USER MOD reduce.3.24.130724 H: found=0, std=0, add=1259, rem=0, adj=46 USER MOD reduce.3.24.130724 removed 1258 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 146 HIS :FLIP no HD1:sc= -0.089 F(o=-0.61,f=-0.029) USER MOD Set 1.2: A 147 ASN : amide:sc= 0.0602 K(o=-0.029,f=-0.77) USER MOD Set 2.1: A 126 HIS : no HE2:sc= -0.677 K(o=-0.56,f=-6.5!) USER MOD Set 2.2: A 142 CYS SG : rot 162:sc= 0.114 USER MOD Set 3.1: A 93 THR OG1 : rot -120:sc= 1.07 USER MOD Set 3.2: A 123 TYR OH : rot -154:sc= 1.2 USER MOD Set 4.1: A 71 THR OG1 : rot 180:sc= 0 USER MOD Set 4.2: A 81 THR OG1 : rot 8:sc= -0.221 USER MOD Set 5.1: A 60 HIS : no HD1:sc= -0.422 X(o=-0.36,f=0.033) USER MOD Set 5.2: A 164 THR OG1 : rot 75:sc= 0.0614 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0.0373 USER MOD Single : A 7 TYR OH : rot -158:sc= 1.27 USER MOD Single : A 8 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 GLN : amide:sc= -0.0666 K(o=-0.067,f=-0.57) USER MOD Single : A 14 THR OG1 : rot 180:sc= -0.647 USER MOD Single : A 16 ASN : amide:sc= -0.309 K(o=-0.31,f=-2.2!) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 180:sc= 0.00157 USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 31 GLN :FLIP amide:sc=-0.00296 F(o=-1,f=-0.003) USER MOD Single : A 33 ASN : amide:sc= -1.81! C(o=-1.8!,f=-10!) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 37 GLN : amide:sc= -1.25 K(o=-1.2,f=-2.6!) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 GLN : amide:sc= -1.8 K(o=-1.8,f=-5.2!) USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 55 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot -61:sc= 1.15 USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ -128:sc= 0.42 (180deg=0) USER MOD Single : A 69 THR OG1 : rot 180:sc= -0.604 USER MOD Single : A 73 SER OG : rot -77:sc= 0.775 USER MOD Single : A 75 ASN :FLIP amide:sc= -3.73! C(o=-6.4!,f=-3.7!) USER MOD Single : A 76 ASN : amide:sc= 0 K(o=0,f=-0.72) USER MOD Single : A 79 MET CE :methyl -163:sc= -1.53! (180deg=-1.7) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 TYR OH : rot -143:sc= 0.595 USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 THR OG1 : rot -83:sc= 0.867 USER MOD Single : A 92 GLN : amide:sc= 0 X(o=0,f=-0.45) USER MOD Single : A 95 THR OG1 : rot -134:sc= -0.111 USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 102 ASN :FLIP amide:sc= -1.23 F(o=-2.2!,f=-1.2) USER MOD Single : A 104 GLN : amide:sc= -1.17 X(o=-1.2,f=-0.7) USER MOD Single : A 106 ASN : amide:sc= -3.04 K(o=-3,f=-4) USER MOD Single : A 114 TYR OH : rot 30:sc= -0.129 USER MOD Single : A 117 SER OG : rot -33:sc= 0.852 USER MOD Single : A 119 SER OG : rot 72:sc= 1.41 USER MOD Single : A 120 LYS NZ :NH3+ 166:sc=-0.00978 (180deg=-0.177) USER MOD Single : A 121 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 122 HIS :FLIP no HD1:sc= -0.255 F(o=-0.92,f=-0.25) USER MOD Single : A 128 THR OG1 : rot 180:sc=-0.00761 USER MOD Single : A 129 ASN : amide:sc= 0 X(o=0,f=-0.06) USER MOD Single : A 130 ASN :FLIP amide:sc= -0.0434 F(o=-1,f=-0.043) USER MOD Single : A 133 SER OG : rot -23:sc= 0.196 USER MOD Single : A 136 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0137) USER MOD Single : A 139 SER OG : rot 180:sc= 0 USER MOD Single : A 140 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 145 MET CE :methyl 155:sc= -3.22 (180deg=-3.96!) USER MOD Single : A 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 155 SER OG : rot 180:sc= 0 USER MOD Single : A 159 ASN : amide:sc= -3.51! C(o=-3.5!,f=-9.2!) USER MOD Single : A 161 THR OG1 : rot 112:sc= 0.217 USER MOD Single : A 166 ASN :FLIP amide:sc= -0.308 F(o=-1.1,f=-0.31) USER MOD ----------------------------------------------------------------- ATOM 56 N LEU A 4 13.044 -11.877 1.204 1.00 0.29 N ATOM 57 CA LEU A 4 12.580 -10.563 1.605 1.00 0.24 C ATOM 58 C LEU A 4 12.290 -9.685 0.406 1.00 0.23 C ATOM 59 O LEU A 4 12.548 -10.065 -0.738 1.00 0.25 O ATOM 60 CB LEU A 4 13.609 -9.888 2.495 1.00 0.25 C ATOM 61 CG LEU A 4 13.109 -9.511 3.884 1.00 0.31 C ATOM 62 CD1 LEU A 4 12.541 -10.724 4.605 1.00 0.65 C ATOM 63 CD2 LEU A 4 14.225 -8.879 4.685 1.00 0.54 C ATOM 0 HA LEU A 4 11.652 -10.699 2.160 1.00 0.24 H new ATOM 0 HB2 LEU A 4 14.467 -10.552 2.602 1.00 0.25 H new ATOM 0 HB3 LEU A 4 13.964 -8.986 1.996 1.00 0.25 H new ATOM 0 HG LEU A 4 12.305 -8.783 3.777 1.00 0.31 H new ATOM 0 HD11 LEU A 4 12.191 -10.428 5.594 1.00 0.65 H new ATOM 0 HD12 LEU A 4 11.708 -11.131 4.032 1.00 0.65 H new ATOM 0 HD13 LEU A 4 13.317 -11.483 4.707 1.00 0.65 H new ATOM 0 HD21 LEU A 4 13.856 -8.614 5.676 1.00 0.54 H new ATOM 0 HD22 LEU A 4 15.049 -9.586 4.782 1.00 0.54 H new ATOM 0 HD23 LEU A 4 14.575 -7.981 4.176 1.00 0.54 H new ATOM 75 N LEU A 5 11.767 -8.507 0.684 1.00 0.22 N ATOM 76 CA LEU A 5 11.319 -7.598 -0.344 1.00 0.22 C ATOM 77 C LEU A 5 12.431 -6.651 -0.745 1.00 0.20 C ATOM 78 O LEU A 5 13.090 -6.049 0.101 1.00 0.19 O ATOM 79 CB LEU A 5 10.112 -6.814 0.154 1.00 0.22 C ATOM 80 CG LEU A 5 9.381 -5.995 -0.902 1.00 0.24 C ATOM 81 CD1 LEU A 5 7.882 -6.077 -0.664 1.00 0.26 C ATOM 82 CD2 LEU A 5 9.858 -4.551 -0.870 1.00 0.28 C ATOM 0 H LEU A 5 11.642 -8.155 1.633 1.00 0.22 H new ATOM 0 HA LEU A 5 11.033 -8.177 -1.222 1.00 0.22 H new ATOM 0 HB2 LEU A 5 9.405 -7.514 0.600 1.00 0.22 H new ATOM 0 HB3 LEU A 5 10.439 -6.142 0.948 1.00 0.22 H new ATOM 0 HG LEU A 5 9.600 -6.401 -1.890 1.00 0.24 H new ATOM 0 HD11 LEU A 5 7.361 -5.490 -1.421 1.00 0.26 H new ATOM 0 HD12 LEU A 5 7.560 -7.117 -0.726 1.00 0.26 H new ATOM 0 HD13 LEU A 5 7.649 -5.683 0.325 1.00 0.26 H new ATOM 0 HD21 LEU A 5 9.328 -3.976 -1.629 1.00 0.28 H new ATOM 0 HD22 LEU A 5 9.659 -4.124 0.113 1.00 0.28 H new ATOM 0 HD23 LEU A 5 10.929 -4.517 -1.071 1.00 0.28 H new ATOM 94 N THR A 6 12.651 -6.554 -2.037 1.00 0.22 N ATOM 95 CA THR A 6 13.645 -5.656 -2.579 1.00 0.22 C ATOM 96 C THR A 6 13.054 -4.349 -3.087 1.00 0.23 C ATOM 97 O THR A 6 11.858 -4.228 -3.356 1.00 0.23 O ATOM 98 CB THR A 6 14.434 -6.311 -3.729 1.00 0.26 C ATOM 99 OG1 THR A 6 13.711 -7.427 -4.264 1.00 0.31 O ATOM 100 CG2 THR A 6 15.809 -6.748 -3.252 1.00 0.25 C ATOM 0 H THR A 6 12.147 -7.094 -2.740 1.00 0.22 H new ATOM 0 HA THR A 6 14.312 -5.434 -1.746 1.00 0.22 H new ATOM 0 HB THR A 6 14.563 -5.573 -4.520 1.00 0.26 H new ATOM 0 HG1 THR A 6 14.225 -7.830 -4.994 1.00 0.31 H new ATOM 0 HG21 THR A 6 16.351 -7.208 -4.078 1.00 0.25 H new ATOM 0 HG22 THR A 6 16.362 -5.880 -2.893 1.00 0.25 H new ATOM 0 HG23 THR A 6 15.701 -7.469 -2.442 1.00 0.25 H new ATOM 108 N TYR A 7 13.942 -3.396 -3.229 1.00 0.23 N ATOM 109 CA TYR A 7 13.642 -2.099 -3.778 1.00 0.24 C ATOM 110 C TYR A 7 14.704 -1.768 -4.810 1.00 0.26 C ATOM 111 O TYR A 7 15.865 -2.117 -4.621 1.00 0.26 O ATOM 112 CB TYR A 7 13.644 -1.053 -2.671 1.00 0.23 C ATOM 113 CG TYR A 7 13.372 0.348 -3.166 1.00 0.26 C ATOM 114 CD1 TYR A 7 12.132 0.707 -3.681 1.00 0.31 C ATOM 115 CD2 TYR A 7 14.370 1.306 -3.136 1.00 0.28 C ATOM 116 CE1 TYR A 7 11.902 1.987 -4.149 1.00 0.36 C ATOM 117 CE2 TYR A 7 14.152 2.582 -3.600 1.00 0.33 C ATOM 118 CZ TYR A 7 12.916 2.920 -4.104 1.00 0.37 C ATOM 119 OH TYR A 7 12.698 4.193 -4.580 1.00 0.44 O ATOM 0 H TYR A 7 14.919 -3.505 -2.958 1.00 0.23 H new ATOM 0 HA TYR A 7 12.656 -2.104 -4.242 1.00 0.24 H new ATOM 0 HB2 TYR A 7 12.892 -1.320 -1.928 1.00 0.23 H new ATOM 0 HB3 TYR A 7 14.610 -1.071 -2.167 1.00 0.23 H new ATOM 0 HD1 TYR A 7 11.338 -0.024 -3.716 1.00 0.31 H new ATOM 0 HD2 TYR A 7 15.341 1.046 -2.740 1.00 0.28 H new ATOM 0 HE1 TYR A 7 10.934 2.255 -4.547 1.00 0.36 H new ATOM 0 HE2 TYR A 7 14.945 3.314 -3.569 1.00 0.33 H new ATOM 0 HH TYR A 7 13.556 4.611 -4.801 1.00 0.44 H new ATOM 129 N GLN A 8 14.326 -1.124 -5.893 1.00 0.29 N ATOM 130 CA GLN A 8 15.269 -0.709 -6.902 1.00 0.32 C ATOM 131 C GLN A 8 15.303 0.799 -6.918 1.00 0.33 C ATOM 132 O GLN A 8 14.313 1.449 -7.261 1.00 0.34 O ATOM 133 CB GLN A 8 14.855 -1.236 -8.261 1.00 0.34 C ATOM 134 CG GLN A 8 15.934 -1.063 -9.314 1.00 0.37 C ATOM 135 CD GLN A 8 15.569 -1.693 -10.629 1.00 0.40 C ATOM 136 OE1 GLN A 8 14.978 -1.061 -11.502 1.00 0.76 O ATOM 137 NE2 GLN A 8 15.932 -2.950 -10.776 1.00 0.60 N ATOM 0 H GLN A 8 13.358 -0.875 -6.096 1.00 0.29 H new ATOM 0 HA GLN A 8 16.258 -1.107 -6.675 1.00 0.32 H new ATOM 0 HB2 GLN A 8 14.605 -2.293 -8.174 1.00 0.34 H new ATOM 0 HB3 GLN A 8 13.951 -0.720 -8.586 1.00 0.34 H new ATOM 0 HG2 GLN A 8 16.121 0.000 -9.465 1.00 0.37 H new ATOM 0 HG3 GLN A 8 16.863 -1.502 -8.951 1.00 0.37 H new ATOM 0 HE21 GLN A 8 16.421 -3.431 -10.021 1.00 0.60 H new ATOM 0 HE22 GLN A 8 15.724 -3.443 -11.645 1.00 0.60 H new ATOM 146 N VAL A 9 16.426 1.351 -6.527 1.00 0.33 N ATOM 147 CA VAL A 9 16.563 2.772 -6.286 1.00 0.34 C ATOM 148 C VAL A 9 16.415 3.609 -7.552 1.00 0.38 C ATOM 149 O VAL A 9 16.688 3.170 -8.664 1.00 0.39 O ATOM 150 CB VAL A 9 17.937 3.019 -5.652 1.00 0.34 C ATOM 151 CG1 VAL A 9 18.208 4.483 -5.434 1.00 0.36 C ATOM 152 CG2 VAL A 9 18.090 2.206 -4.382 1.00 0.31 C ATOM 0 H VAL A 9 17.283 0.822 -6.364 1.00 0.33 H new ATOM 0 HA VAL A 9 15.758 3.082 -5.620 1.00 0.34 H new ATOM 0 HB VAL A 9 18.697 2.679 -6.355 1.00 0.34 H new ATOM 0 HG11 VAL A 9 19.193 4.608 -4.983 1.00 0.36 H new ATOM 0 HG12 VAL A 9 18.178 5.005 -6.390 1.00 0.36 H new ATOM 0 HG13 VAL A 9 17.450 4.898 -4.770 1.00 0.36 H new ATOM 0 HG21 VAL A 9 19.071 2.394 -3.946 1.00 0.31 H new ATOM 0 HG22 VAL A 9 17.316 2.493 -3.671 1.00 0.31 H new ATOM 0 HG23 VAL A 9 17.994 1.146 -4.615 1.00 0.31 H new ATOM 162 N LYS A 10 15.908 4.810 -7.329 1.00 0.39 N ATOM 163 CA LYS A 10 15.800 5.839 -8.334 1.00 0.43 C ATOM 164 C LYS A 10 16.887 6.867 -8.088 1.00 0.44 C ATOM 165 O LYS A 10 17.408 6.972 -6.978 1.00 0.43 O ATOM 166 CB LYS A 10 14.435 6.520 -8.246 1.00 0.45 C ATOM 167 CG LYS A 10 13.266 5.552 -8.295 1.00 0.45 C ATOM 168 CD LYS A 10 11.948 6.240 -7.973 1.00 0.57 C ATOM 169 CE LYS A 10 11.634 7.336 -8.972 1.00 1.50 C ATOM 170 NZ LYS A 10 10.293 7.932 -8.743 1.00 2.01 N ATOM 0 H LYS A 10 15.552 5.098 -6.417 1.00 0.39 H new ATOM 0 HA LYS A 10 15.910 5.396 -9.324 1.00 0.43 H new ATOM 0 HB2 LYS A 10 14.383 7.092 -7.320 1.00 0.45 H new ATOM 0 HB3 LYS A 10 14.340 7.232 -9.066 1.00 0.45 H new ATOM 0 HG2 LYS A 10 13.208 5.102 -9.286 1.00 0.45 H new ATOM 0 HG3 LYS A 10 13.435 4.741 -7.586 1.00 0.45 H new ATOM 0 HD2 LYS A 10 11.143 5.505 -7.973 1.00 0.57 H new ATOM 0 HD3 LYS A 10 11.993 6.663 -6.969 1.00 0.57 H new ATOM 0 HE2 LYS A 10 12.393 8.115 -8.905 1.00 1.50 H new ATOM 0 HE3 LYS A 10 11.682 6.930 -9.982 1.00 1.50 H new ATOM 0 HZ1 LYS A 10 10.119 8.677 -9.448 1.00 2.01 H new ATOM 0 HZ2 LYS A 10 9.565 7.194 -8.832 1.00 2.01 H new ATOM 0 HZ3 LYS A 10 10.254 8.343 -7.788 1.00 2.01 H new ATOM 184 N GLN A 11 17.226 7.624 -9.108 1.00 0.48 N ATOM 185 CA GLN A 11 18.290 8.606 -8.999 1.00 0.50 C ATOM 186 C GLN A 11 17.985 9.632 -7.915 1.00 0.50 C ATOM 187 O GLN A 11 17.079 10.454 -8.063 1.00 0.54 O ATOM 188 CB GLN A 11 18.494 9.314 -10.329 1.00 0.55 C ATOM 189 CG GLN A 11 19.903 9.208 -10.877 1.00 0.54 C ATOM 190 CD GLN A 11 20.960 9.758 -9.935 1.00 1.25 C ATOM 191 OE1 GLN A 11 20.704 10.675 -9.156 1.00 1.80 O ATOM 192 NE2 GLN A 11 22.160 9.203 -10.009 1.00 1.83 N ATOM 0 H GLN A 11 16.781 7.581 -10.025 1.00 0.48 H new ATOM 0 HA GLN A 11 19.203 8.077 -8.727 1.00 0.50 H new ATOM 0 HB2 GLN A 11 17.799 8.899 -11.059 1.00 0.55 H new ATOM 0 HB3 GLN A 11 18.240 10.367 -10.210 1.00 0.55 H new ATOM 0 HG2 GLN A 11 20.125 8.162 -11.089 1.00 0.54 H new ATOM 0 HG3 GLN A 11 19.957 9.744 -11.825 1.00 0.54 H new ATOM 0 HE21 GLN A 11 22.331 8.444 -10.669 1.00 1.83 H new ATOM 0 HE22 GLN A 11 22.913 9.534 -9.406 1.00 1.83 H new ATOM 201 N GLY A 12 18.729 9.555 -6.823 1.00 0.48 N ATOM 202 CA GLY A 12 18.637 10.557 -5.787 1.00 0.48 C ATOM 203 C GLY A 12 17.762 10.154 -4.619 1.00 0.44 C ATOM 204 O GLY A 12 17.437 10.995 -3.778 1.00 0.45 O ATOM 0 H GLY A 12 19.400 8.809 -6.636 1.00 0.48 H new ATOM 0 HA2 GLY A 12 19.639 10.777 -5.419 1.00 0.48 H new ATOM 0 HA3 GLY A 12 18.247 11.478 -6.220 1.00 0.48 H new ATOM 208 N ASP A 13 17.357 8.886 -4.566 1.00 0.41 N ATOM 209 CA ASP A 13 16.652 8.363 -3.391 1.00 0.38 C ATOM 210 C ASP A 13 17.469 8.586 -2.124 1.00 0.37 C ATOM 211 O ASP A 13 18.642 8.948 -2.190 1.00 0.40 O ATOM 212 CB ASP A 13 16.375 6.867 -3.543 1.00 0.38 C ATOM 213 CG ASP A 13 15.135 6.576 -4.375 1.00 1.06 C ATOM 214 OD1 ASP A 13 14.223 7.433 -4.411 1.00 1.46 O ATOM 215 OD2 ASP A 13 15.043 5.479 -4.960 1.00 1.41 O ATOM 0 H ASP A 13 17.502 8.206 -5.313 1.00 0.41 H new ATOM 0 HA ASP A 13 15.707 8.901 -3.313 1.00 0.38 H new ATOM 0 HB2 ASP A 13 17.238 6.388 -4.006 1.00 0.38 H new ATOM 0 HB3 ASP A 13 16.256 6.422 -2.555 1.00 0.38 H new ATOM 220 N THR A 14 16.868 8.367 -0.971 1.00 0.33 N ATOM 221 CA THR A 14 17.620 8.440 0.273 1.00 0.32 C ATOM 222 C THR A 14 17.376 7.239 1.162 1.00 0.28 C ATOM 223 O THR A 14 16.305 6.637 1.150 1.00 0.26 O ATOM 224 CB THR A 14 17.299 9.692 1.083 1.00 0.34 C ATOM 225 OG1 THR A 14 16.291 10.472 0.423 1.00 0.39 O ATOM 226 CG2 THR A 14 18.554 10.517 1.286 1.00 0.41 C ATOM 0 H THR A 14 15.879 8.141 -0.866 1.00 0.33 H new ATOM 0 HA THR A 14 18.665 8.467 -0.037 1.00 0.32 H new ATOM 0 HB THR A 14 16.917 9.388 2.058 1.00 0.34 H new ATOM 0 HG1 THR A 14 16.095 11.271 0.956 1.00 0.39 H new ATOM 0 HG21 THR A 14 18.314 11.408 1.865 1.00 0.41 H new ATOM 0 HG22 THR A 14 19.296 9.925 1.822 1.00 0.41 H new ATOM 0 HG23 THR A 14 18.956 10.812 0.317 1.00 0.41 H new ATOM 234 N LEU A 15 18.384 6.948 1.969 1.00 0.27 N ATOM 235 CA LEU A 15 18.410 5.814 2.866 1.00 0.25 C ATOM 236 C LEU A 15 17.381 5.998 3.958 1.00 0.24 C ATOM 237 O LEU A 15 16.779 5.047 4.448 1.00 0.27 O ATOM 238 CB LEU A 15 19.876 5.726 3.366 1.00 0.29 C ATOM 239 CG LEU A 15 20.225 4.959 4.656 1.00 0.43 C ATOM 240 CD1 LEU A 15 20.109 5.878 5.859 1.00 0.86 C ATOM 241 CD2 LEU A 15 19.380 3.705 4.847 1.00 0.83 C ATOM 0 H LEU A 15 19.231 7.515 2.016 1.00 0.27 H new ATOM 0 HA LEU A 15 18.136 4.870 2.394 1.00 0.25 H new ATOM 0 HB2 LEU A 15 20.463 5.283 2.561 1.00 0.29 H new ATOM 0 HB3 LEU A 15 20.232 6.748 3.495 1.00 0.29 H new ATOM 0 HG LEU A 15 21.257 4.622 4.559 1.00 0.43 H new ATOM 0 HD11 LEU A 15 20.358 5.325 6.765 1.00 0.86 H new ATOM 0 HD12 LEU A 15 20.797 6.716 5.745 1.00 0.86 H new ATOM 0 HD13 LEU A 15 19.089 6.254 5.932 1.00 0.86 H new ATOM 0 HD21 LEU A 15 19.671 3.207 5.772 1.00 0.83 H new ATOM 0 HD22 LEU A 15 18.327 3.981 4.899 1.00 0.83 H new ATOM 0 HD23 LEU A 15 19.537 3.029 4.006 1.00 0.83 H new ATOM 253 N ASN A 16 17.136 7.237 4.277 1.00 0.23 N ATOM 254 CA ASN A 16 16.186 7.589 5.295 1.00 0.23 C ATOM 255 C ASN A 16 14.821 7.852 4.686 1.00 0.21 C ATOM 256 O ASN A 16 13.805 7.693 5.355 1.00 0.22 O ATOM 257 CB ASN A 16 16.711 8.808 6.037 1.00 0.26 C ATOM 258 CG ASN A 16 15.985 9.082 7.341 1.00 0.29 C ATOM 259 OD1 ASN A 16 16.378 8.591 8.400 1.00 1.15 O ATOM 260 ND2 ASN A 16 14.935 9.880 7.278 1.00 1.03 N ATOM 0 H ASN A 16 17.592 8.036 3.836 1.00 0.23 H new ATOM 0 HA ASN A 16 16.065 6.765 5.998 1.00 0.23 H new ATOM 0 HB2 ASN A 16 17.772 8.669 6.243 1.00 0.26 H new ATOM 0 HB3 ASN A 16 16.624 9.682 5.391 1.00 0.26 H new ATOM 0 HD21 ASN A 16 14.418 10.110 8.126 1.00 1.03 H new ATOM 0 HD22 ASN A 16 14.641 10.267 6.381 1.00 1.03 H new ATOM 267 N SER A 17 14.783 8.228 3.415 1.00 0.22 N ATOM 268 CA SER A 17 13.517 8.372 2.727 1.00 0.22 C ATOM 269 C SER A 17 12.893 7.003 2.530 1.00 0.20 C ATOM 270 O SER A 17 11.690 6.833 2.703 1.00 0.21 O ATOM 271 CB SER A 17 13.714 9.064 1.375 1.00 0.25 C ATOM 272 OG SER A 17 12.471 9.423 0.796 1.00 1.21 O ATOM 0 H SER A 17 15.606 8.436 2.849 1.00 0.22 H new ATOM 0 HA SER A 17 12.852 8.990 3.331 1.00 0.22 H new ATOM 0 HB2 SER A 17 14.328 9.955 1.506 1.00 0.25 H new ATOM 0 HB3 SER A 17 14.255 8.401 0.700 1.00 0.25 H new ATOM 0 HG SER A 17 12.627 9.864 -0.065 1.00 1.21 H new ATOM 278 N ILE A 18 13.721 6.015 2.207 1.00 0.19 N ATOM 279 CA ILE A 18 13.222 4.671 2.001 1.00 0.17 C ATOM 280 C ILE A 18 12.845 4.052 3.342 1.00 0.15 C ATOM 281 O ILE A 18 11.958 3.206 3.426 1.00 0.14 O ATOM 282 CB ILE A 18 14.260 3.805 1.254 1.00 0.17 C ATOM 283 CG1 ILE A 18 14.483 4.333 -0.162 1.00 0.19 C ATOM 284 CG2 ILE A 18 13.842 2.347 1.218 1.00 0.16 C ATOM 285 CD1 ILE A 18 15.890 4.118 -0.663 1.00 0.21 C ATOM 0 H ILE A 18 14.728 6.122 2.085 1.00 0.19 H new ATOM 0 HA ILE A 18 12.330 4.716 1.377 1.00 0.17 H new ATOM 0 HB ILE A 18 15.200 3.869 1.802 1.00 0.17 H new ATOM 0 HG12 ILE A 18 13.784 3.843 -0.840 1.00 0.19 H new ATOM 0 HG13 ILE A 18 14.255 5.399 -0.185 1.00 0.19 H new ATOM 0 HG21 ILE A 18 14.595 1.766 0.685 1.00 0.16 H new ATOM 0 HG22 ILE A 18 13.747 1.971 2.236 1.00 0.16 H new ATOM 0 HG23 ILE A 18 12.884 2.256 0.706 1.00 0.16 H new ATOM 0 HD11 ILE A 18 15.981 4.516 -1.674 1.00 0.21 H new ATOM 0 HD12 ILE A 18 16.592 4.632 -0.007 1.00 0.21 H new ATOM 0 HD13 ILE A 18 16.114 3.051 -0.671 1.00 0.21 H new ATOM 297 N ALA A 19 13.483 4.510 4.403 1.00 0.15 N ATOM 298 CA ALA A 19 13.141 4.056 5.733 1.00 0.15 C ATOM 299 C ALA A 19 11.891 4.763 6.247 1.00 0.16 C ATOM 300 O ALA A 19 11.313 4.355 7.253 1.00 0.16 O ATOM 301 CB ALA A 19 14.304 4.200 6.688 1.00 0.16 C ATOM 0 H ALA A 19 14.239 5.194 4.368 1.00 0.15 H new ATOM 0 HA ALA A 19 12.914 2.992 5.673 1.00 0.15 H new ATOM 0 HB1 ALA A 19 14.009 3.849 7.677 1.00 0.16 H new ATOM 0 HB2 ALA A 19 15.145 3.607 6.329 1.00 0.16 H new ATOM 0 HB3 ALA A 19 14.598 5.248 6.748 1.00 0.16 H new ATOM 307 N ALA A 20 11.450 5.785 5.529 1.00 0.17 N ATOM 308 CA ALA A 20 10.242 6.507 5.894 1.00 0.18 C ATOM 309 C ALA A 20 9.103 5.955 5.082 1.00 0.17 C ATOM 310 O ALA A 20 7.982 5.800 5.541 1.00 0.17 O ATOM 311 CB ALA A 20 10.402 7.978 5.602 1.00 0.21 C ATOM 0 H ALA A 20 11.912 6.133 4.689 1.00 0.17 H new ATOM 0 HA ALA A 20 10.048 6.386 6.960 1.00 0.18 H new ATOM 