USER MOD reduce.3.24.130724 H: found=0, std=0, add=870, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 866 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 Single : A 1 GLY N :NH3+ -127:sc= 0.0961 (180deg=0) USER MOD Single : A 2 SER OG : rot 32:sc= 0.623 USER MOD Single : A 3 SER OG : rot 180:sc= -0.132 USER MOD Single : A 5 SER OG : rot -57:sc= 0.0639 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 9 ASN : amide:sc= -2.23 K(o=-2.2,f=-1.7) USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot 180:sc= -0.908 USER MOD Single : A 22 ASN : amide:sc= 0.185 X(o=0.19,f=0) USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 33 ASN : amide:sc= -0.18 K(o=-0.18,f=-2.2!) USER MOD Single : A 38 THR OG1 : rot 180:sc= -0.498 USER MOD Single : A 40 GLN : amide:sc= 0 K(o=0,f=-0.86) USER MOD Single : A 41 GLN : amide:sc= -2.02 X(o=-2,f=-2.1!) USER MOD Single : A 42 TYR OH : rot 180:sc= 0 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 45 ASN : amide:sc= -0.0488 K(o=-0.049,f=-1.7!) USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 50 TYR OH : rot 180:sc= -0.479 USER MOD Single : A 52 SER OG : rot 180:sc=-0.00219 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 67 GLN : amide:sc= -0.0492 X(o=-0.049,f=0) USER MOD Single : A 71 LYS NZ :NH3+ 138:sc= -2.15 (180deg=-3.19!) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 76 ASN : amide:sc= -0.0197 K(o=-0.02,f=0.52) USER MOD Single : A 78 GLN : amide:sc= -3.54! C(o=-3.5!,f=-4.8!) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 ASN : amide:sc= -3.72! C(o=-3.7!,f=-4.7!) USER MOD Single : A 85 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 86 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 94 ASN : amide:sc= -0.0537 K(o=-0.054,f=-0.98) USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 100 SER OG : rot 180:sc= -0.115 USER MOD Single : A 104 GLN : amide:sc= -2.4 X(o=-2.4,f=-2.7) USER MOD Single : A 105 HIS : no HE2:sc= -0.431 K(o=-0.43,f=-1.7) USER MOD Single : A 108 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 110 GLN : amide:sc= 0 K(o=0,f=-0.76) USER MOD Single : A 111 ASN : amide:sc= -0.178 X(o=-0.18,f=-0.59) USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot 180:sc=-0.00423 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -11.731 18.699 30.375 1.00 0.00 N ATOM 2 CA GLY A 1 -12.366 17.773 29.455 1.00 0.00 C ATOM 3 C GLY A 1 -11.969 18.023 28.014 1.00 0.00 C ATOM 4 O GLY A 1 -11.044 18.788 27.742 1.00 0.00 O ATOM 0 H1 GLY A 1 -11.251 18.166 31.128 1.00 0.00 H new ATOM 0 H2 GLY A 1 -11.035 19.276 29.861 1.00 0.00 H new ATOM 0 H3 GLY A 1 -12.452 19.319 30.796 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -12.100 16.752 29.730 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -13.449 17.856 29.550 1.00 0.00 H new ATOM 8 N SER A 2 -12.669 17.375 27.088 1.00 0.00 N ATOM 9 CA SER A 2 -12.381 17.527 25.667 1.00 0.00 C ATOM 10 C SER A 2 -13.586 17.126 24.822 1.00 0.00 C ATOM 11 O SER A 2 -14.563 16.581 25.334 1.00 0.00 O ATOM 12 CB SER A 2 -11.167 16.680 25.278 1.00 0.00 C ATOM 13 OG SER A 2 -9.961 17.395 25.478 1.00 0.00 O ATOM 0 H SER A 2 -13.439 16.740 27.297 1.00 0.00 H new ATOM 0 HA SER A 2 -12.159 18.577 25.477 1.00 0.00 H new ATOM 0 HB2 SER A 2 -11.153 15.765 25.870 1.00 0.00 H new ATOM 0 HB3 SER A 2 -11.248 16.382 24.233 1.00 0.00 H new ATOM 0 HG SER A 2 -10.065 18.005 26.238 1.00 0.00 H new ATOM 19 N SER A 3 -13.510 17.402 23.524 1.00 0.00 N ATOM 20 CA SER A 3 -14.595 17.075 22.607 1.00 0.00 C ATOM 21 C SER A 3 -14.067 16.868 21.191 1.00 0.00 C ATOM 22 O SER A 3 -12.906 17.153 20.902 1.00 0.00 O ATOM 23 CB SER A 3 -15.648 18.185 22.614 1.00 0.00 C ATOM 24 OG SER A 3 -16.108 18.444 23.929 1.00 0.00 O ATOM 0 H SER A 3 -12.707 17.852 23.084 1.00 0.00 H new ATOM 0 HA SER A 3 -15.054 16.145 22.943 1.00 0.00 H new ATOM 0 HB2 SER A 3 -15.225 19.095 22.188 1.00 0.00 H new ATOM 0 HB3 SER A 3 -16.488 17.898 21.982 1.00 0.00 H new ATOM 0 HG SER A 3 -16.779 19.158 23.906 1.00 0.00 H new ATOM 30 N GLY A 4 -14.930 16.369 20.311 1.00 0.00 N ATOM 31 CA GLY A 4 -14.533 16.132 18.936 1.00 0.00 C ATOM 32 C GLY A 4 -15.314 16.980 17.952 1.00 0.00 C ATOM 33 O GLY A 4 -14.783 17.399 16.924 1.00 0.00 O ATOM 0 H GLY A 4 -15.897 16.125 20.526 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -13.469 16.342 18.827 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -14.676 15.078 18.696 1.00 0.00 H new ATOM 37 N SER A 5 -16.581 17.233 18.267 1.00 0.00 N ATOM 38 CA SER A 5 -17.438 18.033 17.400 1.00 0.00 C ATOM 39 C SER A 5 -17.595 17.373 16.033 1.00 0.00 C ATOM 40 O SER A 5 -17.484 18.030 14.998 1.00 0.00 O ATOM 41 CB SER A 5 -16.863 19.441 17.236 1.00 0.00 C ATOM 42 OG SER A 5 -17.839 20.335 16.728 1.00 0.00 O ATOM 0 H SER A 5 -17.036 16.896 19.115 1.00 0.00 H new ATOM 0 HA SER A 5 -18.421 18.102 17.866 1.00 0.00 H new ATOM 0 HB2 SER A 5 -16.499 19.803 18.198 1.00 0.00 H new ATOM 0 HB3 SER A 5 -16.007 19.411 16.562 1.00 0.00 H new ATOM 0 HG SER A 5 -18.184 19.993 15.877 1.00 0.00 H new ATOM 48 N SER A 6 -17.855 16.070 16.038 1.00 0.00 N ATOM 49 CA SER A 6 -18.024 15.319 14.800 1.00 0.00 C ATOM 50 C SER A 6 -18.806 16.133 13.773 1.00 0.00 C ATOM 51 O SER A 6 -19.818 16.752 14.097 1.00 0.00 O ATOM 52 CB SER A 6 -18.742 13.997 15.074 1.00 0.00 C ATOM 53 OG SER A 6 -18.626 13.115 13.970 1.00 0.00 O ATOM 0 H SER A 6 -17.953 15.512 16.886 1.00 0.00 H new ATOM 0 HA SER A 6 -17.035 15.109 14.394 1.00 0.00 H new ATOM 0 HB2 SER A 6 -18.321 13.528 15.964 1.00 0.00 H new ATOM 0 HB3 SER A 6 -19.795 14.188 15.282 1.00 0.00 H new ATOM 0 HG SER A 6 -19.092 12.277 14.171 1.00 0.00 H new ATOM 59 N GLY A 7 -18.328 16.126 12.533 1.00 0.00 N ATOM 60 CA GLY A 7 -18.993 16.867 11.477 1.00 0.00 C ATOM 61 C GLY A 7 -18.788 16.241 10.111 1.00 0.00 C ATOM 62 O GLY A 7 -19.333 15.177 9.821 1.00 0.00 O ATOM 0 H GLY A 7 -17.492 15.620 12.240 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -20.060 16.921 11.692 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -18.618 17.890 11.464 1.00 0.00 H new ATOM 66 N MET A 8 -18.001 16.904 9.271 1.00 0.00 N ATOM 67 CA MET A 8 -17.726 16.406 7.928 1.00 0.00 C ATOM 68 C MET A 8 -16.300 16.745 7.504 1.00 0.00 C ATOM 69 O MET A 8 -15.865 17.890 7.617 1.00 0.00 O ATOM 70 CB MET A 8 -18.722 16.997 6.928 1.00 0.00 C ATOM 71 CG MET A 8 -18.814 16.214 5.628 1.00 0.00 C ATOM 72 SD MET A 8 -19.470 14.551 5.864 1.00 0.00 S ATOM 73 CE MET A 8 -20.671 14.470 4.537 1.00 0.00 C ATOM 0 H MET A 8 -17.542 17.787 9.496 1.00 0.00 H new ATOM 0 HA MET A 8 -17.835 15.321 7.940 1.00 0.00 H new ATOM 0 HB2 MET A 8 -19.709 17.036 7.390 1.00 0.00 H new ATOM 0 HB3 MET A 8 -18.434 18.024 6.704 1.00 0.00 H new ATOM 0 HG2 MET A 8 -19.449 16.755 4.927 1.00 0.00 H new ATOM 0 HG3 MET A 8 -17.824 16.149 5.176 1.00 0.00 H new ATOM 0 HE1 MET A 8 -21.163 13.498 4.551 1.00 0.00 H new ATOM 0 HE2 MET A 8 -21.415 15.255 4.671 1.00 0.00 H new ATOM 0 HE3 MET A 8 -20.166 14.608 3.581 1.00 0.00 H new ATOM 83 N ASN A 9 -15.578 15.742 7.016 1.00 0.00 N ATOM 84 CA ASN A 9 -14.201 15.934 6.576 1.00 0.00 C ATOM 85 C ASN A 9 -13.773 14.820 5.625 1.00 0.00 C ATOM 86 O ASN A 9 -14.305 13.712 5.672 1.00 0.00 O ATOM 87 CB ASN A 9 -13.260 15.980 7.782 1.00 0.00 C ATOM 88 CG ASN A 9 -13.340 17.298 8.527 1.00 0.00 C ATOM 89 OD1 ASN A 9 -12.684 18.273 8.159 1.00 0.00 O ATOM 90 ND2 ASN A 9 -14.146 17.334 9.582 1.00 0.00 N ATOM 0 H ASN A 9 -15.924 14.788 6.915 1.00 0.00 H new ATOM 0 HA ASN A 9 -14.145 16.883 6.043 1.00 0.00 H new ATOM 0 HB2 ASN A 9 -13.506 15.165 8.463 1.00 0.00 H new ATOM 0 HB3 ASN A 9 -12.236 15.817 7.447 1.00 0.00 H new ATOM 0 HD21 ASN A 9 -14.240 18.194 10.123 1.00 0.00 H new ATOM 0 HD22 ASN A 9 -14.671 16.502 9.851 1.00 0.00 H new ATOM 97 N GLY A 10 -12.808 15.124 4.763 1.00 0.00 N ATOM 98 CA GLY A 10 -12.324 14.139 3.813 1.00 0.00 C ATOM 99 C GLY A 10 -10.819 13.970 3.869 1.00 0.00 C ATOM 100 O GLY A 10 -10.072 14.865 3.472 1.00 0.00 O ATOM 0 H GLY A 10 -12.352 16.035 4.705 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -12.802 13.180 4.013 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -12.616 14.436 2.806 1.00 0.00 H new ATOM 104 N ARG A 11 -10.372 12.820 4.364 1.00 0.00 N ATOM 105 CA ARG A 11 -8.946 12.539 4.473 1.00 0.00 C ATOM 106 C ARG A 11 -8.691 11.035 4.526 1.00 0.00 C ATOM 107 O ARG A 11 -9.451 10.287 5.140 1.00 0.00 O ATOM 108 CB ARG A 11 -8.366 13.209 5.720 1.00 0.00 C ATOM 109 CG ARG A 11 -9.029 12.766 7.014 1.00 0.00 C ATOM 110 CD ARG A 11 -8.152 13.061 8.220 1.00 0.00 C ATOM 111 NE ARG A 11 -8.933 13.195 9.447 1.00 0.00 N ATOM 112 CZ ARG A 11 -9.682 14.255 9.729 1.00 0.00 C ATOM 113 NH1 ARG A 11 -9.750 15.269 8.877 1.00 0.00 N ATOM 114 NH2 ARG A 11 -10.364 14.303 10.866 1.00 0.00 N ATOM 0 H ARG A 11 -10.977 12.069 4.696 1.00 0.00 H new ATOM 0 HA ARG A 11 -8.453 12.943 3.589 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -7.299 12.992 5.776 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -8.467 14.290 5.622 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -9.986 13.275 7.126 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -9.239 11.697 6.969 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -7.422 12.261 8.341 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -7.592 13.980 8.045 1.00 0.00 H new ATOM 0 HE ARG A 11 -8.901 12.433 10.124 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -9.226 15.236 8.002 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -10.326 16.082 9.096 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -10.313 13.526 11.524 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -10.939 15.117 11.082 1.00 0.00 H new ATOM 128 N VAL A 12 -7.616 10.599 3.876 1.00 0.00 N ATOM 129 CA VAL A 12 -7.260 9.186 3.849 1.00 0.00 C ATOM 130 C VAL A 12 -8.503 8.308 3.751 1.00 0.00 C ATOM 131 O VAL A 12 -8.590 7.263 4.396 1.00 0.00 O ATOM 132 CB VAL A 12 -6.459 8.784 5.102 1.00 0.00 C ATOM 133 CG1 VAL A 12 -5.157 9.567 5.177 1.00 0.00 C ATOM 134 CG2 VAL A 12 -7.292 8.997 6.357 1.00 0.00 C ATOM 0 H VAL A 12 -6.977 11.205 3.361 1.00 0.00 H new ATOM 0 HA VAL A 12 -6.639 9.033 2.966 1.00 0.00 H new ATOM 0 HB VAL A 12 -6.214 7.724 5.032 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -4.605 9.270 6.068 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -4.556 9.359 4.292 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -5.376 10.634 5.225 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -6.711 8.708 7.233 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -7.569 10.048 6.436 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -8.194 8.387 6.303 1.00 0.00 H new ATOM 144 N ASP A 13 -9.462 8.739 2.939 1.00 0.00 N ATOM 145 CA ASP A 13 -10.701 7.992 2.754 1.00 0.00 C ATOM 146 C ASP A 13 -10.433 6.660 2.062 1.00 0.00 C ATOM 147 O ASP A 13 -10.927 5.616 2.490 1.00 0.00 O ATOM 148 CB ASP A 13 -11.700 8.814 1.939 1.00 0.00 C ATOM 149 CG ASP A 13 -12.356 9.908 2.758 1.00 0.00 C ATOM 150 OD1 ASP A 13 -13.004 9.580 3.774 1.00 0.00 O ATOM 151 OD2 ASP A 13 -12.222 11.091 2.383 1.00 0.00 O ATOM 0 H ASP A 13 -9.405 9.602 2.398 1.00 0.00 H new ATOM 0 HA ASP A 13 -11.126 7.791 3.737 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -11.188 9.260 1.086 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -12.469 8.153 1.539 1.00 0.00 H new ATOM 156 N TYR A 14 -9.650 6.703 0.989 1.00 0.00 N ATOM 157 CA TYR A 14 -9.320 5.500 0.235 1.00 0.00 C ATOM 158 C TYR A 14 -8.989 4.342 1.173 1.00 0.00 C ATOM 159 O TYR A 14 -8.207 4.493 2.112 1.00 0.00 O ATOM 160 CB TYR A 14 -8.139 5.767 -0.700 1.00 0.00 C ATOM 161 CG TYR A 14 -6.881 6.194 0.021 1.00 0.00 C ATOM 162 CD1 TYR A 14 -6.662 7.527 0.346 1.00 0.00 C ATOM 163 CD2 TYR A 14 -5.910 5.265 0.376 1.00 0.00 C ATOM 164 CE1 TYR A 14 -5.513 7.923 1.004 1.00 0.00 C ATOM 165 CE2 TYR A 14 -4.759 5.652 1.035 1.00 0.00 C ATOM 166 CZ TYR A 14 -4.565 6.981 1.346 1.00 0.00 C ATOM 167 OH TYR A 14 -3.420 7.370 2.002 1.00 0.00 O ATOM 0 H TYR A 14 -9.232 7.558 0.622 1.00 0.00 H new ATOM 0 HA TYR A 14 -10.191 5.224 -0.360 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -7.930 4.865 -1.275 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -8.419 6.542 -1.414 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -7.403 8.267 0.080 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -6.058 4.223 0.133 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -5.358 8.963 1.249 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -4.015 4.917 1.305 1.00 0.00 H new ATOM 0 HH TYR A 14 -2.857 6.586 2.171 1.00 0.00 H new ATOM 177 N LEU A 15 -9.590 3.187 0.911 1.00 0.00 N ATOM 178 CA LEU A 15 -9.360 2.002 1.729 1.00 0.00 C ATOM 179 C LEU A 15 -7.982 1.410 1.455 1.00 0.00 C ATOM 180 O LEU A 15 -7.643 1.101 0.312 1.00 0.00 O ATOM 181 CB LEU A 15 -10.441 0.954 1.460 