 -4.637 1.00 0.00 C ATOM 1569 CG ASP A 105 -7.915 -15.646 -3.971 1.00 0.00 C ATOM 1570 OD1 ASP A 105 -8.877 -14.879 -4.180 1.00 0.00 O ATOM 1571 OD2 ASP A 105 -6.950 -15.333 -3.241 1.00 0.00 O ATOM 0 H ASP A 105 -10.413 -16.391 -4.332 1.00 0.00 H new ATOM 0 HA ASP A 105 -8.915 -18.901 -4.608 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -6.946 -17.478 -4.487 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -8.046 -16.877 -5.712 1.00 0.00 H new ATOM 1576 N GLY A 106 -9.934 -17.980 -1.856 1.00 0.00 N ATOM 1577 CA GLY A 106 -9.923 -18.273 -0.434 1.00 0.00 C ATOM 1578 C GLY A 106 -9.510 -17.090 0.416 1.00 0.00 C ATOM 1579 O GLY A 106 -9.651 -17.114 1.639 1.00 0.00 O ATOM 0 H GLY A 106 -10.826 -17.636 -2.212 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -10.917 -18.601 -0.130 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -9.242 -19.103 -0.246 1.00 0.00 H new ATOM 1583 N SER A 107 -9.008 -16.048 -0.221 1.00 0.00 N ATOM 1584 CA SER A 107 -8.607 -14.853 0.497 1.00 0.00 C ATOM 1585 C SER A 107 -9.822 -14.013 0.808 1.00 0.00 C ATOM 1586 O SER A 107 -10.771 -13.943 0.025 1.00 0.00 O ATOM 1587 CB SER A 107 -7.596 -14.042 -0.310 1.00 0.00 C ATOM 1588 OG SER A 107 -7.228 -12.846 0.360 1.00 0.00 O ATOM 0 H SER A 107 -8.869 -16.005 -1.231 1.00 0.00 H new ATOM 0 HA SER A 107 -8.129 -15.154 1.429 1.00 0.00 H new ATOM 0 HB2 SER A 107 -6.707 -14.646 -0.491 1.00 0.00 H new ATOM 0 HB3 SER A 107 -8.020 -13.798 -1.284 1.00 0.00 H new ATOM 0 HG SER A 107 -6.579 -12.353 -0.184 1.00 0.00 H new ATOM 1594 N GLU A 108 -9.801 -13.405 1.967 1.00 0.00 N ATOM 1595 CA GLU A 108 -10.896 -12.560 2.375 1.00 0.00 C ATOM 1596 C GLU A 108 -10.608 -11.119 1.960 1.00 0.00 C ATOM 1597 O GLU A 108 -9.849 -10.394 2.605 1.00 0.00 O ATOM 1598 CB GLU A 108 -11.086 -12.678 3.884 1.00 0.00 C ATOM 1599 CG GLU A 108 -12.442 -12.206 4.370 1.00 0.00 C ATOM 1600 CD GLU A 108 -12.563 -12.197 5.880 1.00 0.00 C ATOM 1601 OE1 GLU A 108 -12.867 -13.261 6.466 1.00 0.00 O ATOM 1602 OE2 GLU A 108 -12.369 -11.124 6.491 1.00 0.00 O ATOM 0 H GLU A 108 -9.041 -13.478 2.643 1.00 0.00 H new ATOM 0 HA GLU A 108 -11.819 -12.874 1.888 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -10.947 -13.719 4.178 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -10.310 -12.099 4.385 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -12.627 -11.201 3.991 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -13.215 -12.852 3.954 1.00 0.00 H new ATOM 1609 N MET A 109 -11.210 -10.752 0.845 1.00 0.00 N ATOM 1610 CA MET A 109 -11.051 -9.428 0.264 1.00 0.00 C ATOM 1611 C MET A 109 -12.178 -8.499 0.670 1.00 0.00 C ATOM 1612 O MET A 109 -13.338 -8.893 0.677 1.00 0.00 O ATOM 1613 CB MET A 109 -10.994 -9.536 -1.263 1.00 0.00 C ATOM 1614 CG MET A 109 -9.661 -10.037 -1.784 1.00 0.00 C ATOM 1615 SD MET A 109 -9.736 -10.647 -3.482 1.00 0.00 S ATOM 1616 CE MET A 109 -10.223 -9.179 -4.381 1.00 0.00 C ATOM 0 H MET A 109 -11.827 -11.365 0.312 1.00 0.00 H new ATOM 0 HA MET A 109 -10.119 -9.007 0.641 1.00 0.00 H new ATOM 0 HB2 MET A 109 -11.783 -10.207 -1.602 1.00 0.00 H new ATOM 0 HB3 MET A 109 -11.200 -8.557 -1.697 1.00 0.00 H new ATOM 0 HG2 MET A 109 -8.931 -9.229 -1.728 1.00 0.00 H new ATOM 0 HG3 MET A 109 -9.303 -10.836 -1.135 1.00 0.00 H new ATOM 0 HE1 MET A 109 -11.196 -9.342 -4.845 1.00 0.00 H new ATOM 0 HE2 MET A 109 -10.286 -8.335 -3.694 1.00 0.00 H new ATOM 0 HE3 MET A 109 -9.485 -8.964 -5.153 1.00 0.00 H new ATOM 1626 N PRO A 110 -11.846 -7.258 1.046 1.00 0.00 N ATOM 1627 CA PRO A 110 -12.844 -6.211 1.212 1.00 0.00 C ATOM 1628 C PRO A 110 -13.420 -5.821 -0.142 1.00 0.00 C ATOM 1629 O PRO A 110 -12.788 -6.040 -1.177 1.00 0.00 O ATOM 1630 CB PRO A 110 -12.069 -5.045 1.831 1.00 0.00 C ATOM 1631 CG PRO A 110 -10.638 -5.298 1.493 1.00 0.00 C ATOM 1632 CD PRO A 110 -10.484 -6.789 1.350 1.00 0.00 C ATOM 0 HA PRO A 110 -13.686 -6.520 1.832 1.00 0.00 H new ATOM 0 HB2 PRO A 110 -12.406 -4.090 1.426 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -12.217 -5.004 2.910 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -10.363 -4.790 0.569 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -9.982 -4.914 2.275 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -9.786 -7.044 0.552 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -10.101 -7.241 2.265 1.00 0.00 H new ATOM 1640 N GLY A 111 -14.588 -5.218 -0.135 1.00 0.00 N ATOM 1641 CA GLY A 111 -15.273 -4.955 -1.383 1.00 0.00 C ATOM 1642 C GLY A 111 -16.071 -3.675 -1.303 1.00 0.00 C ATOM 1643 O GLY A 111 -16.549 -3.327 -0.230 1.00 0.00 O ATOM 0 H GLY A 111 -15.077 -4.905 0.704 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -14.547 -4.885 -2.193 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -15.936 -5.787 -1.620 1.00 0.00 H new ATOM 1647 N VAL A 112 -16.231 -2.966 -2.407 1.00 0.00 N ATOM 1648 CA VAL A 112 -17.148 -1.839 -2.428 1.00 0.00 C ATOM 1649 C VAL A 112 -18.251 -2.074 -3.452 1.00 0.00 C ATOM 1650 O VAL A 112 -18.003 -2.139 -4.658 1.00 0.00 O ATOM 1651 CB VAL A 112 -16.444 -0.482 -2.697 1.00 0.00 C ATOM 1652 CG1 VAL A 112 -15.534 -0.550 -3.914 1.00 0.00 C ATOM 1653 CG2 VAL A 112 -17.477 0.629 -2.861 1.00 0.00 C ATOM 0 H VAL A 112 -15.747 -3.146 -3.287 1.00 0.00 H new ATOM 0 HA VAL A 112 -17.581 -1.772 -1.430 1.00 0.00 H new ATOM 0 HB VAL A 112 -15.818 -0.258 -1.833 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -15.060 0.419 -4.069 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -14.767 -1.307 -3.753 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -16.122 -0.811 -4.794 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -16.968 1.574 -3.049 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -18.132 0.396 -3.701 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -18.070 0.711 -1.950 1.00 0.00 H new ATOM 1663 N ILE A 113 -19.464 -2.271 -2.956 1.00 0.00 N ATOM 1664 CA ILE A 113 -20.618 -2.404 -3.828 1.00 0.00 C ATOM 1665 C ILE A 113 -20.833 -1.125 -4.608 1.00 0.00 C ATOM 1666 O ILE A 113 -21.187 -0.093 -4.043 1.00 0.00 O ATOM 1667 CB ILE A 113 -21.907 -2.713 -3.061 1.00 0.00 C ATOM 1668 CG1 ILE A 113 -21.609 -3.314 -1.699 1.00 0.00 C ATOM 1669 CG2 ILE A 113 -22.762 -3.671 -3.862 1.00 0.00 C ATOM 1670 CD1 ILE A 113 -22.851 -3.761 -0.983 1.00 0.00 C ATOM 0 H ILE A 113 -19.672 -2.342 -1.960 1.00 0.00 H new ATOM 0 HA ILE A 113 -20.403 -3.240 -4.494 1.00 0.00 H new ATOM 0 HB ILE A 113 -22.443 -1.776 -2.910 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -20.937 -4.164 -1.820 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -21.086 -2.579 -1.088 1.00 0.00 H new ATOM 0 HG21 ILE A 113 -23.678 -3.888 -3.312 1.00 0.00 H new ATOM 0 HG22 ILE A 113 -23.013 -3.219 -4.822 1.00 0.00 H new ATOM 0 HG23 ILE A 113 -22.212 -4.597 -4.030 1.00 0.00 H new ATOM 0 HD11 ILE A 113 -22.581 -4.183 -0.015 1.00 0.00 H new ATOM 0 HD12 ILE A 113 -23.513 -2.908 -0.835 1.00 0.00 H new ATOM 0 HD13 ILE A 113 -23.362 -4.518 -1.579 1.00 0.00 H new ATOM 1682 N ARG A 114 -20.619 -1.200 -5.904 1.00 0.00 N ATOM 1683 CA ARG A 114 -20.725 -0.038 -6.757 1.00 0.00 C ATOM 1684 C ARG A 114 -22.182 0.386 -6.911 1.00 0.00 C ATOM 1685 O ARG A 114 -22.495 1.572 -6.853 1.00 0.00 O ATOM 1686 CB ARG A 114 -20.093 -0.342 -8.115 1.00 0.00 C ATOM 1687 CG ARG A 114 -20.043 0.851 -9.063 1.00 0.00 C ATOM 1688 CD ARG A 114 -21.334 1.003 -9.846 1.00 0.00 C ATOM 1689 NE ARG A 114 -21.482 -0.047 -10.851 1.00 0.00 N ATOM 1690 CZ ARG A 114 -22.501 -0.129 -11.701 1.00 0.00 C ATOM 1691 NH1 ARG A 114 -23.442 0.803 -11.709 1.00 0.00 N ATOM 1692 NH2 ARG A 114 -22.562 -1.130 -12.566 1.00 0.00 N ATOM 0 H ARG A 114 -20.369 -2.060 -6.392 1.00 0.00 H new ATOM 