USER MOD reduce.3.24.130724 H: found=0, std=0, add=892, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 896 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: C 81 MET CE :methyl -172:sc= 0 (180deg=0) USER MOD Set 1.2: I 154 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.1: C 37 SER OG : rot 45:sc= 0.833 USER MOD Set 2.2: C 38 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: C 13 THR OG1 : rot -166:sc= -2.72 USER MOD Set 3.2: C 16 GLN : amide:sc= -0.315 K(o=-3,f=-8.9!) USER MOD Set 4.1: C 5 TYR OH : rot 150:sc= -0.464 USER MOD Set 4.2: C 89 SER OG : rot -142:sc= 0.107 USER MOD Single : C 1 MET CE :methyl 164:sc= -0.011 (180deg=-0.391) USER MOD Single : C 1 MET N :NH3+ 176:sc= -0.904 (180deg=-1.11) USER MOD Single : C 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 11 GLN : amide:sc= -0.141 K(o=-0.14,f=-2!) USER MOD Single : C 17 LYS NZ :NH3+ 175:sc= -2! (180deg=-2.17!) USER MOD Single : C 18 ASN :FLIP amide:sc= -0.813 F(o=-2.7!,f=-0.81) USER MOD Single : C 21 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.00643) USER MOD Single : C 35 CYS SG : rot 180:sc= 0 USER MOD Single : C 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 43 LYS NZ :NH3+ 158:sc= -0.0362 (180deg=-0.556) USER MOD Single : C 45 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 47 MET CE :methyl -125:sc=-0.00637 (180deg=-0.114) USER MOD Single : C 50 GLN : amide:sc= -0.174 X(o=-0.17,f=-0.17) USER MOD Single : C 51 ASN : amide:sc= -0.0522 K(o=-0.052,f=-0.57) USER MOD Single : C 53 THR OG1 : rot 180:sc= 0.00339 USER MOD Single : C 58 GLN : amide:sc= 0 K(o=0,f=-1.6!) USER MOD Single : C 60 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 71 THR OG1 : rot -47:sc= 0.408 USER MOD Single : C 80 MET CE :methyl 146:sc= 0 (180deg=-0.0304) USER MOD Single : C 84 CYS SG : rot 129:sc= 0.901 USER MOD Single : C 85 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : I 149 SER OG : rot 180:sc= 0 USER MOD Single : I 153 MET CE :methyl -137:sc= 0 (180deg=-0.991) USER MOD Single : I 155 GLN : amide:sc= 0 K(o=0,f=-0.53) USER MOD Single : I 162 HIS : +bothHN:sc= -1.52! C(o=-1.5!,f=-5.8!) USER MOD Single : I 163 LYS NZ :NH3+ 158:sc= -0.127 (180deg=-0.758) USER MOD Single : I 165 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET C 1 14.599 6.336 4.989 1.00 0.00 N ATOM 2 CA MET C 1 15.423 7.353 4.275 1.00 0.00 C ATOM 3 C MET C 1 16.883 7.221 4.701 1.00 0.00 C ATOM 4 O MET C 1 17.794 7.517 3.928 1.00 0.00 O ATOM 5 CB MET C 1 14.908 8.755 4.613 1.00 0.00 C ATOM 6 CG MET C 1 14.461 8.799 6.076 1.00 0.00 C ATOM 7 SD MET C 1 14.284 10.522 6.605 1.00 0.00 S ATOM 8 CE MET C 1 12.826 10.927 5.612 1.00 0.00 C ATOM 0 H1 MET C 1 13.596 6.471 4.749 1.00 0.00 H new ATOM 0 H2 MET C 1 14.898 5.382 4.701 1.00 0.00 H new ATOM 0 H3 MET C 1 14.727 6.444 6.015 1.00 0.00 H new ATOM 0 HA MET C 1 15.349 7.192 3.200 1.00 0.00 H new ATOM 0 HB2 MET C 1 15.691 9.493 4.439 1.00 0.00 H new ATOM 0 HB3 MET C 1 14.075 9.015 3.960 1.00 0.00 H new ATOM 0 HG2 MET C 1 13.514 8.273 6.193 1.00 0.00 H new ATOM 0 HG3 MET C 1 15.190 8.288 6.705 1.00 0.00 H new ATOM 0 HE1 MET C 1 12.373 11.844 5.988 1.00 0.00 H new ATOM 0 HE2 MET C 1 13.122 11.068 4.572 1.00 0.00 H new ATOM 0 HE3 MET C 1 12.104 10.113 5.677 1.00 0.00 H new ATOM 20 N ASP C 2 17.097 6.777 5.935 1.00 0.00 N ATOM 21 CA ASP C 2 18.450 6.613 6.458 1.00 0.00 C ATOM 22 C ASP C 2 18.895 5.155 6.367 1.00 0.00 C ATOM 23 O ASP C 2 19.936 4.779 6.906 1.00 0.00 O ATOM 24 CB ASP C 2 18.502 7.072 7.917 1.00 0.00 C ATOM 25 CG ASP C 2 18.346 8.586 7.993 1.00 0.00 C ATOM 26 OD1 ASP C 2 18.468 9.228 6.963 1.00 0.00 O ATOM 27 OD2 ASP C 2 18.105 9.083 9.081 1.00 0.00 O1- ATOM 0 H ASP C 2 16.356 6.525 6.589 1.00 0.00 H new ATOM 0 HA ASP C 2 19.125 7.222 5.857 1.00 0.00 H new ATOM 0 HB2 ASP C 2 17.710 6.587 8.488 1.00 0.00 H new ATOM 0 HB3 ASP C 2 19.448 6.773 8.368 1.00 0.00 H new ATOM 32 N ASP C 3 18.097 4.336 5.690 1.00 0.00 N ATOM 33 CA ASP C 3 18.414 2.918 5.544 1.00 0.00 C ATOM 34 C ASP C 3 19.748 2.725 4.826 1.00 0.00 C ATOM 35 O ASP C 3 20.536 1.848 5.184 1.00 0.00 O ATOM 36 CB ASP C 3 17.306 2.222 4.751 1.00 0.00 C ATOM 37 CG ASP C 3 16.042 2.119 5.597 1.00 0.00 C ATOM 38 OD1 ASP C 3 16.135 2.341 6.793 1.00 0.00 O ATOM 39 OD2 ASP C 3 15.000 1.820 5.038 1.00 0.00 O1- ATOM 0 H ASP C 3 17.231 4.626 5.236 1.00 0.00 H new ATOM 0 HA ASP C 3 18.490 2.481 6.540 1.00 0.00 H new ATOM 0 HB2 ASP C 3 17.097 2.779 3.837 1.00 0.00 H new ATOM 0 HB3 ASP C 3 17.634 1.227 4.450 1.00 0.00 H new ATOM 44 N ILE C 4 19.990 3.544 3.808 1.00 0.00 N ATOM 45 CA ILE C 4 21.227 3.452 3.040 1.00 0.00 C ATOM 46 C ILE C 4 22.429 3.786 3.924 1.00 0.00 C ATOM 47 O ILE C 4 23.446 3.093 3.901 1.00 0.00 O ATOM 48 CB ILE C 4 21.170 4.430 1.861 1.00 0.00 C ATOM 49 CG1 ILE C 4 19.953 4.123 0.970 1.00 0.00 C ATOM 50 CG2 ILE C 4 22.453 4.329 1.035 1.00 0.00 C ATOM 51 CD1 ILE C 4 19.970 2.666 0.497 1.00 0.00 C ATOM 0 H ILE C 4 19.350 4.275 3.497 1.00 0.00 H new ATOM 0 HA ILE C 4 21.337 2.433 2.668 1.00 0.00 H new ATOM 0 HB ILE C 4 21.074 5.443 2.253 1.00 0.00 H new ATOM 0 HG12 ILE C 4 19.035 4.318 1.524 1.00 0.00 H new ATOM 0 HG13 ILE C 4 19.953 4.789 0.107 1.00 0.00 H new ATOM 0 HG21 ILE C 4 22.404 5.027 0.199 1.00 0.00 H new ATOM 0 HG22 ILE C 4 23.310 4.574 1.663 1.00 0.00 H new ATOM 0 HG23 ILE C 4 22.561 3.314 0.653 1.00 0.00 H new ATOM 0 HD11 ILE C 4 19.099 2.477 -0.130 1.00 0.00 H new ATOM 0 HD12 ILE C 4 20.878 2.480 -0.077 1.00 0.00 H new ATOM 0 HD13 ILE C 4 19.945 2.003 1.361 1.00 0.00 H new ATOM 63 N TYR C 5 22.296 4.852 4.708 1.00 0.00 N ATOM 64 CA TYR C 5 23.361 5.279 5.608 1.00 0.00 C ATOM 65 C TYR C 5 23.581 4.240 6.696 1.00 0.00 C ATOM 66 O TYR C 5 24.717 3.968 7.080 1.00 0.00 O ATOM 67 CB TYR C 5 23.017 6.627 6.252 1.00 0.00 C ATOM 68 CG TYR C 5 23.230 7.741 5.254 1.00 0.00 C ATOM 69 CD1 TYR C 5 24.515 8.259 5.049 1.00 0.00 C ATOM 70 CD2 TYR C 5 22.145 8.258 4.538 1.00 0.00 C ATOM 71 CE1 TYR C 5 24.714 9.294 4.128 1.00 0.00 C ATOM 72 CE2 TYR C 5 22.344 9.293 3.617 1.00 0.00 C ATOM 73 CZ TYR C 5 23.629 9.810 3.411 1.00 0.00 C ATOM 74 OH TYR C 5 23.825 10.829 2.502 1.00 0.00 O ATOM 0 H TYR C 5 21.460 5.436 4.738 1.00 0.00 H new ATOM 0 HA TYR C 5 24.274 5.388 5.023 1.00 0.00 H new ATOM 0 HB2 TYR C 5 21.981 6.624 6.592 1.00 0.00 H new ATOM 0 HB3 TYR C 5 23.641 6.790 7.131 1.00 0.00 H new ATOM 0 HD1 TYR C 5 25.353 7.860 5.602 1.00 0.00 H new ATOM 0 HD2 TYR C 5 21.154 7.859 4.696 1.00 0.00 H new ATOM 0 HE1 TYR C 5 25.705 9.694 3.971 1.00 0.00 H new ATOM 0 HE2 TYR C 5 21.506 9.693 3.065 1.00 0.00 H new ATOM 0 HH TYR C 5 23.162 10.759 1.784 1.00 0.00 H new ATOM 84 N LYS C 6 22.491 3.653 7.184 1.00 0.00 N ATOM 85 CA LYS C 6 22.602 2.637 8.220 1.00 0.00 C ATOM 86 C LYS C 6 23.497 1.515 7.740 1.00 0.00 C ATOM 87 O LYS C 6 24.425 1.105 8.435 1.00 0.00 O ATOM 88 CB LYS C 6 21.223 2.067 8.574 1.00 0.00 C ATOM 89 CG LYS C 6 20.647 2.821 9.777 1.00 0.00 C ATOM 90 CD LYS C 6 19.208 2.364 10.067 1.00 0.00 C ATOM 91 CE LYS C 6 19.204 0.947 10.658 1.00 0.00 C ATOM 92 NZ LYS C 6 17.835 0.618 11.145 1.00 0.00 N1+ ATOM 0 H LYS C 6 21.538 3.860 6.884 1.00 0.00 H new ATOM 0 HA LYS C 6 23.030 3.099 9.109 1.00 0.00 H new ATOM 0 HB2 LYS C 6 20.551 2.157 7.720 1.00 0.00 H new ATOM 0 HB3 LYS C 6 21.306 1.005 8.804 1.00 0.00 H new ATOM 0 HG2 LYS C 6 21.272 2.649 10.653 1.00 0.00 H new ATOM 0 HG3 LYS C 6 20.661 3.893 9.581 1.00 0.00 H new ATOM 0 HD2 LYS C 6 18.733 3.056 10.763 1.00 0.00 H new ATOM 0 HD3 LYS C 6 18.622 2.383 9.148 1.00 0.00 H new ATOM 0 HE2 LYS C 6 19.517 0.225 9.903 1.00 0.00 H new ATOM 0 HE3 LYS C 6 19.919 0.881 11.478 1.00 0.00 H new ATOM 0 HZ1 LYS C 6 17.830 -0.342 11.546 1.00 0.00 H new ATOM 0 HZ2 LYS C 6 17.554 1.300 11.878 1.00 0.00 H new ATOM 0 HZ3 LYS C 6 17.164 0.665 10.352 1.00 0.00 H new ATOM 106 N ALA C 7 23.220 1.033 6.536 1.00 0.00 N ATOM 107 CA ALA C 7 24.014 -0.032 5.959 1.00 0.00 C ATOM 108 C ALA C 7 25.449 0.425 5.763 1.00 0.00 C ATOM 109 O ALA C 7 26.382 -0.329 6.020 1.00 0.00 O ATOM 110 CB ALA C 7 23.422 -0.462 4.614 1.00 0.00 C ATOM 0 H ALA C 7 22.456 1.363 5.947 1.00 0.00 H new ATOM 0 HA ALA C 7 24.003 -0.880 6.643 1.00 0.00 H new ATOM 0 HB1 ALA C 7 24.027 -1.263 4.190 1.00 0.00 H new ATOM 0 HB2 ALA C 7 22.402 -0.817 4.762 1.00 0.00 H new ATOM 0 HB3 ALA C 7 23.415 0.388 3.931 1.00 0.00 H new ATOM 116 N ALA C 8 25.629 1.665 5.313 1.00 0.00 N ATOM 117 CA ALA C 8 26.979 2.169 5.101 1.00 0.00 C ATOM 118 C ALA C 8 27.730 2.226 6.423 1.00 0.00 C ATOM 119 O ALA C 8 28.891 1.826 6.514 1.00 0.00 O ATOM 120 CB ALA C 8 26.934 3.561 4.468 1.00 0.00 C ATOM 0 H ALA C 8 24.879 2.321 5.094 1.00 0.00 H new ATOM 0 HA ALA C 8 27.500 1.492 4.424 1.00 0.00 H new ATOM 0 HB1 ALA C 8 27.950 3.924 4.316 1.00 0.00 H new ATOM 0 HB2 ALA C 8 26.420 3.508 3.508 1.00 0.00 H new ATOM 0 HB3 ALA C 8 26.400 4.244 5.128 1.00 0.00 H new ATOM 126 N VAL C 9 27.047 2.720 7.445 1.00 0.00 N ATOM 127 CA VAL C 9 27.633 2.829 8.770 1.00 0.00 C ATOM 128 C VAL C 9 27.877 1.451 9.379 1.00 0.00 C ATOM 129 O VAL C 9 28.950 1.175 9.907 1.00 0.00 O ATOM 130 CB VAL C 9 26.694 3.632 9.660 1.00 0.00 C ATOM 131 CG1 VAL C 9 27.183 3.580 11.111 1.00 0.00 C ATOM 132 CG2 VAL C 9 26.673 5.086 9.180 1.00 0.00 C ATOM 0 H VAL C 9 26.085 3.052 7.380 1.00 0.00 H new ATOM 0 HA VAL C 9 28.596 3.333 8.690 1.00 0.00 H new ATOM 0 HB VAL C 9 25.691 3.210 9.607 1.00 0.00 H new ATOM 0 HG11 VAL C 9 26.508 4.156 11.743 1.00 0.00 H new ATOM 0 HG12 VAL C 9 27.204 2.545 11.451 1.00 0.00 H new ATOM 0 HG13 VAL C 9 28.186 4.002 11.172 1.00 0.00 H new ATOM 0 HG21 VAL C 9 26.003 5.668 9.812 1.00 0.00 H new ATOM 0 HG22 VAL C 9 27.679 5.503 9.237 1.00 0.00 H new ATOM 0 HG23 VAL C 9 26.323 5.124 8.148 1.00 0.00 H new ATOM 142 N GLU C 10 26.875 0.585 9.297 1.00 0.00 N ATOM 143 CA GLU C 10 26.991 -0.758 9.847 1.00 0.00 C ATOM 144 C GLU C 10 28.113 -1.520 9.151 1.00 0.00 C ATOM 145 O GLU C 10 28.779 -2.358 9.758 1.00 0.00 O ATOM 146 CB GLU C 10 25.669 -1.510 9.697 1.00 0.00 C ATOM 147 CG GLU C 10 25.750 -2.818 10.484 1.00 0.00 C ATOM 148 CD GLU C 10 24.423 -3.563 10.404 1.00 0.00 C ATOM 149 OE1 GLU C 10 23.427 -2.931 10.092 1.00 0.00 O ATOM 150 OE2 GLU C 10 24.421 -4.758 10.653 1.00 0.00 O1- ATOM 0 H GLU C 10 25.977 0.788 8.857 1.00 0.00 H new ATOM 0 HA GLU C 10 27.228 -0.679 10.908 1.00 0.00 H new ATOM 0 HB2 GLU C 10 24.844 -0.899 10.065 1.00 0.00 H new ATOM 0 HB3 GLU C 10 25.469 -1.715 8.645 1.00 0.00 H new ATOM 0 HG2 GLU C 10 26.550 -3.442 10.086 1.00 0.00 H new ATOM 0 HG3 GLU C 10 25.996 -2.610 11.525 1.00 0.00 H new ATOM 157 N GLN C 11 28.305 -1.231 7.869 1.00 0.00 N ATOM 158 CA GLN C 11 29.338 -1.900 7.084 1.00 0.00 C ATOM 159 C GLN C 11 30.729 -1.647 7.674 1.00 0.00 C ATOM 160 O GLN C 11 31.585 -2.532 7.640 1.00 0.00 O ATOM 161 CB GLN C 11 29.302 -1.386 5.641 1.00 0.00 C ATOM 162 CG GLN C 11 30.208 -2.240 4.749 1.00 0.00 C ATOM 163 CD GLN C 11 29.607 -3.628 4.578 1.00 0.00 C ATOM 164 OE1 GLN C 11 28.407 -3.813 4.782 1.00 0.00 O ATOM 165 NE2 GLN C 11 30.366 -4.618 4.194 1.00 0.00 N ATOM 0 H GLN C 11 27.761 -0.540 7.352 1.00 0.00 H new ATOM 0 HA GLN C 11 29.140 -2.972 7.105 1.00 0.00 H new ATOM 0 HB2 GLN C 11 28.280 -1.413 5.264 1.00 0.00 H new ATOM 0 HB3 GLN C 11 29.626 -0.346 5.610 1.00 0.00 H new ATOM 0 HG2 GLN C 11 30.328 -1.764 3.776 1.00 0.00 H new ATOM 0 HG3 GLN C 11 31.201 -2.316 5.191 1.00 0.00 H new ATOM 0 HE21 GLN C 11 31.360 -4.463 4.025 1.00 0.00 H new ATOM 0 HE22 GLN C 11 29.965 -5.547 4.062 1.00 0.00 H new ATOM 174 N LEU C 12 30.964 -0.447 8.210 1.00 0.00 N ATOM 175 CA LEU C 12 32.271 -0.138 8.788 1.00 0.00 C ATOM 176 C LEU C 12 32.695 -1.232 9.760 1.00 0.00 C ATOM 177 O LEU C 12 31.911 -2.117 10.100 1.00 0.00 O ATOM 178 CB LEU C 12 32.236 1.195 9.538 1.00 0.00 C ATOM 179 CG LEU C 12 32.811 2.308 8.664 1.00 0.00 C ATOM 180 CD1 LEU C 12 32.067 2.354 7.328 1.00 0.00 C ATOM 181 CD2 LEU C 12 32.641 3.646 9.389 1.00 0.00 C ATOM 0 H LEU C 12 30.282 0.311 8.255 1.00 0.00 H new ATOM 0 HA LEU C 12 32.986 -0.073 7.968 1.00 0.00 H new ATOM 0 HB2 LEU C 12 31.211 1.436 9.818 1.00 0.00 H new ATOM 0 HB3 LEU C 12 32.809 1.116 10.462 1.00 0.00 H new ATOM 0 HG LEU C 12 33.868 2.118 8.477 1.00 0.00 H new ATOM 0 HD11 LEU C 12 32.481 3.149 6.708 1.00 0.00 H new ATOM 0 HD12 LEU C 12 32.180 1.399 6.815 1.00 0.00 H new ATOM 0 HD13 LEU C 12 31.009 2.547 7.507 1.00 0.00 H new ATOM 0 HD21 LEU C 12 33.049 4.448 8.773 1.00 0.00 H new ATOM 0 HD22 LEU C 12 31.582 3.830 9.570 1.00 0.00 H new ATOM 0 HD23 LEU C 12 33.171 3.614 10.341 1.00 0.00 H new ATOM 193 N THR C 13 33.943 -1.157 10.198 1.00 0.00 N ATOM 194 CA THR C 13 34.485 -2.128 11.133 1.00 0.00 C ATOM 195 C THR C 13 34.462 -1.592 12.561 1.00 0.00 C ATOM 196 O THR C 13 34.310 -0.390 12.783 1.00 0.00 O ATOM 197 CB THR C 13 35.914 -2.471 10.737 1.00 0.00 C ATOM 198 OG1 THR C 13 36.675 -1.281 10.687 1.00 0.00 O ATOM 199 CG2 