USER MOD reduce.3.24.130724 H: found=0, std=0, add=985, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 985 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: B -17 SER OG : rot 180:sc= 0 USER MOD Set 1.2: B -18 SER OG : rot 180:sc= 0 USER MOD Set 2.1: B 30 SER OG : rot 13:sc= 0.623 USER MOD Set 2.2: B 72 SER OG : rot 100:sc= 0.81 USER MOD Set 3.1: B 27 THR OG1 : rot 180:sc= -0.0448 USER MOD Set 3.2: B 73 THR OG1 : rot 180:sc= 0 USER MOD Set 4.1: B 2 LYS NZ :NH3+ -130:sc= -0.308 (180deg=-0.0269) USER MOD Set 4.2: B 22 GLN :FLIP amide:sc= -0.681 F(o=-3.7!,f=-0.99) USER MOD Single : B 0 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 6 THR OG1 : rot 180:sc= 0 USER MOD Single : B -1 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B -2 SER OG : rot 180:sc= 0 USER MOD Single : B -9 SER OG : rot 180:sc= 0 USER MOD Single : B 14 SER OG : rot -21:sc= 0.586 USER MOD Single : B 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 19 THR OG1 : rot 180:sc= -0.275 USER MOD Single : B 20 GLN :FLIP amide:sc= -1.22 F(o=-2.9!,f=-1.2) USER MOD Single : B 31 ASN : amide:sc= -0.0245 K(o=-0.025,f=-0.8) USER MOD Single : B 33 THR OG1 : rot 180:sc= 0 USER MOD Single : B 34 THR OG1 : rot -61:sc= 0.484 USER MOD Single : B 42 ASN : amide:sc= -0.868 X(o=-0.87,f=-1.1) USER MOD Single : B 46 SER OG : rot 180:sc= 0 USER MOD Single : B 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 56 TYR OH : rot 180:sc= 0 USER MOD Single : B 57 SER OG : rot 180:sc= 0 USER MOD Single : B 58 ASN :FLIP amide:sc=-0.000381 F(o=-1,f=-0.00038) USER MOD Single : B 59 SER OG : rot 180:sc= 0 USER MOD Single : B 63 SER OG : rot 74:sc= 0.982 USER MOD Single : B 68 SER OG : rot 5:sc= 0.652 USER MOD Single : B 81 SER OG : rot 180:sc= 0 USER MOD Single : B 90 TYR OH : rot 180:sc= 0 USER MOD Single : B 96 LYS NZ :NH3+ 143:sc= -2.08! (180deg=-4.16!) USER MOD Single : B -10 SER OG : rot 32:sc= 0.64 USER MOD Single : B -11 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B -12 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B -13 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B -14 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B -15 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B -16 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B -20 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B -20 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 103 SER OG : rot 180:sc= 0 USER MOD Single : B 105 SER OG : rot -110:sc= -1.16 USER MOD Single : B 109 GLN : amide:sc= -2.67! C(o=-2.7!,f=-2.5!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET B -20 48.964 -9.765 11.916 1.00 0.00 N ATOM 2 CA MET B -20 48.334 -11.111 11.892 1.00 0.00 C ATOM 3 C MET B -20 47.627 -11.403 13.211 1.00 0.00 C ATOM 4 O MET B -20 48.198 -11.223 14.286 1.00 0.00 O ATOM 5 CB MET B -20 49.391 -12.182 11.620 1.00 0.00 C ATOM 6 CG MET B -20 48.826 -13.591 11.539 1.00 0.00 C ATOM 7 SD MET B -20 50.093 -14.832 11.214 1.00 0.00 S ATOM 8 CE MET B -20 49.104 -16.324 11.165 1.00 0.00 C ATOM 0 H1 MET B -20 49.439 -9.588 11.008 1.00 0.00 H new ATOM 0 H2 MET B -20 48.233 -9.042 12.071 1.00 0.00 H new ATOM 0 H3 MET B -20 49.662 -9.722 12.686 1.00 0.00 H new ATOM 0 HA MET B -20 47.593 -11.127 11.092 1.00 0.00 H new ATOM 0 HB2 MET B -20 49.899 -11.949 10.684 1.00 0.00 H new ATOM 0 HB3 MET B -20 50.143 -12.146 12.408 1.00 0.00 H new ATOM 0 HG2 MET B -20 48.321 -13.830 12.475 1.00 0.00 H new ATOM 0 HG3 MET B -20 48.073 -13.631 10.752 1.00 0.00 H new ATOM 0 HE1 MET B -20 49.749 -17.182 10.972 1.00 0.00 H new ATOM 0 HE2 MET B -20 48.599 -16.458 12.122 1.00 0.00 H new ATOM 0 HE3 MET B -20 48.361 -16.242 10.371 1.00 0.00 H new ATOM 20 N GLY B -19 46.380 -11.855 13.120 1.00 0.00 N ATOM 21 CA GLY B -19 45.614 -12.166 14.313 1.00 0.00 C ATOM 22 C GLY B -19 44.789 -10.989 14.796 1.00 0.00 C ATOM 23 O GLY B -19 44.343 -10.962 15.943 1.00 0.00 O ATOM 0 H GLY B -19 45.886 -12.011 12.241 1.00 0.00 H new ATOM 0 HA2 GLY B -19 44.954 -13.009 14.108 1.00 0.00 H new ATOM 0 HA3 GLY B -19 46.293 -12.479 15.106 1.00 0.00 H new ATOM 27 N SER B -18 44.587 -10.011 13.916 1.00 0.00 N ATOM 28 CA SER B -18 43.811 -8.825 14.256 1.00 0.00 C ATOM 29 C SER B -18 42.956 -8.377 13.077 1.00 0.00 C ATOM 30 O SER B -18 41.959 -7.674 13.249 1.00 0.00 O ATOM 31 CB SER B -18 44.741 -7.687 14.687 1.00 0.00 C ATOM 32 OG SER B -18 45.644 -7.347 13.650 1.00 0.00 O ATOM 0 H SER B -18 44.951 -10.018 12.963 1.00 0.00 H new ATOM 0 HA SER B -18 43.150 -9.080 15.085 1.00 0.00 H new ATOM 0 HB2 SER B -18 44.149 -6.813 14.960 1.00 0.00 H new ATOM 0 HB3 SER B -18 45.298 -7.985 15.575 1.00 0.00 H new ATOM 0 HG SER B -18 46.226 -6.617 13.949 1.00 0.00 H new ATOM 38 N SER B -17 43.352 -8.787 11.876 1.00 0.00 N ATOM 39 CA SER B -17 42.622 -8.430 10.664 1.00 0.00 C ATOM 40 C SER B -17 42.457 -9.640 9.751 1.00 0.00 C ATOM 41 O SER B -17 43.401 -10.401 9.536 1.00 0.00 O ATOM 42 CB SER B -17 43.347 -7.309 9.918 1.00 0.00 C ATOM 43 OG SER B -17 43.465 -6.149 10.726 1.00 0.00 O ATOM 0 H SER B -17 44.175 -9.367 11.716 1.00 0.00 H new ATOM 0 HA SER B -17 41.632 -8.081 10.957 1.00 0.00 H new ATOM 0 HB2 SER B -17 44.338 -7.649 9.619 1.00 0.00 H new ATOM 0 HB3 SER B -17 42.804 -7.066 9.005 1.00 0.00 H new ATOM 0 HG SER B -17 43.934 -5.448 10.226 1.00 0.00 H new ATOM 49 N HIS B -16 41.251 -9.812 9.216 1.00 0.00 N ATOM 50 CA HIS B -16 40.962 -10.930 8.324 1.00 0.00 C ATOM 51 C HIS B -16 41.185 -10.537 6.867 1.00 0.00 C ATOM 52 O HIS B -16 41.477 -9.379 6.564 1.00 0.00 O ATOM 53 CB HIS B -16 39.521 -11.407 8.521 1.00 0.00 C ATOM 54 CG HIS B -16 39.229 -11.870 9.915 1.00 0.00 C ATOM 55 ND1 HIS B -16 39.211 -13.202 10.277 1.00 0.00 N ATOM 56 CD2 HIS B -16 38.940 -11.172 11.038 1.00 0.00 C ATOM 57 CE1 HIS B -16 38.922 -13.301 11.564 1.00 0.00 C ATOM 58 NE2 HIS B -16 38.754 -12.085 12.047 1.00 0.00 N ATOM 0 H HIS B -16 40.459 -9.192 9.385 1.00 0.00 H new ATOM 0 HA HIS B -16 41.644 -11.744 8.570 1.00 0.00 H new ATOM 0 HB2 HIS B -16 38.840 -10.595 8.267 1.00 0.00 H new ATOM 0 HB3 HIS B -16 39.319 -12.222 7.826 1.00 0.00 H new ATOM 0 HD2 HIS B -16 38.869 -10.098 11.124 1.00 0.00 H new ATOM 0 HE1 HIS B -16 38.838 -14.221 12.124 1.00 0.00 H new ATOM 0 HE2 HIS B -16 38.523 -11.859 13.014 1.00 0.00 H new ATOM 67 N HIS B -15 41.046 -11.508 5.970 1.00 0.00 N ATOM 68 CA HIS B -15 41.232 -11.265 4.544 1.00 0.00 C ATOM 69 C HIS B -15 39.900 -10.957 3.867 1.00 0.00 C ATOM 70 O HIS B -15 38.874 -11.554 4.191 1.00 0.00 O ATOM 71 CB HIS B -15 41.884 -12.477 3.878 1.00 0.00 C ATOM 72 CG HIS B -15 43.232 -12.814 4.440 1.00 0.00 C ATOM 73 ND1 HIS B -15 43.438 -13.834 5.345 1.00 0.00 N ATOM 74 CD2 HIS B -15 44.447 -12.263 4.214 1.00 0.00 C ATOM 75 CE1 HIS B -15 44.721 -13.893 5.656 1.00 0.00 C ATOM 76 NE2 HIS B -15 45.356 -12.951 4.981 1.00 0.00 N ATOM 0 H HIS B -15 40.805 -12.471 6.206 1.00 0.00 H new ATOM 0 HA HIS B -15 41.887 -10.401 4.432 1.00 0.00 H new ATOM 0 HB2 HIS B -15 41.227 -13.340 3.988 1.00 0.00 H new ATOM 0 HB3 HIS B -15 41.982 -12.286 2.809 1.00 0.00 H new ATOM 0 HD2 HIS B -15 44.662 -11.436 3.553 1.00 0.00 H new ATOM 0 HE1 HIS B -15 45.173 -14.592 6.344 1.00 0.00 H new ATOM 0 HE2 HIS B -15 46.358 -12.765 5.023 1.00 0.00 H new ATOM 85 N HIS B -14 39.925 -10.019 2.924 1.00 0.00 N ATOM 86 CA HIS B -14 38.721 -9.627 2.200 1.00 0.00 C ATOM 87 C HIS B -14 38.558 -10.457 0.928 1.00 0.00 C ATOM 88 O HIS B -14 37.626 -10.244 0.152 1.00 0.00 O ATOM 89 CB HIS B -14 38.770 -8.141 1.850 1.00 0.00 C ATOM 90 CG HIS B -14 38.864 -7.246 3.048 1.00 0.00 C ATOM 91 ND1 HIS B -14 40.051 -6.685 3.478 1.00 0.00 N ATOM 92 CD2 HIS B -14 37.913 -6.812 3.909 1.00 0.00 C ATOM 93 CE1 HIS B -14 39.823 -5.947 4.551 1.00 0.00 C ATOM 94 NE2 HIS B -14 38.534 -6.008 4.833 1.00 0.00 N ATOM 0 H HIS B -14 40.767 -9.516 2.644 1.00 0.00 H new ATOM 0 HA HIS B -14 37.863 -9.811 2.846 1.00 0.00 H new ATOM 0 HB2 HIS B -14 39.626 -7.957 1.201 1.00 0.00 H new ATOM 0 HB3 HIS B -14 37.877 -7.880 1.281 1.00 0.00 H new ATOM 0 HD2 HIS B -14 36.861 -7.054 3.875 1.00 0.00 H new ATOM 0 HE1 HIS B -14 40.565 -5.389 5.103 1.00 0.00 H new ATOM 0 HE2 HIS B -14 38.074 -5.535 5.611 1.00 0.00 H new ATOM 103 N HIS B -13 39.471 -11.400 0.723 1.00 0.00 N ATOM 104 CA HIS B -13 39.429 -12.262 -0.455 1.00 0.00 C ATOM 105 C HIS B -13 38.603 -13.515 -0.184 1.00 0.00 C ATOM 106 O HIS B -13 38.850 -14.239 0.780 1.00 0.00 O ATOM 107 CB HIS B -13 40.847 -12.654 -0.875 1.00 0.00 C ATOM 108 CG HIS B -13 41.716 -11.483 -1.220 1.00 0.00 C ATOM 109 ND1 HIS B -13 42.645 -10.955 -0.351 1.00 0.00 N ATOM 110 CD2 HIS B -13 41.793 -10.739 -2.349 1.00 0.00 C ATOM 111 CE1 HIS B -13 43.257 -9.936 -0.929 1.00 0.00 C ATOM 112 NE2 HIS B -13 42.758 -9.785 -2.143 1.00 0.00 N ATOM 0 H HIS B -13 40.249 -11.588 1.356 1.00 0.00 H new ATOM 0 HA HIS B -13 38.957 -11.706 -1.265 1.00 0.00 H new ATOM 0 HB2 HIS B -13 41.314 -13.217 -0.067 1.00 0.00 H new ATOM 0 HB3 HIS B -13 40.791 -13.320 -1.736 1.00 0.00 H new ATOM 0 HD2 HIS B -13 41.205 -10.872 -3.245 1.00 0.00 H new ATOM 0 HE1 HIS B -13 44.033 -9.330 -0.485 1.00 0.00 H new ATOM 0 HE2 HIS B -13 43.043 -9.075 -2.817 1.00 0.00 H new ATOM 121 N HIS B -12 37.618 -13.764 -1.042 1.00 0.00 N ATOM 122 CA HIS B -12 36.753 -14.931 -0.898 1.00 0.00 C ATOM 123 C HIS B -12 37.257 -16.091 -1.749 1.00 0.00 C ATOM 124 O HIS B -12 37.802 -15.887 -2.833 1.00 0.00 O ATOM 125 CB HIS B -12 35.317 -14.580 -1.291 1.00 0.00 C ATOM 126 CG HIS B -12 34.717 -13.486 -0.461 1.00 0.00 C ATOM 127 ND1 HIS B -12 33.855 -13.726 0.588 1.00 0.00 N ATOM 128 CD2 HIS B -12 34.860 -12.142 -0.530 1.00 0.00 C ATOM 129 CE1 HIS B -12 33.492 -12.575 1.127 1.00 0.00 C ATOM 130 NE2 HIS B -12 34.089 -11.599 0.468 1.00 0.00 N ATOM 0 H HIS B -12 37.399 -13.173 -1.844 1.00 0.00 H new ATOM 0 HA HIS B -12 36.771 -15.238 0.148 1.00 0.00 H new ATOM 0 HB2 HIS B -12 35.299 -14.281 -2.339 1.00 0.00 H new ATOM 0 HB3 HIS B -12 34.697 -15.472 -1.204 1.00 0.00 H new ATOM 0 HD2 HIS B -12 35.467 -11.598 -1.238 1.00 0.00 H new ATOM 0 HE1 HIS B -12 32.821 -12.453 1.964 1.00 0.00 H new ATOM 0 HE2 HIS B -12 33.993 -10.603 0.668 1.00 0.00 H new ATOM 139 N HIS B -11 37.073 -17.310 -1.248 1.00 0.00 N ATOM 140 CA HIS B -11 37.509 -18.505 -1.963 1.00 0.00 C ATOM 141 C HIS B -11 36.381 -19.529 -2.051 1.00 0.00 C ATOM 142 O HIS B -11 36.293 -20.289 -3.017 1.00 0.00 O ATOM 143 CB HIS B -11 38.722 -19.126 -1.268 1.00 0.00 C ATOM 144 CG HIS B -11 39.907 -18.213 -1.201 1.00 0.00 C ATOM 145 ND1 HIS B -11 40.960 -18.278 -2.088 1.00 0.00 N ATOM 146 CD2 HIS B -11 40.204 -17.207 -0.342 1.00 0.00 C ATOM 147 CE1 HIS B -11 41.853 -17.356 -1.780 1.00 0.00 C ATOM 148 NE2 HIS B -11 41.418 -16.691 -0.724 1.00 0.00 N ATOM 0 H HIS B -11 36.625 -17.495 -0.350 1.00 0.00 H new ATOM 0 HA HIS B -11 37.789 -18.211 -2.975 1.00 0.00 H new ATOM 0 HB2 HIS B -11 38.441 -19.417 -0.256 1.00 0.00 H new ATOM 0 HB3 HIS B -11 39.005 -20.037 -1.795 1.00 0.00 H new ATOM 0 HD2 HIS B -11 39.599 -16.874 0.488 1.00 0.00 H new ATOM 0 HE1 HIS B -11 42.781 -17.176 -2.302 1.00 0.00 H new ATOM 0 HE2 HIS B -11 41.905 -15.920 -0.267 1.00 0.00 H new ATOM 157 N SER B -10 35.522 -19.544 -1.038 1.00 0.00 N ATOM 158 CA SER B -10 34.401 -20.478 -0.999 1.00 0.00 C ATOM 159 C SER B -10 33.209 -19.928 -1.776 1.00 0.00 C ATOM 160 O SER B -10 32.589 -18.945 -1.368 1.00 0.00 O ATOM 161 CB SER B -10 33.995 -20.761 0.448 1.00 0.00 C ATOM 162 OG SER B -10 33.621 -19.569 1.117 1.00 0.00 O ATOM 0 H SER B -10 35.580 -18.921 -0.233 1.00 0.00 H new ATOM 0 HA SER B -10 34.720 -21.409 -1.467 1.00 0.00 H new ATOM 0 HB2 SER B -10 33.164 -21.466 0.464 1.00 0.00 H new ATOM 0 HB3 SER B -10 34.824 -21.233 0.976 1.00 0.00 H new ATOM 0 HG SER B -10 33.211 -18.950 0.477 1.00 0.00 H new ATOM 168 N SER B -9 32.895 -20.568 -2.901 1.00 0.00 N ATOM 169 CA SER B -9 31.777 -20.149 -3.741 1.00 0.00 C ATOM 170 C SER B -9 31.941 -18.700 -4.192 1.00 0.00 C ATOM 171 O SER B -9 32.984 -18.083 -3.966 1.00 0.00 O ATOM 172 CB SER B -9 30.455 -20.314 -2.988 1.00 0.00 C ATOM 173 OG SER B -9 30.248 -21.666 -2.609 1.00 0.00 O ATOM 0 H SER B -9 33.401 -21.381 -3.252 1.00 0.00 H new ATOM 0 HA SER B -9 31.766 -20.785 -4.626 1.00 0.00 H new ATOM 0 HB2 SER B -9 30.457 -19.681 -2.101 1.00 0.00 H new ATOM 0 HB3 SER B -9 29.630 -19.979 -3.617 1.00 0.00 H new ATOM 0 HG SER B -9 29.398 -21.744 -2.128 1.00 0.00 H new ATOM 179 N GLY B -8 30.909 -18.166 -4.835 1.00 0.00 N ATOM 180 CA GLY B -8 30.956 -16.795 -5.308 1.00 0.00 C ATOM 181 C GLY B -8 29.577 -16.235 -5.598 1.00 0.00 C ATOM 182 O GLY B -8 29.293 -15.077 -5.291 1.00 0.00 O ATOM 0 H GLY B -8 30.039 -18.659 -5.038 1.00 0.00 H new ATOM 0 HA2 GLY B -8 31.448 -16.173 -4.561 1.00 0.00 H new ATOM 0 HA3 GLY B -8 31.562 -16.746 -6.212 1.00 0.00 H new ATOM 186 N LEU B -7 28.720 -17.059 -6.192 1.00 0.00 N ATOM 187 CA LEU B -7 27.363 -16.642 -6.525 1.00 0.00 C ATOM 188 C LEU B -7 26.457 -17.853 -6.726 1.00 0.00 C ATOM 189 O LEU B -7 26.613 -18.605 -7.689 1.00 0.00 O ATOM 190 CB LEU B -7 27.367 -15.776 -7.787 1.00 0.00 C ATOM 191 CG LEU B -7 25.997 -15.248 -8.218 1.00 0.00 C ATOM 192 CD1 LEU B -7 25.433 -14.302 -7.169 1.00 0.00 C ATOM 193 CD2 LEU B -7 26.095 -14.557 -9.570 1.00 0.00 C ATOM 0 H LEU B -7 28.941 -18.020 -6.453 1.00 0.00 H new ATOM 0 HA LEU B -7 26.975 -16.055 -5.693 1.00 0.00 H new ATOM 0 HB2 LEU B -7 28.031 -14.927 -7.624 1.00 0.00 H new ATOM 0 HB3 LEU B -7 27.789 -16.358 -8.607 1.00 0.00 H new ATOM 0 HG LEU B -7 25.316 -16.094 -8.314 1.00 0.00 H new ATOM 0 HD11 LEU B -7 24.459 -13.937 -7.494 1.00 0.00 H new ATOM 0 HD12 LEU B -7 25.325 -14.831 -6.222 1.00 0.00 H new ATOM 0 HD13 LEU B -7 26.111 -13.458 -7.038 1.00 0.00 H new ATOM 0 HD21 LEU B -7 25.112 -14.187 -9.862 1.00 0.00 H new ATOM 0 HD22 LEU B -7 26.791 -13.721 -9.502 1.00 0.00 H new ATOM 0 HD23 LEU B -7 26.452 -15.267 -10.316 1.00 0.00 H new ATOM 205 N VAL B -6 25.510 -18.036 -5.811 1.00 0.00 N ATOM 206 CA VAL B -6 24.578 -19.156 -5.889 1.00 0.00 C ATOM 207 C VAL B -6 23.287 -18.849 -5.125 1.00 0.00 C ATOM 208 O VAL B -6 23.329 -18.427 -3.970 1.00 0.00 O ATOM 209 CB VAL B -6 25.208 -20.447 -5.328 1.00 0.00 C ATOM 210 CG1 VAL B -6 25.749 -20.217 -3.924 1.00 0.00 C ATOM 211 CG2 VAL B -6 24.202 -21.590 -5.340 1.00 0.00 C ATOM 0 H VAL