USER MOD reduce.3.24.130724 H: found=0, std=0, add=1210, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1203 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 11 SER OG : rot 27:sc= 1.79 USER MOD Set 1.2: A 75 TYR OH : rot 10:sc= 0.518 USER MOD Set 2.1: A 61 HIS : no HE2:sc= 0.652 K(o=4.4,f=-1.7!) USER MOD Set 2.2: A 62 SER OG : rot 172:sc= 1.06 USER MOD Set 2.3: A 64 ASN : amide:sc= 1.43 K(o=4.4,f=-0.71) USER MOD Set 2.4: A 111 GLN : amide:sc= 1.26 K(o=4.4,f=0.3) USER MOD Set 3.1: A 44 HIS : no HD1:sc= -0.0998 K(o=-0.22,f=-2) USER MOD Set 3.2: A 48 LYS NZ :NH3+ -107:sc= -0.119 (180deg=-0.55) USER MOD Set 4.1: A 35 SER OG : rot -150:sc= 0.743 USER MOD Set 4.2: A 38 LYS NZ :NH3+ 165:sc= 2.04 (180deg=1.04) USER MOD Single : A 1 GLY N :NH3+ 147:sc= 1.29 (180deg=0.136) USER MOD Single : A 2 SER OG : rot 180:sc= 0.0473 USER MOD Single : A 3 HIS : no HD1:sc= -0.395 X(o=-0.4,f=-0.39) USER MOD Single : A 4 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 7 GLN : amide:sc= 1.1 K(o=1.1,f=0) USER MOD Single : A 8 GLN : amide:sc= 1.06 K(o=1.1,f=-0.061) USER MOD Single : A 13 TYR OH : rot 24:sc= 1.23 USER MOD Single : A 19 HIS : no HE2:sc= 1.14 K(o=1.1,f=-3.5!) USER MOD Single : A 20 GLN : amide:sc= -3.16 K(o=-3.2,f=-5!) USER MOD Single : A 39 MET CE :methyl 158:sc= -1.47 (180deg=-3.36!) USER MOD Single : A 43 THR OG1 : rot -51:sc= 0.742 USER MOD Single : A 50 GLN : amide:sc= 0.672 K(o=0.67,f=-6.7!) USER MOD Single : A 51 GLN : amide:sc= -0.993 X(o=-0.99,f=-0.86) USER MOD Single : A 53 MET CE :methyl 168:sc= -0.378 (180deg=-0.723) USER MOD Single : A 59 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 63 MET CE :methyl -122:sc= 0 (180deg=-0.0407) USER MOD Single : A 66 THR OG1 : rot 69:sc= 1.23 USER MOD Single : A 68 GLN : amide:sc=-0.00323 K(o=-0.0032,f=-0.75) USER MOD Single : A 72 GLN :FLIP amide:sc= -0.0243 F(o=-0.56,f=-0.024) USER MOD Single : A 77 TYR OH : rot -8:sc= 0.584 USER MOD Single : A 81 SER OG : rot 180:sc= -0.0798 USER MOD Single : A 84 SER OG : rot 156:sc= 1.22 USER MOD Single : A 87 LYS NZ :NH3+ 176:sc= 1.62 (180deg=1.56) USER MOD Single : A 90 MET CE :methyl 159:sc= -0.295 (180deg=-1.26) USER MOD Single : A 94 THR OG1 : rot -12:sc= 0.139 USER MOD Single : A 96 ASN : amide:sc= 0.14 K(o=0.14,f=-0.49) USER MOD Single : A 102 THR OG1 : rot 102:sc= 1.21 USER MOD Single : A 105 HIS : no HD1:sc= -6.56 K(o=-6.6,f=-14!) USER MOD Single : A 106 LYS NZ :NH3+ -161:sc= 1.08 (180deg=-0.00162) USER MOD Single : A 108 SER OG : rot 62:sc= 0.881 USER MOD Single : A 119 LYS NZ :NH3+ 177:sc= 0.706 (180deg=0.657) USER MOD Single : A 120 GLN : amide:sc= -0.225 X(o=-0.22,f=-0.048) USER MOD Single : A 133 MET CE :methyl -174:sc= -0.66 (180deg=-0.78) USER MOD Single : A 134 ASN : amide:sc= 1.01 K(o=1,f=-7.5!) USER MOD Single : A 135 SER OG : rot -38:sc= 0.453 USER MOD Single : A 138 ASN : amide:sc= 0.845 K(o=0.84,f=-0.082) USER MOD Single : A 139 THR OG1 : rot 180:sc= 0.00996 USER MOD Single : A 142 GLN : amide:sc= -0.102 K(o=-0.1,f=-1.9!) USER MOD Single : A 143 THR OG1 : rot 75:sc= 0.985 USER MOD Single : A 145 GLN : amide:sc= 1.25 K(o=1.3,f=-0.51) USER MOD Single : A 146 ASN : amide:sc= 0.0448 K(o=0.045,f=-2.4!) USER MOD Single : A 151 LYS NZ :NH3+ -145:sc= 0.415 (180deg=-0.431) USER MOD Single : A 152 THR OG1 : rot 180:sc= 0 USER MOD Single : A 155 GLN : amide:sc= 0.328 X(o=0.33,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -16.043 28.845 8.585 1.00 0.00 N ATOM 2 CA GLY A 1 -17.430 28.578 8.998 1.00 0.00 C ATOM 3 C GLY A 1 -17.691 29.391 10.246 1.00 0.00 C ATOM 4 O GLY A 1 -17.900 30.594 10.149 1.00 0.00 O ATOM 0 H1 GLY A 1 -15.640 27.991 8.150 1.00 0.00 H new ATOM 0 H2 GLY A 1 -16.030 29.624 7.896 1.00 0.00 H new ATOM 0 H3 GLY A 1 -15.478 29.109 9.417 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -18.127 28.854 8.207 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -17.575 27.516 9.194 1.00 0.00 H new ATOM 8 N SER A 2 -17.529 28.759 11.406 1.00 0.00 N ATOM 9 CA SER A 2 -16.845 29.346 12.551 1.00 0.00 C ATOM 10 C SER A 2 -15.447 29.856 12.145 1.00 0.00 C ATOM 11 O SER A 2 -15.046 29.749 10.977 1.00 0.00 O ATOM 12 CB SER A 2 -16.737 28.246 13.626 1.00 0.00 C ATOM 13 OG SER A 2 -16.430 26.998 13.020 1.00 0.00 O ATOM 0 H SER A 2 -17.874 27.814 11.577 1.00 0.00 H new ATOM 0 HA SER A 2 -17.398 30.203 12.935 1.00 0.00 H new ATOM 0 HB2 SER A 2 -15.964 28.508 14.349 1.00 0.00 H new ATOM 0 HB3 SER A 2 -17.675 28.171 14.176 1.00 0.00 H new ATOM 0 HG SER A 2 -16.362 26.307 13.711 1.00 0.00 H new ATOM 19 N HIS A 3 -14.741 30.482 13.088 1.00 0.00 N ATOM 20 CA HIS A 3 -13.351 30.895 12.908 1.00 0.00 C ATOM 21 C HIS A 3 -12.500 29.655 12.575 1.00 0.00 C ATOM 22 O HIS A 3 -12.979 28.521 12.662 1.00 0.00 O ATOM 23 CB HIS A 3 -12.859 31.598 14.191 1.00 0.00 C ATOM 24 CG HIS A 3 -13.395 30.995 15.472 1.00 0.00 C ATOM 25 ND1 HIS A 3 -14.190 31.648 16.391 1.00 0.00 N ATOM 26 CD2 HIS A 3 -13.290 29.685 15.865 1.00 0.00 C ATOM 27 CE1 HIS A 3 -14.564 30.747 17.315 1.00 0.00 C ATOM 28 NE2 HIS A 3 -14.070 29.539 17.016 1.00 0.00 N ATOM 0 H HIS A 3 -15.122 30.718 14.004 1.00 0.00 H new ATOM 0 HA HIS A 3 -13.262 31.602 12.083 1.00 0.00 H new ATOM 0 HB2 HIS A 3 -11.770 31.566 14.215 1.00 0.00 H new ATOM 0 HB3 HIS A 3 -13.146 32.649 14.149 1.00 0.00 H new ATOM 0 HD2 HIS A 3 -12.714 28.913 15.378 1.00 0.00 H new ATOM 0 HE1 HIS A 3 -15.177 30.966 18.177 1.00 0.00 H new ATOM 0 HE2 HIS A 3 -14.232 28.674 17.532 1.00 0.00 H new ATOM 36 N MET A 4 -11.246 29.873 12.184 1.00 0.00 N ATOM 37 CA MET A 4 -10.301 28.794 11.935 1.00 0.00 C ATOM 38 C MET A 4 -10.067 27.996 13.222 1.00 0.00 C ATOM 39 O MET A 4 -10.242 28.519 14.325 1.00 0.00 O ATOM 40 CB MET A 4 -8.959 29.360 11.433 1.00 0.00 C ATOM 41 CG MET A 4 -9.027 30.064 10.070 1.00 0.00 C ATOM 42 SD MET A 4 -9.859 31.682 10.025 1.00 0.00 S ATOM 43 CE MET A 4 -9.447 32.174 8.330 1.00 0.00 C ATOM 0 H MET A 4 -10.859 30.804 12.032 1.00 0.00 H new ATOM 0 HA MET A 4 -10.719 28.138 11.171 1.00 0.00 H new ATOM 0 HB2 MET A 4 -8.579 30.065 12.172 1.00 0.00 H new ATOM 0 HB3 MET A 4 -8.238 28.545 11.370 1.00 0.00 H new ATOM 0 HG2 MET A 4 -8.009 30.195 9.704 1.00 0.00 H new ATOM 0 HG3 MET A 4 -9.535 29.401 9.370 1.00 0.00 H new ATOM 0 HE1 MET A 4 -9.878 33.153 8.120 1.00 0.00 H new ATOM 0 HE2 MET A 4 -8.364 32.223 8.219 1.00 0.00 H new ATOM 0 HE3 MET A 4 -9.851 31.442 7.630 1.00 0.00 H new ATOM 53 N LEU A 5 -9.659 26.744 13.044 1.00 0.00 N ATOM 54 CA LEU A 5 -9.231 25.784 14.050 1.00 0.00 C ATOM 55 C LEU A 5 -7.920 25.219 13.495 1.00 0.00 C ATOM 56 O LEU A 5 -7.617 25.407 12.311 1.00 0.00 O ATOM 57 CB LEU A 5 -10.249 24.640 14.257 1.00 0.00 C ATOM 58 CG LEU A 5 -11.366 24.919 15.282 1.00 0.00 C ATOM 59 CD1 LEU A 5 -12.517 25.752 14.703 1.00 0.00 C ATOM 60 CD2 LEU A 5 -11.957 23.596 15.787 1.00 0.00 C ATOM 0 H LEU A 5 -9.616 26.342 12.108 1.00 0.00 H new ATOM 0 HA LEU A 5 -9.128 26.260 15.025 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -10.711 24.411 13.297 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -9.707 23.748 14.571 1.00 0.00 H new ATOM 0 HG LEU A 5 -10.901 25.485 16.089 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -13.271 25.915 15.473 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -12.134 26.714 14.361 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -12.964 25.220 13.863 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -12.745 23.802 16.511 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -12.372 23.039 14.947 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -11.174 23.006 16.262 1.00 0.00 H new ATOM 72 N ASP A 6 -7.146 24.561 14.344 1.00 0.00 N ATOM 73 CA ASP A 6 -5.930 23.848 13.990 1.00 0.00 C ATOM 74 C ASP A 6 -6.270 22.474 13.404 1.00 0.00 C ATOM 75 O ASP A 6 -7.290 21.867 13.731 1.00 0.00 O ATOM 76 CB ASP A 6 -5.018 23.724 15.226 1.00 0.00 C ATOM 77 CG ASP A 6 -5.681 23.088 16.459 1.00 0.00 C ATOM 78 OD1 ASP A 6 -6.690 23.671 16.931 1.00 0.00 O ATOM 79 OD2 ASP A 6 -5.127 22.094 16.974 1.00 0.00 O ATOM 0 H ASP A 6 -7.358 24.507 15.340 1.00 0.00 H new ATOM 0 HA ASP A 6 -5.392 24.409 13.226 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -4.143 23.132 14.956 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -4.660 24.717 15.496 1.00 0.00 H new ATOM 84 N GLN A 7 -5.417 22.016 12.486 1.00 0.00 N ATOM 85 CA GLN A 7 -5.329 20.750 11.808 1.00 0.00 C ATOM 86 C GLN A 7 -3.955 20.840 11.109 1.00 0.00 C ATOM 87 O GLN A 7 -3.258 21.859 11.154 1.00 0.00 O ATOM 88 CB GLN A 7 -6.476 20.530 10.788 1.00 0.00 C ATOM 89 CG GLN A 7 -6.788 19.029 10.613 1.00 0.00 C ATOM 90 CD GLN A 7 -7.648 18.708 9.387 1.00 0.00 C ATOM 91 OE1 GLN A 7 -8.861 18.896 9.414 1.00 0.00 O ATOM 92 NE2 GLN A 7 -7.038 18.190 8.329 1.00 0.00 N ATOM 0 H GLN A 7 -4.667 22.628 12.165 1.00 0.00 H new ATOM 0 HA GLN A 7 -5.424 19.903 12.488 1.00 0.00 H new ATOM 0 HB2 GLN A 7 -7.371 21.053 11.125 1.00 0.00 H new ATOM 0 HB3 GLN A 7 -6.198 20.961 9.826 1.00 0.00 H new ATOM 0 HG2 GLN A 7 -5.849 18.480 10.539 1.00 0.00 H new ATOM 0 HG3 GLN A 7 -7.298 18.668 11.506 1.00 0.00 H new ATOM 0 HE21 GLN A 7 -6.028 18.048 8.342 1.00 0.00 H new ATOM 0 HE22 GLN A 7 -7.579 17.934 7.503 1.00 0.00 H new ATOM 101 N GLN A 8 -3.586 19.755 10.467 1.00 0.00 N ATOM 102 CA GLN A 8 -2.426 19.560 9.612 1.00 0.00 C ATOM 103 C GLN A 8 -2.958 18.983 8.289 1.00 0.00 C ATOM 104 O GLN A 8 -4.122 18.567 8.217 1.00 0.00 O ATOM 105 CB GLN A 8 -1.425 18.624 10.321 1.00 0.00 C ATOM 106 CG GLN A 8 0.024 18.712 9.810 1.00 0.00 C ATOM 107 CD GLN A 8 0.715 20.010 10.233 1.00 0.00 C ATOM 108 OE1 GLN A 8 1.140 20.157 11.375 1.00 0.00 O ATOM 109 NE2 GLN A 8 0.864 20.973 9.340 1.00 0.00 N ATOM 0 H GLN A 8 -4.141 18.902 10.534 1.00 0.00 H new ATOM 0 HA GLN A 8 -1.886 20.485 9.408 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -1.432 18.850 11.387 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -1.771 17.596 10.211 1.00 0.00 H new ATOM 0 HG2 GLN A 8 0.592 17.862 10.188 1.00 0.00 H new ATOM 0 HG3 GLN A 8 0.028 18.640 8.722 1.00 0.00 H new ATOM 0 HE21 GLN A 8 0.510 20.848 8.392 1.00 0.00 H new ATOM 0 HE22 GLN A 8 1.333 21.841 9.599 1.00 0.00 H new ATOM 118 N GLU A 9 -2.128 18.986 7.250 1.00 0.00 N ATOM 119 CA GLU A 9 -2.408 18.413 5.943 1.00 0.00 C ATOM 120 C GLU A 9 -2.555 16.887 6.036 1.00 0.00 C ATOM 121 O GLU A 9 -2.190 16.261 7.032 1.00 0.00 O ATOM 122 CB GLU A 9 -1.293 18.803 4.950 1.00 0.00 C ATOM 123 CG GLU A 9 -1.161 20.316 4.673 1.00 0.00 C ATOM 124 CD GLU A 9 -0.420 21.142 5.742 1.00 0.00 C ATOM 125 OE1 GLU A 9 0.071 20.564 6.742 1.00 0.00 O ATOM 126 OE2 GLU A 9 -0.341 22.376 5.558 1.00 0.00 O ATOM 0 H GLU A 9 -1.201 19.408 7.302 1.00 0.00 H new ATOM 0 HA GLU A 9 -3.354 18.813 5.578 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -0.341 18.436 5.334 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -1.474 18.291 4.005 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -0.645 20.446 3.721 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -2.162 20.731 4.553 1.00 0.00 H new ATOM 133 N GLU A 10 -3.068 16.284 4.963 1.00 0.00 N ATOM 134 CA GLU A 10 -3.410 14.870 4.869 1.00 0.00 C ATOM 135 C GLU A 10 -2.951 14.331 3.497 1.00 0.00 C ATOM 136 O GLU A 10 -2.552 15.103 2.620 1.00 0.00 O ATOM 137 CB GLU A 10 -4.933 14.709 4.982 1.00 0.00 C ATOM 138 CG GLU A 10 -5.674 15.295 6.197 1.00 0.00 C ATOM 139 CD GLU A 10 -7.199 15.312 5.967 1.00 0.00 C ATOM 140 OE1 GLU A 10 -7.740 14.314 5.428 1.00 0.00 O ATOM 141 OE2 GLU A 10 -7.824 16.346 6.306 1.00 0.00 O ATOM 0 H GLU A 10 -3.264 16.792 4.100 1.00 0.00 H new ATOM 0 HA GLU A 10 -2.919 14.319 5.671 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -5.374 15.150 4.088 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -5.151 13.641 4.952 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -5.444 14.706 7.085 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -5.321 16.309 6.387 1.00 0.00 H new ATOM 148 N SER A 11 -3.039 13.013 3.278 1.00 0.00 N ATOM 149 CA SER A 11 -2.711 12.247 2.065 1.00 0.00 C ATOM 150 C SER A 11 -3.078 10.767 2.263 1.00 0.00 C ATOM 151 O SER A 11 -3.582 10.416 3.320 1.00 0.00 O ATOM 152 CB SER A 11 -1.263 12.468 1.602 1.00 0.00 C ATOM 153 OG SER A 11 -1.210 13.677 0.872 1.00 0.00 O ATOM 0 H SER A 11 -3.374 12.395 4.017 1.00 0.00 H new ATOM 0 HA SER A 11 -3.318 12.624 1.242 1.00 0.00 H new ATOM 0 HB2 SER A 11 -0.593 12.513 2.460 1.00 0.00 H new ATOM 0 HB3 SER A 11 -0.931 11.635 0.982 1.00 0.00 H new ATOM 0 HG SER A 11 -1.928 14.272 1.172 1.00 0.00 H new ATOM 159 N LEU A 12 -2.905 9.927 1.235 1.00 0.00 N ATOM 160 CA LEU A 12 -3.298 8.511 1.169 1.00 0.00 C ATOM 161 C LEU A 12 -2.958 7.752 2.462 1.00 0.00 C ATOM 162 O LEU A 12 -1.807 7.785 2.910 1.00 0.00 O ATOM 163 CB LEU A 12 -2.533 7.904 -0.029 1.00 0.00 C ATOM 164 CG LEU A 12 -2.893 6.483 -0.509 1.00 0.00 C ATOM 165 CD1 LEU A 12 -2.033 6.216 -1.741 1.00 0.00 C ATOM 166 CD2 LEU A 12 -2.584 5.353 0.466 1.00 0.00 C ATOM 0 H LEU A 12 -2.459 10.236 0.372 1.00 0.00 H new ATOM 0 HA LEU A 12 -4.378 8.427 1.047 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -2.661 8.579 -0.876 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -1.473 7.906 0.223 1.00 0.00 H new ATOM 0 HG LEU A 12 -3.972 6.478 -0.664 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -2.247 5.219 -2.125 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -2.257 6.956 -2.509 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -0.979 6.282 -1.470 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -2.878 4.401 0.024 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -1.515 5.339 0.680 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -3.138 5.510 1.392 1.00 0.00 H new ATOM 178 N TYR A 13 -3.945 7.038 3.013 1.00 0.00 N ATOM 179 CA TYR A 13 -3.823 6.151 4.164 1.00 0.00 C ATOM 180 C TYR A 13 -4.129 4.715 3.724 1.00 0.00 C ATOM 181 O TYR A 13 -5.125 4.473 3.043 1.00 0.00 O ATOM 182 CB TYR A 13 -4.788 6.586 5.276 1.00 0.00 C ATOM 183 CG TYR A 13 -4.384 7.851 6.003 1.00 0.00 C ATOM 184 CD1 TYR A 13 -3.462 7.760 7.060 1.00 0.00 C ATOM 185 CD2 TYR A 13 -4.898 9.109 5.631 1.00 0.00 C ATOM 186 CE1 TYR A 13 -2.990 8.921 7.691 1.00 0.00 C ATOM 187 CE2 TYR A 13 -4.447 10.275 6.276 1.00 0.00 C ATOM 188 CZ TYR A 13 -3.462 10.186 7.282 1.00 0.00 C ATOM 189 OH TYR A 13 -2.924 11.310 7.819 1.00 0.00 O ATOM 0 H TYR A 13 -4.896 7.068 2.647 1.00 0.00 H new ATOM 0 HA TYR A 13 -2.807 6.201 4.556 1.00 0.00 H new ATOM 0 HB2 TYR A 13 -5.778 6.732 4.843 1.00 0.00 H new ATOM 0 HB3 TYR A 13 -4.873 5.777 6.002 1.00 0.00 H new ATOM 0 HD1 TYR A 13 -3.115 6.791 7.388 1.00 0.00 H new ATOM 0 HD2 TYR A 13 -5.640 9.178 4.849 1.00 0.00 H new ATOM 0 HE1 TYR A 13 -2.266 8.846 8.489 1.00 0.00 H new ATOM 0 HE2 TYR A 13 -4.854 11.237 6.001 1.00 0.00 H new ATOM 0 HH TYR A 13 -2.023 11.115 8.151 1.00 0.00 H new ATOM 199 N LEU A 14 -3.296 3.746 4.108 1.00 0.00 N ATOM 200 CA LEU A 14 -3.422 2.330 3.758 1.00 0.00 C ATOM 201 C LEU A 14 -2.955 1.538 4.977 1.00 0.00 C ATOM 202 O LEU A 14 -1.814 1.713 5.414 1.00 0.00 O ATOM 203 CB LEU A 14 -2.545 2.022 2.526 1.00 0.00 C ATOM 204 CG LEU A 14 -2.753 0.705 1.765 1.00 0.00 C ATOM 205 CD1 LEU A 14 -1.489 0.320 0.994 1.00 0.00 C ATOM 206 CD2 LEU A 14 -3.218 -0.517 2.558 1.00 0.00 C ATOM 0 H LEU A 14 -2.483 3.934 4.695 1.00 0.00 H new ATOM 0 HA LEU A 14 -4.448 2.064 3.503 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -2.682 2.836 1.815 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -1.504 2.053 2.849 1.00 0.00 H new ATOM 0 HG LEU A 14 -3.592 0.951 1.114 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -1.658 -0.616 0.462 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -1.246 1.105 0.278 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -0.661 0.196 1.692 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -3.320 -1.369 1.886 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -2.485 -0.750 3.331 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -4.181 -0.304 3.023 1.00 0.00 H new ATOM 218 N TRP A 15 -3.806 0.696 5.554 1.00 0.00 N ATOM 219 CA TRP A 15 -3.455 -0.168 6.666 1.00 0.00 C ATOM 220 C TRP A 15 -3.981 -1.584 6.418 1.00 0.00 C ATOM 221 O TRP A 15 -4.634 -1.857 5.411 1.00 0.00 O ATOM 222 CB TRP A 15 -3.918 0.501 7.970 1.00 0.00 C ATOM 223 CG TRP A 15 -5.383 0.748 8.165 1.00 0.00 C ATOM 224 CD1 TRP A 15 -6.189 0.042 8.991 1.00 0.00 C ATOM 225 CD2 TRP A 15 -6.201 1.831 7.616 1.00 0.00 C ATOM 226 NE1 TRP A 15 -7.449 0.625 8.988 1.00 0.00 N ATOM 227 CE2 TRP A 15 -7.505 1.755 8.185 1.00 0.00 C ATOM 228 CE3 TRP A 15 -5.963 2.894 6.719 1.00 0.00 C ATOM 229 CZ2 TRP A 15 -8.507 2.709 7.893 1.00 0.00 C ATOM 230 CZ3 TRP A 15 -6.967 3.819 6.385 1.00 0.00 C ATOM 231 CH2 TRP A 15 -8.236 3.754 6.981 1.00 0.00 C ATOM 0 H TRP A 15 -4.776 0.596 5.253 1.00 0.00 H new ATOM 0 HA TRP A 15 -2.377 -0.296 6.763 1.00 0.00 H new ATOM 0 HB2 TRP A 15 -3.572 -0.115 8.800 1.00 0.00 H new ATOM 0 HB3 TRP A 15 -3.406 1.460 8.051 1.00 0.00 H new ATOM 0 HD1 TRP A 15 -5.900 -0.830 9.559 1.00 0.00 H new ATOM 0 HE1 TRP A 15 -8.243 0.264 9.516 1.00 0.00 H new ATOM 0 HE3 TRP A 15 -4.983 3.000 6.277 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 -9.476 2.639 8.365 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 -6.759 4.591 5.659 1.00 0.00 H new ATOM 0 HH2 TRP A 15 -8.992 4.489 6.747 1.00 0.00 H new ATOM 242 N ILE A 16 -3.654 -2.510 7.306 1.00 0.00 N ATOM 243 CA ILE A 16 -4.137 -3.879 7.329 1.00 0.00 C ATOM 244 C ILE A 16 -5.000 -3.894 8.577 1.00 0.00 C ATOM 245 O ILE A 16 -4.502 -3.598 9.661 1.00 0.00 O ATOM 246 CB ILE A 16 -2.985 -4.910 7.342 1.00 0.00 C ATOM 247 CG1 ILE A 16 -1.822 -4.529 6.415 1.00 0.00 C ATOM 248 CG2 ILE A 16 -3.512 -6.242 6.843 1.00 0.00 C ATOM 249 CD1 ILE A 16 -0.663 -5.531 6.344 1.00 0.00 C ATOM 0 H ILE A 16 -3.009 -2.314 8.071 1.00 0.00 H new ATOM 0 HA ILE A 16 -4.693 -4.170 6.438 1.00 0.00 H new ATOM 0 HB ILE A 16 -2.620 -4.950 8.368 1.00 0.00 H new ATOM 0 HG12 ILE A 16 -2.217 -4.388 5.409 1.00 0.00 H new ATOM 0 HG13 ILE A 16 -1.425 -3.567 6.739 1.00 0.00 H new ATOM 0 HG21 ILE A 16 -2.707 -6.977 6.848 1.00 0.00 H new ATOM 0 HG22 ILE A 16 -4.317 -6.582 7.494 1.00 0.00 H new ATOM 0 HG23 ILE A 16 -3.891 -6.126 5.828 1.00 0.00 H new ATOM 0 HD11 ILE A 16 0.099 -5.158 5.660 1.00 0.00 H new ATOM 0 HD12 ILE A 16 -0.230 -5.657 7.336 1.00 0.00 H new ATOM 0 HD13 ILE A 16 -1.034 -6.491 5.985 1.00 0.00 H new ATOM 261 N ASP A 17 -6.301 -4.113 8.432 1.00 0.00 N ATOM 262 CA ASP A 17 -7.238 -4.009 9.539 1.00 0.00 C ATOM 263 C ASP A 17 -7.332 -5.259 10.414 1.00 0.00 C ATOM 264 O ASP A 17 -7.226 -6.407 9.975 1.00 0.00 O ATOM 265 CB ASP A 17 -8.628 -3.603 9.022 1.00 0.00 C ATOM 266 CG ASP A 17 -9.146 -4.505 7.896 1.00 0.00 C ATOM 267 OD1 ASP A 17 -8.663 -4.297 6.760 1.00 0.00 O ATOM 268 OD2 ASP A 17 -10.043 -5.349 8.142 1.00 0.00 O ATOM 0 H ASP A 17 -6.734 -4.367 7.544 1.00 0.00 H new ATOM 0 HA ASP A 17 -6.839 -3.232 10.191 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -9.336 -3.625 9.850 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -8.588 -2.574 8.664 1.00 0.00 H new ATOM 273 N ALA A 18 -7.610 -4.995 11.695 1.00 0.00 N ATOM 274 CA ALA A 18 -7.656 -5.950 12.794 1.00 0.00 C ATOM 275 C ALA A 18 -8.708 -7.044 12.643 1.00 0.00 C ATOM 276 O ALA A 18 -8.633 -8.043 13.362 1.00 0.00 O ATOM 277 CB ALA A 18 -7.926 -5.178 14.088 1.00 0.00 C ATOM 0 H ALA A 18 -7.821 -4.047 12.006 1.00 0.00 H new ATOM 0 HA ALA A 18 -6.693 -6.461 12.803 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -7.965 -5.874 14.926 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -7.127 -4.455 14.254 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -8.879 -4.654 14.007 1.00 0.00 H new ATOM 283 N HIS A 19 -9.668 -6.902 11.726 1.00 0.00 N ATOM 284 CA HIS A 19 -10.630 -7.959 11.465 1.00 0.00 C ATOM 285 C HIS A 19 -9.900 -9.234 11.047 1.00 0.00 C ATOM 286 O HIS A 19 -10.324 -10.324 11.431 1.00 0.00 O ATOM 287 CB HIS A 19 -11.627 -7.533 10.385 1.00 0.00 C ATOM 288 CG HIS A 19 -12.284 -6.204 10.653 1.00 0.00 C ATOM 289 ND1 HIS A 19 -12.128 -5.077 9.884 1.00 0.00 N ATOM 290 CD2 HIS A 19 -13.095 -5.881 11.706 1.00 0.00 C ATOM 291 CE1 HIS A 19 -12.848 -4.094 10.447 1.00 0.00 C ATOM 292 NE2 HIS A 19 -13.460 -4.540 11.559 1.00 0.00 N ATOM 0 H HIS A 19 -9.794 -6.065 11.157 1.00 0.00 H new ATOM 0 HA HIS A 19 -11.189 -8.155 12.380 1.00 0.00 H new ATOM 0 HB2 HIS A 19 -11.111 -7.486 9.426 1.00 0.00 H new ATOM 0 HB3 HIS A 19 -12.399 -8.297 10.294 1.00 0.00 H new ATOM 0 HD1 HIS A 19 -11.566 -5.001 9.037 1.00 0.00 H new ATOM 0 HD2 HIS A 19 -13.398 -6.542 12.505 1.00 0.00 H new ATOM 0 HE1 HIS A 19 -12.925 -3.088 10.062 1.00 0.00 H new ATOM 300 N GLN A 20 -8.786 -9.118 10.313 1.00 0.00 N ATOM 301 CA GLN A 20 -8.065 -10.300 9.882 1.00 0.00 C ATOM 302 C GLN A 20 -7.440 -11.027 11.071 1.00 0.00 C ATOM 303 O GLN A 20 -7.509 -12.251 11.147 1.00 0.00 O ATOM 304 CB GLN A 20 -7.027 -9.943 8.809 1.00 0.00 C ATOM 305 CG GLN A 20 -6.632 -11.204 8.031 1.00 0.00 C ATOM 306 CD GLN A 20 -7.872 -11.868 7.430 1.00 0.00 C ATOM 307 OE1 GLN A 20 -8.594 -11.262 6.652 1.00 0.00 O ATOM 308 NE2 GLN A 20 -8.200 -13.079 7.835 1.00 0.00 N ATOM 0 H GLN A 20 -8.378 -8.232 10.015 1.00 0.00 H new ATOM 0 HA GLN A 20 -8.775 -10.990 9.427 1.00 0.00 H new ATOM 0 HB2 GLN A 20 -7.436 -9.197 8.128 1.00 0.00 H new ATOM 0 HB3 GLN A 20 -6.146 -9.501 9.274 1.00 0.00 H new ATOM 0 HG2 GLN A 20 -5.930 -10.945 7.239 1.00 0.00 H new ATOM 0 HG3 GLN A 20 -6.122 -11.903 8.693 1.00 0.00 H new ATOM 0 HE21 GLN A 20 -7.594 -13.581 8.484 1.00 0.00 H new ATOM 0 HE22 GLN A 20 -9.059 -13.514 7.499 1.00 0.00 H new ATOM 317 N ALA A 21 -6.841 -10.285 12.001 1.00 0.00 N ATOM 318 CA ALA A 21 -6.320 -10.815 13.246 1.00 0.00 C ATOM 319 C ALA A 21 -7.429 -11.451 14.077 1.00 0.00 C ATOM 320 O ALA A 21 -7.222 -12.510 14.664 1.00 0.00 O ATOM 321 CB ALA A 21 -5.614 -9.708 13.997 1.00 0.00 C ATOM 0 H ALA A 21 -6.705 -9.279 11.902 1.00 0.00 H new ATOM 0 HA ALA A 21 -5.600 -11.605 13.034 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -5.219 -10.099 14.935 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -4.794 -9.322 13.391 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -6.319 -8.904 14.207 1.00 0.00 H new ATOM 327 N ARG A 22 -8.633 -10.881 14.094 1.00 0.00 N ATOM 328 CA ARG A 22 -9.742 -11.525 14.759 1.00 0.00 C ATOM 329 C ARG A 22 -9.911 -12.920 14.162 1.00 0.00 C ATOM 330 O ARG A 22 -9.702 -13.905 14.869 1.00 0.00 O ATOM 331 CB ARG A 22 -10.975 -10.611 14.744 1.00 0.00 C ATOM 332 CG ARG A 22 -12.137 -11.209 15.546 1.00 0.00 C ATOM 333 CD ARG A 22 -12.895 -10.168 16.373 1.00 0.00 C ATOM 334 NE ARG A 22 -12.131 -9.782 17.572 1.00 0.00 N ATOM 335 CZ ARG A 22 -11.983 -8.555 18.080 1.00 0.00 C ATOM 336 NH1 ARG A 22 -12.543 -7.499 17.499 1.00 0.00 N ATOM 337 NH2 ARG A 22 -11.275 -8.410 19.188 1.00 0.00 N ATOM 0 H ARG A 22 -8.855 -9.986 13.658 1.00 0.00 H new ATOM 0 HA ARG A 22 -9.561 -11.683 15.822 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -10.711 -9.638 15.157 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -11.292 -10.445 13.714 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -12.831 -11.695 14.861 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -11.752 -11.982 16.211 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -13.089 -9.286 15.763 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -13.864 -10.570 16.670 1.00 0.00 H new ATOM 0 HE ARG A 22 -11.662 -10.537 18.071 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -13.097 -7.618 16.651 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -12.419 -6.570 17.901 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -10.856 -9.225 19.636 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -11.148 -7.483 19.595 1.00 0.00 H new ATOM 351 N VAL A 23 -10.128 -13.017 12.853 1.00 0.00 N ATOM 352 CA VAL A 23 -10.221 -14.276 12.120 1.00 0.00 C ATOM 353 C VAL A 23 -9.008 -15.186 12.389 1.00 0.00 C ATOM 354 O VAL A 23 -9.128 -16.401 12.237 1.00 0.00 O ATOM 355 CB VAL A 23 -10.454 -13.983 10.619 1.00 0.00 C ATOM 356 CG1 VAL A 23 -10.553 -15.242 9.742 1.00 0.00 C ATOM 357 CG2 VAL A 23 -11.765 -13.206 10.417 1.00 0.00 C ATOM 0 H VAL A 23 -10.247 -12.198 12.256 1.00 0.00 H new ATOM 0 HA VAL A 23 -11.081 -14.841 12.480 1.00 0.00 H new ATOM 0 HB VAL A 23 -9.579 -13.409 10.313 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -10.716 -14.951 8.704 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -9.627 -15.812 9.817 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -11.386 -15.857 10.082 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -11.911 -13.009 9.355 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -12.600 -13.796 10.795 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -11.715 -12.261 10.957 1.00 0.00 H new ATOM 367 N LEU A 24 -7.858 -14.634 12.795 1.00 0.00 N ATOM 368 CA LEU A 24 -6.704 -15.421 13.169 1.00 0.00 C ATOM 369 C LEU A 24 -6.876 -16.101 14.530 1.00 0.00 C ATOM 370 O LEU A 24 -6.653 -17.306 14.603 1.00 0.00 O ATOM 371 CB LEU A 24 -5.399 -14.588 13.158 1.00 0.00 C ATOM 372 CG LEU A 24 -4.767 -14.390 11.769 1.00 0.00 C ATOM 373 CD1 LEU A 24 -3.855 -13.157 11.673 1.00 0.00 C ATOM 374 CD2 LEU A 24 -3.973 -15.634 11.364 1.00 0.00 C ATOM 0 H LEU A 24 -7.714 -13.627 12.869 1.00 0.00 H new ATOM 0 HA LEU A 24 -6.622 -16.199 12.410 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -5.607 -13.609 13.589 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -4.670 -15.074 13.807 1.00 0.00 H new ATOM 0 HG LEU A 24 -5.600 -14.225 11.086 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -3.447 -13.084 10.665 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -4.432 -12.260 11.897 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -3.039 -13.252 12.389 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -3.532 -15.479 10.379 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -3.182 -15.814 12.092 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -4.639 -16.496 11.332 1.00 0.00 H new ATOM 386 N ILE A 25 -7.254 -15.366 15.589 1.00 0.00 N ATOM 387 CA ILE A 25 -7.295 -15.919 16.971 1.00 0.00 C ATOM 388 C ILE A 25 -8.251 -15.200 17.950 1.00 0.00 C ATOM 389 O ILE A 25 -8.099 -15.251 19.168 1.00 0.00 O ATOM 390 CB ILE A 25 -5.863 -16.024 17.578 1.00 0.00 C ATOM 391 CG1 ILE A 25 -5.098 -14.698 17.434 1.00 0.00 C ATOM 392 CG2 ILE A 25 -5.005 -17.187 17.045 1.00 0.00 C ATOM 393 CD1 ILE A 25 -4.098 -14.512 18.574 1.00 0.00 C ATOM 0 H ILE A 25 -7.537 -14.388 15.524 1.00 0.00 H new ATOM 0 HA ILE A 25 -7.719 -16.915 16.848 1.00 0.00 H new ATOM 0 HB ILE A 25 -6.036 -16.246 18.631 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -4.573 -14.680 16.479 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -5.803 -13.867 17.426 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -4.029 -17.171 17.530 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -5.501 -18.133 17.259 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -4.877 -17.081 15.968 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -3.572 -13.566 18.446 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -4.629 -14.506 19.526 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -3.379 -15.331 18.565 1.00 0.00 H new ATOM 405 N GLY A 26 -9.237 -14.489 17.431 1.00 0.00 N ATOM 406 CA GLY A 26 -10.182 -13.641 18.160 1.00 0.00 C ATOM 407 C GLY A 26 -9.606 -12.302 18.633 1.00 0.00 C ATOM 408 O GLY A 26 -10.320 -11.477 19.210 1.00 0.00 O ATOM 0 H GLY A 26 -9.416 -14.484 16.427 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -11.042 -13.445 17.520 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -10.548 -14.190 19.027 1.00 0.00 H new ATOM 412 N PHE A 27 -8.332 -12.085 18.338 1.00 0.00 N ATOM 413 CA PHE A 27 -7.484 -10.974 18.756 1.00 0.00 C ATOM 414 C PHE A 27 -7.759 -9.753 17.889 1.00 0.00 C ATOM 415 O PHE A 27 -8.609 -9.779 17.002 1.00 0.00 O ATOM 416 CB PHE A 27 -6.037 -11.482 18.715 1.00 0.00 C ATOM 417 CG PHE A 27 -4.931 -10.657 19.344 1.00 0.00 C ATOM 418 CD1 PHE A 27 -5.135 -9.943 20.544 1.00 0.00 C ATOM 419 CD2 PHE A 27 -3.631 -10.763 18.817 1.00 0.00 C ATOM 420 CE1 PHE A 27 -4.049 -9.336 21.197 1.00 0.00 C ATOM 421 CE2 PHE A 27 -2.542 -10.182 19.486 1.00 0.00 C ATOM 422 CZ PHE A 27 -2.751 -9.468 20.674 1.00 0.00 C ATOM 0 H PHE A 27 -7.819 -12.739 17.748 1.00 0.00 H new ATOM 0 HA PHE A 27 -7.693 -10.639 19.772 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -6.023 -12.462 19.192 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -5.775 -11.633 17.668 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -6.128 -9.863 20.961 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -3.470 -11.295 17.891 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -4.212 -8.768 22.101 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -1.544 -10.285 19.086 1.00 0.00 H new ATOM 0 HZ PHE A 27 -1.914 -9.019 21.188 1.00 0.00 H new ATOM 432 N GLU A 28 -7.105 -8.650 18.214 1.00 0.00 N ATOM 433 CA GLU A 28 -7.338 -7.361 17.580 1.00 0.00 C ATOM 434 C GLU A 28 -5.971 -6.713 17.345 1.00 0.00 C ATOM 435 O GLU A 28 -5.285 -6.403 18.316 1.00 0.00 O ATOM 436 CB GLU A 28 -8.225 -6.570 18.561 1.00 0.00 C ATOM 437 CG GLU A 28 -8.968 -5.351 17.989 1.00 0.00 C ATOM 438 CD GLU A 28 -10.445 -5.332 18.420 1.00 0.00 C ATOM 439 OE1 GLU A 28 -10.767 -5.749 19.557 1.00 0.00 O ATOM 440 OE2 GLU A 28 -11.316 -5.089 17.558 1.00 0.00 O ATOM 0 H GLU A 28 -6.386 -8.624 18.937 1.00 0.00 H new ATOM 0 HA GLU A 28 -7.840 -7.414 16.614 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -8.964 -7.254 18.979 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -7.600 -6.231 19.388 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -8.479 -4.436 18.324 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -8.906 -5.365 16.901 1.00 0.00 H new ATOM 447 N GLU A 29 -5.553 -6.538 16.086 1.00 0.00 N ATOM 448 CA GLU A 29 -4.253 -5.967 15.741 1.00 0.00 C ATOM 449 C GLU A 29 -4.259 -5.440 14.289 1.00 0.00 C ATOM 450 O GLU A 29 -4.406 -6.235 13.354 1.00 0.00 O ATOM 451 CB GLU A 29 -3.136 -7.024 15.808 1.00 0.00 C ATOM 452 CG GLU A 29 -2.861 -7.899 17.035 1.00 0.00 C ATOM 453 CD GLU A 29 -1.700 -8.855 16.699 1.00 0.00 C ATOM 454 OE1 GLU A 29 -0.519 -8.445 16.806 1.00 0.00 O ATOM 455 OE2 GLU A 29 -1.946 -9.955 16.153 1.00 0.00 O ATOM 0 H GLU A 29 -6.115 -6.792 15.274 1.00 0.00 H new ATOM 0 HA GLU A 29 -4.071 -5.167 16.459 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -3.314 -7.709 14.979 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -2.205 -6.498 15.593 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -2.605 -7.279 17.894 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -3.753 -8.465 17.305 1.00 0.00 H new ATOM 462 N ASP A 30 -4.107 -4.132 14.070 1.00 0.00 N ATOM 463 CA ASP A 30 -3.955 -3.501 12.748 1.00 0.00 C ATOM 464 C ASP A 30 -2.460 -3.441 12.371 1.00 0.00 C ATOM 465 O ASP A 30 -1.597 -3.896 13.134 1.00 0.00 O ATOM 466 CB ASP A 30 -4.507 -2.064 12.780 1.00 0.00 C ATOM 467 CG ASP A 30 -3.527 -1.104 13.461 1.00 0.00 C ATOM 468 OD1 ASP A 30 -3.448 -1.184 14.706 1.00 0.00 O ATOM 469 OD2 ASP A 30 -2.847 -0.352 12.726 1.00 0.00 O ATOM 0 H ASP A 30 -4.085 -3.455 14.833 1.00 0.00 H new ATOM 0 HA ASP A 30 -4.506 -4.092 12.016 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -4.703 -1.725 11.763 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -5.460 -2.050 13.310 1.00 0.00 H new ATOM 474 N ILE A 31 -2.155 -2.974 11.157 1.00 0.00 N ATOM 475 CA ILE A 31 -0.789 -2.706 10.680 1.00 0.00 C ATOM 476 C ILE A 31 -0.905 -1.465 9.800 1.00 0.00 C ATOM 477 O ILE A 31 -1.476 -1.543 8.713 1.00 0.00 O ATOM 478 CB ILE A 31 -0.119 -3.870 9.899 1.00 0.00 C ATOM 479 CG1 ILE A 31 -0.127 -5.162 10.729 1.00 0.00 C ATOM 480 CG2 ILE A 31 1.320 -3.491 9.492 1.00 0.00 C ATOM 481 CD1 ILE A 31 0.635 -6.375 10.191 1.00 0.00 C ATOM 0 H ILE A 31 -2.868 -2.765 10.458 1.00 0.00 H new ATOM 0 HA ILE A 31 -0.135 -2.571 11.542 1.00 0.00 H new ATOM 0 HB ILE A 31 -0.697 -4.049 8.992 1.00 0.00 H new ATOM 0 HG12 ILE A 31 0.276 -4.927 11.714 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -1.166 -5.459 10.872 1.00 0.00 H new ATOM 0 HG21 ILE A 31 1.774 -4.318 8.946 1.00 0.00 H new ATOM 0 HG22 ILE A 31 1.297 -2.606 8.856 1.00 0.00 H new ATOM 0 HG23 ILE A 31 1.907 -3.281 10.386 1.00 0.00 H new ATOM 0 HD11 ILE A 31 0.534 -7.207 10.889 1.00 0.00 H new ATOM 0 HD12 ILE A 31 0.225 -6.662 9.223 1.00 0.00 H new ATOM 0 HD13 ILE A 31 1.689 -6.122 10.078 1.00 0.00 H new ATOM 493 N LEU A 32 -0.322 -0.341 10.209 1.00 0.00 N ATOM 494 CA LEU A 32 -0.427 0.903 9.457 1.00 0.00 C ATOM 495 C LEU A 32 0.718 0.908 8.430 1.00 0.00 C ATOM 496 O LEU A 32 1.884 0.921 8.827 1.00 0.00 O ATOM 497 CB LEU A 32 -0.364 2.089 10.441 1.00 0.00 C ATOM 498 CG LEU A 32 -0.964 3.417 9.930 1.00 0.00 C ATOM 499 CD1 LEU A 32 -0.873 3.643 8.419 1.00 0.00 C ATOM 500 CD2 LEU A 32 -2.439 3.521 10.338 1.00 0.00 C ATOM 0 H LEU A 32 0.231 -0.268 11.063 1.00 0.00 H new ATOM 0 HA LEU A 32 -1.372 0.993 8.921 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -0.884 1.806 11.356 1.00 0.00 H new ATOM 0 HB3 LEU A 32 0.679 2.262 10.707 1.00 0.00 H new ATOM 0 HG LEU A 32 -0.350 4.187 10.397 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -1.323 4.603 8.167 1.00 0.00 H new ATOM 0 HD12 LEU A 32 0.173 3.641 8.113 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -1.404 2.846 7.899 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -2.852 4.461 9.973 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -2.995 2.688 9.907 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -2.519 3.487 11.425 1.00 0.00 H new ATOM 512 N ILE A 33 0.419 0.856 7.126 1.00 0.00 N ATOM 513 CA ILE A 33 1.435 0.798 6.069 1.00 0.00 C ATOM 514 C ILE A 33 1.778 2.221 5.622 1.00 0.00 C ATOM 515 O ILE A 33 2.928 2.661 5.714 1.00 0.00 O ATOM 516 CB ILE A 33 0.955 -0.062 4.873 1.00 0.00 C ATOM 517 CG1 ILE A 33 0.543 -1.473 5.343 1.00 0.00 C ATOM 518 CG2 ILE A 33 2.048 -0.157 3.790 1.00 0.00 C ATOM 519 CD1 ILE A 33 0.209 -2.404 4.178 1.00 0.00 C ATOM 0 H ILE A 33 -0.538 0.853 6.774 1.00 0.00 H new ATOM 0 HA ILE A 33 2.331 0.321 6.465 1.00 0.00 H new ATOM 0 HB ILE A 33 0.083 0.426 4.439 1.00 0.00 H new ATOM 0 HG12 ILE A 33 1.352 -1.907 5.930 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -0.322 -1.395 6.001 1.00 0.00 H new ATOM 0 HG21 ILE A 33 1.687 -0.766 2.961 1.00 0.00 H new ATOM 0 HG22 ILE A 33 2.289 0.842 3.428 1.00 0.00 H new ATOM 0 HG23 ILE A 33 2.942 -0.615 4.214 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -0.074 -3.383 4.564 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -0.619 -1.987 3.605 1.00 0.00 H new ATOM 0 HD13 ILE A 33 1.082 -2.507 3.533 1.00 0.00 H new ATOM 531 N VAL A 34 0.776 2.928 5.101 1.00 0.00 N ATOM 532 CA VAL A 34 0.885 4.242 4.496 1.00 0.00 C ATOM 533 C VAL A 34 0.060 5.179 5.363 1.00 0.00 C ATOM 534 O VAL A 34 -1.119 4.920 5.598 1.00 0.00 O ATOM 535 CB VAL A 34 0.358 4.224 3.038 1.00 0.00 C ATOM 536 CG1 VAL A 34 0.756 5.500 2.288 1.00 0.00 C ATOM 537 CG2 VAL A 34 0.860 3.043 2.197 1.00 0.00 C ATOM 0 H VAL A 34 -0.181 2.575 5.092 1.00 0.00 H new ATOM 0 HA VAL A 34 1.924 4.568 4.445 1.00 0.00 H new ATOM 0 HB VAL A 34 -0.723 4.137 3.151 1.00 0.00 H new ATOM 0 HG11 VAL A 34 0.372 5.458 1.269 1.00 0.00 H new ATOM 0 HG12 VAL A 34 0.337 6.367 2.798 1.00 0.00 H new ATOM 0 HG13 VAL A 34 1.843 5.584 2.263 1.00 0.00 H new ATOM 0 HG21 VAL A 34 0.443 3.109 1.192 1.00 0.00 H new ATOM 0 HG22 VAL A 34 1.948 3.073 2.141 1.00 0.00 H new ATOM 0 HG23 VAL A 34 0.546 2.107 2.660 1.00 0.00 H new ATOM 547 N SER A 35 0.686 6.229 5.876 1.00 0.00 N ATOM 548 CA SER A 35 0.031 7.296 6.607 1.00 0.00 C ATOM 549 C SER A 35 0.479 8.541 5.866 1.00 0.00 C ATOM 550 O SER A 35 1.682 8.704 5.688 1.00 0.00 O ATOM 551 CB SER A 35 0.362 7.269 8.111 1.00 0.00 C ATOM 552 OG SER A 35 1.715 6.934 8.402 1.00 0.00 O ATOM 0 H SER A 35 1.694 6.362 5.790 1.00 0.00 H new ATOM 0 HA SER A 35 -1.056 7.220 6.625 1.00 0.00 H new ATOM 0 HB2 SER A 35 0.141 8.247 8.538 1.00 0.00 H new ATOM 0 HB3 SER A 35 -0.293 6.550 8.604 1.00 0.00 H new ATOM 0 HG SER A 35 1.760 6.480 9.269 1.00 0.00 H new ATOM 558 N GLU A 36 -0.456 9.305 5.305 1.00 0.00 N ATOM 559 CA GLU A 36 -0.217 10.490 4.494 1.00 0.00 C ATOM 560 C GLU A 36 0.888 10.280 3.434 1.00 0.00 C ATOM 561 O GLU A 36 1.745 11.128 3.218 1.00 0.00 O ATOM 562 CB GLU A 36 -0.151 11.780 5.353 1.00 0.00 C ATOM 563 CG GLU A 36 0.933 11.920 6.445 1.00 0.00 C ATOM 564 CD GLU A 36 0.656 11.240 7.802 1.00 0.00 