1.00 0.00 C ATOM 182 CG LEU A 15 -10.709 -0.040 2.590 1.00 0.00 C ATOM 183 CD1 LEU A 15 -9.530 -0.986 2.760 1.00 0.00 C ATOM 184 CD2 LEU A 15 -10.997 0.696 3.890 1.00 0.00 C ATOM 0 H LEU A 15 -10.241 3.046 0.138 1.00 0.00 H new ATOM 0 HA LEU A 15 -9.405 2.300 2.776 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -11.372 1.472 1.231 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -10.161 0.393 0.569 1.00 0.00 H new ATOM 0 HG LEU A 15 -11.587 -0.631 2.328 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -9.739 -1.686 3.569 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -9.370 -1.538 1.834 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -8.635 -0.412 2.999 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -11.185 -0.027 4.683 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -10.139 1.312 4.157 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -11.874 1.331 3.762 1.00 0.00 H new ATOM 196 N VAL A 16 -7.190 1.251 2.511 1.00 0.00 N ATOM 197 CA VAL A 16 -5.849 0.693 2.385 1.00 0.00 C ATOM 198 C VAL A 16 -5.809 -0.753 2.866 1.00 0.00 C ATOM 199 O VAL A 16 -6.450 -1.109 3.855 1.00 0.00 O ATOM 200 CB VAL A 16 -4.821 1.516 3.182 1.00 0.00 C ATOM 201 CG1 VAL A 16 -3.655 0.640 3.614 1.00 0.00 C ATOM 202 CG2 VAL A 16 -4.333 2.699 2.360 1.00 0.00 C ATOM 0 H VAL A 16 -7.454 1.501 3.464 1.00 0.00 H new ATOM 0 HA VAL A 16 -5.589 0.729 1.327 1.00 0.00 H new ATOM 0 HB VAL A 16 -5.307 1.901 4.078 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -2.939 1.239 4.176 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -4.023 -0.171 4.243 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -3.167 0.223 2.733 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -3.607 3.270 2.939 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -3.864 2.337 1.445 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -5.178 3.339 2.106 1.00 0.00 H new ATOM 212 N THR A 17 -5.051 -1.586 2.158 1.00 0.00 N ATOM 213 CA THR A 17 -4.927 -2.994 2.512 1.00 0.00 C ATOM 214 C THR A 17 -3.521 -3.510 2.229 1.00 0.00 C ATOM 215 O THR A 17 -2.778 -2.917 1.448 1.00 0.00 O ATOM 216 CB THR A 17 -5.944 -3.858 1.742 1.00 0.00 C ATOM 217 OG1 THR A 17 -5.766 -3.685 0.332 1.00 0.00 O ATOM 218 CG2 THR A 17 -7.368 -3.490 2.127 1.00 0.00 C ATOM 0 H THR A 17 -4.514 -1.309 1.336 1.00 0.00 H new ATOM 0 HA THR A 17 -5.131 -3.071 3.580 1.00 0.00 H new ATOM 0 HB THR A 17 -5.772 -4.902 2.004 1.00 0.00 H new ATOM 0 HG1 THR A 17 -6.415 -4.239 -0.150 1.00 0.00 H new ATOM 0 HG21 THR A 17 -8.068 -4.113 1.570 1.00 0.00 H new ATOM 0 HG22 THR A 17 -7.509 -3.651 3.196 1.00 0.00 H new ATOM 0 HG23 THR A 17 -7.549 -2.441 1.891 1.00 0.00 H new ATOM 226 N GLU A 18 -3.163 -4.620 2.868 1.00 0.00 N ATOM 227 CA GLU A 18 -1.844 -5.215 2.684 1.00 0.00 C ATOM 228 C GLU A 18 -1.962 -6.654 2.189 1.00 0.00 C ATOM 229 O GLU A 18 -2.968 -7.321 2.425 1.00 0.00 O ATOM 230 CB GLU A 18 -1.056 -5.177 3.994 1.00 0.00 C ATOM 231 CG GLU A 18 -0.752 -3.770 4.482 1.00 0.00 C ATOM 232 CD GLU A 18 -1.844 -3.213 5.374 1.00 0.00 C ATOM 233 OE1 GLU A 18 -2.995 -3.685 5.268 1.00 0.00 O ATOM 234 OE2 GLU A 18 -1.547 -2.305 6.178 1.00 0.00 O ATOM 0 H GLU A 18 -3.767 -5.125 3.517 1.00 0.00 H new ATOM 0 HA GLU A 18 -1.312 -4.633 1.932 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -1.620 -5.705 4.763 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -0.118 -5.716 3.860 1.00 0.00 H new ATOM 0 HG2 GLU A 18 0.191 -3.775 5.029 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -0.619 -3.112 3.623 1.00 0.00 H new ATOM 241 N GLU A 19 -0.925 -7.123 1.501 1.00 0.00 N ATOM 242 CA GLU A 19 -0.913 -8.481 0.972 1.00 0.00 C ATOM 243 C GLU A 19 0.517 -8.969 0.760 1.00 0.00 C ATOM 244 O GLU A 19 1.367 -8.234 0.258 1.00 0.00 O ATOM 245 CB GLU A 19 -1.686 -8.546 -0.347 1.00 0.00 C ATOM 246 CG GLU A 19 -1.364 -9.774 -1.182 1.00 0.00 C ATOM 247 CD GLU A 19 -2.528 -10.210 -2.051 1.00 0.00 C ATOM 248 OE1 GLU A 19 -3.679 -10.156 -1.570 1.00 0.00 O ATOM 249 OE2 GLU A 19 -2.288 -10.605 -3.211 1.00 0.00 O ATOM 0 H GLU A 19 -0.084 -6.583 1.298 1.00 0.00 H new ATOM 0 HA GLU A 19 -1.397 -9.131 1.701 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -2.755 -8.533 -0.133 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -1.467 -7.652 -0.931 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -0.502 -9.563 -1.815 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -1.081 -10.594 -0.522 1.00 0.00 H new ATOM 256 N GLU A 20 0.775 -10.215 1.146 1.00 0.00 N ATOM 257 CA GLU A 20 2.102 -10.801 0.999 1.00 0.00 C ATOM 258 C GLU A 20 2.235 -11.519 -0.341 1.00 0.00 C ATOM 259 O GLU A 20 1.638 -12.575 -0.553 1.00 0.00 O ATOM 260 CB GLU A 20 2.382 -11.777 2.143 1.00 0.00 C ATOM 261 CG GLU A 20 3.863 -11.996 2.408 1.00 0.00 C ATOM 262 CD GLU A 20 4.118 -13.103 3.413 1.00 0.00 C ATOM 263 OE1 GLU A 20 3.636 -14.232 3.187 1.00 0.00 O ATOM 264 OE2 GLU A 20 4.801 -12.838 4.424 1.00 0.00 O ATOM 0 H GLU A 20 0.083 -10.838 1.563 1.00 0.00 H new ATOM 0 HA GLU A 20 2.833 -9.993 1.033 1.00 0.00 H new ATOM 0 HB2 GLU A 20 1.910 -11.403 3.052 1.00 0.00 H new ATOM 0 HB3 GLU A 20 1.917 -12.736 1.913 1.00 0.00 H new ATOM 0 HG2 GLU A 20 4.364 -12.239 1.471 1.00 0.00 H new ATOM 0 HG3 GLU A 20 4.304 -11.069 2.774 1.00 0.00 H new ATOM 271 N ILE A 21 3.021 -10.938 -1.241 1.00 0.00 N ATOM 272 CA ILE A 21 3.232 -11.523 -2.560 1.00 0.00 C ATOM 273 C ILE A 21 4.456 -12.432 -2.568 1.00 0.00 C ATOM 274 O ILE A 21 5.591 -11.963 -2.489 1.00 0.00 O ATOM 275 CB ILE A 21 3.408 -10.435 -3.636 1.00 0.00 C ATOM 276 CG1 ILE A 21 2.282 -9.403 -3.538 1.00 0.00 C ATOM 277 CG2 ILE A 21 3.440 -11.061 -5.022 1.00 0.00 C ATOM 278 CD1 ILE A 21 0.953 -9.908 -4.056 1.00 0.00 C ATOM 0 H ILE A 21 3.522 -10.064 -1.082 1.00 0.00 H new ATOM 0 HA ILE A 21 2.344 -12.111 -2.791 1.00 0.00 H new ATOM 0 HB ILE A 21 4.357 -9.927 -3.466 1.00 0.00 H new ATOM 0 HG12 ILE A 21 2.166 -9.101 -2.497 1.00 0.00 H new ATOM 0 HG13 ILE A 21 2.567 -8.512 -4.098 1.00 0.00 H new ATOM 0 HG21 ILE A 21 3.565 -10.279 -5.771 1.00 0.00 H new ATOM 0 HG22 ILE A 21 4.273 -11.761 -5.086 1.00 0.00 H new ATOM 0 HG23 ILE A 21 2.505 -11.591 -5.203 1.00 0.00 H new ATOM 0 HD11 ILE A 21 0.202 -9.124 -3.956 1.00 0.00 H new ATOM 0 HD12 ILE A 21 1.052 -10.183 -5.106 1.00 0.00 H new ATOM 0 HD13 ILE A 21 0.646 -10.781 -3.480 1.00 0.00 H new ATOM 290 N ASN A 22 4.217 -13.736 -2.667 1.00 0.00 N ATOM 291 CA ASN A 22 5.301 -14.712 -2.687 1.00 0.00 C ATOM 292 C ASN A 22 5.639 -15.120 -4.118 1.00 0.00 C ATOM 293 O ASN A 22 4.896 -15.869 -4.754 1.00 0.00 O ATOM 294 CB ASN A 22 4.917 -15.948 -1.870 1.00 0.00 C ATOM 295 CG ASN A 22 5.005 -15.703 -0.376 1.00 0.00 C ATOM 296 OD1 ASN A 22 6.061 -15.881 0.232 1.00 0.00 O ATOM 297 ND2 ASN A 22 3.893 -15.293 0.223 1.00 0.00 N ATOM 0 H ASN A 22 3.283 -14.141 -2.735 1.00 0.00 H new ATOM 0 HA ASN A 22 6.182 -14.249 -2.242 1.00 0.00 H new ATOM 0 HB2 ASN A 22 3.901 -16.249 -2.127 1.00 0.00 H new ATOM 0 HB3 ASN A 22 5.573 -16.776 -2.139 1.00 0.00 H new ATOM 0 HD21 ASN A 22 3.891 -15.112 1.227 1.00 0.00 H new ATOM 0 HD22 ASN A 22 3.041 -15.159 -0.321 1.00 0.00 H new ATOM 304 N LEU A 23 6.765 -14.623 -4.618 1.00 0.00 N ATOM 305 CA LEU A 23 7.203 -14.935 -5.974 1.00 0.00 C ATOM 306 C LEU A 23 8.475 -15.777 -5.955 1.00 0.00 C ATOM 307 O LEU A 23 9.169 -15.850 -4.940 1.00 0.00 O ATOM 308 CB LEU A 23 7.442 -13.647 -6.763 1.00 0.00 C ATOM 309 CG LEU A 23 6.192 -12.933 -7.279 1.00 0.00 C ATOM 310 CD1 LEU A 23 6.494 -11.472 -7.573 1.00 0.00 C ATOM 311 CD2 LEU A 23 5.654 -13.630 -8.521 1.00 0.00 C ATOM 0 H LEU A 23 7.391 -14.002 -4.105 1.00 0.00 H new ATOM 0 HA LEU A 23 6.415 -15.511 -6.460 1.00 0.00 H new ATOM 0 HB2 LEU A 23 7.996 -12.954 -6.130 1.00 0.00 H new ATOM 0 HB3 LEU A 23 8.081 -13.880 -7.615 1.00 0.00 H new ATOM 0 HG LEU A 23 5.427 -12.975 -6.504 1.00 0.00 H new ATOM 0 HD11 LEU A 23 5.593 -10.981 -7.939 1.00 0.00 H new ATOM 0 HD12 LEU A 23 6.831 -10.979 -6.661 1.00 0.00 H new ATOM 0 HD13 LEU A 23 7.275 -11.407 -8.330 1.00 0.00 H new ATOM 0 HD21 LEU A 23 4.765 -13.108 -8.874 1.00 0.00 H new ATOM 0 HD22 LEU A 23 6.415 -13.620 -9.302 1.00 0.00 H new ATOM 0 HD23 LEU A 23 5.397 -14.661 -8.277 1.00 0.00 H new ATOM 323 N THR A 24 8.776 -16.410 -7.084 1.00 0.00 N ATOM 324 CA THR A 24 9.965 -17.246 -7.198 1.00 0.00 C ATOM 325 C THR A 24 10.978 -16.633 -8.157 1.00 0.00 C ATOM 326 O THR A 24 10.610 -16.072 -9.189 1.00 0.00 O ATOM 327 CB THR A 24 9.610 -18.665 -7.682 1.00 0.00 C ATOM 328 OG1 THR A 24 8.665 -19.265 -6.789 1.00 0.00 O ATOM 329 CG2 THR A 24 10.855 -19.534 -7.770 1.00 0.00 C ATOM 0 H THR A 24 8.213 -16.360 -7.933 1.00 0.00 H new ATOM 0 HA THR A 24 10.404 -17.309 -6.202 1.00 0.00 H new ATOM 0 HB THR A 24 9.170 -18.587 -8.676 1.00 0.00 H new ATOM 0 HG1 THR A 24 8.443 -20.166 -7.104 1.00 0.00 H new ATOM 0 HG21 THR A 24 10.579 -20.531 -8.114 1.00 0.00 H new ATOM 0 HG22 THR A 24 11.560 -19.090 -8.473 1.00 0.00 H new ATOM 0 HG23 THR A 24 11.319 -19.605 -6.786 1.00 0.00 H new ATOM 337 N ARG A 25 12.256 -16.744 -7.811 1.00 0.00 N ATOM 338 CA ARG A 25 13.323 -16.200 -8.642 1.00 0.00 C ATOM 339 C ARG A 25 13.547 -17.068 -9.877 1.00 0.00 C ATOM 340 O ARG A 25 13.889 -18.244 -9.767 1.00 0.00 O ATOM 341 CB ARG A 25 14.621 -16.093 -7.838 1.00 0.00 C ATOM 342 CG ARG A 25 15.791 -15.549 -8.641 1.00 0.00 C ATOM 343 CD ARG A 25 16.920 -15.083 -7.734 1.00 0.00 C ATOM 344 NE ARG A 25 18.057 -14.572 -8.494 1.00 0.00 N ATOM 345 CZ ARG A 25 19.261 -14.372 -7.970 1.00 0.00 C ATOM 346 NH1 ARG A 25 19.484 -14.641 -6.691 1.00 0.00 N ATOM 347 NH2 ARG A 25 20.246 -13.904 -8.726 1.00 0.00 N ATOM 0 H ARG A 25 12.578 -17.206 -6.960 1.00 0.00 H new ATOM 0 HA ARG A 25 13.023 -15.204 -8.969 1.00 0.00 H new ATOM 0 HB2 ARG A 25 14.452 -15.448 -6.975 1.00 0.00 H new ATOM 0 HB3 ARG A 25 14.882 -17.079 -7.453 1.00 0.00 H new ATOM 0 HG2 ARG A 25 16.160 -16.321 -9.317 1.00 0.00 H new ATOM 0 HG3 ARG A 25 15.454 -14.718 -9.260 1.00 0.00 H new ATOM 0 HD2 ARG A 25 16.551 -14.304 -7.067 1.00 0.00 H new ATOM 0 HD3 ARG A 25 17.247 -15.912 -7.107 1.00 0.00 H new ATOM 0 HE ARG A 25 17.919 -14.357 -9.481 1.00 0.00 H new ATOM 0 HH11 ARG A 25 18.730 -15.002 -6.107 1.00 0.00 H new ATOM 0 HH12 ARG A 25 20.410 -14.486 -6.291 1.00 0.00 H new ATOM 0 HH21 ARG A 25 20.079 -13.697 -9.711 1.00 0.00 H new ATOM 0 HH22 ARG A 25 21.170 -13.751 -8.322 1.00 0.00 H new ATOM 361 N GLY A 26 13.352 -16.477 -11.052 1.00 0.00 N ATOM 362 CA GLY A 26 13.536 -17.211 -12.290 1.00 0.00 C ATOM 363 C GLY A 26 14.977 -17.628 -12.508 1.00 0.00 C ATOM 364 O GLY A 26 15.767 -17.721 -11.569 1.00 0.00 O ATOM 0 H GLY A 26 13.070 -15.504 -11.168 1.00 0.00 H new ATOM 0 HA2 GLY A 26 12.902 -18.098 -12.281 1.00 0.00 H new ATOM 0 HA3 GLY A 26 13.209 -16.594 -13.127 1.00 0.00 H new ATOM 368 N PRO A 27 15.337 -17.889 -13.774 1.00 0.00 N ATOM 369 CA PRO A 27 16.694 -18.304 -14.142 1.00 0.00 C ATOM 370 C PRO A 27 17.708 -17.177 -13.982 1.00 0.00 C ATOM 371 O PRO A 27 18.908 -17.421 -13.863 1.00 0.00 O ATOM 372 CB PRO A 27 16.557 -18.697 -15.615 1.00 0.00 C ATOM 373 CG PRO A 27 15.389 -17.915 -16.109 1.00 0.00 C ATOM 374 CD PRO A 27 14.446 -17.799 -14.943 1.00 0.00 C ATOM 0 HA PRO A 27 17.062 -19.108 -13.505 1.00 0.00 H new ATOM 0 HB2 PRO A 27 17.460 -18.455 -16.175 1.00 0.00 H new ATOM 0 HB3 PRO A 27 16.391 -19.769 -15.725 1.00 0.00 H new ATOM 0 HG2 PRO A 27 15.699 -16.931 -16.460 1.00 0.00 H new ATOM 0 HG3 PRO A 27 14.910 -18.417 -16.950 1.00 0.00 H new ATOM 0 HD2 PRO A 27 13.900 -16.856 -14.960 1.00 0.00 H new ATOM 0 HD3 PRO A 27 13.704 -18.597 -14.945 1.00 0.00 H new ATOM 382 N SER A 28 17.217 -15.941 -13.982 1.00 0.00 N ATOM 383 CA SER A 28 18.082 -14.776 -13.840 1.00 0.00 C ATOM 384 C SER A 28 17.622 -13.896 -12.682 1.00 0.00 C ATOM 385 O SER A 28 18.393 -13.595 -11.772 1.00 0.00 O ATOM 386 CB SER A 28 18.096 -13.965 -15.138 1.00 0.00 C ATOM 387 OG SER A 28 18.948 -12.838 -15.025 1.00 0.00 O ATOM 0 H SER A 28 16.226 -15.721 -14.079 1.00 0.00 H new ATOM 0 HA SER A 28 19.092 -15.127 -13.628 1.00 0.00 H new ATOM 0 HB2 SER A 28 18.430 -14.596 -15.962 1.00 0.00 H new ATOM 0 HB3 SER A 28 17.084 -13.638 -15.377 1.00 0.00 H new ATOM 0 HG SER A 28 18.941 -12.337 -15.867 1.00 0.00 H new ATOM 393 N GLY A 29 16.358 -13.485 -12.724 1.00 0.00 N ATOM 394 CA GLY A 29 15.816 -12.644 -11.673 1.00 0.00 C ATOM 395 C GLY A 29 14.321 -12.435 -11.810 1.00 0.00 C ATOM 396 O GLY A 29 13.646 -13.177 -12.527 1.00 0.00 O ATOM 0 H GLY A 29 15.700 -13.720 -13.467 1.00 0.00 H new ATOM 0 HA2 GLY A 29 16.029 -13.096 -10.704 1.00 0.00 H new ATOM 0 HA3 GLY A 29 16.318 -11.677 -11.691 1.00 0.00 H new ATOM 400 N LEU A 30 13.800 -11.426 -11.122 1.00 0.00 N ATOM 401 CA LEU A 30 12.374 -11.123 -11.168 1.00 0.00 C ATOM 402 C LEU A 30 11.961 -10.660 -12.562 1.00 0.00 C ATOM 403 O LEU A 30 12.787 -10.576 -13.470 1.00 0.00 