0 HB1 ALA A 20 9.490 8.506 5.880 1.00 0.21 H new ATOM 0 HB2 ALA A 20 11.240 8.374 6.176 1.00 0.21 H new ATOM 0 HB3 ALA A 20 10.592 8.119 4.538 1.00 0.21 H new ATOM 317 N ASP A 21 9.450 5.685 3.851 1.00 0.17 N ATOM 318 CA ASP A 21 8.611 5.021 2.894 1.00 0.16 C ATOM 319 C ASP A 21 8.280 3.595 3.316 1.00 0.15 C ATOM 320 O ASP A 21 7.118 3.199 3.245 1.00 0.16 O ATOM 321 CB ASP A 21 9.329 5.032 1.555 1.00 0.18 C ATOM 322 CG ASP A 21 8.959 6.237 0.710 1.00 0.27 C ATOM 323 OD1 ASP A 21 7.873 6.818 0.933 1.00 0.34 O ATOM 324 OD2 ASP A 21 9.762 6.628 -0.166 1.00 0.53 O ATOM 0 H ASP A 21 10.365 5.933 3.474 1.00 0.17 H new ATOM 0 HA ASP A 21 7.660 5.549 2.823 1.00 0.16 H new ATOM 0 HB2 ASP A 21 10.406 5.027 1.723 1.00 0.18 H new ATOM 0 HB3 ASP A 21 9.087 4.120 1.009 1.00 0.18 H new ATOM 329 N PHE A 22 9.249 2.818 3.786 1.00 0.13 N ATOM 330 CA PHE A 22 8.926 1.442 4.149 1.00 0.12 C ATOM 331 C PHE A 22 8.688 1.298 5.646 1.00 0.13 C ATOM 332 O PHE A 22 8.476 0.191 6.143 1.00 0.13 O ATOM 333 CB PHE A 22 9.987 0.450 3.688 1.00 0.12 C ATOM 334 CG PHE A 22 10.086 0.265 2.201 1.00 0.13 C ATOM 335 CD1 PHE A 22 10.738 1.195 1.415 1.00 0.15 C ATOM 336 CD2 PHE A 22 9.539 -0.852 1.592 1.00 0.15 C ATOM 337 CE1 PHE A 22 10.844 1.018 0.049 1.00 0.17 C ATOM 338 CE2 PHE A 22 9.641 -1.036 0.228 1.00 0.17 C ATOM 339 CZ PHE A 22 10.294 -0.100 -0.545 1.00 0.18 C ATOM 0 H PHE A 22 10.221 3.098 3.921 1.00 0.13 H new ATOM 0 HA PHE A 22 8.001 1.202 3.624 1.00 0.12 H new ATOM 0 HB2 PHE A 22 10.956 0.779 4.062 1.00 0.12 H new ATOM 0 HB3 PHE A 22 9.780 -0.517 4.145 1.00 0.12 H new ATOM 0 HD1 PHE A 22 11.170 2.072 1.874 1.00 0.15 H new ATOM 0 HD2 PHE A 22 9.026 -1.589 2.192 1.00 0.15 H new ATOM 0 HE1 PHE A 22 11.357 1.753 -0.553 1.00 0.17 H new ATOM 0 HE2 PHE A 22 9.210 -1.912 -0.233 1.00 0.17 H new ATOM 0 HZ PHE A 22 10.375 -0.241 -1.613 1.00 0.18 H new ATOM 349 N ARG A 23 8.707 2.434 6.349 1.00 0.15 N ATOM 350 CA ARG A 23 8.458 2.479 7.790 1.00 0.17 C ATOM 351 C ARG A 23 9.387 1.527 8.503 1.00 0.17 C ATOM 352 O ARG A 23 8.981 0.750 9.366 1.00 0.20 O ATOM 353 CB ARG A 23 7.008 2.155 8.148 1.00 0.19 C ATOM 354 CG ARG A 23 6.052 3.308 7.958 1.00 0.23 C ATOM 355 CD ARG A 23 6.135 3.872 6.562 1.00 0.26 C ATOM 356 NE ARG A 23 5.131 4.915 6.354 1.00 0.42 N ATOM 357 CZ ARG A 23 4.440 5.086 5.227 1.00 0.71 C ATOM 358 NH1 ARG A 23 4.720 4.368 4.143 1.00 1.78 N ATOM 359 NH2 ARG A 23 3.481 6.004 5.180 1.00 0.75 N ATOM 0 H ARG A 23 8.895 3.347 5.934 1.00 0.15 H new ATOM 0 HA ARG A 23 8.649 3.502 8.116 1.00 0.17 H new ATOM 0 HB2 ARG A 23 6.674 1.316 7.538 1.00 0.19 H new ATOM 0 HB3 ARG A 23 6.966 1.830 9.188 1.00 0.19 H new ATOM 0 HG2 ARG A 23 5.034 2.974 8.156 1.00 0.23 H new ATOM 0 HG3 ARG A 23 6.277 4.091 8.682 1.00 0.23 H new ATOM 0 HD2 ARG A 23 7.130 4.282 6.391 1.00 0.26 H new ATOM 0 HD3 ARG A 23 5.990 3.073 5.835 1.00 0.26 H new ATOM 0 HE ARG A 23 4.947 5.556 7.125 1.00 0.42 H new ATOM 0 HH11 ARG A 23 5.470 3.678 4.168 1.00 1.78 H new ATOM 0 HH12 ARG A 23 4.184 4.508 3.286 1.00 1.78 H new ATOM 0 HH21 ARG A 23 3.278 6.572 6.003 1.00 0.75 H new ATOM 0 HH22 ARG A 23 2.948 6.141 4.321 1.00 0.75 H new ATOM 373 N ILE A 24 10.637 1.608 8.128 1.00 0.15 N ATOM 374 CA ILE A 24 11.665 0.766 8.680 1.00 0.15 C ATOM 375 C ILE A 24 12.708 1.616 9.380 1.00 0.16 C ATOM 376 O ILE A 24 12.492 2.799 9.655 1.00 0.19 O ATOM 377 CB ILE A 24 12.361 -0.021 7.566 1.00 0.13 C ATOM 378 CG1 ILE A 24 12.887 0.941 6.516 1.00 0.12 C ATOM 379 CG2 ILE A 24 11.391 -1.007 6.950 1.00 0.13 C ATOM 380 CD1 ILE A 24 13.832 0.314 5.530 1.00 0.11 C ATOM 0 H ILE A 24 10.973 2.266 7.425 1.00 0.15 H new ATOM 0 HA ILE A 24 11.200 0.079 9.387 1.00 0.15 H new ATOM 0 HB ILE A 24 13.201 -0.578 7.982 1.00 0.13 H new ATOM 0 HG12 ILE A 24 12.043 1.368 5.974 1.00 0.12 H new ATOM 0 HG13 ILE A 24 13.395 1.766 7.016 1.00 0.12 H new ATOM 0 HG21 ILE A 24 11.892 -1.564 6.158 1.00 0.13 H new ATOM 0 HG22 ILE A 24 11.041 -1.700 7.715 1.00 0.13 H new ATOM 0 HG23 ILE A 24 10.541 -0.468 6.532 1.00 0.13 H new ATOM 0 HD11 ILE A 24 14.162 1.066 4.814 1.00 0.11 H new ATOM 0 HD12 ILE A 24 14.696 -0.088 6.059 1.00 0.11 H new ATOM 0 HD13 ILE A 24 13.324 -0.492 5.001 1.00 0.11 H new ATOM 392 N SER A 25 13.827 1.000 9.661 1.00 0.16 N ATOM 393 CA SER A 25 14.957 1.714 10.202 1.00 0.19 C ATOM 394 C SER A 25 16.052 1.791 9.170 1.00 0.18 C ATOM 395 O SER A 25 16.287 0.843 8.423 1.00 0.19 O ATOM 396 CB SER A 25 15.434 1.045 11.475 1.00 0.23 C ATOM 397 OG SER A 25 14.721 -0.160 11.709 1.00 0.95 O ATOM 0 H SER A 25 13.981 0.001 9.524 1.00 0.16 H new ATOM 0 HA SER A 25 14.660 2.732 10.455 1.00 0.19 H new ATOM 0 HB2 SER A 25 16.501 0.833 11.402 1.00 0.23 H new ATOM 0 HB3 SER A 25 15.300 1.722 12.319 1.00 0.23 H new ATOM 0 HG SER A 25 15.045 -0.577 12.534 1.00 0.95 H new ATOM 403 N THR A 26 16.722 2.918 9.138 1.00 0.18 N ATOM 404 CA THR A 26 17.795 3.135 8.212 1.00 0.18 C ATOM 405 C THR A 26 18.978 2.323 8.666 1.00 0.16 C ATOM 406 O THR A 26 19.744 1.817 7.863 1.00 0.16 O ATOM 407 CB THR A 26 18.176 4.616 8.134 1.00 0.21 C ATOM 408 OG1 THR A 26 18.671 5.071 9.400 1.00 0.25 O ATOM 409 CG2 THR A 26 16.988 5.454 7.738 1.00 0.20 C ATOM 0 H THR A 26 16.535 3.708 9.756 1.00 0.18 H new ATOM 0 HA THR A 26 17.477 2.828 7.216 1.00 0.18 H new ATOM 0 HB THR A 26 18.955 4.721 7.379 1.00 0.21 H new ATOM 0 HG1 THR A 26 18.912 6.019 9.335 1.00 0.25 H new ATOM 0 HG21 THR A 26 17.282 6.502 7.689 1.00 0.20 H new ATOM 0 HG22 THR A 26 16.625 5.133 6.762 1.00 0.20 H new ATOM 0 HG23 THR A 26 16.196 5.334 8.477 1.00 0.20 H new ATOM 417 N ALA A 27 19.098 2.189 9.966 1.00 0.18 N ATOM 418 CA ALA A 27 20.046 1.267 10.569 1.00 0.17 C ATOM 419 C ALA A 27 19.773 -0.169 10.149 1.00 0.16 C ATOM 420 O ALA A 27 20.698 -0.977 10.084 1.00 0.18 O ATOM 421 CB ALA A 27 19.984 1.390 12.084 1.00 0.20 C ATOM 0 H ALA A 27 18.543 2.715 10.641 1.00 0.18 H new ATOM 0 HA ALA A 27 21.045 1.529 10.220 1.00 0.17 H new ATOM 0 HB1 ALA A 27 20.695 0.698 12.535 1.00 0.20 H new ATOM 0 HB2 ALA A 27 20.234 2.410 12.377 1.00 0.20 H new ATOM 0 HB3 ALA A 27 18.978 1.151 12.428 1.00 0.20 H new ATOM 427 N ALA A 28 18.528 -0.494 9.824 1.00 0.15 N ATOM 428 CA ALA A 28 18.209 -1.848 9.433 1.00 0.15 C ATOM 429 C ALA A 28 18.317 -1.962 7.933 1.00 0.14 C ATOM 430 O ALA A 28 18.636 -3.015 7.394 1.00 0.15 O ATOM 431 CB ALA A 28 16.830 -2.249 9.925 1.00 0.17 C ATOM 0 H ALA A 28 17.740 0.153 9.825 1.00 0.15 H new ATOM 0 HA ALA A 28 18.918 -2.536 9.893 1.00 0.15 H new ATOM 0 HB1 ALA A 28 16.617 -3.272 9.616 1.00 0.17 H new ATOM 0 HB2 ALA A 28 16.799 -2.184 11.013 1.00 0.17 H new ATOM 0 HB3 ALA A 28 16.083 -1.579 9.500 1.00 0.17 H new ATOM 437 N LEU A 29 18.084 -0.854 7.267 1.00 0.14 N ATOM 438 CA LEU A 29 18.253 -0.788 5.837 1.00 0.14 C ATOM 439 C LEU A 29 19.742 -0.768 5.501 1.00 0.15 C ATOM 440 O LEU A 29 20.145 -1.239 4.445 1.00 0.18 O ATOM 441 CB LEU A 29 17.529 0.439 5.294 1.00 0.15 C ATOM 442 CG LEU A 29 17.329 0.479 3.782 1.00 0.39 C ATOM 443 CD1 LEU A 29 16.464 -0.682 3.334 1.00 1.08 C ATOM 444 CD2 LEU A 29 16.708 1.801 3.357 1.00 1.16 C ATOM 0 H LEU A 29 17.775 0.018 7.698 1.00 0.14 H new ATOM 0 HA LEU A 29 17.816 -1.667 5.363 1.00 0.14 H new ATOM 0 HB2 LEU A 29 16.552 0.502 5.772 1.00 0.15 H new ATOM 0 HB3 LEU A 29 18.087 1.327 5.591 1.00 0.15 H new ATOM 0 HG LEU A 29 18.304 0.391 3.303 1.00 0.39 H new ATOM 0 HD11 LEU A 29 16.330 -0.640 2.253 1.00 1.08 H new ATOM 0 HD12 LEU A 29 16.947 -1.621 3.604 1.00 1.08 H new ATOM 0 HD13 LEU A 29 15.492 -0.621 3.823 1.00 1.08 H new ATOM 0 HD21 LEU A 29 16.574 1.809 2.275 1.00 1.16 H new ATOM 0 HD22 LEU A 29 15.740 1.921 3.844 1.00 1.16 H new ATOM 0 HD23 LEU A 29 17.364 2.621 3.647 1.00 1.16 H new ATOM 456 N LEU A 30 20.557 -0.271 6.421 1.00 0.15 N ATOM 457 CA LEU A 30 22.009 -0.353 6.290 1.00 0.17 C ATOM 458 C LEU A 30 22.479 -1.746 6.668 1.00 0.17 C ATOM 459 O LEU A 30 23.460 -2.266 6.138 1.00 0.19 O ATOM 460 CB LEU A 30 22.679 0.690 7.184 1.00 0.22 C ATOM 461 CG LEU A 30 22.444 2.135 6.757 1.00 0.55 C ATOM 462 CD1 LEU A 30 23.262 3.094 7.600 1.00 0.89 C ATOM 463 CD2 LEU A 30 22.762 2.301 5.289 1.00 1.05 C ATOM 0 H LEU A 30 20.238 0.195 7.270 1.00 0.15 H new ATOM 0 HA LEU A 30 22.285 -0.152 5.255 1.00 0.17 H new ATOM 0 HB2 LEU A 30 22.316 0.562 8.204 1.00 0.22 H new ATOM 0 HB3 LEU A 30 23.752 0.500 7.201 1.00 0.22 H new ATOM 0 HG LEU A 30 21.392 2.374 6.915 1.00 0.55 H new ATOM 0 HD11 LEU A 30 23.074 4.117 7.273 1.00 0.89 H new ATOM 0 HD12 LEU A 30 22.979 2.990 8.647 1.00 0.89 H new ATOM 0 HD13 LEU A 30 24.322 2.865 7.486 1.00 0.89 H new ATOM 0 HD21 LEU A 30 22.591 3.336 4.994 1.00 1.05 H new ATOM 0 HD22 LEU A 30 23.805 2.041 5.111 1.00 1.05 H new ATOM 0 HD23 LEU A 30 22.119 1.646 4.701 1.00 1.05 H new ATOM 475 N GLN A 31 21.743 -2.337 7.583 1.00 0.16 N ATOM 476 CA GLN A 31 21.922 -3.713 7.984 1.00 0.17 C ATOM 477 C GLN A 31 21.632 -4.637 6.821 1.00 0.20 C ATOM 478 O GLN A 31 22.335 -5.629 6.636 1.00 0.32 O ATOM 479 CB GLN A 31 21.003 -4.015 9.158 1.00 0.20 C ATOM 480 CG GLN A 31 20.906 -5.485 9.524 1.00 0.24 C ATOM 481 CD GLN A 31 19.998 -5.731 10.714 1.00 1.02 C ATOM 482 OE1 GLN A 31 19.949 -4.781 11.636 1.00 1.70 O flip ATOM 483 NE2 GLN A 31 19.350 -6.773 10.808 1.00 1.81 N flip ATOM 0 H GLN A 31 20.988 -1.864 8.079 1.00 0.16 H new ATOM 0 HA GLN A 31 22.955 -3.874 8.292 1.00 0.17 H new ATOM 0 HB2 GLN A 31 21.353 -3.460 10.028 1.00 0.20 H new ATOM 0 HB3 GLN A 31 20.004 -3.646 8.925 1.00 0.20 H new ATOM 0 HG2 GLN A 31 20.534 -6.045 8.666 1.00 0.24 H new ATOM 0 HG3 GLN A 31 21.902 -5.867 9.747 1.00 0.24 H new ATOM 0 HE21 GLN A 31 19.414 -7.481 10.077 1.00 1.81 H new ATOM 0 HE22 GLN A 31 18.749 -6.928 11.617 1.00 1.81 H new ATOM 492 N ALA A 32 20.626 -4.335 6.020 1.00 0.16 N ATOM 493 CA ALA A 32 20.359 -5.149 4.862 1.00 0.18 C ATOM 494 C ALA A 32 21.203 -4.725 3.675 1.00 0.18 C ATOM 495 O ALA A 32 21.423 -5.507 2.751 1.00 0.20 O ATOM 496 CB ALA A 32 18.885 -5.074 4.511 1.00 0.18 C ATOM 0 H ALA A 32 19.994 -3.545 6.151 1.00 0.16 H new ATOM 0 HA ALA A 32 20.624 -6.178 5.104 1.00 0.18 H new ATOM 0 HB1 ALA A 32 18.688 -5.691 3.634 1.00 0.18 H new ATOM 0 HB2 ALA A 32 18.292 -5.436 5.351 1.00 0.18 H new ATOM 0 HB3 ALA A 32 18.615 -4.040 4.295 1.00 0.18 H new ATOM 502 N ASN A 33 21.696 -3.493 3.702 1.00 0.18 N ATOM 503 CA ASN A 33 22.364 -2.930 2.547 1.00 0.20 C ATOM 504 C ASN A 33 23.437 -1.947 2.981 1.00 0.21 C ATOM 505 O ASN A 33 23.218 -0.735 3.010 1.00 0.23 O ATOM 506 CB ASN A 33 21.376 -2.192 1.668 1.00 0.20 C ATOM 507 CG ASN A 33 20.142 -2.987 1.319 1.00 0.19 C ATOM 508 OD1 ASN A 33 20.137 -3.792 0.387 1.00 0.21 O ATOM 509 ND2 ASN A 33 19.077 -2.745 2.066 1.00 0.18 N ATOM 0 H ASN A 33 21.644 -2.871 4.509 1.00 0.18 H new ATOM 0 HA ASN A 33 22.813 -3.753 1.992 1.00 0.20 H new ATOM 0 HB2 ASN A 33 21.073 -1.275 2.173 1.00 0.20 H new ATOM 0 HB3 ASN A 33 21.877 -1.897 0.746 1.00 0.20 H new ATOM 0 HD21 ASN A 33 18.202 -3.235 1.880 1.00 0.18 H new ATOM 0 HD22 ASN A 33 19.131 -2.068 2.827 1.00 0.18 H new ATOM 516 N PRO A 34 24.607 -2.467 3.323 1.00 0.25 N ATOM 517 CA PRO A 34 25.786 -1.667 3.686 1.00 0.27 C ATOM 518 C PRO A 34 26.201 -0.679 2.589 1.00 0.30 C ATOM 519 O PRO A 34 27.028 0.203 2.808 1.00 0.36 O ATOM 520 CB PRO A 34 26.878 -2.730 3.873 1.00 0.30 C ATOM 521 CG PRO A 34 26.346 -3.940 3.176 1.00 0.31 C ATOM 522 CD PRO A 34 24.878 -3.898 3.416 1.00 0.33 C ATOM 0 HA PRO A 34 25.598 -1.049 4.564 1.00 0.27 H new ATOM 0 HB2 PRO A 34 27.825 -2.407 3.440 1.00 0.30 H new ATOM 0 HB3 PRO A 34 27.062 -2.929 4.929 1.00 0.30 H new ATOM 0 HG2 PRO A 34 26.574 -3.916 2.110 1.00 0.31 H new ATOM 0 HG3 PRO A 34 26.787 -4.853 3.576 1.00 0.31 H new ATOM 0 HD2 PRO A 34 24.324 -4.469 2.671 1.00 0.33 H new ATOM 0 HD3 PRO A 34 24.610 -4.303 4.392 1.00 0.33 H new ATOM 530 N SER A 35 25.625 -0.839 1.411 1.00 0.29 N ATOM 531 CA SER A 35 25.944 -0.012 0.270 1.00 0.34 C ATOM 532 C SER A 35 25.280 1.363 0.355 1.00 0.33 C ATOM 533 O SER A 35 25.718 2.312 -0.289 1.00 0.37 O ATOM 534 CB SER A 35 25.472 -0.737 -0.981 1.00 0.38 C ATOM 535 OG SER A 35 25.939 -2.077 -0.992 1.00 1.38 O ATOM 0 H SER A 35 24.920 -1.551 1.222 1.00 0.29 H new ATOM 0 HA SER A 35 27.021 0.155 0.245 1.00 0.34 H new ATOM 0 HB2 SER A 35 24.383 -0.726 -1.024 1.00 0.38 H new ATOM 0 HB3 SER A 35 25.831 -0.214 -1.867 1.00 0.38 H new ATOM 0 HG SER A 35 25.623 -2.527 -1.804 1.00 1.38 H new ATOM 541 N LEU A 36 24.239 1.465 1.170 1.00 0.31 N ATOM 542 CA LEU A 36 23.397 2.662 1.203 1.00 0.32 C ATOM 543 C LEU A 36 24.053 3.800 1.954 1.00 0.36 C ATOM 544 O LEU A 36 23.873 4.970 1.625 1.00 0.40 O ATOM 545 CB LEU A 36 22.083 2.353 1.896 1.00 0.30 C ATOM 546 CG LEU A 36 21.256 1.278 1.238 1.00 0.27 C ATOM 547 CD1 LEU A 36 20.191 0.779 2.192 1.00 0.48 C ATOM 548 CD2 LEU A 36 20.615 1.810 -0.027 1.00 0.49 C ATOM 0 H LEU A 36 23.953 0.733 1.821 1.00 0.31 H new ATOM 0 HA LEU A 36 23.238 2.962 0.167 1.00 0.32 H new ATOM 0 HB2 LEU A 36 22.292 2.053 2.923 1.00 0.30 H new ATOM 0 HB3 LEU A 36 21.491 3.267 1.946 1.00 0.30 H new ATOM 0 HG LEU A 36 21.910 0.446 0.976 1.00 0.27 H new ATOM 0 HD11 LEU A 36 19.601 0.003 1.705 1.00 0.48 H new ATOM 0 HD12 LEU A 36 20.665 0.368 3.084 1.00 0.48 H new ATOM 0 HD13 LEU A 36 19.540 1.606 2.475 1.00 0.48 H new ATOM 0 HD21 LEU A 36 20.021 1.024 -0.492 1.00 0.49 H new ATOM 0 HD22 LEU A 36 19.971 2.654 0.219 1.00 0.49 H new ATOM 0 HD23 LEU A 36 21.392 2.136 -0.719 1.00 0.49 H new ATOM 560 N GLN A 37 24.799 3.433 2.969 1.00 0.38 N ATOM 561 CA GLN A 37 25.346 4.400 3.917 1.00 0.43 C ATOM 562 C GLN A 37 26.291 5.337 3.238 1.00 0.45 C ATOM 563 O GLN A 37 26.258 6.556 3.408 1.00 0.49 O ATOM 564 CB GLN A 37 26.063 3.684 5.057 1.00 0.46 C ATOM 565 CG GLN A 37 26.928 2.511 4.644 1.00 0.49 C ATOM 566 CD GLN A 37 28.393 2.870 4.492 1.00 1.14 C ATOM 567 OE1 GLN A 37 28.892 3.791 5.145 1.00 1.27 O ATOM 568 NE2 GLN A 37 29.093 2.140 3.641 1.00 1.95 N ATOM 0 H GLN A 37 25.048 2.464 3.168 1.00 0.38 H new ATOM 0 HA GLN A 37 24.515 4.976 4.324 1.00 0.43 H new ATOM 0 HB2 GLN A 37 26.687 4.407 5.582 1.00 0.46 H new ATOM 0 HB3 GLN A 37 25.317 3.331 5.768 1.00 0.46 H new ATOM 0 HG2 GLN A 37 26.831 1.718 5.385 1.00 0.49 H new ATOM 0 HG3 GLN A 37 26.559 2.111 3.699 1.00 0.49 H new ATOM 0 HE21 GLN A 37 28.640 1.388 3.122 1.00 1.95 H new ATOM 0 HE22 GLN A 37 30.086 2.329 3.504 1.00 1.95 H new ATOM 577 N ALA A 38 27.113 4.720 2.470 1.00 0.43 N ATOM 578 CA ALA A 38 28.135 5.375 1.717 1.00 0.46 C ATOM 579 C ALA A 38 27.536 6.321 0.696 1.00 0.46 C ATOM 580 O ALA A 38 27.949 7.476 0.570 1.00 0.49 O ATOM 581 CB ALA A 38 28.933 4.300 1.048 1.00 0.48 C ATOM 0 H ALA A 38 27.097 3.709 2.339 1.00 0.43 H new ATOM 0 HA ALA A 38 28.767 5.980 2.367 1.00 0.46 H new ATOM 0 HB1 ALA A 38 29.730 4.752 0.458 1.00 0.48 H new ATOM 0 HB2 ALA A 38 29.368 3.646 1.804 1.00 0.48 H new ATOM 0 HB3 ALA A 38 28.283 3.718 0.395 1.00 0.48 H new ATOM 587 N GLY A 39 26.541 5.816 -0.007 1.00 0.42 N ATOM 588 CA GLY A 39 25.877 6.576 -1.020 1.00 0.42 C ATOM 589 C GLY A 39 24.753 5.791 -1.629 1.00 0.39 C ATOM 590 O GLY A 39 24.536 4.634 -1.274 1.00 0.40 O ATOM 0 H GLY A 39 26.179 4.870 0.115 1.00 0.42 H new ATOM 0 HA2 GLY A 39 25.490 7.500 -0.591 1.00 0.42 H new ATOM 0 HA3 GLY A 39 26.590 6.858 -1.795 1.00 0.42 H new ATOM 594 N LEU A 40 24.048 6.402 -2.553 1.00 0.39 N ATOM 595 CA LEU A 40 22.940 5.742 -3.205 1.00 0.38 C ATOM 596 C LEU A 40 23.237 5.490 -4.665 1.00 0.39 C ATOM 597 O LEU A 40 24.085 6.151 -5.269 1.00 0.41 O ATOM 598 CB LEU A 40 21.659 6.555 -3.060 1.00 0.40 C ATOM 599 CG LEU A 40 20.872 6.333 -1.764 1.00 0.39 C ATOM 600 CD1 LEU A 40 21.317 5.074 -1.034 1.00 0.40 C ATOM 601 CD2 LEU A 40 20.989 7.546 -0.863 1.00 0.39 C ATOM 0 H LEU A 40 24.222 7.356 -2.870 1.00 0.39 H new ATOM 0 HA LEU A 40 22.796 4.779 -2.714 1.00 0.38 H new ATOM 0 HB2 LEU A 40 21.912 7.613 -3.133 1.00 0.40 H new ATOM 0 HB3 LEU A 40 21.007 6.325 -3.903 1.00 0.40 H new ATOM 0 HG LEU A 40 19.825 6.193 -2.035 1.00 0.39 H new ATOM 0 HD11 LEU A 40 20.732 4.957 -0.122 1.00 0.40 H new ATOM 0 HD12 LEU A 40 21.164 4.207 -1.677 1.00 0.40 H new ATOM 0 HD13 LEU A 40 22.374 5.155 -0.780 1.00 0.40 H new ATOM 0 HD21 LEU A 40 20.425 7.374 0.054 1.00 0.39 H new ATOM 0 HD22 LEU A 40 22.037 7.717 -0.618 1.00 0.39 H new ATOM 0 HD23 LEU A 40 20.589 8.420 -1.376 1.00 0.39 H new ATOM 613 N THR A 41 22.537 4.527 -5.219 1.00 0.38 N ATOM 614 CA THR A 41 22.741 4.124 -6.595 1.00 0.40 C ATOM 615 C THR A 41 21.408 3.881 -7.275 1.00 0.40 C ATOM 616 O THR A 41 20.590 3.117 -6.780 1.00 0.38 O ATOM 617 CB THR A 41 23.572 2.837 -6.679 1.00 0.39 C ATOM 618 OG1 THR A 41 24.811 3.000 -5.970 1.00 0.40 O ATOM 619 CG2 THR A 41 23.851 2.498 -8.133 1.00 0.42 C ATOM 0 H THR A 41 21.812 4.001 -4.732 1.00 0.38 H new ATOM 0 HA THR A 41 23.277 4.931 -7.095 1.00 0.40 H new ATOM 0 HB THR A 41 23.009 2.023 -6.222 1.00 0.39 H new ATOM 0 HG1 THR A 41 25.333 2.173 -6.029 1.00 0.40 H new ATOM 0 HG21 THR A 41 24.441 1.583 -8.187 1.00 0.42 H new ATOM 0 HG22 THR A 41 22.908 2.353 -8.660 1.00 0.42 H new ATOM 0 HG23 THR A 41 24.404 3.314 -8.597 1.00 0.42 H new ATOM 627 N ALA A 42 21.194 4.499 -8.419 1.00 0.44 N ATOM 628 CA ALA A 42 19.938 4.329 -9.116 1.00 0.44 C ATOM 629 C ALA A 42 19.911 2.983 -9.791 1.00 0.43 C ATOM 630 O ALA A 42 20.768 2.662 -10.613 1.00 0.47 O ATOM 631 CB ALA A 42 19.704 5.417 -10.132 1.00 0.47 C ATOM 0 H ALA A 42 21.864 5.115 -8.880 1.00 0.44 H new ATOM 0 HA ALA A 42 19.138 4.391 -8.379 1.00 0.44 H new ATOM 0 HB1 ALA A 42 18.750 5.249 -10.631 1.00 0.47 H new ATOM 0 HB2 ALA A 42 19.686 6.385 -9.631 1.00 0.47 H new ATOM 0 HB3 ALA A 42 20.506 5.405 -10.870 1.00 0.47 H new ATOM 637 N GLY A 43 18.940 2.192 -9.413 1.00 0.40 N ATOM 638 CA GLY A 43 18.804 0.879 -9.971 1.00 0.41 C ATOM 639 C GLY A 43 19.374 -0.148 -9.033 1.00 0.38 