USER MOD reduce.3.24.130724 H: found=0, std=0, add=982, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 983 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 14 TYR OH : rot 145:sc= 0.945 USER MOD Set 1.2: A 115 GLN : amide:sc= -7.43! C(o=-4.7!,f=-6.4!) USER MOD Set 1.3: A 117 TYR OH : rot -28:sc= 1.75 USER MOD Single : A 1 ALA N :NH3+ -120:sc= 0.238 (180deg=0) USER MOD Single : A 5 THR OG1 : rot -93:sc= -7.71! USER MOD Single : A 7 LYS NZ :NH3+ -156:sc= -2.24! (180deg=-3.84!) USER MOD Single : A 11 ASN : amide:sc= -0.0311 X(o=-0.031,f=-0.11) USER MOD Single : A 13 ASN : amide:sc= -1.77 K(o=-1.8,f=-2.4) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 MET CE :methyl -127:sc= -3.61! (180deg=-8.49!) USER MOD Single : A 20 LYS NZ :NH3+ 129:sc= -0.0755 (180deg=-1.64!) USER MOD Single : A 21 MET CE :methyl -129:sc= -2.64 (180deg=-8.47!) USER MOD Single : A 24 ASN : amide:sc= -0.514 K(o=-0.51,f=-1.4!) USER MOD Single : A 27 LYS NZ :NH3+ -146:sc= 0.00743 (180deg=0) USER MOD Single : A 37 LYS NZ :NH3+ 178:sc= -0.0113 (180deg=-0.0217) USER MOD Single : A 39 THR OG1 : rot -178:sc= -6.89! USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 GLN : amide:sc= -0.165 K(o=-0.17,f=-1.3!) USER MOD Single : A 45 ASN : amide:sc= -0.0139 X(o=-0.014,f=0) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 THR OG1 : rot 180:sc= 0 USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 SER OG : rot -27:sc= 0.529 USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 54 ASN : amide:sc= -0.372 X(o=-0.37,f=-0.44) USER MOD Single : A 57 ASN : amide:sc= -0.655 K(o=-0.66,f=-1.2) USER MOD Single : A 70 TYR OH : rot 180:sc= 0.191 USER MOD Single : A 71 SER OG : rot 180:sc= 0.439 USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 THR OG1 : rot -70:sc= -3.24! USER MOD Single : A 81 THR OG1 : rot -176:sc= -1.79 USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 87 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 ASN : amide:sc= 0 X(o=0,f=-0.0059) USER MOD Single : A 100 LYS NZ :NH3+ 162:sc= 0.00748 (180deg=-0.475) USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 111 ASN : amide:sc= -0.99 K(o=-0.99,f=-4.5!) USER MOD Single : A 116 THR OG1 : rot -58:sc= 1.07 USER MOD Single : A 118 THR OG1 : rot 180:sc= -0.245 USER MOD Single : A 119 TYR OH : rot 150:sc= -2.88! USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 3.175 7.224 3.658 1.00 0.00 N ATOM 2 CA ALA A 1 3.652 8.572 3.757 1.00 0.00 C ATOM 3 C ALA A 1 5.169 8.535 3.441 1.00 0.00 C ATOM 4 O ALA A 1 5.563 7.593 2.773 1.00 0.00 O ATOM 5 CB ALA A 1 3.411 9.013 5.182 1.00 0.00 C ATOM 0 H1 ALA A 1 2.439 7.169 2.925 1.00 0.00 H new ATOM 0 H2 ALA A 1 3.963 6.595 3.405 1.00 0.00 H new ATOM 0 H3 ALA A 1 2.776 6.929 4.572 1.00 0.00 H new ATOM 0 HA ALA A 1 3.155 9.259 3.072 1.00 0.00 H new ATOM 0 HB1 ALA A 1 3.759 10.038 5.309 1.00 0.00 H new ATOM 0 HB2 ALA A 1 2.345 8.961 5.403 1.00 0.00 H new ATOM 0 HB3 ALA A 1 3.955 8.358 5.863 1.00 0.00 H new ATOM 13 N PHE A 2 5.966 9.513 3.902 1.00 0.00 N ATOM 14 CA PHE A 2 7.427 9.600 3.687 1.00 0.00 C ATOM 15 C PHE A 2 7.926 9.506 2.238 1.00 0.00 C ATOM 16 O PHE A 2 9.083 9.859 2.007 1.00 0.00 O ATOM 17 CB PHE A 2 8.329 8.561 4.425 1.00 0.00 C ATOM 18 CG PHE A 2 7.771 8.006 5.697 1.00 0.00 C ATOM 19 CD1 PHE A 2 6.661 7.194 5.759 1.00 0.00 C ATOM 20 CD2 PHE A 2 8.415 8.306 6.899 1.00 0.00 C ATOM 21 CE1 PHE A 2 6.221 6.704 6.984 1.00 0.00 C ATOM 22 CE2 PHE A 2 8.003 7.832 8.130 1.00 0.00 C ATOM 23 CZ PHE A 2 6.892 7.023 8.155 1.00 0.00 C ATOM 0 H PHE A 2 5.603 10.291 4.453 1.00 0.00 H new ATOM 0 HA PHE A 2 7.535 10.602 4.102 1.00 0.00 H new ATOM 0 HB2 PHE A 2 8.528 7.733 3.745 1.00 0.00 H new ATOM 0 HB3 PHE A 2 9.288 9.031 4.645 1.00 0.00 H new ATOM 0 HD1 PHE A 2 6.131 6.937 4.854 1.00 0.00 H new ATOM 0 HD2 PHE A 2 9.285 8.945 6.865 1.00 0.00 H new ATOM 0 HE1 PHE A 2 5.348 6.069 7.024 1.00 0.00 H new ATOM 0 HE2 PHE A 2 8.533 8.087 9.036 1.00 0.00 H new ATOM 0 HZ PHE A 2 6.538 6.631 9.097 1.00 0.00 H new ATOM 33 N ASP A 3 7.167 9.071 1.252 1.00 0.00 N ATOM 34 CA ASP A 3 7.690 9.003 -0.135 1.00 0.00 C ATOM 35 C ASP A 3 8.202 10.346 -0.561 1.00 0.00 C ATOM 36 O ASP A 3 7.415 11.309 -0.515 1.00 0.00 O ATOM 37 CB ASP A 3 6.671 8.449 -1.141 1.00 0.00 C ATOM 38 CG ASP A 3 5.291 8.968 -0.840 1.00 0.00 C ATOM 39 OD1 ASP A 3 5.020 9.788 0.022 1.00 0.00 O ATOM 40 OD2 ASP A 3 4.373 8.451 -1.612 1.00 0.00 O ATOM 0 H ASP A 3 6.202 8.760 1.362 1.00 0.00 H new ATOM 0 HA ASP A 3 8.516 8.292 -0.129 1.00 0.00 H new ATOM 0 HB2 ASP A 3 6.959 8.734 -2.153 1.00 0.00 H new ATOM 0 HB3 ASP A 3 6.671 7.360 -1.104 1.00 0.00 H new ATOM 45 N GLY A 4 9.457 10.400 -0.949 1.00 0.00 N ATOM 46 CA GLY A 4 10.061 11.628 -1.355 1.00 0.00 C ATOM 47 C GLY A 4 11.208 12.113 -0.444 1.00 0.00 C ATOM 48 O GLY A 4 11.421 11.440 0.536 1.00 0.00 O ATOM 0 H GLY A 4 10.077 9.591 -0.988 1.00 0.00 H new ATOM 0 HA2 GLY A 4 10.445 11.511 -2.369 1.00 0.00 H new ATOM 0 HA3 GLY A 4 9.293 12.400 -1.392 1.00 0.00 H new ATOM 52 N THR A 5 11.754 13.222 -0.862 1.00 0.00 N ATOM 53 CA THR A 5 12.760 14.005 -0.256 1.00 0.00 C ATOM 54 C THR A 5 12.263 14.406 1.100 1.00 0.00 C ATOM 55 O THR A 5 11.072 14.277 1.324 1.00 0.00 O ATOM 56 CB THR A 5 13.115 15.215 -1.161 1.00 0.00 C ATOM 57 OG1 THR A 5 11.820 15.849 -1.161 1.00 0.00 O ATOM 58 CG2 THR A 5 13.481 14.746 -2.550 1.00 0.00 C ATOM 0 H THR A 5 11.457 13.636 -1.746 1.00 0.00 H new ATOM 0 HA THR A 5 13.687 13.445 -0.134 1.00 0.00 H new ATOM 0 HB THR A 5 13.955 15.832 -0.842 1.00 0.00 H new ATOM 0 HG1 THR A 5 11.305 15.541 -1.936 1.00 0.00 H new ATOM 0 HG21 THR A 5 13.727 15.607 -3.172 1.00 0.00 H new ATOM 0 HG22 THR A 5 14.343 14.081 -2.494 1.00 0.00 H new ATOM 0 HG23 THR A 5 12.638 14.212 -2.988 1.00 0.00 H new ATOM 66 N TRP A 6 13.242 14.821 1.832 1.00 0.00 N ATOM 67 CA TRP A 6 13.146 15.180 3.217 1.00 0.00 C ATOM 68 C TRP A 6 14.528 15.644 3.639 1.00 0.00 C ATOM 69 O TRP A 6 15.400 15.395 2.834 1.00 0.00 O ATOM 70 CB TRP A 6 13.068 13.735 3.809 1.00 0.00 C ATOM 71 CG TRP A 6 11.677 13.242 3.760 1.00 0.00 C ATOM 72 CD1 TRP A 6 11.285 11.990 3.475 1.00 0.00 C ATOM 73 CD2 TRP A 6 10.414 13.906 3.941 1.00 0.00 C ATOM 74 NE1 TRP A 6 9.938 11.813 3.460 1.00 0.00 N ATOM 75 CE2 TRP A 6 9.347 12.989 3.736 1.00 0.00 C ATOM 76 CE3 TRP A 6 10.015 15.211 4.253 1.00 0.00 C ATOM 77 CZ2 TRP A 6 8.014 13.290 3.814 1.00 0.00 C ATOM 78 CZ3 TRP A 6 8.675 15.510 4.336 1.00 0.00 C ATOM 79 CH2 TRP A 6 7.684 14.566 4.117 1.00 0.00 C ATOM 0 H TRP A 6 14.187 14.927 1.463 1.00 0.00 H new ATOM 0 HA TRP A 6 12.373 15.904 3.475 1.00 0.00 H new ATOM 0 HB2 TRP A 6 13.719 13.067 3.245 1.00 0.00 H new ATOM 0 HB3 TRP A 6 13.426 13.735 4.839 1.00 0.00 H new ATOM 0 HD1 TRP A 6 11.982 11.190 3.274 1.00 0.00 H new ATOM 0 HE1 TRP A 6 9.455 10.935 3.271 1.00 0.00 H new ATOM 0 HE3 TRP A 6 10.755 15.978 4.427 1.00 0.00 H new ATOM 0 HZ2 TRP A 6 7.257 12.539 3.641 1.00 0.00 H new ATOM 0 HZ3 TRP A 6 8.383 16.520 4.582 1.00 0.00 H new ATOM 0 HH2 TRP A 6 6.645 14.850 4.189 1.00 0.00 H new ATOM 90 N LYS A 7 14.778 16.223 4.780 1.00 0.00 N ATOM 91 CA LYS A 7 16.122 16.735 5.054 1.00 0.00 C ATOM 92 C LYS A 7 16.210 16.797 6.553 1.00 0.00 C ATOM 93 O LYS A 7 15.715 15.892 7.213 1.00 0.00 O ATOM 94 CB LYS A 7 16.210 18.102 4.342 1.00 0.00 C ATOM 95 CG LYS A 7 15.571 18.111 2.977 1.00 0.00 C ATOM 96 CD LYS A 7 15.732 19.281 2.020 1.00 0.00 C ATOM 97 CE LYS A 7 17.142 19.920 1.935 1.00 0.00 C ATOM 98 NZ LYS A 7 17.134 21.408 1.941 1.00 0.00 N ATOM 0 H LYS A 7 14.098 16.358 5.528 1.00 0.00 H new ATOM 0 HA LYS A 7 16.956 16.135 4.691 1.00 0.00 H new ATOM 0 HB2 LYS A 7 15.731 18.858 4.964 1.00 0.00 H new ATOM 0 HB3 LYS A 7 17.258 18.386 4.246 1.00 0.00 H new ATOM 0 HG2 LYS A 7 15.933 17.226 2.455 1.00 0.00 H new ATOM 0 HG3 LYS A 7 14.500 17.975 3.130 1.00 0.00 H new ATOM 0 HD2 LYS A 7 15.449 18.946 1.022 1.00 0.00 H new ATOM 0 HD3 LYS A 7 15.023 20.057 2.309 1.00 0.00 H new ATOM 0 HE2 LYS A 7 17.741 19.567 2.775 1.00 0.00 H new ATOM 0 HE3 LYS A 7 17.632 19.573 1.025 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 18.001 21.762 1.489 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 16.305 21.753 1.416 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 17.090 21.751 2.922 1.00 0.00 H new ATOM 112 N VAL A 8 16.812 17.868 7.001 1.00 0.00 N ATOM 113 CA VAL A 8 16.859 18.086 8.409 1.00 0.00 C ATOM 114 C VAL A 8 16.998 19.608 8.600 1.00 0.00 C ATOM 115 O VAL A 8 17.978 20.063 9.139 1.00 0.00 O ATOM 116 CB VAL A 8 17.794 17.230 9.236 1.00 0.00 C ATOM 117 CG1 VAL A 8 17.813 17.740 10.689 1.00 0.00 C ATOM 118 CG2 VAL A 8 17.459 15.715 9.244 1.00 0.00 C ATOM 0 H VAL A 8 17.262 18.580 6.425 1.00 0.00 H new ATOM 0 HA VAL A 8 15.931 17.715 8.845 1.00 0.00 H new ATOM 0 HB VAL A 8 18.769 17.325 8.758 1.00 0.00 H new ATOM 0 HG11 VAL A 8 18.487 17.122 11.283 1.00 0.00 H new ATOM 0 HG12 VAL A 8 18.158 18.774 10.707 1.00 0.00 H new ATOM 0 HG13 VAL A 8 16.808 17.685 11.107 1.00 0.00 H new ATOM 0 HG21 VAL A 8 18.184 15.185 9.863 1.00 0.00 H new ATOM 0 HG22 VAL A 8 16.458 15.566 9.649 1.00 0.00 H new ATOM 0 HG23 VAL A 8 17.500 15.328 8.226 1.00 0.00 H new ATOM 128 N ASP A 9 15.967 20.274 8.084 1.00 0.00 N ATOM 129 CA ASP A 9 15.811 21.703 8.030 1.00 0.00 C ATOM 130 C ASP A 9 16.324 22.382 9.312 1.00 0.00 C ATOM 131 O ASP A 9 16.905 23.443 9.278 1.00 0.00 O ATOM 132 CB ASP A 9 14.288 21.955 8.053 1.00 0.00 C ATOM 133 CG ASP A 9 13.775 23.233 7.488 1.00 0.00 C ATOM 134 OD1 ASP A 9 14.529 24.088 7.092 1.00 0.00 O ATOM 135 OD2 ASP A 9 12.461 23.344 7.471 1.00 0.00 O ATOM 0 H ASP A 9 15.173 19.786 7.669 1.00 0.00 H new ATOM 0 HA ASP A 9 16.346 22.085 7.160 1.00 0.00 H new ATOM 0 HB2 ASP A 9 13.808 21.137 7.515 1.00 0.00 H new ATOM 0 HB3 ASP A 9 13.957 21.893 9.090 1.00 0.00 H new ATOM 140 N ARG A 10 16.024 21.677 10.391 1.00 0.00 N ATOM 141 CA ARG A 10 16.407 22.229 11.628 1.00 0.00 C ATOM 142 C ARG A 10 17.026 21.181 12.492 1.00 0.00 C ATOM 143 O ARG A 10 17.094 20.013 12.057 1.00 0.00 O ATOM 144 CB ARG A 10 15.150 22.867 12.234 1.00 0.00 C ATOM 145 CG ARG A 10 13.831 22.563 11.557 1.00 0.00 C ATOM 146 CD ARG A 10 13.415 23.687 10.599 1.00 0.00 C ATOM 147 NE ARG A 10 12.887 24.827 11.344 1.00 0.00 N ATOM 148 CZ ARG A 10 11.599 25.228 11.419 1.00 0.00 C ATOM 149 NH1 ARG A 10 10.628 24.601 10.799 1.00 0.00 N ATOM 150 NH2 ARG A 10 11.273 26.305 12.145 1.00 0.00 N ATOM 0 H ARG A 10 15.545 20.777 10.416 1.00 0.00 H new ATOM 0 HA ARG A 10 17.173 22.997 11.520 1.00 0.00 H new ATOM 0 HB2 ARG A 10 15.078 22.551 13.275 1.00 0.00 H new ATOM 0 HB3 ARG A 10 15.287 23.948 12.238 1.00 0.00 H new ATOM 0 HG2 ARG A 10 13.912 21.626 11.006 1.00 0.00 H new ATOM 0 HG3 ARG A 10 13.058 22.423 12.312 1.00 0.00 H new ATOM 0 HD2 ARG A 10 14.272 24.000 10.003 1.00 0.00 H new ATOM 0 HD3 ARG A 10 12.661 23.319 9.903 1.00 0.00 H new ATOM 0 HE ARG A 10 13.566 25.382 11.865 1.00 0.00 H new ATOM 0 HH11 ARG A 10 10.832 23.777 10.234 1.00 0.00 H new ATOM 0 HH12 ARG A 10 9.669 24.937 10.882 1.00 0.00 H new ATOM 0 HH21 ARG A 10 11.997 26.823 12.642 1.00 0.00 H new ATOM 0 HH22 ARG A 10 10.300 26.607 12.201 1.00 0.00 H new ATOM 164 N ASN A 11 17.479 21.522 13.673 1.00 0.00 N ATOM 165 CA ASN A 11 18.081 20.485 14.471 1.00 0.00 C ATOM 166 C ASN A 11 18.035 20.724 15.949 1.00 0.00 C ATOM 167 O ASN A 11 18.547 21.721 16.493 1.00 0.00 O ATOM 168 CB ASN A 11 19.569 20.337 14.060 1.00 0.00 C ATOM 169 CG ASN A 11 20.142 21.527 13.344 1.00 0.00 C ATOM 170 OD1 ASN A 11 20.155 22.645 13.829 1.00 0.00 O ATOM 171 ND2 ASN A 11 20.626 21.283 12.152 1.00 0.00 N ATOM 0 H ASN A 11 17.447 22.454 14.085 1.00 0.00 H new ATOM 0 HA ASN A 11 17.495 19.586 14.279 1.00 0.00 H new ATOM 0 HB2 ASN A 11 20.162 20.148 14.955 1.00 0.00 H new ATOM 0 HB3 ASN A 11 19.670 19.461 13.419 1.00 0.00 H new ATOM 0 HD21 ASN A 11 21.029 22.040 11.600 1.00 0.00 H new ATOM 0 HD22 ASN A 11 20.600 20.336 11.775 1.00 0.00 H new ATOM 178 N GLU A 12 17.397 19.772 16.620 1.00 0.00 N ATOM 179 CA GLU A 12 17.254 19.829 18.079 1.00 0.00 C ATOM 180 C GLU A 12 17.912 18.606 18.712 1.00 0.00 C ATOM 181 O GLU A 12 17.681 17.484 18.280 1.00 0.00 O ATOM 182 CB GLU A 12 15.795 19.933 18.560 1.00 0.00 C ATOM 183 CG GLU A 12 15.476 20.874 19.745 1.00 0.00 C ATOM 184 CD GLU A 12 16.339 20.679 20.970 1.00 0.00 C ATOM 185 OE1 GLU A 12 16.178 19.762 21.753 1.00 0.00 O ATOM 186 OE2 GLU A 12 17.265 21.573 21.107 1.00 0.00 O ATOM 0 H GLU A 12 16.971 18.954 16.185 1.00 0.00 H new ATOM 0 HA GLU A 12 17.751 20.746 18.396 1.00 0.00 H new ATOM 0 HB2 GLU A 12 15.188 20.250 17.712 1.00 0.00 H new ATOM 0 HB3 GLU A 12 15.463 18.931 18.833 1.00 0.00 H new ATOM 0 HG2 GLU A 12 15.579 21.905 19.408 1.00 0.00 H new ATOM 0 HG3 GLU A 12 14.433 20.734 20.029 1.00 0.00 H new ATOM 193 N ASN A 13 18.734 18.823 19.733 1.00 0.00 N ATOM 194 CA ASN A 13 19.403 17.686 20.376 1.00 0.00 C ATOM 195 C ASN A 13 20.313 16.974 19.362 1.00 0.00 C ATOM 196 O ASN A 13 20.861 15.935 19.653 1.00 0.00 O ATOM 197 CB ASN A 13 18.391 16.732 21.019 1.00 0.00 C ATOM 198 CG ASN A 13 18.211 17.033 22.499 1.00 0.00 C ATOM 199 OD1 ASN A 13 18.068 16.163 23.342 1.00 0.00 O ATOM 200 ND2 ASN A 13 18.215 18.327 22.805 1.00 0.00 N ATOM 0 H ASN A 13 18.951 19.739 20.126 1.00 0.00 H new ATOM 0 HA ASN A 13 20.030 18.058 21.187 1.00 0.00 H new ATOM 0 HB2 ASN A 13 17.432 16.818 20.509 1.00 0.00 H new ATOM 0 HB3 ASN A 13 18.727 15.703 20.893 1.00 0.00 H new ATOM 0 HD21 ASN A 13 18.096 18.622 23.774 1.00 0.00 H new ATOM 0 HD22 ASN A 13 18.337 19.024 22.071 1.00 0.00 H new ATOM 207 N TYR A 14 20.497 17.506 18.147 1.00 0.00 N ATOM 208 CA TYR A 14 21.348 16.845 17.159 1.00 0.00 C ATOM 209 C TYR A 14 22.834 16.779 17.419 1.00 0.00 C ATOM 210 O TYR A 14 23.520 15.804 17.136 1.00 0.00 O ATOM 211 CB TYR A 14 20.885 17.358 15.779 1.00 0.00 C ATOM 212 CG TYR A 14 21.087 16.463 14.631 1.00 0.00 C ATOM 213 CD1 TYR A 14 22.376 16.166 14.182 1.00 0.00 C ATOM 214 CD2 TYR A 14 20.005 15.889 13.961 1.00 0.00 C ATOM 215 CE1 TYR A 14 22.615 15.321 13.095 1.00 0.00 C ATOM 216 CE2 TYR A 14 20.189 