B -6 25.368 -17.424 -5.008 1.00 0.00 H new ATOM 0 HA VAL B -6 24.343 -19.307 -6.943 1.00 0.00 H new ATOM 0 HB VAL B -6 26.042 -20.725 -5.972 1.00 0.00 H new ATOM 0 HG11 VAL B -6 26.189 -21.141 -3.548 1.00 0.00 H new ATOM 0 HG12 VAL B -6 26.510 -19.437 -3.951 1.00 0.00 H new ATOM 0 HG13 VAL B -6 24.936 -19.908 -3.267 1.00 0.00 H new ATOM 0 HG21 VAL B -6 24.669 -22.490 -4.940 1.00 0.00 H new ATOM 0 HG22 VAL B -6 23.342 -21.324 -4.726 1.00 0.00 H new ATOM 0 HG23 VAL B -6 23.874 -21.775 -6.363 1.00 0.00 H new ATOM 221 N PRO B -5 22.117 -19.052 -5.765 1.00 0.00 N ATOM 222 CA PRO B -5 20.817 -18.792 -5.131 1.00 0.00 C ATOM 223 C PRO B -5 20.609 -19.627 -3.872 1.00 0.00 C ATOM 224 O PRO B -5 19.902 -19.215 -2.953 1.00 0.00 O ATOM 225 CB PRO B -5 19.800 -19.191 -6.207 1.00 0.00 C ATOM 226 CG PRO B -5 20.557 -19.155 -7.490 1.00 0.00 C ATOM 227 CD PRO B -5 21.965 -19.545 -7.146 1.00 0.00 C ATOM 0 HA PRO B -5 20.727 -17.755 -4.807 1.00 0.00 H new ATOM 0 HB2 PRO B -5 19.394 -20.185 -6.017 1.00 0.00 H new ATOM 0 HB3 PRO B -5 18.957 -18.501 -6.227 1.00 0.00 H new ATOM 0 HG2 PRO B -5 20.127 -19.844 -8.217 1.00 0.00 H new ATOM 0 HG3 PRO B -5 20.524 -18.161 -7.935 1.00 0.00 H new ATOM 0 HD2 PRO B -5 22.112 -20.623 -7.208 1.00 0.00 H new ATOM 0 HD3 PRO B -5 22.687 -19.085 -7.821 1.00 0.00 H new ATOM 235 N ARG B -4 21.230 -20.803 -3.838 1.00 0.00 N ATOM 236 CA ARG B -4 21.112 -21.698 -2.691 1.00 0.00 C ATOM 237 C ARG B -4 21.594 -21.018 -1.414 1.00 0.00 C ATOM 238 O ARG B -4 20.813 -20.786 -0.491 1.00 0.00 O ATOM 239 CB ARG B -4 21.914 -22.979 -2.938 1.00 0.00 C ATOM 240 CG ARG B -4 21.827 -23.983 -1.798 1.00 0.00 C ATOM 241 CD ARG B -4 22.616 -25.245 -2.106 1.00 0.00 C ATOM 242 NE ARG B -4 24.032 -24.964 -2.329 1.00 0.00 N ATOM 243 CZ ARG B -4 24.916 -25.885 -2.704 1.00 0.00 C ATOM 244 NH1 ARG B -4 24.531 -27.140 -2.897 1.00 0.00 N ATOM 245 NH2 ARG B -4 26.186 -25.550 -2.887 1.00 0.00 N ATOM 0 H ARG B -4 21.819 -21.158 -4.591 1.00 0.00 H new ATOM 0 HA ARG B -4 20.060 -21.952 -2.566 1.00 0.00 H new ATOM 0 HB2 ARG B -4 21.557 -23.450 -3.854 1.00 0.00 H new ATOM 0 HB3 ARG B -4 22.959 -22.717 -3.101 1.00 0.00 H new ATOM 0 HG2 ARG B -4 22.207 -23.529 -0.883 1.00 0.00 H new ATOM 0 HG3 ARG B -4 20.783 -24.240 -1.617 1.00 0.00 H new ATOM 0 HD2 ARG B -4 22.512 -25.948 -1.280 1.00 0.00 H new ATOM 0 HD3 ARG B -4 22.198 -25.727 -2.990 1.00 0.00 H new ATOM 0 HE ARG B -4 24.361 -24.009 -2.190 1.00 0.00 H new ATOM 0 HH11 ARG B -4 23.555 -27.401 -2.758 1.00 0.00 H new ATOM 0 HH12 ARG B -4 25.211 -27.844 -3.184 1.00 0.00 H new ATOM 0 HH21 ARG B -4 26.485 -24.586 -2.740 1.00 0.00 H new ATOM 0 HH22 ARG B -4 26.863 -26.256 -3.174 1.00 0.00 H new ATOM 259 N GLY B -3 22.885 -20.702 -1.368 1.00 0.00 N ATOM 260 CA GLY B -3 23.448 -20.052 -0.198 1.00 0.00 C ATOM 261 C GLY B -3 23.616 -18.557 -0.390 1.00 0.00 C ATOM 262 O GLY B -3 24.736 -18.065 -0.532 1.00 0.00 O ATOM 0 H GLY B -3 23.551 -20.884 -2.119 1.00 0.00 H new ATOM 0 HA2 GLY B -3 22.803 -20.235 0.661 1.00 0.00 H new ATOM 0 HA3 GLY B -3 24.416 -20.497 0.030 1.00 0.00 H new ATOM 266 N SER B -2 22.502 -17.832 -0.394 1.00 0.00 N ATOM 267 CA SER B -2 22.531 -16.384 -0.572 1.00 0.00 C ATOM 268 C SER B -2 21.197 -15.759 -0.175 1.00 0.00 C ATOM 269 O SER B -2 20.167 -16.024 -0.795 1.00 0.00 O ATOM 270 CB SER B -2 22.859 -16.032 -2.024 1.00 0.00 C ATOM 271 OG SER B -2 22.884 -14.628 -2.216 1.00 0.00 O ATOM 0 H SER B -2 21.567 -18.223 -0.276 1.00 0.00 H new ATOM 0 HA SER B -2 23.309 -15.981 0.077 1.00 0.00 H new ATOM 0 HB2 SER B -2 23.826 -16.456 -2.295 1.00 0.00 H new ATOM 0 HB3 SER B -2 22.118 -16.479 -2.686 1.00 0.00 H new ATOM 0 HG SER B -2 23.097 -14.430 -3.152 1.00 0.00 H new ATOM 277 N HIS B -1 21.224 -14.926 0.862 1.00 0.00 N ATOM 278 CA HIS B -1 20.020 -14.259 1.342 1.00 0.00 C ATOM 279 C HIS B -1 20.172 -12.744 1.257 1.00 0.00 C ATOM 280 O HIS B -1 21.051 -12.163 1.893 1.00 0.00 O ATOM 281 CB HIS B -1 19.720 -14.675 2.784 1.00 0.00 C ATOM 282 CG HIS B -1 19.475 -16.142 2.944 1.00 0.00 C ATOM 283 ND1 HIS B -1 18.210 -16.694 3.001 1.00 0.00 N ATOM 284 CD2 HIS B -1 20.339 -17.178 3.063 1.00 0.00 C ATOM 285 CE1 HIS B -1 18.310 -18.005 3.145 1.00 0.00 C ATOM 286 NE2 HIS B -1 19.590 -18.323 3.186 1.00 0.00 N ATOM 0 H HIS B -1 22.069 -14.697 1.386 1.00 0.00 H new ATOM 0 HA HIS B -1 19.187 -14.560 0.706 1.00 0.00 H new ATOM 0 HB2 HIS B -1 20.556 -14.383 3.419 1.00 0.00 H new ATOM 0 HB3 HIS B -1 18.846 -14.128 3.137 1.00 0.00 H new ATOM 0 HD2 HIS B -1 21.417 -17.116 3.061 1.00 0.00 H new ATOM 0 HE1 HIS B -1 17.484 -18.697 3.217 1.00 0.00 H new ATOM 0 HE2 HIS B -1 19.963 -19.266 3.292 1.00 0.00 H new ATOM 295 N MET B 0 19.311 -12.109 0.468 1.00 0.00 N ATOM 296 CA MET B 0 19.355 -10.661 0.296 1.00 0.00 C ATOM 297 C MET B 0 18.409 -9.963 1.267 1.00 0.00 C ATOM 298 O MET B 0 17.371 -10.509 1.643 1.00 0.00 O ATOM 299 CB MET B 0 19.001 -10.279 -1.145 1.00 0.00 C ATOM 300 CG MET B 0 17.547 -10.535 -1.516 1.00 0.00 C ATOM 301 SD MET B 0 17.161 -12.288 -1.682 1.00 0.00 S ATOM 302 CE MET B 0 15.425 -12.214 -2.116 1.00 0.00 C ATOM 0 H MET B 0 18.574 -12.574 -0.062 1.00 0.00 H new ATOM 0 HA MET B 0 20.372 -10.332 0.510 1.00 0.00 H new ATOM 0 HB2 MET B 0 19.222 -9.222 -1.294 1.00 0.00 H new ATOM 0 HB3 MET B 0 19.643 -10.838 -1.826 1.00 0.00 H new ATOM 0 HG2 MET B 0 16.901 -10.097 -0.755 1.00 0.00 H new ATOM 0 HG3 MET B 0 17.323 -10.029 -2.455 1.00 0.00 H new ATOM 0 HE1 MET B 0 15.041 -13.225 -2.252 1.00 0.00 H new ATOM 0 HE2 MET B 0 14.871 -11.720 -1.318 1.00 0.00 H new ATOM 0 HE3 MET B 0 15.305 -11.652 -3.042 1.00 0.00 H new ATOM 312 N GLN B 1 18.778 -8.752 1.669 1.00 0.00 N ATOM 313 CA GLN B 1 17.970 -7.966 2.593 1.00 0.00 C ATOM 314 C GLN B 1 18.318 -6.484 2.489 1.00 0.00 C ATOM 315 O GLN B 1 19.378 -6.125 1.974 1.00 0.00 O ATOM 316 CB GLN B 1 18.177 -8.452 4.025 1.00 0.00 C ATOM 317 CG GLN B 1 19.620 -8.406 4.463 1.00 0.00 C ATOM 318 CD GLN B 1 19.820 -8.892 5.887 1.00 0.00 C ATOM 319 OE1 GLN B 1 19.765 -8.109 6.835 1.00 0.00 O ATOM 320 NE2 GLN B 1 20.052 -10.190 6.043 1.00 0.00 N ATOM 0 H GLN B 1 19.637 -8.291 1.367 1.00 0.00 H new ATOM 0 HA GLN B 1 16.922 -8.096 2.323 1.00 0.00 H new ATOM 0 HB2 GLN B 1 17.579 -7.840 4.700 1.00 0.00 H new ATOM 0 HB3 GLN B 1 17.810 -9.475 4.112 1.00 0.00 H new ATOM 0 HG2 GLN B 1 20.219 -9.017 3.788 1.00 0.00 H new ATOM 0 HG3 GLN B 1 19.988 -7.383 4.378 1.00 0.00 H new ATOM 0 HE21 GLN B 1 20.089 -10.803 5.229 1.00 0.00 H new ATOM 0 HE22 GLN B 1 20.193 -10.574 6.977 1.00 0.00 H new ATOM 329 N LYS B 2 17.426 -5.629 2.979 1.00 0.00 N ATOM 330 CA LYS B 2 17.648 -4.191 2.932 1.00 0.00 C ATOM 331 C LYS B 2 17.356 -3.539 4.274 1.00 0.00 C ATOM 332 O LYS B 2 16.529 -4.026 5.045 1.00 0.00 O ATOM 333 CB LYS B 2 16.778 -3.550 1.852 1.00 0.00 C ATOM 334 CG LYS B 2 17.573 -3.033 0.668 1.00 0.00 C ATOM 335 CD LYS B 2 17.471 -1.521 0.548 1.00 0.00 C ATOM 336 CE LYS B 2 18.537 -0.960 -0.375 1.00 0.00 C ATOM 337 NZ LYS B 2 18.427 -1.512 -1.754 1.00 0.00 N ATOM 0 H LYS B 2 16.545 -5.907 3.412 1.00 0.00 H new ATOM 0 HA LYS B 2 18.699 -4.031 2.693 1.00 0.00 H new ATOM 0 HB2 LYS B 2 16.050 -4.281 1.500 1.00 0.00 H new ATOM 0 HB3 LYS B 2 16.215 -2.726 2.290 1.00 0.00 H new ATOM 0 HG2 LYS B 2 18.619 -3.321 0.776 1.00 0.00 H new ATOM 0 HG3 LYS B 2 17.208 -3.498 -0.248 1.00 0.00 H new ATOM 0 HD2 LYS B 2 16.484 -1.251 0.171 1.00 0.00 H new ATOM 0 HD3 LYS B 2 17.570 -1.070 1.535 1.00 0.00 H new ATOM 0 HE2 LYS B 2 18.450 0.126 -0.411 1.00 0.00 H new ATOM 0 HE3 LYS B 2 19.523 -1.188 0.029 1.00 0.00 H new ATOM 0 HZ1 LYS B 2 19.357 -1.858 -2.065 1.00 0.00 H new ATOM 0 HZ2 LYS B 2 17.745 -2.297 -1.760 1.00 0.00 H new ATOM 0 HZ3 LYS B 2 18.102 -0.766 -2.402 1.00 0.00 H new ATOM 351 N PRO B 3 18.041 -2.422 4.569 1.00 0.00 N ATOM 352 CA PRO B 3 17.848 -1.669 5.806 1.00 0.00 C ATOM 353 C PRO B 3 16.447 -1.089 5.873 1.00 0.00 C ATOM 354 O PRO B 3 16.106 -0.356 6.800 1.00 0.00 O ATOM 355 CB PRO B 3 18.895 -0.552 5.712 1.00 0.00 C ATOM 356 CG PRO B 3 19.882 -1.044 4.717 1.00 0.00 C ATOM 357 CD PRO B 3 19.067 -1.802 3.725 1.00 0.00 C ATOM 0 HA PRO B 3 17.960 -2.284 6.699 1.00 0.00 H new ATOM 0 HB2 PRO B 3 18.444 0.387 5.392 1.00 0.00 H new ATOM 0 HB3 PRO B 3 19.365 -0.367 6.678 1.00 0.00 H new ATOM 0 HG2 PRO B 3 20.415 -0.218 4.245 1.00 0.00 H new ATOM 0 HG3 PRO B 3 20.632 -1.682 5.184 1.00 0.00 H new ATOM 0 HD2 PRO B 3 18.631 -1.146 2.971 1.00 0.00 H new ATOM 0 HD3 PRO B 3 19.661 -2.546 3.195 1.00 0.00 H new ATOM 365 N VAL B 4 15.652 -1.439 4.864 1.00 0.00 N ATOM 366 CA VAL B 4 14.265 -0.999 4.735 1.00 0.00 C ATOM 367 C VAL B 4 14.079 0.471 5.102 1.00 0.00 C ATOM 368 O VAL B 4 14.128 0.853 6.271 1.00 0.00 O ATOM 369 CB VAL B 4 13.302 -1.881 5.560 1.00 0.00 C ATOM 370 CG1 VAL B 4 13.836 -2.145 6.959 1.00 0.00 C ATOM 371 CG2 VAL B 4 11.927 -1.245 5.622 1.00 0.00 C ATOM 0 H VAL B 4 15.958 -2.045 4.102 1.00 0.00 H new ATOM 0 HA VAL B 4 14.015 -1.110 3.680 1.00 0.00 H new ATOM 0 HB VAL B 4 13.222 -2.844 5.057 1.00 0.00 H new ATOM 0 HG11 VAL B 4 13.129 -2.769 7.506 1.00 0.00 H new ATOM 0 HG12 VAL B 4 14.796 -2.657 6.891 1.00 0.00 H new ATOM 0 HG13 VAL B 4 13.966 -1.198 7.483 1.00 0.00 H new ATOM 0 HG21 VAL B 4 11.259 -1.878 6.207 1.00 0.00 H new ATOM 0 HG22 VAL B 4 12.001 -0.264 6.092 1.00 0.00 H new ATOM 0 HG23 VAL B 4 11.531 -1.135 4.612 1.00 0.00 H new ATOM 381 N VAL B 5 13.837 1.287 4.080 1.00 0.00 N ATOM 382 CA VAL B 5 13.644 2.714 4.261 1.00 0.00 C ATOM 383 C VAL B 5 12.357 3.006 5.021 1.00 0.00 C ATOM 384 O VAL B 5 11.304 2.442 4.721 1.00 0.00 O ATOM 385 CB VAL B 5 13.607 3.446 2.907 1.00 0.00 C ATOM 386 CG1 VAL B 5 13.448 4.945 3.111 1.00 0.00 C ATOM 387 CG2 VAL B 5 14.863 3.142 2.104 1.00 0.00 C ATOM 0 H VAL B 5 13.770 0.976 3.111 1.00 0.00 H new ATOM 0 HA VAL B 5 14.491 3.078 4.842 1.00 0.00 H new ATOM 0 HB VAL B 5 12.745 3.087 2.345 1.00 0.00 H new ATOM 0 HG11 VAL B 5 13.424 5.444 2.142 1.00 0.00 H new ATOM 0 HG12 VAL B 5 12.518 5.143 3.644 1.00 0.00 H new ATOM 0 HG13 VAL B 5 14.288 5.324 3.693 1.00 0.00 H new ATOM 0 HG21 VAL B 5 14.821 3.667 1.150 1.00 0.00 H new ATOM 0 HG22 VAL B 5 15.740 3.472 2.661 1.00 0.00 H new ATOM 0 HG23 VAL B 5 14.929 2.069 1.925 1.00 0.00 H new ATOM 397 N THR B 6 12.451 3.889 6.006 1.00 0.00 N ATOM 398 CA THR B 6 11.300 4.264 6.813 1.00 0.00 C ATOM 399 C THR B 6 10.511 5.386 6.145 1.00 0.00 C ATOM 400 O THR B 6 11.015 6.060 5.246 1.00 0.00 O ATOM 401 CB THR B 6 11.735 4.719 8.219 1.00 0.00 C ATOM 402 OG1 THR B 6 12.802 3.891 8.692 1.00 0.00 O ATOM 403 CG2 THR B 6 10.571 4.648 9.192 1.00 0.00 C ATOM 0 H THR B 6 13.317 4.360 6.266 1.00 0.00 H new ATOM 0 HA THR B 6 10.666 3.382 6.904 1.00 0.00 H new ATOM 0 HB THR B 6 12.075 5.752 8.153 1.00 0.00 H new ATOM 0 HG1 THR B 6 13.074 4.187 9.586 1.00 0.00 H new ATOM 0 HG21 THR B 6 10.901 4.974 10.178 1.00 0.00 H new ATOM 0 HG22 THR B 6 9.767 5.297 8.846 1.00 0.00 H new ATOM 0 HG23 THR B 6 10.208 3.622 9.251 1.00 0.00 H new ATOM 411 N LEU B 7 9.275 5.581 6.590 1.00 0.00 N ATOM 412 CA LEU B 7 8.417 6.622 6.032 1.00 0.00 C ATOM 413 C LEU B 7 7.432 7.134 7.080 1.00 0.00 C ATOM 414 O LEU B 7 6.925 6.365 7.897 1.00 0.00 O ATOM 415 CB LEU B 7 7.659 6.090 4.814 1.00 0.00 C ATOM 416 CG LEU B 7 6.732 7.100 4.131 1.00 0.00 C ATOM 417 CD1 LEU B 7 7.527 8.289 3.609 1.00 0.00 C ATOM 418 CD2 LEU B 7 5.964 6.435 2.998 1.00 0.00 C ATOM 0 H LEU B 7 8.844 5.033 7.335 1.00 0.00 H new ATOM 0 HA LEU B 7 9.050 7.453 5.720 1.00 0.00 H new ATOM 0 HB2 LEU B 7 8.384 5.733 4.082 1.00 0.00 H new ATOM 0 HB3 LEU B 7 7.067 5.228 5.122 1.00 0.00 H new ATOM 0 HG LEU B 7 6.016 7.463 4.869 1.00 0.00 H new ATOM 0 HD11 LEU B 7 6.851 8.995 3.127 1.00 0.00 H new ATOM 0 HD12 LEU B 7 8.034 8.781 4.439 1.00 0.00 H new ATOM 0 HD13 LEU B 7 8.266 7.943 2.886 1.00 0.00 H new ATOM 0 HD21 LEU B 7 5.310 7.166 2.523 1.00 0.00 H new ATOM 0 HD22 LEU B 7 6.667 6.045 2.262 1.00 0.00 H new ATOM 0 HD23 LEU B 7 5.364 5.617 3.396 1.00 0.00 H new ATOM 430 N ASP B 8 7.165 8.436 7.046 1.00 0.00 N ATOM 431 CA ASP B 8 6.241 9.052 7.992 1.00 0.00 C ATOM 432 C ASP B 8 5.432 10.158 7.322 1.00 0.00 C ATOM 433 O ASP B 8 4.608 10.812 7.962 1.00 0.00 O ATOM 434 CB ASP B 8 7.005 9.616 9.190 1.00 0.00 C ATOM 435 CG ASP B 8 8.013 10.676 8.786 1.00 0.00 C ATOM 436 OD1 ASP B 8 7.649 11.870 8.782 1.00 0.00 O ATOM 437 OD2 ASP B 8 9.166 10.311 8.474 1.00 0.00 O ATOM 0 H ASP B 8 7.575 9.084 6.374 1.00 0.00 H new ATOM 0 HA ASP B 8 5.551 8.283 8.340 1.00 0.00 H new ATOM 0 HB2 ASP B 8 6.297 10.043 9.900 1.00 0.00 H new ATOM 0 HB3 ASP B 8 7.521 8.805 9.703 1.00 0.00 H new ATOM 442 N ASP B 9 5.676 10.365 6.031 1.00 0.00 N ATOM 443 CA ASP B 9 4.972 11.392 5.273 1.00 0.00 C ATOM 444 C ASP B 9 4.135 10.769 4.160 1.00 0.00 C ATOM 445 O ASP B 9 4.149 9.553 3.968 1.00 0.00 O ATOM 446 CB ASP B 9 5.966 12.391 4.678 1.00 0.00 C ATOM 447 CG ASP B 9 6.779 13.101 5.744 1.00 0.00 C ATOM 448 OD1 ASP B 9 7.876 12.609 6.081 1.00 0.00 O ATOM 449 OD2 ASP B 9 6.317 14.150 6.242 1.00 0.00 O ATOM 0 H ASP B 9 6.357 9.834 5.488 1.00 0.00 H new ATOM 0 HA ASP B 9 4.305 11.917 5.957 1.00 0.00 H new ATOM 0 HB2 ASP B 9 6.640 11.869 3.999 1.00 0.00 H new ATOM 0 HB3 ASP B 9 5.425 13.129 4.086 1.00 0.00 H new ATOM 454 N ALA B 10 3.406 11.610 3.431 1.00 0.00 N ATOM 455 CA ALA B 10 2.563 11.141 2.338 1.00 0.00 C ATOM 456 C ALA B 10 2.701 12.038 1.113 1.00 0.00 C ATOM 457 O ALA B 10 2.377 11.632 -0.005 1.00 0.00 O ATOM 458 CB ALA B 10 1.110 11.076 2.786 1.00 0.00 C ATOM 0 H ALA B 10 3.383 12.619 3.578 1.00 0.00 H new ATOM 0 HA ALA B 10 2.893 10.140 2.060 1.00 0.00 H new ATOM 0 HB1 ALA B 10 0.490 10.724 1.961 1.00 0.00 H new ATOM 0 HB2 ALA B 10 1.019 10.388 3.627 1.00 0.00 H new ATOM 0 HB3 ALA B 10 0.779 12.069 3.091 1.00 0.00 H new ATOM 464 N ASP B 11 3.186 13.257 1.327 1.00 0.00 N ATOM 465 CA ASP B 11 3.367 14.211 0.239 1.00 0.00 C ATOM 466 C ASP B 11 4.749 14.058 -0.391 1.00 0.00 C ATOM 467 O ASP B 11 4.947 14.386 -1.562 1.00 0.00 O ATOM 468 CB ASP B 11 3.183 15.641 0.750 1.00 0.00 C ATOM 469 CG ASP B 11 3.359 16.674 -0.347 1.00 0.00 C ATOM 470 OD1 ASP B 11 2.351 17.030 -0.994 1.00 0.00 O ATOM 471 OD2 ASP B 11 4.503 17.129 -0.558 1.00 0.00 O ATOM 0 H ASP B 11 3.461 13.607 2.245 1.00 0.00 H new ATOM 0 HA ASP B 11 2.614 14.005 -0.522 1.00 0.00 