C ATOM 640 O GLY A 43 19.352 -1.348 -9.305 1.00 0.39 O ATOM 0 H GLY A 43 18.233 2.438 -8.720 1.00 0.40 H new ATOM 0 HA2 GLY A 43 17.752 0.664 -10.161 1.00 0.41 H new ATOM 0 HA3 GLY A 43 19.318 0.829 -10.931 1.00 0.41 H new ATOM 644 N GLN A 44 19.884 0.341 -7.916 1.00 0.37 N ATOM 645 CA GLN A 44 20.443 -0.508 -6.901 1.00 0.35 C ATOM 646 C GLN A 44 19.329 -1.196 -6.149 1.00 0.32 C ATOM 647 O GLN A 44 18.402 -0.554 -5.663 1.00 0.29 O ATOM 648 CB GLN A 44 21.320 0.323 -5.974 1.00 0.35 C ATOM 649 CG GLN A 44 21.343 -0.128 -4.548 1.00 0.32 C ATOM 650 CD GLN A 44 21.685 1.023 -3.616 1.00 0.56 C ATOM 651 OE1 GLN A 44 21.390 2.181 -3.906 1.00 1.30 O ATOM 652 NE2 GLN A 44 22.310 0.723 -2.496 1.00 0.29 N ATOM 0 H GLN A 44 19.918 1.336 -7.696 1.00 0.37 H new ATOM 0 HA GLN A 44 21.067 -1.279 -7.354 1.00 0.35 H new ATOM 0 HB2 GLN A 44 22.340 0.313 -6.358 1.00 0.35 H new ATOM 0 HB3 GLN A 44 20.978 1.357 -6.006 1.00 0.35 H new ATOM 0 HG2 GLN A 44 20.371 -0.542 -4.278 1.00 0.32 H new ATOM 0 HG3 GLN A 44 22.074 -0.927 -4.428 1.00 0.32 H new ATOM 0 HE21 GLN A 44 22.540 -0.248 -2.285 1.00 0.29 H new ATOM 0 HE22 GLN A 44 22.563 1.462 -1.840 1.00 0.29 H new ATOM 661 N SER A 45 19.399 -2.504 -6.103 1.00 0.32 N ATOM 662 CA SER A 45 18.429 -3.267 -5.369 1.00 0.29 C ATOM 663 C SER A 45 18.849 -3.377 -3.926 1.00 0.26 C ATOM 664 O SER A 45 20.002 -3.676 -3.610 1.00 0.29 O ATOM 665 CB SER A 45 18.252 -4.641 -5.959 1.00 0.31 C ATOM 666 OG SER A 45 17.871 -4.573 -7.324 1.00 0.85 O ATOM 0 H SER A 45 20.119 -3.059 -6.566 1.00 0.32 H new ATOM 0 HA SER A 45 17.473 -2.748 -5.431 1.00 0.29 H new ATOM 0 HB2 SER A 45 19.183 -5.201 -5.867 1.00 0.31 H new ATOM 0 HB3 SER A 45 17.495 -5.186 -5.395 1.00 0.31 H new ATOM 0 HG SER A 45 17.765 -5.480 -7.680 1.00 0.85 H new ATOM 672 N ILE A 46 17.904 -3.116 -3.069 1.00 0.24 N ATOM 673 CA ILE A 46 18.133 -3.095 -1.649 1.00 0.21 C ATOM 674 C ILE A 46 17.040 -3.881 -0.953 1.00 0.20 C ATOM 675 O ILE A 46 15.896 -3.878 -1.397 1.00 0.23 O ATOM 676 CB ILE A 46 18.131 -1.650 -1.131 1.00 0.22 C ATOM 677 CG1 ILE A 46 16.802 -0.990 -1.476 1.00 0.24 C ATOM 678 CG2 ILE A 46 19.286 -0.883 -1.752 1.00 0.25 C ATOM 679 CD1 ILE A 46 16.422 0.163 -0.578 1.00 0.21 C ATOM 0 H ILE A 46 16.942 -2.909 -3.337 1.00 0.24 H new ATOM 0 HA ILE A 46 19.104 -3.544 -1.439 1.00 0.21 H new ATOM 0 HB ILE A 46 18.254 -1.646 -0.048 1.00 0.22 H new ATOM 0 HG12 ILE A 46 16.845 -0.633 -2.505 1.00 0.24 H new ATOM 0 HG13 ILE A 46 16.015 -1.743 -1.432 1.00 0.24 H new ATOM 0 HG21 ILE A 46 19.282 0.142 -1.383 1.00 0.25 H new ATOM 0 HG22 ILE A 46 20.227 -1.362 -1.483 1.00 0.25 H new ATOM 0 HG23 ILE A 46 19.178 -0.878 -2.837 1.00 0.25 H new ATOM 0 HD11 ILE A 46 15.463 0.572 -0.897 1.00 0.21 H new ATOM 0 HD12 ILE A 46 16.343 -0.188 0.451 1.00 0.21 H new ATOM 0 HD13 ILE A 46 17.185 0.939 -0.639 1.00 0.21 H new ATOM 691 N VAL A 47 17.390 -4.587 0.101 1.00 0.19 N ATOM 692 CA VAL A 47 16.417 -5.371 0.821 1.00 0.18 C ATOM 693 C VAL A 47 15.770 -4.555 1.920 1.00 0.15 C ATOM 694 O VAL A 47 16.379 -3.644 2.476 1.00 0.14 O ATOM 695 CB VAL A 47 17.031 -6.629 1.444 1.00 0.22 C ATOM 696 CG1 VAL A 47 16.236 -7.851 1.048 1.00 0.53 C ATOM 697 CG2 VAL A 47 18.509 -6.775 1.095 1.00 0.67 C ATOM 0 H VAL A 47 18.338 -4.632 0.475 1.00 0.19 H new ATOM 0 HA VAL A 47 15.668 -5.673 0.089 1.00 0.18 H new ATOM 0 HB VAL A 47 16.981 -6.528 2.528 1.00 0.22 H new ATOM 0 HG11 VAL A 47 16.683 -8.738 1.498 1.00 0.53 H new ATOM 0 HG12 VAL A 47 15.209 -7.746 1.398 1.00 0.53 H new ATOM 0 HG13 VAL A 47 16.241 -7.953 -0.037 1.00 0.53 H new ATOM 0 HG21 VAL A 47 18.904 -7.680 1.557 1.00 0.67 H new ATOM 0 HG22 VAL A 47 18.623 -6.841 0.013 1.00 0.67 H new ATOM 0 HG23 VAL A 47 19.058 -5.909 1.465 1.00 0.67 H new ATOM 707 N ILE A 48 14.532 -4.921 2.227 1.00 0.14 N ATOM 708 CA ILE A 48 13.736 -4.226 3.225 1.00 0.13 C ATOM 709 C ILE A 48 13.455 -5.167 4.390 1.00 0.13 C ATOM 710 O ILE A 48 12.495 -5.937 4.373 1.00 0.16 O ATOM 711 CB ILE A 48 12.406 -3.689 2.645 1.00 0.13 C ATOM 712 CG1 ILE A 48 12.662 -2.847 1.388 1.00 0.14 C ATOM 713 CG2 ILE A 48 11.666 -2.866 3.694 1.00 0.13 C ATOM 714 CD1 ILE A 48 13.633 -1.707 1.602 1.00 0.14 C ATOM 0 H ILE A 48 14.053 -5.708 1.790 1.00 0.14 H new ATOM 0 HA ILE A 48 14.308 -3.363 3.567 1.00 0.13 H new ATOM 0 HB ILE A 48 11.785 -4.540 2.365 1.00 0.13 H new ATOM 0 HG12 ILE A 48 13.046 -3.495 0.600 1.00 0.14 H new ATOM 0 HG13 ILE A 48 11.714 -2.442 1.034 1.00 0.14 H new ATOM 0 HG21 ILE A 48 10.732 -2.494 3.272 1.00 0.13 H new ATOM 0 HG22 ILE A 48 11.450 -3.491 4.561 1.00 0.13 H new ATOM 0 HG23 ILE A 48 12.287 -2.024 4.000 1.00 0.13 H new ATOM 0 HD11 ILE A 48 13.762 -1.159 0.669 1.00 0.14 H new ATOM 0 HD12 ILE A 48 13.243 -1.035 2.366 1.00 0.14 H new ATOM 0 HD13 ILE A 48 14.595 -2.104 1.925 1.00 0.14 H new ATOM 726 N PRO A 49 14.330 -5.131 5.405 1.00 0.13 N ATOM 727 CA PRO A 49 14.258 -6.035 6.543 1.00 0.16 C ATOM 728 C PRO A 49 12.935 -5.944 7.282 1.00 0.17 C ATOM 729 O PRO A 49 12.430 -4.856 7.565 1.00 0.18 O ATOM 730 CB PRO A 49 15.409 -5.631 7.460 1.00 0.17 C ATOM 731 CG PRO A 49 16.095 -4.470 6.820 1.00 0.15 C ATOM 732 CD PRO A 49 15.457 -4.203 5.485 1.00 0.15 C ATOM 0 HA PRO A 49 14.332 -7.070 6.209 1.00 0.16 H new ATOM 0 HB2 PRO A 49 15.037 -5.361 8.448 1.00 0.17 H new ATOM 0 HB3 PRO A 49 16.103 -6.461 7.596 1.00 0.17 H new ATOM 0 HG2 PRO A 49 16.019 -3.589 7.457 1.00 0.15 H new ATOM 0 HG3 PRO A 49 17.157 -4.682 6.695 1.00 0.15 H new ATOM 0 HD2 PRO A 49 15.121 -3.169 5.409 1.00 0.15 H new ATOM 0 HD3 PRO A 49 16.163 -4.370 4.671 1.00 0.15 H new ATOM 740 N GLY A 50 12.388 -7.111 7.586 1.00 0.20 N ATOM 741 CA GLY A 50 11.112 -7.194 8.247 1.00 0.23 C ATOM 742 C GLY A 50 9.963 -7.309 7.270 1.00 0.23 C ATOM 743 O GLY A 50 8.815 -7.508 7.672 1.00 0.26 O ATOM 0 H GLY A 50 12.817 -8.013 7.381 1.00 0.20 H new ATOM 0 HA2 GLY A 50 11.106 -8.057 8.913 1.00 0.23 H new ATOM 0 HA3 GLY A 50 10.970 -6.310 8.869 1.00 0.23 H new ATOM 747 N LEU A 51 10.264 -7.196 5.986 1.00 0.20 N ATOM 748 CA LEU A 51 9.246 -7.265 4.958 1.00 0.20 C ATOM 749 C LEU A 51 9.621 -8.264 3.870 1.00 0.20 C ATOM 750 O LEU A 51 10.650 -8.128 3.212 1.00 0.21 O ATOM 751 CB LEU A 51 9.046 -5.878 4.387 1.00 0.23 C ATOM 752 CG LEU A 51 8.214 -5.786 3.123 1.00 0.24 C ATOM 753 CD1 LEU A 51 6.749 -6.026 3.435 1.00 0.61 C ATOM 754 CD2 LEU A 51 8.429 -4.429 2.501 1.00 0.53 C ATOM 0 H LEU A 51 11.211 -7.056 5.633 1.00 0.20 H new ATOM 0 HA LEU A 51 8.312 -7.618 5.394 1.00 0.20 H new ATOM 0 HB2 LEU A 51 8.577 -5.258 5.151 1.00 0.23 H new ATOM 0 HB3 LEU A 51 10.026 -5.447 4.184 1.00 0.23 H new ATOM 0 HG LEU A 51 8.524 -6.555 2.415 1.00 0.24 H new ATOM 0 HD11 LEU A 51 6.165 -5.956 2.517 1.00 0.61 H new ATOM 0 HD12 LEU A 51 6.627 -7.019 3.868 1.00 0.61 H new ATOM 0 HD13 LEU A 51 6.400 -5.275 4.144 1.00 0.61 H new ATOM 0 HD21 LEU A 51 7.836 -4.348 1.590 1.00 0.53 H new ATOM 0 HD22 LEU A 51 8.122 -3.654 3.203 1.00 0.53 H new ATOM 0 HD23 LEU A 51 9.484 -4.303 2.260 1.00 0.53 H new ATOM 766 N PRO A 52 8.774 -9.282 3.678 1.00 0.22 N ATOM 767 CA PRO A 52 9.040 -10.385 2.774 1.00 0.25 C ATOM 768 C PRO A 52 8.748 -10.078 1.316 1.00 0.25 C ATOM 769 O PRO A 52 8.310 -8.987 0.958 1.00 0.24 O ATOM 770 CB PRO A 52 8.112 -11.482 3.250 1.00 0.28 C ATOM 771 CG PRO A 52 6.975 -10.774 3.905 1.00 0.27 C ATOM 772 CD PRO A 52 7.486 -9.424 4.346 1.00 0.23 C ATOM 0 HA PRO A 52 10.100 -10.640 2.798 1.00 0.25 H new ATOM 0 HB2 PRO A 52 7.767 -12.095 2.417 1.00 0.28 H new ATOM 0 HB3 PRO A 52 8.616 -12.149 3.949 1.00 0.28 H new ATOM 0 HG2 PRO A 52 6.141 -10.662 3.212 1.00 0.27 H new ATOM 0 HG3 PRO A 52 6.607 -11.344 4.758 1.00 0.27 H new ATOM 0 HD2 PRO A 52 6.800 -8.627 4.058 1.00 0.23 H new ATOM 0 HD3 PRO A 52 7.594 -9.376 5.430 1.00 0.23 H new ATOM 780 N ASP A 53 8.946 -11.095 0.497 1.00 0.30 N ATOM 781 CA ASP A 53 8.959 -10.960 -0.941 1.00 0.32 C ATOM 782 C ASP A 53 7.564 -10.768 -1.533 1.00 0.33 C ATOM 783 O ASP A 53 6.627 -11.502 -1.210 1.00 0.35 O ATOM 784 CB ASP A 53 9.611 -12.200 -1.525 1.00 0.36 C ATOM 785 CG ASP A 53 9.898 -12.079 -3.005 1.00 0.39 C ATOM 786 OD1 ASP A 53 8.973 -12.280 -3.815 1.00 0.49 O ATOM 787 OD2 ASP A 53 11.048 -11.769 -3.368 1.00 0.45 O ATOM 0 H ASP A 53 9.104 -12.049 0.820 1.00 0.30 H new ATOM 0 HA ASP A 53 9.522 -10.063 -1.196 1.00 0.32 H new ATOM 0 HB2 ASP A 53 10.543 -12.397 -0.995 1.00 0.36 H new ATOM 0 HB3 ASP A 53 8.961 -13.059 -1.356 1.00 0.36 H new ATOM 792 N PRO A 54 7.446 -9.797 -2.447 1.00 0.35 N ATOM 793 CA PRO A 54 6.174 -9.398 -3.066 1.00 0.39 C ATOM 794 C PRO A 54 5.704 -10.374 -4.145 1.00 0.41 C ATOM 795 O PRO A 54 4.542 -10.353 -4.556 1.00 0.46 O ATOM 796 CB PRO A 54 6.533 -8.041 -3.692 1.00 0.43 C ATOM 797 CG PRO A 54 7.965 -8.184 -4.053 1.00 0.41 C ATOM 798 CD PRO A 54 8.573 -8.992 -2.948 1.00 0.37 C ATOM 0 HA PRO A 54 5.354 -9.370 -2.349 1.00 0.39 H new ATOM 0 HB2 PRO A 54 5.919 -7.830 -4.568 1.00 0.43 H new ATOM 0 HB3 PRO A 54 6.378 -7.223 -2.989 1.00 0.43 H new ATOM 0 HG2 PRO A 54 8.080 -8.684 -5.015 1.00 0.41 H new ATOM 0 HG3 PRO A 54 8.448 -7.211 -4.140 1.00 0.41 H new ATOM 0 HD2 PRO A 54 9.385 -9.622 -3.312 1.00 0.37 H new ATOM 0 HD3 PRO A 54 8.989 -8.355 -2.167 1.00 0.37 H new ATOM 806 N TYR A 55 6.599 -11.233 -4.601 1.00 0.41 N ATOM 807 CA TYR A 55 6.270 -12.182 -5.655 1.00 0.45 C ATOM 808 C TYR A 55 5.863 -13.530 -5.073 1.00 0.45 C ATOM 809 O TYR A 55 5.262 -14.359 -5.757 1.00 0.51 O ATOM 810 CB TYR A 55 7.444 -12.340 -6.618 1.00 0.52 C ATOM 811 CG TYR A 55 7.639 -11.161 -7.555 1.00 0.68 C ATOM 812 CD1 TYR A 55 6.751 -10.094 -7.561 1.00 1.14 C ATOM 813 CD2 TYR A 55 8.711 -11.118 -8.437 1.00 0.93 C ATOM 814 CE1 TYR A 55 6.920 -9.024 -8.411 1.00 1.33 C ATOM 815 CE2 TYR A 55 8.890 -10.046 -9.294 1.00 1.10 C ATOM 816 CZ TYR A 55 7.992 -9.001 -9.277 1.00 1.13 C ATOM 817 OH TYR A 55 8.161 -7.930 -10.126 1.00 1.38 O ATOM 0 H TYR A 55 7.558 -11.294 -4.260 1.00 0.41 H new ATOM 0 HA TYR A 55 5.419 -11.789 -6.211 1.00 0.45 H new ATOM 0 HB2 TYR A 55 8.357 -12.486 -6.041 1.00 0.52 H new ATOM 0 HB3 TYR A 55 7.294 -13.242 -7.212 1.00 0.52 H new ATOM 0 HD1 TYR A 55 5.909 -10.103 -6.884 1.00 1.14 H new ATOM 0 HD2 TYR A 55 9.417 -11.935 -8.454 1.00 0.93 H new ATOM 0 HE1 TYR A 55 6.215 -8.206 -8.399 1.00 1.33 H new ATOM 0 HE2 TYR A 55 9.730 -10.029 -9.973 1.00 1.10 H new ATOM 0 HH TYR A 55 8.964 -8.067 -10.670 1.00 1.38 H new ATOM 827 N THR A 56 6.181 -13.735 -3.802 1.00 0.41 N ATOM 828 CA THR A 56 5.763 -14.938 -3.089 1.00 0.43 C ATOM 829 C THR A 56 4.317 -14.797 -2.668 1.00 0.41 C ATOM 830 O THR A 56 3.658 -15.757 -2.269 1.00 0.46 O ATOM 831 CB THR A 56 6.631 -15.167 -1.846 1.00 0.44 C ATOM 832 OG1 THR A 56 6.311 -14.211 -0.822 1.00 0.41 O ATOM 833 CG2 THR A 56 8.077 -15.015 -2.228 1.00 0.46 C ATOM 0 H THR A 56 6.729 -13.083 -3.241 1.00 0.41 H new ATOM 0 HA THR A 56 5.878 -15.792 -3.757 1.00 0.43 H new ATOM 0 HB THR A 56 6.442 -16.169 -1.461 1.00 0.44 H new ATOM 0 HG1 THR A 56 6.492 -13.306 -1.151 1.00 0.41 H new ATOM 0 HG21 THR A 56 8.704 -15.176 -1.351 1.00 0.46 H new ATOM 0 HG22 THR A 56 8.330 -15.748 -2.994 1.00 0.46 H new ATOM 0 HG23 THR A 56 8.247 -14.011 -2.616 1.00 0.46 H new ATOM 841 N ILE A 57 3.854 -13.568 -2.760 1.00 0.38 N ATOM 842 CA ILE A 57 2.467 -13.235 -2.475 1.00 0.36 C ATOM 843 C ILE A 57 1.544 -13.926 -3.473 1.00 0.25 C ATOM 844 O ILE A 57 1.728 -13.794 -4.685 1.00 0.27 O ATOM 845 CB ILE A 57 2.220 -11.720 -2.574 1.00 0.44 C ATOM 846 CG1 ILE A 57 3.269 -10.933 -1.780 1.00 0.70 C ATOM 847 CG2 ILE A 57 0.807 -11.397 -2.101 1.00 0.38 C ATOM 848 CD1 ILE A 57 3.152 -11.041 -0.280 1.00 0.16 C ATOM 0 H ILE A 57 4.426 -12.769 -3.034 1.00 0.38 H new ATOM 0 HA ILE A 57 2.259 -13.571 -1.459 1.00 0.36 H new ATOM 0 HB ILE A 57 2.316 -11.417 -3.617 1.00 0.44 H new ATOM 0 HG12 ILE A 57 4.260 -11.277 -2.077 1.00 0.70 H new ATOM 0 HG13 ILE A 57 3.200 -9.882 -2.059 1.00 0.70 H new ATOM 0 HG21 ILE A 57 0.636 -10.323 -2.173 1.00 0.38 H new ATOM 0 HG22 ILE A 57 0.085 -11.922 -2.727 1.00 0.38 H new ATOM 0 HG23 ILE A 57 0.688 -11.715 -1.065 1.00 0.38 H new ATOM 0 HD11 ILE A 57 3.938 -10.450 0.190 1.00 0.16 H new ATOM 0 HD12 ILE A 57 2.178 -10.667 0.037 1.00 0.16 H new ATOM 0 HD13 ILE A 57 3.255 -12.084 0.019 1.00 0.16 H new ATOM 860 N PRO A 58 0.549 -14.681 -2.986 1.00 0.26 N ATOM 861 CA PRO A 58 -0.408 -15.358 -3.848 1.00 0.28 C ATOM 862 C PRO A 58 -1.514 -14.431 -4.352 1.00 0.23 C ATOM 863 O PRO A 58 -2.240 -14.768 -5.286 1.00 0.31 O ATOM 864 CB PRO A 58 -0.980 -16.451 -2.951 1.00 0.38 C ATOM 865 CG PRO A 58 -0.881 -15.899 -1.571 1.00 0.39 C ATOM 866 CD PRO A 58 0.300 -14.961 -1.564 1.00 0.36 C ATOM 0 HA PRO A 58 0.062 -15.737 -4.755 1.00 0.28 H new ATOM 0 HB2 PRO A 58 -2.013 -16.678 -3.213 1.00 0.38 H new ATOM 0 HB3 PRO A 58 -0.415 -17.378 -3.048 1.00 0.38 H new ATOM 0 HG2 PRO A 58 -1.795 -15.372 -1.298 1.00 0.39 H new ATOM 0 HG3 PRO A 58 -0.745 -16.699 -0.843 1.00 0.39 H new ATOM 0 HD2 PRO A 58 0.080 -14.048 -1.011 1.00 0.36 H new ATOM 0 HD3 PRO A 58 1.169 -15.418 -1.090 1.00 0.36 H new ATOM 874 N TYR A 59 -1.649 -13.270 -3.727 1.00 0.16 N ATOM 875 CA TYR A 59 -2.645 -12.297 -4.148 1.00 0.14 C ATOM 876 C TYR A 59 -2.012 -11.210 -4.990 1.00 0.16 C ATOM 877 O TYR A 59 -0.792 -11.164 -5.150 1.00 0.24 O ATOM 878 CB TYR A 59 -3.340 -11.665 -2.947 1.00 0.17 C ATOM 879 CG TYR A 59 -3.930 -12.679 -2.014 1.00 0.17 C ATOM 880 CD1 TYR A 59 -5.190 -13.199 -2.248 1.00 0.16 C ATOM 881 CD2 TYR A 59 -3.224 -13.122 -0.909 1.00 0.22 C ATOM 882 CE1 TYR A 59 -5.737 -14.139 -1.409 1.00 0.17 C ATOM 883 CE2 TYR A 59 -3.761 -14.063 -0.058 1.00 0.23 C ATOM 884 CZ TYR A 59 -5.020 -14.571 -0.311 1.00 0.20 C ATOM 885 OH TYR A 59 -5.560 -15.510 0.534 1.00 0.22 O ATOM 0 H TYR A 59 -1.083 -12.980 -2.929 1.00 0.16 H new ATOM 0 HA TYR A 59 -3.386 -12.828 -4.745 1.00 0.14 H new ATOM 0 HB2 TYR A 59 -2.624 -11.050 -2.402 1.00 0.17 H new ATOM 0 HB3 TYR A 59 -4.129 -11.000 -3.299 1.00 0.17 H new ATOM 0 HD1 TYR A 59 -5.753 -12.860 -3.105 1.00 0.16 H new ATOM 0 HD2 TYR A 59 -2.239 -12.725 -0.711 1.00 0.22 H new ATOM 0 HE1 TYR A 59 -6.721 -14.537 -1.607 1.00 0.17 H new ATOM 0 HE2 TYR A 59 -3.201 -14.401 0.801 1.00 0.23 H new ATOM 0 HH TYR A 59 -4.926 -15.705 1.255 1.00 0.22 H new ATOM 895 N HIS A 60 -2.848 -10.339 -5.529 1.00 0.13 N ATOM 896 CA HIS A 60 -2.383 -9.193 -6.284 1.00 0.14 C ATOM 897 C HIS A 60 -3.466 -8.120 -6.278 1.00 0.15 C ATOM 898 O HIS A 60 -4.645 -8.412 -6.490 1.00 0.18 O ATOM 899 CB HIS A 60 -2.032 -9.593 -7.720 1.00 0.16 C ATOM 900 CG HIS A 60 -1.420 -8.488 -8.522 1.00 1.18 C ATOM 901 ND1 HIS A 60 -2.129 -7.825 -9.493 1.00 2.11 N ATOM 902 CD2 HIS A 60 -0.168 -7.981 -8.463 1.00 1.76 C ATOM 903 CE1 HIS A 60 -1.298 -6.932 -10.001 1.00 2.89 C ATOM 904 NE2 HIS A 60 -0.097 -6.991 -9.407 1.00 2.69 N ATOM 0 H HIS A 60 -3.863 -10.407 -5.455 1.00 0.13 H new ATOM 0 HA HIS A 60 -1.479 -8.800 -5.819 1.00 0.14 H new ATOM 0 HB2 HIS A 60 -1.342 -10.436 -7.694 1.00 0.16 H new ATOM 0 HB3 HIS A 60 -2.936 -9.937 -8.223 1.00 0.16 H new ATOM 0 HD2 HIS A 60 0.624 -8.296 -7.799 1.00 1.76 H new ATOM 0 HE1 HIS A 60 -1.553 -6.243 -10.793 1.00 2.89 H new ATOM 0 HE2 HIS A 60 0.714 -6.410 -9.618 1.00 2.69 H new ATOM 912 N ILE A 61 -3.068 -6.895 -5.998 1.00 0.14 N ATOM 913 CA ILE A 61 -3.999 -5.787 -5.929 1.00 0.14 C ATOM 914 C ILE A 61 -3.749 -4.779 -7.040 1.00 0.14 C ATOM 915 O ILE A 61 -2.604 -4.410 -7.309 1.00 0.16 O ATOM 916 CB ILE A 61 -3.906 -5.076 -4.568 1.00 0.15 C ATOM 917 CG1 ILE A 61 -4.443 -5.980 -3.457 1.00 0.15 C ATOM 918 CG2 ILE A 61 -4.668 -3.768 -4.616 1.00 0.16 C ATOM 919 CD1 ILE A 61 -4.140 -5.481 -2.061 1.00 0.16 C ATOM 0 H ILE A 61 -2.098 -6.641 -5.813 1.00 0.14 H new ATOM 0 HA ILE A 61 -4.999 -6.202 -6.052 1.00 0.14 H new ATOM 0 HB ILE A 61 -2.860 -4.859 -4.351 1.00 0.15 H new ATOM 0 HG12 ILE A 61 -5.523 -6.077 -3.571 1.00 0.15 H new ATOM 0 HG13 ILE A 61 -4.019 -6.977 -3.576 1.00 0.15 H new ATOM 0 HG21 ILE A 61 -4.598 -3.270 -3.649 1.00 0.16 H new ATOM 0 HG22 ILE A 61 -4.241 -3.126 -5.386 1.00 0.16 H new ATOM 0 HG23 ILE A 61 -5.715 -3.965 -4.847 1.00 0.16 H new ATOM 0 HD11 ILE A 61 -4.553 -6.175 -1.329 1.00 0.16 H new ATOM 0 HD12 ILE A 61 -3.061 -5.411 -1.926 1.00 0.16 H new ATOM 0 HD13 ILE A 61 -4.588 -4.497 -1.921 1.00 0.16 H new ATOM 931 N ALA A 62 -4.820 -4.335 -7.693 1.00 0.13 N ATOM 932 CA ALA A 62 -4.676 -3.293 -8.689 1.00 0.13 C ATOM 933 C ALA A 62 -5.459 -2.046 -8.293 1.00 0.11 C ATOM 934 O ALA A 62 -6.685 -2.095 -8.171 1.00 0.12 O ATOM 935 CB ALA A 62 -5.117 -3.787 -10.051 1.00 0.16 C ATOM 0 H ALA A 62 -5.772 -4.674 -7.552 1.00 0.13 H new ATOM 0 HA ALA A 62 -3.620 -3.027 -8.745 1.00 0.13 H new ATOM 0 HB1 ALA A 62 -5.000 -2.988 -10.783 1.00 0.16 H new ATOM 0 HB2 ALA A 62 -4.505 -4.640 -10.344 1.00 0.16 H new ATOM 0 HB3 ALA A 62 -6.163 -4.089 -10.007 1.00 0.16 H new ATOM 941 N VAL A 63 -4.761 -0.953 -8.061 1.00 0.12 N ATOM 942 CA VAL A 63 -5.412 0.312 -7.757 1.00 0.12 C ATOM 943 C VAL A 63 -5.547 1.169 -9.002 1.00 0.13 C ATOM 944 O VAL A 63 -4.568 1.627 -9.576 1.00 0.19 O ATOM 945 CB VAL A 63 -4.681 1.121 -6.668 1.00 0.13 C ATOM 946 CG1 VAL A 63 -5.400 2.445 -6.422 1.00 0.13 C ATOM 947 CG2 VAL A 63 -4.586 0.311 -5.389 1.00 0.14 C ATOM 0 H VAL A 63 -3.742 -0.912 -8.076 1.00 0.12 H new ATOM 0 HA VAL A 63 -6.399 0.051 -7.375 1.00 0.12 H new ATOM 0 HB VAL A 63 -3.669 1.341 -7.009 1.00 0.13 H new ATOM 0 HG11 VAL A 63 -4.874 3.007 -5.651 1.00 0.13 H new ATOM 0 HG12 VAL A 63 -5.419 3.025 -7.344 1.00 0.13 H new ATOM 0 HG13 VAL A 63 -6.421 2.249 -6.095 1.00 0.13 H new ATOM 0 HG21 VAL A 63 -4.068 0.893 -4.627 1.00 0.14 H new ATOM 0 HG22 VAL A 63 -5.588 0.066 -5.038 1.00 0.14 H new ATOM 0 HG23 VAL A 63 -4.034 -0.609 -5.581 1.00 0.14 H new ATOM 957 N SER A 64 -6.774 1.378 -9.400 1.00 0.12 N ATOM 958 CA SER A 64 -7.101 2.202 -10.540 1.00 0.13 C ATOM 959 C SER A 64 -7.340 3.644 -10.109 1.00 0.14 C ATOM 960 O SER A 64 -8.302 3.925 -9.428 1.00 0.20 O ATOM 961 CB SER A 64 -8.363 1.640 -11.184 1.00 0.16 C ATOM 962 OG SER A 64 -8.162 0.297 -11.590 1.00 0.20 O ATOM 0 H SER A 64 -7.589 0.976 -8.936 1.00 0.12 H new ATOM 0 HA SER A 64 -6.273 2.194 -11.249 1.00 0.13 H new ATOM 0 HB2 SER A 64 -9.192 1.692 -10.478 1.00 0.16 H new ATOM 0 HB3 SER A 64 -8.640 2.248 -12.045 1.00 0.16 H new ATOM 0 HG SER A 64 -8.983 -0.047 -11.999 1.00 0.20 H new ATOM 968 N ILE A 65 -6.414 4.536 -10.444 1.00 0.13 N ATOM 969 CA ILE A 65 -6.646 5.974 -10.350 1.00 0.14 C ATOM 970 C ILE A 65 -7.885 6.377 -11.128 1.00 0.14 C ATOM 971 O ILE A 65 -8.850 6.913 -10.586 1.00 0.14 O ATOM 972 CB ILE A 65 -5.473 6.738 -10.982 1.00 0.16 C ATOM 973 CG1 ILE A 65 -4.157 6.368 -10.301 1.00 0.16 C ATOM 974 CG2 ILE A 65 -5.731 8.230 -10.924 1.00 0.20 C ATOM 975 CD1 ILE A 65 -4.134 6.710 -8.835 1.00 0.23 C ATOM 0 H ILE A 65 -5.486 4.285 -10.786 1.00 0.13 H new ATOM 0 HA ILE A 65 -6.760 6.212 -9.292 1.00 0.14 H new ATOM 0 HB ILE A 65 -5.388 6.451 -12.030 1.00 0.16 H new ATOM 0 HG12 ILE A 65 -3.980 5.299 -10.421 1.00 0.16 H new ATOM 0 HG13 ILE A 65 -3.338 6.885 -10.801 1.00 0.16 H new ATOM 0 HG21 ILE A 65 -4.893 8.762 -11.375 1.00 0.20 H new ATOM 0 HG22 ILE A 65 -6.645 8.463 -11.471 1.00 0.20 H new ATOM 0 HG23 ILE A 65 -5.841 8.540 -9.885 1.00 0.20 H new ATOM 0 HD11 ILE A 65 -3.173 6.422 -8.409 1.00 0.23 H new ATOM 0 HD12 ILE A 65 -4.280 7.783 -8.709 1.00 0.23 H new ATOM 0 HD13 ILE A 65 -4.933 6.173 -8.323 1.00 0.23 H new ATOM 987 N GLY A 66 -7.804 6.079 -12.410 1.00 0.14 N ATOM 988 CA GLY A 66 -8.835 6.452 -13.362 1.00 0.15 C ATOM 989 C GLY A 66 -10.219 5.941 -12.975 1.00 0.14 C ATOM 990 O GLY A 66 -11.232 6.382 -13.514 1.00 0.16 O ATOM 0 H GLY A 66 -7.021 5.571 -12.822 1.00 0.14 H new ATOM 0 HA2 GLY A 66 -8.866 7.538 -13.448 1.00 0.15 H new ATOM 0 HA3 GLY A 66 -8.572 6.062 -14.345 1.00 0.15 H new ATOM 994 N ALA A 67 -10.248 5.020 -12.026 1.00 0.13 N ATOM 995 CA ALA A 67 -11.474 4.397 -11.560 1.00 0.13 C ATOM 996 C ALA A 67 -11.658 4.527 -10.047 1.00 0.13 C ATOM 997 O ALA A 67 -12.772 4.338 -9.565 1.00 0.15 O ATOM 998 CB ALA A 67 -11.472 2.932 -11.951 1.00 0.14 C ATOM 0 H ALA A 67 -9.411 4.681 -11.553 1.00 0.13 H new ATOM 0 HA ALA A 67 -12.308 4.917 -12.032 1.00 0.13 H new ATOM 0 HB1 ALA A 67 -12.391 2.461 -11.603 1.00 0.14 H new ATOM 0 HB2 ALA A 67 -11.408 2.845 -13.036 1.00 0.14 H new ATOM 0 HB3 ALA A 67 -10.615 2.435 -11.496 1.00 0.14 H new ATOM 1004 N LYS A 68 -10.602 4.857 -9.297 1.00 0.12 N ATOM 1005 CA LYS A 68 -10.679 4.893 -7.845 1.00 0.12 C ATOM 1006 C LYS A 68 -11.142 3.559 -7.278 1.00 0.12 C ATOM 1007 O LYS A 68 -12.127 3.492 -6.532 1.00 0.13 O ATOM 1008 CB LYS A 68 -11.594 5.995 -7.374 1.00 0.13 C ATOM 1009 CG LYS A 68 -10.840 7.231 -6.956 1.00 0.11 C ATOM 1010 CD LYS A 68 -10.422 8.082 -8.137 1.00 0.14 C ATOM 1011 CE LYS A 68 -11.616 8.621 -8.901 1.00 0.25 C ATOM 1012 NZ LYS A 68 -11.563 8.249 -10.339 1.00 0.69 N ATOM 0 H LYS A 68 -9.688 5.102 -9.677 1.00 0.12 H new ATOM 0 HA LYS A 68 -9.672 5.093 -7.478 1.00 0.12 H new ATOM 0 HB2 LYS A 68 -12.291 6.251 -8.172 1.00 0.13 H new ATOM 0 HB3 LYS A 68 -12.189 5.635 -6.535 1.00 0.13 H new ATOM 0 HG2 LYS A 68 -11.464 7.824 -6.287 1.00 0.11 H new ATOM 0 HG3 LYS A 68 -9.955 6.939 -6.391 1.00 0.11 H new ATOM 0 HD2 LYS A 68 -9.811 8.914 -7.786 1.00 0.14 H new ATOM 0 HD3 LYS A 68 -9.800 7.490 -8.808 1.00 0.14 H new ATOM 0 HE2 LYS A 68 -12.535 8.235 -8.459 1.00 0.25 H new ATOM 0 HE3 LYS A 68 -11.648 9.706 -8.807 1.00 0.25 H new ATOM 0 HZ1 LYS A 68 -11.680 9.102 -10.923 1.00 0.69 H new ATOM 0 HZ2 LYS A 68 -10.645 7.808 -10.550 1.00 0.69 H new ATOM 0 HZ3 LYS A 68 -12.327 7.576 -10.552 1.00 0.69 H new ATOM 1026 N THR A 69 -10.433 2.493 -7.624 1.00 0.11 N ATOM 1027 CA THR A 69 -10.816 1.173 -7.171 1.00 0.11 C ATOM 1028 C THR A 69 -9.619 0.325 -6.735 1.00 0.11 C ATOM 1029 O THR A 69 -8.471 0.609 -7.086 1.00 0.12 O ATOM 1030 CB THR A 69 -11.596 0.437 -8.272 1.00 0.12 C ATOM 1031 OG1 THR A 69 -10.841 0.410 -9.490 1.00 0.13 O ATOM 1032 CG2 THR A 69 -12.936 1.117 -8.510 1.00 0.13 C ATOM 0 H THR A 69 -9.599 2.520 -8.211 1.00 0.11 H new ATOM 0 HA THR A 69 -11.450 1.315 -6.296 1.00 0.11 H new ATOM 0 HB THR A 69 -11.769 -0.588 -7.944 1.00 0.12 H new ATOM 0 HG1 THR A 69 -11.351 -0.063 -10.180 1.00 0.13 H new ATOM 0 HG21 THR A 69 -13.479 0.587 -9.292 1.00 0.13 H new ATOM 0 HG22 THR A 69 -13.520 1.103 -7.589 1.00 0.13 H new ATOM 0 HG23 THR A 69 -12.770 2.149 -8.819 1.00 0.13 H new ATOM 1040 N LEU A 70 -9.920 -0.714 -5.983 1.00 0.11 N ATOM 1041 CA LEU A 70 -8.915 -1.640 -5.482 1.00 0.11 C ATOM 1042 C LEU A 70 -9.329 -3.071 -5.782 1.00 0.11 C ATOM 1043 O LEU A 70 -10.312 -3.567 -5.242 1.00 0.13 O ATOM 1044 CB LEU A 70 -8.713 -1.431 -3.974 1.00 0.12 C ATOM 1045 CG LEU A 70 -7.532 -2.171 -3.329 1.00 0.14 C ATOM 1046 CD1 LEU A 70 -7.164 -1.516 -2.007 1.00 0.40 C ATOM 1047 CD2 LEU A 70 -7.865 -3.638 -3.101 1.00 0.34 C ATOM 0 H LEU A 70 -10.872 -0.944 -5.699 1.00 0.11 H new ATOM 0 HA LEU A 70 -7.967 -1.447 -5.984 1.00 0.11 H new ATOM 0 HB2 LEU A 70 -8.587 -0.364 -3.792 1.00 0.12 H new ATOM 0 HB3 LEU A 70 -9.626 -1.736 -3.463 1.00 0.12 H new ATOM 0 HG LEU A 70 -6.684 -2.112 -4.011 1.00 0.14 H new ATOM 0 HD11 LEU A 70 -6.326 -2.049 -1.558 1.00 0.40 H new ATOM 0 HD12 LEU A 70 -6.883 -0.477 -2.181 1.00 0.40 H new ATOM 0 HD13 LEU A 70 -8.020 -1.552 -1.333 1.00 0.40 H new ATOM 0 HD21 LEU A 70 -7.011 -4.138 -2.643 1.00 0.34 H new ATOM 0 HD22 LEU A 70 -8.729 -3.717 -2.441 1.00 0.34 H new ATOM 0 HD23 LEU A 70 -8.094 -4.112 -4.056 1.00 0.34 H new ATOM 1059 N THR A 71 -8.586 -3.731 -6.646 1.00 0.12 N ATOM 1060 CA THR A 71 -8.880 -5.109 -6.988 1.00 0.12 C ATOM 1061 C THR A 71 -8.095 -6.074 -6.111 1.00 0.13 C ATOM 1062 O THR A 71 -6.872 -6.028 -6.057 1.00 0.14 O ATOM 1063 CB THR A 71 -8.528 -5.406 -8.443 1.00 0.12 C ATOM 1064 OG1 THR A 71 -9.126 -4.425 -9.302 1.00 0.16 O ATOM 1065 CG2 THR A 71 -9.011 -6.794 -8.825 1.00 0.15 C ATOM 0 H THR A 71 -7.775 -3.337 -7.124 1.00 0.12 H new ATOM 0 HA THR A 71 -9.950 -5.246 -6.829 1.00 0.12 H new ATOM 0 HB THR A 71 -7.445 -5.366 -8.559 1.00 0.12 H new ATOM 0 HG1 THR A 71 -8.894 -4.621 -10.234 1.00 0.16 H new ATOM 0 HG21 THR A 71 -8.754 -6.995 -9.865 1.00 0.15 H new ATOM 0 HG22 THR A 71 -8.533 -7.535 -8.184 1.00 0.15 H new ATOM 0 HG23 THR A 71 -10.092 -6.850 -8.701 1.00 0.15 H new ATOM 1073 N LEU A 72 -8.820 -6.933 -5.433 1.00 0.14 N ATOM 1074 CA LEU A 72 -8.224 -8.010 -4.668 1.00 0.15 C ATOM 1075 C LEU A 72 -8.311 -9.305 -5.452 1.00 0.15 C ATOM 1076 O LEU A 72 -9.393 -9.868 -5.606 1.00 0.16 O ATOM 1077 CB LEU A 72 -8.925 -8.158 -3.325 1.00 0.20 C ATOM 1078 CG LEU A 72 -8.726 -9.503 -2.634 1.00 0.29 C ATOM 1079 CD1 LEU A 72 -7.284 -9.678 -2.183 1.00 0.59 C ATOM 1080 CD2 LEU A 72 -9.697 -9.633 -1.478 1.00 0.54 C ATOM 0 H LEU A 72 -9.839 -6.907 -5.394 1.00 0.14 H new ATOM 0 HA LEU A 72 -7.176 -7.775 -4.485 1.00 0.15 H new ATOM 0 HB2 LEU A 72 -8.572 -7.370 -2.660 1.00 0.20 H new ATOM 0 HB3 LEU A 72 -9.993 -7.997 -3.471 1.00 0.20 H new ATOM 0 HG LEU A 72 -8.933 -10.302 -3.346 1.00 0.29 H new ATOM 0 HD11 LEU A 72 -7.171 -10.645 -1.694 1.00 0.59 H new ATOM 0 HD12 LEU A 72 -6.624 -9.630 -3.049 1.00 0.59 H new ATOM 0 HD13 LEU A 72 -7.023 -8.884 -1.483 1.00 0.59 H new ATOM 0 HD21 LEU A 72 -9.552 -10.595 -0.987 1.00 0.54 H new ATOM 0 HD22 LEU A 72 -9.520 -8.830 -0.762 1.00 0.54 H new ATOM 0 HD23 LEU A 72 -10.719 -9.567 -1.852 1.00 0.54 H new ATOM 1092 N SER A 73 -7.195 -9.759 -5.993 1.00 0.14 N ATOM 1093 CA SER A 73 -7.222 -11.010 -6.724 1.00 0.14 C ATOM 1094 C SER A 73 -6.524 -12.119 -5.928 1.00 0.14 C ATOM 1095 O SER A 73 -5.749 -11.828 -5.018 1.00 0.14 O ATOM 1096 CB SER A 73 -6.563 -10.843 -8.096 1.00 0.17 C ATOM 1097 OG SER A 73 -5.198 -10.485 -7.981 1.00 1.05 O ATOM 0 H SER A 73 -6.287 -9.297 -5.943 1.00 0.14 H new ATOM 0 HA SER A 73 -8.263 -11.297 -6.871 1.00 0.14 H new ATOM 0 HB2 SER A 73 -6.649 -11.774 -8.657 1.00 0.17 H new ATOM 0 HB3 SER A 73 -7.093 -10.078 -8.664 1.00 0.17 H new ATOM 0 HG SER A 73 -5.127 -9.535 -7.750 1.00 1.05 H new ATOM 1103 N LEU A 74 -6.785 -13.367 -6.263 1.00 0.15 N ATOM 1104 CA LEU A 74 -6.029 -14.475 -5.741 1.00 0.15 C ATOM 1105 C LEU A 74 -5.557 -15.342 -6.908 1.00 0.17 C ATOM 1106 O LEU A 74 -6.336 -15.700 -7.786 1.00 0.20 O ATOM 1107 CB LEU A 74 -6.888 -15.210 -4.712 1.00 0.16 C ATOM 1108 CG LEU A 74 -6.357 -16.520 -4.151 1.00 0.19 C ATOM 1109 CD1 LEU A 74 -6.793 -17.667 -5.023 1.00 0.26 C ATOM 1110 CD2 LEU A 74 -4.844 -16.499 -3.971 1.00 0.17 C ATOM 0 H LEU A 74 -7.530 -13.636 -6.906 1.00 0.15 H new ATOM 0 HA LEU A 74 -5.129 -14.153 -5.217 1.00 0.15 H new ATOM 0 HB2 LEU A 74 -7.061 -14.533 -3.875 1.00 0.16 H new ATOM 0 HB3 LEU A 74 -7.858 -15.409 -5.167 1.00 0.16 H new ATOM 0 HG LEU A 74 -6.781 -16.656 -3.156 1.00 0.19 H new ATOM 0 HD11 LEU A 74 -6.409 -18.601 -4.614 1.00 0.26 H new ATOM 0 HD12 LEU A 74 -7.882 -17.706 -5.055 1.00 0.26 H new ATOM 0 HD13 LEU A 74 -6.405 -17.525 -6.032 1.00 0.26 H new ATOM 0 HD21 LEU A 74 -4.512 -17.456 -3.568 1.00 0.17 H new ATOM 0 HD22 LEU A 74 -4.365 -16.325 -4.935 1.00 0.17 H new ATOM 0 HD23 LEU A 74 -4.571 -15.701 -3.281 1.00 0.17 H new ATOM 1122 N ASN A 75 -4.254 -15.623 -6.892 1.00 0.18 N ATOM 1123 CA ASN A 75 -3.503 -16.188 -8.018 1.00 0.21 C ATOM 1124 C ASN A 75 -3.821 -15.449 -9.322 1.00 0.23 C ATOM 1125 O ASN A 75 -4.066 -16.054 -10.365 1.00 0.28 O ATOM 1126 CB ASN A 75 -3.655 -17.716 -8.156 1.00 0.30 C ATOM 1127 CG ASN A 75 -5.017 -18.205 -8.591 1.00 1.09 C ATOM 1128 OD1 ASN A 75 -5.834 -18.513 -7.618 1.00 1.84 O flip ATOM 1129 ND2 ASN A 75 -5.316 -18.332 -9.779 1.00 1.25 N flip ATOM 0 H ASN A 75 -3.672 -15.459 -6.070 1.00 0.18 H new ATOM 0 HA ASN A 75 -2.448 -16.029 -7.795 1.00 0.21 H new ATOM 0 HB2 ASN A 75 -2.916 -18.072 -8.873 1.00 0.30 H new ATOM 0 HB3 ASN A 75 -3.415 -18.174 -7.197 1.00 0.30 H new ATOM 0 HD21 ASN A 75 -4.645 -18.078 -10.504 1.00 1.25 H new ATOM 0 HD22 ASN A 75 -6.235 -18.691 -10.038 1.00 1.25 H new ATOM 1136 N ASN A 76 -3.812 -14.111 -9.228 1.00 0.25 N ATOM 1137 CA ASN A 76 -4.053 -13.212 -10.368 1.00 0.31 C ATOM 1138 C ASN A 76 -5.524 -13.194 -10.774 1.00 0.29 C ATOM 1139 O ASN A 76 -5.949 -12.382 -11.595 1.00 0.36 O ATOM 1140 CB ASN A 76 -3.177 -13.590 -11.569 1.00 0.38 C ATOM 1141 CG ASN A 76 -1.701 -13.456 -11.277 1.00 1.10 C ATOM 1142 OD1 ASN A 76 -1.281 -12.633 -10.459 1.00 1.39 O ATOM 1143 ND2 ASN A 76 -0.902 -14.270 -11.941 1.00 1.89 N ATOM 0 H ASN A 76 -3.636 -13.618 -8.352 1.00 0.25 H new ATOM 0 HA ASN A 76 -3.781 -12.208 -10.042 1.00 0.31 H new ATOM 0 HB2 ASN A 76 -3.394 -14.617 -11.863 1.00 0.38 H new ATOM 0 HB3 ASN A 76 -3.435 -12.955 -12.416 1.00 0.38 H new ATOM 0 HD21 ASN A 76 0.106 -14.234 -11.787 1.00 1.89 H new ATOM 0 HD22 ASN A 76 -1.292 -14.935 -12.608 1.00 1.89 H new ATOM 1150 N ARG A 77 -6.294 -14.089 -10.182 1.00 0.23 N ATOM 1151 CA ARG A 77 -7.712 -14.196 -10.451 1.00 0.23 C ATOM 1152 C ARG A 77 -8.489 -13.406 -9.422 1.00 0.20 C ATOM 1153 O ARG A 77 -8.424 -13.684 -8.228 1.00 0.19 O ATOM 1154 CB ARG A 77 -8.153 -15.650 -10.439 1.00 0.27 C ATOM 1155 CG ARG A 77 -9.639 -15.810 -10.647 1.00 0.36 C ATOM 1156 CD ARG A 77 -10.008 -15.597 -12.098 1.00 0.99 C ATOM 1157 NE ARG A 77 -11.453 -15.478 -12.282 1.00 1.77 N ATOM 1158 CZ ARG A 77 -12.052 -15.383 -13.467 1.00 2.56 C ATOM 1159 NH1 ARG A 77 -11.329 -15.382 -14.580 1.00 2.80 N ATOM 1160 NH2 ARG A 77 -13.376 -15.289 -13.538 1.00 3.44 N ATOM 0 H ARG A 77 -5.950 -14.764 -9.499 1.00 0.23 H new ATOM 0 HA ARG A 77 -7.911 -13.787 -11.442 1.00 0.23 H new ATOM 0 HB2 ARG A 77 -7.621 -16.193 -11.220 1.00 0.27 H new ATOM 0 HB3 ARG A 77 -7.873 -16.103 -9.488 1.00 0.27 H new ATOM 0 HG2 ARG A 77 -9.949 -16.806 -10.331 1.00 0.36 H new ATOM 0 HG3 ARG A 77 -10.176 -15.096 -10.023 1.00 0.36 H new ATOM 0 HD2 ARG A 77 -9.520 -14.695 -12.468 1.00 0.99 H new ATOM 0 HD3 ARG A 77 -9.634 -16.430 -12.694 1.00 0.99 H new ATOM 0 HE ARG A 77 -12.041 -15.467 -11.448 1.00 1.77 H new ATOM 0 HH11 ARG A 77 -10.313 -15.454 -14.528 1.00 2.80 H new ATOM 0 HH12 ARG A 77 -11.789 -15.309 -15.487 1.00 2.80 H new ATOM 0 HH21 ARG A 77 -13.934 -15.290 -12.684 1.00 3.44 H new ATOM 0 HH22 ARG A 77 -13.834 -15.216 -14.446 1.00 3.44 H new ATOM 1174 N VAL A 78 -9.235 -12.432 -9.902 1.00 0.20 N ATOM 1175 CA VAL A 78 -9.953 -11.504 -9.052 1.00 0.18 C ATOM 1176 C VAL A 78 -10.917 -12.201 -8.131 1.00 0.20 C ATOM 1177 O VAL A 78 -11.669 -13.097 -8.518 1.00 0.24 O ATOM 1178 CB VAL A 78 -10.696 -10.462 -9.904 1.00 0.20 C ATOM 1179 CG1 VAL A 78 -11.621 -9.601 -9.054 1.00 0.20 C ATOM 1180 CG2 VAL A 78 -9.674 -9.595 -10.614 1.00 0.20 C ATOM 0 H VAL A 78 -9.361 -12.261 -10.900 1.00 0.20 H new ATOM 0 HA VAL A 78 -9.213 -11.002 -8.429 1.00 0.18 H new ATOM 0 HB VAL A 78 -11.318 -10.982 -10.633 1.00 0.20 H new ATOM 0 HG11 VAL A 78 -12.129 -8.876 -9.690 1.00 0.20 H new ATOM 0 HG12 VAL A 78 -12.360 -10.235 -8.564 1.00 0.20 H new ATOM 0 HG13 VAL A 78 -11.037 -9.075 -8.299 1.00 0.20 H new ATOM 0 HG21 VAL A 78 -10.188 -8.851 -11.222 1.00 0.20 H new ATOM 0 HG22 VAL A 78 -9.049 -9.092 -9.877 1.00 0.20 H new ATOM 0 HG23 VAL A 78 -9.050 -10.219 -11.254 1.00 0.20 H new ATOM 1190 N MET A 79 -10.845 -11.777 -6.892 1.00 0.19 N ATOM 1191 CA MET A 79 -11.677 -12.262 -5.844 1.00 0.23 C ATOM 1192 C MET A 79 -12.762 -11.252 -5.562 1.00 0.22 C ATOM 1193 O MET A 79 -13.935 -11.581 -5.388 1.00 0.26 O ATOM 1194 CB MET A 79 -10.821 -12.438 -4.614 1.00 0.27 C ATOM 1195 CG MET A 79 -9.996 -13.702 -4.630 1.00 0.37 C ATOM 1196 SD MET A 79 -9.743 -14.401 -2.985 1.00 0.61 S ATOM 1197 CE MET A 79 -8.976 -13.024 -2.142 1.00 0.81 C ATOM 0 H MET A 79 -10.183 -11.064 -6.588 1.00 0.19 H new ATOM 0 HA MET A 79 -12.136 -13.210 -6.126 1.00 0.23 H new ATOM 0 HB2 MET A 79 -10.155 -11.580 -4.519 1.00 0.27 H new ATOM 0 HB3 MET A 79 -11.462 -12.443 -3.733 1.00 0.27 H new ATOM 0 HG2 MET A 79 -10.488 -14.442 -5.261 1.00 0.37 H new ATOM 0 HG3 MET A 79 -9.027 -13.491 -5.082 1.00 0.37 H new ATOM 0 HE1 MET A 79 -8.491 -13.379 -1.233 1.00 0.81 H new ATOM 0 HE2 MET A 79 -8.233 -12.566 -2.795 1.00 0.81 H new ATOM 0 HE3 MET A 79 -9.736 -12.286 -1.884 1.00 0.81 H new ATOM 1207 N LYS A 80 -12.321 -10.005 -5.530 1.00 0.17 N ATOM 1208 CA LYS A 80 -13.160 -8.870 -5.242 1.00 0.16 C ATOM 1209 C LYS A 80 -12.519 -7.605 -5.739 1.00 0.15 C ATOM 1210 O LYS A 80 -11.379 -7.592 -6.202 1.00 0.16 O ATOM 1211 CB LYS A 80 -13.389 -8.712 -3.754 1.00 0.20 C ATOM 1212 CG LYS A 80 -14.716 -9.272 -3.285 1.00 0.42 C ATOM 1213 CD LYS A 80 -15.836 -8.915 -4.241 1.00 0.62 C ATOM 1214 CE LYS A 80 -17.165 -9.101 -3.568 1.00 0.79 C ATOM 1215 NZ LYS A 80 -18.301 -8.668 -4.423 1.00 1.46 N ATOM 0 H LYS A 80 -11.348 -9.756 -5.708 1.00 0.17 H new ATOM 0 HA LYS A 80 -14.112 -9.046 -5.744 1.00 0.16 H new ATOM 0 HB2 LYS A 80 -12.583 -9.210 -3.215 1.00 0.20 H new ATOM 0 HB3 LYS A 80 -13.339 -7.654 -3.497 1.00 0.20 H new ATOM 0 HG2 LYS A 80 -14.644 -10.356 -3.195 1.00 0.42 H new ATOM 0 HG3 LYS A 80 -14.946 -8.885 -2.292 1.00 0.42 H new ATOM 0 HD2 LYS A 80 -15.728 -7.882 -4.571 1.00 0.62 H new ATOM 0 HD3 LYS A 80 -15.779 -9.542 -5.131 1.00 0.62 H new ATOM 0 HE2 LYS A 80 -17.292 -10.151 -3.305 1.00 0.79 H new ATOM 0 HE3 LYS A 80 -17.179 -8.535 -2.636 1.00 0.79 H new ATOM 0 HZ1 LYS A 80 -19.195 -8.817 -3.913 1.00 1.46 H new ATOM 0 HZ2 LYS A 80 -18.197 -7.659 -4.653 1.00 1.46 H new ATOM 0 HZ3 LYS A 80 -18.306 -9.225 -5.301 1.00 1.46 H new ATOM 1229 N THR A 81 -13.278 -6.555 -5.643 1.00 0.14 N ATOM 1230 CA THR A 81 -12.800 -5.227 -5.939 1.00 0.14 C ATOM 1231 C THR A 81 -13.548 -4.215 -5.089 1.00 0.15 C ATOM 1232 O THR A 81 -14.776 -4.176 -5.090 1.00 0.15 O ATOM 1233 CB THR A 81 -12.944 -4.903 -7.430 1.00 0.14 C ATOM 1234 OG1 THR A 81 -12.099 -5.770 -8.200 1.00 0.17 O ATOM 1235 CG2 THR A 81 -12.599 -3.450 -7.728 1.00 0.14 C ATOM 0 H THR A 81 -14.256 -6.590 -5.355 1.00 0.14 H new ATOM 0 HA THR A 81 -11.738 -5.177 -5.699 1.00 0.14 H new ATOM 0 HB THR A 81 -13.987 -5.062 -7.706 1.00 0.14 H new ATOM 0 HG1 THR A 81 -11.715 -6.457 -7.615 1.00 0.17 H new ATOM 0 HG21 THR A 81 -12.713 -3.260 -8.795 1.00 0.14 H new ATOM 0 HG22 THR A 81 -13.268 -2.795 -7.169 1.00 0.14 H new ATOM 0 HG23 THR A 81 -11.568 -3.253 -7.433 1.00 0.14 H new ATOM 1243 N TYR A 82 -12.803 -3.426 -4.352 1.00 0.16 N ATOM 1244 CA TYR A 82 -13.378 -2.485 -3.420 1.00 0.19 C ATOM 1245 C TYR A 82 -13.035 -1.068 -3.839 1.00 0.16 C ATOM 1246 O TYR A 82 -11.976 -0.827 -4.402 1.00 0.21 O ATOM 1247 CB TYR A 82 -12.848 -2.788 -2.015 1.00 0.28 C ATOM 1248 CG TYR A 82 -13.175 -4.190 -1.555 1.00 0.45 C ATOM 1249 CD1 TYR A 82 -14.441 -4.709 -1.745 1.00 0.83 C ATOM 1250 CD2 TYR A 82 -12.224 -4.989 -0.932 1.00 0.69 C ATOM 1251 CE1 TYR A 82 -14.764 -5.985 -1.332 1.00 1.01 C ATOM 1252 CE2 TYR A 82 -12.536 -6.270 -0.514 1.00 0.81 C ATOM 1253 CZ TYR A 82 -13.808 -6.761 -0.717 1.00 0.84 C ATOM 1254 OH TYR A 82 -14.127 -8.038 -0.307 1.00 1.05 O ATOM 0 H TYR A 82 -11.783 -3.418 -4.381 1.00 0.16 H new ATOM 0 HA TYR A 82 -14.464 -2.580 -3.415 1.00 0.19 H new ATOM 0 HB2 TYR A 82 -11.767 -2.649 -2.002 1.00 0.28 H new ATOM 0 HB3 TYR A 82 -13.270 -2.072 -1.310 1.00 0.28 H new ATOM 0 HD1 TYR A 82 -15.194 -4.103 -2.227 1.00 0.83 H new ATOM 0 HD2 TYR A 82 -11.228 -4.604 -0.772 1.00 0.69 H new ATOM 0 HE1 TYR A 82 -15.760 -6.372 -1.490 1.00 1.01 H new ATOM 0 HE2 TYR A 82 -11.788 -6.882 -0.032 1.00 0.81 H new ATOM 0 HH TYR A 82 -13.673 -8.233 0.539 1.00 1.05 H new ATOM 1264 N PRO A 83 -13.938 -0.117 -3.599 1.00 0.15 N ATOM 1265 CA PRO A 83 -13.704 1.280 -3.931 1.00 0.14 C ATOM 1266 C PRO A 83 -12.703 1.896 -3.008 1.00 0.12 C ATOM 1267 O PRO A 83 -12.673 1.583 -1.816 1.00 0.13 O ATOM 1268 CB PRO A 