USER MOD reduce.3.24.130724 H: found=0, std=0, add=786, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 785 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 11 HIS : no HD1:sc= 0.0936 K(o=0.094,f=-2) USER MOD Set 1.2: A 75 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 38 SER OG : rot 140:sc= 0.509 USER MOD Set 2.2: A 49 LYS NZ :NH3+ -171:sc= 0.56 (180deg=0) USER MOD Single : A 1 SER N :NH3+ -104:sc= 0.031 (180deg=0) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 7 SER OG : rot 180:sc= 0.0146 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 10 ASN : amide:sc= -0.0486 K(o=-0.049,f=-3.5!) USER MOD Single : A 20 ASN : amide:sc= 0 K(o=0,f=-0.59) USER MOD Single : A 24 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 THR OG1 : rot -73:sc= 0.854 USER MOD Single : A 26 ASN : amide:sc= -0.0231 K(o=-0.023,f=-1) USER MOD Single : A 27 SER OG : rot 110:sc= 0.102 USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 31 GLN : amide:sc= -0.0804 X(o=-0.08,f=-0.08) USER MOD Single : A 36 MET CE :methyl 179:sc= -0.252 (180deg=-0.254) USER MOD Single : A 39 THR OG1 : rot -78:sc= 1.09 USER MOD Single : A 52 SER OG : rot 76:sc= 0.596 USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 SER OG : rot 180:sc= 0.179 USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 MET CE :methyl -174:sc= 0 (180deg=-0.038) USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 85 SER OG : rot 180:sc=0.000995 USER MOD Single : A 86 GLN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : A 87 GLN : amide:sc= 0.858 K(o=0.86,f=-5.4!) USER MOD Single : A 90 ASN : amide:sc= 0 K(o=0,f=-0.61) USER MOD Single : A 97 SER OG : rot 82:sc= 1.17 USER MOD Single : A 99 SER OG : rot 125:sc= 1.26 USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 GLN : amide:sc= 0.771 K(o=0.77,f=0) USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 5.125 -15.238 -8.228 1.00 0.00 N ATOM 2 CA SER A 1 5.920 -13.983 -8.112 1.00 0.00 C ATOM 3 C SER A 1 6.792 -13.970 -6.849 1.00 0.00 C ATOM 4 O SER A 1 6.450 -14.611 -5.856 1.00 0.00 O ATOM 5 CB SER A 1 5.010 -12.744 -8.149 1.00 0.00 C ATOM 6 OG SER A 1 4.217 -12.776 -9.328 1.00 0.00 O ATOM 0 H1 SER A 1 5.556 -15.857 -8.944 1.00 0.00 H new ATOM 0 H2 SER A 1 5.112 -15.727 -7.310 1.00 0.00 H new ATOM 0 H3 SER A 1 4.151 -15.007 -8.511 1.00 0.00 H new ATOM 0 HA SER A 1 6.586 -13.950 -8.974 1.00 0.00 H new ATOM 0 HB2 SER A 1 4.370 -12.723 -7.267 1.00 0.00 H new ATOM 0 HB3 SER A 1 5.612 -11.836 -8.127 1.00 0.00 H new ATOM 0 HG SER A 1 3.635 -11.988 -9.352 1.00 0.00 H new ATOM 14 N VAL A 2 7.918 -13.238 -6.875 1.00 0.00 N ATOM 15 CA VAL A 2 8.929 -13.191 -5.782 1.00 0.00 C ATOM 16 C VAL A 2 9.111 -11.800 -5.140 1.00 0.00 C ATOM 17 O VAL A 2 10.019 -11.602 -4.330 1.00 0.00 O ATOM 18 CB VAL A 2 10.283 -13.790 -6.239 1.00 0.00 C ATOM 19 CG1 VAL A 2 10.139 -15.260 -6.648 1.00 0.00 C ATOM 20 CG2 VAL A 2 10.920 -13.018 -7.402 1.00 0.00 C ATOM 0 H VAL A 2 8.165 -12.647 -7.669 1.00 0.00 H new ATOM 0 HA VAL A 2 8.523 -13.818 -4.988 1.00 0.00 H new ATOM 0 HB VAL A 2 10.939 -13.708 -5.372 1.00 0.00 H new ATOM 0 HG11 VAL A 2 11.108 -15.647 -6.963 1.00 0.00 H new ATOM 0 HG12 VAL A 2 9.775 -15.840 -5.800 1.00 0.00 H new ATOM 0 HG13 VAL A 2 9.431 -15.340 -7.473 1.00 0.00 H new ATOM 0 HG21 VAL A 2 11.865 -13.487 -7.675 1.00 0.00 H new ATOM 0 HG22 VAL A 2 10.247 -13.031 -8.259 1.00 0.00 H new ATOM 0 HG23 VAL A 2 11.101 -11.987 -7.098 1.00 0.00 H new ATOM 30 N SER A 3 8.259 -10.828 -5.487 1.00 0.00 N ATOM 31 CA SER A 3 8.349 -9.432 -5.020 1.00 0.00 C ATOM 32 C SER A 3 8.191 -9.303 -3.496 1.00 0.00 C ATOM 33 O SER A 3 7.322 -9.940 -2.896 1.00 0.00 O ATOM 34 CB SER A 3 7.289 -8.568 -5.718 1.00 0.00 C ATOM 35 OG SER A 3 7.384 -8.710 -7.130 1.00 0.00 O ATOM 0 H SER A 3 7.470 -10.989 -6.113 1.00 0.00 H new ATOM 0 HA SER A 3 9.348 -9.081 -5.277 1.00 0.00 H new ATOM 0 HB2 SER A 3 6.294 -8.861 -5.383 1.00 0.00 H new ATOM 0 HB3 SER A 3 7.424 -7.522 -5.442 1.00 