0 HA ARG A 114 -20.188 0.793 -6.299 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -19.079 -0.709 -7.957 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -20.653 -1.147 -8.591 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -19.854 1.761 -8.493 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -19.210 0.730 -9.755 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -22.181 0.973 -9.161 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -21.352 1.978 -10.333 1.00 0.00 H new ATOM 0 HE ARG A 114 -20.757 -0.763 -10.904 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -23.387 1.589 -11.061 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -24.222 0.735 -12.363 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -21.827 -1.838 -12.580 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -23.344 -1.193 -13.218 1.00 0.00 H new ATOM 1706 N GLU A 115 -23.069 -0.583 -7.111 1.00 0.00 N ATOM 1707 CA GLU A 115 -24.487 -0.289 -7.274 1.00 0.00 C ATOM 1708 C GLU A 115 -25.321 -1.529 -6.982 1.00 0.00 C ATOM 1709 O GLU A 115 -24.834 -2.655 -7.109 1.00 0.00 O ATOM 1710 CB GLU A 115 -24.780 0.207 -8.694 1.00 0.00 C ATOM 1711 CG GLU A 115 -26.031 1.064 -8.783 1.00 0.00 C ATOM 1712 CD GLU A 115 -26.469 1.333 -10.208 1.00 0.00 C ATOM 1713 OE1 GLU A 115 -27.212 0.507 -10.778 1.00 0.00 O ATOM 1714 OE2 GLU A 115 -26.075 2.377 -10.767 1.00 0.00 O ATOM 0 H GLU A 115 -22.832 -1.574 -7.164 1.00 0.00 H new ATOM 0 HA GLU A 115 -24.753 0.497 -6.567 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -23.927 0.782 -9.054 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -24.888 -0.652 -9.357 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -26.841 0.569 -8.248 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -25.850 2.014 -8.280 1.00 0.00 H new ATOM 1721 N ILE A 116 -26.568 -1.323 -6.586 1.00 0.00 N ATOM 1722 CA ILE A 116 -27.496 -2.420 -6.397 1.00 0.00 C ATOM 1723 C ILE A 116 -28.375 -2.542 -7.627 1.00 0.00 C ATOM 1724 O ILE A 116 -29.175 -1.656 -7.929 1.00 0.00 O ATOM 1725 CB ILE A 116 -28.399 -2.252 -5.152 1.00 0.00 C ATOM 1726 CG1 ILE A 116 -27.570 -2.129 -3.868 1.00 0.00 C ATOM 1727 CG2 ILE A 116 -29.369 -3.424 -5.043 1.00 0.00 C ATOM 1728 CD1 ILE A 116 -26.570 -3.244 -3.666 1.00 0.00 C ATOM 0 H ILE A 116 -26.959 -0.401 -6.390 1.00 0.00 H new ATOM 0 HA ILE A 116 -26.898 -3.318 -6.241 1.00 0.00 H new ATOM 0 HB ILE A 116 -28.965 -1.328 -5.273 1.00 0.00 H new ATOM 0 HG12 ILE A 116 -27.038 -1.178 -3.882 1.00 0.00 H new ATOM 0 HG13 ILE A 116 -28.246 -2.104 -3.013 1.00 0.00 H new ATOM 0 HG21 ILE A 116 -29.999 -3.294 -4.163 1.00 0.00 H new ATOM 0 HG22 ILE A 116 -29.995 -3.463 -5.935 1.00 0.00 H new ATOM 0 HG23 ILE A 116 -28.807 -4.354 -4.953 1.00 0.00 H new ATOM 0 HD11 ILE A 116 -26.026 -3.081 -2.736 1.00 0.00 H new ATOM 0 HD12 ILE A 116 -27.094 -4.198 -3.617 1.00 0.00 H new ATOM 0 HD13 ILE A 116 -25.867 -3.258 -4.499 1.00 0.00 H new ATOM 1740 N ASN A 117 -28.194 -3.625 -8.343 1.00 0.00 N ATOM 1741 CA ASN A 117 -28.996 -3.918 -9.517 1.00 0.00 C ATOM 1742 C ASN A 117 -30.235 -4.679 -9.083 1.00 0.00 C ATOM 1743 O ASN A 117 -30.251 -5.253 -7.993 1.00 0.00 O ATOM 1744 CB ASN A 117 -28.197 -4.710 -10.558 1.00 0.00 C ATOM 1745 CG ASN A 117 -27.151 -3.872 -11.275 1.00 0.00 C ATOM 1746 OD1 ASN A 117 -26.805 -4.146 -12.425 1.00 0.00 O ATOM 1747 ND2 ASN A 117 -26.646 -2.847 -10.609 1.00 0.00 N ATOM 0 H ASN A 117 -27.488 -4.331 -8.133 1.00 0.00 H new ATOM 0 HA ASN A 117 -29.291 -2.983 -9.993 1.00 0.00 H new ATOM 0 HB2 ASN A 117 -27.706 -5.550 -10.067 1.00 0.00 H new ATOM 0 HB3 ASN A 117 -28.885 -5.128 -11.293 1.00 0.00 H new ATOM 0 HD21 ASN A 117 -25.944 -2.251 -11.047 1.00 0.00 H new ATOM 0 HD22 ASN A 117 -26.959 -2.653 -9.658 1.00 0.00 H new ATOM 1754 N GLY A 118 -31.268 -4.676 -9.913 1.00 0.00 N ATOM 1755 CA GLY A 