THR C 13 35.922 -3.139 9.368 1.00 0.00 C ATOM 0 H THR C 13 34.601 -0.430 9.918 1.00 0.00 H new ATOM 0 HA THR C 13 33.864 -3.023 11.097 1.00 0.00 H new ATOM 0 HB THR C 13 36.344 -3.154 11.469 1.00 0.00 H new ATOM 0 HG1 THR C 13 37.522 -1.454 10.226 1.00 0.00 H new ATOM 0 HG21 THR C 13 36.947 -3.383 9.088 1.00 0.00 H new ATOM 0 HG22 THR C 13 35.329 -4.053 9.406 1.00 0.00 H new ATOM 0 HG23 THR C 13 35.496 -2.460 8.629 1.00 0.00 H new ATOM 207 N GLU C 14 34.609 -2.497 13.522 1.00 0.00 N ATOM 208 CA GLU C 14 34.599 -2.116 14.930 1.00 0.00 C ATOM 209 C GLU C 14 35.757 -1.184 15.243 1.00 0.00 C ATOM 210 O GLU C 14 35.618 -0.230 16.004 1.00 0.00 O ATOM 211 CB GLU C 14 34.693 -3.364 15.811 1.00 0.00 C ATOM 212 CG GLU C 14 33.388 -4.157 15.712 1.00 0.00 C ATOM 213 CD GLU C 14 33.517 -5.473 16.470 1.00 0.00 C ATOM 214 OE1 GLU C 14 34.624 -5.799 16.865 1.00 0.00 O ATOM 215 OE2 GLU C 14 32.507 -6.135 16.645 1.00 0.00 O1- ATOM 0 H GLU C 14 34.736 -3.495 13.354 1.00 0.00 H new ATOM 0 HA GLU C 14 33.664 -1.595 15.137 1.00 0.00 H new ATOM 0 HB2 GLU C 14 35.532 -3.983 15.495 1.00 0.00 H new ATOM 0 HB3 GLU C 14 34.880 -3.078 16.846 1.00 0.00 H new ATOM 0 HG2 GLU C 14 32.565 -3.571 16.122 1.00 0.00 H new ATOM 0 HG3 GLU C 14 33.150 -4.352 14.666 1.00 0.00 H new ATOM 222 N GLU C 15 36.894 -1.471 14.640 1.00 0.00 N ATOM 223 CA GLU C 15 38.085 -0.657 14.847 1.00 0.00 C ATOM 224 C GLU C 15 37.896 0.730 14.253 1.00 0.00 C ATOM 225 O GLU C 15 38.219 1.735 14.887 1.00 0.00 O ATOM 226 CB GLU C 15 39.304 -1.330 14.221 1.00 0.00 C ATOM 227 CG GLU C 15 38.888 -2.086 12.963 1.00 0.00 C ATOM 228 CD GLU C 15 40.118 -2.439 12.134 1.00 0.00 C ATOM 229 OE1 GLU C 15 40.999 -3.096 12.667 1.00 0.00 O ATOM 230 OE2 GLU C 15 40.165 -2.042 10.982 1.00 0.00 O1- ATOM 0 H GLU C 15 37.023 -2.258 14.004 1.00 0.00 H new ATOM 0 HA GLU C 15 38.248 -0.558 15.920 1.00 0.00 H new ATOM 0 HB2 GLU C 15 40.057 -0.582 13.974 1.00 0.00 H new ATOM 0 HB3 GLU C 15 39.759 -2.016 14.935 1.00 0.00 H new ATOM 0 HG2 GLU C 15 38.351 -2.994 13.236 1.00 0.00 H new ATOM 0 HG3 GLU C 15 38.204 -1.476 12.372 1.00 0.00 H new ATOM 237 N GLN C 16 37.363 0.781 13.042 1.00 0.00 N ATOM 238 CA GLN C 16 37.127 2.063 12.394 1.00 0.00 C ATOM 239 C GLN C 16 36.145 2.881 13.224 1.00 0.00 C ATOM 240 O GLN C 16 36.332 4.081 13.428 1.00 0.00 O ATOM 241 CB GLN C 16 36.566 1.835 10.990 1.00 0.00 C ATOM 242 CG GLN C 16 37.666 1.273 10.087 1.00 0.00 C ATOM 243 CD GLN C 16 37.059 0.754 8.789 1.00 0.00 C ATOM 244 OE1 GLN C 16 35.851 0.534 8.712 1.00 0.00 O ATOM 245 NE2 GLN C 16 37.832 0.535 7.762 1.00 0.00 N ATOM 0 H GLN C 16 37.089 -0.035 12.495 1.00 0.00 H new ATOM 0 HA GLN C 16 38.067 2.609 12.315 1.00 0.00 H new ATOM 0 HB2 GLN C 16 35.725 1.143 11.031 1.00 0.00 H new ATOM 0 HB3 GLN C 16 36.188 2.772 10.581 1.00 0.00 H new ATOM 0 HG2 GLN C 16 38.401 2.048 9.870 1.00 0.00 H new ATOM 0 HG3 GLN C 16 38.193 0.468 10.599 1.00 0.00 H new ATOM 0 HE21 GLN C 16 38.833 0.718 7.829 1.00 0.00 H new ATOM 0 HE22 GLN C 16 37.436 0.180 6.892 1.00 0.00 H new ATOM 254 N LYS C 17 35.109 2.218 13.725 1.00 0.00 N ATOM 255 CA LYS C 17 34.120 2.889 14.556 1.00 0.00 C ATOM 256 C LYS C 17 34.737 3.376 15.850 1.00 0.00 C ATOM 257 O LYS C 17 34.378 4.439 16.353 1.00 0.00 O ATOM 258 CB LYS C 17 32.939 1.965 14.860 1.00 0.00 C ATOM 259 CG LYS C 17 32.046 1.850 13.619 1.00 0.00 C ATOM 260 CD LYS C 17 30.815 0.997 13.939 1.00 0.00 C ATOM 261 CE LYS C 17 31.011 -0.412 13.387 1.00 0.00 C ATOM 262 NZ LYS C 17 30.841 -0.388 11.909 1.00 0.00 N1+ ATOM 0 H LYS C 17 34.934 1.225 13.571 1.00 0.00 H new ATOM 0 HA LYS C 17 33.755 3.750 13.997 1.00 0.00 H new ATOM 0 HB2 LYS C 17 33.301 0.979 15.153 1.00 0.00 H new ATOM 0 HB3 LYS C 17 32.364 2.356 15.699 1.00 0.00 H new ATOM 0 HG2 LYS C 17 31.736 2.842 13.290 1.00 0.00 H new ATOM 0 HG3 LYS C 17 32.606 1.402 12.798 1.00 0.00 H new ATOM 0 HD2 LYS C 17 30.658 0.958 15.017 1.00 0.00 H new ATOM 0 HD3 LYS C 17 29.924 1.449 13.503 1.00 0.00 H new ATOM 0 HE2 LYS C 17 32.004 -0.781 13.645 1.00 0.00 H new ATOM 0 HE3 LYS C 17 30.290 -1.095 13.837 1.00 0.00 H new ATOM 0 HZ1 LYS C 17 31.057 -1.328 11.519 1.00 0.00 H new ATOM 0 HZ2 LYS C 17 29.860 -0.134 11.677 1.00 0.00 H new ATOM 0 HZ3 LYS C 17 31.488 0.314 11.497 1.00 0.00 H new ATOM 276 N ASN C 18 35.644 2.591 16.406 1.00 0.00 N ATOM 277 CA ASN C 18 36.254 2.979 17.658 1.00 0.00 C ATOM 278 C ASN C 18 36.997 4.302 17.508 1.00 0.00 C ATOM 279 O ASN C 18 36.894 5.186 18.362 1.00 0.00 O ATOM 280 CB ASN C 18 37.228 1.892 18.126 1.00 0.00 C ATOM 281 CG ASN C 18 36.468 0.644 18.559 1.00 0.00 C ATOM 282 OD1 ASN C 18 35.165 0.663 18.584 1.00 0.00 O flip ATOM 283 ND2 ASN C 18 37.077 -0.380 18.870 1.00 0.00 N flip ATOM 0 H ASN C 18 35.966 1.704 16.019 1.00 0.00 H new ATOM 0 HA ASN C 18 35.465 3.103 18.400 1.00 0.00 H new ATOM 0 HB2 ASN C 18 37.919 1.643 17.320 1.00 0.00 H new ATOM 0 HB3 ASN C 18 37.828 2.266 18.956 1.00 0.00 H new ATOM 0 HD21 ASN C 18 38.097 -0.393 18.850 1.00 0.00 H new ATOM 0 HD22 ASN C 18 36.562 -1.215 19.148 1.00 0.00 H new ATOM 290 N GLU C 19 37.734 4.441 16.413 1.00 0.00 N ATOM 291 CA GLU C 19 38.477 5.673 16.168 1.00 0.00 C ATOM 292 C GLU C 19 37.525 6.845 15.961 1.00 0.00 C ATOM 293 O GLU C 19 37.785 7.962 16.406 1.00 0.00 O ATOM 294 CB GLU C 19 39.377 5.513 14.940 1.00 0.00 C ATOM 295 CG GLU C 19 40.489 4.511 15.252 1.00 0.00 C ATOM 296 CD GLU C 19 41.466 5.114 16.257 1.00 0.00 C ATOM 297 OE1 GLU C 19 41.426 6.319 16.441 1.00 0.00 O ATOM 298 OE2 GLU C 19 42.238 4.361 16.829 1.00 0.00 O1- ATOM 0 H GLU C 19 37.834 3.729 15.690 1.00 0.00 H new ATOM 0 HA GLU C 19 39.096 5.877 17.042 1.00 0.00 H new ATOM 0 HB2 GLU C 19 38.791 5.169 14.088 1.00 0.00 H new ATOM 0 HB3 GLU C 19 39.807 6.475 14.663 1.00 0.00 H new ATOM 0 HG2 GLU C 19 40.061 3.593 15.654 1.00 0.00 H new ATOM 0 HG3 GLU C 19 41.016 4.242 14.336 1.00 0.00 H new ATOM 305 N PHE C 20 36.425 6.580 15.269 1.00 0.00 N ATOM 306 CA PHE C 20 35.439 7.614 14.984 1.00 0.00 C ATOM 307 C PHE C 20 34.829 8.146 16.281 1.00 0.00 C ATOM 308 O PHE C 20 34.622 9.350 16.437 1.00 0.00 O ATOM 309 CB PHE C 20 34.333 7.031 14.099 1.00 0.00 C ATOM 310 CG PHE C 20 34.738 7.083 12.639 1.00 0.00 C ATOM 311 CD1 PHE C 20 36.053 6.789 12.246 1.00 0.00 C ATOM 312 CD2 PHE C 20 33.784 7.421 11.672 1.00 0.00 C ATOM 313 CE1 PHE C 20 36.408 6.836 10.892 1.00 0.00 C ATOM 314 CE2 PHE C 20 34.141 7.467 10.318 1.00 0.00 C ATOM 315 CZ PHE C 20 35.452 7.175 9.929 1.00 0.00 C ATOM 0 H PHE C 20 36.193 5.660 14.895 1.00 0.00 H new ATOM 0 HA PHE C 20 35.932 8.437 14.467 1.00 0.00 H new ATOM 0 HB2 PHE C 20 34.132 6.000 14.390 1.00 0.00 H new ATOM 0 HB3 PHE C 20 33.409 7.590 14.246 1.00 0.00 H new ATOM 0 HD1 PHE C 20 36.792 6.526 12.989 1.00 0.00 H new ATOM 0 HD2 PHE C 20 32.771 7.647 11.970 1.00 0.00 H new ATOM 0 HE1 PHE C 20 37.420 6.610 10.591 1.00 0.00 H new ATOM 0 HE2 PHE C 20 33.403 7.728 9.574 1.00 0.00 H new ATOM 0 HZ PHE C 20 35.726 7.211 8.885 1.00 0.00 H new ATOM 325 N LYS C 21 34.546 7.238 17.207 1.00 0.00 N ATOM 326 CA LYS C 21 33.966 7.615 18.490 1.00 0.00 C ATOM 327 C LYS C 21 34.926 8.527 19.253 1.00 0.00 C ATOM 328 O LYS C 21 34.506 9.491 19.891 1.00 0.00 O ATOM 329 CB LYS C 21 33.674 6.363 19.324 1.00 0.00 C ATOM 330 CG LYS C 21 32.717 6.721 20.466 1.00 0.00 C ATOM 331 CD LYS C 21 32.620 5.545 21.447 1.00 0.00 C ATOM 332 CE LYS C 21 31.151 5.179 21.682 1.00 0.00 C ATOM 333 NZ LYS C 21 30.610 4.497 20.471 1.00 0.00 N1+ ATOM 0 H LYS C 21 34.708 6.237 17.094 1.00 0.00 H new ATOM 0 HA LYS C 21 33.034 8.149 18.308 1.00 0.00 H new ATOM 0 HB2 LYS C 21 33.234 5.589 18.695 1.00 0.00 H new ATOM 0 HB3 LYS C 21 34.602 5.957 19.727 1.00 0.00 H new ATOM 0 HG2 LYS C 21 33.072 7.612 20.985 1.00 0.00 H new ATOM 0 HG3 LYS C 21 31.731 6.956 20.067 1.00 0.00 H new ATOM 0 HD2 LYS C 21 33.159 4.684 21.050 1.00 0.00 H new ATOM 0 HD3 LYS C 21 33.093 5.809 22.393 1.00 0.00 H new ATOM 0 HE2 LYS C 21 31.062 4.526 22.551 1.00 0.00 H new ATOM 0 HE3 LYS C 21 30.571 6.077 21.897 1.00 0.00 H new ATOM 0 HZ1 LYS C 21 29.646 4.158 20.665 1.00 0.00 H new ATOM 0 HZ2 LYS C 21 30.588 5.167 19.676 1.00 0.00 H new ATOM 0 HZ3 LYS C 21 31.218 3.690 20.226 1.00 0.00 H new ATOM 347 N ALA C 22 36.219 8.213 19.184 1.00 0.00 N ATOM 348 CA ALA C 22 37.226 9.016 19.874 1.00 0.00 C ATOM 349 C ALA C 22 37.216 10.449 19.354 1.00 0.00 C ATOM 350 O ALA C 22 37.328 11.403 20.126 1.00 0.00 O ATOM 351 CB ALA C 22 38.615 8.411 19.658 1.00 0.00 C ATOM 0 H ALA C 22 36.590 7.418 18.664 1.00 0.00 H new ATOM 0 HA ALA C 22 36.990 9.021 20.938 1.00 0.00 H new ATOM 0 HB1 ALA C 22 39.360 9.016 20.176 1.00 0.00 H new ATOM 0 HB2 ALA C 22 38.635 7.395 20.052 1.00 0.00 H new ATOM 0 HB3 ALA C 22 38.841 8.391 18.592 1.00 0.00 H new ATOM 357 N ALA C 23 37.080 10.595 18.040 1.00 0.00 N ATOM 358 CA ALA C 23 37.053 11.919 17.427 1.00 0.00 C ATOM 359 C ALA C 23 35.861 12.716 17.944 1.00 0.00 C ATOM 360 O ALA C 23 35.962 13.917 18.191 1.00 0.00 O ATOM 361 CB ALA C 23 36.968 11.792 15.905 1.00 0.00 C ATOM 0 H ALA C 23 36.987 9.820 17.383 1.00 0.00 H new ATOM 0 HA ALA C 23 37.971 12.443 17.691 1.00 0.00 H new ATOM 0 HB1 ALA C 23 36.948 12.786 15.458 1.00 0.00 H new ATOM 0 HB2 ALA C 23 37.836 11.245 15.536 1.00 0.00 H new ATOM 0 HB3 ALA C 23 36.059 11.255 15.635 1.00 0.00 H new ATOM 367 N PHE C 24 34.735 12.035 18.106 1.00 0.00 N ATOM 368 CA PHE C 24 33.524 12.682 18.595 1.00 0.00 C ATOM 369 C PHE C 24 33.777 13.299 19.968 1.00 0.00 C ATOM 370 O PHE C 24 33.405 14.444 20.222 1.00 0.00 O ATOM 371 CB PHE C 24 32.386 11.668 18.691 1.00 0.00 C ATOM 372 CG PHE C 24 31.136 12.358 19.182 1.00 0.00 C ATOM 373 CD1 PHE C 24 30.313 13.042 18.278 1.00 0.00 C ATOM 374 CD2 PHE C 24 30.800 12.319 20.540 1.00 0.00 C ATOM 375 CE1 PHE C 24 29.154 13.684 18.732 1.00 0.00 C ATOM 376 CE2 PHE C 24 29.642 12.961 20.995 1.00 0.00 C ATOM 377 CZ PHE C 24 28.820 13.643 20.091 1.00 0.00 C ATOM 0 H PHE C 24 34.634 11.040 17.907 1.00 0.00 H new ATOM 0 HA PHE C 24 33.243 13.468 17.894 1.00 0.00 H new ATOM 0 HB2 PHE C 24 32.205 11.215 17.716 1.00 0.00 H new ATOM 0 HB3 PHE C 24 32.660 10.861 19.371 1.00 0.00 H new ATOM 0 HD1 PHE C 24 30.572 13.074 17.230 1.00 0.00 H new ATOM 0 HD2 PHE C 24 31.435 11.793 21.238 1.00 0.00 H new ATOM 0 HE1 PHE C 24 28.519 14.210 18.035 1.00 0.00 H new ATOM 0 HE2 PHE C 24 29.383 12.930 22.043 1.00 0.00 H new ATOM 0 HZ PHE C 24 27.927 14.138 20.442 1.00 0.00 H new ATOM 387 N ASP C 25 34.413 12.529 20.846 1.00 0.00 N ATOM 388 CA ASP C 25 34.714 13.010 22.192 1.00 0.00 C ATOM 389 C ASP C 25 35.567 14.274 22.127 1.00 0.00 C ATOM 390 O ASP C 25 35.307 15.249 22.829 1.00 0.00 O ATOM 391 CB ASP C 25 35.468 11.932 22.972 1.00 0.00 C ATOM 392 CG ASP C 25 35.765 12.421 24.385 1.00 0.00 C ATOM 393 OD1 ASP C 25 35.412 13.549 24.688 1.00 0.00 O ATOM 394 OD2 ASP C 25 36.349 11.663 25.143 1.00 0.00 O1- ATOM 0 H ASP C 25 34.728 11.578 20.653 1.00 0.00 H new ATOM 0 HA ASP C 25 33.775 13.239 22.696 1.00 0.00 H new ATOM 0 HB2 ASP C 25 34.875 11.019 23.012 1.00 0.00 H new ATOM 0 HB3 ASP C 25 36.399 11.686 22.461 1.00 0.00 H new ATOM 399 N ILE C 26 36.584 14.255 21.278 1.00 0.00 N ATOM 400 CA ILE C 26 37.456 15.402 21.126 1.00 0.00 C ATOM 401 C ILE C 26 36.688 16.582 20.537 1.00 0.00 C ATOM 402 O ILE C 26 36.855 17.722 20.961 1.00 0.00 O ATOM 403 CB ILE C 26 38.621 15.032 20.221 1.00 0.00 C ATOM 404 CG1 ILE C 26 39.495 14.005 20.942 1.00 0.00 C ATOM 405 CG2 ILE C 26 39.438 16.283 19.928 1.00 0.00 C ATOM 406 CD1 ILE C 26 40.500 13.409 19.960 1.00 0.00 C ATOM 0 H ILE C 26 36.822 13.459 20.687 1.00 0.00 H new ATOM 0 HA ILE C 26 37.835 15.695 22.105 1.00 0.00 H new ATOM 0 HB ILE C 26 38.255 14.611 19.285 1.00 0.00 H new ATOM 0 HG12 ILE C 26 40.019 14.478 21.773 1.00 0.00 H new ATOM 0 HG13 ILE C 26 38.873 13.216 21.365 1.00 0.00 H new ATOM 0 HG21 ILE C 26 40.276 16.027 19.279 1.00 0.00 H new ATOM 0 HG22 ILE C 26 38.808 17.021 19.432 1.00 0.00 H new ATOM 0 HG23 ILE C 26 39.816 16.698 20.862 1.00 0.00 H new ATOM 0 HD11 ILE C 26 41.122 12.677 20.475 1.00 0.00 H new ATOM 0 HD12 ILE C 26 39.966 12.921 19.144 1.00 0.00 H new ATOM 0 HD13 ILE C 26 41.130 14.202 19.558 1.00 0.00 H new ATOM 418 N PHE C 27 35.849 16.293 19.549 1.00 0.00 N ATOM 419 CA PHE C 27 35.064 17.335 18.897 1.00 0.00 C ATOM 420 C PHE C 27 34.289 18.155 19.926 1.00 0.00 C ATOM 421 O PHE C 27 34.171 19.373 19.796 1.00 0.00 O ATOM 422 CB PHE C 27 34.075 16.701 17.919 1.00 0.00 C ATOM 423 CG PHE C 27 34.045 17.498 16.636 1.00 0.00 C ATOM 424 CD1 PHE C 27 33.670 18.848 16.655 1.00 0.00 C ATOM 425 CD2 PHE C 27 34.396 16.888 15.424 1.00 0.00 C ATOM 426 CE1 PHE C 27 33.646 19.585 15.465 1.00 0.00 C ATOM 427 CE2 PHE C 27 34.372 17.627 14.235 1.00 0.00 C ATOM 428 CZ PHE C 27 33.997 18.974 14.255 1.00 0.00 C ATOM 0 H PHE C 27 35.695 15.353 19.184 1.00 0.00 H new ATOM 0 HA PHE C 27 35.749 17.993 18.362 1.00 0.00 H new ATOM 0 HB2 PHE C 