0.00 H new ATOM 0 HG SER A 3 6.701 -8.155 -7.561 1.00 0.00 H new ATOM 41 N ILE A 4 9.007 -8.444 -2.869 1.00 0.00 N ATOM 42 CA ILE A 4 9.029 -8.254 -1.400 1.00 0.00 C ATOM 43 C ILE A 4 7.846 -7.431 -0.853 1.00 0.00 C ATOM 44 O ILE A 4 7.548 -7.501 0.340 1.00 0.00 O ATOM 45 CB ILE A 4 10.389 -7.706 -0.901 1.00 0.00 C ATOM 46 CG1 ILE A 4 10.659 -6.204 -1.161 1.00 0.00 C ATOM 47 CG2 ILE A 4 11.560 -8.579 -1.392 1.00 0.00 C ATOM 48 CD1 ILE A 4 10.674 -5.727 -2.620 1.00 0.00 C ATOM 0 H ILE A 4 9.677 -7.855 -3.364 1.00 0.00 H new ATOM 0 HA ILE A 4 8.903 -9.254 -0.986 1.00 0.00 H new ATOM 0 HB ILE A 4 10.313 -7.773 0.184 1.00 0.00 H new ATOM 0 HG12 ILE A 4 9.902 -5.629 -0.627 1.00 0.00 H new ATOM 0 HG13 ILE A 4 11.622 -5.954 -0.716 1.00 0.00 H new ATOM 0 HG21 ILE A 4 12.500 -8.167 -1.025 1.00 0.00 H new ATOM 0 HG22 ILE A 4 11.438 -9.595 -1.018 1.00 0.00 H new ATOM 0 HG23 ILE A 4 11.571 -8.593 -2.482 1.00 0.00 H new ATOM 0 HD11 ILE A 4 10.874 -4.656 -2.651 1.00 0.00 H new ATOM 0 HD12 ILE A 4 11.452 -6.258 -3.168 1.00 0.00 H new ATOM 0 HD13 ILE A 4 9.706 -5.928 -3.079 1.00 0.00 H new ATOM 60 N LEU A 5 7.157 -6.683 -1.723 1.00 0.00 N ATOM 61 CA LEU A 5 5.923 -5.931 -1.445 1.00 0.00 C ATOM 62 C LEU A 5 4.948 -6.060 -2.629 1.00 0.00 C ATOM 63 O LEU A 5 5.382 -6.150 -3.780 1.00 0.00 O ATOM 64 CB LEU A 5 6.259 -4.438 -1.216 1.00 0.00 C ATOM 65 CG LEU A 5 7.034 -4.098 0.070 1.00 0.00 C ATOM 66 CD1 LEU A 5 7.434 -2.622 0.049 1.00 0.00 C ATOM 67 CD2 LEU A 5 6.204 -4.349 1.330 1.00 0.00 C ATOM 0 H LEU A 5 7.459 -6.579 -2.692 1.00 0.00 H new ATOM 0 HA LEU A 5 5.456 -6.340 -0.549 1.00 0.00 H new ATOM 0 HB2 LEU A 5 6.840 -4.084 -2.068 1.00 0.00 H new ATOM 0 HB3 LEU A 5 5.326 -3.875 -1.211 1.00 0.00 H new ATOM 0 HG LEU A 5 7.910 -4.746 0.098 1.00 0.00 H new ATOM 0 HD11 LEU A 5 7.983 -2.381 0.959 1.00 0.00 H new ATOM 0 HD12 LEU A 5 8.066 -2.429 -0.818 1.00 0.00 H new ATOM 0 HD13 LEU A 5 6.539 -2.003 -0.010 1.00 0.00 H new ATOM 0 HD21 LEU A 5 6.794 -4.095 2.211 1.00 0.00 H new ATOM 0 HD22 LEU A 5 5.306 -3.731 1.303 1.00 0.00 H new ATOM 0 HD23 LEU A 5 5.920 -5.400 1.375 1.00 0.00 H new ATOM 79 N ARG A 6 3.634 -5.962 -2.375 1.00 0.00 N ATOM 80 CA ARG A 6 2.594 -5.927 -3.436 1.00 0.00 C ATOM 81 C ARG A 6 2.677 -4.666 -4.311 1.00 0.00 C ATOM 82 O ARG A 6 2.293 -4.691 -5.479 1.00 0.00 O ATOM 83 CB ARG A 6 1.192 -6.067 -2.811 1.00 0.00 C ATOM 84 CG ARG A 6 0.976 -7.454 -2.178 1.00 0.00 C ATOM 85 CD ARG A 6 -0.464 -7.643 -1.674 1.00 0.00 C ATOM 86 NE ARG A 6 -0.798 -6.726 -0.561 1.00 0.00 N ATOM 87 CZ ARG A 6 -0.595 -6.918 0.733 1.00 0.00 C ATOM 88 NH1 ARG A 6 -0.032 -7.997 1.201 1.00 0.00 N ATOM 89 NH2 ARG A 6 -0.964 -6.013 1.593 1.00 0.00 N ATOM 0 H ARG A 6 3.254 -5.904 -1.430 1.00 0.00 H new ATOM 0 HA ARG A 6 2.781 -6.774 -4.096 1.00 0.00 H new ATOM 0 HB2 ARG A 6 1.056 -5.297 -2.052 1.00 0.00 H new ATOM 0 HB3 ARG A 6 0.435 -5.897 -3.577 1.00 0.00 H new ATOM 0 HG2 ARG A 6 1.207 -8.226 -2.912 1.00 0.00 H new ATOM 0 HG3 ARG A 6 1.670 -7.585 -1.348 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -1.159 -7.478 -2.498 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -0.598 -8.673 -1.345 1.00 0.00 H new ATOM 0 HE ARG A 6 -1.236 -5.842 -0.822 1.00 0.00 H new ATOM 0 HH11 ARG A 6 0.270 -8.733 0.562 1.00 0.00 H new ATOM 0 HH12 ARG A 6 0.106 -8.106 2.206 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -1.410 -5.155 1.270 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -0.807 -6.162 2.590 1.00 0.00 H new ATOM 103 N SER A 7 3.250 -3.591 -3.764 1.00 0.00 N ATOM 104 CA SER A 7 3.595 -2.337 -4.453 1.00 0.00 C ATOM 105 C SER A 7 4.929 -2.384 -5.226 1.00 0.00 C ATOM 106 O SER A 7 5.315 -1.384 -5.832 1.00 0.00 O ATOM 107 CB SER A 7 3.613 -1.204 -3.422 1.00 0.00 C ATOM 108 OG SER A 7 4.517 -1.530 -2.376 1.00 0.00 O ATOM 0 H SER A 7 3.501 -3.567 -2.776 1.00 0.00 H new ATOM 0 HA SER A 7 2.832 -2.167 -5.213 1.00 0.00 H new ATOM 0 HB2 SER A 7 3.912 -0.270 -3.898 1.00 0.00 H new ATOM 0 HB3 