H new ATOM 0 HB2 ASP B 11 2.189 15.743 1.186 1.00 0.00 H new ATOM 0 HB3 ASP B 11 3.902 15.835 1.546 1.00 0.00 H new ATOM 476 N ASP B 12 5.700 13.561 0.393 1.00 0.00 N ATOM 477 CA ASP B 12 7.062 13.367 -0.083 1.00 0.00 C ATOM 478 C ASP B 12 7.185 12.062 -0.868 1.00 0.00 C ATOM 479 O ASP B 12 8.274 11.694 -1.308 1.00 0.00 O ATOM 480 CB ASP B 12 8.032 13.358 1.095 1.00 0.00 C ATOM 481 CG ASP B 12 8.064 14.685 1.830 1.00 0.00 C ATOM 482 OD1 ASP B 12 7.265 14.858 2.774 1.00 0.00 O ATOM 483 OD2 ASP B 12 8.887 15.548 1.461 1.00 0.00 O ATOM 0 H ASP B 12 5.550 13.285 1.363 1.00 0.00 H new ATOM 0 HA ASP B 12 7.312 14.193 -0.748 1.00 0.00 H new ATOM 0 HB2 ASP B 12 7.748 12.568 1.790 1.00 0.00 H new ATOM 0 HB3 ASP B 12 9.033 13.121 0.735 1.00 0.00 H new ATOM 488 N CYS B 13 6.064 11.372 -1.039 1.00 0.00 N ATOM 489 CA CYS B 13 6.050 10.108 -1.768 1.00 0.00 C ATOM 490 C CYS B 13 6.118 10.334 -3.274 1.00 0.00 C ATOM 491 O CYS B 13 5.563 11.301 -3.797 1.00 0.00 O ATOM 492 CB CYS B 13 4.800 9.301 -1.419 1.00 0.00 C ATOM 493 SG CYS B 13 4.925 8.378 0.146 1.00 0.00 S ATOM 0 H CYS B 13 5.154 11.665 -0.684 1.00 0.00 H new ATOM 0 HA CYS B 13 6.934 9.545 -1.467 1.00 0.00 H new ATOM 0 HB2 CYS B 13 3.948 9.978 -1.362 1.00 0.00 H new ATOM 0 HB3 CYS B 13 4.596 8.599 -2.227 1.00 0.00 H new ATOM 498 N SER B 14 6.803 9.427 -3.961 1.00 0.00 N ATOM 499 CA SER B 14 6.957 9.503 -5.409 1.00 0.00 C ATOM 500 C SER B 14 7.301 8.129 -5.974 1.00 0.00 C ATOM 501 O SER B 14 7.743 7.251 -5.233 1.00 0.00 O ATOM 502 CB SER B 14 8.056 10.499 -5.772 1.00 0.00 C ATOM 503 OG SER B 14 7.822 11.765 -5.180 1.00 0.00 O ATOM 0 H SER B 14 7.264 8.624 -3.534 1.00 0.00 H new ATOM 0 HA SER B 14 6.015 9.841 -5.841 1.00 0.00 H new ATOM 0 HB2 SER B 14 9.021 10.114 -5.443 1.00 0.00 H new ATOM 0 HB3 SER B 14 8.109 10.606 -6.855 1.00 0.00 H new ATOM 0 HG SER B 14 6.874 11.845 -4.943 1.00 0.00 H new ATOM 509 N PRO B 15 7.094 7.915 -7.287 1.00 0.00 N ATOM 510 CA PRO B 15 7.401 6.632 -7.931 1.00 0.00 C ATOM 511 C PRO B 15 8.849 6.210 -7.698 1.00 0.00 C ATOM 512 O PRO B 15 9.721 6.445 -8.537 1.00 0.00 O ATOM 513 CB PRO B 15 7.155 6.904 -9.415 1.00 0.00 C ATOM 514 CG PRO B 15 6.194 8.042 -9.437 1.00 0.00 C ATOM 515 CD PRO B 15 6.537 8.890 -8.243 1.00 0.00 C ATOM 0 HA PRO B 15 6.794 5.819 -7.533 1.00 0.00 H new ATOM 0 HB2 PRO B 15 8.082 7.158 -9.930 1.00 0.00 H new ATOM 0 HB3 PRO B 15 6.743 6.028 -9.915 1.00 0.00 H new ATOM 0 HG2 PRO B 15 6.285 8.613 -10.361 1.00 0.00 H new ATOM 0 HG3 PRO B 15 5.165 7.686 -9.382 1.00 0.00 H new ATOM 0 HD2 PRO B 15 7.260 9.666 -8.494 1.00 0.00 H new ATOM 0 HD3 PRO B 15 5.658 9.392 -7.840 1.00 0.00 H new ATOM 523 N LEU B 16 9.094 5.598 -6.547 1.00 0.00 N ATOM 524 CA LEU B 16 10.432 5.146 -6.184 1.00 0.00 C ATOM 525 C LEU B 16 10.912 4.026 -7.086 1.00 0.00 C ATOM 526 O LEU B 16 10.158 3.493 -7.901 1.00 0.00 O ATOM 527 CB LEU B 16 10.459 4.677 -4.730 1.00 0.00 C ATOM 528 CG LEU B 16 10.674 5.788 -3.712 1.00 0.00 C ATOM 529 CD1 LEU B 16 10.153 5.371 -2.344 1.00 0.00 C ATOM 530 CD2 LEU B 16 12.145 6.166 -3.637 1.00 0.00 C ATOM 0 H LEU B 16 8.380 5.402 -5.845 1.00 0.00 H new ATOM 0 HA LEU B 16 11.105 5.995 -6.308 1.00 0.00 H new ATOM 0 HB2 LEU B 16 9.518 4.174 -4.506 1.00 0.00 H new ATOM 0 HB3 LEU B 16 11.251 3.938 -4.615 1.00 0.00 H new ATOM 0 HG LEU B 16 10.113 6.664 -4.036 1.00 0.00 H new ATOM 0 HD11 LEU B 16 10.316 6.179 -1.631 1.00 0.00 H new ATOM 0 HD12 LEU B 16 9.087 5.156 -2.411 1.00 0.00 H new ATOM 0 HD13 LEU B 16 10.683 4.479 -2.009 1.00 0.00 H new ATOM 0 HD21 LEU B 16 12.279 6.962 -2.904 1.00 0.00 H new ATOM 0 HD22 LEU B 16 12.730 5.296 -3.339 1.00 0.00 H new ATOM 0 HD23 LEU B 16 12.482 6.512 -4.614 1.00 0.00 H new ATOM 542 N LYS B 17 12.179 3.673 -6.916 1.00 0.00 N ATOM 543 CA LYS B 17 12.801 2.614 -7.698 1.00 0.00 C ATOM 544 C LYS B 17 13.329 1.510 -6.784 1.00 0.00 C ATOM 545 O LYS B 17 14.536 1.369 -6.590 1.00 0.00 O ATOM 546 CB LYS B 17 13.937 3.176 -8.562 1.00 0.00 C ATOM 547 CG LYS B 17 14.930 4.043 -7.796 1.00 0.00 C ATOM 548 CD LYS B 17 14.424 5.469 -7.624 1.00 0.00 C ATOM 549 CE LYS B 17 14.359 6.205 -8.952 1.00 0.00 C ATOM 550 NZ LYS B 17 13.856 7.597 -8.792 1.00 0.00 N ATOM 0 H LYS B 17 12.801 4.110 -6.236 1.00 0.00 H new ATOM 0 HA LYS B 17 12.043 2.188 -8.356 1.00 0.00 H new ATOM 0 HB2 LYS B 17 14.474 2.346 -9.022 1.00 0.00 H new ATOM 0 HB3 LYS B 17 13.506 3.765 -9.372 1.00 0.00 H new ATOM 0 HG2 LYS B 17 15.116 3.603 -6.816 1.00 0.00 H new ATOM 0 HG3 LYS B 17 15.883 4.057 -8.325 1.00 0.00 H new ATOM 0 HD2 LYS B 17 13.434 5.452 -7.168 1.00 0.00 H new ATOM 0 HD3 LYS B 17 15.080 6.008 -6.941 1.00 0.00 H new ATOM 0 HE2 LYS B 17 15.351 6.227 -9.404 1.00 0.00 H new ATOM 0 HE3 LYS B 17 13.709 5.661 -9.637 1.00 0.00 H new ATOM 0 HZ1 LYS B 17 13.827 8.064 -9.721 1.00 0.00 H new ATOM 0 HZ2 LYS B 17 12.899 7.576 -8.385 1.00 0.00 H new ATOM 0 HZ3 LYS B 17 14.490 8.125 -8.159 1.00 0.00 H new ATOM 564 N LEU B 18 12.409 0.734 -6.218 1.00 0.00 N ATOM 565 CA LEU B 18 12.773 -0.354 -5.317 1.00 0.00 C ATOM 566 C LEU B 18 13.366 -1.531 -6.084 1.00 0.00 C ATOM 567 O LEU B 18 13.622 -1.441 -7.283 1.00 0.00 O ATOM 568 CB LEU B 18 11.553 -0.818 -4.518 1.00 0.00 C ATOM 569 CG LEU B 18 11.251 -0.014 -3.263 1.00 0.00 C ATOM 570 CD1 LEU B 18 10.974 1.443 -3.601 1.00 0.00 C ATOM 571 CD2 LEU B 18 10.079 -0.624 -2.508 1.00 0.00 C ATOM 0 H LEU B 18 11.406 0.839 -6.368 1.00 0.00 H new ATOM 0 HA LEU B 18 13.529 0.024 -4.629 1.00 0.00 H new ATOM 0 HB2 LEU B 18 10.679 -0.785 -5.169 1.00 0.00 H new ATOM 0 HB3 LEU B 18 11.700 -1.860 -4.235 1.00 0.00 H new ATOM 0 HG LEU B 18 12.130 -0.047 -2.620 1.00 0.00 H new ATOM 0 HD11 LEU B 18 10.761 1.995 -2.685 1.00 0.00 H new ATOM 0 HD12 LEU B 18 11.847 1.875 -4.091 1.00 0.00 H new ATOM 0 HD13 LEU B 18 10.115 1.505 -4.270 1.00 0.00 H new ATOM 0 HD21 LEU B 18 9.877 -0.036 -1.613 1.00 0.00 H new ATOM 0 HD22 LEU B 18 9.196 -0.627 -3.147 1.00 0.00 H new ATOM 0 HD23 LEU B 18 10.323 -1.647 -2.222 1.00 0.00 H new ATOM 583 N THR B 19 13.581 -2.632 -5.375 1.00 0.00 N ATOM 584 CA THR B 19 14.141 -3.836 -5.973 1.00 0.00 C ATOM 585 C THR B 19 13.763 -5.066 -5.153 1.00 0.00 C ATOM 586 O THR B 19 13.556 -4.975 -3.943 1.00 0.00 O ATOM 587 CB THR B 19 15.676 -3.753 -6.076 1.00 0.00 C ATOM 588 OG1 THR B 19 16.058 -2.534 -6.727 1.00 0.00 O ATOM 589 CG2 THR B 19 16.235 -4.938 -6.850 1.00 0.00 C ATOM 0 H THR B 19 13.374 -2.715 -4.380 1.00 0.00 H new ATOM 0 HA THR B 19 13.726 -3.921 -6.977 1.00 0.00 H new ATOM 0 HB THR B 19 16.085 -3.773 -5.066 1.00 0.00 H new ATOM 0 HG1 THR B 19 17.035 -2.488 -6.787 1.00 0.00 H new ATOM 0 HG21 THR B 19 17.320 -4.855 -6.908 1.00 0.00 H new ATOM 0 HG22 THR B 19 15.969 -5.864 -6.340 1.00 0.00 H new ATOM 0 HG23 THR B 19 15.817 -4.945 -7.857 1.00 0.00 H new ATOM 597 N GLN B 20 13.668 -6.211 -5.820 1.00 0.00 N ATOM 598 CA GLN B 20 13.313 -7.458 -5.152 1.00 0.00 C ATOM 599 C GLN B 20 14.276 -7.754 -4.007 1.00 0.00 C ATOM 600 O GLN B 20 15.370 -8.280 -4.221 1.00 0.00 O ATOM 601 CB GLN B 20 13.313 -8.614 -6.153 1.00 0.00 C ATOM 602 CG GLN B 20 12.427 -8.363 -7.364 1.00 0.00 C ATOM 603 CD GLN B 20 12.440 -9.516 -8.349 1.00 0.00 C ATOM 604 OE1 GLN B 20 11.342 -9.680 -9.078 1.00 0.00 O flip ATOM 605 NE2 GLN B 20 13.425 -10.244 -8.459 1.00 0.00 N flip ATOM 0 H GLN B 20 13.832 -6.302 -6.823 1.00 0.00 H new ATOM 0 HA GLN B 20 12.311 -7.349 -4.737 1.00 0.00 H new ATOM 0 HB2 GLN B 20 14.334 -8.794 -6.490 1.00 0.00 H new ATOM 0 HB3 GLN B 20 12.979 -9.521 -5.649 1.00 0.00 H new ATOM 0 HG2 GLN B 20 11.404 -8.187 -7.030 1.00 0.00 H new ATOM 0 HG3 GLN B 20 12.758 -7.456 -7.869 1.00 0.00 H new ATOM 0 HE21 GLN B 20 14.247 -10.081 -7.878 1.00 0.00 H new ATOM 0 HE22 GLN B 20 13.420 -11.011 -9.131 1.00 0.00 H new ATOM 614 N GLY B 21 13.866 -7.406 -2.791 1.00 0.00 N ATOM 615 CA GLY B 21 14.703 -7.636 -1.628 1.00 0.00 C ATOM 616 C GLY B 21 14.667 -6.481 -0.645 1.00 0.00 C ATOM 617 O GLY B 21 15.361 -6.500 0.370 1.00 0.00 O ATOM 0 H GLY B 21 12.967 -6.968 -2.590 1.00 0.00 H new ATOM 0 HA2 GLY B 21 14.377 -8.546 -1.125 1.00 0.00 H new ATOM 0 HA3 GLY B 21 15.731 -7.801 -1.952 1.00 0.00 H new ATOM 621 N GLN B 22 13.858 -5.469 -0.949 1.00 0.00 N ATOM 622 CA GLN B 22 13.732 -4.305 -0.091 1.00 0.00 C ATOM 623 C GLN B 22 12.421 -4.344 0.679 1.00 0.00 C ATOM 624 O GLN B 22 11.369 -4.649 0.117 1.00 0.00 O ATOM 625 CB GLN B 22 13.794 -3.022 -0.921 1.00 0.00 C ATOM 626 CG GLN B 22 15.009 -2.934 -1.830 1.00 0.00 C ATOM 627 CD GLN B 22 15.266 -1.519 -2.306 1.00 0.00 C ATOM 628 OE1 GLN B 22 14.875 -0.547 -1.489 1.00 0.00 O flip ATOM 629 NE2 GLN B 22 15.806 -1.301 -3.391 1.00 0.00 N flip ATOM 0 H GLN B 22 13.279 -5.437 -1.788 1.00 0.00 H new ATOM 0 HA GLN B 22 14.561 -4.318 0.617 1.00 0.00 H new ATOM 0 HB2 GLN B 22 12.892 -2.950 -1.529 1.00 0.00 H new ATOM 0 HB3 GLN B 22 13.794 -2.165 -0.248 1.00 0.00 H new ATOM 0 HG2 GLN B 22 15.886 -3.301 -1.298 1.00 0.00 H new ATOM 0 HG3 GLN B 22 14.864 -3.585 -2.692 1.00 0.00 H new ATOM 0 HE21 GLN B 22 16.089 -2.080 -3.985 1.00 0.00 H new ATOM 0 HE22 GLN B 22 15.970 -0.341 -3.695 1.00 0.00 H new ATOM 638 N GLU B 23 12.490 -4.040 1.963 1.00 0.00 N ATOM 639 CA GLU B 23 11.301 -4.030 2.807 1.00 0.00 C ATOM 640 C GLU B 23 10.751 -2.615 2.931 1.00 0.00 C ATOM 641 O GLU B 23 11.258 -1.687 2.298 1.00 0.00 O ATOM 642 CB GLU B 23 11.616 -4.594 4.194 1.00 0.00 C ATOM 643 CG GLU B 23 13.003 -5.204 4.303 1.00 0.00 C ATOM 644 CD GLU B 23 13.235 -5.896 5.631 1.00 0.00 C ATOM 645 OE1 GLU B 23 13.743 -5.237 6.563 1.00 0.00 O ATOM 646 OE2 GLU B 23 12.910 -7.097 5.739 1.00 0.00 O ATOM 0 H GLU B 23 13.354 -3.797 2.447 1.00 0.00 H new ATOM 0 HA GLU B 23 10.546 -4.663 2.339 1.00 0.00 H new ATOM 0 HB2 GLU B 23 11.520 -3.797 4.931 1.00 0.00 H new ATOM 0 HB3 GLU B 23 10.874 -5.352 4.446 1.00 0.00 H new ATOM 0 HG2 GLU B 23 13.144 -5.921 3.495 1.00 0.00 H new ATOM 0 HG3 GLU B 23 13.751 -4.422 4.170 1.00 0.00 H new ATOM 653 N LEU B 24 9.717 -2.452 3.747 1.00 0.00 N ATOM 654 CA LEU B 24 9.112 -1.141 3.950 1.00 0.00 C ATOM 655 C LEU B 24 8.368 -1.088 5.281 1.00 0.00 C ATOM 656 O LEU B 24 7.410 -1.830 5.500 1.00 0.00 O ATOM 657 CB LEU B 24 8.162 -0.807 2.798 1.00 0.00 C ATOM 658 CG LEU B 24 7.886 0.686 2.603 1.00 0.00 C ATOM 659 CD1 LEU B 24 7.378 0.954 1.194 1.00 0.00 C ATOM 660 CD2 LEU B 24 6.891 1.192 3.638 1.00 0.00 C ATOM 0 H LEU B 24 9.281 -3.207 4.277 1.00 0.00 H new ATOM 0 HA LEU B 24 9.909 -0.398 3.973 1.00 0.00 H new ATOM 0 HB2 LEU B 24 8.579 -1.208 1.874 1.00 0.00 H new ATOM 0 HB3 LEU B 24 7.214 -1.318 2.968 1.00 0.00 H new ATOM 0 HG LEU B 24 8.822 1.227 2.741 1.00 0.00 H new ATOM 0 HD11 LEU B 24 7.187 2.020 1.073 1.00 0.00 H new ATOM 0 HD12 LEU B 24 8.128 0.635 0.470 1.00 0.00 H new ATOM 0 HD13 LEU B 24 6.455 0.399 1.028 1.00 0.00 H new ATOM 0 HD21 LEU B 24 6.710 2.255 3.480 1.00 0.00 H new ATOM 0 HD22 LEU B 24 5.953 0.646 3.538 1.00 0.00 H new ATOM 0 HD23 LEU B 24 7.296 1.038 4.638 1.00 0.00 H new ATOM 672 N VAL B 25 8.816 -0.203 6.166 1.00 0.00 N ATOM 673 CA VAL B 25 8.199 -0.050 7.478 1.00 0.00 C ATOM 674 C VAL B 25 7.379 1.233 7.556 1.00 0.00 C ATOM 675 O VAL B 25 7.700 2.229 6.908 1.00 0.00 O ATOM 676 CB VAL B 25 9.257 -0.042 8.598 1.00 0.00 C ATOM 677 CG1 VAL B 25 9.917 -1.405 8.720 1.00 0.00 C ATOM 678 CG2 VAL B 25 10.293 1.044 8.350 1.00 0.00 C ATOM 0 H VAL B 25 9.606 0.420 5.997 1.00 0.00 H new ATOM 0 HA VAL B 25 7.539 -0.906 7.619 1.00 0.00 H new ATOM 0 HB VAL B 25 8.757 0.178 9.542 1.00 0.00 H new ATOM 0 HG11 VAL B 25 10.661 -1.379 9.516 1.00 0.00 H new ATOM 0 HG12 VAL B 25 9.162 -2.155 8.954 1.00 0.00 H new ATOM 0 HG13 VAL B 25 10.402 -1.660 7.778 1.00 0.00 H new ATOM 0 HG21 VAL B 25 11.031 1.033 9.152 1.00 0.00 H new ATOM 0 HG22 VAL B 25 10.790 0.862 7.397 1.00 0.00 H new ATOM 0 HG23 VAL B 25 9.801 2.016 8.323 1.00 0.00 H new ATOM 688 N LEU B 26 6.315 1.199 8.352 1.00 0.00 N ATOM 689 CA LEU B 26 5.443 2.357 8.520 1.00 0.00 C ATOM 690 C LEU B 26 4.748 2.320 9.877 1.00 0.00 C ATOM 691 O LEU B 26 4.445 1.246 10.399 1.00 0.00 O ATOM 692 CB LEU B 26 4.400 2.401 7.399 1.00 0.00 C ATOM 693 CG LEU B 26 3.446 3.597 7.446 1.00 0.00 C ATOM 694 CD1 LEU B 26 4.203 4.899 7.230 1.00 0.00 C ATOM 695 CD2 LEU B 26 2.346 3.440 6.408 1.00 0.00 C ATOM 0 H LEU B 26 6.035 0.380 8.892 1.00 0.00 H new ATOM 0 HA LEU B 26 6.057 3.256 8.471 1.00 0.00 H new ATOM 0 HB2 LEU B 26 4.919 2.408 6.441 1.00 0.00 H new ATOM 0 HB3 LEU B 26 3.811 1.485 7.436 1.00 0.00 H new ATOM 0 HG LEU B 26 2.987 3.630 8.434 1.00 0.00 H new ATOM 0 HD11 LEU B 26 3.506 5.736 7.267 1.00 0.00 H new ATOM 0 HD12 LEU B 26 4.954 5.017 8.011 1.00 0.00 H new ATOM 0 HD13 LEU B 26 4.693 4.878 6.256 1.00 0.00 H new ATOM 0 HD21 LEU B 26 1.676 4.299 6.455 1.00 0.00 H new ATOM 0 HD22 LEU B 26 2.790 3.379 5.414 1.00 0.00 H new ATOM 0 HD23 LEU B 26 1.782 2.529 6.610 1.00 0.00 H new ATOM 707 N THR B 27 4.501 3.496 10.446 1.00 0.00 N ATOM 708 CA THR B 27 3.843 3.592 11.743 1.00 0.00 C ATOM 709 C THR B 27 3.067 4.901 11.874 1.00 0.00 C ATOM 710 O THR B 27 3.582 5.974 11.557 1.00 0.00 O ATOM 711 CB THR B 27 4.860 3.494 12.898 1.00 0.00 C ATOM 712 OG1 THR B 27 5.611 2.281 12.785 1.00 0.00 O ATOM 713 CG2 THR B 27 4.155 3.535 14.247 1.00 0.00 C ATOM 0 H THR B 27 4.746 4.394 10.029 1.00 0.00 H new ATOM 0 HA THR B 27 3.149 2.754 11.806 1.00 0.00 H new ATOM 0 HB THR B 27 5.534 4.348 12.833 1.00 0.00 H new ATOM 0 HG1 THR B 27 6.256 2.226 13.521 1.00 0.00 H new ATOM 0 HG21 THR B 27 4.893 3.464 15.046 1.00 0.00 H new ATOM 0 HG22 THR B 27 3.606 4.472 14.342 1.00 0.00 H new ATOM 0 HG23 THR B 27 3.460 2.698 14.320 1.00 0.00 H new ATOM 721 N LEU B 28 1.828 4.801 12.341 1.00 0.00 N ATOM 722 CA LEU B 28 0.979 5.974 12.518 1.00 0.00 C ATOM 723 C LEU B 28 0.294 5.952 13.884 1.00 0.00 C ATOM 724 O LEU B 28 0.209 4.901 14.523 1.00 0.00 O ATOM 725 CB LEU B 28 -0.073 6.045 11.408 1.00 0.00 C ATOM 726 CG LEU B 28 0.480 6.344 10.014 1.00 0.00 C ATOM 727 CD1 LEU B 28 0.837 5.054 9.291 1.00 0.00 C ATOM 728 CD2 LEU B 28 -0.523 7.155 9.207 1.00 0.00 C ATOM 0 H LEU B 28 1.388 3.919 12.604 1.00 0.00 H new ATOM 0 HA LEU B 28 1.613 6.859 12.464 1.00 0.00 H new ATOM 0 HB2 LEU B 28 -0.609 5.096 11.374 1.00 0.00 H new ATOM 0 HB3 LEU B 28 -0.801 6.814 11.666 1.00 0.00 H new ATOM 0 HG LEU B 28 1.390 6.935 10.123 1.00 0.00 