27 34.364 15.671 17.712 1.00 0.00 H new ATOM 0 HB3 PHE C 27 33.080 16.670 18.362 1.00 0.00 H new ATOM 0 HD1 PHE C 27 33.399 19.320 17.588 1.00 0.00 H new ATOM 0 HD2 PHE C 27 34.685 15.848 15.407 1.00 0.00 H new ATOM 0 HE1 PHE C 27 33.357 20.625 15.480 1.00 0.00 H new ATOM 0 HE2 PHE C 27 34.643 17.156 13.302 1.00 0.00 H new ATOM 0 HZ PHE C 27 33.978 19.543 13.337 1.00 0.00 H new ATOM 438 N VAL C 28 33.755 17.484 20.943 1.00 0.00 N ATOM 439 CA VAL C 28 32.985 18.179 21.971 1.00 0.00 C ATOM 440 C VAL C 28 33.902 18.762 23.044 1.00 0.00 C ATOM 441 O VAL C 28 33.483 18.970 24.183 1.00 0.00 O ATOM 442 CB VAL C 28 31.953 17.237 22.603 1.00 0.00 C ATOM 443 CG1 VAL C 28 30.937 16.815 21.540 1.00 0.00 C ATOM 444 CG2 VAL C 28 32.647 15.993 23.155 1.00 0.00 C ATOM 0 H VAL C 28 33.839 16.476 21.077 1.00 0.00 H new ATOM 0 HA VAL C 28 32.456 19.003 21.493 1.00 0.00 H new ATOM 0 HB VAL C 28 31.447 17.757 23.417 1.00 0.00 H new ATOM 0 HG11 VAL C 28 30.201 16.145 21.985 1.00 0.00 H new ATOM 0 HG12 VAL C 28 30.433 17.698 21.148 1.00 0.00 H new ATOM 0 HG13 VAL C 28 31.452 16.301 20.729 1.00 0.00 H new ATOM 0 HG21 VAL C 28 31.905 15.331 23.602 1.00 0.00 H new ATOM 0 HG22 VAL C 28 33.158 15.472 22.345 1.00 0.00 H new ATOM 0 HG23 VAL C 28 33.373 16.288 23.912 1.00 0.00 H new ATOM 454 N LEU C 29 35.152 19.027 22.666 1.00 0.00 N ATOM 455 CA LEU C 29 36.127 19.597 23.592 1.00 0.00 C ATOM 456 C LEU C 29 35.509 20.707 24.444 1.00 0.00 C ATOM 457 O LEU C 29 35.774 20.794 25.644 1.00 0.00 O ATOM 458 CB LEU C 29 37.325 20.162 22.815 1.00 0.00 C ATOM 459 CG LEU C 29 36.849 21.172 21.766 1.00 0.00 C ATOM 460 CD1 LEU C 29 37.104 22.591 22.272 1.00 0.00 C ATOM 461 CD2 LEU C 29 37.621 20.954 20.464 1.00 0.00 C ATOM 0 H LEU C 29 35.512 18.856 21.727 1.00 0.00 H new ATOM 0 HA LEU C 29 36.458 18.798 24.255 1.00 0.00 H new ATOM 0 HB2 LEU C 29 38.020 20.643 23.504 1.00 0.00 H new ATOM 0 HB3 LEU C 29 37.867 19.351 22.329 1.00 0.00 H new ATOM 0 HG LEU C 29 35.783 21.034 21.587 1.00 0.00 H new ATOM 0 HD11 LEU C 29 36.765 23.310 21.526 1.00 0.00 H new ATOM 0 HD12 LEU C 29 36.558 22.749 23.202 1.00 0.00 H new ATOM 0 HD13 LEU C 29 38.171 22.728 22.450 1.00 0.00 H new ATOM 0 HD21 LEU C 29 37.284 21.672 19.716 1.00 0.00 H new ATOM 0 HD22 LEU C 29 38.687 21.093 20.645 1.00 0.00 H new ATOM 0 HD23 LEU C 29 37.444 19.942 20.101 1.00 0.00 H new ATOM 473 N GLY C 30 34.702 21.564 23.819 1.00 0.00 N ATOM 474 CA GLY C 30 34.072 22.673 24.535 1.00 0.00 C ATOM 475 C GLY C 30 32.583 22.431 24.792 1.00 0.00 C ATOM 476 O GLY C 30 31.850 23.373 25.096 1.00 0.00 O ATOM 0 H GLY C 30 34.470 21.513 22.827 1.00 0.00 H new ATOM 0 HA2 GLY C 30 34.582 22.824 25.486 1.00 0.00 H new ATOM 0 HA3 GLY C 30 34.194 23.590 23.959 1.00 0.00 H new ATOM 480 N ALA C 31 32.133 21.184 24.652 1.00 0.00 N ATOM 481 CA ALA C 31 30.719 20.868 24.865 1.00 0.00 C ATOM 482 C ALA C 31 30.537 19.898 26.028 1.00 0.00 C ATOM 483 O ALA C 31 30.753 18.695 25.886 1.00 0.00 O ATOM 484 CB ALA C 31 30.134 20.254 23.597 1.00 0.00 C ATOM 0 H ALA C 31 32.716 20.387 24.396 1.00 0.00 H new ATOM 0 HA ALA C 31 30.198 21.794 25.106 1.00 0.00 H new ATOM 0 HB1 ALA C 31 29.082 20.020 23.758 1.00 0.00 H new ATOM 0 HB2 ALA C 31 30.226 20.962 22.774 1.00 0.00 H new ATOM 0 HB3 ALA C 31 30.676 19.340 23.352 1.00 0.00 H new ATOM 490 N GLU C 32 30.118 20.428 27.172 1.00 0.00 N ATOM 491 CA GLU C 32 29.893 19.597 28.349 1.00 0.00 C ATOM 492 C GLU C 32 28.656 18.735 28.162 1.00 0.00 C ATOM 493 O GLU C 32 28.485 17.717 28.832 1.00 0.00 O ATOM 494 CB GLU C 32 29.734 20.471 29.597 1.00 0.00 C ATOM 495 CG GLU C 32 30.924 20.256 30.534 1.00 0.00 C ATOM 496 CD GLU C 32 30.833 18.869 31.164 1.00 0.00 C ATOM 497 OE1 GLU C 32 30.215 18.756 32.210 1.00 0.00 O1- ATOM 498 OE2 GLU C 32 31.377 17.940 30.589 1.00 0.00 O ATOM 0 H GLU C 32 29.929 21.421 27.309 1.00 0.00 H new ATOM 0 HA GLU C 32 30.759 18.948 28.480 1.00 0.00 H new ATOM 0 HB2 GLU C 32 29.669 21.521 29.311 1.00 0.00 H new ATOM 0 HB3 GLU C 32 28.805 20.222 30.111 1.00 0.00 H new ATOM 0 HG2 GLU C 32 31.858 20.355 29.981 1.00 0.00 H new ATOM 0 HG3 GLU C 32 30.931 21.020 31.311 1.00 0.00 H new ATOM 505 N ASP C 33 27.801 19.151 27.245 1.00 0.00 N ATOM 506 CA ASP C 33 26.579 18.414 26.969 1.00 0.00 C ATOM 507 C ASP C 33 26.897 17.095 26.267 1.00 0.00 C ATOM 508 O ASP C 33 26.079 16.174 26.263 1.00 0.00 O ATOM 509 CB ASP C 33 25.648 19.255 26.096 1.00 0.00 C ATOM 510 CG ASP C 33 25.082 20.415 26.910 1.00 0.00 C ATOM 511 OD1 ASP C 33 25.202 20.375 28.124 1.00 0.00 O ATOM 512 OD2 ASP C 33 24.539 21.326 26.309 1.00 0.00 O1- ATOM 0 H ASP C 33 27.928 19.991 26.681 1.00 0.00 H new ATOM 0 HA ASP C 33 26.084 18.196 27.915 1.00 0.00 H new ATOM 0 HB2 ASP C 33 26.192 19.637 25.232 1.00 0.00 H new ATOM 0 HB3 ASP C 33 24.836 18.637 25.714 1.00 0.00 H new ATOM 517 N GLY C 34 28.090 17.005 25.679 1.00 0.00 N ATOM 518 CA GLY C 34 28.496 15.788 24.987 1.00 0.00 C ATOM 519 C GLY C 34 27.934 15.763 23.574 1.00 0.00 C ATOM 520 O GLY C 34 27.984 14.738 22.892 1.00 0.00 O ATOM 0 H GLY C 34 28.783 17.753 25.669 1.00 0.00 H new ATOM 0 HA2 GLY C 34 29.584 15.728 24.953 1.00 0.00 H new ATOM 0 HA3 GLY C 34 28.146 14.915 25.539 1.00 0.00 H new ATOM 524 N CYS C 35 27.399 16.902 23.149 1.00 0.00 N ATOM 525 CA CYS C 35 26.821 17.016 21.814 1.00 0.00 C ATOM 526 C CYS C 35 27.550 18.083 21.001 1.00 0.00 C ATOM 527 O CYS C 35 28.019 19.083 21.545 1.00 0.00 O ATOM 528 CB CYS C 35 25.337 17.378 21.921 1.00 0.00 C ATOM 529 SG CYS C 35 24.464 16.077 22.829 1.00 0.00 S ATOM 0 H CYS C 35 27.353 17.756 23.706 1.00 0.00 H new ATOM 0 HA CYS C 35 26.928 16.057 21.308 1.00 0.00 H new ATOM 0 HB2 CYS C 35 25.221 18.334 22.432 1.00 0.00 H new ATOM 0 HB3 CYS C 35 24.907 17.494 20.926 1.00 0.00 H new ATOM 0 HG CYS C 35 23.204 16.384 22.923 1.00 0.00 H new ATOM 535 N ILE C 36 27.639 17.861 19.694 1.00 0.00 N ATOM 536 CA ILE C 36 28.307 18.806 18.806 1.00 0.00 C ATOM 537 C ILE C 36 27.291 19.766 18.206 1.00 0.00 C ATOM 538 O ILE C 36 26.286 19.344 17.638 1.00 0.00 O ATOM 539 CB ILE C 36 29.022 18.046 17.688 1.00 0.00 C ATOM 540 CG1 ILE C 36 30.133 17.179 18.293 1.00 0.00 C ATOM 541 CG2 ILE C 36 29.623 19.031 16.678 1.00 0.00 C ATOM 542 CD1 ILE C 36 30.691 16.224 17.230 1.00 0.00 C ATOM 0 H ILE C 36 27.258 17.038 19.227 1.00 0.00 H new ATOM 0 HA ILE C 36 29.038 19.376 19.380 1.00 0.00 H new ATOM 0 HB ILE C 36 28.303 17.410 17.171 1.00 0.00 H new ATOM 0 HG12 ILE C 36 30.931 17.813 18.679 1.00 0.00 H new ATOM 0 HG13 ILE C 36 29.743 16.609 19.136 1.00 0.00 H new ATOM 0 HG21 ILE C 36 30.129 18.478 15.887 1.00 0.00 H new ATOM 0 HG22 ILE C 36 28.828 19.638 16.245 1.00 0.00 H new ATOM 0 HG23 ILE C 36 30.339 19.679 17.183 1.00 0.00 H new ATOM 0 HD11 ILE C 36 31.479 15.612 17.668 1.00 0.00 H new ATOM 0 HD12 ILE C 36 29.892 15.579 16.865 1.00 0.00 H new ATOM 0 HD13 ILE C 36 31.099 16.801 16.400 1.00 0.00 H new ATOM 554 N SER C 37 27.557 21.055 18.345 1.00 0.00 N ATOM 555 CA SER C 37 26.661 22.075 17.820 1.00 0.00 C ATOM 556 C SER C 37 27.461 23.172 17.132 1.00 0.00 C ATOM 557 O SER C 37 28.641 22.995 16.828 1.00 0.00 O ATOM 558 CB SER C 37 25.826 22.674 18.952 1.00 0.00 C ATOM 559 OG SER C 37 24.834 23.530 18.403 1.00 0.00 O ATOM 0 H SER C 37 28.385 21.420 18.816 1.00 0.00 H new ATOM 0 HA SER C 37 25.994 21.613 17.092 1.00 0.00 H new ATOM 0 HB2 SER C 37 25.356 21.880 19.532 1.00 0.00 H new ATOM 0 HB3 SER C 37 26.466 23.232 19.635 1.00 0.00 H new ATOM 0 HG SER C 37 24.416 23.094 17.632 1.00 0.00 H new ATOM 565 N THR C 38 26.817 24.302 16.884 1.00 0.00 N ATOM 566 CA THR C 38 27.485 25.411 16.229 1.00 0.00 C ATOM 567 C THR C 38 28.625 25.934 17.095 1.00 0.00 C ATOM 568 O THR C 38 29.619 26.446 16.582 1.00 0.00 O ATOM 569 CB THR C 38 26.477 26.530 15.973 1.00 0.00 C ATOM 570 OG1 THR C 38 25.899 26.933 17.208 1.00 0.00 O ATOM 571 CG2 THR C 38 25.382 26.030 15.029 1.00 0.00 C ATOM 0 H THR C 38 25.841 24.473 17.125 1.00 0.00 H new ATOM 0 HA THR C 38 27.899 25.065 15.282 1.00 0.00 H new ATOM 0 HB THR C 38 26.983 27.379 15.514 1.00 0.00 H new ATOM 0 HG1 THR C 38 25.253 27.652 17.048 1.00 0.00 H new ATOM 0 HG21 THR C 38 24.664 26.830 14.848 1.00 0.00 H new ATOM 0 HG22 THR C 38 25.829 25.723 14.084 1.00 0.00 H new ATOM 0 HG23 THR C 38 24.871 25.180 15.482 1.00 0.00 H new ATOM 579 N LYS C 39 28.479 25.805 18.410 1.00 0.00 N ATOM 580 CA LYS C 39 29.510 26.278 19.329 1.00 0.00 C ATOM 581 C LYS C 39 30.825 25.525 19.104 1.00 0.00 C ATOM 582 O LYS C 39 31.899 26.132 19.010 1.00 0.00 O ATOM 583 CB LYS C 39 29.043 26.047 20.774 1.00 0.00 C ATOM 584 CG LYS C 39 27.853 26.957 21.103 1.00 0.00 C ATOM 585 CD LYS C 39 28.341 28.342 21.544 1.00 0.00 C ATOM 586 CE LYS C 39 27.135 29.197 21.939 1.00 0.00 C ATOM 587 NZ LYS C 39 27.599 30.542 22.381 1.00 0.00 N1+ ATOM 0 H LYS C 39 27.667 25.382 18.860 1.00 0.00 H new ATOM 0 HA LYS C 39 29.677 27.340 19.148 1.00 0.00 H new ATOM 0 HB2 LYS C 39 28.759 25.003 20.909 1.00 0.00 H new ATOM 0 HB3 LYS C 39 29.863 26.246 21.464 1.00 0.00 H new ATOM 0 HG2 LYS C 39 27.209 27.053 20.229 1.00 0.00 H new ATOM 0 HG3 LYS C 39 27.252 26.508 21.894 1.00 0.00 H new ATOM 0 HD2 LYS C 39 29.027 28.248 22.386 1.00 0.00 H new ATOM 0 HD3 LYS C 39 28.893 28.821 20.735 1.00 0.00 H new ATOM 0 HE2 LYS C 39 26.454 29.296 21.094 1.00 0.00 H new ATOM 0 HE3 LYS C 39 26.579 28.711 22.741 1.00 0.00 H new ATOM 0 HZ1 LYS C 39 26.778 31.122 22.649 1.00 0.00 H new ATOM 0 HZ2 LYS C 39 28.232 30.439 23.200 1.00 0.00 H new ATOM 0 HZ3 LYS C 39 28.111 31.005 21.603 1.00 0.00 H new ATOM 601 N GLU C 40 30.735 24.199 19.013 1.00 0.00 N ATOM 602 CA GLU C 40 31.920 23.380 18.799 1.00 0.00 C ATOM 603 C GLU C 40 32.479 23.615 17.405 1.00 0.00 C ATOM 604 O GLU C 40 33.693 23.700 17.209 1.00 0.00 O ATOM 605 CB GLU C 40 31.558 21.899 18.968 1.00 0.00 C ATOM 606 CG GLU C 40 31.180 21.610 20.426 1.00 0.00 C ATOM 607 CD GLU C 40 32.349 21.910 21.354 1.00 0.00 C ATOM 608 OE1 GLU C 40 33.403 21.331 21.152 1.00 0.00 O ATOM 609 OE2 GLU C 40 32.179 22.730 22.239 1.00 0.00 O1- ATOM 0 H GLU C 40 29.862 23.676 19.084 1.00 0.00 H new ATOM 0 HA GLU C 40 32.678 23.656 19.532 1.00 0.00 H new ATOM 0 HB2 GLU C 40 30.726 21.643 18.311 1.00 0.00 H new ATOM 0 HB3 GLU C 40 32.401 21.275 18.673 1.00 0.00 H new ATOM 0 HG2 GLU C 40 30.319 22.215 20.710 1.00 0.00 H new ATOM 0 HG3 GLU C 40 30.885 20.566 20.530 1.00 0.00 H new ATOM 616 N LEU C 41 31.581 23.730 16.440 1.00 0.00 N ATOM 617 CA LEU C 41 31.983 23.965 15.064 1.00 0.00 C ATOM 618 C LEU C 41 32.593 25.353 14.929 1.00 0.00 C ATOM 619 O LEU C 41 33.527 25.561 14.155 1.00 0.00 O ATOM 620 CB LEU C 41 30.771 23.825 14.134 1.00 0.00 C ATOM 621 CG LEU C 41 30.922 22.583 13.247 1.00 0.00 C ATOM 622 CD1 LEU C 41 30.824 21.322 14.106 1.00 0.00 C ATOM 623 CD2 LEU C 41 29.804 22.571 12.198 1.00 0.00 C ATOM 0 H LEU C 41 30.573 23.665 16.584 1.00 0.00 H new ATOM 0 HA LEU C 41 32.731 23.225 14.781 1.00 0.00 H new ATOM 0 HB2 LEU C 41 29.858 23.750 14.724 1.00 0.00 H new ATOM 0 HB3 LEU C 41 30.676 24.715 13.512 1.00 0.00 H new ATOM 0 HG LEU C 41 31.892 22.608 12.751 1.00 0.00 H new ATOM 0 HD11 LEU C 41 30.932 20.441 13.473 1.00 0.00 H new ATOM 0 HD12 LEU C 41 31.616 21.330 14.855 1.00 0.00 H new ATOM 0 HD13 LEU C 41 29.854 21.295 14.603 1.00 0.00 H new ATOM 0 HD21 LEU C 41 29.908 21.689 11.565 1.00 0.00 H new ATOM 0 HD22 LEU C 41 28.836 22.546 12.698 1.00 0.00 H new ATOM 0 HD23 LEU C 41 29.872 23.469 11.583 1.00 0.00 H new ATOM 635 N GLY C 42 32.062 26.297 15.697 1.00 0.00 N ATOM 636 CA GLY C 42 32.562 27.662 15.666 1.00 0.00 C ATOM 637 C GLY C 42 34.026 27.722 16.091 1.00 0.00 C ATOM 638 O GLY C 42 34.822 28.441 15.487 1.00 0.00 O ATOM 0 H GLY C 42 31.290 26.142 16.345 1.00 0.00 H new ATOM 0 HA2 GLY C 42 32.455 28.069 14.660 1.00 0.00 H new ATOM 0 HA3 GLY C 42 31.962 28.287 16.328 1.00 0.00 H new ATOM 642 N LYS C 43 34.386 26.956 17.124 1.00 0.00 N ATOM 643 CA LYS C 43 35.770 26.946 17.591 1.00 0.00 C ATOM 644 C LYS C 43 36.681 26.341 16.533 1.00 0.00 C ATOM 645 O LYS C 43 37.786 26.827 16.287 1.00 0.00 O ATOM 646 CB LYS C 43 35.886 26.145 18.890 1.00 0.00 C ATOM 647 CG LYS C 43 35.243 26.922 20.046 1.00 0.00 C ATOM 648 CD LYS C 43 36.250 27.918 20.638 1.00 0.00 C ATOM 649 CE LYS C 43 35.648 28.567 21.884 1.00 0.00 C ATOM 650 NZ LYS C 43 35.513 27.544 22.957 1.00 0.00 N1+ ATOM 0 H LYS C 43 33.752 26.348 17.642 1.00 0.00 H new ATOM 0 HA LYS C 43 36.077 27.975 17.778 1.00 0.00 H new ATOM 0 HB2 LYS C 43 35.397 25.178 18.775 1.00 0.00 H new ATOM 0 HB3 LYS C 43 36.935 25.948 19.113 1.00 0.00 H new ATOM 0 HG2 LYS C 43 34.360 27.454 19.690 1.00 0.00 H new ATOM 0 HG3 LYS C 43 34.908 26.229 20.818 1.00 0.00 H new ATOM 0 HD2 LYS C 43 37.178 27.406 20.893 1.00 0.00 H new ATOM 0 HD3 LYS C 43 36.500 28.681 19.901 1.00 0.00 H new ATOM 0 HE2 LYS C 43 36.283 29.385 22.224 1.00 0.00 H new ATOM 0 HE3 LYS C 43 34.673 28.995 21.650 1.00 0.00 H