SER A 7 2.613 -1.050 -3.018 1.00 0.00 H new ATOM 0 HG SER A 7 4.530 -0.805 -1.717 1.00 0.00 H new ATOM 114 N SER A 8 5.624 -3.534 -5.237 1.00 0.00 N ATOM 115 CA SER A 8 6.919 -3.819 -5.887 1.00 0.00 C ATOM 116 C SER A 8 8.147 -3.061 -5.342 1.00 0.00 C ATOM 117 O SER A 8 9.220 -3.654 -5.195 1.00 0.00 O ATOM 118 CB SER A 8 6.785 -3.666 -7.409 1.00 0.00 C ATOM 119 OG SER A 8 7.903 -4.239 -8.069 1.00 0.00 O ATOM 0 H SER A 8 5.267 -4.357 -4.752 1.00 0.00 H new ATOM 0 HA SER A 8 7.141 -4.854 -5.626 1.00 0.00 H new ATOM 0 HB2 SER A 8 5.869 -4.148 -7.749 1.00 0.00 H new ATOM 0 HB3 SER A 8 6.705 -2.610 -7.668 1.00 0.00 H new ATOM 0 HG SER A 8 7.800 -4.134 -9.038 1.00 0.00 H new ATOM 125 N VAL A 9 8.007 -1.776 -4.994 1.00 0.00 N ATOM 126 CA VAL A 9 9.090 -0.878 -4.548 1.00 0.00 C ATOM 127 C VAL A 9 8.668 -0.117 -3.286 1.00 0.00 C ATOM 128 O VAL A 9 7.529 0.329 -3.183 1.00 0.00 O ATOM 129 CB VAL A 9 9.477 0.096 -5.684 1.00 0.00 C ATOM 130 CG1 VAL A 9 10.551 1.115 -5.275 1.00 0.00 C ATOM 131 CG2 VAL A 9 10.024 -0.667 -6.902 1.00 0.00 C ATOM 0 H VAL A 9 7.100 -1.310 -5.015 1.00 0.00 H new ATOM 0 HA VAL A 9 9.967 -1.477 -4.301 1.00 0.00 H new ATOM 0 HB VAL A 9 8.555 0.626 -5.924 1.00 0.00 H new ATOM 0 HG11 VAL A 9 10.775 1.767 -6.120 1.00 0.00 H new ATOM 0 HG12 VAL A 9 10.185 1.714 -4.441 1.00 0.00 H new ATOM 0 HG13 VAL A 9 11.456 0.588 -4.974 1.00 0.00 H new ATOM 0 HG21 VAL A 9 10.289 0.042 -7.687 1.00 0.00 H new ATOM 0 HG22 VAL A 9 10.909 -1.232 -6.610 1.00 0.00 H new ATOM 0 HG23 VAL A 9 9.262 -1.352 -7.274 1.00 0.00 H new ATOM 141 N ASN A 10 9.580 0.048 -2.325 1.00 0.00 N ATOM 142 CA ASN A 10 9.363 0.805 -1.086 1.00 0.00 C ATOM 143 C ASN A 10 9.738 2.295 -1.258 1.00 0.00 C ATOM 144 O ASN A 10 10.646 2.628 -2.017 1.00 0.00 O ATOM 145 CB ASN A 10 10.159 0.098 0.038 1.00 0.00 C ATOM 146 CG ASN A 10 9.785 0.527 1.450 1.00 0.00 C ATOM 147 OD1 ASN A 10 8.932 1.370 1.674 1.00 0.00 O ATOM 148 ND2 ASN A 10 10.432 -0.024 2.451 1.00 0.00 N ATOM 0 H ASN A 10 10.516 -0.352 -2.387 1.00 0.00 H new ATOM 0 HA ASN A 10 8.306 0.815 -0.818 1.00 0.00 H new ATOM 0 HB2 ASN A 10 10.010 -0.978 -0.052 1.00 0.00 H new ATOM 0 HB3 ASN A 10 11.222 0.286 -0.115 1.00 0.00 H new ATOM 0 HD21 ASN A 10 10.220 0.253 3.409 1.00 0.00 H new ATOM 0 HD22 ASN A 10 11.146 -0.729 2.270 1.00 0.00 H new ATOM 155 N HIS A 11 9.120 3.216 -0.505 1.00 0.00 N ATOM 156 CA HIS A 11 9.475 4.649 -0.553 1.00 0.00 C ATOM 157 C HIS A 11 10.907 4.926 -0.059 1.00 0.00 C ATOM 158 O HIS A 11 11.564 5.837 -0.561 1.00 0.00 O ATOM 159 CB HIS A 11 8.424 5.477 0.203 1.00 0.00 C ATOM 160 CG HIS A 11 8.383 5.242 1.693 1.00 0.00 C ATOM 161 ND1 HIS A 11 9.309 5.742 2.607 1.00 0.00 N ATOM 162 CD2 HIS A 11 7.441 4.523 2.366 1.00 0.00 C ATOM 163 CE1 HIS A 11 8.906 5.309 3.813 1.00 0.00 C ATOM 164 NE2 HIS A 11 7.788 4.575 3.698 1.00 0.00 N ATOM 0 H HIS A 11 8.368 2.997 0.148 1.00 0.00 H new ATOM 0 HA HIS A 11 9.468 4.960 -1.598 1.00 0.00 H new ATOM 0 HB2 HIS A 11 8.616 6.534 0.022 1.00 0.00 H new ATOM 0 HB3 HIS A 11 7.441 5.256 -0.212 1.00 0.00 H new ATOM 0 HD2 HIS A 11 6.590 4.013 1.939 1.00 0.00 H new ATOM 0 HE1 HIS A 11 9.410 5.521 4.744 1.00 0.00 H new ATOM 0 HE2 HIS A 11 7.282 4.132 4.465 1.00 0.00 H new ATOM 172 N ARG A 12 11.451 4.067 0.811 1.00 0.00 N ATOM 173 CA ARG A 12 12.876 4.093 1.199 1.00 0.00 C ATOM 174 C ARG A 12 13.830 3.787 0.041 1.00 0.00 C ATOM 175 O ARG A 12 14.951 4.273 0.048 1.00 0.00 O ATOM 176 CB ARG A 12 13.131 3.130 2.369 1.00 0.00 C ATOM 177 CG ARG A 12 12.451 3.618 3.661 1.00 0.00 C ATOM 178 CD ARG A 12 12.775 2.697 4.841 1.00 0.00 C ATOM 179 NE ARG A 12 12.170 3.218 6.080 1.00 0.00 N ATOM 180 CZ ARG A 12 12.082 2.632 7.256 1.00 0.00 C ATOM 181 NH1 ARG A 12 12.542 1.434 7.492 1.00 0.00 N ATOM 182 NH2 ARG A 12 11.505 3.283 8.219 1.00 0.00 N ATOM 0 H ARG A 12 10.917 3.329 1.271 1.00 0.00 H new ATOM 0 HA ARG A 12 13.089 5.115 1.511 1.00 0.00 H new ATOM 0 HB2 ARG A 12 12.758 2.138 2.113 1.00 0.00 H new ATOM 0 HB3 