15.042 12.878 1.00 0.00 C ATOM 217 CZ TYR A 14 21.492 14.771 12.463 1.00 0.00 C ATOM 218 OH TYR A 14 21.658 13.930 11.388 1.00 0.00 O ATOM 0 H TYR A 14 20.074 18.379 17.831 1.00 0.00 H new ATOM 0 HA TYR A 14 21.200 15.767 17.226 1.00 0.00 H new ATOM 0 HB2 TYR A 14 19.822 17.591 15.844 1.00 0.00 H new ATOM 0 HB3 TYR A 14 21.405 18.294 15.574 1.00 0.00 H new ATOM 0 HD1 TYR A 14 23.219 16.606 14.694 1.00 0.00 H new ATOM 0 HD2 TYR A 14 19.001 16.110 14.294 1.00 0.00 H new ATOM 0 HE1 TYR A 14 23.618 15.102 12.758 1.00 0.00 H new ATOM 0 HE2 TYR A 14 19.344 14.603 12.369 1.00 0.00 H new ATOM 0 HH TYR A 14 20.965 13.237 11.405 1.00 0.00 H new ATOM 228 N GLU A 15 23.400 17.829 17.978 1.00 0.00 N ATOM 229 CA GLU A 15 24.821 17.867 18.274 1.00 0.00 C ATOM 230 C GLU A 15 25.087 17.088 19.592 1.00 0.00 C ATOM 231 O GLU A 15 25.973 16.264 19.662 1.00 0.00 O ATOM 232 CB GLU A 15 25.328 19.297 18.379 1.00 0.00 C ATOM 233 CG GLU A 15 26.700 19.434 19.086 1.00 0.00 C ATOM 234 CD GLU A 15 26.977 20.855 19.490 1.00 0.00 C ATOM 235 OE1 GLU A 15 26.407 21.737 18.711 1.00 0.00 O ATOM 236 OE2 GLU A 15 27.662 21.105 20.445 1.00 0.00 O ATOM 0 H GLU A 15 22.894 18.675 18.239 1.00 0.00 H new ATOM 0 HA GLU A 15 25.365 17.394 17.456 1.00 0.00 H new ATOM 0 HB2 GLU A 15 25.405 19.718 17.376 1.00 0.00 H new ATOM 0 HB3 GLU A 15 24.592 19.893 18.919 1.00 0.00 H new ATOM 0 HG2 GLU A 15 26.720 18.794 19.968 1.00 0.00 H new ATOM 0 HG3 GLU A 15 27.489 19.084 18.420 1.00 0.00 H new ATOM 243 N LYS A 16 24.283 17.393 20.610 1.00 0.00 N ATOM 244 CA LYS A 16 24.357 16.790 21.920 1.00 0.00 C ATOM 245 C LYS A 16 24.033 15.312 21.931 1.00 0.00 C ATOM 246 O LYS A 16 24.573 14.614 22.771 1.00 0.00 O ATOM 247 CB LYS A 16 23.452 17.561 22.899 1.00 0.00 C ATOM 248 CG LYS A 16 23.710 17.087 24.314 1.00 0.00 C ATOM 249 CD LYS A 16 23.830 18.316 25.192 1.00 0.00 C ATOM 250 CE LYS A 16 22.979 18.328 26.447 1.00 0.00 C ATOM 251 NZ LYS A 16 21.542 18.387 26.162 1.00 0.00 N ATOM 0 H LYS A 16 23.542 18.090 20.533 1.00 0.00 H new ATOM 0 HA LYS A 16 25.396 16.861 22.242 1.00 0.00 H new ATOM 0 HB2 LYS A 16 23.646 18.631 22.823 1.00 0.00 H new ATOM 0 HB3 LYS A 16 22.405 17.407 22.639 1.00 0.00 H new ATOM 0 HG2 LYS A 16 22.897 16.448 24.658 1.00 0.00 H new ATOM 0 HG3 LYS A 16 24.623 16.493 24.359 1.00 0.00 H new ATOM 0 HD2 LYS A 16 24.874 18.427 25.485 1.00 0.00 H new ATOM 0 HD3 LYS A 16 23.572 19.190 24.595 1.00 0.00 H new ATOM 0 HE2 LYS A 16 23.192 17.434 27.033 1.00 0.00 H new ATOM 0 HE3 LYS A 16 23.258 19.185 27.061 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 21.011 18.393 27.056 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 21.329 19.253 25.627 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 21.265 17.557 25.600 1.00 0.00 H new ATOM 265 N PHE A 17 23.191 14.733 21.068 1.00 0.00 N ATOM 266 CA PHE A 17 22.882 13.288 21.106 1.00 0.00 C ATOM 267 C PHE A 17 24.040 12.479 20.511 1.00 0.00 C ATOM 268 O PHE A 17 24.239 11.294 20.793 1.00 0.00 O ATOM 269 CB PHE A 17 21.539 12.996 20.435 1.00 0.00 C ATOM 270 CG PHE A 17 21.611 12.449 19.012 1.00 0.00 C ATOM 271 CD1 PHE A 17 22.415 13.014 18.047 1.00 0.00 C ATOM 272 CD2 PHE A 17 20.834 11.341 18.693 1.00 0.00 C ATOM 273 CE1 PHE A 17 22.440 12.481 16.775 1.00 0.00 C ATOM 274 CE2 PHE A 17 20.869 10.810 17.413 1.00 0.00 C ATOM 275 CZ PHE A 17 21.675 11.376 16.429 1.00 0.00 C ATOM 0 H PHE A 17 22.706 15.241 20.329 1.00 0.00 H new ATOM 0 HA PHE A 17 22.777 12.973 22.144 1.00 0.00 H new ATOM 0 HB2 PHE A 17 20.994 12.281 21.052 1.00 0.00 H new ATOM 0 HB3 PHE A 17 20.954 13.916 20.421 1.00 0.00 H new ATOM 0 HD1 PHE A 17 23.025 13.873 18.286 1.00 0.00 H new ATOM 0 HD2 PHE A 17 20.201 10.893 19.445 1.00 0.00 H new ATOM 0 HE1 PHE A 17 23.073 12.936 16.027 1.00 0.00 H new ATOM 0 HE2 PHE A 17 20.264 9.947 17.176 1.00 0.00 H new ATOM 0 HZ PHE A 17 21.704 10.969 15.429 1.00 0.00 H new ATOM 285 N MET A 18 24.789 13.195 19.681 1.00 0.00 N ATOM 286 CA MET A 18 25.937 12.657 19.017 1.00 0.00 C ATOM 287 C MET A 18 27.093 12.674 20.030 1.00 0.00 C ATOM 288 O MET A 18 27.738 11.666 20.175 1.00 0.00 O ATOM 289 CB MET A 18 26.392 13.568 17.844 1.00 0.00 C ATOM 290 CG MET A 18 25.934 13.026 16.531 1.00 0.00 C ATOM 291 SD MET A 18 26.935 13.580 15.129 1.00 0.00 S ATOM 292 CE MET A 18 25.804 13.131 13.812 1.00 0.00 C ATOM 0 H MET A 18 24.603 14.173 19.458 1.00 0.00 H new ATOM 0 HA MET A 18 25.689 11.664 18.642 1.00 0.00 H new ATOM 0 HB2 MET A 18 25.993 14.573 17.985 1.00 0.00 H new ATOM 0 HB3 MET A 18 27.479 13.653 17.846 1.00 0.00 H new ATOM 0 HG2 MET A 18 25.951 11.937 16.571 1.00 0.00 H new ATOM 0 HG3 MET A 18 24.898 13.322 16.367 1.00 0.00 H new ATOM 0 HE1 MET A 18 26.324 12.511 13.081 1.00 0.00 H new ATOM 0 HE2 MET A 18 24.964 12.574 14.228 1.00 0.00 H new ATOM 0 HE3 MET A 18 25.435 14.034 13.325 1.00 0.00 H new ATOM 302 N GLU A 19 27.224 13.834 20.622 1.00 0.00 N ATOM 303 CA GLU A 19 28.256 14.152 21.591 1.00 0.00 C ATOM 304 C GLU A 19 28.441 13.135 22.698 1.00 0.00 C ATOM 305 O GLU A 19 29.533 12.728 23.102 1.00 0.00 O ATOM 306 CB GLU A 19 27.846 15.462 22.299 1.00 0.00 C ATOM 307 CG GLU A 19 27.631 15.374 23.823 1.00 0.00 C ATOM 308 CD GLU A 19 27.689 16.765 24.442 1.00 0.00 C ATOM 309 OE1 GLU A 19 28.363 17.643 23.976 1.00 0.00 O ATOM 310 OE2 GLU A 19 26.959 16.906 25.498 1.00 0.00 O ATOM 0 H GLU A 19 26.594 14.615 20.439 1.00 0.00 H new ATOM 0 HA GLU A 19 29.186 14.198 21.024 1.00 0.00 H new ATOM 0 HB2 GLU A 19 28.613 16.211 22.104 1.00 0.00 H new ATOM 0 HB3 GLU A 19 26.924 15.824 21.843 1.00 0.00 H new ATOM 0 HG2 GLU A 19 26.667 14.913 24.036 1.00 0.00 H new ATOM 0 HG3 GLU A 19 28.394 14.737 24.269 1.00 0.00 H new ATOM 317 N LYS A 20 27.282 12.724 23.224 1.00 0.00 N ATOM 318 CA LYS A 20 27.354 11.761 24.340 1.00 0.00 C ATOM 319 C LYS A 20 27.645 10.342 23.924 1.00 0.00 C ATOM 320 O LYS A 20 28.097 9.547 24.769 1.00 0.00 O ATOM 321 CB LYS A 20 26.101 11.985 25.173 1.00 0.00 C ATOM 322 CG LYS A 20 26.174 13.323 25.875 1.00 0.00 C ATOM 323 CD LYS A 20 24.891 14.059 25.730 1.00 0.00 C ATOM 324 CE LYS A 20 24.005 13.956 26.955 1.00 0.00 C ATOM 325 NZ LYS A 20 24.251 15.107 27.836 1.00 0.00 N ATOM 0 H LYS A 20 26.349 13.012 22.929 1.00 0.00 H new ATOM 0 HA LYS A 20 28.229 11.944 24.964 1.00 0.00 H new ATOM 0 HB2 LYS A 20 25.219 11.949 24.534 1.00 0.00 H new ATOM 0 HB3 LYS A 20 25.996 11.186 25.907 1.00 0.00 H new ATOM 0 HG2 LYS A 20 26.397 13.174 26.932 1.00 0.00 H new ATOM 0 HG3 LYS A 20 26.989 13.915 25.458 1.00 0.00 H new ATOM 0 HD2 LYS A 20 25.102 15.109 25.529 1.00 0.00 H new ATOM 0 HD3 LYS A 20 24.352 13.671 24.866 1.00 0.00 H new ATOM 0 HE2 LYS A 20 22.957 13.930 26.658 1.00 0.00 H new ATOM 0 HE3 LYS A 20 24.209 13.027 27.487 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 23.346 15.556 28.082 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 24.724 14.785 28.704 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 24.857 15.796 27.346 1.00 0.00 H new ATOM 339 N MET A 21 27.414 9.977 22.643 1.00 0.00 N ATOM 340 CA MET A 21 27.707 8.623 22.212 1.00 0.00 C ATOM 341 C MET A 21 29.184 8.411 21.783 1.00 0.00 C ATOM 342 O MET A 21 29.480 7.369 21.203 1.00 0.00 O ATOM 343 CB MET A 21 26.729 8.002 21.222 1.00 0.00 C ATOM 344 CG MET A 21 26.347 8.873 20.030 1.00 0.00 C ATOM 345 SD MET A 21 25.018 8.172 19.009 1.00 0.00 S ATOM 346 CE MET A 21 23.661 8.661 20.108 1.00 0.00 C ATOM 0 H MET A 21 27.037 10.591 21.921 1.00 0.00 H new ATOM 0 HA MET A 21 27.550 8.055 23.129 1.00 0.00 H new ATOM 0 HB2 MET A 21 27.162 7.075 20.846 1.00 0.00 H new ATOM 0 HB3 MET A 21 25.819 7.735 21.759 1.00 0.00 H new ATOM 0 HG2 MET A 21 26.036 9.853 20.392 1.00 0.00 H new ATOM 0 HG3 MET A 21 27.228 9.028 19.407 1.00 0.00 H new ATOM 0 HE1 MET A 21 23.029 7.797 20.313 1.00 0.00 H new ATOM 0 HE2 MET A 21 24.070 9.042 21.044 1.00 0.00 H new ATOM 0 HE3 MET A 21 23.067 9.439 19.629 1.00 0.00 H new ATOM 356 N GLY A 22 30.056 9.391 22.080 1.00 0.00 N ATOM 357 CA GLY A 22 31.482 9.393 21.777 1.00 0.00 C ATOM 358 C GLY A 22 31.955 10.385 20.701 1.00 0.00 C ATOM 359 O GLY A 22 32.984 10.200 20.064 1.00 0.00 O ATOM 0 H GLY A 22 29.762 10.241 22.561 1.00 0.00 H new ATOM 0 HA2 GLY A 22 32.026 9.604 22.698 1.00 0.00 H new ATOM 0 HA3 GLY A 22 31.765 8.388 21.463 1.00 0.00 H new ATOM 363 N ILE A 23 31.158 11.442 20.524 1.00 0.00 N ATOM 364 CA ILE A 23 31.442 12.464 19.555 1.00 0.00 C ATOM 365 C ILE A 23 32.093 13.648 20.241 1.00 0.00 C ATOM 366 O ILE A 23 31.514 14.265 21.131 1.00 0.00 O ATOM 367 CB ILE A 23 30.191 12.897 18.818 1.00 0.00 C ATOM 368 CG1 ILE A 23 29.706 11.858 17.844 1.00 0.00 C ATOM 369 CG2 ILE A 23 30.397 14.232 18.073 1.00 0.00 C ATOM 370 CD1 ILE A 23 29.773 10.442 18.378 1.00 0.00 C ATOM 0 H ILE A 23 30.302 11.599 21.056 1.00 0.00 H new ATOM 0 HA ILE A 23 32.128 12.053 18.815 1.00 0.00 H new ATOM 0 HB ILE A 23 29.430 13.030 19.587 1.00 0.00 H new ATOM 0 HG12 ILE A 23 28.676 12.084 17.568 1.00 0.00 H new ATOM 0 HG13 ILE A 23 30.301 11.921 16.933 1.00 0.00 H new ATOM 0 HG21 ILE A 23 29.477 14.507 17.558 1.00 0.00 H new ATOM 0 HG22 ILE A 23 30.659 15.011 18.789 1.00 0.00 H new ATOM 0 HG23 ILE A 23 31.201 14.122 17.346 1.00 0.00 H new ATOM 0 HD11 ILE A 23 29.407 9.750 17.620 1.00 0.00 H new ATOM 0 HD12 ILE A 23 30.805 10.195 18.627 1.00 0.00 H new ATOM 0 HD13 ILE A 23 29.155 10.361 19.272 1.00 0.00 H new ATOM 382 N ASN A 24 33.330 14.022 19.859 1.00 0.00 N ATOM 383 CA ASN A 24 33.948 15.141 20.508 1.00 0.00 C ATOM 384 C ASN A 24 33.763 16.461 19.817 1.00 0.00 C ATOM 385 O ASN A 24 33.177 16.536 18.743 1.00 0.00 O ATOM 386 CB ASN A 24 35.451 14.853 20.819 1.00 0.00 C ATOM 387 CG ASN A 24 35.887 13.418 20.581 1.00 0.00 C ATOM 388 OD1 ASN A 24 35.193 12.459 20.936 1.00 0.00 O ATOM 389 ND2 ASN A 24 37.036 13.204 19.971 1.00 0.00 N ATOM 0 H ASN A 24 33.884 13.571 19.131 1.00 0.00 H new ATOM 0 HA ASN A 24 33.410 15.254 21.449 1.00 0.00 H new ATOM 0 HB2 ASN A 24 36.067 15.511 20.206 1.00 0.00 H new ATOM 0 HB3 ASN A 24 35.648 15.110 21.860 1.00 0.00 H new ATOM 0 HD21 ASN A 24 37.349 12.250 19.794 1.00 0.00 H new ATOM 0 HD22 ASN A 24 37.612 13.993 19.676 1.00 0.00 H new ATOM 396 N VAL A 25 34.250 17.548 20.392 1.00 0.00 N ATOM 397 CA VAL A 25 34.118 18.867 19.778 1.00 0.00 C ATOM 398 C VAL A 25 34.917 19.162 18.525 1.00 0.00 C ATOM 399 O VAL A 25 34.552 20.095 17.804 1.00 0.00 O ATOM 400 CB VAL A 25 33.990 20.036 20.759 1.00 0.00 C ATOM 401 CG1 VAL A 25 32.925 19.757 21.814 1.00 0.00 C ATOM 402 CG2 VAL A 25 35.292 20.332 21.472 1.00 0.00 C ATOM 0 H VAL A 25 34.742 17.547 21.285 1.00 0.00 H new ATOM 0 HA VAL A 25 33.124 18.764 19.343 1.00 0.00 H new ATOM 0 HB VAL A 25 33.708 20.900 20.158 1.00 0.00 H new ATOM 0 HG11 VAL A 25 32.857 20.605 22.496 1.00 0.00 H new ATOM 0 HG12 VAL A 25 31.962 19.605 21.327 1.00 0.00 H new ATOM 0 HG13 VAL A 25 33.194 18.861 22.374 1.00 0.00 H new ATOM 0 HG21 VAL A 25 35.150 21.168 22.156 1.00 0.00 H new ATOM 0 HG22 VAL A 25 35.607 19.453 22.034 1.00 0.00 H new ATOM 0 HG23 VAL A 25 36.058 20.588 20.740 1.00 0.00 H new ATOM 412 N VAL A 26 35.982 18.457 18.201 1.00 0.00 N ATOM 413 CA VAL A 26 36.817 18.649 17.029 1.00 0.00 C ATOM 414 C VAL A 26 36.032 18.593 15.733 1.00 0.00 C ATOM 415 O VAL A 26 36.421 19.099 14.680 1.00 0.00 O ATOM 416 CB VAL A 26 38.061 17.781 17.053 1.00 0.00 C ATOM 417 CG1 VAL A 26 38.984 17.969 15.861 1.00 0.00 C ATOM 418 CG2 VAL A 26 38.825 18.223 18.289 1.00 0.00 C ATOM 0 H VAL A 26 36.309 17.687 18.784 1.00 0.00 H new ATOM 0 HA VAL A 26 37.193 19.671 17.073 1.00 0.00 H new ATOM 0 HB VAL A 26 37.753 16.735 17.039 1.00 0.00 H new ATOM 0 HG11 VAL A 26 39.846 17.310 15.961 1.00 0.00 H new ATOM 0 HG12 VAL A 26 38.447 17.728 14.944 1.00 0.00 H new ATOM 0 HG13 VAL A 26 39.322 19.005 15.822 1.00 0.00 H new ATOM 0 HG21 VAL A 26 39.742 17.640 18.378 1.00 0.00 H new ATOM 0 HG22 VAL A 26 39.074 19.281 18.204 1.00 0.00 H new ATOM 0 HG23 VAL A 26 38.208 18.066 19.174 1.00 0.00 H new ATOM 428 N LYS A 27 34.870 17.939 15.883 1.00 0.00 N ATOM 429 CA LYS A 27 33.916 17.753 14.838 1.00 0.00 C ATOM 430 C LYS A 27 33.097 19.066 14.703 1.00 0.00 C ATOM 431 O LYS A 27 32.597 19.354 13.605 1.00 0.00 O ATOM 432 CB LYS A 27 33.028 16.554 15.082 1.00 0.00 C ATOM 433 CG LYS A 27 33.722 15.231 15.461 1.00 0.00 C ATOM 434 CD LYS A 27 34.058 14.326 14.284 1.00 0.00 C ATOM 435 CE LYS A 27 35.572 14.228 14.044 1.00 0.00 C ATOM 436 NZ LYS A 27 35.959 13.324 12.930 1.00 0.00 N ATOM 0 H LYS A 27 34.583 17.522 16.769 1.00 0.00 H new ATOM 0 HA LYS A 27 34.433 17.541 13.902 1.00 0.00 H new ATOM 0 HB2 LYS A 27 32.327 16.808 15.877 1.00 0.00 H new ATOM 0 HB3 LYS A 27 32.439 16.381 14.182 1.00 0.00 H new ATOM 0 HG2 LYS A 27 34.642 15.461 15.999 1.00 0.00 H new ATOM 0 HG3 LYS A 27 33.078 14.684 16.150 1.00 0.00 H new ATOM 0 HD2 LYS A 27 33.655 13.330 14.467 1.00 0.00 H new ATOM 0 HD3 LYS A 27 33.573 14.706 13.385 1.00 0.00 H new ATOM 0 HE2 LYS A 27 35.960 15.225 13.838 1.00 0.00 H new ATOM 0 HE3 LYS A 27 36.051 13.882 14.960 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 36.861 12.860 13.157 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 35.222 12.602 12.797 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 36.065 13.877 12.055 1.00 0.00 H new ATOM 595 N LYS A 37 19.236 16.065 2.915 1.00 0.00 N ATOM 596 CA LYS A 37 18.177 15.239 2.412 1.00 0.00 C ATOM 597 C LYS A 37 18.179 13.846 3.023 1.00 0.00 C ATOM 598 O LYS A 37 18.822 12.986 2.388 1.00 0.00 O ATOM 599 CB LYS A 37 18.110 15.182 0.900 1.00 0.00 C ATOM 600 CG LYS A 37 16.698 15.365 0.340 1.00 0.00 C ATOM 601 CD LYS A 37 16.658 15.016 -1.120 1.00 0.00 C ATOM 602 CE LYS A 37 17.705 15.756 -1.946 1.00 0.00 C ATOM 603 NZ LYS A 37 17.546 15.607 -3.398 1.00 0.00 N ATOM 0 HA LYS A 37 17.262 15.736 2.735 1.00 0.00 H new ATOM 0 HB2 LYS A 37 18.758 15.955 0.487 1.00 0.00 H new ATOM 0 HB3 LYS A 37 18.503 14.223 0.564 1.00 0.00 H new ATOM 0 HG2 LYS A 37 15.999 14.734 0.889 1.00 0.00 H new ATOM 0 HG3 LYS A 37 16.376 16.397 0.482 1.00 0.00 H new ATOM 0 HD2 LYS A 37 16.808 13.942 -1.234 1.00 0.00 H new ATOM 