83 -15.065 1.944 -3.730 1.00 0.16 C ATOM 1269 CG PRO A 83 -15.800 1.060 -2.781 1.00 0.18 C ATOM 1270 CD PRO A 83 -15.238 -0.327 -2.950 1.00 0.20 C ATOM 0 HA PRO A 83 -13.310 1.397 -4.940 1.00 0.14 H new ATOM 0 HB2 PRO A 83 -14.955 2.950 -3.325 1.00 0.16 H new ATOM 0 HB3 PRO A 83 -15.600 2.037 -4.675 1.00 0.16 H new ATOM 0 HG2 PRO A 83 -15.674 1.405 -1.755 1.00 0.18 H new ATOM 0 HG3 PRO A 83 -16.869 1.072 -2.992 1.00 0.18 H new ATOM 0 HD2 PRO A 83 -15.126 -0.830 -1.990 1.00 0.20 H new ATOM 0 HD3 PRO A 83 -15.892 -0.949 -3.562 1.00 0.20 H new ATOM 1278 N ILE A 84 -11.881 2.755 -3.555 1.00 0.12 N ATOM 1279 CA ILE A 84 -10.861 3.404 -2.780 1.00 0.11 C ATOM 1280 C ILE A 84 -10.714 4.850 -3.198 1.00 0.12 C ATOM 1281 O ILE A 84 -11.322 5.285 -4.170 1.00 0.13 O ATOM 1282 CB ILE A 84 -9.524 2.632 -2.880 1.00 0.11 C ATOM 1283 CG1 ILE A 84 -9.047 2.427 -4.326 1.00 0.11 C ATOM 1284 CG2 ILE A 84 -9.724 1.277 -2.238 1.00 0.12 C ATOM 1285 CD1 ILE A 84 -8.695 3.686 -5.079 1.00 0.12 C ATOM 0 H ILE A 84 -11.901 3.021 -4.540 1.00 0.12 H new ATOM 0 HA ILE A 84 -11.160 3.398 -1.732 1.00 0.11 H new ATOM 0 HB ILE A 84 -8.759 3.223 -2.376 1.00 0.11 H new ATOM 0 HG12 ILE A 84 -8.173 1.776 -4.313 1.00 0.11 H new ATOM 0 HG13 ILE A 84 -9.827 1.902 -4.876 1.00 0.11 H new ATOM 0 HG21 ILE A 84 -8.796 0.708 -2.293 1.00 0.12 H new ATOM 0 HG22 ILE A 84 -10.008 1.407 -1.194 1.00 0.12 H new ATOM 0 HG23 ILE A 84 -10.512 0.738 -2.764 1.00 0.12 H new ATOM 0 HD11 ILE A 84 -8.371 3.428 -6.087 1.00 0.12 H new ATOM 0 HD12 ILE A 84 -9.570 4.334 -5.133 1.00 0.12 H new ATOM 0 HD13 ILE A 84 -7.889 4.207 -4.561 1.00 0.12 H new ATOM 1297 N ALA A 85 -9.905 5.586 -2.481 1.00 0.14 N ATOM 1298 CA ALA A 85 -9.734 6.996 -2.755 1.00 0.16 C ATOM 1299 C ALA A 85 -8.293 7.281 -3.121 1.00 0.18 C ATOM 1300 O ALA A 85 -7.388 6.622 -2.640 1.00 0.26 O ATOM 1301 CB ALA A 85 -10.171 7.825 -1.560 1.00 0.18 C ATOM 0 H ALA A 85 -9.351 5.235 -1.700 1.00 0.14 H new ATOM 0 HA ALA A 85 -10.363 7.273 -3.601 1.00 0.16 H new ATOM 0 HB1 ALA A 85 -10.036 8.883 -1.783 1.00 0.18 H new ATOM 0 HB2 ALA A 85 -11.222 7.630 -1.347 1.00 0.18 H new ATOM 0 HB3 ALA A 85 -9.569 7.557 -0.692 1.00 0.18 H new ATOM 1307 N VAL A 86 -8.096 8.247 -3.984 1.00 0.15 N ATOM 1308 CA VAL A 86 -6.758 8.607 -4.419 1.00 0.15 C ATOM 1309 C VAL A 86 -6.497 10.081 -4.272 1.00 0.13 C ATOM 1310 O VAL A 86 -7.268 10.925 -4.734 1.00 0.16 O ATOM 1311 CB VAL A 86 -6.476 8.200 -5.877 1.00 0.22 C ATOM 1312 CG1 VAL A 86 -6.295 6.703 -5.986 1.00 0.56 C ATOM 1313 CG2 VAL A 86 -7.578 8.668 -6.804 1.00 0.54 C ATOM 0 H VAL A 86 -8.842 8.802 -4.403 1.00 0.15 H new ATOM 0 HA VAL A 86 -6.086 8.051 -3.765 1.00 0.15 H new ATOM 0 HB VAL A 86 -5.551 8.687 -6.184 1.00 0.22 H new ATOM 0 HG11 VAL A 86 -6.097 6.435 -7.024 1.00 0.56 H new ATOM 0 HG12 VAL A 86 -5.456 6.392 -5.364 1.00 0.56 H new ATOM 0 HG13 VAL A 86 -7.202 6.201 -5.649 1.00 0.56 H new ATOM 0 HG21 VAL A 86 -7.348 8.364 -7.825 1.00 0.54 H new ATOM 0 HG22 VAL A 86 -8.525 8.223 -6.498 1.00 0.54 H new ATOM 0 HG23 VAL A 86 -7.656 9.754 -6.757 1.00 0.54 H new ATOM 1323 N GLY A 87 -5.407 10.378 -3.608 1.00 0.15 N ATOM 1324 CA GLY A 87 -4.949 11.726 -3.544 1.00 0.17 C ATOM 1325 C GLY A 87 -4.136 12.046 -4.759 1.00 0.16 C ATOM 1326 O GLY A 87 -3.564 11.150 -5.389 1.00 0.16 O ATOM 0 H GLY A 87 -4.829 9.701 -3.109 1.00 0.15 H new ATOM 0 HA2 GLY A 87 -5.799 12.405 -3.475 1.00 0.17 H new ATOM 0 HA3 GLY A 87 -4.350 11.873 -2.646 1.00 0.17 H new ATOM 1330 N LYS A 88 -4.106 13.312 -5.108 1.00 0.18 N ATOM 1331 CA LYS A 88 -3.314 13.805 -6.229 1.00 0.20 C ATOM 1332 C LYS A 88 -1.830 13.465 -6.111 1.00 0.19 C ATOM 1333 O LYS A 88 -1.031 13.894 -6.937 1.00 0.22 O ATOM 1334 CB LYS A 88 -3.458 15.312 -6.323 1.00 0.27 C ATOM 1335 CG LYS A 88 -4.860 15.776 -6.689 1.00 0.71 C ATOM 1336 CD LYS A 88 -5.267 15.282 -8.070 1.00 1.73 C ATOM 1337 CE LYS A 88 -6.640 15.802 -8.469 1.00 2.42 C ATOM 1338 NZ LYS A 88 -7.032 15.340 -9.827 1.00 3.05 N ATOM 0 H LYS A 88 -4.632 14.039 -4.623 1.00 0.18 H new ATOM 0 HA LYS A 88 -3.695 13.311 -7.123 1.00 0.20 H new ATOM 0 HB2 LYS A 88 -3.178 15.754 -5.367 1.00 0.27 H new ATOM 0 HB3 LYS A 88 -2.756 15.689 -7.067 1.00 0.27 H new ATOM 0 HG2 LYS A 88 -5.570 15.412 -5.947 1.00 0.71 H new ATOM 0 HG3 LYS A 88 -4.903 16.865 -6.664 1.00 0.71 H new ATOM 0 HD2 LYS A 88 -4.528 15.603 -8.804 1.00 1.73 H new ATOM 0 HD3 LYS A 88 -5.273 14.192 -8.080 1.00 1.73 H new ATOM 0 HE2 LYS A 88 -7.381 15.467 -7.743 1.00 2.42 H new ATOM 0 HE3 LYS A 88 -6.638 16.892 -8.442 1.00 2.42 H new ATOM 0 HZ1 LYS A 88 -7.973 15.715 -10.063 1.00 3.05 H new ATOM 0 HZ2 LYS A 88 -6.339 15.681 -10.523 1.00 3.05 H new ATOM 0 HZ3 LYS A 88 -7.059 14.301 -9.846 1.00 3.05 H new ATOM 1352 N ILE A 89 -1.443 12.736 -5.080 1.00 0.17 N ATOM 1353 CA ILE A 89 -0.059 12.385 -4.896 1.00 0.17 C ATOM 1354 C ILE A 89 0.271 11.083 -5.646 1.00 0.16 C ATOM 1355 O ILE A 89 1.416 10.826 -6.013 1.00 0.19 O ATOM 1356 CB ILE A 89 0.245 12.245 -3.387 1.00 0.17 C ATOM 1357 CG1 ILE A 89 1.607 11.611 -3.146 1.00 0.18 C ATOM 1358 CG2 ILE A 89 -0.846 11.440 -2.700 1.00 0.18 C ATOM 1359 CD1 ILE A 89 2.749 12.596 -3.092 1.00 0.23 C ATOM 0 H ILE A 89 -2.072 12.379 -4.361 1.00 0.17 H new ATOM 0 HA ILE A 89 0.568 13.176 -5.308 1.00 0.17 H new ATOM 0 HB ILE A 89 0.268 13.247 -2.959 1.00 0.17 H new ATOM 0 HG12 ILE A 89 1.576 11.057 -2.208 1.00 0.18 H new ATOM 0 HG13 ILE A 89 1.803 10.888 -3.937 1.00 0.18 H new ATOM 0 HG21 ILE A 89 -0.618 11.350 -1.638 1.00 0.18 H new ATOM 0 HG22 ILE A 89 -1.804 11.945 -2.824 1.00 0.18 H new ATOM 0 HG23 ILE A 89 -0.900 10.446 -3.145 1.00 0.18 H new ATOM 0 HD11 ILE A 89 3.683 12.061 -2.917 1.00 0.23 H new ATOM 0 HD12 ILE A 89 2.811 13.134 -4.038 1.00 0.23 H new ATOM 0 HD13 ILE A 89 2.580 13.305 -2.282 1.00 0.23 H new ATOM 1371 N LEU A 90 -0.771 10.288 -5.913 1.00 0.15 N ATOM 1372 CA LEU A 90 -0.608 8.965 -6.540 1.00 0.15 C ATOM 1373 C LEU A 90 -0.615 9.120 -8.043 1.00 0.17 C ATOM 1374 O LEU A 90 -0.225 8.222 -8.786 1.00 0.18 O ATOM 1375 CB LEU A 90 -1.739 7.995 -6.163 1.00 0.14 C ATOM 1376 CG LEU A 90 -1.732 7.429 -4.748 1.00 0.13 C ATOM 1377 CD1 LEU A 90 -0.458 6.653 -4.500 1.00 0.15 C ATOM 1378 CD2 LEU A 90 -1.888 8.531 -3.730 1.00 0.12 C ATOM 0 H LEU A 90 -1.739 10.535 -5.706 1.00 0.15 H new ATOM 0 HA LEU A 90 0.336 8.555 -6.181 1.00 0.15 H new ATOM 0 HB2 LEU A 90 -2.688 8.508 -6.316 1.00 0.14 H new ATOM 0 HB3 LEU A 90 -1.712 7.158 -6.861 1.00 0.14 H new ATOM 0 HG LEU A 90 -2.579 6.750 -4.645 1.00 0.13 H new ATOM 0 HD11 LEU A 90 -0.466 6.254 -3.486 1.00 0.15 H new ATOM 0 HD12 LEU A 90 -0.388 5.831 -5.212 1.00 0.15 H new ATOM 0 HD13 LEU A 90 0.400 7.314 -4.623 1.00 0.15 H new ATOM 0 HD21 LEU A 90 -1.880 8.104 -2.727 1.00 0.12 H new ATOM 0 HD22 LEU A 90 -1.064 9.238 -3.830 1.00 0.12 H new ATOM 0 HD23 LEU A 90 -2.833 9.049 -3.896 1.00 0.12 H new ATOM 1390 N THR A 91 -1.058 10.274 -8.472 1.00 0.18 N ATOM 1391 CA THR A 91 -1.161 10.598 -9.872 1.00 0.22 C ATOM 1392 C THR A 91 0.220 10.751 -10.509 1.00 0.26 C ATOM 1393 O THR A 91 0.375 10.696 -11.731 1.00 0.33 O ATOM 1394 CB THR A 91 -1.954 11.897 -10.006 1.00 0.24 C ATOM 1395 OG1 THR A 91 -1.253 12.977 -9.390 1.00 0.26 O ATOM 1396 CG2 THR A 91 -3.328 11.730 -9.356 1.00 0.23 C ATOM 0 H THR A 91 -1.361 11.024 -7.851 1.00 0.18 H new ATOM 0 HA THR A 91 -1.670 9.788 -10.394 1.00 0.22 H new ATOM 0 HB THR A 91 -2.079 12.124 -11.065 1.00 0.24 H new ATOM 0 HG1 THR A 91 -1.438 12.980 -8.428 1.00 0.26 H new ATOM 0 HG21 THR A 91 -3.892 12.658 -9.453 1.00 0.23 H new ATOM 0 HG22 THR A 91 -3.869 10.923 -9.851 1.00 0.23 H new ATOM 0 HG23 THR A 91 -3.204 11.489 -8.300 1.00 0.23 H new ATOM 1404 N GLN A 92 1.219 10.927 -9.651 1.00 0.24 N ATOM 1405 CA GLN A 92 2.593 11.178 -10.064 1.00 0.27 C ATOM 1406 C GLN A 92 3.222 9.968 -10.752 1.00 0.29 C ATOM 1407 O GLN A 92 3.967 10.126 -11.721 1.00 0.36 O ATOM 1408 CB GLN A 92 3.424 11.573 -8.844 1.00 0.32 C ATOM 1409 CG GLN A 92 2.855 12.770 -8.096 1.00 0.37 C ATOM 1410 CD GLN A 92 3.751 13.252 -6.973 1.00 0.78 C ATOM 1411 OE1 GLN A 92 4.506 12.481 -6.381 1.00 1.45 O ATOM 1412 NE2 GLN A 92 3.661 14.535 -6.662 1.00 1.52 N ATOM 0 H GLN A 92 1.095 10.899 -8.639 1.00 0.24 H new ATOM 0 HA GLN A 92 2.579 11.990 -10.791 1.00 0.27 H new ATOM 0 HB2 GLN A 92 3.487 10.723 -8.164 1.00 0.32 H new ATOM 0 HB3 GLN A 92 4.441 11.801 -9.163 1.00 0.32 H new ATOM 0 HG2 GLN A 92 2.693 13.587 -8.799 1.00 0.37 H new ATOM 0 HG3 GLN A 92 1.880 12.505 -7.686 1.00 0.37 H new ATOM 0 HE21 GLN A 92 3.023 15.141 -7.177 1.00 1.52 H new ATOM 0 HE22 GLN A 92 4.230 14.918 -5.907 1.00 1.52 H new ATOM 1421 N THR A 93 2.934 8.769 -10.269 1.00 0.27 N ATOM 1422 CA THR A 93 3.543 7.576 -10.844 1.00 0.30 C ATOM 1423 C THR A 93 2.532 6.783 -11.666 1.00 0.34 C ATOM 1424 O THR A 93 1.613 6.176 -11.121 1.00 0.43 O ATOM 1425 CB THR A 93 4.148 6.663 -9.762 1.00 0.29 C ATOM 1426 OG1 THR A 93 4.344 7.404 -8.548 1.00 0.40 O ATOM 1427 CG2 THR A 93 5.482 6.102 -10.231 1.00 0.34 C ATOM 0 H THR A 93 2.294 8.595 -9.494 1.00 0.27 H new ATOM 0 HA THR A 93 4.346 7.920 -11.496 1.00 0.30 H new ATOM 0 HB THR A 93 3.458 5.840 -9.578 1.00 0.29 H new ATOM 0 HG1 THR A 93 5.294 7.394 -8.309 1.00 0.40 H new ATOM 0 HG21 THR A 93 5.899 5.458 -9.456 1.00 0.34 H new ATOM 0 HG22 THR A 93 5.333 5.523 -11.142 1.00 0.34 H new ATOM 0 HG23 THR A 93 6.172 6.922 -10.431 1.00 0.34 H new ATOM 1435 N PRO A 94 2.693 6.786 -12.995 1.00 0.40 N ATOM 1436 CA PRO A 94 1.808 6.060 -13.904 1.00 0.48 C ATOM 1437 C PRO A 94 2.025 4.545 -13.882 1.00 0.48 C ATOM 1438 O PRO A 94 1.196 3.791 -14.393 1.00 0.64 O ATOM 1439 CB PRO A 94 2.134 6.614 -15.284 1.00 0.58 C ATOM 1440 CG PRO A 94 3.163 7.682 -15.095 1.00 0.73 C ATOM 1441 CD PRO A 94 3.736 7.517 -13.716 1.00 0.50 C ATOM 0 HA PRO A 94 0.767 6.200 -13.611 1.00 0.48 H new ATOM 0 HB2 PRO A 94 2.511 5.826 -15.936 1.00 0.58 H new ATOM 0 HB3 PRO A 94 1.240 7.019 -15.758 1.00 0.58 H new ATOM 0 HG2 PRO A 94 3.946 7.598 -15.848 1.00 0.73 H new ATOM 0 HG3 PRO A 94 2.716 8.670 -15.209 1.00 0.73 H new ATOM 0 HD2 PRO A 94 4.674 6.962 -13.735 1.00 0.50 H new ATOM 0 HD3 PRO A 94 3.945 8.480 -13.251 1.00 0.50 H new ATOM 1449 N THR A 95 3.137 4.097 -13.307 1.00 0.37 N ATOM 1450 CA THR A 95 3.395 2.668 -13.188 1.00 0.37 C ATOM 1451 C THR A 95 2.864 2.171 -11.854 1.00 0.30 C ATOM 1452 O THR A 95 2.237 1.113 -11.767 1.00 0.32 O ATOM 1453 CB THR A 95 4.905 2.332 -13.308 1.00 0.42 C ATOM 1454 OG1 THR A 95 5.114 0.922 -13.190 1.00 0.48 O ATOM 1455 CG2 THR A 95 5.729 3.054 -12.247 1.00 0.43 C ATOM 0 H THR A 95 3.866 4.696 -12.920 1.00 0.37 H new ATOM 0 HA THR A 95 2.884 2.168 -14.011 1.00 0.37 H new ATOM 0 HB THR A 95 5.234 2.672 -14.290 1.00 0.42 H new ATOM 0 HG1 THR A 95 5.858 0.752 -12.575 1.00 0.48 H new ATOM 0 HG21 THR A 95 6.781 2.793 -12.364 1.00 0.43 H new ATOM 0 HG22 THR A 95 5.607 4.131 -12.362 1.00 0.43 H new ATOM 0 HG23 THR A 95 5.389 2.754 -11.256 1.00 0.43 H new ATOM 1463 N GLY A 96 3.131 2.979 -10.831 1.00 0.26 N ATOM 1464 CA GLY A 96 2.513 2.830 -9.537 1.00 0.29 C ATOM 1465 C GLY A 96 2.699 1.470 -8.919 1.00 0.28 C ATOM 1466 O GLY A 96 1.874 1.034 -8.126 1.00 0.33 O ATOM 0 H GLY A 96 3.788 3.757 -10.888 1.00 0.26 H new ATOM 0 HA2 GLY A 96 2.922 3.582 -8.863 1.00 0.29 H new ATOM 0 HA3 GLY A 96 1.446 3.032 -9.631 1.00 0.29 H new ATOM 1470 N GLU A 97 3.792 0.803 -9.229 1.00 0.31 N ATOM 1471 CA GLU A 97 3.996 -0.524 -8.699 1.00 0.36 C ATOM 1472 C GLU A 97 4.598 -0.426 -7.329 1.00 0.26 C ATOM 1473 O GLU A 97 5.754 -0.036 -7.153 1.00 0.29 O ATOM 1474 CB GLU A 97 4.902 -1.310 -9.616 1.00 0.54 C ATOM 1475 CG GLU A 97 4.349 -1.396 -11.008 1.00 0.50 C ATOM 1476 CD GLU A 97 5.309 -2.065 -11.965 1.00 0.50 C ATOM 1477 OE1 GLU A 97 6.393 -1.498 -12.216 1.00 0.70 O ATOM 1478 OE2 GLU A 97 4.995 -3.167 -12.462 1.00 0.84 O ATOM 0 H GLU A 97 4.537 1.151 -9.833 1.00 0.31 H new ATOM 0 HA GLU A 97 3.039 -1.041 -8.631 1.00 0.36 H new ATOM 0 HB2 GLU A 97 5.886 -0.841 -9.644 1.00 0.54 H new ATOM 0 HB3 GLU A 97 5.039 -2.315 -9.217 1.00 0.54 H new ATOM 0 HG2 GLU A 97 3.411 -1.951 -10.990 1.00 0.50 H new ATOM 0 HG3 GLU A 97 4.120 -0.393 -11.368 1.00 0.50 H new ATOM 1485 N PHE A 98 3.788 -0.799 -6.371 1.00 0.19 N ATOM 1486 CA PHE A 98 4.130 -0.629 -4.971 1.00 0.15 C ATOM 1487 C PHE A 98 3.701 -1.823 -4.133 1.00 0.14 C ATOM 1488 O PHE A 98 2.865 -2.616 -4.555 1.00 0.17 O ATOM 1489 CB PHE A 98 3.515 0.668 -4.447 1.00 0.13 C ATOM 1490 CG PHE A 98 4.410 1.841 -4.743 1.00 0.15 C ATOM 1491 CD1 PHE A 98 4.401 2.412 -5.997 1.00 0.15 C ATOM 1492 CD2 PHE A 98 5.285 2.337 -3.794 1.00 0.18 C ATOM 1493 CE1 PHE A 98 5.244 3.458 -6.312 1.00 0.18 C ATOM 1494 CE2 PHE A 98 6.132 3.389 -4.097 1.00 0.22 C ATOM 1495 CZ PHE A 98 6.114 3.946 -5.359 1.00 0.22 C ATOM 0 H PHE A 98 2.876 -1.227 -6.532 1.00 0.19 H new ATOM 0 HA PHE A 98 5.215 -0.566 -4.888 1.00 0.15 H new ATOM 0 HB2 PHE A 98 2.539 0.824 -4.906 1.00 0.13 H new ATOM 0 HB3 PHE A 98 3.353 0.591 -3.372 1.00 0.13 H new ATOM 0 HD1 PHE A 98 3.722 2.034 -6.747 1.00 0.15 H new ATOM 0 HD2 PHE A 98 5.308 1.899 -2.807 1.00 0.18 H new ATOM 0 HE1 PHE A 98 5.223 3.893 -7.300 1.00 0.18 H new ATOM 0 HE2 PHE A 98 6.806 3.773 -3.346 1.00 0.22 H new ATOM 0 HZ PHE A 98 6.779 4.762 -5.600 1.00 0.22 H new ATOM 1505 N TYR A 99 4.280 -1.953 -2.950 1.00 0.14 N ATOM 1506 CA TYR A 99 4.038 -3.111 -2.101 1.00 0.13 C ATOM 1507 C TYR A 99 3.674 -2.678 -0.694 1.00 0.14 C ATOM 1508 O TYR A 99 4.250 -1.737 -0.154 1.00 0.21 O ATOM 1509 CB TYR A 99 5.281 -4.000 -2.045 1.00 0.18 C ATOM 1510 CG TYR A 99 5.827 -4.435 -3.395 1.00 0.24 C ATOM 1511 CD1 TYR A 99 4.965 -4.756 -4.420 1.00 0.35 C ATOM 1512 CD2 TYR A 99 7.187 -4.499 -3.650 1.00 0.40 C ATOM 1513 CE1 TYR A 99 5.433 -5.129 -5.660 1.00 0.44 C ATOM 1514 CE2 TYR A 99 7.669 -4.879 -4.892 1.00 0.47 C ATOM 1515 CZ TYR A 99 6.869 -5.269 -5.834 1.00 0.43 C ATOM 1516 OH TYR A 99 7.254 -5.563 -7.133 1.00 0.54 O ATOM 0 H TYR A 99 4.924 -1.268 -2.554 1.00 0.14 H new ATOM 0 HA TYR A 99 3.208 -3.672 -2.530 1.00 0.13 H new ATOM 0 HB2 TYR A 99 6.066 -3.467 -1.508 1.00 0.18 H new ATOM 0 HB3 TYR A 99 5.045 -4.891 -1.462 1.00 0.18 H new ATOM 0 HD1 TYR A 99 3.900 -4.714 -4.248 1.00 0.35 H new ATOM 0 HD2 TYR A 99 7.885 -4.248 -2.865 1.00 0.40 H new ATOM 0 HE1 TYR A 99 4.753 -5.312 -6.479 1.00 0.44 H new ATOM 0 HE2 TYR A 99 8.732 -4.850 -5.079 1.00 0.47 H new ATOM 0 HH TYR A 99 8.230 -5.642 -7.175 1.00 0.54 H new ATOM 1526 N ILE A 100 2.686 -3.349 -0.131 1.00 0.10 N ATOM 1527 CA ILE A 100 2.315 -3.181 1.255 1.00 0.10 C ATOM 1528 C ILE A 100 3.473 -3.538 2.176 1.00 0.12 C ATOM 1529 O ILE A 100 3.973 -4.659 2.157 1.00 0.17 O ATOM 1530 CB ILE A 100 1.122 -4.089 1.549 1.00 0.10 C ATOM 1531 CG1 ILE A 100 -0.076 -3.628 0.733 1.00 0.10 C ATOM 1532 CG2 ILE A 100 0.799 -4.125 3.037 1.00 0.12 C ATOM 1533 CD1 ILE A 100 -1.167 -4.661 0.650 1.00 0.12 C ATOM 0 H ILE A 100 2.116 -4.031 -0.631 1.00 0.10 H new ATOM 0 HA ILE A 100 2.054 -2.138 1.434 1.00 0.10 H new ATOM 0 HB ILE A 100 1.377 -5.108 1.260 1.00 0.10 H new ATOM 0 HG12 ILE A 100 -0.480 -2.717 1.174 1.00 0.10 H new ATOM 0 HG13 ILE A 100 0.254 -3.375 -0.275 1.00 0.10 H new ATOM 0 HG21 ILE A 100 -0.055 -4.781 3.208 1.00 0.12 H new ATOM 0 HG22 ILE A 100 1.661 -4.501 3.588 1.00 0.12 H new ATOM 0 HG23 ILE A 100 0.559 -3.119 3.382 1.00 0.12 H new ATOM 0 HD11 ILE A 100 -1.993 -4.271 0.055 1.00 0.12 H new ATOM 0 HD12 ILE A 100 -0.777 -5.565 0.182 1.00 0.12 H new ATOM 0 HD13 ILE A 100 -1.522 -4.896 1.653 1.00 0.12 H new ATOM 1545 N ILE A 101 3.887 -2.579 2.980 1.00 0.10 N ATOM 1546 CA ILE A 101 5.049 -2.756 3.846 1.00 0.12 C ATOM 1547 C ILE A 101 4.701 -3.363 5.207 1.00 0.13 C ATOM 1548 O ILE A 101 5.493 -4.141 5.743 1.00 0.21 O ATOM 1549 CB ILE A 101 5.799 -1.434 4.081 1.00 0.11 C ATOM 1550 CG1 ILE A 101 4.910 -0.431 4.799 1.00 0.11 C ATOM 1551 CG2 ILE A 101 6.288 -0.860 2.770 1.00 0.13 C ATOM 1552 CD1 ILE A 101 5.563 0.908 5.000 1.00 0.11 C ATOM 0 H ILE A 101 3.439 -1.666 3.056 1.00 0.10 H new ATOM 0 HA ILE A 101 5.690 -3.455 3.309 1.00 0.12 H new ATOM 0 HB ILE A 101 6.663 -1.641 4.712 1.00 0.11 H new ATOM 0 HG12 ILE A 101 3.991 -0.297 4.228 1.00 0.11 H new ATOM 0 HG13 ILE A 101 4.626 -0.838 5.769 1.00 0.11 H new ATOM 0 HG21 ILE A 101 6.816 0.075 2.957 1.00 0.13 H new ATOM 0 HG22 ILE A 101 6.964 -1.569 2.292 1.00 0.13 H new ATOM 0 HG23 ILE A 101 5.437 -0.672 2.115 1.00 0.13 H new ATOM 0 HD11 ILE A 101 4.874 1.575 5.518 1.00 0.11 H new ATOM 0 HD12 ILE A 101 6.467 0.786 5.597 1.00 0.11 H new ATOM 0 HD13 ILE A 101 5.822 1.335 4.031 1.00 0.11 H new ATOM 1564 N ASN A 102 3.535 -3.038 5.772 1.00 0.14 N ATOM 1565 CA ASN A 102 3.154 -3.509 7.106 1.00 0.19 C ATOM 1566 C ASN A 102 1.782 -2.921 7.427 1.00 0.19 C ATOM 1567 O ASN A 102 1.233 -2.173 6.622 1.00 0.19 O ATOM 1568 CB ASN A 102 4.176 -3.133 8.199 1.00 0.25 C ATOM 1569 CG ASN A 102 4.172 -1.659 8.571 1.00 1.15 C ATOM 1570 OD1 ASN A 102 5.072 -0.896 7.976 1.00 2.03 O flip ATOM 1571 ND2 ASN A 102 3.393 -1.218 9.417 1.00 1.22 N flip ATOM 0 H ASN A 102 2.835 -2.447 5.323 1.00 0.14 H new ATOM 0 HA ASN A 102 3.127 -4.599 7.097 1.00 0.19 H new ATOM 0 HB2 ASN A 102 3.970 -3.723 9.092 1.00 0.25 H new ATOM 0 HB3 ASN A 102 5.174 -3.408 7.858 1.00 0.25 H new ATOM 0 HD21 ASN A 102 2.711 -1.838 9.855 1.00 1.22 H new ATOM 0 HD22 ASN A 102 3.429 -0.233 9.680 1.00 1.22 H new ATOM 1578 N ARG A 103 1.227 -3.252 8.584 1.00 0.19 N ATOM 1579 CA ARG A 103 -0.132 -2.816 8.893 1.00 0.21 C ATOM 1580 C ARG A 103 -0.260 -2.265 10.301 1.00 0.20 C ATOM 1581 O ARG A 103 0.502 -2.616 11.202 1.00 0.32 O ATOM 1582 CB ARG A 103 -1.144 -3.951 8.711 1.00 0.28 C ATOM 1583 CG ARG A 103 -0.621 -5.136 7.924 1.00 0.25 C ATOM 1584 CD ARG A 103 -1.564 -6.323 8.035 1.00 0.32 C ATOM 1585 NE ARG A 103 -0.956 -7.588 7.607 1.00 0.53 N ATOM 1586 