USER MOD reduce.3.24.130724 H: found=0, std=0, add=835, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 838 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 107 THR OG1 : rot -65:sc= 0.745 USER MOD Set 1.2: B 109 THR OG1 : rot 180:sc= 0.0267 USER MOD Set 2.1: A 25 MET CE :methyl -139:sc= -8.7! (180deg=-15.1!) USER MOD Set 2.2: B 149 GLN :FLIP amide:sc= -1.84 F(o=-15,f=-11) USER MOD Set 3.1: A 6 MET CE :methyl -110:sc= -9.4! (180deg=-6.77!) USER MOD Set 3.2: A 15 MET CE :methyl 143:sc= -5.73! (180deg=-5.86!) USER MOD Set 4.1: A 13 THR OG1 : rot 48:sc= 0.215 USER MOD Set 4.2: B 168 HIS : no HD1:sc= -0.481 X(o=-0.27,f=0.027) USER MOD Set 5.1: A 10 GLN : amide:sc= -1.41 K(o=-8.9,f=-14!) USER MOD Set 5.2: A 11 HIS :FLIP no HD1:sc= -7.51! C(o=-11!,f=-8.9!) USER MOD Single : A 1 GLY N :NH3+ -140:sc= 0.0124 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 THR OG1 : rot 22:sc= 1.08 USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 16 ASN :FLIP amide:sc= -2.22 F(o=-4.5,f=-2.2) USER MOD Single : A 17 GLN :FLIP amide:sc=-0.00562 F(o=-0.66,f=-0.0056) USER MOD Single : A 20 THR OG1 : rot 86:sc= 0.457 USER MOD Single : A 22 HIS : no HD1:sc= -2.54 K(o=-2.5,f=-5.3!) USER MOD Single : A 27 SER OG : rot -43:sc= -1.4 USER MOD Single : A 31 THR OG1 : rot -44:sc= 0.996 USER MOD Single : B 101 MET CE :methyl 166:sc= -2.4! (180deg=-2.47!) 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 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 112 THR OG1 : rot 180:sc= -0.233 USER MOD Single : B 114 THR OG1 : rot -82:sc= 0.0585 USER MOD Single : B 120 SER OG : rot 180:sc= 0 USER MOD Single : B 122 THR OG1 : rot -170:sc= -1.08 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+ 157:sc= -2.11 (180deg=-3.39!) USER MOD Single : B 131 GLN : amide:sc= -0.488 K(o=-0.49,f=-2.8!) USER MOD Single : B 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 140 GLN :FLIP amide:sc= -2.37 F(o=-6.6!,f=-2.4) USER MOD Single : B 141 GLN : amide:sc= -1.99 X(o=-2,f=-1.7) USER MOD Single : B 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 155 THR OG1 : rot 180:sc= -1.35 USER MOD Single : B 157 SER OG : rot 180:sc= 0 USER MOD Single : B 159 TYR OH : rot -119:sc= 1.13 USER MOD Single : B 160 ASN : amide:sc= -0.396 K(o=-0.4,f=-1) USER MOD Single : B 162 GLN :FLIP amide:sc= -2.03 F(o=-2.9,f=-2) USER MOD Single : B 163 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 165 SER OG : rot 180:sc= -0.312 USER MOD Single : B 166 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 6.266 -24.890 16.639 1.00 0.00 N ATOM 2 CA GLY A 1 6.044 -23.470 16.256 1.00 0.00 C ATOM 3 C GLY A 1 4.766 -23.270 15.464 1.00 0.00 C ATOM 4 O GLY A 1 3.780 -23.980 15.680 1.00 0.00 O ATOM 0 H1 GLY A 1 6.639 -24.934 17.609 1.00 0.00 H new ATOM 0 H2 GLY A 1 5.365 -25.407 16.591 1.00 0.00 H new ATOM 0 H3 GLY A 1 6.949 -25.323 15.985 1.00 0.00 H new ATOM 0 HA2 GLY A 1 6.008 -22.857 17.156 1.00 0.00 H new ATOM 0 HA3 GLY A 1 6.891 -23.121 15.665 1.00 0.00 H new ATOM 10 N SER A 2 4.783 -22.310 14.545 1.00 0.00 N ATOM 11 CA SER A 2 3.616 -22.030 13.717 1.00 0.00 C ATOM 12 C SER A 2 2.427 -21.610 14.578 1.00 0.00 C ATOM 13 O SER A 2 1.281 -21.940 14.268 1.00 0.00 O ATOM 14 CB SER A 2 3.250 -23.250 12.876 1.00 0.00 C ATOM 15 OG SER A 2 4.399 -23.820 12.269 1.00 0.00 O ATOM 0 H SER A 2 5.589 -21.715 14.355 1.00 0.00 H new ATOM 0 HA SER A 2 3.867 -21.206 13.049 1.00 0.00 H new ATOM 0 HB2 SER A 2 2.761 -23.994 13.504 1.00 0.00 H new ATOM 0 HB3 SER A 2 2.534 -22.962 12.106 1.00 0.00 H new ATOM 0 HG SER A 2 4.135 -24.600 11.738 1.00 0.00 H new ATOM 21 N THR A 3 2.709 -20.900 15.661 1.00 0.00 N ATOM 22 CA THR A 3 1.662 -20.440 16.566 1.00 0.00 C ATOM 23 C THR A 3 1.369 -18.960 16.353 1.00 0.00 C ATOM 24 O THR A 3 2.178 -18.100 16.703 1.00 0.00 O ATOM 25 CB THR A 3 2.072 -20.680 18.019 1.00 0.00 C ATOM 26 OG1 THR A 3 3.079 -19.770 18.418 1.00 0.00 O ATOM 27 CG2 THR A 3 2.596 -22.080 18.264 1.00 0.00 C ATOM 0 H THR A 3 3.653 -20.629 15.936 1.00 0.00 H new ATOM 0 HA THR A 3 0.758 -21.008 16.349 1.00 0.00 H new ATOM 0 HB THR A 3 1.163 -20.537 18.603 1.00 0.00 H new ATOM 0 HG1 THR A 3 3.062 -18.985 17.831 1.00 0.00 H new ATOM 0 HG21 THR A 3 2.870 -22.187 19.313 1.00 0.00 H new ATOM 0 HG22 THR A 3 1.823 -22.807 18.015 1.00 0.00 H new ATOM 0 HG23 THR A 3 3.473 -22.255 17.640 1.00 0.00 H new ATOM 35 N SER A 4 0.208 -18.660 15.777 1.00 0.00 N ATOM 36 CA SER A 4 -0.192 -17.290 15.517 1.00 0.00 C ATOM 37 C SER A 4 0.803 -16.600 14.589 1.00 0.00 C ATOM 38 O SER A 4 1.700 -15.880 15.043 1.00 0.00 O ATOM 39 CB SER A 4 -0.305 -16.510 16.830 1.00 0.00 C ATOM 40 OG SER A 4 -1.336 -17.040 17.647 1.00 0.00 O ATOM 0 H SER A 4 -0.474 -19.358 15.481 1.00 0.00 H new ATOM 0 HA SER A 4 -1.166 -17.310 15.028 1.00 0.00 H new ATOM 0 HB2 SER A 4 0.644 -16.550 17.364 1.00 0.00 H new ATOM 0 HB3 SER A 4 -0.507 -15.460 16.618 1.00 0.00 H new ATOM 0 HG SER A 4 -1.389 -16.528 18.481 1.00 0.00 H new ATOM 46 N ALA A 5 0.639 -16.810 13.288 1.00 0.00 N ATOM 47 CA ALA A 5 1.523 -16.210 12.296 1.00 0.00 C ATOM 48 C ALA A 5 0.750 -15.290 11.356 1.00 0.00 C ATOM 49 O ALA A 5 -0.477 -15.350 11.282 1.00 0.00 O ATOM 50 CB ALA A 5 2.240 -17.300 11.506 1.00 0.00 C ATOM 0 H ALA A 5 -0.100 -17.393 12.895 1.00 0.00 H new ATOM 0 HA ALA A 5 2.265 -15.607 12.819 1.00 0.00 H new ATOM 0 HB1 ALA A 5 2.898 -16.841 10.768 1.00 0.00 H new ATOM 0 HB2 ALA A 5 2.830 -17.914 12.186 1.00 0.00 H new ATOM 0 HB3 ALA A 5 1.505 -17.925 10.999 1.00 0.00 H new ATOM 56 N MET A 6 1.476 -14.440 10.639 1.00 0.00 N ATOM 57 CA MET A 6 0.859 -13.510 9.700 1.00 0.00 C ATOM 58 C MET A 6 0.476 -14.240 8.423 1.00 0.00 C ATOM 59 O MET A 6 0.836 -15.410 8.238 1.00 0.00 O ATOM 60 CB MET A 6 1.814 -12.370 9.346 1.00 0.00 C ATOM 61 CG MET A 6 2.813 -12.010 10.437 1.00 0.00 C ATOM 62 SD MET A 6 4.517 -12.380 9.960 1.00 0.00 S ATOM 63 CE MET A 6 4.494 -11.950 8.216 1.00 0.00 C ATOM 0 H MET A 6 2.493 -14.375 10.690 1.00 0.00 H new ATOM 0 HA MET A 6 -0.029 -13.095 10.177 1.00 0.00 H new ATOM 0 HB2 MET A 6 2.364 -12.642 8.445 1.00 0.00 H new ATOM 0 HB3 MET A 6 1.226 -11.484 9.105 1.00 0.00 H new ATOM 0 HG2 MET A 6 2.726 -10.949 10.670 1.00 0.00 H new ATOM 0 HG3 MET A 6 2.566 -12.557 11.347 1.00 0.00 H new ATOM 0 HE1 MET A 6 4.570 -12.857 7.617 1.00 0.00 H new ATOM 0 HE2 MET A 6 3.562 -11.436 7.980 1.00 0.00 H new ATOM 0 HE3 MET A 6 5.336 -11.295 7.992 1.00 0.00 H new ATOM 73 N TRP A 7 -0.230 -13.560 7.529 1.00 0.00 N ATOM 74 CA TRP A 7 -0.615 -14.180 6.266 1.00 0.00 C ATOM 75 C TRP A 7 -0.660 -13.150 5.154 1.00 0.00 C ATOM 76 O TRP A 7 -1.317 -12.110 5.264 1.00 0.00 O ATOM 77 CB TRP A 7 -1.954 -14.910 6.369 1.00 0.00 C ATOM 78 CG TRP A 7 -3.111 -14.060 6.804 1.00 0.00 C ATOM 79 CD1 TRP A 7 -3.509 -13.800 8.088 1.00 0.00 C ATOM 80 CD2 TRP A 7 -4.038 -13.370 5.951 1.00 0.00 C ATOM 81 NE1 TRP A 7 -4.624 -12.990 8.076 1.00 0.00 N ATOM 82 CE2 TRP A 7 -4.959 -12.710 6.784 1.00 0.00 C ATOM 83 CE3 TRP A 7 -4.177 -13.240 4.564 1.00 0.00 C ATOM 84 CZ2 TRP A 7 -5.997 -11.930 6.286 1.00 0.00 C ATOM 85 CZ3 TRP A 7 -5.215 -12.470 4.069 1.00 0.00 C ATOM 86 CH2 TRP A 7 -6.112 -11.820 4.928 1.00 0.00 C ATOM 0 H TRP A 7 -0.543 -12.597 7.650 1.00 0.00 H new ATOM 0 HA TRP A 7 0.146 -14.923 6.029 1.00 0.00 H new ATOM 0 HB2 TRP A 7 -2.188 -15.345 5.398 1.00 0.00 H new ATOM 0 HB3 TRP A 7 -1.846 -15.737 7.071 1.00 0.00 H new ATOM 0 HD1 TRP A 7 -3.022 -14.174 8.977 1.00 0.00 H new ATOM 0 HE1 TRP A 7 -5.120 -12.654 8.902 1.00 0.00 H new ATOM 0 HE3 TRP A 7 -3.488 -13.731 3.893 1.00 0.00 H new ATOM 0 HZ2 TRP A 7 -6.688 -11.429 6.948 1.00 0.00 H new ATOM 0 HZ3 TRP A 7 -5.336 -12.368 3.001 1.00 0.00 H new ATOM 0 HH2 TRP A 7 -6.908 -11.222 4.510 1.00 0.00 H new ATOM 97 N ALA A 8 0.052 -13.450 4.082 1.00 0.00 N ATOM 98 CA ALA A 8 0.111 -12.570 2.930 1.00 0.00 C ATOM 99 C ALA A 8 -1.194 -12.630 2.151 1.00 0.00 C ATOM 100 O ALA A 8 -1.583 -13.690 1.660 1.00 0.00 O ATOM 101 CB ALA A 8 1.283 -12.940 2.035 1.00 0.00 C ATOM 0 H ALA A 8 0.601 -14.304 3.986 1.00 0.00 H new ATOM 0 HA ALA A 8 0.258 -11.549 3.282 1.00 0.00 H new ATOM 0 HB1 ALA A 8 1.311 -12.269 1.176 1.00 0.00 H new ATOM 0 HB2 ALA A 8 2.213 -12.849 2.597 1.00 0.00 H new ATOM 0 HB3 ALA A 8 1.167 -13.967 1.689 1.00 0.00 H new ATOM 107 N CYS A 9 -1.875 -11.490 2.047 1.00 0.00 N ATOM 108 CA CYS A 9 -3.145 -11.430 1.332 1.00 0.00 C ATOM 109 C CYS A 9 -3.054 -12.140 -0.015 1.00 0.00 C ATOM 110 O CYS A 9 -1.966 -12.310 -0.568 1.00 0.00 O ATOM 111 CB CYS A 9 -3.574 -9.983 1.112 1.00 0.00 C ATOM 112 SG CYS A 9 -5.309 -9.809 0.643 1.00 0.00 S ATOM 0 H CYS A 9 -1.570 -10.602 2.446 1.00 0.00 H new ATOM 0 HA CYS A 9 -3.889 -11.937 1.947 1.00 0.00 H new ATOM 0 HB2 CYS A 9 -3.394 -9.416 2.026 1.00 0.00 H new ATOM 0 HB3 CYS A 9 -2.950 -9.542 0.335 1.00 0.00 H new ATOM 117 N GLN A 10 -4.199 -12.560 -0.538 1.00 0.00 N ATOM 118 CA GLN A 10 -4.242 -13.260 -1.820 1.00 0.00 C ATOM 119 C GLN A 10 -4.801 -12.360 -2.923 1.00 0.00 C ATOM 120 O GLN A 10 -5.140 -12.840 -4.006 1.00 0.00 O ATOM 121 CB GLN A 10 -5.087 -14.530 -1.705 1.00 0.00 C ATOM 122 CG GLN A 10 -6.522 -14.270 -1.278 1.00 0.00 C ATOM 123 CD GLN A 10 -6.690 -14.250 0.228 1.00 0.00 C ATOM 124 OE1 GLN A 10 -6.461 -15.260 0.900 1.00 0.00 O ATOM 125 NE2 GLN A 10 -7.092 -13.110 0.768 1.00 0.00 N ATOM 0 H GLN A 10 -5.109 -12.430 -0.097 1.00 0.00 H new ATOM 0 HA GLN A 10 -3.221 -13.533 -2.086 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -5.090 -15.042 -2.667 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -4.619 -15.204 -0.987 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -6.852 -13.316 -1.689 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -7.168 -15.039 -1.701 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -7.270 -12.299 0.175 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -7.224 -13.042 1.777 1.00 0.00 H new ATOM 134 N HIS A 11 -4.896 -11.060 -2.644 1.00 0.00 N ATOM 135 CA HIS A 11 -5.416 -10.110 -3.618 1.00 0.00 C ATOM 136 C HIS A 11 -4.577 -8.839 -3.639 1.00 0.00 C ATOM 137 O HIS A 11 -4.079 -8.428 -4.687 1.00 0.00 O ATOM 138 CB HIS A 11 -6.868 -9.764 -3.294 1.00 0.00 C ATOM 139 CG HIS A 11 -7.704 -10.940 -2.930 1.00 0.00 C ATOM 140 ND1 HIS A 11 -8.331 -11.240 -1.777 1.00 0.00 N flip ATOM 141 CD2 HIS A 11 -7.981 -11.970 -3.799 1.00 0.00 C flip ATOM 142 CE1 HIS A 11 -8.974 -12.440 -1.961 1.00 0.00 C flip ATOM 143 NE2 HIS A 11 -8.748 -12.860 -3.191 1.00 0.00 N flip ATOM 0 H HIS A 11 -4.620 -10.645 -1.754 1.00 0.00 H new ATOM 0 HA HIS A 11 -5.367 -10.574 -4.603 1.00 0.00 H new ATOM 0 HB2 HIS A 11 -6.885 -9.050 -2.471 1.00 0.00 H new ATOM 0 HB3 HIS A 11 -7.313 -9.267 -4.156 1.00 0.00 H new ATOM 0 HD2 HIS A 11 -7.628 -12.041 -4.817 1.00 0.00 H new ATOM 0 HE1 HIS A 11 -9.567 -12.955 -1.220 1.00 0.00 H new ATOM 0 HE2 HIS A 11 -9.104 -13.723 -3.603 1.00 0.00 H new ATOM 152 N CYS A 12 -4.430 -8.216 -2.474 1.00 0.00 N ATOM 153 CA CYS A 12 -3.658 -6.986 -2.355 1.00 0.00 C ATOM 154 C CYS A 12 -2.230 -7.271 -1.879 1.00 0.00 C ATOM 155 O CYS A 12 -1.391 -6.372 -1.827 1.00 0.00 O ATOM 156 CB CYS A 12 -4.375 -6.012 -1.410 1.00 0.00 C ATOM 157 SG CYS A 12 -4.009 -6.244 0.348 1.00 0.00 S ATOM 0 H CYS A 12 -4.837 -8.544 -1.598 1.00 0.00 H new ATOM 0 HA CYS A 12 -3.582 -6.525 -3.340 1.00 0.00 H new ATOM 0 HB2 CYS A 12 -4.107 -4.993 -1.690 1.00 0.00 H new ATOM 0 HB3 CYS A 12 -5.450 -6.111 -1.558 1.00 0.00 H new ATOM 162 N THR A 13 -1.964 -8.532 -1.545 1.00 0.00 N ATOM 163 CA THR A 13 -0.645 -8.959 -1.088 1.00 0.00 C ATOM 164 C THR A 13 -0.113 -8.082 0.047 1.00 0.00 C ATOM 165 O THR A 13 0.805 -7.286 -0.149 1.00 0.00 O ATOM 166 CB THR A 13 0.348 -8.958 -2.253 1.00 0.00 C ATOM 167 OG1 THR A 13 0.143 -7.835 -3.091 1.00 0.00 O ATOM 168 CG2 THR A 13 0.256 -10.190 -3.117 1.00 0.00 C ATOM 0 H THR A 13 -2.654 -9.283 -1.583 1.00 0.00 H new ATOM 0 HA THR A 13 -0.754 -9.972 -0.700 1.00 0.00 H new ATOM 0 HB THR A 13 1.333 -8.929 -1.787 1.00 0.00 H new ATOM 0 HG1 THR A 13 0.068 -7.027 -2.542 1.00 0.00 H new ATOM 0 HG21 THR A 13 0.987 -10.124 -3.923 1.00 0.00 H new ATOM 0 HG22 THR A 13 0.460 -11.074 -2.513 1.00 0.00 H new ATOM 0 HG23 THR A 13 -0.746 -10.264 -3.540 1.00 0.00 H new ATOM 176 N PHE A 14 -0.687 -8.246 1.234 1.00 0.00 N ATOM 177 CA PHE A 14 -0.266 -7.486 2.402 1.00 0.00 C ATOM 178 C PHE A 14 -0.113 -8.399 3.616 1.00 0.00 C ATOM 179 O PHE A 14 -0.763 -9.440 3.713 1.00 0.00 O ATOM 180 CB PHE A 14 -1.277 -6.378 2.705 1.00 0.00 C ATOM 181 CG PHE A 14 -1.229 -5.881 4.127 1.00 0.00 C ATOM 182 CD1 PHE A 14 -0.176 -5.094 4.566 1.00 0.00 C ATOM 183 CD2 PHE A 14 -2.233 -6.211 5.023 1.00 0.00 C ATOM 184 CE1 PHE A 14 -0.126 -4.645 5.872 1.00 0.00 C ATOM 185 CE2 PHE A 14 -2.188 -5.764 6.330 1.00 0.00 C ATOM 186 CZ PHE A 14 -1.133 -4.981 6.755 1.00 0.00 C ATOM 0 H PHE A 14 -1.448 -8.902 1.411 1.00 0.00 H new ATOM 0 HA PHE A 14 0.702 -7.035 2.185 1.00 0.00 H new ATOM 0 HB2 PHE A 14 -1.096 -5.540 2.031 1.00 0.00 H new ATOM 0 HB3 PHE A 14 -2.280 -6.747 2.493 1.00 0.00 H new ATOM 0 HD1 PHE A 14 0.614 -4.829 3.880 1.00 0.00 H new ATOM 0 HD2 PHE A 14 -3.060 -6.824 4.696 1.00 0.00 H new ATOM 0 HE1 PHE A 14 0.700 -4.032 6.202 1.00 0.00 H new ATOM 0 HE2 PHE A 14 -2.977 -6.027 7.018 1.00 0.00 H new ATOM 0 HZ PHE A 14 -1.096 -4.632 7.776 1.00 0.00 H new ATOM 196 N MET A 15 0.734 -7.983 4.548 1.00 0.00 N ATOM 197 CA MET A 15 0.967 -8.727 5.768 1.00 0.00 C ATOM 198 C MET A 15 -0.172 -8.566 6.758 1.00 0.00 C ATOM 199 O MET A 15 -0.224 -7.592 7.510 1.00 0.00 O ATOM 200 CB MET A 15 2.262 -8.264 6.416 1.00 0.00 C ATOM 201 CG MET A 15 3.441 -9.196 6.241 1.00 0.00 C ATOM 202 SD MET A 15 4.664 -8.950 7.541 1.00 0.00 S ATOM 203 CE MET A 15 3.646 -9.204 8.998 1.00 0.00 C ATOM 0 H MET A 15 1.275 -7.122 4.475 1.00 0.00 H new ATOM 0 HA MET A 15 1.035 -9.781 5.499 1.00 0.00 H new ATOM 0 HB2 MET A 15 2.526 -7.289 6.006 1.00 0.00 H new ATOM 0 HB3 MET A 15 2.086 -8.124 7.482 1.00 0.00 H new ATOM 0 HG2 MET A 15 3.096 -10.230 6.254 1.00 0.00 H new ATOM 0 HG3 MET A 15 3.901 -9.026 5.268 1.00 0.00 H new ATOM 0 HE1 MET A 15 4.226 -9.724 9.761 1.00 0.00 H new ATOM 0 HE2 MET A 15 3.318 -8.239 9.386 1.00 0.00 H new ATOM 0 HE3 MET A 15 2.775 -9.803 8.733 1.00 0.00 H new ATOM 213 N ASN A 16 -1.057 -9.543 6.782 1.00 0.00 N ATOM 214 CA ASN A 16 -2.167 -9.534 7.710 1.00 0.00 C ATOM 215 C ASN A 16 -1.717 -10.200 8.999 1.00 0.00 C ATOM 216 O ASN A 16 -0.598 -10.700 9.071 1.00 0.00 O ATOM 217 CB ASN A 16 -3.360 -10.260 7.103 1.00 0.00 C ATOM 218 CG ASN A 16 -3.692 -9.770 5.710 1.00 0.00 C ATOM 219 OD1 ASN A 16 -3.222 -10.480 4.699 1.00 0.00 O flip ATOM 220 ND2 ASN A 16 -4.364 -8.752 5.545 1.00 0.00 N flip ATOM 0 H ASN A 16 -1.027 -10.356 6.166 1.00 0.00 H new ATOM 0 HA ASN A 16 -2.478 -8.511 7.923 1.00 0.00 H new ATOM 0 HB2 ASN A 16 -3.151 -11.329 7.068 1.00 0.00 H new ATOM 0 HB3 ASN A 16 -4.229 -10.126 7.748 1.00 0.00 H new ATOM 0 HD21 ASN A 16 -4.708 -8.232 6.352 1.00 0.00 H new ATOM 0 HD22 ASN A 16 -4.576 -8.429 4.601 1.00 0.00 H new ATOM 227 N GLN A 17 -2.567 -10.230 10.010 1.00 0.00 N ATOM 228 CA GLN A 17 -2.193 -10.860 11.272 1.00 0.00 C ATOM 229 C GLN A 17 -2.777 -12.270 11.349 1.00 0.00 C ATOM 230 O GLN A 17 -3.563 -12.660 10.504 1.00 0.00 O ATOM 231 CB GLN A 17 -2.646 -10.020 12.458 1.00 0.00 C ATOM 232 CG GLN A 17 -2.301 -8.550 12.309 1.00 0.00 C ATOM 233 CD GLN A 17 -0.848 -8.255 12.637 1.00 0.00 C ATOM 234 OE1 GLN A 17 0.068 -8.722 11.789 1.00 0.00 O flip ATOM 235 NE2 GLN A 17 -0.549 -7.612 13.644 1.00 0.00 N flip ATOM 0 H GLN A 17 -3.507 -9.834 9.988 1.00 0.00 H new ATOM 0 HA GLN A 17 -1.106 -10.931 11.313 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -3.724 -10.124 12.579 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -2.184 -10.406 13.367 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -2.511 -8.233 11.287 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -2.944 -7.962 12.963 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -1.281 -7.272 14.268 1.00 0.00 H new ATOM 0 HE22 GLN A 17 0.430 -7.419 13.854 1.00 0.00 H new ATOM 244 N PRO A 18 -2.394 -13.050 12.355 1.00 0.00 N ATOM 245 CA PRO A 18 -2.889 -14.410 12.502 1.00 0.00 C ATOM 246 C PRO A 18 -4.350 -14.460 12.941 1.00 0.00 C ATOM 247 O PRO A 18 -5.019 -15.480 12.784 1.00 0.00 O ATOM 248 CB PRO A 18 -1.981 -15.030 13.567 1.00 0.00 C ATOM 249 CG PRO A 18 -0.944 -14.000 13.903 1.00 0.00 C ATOM 250 CD PRO A 18 -1.455 -12.680 13.412 1.00 0.00 C ATOM 0 HA PRO A 18 -2.863 -14.945 11.553 1.00 0.00 H new ATOM 0 HB2 PRO A 18 -2.555 -15.305 14.452 1.00 0.00 H new ATOM 0 HB3 PRO A 18 -1.514 -15.942 13.194 1.00 0.00 H new ATOM 0 HG2 PRO A 18 -0.767 -13.968 14.978 1.00 0.00 H new ATOM 0 HG3 PRO A 18 0.008 -14.244 13.431 1.00 0.00 H new ATOM 0 HD2 PRO A 18 -1.946 -12.119 14.207 1.00 0.00 H new ATOM 0 HD3 PRO A 18 -0.648 -12.054 13.031 1.00 0.00 H new ATOM 258 N GLY A 19 -4.844 -13.350 13.482 1.00 0.00 N ATOM 259 CA GLY A 19 -6.226 -13.300 13.921 1.00 0.00 C ATOM 260 C GLY A 19 -7.110 -12.530 12.958 1.00 0.00 C ATOM 261 O GLY A 19 -8.258 -12.210 13.274 1.00 0.00 O ATOM 0 H GLY A 19 -4.315 -12.489 13.623 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -6.608 -14.315 14.028 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -6.275 -12.836 14.906 1.00 0.00 H new ATOM 265 N THR A 20 -6.575 -12.220 11.780 1.00 0.00 N ATOM 266 CA THR A 20 -7.323 -11.470 10.775 1.00 0.00 C ATOM 267 C THR A 20 -8.044 -12.400 9.807 1.00 0.00 C ATOM 268 O THR A 20 -7.496 -12.770 8.769 1.00 0.00 O ATOM 269 CB THR A 20 -6.383 -10.550 9.987 1.00 0.00 C ATOM 270 OG1 THR A 20 -5.064 -10.630 10.491 1.00 0.00 O ATOM 271 CG2 THR A 20 -6.795 -9.100 10.016 1.00 0.00 C ATOM 0 H THR A 20 -5.629 -12.476 11.498 1.00 0.00 H new ATOM 0 HA THR A 20 -8.067 -10.872 11.301 1.00 0.00 H new ATOM 0 HB THR A 20 -6.437 -10.903 8.957 1.00 0.00 H new ATOM 0 HG1 THR A 20 -4.595 -11.376 10.062 1.00 0.00 H new ATOM 0 HG21 THR A 20 -6.085 -8.508 9.438 1.00 0.00 H new ATOM 0 HG22 THR A 20 -7.790 -8.996 9.584 1.00 0.00 H new ATOM 0 HG23 THR A 20 -6.808 -8.746 11.047 1.00 0.00 H new ATOM 279 N GLY A 21 -9.284 -12.760 10.134 1.00 0.00 N ATOM 280 CA GLY A 21 -10.050 -13.620 9.250 1.00 0.00 C ATOM 281 C GLY A 21 -10.040 -13.090 7.832 1.00 0.00 C ATOM 282 O GLY A 21 -9.862 -13.830 6.871 1.00 0.00 O ATOM 0 H GLY A 21 -9.767 -12.475 10.986 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -9.635 -14.628 9.268 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -11.077 -13.692 9.608 1.00 0.00 H new ATOM 286 N HIS A 22 -10.220 -11.780 7.720 1.00 0.00 N ATOM 287 CA HIS A 22 -10.210 -11.090 6.445 1.00 0.00 C ATOM 288 C HIS A 22 -9.031 -10.140 6.409 1.00 0.00 C ATOM 289 O HIS A 22 -8.291 -10.030 7.386 1.00 0.00 O ATOM 290 CB HIS A 22 -11.510 -10.310 6.243 1.00 0.00 C ATOM 291 CG HIS A 22 -12.740 -11.150 6.189 1.00 0.00 C ATOM 292 ND1 HIS A 22 -12.980 -12.210 7.032 1.00 0.00 N ATOM 293 CD2 HIS A 22 -13.820 -11.060 5.380 1.00 0.00 C ATOM 294 CE1 HIS A 22 -14.150 -12.750 6.739 1.00 0.00 C ATOM 295 NE2 HIS A 22 -14.680 -12.070 5.741 1.00 0.00 N ATOM 0 H HIS A 22 -10.378 -11.166 8.519 1.00 0.00 H new ATOM 0 HA HIS A 22 -10.123 -11.823 5.643 1.00 0.00 H new ATOM 0 HB2 HIS A 22 -11.615 -9.589 7.054 1.00 0.00 H new ATOM 0 HB3 HIS A 22 -11.435 -9.740 5.317 1.00 0.00 H new ATOM 0 HD2 HIS A 22 -13.977 -10.332 4.598 1.00 0.00 H new ATOM 0 HE1 HIS A 22 -14.595 -13.601 7.232 1.00 0.00 H new ATOM 0 HE2 HIS A 22 -15.583 -12.262 5.307 1.00 0.00 H new ATOM 304 N CYS A 23 -8.856 -9.445 5.299 1.00 0.00 N ATOM 305 CA CYS A 23 -7.757 -8.499 5.179 1.00 0.00 C ATOM 306 C CYS A 23 -8.140 -7.156 5.788 1.00 0.00 C ATOM 307 O CYS A 23 -9.270 -6.694 5.636 1.00 0.00 O ATOM 308 CB CYS A 23 -7.367 -8.316 3.715 1.00 0.00 C ATOM 309 SG CYS A 23 -5.850 -7.362 3.464 1.00 0.00 S ATOM 0 H CYS A 23 -9.453 -9.515 4.475 1.00 0.00 H new ATOM 0 HA CYS A 23 -6.901 -8.899 5.723 1.00 0.00 H new ATOM 0 HB2 CYS A 23 -7.245 -9.298 3.258 1.00 0.00 H new ATOM 0 HB3 CYS A 23 -8.185 -7.820 3.192 1.00 0.00 H new ATOM 314 N GLU A 24 -7.190 -6.532 6.475 1.00 0.00 N ATOM 315 CA GLU A 24 -7.430 -5.236 7.104 1.00 0.00 C ATOM 316 C GLU A 24 -7.161 -4.091 6.130 1.00 0.00 C ATOM 317 O GLU A 24 -7.054 -2.933 6.534 1.00 0.00 O ATOM 318 CB GLU A 24 -6.552 -5.066 8.345 1.00 0.00 C ATOM 319 CG GLU A 24 -5.148 -5.628 8.191 1.00 0.00 C ATOM 320 CD GLU A 24 -4.104 -4.793 8.905 1.00 0.00 C ATOM 321 OE1 GLU A 24 -4.204 -3.549 8.857 1.00 0.00 O ATOM 322 OE2 GLU A 24 -3.186 -5.383 9.513 1.00 0.00 O ATOM 0 H GLU A 24 -6.249 -6.900 6.611 1.00 0.00 H new ATOM 0 HA GLU A 24 -8.479 -5.206 7.399 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -6.483 -4.005 8.586 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -7.037 -5.554 9.190 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -5.123 -6.645 8.581 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -4.898 -5.687 7.132 1.00 0.00 H new ATOM 329 N MET A 25 -7.047 -4.421 4.849 1.00 0.00 N ATOM 330 CA MET A 25 -6.785 -3.424 3.822 1.00 0.00 C ATOM 331 C MET A 25 -7.865 -3.440 2.747 1.00 0.00 C ATOM 332 O MET A 25 -8.569 -2.450 2.549 1.00 0.00 O ATOM 333 CB MET A 25 -5.420 -3.673 3.182 1.00 0.00 C ATOM 334 CG MET A 25 -4.287 -3.762 4.187 1.00 0.00 C ATOM 335 SD MET A 25 -3.725 -2.142 4.738 1.00 0.00 S ATOM 336 CE MET A 25 -2.842 -2.589 6.229 1.00 0.00 C ATOM 0 H MET A 25 -7.132 -5.375 4.497 1.00 0.00 H new ATOM 0 HA MET A 25 -6.790 -2.444 4.300 1.00 0.00 H new ATOM 0 HB2 MET A 25 -5.460 -4.599 2.609 1.00 0.00 H new ATOM 0 HB3 MET A 25 -5.207 -2.870 2.476 1.00 0.00 H new ATOM 0 HG2 MET A 25 -4.615 -4.342 5.050 1.00 0.00 H new ATOM 0 HG3 MET A 25 -3.451 -4.301 3.741 1.00 0.00 H new ATOM 0 HE1 MET A 25 -3.054 -1.859 7.010 1.00 0.00 H new ATOM 0 HE2 MET A 25 -3.162 -3.577 6.559 1.00 0.00 H new ATOM 0 HE3 MET A 25 -1.771 -2.603 6.027 1.00 0.00 H new ATOM 346 N CYS A 26 -7.996 -4.569 2.056 1.00 0.00 N ATOM 347 CA CYS A 26 -8.995 -4.698 1.004 1.00 0.00 C ATOM 348 C CYS A 26 -10.310 -5.197 1.579 1.00 0.00 C ATOM 349 O CYS A 26 -11.360 -5.100 0.936 1.00 0.00 O ATOM 350 CB CYS A 26 -8.488 -5.622 -0.108 1.00 0.00 C ATOM 351 SG CYS A 26 -8.054 -7.284 0.442 1.00 0.00 S ATOM 0 H CYS A 26 -7.426 -5.402 2.205 1.00 0.00 H new ATOM 0 HA CYS A 26 -9.172 -3.715 0.567 1.00 0.00 H new ATOM 0 HB2 CYS A 26 -9.255 -5.697 -0.879 1.00 0.00 H new ATOM 0 HB3 CYS A 26 -7.613 -5.166 -0.571 1.00 0.00 H new ATOM 356 N SER A 27 -10.260 -5.718 2.805 1.00 0.00 N ATOM 357 CA SER A 27 -11.440 -6.221 3.492 1.00 0.00 C ATOM 358 C SER A 27 -11.890 -7.573 2.942 1.00 0.00 C ATOM 359 O SER A 27 -12.960 -8.066 3.288 1.00 0.00 O ATOM 360 CB SER A 27 -12.590 -5.212 3.404 1.00 0.00 C ATOM 361 OG SER A 27 -13.610 -5.521 4.337 1.00 0.00 O ATOM 0 H SER A 27 -9.399 -5.801 3.346 1.00 0.00 H new ATOM 0 HA SER A 27 -11.165 -6.361 4.537 1.00 0.00 H new ATOM 0 HB2 SER A 27 -12.212 -4.207 3.593 1.00 0.00 H new ATOM 0 HB3 SER A 27 -13.003 -5.213 2.395 1.00 0.00 H new ATOM 0 HG SER A 27 -13.775 -6.487 4.334 1.00 0.00 H new ATOM 367 N LEU A 28 -11.060 -8.175 2.094 1.00 0.00 N ATOM 368 CA LEU A 28 -11.380 -9.472 1.515 1.00 0.00 C ATOM 369 C LEU A 28 -11.070 -10.580 2.514 1.00 0.00 C ATOM 370 O LEU A 28 -10.140 -10.470 3.311 1.00 0.00 O ATOM 371 CB LEU A 28 -10.590 -9.687 0.221 1.00 0.00 C ATOM 372 CG LEU A 28 -11.050 -8.854 -0.983 1.00 0.00 C ATOM 373 CD1 LEU A 28 -11.460 -7.451 -0.561 1.00 0.00 C ATOM 374 CD2 LEU A 28 -9.957 -8.792 -2.037 1.00 0.00 C ATOM 0 H LEU A 28 -10.166 -7.786 1.795 1.00 0.00 H new ATOM 0 HA LEU A 28 -12.444 -9.498 1.279 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -9.541 -9.463 0.415 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -10.646 -10.742 -0.047 1.00 0.00 H new ATOM 0 HG LEU A 28 -11.924 -9.344 -1.412 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -11.781 -6.887 -1.437 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -12.282 -7.511 0.153 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -10.612 -6.948 -0.096 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -10.301 -8.197 -2.883 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -9.065 -8.333 -1.610 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -9.720 -9.801 -2.375 1.00 0.00 H new ATOM 386 N PRO A 29 -11.860 -11.670 2.492 1.00 0.00 N ATOM 387 CA PRO A 29 -11.660 -12.800 3.409 1.00 0.00 C ATOM 388 C PRO A 29 -10.430 -13.610 3.082 1.00 0.00 C ATOM 389 O PRO A 29 -10.170 -13.950 1.925 1.00 0.00 O ATOM 390 CB PRO A 29 -12.930 -13.630 3.221 1.00 0.00 C ATOM 391 CG PRO A 29 -13.390 -13.310 1.840 1.00 0.00 C ATOM 392 CD PRO A 29 -12.990 -11.890 1.579 1.00 0.00 C ATOM 0 HA PRO A 29 -11.499 -12.469 4.435 1.00 0.00 H new ATOM 0 HB2 PRO A 29 -12.727 -14.695 3.334 1.00 0.00 H new ATOM 0 HB3 PRO A 29 -13.687 -13.369 3.961 1.00 0.00 H new ATOM 0 HG2 PRO A 29 -12.933 -13.982 1.113 1.00 0.00 H new ATOM 0 HG3 PRO A 29 -14.470 -13.432 1.752 1.00 0.00 H new ATOM 0 HD2 PRO A 29 -12.699 -11.741 0.539 1.00 0.00 H new ATOM 0 HD3 PRO A 29 -13.809 -11.200 1.783 1.00 0.00 H new ATOM 400 N ARG A 30 -9.660 -13.920 4.116 1.00 0.00 N ATOM 401 CA ARG A 30 -8.444 -14.700 3.942 1.00 0.00 C ATOM 402 C ARG A 30 -8.758 -16.090 3.402 1.00 0.00 C ATOM 403 O ARG A 30 -9.816 -16.650 3.686 1.00 0.00 O ATOM 404 CB ARG A 30 -7.683 -14.800 5.266 1.00 0.00 C ATOM 405 CG ARG A 30 -6.471 -15.710 5.217 1.00 0.00 C ATOM 406 CD ARG A 30 -5.981 -16.060 6.613 1.00 0.00 C ATOM 407 NE ARG A 30 -4.755 -16.860 6.581 1.00 0.00 N ATOM 408 CZ ARG A 30 -4.709 -18.130 6.204 1.00 0.00 C ATOM 409 NH1 ARG A 30 -5.816 -18.760 5.828 1.00 0.00 N ATOM 410 NH2 ARG A 30 -3.553 -18.780 6.203 1.00 0.00 N ATOM 0 H ARG A 30 -9.855 -13.645 5.079 1.00 0.00 H new ATOM 0 HA ARG A 30 -7.814 -14.190 3.213 1.00 0.00 H new ATOM 0 HB2 ARG A 30 -7.363 -13.802 5.565 1.00 0.00 H new ATOM 0 HB3 ARG A 30 -8.364 -15.160 6.037 1.00 0.00 H new ATOM 0 HG2 ARG A 30 -6.722 -16.624 4.679 1.00 0.00 H new ATOM 0 HG3 ARG A 30 -5.671 -15.222 4.661 1.00 0.00 H new ATOM 0 HD2 ARG A 30 -5.801 -15.143 7.174 1.00 0.00 H new ATOM 0 HD3 ARG A 30 -6.759 -16.610 7.143 1.00 0.00 H new ATOM 0 HE ARG A 30 -3.884 -16.413 6.866 1.00 0.00 H new ATOM 0 HH11 ARG A 30 -6.709 -18.267 5.828 1.00 0.00 H new ATOM 0 HH12 ARG A 30 -5.774 -19.737 5.539 1.00 0.00 H new ATOM 0 HH21 ARG A 30 -2.699 -18.303 6.492 1.00 0.00 H new ATOM 0 HH22 ARG A 30 -3.518 -19.757 5.913 1.00 0.00 H new ATOM 424 N THR A 31 -7.829 -16.640 2.621 1.00 0.00 N ATOM 425 CA THR A 31 -7.995 -17.970 2.034 1.00 0.00 C ATOM 426 C THR A 31 -9.395 -18.150 1.450 1.00 0.00 C ATOM 427 O THR A 31 -10.070 -17.130 1.229 1.00 0.00 O ATOM 428 CB THR A 31 -7.720 -19.050 3.081 1.00 0.00 C ATOM 429 OG1 THR A 31 -7.707 -20.330 2.481 1.00 0.00 O ATOM 430 CG2 THR A 31 -8.737 -19.080 4.202 1.00 0.00 C ATOM 431 OXT THR A 31 -9.793 -19.310 1.218 1.00 0.00 O ATOM 0 H THR A 31 -6.950 -16.183 2.379 1.00 0.00 H new ATOM 0 HA THR A 31 -7.275 -18.068 1.221 1.00 0.00 H new ATOM 0 HB THR A 31 -6.749 -18.798 3.506 1.00 0.00 H new ATOM 0 HG1 THR A 31 -8.460 -20.407 1.859 1.00 0.00 H new ATOM 0 HG21 THR A 31 -8.478 -19.870 4.907 1.00 0.00 H new ATOM 0 HG22 THR A 31 -8.738 -18.120 4.718 1.00 0.00 H new ATOM 0 HG23 THR A 31 -9.728 -19.272 3.790 1.00 0.00 H new TER 439 THR A 31 ATOM 440 N MET B 101 13.787 9.557 -6.916 1.00 0.00 N ATOM 441 CA MET B 101 13.491 8.187 -7.413 1.00 0.00 C ATOM 442 C MET B 101 12.033 8.056 -7.841 1.00 0.00 C ATOM 443 O MET B 101 11.256 9.004 -7.739 1.00 0.00 O ATOM 444 CB MET B 101 13.806 7.173 -6.307 1.00 0.00 C ATOM 445 CG MET B 101 13.660 7.725 -4.898 1.00 0.00 C ATOM 446 SD MET B 101 13.810 6.450 -3.635 1.00 0.00 S ATOM 447 CE MET B 101 12.096 5.969 -3.446 1.00 0.00 C ATOM 0 HA MET B 101 14.113 7.991 -8.287 1.00 0.00 H new ATOM 0 HB2 MET B 101 13.146 6.313 -6.419 1.00 0.00 H new ATOM 0 HB3 MET B 101 14.826 6.812 -6.440 1.00 0.00 H new ATOM 0 HG2 MET B 101 14.420 8.488 -4.730 1.00 0.00 H new ATOM 0 HG3 MET B 101 12.691 8.214 -4.802 1.00 0.00 H new ATOM 0 HE1 MET B 101 12.040 5.031 -2.893 1.00 0.00 H new ATOM 0 HE2 MET B 101 11.558 6.745 -2.900 1.00 0.00 H new ATOM 0 HE3 MET B 101 11.644 5.838 -4.429 1.00 0.00 H new ATOM 459 N GLN B 102 11.673 6.871 -8.319 1.00 0.00 N ATOM 460 CA GLN B 102 10.309 6.603 -8.764 1.00 0.00 C ATOM 461 C GLN B 102 9.754 5.357 -8.088 1.00 0.00 C ATOM 462 O GLN B 102 10.506 4.481 -7.665 1.00 0.00 O ATOM 463 CB GLN B 102 10.261 6.434 -10.280 1.00 0.00 C ATOM 464 CG GLN B 102 11.466 5.707 -10.860 1.00 0.00 C ATOM 465 CD GLN B 102 11.369 5.516 -12.360 1.00 0.00 C ATOM 466 OE1 GLN B 102 11.788 6.375 -13.130 1.00 0.00 O ATOM 467 NE2 GLN B 102 10.814 4.384 -12.770 1.00 0.00 N ATOM 0 H GLN B 102 12.308 6.078 -8.409 1.00 0.00 H new ATOM 0 HA GLN B 102 9.692 7.457 -8.484 1.00 0.00 H new ATOM 0 HB2 GLN B 102 9.357 5.887 -10.546 1.00 0.00 H new ATOM 0 HB3 GLN B 102 10.186 7.418 -10.743 1.00 0.00 H new ATOM 0 HG2 GLN B 102 12.371 6.269 -10.627 1.00 0.00 H new ATOM 0 HG3 GLN B 102 11.563 4.733 -10.380 1.00 0.00 H new ATOM 0 HE21 GLN B 102 10.482 3.702 -12.088 1.00 0.00 H new ATOM 0 HE22 GLN B 102 10.719 4.195 -13.768 1.00 0.00 H new ATOM 476 N ILE B 103 8.433 5.284 -7.988 1.00 0.00 N ATOM 477 CA ILE B 103 7.780 4.141 -7.362 1.00 0.00 C ATOM 478 C ILE B 103 6.572 3.679 -8.173 1.00 0.00 C ATOM 479 O ILE B 103 5.902 4.483 -8.820 1.00 0.00 O ATOM 480 CB ILE B 103 7.325 4.470 -5.927 1.00 0.00 C ATOM 481 CG1 ILE B 103 6.265 5.575 -5.941 1.00 0.00 C ATOM 482 CG2 ILE B 103 8.515 4.884 -5.077 1.00 0.00 C ATOM 483 CD1 ILE B 103 5.655 5.844 -4.583 1.00 0.00 C ATOM 0 H ILE B 103 7.794 6.001 -8.331 1.00 0.00 H new ATOM 0 HA ILE B 103 8.517 3.339 -7.328 1.00 0.00 H new ATOM 0 HB ILE B 103 6.882 3.575 -5.490 1.00 0.00 H new ATOM 0 HG12 ILE B 103 6.715 6.494 -6.317 1.00 0.00 H new ATOM 0 HG13 ILE B 103 5.473 5.299 -6.638 1.00 0.00 H new ATOM 0 HG21 ILE B 103 8.178 5.113 -4.066 1.00 0.00 H new ATOM 0 HG22 ILE B 103 9.238 4.069 -5.042 1.00 0.00 H new ATOM 0 HG23 ILE B 103 8.983 5.767 -5.512 1.00 0.00 H new ATOM 0 HD11 ILE B 103 4.913 6.638 -4.668 1.00 0.00 H new ATOM 0 HD12 ILE B 103 5.176 4.937 -4.213 1.00 0.00 H new ATOM 0 HD13 ILE B 103 6.436 6.151 -3.888 1.00 0.00 H new ATOM 495 N PHE B 104 6.300 2.379 -8.127 1.00 0.00 N ATOM 496 CA PHE B 104 5.170 1.809 -8.853 1.00 0.00 C ATOM 497 C PHE B 104 4.030 1.465 -7.899 1.00 0.00 C ATOM 498 O PHE B 104 4.248 0.866 -6.846 1.00 0.00 O ATOM 499 CB PHE B 104 5.604 0.556 -9.616 1.00 0.00 C ATOM 500 CG PHE B 104 6.867 0.741 -10.400 1.00 0.00 C ATOM 501 CD1 PHE B 104 7.037 1.854 -11.210 1.00 0.00 C ATOM 502 CD2 PHE B 104 7.882 -0.200 -10.340 1.00 0.00 C ATOM 503 CE1 PHE B 104 8.198 2.025 -11.940 1.00 0.00 C ATOM 504 CE2 PHE B 104 9.044 -0.034 -11.070 1.00 0.00 C ATOM 505 CZ PHE B 104 9.202 1.080 -11.870 1.00 0.00 C ATOM 0 H PHE B 104 6.846 1.701 -7.595 1.00 0.00 H new ATOM 0 HA PHE B 104 4.815 2.555 -9.565 1.00 0.00 H new ATOM 0 HB2 PHE B 104 5.742 -0.261 -8.908 1.00 0.00 H new ATOM 0 HB3 PHE B 104 4.805 0.259 -10.295 1.00 0.00 H new ATOM 0 HD1 PHE B 104 6.254 2.595 -11.271 1.00 0.00 H new ATOM 0 HD2 PHE B 104 7.764 -1.073 -9.716 1.00 0.00 H new ATOM 0 HE1 PHE B 104 8.320 2.897 -12.565 1.00 0.00 H new ATOM 0 HE2 PHE B 104 9.828 -0.775 -11.015 1.00 0.00 H new ATOM 0 HZ PHE B 104 10.110 1.212 -12.440 1.00 0.00 H new ATOM 515 N VAL B 105 2.813 1.846 -8.276 1.00 0.00 N ATOM 516 CA VAL B 105 1.639 1.576 -7.453 1.00 0.00 C ATOM 517 C VAL B 105 0.685 0.619 -8.160 1.00 0.00 C ATOM 518 O VAL B 105 0.067 0.973 -9.163 1.00 0.00 O ATOM 519 CB VAL B 105 0.884 2.873 -7.106 1.00 0.00 C ATOM 520 CG1 VAL B 105 -0.240 2.592 -6.121 1.00 0.00 C ATOM 521 CG2 VAL B 105 1.842 3.915 -6.548 1.00 0.00 C ATOM 0 H VAL B 105 2.614 2.342 -9.145 1.00 0.00 H new ATOM 0 HA VAL B 105 1.996 1.117 -6.531 1.00 0.00 H new ATOM 0 HB VAL B 105 0.443 3.269 -8.021 1.00 0.00 H new ATOM 0 HG11 VAL B 105 -0.761 3.521 -5.889 1.00 0.00 H new ATOM 0 HG12 VAL B 105 -0.941 1.883 -6.562 1.00 0.00 H new ATOM 0 HG13 VAL B 105 0.175 2.170 -5.206 1.00 0.00 H new ATOM 0 HG21 VAL B 105 1.291 4.825 -6.309 1.00 0.00 H new ATOM 0 HG22 VAL B 105 2.314 3.528 -5.645 1.00 0.00 H new ATOM 0 HG23 VAL B 105 2.608 4.140 -7.290 1.00 0.00 H new ATOM 531 N LYS B 106 0.572 -0.596 -7.631 1.00 0.00 N ATOM 532 CA LYS B 106 -0.304 -1.605 -8.215 1.00 0.00 C ATOM 533 C LYS B 106 -1.652 -1.644 -7.500 1.00 0.00 C ATOM 534 O LYS B 106 -1.726 -1.937 -6.307 1.00 0.00 O ATOM 535 CB LYS B 106 0.359 -2.982 -8.151 1.00 0.00 C ATOM 536 CG LYS B 106 -0.010 -3.889 -9.313 1.00 0.00 C ATOM 537 CD LYS B 106 1.126 -4.839 -9.660 1.00 0.00 C ATOM 538 CE LYS B 106 0.607 -6.116 -10.300 1.00 0.00 C ATOM 539 NZ LYS B 106 1.677 -7.142 -10.430 1.00 0.00 N ATOM 0 H LYS B 106 1.076 -0.905 -6.800 1.00 0.00 H new ATOM 0 HA LYS B 106 -0.477 -1.337 -9.257 1.00 0.00 H new ATOM 0 HB2 LYS B 106 1.441 -2.854 -8.130 1.00 0.00 H new ATOM 0 HB3 LYS B 106 0.077 -3.469 -7.217 1.00 0.00 H new ATOM 0 HG2 LYS B 106 -0.901 -4.463 -9.059 1.00 0.00 H new ATOM 0 HG3 LYS B 106 -0.258 -3.283 -10.184 1.00 0.00 H new ATOM 0 HD2 LYS B 106 1.820 -4.345 -10.341 1.00 0.00 H new ATOM 0 HD3 LYS B 106 1.685 -5.084 -8.757 1.00 0.00 H new ATOM 0 HE2 LYS B 106 -0.210 -6.517 -9.701 1.00 0.00 H new ATOM 0 HE3 LYS B 106 0.199 -5.889 -11.285 1.00 0.00 H new ATOM 0 HZ1 LYS B 106 1.285 -7.999 -10.871 1.00 0.00 H new ATOM 0 HZ2 LYS B 106 2.446 -6.769 -11.023 1.00 0.00 H new ATOM 0 HZ3 LYS B 106 2.049 -7.377 -9.488 1.00 0.00 H new ATOM 553 N THR B 107 -2.716 -1.351 -8.241 1.00 0.00 N ATOM 554 CA THR B 107 -4.064 -1.357 -7.683 1.00 0.00 C ATOM 555 C THR B 107 -4.711 -2.728 -7.841 1.00 0.00 C ATOM 556 O THR B 107 -4.384 -3.477 -8.762 1.00 0.00 O ATOM 557 CB THR B 107 -4.925 -0.293 -8.366 1.00 0.00 C ATOM 558 OG1 THR B 107 -4.786 -0.365 -9.774 1.00 0.00 O ATOM 559 CG2 THR B 107 -4.582 1.118 -7.942 1.00 0.00 C ATOM 0 H THR B 107 -2.671 -1.106 -9.230 1.00 0.00 H new ATOM 0 HA THR B 107 -3.992 -1.129 -6.620 1.00 0.00 H new ATOM 0 HB THR B 107 -5.948 -0.508 -8.058 1.00 0.00 H new ATOM 0 HG1 THR B 107 -3.865 -0.141 -10.024 1.00 0.00 H new ATOM 0 HG21 THR B 107 -5.230 1.822 -8.464 1.00 0.00 H new ATOM 0 HG22 THR B 107 -4.727 1.220 -6.866 1.00 0.00 H new ATOM 0 HG23 THR B 107 -3.542 1.330 -8.190 1.00 0.00 H new ATOM 567 N LEU B 108 -5.633 -3.051 -6.939 1.00 0.00 N ATOM 568 CA LEU B 108 -6.327 -4.333 -6.984 1.00 0.00 C ATOM 569 C LEU B 108 -7.249 -4.417 -8.199 1.00 0.00 C ATOM 570 O LEU B 108 -7.766 -5.487 -8.521 1.00 0.00 O ATOM 571 CB LEU B 108 -7.136 -4.551 -5.701 1.00 0.00 C ATOM 572 CG LEU B 108 -6.356 -4.392 -4.390 1.00 0.00 C ATOM 573 CD1 LEU B 108 -7.033 -5.171 -3.272 1.00 0.00 C ATOM 574 CD2 LEU B 108 -4.913 -4.849 -4.556 1.00 0.00 C ATOM 0 H LEU B 108 -5.916 -2.444 -6.170 1.00 0.00 H new ATOM 0 HA LEU B 108 -5.574 -5.116 -7.068 1.00 0.00 H new ATOM 0 HB2 LEU B 108 -7.969 -3.848 -5.695 1.00 0.00 H new ATOM 0 HB3 LEU B 108 -7.564 -5.553 -5.729 1.00 0.00 H new ATOM 0 HG LEU B 108 -6.349 -3.335 -4.126 1.00 0.00 H new ATOM 0 HD11 LEU B 108 -6.467 -5.048 -2.348 1.00 0.00 H new ATOM 0 HD12 LEU B 108 -8.047 -4.796 -3.129 1.00 0.00 H new ATOM 0 HD13 LEU B 108 -7.071 -6.228 -3.536 1.00 0.00 H new ATOM 0 HD21 LEU B 108 -4.382 -4.726 -3.612 1.00 0.00 H new ATOM 0 HD22 LEU B 108 -4.895 -5.899 -4.848 1.00 0.00 H new ATOM 0 HD23 LEU B 108 -4.428 -4.250 -5.326 1.00 0.00 H new ATOM 586 N THR B 109 -7.454 -3.287 -8.871 1.00 0.00 N ATOM 587 CA THR B 109 -8.314 -3.246 -10.040 1.00 0.00 C ATOM 588 C THR B 109 -7.590 -3.786 -11.270 1.00 0.00 C ATOM 589 O THR B 109 -8.221 -4.143 -12.270 1.00 0.00 O ATOM 590 CB THR B 109 -8.787 -1.815 -10.300 1.00 0.00 C ATOM 591 OG1 THR B 109 -7.702 -0.907 -10.230 1.00 0.00 O ATOM 592 CG2 THR B 109 -9.843 -1.346 -9.332 1.00 0.00 C ATOM 0 H THR B 109 -7.035 -2.391 -8.623 1.00 0.00 H new ATOM 0 HA THR B 109 -9.180 -3.879 -9.845 1.00 0.00 H new ATOM 0 HB THR B 109 -9.222 -1.834 -11.299 1.00 0.00 H new ATOM 0 HG1 THR B 109 -8.025 0.002 -10.401 1.00 0.00 H new ATOM 0 HG21 THR B 109 -10.132 -0.323 -9.576 1.00 0.00 H new ATOM 0 HG22 THR B 109 -10.715 -1.996 -9.402 1.00 0.00 H new ATOM 0 HG23 THR B 109 -9.447 -1.379 -8.317 1.00 0.00 H new ATOM 600 N GLY B 110 -6.262 -3.846 -11.200 1.00 