USER MOD reduce.3.24.130724 H: found=0, std=0, add=986, rem=0, adj=29 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 27 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 31 ASN : amide:sc= -0.368 K(o=-0.37,f=-4.4!) USER MOD Set 2.1: A 18 LYS NZ :NH3+ -156:sc= 0.751 (180deg=-1.06) USER MOD Set 2.2: A 24 THR OG1 : rot 170:sc= 0.951 USER MOD Single : A 2 SER OG : rot -24:sc= -0.324 USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 6 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 8 ASN : amide:sc= -0.642 K(o=-0.64,f=-1.8!) USER MOD Single : A 9 SER OG : rot -21:sc= 0.734 USER MOD Single : A 14 HIS : no HE2:sc= -0.698 K(o=-0.7,f=-6.5!) USER MOD Single : A 16 THR OG1 : rot 180:sc= -0.363 USER MOD Single : A 23 THR OG1 : rot 112:sc= 1.3 USER MOD Single : A 28 THR OG1 : rot 138:sc= 0.916 USER MOD Single : A 30 ASN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 45 SER OG : rot 178:sc= 1.22 USER MOD Single : A 50 GLN : amide:sc= -0.315 K(o=-0.32,f=-0.82) USER MOD Single : A 51 HIS : no HD1:sc= -0.353 X(o=-0.35,f=-0.021) USER MOD Single : A 56 LYS NZ :NH3+ 179:sc= 1.13 (180deg=1.13) USER MOD Single : A 60 LYS NZ :NH3+ -120:sc= 1.3 (180deg=0.235) USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot -77:sc= 1.22 USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 80 GLN : amide:sc= 0 X(o=0,f=-0.29) USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 SER OG : rot 180:sc= -0.0718 USER MOD Single : A 88 MET CE :methyl 166:sc= -0.026 (180deg=-0.312) USER MOD Single : A 99 MET CE :methyl 143:sc= -0.501 (180deg=-2.85!) USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 104 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 109 MET CE :methyl -121:sc= 0 (180deg=-0.194) USER MOD Single : A 117 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 120 SER OG : rot 39:sc= 1.24 USER MOD Single : A 122 THR OG1 : rot -150:sc= -0.474 USER MOD Single : A 126 ASN : amide:sc= -2.39! K(o=-2.4!,f=-0.023) USER MOD Single : A 133 THR OG1 : rot 38:sc= 0.116 USER MOD Single : A 135 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 20 N SER A 2 23.716 -4.464 7.123 1.00 0.00 N ATOM 21 CA SER A 2 22.790 -3.815 6.185 1.00 0.00 C ATOM 22 C SER A 2 22.643 -2.314 6.452 1.00 0.00 C ATOM 23 O SER A 2 21.599 -1.848 6.911 1.00 0.00 O ATOM 24 CB SER A 2 21.414 -4.510 6.188 1.00 0.00 C ATOM 25 OG SER A 2 20.907 -4.684 7.501 1.00 0.00 O ATOM 0 HA SER A 2 23.227 -3.922 5.192 1.00 0.00 H new ATOM 0 HB2 SER A 2 20.709 -3.920 5.603 1.00 0.00 H new ATOM 0 HB3 SER A 2 21.498 -5.481 5.701 1.00 0.00 H new ATOM 0 HG SER A 2 21.650 -4.691 8.140 1.00 0.00 H new ATOM 31 N GLU A 3 23.701 -1.565 6.167 1.00 0.00 N ATOM 32 CA GLU A 3 23.671 -0.113 6.298 1.00 0.00 C ATOM 33 C GLU A 3 22.900 0.515 5.149 1.00 0.00 C ATOM 34 O GLU A 3 22.241 1.543 5.309 1.00 0.00 O ATOM 35 CB GLU A 3 25.088 0.456 6.313 1.00 0.00 C ATOM 36 CG GLU A 3 25.944 -0.037 7.458 1.00 0.00 C ATOM 37 CD GLU A 3 27.325 0.574 7.430 1.00 0.00 C ATOM 38 OE1 GLU A 3 28.195 0.052 6.706 1.00 0.00 O ATOM 39 OE2 GLU A 3 27.544 1.592 8.118 1.00 0.00 O ATOM 0 H GLU A 3 24.593 -1.940 5.843 1.00 0.00 H new ATOM 0 HA GLU A 3 23.174 0.123 7.239 1.00 0.00 H new ATOM 0 HB2 GLU A 3 25.578 0.203 5.373 1.00 0.00 H new ATOM 0 HB3 GLU A 3 25.030 1.543 6.360 1.00 0.00 H new ATOM 0 HG2 GLU A 3 25.459 0.204 8.404 1.00 0.00 H new ATOM 0 HG3 GLU A 3 26.026 -1.123 7.409 1.00 0.00 H new ATOM 46 N SER A 4 22.993 -0.111 3.992 1.00 0.00 N ATOM 47 CA SER A 4 22.350 0.394 2.797 1.00 0.00 C ATOM 48 C SER A 4 21.256 -0.559 2.332 1.00 0.00 C ATOM 49 O SER A 4 21.339 -1.773 2.539 1.00 0.00 O ATOM 50 CB SER A 4 23.390 0.601 1.694 1.00 0.00 C ATOM 51 OG SER A 4 24.232 -0.534 1.564 1.00 0.00 O ATOM 0 H SER A 4 23.513 -0.978 3.855 1.00 0.00 H new ATOM 0 HA SER A 4 21.886 1.353 3.027 1.00 0.00 H new ATOM 0 HB2 SER A 4 22.886 0.794 0.747 1.00 0.00 H new ATOM 0 HB3 SER A 4 23.993 1.481 1.919 1.00 0.00 H new ATOM 0 HG SER A 4 24.886 -0.376 0.851 1.00 0.00 H new ATOM 57 N VAL A 5 20.226 0.007 1.716 1.00 0.00 N ATOM 58 CA VAL A 5 19.089 -0.764 1.248 1.00 0.00 C ATOM 59 C VAL A 5 19.459 -1.565 0.011 1.00 0.00 C ATOM 60 O VAL A 5 20.234 -1.108 -0.834 1.00 0.00 O ATOM 61 CB VAL A 5 17.877 0.148 0.937 1.00 0.00 C ATOM 62 CG1 VAL A 5 18.231 1.196 -0.087 1.00 0.00 C ATOM 63 CG2 VAL A 5 16.673 -0.664 0.488 1.00 0.00 C ATOM 0 H VAL A 5 20.158 1.007 1.529 1.00 0.00 H new ATOM 0 HA VAL A 5 18.807 -1.449 2.048 1.00 0.00 H new ATOM 0 HB VAL A 5 17.608 0.659 1.861 1.00 0.00 H new ATOM 0 HG11 VAL A 5 17.360 1.821 -0.284 1.00 0.00 H new ATOM 0 HG12 VAL A 5 19.043 1.816 0.292 1.00 0.00 H new ATOM 0 HG13 VAL A 5 18.546 0.710 -1.011 1.00 0.00 H new ATOM 0 HG21 VAL A 5 15.840 0.007 0.278 1.00 0.00 H new ATOM 0 HG22 VAL A 5 16.926 -1.222 -0.414 1.00 0.00 H new ATOM 0 HG23 VAL A 5 16.389 -1.360 1.277 1.00 0.00 H new ATOM 73 N GLN A 6 18.889 -2.751 -0.098 1.00 0.00 N ATOM 74 CA GLN A 6 19.148 -3.632 -1.213 1.00 0.00 C ATOM 75 C GLN A 6 17.833 -4.233 -1.666 1.00 0.00 C ATOM 76 O GLN A 6 16.834 -4.130 -0.951 1.00 0.00 O ATOM 77 CB GLN A 6 20.130 -4.724 -0.809 1.00 0.00 C ATOM 78 CG GLN A 6 19.676 -5.500 0.402 1.00 0.00 C ATOM 79 CD GLN A 6 20.847 -5.980 1.228 1.00 0.00 C ATOM 80 OE1 GLN A 6 21.348 -7.090 1.040 1.00 0.00 O ATOM 81 NE2 GLN A 6 21.310 -5.133 2.132 1.00 0.00 N ATOM 0 H GLN A 6 18.233 -3.127 0.587 1.00 0.00 H new ATOM 0 HA GLN A 6 19.596 -3.072 -2.034 1.00 0.00 H new ATOM 0 HB2 GLN A 6 20.267 -5.411 -1.644 1.00 0.00 H new ATOM 0 HB3 GLN A 6 21.102 -4.275 -0.604 1.00 0.00 H new ATOM 0 HG2 GLN A 6 19.030 -4.872 1.016 1.00 0.00 H new ATOM 0 HG3 GLN A 6 19.080 -6.355 0.084 1.00 0.00 H new ATOM 0 HE21 GLN A 6 20.864 -4.224 2.254 1.00 0.00 H new ATOM 0 HE22 GLN A 6 22.113 -5.389 2.707 1.00 0.00 H new ATOM 90 N SER A 7 17.817 -4.842 -2.834 1.00 0.00 N ATOM 91 CA SER A 7 16.586 -5.380 -3.379 1.00 0.00 C ATOM 92 C SER A 7 16.044 -6.502 -2.498 1.00 0.00 C ATOM 93 O SER A 7 16.809 -7.322 -1.977 1.00 0.00 O ATOM 94 CB SER A 7 16.814 -5.864 -4.809 1.00 0.00 C ATOM 95 OG SER A 7 17.913 -6.760 -4.881 1.00 0.00 O ATOM 0 H SER A 7 18.639 -4.977 -3.423 1.00 0.00 H new ATOM 0 HA SER A 7 15.838 -4.588 -3.398 1.00 0.00 H new ATOM 0 HB2 SER A 7 15.914 -6.358 -5.176 1.00 0.00 H new ATOM 0 HB3 SER A 7 16.996 -5.009 -5.460 1.00 0.00 H new ATOM 0 HG SER A 7 18.034 -7.055 -5.808 1.00 0.00 H new ATOM 101 N ASN A 8 14.723 -6.498 -2.311 1.00 0.00 N ATOM 102 CA ASN A 8 14.025 -7.523 -1.532 1.00 0.00 C ATOM 103 C ASN A 8 14.323 -7.393 -0.025 1.00 0.00 C ATOM 104 O ASN A 8 14.034 -8.291 0.762 1.00 0.00 O ATOM 105 CB ASN A 8 14.379 -8.923 -2.085 1.00 0.00 C ATOM 106 CG ASN A 8 13.711 -10.077 -1.354 1.00 0.00 C ATOM 107 OD1 ASN A 8 12.545 -10.390 -1.591 1.00 0.00 O ATOM 108 ND2 ASN A 8 14.463 -10.748 -0.493 1.00 0.00 N ATOM 0 H ASN A 8 14.106 -5.783 -2.696 1.00 0.00 H new ATOM 0 HA ASN A 8 12.950 -7.378 -1.637 1.00 0.00 H new ATOM 0 HB2 ASN A 8 14.099 -8.965 -3.138 1.00 0.00 H new ATOM 0 HB3 ASN A 8 15.460 -9.056 -2.037 1.00 0.00 H new ATOM 0 HD21 ASN A 8 14.079 -11.554 -0.001 1.00 0.00 H new ATOM 0 HD22 ASN A 8 15.426 -10.458 -0.323 1.00 0.00 H new ATOM 115 N SER A 9 14.862 -6.251 0.387 1.00 0.00 N ATOM 116 CA SER A 9 15.127 -6.005 1.792 1.00 0.00 C ATOM 117 C SER A 9 14.124 -4.979 2.288 1.00 0.00 C ATOM 118 O SER A 9 13.900 -3.969 1.627 1.00 0.00 O ATOM 119 CB SER A 9 16.561 -5.498 1.972 1.00 0.00 C ATOM 120 OG SER A 9 16.971 -5.531 3.329 1.00 0.00 O ATOM 0 H SER A 9 15.122 -5.485 -0.234 1.00 0.00 H new ATOM 0 HA SER A 9 15.025 -6.925 2.368 1.00 0.00 H new ATOM 0 HB2 SER A 9 17.238 -6.107 1.374 1.00 0.00 H new ATOM 0 HB3 SER A 9 16.634 -4.478 1.596 1.00 0.00 H new ATOM 0 HG SER A 9 16.181 -5.544 3.909 1.00 0.00 H new ATOM 126 N ALA A 10 13.532 -5.227 3.444 1.00 0.00 N ATOM 127 CA ALA A 10 12.467 -4.377 3.943 1.00 0.00 C ATOM 128 C ALA A 10 13.061 -3.160 4.622 1.00 0.00 C ATOM 129 O ALA A 10 14.157 -3.224 5.161 1.00 0.00 O ATOM 130 CB ALA A 10 11.580 -5.150 4.909 1.00 0.00 C ATOM 0 H ALA A 10 13.771 -6.009 4.053 1.00 0.00 H new ATOM 0 HA ALA A 10 11.851 -4.048 3.106 1.00 0.00 H new ATOM 0 HB1 ALA A 10 10.786 -4.499 5.275 1.00 0.00 H new ATOM 0 HB2 ALA A 10 11.140 -6.005 4.395 1.00 0.00 H new ATOM 0 HB3 ALA A 10 12.178 -5.501 5.750 1.00 0.00 H new ATOM 136 N VAL A 11 12.365 -2.041 4.575 1.00 0.00 N ATOM 137 CA VAL A 11 12.913 -0.814 5.126 1.00 0.00 C ATOM 138 C VAL A 11 11.883 -0.079 5.977 1.00 0.00 C ATOM 139 O VAL A 11 10.684 -0.117 5.696 1.00 0.00 O ATOM 140 CB VAL A 11 13.456 0.121 4.013 1.00 0.00 C ATOM 141 CG1 VAL A 11 14.389 -0.645 3.077 1.00 0.00 C ATOM 142 CG2 VAL A 11 12.329 0.780 3.228 1.00 0.00 C ATOM 0 H VAL A 11 11.434 -1.954 4.168 1.00 0.00 H new ATOM 0 HA VAL A 11 13.748 -1.099 5.766 1.00 0.00 H new ATOM 0 HB VAL A 11 14.023 0.915 4.499 1.00 0.00 H new ATOM 0 HG11 VAL A 11 14.760 0.027 2.303 1.00 0.00 H new ATOM 0 HG12 VAL A 11 15.230 -1.042 3.646 1.00 0.00 H new ATOM 0 HG13 VAL A 11 13.844 -1.467 2.613 1.00 0.00 H new ATOM 0 HG21 VAL A 11 12.751 1.426 2.459 1.00 0.00 H new ATOM 0 HG22 VAL A 11 11.714 0.012 2.759 1.00 0.00 H new ATOM 0 HG23 VAL A 11 11.714 1.374 3.904 1.00 0.00 H new ATOM 152 N LEU A 12 12.361 0.559 7.036 1.00 0.00 N ATOM 153 CA LEU A 12 11.514 1.344 7.923 1.00 0.00 C ATOM 154 C LEU A 12 11.498 2.783 7.438 1.00 0.00 C ATOM 155 O LEU A 12 12.546 3.427 7.366 1.00 0.00 O ATOM 156 CB LEU A 12 12.030 1.299 9.370 1.00 0.00 C ATOM 157 CG LEU A 12 11.925 -0.051 10.092 1.00 0.00 C ATOM 158 CD1 LEU A 12 12.903 -1.071 9.526 1.00 0.00 C ATOM 159 CD2 LEU A 12 12.165 0.141 11.578 1.00 0.00 C ATOM 0 H LEU A 12 13.345 0.547 7.304 1.00 0.00 H new ATOM 0 HA LEU A 12 10.508 0.924 7.909 1.00 0.00 H new ATOM 0 HB2 LEU A 12 13.076 1.605 9.369 1.00 0.00 H new ATOM 0 HB3 LEU A 12 11.482 2.040 9.951 1.00 0.00 H new ATOM 0 HG LEU A 12 10.919 -0.440 9.933 1.00 0.00 H new ATOM 0 HD11 LEU A 12 12.798 -2.013 10.064 1.00 0.00 H new ATOM 0 HD12 LEU A 12 12.691 -1.231 8.469 1.00 0.00 H new ATOM 0 HD13 LEU A 12 13.922 -0.700 9.640 1.00 0.00 H new ATOM 0 HD21 LEU A 12 12.089 -0.820 12.086 1.00 0.00 H new ATOM 0 HD22 LEU A 12 13.160 0.557 11.735 1.00 0.00 H new ATOM 0 HD23 LEU A 12 11.418 0.824 11.982 1.00 0.00 H new ATOM 171 N VAL A 13 10.327 3.284 7.090 1.00 0.00 N ATOM 172 CA VAL A 13 10.239 4.585 6.458 1.00 0.00 C ATOM 173 C VAL A 13 9.172 5.490 7.084 1.00 0.00 C ATOM 174 O VAL A 13 8.193 5.036 7.674 1.00 0.00 O ATOM 175 CB VAL A 13 9.993 4.416 4.933 1.00 0.00 C ATOM 176 CG1 VAL A 13 8.875 3.426 4.666 1.00 0.00 C ATOM 177 CG2 VAL A 13 9.687 5.737 4.251 1.00 0.00 C ATOM 0 H VAL A 13 9.433 2.815 7.233 1.00 0.00 H new ATOM 0 HA VAL A 13 11.193 5.085 6.623 1.00 0.00 H new ATOM 0 HB VAL A 13 10.920 4.028 4.510 1.00 0.00 H new ATOM 0 HG11 VAL A 13 8.725 3.328 3.591 1.00 0.00 H new ATOM 0 HG12 VAL A 13 9.140 2.456 5.085 1.00 0.00 H new ATOM 0 HG13 VAL A 13 7.955 3.782 5.130 1.00 0.00 H new ATOM 0 HG21 VAL A 13 9.523 5.568 3.187 1.00 0.00 H new ATOM 0 HG22 VAL A 13 8.791 6.175 4.691 1.00 0.00 H new ATOM 0 HG23 VAL A 13 10.527 6.419 4.384 1.00 0.00 H new ATOM 187 N HIS A 14 9.408 6.779 6.927 1.00 0.00 N ATOM 188 CA HIS A 14 8.447 7.824 7.265 1.00 0.00 C ATOM 189 C HIS A 14 8.118 8.534 5.965 1.00 0.00 C ATOM 190 O HIS A 14 9.016 9.095 5.339 1.00 0.00 O ATOM 191 CB HIS A 14 9.033 8.831 8.264 1.00 0.00 C ATOM 192 CG HIS A 14 8.409 8.801 9.626 1.00 0.00 C ATOM 193 ND1 HIS A 14 7.048 8.782 9.840 1.00 0.00 N ATOM 194 CD2 HIS A 14 8.975 8.813 10.854 1.00 0.00 C ATOM 195 CE1 HIS A 14 6.809 8.788 11.137 1.00 0.00 C ATOM 196 NE2 HIS A 14 7.960 8.806 11.775 1.00 0.00 N ATOM 0 H HIS A 14 10.286 7.140 6.555 1.00 0.00 H new ATOM 0 HA HIS A 14 7.565 7.387 7.733 1.00 0.00 H new ATOM 0 HB2 HIS A 14 10.102 8.641 8.365 1.00 0.00 H new ATOM 0 HB3 HIS A 14 8.925 9.835 7.852 1.00 0.00 H new ATOM 0 HD1 HIS A 14 6.336 8.766 9.109 1.00 0.00 H new ATOM 0 HD2 HIS A 14 10.033 8.826 11.070 1.00 0.00 H new ATOM 0 HE1 HIS A 14 5.832 8.780 11.598 1.00 0.00 H new ATOM 205 N PHE A 15 6.867 8.500 5.524 1.00 0.00 N ATOM 206 CA PHE A 15 6.594 8.934 4.156 1.00 0.00 C ATOM 207 C PHE A 15 5.226 9.574 3.977 1.00 0.00 C ATOM 208 O PHE A 15 4.304 9.342 4.751 1.00 0.00 O ATOM 209 CB PHE A 15 6.745 7.749 3.188 1.00 0.00 C ATOM 210 CG PHE A 15 5.631 6.740 3.236 1.00 0.00 C ATOM 211 CD1 PHE A 15 5.682 5.666 4.109 1.00 0.00 C ATOM 212 CD2 PHE A 15 4.538 6.861 2.391 1.00 0.00 C ATOM 213 CE1 PHE A 15 4.662 4.735 4.140 1.00 0.00 C ATOM 214 CE2 PHE A 15 3.519 5.934 2.419 1.00 0.00 C ATOM 215 CZ PHE A 15 3.579 4.869 3.293 1.00 0.00 C ATOM 0 H PHE A 15 6.057 8.192 6.063 1.00 0.00 H new ATOM 0 HA PHE A 15 7.328 9.707 3.930 1.00 0.00 H new ATOM 0 HB2 PHE A 15 6.819 8.137 2.172 1.00 0.00 H new ATOM 0 HB3 PHE A 15 7.684 7.240 3.405 1.00 0.00 H new ATOM 0 HD1 PHE A 15 6.527 5.555 4.772 1.00 0.00 H new ATOM 0 HD2 PHE A 15 4.485 7.692 1.703 1.00 0.00 H new ATOM 0 HE1 PHE A 15 4.711 3.903 4.826 1.00 0.00 H new ATOM 0 HE2 PHE A 15 2.673 6.041 1.756 1.00 0.00 H new ATOM 0 HZ PHE A 15 2.781 4.141 3.315 1.00 0.00 H new ATOM 225 N THR A 16 5.117 10.376 2.933 1.00 0.00 N ATOM 226 CA THR A 16 3.855 10.981 2.544 1.00 0.00 C ATOM 227 C THR A 16 3.595 10.727 1.066 1.00 0.00 C ATOM 228 O THR A 16 4.387 11.133 0.214 1.00 0.00 O ATOM 229 CB THR A 16 3.860 12.499 2.798 1.00 0.00 C ATOM 230 OG1 THR A 16 4.112 12.761 4.182 1.00 0.00 O ATOM 231 CG2 THR A 16 2.534 13.121 2.393 1.00 0.00 C ATOM 0 H THR A 16 5.901 10.627 2.331 1.00 0.00 H new ATOM 0 HA THR A 16 3.068 10.529 3.148 1.00 0.00 H new ATOM 0 HB THR A 16 4.650 12.944 2.193 1.00 0.00 H new ATOM 0 HG1 THR A 16 4.116 13.729 4.336 1.00 0.00 H new ATOM 0 HG21 THR A 16 2.563 14.194 2.582 1.00 0.00 H new ATOM 0 HG22 THR A 16 2.358 12.944 1.332 1.00 0.00 H new ATOM 0 HG23 THR A 16 1.729 12.672 2.974 1.00 0.00 H new ATOM 239 N LEU A 17 2.509 10.035 0.757 1.00 0.00 N ATOM 240 CA LEU A 17 2.156 9.754 -0.620 1.00 0.00 C ATOM 241 C LEU A 17 1.174 10.778 -1.153 1.00 0.00 C ATOM 242 O LEU A 17 0.030 10.850 -0.709 1.00 0.00 O ATOM 243 CB LEU A 17 1.554 8.361 -0.721 1.00 0.00 C ATOM 244 CG LEU A 17 2.437 7.338 -1.413 1.00 0.00 C ATOM 245 CD1 LEU A 17 1.944 5.937 -1.126 1.00 0.00 C ATOM 246 CD2 LEU A 17 2.458 7.596 -2.909 1.00 0.00 C ATOM 0 H LEU A 17 1.857 9.658 1.445 1.00 0.00 H new ATOM 0 HA LEU A 17 3.063 9.807 -1.223 1.00 0.00 H new ATOM 0 HB2 LEU A 17 1.326 8.004 0.284 1.00 0.00 H new ATOM 0 HB3 LEU A 17 0.608 8.427 -1.258 1.00 0.00 H new ATOM 0 HG LEU A 17 3.452 7.432 -1.027 1.00 0.00 H new ATOM 0 HD11 LEU A 17 2.587 5.215 -1.629 1.00 0.00 H new ATOM 0 HD12 LEU A 17 1.967 5.756 -0.051 1.00 0.00 H new ATOM 0 HD13 LEU A 17 0.923 5.829 -1.491 1.00 0.00 H new ATOM 0 HD21 LEU A 17 3.094 