USER MOD reduce.3.24.130724 H: found=0, std=0, add=1133, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1136 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 114 SER OG : rot -69:sc= 0.768 USER MOD Set 1.2: A 119 MET CE :methyl -143:sc= -3.55! (180deg=-5.96!) USER MOD Set 2.1: A 75 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 78 THR OG1 : rot 65:sc= 2 USER MOD Set 3.1: A 19 GLN : amide:sc= 0.822 K(o=2,f=-3.7) USER MOD Set 3.2: A 20 LYS NZ :NH3+ -168:sc= 1.18 (180deg=-0.212) USER MOD Single : A 4 SER OG : rot -37:sc= 0.376 USER MOD Single : A 5 ASN : amide:sc= 0.113 K(o=0.11,f=-3!) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 SER OG : rot -76:sc= 0.6 USER MOD Single : A 22 TYR OH : rot -174:sc= 0.708 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 180:sc= 0.0356 USER MOD Single : A 26 GLN : amide:sc= -0.0182 K(o=-0.018,f=-0.57) USER MOD Single : A 43 SER OG : rot 175:sc= 0.972 USER MOD Single : A 47 LYS NZ :NH3+ 174:sc= 1.09 (180deg=1.02) USER MOD Single : A 48 GLN : amide:sc= -2.02! C(o=-2!,f=-13!) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 SER OG : rot 70:sc= 1.12 USER MOD Single : A 69 THR OG1 : rot -96:sc= 1.29 USER MOD Single : A 70 SER OG : rot 79:sc= 1.23 USER MOD Single : A 71 GLN : amide:sc= -3.34! K(o=-3.3!,f=-0.41) USER MOD Single : A 73 HIS : no HD1:sc= -0.0144 X(o=-0.014,f=0) USER MOD Single : A 80 TYR OH : rot 180:sc= 0 USER MOD Single : A 81 GLN : amide:sc= -1.1 K(o=-1.1,f=-0.23) USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 85 GLN : amide:sc= -0.429 X(o=-0.43,f=-0.31) USER MOD Single : A 88 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 96 ASN : amide:sc= -0.892 K(o=-0.89,f=0) USER MOD Single : A 105 SER OG : rot 73:sc= 1.11 USER MOD Single : A 111 CYS SG : rot -80:sc= -0.881 USER MOD Single : A 117 LYS NZ :NH3+ -169:sc= -0.0239 (180deg=-0.214) USER MOD Single : A 120 GLN : amide:sc= 0 X(o=0,f=-0.49) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 130 MET CE :methyl 172:sc= -3.31! (180deg=-3.72!) USER MOD Single : A 132 THR OG1 : rot 73:sc= 0.966 USER MOD Single : A 133 TYR OH : rot 68:sc= 0.454 USER MOD Single : A 135 ASN : amide:sc= 0 X(o=0,f=-0.26) USER MOD Single : A 137 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 143 GLN : amide:sc= 0.307 X(o=0.31,f=-0.089) USER MOD Single : A 145 ASN : amide:sc= 0.618 K(o=0.62,f=0) USER MOD Single : A 150 THR OG1 : rot -140:sc= 0 USER MOD Single : A 157 ASN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : A 158 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 163 SER OG : rot 76:sc= 0.00393 USER MOD Single : A 165 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0265) USER MOD Single : A 167 GLN : amide:sc= -0.0496 K(o=-0.05,f=-0.69) USER MOD ----------------------------------------------------------------- ATOM 48 N SER A 4 4.854 -0.744 13.596 1.00 0.88 N ATOM 49 CA SER A 4 3.676 -1.048 12.794 1.00 0.77 C ATOM 50 C SER A 4 3.917 -0.706 11.324 1.00 0.62 C ATOM 51 O SER A 4 3.315 -1.296 10.429 1.00 0.64 O ATOM 52 CB SER A 4 2.473 -0.275 13.339 1.00 1.02 C ATOM 53 OG SER A 4 2.841 1.055 13.681 1.00 1.34 O ATOM 0 HA SER A 4 3.471 -2.117 12.857 1.00 0.77 H new ATOM 0 HB2 SER A 4 1.678 -0.257 12.593 1.00 1.02 H new ATOM 0 HB3 SER A 4 2.075 -0.784 14.217 1.00 1.02 H new ATOM 0 HG SER A 4 3.743 1.056 14.065 1.00 1.34 H new ATOM 59 N ASN A 5 4.826 0.234 11.078 1.00 0.59 N ATOM 60 CA ASN A 5 5.150 0.638 9.712 1.00 0.55 C ATOM 61 C ASN A 5 5.880 -0.479 8.976 1.00 0.43 C ATOM 62 O ASN A 5 5.801 -0.585 7.752 1.00 0.44 O ATOM 63 CB ASN A 5 5.987 1.924 9.704 1.00 0.65 C ATOM 64 CG ASN A 5 5.154 3.155 10.034 1.00 0.94 C ATOM 65 OD1 ASN A 5 3.959 3.206 9.738 1.00 1.71 O ATOM 66 ND2 ASN A 5 5.770 4.162 10.640 1.00 0.67 N ATOM 0 H ASN A 5 5.349 0.728 11.802 1.00 0.59 H new ATOM 0 HA ASN A 5 4.214 0.838 9.191 1.00 0.55 H new ATOM 0 HB2 ASN A 5 6.798 1.832 10.426 1.00 0.65 H new ATOM 0 HB3 ASN A 5 6.446 2.050 8.724 1.00 0.65 H new ATOM 0 HD21 ASN A 5 5.253 5.009 10.874 1.00 0.67 H new ATOM 0 HD22 ASN A 5 6.761 4.089 10.872 1.00 0.67 H new ATOM 73 N ARG A 6 6.576 -1.328 9.727 1.00 0.41 N ATOM 74 CA ARG A 6 7.254 -2.475 9.146 1.00 0.41 C ATOM 75 C ARG A 6 6.225 -3.507 8.681 1.00 0.37 C ATOM 76 O ARG A 6 6.455 -4.237 7.716 1.00 0.38 O ATOM 77 CB ARG A 6 8.221 -3.093 10.164 1.00 0.54 C ATOM 78 CG ARG A 6 9.056 -4.233 9.599 1.00 0.65 C ATOM 79 CD ARG A 6 10.129 -4.692 10.578 1.00 0.83 C ATOM 80 NE ARG A 6 9.572 -5.222 11.825 1.00 1.50 N ATOM 81 CZ ARG A 6 10.143 -5.053 13.021 1.00 2.14 C ATOM 82 NH1 ARG A 6 11.241 -4.319 13.138 1.00 2.16 N ATOM 83 NH2 ARG A 6 9.618 -5.617 14.100 1.00 3.18 N ATOM 0 H ARG A 6 6.683 -1.241 10.738 1.00 0.41 H new ATOM 0 HA ARG A 6 7.833 -2.147 8.282 1.00 0.41 H new ATOM 0 HB2 ARG A 6 8.888 -2.316 10.537 1.00 0.54 H new ATOM 0 HB3 ARG A 6 7.651 -3.460 11.017 1.00 0.54 H new ATOM 0 HG2 ARG A 6 8.405 -5.072 9.354 1.00 0.65 H new ATOM 0 HG3 ARG A 6 9.526 -3.912 8.669 1.00 0.65 H new ATOM 0 HD2 ARG A 6 10.742 -5.459 10.105 1.00 0.83 H new ATOM 0 HD3 ARG A 6 10.788 -3.854 10.807 1.00 0.83 H new ATOM 0 HE ARG A 6 8.700 -5.749 11.778 1.00 1.50 H new ATOM 0 HH11 ARG A 6 11.652 -3.881 12.313 1.00 2.16 H new ATOM 0 HH12 ARG A 6 11.674 -4.192 14.053 1.00 2.16 H new ATOM 0 HH21 ARG A 6 8.774 -6.184 14.020 1.00 3.18 H new ATOM 0 HH22 ARG A 6 10.059 -5.484 15.010 1.00 3.18 H new ATOM 97 N GLU A 7 5.078 -3.539 9.359 1.00 0.36 N ATOM 98 CA GLU A 7 3.995 -4.454 9.001 1.00 0.37 C ATOM 99 C GLU A 7 3.423 -4.084 7.645 1.00 0.29 C ATOM 100 O GLU A 7 3.123 -4.950 6.824 1.00 0.29 O ATOM 101 CB GLU A 7 2.861 -4.402 10.027 1.00 0.46 C ATOM 102 CG GLU A 7 3.265 -4.754 11.447 1.00 0.60 C ATOM 103 CD GLU A 7 2.065 -4.798 12.370 1.00 1.39 C ATOM 104 OE1 GLU A 7 1.717 -3.751 12.954 1.00 2.00 O ATOM 105 OE2 GLU A 7 1.452 -5.881 12.490 1.00 1.58 O ATOM 0 H GLU A 7 4.875 -2.941 10.160 1.00 0.36 H new ATOM 0 HA GLU A 7 4.415 -5.460 8.977 1.00 0.37 H new ATOM 0 HB2 GLU A 7 2.435 -3.399 10.025 1.00 0.46 H new ATOM 0 HB3 GLU A 7 2.072 -5.084 9.710 1.00 0.46 H new ATOM 0 HG2 GLU A 7 3.767 -5.722 11.454 1.00 0.60 H new ATOM 0 HG3 GLU A 7 3.982 -4.020 11.815 1.00 0.60 H new ATOM 112 N LEU A 8 3.291 -2.782 7.421 1.00 0.27 N ATOM 113 CA LEU A 8 2.676 -2.255 6.211 1.00 0.28 C ATOM 114 C LEU A 8 3.500 -2.626 4.995 1.00 0.28 C ATOM 115 O LEU A 8 2.996 -2.681 3.879 1.00 0.39 O ATOM 116 CB LEU A 8 2.543 -0.736 6.314 1.00 0.31 C ATOM 117 CG LEU A 8 1.868 -0.240 7.587 1.00 0.33 C ATOM 118 CD1 LEU A 8 1.741 1.272 7.563 1.00 0.36 C ATOM 119 CD2 LEU A 8 0.506 -0.897 7.749 1.00 0.35 C ATOM 0 H LEU A 8 3.607 -2.064 8.073 1.00 0.27 H new ATOM 0 HA LEU A 8 1.683 -2.692 6.103 1.00 0.28 H new ATOM 0 HB2 LEU A 8 3.537 -0.293 6.250 1.00 0.31 H new ATOM 0 HB3 LEU A 8 1.977 -0.376 5.455 1.00 0.31 H new ATOM 0 HG LEU A 8 2.484 -0.515 8.443 1.00 0.33 H new ATOM 0 HD11 LEU A 8 1.257 1.611 8.479 1.00 0.36 H new ATOM 0 HD12 LEU A 8 2.732 1.719 7.489 1.00 0.36 H new ATOM 0 HD13 LEU A 8 1.142 1.573 6.703 1.00 0.36 H new ATOM 0 HD21 LEU A 8 0.034 -0.535 8.662 1.00 0.35 H new ATOM 0 HD22 LEU A 8 -0.122 -0.649 6.893 1.00 0.35 H new ATOM 0 HD23 LEU A 8 0.628 -1.978 7.808 1.00 0.35 H new ATOM 131 N VAL A 9 4.775 -2.869 5.228 1.00 0.26 N ATOM 132 CA VAL A 9 5.663 -3.328 4.188 1.00 0.28 C ATOM 133 C VAL A 9 5.622 -4.849 4.090 1.00 0.29 C ATOM 134 O VAL A 9 5.146 -5.398 3.102 1.00 0.31 O ATOM 135 CB VAL A 9 7.104 -2.879 4.465 1.00 0.32 C ATOM 136 CG1 VAL A 9 8.022 -3.354 3.358 1.00 0.38 C ATOM 137 CG2 VAL A 9 7.170 -1.369 4.613 1.00 0.31 C ATOM 0 H VAL A 9 5.219 -2.753 6.139 1.00 0.26 H new ATOM 0 HA VAL A 9 5.329 -2.893 3.246 1.00 0.28 H new ATOM 0 HB VAL A 9 7.437 -3.326 5.402 1.00 0.32 H new ATOM 0 HG11 VAL A 9 9.041 -3.029 3.566 1.00 0.38 H new ATOM 0 HG12 VAL A 9 7.992 -4.442 3.302 1.00 0.38 H new ATOM 0 HG13 VAL A 9 7.694 -2.933 2.408 1.00 0.38 H new ATOM 0 HG21 VAL A 9 8.199 -1.067 4.809 1.00 0.31 H new ATOM 0 HG22 VAL A 9 6.823 -0.898 3.694 1.00 0.31 H new ATOM 0 HG23 VAL A 9 6.536 -1.057 5.443 1.00 0.31 H new ATOM 147 N VAL A 10 6.103 -5.514 5.140 1.00 0.30 N ATOM 148 CA VAL A 10 6.240 -6.969 5.160 1.00 0.32 C ATOM 149 C VAL A 10 4.951 -7.673 4.756 1.00 0.35 C ATOM 150 O VAL A 10 4.942 -8.478 3.822 1.00 0.36 O ATOM 151 CB VAL A 10 6.671 -7.457 6.555 1.00 0.37 C ATOM 152 CG1 VAL A 10 6.645 -8.974 6.632 1.00 0.42 C ATOM 153 CG2 VAL A 10 8.059 -6.937 6.889 1.00 0.38 C ATOM 0 H VAL A 10 6.408 -5.059 6.000 1.00 0.30 H new ATOM 0 HA VAL A 10 7.009 -7.221 4.429 1.00 0.32 H new ATOM 0 HB VAL A 10 5.962 -7.067 7.286 1.00 0.37 H new ATOM 0 HG11 VAL A 10 6.954 -9.293 7.628 1.00 0.42 H new ATOM 0 HG12 VAL A 10 5.634 -9.331 6.433 1.00 0.42 H new ATOM 0 HG13 VAL A 10 7.328 -9.388 5.890 1.00 0.42 H new ATOM 0 HG21 VAL A 10 8.351 -7.290 7.878 1.00 0.38 H new ATOM 0 HG22 VAL A 10 8.772 -7.301 6.149 1.00 0.38 H new ATOM 0 HG23 VAL A 10 8.051 -5.847 6.880 1.00 0.38 H new ATOM 163 N ASP A 11 3.864 -7.368 5.449 1.00 0.39 N ATOM 164 CA ASP A 11 2.603 -8.061 5.210 1.00 0.46 C ATOM 165 C ASP A 11 2.063 -7.722 3.825 1.00 0.44 C ATOM 166 O ASP A 11 1.327 -8.506 3.228 1.00 0.50 O ATOM 167 CB ASP A 11 1.566 -7.704 6.279 1.00 0.55 C ATOM 168 CG ASP A 11 0.422 -8.700 6.325 1.00 0.71 C ATOM 169 OD1 ASP A 11 -0.572 -8.505 5.597 1.00 0.84 O ATOM 170 OD2 ASP A 11 0.514 -9.694 7.077 1.00 0.92 O ATOM 0 H ASP A 11 3.827 -6.653 6.175 1.00 0.39 H new ATOM 0 HA ASP A 11 2.795 -9.133 5.264 1.00 0.46 H new ATOM 0 HB2 ASP A 11 2.051 -7.665 7.254 1.00 0.55 H new ATOM 0 HB3 ASP A 11 1.170 -6.708 6.080 1.00 0.55 H new ATOM 175 N PHE A 12 2.443 -6.561 3.306 1.00 0.41 N ATOM 176 CA PHE A 12 2.007 -6.149 1.975 1.00 0.42 C ATOM 177 C PHE A 12 2.807 -6.893 0.913 1.00 0.37 C ATOM 178 O PHE A 12 2.258 -7.330 -0.100 1.00 0.41 O ATOM 179 CB PHE A 12 2.158 -4.635 1.782 1.00 0.44 C ATOM 180 CG PHE A 12 1.391 -4.103 0.603 1.00 0.48 C ATOM 181 CD1 PHE A 12 0.073 -3.705 0.750 1.00 0.62 C ATOM 182 CD2 PHE A 12 1.982 -4.006 -0.649 1.00 0.46 C ATOM 183 CE1 PHE A 12 -0.644 -3.221 -0.328 1.00 0.68 C ATOM 184 CE2 PHE A 12 1.269 -3.521 -1.731 1.00 0.51 C ATOM 185 CZ PHE A 12 -0.044 -3.130 -1.570 1.00 0.60 C ATOM 0 H PHE A 12 3.048 -5.891 3.781 1.00 0.41 H new ATOM 0 HA PHE A 12 0.951 -6.397 1.873 1.00 0.42 H new ATOM 0 HB2 PHE A 12 1.821 -4.126 2.685 1.00 0.44 H new ATOM 0 HB3 PHE A 12 3.214 -4.396 1.657 1.00 0.44 H new ATOM 0 HD1 PHE A 12 -0.400 -3.774 1.718 1.00 0.62 H new ATOM 0 HD2 PHE A 12 3.009 -4.312 -0.780 1.00 0.46 H new ATOM 0 HE1 PHE A 12 -1.672 -2.914 -0.200 1.00 0.68 H new ATOM 0 HE2 PHE A 12 1.740 -3.449 -2.700 1.00 0.51 H new ATOM 0 HZ PHE A 12 -0.603 -2.753 -2.414 1.00 0.60 H new ATOM 195 N LEU A 13 4.104 -7.051 1.155 1.00 0.33 N ATOM 196 CA LEU A 13 4.955 -7.794 0.239 1.00 0.32 C ATOM 197 C LEU A 13 4.527 -9.252 0.230 1.00 0.33 C ATOM 198 O LEU A 13 4.449 -9.888 -0.819 1.00 0.35 O ATOM 199 CB LEU A 13 6.429 -7.676 0.642 1.00 0.32 C ATOM 200 CG LEU A 13 6.927 -6.250 0.894 1.00 0.34 C ATOM 201 CD1 LEU A 13 8.435 -6.232 1.069 1.00 0.40 C ATOM 202 CD2 LEU A 13 6.505 -5.321 -0.234 1.00 0.38 C ATOM 0 H LEU A 13 4.585 -6.676 1.973 1.00 0.33 H new ATOM 0 HA LEU A 13 4.848 -7.375 -0.761 1.00 0.32 H new ATOM 0 HB2 LEU A 13 6.590 -8.264 1.546 1.00 0.32 H new ATOM 0 HB3 LEU A 13 7.040 -8.123 -0.142 1.00 0.32 H new ATOM 0 HG LEU A 13 6.471 -5.890 1.816 1.00 0.34 H new ATOM 0 HD11 LEU A 13 8.768 -5.210 1.247 1.00 0.40 H new ATOM 0 HD12 LEU A 13 8.710 -6.857 1.919 1.00 0.40 H new ATOM 0 HD13 LEU A 13 8.911 -6.617 0.167 1.00 0.40 H new ATOM 0 HD21 LEU A 13 6.870 -4.314 -0.032 1.00 0.38 H new ATOM 0 HD22 LEU A 13 6.924 -5.677 -1.175 1.00 0.38 H new ATOM 0 HD23 LEU A 13 5.417 -5.305 -0.304 1.00 0.38 H new ATOM 214 N SER A 14 4.212 -9.762 1.415 1.00 0.34 N ATOM 215 CA SER A 14 3.718 -11.122 1.561 1.00 0.38 C ATOM 216 C SER A 14 2.364 -11.273 0.865 1.00 0.39 C ATOM 217 O SER A 14 2.049 -12.334 0.337 1.00 0.41 O ATOM 218 CB SER A 14 3.603 -11.491 3.045 1.00 0.45 C ATOM 219 OG SER A 14 3.183 -12.834 3.212 1.00 1.14 O ATOM 0 H SER A 14 4.291 -9.249 2.293 1.00 0.34 H new ATOM 0 HA SER A 14 4.427 -11.803 1.090 1.00 0.38 H new ATOM 0 HB2 SER A 14 4.567 -11.346 3.533 1.00 0.45 H new ATOM 0 HB3 SER A 14 2.894 -10.823 3.534 1.00 0.45 H new ATOM 0 HG SER A 14 3.120 -13.041 4.168 1.00 1.14 H new ATOM 225 N TYR A 15 1.590 -10.190 0.841 1.00 0.42 N ATOM 226 CA TYR A 15 0.274 -10.183 0.202 1.00 0.47 C ATOM 227 C TYR A 15 0.415 -10.341 -1.309 1.00 0.45 C ATOM 228 O TYR A 15 -0.434 -10.944 -1.970 1.00 0.52 O ATOM 229 CB TYR A 15 -0.469 -8.882 0.544 1.00 0.55 C ATOM 230 CG TYR A 15 -1.774 -8.679 -0.202 1.00 0.66 C ATOM 231 CD1 TYR A 15 -2.842 -9.552 -0.036 1.00 0.79 C ATOM 232 CD2 TYR A 15 -1.938 -7.601 -1.066 1.00 0.78 C ATOM 233 CE1 TYR A 15 -4.033 -9.360 -0.711 1.00 0.96 C ATOM 234 CE2 TYR A 15 -3.125 -7.404 -1.743 1.00 0.94 C ATOM 235 CZ TYR A 15 -4.168 -8.286 -1.563 1.00 1.02 C ATOM 236 OH TYR A 15 -5.356 -8.088 -2.234 1.00 1.20 O ATOM 0 H TYR A 15 1.854 -9.298 1.260 1.00 0.42 H new ATOM 0 HA TYR A 15 -0.306 -11.025 0.580 1.00 0.47 H new ATOM 0 HB2 TYR A 15 -0.673 -8.867 1.615 1.00 0.55 H new ATOM 0 HB3 TYR A 15 0.189 -8.039 0.333 1.00 0.55 H new ATOM 0 HD1 TYR A 15 -2.740 -10.395 0.632 1.00 0.79 H new ATOM 0 HD2 TYR A 15 -1.123 -6.907 -1.210 1.00 0.78 H new ATOM 0 HE1 TYR A 15 -4.853 -10.048 -0.571 1.00 0.96 H new ATOM 0 HE2 TYR A 15 -3.235 -6.562 -2.411 1.00 0.94 H new ATOM 0 HH TYR A 15 -5.286 -7.286 -2.793 1.00 1.20 H new ATOM 246 N LYS A 16 1.496 -9.804 -1.851 1.00 0.40 N ATOM 247 CA LYS A 16 1.775 -9.935 -3.268 1.00 0.41 C ATOM 248 C LYS A 16 2.407 -11.287 -3.560 1.00 0.35 C ATOM 249 O LYS A 16 2.052 -11.950 -4.535 1.00 0.39 O ATOM 250 CB LYS A 16 2.691 -8.806 -3.738 1.00 0.49 C ATOM 251 CG LYS A 16 2.003 -7.452 -3.826 1.00 0.90 C ATOM 252 CD LYS A 16 0.942 -7.441 -4.913 1.00 0.83 C ATOM 253 CE LYS A 16 0.384 -6.045 -5.143 1.00 1.35 C ATOM 254 NZ LYS A 16 -0.599 -6.027 -6.257 1.00 1.39 N ATOM 0 H LYS A 16 2.194 -9.273 -1.329 1.00 0.40 H new ATOM 0 HA LYS A 16 0.834 -9.867 -3.814 1.00 0.41 H new ATOM 0 HB2 LYS A 16 3.537 -8.729 -3.055 1.00 0.49 H new ATOM 0 HB3 LYS A 16 3.094 -9.062 -4.718 1.00 0.49 H new ATOM 0 HG2 LYS A 16 1.546 -7.211 -2.866 1.00 0.90 H new ATOM 0 HG3 LYS A 16 2.743 -6.678 -4.030 1.00 0.90 H new ATOM 0 HD2 LYS A 16 1.369 -7.819 -5.842 1.00 0.83 H new ATOM 0 HD3 LYS A 16 0.132 -8.116 -4.637 1.00 0.83 H new ATOM 0 HE2 LYS A 16 -0.093 -5.688 -4.230 1.00 1.35 H new ATOM 0 HE3 LYS A 16 1.200 -5.358 -5.366 1.00 1.35 H new ATOM 0 HZ1 LYS A 16 -0.959 -5.060 -6.386 1.00 1.39 H new ATOM 0 HZ2 LYS A 16 -0.137 -6.344 -7.133 1.00 1.39 H new ATOM 0 HZ3 LYS A 16 -1.390 -6.664 -6.032 1.00 1.39 H new ATOM 268 N LEU A 17 3.338 -11.693 -2.706 1.00 0.30 N ATOM 269 CA LEU A 17 4.013 -12.974 -2.848 1.00 0.27 C ATOM 270 C LEU A 17 3.040 -14.143 -2.722 1.00 0.31 C ATOM 271 O LEU A 17 3.117 -15.094 -3.496 1.00 0.32 O ATOM 272 CB LEU A 17 5.128 -13.103 -1.810 1.00 0.25 C ATOM 273 CG LEU A 17 6.314 -12.173 -2.035 1.00 0.24 C ATOM 274 CD1 LEU A 17 7.261 -12.229 -0.855 1.00 0.29 C ATOM 275 CD2 LEU A 17 7.043 -12.545 -3.310 1.00 0.25 C ATOM 0 H LEU A 17 3.644 -11.147 -1.901 1.00 0.30 H new ATOM 0 HA LEU A 17 4.446 -13.009 -3.848 1.00 0.27 H new ATOM 0 HB2 LEU A 17 4.711 -12.907 -0.822 1.00 0.25 H new ATOM 0 HB3 LEU A 17 5.486 -14.133 -1.806 1.00 0.25 H new ATOM 0 HG LEU A 17 5.939 -11.154 -2.133 1.00 0.24 H new ATOM 0 HD11 LEU A 17 8.103 -11.559 -1.032 1.00 0.29 H new ATOM 0 HD12 LEU A 17 6.735 -11.920 0.049 1.00 0.29 H new ATOM 0 HD13 LEU A 17 7.628 -13.248 -0.731 1.00 0.29 H new ATOM 0 HD21 LEU A 17 7.887 -11.871 -3.456 1.00 0.25 H new ATOM 0 HD22 LEU A 17 7.405 -13.570 -3.236 1.00 0.25 H new ATOM 0 HD23 LEU A 17 6.361 -12.461 -4.156 1.00 0.25 H new ATOM 287 N SER A 18 2.118 -14.065 -1.765 1.00 0.37 N ATOM 288 CA SER A 18 1.143 -15.133 -1.558 1.00 0.44 C ATOM 289 C SER A 18 0.253 -15.281 -2.788 1.00 0.47 C ATOM 290 O SER A 18 -0.143 -16.388 -3.154 1.00 0.51 O ATOM 291 CB SER A 18 0.293 -14.849 -0.316 1.00 0.54 C ATOM 292 OG SER A 18 -0.378 -13.604 -0.423 1.00 1.26 O ATOM 0 H SER A 18 2.026 -13.277 -1.123 1.00 0.37 H new ATOM 0 HA SER A 18 1.681 -16.068 -1.402 1.00 0.44 H new ATOM 0 HB2 SER A 18 -0.437 -15.647 -0.182 1.00 0.54 H new ATOM 0 HB3 SER A 18 0.929 -14.847 0.569 1.00 0.54 H new ATOM 0 HG SER A 18 0.258 -12.875 -0.264 1.00 1.26 H new ATOM 298 N GLN A 19 -0.031 -14.155 -3.433 1.00 0.48 N ATOM 299 CA GLN A 19 -0.798 -14.143 -4.670 1.00 0.53 C ATOM 300 C GLN A 19 -0.007 -14.852 -5.762 1.00 0.48 C ATOM 301 O GLN A 19 -0.565 -15.581 -6.579 1.00 0.55 O ATOM 302 CB GLN A 19 -1.110 -12.688 -5.055 1.00 0.59 C ATOM 303 CG GLN