C ATOM 565 OE1 GLU A 36 -0.397 10.597 8.001 1.00 0.00 O ATOM 566 OE2 GLU A 36 1.549 11.298 8.681 1.00 0.00 O ATOM 0 H GLU A 36 -1.450 9.101 5.411 1.00 0.00 H new ATOM 0 HA GLU A 36 -1.092 10.664 3.867 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -0.034 12.621 4.669 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -1.120 11.897 5.839 1.00 0.00 H new ATOM 0 HG2 GLU A 36 1.866 11.518 6.049 1.00 0.00 H new ATOM 0 HG3 GLU A 36 1.095 12.983 6.626 1.00 0.00 H new ATOM 573 N GLY A 37 0.885 9.115 2.766 1.00 0.00 N ATOM 574 CA GLY A 37 1.844 8.715 1.711 1.00 0.00 C ATOM 575 C GLY A 37 3.246 8.315 2.217 1.00 0.00 C ATOM 576 O GLY A 37 3.955 7.518 1.608 1.00 0.00 O ATOM 0 H GLY A 37 0.188 8.393 2.950 1.00 0.00 H new ATOM 0 HA2 GLY A 37 1.422 7.876 1.157 1.00 0.00 H new ATOM 0 HA3 GLY A 37 1.951 9.540 1.007 1.00 0.00 H new ATOM 580 N LYS A 38 3.590 8.828 3.386 1.00 0.00 N ATOM 581 CA LYS A 38 4.700 8.710 4.335 1.00 0.00 C ATOM 582 C LYS A 38 5.060 7.291 4.822 1.00 0.00 C ATOM 583 O LYS A 38 5.301 7.075 6.007 1.00 0.00 O ATOM 584 CB LYS A 38 4.554 9.907 5.309 1.00 0.00 C ATOM 585 CG LYS A 38 5.168 9.917 6.720 1.00 0.00 C ATOM 586 CD LYS A 38 4.032 9.396 7.620 1.00 0.00 C ATOM 587 CE LYS A 38 4.213 9.471 9.130 1.00 0.00 C ATOM 588 NZ LYS A 38 2.894 9.248 9.760 1.00 0.00 N ATOM 0 H LYS A 38 2.934 9.500 3.784 1.00 0.00 H new ATOM 0 HA LYS A 38 5.678 8.816 3.866 1.00 0.00 H new ATOM 0 HB2 LYS A 38 4.954 10.778 4.791 1.00 0.00 H new ATOM 0 HB3 LYS A 38 3.484 10.075 5.435 1.00 0.00 H new ATOM 0 HG2 LYS A 38 6.049 9.277 6.777 1.00 0.00 H new ATOM 0 HG3 LYS A 38 5.482 10.919 7.012 1.00 0.00 H new ATOM 0 HD2 LYS A 38 3.127 9.948 7.366 1.00 0.00 H new ATOM 0 HD3 LYS A 38 3.853 8.353 7.358 1.00 0.00 H new ATOM 0 HE2 LYS A 38 4.928 8.720 9.466 1.00 0.00 H new ATOM 0 HE3 LYS A 38 4.613 10.443 9.418 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 3.023 9.042 10.771 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 2.309 10.101 9.653 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 2.421 8.444 9.300 1.00 0.00 H new ATOM 602 N MET A 39 4.978 6.287 3.944 1.00 0.00 N ATOM 603 CA MET A 39 5.250 4.881 4.252 1.00 0.00 C ATOM 604 C MET A 39 6.416 4.646 5.213 1.00 0.00 C ATOM 605 O MET A 39 7.529 5.144 5.034 1.00 0.00 O ATOM 606 CB MET A 39 5.646 4.110 2.980 1.00 0.00 C ATOM 607 CG MET A 39 4.473 3.669 2.127 1.00 0.00 C ATOM 608 SD MET A 39 4.997 2.720 0.676 1.00 0.00 S ATOM 609 CE MET A 39 3.399 2.142 0.055 1.00 0.00 C ATOM 0 H MET A 39 4.713 6.435 2.970 1.00 0.00 H new ATOM 0 HA MET A 39 4.320 4.541 4.707 1.00 0.00 H new ATOM 0 HB2 MET A 39 6.302 4.739 2.378 1.00 0.00 H new ATOM 0 HB3 MET A 39 6.222 3.231 3.267 1.00 0.00 H new ATOM 0 HG2 MET A 39 3.796 3.063 2.729 1.00 0.00 H new ATOM 0 HG3 MET A 39 3.913 4.546 1.802 1.00 0.00 H new ATOM 0 HE1 MET A 39 3.488 1.892 -1.002 1.00 0.00 H new ATOM 0 HE2 MET A 39 3.090 1.258 0.612 1.00 0.00 H new ATOM 0 HE3 MET A 39 2.654 2.928 0.180 1.00 0.00 H new ATOM 619 N ALA A 40 6.128 3.836 6.229 1.00 0.00 N ATOM 620 CA ALA A 40 7.100 3.344 7.190 1.00 0.00 C ATOM 621 C ALA A 40 7.955 2.291 6.464 1.00 0.00 C ATOM 622 O ALA A 40 7.568 1.795 5.407 1.00 0.00 O ATOM 623 CB ALA A 40 6.304 2.725 8.353 1.00 0.00 C ATOM 0 H ALA A 40 5.183 3.497 6.408 1.00 0.00 H new ATOM 0 HA ALA A 40 7.755 4.121 7.583 1.00 0.00 H new ATOM 0 HB1 ALA A 40 6.995 2.340 9.103 1.00 0.00 H new ATOM 0 HB2 ALA A 40 5.667 3.486 8.803 1.00 0.00 H new ATOM 0 HB3 ALA A 40 5.686 1.910 7.977 1.00 0.00 H new ATOM 629 N PRO A 41 9.084 1.854 7.035 1.00 0.00 N ATOM 630 CA PRO A 41 9.908 0.764 6.499 1.00 0.00 C ATOM 631 C PRO A 41 9.242 -0.619 6.716 1.00 0.00 C ATOM 632 O PRO A 41 9.919 -1.630 6.917 1.00 0.00 O ATOM 633 CB PRO A 41 11.266 0.941 7.196 1.00 0.00 C ATOM 634 CG PRO A 41 10.926 1.651 8.509 1.00 0.00 C ATOM 635 CD PRO A 41 9.708 2.485 8.181 1.00 0.00 C ATOM 0 HA PRO A 41 10.029 0.803 5.416 1.00 0.00 H new ATOM 0 HB2 PRO A 41 11.749 -0.019 7.376 1.00 0.00 H new ATOM 0 HB3 PRO A 41 11.951 1.533 6.589 1.00 0.00 H new ATOM 0 HG2 PRO A 41 10.716 0.936 9.304 1.00 0.00 H new ATOM 0 HG3 PRO A 41 11.753 2.273 8.850 1.00 0.00 H new ATOM 0 HD2 PRO A 41 9.022 2.522 9.027 1.00 0.00 H new ATOM 0 HD3 PRO A 41 9.990 3.513 7.954 1.00 0.00 H new ATOM 643 N PHE A 42 7.907 -0.673 6.654 1.00 0.00 N ATOM 644 CA PHE A 42 7.043 -1.809 6.945 1.00 0.00 C ATOM 645 C PHE A 42 7.377 -3.071 6.160 1.00 0.00 C ATOM 646 O PHE A 42 7.141 -4.175 6.636 1.00 0.00 O ATOM 647 CB PHE A 42 5.590 -1.411 6.570 1.00 0.00 C ATOM 648 CG PHE A 42 5.277 -1.510 5.072 1.00 0.00 C ATOM 649 CD1 PHE A 42 5.508 -0.432 4.194 1.00 0.00 C ATOM 650 CD2 PHE A 42 4.840 -2.735 4.529 1.00 0.00 C ATOM 651 CE1 PHE A 42 5.361 -0.593 2.805 1.00 0.00 C ATOM 652 CE2 PHE A 42 4.697 -2.902 3.138 1.00 0.00 C ATOM 653 CZ PHE A 42 4.970 -1.832 2.271 1.00 0.00 C ATOM 0 H PHE A 42 7.365 0.145 6.376 1.00 0.00 H new ATOM 0 HA PHE A 42 7.179 -2.039 8.002 1.00 0.00 H new ATOM 0 HB2 PHE A 42 4.897 -2.051 7.117 1.00 0.00 H new ATOM 0 HB3 PHE A 42 5.409 -0.388 6.901 1.00 0.00 H new ATOM 0 HD1 PHE A 42 5.801 0.528 4.592 1.00 0.00 H new ATOM 0 HD2 PHE A 42 4.611 -3.558 5.190 1.00 0.00 H new ATOM 0 HE1 PHE A 42 5.550 0.241 2.145 1.00 0.00 H new ATOM 0 HE2 PHE A 42 4.377 -3.853 2.738 1.00 0.00 H new ATOM 0 HZ PHE A 42 4.880 -1.960 1.202 1.00 0.00 H new ATOM 663 N THR A 43 7.974 -2.919 4.984 1.00 0.00 N ATOM 664 CA THR A 43 8.229 -3.996 4.047 1.00 0.00 C ATOM 665 C THR A 43 9.177 -5.051 4.623 1.00 0.00 C ATOM 666 O THR A 43 9.040 -6.239 4.313 1.00 0.00 O ATOM 667 CB THR A 43 8.788 -3.360 2.768 1.00 0.00 C ATOM 668 OG1 THR A 43 8.127 -2.137 2.508 1.00 0.00 O ATOM 669 CG2 THR A 43 8.539 -4.264 1.559 1.00 0.00 C ATOM 0 H THR A 43 8.303 -2.013 4.650 1.00 0.00 H new ATOM 0 HA THR A 43 7.305 -4.532 3.831 1.00 0.00 H new ATOM 0 HB THR A 43 9.857 -3.209 2.919 1.00 0.00 H new ATOM 0 HG1 THR A 43 7.157 -2.276 2.542 1.00 0.00 H new ATOM 0 HG21 THR A 43 8.944 -3.793 0.663 1.00 0.00 H new ATOM 0 HG22 THR A 43 9.028 -5.225 1.716 1.00 0.00 H new ATOM 0 HG23 THR A 43 7.467 -4.419 1.435 1.00 0.00 H new ATOM 677 N HIS A 44 10.120 -4.631 5.477 1.00 0.00 N ATOM 678 CA HIS A 44 11.024 -5.560 6.132 1.00 0.00 C ATOM 679 C HIS A 44 10.212 -6.548 6.965 1.00 0.00 C ATOM 680 O HIS A 44 10.399 -7.761 6.832 1.00 0.00 O ATOM 681 CB HIS A 44 12.055 -4.815 6.990 1.00 0.00 C ATOM 682 CG HIS A 44 12.983 -5.765 7.708 1.00 0.00 C ATOM 683 ND1 HIS A 44 13.737 -6.756 7.117 1.00 0.00 N ATOM 684 CD2 HIS A 44 13.149 -5.867 9.063 1.00 0.00 C ATOM 685 CE1 HIS A 44 14.343 -7.444 8.099 1.00 0.00 C ATOM 686 NE2 HIS A 44 14.002 -6.954 9.301 1.00 0.00 N ATOM 0 H HIS A 44 10.269 -3.653 5.724 1.00 0.00 H new ATOM 0 HA HIS A 44 11.582 -6.112 5.376 1.00 0.00 H new ATOM 0 HB2 HIS A 44 12.639 -4.147 6.357 1.00 0.00 H new ATOM 0 HB3 HIS A 44 11.538 -4.192 7.720 1.00 0.00 H new ATOM 0 HD2 HIS A 44 12.705 -5.228 9.811 1.00 0.00 H new ATOM 0 HE1 HIS A 44 15.013 -8.277 7.943 1.00 0.00 H new ATOM 0 HE2 HIS A 44 14.304 -7.304 10.210 1.00 0.00 H new ATOM 694 N ASP A 45 9.320 -6.035 7.814 1.00 0.00 N ATOM 695 CA ASP A 45 8.518 -6.883 8.683 1.00 0.00 C ATOM 696 C ASP A 45 7.384 -7.574 7.934 1.00 0.00 C ATOM 697 O ASP A 45 7.043 -8.709 8.242 1.00 0.00 O ATOM 698 CB ASP A 45 8.170 -6.223 10.024 1.00 0.00 C ATOM 699 CG ASP A 45 9.379 -6.385 10.957 1.00 0.00 C ATOM 700 OD1 ASP A 45 10.438 -5.789 10.659 1.00 0.00 O ATOM 701 OD2 ASP A 45 9.375 -7.286 11.826 1.00 0.00 O ATOM 0 H ASP A 45 9.138 -5.036 7.915 1.00 0.00 H new ATOM 0 HA ASP A 45 9.143 -7.717 9.003 1.00 0.00 H new ATOM 0 HB2 ASP A 45 7.937 -5.168 9.881 1.00 0.00 H new ATOM 0 HB3 ASP A 45 7.286 -6.688 10.460 1.00 0.00 H new ATOM 706 N PHE A 46 6.873 -6.970 6.864 1.00 0.00 N ATOM 707 CA PHE A 46 5.885 -7.596 5.991 1.00 0.00 C ATOM 708 C PHE A 46 6.460 -8.925 5.490 1.00 0.00 C ATOM 709 O PHE A 46 5.799 -9.961 5.539 1.00 0.00 O ATOM 710 CB PHE A 46 5.583 -6.627 4.842 1.00 0.00 C ATOM 711 CG PHE A 46 4.384 -6.914 3.960 1.00 0.00 C ATOM 712 CD1 PHE A 46 4.381 -8.005 3.068 1.00 0.00 C ATOM 713 CD2 PHE A 46 3.310 -6.003 3.944 1.00 0.00 C ATOM 714 CE1 PHE A 46 3.336 -8.147 2.139 1.00 0.00 C ATOM 715 CE2 PHE A 46 2.287 -6.125 2.993 1.00 0.00 C ATOM 716 CZ PHE A 46 2.312 -7.187 2.080 1.00 0.00 C ATOM 0 H PHE A 46 7.135 -6.027 6.577 1.00 0.00 H new ATOM 0 HA PHE A 46 4.952 -7.807 6.513 1.00 0.00 H new ATOM 0 HB2 PHE A 46 5.451 -5.633 5.270 1.00 0.00 H new ATOM 0 HB3 PHE A 46 6.464 -6.584 4.202 1.00 0.00 H new ATOM 0 HD1 PHE A 46 5.180 -8.731 3.098 1.00 0.00 H new ATOM 0 HD2 PHE A 46 3.274 -5.204 4.670 1.00 0.00 H new ATOM 0 HE1 PHE A 46 3.320 -8.995 1.470 1.00 0.00 H new ATOM 0 HE2 PHE A 46 1.484 -5.404 2.965 1.00 0.00 H new ATOM 0 HZ PHE A 46 1.541 -7.268 1.328 1.00 0.00 H new ATOM 726 N ARG A 47 7.722 -8.905 5.038 1.00 0.00 N ATOM 727 CA ARG A 47 8.389 -10.109 4.560 1.00 0.00 C ATOM 728 C ARG A 47 8.852 -11.018 5.714 1.00 0.00 C ATOM 729 O ARG A 47 8.879 -12.234 5.529 1.00 0.00 O ATOM 730 CB ARG A 47 9.545 -9.689 3.641 1.00 0.00 C ATOM 731 CG ARG A 47 9.984 -10.822 2.703 1.00 0.00 C ATOM 732 CD ARG A 47 11.077 -10.306 1.760 1.00 0.00 C ATOM 733 NE ARG A 47 11.470 -11.305 0.750 1.00 0.00 N ATOM 734 CZ ARG A 47 11.002 -11.379 -0.504 1.00 0.00 C ATOM 735 NH1 ARG A 47 10.016 -10.592 -0.919 1.00 0.00 N ATOM 736 NH2 ARG A 47 11.517 -12.268 -1.353 1.00 0.00 N ATOM 0 H ARG A 47 8.296 -8.063 4.996 1.00 0.00 H new ATOM 0 HA ARG A 47 7.682 -10.714 3.992 1.00 0.00 H new ATOM 0 HB2 ARG A 47 9.240 -8.827 3.048 1.00 0.00 H new ATOM 0 HB3 ARG A 47 10.393 -9.374 4.249 1.00 0.00 H new ATOM 0 HG2 ARG A 47 10.357 -11.666 3.283 1.00 0.00 H new ATOM 0 HG3 ARG A 47 9.132 -11.183 2.127 1.00 0.00 H new ATOM 0 HD2 ARG A 47 10.723 -9.406 1.257 1.00 0.00 H new ATOM 0 HD3 ARG A 47 11.952 -10.022 2.345 1.00 0.00 H new ATOM 0 HE ARG A 47 12.160 -12.002 1.030 1.00 0.00 H new ATOM 0 HH11 ARG A 47 9.600 -9.915 -0.279 1.00 0.00 H new ATOM 0 HH12 ARG A 47 9.675 -10.664 -1.877 1.00 0.00 H new ATOM 0 HH21 ARG A 47 12.266 -12.890 -1.048 1.00 0.00 H new ATOM 0 HH22 ARG A 47 11.163 -12.326 -2.308 1.00 0.00 H new ATOM 750 N LYS A 48 9.296 -10.484 6.863 1.00 0.00 N ATOM 751 CA LYS A 48 9.728 -11.262 8.035 1.00 0.00 C ATOM 752 C LYS A 48 8.965 -10.782 9.263 1.00 0.00 C ATOM 753 O LYS A 48 9.324 -9.727 9.758 1.00 0.00 O ATOM 754 CB LYS A 48 11.251 -11.026 8.185 1.00 0.00 C ATOM 755 CG LYS A 48 11.959 -11.645 9.412 1.00 0.00 C ATOM 756 CD LYS A 48 11.952 -10.882 10.762 1.00 0.00 C ATOM 757 CE LYS A 48 12.536 -9.452 10.740 1.00 0.00 C ATOM 758 NZ LYS A 48 11.527 -8.391 10.527 1.00 0.00 N ATOM 0 H LYS A 48 9.366 -9.477 7.006 1.00 0.00 H new ATOM 0 HA LYS A 48 9.526 -12.327 7.921 1.00 0.00 H new ATOM 0 HB2 LYS A 48 11.739 -11.408 7.289 1.00 0.00 H new ATOM 0 HB3 LYS A 48 11.423 -9.950 8.207 1.00 0.00 H new ATOM 0 HG2 LYS A 48 11.513 -12.624 9.588 1.00 0.00 H new ATOM 0 HG3 LYS A 48 13.000 -11.814 9.138 1.00 0.00 H new ATOM 0 HD2 LYS A 48 10.924 -10.827 11.119 1.00 0.00 H new ATOM 0 HD3 LYS A 48 12.511 -11.469 11.490 1.00 0.00 H new ATOM 0 HE2 LYS A 48 13.049 -9.266 11.683 1.00 0.00 H new ATOM 0 HE3 LYS A 48 13.286 -9.389 9.951 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 11.623 -8.009 9.564 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 10.574 -8.789 10.649 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 11.674 -7.628 11.218 1.00 0.00 H new ATOM 772 N ALA A 49 8.083 -11.565 9.881 1.00 0.00 N ATOM 773 CA ALA A 49 7.349 -11.177 11.089 1.00 0.00 C ATOM 774 C ALA A 49 6.510 -12.356 11.563 1.00 0.00 C ATOM 775 O ALA A 49 6.544 -13.434 10.965 1.00 0.00 O ATOM 776 CB ALA A 49 6.430 -9.964 10.859 1.00 0.00 C ATOM 0 H ALA A 49 7.853 -12.503 9.553 1.00 0.00 H new ATOM 0 HA ALA A 49 8.084 -10.892 11.841 1.00 0.00 H new ATOM 0 HB1 ALA A 49 5.911 -9.720 11.786 1.00 0.00 H new ATOM 0 HB2 ALA A 49 7.028 -9.109 10.542 1.00 0.00 H new ATOM 0 HB3 ALA A 49 5.699 -10.202 10.086 1.00 0.00 H new ATOM 782 N GLN A 50 5.837 -12.154 12.700 1.00 0.00 N ATOM 783 CA GLN A 50 4.866 -13.076 13.269 1.00 0.00 C ATOM 784 C GLN A 50 3.858 -13.436 12.161 1.00 0.00 C ATOM 785 O GLN A 50 3.637 -12.656 11.235 1.00 0.00 O ATOM 786 CB GLN A 50 4.210 -12.366 14.477 1.00 0.00 C ATOM 787 CG GLN A 50 2.986 -13.031 15.136 1.00 0.00 C ATOM 788 CD GLN A 50 3.277 -14.412 15.722 1.00 0.00 C ATOM 789 OE1 GLN A 50 3.705 -15.317 15.016 1.00 0.00 O ATOM 790 NE2 GLN A 50 3.035 -14.619 17.005 1.00 0.00 N ATOM 0 H GLN A 50 5.962 -11.313 13.264 1.00 0.00 H new ATOM 0 HA GLN A 50 5.311 -14.005 13.625 1.00 0.00 H new ATOM 0 HB2 GLN A 50 4.974 -12.240 15.244 1.00 0.00 H new ATOM 0 HB3 GLN A 50 3.914 -11.368 14.156 1.00 0.00 H new ATOM 0 HG2 GLN A 50 2.613 -12.381 15.928 1.00 0.00 H new ATOM 0 HG3 GLN A 50 2.190 -13.120 14.396 1.00 0.00 H new ATOM 0 HE21 GLN A 50 2.679 -13.860 17.586 1.00 0.00 H new ATOM 0 HE22 GLN A 50 3.205 -15.538 17.414 1.00 0.00 H new ATOM 799 N GLN A 51 3.175 -14.569 12.321 1.00 0.00 N ATOM 800 CA GLN A 51 2.262 -15.205 11.372 1.00 0.00 C ATOM 801 C GLN A 51 1.299 -14.220 10.683 1.00 0.00 C ATOM 802 O GLN A 51 0.985 -14.401 9.513 1.00 0.00 O ATOM 803 CB GLN A 51 1.538 -16.322 12.159 1.00 0.00 C ATOM 804 CG GLN A 51 0.895 -17.454 11.343 1.00 0.00 C ATOM 805 CD GLN A 51 -0.579 -17.218 11.017 1.00 0.00 C ATOM 806 OE1 GLN A 51 -1.455 -17.832 11.611 1.00 0.00 O ATOM 807 NE2 GLN A 51 -0.902 -16.344 10.083 1.00 0.00 N ATOM 0 H GLN A 51 3.252 -15.107 13.184 1.00 0.00 H new ATOM 0 HA GLN A 51 2.817 -15.622 10.531 1.00 0.00 H new ATOM 0 HB2 GLN A 51 2.255 -16.768 12.849 1.00 0.00 H new ATOM 0 HB3 GLN A 51 0.759 -15.858 12.765 1.00 0.00 H new ATOM 0 HG2 GLN A 51 1.448 -17.578 10.412 1.00 0.00 H new ATOM 0 HG3 GLN A 51 0.990 -18.388 11.897 1.00 0.00 H new ATOM 0 HE21 GLN A 51 -0.171 -15.833 9.588 1.00 0.00 H new ATOM 0 HE22 GLN A 51 -1.883 -16.180 9.856 1.00 0.00 H new ATOM 816 N ARG A 52 0.866 -13.150 11.354 1.00 0.00 N ATOM 817 CA ARG A 52 -0.044 -12.146 10.804 1.00 0.00 C ATOM 818 C ARG A 52 0.448 -11.443 9.522 1.00 0.00 C ATOM 819 O ARG A 52 -0.375 -10.767 8.912 1.00 0.00 O ATOM 820 CB ARG A 52 -0.404 -11.158 11.932 1.00 0.00 C ATOM 821 CG ARG A 52 -1.503 -10.143 11.565 1.00 0.00 C ATOM 822 CD ARG A 52 -2.156 -9.520 12.803 1.00 0.00 C ATOM 823 NE ARG A 52 -1.183 -8.854 13.682 1.00 0.00 N ATOM 824 CZ ARG A 52 -0.868 -7.555 13.700 1.00 0.00 C ATOM 825 NH1 ARG A 52 -1.530 -6.692 12.945 1.00 0.00 N ATOM 826 NH2 ARG A 52 0.066 -7.105 14.527 1.00 0.00 N ATOM 0 H ARG A 52 1.145 -12.955 12.315 1.00 0.00 H new ATOM 0 HA ARG A 52 -0.938 -12.663 10.455 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -0.727 -11.725 12.805 1.00 0.00 H new ATOM 0 HB3 ARG A 52 0.495 -10.613 12.221 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -1.074 -9.354 10.947 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -2.266 -10.638 10.965 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -2.909 -8.798 12.487 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -2.675 -10.296 13.365 1.00 0.00 H new ATOM 0 HE ARG A 52 -0.695 -9.449 14.352 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -2.287 -7.017 12.343 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -1.283 -5.703 12.965 1.00 0.00 H new ATOM 0 HH21 ARG A 52 0.547 -7.751 15.153 1.00 0.00 H new ATOM 0 HH22 ARG A 52 0.303 -6.113 14.537 1.00 0.00 H new ATOM 840 N MET A 53 1.711 -11.574 9.085 1.00 0.00 N ATOM 841 CA MET A 53 2.147 -10.996 7.806 1.00 0.00 C ATOM 842 C MET A 53 2.670 -12.019 6.789 1.00 0.00 C ATOM 843 O MET A 53 1.971 -12.213 5.798 1.00 0.00 O ATOM 844 CB MET A 53 3.132 -9.838 8.040 1.00 0.00 C ATOM 845 CG MET A 53 2.432 -8.523 8.387 1.00 0.00 C ATOM 846 SD MET A 53 2.266 -7.344 7.012 1.00 0.00 S ATOM 847 CE MET A 53 1.396 -8.332 5.761 1.00 0.00 C ATOM 0 H MET A 53 2.442 -12.071 9.594 1.00 0.00 H new ATOM 0 HA MET A 53 1.250 -10.594 7.335 1.00 0.00 H new ATOM 0 HB2 MET A 53 3.814 -10.105 8.847 1.00 0.00 H new ATOM 0 HB3 MET A 53 3.738 -9.696 7.145 1.00 0.00 H new ATOM 0 HG2 MET A 53 1.438 -8.750 8.771 1.00 0.00 H new ATOM 0 HG3 MET A 53 2.982 -8.039 9.194 1.00 0.00 H new ATOM 0 HE1 MET A 53 1.045 -7.679 4.962 1.00 0.00 H new ATOM 0 HE2 MET A 53 2.076 -9.077 5.348 1.00 0.00 H new ATOM 0 HE3 MET A 53 0.544 -8.833 6.221 1.00 0.00 H new ATOM 857 N PRO A 54 3.808 -12.718 6.981 1.00 0.00 N ATOM 858 CA PRO A 54 4.335 -13.579 5.929 1.00 0.00 C ATOM 859 C PRO A 54 3.564 -14.891 5.784 1.00 0.00 C ATOM 860 O PRO A 54 2.909 -15.105 4.770 1.00 0.00 O ATOM 861 CB PRO A 54 5.815 -13.793 6.262 1.00 0.00 C ATOM 862 CG PRO A 54 5.888 -13.571 7.769 1.00 0.00 C ATOM 863 CD PRO A 54 4.824 -12.502 7.998 1.00 0.00 C ATOM 0 HA PRO A 54 4.219 -13.108 4.953 1.00 0.00 H new ATOM 0 HB2 PRO A 54 6.145 -14.796 5.989 1.00 0.00 H new ATOM 0 HB3 PRO A 54 6.451 -13.091 5.723 1.00 0.00 H new ATOM 0 HG2 PRO A 54 5.672 -14.484 8.324 1.00 0.00 H new ATOM 0 HG3 PRO A 54 6.876 -13.234 8.082 1.00 0.00 H new ATOM 0 HD2 PRO A 54 4.398 -12.585 8.998 1.00 0.00 H new ATOM 0 HD3 PRO A 54 5.252 -11.503 7.915 1.00 0.00 H new ATOM 871 N ALA A 55 3.718 -15.806 6.746 1.00 0.00 N ATOM 872 CA ALA A 55 3.153 -17.145 6.682 1.00 0.00 C ATOM 873 C ALA A 55 1.655 -17.098 6.996 1.00 0.00 C ATOM 874 O ALA A 55 1.266 -16.860 8.136 1.00 0.00 O ATOM 875 CB ALA A 55 3.891 -18.058 7.669 1.00 0.00 C ATOM 0 H ALA A 55 4.247 -15.629 7.600 1.00 0.00 H new ATOM 0 HA ALA A 55 3.276 -17.546 5.676 1.00 0.00 H new ATOM 0 HB1 ALA A 55 3.468 -19.062 7.622 1.00 0.00 H new ATOM 0 HB2 ALA A 55 4.949 -18.097 7.408 1.00 0.00 H new ATOM 0 HB3 ALA A 55 3.781 -17.665 8.680 1.00 0.00 H new ATOM 881 N ILE A 56 0.820 -17.406 6.015 1.00 0.00 N ATOM 882 CA ILE A 56 -0.630 -17.413 6.069 1.00 0.00 C ATOM 883 C ILE A 56 -1.045 -18.887 6.016 1.00 0.00 C ATOM 884 O ILE A 56 -0.719 -19.570 5.046 1.00 0.00 O ATOM 885 CB ILE A 56 -1.184 -16.589 4.887 1.00 0.00 C ATOM 886 CG1 ILE A 56 -0.774 -15.102 5.011 1.00 0.00 C ATOM 887 CG2 ILE A 56 -2.716 -16.710 4.812 1.00 0.00 C ATOM 888 CD1 ILE A 56 -1.022 -14.302 3.730 1.00 0.00 C ATOM 0 H ILE A 56 1.166 -17.677 5.094 1.00 0.00 H new ATOM 0 HA ILE A 56 -1.029 -16.955 6.974 1.00 0.00 H new ATOM 0 HB ILE A 56 -0.756 -16.991 3.969 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -1.329 -14.645 5.831 1.00 0.00 H new ATOM 0 HG13 ILE A 56 0.283 -15.043 5.270 