118 -32.559 -5.179 -9.484 1.00 0.00 C ATOM 1756 C GLY A 118 -32.499 -6.598 -8.954 1.00 0.00 C ATOM 1757 O GLY A 118 -33.062 -6.885 -7.901 1.00 0.00 O ATOM 0 H GLY A 118 -31.237 -4.335 -10.874 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -32.958 -4.525 -8.709 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -33.254 -5.140 -10.323 1.00 0.00 H new ATOM 1761 N ASP A 119 -31.832 -7.485 -9.677 1.00 0.00 N ATOM 1762 CA ASP A 119 -31.621 -8.854 -9.213 1.00 0.00 C ATOM 1763 C ASP A 119 -30.137 -9.136 -8.966 1.00 0.00 C ATOM 1764 O ASP A 119 -29.784 -10.149 -8.362 1.00 0.00 O ATOM 1765 CB ASP A 119 -32.194 -9.870 -10.211 1.00 0.00 C ATOM 1766 CG ASP A 119 -31.416 -9.941 -11.512 1.00 0.00 C ATOM 1767 OD1 ASP A 119 -31.701 -9.138 -12.424 1.00 0.00 O ATOM 1768 OD2 ASP A 119 -30.528 -10.810 -11.637 1.00 0.00 O ATOM 0 H ASP A 119 -31.425 -7.283 -10.590 1.00 0.00 H new ATOM 0 HA ASP A 119 -32.151 -8.961 -8.267 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -32.204 -10.857 -9.748 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -33.230 -9.609 -10.429 1.00 0.00 H new ATOM 1773 N SER A 120 -29.275 -8.231 -9.408 1.00 0.00 N ATOM 1774 CA SER A 120 -27.835 -8.473 -9.388 1.00 0.00 C ATOM 1775 C SER A 120 -27.111 -7.497 -8.457 1.00 0.00 C ATOM 1776 O SER A 120 -27.625 -6.433 -8.127 1.00 0.00 O ATOM 1777 CB SER A 120 -27.275 -8.359 -10.809 1.00 0.00 C ATOM 1778 OG SER A 120 -25.956 -8.874 -10.892 1.00 0.00 O ATOM 0 H SER A 120 -29.545 -7.323 -9.785 1.00 0.00 H new ATOM 0 HA SER A 120 -27.666 -9.480 -9.006 1.00 0.00 H new ATOM 0 HB2 SER A 120 -27.922 -8.899 -11.500 1.00 0.00 H new ATOM 0 HB3 SER A 120 -27.279 -7.314 -11.120 1.00 0.00 H new ATOM 0 HG SER A 120 -25.763 -9.409 -10.094 1.00 0.00 H new ATOM 1784 N ILE A 121 -25.923 -7.883 -8.018 1.00 0.00 N ATOM 1785 CA ILE A 121 -25.096 -7.037 -7.176 1.00 0.00 C ATOM 1786 C ILE A 121 -23.790 -6.694 -7.885 1.00 0.00 C ATOM 1787 O ILE A 121 -23.085 -7.576 -8.379 1.00 0.00 O ATOM 1788 CB ILE A 121 -24.769 -7.721 -5.830 1.00 0.00 C ATOM 1789 CG1 ILE A 121 -26.053 -8.108 -5.091 1.00 0.00 C ATOM 1790 CG2 ILE A 121 -23.913 -6.806 -4.964 1.00 0.00 C ATOM 1791 CD1 ILE A 121 -26.917 -6.927 -4.703 1.00 0.00 C ATOM 0 H ILE A 121 -25.507 -8.789 -8.235 1.00 0.00 H new ATOM 0 HA ILE A 121 -25.663 -6.127 -6.979 1.00 0.00 H new ATOM 0 HB ILE A 121 -24.207 -8.632 -6.037 1.00 0.00 H new ATOM 0 HG12 ILE A 121 -26.635 -8.780 -5.722 1.00 0.00 H new ATOM 0 HG13 ILE A 121 -25.789 -8.664 -4.191 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -23.691 -7.302 -4.019 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -22.981 -6.581 -5.483 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -24.453 -5.879 -4.769 1.00 0.00 H new ATOM 0 HD11 ILE A 121 -27.807 -7.282 -4.184 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -26.354 -6.265 -4.046 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -27.213 -6.382 -5.600 1.00 0.00 H new ATOM 1803 N THR A 122 -23.482 -5.411 -7.930 1.00 0.00 N ATOM 1804 CA THR A 122 -22.239 -4.982 -8.543 1.00 0.00 C ATOM 1805 C THR A 122 -21.134 -4.853 -7.500 1.00 0.00 C ATOM 1806 O THR A 122 -21.074 -3.885 -6.739 1.00 0.00 O ATOM 1807 CB THR A 122 -22.395 -3.653 -9.286 1.00 0.00 C ATOM 1808 OG1 THR A 122 -23.542 -3.706 -10.146 1.00 0.00 O ATOM 1809 CG2 THR A 122 -21.149 -3.380 -10.104 1.00 0.00 C ATOM 0 H THR A 122 -24.063 -4.660 -7.557 1.00 0.00 H new ATOM 0 HA THR A 122 -21.966 -5.749 -9.268 1.00 0.00 H new ATOM 0 HB THR A 122 -22.533 -2.850 -8.562 1.00 0.00 H new ATOM 0 HG1 THR A 122 -23.637 -2.852 -10.617 1.00 0.00 H new ATOM 0 HG21 THR A 122 -21.261 -2.433 -10.633 1.00 0.00 H new ATOM 0 HG22 THR A 122 -20.284 -3.326 -9.443 1.00 0.00 H new ATOM 0 HG23 THR A 122 -21.004 -4.184 -10.826 1.00 0.00 H new ATOM 1817 N VAL A 123 -20.265 -5.856 -7.487 1.00 0.00 N ATOM 