ARG A 12 14.204 3.034 2.535 1.00 0.00 H new ATOM 0 HG2 ARG A 12 12.780 4.632 3.887 1.00 0.00 H new ATOM 0 HG3 ARG A 12 11.372 3.658 3.514 1.00 0.00 H new ATOM 0 HD2 ARG A 12 12.401 1.693 4.640 1.00 0.00 H new ATOM 0 HD3 ARG A 12 13.855 2.617 4.962 1.00 0.00 H new ATOM 0 HE ARG A 12 11.768 4.153 6.019 1.00 0.00 H new ATOM 0 HH11 ARG A 12 12.996 0.906 6.747 1.00 0.00 H new ATOM 0 HH12 ARG A 12 12.448 1.026 8.422 1.00 0.00 H new ATOM 0 HH21 ARG A 12 11.136 4.219 8.052 1.00 0.00 H new ATOM 0 HH22 ARG A 12 11.420 2.858 9.142 1.00 0.00 H new ATOM 196 N GLU A 13 13.392 3.056 -0.982 1.00 0.00 N ATOM 197 CA GLU A 13 14.185 2.856 -2.208 1.00 0.00 C ATOM 198 C GLU A 13 14.215 4.129 -3.075 1.00 0.00 C ATOM 199 O GLU A 13 15.249 4.451 -3.655 1.00 0.00 O ATOM 200 CB GLU A 13 13.677 1.649 -3.008 1.00 0.00 C ATOM 201 CG GLU A 13 13.853 0.336 -2.236 1.00 0.00 C ATOM 202 CD GLU A 13 13.277 -0.847 -3.029 1.00 0.00 C ATOM 203 OE1 GLU A 13 14.004 -1.432 -3.870 1.00 0.00 O ATOM 204 OE2 GLU A 13 12.096 -1.203 -2.802 1.00 0.00 O ATOM 0 H GLU A 13 12.487 2.587 -0.992 1.00 0.00 H new ATOM 0 HA GLU A 13 15.210 2.644 -1.904 1.00 0.00 H new ATOM 0 HB2 GLU A 13 12.623 1.790 -3.248 1.00 0.00 H new ATOM 0 HB3 GLU A 13 14.214 1.589 -3.954 1.00 0.00 H new ATOM 0 HG2 GLU A 13 14.911 0.165 -2.037 1.00 0.00 H new ATOM 0 HG3 GLU A 13 13.355 0.408 -1.269 1.00 0.00 H new ATOM 211 N VAL A 14 13.124 4.909 -3.094 1.00 0.00 N ATOM 212 CA VAL A 14 13.096 6.253 -3.713 1.00 0.00 C ATOM 213 C VAL A 14 14.009 7.226 -2.945 1.00 0.00 C ATOM 214 O VAL A 14 14.765 7.991 -3.545 1.00 0.00 O ATOM 215 CB VAL A 14 11.648 6.783 -3.809 1.00 0.00 C ATOM 216 CG1 VAL A 14 11.548 8.120 -4.551 1.00 0.00 C ATOM 217 CG2 VAL A 14 10.722 5.797 -4.543 1.00 0.00 C ATOM 0 H VAL A 14 12.233 4.631 -2.682 1.00 0.00 H new ATOM 0 HA VAL A 14 13.483 6.173 -4.729 1.00 0.00 H new ATOM 0 HB VAL A 14 11.336 6.911 -2.772 1.00 0.00 H new ATOM 0 HG11 VAL A 14 10.507 8.440 -4.585 1.00 0.00 H new ATOM 0 HG12 VAL A 14 12.141 8.871 -4.029 1.00 0.00 H new ATOM 0 HG13 VAL A 14 11.925 8.001 -5.567 1.00 0.00 H new ATOM 0 HG21 VAL A 14 9.714 6.209 -4.588 1.00 0.00 H new ATOM 0 HG22 VAL A 14 11.093 5.634 -5.555 1.00 0.00 H new ATOM 0 HG23 VAL A 14 10.702 4.848 -4.007 1.00 0.00 H new ATOM 227 N ASP A 15 14.008 7.160 -1.610 1.00 0.00 N ATOM 228 CA ASP A 15 14.931 7.939 -0.773 1.00 0.00 C ATOM 229 C ASP A 15 16.408 7.522 -0.939 1.00 0.00 C ATOM 230 O ASP A 15 17.295 8.370 -1.056 1.00 0.00 O ATOM 231 CB ASP A 15 14.504 7.807 0.686 1.00 0.00 C ATOM 232 CG ASP A 15 15.149 8.909 1.536 1.00 0.00 C ATOM 233 OD1 ASP A 15 14.815 10.100 1.309 1.00 0.00 O ATOM 234 OD2 ASP A 15 15.931 8.593 2.457 1.00 0.00 O ATOM 0 H ASP A 15 13.370 6.567 -1.079 1.00 0.00 H new ATOM 0 HA ASP A 15 14.874 8.977 -1.100 1.00 0.00 H new ATOM 0 HB2 ASP A 15 13.418 7.870 0.761 1.00 0.00 H new ATOM 0 HB3 ASP A 15 14.793 6.828 1.069 1.00 0.00 H new ATOM 239 N GLU A 16 16.677 6.217 -1.031 1.00 0.00 N ATOM 240 CA GLU A 16 17.994 5.683 -1.390 1.00 0.00 C ATOM 241 C GLU A 16 18.429 6.142 -2.789 1.00 0.00 C ATOM 242 O GLU A 16 19.597 6.477 -2.976 1.00 0.00 O ATOM 243 CB GLU A 16 17.965 4.148 -1.311 1.00 0.00 C ATOM 244 CG GLU A 16 19.248 3.465 -1.812 1.00 0.00 C ATOM 245 CD GLU A 16 20.515 3.835 -1.009 1.00 0.00 C ATOM 246 OE1 GLU A 16 20.423 4.128 0.208 1.00 0.00 O ATOM 247 OE2 GLU A 16 21.632 3.780 -1.583 1.00 0.00 O ATOM 0 H GLU A 16 15.979 5.494 -0.857 1.00 0.00 H new ATOM 0 HA GLU A 16 18.726 6.070 -0.681 1.00 0.00 H new ATOM 0 HB2 GLU A 16 17.790 3.852 -0.277 1.00 0.00 H new ATOM 0 HB3 GLU A 16 17.120 3.782 -1.895 1.00 0.00 H new ATOM 0 HG2 GLU A 16 19.110 2.384 -1.774 1.00 0.00 H new ATOM 0 HG3 GLU A 16 19.403 3.730 -2.858 1.00 0.00 H new ATOM 254 N ALA A 17 17.519 6.210 -3.764 1.00 0.00 N ATOM 255 CA ALA A 17 17.830 6.735 -5.089 1.00 0.00 C ATOM 256 C ALA A 17 18.198 8.232 -5.028 1.00 0.00 C ATOM 257 O ALA A 17 19.162 8.647 -5.672 1.00 0.00 O ATOM 258 CB ALA A 17 16.662 6.460 -6.040 