0.00 N ATOM 601 CA GLY B 110 -5.481 -4.345 -12.320 1.00 0.00 C ATOM 602 C GLY B 110 -4.736 -3.244 -13.050 1.00 0.00 C ATOM 603 O GLY B 110 -4.404 -3.382 -14.220 1.00 0.00 O ATOM 0 H GLY B 110 -5.714 -3.559 -10.389 1.00 0.00 H new ATOM 0 HA2 GLY B 110 -4.766 -5.084 -11.959 1.00 0.00 H new ATOM 0 HA3 GLY B 110 -6.142 -4.857 -13.020 1.00 0.00 H new ATOM 607 N LYS B 111 -4.471 -2.146 -12.350 1.00 0.00 N ATOM 608 CA LYS B 111 -3.761 -1.017 -12.930 1.00 0.00 C ATOM 609 C LYS B 111 -2.525 -0.669 -12.110 1.00 0.00 C ATOM 610 O LYS B 111 -2.525 -0.770 -10.890 1.00 0.00 O ATOM 611 CB LYS B 111 -4.683 0.200 -13.030 1.00 0.00 C ATOM 612 CG LYS B 111 -4.415 1.068 -14.250 1.00 0.00 C ATOM 613 CD LYS B 111 -5.551 2.048 -14.490 1.00 0.00 C ATOM 614 CE LYS B 111 -5.330 2.849 -15.770 1.00 0.00 C ATOM 615 NZ LYS B 111 -6.591 3.473 -16.260 1.00 0.00 N ATOM 0 H LYS B 111 -4.740 -2.016 -11.375 1.00 0.00 H new ATOM 0 HA LYS B 111 -3.440 -1.301 -13.932 1.00 0.00 H new ATOM 0 HB2 LYS B 111 -5.718 -0.140 -13.057 1.00 0.00 H new ATOM 0 HB3 LYS B 111 -4.570 0.806 -12.131 1.00 0.00 H new ATOM 0 HG2 LYS B 111 -3.483 1.615 -14.112 1.00 0.00 H new ATOM 0 HG3 LYS B 111 -4.286 0.435 -15.128 1.00 0.00 H new ATOM 0 HD2 LYS B 111 -6.494 1.506 -14.556 1.00 0.00 H new ATOM 0 HD3 LYS B 111 -5.633 2.728 -13.642 1.00 0.00 H new ATOM 0 HE2 LYS B 111 -4.587 3.626 -15.588 1.00 0.00 H new ATOM 0 HE3 LYS B 111 -4.925 2.195 -16.542 1.00 0.00 H new ATOM 0 HZ1 LYS B 111 -6.398 4.008 -17.131 1.00 0.00 H new ATOM 0 HZ2 LYS B 111 -7.292 2.730 -16.458 1.00 0.00 H new ATOM 0 HZ3 LYS B 111 -6.965 4.117 -15.534 1.00 0.00 H new ATOM 629 N THR B 112 -1.473 -0.263 -12.810 1.00 0.00 N ATOM 630 CA THR B 112 -0.219 0.102 -12.170 1.00 0.00 C ATOM 631 C THR B 112 0.134 1.556 -12.470 1.00 0.00 C ATOM 632 O THR B 112 0.037 1.998 -13.620 1.00 0.00 O ATOM 633 CB THR B 112 0.894 -0.837 -12.640 1.00 0.00 C ATOM 634 OG1 THR B 112 0.791 -2.095 -12.000 1.00 0.00 O ATOM 635 CG2 THR B 112 2.292 -0.310 -12.390 1.00 0.00 C ATOM 0 H THR B 112 -1.466 -0.179 -13.826 1.00 0.00 H new ATOM 0 HA THR B 112 -0.329 0.001 -11.090 1.00 0.00 H new ATOM 0 HB THR B 112 0.751 -0.922 -13.717 1.00 0.00 H new ATOM 0 HG1 THR B 112 1.510 -2.682 -12.315 1.00 0.00 H new ATOM 0 HG21 THR B 112 3.023 -1.033 -12.751 1.00 0.00 H new ATOM 0 HG22 THR B 112 2.425 0.635 -12.918 1.00 0.00 H new ATOM 0 HG23 THR B 112 2.435 -0.152 -11.321 1.00 0.00 H new ATOM 643 N ILE B 113 0.539 2.295 -11.450 1.00 0.00 N ATOM 644 CA ILE B 113 0.900 3.698 -11.620 1.00 0.00 C ATOM 645 C ILE B 113 2.353 3.950 -11.240 1.00 0.00 C ATOM 646 O ILE B 113 2.841 3.455 -10.220 1.00 0.00 O ATOM 647 CB ILE B 113 0.009 4.628 -10.770 1.00 0.00 C ATOM 648 CG1 ILE B 113 -1.443 4.147 -10.780 1.00 0.00 C ATOM 649 CG2 ILE B 113 0.101 6.057 -11.280 1.00 0.00 C ATOM 650 CD1 ILE B 113 -2.379 5.035 -9.991 1.00 0.00 C ATOM 0 H ILE B 113 0.627 1.949 -10.494 1.00 0.00 H new ATOM 0 HA ILE B 113 0.751 3.921 -12.676 1.00 0.00 H new ATOM 0 HB ILE B 113 0.368 4.602 -9.741 1.00 0.00 H new ATOM 0 HG12 ILE B 113 -1.792 4.091 -11.811 1.00 0.00 H new ATOM 0 HG13 ILE B 113 -1.485 3.136 -10.374 1.00 0.00 H new ATOM 0 HG21 ILE B 113 -0.533 6.702 -10.671 1.00 0.00 H new ATOM 0 HG22 ILE B 113 1.134 6.400 -11.218 1.00 0.00 H new ATOM 0 HG23 ILE B 113 -0.232 6.095 -12.317 1.00 0.00 H new ATOM 0 HD11 ILE B 113 -3.391 4.633 -10.042 1.00 0.00 H new ATOM 0 HD12 ILE B 113 -2.055 5.072 -8.951 1.00 0.00 H new ATOM 0 HD13 ILE B 113 -2.366 6.041 -10.411 1.00 0.00 H new ATOM 662 N THR B 114 3.030 4.742 -12.050 1.00 0.00 N ATOM 663 CA THR B 114 4.421 5.092 -11.810 1.00 0.00 C ATOM 664 C THR B 114 4.525 6.565 -11.440 1.00 0.00 C ATOM 665 O THR B 114 3.929 7.420 -12.090 1.00 0.00 O ATOM 666 CB THR B 114 5.278 4.798 -13.040 1.00 0.00 C ATOM 667 OG1 THR B 114 4.978 3.517 -13.570 1.00 0.00 O ATOM 668 CG2 THR B 114 6.764 4.843 -12.760 1.00 0.00 C ATOM 0 H THR B 114 2.634 5.161 -12.891 1.00 0.00 H new ATOM 0 HA THR B 114 4.793 4.485 -10.984 1.00 0.00 H new ATOM 0 HB THR B 114 5.035 5.586 -13.753 1.00 0.00 H new ATOM 0 HG1 THR B 114 5.470 2.833 -13.070 1.00 0.00 H new ATOM 0 HG21 THR B 114 7.314 4.625 -13.676 1.00 0.00 H new ATOM 0 HG22 THR B 114 7.037 5.835 -12.400 1.00 0.00 H new ATOM 0 HG23 THR B 114 7.014 4.101 -12.002 1.00 0.00 H new ATOM 676 N LEU B 115 5.268 6.858 -10.380 1.00 0.00 N ATOM 677 CA LEU B 115 5.425 8.231 -9.934 1.00 0.00 C ATOM 678 C LEU B 115 6.853 8.503 -9.487 1.00 0.00 C ATOM 679 O LEU B 115 7.649 7.581 -9.312 1.00 0.00 O ATOM 680 CB LEU B 115 4.460 8.514 -8.783 1.00 0.00 C ATOM 681 CG LEU B 115 2.985 8.601 -9.183 1.00 0.00 C ATOM 682 CD1 LEU B 115 2.098 8.032 -8.086 1.00 0.00 C ATOM 683 CD2 LEU B 115 2.600 10.041 -9.486 1.00 0.00 C ATOM 0 H LEU B 115 5.767 6.167 -9.819 1.00 0.00 H new ATOM 0 HA LEU B 115 5.199 8.890 -10.772 1.00 0.00 H new ATOM 0 HB2 LEU B 115 4.572 7.731 -8.034 1.00 0.00 H new ATOM 0 HB3 LEU B 115 4.748 9.452 -8.309 1.00 0.00 H new ATOM 0 HG LEU B 115 2.838 8.007 -10.085 1.00 0.00 H new ATOM 0 HD11 LEU B 115 1.053 8.103 -8.389 1.00 0.00 H new ATOM 0 HD12 LEU B 115 2.356 6.987 -7.915 1.00 0.00 H new ATOM 0 HD13 LEU B 115 2.248 8.598 -7.167 1.00 0.00 H new ATOM 0 HD21 LEU B 115 1.548 10.085 -9.769 1.00 0.00 H new ATOM 0 HD22 LEU B 115 2.764 10.655 -8.601 1.00 0.00 H new ATOM 0 HD23 LEU B 115 3.212 10.416 -10.306 1.00 0.00 H new ATOM 695 N GLU B 116 7.164 9.778 -9.300 1.00 0.00 N ATOM 696 CA GLU B 116 8.481 10.189 -8.869 1.00 0.00 C ATOM 697 C GLU B 116 8.445 10.642 -7.417 1.00 0.00 C ATOM 698 O GLU B 116 7.811 11.641 -7.076 1.00 0.00 O ATOM 699 CB GLU B 116 8.999 11.313 -9.766 1.00 0.00 C ATOM 700 CG GLU B 116 8.406 12.679 -9.457 1.00 0.00 C ATOM 701 CD GLU B 116 8.324 13.571 -10.680 1.00 0.00 C ATOM 702 OE1 GLU B 116 9.318 13.637 -11.430 1.00 0.00 O ATOM 703 OE2 GLU B 116 7.266 14.203 -10.880 1.00 0.00 O ATOM 0 H GLU B 116 6.511 10.548 -9.443 1.00 0.00 H new ATOM 0 HA GLU B 116 9.158 9.338 -8.948 1.00 0.00 H new ATOM 0 HB2 GLU B 116 10.083 11.370 -9.670 1.00 0.00 H new ATOM 0 HB3 GLU B 116 8.784 11.062 -10.805 1.00 0.00 H new ATOM 0 HG2 GLU B 116 7.408 12.551 -9.038 1.00 0.00 H new ATOM 0 HG3 GLU B 116 9.011 13.169 -8.695 1.00 0.00 H new ATOM 710 N VAL B 117 9.130 9.903 -6.568 1.00 0.00 N ATOM 711 CA VAL B 117 9.186 10.223 -5.158 1.00 0.00 C ATOM 712 C VAL B 117 10.621 10.184 -4.676 1.00 0.00 C ATOM 713 O VAL B 117 11.529 9.855 -5.438 1.00 0.00 O ATOM 714 CB VAL B 117 8.344 9.243 -4.321 1.00 0.00 C ATOM 715 CG1 VAL B 117 6.866 9.395 -4.644 1.00 0.00 C ATOM 716 CG2 VAL B 117 8.804 7.812 -4.554 1.00 0.00 C ATOM 0 H VAL B 117 9.658 9.072 -6.833 1.00 0.00 H new ATOM 0 HA VAL B 117 8.776 11.225 -5.030 1.00 0.00 H new ATOM 0 HB VAL B 117 8.486 9.480 -3.267 1.00 0.00 H new ATOM 0 HG11 VAL B 117 6.288 8.694 -4.042 1.00 0.00 H new ATOM 0 HG12 VAL B 117 6.548 10.413 -4.421 1.00 0.00 H new ATOM 0 HG13 VAL B 117 6.701 9.187 -5.701 1.00 0.00 H new ATOM 0 HG21 VAL B 117 8.198 7.133 -3.954 1.00 0.00 H new ATOM 0 HG22 VAL B 117 8.694 7.562 -5.609 1.00 0.00 H new ATOM 0 HG23 VAL B 117 9.851 7.715 -4.266 1.00 0.00 H new ATOM 726 N GLU B 118 10.828 10.518 -3.417 1.00 0.00 N ATOM 727 CA GLU B 118 12.164 10.509 -2.854 1.00 0.00 C ATOM 728 C GLU B 118 12.223 9.619 -1.617 1.00 0.00 C ATOM 729 O GLU B 118 11.200 9.344 -0.992 1.00 0.00 O ATOM 730 CB GLU B 118 12.600 11.930 -2.496 1.00 0.00 C ATOM 731 CG GLU B 118 13.631 12.510 -3.450 1.00 0.00 C ATOM 732 CD GLU B 118 14.712 13.295 -2.733 1.00 0.00 C ATOM 733 OE1 GLU B 118 14.521 14.511 -2.521 1.00 0.00 O ATOM 734 OE2 GLU B 118 15.749 12.694 -2.382 1.00 0.00 O ATOM 0 H GLU B 118 10.093 10.797 -2.768 1.00 0.00 H new ATOM 0 HA GLU B 118 12.846 10.107 -3.604 1.00 0.00 H new ATOM 0 HB2 GLU B 118 11.723 12.578 -2.484 1.00 0.00 H new ATOM 0 HB3 GLU B 118 13.011 11.931 -1.486 1.00 0.00 H new ATOM 0 HG2 GLU B 118 14.091 11.701 -4.018 1.00 0.00 H new ATOM 0 HG3 GLU B 118 13.131 13.160 -4.168 1.00 0.00 H new ATOM 741 N PRO B 119 13.428 9.163 -1.239 1.00 0.00 N ATOM 742 CA PRO B 119 13.611 8.310 -0.065 1.00 0.00 C ATOM 743 C PRO B 119 13.589 9.107 1.236 1.00 0.00 C ATOM 744 O PRO B 119 13.690 8.541 2.323 1.00 0.00 O ATOM 745 CB PRO B 119 14.989 7.702 -0.303 1.00 0.00 C ATOM 746 CG PRO B 119 15.730 8.750 -1.058 1.00 0.00 C ATOM 747 CD PRO B 119 14.708 9.450 -1.917 1.00 0.00 C ATOM 0 HA PRO B 119 12.815 7.574 0.046 1.00 0.00 H new ATOM 0 HB2 PRO B 119 15.486 7.463 0.637 1.00 0.00 H new ATOM 0 HB3 PRO B 119 14.921 6.775 -0.872 1.00 0.00 H new ATOM 0 HG2 PRO B 119 16.213 9.451 -0.378 1.00 0.00 H new ATOM 0 HG3 PRO B 119 16.516 8.307 -1.670 1.00 0.00 H new ATOM 0 HD2 PRO B 119 14.899 10.522 -1.975 1.00 0.00 H new ATOM 0 HD3 PRO B 119 14.715 9.069 -2.938 1.00 0.00 H new ATOM 755 N SER B 120 13.453 10.424 1.116 1.00 0.00 N ATOM 756 CA SER B 120 13.414 11.298 2.282 1.00 0.00 C ATOM 757 C SER B 120 12.012 11.865 2.490 1.00 0.00 C ATOM 758 O SER B 120 11.661 12.289 3.591 1.00 0.00 O ATOM 759 CB SER B 120 14.419 12.440 2.124 1.00 0.00 C ATOM 760 OG SER B 120 15.034 12.754 3.361 1.00 0.00 O ATOM 0 H SER B 120 13.368 10.909 0.223 1.00 0.00 H new ATOM 0 HA SER B 120 13.682 10.706 3.157 1.00 0.00 H new ATOM 0 HB2 SER B 120 15.181 12.160 1.397 1.00 0.00 H new ATOM 0 HB3 SER B 120 13.913 13.322 1.732 1.00 0.00 H new ATOM 0 HG SER B 120 15.673 13.486 3.232 1.00 0.00 H new ATOM 766 N ASP B 121 11.214 11.868 1.425 1.00 0.00 N ATOM 767 CA ASP B 121 9.852 12.382 1.494 1.00 0.00 C ATOM 768 C ASP B 121 9.022 11.583 2.494 1.00 0.00 C ATOM 769 O ASP B 121 9.558 10.795 3.273 1.00 0.00 O ATOM 770 CB ASP B 121 9.197 12.334 0.112 1.00 0.00 C ATOM 771 CG ASP B 121 8.348 13.558 -0.170 1.00 0.00 C ATOM 772 OD1 ASP B 121 8.578 14.602 0.476 1.00 0.00 O ATOM 773 OD2 ASP B 121 7.454 13.473 -1.037 1.00 0.00 O ATOM 0 H ASP B 121 11.488 11.520 0.506 1.00 0.00 H new ATOM 0 HA ASP B 121 9.895 13.418 1.831 1.00 0.00 H new ATOM 0 HB2 ASP B 121 9.971 12.249 -0.651 1.00 0.00 H new ATOM 0 HB3 ASP B 121 8.577 11.441 0.038 1.00 0.00 H new ATOM 778 N THR B 122 7.710 11.791 2.463 1.00 0.00 N ATOM 779 CA THR B 122 6.804 11.091 3.361 1.00 0.00 C ATOM 780 C THR B 122 5.636 10.496 2.585 1.00 0.00 C ATOM 781 O THR B 122 5.293 10.970 1.502 1.00 0.00 O ATOM 782 CB THR B 122 6.284 12.043 4.440 1.00 0.00 C ATOM 783 OG1 THR B 122 5.848 13.261 3.865 1.00 0.00 O ATOM 784 CG2 THR B 122 7.319 12.377 5.492 1.00 0.00 C ATOM 0 H THR B 122 7.251 12.440 1.824 1.00 0.00 H new ATOM 0 HA THR B 122 7.354 10.281 3.840 1.00 0.00 H new ATOM 0 HB THR B 122 5.460 11.515 4.919 1.00 0.00 H new ATOM 0 HG1 THR B 122 5.668 13.912 4.575 1.00 0.00 H new ATOM 0 HG21 THR B 122 6.885 13.056 6.226 1.00 0.00 H new ATOM 0 HG22 THR B 122 7.641 11.462 5.989 1.00 0.00 H new ATOM 0 HG23 THR B 122 8.177 12.854 5.019 1.00 0.00 H new ATOM 792 N ILE B 123 5.028 9.458 3.144 1.00 0.00 N ATOM 793 CA ILE B 123 3.896 8.804 2.500 1.00 0.00 C ATOM 794 C ILE B 123 2.760 9.791 2.268 1.00 0.00 C ATOM 795 O ILE B 123 2.008 9.675 1.300 1.00 0.00 O ATOM 796 CB ILE B 123 3.369 7.623 3.337 1.00 0.00 C ATOM 797 CG1 ILE B 123 4.521 6.710 3.765 1.00 0.00 C ATOM 798 CG2 ILE B 123 2.330 6.839 2.551 1.00 0.00 C ATOM 799 CD1 ILE B 123 5.350 6.198 2.607 1.00 0.00 C ATOM 0 H ILE B 123 5.299 9.051 4.040 1.00 0.00 H new ATOM 0 HA ILE B 123 4.254 8.424 1.543 1.00 0.00 H new ATOM 0 HB ILE B 123 2.896 8.020 4.235 1.00 0.00 H new ATOM 0 HG12 ILE B 123 5.169 7.254 4.452 1.00 0.00 H new ATOM 0 HG13 ILE B 123 4.115 5.860 4.314 1.00 0.00 H new ATOM 0 HG21 ILE B 123 1.967 6.008 3.156 1.00 0.00 H new ATOM 0 HG22 ILE B 123 1.496 7.493 2.296 1.00 0.00 H new ATOM 0 HG23 ILE B 123 2.781 6.453 1.637 1.00 0.00 H new ATOM 0 HD11 ILE B 123 6.147 5.558 2.985 1.00 0.00 H new ATOM 0 HD12 ILE B 123 4.715 5.626 1.930 1.00 0.00 H new ATOM 0 HD13 ILE B 123 5.785 7.041 2.070 1.00 0.00 H new ATOM 811 N GLU B 124 2.643 10.766 3.164 1.00 0.00 N ATOM 812 CA GLU B 124 1.602 11.780 3.059 1.00 0.00 C ATOM 813 C GLU B 124 1.738 12.558 1.756 1.00 0.00 C ATOM 814 O GLU B 124 0.744 12.985 1.168 1.00 0.00 O ATOM 815 CB GLU B 124 1.664 12.731 