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -3.087 -16.122 3.972 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -2.992 -17.755 4.673 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -3.156 -16.339 5.737 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -0.714 -13.267 3.882 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -0.446 -14.736 2.913 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -2.083 -14.332 3.482 1.00 0.00 H new ATOM 900 N PRO A 57 -1.736 -19.434 7.025 1.00 0.00 N ATOM 901 CA PRO A 57 -2.168 -20.818 6.993 1.00 0.00 C ATOM 902 C PRO A 57 -3.343 -20.963 6.027 1.00 0.00 C ATOM 903 O PRO A 57 -4.125 -20.029 5.849 1.00 0.00 O ATOM 904 CB PRO A 57 -2.592 -21.128 8.428 1.00 0.00 C ATOM 905 CG PRO A 57 -3.106 -19.781 8.944 1.00 0.00 C ATOM 906 CD PRO A 57 -2.228 -18.765 8.211 1.00 0.00 C ATOM 0 HA PRO A 57 -1.390 -21.500 6.651 1.00 0.00 H new ATOM 0 HB2 PRO A 57 -3.367 -21.894 8.462 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -1.756 -21.494 9.024 1.00 0.00 H new ATOM 0 HG2 PRO A 57 -4.162 -19.639 8.715 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -3.000 -19.698 10.026 1.00 0.00 H new ATOM 0 HD2 PRO A 57 -2.800 -17.876 7.947 1.00 0.00 H new ATOM 0 HD3 PRO A 57 -1.403 -18.437 8.843 1.00 0.00 H new ATOM 914 N VAL A 58 -3.533 -22.175 5.508 1.00 0.00 N ATOM 915 CA VAL A 58 -4.643 -22.595 4.659 1.00 0.00 C ATOM 916 C VAL A 58 -5.997 -22.037 5.136 1.00 0.00 C ATOM 917 O VAL A 58 -6.778 -21.560 4.312 1.00 0.00 O ATOM 918 CB VAL A 58 -4.583 -24.139 4.536 1.00 0.00 C ATOM 919 CG1 VAL A 58 -4.882 -24.892 5.842 1.00 0.00 C ATOM 920 CG2 VAL A 58 -5.448 -24.656 3.387 1.00 0.00 C ATOM 0 H VAL A 58 -2.875 -22.935 5.681 1.00 0.00 H new ATOM 0 HA VAL A 58 -4.545 -22.170 3.660 1.00 0.00 H new ATOM 0 HB VAL A 58 -3.541 -24.358 4.305 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -4.818 -25.966 5.666 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -4.155 -24.605 6.602 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -5.885 -24.640 6.186 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -5.376 -25.743 3.338 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -6.486 -24.368 3.555 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -5.100 -24.226 2.448 1.00 0.00 H new ATOM 930 N ASN A 59 -6.223 -22.051 6.459 1.00 0.00 N ATOM 931 CA ASN A 59 -7.428 -21.591 7.149 1.00 0.00 C ATOM 932 C ASN A 59 -7.780 -20.138 6.836 1.00 0.00 C ATOM 933 O ASN A 59 -8.953 -19.815 6.665 1.00 0.00 O ATOM 934 CB ASN A 59 -7.243 -21.745 8.667 1.00 0.00 C ATOM 935 CG ASN A 59 -8.488 -21.277 9.417 1.00 0.00 C ATOM 936 OD1 ASN A 59 -9.491 -21.972 9.437 1.00 0.00 O ATOM 937 ND2 ASN A 59 -8.448 -20.122 10.065 1.00 0.00 N ATOM 0 H ASN A 59 -5.524 -22.406 7.111 1.00 0.00 H new ATOM 0 HA ASN A 59 -8.251 -22.210 6.790 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -7.038 -22.788 8.909 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -6.378 -21.167 8.993 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -9.263 -19.803 10.590 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -7.603 -19.552 10.039 1.00 0.00 H new ATOM 944 N ILE A 60 -6.790 -19.240 6.798 1.00 0.00 N ATOM 945 CA ILE A 60 -7.055 -17.873 6.376 1.00 0.00 C ATOM 946 C ILE A 60 -7.215 -18.042 4.866 1.00 0.00 C ATOM 947 O ILE A 60 -6.262 -18.325 4.136 1.00 0.00 O ATOM 948 CB ILE A 60 -5.871 -16.982 6.839 1.00 0.00 C ATOM 949 CG1 ILE A 60 -5.787 -16.843 8.384 1.00 0.00 C ATOM 950 CG2 ILE A 60 -5.855 -15.600 6.178 1.00 0.00 C ATOM 951 CD1 ILE A 60 -6.574 -15.692 9.037 1.00 0.00 C ATOM 0 H ILE A 60 -5.821 -19.434 7.049 1.00 0.00 H new ATOM 0 HA ILE A 60 -7.931 -17.376 6.793 1.00 0.00 H new ATOM 0 HB ILE A 60 -4.982 -17.514 6.502 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -6.131 -17.779 8.825 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -4.737 -16.729 8.655 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -5.002 -15.030 6.547 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -5.775 -15.715 5.097 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -6.777 -15.071 6.419 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -6.425 -15.715 10.116 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -6.220 -14.740 8.642 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -7.635 -15.805 8.815 1.00 0.00 H new ATOM 963 N HIS A 61 -8.433 -17.819 4.378 1.00 0.00 N ATOM 964 CA HIS A 61 -8.697 -17.908 2.954 1.00 0.00 C ATOM 965 C HIS A 61 -8.163 -16.661 2.269 1.00 0.00 C ATOM 966 O HIS A 61 -7.618 -16.752 1.173 1.00 0.00 O ATOM 967 CB HIS A 61 -10.190 -18.066 2.670 1.00 0.00 C ATOM 968 CG HIS A 61 -10.457 -18.201 1.189 1.00 0.00 C ATOM 969 ND1 HIS A 61 -10.553 -17.158 0.292 1.00 0.00 N ATOM 970 CD2 HIS A 61 -10.488 -19.368 0.473 1.00 0.00 C ATOM 971 CE1 HIS A 61 -10.637 -17.689 -0.940 1.00 0.00 C ATOM 972 NE2 HIS A 61 -10.596 -19.030 -0.879 1.00 0.00 N ATOM 0 H HIS A 61 -9.244 -17.577 4.947 1.00 0.00 H new ATOM 0 HA HIS A 61 -8.193 -18.792 2.563 1.00 0.00 H new ATOM 0 HB2 HIS A 61 -10.570 -18.944 3.192 1.00 0.00 H new ATOM 0 HB3 HIS A 61 -10.730 -17.204 3.062 1.00 0.00 H new ATOM 0 HD1 HIS A 61 -10.559 -16.164 0.522 1.00 0.00 H new ATOM 0 HD2 HIS A 61 -10.438 -20.368 0.879 1.00 0.00 H new ATOM 0 HE1 HIS A 61 -10.725 -17.117 -1.852 1.00 0.00 H new ATOM 980 N SER A 62 -8.275 -15.528 2.952 1.00 0.00 N ATOM 981 CA SER A 62 -7.961 -14.208 2.439 1.00 0.00 C ATOM 982 C SER A 62 -7.468 -13.316 3.569 1.00 0.00 C ATOM 983 O SER A 62 -7.730 -13.637 4.728 1.00 0.00 O ATOM 984 CB SER A 62 -9.292 -13.583 1.986 1.00 0.00 C ATOM 985 OG SER A 62 -10.180 -14.411 1.245 1.00 0.00 O ATOM 0 H SER A 62 -8.601 -15.508 3.918 1.00 0.00 H new ATOM 0 HA SER A 62 -7.215 -14.289 1.649 1.00 0.00 H new ATOM 0 HB2 SER A 62 -9.819 -13.231 2.873 1.00 0.00 H new ATOM 0 HB3 SER A 62 -9.064 -12.705 1.381 1.00 0.00 H new ATOM 0 HG SER A 62 -11.038 -13.951 1.131 1.00 0.00 H new ATOM 991 N MET A 63 -6.794 -12.211 3.248 1.00 0.00 N ATOM 992 CA MET A 63 -6.405 -11.206 4.229 1.00 0.00 C ATOM 993 C MET A 63 -7.121 -9.935 3.815 1.00 0.00 C ATOM 994 O MET A 63 -7.280 -9.667 2.624 1.00 0.00 O ATOM 995 CB MET A 63 -4.909 -10.923 4.364 1.00 0.00 C ATOM 996 CG MET A 63 -4.090 -12.130 4.837 1.00 0.00 C ATOM 997 SD MET A 63 -3.105 -11.873 6.335 1.00 0.00 S ATOM 998 CE MET A 63 -1.816 -10.786 5.665 1.00 0.00 C ATOM 0 H MET A 63 -6.503 -11.990 2.296 1.00 0.00 H new ATOM 0 HA MET A 63 -6.680 -11.588 5.212 1.00 0.00 H new ATOM 0 HB2 MET A 63 -4.524 -10.590 3.400 1.00 0.00 H new ATOM 0 HB3 MET A 63 -4.766 -10.101 5.066 1.00 0.00 H new ATOM 0 HG2 MET A 63 -4.772 -12.963 5.011 1.00 0.00 H new ATOM 0 HG3 MET A 63 -3.420 -12.430 4.031 1.00 0.00 H new ATOM 0 HE1 MET A 63 -0.838 -11.241 5.822 1.00 0.00 H new ATOM 0 HE2 MET A 63 -1.981 -10.641 4.597 1.00 0.00 H new ATOM 0 HE3 MET A 63 -1.853 -9.822 6.172 1.00 0.00 H new ATOM 1008 N ASN A 64 -7.518 -9.146 4.795 1.00 0.00 N ATOM 1009 CA ASN A 64 -8.105 -7.838 4.576 1.00 0.00 C ATOM 1010 C ASN A 64 -6.994 -6.814 4.659 1.00 0.00 C ATOM 1011 O ASN A 64 -6.057 -6.979 5.435 1.00 0.00 O ATOM 1012 CB ASN A 64 -9.080 -7.432 5.689 1.00 0.00 C ATOM 1013 CG ASN A 64 -10.489 -7.982 5.643 1.00 0.00 C ATOM 1014 OD1 ASN A 64 -10.881 -8.768 4.781 1.00 0.00 O ATOM 1015 ND2 ASN A 64 -11.297 -7.505 6.576 1.00 0.00 N ATOM 0 H ASN A 64 -7.441 -9.399 5.780 1.00 0.00 H new ATOM 0 HA ASN A 64 -8.623 -7.879 3.618 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -8.639 -7.726 6.641 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -9.147 -6.344 5.692 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -12.277 -7.787 6.595 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -10.940 -6.855 7.276 1.00 0.00 H new ATOM 1022 N PHE A 65 -7.135 -5.765 3.873 1.00 0.00 N ATOM 1023 CA PHE A 65 -6.339 -4.561 3.814 1.00 0.00 C ATOM 1024 C PHE A 65 -7.399 -3.468 3.714 1.00 0.00 C ATOM 1025 O PHE A 65 -8.492 -3.711 3.198 1.00 0.00 O ATOM 1026 CB PHE A 65 -5.381 -4.530 2.615 1.00 0.00 C ATOM 1027 CG PHE A 65 -4.076 -5.288 2.759 1.00 0.00 C ATOM 1028 CD1 PHE A 65 -4.045 -6.690 2.894 1.00 0.00 C ATOM 1029 CD2 PHE A 65 -2.866 -4.569 2.721 1.00 0.00 C ATOM 1030 CE1 PHE A 65 -2.816 -7.355 3.056 1.00 0.00 C ATOM 1031 CE2 PHE A 65 -1.640 -5.236 2.844 1.00 0.00 C ATOM 1032 CZ PHE A 65 -1.616 -6.622 3.046 1.00 0.00 C ATOM 0 H PHE A 65 -7.891 -5.735 3.189 1.00 0.00 H new ATOM 0 HA PHE A 65 -5.676 -4.458 4.673 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -5.910 -4.927 1.748 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -5.146 -3.489 2.396 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -4.965 -7.255 2.873 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -2.883 -3.496 2.596 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -2.794 -8.427 3.188 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -0.715 -4.682 2.783 1.00 0.00 H new ATOM 0 HZ PHE A 65 -0.674 -7.129 3.194 1.00 0.00 H new ATOM 1042 N THR A 66 -7.103 -2.258 4.156 1.00 0.00 N ATOM 1043 CA THR A 66 -8.053 -1.166 4.166 1.00 0.00 C ATOM 1044 C THR A 66 -7.303 0.077 3.740 1.00 0.00 C ATOM 1045 O THR A 66 -6.224 0.350 4.256 1.00 0.00 O ATOM 1046 CB THR A 66 -8.672 -1.026 5.561 1.00 0.00 C ATOM 1047 OG1 THR A 66 -9.633 -2.037 5.787 1.00 0.00 O ATOM 1048 CG2 THR A 66 -9.386 0.320 5.693 1.00 0.00 C ATOM 0 H THR A 66 -6.185 -2.006 4.522 1.00 0.00 H new ATOM 0 HA THR A 66 -8.880 -1.341 3.478 1.00 0.00 H new ATOM 0 HB THR A 66 -7.861 -1.106 6.285 1.00 0.00 H new ATOM 0 HG1 THR A 66 -9.183 -2.904 5.863 1.00 0.00 H new ATOM 0 HG21 THR A 66 -9.821 0.405 6.689 1.00 0.00 H new ATOM 0 HG22 THR A 66 -8.671 1.128 5.539 1.00 0.00 H new ATOM 0 HG23 THR A 66 -10.176 0.388 4.945 1.00 0.00 H new ATOM 1056 N TRP A 67 -7.867 0.861 2.831 1.00 0.00 N ATOM 1057 CA TRP A 67 -7.234 2.100 2.419 1.00 0.00 C ATOM 1058 C TRP A 67 -8.266 3.169 2.122 1.00 0.00 C ATOM 1059 O TRP A 67 -9.466 2.879 2.024 1.00 0.00 O ATOM 1060 CB TRP A 67 -6.300 1.809 1.238 1.00 0.00 C ATOM 1061 CG TRP A 67 -6.885 1.351 -0.066 1.00 0.00 C ATOM 1062 CD1 TRP A 67 -8.185 1.090 -0.345 1.00 0.00 C ATOM 1063 CD2 TRP A 67 -6.148 1.041 -1.286 1.00 0.00 C ATOM 1064 NE1 TRP A 67 -8.303 0.695 -1.663 1.00 0.00 N ATOM 1065 CE2 TRP A 67 -7.070 0.570 -2.267 1.00 0.00 C ATOM 1066 CE3 TRP A 67 -4.783 1.087 -1.642 1.00 0.00 C ATOM 1067 CZ2 TRP A 67 -6.656 0.097 -3.521 1.00 0.00 C ATOM 1068 CZ3 TRP A 67 -4.353 0.588 -2.888 1.00 0.00 C ATOM 1069 CH2 TRP A 67 -5.283 0.091 -3.821 1.00 0.00 C ATOM 0 H TRP A 67 -8.754 0.661 2.370 1.00 0.00 H new ATOM 0 HA TRP A 67 -6.629 2.503 3.231 1.00 0.00 H new ATOM 0 HB2 TRP A 67 -5.730 2.717 1.040 1.00 0.00 H new ATOM 0 HB3 TRP A 67 -5.589 1.050 1.562 1.00 0.00 H new ATOM 0 HD1 TRP A 67 -9.003 1.177 0.355 1.00 0.00 H new ATOM 0 HE1 TRP A 67 -9.192 0.518 -2.131 1.00 0.00 H new ATOM 0 HE3 TRP A 67 -4.063 1.507 -0.955 1.00 0.00 H new ATOM 0 HZ2 TRP A 67 -7.378 -0.256 -4.242 1.00 0.00 H new ATOM 0 HZ3 TRP A 67 -3.300 0.587 -3.129 1.00 0.00 H new ATOM 0 HH2 TRP A 67 -4.940 -0.296 -4.769 1.00 0.00 H new ATOM 1080 N GLN A 68 -7.792 4.405 2.005 1.00 0.00 N ATOM 1081 CA GLN A 68 -8.574 5.556 1.618 1.00 0.00 C ATOM 1082 C GLN A 68 -7.658 6.724 1.259 1.00 0.00 C ATOM 1083 O GLN A 68 -6.485 6.738 1.641 1.00 0.00 O ATOM 1084 CB GLN A 68 -9.530 5.958 2.760 1.00 0.00 C ATOM 1085 CG GLN A 68 -8.873 6.188 4.129 1.00 0.00 C ATOM 1086 CD GLN A 68 -8.656 7.667 4.417 1.00 0.00 C ATOM 1087 OE1 GLN A 68 -7.748 8.299 3.907 1.00 0.00 O ATOM 1088 NE2 GLN A 68 -9.501 8.252 5.246 1.00 0.00 N ATOM 0 H GLN A 68 -6.814 4.633 2.186 1.00 0.00 H new ATOM 0 HA GLN A 68 -9.166 5.297 0.740 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -10.050 6.871 2.469 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -10.286 5.180 2.867 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -9.499 5.755 4.909 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -7.916 5.668 4.164 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -10.258 7.713 5.667 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -9.397 9.243 5.465 1.00 0.00 H new ATOM 1097 N ALA A 69 -8.172 7.675 0.478 1.00 0.00 N ATOM 1098 CA ALA A 69 -7.448 8.902 0.193 1.00 0.00 C ATOM 1099 C ALA A 69 -7.983 9.969 1.158 1.00 0.00 C ATOM 1100 O ALA A 69 -9.068 9.845 1.734 1.00 0.00 O ATOM 1101 CB ALA A 69 -7.586 9.284 -1.281 1.00 0.00 C ATOM 0 H ALA A 69 -9.088 7.614 0.034 1.00 0.00 H new ATOM 0 HA ALA A 69 -6.376 8.787 0.352 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -7.036 10.206 -1.471 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -7.182 8.485 -1.903 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -8.639 9.434 -1.521 1.00 0.00 H new ATOM 1107 N ALA A 70 -7.310 11.107 1.244 1.00 0.00 N ATOM 1108 CA ALA A 70 -7.601 12.163 2.183 1.00 0.00 C ATOM 1109 C ALA A 70 -8.596 13.157 1.581 1.00 0.00 C ATOM 1110 O ALA A 70 -8.266 14.023 0.771 1.00 0.00 O ATOM 1111 CB ALA A 70 -6.299 12.830 2.577 1.00 0.00 C ATOM 0 H ALA A 70 -6.519 11.321 0.637 1.00 0.00 H new ATOM 0 HA ALA A 70 -8.070 11.754 3.078 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -6.501 13.632 3.287 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -5.639 12.095 3.037 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -5.819 13.244 1.690 1.00 0.00 H new ATOM 1117 N GLY A 71 -9.846 12.907 1.938 1.00 0.00 N ATOM 1118 CA GLY A 71 -11.095 13.645 1.710 1.00 0.00 C ATOM 1119 C GLY A 71 -11.436 14.138 0.296 1.00 0.00 C ATOM 1120 O GLY A 71 -12.557 13.864 -0.135 1.00 0.00 O ATOM 0 H GLY A 71 -10.043 12.060 2.472 1.00 0.00 H new ATOM 0 HA2 GLY A 71 -11.915 13.008 2.040 1.00 0.00 H new ATOM 0 HA3 GLY A 71 -11.084 14.516 2.365 1.00 0.00 H new ATOM 1124 N GLN A 72 -10.606 14.965 -0.353 1.00 0.00 N ATOM 1125 CA GLN A 72 -10.774 15.388 -1.755 1.00 0.00 C ATOM 1126 C GLN A 72 -9.656 14.963 -2.720 1.00 0.00 C ATOM 1127 O GLN A 72 -9.830 15.075 -3.933 1.00 0.00 O ATOM 1128 CB GLN A 72 -11.046 16.900 -1.837 1.00 0.00 C ATOM 1129 CG GLN A 72 -12.519 17.248 -1.560 1.00 0.00 C ATOM 1130 CD GLN A 72 -13.505 16.841 -2.667 1.00 0.00 C ATOM 1131 OE1 GLN A 72 -13.071 16.253 -3.777 1.00 0.00 O flip ATOM 1132 NE2 GLN A 72 -14.701 17.079 -2.541 1.00 0.00 N flip ATOM 0 H GLN A 72 -9.780 15.369 0.089 1.00 0.00 H new ATOM 0 HA GLN A 72 -11.646 14.838 -2.109 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -10.412 17.420 -1.119 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -10.770 17.263 -2.827 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -12.821 16.766 -0.630 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -12.598 18.324 -1.402 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -15.045 17.530 -1.693 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -15.352 16.826 -3.284 1.00 0.00 H new ATOM 1141 N ALA A 73 -8.511 14.550 -2.187 1.00 0.00 N ATOM 1142 CA ALA A 73 -7.258 14.207 -2.847 1.00 0.00 C ATOM 1143 C ALA A 73 -7.212 12.825 -3.537 1.00 0.00 C ATOM 1144 O ALA A 73 -6.240 12.123 -3.281 1.00 0.00 O ATOM 1145 CB ALA A 73 -6.115 14.410 -1.836 1.00 0.00 C ATOM 0 H ALA A 73 -8.431 14.436 -1.177 1.00 0.00 H new ATOM 0 HA ALA A 73 -7.146 14.882 -3.696 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -5.164 14.159 -2.307 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -6.096 15.451 -1.512 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -6.274 13.764 -0.973 1.00 0.00 H new ATOM 1151 N GLU A 74 -8.281 12.321 -4.177 1.00 0.00 N ATOM 1152 CA GLU A 74 -8.372 10.966 -4.751 1.00 0.00 C ATOM 1153 C GLU A 74 -7.026 10.576 -5.404 1.00 0.00 C ATOM 1154 O GLU A 74 -6.606 11.172 -6.399 1.00 0.00 O ATOM 1155 CB GLU A 74 -9.495 10.902 -5.816 1.00 0.00 C ATOM 1156 CG GLU A 74 -10.983 10.788 -5.400 1.00 0.00 C ATOM 1157 CD GLU A 74 -11.436 9.442 -4.790 1.00 0.00 C ATOM 1158 OE1 GLU A 74 -11.077 8.387 -5.364 1.00 0.00 O ATOM 1159 OE2 GLU A 74 -12.233 9.450 -3.814 1.00 0.00 O ATOM 0 H GLU A 74 -9.134 12.863 -4.314 1.00 0.00 H new ATOM 0 HA GLU A 74 -8.603 10.268 -3.947 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -9.403 11.797 -6.431 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -9.277 10.049 -6.459 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -11.195 11.576 -4.678 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -11.597 10.987 -6.278 1.00 0.00 H new ATOM 1166 N TYR A 75 -6.348 9.577 -4.828 1.00 0.00 N ATOM 1167 CA TYR A 75 -5.108 8.999 -5.338 1.00 0.00 C ATOM 1168 C TYR A 75 -5.482 7.855 -6.270 1.00 0.00 C ATOM 1169 O TYR A 75 -6.294 7.014 -5.896 1.00 0.00 O ATOM 1170 CB TYR A 75 -4.215 8.516 -4.178 1.00 0.00 C ATOM 1171 CG TYR A 75 -3.375 9.588 -3.494 1.00 0.00 C ATOM 1172 CD1 TYR A 75 -3.893 10.407 -2.473 1.00 0.00 C ATOM 1173 CD2 TYR A 75 -2.033 9.750 -3.886 1.00 0.00 C ATOM 1174 CE1 TYR A 75 -3.086 11.387 -1.854 1.00 0.00 C ATOM 1175 CE2 TYR A 75 -1.213 10.703 -3.259 1.00 0.00 C ATOM 1176 CZ TYR A 75 -1.733 11.533 -2.244 1.00 0.00 C ATOM 1177 OH TYR A 75 -0.905 12.452 -1.673 1.00 0.00 O ATOM 0 H TYR A 75 -6.662 9.136 -3.964 1.00 0.00 H new ATOM 0 HA TYR A 75 -4.532 9.746 -5.885 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -4.850 8.046 -3.427 1.00 0.00 H new ATOM 0 HB3 TYR A 75 -3.545 7.744 -4.558 1.00 0.00 H new ATOM 0 HD1 TYR A 75 -4.919 10.285 -2.159 1.00 0.00 H new ATOM 0 HD2 TYR A 75 -1.629 9.135 -4.677 1.00 0.00 H new ATOM 0 HE1 TYR A 75 -3.500 12.023 -1.086 1.00 0.00 H new ATOM 0 HE2 TYR A 75 -0.179 10.801 -3.556 1.00 0.00 H new ATOM 0 HH TYR A 75 -1.344 12.847 -0.891 1.00 0.00 H new ATOM 1187 N PHE A 76 -4.931 7.806 -7.478 1.00 0.00 N ATOM 1188 CA PHE A 76 -5.232 6.754 -8.441 1.00 0.00 C ATOM 1189 C PHE A 76 -4.299 5.591 -8.085 1.00 0.00 C ATOM 1190 O PHE A 76 -3.187 5.840 -7.616 1.00 0.00 O ATOM 1191 CB PHE A 76 -4.921 7.280 -9.853 1.00 0.00 C ATOM 1192 CG PHE A 76 -5.632 6.574 -10.989 1.00 0.00 C ATOM 1193 CD1 PHE A 76 -5.292 5.277 -11.406 1.00 0.00 C ATOM 1194 CD2 PHE A 76 -6.694 7.246 -11.627 1.00 0.00 C ATOM 1195 CE1 PHE A 76 -6.016 4.653 -12.432 1.00 0.00 C ATOM 1196 CE2 PHE A 76 -7.425 6.622 -12.650 1.00 0.00 C ATOM 1197 CZ PHE A 76 -7.096 5.311 -13.041 1.00 0.00 C ATOM 0 H PHE A 76 -4.261 8.497 -7.817 1.00 0.00 H new ATOM 0 HA PHE A 76 -6.276 6.441 -8.416 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -5.177 8.339 -9.891 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -3.846 