0 HD3 LYS A 37 15.667 15.243 -1.514 1.00 0.00 H new ATOM 0 HE2 LYS A 37 17.666 16.816 -1.695 1.00 0.00 H new ATOM 0 HE3 LYS A 37 18.694 15.398 -1.662 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 18.274 16.166 -3.886 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 17.647 14.605 -3.657 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 16.604 15.944 -3.680 1.00 0.00 H new ATOM 617 N LEU A 38 17.510 13.620 4.142 1.00 0.00 N ATOM 618 CA LEU A 38 17.428 12.256 4.656 1.00 0.00 C ATOM 619 C LEU A 38 16.867 11.564 3.417 1.00 0.00 C ATOM 620 O LEU A 38 17.421 10.515 3.105 1.00 0.00 O ATOM 621 CB LEU A 38 16.285 11.994 5.638 1.00 0.00 C ATOM 622 CG LEU A 38 16.296 10.721 6.489 1.00 0.00 C ATOM 623 CD1 LEU A 38 16.646 9.511 5.628 1.00 0.00 C ATOM 624 CD2 LEU A 38 17.457 10.848 7.461 1.00 0.00 C ATOM 0 H LEU A 38 17.032 14.330 4.696 1.00 0.00 H new ATOM 0 HA LEU A 38 18.374 11.980 5.122 1.00 0.00 H new ATOM 0 HB2 LEU A 38 16.241 12.842 6.321 1.00 0.00 H new ATOM 0 HB3 LEU A 38 15.357 11.996 5.066 1.00 0.00 H new ATOM 0 HG LEU A 38 15.322 10.601 6.963 1.00 0.00 H new ATOM 0 HD11 LEU A 38 16.650 8.613 6.246 1.00 0.00 H new ATOM 0 HD12 LEU A 38 15.906 9.402 4.835 1.00 0.00 H new ATOM 0 HD13 LEU A 38 17.633 9.652 5.186 1.00 0.00 H new ATOM 0 HD21 LEU A 38 17.503 9.959 8.090 1.00 0.00 H new ATOM 0 HD22 LEU A 38 18.389 10.947 6.904 1.00 0.00 H new ATOM 0 HD23 LEU A 38 17.313 11.729 8.087 1.00 0.00 H new ATOM 636 N THR A 39 15.893 12.237 2.881 1.00 0.00 N ATOM 637 CA THR A 39 15.105 11.900 1.680 1.00 0.00 C ATOM 638 C THR A 39 14.469 10.584 1.971 1.00 0.00 C ATOM 639 O THR A 39 15.006 9.812 2.751 1.00 0.00 O ATOM 640 CB THR A 39 15.984 11.750 0.393 1.00 0.00 C ATOM 641 OG1 THR A 39 17.067 12.610 0.591 1.00 0.00 O ATOM 642 CG2 THR A 39 15.227 12.012 -0.903 1.00 0.00 C ATOM 0 H THR A 39 15.584 13.118 3.292 1.00 0.00 H new ATOM 0 HA THR A 39 14.392 12.700 1.480 1.00 0.00 H new ATOM 0 HB THR A 39 16.314 10.720 0.261 1.00 0.00 H new ATOM 0 HG1 THR A 39 17.649 12.590 -0.197 1.00 0.00 H new ATOM 0 HG21 THR A 39 15.902 11.889 -1.750 1.00 0.00 H new ATOM 0 HG22 THR A 39 14.402 11.306 -0.991 1.00 0.00 H new ATOM 0 HG23 THR A 39 14.835 13.029 -0.896 1.00 0.00 H new ATOM 650 N ILE A 40 13.352 10.169 1.385 1.00 0.00 N ATOM 651 CA ILE A 40 12.791 8.843 1.660 1.00 0.00 C ATOM 652 C ILE A 40 11.966 8.251 0.526 1.00 0.00 C ATOM 653 O ILE A 40 10.922 8.795 0.254 1.00 0.00 O ATOM 654 CB ILE A 40 12.007 8.787 2.954 1.00 0.00 C ATOM 655 CG1 ILE A 40 12.806 9.175 4.217 1.00 0.00 C ATOM 656 CG2 ILE A 40 11.450 7.358 3.176 1.00 0.00 C ATOM 657 CD1 ILE A 40 12.059 9.178 5.578 1.00 0.00 C ATOM 0 H ILE A 40 12.816 10.725 0.719 1.00 0.00 H new ATOM 0 HA ILE A 40 13.677 8.217 1.762 1.00 0.00 H new ATOM 0 HB ILE A 40 11.217 9.528 2.829 1.00 0.00 H new ATOM 0 HG12 ILE A 40 13.651 8.491 4.301 1.00 0.00 H new ATOM 0 HG13 ILE A 40 13.217 10.172 4.059 1.00 0.00 H new ATOM 0 HG21 ILE A 40 10.888 7.328 4.109 1.00 0.00 H new ATOM 0 HG22 ILE A 40 10.794 7.091 2.348 1.00 0.00 H new ATOM 0 HG23 ILE A 40 12.277 6.649 3.227 1.00 0.00 H new ATOM 0 HD11 ILE A 40 12.748 9.470 6.371 1.00 0.00 H new ATOM 0 HD12 ILE A 40 11.232 9.886 5.537 1.00 0.00 H new ATOM 0 HD13 ILE A 40 11.672 8.180 5.783 1.00 0.00 H new ATOM 669 N THR A 41 12.380 7.183 -0.121 1.00 0.00 N ATOM 670 CA THR A 41 11.639 6.582 -1.212 1.00 0.00 C ATOM 671 C THR A 41 11.358 5.127 -0.974 1.00 0.00 C ATOM 672 O THR A 41 12.261 4.299 -0.985 1.00 0.00 O ATOM 673 CB THR A 41 12.366 6.728 -2.551 1.00 0.00 C ATOM 674 OG1 THR A 41 12.785 8.042 -2.737 1.00 0.00 O ATOM 675 CG2 THR A 41 11.499 6.319 -3.720 1.00 0.00 C ATOM 0 H THR A 41 13.252 6.701 0.098 1.00 0.00 H new ATOM 0 HA THR A 41 10.695 7.125 -1.255 1.00 0.00 H new ATOM 0 HB THR A 41 13.228 6.061 -2.514 1.00 0.00 H new ATOM 0 HG1 THR A 41 13.249 8.119 -3.597 1.00 0.00 H new ATOM 0 HG21 THR A 41 12.058 6.440 -4.648 1.00 0.00 H new ATOM 0 HG22 THR A 41 11.205 5.276 -3.607 1.00 0.00 H new ATOM 0 HG23 THR A 41 10.608 6.946 -3.749 1.00 0.00 H new ATOM 683 N GLN A 42 10.104 4.844 -0.769 1.00 0.00 N ATOM 684 CA GLN A 42 9.590 3.529 -0.523 1.00 0.00 C ATOM 685 C GLN A 42 9.780 2.694 -1.745 1.00 0.00 C ATOM 686 O GLN A 42 9.489 3.182 -2.827 1.00 0.00 O ATOM 687 CB GLN A 42 8.057 3.740 -0.349 1.00 0.00 C ATOM 688 CG GLN A 42 7.387 2.665 0.485 1.00 0.00 C ATOM 689 CD GLN A 42 6.924 3.185 1.856 1.00 0.00 C ATOM 690 OE1 GLN A 42 7.236 4.296 2.349 1.00 0.00 O ATOM 691 NE2 GLN A 42 6.139 2.263 2.425 1.00 0.00 N ATOM 0 H GLN A 42 9.377 5.560 -0.769 1.00 0.00 H new ATOM 0 HA GLN A 42 10.073 3.051 0.329 1.00 0.00 H new ATOM 0 HB2 GLN A 42 7.883 4.710 0.116 1.00 0.00 H new ATOM 0 HB3 GLN A 42 7.589 3.769 -1.333 1.00 0.00 H new ATOM 0 HG2 GLN A 42 6.529 2.270 -0.059 1.00 0.00 H new ATOM 0 HG3 GLN A 42 8.081 1.837 0.630 1.00 0.00 H new ATOM 0 HE21 GLN A 42 5.946 1.387 1.939 1.00 0.00 H new ATOM 0 HE22 GLN A 42 5.734 2.436 3.345 1.00 0.00 H new ATOM 700 N GLU A 43 10.248 1.504 -1.533 1.00 0.00 N ATOM 701 CA GLU A 43 10.483 0.598 -2.655 1.00 0.00 C ATOM 702 C GLU A 43 9.293 -0.324 -2.538 1.00 0.00 C ATOM 703 O GLU A 43 8.379 -0.159 -3.330 1.00 0.00 O ATOM 704 CB GLU A 43 11.856 -0.035 -2.477 1.00 0.00 C ATOM 705 CG GLU A 43 12.850 0.179 -3.599 1.00 0.00 C ATOM 706 CD GLU A 43 12.399 -0.764 -4.663 1.00 0.00 C ATOM 707 OE1 GLU A 43 11.254 -0.936 -4.978 1.00 0.00 O ATOM 708 OE2 GLU A 43 13.415 -1.365 -5.205 1.00 0.00 O ATOM 0 H GLU A 43 10.478 1.125 -0.614 1.00 0.00 H new ATOM 0 HA GLU A 43 10.532 1.022 -3.658 1.00 0.00 H new ATOM 0 HB2 GLU A 43 12.293 0.351 -1.556 1.00 0.00 H new ATOM 0 HB3 GLU A 43 11.722 -1.108 -2.340 1.00 0.00 H new ATOM 0 HG2 GLU A 43 12.840 1.211 -3.950 1.00 0.00 H new ATOM 0 HG3 GLU A 43 13.868 -0.039 -3.277 1.00 0.00 H new ATOM 715 N GLY A 44 9.281 -1.259 -1.606 1.00 0.00 N ATOM 716 CA GLY A 44 8.227 -2.233 -1.336 1.00 0.00 C ATOM 717 C GLY A 44 8.166 -2.305 0.192 1.00 0.00 C ATOM 718 O GLY A 44 7.211 -1.898 0.840 1.00 0.00 O ATOM 0 H GLY A 44 10.067 -1.370 -0.966 1.00 0.00 H new ATOM 0 HA2 GLY A 44 7.274 -1.916 -1.758 1.00 0.00 H new ATOM 0 HA3 GLY A 44 8.461 -3.204 -1.772 1.00 0.00 H new ATOM 722 N ASN A 45 9.278 -2.851 0.688 1.00 0.00 N ATOM 723 CA ASN A 45 9.596 -3.057 2.080 1.00 0.00 C ATOM 724 C ASN A 45 10.696 -1.997 2.372 1.00 0.00 C ATOM 725 O ASN A 45 10.478 -1.010 3.040 1.00 0.00 O ATOM 726 CB ASN A 45 10.074 -4.491 2.373 1.00 0.00 C ATOM 727 CG ASN A 45 9.254 -5.513 1.593 1.00 0.00 C ATOM 728 OD1 ASN A 45 7.989 -5.569 1.607 1.00 0.00 O ATOM 729 ND2 ASN A 45 9.992 -6.343 0.891 1.00 0.00 N ATOM 0 H ASN A 45 10.024 -3.180 0.075 1.00 0.00 H new ATOM 0 HA ASN A 45 8.723 -2.940 2.722 1.00 0.00 H new ATOM 0 HB2 ASN A 45 11.127 -4.588 2.109 1.00 0.00 H new ATOM 0 HB3 ASN A 45 9.993 -4.694 3.441 1.00 0.00 H new ATOM 0 HD21 ASN A 45 9.548 -7.069 0.328 1.00 0.00 H new ATOM 0 HD22 ASN A 45 11.009 -6.262 0.909 1.00 0.00 H new ATOM 736 N LYS A 46 11.866 -2.260 1.826 1.00 0.00 N ATOM 737 CA LYS A 46 13.002 -1.367 1.978 1.00 0.00 C ATOM 738 C LYS A 46 12.604 -0.047 1.350 1.00 0.00 C ATOM 739 O LYS A 46 11.518 0.170 0.802 1.00 0.00 O ATOM 740 CB LYS A 46 14.227 -1.817 1.162 1.00 0.00 C ATOM 741 CG LYS A 46 14.695 -0.966 0.014 1.00 0.00 C ATOM 742 CD LYS A 46 15.411 -1.841 -1.040 1.00 0.00 C ATOM 743 CE LYS A 46 14.642 -3.076 -1.476 1.00 0.00 C ATOM 744 NZ LYS A 46 14.990 -3.659 -2.789 1.00 0.00 N ATOM 0 H LYS A 46 12.058 -3.092 1.268 1.00 0.00 H new ATOM 0 HA LYS A 46 13.253 -1.331 3.038 1.00 0.00 H new ATOM 0 HB2 LYS A 46 15.062 -1.922 1.854 1.00 0.00 H new ATOM 0 HB3 LYS A 46 14.012 -2.810 0.768 1.00 0.00 H new ATOM 0 HG2 LYS A 46 13.845 -0.457 -0.441 1.00 0.00 H new ATOM 0 HG3 LYS A 46 15.372 -0.193 0.377 1.00 0.00 H new ATOM 0 HD2 LYS A 46 15.617 -1.230 -1.919 1.00 0.00 H new ATOM 0 HD3 LYS A 46 16.374 -2.154 -0.637 1.00 0.00 H new ATOM 0 HE2 LYS A 46 14.781 -3.846 -0.717 1.00 0.00 H new ATOM 0 HE3 LYS A 46 13.581 -2.827 -1.487 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 14.395 -4.494 -2.967 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 14.829 -2.953 -3.536 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 15.991 -3.941 -2.789 1.00 0.00 H new ATOM 758 N PHE A 47 13.590 0.857 1.440 1.00 0.00 N ATOM 759 CA PHE A 47 13.356 2.142 0.839 1.00 0.00 C ATOM 760 C PHE A 47 14.635 2.874 0.448 1.00 0.00 C ATOM 761 O PHE A 47 15.547 2.970 1.265 1.00 0.00 O ATOM 762 CB PHE A 47 12.569 3.079 1.814 1.00 0.00 C ATOM 763 CG PHE A 47 12.495 2.608 3.253 1.00 0.00 C ATOM 764 CD1 PHE A 47 13.749 2.504 3.904 1.00 0.00 C ATOM 765 CD2 PHE A 47 11.353 2.300 3.939 1.00 0.00 C ATOM 766 CE1 PHE A 47 13.845 2.094 5.238 1.00 0.00 C ATOM 767 CE2 PHE A 47 11.431 1.888 5.271 1.00 0.00 C ATOM 768 CZ PHE A 47 12.657 1.790 5.901 1.00 0.00 C ATOM 0 H PHE A 47 14.493 0.723 1.894 1.00 0.00 H new ATOM 0 HA PHE A 47 12.783 1.929 -0.063 1.00 0.00 H new ATOM 0 HB2 PHE A 47 13.033 4.065 1.796 1.00 0.00 H new ATOM 0 HB3 PHE A 47 11.554 3.197 1.436 1.00 0.00 H new ATOM 0 HD1 PHE A 47 14.649 2.746 3.359 1.00 0.00 H new ATOM 0 HD2 PHE A 47 10.392 2.375 3.451 1.00 0.00 H new ATOM 0 HE1 PHE A 47 14.801 2.016 5.734 1.00 0.00 H new ATOM 0 HE2 PHE A 47 10.528 1.645 5.812 1.00 0.00 H new ATOM 0 HZ PHE A 47 12.696 1.470 6.932 1.00 0.00 H new ATOM 778 N THR A 48 14.646 3.360 -0.772 1.00 0.00 N ATOM 779 CA THR A 48 15.751 4.090 -1.333 1.00 0.00 C ATOM 780 C THR A 48 15.718 5.405 -0.631 1.00 0.00 C ATOM 781 O THR A 48 15.366 6.450 -1.204 1.00 0.00 O ATOM 782 CB THR A 48 15.699 4.394 -2.849 1.00 0.00 C ATOM 783 OG1 THR A 48 15.567 3.185 -3.565 1.00 0.00 O ATOM 784 CG2 THR A 48 16.897 5.224 -3.317 1.00 0.00 C ATOM 0 H THR A 48 13.863 3.253 -1.417 1.00 0.00 H new ATOM 0 HA THR A 48 16.641 3.474 -1.204 1.00 0.00 H new ATOM 0 HB THR A 48 14.824 5.012 -3.051 1.00 0.00 H new ATOM 0 HG1 THR A 48 15.532 3.376 -4.526 1.00 0.00 H new ATOM 0 HG21 THR A 48 16.814 5.411 -4.388 1.00 0.00 H new ATOM 0 HG22 THR A 48 16.912 6.174 -2.783 1.00 0.00 H new ATOM 0 HG23 THR A 48 17.819 4.679 -3.114 1.00 0.00 H new ATOM 792 N VAL A 49 16.084 5.364 0.613 1.00 0.00 N ATOM 793 CA VAL A 49 16.126 6.547 1.502 1.00 0.00 C ATOM 794 C VAL A 49 17.474 7.122 1.231 1.00 0.00 C ATOM 795 O VAL A 49 18.355 6.308 0.876 1.00 0.00 O ATOM 796 CB VAL A 49 16.093 6.091 2.952 1.00 0.00 C ATOM 797 CG1 VAL A 49 16.490 7.215 3.906 1.00 0.00 C ATOM 798 CG2 VAL A 49 14.720 5.595 3.409 1.00 0.00 C ATOM 0 H VAL A 49 16.373 4.502 1.075 1.00 0.00 H new ATOM 0 HA VAL A 49 15.299 7.237 1.336 1.00 0.00 H new ATOM 0 HB VAL A 49 16.806 5.267 2.987 1.00 0.00 H new ATOM 0 HG11 VAL A 49 16.454 6.850 4.933 1.00 0.00 H new ATOM 0 HG12 VAL A 49 17.501 7.549 3.674 1.00 0.00 H new ATOM 0 HG13 VAL A 49 15.798 8.050 3.793 1.00 0.00 H new ATOM 0 HG21 VAL A 49 14.774 5.287 4.453 1.00 0.00 H new ATOM 0 HG22 VAL A 49 13.990 6.398 3.305 1.00 0.00 H new ATOM 0 HG23 VAL A 49 14.417 4.747 2.795 1.00 0.00 H new ATOM 808 N LYS A 50 17.670 8.414 1.370 1.00 0.00 N ATOM 809 CA LYS A 50 19.017 8.914 1.090 1.00 0.00 C ATOM 810 C LYS A 50 19.753 8.913 2.394 1.00 0.00 C ATOM 811 O LYS A 50 20.150 7.784 2.759 1.00 0.00 O ATOM 812 CB LYS A 50 19.076 10.279 0.469 1.00 0.00 C ATOM 813 CG LYS A 50 18.806 10.320 -0.999 1.00 0.00 C ATOM 814 CD LYS A 50 19.391 11.585 -1.573 1.00 0.00 C ATOM 815 CE LYS A 50 20.509 11.163 -2.460 1.00 0.00 C ATOM 816 NZ LYS A 50 20.745 12.210 -3.457 1.00 0.00 N ATOM 0 H LYS A 50 16.975 9.105 1.654 1.00 0.00 H new ATOM 0 HA LYS A 50 19.466 8.260 0.342 1.00 0.00 H new ATOM 0 HB2 LYS A 50 18.355 10.922 0.973 1.00 0.00 H new ATOM 0 HB3 LYS A 50 20.063 10.702 0.653 1.00 0.00 H new ATOM 0 HG2 LYS A 50 19.243 9.449 -1.486 1.00 0.00 H new ATOM 0 HG3 LYS A 50 17.733 10.284 -1.185 1.00 0.00 H new ATOM 0 HD2 LYS A 50 18.640 12.142 -2.133 1.00 0.00 H new ATOM 0 HD3 LYS A 50 19.750 12.242 -0.781 1.00 0.00 H new ATOM 0 HE2 LYS A 50 21.411 10.991 -1.873 1.00 0.00 H new ATOM 0 HE3 LYS A 50 20.265 10.222 -2.952 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 21.525 11.924 -4.082 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 19.883 12.352 -4.022 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 20.994 13.098 -2.976 1.00 0.00 H new ATOM 830 N GLU A 51 19.922 10.052 3.024 1.00 0.00 N ATOM 831 CA GLU A 51 20.622 10.281 4.241 1.00 0.00 C ATOM 832 C GLU A 51 21.968 10.860 3.826 1.00 0.00 C ATOM 833 O GLU A 51 23.014 10.278 4.031 1.00 0.00 O ATOM 834 CB GLU A 51 20.957 9.044 5.031 1.00 0.00 C ATOM 835 CG GLU A 51 21.528 9.416 6.400 1.00 0.00 C ATOM 836 CD GLU A 51 21.518 8.330 7.390 1.00 0.00 C ATOM 837 OE1 GLU A 51 21.706 7.238 6.916 1.00 0.00 O ATOM 838 OE2 GLU A 51 21.304 8.667 8.685 1.00 0.00 O ATOM 0 H GLU A 51 19.530 10.917 2.651 1.00 0.00 H new ATOM 0 HA GLU A 51 19.985 10.906 4.867 1.00 0.00 H new ATOM 0 HB2 GLU A 51 20.063 8.434 5.158 1.00 0.00 H new ATOM 0 HB3 GLU A 51 21.679 8.440 4.482 1.00 0.00 H new ATOM 0 HG2 GLU A 51 22.554 9.759 6.269 1.00 0.00 H new ATOM 0 HG3 GLU A 51 20.960 10.257 6.798 1.00 0.00 H new ATOM 845 N SER A 52 21.859 12.014 3.254 1.00 0.00 N ATOM 846 CA SER A 52 22.969 12.818 2.786 1.00 0.00 C ATOM 847 C SER A 52 22.997 13.978 3.788 1.00 0.00 C ATOM 848 O SER A 52 21.969 14.260 4.438 1.00 0.00 O ATOM 849 CB SER A 52 22.687 13.229 1.390 1.00 0.00 C ATOM 850 OG SER A 52 22.173 12.069 0.731 1.00 0.00 O ATOM 0 H SER A 52 20.954 12.454 3.086 1.00 0.00 H new ATOM 0 HA SER A 52 23.939 12.323 2.750 1.00 0.00 H new ATOM 0 HB2 SER A 52 21.965 14.045 1.362 1.00 0.00 H new ATOM 0 HB3 SER A 52 23.592 13.587 0.899 1.00 0.00 H new ATOM 0 HG SER A 52 22.523 11.264 1.166 1.00 0.00 H new ATOM 856 N SER A 53 24.101 14.658 4.003 1.00 0.00 N ATOM 857 CA SER A 53 24.056 15.750 4.975 1.00 0.00 C ATOM 858 C SER A 53 25.323 16.532 4.804 1.00 0.00 C ATOM 859 O SER A 53 25.844 16.501 3.689 1.00 0.00 O ATOM 860 CB SER A 53 23.865 15.304 6.424 1.00 0.00 C ATOM 861 OG SER A 53 24.876 14.457 6.889 1.00 0.00 O ATOM 0 H SER A 53 25.001 14.495 3.550 1.00 0.00 H new ATOM 0 HA SER A 53 23.173 16.357 4.776 1.00 0.00 H new ATOM 0 HB2 SER A 53 23.819 16.186 7.063 1.00 