CZ ARG A 103 -0.723 -8.614 8.430 1.00 0.96 C ATOM 1587 NH1 ARG A 103 -0.970 -8.505 9.731 1.00 1.52 N ATOM 1588 NH2 ARG A 103 -0.234 -9.749 7.957 1.00 1.27 N ATOM 0 H ARG A 103 1.681 -3.807 9.310 1.00 0.19 H new ATOM 0 HA ARG A 103 -0.351 -2.016 8.186 1.00 0.21 H new ATOM 0 HB2 ARG A 103 -1.465 -4.296 9.694 1.00 0.28 H new ATOM 0 HB3 ARG A 103 -2.027 -3.557 8.207 1.00 0.28 H new ATOM 0 HG2 ARG A 103 -0.503 -4.858 6.877 1.00 0.25 H new ATOM 0 HG3 ARG A 103 0.366 -5.415 8.293 1.00 0.25 H new ATOM 0 HD2 ARG A 103 -1.896 -6.419 9.069 1.00 0.32 H new ATOM 0 HD3 ARG A 103 -2.451 -6.131 7.431 1.00 0.32 H new ATOM 0 HE ARG A 103 -0.697 -7.690 6.626 1.00 0.53 H new ATOM 0 HH11 ARG A 103 -1.340 -7.633 10.108 1.00 1.52 H new ATOM 0 HH12 ARG A 103 -0.789 -9.294 10.352 1.00 1.52 H new ATOM 0 HH21 ARG A 103 -0.034 -9.842 6.961 1.00 1.27 H new ATOM 0 HH22 ARG A 103 -0.057 -10.530 8.588 1.00 1.27 H new ATOM 1602 N GLN A 104 -1.251 -1.404 10.472 1.00 0.21 N ATOM 1603 CA GLN A 104 -1.594 -0.865 11.763 1.00 0.20 C ATOM 1604 C GLN A 104 -3.083 -1.083 12.031 1.00 0.18 C ATOM 1605 O GLN A 104 -3.935 -0.374 11.508 1.00 0.18 O ATOM 1606 CB GLN A 104 -1.252 0.622 11.810 1.00 0.25 C ATOM 1607 CG GLN A 104 -1.650 1.299 13.104 1.00 0.28 C ATOM 1608 CD GLN A 104 -1.376 2.786 13.094 1.00 0.34 C ATOM 1609 OE1 GLN A 104 -0.465 3.265 12.418 1.00 0.59 O ATOM 1610 NE2 GLN A 104 -2.161 3.529 13.850 1.00 0.57 N ATOM 0 H GLN A 104 -1.838 -1.063 9.711 1.00 0.21 H new ATOM 0 HA GLN A 104 -1.021 -1.377 12.536 1.00 0.20 H new ATOM 0 HB2 GLN A 104 -0.179 0.743 11.662 1.00 0.25 H new ATOM 0 HB3 GLN A 104 -1.747 1.126 10.980 1.00 0.25 H new ATOM 0 HG2 GLN A 104 -2.712 1.131 13.286 1.00 0.28 H new ATOM 0 HG3 GLN A 104 -1.108 0.840 13.931 1.00 0.28 H new ATOM 0 HE21 GLN A 104 -2.905 3.094 14.395 1.00 0.57 H new ATOM 0 HE22 GLN A 104 -2.024 4.539 13.889 1.00 0.57 H new ATOM 1619 N ARG A 105 -3.373 -2.096 12.824 1.00 0.16 N ATOM 1620 CA ARG A 105 -4.730 -2.397 13.262 1.00 0.16 C ATOM 1621 C ARG A 105 -5.262 -1.277 14.142 1.00 0.18 C ATOM 1622 O ARG A 105 -4.496 -0.440 14.626 1.00 0.20 O ATOM 1623 CB ARG A 105 -4.796 -3.777 13.925 1.00 0.18 C ATOM 1624 CG ARG A 105 -6.206 -4.250 14.193 1.00 0.21 C ATOM 1625 CD ARG A 105 -6.244 -5.709 14.604 1.00 0.26 C ATOM 1626 NE ARG A 105 -7.596 -6.171 14.929 1.00 1.22 N ATOM 1627 CZ ARG A 105 -7.861 -7.356 15.483 1.00 1.80 C ATOM 1628 NH1 ARG A 105 -6.874 -8.199 15.768 1.00 1.66 N ATOM 1629 NH2 ARG A 105 -9.114 -7.700 15.752 1.00 2.82 N ATOM 0 H ARG A 105 -2.671 -2.741 13.187 1.00 0.16 H new ATOM 0 HA ARG A 105 -5.387 -2.449 12.394 1.00 0.16 H new ATOM 0 HB2 ARG A 105 -4.293 -4.503 13.286 1.00 0.18 H new ATOM 0 HB3 ARG A 105 -4.247 -3.746 14.866 1.00 0.18 H new ATOM 0 HG2 ARG A 105 -6.650 -3.640 14.979 1.00 0.21 H new ATOM 0 HG3 ARG A 105 -6.813 -4.109 13.298 1.00 0.21 H new ATOM 0 HD2 ARG A 105 -5.840 -6.320 13.797 1.00 0.26 H new ATOM 0 HD3 ARG A 105 -5.597 -5.855 15.469 1.00 0.26 H new ATOM 0 HE ARG A 105 -8.379 -5.552 14.720 1.00 1.22 H new ATOM 0 HH11 ARG A 105 -5.908 -7.942 15.563 1.00 1.66 H new ATOM 0 HH12 ARG A 105 -7.082 -9.103 16.191 1.00 1.66 H new ATOM 0 HH21 ARG A 105 -9.877 -7.058 15.535 1.00 2.82 H new ATOM 0 HH22 ARG A 105 -9.314 -8.606 16.175 1.00 2.82 H new ATOM 1643 N ASN A 106 -6.574 -1.312 14.354 1.00 0.20 N ATOM 1644 CA ASN A 106 -7.402 -0.161 14.707 1.00 0.23 C ATOM 1645 C ASN A 106 -6.703 0.844 15.610 1.00 0.25 C ATOM 1646 O ASN A 106 -6.535 0.623 16.811 1.00 0.28 O ATOM 1647 CB ASN A 106 -8.617 -0.686 15.462 1.00 0.26 C ATOM 1648 CG ASN A 106 -9.553 -1.545 14.643 1.00 0.29 C ATOM 1649 OD1 ASN A 106 -10.556 -1.066 14.129 1.00 0.35 O ATOM 1650 ND2 ASN A 106 -9.245 -2.833 14.539 1.00 0.29 N ATOM 0 H ASN A 106 -7.111 -2.176 14.282 1.00 0.20 H new ATOM 0 HA ASN A 106 -7.652 0.355 13.780 1.00 0.23 H new ATOM 0 HB2 ASN A 106 -8.272 -1.265 16.319 1.00 0.26 H new ATOM 0 HB3 ASN A 106 -9.177 0.163 15.855 1.00 0.26 H new ATOM 0 HD21 ASN A 106 -9.854 -3.462 14.016 1.00 0.29 H new ATOM 0 HD22 ASN A 106 -8.400 -3.193 14.982 1.00 0.29 H new ATOM 1657 N PRO A 107 -6.267 1.966 15.009 1.00 0.26 N ATOM 1658 CA PRO A 107 -5.729 3.101 15.748 1.00 0.34 C ATOM 1659 C PRO A 107 -6.745 3.653 16.738 1.00 0.38 C ATOM 1660 O PRO A 107 -6.403 4.020 17.861 1.00 0.48 O ATOM 1661 CB PRO A 107 -5.412 4.151 14.670 1.00 0.42 C ATOM 1662 CG PRO A 107 -6.023 3.658 13.400 1.00 0.30 C ATOM 1663 CD PRO A 107 -6.229 2.179 13.551 1.00 0.25 C ATOM 0 HA PRO A 107 -4.855 2.820 16.335 1.00 0.34 H new ATOM 0 HB2 PRO A 107 -5.821 5.123 14.944 1.00 0.42 H new ATOM 0 HB3 PRO A 107 -4.335 4.278 14.558 1.00 0.42 H new ATOM 0 HG2 PRO A 107 -6.971 4.161 13.209 1.00 0.30 H new ATOM 0 HG3 PRO A 107 -5.372 3.871 12.552 1.00 0.30 H new ATOM 0 HD2 PRO A 107 -7.156 1.856 13.077 1.00 0.25 H new ATOM 0 HD3 PRO A 107 -5.420 1.615 13.087 1.00 0.25 H new ATOM 1726 N ALA A 113 -10.589 1.851 10.914 1.00 0.44 N ATOM 1727 CA ALA A 113 -10.239 0.620 11.657 1.00 0.24 C ATOM 1728 C ALA A 113 -8.839 -0.017 11.364 1.00 0.21 C ATOM 1729 O ALA A 113 -8.486 -1.023 11.977 1.00 0.22 O ATOM 1730 CB ALA A 113 -11.358 -0.366 11.353 1.00 0.48 C ATOM 0 HA ALA A 113 -10.147 0.884 12.711 1.00 0.24 H new ATOM 0 HB1 ALA A 113 -11.166 -1.305 11.872 1.00 0.48 H new ATOM 0 HB2 ALA A 113 -12.309 0.047 11.690 1.00 0.48 H new ATOM 0 HB3 ALA A 113 -11.402 -0.547 10.279 1.00 0.48 H new ATOM 1736 N TYR A 114 -8.055 0.548 10.458 1.00 0.21 N ATOM 1737 CA TYR A 114 -6.756 -0.012 10.058 1.00 0.18 C ATOM 1738 C TYR A 114 -5.951 1.020 9.296 1.00 0.18 C ATOM 1739 O TYR A 114 -6.513 1.946 8.719 1.00 0.28 O ATOM 1740 CB TYR A 114 -6.917 -1.218 9.119 1.00 0.18 C ATOM 1741 CG TYR A 114 -6.504 -2.538 9.720 1.00 0.17 C ATOM 1742 CD1 TYR A 114 -5.194 -2.987 9.637 1.00 0.18 C ATOM 1743 CD2 TYR A 114 -7.429 -3.330 10.365 1.00 0.17 C ATOM 1744 CE1 TYR A 114 -4.825 -4.200 10.190 1.00 0.19 C ATOM 1745 CE2 TYR A 114 -7.073 -4.540 10.919 1.00 0.18 C ATOM 1746 CZ TYR A 114 -5.770 -4.971 10.830 1.00 0.19 C ATOM 1747 OH TYR A 114 -5.413 -6.181 11.382 1.00 0.22 O ATOM 0 H TYR A 114 -8.296 1.412 9.973 1.00 0.21 H new ATOM 0 HA TYR A 114 -6.257 -0.315 10.978 1.00 0.18 H new ATOM 0 HB2 TYR A 114 -7.960 -1.285 8.809 1.00 0.18 H new ATOM 0 HB3 TYR A 114 -6.328 -1.043 8.219 1.00 0.18 H new ATOM 0 HD1 TYR A 114 -4.453 -2.382 9.135 1.00 0.18 H new ATOM 0 HD2 TYR A 114 -8.453 -2.995 10.438 1.00 0.17 H new ATOM 0 HE1 TYR A 114 -3.802 -4.540 10.120 1.00 0.19 H new ATOM 0 HE2 TYR A 114 -7.813 -5.147 11.420 1.00 0.18 H new ATOM 0 HH TYR A 114 -4.476 -6.147 11.667 1.00 0.22 H new ATOM 1757 N TRP A 115 -4.643 0.852 9.274 1.00 0.13 N ATOM 1758 CA TRP A 115 -3.810 1.615 8.374 1.00 0.14 C ATOM 1759 C TRP A 115 -2.752 0.677 7.786 1.00 0.13 C ATOM 1760 O TRP A 115 -1.753 0.375 8.436 1.00 0.14 O ATOM 1761 CB TRP A 115 -3.181 2.793 9.142 1.00 0.16 C ATOM 1762 CG TRP A 115 -2.066 3.513 8.432 1.00 0.20 C ATOM 1763 CD1 TRP A 115 -0.746 3.161 8.433 1.00 0.25 C ATOM 1764 CD2 TRP A 115 -2.158 4.719 7.655 1.00 0.28 C ATOM 1765 NE1 TRP A 115 -0.014 4.065 7.706 1.00 0.31 N ATOM 1766 CE2 TRP A 115 -0.853 5.027 7.216 1.00 0.33 C ATOM 1767 CE3 TRP A 115 -3.208 5.570 7.280 1.00 0.37 C ATOM 1768 CZ2 TRP A 115 -0.570 6.140 6.432 1.00 0.42 C ATOM 1769 CZ3 TRP A 115 -2.919 6.677 6.497 1.00 0.47 C ATOM 1770 CH2 TRP A 115 -1.610 6.950 6.083 1.00 0.49 C ATOM 0 H TRP A 115 -4.138 0.195 9.869 1.00 0.13 H new ATOM 0 HA TRP A 115 -4.392 2.034 7.553 1.00 0.14 H new ATOM 0 HB2 TRP A 115 -3.966 3.514 9.372 1.00 0.16 H new ATOM 0 HB3 TRP A 115 -2.801 2.421 10.094 1.00 0.16 H new ATOM 0 HD1 TRP A 115 -0.338 2.296 8.934 1.00 0.25 H new ATOM 0 HE1 TRP A 115 0.994 4.026 7.555 1.00 0.31 H new ATOM 0 HE3 TRP A 115 -4.221 5.367 7.595 1.00 0.37 H new ATOM 0 HZ2 TRP A 115 0.438 6.355 6.111 1.00 0.42 H new ATOM 0 HZ3 TRP A 115 -3.718 7.341 6.201 1.00 0.47 H new ATOM 0 HH2 TRP A 115 -1.420 7.821 5.474 1.00 0.49 H new ATOM 1781 N LEU A 116 -2.985 0.172 6.592 1.00 0.13 N ATOM 1782 CA LEU A 116 -2.043 -0.720 5.939 1.00 0.13 C ATOM 1783 C LEU A 116 -1.048 0.105 5.142 1.00 0.13 C ATOM 1784 O LEU A 116 -1.404 0.782 4.181 1.00 0.15 O ATOM 1785 CB LEU A 116 -2.825 -1.689 5.058 1.00 0.16 C ATOM 1786 CG LEU A 116 -3.681 -2.673 5.854 1.00 0.19 C ATOM 1787 CD1 LEU A 116 -5.060 -2.838 5.255 1.00 0.59 C ATOM 1788 CD2 LEU A 116 -2.990 -4.007 5.937 1.00 0.66 C ATOM 0 H LEU A 116 -3.826 0.365 6.048 1.00 0.13 H new ATOM 0 HA LEU A 116 -1.479 -1.302 6.667 1.00 0.13 H new ATOM 0 HB2 LEU A 116 -3.468 -1.120 4.386 1.00 0.16 H new ATOM 0 HB3 LEU A 116 -2.126 -2.247 4.435 1.00 0.16 H new ATOM 0 HG LEU A 116 -3.806 -2.264 6.857 1.00 0.19 H new ATOM 0 HD11 LEU A 116 -5.634 -3.546 5.853 1.00 0.59 H new ATOM 0 HD12 LEU A 116 -5.570 -1.875 5.245 1.00 0.59 H new ATOM 0 HD13 LEU A 116 -4.971 -3.212 4.235 1.00 0.59 H new ATOM 0 HD21 LEU A 116 -3.608 -4.702 6.506 1.00 0.66 H new ATOM 0 HD22 LEU A 116 -2.834 -4.399 4.932 1.00 0.66 H new ATOM 0 HD23 LEU A 116 -2.027 -3.888 6.433 1.00 0.66 H new ATOM 1800 N SER A 117 0.201 0.059 5.558 1.00 0.13 N ATOM 1801 CA SER A 117 1.205 0.958 5.028 1.00 0.12 C ATOM 1802 C SER A 117 1.807 0.416 3.737 1.00 0.11 C ATOM 1803 O SER A 117 1.984 -0.790 3.577 1.00 0.12 O ATOM 1804 CB SER A 117 2.287 1.179 6.077 1.00 0.13 C ATOM 1805 OG SER A 117 1.726 1.658 7.285 1.00 0.19 O ATOM 0 H SER A 117 0.545 -0.593 6.263 1.00 0.13 H new ATOM 0 HA SER A 117 0.733 1.911 4.790 1.00 0.12 H new ATOM 0 HB2 SER A 117 2.816 0.244 6.262 1.00 0.13 H new ATOM 0 HB3 SER A 117 3.021 1.893 5.704 1.00 0.13 H new ATOM 0 HG SER A 117 0.947 2.217 7.085 1.00 0.19 H new ATOM 1811 N LEU A 118 2.107 1.321 2.813 1.00 0.11 N ATOM 1812 CA LEU A 118 2.656 0.966 1.516 1.00 0.11 C ATOM 1813 C LEU A 118 4.116 1.362 1.414 1.00 0.11 C ATOM 1814 O LEU A 118 4.633 2.077 2.266 1.00 0.12 O ATOM 1815 CB LEU A 118 1.872 1.683 0.431 1.00 0.12 C ATOM 1816 CG LEU A 118 0.546 1.041 0.048 1.00 0.11 C ATOM 1817 CD1 LEU A 118 0.775 -0.169 -0.837 1.00 0.13 C ATOM 1818 CD2 LEU A 118 -0.236 0.636 1.270 1.00 0.10 C ATOM 0 H LEU A 118 1.975 2.324 2.945 1.00 0.11 H new ATOM 0 HA LEU A 118 2.580 -0.114 1.393 1.00 0.11 H new ATOM 0 HB2 LEU A 118 1.680 2.704 0.760 1.00 0.12 H new ATOM 0 HB3 LEU A 118 2.495 1.748 -0.461 1.00 0.12 H new ATOM 0 HG LEU A 118 -0.032 1.783 -0.503 1.00 0.11 H new ATOM 0 HD11 LEU A 118 -0.185 -0.614 -1.100 1.00 0.13 H new ATOM 0 HD12 LEU A 118 1.294 0.137 -1.745 1.00 0.13 H new ATOM 0 HD13 LEU A 118 1.380 -0.901 -0.303 1.00 0.13 H new ATOM 0 HD21 LEU A 118 -1.178 0.181 0.965 1.00 0.10 H new ATOM 0 HD22 LEU A 118 0.343 -0.082 1.851 1.00 0.10 H new ATOM 0 HD23 LEU A 118 -0.439 1.516 1.880 1.00 0.10 H new ATOM 1830 N SER A 119 4.751 0.909 0.344 1.00 0.11 N ATOM 1831 CA SER A 119 6.160 1.181 0.074 1.00 0.13 C ATOM 1832 C SER A 119 6.453 2.678 -0.091 1.00 0.14 C ATOM 1833 O SER A 119 7.613 3.082 -0.107 1.00 0.18 O ATOM 1834 CB SER A 119 6.593 0.392 -1.168 1.00 0.21 C ATOM 1835 OG SER A 119 7.764 0.924 -1.759 1.00 1.17 O ATOM 0 H SER A 119 4.301 0.336 -0.370 1.00 0.11 H new ATOM 0 HA SER A 119 6.740 0.857 0.938 1.00 0.13 H new ATOM 0 HB2 SER A 119 6.768 -0.648 -0.893 1.00 0.21 H new ATOM 0 HB3 SER A 119 5.785 0.397 -1.899 1.00 0.21 H new ATOM 0 HG SER A 119 8.537 0.727 -1.189 1.00 1.17 H new ATOM 1841 N LYS A 120 5.414 3.487 -0.241 1.00 0.14 N ATOM 1842 CA LYS A 120 5.604 4.927 -0.264 1.00 0.15 C ATOM 1843 C LYS A 120 4.700 5.601 0.743 1.00 0.15 C ATOM 1844 O LYS A 120 3.523 5.259 0.862 1.00 0.15 O ATOM 1845 CB LYS A 120 5.368 5.510 -1.649 1.00 0.18 C ATOM 1846 CG LYS A 120 6.157 6.781 -1.928 1.00 0.31 C ATOM 1847 CD LYS A 120 5.638 7.997 -1.179 1.00 1.09 C ATOM 1848 CE LYS A 120 6.634 9.144 -1.240 1.00 1.09 C ATOM 1849 NZ LYS A 120 7.091 9.426 -2.629 1.00 1.22 N ATOM 0 H LYS A 120 4.448 3.177 -0.347 1.00 0.14 H new ATOM 0 HA LYS A 120 6.643 5.118 0.005 1.00 0.15 H new ATOM 0 HB2 LYS A 120 5.629 4.761 -2.397 1.00 0.18 H new ATOM 0 HB3 LYS A 120 4.305 5.721 -1.767 1.00 0.18 H new ATOM 0 HG2 LYS A 120 7.200 6.617 -1.659 1.00 0.31 H new ATOM 0 HG3 LYS A 120 6.132 6.986 -2.998 1.00 0.31 H new ATOM 0 HD2 LYS A 120 4.687 8.314 -1.608 1.00 1.09 H new ATOM 0 HD3 LYS A 120 5.446 7.733 -0.139 1.00 1.09 H new ATOM 0 HE2 LYS A 120 6.177 10.041 -0.822 1.00 1.09 H new ATOM 0 HE3 LYS A 120 7.497 8.906 -0.618 1.00 1.09 H new ATOM 0 HZ1 LYS A 120 7.573 10.347 -2.656 1.00 1.22 H new ATOM 0 HZ2 LYS A 120 7.750 8.682 -2.936 1.00 1.22 H new ATOM 0 HZ3 LYS A 120 6.270 9.446 -3.267 1.00 1.22 H new ATOM 1863 N GLN A 121 5.290 6.513 1.482 1.00 0.17 N ATOM 1864 CA GLN A 121 4.619 7.262 2.537 1.00 0.20 C ATOM 1865 C GLN A 121 3.158 7.606 2.230 1.00 0.19 C ATOM 1866 O GLN A 121 2.263 7.210 2.981 1.00 0.31 O ATOM 1867 CB GLN A 121 5.422 8.519 2.850 1.00 0.34 C ATOM 1868 CG GLN A 121 6.514 8.296 3.889 1.00 0.48 C ATOM 1869 CD GLN A 121 7.461 9.461 3.997 1.00 0.86 C ATOM 1870 OE1 GLN A 121 7.227 10.410 4.745 1.00 1.51 O ATOM 1871 NE2 GLN A 121 8.557 9.374 3.271 1.00 1.39 N ATOM 0 H GLN A 121 6.272 6.765 1.369 1.00 0.17 H new ATOM 0 HA GLN A 121 4.578 6.611 3.411 1.00 0.20 H new ATOM 0 HB2 GLN A 121 5.876 8.890 1.931 1.00 0.34 H new ATOM 0 HB3 GLN A 121 4.744 9.295 3.207 1.00 0.34 H new ATOM 0 HG2 GLN A 121 6.054 8.116 4.861 1.00 0.48 H new ATOM 0 HG3 GLN A 121 7.077 7.399 3.632 1.00 0.48 H new ATOM 0 HE21 GLN A 121 8.705 8.566 2.666 1.00 1.39 H new ATOM 0 HE22 GLN A 121 9.257 10.114 3.314 1.00 1.39 H new ATOM 1880 N HIS A 122 2.911 8.290 1.125 1.00 0.19 N ATOM 1881 CA HIS A 122 1.557 8.782 0.871 1.00 0.22 C ATOM 1882 C HIS A 122 0.783 7.847 -0.063 1.00 0.15 C ATOM 1883 O HIS A 122 -0.273 8.202 -0.583 1.00 0.20 O ATOM 1884 CB HIS A 122 1.578 10.204 0.320 1.00 0.35 C ATOM 1885 CG HIS A 122 0.611 11.120 0.997 1.00 1.14 C ATOM 1886 ND1 HIS A 122 -0.733 11.148 0.917 1.00 1.81 N flip ATOM 1887 CD2 HIS A 122 1.032 12.112 1.848 1.00 1.99 C flip ATOM 1888 CE1 HIS A 122 -1.162 12.169 1.728 1.00 2.38 C flip ATOM 1889 NE2 HIS A 122 -0.066 12.718 2.266 1.00 2.53 N flip ATOM 0 H HIS A 122 3.601 8.514 0.408 1.00 0.19 H new ATOM 0 HA HIS A 122 1.036 8.799 1.828 1.00 0.22 H new ATOM 0 HB2 HIS A 122 2.584 10.610 0.423 1.00 0.35 H new ATOM 0 HB3 HIS A 122 1.354 10.175 -0.746 1.00 0.35 H new ATOM 0 HD2 HIS A 122 2.050 12.348 2.120 1.00 1.99 H new ATOM 0 HE1 HIS A 122 -2.185 12.471 1.899 1.00 2.38 H new ATOM 0 HE2 HIS A 122 -0.077 13.504 2.916 1.00 2.53 H new ATOM 1897 N TYR A 123 1.325 6.659 -0.282 1.00 0.16 N ATOM 1898 CA TYR A 123 0.739 5.686 -1.190 1.00 0.22 C ATOM 1899 C TYR A 123 -0.098 4.645 -0.481 1.00 0.32 C ATOM 1900 O TYR A 123 -0.130 3.509 -0.924 1.00 0.84 O ATOM 1901 CB TYR A 123 1.835 4.944 -1.927 1.00 0.28 C ATOM 1902 CG TYR A 123 2.456 5.751 -3.023 1.00 0.23 C ATOM 1903 CD1 TYR A 123 2.737 7.078 -2.804 1.00 0.22 C ATOM 1904 CD2 TYR A 123 2.780 5.199 -4.250 1.00 0.25 C ATOM 1905 CE1 TYR A 123 3.321 7.848 -3.759 1.00 0.23 C ATOM 1906 CE2 TYR A 123 3.373 5.970 -5.232 1.00 0.28 C ATOM 1907 CZ TYR A 123 3.643 7.299 -4.980 1.00 0.27 C ATOM 1908 OH TYR A 123 4.243 8.076 -5.944 1.00 0.33 O ATOM 0 H TYR A 123 2.185 6.342 0.166 1.00 0.16 H new ATOM 0 HA TYR A 123 0.100 6.254 -1.867 1.00 0.22 H new ATOM 0 HB2 TYR A 123 2.608 4.651 -1.217 1.00 0.28 H new ATOM 0 HB3 TYR A 123 1.425 4.026 -2.348 1.00 0.28 H new ATOM 0 HD1 TYR A 123 2.488 7.519 -1.850 1.00 0.22 H new ATOM 0 HD2 TYR A 123 2.568 4.158 -4.442 1.00 0.25 H new ATOM 0 HE1 TYR A 123 3.532 8.888 -3.561 1.00 0.23 H new ATOM 0 HE2 TYR A 123 3.623 5.535 -6.189 1.00 0.28 H new ATOM 0 HH TYR A 123 4.038 7.713 -6.831 1.00 0.33 H new ATOM 1918 N GLY A 124 -0.831 5.001 0.552 1.00 0.32 N ATOM 1919 CA GLY A 124 -1.108 3.990 1.540 1.00 0.19 C ATOM 1920 C GLY A 124 -2.576 3.652 1.635 1.00 0.11 C ATOM 1921 O GLY A 124 -3.434 4.523 1.516 1.00 0.12 O ATOM 0 H GLY A 124 -1.224 5.926 0.723 1.00 0.32 H new ATOM 0 HA2 GLY A 124 -0.547 3.088 1.297 1.00 0.19 H new ATOM 0 HA3 GLY A 124 -0.755 4.333 2.513 1.00 0.19 H new ATOM 1925 N ILE A 125 -2.836 2.381 1.861 1.00 0.09 N ATOM 1926 CA ILE A 125 -4.180 1.833 1.935 1.00 0.09 C ATOM 1927 C ILE A 125 -4.664 1.785 3.382 1.00 0.09 C ATOM 1928 O ILE A 125 -4.120 1.076 4.223 1.00 0.12 O ATOM 1929 CB ILE A 125 -4.234 0.421 1.293 1.00 0.12 C ATOM 1930 CG1 ILE A 125 -4.271 0.519 -0.239 1.00 0.13 C ATOM 1931 CG2 ILE A 125 -5.435 -0.364 1.794 1.00 0.18 C ATOM 1932 CD1 ILE A 125 -3.015 1.093 -0.864 1.00 0.13 C ATOM 0 H ILE A 125 -2.106 1.683 2.002 1.00 0.09 H new ATOM 0 HA ILE A 125 -4.846 2.488 1.373 1.00 0.09 H new ATOM 0 HB ILE A 125 -3.329 -0.110 1.588 1.00 0.12 H new ATOM 0 HG12 ILE A 125 -4.444 -0.476 -0.650 1.00 0.13 H new ATOM 0 HG13 ILE A 125 -5.121 1.136 -0.530 1.00 0.13 H new ATOM 0 HG21 ILE A 125 -5.447 -1.349 1.327 1.00 0.18 H new ATOM 0 HG22 ILE A 125 -5.371 -0.476 2.876 1.00 0.18 H new ATOM 0 HG23 ILE A 125 -6.351 0.169 1.539 1.00 0.18 H new ATOM 0 HD11 ILE A 125 -3.130 1.125 -1.947 1.00 0.13 H new ATOM 0 HD12 ILE A 125 -2.849 2.102 -0.487 1.00 0.13 H new ATOM 0 HD13 ILE A 125 -2.162 0.465 -0.608 1.00 0.13 H new ATOM 1944 N HIS A 126 -5.697 2.563 3.657 1.00 0.09 N ATOM 1945 CA HIS A 126 -6.269 2.650 4.993 1.00 0.11 C ATOM 1946 C HIS A 126 -7.771 2.824 4.892 1.00 0.15 C ATOM 1947 O HIS A 126 -8.282 3.052 3.815 1.00 0.21 O ATOM 1948 CB HIS A 126 -5.655 3.828 5.763 1.00 0.13 C ATOM 1949 CG HIS A 126 -5.950 5.185 5.180 1.00 0.14 C ATOM 1950 ND1 HIS A 126 -7.052 5.936 5.519 1.00 0.15 N ATOM 1951 CD2 HIS A 126 -5.244 5.944 4.297 1.00 0.16 C ATOM 1952 CE1 HIS A 126 -6.983 7.096 4.862 1.00 0.17 C ATOM 1953 NE2 HIS A 126 -5.906 7.153 4.106 1.00 0.18 N ATOM 0 H HIS A 126 -6.162 3.150 2.965 1.00 0.09 H new ATOM 0 HA HIS A 126 -6.047 1.730 5.533 1.00 0.11 H new ATOM 0 HB2 HIS A 126 -6.019 3.802 6.790 1.00 0.13 H new ATOM 0 HB3 HIS A 126 -4.574 3.693 5.805 1.00 0.13 H new ATOM 0 HD1 