1818 CA VAL A 123 -19.153 -5.881 -6.550 1.00 0.00 C ATOM 1819 C VAL A 123 -17.820 -5.537 -7.202 1.00 0.00 C ATOM 1820 O VAL A 123 -17.251 -6.325 -7.958 1.00 0.00 O ATOM 1821 CB VAL A 123 -19.032 -7.257 -5.878 1.00 0.00 C ATOM 1822 CG1 VAL A 123 -17.935 -7.242 -4.828 1.00 0.00 C ATOM 1823 CG2 VAL A 123 -20.360 -7.670 -5.267 1.00 0.00 C ATOM 0 H VAL A 123 -20.310 -6.660 -8.113 1.00 0.00 H new ATOM 0 HA VAL A 123 -19.375 -5.116 -5.806 1.00 0.00 H new ATOM 0 HB VAL A 123 -18.765 -7.991 -6.638 1.00 0.00 H new ATOM 0 HG11 VAL A 123 -17.864 -8.225 -4.362 1.00 0.00 H new ATOM 0 HG12 VAL A 123 -16.984 -6.994 -5.299 1.00 0.00 H new ATOM 0 HG13 VAL A 123 -18.169 -6.497 -4.068 1.00 0.00 H new ATOM 0 HG21 VAL A 123 -20.255 -8.647 -4.795 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -20.660 -6.936 -4.519 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -21.119 -7.723 -6.048 1.00 0.00 H new ATOM 1833 N ASP A 124 -17.337 -4.354 -6.877 1.00 0.00 N ATOM 1834 CA ASP A 124 -15.987 -3.943 -7.231 1.00 0.00 C ATOM 1835 C ASP A 124 -15.044 -4.148 -6.053 1.00 0.00 C ATOM 1836 O ASP A 124 -15.111 -3.409 -5.074 1.00 0.00 O ATOM 1837 CB ASP A 124 -15.963 -2.461 -7.629 1.00 0.00 C ATOM 1838 CG ASP A 124 -16.643 -2.171 -8.953 1.00 0.00 C ATOM 1839 OD1 ASP A 124 -17.857 -2.429 -9.079 1.00 0.00 O ATOM 1840 OD2 ASP A 124 -15.967 -1.648 -9.864 1.00 0.00 O ATOM 0 H ASP A 124 -17.865 -3.650 -6.361 1.00 0.00 H new ATOM 0 HA ASP A 124 -15.661 -4.553 -8.073 1.00 0.00 H new ATOM 0 HB2 ASP A 124 -16.448 -1.877 -6.847 1.00 0.00 H new ATOM 0 HB3 ASP A 124 -14.927 -2.126 -7.682 1.00 0.00 H new ATOM 1845 N PHE A 125 -14.177 -5.161 -6.114 1.00 0.00 N ATOM 1846 CA PHE A 125 -13.116 -5.309 -5.115 1.00 0.00 C ATOM 1847 C PHE A 125 -11.993 -4.297 -5.344 1.00 0.00 C ATOM 1848 O PHE A 125 -10.869 -4.477 -4.871 1.00 0.00 O ATOM 1849 CB PHE A 125 -12.549 -6.732 -5.148 1.00 0.00 C ATOM 1850 CG PHE A 125 -13.492 -7.786 -4.649 1.00 0.00 C ATOM 1851 CD1 PHE A 125 -14.454 -8.325 -5.486 1.00 0.00 C ATOM 1852 CD2 PHE A 125 -13.406 -8.251 -3.349 1.00 0.00 C ATOM 1853 CE1 PHE A 125 -15.315 -9.304 -5.033 1.00 0.00 C ATOM 1854 CE2 PHE A 125 -14.264 -9.227 -2.891 1.00 0.00 C ATOM 1855 CZ PHE A 125 -15.222 -9.755 -3.733 1.00 0.00 C ATOM 0 H PHE A 125 -14.187 -5.883 -6.835 1.00 0.00 H new ATOM 0 HA PHE A 125 -13.553 -5.118 -4.135 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -12.263 -6.973 -6.172 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -11.640 -6.762 -4.548 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -14.532 -7.975 -6.505 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -12.657 -7.844 -2.685 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -16.061 -9.717 -5.696 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -14.187 -9.579 -1.873 1.00 0.00 H new ATOM 0 HZ PHE A 125 -15.896 -10.519 -3.375 1.00 0.00 H new ATOM 1865 N ASN A 126 -12.305 -3.247 -6.094 1.00 0.00 N ATOM 1866 CA ASN A 126 -11.364 -2.162 -6.333 1.00 0.00 C ATOM 1867 C ASN A 126 -10.965 -1.500 -5.022 1.00 0.00 C ATOM 1868 O ASN A 126 -11.754 -1.414 -4.080 1.00 0.00 O ATOM 1869 CB ASN A 126 -11.938 -1.136 -7.312 1.00 0.00 C ATOM 1870 CG ASN A 126 -11.579 -1.467 -8.749 1.00 0.00 C ATOM 1871 OD1 ASN A 126 -10.530 -1.061 -9.245 1.00 0.00 O ATOM 1872 ND2 ASN A 126 -12.445 -2.200 -9.432 1.00 0.00 N ATOM 0 H ASN A 126 -13.209 -3.125 -6.550 1.00 0.00 H new ATOM 0 HA ASN A 126 -10.469 -2.587 -6.788 1.00 0.00 H new ATOM 0 HB2 ASN A 126 -13.022 -1.100 -7.207 1.00 0.00 H new ATOM 0 HB3 ASN A 126 -11.561 -0.144 -7.062 1.00 0.00 H new ATOM 0 HD21 ASN A 126 -12.251 -2.445 -10.403 1.00 0.00 H new ATOM 0 HD22 ASN A 126 -13.306 -2.519 -8.987 1.00 0.00 H new ATOM 1964 N THR A 133 -0.813 7.676 -11.073 1.00 0.00 N ATOM 1965 CA THR A 133 0.584 8.021 -10.850 1.00 0.00 C ATOM 1966 C THR A 133 