0.00 H new ATOM 0 HB3 SER A 53 22.906 14.794 6.515 1.00 0.00 H new ATOM 0 HG SER A 53 24.694 14.211 7.820 1.00 0.00 H new ATOM 867 N ASN A 54 25.823 17.193 5.818 1.00 0.00 N ATOM 868 CA ASN A 54 27.075 17.926 5.579 1.00 0.00 C ATOM 869 C ASN A 54 28.228 16.960 5.672 1.00 0.00 C ATOM 870 O ASN A 54 29.236 17.365 6.298 1.00 0.00 O ATOM 871 CB ASN A 54 27.262 19.044 6.624 1.00 0.00 C ATOM 872 CG ASN A 54 28.290 20.037 6.207 1.00 0.00 C ATOM 873 OD1 ASN A 54 29.372 20.142 6.805 1.00 0.00 O ATOM 874 ND2 ASN A 54 27.970 20.804 5.152 1.00 0.00 N ATOM 0 H ASN A 54 25.430 17.250 6.758 1.00 0.00 H new ATOM 0 HA ASN A 54 27.037 18.381 4.589 1.00 0.00 H new ATOM 0 HB2 ASN A 54 26.311 19.553 6.783 1.00 0.00 H new ATOM 0 HB3 ASN A 54 27.551 18.603 7.578 1.00 0.00 H new ATOM 0 HD21 ASN A 54 28.628 21.506 4.814 1.00 0.00 H new ATOM 0 HD22 ASN A 54 27.069 20.685 4.689 1.00 0.00 H new ATOM 881 N PHE A 55 28.178 15.774 5.137 1.00 0.00 N ATOM 882 CA PHE A 55 29.349 14.916 5.283 1.00 0.00 C ATOM 883 C PHE A 55 29.706 14.004 4.196 1.00 0.00 C ATOM 884 O PHE A 55 30.539 14.402 3.386 1.00 0.00 O ATOM 885 CB PHE A 55 29.102 13.999 6.490 1.00 0.00 C ATOM 886 CG PHE A 55 29.385 14.693 7.769 1.00 0.00 C ATOM 887 CD1 PHE A 55 30.623 15.251 8.047 1.00 0.00 C ATOM 888 CD2 PHE A 55 28.373 14.777 8.711 1.00 0.00 C ATOM 889 CE1 PHE A 55 30.810 15.884 9.278 1.00 0.00 C ATOM 890 CE2 PHE A 55 28.535 15.399 9.932 1.00 0.00 C ATOM 891 CZ PHE A 55 29.776 15.961 10.220 1.00 0.00 C ATOM 0 H PHE A 55 27.391 15.382 4.620 1.00 0.00 H new ATOM 0 HA PHE A 55 30.166 15.634 5.348 1.00 0.00 H new ATOM 0 HB2 PHE A 55 28.067 13.657 6.482 1.00 0.00 H new ATOM 0 HB3 PHE A 55 29.731 13.113 6.409 1.00 0.00 H new ATOM 0 HD1 PHE A 55 31.426 15.197 7.327 1.00 0.00 H new ATOM 0 HD2 PHE A 55 27.415 14.336 8.480 1.00 0.00 H new ATOM 0 HE1 PHE A 55 31.770 16.322 9.508 1.00 0.00 H new ATOM 0 HE2 PHE A 55 27.724 15.448 10.643 1.00 0.00 H new ATOM 0 HZ PHE A 55 29.941 16.455 11.166 1.00 0.00 H new ATOM 901 N ARG A 56 29.159 12.813 4.099 1.00 0.00 N ATOM 902 CA ARG A 56 29.526 11.928 3.032 1.00 0.00 C ATOM 903 C ARG A 56 28.653 12.078 1.830 1.00 0.00 C ATOM 904 O ARG A 56 29.170 11.910 0.717 1.00 0.00 O ATOM 905 CB ARG A 56 29.428 10.480 3.529 1.00 0.00 C ATOM 906 CG ARG A 56 29.911 9.405 2.548 1.00 0.00 C ATOM 907 CD ARG A 56 30.573 8.206 3.176 1.00 0.00 C ATOM 908 NE ARG A 56 30.780 8.283 4.622 1.00 0.00 N ATOM 909 CZ ARG A 56 29.937 7.770 5.539 1.00 0.00 C ATOM 910 NH1 ARG A 56 28.825 7.142 5.234 1.00 0.00 N ATOM 911 NH2 ARG A 56 30.240 7.901 6.820 1.00 0.00 N ATOM 0 H ARG A 56 28.463 12.442 4.745 1.00 0.00 H new ATOM 0 HA ARG A 56 30.544 12.183 2.736 1.00 0.00 H new ATOM 0 HB2 ARG A 56 30.005 10.391 4.449 1.00 0.00 H new ATOM 0 HB3 ARG A 56 28.389 10.272 3.784 1.00 0.00 H new ATOM 0 HG2 ARG A 56 29.058 9.062 1.962 1.00 0.00 H new ATOM 0 HG3 ARG A 56 30.613 9.863 1.851 1.00 0.00 H new ATOM 0 HD2 ARG A 56 29.968 7.325 2.960 1.00 0.00 H new ATOM 0 HD3 ARG A 56 31.540 8.054 2.696 1.00 0.00 H new ATOM 0 HE ARG A 56 31.618 8.757 4.958 1.00 0.00 H new ATOM 0 HH11 ARG A 56 28.559 7.021 4.257 1.00 0.00 H new ATOM 0 HH12 ARG A 56 28.227 6.775 5.974 1.00 0.00 H new ATOM 0 HH21 ARG A 56 31.096 8.382 7.095 1.00 0.00 H new ATOM 0 HH22 ARG A 56 29.617 7.521 7.533 1.00 0.00 H new ATOM 925 N ASN A 57 27.425 12.373 2.100 1.00 0.00 N ATOM 926 CA ASN A 57 26.389 12.568 1.132 1.00 0.00 C ATOM 927 C ASN A 57 26.124 11.219 0.495 1.00 0.00 C ATOM 928 O ASN A 57 26.950 10.774 -0.296 1.00 0.00 O ATOM 929 CB ASN A 57 26.779 13.686 0.144 1.00 0.00 C ATOM 930 CG ASN A 57 25.736 13.768 -0.964 1.00 0.00 C ATOM 931 OD1 ASN A 57 24.743 14.527 -0.919 1.00 0.00 O ATOM 932 ND2 ASN A 57 25.924 12.990 -2.001 1.00 0.00 N ATOM 0 H ASN A 57 27.095 12.492 3.058 1.00 0.00 H new ATOM 0 HA ASN A 57 25.458 12.918 1.579 1.00 0.00 H new ATOM 0 HB2 ASN A 57 26.847 14.640 0.666 1.00 0.00 H new ATOM 0 HB3 ASN A 57 27.762 13.484 -0.281 1.00 0.00 H new ATOM 0 HD21 ASN A 57 25.260 13.002 -2.775 1.00 0.00 H new ATOM 0 HD22 ASN A 57 26.735 12.372 -2.035 1.00 0.00 H new ATOM 939 N ILE A 58 25.033 10.553 0.796 1.00 0.00 N ATOM 940 CA ILE A 58 24.810 9.284 0.186 1.00 0.00 C ATOM 941 C ILE A 58 23.416 8.775 0.511 1.00 0.00 C ATOM 942 O ILE A 58 22.704 9.385 1.322 1.00 0.00 O ATOM 943 CB ILE A 58 25.835 8.282 0.650 1.00 0.00 C ATOM 944 CG1 ILE A 58 26.397 7.500 -0.532 1.00 0.00 C ATOM 945 CG2 ILE A 58 25.316 7.388 1.749 1.00 0.00 C ATOM 946 CD1 ILE A 58 27.724 6.870 -0.147 1.00 0.00 C ATOM 0 H ILE A 58 24.310 10.866 1.443 1.00 0.00 H new ATOM 0 HA ILE A 58 24.902 9.409 -0.893 1.00 0.00 H new ATOM 0 HB ILE A 58 26.660 8.836 1.097 1.00 0.00 H new ATOM 0 HG12 ILE A 58 25.692 6.727 -0.837 1.00 0.00 H new ATOM 0 HG13 ILE A 58 26.533 8.163 -1.387 1.00 0.00 H new ATOM 0 HG21 ILE A 58 26.095 6.686 2.045 1.00 0.00 H new ATOM 0 HG22 ILE A 58 25.030 7.996 2.607 1.00 0.00 H new ATOM 0 HG23 ILE A 58 24.448 6.836 1.389 1.00 0.00 H new ATOM 0 HD11 ILE A 58 28.122 6.312 -0.995 1.00 0.00 H new ATOM 0 HD12 ILE A 58 28.429 7.651 0.136 1.00 0.00 H new ATOM 0 HD13 ILE A 58 27.575 6.193 0.695 1.00 0.00 H new ATOM 958 N ASP A 59 23.125 7.683 -0.153 1.00 0.00 N ATOM 959 CA ASP A 59 21.827 7.056 0.038 1.00 0.00 C ATOM 960 C ASP A 59 22.078 5.645 0.538 1.00 0.00 C ATOM 961 O ASP A 59 23.065 5.066 0.087 1.00 0.00 O ATOM 962 CB ASP A 59 21.047 6.941 -1.270 1.00 0.00 C ATOM 963 CG ASP A 59 21.898 6.671 -2.476 1.00 0.00 C ATOM 964 OD1 ASP A 59 22.732 7.634 -2.799 1.00 0.00 O ATOM 965 OD2 ASP A 59 21.771 5.628 -3.061 1.00 0.00 O ATOM 0 H ASP A 59 23.745 7.215 -0.814 1.00 0.00 H new ATOM 0 HA ASP A 59 21.248 7.663 0.734 1.00 0.00 H new ATOM 0 HB2 ASP A 59 20.312 6.142 -1.172 1.00 0.00 H new ATOM 0 HB3 ASP A 59 20.492 7.865 -1.431 1.00 0.00 H new ATOM 970 N VAL A 60 21.209 5.181 1.408 1.00 0.00 N ATOM 971 CA VAL A 60 21.380 3.856 1.927 1.00 0.00 C ATOM 972 C VAL A 60 20.035 3.191 1.900 1.00 0.00 C ATOM 973 O VAL A 60 19.127 3.518 2.692 1.00 0.00 O ATOM 974 CB VAL A 60 21.958 3.955 3.348 1.00 0.00 C ATOM 975 CG1 VAL A 60 22.195 2.581 3.947 1.00 0.00 C ATOM 976 CG2 VAL A 60 23.272 4.692 3.320 1.00 0.00 C ATOM 0 H VAL A 60 20.399 5.691 1.760 1.00 0.00 H new ATOM 0 HA VAL A 60 22.076 3.262 1.335 1.00 0.00 H new ATOM 0 HB VAL A 60 21.231 4.491 3.959 1.00 0.00 H new ATOM 0 HG11 VAL A 60 22.604 2.688 4.952 1.00 0.00 H new ATOM 0 HG12 VAL A 60 21.251 2.037 3.995 1.00 0.00 H new ATOM 0 HG13 VAL A 60 22.900 2.030 3.325 1.00 0.00 H new ATOM 0 HG21 VAL A 60 23.674 4.757 4.331 1.00 0.00 H new ATOM 0 HG22 VAL A 60 23.976 4.156 2.683 1.00 0.00 H new ATOM 0 HG23 VAL A 60 23.118 5.696 2.925 1.00 0.00 H new ATOM 986 N VAL A 61 19.884 2.254 0.992 1.00 0.00 N ATOM 987 CA VAL A 61 18.636 1.491 0.813 1.00 0.00 C ATOM 988 C VAL A 61 18.794 0.192 1.537 1.00 0.00 C ATOM 989 O VAL A 61 19.754 -0.532 1.237 1.00 0.00 O ATOM 990 CB VAL A 61 18.435 1.239 -0.667 1.00 0.00 C ATOM 991 CG1 VAL A 61 16.931 1.152 -1.015 1.00 0.00 C ATOM 992 CG2 VAL A 61 19.058 2.312 -1.562 1.00 0.00 C ATOM 0 H VAL A 61 20.623 1.985 0.342 1.00 0.00 H new ATOM 0 HA VAL A 61 17.775 2.034 1.203 1.00 0.00 H new ATOM 0 HB VAL A 61 18.940 0.293 -0.862 1.00 0.00 H new ATOM 0 HG11 VAL A 61 16.815 0.971 -2.083 1.00 0.00 H new ATOM 0 HG12 VAL A 61 16.475 0.335 -0.456 1.00 0.00 H new ATOM 0 HG13 VAL A 61 16.442 2.089 -0.751 1.00 0.00 H new ATOM 0 HG21 VAL A 61 18.874 2.065 -2.608 1.00 0.00 H new ATOM 0 HG22 VAL A 61 18.612 3.280 -1.334 1.00 0.00 H new ATOM 0 HG23 VAL A 61 20.132 2.356 -1.383 1.00 0.00 H new ATOM 1002 N PHE A 62 17.934 -0.146 2.452 1.00 0.00 N ATOM 1003 CA PHE A 62 18.064 -1.387 3.161 1.00 0.00 C ATOM 1004 C PHE A 62 16.671 -1.804 3.639 1.00 0.00 C ATOM 1005 O PHE A 62 16.016 -0.958 4.263 1.00 0.00 O ATOM 1006 CB PHE A 62 18.977 -1.209 4.373 1.00 0.00 C ATOM 1007 CG PHE A 62 18.650 0.008 5.243 1.00 0.00 C ATOM 1008 CD1 PHE A 62 18.973 1.277 4.800 1.00 0.00 C ATOM 1009 CD2 PHE A 62 18.029 -0.081 6.489 1.00 0.00 C ATOM 1010 CE1 PHE A 62 18.691 2.411 5.562 1.00 0.00 C ATOM 1011 CE2 PHE A 62 17.744 1.028 7.253 1.00 0.00 C ATOM 1012 CZ PHE A 62 18.076 2.295 6.792 1.00 0.00 C ATOM 0 H PHE A 62 17.132 0.422 2.726 1.00 0.00 H new ATOM 0 HA PHE A 62 18.495 -2.145 2.507 1.00 0.00 H new ATOM 0 HB2 PHE A 62 18.920 -2.106 4.990 1.00 0.00 H new ATOM 0 HB3 PHE A 62 20.007 -1.125 4.027 1.00 0.00 H new ATOM 0 HD1 PHE A 62 19.455 1.393 3.841 1.00 0.00 H new ATOM 0 HD2 PHE A 62 17.762 -1.056 6.868 1.00 0.00 H new ATOM 0 HE1 PHE A 62 18.956 3.388 5.186 1.00 0.00 H new ATOM 0 HE2 PHE A 62 17.262 0.912 8.212 1.00 0.00 H new ATOM 0 HZ PHE A 62 17.857 3.172 7.384 1.00 0.00 H new ATOM 1022 N GLU A 63 16.344 -3.020 3.317 1.00 0.00 N ATOM 1023 CA GLU A 63 15.101 -3.708 3.609 1.00 0.00 C ATOM 1024 C GLU A 63 14.636 -3.446 5.007 1.00 0.00 C ATOM 1025 O GLU A 63 14.651 -4.364 5.843 1.00 0.00 O ATOM 1026 CB GLU A 63 15.123 -5.256 3.411 1.00 0.00 C ATOM 1027 CG GLU A 63 14.852 -5.622 1.931 1.00 0.00 C ATOM 1028 CD GLU A 63 15.304 -6.978 1.492 1.00 0.00 C ATOM 1029 OE1 GLU A 63 16.494 -7.221 1.364 1.00 0.00 O ATOM 1030 OE2 GLU A 63 14.346 -7.828 1.273 1.00 0.00 O ATOM 0 H GLU A 63 16.989 -3.616 2.798 1.00 0.00 H new ATOM 0 HA GLU A 63 14.417 -3.290 2.870 1.00 0.00 H new ATOM 0 HB2 GLU A 63 16.091 -5.653 3.718 1.00 0.00 H new ATOM 0 HB3 GLU A 63 14.371 -5.720 4.049 1.00 0.00 H new ATOM 0 HG2 GLU A 63 13.780 -5.543 1.749 1.00 0.00 H new ATOM 0 HG3 GLU A 63 15.338 -4.878 1.300 1.00 0.00 H new ATOM 1037 N LEU A 64 14.200 -2.221 5.317 1.00 0.00 N ATOM 1038 CA LEU A 64 13.705 -1.811 6.598 1.00 0.00 C ATOM 1039 C LEU A 64 14.741 -1.935 7.733 1.00 0.00 C ATOM 1040 O LEU A 64 15.177 -0.906 8.234 1.00 0.00 O ATOM 1041 CB LEU A 64 12.439 -2.646 6.956 1.00 0.00 C ATOM 1042 CG LEU A 64 11.127 -1.921 6.628 1.00 0.00 C ATOM 1043 CD1 LEU A 64 10.346 -2.737 5.593 1.00 0.00 C ATOM 1044 CD2 LEU A 64 10.238 -1.792 7.864 1.00 0.00 C ATOM 0 H LEU A 64 14.190 -1.464 4.634 1.00 0.00 H new ATOM 0 HA LEU A 64 13.464 -0.751 6.513 1.00 0.00 H new ATOM 0 HB2 LEU A 64 12.470 -3.592 6.415 1.00 0.00 H new ATOM 0 HB3 LEU A 64 12.458 -2.886 8.019 1.00 0.00 H new ATOM 0 HG LEU A 64 11.382 -0.929 6.254 1.00 0.00 H new ATOM 0 HD11 LEU A 64 9.413 -2.226 5.356 1.00 0.00 H new ATOM 0 HD12 LEU A 64 10.943 -2.841 4.687 1.00 0.00 H new ATOM 0 HD13 LEU A 64 10.126 -3.725 5.999 1.00 0.00 H new ATOM 0 HD21 LEU A 64 9.317 -1.274 7.597 1.00 0.00 H new ATOM 0 HD22 LEU A 64 9.999 -2.785 8.245 1.00 0.00 H new ATOM 0 HD23 LEU A 64 10.763 -1.225 8.633 1.00 0.00 H new ATOM 1056 N GLY A 65 15.036 -3.185 8.038 1.00 0.00 N ATOM 1057 CA GLY A 65 16.003 -3.453 9.106 1.00 0.00 C ATOM 1058 C GLY A 65 17.043 -4.490 8.744 1.00 0.00 C ATOM 1059 O GLY A 65 16.748 -5.679 8.578 1.00 0.00 O ATOM 0 H GLY A 65 14.641 -4.009 7.585 1.00 0.00 H new ATOM 0 HA2 GLY A 65 16.507 -2.523 9.368 1.00 0.00 H new ATOM 0 HA3 GLY A 65 15.466 -3.786 9.994 1.00 0.00 H new ATOM 1063 N VAL A 66 18.290 -4.059 8.616 1.00 0.00 N ATOM 1064 CA VAL A 66 19.397 -4.962 8.265 1.00 0.00 C ATOM 1065 C VAL A 66 20.593 -4.527 9.112 1.00 0.00 C ATOM 1066 O VAL A 66 20.928 -3.349 9.151 1.00 0.00 O ATOM 1067 CB VAL A 66 19.631 -4.854 6.778 1.00 0.00 C ATOM 1068 CG1 VAL A 66 19.849 -6.235 6.172 1.00 0.00 C ATOM 1069 CG2 VAL A 66 18.440 -4.236 6.048 1.00 0.00 C ATOM 0 H VAL A 66 18.570 -3.087 8.749 1.00 0.00 H new ATOM 0 HA VAL A 66 19.197 -6.013 8.474 1.00 0.00 H new ATOM 0 HB VAL A 66 20.508 -4.219 6.656 1.00 0.00 H new ATOM 0 HG11 VAL A 66 20.016 -6.139 5.099 1.00 0.00 H new ATOM 0 HG12 VAL A 66 20.718 -6.702 6.635 1.00 0.00 H new ATOM 0 HG13 VAL A 66 18.968 -6.853 6.348 1.00 0.00 H new ATOM 0 HG21 VAL A 66 18.657 -4.180 4.981 1.00 0.00 H new ATOM 0 HG22 VAL A 66 17.556 -4.853 6.207 1.00 0.00 H new ATOM 0 HG23 VAL A 66 18.257 -3.233 6.435 1.00 0.00 H new ATOM 1079 N ASP A 67 21.231 -5.481 9.784 1.00 0.00 N ATOM 1080 CA ASP A 67 22.380 -5.155 10.613 1.00 0.00 C ATOM 1081 C ASP A 67 23.436 -4.333 9.948 1.00 0.00 C ATOM 1082 O ASP A 67 23.623 -4.371 8.728 1.00 0.00 O ATOM 1083 CB ASP A 67 22.854 -6.361 11.457 1.00 0.00 C ATOM 1084 CG ASP A 67 22.500 -7.699 10.924 1.00 0.00 C ATOM 1085 OD1 ASP A 67 23.364 -8.175 10.060 1.00 0.00 O ATOM 1086 OD2 ASP A 67 21.492 -8.283 11.273 1.00 0.00 O ATOM 0 H ASP A 67 20.976 -6.468 9.770 1.00 0.00 H new ATOM 0 HA ASP A 67 22.028 -4.438 11.355 1.00 0.00 H new ATOM 0 HB2 ASP A 67 23.938 -6.306 11.559 1.00 0.00 H new ATOM 0 HB3 ASP A 67 22.435 -6.267 12.459 1.00 0.00 H new ATOM 1091 N PHE A 68 24.137 -3.579 10.787 1.00 0.00 N ATOM 1092 CA PHE A 68 25.198 -2.732 10.258 1.00 0.00 C ATOM 1093 C PHE A 68 26.486 -2.817 11.035 1.00 0.00 C ATOM 1094 O PHE A 68 27.344 -3.627 10.656 1.00 0.00 O ATOM 1095 CB PHE A 68 24.719 -1.248 10.074 1.00 0.00 C ATOM 1096 CG PHE A 68 23.680 -1.030 9.023 1.00 0.00 C ATOM 1097 CD1 PHE A 68 23.890 -1.629 7.776 1.00 0.00 C ATOM 1098 CD2 PHE A 68 22.506 -0.286 9.153 1.00 0.00 C ATOM 1099 CE1 PHE A 68 23.004 -1.507 6.719 1.00 0.00 C ATOM 1100 CE2 PHE A 68 21.594 -0.155 8.081 1.00 0.00 C ATOM 1101 CZ PHE A 68 21.855 -0.769 6.873 1.00 0.00 C ATOM 0 H PHE A 68 23.999 -3.535 11.797 1.00 0.00 H new ATOM 0 HA PHE A 68 25.429 -3.131 9.270 1.00 0.00 H new ATOM 0 HB2 PHE A 68 24.327 -0.891 11.026 1.00 0.00 H new ATOM 0 HB3 PHE A 68 25.586 -0.632 9.835 1.00 0.00 H new ATOM 0 HD1 PHE A 68 24.786 -2.214 7.631 1.00 0.00 H new ATOM 0 HD2 PHE A 68 22.290 0.200 10.093 1.00 0.00 H new ATOM 0 HE1 PHE A 68 23.215 -1.990 5.777 1.00 0.00 H new ATOM 0 HE2 PHE A 68 20.692 0.426 8.207 1.00 0.00 H new ATOM 0 HZ PHE A 68 21.160 -0.670 6.053 1.00 0.00 H new ATOM 1111 N ALA A 69 26.579 -2.000 12.065 1.00 0.00 N ATOM 1112 CA ALA A 69 27.698 -1.882 12.966 1.00 0.00 C ATOM 1113 C ALA A 69 28.695 -0.860 12.400 1.00 0.00 C ATOM 1114 O ALA A 69 29.904 -1.017 12.527 1.00 0.00 O ATOM 1115 CB ALA A 69 28.409 -3.200 13.196 1.00 0.00 C ATOM 0 H ALA A 69 25.822 -1.360 12.307 1.00 0.00 H new ATOM 0 HA ALA A 69 27.307 -1.554 13.929 1.00 0.00 H new ATOM 0 HB1 ALA A 69 29.242 -3.049 13.882 1.00 0.00 H new ATOM 0 HB2 ALA A 69 27.712 -3.920 13.625 1.00 