H new ATOM 0 HD11 LEU B 28 1.229 5.288 8.301 1.00 0.00 H new ATOM 0 HD12 LEU B 28 1.593 4.514 9.862 1.00 0.00 H new ATOM 0 HD13 LEU B 28 -0.054 4.434 9.191 1.00 0.00 H new ATOM 0 HD21 LEU B 28 -0.114 7.359 8.218 1.00 0.00 H new ATOM 0 HD22 LEU B 28 -1.450 6.591 9.107 1.00 0.00 H new ATOM 0 HD23 LEU B 28 -0.724 8.097 9.718 1.00 0.00 H new ATOM 740 N PRO B 29 -0.204 7.113 14.351 1.00 0.00 N ATOM 741 CA PRO B 29 -0.877 7.216 15.645 1.00 0.00 C ATOM 742 C PRO B 29 -2.342 6.799 15.574 1.00 0.00 C ATOM 743 O PRO B 29 -3.110 7.324 14.768 1.00 0.00 O ATOM 744 CB PRO B 29 -0.755 8.702 15.971 1.00 0.00 C ATOM 745 CG PRO B 29 -0.758 9.382 14.643 1.00 0.00 C ATOM 746 CD PRO B 29 -0.152 8.415 13.656 1.00 0.00 C ATOM 0 HA PRO B 29 -0.438 6.558 16.395 1.00 0.00 H new ATOM 0 HB2 PRO B 29 -1.585 9.041 16.591 1.00 0.00 H new ATOM 0 HB3 PRO B 29 0.162 8.913 16.522 1.00 0.00 H new ATOM 0 HG2 PRO B 29 -1.773 9.650 14.348 1.00 0.00 H new ATOM 0 HG3 PRO B 29 -0.182 10.307 14.681 1.00 0.00 H new ATOM 0 HD2 PRO B 29 -0.715 8.392 12.723 1.00 0.00 H new ATOM 0 HD3 PRO B 29 0.872 8.692 13.404 1.00 0.00 H new ATOM 754 N SER B 30 -2.722 5.848 16.425 1.00 0.00 N ATOM 755 CA SER B 30 -4.095 5.357 16.459 1.00 0.00 C ATOM 756 C SER B 30 -4.360 4.578 17.743 1.00 0.00 C ATOM 757 O SER B 30 -3.434 4.246 18.485 1.00 0.00 O ATOM 758 CB SER B 30 -4.373 4.470 15.245 1.00 0.00 C ATOM 759 OG SER B 30 -3.509 3.348 15.222 1.00 0.00 O ATOM 0 H SER B 30 -2.098 5.404 17.099 1.00 0.00 H new ATOM 0 HA SER B 30 -4.763 6.218 16.431 1.00 0.00 H new ATOM 0 HB2 SER B 30 -5.410 4.134 15.267 1.00 0.00 H new ATOM 0 HB3 SER B 30 -4.245 5.050 14.331 1.00 0.00 H new ATOM 0 HG SER B 30 -3.054 3.267 16.086 1.00 0.00 H new ATOM 765 N ASN B 31 -5.632 4.285 18.000 1.00 0.00 N ATOM 766 CA ASN B 31 -6.022 3.542 19.193 1.00 0.00 C ATOM 767 C ASN B 31 -6.972 2.397 18.837 1.00 0.00 C ATOM 768 O ASN B 31 -8.033 2.627 18.255 1.00 0.00 O ATOM 769 CB ASN B 31 -6.692 4.476 20.204 1.00 0.00 C ATOM 770 CG ASN B 31 -5.774 5.596 20.656 1.00 0.00 C ATOM 771 OD1 ASN B 31 -4.554 5.435 20.702 1.00 0.00 O ATOM 772 ND2 ASN B 31 -6.356 6.741 20.991 1.00 0.00 N ATOM 0 H ASN B 31 -6.410 4.551 17.397 1.00 0.00 H new ATOM 0 HA ASN B 31 -5.121 3.119 19.637 1.00 0.00 H new ATOM 0 HB2 ASN B 31 -7.590 4.904 19.759 1.00 0.00 H new ATOM 0 HB3 ASN B 31 -7.010 3.899 21.072 1.00 0.00 H new ATOM 0 HD21 ASN B 31 -5.789 7.530 21.301 1.00 0.00 H new ATOM 0 HD22 ASN B 31 -7.371 6.832 20.938 1.00 0.00 H new ATOM 779 N PRO B 32 -6.605 1.146 19.180 1.00 0.00 N ATOM 780 CA PRO B 32 -7.437 -0.026 18.887 1.00 0.00 C ATOM 781 C PRO B 32 -8.654 -0.120 19.802 1.00 0.00 C ATOM 782 O PRO B 32 -9.467 -1.036 19.678 1.00 0.00 O ATOM 783 CB PRO B 32 -6.489 -1.196 19.142 1.00 0.00 C ATOM 784 CG PRO B 32 -5.566 -0.685 20.187 1.00 0.00 C ATOM 785 CD PRO B 32 -5.359 0.770 19.875 1.00 0.00 C ATOM 0 HA PRO B 32 -7.845 0.004 17.877 1.00 0.00 H new ATOM 0 HB2 PRO B 32 -7.028 -2.080 19.482 1.00 0.00 H new ATOM 0 HB3 PRO B 32 -5.951 -1.479 18.237 1.00 0.00 H new ATOM 0 HG2 PRO B 32 -5.992 -0.815 21.182 1.00 0.00 H new ATOM 0 HG3 PRO B 32 -4.620 -1.226 20.172 1.00 0.00 H new ATOM 0 HD2 PRO B 32 -5.209 1.359 20.780 1.00 0.00 H new ATOM 0 HD3 PRO B 32 -4.483 0.926 19.245 1.00 0.00 H new ATOM 793 N THR B 33 -8.773 0.837 20.719 1.00 0.00 N ATOM 794 CA THR B 33 -9.890 0.863 21.656 1.00 0.00 C ATOM 795 C THR B 33 -11.058 1.665 21.094 1.00 0.00 C ATOM 796 O THR B 33 -12.221 1.351 21.352 1.00 0.00 O ATOM 797 CB THR B 33 -9.469 1.466 23.012 1.00 0.00 C ATOM 798 OG1 THR B 33 -8.349 0.747 23.540 1.00 0.00 O ATOM 799 CG2 THR B 33 -10.620 1.420 24.007 1.00 0.00 C ATOM 0 H THR B 33 -8.110 1.603 20.832 1.00 0.00 H new ATOM 0 HA THR B 33 -10.203 -0.170 21.808 1.00 0.00 H new ATOM 0 HB THR B 33 -9.191 2.507 22.850 1.00 0.00 H new ATOM 0 HG1 THR B 33 -8.086 1.136 24.400 1.00 0.00 H new ATOM 0 HG21 THR B 33 -10.299 1.851 24.955 1.00 0.00 H new ATOM 0 HG22 THR B 33 -11.462 1.991 23.616 1.00 0.00 H new ATOM 0 HG23 THR B 33 -10.925 0.385 24.163 1.00 0.00 H new ATOM 807 N THR B 34 -10.744 2.702 20.323 1.00 0.00 N ATOM 808 CA THR B 34 -11.769 3.550 19.725 1.00 0.00 C ATOM 809 C THR B 34 -12.591 2.780 18.696 1.00 0.00 C ATOM 810 O THR B 34 -13.796 2.589 18.867 1.00 0.00 O ATOM 811 CB THR B 34 -11.154 4.790 19.051 1.00 0.00 C ATOM 812 OG1 THR B 34 -10.205 4.389 18.053 1.00 0.00 O ATOM 813 CG2 THR B 34 -10.467 5.679 20.077 1.00 0.00 C ATOM 0 H THR B 34 -9.787 2.975 20.098 1.00 0.00 H new ATOM 0 HA THR B 34 -12.420 3.874 20.537 1.00 0.00 H new ATOM 0 HB THR B 34 -11.959 5.355 18.581 1.00 0.00 H new ATOM 0 HG1 THR B 34 -9.484 3.876 18.474 1.00 0.00 H new ATOM 0 HG21 THR B 34 -10.040 6.549 19.577 1.00 0.00 H new ATOM 0 HG22 THR B 34 -11.195 6.008 20.819 1.00 0.00 H new ATOM 0 HG23 THR B 34 -9.673 5.118 20.571 1.00 0.00 H new ATOM 821 N GLY B 35 -11.933 2.337 17.628 1.00 0.00 N ATOM 822 CA GLY B 35 -12.621 1.594 16.589 1.00 0.00 C ATOM 823 C GLY B 35 -12.130 1.954 15.200 1.00 0.00 C ATOM 824 O GLY B 35 -12.178 1.135 14.285 1.00 0.00 O ATOM 0 H GLY B 35 -10.936 2.480 17.465 1.00 0.00 H new ATOM 0 HA2 GLY B 35 -12.480 0.526 16.756 1.00 0.00 H new ATOM 0 HA3 GLY B 35 -13.691 1.789 16.655 1.00 0.00 H new ATOM 828 N PHE B 36 -11.657 3.188 15.046 1.00 0.00 N ATOM 829 CA PHE B 36 -11.153 3.660 13.767 1.00 0.00 C ATOM 830 C PHE B 36 -9.720 3.189 13.535 1.00 0.00 C ATOM 831 O PHE B 36 -8.770 3.780 14.047 1.00 0.00 O ATOM 832 CB PHE B 36 -11.219 5.187 13.713 1.00 0.00 C ATOM 833 CG PHE B 36 -12.619 5.727 13.663 1.00 0.00 C ATOM 834 CD1 PHE B 36 -13.367 5.858 14.822 1.00 0.00 C ATOM 835 CD2 PHE B 36 -13.188 6.105 12.458 1.00 0.00 C ATOM 836 CE1 PHE B 36 -14.655 6.356 14.778 1.00 0.00 C ATOM 837 CE2 PHE B 36 -14.475 6.603 12.407 1.00 0.00 C ATOM 838 CZ PHE B 36 -15.210 6.729 13.570 1.00 0.00 C ATOM 0 H PHE B 36 -11.614 3.878 15.796 1.00 0.00 H new ATOM 0 HA PHE B 36 -11.779 3.244 12.978 1.00 0.00 H new ATOM 0 HB2 PHE B 36 -10.712 5.595 14.587 1.00 0.00 H new ATOM 0 HB3 PHE B 36 -10.673 5.535 12.836 1.00 0.00 H new ATOM 0 HD1 PHE B 36 -12.939 5.568 15.770 1.00 0.00 H new ATOM 0 HD2 PHE B 36 -12.617 6.009 11.546 1.00 0.00 H new ATOM 0 HE1 PHE B 36 -15.228 6.454 15.688 1.00 0.00 H new ATOM 0 HE2 PHE B 36 -14.906 6.893 11.460 1.00 0.00 H new ATOM 0 HZ PHE B 36 -16.217 7.118 13.534 1.00 0.00 H new ATOM 848 N ARG B 37 -9.578 2.115 12.764 1.00 0.00 N ATOM 849 CA ARG B 37 -8.264 1.557 12.458 1.00 0.00 C ATOM 850 C ARG B 37 -7.801 1.972 11.067 1.00 0.00 C ATOM 851 O ARG B 37 -8.258 2.978 10.522 1.00 0.00 O ATOM 852 CB ARG B 37 -8.303 0.032 12.543 1.00 0.00 C ATOM 853 CG ARG B 37 -8.297 -0.504 13.967 1.00 0.00 C ATOM 854 CD ARG B 37 -6.990 -0.193 14.681 1.00 0.00 C ATOM 855 NE ARG B 37 -5.844 -0.811 14.017 1.00 0.00 N ATOM 856 CZ ARG B 37 -4.616 -0.821 14.524 1.00 0.00 C ATOM 857 NH1 ARG B 37 -4.372 -0.251 15.697 1.00 0.00 N ATOM 858 NH2 ARG B 37 -3.627 -1.404 13.859 1.00 0.00 N ATOM 0 H ARG B 37 -10.358 1.613 12.339 1.00 0.00 H new ATOM 0 HA ARG B 37 -7.559 1.947 13.192 1.00 0.00 H new ATOM 0 HB2 ARG B 37 -9.196 -0.328 12.033 1.00 0.00 H new ATOM 0 HB3 ARG B 37 -7.445 -0.374 12.008 1.00 0.00 H new ATOM 0 HG2 ARG B 37 -9.128 -0.069 14.523 1.00 0.00 H new ATOM 0 HG3 ARG B 37 -8.455 -1.582 13.950 1.00 0.00 H new ATOM 0 HD2 ARG B 37 -6.847 0.887 14.721 1.00 0.00 H new ATOM 0 HD3 ARG B 37 -7.046 -0.546 15.711 1.00 0.00 H new ATOM 0 HE ARG B 37 -5.996 -1.260 13.114 1.00 0.00 H new ATOM 0 HH11 ARG B 37 -5.129 0.197 16.213 1.00 0.00 H new ATOM 0 HH12 ARG B 37 -3.428 -0.261 16.082 1.00 0.00 H new ATOM 0 HH21 ARG B 37 -3.809 -1.845 12.958 1.00 0.00 H new ATOM 0 HH22 ARG B 37 -2.685 -1.411 14.249 1.00 0.00 H new ATOM 872 N TRP B 38 -6.887 1.189 10.500 1.00 0.00 N ATOM 873 CA TRP B 38 -6.362 1.463 9.171 1.00 0.00 C ATOM 874 C TRP B 38 -6.490 0.233 8.275 1.00 0.00 C ATOM 875 O TRP B 38 -6.204 -0.886 8.701 1.00 0.00 O ATOM 876 CB TRP B 38 -4.900 1.907 9.250 1.00 0.00 C ATOM 877 CG TRP B 38 -4.704 3.196 9.989 1.00 0.00 C ATOM 878 CD1 TRP B 38 -4.532 3.354 11.334 1.00 0.00 C ATOM 879 CD2 TRP B 38 -4.658 4.513 9.422 1.00 0.00 C ATOM 880 NE1 TRP B 38 -4.385 4.686 11.639 1.00 0.00 N ATOM 881 CE2 TRP B 38 -4.458 5.417 10.483 1.00 0.00 C ATOM 882 CE3 TRP B 38 -4.765 5.015 8.121 1.00 0.00 C ATOM 883 CZ2 TRP B 38 -4.363 6.792 10.282 1.00 0.00 C ATOM 884 CZ3 TRP B 38 -4.673 6.381 7.923 1.00 0.00 C ATOM 885 CH2 TRP B 38 -4.473 7.256 8.998 1.00 0.00 C ATOM 0 H TRP B 38 -6.496 0.358 10.944 1.00 0.00 H new ATOM 0 HA TRP B 38 -6.949 2.272 8.736 1.00 0.00 H new ATOM 0 HB2 TRP B 38 -4.318 1.126 9.738 1.00 0.00 H new ATOM 0 HB3 TRP B 38 -4.506 2.014 8.239 1.00 0.00 H new ATOM 0 HD1 TRP B 38 -4.514 2.549 12.054 1.00 0.00 H new ATOM 0 HE1 TRP B 38 -4.244 5.068 12.574 1.00 0.00 H new ATOM 0 HE3 TRP B 38 -4.917 4.348 7.285 1.00 0.00 H new ATOM 0 HZ2 TRP B 38 -4.208 7.469 11.109 1.00 0.00 H new ATOM 0 HZ3 TRP B 38 -4.757 6.779 6.923 1.00 0.00 H new ATOM 0 HH2 TRP B 38 -4.404 8.317 8.811 1.00 0.00 H new ATOM 896 N GLU B 39 -6.920 0.449 7.034 1.00 0.00 N ATOM 897 CA GLU B 39 -7.089 -0.646 6.083 1.00 0.00 C ATOM 898 C GLU B 39 -6.161 -0.484 4.883 1.00 0.00 C ATOM 899 O GLU B 39 -5.749 0.627 4.546 1.00 0.00 O ATOM 900 CB GLU B 39 -8.543 -0.714 5.611 1.00 0.00 C ATOM 901 CG GLU B 39 -9.536 -0.978 6.733 1.00 0.00 C ATOM 902 CD GLU B 39 -9.304 -2.308 7.419 1.00 0.00 C ATOM 903 OE1 GLU B 39 -9.879 -3.320 6.963 1.00 0.00 O ATOM 904 OE2 GLU B 39 -8.547 -2.341 8.412 1.00 0.00 O ATOM 0 H GLU B 39 -7.157 1.370 6.665 1.00 0.00 H new ATOM 0 HA GLU B 39 -6.830 -1.575 6.591 1.00 0.00 H new ATOM 0 HB2 GLU B 39 -8.802 0.225 5.122 1.00 0.00 H new ATOM 0 HB3 GLU B 39 -8.637 -1.500 4.862 1.00 0.00 H new ATOM 0 HG2 GLU B 39 -9.467 -0.177 7.469 1.00 0.00 H new ATOM 0 HG3 GLU B 39 -10.548 -0.954 6.330 1.00 0.00 H new ATOM 911 N LEU B 40 -5.838 -1.605 4.241 1.00 0.00 N ATOM 912 CA LEU B 40 -4.964 -1.599 3.073 1.00 0.00 C ATOM 913 C LEU B 40 -5.764 -1.757 1.785 1.00 0.00 C ATOM 914 O LEU B 40 -6.137 -2.868 1.407 1.00 0.00 O ATOM 915 CB LEU B 40 -3.929 -2.722 3.180 1.00 0.00 C ATOM 916 CG LEU B 40 -2.692 -2.396 4.019 1.00 0.00 C ATOM 917 CD1 LEU B 40 -1.980 -3.674 4.434 1.00 0.00 C ATOM 918 CD2 LEU B 40 -1.749 -1.487 3.245 1.00 0.00 C ATOM 0 H LEU B 40 -6.170 -2.531 4.512 1.00 0.00 H new ATOM 0 HA LEU B 40 -4.452 -0.637 3.044 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -4.414 -3.601 3.605 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -3.605 -2.991 2.175 1.00 0.00 H new ATOM 0 HG LEU B 40 -3.013 -1.872 4.920 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -1.102 -3.424 5.030 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -2.656 -4.292 5.025 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -1.670 -4.223 3.545 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -0.874 -1.265 3.856 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -1.434 -1.985 2.328 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -2.262 -0.558 2.995 1.00 0.00 H new ATOM 930 N ARG B 41 -6.028 -0.639 1.117 1.00 0.00 N ATOM 931 CA ARG B 41 -6.777 -0.657 -0.134 1.00 0.00 C ATOM 932 C ARG B 41 -5.925 -1.230 -1.261 1.00 0.00 C ATOM 933 O ARG B 41 -6.445 -1.705 -2.271 1.00 0.00 O ATOM 934 CB ARG B 41 -7.245 0.754 -0.498 1.00 0.00 C ATOM 935 CG ARG B 41 -8.210 1.358 0.512 1.00 0.00 C ATOM 936 CD ARG B 41 -9.516 0.580 0.571 1.00 0.00 C ATOM 937 NE ARG B 41 -10.201 0.562 -0.720 1.00 0.00 N ATOM 938 CZ ARG B 41 -11.207 -0.259 -1.010 1.00 0.00 C ATOM 939 NH1 ARG B 41 -11.641 -1.127 -0.106 1.00 0.00 N ATOM 940 NH2 ARG B 41 -11.780 -0.210 -2.205 1.00 0.00 N ATOM 0 H ARG B 41 -5.735 0.290 1.420 1.00 0.00 H new ATOM 0 HA ARG B 41 -7.651 -1.294 0.002 1.00 0.00 H new ATOM 0 HB2 ARG B 41 -6.375 1.404 -0.589 1.00 0.00 H new ATOM 0 HB3 ARG B 41 -7.726 0.727 -1.476 1.00 0.00 H new ATOM 0 HG2 ARG B 41 -7.746 1.368 1.498 1.00 0.00 H new ATOM 0 HG3 ARG B 41 -8.415 2.395 0.246 1.00 0.00 H new ATOM 0 HD2 ARG B 41 -9.315 -0.443 0.889 1.00 0.00 H new ATOM 0 HD3 ARG B 41 -10.169 1.024 1.322 1.00 0.00 H new ATOM 0 HE ARG B 41 -9.890 1.215 -1.439 1.00 0.00 H new ATOM 0 HH11 ARG B 41 -11.203 -1.166 0.814 1.00 0.00 H new ATOM 0 HH12 ARG B 41 -12.412 -1.755 -0.331 1.00 0.00 H new ATOM 0 HH21 ARG B 41 -11.449 0.457 -2.902 1.00 0.00 H new ATOM 0 HH22 ARG B 41 -12.551 -0.840 -2.427 1.00 0.00 H new ATOM 954 N ASN B 42 -4.608 -1.180 -1.079 1.00 0.00 N ATOM 955 CA ASN B 42 -3.674 -1.694 -2.072 1.00 0.00 C ATOM 956 C ASN B 42 -2.288 -1.890 -1.456 1.00 0.00 C ATOM 957 O ASN B 42 -1.433 -1.006 -1.542 1.00 0.00 O ATOM 958 CB ASN B 42 -3.590 -0.741 -3.268 1.00 0.00 C ATOM 959 CG ASN B 42 -2.786 -1.321 -4.415 1.00 0.00 C ATOM 960 OD1 ASN B 42 -2.706 -2.540 -4.579 1.00 0.00 O ATOM 961 ND2 ASN B 42 -2.186 -0.450 -5.219 1.00 0.00 N ATOM 0 H ASN B 42 -4.164 -0.787 -0.249 1.00 0.00 H new ATOM 0 HA ASN B 42 -4.039 -2.661 -2.418 1.00 0.00 H new ATOM 0 HB2 ASN B 42 -4.597 -0.508 -3.615 1.00 0.00 H new ATOM 0 HB3 ASN B 42 -3.138 0.198 -2.949 1.00 0.00 H new ATOM 0 HD21 ASN B 42 -1.633 -0.782 -6.009 1.00 0.00 H new ATOM 0 HD22 ASN B 42 -2.279 0.551 -5.046 1.00 0.00 H new ATOM 968 N PRO B 43 -2.049 -3.052 -0.821 1.00 0.00 N ATOM 969 CA PRO B 43 -0.764 -3.360 -0.183 1.00 0.00 C ATOM 970 C PRO B 43 0.306 -3.770 -1.189 1.00 0.00 C ATOM 971 O PRO B 43 1.184 -4.577 -0.876 1.00 0.00 O ATOM 972 CB PRO B 43 -1.111 -4.532 0.731 1.00 0.00 C ATOM 973 CG PRO B 43 -2.218 -5.234 0.022 1.00 0.00 C ATOM 974 CD PRO B 43 -3.017 -4.159 -0.669 1.00 0.00 C ATOM 0 HA PRO B 43 -0.345 -2.497 0.334 1.00 0.00 H new ATOM 0 HB2 PRO B 43 -0.254 -5.189 0.879 1.00 0.00 H new ATOM 0 HB3 PRO B 43 -1.424 -4.189 1.717 1.00 0.00 H new ATOM 0 HG2 PRO B 43 -1.826 -5.953 -0.698 1.00 0.00 H new ATOM 0 HG3 PRO B 43 -2.839 -5.792 0.723 1.00 0.00 H new ATOM 0 HD2 PRO B 43 -3.394 -4.497 -1.634 1.00 0.00 H new ATOM 0 HD3 PRO B 43 -3.881 -3.858 -0.077 1.00 0.00 H new ATOM 982 N ALA B 44 0.237 -3.206 -2.392 1.00 0.00 N ATOM 983 CA ALA B 44 1.200 -3.522 -3.441 1.00 0.00 C ATOM 984 C ALA B 44 1.213 -5.016 -3.737 1.00 0.00 C ATOM 985 O ALA B 44 2.204 -5.553 -4.229 1.00 0.00 O ATOM 986 CB ALA B 44 2.592 -3.048 -3.044 1.00 0.00 C ATOM 0 H ALA B 44 -0.475 -2.528 -2.664 1.00 0.00 H new ATOM 0 HA ALA B 44 0.897 -2.999 -4.348 1.00 0.00 H new