O ATOM 404 CB LEU A 30 12.027 -10.047 -10.138 1.00 0.00 C ATOM 405 CG LEU A 30 12.503 -10.309 -8.708 1.00 0.00 C ATOM 406 CD1 LEU A 30 12.291 -9.077 -7.841 1.00 0.00 C ATOM 407 CD2 LEU A 30 11.780 -11.510 -8.117 1.00 0.00 C ATOM 0 H LEU A 30 14.344 -10.803 -10.525 1.00 0.00 H new ATOM 0 HA LEU A 30 11.826 -12.035 -10.930 1.00 0.00 H new ATOM 0 HB2 LEU A 30 12.452 -9.101 -10.473 1.00 0.00 H new ATOM 0 HB3 LEU A 30 10.944 -9.923 -10.122 1.00 0.00 H new ATOM 0 HG LEU A 30 13.570 -10.530 -8.735 1.00 0.00 H new ATOM 0 HD11 LEU A 30 12.635 -9.282 -6.827 1.00 0.00 H new ATOM 0 HD12 LEU A 30 12.855 -8.240 -8.254 1.00 0.00 H new ATOM 0 HD13 LEU A 30 11.231 -8.825 -7.820 1.00 0.00 H new ATOM 0 HD21 LEU A 30 12.131 -11.682 -7.099 1.00 0.00 H new ATOM 0 HD22 LEU A 30 10.707 -11.318 -8.103 1.00 0.00 H new ATOM 0 HD23 LEU A 30 11.983 -12.392 -8.724 1.00 0.00 H new ATOM 419 N GLY A 31 10.676 -10.359 -12.723 1.00 0.00 N ATOM 420 CA GLY A 31 10.176 -9.906 -14.008 1.00 0.00 C ATOM 421 C GLY A 31 9.385 -8.617 -13.901 1.00 0.00 C ATOM 422 O GLY A 31 8.360 -8.452 -14.563 1.00 0.00 O ATOM 0 H GLY A 31 9.973 -10.421 -11.987 1.00 0.00 H new ATOM 0 HA2 GLY A 31 11.014 -9.759 -14.689 1.00 0.00 H new ATOM 0 HA3 GLY A 31 9.545 -10.681 -14.442 1.00 0.00 H new ATOM 426 N PHE A 32 9.861 -7.701 -13.065 1.00 0.00 N ATOM 427 CA PHE A 32 9.190 -6.421 -12.871 1.00 0.00 C ATOM 428 C PHE A 32 10.175 -5.358 -12.392 1.00 0.00 C ATOM 429 O PHE A 32 11.097 -5.649 -11.632 1.00 0.00 O ATOM 430 CB PHE A 32 8.049 -6.567 -11.862 1.00 0.00 C ATOM 431 CG PHE A 32 8.514 -6.902 -10.474 1.00 0.00 C ATOM 432 CD1 PHE A 32 8.839 -8.205 -10.134 1.00 0.00 C ATOM 433 CD2 PHE A 32 8.627 -5.913 -9.510 1.00 0.00 C ATOM 434 CE1 PHE A 32 9.268 -8.517 -8.858 1.00 0.00 C ATOM 435 CE2 PHE A 32 9.056 -6.219 -8.232 1.00 0.00 C ATOM 436 CZ PHE A 32 9.376 -7.522 -7.905 1.00 0.00 C ATOM 0 H PHE A 32 10.709 -7.821 -12.511 1.00 0.00 H new ATOM 0 HA PHE A 32 8.779 -6.105 -13.830 1.00 0.00 H new ATOM 0 HB2 PHE A 32 7.481 -5.637 -11.831 1.00 0.00 H new ATOM 0 HB3 PHE A 32 7.368 -7.346 -12.206 1.00 0.00 H new ATOM 0 HD1 PHE A 32 8.756 -8.986 -10.875 1.00 0.00 H new ATOM 0 HD2 PHE A 32 8.377 -4.892 -9.760 1.00 0.00 H new ATOM 0 HE1 PHE A 32 9.518 -9.537 -8.606 1.00 0.00 H new ATOM 0 HE2 PHE A 32 9.141 -5.439 -7.490 1.00 0.00 H new ATOM 0 HZ PHE A 32 9.710 -7.763 -6.907 1.00 0.00 H new ATOM 446 N ASN A 33 9.971 -4.125 -12.843 1.00 0.00 N ATOM 447 CA ASN A 33 10.841 -3.018 -12.462 1.00 0.00 C ATOM 448 C ASN A 33 10.265 -2.260 -11.270 1.00 0.00 C ATOM 449 O ASN A 33 9.050 -2.107 -11.146 1.00 0.00 O ATOM 450 CB ASN A 33 11.033 -2.064 -13.643 1.00 0.00 C ATOM 451 CG ASN A 33 12.362 -1.335 -13.586 1.00 0.00 C ATOM 452 OD1 ASN A 33 13.282 -1.753 -12.884 1.00 0.00 O ATOM 453 ND2 ASN A 33 12.467 -0.238 -14.328 1.00 0.00 N ATOM 0 H ASN A 33 9.211 -3.867 -13.473 1.00 0.00 H new ATOM 0 HA ASN A 33 11.809 -3.430 -12.175 1.00 0.00 H new ATOM 0 HB2 ASN A 33 10.969 -2.626 -14.575 1.00 0.00 H new ATOM 0 HB3 ASN A 33 10.222 -1.336 -13.654 1.00 0.00 H new ATOM 0 HD21 ASN A 33 13.337 0.295 -14.331 1.00 0.00 H new ATOM 0 HD22 ASN A 33 11.678 0.072 -14.895 1.00 0.00 H new ATOM 460 N ILE A 34 11.147 -1.787 -10.395 1.00 0.00 N ATOM 461 CA ILE A 34 10.727 -1.043 -9.214 1.00 0.00 C ATOM 462 C ILE A 34 11.325 0.360 -9.206 1.00 0.00 C ATOM 463 O ILE A 34 12.374 0.603 -9.803 1.00 0.00 O ATOM 464 CB ILE A 34 11.133 -1.769 -7.918 1.00 0.00 C ATOM 465 CG1 ILE A 34 12.577 -2.264 -8.016 1.00 0.00 C ATOM 466 CG2 ILE A 34 10.188 -2.929 -7.642 1.00 0.00 C ATOM 467 CD1 ILE A 34 13.278 -2.352 -6.678 1.00 0.00 C ATOM 0 H ILE A 34 12.156 -1.906 -10.482 1.00 0.00 H new ATOM 0 HA ILE A 34 9.640 -0.972 -9.256 1.00 0.00 H new ATOM 0 HB ILE A 34 11.065 -1.065 -7.089 1.00 0.00 H new ATOM 0 HG12 ILE A 34 12.584 -3.247 -8.486 1.00 0.00 H new ATOM 0 HG13 ILE A 34 13.138 -1.595 -8.668 1.00 0.00 H new ATOM 0 HG21 ILE A 34 10.488 -3.432 -6.723 1.00 0.00 H new ATOM 0 HG22 ILE A 34 9.171 -2.552 -7.534 1.00 0.00 H new ATOM 0 HG23 ILE A 34 10.227 -3.635 -8.471 1.00 0.00 H new ATOM 0 HD11 ILE A 34 14.297 -2.710 -6.824 1.00 0.00 H new ATOM 0 HD12 ILE A 34 13.303 -1.366 -6.215 1.00 0.00 H new ATOM 0 HD13 ILE A 34 12.740 -3.044 -6.030 1.00 0.00 H new ATOM 479 N VAL A 35 10.651 1.280 -8.524 1.00 0.00 N ATOM 480 CA VAL A 35 11.116 2.659 -8.436 1.00 0.00 C ATOM 481 C VAL A 35 11.192 3.121 -6.985 1.00 0.00 C ATOM 482 O VAL A 35 10.188 3.135 -6.274 1.00 0.00 O ATOM 483 CB VAL A 35 10.196 3.614 -9.220 1.00 0.00 C ATOM 484 CG1 VAL A 35 10.349 3.393 -10.717 1.00 0.00 C ATOM 485 CG2 VAL A 35 8.749 3.431 -8.790 1.00 0.00 C ATOM 0 H VAL A 35 9.781 1.095 -8.024 1.00 0.00 H new ATOM 0 HA VAL A 35 12.113 2.685 -8.876 1.00 0.00 H new ATOM 0 HB VAL A 35 10.490 4.640 -8.997 1.00 0.00 H new ATOM 0 HG11 VAL A 35 9.692 4.076 -11.255 1.00 0.00 H new ATOM 0 HG12 VAL A 35 11.383 3.579 -11.009 1.00 0.00 H new ATOM 0 HG13 VAL A 35 10.083 2.365 -10.962 1.00 0.00 H new ATOM 0 HG21 VAL A 35 8.113 4.113 -9.354 1.00 0.00 H new ATOM 0 HG22 VAL A 35 8.439 2.404 -8.982 1.00 0.00 H new ATOM 0 HG23 VAL A 35 8.656 3.645 -7.725 1.00 0.00 H new ATOM 495 N GLY A 36 12.390 3.501 -6.552 1.00 0.00 N ATOM 496 CA GLY A 36 12.575 3.959 -5.187 1.00 0.00 C ATOM 497 C GLY A 36 13.959 4.531 -4.950 1.00 0.00 C ATOM 498 O GLY A 36 14.793 4.551 -5.854 1.00 0.00 O ATOM 0 H GLY A 36 13.236 3.500 -7.122 1.00 0.00 H new ATOM 0 HA2 GLY A 36 11.827 4.718 -4.957 1.00 0.00 H new ATOM 0 HA3 GLY A 36 12.406 3.128 -4.502 1.00 0.00 H new ATOM 502 N GLY A 37 14.203 5.001 -3.730 1.00 0.00 N ATOM 503 CA GLY A 37 15.495 5.571 -3.400 1.00 0.00 C ATOM 504 C GLY A 37 15.420 7.061 -3.130 1.00 0.00 C ATOM 505 O GLY A 37 15.014 7.838 -3.995 1.00 0.00 O ATOM 0 H GLY A 37 13.528 4.997 -2.965 1.00 0.00 H new ATOM 0 HA2 GLY A 37 15.898 5.066 -2.522 1.00 0.00 H new ATOM 0 HA3 GLY A 37 16.189 5.388 -4.220 1.00 0.00 H new ATOM 509 N THR A 38 15.810 7.463 -1.924 1.00 0.00 N ATOM 510 CA THR A 38 15.782 8.869 -1.541 1.00 0.00 C ATOM 511 C THR A 38 16.250 9.760 -2.685 1.00 0.00 C ATOM 512 O THR A 38 15.859 10.924 -2.778 1.00 0.00 O ATOM 513 CB THR A 38 16.664 9.132 -0.306 1.00 0.00 C ATOM 514 OG1 THR A 38 17.987 8.637 -0.535 1.00 0.00 O ATOM 515 CG2 THR A 38 16.075 8.469 0.931 1.00 0.00 C ATOM 0 H THR A 38 16.149 6.834 -1.196 1.00 0.00 H new ATOM 0 HA THR A 38 14.747 9.110 -1.297 1.00 0.00 H new ATOM 0 HB THR A 38 16.704 10.208 -0.137 1.00 0.00 H new ATOM 0 HG1 THR A 38 18.542 8.810 0.254 1.00 0.00 H new ATOM 0 HG21 THR A 38 16.715 8.669 1.790 1.00 0.00 H new ATOM 0 HG22 THR A 38 15.079 8.870 1.119 1.00 0.00 H new ATOM 0 HG23 THR A 38 16.008 7.393 0.770 1.00 0.00 H new ATOM 523 N ASP A 39 17.088 9.207 -3.554 1.00 0.00 N ATOM 524 CA ASP A 39 17.609 9.952 -4.695 1.00 0.00 C ATOM 525 C ASP A 39 16.715 9.769 -5.917 1.00 0.00 C ATOM 526 O ASP A 39 16.499 10.707 -6.685 1.00 0.00 O ATOM 527 CB ASP A 39 19.034 9.501 -5.018 1.00 0.00 C ATOM 528 CG ASP A 39 19.481 9.941 -6.399 1.00 0.00 C ATOM 529 OD1 ASP A 39 19.220 11.106 -6.764 1.00 0.00 O ATOM 530 OD2 ASP A 39 20.092 9.119 -7.114 1.00 0.00 O ATOM 0 H ASP A 39 17.422 8.245 -3.491 1.00 0.00 H new ATOM 0 HA ASP A 39 17.622 11.010 -4.432 1.00 0.00 H new ATOM 0 HB2 ASP A 39 19.718 9.905 -4.272 1.00 0.00 H new ATOM 0 HB3 ASP A 39 19.093 8.415 -4.949 1.00 0.00 H new ATOM 535 N GLN A 40 16.198 8.557 -6.091 1.00 0.00 N ATOM 536 CA GLN A 40 15.329 8.252 -7.221 1.00 0.00 C ATOM 537 C GLN A 40 13.911 7.948 -6.750 1.00 0.00 C ATOM 538 O GLN A 40 13.228 7.097 -7.319 1.00 0.00 O ATOM 539 CB GLN A 40 15.882 7.064 -8.011 1.00 0.00 C ATOM 540 CG GLN A 40 17.396 7.078 -8.149 1.00 0.00 C ATOM 541 CD GLN A 40 17.873 7.989 -9.263 1.00 0.00 C ATOM 542 OE1 GLN A 40 17.562 9.180 -9.282 1.00 0.00 O ATOM 543 NE2 GLN A 40 18.632 7.432 -10.200 1.00 0.00 N ATOM 0 H GLN A 40 16.366 7.770 -5.464 1.00 0.00 H new ATOM 0 HA GLN A 40 15.298 9.128 -7.869 1.00 0.00 H new ATOM 0 HB2 GLN A 40 15.579 6.139 -7.521 1.00 0.00 H new ATOM 0 HB3 GLN A 40 15.435 7.059 -9.005 1.00 0.00 H new ATOM 0 HG2 GLN A 40 17.840 7.400 -7.207 1.00 0.00 H new ATOM 0 HG3 GLN A 40 17.749 6.064 -8.338 1.00 0.00 H new ATOM 0 HE21 GLN A 40 18.865 6.441 -10.145 1.00 0.00 H new ATOM 0 HE22 GLN A 40 18.982 7.996 -10.975 1.00 0.00 H new ATOM 552 N GLN A 41 13.475 8.649 -5.709 1.00 0.00 N ATOM 553 CA GLN A 41 12.138 8.453 -5.162 1.00 0.00 C ATOM 554 C GLN A 41 11.071 8.848 -6.177 1.00 0.00 C ATOM 555 O GLN A 41 10.977 10.010 -6.573 1.00 0.00 O ATOM 556 CB GLN A 41 11.964 9.268 -3.879 1.00 0.00 C ATOM 557 CG GLN A 41 12.773 10.555 -3.861 1.00 0.00 C ATOM 558 CD GLN A 41 12.123 11.641 -3.026 1.00 0.00 C ATOM 559 OE1 GLN A 41 12.375 12.829 -3.227 1.00 0.00 O ATOM 560 NE2 GLN A 41 11.282 11.237 -2.081 1.00 0.00 N ATOM 0 H GLN A 41 14.028 9.358 -5.227 1.00 0.00 H new ATOM 0 HA GLN A 41 12.020 7.394 -4.931 1.00 0.00 H new ATOM 0 HB2 GLN A 41 10.909 9.510 -3.753 1.00 0.00 H new ATOM 0 HB3 GLN A 41 12.254 8.654 -3.026 1.00 0.00 H new ATOM 0 HG2 GLN A 41 13.769 10.348 -3.470 1.00 0.00 H new ATOM 0 HG3 GLN A 41 12.900 10.914 -4.882 1.00 0.00 H new ATOM 0 HE21 GLN A 41 11.103 10.242 -1.950 1.00 0.00 H new ATOM 0 HE22 GLN A 41 10.815 11.922 -1.487 1.00 0.00 H new ATOM 569 N TYR A 42 10.270 7.874 -6.595 1.00 0.00 N ATOM 570 CA TYR A 42 9.211 8.120 -7.567 1.00 0.00 C ATOM 571 C TYR A 42 8.522 9.454 -7.297 1.00 0.00 C ATOM 572 O TYR A 42 8.131 10.163 -8.224 1.00 0.00 O ATOM 573 CB TYR A 42 8.184 6.987 -7.531 1.00 0.00 C ATOM 574 CG TYR A 42 7.409 6.831 -8.819 1.00 0.00 C ATOM 575 CD1 TYR A 42 7.921 6.086 -9.875 1.00 0.00 C ATOM 576 CD2 TYR A 42 6.164 7.427 -8.981 1.00 0.00 C ATOM 577 CE1 TYR A 42 7.216 5.942 -11.055 1.00 0.00 C ATOM 578 CE2 TYR A 42 5.452 7.287 -10.156 1.00 0.00 C ATOM 579 CZ TYR A 42 5.982 6.544 -11.190 1.00 0.00 C ATOM 580 OH TYR A 42 5.277 6.401 -12.363 1.00 0.00 O ATOM 0 H TYR A 42 10.334 6.907 -6.276 1.00 0.00 H new ATOM 0 HA TYR A 42 9.664 8.160 -8.557 1.00 0.00 H new ATOM 0 HB2 TYR A 42 8.696 6.051 -7.309 1.00 0.00 H new ATOM 0 HB3 TYR A 42 7.484 7.168 -6.715 1.00 0.00 H new ATOM 0 HD1 TYR A 42 8.886 5.612 -9.772 1.00 0.00 H new ATOM 0 HD2 TYR A 42 5.746 8.010 -8.174 1.00 0.00 H new ATOM 0 HE1 TYR A 42 7.629 5.361 -11.867 1.00 0.00 H new ATOM 0 HE2 TYR A 42 4.486 7.757 -10.265 1.00 0.00 H new ATOM 0 HH TYR A 42 4.428 6.885 -12.295 1.00 0.00 H new ATOM 590 N VAL A 43 8.378 9.791 -6.019 1.00 0.00 N ATOM 591 CA VAL A 43 7.739 11.040 -5.625 1.00 0.00 C ATOM 592 C VAL A 43 8.429 11.651 -4.410 1.00 0.00 C ATOM 593 O VAL A 43 8.897 10.936 -3.524 1.00 0.00 O ATOM 594 CB VAL A 43 6.248 10.830 -5.303 1.00 0.00 C ATOM 595 CG1 VAL A 43 5.512 12.162 -5.286 1.00 0.00 C ATOM 596 CG2 VAL A 43 5.616 9.876 -6.304 1.00 0.00 C ATOM 0 H VAL A 43 8.696 9.216 -5.239 1.00 0.00 H new ATOM 0 HA VAL A 43 7.828 11.722 -6.471 1.00 0.00 H new ATOM 0 HB VAL A 43 6.168 10.385 -4.311 1.00 0.00 H new ATOM 0 HG11 VAL A 43 4.460 11.993 -5.057 1.00 0.00 H new ATOM 0 HG12 VAL A 43 5.950 12.810 -4.526 1.00 0.00 H new ATOM 0 HG13 VAL A 43 5.599 12.638 -6.263 1.00 0.00 H new ATOM 0 HG21 VAL A 43 4.562 9.739 -6.061 1.00 0.00 H new ATOM 0 HG22 VAL A 43 5.706 10.290 -7.308 1.00 0.00 H new ATOM 0 HG23 VAL A 43 6.126 8.914 -6.261 1.00 0.00 H new ATOM 606 N SER A 44 8.488 12.978 -4.375 1.00 0.00 N ATOM 607 CA SER A 44 9.124 13.687 -3.270 1.00 0.00 C ATOM 608 C SER A 44 8.537 13.246 -1.933 1.00 0.00 C ATOM 609 O SER A 44 9.209 13.287 -0.903 1.00 0.00 O ATOM 610 CB SER A 44 8.955 15.198 -3.441 1.00 0.00 C ATOM 611 OG SER A 44 9.791 15.908 -2.544 1.00 0.00 O ATOM 0 H SER A 44 8.103 13.585 -5.099 1.00 0.00 H new ATOM 0 HA SER A 44 10.187 13.445 -3.278 1.00 0.00 H new ATOM 0 HB2 SER A 44 9.193 15.480 -4.466 1.00 0.00 H new ATOM 0 HB3 SER A 44 7.914 15.473 -3.269 1.00 0.00 H new ATOM 0 HG SER A 44 9.666 16.871 -2.673 1.00 0.00 H new ATOM 617 N ASN A 45 7.277 12.823 -1.957 1.00 0.00 N ATOM 618 CA ASN A 45 6.597 12.374 -0.747 1.00 0.00 C ATOM 619 C ASN A 45 6.572 10.851 -0.671 1.00 0.00 C ATOM 620 O ASN A 45 6.099 10.276 0.310 1.00 0.00 O ATOM 621 CB ASN A 45 5.170 12.922 -0.706 1.00 0.00 C ATOM 622 CG ASN A 45 5.102 14.315 -0.110 1.00 0.00 C ATOM 623 OD1 ASN A 45 6.125 14.903 0.242 1.00 0.00 O ATOM 624 ND2 ASN A 45 3.892 14.851 0.006 1.00 0.00 N ATOM 0 H ASN A 45 6.706 12.782 -2.801 1.00 0.00 H new ATOM 0 HA ASN A 45 7.149 12.754 0.113 1.00 0.00 H new ATOM 0 HB2 ASN A 45 4.762 12.942 -1.717 1.00 0.00 H new ATOM 0 HB3 ASN A 45 4.542 12.249 -0.122 1.00 0.00 H new ATOM 0 HD21 ASN A 45 3.784 15.786 0.400 1.00 0.00 H new ATOM 0 HD22 ASN A 45 3.071 14.328 -0.299 1.00 0.00 H new ATOM 631 N ASP A 46 7.084 10.203 -1.711 1.00 0.00 N ATOM 632 CA ASP A 46 7.122 8.746 -1.762 1.00 0.00 C ATOM 633 C ASP A 46 8.561 8.242 -1.823 1.00 0.00 C ATOM 634 O ASP A 46 9.045 7.844 -2.883 1.00 0.00 O ATOM 635 CB ASP A 46 6.338 8.236 -2.972 1.00 0.00 C ATOM 636 CG ASP A 46 4.934 8.806 -3.033 1.00 0.00 C ATOM 637 OD1 ASP A 46 4.339 9.035 -1.960 1.00 0.00 O ATOM 638 OD2 ASP A 46 4.431 9.022 -4.155 1.00 0.00 O ATOM 0 H ASP A 46 7.479 10.664 -2.531 1.00 0.00 H new ATOM 0 HA ASP A 46 6.660 8.363 -0.852 1.00 0.00 H new ATOM 0 HB2 ASP A 46 6.873 8.497 -3.885 1.00 0.00 H new ATOM 0 HB3 ASP A 46 6.284 7.148 -2.934 1.00 0.00 H new ATOM 643 N SER A 47 9.239 8.263 -0.680 1.00 0.00 N ATOM 644 CA SER A 47 10.624 7.813 -0.605 1.00 0.00 C ATOM 645 C SER A 47 10.694 6.301 -0.406 1.00 0.00 C ATOM 646 O SER A 47 11.669 5.779 0.132 1.00 0.00 O ATOM 647 CB SER A 47 11.352 8.523 0.538 1.00 0.00 C ATOM 648 OG SER A 47 10.672 8.339 1.768 1.00 0.00 O ATOM 0 H SER A 47 8.852 8.587 0.206 1.00 0.00 H new ATOM 0 HA SER A 47 11.112 8.061 -1.547 1.00 0.00 H new ATOM 0 HB2 SER A 47 12.369 8.139 0.620 1.00 0.00 H new ATOM 0 HB3 SER A 47 11.430 9.588 0.318 1.00 0.00 H new ATOM 0 HG SER A 47 11.158 8.801 2.483 1.00 0.00 H new ATOM 654 N GLY A 48 9.650 5.604 -0.845 1.00 0.00 N ATOM 655 CA GLY A 48 9.612 4.160 -0.707 1.00 0.00 C ATOM 656 C GLY A 48 9.765 3.446 -2.036 1.00 0.00 C ATOM 657 O GLY A 48 9.960 4.083 -3.071 1.00 0.00 O ATOM 0 H GLY A 48 8.831 6.014 -1.293 1.00 0.00 H new ATOM 0 HA2 GLY A 48 10.407 3.841 -0.033 1.00 0.00 H new ATOM 0 HA3 GLY A 48 8.668 3.867 -0.247 1.00 0.00 H new ATOM 661 N ILE A 49 9.679 2.121 -2.006 1.00 0.00 N ATOM 662 CA ILE A 49 9.810 1.320 -3.218 1.00 0.00 C ATOM 663 C ILE A 49 8.450 1.064 -3.857 1.00 0.00 C ATOM 664 O ILE A 49 7.505 0.649 -3.186 1.00 0.00 O ATOM 665 CB ILE A 49 10.491 -0.030 -2.929 1.00 0.00 C ATOM 666 CG1 ILE A 49 11.575 0.138 -1.862 1.00 0.00 C ATOM 667 CG2 ILE A 49 11.083 -0.609 -4.205 1.00 0.00 C ATOM 668 CD1 ILE A 49 12.566 1.237 -2.176 1.00 0.00 C ATOM 0 H ILE A 49 9.519 1.579 -1.157 1.00 0.00 H new ATOM 0 HA ILE A 49 10.431 1.891 -3.908 1.00 0.00 H new ATOM 0 HB ILE A 49 9.740 -0.724 -2.552 1.00 0.00 H new ATOM 0 HG12 ILE A 49 11.101 0.350 -0.904 1.00 0.00 H new ATOM 0 HG13 ILE A 49 12.112 -0.804 -1.750 1.00 0.00 H new ATOM 0 HG21 ILE A 49 11.561 -1.563 -3.984 1.00 0.00 H new ATOM 0 HG22 ILE A 49 10.290 -0.761 -4.937 1.00 0.00 H new ATOM 0 HG23 ILE A 49 11.823 0.082 -4.609 1.00 0.00 H new ATOM 0 HD11 ILE A 49 13.305 1.299 -1.377 1.00 0.00 H new ATOM 0 HD12 ILE A 49 13.068 1.016 -3.118 1.00 0.00 H new ATOM 0 HD13 ILE A 49 12.040 2.188 -2.259 1.00 0.00 H new ATOM 680 N TYR A 50 8.358 1.312 -5.159 1.00 0.00 N ATOM 681 CA TYR A 50 7.113 1.109 -5.890 1.00 0.00 C ATOM 682 C TYR A 50 7.364 0.360 -7.196 1.00 0.00 C ATOM 683 O TYR A 50 8.491 -0.037 -7.491 1.00 0.00 O ATOM 684 CB TYR A 50 6.443 2.452 -6.181 1.00 0.00 C ATOM 685 CG TYR A 50 6.188 3.282 -4.943 1.00 0.00 C ATOM 686 CD1 TYR A 50 7.233 3.910 -4.276 1.00 0.00 C ATOM 687 CD2 TYR A 50 4.903 3.439 -4.440 1.00 0.00 C ATOM 688 CE1 TYR A 50 7.006 4.669 -3.145 1.00 0.00 C ATOM 689 CE2 TYR A 50 4.665 4.197 -3.310 1.00 0.00 C ATOM 690 CZ TYR A 50 5.720 4.810 -2.665 1.00 0.00 C ATOM 691 OH TYR A 50 5.489 5.566 -1.539 1.00 0.00 O ATOM 0 H TYR A 50 9.131 1.654 -5.730 1.00 0.00 H new ATOM 0 HA TYR A 50 6.450 0.507 -5.268 1.00 0.00 H new ATOM 0 HB2 TYR A 50 7.071 3.021 -6.867 1.00 0.00 H new ATOM 0 HB3 TYR A 50 5.496 2.273 -6.690 1.00 0.00 H new ATOM 0 HD1 TYR A 50 8.241 3.802 -4.649 1.00 0.00 H new ATOM 0 HD2 TYR A 50 4.075 2.960 -4.941 1.00 0.00 H new ATOM 0 HE1 TYR A 50 7.830 5.150 -2.639 1.00 0.00 H new ATOM 0 HE2 TYR A 50 3.659 4.309 -2.933 1.00 0.00 H new ATOM 0 HH TYR A 50 4.530 5.565 -1.335 1.00 0.00 H new ATOM 701 N VAL A 51 6.304 0.171 -7.975 1.00 0.00 N ATOM 702 CA VAL A 51 6.407 -0.528 -9.250 1.00 0.00 C ATOM 703 C VAL A 51 6.026 0.385 -10.410 1.00 0.00 C ATOM 704 O VAL A 51 5.053 1.135 -10.329 1.00 0.00 O ATOM 705 CB VAL A 51 5.509 -1.779 -9.279 1.00 0.00 C ATOM 706 CG1 VAL A 51 5.699 -2.543 -10.581 1.00 0.00 C ATOM 707 CG2 VAL A 51 5.800 -2.671 -8.081 1.00 0.00 C ATOM 0 H VAL A 51 5.364 0.492 -7.745 1.00 0.00 H new ATOM 0 HA VAL A 51 7.447 -0.834 -9.359 1.00 0.00 H new ATOM 0 HB VAL A 51 4.468 -1.459 -9.222 1.00 0.00 H new ATOM 0 HG11 VAL A 51 5.057 -3.424 -10.583 1.00 0.00 H new ATOM 0 HG12 VAL A 51 5.437 -1.900 -11.422 1.00 0.00 H new ATOM 0 HG13 VAL A 51 6.740 -2.853 -10.672 1.00 0.00 H new ATOM 0 HG21 VAL A 51 5.157 -3.550 -8.117 1.00 0.00 H new ATOM 0 HG22 VAL A 51 6.844 -2.984 -8.105 1.00 0.00 H new ATOM 0 HG23 VAL A 51 5.608 -2.119 -7.161 1.00 0.00 H new ATOM 717 N SER A 52 6.798 0.315 -11.490 1.00 0.00 N ATOM 718 CA SER A 52 6.543 1.138 -12.666 1.00 0.00 C ATOM 719 C SER A 52 6.083 0.280 -13.840 1.00 0.00 C ATOM 720 O SER A 52 5.084 0.584 -14.493 1.00 0.00 O ATOM 721 CB SER A 52 7.801 1.918 -13.052 1.00 0.00 C ATOM 722 OG SER A 52 8.915 1.052 -13.192 1.00 0.00 O ATOM 0 H SER A 52 7.605 -0.303 -11.575 1.00 0.00 H new ATOM 0 HA SER A 52 5.749 1.843 -12.420 1.00 0.00 H new ATOM 0 HB2 SER A 52 7.630 2.450 -13.988 1.00 0.00 H new ATOM 0 HB3 SER A 52 8.014 2.670 -12.292 1.00 0.00 H new ATOM 0 HG SER A 52 9.706 1.574 -13.441 1.00 0.00 H new ATOM 728 N ARG A 53 6.819 -0.795 -14.103 1.00 0.00 N ATOM 729 CA ARG A 53 6.489 -1.698 -15.199 1.00 0.00 C ATOM 730 C ARG A 53 6.704 -3.152 -14.789 1.00 0.00 C ATOM 731 O ARG A 53 7.578 -3.455 -13.976 1.00 0.00 O ATOM 732 CB ARG A 53 7.337 -1.373 -16.430 1.00 0.00 C ATOM 733 CG ARG A 53 6.670 -1.741 -17.745 1.00 0.00 C ATOM 734 CD ARG A 53 7.013 -3.162 -18.165 1.00 0.00 C ATOM 735 NE ARG A 53 8.266 -3.224 -18.912 1.00 0.00 N ATOM 736 CZ ARG A 53 8.596 -4.233 -19.710 1.00 0.00 C ATOM 737 NH1 ARG A 53 7.770 -5.258 -19.865 1.00 0.00 N ATOM 738 NH2 ARG A 53 9.755 -4.217 -20.357 1.00 0.00 N ATOM 0 H ARG A 53 7.648 -1.062 -13.572 1.00 0.00 H new ATOM 0 HA ARG A 53 5.436 -1.560 -15.445 1.00 0.00 H new ATOM 0 HB2 ARG A 53 7.563 -0.307 -16.433 1.00 0.00 H new ATOM 0 HB3 ARG A 53 8.288 -1.900 -16.355 1.00 0.00 H new ATOM 0 HG2 ARG A 53 5.589 -1.640 -17.647 1.00 0.00 H new ATOM 0 HG3 ARG A 53 6.986 -1.045 -18.522 1.00 0.00 H new ATOM 0 HD2 ARG A 53 7.087 -3.794 -17.280 1.00 0.00 H new ATOM 0 HD3 ARG A 53 6.206 -3.564 -18.777 1.00 0.00 H new ATOM 0 HE ARG A 53 8.924 -2.450 -18.816 1.00 0.00 H new ATOM 0 HH11 ARG A 53 6.878 -5.273 -19.371 1.00 0.00 H new ATOM 0 HH12 ARG A 53 8.026 -6.031 -20.479 1.00 0.00 H new ATOM 0 HH21 ARG A 53 10.393 -3.429 -20.241 1.00 0.00 H new ATOM 0 HH22 ARG A 53 10.008 -4.992 -20.970 1.00 0.00 H new ATOM 752 N ILE A 54 5.902 -4.046 -15.357 1.00 0.00 N ATOM 753 CA ILE A 54 6.006 -5.468 -15.051 1.00 0.00 C ATOM 754 C ILE A 54 6.057 -6.302 -16.327 1.00 0.00 C ATOM 755 O ILE A 54 5.089 -6.357 -17.086 1.00 0.00 O ATOM 756 CB ILE A 54 4.824 -5.945 -14.186 1.00 0.00 C ATOM 757 CG1 ILE A 54 4.622 -5.004 -12.997 1.00 0.00 C ATOM 758 CG2 ILE A 54 5.061 -7.369 -13.707 1.00 0.00 C ATOM 759 CD1 ILE A 54 3.526 -5.448 -12.054 1.00 0.00 C ATOM 0 H ILE A 54 5.173 -3.811 -16.031 1.00 0.00 H new ATOM 0 HA ILE A 54 6.932 -5.605 -14.493 1.00 0.00 H new ATOM 0 HB ILE A 54 3.919 -5.932 -14.793 1.00 0.00 H new ATOM 0 HG12 ILE A 54 5.557 -4.926 -12.443 1.00 0.00 H new ATOM 0 HG13 ILE A 54 4.388 -4.007 -13.369 1.00 0.00 H new ATOM 0 HG21 ILE A 54 4.218 -7.693 -13.097 1.00 0.00 H new ATOM 0 HG22 ILE A 54 5.161 -8.030 -14.568 1.00 0.00 H new ATOM 0 HG23 ILE A 54 5.974 -7.406 -13.113 1.00 0.00 H new ATOM 0 HD11 ILE A 54 3.439 -4.734 -11.235 1.00 0.00 H new ATOM 0 HD12 ILE A 54 2.580 -5.499 -12.593 1.00 0.00 H new ATOM 0 HD13 ILE A 54 3.768 -6.432 -11.653 1.00 0.00 H new ATOM 771 N LYS A 55 7.192 -6.953 -16.556 1.00 0.00 N ATOM 772 CA LYS A 55 7.370 -7.789 -17.738 1.00 0.00 C ATOM 773 C LYS A 55 6.214 -8.772 -17.888 1.00 0.00 C ATOM 774 O LYS A 55 6.041 -9.670 -17.065 1.00 0.00 O ATOM 775 CB LYS A 55 8.694 -8.551 -17.654 1.00 0.00 C ATOM 776 CG LYS A 55 9.918 -7.660 -17.770 1.00 0.00 C ATOM 777 CD LYS A 55 11.151 -8.453 -18.170 1.00 0.00 C ATOM 778 CE LYS A 55 11.263 -8.584 -19.681 1.00 0.00 C ATOM 779 NZ LYS A 55 12.264 -9.613 -20.076 1.00 0.00 N ATOM 0 H LYS A 55 8.003 -6.918 -15.939 1.00 0.00 H new ATOM 0 HA LYS A 55 7.387 -7.139 -18.613 1.00 0.00 H new ATOM 0 HB2 LYS A 55 8.735 -9.088 -16.706 1.00 0.00 H new ATOM 0 HB3 LYS A 55 8.724 -9.299 -18.446 1.00 0.00 H new ATOM 0 HG2 LYS A 55 9.732 -6.879 -18.507 1.00 0.00 H new ATOM 0 HG3 LYS A 55 10.098 -7.162 -16.817 1.00 0.00 H new ATOM 0 HD2 LYS A 55 12.043 -7.963 -17.779 1.00 0.00 H new ATOM 0 HD3 LYS A 55 11.109 -9.445 -17.720 1.00 0.00 H new ATOM 0 HE2 LYS A 55 10.290 -8.846 -20.096 1.00 0.00 H new ATOM 0 HE3 LYS A 55 11.543 -7.622 -20.109 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 12.311 -9.672 -21.113 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 13.198 -9.350 -19.702 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 11.983 -10.537 -19.689 1.00 0.00 H new ATOM 793 N GLU A 56 5.427 -8.596 -18.945 1.00 0.00 N ATOM 794 CA GLU A 56 4.288 -9.469 -19.202 1.00 0.00 C ATOM 795 C GLU A 56 4.721 -10.932 -19.242 1.00 0.00 C ATOM 796 O GLU A 56 3.949 -11.828 -18.906 1.00 0.00 O ATOM 797 CB GLU A 56 3.614 -9.090 -20.523 1.00 0.00 C ATOM 798 CG GLU A 56 4.594 -8.834 -21.655 1.00 0.00 C ATOM 799 CD GLU A 56 3.903 -8.617 -22.987 1.00 0.00 C ATOM 800 OE1 GLU A 56 3.410 -7.495 -23.224 1.00 0.00 O ATOM 801 OE2 GLU A 56 3.855 -9.570 -23.793 1.00 0.00 O ATOM 0 H GLU A 56 5.557 -7.857 -19.636 1.00 0.00 H new ATOM 0 HA GLU A 56 3.575 -9.341 -18.388 1.00 0.00 H new ATOM 0 HB2 GLU A 56 2.934 -9.890 -20.817 1.00 0.00 H new ATOM 0 HB3 GLU A 56 3.008 -8.197 -20.369 1.00 0.00 H new ATOM 0 HG2 GLU A 56 5.198 -7.959 -21.417 1.00 0.00 H new ATOM 0 HG3 GLU A 56 5.277 -9.680 -21.738 1.00 0.00 H new ATOM 808 N ASN A 57 5.963 -11.164 -19.655 1.00 0.00 N ATOM 809 CA ASN A 57 6.500 -12.517 -19.740 1.00 0.00 C ATOM 810 C ASN A 57 7.387 -12.826 -18.539 1.00 0.00 C ATOM 811 O ASN A 57 8.294 -13.653 -18.620 1.00 0.00 O ATOM 812 CB ASN A 57 7.296 -12.692 -21.035 1.00 0.00 C ATOM 813 CG ASN A 57 6.411 -13.045 -22.215 1.00 0.00 C ATOM 814 OD1 ASN A 57 6.001 -14.195 -22.375 1.00 0.00 O ATOM 815 ND2 ASN A 57 6.111 -12.055 -23.047 1.00 0.00 N ATOM 0 H ASN A 57 6.616 -10.433 -19.936 1.00 0.00 H new ATOM 0 HA ASN A 57 5.662 -13.214 -19.740 1.00 0.00 H new ATOM 0 HB2 ASN A 57 7.837 -11.771 -21.253 1.00 0.00 H new ATOM 0 HB3 ASN A 57 8.042 -13.475 -20.897 1.00 0.00 H new ATOM 0 HD21 ASN A 57 5.518 -12.232 -23.858 1.00 0.00 H new ATOM 0 HD22 ASN A 57 6.473 -11.117 -22.875 1.00 0.00 H new ATOM 822 N GLY A 58 7.118 -12.156 -17.422 1.00 0.00 N ATOM 823 CA GLY A 58 7.900 -12.373 -16.220 1.00 0.00 C ATOM 824 C GLY A 58 7.122 -13.110 -15.147 1.00 0.00 C ATOM 825 O GLY A 58 5.954 -13.445 -15.339 1.00 0.00 O ATOM 0 H GLY A 58 6.372 -11.467 -17.329 1.00 0.00 H new ATOM 0 HA2 GLY A 58 8.795 -12.942 -16.471 1.00 0.00 H new ATOM 0 HA3 GLY A 58 8.232 -11.412 -15.828 1.00 0.00 H new ATOM 829 N ALA A 59 7.772 -13.364 -14.016 1.00 0.00 N ATOM 830 CA ALA A 59 7.134 -14.065 -12.909 1.00 0.00 C ATOM 831 C ALA A 59 6.048 -13.207 -12.269 1.00 0.00 C ATOM 832 O ALA A 59 5.021 -13.719 -11.825 1.00 0.00 O ATOM 833 CB ALA A 59 8.171 -14.469 -11.872 1.00 0.00 C ATOM 0 H ALA A 59 8.740 -13.095 -13.842 1.00 0.00 H new ATOM 0 HA ALA A 59 6.663 -14.965 -13.304 1.00 0.00 H new ATOM 0 HB1 ALA A 59 7.680 -14.992 -11.051 1.00 0.00 H new ATOM 0 HB2 ALA A 59 8.908 -15.127 -12.332 1.00 0.00 H new ATOM 0 HB3 ALA A 59 8.669 -13.578 -11.489 1.00 0.00 H new ATOM 839 N ALA A 60 6.284 -11.900 -12.223 1.00 0.00 N ATOM 840 CA ALA A 60 5.325 -10.971 -11.638 1.00 0.00 C ATOM 841 C ALA A 60 4.069 -10.865 -12.496 1.00 0.00 C ATOM 842 O ALA A 60 2.954 -10.819 -11.977 1.00 0.00 O ATOM 843 CB ALA A 60 5.961 -9.600 -11.457 1.00 0.00 C ATOM 0 H ALA A 60 7.131 -11.461 -12.584 1.00 0.00 H new ATOM 0 HA ALA A 60 5.034 -11.356 -10.661 1.00 0.00 H new ATOM 0 HB1 ALA A 60 5.234 -8.916 -11.019 1.00 0.00 H new ATOM 0 HB2 ALA A 60 6.824 -9.684 -10.796 1.00 0.00 H new ATOM 0 HB3 ALA A 60 6.282 -9.217 -12.426 1.00 0.00 H new ATOM 849 N ALA A 61 4.258 -10.825 -13.811 1.00 0.00 N ATOM 850 CA ALA A 61 3.140 -10.726 -14.740 1.00 0.00 C ATOM 851 C ALA A 61 2.330 -12.017 -14.765 1.00 0.00 C ATOM 852 O ALA A 61 1.122 -12.009 -14.524 1.00 0.00 O ATOM 853 CB ALA A 61 3.643 -10.389 -16.136 1.00 0.00 C ATOM 0 H ALA A 61 5.175 -10.860 -14.256 1.00 0.00 H new ATOM 0 HA ALA A 61 2.485 -9.925 -14.398 1.00 0.00 H new ATOM 0 HB1 ALA A 61 2.797 -10.318 -16.820 1.00 0.00 H new ATOM 0 HB2 ALA A 61 4.171 -9.436 -16.112 1.00 0.00 H new ATOM 0 HB3 ALA A 61 4.321 -11.171 -16.477 1.00 0.00 H new ATOM 859 N LEU A 62 3.001 -13.125 -15.058 1.00 0.00 N ATOM 860 CA LEU A 62 2.343 -14.426 -15.115 1.00 0.00 C ATOM 861 C LEU A 62 1.567 -14.700 -13.831 1.00 0.00 C ATOM 862 O LEU A 62 0.359 -14.939 -13.863 1.00 0.00 O ATOM 863 CB LEU A 62 3.375 -15.532 -15.347 1.00 0.00 C ATOM 864 CG LEU A 62 4.156 -15.456 -16.659 1.00 