0.717 8.975 -9.664 1.00 0.00 C ATOM 1967 O THR A 133 0.061 10.017 -9.625 1.00 0.00 O ATOM 1968 CB THR A 133 1.185 8.680 -12.105 1.00 0.00 C ATOM 1969 OG1 THR A 133 0.902 7.878 -13.263 1.00 0.00 O ATOM 1970 CG2 THR A 133 2.688 8.856 -11.964 1.00 0.00 C ATOM 0 HA THR A 133 1.128 7.101 -10.633 1.00 0.00 H new ATOM 0 HB THR A 133 0.731 9.664 -12.220 1.00 0.00 H new ATOM 0 HG1 THR A 133 0.097 7.343 -13.101 1.00 0.00 H new ATOM 0 HG21 THR A 133 3.086 9.324 -12.865 1.00 0.00 H new ATOM 0 HG22 THR A 133 2.901 9.489 -11.102 1.00 0.00 H new ATOM 0 HG23 THR A 133 3.157 7.882 -11.824 1.00 0.00 H new ATOM 1978 N VAL A 134 1.561 8.628 -8.707 1.00 0.00 N ATOM 1979 CA VAL A 134 1.671 9.412 -7.488 1.00 0.00 C ATOM 1980 C VAL A 134 3.129 9.771 -7.185 1.00 0.00 C ATOM 1981 O VAL A 134 4.058 9.188 -7.747 1.00 0.00 O ATOM 1982 CB VAL A 134 1.004 8.663 -6.304 1.00 0.00 C ATOM 1983 CG1 VAL A 134 1.713 7.360 -5.971 1.00 0.00 C ATOM 1984 CG2 VAL A 134 0.876 9.548 -5.074 1.00 0.00 C ATOM 0 H VAL A 134 2.176 7.815 -8.749 1.00 0.00 H new ATOM 0 HA VAL A 134 1.139 10.352 -7.634 1.00 0.00 H new ATOM 0 HB VAL A 134 -0.003 8.406 -6.632 1.00 0.00 H new ATOM 0 HG11 VAL A 134 1.208 6.874 -5.136 1.00 0.00 H new ATOM 0 HG12 VAL A 134 1.693 6.702 -6.840 1.00 0.00 H new ATOM 0 HG13 VAL A 134 2.747 7.568 -5.698 1.00 0.00 H new ATOM 0 HG21 VAL A 134 0.404 8.985 -4.268 1.00 0.00 H new ATOM 0 HG22 VAL A 134 1.866 9.875 -4.757 1.00 0.00 H new ATOM 0 HG23 VAL A 134 0.266 10.419 -5.314 1.00 0.00 H new ATOM 1994 N HIS A 135 3.313 10.751 -6.305 1.00 0.00 N ATOM 1995 CA HIS A 135 4.638 11.271 -5.970 1.00 0.00 C ATOM 1996 C HIS A 135 4.870 11.152 -4.470 1.00 0.00 C ATOM 1997 O HIS A 135 4.160 11.768 -3.673 1.00 0.00 O ATOM 1998 CB HIS A 135 4.783 12.741 -6.390 1.00 0.00 C ATOM 1999 CG HIS A 135 4.569 12.994 -7.852 1.00 0.00 C ATOM 2000 ND1 HIS A 135 5.597 13.092 -8.765 1.00 0.00 N ATOM 2001 CD2 HIS A 135 3.428 13.182 -8.555 1.00 0.00 C ATOM 2002 CE1 HIS A 135 5.097 13.328 -9.965 1.00 0.00 C ATOM 2003 NE2 HIS A 135 3.783 13.385 -9.864 1.00 0.00 N ATOM 0 H HIS A 135 2.551 11.207 -5.804 1.00 0.00 H new ATOM 0 HA HIS A 135 5.379 10.683 -6.512 1.00 0.00 H new ATOM 0 HB2 HIS A 135 4.071 13.340 -5.823 1.00 0.00 H new ATOM 0 HB3 HIS A 135 5.780 13.087 -6.116 1.00 0.00 H new ATOM 0 HD2 HIS A 135 2.423 13.174 -8.158 1.00 0.00 H new ATOM 0 HE1 HIS A 135 5.667 13.453 -10.874 1.00 0.00 H new ATOM 0 HE2 HIS A 135 3.136 13.553 -10.634 1.00 0.00 H new ATOM 2012 N PHE A 136 5.844 10.345 -4.084 1.00 0.00 N ATOM 2013 CA PHE A 136 6.105 10.096 -2.676 1.00 0.00 C ATOM 2014 C PHE A 136 7.551 10.389 -2.304 1.00 0.00 C ATOM 2015 O PHE A 136 8.478 10.058 -3.044 1.00 0.00 O ATOM 2016 CB PHE A 136 5.731 8.656 -2.290 1.00 0.00 C ATOM 2017 CG PHE A 136 5.819 7.633 -3.405 1.00 0.00 C ATOM 2018 CD1 PHE A 136 4.978 7.707 -4.509 1.00 0.00 C ATOM 2019 CD2 PHE A 136 6.715 6.587 -3.332 1.00 0.00 C ATOM 2020 CE1 PHE A 136 5.033 6.770 -5.514 1.00 0.00 C ATOM 2021 CE2 PHE A 136 6.778 5.642 -4.338 1.00 0.00 C ATOM 2022 CZ PHE A 136 5.937 5.734 -5.431 1.00 0.00 C ATOM 0 H PHE A 136 6.466 9.852 -4.724 1.00 0.00 H new ATOM 0 HA PHE A 136 5.474 10.781 -2.110 1.00 0.00 H new ATOM 0 HB2 PHE A 136 6.382 8.337 -1.476 1.00 0.00 H new ATOM 0 HB3 PHE A 136 4.713 8.656 -1.902 1.00 0.00 H new ATOM 0 HD1 PHE A 136 4.267 8.517 -4.579 1.00 0.00 H new ATOM 0 HD2 PHE A 136 7.374 6.506 -2.480 1.00 0.00 H new ATOM 0 HE1 PHE A 136 4.371 6.846 -6.364 1.00 0.00 H new ATOM 0 HE2 PHE A 136 7.486 4.829 -4.270 1.00 0.00 H new ATOM 0 HZ PHE A 136 5.988 4.996 -6.218 1.00 0.00 H new ATOM 2032 N ASP A 137 7.722 11.018 -1.149 1.00 0.00 N ATOM 2033 CA ASP A 137 9.048 11.400 -0.649 1.00 0.00 C ATOM 2034 C ASP A 137 9.491 10.456 0.453 1.00 0.00 C ATOM 2035 O ASP A 137 8.974 10.527 1.563 1.00 0.00 O ATOM 2036 CB ASP A 137 9.031 12.823 -0.084 1.00 0.00 C ATOM 2037 CG ASP A 137 8.817 13.886 -1.132 1.00 0.00 C ATOM 2038 OD1 ASP A 137 7.649 14.157 -1.481 1.00 0.00 O ATOM 2039 OD2 ASP A 137 9.816 14.474 -1.595 1.00 0.00 O ATOM 0 H ASP A 137 6.954 11.279 -0.531 1.00 0.00 H new ATOM 0 HA ASP A 137 9.741 11.348 -1.489 1.00 0.00 H new ATOM 0 HB2 ASP A 137 8.242 12.898 0.664 1.00 0.00 H new ATOM 0 HB3 ASP A 137 9.975 13.013 0.427 1.00 0.00 H new ATOM 2044 N ILE A 138 10.446 9.585 0.163 1.00 0.00 N ATOM 2045 CA ILE A 138 10.852 8.565 1.117 1.00 0.00 C ATOM 2046 C ILE A 138 12.094 8.990 1.910 1.00 0.00 C ATOM 2047 O ILE A 138 13.032 9.561 1.354 1.00 0.00 O ATOM 2048 CB ILE A 138 11.177 7.222 0.403 1.00 0.00 C ATOM 2049 CG1 ILE A 138 9.990 6.707 -0.414 1.00 0.00 C ATOM 2050 CG2 ILE A 138 11.611 6.164 1.404 1.00 0.00 C ATOM 2051 CD1 ILE A 138 9.856 7.352 -1.774 1.00 0.00 C ATOM 0 H ILE A 138 10.952 9.564 -0.722 1.00 0.00 H new ATOM 0 HA ILE A 138 10.010 8.434 1.797 1.00 0.00 H new ATOM 0 HB ILE A 138 12.000 7.421 -0.284 1.00 0.00 H new ATOM 0 HG12 ILE A 138 10.090 5.629 -0.542 1.00 0.00 H new ATOM 0 HG13 ILE A 138 9.073 6.877 0.150 1.00 0.00 H new ATOM 0 HG21 ILE A 138 11.832 5.235 0.879 1.00 0.00 H new ATOM 0 HG22 ILE A 138 12.503 6.505 1.930 1.00 0.00 H new ATOM 0 HG23 ILE A 138 10.810 5.992 2.123 1.00 0.00 H new ATOM 0 HD11 ILE A 138 8.992 6.934 -2.291 1.00 0.00 H new ATOM 0 HD12 ILE A 138 9.723 8.427 -1.655 1.00 0.00 H new ATOM 0 HD13 ILE A 138 10.756 7.160 -2.358 1.00 0.00 H new ATOM 2063 N GLU A 139 12.086 8.700 3.206 1.00 0.00 N ATOM 2064 CA GLU A 139 13.272 8.807 4.043 1.00 0.00 C ATOM 2065 C GLU A 139 13.468 7.490 4.766 1.00 0.00 C ATOM 2066 O GLU A 139 12.529 6.989 5.392 1.00 0.00 O ATOM 2067 CB GLU A 139 13.128 9.933 5.065 1.00 0.00 C ATOM 2068 CG GLU A 139 13.579 11.284 4.554 1.00 0.00 C ATOM 2069 CD GLU A 139 13.276 12.404 5.527 1.00 0.00 C ATOM 2070 OE1 GLU A 139 14.081 12.621 6.461 1.00 0.00 O ATOM 2071 OE2 GLU A 139 12.245 13.079 5.358 1.00 0.00 O ATOM 0 H GLU A 139 11.255 8.384 3.705 1.00 0.00 H new ATOM 0 HA GLU A 139 14.132 9.034 3.413 1.00 0.00 H new ATOM 0 HB2 GLU A 139 12.084 10.001 5.372 1.00 0.00 H new ATOM 0 HB3 GLU A 139 13.706 9.680 5.954 1.00 0.00 H new ATOM 0 HG2 GLU A 139 14.651 11.256 4.360 1.00 0.00 H new ATOM 0 HG3 GLU A 139 13.089 11.491 3.603 1.00 0.00 H new ATOM 2078 N VAL A 140 14.659 6.906 4.681 1.00 0.00 N ATOM 2079 CA VAL A 140 14.917 5.619 5.312 1.00 0.00 C ATOM 2080 C VAL A 140 15.158 5.801 6.805 1.00 0.00 C ATOM 2081 O VAL A 140 16.169 6.369 7.218 1.00 0.00 O ATOM 2082 CB VAL A 140 16.155 4.931 4.693 1.00 0.00 C ATOM 2083 CG1 VAL A 140 16.452 3.608 5.389 1.00 0.00 C ATOM 2084 CG2 VAL A 140 15.962 4.718 3.199 1.00 0.00 C ATOM 0 H VAL A 140 15.457 7.302 4.184 1.00 0.00 H new ATOM 0 HA VAL A 140 14.040 4.993 5.148 1.00 0.00 H new ATOM 0 HB VAL A 140 17.012 5.589 4.839 1.00 0.00 H new ATOM 0 HG11 VAL A 140 17.328 3.146 4.933 1.00 0.00 H new ATOM 0 HG12 VAL A 140 16.646 3.789 6.446 1.00 0.00 H new ATOM 0 HG13 VAL A 140 15.595 2.942 5.286 1.00 0.00 H new ATOM 0 HG21 VAL A 140 16.845 4.233 2.784 1.00 0.00 H new ATOM 0 HG22 VAL A 140 15.089 4.088 3.031 1.00 0.00 H new ATOM 0 HG23 VAL A 140 15.814 5.681 2.710 1.00 0.00 H new ATOM 2094 N LEU A 141 14.227 5.324 7.603 1.00 0.00 N ATOM 2095 CA LEU A 141 14.328 5.432 9.047 1.00 0.00 C ATOM 2096 C LEU A 141 15.144 4.278 9.609 1.00 0.00 C ATOM 2097 O LEU A 141 15.994 4.459 10.478 1.00 0.00 O ATOM 2098 CB LEU A 141 12.934 5.414 9.664 1.00 0.00 C ATOM 2099 CG LEU A 141 11.982 6.508 9.193 1.00 0.00 C ATOM 2100 CD1 LEU A 141 10.723 6.466 10.031 1.00 0.00 C ATOM 2101 CD2 LEU A 141 12.633 7.881 9.258 1.00 0.00 C ATOM 0 H LEU A 141 13.384 4.853 7.275 1.00 0.00 H new ATOM 0 HA LEU A 141 14.825 6.371 9.292 1.00 0.00 H new ATOM 0 HB2 LEU A 141 12.477 4.447 9.454 1.00 0.00 H new ATOM 0 HB3 LEU