0.00 H new ATOM 0 HB3 ALA A 69 28.785 -3.581 12.247 1.00 0.00 H new ATOM 1121 N TYR A 70 28.107 0.151 11.797 1.00 0.00 N ATOM 1122 CA TYR A 70 28.805 1.261 11.178 1.00 0.00 C ATOM 1123 C TYR A 70 28.379 2.485 11.975 1.00 0.00 C ATOM 1124 O TYR A 70 27.220 2.788 11.867 1.00 0.00 O ATOM 1125 CB TYR A 70 28.417 1.455 9.704 1.00 0.00 C ATOM 1126 CG TYR A 70 28.259 2.931 9.291 1.00 0.00 C ATOM 1127 CD1 TYR A 70 29.292 3.857 9.256 1.00 0.00 C ATOM 1128 CD2 TYR A 70 27.009 3.396 8.922 1.00 0.00 C ATOM 1129 CE1 TYR A 70 29.115 5.187 8.878 1.00 0.00 C ATOM 1130 CE2 TYR A 70 26.759 4.728 8.528 1.00 0.00 C ATOM 1131 CZ TYR A 70 27.832 5.623 8.512 1.00 0.00 C ATOM 1132 OH TYR A 70 27.577 6.921 8.126 1.00 0.00 O ATOM 0 H TYR A 70 27.093 0.227 11.721 1.00 0.00 H new ATOM 0 HA TYR A 70 29.881 1.086 11.187 1.00 0.00 H new ATOM 0 HB2 TYR A 70 29.176 0.991 9.074 1.00 0.00 H new ATOM 0 HB3 TYR A 70 27.480 0.932 9.513 1.00 0.00 H new ATOM 0 HD1 TYR A 70 30.283 3.531 9.536 1.00 0.00 H new ATOM 0 HD2 TYR A 70 26.181 2.703 8.936 1.00 0.00 H new ATOM 0 HE1 TYR A 70 29.951 5.871 8.867 1.00 0.00 H new ATOM 0 HE2 TYR A 70 25.766 5.047 8.247 1.00 0.00 H new ATOM 0 HH TYR A 70 26.626 7.018 7.912 1.00 0.00 H new ATOM 1142 N SER A 71 29.328 3.070 12.699 1.00 0.00 N ATOM 1143 CA SER A 71 29.190 4.209 13.532 1.00 0.00 C ATOM 1144 C SER A 71 28.242 5.270 13.010 1.00 0.00 C ATOM 1145 O SER A 71 27.861 5.390 11.848 1.00 0.00 O ATOM 1146 CB SER A 71 30.497 4.958 13.790 1.00 0.00 C ATOM 1147 OG SER A 71 30.661 6.131 13.028 1.00 0.00 O ATOM 0 H SER A 71 30.283 2.713 12.702 1.00 0.00 H new ATOM 0 HA SER A 71 28.801 3.749 14.440 1.00 0.00 H new ATOM 0 HB2 SER A 71 30.549 5.217 14.847 1.00 0.00 H new ATOM 0 HB3 SER A 71 31.331 4.287 13.585 1.00 0.00 H new ATOM 0 HG SER A 71 31.518 6.550 13.253 1.00 0.00 H new ATOM 1153 N LEU A 72 27.864 6.087 13.979 1.00 0.00 N ATOM 1154 CA LEU A 72 26.969 7.209 13.748 1.00 0.00 C ATOM 1155 C LEU A 72 27.905 8.285 13.245 1.00 0.00 C ATOM 1156 O LEU A 72 28.593 9.010 13.998 1.00 0.00 O ATOM 1157 CB LEU A 72 26.220 7.604 15.003 1.00 0.00 C ATOM 1158 CG LEU A 72 26.190 9.059 15.396 1.00 0.00 C ATOM 1159 CD1 LEU A 72 27.353 9.480 16.308 1.00 0.00 C ATOM 1160 CD2 LEU A 72 26.005 10.009 14.226 1.00 0.00 C ATOM 0 H LEU A 72 28.169 5.991 14.948 1.00 0.00 H new ATOM 0 HA LEU A 72 26.169 6.992 13.040 1.00 0.00 H new ATOM 0 HB2 LEU A 72 25.189 7.269 14.892 1.00 0.00 H new ATOM 0 HB3 LEU A 72 26.649 7.045 15.835 1.00 0.00 H new ATOM 0 HG LEU A 72 25.287 9.149 16.000 1.00 0.00 H new ATOM 0 HD11 LEU A 72 27.263 10.540 16.547 1.00 0.00 H new ATOM 0 HD12 LEU A 72 27.324 8.896 17.228 1.00 0.00 H new ATOM 0 HD13 LEU A 72 28.299 9.303 15.796 1.00 0.00 H new ATOM 0 HD21 LEU A 72 25.994 11.036 14.590 1.00 0.00 H new ATOM 0 HD22 LEU A 72 26.827 9.883 13.521 1.00 0.00 H new ATOM 0 HD23 LEU A 72 25.061 9.791 13.726 1.00 0.00 H new ATOM 1172 N ALA A 73 27.965 8.388 11.922 1.00 0.00 N ATOM 1173 CA ALA A 73 28.771 9.293 11.133 1.00 0.00 C ATOM 1174 C ALA A 73 29.934 9.930 11.874 1.00 0.00 C ATOM 1175 O ALA A 73 30.055 11.156 11.755 1.00 0.00 O ATOM 1176 CB ALA A 73 27.945 10.303 10.301 1.00 0.00 C ATOM 0 H ALA A 73 27.398 7.783 11.328 1.00 0.00 H new ATOM 0 HA ALA A 73 29.249 8.638 10.405 1.00 0.00 H new ATOM 0 HB1 ALA A 73 28.619 10.947 9.737 1.00 0.00 H new ATOM 0 HB2 ALA A 73 27.297 9.762 9.611 1.00 0.00 H new ATOM 0 HB3 ALA A 73 27.336 10.912 10.969 1.00 0.00 H new ATOM 1182 N ASP A 74 30.728 9.138 12.597 1.00 0.00 N ATOM 1183 CA ASP A 74 31.895 9.523 13.382 1.00 0.00 C ATOM 1184 C ASP A 74 31.883 9.157 14.864 1.00 0.00 C ATOM 1185 O ASP A 74 32.610 9.734 15.687 1.00 0.00 O ATOM 1186 CB ASP A 74 32.493 10.884 13.166 1.00 0.00 C ATOM 1187 CG ASP A 74 33.164 10.980 11.789 1.00 0.00 C ATOM 1188 OD1 ASP A 74 32.531 11.342 10.731 1.00 0.00 O ATOM 1189 OD2 ASP A 74 34.425 10.671 11.711 1.00 0.00 O ATOM 0 H ASP A 74 30.556 8.134 12.651 1.00 0.00 H new ATOM 0 HA ASP A 74 32.590 8.841 12.893 1.00 0.00 H new ATOM 0 HB2 ASP A 74 31.716 11.644 13.249 1.00 0.00 H new ATOM 0 HB3 ASP A 74 33.225 11.091 13.946 1.00 0.00 H new ATOM 1194 N GLY A 75 31.079 8.191 15.298 1.00 0.00 N ATOM 1195 CA GLY A 75 31.038 7.783 16.712 1.00 0.00 C ATOM 1196 C GLY A 75 31.945 6.527 16.913 1.00 0.00 C ATOM 1197 O GLY A 75 33.164 6.612 17.002 1.00 0.00 O ATOM 0 H GLY A 75 30.443 7.670 14.694 1.00 0.00 H new ATOM 0 HA2 GLY A 75 31.381 8.599 17.348 1.00 0.00 H new ATOM 0 HA3 GLY A 75 30.013 7.557 17.008 1.00 0.00 H new ATOM 1201 N THR A 76 31.343 5.379 16.972 1.00 0.00 N ATOM 1202 CA THR A 76 32.009 4.120 17.136 1.00 0.00 C ATOM 1203 C THR A 76 31.311 2.962 16.401 1.00 0.00 C ATOM 1204 O THR A 76 32.053 2.084 15.947 1.00 0.00 O ATOM 1205 CB THR A 76 32.161 3.782 18.644 1.00 0.00 C ATOM 1206 OG1 THR A 76 33.285 2.972 18.731 1.00 0.00 O ATOM 1207 CG2 THR A 76 31.020 2.998 19.249 1.00 0.00 C ATOM 0 H THR A 76 30.329 5.288 16.904 1.00 0.00 H new ATOM 0 HA THR A 76 32.993 4.230 16.681 1.00 0.00 H new ATOM 0 HB THR A 76 32.207 4.726 19.186 1.00 0.00 H new ATOM 0 HG1 THR A 76 33.437 2.723 19.667 1.00 0.00 H new ATOM 0 HG21 THR A 76 31.224 2.814 20.304 1.00 0.00 H new ATOM 0 HG22 THR A 76 30.096 3.567 19.152 1.00 0.00 H new ATOM 0 HG23 THR A 76 30.916 2.046 18.728 1.00 0.00 H new ATOM 1215 N GLU A 77 29.996 2.965 16.301 1.00 0.00 N ATOM 1216 CA GLU A 77 29.293 1.864 15.628 1.00 0.00 C ATOM 1217 C GLU A 77 27.777 2.036 15.764 1.00 0.00 C ATOM 1218 O GLU A 77 27.361 2.671 16.711 1.00 0.00 O ATOM 1219 CB GLU A 77 29.504 0.573 16.464 1.00 0.00 C ATOM 1220 CG GLU A 77 30.470 -0.462 15.892 1.00 0.00 C ATOM 1221 CD GLU A 77 31.719 -0.683 16.698 1.00 0.00 C ATOM 1222 OE1 GLU A 77 32.085 -0.021 17.627 1.00 0.00 O ATOM 1223 OE2 GLU A 77 32.402 -1.723 16.259 1.00 0.00 O ATOM 0 H GLU A 77 29.391 3.700 16.667 1.00 0.00 H new ATOM 0 HA GLU A 77 29.649 1.836 14.598 1.00 0.00 H new ATOM 0 HB2 GLU A 77 29.861 0.862 17.453 1.00 0.00 H new ATOM 0 HB3 GLU A 77 28.535 0.094 16.602 1.00 0.00 H new ATOM 0 HG2 GLU A 77 29.945 -1.412 15.797 1.00 0.00 H new ATOM 0 HG3 GLU A 77 30.755 -0.153 14.886 1.00 0.00 H new ATOM 1230 N LEU A 78 26.965 1.471 14.896 1.00 0.00 N ATOM 1231 CA LEU A 78 25.516 1.590 15.055 1.00 0.00 C ATOM 1232 C LEU A 78 24.927 0.257 14.535 1.00 0.00 C ATOM 1233 O LEU A 78 24.376 0.090 13.446 1.00 0.00 O ATOM 1234 CB LEU A 78 24.961 2.728 14.174 1.00 0.00 C ATOM 1235 CG LEU A 78 24.195 3.891 14.828 1.00 0.00 C ATOM 1236 CD1 LEU A 78 25.249 4.962 15.157 1.00 0.00 C ATOM 1237 CD2 LEU A 78 23.278 4.596 13.850 1.00 0.00 C ATOM 0 H LEU A 78 27.268 0.932 14.084 1.00 0.00 H new ATOM 0 HA LEU A 78 25.260 1.800 16.094 1.00 0.00 H new ATOM 0 HB2 LEU A 78 25.801 3.157 13.628 1.00 0.00 H new ATOM 0 HB3 LEU A 78 24.299 2.276 13.436 1.00 0.00 H new ATOM 0 HG LEU A 78 23.628 3.493 15.669 1.00 0.00 H new ATOM 0 HD11 LEU A 78 24.764 5.818 15.626 1.00 0.00 H new ATOM 0 HD12 LEU A 78 25.990 4.546 15.840 1.00 0.00 H new ATOM 0 HD13 LEU A 78 25.741 5.282 14.239 1.00 0.00 H new ATOM 0 HD21 LEU A 78 22.760 5.409 14.359 1.00 0.00 H new ATOM 0 HD22 LEU A 78 23.866 5.000 13.026 1.00 0.00 H new ATOM 0 HD23 LEU A 78 22.547 3.887 13.461 1.00 0.00 H new ATOM 1249 N THR A 79 25.066 -0.730 15.378 1.00 0.00 N ATOM 1250 CA THR A 79 24.596 -2.087 15.123 1.00 0.00 C ATOM 1251 C THR A 79 23.136 -2.212 15.554 1.00 0.00 C ATOM 1252 O THR A 79 22.632 -1.401 16.330 1.00 0.00 O ATOM 1253 CB THR A 79 25.371 -3.215 15.860 1.00 0.00 C ATOM 1254 OG1 THR A 79 26.309 -3.759 14.961 1.00 0.00 O ATOM 1255 CG2 THR A 79 24.543 -4.307 16.514 1.00 0.00 C ATOM 0 H THR A 79 25.518 -0.622 16.286 1.00 0.00 H new ATOM 0 HA THR A 79 24.751 -2.228 14.053 1.00 0.00 H new ATOM 0 HB THR A 79 25.846 -2.738 16.717 1.00 0.00 H new ATOM 0 HG1 THR A 79 25.840 -4.264 14.265 1.00 0.00 H new ATOM 0 HG21 THR A 79 25.205 -5.029 16.992 1.00 0.00 H new ATOM 0 HG22 THR A 79 23.886 -3.866 17.263 1.00 0.00 H new ATOM 0 HG23 THR A 79 23.943 -4.811 15.757 1.00 0.00 H new ATOM 1263 N GLY A 80 22.426 -3.208 15.075 1.00 0.00 N ATOM 1264 CA GLY A 80 21.038 -3.437 15.406 1.00 0.00 C ATOM 1265 C GLY A 80 20.289 -3.597 14.069 1.00 0.00 C ATOM 1266 O GLY A 80 20.611 -4.454 13.270 1.00 0.00 O ATOM 0 H GLY A 80 22.807 -3.898 14.428 1.00 0.00 H new ATOM 0 HA2 GLY A 80 20.928 -4.330 16.021 1.00 0.00 H new ATOM 0 HA3 GLY A 80 20.633 -2.603 15.980 1.00 0.00 H new ATOM 1270 N THR A 81 19.308 -2.731 13.919 1.00 0.00 N ATOM 1271 CA THR A 81 18.478 -2.734 12.706 1.00 0.00 C ATOM 1272 C THR A 81 17.319 -1.782 12.767 1.00 0.00 C ATOM 1273 O THR A 81 16.339 -1.890 13.500 1.00 0.00 O ATOM 1274 CB THR A 81 17.908 -4.152 12.488 1.00 0.00 C ATOM 1275 OG1 THR A 81 18.346 -4.625 11.205 1.00 0.00 O ATOM 1276 CG2 THR A 81 16.408 -4.329 12.572 1.00 0.00 C ATOM 0 H THR A 81 19.058 -2.020 14.606 1.00 0.00 H new ATOM 0 HA THR A 81 19.127 -2.416 11.890 1.00 0.00 H new ATOM 0 HB THR A 81 18.292 -4.724 13.332 1.00 0.00 H new ATOM 0 HG1 THR A 81 17.942 -5.499 11.023 1.00 0.00 H new ATOM 0 HG21 THR A 81 16.155 -5.375 12.398 1.00 0.00 H new ATOM 0 HG22 THR A 81 16.061 -4.031 13.562 1.00 0.00 H new ATOM 0 HG23 THR A 81 15.926 -3.709 11.817 1.00 0.00 H new ATOM 1284 N TRP A 82 17.386 -0.740 11.955 1.00 0.00 N ATOM 1285 CA TRP A 82 16.380 0.288 11.862 1.00 0.00 C ATOM 1286 C TRP A 82 15.141 -0.532 11.394 1.00 0.00 C ATOM 1287 O TRP A 82 15.181 -1.739 11.135 1.00 0.00 O ATOM 1288 CB TRP A 82 16.470 1.317 10.739 1.00 0.00 C ATOM 1289 CG TRP A 82 17.745 1.923 10.332 1.00 0.00 C ATOM 1290 CD1 TRP A 82 18.994 1.442 10.269 1.00 0.00 C ATOM 1291 CD2 TRP A 82 17.851 3.273 9.863 1.00 0.00 C ATOM 1292 NE1 TRP A 82 19.833 2.421 9.791 1.00 0.00 N ATOM 1293 CE2 TRP A 82 19.173 3.590 9.521 1.00 0.00 C ATOM 1294 CE3 TRP A 82 16.922 4.319 9.681 1.00 0.00 C ATOM 1295 CZ2 TRP A 82 19.531 4.833 9.046 1.00 0.00 C ATOM 1296 CZ3 TRP A 82 17.268 5.554 9.224 1.00 0.00 C ATOM 1297 CH2 TRP A 82 18.584 5.820 8.898 1.00 0.00 C ATOM 0 H TRP A 82 18.172 -0.588 11.323 1.00 0.00 H new ATOM 0 HA TRP A 82 16.417 0.836 12.804 1.00 0.00 H new ATOM 0 HB2 TRP A 82 16.048 0.848 9.850 1.00 0.00 H new ATOM 0 HB3 TRP A 82 15.806 2.137 11.012 1.00 0.00 H new ATOM 0 HD1 TRP A 82 19.294 0.443 10.549 1.00 0.00 H new ATOM 0 HE1 TRP A 82 20.835 2.291 9.653 1.00 0.00 H new ATOM 0 HE3 TRP A 82 15.885 4.131 9.916 1.00 0.00 H new ATOM 0 HZ2 TRP A 82 20.561 5.034 8.789 1.00 0.00 H new ATOM 0 HZ3 TRP A 82 16.517 6.323 9.117 1.00 0.00 H new ATOM 0 HH2 TRP A 82 18.867 6.795 8.530 1.00 0.00 H new ATOM 1308 N THR A 83 14.039 0.167 11.232 1.00 0.00 N ATOM 1309 CA THR A 83 12.752 -0.295 10.761 1.00 0.00 C ATOM 1310 C THR A 83 11.762 0.833 11.063 1.00 0.00 C ATOM 1311 O THR A 83 12.113 1.739 11.772 1.00 0.00 O ATOM 1312 CB THR A 83 12.134 -1.556 11.373 1.00 0.00 C ATOM 1313 OG1 THR A 83 12.210 -1.424 12.772 1.00 0.00 O ATOM 1314 CG2 THR A 83 12.765 -2.873 10.925 1.00 0.00 C ATOM 0 H THR A 83 14.020 1.164 11.446 1.00 0.00 H new ATOM 0 HA THR A 83 12.933 -0.558 9.719 1.00 0.00 H new ATOM 0 HB THR A 83 11.106 -1.621 11.017 1.00 0.00 H new ATOM 0 HG1 THR A 83 11.820 -2.216 13.197 1.00 0.00 H new ATOM 0 HG21 THR A 83 12.257 -3.705 11.414 1.00 0.00 H new ATOM 0 HG22 THR A 83 12.668 -2.974 9.844 1.00 0.00 H new ATOM 0 HG23 THR A 83 13.820 -2.882 11.197 1.00 0.00 H new ATOM 1322 N MET A 84 10.592 0.701 10.507 1.00 0.00 N ATOM 1323 CA MET A 84 9.538 1.696 10.715 1.00 0.00 C ATOM 1324 C MET A 84 8.306 0.821 10.927 1.00 0.00 C ATOM 1325 O MET A 84 8.492 -0.335 11.328 1.00 0.00 O ATOM 1326 CB MET A 84 9.394 2.376 9.350 1.00 0.00 C ATOM 1327 CG MET A 84 9.094 1.420 8.183 1.00 0.00 C ATOM 1328 SD MET A 84 8.006 2.098 6.921 1.00 0.00 S ATOM 1329 CE MET A 84 7.440 0.573 6.147 1.00 0.00 C ATOM 0 H MET A 84 10.328 -0.079 9.904 1.00 0.00 H new ATOM 0 HA MET A 84 9.700 2.419 11.514 1.00 0.00 H new ATOM 0 HB2 MET A 84 8.595 3.115 9.410 1.00 0.00 H new ATOM 0 HB3 MET A 84 10.314 2.918 9.130 1.00 0.00 H new ATOM 0 HG2 MET A 84 10.035 1.131 7.716 1.00 0.00 H new ATOM 0 HG3 MET A 84 8.644 0.511 8.582 1.00 0.00 H new ATOM 0 HE1 MET A 84 6.751 0.810 5.336 1.00 0.00 H new ATOM 0 HE2 MET A 84 8.296 0.028 5.748 1.00 0.00 H new ATOM 0 HE3 MET A 84 6.930 -0.043 6.887 1.00 0.00 H new ATOM 1339 N GLU A 85 7.112 1.316 10.660 1.00 0.00 N ATOM 1340 CA GLU A 85 5.952 0.430 10.837 1.00 0.00 C ATOM 1341 C GLU A 85 4.864 0.831 9.920 1.00 0.00 C ATOM 1342 O GLU A 85 4.258 -0.036 9.288 1.00 0.00 O ATOM 1343 CB GLU A 85 5.564 0.482 12.317 1.00 0.00 C ATOM 1344 CG GLU A 85 4.471 -0.531 12.623 1.00 0.00 C ATOM 1345 CD GLU A 85 3.089 -0.067 13.004 1.00 0.00 C ATOM 1346 OE1 GLU A 85 2.901 0.778 13.852 1.00 0.00 O ATOM 1347 OE2 GLU A 85 2.145 -0.674 12.322 1.00 0.00 O ATOM 0 H GLU A 85 6.913 2.264 10.339 1.00 0.00 H new ATOM 0 HA GLU A 85 6.180 -0.604 10.579 1.00 0.00 H new ATOM 0 HB2 GLU A 85 6.439 0.278 12.935 1.00 0.00 H new ATOM 0 HB3 GLU A 85 5.220 1.484 12.573 1.00 0.00 H new ATOM 0 HG2 GLU A 85 4.367 -1.168 11.745 1.00 0.00 H new ATOM 0 HG3 GLU A 85 4.834 -1.163 13.434 1.00 0.00 H new ATOM 1354 N GLY A 86 4.611 2.115 9.839 1.00 0.00 N ATOM 1355 CA GLY A 86 3.567 2.585 8.977 1.00 0.00 C ATOM 1356 C GLY A 86 3.380 4.023 9.403 1.00 0.00 C ATOM 1357 O GLY A 86 3.243 4.856 8.532 1.00 0.00 O ATOM 0 H GLY A 86 5.109 2.841 10.354 1.00 0.00 H new ATOM 0 HA2 GLY A 86 3.849 2.511 7.927 1.00 0.00 H new ATOM 0 HA3 GLY A 86 2.652 2.007 9.103 1.00 0.00 H new ATOM 1361 N ASN A 87 3.390 4.225 10.702 1.00 0.00 N ATOM 1362 CA ASN A 87 3.225 5.550 11.178 1.00 0.00 C ATOM 1363 C ASN A 87 4.532 6.152 11.696 1.00 0.00 C ATOM 1364 O ASN A 87 4.570 7.243 12.211 1.00 0.00 O ATOM 1365 CB ASN A 87 1.967 5.766 12.006 1.00 0.00 C ATOM 1366 CG ASN A 87 0.995 4.640 11.754 1.00 0.00 C ATOM 1367 OD1 ASN A 87 0.796 3.749 12.597 1.00 0.00 O ATOM 1368 ND2 ASN A 87 0.394 4.710 10.571 1.00 0.00 N ATOM 0 H ASN A 87 3.507 3.505 11.415 1.00 0.00 H new ATOM 0 HA ASN A 87 2.998 6.178 10.317 1.00 0.00 H new ATOM 0 HB2 ASN A 87 2.220 5.811 13.065 1.00 0.00 H new ATOM 0 HB3 ASN A 87 1.509 6.720 11.747 1.00 0.00 H new ATOM 0 HD21 ASN A 87 -0.285 3.999 10.301 1.00 0.00 H new