USER MOD reduce.3.24.130724 H: found=0, std=0, add=781, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 781 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 9 CYS SG : rot 127:sc= 0.73 USER MOD Set 1.2: A 12 CYS SG : rot -58:sc= -2.36 USER MOD Set 1.3: A 16 ASN : amide:sc= -11.7! C(o=-18!,f=-19!) USER MOD Set 1.4: A 23 CYS SG : rot -170:sc= -0.0485 USER MOD Set 1.5: A 26 CYS SG : rot -116:sc= -4.41! USER MOD Set 2.1: A 25 MET CE :methyl 160:sc= -4.08! (180deg=-4.64) USER MOD Set 2.2: B 149 GLN :FLIP amide:sc= -1.05 F(o=-6.8,f=-5.1) USER MOD Set 3.1: A 6 MET CE :methyl 167:sc= -1.84! (180deg=-2.51!) USER MOD Set 3.2: A 15 MET CE :methyl -151:sc= -13.5! (180deg=-16.9!) USER MOD Set 4.1: A 13 THR OG1 : rot -150:sc= -0.963 USER MOD Set 4.2: B 168 HIS : no HD1:sc= -0.835 X(o=-1.8,f=-2.2) USER MOD Set 5.1: A 10 GLN : amide:sc= -5.9! C(o=-13!,f=-20!) USER MOD Set 5.2: A 11 HIS :FLIP no HD1:sc= -7.12! C(o=-16!,f=-13!) USER MOD Single : A 17 GLN :FLIP amide:sc=-0.00523 F(o=-1.2,f=-0.0052) USER MOD Single : A 20 THR OG1 : rot 70:sc= -0.759 USER MOD Single : A 22 HIS : no HD1:sc= -3.68 K(o=-3.7,f=-6!) USER MOD Single : A 27 SER OG : rot -46:sc= 0.218 USER MOD Single : A 31 THR OG1 : rot -25:sc= 0.224 USER MOD Single : B 101 MET CE :methyl 178:sc= -0.584 (180deg=-0.594) USER MOD Single : B 102 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 107 THR OG1 : rot 44:sc= 0.161 USER MOD Single : B 109 THR OG1 : rot -18:sc= 0.0974 USER MOD Single : B 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 112 THR OG1 : rot 180:sc= 0 USER MOD Single : B 114 THR OG1 : rot 180:sc= 0 USER MOD Single : B 120 SER OG : rot 180:sc= 0 USER MOD Single : B 122 THR OG1 : rot -170:sc= -1.17 USER MOD Single : B 125 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 129 LYS NZ :NH3+ -154:sc= -1.16 (180deg=-2.41!) USER MOD Single : B 131 GLN : amide:sc= 0 K(o=0,f=-0.6) USER MOD Single : B 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 140 GLN : amide:sc= -7.61! C(o=-7.6!,f=-14!) USER MOD Single : B 141 GLN : amide:sc= -4.36 K(o=-4.4,f=-8.9!) USER MOD Single : B 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 155 THR OG1 : rot 180:sc= -1.01 USER MOD Single : B 157 SER OG : rot 180:sc= 0 USER MOD Single : B 159 TYR OH : rot 124:sc= 0.89 USER MOD Single : B 160 ASN : amide:sc= -0.632 K(o=-0.63,f=-1.2) USER MOD Single : B 162 GLN : amide:sc= -0.024 X(o=-0.024,f=0) USER MOD Single : B 163 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 165 SER OG : rot -157:sc= -0.705 USER MOD Single : B 166 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 56 N MET A 6 1.861 -15.120 10.183 1.00 0.00 N ATOM 57 CA MET A 6 1.250 -14.110 9.321 1.00 0.00 C ATOM 58 C MET A 6 0.935 -14.700 7.954 1.00 0.00 C ATOM 59 O MET A 6 1.333 -15.830 7.653 1.00 0.00 O ATOM 60 CB MET A 6 2.181 -12.910 9.138 1.00 0.00 C ATOM 61 CG MET A 6 3.015 -12.550 10.361 1.00 0.00 C ATOM 62 SD MET A 6 4.764 -12.320 9.968 1.00 0.00 S ATOM 63 CE MET A 6 4.671 -11.660 8.299 1.00 0.00 C ATOM 0 HA MET A 6 0.329 -13.779 9.802 1.00 0.00 H new ATOM 0 HB2 MET A 6 2.854 -13.115 8.305 1.00 0.00 H new ATOM 0 HB3 MET A 6 1.582 -12.044 8.858 1.00 0.00 H new ATOM 0 HG2 MET A 6 2.623 -11.636 10.807 1.00 0.00 H new ATOM 0 HG3 MET A 6 2.915 -13.337 11.109 1.00 0.00 H new ATOM 0 HE1 MET A 6 5.642 -11.256 8.013 1.00 0.00 H new ATOM 0 HE2 MET A 6 4.391 -12.455 7.608 1.00 0.00 H new ATOM 0 HE3 MET A 6 3.924 -10.867 8.262 1.00 0.00 H new ATOM 73 N TRP A 7 0.238 -13.940 7.117 1.00 0.00 N ATOM 74 CA TRP A 7 -0.094 -14.410 5.780 1.00 0.00 C ATOM 75 C TRP A 7 -0.184 -13.260 4.802 1.00 0.00 C ATOM 76 O TRP A 7 -0.966 -12.330 4.979 1.00 0.00 O ATOM 77 CB TRP A 7 -1.396 -15.210 5.762 1.00 0.00 C ATOM 78 CG TRP A 7 -2.600 -14.450 6.244 1.00 0.00 C ATOM 79 CD1 TRP A 7 -3.046 -14.340 7.533 1.00 0.00 C ATOM 80 CD2 TRP A 7 -3.523 -13.700 5.436 1.00 0.00 C ATOM 81 NE1 TRP A 7 -4.188 -13.570 7.569 1.00 0.00 N ATOM 82 CE2 TRP A 7 -4.492 -13.160 6.302 1.00 0.00 C ATOM 83 CE3 TRP A 7 -3.625 -13.420 4.067 1.00 0.00 C ATOM 84 CZ2 TRP A 7 -5.541 -12.360 5.854 1.00 0.00 C ATOM 85 CZ3 TRP A 7 -4.672 -12.630 3.620 1.00 0.00 C ATOM 86 CH2 TRP A 7 -5.617 -12.110 4.511 1.00 0.00 C ATOM 0 H TRP A 7 -0.105 -13.005 7.338 1.00 0.00 H new ATOM 0 HA TRP A 7 0.715 -15.073 5.472 1.00 0.00 H new ATOM 0 HB2 TRP A 7 -1.582 -15.554 4.745 1.00 0.00 H new ATOM 0 HB3 TRP A 7 -1.271 -16.098 6.381 1.00 0.00 H new ATOM 0 HD1 TRP A 7 -2.573 -14.790 8.394 1.00 0.00 H new ATOM 0 HE1 TRP A 7 -4.721 -13.342 8.408 1.00 0.00 H new ATOM 0 HE3 TRP A 7 -2.899 -13.814 3.371 1.00 0.00 H new ATOM 0 HZ2 TRP A 7 -6.267 -11.952 6.541 1.00 0.00 H new ATOM 0 HZ3 TRP A 7 -4.760 -12.412 2.566 1.00 0.00 H new ATOM 0 HH2 TRP A 7 -6.423 -11.499 4.131 1.00 0.00 H new ATOM 97 N ALA A 8 0.625 -13.340 3.765 1.00 0.00 N ATOM 98 CA ALA A 8 0.652 -12.320 2.727 1.00 0.00 C ATOM 99 C ALA A 8 -0.617 -12.390 1.885 1.00 0.00 C ATOM 100 O ALA A 8 -0.949 -13.440 1.332 1.00 0.00 O ATOM 101 CB ALA A 8 1.883 -12.490 1.849 1.00 0.00 C ATOM 0 H ALA A 8 1.280 -14.107 3.615 1.00 0.00 H new ATOM 0 HA ALA A 8 0.700 -11.340 3.202 1.00 0.00 H new ATOM 0 HB1 ALA A 8 1.889 -11.720 1.078 1.00 0.00 H new ATOM 0 HB2 ALA A 8 2.781 -12.399 2.460 1.00 0.00 H new ATOM 0 HB3 ALA A 8 1.862 -13.474 1.380 1.00 0.00 H new ATOM 107 N CYS A 9 -1.328 -11.270 1.796 1.00 0.00 N ATOM 108 CA CYS A 9 -2.565 -11.210 1.025 1.00 0.00 C ATOM 109 C CYS A 9 -2.377 -11.820 -0.360 1.00 0.00 C ATOM 110 O CYS A 9 -1.257 -11.900 -0.866 1.00 0.00 O ATOM 111 CB CYS A 9 -3.040 -9.769 0.881 1.00 0.00 C ATOM 112 SG CYS A 9 -4.833 -9.601 0.754 1.00 0.00 S ATOM 0 H CYS A 9 -1.069 -10.393 2.248 1.00 0.00 H new ATOM 0 HA CYS A 9 -3.317 -11.785 1.566 1.00 0.00 H new ATOM 0 HB2 CYS A 9 -2.691 -9.194 1.738 1.00 0.00 H new ATOM 0 HB3 CYS A 9 -2.580 -9.332 -0.005 1.00 0.00 H new ATOM 0 HG CYS A 9 -5.253 -8.746 1.639 1.00 0.00 H new ATOM 117 N GLN A 10 -3.475 -12.260 -0.968 1.00 0.00 N ATOM 118 CA GLN A 10 -3.423 -12.860 -2.294 1.00 0.00 C ATOM 119 C GLN A 10 -4.036 -11.940 -3.350 1.00 0.00 C ATOM 120 O GLN A 10 -4.329 -12.380 -4.464 1.00 0.00 O ATOM 121 CB GLN A 10 -4.153 -14.210 -2.290 1.00 0.00 C ATOM 122 CG GLN A 10 -5.621 -14.100 -1.913 1.00 0.00 C ATOM 123 CD GLN A 10 -5.849 -14.220 -0.419 1.00 0.00 C ATOM 124 OE1 GLN A 10 -5.602 -15.270 0.175 1.00 0.00 O ATOM 125 NE2 GLN A 10 -6.324 -13.140 0.197 1.00 0.00 N ATOM 0 H GLN A 10 -4.410 -12.212 -0.563 1.00 0.00 H new ATOM 0 HA GLN A 10 -2.375 -13.014 -2.550 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -4.072 -14.662 -3.279 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -3.655 -14.882 -1.591 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -6.011 -13.143 -2.261 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -6.184 -14.879 -2.427 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -6.514 -12.291 -0.336 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -6.498 -13.161 1.202 1.00 0.00 H new ATOM 134 N HIS A 11 -4.230 -10.670 -2.997 1.00 0.00 N ATOM 135 CA HIS A 11 -4.810 -9.710 -3.921 1.00 0.00 C ATOM 136 C HIS A 11 -4.048 -8.389 -3.886 1.00 0.00 C ATOM 137 O HIS A 11 -3.561 -7.914 -4.912 1.00 0.00 O ATOM 138 CB HIS A 11 -6.278 -9.465 -3.574 1.00 0.00 C ATOM 139 CG HIS A 11 -7.044 -10.710 -3.291 1.00 0.00 C ATOM 140 ND1 HIS A 11 -7.658 -11.120 -2.164 1.00 0.00 N flip ATOM 141 CD2 HIS A 11 -7.253 -11.700 -4.225 1.00 0.00 C flip ATOM 142 CE1 HIS A 11 -8.225 -12.340 -2.428 1.00 0.00 C flip ATOM 143 NE2 HIS A 11 -7.967 -12.670 -3.680 1.00 0.00 N flip ATOM 0 H HIS A 11 -3.994 -10.288 -2.081 1.00 0.00 H new ATOM 0 HA HIS A 11 -4.740 -10.125 -4.926 1.00 0.00 H new ATOM 0 HB2 HIS A 11 -6.332 -8.811 -2.704 1.00 0.00 H new ATOM 0 HB3 HIS A 11 -6.754 -8.937 -4.400 1.00 0.00 H new ATOM 0 HD2 HIS A 11 -6.891 -11.686 -5.242 1.00 0.00 H new ATOM 0 HE1 HIS A 11 -8.791 -12.934 -1.726 1.00 0.00 H new ATOM 0 HE2 HIS A 11 -8.267 -13.526 -4.147 1.00 0.00 H new ATOM 152 N CYS A 12 -3.949 -7.800 -2.699 1.00 0.00 N ATOM 153 CA CYS A 12 -3.248 -6.534 -2.529 1.00 0.00 C ATOM 154 C CYS A 12 -1.815 -6.760 -2.037 1.00 0.00 C ATOM 155 O CYS A 12 -1.025 -5.821 -1.939 1.00 0.00 O ATOM 156 CB CYS A 12 -4.030 -5.624 -1.572 1.00 0.00 C ATOM 157 SG CYS A 12 -3.806 -5.995 0.181 1.00 0.00 S ATOM 0 H CYS A 12 -4.346 -8.180 -1.840 1.00 0.00 H new ATOM 0 HA CYS A 12 -3.183 -6.039 -3.498 1.00 0.00 H new ATOM 0 HB2 CYS A 12 -3.732 -4.591 -1.751 1.00 0.00 H new ATOM 0 HB3 CYS A 12 -5.091 -5.696 -1.811 1.00 0.00 H new ATOM 0 HG CYS A 12 -4.152 -7.227 0.412 1.00 0.00 H new ATOM 162 N THR A 13 -1.488 -8.019 -1.748 1.00 0.00 N ATOM 163 CA THR A 13 -0.155 -8.394 -1.286 1.00 0.00 C ATOM 164 C THR A 13 0.151 -7.838 0.102 1.00 0.00 C ATOM 165 O THR A 13 1.315 -7.689 0.473 1.00 0.00 O ATOM 166 CB THR A 13 0.917 -7.928 -2.278 1.00 0.00 C ATOM 167 OG1 THR A 13 0.330 -7.470 -3.483 1.00 0.00 O ATOM 168 CG2 THR A 13 1.910 -9.012 -2.637 1.00 0.00 C ATOM 0 H THR A 13 -2.136 -8.802 -1.827 1.00 0.00 H new ATOM 0 HA THR A 13 -0.139 -9.482 -1.222 1.00 0.00 H new ATOM 0 HB THR A 13 1.446 -7.122 -1.768 1.00 0.00 H new ATOM 0 HG1 THR A 13 0.946 -7.629 -4.228 1.00 0.00 H new ATOM 0 HG21 THR A 13 2.641 -8.617 -3.342 1.00 0.00 H new ATOM 0 HG22 THR A 13 2.421 -9.350 -1.736 1.00 0.00 H new ATOM 0 HG23 THR A 13 1.384 -9.851 -3.092 1.00 0.00 H new ATOM 176 N PHE A 14 -0.889 -7.542 0.872 1.00 0.00 N ATOM 177 CA PHE A 14 -0.704 -7.016 2.218 1.00 0.00 C ATOM 178 C PHE A 14 -0.448 -8.143 3.209 1.00 0.00 C ATOM 179 O PHE A 14 -1.175 -9.134 3.244 1.00 0.00 O ATOM 180 CB PHE A 14 -1.929 -6.211 2.660 1.00 0.00 C ATOM 181 CG PHE A 14 -1.893 -5.810 4.108 1.00 0.00 C ATOM 182 CD1 PHE A 14 -1.010 -4.838 4.550 1.00 0.00 C ATOM 183 CD2 PHE A 14 -2.740 -6.409 5.027 1.00 0.00 C ATOM 184 CE1 PHE A 14 -0.973 -4.472 5.882 1.00 0.00 C ATOM 185 CE2 PHE A 14 -2.707 -6.046 6.360 1.00 0.00 C ATOM 186 CZ PHE A 14 -1.823 -5.076 6.787 1.00 0.00 C ATOM 0 H PHE A 14 -1.863 -7.656 0.590 1.00 0.00 H new ATOM 0 HA PHE A 14 0.164 -6.357 2.200 1.00 0.00 H new ATOM 0 HB2 PHE A 14 -2.006 -5.314 2.045 1.00 0.00 H new ATOM 0 HB3 PHE A 14 -2.827 -6.801 2.477 1.00 0.00 H new ATOM 0 HD1 PHE A 14 -0.344 -4.361 3.846 1.00 0.00 H new ATOM 0 HD2 PHE A 14 -3.434 -7.168 4.698 1.00 0.00 H new ATOM 0 HE1 PHE A 14 -0.280 -3.714 6.215 1.00 0.00 H new ATOM 0 HE2 PHE A 14 -3.372 -6.521 7.066 1.00 0.00 H new ATOM 0 HZ PHE A 14 -1.796 -4.790 7.828 1.00 0.00 H new ATOM 196 N MET A 15 0.579 -7.975 4.027 1.00 0.00 N ATOM 197 CA MET A 15 0.921 -8.956 5.027 1.00 0.00 C ATOM 198 C MET A 15 -0.038 -8.841 6.202 1.00 0.00 C ATOM 199 O MET A 15 0.037 -7.903 6.996 1.00 0.00 O ATOM 200 CB MET A 15 2.359 -8.735 5.474 1.00 0.00 C ATOM 201 CG MET A 15 3.372 -9.683 4.839 1.00 0.00 C ATOM 202 SD MET A 15 2.895 -11.420 4.912 1.00 0.00 S ATOM 203 CE MET A 15 1.858 -11.450 6.370 1.00 0.00 C ATOM 0 H MET A 15 1.191 -7.159 4.012 1.00 0.00 H new ATOM 0 HA MET A 15 0.835 -9.960 4.612 1.00 0.00 H new ATOM 0 HB2 MET A 15 2.645 -7.709 5.241 1.00 0.00 H new ATOM 0 HB3 MET A 15 2.410 -8.842 6.558 1.00 0.00 H new ATOM 0 HG2 MET A 15 3.516 -9.400 3.796 1.00 0.00 H new ATOM 0 HG3 MET A 15 4.333 -9.559 5.338 1.00 0.00 H new ATOM 0 HE1 MET A 15 1.911 -12.435 6.834 1.00 0.00 H new ATOM 0 HE2 MET A 15 