4.256 1.00 0.00 C ATOM 816 CG GLU B 124 2.914 13.596 4.286 1.00 0.00 C ATOM 817 CD GLU B 124 2.787 14.770 5.237 1.00 0.00 C ATOM 818 OE1 GLU B 124 1.650 15.244 5.447 1.00 0.00 O ATOM 819 OE2 GLU B 124 3.824 15.215 5.772 1.00 0.00 O ATOM 0 H GLU B 124 3.257 10.875 3.971 1.00 0.00 H new ATOM 0 HA GLU B 124 0.634 11.280 3.060 1.00 0.00 H new ATOM 0 HB2 GLU B 124 0.786 13.377 4.241 1.00 0.00 H new ATOM 0 HB3 GLU B 124 1.615 12.147 5.175 1.00 0.00 H new ATOM 0 HG2 GLU B 124 3.767 12.985 4.581 1.00 0.00 H new ATOM 0 HG3 GLU B 124 3.119 13.967 3.282 1.00 0.00 H new ATOM 826 N ASN B 125 2.976 12.730 1.303 1.00 0.00 N ATOM 827 CA ASN B 125 3.239 13.447 0.063 1.00 0.00 C ATOM 828 C ASN B 125 2.956 12.549 -1.135 1.00 0.00 C ATOM 829 O ASN B 125 2.449 13.003 -2.160 1.00 0.00 O ATOM 830 CB ASN B 125 4.688 13.940 0.027 1.00 0.00 C ATOM 831 CG ASN B 125 4.788 15.417 -0.302 1.00 0.00 C ATOM 832 OD1 ASN B 125 4.267 15.875 -1.319 1.00 0.00 O ATOM 833 ND2 ASN B 125 5.460 16.170 0.560 1.00 0.00 N ATOM 0 H ASN B 125 3.810 12.383 1.776 1.00 0.00 H new ATOM 0 HA ASN B 125 2.578 14.312 0.015 1.00 0.00 H new ATOM 0 HB2 ASN B 125 5.157 13.753 0.993 1.00 0.00 H new ATOM 0 HB3 ASN B 125 5.246 13.367 -0.714 1.00 0.00 H new ATOM 0 HD21 ASN B 125 5.561 17.171 0.392 1.00 0.00 H new ATOM 0 HD22 ASN B 125 5.876 15.748 1.390 1.00 0.00 H new ATOM 840 N VAL B 126 3.272 11.267 -0.989 1.00 0.00 N ATOM 841 CA VAL B 126 3.035 10.300 -2.050 1.00 0.00 C ATOM 842 C VAL B 126 1.544 10.026 -2.182 1.00 0.00 C ATOM 843 O VAL B 126 1.025 9.865 -3.286 1.00 0.00 O ATOM 844 CB VAL B 126 3.772 8.974 -1.783 1.00 0.00 C ATOM 845 CG1 VAL B 126 3.629 8.034 -2.971 1.00 0.00 C ATOM 846 CG2 VAL B 126 5.238 9.231 -1.471 1.00 0.00 C ATOM 0 H VAL B 126 3.692 10.875 -0.146 1.00 0.00 H new ATOM 0 HA VAL B 126 3.419 10.727 -2.976 1.00 0.00 H new ATOM 0 HB VAL B 126 3.318 8.496 -0.915 1.00 0.00 H new ATOM 0 HG11 VAL B 126 4.156 7.103 -2.764 1.00 0.00 H new ATOM 0 HG12 VAL B 126 2.574 7.823 -3.143 1.00 0.00 H new ATOM 0 HG13 VAL B 126 4.055 8.502 -3.859 1.00 0.00 H new ATOM 0 HG21 VAL B 126 5.742 8.283 -1.285 1.00 0.00 H new ATOM 0 HG22 VAL B 126 5.708 9.732 -2.317 1.00 0.00 H new ATOM 0 HG23 VAL B 126 5.316 9.863 -0.586 1.00 0.00 H new ATOM 856 N LYS B 127 0.857 9.988 -1.044 1.00 0.00 N ATOM 857 CA LYS B 127 -0.579 9.751 -1.027 1.00 0.00 C ATOM 858 C LYS B 127 -1.311 10.928 -1.657 1.00 0.00 C ATOM 859 O LYS B 127 -2.286 10.748 -2.387 1.00 0.00 O ATOM 860 CB LYS B 127 -1.068 9.527 0.407 1.00 0.00 C ATOM 861 CG LYS B 127 -1.790 8.205 0.603 1.00 0.00 C ATOM 862 CD LYS B 127 -1.900 7.842 2.075 1.00 0.00 C ATOM 863 CE LYS B 127 -2.243 6.373 2.263 1.00 0.00 C ATOM 864 NZ LYS B 127 -1.535 5.783 3.433 1.00 0.00 N ATOM 0 H LYS B 127 1.274 10.119 -0.122 1.00 0.00 H new ATOM 0 HA LYS B 127 -0.791 8.853 -1.608 1.00 0.00 H new ATOM 0 HB2 LYS B 127 -0.215 9.569 1.084 1.00 0.00 H new ATOM 0 HB3 LYS B 127 -1.737 10.342 0.686 1.00 0.00 H new ATOM 0 HG2 LYS B 127 -2.787 8.266 0.167 1.00 0.00 H new ATOM 0 HG3 LYS B 127 -1.257 7.416 0.072 1.00 0.00 H new ATOM 0 HD2 LYS B 127 -0.958 8.064 2.577 1.00 0.00 H new ATOM 0 HD3 LYS B 127 -2.665 8.459 2.547 1.00 0.00 H new ATOM 0 HE2 LYS B 127 -3.319 6.266 2.398 1.00 0.00 H new ATOM 0 HE3 LYS B 127 -1.978 5.820 1.362 1.00 0.00 H new ATOM 0 HZ1 LYS B 127 -1.796 4.781 3.527 1.00 0.00 H new ATOM 0 HZ2 LYS B 127 -0.508 5.862 3.293 1.00 0.00 H new ATOM 0 HZ3 LYS B 127 -1.807 6.294 4.297 1.00 0.00 H new ATOM 878 N ALA B 128 -0.822 12.133 -1.384 1.00 0.00 N ATOM 879 CA ALA B 128 -1.418 13.339 -1.940 1.00 0.00 C ATOM 880 C ALA B 128 -1.072 13.466 -3.419 1.00 0.00 C ATOM 881 O ALA B 128 -1.784 14.116 -4.184 1.00 0.00 O ATOM 882 CB ALA B 128 -0.944 14.565 -1.174 1.00 0.00 C ATOM 0 H ALA B 128 -0.016 12.299 -0.782 1.00 0.00 H new ATOM 0 HA ALA B 128 -2.501 13.270 -1.843 1.00 0.00 H new ATOM 0 HB1 ALA B 128 -1.398 15.459 -1.601 1.00 0.00 H new ATOM 0 HB2 ALA B 128 -1.235 14.475 -0.127 1.00 0.00 H new ATOM 0 HB3 ALA B 128 0.141 14.641 -1.244 1.00 0.00 H new ATOM 888 N LYS B 129 0.029 12.830 -3.813 1.00 0.00 N ATOM 889 CA LYS B 129 0.484 12.852 -5.191 1.00 0.00 C ATOM 890 C LYS B 129 -0.347 11.899 -6.042 1.00 0.00 C ATOM 891 O LYS B 129 -0.730 12.229 -7.165 1.00 0.00 O ATOM 892 CB LYS B 129 1.960 12.467 -5.223 1.00 0.00 C ATOM 893 CG LYS B 129 2.544 12.309 -6.611 1.00 0.00 C ATOM 894 CD LYS B 129 3.756 11.396 -6.575 1.00 0.00 C ATOM 895 CE LYS B 129 5.001 12.136 -6.115 1.00 0.00 C ATOM 896 NZ LYS B 129 4.802 12.821 -4.809 1.00 0.00 N ATOM 0 H LYS B 129 0.624 12.289 -3.186 1.00 0.00 H new ATOM 0 HA LYS B 129 0.362 13.853 -5.606 1.00 0.00 H new ATOM 0 HB2 LYS B 129 2.531 13.226 -4.688 1.00 0.00 H new ATOM 0 HB3 LYS B 129 2.089 11.530 -4.681 1.00 0.00 H new ATOM 0 HG2 LYS B 129 1.792 11.898 -7.284 1.00 0.00 H new ATOM 0 HG3 LYS B 129 2.827 13.284 -7.006 1.00 0.00 H new ATOM 0 HD2 LYS B 129 3.562 10.559 -5.905 1.00 0.00 H new ATOM 0 HD3 LYS B 129 3.927 10.978 -7.567 1.00 0.00 H new ATOM 0 HE2 LYS B 129 5.829 11.432 -6.031 1.00 0.00 H new ATOM 0 HE3 LYS B 129 5.283 12.871 -6.869 1.00 0.00 H new ATOM 0 HZ1 LYS B 129 5.724 12.971 -4.351 1.00 0.00 H new ATOM 0 HZ2 LYS B 129 4.340 13.740 -4.966 1.00 0.00 H new ATOM 0 HZ3 LYS B 129 4.203 12.232 -4.196 1.00 0.00 H new ATOM 910 N ILE B 130 -0.639 10.724 -5.494 1.00 0.00 N ATOM 911 CA ILE B 130 -1.443 9.737 -6.199 1.00 0.00 C ATOM 912 C ILE B 130 -2.852 10.274 -6.423 1.00 0.00 C ATOM 913 O ILE B 130 -3.492 9.973 -7.430 1.00 0.00 O ATOM 914 CB ILE B 130 -1.517 8.408 -5.420 1.00 0.00 C ATOM 915 CG1 ILE B 130 -0.111 7.860 -5.170 1.00 0.00 C ATOM 916 CG2 ILE B 130 -2.358 7.391 -6.177 1.00 0.00 C ATOM 917 CD1 ILE B 130 0.005 7.050 -3.897 1.00 0.00 C ATOM 0 H ILE B 130 -0.331 10.434 -4.566 1.00 0.00 H new ATOM 0 HA ILE B 130 -0.965 9.545 -7.159 1.00 0.00 H new ATOM 0 HB ILE B 130 -1.992 8.597 -4.457 1.00 0.00 H new ATOM 0 HG12 ILE B 130 0.183 7.238 -6.015 1.00 0.00 H new ATOM 0 HG13 ILE B 130 0.592 8.692 -5.127 1.00 0.00 H new ATOM 0 HG21 ILE B 130 -2.399 6.460 -5.612 1.00 0.00 H new ATOM 0 HG22 ILE B 130 -3.368 7.780 -6.309 1.00 0.00 H new ATOM 0 HG23 ILE B 130 -1.911 7.204 -7.153 1.00 0.00 H new ATOM 0 HD11 ILE B 130 1.029 6.693 -3.785 1.00 0.00 H new ATOM 0 HD12 ILE B 130 -0.258 7.675 -3.043 1.00 0.00 H new ATOM 0 HD13 ILE B 130 -0.673 6.198 -3.945 1.00 0.00 H new ATOM 929 N GLN B 131 -3.321 11.083 -5.477 1.00 0.00 N ATOM 930 CA GLN B 131 -4.646 11.681 -5.567 1.00 0.00 C ATOM 931 C GLN B 131 -4.708 12.652 -6.738 1.00 0.00 C ATOM 932 O GLN B 131 -5.657 12.642 -7.520 1.00 0.00 O ATOM 933 CB GLN B 131 -4.988 12.410 -4.266 1.00 0.00 C ATOM 934 CG GLN B 131 -6.452 12.297 -3.872 1.00 0.00 C ATOM 935 CD GLN B 131 -7.239 13.553 -4.190 1.00 0.00 C ATOM 936 OE1 GLN B 131 -7.445 13.892 -5.356 1.00 0.00 O ATOM 937 NE2 GLN B 131 -7.684 14.252 -3.152 1.00 0.00 N ATOM 0 H GLN B 131 -2.800 11.339 -4.638 1.00 0.00 H new ATOM 0 HA GLN B 131 -5.375 10.887 -5.728 1.00 0.00 H new ATOM 0 HB2 GLN B 131 -4.372 12.008 -3.462 1.00 0.00 H new ATOM 0 HB3 GLN B 131 -4.729 13.464 -4.371 1.00 0.00 H new ATOM 0 HG2 GLN B 131 -6.900 11.450 -4.392 1.00 0.00 H new ATOM 0 HG3 GLN B 131 -6.522 12.089 -2.804 1.00 0.00 H new ATOM 0 HE21 GLN B 131 -7.490 13.934 -2.202 1.00 0.00 H new ATOM 0 HE22 GLN B 131 -8.220 15.107 -3.305 1.00 0.00 H new ATOM 946 N ASP B 132 -3.682 13.484 -6.858 1.00 0.00 N ATOM 947 CA ASP B 132 -3.614 14.454 -7.942 1.00 0.00 C ATOM 948 C ASP B 132 -3.538 13.747 -9.293 1.00 0.00 C ATOM 949 O ASP B 132 -3.882 14.321 -10.320 1.00 0.00 O ATOM 950 CB ASP B 132 -2.401 15.369 -7.763 1.00 0.00 C ATOM 951 CG ASP B 132 -2.670 16.786 -8.231 1.00 0.00 C ATOM 952 OD1 ASP B 132 -3.254 17.568 -7.452 1.00 0.00 O ATOM 953 OD2 ASP B 132 -2.297 17.113 -9.377 1.00 0.00 O ATOM 0 H ASP B 132 -2.887 13.507 -6.219 1.00 0.00 H new ATOM 0 HA ASP B 132 -4.520 15.059 -7.915 1.00 0.00 H new ATOM 0 HB2 ASP B 132 -2.114 15.385 -6.712 1.00 0.00 H new ATOM 0 HB3 ASP B 132 -1.556 14.960 -8.318 1.00 0.00 H new ATOM 958 N LYS B 133 -3.081 12.496 -9.277 1.00 0.00 N ATOM 959 CA LYS B 133 -2.958 11.711 -10.500 1.00 0.00 C ATOM 960 C LYS B 133 -4.223 10.899 -10.760 1.00 0.00 C ATOM 961 O LYS B 133 -4.724 10.868 -11.890 1.00 0.00 O ATOM 962 CB LYS B 133 -1.748 10.777 -10.400 1.00 0.00 C ATOM 963 CG LYS B 133 -0.693 11.039 -11.460 1.00 0.00 C ATOM 964 CD LYS B 133 -0.005 9.754 -11.890 1.00 0.00 C ATOM 965 CE LYS B 133 -0.683 9.140 -13.110 1.00 0.00 C ATOM 966 NZ LYS B 133 0.298 8.498 -14.030 1.00 0.00 N ATOM 0 H LYS B 133 -2.791 12.006 -8.431 1.00 0.00 H new ATOM 0 HA LYS B 133 -2.817 12.398 -11.334 1.00 0.00 H new ATOM 0 HB2 LYS B 133 -1.296 10.885 -9.414 1.00 0.00 H new ATOM 0 HB3 LYS B 133 -2.088 9.745 -10.484 1.00 0.00 H new ATOM 0 HG2 LYS B 133 -1.155 11.513 -12.326 1.00 0.00 H new ATOM 0 HG3 LYS B 133 0.048 11.738 -11.072 1.00 0.00 H new ATOM 0 HD2 LYS B 133 1.041 9.959 -12.118 1.00 0.00 H new ATOM 0 HD3 LYS B 133 -0.018 9.040 -11.067 1.00 0.00 H new ATOM 0 HE2 LYS B 133 -1.413 8.399 -12.784 1.00 0.00 H new ATOM 0 HE3 LYS B 133 -1.232 9.913 -13.647 1.00 0.00 H new ATOM 0 HZ1 LYS B 133 -0.204 8.093 -14.846 1.00 0.00 H new ATOM 0 HZ2 LYS B 133 0.980 9.210 -14.362 1.00 0.00 H new ATOM 0 HZ3 LYS B 133 0.804 7.742 -13.525 1.00 0.00 H new ATOM 980 N GLU B 134 -4.730 10.234 -9.733 1.00 0.00 N ATOM 981 CA GLU B 134 -5.930 9.414 -9.865 1.00 0.00 C ATOM 982 C GLU B 134 -7.138 10.092 -9.225 1.00 0.00 C ATOM 983 O GLU B 134 -8.197 10.205 -9.842 1.00 0.00 O ATOM 984 CB GLU B 134 -5.701 8.042 -9.228 1.00 0.00 C ATOM 985 CG GLU B 134 -5.651 6.904 -10.230 1.00 0.00 C ATOM 986 CD GLU B 134 -4.511 7.051 -11.220 1.00 0.00 C ATOM 987 OE1 GLU B 134 -3.996 8.179 -11.370 1.00 0.00 O ATOM 988 OE2 GLU B 134 -4.134 6.038 -11.850 1.00 0.00 O ATOM 0 H GLU B 134 -4.329 10.245 -8.795 1.00 0.00 H new ATOM 0 HA GLU B 134 -6.137 9.288 -10.928 1.00 0.00 H new ATOM 0 HB2 GLU B 134 -4.766 8.063 -8.668 1.00 0.00 H new ATOM 0 HB3 GLU B 134 -6.498 7.847 -8.510 1.00 0.00 H new ATOM 0 HG2 GLU B 134 -5.545 5.959 -9.697 1.00 0.00 H new ATOM 0 HG3 GLU B 134 -6.595 6.860 -10.772 1.00 0.00 H new ATOM 995 N GLY B 135 -6.974 10.537 -7.984 1.00 0.00 N ATOM 996 CA GLY B 135 -8.062 11.194 -7.282 1.00 0.00 C ATOM 997 C GLY B 135 -8.607 10.352 -6.146 1.00 0.00 C ATOM 998 O GLY B 135 -9.793 10.425 -5.823 1.00 0.00 O ATOM 0 H GLY B 135 -6.108 10.455 -7.452 1.00 0.00 H new ATOM 0 HA2 GLY B 135 -7.713 12.149 -6.888 1.00 0.00 H new ATOM 0 HA3 GLY B 135 -8.865 11.414 -7.986 1.00 0.00 H new ATOM 1002 N ILE B 136 -7.738 9.550 -5.540 1.00 0.00 N ATOM 1003 CA ILE B 136 -8.135 8.689 -4.433 1.00 0.00 C ATOM 1004 C ILE B 136 -7.714 9.290 -3.091 1.00 0.00 C ATOM 1005 O ILE B 136 -6.575 9.728 -2.932 1.00 0.00 O ATOM 1006 CB ILE B 136 -7.518 7.285 -4.569 1.00 0.00 C ATOM 1007 CG1 ILE B 136 -7.737 6.742 -5.983 1.00 0.00 C ATOM 1008 CG2 ILE B 136 -8.115 6.341 -3.536 1.00 0.00 C ATOM 1009 CD1 ILE B 136 -6.900 5.522 -6.298 1.00 0.00 C ATOM 0 H ILE B 136 -6.754 9.479 -5.797 1.00 0.00 H new ATOM 0 HA ILE B 136 -9.221 8.607 -4.467 1.00 0.00 H new ATOM 0 HB ILE B 136 -6.445 7.358 -4.390 1.00 0.00 H new ATOM 0 HG12 ILE B 136 -8.791 6.492 -6.108 1.00 0.00 H new ATOM 0 HG13 ILE B 136 -7.507 7.526 -6.704 1.00 0.00 H new ATOM 0 HG21 ILE B 136 -7.669 5.353 -3.645 1.00 0.00 H new ATOM 0 HG22 ILE B 136 -7.913 6.722 -2.535 1.00 0.00 H new ATOM 0 HG23 ILE B 136 -9.192 6.271 -3.687 1.00 0.00 H new ATOM 0 HD11 ILE B 136 -7.107 5.192 -7.316 1.00 0.00 H new ATOM 0 HD12 ILE B 136 -5.843 5.772 -6.205 1.00 0.00 H new ATOM 0 HD13 ILE B 136 -7.146 4.722 -5.600 1.00 0.00 H new ATOM 1021 N PRO B 137 -8.629 9.322 -2.104 1.00 0.00 N ATOM 1022 CA PRO B 137 -8.339 9.876 -0.777 1.00 0.00 C ATOM 1023 C PRO B 137 -7.219 9.123 -0.063 1.00 0.00 C ATOM 1024 O PRO B 137 -7.107 7.903 -0.181 1.00 0.00 O ATOM 1025 CB PRO B 137 -9.658 9.713 -0.011 1.00 0.00 C ATOM 1026 CG PRO B 137 -10.420 8.679 -0.765 1.00 0.00 C ATOM 1027 CD PRO B 137 -10.010 8.825 -2.201 1.00 0.00 C ATOM 0 HA PRO B 137 -7.997 10.909 -0.843 1.00 0.00 H new ATOM 0 HB2 