new ATOM 0 HZ1 LYS C 43 35.468 28.016 23.883 1.00 0.00 H new ATOM 0 HZ2 LYS C 43 34.643 26.995 22.806 1.00 0.00 H new ATOM 0 HZ3 LYS C 43 36.334 26.906 22.933 1.00 0.00 H new ATOM 664 N VAL C 44 36.200 25.279 15.909 1.00 0.00 N ATOM 665 CA VAL C 44 36.961 24.600 14.873 1.00 0.00 C ATOM 666 C VAL C 44 37.220 25.528 13.701 1.00 0.00 C ATOM 667 O VAL C 44 38.330 25.589 13.174 1.00 0.00 O ATOM 668 CB VAL C 44 36.172 23.403 14.377 1.00 0.00 C ATOM 669 CG1 VAL C 44 36.853 22.823 13.134 1.00 0.00 C ATOM 670 CG2 VAL C 44 36.112 22.338 15.475 1.00 0.00 C ATOM 0 H VAL C 44 35.286 24.868 16.101 1.00 0.00 H new ATOM 0 HA VAL C 44 37.915 24.284 15.296 1.00 0.00 H new ATOM 0 HB VAL C 44 35.159 23.715 14.123 1.00 0.00 H new ATOM 0 HG11 VAL C 44 36.287 21.963 12.777 1.00 0.00 H new ATOM 0 HG12 VAL C 44 36.891 23.582 12.353 1.00 0.00 H new ATOM 0 HG13 VAL C 44 37.866 22.511 13.387 1.00 0.00 H new ATOM 0 HG21 VAL C 44 35.545 21.478 15.118 1.00 0.00 H new ATOM 0 HG22 VAL C 44 37.123 22.024 15.733 1.00 0.00 H new ATOM 0 HG23 VAL C 44 35.625 22.752 16.358 1.00 0.00 H new ATOM 680 N MET C 45 36.179 26.237 13.287 1.00 0.00 N ATOM 681 CA MET C 45 36.298 27.147 12.162 1.00 0.00 C ATOM 682 C MET C 45 37.316 28.243 12.459 1.00 0.00 C ATOM 683 O MET C 45 38.095 28.634 11.590 1.00 0.00 O ATOM 684 CB MET C 45 34.945 27.792 11.856 1.00 0.00 C ATOM 685 CG MET C 45 34.005 26.771 11.213 1.00 0.00 C ATOM 686 SD MET C 45 34.590 26.390 9.542 1.00 0.00 S ATOM 687 CE MET C 45 33.173 25.389 9.026 1.00 0.00 C ATOM 0 H MET C 45 35.252 26.199 13.710 1.00 0.00 H new ATOM 0 HA MET C 45 36.633 26.571 11.299 1.00 0.00 H new ATOM 0 HB2 MET C 45 34.502 28.177 12.774 1.00 0.00 H new ATOM 0 HB3 MET C 45 35.082 28.642 11.188 1.00 0.00 H new ATOM 0 HG2 MET C 45 33.970 25.863 11.814 1.00 0.00 H new ATOM 0 HG3 MET C 45 32.990 27.167 11.174 1.00 0.00 H new ATOM 0 HE1 MET C 45 33.325 25.042 8.004 1.00 0.00 H new ATOM 0 HE2 MET C 45 33.073 24.530 9.690 1.00 0.00 H new ATOM 0 HE3 MET C 45 32.266 25.991 9.073 1.00 0.00 H new ATOM 697 N ARG C 46 37.291 28.743 13.690 1.00 0.00 N ATOM 698 CA ARG C 46 38.204 29.803 14.092 1.00 0.00 C ATOM 699 C ARG C 46 39.652 29.320 14.017 1.00 0.00 C ATOM 700 O ARG C 46 40.537 30.048 13.571 1.00 0.00 O ATOM 701 CB ARG C 46 37.871 30.257 15.517 1.00 0.00 C ATOM 702 CG ARG C 46 38.581 31.575 15.824 1.00 0.00 C ATOM 703 CD ARG C 46 38.241 32.017 17.250 1.00 0.00 C ATOM 704 NE ARG C 46 38.725 33.372 17.489 1.00 0.00 N ATOM 705 CZ ARG C 46 38.549 33.970 18.666 1.00 0.00 C ATOM 706 NH1 ARG C 46 37.990 33.322 19.652 1.00 0.00 N ATOM 707 NH2 ARG C 46 38.946 35.201 18.838 1.00 0.00 N1+ ATOM 0 H ARG C 46 36.652 28.432 14.422 1.00 0.00 H new ATOM 0 HA ARG C 46 38.088 30.646 13.411 1.00 0.00 H new ATOM 0 HB2 ARG C 46 36.794 30.381 15.626 1.00 0.00 H new ATOM 0 HB3 ARG C 46 38.178 29.494 16.232 1.00 0.00 H new ATOM 0 HG2 ARG C 46 39.659 31.454 15.717 1.00 0.00 H new ATOM 0 HG3 ARG C 46 38.274 32.341 15.111 1.00 0.00 H new ATOM 0 HD2 ARG C 46 37.163 31.976 17.403 1.00 0.00 H new ATOM 0 HD3 ARG C 46 38.691 31.331 17.968 1.00 0.00 H new ATOM 0 HE ARG C 46 39.207 33.871 16.741 1.00 0.00 H new ATOM 0 HH11 ARG C 46 37.688 32.357 19.521 1.00 0.00 H new ATOM 0 HH12 ARG C 46 37.856 33.781 20.553 1.00 0.00 H new ATOM 0 HH21 ARG C 46 39.391 35.705 18.071 1.00 0.00 H new ATOM 0 HH22 ARG C 46 38.811 35.659 19.739 1.00 0.00 H new ATOM 721 N MET C 47 39.883 28.083 14.449 1.00 0.00 N ATOM 722 CA MET C 47 41.224 27.506 14.423 1.00 0.00 C ATOM 723 C MET C 47 41.731 27.416 12.990 1.00 0.00 C ATOM 724 O MET C 47 42.910 27.642 12.716 1.00 0.00 O ATOM 725 CB MET C 47 41.221 26.117 15.063 1.00 0.00 C ATOM 726 CG MET C 47 42.661 25.605 15.162 1.00 0.00 C ATOM 727 SD MET C 47 42.699 24.023 16.049 1.00 0.00 S ATOM 728 CE MET C 47 42.135 22.958 14.698 1.00 0.00 C ATOM 0 H MET C 47 39.163 27.463 14.820 1.00 0.00 H new ATOM 0 HA MET C 47 41.889 28.154 14.994 1.00 0.00 H new ATOM 0 HB2 MET C 47 40.769 26.161 16.054 1.00 0.00 H new ATOM 0 HB3 MET C 47 40.618 25.431 14.468 1.00 0.00 H new ATOM 0 HG2 MET C 47 43.081 25.482 14.164 1.00 0.00 H new ATOM 0 HG3 MET C 47 43.281 26.337 15.680 1.00 0.00 H new ATOM 0 HE1 MET C 47 41.262 22.391 15.022 1.00 0.00 H new ATOM 0 HE2 MET C 47 41.870 23.572 13.837 1.00 0.00 H new ATOM 0 HE3 MET C 47 42.933 22.269 14.420 1.00 0.00 H new ATOM 738 N LEU C 48 40.825 27.083 12.087 1.00 0.00 N ATOM 739 CA LEU C 48 41.163 26.957 10.675 1.00 0.00 C ATOM 740 C LEU C 48 41.589 28.308 10.104 1.00 0.00 C ATOM 741 O LEU C 48 42.213 28.372 9.046 1.00 0.00 O ATOM 742 CB LEU C 48 39.960 26.426 9.890 1.00 0.00 C ATOM 743 CG LEU C 48 39.698 24.961 10.263 1.00 0.00 C ATOM 744 CD1 LEU C 48 38.378 24.506 9.641 1.00 0.00 C ATOM 745 CD2 LEU C 48 40.836 24.065 9.748 1.00 0.00 C ATOM 0 H LEU C 48 39.847 26.894 12.305 1.00 0.00 H new ATOM 0 HA LEU C 48 41.992 26.256 10.582 1.00 0.00 H new ATOM 0 HB2 LEU C 48 39.078 27.029 10.107 1.00 0.00 H new ATOM 0 HB3 LEU C 48 40.148 26.510 8.820 1.00 0.00 H new ATOM 0 HG LEU C 48 39.646 24.879 11.349 1.00 0.00 H new ATOM 0 HD11 LEU C 48 38.191 23.465 9.905 1.00 0.00 H new ATOM 0 HD12 LEU C 48 37.565 25.128 10.017 1.00 0.00 H new ATOM 0 HD13 LEU C 48 38.435 24.600 8.557 1.00 0.00 H new ATOM 0 HD21 LEU C 48 40.635 23.029 10.021 1.00 0.00 H new ATOM 0 HD22 LEU C 48 40.902 24.148 8.663 1.00 0.00 H new ATOM 0 HD23 LEU C 48 41.779 24.381 10.194 1.00 0.00 H new ATOM 757 N GLY C 49 41.247 29.384 10.811 1.00 0.00 N ATOM 758 CA GLY C 49 41.602 30.726 10.359 1.00 0.00 C ATOM 759 C GLY C 49 40.475 31.347 9.542 1.00 0.00 C ATOM 760 O GLY C 49 40.675 32.344 8.848 1.00 0.00 O ATOM 0 H GLY C 49 40.730 29.353 11.690 1.00 0.00 H new ATOM 0 HA2 GLY C 49 41.821 31.357 11.220 1.00 0.00 H new ATOM 0 HA3 GLY C 49 42.510 30.682 9.757 1.00 0.00 H new ATOM 764 N GLN C 50 39.292 30.747 9.626 1.00 0.00 N ATOM 765 CA GLN C 50 38.141 31.244 8.890 1.00 0.00 C ATOM 766 C GLN C 50 37.180 31.953 9.835 1.00 0.00 C ATOM 767 O GLN C 50 37.031 31.561 10.992 1.00 0.00 O ATOM 768 CB GLN C 50 37.418 30.078 8.213 1.00 0.00 C ATOM 769 CG GLN C 50 38.412 29.266 7.377 1.00 0.00 C ATOM 770 CD GLN C 50 39.100 30.162 6.352 1.00 0.00 C ATOM 771 OE1 GLN C 50 40.321 30.318 6.385 1.00 0.00 O ATOM 772 NE2 GLN C 50 38.388 30.761 5.438 1.00 0.00 N ATOM 0 H GLN C 50 39.108 29.920 10.194 1.00 0.00 H new ATOM 0 HA GLN C 50 38.486 31.949 8.134 1.00 0.00 H new ATOM 0 HB2 GLN C 50 36.955 29.440 8.965 1.00 0.00 H new ATOM 0 HB3 GLN C 50 36.617 30.455 7.577 1.00 0.00 H new ATOM 0 HG2 GLN C 50 39.157 28.809 8.028 1.00 0.00 H new ATOM 0 HG3 GLN C 50 37.892 28.454 6.869 1.00 0.00 H new ATOM 0 HE21 GLN C 50 37.377 30.630 5.412 1.00 0.00 H new ATOM 0 HE22 GLN C 50 38.842 31.360 4.749 1.00 0.00 H new ATOM 781 N ASN C 51 36.527 32.992 9.331 1.00 0.00 N ATOM 782 CA ASN C 51 35.575 33.747 10.137 1.00 0.00 C ATOM 783 C ASN C 51 34.301 34.016 9.347 1.00 0.00 C ATOM 784 O ASN C 51 33.984 35.162 9.027 1.00 0.00 O ATOM 785 CB ASN C 51 36.194 35.077 10.574 1.00 0.00 C ATOM 786 CG ASN C 51 35.319 35.732 11.637 1.00 0.00 C ATOM 787 OD1 ASN C 51 34.881 35.069 12.578 1.00 0.00 O ATOM 788 ND2 ASN C 51 35.032 37.002 11.541 1.00 0.00 N ATOM 0 H ASN C 51 36.637 33.330 8.375 1.00 0.00 H new ATOM 0 HA ASN C 51 35.327 33.155 11.018 1.00 0.00 H new ATOM 0 HB2 ASN C 51 37.196 34.910 10.968 1.00 0.00 H new ATOM 0 HB3 ASN C 51 36.296 35.740 9.715 1.00 0.00 H new ATOM 0 HD21 ASN C 51 34.444 37.447 12.246 1.00 0.00 H new ATOM 0 HD22 ASN C 51 35.396 37.549 10.761 1.00 0.00 H new ATOM 795 N PRO C 52 33.569 32.980 9.043 1.00 0.00 N ATOM 796 CA PRO C 52 32.290 33.079 8.287 1.00 0.00 C ATOM 797 C PRO C 52 31.141 33.565 9.170 1.00 0.00 C ATOM 798 O PRO C 52 31.353 33.982 10.310 1.00 0.00 O ATOM 799 CB PRO C 52 32.058 31.651 7.806 1.00 0.00 C ATOM 800 CG PRO C 52 32.697 30.797 8.843 1.00 0.00 C ATOM 801 CD PRO C 52 33.884 31.582 9.386 1.00 0.00 C ATOM 0 HA PRO C 52 32.338 33.803 7.474 1.00 0.00 H new ATOM 0 HB2 PRO C 52 30.994 31.432 7.713 1.00 0.00 H new ATOM 0 HB3 PRO C 52 32.505 31.485 6.826 1.00 0.00 H new ATOM 0 HG2 PRO C 52 31.991 30.562 9.640 1.00 0.00 H new ATOM 0 HG3 PRO C 52 33.023 29.848 8.416 1.00 0.00 H new ATOM 0 HD2 PRO C 52 33.992 31.449 10.462 1.00 0.00 H new ATOM 0 HD3 PRO C 52 34.820 31.259 8.929 1.00 0.00 H new ATOM 809 N THR C 53 29.930 33.519 8.631 1.00 0.00 N ATOM 810 CA THR C 53 28.753 33.966 9.371 1.00 0.00 C ATOM 811 C THR C 53 28.086 32.795 10.106 1.00 0.00 C ATOM 812 O THR C 53 28.207 31.644 9.682 1.00 0.00 O ATOM 813 CB THR C 53 27.754 34.612 8.406 1.00 0.00 C ATOM 814 OG1 THR C 53 27.861 33.987 7.135 1.00 0.00 O ATOM 815 CG2 THR C 53 28.048 36.110 8.282 1.00 0.00 C ATOM 0 H THR C 53 29.735 33.179 7.689 1.00 0.00 H new ATOM 0 HA THR C 53 29.070 34.697 10.114 1.00 0.00 H new ATOM 0 HB THR C 53 26.741 34.484 8.787 1.00 0.00 H new ATOM 0 HG1 THR C 53 27.222 34.396 6.514 1.00 0.00 H new ATOM 0 HG21 THR C 53 27.335 36.565 7.595 1.00 0.00 H new ATOM 0 HG22 THR C 53 27.959 36.581 9.261 1.00 0.00 H new ATOM 0 HG23 THR C 53 29.060 36.252 7.902 1.00 0.00 H new ATOM 823 N PRO C 54 27.386 33.064 11.190 1.00 0.00 N ATOM 824 CA PRO C 54 26.693 32.003 11.993 1.00 0.00 C ATOM 825 C PRO C 54 25.650 31.236 11.186 1.00 0.00 C ATOM 826 O PRO C 54 25.379 30.065 11.451 1.00 0.00 O ATOM 827 CB PRO C 54 26.013 32.780 13.126 1.00 0.00 C ATOM 828 CG PRO C 54 25.967 34.200 12.676 1.00 0.00 C ATOM 829 CD PRO C 54 27.175 34.400 11.773 1.00 0.00 C ATOM 0 HA PRO C 54 27.399 31.248 12.338 1.00 0.00 H new ATOM 0 HB2 PRO C 54 25.010 32.397 13.315 1.00 0.00 H new ATOM 0 HB3 PRO C 54 26.572 32.683 14.057 1.00 0.00 H new ATOM 0 HG2 PRO C 54 25.041 34.408 12.139 1.00 0.00 H new ATOM 0 HG3 PRO C 54 26.001 34.879 13.528 1.00 0.00 H new ATOM 0 HD2 PRO C 54 26.983 35.149 11.004 1.00 0.00 H new ATOM 0 HD3 PRO C 54 28.046 34.736 12.335 1.00 0.00 H new ATOM 837 N GLU C 55 25.073 31.901 10.202 1.00 0.00 N ATOM 838 CA GLU C 55 24.071 31.287 9.361 1.00 0.00 C ATOM 839 C GLU C 55 24.663 30.099 8.611 1.00 0.00 C ATOM 840 O GLU C 55 24.001 29.088 8.407 1.00 0.00 O ATOM 841 CB GLU C 55 23.540 32.340 8.380 1.00 0.00 C ATOM 842 CG GLU C 55 23.068 31.662 7.104 1.00 0.00 C ATOM 843 CD GLU C 55 22.198 32.615 6.292 1.00 0.00 C ATOM 844 OE1 GLU C 55 22.755 33.461 5.613 1.00 0.00 O ATOM 845 OE2 GLU C 55 20.987 32.483 6.359 1.00 0.00 O1- ATOM 0 H GLU C 55 25.285 32.871 9.968 1.00 0.00 H new ATOM 0 HA GLU C 55 23.250 30.916 9.974 1.00 0.00 H new ATOM 0 HB2 GLU C 55 22.718 32.892 8.835 1.00 0.00 H new ATOM 0 HB3 GLU C 55 24.322 33.064 8.150 1.00 0.00 H new ATOM 0 HG2 GLU C 55 23.927 31.348 6.511 1.00 0.00 H new ATOM 0 HG3 GLU C 55 22.504 30.762 7.349 1.00 0.00 H new ATOM 852 N GLU C 56 25.913 30.238 8.199 1.00 0.00 N ATOM 853 CA GLU C 56 26.592 29.184 7.457 1.00 0.00 C ATOM 854 C GLU C 56 26.791 27.969 8.339 1.00 0.00 C ATOM 855 O GLU C 56 26.631 26.831 7.899 1.00 0.00 O ATOM 856 CB GLU C 56 27.952 29.687 6.982 1.00 0.00 C ATOM 857 CG GLU C 56 27.746 30.899 6.081 1.00 0.00 C ATOM 858 CD GLU C 56 27.008 30.494 4.809 1.00 0.00 C ATOM 859 OE1 GLU C 56 27.024 29.317 4.488 1.00 0.00 O ATOM 860 OE2 GLU C 56 26.435 31.367 4.177 1.00 0.00 O1- ATOM 0 H GLU C 56 26.479 31.070 8.365 1.00 0.00 H new ATOM 0 HA GLU C 56 25.980 28.908 6.599 1.00 0.00 H new ATOM 0 HB2 GLU C 56 28.574 29.954 7.836 1.00 0.00 H new ATOM 0 HB3 GLU C 56 28.476 28.900 6.440 1.00 0.00 H new ATOM 0 HG2 GLU C 56 27.178 31.663 6.612 1.00 0.00 H new ATOM 0 HG3 GLU C 56 28.710 31.339 5.826 1.00 0.00 H new ATOM 867 N LEU C 57 27.138 28.224 9.591 1.00 0.00 N ATOM 868 CA LEU C 57 27.353 27.137 10.533 1.00 0.00 C ATOM 869 C LEU C 57 26.083 26.329 10.696 1.00 0.00 C ATOM 870 O LEU C 57 26.119 25.097 10.745 1.00 0.00 O ATOM 871 CB LEU C 57 27.777 27.676 11.902 1.00 0.00 C ATOM 872 CG LEU C 57 29.277 27.979 11.916 1.00 0.00 C ATOM 873 CD1 LEU C 57 29.586 29.116 10.947 1.00 0.00 C ATOM 874 CD2 LEU C 57 29.687 28.389 13.332 1.00 0.00 C ATOM 0 H LEU C 57 27.275 29.159 9.974 1.00 0.00 H new ATOM 0 HA LEU C 57 28.147 26.504 10.137 1.00 0.00 H new ATOM 0 HB2 LEU C 57 27.215 28.581 12.134 1.00 0.00 H new ATOM 0 HB3 LEU C 57 27.540 26.946 12.676 1.00 0.00 H new ATOM 0 HG LEU C 57 29.832 27.092 11.610 1.00 0.00 H new ATOM 0 HD11 LEU C 57 30.655 29.326 10.962 1.00 0.00 H new ATOM 0 HD12 LEU C 57 29.287 28.827 9.939 1.00 0.00 H new ATOM 0 HD13 LEU C 57 29.036 30.008 11.246 1.00 0.00 H new ATOM 0 HD21 LEU C 57 30.755 28.607 13.353 1.00 0.00 H new ATOM 0 HD22 LEU C 57 29.129 29.277 13.630 1.00 0.00 H new ATOM 0 HD23 LEU C 57 29.469 27.575 14.024 1.00 0.00 H new ATOM 886 N GLN C 58 24.958 27.026 10.779 1.00 0.00 N ATOM 887 CA GLN C 58 23.683 26.338 10.940 1.00 0.00 C ATOM 888 C GLN C 58 23.351 25.543 9.680 1.00 0.00 C ATOM 889 O GLN C 58 22.858 24.420 9.755 1.00 0.00 O ATOM 890 CB GLN C 58 22.549 27.327 11.220 1.00 0.00 C ATOM 891 CG GLN C 58 21.299 26.541 11.638 1.00 0.00 C ATOM 892 CD