ATOM 0 HB1 ALA B 44 3.299 -3.291 -3.837 1.00 0.00 H new ATOM 0 HB2 ALA B 44 2.578 -1.969 -2.888 1.00 0.00 H new ATOM 0 HB3 ALA B 44 2.896 -3.544 -2.122 1.00 0.00 H new ATOM 992 N ALA B 45 0.099 -5.682 -3.440 1.00 0.00 N ATOM 993 CA ALA B 45 -0.022 -7.116 -3.674 1.00 0.00 C ATOM 994 C ALA B 45 0.217 -7.457 -5.142 1.00 0.00 C ATOM 995 O ALA B 45 0.370 -8.625 -5.503 1.00 0.00 O ATOM 996 CB ALA B 45 -1.390 -7.607 -3.229 1.00 0.00 C ATOM 0 H ALA B 45 -0.732 -5.250 -3.037 1.00 0.00 H new ATOM 0 HA ALA B 45 0.743 -7.622 -3.085 1.00 0.00 H new ATOM 0 HB1 ALA B 45 -1.468 -8.679 -3.409 1.00 0.00 H new ATOM 0 HB2 ALA B 45 -1.520 -7.407 -2.165 1.00 0.00 H new ATOM 0 HB3 ALA B 45 -2.164 -7.087 -3.793 1.00 0.00 H new ATOM 1002 N SER B 46 0.245 -6.428 -5.984 1.00 0.00 N ATOM 1003 CA SER B 46 0.467 -6.613 -7.413 1.00 0.00 C ATOM 1004 C SER B 46 1.842 -7.218 -7.678 1.00 0.00 C ATOM 1005 O SER B 46 1.969 -8.176 -8.441 1.00 0.00 O ATOM 1006 CB SER B 46 0.335 -5.277 -8.148 1.00 0.00 C ATOM 1007 OG SER B 46 0.548 -5.438 -9.541 1.00 0.00 O ATOM 0 H SER B 46 0.116 -5.457 -5.700 1.00 0.00 H new ATOM 0 HA SER B 46 -0.291 -7.302 -7.786 1.00 0.00 H new ATOM 0 HB2 SER B 46 -0.657 -4.859 -7.974 1.00 0.00 H new ATOM 0 HB3 SER B 46 1.056 -4.565 -7.747 1.00 0.00 H new ATOM 0 HG SER B 46 0.457 -4.571 -9.988 1.00 0.00 H new ATOM 1013 N VAL B 47 2.869 -6.656 -7.044 1.00 0.00 N ATOM 1014 CA VAL B 47 4.231 -7.147 -7.222 1.00 0.00 C ATOM 1015 C VAL B 47 4.903 -7.421 -5.875 1.00 0.00 C ATOM 1016 O VAL B 47 5.671 -8.376 -5.743 1.00 0.00 O ATOM 1017 CB VAL B 47 5.088 -6.157 -8.041 1.00 0.00 C ATOM 1018 CG1 VAL B 47 4.369 -5.778 -9.326 1.00 0.00 C ATOM 1019 CG2 VAL B 47 5.425 -4.919 -7.228 1.00 0.00 C ATOM 0 H VAL B 47 2.784 -5.865 -6.406 1.00 0.00 H new ATOM 0 HA VAL B 47 4.160 -8.083 -7.776 1.00 0.00 H new ATOM 0 HB VAL B 47 6.026 -6.650 -8.297 1.00 0.00 H new ATOM 0 HG11 VAL B 47 4.983 -5.080 -9.894 1.00 0.00 H new ATOM 0 HG12 VAL B 47 4.192 -6.674 -9.922 1.00 0.00 H new ATOM 0 HG13 VAL B 47 3.415 -5.309 -9.084 1.00 0.00 H new ATOM 0 HG21 VAL B 47 6.029 -4.241 -7.831 1.00 0.00 H new ATOM 0 HG22 VAL B 47 4.504 -4.417 -6.930 1.00 0.00 H new ATOM 0 HG23 VAL B 47 5.984 -5.209 -6.338 1.00 0.00 H new ATOM 1029 N LEU B 48 4.614 -6.587 -4.880 1.00 0.00 N ATOM 1030 CA LEU B 48 5.192 -6.762 -3.548 1.00 0.00 C ATOM 1031 C LEU B 48 4.575 -7.971 -2.851 1.00 0.00 C ATOM 1032 O LEU B 48 3.764 -8.690 -3.434 1.00 0.00 O ATOM 1033 CB LEU B 48 4.984 -5.512 -2.686 1.00 0.00 C ATOM 1034 CG LEU B 48 5.978 -4.374 -2.920 1.00 0.00 C ATOM 1035 CD1 LEU B 48 5.816 -3.779 -4.301 1.00 0.00 C ATOM 1036 CD2 LEU B 48 5.831 -3.302 -1.846 1.00 0.00 C ATOM 0 H LEU B 48 3.987 -5.787 -4.968 1.00 0.00 H new ATOM 0 HA LEU B 48 6.262 -6.926 -3.672 1.00 0.00 H new ATOM 0 HB2 LEU B 48 3.978 -5.133 -2.864 1.00 0.00 H new ATOM 0 HB3 LEU B 48 5.034 -5.804 -1.637 1.00 0.00 H new ATOM 0 HG LEU B 48 6.984 -4.789 -2.854 1.00 0.00 H new ATOM 0 HD11 LEU B 48 6.537 -2.973 -4.437 1.00 0.00 H new ATOM 0 HD12 LEU B 48 5.989 -4.550 -5.052 1.00 0.00 H new ATOM 0 HD13 LEU B 48 4.806 -3.385 -4.411 1.00 0.00 H new ATOM 0 HD21 LEU B 48 6.547 -2.501 -2.031 1.00 0.00 H new ATOM 0 HD22 LEU B 48 4.819 -2.897 -1.872 1.00 0.00 H new ATOM 0 HD23 LEU B 48 6.021 -3.740 -0.866 1.00 0.00 H new ATOM 1048 N LYS B 49 4.969 -8.186 -1.600 1.00 0.00 N ATOM 1049 CA LYS B 49 4.460 -9.306 -0.818 1.00 0.00 C ATOM 1050 C LYS B 49 4.270 -8.906 0.645 1.00 0.00 C ATOM 1051 O LYS B 49 4.984 -8.047 1.159 1.00 0.00 O ATOM 1052 CB LYS B 49 5.420 -10.488 -0.920 1.00 0.00 C ATOM 1053 CG LYS B 49 4.899 -11.762 -0.276 1.00 0.00 C ATOM 1054 CD LYS B 49 5.922 -12.881 -0.362 1.00 0.00 C ATOM 1055 CE LYS B 49 7.144 -12.590 0.497 1.00 0.00 C ATOM 1056 NZ LYS B 49 8.131 -13.705 0.455 1.00 0.00 N ATOM 0 H LYS B 49 5.640 -7.598 -1.106 1.00 0.00 H new ATOM 0 HA LYS B 49 3.489 -9.596 -1.220 1.00 0.00 H new ATOM 0 HB2 LYS B 49 5.629 -10.684 -1.972 1.00 0.00 H new ATOM 0 HB3 LYS B 49 6.366 -10.216 -0.452 1.00 0.00 H new ATOM 0 HG2 LYS B 49 4.654 -11.570 0.769 1.00 0.00 H new ATOM 0 HG3 LYS B 49 3.977 -12.070 -0.769 1.00 0.00 H new ATOM 0 HD2 LYS B 49 5.466 -13.817 -0.041 1.00 0.00 H new ATOM 0 HD3 LYS B 49 6.229 -13.015 -1.399 1.00 0.00 H new ATOM 0 HE2 LYS B 49 7.619 -11.671 0.153 1.00 0.00 H new ATOM 0 HE3 LYS B 49 6.831 -12.421 1.527 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 8.948 -13.468 1.053 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 7.686 -14.576 0.807 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 8.449 -13.850 -0.524 1.00 0.00 H new ATOM 1070 N ARG B 50 3.303 -9.536 1.305 1.00 0.00 N ATOM 1071 CA ARG B 50 3.021 -9.244 2.706 1.00 0.00 C ATOM 1072 C ARG B 50 3.754 -10.218 3.624 1.00 0.00 C ATOM 1073 O ARG B 50 4.106 -11.326 3.218 1.00 0.00 O ATOM 1074 CB ARG B 50 1.517 -9.311 2.971 1.00 0.00 C ATOM 1075 CG ARG B 50 0.710 -8.316 2.154 1.00 0.00 C ATOM 1076 CD ARG B 50 -0.771 -8.390 2.490 1.00 0.00 C ATOM 1077 NE ARG B 50 -1.327 -9.717 2.232 1.00 0.00 N ATOM 1078 CZ ARG B 50 -2.577 -10.061 2.520 1.00 0.00 C ATOM 1079 NH1 ARG B 50 -3.402 -9.180 3.071 1.00 0.00 N ATOM 1080 NH2 ARG B 50 -3.007 -11.288 2.254 1.00 0.00 N ATOM 0 H ARG B 50 2.703 -10.250 0.893 1.00 0.00 H new ATOM 0 HA ARG B 50 3.376 -8.235 2.918 1.00 0.00 H new ATOM 0 HB2 ARG B 50 1.163 -10.319 2.754 1.00 0.00 H new ATOM 0 HB3 ARG B 50 1.335 -9.131 4.030 1.00 0.00 H new ATOM 0 HG2 ARG B 50 1.077 -7.307 2.342 1.00 0.00 H new ATOM 0 HG3 ARG B 50 0.854 -8.515 1.092 1.00 0.00 H new ATOM 0 HD2 ARG B 50 -0.918 -8.134 3.539 1.00 0.00 H new ATOM 0 HD3 ARG B 50 -1.313 -7.649 1.902 1.00 0.00 H new ATOM 0 HE ARG B 50 -0.721 -10.418 1.807 1.00 0.00 H new ATOM 0 HH11 ARG B 50 -3.077 -8.235 3.275 1.00 0.00 H new ATOM 0 HH12 ARG B 50 -4.361 -9.448 3.291 1.00 0.00 H new ATOM 0 HH21 ARG B 50 -2.377 -11.968 1.828 1.00 0.00 H new ATOM 0 HH22 ARG B 50 -3.967 -11.551 2.476 1.00 0.00 H new ATOM 1094 N LEU B 51 3.984 -9.795 4.864 1.00 0.00 N ATOM 1095 CA LEU B 51 4.675 -10.631 5.842 1.00 0.00 C ATOM 1096 C LEU B 51 3.677 -11.383 6.717 1.00 0.00 C ATOM 1097 O LEU B 51 3.566 -12.607 6.636 1.00 0.00 O ATOM 1098 CB LEU B 51 5.595 -9.774 6.716 1.00 0.00 C ATOM 1099 CG LEU B 51 6.675 -8.999 5.957 1.00 0.00 C ATOM 1100 CD1 LEU B 51 7.432 -8.077 6.901 1.00 0.00 C ATOM 1101 CD2 LEU B 51 7.634 -9.954 5.262 1.00 0.00 C ATOM 0 H LEU B 51 3.703 -8.880 5.215 1.00 0.00 H new ATOM 0 HA LEU B 51 5.276 -11.361 5.300 1.00 0.00 H new ATOM 0 HB2 LEU B 51 4.984 -9.064 7.273 1.00 0.00 H new ATOM 0 HB3 LEU B 51 6.080 -10.420 7.448 1.00 0.00 H new ATOM 0 HG LEU B 51 6.188 -8.390 5.196 1.00 0.00 H new ATOM 0 HD11 LEU B 51 8.196 -7.534 6.344 1.00 0.00 H new ATOM 0 HD12 LEU B 51 6.738 -7.367 7.351 1.00 0.00 H new ATOM 0 HD13 LEU B 51 7.906 -8.668 7.685 1.00 0.00 H new ATOM 0 HD21 LEU B 51 8.394 -9.383 4.728 1.00 0.00 H new ATOM 0 HD22 LEU B 51 8.114 -10.592 6.004 1.00 0.00 H new ATOM 0 HD23 LEU B 51 7.082 -10.573 4.555 1.00 0.00 H new ATOM 1113 N GLY B 52 2.952 -10.644 7.552 1.00 0.00 N ATOM 1114 CA GLY B 52 1.972 -11.261 8.427 1.00 0.00 C ATOM 1115 C GLY B 52 0.975 -10.260 8.985 1.00 0.00 C ATOM 1116 O GLY B 52 1.263 -9.065 9.041 1.00 0.00 O ATOM 0 H GLY B 52 3.026 -9.630 7.638 1.00 0.00 H new ATOM 0 HA2 GLY B 52 1.436 -12.035 7.877 1.00 0.00 H new ATOM 0 HA3 GLY B 52 2.486 -11.754 9.252 1.00 0.00 H new ATOM 1120 N PRO B 53 -0.214 -10.726 9.407 1.00 0.00 N ATOM 1121 CA PRO B 53 -1.257 -9.856 9.962 1.00 0.00 C ATOM 1122 C PRO B 53 -0.844 -9.234 11.292 1.00 0.00 C ATOM 1123 O PRO B 53 -0.929 -8.019 11.473 1.00 0.00 O ATOM 1124 CB PRO B 53 -2.454 -10.797 10.164 1.00 0.00 C ATOM 1125 CG PRO B 53 -2.131 -12.022 9.376 1.00 0.00 C ATOM 1126 CD PRO B 53 -0.642 -12.132 9.373 1.00 0.00 C ATOM 0 HA PRO B 53 -1.470 -9.015 9.303 1.00 0.00 H new ATOM 0 HB2 PRO B 53 -2.594 -11.034 11.219 1.00 0.00 H new ATOM 0 HB3 PRO B 53 -3.379 -10.337 9.815 1.00 0.00 H new ATOM 0 HG2 PRO B 53 -2.586 -12.905 9.825 1.00 0.00 H new ATOM 0 HG3 PRO B 53 -2.518 -11.945 8.360 1.00 0.00 H new ATOM 0 HD2 PRO B 53 -0.275 -12.688 10.236 1.00 0.00 H new ATOM 0 HD3 PRO B 53 -0.276 -12.645 8.484 1.00 0.00 H new ATOM 1134 N GLU B 54 -0.402 -10.077 12.222 1.00 0.00 N ATOM 1135 CA GLU B 54 0.022 -9.613 13.539 1.00 0.00 C ATOM 1136 C GLU B 54 1.133 -8.575 13.421 1.00 0.00 C ATOM 1137 O GLU B 54 1.899 -8.579 12.458 1.00 0.00 O ATOM 1138 CB GLU B 54 0.496 -10.793 14.391 1.00 0.00 C ATOM 1139 CG GLU B 54 -0.579 -11.839 14.632 1.00 0.00 C ATOM 1140 CD GLU B 54 -0.090 -12.988 15.493 1.00 0.00 C ATOM 1141 OE1 GLU B 54 -0.228 -12.902 16.732 1.00 0.00 O ATOM 1142 OE2 GLU B 54 0.429 -13.974 14.930 1.00 0.00 O ATOM 0 H GLU B 54 -0.328 -11.085 12.087 1.00 0.00 H new ATOM 0 HA GLU B 54 -0.835 -9.145 14.024 1.00 0.00 H new ATOM 0 HB2 GLU B 54 1.348 -11.265 13.901 1.00 0.00 H new ATOM 0 HB3 GLU B 54 0.849 -10.418 15.352 1.00 0.00 H new ATOM 0 HG2 GLU B 54 -1.437 -11.369 15.112 1.00 0.00 H new ATOM 0 HG3 GLU B 54 -0.924 -12.228 13.674 1.00 0.00 H new ATOM 1149 N VAL B 55 1.214 -7.689 14.410 1.00 0.00 N ATOM 1150 CA VAL B 55 2.230 -6.643 14.418 1.00 0.00 C ATOM 1151 C VAL B 55 3.049 -6.684 15.704 1.00 0.00 C ATOM 1152 O VAL B 55 3.801 -5.755 16.002 1.00 0.00 O ATOM 1153 CB VAL B 55 1.599 -5.246 14.267 1.00 0.00 C ATOM 1154 CG1 VAL B 55 0.930 -5.108 12.907 1.00 0.00 C ATOM 1155 CG2 VAL B 55 0.605 -4.981 15.387 1.00 0.00 C ATOM 0 H VAL B 55 0.588 -7.675 15.215 1.00 0.00 H new ATOM 0 HA VAL B 55 2.885 -6.830 13.567 1.00 0.00 H new ATOM 0 HB VAL B 55 2.392 -4.501 14.336 1.00 0.00 H new ATOM 0 HG11 VAL B 55 0.489 -4.115 12.817 1.00 0.00 H new ATOM 0 HG12 VAL B 55 1.672 -5.248 12.121 1.00 0.00 H new ATOM 0 HG13 VAL B 55 0.149 -5.862 12.808 1.00 0.00 H new ATOM 0 HG21 VAL B 55 0.171 -3.989 15.261 1.00 0.00 H new ATOM 0 HG22 VAL B 55 -0.186 -5.730 15.356 1.00 0.00 H new ATOM 0 HG23 VAL B 55 1.117 -5.034 16.348 1.00 0.00 H new ATOM 1165 N TYR B 56 2.901 -7.768 16.459 1.00 0.00 N ATOM 1166 CA TYR B 56 3.624 -7.933 17.714 1.00 0.00 C ATOM 1167 C TYR B 56 4.583 -9.118 17.639 1.00 0.00 C ATOM 1168 O TYR B 56 4.286 -10.128 16.999 1.00 0.00 O ATOM 1169 CB TYR B 56 2.646 -8.128 18.873 1.00 0.00 C ATOM 1170 CG TYR B 56 1.723 -6.950 19.092 1.00 0.00 C ATOM 1171 CD1 TYR B 56 0.461 -6.915 18.511 1.00 0.00 C ATOM 1172 CD2 TYR B 56 2.112 -5.875 19.880 1.00 0.00 C ATOM 1173 CE1 TYR B 56 -0.385 -5.839 18.710 1.00 0.00 C ATOM 1174 CE2 TYR B 56 1.273 -4.797 20.085 1.00 0.00 C ATOM 1175 CZ TYR B 56 0.025 -4.784 19.496 1.00 0.00 C ATOM 1176 OH TYR B 56 -0.815 -3.712 19.696 1.00 0.00 O ATOM 0 H TYR B 56 2.286 -8.546 16.222 1.00 0.00 H new ATOM 0 HA TYR B 56 4.205 -7.027 17.888 1.00 0.00 H new ATOM 0 HB2 TYR B 56 2.046 -9.019 18.685 1.00 0.00 H new ATOM 0 HB3 TYR B 56 3.211 -8.311 19.787 1.00 0.00 H new ATOM 0 HD1 TYR B 56 0.136 -7.740 17.895 1.00 0.00 H new ATOM 0 HD2 TYR B 56 3.089 -5.882 20.341 1.00 0.00 H new ATOM 0 HE1 TYR B 56 -1.363 -5.826 18.251 1.00 0.00 H new ATOM 0 HE2 TYR B 56 1.592 -3.970 20.702 1.00 0.00 H new ATOM 0 HH TYR B 56 -0.375 -3.055 20.275 1.00 0.00 H new ATOM 1186 N SER B 57 5.731 -8.988 18.296 1.00 0.00 N ATOM 1187 CA SER B 57 6.733 -10.047 18.302 1.00 0.00 C ATOM 1188 C SER B 57 7.633 -9.940 19.530 1.00 0.00 C ATOM 1189 O SER B 57 7.619 -10.808 20.403 1.00 0.00 O ATOM 1190 CB SER B 57 7.578 -9.988 17.029 1.00 0.00 C ATOM 1191 OG SER B 57 8.557 -11.012 17.019 1.00 0.00 O ATOM 0 H SER B 57 5.990 -8.159 18.831 1.00 0.00 H new ATOM 0 HA SER B 57 6.212 -11.004 18.339 1.00 0.00 H new ATOM 0 HB2 SER B 57 6.933 -10.088 16.156 1.00 0.00 H new ATOM 0 HB3 SER B 57 8.064 -9.015 16.956 1.00 0.00 H new ATOM 0 HG SER B 57 9.083 -10.954 16.194 1.00 0.00 H new ATOM 1197 N ASN B 58 8.415 -8.864 19.591 1.00 0.00 N ATOM 1198 CA ASN B 58 9.322 -8.641 20.711 1.00 0.00 C ATOM 1199 C ASN B 58 8.796 -7.546 21.630 1.00 0.00 C ATOM 1200 O ASN B 58 7.736 -6.968 21.381 1.00 0.00 O ATOM 1201 CB ASN B 58 10.715 -8.266 20.198 1.00 0.00 C ATOM 1202 CG ASN B 58 11.327 -9.348 19.328 1.00 0.00 C ATOM 1203 OD1 ASN B 58 10.995 -10.603 19.618 1.00 0.00 O flip ATOM 1204 ND2 ASN B 58 12.093 -9.062 18.407 1.00 0.00 N flip ATOM 0 H ASN B 58 8.438 -8.135 18.878 1.00 0.00 H new ATOM 0 HA ASN B 58 9.388 -9.567 21.282 1.00 0.00 H new ATOM 0 HB2 ASN B 58 10.651 -7.339 19.628 1.00 0.00 H new ATOM 0 HB3 ASN B 58 11.371 -8.073 21.047 1.00 0.00 H new ATOM 0 HD21 ASN B 58 12.322 -8.086 18.218 1.00 0.00 H new ATOM 0 HD22 ASN B 58 12.499 -9.801 17.833 1.00 0.00 H new ATOM 1211 N SER B 59 9.540 -7.264 22.696 1.00 0.00 N ATOM 1212 CA SER B 59 9.148 -6.236 23.654 1.00 0.00 C ATOM 1213 C SER B 59 9.241 -4.846 23.030 1.00 0.00 C ATOM 1214 O SER B 59 8.263 -4.097 23.010 1.00 0.00 O ATOM 1215 CB SER B 59 10.032 -6.307 24.900 1.00 0.00 C ATOM 1216 OG SER B 59 9.921 -7.571 25.535 1.00 0.00 O ATOM 0 H SER B 59 10.418 -7.733 22.918 1.00 0.00 H new ATOM 0 HA SER B 59 8.112 -6.418 23.940 1.00 0.00 H new ATOM 0 HB2 SER B 59 11.071 -6.126 24.623 1.00 0.00 H new ATOM 0 HB3 SER B 59 9.746 -5.520 25.598 1.00 0.00 H new ATOM 0 HG SER B 59 10.497 -7.591 26.327 1.00 0.00 H new ATOM 1222 N GLU B 60 10.422 -4.508 22.524 1.00 0.00 N ATOM 1223 CA GLU B 60 10.644 -3.207 21.899 1.00 0.00 C ATOM 1224 C GLU B 60 11.201 -3.370 20.489 1.00 0.00 C ATOM 1225 O GLU B 60 12.328 -3.831 20.305 1.00 0.00 O ATOM 1226 CB GLU B 60 11.599 -2.368 22.746 1.00 0.00 C ATOM 1227 CG GLU B 60 11.837 -0.972 22.197 1.00 0.00 C ATOM 1228 CD GLU B 60 12.790 -0.161 23.053 1.00 0.00 C ATOM 1229 OE1 GLU B 60 12.318 0.520 23.988 1.00 0.00 O ATOM 1230 OE2 GLU B 60 14.010 -0.207 22.789 1.00 0.00 O ATOM 0 H GLU B 60 11.241 -5.116 22.534 1.00 0.00 H new ATOM 0 HA GLU B 60 9.685 -2.694 21.833 1.00 0.00 H new ATOM 0 HB2 GLU B 60 11.199 -2.288 23.757 1.00 0.00 H new ATOM 0 HB3 GLU B 60 12.555 -2.887 22.822 1.00 0.00 H new ATOM 0 HG2 GLU B 60 12.238 -1.047 21.186 1.00 0.00 H new ATOM 0 HG3 GLU B 60 10.884 -0.447 22.124 1.00 0.00 H new ATOM 1237 N GLU B 61 10.404 -2.988 19.496 1.00 0.00 N ATOM 1238 CA GLU B 61 10.815 -3.091 18.100 1.00 0.00 C ATOM 1239 C GLU B 61 11.644 -1.877 17.687 1.00 0.00 C ATOM 1240 O GLU B 61 12.819 -2.005 17.345 1.00 0.00 O ATOM 1241 CB GLU B 61 9.588 -3.218 17.194 1.00 0.00 C ATOM 1242 CG GLU B 61 9.930 -3.372 15.721 1.00 0.00 C ATOM 1243 CD GLU B 61 