PRO B 137 -9.480 9.400 1.018 1.00 0.00 H new ATOM 0 HB3 PRO B 137 -10.207 10.654 0.033 1.00 0.00 H new ATOM 0 HG2 PRO B 137 -10.192 7.680 -0.394 1.00 0.00 H new ATOM 0 HG3 PRO B 137 -11.494 8.825 -0.650 1.00 0.00 H new ATOM 0 HD2 PRO B 137 -10.060 7.875 -2.733 1.00 0.00 H new ATOM 0 HD3 PRO B 137 -10.654 9.524 -2.735 1.00 0.00 H new ATOM 1035 N PRO B 138 -6.377 9.843 0.700 1.00 0.00 N ATOM 1036 CA PRO B 138 -5.268 9.234 1.442 1.00 0.00 C ATOM 1037 C PRO B 138 -5.759 8.419 2.627 1.00 0.00 C ATOM 1038 O PRO B 138 -5.174 7.396 2.983 1.00 0.00 O ATOM 1039 CB PRO B 138 -4.466 10.441 1.927 1.00 0.00 C ATOM 1040 CG PRO B 138 -5.464 11.541 2.022 1.00 0.00 C ATOM 1041 CD PRO B 138 -6.445 11.303 0.908 1.00 0.00 C ATOM 0 HA PRO B 138 -4.693 8.540 0.829 1.00 0.00 H new ATOM 0 HB2 PRO B 138 -3.999 10.245 2.892 1.00 0.00 H new ATOM 0 HB3 PRO B 138 -3.666 10.691 1.231 1.00 0.00 H new ATOM 0 HG2 PRO B 138 -5.963 11.533 2.991 1.00 0.00 H new ATOM 0 HG3 PRO B 138 -4.984 12.514 1.919 1.00 0.00 H new ATOM 0 HD2 PRO B 138 -7.450 11.624 1.182 1.00 0.00 H new ATOM 0 HD3 PRO B 138 -6.170 11.851 0.007 1.00 0.00 H new ATOM 1049 N ASP B 139 -6.842 8.885 3.233 1.00 0.00 N ATOM 1050 CA ASP B 139 -7.429 8.210 4.385 1.00 0.00 C ATOM 1051 C ASP B 139 -8.010 6.859 3.983 1.00 0.00 C ATOM 1052 O ASP B 139 -8.037 5.921 4.779 1.00 0.00 O ATOM 1053 CB ASP B 139 -8.519 9.081 5.013 1.00 0.00 C ATOM 1054 CG ASP B 139 -7.972 10.016 6.074 1.00 0.00 C ATOM 1055 OD1 ASP B 139 -7.727 9.550 7.206 1.00 0.00 O ATOM 1056 OD2 ASP B 139 -7.789 11.214 5.772 1.00 0.00 O ATOM 0 H ASP B 139 -7.334 9.731 2.946 1.00 0.00 H new ATOM 0 HA ASP B 139 -6.640 8.043 5.119 1.00 0.00 H new ATOM 0 HB2 ASP B 139 -9.007 9.666 4.233 1.00 0.00 H new ATOM 0 HB3 ASP B 139 -9.282 8.441 5.455 1.00 0.00 H new ATOM 1061 N GLN B 140 -8.474 6.768 2.741 1.00 0.00 N ATOM 1062 CA GLN B 140 -9.054 5.533 2.229 1.00 0.00 C ATOM 1063 C GLN B 140 -8.000 4.686 1.519 1.00 0.00 C ATOM 1064 O GLN B 140 -8.170 3.477 1.356 1.00 0.00 O ATOM 1065 CB GLN B 140 -10.200 5.848 1.272 1.00 0.00 C ATOM 1066 CG GLN B 140 -11.420 4.970 1.480 1.00 0.00 C ATOM 1067 CD GLN B 140 -12.590 5.372 0.594 1.00 0.00 C ATOM 1068 OE1 GLN B 140 -12.830 4.590 -0.451 1.00 0.00 O flip ATOM 1069 NE2 GLN B 140 -13.260 6.374 0.845 1.00 0.00 N flip ATOM 0 H GLN B 140 -8.459 7.536 2.070 1.00 0.00 H new ATOM 0 HA GLN B 140 -9.439 4.963 3.075 1.00 0.00 H new ATOM 0 HB2 GLN B 140 -10.488 6.892 1.394 1.00 0.00 H new ATOM 0 HB3 GLN B 140 -9.849 5.732 0.247 1.00 0.00 H new ATOM 0 HG2 GLN B 140 -11.155 3.932 1.276 1.00 0.00 H new ATOM 0 HG3 GLN B 140 -11.726 5.022 2.525 1.00 0.00 H new ATOM 0 HE21 GLN B 140 -13.038 6.945 1.660 1.00 0.00 H new ATOM 0 HE22 GLN B 140 -14.037 6.633 0.238 1.00 0.00 H new ATOM 1078 N GLN B 141 -6.914 5.326 1.095 1.00 0.00 N ATOM 1079 CA GLN B 141 -5.838 4.626 0.401 1.00 0.00 C ATOM 1080 C GLN B 141 -4.976 3.834 1.380 1.00 0.00 C ATOM 1081 O GLN B 141 -4.582 4.343 2.429 1.00 0.00 O ATOM 1082 CB GLN B 141 -4.970 5.622 -0.371 1.00 0.00 C ATOM 1083 CG GLN B 141 -5.509 5.957 -1.753 1.00 0.00 C ATOM 1084 CD GLN B 141 -4.659 6.980 -2.480 1.00 0.00 C ATOM 1085 OE1 GLN B 141 -4.067 6.687 -3.519 1.00 0.00 O ATOM 1086 NE2 GLN B 141 -4.594 8.190 -1.937 1.00 0.00 N ATOM 0 H GLN B 141 -6.756 6.326 1.220 1.00 0.00 H new ATOM 0 HA GLN B 141 -6.290 3.925 -0.301 1.00 0.00 H new ATOM 0 HB2 GLN B 141 -4.884 6.541 0.209 1.00 0.00 H new ATOM 0 HB3 GLN B 141 -3.965 5.213 -0.472 1.00 0.00 H new ATOM 0 HG2 GLN B 141 -5.562 5.046 -2.349 1.00 0.00 H new ATOM 0 HG3 GLN B 141 -6.527 6.337 -1.660 1.00 0.00 H new ATOM 0 HE21 GLN B 141 -5.101 8.390 -1.075 1.00 0.00 H new ATOM 0 HE22 GLN B 141 -4.037 8.920 -2.382 1.00 0.00 H new ATOM 1095 N ARG B 142 -4.685 2.586 1.025 1.00 0.00 N ATOM 1096 CA ARG B 142 -3.867 1.719 1.865 1.00 0.00 C ATOM 1097 C ARG B 142 -2.613 1.278 1.117 1.00 0.00 C ATOM 1098 O ARG B 142 -2.664 0.401 0.256 1.00 0.00 O ATOM 1099 CB ARG B 142 -4.672 0.495 2.312 1.00 0.00 C ATOM 1100 CG ARG B 142 -5.105 0.552 3.768 1.00 0.00 C ATOM 1101 CD ARG B 142 -5.954 1.781 4.053 1.00 0.00 C ATOM 1102 NE ARG B 142 -5.441 2.550 5.185 1.00 0.00 N ATOM 1103 CZ ARG B 142 -5.641 2.217 6.458 1.00 0.00 C ATOM 1104 NH1 ARG B 142 -6.341 1.133 6.766 1.00 0.00 N ATOM 1105 NH2 ARG B 142 -5.139 2.972 7.426 1.00 0.00 N ATOM 0 H ARG B 142 -5.005 2.152 0.159 1.00 0.00 H new ATOM 0 HA ARG B 142 -3.566 2.282 2.748 1.00 0.00 H new ATOM 0 HB2 ARG B 142 -5.556 0.402 1.682 1.00 0.00 H new ATOM 0 HB3 ARG B 142 -4.072 -0.402 2.154 1.00 0.00 H new ATOM 0 HG2 ARG B 142 -5.670 -0.347 4.015 1.00 0.00 H new ATOM 0 HG3 ARG B 142 -4.224 0.561 4.410 1.00 0.00 H new ATOM 0 HD2 ARG B 142 -5.983 2.415 3.167 1.00 0.00 H new ATOM 0 HD3 ARG B 142 -6.979 1.474 4.258 1.00 0.00 H new ATOM 0 HE ARG B 142 -4.898 3.391 4.988 1.00 0.00 H new ATOM 0 HH11 ARG B 142 -6.729 0.549 6.025 1.00 0.00 H new ATOM 0 HH12 ARG B 142 -6.491 0.883 7.744 1.00 0.00 H new ATOM 0 HH21 ARG B 142 -4.600 3.807 7.194 1.00 0.00 H new ATOM 0 HH22 ARG B 142 -5.292 2.718 8.402 1.00 0.00 H new ATOM 1119 N LEU B 143 -1.489 1.901 1.452 1.00 0.00 N ATOM 1120 CA LEU B 143 -0.217 1.587 0.815 1.00 0.00 C ATOM 1121 C LEU B 143 0.382 0.302 1.376 1.00 0.00 C ATOM 1122 O LEU B 143 0.649 0.193 2.572 1.00 0.00 O ATOM 1123 CB LEU B 143 0.766 2.744 1.000 1.00 0.00 C ATOM 1124 CG LEU B 143 0.615 3.893 -0.001 1.00 0.00 C ATOM 1125 CD1 LEU B 143 1.712 4.927 0.203 1.00 0.00 C ATOM 1126 CD2 LEU B 143 0.636 3.364 -1.427 1.00 0.00 C ATOM 0 H LEU B 143 -1.434 2.629 2.164 1.00 0.00 H new ATOM 0 HA LEU B 143 -0.404 1.439 -0.249 1.00 0.00 H new ATOM 0 HB2 LEU B 143 0.648 3.143 2.007 1.00 0.00 H new ATOM 0 HB3 LEU B 143 1.781 2.353 0.929 1.00 0.00 H new ATOM 0 HG LEU B 143 -0.347 4.376 0.172 1.00 0.00 H new ATOM 0 HD11 LEU B 143 1.588 5.736 -0.517 1.00 0.00 H new ATOM 0 HD12 LEU B 143 1.650 5.329 1.214 1.00 0.00 H new ATOM 0 HD13 LEU B 143 2.685 4.458 0.058 1.00 0.00 H new ATOM 0 HD21 LEU B 143 0.528 4.194 -2.125 1.00 0.00 H new ATOM 0 HD22 LEU B 143 1.582 2.855 -1.612 1.00 0.00 H new ATOM 0 HD23 LEU B 143 -0.187 2.663 -1.567 1.00 0.00 H new ATOM 1138 N ILE B 144 0.591 -0.664 0.492 1.00 0.00 N ATOM 1139 CA ILE B 144 1.162 -1.953 0.869 1.00 0.00 C ATOM 1140 C ILE B 144 2.569 -2.107 0.302 1.00 0.00 C ATOM 1141 O ILE B 144 2.833 -1.711 -0.833 1.00 0.00 O ATOM 1142 CB ILE B 144 0.289 -3.113 0.357 1.00 0.00 C ATOM 1143 CG1 ILE B 144 -1.174 -2.897 0.762 1.00 0.00 C ATOM 1144 CG2 ILE B 144 0.813 -4.448 0.871 1.00 0.00 C ATOM 1145 CD1 ILE B 144 -1.478 -3.255 2.201 1.00 0.00 C ATOM 0 H ILE B 144 0.372 -0.579 -0.501 1.00 0.00 H new ATOM 0 HA ILE B 144 1.202 -1.986 1.958 1.00 0.00 H new ATOM 0 HB ILE B 144 0.339 -3.134 -0.732 1.00 0.00 H new ATOM 0 HG12 ILE B 144 -1.435 -1.852 0.596 1.00 0.00 H new ATOM 0 HG13 ILE B 144 -1.812 -3.492 0.109 1.00 0.00 H new ATOM 0 HG21 ILE B 144 0.182 -5.255 0.498 1.00 0.00 H new ATOM 0 HG22 ILE B 144 1.835 -4.596 0.523 1.00 0.00 H new ATOM 0 HG23 ILE B 144 0.797 -4.450 1.961 1.00 0.00 H new ATOM 0 HD11 ILE B 144 -2.533 -3.073 2.406 1.00 0.00 H new ATOM 0 HD12 ILE B 144 -1.252 -4.308 2.370 1.00 0.00 H new ATOM 0 HD13 ILE B 144 -0.869 -2.642 2.865 1.00 0.00 H new ATOM 1157 N PHE B 145 3.472 -2.682 1.091 1.00 0.00 N ATOM 1158 CA PHE B 145 4.846 -2.877 0.644 1.00 0.00 C ATOM 1159 C PHE B 145 5.416 -4.205 1.135 1.00 0.00 C ATOM 1160 O PHE B 145 5.881 -4.314 2.270 1.00 0.00 O ATOM 1161 CB PHE B 145 5.726 -1.719 1.121 1.00 0.00 C ATOM 1162 CG PHE B 145 7.156 -1.827 0.671 1.00 0.00 C ATOM 1163 CD1 PHE B 145 7.509 -1.536 -0.637 1.00 0.00 C ATOM 1164 CD2 PHE B 145 8.147 -2.218 1.558 1.00 0.00 C ATOM 1165 CE1 PHE B 145 8.823 -1.633 -1.053 1.00 0.00 C ATOM 1166 CE2 PHE B 145 9.463 -2.318 1.147 1.00 0.00 C ATOM 1167 CZ PHE B 145 9.801 -2.025 -0.159 1.00 0.00 C ATOM 0 H PHE B 145 3.279 -3.018 2.035 1.00 0.00 H new ATOM 0 HA PHE B 145 4.839 -2.900 -0.446 1.00 0.00 H new ATOM 0 HB2 PHE B 145 5.308 -0.781 0.755 1.00 0.00 H new ATOM 0 HB3 PHE B 145 5.698 -1.677 2.210 1.00 0.00 H new ATOM 0 HD1 PHE B 145 6.748 -1.230 -1.340 1.00 0.00 H new ATOM 0 HD2 PHE B 145 7.888 -2.447 2.581 1.00 0.00 H new ATOM 0 HE1 PHE B 145 9.085 -1.403 -2.075 1.00 0.00 H new ATOM 0 HE2 PHE B 145 10.226 -2.625 1.847 1.00 0.00 H new ATOM 0 HZ PHE B 145 10.829 -2.102 -0.482 1.00 0.00 H new ATOM 1177 N ALA B 146 5.392 -5.204 0.254 1.00 0.00 N ATOM 1178 CA ALA B 146 5.917 -6.536 0.554 1.00 0.00 C ATOM 1179 C ALA B 146 5.633 -6.971 1.991 1.00 0.00 C ATOM 1180 O ALA B 146 6.490 -7.564 2.645 1.00 0.00 O ATOM 1181 CB ALA B 146 7.412 -6.578 0.280 1.00 0.00 C ATOM 0 H ALA B 146 5.009 -5.113 -0.687 1.00 0.00 H new ATOM 0 HA ALA B 146 5.401 -7.240 -0.099 1.00 0.00 H new ATOM 0 HB1 ALA B 146 7.795 -7.573 0.506 1.00 0.00 H new ATOM 0 HB2 ALA B 146 7.596 -6.348 -0.769 1.00 0.00 H new ATOM 0 HB3 ALA B 146 7.918 -5.843 0.907 1.00 0.00 H new ATOM 1187 N GLY B 147 4.429 -6.686 2.477 1.00 0.00 N ATOM 1188 CA GLY B 147 4.078 -7.072 3.824 1.00 0.00 C ATOM 1189 C GLY B 147 4.216 -5.938 4.816 1.00 0.00 C ATOM 1190 O GLY B 147 4.426 -6.170 6.007 1.00 0.00 O ATOM 0 H GLY B 147 3.696 -6.197 1.962 1.00 0.00 H new ATOM 0 HA2 GLY B 147 3.051 -7.436 3.836 1.00 0.00 H new ATOM 0 HA3 GLY B 147 4.713 -7.901 4.136 1.00 0.00 H new ATOM 1194 N LYS B 148 4.102 -4.708 4.332 1.00 0.00 N ATOM 1195 CA LYS B 148 4.219 -3.545 5.193 1.00 0.00 C ATOM 1196 C LYS B 148 3.164 -2.502 4.853 1.00 0.00 C ATOM 1197 O LYS B 148 2.887 -2.237 3.683 1.00 0.00 O ATOM 1198 CB LYS B 148 5.607 -2.929 5.065 1.00 0.00 C ATOM 1199 CG LYS B 148 6.735 -3.872 5.452 1.00 0.00 C ATOM 1200 CD LYS B 148 7.330 -3.508 6.803 1.00 0.00 C ATOM 1201 CE LYS B 148 7.859 -4.735 7.528 1.00 0.00 C ATOM 1202 NZ LYS B 148 8.825 -4.372 8.601 1.00 0.00 N ATOM 0 H LYS B 148 3.929 -4.493 3.350 1.00 0.00 H new ATOM 0 HA LYS B 148 4.063 -3.874 6.220 1.00 0.00 H new ATOM 0 HB2 LYS B 148 5.756 -2.603 4.036 1.00 0.00 H new ATOM 0 HB3 LYS B 148 5.659 -2.039 5.692 1.00 0.00 H new ATOM 0 HG2 LYS B 148 6.360 -4.895 5.483 1.00 0.00 H new ATOM 0 HG3 LYS B 148 7.514 -3.840 4.690 1.00 0.00 H new ATOM 0 HD2 LYS B 148 8.138 -2.790 6.664 1.00 0.00 H new ATOM 0 HD3 LYS B 148 6.572 -3.021 7.416 1.00 0.00 H new ATOM 0 HE2 LYS B 148 7.026 -5.288 7.962 1.00 0.00 H new ATOM 0 HE3 LYS B 148 8.344 -5.399 6.812 1.00 0.00 H new ATOM 0 HZ1 LYS B 148 9.162 -5.236 9.071 1.00 0.00 H new ATOM 0 HZ2 LYS B 148 9.633 -3.867 8.184 1.00 0.00 H new ATOM 0 HZ3 LYS B 148 8.356 -3.759 9.298 1.00 0.00 H new ATOM 1216 N GLN B 149 2.589 -1.909 5.887 1.00 0.00 N ATOM 1217 CA GLN B 149 1.570 -0.884 5.715 1.00 0.00 C ATOM 1218 C GLN B 149 2.167 0.503 5.933 1.00 0.00 C ATOM 1219 O GLN B 149 2.382 0.924 7.070 1.00 0.00 O ATOM 1220 CB GLN B 149 0.414 -1.113 6.692 1.00 0.00 C ATOM 1221 CG GLN B 149 -0.690 -0.069 6.592 1.00 0.00 C ATOM 1222 CD GLN B 149 -1.075 0.249 5.159 1.00 0.00 C ATOM 1223 OE1 GLN B 149 -1.068 -0.766 4.302 1.00 0.00 O flip ATOM 1224 NE2 GLN B 149 -1.375 1.396 4.826 1.00 0.00 N flip ATOM 0 H GLN B 149 2.812 -2.121 6.860 1.00 0.00 H new ATOM 0 HA GLN B 149 1.189 -0.947 4.696 1.00 0.00 H new ATOM 0 HB2 GLN B 149 -0.013 -2.099 6.510 1.00 0.00 H new ATOM 0 HB3 GLN B 149 0.806 -1.118 7.709 1.00 0.00 H new ATOM 0 HG2 GLN B 149 -1.569 -0.425 7.128 1.00 0.00 H new ATOM 0 HG3 GLN B 149 -0.364 0.846 7.087 1.00 0.00 H new ATOM 0 HE21 GLN B 149 -1.367 2.146 5.517 1.00 0.00 H new ATOM 0 HE22 GLN B 149 -1.631 1.596 3.859 1.00 0.00 H new ATOM 1233 N LEU B 150 2.439 1.205 4.839 1.00 0.00 N ATOM 1234 CA LEU B 150 3.017 2.542 4.915 1.00 0.00 C ATOM 1235 C LEU B 150 2.106 3.489 5.689 1.00 0.00 C ATOM 1236 O LEU B 150 0.883 3.350 5.664 1.00 0.00 O ATOM 1237 CB LEU B 150 3.274 3.088 3.510 1.00 0.00 C ATOM 1238 CG LEU B 150 4.098 2.173 2.601 1.00 0.00 C ATOM 1239 CD1 LEU B 150 4.380 2.854 1.271 1.00 0.00 C ATOM 1240 CD2 LEU B 150 5.397 1.775 3.285 1.00 0.00 C ATOM 0 H LEU B 150 2.269 0.872 3.890 1.00 0.00 H new ATOM 0 HA LEU B 150 3.965 2.471 5.447 1.00 0.00 H new ATOM 0 HB2 LEU B 150 2.314 3.282 3.031 1.00 0.00 H new ATOM 0 HB3 LEU B 150 