6.857 -3.397 1.00 0.00 H new ATOM 0 HD22 LEU A 17 1.445 7.521 -3.305 1.00 0.00 H new ATOM 0 HD23 LEU A 17 2.850 8.595 -3.100 1.00 0.00 H new ATOM 258 N LYS A 18 1.630 11.567 -2.100 1.00 0.00 N ATOM 259 CA LYS A 18 0.804 12.603 -2.690 1.00 0.00 C ATOM 260 C LYS A 18 0.421 12.242 -4.117 1.00 0.00 C ATOM 261 O LYS A 18 1.271 11.909 -4.940 1.00 0.00 O ATOM 262 CB LYS A 18 1.545 13.936 -2.673 1.00 0.00 C ATOM 263 CG LYS A 18 0.902 15.003 -1.799 1.00 0.00 C ATOM 264 CD LYS A 18 0.731 14.542 -0.358 1.00 0.00 C ATOM 265 CE LYS A 18 0.454 15.721 0.564 1.00 0.00 C ATOM 266 NZ LYS A 18 -0.006 15.295 1.910 1.00 0.00 N ATOM 0 H LYS A 18 2.574 11.512 -2.482 1.00 0.00 H new ATOM 0 HA LYS A 18 -0.108 12.691 -2.100 1.00 0.00 H new ATOM 0 HB2 LYS A 18 2.565 13.766 -2.327 1.00 0.00 H new ATOM 0 HB3 LYS A 18 1.613 14.313 -3.694 1.00 0.00 H new ATOM 0 HG2 LYS A 18 1.514 15.904 -1.820 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -0.071 15.269 -2.211 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -0.090 13.827 -0.296 1.00 0.00 H new ATOM 0 HD3 LYS A 18 1.631 14.023 -0.029 1.00 0.00 H new ATOM 0 HE2 LYS A 18 1.360 16.319 0.666 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -0.302 16.362 0.111 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -0.553 16.063 2.349 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -0.606 14.450 1.821 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 0.818 15.073 2.504 1.00 0.00 H new ATOM 280 N LEU A 19 -0.863 12.299 -4.394 1.00 0.00 N ATOM 281 CA LEU A 19 -1.376 12.074 -5.718 1.00 0.00 C ATOM 282 C LEU A 19 -1.324 13.382 -6.506 1.00 0.00 C ATOM 283 O LEU A 19 -1.222 14.455 -5.908 1.00 0.00 O ATOM 284 CB LEU A 19 -2.804 11.592 -5.563 1.00 0.00 C ATOM 285 CG LEU A 19 -3.454 10.958 -6.774 1.00 0.00 C ATOM 286 CD1 LEU A 19 -2.727 9.683 -7.172 1.00 0.00 C ATOM 287 CD2 LEU A 19 -4.895 10.675 -6.429 1.00 0.00 C ATOM 0 H LEU A 19 -1.581 12.504 -3.699 1.00 0.00 H new ATOM 0 HA LEU A 19 -0.788 11.333 -6.259 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -2.830 10.869 -4.748 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -3.416 12.440 -5.256 1.00 0.00 H new ATOM 0 HG LEU A 19 -3.401 11.634 -7.628 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -3.212 9.245 -8.044 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -1.689 9.916 -7.412 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -2.758 8.973 -6.345 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -5.391 10.217 -7.285 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -4.939 9.996 -5.578 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -5.398 11.608 -6.175 1.00 0.00 H new ATOM 299 N ASP A 20 -1.395 13.304 -7.830 1.00 0.00 N ATOM 300 CA ASP A 20 -1.383 14.509 -8.662 1.00 0.00 C ATOM 301 C ASP A 20 -2.606 15.373 -8.359 1.00 0.00 C ATOM 302 O ASP A 20 -2.592 16.589 -8.538 1.00 0.00 O ATOM 303 CB ASP A 20 -1.348 14.136 -10.146 1.00 0.00 C ATOM 304 CG ASP A 20 -1.309 15.345 -11.060 1.00 0.00 C ATOM 305 OD1 ASP A 20 -0.223 15.945 -11.219 1.00 0.00 O ATOM 306 OD2 ASP A 20 -2.360 15.695 -11.636 1.00 0.00 O ATOM 0 H ASP A 20 -1.461 12.429 -8.350 1.00 0.00 H new ATOM 0 HA ASP A 20 -0.485 15.082 -8.430 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -0.474 13.514 -10.338 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -2.226 13.535 -10.385 1.00 0.00 H new ATOM 311 N ASP A 21 -3.649 14.720 -7.861 1.00 0.00 N ATOM 312 CA ASP A 21 -4.886 15.391 -7.465 1.00 0.00 C ATOM 313 C ASP A 21 -4.683 16.239 -6.204 1.00 0.00 C ATOM 314 O ASP A 21 -5.580 16.964 -5.776 1.00 0.00 O ATOM 315 CB ASP A 21 -5.983 14.340 -7.231 1.00 0.00 C ATOM 316 CG ASP A 21 -7.340 14.942 -6.912 1.00 0.00 C ATOM 317 OD1 ASP A 21 -8.043 15.374 -7.852 1.00 0.00 O ATOM 318 OD2 ASP A 21 -7.713 14.971 -5.719 1.00 0.00 O ATOM 0 H ASP A 21 -3.663 13.710 -7.719 1.00 0.00 H new ATOM 0 HA ASP A 21 -5.188 16.064 -8.268 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -6.071 13.715 -8.119 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -5.682 13.688 -6.411 1.00 0.00 H new ATOM 323 N GLY A 22 -3.481 16.181 -5.633 1.00 0.00 N ATOM 324 CA GLY A 22 -3.200 16.867 -4.381 1.00 0.00 C ATOM 325 C GLY A 22 -3.811 16.167 -3.191 1.00 0.00 C ATOM 326 O GLY A 22 -3.807 16.686 -2.075 1.00 0.00 O ATOM 0 H GLY A 22 -2.690 15.666 -6.019 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -2.121 16.938 -4.243 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -3.582 17.886 -4.435 1.00 0.00 H new ATOM 330 N THR A 23 -4.325 14.978 -3.439 1.00 0.00 N ATOM 331 CA THR A 23 -4.869 14.136 -2.392 1.00 0.00 C ATOM 332 C THR A 23 -3.785 13.210 -1.849 1.00 0.00 C ATOM 333 O THR A 23 -2.951 12.706 -2.604 1.00 0.00 O ATOM 334 CB THR A 23 -6.067 13.314 -2.920 1.00 0.00 C ATOM 335 OG1 THR A 23 -7.147 14.198 -3.254 1.00 0.00 O ATOM 336 CG2 THR A 23 -6.549 12.295 -1.896 1.00 0.00 C ATOM 0 H THR A 23 -4.377 14.569 -4.372 1.00 0.00 H new ATOM 0 HA THR A 23 -5.224 14.774 -1.583 1.00 0.00 H new ATOM 0 HB THR A 23 -5.734 12.772 -3.805 1.00 0.00 H new ATOM 0 HG1 THR A 23 -7.285 14.194 -4.224 1.00 0.00 H new ATOM 0 HG21 THR A 23 -7.392 11.738 -2.306 1.00 0.00 H new ATOM 0 HG22 THR A 23 -5.739 11.605 -1.660 1.00 0.00 H new ATOM 0 HG23 THR A 23 -6.862 12.811 -0.989 1.00 0.00 H new ATOM 344 N THR A 24 -3.779 13.012 -0.546 1.00 0.00 N ATOM 345 CA THR A 24 -2.836 12.107 0.077 1.00 0.00 C ATOM 346 C THR A 24 -3.309 10.666 -0.085 1.00 0.00 C ATOM 347 O THR A 24 -4.284 10.248 0.542 1.00 0.00 O ATOM 348 CB THR A 24 -2.656 12.435 1.571 1.00 0.00 C ATOM 349 OG1 THR A 24 -2.290 13.815 1.722 1.00 0.00 O ATOM 350 CG2 THR A 24 -1.582 11.557 2.192 1.00 0.00 C ATOM 0 H THR A 24 -4.420 13.468 0.104 1.00 0.00 H new ATOM 0 HA THR A 24 -1.872 12.229 -0.418 1.00 0.00 H new ATOM 0 HB THR A 24 -3.600 12.244 2.081 1.00 0.00 H new ATOM 0 HG1 THR A 24 -2.333 14.063 2.669 1.00 0.00 H new ATOM 0 HG21 THR A 24 -1.473 11.807 3.247 1.00 0.00 H new ATOM 0 HG22 THR A 24 -1.867 10.509 2.095 1.00 0.00 H new ATOM 0 HG23 THR A 24 -0.634 11.724 1.680 1.00 0.00 H new ATOM 358 N ALA A 25 -2.616 9.921 -0.938 1.00 0.00 N ATOM 359 CA ALA A 25 -2.977 8.540 -1.228 1.00 0.00 C ATOM 360 C ALA A 25 -2.702 7.651 -0.021 1.00 0.00 C ATOM 361 O ALA A 25 -3.436 6.700 0.245 1.00 0.00 O ATOM 362 CB ALA A 25 -2.216 8.040 -2.453 1.00 0.00 C ATOM 0 H ALA A 25 -1.795 10.254 -1.444 1.00 0.00 H new ATOM 0 HA ALA A 25 -4.044 8.497 -1.445 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -2.495 7.007 -2.658 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -2.464 8.661 -3.314 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -1.144 8.095 -2.263 1.00 0.00 H new ATOM 368 N GLU A 26 -1.640 7.976 0.708 1.00 0.00 N ATOM 369 CA GLU A 26 -1.284 7.255 1.921 1.00 0.00 C ATOM 370 C GLU A 26 -0.370 8.121 2.785 1.00 0.00 C ATOM 371 O GLU A 26 0.624 8.665 2.303 1.00 0.00 O ATOM 372 CB GLU A 26 -0.607 5.926 1.570 1.00 0.00 C ATOM 373 CG GLU A 26 -0.207 5.096 2.778 1.00 0.00 C ATOM 374 CD GLU A 26 0.243 3.698 2.403 1.00 0.00 C ATOM 375 OE1 GLU A 26 1.004 3.552 1.425 1.00 0.00 O ATOM 376 OE2 GLU A 26 -0.178 2.734 3.078 1.00 0.00 O ATOM 0 H GLU A 26 -1.007 8.741 0.476 1.00 0.00 H new ATOM 0 HA GLU A 26 -2.189 7.033 2.486 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -1.283 5.340 0.947 1.00 0.00 H new ATOM 0 HB3 GLU A 26 0.281 6.130 0.972 1.00 0.00 H new ATOM 0 HG2 GLU A 26 0.598 5.602 3.311 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -1.051 5.030 3.464 1.00 0.00 H new ATOM 383 N SER A 27 -0.725 8.276 4.049 1.00 0.00 N ATOM 384 CA SER A 27 0.048 9.108 4.955 1.00 0.00 C ATOM 385 C SER A 27 0.776 8.256 5.984 1.00 0.00 C ATOM 386 O SER A 27 0.185 7.357 6.581 1.00 0.00 O ATOM 387 CB SER A 27 -0.869 10.115 5.651 1.00 0.00 C ATOM 388 OG SER A 27 -2.008 9.476 6.205 1.00 0.00 O ATOM 0 H SER A 27 -1.543 7.837 4.471 1.00 0.00 H new ATOM 0 HA SER A 27 0.795 9.650 4.375 1.00 0.00 H new ATOM 0 HB2 SER A 27 -0.318 10.628 6.439 1.00 0.00 H new ATOM 0 HB3 SER A 27 -1.187 10.875 4.937 1.00 0.00 H new ATOM 0 HG SER A 27 -2.576 10.143 6.645 1.00 0.00 H new ATOM 394 N THR A 28 2.069 8.501 6.148 1.00 0.00 N ATOM 395 CA THR A 28 2.849 7.837 7.174 1.00 0.00 C ATOM 396 C THR A 28 3.982 8.756 7.685 1.00 0.00 C ATOM 397 O THR A 28 4.969 8.329 8.281 1.00 0.00 O ATOM 398 CB THR A 28 3.409 6.514 6.629 1.00 0.00 C ATOM 399 OG1 THR A 28 2.338 5.691 6.151 1.00 0.00 O ATOM 400 CG2 THR A 28 4.162 5.781 7.702 1.00 0.00 C ATOM 0 H THR A 28 2.599 9.160 5.578 1.00 0.00 H new ATOM 0 HA THR A 28 2.201 7.615 8.022 1.00 0.00 H new ATOM 0 HB THR A 28 4.090 6.739 5.808 1.00 0.00 H new ATOM 0 HG1 THR A 28 2.600 5.272 5.304 1.00 0.00 H new ATOM 0 HG21 THR A 28 4.552 4.846 7.299 1.00 0.00 H new ATOM 0 HG22 THR A 28 4.989 6.398 8.052 1.00 0.00 H new ATOM 0 HG23 THR A 28 3.492 5.566 8.534 1.00 0.00 H new ATOM 408 N ARG A 29 3.881 10.018 7.360 1.00 0.00 N ATOM 409 CA ARG A 29 4.739 11.020 7.981 1.00 0.00 C ATOM 410 C ARG A 29 4.066 11.635 9.201 1.00 0.00 C ATOM 411 O ARG A 29 4.476 11.381 10.330 1.00 0.00 O ATOM 412 CB ARG A 29 5.135 12.115 6.988 1.00 0.00 C ATOM 413 CG ARG A 29 5.946 13.239 7.619 1.00 0.00 C ATOM 414 CD ARG A 29 7.264 12.735 8.182 1.00 0.00 C ATOM 415 NE ARG A 29 7.855 13.681 9.126 1.00 0.00 N ATOM 416 CZ ARG A 29 9.114 13.624 9.550 1.00 0.00 C ATOM 417 NH1 ARG A 29 9.967 12.771 8.999 1.00 0.00 N ATOM 418 NH2 ARG A 29 9.532 14.462 10.488 1.00 0.00 N ATOM 0 H ARG A 29 3.221 10.385 6.675 1.00 0.00 H new ATOM 0 HA ARG A 29 5.647 10.511 8.303 1.00 0.00 H new ATOM 0 HB2 ARG A 29 5.714 11.669 6.179 1.00 0.00 H new ATOM 0 HB3 ARG A 29 4.233 12.534 6.542 1.00 0.00 H new ATOM 0 HG2 ARG A 29 6.140 14.010 6.874 1.00 0.00 H new ATOM 0 HG3 ARG A 29 5.365 13.704 8.415 1.00 0.00 H new ATOM 0 HD2 ARG A 29 7.103 11.779 8.680 1.00 0.00 H new ATOM 0 HD3 ARG A 29 7.962 12.555 7.364 1.00 0.00 H new ATOM 0 HE ARG A 29 7.264 14.433 9.482 1.00 0.00 H new ATOM 0 HH11 ARG A 29 9.658 12.155 8.247 1.00 0.00 H new ATOM 0 HH12 ARG A 29 10.932 12.731 9.327 1.00 0.00 H new ATOM 0 HH21 ARG A 29 8.888 15.148 10.882 1.00 0.00 H new ATOM 0 HH22 ARG A 29 10.497 14.421 10.815 1.00 0.00 H new ATOM 432 N ASN A 30 3.014 12.410 8.967 1.00 0.00 N ATOM 433 CA ASN A 30 2.374 13.184 10.033 1.00 0.00 C ATOM 434 C ASN A 30 1.650 12.278 11.022 1.00 0.00 C ATOM 435 O ASN A 30 1.220 12.728 12.082 1.00 0.00 O ATOM 436 CB ASN A 30 1.394 14.208 9.453 1.00 0.00 C ATOM 437 CG ASN A 30 0.101 13.587 8.959 1.00 0.00 C ATOM 438 OD1 ASN A 30 -0.871 13.469 9.706 1.00 0.00 O ATOM 439 ND2 ASN A 30 0.077 13.202 7.696 1.00 0.00 N ATOM 0 H ASN A 30 2.583 12.522 8.049 1.00 0.00 H new ATOM 0 HA ASN A 30 3.164 13.713 10.566 1.00 0.00 H new ATOM 0 HB2 ASN A 30 1.164 14.952 10.215 1.00 0.00 H new ATOM 0 HB3 ASN A 30 1.875 14.734 8.628 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -0.769 12.789 7.305 1.00 0.00 H new ATOM 0 HD22 ASN A 30 0.905 13.318 7.112 1.00 0.00 H new ATOM 446 N ASN A 31 1.521 11.008 10.664 1.00 0.00 N ATOM 447 CA ASN A 31 0.896 10.016 11.532 1.00 0.00 C ATOM 448 C ASN A 31 1.624 9.922 12.864 1.00 0.00 C ATOM 449 O ASN A 31 1.025 9.621 13.894 1.00 0.00 O ATOM 450 CB ASN A 31 0.906 8.631 10.878 1.00 0.00 C ATOM 451 CG ASN A 31 0.124 8.563 9.586 1.00 0.00 C ATOM 452 OD1 ASN A 31 0.036 9.537 8.839 1.00 0.00 O ATOM 453 ND2 ASN A 31 -0.443 7.401 9.311 1.00 0.00 N ATOM 0 H ASN A 31 1.844 10.637 9.770 1.00 0.00 H new ATOM 0 HA ASN A 31 -0.132 10.338 11.697 1.00 0.00 H new ATOM 0 HB2 ASN A 31 1.938 8.338 10.684 1.00 0.00 H new ATOM 0 HB3 ASN A 31 0.495 7.905 11.580 1.00 0.00 H new ATOM 0 HD21 ASN A 31 -0.979 7.286 8.451 1.00 0.00 H new ATOM 0 HD22 ASN A 31 -0.344 6.619 9.959 1.00 0.00 H new ATOM 460 N GLY A 32 2.927 10.171 12.830 1.00 0.00 N ATOM 461 CA GLY A 32 3.737 10.023 14.020 1.00 0.00 C ATOM 462 C GLY A 32 4.316 8.629 14.124 1.00 0.00 C ATOM 463 O GLY A 32 5.223 8.375 14.915 1.00 0.00 O ATOM 0 H GLY A 32 3.436 10.473 11.999 1.00 0.00 H new ATOM 0 HA2 GLY A 32 4.545 10.754 14.005 1.00 0.00 H new ATOM 0 HA3 GLY A 32 3.132 10.234 14.902 1.00 0.00 H new ATOM 467 N LYS A 33 3.789 7.727 13.311 1.00 0.00 N ATOM 468 CA LYS A 33 4.241 6.348 13.292 1.00 0.00 C ATOM 469 C LYS A 33 4.759 6.001 11.907 1.00 0.00 C ATOM 470 O LYS A 33 4.062 6.198 10.913 1.00 0.00 O ATOM 471 CB LYS A 33 3.099 5.399 13.668 1.00 0.00 C ATOM 472 CG LYS A 33 2.508 5.658 15.044 1.00 0.00 C ATOM 473 CD LYS A 33 3.543 5.482 16.145 1.00 0.00 C ATOM 474 CE LYS A 33 2.941 5.740 17.515 1.00 0.00 C ATOM 475 NZ LYS A 33 3.960 5.667 18.593 1.00 0.00 N ATOM 0 H LYS A 33 3.040 7.930 12.649 1.00 0.00 H new ATOM 0 HA LYS A 33 5.042 6.234 14.023 1.00 0.00 H new ATOM 0 HB2 LYS A 33 2.309 5.485 12.922 1.00 0.00 H new ATOM 0 HB3 LYS A 33 3.465 4.373 13.628 1.00 0.00 H new ATOM 0 HG2 LYS A 33 2.105 6.670 15.082 1.00 0.00 H new ATOM 0 HG3 LYS A 33 1.675 4.977 15.216 1.00 0.00 H new ATOM 0 HD2 LYS A 33 3.948 4.471 16.108 1.00 0.00 H new ATOM 0 HD3 LYS A 33 4.376 6.165 15.977 1.00 0.00 H new ATOM 0 HE2 LYS A 33 2.472 6.724 17.525 1.00 0.00 H new ATOM 0 HE3 LYS A 33 2.155 5.010 17.709 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 3.507 5.849 19.511 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 4.390 4.720 18.601 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 4.697 6.381 18.423 1.00 0.00 H new ATOM 489 N PRO A 34 6.006 5.528 11.817 1.00 0.00 N ATOM 490 CA PRO A 34 6.585 5.090 10.554 1.00 0.00 C ATOM 491 C PRO A 34 6.063 3.720 10.134 1.00 0.00 C ATOM 492 O PRO A 34 5.399 3.030 10.912 1.00 0.00 O ATOM 493 CB PRO A 34 8.079 5.048 10.856 1.00 0.00 C ATOM 494 CG PRO A 34 8.162 4.742 12.308 1.00 0.00 C ATOM 495 CD PRO A 34 6.959 5.391 12.939 1.00 0.00 C ATOM 0 HA PRO A 34 6.332 5.748 9.723 1.00 0.00 H new ATOM 0 HB2 PRO A 34 8.582 4.285 10.261 1.00 0.00 H new ATOM 0 HB3 PRO A 34 8.557 6.000 10.624 1.00 0.00 H new ATOM 0 HG2 PRO A 34 8.160 3.666 12.481 1.00 0.00 H new ATOM 0 HG3 PRO A 34 9.085 5.132 12.737 1.00 0.00 H new ATOM 0 HD2 PRO A 34 6.548 4.778 13.741 1.00 0.00 H new ATOM 0 HD3 PRO A 34 7.208 6.359 13.373 1.00 0.00 H new ATOM 503 N ALA A 35 6.347 3.336 8.904 1.00 0.00 N ATOM 504 CA ALA A 35 5.859 2.082 8.364 1.00 0.00 C ATOM 505 C ALA A 35 6.986 1.317 7.703 1.00 0.00 C ATOM 506 O ALA A 35 7.936 1.913 7.201 1.00 0.00 O ATOM 507 CB ALA A 35 4.743 2.339 7.362 1.00 0.00 C ATOM 0 H ALA A 35 6.917 3.879 8.256 1.00 0.00 H new ATOM 0 HA ALA A 35 5.465 1.482 9.184 1.00 0.00 H new ATOM 0 HB1 ALA A 35 4.385 1.389 6.964 1.00 0.00 H new ATOM 0 HB2 ALA A 35 3.922 2.857 7.857 1.00 0.00 H new ATOM 0 HB3 ALA A 35 5.121 2.955 6.546 1.00 0.00 H new ATOM 513 N LEU A 36 6.891 0.003 7.723 1.00 0.00 N ATOM 514 CA LEU A 36 7.846 -0.832 7.027 1.00 0.00 C ATOM 515 C