10.757 -4.612 15.438 1.00 0.00 C ATOM 1244 OE1 GLU B 61 10.159 -5.678 15.183 1.00 0.00 O ATOM 1245 OE2 GLU B 61 12.001 -4.515 15.473 1.00 0.00 O ATOM 0 H GLU B 61 9.469 -2.604 19.632 1.00 0.00 H new ATOM 0 HA GLU B 61 11.431 -3.984 17.992 1.00 0.00 H new ATOM 0 HB2 GLU B 61 8.999 -4.078 17.513 1.00 0.00 H new ATOM 0 HB3 GLU B 61 8.960 -2.336 17.322 1.00 0.00 H new ATOM 0 HG2 GLU B 61 9.008 -3.415 15.141 1.00 0.00 H new ATOM 0 HG3 GLU B 61 10.477 -2.491 15.385 1.00 0.00 H new ATOM 1252 N ASP B 62 11.020 -0.704 17.723 1.00 0.00 N ATOM 1253 CA ASP B 62 11.699 0.533 17.353 1.00 0.00 C ATOM 1254 C ASP B 62 11.587 1.568 18.469 1.00 0.00 C ATOM 1255 O ASP B 62 12.595 2.048 18.988 1.00 0.00 O ATOM 1256 CB ASP B 62 11.109 1.096 16.058 1.00 0.00 C ATOM 1257 CG ASP B 62 11.792 2.377 15.619 1.00 0.00 C ATOM 1258 OD1 ASP B 62 11.338 3.464 16.030 1.00 0.00 O ATOM 1259 OD2 ASP B 62 12.782 2.291 14.862 1.00 0.00 O ATOM 0 H ASP B 62 10.047 -0.584 18.004 1.00 0.00 H new ATOM 0 HA ASP B 62 12.754 0.307 17.195 1.00 0.00 H new ATOM 0 HB2 ASP B 62 11.198 0.351 15.268 1.00 0.00 H new ATOM 0 HB3 ASP B 62 10.045 1.285 16.199 1.00 0.00 H new ATOM 1264 N SER B 63 10.353 1.905 18.834 1.00 0.00 N ATOM 1265 CA SER B 63 10.108 2.882 19.889 1.00 0.00 C ATOM 1266 C SER B 63 8.922 2.460 20.750 1.00 0.00 C ATOM 1267 O SER B 63 9.087 2.093 21.915 1.00 0.00 O ATOM 1268 CB SER B 63 9.849 4.263 19.285 1.00 0.00 C ATOM 1269 OG SER B 63 10.965 4.709 18.533 1.00 0.00 O ATOM 0 H SER B 63 9.508 1.516 18.415 1.00 0.00 H new ATOM 0 HA SER B 63 10.996 2.932 20.520 1.00 0.00 H new ATOM 0 HB2 SER B 63 8.968 4.224 18.645 1.00 0.00 H new ATOM 0 HB3 SER B 63 9.634 4.977 20.080 1.00 0.00 H new ATOM 0 HG SER B 63 11.007 4.217 17.687 1.00 0.00 H new ATOM 1275 N GLY B 64 7.727 2.515 20.170 1.00 0.00 N ATOM 1276 CA GLY B 64 6.528 2.138 20.899 1.00 0.00 C ATOM 1277 C GLY B 64 6.303 2.996 22.129 1.00 0.00 C ATOM 1278 O GLY B 64 5.677 2.557 23.094 1.00 0.00 O ATOM 0 H GLY B 64 7.567 2.814 19.208 1.00 0.00 H new ATOM 0 HA2 GLY B 64 5.664 2.221 20.239 1.00 0.00 H new ATOM 0 HA3 GLY B 64 6.602 1.092 21.198 1.00 0.00 H new ATOM 1282 N LEU B 65 6.814 4.222 22.093 1.00 0.00 N ATOM 1283 CA LEU B 65 6.666 5.145 23.214 1.00 0.00 C ATOM 1284 C LEU B 65 5.506 6.099 22.979 1.00 0.00 C ATOM 1285 O LEU B 65 5.430 7.173 23.576 1.00 0.00 O ATOM 1286 CB LEU B 65 7.954 5.940 23.416 1.00 0.00 C ATOM 1287 CG LEU B 65 9.197 5.100 23.723 1.00 0.00 C ATOM 1288 CD1 LEU B 65 10.428 5.989 23.815 1.00 0.00 C ATOM 1289 CD2 LEU B 65 9.009 4.312 25.010 1.00 0.00 C ATOM 0 H LEU B 65 7.334 4.600 21.301 1.00 0.00 H new ATOM 0 HA LEU B 65 6.460 4.560 24.110 1.00 0.00 H new ATOM 0 HB2 LEU B 65 8.145 6.527 22.517 1.00 0.00 H new ATOM 0 HB3 LEU B 65 7.802 6.647 24.232 1.00 0.00 H new ATOM 0 HG LEU B 65 9.343 4.391 22.908 1.00 0.00 H new ATOM 0 HD11 LEU B 65 11.303 5.377 24.034 1.00 0.00 H new ATOM 0 HD12 LEU B 65 10.575 6.507 22.867 1.00 0.00 H new ATOM 0 HD13 LEU B 65 10.289 6.721 24.610 1.00 0.00 H new ATOM 0 HD21 LEU B 65 9.904 3.722 25.209 1.00 0.00 H new ATOM 0 HD22 LEU B 65 8.837 5.001 25.837 1.00 0.00 H new ATOM 0 HD23 LEU B 65 8.151 3.647 24.908 1.00 0.00 H new ATOM 1301 N VAL B 66 4.606 5.685 22.109 1.00 0.00 N ATOM 1302 CA VAL B 66 3.433 6.480 21.772 1.00 0.00 C ATOM 1303 C VAL B 66 2.147 5.707 22.043 1.00 0.00 C ATOM 1304 O VAL B 66 1.913 4.648 21.460 1.00 0.00 O ATOM 1305 CB VAL B 66 3.455 6.913 20.293 1.00 0.00 C ATOM 1306 CG1 VAL B 66 2.304 7.863 19.994 1.00 0.00 C ATOM 1307 CG2 VAL B 66 4.791 7.551 19.941 1.00 0.00 C ATOM 0 H VAL B 66 4.663 4.794 21.616 1.00 0.00 H new ATOM 0 HA VAL B 66 3.460 7.367 22.405 1.00 0.00 H new ATOM 0 HB VAL B 66 3.330 6.025 19.674 1.00 0.00 H new ATOM 0 HG11 VAL B 66 2.338 8.157 18.945 1.00 0.00 H new ATOM 0 HG12 VAL B 66 1.357 7.364 20.201 1.00 0.00 H new ATOM 0 HG13 VAL B 66 2.392 8.750 20.622 1.00 0.00 H new ATOM 0 HG21 VAL B 66 4.787 7.850 18.893 1.00 0.00 H new ATOM 0 HG22 VAL B 66 4.952 8.428 20.568 1.00 0.00 H new ATOM 0 HG23 VAL B 66 5.593 6.833 20.110 1.00 0.00 H new ATOM 1317 N GLY B 67 1.319 6.243 22.934 1.00 0.00 N ATOM 1318 CA GLY B 67 0.066 5.592 23.269 1.00 0.00 C ATOM 1319 C GLY B 67 0.166 4.749 24.525 1.00 0.00 C ATOM 1320 O GLY B 67 -0.806 4.617 25.270 1.00 0.00 O ATOM 0 H GLY B 67 1.494 7.117 23.430 1.00 0.00 H new ATOM 0 HA2 GLY B 67 -0.708 6.348 23.404 1.00 0.00 H new ATOM 0 HA3 GLY B 67 -0.246 4.962 22.436 1.00 0.00 H new ATOM 1324 N SER B 68 1.345 4.176 24.757 1.00 0.00 N ATOM 1325 CA SER B 68 1.584 3.339 25.933 1.00 0.00 C ATOM 1326 C SER B 68 0.506 2.270 26.081 1.00 0.00 C ATOM 1327 O SER B 68 0.265 1.764 27.179 1.00 0.00 O ATOM 1328 CB SER B 68 1.651 4.197 27.198 1.00 0.00 C ATOM 1329 OG SER B 68 0.395 4.783 27.490 1.00 0.00 O ATOM 0 H SER B 68 2.154 4.276 24.144 1.00 0.00 H new ATOM 0 HA SER B 68 2.542 2.838 25.794 1.00 0.00 H new ATOM 0 HB2 SER B 68 1.973 3.583 28.039 1.00 0.00 H new ATOM 0 HB3 SER B 68 2.399 4.980 27.070 1.00 0.00 H new ATOM 0 HG SER B 68 -0.276 4.450 26.859 1.00 0.00 H new ATOM 1335 N GLY B 69 -0.138 1.925 24.969 1.00 0.00 N ATOM 1336 CA GLY B 69 -1.184 0.918 24.998 1.00 0.00 C ATOM 1337 C GLY B 69 -1.271 0.135 23.703 1.00 0.00 C ATOM 1338 O GLY B 69 -1.890 -0.930 23.655 1.00 0.00 O ATOM 0 H GLY B 69 0.046 2.325 24.049 1.00 0.00 H new ATOM 0 HA2 GLY B 69 -0.999 0.230 25.823 1.00 0.00 H new ATOM 0 HA3 GLY B 69 -2.142 1.399 25.193 1.00 0.00 H new ATOM 1342 N GLY B 70 -0.652 0.662 22.651 1.00 0.00 N ATOM 1343 CA GLY B 70 -0.672 -0.007 21.365 1.00 0.00 C ATOM 1344 C GLY B 70 -0.562 0.963 20.204 1.00 0.00 C ATOM 1345 O GLY B 70 -0.977 2.117 20.311 1.00 0.00 O ATOM 0 H GLY B 70 -0.136 1.542 22.667 1.00 0.00 H new ATOM 0 HA2 GLY B 70 0.151 -0.720 21.317 1.00 0.00 H new ATOM 0 HA3 GLY B 70 -1.595 -0.578 21.271 1.00 0.00 H new ATOM 1349 N GLU B 71 -0.001 0.493 19.094 1.00 0.00 N ATOM 1350 CA GLU B 71 0.161 1.325 17.907 1.00 0.00 C ATOM 1351 C GLU B 71 0.084 0.485 16.638 1.00 0.00 C ATOM 1352 O GLU B 71 0.113 -0.746 16.692 1.00 0.00 O ATOM 1353 CB GLU B 71 1.497 2.071 17.958 1.00 0.00 C ATOM 1354 CG GLU B 71 2.711 1.161 17.878 1.00 0.00 C ATOM 1355 CD GLU B 71 2.867 0.279 19.102 1.00 0.00 C ATOM 1356 OE1 GLU B 71 2.404 -0.879 19.062 1.00 0.00 O ATOM 1357 OE2 GLU B 71 3.453 0.749 20.100 1.00 0.00 O ATOM 0 H GLU B 71 0.349 -0.460 18.992 1.00 0.00 H new ATOM 0 HA GLU B 71 -0.652 2.051 17.891 1.00 0.00 H new ATOM 0 HB2 GLU B 71 1.535 2.785 17.136 1.00 0.00 H new ATOM 0 HB3 GLU B 71 1.546 2.646 18.882 1.00 0.00 H new ATOM 0 HG2 GLU B 71 2.630 0.533 16.991 1.00 0.00 H new ATOM 0 HG3 GLU B 71 3.608 1.769 17.757 1.00 0.00 H new ATOM 1364 N SER B 72 -0.019 1.155 15.494 1.00 0.00 N ATOM 1365 CA SER B 72 -0.103 0.470 14.209 1.00 0.00 C ATOM 1366 C SER B 72 1.259 0.429 13.523 1.00 0.00 C ATOM 1367 O SER B 72 1.803 1.465 13.139 1.00 0.00 O ATOM 1368 CB SER B 72 -1.123 1.162 13.303 1.00 0.00 C ATOM 1369 OG SER B 72 -2.411 1.164 13.894 1.00 0.00 O ATOM 0 H SER B 72 -0.046 2.173 15.431 1.00 0.00 H new ATOM 0 HA SER B 72 -0.427 -0.554 14.393 1.00 0.00 H new ATOM 0 HB2 SER B 72 -0.806 2.187 13.110 1.00 0.00 H new ATOM 0 HB3 SER B 72 -1.162 0.654 12.340 1.00 0.00 H new ATOM 0 HG SER B 72 -2.581 2.038 14.304 1.00 0.00 H new ATOM 1375 N THR B 73 1.802 -0.775 13.369 1.00 0.00 N ATOM 1376 CA THR B 73 3.098 -0.954 12.725 1.00 0.00 C ATOM 1377 C THR B 73 2.981 -1.866 11.510 1.00 0.00 C ATOM 1378 O THR B 73 2.900 -3.089 11.643 1.00 0.00 O ATOM 1379 CB THR B 73 4.135 -1.545 13.703 1.00 0.00 C ATOM 1380 OG1 THR B 73 4.254 -0.704 14.857 1.00 0.00 O ATOM 1381 CG2 THR B 73 5.494 -1.685 13.031 1.00 0.00 C ATOM 0 H THR B 73 1.364 -1.641 13.682 1.00 0.00 H new ATOM 0 HA THR B 73 3.435 0.032 12.406 1.00 0.00 H new ATOM 0 HB THR B 73 3.793 -2.534 14.007 1.00 0.00 H new ATOM 0 HG1 THR B 73 4.913 -1.086 15.474 1.00 0.00 H new ATOM 0 HG21 THR B 73 6.209 -2.104 13.739 1.00 0.00 H new ATOM 0 HG22 THR B 73 5.407 -2.347 12.169 1.00 0.00 H new ATOM 0 HG23 THR B 73 5.840 -0.705 12.702 1.00 0.00 H new ATOM 1389 N TRP B 74 2.967 -1.266 10.323 1.00 0.00 N ATOM 1390 CA TRP B 74 2.856 -2.024 9.083 1.00 0.00 C ATOM 1391 C TRP B 74 4.230 -2.401 8.543 1.00 0.00 C ATOM 1392 O TRP B 74 5.142 -1.574 8.501 1.00 0.00 O ATOM 1393 CB TRP B 74 2.090 -1.215 8.034 1.00 0.00 C ATOM 1394 CG TRP B 74 0.716 -0.816 8.478 1.00 0.00 C ATOM 1395 CD1 TRP B 74 0.351 0.371 9.049 1.00 0.00 C ATOM 1396 CD2 TRP B 74 -0.478 -1.601 8.387 1.00 0.00 C ATOM 1397 NE1 TRP B 74 -0.996 0.368 9.318 1.00 0.00 N ATOM 1398 CE2 TRP B 74 -1.527 -0.831 8.922 1.00 0.00 C ATOM 1399 CE3 TRP B 74 -0.762 -2.884 7.905 1.00 0.00 C ATOM 1400 CZ2 TRP B 74 -2.837 -1.299 8.987 1.00 0.00 C ATOM 1401 CZ3 TRP B 74 -2.064 -3.348 7.972 1.00 0.00 C ATOM 1402 CH2 TRP B 74 -3.086 -2.557 8.508 1.00 0.00 C ATOM 0 H TRP B 74 3.031 -0.256 10.195 1.00 0.00 H new ATOM 0 HA TRP B 74 2.309 -2.942 9.300 1.00 0.00 H new ATOM 0 HB2 TRP B 74 2.660 -0.318 7.790 1.00 0.00 H new ATOM 0 HB3 TRP B 74 2.012 -1.802 7.119 1.00 0.00 H new ATOM 0 HD1 TRP B 74 1.023 1.191 9.258 1.00 0.00 H new ATOM 0 HE1 TRP B 74 -1.517 1.135 9.744 1.00 0.00 H new ATOM 0 HE3 TRP B 74 0.021 -3.501 7.488 1.00 0.00 H new ATOM 0 HZ2 TRP B 74 -3.628 -0.691 9.401 1.00 0.00 H new ATOM 0 HZ3 TRP B 74 -2.295 -4.337 7.605 1.00 0.00 H new ATOM 0 HH2 TRP B 74 -4.092 -2.947 8.545 1.00 0.00 H new ATOM 1413 N ARG B 75 4.373 -3.658 8.132 1.00 0.00 N ATOM 1414 CA ARG B 75 5.633 -4.151 7.588 1.00 0.00 C ATOM 1415 C ARG B 75 5.397 -4.919 6.292 1.00 0.00 C ATOM 1416 O ARG B 75 4.662 -5.908 6.272 1.00 0.00 O ATOM 1417 CB ARG B 75 6.337 -5.049 8.606 1.00 0.00 C ATOM 1418 CG ARG B 75 6.704 -4.329 9.893 1.00 0.00 C ATOM 1419 CD ARG B 75 7.659 -5.155 10.737 1.00 0.00 C ATOM 1420 NE ARG B 75 7.070 -6.428 11.144 1.00 0.00 N ATOM 1421 CZ ARG B 75 7.725 -7.354 11.838 1.00 0.00 C ATOM 1422 NH1 ARG B 75 8.985 -7.151 12.201 1.00 0.00 N ATOM 1423 NH2 ARG B 75 7.119 -8.486 12.172 1.00 0.00 N ATOM 0 H ARG B 75 3.629 -4.355 8.166 1.00 0.00 H new ATOM 0 HA ARG B 75 6.270 -3.293 7.373 1.00 0.00 H new ATOM 0 HB2 ARG B 75 5.690 -5.894 8.843 1.00 0.00 H new ATOM 0 HB3 ARG B 75 7.242 -5.457 8.155 1.00 0.00 H new ATOM 0 HG2 ARG B 75 7.162 -3.369 9.657 1.00 0.00 H new ATOM 0 HG3 ARG B 75 5.800 -4.118 10.464 1.00 0.00 H new ATOM 0 HD2 ARG B 75 8.572 -5.342 10.172 1.00 0.00 H new ATOM 0 HD3 ARG B 75 7.943 -4.587 11.623 1.00 0.00 H new ATOM 0 HE ARG B 75 6.103 -6.617 10.881 1.00 0.00 H new ATOM 0 HH11 ARG B 75 9.455 -6.282 11.948 1.00 0.00 H new ATOM 0 HH12 ARG B 75 9.484 -7.864 12.733 1.00 0.00 H new ATOM 0 HH21 ARG B 75 6.150 -8.646 11.896 1.00 0.00 H new ATOM 0 HH22 ARG B 75 7.622 -9.196 12.704 1.00 0.00 H new ATOM 1437 N PHE B 76 6.024 -4.461 5.212 1.00 0.00 N ATOM 1438 CA PHE B 76 5.870 -5.105 3.912 1.00 0.00 C ATOM 1439 C PHE B 76 7.223 -5.527 3.344 1.00 0.00 C ATOM 1440 O PHE B 76 8.273 -5.117 3.840 1.00 0.00 O ATOM 1441 CB PHE B 76 5.170 -4.163 2.930 1.00 0.00 C ATOM 1442 CG PHE B 76 3.848 -3.655 3.426 1.00 0.00 C ATOM 1443 CD1 PHE B 76 3.754 -2.422 4.051 1.00 0.00 C ATOM 1444 CD2 PHE B 76 2.697 -4.410 3.264 1.00 0.00 C ATOM 1445 CE1 PHE B 76 2.538 -1.952 4.507 1.00 0.00 C ATOM 1446 CE2 PHE B 76 1.478 -3.945 3.718 1.00 0.00 C ATOM 1447 CZ PHE B 76 1.398 -2.713 4.341 1.00 0.00 C ATOM 0 H PHE B 76 6.641 -3.649 5.211 1.00 0.00 H new ATOM 0 HA PHE B 76 5.259 -5.997 4.052 1.00 0.00 H new ATOM 0 HB2 PHE B 76 5.823 -3.314 2.725 1.00 0.00 H new ATOM 0 HB3 PHE B 76 5.018 -4.684 1.985 1.00 0.00 H new ATOM 0 HD1 PHE B 76 4.642 -1.821 4.183 1.00 0.00 H new ATOM 0 HD2 PHE B 76 2.754 -5.373 2.777 1.00 0.00 H new ATOM 0 HE1 PHE B 76 2.479 -0.989 4.993 1.00 0.00 H new ATOM 0 HE2 PHE B 76 0.588 -4.543 3.587 1.00 0.00 H new ATOM 0 HZ PHE B 76 0.446 -2.347 4.697 1.00 0.00 H new ATOM 1457 N ARG B 77 7.183 -6.348 2.300 1.00 0.00 N ATOM 1458 CA ARG B 77 8.398 -6.830 1.651 1.00 0.00 C ATOM 1459 C ARG B 77 8.143 -7.100 0.172 1.00 0.00 C ATOM 1460 O ARG B 77 7.263 -7.883 -0.183 1.00 0.00 O ATOM 1461 CB ARG B 77 8.899 -8.104 2.333 1.00 0.00 C ATOM 1462 CG ARG B 77 10.138 -8.694 1.685 1.00 0.00 C ATOM 1463 CD ARG B 77 11.371 -7.846 1.949 1.00 0.00 C ATOM 1464 NE ARG B 77 12.567 -8.414 1.332 1.00 0.00 N ATOM 1465 CZ ARG B 77 13.740 -8.518 1.949 1.00 0.00 C ATOM 1466 NH1 ARG B 77 13.874 -8.095 3.200 1.00 0.00 N ATOM 1467 NH2 ARG B 77 14.778 -9.047 1.318 1.00 0.00 N ATOM 0 H ARG B 77 6.319 -6.695 1.883 1.00 0.00 H new ATOM 0 HA ARG B 77 9.162 -6.058 1.741 1.00 0.00 H new ATOM 0 HB2 ARG B 77 9.115 -7.885 3.379 1.00 0.00 H new ATOM 0 HB3 ARG B 77 8.103 -8.849 2.321 1.00 0.00 H new ATOM 0 HG2 ARG B 77 10.302 -9.702 2.065 1.00 0.00 H new ATOM 0 HG3 ARG B 77 9.980 -8.781 0.610 1.00 0.00 H new ATOM 0 HD2 ARG B 77 11.208 -6.839 1.565 1.00 0.00 H new ATOM 0 HD3 ARG B 77 11.526 -7.756 3.024 1.00 0.00 H new ATOM 0 HE ARG B 77 12.498 -8.751 0.372 1.00 0.00 H new ATOM 0 HH11 ARG B 77 13.076 -7.689 3.689 1.00 0.00 H new ATOM 0 HH12 ARG B 77 14.775 -8.176 3.672 1.00 0.00 H new ATOM 0 HH21 ARG B 77 14.678 -9.375 0.357 1.00 0.00 H new ATOM 0 HH22 ARG B 77 15.677 -9.126 1.793 1.00 0.00 H new ATOM 1481 N VAL B 78 8.924 -6.454 -0.686 1.00 0.00 N ATOM 1482 CA VAL B 78 8.778 -6.622 -2.128 1.00 0.00 C ATOM 1483 C VAL B 78 9.126 -8.045 -2.546 1.00 0.00 C ATOM 1484 O VAL B 78 9.926 -8.713 -1.891 1.00 0.00 O ATOM 1485 CB VAL B 78 9.665 -5.627 -2.898 1.00 0.00 C ATOM 1486 CG1 VAL B 78 9.408 -5.719 -4.395 1.00 0.00 C ATOM 1487 CG2 VAL B 78 9.422 -4.212 -2.394 1.00 0.00 C ATOM 0 H VAL B 78 9.664 -5.809 -0.409 1.00 0.00 H new ATOM 0 HA VAL B 78 7.735 -6.423 -2.374 1.00 0.00 H new ATOM 0 HB VAL B 78 10.709 -5.885 -2.722 1.00 0.00 H new ATOM 0 HG11 VAL B 78 10.046 -5.007 -4.918 1.00 0.00 H new ATOM 0 HG12 VAL B 78 9.631 -6.728 -4.741 1.00 0.00 H new ATOM 0 HG13 VAL B 78 8.363 -5.488 -4.600 1.00 0.00 H new ATOM 0 HG21 VAL B 78 10.054 -3.516 -2.945 1.00 0.00 H new ATOM 0 HG22 VAL B 78 8.375 -3.947 -2.543 1.00 0.00 H new ATOM 0 HG23 VAL B 78 9.662 -4.158 -1.332 1.00 0.00 H new ATOM 1497 N ALA B 79 8.524 -8.509 -3.639 1.00 0.00 N ATOM 1498 CA ALA B 79 8.776 -9.864 -4.119 1.00 0.00 C ATOM 1499 C ALA B 79 8.756 -9.949 -5.643 1.00 0.00 C ATOM 1500 O ALA B 79 9.020 -11.010 -6.212 1.00 0.00 O ATOM 1501 CB ALA B 79 7.758 -10.826 -3.525 1.00 0.00 C ATOM 0 H ALA B 79 