2.203 -10.696 7.078 1.00 0.00 H new ATOM 0 HE3 MET A 15 0.827 -11.237 6.088 1.00 0.00 H new ATOM 213 N ASN A 16 -0.954 -9.788 6.280 1.00 0.00 N ATOM 214 CA ASN A 16 -1.965 -9.803 7.328 1.00 0.00 C ATOM 215 C ASN A 16 -1.468 -10.530 8.568 1.00 0.00 C ATOM 216 O ASN A 16 -0.363 -11.080 8.580 1.00 0.00 O ATOM 217 CB ASN A 16 -3.240 -10.460 6.810 1.00 0.00 C ATOM 218 CG ASN A 16 -3.435 -10.270 5.317 1.00 0.00 C ATOM 219 OD1 ASN A 16 -2.749 -10.890 4.506 1.00 0.00 O ATOM 220 ND2 ASN A 16 -4.371 -9.418 4.946 1.00 0.00 N ATOM 0 H ASN A 16 -1.021 -10.566 5.624 1.00 0.00 H new ATOM 0 HA ASN A 16 -2.177 -8.771 7.608 1.00 0.00 H new ATOM 0 HB2 ASN A 16 -3.211 -11.526 7.035 1.00 0.00 H new ATOM 0 HB3 ASN A 16 -4.098 -10.045 7.339 1.00 0.00 H new ATOM 0 HD21 ASN A 16 -4.547 -9.254 3.955 1.00 0.00 H new ATOM 0 HD22 ASN A 16 -4.919 -8.923 5.650 1.00 0.00 H new ATOM 227 N GLN A 17 -2.294 -10.550 9.610 1.00 0.00 N ATOM 228 CA GLN A 17 -1.940 -11.210 10.861 1.00 0.00 C ATOM 229 C GLN A 17 -2.380 -12.670 10.829 1.00 0.00 C ATOM 230 O GLN A 17 -3.091 -13.090 9.929 1.00 0.00 O ATOM 231 CB GLN A 17 -2.580 -10.500 12.054 1.00 0.00 C ATOM 232 CG GLN A 17 -2.574 -8.990 11.934 1.00 0.00 C ATOM 233 CD GLN A 17 -1.202 -8.391 12.179 1.00 0.00 C ATOM 234 OE1 GLN A 17 -0.269 -8.655 11.270 1.00 0.00 O flip ATOM 235 NE2 GLN A 17 -0.982 -7.700 13.174 1.00 0.00 N flip ATOM 0 H GLN A 17 -3.216 -10.115 9.612 1.00 0.00 H new ATOM 0 HA GLN A 17 -0.857 -11.164 10.973 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -3.609 -10.844 12.162 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -2.051 -10.786 12.963 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -2.918 -8.707 10.939 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -3.283 -8.570 12.648 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -1.728 -7.523 13.847 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -0.054 -7.305 13.326 1.00 0.00 H new ATOM 244 N PRO A 18 -1.951 -13.480 11.805 1.00 0.00 N ATOM 245 CA PRO A 18 -2.303 -14.890 11.864 1.00 0.00 C ATOM 246 C PRO A 18 -3.769 -15.130 12.224 1.00 0.00 C ATOM 247 O PRO A 18 -4.333 -16.180 11.903 1.00 0.00 O ATOM 248 CB PRO A 18 -1.393 -15.460 12.961 1.00 0.00 C ATOM 249 CG PRO A 18 -0.419 -14.370 13.292 1.00 0.00 C ATOM 250 CD PRO A 18 -1.081 -13.080 12.913 1.00 0.00 C ATOM 0 HA PRO A 18 -2.170 -15.362 10.891 1.00 0.00 H new ATOM 0 HB2 PRO A 18 -1.972 -15.747 13.839 1.00 0.00 H new ATOM 0 HB3 PRO A 18 -0.876 -16.354 12.614 1.00 0.00 H new ATOM 0 HG2 PRO A 18 -0.170 -14.381 14.353 1.00 0.00 H new ATOM 0 HG3 PRO A 18 0.514 -14.503 12.744 1.00 0.00 H new ATOM 0 HD2 PRO A 18 -1.649 -12.657 13.742 1.00 0.00 H new ATOM 0 HD3 PRO A 18 -0.355 -12.327 12.607 1.00 0.00 H new ATOM 258 N GLY A 19 -4.381 -14.160 12.896 1.00 0.00 N ATOM 259 CA GLY A 19 -5.773 -14.300 13.288 1.00 0.00 C ATOM 260 C GLY A 19 -6.720 -13.480 12.426 1.00 0.00 C ATOM 261 O GLY A 19 -7.902 -13.350 12.746 1.00 0.00 O ATOM 0 H GLY A 19 -3.941 -13.283 13.175 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -6.057 -15.351 13.231 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -5.884 -13.996 14.329 1.00 0.00 H new ATOM 265 N THR A 20 -6.207 -12.930 11.332 1.00 0.00 N ATOM 266 CA THR A 20 -7.027 -12.130 10.436 1.00 0.00 C ATOM 267 C THR A 20 -7.612 -12.980 9.312 1.00 0.00 C ATOM 268 O THR A 20 -6.992 -13.140 8.262 1.00 0.00 O ATOM 269 CB THR A 20 -6.204 -10.980 9.843 1.00 0.00 C ATOM 270 OG1 THR A 20 -4.868 -11.020 10.309 1.00 0.00 O ATOM 271 CG2 THR A 20 -6.760 -9.617 10.174 1.00 0.00 C ATOM 0 H THR A 20 -5.232 -13.023 11.047 1.00 0.00 H new ATOM 0 HA THR A 20 -7.851 -11.719 11.019 1.00 0.00 H new ATOM 0 HB THR A 20 -6.249 -11.124 8.764 1.00 0.00 H new ATOM 0 HG1 THR A 20 -4.405 -11.787 9.911 1.00 0.00 H new ATOM 0 HG21 THR A 20 -6.131 -8.849 9.724 1.00 0.00 H new ATOM 0 HG22 THR A 20 -7.773 -9.532 9.781 1.00 0.00 H new ATOM 0 HG23 THR A 20 -6.778 -9.484 11.256 1.00 0.00 H new ATOM 279 N GLY A 21 -8.814 -13.500 9.532 1.00 0.00 N ATOM 280 CA GLY A 21 -9.461 -14.320 8.512 1.00 0.00 C ATOM 281 C GLY A 21 -9.433 -13.640 7.155 1.00 0.00 C ATOM 282 O GLY A 21 -9.093 -14.260 6.148 1.00 0.00 O ATOM 0 H GLY A 21 -9.352 -13.373 10.389 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -8.960 -15.286 8.447 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -10.493 -14.516 8.801 1.00 0.00 H new ATOM 286 N HIS A 22 -9.774 -12.360 7.142 1.00 0.00 N ATOM 287 CA HIS A 22 -9.771 -11.570 5.928 1.00 0.00 C ATOM 288 C HIS A 22 -8.663 -10.530 6.006 1.00 0.00 C ATOM 289 O HIS A 22 -7.876 -10.520 6.952 1.00 0.00 O ATOM 290 CB HIS A 22 -11.110 -10.870 5.737 1.00 0.00 C ATOM 291 CG HIS A 22 -12.290 -11.790 5.677 1.00 0.00 C ATOM 292 ND1 HIS A 22 -12.450 -12.890 6.502 1.00 0.00 N ATOM 293 CD2 HIS A 22 -13.380 -11.760 4.878 1.00 0.00 C ATOM 294 CE1 HIS A 22 -13.590 -13.490 6.207 1.00 0.00 C ATOM 295 NE2 HIS A 22 -14.170 -12.830 5.225 1.00 0.00 N ATOM 0 H HIS A 22 -10.060 -11.844 7.974 1.00 0.00 H new ATOM 0 HA HIS A 22 -9.601 -12.233 5.080 1.00 0.00 H new ATOM 0 HB2 HIS A 22 -11.257 -10.165 6.555 1.00 0.00 H new ATOM 0 HB3 HIS A 22 -11.073 -10.287 4.817 1.00 0.00 H new ATOM 0 HD2 HIS A 22 -13.591 -11.031 4.110 1.00 0.00 H new ATOM 0 HE1 HIS A 22 -13.981 -14.373 6.690 1.00 0.00 H new ATOM 0 HE2 HIS A 22 -15.061 -13.074 4.792 1.00 0.00 H new ATOM 304 N CYS A 23 -8.608 -9.648 5.024 1.00 0.00 N ATOM 305 CA CYS A 23 -7.595 -8.605 5.010 1.00 0.00 C ATOM 306 C CYS A 23 -8.159 -7.305 5.572 1.00 0.00 C ATOM 307 O CYS A 23 -9.273 -6.903 5.236 1.00 0.00 O ATOM 308 CB CYS A 23 -7.075 -8.387 3.589 1.00 0.00 C ATOM 309 SG CYS A 23 -5.781 -7.129 3.446 1.00 0.00 S ATOM 0 H CYS A 23 -9.248 -9.632 4.230 1.00 0.00 H new ATOM 0 HA CYS A 23 -6.764 -8.923 5.640 1.00 0.00 H new ATOM 0 HB2 CYS A 23 -6.688 -9.332 3.208 1.00 0.00 H new ATOM 0 HB3 CYS A 23 -7.911 -8.104 2.949 1.00 0.00 H new ATOM 0 HG CYS A 23 -5.561 -6.874 2.190 1.00 0.00 H new ATOM 314 N GLU A 24 -7.381 -6.651 6.429 1.00 0.00 N ATOM 315 CA GLU A 24 -7.803 -5.391 7.039 1.00 0.00 C ATOM 316 C GLU A 24 -7.490 -4.203 6.133 1.00 0.00 C ATOM 317 O GLU A 24 -7.484 -3.055 6.579 1.00 0.00 O ATOM 318 CB GLU A 24 -7.122 -5.191 8.394 1.00 0.00 C ATOM 319 CG GLU A 24 -5.679 -5.671 8.440 1.00 0.00 C ATOM 320 CD GLU A 24 -4.911 -5.095 9.614 1.00 0.00 C ATOM 321 OE1 GLU A 24 -5.080 -5.606 10.741 1.00 0.00 O ATOM 322 OE2 GLU A 24 -4.140 -4.135 9.405 1.00 0.00 O ATOM 0 H GLU A 24 -6.456 -6.971 6.718 1.00 0.00 H new ATOM 0 HA GLU A 24 -8.882 -5.445 7.183 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -7.150 -4.132 8.650 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -7.694 -5.718 9.157 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -5.664 -6.759 8.499 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -5.178 -5.395 7.512 1.00 0.00 H new ATOM 329 N MET A 25 -7.227 -4.486 4.865 1.00 0.00 N ATOM 330 CA MET A 25 -6.910 -3.448 3.896 1.00 0.00 C ATOM 331 C MET A 25 -7.872 -3.491 2.713 1.00 0.00 C ATOM 332 O MET A 25 -8.592 -2.526 2.457 1.00 0.00 O ATOM 333 CB MET A 25 -5.468 -3.600 3.407 1.00 0.00 C ATOM 334 CG MET A 25 -4.476 -3.899 4.520 1.00 0.00 C ATOM 335 SD MET A 25 -4.537 -2.686 5.852 1.00 0.00 S ATOM 336 CE MET A 25 -3.179 -1.613 5.393 1.00 0.00 C ATOM 0 H MET A 25 -7.227 -5.432 4.482 1.00 0.00 H new ATOM 0 HA MET A 25 -7.018 -2.482 4.389 1.00 0.00 H new ATOM 0 HB2 MET A 25 -5.426 -4.401 2.669 1.00 0.00 H new ATOM 0 HB3 MET A 25 -5.167 -2.684 2.900 1.00 0.00 H new ATOM 0 HG2 MET A 25 -4.680 -4.889 4.927 1.00 0.00 H new ATOM 0 HG3 MET A 25 -3.468 -3.926 4.105 1.00 0.00 H new ATOM 0 HE1 MET A 25 -3.297 -0.647 5.884 1.00 0.00 H new ATOM 0 HE2 MET A 25 -2.237 -2.065 5.703 1.00 0.00 H new ATOM 0 HE3 MET A 25 -3.175 -1.473 4.312 1.00 0.00 H new ATOM 346 N CYS A 26 -7.893 -4.615 1.995 1.00 0.00 N ATOM 347 CA CYS A 26 -8.786 -4.758 0.852 1.00 0.00 C ATOM 348 C CYS A 26 -10.130 -5.322 1.293 1.00 0.00 C ATOM 349 O CYS A 26 -11.130 -5.212 0.578 1.00 0.00 O ATOM 350 CB CYS A 26 -8.150 -5.631 -0.237 1.00 0.00 C ATOM 351 SG CYS A 26 -7.743 -7.308 0.286 1.00 0.00 S ATOM 0 H CYS A 26 -7.308 -5.429 2.184 1.00 0.00 H new ATOM 0 HA CYS A 26 -8.956 -3.770 0.425 1.00 0.00 H new ATOM 0 HB2 CYS A 26 -8.832 -5.685 -1.085 1.00 0.00 H new ATOM 0 HB3 CYS A 26 -7.241 -5.144 -0.590 1.00 0.00 H new ATOM 0 HG CYS A 26 -6.456 -7.480 0.230 1.00 0.00 H new ATOM 356 N SER A 27 -10.150 -5.920 2.486 1.00 0.00 N ATOM 357 CA SER A 27 -11.370 -6.497 3.049 1.00 0.00 C ATOM 358 C SER A 27 -11.700 -7.852 2.424 1.00 0.00 C ATOM 359 O SER A 27 -12.790 -8.387 2.624 1.00 0.00 O ATOM 360 CB SER A 27 -12.550 -5.541 2.880 1.00 0.00 C ATOM 361 OG SER A 27 -13.610 -5.874 3.766 1.00 0.00 O ATOM 0 H SER A 27 -9.329 -6.017 3.083 1.00 0.00 H new ATOM 0 HA SER A 27 -11.189 -6.654 4.112 1.00 0.00 H new ATOM 0 HB2 SER A 27 -12.223 -4.518 3.068 1.00 0.00 H new ATOM 0 HB3 SER A 27 -12.907 -5.578 1.851 1.00 0.00 H new ATOM 0 HG SER A 27 -13.765 -6.841 3.742 1.00 0.00 H new ATOM 367 N LEU A 28 -10.750 -8.406 1.673 1.00 0.00 N ATOM 368 CA LEU A 28 -10.940 -9.698 1.030 1.00 0.00 C ATOM 369 C LEU A 28 -10.590 -10.820 1.994 1.00 0.00 C ATOM 370 O LEU A 28 -9.686 -10.690 2.812 1.00 0.00 O ATOM 371 CB LEU A 28 -10.080 -9.798 -0.233 1.00 0.00 C ATOM 372 CG LEU A 28 -10.520 -8.915 -1.411 1.00 0.00 C ATOM 373 CD1 LEU A 28 -11.050 -7.568 -0.936 1.00 0.00 C ATOM 374 CD2 LEU A 28 -9.378 -8.724 -2.388 1.00 0.00 C ATOM 0 H LEU A 28 -9.841 -7.977 1.497 1.00 0.00 H new ATOM 0 HA LEU A 28 -11.988 -9.794 0.745 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -9.054 -9.539 0.027 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -10.073 -10.836 -0.564 1.00 0.00 H new ATOM 0 HG LEU A 28 -11.335 -9.428 -1.921 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -11.351 -6.971 -1.797 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -11.910 -7.725 -0.284 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -10.269 -7.043 -0.386 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -9.708 -8.096 -3.216 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -8.541 -8.245 -1.880 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -9.062 -9.694 -2.772 1.00 0.00 H new ATOM 386 N PRO A 29 -11.310 -11.960 1.915 1.00 0.00 N ATOM 387 CA PRO A 29 -11.070 -13.110 2.790 1.00 0.00 C ATOM 388 C PRO A 29 -9.814 -13.870 2.415 1.00 0.00 C ATOM 389 O PRO A 29 -9.543 -14.100 1.238 1.00 0.00 O ATOM 390 CB PRO A 29 -12.310 -13.970 2.586 1.00 0.00 C ATOM 391 CG PRO A 29 -12.770 -13.650 1.208 1.00 0.00 C ATOM 392 CD PRO A 29 -12.420 -12.200 0.972 1.00 0.00 C ATOM 0 HA PRO A 29 -10.912 -12.812 3.827 1.00 0.00 H new ATOM 0 HB2 PRO A 29 -12.078 -15.030 2.690 1.00 0.00 H new ATOM 0 HB3 PRO A 29 -13.078 -13.738 3.324 1.00 0.00 H new ATOM 0 HG2 PRO A 29 -12.281 -14.292 0.476 1.00 0.00 H new ATOM 0 HG3 PRO A 29 -13.843 -13.812 1.109 1.00 0.00 H new ATOM 0 HD2 PRO A 29 -12.117 -12.022 -0.060 1.00 0.00 H new ATOM 0 HD3 PRO A 29 -13.267 -11.544 1.173 1.00 0.00 H new ATOM 400 N ARG A 30 -9.042 -14.240 3.428 1.00 0.00 N ATOM 401 CA ARG A 30 -7.807 -14.970 3.204 1.00 0.00 C ATOM 402 C ARG A 30 -8.081 -16.310 2.533 1.00 0.00 C ATOM 403 O ARG A 30 -9.081 -16.970 2.820 1.00 0.00 O ATOM 404 CB ARG A 30 -7.061 -15.180 4.523 1.00 0.00 C ATOM 405 CG