0.00 C ATOM 865 CD1 LEU A 62 5.375 -16.365 -16.607 1.00 0.00 C ATOM 866 CD2 LEU A 62 3.263 -15.825 -17.834 1.00 0.00 C ATOM 0 H LEU A 62 4.001 -13.149 -15.260 1.00 0.00 H new ATOM 0 HA LEU A 62 1.639 -14.414 -15.947 1.00 0.00 H new ATOM 0 HB2 LEU A 62 4.087 -15.516 -14.522 1.00 0.00 H new ATOM 0 HB3 LEU A 62 2.863 -16.493 -15.307 1.00 0.00 H new ATOM 0 HG LEU A 62 4.498 -14.430 -16.797 1.00 0.00 H new ATOM 0 HD11 LEU A 62 5.919 -16.298 -17.549 1.00 0.00 H new ATOM 0 HD12 LEU A 62 6.026 -16.055 -15.789 1.00 0.00 H new ATOM 0 HD13 LEU A 62 5.055 -17.394 -16.445 1.00 0.00 H new ATOM 0 HD21 LEU A 62 3.836 -15.765 -18.759 1.00 0.00 H new ATOM 0 HD22 LEU A 62 2.890 -16.841 -17.703 1.00 0.00 H new ATOM 0 HD23 LEU A 62 2.422 -15.134 -17.883 1.00 0.00 H new ATOM 878 N ASP A 63 2.267 -14.662 -12.703 1.00 0.00 N ATOM 879 CA ASP A 63 1.643 -14.903 -11.407 1.00 0.00 C ATOM 880 C ASP A 63 0.462 -13.962 -11.189 1.00 0.00 C ATOM 881 O ASP A 63 -0.591 -14.373 -10.704 1.00 0.00 O ATOM 882 CB ASP A 63 2.666 -14.727 -10.284 1.00 0.00 C ATOM 883 CG ASP A 63 2.163 -15.254 -8.954 1.00 0.00 C ATOM 884 OD1 ASP A 63 1.305 -16.162 -8.962 1.00 0.00 O ATOM 885 OD2 ASP A 63 2.627 -14.759 -7.906 1.00 0.00 O ATOM 0 H ASP A 63 3.267 -14.467 -12.660 1.00 0.00 H new ATOM 0 HA ASP A 63 1.274 -15.929 -11.394 1.00 0.00 H new ATOM 0 HB2 ASP A 63 3.587 -15.244 -10.551 1.00 0.00 H new ATOM 0 HB3 ASP A 63 2.912 -13.670 -10.183 1.00 0.00 H new ATOM 890 N GLY A 64 0.647 -12.696 -11.550 1.00 0.00 N ATOM 891 CA GLY A 64 -0.411 -11.716 -11.386 1.00 0.00 C ATOM 892 C GLY A 64 -0.464 -11.151 -9.980 1.00 0.00 C ATOM 893 O GLY A 64 -0.857 -10.002 -9.780 1.00 0.00 O ATOM 0 H GLY A 64 1.510 -12.332 -11.953 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -0.262 -10.902 -12.096 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -1.369 -12.177 -11.626 1.00 0.00 H new ATOM 897 N ARG A 65 -0.068 -11.961 -9.003 1.00 0.00 N ATOM 898 CA ARG A 65 -0.075 -11.536 -7.609 1.00 0.00 C ATOM 899 C ARG A 65 0.310 -10.064 -7.487 1.00 0.00 C ATOM 900 O ARG A 65 -0.404 -9.274 -6.868 1.00 0.00 O ATOM 901 CB ARG A 65 0.887 -12.396 -6.787 1.00 0.00 C ATOM 902 CG ARG A 65 0.447 -13.844 -6.653 1.00 0.00 C ATOM 903 CD ARG A 65 -0.801 -13.971 -5.794 1.00 0.00 C ATOM 904 NE ARG A 65 -0.604 -13.415 -4.457 1.00 0.00 N ATOM 905 CZ ARG A 65 -1.437 -13.625 -3.444 1.00 0.00 C ATOM 906 NH1 ARG A 65 -2.518 -14.375 -3.614 1.00 0.00 N ATOM 907 NH2 ARG A 65 -1.190 -13.086 -2.258 1.00 0.00 N ATOM 0 H ARG A 65 0.261 -12.915 -9.152 1.00 0.00 H new ATOM 0 HA ARG A 65 -1.086 -11.662 -7.222 1.00 0.00 H new ATOM 0 HB2 ARG A 65 1.873 -12.366 -7.250 1.00 0.00 H new ATOM 0 HB3 ARG A 65 0.989 -11.963 -5.792 1.00 0.00 H new ATOM 0 HG2 ARG A 65 0.253 -14.259 -7.642 1.00 0.00 H new ATOM 0 HG3 ARG A 65 1.253 -14.431 -6.214 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -1.630 -13.458 -6.281 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -1.080 -15.022 -5.712 1.00 0.00 H new ATOM 0 HE ARG A 65 0.218 -12.834 -4.293 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -2.711 -14.792 -4.525 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -3.156 -14.535 -2.834 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -0.360 -12.509 -2.123 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -1.830 -13.248 -1.481 1.00 0.00 H new ATOM 921 N LEU A 66 1.442 -9.704 -8.080 1.00 0.00 N ATOM 922 CA LEU A 66 1.923 -8.327 -8.038 1.00 0.00 C ATOM 923 C LEU A 66 1.330 -7.508 -9.180 1.00 0.00 C ATOM 924 O LEU A 66 1.004 -8.046 -10.238 1.00 0.00 O ATOM 925 CB LEU A 66 3.451 -8.297 -8.114 1.00 0.00 C ATOM 926 CG LEU A 66 4.130 -7.081 -7.484 1.00 0.00 C ATOM 927 CD1 LEU A 66 4.251 -7.256 -5.979 1.00 0.00 C ATOM 928 CD2 LEU A 66 5.499 -6.852 -8.108 1.00 0.00 C ATOM 0 H LEU A 66 2.044 -10.346 -8.596 1.00 0.00 H new ATOM 0 HA LEU A 66 1.603 -7.885 -7.094 1.00 0.00 H new ATOM 0 HB2 LEU A 66 3.837 -9.195 -7.630 1.00 0.00 H new ATOM 0 HB3 LEU A 66 3.744 -8.349 -9.163 1.00 0.00 H new ATOM 0 HG LEU A 66 3.513 -6.204 -7.678 1.00 0.00 H new ATOM 0 HD11 LEU A 66 4.737 -6.380 -5.549 1.00 0.00 H new ATOM 0 HD12 LEU A 66 3.258 -7.370 -5.545 1.00 0.00 H new ATOM 0 HD13 LEU A 66 4.845 -8.144 -5.763 1.00 0.00 H new ATOM 0 HD21 LEU A 66 5.968 -5.982 -7.648 1.00 0.00 H new ATOM 0 HD22 LEU A 66 6.124 -7.730 -7.946 1.00 0.00 H new ATOM 0 HD23 LEU A 66 5.387 -6.679 -9.178 1.00 0.00 H new ATOM 940 N GLN A 67 1.194 -6.204 -8.957 1.00 0.00 N ATOM 941 CA GLN A 67 0.641 -5.311 -9.969 1.00 0.00 C ATOM 942 C GLN A 67 1.234 -3.912 -9.842 1.00 0.00 C ATOM 943 O GLN A 67 1.580 -3.472 -8.746 1.00 0.00 O ATOM 944 CB GLN A 67 -0.882 -5.245 -9.844 1.00 0.00 C ATOM 945 CG GLN A 67 -1.361 -4.756 -8.486 1.00 0.00 C ATOM 946 CD GLN A 67 -2.871 -4.671 -8.396 1.00 0.00 C ATOM 947 OE1 GLN A 67 -3.427 -3.623 -8.066 1.00 0.00 O ATOM 948 NE2 GLN A 67 -3.546 -5.777 -8.690 1.00 0.00 N ATOM 0 H GLN A 67 1.459 -5.743 -8.086 1.00 0.00 H new ATOM 0 HA GLN A 67 0.901 -5.709 -10.950 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -1.273 -4.584 -10.617 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -1.297 -6.235 -10.031 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -0.992 -5.428 -7.711 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -0.933 -3.774 -8.286 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -3.045 -6.624 -8.959 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -4.565 -5.779 -8.647 1.00 0.00 H new ATOM 957 N GLU A 68 1.349 -3.219 -10.970 1.00 0.00 N ATOM 958 CA GLU A 68 1.902 -1.869 -10.984 1.00 0.00 C ATOM 959 C GLU A 68 1.136 -0.957 -10.030 1.00 0.00 C ATOM 960 O GLU A 68 0.035 -1.286 -9.590 1.00 0.00 O ATOM 961 CB GLU A 68 1.862 -1.293 -12.401 1.00 0.00 C ATOM 962 CG GLU A 68 2.856 -1.941 -13.350 1.00 0.00 C ATOM 963 CD GLU A 68 2.288 -3.165 -14.042 1.00 0.00 C ATOM 964 OE1 GLU A 68 1.229 -3.657 -13.601 1.00 0.00 O ATOM 965 OE2 GLU A 68 2.903 -3.631 -15.024 1.00 0.00 O ATOM 0 H GLU A 68 1.067 -3.569 -11.886 1.00 0.00 H new ATOM 0 HA GLU A 68 2.938 -1.925 -10.651 1.00 0.00 H new ATOM 0 HB2 GLU A 68 0.856 -1.413 -12.804 1.00 0.00 H new ATOM 0 HB3 GLU A 68 2.062 -0.222 -12.355 1.00 0.00 H new ATOM 0 HG2 GLU A 68 3.163 -1.213 -14.101 1.00 0.00 H new ATOM 0 HG3 GLU A 68 3.751 -2.224 -12.796 1.00 0.00 H new ATOM 972 N GLY A 69 1.727 0.191 -9.716 1.00 0.00 N ATOM 973 CA GLY A 69 1.087 1.133 -8.816 1.00 0.00 C ATOM 974 C GLY A 69 1.122 0.671 -7.373 1.00 0.00 C ATOM 975 O GLY A 69 0.540 1.309 -6.495 1.00 0.00 O ATOM 0 H GLY A 69 2.638 0.486 -10.069 1.00 0.00 H new ATOM 0 HA2 GLY A 69 1.582 2.101 -8.896 1.00 0.00 H new ATOM 0 HA3 GLY A 69 0.051 1.278 -9.123 1.00 0.00 H new ATOM 979 N ASP A 70 1.805 -0.441 -7.125 1.00 0.00 N ATOM 980 CA ASP A 70 1.914 -0.989 -5.778 1.00 0.00 C ATOM 981 C ASP A 70 3.116 -0.399 -5.047 1.00 0.00 C ATOM 982 O ASP A 70 3.916 0.331 -5.633 1.00 0.00 O ATOM 983 CB ASP A 70 2.031 -2.513 -5.832 1.00 0.00 C ATOM 984 CG ASP A 70 0.683 -3.193 -5.969 1.00 0.00 C ATOM 985 OD1 ASP A 70 -0.342 -2.542 -5.677 1.00 0.00 O ATOM 986 OD2 ASP A 70 0.653 -4.376 -6.367 1.00 0.00 O ATOM 0 H ASP A 70 2.292 -0.981 -7.840 1.00 0.00 H new ATOM 0 HA ASP A 70 1.011 -0.722 -5.229 1.00 0.00 H new ATOM 0 HB2 ASP A 70 2.665 -2.796 -6.673 1.00 0.00 H new ATOM 0 HB3 ASP A 70 2.524 -2.869 -4.927 1.00 0.00 H new ATOM 991 N LYS A 71 3.236 -0.719 -3.763 1.00 0.00 N ATOM 992 CA LYS A 71 4.340 -0.222 -2.950 1.00 0.00 C ATOM 993 C LYS A 71 4.860 -1.309 -2.015 1.00 0.00 C ATOM 994 O LYS A 71 4.192 -1.680 -1.049 1.00 0.00 O ATOM 995 CB LYS A 71 3.894 0.996 -2.137 1.00 0.00 C ATOM 996 CG LYS A 71 5.037 1.717 -1.446 1.00 0.00 C ATOM 997 CD LYS A 71 5.456 1.006 -0.170 1.00 0.00 C ATOM 998 CE LYS A 71 6.018 1.981 0.854 1.00 0.00 C ATOM 999 NZ LYS A 71 6.957 1.314 1.797 1.00 0.00 N ATOM 0 H LYS A 71 2.582 -1.321 -3.263 1.00 0.00 H new ATOM 0 HA LYS A 71 5.148 0.072 -3.620 1.00 0.00 H new ATOM 0 HB2 LYS A 71 3.381 1.695 -2.797 1.00 0.00 H new ATOM 0 HB3 LYS A 71 3.171 0.677 -1.387 1.00 0.00 H new ATOM 0 HG2 LYS A 71 5.889 1.783 -2.123 1.00 0.00 H new ATOM 0 HG3 LYS A 71 4.736 2.738 -1.212 1.00 0.00 H new ATOM 0 HD2 LYS A 71 4.599 0.484 0.255 1.00 0.00 H new ATOM 0 HD3 LYS A 71 6.206 0.250 -0.403 1.00 0.00 H new ATOM 0 HE2 LYS A 71 6.535 2.791 0.339 1.00 0.00 H new ATOM 0 HE3 LYS A 71 5.199 2.431 1.415 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 7.782 1.927 1.957 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 6.475 1.139 2.702 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 7.272 0.409 1.392 1.00 0.00 H new ATOM 1013 N ILE A 72 6.053 -1.813 -2.307 1.00 0.00 N ATOM 1014 CA ILE A 72 6.663 -2.856 -1.490 1.00 0.00 C ATOM 1015 C ILE A 72 7.174 -2.290 -0.169 1.00 0.00 C ATOM 1016 O ILE A 72 8.098 -1.476 -0.146 1.00 0.00 O ATOM 1017 CB ILE A 72 7.828 -3.540 -2.228 1.00 0.00 C ATOM 1018 CG1 ILE A 72 7.349 -4.115 -3.563 1.00 0.00 C ATOM 1019 CG2 ILE A 72 8.434 -4.634 -1.361 1.00 0.00 C ATOM 1020 CD1 ILE A 72 8.476 -4.488 -4.500 1.00 0.00 C ATOM 0 H ILE A 72 6.617 -1.517 -3.103 1.00 0.00 H new ATOM 0 HA ILE A 72 5.887 -3.595 -1.290 1.00 0.00 H new ATOM 0 HB ILE A 72 8.597 -2.795 -2.431 1.00 0.00 H new ATOM 0 HG12 ILE A 72 6.740 -4.998 -3.371 1.00 0.00 H new ATOM 0 HG13 ILE A 72 6.706 -3.385 -4.054 1.00 0.00 H new ATOM 0 HG21 ILE A 72 9.256 -5.109 -1.896 1.00 0.00 H new ATOM 0 HG22 ILE A 72 8.807 -4.199 -0.434 1.00 0.00 H new ATOM 0 HG23 ILE A 72 7.673 -5.379 -1.131 1.00 0.00 H new ATOM 0 HD11 ILE A 72 8.062 -4.888 -5.426 1.00 0.00 H new ATOM 0 HD12 ILE A 72 9.072 -3.603 -4.722 1.00 0.00 H new ATOM 0 HD13 ILE A 72 9.107 -5.242 -4.029 1.00 0.00 H new ATOM 1032 N LEU A 73 6.568 -2.728 0.929 1.00 0.00 N ATOM 1033 CA LEU A 73 6.963 -2.268 2.256 1.00 0.00 C ATOM 1034 C LEU A 73 8.197 -3.017 2.747 1.00 0.00 C ATOM 1035 O LEU A 73 9.214 -2.409 3.078 1.00 0.00 O ATOM 1036 CB LEU A 73 5.811 -2.453 3.245 1.00 0.00 C ATOM 1037 CG LEU A 73 4.433 -1.997 2.765 1.00 0.00 C ATOM 1038 CD1 LEU A 73 3.339 -2.835 3.407 1.00 0.00 C ATOM 1039 CD2 LEU A 73 4.225 -0.520 3.068 1.00 0.00 C ATOM 0 H LEU A 73 5.801 -3.401 0.927 1.00 0.00 H new ATOM 0 HA LEU A 73 7.208 -1.208 2.188 1.00 0.00 H new ATOM 0 HB2 LEU A 73 5.751 -3.509 3.508 1.00 0.00 H new ATOM 0 HB3 LEU A 73 6.053 -1.910 4.159 1.00 0.00 H new ATOM 0 HG LEU A 73 4.381 -2.137 1.685 1.00 0.00 H new ATOM 0 HD11 LEU A 73 2.366 -2.495 3.053 1.00 0.00 H new ATOM 0 HD12 LEU A 73 3.478 -3.882 3.138 1.00 0.00 H new ATOM 0 HD13 LEU A 73 3.388 -2.729 4.491 1.00 0.00 H new ATOM 0 HD21 LEU A 73 3.239 -0.212 2.720 1.00 0.00 H new ATOM 0 HD22 LEU A 73 4.298 -0.355 4.143 1.00 0.00 H new ATOM 0 HD23 LEU A 73 4.989 0.067 2.559 1.00 0.00 H new ATOM 1051 N SER A 74 8.099 -4.342 2.791 1.00 0.00 N ATOM 1052 CA SER A 74 9.207 -5.175 3.244 1.00 0.00 C ATOM 1053 C SER A 74 9.550 -6.236 2.202 1.00 0.00 C ATOM 1054 O SER A 74 8.759 -6.517 1.301 1.00 0.00 O ATOM 1055 CB SER A 74 8.859 -5.845 4.575 1.00 0.00 C ATOM 1056 OG SER A 74 7.560 -6.411 4.536 1.00 0.00 O ATOM 0 H SER A 74 7.264 -4.861 2.519 1.00 0.00 H new ATOM 0 HA SER A 74 10.077 -4.534 3.385 1.00 0.00 H new ATOM 0 HB2 SER A 74 9.591 -6.621 4.797 1.00 0.00 H new ATOM 0 HB3 SER A 74 8.916 -5.113 5.380 1.00 0.00 H new ATOM 0 HG SER A 74 7.362 -6.835 5.397 1.00 0.00 H new ATOM 1062 N VAL A 75 10.736 -6.823 2.333 1.00 0.00 N ATOM 1063 CA VAL A 75 11.184 -7.854 1.405 1.00 0.00 C ATOM 1064 C VAL A 75 11.737 -9.063 2.152 1.00 0.00 C ATOM 1065 O VAL A 75 12.891 -9.069 2.576 1.00 0.00 O ATOM 1066 CB VAL A 75 12.266 -7.317 0.449 1.00 0.00 C ATOM 1067 CG1 VAL A 75 12.772 -8.425 -0.462 1.00 0.00 C ATOM 1068 CG2 VAL A 75 11.725 -6.151 -0.365 1.00 0.00 C ATOM 0 H VAL A 75 11.403 -6.602 3.072 1.00 0.00 H new ATOM 0 HA VAL A 75 10.313 -8.156 0.824 1.00 0.00 H new ATOM 0 HB VAL A 75 13.106 -6.957 1.043 1.00 0.00 H new ATOM 0 HG11 VAL A 75 13.536 -8.027 -1.130 1.00 0.00 H new ATOM 0 HG12 VAL A 75 13.200 -9.225 0.142 1.00 0.00 H new ATOM 0 HG13 VAL A 75 11.944 -8.818 -1.051 1.00 0.00 H new ATOM 0 HG21 VAL A 75 12.502 -5.784 -1.035 1.00 0.00 H new ATOM 0 HG22 VAL A 75 10.868 -6.483 -0.951 1.00 0.00 H new ATOM 0 HG23 VAL A 75 11.417 -5.350 0.307 1.00 0.00 H new ATOM 1078 N ASN A 76 10.904 -10.087 2.307 1.00 0.00 N ATOM 1079 CA ASN A 76 11.309 -11.303 3.003 1.00 0.00 C ATOM 1080 C ASN A 76 11.542 -11.029 4.486 1.00 0.00 C ATOM 1081 O ASN A 76 12.458 -11.581 5.094 1.00 0.00 O ATOM 1082 CB ASN A 76 12.580 -11.877 2.373 1.00 0.00 C ATOM 1083 CG ASN A 76 12.659 -13.386 2.503 1.00 0.00 C ATOM 1084 OD1 ASN A 76 12.516 -13.934 3.596 1.00 0.00 O ATOM 1085 ND2 ASN A 76 12.888 -14.064 1.385 1.00 0.00 N ATOM 0 H ASN A 76 9.945 -10.099 1.960 1.00 0.00 H new ATOM 0 HA ASN A 76 10.504 -12.031 2.908 1.00 0.00 H new ATOM 0 HB2 ASN A 76 12.615 -11.604 1.318 1.00 0.00 H new ATOM 0 HB3 ASN A 76 13.452 -11.428 2.848 1.00 0.00 H new