A 19 -2.018 -12.506 -6.269 1.00 0.71 C ATOM 304 CD GLN A 19 -1.257 -12.399 -7.581 1.00 1.06 C ATOM 305 OE1 GLN A 19 -0.813 -11.316 -7.961 1.00 1.72 O ATOM 306 NE2 GLN A 19 -1.130 -13.500 -8.302 1.00 1.65 N ATOM 0 H GLN A 19 0.262 -13.231 -3.115 1.00 0.48 H new ATOM 0 HA GLN A 19 -1.742 -14.672 -4.539 1.00 0.53 H new ATOM 0 HB2 GLN A 19 -1.574 -12.197 -4.200 1.00 0.59 H new ATOM 0 HB3 GLN A 19 -0.169 -12.172 -5.247 1.00 0.59 H new ATOM 0 HG2 GLN A 19 -2.709 -13.347 -6.326 1.00 0.71 H new ATOM 0 HG3 GLN A 19 -2.620 -11.607 -6.132 1.00 0.71 H new ATOM 0 HE21 GLN A 19 -1.510 -14.382 -7.958 1.00 1.65 H new ATOM 0 HE22 GLN A 19 -0.652 -13.468 -9.203 1.00 1.65 H new ATOM 315 N LYS A 20 1.306 -14.663 -5.738 1.00 0.41 N ATOM 316 CA LYS A 20 2.197 -15.268 -6.722 1.00 0.40 C ATOM 317 C LYS A 20 2.461 -16.738 -6.387 1.00 0.44 C ATOM 318 O LYS A 20 3.091 -17.457 -7.158 1.00 0.48 O ATOM 319 CB LYS A 20 3.526 -14.507 -6.771 1.00 0.36 C ATOM 320 CG LYS A 20 3.386 -13.013 -7.037 1.00 0.68 C ATOM 321 CD LYS A 20 2.931 -12.717 -8.458 1.00 0.61 C ATOM 322 CE LYS A 20 2.820 -11.217 -8.706 1.00 1.06 C ATOM 323 NZ LYS A 20 1.843 -10.563 -7.794 1.00 1.87 N ATOM 0 H LYS A 20 1.782 -14.090 -5.041 1.00 0.41 H new ATOM 0 HA LYS A 20 1.712 -15.213 -7.696 1.00 0.40 H new ATOM 0 HB2 LYS A 20 4.047 -14.648 -5.824 1.00 0.36 H new ATOM 0 HB3 LYS A 20 4.153 -14.945 -7.548 1.00 0.36 H new ATOM 0 HG2 LYS A 20 2.671 -12.587 -6.333 1.00 0.68 H new ATOM 0 HG3 LYS A 20 4.343 -12.523 -6.855 1.00 0.68 H new ATOM 0 HD2 LYS A 20 3.636 -13.153 -9.166 1.00 0.61 H new ATOM 0 HD3 LYS A 20 1.965 -13.189 -8.638 1.00 0.61 H new ATOM 0 HE2 LYS A 20 3.799 -10.756 -8.576 1.00 1.06 H new ATOM 0 HE3 LYS A 20 2.521 -11.043 -9.740 1.00 1.06 H new ATOM 0 HZ1 LYS A 20 1.650 -9.597 -8.127 1.00 1.87 H new ATOM 0 HZ2 LYS A 20 0.958 -11.109 -7.784 1.00 1.87 H new ATOM 0 HZ3 LYS A 20 2.237 -10.525 -6.832 1.00 1.87 H new ATOM 337 N GLY A 21 1.983 -17.173 -5.226 1.00 0.48 N ATOM 338 CA GLY A 21 2.158 -18.556 -4.819 1.00 0.54 C ATOM 339 C GLY A 21 3.351 -18.764 -3.896 1.00 0.53 C ATOM 340 O GLY A 21 3.664 -19.896 -3.530 1.00 0.67 O ATOM 0 H GLY A 21 1.477 -16.592 -4.558 1.00 0.48 H new ATOM 0 HA2 GLY A 21 1.253 -18.897 -4.315 1.00 0.54 H new ATOM 0 HA3 GLY A 21 2.281 -19.176 -5.707 1.00 0.54 H new ATOM 344 N TYR A 22 4.012 -17.681 -3.500 1.00 0.43 N ATOM 345 CA TYR A 22 5.197 -17.784 -2.650 1.00 0.42 C ATOM 346 C TYR A 22 4.836 -17.483 -1.198 1.00 0.43 C ATOM 347 O TYR A 22 3.904 -16.726 -0.928 1.00 0.46 O ATOM 348 CB TYR A 22 6.294 -16.813 -3.106 1.00 0.40 C ATOM 349 CG TYR A 22 6.623 -16.867 -4.585 1.00 0.48 C ATOM 350 CD1 TYR A 22 6.573 -18.075 -5.268 1.00 0.65 C ATOM 351 CD2 TYR A 22 6.981 -15.726 -5.300 1.00 0.47 C ATOM 352 CE1 TYR A 22 6.871 -18.150 -6.614 1.00 0.75 C ATOM 353 CE2 TYR A 22 7.283 -15.797 -6.648 1.00 0.57 C ATOM 354 CZ TYR A 22 7.229 -16.922 -7.300 1.00 0.69 C ATOM 355 OH TYR A 22 7.534 -17.085 -8.636 1.00 0.81 O ATOM 0 H TYR A 22 3.751 -16.727 -3.751 1.00 0.43 H new ATOM 0 HA TYR A 22 5.573 -18.804 -2.732 1.00 0.42 H new ATOM 0 HB2 TYR A 22 5.987 -15.798 -2.854 1.00 0.40 H new ATOM 0 HB3 TYR A 22 7.201 -17.022 -2.539 1.00 0.40 H new ATOM 0 HD1 TYR A 22 6.296 -18.973 -4.736 1.00 0.65 H new ATOM 0 HD2 TYR A 22 7.023 -14.773 -4.795 1.00 0.47 H new ATOM 0 HE1 TYR A 22 6.839 -19.093 -7.140 1.00 0.75 H new ATOM 0 HE2 TYR A 22 7.570 -14.897 -7.172 1.00 0.57 H new ATOM 0 HH TYR A 22 7.855 -16.236 -9.004 1.00 0.81 H new ATOM 365 N SER A 23 5.570 -18.077 -0.267 1.00 0.45 N ATOM 366 CA SER A 23 5.342 -17.836 1.151 1.00 0.49 C ATOM 367 C SER A 23 6.489 -17.022 1.752 1.00 0.43 C ATOM 368 O SER A 23 7.660 -17.339 1.545 1.00 0.44 O ATOM 369 CB SER A 23 5.197 -19.163 1.894 1.00 0.59 C ATOM 370 OG SER A 23 4.137 -19.939 1.357 1.00 1.41 O ATOM 0 H SER A 23 6.328 -18.729 -0.468 1.00 0.45 H new ATOM 0 HA SER A 23 4.419 -17.265 1.258 1.00 0.49 H new ATOM 0 HB2 SER A 23 6.130 -19.723 1.829 1.00 0.59 H new ATOM 0 HB3 SER A 23 5.012 -18.973 2.951 1.00 0.59 H new ATOM 0 HG SER A 23 4.068 -20.783 1.850 1.00 1.41 H new ATOM 376 N TRP A 24 6.140 -15.984 2.505 1.00 0.43 N ATOM 377 CA TRP A 24 7.130 -15.096 3.118 1.00 0.41 C ATOM 378 C TRP A 24 7.984 -15.860 4.129 1.00 0.47 C ATOM 379 O TRP A 24 9.206 -15.702 4.179 1.00 0.53 O ATOM 380 CB TRP A 24 6.418 -13.915 3.802 1.00 0.44 C ATOM 381 CG TRP A 24 7.346 -12.925 4.453 1.00 0.46 C ATOM 382 CD1 TRP A 24 7.659 -12.844 5.782 1.00 0.55 C ATOM 383 CD2 TRP A 24 8.074 -11.869 3.806 1.00 0.43 C ATOM 384 NE1 TRP A 24 8.534 -11.811 5.999 1.00 0.57 N ATOM 385 CE2 TRP A 24 8.806 -11.197 4.804 1.00 0.50 C ATOM 386 CE3 TRP A 24 8.182 -11.428 2.484 1.00 0.39 C ATOM 387 CZ2 TRP A 24 9.629 -10.109 4.522 1.00 0.51 C ATOM 388 CZ3 TRP A 24 9.000 -10.349 2.205 1.00 0.43 C ATOM 389 CH2 TRP A 24 9.714 -9.700 3.219 1.00 0.48 C ATOM 0 H TRP A 24 5.172 -15.733 2.708 1.00 0.43 H new ATOM 0 HA TRP A 24 7.788 -14.711 2.338 1.00 0.41 H new ATOM 0 HB2 TRP A 24 5.811 -13.394 3.062 1.00 0.44 H new ATOM 0 HB3 TRP A 24 5.735 -14.305 4.556 1.00 0.44 H new ATOM 0 HD1 TRP A 24 7.273 -13.499 6.549 1.00 0.55 H new ATOM 0 HE1 TRP A 24 8.920 -11.543 6.904 1.00 0.57 H new ATOM 0 HE3 TRP A 24 7.636 -11.922 1.694 1.00 0.39 H new ATOM 0 HZ2 TRP A 24 10.180 -9.607 5.303 1.00 0.51 H new ATOM 0 HZ3 TRP A 24 9.090 -10.001 1.187 1.00 0.43 H new ATOM 0 HH2 TRP A 24 10.344 -8.860 2.968 1.00 0.48 H new ATOM 400 N SER A 25 7.330 -16.715 4.904 1.00 0.54 N ATOM 401 CA SER A 25 7.996 -17.504 5.935 1.00 0.63 C ATOM 402 C SER A 25 9.020 -18.480 5.345 1.00 0.63 C ATOM 403 O SER A 25 9.880 -19.000 6.058 1.00 0.75 O ATOM 404 CB SER A 25 6.939 -18.261 6.740 1.00 0.75 C ATOM 405 OG SER A 25 5.922 -18.766 5.885 1.00 1.20 O ATOM 0 H SER A 25 6.326 -16.882 4.837 1.00 0.54 H new ATOM 0 HA SER A 25 8.547 -16.824 6.585 1.00 0.63 H new ATOM 0 HB2 SER A 25 7.407 -19.083 7.281 1.00 0.75 H new ATOM 0 HB3 SER A 25 6.499 -17.598 7.485 1.00 0.75 H new ATOM 0 HG SER A 25 5.256 -19.248 6.418 1.00 1.20 H new ATOM 411 N GLN A 26 8.934 -18.714 4.042 1.00 0.61 N ATOM 412 CA GLN A 26 9.814 -19.663 3.376 1.00 0.73 C ATOM 413 C GLN A 26 11.143 -19.009 2.988 1.00 0.79 C ATOM 414 O GLN A 26 12.180 -19.672 2.948 1.00 0.93 O ATOM 415 CB GLN A 26 9.114 -20.236 2.134 1.00 0.80 C ATOM 416 CG GLN A 26 9.958 -21.225 1.330 1.00 1.25 C ATOM 417 CD GLN A 26 10.325 -22.472 2.121 1.00 1.53 C ATOM 418 OE1 GLN A 26 9.585 -22.903 3.008 1.00 1.91 O ATOM 419 NE2 GLN A 26 11.469 -23.065 1.805 1.00 2.26 N ATOM 0 H GLN A 26 8.262 -18.258 3.425 1.00 0.61 H new ATOM 0 HA GLN A 26 10.035 -20.474 4.070 1.00 0.73 H new ATOM 0 HB2 GLN A 26 8.195 -20.732 2.447 1.00 0.80 H new ATOM 0 HB3 GLN A 26 8.825 -19.411 1.483 1.00 0.80 H new ATOM 0 HG2 GLN A 26 9.410 -21.518 0.434 1.00 1.25 H new ATOM 0 HG3 GLN A 26 10.871 -20.730 0.998 1.00 1.25 H new ATOM 0 HE21 GLN A 26 12.056 -22.680 1.065 1.00 2.26 H new ATOM 0 HE22 GLN A 26 11.762 -23.906 2.302 1.00 2.26 H new ATOM 644 N GLU A 42 -3.330 0.424 14.042 1.00 1.02 N ATOM 645 CA GLU A 42 -3.311 1.385 12.950 1.00 0.87 C ATOM 646 C GLU A 42 -3.097 0.650 11.631 1.00 0.73 C ATOM 647 O GLU A 42 -3.677 1.003 10.601 1.00 0.63 O ATOM 648 CB GLU A 42 -2.195 2.412 13.170 1.00 1.05 C ATOM 649 CG GLU A 42 -2.346 3.665 12.331 1.00 1.53 C ATOM 650 CD GLU A 42 -3.557 4.481 12.734 1.00 2.12 C ATOM 651 OE1 GLU A 42 -3.446 5.301 13.665 1.00 2.82 O ATOM 652 OE2 GLU A 42 -4.628 4.308 12.112 1.00 2.42 O ATOM 0 HA GLU A 42 -4.265 1.912 12.917 1.00 0.87 H new ATOM 0 HB2 GLU A 42 -2.173 2.691 14.223 1.00 1.05 H new ATOM 0 HB3 GLU A 42 -1.236 1.947 12.943 1.00 1.05 H new ATOM 0 HG2 GLU A 42 -1.449 4.276 12.429 1.00 1.53 H new ATOM 0 HG3 GLU A 42 -2.430 3.389 11.280 1.00 1.53 H new ATOM 659 N SER A 43 -2.283 -0.400 11.693 1.00 0.79 N ATOM 660 CA SER A 43 -1.929 -1.198 10.524 1.00 0.75 C ATOM 661 C SER A 43 -3.166 -1.760 9.821 1.00 0.67 C ATOM 662 O SER A 43 -3.181 -1.888 8.600 1.00 0.62 O ATOM 663 CB SER A 43 -1.000 -2.342 10.945 1.00 0.94 C ATOM 664 OG SER A 43 0.004 -1.871 11.829 1.00 1.14 O ATOM 0 H SER A 43 -1.849 -0.722 12.558 1.00 0.79 H new ATOM 0 HA SER A 43 -1.417 -0.546 9.816 1.00 0.75 H new ATOM 0 HB2 SER A 43 -1.579 -3.128 11.430 1.00 0.94 H new ATOM 0 HB3 SER A 43 -0.537 -2.785 10.063 1.00 0.94 H new ATOM 0 HG SER A 43 0.534 -2.628 12.155 1.00 1.14 H new ATOM 670 N GLU A 44 -4.206 -2.068 10.593 1.00 0.72 N ATOM 671 CA GLU A 44 -5.434 -2.644 10.044 1.00 0.73 C ATOM 672 C GLU A 44 -6.078 -1.700 9.027 1.00 0.61 C ATOM 673 O GLU A 44 -6.747 -2.138 8.089 1.00 0.66 O ATOM 674 CB GLU A 44 -6.428 -2.943 11.169 1.00 0.85 C ATOM 675 CG GLU A 44 -7.663 -3.703 10.713 1.00 1.32 C ATOM 676 CD GLU A 44 -8.722 -3.799 11.792 1.00 1.96 C ATOM 677 OE1 GLU A 44 -8.589 -4.667 12.684 1.00 1.90 O ATOM 678 OE2 GLU A 44 -9.691 -3.012 11.760 1.00 2.98 O ATOM 0 H GLU A 44 -4.224 -1.928 11.603 1.00 0.72 H new ATOM 0 HA GLU A 44 -5.171 -3.572 9.537 1.00 0.73 H new ATOM 0 HB2 GLU A 44 -5.923 -3.521 11.943 1.00 0.85 H new ATOM 0 HB3 GLU A 44 -6.739 -2.003 11.625 1.00 0.85 H new ATOM 0 HG2 GLU A 44 -8.086 -3.210 9.838 1.00 1.32 H new ATOM 0 HG3 GLU A 44 -7.373 -4.707 10.404 1.00 1.32 H new ATOM 685 N ALA A 45 -5.856 -0.408 9.212 1.00 0.53 N ATOM 686 CA ALA A 45 -6.467 0.597 8.363 1.00 0.45 C ATOM 687 C ALA A 45 -5.584 0.915 7.169 1.00 0.39 C ATOM 688 O ALA A 45 -6.011 0.808 6.023 1.00 0.39 O ATOM 689 CB ALA A 45 -6.744 1.853 9.166 1.00 0.48 C ATOM 0 H ALA A 45 -5.255 -0.032 9.945 1.00 0.53 H new ATOM 0 HA ALA A 45 -7.409 0.201 7.985 1.00 0.45 H new ATOM 0 HB1 ALA A 45 -7.203 2.603 8.522 1.00 0.48 H new ATOM 0 HB2 ALA A 45 -7.420 1.618 9.988 1.00 0.48 H new ATOM 0 HB3 ALA A 45 -5.808 2.242 9.567 1.00 0.48 H new ATOM 695 N VAL A 46 -4.344 1.293 7.442 1.00 0.36 N ATOM 696 CA VAL A 46 -3.422 1.706 6.395 1.00 0.32 C ATOM 697 C VAL A 46 -3.081 0.561 5.445 1.00 0.34 C ATOM 698 O VAL A 46 -2.961 0.768 4.239 1.00 0.35 O ATOM 699 CB VAL A 46 -2.137 2.326 6.983 1.00 0.33 C ATOM 700 CG1 VAL A 46 -1.711 1.608 8.248 1.00 0.34 C ATOM 701 CG2 VAL A 46 -1.022 2.311 5.953 1.00 0.34 C ATOM 0 H VAL A 46 -3.952 1.322 8.383 1.00 0.36 H new ATOM 0 HA VAL A 46 -3.935 2.473 5.815 1.00 0.32 H new ATOM 0 HB VAL A 46 -2.351 3.362 7.246 1.00 0.33 H new ATOM 0 HG11 VAL A 46 -0.803 2.067 8.639 1.00 0.34 H new ATOM 0 HG12 VAL A 46 -2.504 1.681 8.992 1.00 0.34 H new ATOM 0 HG13 VAL A 46 -1.519 0.559 8.024 1.00 0.34 H new ATOM 0 HG21 VAL A 46 -0.123 2.752 6.384 1.00 0.34 H new ATOM 0 HG22 VAL A 46 -0.815 1.283 5.655 1.00 0.34 H new ATOM 0 HG23 VAL A 46 -1.326 2.888 5.079 1.00 0.34 H new ATOM 711 N LYS A 47 -2.944 -0.645 5.970 1.00 0.41 N ATOM 712 CA LYS A 47 -2.652 -1.788 5.115 1.00 0.50 C ATOM 713 C LYS A 47 -3.818 -2.031 4.157 1.00 0.51 C ATOM 714 O LYS A 47 -3.626 -2.483 3.029 1.00 0.59 O ATOM 715 CB LYS A 47 -2.367 -3.043 5.941 1.00 0.63 C ATOM 716 CG LYS A 47 -1.761 -4.169 5.121 1.00 0.84 C ATOM 717 CD LYS A 47 -1.417 -5.373 5.979 1.00 1.45 C ATOM 718 CE LYS A 47 -2.661 -6.051 6.526 1.00 1.93 C ATOM 719 NZ LYS A 47 -2.326 -7.297 7.260 1.00 2.14 N ATOM 0 H LYS A 47 -3.028 -0.858 6.964 1.00 0.41 H new ATOM 0 HA LYS A 47 -1.755 -1.563 4.538 1.00 0.50 H new ATOM 0 HB2 LYS A 47 -1.689 -2.789 6.756 1.00 0.63 H new ATOM 0 HB3 LYS A 47 -3.295 -3.391 6.395 1.00 0.63 H new ATOM 0 HG2 LYS A 47 -2.461 -4.467 4.341 1.00 0.84 H new ATOM 0 HG3 LYS A 47 -0.861 -3.810 4.621 1.00 0.84 H new ATOM 0 HD2 LYS A 47 -0.844 -6.088 5.389 1.00 1.45 H new ATOM 0 HD3 LYS A 47 -0.781 -5.059 6.806 1.00 1.45 H new ATOM 0 HE2 LYS A 47 -3.187 -5.366 7.191 1.00 1.93 H new ATOM 0 HE3 LYS A 47 -3.340 -6.283 5.706 1.00 1.93 H new ATOM 0 HZ1 LYS A 47 -3.185 -7.679 7.705 1.00 2.14 H new ATOM 0 HZ2 LYS A 47 -1.939 -7.998 6.596 1.00 2.14 H new ATOM 0 HZ3 LYS A 47 -1.619 -7.088 7.994 1.00 2.14 H new ATOM 733 N GLN A 48 -5.025 -1.706 4.614 1.00 0.47 N ATOM 734 CA GLN A 48 -6.209 -1.759 3.762 1.00 0.52 C ATOM 735 C GLN A 48 -6.192 -0.584 2.791 1.00 0.48 C ATOM 736 O GLN A 48 -6.559 -0.718 1.623 1.00 0.54 O ATOM 737 CB GLN A 48 -7.488 -1.730 4.614 1.00 0.55 C ATOM 738 CG GLN A 48 -8.784 -1.608 3.811 1.00 0.85 C ATOM 739 CD GLN A 48 -9.062 -2.801 2.906 1.00 1.50 C ATOM 740 OE1 GLN A 48 -8.150 -3.469 2.427 1.00 2.23 O ATOM 741 NE2 GLN A 48 -10.333 -3.071 2.654 1.00 2.02 N ATOM 0 H GLN A 48 -5.208 -1.403 5.571 1.00 0.47 H new ATOM 0 HA GLN A 48 -6.198 -2.691 3.197 1.00 0.52 H new ATOM 0 HB2 GLN A 48 -7.531 -2.640 5.213 1.00 0.55 H new ATOM 0 HB3 GLN A 48 -7.427 -0.893 5.310 1.00 0.55 H new ATOM 0 HG2 GLN A 48 -9.618 -1.486 4.502 1.00 0.85 H new ATOM 0 HG3 GLN A 48 -8.739 -0.705 3.202 1.00 0.85 H new ATOM 0 HE21 GLN A 48 -11.068 -2.497 3.067 1.00 2.02 H new ATOM 0 HE22 GLN A 48 -10.578 -3.853 2.047 1.00 2.02 H new ATOM 750 N ALA A 49 -5.745 0.564 3.286 1.00 0.42 N ATOM 751 CA ALA A 49 -5.616 1.758 2.471 1.00 0.40 C ATOM 752 C ALA A 49 -4.717 1.497 1.274 1.00 0.39 C ATOM 753 O ALA A 49 -5.086 1.781 0.140 1.00 0.42 O ATOM 754 CB ALA A 49 -5.068 2.902 3.304 1.00 0.36 C ATOM 0 H ALA A 49 -5.464 0.690 4.258 1.00 0.42 H new ATOM 0 HA ALA A 49 -6.604 2.033 2.102 1.00 0.40 H new ATOM 0 HB1 ALA A 49 -4.975 3.793 2.683 1.00 0.36 H new ATOM 0 HB2 ALA A 49 -5.746 3.106 4.132 1.00 0.36 H new ATOM 0 HB3 ALA A 49 -4.088 2.630 3.696 1.00 0.36 H new ATOM 760 N LEU A 50 -3.542 0.932 1.534 1.00 0.38 N ATOM 761 CA LEU A 50 -2.600 0.604 0.469 1.00 0.39 C ATOM 762 C LEU A 50 -3.127 -0.537 -0.394 1.00 0.46 C ATOM 763 O LEU A 50 -2.832 -0.607 -1.584 1.00 0.49 O ATOM 764 CB LEU A 50 -1.219 0.238 1.027 1.00 0.39 C ATOM 765 CG LEU A 50 -0.277 1.418 1.297 1.00 0.33 C ATOM 766 CD1 LEU A 50 -0.090 2.253 0.039 1.00 0.31 C ATOM 767 CD2 LEU A 50 -0.786 2.280 2.439 1.00 0.29 C ATOM 0 H LEU A 50 -3.220 0.692 2.471 1.00 0.38 H new ATOM 0 HA LEU A 50 -2.494 1.496 -0.148 1.00 0.39 H new ATOM 0 HB2 LEU A 50 -1.358 -0.313 1.957 1.00 0.39 H new ATOM 0 HB3 LEU A 50 -0.732 -0.439 0.325 1.00 0.39 H new ATOM 0 HG LEU A 50 0.691 1.012 1.591 1.00 0.33 H new ATOM 0 HD11 LEU A 50 0.581 3.085 0.251 1.00 0.31 H new ATOM 0 HD12 LEU A 50 0.338 1.633 -0.749 1.00 0.31 H new ATOM 0 HD13 LEU A 50 -1.055 2.640 -0.288 1.00 0.31 H new ATOM 0 HD21 LEU A 50 -0.096 3.108 2.606 1.00 0.29 H new ATOM 0 HD22 LEU A 50 -1.771 2.673 2.187 1.00 0.29 H new ATOM 0 HD23 LEU A 50 -0.857 1.679 3.345 1.00 0.29 H new ATOM 779 N ARG A 51 -3.912 -1.420 0.206 1.00 0.52 N ATOM 780 CA ARG A 51 -4.509 -2.532 -0.526 1.00 0.61 C ATOM 781 C ARG A 51 -5.496 -2.011 -1.567 1.00 0.62 C ATOM 782 O ARG A 51 -5.530 -2.484 -2.704 1.00 0.69 O ATOM 783 CB ARG A 51 -5.216 -3.484 0.442 1.00 0.67 C ATOM 784 CG ARG A 51 -5.782 -4.727 -0.221 1.00 0.98 C ATOM 785 CD ARG A 51 -6.493 -5.615 0.784 1.00 1.49 C ATOM 786 NE ARG A 51 -5.590 -6.117 1.821 1.00 2.00 N ATOM 787 CZ ARG A 51 -5.923 -6.224 3.107 1.00 2.89 C ATOM 788 NH1 ARG A 51 -7.091 -5.761 3.529 1.00 3.39 N ATOM 789 NH2 ARG A 51 -5.080 -6.770 3.976 1.00 3.74 N ATOM 0 H ARG A 51 -4.151 -1.390 1.197 1.00 0.52 H new ATOM 0 HA ARG A 51 -3.717 -3.078 -1.038 1.00 0.61 H new ATOM 0 HB2 ARG A 51 -4.512 -3.786 1.218 1.00 0.67 H new ATOM 0 HB3 ARG A 51 -6.025 -2.948 0.937 1.00 0.67 H new ATOM 0 HG2 ARG A 51 -6.477 -4.437 -1.008 1.00 0.98 H new ATOM 0 HG3 ARG A 51 -4.977 -5.286 -0.697 1.00 0.98 H new ATOM 0 HD2 ARG A 51 -7.303 -5.055 1.251 1.00 1.49 H new ATOM 0 HD3 ARG A 51 -6.948 -6.457 0.263 1.00 1.49 H new ATOM 0 HE ARG A 51 -4.651 -6.402 1.543 1.00 2.00 H new ATOM 0 HH11 ARG A 51 -7.734 -5.323 2.870 1.00 3.39 H new ATOM 0 HH12 ARG A 51 -7.347 -5.843 4.513 1.00 3.39 H new ATOM 0 HH21 ARG A 51 -4.172 -7.110 3.660 1.00 3.74 H new ATOM 0 HH22 ARG A 51 -5.341 -6.849 4.959 1.00 3.74 H new ATOM 803 N GLU A 52 -6.294 -1.031 -1.168 1.00 0.59 N ATOM 804 CA GLU A 52 -7.239 -0.396 -2.077 1.00 0.62 C ATOM 805 C GLU A 52 -6.510 0.569 -3.009 1.00 0.59 C ATOM 806 O GLU A 52 -6.898 0.751 -4.164 1.00 0.65 O ATOM 807 CB GLU A 52 -8.315 0.350 -1.287 1.00 0.66 C ATOM 808 CG GLU A 52 -9.195 -0.555 -0.438 1.00 0.92 C ATOM 809 CD GLU A 52 -10.093 -1.447 -1.271 1.00 1.23 C ATOM 810 OE1 GLU A 52 -9.650 -2.542 -1.678 1.00 1.88 O ATOM 811 OE2 GLU A 52 -11.254 -1.056 -1.514 1.00 1.45 O ATOM 0 H GLU A 52 -6.306 -0.657 -0.219 1.00 0.59 H new ATOM 0 HA GLU A 52 -7.717 -1.170 -2.677 1.00 0.62 H new ATOM 0 HB2 GLU A 52 -7.834 1.083 -0.640 1.00 0.66 H new ATOM 0 HB3 GLU A 52 -8.945 0.904 -1.983 1.00 0.66 H new ATOM 0 HG2 GLU A 52 -8.564 -1.175 0.199 1.00 0.92 H new ATOM 0 HG3 GLU A 52 -9.809 0.058 0.222 1.00 0.92 H new ATOM 818 N ALA A 53 -5.453 1.181 -2.496 1.00 0.52 N ATOM 819 CA ALA A 53 -4.643 2.105 -3.270 1.00 0.49 C ATOM 820 C ALA A 53 -3.931 1.388 -4.407 1.00 0.52 C ATOM 821 O ALA A 53 -3.917 1.868 -5.542 1.00 0.53 