A 141 13.036 5.490 10.747 1.00 0.00 H new ATOM 0 HG LEU A 141 11.728 6.326 8.149 1.00 0.00 H new ATOM 0 HD11 LEU A 141 10.038 7.246 9.699 1.00 0.00 H new ATOM 0 HD12 LEU A 141 10.245 5.493 9.921 1.00 0.00 H new ATOM 0 HD13 LEU A 141 10.977 6.629 11.078 1.00 0.00 H new ATOM 0 HD21 LEU A 141 11.925 8.636 8.915 1.00 0.00 H new ATOM 0 HD22 LEU A 141 12.924 8.097 10.286 1.00 0.00 H new ATOM 0 HD23 LEU A 141 13.517 7.895 8.620 1.00 0.00 H new ATOM 2113 N GLU A 142 14.876 3.095 9.087 1.00 0.00 N ATOM 2114 CA GLU A 142 15.540 1.877 9.547 1.00 0.00 C ATOM 2115 C GLU A 142 15.635 0.850 8.437 1.00 0.00 C ATOM 2116 O GLU A 142 14.851 0.868 7.490 1.00 0.00 O ATOM 2117 CB GLU A 142 14.800 1.270 10.738 1.00 0.00 C ATOM 2118 CG GLU A 142 15.394 1.633 12.086 1.00 0.00 C ATOM 2119 CD GLU A 142 16.710 0.933 12.337 1.00 0.00 C ATOM 2120 OE1 GLU A 142 16.692 -0.261 12.716 1.00 0.00 O ATOM 2121 OE2 GLU A 142 17.773 1.564 12.148 1.00 0.00 O ATOM 0 H GLU A 142 14.199 2.946 8.339 1.00 0.00 H new ATOM 0 HA GLU A 142 16.548 2.155 9.855 1.00 0.00 H new ATOM 0 HB2 GLU A 142 13.760 1.597 10.711 1.00 0.00 H new ATOM 0 HB3 GLU A 142 14.796 0.185 10.635 1.00 0.00 H new ATOM 0 HG2 GLU A 142 15.543 2.712 12.137 1.00 0.00 H new ATOM 0 HG3 GLU A 142 14.689 1.371 12.875 1.00 0.00 H new ATOM 2128 N ILE A 143 16.594 -0.045 8.569 1.00 0.00 N ATOM 2129 CA ILE A 143 16.799 -1.111 7.603 1.00 0.00 C ATOM 2130 C ILE A 143 16.819 -2.457 8.314 1.00 0.00 C ATOM 2131 O ILE A 143 17.742 -2.753 9.077 1.00 0.00 O ATOM 2132 CB ILE A 143 18.126 -0.925 6.833 1.00 0.00 C ATOM 2133 CG1 ILE A 143 18.141 0.416 6.100 1.00 0.00 C ATOM 2134 CG2 ILE A 143 18.340 -2.064 5.846 1.00 0.00 C ATOM 2135 CD1 ILE A 143 19.497 0.783 5.542 1.00 0.00 C ATOM 0 H ILE A 143 17.253 -0.056 9.347 1.00 0.00 H new ATOM 0 HA ILE A 143 15.976 -1.077 6.889 1.00 0.00 H new ATOM 0 HB ILE A 143 18.941 -0.935 7.557 1.00 0.00 H new ATOM 0 HG12 ILE A 143 17.418 0.384 5.285 1.00 0.00 H new ATOM 0 HG13 ILE A 143 17.815 1.199 6.785 1.00 0.00 H new ATOM 0 HG21 ILE A 143 19.280 -1.913 5.315 1.00 0.00 H new ATOM 0 HG22 ILE A 143 18.376 -3.011 6.385 1.00 0.00 H new ATOM 0 HG23 ILE A 143 17.518 -2.085 5.130 1.00 0.00 H new ATOM 0 HD11 ILE A 143 19.433 1.746 5.035 1.00 0.00 H new ATOM 0 HD12 ILE A 143 20.220 0.848 6.355 1.00 0.00 H new ATOM 0 HD13 ILE A 143 19.817 0.020 4.832 1.00 0.00 H new ATOM 2147 N ASP A 144 15.781 -3.252 8.104 1.00 0.00 N ATOM 2148 CA ASP A 144 15.730 -4.604 8.638 1.00 0.00 C ATOM 2149 C ASP A 144 16.575 -5.518 7.767 1.00 0.00 C ATOM 2150 O ASP A 144 16.382 -5.573 6.550 1.00 0.00 O ATOM 2151 CB ASP A 144 14.286 -5.112 8.709 1.00 0.00 C ATOM 2152 CG ASP A 144 14.196 -6.524 9.254 1.00 0.00 C ATOM 2153 OD1 ASP A 144 14.402 -6.708 10.472 1.00 0.00 O ATOM 2154 OD2 ASP A 144 13.919 -7.458 8.470 1.00 0.00 O ATOM 0 H ASP A 144 14.958 -2.982 7.565 1.00 0.00 H new ATOM 0 HA ASP A 144 16.128 -4.600 9.653 1.00 0.00 H new ATOM 0 HB2 ASP A 144 13.699 -4.444 9.340 1.00 0.00 H new ATOM 0 HB3 ASP A 144 13.843 -5.081 7.713 1.00 0.00 H new ATOM 2159 N PRO A 145 17.536 -6.228 8.369 1.00 0.00 N ATOM 2160 CA PRO A 145 18.472 -7.070 7.628 1.00 0.00 C ATOM 2161 C PRO A 145 17.783 -8.231 6.937 1.00 0.00 C ATOM 2162 O PRO A 145 17.063 -9.014 7.560 1.00 0.00 O ATOM 2163 CB PRO A 145 19.430 -7.580 8.699 1.00 0.00 C ATOM 2164 CG PRO A 145 18.640 -7.513 9.951 1.00 0.00 C ATOM 2165 CD PRO A 145 17.782 -6.287 9.817 1.00 0.00 C ATOM 0 HA PRO A 145 18.966 -6.516 6.830 1.00 0.00 H new ATOM 0 HB2 PRO A 145 19.758 -8.598 8.489 1.00 0.00 H new ATOM 0 HB3 PRO A 145 20.326 -6.962 8.759 1.00 0.00 H new ATOM 0 HG2 PRO A 145 18.030 -8.407 10.079 1.00 0.00 H new ATOM 0 HG3 PRO A 145 19.291 -7.444 10.823 1.00 0.00 H new ATOM 0 HD2 PRO A 145 16.855 -6.377 10.383 1.00 0.00 H new ATOM 0 HD3 PRO A 145 18.291 -5.394 10.179 1.00 0.00 H new