GLN C 58 20.086 27.459 11.714 1.00 0.00 C ATOM 893 OE1 GLN C 58 20.168 28.635 11.358 1.00 0.00 O ATOM 894 NE2 GLN C 58 18.954 26.984 12.161 1.00 0.00 N ATOM 0 H GLN C 58 24.900 28.044 10.739 1.00 0.00 H new ATOM 0 HA GLN C 58 23.778 25.663 11.791 1.00 0.00 H new ATOM 0 HB2 GLN C 58 22.840 28.021 12.009 1.00 0.00 H new ATOM 0 HB3 GLN C 58 22.340 27.923 10.332 1.00 0.00 H new ATOM 0 HG2 GLN C 58 21.111 25.740 10.923 1.00 0.00 H new ATOM 0 HG3 GLN C 58 21.466 26.070 12.607 1.00 0.00 H new ATOM 0 HE21 GLN C 58 18.890 26.009 12.455 1.00 0.00 H new ATOM 0 HE22 GLN C 58 18.134 27.588 12.216 1.00 0.00 H new ATOM 903 N GLU C 59 23.617 26.141 8.522 1.00 0.00 N ATOM 904 CA GLU C 59 23.331 25.483 7.251 1.00 0.00 C ATOM 905 C GLU C 59 24.136 24.199 7.107 1.00 0.00 C ATOM 906 O GLU C 59 23.629 23.191 6.616 1.00 0.00 O ATOM 907 CB GLU C 59 23.654 26.426 6.089 1.00 0.00 C ATOM 908 CG GLU C 59 22.613 27.545 6.032 1.00 0.00 C ATOM 909 CD GLU C 59 23.055 28.621 5.048 1.00 0.00 C ATOM 910 OE1 GLU C 59 24.222 28.625 4.689 1.00 0.00 O ATOM 911 OE2 GLU C 59 22.223 29.427 4.667 1.00 0.00 O1- ATOM 0 H GLU C 59 24.026 27.071 8.437 1.00 0.00 H new ATOM 0 HA GLU C 59 22.271 25.230 7.231 1.00 0.00 H new ATOM 0 HB2 GLU C 59 24.651 26.849 6.217 1.00 0.00 H new ATOM 0 HB3 GLU C 59 23.660 25.873 5.150 1.00 0.00 H new ATOM 0 HG2 GLU C 59 21.648 27.139 5.730 1.00 0.00 H new ATOM 0 HG3 GLU C 59 22.480 27.980 7.023 1.00 0.00 H new ATOM 918 N MET C 60 25.391 24.236 7.537 1.00 0.00 N ATOM 919 CA MET C 60 26.240 23.068 7.444 1.00 0.00 C ATOM 920 C MET C 60 25.638 21.931 8.262 1.00 0.00 C ATOM 921 O MET C 60 25.542 20.795 7.793 1.00 0.00 O ATOM 922 CB MET C 60 27.631 23.425 7.969 1.00 0.00 C ATOM 923 CG MET C 60 28.593 22.273 7.706 1.00 0.00 C ATOM 924 SD MET C 60 28.883 22.125 5.925 1.00 0.00 S ATOM 925 CE MET C 60 29.974 20.683 5.988 1.00 0.00 C ATOM 0 H MET C 60 25.835 25.057 7.949 1.00 0.00 H new ATOM 0 HA MET C 60 26.319 22.744 6.406 1.00 0.00 H new ATOM 0 HB2 MET C 60 27.992 24.331 7.482 1.00 0.00 H new ATOM 0 HB3 MET C 60 27.584 23.635 9.038 1.00 0.00 H new ATOM 0 HG2 MET C 60 29.535 22.446 8.226 1.00 0.00 H new ATOM 0 HG3 MET C 60 28.180 21.343 8.097 1.00 0.00 H new ATOM 0 HE1 MET C 60 30.280 20.414 4.977 1.00 0.00 H new ATOM 0 HE2 MET C 60 30.856 20.920 6.583 1.00 0.00 H new ATOM 0 HE3 MET C 60 29.444 19.846 6.442 1.00 0.00 H new ATOM 935 N ILE C 61 25.218 22.252 9.480 1.00 0.00 N ATOM 936 CA ILE C 61 24.609 21.260 10.358 1.00 0.00 C ATOM 937 C ILE C 61 23.249 20.827 9.820 1.00 0.00 C ATOM 938 O ILE C 61 22.893 19.657 9.891 1.00 0.00 O ATOM 939 CB ILE C 61 24.450 21.808 11.771 1.00 0.00 C ATOM 940 CG1 ILE C 61 25.840 22.037 12.369 1.00 0.00 C ATOM 941 CG2 ILE C 61 23.684 20.782 12.616 1.00 0.00 C ATOM 942 CD1 ILE C 61 25.708 22.775 13.695 1.00 0.00 C ATOM 0 H ILE C 61 25.287 23.187 9.881 1.00 0.00 H new ATOM 0 HA ILE C 61 25.271 20.395 10.390 1.00 0.00 H new ATOM 0 HB ILE C 61 23.900 22.749 11.756 1.00 0.00 H new ATOM 0 HG12 ILE C 61 26.344 21.082 12.521 1.00 0.00 H new ATOM 0 HG13 ILE C 61 26.454 22.615 11.678 1.00 0.00 H new ATOM 0 HG21 ILE C 61 23.564 21.163 13.630 1.00 0.00 H new ATOM 0 HG22 ILE C 61 22.703 20.608 12.175 1.00 0.00 H new ATOM 0 HG23 ILE C 61 24.241 19.845 12.644 1.00 0.00 H new ATOM 0 HD11 ILE C 61 26.698 22.938 14.121 1.00 0.00 H new ATOM 0 HD12 ILE C 61 25.221 23.736 13.530 1.00 0.00 H new ATOM 0 HD13 ILE C 61 25.110 22.180 14.385 1.00 0.00 H new ATOM 954 N ASP C 62 22.494 21.791 9.297 1.00 0.00 N ATOM 955 CA ASP C 62 21.159 21.525 8.760 1.00 0.00 C ATOM 956 C ASP C 62 21.205 20.442 7.688 1.00 0.00 C ATOM 957 O ASP C 62 20.287 19.629 7.577 1.00 0.00 O ATOM 958 CB ASP C 62 20.574 22.805 8.165 1.00 0.00 C ATOM 959 CG ASP C 62 19.138 22.563 7.714 1.00 0.00 C ATOM 960 OD1 ASP C 62 18.733 21.412 7.686 1.00 0.00 O ATOM 961 OD2 ASP C 62 18.463 23.531 7.405 1.00 0.00 O1- ATOM 0 H ASP C 62 22.784 22.767 9.233 1.00 0.00 H new ATOM 0 HA ASP C 62 20.528 21.177 9.578 1.00 0.00 H new ATOM 0 HB2 ASP C 62 20.601 23.605 8.905 1.00 0.00 H new ATOM 0 HB3 ASP C 62 21.179 23.132 7.319 1.00 0.00 H new ATOM 966 N GLU C 63 22.272 20.434 6.902 1.00 0.00 N ATOM 967 CA GLU C 63 22.413 19.439 5.848 1.00 0.00 C ATOM 968 C GLU C 63 22.341 18.034 6.439 1.00 0.00 C ATOM 969 O GLU C 63 21.896 17.096 5.776 1.00 0.00 O ATOM 970 CB GLU C 63 23.751 19.638 5.127 1.00 0.00 C ATOM 971 CG GLU C 63 23.647 20.835 4.178 1.00 0.00 C ATOM 972 CD GLU C 63 22.754 20.483 2.992 1.00 0.00 C ATOM 973 OE1 GLU C 63 23.153 19.638 2.208 1.00 0.00 O ATOM 974 OE2 GLU C 63 21.682 21.056 2.890 1.00 0.00 O1- ATOM 0 H GLU C 63 23.044 21.097 6.972 1.00 0.00 H new ATOM 0 HA GLU C 63 21.599 19.559 5.133 1.00 0.00 H new ATOM 0 HB2 GLU C 63 24.546 19.804 5.853 1.00 0.00 H new ATOM 0 HB3 GLU C 63 24.012 18.739 4.568 1.00 0.00 H new ATOM 0 HG2 GLU C 63 23.239 21.696 4.708 1.00 0.00 H new ATOM 0 HG3 GLU C 63 24.639 21.118 3.826 1.00 0.00 H new ATOM 981 N VAL C 64 22.777 17.898 7.689 1.00 0.00 N ATOM 982 CA VAL C 64 22.754 16.605 8.364 1.00 0.00 C ATOM 983 C VAL C 64 21.646 16.561 9.421 1.00 0.00 C ATOM 984 O VAL C 64 21.083 15.503 9.700 1.00 0.00 O ATOM 985 CB VAL C 64 24.110 16.348 9.023 1.00 0.00 C ATOM 986 CG1 VAL C 64 24.180 14.899 9.507 1.00 0.00 C ATOM 987 CG2 VAL C 64 25.222 16.602 8.002 1.00 0.00 C ATOM 0 H VAL C 64 23.148 18.663 8.252 1.00 0.00 H new ATOM 0 HA VAL C 64 22.553 15.830 7.624 1.00 0.00 H new ATOM 0 HB VAL C 64 24.235 17.017 9.875 1.00 0.00 H new ATOM 0 HG11 VAL C 64 25.147 14.718 9.976 1.00 0.00 H new ATOM 0 HG12 VAL C 64 23.386 14.719 10.232 1.00 0.00 H new ATOM 0 HG13 VAL C 64 24.057 14.226 8.659 1.00 0.00 H new ATOM 0 HG21 VAL C 64 26.191 16.420 8.467 1.00 0.00 H new ATOM 0 HG22 VAL C 64 25.096 15.931 7.152 1.00 0.00 H new ATOM 0 HG23 VAL C 64 25.172 17.636 7.659 1.00 0.00 H new ATOM 997 N ASP C 65 21.345 17.716 10.014 1.00 0.00 N ATOM 998 CA ASP C 65 20.313 17.795 11.045 1.00 0.00 C ATOM 999 C ASP C 65 18.924 17.872 10.425 1.00 0.00 C ATOM 1000 O ASP C 65 18.414 18.956 10.140 1.00 0.00 O ATOM 1001 CB ASP C 65 20.528 19.033 11.921 1.00 0.00 C ATOM 1002 CG ASP C 65 21.385 18.704 13.141 1.00 0.00 C ATOM 1003 OD1 ASP C 65 21.988 17.642 13.160 1.00 0.00 O ATOM 1004 OD2 ASP C 65 21.416 19.521 14.045 1.00 0.00 O1- ATOM 0 H ASP C 65 21.798 18.604 9.799 1.00 0.00 H new ATOM 0 HA ASP C 65 20.386 16.892 11.652 1.00 0.00 H new ATOM 0 HB2 ASP C 65 21.009 19.817 11.336 1.00 0.00 H new ATOM 0 HB3 ASP C 65 19.564 19.424 12.245 1.00 0.00 H new ATOM 1009 N GLU C 66 18.314 16.712 10.239 1.00 0.00 N ATOM 1010 CA GLU C 66 16.977 16.641 9.669 1.00 0.00 C ATOM 1011 C GLU C 66 15.969 17.318 10.591 1.00 0.00 C ATOM 1012 O GLU C 66 15.030 17.965 10.129 1.00 0.00 O ATOM 1013 CB GLU C 66 16.583 15.182 9.446 1.00 0.00 C ATOM 1014 CG GLU C 66 17.416 14.611 8.298 1.00 0.00 C ATOM 1015 CD GLU C 66 17.187 13.109 8.181 1.00 0.00 C ATOM 1016 OE1 GLU C 66 16.633 12.541 9.108 1.00 0.00 O ATOM 1017 OE2 GLU C 66 17.569 12.549 7.167 1.00 0.00 O1- ATOM 0 H GLU C 66 18.723 15.807 10.474 1.00 0.00 H new ATOM 0 HA GLU C 66 16.977 17.162 8.711 1.00 0.00 H new ATOM 0 HB2 GLU C 66 16.749 14.604 10.355 1.00 0.00 H new ATOM 0 HB3 GLU C 66 15.521 15.110 9.212 1.00 0.00 H new ATOM 0 HG2 GLU C 66 17.146 15.102 7.363 1.00 0.00 H new ATOM 0 HG3 GLU C 66 18.473 14.813 8.470 1.00 0.00 H new ATOM 1024 N ASP C 67 16.164 17.155 11.897 1.00 0.00 N ATOM 1025 CA ASP C 67 15.256 17.746 12.872 1.00 0.00 C ATOM 1026 C ASP C 67 15.479 19.250 12.985 1.00 0.00 C ATOM 1027 O ASP C 67 14.671 19.962 13.582 1.00 0.00 O ATOM 1028 CB ASP C 67 15.471 17.091 14.239 1.00 0.00 C ATOM 1029 CG ASP C 67 16.901 17.333 14.715 1.00 0.00 C ATOM 1030 OD1 ASP C 67 17.619 18.046 14.034 1.00 0.00 O ATOM 1031 OD2 ASP C 67 17.257 16.799 15.752 1.00 0.00 O1- ATOM 0 H ASP C 67 16.935 16.624 12.300 1.00 0.00 H new ATOM 0 HA ASP C 67 14.233 17.574 12.537 1.00 0.00 H new ATOM 0 HB2 ASP C 67 14.764 17.499 14.962 1.00 0.00 H new ATOM 0 HB3 ASP C 67 15.277 16.020 14.173 1.00 0.00 H new ATOM 1036 N GLY C 68 16.567 19.733 12.397 1.00 0.00 N ATOM 1037 CA GLY C 68 16.863 21.159 12.431 1.00 0.00 C ATOM 1038 C GLY C 68 17.245 21.597 13.837 1.00 0.00 C ATOM 1039 O GLY C 68 17.254 22.788 14.146 1.00 0.00 O ATOM 0 H GLY C 68 17.251 19.166 11.897 1.00 0.00 H new ATOM 0 HA2 GLY C 68 17.677 21.383 11.742 1.00 0.00 H new ATOM 0 HA3 GLY C 68 15.994 21.724 12.093 1.00 0.00 H new ATOM 1043 N SER C 69 17.546 20.626 14.688 1.00 0.00 N ATOM 1044 CA SER C 69 17.912 20.923 16.066 1.00 0.00 C ATOM 1045 C SER C 69 19.180 21.770 16.120 1.00 0.00 C ATOM 1046 O SER C 69 19.436 22.452 17.114 1.00 0.00 O ATOM 1047 CB SER C 69 18.123 19.624 16.845 1.00 0.00 C ATOM 1048 OG SER C 69 19.223 18.915 16.292 1.00 0.00 O ATOM 0 H SER C 69 17.544 19.634 14.452 1.00 0.00 H new ATOM 0 HA SER C 69 17.098 21.488 16.521 1.00 0.00 H new ATOM 0 HB2 SER C 69 18.309 19.844 17.896 1.00 0.00 H new ATOM 0 HB3 SER C 69 17.223 19.011 16.802 1.00 0.00 H new ATOM 1054 N GLY C 70 19.972 21.729 15.052 1.00 0.00 N ATOM 1055 CA GLY C 70 21.205 22.505 15.005 1.00 0.00 C ATOM 1056 C GLY C 70 22.316 21.803 15.775 1.00 0.00 C ATOM 1057 O GLY C 70 23.362 22.393 16.046 1.00 0.00 O ATOM 0 H GLY C 70 19.784 21.173 14.217 1.00 0.00 H new ATOM 0 HA2 GLY C 70 21.510 22.649 13.968 1.00 0.00 H new ATOM 0 HA3 GLY C 70 21.033 23.495 15.427 1.00 0.00 H new ATOM 1061 N THR C 71 22.080 20.541 16.123 1.00 0.00 N ATOM 1062 CA THR C 71 23.065 19.762 16.863 1.00 0.00 C ATOM 1063 C THR C 71 23.329 18.427 16.171 1.00 0.00 C ATOM 1064 O THR C 71 22.471 17.903 15.460 1.00 0.00 O ATOM 1065 CB THR C 71 22.556 19.498 18.282 1.00 0.00 C ATOM 1066 OG1 THR C 71 21.367 18.721 18.217 1.00 0.00 O ATOM 1067 CG2 THR C 71 22.256 20.827 18.979 1.00 0.00 C ATOM 0 H THR C 71 21.219 20.039 15.905 1.00 0.00 H new ATOM 0 HA THR C 71 23.994 20.332 16.901 1.00 0.00 H new ATOM 0 HB THR C 71 23.318 18.960 18.846 1.00 0.00 H new ATOM 0 HG1 THR C 71 20.761 19.105 17.549 1.00 0.00 H new ATOM 0 HG21 THR C 71 21.894 20.635 19.989 1.00 0.00 H new ATOM 0 HG22 THR C 71 23.165 21.426 19.028 1.00 0.00 H new ATOM 0 HG23 THR C 71 21.495 21.369 18.418 1.00 0.00 H new ATOM 1075 N VAL C 72 24.521 17.887 16.401 1.00 0.00 N ATOM 1076 CA VAL C 72 24.914 16.608 15.817 1.00 0.00 C ATOM 1077 C VAL C 72 25.256 15.598 16.914 1.00 0.00 C ATOM 1078 O VAL C 72 26.099 15.855 17.776 1.00 0.00 O ATOM 1079 CB VAL C 72 26.113 16.815 14.884 1.00 0.00 C ATOM 1080 CG1 VAL C 72 26.663 15.464 14.423 1.00 0.00 C ATOM 1081 CG2 VAL C 72 25.663 17.612 13.657 1.00 0.00 C ATOM 0 H VAL C 72 25.235 18.316 16.990 1.00 0.00 H new ATOM 0 HA VAL C 72 24.079 16.210 15.240 1.00 0.00 H new ATOM 0 HB VAL C 72 26.892 17.356 15.422 1.00 0.00 H new ATOM 0 HG11 VAL C 72 27.514 15.624 13.761 1.00 0.00 H new ATOM 0 HG12 VAL C 72 26.982 14.886 15.290 1.00 0.00 H new ATOM 0 HG13 VAL C 72 25.886 14.918 13.889 1.00 0.00 H new ATOM 0 HG21 VAL C 72 26.512 17.762 12.990 1.00 0.00 H new ATOM 0 HG22 VAL C 72 24.882 17.062 13.132 1.00 0.00 H new ATOM 0 HG23 VAL C 72 25.275 18.580 13.974 1.00 0.00 H new ATOM 1091 N ASP C 73 24.583 14.450 16.872 1.00 0.00 N ATOM 1092 CA ASP C 73 24.799 13.395 17.859 1.00 0.00 C ATOM 1093 C ASP C 73 25.665 12.287 17.270 1.00 0.00 C ATOM 1094 O ASP C 73 26.198 12.428 16.172 1.00 0.00 O ATOM 1095 CB ASP C 73 23.456 12.811 18.307 1.00 0.00 C ATOM 1096 CG ASP C 73 22.589 13.902 18.925 1.00 0.00 C ATOM 1097 OD1 ASP C 73 23.139 14.770 19.581 1.00 0.00 O ATOM 1098 OD2 ASP C 73 21.385 13.852 18.733 1.00 0.00 O1- ATOM 0 H ASP C 73 23.883 14.227 16.164 1.00 0.00 H new ATOM 0 HA ASP C 73 25.310 13.827 18.720 1.00 0.00 H new ATOM 0 HB2 ASP C 73 22.942 12.366 17.455 1.00 0.00 H new ATOM 0 HB3 ASP C 73 23.621 12.013 19.031 1.00 0.00 H new ATOM 1103 N PHE C 74 25.806 11.187 18.004 1.00 0.00 N ATOM 1104 CA PHE C 74 26.621 10.074 17.528 1.00 0.00 C ATOM 1105 C PHE C 74 26.081 9.523 16.207 1.00 0.00 C ATOM 1106 O PHE C 74 26.849 9.243 15.287 1.00 0.00 O ATOM 1107 CB PHE C 74 26.638 8.958 18.576 1.00 0.00 C ATOM 1108 CG PHE C 74 27.571 9.338 19.700 1.00 0.00 C ATOM 1109 CD1 PHE C 74 28.956 9.261 19.510 1.00 0.00 C ATOM 1110 CD2 PHE C 74 27.056 9.767 20.930 1.00 0.00 C ATOM 1111 CE1 PHE C 74 29.826 9.613 20.548 1.00 0.00 C ATOM 1112 CE2 PHE C 74 27.927 10.119 21.968 1.00 0.00 C ATOM 1113 CZ PHE C 74 29.312 10.041 21.776 1.00 0.00 C ATOM 0 H PHE C 74 25.374 11.043 18.917 1.00 0.00 H new ATOM 0 HA PHE C 74 27.634 10.441 17.362 1.00 0.00 H new ATOM 0 HB2 PHE C 74 25.633 8.793 18.964 1.00 0.00 H new ATOM 0 HB3 PHE C 74 26.962 8.022 18.121 1.00 0.00 H new ATOM 0 HD1 PHE C 74 29.353 8.930 18.562 1.00 0.00 H new ATOM 0 HD2 PHE C 74 25.988 9.826 21.077 1.00 0.00 H new ATOM 0 HE1 PHE C 74 30.894 9.554 20.401 1.00 0.00 H new ATOM 0 HE2 PHE C 74 27.531 10.451 22.916 1.00 0.00 H new ATOM 0 HZ PHE C 74 29.984 10.312 22.577 1.00 0.00 H new ATOM 1123 N ASP C 75 24.761 9.374 16.121 1.00 0.00 