ATOM 0 HD21 ASN A 76 12.952 -15.082 1.410 1.00 0.00 H new ATOM 0 HD22 ASN A 76 13.000 -13.567 0.501 1.00 0.00 H new ATOM 1092 N GLY A 77 10.705 -10.172 5.063 1.00 0.00 N ATOM 1093 CA GLY A 77 10.836 -9.840 6.470 1.00 0.00 C ATOM 1094 C GLY A 77 11.701 -8.617 6.698 1.00 0.00 C ATOM 1095 O GLY A 77 11.827 -8.141 7.826 1.00 0.00 O ATOM 0 H GLY A 77 9.939 -9.702 4.581 1.00 0.00 H new ATOM 0 HA2 GLY A 77 9.847 -9.666 6.893 1.00 0.00 H new ATOM 0 HA3 GLY A 77 11.265 -10.689 7.002 1.00 0.00 H new ATOM 1099 N GLN A 78 12.300 -8.109 5.626 1.00 0.00 N ATOM 1100 CA GLN A 78 13.160 -6.935 5.717 1.00 0.00 C ATOM 1101 C GLN A 78 12.333 -5.668 5.913 1.00 0.00 C ATOM 1102 O GLN A 78 11.113 -5.729 6.067 1.00 0.00 O ATOM 1103 CB GLN A 78 14.019 -6.807 4.458 1.00 0.00 C ATOM 1104 CG GLN A 78 14.785 -8.075 4.113 1.00 0.00 C ATOM 1105 CD GLN A 78 16.126 -8.156 4.814 1.00 0.00 C ATOM 1106 OE1 GLN A 78 16.307 -7.601 5.899 1.00 0.00 O ATOM 1107 NE2 GLN A 78 17.076 -8.849 4.198 1.00 0.00 N ATOM 0 H GLN A 78 12.206 -8.491 4.685 1.00 0.00 H new ATOM 0 HA GLN A 78 13.811 -7.060 6.582 1.00 0.00 H new ATOM 0 HB2 GLN A 78 13.379 -6.539 3.617 1.00 0.00 H new ATOM 0 HB3 GLN A 78 14.727 -5.990 4.593 1.00 0.00 H new ATOM 0 HG2 GLN A 78 14.184 -8.943 4.385 1.00 0.00 H new ATOM 0 HG3 GLN A 78 14.940 -8.119 3.035 1.00 0.00 H new ATOM 0 HE21 GLN A 78 16.883 -9.293 3.300 1.00 0.00 H new ATOM 0 HE22 GLN A 78 17.999 -8.938 4.623 1.00 0.00 H new ATOM 1116 N ASP A 79 13.005 -4.522 5.906 1.00 0.00 N ATOM 1117 CA ASP A 79 12.333 -3.240 6.082 1.00 0.00 C ATOM 1118 C ASP A 79 12.891 -2.197 5.119 1.00 0.00 C ATOM 1119 O ASP A 79 14.018 -1.727 5.282 1.00 0.00 O ATOM 1120 CB ASP A 79 12.485 -2.755 7.524 1.00 0.00 C ATOM 1121 CG ASP A 79 12.107 -3.819 8.536 1.00 0.00 C ATOM 1122 OD1 ASP A 79 10.955 -4.297 8.492 1.00 0.00 O ATOM 1123 OD2 ASP A 79 12.964 -4.173 9.373 1.00 0.00 O ATOM 0 H ASP A 79 14.015 -4.455 5.780 1.00 0.00 H new ATOM 0 HA ASP A 79 11.274 -3.379 5.864 1.00 0.00 H new ATOM 0 HB2 ASP A 79 13.517 -2.447 7.694 1.00 0.00 H new ATOM 0 HB3 ASP A 79 11.860 -1.875 7.676 1.00 0.00 H new ATOM 1128 N LEU A 80 12.097 -1.839 4.117 1.00 0.00 N ATOM 1129 CA LEU A 80 12.512 -0.852 3.126 1.00 0.00 C ATOM 1130 C LEU A 80 12.138 0.558 3.573 1.00 0.00 C ATOM 1131 O LEU A 80 11.000 0.995 3.399 1.00 0.00 O ATOM 1132 CB LEU A 80 11.869 -1.157 1.772 1.00 0.00 C ATOM 1133 CG LEU A 80 12.032 -2.589 1.260 1.00 0.00 C ATOM 1134 CD1 LEU A 80 10.995 -2.894 0.190 1.00 0.00 C ATOM 1135 CD2 LEU A 80 13.438 -2.805 0.719 1.00 0.00 C ATOM 0 H LEU A 80 11.161 -2.217 3.969 1.00 0.00 H new ATOM 0 HA LEU A 80 13.596 -0.907 3.027 1.00 0.00 H new ATOM 0 HB2 LEU A 80 10.804 -0.935 1.840 1.00 0.00 H new ATOM 0 HB3 LEU A 80 12.289 -0.477 1.031 1.00 0.00 H new ATOM 0 HG LEU A 80 11.876 -3.273 2.094 1.00 0.00 H new ATOM 0 HD11 LEU A 80 11.126 -3.917 -0.163 1.00 0.00 H new ATOM 0 HD12 LEU A 80 9.995 -2.780 0.609 1.00 0.00 H new ATOM 0 HD13 LEU A 80 11.119 -2.204 -0.644 1.00 0.00 H new ATOM 0 HD21 LEU A 80 13.536 -3.829 0.359 1.00 0.00 H new ATOM 0 HD22 LEU A 80 13.622 -2.113 -0.102 1.00 0.00 H new ATOM 0 HD23 LEU A 80 14.164 -2.628 1.512 1.00 0.00 H new ATOM 1147 N LYS A 81 13.103 1.267 4.148 1.00 0.00 N ATOM 1148 CA LYS A 81 12.878 2.629 4.617 1.00 0.00 C ATOM 1149 C LYS A 81 14.181 3.422 4.631 1.00 0.00 C ATOM 1150 O LYS A 81 15.240 2.888 4.957 1.00 0.00 O ATOM 1151 CB LYS A 81 12.263 2.612 6.018 1.00 0.00 C ATOM 1152 CG LYS A 81 13.046 1.776 7.016 1.00 0.00 C ATOM 1153 CD LYS A 81 12.367 1.749 8.375 1.00 0.00 C ATOM 1154 CE LYS A 81 12.912 0.630 9.249 1.00 0.00 C ATOM 1155 NZ LYS A 81 14.178 1.024 9.928 1.00 0.00 N ATOM 0 H LYS A 81 14.050 0.920 4.301 1.00 0.00 H new ATOM 0 HA LYS A 81 12.186 3.114 3.929 1.00 0.00 H new ATOM 0 HB2 LYS A 81 12.195 3.635 6.388 1.00 0.00 H new ATOM 0 HB3 LYS A 81 11.245 2.228 5.954 1.00 0.00 H new ATOM 0 HG2 LYS A 81 13.148 0.758 6.639 1.00 0.00 H new ATOM 0 HG3 LYS A 81 14.053 2.180 7.119 1.00 0.00 H new ATOM 0 HD2 LYS A 81 12.513 2.706 8.875 1.00 0.00 H new ATOM 0 HD3 LYS A 81 11.293 1.619 8.244 1.00 0.00 H new ATOM 0 HE2 LYS A 81 12.168 0.358 9.997 1.00 0.00 H new ATOM 0 HE3 LYS A 81 13.088 -0.255 8.638 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 14.518 0.235 10.514 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 14.896 1.259 9.214 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 14.005 1.854 10.531 1.00 0.00 H new ATOM 1169 N ASN A 82 14.094 4.700 4.277 1.00 0.00 N ATOM 1170 CA ASN A 82 15.266 5.567 4.250 1.00 0.00 C ATOM 1171 C ASN A 82 16.443 4.870 3.575 1.00 0.00 C ATOM 1172 O ASN A 82 17.532 4.773 4.144 1.00 0.00 O ATOM 1173 CB ASN A 82 15.652 5.982 5.671 1.00 0.00 C ATOM 1174 CG ASN A 82 15.347 4.903 6.692 1.00 0.00 C ATOM 1175 OD1 ASN A 82 14.225 4.804 7.191 1.00 0.00 O ATOM 1176 ND2 ASN A 82 16.346 4.087 7.008 1.00 0.00 N ATOM 0 H ASN A 82 13.224 5.158 4.005 1.00 0.00 H new ATOM 0 HA ASN A 82 15.015 6.458 3.674 1.00 0.00 H new ATOM 0 HB2 ASN A 82 16.716 6.217 5.702 1.00 0.00 H new ATOM 0 HB3 ASN A 82 15.117 6.893 5.938 1.00 0.00 H new ATOM 0 HD21 ASN A 82 16.200 3.342 7.689 1.00 0.00 H new ATOM 0 HD22 ASN A 82 17.259 4.206 6.570 1.00 0.00 H new ATOM 1183 N LEU A 83 16.218 4.385 2.359 1.00 0.00 N ATOM 1184 CA LEU A 83 17.260 3.697 1.604 1.00 0.00 C ATOM 1185 C LEU A 83 17.362 4.251 0.187 1.00 0.00 C ATOM 1186 O LEU A 83 16.511 5.026 -0.251 1.00 0.00 O ATOM 1187 CB LEU A 83 16.974 2.194 1.557 1.00 0.00 C ATOM 1188 CG LEU A 83 15.546 1.794 1.187 1.00 0.00 C ATOM 1189 CD1 LEU A 83 15.235 2.191 -0.248 1.00 0.00 C ATOM 1190 CD2 LEU A 83 15.344 0.298 1.384 1.00 0.00 C ATOM 0 H LEU A 83 15.323 4.455 1.874 1.00 0.00 H new ATOM 0 HA LEU A 83 18.211 3.865 2.109 1.00 0.00 H new ATOM 0 HB2 LEU A 83 17.655 1.737 0.839 1.00 0.00 H new ATOM 0 HB3 LEU A 83 17.208 1.769 2.533 1.00 0.00 H new ATOM 0 HG LEU A 83 14.858 2.324 1.846 1.00 0.00 H new ATOM 0 HD11 LEU A 83 14.214 1.898 -0.493 1.00 0.00 H new ATOM 0 HD12 LEU A 83 15.339 3.270 -0.358 1.00 0.00 H new ATOM 0 HD13 LEU A 83 15.929 1.689 -0.923 1.00 0.00 H new ATOM 0 HD21 LEU A 83 14.322 0.030 1.116 1.00 0.00 H new ATOM 0 HD22 LEU A 83 16.041 -0.250 0.750 1.00 0.00 H new ATOM 0 HD23 LEU A 83 15.524 0.041 2.428 1.00 0.00 H new ATOM 1202 N LEU A 84 18.407 3.847 -0.527 1.00 0.00 N ATOM 1203 CA LEU A 84 18.620 4.301 -1.896 1.00 0.00 C ATOM 1204 C LEU A 84 18.123 3.263 -2.898 1.00 0.00 C ATOM 1205 O LEU A 84 17.850 2.118 -2.537 1.00 0.00 O ATOM 1206 CB LEU A 84 20.104 4.587 -2.135 1.00 0.00 C ATOM 1207 CG LEU A 84 20.825 5.358 -1.028 1.00 0.00 C ATOM 1208 CD1 LEU A 84 22.294 4.967 -0.976 1.00 0.00 C ATOM 1209 CD2 LEU A 84 20.677 6.858 -1.240 1.00 0.00 C ATOM 0 H LEU A 84 19.120 3.206 -0.180 1.00 0.00 H new ATOM 0 HA LEU A 84 18.051 5.220 -2.040 1.00 0.00 H new ATOM 0 HB2 LEU A 84 20.618 3.637 -2.283 1.00 0.00 H new ATOM 0 HB3 LEU A 84 20.200 5.149 -3.064 1.00 0.00 H new ATOM 0 HG LEU A 84 20.367 5.100 -0.073 1.00 0.00 H new ATOM 0 HD11 LEU A 84 22.791 5.525 -0.183 1.00 0.00 H new ATOM 0 HD12 LEU A 84 22.379 3.899 -0.776 1.00 0.00 H new ATOM 0 HD13 LEU A 84 22.766 5.196 -1.932 1.00 0.00 H new ATOM 0 HD21 LEU A 84 21.196 7.391 -0.443 1.00 0.00 H new ATOM 0 HD22 LEU A 84 21.109 7.134 -2.202 1.00 0.00 H new ATOM 0 HD23 LEU A 84 19.620 7.125 -1.227 1.00 0.00 H new ATOM 1221 N HIS A 85 18.011 3.671 -4.158 1.00 0.00 N ATOM 1222 CA HIS A 85 17.550 2.775 -5.213 1.00 0.00 C ATOM 1223 C HIS A 85 18.387 1.499 -5.247 1.00 0.00 C ATOM 1224 O HIS A 85 17.869 0.413 -5.504 1.00 0.00 O ATOM 1225 CB HIS A 85 17.613 3.476 -6.570 1.00 0.00 C ATOM 1226 CG HIS A 85 17.194 2.605 -7.714 1.00 0.00 C ATOM 1227 ND1 HIS A 85 15.892 2.194 -7.909 1.00 0.00 N ATOM 1228 CD2 HIS A 85 17.912 2.068 -8.728 1.00 0.00 C ATOM 1229 CE1 HIS A 85 15.829 1.440 -8.993 1.00 0.00 C ATOM 1230 NE2 HIS A 85 17.041 1.349 -9.508 1.00 0.00 N ATOM 0 H HIS A 85 18.233 4.615 -4.473 1.00 0.00 H new ATOM 0 HA HIS A 85 16.516 2.505 -5.000 1.00 0.00 H new ATOM 0 HB2 HIS A 85 16.975 4.359 -6.544 1.00 0.00 H new ATOM 0 HB3 HIS A 85 18.631 3.824 -6.743 1.00 0.00 H new ATOM 0 HD2 HIS A 85 18.973 2.184 -8.893 1.00 0.00 H new ATOM 0 HE1 HIS A 85 14.938 0.977 -9.390 1.00 0.00 H new ATOM 0 HE2 HIS A 85 17.290 0.829 -10.349 1.00 0.00 H new ATOM 1238 N GLN A 86 19.682 1.640 -4.986 1.00 0.00 N ATOM 1239 CA GLN A 86 20.590 0.499 -4.988 1.00 0.00 C ATOM 1240 C GLN A 86 20.361 -0.382 -3.764 1.00 0.00 C ATOM 1241 O GLN A 86 20.485 -1.604 -3.835 1.00 0.00 O ATOM 1242 CB GLN A 86 22.043 0.976 -5.023 1.00 0.00 C ATOM 1243 CG GLN A 86 23.057 -0.152 -4.919 1.00 0.00 C ATOM 1244 CD GLN A 86 23.273 -0.865 -6.239 1.00 0.00 C ATOM 1245 OE1 GLN A 86 24.000 -0.382 -7.107 1.00 0.00 O ATOM 1246 NE2 GLN A 86 22.641 -2.022 -6.397 1.00 0.00 N ATOM 0 H GLN A 86 20.126 2.533 -4.771 1.00 0.00 H new ATOM 0 HA GLN A 86 20.387 -0.092 -5.881 1.00 0.00 H new ATOM 0 HB2 GLN A 86 22.215 1.523 -5.950 1.00 0.00 H new ATOM 0 HB3 GLN A 86 22.206 1.677 -4.204 1.00 0.00 H new ATOM 0 HG2 GLN A 86 24.007 0.250 -4.568 1.00 0.00 H new ATOM 0 HG3 GLN A 86 22.720 -0.871 -4.173 1.00 0.00 H new ATOM 0 HE21 GLN A 86 22.048 -2.385 -5.651 1.00 0.00 H new ATOM 0 HE22 GLN A 86 22.749 -2.548 -7.265 1.00 0.00 H new ATOM 1255 N ASP A 87 20.026 0.248 -2.643 1.00 0.00 N ATOM 1256 CA ASP A 87 19.779 -0.479 -1.403 1.00 0.00 C ATOM 1257 C ASP A 87 18.656 -1.496 -1.584 1.00 0.00 C ATOM 1258 O ASP A 87 18.771 -2.644 -1.155 1.00 0.00 O ATOM 1259 CB ASP A 87 19.424 0.495 -0.278 1.00 0.00 C ATOM 1260 CG ASP A 87 20.651 1.013 0.447 1.00 0.00 C ATOM 1261 OD1 ASP A 87 21.630 1.384 -0.233 1.00 0.00 O ATOM 1262 OD2 ASP A 87 20.631 1.047 1.695 1.00 0.00 O ATOM 0 H ASP A 87 19.919 1.260 -2.568 1.00 0.00 H new ATOM 0 HA ASP A 87 20.691 -1.014 -1.137 1.00 0.00 H new ATOM 0 HB2 ASP A 87 18.868 1.336 -0.692 1.00 0.00 H new ATOM 0 HB3 ASP A 87 18.767 -0.002 0.435 1.00 0.00 H new ATOM 1267 N ALA A 88 17.572 -1.066 -2.221 1.00 0.00 N ATOM 1268 CA ALA A 88 16.429 -1.939 -2.459 1.00 0.00 C ATOM 1269 C ALA A 88 16.765 -3.013 -3.489 1.00 0.00 C ATOM 1270 O ALA A 88 16.536 -4.201 -3.258 1.00 0.00 O ATOM 1271 CB ALA A 88 15.229 -1.124 -2.916 1.00 0.00 C ATOM 0 H ALA A 88 17.461 -0.118 -2.582 1.00 0.00 H new ATOM 0 HA ALA A 88 16.181 -2.436 -1.521 1.00 0.00 H new ATOM 0 HB1 ALA A 88 14.383 -1.789 -3.090 1.00 0.00 H new ATOM 0 HB2 ALA A 88 14.968 -0.398 -2.146 1.00 0.00 H new ATOM 0 HB3 ALA A 88 15.475 -0.601 -3.840 1.00 0.00 H new ATOM 1277 N VAL A 89 17.308 -2.589 -4.625 1.00 0.00 N ATOM 1278 CA VAL A 89 17.675 -3.515 -5.690 1.00 0.00 C ATOM 1279 C VAL A 89 18.544 -4.648 -5.157 1.00 0.00 C ATOM 1280 O VAL A 89 18.341 -5.813 -5.498 1.00 0.00 O ATOM 1281 CB VAL A 89 18.428 -2.795 -6.825 1.00 0.00 C ATOM 1282 CG1 VAL A 89 18.857 -3.787 -7.894 1.00 0.00 C ATOM 1283 CG2 VAL A 89 17.565 -1.694 -7.422 1.00 0.00 C ATOM 0 H VAL A 89 17.504 -1.610 -4.832 1.00 0.00 H new ATOM 0 HA VAL A 89 16.747 -3.928 -6.085 1.00 0.00 H new ATOM 0 HB VAL A 89 19.325 -2.336 -6.409 1.00 0.00 H new ATOM 0 HG11 VAL A 89 19.387 -3.260 -8.687 1.00 0.00 H new ATOM 0 HG12 VAL A 89 19.515 -4.536 -7.453 1.00 0.00 H new ATOM 0 HG13 VAL A 89 17.977 -4.277 -8.310 1.00 0.00 H new ATOM 0 HG21 VAL A 89 18.113 -1.196 -8.222 1.00 0.00 H new ATOM 0 HG22 VAL A 89 16.649 -2.127 -7.824 1.00 0.00 H new ATOM 0 HG23 VAL A 89 17.314 -0.969 -6.648 1.00 0.00 H new ATOM 1293 N ASP A 90 19.513 -4.299 -4.318 1.00 0.00 N ATOM 1294 CA ASP A 90 20.414 -5.287 -3.736 1.00 0.00 C ATOM 1295 C ASP A 90 19.647 -6.265 -2.851 1.00 0.00 C ATOM 1296 O ASP A 90 19.700 -7.478 -3.058 1.00 0.00 O ATOM 1297 CB ASP A 90 21.509 -4.595 -2.923 1.00 0.00 C ATOM 1298 CG ASP A 90 22.808 -5.375 -2.919 1.00 0.00 C ATOM 1299 OD1 ASP A 90 23.567 -5.269 -3.906 1.00 0.00 O ATOM 1300 OD2 ASP A 90 23.067 -6.091 -1.930 1.00 0.00 O ATOM 0 H ASP A 90 19.695 -3.339 -4.026 1.00 0.00 H new ATOM 0 HA ASP A 90 20.876 -5.846 -4.550 1.00 0.00 H new ATOM 0 HB2 ASP A 90 21.687 -3.600 -3.332 1.00 0.00 H new ATOM 0 HB3 ASP A 90 21.166 -4.461 -1.897 1.00 0.00 H new ATOM 1305 N LEU A 91 18.937 -5.730 -1.864 1.00 0.00 N ATOM 1306 CA LEU A 91 18.160 -6.556 -0.945 1.00 0.00 C ATOM 1307 C LEU A 91 17.350 -7.601 -1.706 1.00 0.00 C ATOM 1308 O LEU A 91 17.269 -8.759 -1.295 1.00 0.00 O ATOM 1309 CB LEU A 91 17.227 -5.681 -0.107 1.00 0.00 C ATOM 1310 CG LEU A 91 16.519 -6.378 1.056 1.00 0.00 C ATOM 1311 CD1 LEU A 91 17.395 -6.364 2.299 1.00 0.00 C ATOM 1312 CD2 LEU A 91 15.179 -5.714 1.338 1.00 0.00 C ATOM 0 H LEU A 91 18.883 -4.728 -1.679 1.00 0.00 H new ATOM 0 HA LEU A 91 18.855 -7.073 -0.283 1.00 0.00 H new ATOM 0 HB2 LEU A 91 17.805 -4.847 0.292 1.00 0.00 H new ATOM 0 HB3 LEU A 91 16.469 -5.257 -0.766 1.00 0.00 H new ATOM 0 HG LEU A 91 16.337 -7.416 0.777 1.00 0.00 H new ATOM 0 HD11 LEU A 91 16.875 -6.864 3.116 1.00 0.00 H new ATOM 0 HD12 LEU A 91 18.330 -6.884 