1.00 0.00 C ATOM 0 H ALA A 17 16.552 5.904 -3.655 1.00 0.00 H new ATOM 0 HA ALA A 17 18.709 6.221 -5.478 1.00 0.00 H new ATOM 0 HB1 ALA A 17 16.898 6.853 -7.029 1.00 0.00 H new ATOM 0 HB2 ALA A 17 16.493 5.385 -6.108 1.00 0.00 H new ATOM 0 HB3 ALA A 17 15.762 6.945 -5.661 1.00 0.00 H new ATOM 264 N ILE A 18 17.501 9.030 -4.202 1.00 0.00 N ATOM 265 CA ILE A 18 17.903 10.419 -3.895 1.00 0.00 C ATOM 266 C ILE A 18 19.330 10.469 -3.320 1.00 0.00 C ATOM 267 O ILE A 18 20.144 11.250 -3.813 1.00 0.00 O ATOM 268 CB ILE A 18 16.862 11.107 -2.974 1.00 0.00 C ATOM 269 CG1 ILE A 18 15.613 11.470 -3.805 1.00 0.00 C ATOM 270 CG2 ILE A 18 17.421 12.358 -2.263 1.00 0.00 C ATOM 271 CD1 ILE A 18 14.381 11.800 -2.955 1.00 0.00 C ATOM 0 H ILE A 18 16.647 8.735 -3.729 1.00 0.00 H new ATOM 0 HA ILE A 18 17.923 10.987 -4.825 1.00 0.00 H new ATOM 0 HB ILE A 18 16.599 10.401 -2.186 1.00 0.00 H new ATOM 0 HG12 ILE A 18 15.846 12.326 -4.439 1.00 0.00 H new ATOM 0 HG13 ILE A 18 15.374 10.638 -4.467 1.00 0.00 H new ATOM 0 HG21 ILE A 18 16.646 12.795 -1.633 1.00 0.00 H new ATOM 0 HG22 ILE A 18 18.274 12.075 -1.646 1.00 0.00 H new ATOM 0 HG23 ILE A 18 17.738 13.088 -3.007 1.00 0.00 H new ATOM 0 HD11 ILE A 18 13.543 12.045 -3.608 1.00 0.00 H new ATOM 0 HD12 ILE A 18 14.122 10.938 -2.340 1.00 0.00 H new ATOM 0 HD13 ILE A 18 14.601 12.652 -2.311 1.00 0.00 H new ATOM 283 N ASP A 19 19.679 9.629 -2.342 1.00 0.00 N ATOM 284 CA ASP A 19 21.044 9.572 -1.795 1.00 0.00 C ATOM 285 C ASP A 19 22.094 9.074 -2.808 1.00 0.00 C ATOM 286 O ASP A 19 23.213 9.590 -2.834 1.00 0.00 O ATOM 287 CB ASP A 19 21.068 8.708 -0.529 1.00 0.00 C ATOM 288 CG ASP A 19 20.546 9.496 0.679 1.00 0.00 C ATOM 289 OD1 ASP A 19 21.197 10.485 1.084 1.00 0.00 O ATOM 290 OD2 ASP A 19 19.468 9.173 1.225 1.00 0.00 O ATOM 0 H ASP A 19 19.031 8.972 -1.907 1.00 0.00 H new ATOM 0 HA ASP A 19 21.323 10.597 -1.550 1.00 0.00 H new ATOM 0 HB2 ASP A 19 20.457 7.818 -0.679 1.00 0.00 H new ATOM 0 HB3 ASP A 19 22.085 8.368 -0.335 1.00 0.00 H new ATOM 295 N ASN A 20 21.747 8.124 -3.681 1.00 0.00 N ATOM 296 CA ASN A 20 22.625 7.650 -4.754 1.00 0.00 C ATOM 297 C ASN A 20 22.930 8.777 -5.757 1.00 0.00 C ATOM 298 O ASN A 20 24.090 9.010 -6.087 1.00 0.00 O ATOM 299 CB ASN A 20 21.968 6.423 -5.418 1.00 0.00 C ATOM 300 CG ASN A 20 22.866 5.695 -6.408 1.00 0.00 C ATOM 301 OD1 ASN A 20 24.071 5.889 -6.481 1.00 0.00 O ATOM 302 ND2 ASN A 20 22.305 4.806 -7.198 1.00 0.00 N ATOM 0 H ASN A 20 20.840 7.658 -3.662 1.00 0.00 H new ATOM 0 HA ASN A 20 23.589 7.347 -4.346 1.00 0.00 H new ATOM 0 HB2 ASN A 20 21.661 5.724 -4.640 1.00 0.00 H new ATOM 0 HB3 ASN A 20 21.063 6.744 -5.933 1.00 0.00 H new ATOM 0 HD21 ASN A 20 22.874 4.285 -7.865 1.00 0.00 H new ATOM 0 HD22 ASN A 20 21.300 4.638 -7.144 1.00 0.00 H new ATOM 309 N ILE A 21 21.912 9.550 -6.161 1.00 0.00 N ATOM 310 CA ILE A 21 22.091 10.751 -6.997 1.00 0.00 C ATOM 311 C ILE A 21 22.932 11.806 -6.271 1.00 0.00 C ATOM 312 O ILE A 21 23.858 12.361 -6.863 1.00 0.00 O ATOM 313 CB ILE A 21 20.714 11.304 -7.434 1.00 0.00 C ATOM 314 CG1 ILE A 21 20.080 10.367 -8.486 1.00 0.00 C ATOM 315 CG2 ILE A 21 20.861 12.722 -8.013 1.00 0.00 C ATOM 316 CD1 ILE A 21 18.558 10.540 -8.595 1.00 0.00 C ATOM 0 H ILE A 21 20.939 9.362 -5.918 1.00 0.00 H new ATOM 0 HA ILE A 21 22.640 10.476 -7.897 1.00 0.00 H new ATOM 0 HB ILE A 21 20.065 11.352 -6.560 1.00 0.00 H new ATOM 0 HG12 ILE A 21 20.534 10.560 -9.458 1.00 0.00 H new ATOM 0 HG13 ILE A 21 20.306 9.332 -8.228 1.00 0.00 H new ATOM 0 HG21 ILE A 21 19.882 13.095 -8.315 1.00 0.00 H new ATOM 0 HG22 ILE A 21 21.283 13.382 -7.255 1.00 0.00 H new ATOM 0 HG23 ILE A 21 21.522 12.695 -8.879 1.00 0.00 H new ATOM 0 HD11 ILE A 21 18.167 9.857 -9.349 1.00 0.00 H new ATOM 0 HD12 ILE A 21 18.097 10.320 -7.632 1.00 0.00 H new ATOM 0 HD13 ILE A 21 18.328 11.566 -8.881 1.00 0.00 H new ATOM 328 N LEU A 22 22.657 12.060 -4.992 1.00 0.00 N ATOM 329 CA LEU A 22 23.400 13.022 -4.174 1.00 0.00 C ATOM 330 