3.787 4.046 3.597 1.00 0.00 H new ATOM 0 HG LEU B 150 3.520 1.269 2.406 1.00 0.00 H new ATOM 0 HD11 LEU B 150 4.967 2.188 0.638 1.00 0.00 H new ATOM 0 HD12 LEU B 150 3.438 3.089 0.775 1.00 0.00 H new ATOM 0 HD13 LEU B 150 4.938 3.774 1.444 1.00 0.00 H new ATOM 0 HD21 LEU B 150 5.971 1.124 2.625 1.00 0.00 H new ATOM 0 HD22 LEU B 150 5.979 2.669 3.509 1.00 0.00 H new ATOM 0 HD23 LEU B 150 5.173 1.246 4.211 1.00 0.00 H new ATOM 1252 N GLU B 151 2.711 4.454 6.377 1.00 0.00 N ATOM 1253 CA GLU B 151 1.958 5.425 7.158 1.00 0.00 C ATOM 1254 C GLU B 151 2.187 6.836 6.634 1.00 0.00 C ATOM 1255 O GLU B 151 3.273 7.170 6.163 1.00 0.00 O ATOM 1256 CB GLU B 151 2.351 5.346 8.634 1.00 0.00 C ATOM 1257 CG GLU B 151 1.165 5.393 9.583 1.00 0.00 C ATOM 1258 CD GLU B 151 1.509 4.889 10.971 1.00 0.00 C ATOM 1259 OE1 GLU B 151 2.600 5.230 11.472 1.00 0.00 O ATOM 1260 OE2 GLU B 151 0.686 4.155 11.556 1.00 0.00 O ATOM 0 H GLU B 151 3.722 4.582 6.408 1.00 0.00 H new ATOM 0 HA GLU B 151 0.899 5.186 7.061 1.00 0.00 H new ATOM 0 HB2 GLU B 151 2.906 4.423 8.805 1.00 0.00 H new ATOM 0 HB3 GLU B 151 3.025 6.171 8.867 1.00 0.00 H new ATOM 0 HG2 GLU B 151 0.800 6.418 9.653 1.00 0.00 H new ATOM 0 HG3 GLU B 151 0.353 4.793 9.173 1.00 0.00 H new ATOM 1267 N ASP B 152 1.149 7.654 6.722 1.00 0.00 N ATOM 1268 CA ASP B 152 1.206 9.033 6.261 1.00 0.00 C ATOM 1269 C ASP B 152 2.201 9.851 7.080 1.00 0.00 C ATOM 1270 O ASP B 152 2.755 10.837 6.595 1.00 0.00 O ATOM 1271 CB ASP B 152 -0.187 9.659 6.351 1.00 0.00 C ATOM 1272 CG ASP B 152 -0.545 10.468 5.121 1.00 0.00 C ATOM 1273 OD1 ASP B 152 -0.719 9.862 4.043 1.00 0.00 O ATOM 1274 OD2 ASP B 152 -0.658 11.706 5.237 1.00 0.00 O ATOM 0 H ASP B 152 0.247 7.382 7.113 1.00 0.00 H new ATOM 0 HA ASP B 152 1.544 9.036 5.225 1.00 0.00 H new ATOM 0 HB2 ASP B 152 -0.927 8.871 6.490 1.00 0.00 H new ATOM 0 HB3 ASP B 152 -0.236 10.301 7.230 1.00 0.00 H new ATOM 1279 N GLY B 153 2.421 9.440 8.325 1.00 0.00 N ATOM 1280 CA GLY B 153 3.345 10.154 9.188 1.00 0.00 C ATOM 1281 C GLY B 153 4.760 9.606 9.128 1.00 0.00 C ATOM 1282 O GLY B 153 5.646 10.095 9.829 1.00 0.00 O ATOM 0 H GLY B 153 1.977 8.627 8.751 1.00 0.00 H new ATOM 0 HA2 GLY B 153 3.357 11.207 8.906 1.00 0.00 H new ATOM 0 HA3 GLY B 153 2.986 10.104 10.216 1.00 0.00 H new ATOM 1286 N ARG B 154 4.978 8.591 8.297 1.00 0.00 N ATOM 1287 CA ARG B 154 6.290 7.987 8.162 1.00 0.00 C ATOM 1288 C ARG B 154 7.003 8.502 6.921 1.00 0.00 C ATOM 1289 O ARG B 154 6.541 9.428 6.256 1.00 0.00 O ATOM 1290 CB ARG B 154 6.169 6.469 8.092 1.00 0.00 C ATOM 1291 CG ARG B 154 6.669 5.758 9.338 1.00 0.00 C ATOM 1292 CD ARG B 154 7.278 4.406 9.004 1.00 0.00 C ATOM 1293 NE ARG B 154 8.469 4.130 9.804 1.00 0.00 N ATOM 1294 CZ ARG B 154 9.135 2.978 9.770 1.00 0.00 C ATOM 1295 NH1 ARG B 154 8.731 1.993 8.978 1.00 0.00 N ATOM 1296 NH2 ARG B 154 10.208 2.811 10.531 1.00 0.00 N ATOM 0 H ARG B 154 4.258 8.172 7.708 1.00 0.00 H new ATOM 0 HA ARG B 154 6.877 8.262 9.038 1.00 0.00 H new ATOM 0 HB2 ARG B 154 5.125 6.204 7.928 1.00 0.00 H new ATOM 0 HB3 ARG B 154 6.729 6.108 7.229 1.00 0.00 H new ATOM 0 HG2 ARG B 154 7.412 6.379 9.838 1.00 0.00 H new ATOM 0 HG3 ARG B 154 5.843 5.623 10.037 1.00 0.00 H new ATOM 0 HD2 ARG B 154 6.538 3.623 9.173 1.00 0.00 H new ATOM 0 HD3 ARG B 154 7.537 4.377 7.946 1.00 0.00 H new ATOM 0 HE ARG B 154 8.810 4.863 10.425 1.00 0.00 H new ATOM 0 HH11 ARG B 154 7.906 2.116 8.391 1.00 0.00 H new ATOM 0 HH12 ARG B 154 9.245 1.112 8.956 1.00 0.00 H new ATOM 0 HH21 ARG B 154 10.522 3.565 11.142 1.00 0.00 H new ATOM 0 HH22 ARG B 154 10.719 1.929 10.506 1.00 0.00 H new ATOM 1310 N THR B 155 8.134 7.884 6.624 1.00 0.00 N ATOM 1311 CA THR B 155 8.935 8.258 5.464 1.00 0.00 C ATOM 1312 C THR B 155 9.157 7.057 4.550 1.00 0.00 C ATOM 1313 O THR B 155 9.043 5.909 4.977 1.00 0.00 O ATOM 1314 CB THR B 155 10.281 8.832 5.912 1.00 0.00 C ATOM 1315 OG1 THR B 155 10.621 8.364 7.205 1.00 0.00 O ATOM 1316 CG2 THR B 155 10.302 10.345 5.951 1.00 0.00 C ATOM 0 H THR B 155 8.522 7.116 7.172 1.00 0.00 H new ATOM 0 HA THR B 155 8.392 9.021 4.906 1.00 0.00 H new ATOM 0 HB THR B 155 11.002 8.493 5.168 1.00 0.00 H new ATOM 0 HG1 THR B 155 11.485 8.741 7.473 1.00 0.00 H new ATOM 0 HG21 THR B 155 11.284 10.687 6.276 1.00 0.00 H new ATOM 0 HG22 THR B 155 10.092 10.738 4.956 1.00 0.00 H new ATOM 0 HG23 THR B 155 9.544 10.702 6.649 1.00 0.00 H new ATOM 1324 N LEU B 156 9.477 7.332 3.290 1.00 0.00 N ATOM 1325 CA LEU B 156 9.718 6.278 2.314 1.00 0.00 C ATOM 1326 C LEU B 156 10.919 5.432 2.724 1.00 0.00 C ATOM 1327 O LEU B 156 10.923 4.214 2.550 1.00 0.00 O ATOM 1328 CB LEU B 156 9.944 6.887 0.929 1.00 0.00 C ATOM 1329 CG LEU B 156 8.708 6.918 0.028 1.00 0.00 C ATOM 1330 CD1 LEU B 156 8.927 7.854 -1.150 1.00 0.00 C ATOM 1331 CD2 LEU B 156 8.367 5.517 -0.459 1.00 0.00 C ATOM 0 H LEU B 156 9.575 8.278 2.921 1.00 0.00 H new ATOM 0 HA LEU B 156 8.841 5.632 2.276 1.00 0.00 H new ATOM 0 HB2 LEU B 156 10.311 7.906 1.052 1.00 0.00 H new ATOM 0 HB3 LEU B 156 10.729 6.324 0.424 1.00 0.00 H new ATOM 0 HG LEU B 156 7.868 7.293 0.612 1.00 0.00 H new ATOM 0 HD11 LEU B 156 8.037 7.862 -1.779 1.00 0.00 H new ATOM 0 HD12 LEU B 156 9.121 8.862 -0.783 1.00 0.00 H new ATOM 0 HD13 LEU B 156 9.781 7.510 -1.734 1.00 0.00 H new ATOM 0 HD21 LEU B 156 7.485 5.559 -1.098 1.00 0.00 H new ATOM 0 HD22 LEU B 156 9.207 5.114 -1.025 1.00 0.00 H new ATOM 0 HD23 LEU B 156 8.164 4.874 0.397 1.00 0.00 H new ATOM 1343 N SER B 157 11.931 6.088 3.282 1.00 0.00 N ATOM 1344 CA SER B 157 13.133 5.401 3.732 1.00 0.00 C ATOM 1345 C SER B 157 12.880 4.708 5.066 1.00 0.00 C ATOM 1346 O SER B 157 13.575 3.756 5.423 1.00 0.00 O ATOM 1347 CB SER B 157 14.297 6.388 3.860 1.00 0.00 C ATOM 1348 OG SER B 157 15.272 5.917 4.775 1.00 0.00 O ATOM 0 H SER B 157 11.941 7.097 3.433 1.00 0.00 H new ATOM 0 HA SER B 157 13.397 4.646 2.991 1.00 0.00 H new ATOM 0 HB2 SER B 157 14.756 6.542 2.883 1.00 0.00 H new ATOM 0 HB3 SER B 157 13.921 7.356 4.192 1.00 0.00 H new ATOM 0 HG SER B 157 16.004 6.566 4.836 1.00 0.00 H new ATOM 1354 N ASP B 158 11.872 5.182 5.796 1.00 0.00 N ATOM 1355 CA ASP B 158 11.523 4.593 7.082 1.00 0.00 C ATOM 1356 C ASP B 158 11.166 3.123 6.906 1.00 0.00 C ATOM 1357 O ASP B 158 11.430 2.296 7.779 1.00 0.00 O ATOM 1358 CB ASP B 158 10.349 5.347 7.712 1.00 0.00 C ATOM 1359 CG ASP B 158 10.668 5.859 9.103 1.00 0.00 C ATOM 1360 OD1 ASP B 158 11.262 5.096 9.894 1.00 0.00 O ATOM 1361 OD2 ASP B 158 10.324 7.022 9.401 1.00 0.00 O ATOM 0 H ASP B 158 11.286 5.969 5.518 1.00 0.00 H new ATOM 0 HA ASP B 158 12.384 4.670 7.745 1.00 0.00 H new ATOM 0 HB2 ASP B 158 10.076 6.187 7.073 1.00 0.00 H new ATOM 0 HB3 ASP B 158 9.482 4.688 7.761 1.00 0.00 H new ATOM 1366 N TYR B 159 10.569 2.807 5.761 1.00 0.00 N ATOM 1367 CA TYR B 159 10.176 1.443 5.451 1.00 0.00 C ATOM 1368 C TYR B 159 11.216 0.764 4.559 1.00 0.00 C ATOM 1369 O TYR B 159 11.145 -0.442 4.327 1.00 0.00 O ATOM 1370 CB TYR B 159 8.811 1.442 4.769 1.00 0.00 C ATOM 1371 CG TYR B 159 7.658 1.271 5.732 1.00 0.00 C ATOM 1372 CD1 TYR B 159 7.331 0.020 6.241 1.00 0.00 C ATOM 1373 CD2 TYR B 159 6.899 2.362 6.135 1.00 0.00 C ATOM 1374 CE1 TYR B 159 6.280 -0.137 7.124 1.00 0.00 C ATOM 1375 CE2 TYR B 159 5.847 2.212 7.018 1.00 0.00 C ATOM 1376 CZ TYR B 159 5.541 0.961 7.510 1.00 0.00 C ATOM 1377 OH TYR B 159 4.495 0.808 8.390 1.00 0.00 O ATOM 0 H TYR B 159 10.347 3.484 5.031 1.00 0.00 H new ATOM 0 HA TYR B 159 10.112 0.880 6.382 1.00 0.00 H new ATOM 0 HB2 TYR B 159 8.684 2.378 4.225 1.00 0.00 H new ATOM 0 HB3 TYR B 159 8.782 0.639 4.033 1.00 0.00 H new ATOM 0 HD1 TYR B 159 7.907 -0.843 5.942 1.00 0.00 H new ATOM 0 HD2 TYR B 159 7.135 3.344 5.752 1.00 0.00 H new ATOM 0 HE1 TYR B 159 6.038 -1.116 7.510 1.00 0.00 H new ATOM 0 HE2 TYR B 159 5.267 3.071 7.321 1.00 0.00 H new ATOM 0 HH TYR B 159 3.660 1.083 7.957 1.00 0.00 H new ATOM 1387 N ASN B 160 12.180 1.551 4.065 1.00 0.00 N ATOM 1388 CA ASN B 160 13.248 1.048 3.202 1.00 0.00 C ATOM 1389 C ASN B 160 12.780 0.939 1.756 1.00 0.00 C ATOM 1390 O ASN B 160 12.896 -0.113 1.127 1.00 0.00 O ATOM 1391 CB ASN B 160 13.763 -0.305 3.696 1.00 0.00 C ATOM 1392 CG ASN B 160 14.934 -0.814 2.878 1.00 0.00 C ATOM 1393 OD1 ASN B 160 15.740 -0.032 2.374 1.00 0.00 O ATOM 1394 ND2 ASN B 160 15.033 -2.131 2.742 1.00 0.00 N ATOM 0 H ASN B 160 12.239 2.552 4.254 1.00 0.00 H new ATOM 0 HA ASN B 160 14.068 1.764 3.244 1.00 0.00 H new ATOM 0 HB2 ASN B 160 14.064 -0.216 4.740 1.00 0.00 H new ATOM 0 HB3 ASN B 160 12.954 -1.034 3.659 1.00 0.00 H new ATOM 0 HD21 ASN B 160 15.800 -2.532 2.202 1.00 0.00 H new ATOM 0 HD22 ASN B 160 14.342 -2.742 3.177 1.00 0.00 H new ATOM 1401 N ILE B 161 12.259 2.043 1.233 1.00 0.00 N ATOM 1402 CA ILE B 161 11.780 2.090 -0.141 1.00 0.00 C ATOM 1403 C ILE B 161 12.807 2.768 -1.042 1.00 0.00 C ATOM 1404 O ILE B 161 13.486 3.708 -0.627 1.00 0.00 O ATOM 1405 CB ILE B 161 10.428 2.832 -0.232 1.00 0.00 C ATOM 1406 CG1 ILE B 161 9.302 1.950 0.315 1.00 0.00 C ATOM 1407 CG2 ILE B 161 10.128 3.251 -1.669 1.00 0.00 C ATOM 1408 CD1 ILE B 161 8.458 2.630 1.371 1.00 0.00 C ATOM 0 H ILE B 161 12.158 2.920 1.743 1.00 0.00 H new ATOM 0 HA ILE B 161 11.634 1.064 -0.479 1.00 0.00 H new ATOM 0 HB ILE B 161 10.493 3.735 0.375 1.00 0.00 H new ATOM 0 HG12 ILE B 161 8.659 1.643 -0.510 1.00 0.00 H new ATOM 0 HG13 ILE B 161 9.735 1.043 0.736 1.00 0.00 H new ATOM 0 HG21 ILE B 161 9.171 3.771 -1.704 1.00 0.00 H new ATOM 0 HG22 ILE B 161 10.915 3.915 -2.026 1.00 0.00 H new ATOM 0 HG23 ILE B 161 10.084 2.366 -2.304 1.00 0.00 H new ATOM 0 HD11 ILE B 161 7.681 1.946 1.712 1.00 0.00 H new ATOM 0 HD12 ILE B 161 9.088 2.913 2.214 1.00 0.00 H new ATOM 0 HD13 ILE B 161 7.996 3.522 0.948 1.00 0.00 H new ATOM 1420 N GLN B 162 12.916 2.286 -2.274 1.00 0.00 N ATOM 1421 CA GLN B 162 13.863 2.848 -3.228 1.00 0.00 C ATOM 1422 C GLN B 162 13.200 3.078 -4.583 1.00 0.00 C ATOM 1423 O GLN B 162 11.987 2.922 -4.728 1.00 0.00 O ATOM 1424 CB GLN B 162 15.069 1.921 -3.388 1.00 0.00 C ATOM 1425 CG GLN B 162 15.612 1.396 -2.069 1.00 0.00 C ATOM 1426 CD GLN B 162 15.937 2.506 -1.089 1.00 0.00 C ATOM 1427 OE1 GLN B 162 15.535 2.325 0.164 1.00 0.00 O flip ATOM 1428 NE2 GLN B 162 16.541 3.515 -1.453 1.00 0.00 N flip ATOM 0 H GLN B 162 12.362 1.509 -2.635 1.00 0.00 H new ATOM 0 HA GLN B 162 14.201 3.810 -2.842 1.00 0.00 H new ATOM 0 HB2 GLN B 162 14.787 1.077 -4.017 1.00 0.00 H new ATOM 0 HB3 GLN B 162 15.862 2.457 -3.910 1.00 0.00 H new ATOM 0 HG2 GLN B 162 14.880 0.724 -1.621 1.00 0.00 H new ATOM 0 HG3 GLN B 162 16.511 0.809 -2.258 1.00 0.00 H new ATOM 0 HE21 GLN B 162 16.831 3.612 -2.426 1.00 0.00 H new ATOM 0 HE22 GLN B 162 16.751 4.254 -0.782 1.00 0.00 H new ATOM 1437 N LYS B 163 14.005 3.451 -5.572 1.00 0.00 N ATOM 1438 CA LYS B 163 13.498 3.705 -6.915 1.00 0.00 C ATOM 1439 C LYS B 163 12.909 2.438 -7.528 1.00 0.00 C ATOM 1440 O LYS B 163 13.239 1.324 -7.122 1.00 0.00 O ATOM 1441 CB LYS B 163 14.616 4.251 -7.811 1.00 0.00 C ATOM 1442 CG LYS B 163 14.244 4.336 -9.284 1.00 0.00 C ATOM 1443 CD LYS B 163 15.230 5.196 -10.050 1.00 0.00 C ATOM 1444 CE LYS B 163 16.417 4.380 -10.540 1.00 0.00 C ATOM 1445 NZ LYS B 163 17.688 5.153 -10.470 1.00 0.00 N ATOM 0 H LYS B 163 15.011 3.584 -5.469 1.00 0.00 H new ATOM 0 HA LYS B 163 12.705 4.449 -6.841 1.00 0.00 H new ATOM 0 HB2 LYS B 163 14.896 5.244 -7.460 1.00 0.00 H new ATOM 0 HB3 LYS B 163 15.495 3.616 -7.705 1.00 0.00 H new ATOM 0 HG2 LYS B 163 14.220 3.335 -9.714 1.00 0.00 H new ATOM 0 HG3 LYS B 163 13.241 4.750 -9.385 1.00 0.00 H new ATOM 0 HD2 LYS B 163 14.728 5.657 -10.901 1.00 0.00 H new ATOM 0 HD3 LYS B 163 15.582 6.005 -9.410 1.00 0.00 H new ATOM 0 HE2 LYS B 163 16.509 3.475 -9.939 1.00 0.00 H new ATOM 0 HE3 LYS B 163 16.241 4.063 -11.568 1.00 0.00 H new ATOM 0 HZ1 LYS B 163 18.473 4.563 -10.812 1.00 0.00 H new ATOM 0 HZ2 LYS B 163 17.610 6.004 -11.063 1.00 0.00 H new ATOM 0 HZ3 LYS B 163 17.870 5.434 -9.485 1.00 0.00 H new ATOM 1459 N GLU B 164 12.038 2.625 -8.514 1.00 0.00 N ATOM 1460 CA GLU B 164 11.397 1.513 -9.201 1.00 