ATOM 0 HD22 ASN A 87 0.612 5.475 9.933 1.00 0.00 H new ATOM 1375 N LYS A 88 5.591 5.398 11.534 1.00 0.00 N ATOM 1376 CA LYS A 88 6.874 5.828 11.968 1.00 0.00 C ATOM 1377 C LYS A 88 7.995 4.815 11.688 1.00 0.00 C ATOM 1378 O LYS A 88 7.810 3.627 11.764 1.00 0.00 O ATOM 1379 CB LYS A 88 7.068 5.959 13.465 1.00 0.00 C ATOM 1380 CG LYS A 88 6.570 4.833 14.299 1.00 0.00 C ATOM 1381 CD LYS A 88 6.921 5.166 15.741 1.00 0.00 C ATOM 1382 CE LYS A 88 8.108 4.385 16.259 1.00 0.00 C ATOM 1383 NZ LYS A 88 7.757 3.076 16.773 1.00 0.00 N ATOM 0 H LYS A 88 5.577 4.476 11.099 1.00 0.00 H new ATOM 0 HA LYS A 88 6.923 6.773 11.428 1.00 0.00 H new ATOM 0 HB2 LYS A 88 8.133 6.084 13.661 1.00 0.00 H new ATOM 0 HB3 LYS A 88 6.573 6.873 13.795 1.00 0.00 H new ATOM 0 HG2 LYS A 88 5.493 4.711 14.181 1.00 0.00 H new ATOM 0 HG3 LYS A 88 7.032 3.893 13.996 1.00 0.00 H new ATOM 0 HD2 LYS A 88 7.133 6.232 15.820 1.00 0.00 H new ATOM 0 HD3 LYS A 88 6.057 4.965 16.375 1.00 0.00 H new ATOM 0 HE2 LYS A 88 8.835 4.268 15.455 1.00 0.00 H new ATOM 0 HE3 LYS A 88 8.594 4.958 17.048 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 8.614 2.595 17.111 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 7.085 3.181 17.560 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 7.319 2.512 16.017 1.00 0.00 H new ATOM 1397 N LEU A 89 9.139 5.415 11.388 1.00 0.00 N ATOM 1398 CA LEU A 89 10.383 4.745 11.129 1.00 0.00 C ATOM 1399 C LEU A 89 10.870 4.404 12.553 1.00 0.00 C ATOM 1400 O LEU A 89 10.095 4.538 13.482 1.00 0.00 O ATOM 1401 CB LEU A 89 11.415 5.698 10.454 1.00 0.00 C ATOM 1402 CG LEU A 89 12.111 5.192 9.177 1.00 0.00 C ATOM 1403 CD1 LEU A 89 13.272 6.158 8.905 1.00 0.00 C ATOM 1404 CD2 LEU A 89 12.707 3.811 9.350 1.00 0.00 C ATOM 0 H LEU A 89 9.217 6.430 11.318 1.00 0.00 H new ATOM 0 HA LEU A 89 10.272 3.891 10.461 1.00 0.00 H new ATOM 0 HB2 LEU A 89 10.906 6.631 10.214 1.00 0.00 H new ATOM 0 HB3 LEU A 89 12.186 5.935 11.187 1.00 0.00 H new ATOM 0 HG LEU A 89 11.378 5.144 8.372 1.00 0.00 H new ATOM 0 HD11 LEU A 89 13.803 5.845 8.006 1.00 0.00 H new ATOM 0 HD12 LEU A 89 12.881 7.166 8.763 1.00 0.00 H new ATOM 0 HD13 LEU A 89 13.958 6.150 9.752 1.00 0.00 H new ATOM 0 HD21 LEU A 89 13.185 3.502 8.421 1.00 0.00 H new ATOM 0 HD22 LEU A 89 13.447 3.832 10.150 1.00 0.00 H new ATOM 0 HD23 LEU A 89 11.918 3.103 9.605 1.00 0.00 H new ATOM 1416 N VAL A 90 12.119 4.012 12.594 1.00 0.00 N ATOM 1417 CA VAL A 90 12.864 3.668 13.759 1.00 0.00 C ATOM 1418 C VAL A 90 14.319 3.480 13.271 1.00 0.00 C ATOM 1419 O VAL A 90 14.641 2.397 12.806 1.00 0.00 O ATOM 1420 CB VAL A 90 12.386 2.406 14.472 1.00 0.00 C ATOM 1421 CG1 VAL A 90 12.612 2.493 15.980 1.00 0.00 C ATOM 1422 CG2 VAL A 90 10.911 2.133 14.322 1.00 0.00 C ATOM 0 H VAL A 90 12.675 3.921 11.744 1.00 0.00 H new ATOM 0 HA VAL A 90 12.747 4.457 14.502 1.00 0.00 H new ATOM 0 HB VAL A 90 12.968 1.615 13.999 1.00 0.00 H new ATOM 0 HG11 VAL A 90 12.260 1.577 16.454 1.00 0.00 H new ATOM 0 HG12 VAL A 90 13.676 2.620 16.182 1.00 0.00 H new ATOM 0 HG13 VAL A 90 12.062 3.344 16.382 1.00 0.00 H new ATOM 0 HG21 VAL A 90 10.654 1.219 14.858 1.00 0.00 H new ATOM 0 HG22 VAL A 90 10.343 2.967 14.734 1.00 0.00 H new ATOM 0 HG23 VAL A 90 10.668 2.015 13.266 1.00 0.00 H new ATOM 1432 N GLY A 91 15.077 4.558 13.396 1.00 0.00 N ATOM 1433 CA GLY A 91 16.468 4.580 13.014 1.00 0.00 C ATOM 1434 C GLY A 91 17.051 3.295 13.622 1.00 0.00 C ATOM 1435 O GLY A 91 17.907 2.689 13.007 1.00 0.00 O ATOM 0 H GLY A 91 14.736 5.444 13.768 1.00 0.00 H new ATOM 0 HA2 GLY A 91 16.582 4.594 11.930 1.00 0.00 H new ATOM 0 HA3 GLY A 91 16.972 5.466 13.399 1.00 0.00 H new ATOM 1439 N LYS A 92 16.480 3.001 14.750 1.00 0.00 N ATOM 1440 CA LYS A 92 16.750 1.828 15.533 1.00 0.00 C ATOM 1441 C LYS A 92 18.169 1.386 15.428 1.00 0.00 C ATOM 1442 O LYS A 92 18.664 0.780 14.515 1.00 0.00 O ATOM 1443 CB LYS A 92 15.879 0.628 15.137 1.00 0.00 C ATOM 1444 CG LYS A 92 15.274 -0.147 16.269 1.00 0.00 C ATOM 1445 CD LYS A 92 16.285 -0.210 17.409 1.00 0.00 C ATOM 1446 CE LYS A 92 15.972 -1.251 18.424 1.00 0.00 C ATOM 1447 NZ LYS A 92 16.828 -1.104 19.623 1.00 0.00 N ATOM 0 H LYS A 92 15.775 3.604 15.174 1.00 0.00 H new ATOM 0 HA LYS A 92 16.520 2.134 16.554 1.00 0.00 H new ATOM 0 HB2 LYS A 92 15.073 0.985 14.496 1.00 0.00 H new ATOM 0 HB3 LYS A 92 16.484 -0.053 14.539 1.00 0.00 H new ATOM 0 HG2 LYS A 92 14.354 0.330 16.605 1.00 0.00 H new ATOM 0 HG3 LYS A 92 15.010 -1.152 15.941 1.00 0.00 H new ATOM 0 HD2 LYS A 92 17.275 -0.403 16.996 1.00 0.00 H new ATOM 0 HD3 LYS A 92 16.329 0.763 17.899 1.00 0.00 H new ATOM 0 HE2 LYS A 92 14.923 -1.179 18.712 1.00 0.00 H new ATOM 0 HE3 LYS A 92 16.116 -2.241 17.990 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 16.588 -1.843 20.314 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 17.827 -1.197 19.350 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 16.671 -0.168 20.049 1.00 0.00 H new ATOM 1461 N PHE A 93 18.873 1.693 16.530 1.00 0.00 N ATOM 1462 CA PHE A 93 20.233 1.335 16.743 1.00 0.00 C ATOM 1463 C PHE A 93 20.505 1.028 18.224 1.00 0.00 C ATOM 1464 O PHE A 93 19.706 1.211 19.154 1.00 0.00 O ATOM 1465 CB PHE A 93 21.251 2.407 16.324 1.00 0.00 C ATOM 1466 CG PHE A 93 20.906 3.012 14.991 1.00 0.00 C ATOM 1467 CD1 PHE A 93 20.076 4.100 14.822 1.00 0.00 C ATOM 1468 CD2 PHE A 93 21.452 2.420 13.845 1.00 0.00 C ATOM 1469 CE1 PHE A 93 19.813 4.595 13.550 1.00 0.00 C ATOM 1470 CE2 PHE A 93 21.209 2.880 12.551 1.00 0.00 C ATOM 1471 CZ PHE A 93 20.388 3.978 12.432 1.00 0.00 C ATOM 0 H PHE A 93 18.471 2.216 17.308 1.00 0.00 H new ATOM 0 HA PHE A 93 20.369 0.458 16.110 1.00 0.00 H new ATOM 0 HB2 PHE A 93 21.286 3.191 17.081 1.00 0.00 H new ATOM 0 HB3 PHE A 93 22.246 1.965 16.276 1.00 0.00 H new ATOM 0 HD1 PHE A 93 19.627 4.571 15.684 1.00 0.00 H new ATOM 0 HD2 PHE A 93 22.095 1.562 13.970 1.00 0.00 H new ATOM 0 HE1 PHE A 93 19.168 5.452 13.424 1.00 0.00 H new ATOM 0 HE2 PHE A 93 21.643 2.399 11.687 1.00 0.00 H new ATOM 0 HZ PHE A 93 20.181 4.375 11.449 1.00 0.00 H new ATOM 1481 N LYS A 94 21.733 0.544 18.269 1.00 0.00 N ATOM 1482 CA LYS A 94 22.423 0.115 19.440 1.00 0.00 C ATOM 1483 C LYS A 94 23.871 -0.020 19.049 1.00 0.00 C ATOM 1484 O LYS A 94 24.190 -1.058 18.512 1.00 0.00 O ATOM 1485 CB LYS A 94 21.976 -1.231 19.954 1.00 0.00 C ATOM 1486 CG LYS A 94 21.325 -0.880 21.252 1.00 0.00 C ATOM 1487 CD LYS A 94 20.600 -1.973 22.016 1.00 0.00 C ATOM 1488 CE LYS A 94 19.692 -2.846 21.190 1.00 0.00 C ATOM 1489 NZ LYS A 94 20.281 -4.182 20.962 1.00 0.00 N ATOM 0 H LYS A 94 22.298 0.439 17.427 1.00 0.00 H new ATOM 0 HA LYS A 94 22.230 0.841 20.230 1.00 0.00 H new ATOM 0 HB2 LYS A 94 21.281 -1.717 19.269 1.00 0.00 H new ATOM 0 HB3 LYS A 94 22.816 -1.912 20.092 1.00 0.00 H new ATOM 0 HG2 LYS A 94 22.093 -0.470 21.908 1.00 0.00 H new ATOM 0 HG3 LYS A 94 20.610 -0.080 21.059 1.00 0.00 H new ATOM 0 HD2 LYS A 94 21.342 -2.607 22.502 1.00 0.00 H new ATOM 0 HD3 LYS A 94 20.010 -1.510 22.807 1.00 0.00 H new ATOM 0 HE2 LYS A 94 18.731 -2.952 21.694 1.00 0.00 H new ATOM 0 HE3 LYS A 94 19.497 -2.365 20.231 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 19.629 -4.756 20.390 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 21.186 -4.081 20.459 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 20.443 -4.650 21.876 1.00 0.00 H new ATOM 1503 N ARG A 95 24.605 1.028 19.330 1.00 0.00 N ATOM 1504 CA ARG A 95 26.008 1.133 19.094 1.00 0.00 C ATOM 1505 C ARG A 95 26.732 -0.116 19.648 1.00 0.00 C ATOM 1506 O ARG A 95 26.167 -1.106 19.987 1.00 0.00 O ATOM 1507 CB ARG A 95 26.712 2.230 19.876 1.00 0.00 C ATOM 1508 CG ARG A 95 25.964 3.474 20.210 1.00 0.00 C ATOM 1509 CD ARG A 95 25.120 4.035 19.053 1.00 0.00 C ATOM 1510 NE ARG A 95 25.998 4.162 17.901 1.00 0.00 N ATOM 1511 CZ ARG A 95 26.968 5.093 17.883 1.00 0.00 C ATOM 1512 NH1 ARG A 95 27.125 5.971 18.881 1.00 0.00 N ATOM 1513 NH2 ARG A 95 27.850 5.196 16.886 1.00 0.00 N ATOM 0 H ARG A 95 24.211 1.870 19.751 1.00 0.00 H new ATOM 0 HA ARG A 95 26.062 1.298 18.018 1.00 0.00 H new ATOM 0 HB2 ARG A 95 27.060 1.794 20.812 1.00 0.00 H new ATOM 0 HB3 ARG A 95 27.597 2.520 19.311 1.00 0.00 H new ATOM 0 HG2 ARG A 95 25.309 3.274 21.058 1.00 0.00 H new ATOM 0 HG3 ARG A 95 26.674 4.237 20.529 1.00 0.00 H new ATOM 0 HD2 ARG A 95 24.285 3.371 18.829 1.00 0.00 H new ATOM 0 HD3 ARG A 95 24.695 5.002 19.321 1.00 0.00 H new ATOM 0 HE ARG A 95 25.877 3.541 17.101 1.00 0.00 H new ATOM 0 HH11 ARG A 95 26.499 5.946 19.686 1.00 0.00 H new ATOM 0 HH12 ARG A 95 27.871 6.665 18.837 1.00 0.00 H new ATOM 0 HH21 ARG A 95 27.804 4.552 16.096 1.00 0.00 H new ATOM 0 HH22 ARG A 95 28.570 5.918 16.914 1.00 0.00 H new ATOM 1527 N VAL A 96 27.990 0.033 19.783 1.00 0.00 N ATOM 1528 CA VAL A 96 28.908 -0.923 20.353 1.00 0.00 C ATOM 1529 C VAL A 96 29.742 -0.188 21.416 1.00 0.00 C ATOM 1530 O VAL A 96 30.264 -0.901 22.281 1.00 0.00 O ATOM 1531 CB VAL A 96 29.740 -1.454 19.212 1.00 0.00 C ATOM 1532 CG1 VAL A 96 31.142 -1.745 19.779 1.00 0.00 C ATOM 1533 CG2 VAL A 96 29.096 -2.623 18.501 1.00 0.00 C ATOM 0 H VAL A 96 28.461 0.886 19.481 1.00 0.00 H new ATOM 0 HA VAL A 96 28.420 -1.765 20.844 1.00 0.00 H new ATOM 0 HB VAL A 96 29.821 -0.713 18.417 1.00 0.00 H new ATOM 0 HG11 VAL A 96 31.782 -2.133 18.986 1.00 0.00 H new ATOM 0 HG12 VAL A 96 31.572 -0.825 20.175 1.00 0.00 H new ATOM 0 HG13 VAL A 96 31.066 -2.483 20.577 1.00 0.00 H new ATOM 0 HG21 VAL A 96 29.744 -2.958 17.691 1.00 0.00 H new ATOM 0 HG22 VAL A 96 28.945 -3.440 19.207 1.00 0.00 H new ATOM 0 HG23 VAL A 96 28.134 -2.315 18.092 1.00 0.00 H new ATOM 1543 N ASP A 97 29.881 1.115 21.436 1.00 0.00 N ATOM 1544 CA ASP A 97 30.681 1.756 22.548 1.00 0.00 C ATOM 1545 C ASP A 97 30.068 1.374 23.893 1.00 0.00 C ATOM 1546 O ASP A 97 30.672 1.411 24.984 1.00 0.00 O ATOM 1547 CB ASP A 97 30.817 3.266 22.425 1.00 0.00 C ATOM 1548 CG ASP A 97 31.228 3.968 23.708 1.00 0.00 C ATOM 1549 OD1 ASP A 97 32.264 3.659 24.292 1.00 0.00 O ATOM 1550 OD2 ASP A 97 30.392 4.876 24.077 1.00 0.00 O ATOM 0 H ASP A 97 29.487 1.759 20.750 1.00 0.00 H new ATOM 0 HA ASP A 97 31.698 1.371 22.470 1.00 0.00 H new ATOM 0 HB2 ASP A 97 31.552 3.490 21.652 1.00 0.00 H new ATOM 0 HB3 ASP A 97 29.865 3.678 22.089 1.00 0.00 H new ATOM 1555 N ASN A 98 28.801 0.989 23.761 1.00 0.00 N ATOM 1556 CA ASN A 98 28.010 0.573 24.872 1.00 0.00 C ATOM 1557 C ASN A 98 26.629 0.030 24.615 1.00 0.00 C ATOM 1558 O ASN A 98 26.187 -0.898 25.277 1.00 0.00 O ATOM 1559 CB ASN A 98 27.927 1.784 25.871 1.00 0.00 C ATOM 1560 CG ASN A 98 26.738 1.802 26.819 1.00 0.00 C ATOM 1561 OD1 ASN A 98 25.752 2.591 26.603 1.00 0.00 O ATOM 1562 ND2 ASN A 98 26.800 0.982 27.832 1.00 0.00 N ATOM 0 H ASN A 98 28.309 0.964 22.868 1.00 0.00 H new ATOM 0 HA ASN A 98 28.528 -0.302 25.264 1.00 0.00 H new ATOM 0 HB2 ASN A 98 28.839 1.797 26.468 1.00 0.00 H new ATOM 0 HB3 ASN A 98 27.913 2.706 25.289 1.00 0.00 H new ATOM 0 HD21 ASN A 98 26.035 0.945 28.506 1.00 0.00 H new ATOM 0 HD22 ASN A 98 27.613 0.378 27.950 1.00 0.00 H new ATOM 1569 N GLY A 99 25.989 0.672 23.623 1.00 0.00 N ATOM 1570 CA GLY A 99 24.668 0.419 23.154 1.00 0.00 C ATOM 1571 C GLY A 99 23.698 1.605 23.419 1.00 0.00 C ATOM 1572 O GLY A 99 23.113 1.721 24.514 1.00 0.00 O ATOM 0 H GLY A 99 26.437 1.431 23.109 1.00 0.00 H new ATOM 0 HA2 GLY A 99 24.700 0.214 22.084 1.00 0.00 H new ATOM 0 HA3 GLY A 99 24.280 -0.477 23.639 1.00 0.00 H new ATOM 1576 N LYS A 100 23.577 2.440 22.384 1.00 0.00 N ATOM 1577 CA LYS A 100 22.716 3.596 22.493 1.00 0.00 C ATOM 1578 C LYS A 100 21.323 3.292 21.877 1.00 0.00 C ATOM 1579 O LYS A 100 21.105 2.168 21.503 1.00 0.00 O ATOM 1580 CB LYS A 100 23.236 4.810 21.781 1.00 0.00 C ATOM 1581 CG LYS A 100 24.533 5.399 22.241 1.00 0.00 C ATOM 1582 CD LYS A 100 25.063 4.761 23.494 1.00 0.00 C ATOM 1583 CE LYS A 100 26.010 5.681 24.259 1.00 0.00 C ATOM 1584 NZ LYS A 100 25.478 7.032 24.497 1.00 0.00 N ATOM 0 H LYS A 100 24.054 2.334 21.489 1.00 0.00 H new ATOM 0 HA LYS A 100 22.665 3.806 23.561 1.00 0.00 H new ATOM 0 HB2 LYS A 100 23.341 4.558 20.726 1.00 0.00 H new ATOM 0 HB3 LYS A 100 22.475 5.587 21.849 1.00 0.00 H new ATOM 0 HG2 LYS A 100 25.273 5.295 21.448 1.00 0.00 H new ATOM 0 HG3 LYS A 100 24.398 6.467 22.414 1.00 0.00 H new ATOM 0 HD2 LYS A 100 24.229 4.485 24.139 1.00 0.00 H new ATOM 0 HD3 LYS A 100 25.585 3.839 23.237 1.00 0.00 H new ATOM 0 HE2 LYS A 100 26.248 5.222 25.219 1.00 0.00 H new ATOM 0 HE3 LYS A 100 26.945 5.763 23.705 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 26.018 7.488 25.260 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 25.562 7.596 23.627 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 24.477 6.967 24.772 1.00 0.00 H new ATOM 1598 N GLU A 101 20.453 4.254 21.776 1.00 0.00 N ATOM 1599 CA GLU A 101 19.170 3.967 21.144 1.00 0.00 C ATOM 1600 C GLU A 101 18.719 5.181 20.300 1.00 0.00 C ATOM 1601 O GLU A 101 17.620 5.615 20.513 1.00 0.00 O ATOM 1602 CB GLU A 101 18.083 3.386 22.036 1.00 0.00 C ATOM 1603 CG GLU A 101 18.069 1.862 22.217 1.00 0.00 C ATOM 1604 CD GLU A 101 16.907 1.377 23.041 1.00 0.00 C ATOM 1605 OE1 GLU A 101 15.729 1.532 22.734 1.00 0.00 O ATOM 1606 OE2 GLU A 101 17.328 0.767 24.116 1.00 0.00 O ATOM 0 H GLU A 101 20.585 5.211 22.104 1.00 0.00 H new ATOM 0 HA GLU A 101 19.348 3.123 20.478 1.00 0.00 H new ATOM 0 HB2 GLU A 101 18.174 3.843 23.021 1.00 0.00 H new ATOM 0 HB3 GLU A 101 17.117 3.688 21.632 1.00 0.00 H new ATOM 0 HG2 GLU A 101 18.036 1.386 21.237 1.00 0.00 H new ATOM 0 HG3 GLU A 101 18.999 1.550 22.692 1.00 0.00 H new ATOM 1613 N LEU A 102 19.654 5.572 19.463 1.00 0.00 N ATOM 1614 CA LEU A 102 19.585 6.682 18.522 1.00 0.00 C ATOM 1615 C LEU A 102 18.118 6.604 18.083 1.00 0.00 C ATOM 1616 O LEU A 102 17.431 7.552 18.373 1.00 0.00 O ATOM 1617 CB LEU A 102 20.461 6.351 17.274 1.00 0.00 C ATOM 1618 CG LEU A 102 21.899 6.764 17.573 1.00 0.00 C ATOM 1619 CD1 LEU A 102 22.849 5.690 17.106 1.00 0.00 C ATOM 1620 CD2 LEU A 102 22.105 8.064 16.813 1.00 0.00 C ATOM 0 H LEU A 102 20.552 5.090 19.414 1.00 0.00 H new ATOM 0 HA LEU A 102 