N ATOM 1124 CA ASP C 75 24.133 8.858 14.905 1.00 0.00 C ATOM 1125 C ASP C 75 24.350 9.814 13.735 1.00 0.00 C ATOM 1126 O ASP C 75 24.806 9.411 12.664 1.00 0.00 O ATOM 1127 CB ASP C 75 22.633 8.667 15.143 1.00 0.00 C ATOM 1128 CG ASP C 75 21.983 8.039 13.914 1.00 0.00 C ATOM 1129 OD1 ASP C 75 21.938 6.821 13.850 1.00 0.00 O1- ATOM 1130 OD2 ASP C 75 21.537 8.784 13.057 1.00 0.00 O ATOM 0 H ASP C 75 24.109 9.601 16.872 1.00 0.00 H new ATOM 0 HA ASP C 75 24.591 7.900 14.658 1.00 0.00 H new ATOM 0 HB2 ASP C 75 22.473 8.031 16.014 1.00 0.00 H new ATOM 0 HB3 ASP C 75 22.166 9.628 15.360 1.00 0.00 H new ATOM 1135 N GLU C 76 24.034 11.087 13.953 1.00 0.00 N ATOM 1136 CA GLU C 76 24.211 12.094 12.917 1.00 0.00 C ATOM 1137 C GLU C 76 25.694 12.279 12.604 1.00 0.00 C ATOM 1138 O GLU C 76 26.079 12.455 11.449 1.00 0.00 O ATOM 1139 CB GLU C 76 23.567 13.417 13.345 1.00 0.00 C ATOM 1140 CG GLU C 76 22.042 13.270 13.298 1.00 0.00 C ATOM 1141 CD GLU C 76 21.369 14.516 13.864 1.00 0.00 C ATOM 1142 OE1 GLU C 76 22.059 15.312 14.482 1.00 0.00 O ATOM 1143 OE2 GLU C 76 20.171 14.658 13.670 1.00 0.00 O1- ATOM 0 H GLU C 76 23.657 11.442 14.832 1.00 0.00 H new ATOM 0 HA GLU C 76 23.714 11.755 12.008 1.00 0.00 H new ATOM 0 HB2 GLU C 76 23.888 13.683 14.352 1.00 0.00 H new ATOM 0 HB3 GLU C 76 23.888 14.223 12.684 1.00 0.00 H new ATOM 0 HG2 GLU C 76 21.718 13.109 12.270 1.00 0.00 H new ATOM 0 HG3 GLU C 76 21.737 12.393 13.869 1.00 0.00 H new ATOM 1150 N PHE C 77 26.523 12.220 13.642 1.00 0.00 N ATOM 1151 CA PHE C 77 27.965 12.368 13.473 1.00 0.00 C ATOM 1152 C PHE C 77 28.507 11.333 12.500 1.00 0.00 C ATOM 1153 O PHE C 77 29.260 11.666 11.583 1.00 0.00 O ATOM 1154 CB PHE C 77 28.666 12.199 14.823 1.00 0.00 C ATOM 1155 CG PHE C 77 30.124 11.853 14.605 1.00 0.00 C ATOM 1156 CD1 PHE C 77 30.949 12.718 13.880 1.00 0.00 C ATOM 1157 CD2 PHE C 77 30.651 10.664 15.137 1.00 0.00 C ATOM 1158 CE1 PHE C 77 32.299 12.398 13.681 1.00 0.00 C ATOM 1159 CE2 PHE C 77 32.003 10.343 14.938 1.00 0.00 C ATOM 1160 CZ PHE C 77 32.825 11.212 14.210 1.00 0.00 C ATOM 0 H PHE C 77 26.223 12.071 14.605 1.00 0.00 H new ATOM 0 HA PHE C 77 28.159 13.364 13.074 1.00 0.00 H new ATOM 0 HB2 PHE C 77 28.584 13.118 15.403 1.00 0.00 H new ATOM 0 HB3 PHE C 77 28.179 11.413 15.400 1.00 0.00 H new ATOM 0 HD1 PHE C 77 30.546 13.633 13.473 1.00 0.00 H new ATOM 0 HD2 PHE C 77 30.015 9.996 15.700 1.00 0.00 H new ATOM 0 HE1 PHE C 77 32.935 13.066 13.119 1.00 0.00 H new ATOM 0 HE2 PHE C 77 32.408 9.428 15.345 1.00 0.00 H new ATOM 0 HZ PHE C 77 33.866 10.968 14.056 1.00 0.00 H new ATOM 1170 N LEU C 78 28.127 10.078 12.700 1.00 0.00 N ATOM 1171 CA LEU C 78 28.602 9.018 11.820 1.00 0.00 C ATOM 1172 C LEU C 78 28.114 9.255 10.395 1.00 0.00 C ATOM 1173 O LEU C 78 28.854 9.054 9.431 1.00 0.00 O ATOM 1174 CB LEU C 78 28.101 7.660 12.324 1.00 0.00 C ATOM 1175 CG LEU C 78 28.810 7.306 13.637 1.00 0.00 C ATOM 1176 CD1 LEU C 78 28.164 6.061 14.244 1.00 0.00 C ATOM 1177 CD2 LEU C 78 30.301 7.036 13.388 1.00 0.00 C ATOM 0 H LEU C 78 27.504 9.772 13.448 1.00 0.00 H new ATOM 0 HA LEU C 78 29.692 9.022 11.822 1.00 0.00 H new ATOM 0 HB2 LEU C 78 27.023 7.693 12.479 1.00 0.00 H new ATOM 0 HB3 LEU C 78 28.292 6.890 11.576 1.00 0.00 H new ATOM 0 HG LEU C 78 28.715 8.147 14.324 1.00 0.00 H new ATOM 0 HD11 LEU C 78 28.667 5.808 15.177 1.00 0.00 H new ATOM 0 HD12 LEU C 78 27.110 6.257 14.441 1.00 0.00 H new ATOM 0 HD13 LEU C 78 28.253 5.228 13.547 1.00 0.00 H new ATOM 0 HD21 LEU C 78 30.788 6.786 14.331 1.00 0.00 H new ATOM 0 HD22 LEU C 78 30.409 6.204 12.692 1.00 0.00 H new ATOM 0 HD23 LEU C 78 30.766 7.926 12.964 1.00 0.00 H new ATOM 1189 N VAL C 79 26.864 9.685 10.273 1.00 0.00 N ATOM 1190 CA VAL C 79 26.277 9.949 8.964 1.00 0.00 C ATOM 1191 C VAL C 79 26.971 11.114 8.267 1.00 0.00 C ATOM 1192 O VAL C 79 27.195 11.080 7.058 1.00 0.00 O ATOM 1193 CB VAL C 79 24.786 10.261 9.107 1.00 0.00 C ATOM 1194 CG1 VAL C 79 24.232 10.740 7.762 1.00 0.00 C ATOM 1195 CG2 VAL C 79 24.038 8.999 9.549 1.00 0.00 C ATOM 0 H VAL C 79 26.239 9.858 11.060 1.00 0.00 H new ATOM 0 HA VAL C 79 26.410 9.054 8.357 1.00 0.00 H new ATOM 0 HB VAL C 79 24.650 11.043 9.854 1.00 0.00 H new ATOM 0 HG11 VAL C 79 23.170 10.962 7.864 1.00 0.00 H new ATOM 0 HG12 VAL C 79 24.762 11.640 7.450 1.00 0.00 H new ATOM 0 HG13 VAL C 79 24.369 9.960 7.013 1.00 0.00 H new ATOM 0 HG21 VAL C 79 22.976 9.222 9.651 1.00 0.00 H new ATOM 0 HG22 VAL C 79 24.174 8.215 8.804 1.00 0.00 H new ATOM 0 HG23 VAL C 79 24.431 8.660 10.508 1.00 0.00 H new ATOM 1205 N MET C 80 27.297 12.145 9.035 1.00 0.00 N ATOM 1206 CA MET C 80 27.948 13.318 8.482 1.00 0.00 C ATOM 1207 C MET C 80 29.296 12.942 7.912 1.00 0.00 C ATOM 1208 O MET C 80 29.702 13.426 6.856 1.00 0.00 O ATOM 1209 CB MET C 80 28.136 14.379 9.572 1.00 0.00 C ATOM 1210 CG MET C 80 28.794 15.625 8.966 1.00 0.00 C ATOM 1211 SD MET C 80 30.598 15.433 8.970 1.00 0.00 S ATOM 1212 CE MET C 80 30.901 15.930 10.686 1.00 0.00 C ATOM 0 H MET C 80 27.121 12.190 10.039 1.00 0.00 H new ATOM 0 HA MET C 80 27.320 13.723 7.689 1.00 0.00 H new ATOM 0 HB2 MET C 80 27.173 14.640 10.010 1.00 0.00 H new ATOM 0 HB3 MET C 80 28.755 13.983 10.377 1.00 0.00 H new ATOM 0 HG2 MET C 80 28.438 15.776 7.947 1.00 0.00 H new ATOM 0 HG3 MET C 80 28.512 16.510 9.537 1.00 0.00 H new ATOM 0 HE1 MET C 80 31.739 15.360 11.087 1.00 0.00 H new ATOM 0 HE2 MET C 80 31.136 16.994 10.721 1.00 0.00 H new ATOM 0 HE3 MET C 80 30.010 15.736 11.284 1.00 0.00 H new ATOM 1222 N MET C 81 29.991 12.080 8.632 1.00 0.00 N ATOM 1223 CA MET C 81 31.311 11.652 8.198 1.00 0.00 C ATOM 1224 C MET C 81 31.213 10.853 6.904 1.00 0.00 C ATOM 1225 O MET C 81 31.982 11.069 5.967 1.00 0.00 O ATOM 1226 CB MET C 81 31.968 10.807 9.287 1.00 0.00 C ATOM 1227 CG MET C 81 33.481 10.743 9.043 1.00 0.00 C ATOM 1228 SD MET C 81 34.218 12.358 9.402 1.00 0.00 S ATOM 1229 CE MET C 81 35.153 12.540 7.863 1.00 0.00 C ATOM 0 H MET C 81 29.671 11.667 9.508 1.00 0.00 H new ATOM 0 HA MET C 81 31.922 12.536 8.015 1.00 0.00 H new ATOM 0 HB2 MET C 81 31.765 11.237 10.268 1.00 0.00 H new ATOM 0 HB3 MET C 81 31.546 9.802 9.286 1.00 0.00 H new ATOM 0 HG2 MET C 81 33.930 9.977 9.676 1.00 0.00 H new ATOM 0 HG3 MET C 81 33.682 10.461 8.009 1.00 0.00 H new ATOM 0 HE1 MET C 81 35.801 13.414 7.932 1.00 0.00 H new ATOM 0 HE2 MET C 81 35.760 11.650 7.699 1.00 0.00 H new ATOM 0 HE3 MET C 81 34.462 12.667 7.030 1.00 0.00 H new ATOM 1239 N VAL C 82 30.254 9.936 6.856 1.00 0.00 N ATOM 1240 CA VAL C 82 30.055 9.115 5.668 1.00 0.00 C ATOM 1241 C VAL C 82 29.626 9.974 4.484 1.00 0.00 C ATOM 1242 O VAL C 82 30.100 9.786 3.364 1.00 0.00 O ATOM 1243 CB VAL C 82 29.003 8.039 5.937 1.00 0.00 C ATOM 1244 CG1 VAL C 82 28.652 7.332 4.626 1.00 0.00 C ATOM 1245 CG2 VAL C 82 29.569 7.020 6.929 1.00 0.00 C ATOM 0 H VAL C 82 29.606 9.743 7.620 1.00 0.00 H new ATOM 0 HA VAL C 82 31.002 8.634 5.424 1.00 0.00 H new ATOM 0 HB VAL C 82 28.106 8.498 6.353 1.00 0.00 H new ATOM 0 HG11 VAL C 82 27.902 6.564 4.816 1.00 0.00 H new ATOM 0 HG12 VAL C 82 28.256 8.058 3.916 1.00 0.00 H new ATOM 0 HG13 VAL C 82 29.547 6.869 4.211 1.00 0.00 H new ATOM 0 HG21 VAL C 82 28.823 6.250 7.125 1.00 0.00 H new ATOM 0 HG22 VAL C 82 30.463 6.560 6.508 1.00 0.00 H new ATOM 0 HG23 VAL C 82 29.824 7.523 7.862 1.00 0.00 H new ATOM 1255 N ARG C 83 28.717 10.913 4.735 1.00 0.00 N ATOM 1256 CA ARG C 83 28.228 11.786 3.682 1.00 0.00 C ATOM 1257 C ARG C 83 29.381 12.592 3.087 1.00 0.00 C ATOM 1258 O ARG C 83 29.493 12.735 1.870 1.00 0.00 O ATOM 1259 CB ARG C 83 27.183 12.727 4.272 1.00 0.00 C ATOM 1260 CG ARG C 83 26.493 13.501 3.159 1.00 0.00 C ATOM 1261 CD ARG C 83 25.424 14.389 3.782 1.00 0.00 C ATOM 1262 NE ARG C 83 24.708 15.120 2.742 1.00 0.00 N ATOM 1263 CZ ARG C 83 23.702 14.558 2.078 1.00 0.00 C ATOM 1264 NH1 ARG C 83 23.311 13.351 2.385 1.00 0.00 N ATOM 1265 NH2 ARG C 83 23.099 15.217 1.126 1.00 0.00 N1+ ATOM 0 H ARG C 83 28.309 11.085 5.654 1.00 0.00 H new ATOM 0 HA ARG C 83 27.781 11.188 2.888 1.00 0.00 H new ATOM 0 HB2 ARG C 83 26.448 12.157 4.840 1.00 0.00 H new ATOM 0 HB3 ARG C 83 27.657 13.419 4.968 1.00 0.00 H new ATOM 0 HG2 ARG C 83 27.217 14.105 2.612 1.00 0.00 H new ATOM 0 HG3 ARG C 83 26.044 12.814 2.441 1.00 0.00 H new ATOM 0 HD2 ARG C 83 24.725 13.781 4.356 1.00 0.00 H new ATOM 0 HD3 ARG C 83 25.884 15.090 4.479 1.00 0.00 H new ATOM 0 HE ARG C 83 24.983 16.077 2.521 1.00 0.00 H new ATOM 0 HH11 ARG C 83 23.777 12.839 3.134 1.00 0.00 H new ATOM 0 HH12 ARG C 83 22.539 12.920 1.876 1.00 0.00 H new ATOM 0 HH21 ARG C 83 23.399 16.163 0.891 1.00 0.00 H new ATOM 0 HH22 ARG C 83 22.327 14.786 0.617 1.00 0.00 H new ATOM 1279 N CYS C 84 30.241 13.110 3.958 1.00 0.00 N ATOM 1280 CA CYS C 84 31.390 13.892 3.515 1.00 0.00 C ATOM 1281 C CYS C 84 32.330 13.037 2.671 1.00 0.00 C ATOM 1282 O CYS C 84 32.880 13.503 1.674 1.00 0.00 O ATOM 1283 CB CYS C 84 32.148 14.443 4.726 1.00 0.00 C ATOM 1284 SG CYS C 84 31.157 15.730 5.524 1.00 0.00 S ATOM 0 H CYS C 84 30.165 13.003 4.970 1.00 0.00 H new ATOM 0 HA CYS C 84 31.026 14.720 2.907 1.00 0.00 H new ATOM 0 HB2 CYS C 84 32.358 13.640 5.433 1.00 0.00 H new ATOM 0 HB3 CYS C 84 33.109 14.851 4.412 1.00 0.00 H new ATOM 0 HG CYS C 84 31.063 15.479 6.796 1.00 0.00 H new ATOM 1290 N MET C 85 32.516 11.787 3.083 1.00 0.00 N ATOM 1291 CA MET C 85 33.399 10.881 2.357 1.00 0.00 C ATOM 1292 C MET C 85 32.908 10.683 0.926 1.00 0.00 C ATOM 1293 O MET C 85 33.703 10.685 -0.014 1.00 0.00 O ATOM 1294 CB MET C 85 33.463 9.524 3.071 1.00 0.00 C ATOM 1295 CG MET C 85 34.541 8.646 2.426 1.00 0.00 C ATOM 1296 SD MET C 85 36.174 9.355 2.761 1.00 0.00 S ATOM 1297 CE MET C 85 37.029 8.644 1.332 1.00 0.00 C ATOM 0 H MET C 85 32.072 11.381 3.907 1.00 0.00 H new ATOM 0 HA MET C 85 34.395 11.323 2.329 1.00 0.00 H new ATOM 0 HB2 MET C 85 33.685 9.670 4.128 1.00 0.00 H new ATOM 0 HB3 MET C 85 32.495 9.027 3.014 1.00 0.00 H new ATOM 0 HG2 MET C 85 34.484 7.632 2.822 1.00 0.00 H new ATOM 0 HG3 MET C 85 34.375 8.578 1.351 1.00 0.00 H new ATOM 0 HE1 MET C 85 38.073 8.958 1.339 1.00 0.00 H new ATOM 0 HE2 MET C 85 36.977 7.556 1.381 1.00 0.00 H new ATOM 0 HE3 MET C 85 36.553 8.989 0.414 1.00 0.00 H new ATOM 1307 N LYS C 86 31.597 10.517 0.758 1.00 0.00 N ATOM 1308 CA LYS C 86 31.039 10.325 -0.577 1.00 0.00 C ATOM 1309 C LYS C 86 30.702 11.668 -1.215 1.00 0.00 C ATOM 1310 O LYS C 86 30.306 11.731 -2.378 1.00 0.00 O ATOM 1311 CB LYS C 86 29.780 9.456 -0.524 1.00 0.00 C ATOM 1312 CG LYS C 86 30.139 8.056 -0.012 1.00 0.00 C ATOM 1313 CD LYS C 86 28.997 7.071 -0.303 1.00 0.00 C ATOM 1314 CE LYS C 86 27.754 7.418 0.519 1.00 0.00 C ATOM 1315 NZ LYS C 86 26.717 6.369 0.299 1.00 0.00 N1+ ATOM 0 H LYS C 86 30.913 10.512 1.515 1.00 0.00 H new ATOM 0 HA LYS C 86 31.792 9.819 -1.181 1.00 0.00 H new ATOM 0 HB2 LYS C 86 29.038 9.914 0.130 1.00 0.00 H new ATOM 0 HB3 LYS C 86 29.332 9.387 -1.515 1.00 0.00 H new ATOM 0 HG2 LYS C 86 31.056 7.711 -0.490 1.00 0.00 H new ATOM 0 HG3 LYS C 86 30.332 8.092 1.060 1.00 0.00 H new ATOM 0 HD2 LYS C 86 28.753 7.094 -1.365 1.00 0.00 H new ATOM 0 HD3 LYS C 86 29.319 6.056 -0.072 1.00 0.00 H new ATOM 0 HE2 LYS C 86 28.008 7.480 1.577 1.00 0.00 H new ATOM 0 HE3 LYS C 86 27.369 8.395 0.226 1.00 0.00 H new ATOM 0 HZ1 LYS C 86 25.868 6.598 0.855 1.00 0.00 H new ATOM 0 HZ2 LYS C 86 26.470 6.331 -0.711 1.00 0.00 H new ATOM 0 HZ3 LYS C 86 27.089 5.445 0.599 1.00 0.00 H new ATOM 1329 N ASP C 87 30.867 12.740 -0.450 1.00 0.00 N ATOM 1330 CA ASP C 87 30.585 14.075 -0.964 1.00 0.00 C ATOM 1331 C ASP C 87 29.226 14.112 -1.666 1.00 0.00 C ATOM 1332 O ASP C 87 28.183 14.165 -1.018 1.00 0.00 O ATOM 1333 CB ASP C 87 31.689 14.492 -1.939 1.00 0.00 C ATOM 1334 CG ASP C 87 33.044 14.472 -1.236 1.00 0.00 C ATOM 1335 OD1 ASP C 87 33.140 15.046 -0.164 1.00 0.00 O ATOM 1336 OD2 ASP C 87 33.963 13.880 -1.779 1.00 0.00 O1- ATOM 0 H ASP C 87 31.191 12.713 0.517 1.00 0.00 H new ATOM 0 HA ASP C 87 30.555 14.772 -0.127 1.00 0.00 H new ATOM 0 HB2 ASP C 87 31.704 13.816 -2.794 1.00 0.00 H new ATOM 0 HB3 ASP C 87 31.486 15.491 -2.325 1.00 0.00 H new ATOM 1341 N ASP C 88 29.255 14.097 -2.992 1.00 0.00 N ATOM 1342 CA ASP C 88 28.042 14.140 -3.780 1.00 0.00 C ATOM 1343 C ASP C 88 27.218 12.887 -3.548 1.00 0.00 C ATOM 1344 O ASP C 88 27.109 12.022 -4.418 1.00 0.00 O ATOM 1345 CB ASP C 88 28.390 14.256 -5.265 1.00 0.00 C ATOM 1346 CG ASP C 88 29.560 15.215 -5.455 1.00 0.00 C ATOM 1347 OD1 ASP C 88 29.313 16.398 -5.618 1.00 0.00 O1- ATOM 1348 OD2 ASP C 88 30.689 14.750 -5.435 1.00 0.00 O ATOM 0 H ASP C 88 30.113 14.055 -3.542 1.00 0.00 H new ATOM 0 HA ASP C 88 27.459 15.009 -3.475 1.00 0.00 H new ATOM 0 HB2 ASP C 88 28.645 13.275 -5.664 1.00 0.00 H new ATOM 0 HB3 ASP C 88 27.524 14.612 -5.823 1.00 0.00 H new ATOM 1353 N SER C 89 26.643 12.813 -2.364 1.00 0.00 N ATOM 1354 CA SER C 89 25.812 11.674 -1.985 1.00 0.00 C ATOM 1355 C SER