O ATOM 822 CB ALA A 53 -3.638 2.788 -2.362 1.00 0.43 C ATOM 0 H ALA A 53 -5.135 1.051 -1.536 1.00 0.52 H new ATOM 0 HA ALA A 53 -5.298 2.857 -3.709 1.00 0.49 H new ATOM 0 HB1 ALA A 53 -3.032 3.481 -2.946 1.00 0.43 H new ATOM 0 HB2 ALA A 53 -4.166 3.337 -1.582 1.00 0.43 H new ATOM 0 HB3 ALA A 53 -2.993 2.038 -1.904 1.00 0.43 H new ATOM 828 N GLY A 54 -3.352 0.232 -4.094 1.00 0.57 N ATOM 829 CA GLY A 54 -2.669 -0.567 -5.096 1.00 0.64 C ATOM 830 C GLY A 54 -3.593 -0.990 -6.218 1.00 0.74 C ATOM 831 O GLY A 54 -3.142 -1.324 -7.310 1.00 0.82 O ATOM 0 H GLY A 54 -3.344 -0.168 -3.156 1.00 0.57 H new ATOM 0 HA2 GLY A 54 -1.837 0.004 -5.508 1.00 0.64 H new ATOM 0 HA3 GLY A 54 -2.244 -1.453 -4.624 1.00 0.64 H new ATOM 835 N ASP A 55 -4.890 -0.972 -5.941 1.00 0.79 N ATOM 836 CA ASP A 55 -5.898 -1.266 -6.952 1.00 0.92 C ATOM 837 C ASP A 55 -6.087 -0.067 -7.872 1.00 0.88 C ATOM 838 O ASP A 55 -6.059 -0.199 -9.095 1.00 0.97 O ATOM 839 CB ASP A 55 -7.234 -1.639 -6.291 1.00 1.04 C ATOM 840 CG ASP A 55 -8.413 -1.523 -7.241 1.00 1.12 C ATOM 841 OD1 ASP A 55 -8.685 -2.485 -7.994 1.00 1.34 O ATOM 842 OD2 ASP A 55 -9.083 -0.466 -7.232 1.00 1.29 O ATOM 0 H ASP A 55 -5.271 -0.756 -5.020 1.00 0.79 H new ATOM 0 HA ASP A 55 -5.554 -2.115 -7.543 1.00 0.92 H new ATOM 0 HB2 ASP A 55 -7.175 -2.660 -5.915 1.00 1.04 H new ATOM 0 HB3 ASP A 55 -7.402 -0.992 -5.430 1.00 1.04 H new ATOM 847 N GLU A 56 -6.249 1.108 -7.273 1.00 0.79 N ATOM 848 CA GLU A 56 -6.503 2.318 -8.038 1.00 0.83 C ATOM 849 C GLU A 56 -5.280 2.698 -8.867 1.00 0.78 C ATOM 850 O GLU A 56 -5.402 3.026 -10.045 1.00 0.85 O ATOM 851 CB GLU A 56 -6.906 3.475 -7.114 1.00 0.83 C ATOM 852 CG GLU A 56 -7.218 4.766 -7.858 1.00 0.94 C ATOM 853 CD GLU A 56 -7.668 5.881 -6.941 1.00 1.27 C ATOM 854 OE1 GLU A 56 -8.878 5.962 -6.641 1.00 1.38 O ATOM 855 OE2 GLU A 56 -6.809 6.672 -6.498 1.00 2.06 O ATOM 0 H GLU A 56 -6.209 1.246 -6.263 1.00 0.79 H new ATOM 0 HA GLU A 56 -7.332 2.120 -8.717 1.00 0.83 H new ATOM 0 HB2 GLU A 56 -7.780 3.179 -6.534 1.00 0.83 H new ATOM 0 HB3 GLU A 56 -6.100 3.660 -6.404 1.00 0.83 H new ATOM 0 HG2 GLU A 56 -6.331 5.088 -8.404 1.00 0.94 H new ATOM 0 HG3 GLU A 56 -7.996 4.574 -8.597 1.00 0.94 H new ATOM 862 N PHE A 57 -4.100 2.625 -8.261 1.00 0.72 N ATOM 863 CA PHE A 57 -2.873 2.990 -8.960 1.00 0.76 C ATOM 864 C PHE A 57 -2.611 2.029 -10.115 1.00 0.82 C ATOM 865 O PHE A 57 -2.131 2.431 -11.171 1.00 0.90 O ATOM 866 CB PHE A 57 -1.673 3.004 -8.003 1.00 0.77 C ATOM 867 CG PHE A 57 -0.401 3.496 -8.643 1.00 0.94 C ATOM 868 CD1 PHE A 57 -0.120 4.855 -8.715 1.00 1.07 C ATOM 869 CD2 PHE A 57 0.520 2.600 -9.164 1.00 1.05 C ATOM 870 CE1 PHE A 57 1.054 5.305 -9.290 1.00 1.26 C ATOM 871 CE2 PHE A 57 1.693 3.046 -9.743 1.00 1.25 C ATOM 872 CZ PHE A 57 1.935 4.411 -9.847 1.00 1.34 C ATOM 0 H PHE A 57 -3.967 2.320 -7.297 1.00 0.72 H new ATOM 0 HA PHE A 57 -3.003 3.996 -9.359 1.00 0.76 H new ATOM 0 HB2 PHE A 57 -1.908 3.637 -7.147 1.00 0.77 H new ATOM 0 HB3 PHE A 57 -1.512 1.996 -7.620 1.00 0.77 H new ATOM 0 HD1 PHE A 57 -0.827 5.568 -8.317 1.00 1.07 H new ATOM 0 HD2 PHE A 57 0.318 1.540 -9.117 1.00 1.05 H new ATOM 0 HE1 PHE A 57 1.279 6.361 -9.301 1.00 1.26 H new ATOM 0 HE2 PHE A 57 2.419 2.337 -10.113 1.00 1.25 H new ATOM 0 HZ PHE A 57 2.813 4.767 -10.364 1.00 1.34 H new ATOM 882 N GLU A 58 -2.957 0.765 -9.919 1.00 0.83 N ATOM 883 CA GLU A 58 -2.688 -0.258 -10.919 1.00 0.95 C ATOM 884 C GLU A 58 -3.671 -0.153 -12.081 1.00 0.99 C ATOM 885 O GLU A 58 -3.298 -0.339 -13.235 1.00 1.08 O ATOM 886 CB GLU A 58 -2.772 -1.649 -10.284 1.00 1.05 C ATOM 887 CG GLU A 58 -2.396 -2.790 -11.215 1.00 1.35 C ATOM 888 CD GLU A 58 -2.644 -4.137 -10.579 1.00 1.27 C ATOM 889 OE1 GLU A 58 -1.803 -4.585 -9.774 1.00 1.45 O ATOM 890 OE2 GLU A 58 -3.699 -4.742 -10.863 1.00 1.61 O ATOM 0 H GLU A 58 -3.424 0.424 -9.079 1.00 0.83 H new ATOM 0 HA GLU A 58 -1.681 -0.102 -11.306 1.00 0.95 H new ATOM 0 HB2 GLU A 58 -2.118 -1.677 -9.413 1.00 1.05 H new ATOM 0 HB3 GLU A 58 -3.788 -1.810 -9.925 1.00 1.05 H new ATOM 0 HG2 GLU A 58 -2.972 -2.712 -12.137 1.00 1.35 H new ATOM 0 HG3 GLU A 58 -1.344 -2.705 -11.488 1.00 1.35 H new ATOM 897 N LEU A 59 -4.927 0.149 -11.781 1.00 0.98 N ATOM 898 CA LEU A 59 -5.946 0.238 -12.816 1.00 1.10 C ATOM 899 C LEU A 59 -5.819 1.542 -13.602 1.00 1.10 C ATOM 900 O LEU A 59 -6.237 1.627 -14.757 1.00 1.24 O ATOM 901 CB LEU A 59 -7.341 0.127 -12.199 1.00 1.19 C ATOM 902 CG LEU A 59 -8.493 0.060 -13.204 1.00 1.36 C ATOM 903 CD1 LEU A 59 -8.374 -1.184 -14.072 1.00 1.59 C ATOM 904 CD2 LEU A 59 -9.829 0.081 -12.481 1.00 1.56 C ATOM 0 H LEU A 59 -5.262 0.335 -10.836 1.00 0.98 H new ATOM 0 HA LEU A 59 -5.798 -0.591 -13.508 1.00 1.10 H new ATOM 0 HB2 LEU A 59 -7.374 -0.764 -11.572 1.00 1.19 H new ATOM 0 HB3 LEU A 59 -7.501 0.983 -11.544 1.00 1.19 H new ATOM 0 HG LEU A 59 -8.437 0.935 -13.851 1.00 1.36 H new ATOM 0 HD11 LEU A 59 -9.202 -1.214 -14.780 1.00 1.59 H new ATOM 0 HD12 LEU A 59 -7.431 -1.158 -14.617 1.00 1.59 H new ATOM 0 HD13 LEU A 59 -8.404 -2.072 -13.441 1.00 1.59 H new ATOM 0 HD21 LEU A 59 -10.638 0.033 -13.210 1.00 1.56 H new ATOM 0 HD22 LEU A 59 -9.893 -0.776 -11.810 1.00 1.56 H new ATOM 0 HD23 LEU A 59 -9.916 1.001 -11.903 1.00 1.56 H new ATOM 916 N ARG A 60 -5.225 2.546 -12.979 1.00 1.00 N ATOM 917 CA ARG A 60 -5.129 3.869 -13.589 1.00 1.06 C ATOM 918 C ARG A 60 -3.752 4.118 -14.206 1.00 1.00 C ATOM 919 O ARG A 60 -3.641 4.787 -15.235 1.00 1.07 O ATOM 920 CB ARG A 60 -5.450 4.960 -12.558 1.00 1.10 C ATOM 921 CG ARG A 60 -6.938 5.110 -12.253 1.00 1.19 C ATOM 922 CD ARG A 60 -7.695 5.688 -13.440 1.00 1.31 C ATOM 923 NE ARG A 60 -7.219 7.029 -13.775 1.00 1.81 N ATOM 924 CZ ARG A 60 -7.110 7.495 -15.017 1.00 2.26 C ATOM 925 NH1 ARG A 60 -7.433 6.726 -16.049 1.00 2.15 N ATOM 926 NH2 ARG A 60 -6.663 8.728 -15.225 1.00 3.21 N ATOM 0 H ARG A 60 -4.802 2.474 -12.054 1.00 1.00 H new ATOM 0 HA ARG A 60 -5.863 3.907 -14.394 1.00 1.06 H new ATOM 0 HB2 ARG A 60 -4.921 4.737 -11.632 1.00 1.10 H new ATOM 0 HB3 ARG A 60 -5.067 5.913 -12.922 1.00 1.10 H new ATOM 0 HG2 ARG A 60 -7.357 4.138 -11.991 1.00 1.19 H new ATOM 0 HG3 ARG A 60 -7.069 5.758 -11.386 1.00 1.19 H new ATOM 0 HD2 ARG A 60 -7.577 5.032 -14.303 1.00 1.31 H new ATOM 0 HD3 ARG A 60 -8.760 5.725 -13.211 1.00 1.31 H new ATOM 0 HE ARG A 60 -6.954 7.647 -13.008 1.00 1.81 H new ATOM 0 HH11 ARG A 60 -7.766 5.775 -15.892 1.00 2.15 H new ATOM 0 HH12 ARG A 60 -7.348 7.086 -17.000 1.00 2.15 H new ATOM 0 HH21 ARG A 60 -6.404 9.317 -14.433 1.00 3.21 H new ATOM 0 HH22 ARG A 60 -6.579 9.086 -16.176 1.00 3.21 H new ATOM 940 N TYR A 61 -2.709 3.579 -13.590 1.00 0.91 N ATOM 941 CA TYR A 61 -1.345 3.821 -14.048 1.00 0.90 C ATOM 942 C TYR A 61 -0.574 2.508 -14.185 1.00 0.84 C ATOM 943 O TYR A 61 0.566 2.395 -13.730 1.00 0.83 O ATOM 944 CB TYR A 61 -0.612 4.760 -13.079 1.00 0.96 C ATOM 945 CG TYR A 61 -1.220 6.144 -12.981 1.00 1.05 C ATOM 946 CD1 TYR A 61 -0.928 7.120 -13.927 1.00 1.27 C ATOM 947 CD2 TYR A 61 -2.081 6.477 -11.941 1.00 1.04 C ATOM 948 CE1 TYR A 61 -1.478 8.387 -13.840 1.00 1.38 C ATOM 949 CE2 TYR A 61 -2.634 7.740 -11.848 1.00 1.14 C ATOM 950 CZ TYR A 61 -2.329 8.689 -12.799 1.00 1.27 C ATOM 951 OH TYR A 61 -2.878 9.949 -12.705 1.00 1.41 O ATOM 0 H TYR A 61 -2.779 2.972 -12.773 1.00 0.91 H new ATOM 0 HA TYR A 61 -1.399 4.295 -15.028 1.00 0.90 H new ATOM 0 HB2 TYR A 61 -0.604 4.307 -12.087 1.00 0.96 H new ATOM 0 HB3 TYR A 61 0.427 4.853 -13.396 1.00 0.96 H new ATOM 0 HD1 TYR A 61 -0.261 6.886 -14.743 1.00 1.27 H new ATOM 0 HD2 TYR A 61 -2.322 5.736 -11.193 1.00 1.04 H new ATOM 0 HE1 TYR A 61 -1.242 9.134 -14.583 1.00 1.38 H new ATOM 0 HE2 TYR A 61 -3.302 7.982 -11.034 1.00 1.14 H new ATOM 0 HH TYR A 61 -3.456 9.996 -11.915 1.00 1.41 H new ATOM 961 N ARG A 62 -1.191 1.526 -14.833 1.00 0.86 N ATOM 962 CA ARG A 62 -0.566 0.215 -15.008 1.00 0.85 C ATOM 963 C ARG A 62 0.682 0.321 -15.881 1.00 0.87 C ATOM 964 O ARG A 62 1.680 -0.367 -15.650 1.00 0.85 O ATOM 965 CB ARG A 62 -1.562 -0.773 -15.627 1.00 0.95 C ATOM 966 CG ARG A 62 -1.017 -2.186 -15.789 1.00 1.04 C ATOM 967 CD ARG A 62 -2.076 -3.139 -16.328 1.00 1.23 C ATOM 968 NE ARG A 62 -2.620 -2.690 -17.610 1.00 1.73 N ATOM 969 CZ ARG A 62 -3.826 -3.029 -18.067 1.00 2.16 C ATOM 970 NH1 ARG A 62 -4.631 -3.786 -17.329 1.00 2.24 N ATOM 971 NH2 ARG A 62 -4.233 -2.596 -19.255 1.00 3.02 N ATOM 0 H ARG A 62 -2.120 1.610 -15.245 1.00 0.86 H new ATOM 0 HA ARG A 62 -0.269 -0.154 -14.026 1.00 0.85 H new ATOM 0 HB2 ARG A 62 -2.456 -0.809 -15.004 1.00 0.95 H new ATOM 0 HB3 ARG A 62 -1.869 -0.399 -16.604 1.00 0.95 H new ATOM 0 HG2 ARG A 62 -0.162 -2.171 -16.465 1.00 1.04 H new ATOM 0 HG3 ARG A 62 -0.656 -2.549 -14.827 1.00 1.04 H new ATOM 0 HD2 ARG A 62 -1.643 -4.132 -16.447 1.00 1.23 H new ATOM 0 HD3 ARG A 62 -2.885 -3.229 -15.603 1.00 1.23 H new ATOM 0 HE ARG A 62 -2.042 -2.081 -18.189 1.00 1.73 H new ATOM 0 HH11 ARG A 62 -4.327 -4.109 -16.411 1.00 2.24 H new ATOM 0 HH12 ARG A 62 -5.553 -4.044 -17.681 1.00 2.24 H new ATOM 0 HH21 ARG A 62 -3.623 -2.004 -19.818 1.00 3.02 H new ATOM 0 HH22 ARG A 62 -5.156 -2.856 -19.604 1.00 3.02 H new ATOM 985 N ARG A 63 0.628 1.193 -16.880 1.00 0.94 N ATOM 986 CA ARG A 63 1.758 1.387 -17.774 1.00 1.01 C ATOM 987 C ARG A 63 2.914 2.047 -17.022 1.00 0.95 C ATOM 988 O ARG A 63 4.063 1.628 -17.152 1.00 0.99 O ATOM 989 CB ARG A 63 1.350 2.236 -18.985 1.00 1.16 C ATOM 990 CG ARG A 63 2.390 2.252 -20.098 1.00 1.70 C ATOM 991 CD ARG A 63 2.552 0.880 -20.735 1.00 2.14 C ATOM 992 NE ARG A 63 1.317 0.416 -21.363 1.00 2.71 N ATOM 993 CZ ARG A 63 1.106 -0.836 -21.763 1.00 3.58 C ATOM 994 NH1 ARG A 63 2.043 -1.762 -21.596 1.00 3.92 N ATOM 995 NH2 ARG A 63 -0.045 -1.160 -22.337 1.00 4.52 N ATOM 0 H ARG A 63 -0.184 1.774 -17.089 1.00 0.94 H new ATOM 0 HA ARG A 63 2.086 0.413 -18.137 1.00 1.01 H new ATOM 0 HB2 ARG A 63 0.409 1.856 -19.384 1.00 1.16 H new ATOM 0 HB3 ARG A 63 1.167 3.259 -18.656 1.00 1.16 H new ATOM 0 HG2 ARG A 63 2.097 2.975 -20.860 1.00 1.70 H new ATOM 0 HG3 ARG A 63 3.348 2.582 -19.697 1.00 1.70 H new ATOM 0 HD2 ARG A 63 3.345 0.919 -21.481 1.00 2.14 H new ATOM 0 HD3 ARG A 63 2.864 0.163 -19.976 1.00 2.14 H new ATOM 0 HE ARG A 63 0.569 1.095 -21.504 1.00 2.71 H new ATOM 0 HH11 ARG A 63 2.931 -1.516 -21.159 1.00 3.92 H new ATOM 0 HH12 ARG A 63 1.875 -2.719 -21.905 1.00 3.92 H new ATOM 0 HH21 ARG A 63 -0.766 -0.451 -22.471 1.00 4.52 H new ATOM 0 HH22 ARG A 63 -0.210 -2.119 -22.645 1.00 4.52 H new ATOM 1009 N ALA A 64 2.595 3.053 -16.211 1.00 0.90 N ATOM 1010 CA ALA A 64 3.599 3.739 -15.408 1.00 0.89 C ATOM 1011 C ALA A 64 4.237 2.774 -14.422 1.00 0.75 C ATOM 1012 O ALA A 64 5.453 2.776 -14.232 1.00 0.73 O ATOM 1013 CB ALA A 64 2.981 4.915 -14.669 1.00 0.94 C ATOM 0 H ALA A 64 1.647 3.410 -16.094 1.00 0.90 H new ATOM 0 HA ALA A 64 4.372 4.119 -16.076 1.00 0.89 H new ATOM 0 HB1 ALA A 64 3.746 5.414 -14.075 1.00 0.94 H new ATOM 0 HB2 ALA A 64 2.564 5.619 -15.389 1.00 0.94 H new ATOM 0 HB3 ALA A 64 2.189 4.556 -14.012 1.00 0.94 H new ATOM 1019 N PHE A 65 3.400 1.944 -13.813 1.00 0.69 N ATOM 1020 CA PHE A 65 3.865 0.909 -12.898 1.00 0.61 C ATOM 1021 C PHE A 65 4.892 0.012 -13.586 1.00 0.59 C ATOM 1022 O PHE A 65 5.895 -0.372 -12.989 1.00 0.59 O ATOM 1023 CB PHE A 65 2.677 0.071 -12.403 1.00 0.62 C ATOM 1024 CG PHE A 65 3.044 -0.970 -11.383 1.00 0.59 C ATOM 1025 CD1 PHE A 65 3.248 -0.622 -10.056 1.00 0.60 C ATOM 1026 CD2 PHE A 65 3.193 -2.297 -11.754 1.00 0.64 C ATOM 1027 CE1 PHE A 65 3.591 -1.576 -9.120 1.00 0.64 C ATOM 1028 CE2 PHE A 65 3.537 -3.255 -10.820 1.00 0.68 C ATOM 1029 CZ PHE A 65 3.709 -2.895 -9.493 1.00 0.66 C ATOM 0 H PHE A 65 2.388 1.968 -13.938 1.00 0.69 H new ATOM 0 HA PHE A 65 4.341 1.388 -12.042 1.00 0.61 H new ATOM 0 HB2 PHE A 65 1.930 0.738 -11.973 1.00 0.62 H new ATOM 0 HB3 PHE A 65 2.212 -0.421 -13.257 1.00 0.62 H new ATOM 0 HD1 PHE A 65 3.137 0.408 -9.752 1.00 0.60 H new ATOM 0 HD2 PHE A 65 3.039 -2.585 -12.783 1.00 0.64 H new ATOM 0 HE1 PHE A 65 3.767 -1.287 -8.094 1.00 0.64 H new ATOM 0 HE2 PHE A 65 3.672 -4.283 -11.124 1.00 0.68 H new ATOM 0 HZ PHE A 65 3.935 -3.648 -8.753 1.00 0.66 H new ATOM 1039 N SER A 66 4.642 -0.292 -14.854 1.00 0.64 N ATOM 1040 CA SER A 66 5.528 -1.150 -15.632 1.00 0.68 C ATOM 1041 C SER A 66 6.887 -0.479 -15.861 1.00 0.66 C ATOM 1042 O SER A 66 7.935 -1.111 -15.712 1.00 0.68 O ATOM 1043 CB SER A 66 4.872 -1.498 -16.972 1.00 0.83 C ATOM 1044 OG SER A 66 3.576 -2.051 -16.776 1.00 1.20 O ATOM 0 H SER A 66 3.828 0.045 -15.368 1.00 0.64 H new ATOM 0 HA SER A 66 5.699 -2.067 -15.069 1.00 0.68 H new ATOM 0 HB2 SER A 66 4.800 -0.602 -17.589 1.00 0.83 H new ATOM 0 HB3 SER A 66 5.497 -2.209 -17.513 1.00 0.83 H new ATOM 0 HG SER A 66 2.969 -1.354 -16.449 1.00 1.20 H new ATOM 1050 N ASP A 67 6.867 0.804 -16.206 1.00 0.68 N ATOM 1051 CA ASP A 67 8.108 1.546 -16.455 1.00 0.73 C ATOM 1052 C ASP A 67 8.907 1.736 -15.171 1.00 0.65 C ATOM 1053 O ASP A 67 10.130 1.582 -15.159 1.00 0.66 O ATOM 1054 CB ASP A 67 7.828 2.917 -17.084 1.00 0.89 C ATOM 1055 CG ASP A 67 7.273 2.819 -18.487 1.00 1.36 C ATOM 1056 OD1 ASP A 67 8.028 2.436 -19.406 1.00 1.41 O ATOM 1057 OD2 ASP A 67 6.080 3.124 -18.685 1.00 2.06 O ATOM 0 H ASP A 67 6.015 1.353 -16.320 1.00 0.68 H new ATOM 0 HA ASP A 67 8.694 0.950 -17.155 1.00 0.73 H new ATOM 0 HB2 ASP A 67 7.122 3.461 -16.457 1.00 0.89 H new ATOM 0 HB3 ASP A 67 8.750 3.497 -17.103 1.00 0.89 H new ATOM 1062 N LEU A 68 8.215 2.062 -14.087 1.00 0.63 N ATOM 1063 CA LEU A 68 8.874 2.356 -12.824 1.00 0.66 C ATOM 1064 C LEU A 68 9.445 1.098 -12.173 1.00 0.57 C ATOM 1065 O LEU A 68 10.498 1.151 -11.539 1.00 0.63 O ATOM 1066 CB LEU A 68 7.907 3.069 -11.876 1.00 0.75 C ATOM 1067 CG LEU A 68 7.462 4.463 -12.336 1.00 0.81 C ATOM 1068 CD1 LEU A 68 6.469 5.063 -11.354 1.00 1.64 C ATOM 1069 CD2 LEU A 68 8.665 5.380 -12.501 1.00 1.07 C ATOM 0 H LEU A 68 7.198 2.129 -14.058 1.00 0.63 H new ATOM 0 HA LEU A 68 9.714 3.018 -13.034 1.00 0.66 H new ATOM 0 HB2 LEU A 68 7.022 2.446 -11.746 1.00 0.75 H new ATOM 0 HB3 LEU A 68 8.380 3.159 -10.898 1.00 0.75 H new ATOM 0 HG LEU A 68 6.969 4.361 -13.303 1.00 0.81 H new ATOM 0 HD11 LEU A 68 6.167 6.051 -11.700 1.00 1.64 H new ATOM 0 HD12 LEU A 68 5.592 4.419 -11.284 1.00 1.64 H new ATOM 0 HD13 LEU A 68 6.935 5.149 -10.372 1.00 1.64 H new ATOM 0 HD21 LEU A 68 8.330 6.364 -12.828 1.00 1.07 H new ATOM 0 HD22 LEU A 68 9.186 5.472 -11.548 1.00 1.07 H new ATOM 0 HD23 LEU A 68 9.342 4.962 -13.246 1.00 1.07 H new ATOM 1081 N THR A 69 8.773 -0.038 -12.342 1.00 0.49 N ATOM 1082 CA THR A 69 9.271 -1.292 -11.785 1.00 0.49 C ATOM 1083 C THR A 69 10.504 -1.776 -12.539 1.00 0.46 C ATOM 1084 O THR A 69 11.376 -2.422 -11.963 1.00 0.51 O ATOM 1085 CB THR A 69 8.201 -2.398 -11.789 1.00 0.51 C ATOM 1086 OG1 THR A 69 7.536 -2.439 -13.057 1.00 0.71 O ATOM 1087 CG2 THR A 69 7.189 -2.174 -10.678 1.00 0.63 C ATOM 0 H THR A 69 7.894 -0.116 -12.853 1.00 0.49 H new ATOM 0 HA THR A 69 9.539 -1.083 -10.749 1.00 0.49 H new ATOM 0 HB THR A 69 8.697 -3.353 -11.616 1.00 0.51 H new ATOM 0 HG1 THR A 69 6.703 -1.925 -13.006 1.00 0.71 H new ATOM 0 HG21 THR A 69 6.442 -2.968 -10.700 1.00 0.63 H new ATOM 0 HG22 THR A 69 7.699 -2.182 -9.715 1.00 0.63 H new ATOM 0 HG23 THR A 69 6.699 -1.211 -10.821 1.00 0.63 H new ATOM 1095 N SER A 70 10.579 -1.450 -13.824 1.00 0.46 N ATOM 1096 CA SER A 70 11.741 -1.802 -14.628 1.00 0.49 C ATOM 1097 C SER A 70 12.921 -0.906 -14.256 1.00 0.48 C ATOM 1098 O SER A 70 14.083 -1.299 -14.361 1.00 0.53 O ATOM 1099 CB SER A 70 11.409 -1.685 -16.119 1.00 0.57 C ATOM 1100 OG SER A 70 10.233 -2.419 -16.433 1.00 1.31 O ATOM 0 H SER A 70 9.851 -0.944 -14.329 1.00 0.46 H new ATOM 0 HA SER A 70 12.018 -2.836 -14.425 1.00 0.49 H new ATOM 0 HB2 SER A 70 11.271 -0.637 -16.384 1.00 0.57 H new ATOM 0 HB3 SER A 70 12.244 -2.056 -16.713 1.00 0.57 H new ATOM 0 HG SER A 70 9.444 -1.902 -16.168 1.00 1.31 H new ATOM 1106 N GLN A 71 12.606 0.298 -13.791 1.00 0.49 N ATOM 1107 CA GLN A 71 13.611 1.223 -13.286 1.00 0.53 C ATOM 1108 C GLN A 71 14.099 0.753 -11.915 1.00 0.46 C ATOM 1109 O GLN A 71 15.229 1.025 -11.507 1.00 0.53 O ATOM 1110 CB GLN A 71 13.013 2.631 -13.203 1.00 0.63 C ATOM 1111 CG GLN A 71 13.956 3.685 -12.648 1.00 0.69 C ATOM 1112 CD GLN A 71 13.321 5.064 -12.624 1.00 0.83 C ATOM 1113 OE1 GLN A 71 13.443 5.824 -13.580 1.00 1.22 O ATOM 1114 NE2 GLN A 71 12.619 5.390 -11.546 1.00 0.82 N ATOM 0 H GLN A 71 11.652 0.658 -13.754 1.00 0.49 H new ATOM 0 HA GLN A 71 14.465 1.249 -13.963 1.00 0.53 H new ATOM 0 HB2 GLN A 71 12.694 2.936 -14.200 1.00 0.63 H new ATOM 0 HB3 GLN A 71 12.120 2.596 -12.579 1.00 0.63 H new ATOM 0 HG2 GLN A 71 14.256 3.407 -11.638 