2.091 1.00 0.00 H new ATOM 0 HD13 LEU A 91 17.609 -5.333 2.582 1.00 0.00 H new ATOM 0 HD21 LEU A 91 14.689 -6.222 2.168 1.00 0.00 H new ATOM 0 HD22 LEU A 91 15.339 -4.667 1.597 1.00 0.00 H new ATOM 0 HD23 LEU A 91 14.548 -5.776 0.451 1.00 0.00 H new ATOM 1324 N PHE A 92 16.753 -7.185 -2.818 1.00 0.00 N ATOM 1325 CA PHE A 92 15.949 -8.085 -3.637 1.00 0.00 C ATOM 1326 C PHE A 92 16.742 -9.334 -4.010 1.00 0.00 C ATOM 1327 O PHE A 92 16.182 -10.423 -4.140 1.00 0.00 O ATOM 1328 CB PHE A 92 15.476 -7.370 -4.904 1.00 0.00 C ATOM 1329 CG PHE A 92 14.302 -6.460 -4.675 1.00 0.00 C ATOM 1330 CD1 PHE A 92 14.226 -5.680 -3.533 1.00 0.00 C ATOM 1331 CD2 PHE A 92 13.276 -6.386 -5.603 1.00 0.00 C ATOM 1332 CE1 PHE A 92 13.148 -4.842 -3.320 1.00 0.00 C ATOM 1333 CE2 PHE A 92 12.196 -5.549 -5.396 1.00 0.00 C ATOM 1334 CZ PHE A 92 12.131 -4.777 -4.252 1.00 0.00 C ATOM 0 H PHE A 92 16.811 -6.230 -3.173 1.00 0.00 H new ATOM 0 HA PHE A 92 15.080 -8.388 -3.054 1.00 0.00 H new ATOM 0 HB2 PHE A 92 16.302 -6.789 -5.314 1.00 0.00 H new ATOM 0 HB3 PHE A 92 15.208 -8.115 -5.653 1.00 0.00 H new ATOM 0 HD1 PHE A 92 15.018 -5.727 -2.801 1.00 0.00 H new ATOM 0 HD2 PHE A 92 13.321 -6.989 -6.498 1.00 0.00 H new ATOM 0 HE1 PHE A 92 13.101 -4.239 -2.426 1.00 0.00 H new ATOM 0 HE2 PHE A 92 11.403 -5.498 -6.128 1.00 0.00 H new ATOM 0 HZ PHE A 92 11.287 -4.124 -4.087 1.00 0.00 H new ATOM 1344 N ARG A 93 18.050 -9.168 -4.182 1.00 0.00 N ATOM 1345 CA ARG A 93 18.920 -10.281 -4.543 1.00 0.00 C ATOM 1346 C ARG A 93 19.214 -11.157 -3.328 1.00 0.00 C ATOM 1347 O ARG A 93 19.274 -12.381 -3.434 1.00 0.00 O ATOM 1348 CB ARG A 93 20.230 -9.759 -5.138 1.00 0.00 C ATOM 1349 CG ARG A 93 20.096 -9.274 -6.572 1.00 0.00 C ATOM 1350 CD ARG A 93 21.372 -8.601 -7.053 1.00 0.00 C ATOM 1351 NE ARG A 93 22.367 -9.572 -7.502 1.00 0.00 N ATOM 1352 CZ ARG A 93 23.644 -9.273 -7.710 1.00 0.00 C ATOM 1353 NH1 ARG A 93 24.080 -8.037 -7.512 1.00 0.00 N ATOM 1354 NH2 ARG A 93 24.489 -10.212 -8.118 1.00 0.00 N ATOM 0 H ARG A 93 18.530 -8.274 -4.077 1.00 0.00 H new ATOM 0 HA ARG A 93 18.405 -10.886 -5.289 1.00 0.00 H new ATOM 0 HB2 ARG A 93 20.600 -8.941 -4.520 1.00 0.00 H new ATOM 0 HB3 ARG A 93 20.978 -10.551 -5.099 1.00 0.00 H new ATOM 0 HG2 ARG A 93 19.860 -10.117 -7.222 1.00 0.00 H new ATOM 0 HG3 ARG A 93 19.264 -8.573 -6.644 1.00 0.00 H new ATOM 0 HD2 ARG A 93 21.136 -7.919 -7.870 1.00 0.00 H new ATOM 0 HD3 ARG A 93 21.791 -7.999 -6.246 1.00 0.00 H new ATOM 0 HE ARG A 93 22.064 -10.532 -7.665 1.00 0.00 H new ATOM 0 HH11 ARG A 93 23.434 -7.312 -7.199 1.00 0.00 H new ATOM 0 HH12 ARG A 93 25.061 -7.811 -7.673 1.00 0.00 H new ATOM 0 HH21 ARG A 93 24.158 -11.164 -8.272 1.00 0.00 H new ATOM 0 HH22 ARG A 93 25.470 -9.981 -8.277 1.00 0.00 H new ATOM 1368 N ASN A 94 19.398 -10.520 -2.176 1.00 0.00 N ATOM 1369 CA ASN A 94 19.687 -11.241 -0.942 1.00 0.00 C ATOM 1370 C ASN A 94 18.579 -12.241 -0.624 1.00 0.00 C ATOM 1371 O ASN A 94 18.843 -13.341 -0.140 1.00 0.00 O ATOM 1372 CB ASN A 94 19.852 -10.259 0.220 1.00 0.00 C ATOM 1373 CG ASN A 94 20.676 -10.838 1.353 1.00 0.00 C ATOM 1374 OD1 ASN A 94 21.639 -11.570 1.124 1.00 0.00 O ATOM 1375 ND2 ASN A 94 20.301 -10.512 2.585 1.00 0.00 N ATOM 0 H ASN A 94 19.352 -9.506 -2.072 1.00 0.00 H new ATOM 0 HA ASN A 94 20.619 -11.790 -1.081 1.00 0.00 H new ATOM 0 HB2 ASN A 94 20.328 -9.348 -0.143 1.00 0.00 H new ATOM 0 HB3 ASN A 94 18.869 -9.977 0.597 1.00 0.00 H new ATOM 0 HD21 ASN A 94 20.818 -10.872 3.387 1.00 0.00 H new ATOM 0 HD22 ASN A 94 19.496 -9.902 2.729 1.00 0.00 H new ATOM 1382 N ALA A 95 17.339 -11.850 -0.900 1.00 0.00 N ATOM 1383 CA ALA A 95 16.192 -12.713 -0.647 1.00 0.00 C ATOM 1384 C ALA A 95 16.487 -14.152 -1.055 1.00 0.00 C ATOM 1385 O ALA A 95 16.562 -15.044 -0.210 1.00 0.00 O ATOM 1386 CB ALA A 95 14.967 -12.193 -1.385 1.00 0.00 C ATOM 0 H ALA A 95 17.103 -10.941 -1.299 1.00 0.00 H new ATOM 0 HA ALA A 95 15.989 -12.701 0.424 1.00 0.00 H new ATOM 0 HB1 ALA A 95 14.118 -12.847 -1.187 1.00 0.00 H new ATOM 0 HB2 ALA A 95 14.736 -11.185 -1.041 1.00 0.00 H new ATOM 0 HB3 ALA A 95 15.168 -12.174 -2.456 1.00 0.00 H new ATOM 1392 N GLY A 96 16.652 -14.372 -2.355 1.00 0.00 N ATOM 1393 CA GLY A 96 16.935 -15.706 -2.852 1.00 0.00 C ATOM 1394 C GLY A 96 15.743 -16.331 -3.549 1.00 0.00 C ATOM 1395 O GLY A 96 14.804 -15.633 -3.934 1.00 0.00 O ATOM 0 H GLY A 96 16.595 -13.650 -3.074 1.00 0.00 H new ATOM 0 HA2 GLY A 96 17.775 -15.661 -3.545 1.00 0.00 H new ATOM 0 HA3 GLY A 96 17.241 -16.342 -2.022 1.00 0.00 H new ATOM 1399 N TYR A 97 15.779 -17.649 -3.712 1.00 0.00 N ATOM 1400 CA TYR A 97 14.695 -18.367 -4.371 1.00 0.00 C ATOM 1401 C TYR A 97 13.341 -17.769 -4.001 1.00 0.00 C ATOM 1402 O TYR A 97 12.696 -17.113 -4.819 1.00 0.00 O ATOM 1403 CB TYR A 97 14.731 -19.848 -3.990 1.00 0.00 C ATOM 1404 CG TYR A 97 13.664 -20.675 -4.671 1.00 0.00 C ATOM 1405 CD1 TYR A 97 13.876 -21.216 -5.933 1.00 0.00 C ATOM 1406 CD2 TYR A 97 12.443 -20.914 -4.053 1.00 0.00 C ATOM 1407 CE1 TYR A 97 12.904 -21.971 -6.559 1.00 0.00 C ATOM 1408 CE2 TYR A 97 11.465 -21.670 -4.671 1.00 0.00 C ATOM 1409 CZ TYR A 97 11.700 -22.196 -5.924 1.00 0.00 C ATOM 1410 OH TYR A 97 10.729 -22.948 -6.543 1.00 0.00 O ATOM 0 H TYR A 97 16.547 -18.241 -3.397 1.00 0.00 H new ATOM 0 HA TYR A 97 14.832 -18.271 -5.448 1.00 0.00 H new ATOM 0 HB2 TYR A 97 15.710 -20.255 -4.242 1.00 0.00 H new ATOM 0 HB3 TYR A 97 14.616 -19.940 -2.910 1.00 0.00 H new ATOM 0 HD1 TYR A 97 14.817 -21.043 -6.433 1.00 0.00 H new ATOM 0 HD2 TYR A 97 12.255 -20.502 -3.073 1.00 0.00 H new ATOM 0 HE1 TYR A 97 13.085 -22.383 -7.541 1.00 0.00 H new ATOM 0 HE2 TYR A 97 10.522 -21.848 -4.175 1.00 0.00 H new ATOM 0 HH TYR A 97 9.943 -23.011 -5.961 1.00 0.00 H new ATOM 1420 N ALA A 98 12.918 -17.999 -2.763 1.00 0.00 N ATOM 1421 CA ALA A 98 11.642 -17.482 -2.282 1.00 0.00 C ATOM 1422 C ALA A 98 11.728 -15.985 -2.001 1.00 0.00 C ATOM 1423 O ALA A 98 12.403 -15.557 -1.065 1.00 0.00 O ATOM 1424 CB ALA A 98 11.206 -18.231 -1.033 1.00 0.00 C ATOM 0 H ALA A 98 13.440 -18.540 -2.074 1.00 0.00 H new ATOM 0 HA ALA A 98 10.897 -17.637 -3.063 1.00 0.00 H new ATOM 0 HB1 ALA A 98 10.252 -17.834 -0.685 1.00 0.00 H new ATOM 0 HB2 ALA A 98 11.096 -19.291 -1.264 1.00 0.00 H new ATOM 0 HB3 ALA A 98 11.957 -18.106 -0.253 1.00 0.00 H new ATOM 1430 N VAL A 99 11.042 -15.194 -2.819 1.00 0.00 N ATOM 1431 CA VAL A 99 11.040 -13.745 -2.658 1.00 0.00 C ATOM 1432 C VAL A 99 9.672 -13.242 -2.213 1.00 0.00 C ATOM 1433 O VAL A 99 8.721 -13.223 -2.995 1.00 0.00 O ATOM 1434 CB VAL A 99 11.435 -13.034 -3.967 1.00 0.00 C ATOM 1435 CG1 VAL A 99 11.435 -11.525 -3.776 1.00 0.00 C ATOM 1436 CG2 VAL A 99 12.795 -13.519 -4.447 1.00 0.00 C ATOM 0 H VAL A 99 10.480 -15.532 -3.600 1.00 0.00 H new ATOM 0 HA VAL A 99 11.777 -13.512 -1.889 1.00 0.00 H new ATOM 0 HB VAL A 99 10.697 -13.279 -4.731 1.00 0.00 H new ATOM 0 HG11 VAL A 99 11.716 -11.040 -4.711 1.00 0.00 H new ATOM 0 HG12 VAL A 99 10.439 -11.196 -3.482 1.00 0.00 H new ATOM 0 HG13 VAL A 99 12.150 -11.257 -2.998 1.00 0.00 H new ATOM 0 HG21 VAL A 99 13.058 -13.007 -5.372 1.00 0.00 H new ATOM 0 HG22 VAL A 99 13.547 -13.305 -3.687 1.00 0.00 H new ATOM 0 HG23 VAL A 99 12.756 -14.594 -4.626 1.00 0.00 H new ATOM 1446 N SER A 100 9.578 -12.836 -0.951 1.00 0.00 N ATOM 1447 CA SER A 100 8.324 -12.336 -0.400 1.00 0.00 C ATOM 1448 C SER A 100 8.300 -10.810 -0.401 1.00 0.00 C ATOM 1449 O SER A 100 9.209 -10.163 0.121 1.00 0.00 O ATOM 1450 CB SER A 100 8.124 -12.860 1.024 1.00 0.00 C ATOM 1451 OG SER A 100 6.781 -12.692 1.444 1.00 0.00 O ATOM 0 H SER A 100 10.355 -12.844 -0.291 1.00 0.00 H new ATOM 0 HA SER A 100 7.510 -12.695 -1.030 1.00 0.00 H new ATOM 0 HB2 SER A 100 8.393 -13.915 1.068 1.00 0.00 H new ATOM 0 HB3 SER A 100 8.791 -12.333 1.706 1.00 0.00 H new ATOM 0 HG SER A 100 6.678 -13.036 2.356 1.00 0.00 H new ATOM 1457 N LEU A 101 7.254 -10.242 -0.990 1.00 0.00 N ATOM 1458 CA LEU A 101 7.110 -8.792 -1.059 1.00 0.00 C ATOM 1459 C LEU A 101 5.755 -8.353 -0.513 1.00 0.00 C ATOM 1460 O LEU A 101 4.713 -8.653 -1.095 1.00 0.00 O ATOM 1461 CB LEU A 101 7.270 -8.313 -2.503 1.00 0.00 C ATOM 1462 CG LEU A 101 8.423 -8.934 -3.293 1.00 0.00 C ATOM 1463 CD1 LEU A 101 8.242 -8.688 -4.783 1.00 0.00 C ATOM 1464 CD2 LEU A 101 9.756 -8.376 -2.817 1.00 0.00 C ATOM 0 H LEU A 101 6.493 -10.763 -1.427 1.00 0.00 H new ATOM 0 HA LEU A 101 7.891 -8.344 -0.445 1.00 0.00 H new ATOM 0 HB2 LEU A 101 6.341 -8.514 -3.036 1.00 0.00 H new ATOM 0 HB3 LEU A 101 7.404 -7.231 -2.493 1.00 0.00 H new ATOM 0 HG LEU A 101 8.419 -10.010 -3.120 1.00 0.00 H new ATOM 0 HD11 LEU A 101 9.072 -9.137 -5.329 1.00 0.00 H new ATOM 0 HD12 LEU A 101 7.305 -9.135 -5.114 1.00 0.00 H new ATOM 0 HD13 LEU A 101 8.220 -7.615 -4.975 1.00 0.00 H new ATOM 0 HD21 LEU A 101 10.565 -8.829 -3.390 1.00 0.00 H new ATOM 0 HD22 LEU A 101 9.770 -7.296 -2.960 1.00 0.00 H new ATOM 0 HD23 LEU A 101 9.889 -8.603 -1.759 1.00 0.00 H new ATOM 1476 N ARG A 102 5.778 -7.638 0.608 1.00 0.00 N ATOM 1477 CA ARG A 102 4.552 -7.157 1.232 1.00 0.00 C ATOM 1478 C ARG A 102 4.178 -5.776 0.701 1.00 0.00 C ATOM 1479 O ARG A 102 4.726 -4.763 1.134 1.00 0.00 O ATOM 1480 CB ARG A 102 4.716 -7.102 2.752 1.00 0.00 C ATOM 1481 CG ARG A 102 3.398 -7.139 3.508 1.00 0.00 C ATOM 1482 CD ARG A 102 3.541 -6.552 4.904 1.00 0.00 C ATOM 1483 NE ARG A 102 3.931 -7.562 5.885 1.00 0.00 N ATOM 1484 CZ ARG A 102 3.184 -8.617 6.190 1.00 0.00 C ATOM 1485 NH1 ARG A 102 2.014 -8.800 5.594 1.00 0.00 N ATOM 1486 NH2 ARG A 102 3.607 -9.492 7.093 1.00 0.00 N ATOM 0 H ARG A 102 6.632 -7.380 1.102 1.00 0.00 H new ATOM 0 HA ARG A 102 3.751 -7.853 0.984 1.00 0.00 H new ATOM 0 HB2 ARG A 102 5.333 -7.941 3.073 1.00 0.00 H new ATOM 0 HB3 ARG A 102 5.253 -6.191 3.018 1.00 0.00 H new ATOM 0 HG2 ARG A 102 2.643 -6.582 2.953 1.00 0.00 H new ATOM 0 HG3 ARG A 102 3.046 -8.168 3.579 1.00 0.00 H new ATOM 0 HD2 ARG A 102 4.285 -5.756 4.888 1.00 0.00 H new ATOM 0 HD3 ARG A 102 2.596 -6.099 5.206 1.00 0.00 H new ATOM 0 HE ARG A 102 4.826 -7.451 6.362 1.00 0.00 H new ATOM 0 HH11 ARG A 102 1.685 -8.130 4.899 1.00 0.00 H new ATOM 0 HH12 ARG A 102 1.443 -9.611 5.830 1.00 0.00 H new ATOM 0 HH21 ARG A 102 4.507 -9.355 7.554 1.00 0.00 H new ATOM 0 HH22 ARG A 102 3.033 -10.302 7.327 1.00 0.00 H new ATOM 1500 N VAL A 103 3.240 -5.745 -0.241 1.00 0.00 N ATOM 1501 CA VAL A 103 2.791 -4.489 -0.831 1.00 0.00 C ATOM 1502 C VAL A 103 1.454 -4.052 -0.242 1.00 0.00 C ATOM 1503 O VAL A 103 0.708 -4.867 0.300 1.00 0.00 O ATOM 1504 CB VAL A 103 2.652 -4.606 -2.360 1.00 0.00 C ATOM 1505 CG1 VAL A 103 4.007 -4.862 -3.002 1.00 0.00 C ATOM 1506 CG2 VAL A 103 1.665 -5.706 -2.723 1.00 0.00 C ATOM 0 H VAL A 103 2.777 -6.575 -0.612 1.00 0.00 H new ATOM 0 HA VAL A 103 3.549 -3.741 -0.598 1.00 0.00 H new ATOM 0 HB VAL A 103 2.267 -3.662 -2.745 1.00 0.00 H new ATOM 0 HG11 VAL A 103 3.888 -4.942 -4.083 1.00 0.00 H new ATOM 0 HG12 VAL A 103 4.681 -4.037 -2.771 1.00 0.00 H new ATOM 0 HG13 VAL A 103 4.424 -5.791 -2.613 1.00 0.00 H new ATOM 0 HG21 VAL A 103 1.579 -5.775 -3.807 1.00 0.00 H new ATOM 0 HG22 VAL A 103 2.019 -6.658 -2.326 1.00 0.00 H new ATOM 0 HG23 VAL A 103 0.689 -5.475 -2.296 1.00 0.00 H new ATOM 1516 N GLN A 104 1.159 -2.761 -0.354 1.00 0.00 N ATOM 1517 CA GLN A 104 -0.089 -2.216 0.168 1.00 0.00 C ATOM 1518 C GLN A 104 -0.976 -1.708 -0.964 1.00 0.00 C ATOM 1519 O GLN A 104 -0.554 -0.885 -1.777 1.00 0.00 O ATOM 1520 CB GLN A 104 0.199 -1.082 1.154 1.00 0.00 C ATOM 1521 CG GLN A 104 -1.038 -0.581 1.882 1.00 0.00 C ATOM 1522 CD GLN A 104 -0.731 0.551 2.843 1.00 0.00 C ATOM 1523 OE1 GLN A 104 -1.003 1.716 2.554 1.00 0.00 O ATOM 1524 NE2 GLN A 104 -0.162 0.212 3.994 1.00 0.00 N ATOM 0 H GLN A 104 1.766 -2.074 -0.801 1.00 0.00 H new ATOM 0 HA GLN A 104 -0.617 -3.015 0.688 1.00 0.00 H new ATOM 0 HB2 GLN A 104 0.928 -1.426 1.888 1.00 0.00 H new ATOM 0 HB3 GLN A 104 0.656 -0.251 0.616 1.00 0.00 H new ATOM 0 HG2 GLN A 104 -1.773 -0.243 1.151 1.00 0.00 H new ATOM 0 HG3 GLN A 104 -1.491 -1.406 2.431 1.00 0.00 H new ATOM 0 HE21 GLN A 104 0.046 -0.767 4.191 1.00 0.00 H new ATOM 0 HE22 GLN A 104 0.067 0.931 4.681 1.00 0.00 H new ATOM 1533 N HIS A 105 -2.209 -2.204 -1.011 1.00 0.00 N ATOM 1534 CA HIS A 105 -3.157 -1.800 -2.043 1.00 0.00 C ATOM 1535 C HIS A 105 -4.003 -0.621 -1.573 1.00 0.00 C ATOM 1536 O HIS A 105 -4.791 -0.745 -0.635 1.00 0.00 O ATOM 1537 CB HIS A 105 -4.061 -2.973 -2.422 1.00 0.00 C ATOM 1538 CG HIS A 105 -3.312 -4.234 -2.722 1.00 0.00 C ATOM 1539 ND1 HIS A 105 -2.475 -4.372 -3.809 1.00 0.00 N ATOM 1540 CD2 HIS A 105 -3.276 -5.419 -2.068 1.00 0.00 C ATOM 1541 CE1 HIS A 105 -1.958 -5.588 -3.812 1.00 0.00 C ATOM 1542 NE2 HIS A 105 -2.427 -6.243 -2.766 1.00 0.00 N ATOM 0 H HIS A 105 -2.574 -2.886 -0.346 1.00 0.00 H new ATOM 0 HA HIS A 105 -2.590 -1.490 -2.921 1.00 0.00 H new ATOM 0 HB2 HIS