ARG A 30 -5.850 -16.100 4.410 1.00 0.00 C ATOM 406 CD ARG A 30 -6.079 -17.420 5.130 1.00 0.00 C ATOM 407 NE ARG A 30 -5.229 -18.480 4.605 1.00 0.00 N ATOM 408 CZ ARG A 30 -5.197 -19.720 5.100 1.00 0.00 C ATOM 409 NH1 ARG A 30 -5.965 -20.050 6.132 1.00 0.00 N ATOM 410 NH2 ARG A 30 -4.395 -20.630 4.562 1.00 0.00 N ATOM 0 H ARG A 30 -9.250 -14.047 4.408 1.00 0.00 H new ATOM 0 HA ARG A 30 -7.180 -14.376 2.539 1.00 0.00 H new ATOM 0 HB2 ARG A 30 -6.735 -14.212 4.902 1.00 0.00 H new ATOM 0 HB3 ARG A 30 -7.752 -15.594 5.258 1.00 0.00 H new ATOM 0 HG2 ARG A 30 -5.635 -16.291 3.359 1.00 0.00 H new ATOM 0 HG3 ARG A 30 -4.975 -15.603 4.829 1.00 0.00 H new ATOM 0 HD2 ARG A 30 -5.883 -17.292 6.195 1.00 0.00 H new ATOM 0 HD3 ARG A 30 -7.125 -17.711 5.031 1.00 0.00 H new ATOM 0 HE ARG A 30 -4.623 -18.263 3.814 1.00 0.00 H new ATOM 0 HH11 ARG A 30 -6.583 -19.355 6.550 1.00 0.00 H new ATOM 0 HH12 ARG A 30 -5.937 -20.998 6.506 1.00 0.00 H new ATOM 0 HH21 ARG A 30 -3.802 -20.383 3.770 1.00 0.00 H new ATOM 0 HH22 ARG A 30 -4.371 -21.577 4.941 1.00 0.00 H new ATOM 424 N THR A 31 -7.184 -16.720 1.638 1.00 0.00 N ATOM 425 CA THR A 31 -7.329 -17.980 0.926 1.00 0.00 C ATOM 426 C THR A 31 -5.973 -18.650 0.719 1.00 0.00 C ATOM 427 O THR A 31 -4.943 -17.960 0.898 1.00 0.00 O ATOM 428 CB THR A 31 -8.012 -17.740 -0.422 1.00 0.00 C ATOM 429 OG1 THR A 31 -8.311 -18.980 -1.054 1.00 0.00 O ATOM 430 CG2 THR A 31 -7.182 -16.920 -1.385 1.00 0.00 C ATOM 431 OXT THR A 31 -5.954 -19.850 0.381 1.00 0.00 O ATOM 0 H THR A 31 -6.347 -16.192 1.391 1.00 0.00 H new ATOM 0 HA THR A 31 -7.947 -18.647 1.527 1.00 0.00 H new ATOM 0 HB THR A 31 -8.918 -17.179 -0.192 1.00 0.00 H new ATOM 0 HG1 THR A 31 -7.694 -19.669 -0.731 1.00 0.00 H new ATOM 0 HG21 THR A 31 -7.730 -16.791 -2.318 1.00 0.00 H new ATOM 0 HG22 THR A 31 -6.976 -15.943 -0.947 1.00 0.00 H new ATOM 0 HG23 THR A 31 -6.242 -17.434 -1.584 1.00 0.00 H new ATOM 440 N MET B 101 13.483 9.337 -7.672 1.00 0.00 N ATOM 441 CA MET B 101 13.146 7.984 -8.190 1.00 0.00 C ATOM 442 C MET B 101 11.666 7.876 -8.538 1.00 0.00 C ATOM 443 O MET B 101 10.903 8.825 -8.356 1.00 0.00 O ATOM 444 CB MET B 101 13.513 6.936 -7.133 1.00 0.00 C ATOM 445 CG MET B 101 13.474 7.455 -5.703 1.00 0.00 C ATOM 446 SD MET B 101 13.632 6.138 -4.483 1.00 0.00 S ATOM 447 CE MET B 101 11.912 5.711 -4.233 1.00 0.00 C ATOM 0 HA MET B 101 13.716 7.809 -9.103 1.00 0.00 H new ATOM 0 HB2 MET B 101 12.829 6.092 -7.221 1.00 0.00 H new ATOM 0 HB3 MET B 101 14.513 6.558 -7.344 1.00 0.00 H new ATOM 0 HG2 MET B 101 14.279 8.176 -5.560 1.00 0.00 H new ATOM 0 HG3 MET B 101 12.537 7.987 -5.539 1.00 0.00 H new ATOM 0 HE1 MET B 101 11.842 4.883 -3.528 1.00 0.00 H new ATOM 0 HE2 MET B 101 11.377 6.573 -3.834 1.00 0.00 H new ATOM 0 HE3 MET B 101 11.468 5.417 -5.184 1.00 0.00 H new ATOM 459 N GLN B 102 11.269 6.712 -9.039 1.00 0.00 N ATOM 460 CA GLN B 102 9.879 6.474 -9.415 1.00 0.00 C ATOM 461 C GLN B 102 9.343 5.210 -8.752 1.00 0.00 C ATOM 462 O GLN B 102 10.043 4.206 -8.650 1.00 0.00 O ATOM 463 CB GLN B 102 9.749 6.359 -10.930 1.00 0.00 C ATOM 464 CG GLN B 102 10.595 7.365 -11.690 1.00 0.00 C ATOM 465 CD GLN B 102 10.489 7.193 -13.200 1.00 0.00 C ATOM 466 OE1 GLN B 102 11.173 6.357 -13.790 1.00 0.00 O ATOM 467 NE2 GLN B 102 9.628 7.986 -13.820 1.00 0.00 N ATOM 0 H GLN B 102 11.890 5.918 -9.195 1.00 0.00 H new ATOM 0 HA GLN B 102 9.289 7.323 -9.070 1.00 0.00 H new ATOM 0 HB2 GLN B 102 10.034 5.352 -11.236 1.00 0.00 H new ATOM 0 HB3 GLN B 102 8.703 6.492 -11.208 1.00 0.00 H new ATOM 0 HG2 GLN B 102 10.284 8.374 -11.420 1.00 0.00 H new ATOM 0 HG3 GLN B 102 11.637 7.261 -11.388 1.00 0.00 H new ATOM 0 HE21 GLN B 102 9.083 8.664 -13.287 1.00 0.00 H new ATOM 0 HE22 GLN B 102 9.510 7.919 -14.831 1.00 0.00 H new ATOM 476 N ILE B 103 8.095 5.268 -8.306 1.00 0.00 N ATOM 477 CA ILE B 103 7.459 4.129 -7.657 1.00 0.00 C ATOM 478 C ILE B 103 6.170 3.743 -8.374 1.00 0.00 C ATOM 479 O ILE B 103 5.404 4.606 -8.802 1.00 0.00 O ATOM 480 CB ILE B 103 7.148 4.427 -6.174 1.00 0.00 C ATOM 481 CG1 ILE B 103 6.053 5.489 -6.053 1.00 0.00 C ATOM 482 CG2 ILE B 103 8.408 4.879 -5.452 1.00 0.00 C ATOM 483 CD1 ILE B 103 5.648 5.780 -4.624 1.00 0.00 C ATOM 0 H ILE B 103 7.502 6.094 -8.382 1.00 0.00 H new ATOM 0 HA ILE B 103 8.162 3.298 -7.708 1.00 0.00 H new ATOM 0 HB ILE B 103 6.787 3.510 -5.707 1.00 0.00 H new ATOM 0 HG12 ILE B 103 6.400 6.411 -6.519 1.00 0.00 H new ATOM 0 HG13 ILE B 103 5.176 5.160 -6.611 1.00 0.00 H new ATOM 0 HG21 ILE B 103 8.175 5.086 -4.408 1.00 0.00 H new ATOM 0 HG22 ILE B 103 9.161 4.093 -5.507 1.00 0.00 H new ATOM 0 HG23 ILE B 103 8.793 5.783 -5.924 1.00 0.00 H new ATOM 0 HD11 ILE B 103 4.868 6.542 -4.615 1.00 0.00 H new ATOM 0 HD12 ILE B 103 5.270 4.869 -4.160 1.00 0.00 H new ATOM 0 HD13 ILE B 103 6.513 6.139 -4.067 1.00 0.00 H new ATOM 495 N PHE B 104 5.935 2.443 -8.502 1.00 0.00 N ATOM 496 CA PHE B 104 4.736 1.948 -9.168 1.00 0.00 C ATOM 497 C PHE B 104 3.622 1.685 -8.161 1.00 0.00 C ATOM 498 O PHE B 104 3.875 1.230 -7.046 1.00 0.00 O ATOM 499 CB PHE B 104 5.047 0.668 -9.945 1.00 0.00 C ATOM 500 CG PHE B 104 6.021 0.870 -11.070 1.00 0.00 C ATOM 501 CD1 PHE B 104 7.318 1.284 -10.810 1.00 0.00 C ATOM 502 CD2 PHE B 104 5.637 0.646 -12.380 1.00 0.00 C ATOM 503 CE1 PHE B 104 8.216 1.471 -11.850 1.00 0.00 C ATOM 504 CE2 PHE B 104 6.530 0.831 -13.420 1.00 0.00 C ATOM 505 CZ PHE B 104 7.821 1.244 -13.150 1.00 0.00 C ATOM 0 H PHE B 104 6.557 1.713 -8.154 1.00 0.00 H new ATOM 0 HA PHE B 104 4.398 2.715 -9.865 1.00 0.00 H new ATOM 0 HB2 PHE B 104 5.448 -0.076 -9.257 1.00 0.00 H new ATOM 0 HB3 PHE B 104 4.119 0.262 -10.347 1.00 0.00 H new ATOM 0 HD1 PHE B 104 7.631 1.462 -9.792 1.00 0.00 H new ATOM 0 HD2 PHE B 104 4.629 0.323 -12.593 1.00 0.00 H new ATOM 0 HE1 PHE B 104 9.225 1.795 -11.641 1.00 0.00 H new ATOM 0 HE2 PHE B 104 6.220 0.653 -14.439 1.00 0.00 H new ATOM 0 HZ PHE B 104 8.521 1.389 -13.959 1.00 0.00 H new ATOM 515 N VAL B 105 2.389 1.974 -8.562 1.00 0.00 N ATOM 516 CA VAL B 105 1.234 1.768 -7.695 1.00 0.00 C ATOM 517 C VAL B 105 0.222 0.832 -8.346 1.00 0.00 C ATOM 518 O VAL B 105 -0.516 1.230 -9.246 1.00 0.00 O ATOM 519 CB VAL B 105 0.541 3.100 -7.353 1.00 0.00 C ATOM 520 CG1 VAL B 105 -0.563 2.883 -6.329 1.00 0.00 C ATOM 521 CG2 VAL B 105 1.555 4.115 -6.848 1.00 0.00 C ATOM 0 H VAL B 105 2.163 2.352 -9.482 1.00 0.00 H new ATOM 0 HA VAL B 105 1.605 1.316 -6.775 1.00 0.00 H new ATOM 0 HB VAL B 105 0.087 3.495 -8.262 1.00 0.00 H new ATOM 0 HG11 VAL B 105 -1.040 3.836 -6.101 1.00 0.00 H new ATOM 0 HG12 VAL B 105 -1.304 2.194 -6.734 1.00 0.00 H new ATOM 0 HG13 VAL B 105 -0.137 2.463 -5.418 1.00 0.00 H new ATOM 0 HG21 VAL B 105 1.047 5.050 -6.611 1.00 0.00 H new ATOM 0 HG22 VAL B 105 2.041 3.729 -5.952 1.00 0.00 H new ATOM 0 HG23 VAL B 105 2.305 4.294 -7.618 1.00 0.00 H new ATOM 531 N LYS B 106 0.195 -0.415 -7.887 1.00 0.00 N ATOM 532 CA LYS B 106 -0.725 -1.409 -8.429 1.00 0.00 C ATOM 533 C LYS B 106 -2.031 -1.442 -7.641 1.00 0.00 C ATOM 534 O LYS B 106 -2.041 -1.746 -6.448 1.00 0.00 O ATOM 535 CB LYS B 106 -0.075 -2.794 -8.417 1.00 0.00 C ATOM 536 CG LYS B 106 -0.775 -3.802 -9.314 1.00 0.00 C ATOM 537 CD LYS B 106 -0.702 -5.207 -8.736 1.00 0.00 C ATOM 538 CE LYS B 106 -0.866 -6.263 -9.817 1.00 0.00 C ATOM 539 NZ LYS B 106 -0.722 -7.641 -9.273 1.00 0.00 N ATOM 0 H LYS B 106 0.799 -0.761 -7.142 1.00 0.00 H new ATOM 0 HA LYS B 106 -0.954 -1.127 -9.457 1.00 0.00 H new ATOM 0 HB2 LYS B 106 0.965 -2.701 -8.731 1.00 0.00 H new ATOM 0 HB3 LYS B 106 -0.067 -3.174 -7.395 1.00 0.00 H new ATOM 0 HG2 LYS B 106 -1.818 -3.514 -9.442 1.00 0.00 H new ATOM 0 HG3 LYS B 106 -0.317 -3.790 -10.303 1.00 0.00 H new ATOM 0 HD2 LYS B 106 0.255 -5.345 -8.233 1.00 0.00 H new ATOM 0 HD3 LYS B 106 -1.479 -5.332 -7.982 1.00 0.00 H new ATOM 0 HE2 LYS B 106 -1.846 -6.157 -10.282 1.00 0.00 H new ATOM 0 HE3 LYS B 106 -0.123 -6.102 -10.598 1.00 0.00 H new ATOM 0 HZ1 LYS B 106 -0.841 -8.332 -10.041 1.00 0.00 H new ATOM 0 HZ2 LYS B 106 0.222 -7.751 -8.851 1.00 0.00 H new ATOM 0 HZ3 LYS B 106 -1.447 -7.805 -8.546 1.00 0.00 H new ATOM 553 N THR B 107 -3.131 -1.131 -8.318 1.00 0.00 N ATOM 554 CA THR B 107 -4.446 -1.129 -7.686 1.00 0.00 C ATOM 555 C THR B 107 -5.142 -2.470 -7.889 1.00 0.00 C ATOM 556 O THR B 107 -4.879 -3.176 -8.862 1.00 0.00 O ATOM 557 CB THR B 107 -5.307 0.001 -8.256 1.00 0.00 C ATOM 558 OG1 THR B 107 -4.824 0.411 -9.523 1.00 0.00 O ATOM 559 CG2 THR B 107 -5.353 1.225 -7.366 1.00 0.00 C ATOM 0 H THR B 107 -3.138 -0.877 -9.306 1.00 0.00 H new ATOM 0 HA THR B 107 -4.312 -0.966 -6.617 1.00 0.00 H new ATOM 0 HB THR B 107 -6.312 -0.413 -8.332 1.00 0.00 H new ATOM 0 HG1 THR B 107 -4.601 -0.378 -10.059 1.00 0.00 H new ATOM 0 HG21 THR B 107 -5.980 1.988 -7.828 1.00 0.00 H new ATOM 0 HG22 THR B 107 -5.768 0.954 -6.395 1.00 0.00 H new ATOM 0 HG23 THR B 107 -4.344 1.616 -7.233 1.00 0.00 H new ATOM 567 N LEU B 108 -6.036 -2.815 -6.966 1.00 0.00 N ATOM 568 CA LEU B 108 -6.772 -4.072 -7.052 1.00 0.00 C ATOM 569 C LEU B 108 -7.729 -4.071 -8.242 1.00 0.00 C ATOM 570 O LEU B 108 -8.296 -5.106 -8.592 1.00 0.00 O ATOM 571 CB LEU B 108 -7.553 -4.326 -5.759 1.00 0.00 C ATOM 572 CG LEU B 108 -6.711 -4.365 -4.480 1.00 0.00 C ATOM 573 CD1 LEU B 108 -7.525 -4.929 -3.325 1.00 0.00 C ATOM 574 CD2 LEU B 108 -5.447 -5.187 -4.691 1.00 0.00 C ATOM 0 H LEU B 108 -6.267 -2.244 -6.153 1.00 0.00 H new ATOM 0 HA LEU B 108 -6.046 -4.872 -7.194 1.00 0.00 H new ATOM 0 HB2 LEU B 108 -8.309 -3.548 -5.652 1.00 0.00 H new ATOM 0 HB3 LEU B 108 -8.082 -5.274 -5.854 1.00 0.00 H new ATOM 0 HG LEU B 108 -6.418 -3.345 -4.233 1.00 0.00 H new ATOM 0 HD11 LEU B 108 -6.912 -4.950 -2.424 1.00 0.00 H new ATOM 0 HD12 LEU B 108 -8.399 -4.300 -3.155 1.00 0.00 H new ATOM 0 HD13 LEU B 108 -7.848 -5.941 -3.568 1.00 0.00 H new ATOM 0 HD21 LEU B 108 -4.864 -5.201 -3.770 1.00 0.00 H new ATOM 0 HD22 LEU B 108 -5.718 -6.207 -4.965 1.00 0.00 H new ATOM 0 HD23 LEU B 108 -4.853 -4.742 -5.489 1.00 0.00 H new ATOM 586 N THR B 109 -7.909 -2.907 -8.862 1.00 0.00 N ATOM 587 CA THR B 109 -8.800 -2.785 -10.010 1.00 0.00 C ATOM 588 C THR B 109 -8.133 -3.302 -11.280 1.00 0.00 C ATOM 589 O THR B 109 -8.807 -3.593 -12.270 1.00 0.00 O ATOM 590 CB THR B 109 -9.224 -1.328 -10.200 1.00 0.00 C ATOM 591 OG1 THR B 109 -10.160 -1.211 -11.250 1.00 0.00 O ATOM 592 CG2 THR B 109 -8.066 -0.404 -10.510 1.00 0.00 C ATOM 0 H THR B 109 -7.450 -2.038 -8.589 1.00 0.00 H new ATOM 0 HA THR B 109 -9.684 -3.392 -9.815 1.00 0.00 H new ATOM 0 HB THR B 109 -9.662 -1.028 -9.248 1.00 0.00 H new ATOM 0 HG1 THR B 109 -10.124 -2.014 -11.811 1.00 0.00 H new ATOM 0 HG21 THR B 109 -8.436 0.614 -10.633 1.00 0.00 H new ATOM 0 HG22 THR B 109 -7.348 -0.433 -9.690 1.00 0.00 H new ATOM 0 HG23 THR B 109 -7.579 -0.727 -11.430 1.00 0.00 H new ATOM 600 N GLY B 110 -6.807 -3.415 -11.250 1.00 0.00 N ATOM 601 CA GLY B 110 -6.081 -3.898 -12.410 1.00 0.00 C ATOM 602 C GLY B 110 -5.337 -2.792 -13.130 1.00 0.00 C ATOM 603 O GLY B 110 -5.047 -2.906 -14.330 1.00 0.00 O ATOM 0 H GLY B 110 -6.225 -3.181 -10.445 1.00 0.00 H new ATOM 0 HA2 GLY B 110 -5.372 -4.665 -12.098 1.00 0.00 H new ATOM 0 HA3 GLY B 110 -6.779 -4.371 -13.100 1.00 0.00 H new ATOM 607 N LYS B 111 -5.029 -1.718 -12.410 1.00 0.00 N ATOM 608 CA LYS B 111 -4.315 -0.588 -12.990 1.00 0.00 C ATOM 609 C LYS B 111 -3.047 -0.287 -12.210 1.00 0.00 C ATOM 610 O LYS B 111 -3.002 -0.447 -10.990 1.00 0.00 O ATOM 611 CB LYS B 111 -5.215 0.648 -13.030 1.00 0.00 C ATOM 612 CG LYS B 111 -4.993 1.526 -14.250 1.00 0.00 C ATOM 613 CD LYS B 111 -6.290 2.167 -14.720 1.00 0.00 C ATOM 614 CE LYS B 111 -6.027 3.382 -15.590 1.00 0.00 C ATOM 615 NZ LYS B 111 -6.078 3.046 -17.040 1.00 0.00 N ATOM 0 H LYS B 111 -5.263 -1.607 -11.423 1.00 0.00 H new ATOM 0 HA LYS B 111 -4.035 -0.854 -14.009 1.00 0.00 H new ATOM 0 HB2 LYS B 111 -6.257 0.329 -13.008 1.00 0.00 H new ATOM 0 HB3 LYS B 111 -5.044 1.240 -12.131 1.00 0.00 H new ATOM 0 HG2 LYS B 111 -4.267 2.304 -14.013 1.00 0.00 H new ATOM 0 HG3 LYS B 111 -4.568 0.929 -15.057 1.00 0.00 H new ATOM 0 HD2 LYS B 111 -6.876 1.438 -15.280 1.00 0.00 H new ATOM 0 HD3 LYS B 111 -6.887 2.459 -13.856 1.00 0.00 H new ATOM 0 HE2 LYS B 111 -6.765 4.153 -15.370 1.00 0.00 H new ATOM 0 HE3 LYS B 111 -5.049 3.798 -15.347 1.00 0.00 H new ATOM 0 HZ1 LYS B 111 -5.893 3.902 -17.601 1.00 0.00 H new ATOM 0 HZ2 LYS B 111 -5.357 2.328 -17.256 1.00 0.00 H new ATOM 0 HZ3 LYS B 111 -7.019 2.673 -17.277 1.00 0.00 H new ATOM 629 N THR B 112 -2.019 0.148 -12.920 1.00 0.00 N ATOM 630 CA THR B 112 -0.740 0.473 -12.310 1.00 0.00 C ATOM 631 C THR B 112 -0.364 1.926 -12.590 1.00 0.00 C ATOM 632 O THR B 112 -0.351 2.357 -13.750 1.00 0.00 O ATOM 633 CB THR B 112 0.339 -0.478 -12.840 1.00 0.00 C ATOM 634 OG1 THR B 112 0.223 -1.750 -12.220 1.00 0.00 O ATOM 635 CG2 THR B 112 1.755 0.010 -12.610 1.00 0.00 C ATOM 0 H THR B 112 -2.047 0.285 -13.930 1.00 0.00 H new ATOM 0 HA THR B 112 -0.820 0.350 -11.230 1.00 0.00 H new ATOM 0 HB THR B 112 0.168 -0.532 -13.915 1.00 0.00 H new ATOM 0 HG1 THR B 112 0.917 -2.348 -12.568 1.00 0.00 H new ATOM 0 HG21 THR B 112 2.460 -0.717 -13.013 1.00 0.00 H new ATOM 0 HG22 THR B 112 1.896 0.968 -13.111 1.00 0.00 H new ATOM 0 HG23 THR B 112 1.929 0.131 -11.541 1.00 0.00 H new ATOM 643 N ILE B 113 -0.064 2.677 -11.540 1.00 0.00 N ATOM 644 CA ILE B 113 0.306 4.081 -11.680 1.00 0.00 C ATOM 645 C ILE B 113 1.762 4.314 -11.300 1.00 0.00 C ATOM 646 O ILE B 113 2.209 3.898 -10.230 1.00 0.00 O ATOM 647 CB ILE B 113 -0.582 5.007 -10.830 1.00 0.00 C ATOM 648 CG1 ILE B 113 -1.969 4.395 -10.620 1.00 0.00 C ATOM 649 CG2 ILE B 113 -0.697 6.377 -11.480 1.00 0.00 C ATOM 650 CD1 ILE B 113 -2.899 5.270 -9.807 1.00 0.00 C ATOM 0 H ILE B 113 -0.069 2.338 -10.578 1.00 0.00 H new ATOM 0 HA ILE B 113 0.159 4.325 -12.732 1.00 0.00 H new ATOM 0 HB ILE B 113 -0.113 5.124 -9.853 1.00 0.00 H new ATOM 0 HG12 ILE B 113 -2.423 4.201 -11.592 1.00 0.00 H new ATOM 0 HG13 ILE B 113 -1.861 3.432 -10.121 1.00 0.00 H new ATOM 0 HG21 ILE B 113 -1.328 7.019 -10.866 1.00 0.00 H new ATOM 0 HG22 ILE B 113 0.294 6.821 -11.570 1.00 0.00 H new ATOM 0 HG23 ILE B 113 -1.139 6.274 -12.471 1.00 0.00 H new ATOM 0 HD11 ILE B 113 -3.863 4.774 -9.698 1.00 0.00 H new ATOM 0 HD12 ILE B 113 -2.467 5.443 -8.821 1.00 0.00 H new ATOM 0 HD13 ILE B 113 -3.038 6.224 -10.315 1.00 0.00 H new ATOM 662 N THR B 114 2.490 4.998 -12.170 1.00 0.00 N ATOM 663 CA THR B 114 3.891 5.309 -11.930 1.00 0.00 C ATOM 664 C THR B 114 4.038 6.764 -11.500 1.00 0.00 C ATOM 665 O THR B 114 3.533 7.669 -12.170 1.00 0.00 O ATOM 666 CB THR B 114 4.726 5.041 -13.180 1.00 0.00 C ATOM 667 OG1 THR B 114 4.274 3.874 -13.840 1.00 0.00 O ATOM 668 CG2 THR B 114 6.200 4.862 -12.890 1.00 0.00 C ATOM 0 H THR B 114 2.129 5.351 -13.056 1.00 0.00 H new ATOM 0 HA THR B 114 4.255 4.664 -11.130 1.00 0.00 H new ATOM 0 HB THR B 114 4.602 5.925 -13.806 1.00 0.00 H new ATOM 0 HG1 THR B 114 4.819 3.718 -14.639 1.00 0.00 H new ATOM 0 HG21 THR B 114 6.734 4.675 -13.822 1.00 0.00 H new ATOM 0 HG22 THR B 114 6.591 5.766 -12.423 1.00 0.00 H new ATOM 0 HG23 THR B 114 6.338 4.016 -12.217 1.00 0.00 H new ATOM 676 N LEU B 115 4.723 6.983 -10.390 1.00 0.00 N ATOM 677 CA LEU B 115 4.924 8.327 -9.875 1.00 0.00 C ATOM 678 C LEU B 115 6.387 8.559 -9.524 1.00 0.00 C ATOM 679 O LEU B 115 7.158 7.613 -9.372 1.00 0.00 O ATOM 680 CB LEU B 115 4.046 8.550 -8.644 1.00 0.00 C ATOM 681 CG LEU B 115 2.543 8.398 -8.890 1.00 0.00 C ATOM 682 CD1 LEU B 115 1.858 7.788 -7.677 1.00 0.00 C ATOM 683 CD2 LEU B 115 1.921 9.744 -9.235 1.00 0.00 C ATOM 0 H LEU B 115 5.150 6.247 -9.828 1.00 0.00 H new ATOM 0 HA LEU B 115 4.642 9.039 -10.650 1.00 0.00 H new ATOM 0 HB2 LEU B 115 4.346 7.845 -7.869 1.00 0.00 H new ATOM 0 HB3 LEU B 115 4.237 9.550 -8.256 1.00 0.00 H new ATOM 0 HG LEU B 115 2.401 7.725 -9.736 1.00 0.00 H new ATOM 0 HD11 LEU B 115 0.790 7.689 -7.874 1.00 0.00 H new ATOM 0 HD12 LEU B 115 2.283 6.805 -7.476 1.00 0.00 H new ATOM 0 HD13 LEU B 115 2.009 8.433 -6.811 1.00 0.00 H new ATOM 0 HD21 LEU B 115 0.852 9.618 -9.407 1.00 0.00 H new ATOM 0 HD22 LEU B 115 2.076 10.439 -8.410 1.00 0.00 H new ATOM 0 HD23 LEU B 115 2.389 10.141 -10.136 1.00 0.00 H new ATOM 695 N GLU B 116 6.758 9.826 -9.397 1.00 0.00 N ATOM 696 CA GLU B 116 8.117 10.198 -9.067 1.00 0.00 C ATOM 697 C GLU B 116 8.210 10.654 -7.617 1.00 0.00 C ATOM 698 O GLU B 116 7.579 11.630 -7.212 1.00 0.00 O ATOM 699 CB GLU B 116 8.604 11.299 -10.010 1.00 0.00 C ATOM 700 CG GLU B 116 8.216 12.708 -9.586 1.00 0.00 C ATOM 701 CD GLU B 116 8.189 13.682 -10.740 1.00 0.00 C ATOM 702 OE1 GLU B 116 7.656 13.318 -11.810 1.00 0.00 O ATOM 703 OE2 GLU B 116 8.701 14.810 -10.580 1.00 0.00 O ATOM 0 H GLU B 116 6.126 10.617 -9.520 1.00 0.00 H new ATOM 0 HA GLU B 116 8.758 9.325 -9.190 1.00 0.00 H new ATOM 0 HB2 GLU B 116 9.690 11.242 -10.085 1.00 0.00 H new ATOM 0 HB3 GLU B 116 8.205 11.110 -11.006 1.00 0.00 H new ATOM 0 HG2 GLU B 116 7.233 12.683 -9.115 1.00 0.00 H new ATOM 0 HG3 GLU B 116 8.921 13.063 -8.834 1.00 0.00 H new ATOM 710 N VAL B 117 9.004 9.938 -6.847 1.00 0.00 N ATOM 711 CA VAL B 117 9.200 10.250 -5.445 1.00 0.00 C ATOM 712 C VAL B 117 10.670 10.127 -5.086 1.00 0.00 C ATOM 713 O VAL B 117 11.502 9.838 -5.945 1.00 0.00 O ATOM 714 CB VAL B 117 8.378 9.315 -4.540 1.00 0.00 C ATOM 715 CG1 VAL B 117 6.891 9.602 -4.683 1.00 0.00 C ATOM 716 CG2 VAL B 117 8.682 7.860 -4.862 1.00 0.00 C ATOM 0 H VAL B 117 9.530 9.127 -7.173 1.00 0.00 H new ATOM 0 HA VAL B 117 8.861 11.273 -5.283 1.00 0.00 H new ATOM 0 HB VAL B 117 8.660 9.501 -3.504 1.00 0.00 H new ATOM 0 HG11 VAL B 117 6.327 8.931 -4.035 1.00 0.00 H new ATOM 0 HG12 VAL B 117 6.691 10.635 -4.398 1.00 0.00 H new ATOM 0 HG13 VAL B 117 6.588 9.446 -5.719 1.00 0.00 H new ATOM 0 HG21 VAL B 117 8.092 7.213 -4.213 1.00 0.00 H new ATOM 0 HG22 VAL B 117 8.430 7.657 -5.903 1.00 0.00 H new ATOM 0 HG23 VAL B 117 9.742 7.666 -4.701 1.00 0.00 H new ATOM 726 N GLU B 118 10.991 10.345 -3.821 1.00 0.00 N ATOM 727 CA GLU B 118 12.368 10.251 -3.371 1.00 0.00 C ATOM 728 C GLU B 118 12.480 9.342 -2.151 1.00 0.00 C ATOM 729 O GLU B 118 11.496 9.102 -1.452 1.00 0.00 O ATOM 730 CB GLU B 118 12.912 11.639 -3.036 1.00 0.00 C ATOM 731 CG GLU B 118 13.926 12.157 -4.043 1.00 0.00 C ATOM 732 CD GLU B 118 14.878 13.173 -3.442 1.00 0.00 C ATOM 733 OE1 GLU B 118 15.422 12.903 -2.351 1.00 0.00 O ATOM 734 OE2 GLU B 118 15.079 14.237 -4.063 1.00 0.00 O ATOM 0 H GLU B 118 10.320 10.587 -3.092 1.00 0.00 H new ATOM 0 HA GLU B 118 12.960 9.821 -4.179 1.00 0.00 H new ATOM 0 HB2 GLU B 118 12.080 12.341 -2.977 1.00 0.00 H new ATOM 0 HB3 GLU B 118 13.375 11.610 -2.050 1.00 0.00 H new ATOM 0 HG2 GLU B 118 14.498 11.319 -4.441 1.00 0.00 H new ATOM 0 HG3 GLU B 118 13.399 12.610 -4.883 1.00 0.00 H new ATOM 741 N PRO B 119 13.690 8.830 -1.872 1.00 0.00 N ATOM 742 CA PRO B 119 13.929 7.954 -0.724 1.00 0.00 C ATOM 743 C PRO B 119 13.995 8.728 0.590 1.00 0.00 C ATOM 744 O PRO B 119 14.134 8.138 1.661 1.00 0.00 O ATOM 745 CB PRO B 119 15.284 7.331 -1.047 1.00 0.00 C ATOM 746 CG PRO B 119 15.989 8.368 -1.851 1.00 0.00 C ATOM 747 CD PRO B 119 14.923 9.073 -2.648 1.00 0.00 C ATOM 0 HA PRO B 119 13.129 7.227 -0.583 1.00 0.00 H new ATOM 0 HB2 PRO B 119 15.836 7.089 -0.139 1.00 0.00 H new ATOM 0 HB3 PRO B 119 15.171 6.403 -1.608 1.00 0.00 H new ATOM 0 HG2 PRO B 119 16.520 9.068 -1.205 1.00 0.00 H new ATOM 0 HG3 PRO B 119 16.731 7.914 -2.508 1.00 0.00 H new ATOM 0 HD2 PRO B 119 15.133 10.138 -2.744 1.00 0.00 H new ATOM 0 HD3 PRO B 119 14.846 8.671 -3.658 1.00 0.00 H new ATOM 755 N SER B 120 13.890 10.051 0.501 1.00 0.00 N ATOM 756 CA SER B 120 13.934 10.902 1.683 1.00 0.00 C ATOM 757 C SER B 120 12.550 11.460 1.998 1.00 0.00 C ATOM 758 O SER B 120 12.272 11.854 3.131 1.00 0.00 O ATOM 759 CB SER B 120 14.925 12.049 1.475 1.00 0.00 C ATOM 760 OG SER B 120 15.621 12.345 2.674 1.00 0.00 O ATOM 0 H SER B 120 13.774 10.556 -0.378 1.00 0.00 H new ATOM 0 HA SER B 120 14.264 10.296 2.527 1.00 0.00 H new ATOM 0 HB2 SER B 120 15.637 11.782 0.694 1.00 0.00 H new ATOM 0 HB3 SER B 120 14.393 12.936 1.131 1.00 0.00 H new ATOM 0 HG SER B 120 16.249 13.080 2.515 1.00 0.00 H new ATOM 766 N ASP B 121 11.684 11.489 0.989 1.00 0.00 N ATOM 767 CA ASP B 121 10.330 11.997 1.160 1.00 0.00 C ATOM 768 C ASP B 121 9.575 11.182 2.206 1.00 0.00 C ATOM 769 O ASP B 121 10.171 10.404 2.950 1.00 0.00 O ATOM 770 CB ASP B 121 9.579 11.965 -0.173 1.00 0.00 C ATOM 771 CG ASP B 121 8.713 13.192 -0.378 1.00 0.00 C ATOM 772 OD1 ASP B 121 8.067 13.632 0.597 1.00 0.00 O ATOM 773 OD2 ASP B 121 8.679 13.712 -1.513 1.00 0.00 O ATOM 0 H ASP B 121 11.897 11.166 0.045 1.00 0.00 H new ATOM 0 HA ASP B 121 10.394 13.029 1.506 1.00 0.00 H new ATOM 0 HB2 ASP B 121 10.297 11.890 -0.990 1.00 0.00 H new ATOM 0 HB3 ASP B 121 8.955 11.072 -0.214 1.00 0.00 H new ATOM 778 N THR B 122 8.260 11.365 2.255 1.00 0.00 N ATOM 779 CA THR B 122 7.422 10.647 3.204 1.00 0.00 C ATOM 780 C THR B 122 6.222 10.030 2.498 1.00 0.00 C ATOM 781 O THR B 122 5.788 10.515 1.453 1.00 0.00 O ATOM 782 CB THR B 122 6.950 11.588 4.314 1.00 0.00 C ATOM 783 OG1 THR B 122 6.423 12.783 3.767 1.00 0.00 O ATOM 784 CG2 THR B 122 8.049 11.971 5.281 1.00 0.00 C ATOM 0 H THR B 122 7.752 12.007 1.646 1.00 0.00 H new ATOM 0 HA THR B 122 8.014 9.847 3.648 1.00 0.00 H new ATOM 0 HB THR B 122 6.186 11.033 4.859 1.00 0.00 H new ATOM 0 HG1 THR B 122 6.273 13.433 4.485 1.00 0.00 H new ATOM 0 HG21 THR B 122 7.647 12.639 6.043 1.00 0.00 H new ATOM 0 HG22 THR B 122 8.444 11.074 5.757 1.00 0.00 H new ATOM 0 HG23 THR B 122 8.849 12.477 4.741 1.00 0.00 H new ATOM 792 N ILE B 123 5.688 8.959 3.073 1.00 0.00 N ATOM 793 CA ILE B 123 4.535 8.280 2.492 1.00 0.00 C ATOM 794 C ILE B 123 3.366 9.243 2.321 1.00 0.00 C ATOM 795 O ILE B 123 2.563 9.104 1.398 1.00 0.00 O ATOM 796 CB ILE B 123 4.078 7.090 3.357 1.00 0.00 C ATOM 797 CG1 ILE B 123 5.271 6.206 3.733 1.00 0.00 C ATOM 798 CG2 ILE B 123 3.023 6.277 2.622 1.00 0.00 C ATOM 799 CD1 ILE B 123 6.087 5.749 2.543 1.00 0.00 C ATOM 0 H ILE B 123 6.033 8.543 3.938 1.00 0.00 H new ATOM 0 HA ILE B 123 4.849 7.907 1.517 1.00 0.00 H new ATOM 0 HB ILE B 123 3.639 7.480 4.275 1.00 0.00 H new ATOM 0 HG12 ILE B 123 5.918 6.755 4.417 1.00 0.00 H new ATOM 0 HG13 ILE B 123 4.908 5.331 4.272 1.00 0.00 H new ATOM 0 HG21 ILE B 123 2.710 5.440 3.245 1.00 0.00 H new ATOM 0 HG22 ILE B 123 2.162 6.910 2.405 1.00 0.00 H new ATOM 0 HG23 ILE B 123 3.440 5.899 1.689 1.00 0.00 H new ATOM 0 HD11 ILE B 123 6.914 5.128 2.886 1.00 0.00 H new ATOM 0 HD12 ILE B 