19.910 7.638 18.933 1.00 0.00 H new ATOM 0 HB2 LEU A 102 20.411 5.286 17.047 1.00 0.00 H new ATOM 0 HB3 LEU A 102 20.088 6.881 16.397 1.00 0.00 H new ATOM 0 HG LEU A 102 22.086 6.899 18.638 1.00 0.00 H new ATOM 0 HD11 LEU A 102 23.874 5.991 17.323 1.00 0.00 H new ATOM 0 HD12 LEU A 102 22.628 4.758 17.625 1.00 0.00 H new ATOM 0 HD13 LEU A 102 22.733 5.544 16.032 1.00 0.00 H new ATOM 0 HD21 LEU A 102 23.120 8.425 16.979 1.00 0.00 H new ATOM 0 HD22 LEU A 102 21.951 7.891 15.748 1.00 0.00 H new ATOM 0 HD23 LEU A 102 21.392 8.809 17.167 1.00 0.00 H new ATOM 1632 N ILE A 103 17.786 5.492 17.475 1.00 0.00 N ATOM 1633 CA ILE A 103 16.428 5.155 17.055 1.00 0.00 C ATOM 1634 C ILE A 103 16.037 6.031 15.858 1.00 0.00 C ATOM 1635 O ILE A 103 14.873 5.866 15.463 1.00 0.00 O ATOM 1636 CB ILE A 103 15.533 5.448 18.262 1.00 0.00 C ATOM 1637 CG1 ILE A 103 15.212 4.205 19.096 1.00 0.00 C ATOM 1638 CG2 ILE A 103 14.282 6.245 17.959 1.00 0.00 C ATOM 1639 CD1 ILE A 103 15.363 2.861 18.458 1.00 0.00 C ATOM 0 H ILE A 103 18.467 4.767 17.247 1.00 0.00 H new ATOM 0 HA ILE A 103 16.334 4.114 16.745 1.00 0.00 H new ATOM 0 HB ILE A 103 16.154 6.104 18.872 1.00 0.00 H new ATOM 0 HG12 ILE A 103 15.848 4.226 19.981 1.00 0.00 H new ATOM 0 HG13 ILE A 103 14.182 4.294 19.442 1.00 0.00 H new ATOM 0 HG21 ILE A 103 13.717 6.399 18.878 1.00 0.00 H new ATOM 0 HG22 ILE A 103 14.559 7.211 17.537 1.00 0.00 H new ATOM 0 HG23 ILE A 103 13.668 5.699 17.243 1.00 0.00 H new ATOM 0 HD11 ILE A 103 15.099 2.085 19.177 1.00 0.00 H new ATOM 0 HD12 ILE A 103 14.704 2.793 17.592 1.00 0.00 H new ATOM 0 HD13 ILE A 103 16.396 2.723 18.139 1.00 0.00 H new ATOM 1651 N ALA A 104 16.934 6.853 15.346 1.00 0.00 N ATOM 1652 CA ALA A 104 16.757 7.759 14.245 1.00 0.00 C ATOM 1653 C ALA A 104 15.514 7.479 13.478 1.00 0.00 C ATOM 1654 O ALA A 104 15.596 6.993 12.357 1.00 0.00 O ATOM 1655 CB ALA A 104 17.951 7.683 13.271 1.00 0.00 C ATOM 0 H ALA A 104 17.879 6.902 15.726 1.00 0.00 H new ATOM 0 HA ALA A 104 16.687 8.755 14.682 1.00 0.00 H new ATOM 0 HB1 ALA A 104 17.793 8.378 12.446 1.00 0.00 H new ATOM 0 HB2 ALA A 104 18.868 7.948 13.798 1.00 0.00 H new ATOM 0 HB3 ALA A 104 18.037 6.669 12.880 1.00 0.00 H new ATOM 1661 N VAL A 105 14.350 7.746 13.994 1.00 0.00 N ATOM 1662 CA VAL A 105 13.068 7.487 13.383 1.00 0.00 C ATOM 1663 C VAL A 105 12.849 8.465 12.214 1.00 0.00 C ATOM 1664 O VAL A 105 13.680 8.372 11.310 1.00 0.00 O ATOM 1665 CB VAL A 105 11.957 7.624 14.407 1.00 0.00 C ATOM 1666 CG1 VAL A 105 10.559 7.178 13.921 1.00 0.00 C ATOM 1667 CG2 VAL A 105 12.211 6.923 15.726 1.00 0.00 C ATOM 0 H VAL A 105 14.259 8.179 14.913 1.00 0.00 H new ATOM 0 HA VAL A 105 13.053 6.466 13.001 1.00 0.00 H new ATOM 0 HB VAL A 105 11.963 8.703 14.559 1.00 0.00 H new ATOM 0 HG11 VAL A 105 9.834 7.314 14.724 1.00 0.00 H new ATOM 0 HG12 VAL A 105 10.264 7.778 13.060 1.00 0.00 H new ATOM 0 HG13 VAL A 105 10.591 6.126 13.636 1.00 0.00 H new ATOM 0 HG21 VAL A 105 11.361 7.079 16.391 1.00 0.00 H new ATOM 0 HG22 VAL A 105 12.344 5.855 15.551 1.00 0.00 H new ATOM 0 HG23 VAL A 105 13.111 7.330 16.187 1.00 0.00 H new ATOM 1677 N ARG A 106 11.834 9.284 12.250 1.00 0.00 N ATOM 1678 CA ARG A 106 11.412 10.215 11.205 1.00 0.00 C ATOM 1679 C ARG A 106 9.884 10.213 11.407 1.00 0.00 C ATOM 1680 O ARG A 106 9.343 11.261 11.191 1.00 0.00 O ATOM 1681 CB ARG A 106 11.639 9.781 9.816 1.00 0.00 C ATOM 1682 CG ARG A 106 12.307 10.919 9.059 1.00 0.00 C ATOM 1683 CD ARG A 106 13.687 10.679 8.538 1.00 0.00 C ATOM 1684 NE ARG A 106 14.578 10.476 9.677 1.00 0.00 N ATOM 1685 CZ ARG A 106 15.598 9.633 9.702 1.00 0.00 C ATOM 1686 NH1 ARG A 106 15.941 8.854 8.691 1.00 0.00 N ATOM 1687 NH2 ARG A 106 16.286 9.616 10.849 1.00 0.00 N ATOM 0 H ARG A 106 11.225 9.332 13.067 1.00 0.00 H new ATOM 0 HA ARG A 106 11.962 11.151 11.302 1.00 0.00 H new ATOM 0 HB2 ARG A 106 12.268 8.891 9.795 1.00 0.00 H new ATOM 0 HB3 ARG A 106 10.694 9.514 9.343 1.00 0.00 H new ATOM 0 HG2 ARG A 106 11.669 11.183 8.215 1.00 0.00 H new ATOM 0 HG3 ARG A 106 12.341 11.787 9.717 1.00 0.00 H new ATOM 0 HD2 ARG A 106 13.700 9.806 7.885 1.00 0.00 H new ATOM 0 HD3 ARG A 106 14.021 11.528 7.941 1.00 0.00 H new ATOM 0 HE ARG A 106 14.401 11.026 10.518 1.00 0.00 H new ATOM 0 HH11 ARG A 106 15.406 8.880 7.823 1.00 0.00 H new ATOM 0 HH12 ARG A 106 16.740 8.227 8.779 1.00 0.00 H new ATOM 0 HH21 ARG A 106 16.009 10.224 11.619 1.00 0.00 H new ATOM 0 HH22 ARG A 106 17.088 8.995 10.953 1.00 0.00 H new ATOM 1701 N GLU A 107 9.454 9.061 11.840 1.00 0.00 N ATOM 1702 CA GLU A 107 8.096 8.762 12.225 1.00 0.00 C ATOM 1703 C GLU A 107 7.169 9.201 11.111 1.00 0.00 C ATOM 1704 O GLU A 107 6.481 8.510 10.386 1.00 0.00 O ATOM 1705 CB GLU A 107 7.805 9.739 13.416 1.00 0.00 C ATOM 1706 CG GLU A 107 7.773 9.013 14.764 1.00 0.00 C ATOM 1707 CD GLU A 107 6.443 8.815 15.517 1.00 0.00 C ATOM 1708 OE1 GLU A 107 5.411 8.479 14.968 1.00 0.00 O ATOM 1709 OE2 GLU A 107 6.515 9.039 16.822 1.00 0.00 O ATOM 0 H GLU A 107 10.074 8.258 11.941 1.00 0.00 H new ATOM 0 HA GLU A 107 7.961 7.705 12.454 1.00 0.00 H new ATOM 0 HB2 GLU A 107 8.569 10.516 13.442 1.00 0.00 H new ATOM 0 HB3 GLU A 107 6.850 10.237 13.250 1.00 0.00 H new ATOM 0 HG2 GLU A 107 8.203 8.024 14.606 1.00 0.00 H new ATOM 0 HG3 GLU A 107 8.445 9.550 15.434 1.00 0.00 H new ATOM 1716 N ILE A 108 7.157 10.527 10.991 1.00 0.00 N ATOM 1717 CA ILE A 108 6.402 11.306 10.033 1.00 0.00 C ATOM 1718 C ILE A 108 4.925 11.386 10.360 1.00 0.00 C ATOM 1719 O ILE A 108 4.137 10.439 10.248 1.00 0.00 O ATOM 1720 CB ILE A 108 6.631 10.710 8.639 1.00 0.00 C ATOM 1721 CG1 ILE A 108 6.748 11.917 7.715 1.00 0.00 C ATOM 1722 CG2 ILE A 108 5.453 9.910 8.105 1.00 0.00 C ATOM 1723 CD1 ILE A 108 7.408 11.554 6.399 1.00 0.00 C ATOM 0 H ILE A 108 7.715 11.119 11.606 1.00 0.00 H new ATOM 0 HA ILE A 108 6.760 12.335 10.070 1.00 0.00 H new ATOM 0 HB ILE A 108 7.493 10.044 8.688 1.00 0.00 H new ATOM 0 HG12 ILE A 108 5.756 12.326 7.524 1.00 0.00 H new ATOM 0 HG13 ILE A 108 7.326 12.698 8.209 1.00 0.00 H new ATOM 0 HG21 ILE A 108 5.695 9.523 7.115 1.00 0.00 H new ATOM 0 HG22 ILE A 108 5.242 9.079 8.778 1.00 0.00 H new ATOM 0 HG23 ILE A 108 4.576 10.554 8.038 1.00 0.00 H new ATOM 0 HD11 ILE A 108 7.473 12.440 5.768 1.00 0.00 H new ATOM 0 HD12 ILE A 108 8.410 11.169 6.588 1.00 0.00 H new ATOM 0 HD13 ILE A 108 6.816 10.791 5.893 1.00 0.00 H new ATOM 1735 N SER A 109 4.526 12.581 10.796 1.00 0.00 N ATOM 1736 CA SER A 109 3.115 12.790 11.028 1.00 0.00 C ATOM 1737 C SER A 109 2.855 14.245 11.097 1.00 0.00 C ATOM 1738 O SER A 109 3.416 14.905 11.939 1.00 0.00 O ATOM 1739 CB SER A 109 2.708 12.047 12.286 1.00 0.00 C ATOM 1740 OG SER A 109 1.451 12.432 12.770 1.00 0.00 O ATOM 0 H SER A 109 5.133 13.378 10.985 1.00 0.00 H new ATOM 0 HA SER A 109 2.509 12.393 10.214 1.00 0.00 H new ATOM 0 HB2 SER A 109 2.700 10.976 12.082 1.00 0.00 H new ATOM 0 HB3 SER A 109 3.456 12.218 13.060 1.00 0.00 H new ATOM 0 HG SER A 109 1.241 11.920 13.579 1.00 0.00 H new ATOM 1746 N GLY A 110 1.975 14.655 10.182 1.00 0.00 N ATOM 1747 CA GLY A 110 1.494 15.981 10.015 1.00 0.00 C ATOM 1748 C GLY A 110 2.625 16.953 9.730 1.00 0.00 C ATOM 1749 O GLY A 110 3.298 17.253 10.728 1.00 0.00 O ATOM 0 H GLY A 110 1.568 14.009 9.506 1.00 0.00 H new ATOM 0 HA2 GLY A 110 0.775 16.008 9.196 1.00 0.00 H new ATOM 0 HA3 GLY A 110 0.964 16.292 10.915 1.00 0.00 H new ATOM 1753 N ASN A 111 2.817 17.418 8.519 1.00 0.00 N ATOM 1754 CA ASN A 111 3.925 18.301 8.188 1.00 0.00 C ATOM 1755 C ASN A 111 5.123 17.773 8.972 1.00 0.00 C ATOM 1756 O ASN A 111 5.368 18.288 10.067 1.00 0.00 O ATOM 1757 CB ASN A 111 3.711 19.810 8.376 1.00 0.00 C ATOM 1758 CG ASN A 111 2.289 20.250 8.739 1.00 0.00 C ATOM 1759 OD1 ASN A 111 1.299 19.510 8.667 1.00 0.00 O ATOM 1760 ND2 ASN A 111 2.181 21.498 9.145 1.00 0.00 N ATOM 0 H ASN A 111 2.211 17.198 7.728 1.00 0.00 H new ATOM 0 HA ASN A 111 4.070 18.264 7.108 1.00 0.00 H new ATOM 0 HB2 ASN A 111 4.387 20.158 9.157 1.00 0.00 H new ATOM 0 HB3 ASN A 111 4.002 20.315 7.455 1.00 0.00 H new ATOM 0 HD21 ASN A 111 1.269 21.872 9.407 1.00 0.00 H new ATOM 0 HD22 ASN A 111 3.009 22.091 9.197 1.00 0.00 H new ATOM 1767 N GLU A 112 5.872 16.787 8.449 1.00 0.00 N ATOM 1768 CA GLU A 112 6.886 16.288 9.305 1.00 0.00 C ATOM 1769 C GLU A 112 7.976 15.453 8.667 1.00 0.00 C ATOM 1770 O GLU A 112 8.076 15.254 7.463 1.00 0.00 O ATOM 1771 CB GLU A 112 6.088 15.110 10.008 1.00 0.00 C ATOM 1772 CG GLU A 112 5.493 14.274 8.862 1.00 0.00 C ATOM 1773 CD GLU A 112 4.206 14.635 8.183 1.00 0.00 C ATOM 1774 OE1 GLU A 112 4.003 15.575 7.472 1.00 0.00 O ATOM 1775 OE2 GLU A 112 3.264 13.730 8.352 1.00 0.00 O ATOM 0 H GLU A 112 5.788 16.370 7.522 1.00 0.00 H new ATOM 0 HA GLU A 112 7.333 17.134 9.828 1.00 0.00 H new ATOM 0 HB2 GLU A 112 6.748 14.507 10.632 1.00 0.00 H new ATOM 0 HB3 GLU A 112 5.304 15.500 10.657 1.00 0.00 H new ATOM 0 HG2 GLU A 112 6.254 14.228 8.083 1.00 0.00 H new ATOM 0 HG3 GLU A 112 5.369 13.262 9.247 1.00 0.00 H new ATOM 1782 N LEU A 113 8.737 14.875 9.606 1.00 0.00 N ATOM 1783 CA LEU A 113 9.798 13.937 9.460 1.00 0.00 C ATOM 1784 C LEU A 113 10.460 13.772 10.857 1.00 0.00 C ATOM 1785 O LEU A 113 11.633 13.479 10.919 1.00 0.00 O ATOM 1786 CB LEU A 113 10.905 14.232 8.458 1.00 0.00 C ATOM 1787 CG LEU A 113 10.662 13.828 7.009 1.00 0.00 C ATOM 1788 CD1 LEU A 113 12.065 13.849 6.395 1.00 0.00 C ATOM 1789 CD2 LEU A 113 10.222 12.403 6.836 1.00 0.00 C ATOM 0 H LEU A 113 8.585 15.096 10.590 1.00 0.00 H new ATOM 0 HA LEU A 113 9.313 13.050 9.053 1.00 0.00 H new ATOM 0 HB2 LEU A 113 11.104 15.304 8.481 1.00 0.00 H new ATOM 0 HB3 LEU A 113 11.811 13.732 8.800 1.00 0.00 H new ATOM 0 HG LEU A 113 9.899 14.481 6.585 1.00 0.00 H new ATOM 0 HD11 LEU A 113 12.006 13.571 5.343 1.00 0.00 H new ATOM 0 HD12 LEU A 113 12.485 14.851 6.482 1.00 0.00 H new ATOM 0 HD13 LEU A 113 12.704 13.140 6.922 1.00 0.00 H new ATOM 0 HD21 LEU A 113 10.070 12.195 5.777 1.00 0.00 H new ATOM 0 HD22 LEU A 113 10.988 11.735 7.231 1.00 0.00 H new ATOM 0 HD23 LEU A 113 9.288 12.243 7.374 1.00 0.00 H new ATOM 1801 N ILE A 114 9.758 13.942 11.916 1.00 0.00 N ATOM 1802 CA ILE A 114 10.246 13.720 13.252 1.00 0.00 C ATOM 1803 C ILE A 114 11.281 12.635 13.317 1.00 0.00 C ATOM 1804 O ILE A 114 11.076 11.449 13.587 1.00 0.00 O ATOM 1805 CB ILE A 114 9.051 13.241 14.091 1.00 0.00 C ATOM 1806 CG1 ILE A 114 7.754 12.923 13.329 1.00 0.00 C ATOM 1807 CG2 ILE A 114 8.925 14.071 15.335 1.00 0.00 C ATOM 1808 CD1 ILE A 114 6.629 13.971 13.426 1.00 0.00 C ATOM 0 H ILE A 114 8.787 14.252 11.889 1.00 0.00 H new ATOM 0 HA ILE A 114 10.696 14.647 13.609 1.00 0.00 H new ATOM 0 HB ILE A 114 9.282 12.227 14.419 1.00 0.00 H new ATOM 0 HG12 ILE A 114 8.001 12.783 12.277 1.00 0.00 H new ATOM 0 HG13 ILE A 114 7.367 11.972 13.694 1.00 0.00 H new ATOM 0 HG21 ILE A 114 8.075 13.722 15.921 1.00 0.00 H new ATOM 0 HG22 ILE A 114 9.836 13.980 15.927 1.00 0.00 H new ATOM 0 HG23 ILE A 114 8.773 15.115 15.062 1.00 0.00 H new ATOM 0 HD11 ILE A 114 5.768 13.635 12.848 1.00 0.00 H new ATOM 0 HD12 ILE A 114 6.339 14.098 14.469 1.00 0.00 H new ATOM 0 HD13 ILE A 114 6.983 14.923 13.029 1.00 0.00 H new ATOM 1820 N GLN A 115 12.510 13.087 13.061 1.00 0.00 N ATOM 1821 CA GLN A 115 13.723 12.353 13.033 1.00 0.00 C ATOM 1822 C GLN A 115 13.919 11.553 14.322 1.00 0.00 C ATOM 1823 O GLN A 115 14.687 10.606 14.282 1.00 0.00 O ATOM 1824 CB GLN A 115 14.817 13.405 12.824 1.00 0.00 C ATOM 1825 CG GLN A 115 14.785 13.960 11.392 1.00 0.00 C ATOM 1826 CD GLN A 115 16.014 13.544 10.639 1.00 0.00 C ATOM 1827 OE1 GLN A 115 17.097 13.411 11.175 1.00 0.00 O ATOM 1828 NE2 GLN A 115 15.871 13.325 9.330 1.00 0.00 N ATOM 0 H GLN A 115 12.668 14.073 12.852 1.00 0.00 H new ATOM 0 HA GLN A 115 13.737 11.607 12.238 1.00 0.00 H new ATOM 0 HB2 GLN A 115 14.683 14.219 13.536 1.00 0.00 H new ATOM 0 HB3 GLN A 115 15.793 12.964 13.024 1.00 0.00 H new ATOM 0 HG2 GLN A 115 13.896 13.599 10.876 1.00 0.00 H new ATOM 0 HG3 GLN A 115 14.719 15.048 11.419 1.00 0.00 H new ATOM 0 HE21 GLN A 115 14.958 13.440 8.891 1.00 0.00 H new ATOM 0 HE22 GLN A 115 16.675 13.043 8.769 1.00 0.00 H new ATOM 1837 N THR A 116 13.193 11.984 15.324 1.00 0.00 N ATOM 1838 CA THR A 116 13.090 11.419 16.650 1.00 0.00 C ATOM 1839 C THR A 116 14.139 10.415 16.983 1.00 0.00 C ATOM 1840 O THR A 116 13.747 9.269 17.222 1.00 0.00 O ATOM 1841 CB THR A 116 11.702 10.738 16.782 1.00 0.00 C ATOM 1842 OG1 THR A 116 10.742 11.761 16.494 1.00 0.00 O ATOM 1843 CG2 THR A 116 11.467 10.264 18.191 1.00 0.00 C ATOM 0 H THR A 116 12.607 12.813 15.225 1.00 0.00 H new ATOM 0 HA THR A 116 13.226 12.246 17.347 1.00 0.00 H new ATOM 0 HB THR A 116 11.632 9.878 16.115 1.00 0.00 H new ATOM 0 HG1 THR A 116 10.863 12.508 17.117 1.00 0.00 H new ATOM 0 HG21 THR A 116 10.487 9.790 18.257 1.00 0.00 H new ATOM 0 HG22 THR A 116 12.238 9.544 18.466 1.00 0.00 H new ATOM 0 HG23 THR A 116 11.506 11.114 18.872 1.00 0.00 H new ATOM 1851 N TYR A 117 15.411 10.813 17.050 1.00 0.00 N ATOM 1852 CA TYR A 117 16.343 9.833 17.477 1.00 0.00 C ATOM 1853 C TYR A 117 16.589 10.031 18.987 1.00 0.00 C ATOM 1854 O TYR A 117 17.279 11.002 19.306 1.00 0.00 O ATOM 1855 CB TYR A 117 17.742 9.964 16.875 1.00 0.00 C ATOM 1856 CG TYR A 117 18.133 10.591 15.553 1.00 0.00 C ATOM 1857 CD1 TYR A 117 17.611 11.735 14.999 1.00 0.00 C ATOM 1858 CD2 TYR A 117 19.145 9.997 14.768 1.00 0.00 C ATOM 1859 CE1 TYR A 117 18.061 12.258 13.771 1.00 0.00 C ATOM 1860 CE2 TYR A 117 19.602 10.483 13.549 1.00 0.00 C ATOM 1861 CZ TYR A 117 19.060 11.649 13.016 1.00 0.00 C ATOM 1862 OH TYR A 117 19.513 12.144 11.814 1.00 0.00 O ATOM 0 H TYR A 117 15.777 11.739 16.828 1.00 0.00 H new ATOM 0 HA TYR A 117 15.904 8.881 17.178 1.00 0.00 H new ATOM 0 HB2 TYR A 117 18.326 10.496 17.626 1.00 0.00 H new ATOM 0 HB3 TYR A 117 18.130 8.946 16.833 1.00 0.00 H new ATOM 0 HD1 TYR A 117 16.824 12.254 15.526 1.00 0.00 H new ATOM 0 HD2 TYR A 117 19.600 9.093 15.145 1.00 0.00 H new ATOM 0 HE1 TYR A 117 17.613 13.168 13.400 1.00 0.00 H new ATOM 0 HE2 TYR A 117 20.378 9.956 13.015 1.00 0.00 