1.00 0.69 H new ATOM 0 HG3 GLN A 71 14.862 3.714 -13.253 1.00 0.69 H new ATOM 0 HE21 GLN A 71 12.540 4.732 -10.771 1.00 0.82 H new ATOM 0 HE22 GLN A 71 12.159 6.299 -11.493 1.00 0.82 H new ATOM 1123 N LEU A 72 13.234 0.028 -11.222 1.00 0.39 N ATOM 1124 CA LEU A 72 13.564 -0.546 -9.923 1.00 0.33 C ATOM 1125 C LEU A 72 13.991 -1.999 -10.061 1.00 0.34 C ATOM 1126 O LEU A 72 14.043 -2.722 -9.069 1.00 0.37 O ATOM 1127 CB LEU A 72 12.365 -0.455 -8.970 1.00 0.37 C ATOM 1128 CG LEU A 72 12.362 0.754 -8.040 1.00 0.46 C ATOM 1129 CD1 LEU A 72 11.073 0.806 -7.243 1.00 0.96 C ATOM 1130 CD2 LEU A 72 13.561 0.705 -7.104 1.00 0.92 C ATOM 0 H LEU A 72 12.288 -0.179 -11.541 1.00 0.39 H new ATOM 0 HA LEU A 72 14.394 0.028 -9.511 1.00 0.33 H new ATOM 0 HB2 LEU A 72 11.451 -0.439 -9.563 1.00 0.37 H new ATOM 0 HB3 LEU A 72 12.335 -1.360 -8.363 1.00 0.37 H new ATOM 0 HG LEU A 72 12.431 1.657 -8.646 1.00 0.46 H new ATOM 0 HD11 LEU A 72 11.087 1.674 -6.584 1.00 0.96 H new ATOM 0 HD12 LEU A 72 10.226 0.882 -7.925 1.00 0.96 H new ATOM 0 HD13 LEU A 72 10.978 -0.101 -6.646 1.00 0.96 H new ATOM 0 HD21 LEU A 72 13.545 1.574 -6.447 1.00 0.92 H new ATOM 0 HD22 LEU A 72 13.518 -0.204 -6.504 1.00 0.92 H new ATOM 0 HD23 LEU A 72 14.480 0.710 -7.690 1.00 0.92 H new ATOM 1142 N HIS A 73 14.299 -2.407 -11.295 1.00 0.41 N ATOM 1143 CA HIS A 73 14.721 -3.779 -11.596 1.00 0.46 C ATOM 1144 C HIS A 73 15.775 -4.247 -10.597 1.00 0.41 C ATOM 1145 O HIS A 73 16.927 -3.820 -10.658 1.00 0.45 O ATOM 1146 CB HIS A 73 15.282 -3.842 -13.025 1.00 0.60 C ATOM 1147 CG HIS A 73 15.670 -5.216 -13.487 1.00 1.34 C ATOM 1148 ND1 HIS A 73 14.848 -6.005 -14.257 1.00 2.07 N ATOM 1149 CD2 HIS A 73 16.811 -5.924 -13.315 1.00 2.33 C ATOM 1150 CE1 HIS A 73 15.464 -7.135 -14.540 1.00 2.86 C ATOM 1151 NE2 HIS A 73 16.660 -7.114 -13.982 1.00 3.01 N ATOM 0 H HIS A 73 14.263 -1.798 -12.112 1.00 0.41 H new ATOM 0 HA HIS A 73 13.858 -4.440 -11.517 1.00 0.46 H new ATOM 0 HB2 HIS A 73 14.537 -3.440 -13.711 1.00 0.60 H new ATOM 0 HB3 HIS A 73 16.155 -3.193 -13.087 1.00 0.60 H new ATOM 0 HD2 HIS A 73 17.680 -5.610 -12.756 1.00 2.33 H new ATOM 0 HE1 HIS A 73 15.058 -7.943 -15.130 1.00 2.86 H new ATOM 0 HE2 HIS A 73 17.356 -7.858 -14.037 1.00 3.01 H new ATOM 1160 N ILE A 74 15.374 -5.115 -9.674 1.00 0.37 N ATOM 1161 CA ILE A 74 16.258 -5.537 -8.603 1.00 0.36 C ATOM 1162 C ILE A 74 17.368 -6.442 -9.141 1.00 0.45 C ATOM 1163 O ILE A 74 17.119 -7.367 -9.921 1.00 0.61 O ATOM 1164 CB ILE A 74 15.472 -6.232 -7.460 1.00 0.31 C ATOM 1165 CG1 ILE A 74 16.376 -6.449 -6.247 1.00 0.31 C ATOM 1166 CG2 ILE A 74 14.876 -7.555 -7.925 1.00 0.35 C ATOM 1167 CD1 ILE A 74 15.629 -6.872 -5.004 1.00 0.34 C ATOM 0 H ILE A 74 14.445 -5.536 -9.649 1.00 0.37 H new ATOM 0 HA ILE A 74 16.723 -4.645 -8.183 1.00 0.36 H new ATOM 0 HB ILE A 74 14.649 -5.578 -7.171 1.00 0.31 H new ATOM 0 HG12 ILE A 74 17.120 -7.208 -6.490 1.00 0.31 H new ATOM 0 HG13 ILE A 74 16.918 -5.527 -6.039 1.00 0.31 H new ATOM 0 HG21 ILE A 74 14.331 -8.018 -7.102 1.00 0.35 H new ATOM 0 HG22 ILE A 74 14.194 -7.375 -8.756 1.00 0.35 H new ATOM 0 HG23 ILE A 74 15.676 -8.220 -8.250 1.00 0.35 H new ATOM 0 HD11 ILE A 74 16.334 -7.007 -4.184 1.00 0.34 H new ATOM 0 HD12 ILE A 74 14.904 -6.103 -4.736 1.00 0.34 H new ATOM 0 HD13 ILE A 74 15.109 -7.811 -5.194 1.00 0.34 H new ATOM 1179 N THR A 75 18.595 -6.141 -8.750 1.00 0.61 N ATOM 1180 CA THR A 75 19.759 -6.846 -9.251 1.00 0.73 C ATOM 1181 C THR A 75 20.518 -7.524 -8.109 1.00 0.58 C ATOM 1182 O THR A 75 20.303 -7.196 -6.941 1.00 0.57 O ATOM 1183 CB THR A 75 20.692 -5.870 -9.997 1.00 1.02 C ATOM 1184 OG1 THR A 75 20.915 -4.701 -9.195 1.00 1.38 O ATOM 1185 CG2 THR A 75 20.093 -5.463 -11.335 1.00 1.56 C ATOM 0 H THR A 75 18.810 -5.404 -8.079 1.00 0.61 H new ATOM 0 HA THR A 75 19.419 -7.616 -9.944 1.00 0.73 H new ATOM 0 HB THR A 75 21.640 -6.375 -10.180 1.00 1.02 H new ATOM 0 HG1 THR A 75 21.509 -4.085 -9.672 1.00 1.38 H new ATOM 0 HG21 THR A 75 20.769 -4.775 -11.842 1.00 1.56 H new ATOM 0 HG22 THR A 75 19.947 -6.349 -11.953 1.00 1.56 H new ATOM 0 HG23 THR A 75 19.133 -4.973 -11.170 1.00 1.56 H new ATOM 1193 N PRO A 76 21.400 -8.487 -8.425 1.00 0.66 N ATOM 1194 CA PRO A 76 22.193 -9.198 -7.414 1.00 0.73 C ATOM 1195 C PRO A 76 23.035 -8.252 -6.563 1.00 0.72 C ATOM 1196 O PRO A 76 23.968 -7.616 -7.060 1.00 0.81 O ATOM 1197 CB PRO A 76 23.098 -10.118 -8.240 1.00 0.93 C ATOM 1198 CG PRO A 76 22.399 -10.269 -9.544 1.00 1.06 C ATOM 1199 CD PRO A 76 21.689 -8.970 -9.786 1.00 0.90 C ATOM 0 HA PRO A 76 21.557 -9.730 -6.707 1.00 0.73 H new ATOM 0 HB2 PRO A 76 24.089 -9.684 -8.371 1.00 0.93 H new ATOM 0 HB3 PRO A 76 23.234 -11.082 -7.750 1.00 0.93 H new ATOM 0 HG2 PRO A 76 23.108 -10.481 -10.344 1.00 1.06 H new ATOM 0 HG3 PRO A 76 21.694 -11.100 -9.515 1.00 1.06 H new ATOM 0 HD2 PRO A 76 22.312 -8.267 -10.339 1.00 0.90 H new ATOM 0 HD3 PRO A 76 20.777 -9.111 -10.366 1.00 0.90 H new ATOM 1207 N GLY A 77 22.688 -8.156 -5.287 1.00 0.86 N ATOM 1208 CA GLY A 77 23.421 -7.302 -4.376 1.00 1.10 C ATOM 1209 C GLY A 77 23.052 -5.838 -4.518 1.00 1.00 C ATOM 1210 O GLY A 77 23.919 -4.970 -4.446 1.00 1.32 O ATOM 0 H GLY A 77 21.907 -8.658 -4.865 1.00 0.86 H new ATOM 0 HA2 GLY A 77 23.230 -7.622 -3.352 1.00 1.10 H new ATOM 0 HA3 GLY A 77 24.490 -7.422 -4.554 1.00 1.10 H new ATOM 1214 N THR A 78 21.766 -5.565 -4.716 1.00 0.85 N ATOM 1215 CA THR A 78 21.280 -4.192 -4.834 1.00 0.82 C ATOM 1216 C THR A 78 21.545 -3.402 -3.554 1.00 0.85 C ATOM 1217 O THR A 78 21.022 -3.733 -2.490 1.00 1.52 O ATOM 1218 CB THR A 78 19.767 -4.158 -5.135 1.00 0.90 C ATOM 1219 OG1 THR A 78 19.500 -4.784 -6.395 1.00 1.52 O ATOM 1220 CG2 THR A 78 19.246 -2.727 -5.164 1.00 1.15 C ATOM 0 H THR A 78 21.040 -6.277 -4.798 1.00 0.85 H new ATOM 0 HA THR A 78 21.822 -3.734 -5.661 1.00 0.82 H new ATOM 0 HB THR A 78 19.256 -4.701 -4.340 1.00 0.90 H new ATOM 0 HG1 THR A 78 19.727 -5.736 -6.342 1.00 1.52 H new ATOM 0 HG21 THR A 78 18.177 -2.733 -5.378 1.00 1.15 H new ATOM 0 HG22 THR A 78 19.419 -2.257 -4.196 1.00 1.15 H new ATOM 0 HG23 THR A 78 19.768 -2.165 -5.939 1.00 1.15 H new ATOM 1228 N ALA A 79 22.387 -2.386 -3.657 1.00 0.68 N ATOM 1229 CA ALA A 79 22.630 -1.485 -2.543 1.00 0.73 C ATOM 1230 C ALA A 79 21.431 -0.560 -2.345 1.00 0.62 C ATOM 1231 O ALA A 79 20.786 -0.153 -3.317 1.00 0.56 O ATOM 1232 CB ALA A 79 23.893 -0.671 -2.782 1.00 0.85 C ATOM 0 H ALA A 79 22.914 -2.165 -4.502 1.00 0.68 H new ATOM 0 HA ALA A 79 22.769 -2.078 -1.639 1.00 0.73 H new ATOM 0 HB1 ALA A 79 24.060 -0.002 -1.938 1.00 0.85 H new ATOM 0 HB2 ALA A 79 24.745 -1.343 -2.886 1.00 0.85 H new ATOM 0 HB3 ALA A 79 23.781 -0.084 -3.694 1.00 0.85 H new ATOM 1238 N TYR A 80 21.138 -0.230 -1.089 1.00 0.63 N ATOM 1239 CA TYR A 80 20.011 0.644 -0.761 1.00 0.58 C ATOM 1240 C TYR A 80 20.158 2.007 -1.436 1.00 0.50 C ATOM 1241 O TYR A 80 19.166 2.667 -1.737 1.00 0.46 O ATOM 1242 CB TYR A 80 19.882 0.813 0.759 1.00 0.67 C ATOM 1243 CG TYR A 80 18.809 1.797 1.189 1.00 0.80 C ATOM 1244 CD1 TYR A 80 17.464 1.559 0.918 1.00 0.89 C ATOM 1245 CD2 TYR A 80 19.143 2.965 1.865 1.00 1.14 C ATOM 1246 CE1 TYR A 80 16.489 2.458 1.309 1.00 1.24 C ATOM 1247 CE2 TYR A 80 18.173 3.863 2.258 1.00 1.55 C ATOM 1248 CZ TYR A 80 16.849 3.606 1.978 1.00 1.58 C ATOM 1249 OH TYR A 80 15.880 4.501 2.374 1.00 2.03 O ATOM 0 H TYR A 80 21.666 -0.555 -0.279 1.00 0.63 H new ATOM 0 HA TYR A 80 19.103 0.174 -1.138 1.00 0.58 H new ATOM 0 HB2 TYR A 80 19.667 -0.159 1.204 1.00 0.67 H new ATOM 0 HB3 TYR A 80 20.841 1.142 1.159 1.00 0.67 H new ATOM 0 HD1 TYR A 80 17.178 0.659 0.395 1.00 0.89 H new ATOM 0 HD2 TYR A 80 20.180 3.173 2.086 1.00 1.14 H new ATOM 0 HE1 TYR A 80 15.450 2.261 1.091 1.00 1.24 H new ATOM 0 HE2 TYR A 80 18.450 4.765 2.784 1.00 1.55 H new ATOM 0 HH TYR A 80 16.301 5.257 2.834 1.00 2.03 H new ATOM 1259 N GLN A 81 21.397 2.416 -1.686 1.00 0.56 N ATOM 1260 CA GLN A 81 21.664 3.687 -2.344 1.00 0.59 C ATOM 1261 C GLN A 81 20.983 3.750 -3.712 1.00 0.54 C ATOM 1262 O GLN A 81 20.401 4.772 -4.074 1.00 0.63 O ATOM 1263 CB GLN A 81 23.175 3.905 -2.479 1.00 0.72 C ATOM 1264 CG GLN A 81 23.552 5.246 -3.094 1.00 0.84 C ATOM 1265 CD GLN A 81 22.969 6.437 -2.346 1.00 1.40 C ATOM 1266 OE1 GLN A 81 22.694 7.475 -2.944 1.00 2.01 O ATOM 1267 NE2 GLN A 81 22.787 6.308 -1.039 1.00 2.18 N ATOM 0 H GLN A 81 22.232 1.884 -1.442 1.00 0.56 H new ATOM 0 HA GLN A 81 21.250 4.486 -1.729 1.00 0.59 H new ATOM 0 HB2 GLN A 81 23.633 3.827 -1.493 1.00 0.72 H new ATOM 0 HB3 GLN A 81 23.595 3.105 -3.090 1.00 0.72 H new ATOM 0 HG2 GLN A 81 24.638 5.336 -3.115 1.00 0.84 H new ATOM 0 HG3 GLN A 81 23.210 5.273 -4.128 1.00 0.84 H new ATOM 0 HE21 GLN A 81 23.026 5.432 -0.575 1.00 2.18 H new ATOM 0 HE22 GLN A 81 22.408 7.085 -0.498 1.00 2.18 H new ATOM 1276 N SER A 82 21.025 2.645 -4.453 1.00 0.48 N ATOM 1277 CA SER A 82 20.389 2.585 -5.763 1.00 0.47 C ATOM 1278 C SER A 82 18.873 2.635 -5.609 1.00 0.40 C ATOM 1279 O SER A 82 18.175 3.287 -6.387 1.00 0.42 O ATOM 1280 CB SER A 82 20.803 1.312 -6.511 1.00 0.55 C ATOM 1281 OG SER A 82 20.355 1.340 -7.857 1.00 1.17 O ATOM 0 H SER A 82 21.491 1.783 -4.169 1.00 0.48 H new ATOM 0 HA SER A 82 20.717 3.446 -6.346 1.00 0.47 H new ATOM 0 HB2 SER A 82 21.888 1.210 -6.488 1.00 0.55 H new ATOM 0 HB3 SER A 82 20.390 0.439 -6.005 1.00 0.55 H new ATOM 0 HG SER A 82 20.633 0.518 -8.312 1.00 1.17 H new ATOM 1287 N PHE A 83 18.375 1.957 -4.581 1.00 0.36 N ATOM 1288 CA PHE A 83 16.947 1.919 -4.300 1.00 0.33 C ATOM 1289 C PHE A 83 16.445 3.318 -3.942 1.00 0.31 C ATOM 1290 O PHE A 83 15.369 3.735 -4.375 1.00 0.32 O ATOM 1291 CB PHE A 83 16.672 0.927 -3.156 1.00 0.35 C ATOM 1292 CG PHE A 83 15.213 0.684 -2.870 1.00 0.33 C ATOM 1293 CD1 PHE A 83 14.482 -0.211 -3.637 1.00 0.38 C ATOM 1294 CD2 PHE A 83 14.570 1.358 -1.844 1.00 0.32 C ATOM 1295 CE1 PHE A 83 13.142 -0.429 -3.385 1.00 0.41 C ATOM 1296 CE2 PHE A 83 13.229 1.142 -1.587 1.00 0.34 C ATOM 1297 CZ PHE A 83 12.525 0.223 -2.330 1.00 0.38 C ATOM 0 H PHE A 83 18.945 1.423 -3.925 1.00 0.36 H new ATOM 0 HA PHE A 83 16.411 1.583 -5.188 1.00 0.33 H new ATOM 0 HB2 PHE A 83 17.144 -0.025 -3.398 1.00 0.35 H new ATOM 0 HB3 PHE A 83 17.149 1.298 -2.249 1.00 0.35 H new ATOM 0 HD1 PHE A 83 14.967 -0.744 -4.441 1.00 0.38 H new ATOM 0 HD2 PHE A 83 15.123 2.060 -1.238 1.00 0.32 H new ATOM 0 HE1 PHE A 83 12.577 -1.106 -4.009 1.00 0.41 H new ATOM 0 HE2 PHE A 83 12.734 1.695 -0.803 1.00 0.34 H new ATOM 0 HZ PHE A 83 11.493 0.010 -2.091 1.00 0.38 H new ATOM 1307 N GLU A 84 17.253 4.051 -3.183 1.00 0.34 N ATOM 1308 CA GLU A 84 16.888 5.390 -2.743 1.00 0.39 C ATOM 1309 C GLU A 84 16.859 6.358 -3.922 1.00 0.37 C ATOM 1310 O GLU A 84 16.016 7.244 -3.972 1.00 0.40 O ATOM 1311 CB GLU A 84 17.863 5.896 -1.671 1.00 0.51 C ATOM 1312 CG GLU A 84 17.453 7.229 -1.063 1.00 0.64 C ATOM 1313 CD GLU A 84 18.463 7.757 -0.066 1.00 0.90 C ATOM 1314 OE1 GLU A 84 18.469 7.277 1.088 1.00 0.95 O ATOM 1315 OE2 GLU A 84 19.260 8.647 -0.429 1.00 1.58 O ATOM 0 H GLU A 84 18.168 3.737 -2.860 1.00 0.34 H new ATOM 0 HA GLU A 84 15.889 5.339 -2.309 1.00 0.39 H new ATOM 0 HB2 GLU A 84 17.939 5.151 -0.879 1.00 0.51 H new ATOM 0 HB3 GLU A 84 18.855 5.995 -2.111 1.00 0.51 H new ATOM 0 HG2 GLU A 84 17.320 7.961 -1.860 1.00 0.64 H new ATOM 0 HG3 GLU A 84 16.488 7.116 -0.570 1.00 0.64 H new ATOM 1322 N GLN A 85 17.758 6.170 -4.883 1.00 0.37 N ATOM 1323 CA GLN A 85 17.827 7.059 -6.044 1.00 0.42 C ATOM 1324 C GLN A 85 16.536 7.009 -6.850 1.00 0.38 C ATOM 1325 O GLN A 85 16.167 7.971 -7.528 1.00 0.46 O ATOM 1326 CB GLN A 85 19.015 6.705 -6.938 1.00 0.50 C ATOM 1327 CG GLN A 85 20.368 6.918 -6.275 1.00 0.61 C ATOM 1328 CD GLN A 85 20.474 8.265 -5.584 1.00 1.44 C ATOM 1329 OE1 GLN A 85 20.873 9.258 -6.189 1.00 1.90 O ATOM 1330 NE2 GLN A 85 20.133 8.300 -4.305 1.00 2.16 N ATOM 0 H GLN A 85 18.445 5.417 -4.884 1.00 0.37 H new ATOM 0 HA GLN A 85 17.964 8.074 -5.670 1.00 0.42 H new ATOM 0 HB2 GLN A 85 18.930 5.662 -7.243 1.00 0.50 H new ATOM 0 HB3 GLN A 85 18.967 7.307 -7.845 1.00 0.50 H new ATOM 0 HG2 GLN A 85 20.540 6.126 -5.547 1.00 0.61 H new ATOM 0 HG3 GLN A 85 21.153 6.836 -7.026 1.00 0.61 H new ATOM 0 HE21 GLN A 85 19.807 7.452 -3.841 1.00 2.16 H new ATOM 0 HE22 GLN A 85 20.197 9.175 -3.784 1.00 2.16 H new ATOM 1339 N VAL A 86 15.844 5.886 -6.759 1.00 0.31 N ATOM 1340 CA VAL A 86 14.571 5.719 -7.430 1.00 0.31 C ATOM 1341 C VAL A 86 13.461 6.325 -6.593 1.00 0.29 C ATOM 1342 O VAL A 86 12.731 7.208 -7.040 1.00 0.32 O ATOM 1343 CB VAL A 86 14.256 4.234 -7.656 1.00 0.33 C ATOM 1344 CG1 VAL A 86 12.944 4.077 -8.408 1.00 0.38 C ATOM 1345 CG2 VAL A 86 15.396 3.547 -8.390 1.00 0.36 C ATOM 0 H VAL A 86 16.147 5.073 -6.223 1.00 0.31 H new ATOM 0 HA VAL A 86 14.636 6.222 -8.395 1.00 0.31 H new ATOM 0 HB VAL A 86 14.148 3.752 -6.685 1.00 0.33 H new ATOM 0 HG11 VAL A 86 12.736 3.018 -8.560 1.00 0.38 H new ATOM 0 HG12 VAL A 86 12.137 4.526 -7.829 1.00 0.38 H new ATOM 0 HG13 VAL A 86 13.017 4.574 -9.375 1.00 0.38 H new ATOM 0 HG21 VAL A 86 15.151 2.495 -8.539 1.00 0.36 H new ATOM 0 HG22 VAL A 86 15.546 4.026 -9.358 1.00 0.36 H new ATOM 0 HG23 VAL A 86 16.309 3.627 -7.800 1.00 0.36 H new ATOM 1355 N VAL A 87 13.354 5.844 -5.363 1.00 0.28 N ATOM 1356 CA VAL A 87 12.280 6.240 -4.469 1.00 0.32 C ATOM 1357 C VAL A 87 12.384 7.714 -4.068 1.00 0.35 C ATOM 1358 O VAL A 87 11.429 8.301 -3.557 1.00 0.37 O ATOM 1359 CB VAL A 87 12.253 5.346 -3.222 1.00 0.38 C ATOM 1360 CG1 VAL A 87 12.231 3.888 -3.641 1.00 0.38 C ATOM 1361 CG2 VAL A 87 13.439 5.627 -2.319 1.00 0.41 C ATOM 0 H VAL A 87 14.007 5.172 -4.960 1.00 0.28 H new ATOM 0 HA VAL A 87 11.344 6.113 -5.013 1.00 0.32 H new ATOM 0 HB VAL A 87 11.350 5.568 -2.654 1.00 0.38 H new ATOM 0 HG11 VAL A 87 12.212 3.255 -2.754 1.00 0.38 H new ATOM 0 HG12 VAL A 87 11.343 3.696 -4.243 1.00 0.38 H new ATOM 0 HG13 VAL A 87 13.122 3.664 -4.227 1.00 0.38 H new ATOM 0 HG21 VAL A 87 13.392 4.978 -1.444 1.00 0.41 H new ATOM 0 HG22 VAL A 87 14.364 5.436 -2.863 1.00 0.41 H new ATOM 0 HG23 VAL A 87 13.414 6.669 -2.000 1.00 0.41 H new ATOM 1371 N ASN A 88 13.546 8.303 -4.317 1.00 0.38 N ATOM 1372 CA ASN A 88 13.743 9.738 -4.125 1.00 0.47 C ATOM 1373 C ASN A 88 12.847 10.510 -5.079 1.00 0.44 C ATOM 1374 O ASN A 88 12.292 11.547 -4.728 1.00 0.45 O ATOM 1375 CB ASN A 88 15.208 10.121 -4.373 1.00 0.61 C ATOM 1376 CG ASN A 88 15.464 11.616 -4.248 1.00 0.78 C ATOM 1377 OD1 ASN A 88 14.860 12.295 -3.419 1.00 0.87 O ATOM 1378 ND2 ASN A 88 16.350 12.142 -5.086 1.00 0.97 N ATOM 0 H ASN A 88 14.372 7.808 -4.654 1.00 0.38 H new ATOM 0 HA ASN A 88 13.486 9.989 -3.096 1.00 0.47 H new ATOM 0 HB2 ASN A 88 15.841 9.589 -3.663 1.00 0.61 H new ATOM 0 HB3 ASN A 88 15.500 9.791 -5.370 1.00 0.61 H new ATOM 0 HD21 ASN A 88 16.550 13.142 -5.056 1.00 0.97 H new ATOM 0 HD22 ASN A 88 16.831 11.546 -5.760 1.00 0.97 H new ATOM 1385 N GLU A 89 12.663 9.966 -6.278 1.00 0.42 N ATOM 1386 CA GLU A 89 11.897 10.647 -7.310 1.00 0.45 C ATOM 1387 C GLU A 89 10.412 10.628 -6.987 1.00 0.38 C ATOM 1388 O GLU A 89 9.625 11.333 -7.613 1.00 0.43 O ATOM 1389 CB GLU A 89 12.142 10.026 -8.682 1.00 0.54 C ATOM 1390 CG GLU A 89 13.580 10.140 -9.157 1.00 0.65 C ATOM 1391 CD GLU A 89 13.704 9.941 -10.649 1.00 1.23 C ATOM 1392 OE1 GLU A 89 13.601 8.783 -11.104 1.00 2.04 O ATOM 1393 OE2 GLU A 89 13.919 10.933 -11.371 1.00 1.28 O ATOM 0 H GLU A 89 13.034 9.057 -6.556 1.00 0.42 H new ATOM 0 HA GLU A 89 12.235 11.683 -7.337 1.00 0.45 H new ATOM 0 HB2 GLU A 89 11.862 8.973 -8.649 1.00 0.54 H new ATOM 0 HB3 GLU A 89 11.489 10.507 -9.410 1.00 0.54 H new ATOM 0 HG2 GLU A 89 13.973 11.121 -8.889 1.00 0.65 H new ATOM 0 HG3 GLU A 89 14.191 9.400 -8.641 1.00 0.65 H new ATOM 1400 N LEU A 90 10.028 9.812 -6.017 1.00 0.31 N ATOM 1401 CA LEU A 90 8.656 9.798 -5.541 1.00 0.27 C ATOM 1402 C LEU A 90 8.411 11.034 -4.692 1.00 0.25 C ATOM 1403 O LEU A 90 7.388 11.700 -4.819 1.00 0.26 O ATOM 1404 CB LEU A 90 8.382 8.542 -4.717 1.00 0.26 C ATOM 1405 CG LEU A 90 8.699 7.223 -5.411 1.00 0.30 C ATOM 1406 CD1 LEU A 90 8.507 6.071 -4.447 1.00 0.31 C ATOM 1407 CD2 LEU A 90 7.829 7.039 -6.642 1.00 0.37 C ATOM 0 H LEU A 90 10.647 9.152 -5.546 1.00 0.31 H new ATOM 0 HA LEU A 90 7.984 9.797 -6.399 1.00 0.27 H new ATOM 0 HB2 LEU A 90 8.963 8.598 -3.797 1.00 0.26 H new ATOM 0 HB3 LEU A 90 7.330 8.539 -4.430 1.00 0.26 H new ATOM 0 HG LEU A 90 9.740 7.242 -5.734 1.00 0.30 H new ATOM 0 HD11 LEU A 90 8.736 5.132 -4.952 1.00 0.31 H new ATOM 0 HD12 LEU A 90 9.173 6.196 -3.593 1.00 0.31 H new ATOM 0 HD13 LEU A 90 7.473 6.054 -4.101 1.00 0.31 H new ATOM 0 HD21 LEU A 90 8.073 6.091 -7.121 1.00 0.37 H new ATOM 0 HD22 LEU A 90 6.779 7.038 -6.349 1.00 