123 5.455 5.171 1.869 1.00 0.00 H new ATOM 0 HD13 ILE B 123 6.480 6.618 2.016 1.00 0.00 H new ATOM 811 N GLU B 124 3.279 10.221 3.215 1.00 0.00 N ATOM 812 CA GLU B 124 2.210 11.211 3.162 1.00 0.00 C ATOM 813 C GLU B 124 2.265 11.992 1.854 1.00 0.00 C ATOM 814 O GLU B 124 1.235 12.412 1.327 1.00 0.00 O ATOM 815 CB GLU B 124 2.312 12.167 4.352 1.00 0.00 C ATOM 816 CG GLU B 124 3.568 13.022 4.343 1.00 0.00 C ATOM 817 CD GLU B 124 3.460 14.227 5.256 1.00 0.00 C ATOM 818 OE1 GLU B 124 2.340 14.761 5.405 1.00 0.00 O ATOM 819 OE2 GLU B 124 4.494 14.638 5.823 1.00 0.00 O ATOM 0 H GLU B 124 3.936 10.350 3.985 1.00 0.00 H new ATOM 0 HA GLU B 124 1.255 10.688 3.212 1.00 0.00 H new ATOM 0 HB2 GLU B 124 1.439 12.820 4.358 1.00 0.00 H new ATOM 0 HB3 GLU B 124 2.284 11.588 5.275 1.00 0.00 H new ATOM 0 HG2 GLU B 124 4.419 12.414 4.649 1.00 0.00 H new ATOM 0 HG3 GLU B 124 3.767 13.359 3.325 1.00 0.00 H new ATOM 826 N ASN B 125 3.473 12.175 1.332 1.00 0.00 N ATOM 827 CA ASN B 125 3.659 12.897 0.080 1.00 0.00 C ATOM 828 C ASN B 125 3.281 12.015 -1.103 1.00 0.00 C ATOM 829 O ASN B 125 2.699 12.486 -2.081 1.00 0.00 O ATOM 830 CB ASN B 125 5.110 13.369 -0.054 1.00 0.00 C ATOM 831 CG ASN B 125 5.208 14.828 -0.454 1.00 0.00 C ATOM 832 OD1 ASN B 125 4.695 15.233 -1.498 1.00 0.00 O ATOM 833 ND2 ASN B 125 5.870 15.626 0.375 1.00 0.00 N ATOM 0 H ASN B 125 4.336 11.834 1.756 1.00 0.00 H new ATOM 0 HA ASN B 125 3.007 13.771 0.086 1.00 0.00 H new ATOM 0 HB2 ASN B 125 5.627 13.219 0.894 1.00 0.00 H new ATOM 0 HB3 ASN B 125 5.622 12.756 -0.796 1.00 0.00 H new ATOM 0 HD21 ASN B 125 5.970 16.618 0.158 1.00 0.00 H new ATOM 0 HD22 ASN B 125 6.279 15.248 1.229 1.00 0.00 H new ATOM 840 N VAL B 126 3.603 10.731 -1.000 1.00 0.00 N ATOM 841 CA VAL B 126 3.284 9.779 -2.055 1.00 0.00 C ATOM 842 C VAL B 126 1.781 9.544 -2.116 1.00 0.00 C ATOM 843 O VAL B 126 1.201 9.425 -3.196 1.00 0.00 O ATOM 844 CB VAL B 126 3.998 8.432 -1.837 1.00 0.00 C ATOM 845 CG1 VAL B 126 3.767 7.507 -3.022 1.00 0.00 C ATOM 846 CG2 VAL B 126 5.486 8.646 -1.596 1.00 0.00 C ATOM 0 H VAL B 126 4.084 10.326 -0.197 1.00 0.00 H new ATOM 0 HA VAL B 126 3.631 10.207 -2.996 1.00 0.00 H new ATOM 0 HB VAL B 126 3.577 7.958 -0.950 1.00 0.00 H new ATOM 0 HG11 VAL B 126 4.279 6.560 -2.850 1.00 0.00 H new ATOM 0 HG12 VAL B 126 2.699 7.326 -3.139 1.00 0.00 H new ATOM 0 HG13 VAL B 126 4.158 7.971 -3.928 1.00 0.00 H new ATOM 0 HG21 VAL B 126 5.972 7.682 -1.444 1.00 0.00 H new ATOM 0 HG22 VAL B 126 5.927 9.143 -2.460 1.00 0.00 H new ATOM 0 HG23 VAL B 126 5.626 9.266 -0.711 1.00 0.00 H new ATOM 856 N LYS B 127 1.154 9.489 -0.945 1.00 0.00 N ATOM 857 CA LYS B 127 -0.285 9.282 -0.857 1.00 0.00 C ATOM 858 C LYS B 127 -1.025 10.501 -1.390 1.00 0.00 C ATOM 859 O LYS B 127 -2.044 10.374 -2.069 1.00 0.00 O ATOM 860 CB LYS B 127 -0.694 9.003 0.592 1.00 0.00 C ATOM 861 CG LYS B 127 -1.519 7.736 0.758 1.00 0.00 C ATOM 862 CD LYS B 127 -1.004 6.877 1.904 1.00 0.00 C ATOM 863 CE LYS B 127 -2.133 6.429 2.818 1.00 0.00 C ATOM 864 NZ LYS B 127 -1.627 5.665 3.992 1.00 0.00 N ATOM 0 H LYS B 127 1.622 9.585 -0.044 1.00 0.00 H new ATOM 0 HA LYS B 127 -0.552 8.418 -1.466 1.00 0.00 H new ATOM 0 HB2 LYS B 127 0.204 8.925 1.206 1.00 0.00 H new ATOM 0 HB3 LYS B 127 -1.266 9.851 0.969 1.00 0.00 H new ATOM 0 HG2 LYS B 127 -2.560 8.001 0.941 1.00 0.00 H new ATOM 0 HG3 LYS B 127 -1.494 7.161 -0.168 1.00 0.00 H new ATOM 0 HD2 LYS B 127 -0.491 6.003 1.503 1.00 0.00 H new ATOM 0 HD3 LYS B 127 -0.270 7.440 2.480 1.00 0.00 H new ATOM 0 HE2 LYS B 127 -2.688 7.301 3.164 1.00 0.00 H new ATOM 0 HE3 LYS B 127 -2.832 5.810 2.255 1.00 0.00 H new ATOM 0 HZ1 LYS B 127 -2.428 5.378 4.590 1.00 0.00 H new ATOM 0 HZ2 LYS B 127 -1.119 4.819 3.663 1.00 0.00 H new ATOM 0 HZ3 LYS B 127 -0.980 6.264 4.544 1.00 0.00 H new ATOM 878 N ALA B 128 -0.493 11.682 -1.094 1.00 0.00 N ATOM 879 CA ALA B 128 -1.093 12.922 -1.562 1.00 0.00 C ATOM 880 C ALA B 128 -0.905 13.061 -3.067 1.00 0.00 C ATOM 881 O ALA B 128 -1.694 13.714 -3.750 1.00 0.00 O ATOM 882 CB ALA B 128 -0.482 14.111 -0.839 1.00 0.00 C ATOM 0 H ALA B 128 0.350 11.805 -0.534 1.00 0.00 H new ATOM 0 HA ALA B 128 -2.161 12.898 -1.345 1.00 0.00 H new ATOM 0 HB1 ALA B 128 -0.941 15.031 -1.200 1.00 0.00 H new ATOM 0 HB2 ALA B 128 -0.657 14.014 0.233 1.00 0.00 H new ATOM 0 HB3 ALA B 128 0.591 14.141 -1.030 1.00 0.00 H new ATOM 888 N LYS B 129 0.150 12.430 -3.576 1.00 0.00 N ATOM 889 CA LYS B 129 0.457 12.462 -4.997 1.00 0.00 C ATOM 890 C LYS B 129 -0.556 11.642 -5.784 1.00 0.00 C ATOM 891 O LYS B 129 -1.144 12.123 -6.752 1.00 0.00 O ATOM 892 CB LYS B 129 1.864 11.916 -5.230 1.00 0.00 C ATOM 893 CG LYS B 129 2.466 12.324 -6.561 1.00 0.00 C ATOM 894 CD LYS B 129 3.954 12.017 -6.608 1.00 0.00 C ATOM 895 CE LYS B 129 4.781 13.281 -6.780 1.00 0.00 C ATOM 896 NZ LYS B 129 5.181 13.495 -8.198 1.00 0.00 N ATOM 0 H LYS B 129 0.809 11.887 -3.018 1.00 0.00 H new ATOM 0 HA LYS B 129 0.407 13.494 -5.343 1.00 0.00 H new ATOM 0 HB2 LYS B 129 2.515 12.260 -4.426 1.00 0.00 H new ATOM 0 HB3 LYS B 129 1.836 10.828 -5.173 1.00 0.00 H new ATOM 0 HG2 LYS B 129 1.958 11.798 -7.369 1.00 0.00 H new ATOM 0 HG3 LYS B 129 2.306 13.390 -6.724 1.00 0.00 H new ATOM 0 HD2 LYS B 129 4.251 11.510 -5.690 1.00 0.00 H new ATOM 0 HD3 LYS B 129 4.159 11.333 -7.431 1.00 0.00 H new ATOM 0 HE2 LYS B 129 4.208 14.140 -6.431 1.00 0.00 H new ATOM 0 HE3 LYS B 129 5.673 13.219 -6.157 1.00 0.00 H new ATOM 0 HZ1 LYS B 129 6.055 14.058 -8.231 1.00 0.00 H new ATOM 0 HZ2 LYS B 129 5.344 12.575 -8.655 1.00 0.00 H new ATOM 0 HZ3 LYS B 129 4.424 14.002 -8.700 1.00 0.00 H new ATOM 910 N ILE B 130 -0.759 10.400 -5.354 1.00 0.00 N ATOM 911 CA ILE B 130 -1.708 9.512 -6.012 1.00 0.00 C ATOM 912 C ILE B 130 -3.096 10.142 -6.040 1.00 0.00 C ATOM 913 O ILE B 130 -3.861 9.948 -6.984 1.00 0.00 O ATOM 914 CB ILE B 130 -1.784 8.144 -5.303 1.00 0.00 C ATOM 915 CG1 ILE B 130 -0.391 7.521 -5.195 1.00 0.00 C ATOM 916 CG2 ILE B 130 -2.729 7.211 -6.046 1.00 0.00 C ATOM 917 CD1 ILE B 130 -0.219 6.633 -3.982 1.00 0.00 C ATOM 0 H ILE B 130 -0.279 9.988 -4.554 1.00 0.00 H new ATOM 0 HA ILE B 130 -1.356 9.357 -7.032 1.00 0.00 H new ATOM 0 HB ILE B 130 -2.173 8.297 -4.296 1.00 0.00 H new ATOM 0 HG12 ILE B 130 -0.192 6.937 -6.094 1.00 0.00 H new ATOM 0 HG13 ILE B 130 0.353 8.317 -5.161 1.00 0.00 H new ATOM 0 HG21 ILE B 130 -2.771 6.251 -5.532 1.00 0.00 H new ATOM 0 HG22 ILE B 130 -3.726 7.651 -6.075 1.00 0.00 H new ATOM 0 HG23 ILE B 130 -2.368 7.063 -7.064 1.00 0.00 H new ATOM 0 HD11 ILE B 130 0.792 6.226 -3.970 1.00 0.00 H new ATOM 0 HD12 ILE B 130 -0.386 7.217 -3.077 1.00 0.00 H new ATOM 0 HD13 ILE B 130 -0.939 5.816 -4.024 1.00 0.00 H new ATOM 929 N GLN B 131 -3.405 10.907 -4.998 1.00 0.00 N ATOM 930 CA GLN B 131 -4.693 11.580 -4.898 1.00 0.00 C ATOM 931 C GLN B 131 -4.820 12.655 -5.972 1.00 0.00 C ATOM 932 O GLN B 131 -5.843 12.756 -6.648 1.00 0.00 O ATOM 933 CB GLN B 131 -4.857 12.208 -3.513 1.00 0.00 C ATOM 934 CG GLN B 131 -6.278 12.138 -2.977 1.00 0.00 C ATOM 935 CD GLN B 131 -7.005 13.465 -3.077 1.00 0.00 C ATOM 936 OE1 GLN B 131 -7.210 13.993 -4.171 1.00 0.00 O ATOM 937 NE2 GLN B 131 -7.398 14.013 -1.933 1.00 0.00 N ATOM 0 H GLN B 131 -2.779 11.076 -4.210 1.00 0.00 H new ATOM 0 HA GLN B 131 -5.479 10.840 -5.048 1.00 0.00 H new ATOM 0 HB2 GLN B 131 -4.189 11.705 -2.814 1.00 0.00 H new ATOM 0 HB3 GLN B 131 -4.545 13.252 -3.557 1.00 0.00 H new ATOM 0 HG2 GLN B 131 -6.834 11.381 -3.530 1.00 0.00 H new ATOM 0 HG3 GLN B 131 -6.254 11.819 -1.935 1.00 0.00 H new ATOM 0 HE21 GLN B 131 -7.207 13.541 -1.049 1.00 0.00 H new ATOM 0 HE22 GLN B 131 -7.891 14.906 -1.938 1.00 0.00 H new ATOM 946 N ASP B 132 -3.772 13.455 -6.124 1.00 0.00 N ATOM 947 CA ASP B 132 -3.764 14.522 -7.117 1.00 0.00 C ATOM 948 C ASP B 132 -3.799 13.955 -8.535 1.00 0.00 C ATOM 949 O ASP B 132 -4.135 14.661 -9.486 1.00 0.00 O ATOM 950 CB ASP B 132 -2.525 15.402 -6.939 1.00 0.00 C ATOM 951 CG ASP B 132 -2.830 16.875 -7.128 1.00 0.00 C ATOM 952 OD1 ASP B 132 -3.247 17.256 -8.242 1.00 0.00 O ATOM 953 OD2 ASP B 132 -2.650 17.648 -6.163 1.00 0.00 O ATOM 0 H ASP B 132 -2.917 13.385 -5.573 1.00 0.00 H new ATOM 0 HA ASP B 132 -4.659 15.127 -6.967 1.00 0.00 H new ATOM 0 HB2 ASP B 132 -2.111 15.244 -5.943 1.00 0.00 H new ATOM 0 HB3 ASP B 132 -1.761 15.097 -7.654 1.00 0.00 H new ATOM 958 N LYS B 133 -3.447 12.679 -8.673 1.00 0.00 N ATOM 959 CA LYS B 133 -3.436 12.027 -9.978 1.00 0.00 C ATOM 960 C LYS B 133 -4.743 11.278 -10.230 1.00 0.00 C ATOM 961 O LYS B 133 -5.330 11.387 -11.300 1.00 0.00 O ATOM 962 CB LYS B 133 -2.252 11.062 -10.070 1.00 0.00 C ATOM 963 CG LYS B 133 -1.290 11.394 -11.200 1.00 0.00 C ATOM 964 CD LYS B 133 -1.891 11.067 -12.560 1.00 0.00 C ATOM 965 CE LYS B 133 -0.813 10.756 -13.580 1.00 0.00 C ATOM 966 NZ LYS B 133 -1.353 10.745 -14.970 1.00 0.00 N ATOM 0 H LYS B 133 -3.166 12.078 -7.898 1.00 0.00 H new ATOM 0 HA LYS B 133 -3.334 12.797 -10.743 1.00 0.00 H new ATOM 0 HB2 LYS B 133 -1.709 11.074 -9.125 1.00 0.00 H new ATOM 0 HB3 LYS B 133 -2.628 10.049 -10.209 1.00 0.00 H new ATOM 0 HG2 LYS B 133 -1.032 12.452 -11.160 1.00 0.00 H new ATOM 0 HG3 LYS B 133 -0.364 10.835 -11.067 1.00 0.00 H new ATOM 0 HD2 LYS B 133 -2.563 10.214 -12.467 1.00 0.00 H new ATOM 0 HD3 LYS B 133 -2.490 11.909 -12.907 1.00 0.00 H new ATOM 0 HE2 LYS B 133 -0.017 11.497 -13.505 1.00 0.00 H new ATOM 0 HE3 LYS B 133 -0.368 9.787 -13.355 1.00 0.00 H new ATOM 0 HZ1 LYS B 133 -0.586 10.529 -15.639 1.00 0.00 H new ATOM 0 HZ2 LYS B 133 -2.095 10.021 -15.048 1.00 0.00 H new ATOM 0 HZ3 LYS B 133 -1.755 11.678 -15.194 1.00 0.00 H new ATOM 980 N GLU B 134 -5.188 10.513 -9.240 1.00 0.00 N ATOM 981 CA GLU B 134 -6.420 9.742 -9.365 1.00 0.00 C ATOM 982 C GLU B 134 -7.573 10.419 -8.630 1.00 0.00 C ATOM 983 O GLU B 134 -8.659 10.591 -9.183 1.00 0.00 O ATOM 984 CB GLU B 134 -6.213 8.326 -8.824 1.00 0.00 C ATOM 985 CG GLU B 134 -6.041 7.278 -9.911 1.00 0.00 C ATOM 986 CD GLU B 134 -6.727 5.969 -9.573 1.00 0.00 C ATOM 987 OE1 GLU B 134 -7.970 5.963 -9.452 1.00 0.00 O ATOM 988 OE2 GLU B 134 -6.020 4.949 -9.428 1.00 0.00 O ATOM 0 H GLU B 134 -4.715 10.410 -8.342 1.00 0.00 H new ATOM 0 HA GLU B 134 -6.677 9.688 -10.423 1.00 0.00 H new ATOM 0 HB2 GLU B 134 -5.334 8.317 -8.180 1.00 0.00 H new ATOM 0 HB3 GLU B 134 -7.066 8.055 -8.202 1.00 0.00 H new ATOM 0 HG2 GLU B 134 -6.443 7.663 -10.848 1.00 0.00 H new ATOM 0 HG3 GLU B 134 -4.978 7.096 -10.070 1.00 0.00 H new ATOM 995 N GLY B 135 -7.331 10.798 -7.379 1.00 0.00 N ATOM 996 CA GLY B 135 -8.361 11.447 -6.589 1.00 0.00 C ATOM 997 C GLY B 135 -8.871 10.561 -5.470 1.00 0.00 C ATOM 998 O GLY B 135 -10.030 10.640 -5.087 1.00 0.00 O ATOM 0 H GLY B 135 -6.441 10.667 -6.899 1.00 0.00 H new ATOM 0 HA2 GLY B 135 -7.964 12.370 -6.166 1.00 0.00 H new ATOM 0 HA3 GLY B 135 -9.192 11.725 -7.237 1.00 0.00 H new ATOM 1002 N ILE B 136 -7.992 9.712 -4.947 1.00 0.00 N ATOM 1003 CA ILE B 136 -8.355 8.804 -3.866 1.00 0.00 C ATOM 1004 C ILE B 136 -7.795 9.287 -2.529 1.00 0.00 C ATOM 1005 O ILE B 136 -6.588 9.487 -2.394 1.00 0.00 O ATOM 1006 CB ILE B 136 -7.835 7.379 -4.139 1.00 0.00 C ATOM 1007 CG1 ILE B 136 -8.239 6.926 -5.544 1.00 0.00 C ATOM 1008 CG2 ILE B 136 -8.364 6.411 -3.091 1.00 0.00 C ATOM 1009 CD1 ILE B 136 -7.753 5.536 -5.893 1.00 0.00 C ATOM 0 H ILE B 136 -7.023 9.634 -5.255 1.00 0.00 H new ATOM 0 HA ILE B 136 -9.444 8.787 -3.816 1.00 0.00 H new ATOM 0 HB ILE B 136 -6.747 7.388 -4.079 1.00 0.00 H new ATOM 0 HG12 ILE B 136 -9.325 6.954 -5.628 1.00 0.00 H new ATOM 0 HG13 ILE B 136 -7.845 7.634 -6.273 1.00 0.00 H new ATOM 0 HG21 ILE B 136 -7.988 5.409 -3.298 1.00 0.00 H new ATOM 0 HG22 ILE B 136 -8.030 6.727 -2.103 1.00 0.00 H new ATOM 0 HG23 ILE B 136 -9.454 6.403 -3.121 1.00 0.00 H new ATOM 0 HD11 ILE B 136 -8.075 5.281 -6.902 1.00 0.00 H new ATOM 0 HD12 ILE B 136 -6.665 5.508 -5.842 1.00 0.00 H new ATOM 0 HD13 ILE B 136 -8.168 4.817 -5.187 1.00 0.00 H new ATOM 1021 N PRO B 137 -8.661 9.479 -1.515 1.00 0.00 N ATOM 1022 CA PRO B 137 -8.230 9.938 -0.192 1.00 0.00 C ATOM 1023 C PRO B 137 -7.138 9.047 0.397 1.00 0.00 C ATOM 1024 O PRO B 137 -7.240 7.822 0.357 1.00 0.00 O ATOM 1025 CB PRO B 137 -9.502 9.863 0.666 1.00 0.00 C ATOM 1026 CG PRO B 137 -10.480 9.065 -0.131 1.00 0.00 C ATOM 1027 CD PRO B 137 -10.110 9.266 -1.572 1.00 0.00 C ATOM 0 HA PRO B 137 -7.799 10.938 -0.236 1.00 0.00 H new ATOM 0 HB2 PRO B 137 -9.299 9.388 1.626 1.00 0.00 H new ATOM 0 HB3 PRO B 137 -9.890 10.859 0.879 1.00 0.00 H new ATOM 0 HG2 PRO B 137 -10.433 8.010 0.139 1.00 0.00 H new ATOM 0 HG3 PRO B 137 -11.500 9.398 0.059 1.00 0.00 H new ATOM 0 HD2 PRO B 137 -10.367 8.398 -2.179 1.00 0.00 H new ATOM 0 HD3 PRO B 137 -10.627 10.122 -2.006 1.00 0.00 H new ATOM 1035 N PRO B 138 -6.074 9.652 0.956 1.00 0.00 N ATOM 1036 CA PRO B 138 -4.962 8.904 1.555 1.00 0.00 C ATOM 1037 C PRO B 138 -5.386 8.136 2.798 1.00 0.00 C ATOM 1038 O PRO B 138 -4.890 7.043 3.071 1.00 0.00 O ATOM 1039 CB PRO B 138 -3.957 9.995 1.930 1.00 0.00 C ATOM 1040 CG PRO B 138 -4.773 11.232 2.068 1.00 0.00 C ATOM 1041 CD PRO B 138 -5.871 11.110 1.053 1.00 0.00 C ATOM 0 HA PRO B 138 -4.565 8.154 0.871 1.00 0.00 H new ATOM 0 HB2 PRO B 138 -3.442 9.755 2.860 1.00 0.00 H new ATOM 0 HB3 PRO B 138 -3.192 10.109 1.162 1.00 0.00 H new ATOM 0 HG2 PRO B 138 -5.179 11.322 3.075 1.00 0.00 H new ATOM 0 HG3 PRO B 138 -4.169 12.121 1.887 1.00 0.00 H new ATOM 0 HD2 PRO B 138 -6.777 11.623 1.375 1.00 0.00 H new ATOM 0 HD3 PRO B 138 -5.584 11.542 0.094 1.00 0.00 H new ATOM 1049 N ASP B 139 -6.306 8.724 3.547 1.00 0.00 N ATOM 1050 CA ASP B 139 -6.809 8.110 4.770 1.00 0.00 C ATOM 1051 C ASP B 139 -7.653 6.883 4.452 1.00 0.00 C ATOM 1052 O ASP B 139 -7.631 5.894 5.184 1.00 0.00 O ATOM 1053 CB ASP B 139 -7.635 9.119 5.570 1.00 0.00 C ATOM 1054 CG ASP B 139 -6.794 9.896 6.564 1.00 0.00 C ATOM 1055 OD1 ASP B 139 -5.772 9.351 7.031 1.00 0.00 O ATOM 1056 OD2 ASP B 139 -7.158 11.050 6.876 1.00 0.00 O ATOM 0 H ASP B 139 -6.722 9.630 3.330 1.00 0.00 H new ATOM 0 HA ASP B 139 -5.954 7.796 5.369 1.00 0.00 H new ATOM 0 HB2 ASP B 139 -8.117 9.815 4.884 1.00 0.00 H new ATOM 0 HB3 ASP B 139 -8.429 8.594 6.102 1.00 0.00 H new ATOM 1061 N GLN B 140 -8.395 6.955 3.354 1.00 0.00 N ATOM 1062 CA GLN B 140 -9.246 5.850 2.935 1.00 0.00 C ATOM 1063 C GLN B 140 -8.424 4.754 2.265 1.00 0.00 C ATOM 1064 O GLN B 140 -8.832 3.594 2.236 1.00 0.00 O ATOM 1065 CB GLN B 140 -10.330 6.346 1.978 1.00 0.00 C ATOM 1066 CG GLN B 140 -11.610 5.534 2.040 1.00 0.00 C ATOM 1067 CD GLN B 140 -12.440 5.663 0.781 1.00 0.00 C ATOM 1068 OE1 GLN B 140 -12.300 4.879 -0.157 1.00 0.00 O ATOM 1069 NE2 GLN B 140 -13.320 6.657 0.754 1.00 0.00 N ATOM 0 H GLN B 140 -8.424 7.767 2.738 1.00 0.00 H new ATOM 0 HA GLN B 140 -9.720 5.433 3.824 1.00 0.00 H new ATOM 0 HB2 GLN B 140 -10.558 7.387 2.208 1.00 0.00 H new ATOM 0 HB3 GLN B 140 -9.943 6.322 0.959 1.00 0.00 H new ATOM 0 HG2 GLN B 140 -11.363 4.485 2.203 1.00 0.00 H new ATOM 0 HG3 GLN B 140 -12.201 5.859 2.896 1.00 0.00 H new ATOM 0 HE21 GLN B 140 -13.405 7.285 1.553 1.00 0.00 H new ATOM 0 HE22 GLN B 140 -13.911 6.792 -0.066 1.00 0.00 H new ATOM 1078 N GLN B 141 -7.265 5.125 1.724 1.00 0.00 N ATOM 1079 CA GLN B 141 -6.401 4.158 1.057 1.00 0.00 C ATOM 1080 C GLN B 141 -5.209 3.785 1.924 1.00 0.00 C ATOM 1081 O GLN B 141 -4.881 4.481 2.885 1.00 0.00 O ATOM 1082 CB GLN B 141 -5.900 4.704 -0.278 1.00 0.00 C ATOM 1083 CG GLN B 141 -5.217 6.058 -0.170 1.00 0.00 C ATOM 1084 CD GLN B 141 -3.750 6.005 -0.550 1.00 0.00 C ATOM 1085 OE1 GLN B 141 -2.959 5.299 0.076 1.00 0.00 O ATOM 1086 NE2 GLN B 141 -3.379 6.753 -1.583 1.00 0.00 N ATOM 0 H GLN B 141 -6.906 6.080 1.735 1.00 0.00 H new ATOM 0 HA GLN B 141 -7.000 3.264 0.880 1.00 0.00 H new ATOM 0 HB2 GLN B 141 -5.202 3.989 -0.713 1.00 0.00 H new ATOM 0 HB3 GLN B 141 -6.742 4.786 -0.965 1.00 0.00 H new ATOM 0 HG2 GLN B 141 -5.730 6.772 -0.815 1.00 0.00 H new ATOM 0 HG3 GLN B 141 -5.311 6.427 0.851 1.00 0.00 H new ATOM 0 HE21 GLN B 141 -4.068 7.323 -2.073 1.00 0.00 H new ATOM 0 HE22 GLN B 141 -2.405 6.757 -1.886 1.00 0.00 H new ATOM 1095 N ARG B 142 -4.558 2.685 1.566 1.00 0.00 N ATOM 1096 CA ARG B 142 -3.390 2.217 2.295 1.00 0.00 C ATOM 1097 C ARG B 142 -2.393 1.558 1.347 1.00 0.00 C ATOM 1098 O ARG B 142 -2.687 0.533 0.733 1.00 0.00 O ATOM 1099 CB ARG B 142 -3.791 1.240 3.406 1.00 0.00 C ATOM 1100 CG ARG B 142 -5.085 0.488 3.130 1.00 0.00 C ATOM 1101 CD ARG B 142 -6.295 1.209 3.707 1.00 0.00 C ATOM 1102 NE ARG B 142 -6.048 1.715 5.057 1.00 0.00 N ATOM 1103 CZ ARG B 142 -6.116 0.965 6.154 1.00 0.00 C ATOM 1104 NH1 ARG B 142 -6.421 -0.324 6.069 1.00 0.00 N ATOM 1105 NH2 ARG B 142 -5.877 1.505 7.342 1.00 0.00 N ATOM 0 H ARG B 142 -4.822 2.100 0.773 1.00 0.00 H new ATOM 0 HA ARG B 142 -2.914 3.083 2.756 1.00 0.00 H new ATOM 0 HB2 ARG B 142 -2.987 0.518 3.549 1.00 0.00 H new ATOM 0 HB3 ARG B 142 -3.895 1.791 4.341 1.00 0.00 H new ATOM 0 HG2 ARG B 142 -5.213 0.368 2.054 1.00 0.00 H new ATOM 0 HG3 ARG B 142 -5.021 -0.513 3.557 1.00 0.00 H new ATOM 0 HD2 ARG B 142 -6.566 2.039 3.054 1.00 0.00 H new ATOM 0 HD3 ARG B 142 -7.146 0.528 3.727 1.00 0.00 H new ATOM 0 HE ARG B 142 -5.810 2.701 5.164 1.00 0.00 H new ATOM 0 HH11 ARG B 142 -6.605 -0.746 5.159 1.00 0.00 H new ATOM 0 HH12 ARG B 142 -6.471 -0.893 6.914 1.00 0.00 H new ATOM 0 HH21 ARG B 142 -5.641 2.495 7.414 1.00 0.00 H new ATOM 0 HH22 ARG B 142 -5.929 0.930 8.183 1.00 0.00 H new ATOM 1119 N LEU B 143 -1.217 2.163 1.227 1.00 0.00 N ATOM 1120 CA LEU B 143 -0.175 1.649 0.347 1.00 0.00 C ATOM 1121 C LEU B 143 0.577 0.488 0.990 1.00 0.00 C ATOM 1122 O LEU B 143 1.208 0.642 2.036 1.00 0.00 O ATOM 1123 CB LEU B 143 0.806 2.765 -0.016 1.00 0.00 C ATOM 1124 CG LEU B 143 0.159 4.069 -0.486 1.00 0.00 C ATOM 1125 CD1 LEU B 143 1.187 5.189 -0.531 1.00 0.00 C ATOM 1126 CD2 LEU B 143 -0.487 3.881 -1.850 1.00 0.00 C ATOM 0 H LEU B 143 -0.961 3.013 1.730 1.00 0.00 H new ATOM 0 HA LEU B 143 -0.657 1.280 -0.558 1.00 0.00 H new ATOM 0 HB2 LEU B 143 1.428 2.979 0.854 1.00 0.00 H new ATOM 0 HB3 LEU B 143 1.470 2.403 -0.801 1.00 0.00 H new ATOM 0 HG LEU B 143 -0.618 4.345 0.227 1.00 0.00 H new ATOM 0 HD11 LEU B 143 0.709 6.109 -0.868 1.00 0.00 H new ATOM 0 HD12 LEU B 143 1.604 5.340 0.465 1.00 0.00 H new ATOM 0 HD13 LEU B 143 1.986 4.922 -1.222 1.00 0.00 H new ATOM 0 HD21 LEU B 143 -0.942 4.818 -2.169 1.00 0.00 H new ATOM 0 HD22 LEU B 143 0.271 3.581 -2.573 1.00 0.00 H new ATOM 0 HD23 LEU B 143 -1.253 3.108 -1.786 1.00 0.00 H new ATOM 1138 N ILE B 144 0.509 -0.669 0.345 1.00 0.00 N ATOM 1139 CA ILE B 144 1.186 -1.867 0.830 1.00 0.00 C ATOM 1140 C ILE B 144 2.596 -1.954 0.256 1.00 0.00 C ATOM 1141 O ILE B 144 2.808 -1.690 -0.927 1.00 0.00 O ATOM 1142 CB ILE B 144 0.409 -3.141 0.446 1.00 0.00 C ATOM 1143 CG1 ILE B 144 -1.065 -3.009 0.840 1.00 0.00 C ATOM 1144 CG2 ILE B 144 1.032 -4.362 1.101 1.00 0.00 C ATOM 1145 CD1 ILE B 144 -1.276 -2.651 2.295 1.00 0.00 C ATOM 0 H ILE B 144 -0.012 -0.805 -0.522 1.00 0.00 H new ATOM 0 HA ILE B 144 1.235 -1.796 1.917 1.00 0.00 H new ATOM 0 HB ILE B 144 0.465 -3.267 -0.635 1.00 0.00 H new ATOM 0 HG12 ILE B 144 -1.532 -2.247 0.216 1.00 0.00 H new ATOM 0 HG13 ILE B 144 -1.574 -3.949 0.629 1.00 0.00 H new ATOM 0 HG21 ILE B 144 0.470 -5.253 0.819 1.00 0.00 H new ATOM 0 HG22 ILE B 144 2.066 -4.465 0.770 1.00 0.00 H new ATOM 0 HG23 ILE B 144 1.008 -4.246 2.185 1.00 0.00 H new ATOM 0 HD11 ILE B 144 -2.344 -2.575 2.500 1.00 0.00 H new ATOM 0 HD12 ILE B 144 -0.840 -3.424 2.927 1.00 0.00 H new ATOM 0 HD13 ILE B 144 -0.797 -1.695 2.508 1.00 0.00 H new ATOM 1157 N PHE B 145 3.560 -2.315 1.097 1.00 0.00 N ATOM 1158 CA PHE B 145 4.947 -2.420 0.654 1.00 0.00 C ATOM 1159 C PHE B 145 5.563 -3.765 1.031 1.00 0.00 C ATOM 1160 O PHE B 145 5.996 -3.968 2.166 1.00 0.00 O ATOM 1161 CB PHE B 145 5.779 -1.279 1.241 1.00 0.00 C ATOM 1162 CG PHE B 145 7.220 -1.303 0.813 1.00 0.00 C ATOM 1163 CD1 PHE B 145 7.563 -1.134 -0.519 1.00 0.00 C ATOM 1164 CD2 PHE B 145 8.229 -1.495 1.742 1.00 0.00 C ATOM 1165 CE1 PHE B 145 8.887 -1.156 -0.916 1.00 0.00 C ATOM 1166 CE2 PHE B 145 9.554 -1.519 1.352 1.00 0.00 C ATOM 1167 CZ PHE B 145 9.884 -1.349 0.021 1.00 0.00 C ATOM 0 H PHE B 145 3.409 -2.538 2.081 1.00 0.00 H new ATOM 0 HA PHE B 145 4.950 -2.347 -0.434 1.00 0.00 H new ATOM 0 HB2 PHE B 145 5.336 -0.328 0.945 1.00 0.00 H new ATOM 0 HB3 PHE B 145 5.731 -1.328 2.329 1.00 0.00 H new ATOM 0 HD1 PHE B 145 6.787 -0.983 -1.255 1.00 0.00 H new ATOM 0 HD2 PHE B 145 7.977 -1.628 2.784 1.00 0.00 H new ATOM 0 HE1 PHE B 145 9.142 -1.023 -1.957 1.00 0.00 H new ATOM 0 HE2 PHE B 145 10.331 -1.670 2.087 1.00 0.00 H new ATOM 0 HZ PHE B 145 10.919 -1.367 -0.286 1.00 0.00 H new ATOM 1177 N ALA B 146 5.612 -4.670 0.058 1.00 0.00 N ATOM 1178 CA ALA B 146 6.190 -5.999 0.252 1.00 0.00 C ATOM 1179 C ALA B 146 5.782 -6.624 1.585 1.00 0.00 C ATOM 1180 O ALA B 146 6.606 -7.230 2.270 1.00 0.00 O ATOM 1181 CB ALA B 146 7.706 -5.927 0.148 1.00 0.00 C ATOM 0 H ALA B 146 5.255 -4.506 -0.883 1.00 0.00 H new ATOM 0 HA ALA B 146 5.798 -6.641 -0.536 1.00 0.00 H new ATOM 0 HB1 ALA B 146 8.128 -6.921 0.294 1.00 0.00 H new ATOM 0 HB2 ALA B 146 7.986 -5.555 -0.838 1.00 0.00 H new ATOM 0 HB3 ALA B 146 8.092 -5.253 0.913 1.00 0.00 H new ATOM 1187 N GLY B 147 4.509 -6.490 1.944 1.00 0.00 N ATOM 1188 CA GLY B 147 4.036 -7.065 3.185 1.00 0.00 C ATOM 1189 C GLY B 147 4.223 -6.148 4.375 1.00 0.00 C ATOM 1190 O GLY B 147 4.480 -6.614 5.486 1.00 0.00 O ATOM 0 H GLY B 147 3.802 -5.996 1.400 1.00 0.00 H new ATOM 0 HA2 GLY B 147 2.978 -7.309 3.085 1.00 0.00 H new ATOM 0 HA3 GLY B 147 4.564 -8.001 3.369 1.00 0.00 H new ATOM 1194 N LYS B 148 4.099 -4.846 4.156 1.00 0.00 N ATOM 1195 CA LYS B 148 4.258 -3.890 5.230 1.00 0.00 C ATOM 1196 C LYS B 148 3.328 -2.702 5.054 1.00 0.00 C ATOM 1197 O LYS B 148 3.203 -2.146 3.963 1.00 0.00 O ATOM 1198 CB LYS B 148 5.693 -3.401 5.285 1.00 0.00 C ATOM 1199 CG LYS B 148 6.715 -4.512 5.460 1.00 0.00 C ATOM 1200 CD LYS B 148 8.069 -3.962 5.879 1.00 0.00 C ATOM 1201 CE LYS B 148 8.279 -4.082 7.379 1.00 0.00 C ATOM 1202 NZ LYS B 148 9.002 -5.333 7.741 1.00 0.00 N ATOM 0 H LYS B 148 3.890 -4.434 3.247 1.00 0.00 H new ATOM 0 HA LYS B 148 4.004 -4.393 6.163 1.00 0.00 H new ATOM 0 HB2 LYS B 148 5.916 -2.856 4.368 1.00 0.00 H new ATOM 0 HB3 LYS B 148 5.794 -2.694 6.108 1.00 0.00 H new ATOM 0 HG2 LYS B 148 6.360 -5.219 6.210 1.00 0.00 H new ATOM 0 HG3 LYS B 148 6.818 -5.063 4.525 1.00 0.00 H new ATOM 0 HD2 LYS B 148 8.859 -4.500 5.356 1.00 0.00 H new ATOM 0 HD3 LYS B 148 8.146 -2.916 5.582 