HIS A 126 -7.793 5.655 6.161 1.00 0.15 H new ATOM 0 HD2 HIS A 126 -4.319 5.654 3.821 1.00 0.16 H new ATOM 0 HE1 HIS A 126 -7.716 7.886 4.940 1.00 0.17 H new ATOM 1961 N GLY A 127 -8.469 2.734 6.007 1.00 0.20 N ATOM 1962 CA GLY A 127 -9.909 2.933 5.986 1.00 0.27 C ATOM 1963 C GLY A 127 -10.291 4.372 6.289 1.00 0.22 C ATOM 1964 O GLY A 127 -9.437 5.252 6.316 1.00 0.19 O ATOM 0 H GLY A 127 -8.074 2.528 6.925 1.00 0.20 H new ATOM 0 HA2 GLY A 127 -10.299 2.653 5.007 1.00 0.27 H new ATOM 0 HA3 GLY A 127 -10.377 2.273 6.716 1.00 0.27 H new ATOM 1968 N THR A 128 -11.568 4.621 6.528 1.00 0.30 N ATOM 1969 CA THR A 128 -12.020 5.959 6.874 1.00 0.24 C ATOM 1970 C THR A 128 -13.328 5.909 7.655 1.00 0.33 C ATOM 1971 O THR A 128 -13.922 4.841 7.816 1.00 0.41 O ATOM 1972 CB THR A 128 -12.211 6.808 5.604 1.00 0.19 C ATOM 1973 OG1 THR A 128 -12.426 8.184 5.957 1.00 0.21 O ATOM 1974 CG2 THR A 128 -13.395 6.302 4.786 1.00 0.26 C ATOM 0 H THR A 128 -12.307 3.919 6.489 1.00 0.30 H new ATOM 0 HA THR A 128 -11.255 6.417 7.501 1.00 0.24 H new ATOM 0 HB THR A 128 -11.307 6.724 5.001 1.00 0.19 H new ATOM 0 HG1 THR A 128 -12.545 8.716 5.143 1.00 0.21 H new ATOM 0 HG21 THR A 128 -13.510 6.917 3.894 1.00 0.26 H new ATOM 0 HG22 THR A 128 -13.219 5.267 4.493 1.00 0.26 H new ATOM 0 HG23 THR A 128 -14.303 6.360 5.386 1.00 0.26 H new ATOM 1982 N ASN A 129 -13.769 7.068 8.136 1.00 0.36 N ATOM 1983 CA ASN A 129 -15.042 7.177 8.835 1.00 0.45 C ATOM 1984 C ASN A 129 -16.010 7.970 7.963 1.00 0.41 C ATOM 1985 O ASN A 129 -17.195 8.109 8.278 1.00 0.48 O ATOM 1986 CB ASN A 129 -14.880 7.860 10.200 1.00 0.55 C ATOM 1987 CG ASN A 129 -14.937 9.379 10.107 1.00 1.16 C ATOM 1988 OD1 ASN A 129 -15.993 9.988 10.288 1.00 1.99 O ATOM 1989 ND2 ASN A 129 -13.809 10.004 9.803 1.00 1.59 N ATOM 0 H ASN A 129 -13.259 7.948 8.053 1.00 0.36 H new ATOM 0 HA ASN A 129 -15.430 6.175 9.018 1.00 0.45 H new ATOM 0 HB2 ASN A 129 -15.665 7.511 10.872 1.00 0.55 H new ATOM 0 HB3 ASN A 129 -13.928 7.562 10.640 1.00 0.55 H new ATOM 0 HD21 ASN A 129 -13.797 11.020 9.712 1.00 1.59 H new ATOM 0 HD22 ASN A 129 -12.952 9.469 9.660 1.00 1.59 H new ATOM 1996 N ASN A 130 -15.482 8.488 6.860 1.00 0.33 N ATOM 1997 CA ASN A 130 -16.293 9.184 5.873 1.00 0.30 C ATOM 1998 C ASN A 130 -16.225 8.412 4.560 1.00 0.28 C ATOM 1999 O ASN A 130 -15.405 8.707 3.685 1.00 0.28 O ATOM 2000 CB ASN A 130 -15.798 10.624 5.685 1.00 0.30 C ATOM 2001 CG ASN A 130 -16.716 11.447 4.800 1.00 0.45 C ATOM 2002 OD1 ASN A 130 -16.452 11.442 3.507 1.00 1.36 O flip ATOM 2003 ND2 ASN A 130 -17.656 12.081 5.280 1.00 1.10 N flip ATOM 0 H ASN A 130 -14.490 8.438 6.628 1.00 0.33 H new ATOM 0 HA ASN A 130 -17.327 9.236 6.214 1.00 0.30 H new ATOM 0 HB2 ASN A 130 -15.712 11.105 6.660 1.00 0.30 H new ATOM 0 HB3 ASN A 130 -14.799 10.607 5.249 1.00 0.30 H new ATOM 0 HD21 ASN A 130 -17.826 12.058 6.285 1.00 1.10 H new ATOM 0 HD22 ASN A 130 -18.265 12.629 4.672 1.00 1.10 H new ATOM 2010 N PRO A 131 -17.105 7.416 4.406 1.00 0.29 N ATOM 2011 CA PRO A 131 -17.010 6.437 3.330 1.00 0.28 C ATOM 2012 C PRO A 131 -17.409 6.978 1.970 1.00 0.27 C ATOM 2013 O PRO A 131 -17.105 6.386 0.937 1.00 0.27 O ATOM 2014 CB PRO A 131 -17.989 5.352 3.742 1.00 0.32 C ATOM 2015 CG PRO A 131 -18.941 5.980 4.687 1.00 0.35 C ATOM 2016 CD PRO A 131 -18.251 7.164 5.291 1.00 0.33 C ATOM 0 HA PRO A 131 -15.979 6.105 3.210 1.00 0.28 H new ATOM 0 HB2 PRO A 131 -18.512 4.952 2.874 1.00 0.32 H new ATOM 0 HB3 PRO A 131 -17.468 4.518 4.213 1.00 0.32 H new ATOM 0 HG2 PRO A 131 -19.850 6.287 4.170 1.00 0.35 H new ATOM 0 HG3 PRO A 131 -19.238 5.272 5.461 1.00 0.35 H new ATOM 0 HD2 PRO A 131 -18.914 8.028 5.337 1.00 0.33 H new ATOM 0 HD3 PRO A 131 -17.926 6.956 6.311 1.00 0.33 H new ATOM 2024 N ALA A 132 -18.104 8.093 1.973 1.00 0.28 N ATOM 2025 CA ALA A 132 -18.583 8.675 0.734 1.00 0.30 C ATOM 2026 C ALA A 132 -17.462 9.421 0.016 1.00 0.28 C ATOM 2027 O ALA A 132 -17.624 9.872 -1.116 1.00 0.33 O ATOM 2028 CB ALA A 132 -19.785 9.567 0.982 1.00 0.31 C ATOM 0 H ALA A 132 -18.351 8.615 2.814 1.00 0.28 H new ATOM 0 HA ALA A 132 -18.909 7.867 0.079 1.00 0.30 H new ATOM 0 HB1 ALA A 132 -20.125 9.991 0.037 1.00 0.31 H new ATOM 0 HB2 ALA A 132 -20.589 8.979 1.426 1.00 0.31 H new ATOM 0 HB3 ALA A 132 -19.506 10.372 1.662 1.00 0.31 H new ATOM 2034 N SER A 133 -16.313 9.521 0.677 1.00 0.24 N ATOM 2035 CA SER A 133 -15.115 10.066 0.054 1.00 0.24 C ATOM 2036 C SER A 133 -14.361 8.929 -0.626 1.00 0.20 C ATOM 2037 O SER A 133 -13.413 9.141 -1.382 1.00 0.21 O ATOM 2038 CB SER A 133 -14.235 10.749 1.108 1.00 0.28 C ATOM 2039 OG SER A 133 -13.077 11.334 0.532 1.00 1.35 O ATOM 0 H SER A 133 -16.188 9.230 1.647 1.00 0.24 H new ATOM 0 HA SER A 133 -15.388 10.815 -0.689 1.00 0.24 H new ATOM 0 HB2 SER A 133 -14.813 11.518 1.621 1.00 0.28 H new ATOM 0 HB3 SER A 133 -13.937 10.019 1.861 1.00 0.28 H new ATOM 0 HG SER A 133 -12.877 10.893 -0.320 1.00 1.35 H new ATOM 2045 N ILE A 134 -14.811 7.713 -0.353 1.00 0.18 N ATOM 2046 CA ILE A 134 -14.230 6.530 -0.950 1.00 0.16 C ATOM 2047 C ILE A 134 -14.712 6.394 -2.381 1.00 0.16 C ATOM 2048 O ILE A 134 -15.880 6.650 -2.678 1.00 0.21 O ATOM 2049 CB ILE A 134 -14.591 5.258 -0.159 1.00 0.16 C ATOM 2050 CG1 ILE A 134 -14.120 5.387 1.289 1.00 0.15 C ATOM 2051 CG2 ILE A 134 -13.987 4.026 -0.809 1.00 0.16 C ATOM 2052 CD1 ILE A 134 -12.660 5.741 1.421 1.00 0.15 C ATOM 0 H ILE A 134 -15.584 7.524 0.285 1.00 0.18 H new ATOM 0 HA ILE A 134 -13.146 6.641 -0.930 1.00 0.16 H new ATOM 0 HB ILE A 134 -15.675 5.144 -0.166 1.00 0.16 H new ATOM 0 HG12 ILE A 134 -14.717 6.150 1.789 1.00 0.15 H new ATOM 0 HG13 ILE A 134 -14.305 4.446 1.807 1.00 0.15 H new ATOM 0 HG21 ILE A 134 -14.256 3.141 -0.232 1.00 0.16 H new ATOM 0 HG22 ILE A 134 -14.369 3.927 -1.825 1.00 0.16 H new ATOM 0 HG23 ILE A 134 -12.902 4.125 -0.837 1.00 0.16 H new ATOM 0 HD11 ILE A 134 -12.398 5.816 2.476 1.00 0.15 H new ATOM 0 HD12 ILE A 134 -12.054 4.967 0.950 1.00 0.15 H new ATOM 0 HD13 ILE A 134 -12.472 6.697 0.932 1.00 0.15 H new ATOM 2064 N GLY A 135 -13.811 6.018 -3.263 1.00 0.14 N ATOM 2065 CA GLY A 135 -14.147 5.929 -4.660 1.00 0.15 C ATOM 2066 C GLY A 135 -13.921 7.248 -5.349 1.00 0.14 C ATOM 2067 O GLY A 135 -14.223 7.406 -6.532 1.00 0.15 O ATOM 0 H GLY A 135 -12.848 5.771 -3.036 1.00 0.14 H new ATOM 0 HA2 GLY A 135 -13.542 5.157 -5.136 1.00 0.15 H new ATOM 0 HA3 GLY A 135 -15.189 5.630 -4.770 1.00 0.15 H new ATOM 2071 N LYS A 136 -13.410 8.212 -4.596 1.00 0.14 N ATOM 2072 CA LYS A 136 -13.183 9.534 -5.119 1.00 0.15 C ATOM 2073 C LYS A 136 -11.712 9.918 -5.198 1.00 0.15 C ATOM 2074 O LYS A 136 -10.813 9.240 -4.698 1.00 0.17 O ATOM 2075 CB LYS A 136 -13.906 10.567 -4.265 1.00 0.17 C ATOM 2076 CG LYS A 136 -15.393 10.642 -4.508 1.00 1.03 C ATOM 2077 CD LYS A 136 -15.936 11.991 -4.073 1.00 1.03 C ATOM 2078 CE LYS A 136 -17.370 11.896 -3.571 1.00 1.94 C ATOM 2079 NZ LYS A 136 -18.307 11.403 -4.615 1.00 2.50 N ATOM 0 H LYS A 136 -13.147 8.093 -3.618 1.00 0.14 H new ATOM 0 HA LYS A 136 -13.573 9.520 -6.137 1.00 0.15 H new ATOM 0 HB2 LYS A 136 -13.733 10.338 -3.214 1.00 0.17 H new ATOM 0 HB3 LYS A 136 -13.469 11.548 -4.454 1.00 0.17 H new ATOM 0 HG2 LYS A 136 -15.603 10.483 -5.566 1.00 1.03 H new ATOM 0 HG3 LYS A 136 -15.898 9.846 -3.960 1.00 1.03 H new ATOM 0 HD2 LYS A 136 -15.303 12.399 -3.285 1.00 1.03 H new ATOM 0 HD3 LYS A 136 -15.891 12.687 -4.911 1.00 1.03 H new ATOM 0 HE2 LYS A 136 -17.407 11.229 -2.710 1.00 1.94 H new ATOM 0 HE3 LYS A 136 -17.697 12.877 -3.228 1.00 1.94 H new ATOM 0 HZ1 LYS A 136 -19.277 11.405 -4.240 1.00 2.50 H new ATOM 0 HZ2 LYS A 136 -18.257 12.024 -5.448 1.00 2.50 H new ATOM 0 HZ3 LYS A 136 -18.043 10.435 -4.889 1.00 2.50 H new ATOM 2093 N ALA A 137 -11.537 11.055 -5.824 1.00 0.14 N ATOM 2094 CA ALA A 137 -10.260 11.719 -5.998 1.00 0.14 C ATOM 2095 C ALA A 137 -10.191 12.873 -5.008 1.00 0.15 C ATOM 2096 O ALA A 137 -11.095 13.708 -4.974 1.00 0.17 O ATOM 2097 CB ALA A 137 -10.152 12.245 -7.415 1.00 0.15 C ATOM 0 H ALA A 137 -12.311 11.569 -6.246 1.00 0.14 H new ATOM 0 HA ALA A 137 -9.439 11.024 -5.821 1.00 0.14 H new ATOM 0 HB1 ALA A 137 -9.192 12.744 -7.546 1.00 0.15 H new ATOM 0 HB2 ALA A 137 -10.228 11.415 -8.118 1.00 0.15 H new ATOM 0 HB3 ALA A 137 -10.958 12.954 -7.602 1.00 0.15 H new ATOM 2103 N VAL A 138 -9.138 12.930 -4.194 1.00 0.15 N ATOM 2104 CA VAL A 138 -9.027 13.910 -3.125 1.00 0.17 C ATOM 2105 C VAL A 138 -7.736 14.709 -3.313 1.00 0.20 C ATOM 2106 O VAL A 138 -6.842 14.261 -4.034 1.00 0.35 O ATOM 2107 CB VAL A 138 -9.033 13.197 -1.734 1.00 0.22 C ATOM 2108 CG1 VAL A 138 -8.386 11.824 -1.827 1.00 0.48 C ATOM 2109 CG2 VAL A 138 -8.331 14.006 -0.658 1.00 0.66 C ATOM 0 H VAL A 138 -8.341 12.297 -4.260 1.00 0.15 H new ATOM 0 HA VAL A 138 -9.879 14.588 -3.161 1.00 0.17 H new ATOM 0 HB VAL A 138 -10.080 13.096 -1.449 1.00 0.22 H new ATOM 0 HG11 VAL A 138 -8.402 11.347 -0.847 1.00 0.48 H new ATOM 0 HG12 VAL A 138 -8.937 11.209 -2.539 1.00 0.48 H new ATOM 0 HG13 VAL A 138 -7.354 11.930 -2.162 1.00 0.48 H new ATOM 0 HG21 VAL A 138 -8.366 13.463 0.286 1.00 0.66 H new ATOM 0 HG22 VAL A 138 -7.292 14.169 -0.945 1.00 0.66 H new ATOM 0 HG23 VAL A 138 -8.830 14.968 -0.542 1.00 0.66 H new ATOM 2119 N SER A 139 -7.652 15.886 -2.700 1.00 0.23 N ATOM 2120 CA SER A 139 -6.464 16.720 -2.790 1.00 0.27 C ATOM 2121 C SER A 139 -5.176 15.935 -2.533 1.00 0.24 C ATOM 2122 O SER A 139 -4.323 15.859 -3.415 1.00 0.26 O ATOM 2123 CB SER A 139 -6.562 17.863 -1.788 1.00 0.35 C ATOM 2124 OG SER A 139 -7.753 18.609 -1.978 1.00 0.43 O ATOM 0 H SER A 139 -8.400 16.284 -2.132 1.00 0.23 H new ATOM 0 HA SER A 139 -6.419 17.106 -3.808 1.00 0.27 H new ATOM 0 HB2 SER A 139 -6.537 17.464 -0.774 1.00 0.35 H new ATOM 0 HB3 SER A 139 -5.698 18.519 -1.894 1.00 0.35 H new ATOM 0 HG SER A 139 -7.792 19.335 -1.321 1.00 0.43 H new ATOM 2130 N LYS A 140 -5.012 15.346 -1.355 1.00 0.21 N ATOM 2131 CA LYS A 140 -3.757 14.656 -1.084 1.00 0.21 C ATOM 2132 C LYS A 140 -3.941 13.265 -0.488 1.00 0.18 C ATOM 2133 O LYS A 140 -3.246 12.334 -0.882 1.00 0.18 O ATOM 2134 CB LYS A 140 -2.887 15.513 -0.164 1.00 0.26 C ATOM 2135 CG LYS A 140 -3.593 15.970 1.092 1.00 0.37 C ATOM 2136 CD LYS A 140 -2.803 17.037 1.815 1.00 0.81 C ATOM 2137 CE LYS A 140 -3.519 17.513 3.068 1.00 1.40 C ATOM 2138 NZ LYS A 140 -2.709 18.502 3.827 1.00 2.02 N ATOM 0 H LYS A 140 -5.699 15.330 -0.601 1.00 0.21 H new ATOM 0 HA LYS A 140 -3.265 14.511 -2.046 1.00 0.21 H new ATOM 0 HB2 LYS A 140 -2.000 14.944 0.115 1.00 0.26 H new ATOM 0 HB3 LYS A 140 -2.544 16.388 -0.716 1.00 0.26 H new ATOM 0 HG2 LYS A 140 -4.579 16.357 0.836 1.00 0.37 H new ATOM 0 HG3 LYS A 140 -3.747 15.118 1.754 1.00 0.37 H new ATOM 0 HD2 LYS A 140 -1.822 16.645 2.083 1.00 0.81 H new ATOM 0 HD3 LYS A 140 -2.637 17.882 1.147 1.00 0.81 H new ATOM 0 HE2 LYS A 140 -4.474 17.961 2.793 1.00 1.40 H new ATOM 0 HE3 LYS A 140 -3.740 16.658 3.707 1.00 1.40 H new ATOM 0 HZ1 LYS A 140 -3.232 18.802 4.674 1.00 2.02 H new ATOM 0 HZ2 LYS A 140 -1.808 18.067 4.112 1.00 2.02 H new ATOM 0 HZ3 LYS A 140 -2.519 19.330 3.226 1.00 2.02 H new ATOM 2152 N GLY A 141 -4.853 13.169 0.482 1.00 0.18 N ATOM 2153 CA GLY A 141 -5.080 11.900 1.180 1.00 0.17 C ATOM 2154 C GLY A 141 -4.878 10.622 0.377 1.00 0.15 C ATOM 2155 O GLY A 141 -5.378 10.446 -0.731 1.00 0.14 O ATOM 0 H GLY A 141 -5.439 13.942 0.799 1.00 0.18 H new ATOM 0 HA2 GLY A 141 -4.416 11.865 2.044 1.00 0.17 H new ATOM 0 HA3 GLY A 141 -6.101 11.902 1.562 1.00 0.17 H new ATOM 2159 N CYS A 142 -4.140 9.730 1.031 1.00 0.14 N ATOM 2160 CA CYS A 142 -3.734 8.430 0.526 1.00 0.13 C ATOM 2161 C CYS A 142 -4.897 7.464 0.445 1.00 0.12 C ATOM 2162 O CYS A 142 -5.959 7.709 1.006 1.00 0.12 O ATOM 2163 CB CYS A 142 -2.607 7.871 1.394 1.00 0.14 C ATOM 2164 SG CYS A 142 -2.909 8.041 3.165 1.00 0.16 S ATOM 0 H CYS A 142 -3.794 9.907 1.974 1.00 0.14 H new ATOM 0 HA CYS A 142 -3.367 8.559 -0.492 1.00 0.13 H new ATOM 0 HB2 CYS A 142 -2.466 6.816 1.157 1.00 0.14 H new ATOM 0 HB3 CYS A 142 -1.678 8.381 1.141 1.00 0.14 H new ATOM 0 HG CYS A 142 -2.128 7.232 3.818 1.00 0.16 H new ATOM 2170 N ILE A 143 -4.671 6.374 -0.280 1.00 0.12 N ATOM 2171 CA ILE A 143 -5.721 5.505 -0.783 1.00 0.11 C ATOM 2172 C ILE A 143 -6.568 4.914 0.344 1.00 0.11 C ATOM 2173 O ILE A 143 -6.211 3.932 0.995 1.00 0.12 O ATOM 2174 CB ILE A 143 -5.086 4.359 -1.600 1.00 0.14 C ATOM 2175 CG1 ILE A 143 -4.212 4.931 -2.724 1.00 0.21 C ATOM 2176 CG2 ILE A 143 -6.160 3.441 -2.160 1.00 0.10 C ATOM 2177 CD1 ILE A 143 -3.258 3.923 -3.332 1.00 0.40 C ATOM 0 H ILE A 143 -3.733 6.066 -0.538 1.00 0.12 H new ATOM 0 HA ILE A 143 -6.378 6.106 -1.411 1.00 0.11 H new ATOM 0 HB ILE A 143 -4.452 3.768 -0.939 1.00 0.14 H new ATOM 0 HG12 ILE A 143 -4.858 5.325 -3.509 1.00 0.21 H new ATOM 0 HG13 ILE A 143 -3.637 5.771 -2.333 1.00 0.21 H new ATOM 0 HG21 ILE A 143 -5.692 2.640 -2.732 1.00 0.10 H new ATOM 0 HG22 ILE A 143 -6.736 3.012 -1.340 1.00 0.10 H new ATOM 0 HG23 ILE A 143 -6.824 4.011 -2.810 1.00 0.10 H new ATOM 0 HD11 ILE A 143 -2.675 4.402 -4.119 1.00 0.40 H new ATOM 0 HD12 ILE A 143 -2.586 3.547 -2.561 1.00 0.40 H new ATOM 0 HD13 ILE A 143 -3.826 3.094 -3.755 1.00 0.40 H new ATOM 2189 N ARG A 144 -7.711 5.560 0.544 1.00 0.12 N ATOM 2190 CA ARG A 144 -8.642 5.214 1.608 1.00 0.12 C ATOM 2191 C ARG A 144 -9.605 4.134 1.134 1.00 0.11 C ATOM 2192 O ARG A 144 -9.955 4.079 -0.042 1.00 0.13 O ATOM 2193 CB ARG A 144 -9.461 6.443 2.028 1.00 0.14 C ATOM 2194 CG ARG A 144 -8.734 7.765 1.876 1.00 0.22 C ATOM 2195 CD ARG A 144 -9.670 8.947 2.062 1.00 0.41 C ATOM 2196 NE ARG A 144 -9.883 9.275 3.469 1.00 0.93 N ATOM 2197 CZ ARG A 144 -10.670 10.270 3.885 1.00 1.19 C ATOM 2198 NH1 ARG A 144 -11.402 10.953 3.013 1.00 1.32 N ATOM 2199 NH2 ARG A 144 -10.737 10.568 5.177 1.00 1.87 N ATOM 0 H ARG A 144 -8.018 6.344 -0.032 1.00 0.12 H new ATOM 0 HA ARG A 144 -8.061 4.851 2.456 1.00 0.12 H new ATOM 0 HB2 ARG A 144 -10.375 6.475 1.435 1.00 0.14 H new ATOM 0 HB3 ARG A 144 -9.761 6.325 3.069 1.00 0.14 H new ATOM 0 HG2 ARG A 144 -7.927 7.822 2.606 1.00 0.22 H new ATOM 0 HG3 ARG A 144 -8.275 7.816 0.889 1.00 0.22 H new ATOM 0 HD2 ARG A 144 -9.259 9.816 1.548 1.00 0.41 H new ATOM 0 HD3 ARG A 144 -10.629 8.724 1.595 1.00 0.41 H new ATOM 0 HE ARG A 144 -9.404 8.713 4.173 1.00 0.93 H new ATOM 0 HH11 ARG A 144 -11.364 10.718 2.021 1.00 1.32 H new ATOM 0 HH12 ARG A 144 -12.002 11.712 3.335 1.00 1.32 H new ATOM 0 HH21 ARG A 144 -10.187 10.037 5.852 1.00 1.87 H new ATOM 0 HH22 ARG A 144 -11.338 11.328 5.495 1.00 1.87 H new ATOM 2213 N MET A 145 -10.030 3.291 2.056 1.00 0.14 N ATOM 2214 CA MET A 145 -11.037 2.285 1.783 1.00 0.13 C ATOM 2215 C MET A 145 -12.139 2.399 2.827 1.00 0.12 C ATOM 2216 O MET A 145 -12.210 3.387 3.558 1.00 0.15 O ATOM 2217 CB MET A 145 -10.464 0.863 1.847 1.00 0.13 C ATOM 2218 CG MET A 145 -9.103 0.677 1.207 1.00 0.45 C ATOM 2219 SD MET A 145 -8.560 -1.039 1.302 1.00 0.79 S ATOM 2220 CE MET A 145 -10.048 -1.886 0.780 1.00 0.24 C ATOM 0 H MET A 145 -9.686 3.285 3.016 1.00 0.14 H new ATOM 0 HA MET A 145 -11.416 2.458 0.776 1.00 0.13 H new ATOM 0 HB2 MET A 145 -10.398 0.564 2.893 1.00 0.13 H new ATOM 0 HB3 MET A 145 -11.168 0.185 1.365 1.00 0.13 H new ATOM 0 HG2 MET A 145 -9.144 0.990 0.164 1.00 0.45 H new ATOM 0 HG3 MET A 145 -8.375 1.319 1.704 1.00 0.45 H new ATOM 0 HE1 MET A 145 -9.786 -2.858 0.362 1.00 0.24 H new ATOM 0 HE2 MET A 145 -10.707 -2.025 1.637 1.00 0.24 H new ATOM 0 HE3 MET A 145 -10.558 -1.291 0.023 1.00 0.24 H new ATOM 2230 N HIS A 146 -12.970 1.382 2.922 1.00 0.15 N ATOM 2231 CA HIS A 146 -13.939 1.292 4.002 1.00 0.16 C ATOM 2232 C HIS A 146 -13.346 0.444 5.131 1.00 0.17 C ATOM 2233 O HIS A 146 -12.434 -0.343 4.887 1.00 0.21 O ATOM 2234 CB HIS A 146 -15.241 0.685 3.474 1.00 0.23 C ATOM 2235 CG HIS A 146 -16.470 1.036 4.258 1.00 0.87 C ATOM 2236 ND1 HIS A 146 -16.841 0.724 5.521 1.00 1.59 N flip ATOM 2237 CD2 HIS A 146 -17.507 1.778 3.734 1.00 1.78 C flip ATOM 2238 CE1 HIS A 146 -18.076 1.275 5.734 1.00 2.22 C flip ATOM 2239 NE2 HIS A 146 -18.455 1.907 4.643 1.00 2.32 N flip ATOM 0 H HIS A 146 -12.996 0.603 2.264 1.00 0.15 H new ATOM 0 HA HIS A 146 -14.166 2.284 4.393 1.00 0.16 H new ATOM 0 HB2 HIS A 146 -15.382 1.008 2.443 1.00 0.23 H new ATOM 0 HB3 HIS A 146 -15.137 -0.400 3.457 1.00 0.23 H new ATOM 0 HD2 HIS A 146 -17.539 2.189 2.736 1.00 1.78 H new ATOM 0 HE1 HIS A 146 -18.647 1.203 6.648 1.00 2.22 H new ATOM 0 HE2 HIS A 146 -19.333 2.411 4.521 1.00 2.32 H new ATOM 2248 N ASN A 147 -13.863 0.593 6.345 1.00 0.17 N ATOM 2249 CA ASN A 147 -13.369 -0.166 7.497 1.00 0.18 C ATOM 2250 C ASN A 147 -13.478 -1.660 7.234 1.00 0.17 C ATOM 2251 O ASN A 147 -12.469 -2.344 7.337 1.00 0.34 O ATOM 2252 CB ASN A 147 -14.098 0.175 8.800 1.00 0.28 C ATOM 2253 CG ASN A 147 -14.442 1.642 8.930 1.00 0.42 C ATOM 2254 OD1 ASN A 147 -15.472 2.093 8.437 1.00 0.68 O ATOM 2255 ND2 ASN A 147 -13.606 2.386 9.628 1.00 0.57 N ATOM 0 H ASN A 147 -14.627 1.234 6.562 1.00 0.17 H new ATOM 0 HA ASN A 147 -12.325 0.119 7.625 1.00 0.18 H new ATOM 0 HB2 ASN A 147 -15.015 -0.412 8.859 1.00 0.28 H new ATOM 0 HB3 ASN A 147 -13.475 -0.121 9.644 1.00 0.28 H new ATOM 0 HD21 ASN A 147 -13.805 3.376 9.775 1.00 0.57 H new ATOM 0 HD22 ASN A 147 -12.761 1.972 10.021 1.00 0.57 H new ATOM 2262 N LYS A 148 -14.611 -2.204 6.864 1.00 0.16 N ATOM 2263 CA LYS A 148 -14.678 -3.661 6.707 1.00 0.18 C ATOM 2264 C LYS A 148 -13.751 -4.172 5.604 1.00 0.17 C ATOM 2265 O LYS A 148 -13.276 -5.304 5.657 1.00 0.20 O ATOM 2266 CB LYS A 148 -16.105 -4.109 6.420 1.00 0.21 C ATOM 2267 CG LYS A 148 -16.699 -3.454 5.195 1.00 0.25 C ATOM 2268 CD LYS A 148 -18.064 -4.020 4.853 1.00 0.34 C ATOM 2269 CE LYS A 148 -18.626 -3.372 3.601 1.00 1.34 C ATOM 2270 NZ LYS A 148 -19.921 -3.973 3.188 1.00 