7.206 -10.020 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -4.470 4.758 -10.935 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -6.948 8.252 -11.326 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -5.741 3.660 -12.756 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -8.236 7.146 -13.135 1.00 0.00 H new ATOM 0 HZ PHE A 76 -7.672 4.813 -13.807 1.00 0.00 H new ATOM 1207 N TYR A 77 -4.671 4.340 -8.341 1.00 0.00 N ATOM 1208 CA TYR A 77 -3.800 3.189 -8.137 1.00 0.00 C ATOM 1209 C TYR A 77 -3.918 2.207 -9.299 1.00 0.00 C ATOM 1210 O TYR A 77 -4.918 2.212 -10.024 1.00 0.00 O ATOM 1211 CB TYR A 77 -4.180 2.469 -6.823 1.00 0.00 C ATOM 1212 CG TYR A 77 -5.432 1.601 -6.916 1.00 0.00 C ATOM 1213 CD1 TYR A 77 -5.354 0.324 -7.505 1.00 0.00 C ATOM 1214 CD2 TYR A 77 -6.683 2.080 -6.479 1.00 0.00 C ATOM 1215 CE1 TYR A 77 -6.514 -0.422 -7.743 1.00 0.00 C ATOM 1216 CE2 TYR A 77 -7.842 1.292 -6.629 1.00 0.00 C ATOM 1217 CZ TYR A 77 -7.757 0.037 -7.272 1.00 0.00 C ATOM 1218 OH TYR A 77 -8.850 -0.757 -7.420 1.00 0.00 O ATOM 0 H TYR A 77 -5.594 4.096 -8.699 1.00 0.00 H new ATOM 0 HA TYR A 77 -2.772 3.546 -8.080 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -3.343 1.845 -6.510 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -4.329 3.217 -6.044 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -4.391 -0.083 -7.775 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -6.754 3.058 -6.026 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -6.454 -1.352 -8.289 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -8.791 1.646 -6.254 1.00 0.00 H new ATOM 0 HH TYR A 77 -8.619 -1.533 -7.973 1.00 0.00 H new ATOM 1228 N GLU A 78 -2.919 1.334 -9.441 1.00 0.00 N ATOM 1229 CA GLU A 78 -2.950 0.243 -10.402 1.00 0.00 C ATOM 1230 C GLU A 78 -2.052 -0.881 -9.880 1.00 0.00 C ATOM 1231 O GLU A 78 -1.010 -0.652 -9.262 1.00 0.00 O ATOM 1232 CB GLU A 78 -2.671 0.710 -11.848 1.00 0.00 C ATOM 1233 CG GLU A 78 -2.523 -0.465 -12.830 1.00 0.00 C ATOM 1234 CD GLU A 78 -2.520 -0.017 -14.296 1.00 0.00 C ATOM 1235 OE1 GLU A 78 -3.629 0.090 -14.869 1.00 0.00 O ATOM 1236 OE2 GLU A 78 -1.411 0.178 -14.842 1.00 0.00 O ATOM 0 H GLU A 78 -2.063 1.369 -8.887 1.00 0.00 H new ATOM 0 HA GLU A 78 -3.958 -0.163 -10.486 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -3.483 1.357 -12.180 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -1.760 1.309 -11.863 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -1.596 -0.997 -12.616 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -3.339 -1.170 -12.672 1.00 0.00 H new ATOM 1243 N PHE A 79 -2.507 -2.120 -10.023 1.00 0.00 N ATOM 1244 CA PHE A 79 -1.769 -3.277 -9.549 1.00 0.00 C ATOM 1245 C PHE A 79 -0.785 -3.698 -10.640 1.00 0.00 C ATOM 1246 O PHE A 79 -1.158 -4.364 -11.605 1.00 0.00 O ATOM 1247 CB PHE A 79 -2.751 -4.418 -9.199 1.00 0.00 C ATOM 1248 CG PHE A 79 -3.562 -4.263 -7.918 1.00 0.00 C ATOM 1249 CD1 PHE A 79 -4.769 -3.543 -7.913 1.00 0.00 C ATOM 1250 CD2 PHE A 79 -3.139 -4.873 -6.724 1.00 0.00 C ATOM 1251 CE1 PHE A 79 -5.516 -3.397 -6.732 1.00 0.00 C ATOM 1252 CE2 PHE A 79 -3.867 -4.695 -5.529 1.00 0.00 C ATOM 1253 CZ PHE A 79 -5.050 -3.939 -5.529 1.00 0.00 C ATOM 0 H PHE A 79 -3.395 -2.347 -10.470 1.00 0.00 H new ATOM 0 HA PHE A 79 -1.213 -3.036 -8.643 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -3.448 -4.532 -10.029 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -2.182 -5.345 -9.130 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -5.127 -3.096 -8.829 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -2.248 -5.484 -6.722 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -6.455 -2.864 -6.753 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -3.513 -5.142 -4.611 1.00 0.00 H new ATOM 0 HZ PHE A 79 -5.595 -3.777 -4.610 1.00 0.00 H new ATOM 1263 N LEU A 80 0.493 -3.366 -10.442 1.00 0.00 N ATOM 1264 CA LEU A 80 1.597 -3.769 -11.305 1.00 0.00 C ATOM 1265 C LEU A 80 1.829 -5.272 -11.112 1.00 0.00 C ATOM 1266 O LEU A 80 2.026 -6.010 -12.081 1.00 0.00 O ATOM 1267 CB LEU A 80 2.832 -2.920 -10.935 1.00 0.00 C ATOM 1268 CG LEU A 80 3.926 -2.816 -12.019 1.00 0.00 C ATOM 1269 CD1 LEU A 80 5.046 -1.894 -11.522 1.00 0.00 C ATOM 1270 CD2 LEU A 80 4.552 -4.152 -12.425 1.00 0.00 C ATOM 0 H LEU A 80 0.793 -2.793 -9.653 1.00 0.00 H new ATOM 0 HA LEU A 80 1.383 -3.599 -12.360 1.00 0.00 H new ATOM 0 HB2 LEU A 80 2.496 -1.913 -10.687 1.00 0.00 H new ATOM 0 HB3 LEU A 80 3.279 -3.338 -10.033 1.00 0.00 H new ATOM 0 HG LEU A 80 3.425 -2.422 -12.903 1.00 0.00 H new ATOM 0 HD11 LEU A 80 5.821 -1.818 -12.285 1.00 0.00 H new ATOM 0 HD12 LEU A 80 4.639 -0.904 -11.319 1.00 0.00 H new ATOM 0 HD13 LEU A 80 5.476 -2.304 -10.608 1.00 0.00 H new ATOM 0 HD21 LEU A 80 5.309 -3.981 -13.190 1.00 0.00 H new ATOM 0 HD22 LEU A 80 5.015 -4.617 -11.554 1.00 0.00 H new ATOM 0 HD23 LEU A 80 3.779 -4.811 -12.820 1.00 0.00 H new ATOM 1282 N SER A 81 1.777 -5.747 -9.864 1.00 0.00 N ATOM 1283 CA SER A 81 1.952 -7.140 -9.505 1.00 0.00 C ATOM 1284 C SER A 81 0.957 -7.567 -8.433 1.00 0.00 C ATOM 1285 O SER A 81 0.713 -6.854 -7.462 1.00 0.00 O ATOM 1286 CB SER A 81 3.389 -7.405 -9.036 1.00 0.00 C ATOM 1287 OG SER A 81 4.340 -6.867 -9.944 1.00 0.00 O ATOM 0 H SER A 81 1.606 -5.146 -9.057 1.00 0.00 H new ATOM 0 HA SER A 81 1.761 -7.736 -10.398 1.00 0.00 H new ATOM 0 HB2 SER A 81 3.538 -6.966 -8.049 1.00 0.00 H new ATOM 0 HB3 SER A 81 3.548 -8.479 -8.935 1.00 0.00 H new ATOM 0 HG SER A 81 5.245 -7.051 -9.617 1.00 0.00 H new ATOM 1293 N LEU A 82 0.373 -8.744 -8.643 1.00 0.00 N ATOM 1294 CA LEU A 82 -0.504 -9.462 -7.734 1.00 0.00 C ATOM 1295 C LEU A 82 -0.527 -10.869 -8.350 1.00 0.00 C ATOM 1296 O LEU A 82 -1.303 -11.110 -9.274 1.00 0.00 O ATOM 1297 CB LEU A 82 -1.910 -8.804 -7.682 1.00 0.00 C ATOM 1298 CG LEU A 82 -2.753 -9.137 -6.431 1.00 0.00 C ATOM 1299 CD1 LEU A 82 -2.527 -10.521 -5.845 1.00 0.00 C ATOM 1300 CD2 LEU A 82 -2.545 -8.112 -5.319 1.00 0.00 C ATOM 0 H LEU A 82 0.513 -9.253 -9.516 1.00 0.00 H new ATOM 0 HA LEU A 82 -0.173 -9.464 -6.695 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -1.788 -7.722 -7.740 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -2.468 -9.110 -8.567 1.00 0.00 H new ATOM 0 HG LEU A 82 -3.776 -9.108 -6.806 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -3.165 -10.655 -4.972 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -2.771 -11.277 -6.592 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -1.483 -10.625 -5.551 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -3.155 -8.382 -4.457 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -1.494 -8.097 -5.030 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -2.837 -7.124 -5.675 1.00 0.00 H new ATOM 1312 N ARG A 83 0.339 -11.795 -7.923 1.00 0.00 N ATOM 1313 CA ARG A 83 0.447 -13.125 -8.571 1.00 0.00 C ATOM 1314 C ARG A 83 1.138 -14.117 -7.652 1.00 0.00 C ATOM 1315 O ARG A 83 1.924 -13.702 -6.805 1.00 0.00 O ATOM 1316 CB ARG A 83 1.354 -13.077 -9.829 1.00 0.00 C ATOM 1317 CG ARG A 83 0.762 -12.560 -11.155 1.00 0.00 C ATOM 1318 CD ARG A 83 1.009 -11.082 -11.490 1.00 0.00 C ATOM 1319 NE ARG A 83 2.436 -10.712 -11.463 1.00 0.00 N ATOM 1320 CZ ARG A 83 2.961 -9.561 -11.889 1.00 0.00 C ATOM 1321 NH1 ARG A 83 2.236 -8.714 -12.618 1.00 0.00 N ATOM 1322 NH2 ARG A 83 4.193 -9.255 -11.520 1.00 0.00 N ATOM 0 H ARG A 83 0.975 -11.658 -7.138 1.00 0.00 H new ATOM 0 HA ARG A 83 -0.575 -13.415 -8.815 1.00 0.00 H new ATOM 0 HB2 ARG A 83 2.217 -12.456 -9.589 1.00 0.00 H new ATOM 0 HB3 ARG A 83 1.726 -14.086 -10.006 1.00 0.00 H new ATOM 0 HG2 ARG A 83 1.166 -13.165 -11.967 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -0.315 -12.729 -11.136 1.00 0.00 H new ATOM 0 HD2 ARG A 83 0.603 -10.867 -12.479 1.00 0.00 H new ATOM 0 HD3 ARG A 83 0.465 -10.459 -10.780 1.00 0.00 H new ATOM 0 HE ARG A 83 3.084 -11.402 -11.082 1.00 0.00 H new ATOM 0 HH11 ARG A 83 1.271 -8.942 -12.855 1.00 0.00 H new ATOM 0 HH12 ARG A 83 2.646 -7.837 -12.939 1.00 0.00 H new ATOM 0 HH21 ARG A 83 4.720 -9.893 -10.923 1.00 0.00 H new ATOM 0 HH22 ARG A 83 4.617 -8.381 -11.832 1.00 0.00 H new ATOM 1336 N SER A 84 0.871 -15.418 -7.809 1.00 0.00 N ATOM 1337 CA SER A 84 1.607 -16.422 -7.062 1.00 0.00 C ATOM 1338 C SER A 84 3.018 -16.545 -7.623 1.00 0.00 C ATOM 1339 O SER A 84 3.299 -16.130 -8.749 1.00 0.00 O ATOM 1340 CB SER A 84 0.903 -17.758 -7.182 1.00 0.00 C ATOM 1341 OG SER A 84 1.265 -18.635 -6.141 1.00 0.00 O ATOM 0 H SER A 84 0.160 -15.789 -8.439 1.00 0.00 H new ATOM 0 HA SER A 84 1.657 -16.127 -6.014 1.00 0.00 H new ATOM 0 HB2 SER A 84 -0.176 -17.603 -7.168 1.00 0.00 H new ATOM 0 HB3 SER A 84 1.147 -18.213 -8.142 1.00 0.00 H new ATOM 0 HG SER A 84 0.558 -19.301 -6.014 1.00 0.00 H new ATOM 1347 N LEU A 85 3.873 -17.197 -6.844 1.00 0.00 N ATOM 1348 CA LEU A 85 5.231 -17.556 -7.197 1.00 0.00 C ATOM 1349 C LEU A 85 5.424 -19.066 -7.135 1.00 0.00 C ATOM 1350 O LEU A 85 6.362 -19.526 -7.782 1.00 0.00 O ATOM 1351 CB LEU A 85 6.248 -16.835 -6.301 1.00 0.00 C ATOM 1352 CG LEU A 85 6.292 -15.307 -6.484 1.00 0.00 C ATOM 1353 CD1 LEU A 85 7.355 -14.738 -5.541 1.00 0.00 C ATOM 1354 CD2 LEU A 85 6.631 -14.883 -7.917 1.00 0.00 C ATOM 0 H LEU A 85 3.620 -17.502 -5.904 1.00 0.00 H new ATOM 0 HA LEU A 85 5.407 -17.233 -8.223 1.00 0.00 H new ATOM 0 HB2 LEU A 85 6.016 -17.057 -5.259 1.00 0.00 H new ATOM 0 HB3 LEU A 85 7.240 -17.241 -6.500 1.00 0.00 H new ATOM 0 HG LEU A 85 5.298 -14.921 -6.260 1.00 0.00 H new ATOM 0 HD11 LEU A 85 7.401 -13.655 -5.656 1.00 0.00 H new ATOM 0 HD12 LEU A 85 7.096 -14.983 -4.511 1.00 0.00 H new ATOM 0 HD13 LEU A 85 8.326 -15.170 -5.784 1.00 0.00 H new ATOM 0 HD21 LEU A 85 6.647 -13.795 -7.980 1.00 0.00 H new ATOM 0 HD22 LEU A 85 7.610 -15.276 -8.191 1.00 0.00 H new ATOM 0 HD23 LEU A 85 5.878 -15.276 -8.600 1.00 0.00 H new ATOM 1366 N ASP A 86 4.602 -19.840 -6.396 1.00 0.00 N ATOM 1367 CA ASP A 86 4.726 -21.297 -6.476 1.00 0.00 C ATOM 1368 C ASP A 86 3.646 -21.822 -7.421 1.00 0.00 C ATOM 1369 O ASP A 86 2.650 -21.170 -7.763 1.00 0.00 O ATOM 1370 CB ASP A 86 4.675 -22.102 -5.153 1.00 0.00 C ATOM 1371 CG ASP A 86 5.324 -23.486 -5.320 1.00 0.00 C ATOM 1372 OD1 ASP A 86 5.994 -23.765 -6.341 1.00 0.00 O ATOM 1373 OD2 ASP A 86 5.005 -24.348 -4.494 1.00 0.00 O ATOM 0 H ASP A 86 3.878 -19.494 -5.766 1.00 0.00 H new ATOM 0 HA ASP A 86 5.743 -21.460 -6.834 1.00 0.00 H new ATOM 0 HB2 ASP A 86 5.189 -21.549 -4.367 1.00 0.00 H new ATOM 0 HB3 ASP A 86 3.639 -22.219 -4.835 1.00 0.00 H new ATOM 1378 N LYS A 87 3.846 -23.063 -7.820 1.00 0.00 N ATOM 1379 CA LYS A 87 3.056 -23.872 -8.712 1.00 0.00 C ATOM 1380 C LYS A 87 2.884 -25.298 -8.201 1.00 0.00 C ATOM 1381 O LYS A 87 1.939 -25.992 -8.551 1.00 0.00 O ATOM 1382 CB LYS A 87 3.766 -23.837 -10.044 1.00 0.00 C ATOM 1383 CG LYS A 87 3.433 -22.551 -10.852 1.00 0.00 C ATOM 1384 CD LYS A 87 1.944 -22.265 -11.183 1.00 0.00 C ATOM 1385 CE LYS A 87 1.515 -20.783 -11.015 1.00 0.00 C ATOM 1386 NZ LYS A 87 0.743 -20.488 -9.779 1.00 0.00 N ATOM 0 H LYS A 87 4.659 -23.581 -7.486 1.00 0.00 H new ATOM 0 HA LYS A 87 2.042 -23.480 -8.793 1.00 0.00 H new ATOM 0 HB2 LYS A 87 4.842 -23.894 -9.882 1.00 0.00 H new ATOM 0 HB3 LYS A 87 3.485 -24.714 -10.627 1.00 0.00 H new ATOM 0 HG2 LYS A 87 3.822 -21.697 -10.297 1.00 0.00 H new ATOM 0 HG3 LYS A 87 3.982 -22.596 -11.793 1.00 0.00 H new ATOM 0 HD2 LYS A 87 1.749 -22.571 -12.211 1.00 0.00 H new ATOM 0 HD3 LYS A 87 1.318 -22.885 -10.542 1.00 0.00 H new ATOM 0 HE2 LYS A 87 2.408 -20.159 -11.025 1.00 0.00 H new ATOM 0 HE3 LYS A 87 0.915 -20.494 -11.878 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 0.560 -19.466 -9.720 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -0.161 -21.001 -9.804 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 1.290 -20.790 -8.948 1.00 0.00 H new ATOM 1400 N GLY A 88 3.844 -25.743 -7.425 1.00 0.00 N ATOM 1401 CA GLY A 88 3.804 -27.013 -6.717 1.00 0.00 C ATOM 1402 C GLY A 88 2.668 -26.909 -5.690 1.00 0.00 C ATOM 1403 O GLY A 88 1.640 -27.564 -5.821 1.00 0.00 O ATOM 0 H GLY A 88 4.704 -25.219 -7.260 1.00 0.00 H new ATOM 0 HA2 GLY A 88 3.626 -27.836 -7.409 1.00 0.00 H new ATOM 0 HA3 GLY A 88 4.755 -27.211 -6.223 1.00 0.00 H new ATOM 1407 N ILE A 89 2.813 -25.997 -4.727 1.00 0.00 N ATOM 1408 CA ILE A 89 1.855 -25.595 -3.678 1.00 0.00 C ATOM 1409 C ILE A 89 0.829 -24.575 -4.230 1.00 0.00 C ATOM 1410 O ILE A 89 0.267 -23.755 -3.514 1.00 0.00 O ATOM 1411 CB ILE A 89 2.626 -25.162 -2.396 1.00 0.00 C ATOM 1412 CG1 ILE A 89 3.463 -26.332 -1.843 1.00 0.00 C ATOM 1413 CG2 ILE A 89 1.739 -24.683 -1.235 1.00 0.00 C ATOM 1414 CD1 ILE A 89 4.939 -26.209 -2.189 1.00 0.00 C ATOM 0 H ILE A 89 3.682 -25.468 -4.648 1.00 0.00 H new ATOM 0 HA ILE A 89 1.242 -26.441 -3.368 1.00 0.00 H new ATOM 0 HB ILE A 89 3.237 -24.324 -2.732 1.00 0.00 H new ATOM 0 HG12 ILE A 89 3.350 -26.375 -0.760 1.00 0.00 H new ATOM 0 HG13 ILE A 89 3.077 -27.270 -2.241 1.00 0.00 H new ATOM 0 HG21 ILE A 89 2.367 -24.404 -0.389 1.00 0.00 H new ATOM 0 HG22 ILE A 89 1.156 -23.819 -1.555 1.00 0.00 H new ATOM 0 HG23 ILE A 89 1.065 -25.486 -0.937 1.00 0.00 H new ATOM 0 HD11 ILE A 89 5.482 -27.059 -1.775 1.00 0.00 H new ATOM 0 HD12 ILE A 89 5.059 -26.194 -3.272 1.00 0.00 H new ATOM 0 HD13 ILE A 89 5.336 -25.285 -1.768 1.00 0.00 H new ATOM 1426 N MET A 90 0.577 -24.622 -5.533 1.00 0.00 N ATOM 1427 CA MET A 90 -0.240 -23.685 -6.283 1.00 0.00 C ATOM 1428 C MET A 90 -1.527 -23.315 -5.558 1.00 0.00 C ATOM 1429 O MET A 90 -2.348 -24.120 -5.117 1.00 0.00 O ATOM 1430 CB MET A 90 -0.581 -24.244 -7.668 1.00 0.00 C ATOM 1431 CG MET A 90 -1.400 -23.308 -8.563 1.00 0.00 C ATOM 1432 SD MET A 90 -1.348 -23.663 -10.353 1.00 0.00 S ATOM 1433 CE MET A 90 -0.944 -25.436 -10.436 1.00 0.00 C ATOM 0 H MET A 90 0.961 -25.359 -6.125 1.00 0.00 H new ATOM 0 HA MET A 90 0.357 -22.779 -6.388 1.00 0.00 H new ATOM 0 HB2 MET A 90 0.348 -24.492 -8.182 1.00 0.00 H new ATOM 0 HB3 MET A 90 -1.133 -25.175 -7.541 1.00 0.00 H new ATOM 0 HG2 MET A 90 -2.439 -23.342 -8.236 1.00 0.00 H new ATOM 0 HG3 MET A 90 -1.050 -22.288 -8.405 1.00 0.00 H new ATOM 0 HE1 MET A 90 -1.247 -25.833 -11.405 1.00 0.00 H new ATOM 0 HE2 MET A 90 0.130 -25.571 -10.308 1.00 0.00 H new ATOM 0 HE3 MET A 90 -1.473 -25.967 -9.645 1.00 0.00 H new ATOM 1443 N ALA A 91 -1.624 -22.007 -5.508 1.00 0.00 N ATOM 1444 CA ALA A 91 -2.614 -21.077 -5.071 1.00 0.00 C ATOM 1445 C ALA A 91 -2.336 -19.905 -5.975 1.00 0.00 C ATOM 1446 O ALA A 91 -1.169 -19.664 -6.301 1.00 0.00 O ATOM 1447 CB ALA A 91 -2.379 -20.631 -3.619 1.00 0.00 C ATOM 0 H ALA A 91 -0.826 -21.474 -5.853 1.00 0.00 H new ATOM 0 HA ALA A 91 -3.624 -21.485 -5.108 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -3.155 -19.923 -3.326 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -2.413 -21.500 -2.962 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -1.403 -20.153 -3.539 1.00 0.00 H new ATOM 1453 N ASP A 92 -3.365 -19.169 -6.343 1.00 0.00 N ATOM 1454 CA ASP A 92 -3.154 -17.977 -7.175 1.00 0.00 C ATOM 1455 C ASP A 92 -4.042 -16.888 -6.578 1.00 0.00 C ATOM 1456 O ASP A 92 -5.251 -17.086 -6.466 1.00 0.00 O ATOM 1457 CB ASP A 92 -3.299 -18.273 -8.677 1.00 0.00 C ATOM 1458 CG ASP A 92 -2.010 -18.917 -9.238 1.00 0.00 C ATOM 1459 OD1 ASP A 92 -1.008 -18.199 -9.471 1.00 0.00 O ATOM 1460 OD2 ASP A 92 -1.944 -20.157 -9.400 1.00 0.00 O ATOM 0 H ASP A 92 -4.336 -19.358 -6.093 1.00 0.00 H new ATOM 0 HA ASP A 92 -2.127 -17.613 -7.151 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -4.145 -18.941 -8.840 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -3.513 -17.350 -9.215 1.00 0.00 H new ATOM 1465 N PRO A 93 -3.453 -15.787 -6.074 1.00 0.00 N ATOM 1466 CA PRO A 93 -4.185 -14.756 -5.357 1.00 0.00 C ATOM 1467 C PRO A 93 -5.150 -13.955 -6.235 1.00 0.00 C ATOM 1468 O PRO A 93 -5.005 -13.859 -7.452 1.00 0.00 O ATOM 1469 CB PRO A 93 -3.102 -13.868 -4.740 1.00 0.00 C ATOM 1470 CG PRO A 93 -1.992 -13.943 -5.783 1.00 0.00 C ATOM 1471 CD PRO A 93 -2.054 -15.406 -6.200 1.00 0.00 C ATOM 0 HA PRO A 93 -4.840 -15.201 -4.608 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -3.450 -12.846 -4.589 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -2.774 -14.240 -3.769 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -2.173 -13.271 -6.622 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -1.021 -13.678 -5.366 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -1.702 -15.538 -7.223 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -1.420 -16.023 -5.563 1.00 0.00 H new ATOM 1479 N THR A 94 -6.109 -13.323 -5.567 1.00 0.00 N ATOM 1480 CA THR A 94 -7.178 -12.502 -6.133 1.00 0.00 C ATOM 1481 C THR A 94 -7.369 -11.255 -5.257 1.00 0.00 C ATOM 1482 O THR A 94 -6.926 -11.249 -4.108 1.00 0.00 O ATOM 1483 CB THR A 94 -8.458 -13.360 -6.217 1.00 0.00 C ATOM 1484 OG1 THR A 94 -8.711 -14.022 -4.989 1.00 0.00 O ATOM 1485 CG2 THR A 94 -8.372 -14.432 -7.310 1.00 0.00 C ATOM 0 H THR A 94 -6.166 -13.373 -4.550 1.00 0.00 H new ATOM 0 HA THR A 94 -6.930 -12.162 -7.138 1.00 0.00 H new ATOM 0 HB THR A 94 -9.264 -12.665 -6.454 1.00 0.00 H new ATOM 0 HG1 THR A 94 -7.925 -13.946 -4.409 1.00 0.00 H new ATOM 0 HG21 THR A 94 -9.297 -15.008 -7.328 1.00 0.00 H new ATOM 0 HG22 THR A 94 -8.224 -13.954 -8.278 1.00 0.00 H new ATOM 0 HG23 THR A 94 -7.534 -15.097 -7.102 1.00 0.00 H new ATOM 1493 N VAL A 95 -8.017 -10.203 -5.765 1.00 0.00 N ATOM 1494 CA VAL A 95 -8.358 -8.998 -5.002 1.00 0.00 C ATOM 1495 C VAL A 95 -9.855 -8.670 -5.094 1.00 0.00 C ATOM 1496 O VAL A 95 -10.512 -9.010 -6.074 1.00 0.00 O ATOM 1497 CB VAL A 95 -7.467 -7.810 -5.408 1.00 0.00 C ATOM 1498 CG1 VAL A 95 -6.074 -7.931 -4.783 1.00 0.00 C ATOM 1499 CG2 VAL A 95 -7.330 -7.620 -6.927 1.00 0.00 C ATOM 0 H VAL A 95 -8.325 -10.164 -6.736 1.00 0.00 H new ATOM 0 HA VAL A 95 -8.154 -9.202 -3.951 1.00 0.00 H new ATOM 0 HB VAL A 95 -7.977 -6.927 -5.024 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -5.464 -7.080 -5.085 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -6.163 -7.946 -3.697 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -5.602 -8.853 -5.121 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -6.687 -6.763 -7.130 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -6.891 -8.515 -7.368 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -8.314 -7.446 -7.362 1.00 0.00 H new ATOM 1509 N ASN A 96 -10.368 -7.964 -4.081 1.00 0.00 N ATOM 1510 CA ASN A 96 -11.746 -7.472 -3.940 1.00 0.00 C ATOM 1511 C ASN A 96 -12.021 -6.187 -4.735 1.00 0.00 C ATOM 1512 O ASN A 96 -13.029 -5.518 -4.522 1.00 0.00 O ATOM 1513 CB ASN A 96 -12.016 -7.212 -2.445 1.00 0.00 C ATOM 1514 CG ASN A 96 -13.485 -6.980 -2.116 1.00 0.00 C ATOM 1515 OD1 ASN A 96 -14.361 -7.707 -2.565 1.00 0.00 O ATOM 1516 ND2 ASN A 96 -13.775 -6.021 -1.251 1.00 0.00 N ATOM 0 H ASN A 96 -9.792 -7.702 -3.281 1.00 0.00 H new ATOM 0 HA ASN A 96 -12.410 -8.235 -4.346 1.00 0.00 H new ATOM 0 HB2 ASN A 96 -11.654 -8.062 -1.867 1.00 0.00 H new ATOM 0 HB3 ASN A 96 -11.441 -6.342 -2.127 1.00 0.00 H new ATOM 0 HD21 ASN A 96 -14.739 -5.880 -0.950 1.00 0.00 H new ATOM 0 HD22 ASN A 96 -13.034 -5.423 -0.885 1.00 0.00 H new ATOM 1523 N VAL A 97 -11.098 -5.783 -5.599 1.00 0.00 N ATOM 1524 CA VAL A 97 -11.171 -4.545 -6.370 1.00 0.00 C ATOM 1525 C VAL A 97 -10.655 -4.790 -7.791 1.00 0.00 C ATOM 1526 O VAL A 97 -10.002 -5.810 -8.025 1.00 0.00 O ATOM 1527 CB VAL A 97 -10.380 -3.414 -5.680 1.00 0.00 C ATOM 1528 CG1 VAL A 97 -11.059 -2.913 -4.402 1.00 0.00 C ATOM 1529 CG2 VAL A 97 -8.919 -3.783 -5.380 1.00 0.00 C ATOM 0 H VAL A 97 -10.253 -6.322 -5.789 1.00 0.00 H new ATOM 0 HA VAL A 97 -12.212 -4.227 -6.425 1.00 0.00 H new ATOM 0 HB VAL A 97 -10.374 -2.605 -6.410 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -10.459 -2.118 -3.959 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -12.050 -2.528 -4.643 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -11.152 -3.736 -3.693 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -8.423 -2.942 -4.895 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -8.891 -4.650 -4.720 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -8.405 -4.019 -6.312 1.00 0.00 H new ATOM 1539 N PRO A 98 -10.945 -3.898 -8.755 1.00 0.00 N ATOM 1540 CA PRO A 98 -10.373 -4.007 -10.085 1.00 0.00 C ATOM 1541 C PRO A 98 -8.857 -3.770 -10.014 1.00 0.00 C ATOM 1542 O PRO A 98 -8.349 -3.165 -9.063 1.00 0.00 O ATOM 1543 CB PRO A 98 -11.071 -2.945 -10.946 1.00 0.00 C ATOM 1544 CG PRO A 98 -12.186 -2.371 -10.068 1.00 0.00 C ATOM 1545 CD PRO A 98 -11.750 -2.694 -8.643 1.00 0.00 C ATOM 0 HA PRO A 98 -10.522 -4.997 -10.516 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -10.372 -2.166 -11.251 1.00 0.00 H new ATOM 0 HB3 PRO A 98 -11.477 -3.384 -11.858 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -12.295 -1.297 -10.216 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -13.149 -2.825 -10.301 1.00 0.00 H new ATOM 0 HD2 PRO A 98 -11.175 -1.875 -8.212 1.00 0.00 H new ATOM 0 HD3 PRO A 98 -12.611 -2.855 -7.995 1.00 0.00 H new ATOM 1553 N LEU A 99 -8.150 -4.200 -11.065 1.00 0.00 N ATOM 1554 CA LEU A 99 -6.697 -4.074 -11.187 1.00 0.00 C ATOM 1555 C LEU A 99 -6.235 -2.614 -11.257 1.00 0.00 C ATOM 1556 O LEU A 99 -5.046 -2.374 -11.112 1.00 0.00 O ATOM 1557 CB LEU A 99 -6.164 -4.871 -12.399 1.00 0.00 C ATOM 1558 CG LEU A 99 -5.958 -6.383 -12.225 1.00 0.00 C ATOM 1559 CD1 LEU A 99 -4.675 -6.646 -11.457 1.00 0.00 C ATOM 1560 CD2 LEU A 99 -7.117 -7.118 -11.540 1.00 0.00 C ATOM 0 H LEU A 99 -8.582 -4.654 -11.870 1.00 0.00 H new ATOM 0 HA LEU A 99 -6.275 -4.501 -10.277 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -6.854 -4.720 -13.229 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -5.210 -4.434 -12.694 1.00 0.00 H new ATOM 0 HG LEU A 99 -5.904 -6.784 -13.237 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -4.536 -7.721 -11.338 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -3.830 -6.230 -12.006 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -4.736 -6.177 -10.475 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -6.880 -8.179 -11.462 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -7.270 -6.706 -10.542 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -8.026 -6.992 -12.128 1.00 0.00 H new ATOM 1572 N LEU A 100 -7.124 -1.641 -11.451 1.00 0.00 N ATOM 1573 CA LEU A 100 -6.826 -0.215 -11.402 1.00 0.00 C ATOM 1574 C LEU A 100 -8.039 0.501 -10.814 1.00 0.00 C ATOM 1575 O LEU A 100 -9.133 -0.072 -10.786 1.00 0.00 O ATOM 1576 CB LEU A 100 -6.422 0.372 -12.767 1.00 0.00 C ATOM 1577 CG LEU A 100 -7.562 0.616 -13.771 1.00 0.00 C ATOM 1578 CD1 LEU A 100 -6.993 1.223 -15.054 1.00 0.00 C ATOM 1579 CD2 LEU A 100 -8.304 -0.680 -14.110 1.00 0.00 C ATOM 0 H LEU A 100 -8.105 -1.833 -11.654 1.00 0.00 H new ATOM 0 HA LEU A 100 -5.953 -0.063 -10.768 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -5.911 1.319 -12.594 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -5.699 -0.301 -13.228 1.00 0.00 H new ATOM 0 HG LEU A 100 -8.272 1.303 -13.310 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -7.801 1.395 -15.765 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -6.505 2.170 -14.823 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -6.267 0.537 -15.490 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -9.102 -0.467 -14.822 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -7.607 -1.394 -14.549 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -8.732 -1.103 -13.201 1.00 0.00 H new ATOM 1591 N GLY A 101 -7.886 1.753 -10.398 1.00 0.00 N ATOM 1592 CA GLY A 101 -8.985 2.525 -9.834 1.00 0.00 C ATOM 1593 C GLY A 101 -8.440 3.696 -9.043 1.00 0.00 C ATOM 1594 O GLY A 101 -7.298 4.099 -9.243 1.00 0.00 O ATOM 0 H GLY A 101 -7.001 2.259 -10.442 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -9.635 2.885 -10.632 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -9.593 1.891 -9.189 1.00 0.00 H new ATOM 1598 N THR A 102 -9.253 4.267 -8.162 1.00 0.00 N ATOM 1599 CA THR A 102 -8.802 5.306 -7.253 1.00 0.00 C ATOM 1600 C THR A 102 -8.999 4.792 -5.832 1.00 0.00 C ATOM 1601 O THR A 102 -9.863 3.949 -5.570 1.00 0.00 O ATOM 1602 CB THR A 102 -9.480 6.660 -7.546 1.00 0.00 C ATOM 1603 OG1 THR A 102 -10.873 6.616 -7.325 1.00 0.00 O ATOM 1604 CG2 THR A 102 -9.248 7.116 -8.996 1.00 0.00 C ATOM 0 H THR A 102 -10.238 4.022 -8.060 1.00 0.00 H new ATOM 0 HA THR A 102 -7.742 5.517 -7.394 1.00 0.00 H new ATOM 0 HB THR A 102 -9.021 7.368 -6.856 1.00 0.00 H new ATOM 0 HG1 THR A 102 -11.082 7.040 -6.466 1.00 0.00 H new ATOM 0 HG21 THR A 102 -9.742 8.074 -9.160 1.00 0.00 H new ATOM 0 HG22 THR A 102 -8.179 7.224 -9.177 1.00 0.00 H new ATOM 0 HG23 THR A 102 -9.658 6.374 -9.681 1.00 0.00 H new ATOM 1612 N VAL A 103 -8.124 5.220 -4.930 1.00 0.00 N ATOM 1613 CA VAL A 103 -8.219 4.954 -3.511 1.00 0.00 C ATOM 1614 C VAL A 103 -9.248 6.000 -3.054 1.00 0.00 C ATOM 1615 O VAL A 103 -8.924 7.189 -3.071 1.00 0.00 O ATOM 1616 CB VAL A 103 -6.825 5.129 -2.868 1.00 0.00 C ATOM 1617 CG1 VAL A 103 -6.894 4.710 -1.402 1.00 0.00 C ATOM 1618 CG2 VAL A 103 -5.732 4.292 -3.554 1.00 0.00 C ATOM 0 H VAL A 103 -7.307 5.778 -5.179 1.00 0.00 H new ATOM 0 HA VAL A 103 -8.527 3.945 -3.235 1.00 0.00 H new ATOM 0 HB VAL A 103 -6.558 6.180 -2.979 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -5.913 4.831 -0.942 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -7.619 5.333 -0.879 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -7.199 3.666 -1.336 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -4.778 4.460 -3.055 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -5.992 3.235 -3.494 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -5.651 4.587 -4.600 1.00 0.00 H new ATOM 1628 N PRO A 104 -10.452 5.607 -2.603 1.00 0.00 N ATOM 1629 CA PRO A 104 -11.503 6.567 -2.300 1.00 0.00 C ATOM 1630 C PRO A 104 -11.423 7.174 -0.918 1.00 0.00 C ATOM 1631 O PRO A 104 -10.797 6.641 -0.013 1.00 0.00 O ATOM 1632 CB PRO A 104 -12.798 5.779 -2.507 1.00 0.00 C ATOM 1633 CG PRO A 104 -12.401 4.386 -2.012 1.00 0.00 C ATOM 1634 CD PRO A 104 -10.955 4.248 -2.481 1.00 0.00 C ATOM 0 HA PRO A 104 -11.422 7.441 -2.946 1.00 0.00 H new ATOM 0 HB2 PRO A 104 -13.626 6.196 -1.934 1.00 0.00 H new ATOM 0 HB3 PRO A 104 -13.107 5.769 -3.552 1.00 0.00 H new ATOM 0 HG2 PRO A 104 -12.482 4.306 -0.928 1.00 0.00 H new ATOM 0 HG3 PRO A 104 -13.038 3.611 -2.438 1.00 0.00 H new ATOM 0 HD2 PRO A 104 -10.364 3.674 -1.767 1.00 0.00 H new ATOM 0 HD3 PRO A 104 -10.901 3.723 -3.435 1.00 0.00 H new ATOM 1642 N HIS A 105 -12.162 8.255 -0.687 1.00 0.00 N ATOM 1643 CA HIS A 105 -12.076 9.013 0.558 1.00 0.00 C ATOM 1644 C HIS A 105 -12.795 8.372 1.732 1.00 0.00 C ATOM 1645 O HIS A 105 -13.037 9.014 2.758 1.00 0.00 O ATOM 1646 CB HIS A 105 -12.471 10.470 0.343 1.00 0.00 C ATOM 1647 CG HIS A 105 -11.546 11.091 -0.638 1.00 0.00 C ATOM 1648 ND1 HIS A 105 -10.212 11.225 -0.418 1.00 0.00 N ATOM 1649 CD2 HIS A 105 -11.821 11.570 -1.883 1.00 0.00 C ATOM 1650 CE1 HIS A 105 -9.678 11.827 -1.474 1.00 0.00 C ATOM 1651 NE2 HIS A 105 -10.628 12.095 -2.375 1.00 0.00 N ATOM 0 H HIS A 105 -12.836 8.630 -1.355 1.00 0.00 H new ATOM 0 HA HIS A 105 -11.026 8.994 0.851 1.00 0.00 H new ATOM 0 HB2 HIS A 105 -13.497 10.531 -0.019 1.00 0.00 H new ATOM 0 HB3 HIS A 105 -12.434 11.012 1.288 1.00 0.00 H new ATOM 0 HD2 HIS A 105 -12.775 11.547 -2.389 1.00 0.00 H new ATOM 0 HE1 HIS A 105 -8.631 12.065 -1.588 1.00 0.00 H new ATOM 0 HE2 HIS A 105 -10.503 12.591 -3.257 1.00 0.00 H new ATOM 1659 N LYS A 106 -13.344 7.185 1.523 1.00 0.00 N ATOM 1660 CA LYS A 106 -13.939 6.380 2.567 1.00 0.00 C ATOM 1661 C LYS A 106 -13.134 5.093 2.684 1.00 0.00 C ATOM 1662 O LYS A 106 -12.839 4.482 1.659 1.00 0.00 O ATOM 1663 CB LYS A 106 -15.442 6.151 2.338 1.00 0.00 C ATOM 1664 CG LYS A 106 -16.330 7.350 2.738 1.00 0.00 C ATOM 1665 CD LYS A 106 -16.864 8.227 1.587 1.00 0.00 C ATOM 1666 CE LYS A 106 -15.890 9.243 0.969 1.00 0.00 C ATOM 1667 NZ LYS A 106 -15.382 10.246 1.939 1.00 0.00 N ATOM 0 H LYS A 106 -13.387 6.750 0.602 1.00 0.00 H new ATOM 0 HA LYS A 106 -13.894 6.906 3.521 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -15.608 5.925 1.285 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -15.756 5.275 2.905 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -17.183 6.970 3.301 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -15.759 7.986 3.415 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -17.213 7.567 0.793 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -17.734 8.772 1.953 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -15.045 8.707 0.537 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -16.390 9.762 0.151 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -15.006 11.068 1.424 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -16.158 10.552 2.560 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -14.626 9.822 2.513 1.00 0.00 H new ATOM 1681 N ALA A 107 -12.808 4.702 3.921 1.00 0.00 N ATOM 1682 CA ALA A 107 -12.099 3.470 4.244 1.00 0.00 C ATOM 1683 C ALA A 107 -12.802 2.307 3.553 1.00 0.00 C ATOM 1684 O ALA A 107 -13.942 1.993 3.897 1.00 0.00 O ATOM 1685 CB ALA A 107 -12.034 3.285 5.765 1.00 0.00 C ATOM 0 H ALA A 107 -13.040 5.255 4.746 1.00 0.00 H new ATOM 0 HA ALA A 107 -11.071 3.513 3.884 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -11.503 2.362 5.997 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -11.508 4.129 6.212 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -13.045 3.233 6.169 1.00 0.00 H new ATOM 1691 N SER A 108 -12.144 1.725 2.555 1.00 0.00 N ATOM 1692 CA SER A 108 -12.664 0.620 1.770 1.00 0.00 C ATOM 1693 C SER A 108 -11.724 -0.560 1.967 1.00 0.00 C ATOM 1694 O SER A 108 -10.504 -0.384 2.009 1.00 0.00 O ATOM 1695 CB SER A 108 -12.778 1.032 0.306 1.00 0.00 C ATOM 1696 OG SER A 108 -13.572 2.199 0.183 1.00 0.00 O ATOM 0 H SER A 108 -11.211 2.019 2.266 1.00 0.00 H new ATOM 0 HA SER A 108 -13.666 0.336 2.092 1.00 0.00 H new ATOM 0 HB2 SER A 108 -11.785 1.214 -0.106 1.00 0.00 H new ATOM 0 HB3 SER A 108 -13.219 0.221 -0.274 1.00 0.00 H new ATOM 0 HG SER A 108 -13.142 2.939 0.660 1.00 0.00 H new ATOM 1702 N VAL A 109 -12.309 -1.749 2.082 1.00 0.00 N ATOM 1703 CA VAL A 109 -11.604 -2.977 2.409 1.00 0.00 C ATOM 1704 C VAL A 109 -11.237 -3.724 1.128 1.00 0.00 C ATOM 1705 O VAL A 109 -12.106 -4.179 0.375 1.00 0.00 O ATOM 1706 CB VAL A 109 -12.434 -3.850 3.379 1.00 0.00 C ATOM 1707 CG1 VAL A 109 -11.596 -5.016 3.929 1.00 0.00 C ATOM 1708 CG2 VAL A 109 -12.980 -3.046 4.575 1.00 0.00 C ATOM 0 H VAL A 109 -13.311 -1.885 1.946 1.00 0.00 H new ATOM 0 HA VAL A 109 -10.677 -2.730 2.927 1.00 0.00 H new ATOM 0 HB VAL A 109 -13.273 -4.228 2.795 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -12.205 -5.613 4.608 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -11.255 -5.640 3.103 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -10.733 -4.622 4.466 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -13.555 -3.706 5.225 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -12.149 -2.618 5.136 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -13.623 -2.244 4.211 1.00 0.00 H new ATOM 1718 N VAL A 110 -9.941 -3.840 0.871 1.00 0.00 N ATOM 1719 CA VAL A 110 -9.390 -4.623 -0.210 1.00 0.00 C ATOM 1720 C VAL A 110 -9.093 -5.967 0.445 1.00 0.00 C ATOM 1721 O VAL A 110 -8.141 -6.097 1.212 1.00 0.00 O ATOM 1722 CB VAL A 110 -8.114 -3.953 -0.764 1.00 0.00 C ATOM 1723 CG1 VAL A 110 -7.427 -4.834 -1.820 1.00 0.00 C ATOM 1724 CG2 VAL A 110 -8.449 -2.596 -1.393 1.00 0.00 C ATOM 0 H VAL A 110 -9.227 -3.374 1.431 1.00 0.00 H new ATOM 0 HA VAL A 110 -10.058 -4.722 -1.066 1.00 0.00 H new ATOM 0 HB VAL A 110 -7.434 -3.815 0.076 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -6.533 -4.331 -2.188 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -7.148 -5.788 -1.372 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -8.112 -5.009 -2.650 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -7.538 -2.139 -1.778 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -9.157 -2.738 -2.210 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -8.891 -1.945 -0.639 1.00 0.00 H new ATOM 1734 N GLN A 111 -9.935 -6.965 0.193 1.00 0.00 N ATOM 1735 CA GLN A 111 -9.654 -8.308 0.657 1.00 0.00 C ATOM 1736 C GLN A 111 -8.846 -8.961 -0.462 1.00 0.00 C ATOM 1737 O GLN A 111 -9.268 -8.943 -1.620 1.00 0.00 O ATOM 1738 CB GLN A 111 -10.937 -9.068 1.026 1.00 0.00 C ATOM 1739 CG GLN A 111 -10.552 -10.467 1.525 1.00 0.00 C ATOM 1740 CD GLN A 111 -11.699 -11.257 2.141 1.00 0.00 C ATOM 1741 OE1 GLN A 111 -12.095 -12.298 1.620 1.00 0.00 O ATOM 1742 NE2 GLN A 111 -12.191 -10.841 3.295 1.00 0.00 N ATOM 0 H GLN A 111 -10.808 -6.865 -0.325 1.00 0.00 H new ATOM 0 HA GLN A 111 -9.083 -8.314 1.585 1.00 0.00 H new ATOM 0 HB2 GLN A 111 -11.487 -8.529 1.798 1.00 0.00 H new ATOM 0 HB3 GLN A 111 -11.594 -9.143 0.160 1.00 0.00 H new ATOM 0 HG2 GLN A 111 -10.143 -11.036 0.691 1.00 0.00 H new ATOM 0 HG3 GLN A 111 -9.757 -10.369 2.264 1.00 0.00 H new ATOM 0 HE21 GLN A 111 -11.850 -9.975 3.712 1.00 0.00 H new ATOM 0 HE22 GLN A 111 -12.911 -11.386 3.768 1.00 0.00 H new ATOM 1751 N VAL A 112 -7.674 -9.485 -0.135 1.00 0.00 N ATOM 1752 CA VAL A 112 -6.842 -10.251 -1.042 1.00 0.00 C ATOM 1753 C VAL A 112 -7.211 -11.704 -0.742 1.00 0.00 C ATOM 1754 O VAL A 112 -6.985 -12.157 0.379 1.00 0.00 O ATOM 1755 CB VAL A 112 -5.346 -9.964 -0.787 1.00 0.00 C ATOM 1756 CG1 VAL A 112 -4.524 -10.353 -2.025 1.00 0.00 C ATOM 1757 CG2 VAL A 112 -5.039 -8.487 -0.471 1.00 0.00 C ATOM 0 H VAL A 112 -7.267 -9.385 0.795 1.00 0.00 H new ATOM 0 HA VAL A 112 -7.005 -10.000 -2.090 1.00 0.00 H new ATOM 0 HB VAL A 112 -5.078 -10.557 0.088 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -3.469 -10.149 -1.840 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -4.657 -11.415 -2.231 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -4.861 -9.772 -2.883 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -3.969 -8.365 -0.304 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -5.349 -7.864 -1.310 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -5.582 -8.186 0.425 1.00 0.00 H new ATOM 1767 N GLY A 113 -7.830 -12.419 -1.681 1.00 0.00 N ATOM 1768 CA GLY A 113 -8.254 -13.791 -1.526 1.00 0.00 C ATOM 1769 C GLY A 113 -7.190 -14.727 -2.056 1.00 0.00 C ATOM 1770 O GLY A 113 -6.566 -14.424 -3.071 1.00 0.00 O ATOM 0 H GLY A 113 -8.053 -12.036 -2.600 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -8.446 -14.004 -0.474 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -9.190 -13.953 -2.060 1.00 0.00 H new ATOM 1774 N PHE A 114 -7.011 -15.887 -1.427 1.00 0.00 N ATOM 1775 CA PHE A 114 -5.939 -16.813 -1.761 1.00 0.00 C ATOM 1776 C PHE A 114 -6.499 -18.231 -1.976 1.00 0.00 C ATOM 1777 O PHE A 114 -6.319 -19.102 -1.108 1.00 0.00 O ATOM 1778 CB PHE A 114 -4.871 -16.812 -0.648 1.00 0.00 C ATOM 1779 CG PHE A 114 -4.533 -15.488 -0.016 1.00 0.00 C ATOM 1780 CD1 PHE A 114 -4.109 -14.408 -0.802 1.00 0.00 C ATOM 1781 CD2 PHE A 114 -4.636 -15.349 1.381 1.00 0.00 C ATOM 1782 CE1 PHE A 114 -3.803 -13.188 -0.187 1.00 0.00 C ATOM 1783 CE2 PHE A 114 -4.315 -14.130 1.988 1.00 0.00 C ATOM 1784 CZ PHE A 114 -3.902 -13.040 1.205 1.00 0.00 C ATOM 0 H PHE A 114 -7.611 -16.210 -0.668 1.00 0.00 H new ATOM 0 HA PHE A 114 -5.472 -16.488 -2.690 1.00 0.00 H new ATOM 0 HB2 PHE A 114 -5.205 -17.487 0.140 1.00 0.00 H new ATOM 0 HB3 PHE A 114 -3.954 -17.233 -1.060 1.00 0.00 H new ATOM 0 HD1 PHE A 114 -4.019 -14.516 -1.873 1.00 0.00 H new ATOM 0 HD2 PHE A 114 -4.963 -16.183 1.984 1.00 0.00 H new ATOM 0 HE1 PHE A 114 -3.487 -12.351 -0.791 1.00 0.00 H new ATOM 0 HE2 PHE A 114 -4.385 -14.027 3.061 1.00 0.00 H new ATOM 0 HZ PHE A 114 -3.662 -12.095 1.670 1.00 0.00 H new ATOM 1794 N PRO A 115 -7.183 -18.494 -3.100 1.00 0.00 N ATOM 1795 CA PRO A 115 -7.623 -19.839 -3.429 1.00 0.00 C ATOM 1796 C PRO A 115 -6.376 -20.689 -3.708 1.00 0.00 C ATOM 1797 O PRO A 115 -5.549 -20.323 -4.554 1.00 0.00 O ATOM 1798 CB PRO A 115 -8.546 -19.691 -4.643 1.00 0.00 C ATOM 1799 CG PRO A 115 -8.067 -18.404 -5.313 1.00 0.00 C ATOM 1800 CD PRO A 115 -7.576 -17.553 -4.141 1.00 0.00 C ATOM 0 HA PRO A 115 -8.171 -20.339 -2.630 1.00 0.00 H new ATOM 0 HB2 PRO A 115 -8.463 -20.546 -5.314 1.00 0.00 H new ATOM 0 HB3 PRO A 115 -9.592 -19.621 -4.344 1.00 0.00 H new ATOM 0 HG2 PRO A 115 -7.269 -18.598 -6.030 1.00 0.00 H new ATOM 0 HG3 PRO A 115 -8.872 -17.911 -5.857 1.00 0.00 H new ATOM 0 HD2 PRO A 115 -6.735 -16.927 -4.439 1.00 0.00 H