C LEU A 22 24.902 12.675 -4.099 1.00 0.00 C ATOM 331 O LEU A 22 25.754 13.552 -4.257 1.00 0.00 O ATOM 332 CB LEU A 22 22.729 13.039 -2.786 1.00 0.00 C ATOM 333 CG LEU A 22 23.248 14.104 -1.813 1.00 0.00 C ATOM 334 CD1 LEU A 22 22.862 15.510 -2.271 1.00 0.00 C ATOM 335 CD2 LEU A 22 22.647 13.852 -0.430 1.00 0.00 C ATOM 0 H LEU A 22 21.901 11.597 -4.487 1.00 0.00 H new ATOM 0 HA LEU A 22 23.365 14.016 -4.620 1.00 0.00 H new ATOM 0 HB2 LEU A 22 21.658 13.188 -2.922 1.00 0.00 H new ATOM 0 HB3 LEU A 22 22.859 12.059 -2.327 1.00 0.00 H new ATOM 0 HG LEU A 22 24.335 14.037 -1.780 1.00 0.00 H new ATOM 0 HD11 LEU A 22 23.245 16.242 -1.560 1.00 0.00 H new ATOM 0 HD12 LEU A 22 23.289 15.702 -3.255 1.00 0.00 H new ATOM 0 HD13 LEU A 22 21.776 15.590 -2.325 1.00 0.00 H new ATOM 0 HD21 LEU A 22 23.012 14.606 0.268 1.00 0.00 H new ATOM 0 HD22 LEU A 22 21.560 13.908 -0.490 1.00 0.00 H new ATOM 0 HD23 LEU A 22 22.940 12.862 -0.081 1.00 0.00 H new ATOM 347 N ARG A 23 25.236 11.385 -3.934 1.00 0.00 N ATOM 348 CA ARG A 23 26.624 10.884 -3.938 1.00 0.00 C ATOM 349 C ARG A 23 27.255 10.866 -5.333 1.00 0.00 C ATOM 350 O ARG A 23 28.430 11.201 -5.451 1.00 0.00 O ATOM 351 CB ARG A 23 26.657 9.492 -3.261 1.00 0.00 C ATOM 352 CG ARG A 23 28.039 8.812 -3.263 1.00 0.00 C ATOM 353 CD ARG A 23 29.144 9.636 -2.588 1.00 0.00 C ATOM 354 NE ARG A 23 30.473 9.028 -2.803 1.00 0.00 N ATOM 355 CZ ARG A 23 31.290 9.209 -3.827 1.00 0.00 C ATOM 356 NH1 ARG A 23 30.988 9.956 -4.857 1.00 0.00 N ATOM 357 NH2 ARG A 23 32.453 8.622 -3.840 1.00 0.00 N ATOM 0 H ARG A 23 24.543 10.650 -3.792 1.00 0.00 H new ATOM 0 HA ARG A 23 27.240 11.578 -3.366 1.00 0.00 H new ATOM 0 HB2 ARG A 23 26.319 9.596 -2.230 1.00 0.00 H new ATOM 0 HB3 ARG A 23 25.945 8.840 -3.766 1.00 0.00 H new ATOM 0 HG2 ARG A 23 27.959 7.849 -2.758 1.00 0.00 H new ATOM 0 HG3 ARG A 23 28.330 8.609 -4.293 1.00 0.00 H new ATOM 0 HD2 ARG A 23 29.138 10.651 -2.985 1.00 0.00 H new ATOM 0 HD3 ARG A 23 28.944 9.710 -1.519 1.00 0.00 H new ATOM 0 HE ARG A 23 30.799 8.393 -2.075 1.00 0.00 H new ATOM 0 HH11 ARG A 23 30.086 10.431 -4.895 1.00 0.00 H new ATOM 0 HH12 ARG A 23 31.654 10.063 -5.622 1.00 0.00 H new ATOM 0 HH21 ARG A 23 32.731 8.025 -3.062 1.00 0.00 H new ATOM 0 HH22 ARG A 23 33.085 8.760 -4.629 1.00 0.00 H new ATOM 371 N TYR A 24 26.500 10.523 -6.378 1.00 0.00 N ATOM 372 CA TYR A 24 26.993 10.473 -7.766 1.00 0.00 C ATOM 373 C TYR A 24 27.308 11.871 -8.328 1.00 0.00 C ATOM 374 O TYR A 24 28.342 12.076 -8.964 1.00 0.00 O ATOM 375 CB TYR A 24 25.939 9.750 -8.623 1.00 0.00 C ATOM 376 CG TYR A 24 26.249 9.661 -10.105 1.00 0.00 C ATOM 377 CD1 TYR A 24 27.397 8.972 -10.543 1.00 0.00 C ATOM 378 CD2 TYR A 24 25.373 10.237 -11.049 1.00 0.00 C ATOM 379 CE1 TYR A 24 27.675 8.865 -11.920 1.00 0.00 C ATOM 380 CE2 TYR A 24 25.636 10.119 -12.426 1.00 0.00 C ATOM 381 CZ TYR A 24 26.793 9.437 -12.865 1.00 0.00 C ATOM 382 OH TYR A 24 27.066 9.312 -14.195 1.00 0.00 O ATOM 0 H TYR A 24 25.516 10.268 -6.289 1.00 0.00 H new ATOM 0 HA TYR A 24 27.936 9.926 -7.789 1.00 0.00 H new ATOM 0 HB2 TYR A 24 25.812 8.739 -8.235 1.00 0.00 H new ATOM 0 HB3 TYR A 24 24.984 10.261 -8.500 1.00 0.00 H new ATOM 0 HD1 TYR A 24 28.065 8.525 -9.822 1.00 0.00 H new ATOM 0 HD2 TYR A 24 24.496 10.771 -10.713 1.00 0.00 H new ATOM 0 HE1 TYR A 24 28.562 8.346 -12.253 1.00 0.00 H new ATOM 0 HE2 TYR A 24 24.955 10.549 -13.146 1.00 0.00 H new ATOM 0 HH TYR A 24 26.366 9.757 -14.716 1.00 0.00 H new ATOM 392 N THR A 25 26.462 12.861 -8.016 1.00 0.00 N ATOM 393 CA THR A 25 26.715 14.283 -8.334 1.00 0.00 C ATOM 394 C THR A 25 27.739 14.944 -7.398 1.00 0.00 C ATOM 395 O THR A 25 28.241 16.023 -7.717 1.00 0.00 O ATOM 396 CB THR A 25 25.423 15.112 -8.303 1.00 0.00 C ATOM 397 OG1 THR A 25 24.812 15.053 -7.036 1.00 0.00 O ATOM 398 CG2 THR A 25 24.401 14.667 -9.352 1.00 0.00 C ATOM 0 H THR A 25 25.577 12.703 -7.534 1.00 0.00 H new ATOM 0 HA THR A 25 27.129 14.273 -9.342 1.00 0.00 H new ATOM 0 HB THR A 