LEU A 36 7.383 -1.061 5.598 1.00 0.00 C ATOM 516 O LEU A 36 6.199 -1.307 5.355 1.00 0.00 O ATOM 517 CB LEU A 36 7.998 -2.183 7.725 1.00 0.00 C ATOM 518 CG LEU A 36 8.988 -3.135 7.054 1.00 0.00 C ATOM 519 CD1 LEU A 36 10.371 -2.982 7.663 1.00 0.00 C ATOM 520 CD2 LEU A 36 8.505 -4.570 7.151 1.00 0.00 C ATOM 0 H LEU A 36 6.160 -0.510 8.215 1.00 0.00 H new ATOM 0 HA LEU A 36 8.810 -0.322 7.030 1.00 0.00 H new ATOM 0 HB2 LEU A 36 8.317 -2.013 8.753 1.00 0.00 H new ATOM 0 HB3 LEU A 36 7.022 -2.666 7.770 1.00 0.00 H new ATOM 0 HG LEU A 36 9.053 -2.875 5.997 1.00 0.00 H new ATOM 0 HD11 LEU A 36 11.062 -3.668 7.173 1.00 0.00 H new ATOM 0 HD12 LEU A 36 10.718 -1.958 7.526 1.00 0.00 H new ATOM 0 HD13 LEU A 36 10.327 -3.211 8.728 1.00 0.00 H new ATOM 0 HD21 LEU A 36 9.225 -5.230 6.667 1.00 0.00 H new ATOM 0 HD22 LEU A 36 8.404 -4.850 8.200 1.00 0.00 H new ATOM 0 HD23 LEU A 36 7.538 -4.663 6.656 1.00 0.00 H new ATOM 532 N PHE A 37 8.304 -0.983 4.661 1.00 0.00 N ATOM 533 CA PHE A 37 8.013 -1.339 3.290 1.00 0.00 C ATOM 534 C PHE A 37 8.496 -2.748 3.047 1.00 0.00 C ATOM 535 O PHE A 37 9.679 -3.040 3.224 1.00 0.00 O ATOM 536 CB PHE A 37 8.697 -0.387 2.307 1.00 0.00 C ATOM 537 CG PHE A 37 7.949 0.888 2.043 1.00 0.00 C ATOM 538 CD1 PHE A 37 6.733 1.153 2.660 1.00 0.00 C ATOM 539 CD2 PHE A 37 8.463 1.818 1.156 1.00 0.00 C ATOM 540 CE1 PHE A 37 6.053 2.322 2.395 1.00 0.00 C ATOM 541 CE2 PHE A 37 7.784 2.986 0.886 1.00 0.00 C ATOM 542 CZ PHE A 37 6.577 3.240 1.507 1.00 0.00 C ATOM 0 H PHE A 37 9.263 -0.675 4.825 1.00 0.00 H new ATOM 0 HA PHE A 37 6.937 -1.267 3.129 1.00 0.00 H new ATOM 0 HB2 PHE A 37 9.686 -0.139 2.692 1.00 0.00 H new ATOM 0 HB3 PHE A 37 8.845 -0.908 1.361 1.00 0.00 H new ATOM 0 HD1 PHE A 37 6.317 0.437 3.353 1.00 0.00 H new ATOM 0 HD2 PHE A 37 9.408 1.626 0.670 1.00 0.00 H new ATOM 0 HE1 PHE A 37 5.110 2.520 2.882 1.00 0.00 H new ATOM 0 HE2 PHE A 37 8.195 3.702 0.190 1.00 0.00 H new ATOM 0 HZ PHE A 37 6.044 4.156 1.298 1.00 0.00 H new ATOM 552 N ARG A 38 7.589 -3.631 2.684 1.00 0.00 N ATOM 553 CA ARG A 38 7.971 -4.990 2.388 1.00 0.00 C ATOM 554 C ARG A 38 8.298 -5.100 0.905 1.00 0.00 C ATOM 555 O ARG A 38 7.402 -5.108 0.053 1.00 0.00 O ATOM 556 CB ARG A 38 6.843 -5.950 2.767 1.00 0.00 C ATOM 557 CG ARG A 38 7.267 -7.406 2.830 1.00 0.00 C ATOM 558 CD ARG A 38 8.188 -7.681 4.010 1.00 0.00 C ATOM 559 NE ARG A 38 8.568 -9.090 4.076 1.00 0.00 N ATOM 560 CZ ARG A 38 9.614 -9.554 4.753 1.00 0.00 C ATOM 561 NH1 ARG A 38 10.397 -8.722 5.431 1.00 0.00 N ATOM 562 NH2 ARG A 38 9.881 -10.852 4.748 1.00 0.00 N ATOM 0 H ARG A 38 6.593 -3.432 2.588 1.00 0.00 H new ATOM 0 HA ARG A 38 8.852 -5.261 2.970 1.00 0.00 H new ATOM 0 HB2 ARG A 38 6.441 -5.657 3.737 1.00 0.00 H new ATOM 0 HB3 ARG A 38 6.035 -5.849 2.043 1.00 0.00 H new ATOM 0 HG2 ARG A 38 6.382 -8.038 2.906 1.00 0.00 H new ATOM 0 HG3 ARG A 38 7.774 -7.676 1.904 1.00 0.00 H new ATOM 0 HD2 ARG A 38 9.083 -7.065 3.925 1.00 0.00 H new ATOM 0 HD3 ARG A 38 7.690 -7.394 4.936 1.00 0.00 H new ATOM 0 HE ARG A 38 7.993 -9.763 3.569 1.00 0.00 H new ATOM 0 HH11 ARG A 38 10.197 -7.722 5.434 1.00 0.00 H new ATOM 0 HH12 ARG A 38 11.198 -9.083 5.949 1.00 0.00 H new ATOM 0 HH21 ARG A 38 9.284 -11.493 4.225 1.00 0.00 H new ATOM 0 HH22 ARG A 38 10.683 -11.210 5.267 1.00 0.00 H new ATOM 576 N LEU A 39 9.585 -5.178 0.611 1.00 0.00 N ATOM 577 CA LEU A 39 10.063 -5.261 -0.755 1.00 0.00 C ATOM 578 C LEU A 39 10.171 -6.704 -1.210 1.00 0.00 C ATOM 579 O LEU A 39 10.283 -7.617 -0.390 1.00 0.00 O ATOM 580 CB LEU A 39 11.403 -4.550 -0.902 1.00 0.00 C ATOM 581 CG LEU A 39 11.349 -3.025 -0.761 1.00 0.00 C ATOM 582 CD1 LEU A 39 10.114 -2.446 -1.438 1.00 0.00 C ATOM 583 CD2 LEU A 39 11.413 -2.601 0.695 1.00 0.00 C ATOM 0 H LEU A 39 10.325 -5.185 1.313 1.00 0.00 H new ATOM 0 HA LEU A 39 9.336 -4.760 -1.394 1.00 0.00 H new ATOM 0 HB2 LEU A 39 12.090 -4.944 -0.153 1.00 0.00 H new ATOM 0 HB3 LEU A 39 11.821 -4.794 -1.878 1.00 0.00 H new ATOM 0 HG LEU A 39 12.227 -2.623 -1.267 1.00 0.00 H new ATOM 0 HD11 LEU A 39 10.108 -1.363 -1.318 1.00 0.00 H new ATOM 0 HD12 LEU A 39 10.131 -2.694 -2.499 1.00 0.00 H new ATOM 0 HD13 LEU A 39 9.218 -2.867 -0.981 1.00 0.00 H new ATOM 0 HD21 LEU A 39 11.373 -1.514 0.759 1.00 0.00 H new ATOM 0 HD22 LEU A 39 10.569 -3.028 1.236 1.00 0.00 H new ATOM 0 HD23 LEU A 39 12.344 -2.956 1.137 1.00 0.00 H new ATOM 595 N GLY A 40 10.116 -6.907 -2.516 1.00 0.00 N ATOM 596 CA GLY A 40 10.105 -8.248 -3.055 1.00 0.00 C ATOM 597 C GLY A 40 8.716 -8.688 -3.457 1.00 0.00 C ATOM 598 O GLY A 40 8.394 -9.875 -3.384 1.00 0.00 O ATOM 0 H GLY A 40 10.079 -6.164 -3.214 1.00 0.00 H new ATOM 0 HA2 GLY A 40 10.765 -8.295 -3.921 1.00 0.00 H new ATOM 0 HA3 GLY A 40 10.503 -8.940 -2.313 1.00 0.00 H new ATOM 602 N ASP A 41 7.883 -7.717 -3.848 1.00 0.00 N ATOM 603 CA ASP A 41 6.531 -7.982 -4.365 1.00 0.00 C ATOM 604 C ASP A 41 5.595 -8.510 -3.270 1.00 0.00 C ATOM 605 O ASP A 41 4.431 -8.827 -3.520 1.00 0.00 O ATOM 606 CB ASP A 41 6.607 -8.957 -5.550 1.00 0.00 C ATOM 607 CG ASP A 41 5.271 -9.196 -6.228 1.00 0.00 C ATOM 608 OD1 ASP A 41 4.676 -8.228 -6.748 1.00 0.00 O ATOM 609 OD2 ASP A 41 4.813 -10.358 -6.253 1.00 0.00 O ATOM 0 H ASP A 41 8.124 -6.726 -3.816 1.00 0.00 H new ATOM 0 HA ASP A 41 6.108 -7.039 -4.712 1.00 0.00 H new ATOM 0 HB2 ASP A 41 7.313 -8.569 -6.284 1.00 0.00 H new ATOM 0 HB3 ASP A 41 7.003 -9.910 -5.200 1.00 0.00 H new ATOM 614 N ALA A 42 6.106 -8.577 -2.051 1.00 0.00 N ATOM 615 CA ALA A 42 5.339 -9.073 -0.912 1.00 0.00 C ATOM 616 C ALA A 42 4.300 -8.062 -0.435 1.00 0.00 C ATOM 617 O ALA A 42 3.486 -8.359 0.437 1.00 0.00 O ATOM 618 CB ALA A 42 6.282 -9.430 0.218 1.00 0.00 C ATOM 0 H ALA A 42 7.058 -8.292 -1.821 1.00 0.00 H new ATOM 0 HA ALA A 42 4.797 -9.962 -1.235 1.00 0.00 H new ATOM 0 HB1 ALA A 42 5.708 -9.800 1.068 1.00 0.00 H new ATOM 0 HB2 ALA A 42 6.974 -10.203 -0.116 1.00 0.00 H new ATOM 0 HB3 ALA A 42 6.843 -8.545 0.517 1.00 0.00 H new ATOM 624 N SER A 43 4.346 -6.864 -0.995 1.00 0.00 N ATOM 625 CA SER A 43 3.362 -5.838 -0.692 1.00 0.00 C ATOM 626 C SER A 43 3.422 -4.750 -1.751 1.00 0.00 C ATOM 627 O SER A 43 2.446 -4.498 -2.457 1.00 0.00 O ATOM 628 CB SER A 43 3.602 -5.246 0.703 1.00 0.00 C ATOM 629 OG SER A 43 2.593 -4.307 1.049 1.00 0.00 O ATOM 0 H SER A 43 5.059 -6.577 -1.666 1.00 0.00 H new ATOM 0 HA SER A 43 2.369 -6.288 -0.696 1.00 0.00 H new ATOM 0 HB2 SER A 43 3.623 -6.048 1.441 1.00 0.00 H new ATOM 0 HB3 SER A 43 4.578 -4.761 0.731 1.00 0.00 H new ATOM 0 HG SER A 43 2.772 -3.949 1.943 1.00 0.00 H new ATOM 635 N LEU A 44 4.577 -4.116 -1.862 1.00 0.00 N ATOM 636 CA LEU A 44 4.783 -3.085 -2.859 1.00 0.00 C ATOM 637 C LEU A 44 5.310 -3.690 -4.149 1.00 0.00 C ATOM 638 O LEU A 44 5.823 -4.812 -4.159 1.00 0.00 O ATOM 639 CB LEU A 44 5.766 -2.028 -2.351 1.00 0.00 C ATOM 640 CG LEU A 44 5.216 -1.063 -1.297 1.00 0.00 C ATOM 641 CD1 LEU A 44 5.045 -1.747 0.051 1.00 0.00 C ATOM 642 CD2 LEU A 44 6.133 0.134 -1.172 1.00 0.00 C ATOM 0 H LEU A 44 5.388 -4.300 -1.271 1.00 0.00 H new ATOM 0 HA LEU A 44 3.822 -2.609 -3.053 1.00 0.00 H new ATOM 0 HB2 LEU A 44 6.635 -2.537 -1.933 1.00 0.00 H new ATOM 0 HB3 LEU A 44 6.117 -1.445 -3.203 1.00 0.00 H new ATOM 0 HG LEU A 44 4.230 -0.729 -1.621 1.00 0.00 H new ATOM 0 HD11 LEU A 44 4.653 -1.032 0.775 1.00 0.00 H new ATOM 0 HD12 LEU A 44 4.349 -2.580 -0.049 1.00 0.00 H new ATOM 0 HD13 LEU A 44 6.010 -2.119 0.395 1.00 0.00 H new ATOM 0 HD21 LEU A 44 5.738 0.818 -0.421 1.00 0.00 H new ATOM 0 HD22 LEU A 44 7.127 -0.199 -0.873 1.00 0.00 H new ATOM 0 HD23 LEU A 44 6.196 0.646 -2.132 1.00 0.00 H new ATOM 654 N SER A 45 5.176 -2.935 -5.227 1.00 0.00 N ATOM 655 CA SER A 45 5.663 -3.358 -6.525 1.00 0.00 C ATOM 656 C SER A 45 7.171 -3.161 -6.598 1.00 0.00 C ATOM 657 O SER A 45 7.717 -2.215 -6.020 1.00 0.00 O ATOM 658 CB SER A 45 4.967 -2.562 -7.633 1.00 0.00 C ATOM 659 OG SER A 45 5.438 -2.939 -8.916 1.00 0.00 O ATOM 0 H SER A 45 4.729 -2.018 -5.225 1.00 0.00 H new ATOM 0 HA SER A 45 5.438 -4.415 -6.664 1.00 0.00 H new ATOM 0 HB2 SER A 45 3.890 -2.723 -7.577 1.00 0.00 H new ATOM 0 HB3 SER A 45 5.138 -1.496 -7.480 1.00 0.00 H new ATOM 0 HG SER A 45 4.948 -2.442 -9.604 1.00 0.00 H new ATOM 665 N GLU A 46 7.824 -4.069 -7.318 1.00 0.00 N ATOM 666 CA GLU A 46 9.272 -4.092 -7.457 1.00 0.00 C ATOM 667 C GLU A 46 9.810 -2.794 -8.054 1.00 0.00 C ATOM 668 O GLU A 46 10.999 -2.507 -7.949 1.00 0.00 O ATOM 669 CB GLU A 46 9.668 -5.263 -8.352 1.00 0.00 C ATOM 670 CG GLU A 46 11.047 -5.808 -8.051 1.00 0.00 C ATOM 671 CD GLU A 46 11.468 -6.902 -9.010 1.00 0.00 C ATOM 672 OE1 GLU A 46 11.013 -8.054 -8.851 1.00 0.00 O ATOM 673 OE2 GLU A 46 12.254 -6.616 -9.938 1.00 0.00 O ATOM 0 H GLU A 46 7.354 -4.818 -7.827 1.00 0.00 H new ATOM 0 HA GLU A 46 9.704 -4.203 -6.463 1.00 0.00 H new ATOM 0 HB2 GLU A 46 8.936 -6.063 -8.237 1.00 0.00 H new ATOM 0 HB3 GLU A 46 9.631 -4.944 -9.394 1.00 0.00 H new ATOM 0 HG2 GLU A 46 11.771 -4.995 -8.094 1.00 0.00 H new ATOM 0 HG3 GLU A 46 11.065 -6.197 -7.033 1.00 0.00 H new ATOM 680 N GLY A 47 8.933 -2.006 -8.663 1.00 0.00 N ATOM 681 CA GLY A 47 9.360 -0.779 -9.299 1.00 0.00 C ATOM 682 C GLY A 47 9.800 0.259 -8.288 1.00 0.00 C ATOM 683 O GLY A 47 10.700 1.056 -8.556 1.00 0.00 O ATOM 0 H GLY A 47 7.933 -2.197 -8.727 1.00 0.00 H new ATOM 0 HA2 GLY A 47 10.182 -0.992 -9.982 1.00 0.00 H new ATOM 0 HA3 GLY A 47 8.543 -0.378 -9.899 1.00 0.00 H new ATOM 687 N LEU A 48 9.176 0.239 -7.115 1.00 0.00 N ATOM 688 CA LEU A 48 9.487 1.208 -6.082 1.00 0.00 C ATOM 689 C LEU A 48 10.879 0.971 -5.520 1.00 0.00 C ATOM 690 O LEU A 48 11.708 1.885 -5.485 1.00 0.00 O ATOM 691 CB LEU A 48 8.460 1.138 -4.960 1.00 0.00 C ATOM 692 CG LEU A 48 8.763 2.040 -3.770 1.00 0.00 C ATOM 693 CD1 LEU A 48 7.547 2.866 -3.420 1.00 0.00 C ATOM 694 CD2 LEU A 48 9.215 1.214 -2.577 1.00 0.00 C ATOM 0 H LEU A 48 8.455 -0.437 -6.861 1.00 0.00 H new ATOM 0 HA LEU A 48 9.456 2.200 -6.532 1.00 0.00 H new ATOM 0 HB2 LEU A 48 7.482 1.404 -5.362 1.00 0.00 H new ATOM 0 HB3 LEU A 48 8.391 0.108 -4.611 1.00 0.00 H new ATOM 0 HG LEU A 48 9.574 2.716 -4.041 1.00 0.00 H new ATOM 0 HD11 LEU A 48 7.775 3.507 -2.568 1.00 0.00 H new ATOM 0 HD12 LEU A 48 7.268 3.483 -4.274 1.00 0.00 H new ATOM 0 HD13 LEU A 48 6.719 2.205 -3.165 1.00 0.00 H new ATOM 0 HD21 LEU A 48 9.427 1.875 -1.736 1.00 0.00 H new ATOM 0 HD22 LEU A 48 8.427 0.515 -2.299 1.00 0.00 H new ATOM 0 HD23 LEU A 48 10.116 0.659 -2.839 1.00 0.00 H new ATOM 706 N GLU A 49 11.136 -0.262 -5.091 1.00 0.00 N ATOM 707 CA GLU A 49 12.435 -0.613 -4.543 1.00 0.00 C ATOM 708 C GLU A 49 13.533 -0.341 -5.555 1.00 0.00 C ATOM 709 O GLU A 49 14.619 0.085 -5.185 1.00 0.00 O ATOM 710 CB GLU A 49 12.469 -2.066 -4.061 1.00 0.00 C ATOM 711 CG GLU A 49 12.181 -3.104 -5.128 1.00 0.00 C ATOM 712 CD GLU A 49 12.230 -4.516 -4.577 1.00 0.00 C ATOM 713 OE1 GLU A 49 13.348 -5.012 -4.300 1.00 0.00 O ATOM 714 OE2 GLU A 49 11.155 -5.136 -4.409 1.00 0.00 O ATOM 0 H GLU A 49 10.463 -1.028 -5.114 1.00 0.00 H new ATOM 0 HA GLU A 49 12.612 0.018 -3.672 1.00 0.00 H new ATOM 0 HB2 GLU A 49 13.452 -2.268 -3.635 1.00 0.00 H new ATOM 0 HB3 GLU A 49 11.743 -2.183 -3.257 1.00 0.00 H new ATOM 0 HG2 GLU A 49 11.197 -2.917 -5.559 1.00 0.00 H new ATOM 0 HG3 GLU A 49 12.907 -3.005 -5.935 1.00 0.00 H new ATOM 721 N GLN A 50 13.215 -0.497 -6.835 1.00 0.00 N ATOM 722 CA GLN A 50 14.198 -0.310 -7.898 1.00 0.00 C ATOM 723 C GLN A 50 14.807 1.089 -7.837 1.00 0.00 C ATOM 724 O GLN A 50 15.945 1.299 -8.255 1.00 0.00 O ATOM 725 CB GLN A 50 13.567 -0.545 -9.273 1.00 0.00 C ATOM 726 CG GLN A 50 13.381 -2.015 -9.617 1.00 0.00 C ATOM 727 CD GLN A 50 14.686 -2.786 -9.606 1.00 0.00 C ATOM 728 OE1 GLN A 50 15.749 -2.240 -9.908 1.00 0.00 O ATOM 729 NE2 GLN A 50 14.617 -4.060 -9.259 1.00 0.00 N ATOM 0 H GLN A 50 12.284 -0.753 -7.163 1.00 0.00 H new ATOM 0 HA GLN A 50 14.991 -1.043 -7.748 1.00 0.00 H new ATOM 0 HB2 GLN A 50 12.598 -0.047 -9.308 1.00 0.00 H new ATOM 0 HB3 GLN A 50 14.192 -0.079 -10.034 1.00 0.00 H new ATOM 0 HG2 GLN A 50 12.691 -2.466 -8.905 1.00 0.00 H new ATOM 0 HG3 GLN A 50 12.922 -2.099 -10.602 1.00 0.00 H new ATOM 0 HE21 GLN A 50 13.717 -4.474 -9.016 1.00 0.00 H new ATOM 0 HE22 GLN A 50 15.464 -4.628 -9.234 1.00 0.00 H new ATOM 738 N HIS A 51 14.054 2.037 -7.294 1.00 0.00 N ATOM 739 CA HIS A 51 14.521 3.413 -7.196 1.00 0.00 C ATOM 740 C HIS A 51 15.044 3.714 -5.799 1.00 0.00 C ATOM 741 O HIS A 51 15.711 4.723 -5.581 1.00 0.00 O ATOM 742 CB HIS A 51 13.393 4.386 -7.547 1.00 0.00 C ATOM 743 CG HIS A 51 12.948 4.300 -8.973 1.00 0.00 C ATOM 744 ND1 HIS A 51 12.754 5.403 -9.773 1.00 0.00 N ATOM 745 CD2 HIS A 51 12.647 3.225 -9.738 1.00 0.00 C ATOM 746 CE1 HIS A 51 12.353 5.010 -10.966 1.00 0.00 C ATOM 747 NE2 HIS A 51 12.278 3.693 -10.974 1.00 0.00 N ATOM 0 H HIS A 51 13.120 1.879 -6.916 1.00 0.00 H new ATOM 0 HA HIS A 51 15.338 3.540 -7.907 1.00 0.00 H new ATOM 0 HB2 HIS A 51 12.540 4.190 -6.897 1.00 0.00 H new ATOM 0 HB3 HIS A 51 13.725 5.403 -7.340 1.00 0.00 H new ATOM 0 HD2 HIS A 51 12.689 2.190 -9.432 1.00 0.00 H new ATOM 0 HE1 HIS A 51 12.124 5.659 -11.799 1.00 0.00 H new ATOM 0 HE2 HIS A 51 11.993 3.118 -11.767 1.00 0.00 H new ATOM 756 N LEU A 52 14.740 2.836 -4.854 1.00 0.00 N ATOM 757 CA LEU A 52 15.132 3.038 -3.473 1.00 0.00 C ATOM 758 C LEU A 52 16.431 2.315 -3.139 1.00 0.00 C ATOM 759 O LEU A 52 17.207 2.796 -2.317 1.00 0.00 O ATOM 760 CB LEU A 52 14.019 2.579 -2.533 1.00 0.00 C ATOM 761 CG LEU A 52 12.839 3.543 -2.388 1.00 0.00 C ATOM 762 CD1 LEU A 52 11.830 2.982 -1.406 1.00 0.00 C ATOM 763 CD2 LEU A 52 13.321 4.905 -1.921 1.00 0.00 C ATOM 0 H LEU A 52 14.221 1.974 -5.023 1.00 0.00 H new ATOM 0 HA LEU A 52 15.303 4.106 -3.335 1.00 0.00 H new ATOM 0 HB2 LEU A 52 13.641 1.620 -2.887 1.00 0.00 H new ATOM 0 HB3 LEU A 52 14.449 2.407 -1.546 1.00 0.00 H new ATOM 0 HG LEU A 52 12.361 3.659 -3.361 1.00 0.00 H new ATOM 0 HD11 LEU A 52 10.994 3.674 -1.309 1.00 0.00 H new ATOM 0 HD12 LEU A 52 11.465 2.021 -1.768 1.00 0.00 H new ATOM 0 HD13 LEU A 52 12.304 2.847 -0.434 1.00 0.00 H new ATOM 0 HD21 LEU A 52 12.469 5.578 -1.823 1.00 0.00 H new ATOM 0 HD22 LEU A 52 13.817 4.804 -0.956 1.00 0.00 H new ATOM 0 HD23 LEU A 52 14.023 5.312 -2.649 1.00 0.00 H new ATOM 775 N LEU A 53 16.682 1.186 -3.804 1.00 0.00 N ATOM 776 CA LEU A 53 17.856 0.367 -3.529 1.00 0.00 C ATOM 777 C LEU A 53 19.141 1.168 -3.702 1.00 0.00 C ATOM 778 O LEU A 53 19.241 2.021 -4.588 1.00 0.00 O ATOM 779 CB LEU A 53 17.900 -0.818 -4.503 1.00 0.00 C ATOM 780 CG LEU A 53 16.932 -1.981 -4.258 1.00 0.00 C ATOM 781 CD1 LEU A 53 15.941 -1.707 -3.142 1.00 0.00 C ATOM 782 CD2 LEU A 53 16.199 -2.328 -5.543 1.00 0.00 C ATOM 0 H LEU A 53 16.081 0.819 -4.542 1.00 0.00 H new ATOM 0 HA LEU A 53 17.783 0.020 -2.498 1.00 0.00 H new ATOM 0 HB2 LEU A 53 17.715 -0.434 -5.506 1.00 0.00 H new ATOM 0 HB3 LEU A 53 18.914 -1.219 -4.497 1.00 0.00 H new ATOM 0 HG LEU A 53 17.534 -2.830 -3.935 1.00 0.00 H new ATOM 0 HD11 LEU A 53 15.285 -2.568 -3.019 1.00 0.00 H new ATOM 0 HD12 LEU A 53 16.481 -1.526 -2.212 1.00 0.00 H new ATOM 0 HD13 LEU A 53 15.345 -0.829 -3.392 1.00 0.00 H new ATOM 0 HD21 LEU A 53 15.514 -3.155 -5.359 1.00 0.00 H new ATOM 0 HD22 LEU A 53 15.636 -1.460 -5.887 1.00 0.00 H new ATOM 0 HD23 LEU A 53 16.921 -2.618 -6.307 1.00 0.00 H new ATOM 794 N GLY A 54 20.117 0.889 -2.851 1.00 0.00 N ATOM 795 CA GLY A 54 21.395 1.553 -2.946 1.00 0.00 C ATOM 796 C GLY A 54 21.502 2.784 -2.068 1.00 0.00 C ATOM 797 O GLY A 54 22.563 3.406 -2.011 1.00 0.00 O ATOM 0 H GLY A 54 20.043 0.210 -2.093 1.00 0.00 H new ATOM 0 HA2 GLY A 54 22.182 0.851 -2.671 1.00 0.00 H new ATOM 0 HA3 GLY A 54 21.571 1.839 -3.983 1.00 0.00 H new ATOM 801 N LEU A 55 20.429 3.149 -1.367 1.00 0.00 N ATOM 802 CA LEU A 55 20.465 4.299 -0.480 1.00 0.00 C ATOM 803 C LEU A 55 20.790 3.830 0.935 1.00 0.00 C ATOM 804 O LEU A 55 20.689 2.642 1.234 1.00 0.00 O ATOM 805 CB LEU A 55 19.108 5.010 -0.514 1.00 0.00 C ATOM 806 CG LEU A 55 19.059 6.388 0.147 1.00 0.00 C ATOM 807 CD1 LEU A 55 20.036 7.339 -0.525 1.00 0.00 C ATOM 808 CD2 LEU A 55 17.645 6.945 0.092 1.00 0.00 C ATOM 0 H LEU A 55 19.532 2.665 -1.399 1.00 0.00 H new ATOM 0 HA LEU A 55 21.234 4.999 -0.805 1.00 0.00 H new ATOM 0 HB2 LEU A 55 18.801 5.117 -1.555 1.00 0.00 H new ATOM 0 HB3 LEU A 55 18.372 4.369 -0.029 1.00 0.00 H new ATOM 0 HG LEU A 55 19.352 6.284 1.192 1.00 0.00 H new ATOM 0 HD11 LEU A 55 19.986 8.314 -0.040 1.00 0.00 H new ATOM 0 HD12 LEU A 55 21.048 6.942 -0.439 1.00 0.00 H new ATOM 0 HD13 LEU A 55 19.776 7.444 -1.578 1.00 0.00 H new ATOM 0 HD21 LEU A 55 17.622 7.926 0.566 1.00 0.00 H new ATOM 0 HD22 LEU A 55 17.330 7.036 -0.948 1.00 0.00 H new ATOM 0 HD23 LEU A 55 16.968 6.272 0.619 1.00 0.00 H new ATOM 820 N LYS A 56 21.176 4.748 1.801 1.00 0.00 N ATOM 821 CA LYS A 56 21.612 4.389 3.132 1.00 0.00 C ATOM 822 C LYS A 56 20.667 5.002 4.174 1.00 0.00 C ATOM 823 O LYS A 56 19.962 5.969 3.884 1.00 0.00 O ATOM 824 CB LYS A 56 23.059 4.875 3.301 1.00 0.00 C ATOM 825 CG LYS A 56 23.857 4.160 4.381 1.00 0.00 C ATOM 826 CD LYS A 56 23.636 4.783 5.739 1.00 0.00 C ATOM 827 CE LYS A 56 24.294 6.151 5.841 1.00 0.00 C ATOM 828 NZ LYS A 56 24.074 6.775 7.170 1.00 0.00 N ATOM 0 H LYS A 56 21.196 5.749 1.604 1.00 0.00 H new ATOM 0 HA LYS A 56 21.584 3.309 3.279 1.00 0.00 H new ATOM 0 HB2 LYS A 56 23.579 4.759 2.350 1.00 0.00 H new ATOM 0 HB3 LYS A 56 23.044 5.941 3.528 1.00 0.00 H new ATOM 0 HG2 LYS A 56 23.570 3.109 4.411 1.00 0.00 H new ATOM 0 HG3 LYS A 56 24.918 4.193 4.133 1.00 0.00 H new ATOM 0 HD2 LYS A 56 22.566 4.878 5.927 1.00 0.00 H new ATOM 0 HD3 LYS A 56 24.038 4.127 6.511 1.00 0.00 H new ATOM 0 HE2 LYS A 56 25.364 6.053 5.659 1.00 0.00 H new ATOM 0 HE3 LYS A 56 23.897 6.804 5.064 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 24.552 7.698 7.204 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 23.054 6.908 7.327 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 24.461 6.157 7.912 1.00 0.00 H new ATOM 842 N VAL A 57 20.645 4.418 5.370 1.00 0.00 N ATOM 843 CA VAL A 57 19.826 4.920 6.473 1.00 0.00 C ATOM 844 C VAL A 57 20.169 6.375 6.805 1.00 0.00 C ATOM 845 O VAL A 57 21.333 6.776 6.777 1.00 0.00 O ATOM 846 CB VAL A 57 20.022 4.041 7.736 1.00 0.00 C ATOM 847 CG1 VAL A 57 19.604 4.770 9.007 1.00 0.00 C ATOM 848 CG2 VAL A 57 19.245 2.747 7.609 1.00 0.00 C ATOM 0 H VAL A 57 21.191 3.588 5.602 1.00 0.00 H new ATOM 0 HA VAL A 57 18.784 4.874 6.156 1.00 0.00 H new ATOM 0 HB VAL A 57 21.086 3.819 7.810 1.00 0.00 H new ATOM 0 HG11 VAL A 57 19.758 4.119 9.867 1.00 0.00 H new ATOM 0 HG12 VAL A 57 20.205 5.672 9.123 1.00 0.00 H new ATOM 0 HG13 VAL A 57 18.550 5.041 8.941 1.00 0.00 H new ATOM 0 HG21 VAL A 57 19.395 2.143 8.504 1.00 0.00 H new ATOM 0 HG22 VAL A 57 18.184 2.969 7.494 1.00 0.00 H new ATOM 0 HG23 VAL A 57 19.596 2.196 6.737 1.00 0.00 H new ATOM 858 N GLY A 58 19.139 7.152 7.127 1.00 0.00 N ATOM 859 CA GLY A 58 19.327 8.553 7.438 1.00 0.00 C ATOM 860 C GLY A 58 19.396 9.414 6.195 1.00 0.00 C ATOM 861 O GLY A 58 19.739 10.594 6.266 1.00 0.00 O ATOM 0 H GLY A 58 18.172 6.831 7.178 1.00 0.00 H new ATOM 0 HA2 GLY A 58 18.507 8.896 8.069 1.00 0.00 H new ATOM 0 HA3 GLY A 58 20.245 8.675 8.013 1.00 0.00 H new ATOM 865 N ASP A 59 19.074 8.825 5.054 1.00 0.00 N ATOM 866 CA ASP A 59 18.982 9.570 3.812 1.00 0.00 C ATOM 867 C ASP A 59 17.559 9.528 3.301 1.00 0.00 C ATOM 868 O ASP A 59 16.811 8.592 3.593 1.00 0.00 O ATOM 869 CB ASP A 59 19.939 9.018 2.751 1.00 0.00 C ATOM 870 CG ASP A 59 21.385 9.389 3.010 1.00 0.00 C ATOM 871 OD1 ASP A 59 21.797 10.503 2.626 1.00 0.00 O ATOM 872 OD2 ASP A 59 22.131 8.567 3.588 1.00 0.00 O ATOM 0 H ASP A 59 18.872 7.829 4.964 1.00 0.00 H new ATOM 0 HA ASP A 59 19.271 10.602 4.012 1.00 0.00 H new ATOM 0 HB2 ASP A 59 19.848 7.932 2.717 1.00 0.00 H new ATOM 0 HB3 ASP A 59 19.643 9.393 1.771 1.00 0.00 H new ATOM 877 N LYS A 60 17.176 10.542 2.555 1.00 0.00 N ATOM 878 CA LYS A 60 15.811 10.660 2.093 1.00 0.00 C ATOM 879 C LYS A 60 15.744 10.961 0.607 1.00 0.00 C ATOM 880 O LYS A 60 16.632 11.600 0.038 1.00 0.00 O ATOM 881 CB LYS A 60 15.093 11.739 2.893 1.00 0.00 C ATOM 882 CG LYS A 60 15.877 13.037 2.989 1.00 0.00 C ATOM 883 CD LYS A 60 15.932 13.527 4.421 1.00 0.00 C ATOM 884 CE LYS A 60 14.539 13.819 4.959 1.00 0.00 C ATOM 885 NZ LYS A 60 14.488 13.736 6.441 1.00 0.00 N ATOM 0 H LYS A 60 17.792 11.297 2.255 1.00 0.00 H new ATOM 0 HA LYS A 60 15.314 9.703 2.249 1.00 0.00 H new ATOM 0 HB2 LYS A 60 14.126 11.940 2.433 1.00 0.00 H new ATOM 0 HB3 LYS A 60 14.896 11.366 3.898 1.00 0.00 H new ATOM 0 HG2 LYS A 60 16.889 12.885 2.613 1.00 0.00 H new ATOM 0 HG3 LYS A 60 15.413 13.795 2.358 1.00 0.00 H new ATOM 0 HD2 LYS A 60 16.416 12.776 5.046 1.00 0.00 H new ATOM 0 HD3 LYS A 60 16.542 14.429 4.476 1.00 0.00 H new ATOM 0 HE2 LYS A 60 14.228 14.814 4.640 1.00 0.00 H new ATOM 0 HE3 LYS A 60 13.829 13.111 4.531 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 13.806 13.004 6.724 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 15.430 13.492 6.808 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 14.192 14.654 6.830 1.00 0.00 H new ATOM 899 N THR A 61 14.683 10.483 -0.003 1.00 0.00 N ATOM 900 CA THR A 61 14.484 10.651 -1.425 1.00 0.00 C ATOM 901 C THR A 61 13.016 10.868 -1.744 1.00 0.00 C ATOM 902 O THR A 61 12.137 10.155 -1.251 1.00 0.00 O ATOM 903 CB THR A 61 15.045 9.445 -2.216 1.00 0.00 C ATOM 904 OG1 THR A 61 14.886 9.646 -3.627 1.00 0.00 O ATOM 905 CG2 THR A 61 14.363 8.148 -1.805 1.00 0.00 C ATOM 0 H THR A 61 13.938 9.970 0.469 1.00 0.00 H new ATOM 0 HA THR A 61 15.035 11.539 -1.735 1.00 0.00 H new ATOM 0 HB THR A 61 16.107 9.367 -1.982 1.00 0.00 H new ATOM 0 HG1 THR A 61 15.248 8.874 -4.110 1.00 0.00 H new ATOM 0 HG21 THR A 61 14.780 7.320 -2.379 1.00 0.00 H new ATOM 0 HG22 THR A 61 14.527 7.972 -0.742 1.00 0.00 H new ATOM 0 HG23 THR A 61 13.293 8.222 -1.999 1.00 0.00 H new ATOM 913 N THR A 62 12.750 11.889 -2.529 1.00 0.00 N ATOM 914 CA THR A 62 11.431 12.103 -3.066 1.00 0.00 C ATOM 915 C THR A 62 11.468 11.756 -4.547 1.00 0.00 C ATOM 916 O THR A 62 12.363 12.207 -5.267 1.00 0.00 O ATOM 917 CB THR A 62 11.012 13.571 -2.875 1.00 0.00 C ATOM 918 OG1 THR A 62 11.401 14.018 -1.565 1.00 0.00 O ATOM 919 CG2 THR A 62 9.512 13.740 -3.040 1.00 0.00 C ATOM 0 H THR A 62 13.438 12.587 -2.809 1.00 0.00 H new ATOM 0 HA THR A 62 10.705 11.476 -2.548 1.00 0.00 H new ATOM 0 HB THR A 62 11.512 14.169 -3.637 1.00 0.00 H new ATOM 0 HG1 THR A 62 10.778 13.660 -0.899 1.00 0.00 H new ATOM 0 HG21 THR A 62 9.246 14.788 -2.899 1.00 0.00 H new ATOM 0 HG22 THR A 62 9.218 13.422 -4.040 1.00 0.00 H new ATOM 0 HG23 THR A 62 8.994 13.132 -2.299 1.00 0.00 H new ATOM 927 N PHE A 63 10.517 10.965 -5.012 1.00 0.00 N ATOM 928 CA PHE A 63 10.583 10.432 -6.364 1.00 0.00 C ATOM 929 C PHE A 63 9.199 10.021 -6.856 1.00 0.00 C ATOM 930 O PHE A 63 8.311 9.712 -6.064 1.00 0.00 O ATOM 931 CB PHE A 63 11.558 9.241 -6.425 1.00 0.00 C ATOM 932 CG PHE A 63 11.196 8.065 -5.545 1.00 0.00 C ATOM 933 CD1 PHE A 63 11.114 8.201 -4.168 1.00 0.00 C ATOM 934 CD2 PHE A 63 10.953 6.818 -6.100 1.00 0.00 C ATOM 935 CE1 PHE A 63 10.792 7.125 -3.367 1.00 0.00 C ATOM 936 CE2 PHE A 63 10.632 5.738 -5.301 1.00 0.00 C ATOM 937 CZ PHE A 63 10.551 5.892 -3.934 1.00 0.00 C ATOM 0 H PHE A 63 9.696 10.679 -4.479 1.00 0.00 H new ATOM 0 HA PHE A 63 10.954 11.217 -7.023 1.00 0.00 H new ATOM 0 HB2 PHE A 63 11.620 8.896 -7.457 1.00 0.00 H new ATOM 0 HB3 PHE A 63 12.552 9.591 -6.145 1.00 0.00 H new ATOM 0 HD1 PHE A 63 11.305 9.163 -3.716 1.00 0.00 H new ATOM 0 HD2 PHE A 63 11.015 6.689 -7.170 1.00 0.00 H new ATOM 0 HE1 PHE A 63 10.729 7.249 -2.296 1.00 0.00 H new ATOM 0 HE2 PHE A 63 10.444 4.773 -5.748 1.00 0.00 H new ATOM 0 HZ PHE A 63 10.299 5.048 -3.308 1.00 0.00 H new ATOM 947 N SER A 64 9.025 10.047 -8.163 1.00 0.00 N ATOM 948 CA SER A 64 7.756 9.687 -8.780 1.00 0.00 C ATOM 949 C SER A 64 7.842 8.304 -9.420 1.00 0.00 C ATOM 950 O SER A 64 8.902 7.899 -9.900 1.00 0.00 O ATOM 951 CB SER A 64 7.376 10.738 -9.821 1.00 0.00 C ATOM 952 OG SER A 64 7.415 12.043 -9.261 1.00 0.00 O ATOM 0 H SER A 64 9.752 10.316 -8.826 1.00 0.00 H new ATOM 0 HA SER A 64 6.985 9.654 -8.011 1.00 0.00 H new ATOM 0 HB2 SER A 64 8.060 10.681 -10.668 1.00 0.00 H new ATOM 0 HB3 SER A 64 6.376 10.532 -10.204 1.00 0.00 H new ATOM 0 HG SER A 64 7.170 12.700 -9.945 1.00 0.00 H new ATOM 958 N LEU A 65 6.723 7.590 -9.443 1.00 0.00 N ATOM 959 CA LEU A 65 6.692 6.222 -9.949 1.00 0.00 C ATOM 960 C LEU A 65 5.445 5.986 -10.785 1.00 0.00 C ATOM 961 O LEU A 65 4.370 6.497 -10.466 1.00 0.00 O ATOM 962 CB LEU A 65 6.699 5.227 -8.793 1.00 0.00 C ATOM 963 CG LEU A 65 8.013 5.100 -8.030 1.00 0.00 C ATOM 964 CD1 LEU A 65 7.814 4.227 -6.807 1.00 0.00 C ATOM 965 CD2 LEU A 65 9.097 4.521 -8.928 1.00 0.00 C ATOM 0 H LEU A 65 5.821 7.937 -9.116 1.00 0.00 H new ATOM 0 HA LEU A 65 7.578 6.077 -10.567 1.00 0.00 H new ATOM 0 HB2 LEU A 65 5.918 5.513 -8.088 1.00 0.00 H new ATOM 0 HB3 LEU A 65 6.432 4.245 -9.183 1.00 0.00 H new ATOM 0 HG LEU A 65 8.332 6.091 -7.708 1.00 0.00 H new ATOM 0 HD11 LEU A 65 8.756 4.139 -6.265 1.00 0.00 H new ATOM 0 HD12 LEU A 65 7.062 4.676 -6.158 1.00 0.00 H new ATOM 0 HD13 LEU A 65 7.480 3.237 -7.117 1.00 0.00 H new ATOM 0 HD21 LEU A 65 10.028 4.437 -8.367 1.00 0.00 H new ATOM 0 HD22 LEU A 65 8.793 3.534 -9.275 1.00 0.00 H new ATOM 0 HD23 LEU A 65 9.248 5.177 -9.786 1.00 0.00 H new ATOM 977 N GLU A 66 5.601 5.215 -11.856 1.00 0.00 N ATOM 978 CA GLU A 66 4.479 4.801 -12.682 1.00 0.00 C ATOM 979 C GLU A 66 3.545 3.907 -11.872 1.00 0.00 C ATOM 980 O GLU A 66 3.991 3.267 -10.926 1.00 0.00 O ATOM 981 CB GLU A 66 4.967 4.032 -13.915 1.00 0.00 C ATOM 982 CG GLU A 66 6.221 4.602 -14.558 1.00 0.00 C ATOM 983 CD GLU A 66 7.493 4.149 -13.873 1.00 0.00 C ATOM 984 OE1 GLU A 66 7.955 3.024 -14.152 1.00 0.00 O ATOM 985 OE2 GLU A 66 8.036 4.914 -13.050 1.00 0.00 O ATOM 0 H GLU A 66 6.504 4.863 -12.172 1.00 0.00 H new ATOM 0 HA GLU A 66 3.947 5.694 -13.010 1.00 0.00 H new ATOM 0 HB2 GLU A 66 5.158 2.997 -13.630 1.00 0.00 H new ATOM 0 HB3 GLU A 66 4.169 4.016 -14.657 1.00 0.00 H new ATOM 0 HG2 GLU A 66 6.253 4.304 -15.606 1.00 0.00 H new ATOM 0 HG3 GLU A 66 6.171 5.691 -14.537 1.00 0.00 H new ATOM 992 N PRO A 67 2.254 3.839 -12.210 1.00 0.00 N ATOM 993 CA PRO A 67 1.289 3.062 -11.427 1.00 0.00 C ATOM 994 C PRO A 67 1.670 1.589 -11.275 1.00 0.00 C ATOM 995 O PRO A 67 1.651 1.059 -10.177 1.00 0.00 O ATOM 996 CB PRO A 67 -0.019 3.194 -12.207 1.00 0.00 C ATOM 997 CG PRO A 67 0.355 3.738 -13.546 1.00 0.00 C ATOM 998 CD PRO A 67 1.622 4.516 -13.350 1.00 0.00 C ATOM 0 HA PRO A 67 1.233 3.437 -10.405 1.00 0.00 H new ATOM 0 HB2 PRO A 67 -0.516 2.228 -12.303 1.00 0.00 H new ATOM 0 HB3 PRO A 67 -0.713 3.860 -11.695 1.00 0.00 H new ATOM 0 HG2 PRO A 67 0.502 2.932 -14.265 1.00 0.00 H new ATOM 0 HG3 PRO A 67 -0.436 4.377 -13.940 1.00 0.00 H new ATOM 0 HD2 PRO A 67 2.254 4.487 -14.237 1.00 0.00 H new ATOM 0 HD3 PRO A 67 1.422 5.566 -13.135 1.00 0.00 H new ATOM 1006 N ASP A 68 2.024 0.919 -12.361 1.00 0.00 N ATOM 1007 CA ASP A 68 2.429 -0.485 -12.267 1.00 0.00 C ATOM 1008 C ASP A 68 3.707 -0.608 -11.437 1.00 0.00 C ATOM 1009 O ASP A 68 3.996 -1.659 -10.861 1.00 0.00 O ATOM 1010 CB ASP A 68 2.629 -1.085 -13.664 1.00 0.00 C ATOM 1011 CG ASP A 68 3.177 -2.502 -13.634 1.00 0.00 C ATOM 1012 OD1 ASP A 68 2.524 -3.395 -13.053 1.00 0.00 O ATOM 1013 OD2 ASP A 68 4.262 -2.730 -14.212 1.00 0.00 O ATOM 0 H ASP A 68 2.041 1.310 -13.303 1.00 0.00 H new ATOM 0 HA ASP A 68 1.636 -1.045 -11.770 1.00 0.00 H new ATOM 0 HB2 ASP A 68 1.676 -1.082 -14.193 1.00 0.00 H new ATOM 0 HB3 ASP A 68 3.311 -0.451 -14.231 1.00 0.00 H new ATOM 1018 N ALA A 69 4.451 0.489 -11.348 1.00 0.00 N ATOM 1019 CA ALA A 69 5.678 0.510 -10.574 1.00 0.00 C ATOM 1020 C ALA A 69 5.401 0.834 -9.108 1.00 0.00 C ATOM 1021 O ALA A 69 6.146 0.402 -8.228 1.00 0.00 O ATOM 1022 CB ALA A 69 6.655 1.517 -11.158 1.00 0.00 C ATOM 0 H ALA A 69 4.223 1.373 -11.803 1.00 0.00 H new ATOM 0 HA ALA A 69 6.122 -0.484 -10.623 1.00 0.00 H new ATOM 0 HB1 ALA A 69 7.570 1.521 -10.566 1.00 0.00 H new ATOM 0 HB2 ALA A 69 6.889 1.243 -12.187 1.00 0.00 H new ATOM 0 HB3 ALA A 69 6.207 2.511 -11.140 1.00 0.00 H new ATOM 1028 N ALA A 70 4.337 1.589 -8.828 1.00 0.00 N ATOM 1029 CA ALA A 70 3.944 1.894 -7.462 1.00 0.00 C ATOM 1030 C ALA A 70 2.438 1.762 -7.319 1.00 0.00 C ATOM 1031 O ALA A 70 1.703 2.397 -8.067 1.00 0.00 O ATOM 1032 CB ALA A 70 4.331 3.314 -7.132 1.00 0.00 C ATOM 0 H ALA A 70 3.732 2.000 -9.539 1.00 0.00 H new ATOM 0 HA ALA A 70 4.445 1.200 -6.787 1.00 0.00 H new ATOM 0 HB1 ALA A 70 4.036 3.543 -6.108 1.00 0.00 H new ATOM 0 HB2 ALA A 70 5.410 3.430 -7.234 1.00 0.00 H new ATOM 0 HB3 ALA A 70 3.827 3.997 -7.816 1.00 0.00 H new ATOM 1095 N SER A 75 -6.398 -5.513 -8.453 1.00 0.00 N ATOM 1096 CA SER A 75 -6.399 -6.573 -7.453 1.00 0.00 C ATOM 1097 C SER A 75 -7.810 -6.831 -6.931 1.00 0.00 C ATOM 1098 O SER A 75 -8.477 -5.919 -6.440 1.00 0.00 O ATOM 1099 CB SER A 75 -5.474 -6.199 -6.300 1.00 0.00 C ATOM 1100 OG SER A 75 -4.120 -6.314 -6.695 1.00 0.00 O ATOM 0 HA SER A 75 -6.038 -7.488 -7.922 1.00 0.00 H new ATOM 0 HB2 SER A 75 -5.680 -5.178 -5.977 1.00 0.00 H new ATOM 0 HB3 SER A 75 -5.666 -6.848 -5.446 1.00 0.00 H new ATOM 0 HG SER A 75 -3.539 -6.069 -5.945 1.00 0.00 H new ATOM 1106 N PRO A 76 -8.280 -8.084 -7.045 1.00 0.00 N ATOM 1107 CA PRO A 76 -9.631 -8.477 -6.626 1.00 0.00 C ATOM 1108 C PRO A 76 -9.826 -8.474 -5.109 1.00 0.00 C ATOM 1109 O PRO A 76 -10.955 -8.448 -4.623 1.00 0.00 O ATOM 1110 CB PRO A 76 -9.779 -9.895 -7.176 1.00 0.00 C ATOM 1111 CG PRO A 76 -8.386 -10.411 -7.285 1.00 0.00 C ATOM 1112 CD PRO A 76 -7.525 -9.221 -7.608 1.00 0.00 C ATOM 0 HA PRO A 76 -10.376 -7.773 -6.997 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -10.379 -10.516 -6.511 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -10.277 -9.893 -8.146 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -8.070 -10.879 -6.353 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -8.311 -11.169 -8.064 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -6.536 -9.308 -7.158 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -7.378 -9.112 -8.683 1.00 0.00 H new ATOM 1120 N ASP A 77 -8.724 -8.478 -4.367 1.00 0.00 N ATOM 1121 CA ASP A 77 -8.773 -8.620 -2.912 1.00 0.00 C ATOM 1122 C ASP A 77 -9.371 -7.394 -2.215 1.00 0.00 C ATOM 1123 O ASP A 77 -9.565 -7.405 -1.002 1.00 0.00 O ATOM 1124 CB ASP A 77 -7.379 -8.923 -2.348 1.00 0.00 C ATOM 1125 CG ASP A 77 -6.345 -7.880 -2.720 1.00 0.00 C ATOM 1126 OD1 ASP A 77 -5.762 -7.986 -3.819 1.00 0.00 O ATOM 1127 OD2 ASP A 77 -6.093 -6.962 -1.913 1.00 0.00 O ATOM 0 H ASP A 77 -7.783 -8.384 -4.748 1.00 0.00 H new ATOM 0 HA ASP A 77 -9.436 -9.460 -2.705 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -7.441 -8.993 -1.262 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -7.051 -9.897 -2.712 1.00 0.00 H new ATOM 1132 N LEU A 78 -9.672 -6.346 -2.966 1.00 0.00 N ATOM 1133 CA LEU A 78 -10.318 -5.170 -2.384 1.00 0.00 C ATOM 1134 C LEU A 78 -11.731 -5.012 -2.909 1.00 0.00 C ATOM 1135 O LEU A 78 -12.468 -4.138 -2.467 1.00 0.00 O ATOM 1136 CB LEU A 78 -9.551 -3.896 -2.703 1.00 0.00 C ATOM 1137 CG LEU A 78 -8.120 -3.837 -2.206 1.00 0.00 C ATOM 1138 CD1 LEU A 78 -7.443 -2.594 -2.745 1.00 0.00 C ATOM 1139 CD2 LEU A 78 -8.089 -3.832 -0.691 1.00 0.00 C ATOM 0 H LEU A 78 -9.484 -6.281 -3.966 1.00 0.00 H new ATOM 0 HA LEU A 78 -10.334 -5.326 -1.305 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -9.544 -3.761 -3.785 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -10.096 -3.052 -2.280 1.00 0.00 H new ATOM 0 HG LEU A 78 -7.585 -4.718 -2.561 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -6.415 -2.555 -2.386 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -7.446 -2.622 -3.835 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -7.981 -1.710 -2.403 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -7.055 -3.789 -0.348 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -8.631 -2.962 -0.319 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -8.559 -4.741 -0.314 1.00 0.00 H new ATOM 1151 N ILE A 79 -12.106 -5.858 -3.849 1.00 0.00 N ATOM 1152 CA ILE A 79 -13.386 -5.700 -4.507 1.00 0.00 C ATOM 1153 C ILE A 79 -14.486 -6.198 -3.605 1.00 0.00 C ATOM 1154 O ILE A 79 -14.673 -7.402 -3.437 1.00 0.00 O ATOM 1155 CB ILE A 79 -13.422 -6.452 -5.841 1.00 0.00 C ATOM 1156 CG1 ILE A 79 -12.219 -6.029 -6.675 1.00 0.00 C ATOM 1157 CG2 ILE A 79 -14.731 -6.183 -6.575 1.00 0.00 C ATOM 1158 CD1 ILE A 79 -12.249 -6.552 -8.083 1.00 0.00 C ATOM 0 H ILE A 79 -11.551 -6.651 -4.170 1.00 0.00 H new ATOM 0 HA ILE A 79 -13.535 -4.640 -4.714 1.00 0.00 H new ATOM 0 HB ILE A 79 -13.370 -7.526 -5.662 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -12.171 -4.940 -6.702 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -11.309 -6.377 -6.187 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -14.737 -6.726 -7.520 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -15.568 -6.515 -5.960 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -14.826 -5.115 -6.770 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -11.362 -6.211 -8.617 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -12.266 -7.642 -8.066 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -13.141 -6.183 -8.589 1.00 0.00 H new ATOM 1170 N GLN A 80 -15.210 -5.268 -3.023 1.00 0.00 N ATOM 1171 CA GLN A 80 -16.193 -5.605 -2.018 1.00 0.00 C ATOM 1172 C GLN A 80 -17.603 -5.422 -2.528 1.00 0.00 C ATOM 1173 O GLN A 80 -17.835 -4.759 -3.540 1.00 0.00 O ATOM 1174 CB GLN A 80 -15.949 -4.760 -0.772 1.00 0.00 C ATOM 1175 CG GLN A 80 -14.588 -5.013 -0.150 1.00 0.00 C ATOM 1176 CD GLN A 80 -14.244 -4.027 0.946 1.00 0.00 C ATOM 1177 OE1 GLN A 80 -15.122 -3.531 1.650 1.00 0.00 O ATOM 1178 NE2 GLN A 80 -12.959 -3.731 1.091 1.00 0.00 N ATOM 0 H GLN A 80 -15.136 -4.272 -3.229 1.00 0.00 H new ATOM 0 HA GLN A 80 -16.084 -6.660 -1.767 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -16.035 -3.705 -1.031 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -16.725 -4.972 -0.037 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -14.564 -6.024 0.258 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -13.825 -4.964 -0.927 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -12.264 -4.166 0.485 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -12.666 -3.068 1.809 1.00 0.00 H new ATOM 1187 N TYR A 81 -18.543 -6.009 -1.808 1.00 0.00 N ATOM 1188 CA TYR A 81 -19.919 -6.059 -2.242 1.00 0.00 C ATOM 1189 C TYR A 81 -20.778 -5.572 -1.092 1.00 0.00 C ATOM 1190 O TYR A 81 -20.801 -6.187 -0.028 1.00 0.00 O ATOM 1191 CB TYR A 81 -20.305 -7.493 -2.613 1.00 0.00 C ATOM 1192 CG TYR A 81 -19.225 -8.239 -3.365 1.00 0.00 C ATOM 1193 CD1 TYR A 81 -18.884 -7.891 -4.664 1.00 0.00 C ATOM 1194 CD2 TYR A 81 -18.536 -9.286 -2.768 1.00 0.00 C ATOM 1195 CE1 TYR A 81 -17.891 -8.566 -5.349 1.00 0.00 C ATOM 1196 CE2 TYR A 81 -17.541 -9.965 -3.446 1.00 0.00 C ATOM 1197 CZ TYR A 81 -17.223 -9.602 -4.735 1.00 0.00 C ATOM 1198 OH TYR A 81 -16.233 -10.279 -5.413 1.00 0.00 O ATOM 0 H TYR A 81 -18.370 -6.461 -0.910 1.00 0.00 H new ATOM 0 HA TYR A 81 -20.064 -5.433 -3.122 1.00 0.00 H new ATOM 0 HB2 TYR A 81 -20.547 -8.042 -1.703 1.00 0.00 H new ATOM 0 HB3 TYR A 81 -21.209 -7.471 -3.221 1.00 0.00 H new ATOM 0 HD1 TYR A 81 -19.404 -7.078 -5.149 1.00 0.00 H new ATOM 0 HD2 TYR A 81 -18.782 -9.575 -1.757 1.00 0.00 H new ATOM 0 HE1 TYR A 81 -17.640 -8.282 -6.360 1.00 0.00 H new ATOM 0 HE2 TYR A 81 -17.015 -10.777 -2.966 1.00 0.00 H new ATOM 0 HH TYR A 81 -15.862 -10.980 -4.837 1.00 0.00 H new ATOM 1208 N PHE A 82 -21.454 -4.459 -1.286 1.00 0.00 N ATOM 1209 CA PHE A 82 -22.217 -3.840 -0.218 1.00 0.00 C ATOM 1210 C PHE A 82 -23.707 -3.940 -0.490 1.00 0.00 C ATOM 1211 O PHE A 82 -24.124 -4.287 -1.597 1.00 0.00 O ATOM 1212 CB PHE A 82 -21.819 -2.372 -0.085 1.00 0.00 C ATOM 1213 CG PHE A 82 -20.403 -2.147 0.370 1.00 0.00 C ATOM 1214 CD1 PHE A 82 -19.342 -2.240 -0.520 1.00 0.00 C ATOM 1215 CD2 PHE A 82 -20.136 -1.821 1.690 1.00 0.00 C ATOM 1216 CE1 PHE A 82 -18.047 -2.014 -0.099 1.00 0.00 C ATOM 1217 CE2 PHE A 82 -18.842 -1.597 2.115 1.00 0.00 C ATOM 1218 CZ PHE A 82 -17.796 -1.692 1.218 1.00 0.00 C ATOM 0 H PHE A 82 -21.492 -3.962 -2.176 1.00 0.00 H new ATOM 0 HA PHE A 82 -21.998 -4.366 0.711 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -21.960 -1.882 -1.049 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -22.495 -1.888 0.620 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -19.532 -2.492 -1.553 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -20.950 -1.741 2.395 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -17.230 -2.089 -0.801 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -18.648 -1.348 3.148 1.00 0.00 H new ATOM 0 HZ PHE A 82 -16.783 -1.514 1.548 1.00 0.00 H new ATOM 1228 N SER A 83 -24.505 -3.629 0.518 1.00 0.00 N ATOM 1229 CA SER A 83 -25.946 -3.615 0.369 1.00 0.00 C ATOM 1230 C SER A 83 -26.345 -2.387 -0.435 1.00 0.00 C ATOM 1231 O SER A 83 -25.739 -1.323 -0.310 1.00 0.00 O ATOM 1232 CB SER A 83 -26.620 -3.597 1.743 1.00 0.00 C ATOM 1233 OG SER A 83 -28.014 -3.838 1.629 1.00 0.00 O ATOM 0 H SER A 83 -24.175 -3.382 1.451 1.00 0.00 H new ATOM 0 HA SER A 83 -26.270 -4.514 -0.155 1.00 0.00 H new ATOM 0 HB2 SER A 83 -26.168 -4.354 2.384 1.00 0.00 H new ATOM 0 HB3 SER A 83 -26.452 -2.632 2.222 1.00 0.00 H new ATOM 0 HG SER A 83 -28.422 -3.823 2.520 1.00 0.00 H new ATOM 1239 N ARG A 84 -27.383 -2.538 -1.246 1.00 0.00 N ATOM 1240 CA ARG A 84 -27.791 -1.489 -2.168 1.00 0.00 C ATOM 1241 C ARG A 84 -28.464 -0.359 -1.393 1.00 0.00 C ATOM 1242 O ARG A 84 -28.445 0.796 -1.798 1.00 0.00 O ATOM 1243 CB ARG A 84 -28.768 -2.056 -3.203 1.00 0.00 C ATOM 1244 CG ARG A 84 -30.188 -2.163 -2.673 1.00 0.00 C ATOM 1245 CD ARG A 84 -31.086 -3.013 -3.543 1.00 0.00 C ATOM 1246 NE ARG A 84 -32.469 -2.957 -3.068 1.00 0.00 N ATOM 1247 CZ ARG A 84 -33.504 -3.551 -3.668 1.00 0.00 C ATOM 1248 NH1 ARG A 84 -33.332 -4.218 -4.799 1.00 0.00 N ATOM 1249 NH2 ARG A 84 -34.719 -3.465 -3.139 1.00 0.00 N ATOM 0 H ARG A 84 -27.959 -3.379 -1.283 1.00 0.00 H new ATOM 0 HA ARG A 84 -26.911 -1.102 -2.682 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -28.762 -1.420 -4.088 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -28.426 -3.042 -3.517 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -30.163 -2.584 -1.668 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -30.614 -1.163 -2.590 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -31.036 -2.665 -4.575 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -30.736 -4.045 -3.537 1.00 0.00 H new ATOM 0 HE ARG A 84 -32.656 -2.426 -2.217 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -32.404 -4.281 -5.218 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -34.127 -4.669 -5.251 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -34.863 -2.945 -2.273 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -35.508 -3.919 -3.598 1.00 0.00 H new ATOM 1263 N ARG A 85 -29.091 -0.744 -0.287 1.00 0.00 N ATOM 1264 CA ARG A 85 -29.949 0.149 0.482 1.00 0.00 C ATOM 1265 C ARG A 85 -29.203 1.317 1.100 1.00 0.00 C ATOM 1266 O ARG A 85 -29.726 2.430 1.133 1.00 0.00 O ATOM 1267 CB ARG A 85 -30.722 -0.623 1.561 1.00 0.00 C ATOM 1268 CG ARG A 85 -31.593 -1.754 1.019 1.00 0.00 C ATOM 1269 CD ARG A 85 -30.904 -3.110 1.121 1.00 0.00 C ATOM 1270 NE ARG A 85 -31.618 -4.152 0.386 1.00 0.00 N ATOM 1271 CZ ARG A 85 -31.055 -5.286 -0.040 1.00 0.00 C ATOM 1272 NH1 ARG A 85 -29.776 -5.539 0.212 1.00 0.00 N ATOM 1273 NH2 ARG A 85 -31.777 -6.171 -0.712 1.00 0.00 N ATOM 0 H ARG A 85 -29.019 -1.684 0.102 1.00 0.00 H new ATOM 0 HA ARG A 85 -30.656 0.573 -0.232 1.00 0.00 H new ATOM 0 HB2 ARG A 85 -30.010 -1.038 2.275 1.00 0.00 H new ATOM 0 HB3 ARG A 85 -31.354 0.076 2.110 1.00 0.00 H new ATOM 0 HG2 ARG A 85 -32.533 -1.783 1.571 1.00 0.00 H new ATOM 0 HG3 ARG A 85 -31.841 -1.552 -0.023 1.00 0.00 H new ATOM 0 HD2 ARG A 85 -29.888 -3.028 0.736 1.00 0.00 H new ATOM 0 HD3 ARG A 85 -30.825 -3.397 2.170 1.00 0.00 H new ATOM 0 HE ARG A 85 -32.607 -4.004 0.186 1.00 0.00 H new ATOM 0 HH11 ARG A 85 -29.216 -4.865 0.734 1.00 0.00 H new ATOM 0 HH12 ARG A 85 -29.353 -6.407 -0.117 1.00 0.00 H new ATOM 0 HH21 ARG A 85 -32.762 -5.986 -0.904 1.00 0.00 H new ATOM 0 HH22 ARG A 85 -31.348 -7.037 -1.038 1.00 0.00 H new ATOM 1287 N GLU A 86 -28.003 1.083 1.589 1.00 0.00 N ATOM 1288 CA GLU A 86 -27.183 2.177 2.082 1.00 0.00 C ATOM 1289 C GLU A 86 -26.925 3.148 0.937 1.00 0.00 C ATOM 1290 O GLU A 86 -27.046 4.364 1.068 1.00 0.00 O ATOM 1291 CB GLU A 86 -25.863 1.647 2.630 1.00 0.00 C ATOM 1292 CG GLU A 86 -26.048 0.761 3.845 1.00 0.00 C ATOM 1293 CD GLU A 86 -26.554 1.526 5.048 1.00 0.00 C ATOM 1294 OE1 GLU A 86 -25.785 2.328 5.618 1.00 0.00 O ATOM 1295 OE2 GLU A 86 -27.727 1.333 5.424 1.00 0.00 O ATOM 0 H GLU A 86 -27.575 0.159 1.657 1.00 0.00 H new ATOM 0 HA GLU A 86 -27.704 2.689 2.891 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -25.350 1.084 1.850 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -25.220 2.487 2.892 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -26.750 -0.038 3.605 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -25.098 0.287 4.093 1.00 0.00 H new ATOM 1302 N PHE A 87 -26.512 2.564 -0.170 1.00 0.00 N ATOM 1303 CA PHE A 87 -26.314 3.328 -1.399 1.00 0.00 C ATOM 1304 C PHE A 87 -27.580 4.030 -1.871 1.00 0.00 C ATOM 1305 O PHE A 87 -27.503 5.109 -2.434 1.00 0.00 O ATOM 1306 CB PHE A 87 -25.758 2.436 -2.509 1.00 0.00 C ATOM 1307 CG PHE A 87 -24.327 2.033 -2.298 1.00 0.00 C ATOM 1308 CD1 PHE A 87 -23.996 1.037 -1.396 1.00 0.00 C ATOM 1309 CD2 PHE A 87 -23.311 2.652 -3.006 1.00 0.00 C ATOM 1310 CE1 PHE A 87 -22.681 0.667 -1.206 1.00 0.00 C ATOM 1311 CE2 PHE A 87 -21.995 2.282 -2.819 1.00 0.00 C ATOM 1312 CZ PHE A 87 -21.680 1.290 -1.917 1.00 0.00 C ATOM 0 H PHE A 87 -26.306 1.568 -0.250 1.00 0.00 H new ATOM 0 HA PHE A 87 -25.587 4.106 -1.164 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -26.372 1.538 -2.584 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -25.842 2.960 -3.461 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -24.776 0.544 -0.835 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -23.551 3.433 -3.712 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -22.436 -0.112 -0.499 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -21.212 2.770 -3.380 1.00 0.00 H new ATOM 0 HZ PHE A 87 -20.650 1.001 -1.768 1.00 0.00 H new ATOM 1322 N MET A 88 -28.736 3.454 -1.622 1.00 0.00 N ATOM 1323 CA MET A 88 -29.989 4.136 -1.932 1.00 0.00 C ATOM 1324 C MET A 88 -30.159 5.333 -1.007 1.00 0.00 C ATOM 1325 O MET A 88 -30.594 6.413 -1.407 1.00 0.00 O ATOM 1326 CB MET A 88 -31.177 3.201 -1.753 1.00 0.00 C ATOM 1327 CG MET A 88 -32.474 3.827 -2.227 1.00 0.00 C ATOM 1328 SD MET A 88 -33.875 2.698 -2.127 1.00 0.00 S ATOM 1329 CE MET A 88 -34.015 2.486 -0.350 1.00 0.00 C ATOM 0 H MET A 88 -28.842 2.527 -1.211 1.00 0.00 H new ATOM 0 HA MET A 88 -29.952 4.463 -2.971 1.00 0.00 H new ATOM 0 HB2 MET A 88 -30.998 2.278 -2.305 1.00 0.00 H new ATOM 0 HB3 MET A 88 -31.269 2.930 -0.701 1.00 0.00 H new ATOM 0 HG2 MET A 88 -32.684 4.713 -1.628 1.00 0.00 H new ATOM 0 HG3 MET A 88 -32.355 4.160 -3.258 1.00 0.00 H new ATOM 0 HE1 MET A 88 -34.973 2.023 -0.113 1.00 0.00 H new ATOM 0 HE2 MET A 88 -33.206 1.848 0.005 1.00 0.00 H new ATOM 0 HE3 MET A 88 -33.951 3.458 0.139 1.00 0.00 H new ATOM 1339 N ASP A 89 -29.810 5.084 0.242 1.00 0.00 N ATOM 1340 CA ASP A 89 -29.810 6.110 1.286 1.00 0.00 C ATOM 1341 C ASP A 89 -28.950 7.298 0.857 1.00 0.00 C ATOM 1342 O ASP A 89 -29.137 8.421 1.321 1.00 0.00 O ATOM 1343 CB ASP A 89 -29.302 5.543 2.606 1.00 0.00 C ATOM 1344 CG ASP A 89 -29.482 6.506 3.766 1.00 0.00 C ATOM 1345 OD1 ASP A 89 -30.568 6.505 4.380 1.00 0.00 O ATOM 1346 OD2 ASP A 89 -28.538 7.265 4.069 1.00 0.00 O ATOM 0 H ASP A 89 -29.516 4.163 0.569 1.00 0.00 H