0.37 H new ATOM 0 HD23 LEU A 90 8.010 7.856 -7.341 1.00 0.37 H new ATOM 1419 N PHE A 91 9.379 11.344 -3.845 1.00 0.27 N ATOM 1420 CA PHE A 91 9.292 12.502 -2.971 1.00 0.29 C ATOM 1421 C PHE A 91 9.612 13.769 -3.760 1.00 0.33 C ATOM 1422 O PHE A 91 8.935 14.790 -3.627 1.00 0.33 O ATOM 1423 CB PHE A 91 10.268 12.351 -1.797 1.00 0.35 C ATOM 1424 CG PHE A 91 9.916 13.184 -0.596 1.00 0.37 C ATOM 1425 CD1 PHE A 91 10.287 14.518 -0.539 1.00 0.46 C ATOM 1426 CD2 PHE A 91 9.219 12.640 0.471 1.00 0.37 C ATOM 1427 CE1 PHE A 91 9.971 15.293 0.559 1.00 0.53 C ATOM 1428 CE2 PHE A 91 8.901 13.411 1.572 1.00 0.43 C ATOM 1429 CZ PHE A 91 9.257 14.710 1.630 1.00 0.50 C ATOM 0 H PHE A 91 10.239 10.806 -3.744 1.00 0.27 H new ATOM 0 HA PHE A 91 8.279 12.575 -2.576 1.00 0.29 H new ATOM 0 HB2 PHE A 91 10.304 11.303 -1.501 1.00 0.35 H new ATOM 0 HB3 PHE A 91 11.269 12.622 -2.133 1.00 0.35 H new ATOM 0 HD1 PHE A 91 10.830 14.957 -1.363 1.00 0.46 H new ATOM 0 HD2 PHE A 91 8.921 11.602 0.441 1.00 0.37 H new ATOM 0 HE1 PHE A 91 10.266 16.331 0.599 1.00 0.53 H new ATOM 0 HE2 PHE A 91 8.361 12.968 2.396 1.00 0.43 H new ATOM 0 HZ PHE A 91 8.997 15.304 2.494 1.00 0.50 H new ATOM 1439 N ARG A 92 10.628 13.672 -4.613 1.00 0.39 N ATOM 1440 CA ARG A 92 11.122 14.812 -5.376 1.00 0.49 C ATOM 1441 C ARG A 92 10.102 15.270 -6.418 1.00 0.51 C ATOM 1442 O ARG A 92 10.165 16.394 -6.912 1.00 0.62 O ATOM 1443 CB ARG A 92 12.441 14.444 -6.062 1.00 0.56 C ATOM 1444 CG ARG A 92 13.183 15.637 -6.645 1.00 1.24 C ATOM 1445 CD ARG A 92 13.625 16.592 -5.546 1.00 1.54 C ATOM 1446 NE ARG A 92 14.555 15.953 -4.616 1.00 2.30 N ATOM 1447 CZ ARG A 92 14.407 15.942 -3.292 1.00 2.99 C ATOM 1448 NH1 ARG A 92 13.344 16.503 -2.729 1.00 3.13 N ATOM 1449 NH2 ARG A 92 15.323 15.351 -2.535 1.00 3.95 N ATOM 0 H ARG A 92 11.130 12.803 -4.794 1.00 0.39 H new ATOM 0 HA ARG A 92 11.288 15.637 -4.683 1.00 0.49 H new ATOM 0 HB2 ARG A 92 13.087 13.943 -5.341 1.00 0.56 H new ATOM 0 HB3 ARG A 92 12.238 13.729 -6.859 1.00 0.56 H new ATOM 0 HG2 ARG A 92 14.053 15.292 -7.204 1.00 1.24 H new ATOM 0 HG3 ARG A 92 12.539 16.162 -7.351 1.00 1.24 H new ATOM 0 HD2 ARG A 92 14.100 17.466 -5.992 1.00 1.54 H new ATOM 0 HD3 ARG A 92 12.751 16.948 -5.000 1.00 1.54 H new ATOM 0 HE ARG A 92 15.372 15.484 -5.007 1.00 2.30 H new ATOM 0 HH11 ARG A 92 12.633 16.947 -3.311 1.00 3.13 H new ATOM 0 HH12 ARG A 92 13.238 16.490 -1.715 1.00 3.13 H new ATOM 0 HH21 ARG A 92 16.134 14.909 -2.968 1.00 3.95 H new ATOM 0 HH22 ARG A 92 15.216 15.339 -1.521 1.00 3.95 H new ATOM 1463 N ASP A 93 9.159 14.396 -6.737 1.00 0.46 N ATOM 1464 CA ASP A 93 8.127 14.703 -7.726 1.00 0.53 C ATOM 1465 C ASP A 93 7.026 15.567 -7.111 1.00 0.50 C ATOM 1466 O ASP A 93 6.075 15.962 -7.788 1.00 0.60 O ATOM 1467 CB ASP A 93 7.531 13.400 -8.289 1.00 0.62 C ATOM 1468 CG ASP A 93 6.459 13.637 -9.334 1.00 0.90 C ATOM 1469 OD1 ASP A 93 6.784 14.183 -10.410 1.00 1.14 O ATOM 1470 OD2 ASP A 93 5.287 13.289 -9.081 1.00 1.11 O ATOM 0 H ASP A 93 9.084 13.465 -6.326 1.00 0.46 H new ATOM 0 HA ASP A 93 8.586 15.264 -8.540 1.00 0.53 H new ATOM 0 HB2 ASP A 93 8.330 12.802 -8.727 1.00 0.62 H new ATOM 0 HB3 ASP A 93 7.109 12.818 -7.470 1.00 0.62 H new ATOM 1475 N GLY A 94 7.169 15.901 -5.837 1.00 0.45 N ATOM 1476 CA GLY A 94 6.103 16.607 -5.159 1.00 0.47 C ATOM 1477 C GLY A 94 5.201 15.651 -4.419 1.00 0.39 C ATOM 1478 O GLY A 94 3.991 15.860 -4.378 1.00 0.42 O ATOM 0 H GLY A 94 7.991 15.699 -5.268 1.00 0.45 H new ATOM 0 HA2 GLY A 94 6.527 17.327 -4.459 1.00 0.47 H new ATOM 0 HA3 GLY A 94 5.520 17.174 -5.884 1.00 0.47 H new ATOM 1482 N VAL A 95 5.822 14.595 -3.873 1.00 0.32 N ATOM 1483 CA VAL A 95 5.147 13.436 -3.267 1.00 0.26 C ATOM 1484 C VAL A 95 3.687 13.682 -2.880 1.00 0.25 C ATOM 1485 O VAL A 95 3.374 14.460 -1.977 1.00 0.29 O ATOM 1486 CB VAL A 95 5.932 12.928 -2.031 1.00 0.31 C ATOM 1487 CG1 VAL A 95 6.225 14.059 -1.061 1.00 0.40 C ATOM 1488 CG2 VAL A 95 5.181 11.802 -1.332 1.00 0.33 C ATOM 0 H VAL A 95 6.839 14.521 -3.840 1.00 0.32 H new ATOM 0 HA VAL A 95 5.133 12.677 -4.049 1.00 0.26 H new ATOM 0 HB VAL A 95 6.885 12.534 -2.385 1.00 0.31 H new ATOM 0 HG11 VAL A 95 6.776 13.670 -0.205 1.00 0.40 H new ATOM 0 HG12 VAL A 95 6.822 14.822 -1.561 1.00 0.40 H new ATOM 0 HG13 VAL A 95 5.287 14.498 -0.720 1.00 0.40 H new ATOM 0 HG21 VAL A 95 5.754 11.464 -0.468 1.00 0.33 H new ATOM 0 HG22 VAL A 95 4.207 12.164 -1.003 1.00 0.33 H new ATOM 0 HG23 VAL A 95 5.044 10.971 -2.024 1.00 0.33 H new ATOM 1498 N ASN A 96 2.805 13.042 -3.627 1.00 0.24 N ATOM 1499 CA ASN A 96 1.391 12.977 -3.283 1.00 0.29 C ATOM 1500 C ASN A 96 1.131 11.648 -2.584 1.00 0.23 C ATOM 1501 O ASN A 96 2.047 10.832 -2.455 1.00 0.21 O ATOM 1502 CB ASN A 96 0.508 13.085 -4.538 1.00 0.41 C ATOM 1503 CG ASN A 96 0.644 14.410 -5.272 1.00 1.33 C ATOM 1504 OD1 ASN A 96 0.488 14.470 -6.492 1.00 2.13 O ATOM 1505 ND2 ASN A 96 0.918 15.478 -4.542 1.00 2.00 N ATOM 0 H ASN A 96 3.046 12.552 -4.489 1.00 0.24 H new ATOM 0 HA ASN A 96 1.142 13.812 -2.629 1.00 0.29 H new ATOM 0 HB2 ASN A 96 0.762 12.274 -5.221 1.00 0.41 H new ATOM 0 HB3 ASN A 96 -0.534 12.945 -4.251 1.00 0.41 H new ATOM 0 HD21 ASN A 96 1.007 16.391 -4.988 1.00 2.00 H new ATOM 0 HD22 ASN A 96 1.040 15.389 -3.533 1.00 2.00 H new ATOM 1512 N TRP A 97 -0.101 11.407 -2.142 1.00 0.25 N ATOM 1513 CA TRP A 97 -0.429 10.134 -1.498 1.00 0.24 C ATOM 1514 C TRP A 97 -0.202 8.962 -2.456 1.00 0.25 C ATOM 1515 O TRP A 97 0.102 7.848 -2.025 1.00 0.25 O ATOM 1516 CB TRP A 97 -1.875 10.116 -0.986 1.00 0.27 C ATOM 1517 CG TRP A 97 -2.118 11.041 0.174 1.00 0.28 C ATOM 1518 CD1 TRP A 97 -2.914 12.152 0.184 1.00 0.32 C ATOM 1519 CD2 TRP A 97 -1.565 10.935 1.496 1.00 0.27 C ATOM 1520 NE1 TRP A 97 -2.889 12.739 1.425 1.00 0.34 N ATOM 1521 CE2 TRP A 97 -2.069 12.014 2.245 1.00 0.30 C ATOM 1522 CE3 TRP A 97 -0.694 10.036 2.119 1.00 0.26 C ATOM 1523 CZ2 TRP A 97 -1.733 12.219 3.579 1.00 0.32 C ATOM 1524 CZ3 TRP A 97 -0.361 10.240 3.446 1.00 0.27 C ATOM 1525 CH2 TRP A 97 -0.880 11.325 4.163 1.00 0.30 C ATOM 0 H TRP A 97 -0.878 12.063 -2.215 1.00 0.25 H new ATOM 0 HA TRP A 97 0.238 10.026 -0.642 1.00 0.24 H new ATOM 0 HB2 TRP A 97 -2.543 10.389 -1.803 1.00 0.27 H new ATOM 0 HB3 TRP A 97 -2.133 9.100 -0.689 1.00 0.27 H new ATOM 0 HD1 TRP A 97 -3.480 12.515 -0.661 1.00 0.32 H new ATOM 0 HE1 TRP A 97 -3.400 13.580 1.692 1.00 0.34 H new ATOM 0 HE3 TRP A 97 -0.288 9.197 1.574 1.00 0.26 H new ATOM 0 HZ2 TRP A 97 -2.132 13.055 4.134 1.00 0.32 H new ATOM 0 HZ3 TRP A 97 0.310 9.551 3.937 1.00 0.27 H new ATOM 0 HH2 TRP A 97 -0.601 11.458 5.198 1.00 0.30 H new ATOM 1536 N GLY A 98 -0.318 9.227 -3.756 1.00 0.27 N ATOM 1537 CA GLY A 98 -0.134 8.188 -4.753 1.00 0.29 C ATOM 1538 C GLY A 98 1.306 7.723 -4.861 1.00 0.26 C ATOM 1539 O GLY A 98 1.575 6.639 -5.374 1.00 0.27 O ATOM 0 H GLY A 98 -0.537 10.148 -4.136 1.00 0.27 H new ATOM 0 HA2 GLY A 98 -0.768 7.337 -4.505 1.00 0.29 H new ATOM 0 HA3 GLY A 98 -0.464 8.559 -5.723 1.00 0.29 H new ATOM 1543 N ARG A 99 2.234 8.536 -4.372 1.00 0.26 N ATOM 1544 CA ARG A 99 3.646 8.168 -4.388 1.00 0.25 C ATOM 1545 C ARG A 99 3.905 7.107 -3.334 1.00 0.21 C ATOM 1546 O ARG A 99 4.730 6.216 -3.521 1.00 0.20 O ATOM 1547 CB ARG A 99 4.548 9.381 -4.140 1.00 0.30 C ATOM 1548 CG ARG A 99 4.533 10.430 -5.248 1.00 0.70 C ATOM 1549 CD ARG A 99 5.033 9.882 -6.581 1.00 1.40 C ATOM 1550 NE ARG A 99 4.007 9.125 -7.298 1.00 1.74 N ATOM 1551 CZ ARG A 99 4.211 8.516 -8.466 1.00 2.46 C ATOM 1552 NH1 ARG A 99 5.410 8.558 -9.041 1.00 3.06 N ATOM 1553 NH2 ARG A 99 3.213 7.878 -9.064 1.00 2.98 N ATOM 0 H ARG A 99 2.037 9.449 -3.962 1.00 0.26 H new ATOM 0 HA ARG A 99 3.883 7.775 -5.377 1.00 0.25 H new ATOM 0 HB2 ARG A 99 4.246 9.855 -3.206 1.00 0.30 H new ATOM 0 HB3 ARG A 99 5.572 9.032 -4.004 1.00 0.30 H new ATOM 0 HG2 ARG A 99 3.518 10.807 -5.372 1.00 0.70 H new ATOM 0 HG3 ARG A 99 5.153 11.276 -4.951 1.00 0.70 H new ATOM 0 HD2 ARG A 99 5.372 10.709 -7.205 1.00 1.40 H new ATOM 0 HD3 ARG A 99 5.896 9.240 -6.405 1.00 1.40 H new ATOM 0 HE ARG A 99 3.079 9.059 -6.879 1.00 1.74 H new ATOM 0 HH11 ARG A 99 6.176 9.057 -8.588 1.00 3.06 H new ATOM 0 HH12 ARG A 99 5.564 8.091 -9.935 1.00 3.06 H new ATOM 0 HH21 ARG A 99 2.290 7.854 -8.630 1.00 2.98 H new ATOM 0 HH22 ARG A 99 3.369 7.412 -9.958 1.00 2.98 H new ATOM 1567 N ILE A 100 3.175 7.208 -2.232 1.00 0.22 N ATOM 1568 CA ILE A 100 3.228 6.207 -1.182 1.00 0.21 C ATOM 1569 C ILE A 100 2.632 4.909 -1.700 1.00 0.20 C ATOM 1570 O ILE A 100 3.181 3.827 -1.494 1.00 0.19 O ATOM 1571 CB ILE A 100 2.457 6.679 0.070 1.00 0.24 C ATOM 1572 CG1 ILE A 100 3.106 7.938 0.647 1.00 0.26 C ATOM 1573 CG2 ILE A 100 2.402 5.576 1.115 1.00 0.24 C ATOM 1574 CD1 ILE A 100 2.471 8.414 1.932 1.00 0.30 C ATOM 0 H ILE A 100 2.535 7.980 -2.044 1.00 0.22 H new ATOM 0 HA ILE A 100 4.268 6.049 -0.898 1.00 0.21 H new ATOM 0 HB ILE A 100 1.435 6.919 -0.222 1.00 0.24 H new ATOM 0 HG12 ILE A 100 4.163 7.742 0.825 1.00 0.26 H new ATOM 0 HG13 ILE A 100 3.050 8.736 -0.093 1.00 0.26 H new ATOM 0 HG21 ILE A 100 1.854 5.930 1.989 1.00 0.24 H new ATOM 0 HG22 ILE A 100 1.897 4.705 0.698 1.00 0.24 H new ATOM 0 HG23 ILE A 100 3.415 5.302 1.408 1.00 0.24 H new ATOM 0 HD11 ILE A 100 2.984 9.310 2.281 1.00 0.30 H new ATOM 0 HD12 ILE A 100 1.420 8.643 1.756 1.00 0.30 H new ATOM 0 HD13 ILE A 100 2.550 7.633 2.688 1.00 0.30 H new ATOM 1586 N VAL A 101 1.511 5.041 -2.395 1.00 0.21 N ATOM 1587 CA VAL A 101 0.866 3.915 -3.045 1.00 0.21 C ATOM 1588 C VAL A 101 1.841 3.219 -3.977 1.00 0.20 C ATOM 1589 O VAL A 101 2.061 2.010 -3.883 1.00 0.21 O ATOM 1590 CB VAL A 101 -0.344 4.379 -3.865 1.00 0.25 C ATOM 1591 CG1 VAL A 101 -1.020 3.197 -4.527 1.00 0.29 C ATOM 1592 CG2 VAL A 101 -1.315 5.139 -2.988 1.00 0.26 C ATOM 0 H VAL A 101 1.026 5.929 -2.522 1.00 0.21 H new ATOM 0 HA VAL A 101 0.535 3.227 -2.267 1.00 0.21 H new ATOM 0 HB VAL A 101 0.003 5.052 -4.649 1.00 0.25 H new ATOM 0 HG11 VAL A 101 -1.877 3.544 -5.105 1.00 0.29 H new ATOM 0 HG12 VAL A 101 -0.313 2.698 -5.190 1.00 0.29 H new ATOM 0 HG13 VAL A 101 -1.358 2.496 -3.763 1.00 0.29 H new ATOM 0 HG21 VAL A 101 -2.168 5.462 -3.585 1.00 0.26 H new ATOM 0 HG22 VAL A 101 -1.660 4.492 -2.181 1.00 0.26 H new ATOM 0 HG23 VAL A 101 -0.817 6.012 -2.565 1.00 0.26 H new ATOM 1602 N ALA A 102 2.413 4.004 -4.879 1.00 0.19 N ATOM 1603 CA ALA A 102 3.384 3.504 -5.832 1.00 0.19 C ATOM 1604 C ALA A 102 4.534 2.813 -5.116 1.00 0.17 C ATOM 1605 O ALA A 102 4.921 1.708 -5.480 1.00 0.19 O ATOM 1606 CB ALA A 102 3.896 4.641 -6.699 1.00 0.21 C ATOM 0 H ALA A 102 2.216 5.001 -4.968 1.00 0.19 H new ATOM 0 HA ALA A 102 2.897 2.769 -6.473 1.00 0.19 H new ATOM 0 HB1 ALA A 102 4.625 4.255 -7.412 1.00 0.21 H new ATOM 0 HB2 ALA A 102 3.063 5.090 -7.239 1.00 0.21 H new ATOM 0 HB3 ALA A 102 4.368 5.395 -6.069 1.00 0.21 H new ATOM 1612 N PHE A 103 5.043 3.461 -4.073 1.00 0.16 N ATOM 1613 CA PHE A 103 6.169 2.935 -3.303 1.00 0.17 C ATOM 1614 C PHE A 103 5.874 1.533 -2.775 1.00 0.17 C ATOM 1615 O PHE A 103 6.695 0.622 -2.907 1.00 0.21 O ATOM 1616 CB PHE A 103 6.499 3.876 -2.136 1.00 0.17 C ATOM 1617 CG PHE A 103 7.651 3.406 -1.292 1.00 0.19 C ATOM 1618 CD1 PHE A 103 8.938 3.360 -1.806 1.00 0.29 C ATOM 1619 CD2 PHE A 103 7.444 3.012 0.018 1.00 0.17 C ATOM 1620 CE1 PHE A 103 9.993 2.931 -1.028 1.00 0.32 C ATOM 1621 CE2 PHE A 103 8.497 2.582 0.801 1.00 0.20 C ATOM 1622 CZ PHE A 103 9.784 2.533 0.254 1.00 0.26 C ATOM 0 H PHE A 103 4.692 4.358 -3.738 1.00 0.16 H new ATOM 0 HA PHE A 103 7.029 2.872 -3.969 1.00 0.17 H new ATOM 0 HB2 PHE A 103 6.729 4.865 -2.532 1.00 0.17 H new ATOM 0 HB3 PHE A 103 5.617 3.982 -1.505 1.00 0.17 H new ATOM 0 HD1 PHE A 103 9.116 3.664 -2.827 1.00 0.29 H new ATOM 0 HD2 PHE A 103 6.447 3.041 0.433 1.00 0.17 H new ATOM 0 HE1 PHE A 103 10.991 2.911 -1.440 1.00 0.32 H new ATOM 0 HE2 PHE A 103 8.329 2.286 1.826 1.00 0.20 H new ATOM 0 HZ PHE A 103 10.611 2.179 0.851 1.00 0.26 H new ATOM 1632 N PHE A 104 4.696 1.360 -2.197 1.00 0.16 N ATOM 1633 CA PHE A 104 4.313 0.078 -1.622 1.00 0.18 C ATOM 1634 C PHE A 104 4.023 -0.940 -2.720 1.00 0.19 C ATOM 1635 O PHE A 104 4.319 -2.127 -2.576 1.00 0.23 O ATOM 1636 CB PHE A 104 3.099 0.242 -0.702 1.00 0.19 C ATOM 1637 CG PHE A 104 3.436 0.791 0.662 1.00 0.21 C ATOM 1638 CD1 PHE A 104 3.998 2.051 0.810 1.00 0.24 C ATOM 1639 CD2 PHE A 104 3.191 0.039 1.800 1.00 0.29 C ATOM 1640 CE1 PHE A 104 4.306 2.548 2.061 1.00 0.27 C ATOM 1641 CE2 PHE A 104 3.499 0.532 3.053 1.00 0.33 C ATOM 1642 CZ PHE A 104 4.056 1.787 3.184 1.00 0.30 C ATOM 0 H PHE A 104 3.988 2.090 -2.113 1.00 0.16 H new ATOM 0 HA PHE A 104 5.147 -0.293 -1.026 1.00 0.18 H new ATOM 0 HB2 PHE A 104 2.379 0.905 -1.182 1.00 0.19 H new ATOM 0 HB3 PHE A 104 2.612 -0.726 -0.583 1.00 0.19 H new ATOM 0 HD1 PHE A 104 4.197 2.651 -0.065 1.00 0.24 H new ATOM 0 HD2 PHE A 104 2.754 -0.944 1.706 1.00 0.29 H new ATOM 0 HE1 PHE A 104 4.742 3.531 2.160 1.00 0.27 H new ATOM 0 HE2 PHE A 104 3.303 -0.066 3.931 1.00 0.33 H new ATOM 0 HZ PHE A 104 4.296 2.173 4.164 1.00 0.30 H new ATOM 1652 N SER A 105 3.466 -0.468 -3.826 1.00 0.18 N ATOM 1653 CA SER A 105 3.166 -1.337 -4.955 1.00 0.21 C ATOM 1654 C SER A 105 4.452 -1.819 -5.630 1.00 0.21 C ATOM 1655 O SER A 105 4.499 -2.929 -6.167 1.00 0.23 O ATOM 1656 CB SER A 105 2.276 -0.606 -5.961 1.00 0.25 C ATOM 1657 OG SER A 105 1.086 -0.141 -5.344 1.00 1.04 O ATOM 0 H SER A 105 3.213 0.510 -3.966 1.00 0.18 H new ATOM 0 HA SER A 105 2.632 -2.211 -4.583 1.00 0.21 H new ATOM 0 HB2 SER A 105 2.821 0.236 -6.389 1.00 0.25 H new ATOM 0 HB3 SER A 105 2.025 -1.275 -6.784 1.00 0.25 H new ATOM 0 HG SER A 105 1.293 0.626 -4.770 1.00 1.04 H new ATOM 1663 N PHE A 106 5.497 -0.990 -5.594 1.00 0.20 N ATOM 1664 CA PHE A 106 6.784 -1.359 -6.173 1.00 0.21 C ATOM 1665 C PHE A 106 7.381 -2.529 -5.418 1.00 0.22 C ATOM 1666 O PHE A 106 7.788 -3.518 -6.021 1.00 0.24 O ATOM 1667 CB PHE A 106 7.776 -0.187 -6.151 1.00 0.23 C ATOM 1668 CG PHE A 106 7.383 0.981 -7.011 1.00 0.24 C ATOM 1669 CD1 PHE A 106 6.606 0.786 -8.142 1.00 0.30 C ATOM 1670 CD2 PHE A 106 7.788 2.270 -6.696 1.00 0.27 C ATOM 1671 CE1 PHE A 106 6.241 1.849 -8.941 1.00 0.35 C ATOM 1672 CE2 PHE A 106 7.424 3.338 -7.493 1.00 0.30 C ATOM 1673 CZ PHE A 106 6.666 3.155 -8.582 1.00 0.33 C ATOM 0 H PHE A 106 5.475 -0.062 -5.171 1.00 0.20 H new ATOM 0 HA PHE A 106 6.604 -1.637 -7.211 1.00 0.21 H new ATOM 0 HB2 PHE A 106 7.889 0.157 -5.123 1.00 0.23 H new ATOM 0 HB3 PHE A 106 8.752 -0.548 -6.475 1.00 0.23 H new ATOM 0 HD1 PHE A 106 6.282 -0.211 -8.401 1.00 0.30 H new ATOM 0 HD2 PHE A 106 8.394 2.440 -5.819 1.00 0.27 H new ATOM 0 HE1 PHE A 106 5.642 1.691 -9.825 1.00 0.35 H new ATOM 0 HE2 PHE A 106 7.755 4.333 -7.235 1.00 0.30 H new ATOM 0 HZ PHE A 106 6.378 4.002 -9.187 1.00 0.33 H new ATOM 1683 N GLY A 107 7.419 -2.417 -4.093 1.00 0.23 N ATOM 1684 CA GLY A 107 7.941 -3.494 -3.273 1.00 0.27 C ATOM 1685 C GLY A 107 7.182 -4.784 -3.488 1.00 0.32 C ATOM 1686 O GLY A 107 7.770 -5.865 -3.499 1.00 0.37 O ATOM 0 H GLY A 107 7.098 -1.600 -3.574 1.00 0.23 H new ATOM 0 HA2 GLY A 107 8.995 -3.649 -3.505 1.00 0.27 H new ATOM 0 HA3 GLY A 107 7.885 -3.210 -2.222 1.00 0.27 H new ATOM 1690 N GLY A 108 5.874 -4.659 -3.674 1.00 0.33 N ATOM 1691 CA GLY A 108 5.036 -5.812 -3.946 1.00 0.41 C ATOM 1692 C GLY A 108 5.426 -6.527 -5.225 1.00 0.42 C ATOM 1693 O GLY A 108 5.196 -7.723 -5.369 1.00 0.63 O ATOM 0 H GLY A 108 5.374 -3.770 -3.641 1.00 0.33 H new ATOM 0 HA2 GLY A 108 5.101 -6.509 -3.110 1.00 0.41 H new ATOM 0 HA3 GLY A 108 3.996 -5.493 -4.015 1.00 0.41 H new ATOM 1697 N ALA A 109 6.014 -5.794 -6.153 1.00 0.27 N ATOM 1698 CA ALA A 109 6.502 -6.380 -7.389 1.00 0.26 C ATOM 1699 C ALA A 109 7.939 -6.852 -7.220 1.00 0.23 C ATOM 1700 O ALA A 109 8.309 -7.937 -7.672 1.00 0.24 O ATOM 1701 CB ALA A 109 6.405 -5.368 -8.516 1.00 0.29 C ATOM 0 H ALA A 109 6.166 -4.788 -6.074 1.00 0.27 H new ATOM 0 HA ALA A 109 5.884 -7.243 -7.638 1.00 0.26 H new ATOM 0 HB1 ALA A 109 6.773 -5.815 -9.439 1.00 0.29 H new ATOM 0 HB2 ALA A 109 5.365 -5.068 -8.647 1.00 0.29 H new ATOM 0 HB3 ALA A 109 7.007 -4.493 -8.272 1.00 0.29 H new ATOM 1707 N LEU A 110 8.733 -6.031 -6.548 1.00 0.22 N ATOM 1708 CA LEU A 110 10.145 -6.303 -6.337 1.00 0.23 C ATOM 1709 C LEU A 110 10.353 -7.599 -5.575 1.00 0.21 C ATOM 1710 O LEU A 110 11.192 -8.418 -5.945 1.00 0.21 O ATOM 1711 CB LEU A 110 10.782 -5.150 -5.573 1.00 0.25 C ATOM 1712 CG LEU A 110 10.764 -3.815 -6.302 1.00 0.28 C ATOM 1713 CD1 LEU A 110 11.368 -2.733 -5.433 1.00 0.32 C ATOM 1714 CD2 LEU A 110 11.507 -3.926 -7.620 1.00 0.36 C ATOM 0 H LEU A 110 8.414 -5.155 -6.133 1.00 0.22 H new ATOM 0 HA LEU A 110 10.618 -6.406 -7.313 1.00 0.23 H