25 25.728 16.134 -8.531 1.00 0.00 H new ATOM 0 HG1 THR A 25 24.408 14.169 -6.908 1.00 0.00 H new ATOM 0 HG21 THR A 25 23.510 15.291 -9.280 1.00 0.00 H new ATOM 0 HG22 THR A 25 24.834 14.767 -10.347 1.00 0.00 H new ATOM 0 HG23 THR A 25 24.130 13.626 -9.177 1.00 0.00 H new ATOM 406 N ASN A 26 28.050 14.310 -6.257 1.00 0.00 N ATOM 407 CA ASN A 26 28.940 14.821 -5.204 1.00 0.00 C ATOM 408 C ASN A 26 28.570 16.254 -4.752 1.00 0.00 C ATOM 409 O ASN A 26 29.433 17.116 -4.565 1.00 0.00 O ATOM 410 CB ASN A 26 30.410 14.622 -5.628 1.00 0.00 C ATOM 411 CG ASN A 26 31.401 14.763 -4.477 1.00 0.00 C ATOM 412 OD1 ASN A 26 31.063 14.690 -3.302 1.00 0.00 O ATOM 413 ND2 ASN A 26 32.671 14.922 -4.780 1.00 0.00 N ATOM 0 H ASN A 26 27.672 13.389 -6.034 1.00 0.00 H new ATOM 0 HA ASN A 26 28.799 14.236 -4.295 1.00 0.00 H new ATOM 0 HB2 ASN A 26 30.521 13.633 -6.073 1.00 0.00 H new ATOM 0 HB3 ASN A 26 30.658 15.349 -6.401 1.00 0.00 H new ATOM 0 HD21 ASN A 26 33.368 14.984 -4.038 1.00 0.00 H new ATOM 0 HD22 ASN A 26 32.958 14.983 -5.757 1.00 0.00 H new ATOM 420 N SER A 27 27.262 16.514 -4.636 1.00 0.00 N ATOM 421 CA SER A 27 26.702 17.855 -4.392 1.00 0.00 C ATOM 422 C SER A 27 25.853 17.927 -3.107 1.00 0.00 C ATOM 423 O SER A 27 25.783 16.970 -2.332 1.00 0.00 O ATOM 424 CB SER A 27 25.907 18.295 -5.626 1.00 0.00 C ATOM 425 OG SER A 27 25.729 19.704 -5.600 1.00 0.00 O ATOM 0 H SER A 27 26.549 15.789 -4.710 1.00 0.00 H new ATOM 0 HA SER A 27 27.529 18.546 -4.227 1.00 0.00 H new ATOM 0 HB2 SER A 27 26.434 18.001 -6.534 1.00 0.00 H new ATOM 0 HB3 SER A 27 24.938 17.796 -5.644 1.00 0.00 H new ATOM 0 HG SER A 27 26.270 20.115 -6.306 1.00 0.00 H new ATOM 431 N THR A 28 25.218 19.082 -2.873 1.00 0.00 N ATOM 432 CA THR A 28 24.298 19.322 -1.745 1.00 0.00 C ATOM 433 C THR A 28 22.832 19.196 -2.165 1.00 0.00 C ATOM 434 O THR A 28 22.464 19.468 -3.309 1.00 0.00 O ATOM 435 CB THR A 28 24.615 20.655 -1.037 1.00 0.00 C ATOM 436 OG1 THR A 28 23.731 20.835 0.051 1.00 0.00 O ATOM 437 CG2 THR A 28 24.482 21.893 -1.922 1.00 0.00 C ATOM 0 H THR A 28 25.330 19.898 -3.475 1.00 0.00 H new ATOM 0 HA THR A 28 24.462 18.535 -1.008 1.00 0.00 H new ATOM 0 HB THR A 28 25.658 20.572 -0.732 1.00 0.00 H new ATOM 0 HG1 THR A 28 23.934 21.681 0.501 1.00 0.00 H new ATOM 0 HG21 THR A 28 24.724 22.783 -1.341 1.00 0.00 H new ATOM 0 HG22 THR A 28 25.168 21.813 -2.765 1.00 0.00 H new ATOM 0 HG23 THR A 28 23.459 21.968 -2.292 1.00 0.00 H new ATOM 445 N GLU A 29 21.968 18.799 -1.231 1.00 0.00 N ATOM 446 CA GLU A 29 20.549 18.496 -1.489 1.00 0.00 C ATOM 447 C GLU A 29 19.785 19.722 -2.007 1.00 0.00 C ATOM 448 O GLU A 29 18.919 19.593 -2.869 1.00 0.00 O ATOM 449 CB GLU A 29 19.898 17.963 -0.197 1.00 0.00 C ATOM 450 CG GLU A 29 20.591 16.711 0.358 1.00 0.00 C ATOM 451 CD GLU A 29 19.969 16.251 1.691 1.00 0.00 C ATOM 452 OE1 GLU A 29 20.061 16.988 2.703 1.00 0.00 O ATOM 453 OE2 GLU A 29 19.410 15.130 1.734 1.00 0.00 O ATOM 0 H GLU A 29 22.234 18.675 -0.254 1.00 0.00 H new ATOM 0 HA GLU A 29 20.500 17.736 -2.269 1.00 0.00 H new ATOM 0 HB2 GLU A 29 19.916 18.746 0.561 1.00 0.00 H new ATOM 0 HB3 GLU A 29 18.851 17.734 -0.394 1.00 0.00 H new ATOM 0 HG2 GLU A 29 20.522 15.904 -0.372 1.00 0.00 H new ATOM 0 HG3 GLU A 29 21.651 16.918 0.505 1.00 0.00 H new ATOM 460 N GLN A 30 20.162 20.927 -1.554 1.00 0.00 N ATOM 461 CA GLN A 30 19.582 22.187 -2.037 1.00 0.00 C ATOM 462 C GLN A 30 19.875 22.409 -3.525 1.00 0.00 C ATOM 463 O GLN A 30 18.987 22.791 -4.278 1.00 0.00 O ATOM 464 CB GLN A 30 20.125 23.369 -1.215 1.00 0.00 C ATOM 465 CG GLN A 30 19.821 23.248 0.287 1.00 0.00 C ATOM 466 CD GLN A 30 20.230 24.509 1.050 1.00 0.00 C ATOM 467 OE1 GLN A 30 19.431 25.396 1.317 1.00 0.00 O ATOM 468 NE2 GLN A 30 21.486 24.651 1.422 1.00 0.00 N ATOM 0 H GLN A 30 20.880 21.054 -0.840 1.00 0.00 H new ATOM 0 HA GLN A 30 18.501 22.124 -1.913 1.00 0.00 H new ATOM 0 HB2 GLN A 30 21.204 23.438 -1.357 1.00 0.00 H new ATOM 0 HB3 GLN A 30 19.694 24.296 -1.594 