H new ATOM 0 HH TYR A 117 18.798 12.654 11.380 1.00 0.00 H new ATOM 1872 N THR A 118 16.039 9.126 19.746 1.00 0.00 N ATOM 1873 CA THR A 118 16.027 9.134 21.199 1.00 0.00 C ATOM 1874 C THR A 118 17.005 8.167 21.767 1.00 0.00 C ATOM 1875 O THR A 118 16.584 7.179 22.380 1.00 0.00 O ATOM 1876 CB THR A 118 14.641 8.937 21.855 1.00 0.00 C ATOM 1877 OG1 THR A 118 13.732 9.810 21.192 1.00 0.00 O ATOM 1878 CG2 THR A 118 14.693 9.246 23.316 1.00 0.00 C ATOM 0 H THR A 118 15.559 8.315 19.356 1.00 0.00 H new ATOM 0 HA THR A 118 16.327 10.151 21.451 1.00 0.00 H new ATOM 0 HB THR A 118 14.320 7.900 21.759 1.00 0.00 H new ATOM 0 HG1 THR A 118 12.839 9.710 21.583 1.00 0.00 H new ATOM 0 HG21 THR A 118 13.706 9.100 23.754 1.00 0.00 H new ATOM 0 HG22 THR A 118 15.408 8.583 23.803 1.00 0.00 H new ATOM 0 HG23 THR A 118 15.003 10.281 23.458 1.00 0.00 H new ATOM 1886 N TYR A 119 18.305 8.404 21.637 1.00 0.00 N ATOM 1887 CA TYR A 119 19.289 7.540 22.211 1.00 0.00 C ATOM 1888 C TYR A 119 19.255 7.629 23.738 1.00 0.00 C ATOM 1889 O TYR A 119 19.638 8.585 24.357 1.00 0.00 O ATOM 1890 CB TYR A 119 20.725 7.842 21.692 1.00 0.00 C ATOM 1891 CG TYR A 119 21.369 8.932 22.454 1.00 0.00 C ATOM 1892 CD1 TYR A 119 20.938 10.244 22.343 1.00 0.00 C ATOM 1893 CD2 TYR A 119 22.420 8.650 23.335 1.00 0.00 C ATOM 1894 CE1 TYR A 119 21.535 11.218 23.106 1.00 0.00 C ATOM 1895 CE2 TYR A 119 23.019 9.628 24.105 1.00 0.00 C ATOM 1896 CZ TYR A 119 22.555 10.921 23.989 1.00 0.00 C ATOM 1897 OH TYR A 119 23.060 11.950 24.729 1.00 0.00 O ATOM 0 H TYR A 119 18.690 9.201 21.130 1.00 0.00 H new ATOM 0 HA TYR A 119 19.038 6.526 21.899 1.00 0.00 H new ATOM 0 HB2 TYR A 119 21.334 6.941 21.763 1.00 0.00 H new ATOM 0 HB3 TYR A 119 20.680 8.114 20.637 1.00 0.00 H new ATOM 0 HD1 TYR A 119 20.139 10.499 21.662 1.00 0.00 H new ATOM 0 HD2 TYR A 119 22.775 7.633 23.415 1.00 0.00 H new ATOM 0 HE1 TYR A 119 21.199 12.240 23.013 1.00 0.00 H new ATOM 0 HE2 TYR A 119 23.828 9.387 24.779 1.00 0.00 H new ATOM 0 HH TYR A 119 23.381 11.608 25.589 1.00 0.00 H new ATOM 1907 N GLU A 120 18.778 6.513 24.323 1.00 0.00 N ATOM 1908 CA GLU A 120 18.789 6.412 25.754 1.00 0.00 C ATOM 1909 C GLU A 120 18.164 7.552 26.501 1.00 0.00 C ATOM 1910 O GLU A 120 18.595 7.970 27.561 1.00 0.00 O ATOM 1911 CB GLU A 120 20.278 6.162 26.111 1.00 0.00 C ATOM 1912 CG GLU A 120 21.152 5.833 24.853 1.00 0.00 C ATOM 1913 CD GLU A 120 22.438 5.214 25.409 1.00 0.00 C ATOM 1914 OE1 GLU A 120 22.609 4.053 25.777 1.00 0.00 O ATOM 1915 OE2 GLU A 120 23.368 6.081 25.495 1.00 0.00 O ATOM 0 H GLU A 120 18.397 5.707 23.828 1.00 0.00 H new ATOM 0 HA GLU A 120 18.140 5.600 26.081 1.00 0.00 H new ATOM 0 HB2 GLU A 120 20.681 7.044 26.609 1.00 0.00 H new ATOM 0 HB3 GLU A 120 20.344 5.337 26.821 1.00 0.00 H new ATOM 0 HG2 GLU A 120 20.638 5.141 24.186 1.00 0.00 H new ATOM 0 HG3 GLU A 120 21.365 6.732 24.275 1.00 0.00 H new ATOM 1922 N GLY A 121 17.094 8.038 25.874 1.00 0.00 N ATOM 1923 CA GLY A 121 16.320 9.114 26.394 1.00 0.00 C ATOM 1924 C GLY A 121 16.683 10.503 25.935 1.00 0.00 C ATOM 1925 O GLY A 121 16.588 11.389 26.767 1.00 0.00 O ATOM 0 H GLY A 121 16.754 7.677 24.983 1.00 0.00 H new ATOM 0 HA2 GLY A 121 15.276 8.935 26.138 1.00 0.00 H new ATOM 0 HA3 GLY A 121 16.391 9.087 27.481 1.00 0.00 H new ATOM 1929 N VAL A 122 17.089 10.658 24.647 1.00 0.00 N ATOM 1930 CA VAL A 122 17.440 11.969 24.187 1.00 0.00 C ATOM 1931 C VAL A 122 17.164 12.081 22.666 1.00 0.00 C ATOM 1932 O VAL A 122 18.083 12.040 21.858 1.00 0.00 O ATOM 1933 CB VAL A 122 18.944 12.195 24.515 1.00 0.00 C ATOM 1934 CG1 VAL A 122 19.476 13.515 24.024 1.00 0.00 C ATOM 1935 CG2 VAL A 122 19.198 12.105 26.011 1.00 0.00 C ATOM 0 H VAL A 122 17.170 9.910 23.958 1.00 0.00 H new ATOM 0 HA VAL A 122 16.843 12.735 24.681 1.00 0.00 H new ATOM 0 HB VAL A 122 19.471 11.401 23.987 1.00 0.00 H new ATOM 0 HG11 VAL A 122 20.530 13.603 24.288 1.00 0.00 H new ATOM 0 HG12 VAL A 122 19.367 13.571 22.941 1.00 0.00 H new ATOM 0 HG13 VAL A 122 18.916 14.328 24.487 1.00 0.00 H new ATOM 0 HG21 VAL A 122 20.257 12.267 26.211 1.00 0.00 H new ATOM 0 HG22 VAL A 122 18.611 12.866 26.526 1.00 0.00 H new ATOM 0 HG23 VAL A 122 18.908 11.118 26.371 1.00 0.00 H new ATOM 1945 N GLU A 123 15.926 12.232 22.303 1.00 0.00 N ATOM 1946 CA GLU A 123 15.421 12.395 20.974 1.00 0.00 C ATOM 1947 C GLU A 123 15.996 13.653 20.373 1.00 0.00 C ATOM 1948 O GLU A 123 16.119 14.677 21.064 1.00 0.00 O ATOM 1949 CB GLU A 123 13.900 12.786 21.048 1.00 0.00 C ATOM 1950 CG GLU A 123 13.212 12.588 19.662 1.00 0.00 C ATOM 1951 CD GLU A 123 11.730 12.773 19.555 1.00 0.00 C ATOM 1952 OE1 GLU A 123 11.189 12.500 20.724 1.00 0.00 O ATOM 1953 OE2 GLU A 123 10.983 13.090 18.649 1.00 0.00 O ATOM 0 H GLU A 123 15.176 12.245 22.994 1.00 0.00 H new ATOM 0 HA GLU A 123 15.642 11.478 20.428 1.00 0.00 H new ATOM 0 HB2 GLU A 123 13.399 12.176 21.799 1.00 0.00 H new ATOM 0 HB3 GLU A 123 13.801 13.825 21.364 1.00 0.00 H new ATOM 0 HG2 GLU A 123 13.681 13.277 18.960 1.00 0.00 H new ATOM 0 HG3 GLU A 123 13.443 11.579 19.321 1.00 0.00 H new ATOM 1960 N ALA A 124 16.329 13.535 19.081 1.00 0.00 N ATOM 1961 CA ALA A 124 16.885 14.700 18.377 1.00 0.00 C ATOM 1962 C ALA A 124 16.141 14.903 17.067 1.00 0.00 C ATOM 1963 O ALA A 124 16.128 14.170 16.126 1.00 0.00 O ATOM 1964 CB ALA A 124 18.370 14.661 18.181 1.00 0.00 C ATOM 0 H ALA A 124 16.230 12.687 18.522 1.00 0.00 H new ATOM 0 HA ALA A 124 16.729 15.563 19.024 1.00 0.00 H new ATOM 0 HB1 ALA A 124 18.691 15.559 17.654 1.00 0.00 H new ATOM 0 HB2 ALA A 124 18.864 14.614 19.151 1.00 0.00 H new ATOM 0 HB3 ALA A 124 18.637 13.782 17.595 1.00 0.00 H new ATOM 1970 N LYS A 125 15.408 16.027 17.019 1.00 0.00 N ATOM 1971 CA LYS A 125 14.593 16.290 15.841 1.00 0.00 C ATOM 1972 C LYS A 125 14.245 17.734 15.744 1.00 0.00 C ATOM 1973 O LYS A 125 14.403 18.460 16.727 1.00 0.00 O ATOM 1974 CB LYS A 125 13.264 15.469 15.884 1.00 0.00 C ATOM 1975 CG LYS A 125 13.187 14.661 17.174 1.00 0.00 C ATOM 1976 CD LYS A 125 12.965 15.595 18.397 1.00 0.00 C ATOM 1977 CE LYS A 125 11.952 16.708 18.124 1.00 0.00 C ATOM 1978 NZ LYS A 125 11.479 17.370 19.331 1.00 0.00 N ATOM 0 H LYS A 125 15.367 16.735 17.752 1.00 0.00 H new ATOM 0 HA LYS A 125 15.183 15.993 14.974 1.00 0.00 H new ATOM 0 HB2 LYS A 125 12.410 16.142 15.816 1.00 0.00 H new ATOM 0 HB3 LYS A 125 13.212 14.801 15.024 1.00 0.00 H new ATOM 0 HG2 LYS A 125 12.372 13.940 17.109 1.00 0.00 H new ATOM 0 HG3 LYS A 125 14.107 14.092 17.307 1.00 0.00 H new ATOM 0 HD2 LYS A 125 12.623 15.000 19.244 1.00 0.00 H new ATOM 0 HD3 LYS A 125 13.917 16.041 18.684 1.00 0.00 H new ATOM 0 HE2 LYS A 125 12.407 17.449 17.467 1.00 0.00 H new ATOM 0 HE3 LYS A 125 11.099 16.289 17.590 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 10.797 18.112 19.075 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 11.017 16.674 19.951 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 12.285 17.798 19.831 1.00 0.00 H new ATOM 1992 N ARG A 126 13.772 18.116 14.568 1.00 0.00 N ATOM 1993 CA ARG A 126 13.384 19.480 14.239 1.00 0.00 C ATOM 1994 C ARG A 126 12.531 19.318 12.999 1.00 0.00 C ATOM 1995 O ARG A 126 11.474 19.893 13.013 1.00 0.00 O ATOM 1996 CB ARG A 126 14.418 20.513 13.987 1.00 0.00 C ATOM 1997 CG ARG A 126 15.009 21.057 15.246 1.00 0.00 C ATOM 1998 CD ARG A 126 13.892 21.689 16.055 1.00 0.00 C ATOM 1999 NE ARG A 126 13.118 22.573 15.216 1.00 0.00 N ATOM 2000 CZ ARG A 126 13.423 23.796 14.865 1.00 0.00 C ATOM 2001 NH1 ARG A 126 14.534 24.422 15.263 1.00 0.00 N ATOM 2002 NH2 ARG A 126 12.583 24.443 14.070 1.00 0.00 N ATOM 0 H ARG A 126 13.643 17.466 13.792 1.00 0.00 H new ATOM 0 HA ARG A 126 12.914 19.888 15.134 1.00 0.00 H new ATOM 0 HB2 ARG A 126 15.211 20.085 13.374 1.00 0.00 H new ATOM 0 HB3 ARG A 126 13.978 21.330 13.415 1.00 0.00 H new ATOM 0 HG2 ARG A 126 15.489 20.262 15.816 1.00 0.00 H new ATOM 0 HG3 ARG A 126 15.778 21.795 15.018 1.00 0.00 H new ATOM 0 HD2 ARG A 126 13.249 20.914 16.472 1.00 0.00 H new ATOM 0 HD3 ARG A 126 14.309 22.244 16.896 1.00 0.00 H new ATOM 0 HE ARG A 126 12.237 22.204 14.858 1.00 0.00 H new ATOM 0 HH11 ARG A 126 15.197 23.945 15.873 1.00 0.00 H new ATOM 0 HH12 ARG A 126 14.719 25.377 14.957 1.00 0.00 H new ATOM 0 HH21 ARG A 126 11.729 23.986 13.751 1.00 0.00 H new ATOM 0 HH22 ARG A 126 12.791 25.398 13.777 1.00 0.00 H new ATOM 2016 N ILE A 127 13.036 18.557 12.018 1.00 0.00 N ATOM 2017 CA ILE A 127 12.389 18.174 10.806 1.00 0.00 C ATOM 2018 C ILE A 127 13.104 18.555 9.564 1.00 0.00 C ATOM 2019 O ILE A 127 13.864 19.507 9.459 1.00 0.00 O ATOM 2020 CB ILE A 127 10.916 18.663 10.675 1.00 0.00 C ATOM 2021 CG1 ILE A 127 10.017 17.794 11.530 1.00 0.00 C ATOM 2022 CG2 ILE A 127 10.426 18.635 9.240 1.00 0.00 C ATOM 2023 CD1 ILE A 127 10.544 17.335 12.894 1.00 0.00 C ATOM 0 H ILE A 127 13.980 18.177 12.079 1.00 0.00 H new ATOM 0 HA ILE A 127 12.402 17.088 10.899 1.00 0.00 H new ATOM 0 HB ILE A 127 10.883 19.698 11.015 1.00 0.00 H new ATOM 0 HG12 ILE A 127 9.088 18.338 11.697 1.00 0.00 H new ATOM 0 HG13 ILE A 127 9.766 16.904 10.953 1.00 0.00 H new ATOM 0 HG21 ILE A 127 9.394 18.985 9.201 1.00 0.00 H new ATOM 0 HG22 ILE A 127 11.053 19.284 8.629 1.00 0.00 H new ATOM 0 HG23 ILE A 127 10.478 17.616 8.857 1.00 0.00 H new ATOM 0 HD11 ILE A 127 9.790 16.722 13.388 1.00 0.00 H new ATOM 0 HD12 ILE A 127 11.453 16.750 12.755 1.00 0.00 H new ATOM 0 HD13 ILE A 127 10.764 18.206 13.511 1.00 0.00 H new ATOM 2035 N PHE A 128 12.747 17.713 8.563 1.00 0.00 N ATOM 2036 CA PHE A 128 13.086 17.720 7.217 1.00 0.00 C ATOM 2037 C PHE A 128 13.100 19.105 6.543 1.00 0.00 C ATOM 2038 O PHE A 128 12.381 19.971 7.009 1.00 0.00 O ATOM 2039 CB PHE A 128 11.999 17.038 6.353 1.00 0.00 C ATOM 2040 CG PHE A 128 10.700 17.843 6.136 1.00 0.00 C ATOM 2041 CD1 PHE A 128 10.603 18.934 5.298 1.00 0.00 C ATOM 2042 CD2 PHE A 128 9.510 17.515 6.786 1.00 0.00 C ATOM 2043 CE1 PHE A 128 9.466 19.667 5.075 1.00 0.00 C ATOM 2044 CE2 PHE A 128 8.329 18.202 6.611 1.00 0.00 C ATOM 2045 CZ PHE A 128 8.317 19.289 5.740 1.00 0.00 C ATOM 0 H PHE A 128 12.131 16.926 8.767 1.00 0.00 H new ATOM 0 HA PHE A 128 14.067 17.246 7.245 1.00 0.00 H new ATOM 0 HB2 PHE A 128 12.429 16.811 5.377 1.00 0.00 H new ATOM 0 HB3 PHE A 128 11.739 16.086 6.817 1.00 0.00 H new ATOM 0 HD1 PHE A 128 11.497 19.236 4.774 1.00 0.00 H new ATOM 0 HD2 PHE A 128 9.515 16.675 7.465 1.00 0.00 H new ATOM 0 HE1 PHE A 128 9.469 20.512 4.402 1.00 0.00 H new ATOM 0 HE2 PHE A 128 7.434 17.905 7.137 1.00 0.00 H new ATOM 0 HZ PHE A 128 7.402 19.840 5.584 1.00 0.00 H new ATOM 2055 N LYS A 129 13.848 19.030 5.482 1.00 0.00 N ATOM 2056 CA LYS A 129 14.018 20.142 4.597 1.00 0.00 C ATOM 2057 C LYS A 129 13.303 19.812 3.298 1.00 0.00 C ATOM 2058 O LYS A 129 13.079 20.752 2.552 1.00 0.00 O ATOM 2059 CB LYS A 129 15.314 20.867 4.518 1.00 0.00 C ATOM 2060 CG LYS A 129 15.047 22.388 4.482 1.00 0.00 C ATOM 2061 CD LYS A 129 14.743 23.001 3.135 1.00 0.00 C ATOM 2062 CE LYS A 129 13.372 23.695 2.991 1.00 0.00 C ATOM 2063 NZ LYS A 129 12.994 24.145 1.628 1.00 0.00 N ATOM 0 H LYS A 129 14.359 18.192 5.206 1.00 0.00 H new ATOM 0 HA LYS A 129 13.544 20.994 5.085 1.00 0.00 H new ATOM 0 HB2 LYS A 129 15.937 20.616 5.376 1.00 0.00 H new ATOM 0 HB3 LYS A 129 15.861 20.561 3.626 1.00 0.00 H new ATOM 0 HG2 LYS A 129 14.210 22.600 5.147 1.00 0.00 H new ATOM 0 HG3 LYS A 129 15.919 22.895 4.895 1.00 0.00 H new ATOM 0 HD2 LYS A 129 15.521 23.730 2.908 1.00 0.00 H new ATOM 0 HD3 LYS A 129 14.810 22.218 2.380 1.00 0.00 H new ATOM 0 HE2 LYS A 129 12.604 23.009 3.348 1.00 0.00 H new ATOM 0 HE3 LYS A 129 13.358 24.562 3.652 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 12.057 24.594 1.658 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 13.695 24.830 1.282 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 12.965 23.326 0.988 1.00 0.00 H new ATOM 2077 N LYS A 130 12.914 18.577 3.201 1.00 0.00 N ATOM 2078 CA LYS A 130 12.279 18.054 2.038 1.00 0.00 C ATOM 2079 C LYS A 130 12.888 18.615 0.775 1.00 0.00 C ATOM 2080 O LYS A 130 13.407 19.730 0.606 1.00 0.00 O ATOM 2081 CB LYS A 130 10.749 18.193 2.072 1.00 0.00 C ATOM 2082 CG LYS A 130 10.026 18.156 0.700 1.00 0.00 C ATOM 2083 CD LYS A 130 9.541 19.479 0.155 1.00 0.00 C ATOM 2084 CE LYS A 130 8.036 19.677 0.463 1.00 0.00 C ATOM 2085 NZ LYS A 130 7.724 21.047 0.893 1.00 0.00 N ATOM 0 H LYS A 130 13.034 17.892 3.947 1.00 0.00 H new ATOM 0 HA LYS A 130 12.469 16.981 2.035 1.00 0.00 H new ATOM 0 HB2 LYS A 130 10.346 17.393 2.693 1.00 0.00 H new ATOM 0 HB3 LYS A 130 10.502 19.134 2.564 1.00 0.00 H new ATOM 0 HG2 LYS A 130 10.704 17.715 -0.031 1.00 0.00 H new ATOM 0 HG3 LYS A 130 9.169 17.488 0.784 1.00 0.00 H new ATOM 0 HD2 LYS A 130 10.118 20.293 0.594 1.00 0.00 H new ATOM 0 HD3 LYS A 130 9.705 19.517 -0.922 1.00 0.00 H new ATOM 0 HE2 LYS A 130 7.452 19.437 -0.426 1.00 0.00 H new ATOM 0 HE3 LYS A 130 7.733 18.977 1.242 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 6.705 21.127 1.086 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 8.259 21.270 1.757 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 7.987 21.715 0.141 1.00 0.00 H new ATOM 2099 N GLU A 131 12.751 17.698 -0.210 1.00 0.00 N ATOM 2100 CA GLU A 131 13.250 18.013 -1.592 1.00 0.00 C ATOM 2101 C GLU A 131 12.498 17.411 -2.743 1.00 0.00 C ATOM 2102 O GLU A 131 13.054 17.199 -3.834 1.00 0.00 O ATOM 2103 CB GLU A 131 14.772 18.003 -1.450 1.00 0.00 C ATOM 2104 CG GLU A 131 15.811 18.708 -2.358 1.00 0.00 C ATOM 2105 CD GLU A 131 15.147 19.724 -3.286 1.00 0.00 C ATOM 2106 OE1 GLU A 131 14.407 20.641 -2.790 1.00 0.00 O ATOM 2107 OE2 GLU A 131 15.363 19.609 -4.551 1.00 0.00 O ATOM 2108 OXT GLU A 131 11.438 18.311 -2.039 1.00 0.00 O ATOM 0 H GLU A 131 12.325 16.778 -0.098 1.00 0.00 H new ATOM 0 HA GLU A 131 12.991 18.997 -1.984 1.00 0.00 H new ATOM 0 HB2 GLU A 131 14.968 18.378 -0.446 1.00 0.00 H new ATOM 0 HB3 GLU A 131 15.053 16.950 -1.457 1.00 0.00 H new ATOM 0 HG2 GLU A 131 16.555 19.211 -1.739 1.00 0.00 H new ATOM 0 HG3 GLU A 131 16.341 17.963 -2.952 1.00 0.00 H new