new ATOM 0 HB2 LEU A 110 10.266 -5.035 -4.620 1.00 0.25 H new ATOM 0 HB3 LEU A 110 11.816 -5.410 -5.346 1.00 0.25 H new ATOM 0 HG LEU A 110 9.730 -3.544 -6.514 1.00 0.28 H new ATOM 0 HD11 LEU A 110 11.348 -1.783 -5.968 1.00 0.32 H new ATOM 0 HD12 LEU A 110 10.792 -2.643 -4.512 1.00 0.32 H new ATOM 0 HD13 LEU A 110 12.399 -2.993 -5.193 1.00 0.32 H new ATOM 0 HD21 LEU A 110 11.486 -2.964 -8.131 1.00 0.36 H new ATOM 0 HD22 LEU A 110 12.541 -4.215 -7.432 1.00 0.36 H new ATOM 0 HD23 LEU A 110 11.028 -4.679 -8.245 1.00 0.36 H new ATOM 1726 N CYS A 111 9.586 -7.776 -4.509 1.00 0.21 N ATOM 1727 CA CYS A 111 9.703 -8.960 -3.674 1.00 0.21 C ATOM 1728 C CYS A 111 9.492 -10.232 -4.489 1.00 0.21 C ATOM 1729 O CYS A 111 10.168 -11.239 -4.276 1.00 0.25 O ATOM 1730 CB CYS A 111 8.702 -8.896 -2.519 1.00 0.22 C ATOM 1731 SG CYS A 111 6.981 -8.694 -3.027 1.00 1.34 S ATOM 0 H CYS A 111 8.875 -7.112 -4.202 1.00 0.21 H new ATOM 0 HA CYS A 111 10.713 -8.986 -3.265 1.00 0.21 H new ATOM 0 HB2 CYS A 111 8.788 -9.809 -1.929 1.00 0.22 H new ATOM 0 HB3 CYS A 111 8.974 -8.067 -1.865 1.00 0.22 H new ATOM 0 HG CYS A 111 6.752 -7.443 -3.298 1.00 1.34 H new ATOM 1737 N VAL A 112 8.573 -10.165 -5.441 1.00 0.19 N ATOM 1738 CA VAL A 112 8.238 -11.310 -6.268 1.00 0.20 C ATOM 1739 C VAL A 112 9.398 -11.677 -7.179 1.00 0.22 C ATOM 1740 O VAL A 112 9.927 -12.788 -7.115 1.00 0.25 O ATOM 1741 CB VAL A 112 7.000 -11.018 -7.128 1.00 0.23 C ATOM 1742 CG1 VAL A 112 6.678 -12.208 -8.012 1.00 0.27 C ATOM 1743 CG2 VAL A 112 5.814 -10.664 -6.248 1.00 0.25 C ATOM 0 H VAL A 112 8.043 -9.321 -5.659 1.00 0.19 H new ATOM 0 HA VAL A 112 8.026 -12.145 -5.600 1.00 0.20 H new ATOM 0 HB VAL A 112 7.215 -10.164 -7.770 1.00 0.23 H new ATOM 0 HG11 VAL A 112 5.798 -11.985 -8.615 1.00 0.27 H new ATOM 0 HG12 VAL A 112 7.524 -12.414 -8.667 1.00 0.27 H new ATOM 0 HG13 VAL A 112 6.480 -13.081 -7.390 1.00 0.27 H new ATOM 0 HG21 VAL A 112 4.945 -10.460 -6.873 1.00 0.25 H new ATOM 0 HG22 VAL A 112 5.594 -11.498 -5.582 1.00 0.25 H new ATOM 0 HG23 VAL A 112 6.051 -9.780 -5.656 1.00 0.25 H new ATOM 1753 N GLU A 113 9.789 -10.733 -8.020 1.00 0.22 N ATOM 1754 CA GLU A 113 10.849 -10.970 -8.990 1.00 0.25 C ATOM 1755 C GLU A 113 12.164 -11.308 -8.295 1.00 0.25 C ATOM 1756 O GLU A 113 13.005 -12.004 -8.853 1.00 0.30 O ATOM 1757 CB GLU A 113 11.024 -9.764 -9.916 1.00 0.29 C ATOM 1758 CG GLU A 113 11.309 -8.459 -9.196 1.00 0.30 C ATOM 1759 CD GLU A 113 11.417 -7.296 -10.156 1.00 0.39 C ATOM 1760 OE1 GLU A 113 10.372 -6.832 -10.660 1.00 0.51 O ATOM 1761 OE2 GLU A 113 12.551 -6.820 -10.390 1.00 0.50 O ATOM 0 H GLU A 113 9.389 -9.795 -8.051 1.00 0.22 H new ATOM 0 HA GLU A 113 10.557 -11.827 -9.597 1.00 0.25 H new ATOM 0 HB2 GLU A 113 11.840 -9.969 -10.609 1.00 0.29 H new ATOM 0 HB3 GLU A 113 10.120 -9.646 -10.514 1.00 0.29 H new ATOM 0 HG2 GLU A 113 10.516 -8.262 -8.475 1.00 0.30 H new ATOM 0 HG3 GLU A 113 12.237 -8.551 -8.632 1.00 0.30 H new ATOM 1768 N SER A 114 12.320 -10.839 -7.064 1.00 0.23 N ATOM 1769 CA SER A 114 13.511 -11.132 -6.288 1.00 0.28 C ATOM 1770 C SER A 114 13.598 -12.630 -6.006 1.00 0.27 C ATOM 1771 O SER A 114 14.681 -13.211 -6.009 1.00 0.31 O ATOM 1772 CB SER A 114 13.503 -10.342 -4.976 1.00 0.33 C ATOM 1773 OG SER A 114 14.738 -10.465 -4.294 1.00 0.99 O ATOM 0 H SER A 114 11.635 -10.255 -6.584 1.00 0.23 H new ATOM 0 HA SER A 114 14.386 -10.832 -6.865 1.00 0.28 H new ATOM 0 HB2 SER A 114 13.303 -9.291 -5.183 1.00 0.33 H new ATOM 0 HB3 SER A 114 12.695 -10.701 -4.338 1.00 0.33 H new ATOM 0 HG SER A 114 14.840 -11.382 -3.964 1.00 0.99 H new ATOM 1779 N VAL A 115 12.448 -13.255 -5.795 1.00 0.28 N ATOM 1780 CA VAL A 115 12.391 -14.681 -5.522 1.00 0.33 C ATOM 1781 C VAL A 115 12.653 -15.478 -6.793 1.00 0.37 C ATOM 1782 O VAL A 115 13.428 -16.436 -6.785 1.00 0.42 O ATOM 1783 CB VAL A 115 11.026 -15.073 -4.936 1.00 0.40 C ATOM 1784 CG1 VAL A 115 10.934 -16.578 -4.745 1.00 0.45 C ATOM 1785 CG2 VAL A 115 10.801 -14.351 -3.619 1.00 0.41 C ATOM 0 H VAL A 115 11.539 -12.793 -5.808 1.00 0.28 H new ATOM 0 HA VAL A 115 13.165 -14.913 -4.790 1.00 0.33 H new ATOM 0 HB VAL A 115 10.246 -14.775 -5.637 1.00 0.40 H new ATOM 0 HG11 VAL A 115 9.959 -16.833 -4.329 1.00 0.45 H new ATOM 0 HG12 VAL A 115 11.059 -17.075 -5.707 1.00 0.45 H new ATOM 0 HG13 VAL A 115 11.717 -16.907 -4.062 1.00 0.45 H new ATOM 0 HG21 VAL A 115 9.831 -14.634 -3.210 1.00 0.41 H new ATOM 0 HG22 VAL A 115 11.586 -14.626 -2.915 1.00 0.41 H new ATOM 0 HG23 VAL A 115 10.824 -13.274 -3.786 1.00 0.41 H new ATOM 1795 N ASP A 116 12.010 -15.074 -7.883 1.00 0.38 N ATOM 1796 CA ASP A 116 12.214 -15.725 -9.176 1.00 0.46 C ATOM 1797 C ASP A 116 13.674 -15.653 -9.606 1.00 0.47 C ATOM 1798 O ASP A 116 14.185 -16.566 -10.248 1.00 0.56 O ATOM 1799 CB ASP A 116 11.326 -15.100 -10.255 1.00 0.49 C ATOM 1800 CG ASP A 116 9.899 -15.603 -10.203 1.00 1.08 C ATOM 1801 OD1 ASP A 116 9.622 -16.691 -10.751 1.00 1.23 O ATOM 1802 OD2 ASP A 116 9.043 -14.914 -9.608 1.00 1.89 O ATOM 0 H ASP A 116 11.345 -14.301 -7.899 1.00 0.38 H new ATOM 0 HA ASP A 116 11.937 -16.772 -9.057 1.00 0.46 H new ATOM 0 HB2 ASP A 116 11.329 -14.016 -10.139 1.00 0.49 H new ATOM 0 HB3 ASP A 116 11.747 -15.317 -11.237 1.00 0.49 H new ATOM 1807 N LYS A 117 14.351 -14.574 -9.226 1.00 0.43 N ATOM 1808 CA LYS A 117 15.763 -14.402 -9.561 1.00 0.49 C ATOM 1809 C LYS A 117 16.653 -15.098 -8.535 1.00 0.47 C ATOM 1810 O LYS A 117 17.875 -14.938 -8.551 1.00 0.52 O ATOM 1811 CB LYS A 117 16.121 -12.913 -9.658 1.00 0.53 C ATOM 1812 CG LYS A 117 15.339 -12.171 -10.730 1.00 0.61 C ATOM 1813 CD LYS A 117 15.681 -10.691 -10.750 1.00 1.20 C ATOM 1814 CE LYS A 117 14.753 -9.921 -11.680 1.00 1.32 C ATOM 1815 NZ LYS A 117 14.721 -10.514 -13.043 1.00 1.90 N ATOM 0 H LYS A 117 13.948 -13.807 -8.688 1.00 0.43 H new ATOM 0 HA LYS A 117 15.937 -14.862 -10.534 1.00 0.49 H new ATOM 0 HB2 LYS A 117 15.939 -12.440 -8.693 1.00 0.53 H new ATOM 0 HB3 LYS A 117 17.187 -12.816 -9.864 1.00 0.53 H new ATOM 0 HG2 LYS A 117 15.554 -12.608 -11.705 1.00 0.61 H new ATOM 0 HG3 LYS A 117 14.271 -12.296 -10.553 1.00 0.61 H new ATOM 0 HD2 LYS A 117 15.607 -10.285 -9.741 1.00 1.20 H new ATOM 0 HD3 LYS A 117 16.714 -10.559 -11.072 1.00 1.20 H new ATOM 0 HE2 LYS A 117 13.746 -9.913 -11.263 1.00 1.32 H new ATOM 0 HE3 LYS A 117 15.080 -8.883 -11.743 1.00 1.32 H new ATOM 0 HZ1 LYS A 117 14.233 -9.865 -13.693 1.00 1.90 H new ATOM 0 HZ2 LYS A 117 15.694 -10.671 -13.376 1.00 1.90 H new ATOM 0 HZ3 LYS A 117 14.214 -11.422 -13.015 1.00 1.90 H new ATOM 1829 N GLU A 118 16.020 -15.870 -7.648 1.00 0.45 N ATOM 1830 CA GLU A 118 16.716 -16.695 -6.660 1.00 0.49 C ATOM 1831 C GLU A 118 17.438 -15.842 -5.627 1.00 0.45 C ATOM 1832 O GLU A 118 18.413 -16.272 -5.014 1.00 0.55 O ATOM 1833 CB GLU A 118 17.690 -17.650 -7.350 1.00 0.59 C ATOM 1834 CG GLU A 118 17.016 -18.547 -8.373 1.00 1.07 C ATOM 1835 CD GLU A 118 17.967 -19.541 -8.991 1.00 1.72 C ATOM 1836 OE1 GLU A 118 18.140 -20.636 -8.418 1.00 1.89 O ATOM 1837 OE2 GLU A 118 18.547 -19.233 -10.054 1.00 2.54 O ATOM 0 H GLU A 118 15.004 -15.940 -7.596 1.00 0.45 H new ATOM 0 HA GLU A 118 15.966 -17.284 -6.132 1.00 0.49 H new ATOM 0 HB2 GLU A 118 18.472 -17.071 -7.842 1.00 0.59 H new ATOM 0 HB3 GLU A 118 18.178 -18.269 -6.597 1.00 0.59 H new ATOM 0 HG2 GLU A 118 16.196 -19.083 -7.896 1.00 1.07 H new ATOM 0 HG3 GLU A 118 16.579 -17.931 -9.159 1.00 1.07 H new ATOM 1844 N MET A 119 16.931 -14.643 -5.415 1.00 0.35 N ATOM 1845 CA MET A 119 17.489 -13.741 -4.427 1.00 0.33 C ATOM 1846 C MET A 119 16.552 -13.672 -3.227 1.00 0.31 C ATOM 1847 O MET A 119 15.878 -12.666 -2.994 1.00 0.27 O ATOM 1848 CB MET A 119 17.705 -12.350 -5.028 1.00 0.34 C ATOM 1849 CG MET A 119 18.570 -12.358 -6.280 1.00 0.41 C ATOM 1850 SD MET A 119 18.755 -10.723 -7.017 1.00 0.47 S ATOM 1851 CE MET A 119 17.040 -10.232 -7.179 1.00 0.44 C ATOM 0 H MET A 119 16.127 -14.269 -5.919 1.00 0.35 H new ATOM 0 HA MET A 119 18.460 -14.116 -4.103 1.00 0.33 H new ATOM 0 HB2 MET A 119 16.736 -11.912 -5.268 1.00 0.34 H new ATOM 0 HB3 MET A 119 18.169 -11.707 -4.280 1.00 0.34 H new ATOM 0 HG2 MET A 119 19.555 -12.753 -6.032 1.00 0.41 H new ATOM 0 HG3 MET A 119 18.131 -13.034 -7.014 1.00 0.41 H new ATOM 0 HE1 MET A 119 16.908 -9.670 -8.104 1.00 0.44 H new ATOM 0 HE2 MET A 119 16.408 -11.120 -7.201 1.00 0.44 H new ATOM 0 HE3 MET A 119 16.759 -9.607 -6.331 1.00 0.44 H new ATOM 1861 N GLN A 120 16.505 -14.767 -2.481 1.00 0.36 N ATOM 1862 CA GLN A 120 15.591 -14.902 -1.352 1.00 0.39 C ATOM 1863 C GLN A 120 16.047 -14.056 -0.170 1.00 0.41 C ATOM 1864 O GLN A 120 15.289 -13.819 0.770 1.00 0.47 O ATOM 1865 CB GLN A 120 15.475 -16.369 -0.933 1.00 0.49 C ATOM 1866 CG GLN A 120 14.860 -17.271 -2.002 1.00 0.53 C ATOM 1867 CD GLN A 120 14.892 -18.740 -1.615 1.00 0.65 C ATOM 1868 OE1 GLN A 120 14.868 -19.084 -0.432 1.00 0.71 O ATOM 1869 NE2 GLN A 120 14.922 -19.620 -2.607 1.00 0.70 N ATOM 0 H GLN A 120 17.095 -15.584 -2.639 1.00 0.36 H new ATOM 0 HA GLN A 120 14.612 -14.544 -1.670 1.00 0.39 H new ATOM 0 HB2 GLN A 120 16.467 -16.744 -0.681 1.00 0.49 H new ATOM 0 HB3 GLN A 120 14.871 -16.432 -0.028 1.00 0.49 H new ATOM 0 HG2 GLN A 120 13.828 -16.968 -2.178 1.00 0.53 H new ATOM 0 HG3 GLN A 120 15.397 -17.134 -2.941 1.00 0.53 H new ATOM 0 HE21 GLN A 120 14.941 -19.297 -3.574 1.00 0.70 H new ATOM 0 HE22 GLN A 120 14.926 -20.619 -2.402 1.00 0.70 H new ATOM 1878 N VAL A 121 17.289 -13.604 -0.208 1.00 0.39 N ATOM 1879 CA VAL A 121 17.785 -12.698 0.811 1.00 0.44 C ATOM 1880 C VAL A 121 17.378 -11.262 0.494 1.00 0.38 C ATOM 1881 O VAL A 121 17.199 -10.441 1.394 1.00 0.47 O ATOM 1882 CB VAL A 121 19.315 -12.783 0.962 1.00 0.52 C ATOM 1883 CG1 VAL A 121 19.720 -14.153 1.476 1.00 0.98 C ATOM 1884 CG2 VAL A 121 20.010 -12.482 -0.354 1.00 0.92 C ATOM 0 H VAL A 121 17.968 -13.848 -0.929 1.00 0.39 H new ATOM 0 HA VAL A 121 17.337 -13.003 1.757 1.00 0.44 H new ATOM 0 HB VAL A 121 19.627 -12.031 1.687 1.00 0.52 H new ATOM 0 HG11 VAL A 121 20.804 -14.198 1.577 1.00 0.98 H new ATOM 0 HG12 VAL A 121 19.257 -14.329 2.447 1.00 0.98 H new ATOM 0 HG13 VAL A 121 19.390 -14.918 0.773 1.00 0.98 H new ATOM 0 HG21 VAL A 121 21.090 -12.549 -0.219 1.00 0.92 H new ATOM 0 HG22 VAL A 121 19.693 -13.204 -1.106 1.00 0.92 H new ATOM 0 HG23 VAL A 121 19.747 -11.477 -0.683 1.00 0.92 H new ATOM 1894 N LEU A 122 17.202 -10.971 -0.789 1.00 0.30 N ATOM 1895 CA LEU A 122 16.852 -9.627 -1.217 1.00 0.27 C ATOM 1896 C LEU A 122 15.383 -9.329 -0.982 1.00 0.23 C ATOM 1897 O LEU A 122 15.038 -8.219 -0.600 1.00 0.23 O ATOM 1898 CB LEU A 122 17.208 -9.391 -2.681 1.00 0.28 C ATOM 1899 CG LEU A 122 18.612 -8.843 -2.921 1.00 0.37 C ATOM 1900 CD1 LEU A 122 19.662 -9.832 -2.461 1.00 0.39 C ATOM 1901 CD2 LEU A 122 18.796 -8.509 -4.384 1.00 0.41 C ATOM 0 H LEU A 122 17.296 -11.647 -1.547 1.00 0.30 H new ATOM 0 HA LEU A 122 17.442 -8.942 -0.607 1.00 0.27 H new ATOM 0 HB2 LEU A 122 17.104 -10.332 -3.221 1.00 0.28 H new ATOM 0 HB3 LEU A 122 16.485 -8.696 -3.108 1.00 0.28 H new ATOM 0 HG LEU A 122 18.733 -7.931 -2.337 1.00 0.37 H new ATOM 0 HD11 LEU A 122 20.655 -9.420 -2.642 1.00 0.39 H new ATOM 0 HD12 LEU A 122 19.538 -10.025 -1.395 1.00 0.39 H new ATOM 0 HD13 LEU A 122 19.550 -10.765 -3.014 1.00 0.39 H new ATOM 0 HD21 LEU A 122 19.801 -8.119 -4.545 1.00 0.41 H new ATOM 0 HD22 LEU A 122 18.656 -9.409 -4.983 1.00 0.41 H new ATOM 0 HD23 LEU A 122 18.064 -7.758 -4.681 1.00 0.41 H new ATOM 1913 N VAL A 123 14.523 -10.319 -1.193 1.00 0.23 N ATOM 1914 CA VAL A 123 13.091 -10.134 -0.979 1.00 0.25 C ATOM 1915 C VAL A 123 12.814 -9.667 0.449 1.00 0.27 C ATOM 1916 O VAL A 123 11.969 -8.803 0.682 1.00 0.31 O ATOM 1917 CB VAL A 123 12.290 -11.424 -1.279 1.00 0.28 C ATOM 1918 CG1 VAL A 123 12.819 -12.603 -0.485 1.00 0.31 C ATOM 1919 CG2 VAL A 123 10.815 -11.212 -0.994 1.00 0.31 C ATOM 0 H VAL A 123 14.789 -11.251 -1.510 1.00 0.23 H new ATOM 0 HA VAL A 123 12.760 -9.365 -1.677 1.00 0.25 H new ATOM 0 HB VAL A 123 12.414 -11.653 -2.337 1.00 0.28 H new ATOM 0 HG11 VAL A 123 12.234 -13.492 -0.720 1.00 0.31 H new ATOM 0 HG12 VAL A 123 13.863 -12.777 -0.744 1.00 0.31 H new ATOM 0 HG13 VAL A 123 12.741 -12.388 0.581 1.00 0.31 H new ATOM 0 HG21 VAL A 123 10.267 -12.129 -1.210 1.00 0.31 H new ATOM 0 HG22 VAL A 123 10.681 -10.949 0.055 1.00 0.31 H new ATOM 0 HG23 VAL A 123 10.435 -10.406 -1.622 1.00 0.31 H new ATOM 1929 N SER A 124 13.570 -10.213 1.386 1.00 0.29 N ATOM 1930 CA SER A 124 13.415 -9.875 2.788 1.00 0.35 C ATOM 1931 C SER A 124 13.975 -8.482 3.077 1.00 0.34 C ATOM 1932 O SER A 124 13.404 -7.727 3.865 1.00 0.44 O ATOM 1933 CB SER A 124 14.113 -10.928 3.650 1.00 0.43 C ATOM 1934 OG SER A 124 13.692 -12.236 3.292 1.00 1.32 O ATOM 0 H SER A 124 14.302 -10.897 1.198 1.00 0.29 H new ATOM 0 HA SER A 124 12.353 -9.863 3.032 1.00 0.35 H new ATOM 0 HB2 SER A 124 15.193 -10.844 3.530 1.00 0.43 H new ATOM 0 HB3 SER A 124 13.894 -10.746 4.702 1.00 0.43 H new ATOM 0 HG SER A 124 14.152 -12.893 3.855 1.00 1.32 H new ATOM 1940 N ARG A 125 15.077 -8.127 2.416 1.00 0.28 N ATOM 1941 CA ARG A 125 15.703 -6.830 2.653 1.00 0.31 C ATOM 1942 C ARG A 125 14.969 -5.728 1.893 1.00 0.24 C ATOM 1943 O ARG A 125 15.108 -4.551 2.212 1.00 0.24 O ATOM 1944 CB ARG A 125 17.198 -6.850 2.296 1.00 0.41 C ATOM 1945 CG ARG A 125 17.504 -6.988 0.813 1.00 0.91 C ATOM 1946 CD ARG A 125 18.994 -7.198 0.575 1.00 0.74 C ATOM 1947 NE ARG A 125 19.517 -8.311 1.364 1.00 1.01 N ATOM 1948 CZ ARG A 125 20.712 -8.863 1.181 1.00 1.24 C ATOM 1949 NH1 ARG A 125 21.517 -8.421 0.220 1.00 1.28 N ATOM 1950 NH2 ARG A 125 21.099 -9.855 1.970 1.00 1.84 N ATOM 0 H ARG A 125 15.547 -8.710 1.723 1.00 0.28 H new ATOM 0 HA ARG A 125 15.628 -6.615 3.719 1.00 0.31 H new ATOM 0 HB2 ARG A 125 17.656 -5.931 2.662 1.00 0.41 H new ATOM 0 HB3 ARG A 125 17.672 -7.675 2.827 1.00 0.41 H new ATOM 0 HG2 ARG A 125 16.945 -7.828 0.400 1.00 0.91 H new ATOM 0 HG3 ARG A 125 17.171 -6.094 0.286 1.00 0.91 H new ATOM 0 HD2 ARG A 125 19.170 -7.389 -0.484 1.00 0.74 H new ATOM 0 HD3 ARG A 125 19.535 -6.286 0.829 1.00 0.74 H new ATOM 0 HE ARG A 125 18.926 -8.689 2.104 1.00 1.01 H new ATOM 0 HH11 ARG A 125 21.219 -7.654 -0.382 1.00 1.28 H new ATOM 0 HH12 ARG A 125 22.433 -8.849 0.085 1.00 1.28 H new ATOM 0 HH21 ARG A 125 20.481 -10.189 2.710 1.00 1.84 H new ATOM 0 HH22 ARG A 125 22.014 -10.285 1.837 1.00 1.84 H new ATOM 1964 N ILE A 126 14.181 -6.116 0.893 1.00 0.21 N ATOM 1965 CA ILE A 126 13.289 -5.184 0.218 1.00 0.19 C ATOM 1966 C ILE A 126 12.342 -4.559 1.232 1.00 0.19 C ATOM 1967 O ILE A 126 12.152 -3.340 1.258 1.00 0.19 O ATOM 1968 CB ILE A 126 12.482 -5.891 -0.892 1.00 0.19 C ATOM 1969 CG1 ILE A 126 13.384 -6.173 -2.092 1.00 0.20 C ATOM 1970 CG2 ILE A 126 11.276 -5.064 -1.312 1.00 0.20 C ATOM 1971 CD1 ILE A 126 12.705 -6.948 -3.192 1.00 0.23 C ATOM 0 H ILE A 126 14.144 -7.070 0.534 1.00 0.21 H new ATOM 0 HA ILE A 126 13.892 -4.405 -0.248 1.00 0.19 H new ATOM 0 HB ILE A 126 12.111 -6.836 -0.496 1.00 0.19 H new ATOM 0 HG12 ILE A 126 13.744 -5.226 -2.495 1.00 0.20 H new ATOM 0 HG13 ILE A 126 14.259 -6.729 -1.755 1.00 0.20 H new ATOM 0 HG21 ILE A 126 10.729 -5.590 -2.095 1.00 0.20 H new ATOM 0 HG22 ILE A 126 10.623 -4.911 -0.453 1.00 0.20 H new ATOM 0 HG23 ILE A 126 11.611 -4.098 -1.690 1.00 0.20 H new ATOM 0 HD11 ILE A 126 13.407 -7.110 -4.010 1.00 0.23 H new ATOM 0 HD12 ILE A 126 12.370 -7.910 -2.805 1.00 0.23 H new ATOM 0 HD13 ILE A 126 11.846 -6.385 -3.557 1.00 0.23 H new ATOM 1983 N ALA A 127 11.769 -5.408 2.078 1.00 0.22 N ATOM 1984 CA ALA A 127 10.912 -4.954 3.160 1.00 0.25 C ATOM 1985 C ALA A 127 11.650 -3.971 4.054 1.00 0.24 C ATOM 1986 O ALA A 127 11.090 -2.968 4.494 1.00 0.26 O ATOM 1987 CB ALA A 127 10.424 -6.140 3.973 1.00 0.30 C ATOM 0 H ALA A 127 11.886 -6.420 2.032 1.00 0.22 H new ATOM 0 HA ALA A 127 10.051 -4.444 2.727 1.00 0.25 H new ATOM 0 HB1 ALA A 127 9.783 -5.788 4.781 1.00 0.30 H new ATOM 0 HB2 ALA A 127 9.860 -6.815 3.329 1.00 0.30 H new ATOM 0 HB3 ALA A 127 11.279 -6.670 4.393 1.00 0.30 H new ATOM 1993 N ALA A 128 12.919 -4.261 4.301 1.00 0.22 N ATOM 1994 CA ALA A 128 13.755 -3.404 5.124 1.00 0.23 C ATOM 1995 C ALA A 128 13.958 -2.048 4.462 1.00 0.19 C ATOM 1996 O ALA A 128 13.833 -1.011 5.110 1.00 0.19 O ATOM 1997 CB ALA A 128 15.092 -4.073 5.391 1.00 0.27 C ATOM 0 H ALA A 128 13.393 -5.089 3.940 1.00 0.22 H new ATOM 0 HA ALA A 128 13.249 -3.243 6.076 1.00 0.23 H new ATOM 0 HB1 ALA A 128 15.709 -3.420 6.009 1.00 0.27 H new ATOM 0 HB2 ALA A 128 14.929 -5.017 5.911 1.00 0.27 H new ATOM 0 HB3 ALA A 128 15.599 -4.263 4.445 1.00 0.27 H new ATOM 2003 N TRP A 129 14.261 -2.059 3.165 1.00 0.17 N ATOM 2004 CA TRP A 129 