new ATOM 0 HD3 PRO A 115 -8.362 -16.885 -3.787 1.00 0.00 H new ATOM 1808 N CYS A 116 -6.224 -21.784 -2.951 1.00 0.00 N ATOM 1809 CA CYS A 116 -5.181 -22.786 -3.140 1.00 0.00 C ATOM 1810 C CYS A 116 -5.824 -24.024 -3.755 1.00 0.00 C ATOM 1811 O CYS A 116 -7.004 -24.266 -3.505 1.00 0.00 O ATOM 1812 CB CYS A 116 -4.494 -23.157 -1.812 1.00 0.00 C ATOM 1813 SG CYS A 116 -2.864 -23.908 -2.035 1.00 0.00 S ATOM 0 H CYS A 116 -6.844 -21.998 -2.170 1.00 0.00 H new ATOM 0 HA CYS A 116 -4.411 -22.378 -3.795 1.00 0.00 H new ATOM 0 HB2 CYS A 116 -4.393 -22.260 -1.201 1.00 0.00 H new ATOM 0 HB3 CYS A 116 -5.132 -23.848 -1.261 1.00 0.00 H new ATOM 1818 N LEU A 117 -5.064 -24.829 -4.503 1.00 0.00 N ATOM 1819 CA LEU A 117 -5.636 -25.979 -5.208 1.00 0.00 C ATOM 1820 C LEU A 117 -5.806 -27.193 -4.285 1.00 0.00 C ATOM 1821 O LEU A 117 -6.424 -28.172 -4.686 1.00 0.00 O ATOM 1822 CB LEU A 117 -4.824 -26.363 -6.458 1.00 0.00 C ATOM 1823 CG LEU A 117 -4.432 -25.236 -7.441 1.00 0.00 C ATOM 1824 CD1 LEU A 117 -4.191 -25.830 -8.827 1.00 0.00 C ATOM 1825 CD2 LEU A 117 -5.399 -24.052 -7.585 1.00 0.00 C ATOM 0 H LEU A 117 -4.060 -24.707 -4.635 1.00 0.00 H new ATOM 0 HA LEU A 117 -6.626 -25.665 -5.540 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -3.907 -26.850 -6.125 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -5.396 -27.107 -7.013 1.00 0.00 H new ATOM 0 HG LEU A 117 -3.537 -24.808 -6.990 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -3.915 -25.036 -9.520 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -3.385 -26.562 -8.774 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -5.101 -26.317 -9.177 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -4.997 -23.340 -8.306 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -6.367 -24.413 -7.933 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -5.520 -23.562 -6.619 1.00 0.00 H new ATOM 1837 N GLY A 118 -5.243 -27.139 -3.073 1.00 0.00 N ATOM 1838 CA GLY A 118 -5.384 -28.111 -2.006 1.00 0.00 C ATOM 1839 C GLY A 118 -5.040 -29.532 -2.394 1.00 0.00 C ATOM 1840 O GLY A 118 -5.775 -30.427 -2.005 1.00 0.00 O ATOM 0 H GLY A 118 -4.640 -26.362 -2.803 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -4.746 -27.812 -1.174 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -6.412 -28.087 -1.645 1.00 0.00 H new ATOM 1844 N LYS A 119 -3.960 -29.768 -3.144 1.00 0.00 N ATOM 1845 CA LYS A 119 -3.517 -31.144 -3.432 1.00 0.00 C ATOM 1846 C LYS A 119 -2.059 -31.391 -3.085 1.00 0.00 C ATOM 1847 O LYS A 119 -1.713 -32.528 -2.794 1.00 0.00 O ATOM 1848 CB LYS A 119 -3.923 -31.604 -4.836 1.00 0.00 C ATOM 1849 CG LYS A 119 -5.457 -31.733 -4.876 1.00 0.00 C ATOM 1850 CD LYS A 119 -5.980 -32.730 -5.906 1.00 0.00 C ATOM 1851 CE LYS A 119 -7.513 -32.799 -5.816 1.00 0.00 C ATOM 1852 NZ LYS A 119 -8.001 -33.405 -4.560 1.00 0.00 N ATOM 0 H LYS A 119 -3.380 -29.039 -3.560 1.00 0.00 H new ATOM 0 HA LYS A 119 -4.063 -31.796 -2.750 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -3.582 -30.888 -5.584 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -3.455 -32.559 -5.073 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -5.810 -32.031 -3.889 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -5.886 -30.753 -5.086 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -5.677 -32.427 -6.908 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -5.549 -33.715 -5.726 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -7.920 -31.792 -5.907 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -7.893 -33.374 -6.660 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -9.040 -33.375 -4.541 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -7.682 -34.393 -4.505 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -7.624 -32.874 -3.749 1.00 0.00 H new ATOM 1866 N GLN A 120 -1.204 -30.375 -3.163 1.00 0.00 N ATOM 1867 CA GLN A 120 0.172 -30.492 -2.705 1.00 0.00 C ATOM 1868 C GLN A 120 0.160 -29.921 -1.281 1.00 0.00 C ATOM 1869 O GLN A 120 -0.649 -29.041 -0.967 1.00 0.00 O ATOM 1870 CB GLN A 120 1.128 -29.753 -3.654 1.00 0.00 C ATOM 1871 CG GLN A 120 2.609 -29.820 -3.240 1.00 0.00 C ATOM 1872 CD GLN A 120 3.144 -31.229 -3.008 1.00 0.00 C ATOM 1873 OE1 GLN A 120 3.123 -32.079 -3.888 1.00 0.00 O ATOM 1874 NE2 GLN A 120 3.637 -31.506 -1.809 1.00 0.00 N ATOM 0 H GLN A 120 -1.444 -29.459 -3.541 1.00 0.00 H new ATOM 0 HA GLN A 120 0.537 -31.519 -2.700 1.00 0.00 H new ATOM 0 HB2 GLN A 120 1.023 -30.172 -4.655 1.00 0.00 H new ATOM 0 HB3 GLN A 120 0.826 -28.707 -3.713 1.00 0.00 H new ATOM 0 HG2 GLN A 120 3.210 -29.341 -4.013 1.00 0.00 H new ATOM 0 HG3 GLN A 120 2.743 -29.240 -2.327 1.00 0.00 H new ATOM 0 HE21 GLN A 120 3.649 -30.788 -1.084 1.00 0.00 H new ATOM 0 HE22 GLN A 120 4.005 -32.437 -1.611 1.00 0.00 H new ATOM 1883 N ASP A 121 1.090 -30.370 -0.446 1.00 0.00 N ATOM 1884 CA ASP A 121 1.264 -29.903 0.923 1.00 0.00 C ATOM 1885 C ASP A 121 2.546 -29.083 0.937 1.00 0.00 C ATOM 1886 O ASP A 121 3.509 -29.454 0.252 1.00 0.00 O ATOM 1887 CB ASP A 121 1.396 -31.063 1.925 1.00 0.00 C ATOM 1888 CG ASP A 121 0.216 -32.027 1.917 1.00 0.00 C ATOM 1889 OD1 ASP A 121 -0.754 -31.731 2.645 1.00 0.00 O ATOM 1890 OD2 ASP A 121 0.278 -33.042 1.188 1.00 0.00 O ATOM 0 H ASP A 121 1.763 -31.090 -0.711 1.00 0.00 H new ATOM 0 HA ASP A 121 0.391 -29.325 1.224 1.00 0.00 H new ATOM 0 HB2 ASP A 121 2.307 -31.619 1.704 1.00 0.00 H new ATOM 0 HB3 ASP A 121 1.509 -30.652 2.928 1.00 0.00 H new ATOM 1895 N GLY A 122 2.596 -28.000 1.714 1.00 0.00 N ATOM 1896 CA GLY A 122 3.789 -27.165 1.821 1.00 0.00 C ATOM 1897 C GLY A 122 3.423 -25.694 1.912 1.00 0.00 C ATOM 1898 O GLY A 122 2.338 -25.345 2.375 1.00 0.00 O ATOM 0 H GLY A 122 1.813 -27.680 2.284 1.00 0.00 H new ATOM 0 HA2 GLY A 122 4.361 -27.455 2.702 1.00 0.00 H new ATOM 0 HA3 GLY A 122 4.431 -27.330 0.955 1.00 0.00 H new ATOM 1902 N VAL A 123 4.345 -24.821 1.503 1.00 0.00 N ATOM 1903 CA VAL A 123 4.169 -23.376 1.574 1.00 0.00 C ATOM 1904 C VAL A 123 4.514 -22.756 0.219 1.00 0.00 C ATOM 1905 O VAL A 123 5.663 -22.830 -0.212 1.00 0.00 O ATOM 1906 CB VAL A 123 5.017 -22.780 2.724 1.00 0.00 C ATOM 1907 CG1 VAL A 123 4.637 -21.316 2.981 1.00 0.00 C ATOM 1908 CG2 VAL A 123 4.872 -23.541 4.053 1.00 0.00 C ATOM 0 H VAL A 123 5.243 -25.104 1.110 1.00 0.00 H new ATOM 0 HA VAL A 123 3.128 -23.142 1.797 1.00 0.00 H new ATOM 0 HB VAL A 123 6.051 -22.867 2.389 1.00 0.00 H new ATOM 0 HG11 VAL A 123 5.246 -20.919 3.793 1.00 0.00 H new ATOM 0 HG12 VAL A 123 4.811 -20.731 2.078 1.00 0.00 H new ATOM 0 HG13 VAL A 123 3.584 -21.256 3.255 1.00 0.00 H new ATOM 0 HG21 VAL A 123 5.494 -23.068 4.813 1.00 0.00 H new ATOM 0 HG22 VAL A 123 3.830 -23.520 4.372 1.00 0.00 H new ATOM 0 HG23 VAL A 123 5.189 -24.575 3.917 1.00 0.00 H new ATOM 1918 N ALA A 124 3.511 -22.185 -0.451 1.00 0.00 N ATOM 1919 CA ALA A 124 3.685 -21.426 -1.689 1.00 0.00 C ATOM 1920 C ALA A 124 3.945 -19.973 -1.278 1.00 0.00 C ATOM 1921 O ALA A 124 3.740 -19.597 -0.122 1.00 0.00 O ATOM 1922 CB ALA A 124 2.453 -21.538 -2.619 1.00 0.00 C ATOM 0 H ALA A 124 2.540 -22.238 -0.143 1.00 0.00 H new ATOM 0 HA ALA A 124 4.520 -21.826 -2.265 1.00 0.00 H new ATOM 0 HB1 ALA A 124 2.628 -20.959 -3.526 1.00 0.00 H new ATOM 0 HB2 ALA A 124 2.290 -22.583 -2.882 1.00 0.00 H new ATOM 0 HB3 ALA A 124 1.573 -21.151 -2.105 1.00 0.00 H new ATOM 1928 N ALA A 125 4.359 -19.132 -2.220 1.00 0.00 N ATOM 1929 CA ALA A 125 4.524 -17.690 -2.009 1.00 0.00 C ATOM 1930 C ALA A 125 3.760 -16.920 -3.080 1.00 0.00 C ATOM 1931 O ALA A 125 3.461 -17.496 -4.125 1.00 0.00 O ATOM 1932 CB ALA A 125 6.013 -17.319 -1.998 1.00 0.00 C ATOM 0 H ALA A 125 4.594 -19.433 -3.166 1.00 0.00 H new ATOM 0 HA ALA A 125 4.111 -17.417 -1.038 1.00 0.00 H new ATOM 0 HB1 ALA A 125 6.119 -16.246 -1.840 1.00 0.00 H new ATOM 0 HB2 ALA A 125 6.516 -17.855 -1.193 1.00 0.00 H new ATOM 0 HB3 ALA A 125 6.463 -17.592 -2.952 1.00 0.00 H new ATOM 1938 N PHE A 126 3.457 -15.640 -2.846 1.00 0.00 N ATOM 1939 CA PHE A 126 2.846 -14.756 -3.835 1.00 0.00 C ATOM 1940 C PHE A 126 3.356 -13.327 -3.628 1.00 0.00 C ATOM 1941 O PHE A 126 3.725 -12.954 -2.513 1.00 0.00 O ATOM 1942 CB PHE A 126 1.309 -14.879 -3.818 1.00 0.00 C ATOM 1943 CG PHE A 126 0.554 -14.156 -2.728 1.00 0.00 C ATOM 1944 CD1 PHE A 126 0.214 -12.797 -2.888 1.00 0.00 C ATOM 1945 CD2 PHE A 126 0.114 -14.865 -1.596 1.00 0.00 C ATOM 1946 CE1 PHE A 126 -0.496 -12.136 -1.875 1.00 0.00 C ATOM 1947 CE2 PHE A 126 -0.600 -14.201 -0.587 1.00 0.00 C ATOM 1948 CZ PHE A 126 -0.855 -12.825 -0.705 1.00 0.00 C ATOM 0 H PHE A 126 3.633 -15.185 -1.950 1.00 0.00 H new ATOM 0 HA PHE A 126 3.145 -15.058 -4.839 1.00 0.00 H new ATOM 0 HB2 PHE A 126 0.934 -14.522 -4.777 1.00 0.00 H new ATOM 0 HB3 PHE A 126 1.059 -15.938 -3.752 1.00 0.00 H new ATOM 0 HD1 PHE A 126 0.499 -12.268 -3.786 1.00 0.00 H new ATOM 0 HD2 PHE A 126 0.326 -15.920 -1.503 1.00 0.00 H new ATOM 0 HE1 PHE A 126 -0.767 -11.097 -1.995 1.00 0.00 H new ATOM 0 HE2 PHE A 126 -0.952 -14.746 0.277 1.00 0.00 H new ATOM 0 HZ PHE A 126 -1.329 -12.294 0.107 1.00 0.00 H new ATOM 1958 N GLU A 127 3.383 -12.538 -4.699 1.00 0.00 N ATOM 1959 CA GLU A 127 3.939 -11.197 -4.787 1.00 0.00 C ATOM 1960 C GLU A 127 2.858 -10.138 -4.996 1.00 0.00 C ATOM 1961 O GLU A 127 1.833 -10.424 -5.633 1.00 0.00 O ATOM 1962 CB GLU A 127 4.944 -11.153 -5.959 1.00 0.00 C ATOM 1963 CG GLU A 127 4.382 -11.711 -7.288 1.00 0.00 C ATOM 1964 CD GLU A 127 5.156 -11.289 -8.539 1.00 0.00 C ATOM 1965 OE1 GLU A 127 6.390 -11.123 -8.461 1.00 0.00 O ATOM 1966 OE2 GLU A 127 4.492 -11.122 -9.594 1.00 0.00 O ATOM 0 H GLU A 127 2.988 -12.843 -5.589 1.00 0.00 H new ATOM 0 HA GLU A 127 4.435 -10.971 -3.843 1.00 0.00 H new ATOM 0 HB2 GLU A 127 5.261 -10.122 -6.114 1.00 0.00 H new ATOM 0 HB3 GLU A 127 5.832 -11.722 -5.684 1.00 0.00 H new ATOM 0 HG2 GLU A 127 4.372 -12.800 -7.234 1.00 0.00 H new ATOM 0 HG3 GLU A 127 3.346 -11.388 -7.392 1.00 0.00 H new ATOM 1973 N VAL A 128 3.120 -8.919 -4.493 1.00 0.00 N ATOM 1974 CA VAL A 128 2.284 -7.738 -4.691 1.00 0.00 C ATOM 1975 C VAL A 128 3.177 -6.508 -4.939 1.00 0.00 C ATOM 1976 O VAL A 128 4.224 -6.362 -4.308 1.00 0.00 O ATOM 1977 CB VAL A 128 1.353 -7.543 -3.471 1.00 0.00 C ATOM 1978 CG1 VAL A 128 0.476 -6.286 -3.601 1.00 0.00 C ATOM 1979 CG2 VAL A 128 0.444 -8.770 -3.271 1.00 0.00 C ATOM 0 H VAL A 128 3.944 -8.730 -3.922 1.00 0.00 H new ATOM 0 HA VAL A 128 1.651 -7.871 -5.568 1.00 0.00 H new ATOM 0 HB VAL A 128 2.004 -7.420 -2.605 1.00 0.00 H new ATOM 0 HG11 VAL A 128 -0.160 -6.193 -2.720 1.00 0.00 H new ATOM 0 HG12 VAL A 128 1.113 -5.405 -3.684 1.00 0.00 H new ATOM 0 HG13 VAL A 128 -0.147 -6.368 -4.491 1.00 0.00 H new ATOM 0 HG21 VAL A 128 -0.201 -8.608 -2.407 1.00 0.00 H new ATOM 0 HG22 VAL A 128 -0.170 -8.917 -4.160 1.00 0.00 H new ATOM 0 HG23 VAL A 128 1.058 -9.655 -3.104 1.00 0.00 H new ATOM 1989 N ASP A 129 2.757 -5.623 -5.848 1.00 0.00 N ATOM 1990 CA ASP A 129 3.350 -4.322 -6.172 1.00 0.00 C ATOM 1991 C ASP A 129 2.214 -3.495 -6.769 1.00 0.00 C ATOM 1992 O ASP A 129 1.602 -3.919 -7.750 1.00 0.00 O ATOM 1993 CB ASP A 129 4.495 -4.447 -7.190 1.00 0.00 C ATOM 1994 CG ASP A 129 5.197 -3.120 -7.515 1.00 0.00 C ATOM 1995 OD1 ASP A 129 4.691 -2.026 -7.184 1.00 0.00 O ATOM 1996 OD2 ASP A 129 6.284 -3.204 -8.128 1.00 0.00 O ATOM 0 H ASP A 129 1.933 -5.811 -6.419 1.00 0.00 H new ATOM 0 HA ASP A 129 3.782 -3.865 -5.282 1.00 0.00 H new ATOM 0 HB2 ASP A 129 5.233 -5.151 -6.805 1.00 0.00 H new ATOM 0 HB3 ASP A 129 4.101 -4.872 -8.113 1.00 0.00 H new ATOM 2001 N VAL A 130 1.856 -2.371 -6.160 1.00 0.00 N ATOM 2002 CA VAL A 130 0.808 -1.487 -6.631 1.00 0.00 C ATOM 2003 C VAL A 130 1.422 -0.112 -6.653 1.00 0.00 C ATOM 2004 O VAL A 130 1.983 0.338 -5.644 1.00 0.00 O ATOM 2005 CB VAL A 130 -0.430 -1.560 -5.725 1.00 0.00 C ATOM 2006 CG1 VAL A 130 -1.613 -0.715 -6.218 1.00 0.00 C ATOM 2007 CG2 VAL A 130 -0.900 -3.005 -5.686 1.00 0.00 C ATOM 0 H VAL A 130 2.301 -2.045 -5.302 1.00 0.00 H new ATOM 0 HA VAL A 130 0.451 -1.768 -7.622 1.00 0.00 H new ATOM 0 HB VAL A 130 -0.129 -1.172 -4.752 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -2.448 -0.819 -5.525 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -1.315 0.332 -6.272 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -1.917 -1.057 -7.207 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -1.780 -3.084 -5.048 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -1.152 -3.333 -6.694 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -0.105 -3.636 -5.288 1.00 0.00 H new ATOM 2017 N ILE A 131 1.346 0.520 -7.815 1.00 0.00 N ATOM 2018 CA ILE A 131 1.773 1.895 -7.954 1.00 0.00 C ATOM 2019 C ILE A 131 0.553 2.782 -7.729 1.00 0.00 C ATOM 2020 O ILE A 131 -0.599 2.348 -7.816 1.00 0.00 O ATOM 2021 CB ILE A 131 2.511 2.160 -9.282 1.00 0.00 C ATOM 2022 CG1 ILE A 131 1.615 2.358 -10.511 1.00 0.00 C ATOM 2023 CG2 ILE A 131 3.597 1.109 -9.580 1.00 0.00 C ATOM 2024 CD1 ILE A 131 0.692 1.168 -10.780 1.00 0.00 C ATOM 0 H ILE A 131 0.992 0.098 -8.673 1.00 0.00 H new ATOM 0 HA ILE A 131 2.524 2.135 -7.202 1.00 0.00 H new ATOM 0 HB ILE A 131 2.987 3.124 -9.104 1.00 0.00 H new ATOM 0 HG12 ILE A 131 1.011 3.254 -10.372 1.00 0.00 H new ATOM 0 HG13 ILE A 131 2.242 2.529 -11.386 1.00 0.00 H new ATOM 0 HG21 ILE A 131 4.083 1.346 -10.526 1.00 0.00 H new ATOM 0 HG22 ILE A 131 4.338 1.114 -8.780 1.00 0.00 H new ATOM 0 HG23 ILE A 131 3.140 0.122 -9.644 1.00 0.00 H new ATOM 0 HD11 ILE A 131 0.085 1.371 -11.662 1.00 0.00 H new ATOM 0 HD12 ILE A 131 1.292 0.274 -10.950 1.00 0.00 H new ATOM 0 HD13 ILE A 131 0.041 1.011 -9.920 1.00 0.00 H new ATOM 2036 N VAL A 132 0.824 4.043 -7.443 1.00 0.00 N ATOM 2037 CA VAL A 132 -0.154 5.061 -7.149 1.00 0.00 C ATOM 2038 C VAL A 132 0.291 6.308 -7.886 1.00 0.00 C ATOM 2039 O VAL A 132 1.470 6.683 -7.886 1.00 0.00 O ATOM 2040 CB VAL A 132 -0.296 5.247 -5.629 1.00 0.00 C ATOM 2041 CG1 VAL A 132 -0.892 6.605 -5.246 1.00 0.00 C ATOM 2042 CG2 VAL A 132 -1.181 4.162 -4.998 1.00 0.00 C ATOM 0 H VAL A 132 1.780 4.396 -7.409 1.00 0.00 H new ATOM 0 HA VAL A 132 -1.154 4.791 -7.488 1.00 0.00 H new ATOM 0 HB VAL A 132 0.723 5.178 -5.247 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -0.967 6.676 -4.161 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -0.249 7.403 -5.618 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -1.884 6.704 -5.686 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -1.254 4.332 -3.924 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -2.176 4.202 -5.440 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -0.741 3.182 -5.181 1.00 0.00 H new ATOM 2052 N MET A 133 -0.672 6.946 -8.529 1.00 0.00 N ATOM 2053 CA MET A 133 -0.477 8.113 -9.362 1.00 0.00 C ATOM 2054 C MET A 133 -1.595 9.099 -9.073 1.00 0.00 C ATOM 2055 O MET A 133 -2.487 8.831 -8.268 1.00 0.00 O ATOM 2056 CB MET A 133 -0.538 7.719 -10.853 1.00 0.00 C ATOM 2057 CG MET A 133 0.317 6.514 -11.277 1.00 0.00 C ATOM 2058 SD MET A 133 -0.599 5.162 -12.064 1.00 0.00 S ATOM 2059 CE MET A 133 -1.855 4.782 -10.810 1.00 0.00 C ATOM 0 H MET A 133 -1.647 6.651 -8.481 1.00 0.00 H new ATOM 0 HA MET A 133 0.497 8.554 -9.148 1.00 0.00 H new ATOM 0 HB2 MET A 133 -1.576 7.508 -11.108 1.00 0.00 H new ATOM 0 HB3 MET A 133 -0.233 8.581 -11.447 1.00 0.00 H new ATOM 0 HG2 MET A 133 1.088 6.859 -11.966 1.00 0.00 H new ATOM 0 HG3 MET A 133 0.828 6.123 -10.397 1.00 0.00 H new ATOM 0 HE1 MET A 133 -2.419 3.901 -11.115 1.00 0.00 H new ATOM 0 HE2 MET A 133 -1.368 4.588 -9.854 1.00 0.00 H new ATOM 0 HE3 MET A 133 -2.533 5.629 -10.706 1.00 0.00 H new ATOM 2069 N ASN A 134 -1.516 10.280 -9.665 1.00 0.00 N ATOM 2070 CA ASN A 134 -2.594 11.250 -9.593 1.00 0.00 C ATOM 2071 C ASN A 134 -3.486 10.927 -10.812 1.00 0.00 C ATOM 2072 O ASN A 134 -3.154 10.049 -11.614 1.00 0.00 O ATOM 2073 CB ASN A 134 -2.044 12.686 -9.554 1.00 0.00 C ATOM 2074 CG ASN A 134 -1.520 13.212 -10.886 1.00 0.00 C ATOM 2075 OD1 ASN A 134 -1.353 12.476 -11.851 1.00 0.00 O ATOM 2076 ND2 ASN A 134 -1.276 14.506 -10.958 1.00 0.00 N ATOM 0 H ASN A 134 -0.708 10.591 -10.205 1.00 0.00 H new ATOM 0 HA ASN A 134 -3.182 11.187 -8.677 1.00 0.00 H new ATOM 0 HB2 ASN A 134 -2.832 13.352 -9.203 1.00 0.00 H new ATOM 0 HB3 ASN A 134 -1.239 12.731 -8.821 1.00 0.00 H new ATOM 0 HD21 ASN A 134 -0.941 14.914 -11.831 1.00 0.00 H new ATOM 0 HD22 ASN A 134 -1.423 15.099 -10.141 1.00 0.00 H new ATOM 2083 N SER A 135 -4.620 11.603 -10.989 1.00 0.00 N ATOM 2084 CA SER A 135 -5.524 11.300 -12.103 1.00 0.00 C ATOM 2085 C SER A 135 -4.925 11.613 -13.495 1.00 0.00 C ATOM 2086 O SER A 135 -5.610 11.364 -14.486 1.00 0.00 O ATOM 2087 CB SER A 135 -6.849 12.046 -11.887 1.00 0.00 C ATOM 2088 OG SER A 135 -7.847 11.565 -12.763 1.00 0.00 O ATOM 0 H SER A 135 -4.935 12.359 -10.381 1.00 0.00 H new ATOM 0 HA SER A 135 -5.694 10.223 -12.104 1.00 0.00 H new ATOM 0 HB2 SER A 135 -7.176 11.923 -10.854 1.00 0.00 H new ATOM 0 HB3 SER A 135 -6.701 13.114 -12.050 1.00 0.00 H new ATOM 0 HG SER A 135 -7.449 11.369 -13.637 1.00 0.00 H new ATOM 2094 N GLU A 136 -3.717 12.182 -13.606 1.00 0.00 N ATOM 2095 CA GLU A 136 -3.027 12.390 -14.877 1.00 0.00 C ATOM 2096 C GLU A 136 -2.157 11.172 -15.226 1.00 0.00 C ATOM 2097 O GLU A 136 -1.696 11.056 -16.360 1.00 0.00 O ATOM 2098 CB GLU A 136 -2.087 13.608 -14.820 1.00 0.00 C ATOM 2099 CG GLU A 136 -2.693 14.912 -14.282 1.00 0.00 C ATOM 2100 CD GLU A 136 -1.603 15.978 -14.118 1.00 0.00 C ATOM 2101 OE1 GLU A 136 -0.647 15.708 -13.347 1.00 0.00 O ATOM 2102 OE2 GLU A 136 -1.727 17.055 -14.738 1.00 0.00 O ATOM 0 H GLU A 136 -3.187 12.514 -12.800 1.00 0.00 H new ATOM 0 HA GLU A 136 -3.803 12.548 -15.626 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -1.229 13.349 -14.200 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -1.709 13.796 -15.825 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -3.463 15.272 -14.964 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -3.178 14.727 -13.323 1.00 0.00 H new ATOM 2109 N GLY A 137 -1.905 10.282 -14.259 1.00 0.00 N ATOM 2110 CA GLY A 137 -0.997 9.153 -14.392 1.00 0.00 C ATOM 2111 C GLY A 137 0.408 9.479 -13.875 1.00 0.00 C ATOM 2112 O GLY A 137 1.275 8.606 -13.900 1.00 0.00 O ATOM 0 H GLY A 137 -2.343 10.335 -13.339 1.00 0.00 H new ATOM 0 HA2 GLY A 137 -1.396 8.301 -13.842 