0.00 C ATOM 1461 C GLU B 164 10.715 0.563 -8.223 1.00 0.00 C ATOM 1462 O GLU B 164 10.491 -0.607 -8.537 1.00 0.00 O ATOM 1463 CB GLU B 164 12.426 0.752 -10.030 1.00 0.00 C ATOM 1464 CG GLU B 164 12.543 1.249 -11.460 1.00 0.00 C ATOM 1465 CD GLU B 164 12.414 0.134 -12.480 1.00 0.00 C ATOM 1466 OE1 GLU B 164 11.744 -0.874 -12.170 1.00 0.00 O ATOM 1467 OE2 GLU B 164 12.983 0.271 -13.580 1.00 0.00 O ATOM 0 H GLU B 164 11.759 3.544 -8.856 1.00 0.00 H new ATOM 0 HA GLU B 164 10.629 1.925 -9.856 1.00 0.00 H new ATOM 0 HB2 GLU B 164 13.400 0.830 -9.546 1.00 0.00 H new ATOM 0 HB3 GLU B 164 12.160 -0.305 -10.042 1.00 0.00 H new ATOM 0 HG2 GLU B 164 11.771 1.996 -11.645 1.00 0.00 H new ATOM 0 HG3 GLU B 164 13.505 1.745 -11.590 1.00 0.00 H new ATOM 1474 N SER B 165 10.378 1.068 -7.043 1.00 0.00 N ATOM 1475 CA SER B 165 9.713 0.255 -6.032 1.00 0.00 C ATOM 1476 C SER B 165 8.393 -0.287 -6.569 1.00 0.00 C ATOM 1477 O SER B 165 7.920 0.138 -7.623 1.00 0.00 O ATOM 1478 CB SER B 165 9.468 1.073 -4.763 1.00 0.00 C ATOM 1479 OG SER B 165 8.648 0.365 -3.850 1.00 0.00 O ATOM 0 H SER B 165 10.553 2.033 -6.763 1.00 0.00 H new ATOM 0 HA SER B 165 10.362 -0.585 -5.786 1.00 0.00 H new ATOM 0 HB2 SER B 165 10.421 1.312 -4.291 1.00 0.00 H new ATOM 0 HB3 SER B 165 8.995 2.020 -5.023 1.00 0.00 H new ATOM 0 HG SER B 165 8.508 0.909 -3.047 1.00 0.00 H new ATOM 1485 N THR B 166 7.802 -1.228 -5.842 1.00 0.00 N ATOM 1486 CA THR B 166 6.538 -1.825 -6.255 1.00 0.00 C ATOM 1487 C THR B 166 5.608 -2.016 -5.063 1.00 0.00 C ATOM 1488 O THR B 166 5.729 -2.987 -4.316 1.00 0.00 O ATOM 1489 CB THR B 166 6.783 -3.168 -6.945 1.00 0.00 C ATOM 1490 OG1 THR B 166 7.882 -3.081 -7.834 1.00 0.00 O ATOM 1491 CG2 THR B 166 5.590 -3.660 -7.736 1.00 0.00 C ATOM 0 H THR B 166 8.177 -1.593 -4.966 1.00 0.00 H new ATOM 0 HA THR B 166 6.060 -1.144 -6.959 1.00 0.00 H new ATOM 0 HB THR B 166 6.981 -3.875 -6.140 1.00 0.00 H new ATOM 0 HG1 THR B 166 8.024 -3.950 -8.265 1.00 0.00 H new ATOM 0 HG21 THR B 166 5.830 -4.617 -8.200 1.00 0.00 H new ATOM 0 HG22 THR B 166 4.737 -3.784 -7.069 1.00 0.00 H new ATOM 0 HG23 THR B 166 5.342 -2.934 -8.510 1.00 0.00 H new ATOM 1499 N LEU B 167 4.676 -1.085 -4.895 1.00 0.00 N ATOM 1500 CA LEU B 167 3.720 -1.149 -3.799 1.00 0.00 C ATOM 1501 C LEU B 167 2.329 -1.493 -4.317 1.00 0.00 C ATOM 1502 O LEU B 167 2.090 -1.499 -5.525 1.00 0.00 O ATOM 1503 CB LEU B 167 3.684 0.183 -3.048 1.00 0.00 C ATOM 1504 CG LEU B 167 5.049 0.702 -2.589 1.00 0.00 C ATOM 1505 CD1 LEU B 167 5.515 1.844 -3.478 1.00 0.00 C ATOM 1506 CD2 LEU B 167 4.992 1.147 -1.136 1.00 0.00 C ATOM 0 H LEU B 167 4.563 -0.276 -5.506 1.00 0.00 H new ATOM 0 HA LEU B 167 4.039 -1.934 -3.113 1.00 0.00 H new ATOM 0 HB2 LEU B 167 3.224 0.933 -3.691 1.00 0.00 H new ATOM 0 HB3 LEU B 167 3.041 0.074 -2.175 1.00 0.00 H new ATOM 0 HG LEU B 167 5.769 -0.112 -2.671 1.00 0.00 H new ATOM 0 HD11 LEU B 167 6.487 2.199 -3.135 1.00 0.00 H new ATOM 0 HD12 LEU B 167 5.599 1.493 -4.507 1.00 0.00 H new ATOM 0 HD13 LEU B 167 4.794 2.660 -3.430 1.00 0.00 H new ATOM 0 HD21 LEU B 167 5.972 1.512 -0.829 1.00 0.00 H new ATOM 0 HD22 LEU B 167 4.257 1.945 -1.028 1.00 0.00 H new ATOM 0 HD23 LEU B 167 4.706 0.303 -0.508 1.00 0.00 H new ATOM 1518 N HIS B 168 1.413 -1.777 -3.398 1.00 0.00 N ATOM 1519 CA HIS B 168 0.045 -2.118 -3.766 1.00 0.00 C ATOM 1520 C HIS B 168 -0.949 -1.248 -3.007 1.00 0.00 C ATOM 1521 O HIS B 168 -0.999 -1.273 -1.778 1.00 0.00 O ATOM 1522 CB HIS B 168 -0.232 -3.597 -3.486 1.00 0.00 C ATOM 1523 CG HIS B 168 0.878 -4.507 -3.911 1.00 0.00 C ATOM 1524 ND1 HIS B 168 0.789 -5.345 -5.003 1.00 0.00 N ATOM 1525 CD2 HIS B 168 2.110 -4.708 -3.386 1.00 0.00 C ATOM 1526 CE1 HIS B 168 1.916 -6.022 -5.130 1.00 0.00 C ATOM 1527 NE2 HIS B 168 2.734 -5.654 -4.161 1.00 0.00 N ATOM 0 H HIS B 168 1.593 -1.778 -2.394 1.00 0.00 H new ATOM 0 HA HIS B 168 -0.076 -1.934 -4.834 1.00 0.00 H new ATOM 0 HB2 HIS B 168 -0.410 -3.729 -2.419 1.00 0.00 H new ATOM 0 HB3 HIS B 168 -1.147 -3.890 -4.000 1.00 0.00 H new ATOM 0 HD2 HIS B 168 2.525 -4.216 -2.519 1.00 0.00 H new ATOM 0 HE1 HIS B 168 2.132 -6.752 -5.896 1.00 0.00 H new ATOM 0 HE2 HIS B 168 3.677 -6.014 -4.012 1.00 0.00 H new ATOM 1536 N LEU B 169 -1.735 -0.476 -3.748 1.00 0.00 N ATOM 1537 CA LEU B 169 -2.725 0.405 -3.148 1.00 0.00 C ATOM 1538 C LEU B 169 -4.031 -0.335 -2.911 1.00 0.00 C ATOM 1539 O LEU B 169 -4.399 -1.234 -3.667 1.00 0.00 O ATOM 1540 CB LEU B 169 -2.953 1.619 -4.047 1.00 0.00 C ATOM 1541 CG LEU B 169 -4.064 2.567 -3.599 1.00 0.00 C ATOM 1542 CD1 LEU B 169 -3.516 3.626 -2.653 1.00 0.00 C ATOM 1543 CD2 LEU B 169 -4.719 3.212 -4.809 1.00 0.00 C ATOM 0 H LEU B 169 -1.704 -0.444 -4.767 1.00 0.00 H new ATOM 0 HA LEU B 169 -2.350 0.745 -2.183 1.00 0.00 H new ATOM 0 HB2 LEU B 169 -2.022 2.182 -4.111 1.00 0.00 H new ATOM 0 HB3 LEU B 169 -3.183 1.267 -5.053 1.00 0.00 H new ATOM 0 HG LEU B 169 -4.818 1.993 -3.061 1.00 0.00 H new ATOM 0 HD11 LEU B 169 -4.323 4.291 -2.345 1.00 0.00 H new ATOM 0 HD12 LEU B 169 -3.089 3.143 -1.774 1.00 0.00 H new ATOM 0 HD13 LEU B 169 -2.744 4.203 -3.161 1.00 0.00 H new ATOM 0 HD21 LEU B 169 -5.510 3.886 -4.479 1.00 0.00 H new ATOM 0 HD22 LEU B 169 -3.973 3.775 -5.370 1.00 0.00 H new ATOM 0 HD23 LEU B 169 -5.145 2.438 -5.448 1.00 0.00 H new ATOM 1555 N VAL B 170 -4.716 0.043 -1.842 1.00 0.00 N ATOM 1556 CA VAL B 170 -5.972 -0.587 -1.479 1.00 0.00 C ATOM 1557 C VAL B 170 -6.955 0.434 -0.911 1.00 0.00 C ATOM 1558 O VAL B 170 -6.590 1.267 -0.083 1.00 0.00 O ATOM 1559 CB VAL B 170 -5.726 -1.697 -0.441 1.00 0.00 C ATOM 1560 CG1 VAL B 170 -7.034 -2.211 0.141 1.00 0.00 C ATOM 1561 CG2 VAL B 170 -4.933 -2.835 -1.058 1.00 0.00 C ATOM 0 H VAL B 170 -4.420 0.786 -1.210 1.00 0.00 H new ATOM 0 HA VAL B 170 -6.404 -1.020 -2.381 1.00 0.00 H new ATOM 0 HB VAL B 170 -5.144 -1.268 0.375 1.00 0.00 H new ATOM 0 HG11 VAL B 170 -6.825 -2.994 0.870 1.00 0.00 H new ATOM 0 HG12 VAL B 170 -7.562 -1.392 0.629 1.00 0.00 H new ATOM 0 HG13 VAL B 170 -7.654 -2.616 -0.659 1.00 0.00 H new ATOM 0 HG21 VAL B 170 -4.768 -3.611 -0.310 1.00 0.00 H new ATOM 0 HG22 VAL B 170 -5.489 -3.252 -1.898 1.00 0.00 H new ATOM 0 HG23 VAL B 170 -3.972 -2.460 -1.410 1.00 0.00 H new ATOM 1571 N LEU B 171 -8.202 0.360 -1.360 1.00 0.00 N ATOM 1572 CA LEU B 171 -9.233 1.272 -0.896 1.00 0.00 C ATOM 1573 C LEU B 171 -9.938 0.709 0.335 1.00 0.00 C ATOM 1574 O LEU B 171 -10.550 -0.353 0.276 1.00 0.00 O ATOM 1575 CB LEU B 171 -10.240 1.520 -2.013 1.00 0.00 C ATOM 1576 CG LEU B 171 -9.923 2.705 -2.924 1.00 0.00 C ATOM 1577 CD1 LEU B 171 -10.990 2.863 -3.992 1.00 0.00 C ATOM 1578 CD2 LEU B 171 -9.786 3.982 -2.108 1.00 0.00 C ATOM 0 H LEU B 171 -8.521 -0.324 -2.046 1.00 0.00 H new ATOM 0 HA LEU B 171 -8.765 2.217 -0.618 1.00 0.00 H new ATOM 0 HB2 LEU B 171 -10.309 0.620 -2.625 1.00 0.00 H new ATOM 0 HB3 LEU B 171 -11.222 1.678 -1.567 1.00 0.00 H new ATOM 0 HG LEU B 171 -8.973 2.511 -3.421 1.00 0.00 H new ATOM 0 HD11 LEU B 171 -10.744 3.713 -4.629 1.00 0.00 H new ATOM 0 HD12 LEU B 171 -11.036 1.957 -4.597 1.00 0.00 H new ATOM 0 HD13 LEU B 171 -11.957 3.033 -3.518 1.00 0.00 H new ATOM 0 HD21 LEU B 171 -9.560 4.816 -2.773 1.00 0.00 H new ATOM 0 HD22 LEU B 171 -10.720 4.180 -1.582 1.00 0.00 H new ATOM 0 HD23 LEU B 171 -8.979 3.866 -1.384 1.00 0.00 H new ATOM 1590 N ARG B 172 -9.839 1.426 1.448 1.00 0.00 N ATOM 1591 CA ARG B 172 -10.460 0.998 2.694 1.00 0.00 C ATOM 1592 C ARG B 172 -11.710 1.818 2.978 1.00 0.00 C ATOM 1593 O ARG B 172 -11.630 2.984 3.364 1.00 0.00 O ATOM 1594 CB ARG B 172 -9.481 1.128 3.857 1.00 0.00 C ATOM 1595 CG ARG B 172 -10.050 0.678 5.192 1.00 0.00 C ATOM 1596 CD ARG B 172 -10.590 1.852 5.992 1.00 0.00 C ATOM 1597 NE ARG B 172 -10.150 1.812 7.386 1.00 0.00 N ATOM 1598 CZ ARG B 172 -10.510 0.861 8.247 1.00 0.00 C ATOM 1599 NH1 ARG B 172 -11.310 -0.128 7.862 1.00 0.00 N ATOM 1600 NH2 ARG B 172 -10.070 0.900 9.497 1.00 0.00 N ATOM 0 H ARG B 172 -9.333 2.309 1.512 1.00 0.00 H new ATOM 0 HA ARG B 172 -10.741 -0.050 2.587 1.00 0.00 H new ATOM 0 HB2 ARG B 172 -8.590 0.541 3.636 1.00 0.00 H new ATOM 0 HB3 ARG B 172 -9.165 2.168 3.939 1.00 0.00 H new ATOM 0 HG2 ARG B 172 -10.847 -0.046 5.023 1.00 0.00 H new ATOM 0 HG3 ARG B 172 -9.275 0.171 5.767 1.00 0.00 H new ATOM 0 HD2 ARG B 172 -10.261 2.785 5.534 1.00 0.00 H new ATOM 0 HD3 ARG B 172 -11.679 1.846 5.955 1.00 0.00 H new ATOM 0 HE ARG B 172 -9.533 2.553 7.718 1.00 0.00 H new ATOM 0 HH11 ARG B 172 -11.653 -0.162 6.902 1.00 0.00 H new ATOM 0 HH12 ARG B 172 -11.581 -0.853 8.527 1.00 0.00 H new ATOM 0 HH21 ARG B 172 -9.457 1.657 9.798 1.00 0.00 H new ATOM 0 HH22 ARG B 172 -10.345 0.173 10.157 1.00 0.00 H new ATOM 1614 N LEU B 173 -12.880 1.204 2.779 1.00 0.00 N ATOM 1615 CA LEU B 173 -14.140 1.873 3.006 1.00 0.00 C ATOM 1616 C LEU B 173 -15.210 0.882 3.446 1.00 0.00 C ATOM 1617 O LEU B 173 -15.620 0.015 2.674 1.00 0.00 O ATOM 1618 CB LEU B 173 -14.590 2.600 1.738 1.00 0.00 C ATOM 1619 CG LEU B 173 -14.600 1.750 0.463 1.00 0.00 C ATOM 1620 CD1 LEU B 173 -15.320 2.478 -0.655 1.00 0.00 C ATOM 1621 CD2 LEU B 173 -13.180 1.404 0.038 1.00 0.00 C ATOM 0 H LEU B 173 -12.968 0.239 2.459 1.00 0.00 H new ATOM 0 HA LEU B 173 -13.998 2.603 3.803 1.00 0.00 H new ATOM 0 HB2 LEU B 173 -15.594 2.992 1.901 1.00 0.00 H new ATOM 0 HB3 LEU B 173 -13.935 3.457 1.579 1.00 0.00 H new ATOM 0 HG LEU B 173 -15.133 0.823 0.675 1.00 0.00 H new ATOM 0 HD11 LEU B 173 -15.317 1.860 -1.553 1.00 0.00 H new ATOM 0 HD12 LEU B 173 -16.349 2.678 -0.355 1.00 0.00 H new ATOM 0 HD13 LEU B 173 -14.812 3.420 -0.862 1.00 0.00 H new ATOM 0 HD21 LEU B 173 -13.209 0.800 -0.869 1.00 0.00 H new ATOM 0 HD22 LEU B 173 -12.624 2.322 -0.154 1.00 0.00 H new ATOM 0 HD23 LEU B 173 -12.689 0.842 0.833 1.00 0.00 H new ATOM 1633 N ARG B 174 -15.660 1.017 4.693 1.00 0.00 N ATOM 1634 CA ARG B 174 -16.690 0.137 5.249 1.00 0.00 C ATOM 1635 C ARG B 174 -16.410 -1.326 4.906 1.00 0.00 C ATOM 1636 O ARG B 174 -17.340 -2.124 4.760 1.00 0.00 O ATOM 1637 CB ARG B 174 -18.070 0.544 4.735 1.00 0.00 C ATOM 1638 CG ARG B 174 -18.260 0.339 3.240 1.00 0.00 C ATOM 1639 CD ARG B 174 -19.730 0.306 2.859 1.00 0.00 C ATOM 1640 NE ARG B 174 -20.190 1.602 2.372 1.00 0.00 N ATOM 1641 CZ ARG B 174 -21.310 1.768 1.658 1.00 0.00 C ATOM 1642 NH1 ARG B 174 -22.070 0.725 1.346 1.00 0.00 N ATOM 1643 NH2 ARG B 174 -21.660 2.981 1.255 1.00 0.00 N ATOM 0 H ARG B 174 -15.326 1.731 5.341 1.00 0.00 H new ATOM 0 HA ARG B 174 -16.671 0.241 6.334 1.00 0.00 H new ATOM 0 HB2 ARG B 174 -18.828 -0.029 5.269 1.00 0.00 H new ATOM 0 HB3 ARG B 174 -18.239 1.595 4.971 1.00 0.00 H new ATOM 0 HG2 ARG B 174 -17.761 1.142 2.697 1.00 0.00 H new ATOM 0 HG3 ARG B 174 -17.785 -0.594 2.937 1.00 0.00 H new ATOM 0 HD2 ARG B 174 -19.890 -0.450 2.090 1.00 0.00 H new ATOM 0 HD3 ARG B 174 -20.324 0.011 3.724 1.00 0.00 H new ATOM 0 HE ARG B 174 -19.628 2.426 2.587 1.00 0.00 H new ATOM 0 HH11 ARG B 174 -21.802 -0.211 1.651 1.00 0.00 H new ATOM 0 HH12 ARG B 174 -22.922 0.859 0.802 1.00 0.00 H new ATOM 0 HH21 ARG B 174 -21.077 3.784 1.489 1.00 0.00 H new ATOM 0 HH22 ARG B 174 -22.513 3.111 0.711 1.00 0.00 H new ATOM 1657 N GLY B 175 -15.140 -1.669 4.781 1.00 0.00 N ATOM 1658 CA GLY B 175 -14.760 -3.033 4.457 1.00 0.00 C ATOM 1659 C GLY B 175 -14.880 -3.330 2.975 1.00 0.00 C ATOM 1660 O GLY B 175 -14.250 -2.671 2.150 1.00 0.00 O ATOM 0 H GLY B 175 -14.357 -1.025 4.898 1.00 0.00 H new ATOM 0 HA2 GLY B 175 -13.733 -3.207 4.778 1.00 0.00 H new ATOM 0 HA3 GLY B 175 -15.390 -3.725 5.016 1.00 0.00 H new ATOM 1664 N GLY B 176 -15.690 -4.326 2.635 1.00 0.00 N ATOM 1665 CA GLY B 176 -15.880 -4.691 1.243 1.00 0.00 C ATOM 1666 C GLY B 176 -17.330 -4.936 0.895 1.00 0.00 C ATOM 1667 O GLY B 176 -18.170 -4.067 1.208 1.00 0.00 O ATOM 1668 OXT GLY B 176 -17.630 -5.998 0.309 1.00 0.00 O ATOM 0 H GLY B 176 -16.220 -4.889 3.300 1.00 0.00 H new ATOM 0 HA2 GLY B 176 -15.487 -3.897 0.607 1.00 0.00 H new ATOM 0 HA3 GLY B 176 -15.302 -5.589 1.025 1.00 0.00 H new TER 1672 GLY B 176 HETATM 1673 ZN ZN A 32 -5.783 -7.542 1.069 1.00 0.00 ZN