new ATOM 0 HA ASP A 89 -30.836 6.448 1.432 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -29.830 4.615 2.825 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -28.246 5.294 2.507 1.00 0.00 H new ATOM 1351 N ALA A 90 -28.026 7.037 -0.055 1.00 0.00 N ATOM 1352 CA ALA A 90 -27.145 8.070 -0.580 1.00 0.00 C ATOM 1353 C ALA A 90 -27.421 8.355 -2.060 1.00 0.00 C ATOM 1354 O ALA A 90 -26.665 9.086 -2.704 1.00 0.00 O ATOM 1355 CB ALA A 90 -25.693 7.660 -0.389 1.00 0.00 C ATOM 0 H ALA A 90 -27.866 6.110 -0.450 1.00 0.00 H new ATOM 0 HA ALA A 90 -27.341 8.988 -0.025 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -25.040 8.438 -0.784 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -25.491 7.522 0.673 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -25.506 6.726 -0.919 1.00 0.00 H new ATOM 1361 N GLY A 91 -28.495 7.787 -2.603 1.00 0.00 N ATOM 1362 CA GLY A 91 -28.790 7.967 -4.015 1.00 0.00 C ATOM 1363 C GLY A 91 -28.189 6.866 -4.865 1.00 0.00 C ATOM 1364 O GLY A 91 -27.033 6.484 -4.668 1.00 0.00 O ATOM 0 H GLY A 91 -29.163 7.208 -2.094 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -29.870 7.988 -4.160 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -28.405 8.932 -4.346 1.00 0.00 H new ATOM 1368 N GLU A 92 -28.959 6.383 -5.830 1.00 0.00 N ATOM 1369 CA GLU A 92 -28.592 5.229 -6.613 1.00 0.00 C ATOM 1370 C GLU A 92 -27.300 5.479 -7.403 1.00 0.00 C ATOM 1371 O GLU A 92 -27.202 6.432 -8.179 1.00 0.00 O ATOM 1372 CB GLU A 92 -29.767 4.882 -7.519 1.00 0.00 C ATOM 1373 CG GLU A 92 -29.365 4.132 -8.750 1.00 0.00 C ATOM 1374 CD GLU A 92 -30.552 3.676 -9.573 1.00 0.00 C ATOM 1375 OE1 GLU A 92 -31.098 2.593 -9.283 1.00 0.00 O ATOM 1376 OE2 GLU A 92 -30.952 4.401 -10.509 1.00 0.00 O ATOM 0 H GLU A 92 -29.859 6.788 -6.087 1.00 0.00 H new ATOM 0 HA GLU A 92 -28.380 4.382 -5.961 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -30.486 4.286 -6.957 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -30.275 5.801 -7.812 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -28.725 4.766 -9.364 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -28.772 3.263 -8.463 1.00 0.00 H new ATOM 1383 N PRO A 93 -26.281 4.633 -7.176 1.00 0.00 N ATOM 1384 CA PRO A 93 -24.975 4.775 -7.812 1.00 0.00 C ATOM 1385 C PRO A 93 -24.963 4.286 -9.260 1.00 0.00 C ATOM 1386 O PRO A 93 -25.888 3.602 -9.707 1.00 0.00 O ATOM 1387 CB PRO A 93 -24.056 3.924 -6.944 1.00 0.00 C ATOM 1388 CG PRO A 93 -24.927 2.933 -6.264 1.00 0.00 C ATOM 1389 CD PRO A 93 -26.336 3.469 -6.278 1.00 0.00 C ATOM 0 HA PRO A 93 -24.671 5.820 -7.874 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -23.300 3.426 -7.550 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -23.527 4.540 -6.217 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -24.880 1.970 -6.773 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -24.591 2.769 -5.240 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -27.041 2.721 -6.641 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -26.661 3.755 -5.278 1.00 0.00 H new ATOM 1397 N GLU A 94 -23.909 4.644 -9.988 1.00 0.00 N ATOM 1398 CA GLU A 94 -23.812 4.314 -11.410 1.00 0.00 C ATOM 1399 C GLU A 94 -22.644 3.371 -11.677 1.00 0.00 C ATOM 1400 O GLU A 94 -21.669 3.350 -10.932 1.00 0.00 O ATOM 1401 CB GLU A 94 -23.633 5.592 -12.233 1.00 0.00 C ATOM 1402 CG GLU A 94 -24.637 6.676 -11.895 1.00 0.00 C ATOM 1403 CD GLU A 94 -24.459 7.910 -12.748 1.00 0.00 C ATOM 1404 OE1 GLU A 94 -24.950 7.925 -13.894 1.00 0.00 O ATOM 1405 OE2 GLU A 94 -23.839 8.882 -12.274 1.00 0.00 O ATOM 0 H GLU A 94 -23.111 5.161 -9.620 1.00 0.00 H new ATOM 0 HA GLU A 94 -24.735 3.814 -11.703 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -22.626 5.978 -12.074 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -23.717 5.347 -13.292 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -25.647 6.287 -12.029 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -24.536 6.946 -10.844 1.00 0.00 H new ATOM 1412 N ILE A 95 -22.744 2.595 -12.749 1.00 0.00 N ATOM 1413 CA ILE A 95 -21.683 1.665 -13.118 1.00 0.00 C ATOM 1414 C ILE A 95 -20.534 2.416 -13.772 1.00 0.00 C ATOM 1415 O ILE A 95 -20.749 3.261 -14.639 1.00 0.00 O ATOM 1416 CB ILE A 95 -22.193 0.559 -14.066 1.00 0.00 C ATOM 1417 CG1 ILE A 95 -23.386 -0.140 -13.432 1.00 0.00 C ATOM 1418 CG2 ILE A 95 -21.091 -0.453 -14.365 1.00 0.00 C ATOM 1419 CD1 ILE A 95 -23.912 -1.311 -14.222 1.00 0.00 C ATOM 0 H ILE A 95 -23.547 2.591 -13.378 1.00 0.00 H new ATOM 0 HA ILE A 95 -21.334 1.185 -12.204 1.00 0.00 H new ATOM 0 HB ILE A 95 -22.496 1.017 -15.008 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -23.103 -0.485 -12.438 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -24.189 0.585 -13.301 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -21.475 -1.222 -15.035 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -20.250 0.054 -14.839 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -20.759 -0.915 -13.435 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -24.761 -1.751 -13.699 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -24.229 -0.972 -15.208 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -23.126 -2.059 -14.331 1.00 0.00 H new ATOM 1431 N GLY A 96 -19.316 2.103 -13.352 1.00 0.00 N ATOM 1432 CA GLY A 96 -18.150 2.799 -13.857 1.00 0.00 C ATOM 1433 C GLY A 96 -18.045 4.212 -13.323 1.00 0.00 C ATOM 1434 O GLY A 96 -17.356 5.058 -13.898 1.00 0.00 O ATOM 0 H GLY A 96 -19.114 1.375 -12.667 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -17.253 2.243 -13.585 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -18.190 2.827 -14.946 1.00 0.00 H new ATOM 1438 N ALA A 97 -18.737 4.469 -12.225 1.00 0.00 N ATOM 1439 CA ALA A 97 -18.649 5.749 -11.549 1.00 0.00 C ATOM 1440 C ALA A 97 -17.711 5.633 -10.361 1.00 0.00 C ATOM 1441 O ALA A 97 -17.341 4.528 -9.961 1.00 0.00 O ATOM 1442 CB ALA A 97 -20.028 6.216 -11.110 1.00 0.00 C ATOM 0 H ALA A 97 -19.369 3.802 -11.782 1.00 0.00 H new ATOM 0 HA ALA A 97 -18.250 6.493 -12.239 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -19.943 7.178 -10.605 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -20.672 6.321 -11.983 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -20.460 5.484 -10.427 1.00 0.00 H new ATOM 1448 N ILE A 98 -17.318 6.764 -9.807 1.00 0.00 N ATOM 1449 CA ILE A 98 -16.350 6.773 -8.729 1.00 0.00 C ATOM 1450 C ILE A 98 -16.897 7.528 -7.527 1.00 0.00 C ATOM 1451 O ILE A 98 -17.332 8.674 -7.645 1.00 0.00 O ATOM 1452 CB ILE A 98 -15.026 7.412 -9.193 1.00 0.00 C ATOM 1453 CG1 ILE A 98 -14.541 6.739 -10.479 1.00 0.00 C ATOM 1454 CG2 ILE A 98 -13.966 7.299 -8.105 1.00 0.00 C ATOM 1455 CD1 ILE A 98 -13.473 7.517 -11.209 1.00 0.00 C ATOM 0 H ILE A 98 -17.654 7.686 -10.085 1.00 0.00 H new ATOM 0 HA ILE A 98 -16.157 5.740 -8.438 1.00 0.00 H new ATOM 0 HB ILE A 98 -15.201 8.469 -9.392 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -14.154 5.749 -10.236 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -15.391 6.594 -11.145 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -13.039 7.756 -8.451 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -14.310 7.812 -7.207 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -13.790 6.248 -7.877 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -13.181 6.977 -12.109 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -13.861 8.498 -11.484 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -12.605 7.639 -10.561 1.00 0.00 H new ATOM 1467 N MET A 99 -16.885 6.874 -6.376 1.00 0.00 N ATOM 1468 CA MET A 99 -17.380 7.476 -5.147 1.00 0.00 C ATOM 1469 C MET A 99 -16.276 7.404 -4.117 1.00 0.00 C ATOM 1470 O MET A 99 -15.335 6.626 -4.293 1.00 0.00 O ATOM 1471 CB MET A 99 -18.580 6.716 -4.600 1.00 0.00 C ATOM 1472 CG MET A 99 -19.468 6.117 -5.666 1.00 0.00 C ATOM 1473 SD MET A 99 -20.452 4.742 -5.045 1.00 0.00 S ATOM 1474 CE MET A 99 -21.196 5.487 -3.602 1.00 0.00 C ATOM 0 H MET A 99 -16.536 5.922 -6.267 1.00 0.00 H new ATOM 0 HA MET A 99 -17.681 8.502 -5.357 1.00 0.00 H new ATOM 0 HB2 MET A 99 -18.225 5.918 -3.947 1.00 0.00 H new ATOM 0 HB3 MET A 99 -19.174 7.391 -3.984 1.00 0.00 H new ATOM 0 HG2 MET A 99 -20.132 6.888 -6.058 1.00 0.00 H new ATOM 0 HG3 MET A 99 -18.852 5.774 -6.497 1.00 0.00 H new ATOM 0 HE1 MET A 99 -22.217 5.123 -3.490 1.00 0.00 H new ATOM 0 HE2 MET A 99 -20.618 5.222 -2.717 1.00 0.00 H new ATOM 0 HE3 MET A 99 -21.208 6.571 -3.717 1.00 0.00 H new ATOM 1484 N LEU A 100 -16.339 8.195 -3.059 1.00 0.00 N ATOM 1485 CA LEU A 100 -15.467 7.991 -1.918 1.00 0.00 C ATOM 1486 C LEU A 100 -15.948 6.834 -1.064 1.00 0.00 C ATOM 1487 O LEU A 100 -17.135 6.505 -1.038 1.00 0.00 O ATOM 1488 CB LEU A 100 -15.352 9.262 -1.067 1.00 0.00 C ATOM 1489 CG LEU A 100 -14.452 10.363 -1.637 1.00 0.00 C ATOM 1490 CD1 LEU A 100 -13.059 9.820 -1.898 1.00 0.00 C ATOM 1491 CD2 LEU A 100 -15.043 10.950 -2.907 1.00 0.00 C ATOM 0 H LEU A 100 -16.983 8.981 -2.968 1.00 0.00 H new ATOM 0 HA LEU A 100 -14.478 7.749 -2.307 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -16.351 9.673 -0.924 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -14.977 8.985 -0.082 1.00 0.00 H new ATOM 0 HG LEU A 100 -14.384 11.163 -0.900 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -12.430 10.612 -2.303 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -12.629 9.457 -0.965 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -13.116 9.000 -2.614 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -14.383 11.729 -3.289 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -15.149 10.165 -3.656 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -16.021 11.378 -2.689 1.00 0.00 H new ATOM 1503 N PHE A 101 -15.003 6.232 -0.369 1.00 0.00 N ATOM 1504 CA PHE A 101 -15.238 4.986 0.339 1.00 0.00 C ATOM 1505 C PHE A 101 -14.337 4.962 1.554 1.00 0.00 C ATOM 1506 O PHE A 101 -13.289 5.599 1.541 1.00 0.00 O ATOM 1507 CB PHE A 101 -14.996 3.775 -0.554 1.00 0.00 C ATOM 1508 CG PHE A 101 -16.024 3.622 -1.639 1.00 0.00 C ATOM 1509 CD1 PHE A 101 -17.335 3.280 -1.336 1.00 0.00 C ATOM 1510 CD2 PHE A 101 -15.681 3.818 -2.964 1.00 0.00 C ATOM 1511 CE1 PHE A 101 -18.276 3.140 -2.332 1.00 0.00 C ATOM 1512 CE2 PHE A 101 -16.621 3.680 -3.963 1.00 0.00 C ATOM 1513 CZ PHE A 101 -17.918 3.341 -3.647 1.00 0.00 C ATOM 0 H PHE A 101 -14.052 6.591 -0.278 1.00 0.00 H new ATOM 0 HA PHE A 101 -16.282 4.932 0.647 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -14.008 3.858 -1.008 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -14.989 2.875 0.060 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -17.621 3.122 -0.307 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -14.665 4.082 -3.219 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -19.292 2.873 -2.083 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -16.340 3.838 -4.994 1.00 0.00 H new ATOM 0 HZ PHE A 101 -18.654 3.233 -4.430 1.00 0.00 H new ATOM 1523 N THR A 102 -14.691 4.220 2.579 1.00 0.00 N ATOM 1524 CA THR A 102 -13.870 4.202 3.772 1.00 0.00 C ATOM 1525 C THR A 102 -13.400 2.786 4.063 1.00 0.00 C ATOM 1526 O THR A 102 -14.196 1.906 4.406 1.00 0.00 O ATOM 1527 CB THR A 102 -14.602 4.784 4.994 1.00 0.00 C ATOM 1528 OG1 THR A 102 -15.366 5.938 4.602 1.00 0.00 O ATOM 1529 CG2 THR A 102 -13.592 5.194 6.054 1.00 0.00 C ATOM 0 H THR A 102 -15.524 3.632 2.614 1.00 0.00 H new ATOM 0 HA THR A 102 -13.006 4.839 3.581 1.00 0.00 H new ATOM 0 HB THR A 102 -15.270 4.023 5.399 1.00 0.00 H new ATOM 0 HG1 THR A 102 -15.831 6.303 5.383 1.00 0.00 H new ATOM 0 HG21 THR A 102 -14.116 5.605 6.917 1.00 0.00 H new ATOM 0 HG22 THR A 102 -13.014 4.323 6.362 1.00 0.00 H new ATOM 0 HG23 THR A 102 -12.920 5.948 5.644 1.00 0.00 H new ATOM 1537 N ALA A 103 -12.103 2.574 3.903 1.00 0.00 N ATOM 1538 CA ALA A 103 -11.504 1.268 4.081 1.00 0.00 C ATOM 1539 C ALA A 103 -11.338 0.944 5.561 1.00 0.00 C ATOM 1540 O ALA A 103 -11.445 1.821 6.424 1.00 0.00 O ATOM 1541 CB ALA A 103 -10.162 1.220 3.368 1.00 0.00 C ATOM 0 H ALA A 103 -11.439 3.305 3.646 1.00 0.00 H new ATOM 0 HA ALA A 103 -12.164 0.516 3.648 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -9.713 0.236 3.503 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -10.308 1.409 2.304 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -9.501 1.981 3.784 1.00 0.00 H new ATOM 1547 N MET A 104 -11.068 -0.327 5.833 1.00 0.00 N ATOM 1548 CA MET A 104 -11.009 -0.850 7.195 1.00 0.00 C ATOM 1549 C MET A 104 -9.829 -0.277 7.974 1.00 0.00 C ATOM 1550 O MET A 104 -9.769 -0.396 9.196 1.00 0.00 O ATOM 1551 CB MET A 104 -10.906 -2.375 7.162 1.00 0.00 C ATOM 1552 CG MET A 104 -12.041 -3.048 6.406 1.00 0.00 C ATOM 1553 SD MET A 104 -11.894 -4.845 6.388 1.00 0.00 S ATOM 1554 CE MET A 104 -13.227 -5.281 5.275 1.00 0.00 C ATOM 0 H MET A 104 -10.883 -1.027 5.114 1.00 0.00 H new ATOM 0 HA MET A 104 -11.925 -0.548 7.703 1.00 0.00 H new ATOM 0 HB2 MET A 104 -9.958 -2.656 6.703 1.00 0.00 H new ATOM 0 HB3 MET A 104 -10.889 -2.751 8.185 1.00 0.00 H new ATOM 0 HG2 MET A 104 -12.991 -2.770 6.862 1.00 0.00 H new ATOM 0 HG3 MET A 104 -12.059 -2.678 5.381 1.00 0.00 H new ATOM 0 HE1 MET A 104 -13.266 -6.364 5.161 1.00 0.00 H new ATOM 0 HE2 MET A 104 -14.173 -4.925 5.683 1.00 0.00 H new ATOM 0 HE3 MET A 104 -13.055 -4.820 4.303 1.00 0.00 H new ATOM 1564 N ASP A 105 -8.895 0.341 7.265 1.00 0.00 N ATOM 1565 CA ASP A 105 -7.697 0.888 7.889 1.00 0.00 C ATOM 1566 C ASP A 105 -7.852 2.375 8.180 1.00 0.00 C ATOM 1567 O ASP A 105 -6.880 3.053 8.506 1.00 0.00 O ATOM 1568 CB ASP A 105 -6.483 0.678 6.987 1.00 0.00 C ATOM 1569 CG ASP A 105 -6.528 1.553 5.752 1.00 0.00 C ATOM 1570 OD1 ASP A 105 -7.478 1.411 4.959 1.00 0.00 O ATOM 1571 OD2 ASP A 105 -5.622 2.396 5.578 1.00 0.00 O ATOM 0 H ASP A 105 -8.943 0.477 6.255 1.00 0.00 H new ATOM 0 HA ASP A 105 -7.550 0.360 8.831 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -5.574 0.892 7.549 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -6.433 -0.369 6.687 1.00 0.00 H new ATOM 1576 N GLY A 106 -9.071 2.888 8.059 1.00 0.00 N ATOM 1577 CA GLY A 106 -9.306 4.290 8.329 1.00 0.00 C ATOM 1578 C GLY A 106 -9.099 5.176 7.118 1.00 0.00 C ATOM 1579 O GLY A 106 -9.462 6.350 7.136 1.00 0.00 O ATOM 0 H GLY A 106 -9.897 2.359 7.780 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -10.325 4.417 8.693 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -8.639 4.616 9.127 1.00 0.00 H new ATOM 1583 N SER A 107 -8.522 4.626 6.063 1.00 0.00 N ATOM 1584 CA SER A 107 -8.269 5.400 4.862 1.00 0.00 C ATOM 1585 C SER A 107 -9.536 5.536 4.034 1.00 0.00 C ATOM 1586 O SER A 107 -10.401 4.662 4.044 1.00 0.00 O ATOM 1587 CB SER A 107 -7.161 4.760 