1.00 0.00 H new ATOM 0 HE2 LYS B 148 8.843 -3.220 7.737 1.00 0.00 H new ATOM 0 HE3 LYS B 148 7.313 -4.062 7.883 1.00 0.00 H new ATOM 0 HZ1 LYS B 148 9.125 -5.377 8.773 1.00 0.00 H new ATOM 0 HZ2 LYS B 148 8.452 -6.156 7.423 1.00 0.00 H new ATOM 0 HZ3 LYS B 148 9.934 -5.341 7.281 1.00 0.00 H new ATOM 1216 N GLN B 149 2.690 -2.313 6.144 1.00 0.00 N ATOM 1217 CA GLN B 149 1.776 -1.179 6.133 1.00 0.00 C ATOM 1218 C GLN B 149 2.546 0.130 6.267 1.00 0.00 C ATOM 1219 O GLN B 149 2.956 0.509 7.364 1.00 0.00 O ATOM 1220 CB GLN B 149 0.771 -1.306 7.276 1.00 0.00 C ATOM 1221 CG GLN B 149 -0.538 -0.578 7.023 1.00 0.00 C ATOM 1222 CD GLN B 149 -1.601 -0.943 8.038 1.00 0.00 C ATOM 1223 OE1 GLN B 149 -1.793 -2.240 8.245 1.00 0.00 O flip ATOM 1224 NE2 GLN B 149 -2.240 -0.073 8.628 1.00 0.00 N flip ATOM 0 H GLN B 149 2.787 -2.766 7.053 1.00 0.00 H new ATOM 0 HA GLN B 149 1.242 -1.175 5.183 1.00 0.00 H new ATOM 0 HB2 GLN B 149 0.562 -2.362 7.448 1.00 0.00 H new ATOM 0 HB3 GLN B 149 1.222 -0.917 8.189 1.00 0.00 H new ATOM 0 HG2 GLN B 149 -0.365 0.498 7.052 1.00 0.00 H new ATOM 0 HG3 GLN B 149 -0.897 -0.817 6.022 1.00 0.00 H new ATOM 0 HE21 GLN B 149 -2.058 0.912 8.436 1.00 0.00 H new ATOM 0 HE22 GLN B 149 -2.952 -0.337 9.309 1.00 0.00 H new ATOM 1233 N LEU B 150 2.744 0.817 5.147 1.00 0.00 N ATOM 1234 CA LEU B 150 3.471 2.082 5.147 1.00 0.00 C ATOM 1235 C LEU B 150 2.781 3.109 6.040 1.00 0.00 C ATOM 1236 O LEU B 150 1.558 3.108 6.174 1.00 0.00 O ATOM 1237 CB LEU B 150 3.590 2.626 3.723 1.00 0.00 C ATOM 1238 CG LEU B 150 4.177 1.649 2.703 1.00 0.00 C ATOM 1239 CD1 LEU B 150 4.341 2.325 1.350 1.00 0.00 C ATOM 1240 CD2 LEU B 150 5.511 1.104 3.193 1.00 0.00 C ATOM 0 H LEU B 150 2.412 0.520 4.229 1.00 0.00 H new ATOM 0 HA LEU B 150 4.470 1.897 5.543 1.00 0.00 H new ATOM 0 HB2 LEU B 150 2.600 2.931 3.383 1.00 0.00 H new ATOM 0 HB3 LEU B 150 4.210 3.522 3.743 1.00 0.00 H new ATOM 0 HG LEU B 150 3.486 0.814 2.588 1.00 0.00 H new ATOM 0 HD11 LEU B 150 4.760 1.615 0.637 1.00 0.00 H new ATOM 0 HD12 LEU B 150 3.369 2.667 0.994 1.00 0.00 H new ATOM 0 HD13 LEU B 150 5.012 3.179 1.449 1.00 0.00 H new ATOM 0 HD21 LEU B 150 5.914 0.411 2.455 1.00 0.00 H new ATOM 0 HD22 LEU B 150 6.210 1.928 3.337 1.00 0.00 H new ATOM 0 HD23 LEU B 150 5.366 0.583 4.139 1.00 0.00 H new ATOM 1252 N GLU B 151 3.576 3.986 6.645 1.00 0.00 N ATOM 1253 CA GLU B 151 3.048 5.020 7.520 1.00 0.00 C ATOM 1254 C GLU B 151 3.174 6.388 6.866 1.00 0.00 C ATOM 1255 O GLU B 151 4.162 6.683 6.195 1.00 0.00 O ATOM 1256 CB GLU B 151 3.783 5.011 8.859 1.00 0.00 C ATOM 1257 CG GLU B 151 3.004 4.340 9.978 1.00 0.00 C ATOM 1258 CD GLU B 151 3.883 3.481 10.866 1.00 0.00 C ATOM 1259 OE1 GLU B 151 4.753 4.044 11.563 1.00 0.00 O ATOM 1260 OE2 GLU B 151 3.702 2.245 10.865 1.00 0.00 O ATOM 0 H GLU B 151 4.591 3.999 6.543 1.00 0.00 H new ATOM 0 HA GLU B 151 1.993 4.813 7.697 1.00 0.00 H new ATOM 0 HB2 GLU B 151 4.738 4.500 8.736 1.00 0.00 H new ATOM 0 HB3 GLU B 151 4.006 6.038 9.148 1.00 0.00 H new ATOM 0 HG2 GLU B 151 2.516 5.103 10.585 1.00 0.00 H new ATOM 0 HG3 GLU B 151 2.215 3.723 9.547 1.00 0.00 H new ATOM 1267 N ASP B 152 2.161 7.213 7.069 1.00 0.00 N ATOM 1268 CA ASP B 152 2.130 8.555 6.505 1.00 0.00 C ATOM 1269 C ASP B 152 3.138 9.469 7.196 1.00 0.00 C ATOM 1270 O ASP B 152 3.658 10.405 6.589 1.00 0.00 O ATOM 1271 CB ASP B 152 0.721 9.137 6.632 1.00 0.00 C ATOM 1272 CG ASP B 152 0.265 9.840 5.369 1.00 0.00 C ATOM 1273 OD1 ASP B 152 0.118 9.160 4.332 1.00 0.00 O ATOM 1274 OD2 ASP B 152 0.051 11.069 5.419 1.00 0.00 O ATOM 0 H ASP B 152 1.340 6.975 7.626 1.00 0.00 H new ATOM 0 HA ASP B 152 2.403 8.489 5.452 1.00 0.00 H new ATOM 0 HB2 ASP B 152 0.021 8.336 6.871 1.00 0.00 H new ATOM 0 HB3 ASP B 152 0.696 9.840 7.464 1.00 0.00 H new ATOM 1279 N GLY B 153 3.405 9.196 8.469 1.00 0.00 N ATOM 1280 CA GLY B 153 4.345 10.009 9.218 1.00 0.00 C ATOM 1281 C GLY B 153 5.773 9.498 9.134 1.00 0.00 C ATOM 1282 O GLY B 153 6.662 10.021 9.806 1.00 0.00 O ATOM 0 H GLY B 153 2.988 8.428 8.994 1.00 0.00 H new ATOM 0 HA2 GLY B 153 4.309 11.032 8.845 1.00 0.00 H new ATOM 0 HA3 GLY B 153 4.037 10.040 10.263 1.00 0.00 H new ATOM 1286 N ARG B 154 5.998 8.475 8.313 1.00 0.00 N ATOM 1287 CA ARG B 154 7.320 7.903 8.156 1.00 0.00 C ATOM 1288 C ARG B 154 7.942 8.324 6.833 1.00 0.00 C ATOM 1289 O ARG B 154 7.406 9.168 6.116 1.00 0.00 O ATOM 1290 CB ARG B 154 7.246 6.383 8.227 1.00 0.00 C ATOM 1291 CG ARG B 154 7.818 5.803 9.510 1.00 0.00 C ATOM 1292 CD ARG B 154 8.490 4.460 9.268 1.00 0.00 C ATOM 1293 NE ARG B 154 7.853 3.386 10.026 1.00 0.00 N ATOM 1294 CZ ARG B 154 8.255 2.117 9.995 1.00 0.00 C ATOM 1295 NH1 ARG B 154 9.290 1.760 9.245 1.00 0.00 N ATOM 1296 NH2 ARG B 154 7.619 1.203 10.715 1.00 0.00 N ATOM 0 H ARG B 154 5.276 8.029 7.748 1.00 0.00 H new ATOM 0 HA ARG B 154 7.947 8.273 8.967 1.00 0.00 H new ATOM 0 HB2 ARG B 154 6.205 6.074 8.131 1.00 0.00 H new ATOM 0 HB3 ARG B 154 7.783 5.962 7.377 1.00 0.00 H new ATOM 0 HG2 ARG B 154 8.540 6.500 9.935 1.00 0.00 H new ATOM 0 HG3 ARG B 154 7.020 5.684 10.243 1.00 0.00 H new ATOM 0 HD2 ARG B 154 8.455 4.223 8.205 1.00 0.00 H new ATOM 0 HD3 ARG B 154 9.542 4.525 9.546 1.00 0.00 H new ATOM 0 HE ARG B 154 7.053 3.622 10.614 1.00 0.00 H new ATOM 0 HH11 ARG B 154 9.782 2.459 8.689 1.00 0.00 H new ATOM 0 HH12 ARG B 154 9.594 0.786 9.225 1.00 0.00 H new ATOM 0 HH21 ARG B 154 6.822 1.472 11.292 1.00 0.00 H new ATOM 0 HH22 ARG B 154 7.926 0.231 10.692 1.00 0.00 H new ATOM 1310 N THR B 155 9.076 7.718 6.524 1.00 0.00 N ATOM 1311 CA THR B 155 9.793 8.009 5.289 1.00 0.00 C ATOM 1312 C THR B 155 9.871 6.767 4.406 1.00 0.00 C ATOM 1313 O THR B 155 9.687 5.645 4.879 1.00 0.00 O ATOM 1314 CB THR B 155 11.201 8.524 5.598 1.00 0.00 C ATOM 1315 OG1 THR B 155 11.578 8.192 6.923 1.00 0.00 O ATOM 1316 CG2 THR B 155 11.335 10.024 5.447 1.00 0.00 C ATOM 0 H THR B 155 9.524 7.017 7.114 1.00 0.00 H new ATOM 0 HA THR B 155 9.246 8.783 4.751 1.00 0.00 H new ATOM 0 HB THR B 155 11.851 8.040 4.869 1.00 0.00 H new ATOM 0 HG1 THR B 155 12.481 8.528 7.100 1.00 0.00 H new ATOM 0 HG21 THR B 155 12.357 10.323 5.681 1.00 0.00 H new ATOM 0 HG22 THR B 155 11.099 10.309 4.422 1.00 0.00 H new ATOM 0 HG23 THR B 155 10.646 10.521 6.130 1.00 0.00 H new ATOM 1324 N LEU B 156 10.148 6.974 3.124 1.00 0.00 N ATOM 1325 CA LEU B 156 10.255 5.875 2.177 1.00 0.00 C ATOM 1326 C LEU B 156 11.370 4.920 2.590 1.00 0.00 C ATOM 1327 O LEU B 156 11.176 3.706 2.646 1.00 0.00 O ATOM 1328 CB LEU B 156 10.516 6.419 0.772 1.00 0.00 C ATOM 1329 CG LEU B 156 9.268 6.608 -0.094 1.00 0.00 C ATOM 1330 CD1 LEU B 156 9.652 7.072 -1.491 1.00 0.00 C ATOM 1331 CD2 LEU B 156 8.465 5.318 -0.161 1.00 0.00 C ATOM 0 H LEU B 156 10.303 7.896 2.717 1.00 0.00 H new ATOM 0 HA LEU B 156 9.314 5.324 2.174 1.00 0.00 H new ATOM 0 HB2 LEU B 156 11.027 7.378 0.860 1.00 0.00 H new ATOM 0 HB3 LEU B 156 11.197 5.741 0.257 1.00 0.00 H new ATOM 0 HG LEU B 156 8.645 7.377 0.363 1.00 0.00 H new ATOM 0 HD11 LEU B 156 8.752 7.201 -2.092 1.00 0.00 H new ATOM 0 HD12 LEU B 156 10.184 8.021 -1.426 1.00 0.00 H new ATOM 0 HD13 LEU B 156 10.296 6.327 -1.958 1.00 0.00 H new ATOM 0 HD21 LEU B 156 7.582 5.471 -0.781 1.00 0.00 H new ATOM 0 HD22 LEU B 156 9.080 4.529 -0.594 1.00 0.00 H new ATOM 0 HD23 LEU B 156 8.158 5.028 0.844 1.00 0.00 H new ATOM 1343 N SER B 157 12.534 5.485 2.892 1.00 0.00 N ATOM 1344 CA SER B 157 13.681 4.697 3.318 1.00 0.00 C ATOM 1345 C SER B 157 13.406 4.054 4.668 1.00 0.00 C ATOM 1346 O SER B 157 13.909 2.972 4.970 1.00 0.00 O ATOM 1347 CB SER B 157 14.926 5.579 3.406 1.00 0.00 C ATOM 1348 OG SER B 157 14.965 6.290 4.631 1.00 0.00 O ATOM 0 H SER B 157 12.707 6.489 2.849 1.00 0.00 H new ATOM 0 HA SER B 157 13.855 3.912 2.582 1.00 0.00 H new ATOM 0 HB2 SER B 157 15.819 4.962 3.312 1.00 0.00 H new ATOM 0 HB3 SER B 157 14.936 6.283 2.574 1.00 0.00 H new ATOM 0 HG SER B 157 15.772 6.845 4.662 1.00 0.00 H new ATOM 1354 N ASP B 158 12.593 4.728 5.476 1.00 0.00 N ATOM 1355 CA ASP B 158 12.234 4.224 6.795 1.00 0.00 C ATOM 1356 C ASP B 158 11.661 2.815 6.691 1.00 0.00 C ATOM 1357 O ASP B 158 11.843 1.989 7.585 1.00 0.00 O ATOM 1358 CB ASP B 158 11.216 5.154 7.459 1.00 0.00 C ATOM 1359 CG ASP B 158 11.659 5.611 8.835 1.00 0.00 C ATOM 1360 OD1 ASP B 158 12.486 4.910 9.455 1.00 0.00 O ATOM 1361 OD2 ASP B 158 11.180 6.670 9.292 1.00 0.00 O ATOM 0 H ASP B 158 12.171 5.626 5.239 1.00 0.00 H new ATOM 0 HA ASP B 158 13.135 4.191 7.407 1.00 0.00 H new ATOM 0 HB2 ASP B 158 11.056 6.025 6.824 1.00 0.00 H new ATOM 0 HB3 ASP B 158 10.258 4.640 7.541 1.00 0.00 H new ATOM 1366 N TYR B 159 10.969 2.550 5.587 1.00 0.00 N ATOM 1367 CA TYR B 159 10.368 1.249 5.354 1.00 0.00 C ATOM 1368 C TYR B 159 11.259 0.380 4.466 1.00 0.00 C ATOM 1369 O TYR B 159 11.024 -0.820 4.336 1.00 0.00 O ATOM 1370 CB TYR B 159 8.991 1.423 4.718 1.00 0.00 C ATOM 1371 CG TYR B 159 7.869 1.482 5.729 1.00 0.00 C ATOM 1372 CD1 TYR B 159 7.609 2.650 6.434 1.00 0.00 C ATOM 1373 CD2 TYR B 159 7.074 0.372 5.983 1.00 0.00 C ATOM 1374 CE1 TYR B 159 6.590 2.710 7.365 1.00 0.00 C ATOM 1375 CE2 TYR B 159 6.051 0.424 6.912 1.00 0.00 C ATOM 1376 CZ TYR B 159 5.814 1.596 7.600 1.00 0.00 C ATOM 1377 OH TYR B 159 4.799 1.652 8.527 1.00 0.00 O ATOM 0 H TYR B 159 10.812 3.225 4.839 1.00 0.00 H new ATOM 0 HA TYR B 159 10.259 0.743 6.313 1.00 0.00 H new ATOM 0 HB2 TYR B 159 8.985 2.338 4.125 1.00 0.00 H new ATOM 0 HB3 TYR B 159 8.809 0.597 4.031 1.00 0.00 H new ATOM 0 HD1 TYR B 159 8.214 3.526 6.251 1.00 0.00 H new ATOM 0 HD2 TYR B 159 7.258 -0.547 5.446 1.00 0.00 H new ATOM 0 HE1 TYR B 159 6.403 3.626 7.906 1.00 0.00 H new ATOM 0 HE2 TYR B 159 5.441 -0.448 7.098 1.00 0.00 H new ATOM 0 HH TYR B 159 3.954 1.396 8.102 1.00 0.00 H new ATOM 1387 N ASN B 160 12.280 1.001 3.862 1.00 0.00 N ATOM 1388 CA ASN B 160 13.228 0.310 2.985 1.00 0.00 C ATOM 1389 C ASN B 160 12.721 0.275 1.549 1.00 0.00 C ATOM 1390 O ASN B 160 12.731 -0.769 0.897 1.00 0.00 O ATOM 1391 CB ASN B 160 13.510 -1.109 3.481 1.00 0.00 C ATOM 1392 CG ASN B 160 14.570 -1.811 2.655 1.00 0.00 C ATOM 1393 OD1 ASN B 160 14.262 -2.673 1.832 1.00 0.00 O ATOM 1394 ND2 ASN B 160 15.828 -1.445 2.872 1.00 0.00 N ATOM 0 H ASN B 160 12.470 1.997 3.969 1.00 0.00 H new ATOM 0 HA ASN B 160 14.162 0.872 3.008 1.00 0.00 H new ATOM 0 HB2 ASN B 160 13.831 -1.070 4.522 1.00 0.00 H new ATOM 0 HB3 ASN B 160 12.588 -1.690 3.454 1.00 0.00 H new ATOM 0 HD21 ASN B 160 16.584 -1.883 2.346 1.00 0.00 H new ATOM 0 HD22 ASN B 160 16.038 -0.726 3.564 1.00 0.00 H new ATOM 1401 N ILE B 161 12.289 1.431 1.063 1.00 0.00 N ATOM 1402 CA ILE B 161 11.787 1.553 -0.297 1.00 0.00 C ATOM 1403 C ILE B 161 12.854 2.160 -1.205 1.00 0.00 C ATOM 1404 O ILE B 161 13.468 3.171 -0.865 1.00 0.00 O ATOM 1405 CB ILE B 161 10.510 2.417 -0.340 1.00 0.00 C ATOM 1406 CG1 ILE B 161 9.372 1.716 0.406 1.00 0.00 C ATOM 1407 CG2 ILE B 161 10.101 2.714 -1.777 1.00 0.00 C ATOM 1408 CD1 ILE B 161 8.552 2.647 1.272 1.00 0.00 C ATOM 0 H ILE B 161 12.277 2.301 1.595 1.00 0.00 H new ATOM 0 HA ILE B 161 11.540 0.553 -0.654 1.00 0.00 H new ATOM 0 HB ILE B 161 10.722 3.366 0.153 1.00 0.00 H new ATOM 0 HG12 ILE B 161 8.715 1.235 -0.319 1.00 0.00 H new ATOM 0 HG13 ILE B 161 9.790 0.926 1.030 1.00 0.00 H new ATOM 0 HG21 ILE B 161 9.198 3.325 -1.780 1.00 0.00 H new ATOM 0 HG22 ILE B 161 10.904 3.252 -2.280 1.00 0.00 H new ATOM 0 HG23 ILE B 161 9.908 1.778 -2.301 1.00 0.00 H new ATOM 0 HD11 ILE B 161 7.764 2.081 1.770 1.00 0.00 H new ATOM 0 HD12 ILE B 161 9.196 3.109 2.021 1.00 0.00 H new ATOM 0 HD13 ILE B 161 8.104 3.422 0.650 1.00 0.00 H new ATOM 1420 N GLN B 162 13.076 1.533 -2.356 1.00 0.00 N ATOM 1421 CA GLN B 162 14.077 2.011 -3.303 1.00 0.00 C ATOM 1422 C GLN B 162 13.427 2.552 -4.572 1.00 0.00 C ATOM 1423 O GLN B 162 12.202 2.632 -4.672 1.00 0.00 O ATOM 1424 CB GLN B 162 15.052 0.885 -3.654 1.00 0.00 C ATOM 1425 CG GLN B 162 16.309 0.879 -2.799 1.00 0.00 C ATOM 1426 CD GLN B 162 16.272 -0.180 -1.715 1.00 0.00 C ATOM 1427 OE1 GLN B 162 16.835 -1.264 -1.871 1.00 0.00 O ATOM 1428 NE2 GLN B 162 15.606 0.128 -0.608 1.00 0.00 N ATOM 0 H GLN B 162 12.578 0.695 -2.655 1.00 0.00 H new ATOM 0 HA GLN B 162 14.624 2.826 -2.829 1.00 0.00 H new ATOM 0 HB2 GLN B 162 14.543 -0.072 -3.543 1.00 0.00 H new ATOM 0 HB3 GLN B 162 15.336 0.976 -4.702 1.00 0.00 H new ATOM 0 HG2 GLN B 162 17.177 0.711 -3.437 1.00 0.00 H new ATOM 0 HG3 GLN B 162 16.436 1.859 -2.340 1.00 0.00 H new ATOM 0 HE21 GLN B 162 15.154 1.038 -0.521 1.00 0.00 H new ATOM 0 HE22 GLN B 162 15.546 -0.546 0.155 1.00 0.00 H new ATOM 1437 N LYS B 163 14.259 2.921 -5.540 1.00 0.00 N ATOM 1438 CA LYS B 163 13.774 3.457 -6.807 1.00 0.00 C ATOM 1439 C LYS B 163 13.091 2.371 -7.630 1.00 0.00 C ATOM 1440 O LYS B 163 13.485 1.205 -7.587 1.00 0.00 O ATOM 1441 CB LYS B 163 14.927 4.066 -7.613 1.00 0.00 C ATOM 1442 CG LYS B 163 16.007 4.711 -6.756 1.00 0.00 C ATOM 1443 CD LYS B 163 17.249 3.836 -6.668 1.00 0.00 C ATOM 1444 CE LYS B 163 18.392 4.405 -7.493 1.00 0.00 C ATOM 1445 NZ LYS B 163 19.357 5.168 -6.654 1.00 0.00 N ATOM 0 H LYS B 163 15.275 2.859 -5.471 1.00 0.00 H new ATOM 0 HA LYS B 163 13.047 4.237 -6.582 1.00 0.00 H new ATOM 0 HB2 LYS B 163 15.380 3.287 -8.225 1.00 0.00 H new ATOM 0 HB3 LYS B 163 14.524 4.814 -8.296 1.00 0.00 H new ATOM 0 HG2 LYS B 163 16.274 5.681 -7.175 1.00 0.00 H new ATOM 0 HG3 LYS B 163 15.617 4.893 -5.754 1.00 0.00 H new ATOM 0 HD2 LYS B 163 17.560 3.747 -5.627 1.00 0.00 H new ATOM 0 HD3 LYS B 163 17.012 2.831 -7.017 1.00 0.00 H new ATOM 0 HE2 LYS B 163 18.914 3.593 -7.999 1.00 0.00 H new ATOM 0 HE3 LYS B 163 17.990 5.057 -8.268 1.00 0.00 H new ATOM 0 HZ1 LYS B 163 20.121 5.539 -7.254 1.00 0.00 H new ATOM 0 HZ2 LYS B 163 18.865 5.959 -6.191 1.00 0.00 H new ATOM 0 HZ3 LYS B 163 19.760 4.540 -5.930 1.00 0.00 H new ATOM 1459 N GLU B 164 12.066 2.760 -8.383 1.00 0.00 N ATOM 1460 CA GLU B 164 11.328 1.821 -9.219 1.00 0.00 C ATOM 1461 C GLU B 164 10.561 0.812 -8.369 1.00 0.00 C ATOM 1462 O GLU B 164 10.199 -0.264 -8.845 1.00 0.00 O ATOM 1463 CB GLU B 164 12.284 1.091 -10.160 1.00 0.00 C ATOM 1464 CG GLU B 164 11.935 1.265 -11.630 1.00 0.00 C ATOM 1465 CD GLU B 164 11.041 0.157 -12.150 1.00 0.00 C ATOM 1466 OE1 GLU B 164 10.283 -0.424 -11.350 1.00 0.00 O ATOM 1467 OE2 GLU B 164 11.098 -0.129 -13.370 1.00 0.00 O ATOM 0 H GLU B 164 11.728 3.721 -8.431 1.00 0.00 H new ATOM 0 HA GLU B 164 10.607 2.388 -9.808 1.00 0.00 H new ATOM 0 HB2 GLU B 164 13.298 1.454 -9.989 1.00 0.00 H new ATOM 0 HB3 GLU B 164 12.281 0.028 -9.917 1.00 0.00 H new ATOM 0 HG2 GLU B 164 11.438 2.225 -11.771 1.00 0.00 H new ATOM 0 HG3 GLU B 164 12.853 1.292 -12.217 1.00 0.00 H new ATOM 1474 N SER B 165 10.310 1.164 -7.111 1.00 0.00 N ATOM 1475 CA SER B 165 9.581 0.285 -6.207 1.00 0.00 C ATOM 1476 C SER B 165 8.177 0.016 -6.738 1.00 0.00 C ATOM 1477 O SER B 165 7.751 0.616 -7.725 1.00 0.00 O ATOM 1478 CB SER B 165 9.506 0.902 -4.809 1.00 0.00 C ATOM 1479 OG SER B 165 8.505 0.275 -4.026 1.00 0.00 O ATOM 0 H SER B 165 10.601 2.050 -6.697 1.00 0.00 H new ATOM 0 HA SER B 165 10.116 -0.662 -6.144 1.00 0.00 H new ATOM 0 HB2 SER B 165 10.472 0.806 -4.314 1.00 0.00 H new ATOM 0 HB3 SER B 165 9.294 1.968 -4.890 1.00 0.00 H new ATOM 0 HG SER B 165 8.220 0.882 -3.312 1.00 0.00 H new ATOM 1485 N THR B 166 7.462 -0.889 -6.081 1.00 0.00 N ATOM 1486 CA THR B 166 6.107 -1.236 -6.491 1.00 0.00 C ATOM 1487 C THR B 166 5.194 -1.398 -5.282 1.00 0.00 C ATOM 1488 O THR B 166 5.324 -2.352 -4.515 1.00 0.00 O ATOM 1489 CB THR B 166 6.116 -2.525 -7.315 1.00 0.00 C ATOM 1490 OG1 THR B 166 7.013 -2.417 -8.406 1.00 0.00 O ATOM 1491 CG2 THR B 166 4.756 -2.887 -7.873 1.00 0.00 C ATOM 0 H THR B 166 7.798 -1.396 -5.262 1.00 0.00 H new ATOM 0 HA THR B 166 5.722 -0.422 -7.105 1.00 0.00 H new ATOM 0 HB THR B 166 6.428 -3.308 -6.624 1.00 0.00 H new ATOM 0 HG1 THR B 166 7.005 -3.252 -8.920 1.00 0.00 H new ATOM 0 HG21 THR B 166 4.832 -3.811 -8.447 1.00 0.00 H new ATOM 0 HG22 THR B 166 4.052 -3.026 -7.053 1.00 0.00 H new ATOM 0 HG23 THR B 166 4.404 -2.085 -8.522 1.00 0.00 H new ATOM 1499 N LEU B 167 4.268 -0.460 -5.121 1.00 0.00 N ATOM 1500 CA LEU B 167 3.328 -0.495 -4.009 1.00 0.00 C ATOM 1501 C LEU B 167 1.948 -0.935 -4.482 1.00 0.00 C ATOM 1502 O LEU B 167 1.714 -1.099 -5.680 1.00 0.00 O ATOM 1503 CB LEU B 167 3.236 0.881 -3.347 1.00 0.00 C ATOM 1504 CG LEU B 167 4.508 1.346 -2.636 1.00 0.00 C ATOM 1505 CD1 LEU B 167 5.540 1.825 -3.644 1.00 0.00 C ATOM 1506 CD2 LEU B 167 4.186 2.446 -1.638 1.00 0.00 C ATOM 0 H LEU B 167 4.149 0.335 -5.748 1.00 0.00 H new ATOM 0 HA LEU B 167 3.693 -1.218 -3.279 1.00 0.00 H new ATOM 0 HB2 LEU B 167 2.974 1.616 -4.108 1.00 0.00 H new ATOM 0 HB3 LEU B 167 2.420 0.866 -2.625 1.00 0.00 H new ATOM 0 HG LEU B 167 4.928 0.499 -2.093 1.00 0.00 H new ATOM 0 HD11 LEU B 167 6.437 2.152 -3.119 1.00 0.00 H new ATOM 0 HD12 LEU B 167 5.793 1.009 -4.322 1.00 0.00 H new ATOM 0 HD13 LEU B 167 5.131 2.658 -4.216 1.00 0.00 H new ATOM 0 HD21 LEU B 167 5.102 2.766 -1.141 1.00 0.00 H new ATOM 0 HD22 LEU B 167 3.742 3.293 -2.161 1.00 0.00 H new ATOM 0 HD23 LEU B 167 3.483 2.069 -0.896 1.00 0.00 H new ATOM 1518 N HIS B 168 1.036 -1.124 -3.536 1.00 0.00 N ATOM 1519 CA HIS B 168 -0.322 -1.544 -3.857 1.00 0.00 C ATOM 1520 C HIS B 168 -1.343 -0.668 -3.139 1.00 0.00 C ATOM 1521 O HIS B 168 -1.375 -0.616 -1.910 1.00 0.00 O ATOM 1522 CB HIS B 168 -0.530 -3.010 -3.476 1.00 0.00 C ATOM 1523 CG HIS B 168 0.420 -3.945 -4.156 1.00 0.00 C ATOM 1524 ND1 HIS B 168 0.121 -4.598 -5.334 1.00 0.00 N ATOM 1525 CD2 HIS B 168 1.673 -4.336 -3.820 1.00 0.00 C ATOM 1526 CE1 HIS B 168 1.147 -5.350 -5.692 1.00 0.00 C ATOM 1527 NE2 HIS B 168 2.101 -5.208 -4.791 1.00 0.00 N ATOM 0 H HIS B 168 1.213 -0.993 -2.540 1.00 0.00 H new ATOM 0 HA HIS B 168 -0.466 -1.434 -4.932 1.00 0.00 H new ATOM 0 HB2 HIS B 168 -0.421 -3.115 -2.397 1.00 0.00 H new ATOM 0 HB3 HIS B 168 -1.551 -3.300 -3.723 1.00 0.00 H new ATOM 0 HD2 HIS B 168 2.231 -4.021 -2.951 1.00 0.00 H new ATOM 0 HE1 HIS B 168 1.196 -5.974 -6.572 1.00 0.00 H new ATOM 0 HE2 HIS B 168 3.010 -5.671 -4.812 1.00 0.00 H new ATOM 1536 N LEU B 169 -2.173 0.022 -3.914 1.00 0.00 N ATOM 1537 CA LEU B 169 -3.191 0.898 -3.350 1.00 0.00 C ATOM 1538 C LEU B 169 -4.464 0.124 -3.047 1.00 0.00 C ATOM 1539 O LEU B 169 -4.972 -0.622 -3.884 1.00 0.00 O ATOM 1540 CB LEU B 169 -3.483 2.050 -4.314 1.00 0.00 C ATOM 1541 CG LEU B 169 -4.679 2.930 -3.947 1.00 0.00 C ATOM 1542 CD1 LEU B 169 -4.263 4.027 -2.979 1.00 0.00 C ATOM 1543 CD2 LEU B 169 -5.294 3.525 -5.203 1.00 0.00 C ATOM 0 H LEU B 169 -2.160 -0.009 -4.933 1.00 0.00 H new ATOM 0 HA LEU B 169 -2.814 1.308 -2.413 1.00 0.00 H new ATOM 0 HB2 LEU B 169 -2.596 2.681 -4.378 1.00 0.00 H new ATOM 0 HB3 LEU B 169 -3.651 1.635 -5.308 1.00 0.00 H new ATOM 0 HG LEU B 169 -5.428 2.312 -3.452 1.00 0.00 H new ATOM 0 HD11 LEU B 169 -5.129 4.641 -2.731 1.00 0.00 H new ATOM 0 HD12 LEU B 169 -3.865 3.578 -2.069 1.00 0.00 H new ATOM 0 HD13 LEU B 169 -3.497 4.649 -3.442 1.00 0.00 H new ATOM 0 HD21 LEU B 169 -6.145 4.150 -4.931 1.00 0.00 H new ATOM 0 HD22 LEU B 169 -4.550 4.130 -5.721 1.00 0.00 H new ATOM 0 HD23 LEU B 169 -5.629 2.722 -5.860 1.00 0.00 H new ATOM 1555 N VAL B 170 -4.963 0.305 -1.834 1.00 0.00 N ATOM 1556 CA VAL B 170 -6.169 -0.371 -1.390 1.00 0.00 C ATOM 1557 C VAL B 170 -7.003 0.546 -0.500 1.00 0.00 C ATOM 1558 O VAL B 170 -6.474 1.201 0.397 1.00 0.00 O ATOM 1559 CB VAL B 170 -5.806 -1.660 -0.628 1.00 0.00 C ATOM 1560 CG1 VAL B 170 -6.981 -2.170 0.197 1.00 0.00 C ATOM 1561 CG2 VAL B 170 -5.328 -2.728 -1.598 1.00 0.00 C ATOM 0 H VAL B 170 -4.546 0.920 -1.135 1.00 0.00 H new ATOM 0 HA VAL B 170 -6.760 -0.632 -2.268 1.00 0.00 H new ATOM 0 HB VAL B 170 -4.997 -1.425 0.063 1.00 0.00 H new ATOM 0 HG11 VAL B 170 -6.690 -3.080 0.721 1.00 0.00 H new ATOM 0 HG12 VAL B 170 -7.273 -1.411 0.923 1.00 0.00 H new ATOM 0 HG13 VAL B 170 -7.822 -2.384 -0.462 1.00 0.00 H new ATOM 0 HG21 VAL B 170 -5.075 -3.633 -1.046 1.00 0.00 H new ATOM 0 HG22 VAL B 170 -6.119 -2.949 -2.315 1.00 0.00 H new ATOM 0 HG23 VAL B 170 -4.447 -2.369 -2.130 1.00 0.00 H new ATOM 1571 N LEU B 171 -8.306 0.589 -0.754 1.00 0.00 N ATOM 1572 CA LEU B 171 -9.205 1.420 0.014 1.00 0.00 C ATOM 1573 C LEU B 171 -9.760 0.654 1.206 1.00 0.00 C ATOM 1574 O LEU B 171 -9.791 -0.577 1.214 1.00 0.00 O ATOM 1575 CB LEU B 171 -10.340 1.910 -0.875 1.00 0.00 C ATOM 1576 CG LEU B 171 -10.080 3.228 -1.605 1.00 0.00 C ATOM 1577 CD1 LEU B 171 -11.300 3.657 -2.395 1.00 0.00 C ATOM 1578 CD2 LEU B 171 -9.673 4.311 -0.617 1.00 0.00 C ATOM 0 H LEU B 171 -8.759 0.051 -1.493 1.00 0.00 H new ATOM 0 HA LEU B 171 -8.651 2.279 0.391 1.00 0.00 H new ATOM 0 HB2 LEU B 171 -10.556 1.141 -1.616 1.00 0.00 H new ATOM 0 HB3 LEU B 171 -11.235 2.024 -0.263 1.00 0.00 H new ATOM 0 HG LEU B 171 -9.260 3.074 -2.307 1.00 0.00 H new ATOM 0 HD11 LEU B 171 -11.091 4.597 -2.906 1.00 0.00 H new ATOM 0 HD12 LEU B 171 -11.545 2.891 -3.131 1.00 0.00 H new ATOM 0 HD13 LEU B 171 -12.143 3.792 -1.718 1.00 0.00 H new ATOM 0 HD21 LEU B 171 -9.492 5.243 -1.153 1.00 0.00 H new ATOM 0 HD22 LEU B 171 -10.472 4.460 0.109 1.00 0.00 H new ATOM 0 HD23 LEU B 171 -8.763 4.007 -0.099 1.00 0.00 H new ATOM 1590 N ARG B 172 -10.190 1.397 2.209 1.00 0.00 N ATOM 1591 CA ARG B 172 -10.740 0.810 3.423 1.00 0.00 C ATOM 1592 C ARG B 172 -12.100 1.424 3.759 1.00 0.00 C ATOM 1593 O ARG B 172 -12.480 1.510 4.926 1.00 0.00 O ATOM 1594 CB ARG B 172 -9.780 1.003 4.593 1.00 0.00 C ATOM 1595 CG ARG B 172 -9.514 -0.270 5.380 1.00 0.00 C ATOM 1596 CD ARG B 172 -9.382 0.011 6.868 1.00 0.00 C ATOM 1597 NE ARG B 172 -10.670 -0.040 7.552 1.00 0.00 N ATOM 1598 CZ ARG B 172 -10.890 0.498 8.748 1.00 0.00 C ATOM 1599 NH1 ARG B 172 -9.927 1.127 9.396 1.00 0.00 N ATOM 1600 NH2 ARG B 172 -12.100 0.407 9.298 1.00 0.00 N ATOM 0 H ARG B 172 -10.170 2.417 2.209 1.00 0.00 H new ATOM 0 HA ARG B 172 -10.875 -0.257 3.248 1.00 0.00 H new ATOM 0 HB2 ARG B 172 -8.834 1.391 4.215 1.00 0.00 H new ATOM 0 HB3 ARG B 172 -10.188 1.757 5.266 1.00 0.00 H new ATOM 0 HG2 ARG B 172 -10.326 -0.978 5.213 1.00 0.00 H new ATOM 0 HG3 ARG B 172 -8.601 -0.740 5.015 1.00 0.00 H new ATOM 0 HD2 ARG B 172 -8.705 -0.717 7.315 1.00 0.00 H new ATOM 0 HD3 ARG B 172 -8.934 0.994 7.013 1.00 0.00 H new ATOM 0 HE ARG B 172 -11.444 -0.514 7.087 1.00 0.00 H new ATOM 0 HH11 ARG B 172 -8.999 1.205 8.980 1.00 0.00 H new ATOM 0 HH12 ARG B 172 -10.111 1.535 10.313 1.00 0.00 H new ATOM 0 HH21 ARG B 172 -12.851 -0.073 8.802 1.00 0.00 H new ATOM 0 HH22 ARG B 172 -12.276 0.817 10.215 1.00 0.00 H new