7.865 -7.973 -4.203 1.00 0.00 H new ATOM 0 HA ALA B 79 9.777 -10.146 -3.792 1.00 0.00 H new ATOM 0 HB1 ALA B 79 7.955 -11.834 -3.889 1.00 0.00 H new ATOM 0 HB2 ALA B 79 7.835 -10.812 -2.438 1.00 0.00 H new ATOM 0 HB3 ALA B 79 6.754 -10.522 -3.822 1.00 0.00 H new ATOM 1507 N ALA B 80 8.444 -8.840 -6.305 1.00 0.00 N ATOM 1508 CA ALA B 80 8.396 -8.819 -7.763 1.00 0.00 C ATOM 1509 C ALA B 80 8.483 -7.398 -8.307 1.00 0.00 C ATOM 1510 O ALA B 80 8.154 -6.436 -7.614 1.00 0.00 O ATOM 1511 CB ALA B 80 7.128 -9.495 -8.260 1.00 0.00 C ATOM 0 H ALA B 80 8.222 -7.950 -5.859 1.00 0.00 H new ATOM 0 HA ALA B 80 9.262 -9.370 -8.130 1.00 0.00 H new ATOM 0 HB1 ALA B 80 7.106 -9.472 -9.350 1.00 0.00 H new ATOM 0 HB2 ALA B 80 7.110 -10.530 -7.919 1.00 0.00 H new ATOM 0 HB3 ALA B 80 6.258 -8.969 -7.868 1.00 0.00 H new ATOM 1517 N SER B 81 8.931 -7.277 -9.554 1.00 0.00 N ATOM 1518 CA SER B 81 9.062 -5.987 -10.202 1.00 0.00 C ATOM 1519 C SER B 81 7.728 -5.533 -10.773 1.00 0.00 C ATOM 1520 O SER B 81 6.779 -6.312 -10.866 1.00 0.00 O ATOM 1521 CB SER B 81 10.103 -6.072 -11.317 1.00 0.00 C ATOM 1522 OG SER B 81 9.549 -6.644 -12.488 1.00 0.00 O ATOM 0 H SER B 81 9.210 -8.068 -10.135 1.00 0.00 H new ATOM 0 HA SER B 81 9.385 -5.257 -9.459 1.00 0.00 H new ATOM 0 HB2 SER B 81 10.484 -5.075 -11.540 1.00 0.00 H new ATOM 0 HB3 SER B 81 10.951 -6.670 -10.983 1.00 0.00 H new ATOM 0 HG SER B 81 10.234 -6.686 -13.187 1.00 0.00 H new ATOM 1528 N GLY B 82 7.671 -4.271 -11.164 1.00 0.00 N ATOM 1529 CA GLY B 82 6.452 -3.713 -11.719 1.00 0.00 C ATOM 1530 C GLY B 82 6.031 -2.434 -11.020 1.00 0.00 C ATOM 1531 O GLY B 82 6.662 -2.012 -10.050 1.00 0.00 O ATOM 0 H GLY B 82 8.452 -3.617 -11.107 1.00 0.00 H new ATOM 0 HA2 GLY B 82 6.598 -3.513 -12.780 1.00 0.00 H new ATOM 0 HA3 GLY B 82 5.651 -4.448 -11.640 1.00 0.00 H new ATOM 1535 N ASP B 83 4.964 -1.816 -11.518 1.00 0.00 N ATOM 1536 CA ASP B 83 4.458 -0.580 -10.942 1.00 0.00 C ATOM 1537 C ASP B 83 3.358 -0.861 -9.921 1.00 0.00 C ATOM 1538 O ASP B 83 2.356 -1.507 -10.235 1.00 0.00 O ATOM 1539 CB ASP B 83 3.926 0.326 -12.048 1.00 0.00 C ATOM 1540 CG ASP B 83 2.934 -0.380 -12.950 1.00 0.00 C ATOM 1541 OD1 ASP B 83 3.372 -1.009 -13.937 1.00 0.00 O ATOM 1542 OD2 ASP B 83 1.719 -0.306 -12.670 1.00 0.00 O ATOM 0 H ASP B 83 4.434 -2.154 -12.321 1.00 0.00 H new ATOM 0 HA ASP B 83 5.278 -0.080 -10.427 1.00 0.00 H new ATOM 0 HB2 ASP B 83 3.449 1.198 -11.601 1.00 0.00 H new ATOM 0 HB3 ASP B 83 4.760 0.691 -12.647 1.00 0.00 H new ATOM 1547 N ASP B 84 3.551 -0.371 -8.702 1.00 0.00 N ATOM 1548 CA ASP B 84 2.577 -0.560 -7.634 1.00 0.00 C ATOM 1549 C ASP B 84 2.432 0.717 -6.812 1.00 0.00 C ATOM 1550 O ASP B 84 3.073 1.726 -7.101 1.00 0.00 O ATOM 1551 CB ASP B 84 2.994 -1.722 -6.729 1.00 0.00 C ATOM 1552 CG ASP B 84 4.334 -1.483 -6.063 1.00 0.00 C ATOM 1553 OD1 ASP B 84 5.372 -1.774 -6.694 1.00 0.00 O ATOM 1554 OD2 ASP B 84 4.346 -1.004 -4.908 1.00 0.00 O ATOM 0 H ASP B 84 4.376 0.162 -8.428 1.00 0.00 H new ATOM 0 HA ASP B 84 1.614 -0.796 -8.087 1.00 0.00 H new ATOM 0 HB2 ASP B 84 2.233 -1.874 -5.964 1.00 0.00 H new ATOM 0 HB3 ASP B 84 3.042 -2.638 -7.317 1.00 0.00 H new ATOM 1559 N ARG B 85 1.584 0.670 -5.788 1.00 0.00 N ATOM 1560 CA ARG B 85 1.361 1.830 -4.934 1.00 0.00 C ATOM 1561 C ARG B 85 0.640 1.439 -3.649 1.00 0.00 C ATOM 1562 O ARG B 85 -0.419 0.811 -3.684 1.00 0.00 O ATOM 1563 CB ARG B 85 0.551 2.882 -5.690 1.00 0.00 C ATOM 1564 CG ARG B 85 0.364 4.174 -4.917 1.00 0.00 C ATOM 1565 CD ARG B 85 -0.460 5.179 -5.706 1.00 0.00 C ATOM 1566 NE ARG B 85 0.170 5.526 -6.977 1.00 0.00 N ATOM 1567 CZ ARG B 85 -0.393 6.313 -7.890 1.00 0.00 C ATOM 1568 NH1 ARG B 85 -1.595 6.828 -7.674 1.00 0.00 N ATOM 1569 NH2 ARG B 85 0.245 6.583 -9.020 1.00 0.00 N ATOM 0 H ARG B 85 1.043 -0.156 -5.531 1.00 0.00 H new ATOM 0 HA ARG B 85 2.332 2.245 -4.663 1.00 0.00 H new ATOM 0 HB2 ARG B 85 1.048 3.102 -6.635 1.00 0.00 H new ATOM 0 HB3 ARG B 85 -0.428 2.469 -5.934 1.00 0.00 H new ATOM 0 HG2 ARG B 85 -0.128 3.964 -3.967 1.00 0.00 H new ATOM 0 HG3 ARG B 85 1.338 4.604 -4.683 1.00 0.00 H new ATOM 0 HD2 ARG B 85 -1.452 4.767 -5.894 1.00 0.00 H new ATOM 0 HD3 ARG B 85 -0.597 6.082 -5.111 1.00 0.00 H new ATOM 0 HE ARG B 85 1.094 5.143 -7.176 1.00 0.00 H new ATOM 0 HH11 ARG B 85 -2.090 6.621 -6.807 1.00 0.00 H new ATOM 0 HH12 ARG B 85 -2.025 7.431 -8.375 1.00 0.00 H new ATOM 0 HH21 ARG B 85 1.169 6.187 -9.191 1.00 0.00 H new ATOM 0 HH22 ARG B 85 -0.188 7.187 -9.719 1.00 0.00 H new ATOM 1583 N LEU B 86 1.221 1.814 -2.513 1.00 0.00 N ATOM 1584 CA LEU B 86 0.632 1.509 -1.214 1.00 0.00 C ATOM 1585 C LEU B 86 -0.552 2.426 -0.929 1.00 0.00 C ATOM 1586 O LEU B 86 -0.388 3.634 -0.754 1.00 0.00 O ATOM 1587 CB LEU B 86 1.681 1.651 -0.109 1.00 0.00 C ATOM 1588 CG LEU B 86 2.248 0.333 0.434 1.00 0.00 C ATOM 1589 CD1 LEU B 86 1.200 -0.402 1.254 1.00 0.00 C ATOM 1590 CD2 LEU B 86 2.749 -0.547 -0.700 1.00 0.00 C ATOM 0 H LEU B 86 2.100 2.330 -2.466 1.00 0.00 H new ATOM 0 HA LEU B 86 0.276 0.479 -1.235 1.00 0.00 H new ATOM 0 HB2 LEU B 86 2.506 2.252 -0.490 1.00 0.00 H new ATOM 0 HB3 LEU B 86 1.239 2.205 0.719 1.00 0.00 H new ATOM 0 HG LEU B 86 3.092 0.568 1.082 1.00 0.00 H new ATOM 0 HD11 LEU B 86 1.621 -1.334 1.631 1.00 0.00 H new ATOM 0 HD12 LEU B 86 0.891 0.222 2.093 1.00 0.00 H new ATOM 0 HD13 LEU B 86 0.336 -0.621 0.627 1.00 0.00 H new ATOM 0 HD21 LEU B 86 3.147 -1.476 -0.291 1.00 0.00 H new ATOM 0 HD22 LEU B 86 1.925 -0.772 -1.377 1.00 0.00 H new ATOM 0 HD23 LEU B 86 3.535 -0.025 -1.246 1.00 0.00 H new ATOM 1602 N GLU B 87 -1.746 1.843 -0.884 1.00 0.00 N ATOM 1603 CA GLU B 87 -2.961 2.610 -0.627 1.00 0.00 C ATOM 1604 C GLU B 87 -3.547 2.265 0.739 1.00 0.00 C ATOM 1605 O GLU B 87 -4.005 1.145 0.964 1.00 0.00 O ATOM 1606 CB GLU B 87 -3.998 2.346 -1.721 1.00 0.00 C ATOM 1607 CG GLU B 87 -3.484 2.614 -3.126 1.00 0.00 C ATOM 1608 CD GLU B 87 -4.598 2.686 -4.153 1.00 0.00 C ATOM 1609 OE1 GLU B 87 -5.152 3.788 -4.353 1.00 0.00 O ATOM 1610 OE2 GLU B 87 -4.918 1.640 -4.758 1.00 0.00 O ATOM 0 H GLU B 87 -1.898 0.844 -1.022 1.00 0.00 H new ATOM 0 HA GLU B 87 -2.699 3.668 -0.632 1.00 0.00 H new ATOM 0 HB2 GLU B 87 -4.327 1.309 -1.655 1.00 0.00 H new ATOM 0 HB3 GLU B 87 -4.873 2.970 -1.538 1.00 0.00 H new ATOM 0 HG2 GLU B 87 -2.928 3.552 -3.132 1.00 0.00 H new ATOM 0 HG3 GLU B 87 -2.785 1.827 -3.409 1.00 0.00 H new ATOM 1617 N LEU B 88 -3.524 3.235 1.648 1.00 0.00 N ATOM 1618 CA LEU B 88 -4.059 3.040 2.992 1.00 0.00 C ATOM 1619 C LEU B 88 -5.100 4.105 3.317 1.00 0.00 C ATOM 1620 O LEU B 88 -5.001 5.242 2.851 1.00 0.00 O ATOM 1621 CB LEU B 88 -2.936 3.080 4.033 1.00 0.00 C ATOM 1622 CG LEU B 88 -1.928 1.931 3.955 1.00 0.00 C ATOM 1623 CD1 LEU B 88 -0.918 2.179 2.843 1.00 0.00 C ATOM 1624 CD2 LEU B 88 -1.221 1.750 5.289 1.00 0.00 C ATOM 0 H LEU B 88 -3.140 4.165 1.478 1.00 0.00 H new ATOM 0 HA LEU B 88 -4.535 2.060 3.024 1.00 0.00 H new ATOM 0 HB2 LEU B 88 -2.397 4.021 3.926 1.00 0.00 H new ATOM 0 HB3 LEU B 88 -3.384 3.081 5.027 1.00 0.00 H new ATOM 0 HG LEU B 88 -2.470 1.014 3.726 1.00 0.00 H new ATOM 0 HD11 LEU B 88 -0.210 1.351 2.803 1.00 0.00 H new ATOM 0 HD12 LEU B 88 -1.439 2.257 1.889 1.00 0.00 H new ATOM 0 HD13 LEU B 88 -0.381 3.107 3.040 1.00 0.00 H new ATOM 0 HD21 LEU B 88 -0.508 0.929 5.215 1.00 0.00 H new ATOM 0 HD22 LEU B 88 -0.692 2.667 5.548 1.00 0.00 H new ATOM 0 HD23 LEU B 88 -1.955 1.524 6.062 1.00 0.00 H new ATOM 1636 N VAL B 89 -6.097 3.735 4.113 1.00 0.00 N ATOM 1637 CA VAL B 89 -7.150 4.667 4.498 1.00 0.00 C ATOM 1638 C VAL B 89 -7.455 4.564 5.991 1.00 0.00 C ATOM 1639 O VAL B 89 -7.116 3.570 6.634 1.00 0.00 O ATOM 1640 CB VAL B 89 -8.443 4.420 3.699 1.00 0.00 C ATOM 1641 CG1 VAL B 89 -8.188 4.568 2.207 1.00 0.00 C ATOM 1642 CG2 VAL B 89 -9.017 3.045 4.014 1.00 0.00 C ATOM 0 H VAL B 89 -6.198 2.798 4.504 1.00 0.00 H new ATOM 0 HA VAL B 89 -6.784 5.669 4.273 1.00 0.00 H new ATOM 0 HB VAL B 89 -9.176 5.170 3.996 1.00 0.00 H new ATOM 0 HG11 VAL B 89 -9.114 4.390 1.660 1.00 0.00 H new ATOM 0 HG12 VAL B 89 -7.831 5.576 1.997 1.00 0.00 H new ATOM 0 HG13 VAL B 89 -7.436 3.844 1.893 1.00 0.00 H new ATOM 0 HG21 VAL B 89 -9.930 2.891 3.439 1.00 0.00 H new ATOM 0 HG22 VAL B 89 -8.289 2.278 3.751 1.00 0.00 H new ATOM 0 HG23 VAL B 89 -9.243 2.980 5.078 1.00 0.00 H new ATOM 1652 N TYR B 90 -8.097 5.594 6.533 1.00 0.00 N ATOM 1653 CA TYR B 90 -8.441 5.620 7.950 1.00 0.00 C ATOM 1654 C TYR B 90 -9.918 5.306 8.165 1.00 0.00 C ATOM 1655 O TYR B 90 -10.780 6.163 7.968 1.00 0.00 O ATOM 1656 CB TYR B 90 -8.106 6.987 8.550 1.00 0.00 C ATOM 1657 CG TYR B 90 -8.287 7.065 10.052 1.00 0.00 C ATOM 1658 CD1 TYR B 90 -8.965 8.129 10.632 1.00 0.00 C ATOM 1659 CD2 TYR B 90 -7.776 6.080 10.888 1.00 0.00 C ATOM 1660 CE1 TYR B 90 -9.130 8.211 12.002 1.00 0.00 C ATOM 1661 CE2 TYR B 90 -7.937 6.151 12.259 1.00 0.00 C ATOM 1662 CZ TYR B 90 -8.614 7.218 12.810 1.00 0.00 C ATOM 1663 OH TYR B 90 -8.777 7.295 14.175 1.00 0.00 O ATOM 0 H TYR B 90 -8.389 6.421 6.013 1.00 0.00 H new ATOM 0 HA TYR B 90 -7.852 4.852 8.453 1.00 0.00 H new ATOM 0 HB2 TYR B 90 -7.073 7.236 8.306 1.00 0.00 H new ATOM 0 HB3 TYR B 90 -8.735 7.742 8.079 1.00 0.00 H new ATOM 0 HD1 TYR B 90 -9.371 8.906 10.001 1.00 0.00 H new ATOM 0 HD2 TYR B 90 -7.244 5.244 10.459 1.00 0.00 H new ATOM 0 HE1 TYR B 90 -9.659 9.046 12.437 1.00 0.00 H new ATOM 0 HE2 TYR B 90 -7.535 5.376 12.894 1.00 0.00 H new ATOM 0 HH TYR B 90 -8.357 6.518 14.599 1.00 0.00 H new ATOM 1673 N ARG B 91 -10.199 4.072 8.569 1.00 0.00 N ATOM 1674 CA ARG B 91 -11.569 3.638 8.814 1.00 0.00 C ATOM 1675 C ARG B 91 -11.588 2.391 9.689 1.00 0.00 C ATOM 1676 O ARG B 91 -10.556 1.753 9.895 1.00 0.00 O ATOM 1677 CB ARG B 91 -12.286 3.361 7.491 1.00 0.00 C ATOM 1678 CG ARG B 91 -11.641 2.258 6.667 1.00 0.00 C ATOM 1679 CD ARG B 91 -12.413 1.996 5.385 1.00 0.00 C ATOM 1680 NE ARG B 91 -11.820 0.919 4.599 1.00 0.00 N ATOM 1681 CZ ARG B 91 -12.358 0.436 3.483 1.00 0.00 C ATOM 1682 NH1 ARG B 91 -13.497 0.936 3.022 1.00 0.00 N ATOM 1683 NH2 ARG B 91 -11.756 -0.545 2.825 1.00 0.00 N ATOM 0 H ARG B 91 -9.494 3.353 8.734 1.00 0.00 H new ATOM 0 HA ARG B 91 -12.092 4.439 9.337 1.00 0.00 H new ATOM 0 HB2 ARG B 91 -13.321 3.090 7.699 1.00 0.00 H new ATOM 0 HB3 ARG B 91 -12.309 4.277 6.901 1.00 0.00 H new ATOM 0 HG2 ARG B 91 -10.615 2.536 6.425 1.00 0.00 H new ATOM 0 HG3 ARG B 91 -11.592 1.343 7.257 1.00 0.00 H new ATOM 0 HD2 ARG B 91 -13.444 1.741 5.629 1.00 0.00 H new ATOM 0 HD3 ARG B 91 -12.443 2.907 4.787 1.00 0.00 H new ATOM 0 HE ARG B 91 -10.942 0.513 4.924 1.00 0.00 H new ATOM 0 HH11 ARG B 91 -13.962 1.693 3.524 1.00 0.00 H new ATOM 0 HH12 ARG B 91 -13.908 0.564 2.166 1.00 0.00 H new ATOM 0 HH21 ARG B 91 -10.879 -0.930 3.175 1.00 0.00 H new ATOM 0 HH22 ARG B 91 -12.170 -0.914 1.969 1.00 0.00 H new ATOM 1697 N ARG B 92 -12.765 2.046 10.204 1.00 0.00 N ATOM 1698 CA ARG B 92 -12.908 0.872 11.056 1.00 0.00 C ATOM 1699 C ARG B 92 -12.434 -0.383 10.322 1.00 0.00 C ATOM 1700 O ARG B 92 -12.601 -0.498 9.108 1.00 0.00 O ATOM 1701 CB ARG B 92 -14.359 0.721 11.510 1.00 0.00 C ATOM 1702 CG ARG B 92 -14.930 1.994 12.115 1.00 0.00 C ATOM 1703 CD ARG B 92 -16.205 1.725 12.894 1.00 0.00 C ATOM 1704 NE ARG B 92 -16.885 2.960 13.276 1.00 0.00 N ATOM 1705 CZ ARG B 92 -18.041 2.993 13.931 1.00 0.00 C ATOM 1706 NH1 ARG B 92 -18.646 1.863 14.275 1.00 0.00 N ATOM 1707 NH2 ARG B 92 -18.595 4.157 14.243 1.00 0.00 N ATOM 0 H ARG B 92 -13.631 2.562 10.046 1.00 0.00 H new ATOM 0 HA ARG B 92 -12.284 1.003 11.940 1.00 0.00 H new ATOM 0 HB2 ARG B 92 -14.971 0.424 10.658 1.00 0.00 H new ATOM 0 HB3 ARG B 92 -14.422 -0.083 12.243 1.00 0.00 H new ATOM 0 HG2 ARG B 92 -14.190 2.447 12.775 1.00 0.00 H new ATOM 0 HG3 ARG B 92 -15.133 2.714 11.322 1.00 0.00 H new ATOM 0 HD2 ARG B 92 -16.876 1.114 12.291 1.00 0.00 H new ATOM 0 HD3 ARG B 92 -15.968 1.150 13.789 1.00 0.00 H new ATOM 0 HE ARG B 92 -16.448 3.847 13.026 1.00 0.00 H new ATOM 0 HH11 ARG B 92 -18.224 0.966 14.037 1.00 0.00 H new ATOM 0 HH12 ARG B 92 -19.533 1.892 14.778 1.00 0.00 H new ATOM 0 HH21 ARG B 92 -18.134 5.028 13.980 1.00 0.00 H new ATOM 0 HH22 ARG B 92 -19.482 4.181 14.746 1.00 0.00 H new ATOM 1721 N PRO B 93 -11.836 -1.342 11.053 1.00 0.00 N ATOM 1722 CA PRO B 93 -11.313 -2.578 10.462 1.00 0.00 C ATOM 1723 C PRO B 93 -12.390 -3.615 10.145 1.00 0.00 C ATOM 1724 O PRO B 93 -12.212 -4.439 9.247 1.00 0.00 O ATOM 1725 CB PRO B 93 -10.375 -3.096 11.550 1.00 0.00 C ATOM 1726 CG PRO B 93 -11.000 -2.638 12.820 1.00 0.00 C ATOM 1727 CD PRO B 93 -11.616 -1.300 12.514 1.00 0.00 C ATOM 0 HA PRO B 93 -10.839 -2.392 9.498 1.00 0.00 H new ATOM 0 HB2 PRO B 93 -10.289 -4.182 11.518 1.00 0.00 H new ATOM 0 HB3 PRO B 93 -9.369 -2.693 11.433 1.00 0.00 H new ATOM 0 HG2 PRO B 93 -11.754 -3.347 13.163 1.00 0.00 H new ATOM 0 HG3 PRO B 93 -10.257 -2.554 13.613 1.00 0.00 H new ATOM 0 HD2 PRO B 93 -12.551 -1.156 13.056 1.00 0.00 H new ATOM 0 HD3 PRO B 93 -10.955 -0.481 12.796 1.00 0.00 H new ATOM 1735 N TRP B 94 -13.502 -3.582 10.873 1.00 0.00 N ATOM 1736 CA TRP B 94 -14.574 -4.544 10.649 1.00 0.00 C ATOM 1737 C TRP B 94 -15.582 -4.033 9.620 1.00 0.00 C ATOM 1738 O TRP B 94 -16.628 -4.647 9.407 1.00 0.00 O ATOM 1739 CB TRP B 94 -15.280 -4.883 11.966 1.00 0.00 C ATOM 1740 CG TRP B 94 -16.083 -3.757 12.540 1.00 0.00 C ATOM 1741 CD1 TRP B 94 -17.336 -3.367 12.163 1.00 0.00 C ATOM 1742 CD2 TRP B 94 -15.695 -2.885 13.607 1.00 0.00 C ATOM 1743 NE1 TRP B 94 -17.747 -2.301 12.926 1.00 0.00 N ATOM 1744 CE2 TRP B 94 -16.757 -1.987 13.820 1.00 0.00 C ATOM 1745 CE3 TRP B 94 -14.550 -2.777 14.403 1.00 0.00 C ATOM 1746 CZ2 TRP B 94 -16.710 -0.996 14.795 1.00 0.00 C ATOM 1747 CZ3 TRP B 94 -14.504 -1.789 15.369 1.00 0.00 C ATOM 1748 CH2 TRP B 94 -15.579 -0.911 15.559 1.00 0.00 C ATOM 0 H TRP B 94 -13.683 -2.907 11.616 1.00 0.00 H new ATOM 0 HA TRP B 94 -14.122 -5.452 10.250 1.00 0.00 H new ATOM 0 HB2 TRP B 94 -15.937 -5.737 11.803 1.00 0.00 H new ATOM 0 HB3 TRP B 94 -14.532 -5.191 12.697 1.00 0.00 H new ATOM 0 HD1 TRP B 94 -17.919 -3.829 11.380 1.00 0.00 H new ATOM 0 HE1 TRP B 94 -18.643 -1.821 12.841 1.00 0.00 H new ATOM 0 HE3 TRP B 94 -13.718 -3.452 14.266 1.00 0.00 H new ATOM 0 HZ2 TRP B 94 -17.537 -0.318 14.943 1.00 0.00 H new ATOM 0 HZ3 TRP B 94 -13.624 -1.692 15.988 1.00 