4.030 1.00 0.00 C ATOM 1588 OG SER A 107 -6.844 5.549 2.893 1.00 0.00 O ATOM 0 H SER A 107 -8.222 3.652 6.014 1.00 0.00 H new ATOM 0 HA SER A 107 -7.944 6.395 5.164 1.00 0.00 H new ATOM 0 HB2 SER A 107 -6.270 4.632 4.645 1.00 0.00 H new ATOM 0 HB3 SER A 107 -7.473 3.766 3.709 1.00 0.00 H new ATOM 0 HG SER A 107 -6.130 5.114 2.382 1.00 0.00 H new ATOM 1594 N GLU A 108 -9.635 6.639 3.322 1.00 0.00 N ATOM 1595 CA GLU A 108 -10.782 6.907 2.481 1.00 0.00 C ATOM 1596 C GLU A 108 -10.323 7.075 1.039 1.00 0.00 C ATOM 1597 O GLU A 108 -9.751 8.103 0.677 1.00 0.00 O ATOM 1598 CB GLU A 108 -11.509 8.161 2.966 1.00 0.00 C ATOM 1599 CG GLU A 108 -12.756 8.481 2.171 1.00 0.00 C ATOM 1600 CD GLU A 108 -13.450 9.733 2.647 1.00 0.00 C ATOM 1601 OE1 GLU A 108 -12.902 10.833 2.445 1.00 0.00 O ATOM 1602 OE2 GLU A 108 -14.551 9.622 3.221 1.00 0.00 O ATOM 0 H GLU A 108 -8.926 7.372 3.310 1.00 0.00 H new ATOM 0 HA GLU A 108 -11.477 6.069 2.536 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -11.779 8.032 4.014 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -10.827 9.010 2.914 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -12.491 8.596 1.120 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -13.448 7.641 2.236 1.00 0.00 H new ATOM 1609 N MET A 109 -10.553 6.060 0.224 1.00 0.00 N ATOM 1610 CA MET A 109 -10.075 6.068 -1.150 1.00 0.00 C ATOM 1611 C MET A 109 -11.244 6.171 -2.125 1.00 0.00 C ATOM 1612 O MET A 109 -12.325 5.646 -1.860 1.00 0.00 O ATOM 1613 CB MET A 109 -9.270 4.787 -1.425 1.00 0.00 C ATOM 1614 CG MET A 109 -10.114 3.583 -1.786 1.00 0.00 C ATOM 1615 SD MET A 109 -9.109 2.121 -2.103 1.00 0.00 S ATOM 1616 CE MET A 109 -8.671 1.679 -0.430 1.00 0.00 C ATOM 0 H MET A 109 -11.067 5.220 0.489 1.00 0.00 H new ATOM 0 HA MET A 109 -9.432 6.936 -1.293 1.00 0.00 H new ATOM 0 HB2 MET A 109 -8.569 4.980 -2.237 1.00 0.00 H new ATOM 0 HB3 MET A 109 -8.677 4.548 -0.542 1.00 0.00 H new ATOM 0 HG2 MET A 109 -10.812 3.374 -0.975 1.00 0.00 H new ATOM 0 HG3 MET A 109 -10.711 3.811 -2.669 1.00 0.00 H new ATOM 0 HE1 MET A 109 -7.586 1.682 -0.325 1.00 0.00 H new ATOM 0 HE2 MET A 109 -9.105 2.401 0.262 1.00 0.00 H new ATOM 0 HE3 MET A 109 -9.054 0.684 -0.204 1.00 0.00 H new ATOM 1626 N PRO A 110 -11.052 6.872 -3.253 1.00 0.00 N ATOM 1627 CA PRO A 110 -12.028 6.891 -4.341 1.00 0.00 C ATOM 1628 C PRO A 110 -12.075 5.540 -5.045 1.00 0.00 C ATOM 1629 O PRO A 110 -11.062 5.072 -5.570 1.00 0.00 O ATOM 1630 CB PRO A 110 -11.506 7.970 -5.302 1.00 0.00 C ATOM 1631 CG PRO A 110 -10.422 8.683 -4.564 1.00 0.00 C ATOM 1632 CD PRO A 110 -9.884 7.711 -3.553 1.00 0.00 C ATOM 0 HA PRO A 110 -13.038 7.095 -3.986 1.00 0.00 H new ATOM 0 HB2 PRO A 110 -11.125 7.524 -6.221 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -12.302 8.658 -5.587 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -9.636 9.007 -5.247 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -10.809 9.577 -4.075 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -9.058 7.125 -3.956 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -9.511 8.218 -2.663 1.00 0.00 H new ATOM 1640 N GLY A 111 -13.238 4.914 -5.049 1.00 0.00 N ATOM 1641 CA GLY A 111 -13.366 3.589 -5.629 1.00 0.00 C ATOM 1642 C GLY A 111 -14.312 3.564 -6.809 1.00 0.00 C ATOM 1643 O GLY A 111 -15.216 4.396 -6.902 1.00 0.00 O ATOM 0 H GLY A 111 -14.100 5.297 -4.661 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -12.384 3.238 -5.947 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -13.721 2.895 -4.867 1.00 0.00 H new ATOM 1647 N VAL A 112 -14.110 2.611 -7.711 1.00 0.00 N ATOM 1648 CA VAL A 112 -14.903 2.533 -8.923 1.00 0.00 C ATOM 1649 C VAL A 112 -15.978 1.471 -8.780 1.00 0.00 C ATOM 1650 O VAL A 112 -15.689 0.310 -8.501 1.00 0.00 O ATOM 1651 CB VAL A 112 -14.027 2.242 -10.168 1.00 0.00 C ATOM 1652 CG1 VAL A 112 -12.922 1.258 -9.833 1.00 0.00 C ATOM 1653 CG2 VAL A 112 -14.872 1.702 -11.316 1.00 0.00 C ATOM 0 H VAL A 112 -13.402 1.882 -7.622 1.00 0.00 H new ATOM 0 HA VAL A 112 -15.374 3.505 -9.070 1.00 0.00 H new ATOM 0 HB VAL A 112 -13.575 3.183 -10.481 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -12.321 1.069 -10.722 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -12.290 1.674 -9.049 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -13.361 0.322 -9.487 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -14.233 1.506 -12.177 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -15.358 0.777 -11.006 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -15.630 2.437 -11.586 1.00 0.00 H new ATOM 1663 N ILE A 113 -17.218 1.889 -8.924 1.00 0.00 N ATOM 1664 CA ILE A 113 -18.328 0.964 -8.881 1.00 0.00 C ATOM 1665 C ILE A 113 -18.266 0.043 -10.093 1.00 0.00 C ATOM 1666 O ILE A 113 -18.460 0.473 -11.235 1.00 0.00 O ATOM 1667 CB ILE A 113 -19.680 1.700 -8.864 1.00 0.00 C ATOM 1668 CG1 ILE A 113 -19.542 3.084 -8.235 1.00 0.00 C ATOM 1669 CG2 ILE A 113 -20.706 0.901 -8.080 1.00 0.00 C ATOM 1670 CD1 ILE A 113 -20.874 3.753 -8.018 1.00 0.00 C ATOM 0 H ILE A 113 -17.481 2.863 -9.072 1.00 0.00 H new ATOM 0 HA ILE A 113 -18.249 0.384 -7.961 1.00 0.00 H new ATOM 0 HB ILE A 113 -20.010 1.810 -9.897 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -19.023 2.996 -7.280 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -18.924 3.712 -8.877 1.00 0.00 H new ATOM 0 HG21 ILE A 113 -21.657 1.434 -8.077 1.00 0.00 H new ATOM 0 HG22 ILE A 113 -20.839 -0.076 -8.545 1.00 0.00 H new ATOM 0 HG23 ILE A 113 -20.360 0.771 -7.055 1.00 0.00 H new ATOM 0 HD11 ILE A 113 -20.720 4.734 -7.569 1.00 0.00 H new ATOM 0 HD12 ILE A 113 -21.383 3.868 -8.975 1.00 0.00 H new ATOM 0 HD13 ILE A 113 -21.484 3.142 -7.353 1.00 0.00 H new ATOM 1682 N ARG A 114 -17.978 -1.224 -9.829 1.00 0.00 N ATOM 1683 CA ARG A 114 -17.840 -2.224 -10.872 1.00 0.00 C ATOM 1684 C ARG A 114 -19.151 -2.414 -11.611 1.00 0.00 C ATOM 1685 O ARG A 114 -19.194 -2.351 -12.837 1.00 0.00 O ATOM 1686 CB ARG A 114 -17.369 -3.554 -10.264 1.00 0.00 C ATOM 1687 CG ARG A 114 -17.728 -4.792 -11.083 1.00 0.00 C ATOM 1688 CD ARG A 114 -17.186 -4.723 -12.503 1.00 0.00 C ATOM 1689 NE ARG A 114 -15.744 -4.959 -12.559 1.00 0.00 N ATOM 1690 CZ ARG A 114 -14.985 -4.695 -13.622 1.00 0.00 C ATOM 1691 NH1 ARG A 114 -15.516 -4.132 -14.699 1.00 0.00 N ATOM 1692 NH2 ARG A 114 -13.690 -4.986 -13.603 1.00 0.00 N ATOM 0 H ARG A 114 -17.834 -1.585 -8.886 1.00 0.00 H new ATOM 0 HA ARG A 114 -17.094 -1.879 -11.588 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -16.287 -3.518 -10.140 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -17.801 -3.656 -9.268 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -17.333 -5.679 -10.588 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -18.812 -4.902 -11.115 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -17.697 -5.462 -13.121 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -17.408 -3.744 -12.927 1.00 0.00 H new ATOM 0 HE ARG A 114 -15.291 -5.350 -11.733 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -16.509 -3.899 -14.716 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -14.931 -3.932 -15.510 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -13.275 -5.412 -12.774 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -13.110 -4.784 -14.417 1.00 0.00 H new ATOM 1706 N GLU A 115 -20.215 -2.658 -10.869 1.00 0.00 N ATOM 1707 CA GLU A 115 -21.506 -2.902 -11.474 1.00 0.00 C ATOM 1708 C GLU A 115 -22.613 -2.653 -10.462 1.00 0.00 C ATOM 1709 O GLU A 115 -22.421 -2.853 -9.259 1.00 0.00 O ATOM 1710 CB GLU A 115 -21.573 -4.340 -11.992 1.00 0.00 C ATOM 1711 CG GLU A 115 -22.376 -4.484 -13.271 1.00 0.00 C ATOM 1712 CD GLU A 115 -22.707 -5.929 -13.591 1.00 0.00 C ATOM 1713 OE1 GLU A 115 -23.704 -6.450 -13.052 1.00 0.00 O ATOM 1714 OE2 GLU A 115 -21.968 -6.554 -14.379 1.00 0.00 O ATOM 0 H GLU A 115 -20.209 -2.692 -9.850 1.00 0.00 H new ATOM 0 HA GLU A 115 -21.642 -2.219 -12.312 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -20.560 -4.703 -12.165 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -22.012 -4.975 -11.223 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -23.301 -3.914 -13.181 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -21.814 -4.052 -14.099 1.00 0.00 H new ATOM 1721 N ILE A 116 -23.762 -2.205 -10.943 1.00 0.00 N ATOM 1722 CA ILE A 116 -24.914 -2.009 -10.085 1.00 0.00 C ATOM 1723 C ILE A 116 -25.801 -3.234 -10.168 1.00 0.00 C ATOM 1724 O ILE A 116 -26.401 -3.508 -11.209 1.00 0.00 O ATOM 1725 CB ILE A 116 -25.750 -0.769 -10.468 1.00 0.00 C ATOM 1726 CG1 ILE A 116 -24.886 0.497 -10.502 1.00 0.00 C ATOM 1727 CG2 ILE A 116 -26.905 -0.597 -9.491 1.00 0.00 C ATOM 1728 CD1 ILE A 116 -24.161 0.792 -9.212 1.00 0.00 C ATOM 0 H ILE A 116 -23.919 -1.971 -11.923 1.00 0.00 H new ATOM 0 HA ILE A 116 -24.538 -1.850 -9.074 1.00 0.00 H new ATOM 0 HB ILE A 116 -26.150 -0.925 -11.470 1.00 0.00 H new ATOM 0 HG12 ILE A 116 -24.153 0.400 -11.303 1.00 0.00 H new ATOM 0 HG13 ILE A 116 -25.520 1.348 -10.751 1.00 0.00 H new ATOM 0 HG21 ILE A 116 -27.489 0.280 -9.769 1.00 0.00 H new ATOM 0 HG22 ILE A 116 -27.542 -1.481 -9.521 1.00 0.00 H new ATOM 0 HG23 ILE A 116 -26.512 -0.467 -8.483 1.00 0.00 H new ATOM 0 HD11 ILE A 116 -23.574 1.704 -9.325 1.00 0.00 H new ATOM 0 HD12 ILE A 116 -24.886 0.924 -8.409 1.00 0.00 H new ATOM 0 HD13 ILE A 116 -23.498 -0.038 -8.969 1.00 0.00 H new ATOM 1740 N ASN A 117 -25.865 -3.976 -9.087 1.00 0.00 N ATOM 1741 CA ASN A 117 -26.664 -5.184 -9.047 1.00 0.00 C ATOM 1742 C ASN A 117 -27.967 -4.921 -8.322 1.00 0.00 C ATOM 1743 O ASN A 117 -28.040 -3.997 -7.509 1.00 0.00 O ATOM 1744 CB ASN A 117 -25.901 -6.334 -8.390 1.00 0.00 C ATOM 1745 CG ASN A 117 -24.851 -6.931 -9.309 1.00 0.00 C ATOM 1746 OD1 ASN A 117 -25.133 -7.860 -10.066 1.00 0.00 O ATOM 1747 ND2 ASN A 117 -23.637 -6.405 -9.257 1.00 0.00 N ATOM 0 H ASN A 117 -25.372 -3.765 -8.219 1.00 0.00 H new ATOM 0 HA ASN A 117 -26.885 -5.481 -10.072 1.00 0.00 H new ATOM 0 HB2 ASN A 117 -25.421 -5.975 -7.480 1.00 0.00 H new ATOM 0 HB3 ASN A 117 -26.605 -7.111 -8.094 1.00 0.00 H new ATOM 0 HD21 ASN A 117 -22.897 -6.769 -9.857 1.00 0.00 H new ATOM 0 HD22 ASN A 117 -23.442 -5.636 -8.616 1.00 0.00 H new ATOM 1754 N GLY A 118 -28.986 -5.710 -8.604 1.00 0.00 N ATOM 1755 CA GLY A 118 -30.311 -5.404 -8.106 1.00 0.00 C ATOM 1756 C GLY A 118 -30.362 -5.289 -6.596 1.00 0.00 C ATOM 1757 O GLY A 118 -31.016 -4.398 -6.067 1.00 0.00 O ATOM 0 H GLY A 118 -28.923 -6.557 -9.168 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -30.653 -4.468 -8.548 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -31.004 -6.181 -8.430 1.00 0.00 H new ATOM 1761 N ASP A 119 -29.629 -6.150 -5.907 1.00 0.00 N ATOM 1762 CA ASP A 119 -29.681 -6.216 -4.455 1.00 0.00 C ATOM 1763 C ASP A 119 -28.394 -5.697 -3.812 1.00 0.00 C ATOM 1764 O ASP A 119 -28.360 -5.435 -2.610 1.00 0.00 O ATOM 1765 CB ASP A 119 -29.928 -7.658 -3.996 1.00 0.00 C ATOM 1766 CG ASP A 119 -28.733 -8.563 -4.225 1.00 0.00 C ATOM 1767 OD1 ASP A 119 -28.568 -9.062 -5.358 1.00 0.00 O ATOM 1768 OD2 ASP A 119 -27.956 -8.786 -3.273 1.00 0.00 O ATOM 0 H ASP A 119 -28.987 -6.817 -6.334 1.00 0.00 H new ATOM 0 HA ASP A 119 -30.504 -5.577 -4.135 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -30.180 -7.658 -2.935 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -30.790 -8.061 -4.528 1.00 0.00 H new ATOM 1773 N SER A 120 -27.347 -5.513 -4.610 1.00 0.00 N ATOM 1774 CA SER A 120 -26.020 -5.261 -4.055 1.00 0.00 C ATOM 1775 C SER A 120 -25.202 -4.315 -4.938 1.00 0.00 C ATOM 1776 O SER A 120 -25.444 -4.199 -6.138 1.00 0.00 O ATOM 1777 CB SER A 120 -25.285 -6.596 -3.889 1.00 0.00 C ATOM 1778 OG SER A 120 -24.067 -6.447 -3.175 1.00 0.00 O ATOM 0 H SER A 120 -27.388 -5.533 -5.629 1.00 0.00 H new ATOM 0 HA SER A 120 -26.140 -4.775 -3.087 1.00 0.00 H new ATOM 0 HB2 SER A 120 -25.929 -7.302 -3.364 1.00 0.00 H new ATOM 0 HB3 SER A 120 -25.080 -7.022 -4.871 1.00 0.00 H new ATOM 0 HG SER A 120 -24.189 -5.795 -2.453 1.00 0.00 H new ATOM 1784 N ILE A 121 -24.232 -3.643 -4.326 1.00 0.00 N ATOM 1785 CA ILE A 121 -23.349 -2.726 -5.033 1.00 0.00 C ATOM 1786 C ILE A 121 -21.901 -3.192 -4.913 1.00 0.00 C ATOM 1787 O ILE A 121 -21.374 -3.314 -3.805 1.00 0.00 O ATOM 1788 CB ILE A 121 -23.461 -1.292 -4.470 1.00 0.00 C ATOM 1789 CG1 ILE A 121 -24.903 -0.786 -4.566 1.00 0.00 C ATOM 1790 CG2 ILE A 121 -22.517 -0.352 -5.209 1.00 0.00 C ATOM 1791 CD1 ILE A 121 -25.385 -0.586 -5.985 1.00 0.00 C ATOM 0 H ILE A 121 -24.037 -3.720 -3.328 1.00 0.00 H new ATOM 0 HA ILE A 121 -23.653 -2.718 -6.080 1.00 0.00 H new ATOM 0 HB ILE A 121 -23.173 -1.314 -3.419 1.00 0.00 H new ATOM 0 HG12 ILE A 121 -25.561 -1.495 -4.065 1.00 0.00 H new ATOM 0 HG13 ILE A 121 -24.984 0.159 -4.028 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -22.610 0.654 -4.799 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -21.491 -0.699 -5.090 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -22.774 -0.337 -6.268 1.00 0.00 H new ATOM 0 HD11 ILE A 121 -26.414 -0.227 -5.972 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -24.751 0.146 -6.485 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -25.338 -1.533 -6.522 1.00 0.00 H new ATOM 1803 N THR A 122 -21.269 -3.460 -6.046 1.00 0.00 N ATOM 1804 CA THR A 122 -19.902 -3.964 -6.069 1.00 0.00 C ATOM 1805 C THR A 122 -18.926 -2.880 -6.513 1.00 0.00 C ATOM 1806 O THR A 122 -19.050 -2.356 -7.620 1.00 0.00 O ATOM 1807 CB THR A 122 -19.801 -5.151 -7.042 1.00 0.00 C ATOM 1808 OG1 THR A 122 -20.698 -6.190 -6.626 1.00 0.00 O ATOM 1809 CG2 THR A 122 -18.375 -5.684 -7.126 1.00 0.00 C ATOM 0 H THR A 122 -21.684 -3.336 -6.969 1.00 0.00 H new ATOM 0 HA THR A 122 -19.643 -4.281 -5.059 1.00 0.00 H new ATOM 0 HB THR A 122 -20.081 -4.804 -8.037 1.00 0.00 H new ATOM 0 HG1 THR A 122 -20.336 -7.061 -6.892 1.00 0.00 H new ATOM 0 HG21 THR A 122 -18.340 -6.522 -7.822 1.00 0.00 H new ATOM 0 HG22 THR A 122 -17.711 -4.894 -7.476 1.00 0.00 H new ATOM 0 HG23 THR A 122 -18.053 -6.018 -6.140 1.00 0.00 H new ATOM 1817 N VAL A 123 -17.969 -2.529 -5.657 1.00 0.00 N ATOM 1818 CA VAL A 123 -16.964 -1.514 -5.984 1.00 0.00 C ATOM 1819 C VAL A 123 -15.569 -2.123 -5.980 1.00 0.00 C ATOM 1820 O VAL A 123 -15.128 -2.624 -4.942 1.00 0.00 O ATOM 1821 CB VAL A 123 -16.977 -0.404 -4.920 1.00 0.00 C ATOM 1822 CG1 VAL A 123 -16.037 0.729 -5.299 1.00 0.00 C ATOM 1823 CG2 VAL A 123 -18.390 0.092 -4.681 1.00 0.00 C ATOM 0 H VAL A 123 -17.866 -2.934 -4.726 1.00 0.00 H new ATOM 0 HA VAL A 123 -17.203 -1.116 -6.970 1.00 0.00 H new ATOM 0 HB VAL A 123 -16.612 -0.823 -3.982 1.00 0.00 H new ATOM 0 HG11 VAL A 123 -16.067 1.500 -4.529 1.00 0.00 H new ATOM 0 HG12 VAL A 123 -15.021 