C 89 24.964 11.207 -3.166 1.00 0.00 C ATOM 1356 O SER C 89 24.762 10.010 -3.289 1.00 0.00 O ATOM 1357 CB SER C 89 24.896 12.061 -0.826 1.00 0.00 C ATOM 1358 OG SER C 89 25.574 11.839 0.402 1.00 0.00 O ATOM 1359 OXT SER C 89 24.529 12.053 -3.930 1.00 0.00 O ATOM 0 H SER C 89 26.733 13.528 -1.642 1.00 0.00 H new ATOM 0 HA SER C 89 26.468 10.859 -1.678 1.00 0.00 H new ATOM 0 HB2 SER C 89 24.606 13.108 -0.910 1.00 0.00 H new ATOM 0 HB3 SER C 89 23.979 11.473 -0.860 1.00 0.00 H new ATOM 0 HG SER C 89 24.944 11.488 1.065 1.00 0.00 H new TER 1365 SER C 89 ATOM 1366 N ARG I 144 34.321 22.899 -6.614 1.00 0.00 N ATOM 1367 CA ARG I 144 35.267 22.101 -5.785 1.00 0.00 C ATOM 1368 C ARG I 144 35.198 22.564 -4.335 1.00 0.00 C ATOM 1369 O ARG I 144 35.970 22.107 -3.496 1.00 0.00 O ATOM 1370 CB ARG I 144 36.685 22.279 -6.329 1.00 0.00 C ATOM 1371 CG ARG I 144 36.996 21.145 -7.306 1.00 0.00 C ATOM 1372 CD ARG I 144 38.229 21.507 -8.133 1.00 0.00 C ATOM 1373 NE ARG I 144 37.885 22.536 -9.104 1.00 0.00 N ATOM 1374 CZ ARG I 144 37.261 22.227 -10.235 1.00 0.00 C ATOM 1375 NH1 ARG I 144 36.954 20.983 -10.489 1.00 0.00 N ATOM 1376 NH2 ARG I 144 36.951 23.163 -11.089 1.00 0.00 N1+ ATOM 0 HA ARG I 144 34.995 21.046 -5.828 1.00 0.00 H new ATOM 0 HB2 ARG I 144 36.776 23.242 -6.831 1.00 0.00 H new ATOM 0 HB3 ARG I 144 37.404 22.277 -5.510 1.00 0.00 H new ATOM 0 HG2 ARG I 144 37.171 20.218 -6.760 1.00 0.00 H new ATOM 0 HG3 ARG I 144 36.143 20.972 -7.962 1.00 0.00 H new ATOM 0 HD2 ARG I 144 39.026 21.862 -7.479 1.00 0.00 H new ATOM 0 HD3 ARG I 144 38.608 20.622 -8.645 1.00 0.00 H new ATOM 0 HE ARG I 144 38.127 23.508 -8.913 1.00 0.00 H new ATOM 0 HH11 ARG I 144 37.193 20.252 -9.819 1.00 0.00 H new ATOM 0 HH12 ARG I 144 36.475 20.743 -11.357 1.00 0.00 H new ATOM 0 HH21 ARG I 144 37.188 24.135 -10.889 1.00 0.00 H new ATOM 0 HH22 ARG I 144 36.472 22.923 -11.957 1.00 0.00 H new ATOM 1392 N ARG I 145 34.266 23.469 -4.049 1.00 0.00 N ATOM 1393 CA ARG I 145 34.101 23.990 -2.692 1.00 0.00 C ATOM 1394 C ARG I 145 35.356 24.738 -2.246 1.00 0.00 C ATOM 1395 O ARG I 145 35.331 25.956 -2.066 1.00 0.00 O ATOM 1396 CB ARG I 145 33.802 22.845 -1.715 1.00 0.00 C ATOM 1397 CG ARG I 145 32.402 23.032 -1.124 1.00 0.00 C ATOM 1398 CD ARG I 145 32.049 21.826 -0.252 1.00 0.00 C ATOM 1399 NE ARG I 145 31.097 20.964 -0.945 1.00 0.00 N ATOM 1400 CZ ARG I 145 29.802 21.260 -0.977 1.00 0.00 C ATOM 1401 NH1 ARG I 145 29.365 22.337 -0.386 1.00 0.00 N ATOM 1402 NH2 ARG I 145 28.968 20.473 -1.601 1.00 0.00 N1+ ATOM 0 H ARG I 145 33.616 23.856 -4.733 1.00 0.00 H new ATOM 0 HA ARG I 145 33.262 24.685 -2.693 1.00 0.00 H new ATOM 0 HB2 ARG I 145 33.866 21.887 -2.230 1.00 0.00 H new ATOM 0 HB3 ARG I 145 34.546 22.829 -0.918 1.00 0.00 H new ATOM 0 HG2 ARG I 145 32.366 23.946 -0.531 1.00 0.00 H new ATOM 0 HG3 ARG I 145 31.670 23.142 -1.924 1.00 0.00 H new ATOM 0 HD2 ARG I 145 32.952 21.264 -0.013 1.00 0.00 H new ATOM 0 HD3 ARG I 145 31.624 22.164 0.693 1.00 0.00 H new ATOM 0 HE ARG I 145 31.431 20.121 -1.412 1.00 0.00 H new ATOM 0 HH11 ARG I 145 30.017 22.952 0.101 1.00 0.00 H new ATOM 0 HH12 ARG I 145 28.371 22.565 -0.410 1.00 0.00 H new ATOM 0 HH21 ARG I 145 29.310 19.631 -2.064 1.00 0.00 H new ATOM 0 HH22 ARG I 145 27.974 20.700 -1.626 1.00 0.00 H new ATOM 1416 N VAL I 146 36.450 24.002 -2.070 1.00 0.00 N ATOM 1417 CA VAL I 146 37.713 24.603 -1.647 1.00 0.00 C ATOM 1418 C VAL I 146 37.628 25.058 -0.191 1.00 0.00 C ATOM 1419 O VAL I 146 38.507 25.764 0.303 1.00 0.00 O ATOM 1420 CB VAL I 146 38.066 25.795 -2.546 1.00 0.00 C ATOM 1421 CG1 VAL I 146 39.582 26.015 -2.534 1.00 0.00 C ATOM 1422 CG2 VAL I 146 37.614 25.515 -3.985 1.00 0.00 C ATOM 0 H VAL I 146 36.489 22.993 -2.213 1.00 0.00 H new ATOM 0 HA VAL I 146 38.496 23.850 -1.735 1.00 0.00 H new ATOM 0 HB VAL I 146 37.559 26.684 -2.171 1.00 0.00 H new ATOM 0 HG11 VAL I 146 39.832 26.862 -3.173 1.00 0.00 H new ATOM 0 HG12 VAL I 146 39.912 26.219 -1.515 1.00 0.00 H new ATOM 0 HG13 VAL I 146 40.082 25.121 -2.905 1.00 0.00 H new ATOM 0 HG21 VAL I 146 37.868 26.365 -4.618 1.00 0.00 H new ATOM 0 HG22 VAL I 146 38.117 24.623 -4.357 1.00 0.00 H new ATOM 0 HG23 VAL I 146 36.536 25.358 -4.004 1.00 0.00 H new ATOM 1432 N ARG I 147 36.568 24.642 0.492 1.00 0.00 N ATOM 1433 CA ARG I 147 36.382 25.008 1.893 1.00 0.00 C ATOM 1434 C ARG I 147 37.317 24.189 2.778 1.00 0.00 C ATOM 1435 O ARG I 147 38.501 24.504 2.899 1.00 0.00 O ATOM 1436 CB ARG I 147 34.927 24.759 2.307 1.00 0.00 C ATOM 1437 CG ARG I 147 33.973 25.640 1.486 1.00 0.00 C ATOM 1438 CD ARG I 147 33.903 27.050 2.084 1.00 0.00 C ATOM 1439 NE ARG I 147 33.420 26.985 3.459 1.00 0.00 N ATOM 1440 CZ ARG I 147 32.121 26.901 3.727 1.00 0.00 C ATOM 1441 NH1 ARG I 147 31.254 26.900 2.752 1.00 0.00 N ATOM 1442 NH2 ARG I 147 31.712 26.824 4.964 1.00 0.00 N1+ ATOM 0 H ARG I 147 35.829 24.056 0.104 1.00 0.00 H new ATOM 0 HA ARG I 147 36.615 26.066 2.015 1.00 0.00 H new ATOM 0 HB2 ARG I 147 34.676 23.708 2.161 1.00 0.00 H new ATOM 0 HB3 ARG I 147 34.804 24.972 3.369 1.00 0.00 H new ATOM 0 HG2 ARG I 147 34.315 25.693 0.452 1.00 0.00 H new ATOM 0 HG3 ARG I 147 32.978 25.194 1.471 1.00 0.00 H new ATOM 0 HD2 ARG I 147 34.889 27.515 2.058 1.00 0.00 H new ATOM 0 HD3 ARG I 147 33.240 27.675 1.486 1.00 0.00 H new ATOM 0 HE ARG I 147 34.090 27.004 4.227 1.00 0.00 H new ATOM 0 HH11 ARG I 147 31.573 26.964 1.785 1.00 0.00 H new ATOM 0 HH12 ARG I 147 30.257 26.836 2.956 1.00 0.00 H new ATOM 0 HH21 ARG I 147 32.390 26.828 5.726 1.00 0.00 H new ATOM 0 HH22 ARG I 147 30.715 26.760 5.168 1.00 0.00 H new ATOM 1456 N ILE I 148 36.784 23.131 3.387 1.00 0.00 N ATOM 1457 CA ILE I 148 37.587 22.272 4.250 1.00 0.00 C ATOM 1458 C ILE I 148 37.883 20.947 3.559 1.00 0.00 C ATOM 1459 O ILE I 148 36.983 20.144 3.314 1.00 0.00 O ATOM 1460 CB ILE I 148 36.847 22.018 5.567 1.00 0.00 C ATOM 1461 CG1 ILE I 148 36.702 23.341 6.327 1.00 0.00 C ATOM 1462 CG2 ILE I 148 37.631 21.016 6.417 1.00 0.00 C ATOM 1463 CD1 ILE I 148 35.720 23.165 7.486 1.00 0.00 C ATOM 0 H ILE I 148 35.807 22.851 3.299 1.00 0.00 H new ATOM 0 HA ILE I 148 38.531 22.775 4.459 1.00 0.00 H new ATOM 0 HB ILE I 148 35.859 21.608 5.357 1.00 0.00 H new ATOM 0 HG12 ILE I 148 37.672 23.662 6.706 1.00 0.00 H new ATOM 0 HG13 ILE I 148 36.348 24.122 5.653 1.00 0.00 H new ATOM 0 HG21 ILE I 148 37.100 20.839 7.353 1.00 0.00 H new ATOM 0 HG22 ILE I 148 37.731 20.077 5.873 1.00 0.00 H new ATOM 0 HG23 ILE I 148 38.621 21.418 6.632 1.00 0.00 H new ATOM 0 HD11 ILE I 148 35.619 24.108 8.024 1.00 0.00 H new ATOM 0 HD12 ILE I 148 34.748 22.864 7.096 1.00 0.00 H new ATOM 0 HD13 ILE I 148 36.092 22.398 8.165 1.00 0.00 H new ATOM 1475 N SER I 149 39.158 20.728 3.251 1.00 0.00 N ATOM 1476 CA SER I 149 39.586 19.500 2.588 1.00 0.00 C ATOM 1477 C SER I 149 39.540 18.324 3.556 1.00 0.00 C ATOM 1478 O SER I 149 39.762 18.484 4.755 1.00 0.00 O ATOM 1479 CB SER I 149 41.003 19.664 2.039 1.00 0.00 C ATOM 1480 OG SER I 149 41.429 18.435 1.464 1.00 0.00 O ATOM 0 H SER I 149 39.913 21.385 3.450 1.00 0.00 H new ATOM 0 HA SER I 149 38.903 19.300 1.762 1.00 0.00 H new ATOM 0 HB2 SER I 149 41.026 20.456 1.291 1.00 0.00 H new ATOM 0 HB3 SER I 149 41.683 19.960 2.838 1.00 0.00 H new ATOM 0 HG SER I 149 42.337 18.537 1.109 1.00 0.00 H new ATOM 1486 N ALA I 150 39.248 17.142 3.026 1.00 0.00 N ATOM 1487 CA ALA I 150 39.172 15.945 3.852 1.00 0.00 C ATOM 1488 C ALA I 150 40.508 15.687 4.543 1.00 0.00 C ATOM 1489 O ALA I 150 40.545 15.288 5.704 1.00 0.00 O ATOM 1490 CB ALA I 150 38.801 14.738 2.989 1.00 0.00 C ATOM 0 H ALA I 150 39.061 16.988 2.035 1.00 0.00 H new ATOM 0 HA ALA I 150 38.405 16.098 4.612 1.00 0.00 H new ATOM 0 HB1 ALA I 150 38.746 13.847 3.614 1.00 0.00 H new ATOM 0 HB2 ALA I 150 37.833 14.911 2.518 1.00 0.00 H new ATOM 0 HB3 ALA I 150 39.559 14.595 2.219 1.00 0.00 H new ATOM 1496 N ASP I 151 41.601 15.911 3.821 1.00 0.00 N ATOM 1497 CA ASP I 151 42.929 15.692 4.385 1.00 0.00 C ATOM 1498 C ASP I 151 43.151 16.582 5.607 1.00 0.00 C ATOM 1499 O ASP I 151 43.603 16.115 6.651 1.00 0.00 O ATOM 1500 CB ASP I 151 43.994 15.993 3.328 1.00 0.00 C ATOM 1501 CG ASP I 151 45.382 15.679 3.877 1.00 0.00 C ATOM 1502 OD1 ASP I 151 45.494 15.495 5.077 1.00 0.00 O ATOM 1503 OD2 ASP I 151 46.311 15.627 3.088 1.00 0.00 O1- ATOM 0 H ASP I 151 41.596 16.240 2.856 1.00 0.00 H new ATOM 0 HA ASP I 151 43.006 14.650 4.696 1.00 0.00 H new ATOM 0 HB2 ASP I 151 43.806 15.401 2.433 1.00 0.00 H new ATOM 0 HB3 ASP I 151 43.939 17.041 3.034 1.00 0.00 H new ATOM 1508 N ALA I 152 42.825 17.864 5.471 1.00 0.00 N ATOM 1509 CA ALA I 152 42.990 18.808 6.573 1.00 0.00 C ATOM 1510 C ALA I 152 42.098 18.431 7.755 1.00 0.00 C ATOM 1511 O ALA I 152 42.506 18.531 8.910 1.00 0.00 O ATOM 1512 CB ALA I 152 42.642 20.221 6.104 1.00 0.00 C ATOM 0 H ALA I 152 42.448 18.271 4.615 1.00 0.00 H new ATOM 0 HA ALA I 152 44.030 18.773 6.897 1.00 0.00 H new ATOM 0 HB1 ALA I 152 42.767 20.920 6.931 1.00 0.00 H new ATOM 0 HB2 ALA I 152 43.303 20.506 5.285 1.00 0.00 H new ATOM 0 HB3 ALA I 152 41.608 20.246 5.761 1.00 0.00 H new ATOM 1518 N MET I 153 40.873 18.011 7.455 1.00 0.00 N ATOM 1519 CA MET I 153 39.924 17.636 8.497 1.00 0.00 C ATOM 1520 C MET I 153 40.466 16.470 9.318 1.00 0.00 C ATOM 1521 O MET I 153 40.432 16.486 10.555 1.00 0.00 O ATOM 1522 CB MET I 153 38.599 17.226 7.849 1.00 0.00 C ATOM 1523 CG MET I 153 37.516 17.079 8.920 1.00 0.00 C ATOM 1524 SD MET I 153 37.091 18.715 9.566 1.00 0.00 S ATOM 1525 CE MET I 153 35.808 18.182 10.724 1.00 0.00 C ATOM 0 H MET I 153 40.516 17.922 6.504 1.00 0.00 H new ATOM 0 HA MET I 153 39.769 18.489 9.157 1.00 0.00 H new ATOM 0 HB2 MET I 153 38.297 17.973 7.115 1.00 0.00 H new ATOM 0 HB3 MET I 153 38.723 16.285 7.313 1.00 0.00 H new ATOM 0 HG2 MET I 153 36.632 16.601 8.497 1.00 0.00 H new ATOM 0 HG3 MET I 153 37.870 16.437 9.727 1.00 0.00 H new ATOM 0 HE1 MET I 153 34.958 18.861 10.663 1.00 0.00 H new ATOM 0 HE2 MET I 153 35.485 17.172 10.470 1.00 0.00 H new ATOM 0 HE3 MET I 153 36.207 18.191 11.738 1.00 0.00 H new ATOM 1535 N MET I 154 40.971 15.460 8.620 1.00 0.00 N ATOM 1536 CA MET I 154 41.521 14.291 9.286 1.00 0.00 C ATOM 1537 C MET I 154 42.735 14.682 10.120 1.00 0.00 C ATOM 1538 O MET I 154 42.912 14.199 11.232 1.00 0.00 O ATOM 1539 CB MET I 154 41.938 13.249 8.244 1.00 0.00 C ATOM 1540 CG MET I 154 40.703 12.667 7.543 1.00 0.00 C ATOM 1541 SD MET I 154 39.688 11.745 8.725 1.00 0.00 S ATOM 1542 CE MET I 154 38.558 10.999 7.524 1.00 0.00 C ATOM 0 H MET I 154 41.010 15.428 7.601 1.00 0.00 H new ATOM 0 HA MET I 154 40.757 13.870 9.940 1.00 0.00 H new ATOM 0 HB2 MET I 154 42.600 13.706 7.508 1.00 0.00 H new ATOM 0 HB3 MET I 154 42.501 12.449 8.726 1.00 0.00 H new ATOM 0 HG2 MET I 154 40.116 13.471 7.098 1.00 0.00 H new ATOM 0 HG3 MET I 154 41.013 12.011 6.730 1.00 0.00 H new ATOM 0 HE1 MET I 154 37.832 10.376 8.046 1.00 0.00 H new ATOM 0 HE2 MET I 154 38.036 11.785 6.979 1.00 0.00 H new ATOM 0 HE3 MET I 154 39.125 10.386 6.823 1.00 0.00 H new ATOM 1552 N GLN I 155 43.571 15.556 9.568 1.00 0.00 N ATOM 1553 CA GLN I 155 44.772 16.001 10.268 1.00 0.00 C ATOM 1554 C GLN I 155 44.407 16.794 11.527 1.00 0.00 C ATOM 1555 O GLN I 155 45.062 16.666 12.563 1.00 0.00 O ATOM 1556 CB GLN I 155 45.629 16.861 9.333 1.00 0.00 C ATOM 1557 CG GLN I 155 46.997 17.121 9.972 1.00 0.00 C ATOM 1558 CD GLN I 155 47.923 17.788 8.959 1.00 0.00 C ATOM 1559 OE1 GLN I 155 47.471 18.566 8.119 1.00 0.00 O ATOM 1560 NE2 GLN I 155 49.202 17.520 8.980 1.00 0.00 N ATOM 0 H GLN I 155 43.441 15.968 8.644 1.00 0.00 H new ATOM 0 HA GLN I 155 45.341 15.123 10.572 1.00 0.00 H new ATOM 0 HB2 GLN I 155 45.755 16.357 8.375 1.00 0.00 H new ATOM 0 HB3 GLN I 155 45.126 17.807 9.132 1.00 0.00 H new ATOM 0 HG2 GLN I 155 46.884 17.758 10.849 1.00 0.00 H new ATOM 0 HG3 GLN I 155 47.433 16.182 10.314 1.00 0.00 H new ATOM 0 HE21 GLN I 155 49.577 16.875 9.676 1.00 0.00 H new ATOM 0 HE22 GLN I 155 49.826 17.956 8.300 1.00 0.00 H new ATOM 1569 N ALA I 156 43.363 17.618 11.428 1.00 0.00 N ATOM 1570 CA ALA I 156 42.928 18.435 12.563 1.00 0.00 C ATOM 1571 C ALA I 156 42.530 17.562 13.752 1.00 0.00 C ATOM 1572 O ALA I 156 42.830 17.891 14.900 1.00 0.00 O ATOM 1573 CB ALA I 156 41.731 19.300 12.160 1.00 0.00 C ATOM 0 H ALA I 156 42.807 17.737 10.581 1.00 0.00 H new ATOM 0 HA ALA I 156 43.765 19.069 12.855 1.00 0.00 H new ATOM 0 HB1 ALA I 156 41.415 19.904 13.011 1.00 0.00 H new ATOM 0 HB2 ALA I 156 42.016 19.955 11.337 1.00 0.00 H new ATOM 0 HB3 ALA I 156 40.908 18.658 11.845 1.00 0.00 H new ATOM 1579 N LEU I 157 41.845 16.458 13.470 1.00 0.00 N ATOM 1580 CA LEU I 157 41.402 15.548 14.527 1.00 0.00 C ATOM 1581 C LEU I 157 41.777 14.105 14.177 1.00 0.00 C ATOM 1582 O LEU I 157 42.781 13.872 13.509 1.00 0.00 O ATOM 1583 CB LEU I 157 39.887 15.686 14.712 1.00 0.00 C ATOM 1584 CG LEU I 157 39.191 15.501 13.366 1.00 0.00 