14.462 -0.819 2.414 1.00 0.17 C ATOM 2005 C TRP A 129 13.213 0.049 2.463 1.00 0.15 C ATOM 2006 O TRP A 129 13.295 1.266 2.655 1.00 0.18 O ATOM 2007 CB TRP A 129 14.820 -1.099 0.953 1.00 0.20 C ATOM 2008 CG TRP A 129 16.090 -1.869 0.768 1.00 0.24 C ATOM 2009 CD1 TRP A 129 17.152 -1.930 1.625 1.00 0.27 C ATOM 2010 CD2 TRP A 129 16.437 -2.675 -0.361 1.00 0.31 C ATOM 2011 NE1 TRP A 129 18.132 -2.736 1.100 1.00 0.33 N ATOM 2012 CE2 TRP A 129 17.718 -3.201 -0.122 1.00 0.36 C ATOM 2013 CE3 TRP A 129 15.783 -3.007 -1.553 1.00 0.37 C ATOM 2014 CZ2 TRP A 129 18.359 -4.038 -1.030 1.00 0.45 C ATOM 2015 CZ3 TRP A 129 16.420 -3.837 -2.454 1.00 0.47 C ATOM 2016 CH2 TRP A 129 17.699 -4.345 -2.188 1.00 0.50 C ATOM 0 H TRP A 129 14.373 -2.909 2.613 1.00 0.17 H new ATOM 0 HA TRP A 129 15.292 -0.292 2.884 1.00 0.17 H new ATOM 0 HB2 TRP A 129 14.003 -1.652 0.490 1.00 0.20 H new ATOM 0 HB3 TRP A 129 14.903 -0.150 0.423 1.00 0.20 H new ATOM 0 HD1 TRP A 129 17.212 -1.420 2.575 1.00 0.27 H new ATOM 0 HE1 TRP A 129 19.023 -2.954 1.546 1.00 0.33 H new ATOM 0 HE3 TRP A 129 14.797 -2.621 -1.764 1.00 0.37 H new ATOM 0 HZ2 TRP A 129 19.344 -4.432 -0.827 1.00 0.45 H new ATOM 0 HZ3 TRP A 129 15.925 -4.099 -3.378 1.00 0.47 H new ATOM 0 HH2 TRP A 129 18.173 -4.992 -2.912 1.00 0.50 H new ATOM 2027 N MET A 130 12.058 -0.585 2.298 1.00 0.16 N ATOM 2028 CA MET A 130 10.793 0.134 2.317 1.00 0.21 C ATOM 2029 C MET A 130 10.508 0.677 3.708 1.00 0.19 C ATOM 2030 O MET A 130 10.094 1.825 3.859 1.00 0.21 O ATOM 2031 CB MET A 130 9.643 -0.766 1.867 1.00 0.29 C ATOM 2032 CG MET A 130 9.685 -1.155 0.398 1.00 0.33 C ATOM 2033 SD MET A 130 8.286 -2.188 -0.071 1.00 0.71 S ATOM 2034 CE MET A 130 6.926 -1.155 0.467 1.00 0.29 C ATOM 0 H MET A 130 11.973 -1.591 2.150 1.00 0.16 H new ATOM 0 HA MET A 130 10.874 0.968 1.619 1.00 0.21 H new ATOM 0 HB2 MET A 130 9.651 -1.674 2.471 1.00 0.29 H new ATOM 0 HB3 MET A 130 8.700 -0.258 2.068 1.00 0.29 H new ATOM 0 HG2 MET A 130 9.691 -0.254 -0.215 1.00 0.33 H new ATOM 0 HG3 MET A 130 10.613 -1.687 0.191 1.00 0.33 H new ATOM 0 HE1 MET A 130 5.985 -1.584 0.122 1.00 0.29 H new ATOM 0 HE2 MET A 130 6.921 -1.097 1.555 1.00 0.29 H new ATOM 0 HE3 MET A 130 7.043 -0.154 0.051 1.00 0.29 H new ATOM 2044 N ALA A 131 10.749 -0.149 4.720 1.00 0.18 N ATOM 2045 CA ALA A 131 10.537 0.252 6.102 1.00 0.20 C ATOM 2046 C ALA A 131 11.421 1.439 6.454 1.00 0.21 C ATOM 2047 O ALA A 131 10.976 2.387 7.093 1.00 0.23 O ATOM 2048 CB ALA A 131 10.808 -0.916 7.037 1.00 0.23 C ATOM 0 H ALA A 131 11.092 -1.103 4.607 1.00 0.18 H new ATOM 0 HA ALA A 131 9.497 0.555 6.221 1.00 0.20 H new ATOM 0 HB1 ALA A 131 10.646 -0.602 8.068 1.00 0.23 H new ATOM 0 HB2 ALA A 131 10.133 -1.738 6.797 1.00 0.23 H new ATOM 0 HB3 ALA A 131 11.840 -1.247 6.917 1.00 0.23 H new ATOM 2054 N THR A 132 12.670 1.382 6.011 1.00 0.22 N ATOM 2055 CA THR A 132 13.613 2.471 6.217 1.00 0.25 C ATOM 2056 C THR A 132 13.107 3.761 5.568 1.00 0.24 C ATOM 2057 O THR A 132 12.986 4.791 6.232 1.00 0.25 O ATOM 2058 CB THR A 132 15.001 2.113 5.646 1.00 0.31 C ATOM 2059 OG1 THR A 132 15.501 0.931 6.285 1.00 0.33 O ATOM 2060 CG2 THR A 132 15.984 3.253 5.850 1.00 0.37 C ATOM 0 H THR A 132 13.055 0.586 5.503 1.00 0.22 H new ATOM 0 HA THR A 132 13.704 2.629 7.292 1.00 0.25 H new ATOM 0 HB THR A 132 14.893 1.935 4.576 1.00 0.31 H new ATOM 0 HG1 THR A 132 15.001 0.151 5.967 1.00 0.33 H new ATOM 0 HG21 THR A 132 16.954 2.975 5.439 1.00 0.37 H new ATOM 0 HG22 THR A 132 15.617 4.145 5.342 1.00 0.37 H new ATOM 0 HG23 THR A 132 16.087 3.458 6.916 1.00 0.37 H new ATOM 2068 N TYR A 133 12.797 3.700 4.275 1.00 0.23 N ATOM 2069 CA TYR A 133 12.327 4.878 3.550 1.00 0.24 C ATOM 2070 C TYR A 133 11.060 5.435 4.189 1.00 0.21 C ATOM 2071 O TYR A 133 10.928 6.647 4.372 1.00 0.23 O ATOM 2072 CB TYR A 133 12.073 4.545 2.078 1.00 0.27 C ATOM 2073 CG TYR A 133 11.571 5.721 1.263 1.00 0.33 C ATOM 2074 CD1 TYR A 133 12.448 6.697 0.806 1.00 0.42 C ATOM 2075 CD2 TYR A 133 10.224 5.852 0.948 1.00 0.36 C ATOM 2076 CE1 TYR A 133 11.994 7.769 0.060 1.00 0.50 C ATOM 2077 CE2 TYR A 133 9.764 6.919 0.201 1.00 0.45 C ATOM 2078 CZ TYR A 133 10.653 7.874 -0.240 1.00 0.51 C ATOM 2079 OH TYR A 133 10.203 8.932 -0.991 1.00 0.61 O ATOM 0 H TYR A 133 12.862 2.853 3.711 1.00 0.23 H new ATOM 0 HA TYR A 133 13.106 5.638 3.604 1.00 0.24 H new ATOM 0 HB2 TYR A 133 12.997 4.175 1.634 1.00 0.27 H new ATOM 0 HB3 TYR A 133 11.345 3.736 2.018 1.00 0.27 H new ATOM 0 HD1 TYR A 133 13.500 6.617 1.037 1.00 0.42 H new ATOM 0 HD2 TYR A 133 9.524 5.106 1.294 1.00 0.36 H new ATOM 0 HE1 TYR A 133 12.688 8.521 -0.286 1.00 0.50 H new ATOM 0 HE2 TYR A 133 8.714 7.004 -0.036 1.00 0.45 H new ATOM 0 HH TYR A 133 10.546 8.853 -1.906 1.00 0.61 H new ATOM 2089 N LEU A 134 10.142 4.543 4.544 1.00 0.20 N ATOM 2090 CA LEU A 134 8.886 4.932 5.164 1.00 0.20 C ATOM 2091 C LEU A 134 9.129 5.581 6.526 1.00 0.21 C ATOM 2092 O LEU A 134 8.614 6.659 6.806 1.00 0.24 O ATOM 2093 CB LEU A 134 7.973 3.707 5.292 1.00 0.20 C ATOM 2094 CG LEU A 134 6.735 3.878 6.173 1.00 0.22 C ATOM 2095 CD1 LEU A 134 5.897 5.054 5.708 1.00 0.26 C ATOM 2096 CD2 LEU A 134 5.906 2.603 6.163 1.00 0.26 C ATOM 0 H LEU A 134 10.248 3.537 4.410 1.00 0.20 H new ATOM 0 HA LEU A 134 8.394 5.671 4.532 1.00 0.20 H new ATOM 0 HB2 LEU A 134 7.646 3.418 4.293 1.00 0.20 H new ATOM 0 HB3 LEU A 134 8.563 2.880 5.686 1.00 0.20 H new ATOM 0 HG LEU A 134 7.065 4.079 7.192 1.00 0.22 H new ATOM 0 HD11 LEU A 134 5.022 5.154 6.351 1.00 0.26 H new ATOM 0 HD12 LEU A 134 6.491 5.967 5.758 1.00 0.26 H new ATOM 0 HD13 LEU A 134 5.575 4.887 4.680 1.00 0.26 H new ATOM 0 HD21 LEU A 134 5.027 2.736 6.794 1.00 0.26 H new ATOM 0 HD22 LEU A 134 5.591 2.382 5.143 1.00 0.26 H new ATOM 0 HD23 LEU A 134 6.505 1.776 6.545 1.00 0.26 H new ATOM 2108 N ASN A 135 9.944 4.940 7.346 1.00 0.24 N ATOM 2109 CA ASN A 135 10.225 5.419 8.696 1.00 0.29 C ATOM 2110 C ASN A 135 10.983 6.745 8.677 1.00 0.30 C ATOM 2111 O ASN A 135 10.652 7.676 9.414 1.00 0.33 O ATOM 2112 CB ASN A 135 11.041 4.369 9.454 1.00 0.37 C ATOM 2113 CG ASN A 135 11.476 4.825 10.838 1.00 0.92 C ATOM 2114 OD1 ASN A 135 10.774 5.577 11.510 1.00 1.17 O ATOM 2115 ND2 ASN A 135 12.648 4.379 11.266 1.00 1.46 N ATOM 0 H ASN A 135 10.429 4.077 7.100 1.00 0.24 H new ATOM 0 HA ASN A 135 9.272 5.585 9.199 1.00 0.29 H new ATOM 0 HB2 ASN A 135 10.449 3.459 9.549 1.00 0.37 H new ATOM 0 HB3 ASN A 135 11.925 4.115 8.869 1.00 0.37 H new ATOM 0 HD21 ASN A 135 12.996 4.659 12.183 1.00 1.46 H new ATOM 0 HD22 ASN A 135 13.202 3.756 10.679 1.00 1.46 H new ATOM 2122 N ASP A 136 11.991 6.836 7.824 1.00 0.32 N ATOM 2123 CA ASP A 136 12.889 7.987 7.837 1.00 0.37 C ATOM 2124 C ASP A 136 12.403 9.123 6.943 1.00 0.34 C ATOM 2125 O ASP A 136 12.229 10.247 7.406 1.00 0.36 O ATOM 2126 CB ASP A 136 14.306 7.575 7.421 1.00 0.46 C ATOM 2127 CG ASP A 136 15.016 6.776 8.495 1.00 1.19 C ATOM 2128 OD1 ASP A 136 15.343 7.357 9.551 1.00 1.27 O ATOM 2129 OD2 ASP A 136 15.261 5.571 8.284 1.00 2.07 O ATOM 0 H ASP A 136 12.210 6.134 7.117 1.00 0.32 H new ATOM 0 HA ASP A 136 12.900 8.357 8.862 1.00 0.37 H new ATOM 0 HB2 ASP A 136 14.255 6.984 6.506 1.00 0.46 H new ATOM 0 HB3 ASP A 136 14.888 8.468 7.192 1.00 0.46 H new ATOM 2134 N HIS A 137 12.188 8.841 5.665 1.00 0.33 N ATOM 2135 CA HIS A 137 11.908 9.906 4.701 1.00 0.35 C ATOM 2136 C HIS A 137 10.415 10.173 4.547 1.00 0.29 C ATOM 2137 O HIS A 137 9.995 11.322 4.428 1.00 0.32 O ATOM 2138 CB HIS A 137 12.503 9.590 3.322 1.00 0.45 C ATOM 2139 CG HIS A 137 14.001 9.529 3.299 1.00 0.63 C ATOM 2140 ND1 HIS A 137 14.801 10.648 3.369 1.00 1.07 N ATOM 2141 CD2 HIS A 137 14.844 8.474 3.198 1.00 1.53 C ATOM 2142 CE1 HIS A 137 16.067 10.286 3.309 1.00 0.95 C ATOM 2143 NE2 HIS A 137 16.121 8.972 3.205 1.00 1.34 N ATOM 0 H HIS A 137 12.201 7.900 5.272 1.00 0.33 H new ATOM 0 HA HIS A 137 12.381 10.802 5.104 1.00 0.35 H new ATOM 0 HB2 HIS A 137 12.106 8.635 2.978 1.00 0.45 H new ATOM 0 HB3 HIS A 137 12.170 10.348 2.613 1.00 0.45 H new ATOM 0 HD2 HIS A 137 14.563 7.434 3.125 1.00 1.53 H new ATOM 0 HE1 HIS A 137 16.916 10.952 3.340 1.00 0.95 H new ATOM 0 HE2 HIS A 137 16.974 8.417 3.140 1.00 1.34 H new ATOM 2152 N LEU A 138 9.621 9.116 4.554 1.00 0.26 N ATOM 2153 CA LEU A 138 8.217 9.215 4.182 1.00 0.25 C ATOM 2154 C LEU A 138 7.348 9.687 5.347 1.00 0.24 C ATOM 2155 O LEU A 138 6.465 10.527 5.168 1.00 0.25 O ATOM 2156 CB LEU A 138 7.734 7.858 3.674 1.00 0.23 C ATOM 2157 CG LEU A 138 6.402 7.872 2.934 1.00 0.23 C ATOM 2158 CD1 LEU A 138 6.487 8.779 1.718 1.00 0.26 C ATOM 2159 CD2 LEU A 138 6.019 6.460 2.526 1.00 0.22 C ATOM 0 H LEU A 138 9.924 8.177 4.813 1.00 0.26 H new ATOM 0 HA LEU A 138 8.125 9.961 3.393 1.00 0.25 H new ATOM 0 HB2 LEU A 138 8.494 7.446 3.010 1.00 0.23 H new ATOM 0 HB3 LEU A 138 7.651 7.180 4.523 1.00 0.23 H new ATOM 0 HG LEU A 138 5.630 8.261 3.598 1.00 0.23 H new ATOM 0 HD11 LEU A 138 5.529 8.781 1.198 1.00 0.26 H new ATOM 0 HD12 LEU A 138 6.729 9.793 2.037 1.00 0.26 H new ATOM 0 HD13 LEU A 138 7.264 8.415 1.046 1.00 0.26 H new ATOM 0 HD21 LEU A 138 5.066 6.480 1.998 1.00 0.22 H new ATOM 0 HD22 LEU A 138 6.788 6.049 1.872 1.00 0.22 H new ATOM 0 HD23 LEU A 138 5.928 5.836 3.415 1.00 0.22 H new ATOM 2171 N GLU A 139 7.610 9.147 6.533 1.00 0.26 N ATOM 2172 CA GLU A 139 6.841 9.476 7.736 1.00 0.29 C ATOM 2173 C GLU A 139 6.698 10.992 7.962 1.00 0.30 C ATOM 2174 O GLU A 139 5.586 11.459 8.222 1.00 0.30 O ATOM 2175 CB GLU A 139 7.466 8.810 8.969 1.00 0.36 C ATOM 2176 CG GLU A 139 6.716 9.083 10.266 1.00 0.52 C ATOM 2177 CD GLU A 139 7.324 8.361 11.448 1.00 1.00 C ATOM 2178 OE1 GLU A 139 8.289 8.889 12.038 1.00 1.74 O ATOM 2179 OE2 GLU A 139 6.836 7.268 11.795 1.00 1.46 O ATOM 0 H GLU A 139 8.358 8.471 6.691 1.00 0.26 H new ATOM 0 HA GLU A 139 5.835 9.085 7.581 1.00 0.29 H new ATOM 0 HB2 GLU A 139 7.509 7.733 8.805 1.00 0.36 H new ATOM 0 HB3 GLU A 139 8.494 9.157 9.075 1.00 0.36 H new ATOM 0 HG2 GLU A 139 6.713 10.155 10.462 1.00 0.52 H new ATOM 0 HG3 GLU A 139 5.676 8.776 10.152 1.00 0.52 H new ATOM 2186 N PRO A 140 7.796 11.790 7.877 1.00 0.33 N ATOM 2187 CA PRO A 140 7.719 13.248 8.057 1.00 0.36 C ATOM 2188 C PRO A 140 6.641 13.898 7.194 1.00 0.31 C ATOM 2189 O PRO A 140 5.915 14.777 7.662 1.00 0.36 O ATOM 2190 CB PRO A 140 9.106 13.739 7.635 1.00 0.42 C ATOM 2191 CG PRO A 140 10.006 12.589 7.906 1.00 0.42 C ATOM 2192 CD PRO A 140 9.189 11.351 7.640 1.00 0.35 C ATOM 0 HA PRO A 140 7.451 13.508 9.081 1.00 0.36 H new ATOM 0 HB2 PRO A 140 9.125 14.018 6.581 1.00 0.42 H new ATOM 0 HB3 PRO A 140 9.405 14.620 8.203 1.00 0.42 H new ATOM 0 HG2 PRO A 140 10.885 12.622 7.263 1.00 0.42 H new ATOM 0 HG3 PRO A 140 10.363 12.607 8.936 1.00 0.42 H new ATOM 0 HD2 PRO A 140 9.327 10.992 6.620 1.00 0.35 H new ATOM 0 HD3 PRO A 140 9.470 10.535 8.306 1.00 0.35 H new ATOM 2200 N TRP A 141 6.521 13.455 5.944 1.00 0.28 N ATOM 2201 CA TRP A 141 5.526 14.011 5.037 1.00 0.25 C ATOM 2202 C TRP A 141 4.136 13.501 5.404 1.00 0.22 C ATOM 2203 O TRP A 141 3.160 14.258 5.405 1.00 0.22 O ATOM 2204 CB TRP A 141 5.847 13.658 3.577 1.00 0.29 C ATOM 2205 CG TRP A 141 4.947 14.355 2.606 1.00 0.29 C ATOM 2206 CD1 TRP A 141 5.152 15.574 2.028 1.00 0.32 C ATOM 2207 CD2 TRP A 141 3.688 13.883 2.113 1.00 0.30 C ATOM 2208 NE1 TRP A 141 4.098 15.890 1.208 1.00 0.35 N ATOM 2209 CE2 TRP A 141 3.185 14.867 1.244 1.00 0.33 C ATOM 2210 CE3 TRP A 141 2.938 12.723 2.325 1.00 0.31 C ATOM 2211 CZ2 TRP A 141 1.965 14.726 0.591 1.00 0.36 C ATOM 2212 CZ3 TRP A 141 1.729 12.584 1.674 1.00 0.35 C ATOM 2213 CH2 TRP A 141 1.251 13.579 0.817 1.00 0.36 C ATOM 0 H TRP A 141 7.098 12.717 5.540 1.00 0.28 H new ATOM 0 HA TRP A 141 5.548 15.096 5.137 1.00 0.25 H new ATOM 0 HB2 TRP A 141 6.882 13.923 3.362 1.00 0.29 H new ATOM 0 HB3 TRP A 141 5.759 12.580 3.440 1.00 0.29 H new ATOM 0 HD1 TRP A 141 6.017 16.199 2.192 1.00 0.32 H new ATOM 0 HE1 TRP A 141 4.008 16.746 0.661 1.00 0.35 H new ATOM 0 HE3 TRP A 141 3.298 11.949 2.987 1.00 0.31 H new ATOM 0 HZ2 TRP A 141 1.594 15.494 -0.071 1.00 0.36 H new ATOM 0 HZ3 TRP A 141 1.142 11.691 1.830 1.00 0.35 H new ATOM 0 HH2 TRP A 141 0.300 13.441 0.323 1.00 0.36 H new ATOM 2224 N ILE A 142 4.064 12.216 5.726 1.00 0.20 N ATOM 2225 CA ILE A 142 2.809 11.574 6.097 1.00 0.19 C ATOM 2226 C ILE A 142 2.176 12.278 7.293 1.00 0.20 C ATOM 2227 O ILE A 142 1.049 12.770 7.212 1.00 0.20 O ATOM 2228 CB ILE A 142 3.040 10.082 6.426 1.00 0.21 C ATOM 2229 CG1 ILE A 142 3.454 9.320 5.166 1.00 0.21 C ATOM 2230 CG2 ILE A 142 1.798 9.453 7.036 1.00 0.25 C ATOM 2231 CD1 ILE A 142 3.805 7.877 5.427 1.00 0.23 C ATOM 0 H ILE A 142 4.870 11.591 5.738 1.00 0.20 H new ATOM 0 HA ILE A 142 2.129 11.647 5.249 1.00 0.19 H new ATOM 0 HB ILE A 142 3.844 10.020 7.160 1.00 0.21 H new ATOM 0 HG12 ILE A 142 2.641 9.363 4.441 1.00 0.21 H new ATOM 0 HG13 ILE A 142 4.311 9.819 4.714 1.00 0.21 H new ATOM 0 HG21 ILE A 142 1.992 8.403 7.256 1.00 0.25 H new ATOM 0 HG22 ILE A 142 1.541 9.975 7.957 1.00 0.25 H new ATOM 0 HG23 ILE A 142 0.969 9.529 6.332 1.00 0.25 H new ATOM 0 HD11 ILE A 142 4.089 7.397 4.491 1.00 0.23 H new ATOM 0 HD12 ILE A 142 4.638 7.826 6.128 1.00 0.23 H new ATOM 0 HD13 ILE A 142 2.942 7.364 5.851 1.00 0.23 H new ATOM 2243 N GLN A 143 2.918 12.341 8.394 1.00 0.25 N ATOM 2244 CA GLN A 143 2.426 12.950 9.624 1.00 0.30 C ATOM 2245 C GLN A 143 2.124 14.433 9.418 1.00 0.29 C ATOM 2246 O GLN A 143 1.177 14.965 9.992 1.00 0.31 O ATOM 2247 CB GLN A 143 3.451 12.768 10.748 1.00 0.40 C ATOM 2248 CG GLN A 143 2.980 13.278 12.105 1.00 0.51 C ATOM 2249 CD GLN A 143 1.693 12.612 12.574 1.00 0.95 C ATOM 2250 OE1 GLN A 143 1.726 11.571 13.223 1.00 1.51 O ATOM 2251 NE2 GLN A 143 0.553 13.213 12.265 1.00 1.60 N ATOM 0 H GLN A 143 3.868 11.975 8.459 1.00 0.25 H new ATOM 0 HA GLN A 143 1.498 12.452 9.905 1.00 0.30 H new ATOM 0 HB2 GLN A 143 3.696 11.709 10.834 1.00 0.40 H new ATOM 0 HB3 GLN A 143 4.370 13.287 10.475 1.00 0.40 H new ATOM 0 HG2 GLN A 143 3.763 13.106 12.844 1.00 0.51 H new ATOM 0 HG3 GLN A 143 2.826 14.356 12.049 1.00 0.51 H new ATOM 0 HE21 GLN A 143 0.563 14.078 11.724 1.00 1.60 H new ATOM 0 HE22 GLN A 143 -0.334 12.811 12.568 1.00 1.60 H new ATOM 2260 N GLU A 144 2.923 15.085 8.579 1.00 0.29 N ATOM 2261 CA GLU A 144 2.736 16.501 8.271 1.00 0.33 C ATOM 2262 C GLU A 144 1.346 16.756 7.696 1.00 0.29 C ATOM 2263 O GLU A 144 0.716 17.772 7.992 1.00 0.35 O ATOM 2264 CB GLU A 144 3.813 16.966 7.288 1.00 0.41 C ATOM 2265 CG GLU A 144 3.677 18.411 6.836 1.00 0.64 C ATOM 2266 CD GLU A 144 4.838 18.844 5.967 1.00 1.09 C ATOM 2267 OE1 GLU A 144 4.784 18.631 4.737 1.00 1.75 O ATOM 2268 OE2 GLU A 144 5.821 19.381 6.513 1.00 1.25 O ATOM 0 H GLU A 144 3.711 14.653 8.097 1.00 0.29 H new ATOM 0 HA GLU A 144 2.827 17.071 9.196 1.00 0.33 H new ATOM 0 HB2 GLU A 144 4.791 16.835 7.752 1.00 0.41 H new ATOM 0 HB3 GLU A 144 3.788 16.321 6.410 1.00 0.41 H new ATOM 0 HG2 GLU A 144 2.745 18.532 6.283 1.00 0.64 H new ATOM 0 HG3 GLU A 144 3.616 19.060 7.710 1.00 0.64 H new ATOM 2275 N ASN A 145 0.859 15.819 6.892 1.00 0.24 N ATOM 2276 CA ASN A 145 -0.455 15.955 6.270 1.00 0.28 C ATOM 2277 C ASN A 145 -1.533 15.281 7.107 1.00 0.30 C ATOM 2278 O ASN A 145 -2.651 15.075 6.641 1.00 0.42 O ATOM 2279 CB ASN A 145 -0.452 15.382 4.848 1.00 0.32 C ATOM 2280 CG ASN A 145 0.303 16.268 3.874 1.00 0.34 C ATOM 2281 OD1 ASN A 145 -0.281 17.157 3.250 1.00 0.40 O ATOM 2282 ND2 ASN A 145 1.600 16.039 3.729 1.00 0.33 N ATOM 0 H ASN A 145 1.352 14.958 6.655 1.00 0.24 H new ATOM 0 HA ASN A 145 -0.682 17.020 6.213 1.00 0.28 H new ATOM 0 HB2 ASN A 145 -0.001 14.390 4.859 1.00 0.32 H new ATOM 0 HB3 ASN A 145 -1.479 15.261 4.505 1.00 0.32 H new ATOM 0 HD21 ASN A 145 2.149 16.607 3.084 1.00 0.33 H new ATOM 0 HD22 ASN A 145 2.049 15.294 4.262 1.00 0.33 H new ATOM 2289 N GLY A 146 -1.193 14.944 8.342 1.00 0.25 N ATOM 2290 CA GLY A 146 -2.175 14.410 9.263 1.00 0.30 C ATOM 2291 C GLY A 146 -1.842 13.012 9.738 1.00 0.30 C ATOM 2292 O GLY A 146 -2.158 12.647 10.870 1.00 0.41 O ATOM 0 H GLY A 146 -0.251 15.031 8.724 1.00 0.25 H new ATOM 0 HA2 GLY A 146 -2.253 15.072 10.126 1.00 0.30 H new ATOM 0 HA3 GLY A 146 -3.152 14.400 8.779 1.00 0.30 H new ATOM 2296 N GLY A 147 -1.189 12.235 8.889 1.00 0.24 N ATOM 2297 CA GLY A 147 -0.846 10.874 9.244 1.00 0.22 C ATOM 2298 C GLY A 147 -1.550 9.869 8.356 1.00 0.19 C ATOM 2299 O GLY A 147 -2.236 10.252 7.404 1.00 0.20 O ATOM 0 H GLY A 147 -0.889 12.523 7.958 1.00 0.24 H new ATOM 0 HA2 GLY A 147 0.232 10.738 9.164 1.00 0.22 H new ATOM 0 HA3 GLY A 147 -1.114 10.691 10.285 1.00 0.22 H new ATOM 2303 N TRP A 148 -1.386 8.588 8.663 1.00 0.20 N ATOM 2304 CA TRP A 148 -2.005 7.525 