A 105 -4.760 -3.161 -1.607 1.00 0.00 H new ATOM 0 HB3 HIS A 105 -4.655 -2.697 -3.293 1.00 0.00 H new ATOM 0 HD1 HIS A 105 -2.285 -3.649 -4.502 1.00 0.00 H new ATOM 0 HD2 HIS A 105 -3.814 -5.670 -1.166 1.00 0.00 H new ATOM 0 HE1 HIS A 105 -1.269 -5.980 -4.546 1.00 0.00 H new ATOM 1550 N ARG A 106 -3.833 0.522 -2.229 1.00 0.00 N ATOM 1551 CA ARG A 106 -4.580 1.724 -1.876 1.00 0.00 C ATOM 1552 C ARG A 106 -5.807 1.884 -2.770 1.00 0.00 C ATOM 1553 O ARG A 106 -5.730 2.474 -3.848 1.00 0.00 O ATOM 1554 CB ARG A 106 -3.685 2.959 -1.994 1.00 0.00 C ATOM 1555 CG ARG A 106 -2.481 2.930 -1.067 1.00 0.00 C ATOM 1556 CD ARG A 106 -1.304 3.690 -1.658 1.00 0.00 C ATOM 1557 NE ARG A 106 -0.552 2.879 -2.612 1.00 0.00 N ATOM 1558 CZ ARG A 106 0.403 3.365 -3.397 1.00 0.00 C ATOM 1559 NH1 ARG A 106 0.720 4.652 -3.342 1.00 0.00 N ATOM 1560 NH2 ARG A 106 1.043 2.564 -4.239 1.00 0.00 N ATOM 0 H ARG A 106 -3.185 0.641 -3.008 1.00 0.00 H new ATOM 0 HA ARG A 106 -4.915 1.624 -0.844 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -3.338 3.049 -3.023 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -4.277 3.848 -1.779 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -2.751 3.366 -0.105 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -2.190 1.896 -0.879 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -1.666 4.590 -2.154 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -0.641 4.013 -0.855 1.00 0.00 H new ATOM 0 HE ARG A 106 -0.772 1.885 -2.679 1.00 0.00 H new ATOM 0 HH11 ARG A 106 0.230 5.271 -2.696 1.00 0.00 H new ATOM 0 HH12 ARG A 106 1.454 5.023 -3.946 1.00 0.00 H new ATOM 0 HH21 ARG A 106 0.802 1.574 -4.284 1.00 0.00 H new ATOM 0 HH22 ARG A 106 1.776 2.938 -4.841 1.00 0.00 H new ATOM 1574 N LEU A 107 -6.936 1.354 -2.315 1.00 0.00 N ATOM 1575 CA LEU A 107 -8.180 1.437 -3.074 1.00 0.00 C ATOM 1576 C LEU A 107 -8.986 2.666 -2.665 1.00 0.00 C ATOM 1577 O LEU A 107 -9.068 3.000 -1.483 1.00 0.00 O ATOM 1578 CB LEU A 107 -9.015 0.173 -2.863 1.00 0.00 C ATOM 1579 CG LEU A 107 -8.694 -1.004 -3.785 1.00 0.00 C ATOM 1580 CD1 LEU A 107 -7.515 -1.799 -3.246 1.00 0.00 C ATOM 1581 CD2 LEU A 107 -9.913 -1.901 -3.948 1.00 0.00 C ATOM 0 H LEU A 107 -7.017 0.862 -1.425 1.00 0.00 H new ATOM 0 HA LEU A 107 -7.927 1.526 -4.130 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -8.888 -0.154 -1.831 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -10.067 0.431 -2.989 1.00 0.00 H new ATOM 0 HG LEU A 107 -8.423 -0.610 -4.764 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -7.302 -2.632 -3.915 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -6.640 -1.153 -3.181 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -7.757 -2.183 -2.255 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -9.667 -2.733 -4.607 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -10.214 -2.286 -2.974 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -10.732 -1.326 -4.380 1.00 0.00 H new ATOM 1593 N GLN A 108 -9.580 3.332 -3.650 1.00 0.00 N ATOM 1594 CA GLN A 108 -10.380 4.523 -3.391 1.00 0.00 C ATOM 1595 C GLN A 108 -11.784 4.146 -2.928 1.00 0.00 C ATOM 1596 O GLN A 108 -12.152 2.971 -2.924 1.00 0.00 O ATOM 1597 CB GLN A 108 -10.462 5.391 -4.648 1.00 0.00 C ATOM 1598 CG GLN A 108 -11.078 4.679 -5.841 1.00 0.00 C ATOM 1599 CD GLN A 108 -10.766 5.365 -7.156 1.00 0.00 C ATOM 1600 OE1 GLN A 108 -11.282 6.445 -7.444 1.00 0.00 O ATOM 1601 NE2 GLN A 108 -9.916 4.740 -7.963 1.00 0.00 N ATOM 0 H GLN A 108 -9.522 3.067 -4.633 1.00 0.00 H new ATOM 0 HA GLN A 108 -9.895 5.090 -2.597 1.00 0.00 H new ATOM 0 HB2 GLN A 108 -11.048 6.283 -4.426 1.00 0.00 H new ATOM 0 HB3 GLN A 108 -9.459 5.726 -4.914 1.00 0.00 H new ATOM 0 HG2 GLN A 108 -10.712 3.653 -5.875 1.00 0.00 H new ATOM 0 HG3 GLN A 108 -12.159 4.628 -5.710 1.00 0.00 H new ATOM 0 HE21 GLN A 108 -9.512 3.846 -7.684 1.00 0.00 H new ATOM 0 HE22 GLN A 108 -9.668 5.154 -8.861 1.00 0.00 H new ATOM 1610 N VAL A 109 -12.563 5.150 -2.538 1.00 0.00 N ATOM 1611 CA VAL A 109 -13.926 4.923 -2.073 1.00 0.00 C ATOM 1612 C VAL A 109 -14.899 5.896 -2.730 1.00 0.00 C ATOM 1613 O VAL A 109 -14.682 7.107 -2.720 1.00 0.00 O ATOM 1614 CB VAL A 109 -14.029 5.067 -0.543 1.00 0.00 C ATOM 1615 CG1 VAL A 109 -15.470 4.903 -0.087 1.00 0.00 C ATOM 1616 CG2 VAL A 109 -13.124 4.058 0.148 1.00 0.00 C ATOM 0 H VAL A 109 -12.274 6.128 -2.535 1.00 0.00 H new ATOM 0 HA VAL A 109 -14.190 3.903 -2.353 1.00 0.00 H new ATOM 0 HB VAL A 109 -13.698 6.068 -0.266 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -15.523 5.008 0.997 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -16.089 5.667 -0.556 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -15.832 3.916 -0.374 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -13.209 4.173 1.229 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -13.423 3.048 -0.134 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -12.091 4.228 -0.155 1.00 0.00 H new ATOM 1626 N GLN A 110 -15.972 5.357 -3.301 1.00 0.00 N ATOM 1627 CA GLN A 110 -16.978 6.178 -3.963 1.00 0.00 C ATOM 1628 C GLN A 110 -18.361 5.545 -3.845 1.00 0.00 C ATOM 1629 O GLN A 110 -18.632 4.506 -4.446 1.00 0.00 O ATOM 1630 CB GLN A 110 -16.618 6.374 -5.436 1.00 0.00 C ATOM 1631 CG GLN A 110 -17.316 7.561 -6.080 1.00 0.00 C ATOM 1632 CD GLN A 110 -17.038 7.665 -7.567 1.00 0.00 C ATOM 1633 OE1 GLN A 110 -16.172 6.970 -8.099 1.00 0.00 O ATOM 1634 NE2 GLN A 110 -17.775 8.535 -8.248 1.00 0.00 N ATOM 0 H GLN A 110 -16.166 4.356 -3.318 1.00 0.00 H new ATOM 0 HA GLN A 110 -17.000 7.150 -3.469 1.00 0.00 H new ATOM 0 HB2 GLN A 110 -15.540 6.506 -5.523 1.00 0.00 H new ATOM 0 HB3 GLN A 110 -16.874 5.469 -5.988 1.00 0.00 H new ATOM 0 HG2 GLN A 110 -18.391 7.476 -5.920 1.00 0.00 H new ATOM 0 HG3 GLN A 110 -16.992 8.479 -5.589 1.00 0.00 H new ATOM 0 HE21 GLN A 110 -18.482 9.091 -7.767 1.00 0.00 H new ATOM 0 HE22 GLN A 110 -17.634 8.647 -9.252 1.00 0.00 H new ATOM 1643 N ASN A 111 -19.232 6.178 -3.065 1.00 0.00 N ATOM 1644 CA ASN A 111 -20.586 5.675 -2.867 1.00 0.00 C ATOM 1645 C ASN A 111 -21.594 6.498 -3.665 1.00 0.00 C ATOM 1646 O ASN A 111 -21.601 7.727 -3.596 1.00 0.00 O ATOM 1647 CB ASN A 111 -20.951 5.703 -1.382 1.00 0.00 C ATOM 1648 CG ASN A 111 -20.703 7.059 -0.751 1.00 0.00 C ATOM 1649 OD1 ASN A 111 -21.532 7.964 -0.850 1.00 0.00 O ATOM 1650 ND2 ASN A 111 -19.556 7.207 -0.097 1.00 0.00 N ATOM 0 H ASN A 111 -19.024 7.040 -2.560 1.00 0.00 H new ATOM 0 HA ASN A 111 -20.620 4.645 -3.223 1.00 0.00 H new ATOM 0 HB2 ASN A 111 -22.001 5.437 -1.264 1.00 0.00 H new ATOM 0 HB3 ASN A 111 -20.370 4.948 -0.853 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -19.334 8.098 0.348 1.00 0.00 H new ATOM 0 HD22 ASN A 111 -18.898 6.430 -0.040 1.00 0.00 H new ATOM 1657 N GLY A 112 -22.444 5.811 -4.422 1.00 0.00 N ATOM 1658 CA GLY A 112 -23.444 6.495 -5.221 1.00 0.00 C ATOM 1659 C GLY A 112 -23.398 6.086 -6.680 1.00 0.00 C ATOM 1660 O GLY A 112 -22.337 5.792 -7.232 1.00 0.00 O ATOM 0 H GLY A 112 -22.458 4.794 -4.496 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -24.434 6.283 -4.818 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -23.293 7.572 -5.144 1.00 0.00 H new ATOM 1664 N PRO A 113 -24.572 6.062 -7.329 1.00 0.00 N ATOM 1665 CA PRO A 113 -24.688 5.686 -8.742 1.00 0.00 C ATOM 1666 C PRO A 113 -24.083 6.733 -9.671 1.00 0.00 C ATOM 1667 O PRO A 113 -24.179 7.934 -9.415 1.00 0.00 O ATOM 1668 CB PRO A 113 -26.199 5.587 -8.959 1.00 0.00 C ATOM 1669 CG PRO A 113 -26.791 6.481 -7.925 1.00 0.00 C ATOM 1670 CD PRO A 113 -25.876 6.400 -6.735 1.00 0.00 C ATOM 0 HA PRO A 113 -24.151 4.764 -8.965 1.00 0.00 H new ATOM 0 HB2 PRO A 113 -26.476 5.906 -9.964 1.00 0.00 H new ATOM 0 HB3 PRO A 113 -26.549 4.561 -8.843 1.00 0.00 H new ATOM 0 HG2 PRO A 113 -26.866 7.505 -8.291 1.00 0.00 H new ATOM 0 HG3 PRO A 113 -27.800 6.161 -7.664 1.00 0.00 H new ATOM 0 HD2 PRO A 113 -25.838 7.345 -6.193 1.00 0.00 H new ATOM 0 HD3 PRO A 113 -26.204 5.639 -6.027 1.00 0.00 H new ATOM 1678 N ILE A 114 -23.462 6.271 -10.751 1.00 0.00 N ATOM 1679 CA ILE A 114 -22.844 7.169 -11.719 1.00 0.00 C ATOM 1680 C ILE A 114 -23.874 7.704 -12.708 1.00 0.00 C ATOM 1681 O ILE A 114 -24.925 7.098 -12.915 1.00 0.00 O ATOM 1682 CB ILE A 114 -21.717 6.466 -12.499 1.00 0.00 C ATOM 1683 CG1 ILE A 114 -22.270 5.258 -13.259 1.00 0.00 C ATOM 1684 CG2 ILE A 114 -20.605 6.040 -11.553 1.00 0.00 C ATOM 1685 CD1 ILE A 114 -21.366 4.782 -14.375 1.00 0.00 C ATOM 0 H ILE A 114 -23.373 5.280 -10.978 1.00 0.00 H new ATOM 0 HA ILE A 114 -22.421 7.999 -11.154 1.00 0.00 H new ATOM 0 HB ILE A 114 -21.303 7.168 -13.223 1.00 0.00 H new ATOM 0 HG12 ILE A 114 -22.430 4.439 -12.557 1.00 0.00 H new ATOM 0 HG13 ILE A 114 -23.244 5.515 -13.676 1.00 0.00 H new ATOM 0 HG21 ILE A 114 -19.816 5.545 -12.119 1.00 0.00 H new ATOM 0 HG22 ILE A 114 -20.197 6.918 -11.053 1.00 0.00 H new ATOM 0 HG23 ILE A 114 -21.005 5.351 -10.808 1.00 0.00 H new ATOM 0 HD11 ILE A 114 -21.820 3.924 -14.870 1.00 0.00 H new ATOM 0 HD12 ILE A 114 -21.226 5.586 -15.098 1.00 0.00 H new ATOM 0 HD13 ILE A 114 -20.400 4.493 -13.962 1.00 0.00 H new ATOM 1697 N SER A 115 -23.564 8.843 -13.318 1.00 0.00 N ATOM 1698 CA SER A 115 -24.464 9.462 -14.285 1.00 0.00 C ATOM 1699 C SER A 115 -23.858 9.436 -15.685 1.00 0.00 C ATOM 1700 O SER A 115 -22.641 9.349 -15.846 1.00 0.00 O ATOM 1701 CB SER A 115 -24.771 10.904 -13.877 1.00 0.00 C ATOM 1702 OG SER A 115 -25.562 10.944 -12.702 1.00 0.00 O ATOM 0 H SER A 115 -22.697 9.356 -13.160 1.00 0.00 H new ATOM 0 HA SER A 115 -25.392 8.890 -14.299 1.00 0.00 H new ATOM 0 HB2 SER A 115 -23.839 11.444 -13.710 1.00 0.00 H new ATOM 0 HB3 SER A 115 -25.293 11.411 -14.688 1.00 0.00 H new ATOM 0 HG SER A 115 -25.743 11.877 -12.461 1.00 0.00 H new ATOM 1708 N GLY A 116 -24.718 9.512 -16.696 1.00 0.00 N ATOM 1709 CA GLY A 116 -24.250 9.495 -18.070 1.00 0.00 C ATOM 1710 C GLY A 116 -25.253 8.865 -19.016 1.00 0.00 C ATOM 1711 O GLY A 116 -26.423 8.679 -18.681 1.00 0.00 O ATOM 0 H GLY A 116 -25.730 9.585 -16.588 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -24.042 10.515 -18.392 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -23.310 8.946 -18.124 1.00 0.00 H new ATOM 1715 N PRO A 117 -24.795 8.527 -20.231 1.00 0.00 N ATOM 1716 CA PRO A 117 -25.644 7.910 -21.253 1.00 0.00 C ATOM 1717 C PRO A 117 -26.037 6.480 -20.896 1.00 0.00 C ATOM 1718 O PRO A 117 -25.214 5.702 -20.415 1.00 0.00 O ATOM 1719 CB PRO A 117 -24.762 7.924 -22.504 1.00 0.00 C ATOM 1720 CG PRO A 117 -23.366 7.939 -21.982 1.00 0.00 C ATOM 1721 CD PRO A 117 -23.412 8.720 -20.698 1.00 0.00 C ATOM 0 HA PRO A 117 -26.587 8.443 -21.373 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -24.943 7.047 -23.126 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -24.964 8.800 -23.121 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -23.003 6.926 -21.810 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -22.687 8.403 -22.697 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -22.688 8.346 -19.974 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -23.186 9.774 -20.860 1.00 0.00 H new ATOM 1729 N SER A 118 -27.301 6.142 -21.134 1.00 0.00 N ATOM 1730 CA SER A 118 -27.804 4.806 -20.833 1.00 0.00 C ATOM 1731 C SER A 118 -29.125 4.549 -21.552 1.00 0.00 C ATOM 1732 O SER A 118 -30.076 5.318 -21.419 1.00 0.00 O ATOM 1733 CB SER A 118 -27.989 4.636 -19.324 1.00 0.00 C ATOM 1734 OG SER A 118 -28.197 3.276 -18.986 1.00 0.00 O ATOM 0 H SER A 118 -27.995 6.774 -21.534 1.00 0.00 H new ATOM 0 HA SER A 118 -27.071 4.080 -21.186 1.00 0.00 H new ATOM 0 HB2 SER A 118 -27.110 5.013 -18.802 1.00 0.00 H new ATOM 0 HB3 SER A 118 -28.839 5.231 -18.989 1.00 0.00 H new ATOM 0 HG SER A 118 -28.311 3.194 -18.016 1.00 0.00 H new ATOM 1740 N SER A 119 -29.174 3.461 -22.313 1.00 0.00 N ATOM 1741 CA SER A 119 -30.376 3.103 -23.057 1.00 0.00 C ATOM 1742 C SER A 119 -31.540 2.828 -22.109 1.00 0.00 C ATOM 1743 O SER A 119 -32.665 3.267 -22.346 1.00 0.00 O ATOM 1744 CB SER A 119 -30.114 1.874 -23.930 1.00 0.00 C ATOM 1745 OG SER A 119 -29.731 0.760 -23.141 1.00 0.00 O ATOM 0 H SER A 119 -28.396 2.812 -22.431 1.00 0.00 H new ATOM 0 HA SER A 119 -30.642 3.945 -23.697 1.00 0.00 H new ATOM 0 HB2 SER A 119 -31.011 1.630 -24.498 1.00 0.00 H new ATOM 0 HB3 SER A 119 -29.330 2.098 -24.653 1.00 0.00 H new ATOM 0 HG SER A 119 -29.571 -0.013 -23.722 1.00 0.00 H new ATOM 1751 N GLY A 120 -31.260 2.099 -21.033 1.00 0.00 N ATOM 1752 CA GLY A 120 -32.292 1.778 -20.065 1.00 0.00 C ATOM 1753 C GLY A 120 -32.511 2.891 -19.060 1.00 0.00 C ATOM 1754 O GLY A 120 -31.554 3.490 -18.569 1.00 0.00 O ATOM 0 H GLY A 120 -30.337 1.725 -20.815 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -33.227 1.576 -20.588 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -32.019 0.864 -19.537 1.00 0.00 H new TER 1758 GLY A 120