0.344 -5.389 1.00 0.00 H new ATOM 0 HG13 VAL A 123 -16.348 1.157 -6.252 1.00 0.00 H new ATOM 0 HG21 VAL A 123 -18.377 0.877 -3.925 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -18.798 0.490 -5.610 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -19.012 -0.734 -4.336 1.00 0.00 H new ATOM 1833 N ASP A 124 -14.860 -2.116 -7.107 1.00 0.00 N ATOM 1834 CA ASP A 124 -13.528 -2.694 -7.124 1.00 0.00 C ATOM 1835 C ASP A 124 -12.406 -1.682 -6.910 1.00 0.00 C ATOM 1836 O ASP A 124 -11.961 -1.008 -7.836 1.00 0.00 O ATOM 1837 CB ASP A 124 -13.324 -3.422 -8.464 1.00 0.00 C ATOM 1838 CG ASP A 124 -13.454 -2.529 -9.686 1.00 0.00 C ATOM 1839 OD1 ASP A 124 -14.579 -2.084 -9.986 1.00 0.00 O ATOM 1840 OD2 ASP A 124 -12.436 -2.307 -10.376 1.00 0.00 O ATOM 0 H ASP A 124 -15.178 -1.727 -7.995 1.00 0.00 H new ATOM 0 HA ASP A 124 -13.470 -3.383 -6.281 1.00 0.00 H new ATOM 0 HB2 ASP A 124 -12.336 -3.882 -8.468 1.00 0.00 H new ATOM 0 HB3 ASP A 124 -14.052 -4.230 -8.540 1.00 0.00 H new ATOM 1845 N PHE A 125 -11.948 -1.567 -5.670 1.00 0.00 N ATOM 1846 CA PHE A 125 -10.708 -0.884 -5.372 1.00 0.00 C ATOM 1847 C PHE A 125 -9.547 -1.695 -5.912 1.00 0.00 C ATOM 1848 O PHE A 125 -9.129 -2.678 -5.314 1.00 0.00 O ATOM 1849 CB PHE A 125 -10.543 -0.744 -3.856 1.00 0.00 C ATOM 1850 CG PHE A 125 -11.777 -0.288 -3.140 1.00 0.00 C ATOM 1851 CD1 PHE A 125 -12.752 -1.200 -2.769 1.00 0.00 C ATOM 1852 CD2 PHE A 125 -11.961 1.044 -2.833 1.00 0.00 C ATOM 1853 CE1 PHE A 125 -13.888 -0.790 -2.106 1.00 0.00 C ATOM 1854 CE2 PHE A 125 -13.091 1.459 -2.170 1.00 0.00 C ATOM 1855 CZ PHE A 125 -14.059 0.543 -1.804 1.00 0.00 C ATOM 0 H PHE A 125 -12.426 -1.944 -4.852 1.00 0.00 H new ATOM 0 HA PHE A 125 -10.726 0.103 -5.833 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -10.234 -1.705 -3.446 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -9.738 -0.037 -3.654 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -12.620 -2.246 -3.003 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -11.211 1.767 -3.116 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -14.641 -1.511 -1.824 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -13.223 2.505 -1.934 1.00 0.00 H new ATOM 0 HZ PHE A 125 -14.946 0.871 -1.283 1.00 0.00 H new ATOM 1865 N ASN A 126 -9.069 -1.330 -7.064 1.00 0.00 N ATOM 1866 CA ASN A 126 -7.925 -2.005 -7.631 1.00 0.00 C ATOM 1867 C ASN A 126 -6.632 -1.513 -6.994 1.00 0.00 C ATOM 1868 O ASN A 126 -5.986 -0.595 -7.496 1.00 0.00 O ATOM 1869 CB ASN A 126 -7.936 -1.804 -9.132 1.00 0.00 C ATOM 1870 CG ASN A 126 -8.930 -2.727 -9.810 1.00 0.00 C ATOM 1871 OD1 ASN A 126 -8.840 -2.988 -11.009 1.00 0.00 O ATOM 1872 ND2 ASN A 126 -9.860 -3.266 -9.035 1.00 0.00 N ATOM 0 H ASN A 126 -9.447 -0.572 -7.633 1.00 0.00 H new ATOM 0 HA ASN A 126 -7.982 -3.073 -7.422 1.00 0.00 H new ATOM 0 HB2 ASN A 126 -8.187 -0.768 -9.359 1.00 0.00 H new ATOM 0 HB3 ASN A 126 -6.938 -1.986 -9.532 1.00 0.00 H new ATOM 0 HD21 ASN A 126 -10.534 -3.923 -9.428 1.00 0.00 H new ATOM 0 HD22 ASN A 126 -9.902 -3.024 -8.045 1.00 0.00 H new ATOM 1964 N THR A 133 0.024 7.686 -11.769 1.00 0.00 N ATOM 1965 CA THR A 133 1.324 8.005 -11.198 1.00 0.00 C ATOM 1966 C THR A 133 1.176 8.688 -9.837 1.00 0.00 C ATOM 1967 O THR A 133 0.333 9.573 -9.670 1.00 0.00 O ATOM 1968 CB THR A 133 2.107 8.925 -12.155 1.00 0.00 C ATOM 1969 OG1 THR A 133 2.214 8.303 -13.441 1.00 0.00 O ATOM 1970 CG2 THR A 133 3.497 9.227 -11.621 1.00 0.00 C ATOM 0 HA THR A 133 1.870 7.072 -11.058 1.00 0.00 H new ATOM 0 HB THR A 133 1.563 9.866 -12.239 1.00 0.00 H new ATOM 0 HG1 THR A 133 1.382 7.826 -13.644 1.00 0.00 H new ATOM 0 HG21 THR A 133 4.022 9.878 -12.320 1.00 0.00 H new ATOM 0 HG22 THR A 133 3.415 9.724 -10.654 1.00 0.00 H new ATOM 0 HG23 THR A 133 4.052 8.296 -11.505 1.00 0.00 H new ATOM 1978 N VAL A 134 1.994 8.274 -8.871 1.00 0.00 N ATOM 1979 CA VAL A 134 1.972 8.885 -7.545 1.00 0.00 C ATOM 1980 C VAL A 134 3.328 9.485 -7.177 1.00 0.00 C ATOM 1981 O VAL A 134 4.378 9.044 -7.650 1.00 0.00 O ATOM 1982 CB VAL A 134 1.556 7.892 -6.433 1.00 0.00 C ATOM 1983 CG1 VAL A 134 0.101 7.477 -6.585 1.00 0.00 C ATOM 1984 CG2 VAL A 134 2.465 6.671 -6.416 1.00 0.00 C ATOM 0 H VAL A 134 2.676 7.523 -8.981 1.00 0.00 H new ATOM 0 HA VAL A 134 1.222 9.674 -7.606 1.00 0.00 H new ATOM 0 HB VAL A 134 1.664 8.405 -5.477 1.00 0.00 H new ATOM 0 HG11 VAL A 134 -0.163 6.779 -5.790 1.00 0.00 H new ATOM 0 HG12 VAL A 134 -0.537 8.358 -6.521 1.00 0.00 H new ATOM 0 HG13 VAL A 134 -0.041 6.995 -7.553 1.00 0.00 H new ATOM 0 HG21 VAL A 134 2.148 5.992 -5.624 1.00 0.00 H new ATOM 0 HG22 VAL A 134 2.406 6.160 -7.377 1.00 0.00 H new ATOM 0 HG23 VAL A 134 3.493 6.985 -6.234 1.00 0.00 H new ATOM 1994 N HIS A 135 3.271 10.515 -6.348 1.00 0.00 N ATOM 1995 CA HIS A 135 4.470 11.132 -5.794 1.00 0.00 C ATOM 1996 C HIS A 135 4.846 10.470 -4.476 1.00 0.00 C ATOM 1997 O HIS A 135 3.993 10.260 -3.613 1.00 0.00 O ATOM 1998 CB HIS A 135 4.270 12.634 -5.568 1.00 0.00 C ATOM 1999 CG HIS A 135 4.137 13.429 -6.827 1.00 0.00 C ATOM 2000 ND1 HIS A 135 5.206 14.038 -7.448 1.00 0.00 N ATOM 2001 CD2 HIS A 135 3.053 13.722 -7.581 1.00 0.00 C ATOM 2002 CE1 HIS A 135 4.787 14.667 -8.526 1.00 0.00 C ATOM 2003 NE2 HIS A 135 3.486 14.491 -8.631 1.00 0.00 N ATOM 0 H HIS A 135 2.399 10.946 -6.040 1.00 0.00 H new ATOM 0 HA HIS A 135 5.275 10.993 -6.516 1.00 0.00 H new ATOM 0 HB2 HIS A 135 3.377 12.783 -4.961 1.00 0.00 H new ATOM 0 HB3 HIS A 135 5.113 13.020 -4.995 1.00 0.00 H new ATOM 0 HD2 HIS A 135 2.037 13.409 -7.392 1.00 0.00 H new ATOM 0 HE1 HIS A 135 5.405 15.231 -9.208 1.00 0.00 H new ATOM 0 HE2 HIS A 135 2.896 14.866 -9.373 1.00 0.00 H new ATOM 2012 N PHE A 136 6.127 10.175 -4.313 1.00 0.00 N ATOM 2013 CA PHE A 136 6.618 9.492 -3.130 1.00 0.00 C ATOM 2014 C PHE A 136 7.654 10.327 -2.409 1.00 0.00 C ATOM 2015 O PHE A 136 8.646 10.743 -3.002 1.00 0.00 O ATOM 2016 CB PHE A 136 7.265 8.167 -3.495 1.00 0.00 C ATOM 2017 CG PHE A 136 6.378 6.993 -3.282 1.00 0.00 C ATOM 2018 CD1 PHE A 136 6.272 6.427 -2.027 1.00 0.00 C ATOM 2019 CD2 PHE A 136 5.655 6.456 -4.325 1.00 0.00 C ATOM 2020 CE1 PHE A 136 5.454 5.337 -1.814 1.00 0.00 C ATOM 2021 CE2 PHE A 136 4.837 5.368 -4.124 1.00 0.00 C ATOM 2022 CZ PHE A 136 4.735 4.804 -2.866 1.00 0.00 C ATOM 0 H PHE A 136 6.851 10.402 -4.995 1.00 0.00 H new ATOM 0 HA PHE A 136 5.756 9.325 -2.484 1.00 0.00 H new ATOM 0 HB2 PHE A 136 7.569 8.197 -4.541 1.00 0.00 H new ATOM 0 HB3 PHE A 136 8.171 8.039 -2.903 1.00 0.00 H new ATOM 0 HD1 PHE A 136 6.835 6.842 -1.204 1.00 0.00 H new ATOM 0 HD2 PHE A 136 5.731 6.893 -5.310 1.00 0.00 H new ATOM 0 HE1 PHE A 136 5.376 4.902 -0.829 1.00 0.00 H new ATOM 0 HE2 PHE A 136 4.275 4.955 -4.949 1.00 0.00 H new ATOM 0 HZ PHE A 136 4.095 3.949 -2.706 1.00 0.00 H new ATOM 2032 N ASP A 137 7.428 10.562 -1.135 1.00 0.00 N ATOM 2033 CA ASP A 137 8.448 11.142 -0.282 1.00 0.00 C ATOM 2034 C ASP A 137 8.869 10.102 0.742 1.00 0.00 C ATOM 2035 O ASP A 137 8.102 9.774 1.639 1.00 0.00 O ATOM 2036 CB ASP A 137 7.928 12.404 0.407 1.00 0.00 C ATOM 2037 CG ASP A 137 8.996 13.096 1.226 1.00 0.00 C ATOM 2038 OD1 ASP A 137 9.949 13.641 0.630 1.00 0.00 O ATOM 2039 OD2 ASP A 137 8.890 13.101 2.469 1.00 0.00 O ATOM 0 H ASP A 137 6.546 10.361 -0.664 1.00 0.00 H new ATOM 0 HA ASP A 137 9.308 11.433 -0.885 1.00 0.00 H new ATOM 0 HB2 ASP A 137 7.547 13.094 -0.345 1.00 0.00 H new ATOM 0 HB3 ASP A 137 7.090 12.143 1.054 1.00 0.00 H new ATOM 2044 N ILE A 138 10.082 9.586 0.602 1.00 0.00 N ATOM 2045 CA ILE A 138 10.527 8.428 1.378 1.00 0.00 C ATOM 2046 C ILE A 138 11.738 8.773 2.243 1.00 0.00 C ATOM 2047 O ILE A 138 12.776 9.203 1.729 1.00 0.00 O ATOM 2048 CB ILE A 138 10.909 7.249 0.449 1.00 0.00 C ATOM 2049 CG1 ILE A 138 9.696 6.763 -0.341 1.00 0.00 C ATOM 2050 CG2 ILE A 138 11.527 6.099 1.238 1.00 0.00 C ATOM 2051 CD1 ILE A 138 8.600 6.213 0.521 1.00 0.00 C ATOM 0 H ILE A 138 10.782 9.951 -0.044 1.00 0.00 H new ATOM 0 HA ILE A 138 9.693 8.138 2.017 1.00 0.00 H new ATOM 0 HB ILE A 138 11.656 7.614 -0.256 1.00 0.00 H new ATOM 0 HG12 ILE A 138 9.302 7.590 -0.931 1.00 0.00 H new ATOM 0 HG13 ILE A 138 10.015 5.993 -1.044 1.00 0.00 H new ATOM 0 HG21 ILE A 138 11.784 5.287 0.557 1.00 0.00 H new ATOM 0 HG22 ILE A 138 12.428 6.447 1.744 1.00 0.00 H new ATOM 0 HG23 ILE A 138 10.812 5.739 1.978 1.00 0.00 H new ATOM 0 HD11 ILE A 138 7.771 5.887 -0.108 1.00 0.00 H new ATOM 0 HD12 ILE A 138 8.977 5.365 1.092 1.00 0.00 H new ATOM 0 HD13 ILE A 138 8.253 6.986 1.206 1.00 0.00 H new ATOM 2063 N GLU A 139 11.606 8.600 3.553 1.00 0.00 N ATOM 2064 CA GLU A 139 12.729 8.757 4.465 1.00 0.00 C ATOM 2065 C GLU A 139 13.194 7.415 4.999 1.00 0.00 C ATOM 2066 O GLU A 139 12.453 6.731 5.707 1.00 0.00 O ATOM 2067 CB GLU A 139 12.331 9.649 5.631 1.00 0.00 C ATOM 2068 CG GLU A 139 12.158 11.091 5.232 1.00 0.00 C ATOM 2069 CD GLU A 139 11.461 11.920 6.291 1.00 0.00 C ATOM 2070 OE1 GLU A 139 10.213 11.936 6.322 1.00 0.00 O ATOM 2071 OE2 GLU A 139 12.158 12.584 7.088 1.00 0.00 O ATOM 0 H GLU A 139 10.728 8.350 4.007 1.00 0.00 H new ATOM 0 HA GLU A 139 13.548 9.215 3.911 1.00 0.00 H new ATOM 0 HB2 GLU A 139 11.399 9.282 6.061 1.00 0.00 H new ATOM 0 HB3 GLU A 139 13.091 9.581 6.410 1.00 0.00 H new ATOM 0 HG2 GLU A 139 13.136 11.525 5.025 1.00 0.00 H new ATOM 0 HG3 GLU A 139 11.585 11.140 4.306 1.00 0.00 H new ATOM 2078 N VAL A 140 14.416 7.040 4.658 1.00 0.00 N ATOM 2079 CA VAL A 140 15.004 5.813 5.193 1.00 0.00 C ATOM 2080 C VAL A 140 15.334 5.989 6.671 1.00 0.00 C ATOM 2081 O VAL A 140 16.281 6.696 7.024 1.00 0.00 O ATOM 2082 CB VAL A 140 16.300 5.413 4.459 1.00 0.00 C ATOM 2083 CG1 VAL A 140 16.803 4.067 4.960 1.00 0.00 C ATOM 2084 CG2 VAL A 140 16.089 5.373 2.958 1.00 0.00 C ATOM 0 H VAL A 140 15.019 7.559 4.020 1.00 0.00 H new ATOM 0 HA VAL A 140 14.263 5.026 5.049 1.00 0.00 H new ATOM 0 HB VAL A 140 17.054 6.170 4.674 1.00 0.00 H new ATOM 0 HG11 VAL A 140 17.718 3.801 4.431 1.00 0.00 H new ATOM 0 HG12 VAL A 140 17.007 4.130 6.029 1.00 0.00 H new ATOM 0 HG13 VAL A 140 16.045 3.305 4.779 1.00 0.00 H new ATOM 0 HG21 VAL A 140 17.020 5.088 2.467 1.00 0.00 H new ATOM 0 HG22 VAL A 140 15.315 4.644 2.719 1.00 0.00 H new ATOM 0 HG23 VAL A 140 15.781 6.358 2.608 1.00 0.00 H new ATOM 2094 N LEU A 141 14.557 5.351 7.532 1.00 0.00 N ATOM 2095 CA LEU A 141 14.787 5.448 8.965 1.00 0.00 C ATOM 2096 C LEU A 141 15.643 4.280 9.438 1.00 0.00 C ATOM 2097 O LEU A 141 16.635 4.468 10.140 1.00 0.00 O ATOM 2098 CB LEU A 141 13.457 5.455 9.717 1.00 0.00 C ATOM 2099 CG LEU A 141 12.424 6.469 9.233 1.00 0.00 C ATOM 2100 CD1 LEU A 141 11.203 6.421 10.133 1.00 0.00 C ATOM 2101 CD2 LEU A 141 13.007 7.879 9.186 1.00 0.00 C ATOM 0 H LEU A 141 13.766 4.764 7.266 1.00 0.00 H new ATOM 0 HA LEU A 141 15.312 6.381 9.170 1.00 0.00 H new ATOM 0 HB2 LEU A 141 13.019 4.459 9.651 1.00 0.00 H new ATOM 0 HB3 LEU A 141 13.659 5.645 10.771 1.00 0.00 H new ATOM 0 HG LEU A 141 12.130 6.206 8.217 1.00 0.00 H new ATOM 0 HD11 LEU A 141 10.466 7.146 9.786 1.00 0.00 H new ATOM 0 HD12 LEU A 141 10.770 5.421 10.105 1.00 0.00 H new ATOM 0 HD13 LEU A 141 11.495 6.662 11.155 1.00 0.00 H new ATOM 0 HD21 LEU A 141 12.245 8.576 8.837 1.00 0.00 H new ATOM 0 HD22 LEU A 141 13.336 8.170 10.184 1.00 0.00 H new ATOM 0 HD23 LEU A 141 13.857 7.899 8.504 1.00 0.00 H new ATOM 2113 N GLU A 142 15.245 3.076 9.048 1.00 0.00 N ATOM 2114 CA GLU A 142 16.044 1.877 9.280 1.00 0.00 C ATOM 2115 C GLU A 142 15.906 0.932 8.107 1.00 0.00 C ATOM 2116 O GLU A 142 14.990 1.064 7.298 1.00 0.00 O ATOM 2117 CB GLU A 142 15.638 1.141 10.557 1.00 0.00 C ATOM 2118 CG GLU A 142 15.993 1.881 11.824 1.00 0.00 C ATOM 2119 CD GLU A 142 15.836 1.036 13.070 1.00 0.00 C ATOM 2120 OE1 GLU A 142 16.756 0.244 13.372 1.00 0.00 O ATOM 2121 OE2 GLU A 142 14.804 1.169 13.762 1.00 0.00 O ATOM 0 H GLU A 142 14.364 2.902 8.564 1.00 0.00 H new ATOM 0 HA GLU A 142 17.078 2.202 9.393 1.00 0.00 H new ATOM 0 HB2 GLU A 142 14.562 0.966 10.538 1.00 0.00 H new ATOM 0 HB3 GLU A 142 16.120 0.163 10.571 1.00 0.00 H new ATOM 0 HG2 GLU A 142 17.023 2.230 11.757 1.00 0.00 H new ATOM 0 HG3 GLU A 142 15.361 2.765 11.910 1.00 0.00 H new ATOM 2128 N ILE A 143 16.816 -0.013 8.013 1.00 0.00 N ATOM 2129 CA ILE A 143 16.773 -1.001 6.950 1.00 0.00 C ATOM 2130 C ILE A 143 16.744 -2.409 7.530 1.00 0.00 C ATOM 2131 O ILE A 143 17.719 -2.873 8.118 1.00 0.00 O ATOM 2132 CB ILE A 143 17.971 -0.830 5.992 1.00 0.00 C ATOM 2133 CG1 ILE A 143 17.879 0.536 5.307 1.00 0.00 C ATOM 2134 CG2 ILE A 143 18.018 -1.950 4.957 1.00 0.00 C ATOM 2135 CD1 ILE A 143 19.136 0.943 4.578 1.00 0.00 C ATOM 0 H ILE A 143 17.597 -0.121 8.660 1.00 0.00 H new ATOM 0 HA ILE A 143 15.858 -0.846 6.378 1.00 0.00 H new ATOM 0 HB ILE A 143 18.893 -0.884 6.570 1.00 0.00 H new ATOM 0 HG12 ILE A 143 17.050 0.521 4.600 1.00 0.00 H new ATOM 0 HG13 ILE A 143 17.645 1.292 6.057 1.00 0.00 H new ATOM 0 HG21 ILE A 143 18.873 -1.800 4.298 1.00 0.00 H new ATOM 0 HG22 ILE A 143 18.114 -2.910 5.464 1.00 0.00 H new ATOM 0 HG23 ILE A 143 17.100 -1.941 4.369 1.00 0.00 H new ATOM 0 HD11 ILE A 143 18.990 1.921 4.120 1.00 0.00 H new ATOM 0 HD12 ILE A 143 19.966 0.992 5.283 1.00 0.00 H new ATOM 0 HD13 ILE A 143 19.361 0.210 3.804 1.00 0.00 H new ATOM 2147 N ASP A 144 15.600 -3.062 7.385 1.00 0.00 N ATOM 2148 CA ASP A 144 15.415 -4.430 7.852 1.00 0.00 C ATOM 2149 C ASP A 144 16.049 -5.407 6.871 1.00 0.00 C ATOM 2150 O ASP A 144 15.582 -5.556 5.739 1.00 0.00 O ATOM 2151 CB ASP A 144 13.924 -4.739 8.018 1.00 0.00 C ATOM 2152 CG ASP A 144 13.666 -6.165 8.474 1.00 0.00 C ATOM 2153 OD1 ASP A 144 13.813 -6.442 9.685 1.00 0.00 O ATOM 2154 OD2 ASP A 144 13.314 -7.015 7.631 1.00 0.00 O ATOM 0 H ASP A 144 14.774 -2.660 6.941 1.00 0.00 H new ATOM 0 HA ASP A 144 15.902 -4.538 8.821 1.00 0.00 H new ATOM 0 HB2 ASP A 144 13.493 -4.047 8.741 1.00 0.00 H new ATOM 0 HB3 ASP A 144 13.414 -4.568 7.070 1.00 0.00 H new ATOM 2159 N PRO A 145 17.127 -6.081 7.279 1.00 0.00 N ATOM 2160 CA PRO A 145 17.849 -6.997 6.402 1.00 0.00 C ATOM 2161 C PRO A 145 17.022 -8.228 6.066 1.00 0.00 C ATOM 2162 O PRO A 145 16.239 -8.710 6.887 1.00 0.00 O ATOM 2163 CB PRO A 145 19.079 -7.382 7.220 1.00 0.00 C ATOM 2164 CG PRO A 145 18.665 -7.189 8.635 1.00 0.00 C ATOM 2165 CD PRO A 145 17.718 -6.023 8.626 1.00 0.00 C ATOM 0 HA PRO A 145 18.093 -6.542 5.442 1.00 0.00 H new ATOM 0 HB2 PRO A 145 19.374 -8.414 7.031 1.00 0.00 H new ATOM 0 HB3 PRO A 145 19.934 -6.755 6.968 1.00 0.00 H new ATOM 0 HG2 PRO A 145 18.181 -8.084 9.027 1.00 0.00 H new ATOM 0 HG3 PRO A 145 19.527 -6.988 9.271 1.00 0.00 H new ATOM 0 HD2 PRO A 145 16.959 -6.114 9.403 1.00 0.00 H new ATOM 0 HD3 PRO A 145 18.238 -5.080 8.798 1.00 0.00 H new