7.880 1.00 0.21 C ATOM 2305 C TRP A 148 -3.523 7.661 7.830 1.00 0.23 C ATOM 2306 O TRP A 148 -4.134 7.358 6.808 1.00 0.25 O ATOM 2307 CB TRP A 148 -1.644 6.146 8.437 1.00 0.23 C ATOM 2308 CG TRP A 148 -0.260 5.686 8.088 1.00 0.23 C ATOM 2309 CD1 TRP A 148 0.745 5.355 8.954 1.00 0.28 C ATOM 2310 CD2 TRP A 148 0.272 5.501 6.770 1.00 0.22 C ATOM 2311 NE1 TRP A 148 1.857 4.957 8.255 1.00 0.29 N ATOM 2312 CE2 TRP A 148 1.593 5.042 6.914 1.00 0.25 C ATOM 2313 CE3 TRP A 148 -0.244 5.673 5.481 1.00 0.22 C ATOM 2314 CZ2 TRP A 148 2.403 4.752 5.823 1.00 0.26 C ATOM 2315 CZ3 TRP A 148 0.564 5.385 4.397 1.00 0.23 C ATOM 2316 CH2 TRP A 148 1.875 4.929 4.575 1.00 0.24 C ATOM 0 H TRP A 148 -0.828 8.259 9.451 1.00 0.20 H new ATOM 0 HA TRP A 148 -1.614 7.622 6.867 1.00 0.21 H new ATOM 0 HB2 TRP A 148 -1.745 6.167 9.522 1.00 0.23 H new ATOM 0 HB3 TRP A 148 -2.362 5.416 8.064 1.00 0.23 H new ATOM 0 HD1 TRP A 148 0.674 5.400 10.031 1.00 0.28 H new ATOM 0 HE1 TRP A 148 2.737 4.648 8.667 1.00 0.29 H new ATOM 0 HE3 TRP A 148 -1.255 6.024 5.336 1.00 0.22 H new ATOM 0 HZ2 TRP A 148 3.415 4.399 5.957 1.00 0.26 H new ATOM 0 HZ3 TRP A 148 0.177 5.514 3.397 1.00 0.23 H new ATOM 0 HH2 TRP A 148 2.482 4.713 3.708 1.00 0.24 H new ATOM 2327 N ASP A 149 -4.128 8.126 8.925 1.00 0.26 N ATOM 2328 CA ASP A 149 -5.593 8.234 9.013 1.00 0.31 C ATOM 2329 C ASP A 149 -6.149 9.089 7.879 1.00 0.30 C ATOM 2330 O ASP A 149 -7.269 8.868 7.414 1.00 0.37 O ATOM 2331 CB ASP A 149 -6.035 8.815 10.367 1.00 0.40 C ATOM 2332 CG ASP A 149 -5.689 10.284 10.532 1.00 1.24 C ATOM 2333 OD1 ASP A 149 -4.543 10.592 10.933 1.00 1.94 O ATOM 2334 OD2 ASP A 149 -6.553 11.136 10.252 1.00 1.96 O ATOM 0 H ASP A 149 -3.632 8.434 9.762 1.00 0.26 H new ATOM 0 HA ASP A 149 -5.994 7.224 8.923 1.00 0.31 H new ATOM 0 HB2 ASP A 149 -7.112 8.688 10.475 1.00 0.40 H new ATOM 0 HB3 ASP A 149 -5.565 8.246 11.169 1.00 0.40 H new ATOM 2339 N THR A 150 -5.357 10.049 7.430 1.00 0.27 N ATOM 2340 CA THR A 150 -5.744 10.919 6.334 1.00 0.29 C ATOM 2341 C THR A 150 -5.790 10.145 5.019 1.00 0.28 C ATOM 2342 O THR A 150 -6.737 10.274 4.239 1.00 0.33 O ATOM 2343 CB THR A 150 -4.753 12.091 6.214 1.00 0.33 C ATOM 2344 OG1 THR A 150 -4.726 12.819 7.450 1.00 0.38 O ATOM 2345 CG2 THR A 150 -5.132 13.022 5.076 1.00 0.37 C ATOM 0 H THR A 150 -4.432 10.246 7.813 1.00 0.27 H new ATOM 0 HA THR A 150 -6.740 11.309 6.543 1.00 0.29 H new ATOM 0 HB THR A 150 -3.765 11.685 5.999 1.00 0.33 H new ATOM 0 HG1 THR A 150 -4.678 13.780 7.263 1.00 0.38 H new ATOM 0 HG21 THR A 150 -4.412 13.838 5.019 1.00 0.37 H new ATOM 0 HG22 THR A 150 -5.129 12.469 4.137 1.00 0.37 H new ATOM 0 HG23 THR A 150 -6.128 13.428 5.254 1.00 0.37 H new ATOM 2353 N PHE A 151 -4.769 9.330 4.792 1.00 0.24 N ATOM 2354 CA PHE A 151 -4.662 8.554 3.566 1.00 0.25 C ATOM 2355 C PHE A 151 -5.654 7.395 3.559 1.00 0.26 C ATOM 2356 O PHE A 151 -6.281 7.115 2.539 1.00 0.30 O ATOM 2357 CB PHE A 151 -3.234 8.024 3.398 1.00 0.25 C ATOM 2358 CG PHE A 151 -3.071 7.113 2.216 1.00 0.27 C ATOM 2359 CD1 PHE A 151 -3.264 7.583 0.929 1.00 0.39 C ATOM 2360 CD2 PHE A 151 -2.706 5.789 2.392 1.00 0.26 C ATOM 2361 CE1 PHE A 151 -3.097 6.753 -0.158 1.00 0.43 C ATOM 2362 CE2 PHE A 151 -2.542 4.951 1.309 1.00 0.28 C ATOM 2363 CZ PHE A 151 -2.802 5.423 0.030 1.00 0.34 C ATOM 0 H PHE A 151 -3.999 9.189 5.446 1.00 0.24 H new ATOM 0 HA PHE A 151 -4.901 9.211 2.730 1.00 0.25 H new ATOM 0 HB2 PHE A 151 -2.551 8.867 3.294 1.00 0.25 H new ATOM 0 HB3 PHE A 151 -2.944 7.489 4.302 1.00 0.25 H new ATOM 0 HD1 PHE A 151 -3.549 8.613 0.775 1.00 0.39 H new ATOM 0 HD2 PHE A 151 -2.548 5.408 3.390 1.00 0.26 H new ATOM 0 HE1 PHE A 151 -3.198 7.147 -1.158 1.00 0.43 H new ATOM 0 HE2 PHE A 151 -2.213 3.933 1.455 1.00 0.28 H new ATOM 0 HZ PHE A 151 -2.773 4.749 -0.813 1.00 0.34 H new ATOM 2373 N VAL A 152 -5.798 6.736 4.703 1.00 0.25 N ATOM 2374 CA VAL A 152 -6.676 5.581 4.818 1.00 0.29 C ATOM 2375 C VAL A 152 -8.107 5.937 4.454 1.00 0.35 C ATOM 2376 O VAL A 152 -8.765 5.201 3.730 1.00 0.45 O ATOM 2377 CB VAL A 152 -6.639 4.987 6.236 1.00 0.29 C ATOM 2378 CG1 VAL A 152 -7.644 3.855 6.375 1.00 0.35 C ATOM 2379 CG2 VAL A 152 -5.241 4.496 6.558 1.00 0.28 C ATOM 0 H VAL A 152 -5.315 6.984 5.566 1.00 0.25 H new ATOM 0 HA VAL A 152 -6.309 4.833 4.115 1.00 0.29 H new ATOM 0 HB VAL A 152 -6.910 5.769 6.945 1.00 0.29 H new ATOM 0 HG11 VAL A 152 -7.599 3.451 7.386 1.00 0.35 H new ATOM 0 HG12 VAL A 152 -8.647 4.233 6.179 1.00 0.35 H new ATOM 0 HG13 VAL A 152 -7.407 3.068 5.659 1.00 0.35 H new ATOM 0 HG21 VAL A 152 -5.225 4.077 7.564 1.00 0.28 H new ATOM 0 HG22 VAL A 152 -4.951 3.728 5.841 1.00 0.28 H new ATOM 0 HG23 VAL A 152 -4.541 5.329 6.501 1.00 0.28 H new ATOM 2389 N GLU A 153 -8.567 7.079 4.947 1.00 0.37 N ATOM 2390 CA GLU A 153 -9.926 7.534 4.687 1.00 0.46 C ATOM 2391 C GLU A 153 -10.195 7.640 3.185 1.00 0.51 C ATOM 2392 O GLU A 153 -11.288 7.320 2.721 1.00 0.62 O ATOM 2393 CB GLU A 153 -10.167 8.886 5.358 1.00 0.52 C ATOM 2394 CG GLU A 153 -11.596 9.383 5.230 1.00 0.70 C ATOM 2395 CD GLU A 153 -12.596 8.475 5.920 1.00 1.35 C ATOM 2396 OE1 GLU A 153 -13.011 7.471 5.304 1.00 2.17 O ATOM 2397 OE2 GLU A 153 -12.974 8.755 7.075 1.00 1.42 O ATOM 0 H GLU A 153 -8.017 7.709 5.531 1.00 0.37 H new ATOM 0 HA GLU A 153 -10.613 6.798 5.105 1.00 0.46 H new ATOM 0 HB2 GLU A 153 -9.912 8.808 6.415 1.00 0.52 H new ATOM 0 HB3 GLU A 153 -9.494 9.624 4.921 1.00 0.52 H new ATOM 0 HG2 GLU A 153 -11.667 10.384 5.655 1.00 0.70 H new ATOM 0 HG3 GLU A 153 -11.854 9.465 4.174 1.00 0.70 H new ATOM 2404 N LEU A 154 -9.176 8.048 2.428 1.00 0.50 N ATOM 2405 CA LEU A 154 -9.315 8.253 0.983 1.00 0.59 C ATOM 2406 C LEU A 154 -9.749 6.969 0.276 1.00 0.68 C ATOM 2407 O LEU A 154 -10.399 7.016 -0.770 1.00 0.74 O ATOM 2408 CB LEU A 154 -7.996 8.756 0.383 1.00 0.65 C ATOM 2409 CG LEU A 154 -7.500 10.097 0.930 1.00 0.64 C ATOM 2410 CD1 LEU A 154 -6.130 10.428 0.360 1.00 0.75 C ATOM 2411 CD2 LEU A 154 -8.493 11.204 0.606 1.00 0.67 C ATOM 0 H LEU A 154 -8.243 8.244 2.791 1.00 0.50 H new ATOM 0 HA LEU A 154 -10.089 9.005 0.831 1.00 0.59 H new ATOM 0 HB2 LEU A 154 -7.226 8.004 0.557 1.00 0.65 H new ATOM 0 HB3 LEU A 154 -8.117 8.845 -0.697 1.00 0.65 H new ATOM 0 HG LEU A 154 -7.414 10.018 2.014 1.00 0.64 H new ATOM 0 HD11 LEU A 154 -5.791 11.384 0.759 1.00 0.75 H new ATOM 0 HD12 LEU A 154 -5.422 9.648 0.638 1.00 0.75 H new ATOM 0 HD13 LEU A 154 -6.193 10.490 -0.726 1.00 0.75 H new ATOM 0 HD21 LEU A 154 -8.125 12.150 1.002 1.00 0.67 H new ATOM 0 HD22 LEU A 154 -8.609 11.284 -0.475 1.00 0.67 H new ATOM 0 HD23 LEU A 154 -9.457 10.972 1.058 1.00 0.67 H new ATOM 2444 N GLY A 156 -11.091 4.473 2.346 1.00 0.89 N ATOM 2445 CA GLY A 156 -11.670 3.821 3.499 1.00 1.02 C ATOM 2446 C GLY A 156 -13.177 3.906 3.553 1.00 1.11 C ATOM 2447 O GLY A 156 -13.855 3.856 2.526 1.00 1.68 O ATOM 0 HA2 GLY A 156 -11.374 2.772 3.499 1.00 1.02 H new ATOM 0 HA3 GLY A 156 -11.257 4.268 4.403 1.00 1.02 H new ATOM 2451 N ASN A 157 -13.692 4.061 4.763 1.00 1.62 N ATOM 2452 CA ASN A 157 -15.115 3.918 5.025 1.00 2.05 C ATOM 2453 C ASN A 157 -15.902 5.185 4.702 1.00 2.33 C ATOM 2454 O ASN A 157 -16.712 5.191 3.777 1.00 2.52 O ATOM 2455 CB ASN A 157 -15.340 3.537 6.492 1.00 3.21 C ATOM 2456 CG ASN A 157 -16.808 3.360 6.837 1.00 3.90 C ATOM 2457 OD1 ASN A 157 -17.613 2.941 6.007 1.00 4.30 O ATOM 2458 ND2 ASN A 157 -17.167 3.691 8.065 1.00 4.60 N ATOM 0 H ASN A 157 -13.137 4.289 5.588 1.00 1.62 H new ATOM 0 HA ASN A 157 -15.482 3.129 4.369 1.00 2.05 H new ATOM 0 HB2 ASN A 157 -14.807 2.611 6.708 1.00 3.21 H new ATOM 0 HB3 ASN A 157 -14.912 4.308 7.132 1.00 3.21 H new ATOM 0 HD21 ASN A 157 -18.142 3.603 8.353 1.00 4.60 H new ATOM 0 HD22 ASN A 157 -16.470 4.035 8.725 1.00 4.60 H new ATOM 2465 N ASN A 158 -15.655 6.256 5.448 1.00 2.99 N ATOM 2466 CA ASN A 158 -16.534 7.426 5.405 1.00 4.03 C ATOM 2467 C ASN A 158 -16.448 8.162 4.075 1.00 4.18 C ATOM 2468 O ASN A 158 -17.474 8.552 3.522 1.00 4.81 O ATOM 2469 CB ASN A 158 -16.242 8.385 6.564 1.00 5.08 C ATOM 2470 CG ASN A 158 -17.145 9.608 6.537 1.00 5.98 C ATOM 2471 OD1 ASN A 158 -18.320 9.531 6.894 1.00 6.22 O ATOM 2472 ND2 ASN A 158 -16.597 10.751 6.155 1.00 6.76 N ATOM 0 H ASN A 158 -14.863 6.342 6.085 1.00 2.99 H new ATOM 0 HA ASN A 158 -17.553 7.053 5.511 1.00 4.03 H new ATOM 0 HB2 ASN A 158 -16.372 7.860 7.510 1.00 5.08 H new ATOM 0 HB3 ASN A 158 -15.200 8.703 6.517 1.00 5.08 H new ATOM 0 HD21 ASN A 158 -17.153 11.606 6.150 1.00 6.76 H new ATOM 0 HD22 ASN A 158 -15.619 10.776 5.866 1.00 6.76 H new ATOM 2479 N ALA A 159 -15.238 8.338 3.552 1.00 3.95 N ATOM 2480 CA ALA A 159 -15.063 9.044 2.284 1.00 4.72 C ATOM 2481 C ALA A 159 -15.853 8.364 1.170 1.00 4.66 C ATOM 2482 O ALA A 159 -16.547 9.024 0.395 1.00 5.63 O ATOM 2483 CB ALA A 159 -13.594 9.129 1.912 1.00 4.78 C ATOM 0 H ALA A 159 -14.373 8.007 3.979 1.00 3.95 H new ATOM 0 HA ALA A 159 -15.446 10.057 2.409 1.00 4.72 H new ATOM 0 HB1 ALA A 159 -13.489 9.658 0.965 1.00 4.78 H new ATOM 0 HB2 ALA A 159 -13.052 9.666 2.690 1.00 4.78 H new ATOM 0 HB3 ALA A 159 -13.185 8.124 1.813 1.00 4.78 H new ATOM 2489 N ALA A 160 -15.757 7.040 1.115 1.00 3.75 N ATOM 2490 CA ALA A 160 -16.487 6.254 0.127 1.00 4.08 C ATOM 2491 C ALA A 160 -17.981 6.232 0.438 1.00 4.33 C ATOM 2492 O ALA A 160 -18.812 6.244 -0.470 1.00 5.11 O ATOM 2493 CB ALA A 160 -15.937 4.837 0.072 1.00 3.59 C ATOM 0 H ALA A 160 -15.178 6.486 1.746 1.00 3.75 H new ATOM 0 HA ALA A 160 -16.352 6.723 -0.847 1.00 4.08 H new ATOM 0 HB1 ALA A 160 -16.490 4.260 -0.669 1.00 3.59 H new ATOM 0 HB2 ALA A 160 -14.883 4.866 -0.204 1.00 3.59 H new ATOM 0 HB3 ALA A 160 -16.043 4.367 1.050 1.00 3.59 H new ATOM 2499 N ALA A 161 -18.312 6.210 1.725 1.00 3.93 N ATOM 2500 CA ALA A 161 -19.703 6.184 2.167 1.00 4.43 C ATOM 2501 C ALA A 161 -20.439 7.453 1.753 1.00 5.54 C ATOM 2502 O ALA A 161 -21.629 7.419 1.443 1.00 6.11 O ATOM 2503 CB ALA A 161 -19.773 6.008 3.674 1.00 4.39 C ATOM 0 H ALA A 161 -17.632 6.210 2.485 1.00 3.93 H new ATOM 0 HA ALA A 161 -20.192 5.337 1.685 1.00 4.43 H new ATOM 0 HB1 ALA A 161 -20.816 5.990 3.990 1.00 4.39 H new ATOM 0 HB2 ALA A 161 -19.293 5.070 3.953 1.00 4.39 H new ATOM 0 HB3 ALA A 161 -19.260 6.837 4.161 1.00 4.39 H new ATOM 2509 N GLU A 162 -19.728 8.569 1.743 1.00 5.98 N ATOM 2510 CA GLU A 162 -20.311 9.843 1.341 1.00 7.23 C ATOM 2511 C GLU A 162 -20.602 9.855 -0.156 1.00 7.80 C ATOM 2512 O GLU A 162 -21.515 10.541 -0.616 1.00 8.75 O ATOM 2513 CB GLU A 162 -19.368 10.987 1.704 1.00 7.72 C ATOM 2514 CG GLU A 162 -19.139 11.129 3.198 1.00 7.99 C ATOM 2515 CD GLU A 162 -20.357 11.646 3.932 1.00 8.68 C ATOM 2516 OE1 GLU A 162 -21.292 10.853 4.154 1.00 9.03 O ATOM 2517 OE2 GLU A 162 -20.391 12.846 4.285 1.00 9.09 O ATOM 0 H GLU A 162 -18.745 8.620 2.009 1.00 5.98 H new ATOM 0 HA GLU A 162 -21.253 9.976 1.874 1.00 7.23 H new ATOM 0 HB2 GLU A 162 -18.409 10.828 1.211 1.00 7.72 H new ATOM 0 HB3 GLU A 162 -19.775 11.921 1.316 1.00 7.72 H new ATOM 0 HG2 GLU A 162 -18.855 10.161 3.611 1.00 7.99 H new ATOM 0 HG3 GLU A 162 -18.302 11.806 3.370 1.00 7.99 H new ATOM 2524 N SER A 163 -19.835 9.079 -0.911 1.00 7.39 N ATOM 2525 CA SER A 163 -20.012 8.997 -2.353 1.00 8.21 C ATOM 2526 C SER A 163 -20.966 7.863 -2.721 1.00 8.28 C ATOM 2527 O SER A 163 -21.273 7.651 -3.894 1.00 9.15 O ATOM 2528 CB SER A 163 -18.658 8.787 -3.030 1.00 8.03 C ATOM 2529 OG SER A 163 -17.735 9.786 -2.632 1.00 7.86 O ATOM 0 H SER A 163 -19.082 8.496 -0.546 1.00 7.39 H new ATOM 0 HA SER A 163 -20.447 9.933 -2.702 1.00 8.21 H new ATOM 0 HB2 SER A 163 -18.267 7.802 -2.774 1.00 8.03 H new ATOM 0 HB3 SER A 163 -18.781 8.810 -4.113 1.00 8.03 H new ATOM 0 HG SER A 163 -17.419 9.596 -1.724 1.00 7.86 H new ATOM 2535 N ARG A 164 -21.440 7.143 -1.708 1.00 7.47 N ATOM 2536 CA ARG A 164 -22.326 6.008 -1.926 1.00 7.60 C ATOM 2537 C ARG A 164 -23.671 6.482 -2.467 1.00 8.33 C ATOM 2538 O ARG A 164 -24.248 5.863 -3.362 1.00 8.87 O ATOM 2539 CB ARG A 164 -22.522 5.229 -0.625 1.00 6.69 C ATOM 2540 CG ARG A 164 -23.127 3.852 -0.824 1.00 6.19 C ATOM 2541 CD ARG A 164 -23.339 3.145 0.503 1.00 5.74 C ATOM 2542 NE ARG A 164 -23.719 1.748 0.316 1.00 5.66 N ATOM 2543 CZ ARG A 164 -24.474 1.057 1.164 1.00 5.62 C ATOM 2544 NH1 ARG A 164 -24.969 1.634 2.252 1.00 5.62 N ATOM 2545 NH2 ARG A 164 -24.740 -0.218 0.911 1.00 6.02 N ATOM 0 H ARG A 164 -21.224 7.327 -0.728 1.00 7.47 H new ATOM 0 HA ARG A 164 -21.869 5.347 -2.662 1.00 7.60 H new ATOM 0 HB2 ARG A 164 -21.559 5.124 -0.126 1.00 6.69 H new ATOM 0 HB3 ARG A 164 -23.165 5.806 0.040 1.00 6.69 H new ATOM 0 HG2 ARG A 164 -24.079 3.943 -1.346 1.00 6.19 H new ATOM 0 HG3 ARG A 164 -22.472 3.253 -1.457 1.00 6.19 H new ATOM 0 HD2 ARG A 164 -22.424 3.197 1.093 1.00 5.74 H new ATOM 0 HD3 ARG A 164 -24.114 3.660 1.070 1.00 5.74 H new ATOM 0 HE ARG A 164 -23.383 1.271 -0.520 1.00 5.66 H new ATOM 0 HH11 ARG A 164 -24.771 2.616 2.443 1.00 5.62 H new ATOM 0 HH12 ARG A 164 -25.547 1.095 2.897 1.00 5.62 H new ATOM 0 HH21 ARG A 164 -24.366 -0.660 0.071 1.00 6.02 H new ATOM 0 HH22 ARG A 164 -25.318 -0.756 1.556 1.00 6.02 H new ATOM 2559 N LYS A 165 -24.159 7.596 -1.931 1.00 8.52 N ATOM 2560 CA LYS A 165 -25.400 8.197 -2.414 1.00 9.41 C ATOM 2561 C LYS A 165 -25.218 8.757 -3.822 1.00 10.47 C ATOM 2562 O LYS A 165 -26.193 8.995 -4.538 1.00 11.24 O ATOM 2563 CB LYS A 165 -25.876 9.300 -1.466 1.00 9.61 C ATOM 2564 CG LYS A 165 -24.803 10.322 -1.118 1.00 9.69 C ATOM 2565 CD LYS A 165 -25.371 11.493 -0.330 1.00 10.12 C ATOM 2566 CE LYS A 165 -26.142 11.032 0.901 1.00 10.34 C ATOM 2567 NZ LYS A 165 -25.294 10.255 1.843 1.00 10.42 N ATOM 0 H LYS A 165 -23.716 8.101 -1.163 1.00 8.52 H new ATOM 0 HA LYS A 165 -26.160 7.416 -2.446 1.00 9.41 H new ATOM 0 HB2 LYS A 165 -26.721 9.816 -1.921 1.00 9.61 H new ATOM 0 HB3 LYS A 165 -26.240 8.842 -0.546 1.00 9.61 H new ATOM 0 HG2 LYS A 165 -24.017 9.840 -0.537 1.00 9.69 H new ATOM 0 HG3 LYS A 165 -24.341 10.690 -2.034 1.00 9.69 H new ATOM 0 HD2 LYS A 165 -24.559 12.152 -0.023 1.00 10.12 H new ATOM 0 HD3 LYS A 165 -26.030 12.077 -0.973 1.00 10.12 H new ATOM 0 HE2 LYS A 165 -26.551 11.901 1.417 1.00 10.34 H new ATOM 0 HE3 LYS A 165 -26.988 10.420 0.588 1.00 10.34 H new ATOM 0 HZ1 LYS A 165 -25.833 10.051 2.709 1.00 10.42 H new ATOM 0 HZ2 LYS A 165 -25.007 9.361 1.395 1.00 10.42 H new ATOM 0 HZ3 LYS A 165 -24.447 10.808 2.085 1.00 10.42 H new ATOM 2581 N GLY A 166 -23.962 8.954 -4.214 1.00 10.61 N ATOM 2582 CA GLY A 166 -23.659 9.397 -5.559 1.00 11.72 C ATOM 2583 C GLY A 166 -24.002 8.339 -6.587 1.00 12.02 C ATOM 2584 O GLY A 166 -24.292 8.649 -7.740 1.00 13.02 O ATOM 0 H GLY A 166 -23.146 8.813 -3.618 1.00 10.61 H new ATOM 0 HA2 GLY A 166 -24.215 10.309 -5.776 1.00 11.72 H new ATOM 0 HA3 GLY A 166 -22.600 9.645 -5.631 1.00 11.72 H new ATOM 2588 N GLN A 167 -23.976 7.080 -6.163 1.00 11.25 N ATOM 2589 CA GLN A 167 -24.359 5.970 -7.029 1.00 11.64 C ATOM 2590 C GLN A 167 -25.863 6.015 -7.279 1.00 12.01 C ATOM 2591 O GLN A 167 -26.339 5.714 -8.376 1.00 12.84 O ATOM 2592 CB GLN A 167 -23.963 4.632 -6.389 1.00 10.86 C ATOM 2593 CG GLN A 167 -24.252 3.412 -7.253 1.00 11.50 C ATOM 2594 CD GLN A 167 -23.465 3.403 -8.549 1.00 11.89 C ATOM 2595 OE1 GLN A 167 -22.370 3.955 -8.631 1.00 11.87 O ATOM 2596 NE2 GLN A 167 -24.015 2.769 -9.569 1.00 12.41 N ATOM 0 H GLN A 167 -23.693 6.802 -5.223 1.00 11.25 H new ATOM 0 HA GLN A 167 -23.836 6.061 -7.981 1.00 11.64 H new ATOM 0 HB2 GLN A 167 -22.898 4.655 -6.158 1.00 10.86 H new ATOM 0 HB3 GLN A 167 -24.492 4.525 -5.442 1.00 10.86 H new ATOM 0 HG2 GLN A 167 -24.020 2.510 -6.687 1.00 11.50 H new ATOM 0 HG3 GLN A 167 -25.317 3.380 -7.481 1.00 11.50 H new ATOM 0 HE21 GLN A 167 -24.926 2.323 -9.461 1.00 12.41 H new ATOM 0 HE22 GLN A 167 -23.529 2.725 -10.465 1.00 12.41 H new ATOM 2605 N GLU A 168 -26.602 6.425 -6.255 1.00 11.51 N ATOM 2606 CA GLU A 168 -28.048 6.569 -6.353 1.00 11.94 C ATOM 2607 C GLU A 168 -28.401 7.796 -7.188 1.00 13.03 C ATOM 2608 O GLU A 168 -29.440 7.841 -7.848 1.00 13.73 O ATOM 2609 CB GLU A 168 -28.662 6.687 -4.959 1.00 11.38 C ATOM 2610 CG GLU A 168 -28.403 5.476 -4.078 1.00 10.85 C ATOM 2611 CD GLU A 168 -29.009 5.623 -2.700 1.00 10.80 C ATOM 2612 OE1 GLU A 168 -30.248 5.528 -2.578 1.00 10.98 O ATOM 2613 OE2 GLU A 168 -28.251 5.841 -1.734 1.00 10.74 O ATOM 0 H GLU A 168 -26.219 6.665 -5.341 1.00 11.51 H new ATOM 0 HA GLU A 168 -28.455 5.684 -6.842 1.00 11.94 H new ATOM 0 HB2 GLU A 168 -28.263 7.575 -4.469 1.00 11.38 H new ATOM 0 HB3 GLU A 168 -29.738 6.833 -5.056 1.00 11.38 H new ATOM 0 HG2 GLU A 168 -28.812 4.587 -4.558 1.00 10.85 H new ATOM 0 HG3 GLU A 168 -27.328 5.322 -3.984 1.00 10.85 H new