0.00 H new ATOM 0 HH2 TRP B 94 -15.513 -0.152 16.324 1.00 0.00 H new ATOM 1759 N GLU B 95 -15.262 -2.909 8.984 1.00 0.00 N ATOM 1760 CA GLU B 95 -16.143 -2.331 7.974 1.00 0.00 C ATOM 1761 C GLU B 95 -15.544 -2.484 6.581 1.00 0.00 C ATOM 1762 O GLU B 95 -14.507 -1.898 6.270 1.00 0.00 O ATOM 1763 CB GLU B 95 -16.406 -0.852 8.267 1.00 0.00 C ATOM 1764 CG GLU B 95 -17.128 -0.609 9.577 1.00 0.00 C ATOM 1765 CD GLU B 95 -17.680 0.801 9.684 1.00 0.00 C ATOM 1766 OE1 GLU B 95 -16.874 1.746 9.810 1.00 0.00 O ATOM 1767 OE2 GLU B 95 -18.919 0.958 9.643 1.00 0.00 O ATOM 0 H GLU B 95 -14.404 -2.383 9.149 1.00 0.00 H new ATOM 0 HA GLU B 95 -17.090 -2.870 8.009 1.00 0.00 H new ATOM 0 HB2 GLU B 95 -15.455 -0.319 8.282 1.00 0.00 H new ATOM 0 HB3 GLU B 95 -16.996 -0.429 7.454 1.00 0.00 H new ATOM 0 HG2 GLU B 95 -17.945 -1.324 9.676 1.00 0.00 H new ATOM 0 HG3 GLU B 95 -16.443 -0.791 10.405 1.00 0.00 H new ATOM 1774 N LYS B 96 -16.207 -3.276 5.742 1.00 0.00 N ATOM 1775 CA LYS B 96 -15.741 -3.509 4.380 1.00 0.00 C ATOM 1776 C LYS B 96 -16.131 -2.349 3.467 1.00 0.00 C ATOM 1777 O LYS B 96 -15.589 -2.199 2.373 1.00 0.00 O ATOM 1778 CB LYS B 96 -16.319 -4.818 3.837 1.00 0.00 C ATOM 1779 CG LYS B 96 -15.948 -6.040 4.663 1.00 0.00 C ATOM 1780 CD LYS B 96 -14.448 -6.302 4.655 1.00 0.00 C ATOM 1781 CE LYS B 96 -14.001 -6.998 3.378 1.00 0.00 C ATOM 1782 NZ LYS B 96 -14.148 -6.125 2.180 1.00 0.00 N ATOM 0 H LYS B 96 -17.068 -3.767 5.982 1.00 0.00 H new ATOM 0 HA LYS B 96 -14.654 -3.582 4.401 1.00 0.00 H new ATOM 0 HB2 LYS B 96 -17.405 -4.735 3.795 1.00 0.00 H new ATOM 0 HB3 LYS B 96 -15.970 -4.962 2.814 1.00 0.00 H new ATOM 0 HG2 LYS B 96 -16.286 -5.899 5.690 1.00 0.00 H new ATOM 0 HG3 LYS B 96 -16.470 -6.913 4.273 1.00 0.00 H new ATOM 0 HD2 LYS B 96 -13.914 -5.358 4.760 1.00 0.00 H new ATOM 0 HD3 LYS B 96 -14.182 -6.916 5.515 1.00 0.00 H new ATOM 0 HE2 LYS B 96 -12.959 -7.302 3.478 1.00 0.00 H new ATOM 0 HE3 LYS B 96 -14.587 -7.907 3.237 1.00 0.00 H new ATOM 0 HZ1 LYS B 96 -13.354 -6.292 1.529 1.00 0.00 H new ATOM 0 HZ2 LYS B 96 -15.043 -6.344 1.698 1.00 0.00 H new ATOM 0 HZ3 LYS B 96 -14.149 -5.128 2.475 1.00 0.00 H new ATOM 1796 N ASP B 97 -17.074 -1.531 3.927 1.00 0.00 N ATOM 1797 CA ASP B 97 -17.535 -0.385 3.152 1.00 0.00 C ATOM 1798 C ASP B 97 -17.964 0.757 4.068 1.00 0.00 C ATOM 1799 O ASP B 97 -19.101 0.797 4.537 1.00 0.00 O ATOM 1800 CB ASP B 97 -18.697 -0.790 2.242 1.00 0.00 C ATOM 1801 CG ASP B 97 -19.208 0.368 1.406 1.00 0.00 C ATOM 1802 OD1 ASP B 97 -18.689 0.566 0.287 1.00 0.00 O ATOM 1803 OD2 ASP B 97 -20.125 1.076 1.870 1.00 0.00 O ATOM 0 H ASP B 97 -17.533 -1.641 4.831 1.00 0.00 H new ATOM 0 HA ASP B 97 -16.705 -0.039 2.536 1.00 0.00 H new ATOM 0 HB2 ASP B 97 -18.375 -1.596 1.583 1.00 0.00 H new ATOM 0 HB3 ASP B 97 -19.512 -1.182 2.851 1.00 0.00 H new ATOM 1808 N ALA B 98 -17.041 1.681 4.321 1.00 0.00 N ATOM 1809 CA ALA B 98 -17.321 2.828 5.178 1.00 0.00 C ATOM 1810 C ALA B 98 -16.455 4.022 4.789 1.00 0.00 C ATOM 1811 O ALA B 98 -15.255 3.880 4.557 1.00 0.00 O ATOM 1812 CB ALA B 98 -17.096 2.463 6.637 1.00 0.00 C ATOM 0 H ALA B 98 -16.093 1.657 3.945 1.00 0.00 H new ATOM 0 HA ALA B 98 -18.366 3.108 5.043 1.00 0.00 H new ATOM 0 HB1 ALA B 98 -17.309 3.328 7.265 1.00 0.00 H new ATOM 0 HB2 ALA B 98 -17.758 1.642 6.913 1.00 0.00 H new ATOM 0 HB3 ALA B 98 -16.060 2.157 6.780 1.00 0.00 H new ATOM 1818 N GLU B 99 -17.072 5.198 4.718 1.00 0.00 N ATOM 1819 CA GLU B 99 -16.356 6.418 4.355 1.00 0.00 C ATOM 1820 C GLU B 99 -15.239 6.717 5.353 1.00 0.00 C ATOM 1821 O GLU B 99 -15.503 7.026 6.516 1.00 0.00 O ATOM 1822 CB GLU B 99 -17.319 7.601 4.278 1.00 0.00 C ATOM 1823 CG GLU B 99 -18.149 7.624 3.007 1.00 0.00 C ATOM 1824 CD GLU B 99 -19.001 8.872 2.887 1.00 0.00 C ATOM 1825 OE1 GLU B 99 -18.514 9.870 2.313 1.00 0.00 O ATOM 1826 OE2 GLU B 99 -20.153 8.851 3.366 1.00 0.00 O ATOM 0 H GLU B 99 -18.065 5.332 4.907 1.00 0.00 H new ATOM 0 HA GLU B 99 -15.907 6.263 3.374 1.00 0.00 H new ATOM 0 HB2 GLU B 99 -17.987 7.572 5.139 1.00 0.00 H new ATOM 0 HB3 GLU B 99 -16.750 8.528 4.348 1.00 0.00 H new ATOM 0 HG2 GLU B 99 -17.486 7.557 2.144 1.00 0.00 H new ATOM 0 HG3 GLU B 99 -18.794 6.745 2.983 1.00 0.00 H new ATOM 1833 N PRO B 100 -13.969 6.629 4.911 1.00 0.00 N ATOM 1834 CA PRO B 100 -12.815 6.894 5.771 1.00 0.00 C ATOM 1835 C PRO B 100 -12.557 8.385 5.963 1.00 0.00 C ATOM 1836 O PRO B 100 -12.880 9.197 5.094 1.00 0.00 O ATOM 1837 CB PRO B 100 -11.663 6.252 5.000 1.00 0.00 C ATOM 1838 CG PRO B 100 -12.060 6.381 3.570 1.00 0.00 C ATOM 1839 CD PRO B 100 -13.561 6.263 3.539 1.00 0.00 C ATOM 0 HA PRO B 100 -12.955 6.502 6.778 1.00 0.00 H new ATOM 0 HB2 PRO B 100 -10.719 6.760 5.198 1.00 0.00 H new ATOM 0 HB3 PRO B 100 -11.528 5.208 5.283 1.00 0.00 H new ATOM 0 HG2 PRO B 100 -11.736 7.338 3.161 1.00 0.00 H new ATOM 0 HG3 PRO B 100 -11.596 5.602 2.965 1.00 0.00 H new ATOM 0 HD2 PRO B 100 -14.000 6.932 2.799 1.00 0.00 H new ATOM 0 HD3 PRO B 100 -13.878 5.252 3.283 1.00 0.00 H new ATOM 1847 N ALA B 101 -11.976 8.738 7.105 1.00 0.00 N ATOM 1848 CA ALA B 101 -11.670 10.132 7.406 1.00 0.00 C ATOM 1849 C ALA B 101 -10.391 10.570 6.700 1.00 0.00 C ATOM 1850 O ALA B 101 -10.422 11.428 5.815 1.00 0.00 O ATOM 1851 CB ALA B 101 -11.541 10.333 8.911 1.00 0.00 C ATOM 0 H ALA B 101 -11.708 8.079 7.836 1.00 0.00 H new ATOM 0 HA ALA B 101 -12.490 10.749 7.040 1.00 0.00 H new ATOM 0 HB1 ALA B 101 -11.313 11.378 9.120 1.00 0.00 H new ATOM 0 HB2 ALA B 101 -12.479 10.062 9.396 1.00 0.00 H new ATOM 0 HB3 ALA B 101 -10.739 9.702 9.295 1.00 0.00 H new ATOM 1857 N GLU B 102 -9.271 9.975 7.095 1.00 0.00 N ATOM 1858 CA GLU B 102 -7.982 10.295 6.494 1.00 0.00 C ATOM 1859 C GLU B 102 -7.749 9.462 5.240 1.00 0.00 C ATOM 1860 O GLU B 102 -8.641 8.750 4.781 1.00 0.00 O ATOM 1861 CB GLU B 102 -6.851 10.049 7.496 1.00 0.00 C ATOM 1862 CG GLU B 102 -6.535 11.251 8.369 1.00 0.00 C ATOM 1863 CD GLU B 102 -5.469 10.956 9.404 1.00 0.00 C ATOM 1864 OE1 GLU B 102 -5.829 10.541 10.526 1.00 0.00 O ATOM 1865 OE2 GLU B 102 -4.273 11.139 9.093 1.00 0.00 O ATOM 0 H GLU B 102 -9.230 9.268 7.829 1.00 0.00 H new ATOM 0 HA GLU B 102 -7.991 11.349 6.217 1.00 0.00 H new ATOM 0 HB2 GLU B 102 -7.120 9.208 8.135 1.00 0.00 H new ATOM 0 HB3 GLU B 102 -5.952 9.760 6.952 1.00 0.00 H new ATOM 0 HG2 GLU B 102 -6.205 12.077 7.738 1.00 0.00 H new ATOM 0 HG3 GLU B 102 -7.444 11.578 8.873 1.00 0.00 H new ATOM 1872 N SER B 103 -6.544 9.556 4.694 1.00 0.00 N ATOM 1873 CA SER B 103 -6.187 8.809 3.492 1.00 0.00 C ATOM 1874 C SER B 103 -4.677 8.783 3.298 1.00 0.00 C ATOM 1875 O SER B 103 -3.964 9.664 3.777 1.00 0.00 O ATOM 1876 CB SER B 103 -6.863 9.421 2.264 1.00 0.00 C ATOM 1877 OG SER B 103 -6.468 10.768 2.080 1.00 0.00 O ATOM 0 H SER B 103 -5.796 10.142 5.064 1.00 0.00 H new ATOM 0 HA SER B 103 -6.537 7.784 3.614 1.00 0.00 H new ATOM 0 HB2 SER B 103 -6.608 8.840 1.378 1.00 0.00 H new ATOM 0 HB3 SER B 103 -7.946 9.369 2.378 1.00 0.00 H new ATOM 0 HG SER B 103 -6.913 11.134 1.288 1.00 0.00 H new ATOM 1883 N PHE B 104 -4.197 7.767 2.590 1.00 0.00 N ATOM 1884 CA PHE B 104 -2.768 7.624 2.334 1.00 0.00 C ATOM 1885 C PHE B 104 -2.516 6.967 0.979 1.00 0.00 C ATOM 1886 O PHE B 104 -3.293 6.120 0.536 1.00 0.00 O ATOM 1887 CB PHE B 104 -2.112 6.802 3.445 1.00 0.00 C ATOM 1888 CG PHE B 104 -0.612 6.752 3.355 1.00 0.00 C ATOM 1889 CD1 PHE B 104 0.022 5.709 2.697 1.00 0.00 C ATOM 1890 CD2 PHE B 104 0.163 7.745 3.930 1.00 0.00 C ATOM 1891 CE1 PHE B 104 1.400 5.660 2.614 1.00 0.00 C ATOM 1892 CE2 PHE B 104 1.542 7.703 3.850 1.00 0.00 C ATOM 1893 CZ PHE B 104 2.161 6.659 3.191 1.00 0.00 C ATOM 0 H PHE B 104 -4.775 7.031 2.184 1.00 0.00 H new ATOM 0 HA PHE B 104 -2.326 8.620 2.318 1.00 0.00 H new ATOM 0 HB2 PHE B 104 -2.395 7.221 4.410 1.00 0.00 H new ATOM 0 HB3 PHE B 104 -2.503 5.785 3.412 1.00 0.00 H new ATOM 0 HD1 PHE B 104 -0.568 4.926 2.244 1.00 0.00 H new ATOM 0 HD2 PHE B 104 -0.316 8.563 4.448 1.00 0.00 H new ATOM 0 HE1 PHE B 104 1.882 4.842 2.099 1.00 0.00 H new ATOM 0 HE2 PHE B 104 2.134 8.485 4.302 1.00 0.00 H new ATOM 0 HZ PHE B 104 3.238 6.623 3.127 1.00 0.00 H new ATOM 1903 N SER B 105 -1.426 7.363 0.330 1.00 0.00 N ATOM 1904 CA SER B 105 -1.067 6.816 -0.974 1.00 0.00 C ATOM 1905 C SER B 105 0.392 7.122 -1.302 1.00 0.00 C ATOM 1906 O SER B 105 0.764 8.280 -1.496 1.00 0.00 O ATOM 1907 CB SER B 105 -1.979 7.388 -2.061 1.00 0.00 C ATOM 1908 OG SER B 105 -1.630 6.883 -3.338 1.00 0.00 O ATOM 0 H SER B 105 -0.775 8.062 0.686 1.00 0.00 H new ATOM 0 HA SER B 105 -1.196 5.734 -0.938 1.00 0.00 H new ATOM 0 HB2 SER B 105 -3.016 7.138 -1.839 1.00 0.00 H new ATOM 0 HB3 SER B 105 -1.907 8.476 -2.065 1.00 0.00 H new ATOM 0 HG SER B 105 -1.234 7.600 -3.876 1.00 0.00 H new ATOM 1914 N CYS B 106 1.215 6.080 -1.362 1.00 0.00 N ATOM 1915 CA CYS B 106 2.634 6.243 -1.661 1.00 0.00 C ATOM 1916 C CYS B 106 3.027 5.454 -2.906 1.00 0.00 C ATOM 1917 O CYS B 106 2.917 4.229 -2.937 1.00 0.00 O ATOM 1918 CB CYS B 106 3.476 5.790 -0.466 1.00 0.00 C ATOM 1919 SG CYS B 106 5.172 6.454 -0.450 1.00 0.00 S ATOM 0 H CYS B 106 0.924 5.114 -1.208 1.00 0.00 H new ATOM 0 HA CYS B 106 2.822 7.299 -1.855 1.00 0.00 H new ATOM 0 HB2 CYS B 106 2.972 6.090 0.453 1.00 0.00 H new ATOM 0 HB3 CYS B 106 3.525 4.701 -0.462 1.00 0.00 H new ATOM 1924 N ALA B 107 3.486 6.166 -3.933 1.00 0.00 N ATOM 1925 CA ALA B 107 3.898 5.532 -5.183 1.00 0.00 C ATOM 1926 C ALA B 107 5.140 4.674 -4.978 1.00 0.00 C ATOM 1927 O ALA B 107 6.094 5.094 -4.321 1.00 0.00 O ATOM 1928 CB ALA B 107 4.149 6.586 -6.250 1.00 0.00 C ATOM 0 H ALA B 107 3.582 7.181 -3.924 1.00 0.00 H new ATOM 0 HA ALA B 107 3.091 4.880 -5.517 1.00 0.00 H new ATOM 0 HB1 ALA B 107 4.455 6.100 -7.176 1.00 0.00 H new ATOM 0 HB2 ALA B 107 3.235 7.153 -6.423 1.00 0.00 H new ATOM 0 HB3 ALA B 107 4.937 7.261 -5.916 1.00 0.00 H new ATOM 1934 N ILE B 108 5.125 3.471 -5.544 1.00 0.00 N ATOM 1935 CA ILE B 108 6.251 2.551 -5.417 1.00 0.00 C ATOM 1936 C ILE B 108 6.457 1.739 -6.693 1.00 0.00 C ATOM 1937 O ILE B 108 5.608 0.931 -7.068 1.00 0.00 O ATOM 1938 CB ILE B 108 6.044 1.576 -4.239 1.00 0.00 C ATOM 1939 CG1 ILE B 108 6.054 2.334 -2.911 1.00 0.00 C ATOM 1940 CG2 ILE B 108 7.113 0.491 -4.246 1.00 0.00 C ATOM 1941 CD1 ILE B 108 5.514 1.527 -1.749 1.00 0.00 C ATOM 0 H ILE B 108 4.346 3.110 -6.095 1.00 0.00 H new ATOM 0 HA ILE B 108 7.134 3.163 -5.234 1.00 0.00 H new ATOM 0 HB ILE B 108 5.072 1.097 -4.355 1.00 0.00 H new ATOM 0 HG12 ILE B 108 7.075 2.642 -2.686 1.00 0.00 H new ATOM 0 HG13 ILE B 108 5.463 3.244 -3.017 1.00 0.00 H new ATOM 0 HG21 ILE B 108 6.950 -0.186 -3.408 1.00 0.00 H new ATOM 0 HG22 ILE B 108 7.058 -0.068 -5.180 1.00 0.00 H new ATOM 0 HG23 ILE B 108 8.098 0.950 -4.155 1.00 0.00 H new ATOM 0 HD11 ILE B 108 5.551 2.128 -0.840 1.00 0.00 H new ATOM 0 HD12 ILE B 108 4.482 1.241 -1.953 1.00 0.00 H new ATOM 0 HD13 ILE B 108 6.119 0.630 -1.616 1.00 0.00 H new ATOM 1953 N GLN B 109 7.587 1.961 -7.357 1.00 0.00 N ATOM 1954 CA GLN B 109 7.903 1.230 -8.582 1.00 0.00 C ATOM 1955 C GLN B 109 9.185 0.421 -8.408 1.00 0.00 C ATOM 1956 O GLN B 109 10.271 0.983 -8.274 1.00 0.00 O ATOM 1957 CB GLN B 109 8.044 2.191 -9.764 1.00 0.00 C ATOM 1958 CG GLN B 109 6.738 2.863 -10.159 1.00 0.00 C ATOM 1959 CD GLN B 109 6.873 3.727 -11.401 1.00 0.00 C ATOM 1960 OE1 GLN B 109 6.165 4.721 -11.560 1.00 0.00 O ATOM 1961 NE2 GLN B 109 7.785 3.349 -12.291 1.00 0.00 N ATOM 0 H GLN B 109 8.296 2.636 -7.071 1.00 0.00 H new ATOM 0 HA GLN B 109 7.082 0.544 -8.788 1.00 0.00 H new ATOM 0 HB2 GLN B 109 8.777 2.958 -9.513 1.00 0.00 H new ATOM 0 HB3 GLN B 109 8.436 1.644 -10.622 1.00 0.00 H new ATOM 0 HG2 GLN B 109 5.980 2.099 -10.334 1.00 0.00 H new ATOM 0 HG3 GLN B 109 6.386 3.478 -9.331 1.00 0.00 H new ATOM 0 HE21 GLN B 109 8.351 2.518 -12.120 1.00 0.00 H new ATOM 0 HE22 GLN B 109 7.919 3.890 -13.145 1.00 0.00 H new ATOM 1970 N VAL B 110 9.057 -0.904 -8.411 1.00 0.00 N ATOM 1971 CA VAL B 110 10.213 -1.778 -8.244 1.00 0.00 C ATOM 1972 C VAL B 110 11.172 -1.646 -9.427 1.00 0.00 C ATOM 1973 O VAL B 110 12.119 -0.861 -9.383 1.00 0.00 O ATOM 1974 CB VAL B 110 9.794 -3.254 -8.081 1.00 0.00 C ATOM 1975 CG1 VAL B 110 11.005 -4.125 -7.784 1.00 0.00 C ATOM 1976 CG2 VAL B 110 8.752 -3.393 -6.981 1.00 0.00 C ATOM 0 H VAL B 110 8.169 -1.393 -8.527 1.00 0.00 H new ATOM 0 HA VAL B 110 10.721 -1.462 -7.333 1.00 0.00 H new ATOM 0 HB VAL B 110 9.352 -3.592 -9.019 1.00 0.00 H new ATOM 0 HG11 VAL B 110 10.689 -5.162 -7.672 1.00 0.00 H new ATOM 0 HG12 VAL B 110 11.718 -4.049 -8.605 1.00 0.00 H new ATOM 0 HG13 VAL B 110 11.478 -3.789 -6.861 1.00 0.00 H new ATOM 0 HG21 VAL B 110 8.468 -4.440 -6.879 1.00 0.00 H new ATOM 0 HG22 VAL B 110 9.168 -3.037 -6.039 1.00 0.00 H new ATOM 0 HG23 VAL B 110 7.873 -2.801 -7.236 1.00 0.00 H new ATOM 1986 N ARG B 111 10.923 -2.416 -10.480 1.00 0.00 N ATOM 1987 CA ARG B 111 11.759 -2.382 -11.669 1.00 0.00 C ATOM 1988 C ARG B 111 10.904 -2.424 -12.933 1.00 0.00 C ATOM 1989 O ARG B 111 10.680 -1.348 -13.530 1.00 0.00 O ATOM 1990 CB ARG B 111 12.742 -3.553 -11.654 1.00 0.00 C ATOM 1991 CG ARG B 111 13.460 -3.759 -12.967 1.00 0.00 C ATOM 1992 CD ARG B 111 14.321 -2.564 -13.292 1.00 0.00 C ATOM 1993 NE ARG B 111 15.008 -2.704 -14.574 1.00 0.00 N ATOM 1994 CZ ARG B 111 15.849 -1.798 -15.064 1.00 0.00 C ATOM 1995 NH1 ARG B 111 16.103 -0.690 -14.383 1.00 0.00 N ATOM 1996 NH2 ARG B 111 16.433 -2.000 -16.238 1.00 0.00 N ATOM 1997 OXT ARG B 111 10.464 -3.528 -13.315 1.00 0.00 O ATOM 0 H ARG B 111 10.145 -3.073 -10.532 1.00 0.00 H new ATOM 0 HA ARG B 111 12.322 -1.448 -11.669 1.00 0.00 H new ATOM 0 HB2 ARG B 111 13.479 -3.387 -10.869 1.00 0.00 H new ATOM 0 HB3 ARG B 111 12.203 -4.465 -11.397 1.00 0.00 H new ATOM 0 HG2 ARG B 111 14.077 -4.656 -12.914 1.00 0.00 H new ATOM 0 HG3 ARG B 111 12.734 -3.919 -13.764 1.00 0.00 H new ATOM 0 HD2 ARG B 111 13.701 -1.668 -13.311 1.00 0.00 H new ATOM 0 HD3 ARG B 111 15.058 -2.425 -12.501 1.00 0.00 H new ATOM 0 HE ARG B 111 14.832 -3.545 -15.124 1.00 0.00 H new ATOM 0 HH11 ARG B 111 15.653 -0.531 -13.481 1.00 0.00 H new ATOM 0 HH12 ARG B 111 16.748 0.004 -14.760 1.00 0.00 H new ATOM 0 HH21 ARG B 111 16.237 -2.851 -16.765 1.00 0.00 H new ATOM 0 HH22 ARG B 111 17.078 -1.305 -16.613 1.00 0.00 H new TER 2011 ARG B 111