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -0.938 8.857 -15.439 1.00 0.00 H new ATOM 2116 N ASN A 138 0.660 10.696 -13.368 1.00 0.00 N ATOM 2117 CA ASN A 138 1.947 11.024 -12.756 1.00 0.00 C ATOM 2118 C ASN A 138 2.060 10.262 -11.443 1.00 0.00 C ATOM 2119 O ASN A 138 1.261 10.463 -10.527 1.00 0.00 O ATOM 2120 CB ASN A 138 2.130 12.521 -12.495 1.00 0.00 C ATOM 2121 CG ASN A 138 2.434 13.303 -13.767 1.00 0.00 C ATOM 2122 OD1 ASN A 138 3.423 13.023 -14.436 1.00 0.00 O ATOM 2123 ND2 ASN A 138 1.642 14.297 -14.136 1.00 0.00 N ATOM 0 H ASN A 138 -0.012 11.464 -13.372 1.00 0.00 H new ATOM 0 HA ASN A 138 2.730 10.735 -13.457 1.00 0.00 H new ATOM 0 HB2 ASN A 138 1.226 12.919 -12.035 1.00 0.00 H new ATOM 0 HB3 ASN A 138 2.941 12.665 -11.781 1.00 0.00 H new ATOM 0 HD21 ASN A 138 1.854 14.832 -14.978 1.00 0.00 H new ATOM 0 HD22 ASN A 138 0.820 14.528 -13.578 1.00 0.00 H new ATOM 2130 N THR A 139 3.026 9.356 -11.377 1.00 0.00 N ATOM 2131 CA THR A 139 3.270 8.452 -10.258 1.00 0.00 C ATOM 2132 C THR A 139 3.769 9.270 -9.061 1.00 0.00 C ATOM 2133 O THR A 139 4.525 10.227 -9.236 1.00 0.00 O ATOM 2134 CB THR A 139 4.305 7.400 -10.684 1.00 0.00 C ATOM 2135 OG1 THR A 139 4.099 6.984 -12.025 1.00 0.00 O ATOM 2136 CG2 THR A 139 4.268 6.151 -9.794 1.00 0.00 C ATOM 0 H THR A 139 3.693 9.224 -12.137 1.00 0.00 H new ATOM 0 HA THR A 139 2.354 7.937 -9.968 1.00 0.00 H new ATOM 0 HB THR A 139 5.275 7.886 -10.583 1.00 0.00 H new ATOM 0 HG1 THR A 139 4.774 6.316 -12.268 1.00 0.00 H new ATOM 0 HG21 THR A 139 5.018 5.438 -10.136 1.00 0.00 H new ATOM 0 HG22 THR A 139 4.479 6.433 -8.762 1.00 0.00 H new ATOM 0 HG23 THR A 139 3.280 5.693 -9.850 1.00 0.00 H new ATOM 2144 N ILE A 140 3.365 8.880 -7.852 1.00 0.00 N ATOM 2145 CA ILE A 140 3.639 9.601 -6.612 1.00 0.00 C ATOM 2146 C ILE A 140 3.982 8.689 -5.431 1.00 0.00 C ATOM 2147 O ILE A 140 4.836 9.032 -4.619 1.00 0.00 O ATOM 2148 CB ILE A 140 2.512 10.572 -6.259 1.00 0.00 C ATOM 2149 CG1 ILE A 140 1.110 9.932 -6.300 1.00 0.00 C ATOM 2150 CG2 ILE A 140 2.689 11.862 -7.100 1.00 0.00 C ATOM 2151 CD1 ILE A 140 0.029 10.958 -6.588 1.00 0.00 C ATOM 0 H ILE A 140 2.822 8.029 -7.706 1.00 0.00 H new ATOM 0 HA ILE A 140 4.539 10.184 -6.809 1.00 0.00 H new ATOM 0 HB ILE A 140 2.588 10.858 -5.210 1.00 0.00 H new ATOM 0 HG12 ILE A 140 1.087 9.156 -7.065 1.00 0.00 H new ATOM 0 HG13 ILE A 140 0.905 9.446 -5.346 1.00 0.00 H new ATOM 0 HG21 ILE A 140 1.892 12.565 -6.859 1.00 0.00 H new ATOM 0 HG22 ILE A 140 3.654 12.315 -6.872 1.00 0.00 H new ATOM 0 HG23 ILE A 140 2.646 11.614 -8.160 1.00 0.00 H new ATOM 0 HD11 ILE A 140 -0.943 10.466 -6.608 1.00 0.00 H new ATOM 0 HD12 ILE A 140 0.034 11.720 -5.809 1.00 0.00 H new ATOM 0 HD13 ILE A 140 0.219 11.426 -7.554 1.00 0.00 H new ATOM 2163 N LEU A 141 3.323 7.538 -5.327 1.00 0.00 N ATOM 2164 CA LEU A 141 3.513 6.545 -4.263 1.00 0.00 C ATOM 2165 C LEU A 141 3.632 5.179 -4.948 1.00 0.00 C ATOM 2166 O LEU A 141 3.069 4.982 -6.024 1.00 0.00 O ATOM 2167 CB LEU A 141 2.344 6.709 -3.256 1.00 0.00 C ATOM 2168 CG LEU A 141 2.198 5.785 -2.025 1.00 0.00 C ATOM 2169 CD1 LEU A 141 1.721 4.361 -2.330 1.00 0.00 C ATOM 2170 CD2 LEU A 141 3.479 5.756 -1.190 1.00 0.00 C ATOM 0 H LEU A 141 2.615 7.257 -6.005 1.00 0.00 H new ATOM 0 HA LEU A 141 4.421 6.668 -3.673 1.00 0.00 H new ATOM 0 HB2 LEU A 141 2.392 7.731 -2.880 1.00 0.00 H new ATOM 0 HB3 LEU A 141 1.420 6.622 -3.828 1.00 0.00 H new ATOM 0 HG LEU A 141 1.395 6.238 -1.444 1.00 0.00 H new ATOM 0 HD11 LEU A 141 1.651 3.794 -1.402 1.00 0.00 H new ATOM 0 HD12 LEU A 141 0.741 4.400 -2.806 1.00 0.00 H new ATOM 0 HD13 LEU A 141 2.431 3.875 -2.999 1.00 0.00 H new ATOM 0 HD21 LEU A 141 3.340 5.097 -0.333 1.00 0.00 H new ATOM 0 HD22 LEU A 141 4.303 5.388 -1.801 1.00 0.00 H new ATOM 0 HD23 LEU A 141 3.708 6.763 -0.840 1.00 0.00 H new ATOM 2182 N GLN A 142 4.386 4.235 -4.385 1.00 0.00 N ATOM 2183 CA GLN A 142 4.492 2.877 -4.908 1.00 0.00 C ATOM 2184 C GLN A 142 4.701 1.923 -3.744 1.00 0.00 C ATOM 2185 O GLN A 142 5.274 2.304 -2.724 1.00 0.00 O ATOM 2186 CB GLN A 142 5.603 2.817 -5.959 1.00 0.00 C ATOM 2187 CG GLN A 142 5.833 1.462 -6.653 1.00 0.00 C ATOM 2188 CD GLN A 142 6.995 0.611 -6.145 1.00 0.00 C ATOM 2189 OE1 GLN A 142 7.813 1.025 -5.327 1.00 0.00 O ATOM 2190 NE2 GLN A 142 7.112 -0.598 -6.661 1.00 0.00 N ATOM 0 H GLN A 142 4.944 4.395 -3.546 1.00 0.00 H new ATOM 0 HA GLN A 142 3.577 2.572 -5.415 1.00 0.00 H new ATOM 0 HB2 GLN A 142 5.384 3.559 -6.727 1.00 0.00 H new ATOM 0 HB3 GLN A 142 6.537 3.117 -5.483 1.00 0.00 H new ATOM 0 HG2 GLN A 142 4.919 0.876 -6.562 1.00 0.00 H new ATOM 0 HG3 GLN A 142 5.988 1.648 -7.716 1.00 0.00 H new ATOM 0 HE21 GLN A 142 6.427 -0.931 -7.339 1.00 0.00 H new ATOM 0 HE22 GLN A 142 7.887 -1.199 -6.381 1.00 0.00 H new ATOM 2199 N THR A 143 4.200 0.702 -3.888 1.00 0.00 N ATOM 2200 CA THR A 143 4.400 -0.356 -2.910 1.00 0.00 C ATOM 2201 C THR A 143 5.796 -0.912 -3.184 1.00 0.00 C ATOM 2202 O THR A 143 5.981 -1.555 -4.213 1.00 0.00 O ATOM 2203 CB THR A 143 3.310 -1.422 -3.084 1.00 0.00 C ATOM 2204 OG1 THR A 143 2.035 -0.811 -3.077 1.00 0.00 O ATOM 2205 CG2 THR A 143 3.341 -2.471 -1.969 1.00 0.00 C ATOM 0 H THR A 143 3.640 0.418 -4.692 1.00 0.00 H new ATOM 0 HA THR A 143 4.330 -0.003 -1.881 1.00 0.00 H new ATOM 0 HB THR A 143 3.502 -1.918 -4.035 1.00 0.00 H new ATOM 0 HG1 THR A 143 1.883 -0.361 -3.934 1.00 0.00 H new ATOM 0 HG21 THR A 143 2.551 -3.203 -2.136 1.00 0.00 H new ATOM 0 HG22 THR A 143 4.308 -2.974 -1.969 1.00 0.00 H new ATOM 0 HG23 THR A 143 3.186 -1.984 -1.006 1.00 0.00 H new ATOM 2213 N PRO A 144 6.773 -0.749 -2.281 1.00 0.00 N ATOM 2214 CA PRO A 144 8.131 -1.146 -2.583 1.00 0.00 C ATOM 2215 C PRO A 144 8.232 -2.655 -2.738 1.00 0.00 C ATOM 2216 O PRO A 144 7.587 -3.438 -2.027 1.00 0.00 O ATOM 2217 CB PRO A 144 8.990 -0.650 -1.437 1.00 0.00 C ATOM 2218 CG PRO A 144 7.997 -0.622 -0.276 1.00 0.00 C ATOM 2219 CD PRO A 144 6.676 -0.231 -0.933 1.00 0.00 C ATOM 0 HA PRO A 144 8.466 -0.718 -3.528 1.00 0.00 H new ATOM 0 HB2 PRO A 144 9.829 -1.317 -1.239 1.00 0.00 H new ATOM 0 HB3 PRO A 144 9.408 0.336 -1.639 1.00 0.00 H new ATOM 0 HG2 PRO A 144 7.928 -1.593 0.214 1.00 0.00 H new ATOM 0 HG3 PRO A 144 8.293 0.099 0.486 1.00 0.00 H new ATOM 0 HD2 PRO A 144 5.827 -0.662 -0.403 1.00 0.00 H new ATOM 0 HD3 PRO A 144 6.537 0.850 -0.932 1.00 0.00 H new ATOM 2227 N GLN A 145 9.121 -3.060 -3.638 1.00 0.00 N ATOM 2228 CA GLN A 145 9.226 -4.448 -3.980 1.00 0.00 C ATOM 2229 C GLN A 145 10.013 -5.117 -2.863 1.00 0.00 C ATOM 2230 O GLN A 145 11.180 -4.815 -2.634 1.00 0.00 O ATOM 2231 CB GLN A 145 9.896 -4.619 -5.353 1.00 0.00 C ATOM 2232 CG GLN A 145 9.020 -4.040 -6.478 1.00 0.00 C ATOM 2233 CD GLN A 145 9.605 -4.247 -7.875 1.00 0.00 C ATOM 2234 OE1 GLN A 145 10.758 -4.633 -8.045 1.00 0.00 O ATOM 2235 NE2 GLN A 145 8.818 -3.983 -8.902 1.00 0.00 N ATOM 0 H GLN A 145 9.767 -2.444 -4.132 1.00 0.00 H new ATOM 0 HA GLN A 145 8.244 -4.914 -4.069 1.00 0.00 H new ATOM 0 HB2 GLN A 145 10.866 -4.121 -5.351 1.00 0.00 H new ATOM 0 HB3 GLN A 145 10.081 -5.677 -5.541 1.00 0.00 H new ATOM 0 HG2 GLN A 145 8.034 -4.502 -6.434 1.00 0.00 H new ATOM 0 HG3 GLN A 145 8.880 -2.973 -6.306 1.00 0.00 H new ATOM 0 HE21 GLN A 145 7.863 -3.663 -8.743 1.00 0.00 H new ATOM 0 HE22 GLN A 145 9.166 -4.099 -9.854 1.00 0.00 H new ATOM 2244 N ASN A 146 9.301 -5.971 -2.139 1.00 0.00 N ATOM 2245 CA ASN A 146 9.571 -6.932 -1.069 1.00 0.00 C ATOM 2246 C ASN A 146 8.281 -7.508 -0.502 1.00 0.00 C ATOM 2247 O ASN A 146 8.341 -8.577 0.110 1.00 0.00 O ATOM 2248 CB ASN A 146 10.681 -6.657 -0.030 1.00 0.00 C ATOM 2249 CG ASN A 146 12.094 -7.022 -0.479 1.00 0.00 C ATOM 2250 OD1 ASN A 146 12.499 -8.162 -0.279 1.00 0.00 O ATOM 2251 ND2 ASN A 146 12.885 -6.126 -1.031 1.00 0.00 N ATOM 0 H ASN A 146 8.301 -6.009 -2.338 1.00 0.00 H new ATOM 0 HA ASN A 146 10.108 -7.714 -1.606 1.00 0.00 H new ATOM 0 HB2 ASN A 146 10.661 -5.598 0.228 1.00 0.00 H new ATOM 0 HB3 ASN A 146 10.451 -7.212 0.880 1.00 0.00 H new ATOM 0 HD21 ASN A 146 13.838 -6.379 -1.294 1.00 0.00 H new ATOM 0 HD22 ASN A 146 12.545 -5.179 -1.196 1.00 0.00 H new ATOM 2258 N ALA A 147 7.159 -6.800 -0.699 1.00 0.00 N ATOM 2259 CA ALA A 147 5.802 -7.173 -0.325 1.00 0.00 C ATOM 2260 C ALA A 147 5.426 -8.522 -0.955 1.00 0.00 C ATOM 2261 O ALA A 147 4.974 -8.608 -2.101 1.00 0.00 O ATOM 2262 CB ALA A 147 4.848 -6.033 -0.716 1.00 0.00 C ATOM 0 H ALA A 147 7.187 -5.889 -1.157 1.00 0.00 H new ATOM 0 HA ALA A 147 5.724 -7.313 0.753 1.00 0.00 H new ATOM 0 HB1 ALA A 147 3.828 -6.301 -0.441 1.00 0.00 H new ATOM 0 HB2 ALA A 147 5.137 -5.121 -0.193 1.00 0.00 H new ATOM 0 HB3 ALA A 147 4.901 -5.867 -1.792 1.00 0.00 H new ATOM 2268 N ILE A 148 5.679 -9.586 -0.196 1.00 0.00 N ATOM 2269 CA ILE A 148 5.429 -10.972 -0.543 1.00 0.00 C ATOM 2270 C ILE A 148 4.822 -11.600 0.695 1.00 0.00 C ATOM 2271 O ILE A 148 5.165 -11.218 1.818 1.00 0.00 O ATOM 2272 CB ILE A 148 6.743 -11.662 -0.986 1.00 0.00 C ATOM 2273 CG1 ILE A 148 7.136 -11.045 -2.352 1.00 0.00 C ATOM 2274 CG2 ILE A 148 6.682 -13.206 -1.006 1.00 0.00 C ATOM 2275 CD1 ILE A 148 7.873 -11.973 -3.305 1.00 0.00 C ATOM 0 H ILE A 148 6.089 -9.491 0.733 1.00 0.00 H new ATOM 0 HA ILE A 148 4.749 -11.077 -1.388 1.00 0.00 H new ATOM 0 HB ILE A 148 7.518 -11.472 -0.243 1.00 0.00 H new ATOM 0 HG12 ILE A 148 6.230 -10.692 -2.845 1.00 0.00 H new ATOM 0 HG13 ILE A 148 7.761 -10.171 -2.169 1.00 0.00 H new ATOM 0 HG21 ILE A 148 7.644 -13.604 -1.328 1.00 0.00 H new ATOM 0 HG22 ILE A 148 6.453 -13.574 -0.006 1.00 0.00 H new ATOM 0 HG23 ILE A 148 5.905 -13.531 -1.699 1.00 0.00 H new ATOM 0 HD11 ILE A 148 8.100 -11.441 -4.229 1.00 0.00 H new ATOM 0 HD12 ILE A 148 8.801 -12.308 -2.842 1.00 0.00 H new ATOM 0 HD13 ILE A 148 7.247 -12.837 -3.528 1.00 0.00 H new ATOM 2287 N PHE A 149 3.976 -12.593 0.464 1.00 0.00 N ATOM 2288 CA PHE A 149 3.377 -13.410 1.506 1.00 0.00 C ATOM 2289 C PHE A 149 3.623 -14.871 1.138 1.00 0.00 C ATOM 2290 O PHE A 149 4.038 -15.184 0.017 1.00 0.00 O ATOM 2291 CB PHE A 149 1.879 -13.127 1.716 1.00 0.00 C ATOM 2292 CG PHE A 149 1.380 -11.693 1.646 1.00 0.00 C ATOM 2293 CD1 PHE A 149 1.359 -11.008 0.416 1.00 0.00 C ATOM 2294 CD2 PHE A 149 0.764 -11.107 2.767 1.00 0.00 C ATOM 2295 CE1 PHE A 149 0.661 -9.798 0.293 1.00 0.00 C ATOM 2296 CE2 PHE A 149 0.051 -9.904 2.638 1.00 0.00 C ATOM 2297 CZ PHE A 149 -0.039 -9.273 1.387 1.00 0.00 C ATOM 0 H PHE A 149 3.681 -12.858 -0.476 1.00 0.00 H new ATOM 0 HA PHE A 149 3.842 -13.165 2.461 1.00 0.00 H new ATOM 0 HB2 PHE A 149 1.329 -13.703 0.972 1.00 0.00 H new ATOM 0 HB3 PHE A 149 1.604 -13.523 2.693 1.00 0.00 H new ATOM 0 HD1 PHE A 149 1.882 -11.416 -0.436 1.00 0.00 H new ATOM 0 HD2 PHE A 149 0.840 -11.585 3.732 1.00 0.00 H new ATOM 0 HE1 PHE A 149 0.663 -9.269 -0.649 1.00 0.00 H new ATOM 0 HE2 PHE A 149 -0.428 -9.465 3.501 1.00 0.00 H new ATOM 0 HZ PHE A 149 -0.645 -8.387 1.269 1.00 0.00 H new ATOM 2307 N PHE A 150 3.341 -15.771 2.073 1.00 0.00 N ATOM 2308 CA PHE A 150 3.624 -17.190 1.979 1.00 0.00 C ATOM 2309 C PHE A 150 2.379 -17.935 2.426 1.00 0.00 C ATOM 2310 O PHE A 150 2.027 -17.823 3.593 1.00 0.00 O ATOM 2311 CB PHE A 150 4.830 -17.478 2.888 1.00 0.00 C ATOM 2312 CG PHE A 150 6.105 -16.836 2.374 1.00 0.00 C ATOM 2313 CD1 PHE A 150 6.892 -17.501 1.418 1.00 0.00 C ATOM 2314 CD2 PHE A 150 6.433 -15.519 2.755 1.00 0.00 C ATOM 2315 CE1 PHE A 150 7.966 -16.833 0.804 1.00 0.00 C ATOM 2316 CE2 PHE A 150 7.503 -14.849 2.139 1.00 0.00 C ATOM 2317 CZ PHE A 150 8.248 -15.496 1.137 1.00 0.00 C ATOM 0 H PHE A 150 2.890 -15.517 2.952 1.00 0.00 H new ATOM 0 HA PHE A 150 3.870 -17.510 0.967 1.00 0.00 H new ATOM 0 HB2 PHE A 150 4.621 -17.111 3.893 1.00 0.00 H new ATOM 0 HB3 PHE A 150 4.974 -18.556 2.966 1.00 0.00 H new ATOM 0 HD1 PHE A 150 6.672 -18.525 1.155 1.00 0.00 H new ATOM 0 HD2 PHE A 150 5.859 -15.023 3.524 1.00 0.00 H new ATOM 0 HE1 PHE A 150 8.575 -17.347 0.076 1.00 0.00 H new ATOM 0 HE2 PHE A 150 7.753 -13.840 2.434 1.00 0.00 H new ATOM 0 HZ PHE A 150 9.037 -14.966 0.623 1.00 0.00 H new ATOM 2327 N LYS A 151 1.690 -18.675 1.551 1.00 0.00 N ATOM 2328 CA LYS A 151 0.501 -19.414 1.968 1.00 0.00 C ATOM 2329 C LYS A 151 0.865 -20.873 2.165 1.00 0.00 C ATOM 2330 O LYS A 151 1.315 -21.535 1.233 1.00 0.00 O ATOM 2331 CB LYS A 151 -0.709 -19.257 1.029 1.00 0.00 C ATOM 2332 CG LYS A 151 -1.955 -19.627 1.859 1.00 0.00 C ATOM 2333 CD LYS A 151 -3.281 -19.690 1.099 1.00 0.00 C ATOM 2334 CE LYS A 151 -4.387 -19.524 2.153 1.00 0.00 C ATOM 2335 NZ LYS A 151 -5.761 -19.723 1.648 1.00 0.00 N ATOM 0 H LYS A 151 1.932 -18.776 0.565 1.00 0.00 H new ATOM 0 HA LYS A 151 0.171 -18.978 2.911 1.00 0.00 H new ATOM 0 HB2 LYS A 151 -0.781 -18.236 0.655 1.00 0.00 H new ATOM 0 HB3 LYS A 151 -0.614 -19.908 0.160 1.00 0.00 H new ATOM 0 HG2 LYS A 151 -1.781 -20.597 2.324 1.00 0.00 H new ATOM 0 HG3 LYS A 151 -2.057 -18.901 2.665 1.00 0.00 H new ATOM 0 HD2 LYS A 151 -3.337 -18.902 0.348 1.00 0.00 H new ATOM 0 HD3 LYS A 151 -3.384 -20.639 0.573 1.00 0.00 H new ATOM 0 HE2 LYS A 151 -4.207 -20.231 2.962 1.00 0.00 H new ATOM 0 HE3 LYS A 151 -4.314 -18.524 2.581 1.00 0.00 H new ATOM 0 HZ1 LYS A 151 -6.409 -19.076 2.141 1.00 0.00 H new ATOM 0 HZ2 LYS A 151 -5.787 -19.528 0.627 1.00 0.00 H new ATOM 0 HZ3 LYS A 151 -6.055 -20.706 1.820 1.00 0.00 H new ATOM 2349 N THR A 152 0.626 -21.378 3.363 1.00 0.00 N ATOM 2350 CA THR A 152 0.788 -22.772 3.697 1.00 0.00 C ATOM 2351 C THR A 152 -0.500 -23.453 3.255 1.00 0.00 C ATOM 2352 O THR A 152 -1.567 -23.100 3.768 1.00 0.00 O ATOM 2353 CB THR A 152 0.935 -22.895 5.221 1.00 0.00 C ATOM 2354 OG1 THR A 152 1.972 -22.052 5.691 1.00 0.00 O ATOM 2355 CG2 THR A 152 1.184 -24.323 5.704 1.00 0.00 C ATOM 0 H THR A 152 0.306 -20.810 4.147 1.00 0.00 H new ATOM 0 HA THR A 152 1.662 -23.217 3.221 1.00 0.00 H new ATOM 0 HB THR A 152 -0.024 -22.584 5.634 1.00 0.00 H new ATOM 0 HG1 THR A 152 2.051 -22.142 6.664 1.00 0.00 H new ATOM 0 HG21 THR A 152 1.277 -24.329 6.790 1.00 0.00 H new ATOM 0 HG22 THR A 152 0.349 -24.958 5.408 1.00 0.00 H new ATOM 0 HG23 THR A 152 2.104 -24.702 5.259 1.00 0.00 H new ATOM 2363 N CYS A 153 -0.417 -24.398 2.322 1.00 0.00 N ATOM 2364 CA CYS A 153 -1.551 -25.211 1.906 1.00 0.00 C ATOM 2365 C CYS A 153 -1.292 -26.663 2.296 1.00 0.00 C ATOM 2366 O CYS A 153 -0.161 -27.045 2.612 1.00 0.00 O ATOM 2367 CB CYS A 153 -1.814 -25.101 0.403 1.00 0.00 C ATOM 2368 SG CYS A 153 -1.863 -23.459 -0.325 1.00 0.00 S ATOM 0 H CYS A 153 0.448 -24.621 1.830 1.00 0.00 H new ATOM 0 HA CYS A 153 -2.443 -24.842 2.413 1.00 0.00 H new ATOM 0 HB2 CYS A 153 -1.043 -25.673 -0.114 1.00 0.00 H new ATOM 0 HB3 CYS A 153 -2.767 -25.588 0.194 1.00 0.00 H new ATOM 2373 N LEU A 154 -2.350 -27.469 2.262 1.00 0.00 N ATOM 2374 CA LEU A 154 -2.299 -28.898 2.478 1.00 0.00 C ATOM 2375 C LEU A 154 -3.267 -29.572 1.513 1.00 0.00 C ATOM 2376 O LEU A 154 -4.151 -28.916 0.954 1.00 0.00 O ATOM 2377 CB LEU A 154 -2.539 -29.233 3.958 1.00 0.00 C ATOM 2378 CG LEU A 154 -3.912 -28.880 4.559 1.00 0.00 C ATOM 2379 CD1 LEU A 154 -5.012 -29.890 4.214 1.00 0.00 C ATOM 2380 CD2 LEU A 154 -3.766 -28.827 6.086 1.00 0.00 C ATOM 0 H LEU A 154 -3.293 -27.127 2.077 1.00 0.00 H new ATOM 0 HA LEU A 154 -1.306 -29.292 2.261 1.00 0.00 H new ATOM 0 HB2 LEU A 154 -2.381 -30.303 4.089 1.00 0.00 H new ATOM 0 HB3 LEU A 154 -1.775 -28.723 4.545 1.00 0.00 H new ATOM 0 HG LEU A 154 -4.214 -27.923 4.134 1.00 0.00 H new ATOM 0 HD11 LEU A 154 -5.950 -29.576 4.671 1.00 0.00 H new ATOM 0 HD12 LEU A 154 -5.134 -29.940 3.132 1.00 0.00 H new ATOM 0 HD13 LEU A 154 -4.735 -30.874 4.593 1.00 0.00 H new ATOM 0 HD21 LEU A 154 -4.728 -28.578 6.535 1.00 0.00 H new ATOM 0 HD22 LEU A 154 -3.434 -29.798 6.454 1.00 0.00 H new ATOM 0 HD23 LEU A 154 -3.032 -28.067 6.355 1.00 0.00 H new ATOM 2392 N GLN A 155 -3.059 -30.865 1.327 1.00 0.00 N ATOM 2393 CA GLN A 155 -3.777 -31.778 0.459 1.00 0.00 C ATOM 2394 C GLN A 155 -5.150 -32.134 1.039 1.00 0.00 C ATOM 2395 O GLN A 155 -5.244 -32.581 2.183 1.00 0.00 O ATOM 2396 CB GLN A 155 -2.857 -32.999 0.328 1.00 0.00 C ATOM 2397 CG GLN A 155 -3.360 -34.183 -0.505 1.00 0.00 C ATOM 2398 CD GLN A 155 -2.311 -35.299 -0.650 1.00 0.00 C ATOM 2399 OE1 GLN A 155 -2.599 -36.349 -1.217 1.00 0.00 O ATOM 2400 NE2 GLN A 155 -1.088 -35.151 -0.154 1.00 0.00 N ATOM 0 H GLN A 155 -2.312 -31.345 1.829 1.00 0.00 H new ATOM 0 HA GLN A 155 -3.994 -31.342 -0.516 1.00 0.00 H new ATOM 0 HB2 GLN A 155 -1.913 -32.663 -0.102 1.00 0.00 H new ATOM 0 HB3 GLN A 155 -2.638 -33.364 1.332 1.00 0.00 H new ATOM 0 HG2 GLN A 155 -4.257 -34.592 -0.041 1.00 0.00 H new ATOM 0 HG3 GLN A 155 -3.646 -33.829 -1.495 1.00 0.00 H new ATOM 0 HE21 GLN A 155 -0.831 -34.285 0.320 1.00 0.00 H new ATOM 0 HE22 GLN A 155 -0.405 -35.903 -0.247 1.00 0.00 H new ATOM 2409 N ALA A 156 -6.212 -31.954 0.250 1.00 0.00 N ATOM 2410 CA ALA A 156 -7.575 -32.336 0.542 1.00 0.00 C ATOM 2411 C ALA A 156 -8.219 -32.903 -0.732 1.00 0.00 C ATOM 2412 O ALA A 156 -7.698 -32.787 -1.848 1.00 0.00 O ATOM 2413 CB ALA A 156 -8.342 -31.111 1.058 1.00 0.00 C ATOM 0 H ALA A 156 -6.126 -31.509 -0.664 1.00 0.00 H new ATOM 0 HA ALA A 156 -7.602 -33.105 1.314 1.00 0.00 H new ATOM 0 HB1 ALA A 156 -9.371 -31.393 1.280 1.00 0.00 H new ATOM 0 HB2 ALA A 156 -7.865 -30.738 1.964 1.00 0.00 H new ATOM 0 HB3 ALA A 156 -8.336 -30.331 0.297 1.00 0.00 H new ATOM 2419 N GLU A 157 -9.379 -33.506 -0.540 1.00 0.00 N ATOM 2420 CA GLU A 157 -10.335 -34.059 -1.485 1.00 0.00 C ATOM 2421 C GLU A 157 -11.697 -33.867 -0.814 1.00 0.00 C ATOM 2422 O GLU A 157 -12.685 -33.659 -1.545 1.00 0.00 O ATOM 2423 CB GLU A 157 -10.016 -35.548 -1.719 1.00 0.00 C ATOM 2424 CG GLU A 157 -10.590 -36.137 -3.024 1.00 0.00 C ATOM 2425 CD GLU A 157 -9.837 -35.633 -4.264 1.00 0.00 C ATOM 2426 OE1 GLU A 157 -8.672 -36.040 -4.490 1.00 0.00 O ATOM 2427 OE2 GLU A 157 -10.322 -34.704 -4.953 1.00 0.00 O ATOM 2428 OXT GLU A 157 -11.710 -33.876 0.442 1.00 0.00 O ATOM 0 H GLU A 157 -9.718 -33.637 0.413 1.00 0.00 H new ATOM 0 HA GLU A 157 -10.309 -33.578 -2.463 1.00 0.00 H new ATOM 0 HB2 GLU A 157 -8.934 -35.676 -1.725 1.00 0.00 H new ATOM 0 HB3 GLU A 157 -10.401 -36.124 -0.877 1.00 0.00 H new ATOM 0 HG2 GLU A 157 -10.536 -37.225 -2.985 1.00 0.00 H new ATOM 0 HG3 GLU A 157 -11.644 -35.873 -3.108 1.00 0.00 H new TER 2435 GLU A 157