2.18 N ATOM 0 H LYS A 148 -15.474 -1.697 6.669 1.00 0.16 H new ATOM 0 HA LYS A 148 -14.343 -4.090 7.651 1.00 0.18 H new ATOM 0 HB2 LYS A 148 -16.120 -5.191 6.289 1.00 0.21 H new ATOM 0 HB3 LYS A 148 -16.730 -3.884 7.284 1.00 0.21 H new ATOM 0 HG2 LYS A 148 -16.784 -2.380 5.363 1.00 0.25 H new ATOM 0 HG3 LYS A 148 -16.027 -3.592 4.348 1.00 0.25 H new ATOM 0 HD2 LYS A 148 -17.988 -5.097 4.706 1.00 0.34 H new ATOM 0 HD3 LYS A 148 -18.747 -3.860 5.687 1.00 0.34 H new ATOM 0 HE2 LYS A 148 -18.763 -2.305 3.777 1.00 1.34 H new ATOM 0 HE3 LYS A 148 -17.906 -3.471 2.789 1.00 1.34 H new ATOM 0 HZ1 LYS A 148 -20.266 -3.499 2.329 1.00 2.18 H new ATOM 0 HZ2 LYS A 148 -19.787 -4.986 2.994 1.00 2.18 H new ATOM 0 HZ3 LYS A 148 -20.617 -3.856 3.951 1.00 2.18 H new ATOM 2284 N ASP A 149 -13.478 -3.325 4.633 1.00 0.16 N ATOM 2285 CA ASP A 149 -12.670 -3.703 3.477 1.00 0.16 C ATOM 2286 C ASP A 149 -11.182 -3.681 3.824 1.00 0.13 C ATOM 2287 O ASP A 149 -10.432 -4.591 3.470 1.00 0.15 O ATOM 2288 CB ASP A 149 -12.964 -2.757 2.310 1.00 0.23 C ATOM 2289 CG ASP A 149 -14.438 -2.726 1.948 1.00 0.31 C ATOM 2290 OD1 ASP A 149 -15.213 -2.063 2.659 1.00 0.69 O ATOM 2291 OD2 ASP A 149 -14.829 -3.360 0.952 1.00 0.59 O ATOM 0 H ASP A 149 -13.805 -2.359 4.616 1.00 0.16 H new ATOM 0 HA ASP A 149 -12.931 -4.720 3.184 1.00 0.16 H new ATOM 0 HB2 ASP A 149 -12.635 -1.751 2.570 1.00 0.23 H new ATOM 0 HB3 ASP A 149 -12.385 -3.067 1.440 1.00 0.23 H new ATOM 2296 N VAL A 150 -10.774 -2.629 4.516 1.00 0.11 N ATOM 2297 CA VAL A 150 -9.402 -2.479 4.971 1.00 0.10 C ATOM 2298 C VAL A 150 -9.042 -3.527 6.042 1.00 0.10 C ATOM 2299 O VAL A 150 -7.878 -3.878 6.213 1.00 0.10 O ATOM 2300 CB VAL A 150 -9.151 -1.048 5.486 1.00 0.09 C ATOM 2301 CG1 VAL A 150 -9.979 -0.741 6.713 1.00 0.08 C ATOM 2302 CG2 VAL A 150 -7.694 -0.850 5.781 1.00 0.09 C ATOM 0 H VAL A 150 -11.385 -1.855 4.778 1.00 0.11 H new ATOM 0 HA VAL A 150 -8.748 -2.652 4.116 1.00 0.10 H new ATOM 0 HB VAL A 150 -9.455 -0.357 4.700 1.00 0.09 H new ATOM 0 HG11 VAL A 150 -9.774 0.277 7.045 1.00 0.08 H new ATOM 0 HG12 VAL A 150 -11.037 -0.837 6.471 1.00 0.08 H new ATOM 0 HG13 VAL A 150 -9.724 -1.441 7.509 1.00 0.08 H new ATOM 0 HG21 VAL A 150 -7.531 0.165 6.144 1.00 0.09 H new ATOM 0 HG22 VAL A 150 -7.377 -1.563 6.542 1.00 0.09 H new ATOM 0 HG23 VAL A 150 -7.114 -1.008 4.872 1.00 0.09 H new ATOM 2312 N ILE A 151 -10.047 -4.049 6.730 1.00 0.10 N ATOM 2313 CA ILE A 151 -9.859 -5.168 7.639 1.00 0.11 C ATOM 2314 C ILE A 151 -9.862 -6.483 6.859 1.00 0.12 C ATOM 2315 O ILE A 151 -9.040 -7.355 7.153 1.00 0.12 O ATOM 2316 CB ILE A 151 -10.910 -5.224 8.773 1.00 0.13 C ATOM 2317 CG1 ILE A 151 -10.593 -4.229 9.877 1.00 0.15 C ATOM 2318 CG2 ILE A 151 -10.963 -6.614 9.355 1.00 0.15 C ATOM 2319 CD1 ILE A 151 -10.580 -2.797 9.432 1.00 0.38 C ATOM 0 H ILE A 151 -11.008 -3.712 6.674 1.00 0.10 H new ATOM 0 HA ILE A 151 -8.892 -5.017 8.119 1.00 0.11 H new ATOM 0 HB ILE A 151 -11.877 -4.962 8.343 1.00 0.13 H new ATOM 0 HG12 ILE A 151 -11.327 -4.343 10.674 1.00 0.15 H new ATOM 0 HG13 ILE A 151 -9.620 -4.474 10.302 1.00 0.15 H new ATOM 0 HG21 ILE A 151 -11.705 -6.646 10.153 1.00 0.15 H new ATOM 0 HG22 ILE A 151 -11.237 -7.325 8.575 1.00 0.15 H new ATOM 0 HG23 ILE A 151 -9.985 -6.877 9.758 1.00 0.15 H new ATOM 0 HD11 ILE A 151 -10.346 -2.154 10.281 1.00 0.38 H new ATOM 0 HD12 ILE A 151 -9.825 -2.664 8.657 1.00 0.38 H new ATOM 0 HD13 ILE A 151 -11.559 -2.531 9.035 1.00 0.38 H new ATOM 2331 N GLU A 152 -10.751 -6.659 5.887 1.00 0.14 N ATOM 2332 CA GLU A 152 -10.652 -7.812 4.992 1.00 0.18 C ATOM 2333 C GLU A 152 -9.236 -8.011 4.455 1.00 0.17 C ATOM 2334 O GLU A 152 -8.581 -8.990 4.794 1.00 0.17 O ATOM 2335 CB GLU A 152 -11.629 -7.680 3.832 1.00 0.24 C ATOM 2336 CG GLU A 152 -13.016 -8.170 4.184 1.00 0.33 C ATOM 2337 CD GLU A 152 -13.975 -8.099 3.022 1.00 1.07 C ATOM 2338 OE1 GLU A 152 -13.866 -8.929 2.098 1.00 1.07 O ATOM 2339 OE2 GLU A 152 -14.841 -7.200 3.018 1.00 1.99 O ATOM 0 H GLU A 152 -11.534 -6.033 5.699 1.00 0.14 H new ATOM 0 HA GLU A 152 -10.909 -8.690 5.584 1.00 0.18 H new ATOM 0 HB2 GLU A 152 -11.683 -6.636 3.524 1.00 0.24 H new ATOM 0 HB3 GLU A 152 -11.253 -8.245 2.979 1.00 0.24 H new ATOM 0 HG2 GLU A 152 -12.954 -9.200 4.535 1.00 0.33 H new ATOM 0 HG3 GLU A 152 -13.408 -7.575 5.009 1.00 0.33 H new ATOM 2346 N LEU A 153 -8.790 -7.090 3.595 1.00 0.18 N ATOM 2347 CA LEU A 153 -7.446 -7.149 3.011 1.00 0.20 C ATOM 2348 C LEU A 153 -6.390 -7.442 4.078 1.00 0.18 C ATOM 2349 O LEU A 153 -5.474 -8.227 3.872 1.00 0.22 O ATOM 2350 CB LEU A 153 -7.128 -5.835 2.311 1.00 0.22 C ATOM 2351 CG LEU A 153 -7.596 -5.724 0.860 1.00 0.42 C ATOM 2352 CD1 LEU A 153 -9.071 -6.068 0.717 1.00 1.19 C ATOM 2353 CD2 LEU A 153 -7.341 -4.321 0.361 1.00 1.27 C ATOM 0 H LEU A 153 -9.343 -6.291 3.286 1.00 0.18 H new ATOM 0 HA LEU A 153 -7.426 -7.962 2.285 1.00 0.20 H new ATOM 0 HB2 LEU A 153 -7.579 -5.023 2.881 1.00 0.22 H new ATOM 0 HB3 LEU A 153 -6.049 -5.683 2.338 1.00 0.22 H new ATOM 0 HG LEU A 153 -7.033 -6.441 0.263 1.00 0.42 H new ATOM 0 HD11 LEU A 153 -9.366 -5.978 -0.328 1.00 1.19 H new ATOM 0 HD12 LEU A 153 -9.241 -7.090 1.055 1.00 1.19 H new ATOM 0 HD13 LEU A 153 -9.665 -5.383 1.322 1.00 1.19 H new ATOM 0 HD21 LEU A 153 -7.673 -4.237 -0.674 1.00 1.27 H new ATOM 0 HD22 LEU A 153 -7.891 -3.610 0.978 1.00 1.27 H new ATOM 0 HD23 LEU A 153 -6.275 -4.103 0.419 1.00 1.27 H new ATOM 2365 N ALA A 154 -6.594 -6.831 5.230 1.00 0.16 N ATOM 2366 CA ALA A 154 -5.710 -6.990 6.379 1.00 0.16 C ATOM 2367 C ALA A 154 -5.692 -8.431 6.883 1.00 0.16 C ATOM 2368 O ALA A 154 -4.653 -8.899 7.349 1.00 0.18 O ATOM 2369 CB ALA A 154 -6.105 -6.046 7.501 1.00 0.16 C ATOM 0 H ALA A 154 -7.382 -6.206 5.400 1.00 0.16 H new ATOM 0 HA ALA A 154 -4.703 -6.739 6.048 1.00 0.16 H new ATOM 0 HB1 ALA A 154 -5.431 -6.184 8.346 1.00 0.16 H new ATOM 0 HB2 ALA A 154 -6.041 -5.016 7.150 1.00 0.16 H new ATOM 0 HB3 ALA A 154 -7.127 -6.260 7.813 1.00 0.16 H new ATOM 2375 N SER A 155 -6.806 -9.141 6.817 1.00 0.15 N ATOM 2376 CA SER A 155 -6.830 -10.536 7.224 1.00 0.15 C ATOM 2377 C SER A 155 -6.456 -11.483 6.077 1.00 0.15 C ATOM 2378 O SER A 155 -5.886 -12.554 6.307 1.00 0.17 O ATOM 2379 CB SER A 155 -8.222 -10.880 7.746 1.00 0.16 C ATOM 2380 OG SER A 155 -8.254 -12.161 8.350 1.00 0.21 O ATOM 0 H SER A 155 -7.700 -8.777 6.488 1.00 0.15 H new ATOM 0 HA SER A 155 -6.085 -10.670 8.008 1.00 0.15 H new ATOM 0 HB2 SER A 155 -8.535 -10.128 8.471 1.00 0.16 H new ATOM 0 HB3 SER A 155 -8.937 -10.847 6.924 1.00 0.16 H new ATOM 0 HG SER A 155 -9.160 -12.347 8.674 1.00 0.21 H new ATOM 2386 N ILE A 156 -6.769 -11.094 4.843 1.00 0.13 N ATOM 2387 CA ILE A 156 -6.600 -11.981 3.703 1.00 0.13 C ATOM 2388 C ILE A 156 -5.177 -11.957 3.163 1.00 0.13 C ATOM 2389 O ILE A 156 -4.488 -12.977 3.123 1.00 0.15 O ATOM 2390 CB ILE A 156 -7.531 -11.518 2.580 1.00 0.14 C ATOM 2391 CG1 ILE A 156 -8.950 -11.417 3.111 1.00 0.15 C ATOM 2392 CG2 ILE A 156 -7.466 -12.468 1.398 1.00 0.14 C ATOM 2393 CD1 ILE A 156 -9.861 -10.611 2.226 1.00 0.16 C ATOM 0 H ILE A 156 -7.140 -10.172 4.611 1.00 0.13 H new ATOM 0 HA ILE A 156 -6.829 -12.993 4.035 1.00 0.13 H new ATOM 0 HB ILE A 156 -7.208 -10.536 2.233 1.00 0.14 H new ATOM 0 HG12 ILE A 156 -9.360 -12.420 3.225 1.00 0.15 H new ATOM 0 HG13 ILE A 156 -8.928 -10.967 4.104 1.00 0.15 H new ATOM 0 HG21 ILE A 156 -8.136 -12.118 0.613 1.00 0.14 H new ATOM 0 HG22 ILE A 156 -6.446 -12.504 1.015 1.00 0.14 H new ATOM 0 HG23 ILE A 156 -7.769 -13.466 1.716 1.00 0.14 H new ATOM 0 HD11 ILE A 156 -10.859 -10.579 2.664 1.00 0.16 H new ATOM 0 HD12 ILE A 156 -9.473 -9.597 2.132 1.00 0.16 H new ATOM 0 HD13 ILE A 156 -9.912 -11.073 1.240 1.00 0.16 H new ATOM 2405 N VAL A 157 -4.759 -10.777 2.742 1.00 0.13 N ATOM 2406 CA VAL A 157 -3.405 -10.589 2.235 1.00 0.13 C ATOM 2407 C VAL A 157 -2.410 -10.269 3.353 1.00 0.14 C ATOM 2408 O VAL A 157 -2.734 -9.599 4.335 1.00 0.16 O ATOM 2409 CB VAL A 157 -3.333 -9.499 1.136 1.00 0.15 C ATOM 2410 CG1 VAL A 157 -4.410 -9.719 0.089 1.00 0.16 C ATOM 2411 CG2 VAL A 157 -3.427 -8.099 1.716 1.00 0.16 C ATOM 0 H VAL A 157 -5.333 -9.934 2.740 1.00 0.13 H new ATOM 0 HA VAL A 157 -3.123 -11.542 1.786 1.00 0.13 H new ATOM 0 HB VAL A 157 -2.358 -9.587 0.657 1.00 0.15 H new ATOM 0 HG11 VAL A 157 -4.341 -8.942 -0.673 1.00 0.16 H new ATOM 0 HG12 VAL A 157 -4.272 -10.696 -0.375 1.00 0.16 H new ATOM 0 HG13 VAL A 157 -5.391 -9.677 0.562 1.00 0.16 H new ATOM 0 HG21 VAL A 157 -3.372 -7.367 0.910 1.00 0.16 H new ATOM 0 HG22 VAL A 157 -4.374 -7.987 2.244 1.00 0.16 H new ATOM 0 HG23 VAL A 157 -2.603 -7.937 2.410 1.00 0.16 H new ATOM 2421 N PRO A 158 -1.186 -10.797 3.217 1.00 0.14 N ATOM 2422 CA PRO A 158 -0.070 -10.526 4.123 1.00 0.15 C ATOM 2423 C PRO A 158 0.731 -9.317 3.660 1.00 0.13 C ATOM 2424 O PRO A 158 0.472 -8.777 2.583 1.00 0.12 O ATOM 2425 CB PRO A 158 0.760 -11.796 3.969 1.00 0.19 C ATOM 2426 CG PRO A 158 0.613 -12.136 2.522 1.00 0.20 C ATOM 2427 CD PRO A 158 -0.788 -11.724 2.141 1.00 0.17 C ATOM 0 HA PRO A 158 -0.377 -10.303 5.145 1.00 0.15 H new ATOM 0 HB2 PRO A 158 1.803 -11.629 4.238 1.00 0.19 H new ATOM 0 HB3 PRO A 158 0.390 -12.597 4.609 1.00 0.19 H new ATOM 0 HG2 PRO A 158 1.353 -11.609 1.920 1.00 0.20 H new ATOM 0 HG3 PRO A 158 0.766 -13.202 2.354 1.00 0.20 H new ATOM 0 HD2 PRO A 158 -0.811 -11.238 1.165 1.00 0.17 H new ATOM 0 HD3 PRO A 158 -1.457 -12.583 2.085 1.00 0.17 H new ATOM 2435 N ASN A 159 1.687 -8.867 4.464 1.00 0.14 N ATOM 2436 CA ASN A 159 2.527 -7.774 4.013 1.00 0.14 C ATOM 2437 C ASN A 159 3.393 -8.257 2.861 1.00 0.12 C ATOM 2438 O ASN A 159 3.643 -9.458 2.735 1.00 0.11 O ATOM 2439 CB ASN A 159 3.385 -7.215 5.143 1.00 0.19 C ATOM 2440 CG ASN A 159 2.563 -6.742 6.317 1.00 0.46 C ATOM 2441 OD1 ASN A 159 1.421 -6.326 6.155 1.00 1.10 O ATOM 2442 ND2 ASN A 159 3.140 -6.803 7.506 1.00 0.65 N ATOM 0 H ASN A 159 1.893 -9.228 5.396 1.00 0.14 H new ATOM 0 HA ASN A 159 1.888 -6.959 3.673 1.00 0.14 H new ATOM 0 HB2 ASN A 159 4.082 -7.983 5.478 1.00 0.19 H new ATOM 0 HB3 ASN A 159 3.982 -6.385 4.764 1.00 0.19 H new ATOM 0 HD21 ASN A 159 2.632 -6.496 8.336 1.00 0.65 H new ATOM 0 HD22 ASN A 159 4.093 -7.157 7.593 1.00 0.65 H new ATOM 2449 N GLY A 160 3.862 -7.338 2.041 1.00 0.12 N ATOM 2450 CA GLY A 160 4.555 -7.726 0.837 1.00 0.12 C ATOM 2451 C GLY A 160 3.639 -7.757 -0.365 1.00 0.13 C ATOM 2452 O GLY A 160 4.109 -7.764 -1.502 1.00 0.18 O ATOM 0 H GLY A 160 3.776 -6.332 2.186 1.00 0.12 H new ATOM 0 HA2 GLY A 160 5.373 -7.030 0.650 1.00 0.12 H new ATOM 0 HA3 GLY A 160 5.000 -8.711 0.978 1.00 0.12 H new ATOM 2456 N THR A 161 2.327 -7.767 -0.123 1.00 0.11 N ATOM 2457 CA THR A 161 1.369 -7.873 -1.200 1.00 0.10 C ATOM 2458 C THR A 161 1.467 -6.654 -2.101 1.00 0.11 C ATOM 2459 O THR A 161 1.626 -5.523 -1.630 1.00 0.14 O ATOM 2460 CB THR A 161 -0.066 -8.053 -0.657 1.00 0.11 C ATOM 2461 OG1 THR A 161 -0.139 -9.259 0.111 1.00 0.11 O ATOM 2462 CG2 THR A 161 -1.091 -8.115 -1.781 1.00 0.14 C ATOM 0 H THR A 161 1.915 -7.703 0.808 1.00 0.11 H new ATOM 0 HA THR A 161 1.604 -8.760 -1.788 1.00 0.10 H new ATOM 0 HB THR A 161 -0.297 -7.189 -0.033 1.00 0.11 H new ATOM 0 HG1 THR A 161 -0.272 -9.037 1.056 1.00 0.11 H new ATOM 0 HG21 THR A 161 -2.088 -8.242 -1.358 1.00 0.14 H new ATOM 0 HG22 THR A 161 -1.056 -7.190 -2.357 1.00 0.14 H new ATOM 0 HG23 THR A 161 -0.864 -8.957 -2.434 1.00 0.14 H new ATOM 2470 N ARG A 162 1.368 -6.891 -3.393 1.00 0.12 N ATOM 2471 CA ARG A 162 1.648 -5.856 -4.368 1.00 0.16 C ATOM 2472 C ARG A 162 0.395 -5.121 -4.774 1.00 0.16 C ATOM 2473 O ARG A 162 -0.602 -5.700 -5.209 1.00 0.19 O ATOM 2474 CB ARG A 162 2.375 -6.409 -5.599 1.00 0.26 C ATOM 2475 CG ARG A 162 2.497 -7.921 -5.622 1.00 0.73 C ATOM 2476 CD ARG A 162 3.114 -8.423 -6.917 1.00 1.11 C ATOM 2477 NE ARG A 162 3.142 -9.886 -6.963 1.00 2.03 N ATOM 2478 CZ ARG A 162 3.096 -10.603 -8.085 1.00 2.63 C ATOM 2479 NH1 ARG A 162 3.068 -9.998 -9.267 1.00 2.64 N ATOM 2480 NH2 ARG A 162 3.087 -11.932 -8.022 1.00 3.63 N ATOM 0 H ARG A 162 1.096 -7.789 -3.792 1.00 0.12 H new ATOM 0 HA ARG A 162 2.315 -5.143 -3.883 1.00 0.16 H new ATOM 0 HB2 ARG A 162 1.846 -6.085 -6.495 1.00 0.26 H new ATOM 0 HB3 ARG A 162 3.374 -5.974 -5.643 1.00 0.26 H new ATOM 0 HG2 ARG A 162 3.106 -8.248 -4.779 1.00 0.73 H new ATOM 0 HG3 ARG A 162 1.510 -8.366 -5.494 1.00 0.73 H new ATOM 0 HD2 ARG A 162 2.545 -8.042 -7.765 1.00 1.11 H new ATOM 0 HD3 ARG A 162 4.128 -8.035 -7.013 1.00 1.11 H new ATOM 0 HE ARG A 162 3.201 -10.389 -6.078 1.00 2.03 H new ATOM 0 HH11 ARG A 162 3.082 -8.979 -9.319 1.00 2.64 H new ATOM 0 HH12 ARG A 162 3.033 -10.552 -10.123 1.00 2.64 H new ATOM 0 HH21 ARG A 162 3.115 -12.400 -7.116 1.00 3.63 H new ATOM 0 HH22 ARG A 162 3.052 -12.483 -8.880 1.00 3.63 H new ATOM 2494 N VAL A 163 0.503 -3.813 -4.596 1.00 0.14 N ATOM 2495 CA VAL A 163 -0.570 -2.885 -4.836 1.00 0.13 C ATOM 2496 C VAL A 163 -0.224 -2.025 -6.042 1.00 0.13 C ATOM 2497 O VAL A 163 0.663 -1.174 -5.980 1.00 0.14 O ATOM 2498 CB VAL A 163 -0.794 -2.010 -3.591 1.00 0.13 C ATOM 2499 CG1 VAL A 163 -1.700 -0.842 -3.893 1.00 0.13 C ATOM 2500 CG2 VAL A 163 -1.349 -2.846 -2.453 1.00 0.13 C ATOM 0 H VAL A 163 1.361 -3.367 -4.273 1.00 0.14 H new ATOM 0 HA VAL A 163 -1.492 -3.430 -5.040 1.00 0.13 H new ATOM 0 HB VAL A 163 0.170 -1.604 -3.286 1.00 0.13 H new ATOM 0 HG11 VAL A 163 -1.837 -0.245 -2.991 1.00 0.13 H new ATOM 0 HG12 VAL A 163 -1.251 -0.225 -4.672 1.00 0.13 H new ATOM 0 HG13 VAL A 163 -2.667 -1.211 -4.234 1.00 0.13 H new ATOM 0 HG21 VAL A 163 -1.503 -2.214 -1.578 1.00 0.13 H new ATOM 0 HG22 VAL A 163 -2.300 -3.286 -2.755 1.00 0.13 H new ATOM 0 HG23 VAL A 163 -0.644 -3.640 -2.207 1.00 0.13 H new ATOM 2510 N THR A 164 -0.891 -2.277 -7.143 1.00 0.12 N ATOM 2511 CA THR A 164 -0.511 -1.656 -8.396 1.00 0.13 C ATOM 2512 C THR A 164 -1.307 -0.394 -8.695 1.00 0.14 C ATOM 2513 O THR A 164 -2.467 -0.458 -9.076 1.00 0.16 O ATOM 2514 CB THR A 164 -0.684 -2.641 -9.554 1.00 0.16 C ATOM 2515 OG1 THR A 164 -0.126 -3.912 -9.195 1.00 0.21 O ATOM 2516 CG2 THR A 164 0.001 -2.109 -10.803 1.00 0.20 C ATOM 0 H THR A 164 -1.694 -2.903 -7.201 1.00 0.12 H new ATOM 0 HA THR A 164 0.536 -1.373 -8.293 1.00 0.13 H new ATOM 0 HB THR A 164 -1.747 -2.761 -9.761 1.00 0.16 H new ATOM 0 HG1 THR A 164 -0.726 -4.367 -8.568 1.00 0.21 H new ATOM 0 HG21 THR A 164 -0.129 -2.819 -11.620 1.00 0.20 H new ATOM 0 HG22 THR A 164 -0.440 -1.152 -11.080 1.00 0.20 H new ATOM 0 HG23 THR A 164 1.064 -1.974 -10.605 1.00 0.20 H new ATOM 2524 N ILE A 165 -0.650 0.734 -8.563 1.00 0.14 N ATOM 2525 CA ILE A 165 -1.258 2.021 -8.846 1.00 0.14 C ATOM 2526 C ILE A 165 -1.241 2.284 -10.348 1.00 0.16 C ATOM 2527 O ILE A 165 -0.204 2.544 -10.955 1.00 0.24 O ATOM 2528 CB ILE A 165 -0.575 3.180 -8.078 1.00 0.16 C ATOM 2529 CG1 ILE A 165 -0.952 3.141 -6.593 1.00 0.16 C ATOM 2530 CG2 ILE A 165 -0.941 4.527 -8.687 1.00 0.19 C ATOM 2531 CD1 ILE A 165 -0.296 2.016 -5.818 1.00 0.15 C ATOM 0 H ILE A 165 0.321 0.790 -8.257 1.00 0.14 H new ATOM 0 HA ILE A 165 -2.290 1.981 -8.497 1.00 0.14 H new ATOM 0 HB ILE A 165 0.504 3.051 -8.163 1.00 0.16 H new ATOM 0 HG12 ILE A 165 -0.679 4.091 -6.135 1.00 0.16 H new ATOM 0 HG13 ILE A 165 -2.034 3.045 -6.506 1.00 0.16 H new ATOM 0 HG21 ILE A 165 -0.449 5.324 -8.130 1.00 0.19 H new ATOM 0 HG22 ILE A 165 -0.615 4.557 -9.727 1.00 0.19 H new ATOM 0 HG23 ILE A 165 -2.021 4.666 -8.641 1.00 0.19 H new ATOM 0 HD11 ILE A 165 -0.614 2.058 -4.776 1.00 0.15 H new ATOM 0 HD12 ILE A 165 -0.589 1.058 -6.248 1.00 0.15 H new ATOM 0 HD13 ILE A 165 0.788 2.121 -5.871 1.00 0.15 H new ATOM 2543 N ASN A 166 -2.417 2.183 -10.928 1.00 0.16 N ATOM 2544 CA ASN A 166 -2.612 2.349 -12.355 1.00 0.19 C ATOM 2545 C ASN A 166 -3.362 3.628 -12.628 1.00 0.18 C ATOM 2546 O ASN A 166 -4.427 3.858 -12.064 1.00 0.18 O ATOM 2547 CB ASN A 166 -3.425 1.185 -12.925 1.00 0.29 C ATOM 2548 CG ASN A 166 -2.582 0.008 -13.344 1.00 0.48 C ATOM 2549 OD1 ASN A 166 -2.389 -0.931 -12.438 1.00 1.09 O flip ATOM 2550 ND2 ASN A 166 -2.131 -0.070 -14.485 1.00 0.68 N flip ATOM 0 H ASN A 166 -3.276 1.981 -10.417 1.00 0.16 H new ATOM 0 HA ASN A 166 -1.630 2.379 -12.828 1.00 0.19 H new ATOM 0 HB2 ASN A 166 -4.147 0.856 -12.177 1.00 0.29 H new ATOM 0 HB3 ASN A 166 -3.995 1.537 -13.785 1.00 0.29 H new ATOM 0 HD21 ASN A 166 -2.305 0.680 -15.154 1.00 0.68 H new ATOM 0 HD22 ASN A 166 -1.583 -0.885 -14.762 1.00 0.68 H new ATOM 2557 N ARG A 167 -2.821 4.450 -13.505 1.00 0.22 N ATOM 2558 CA ARG A 167 -3.499 5.668 -13.917 1.00 0.28 C ATOM 2559 C ARG A 167 -4.692 5.328 -14.800 1.00 0.36 C ATOM 2560 O ARG A 167 -5.575 6.153 -15.023 1.00 0.67 O ATOM 2561 CB ARG A 167 -2.541 6.588 -14.662 1.00 0.31 C ATOM 2562 CG ARG A 167 -1.492 7.224 -13.776 1.00 0.46 C ATOM 2563 CD ARG A 167 -1.975 8.556 -13.245 1.00 0.52 C ATOM 2564 NE ARG A 167 -2.447 9.424 -14.323 1.00 1.06 N ATOM 2565 CZ ARG A 167 -1.825 10.523 -14.752 1.00 1.49 C ATOM 2566 NH1 ARG A 167 -0.699 10.933 -14.183 1.00 1.92 N ATOM 2567 NH2 ARG A 167 -2.348 11.219 -15.753 1.00 2.08 N ATOM 0 H ARG A 167 -1.914 4.299 -13.947 1.00 0.22 H new ATOM 0 HA ARG A 167 -3.853 6.186 -13.026 1.00 0.28 H new ATOM 0 HB2 ARG A 167 -2.043 6.020 -15.448 1.00 0.31 H new ATOM 0 HB3 ARG A 167 -3.115 7.375 -15.152 1.00 0.31 H new ATOM 0 HG2 ARG A 167 -1.259 6.559 -12.945 1.00 0.46 H new ATOM 0 HG3 ARG A 167 -0.570 7.365 -14.340 1.00 0.46 H new ATOM 0 HD2 ARG A 167 -2.780 8.393 -12.529 1.00 0.52 H new ATOM 0 HD3 ARG A 167 -1.165 9.050 -12.707 1.00 0.52 H new ATOM 0 HE ARG A 167 -3.321 9.169 -14.783 1.00 1.06 H new ATOM 0 HH11 ARG A 167 -0.298 10.406 -13.407 1.00 1.92 H new ATOM 0 HH12 ARG A 167 -0.234 11.775 -14.521 1.00 1.92 H new ATOM 0 HH21 ARG A 167 -3.218 10.912 -16.187 1.00 2.08 H new ATOM 0 HH22 ARG A 167 -1.880 12.061 -16.088 1.00 2.08 H new