C ATOM 1585 CD1 LEU I 157 38.206 14.337 13.459 1.00 0.00 C ATOM 1586 CD2 LEU I 157 38.440 16.784 13.001 1.00 0.00 C ATOM 0 H LEU I 157 41.585 16.171 12.526 1.00 0.00 H new ATOM 0 HA LEU I 157 41.899 15.807 15.462 1.00 0.00 H new ATOM 0 HB2 LEU I 157 39.528 14.943 15.424 1.00 0.00 H new ATOM 0 HB3 LEU I 157 39.648 16.666 15.125 1.00 0.00 H new ATOM 0 HG LEU I 157 39.933 15.285 12.597 1.00 0.00 H new ATOM 0 HD11 LEU I 157 37.708 14.204 12.498 1.00 0.00 H new ATOM 0 HD12 LEU I 157 38.744 13.425 13.718 1.00 0.00 H new ATOM 0 HD13 LEU I 157 37.462 14.550 14.227 1.00 0.00 H new ATOM 0 HD21 LEU I 157 37.942 16.653 12.040 1.00 0.00 H new ATOM 0 HD22 LEU I 157 37.697 17.001 13.768 1.00 0.00 H new ATOM 0 HD23 LEU I 157 39.146 17.612 12.935 1.00 0.00 H new ATOM 1598 N LEU I 158 40.988 13.139 14.637 1.00 0.00 N ATOM 1599 CA LEU I 158 41.283 11.738 14.354 1.00 0.00 C ATOM 1600 C LEU I 158 42.737 11.407 14.702 1.00 0.00 C ATOM 1601 O LEU I 158 43.029 10.984 15.820 1.00 0.00 O ATOM 1602 CB LEU I 158 41.006 11.440 12.874 1.00 0.00 C ATOM 1603 CG LEU I 158 40.953 9.925 12.654 1.00 0.00 C ATOM 1604 CD1 LEU I 158 39.536 9.407 12.919 1.00 0.00 C ATOM 1605 CD2 LEU I 158 41.354 9.603 11.214 1.00 0.00 C ATOM 0 H LEU I 158 40.151 13.296 15.199 1.00 0.00 H new ATOM 0 HA LEU I 158 40.638 11.113 14.972 1.00 0.00 H new ATOM 0 HB2 LEU I 158 40.062 11.894 12.572 1.00 0.00 H new ATOM 0 HB3 LEU I 158 41.785 11.881 12.252 1.00 0.00 H new ATOM 0 HG LEU I 158 41.645 9.440 13.343 1.00 0.00 H new ATOM 0 HD11 LEU I 158 39.507 8.329 12.760 1.00 0.00 H new ATOM 0 HD12 LEU I 158 39.254 9.630 13.948 1.00 0.00 H new ATOM 0 HD13 LEU I 158 38.838 9.893 12.238 1.00 0.00 H new ATOM 0 HD21 LEU I 158 41.316 8.525 11.058 1.00 0.00 H new ATOM 0 HD22 LEU I 158 40.665 10.094 10.526 1.00 0.00 H new ATOM 0 HD23 LEU I 158 42.367 9.961 11.030 1.00 0.00 H new ATOM 1617 N GLY I 159 43.642 11.599 13.745 1.00 0.00 N ATOM 1618 CA GLY I 159 45.054 11.318 13.972 1.00 0.00 C ATOM 1619 C GLY I 159 45.920 12.460 13.462 1.00 0.00 C ATOM 1620 O GLY I 159 45.802 12.872 12.307 1.00 0.00 O ATOM 0 H GLY I 159 43.423 11.946 12.811 1.00 0.00 H new ATOM 0 HA2 GLY I 159 45.233 11.167 15.037 1.00 0.00 H new ATOM 0 HA3 GLY I 159 45.331 10.392 13.468 1.00 0.00 H new ATOM 1624 N ALA I 160 46.792 12.962 14.324 1.00 0.00 N ATOM 1625 CA ALA I 160 47.678 14.055 13.948 1.00 0.00 C ATOM 1626 C ALA I 160 48.600 13.628 12.811 1.00 0.00 C ATOM 1627 O ALA I 160 48.872 14.404 11.895 1.00 0.00 O ATOM 1628 CB ALA I 160 48.513 14.486 15.155 1.00 0.00 C ATOM 0 H ALA I 160 46.905 12.633 15.283 1.00 0.00 H new ATOM 0 HA ALA I 160 47.070 14.894 13.610 1.00 0.00 H new ATOM 0 HB1 ALA I 160 49.174 15.304 14.867 1.00 0.00 H new ATOM 0 HB2 ALA I 160 47.852 14.818 15.955 1.00 0.00 H new ATOM 0 HB3 ALA I 160 49.110 13.643 15.504 1.00 0.00 H new ATOM 1634 N ARG I 161 49.078 12.389 12.879 1.00 0.00 N ATOM 1635 CA ARG I 161 49.973 11.866 11.852 1.00 0.00 C ATOM 1636 C ARG I 161 49.233 10.948 10.884 1.00 0.00 C ATOM 1637 O ARG I 161 48.644 9.946 11.293 1.00 0.00 O ATOM 1638 CB ARG I 161 51.098 11.066 12.508 1.00 0.00 C ATOM 1639 CG ARG I 161 50.525 10.254 13.674 1.00 0.00 C ATOM 1640 CD ARG I 161 51.251 8.910 13.774 1.00 0.00 C ATOM 1641 NE ARG I 161 52.676 9.114 13.996 1.00 0.00 N ATOM 1642 CZ ARG I 161 53.525 8.091 13.983 1.00 0.00 C ATOM 1643 NH1 ARG I 161 53.080 6.879 13.787 1.00 0.00 N ATOM 1644 NH2 ARG I 161 54.799 8.296 14.169 1.00 0.00 N1+ ATOM 0 H ARG I 161 48.862 11.732 13.629 1.00 0.00 H new ATOM 0 HA ARG I 161 50.374 12.716 11.300 1.00 0.00 H new ATOM 0 HB2 ARG I 161 51.561 10.401 11.779 1.00 0.00 H new ATOM 0 HB3 ARG I 161 51.878 11.738 12.866 1.00 0.00 H new ATOM 0 HG2 ARG I 161 50.637 10.809 14.606 1.00 0.00 H new ATOM 0 HG3 ARG I 161 49.457 10.091 13.526 1.00 0.00 H new ATOM 0 HD2 ARG I 161 50.830 8.323 14.590 1.00 0.00 H new ATOM 0 HD3 ARG I 161 51.098 8.339 12.859 1.00 0.00 H new ATOM 0 HE ARG I 161 53.028 10.056 14.164 1.00 0.00 H new ATOM 0 HH11 ARG I 161 52.083 6.719 13.644 1.00 0.00 H new ATOM 0 HH12 ARG I 161 53.730 6.093 13.777 1.00 0.00 H new ATOM 0 HH21 ARG I 161 55.146 9.242 14.325 1.00 0.00 H new ATOM 0 HH22 ARG I 161 55.449 7.510 14.159 1.00 0.00 H new ATOM 1658 N HIS I 162 49.290 11.277 9.598 1.00 0.00 N ATOM 1659 CA HIS I 162 48.646 10.451 8.584 1.00 0.00 C ATOM 1660 C HIS I 162 49.238 10.768 7.214 1.00 0.00 C ATOM 1661 O HIS I 162 49.885 11.801 7.037 1.00 0.00 O ATOM 1662 CB HIS I 162 47.135 10.700 8.556 1.00 0.00 C ATOM 1663 CG HIS I 162 46.833 11.905 7.713 1.00 0.00 C ATOM 1664 ND1 HIS I 162 46.548 11.791 6.362 1.00 0.00 N ATOM 1665 CD2 HIS I 162 46.762 13.245 8.000 1.00 0.00 C ATOM 1666 CE1 HIS I 162 46.320 13.025 5.887 1.00 0.00 C ATOM 1667 NE2 HIS I 162 46.437 13.953 6.844 1.00 0.00 N ATOM 0 H HIS I 162 49.770 12.101 9.236 1.00 0.00 H new ATOM 0 HA HIS I 162 48.821 9.404 8.831 1.00 0.00 H new ATOM 0 HB2 HIS I 162 46.621 9.826 8.155 1.00 0.00 H new ATOM 0 HB3 HIS I 162 46.763 10.852 9.569 1.00 0.00 H new ATOM 0 HD1 HIS I 162 46.517 10.924 5.825 1.00 0.00 H new ATOM 0 HD2 HIS I 162 46.932 13.684 8.972 1.00 0.00 H new ATOM 0 HE1 HIS I 162 46.072 13.243 4.859 1.00 0.00 H new ATOM 0 HE2 HIS I 162 46.315 14.961 6.748 1.00 0.00 H new ATOM 1676 N LYS I 163 49.008 9.882 6.248 1.00 0.00 N ATOM 1677 CA LYS I 163 49.518 10.082 4.893 1.00 0.00 C ATOM 1678 C LYS I 163 48.358 10.277 3.924 1.00 0.00 C ATOM 1679 O LYS I 163 47.246 9.808 4.173 1.00 0.00 O ATOM 1680 CB LYS I 163 50.355 8.874 4.454 1.00 0.00 C ATOM 1681 CG LYS I 163 51.531 8.671 5.418 1.00 0.00 C ATOM 1682 CD LYS I 163 52.713 9.555 5.003 1.00 0.00 C ATOM 1683 CE LYS I 163 53.860 9.362 5.997 1.00 0.00 C ATOM 1684 NZ LYS I 163 54.215 7.917 6.073 1.00 0.00 N1+ ATOM 0 H LYS I 163 48.474 9.022 6.377 1.00 0.00 H new ATOM 0 HA LYS I 163 50.148 10.971 4.887 1.00 0.00 H new ATOM 0 HB2 LYS I 163 49.733 7.979 4.433 1.00 0.00 H new ATOM 0 HB3 LYS I 163 50.727 9.028 3.441 1.00 0.00 H new ATOM 0 HG2 LYS I 163 51.224 8.915 6.435 1.00 0.00 H new ATOM 0 HG3 LYS I 163 51.833 7.624 5.419 1.00 0.00 H new ATOM 0 HD2 LYS I 163 53.041 9.295 3.996 1.00 0.00 H new ATOM 0 HD3 LYS I 163 52.409 10.601 4.979 1.00 0.00 H new ATOM 0 HE2 LYS I 163 54.727 9.944 5.685 1.00 0.00 H new ATOM 0 HE3 LYS I 163 53.568 9.728 6.981 1.00 0.00 H new ATOM 0 HZ1 LYS I 163 55.187 7.817 6.429 1.00 0.00 H new ATOM 0 HZ2 LYS I 163 53.558 7.432 6.717 1.00 0.00 H new ATOM 0 HZ3 LYS I 163 54.148 7.493 5.126 1.00 0.00 H new ATOM 1698 N GLU I 164 48.619 10.978 2.824 1.00 0.00 N ATOM 1699 CA GLU I 164 47.582 11.234 1.829 1.00 0.00 C ATOM 1700 C GLU I 164 46.706 10.004 1.628 1.00 0.00 C ATOM 1701 O GLU I 164 47.204 8.907 1.373 1.00 0.00 O ATOM 1702 CB GLU I 164 48.223 11.627 0.497 1.00 0.00 C ATOM 1703 CG GLU I 164 48.044 13.128 0.265 1.00 0.00 C ATOM 1704 CD GLU I 164 46.587 13.430 -0.064 1.00 0.00 C ATOM 1705 OE1 GLU I 164 45.871 12.501 -0.404 1.00 0.00 O ATOM 1706 OE2 GLU I 164 46.206 14.585 0.027 1.00 0.00 O1- ATOM 0 H GLU I 164 49.531 11.376 2.600 1.00 0.00 H new ATOM 0 HA GLU I 164 46.958 12.051 2.191 1.00 0.00 H new ATOM 0 HB2 GLU I 164 49.283 11.374 0.503 1.00 0.00 H new ATOM 0 HB3 GLU I 164 47.766 11.066 -0.318 1.00 0.00 H new ATOM 0 HG2 GLU I 164 48.348 13.681 1.154 1.00 0.00 H new ATOM 0 HG3 GLU I 164 48.687 13.458 -0.551 1.00 0.00 H new ATOM 1713 N SER I 165 45.398 10.197 1.753 1.00 0.00 N ATOM 1714 CA SER I 165 44.453 9.100 1.589 1.00 0.00 C ATOM 1715 C SER I 165 43.791 9.147 0.215 1.00 0.00 C ATOM 1716 O SER I 165 43.786 8.157 -0.516 1.00 0.00 O ATOM 1717 CB SER I 165 43.377 9.176 2.673 1.00 0.00 C ATOM 1718 OG SER I 165 42.295 8.326 2.320 1.00 0.00 O ATOM 0 H SER I 165 44.970 11.098 1.966 1.00 0.00 H new ATOM 0 HA SER I 165 45.003 8.163 1.678 1.00 0.00 H new ATOM 0 HB2 SER I 165 43.792 8.875 3.635 1.00 0.00 H new ATOM 0 HB3 SER I 165 43.027 10.202 2.783 1.00 0.00 H new ATOM 0 HG SER I 165 41.604 8.371 3.013 1.00 0.00 H new ATOM 1724 N LEU I 166 43.222 10.300 -0.123 1.00 0.00 N ATOM 1725 CA LEU I 166 42.547 10.463 -1.406 1.00 0.00 C ATOM 1726 C LEU I 166 43.527 10.886 -2.496 1.00 0.00 C ATOM 1727 O LEU I 166 43.665 12.072 -2.793 1.00 0.00 O ATOM 1728 CB LEU I 166 41.438 11.513 -1.285 1.00 0.00 C ATOM 1729 CG LEU I 166 41.839 12.581 -0.262 1.00 0.00 C ATOM 1730 CD1 LEU I 166 41.231 13.927 -0.665 1.00 0.00 C ATOM 1731 CD2 LEU I 166 41.321 12.184 1.122 1.00 0.00 C ATOM 0 H LEU I 166 43.215 11.130 0.469 1.00 0.00 H new ATOM 0 HA LEU I 166 42.116 9.501 -1.682 1.00 0.00 H new ATOM 0 HB2 LEU I 166 41.257 11.976 -2.255 1.00 0.00 H new ATOM 0 HB3 LEU I 166 40.506 11.037 -0.980 1.00 0.00 H new ATOM 0 HG LEU I 166 42.925 12.665 -0.233 1.00 0.00 H new ATOM 0 HD11 LEU I 166 41.516 14.687 0.062 1.00 0.00 H new ATOM 0 HD12 LEU I 166 41.599 14.212 -1.651 1.00 0.00 H new ATOM 0 HD13 LEU I 166 40.145 13.841 -0.694 1.00 0.00 H new ATOM 0 HD21 LEU I 166 41.607 12.944 1.849 1.00 0.00 H new ATOM 0 HD22 LEU I 166 40.235 12.099 1.093 1.00 0.00 H new ATOM 0 HD23 LEU I 166 41.752 11.225 1.411 1.00 0.00 H new ATOM 1743 N ASP I 167 44.196 9.906 -3.097 1.00 0.00 N ATOM 1744 CA ASP I 167 45.152 10.186 -4.164 1.00 0.00 C ATOM 1745 C ASP I 167 44.438 10.263 -5.506 1.00 0.00 C ATOM 1746 O ASP I 167 45.021 10.662 -6.514 1.00 0.00 O ATOM 1747 CB ASP I 167 46.221 9.095 -4.210 1.00 0.00 C ATOM 1748 CG ASP I 167 47.040 9.123 -2.927 1.00 0.00 C ATOM 1749 OD1 ASP I 167 47.245 10.205 -2.407 1.00 0.00 O ATOM 1750 OD2 ASP I 167 47.442 8.061 -2.479 1.00 0.00 O1- ATOM 0 H ASP I 167 44.095 8.918 -2.866 1.00 0.00 H new ATOM 0 HA ASP I 167 45.628 11.145 -3.961 1.00 0.00 H new ATOM 0 HB2 ASP I 167 45.752 8.118 -4.332 1.00 0.00 H new ATOM 0 HB3 ASP I 167 46.872 9.246 -5.071 1.00 0.00 H new ATOM 1755 N LEU I 168 43.169 9.876 -5.507 1.00 0.00 N ATOM 1756 CA LEU I 168 42.367 9.900 -6.722 1.00 0.00 C ATOM 1757 C LEU I 168 41.910 11.318 -7.040 1.00 0.00 C ATOM 1758 O LEU I 168 41.858 12.180 -6.162 1.00 0.00 O ATOM 1759 CB LEU I 168 41.148 8.985 -6.566 1.00 0.00 C ATOM 1760 CG LEU I 168 41.572 7.518 -6.706 1.00 0.00 C ATOM 1761 CD1 LEU I 168 40.500 6.618 -6.088 1.00 0.00 C ATOM 1762 CD2 LEU I 168 41.721 7.150 -8.192 1.00 0.00 C ATOM 0 H LEU I 168 42.674 9.542 -4.680 1.00 0.00 H new ATOM 0 HA LEU I 168 42.984 9.541 -7.546 1.00 0.00 H new ATOM 0 HB2 LEU I 168 40.684 9.147 -5.593 1.00 0.00 H new ATOM 0 HB3 LEU I 168 40.400 9.230 -7.321 1.00 0.00 H new ATOM 0 HG LEU I 168 42.525 7.378 -6.196 1.00 0.00 H new ATOM 0 HD11 LEU I 168 40.800 5.575 -6.187 1.00 0.00 H new ATOM 0 HD12 LEU I 168 40.383 6.864 -5.033 1.00 0.00 H new ATOM 0 HD13 LEU I 168 39.553 6.774 -6.604 1.00 0.00 H new ATOM 0 HD21 LEU I 168 42.022 6.106 -8.280 1.00 0.00 H new ATOM 0 HD22 LEU I 168 40.768 7.297 -8.700 1.00 0.00 H new ATOM 0 HD23 LEU I 168 42.478 7.786 -8.650 1.00 0.00 H new ATOM 1774 N ARG I 169 41.583 11.549 -8.306 1.00 0.00 N ATOM 1775 CA ARG I 169 41.133 12.862 -8.752 1.00 0.00 C ATOM 1776 C ARG I 169 39.848 13.254 -8.021 1.00 0.00 C ATOM 1777 O ARG I 169 39.662 14.417 -7.661 1.00 0.00 O ATOM 1778 CB ARG I 169 40.879 12.824 -10.268 1.00 0.00 C ATOM 1779 CG ARG I 169 42.185 12.543 -11.044 1.00 0.00 C ATOM 1780 CD ARG I 169 43.119 13.767 -11.051 1.00 0.00 C ATOM 1781 NE ARG I 169 44.320 13.474 -11.831 1.00 0.00 N ATOM 1782 CZ ARG I 169 45.390 12.921 -11.261 1.00 0.00 C ATOM 1783 NH1 ARG I 169 45.377 12.626 -9.989 1.00 0.00 N ATOM 1784 NH2 ARG I 169 46.453 12.670 -11.973 1.00 0.00 N1+ ATOM 0 H ARG I 169 41.621 10.844 -9.042 1.00 0.00 H new ATOM 0 HA ARG I 169 41.903 13.601 -8.529 1.00 0.00 H new ATOM 0 HB2 ARG I 169 40.143 12.053 -10.497 1.00 0.00 H new ATOM 0 HB3 ARG I 169 40.457 13.775 -10.593 1.00 0.00 H new ATOM 0 HG2 ARG I 169 42.700 11.695 -10.594 1.00 0.00 H new ATOM 0 HG3 ARG I 169 41.945 12.262 -12.070 1.00 0.00 H new ATOM 0 HD2 ARG I 169 42.601 14.628 -11.474 1.00 0.00 H new ATOM 0 HD3 ARG I 169 43.394 14.031 -10.030 1.00 0.00 H new ATOM 0 HE ARG I 169 44.339 13.696 -12.826 1.00 0.00 H new ATOM 0 HH11 ARG I 169 44.546 12.819 -9.429 1.00 0.00 H new ATOM 0 HH12 ARG I 169 46.197 12.203 -9.555 1.00 0.00 H new ATOM 0 HH21 ARG I 169 46.466 12.897 -12.967 1.00 0.00 H new ATOM 0 HH22 ARG I 169 47.272 12.247 -11.536 1.00 0.00 H new ATOM 1798 N ALA I 170 38.972 12.273 -7.805 1.00 0.00 N ATOM 1799 CA ALA I 170 37.708 12.511 -7.111 1.00 0.00 C ATOM 1800 C ALA I 170 37.881 13.534 -5.990 1.00 0.00 C ATOM 1801 O ALA I 170 37.390 14.641 -6.143 1.00 0.00 O ATOM 1802 CB ALA I 170 37.185 11.201 -6.520 1.00 0.00 C ATOM 1803 OXT ALA I 170 38.502 13.194 -4.995 1.00 0.00 O ATOM 0 H ALA I 170 39.115 11.307 -8.100 1.00 0.00 H new ATOM 0 HA ALA I 170 36.994 12.903 -7.835 1.00 0.00 H new ATOM 0 HB1 ALA I 170 36.243 11.385 -6.004 1.00 0.00 H new ATOM 0 HB2 ALA I 170 37.025 10.479 -7.321 1.00 0.00 H new ATOM 0 HB3 ALA I 170 37.914 10.804 -5.813 1.00 0.00 H new TER 1809 ALA I 170 HETATM 1810 CA CA C 101 20.121 17.263 14.715 1.00 0.00 CA