1.00 0.00 H new ATOM 0 HG2 GLN A 30 18.756 23.066 0.429 1.00 0.00 H new ATOM 0 HG3 GLN A 30 20.349 22.387 0.697 1.00 0.00 H new ATOM 0 HE21 GLN A 30 22.167 23.922 1.208 1.00 0.00 H new ATOM 0 HE22 GLN A 30 21.778 25.490 1.924 1.00 0.00 H new ATOM 477 N GLN A 31 21.099 22.106 -3.971 1.00 0.00 N ATOM 478 CA GLN A 31 21.505 22.250 -5.372 1.00 0.00 C ATOM 479 C GLN A 31 20.831 21.200 -6.271 1.00 0.00 C ATOM 480 O GLN A 31 20.405 21.521 -7.376 1.00 0.00 O ATOM 481 CB GLN A 31 23.042 22.188 -5.445 1.00 0.00 C ATOM 482 CG GLN A 31 23.608 22.697 -6.776 1.00 0.00 C ATOM 483 CD GLN A 31 23.402 24.198 -6.983 1.00 0.00 C ATOM 484 OE1 GLN A 31 22.563 24.637 -7.758 1.00 0.00 O ATOM 485 NE2 GLN A 31 24.141 25.043 -6.292 1.00 0.00 N ATOM 0 H GLN A 31 21.840 21.752 -3.366 1.00 0.00 H new ATOM 0 HA GLN A 31 21.172 23.216 -5.753 1.00 0.00 H new ATOM 0 HB2 GLN A 31 23.461 22.779 -4.630 1.00 0.00 H new ATOM 0 HB3 GLN A 31 23.365 21.158 -5.291 1.00 0.00 H new ATOM 0 HG2 GLN A 31 24.674 22.474 -6.819 1.00 0.00 H new ATOM 0 HG3 GLN A 31 23.135 22.155 -7.595 1.00 0.00 H new ATOM 0 HE21 GLN A 31 24.844 24.692 -5.642 1.00 0.00 H new ATOM 0 HE22 GLN A 31 24.009 26.048 -6.407 1.00 0.00 H new ATOM 494 N PHE A 32 20.653 19.965 -5.778 1.00 0.00 N ATOM 495 CA PHE A 32 19.852 18.942 -6.468 1.00 0.00 C ATOM 496 C PHE A 32 18.376 19.364 -6.588 1.00 0.00 C ATOM 497 O PHE A 32 17.812 19.289 -7.679 1.00 0.00 O ATOM 498 CB PHE A 32 20.050 17.591 -5.752 1.00 0.00 C ATOM 499 CG PHE A 32 19.305 16.375 -6.293 1.00 0.00 C ATOM 500 CD1 PHE A 32 18.847 16.299 -7.627 1.00 0.00 C ATOM 501 CD2 PHE A 32 19.091 15.279 -5.432 1.00 0.00 C ATOM 502 CE1 PHE A 32 18.114 15.180 -8.065 1.00 0.00 C ATOM 503 CE2 PHE A 32 18.376 14.152 -5.880 1.00 0.00 C ATOM 504 CZ PHE A 32 17.865 14.112 -7.188 1.00 0.00 C ATOM 0 H PHE A 32 21.057 19.649 -4.896 1.00 0.00 H new ATOM 0 HA PHE A 32 20.195 18.830 -7.496 1.00 0.00 H new ATOM 0 HB2 PHE A 32 21.115 17.361 -5.763 1.00 0.00 H new ATOM 0 HB3 PHE A 32 19.762 17.721 -4.709 1.00 0.00 H new ATOM 0 HD1 PHE A 32 19.060 17.104 -8.315 1.00 0.00 H new ATOM 0 HD2 PHE A 32 19.478 15.304 -4.424 1.00 0.00 H new ATOM 0 HE1 PHE A 32 17.742 15.143 -9.078 1.00 0.00 H new ATOM 0 HE2 PHE A 32 18.220 13.315 -5.216 1.00 0.00 H new ATOM 0 HZ PHE A 32 17.283 13.264 -7.517 1.00 0.00 H new ATOM 514 N LEU A 33 17.767 19.897 -5.521 1.00 0.00 N ATOM 515 CA LEU A 33 16.395 20.426 -5.569 1.00 0.00 C ATOM 516 C LEU A 33 16.267 21.598 -6.554 1.00 0.00 C ATOM 517 O LEU A 33 15.358 21.608 -7.379 1.00 0.00 O ATOM 518 CB LEU A 33 15.944 20.757 -4.129 1.00 0.00 C ATOM 519 CG LEU A 33 14.506 21.280 -3.898 1.00 0.00 C ATOM 520 CD1 LEU A 33 14.342 22.761 -4.234 1.00 0.00 C ATOM 521 CD2 LEU A 33 13.453 20.472 -4.662 1.00 0.00 C ATOM 0 H LEU A 33 18.207 19.974 -4.604 1.00 0.00 H new ATOM 0 HA LEU A 33 15.714 19.672 -5.964 1.00 0.00 H new ATOM 0 HB2 LEU A 33 16.067 19.855 -3.529 1.00 0.00 H new ATOM 0 HB3 LEU A 33 16.633 21.501 -3.730 1.00 0.00 H new ATOM 0 HG LEU A 33 14.341 21.152 -2.828 1.00 0.00 H new ATOM 0 HD11 LEU A 33 13.311 23.064 -4.050 1.00 0.00 H new ATOM 0 HD12 LEU A 33 15.011 23.352 -3.609 1.00 0.00 H new ATOM 0 HD13 LEU A 33 14.587 22.925 -5.283 1.00 0.00 H new ATOM 0 HD21 LEU A 33 12.464 20.883 -4.463 1.00 0.00 H new ATOM 0 HD22 LEU A 33 13.659 20.524 -5.731 1.00 0.00 H new ATOM 0 HD23 LEU A 33 13.486 19.432 -4.337 1.00 0.00 H new ATOM 533 N GLU A 34 17.201 22.543 -6.532 1.00 0.00 N ATOM 534 CA GLU A 34 17.201 23.690 -7.453 1.00 0.00 C ATOM 535 C GLU A 34 17.387 23.277 -8.920 1.00 0.00 C ATOM 536 O GLU A 34 16.721 23.821 -9.800 1.00 0.00 O ATOM 537 CB GLU A 34 18.284 24.694 -7.033 1.00 0.00 C ATOM 538 CG GLU A 34 17.872 25.528 -5.817 1.00 0.00 C ATOM 539 CD GLU A 34 16.882 26.644 -6.208 1.00 0.00 C ATOM 540 OE1 GLU A 34 17.335 27.741 -6.623 1.00 0.00 O ATOM 541 OE2 GLU A 34 15.649 26.437 -6.098 1.00 0.00 O ATOM 0 H GLU A 34 17.983 22.542 -5.877 1.00 0.00 H new ATOM 0 HA GLU A 34 16.219 24.159 -7.387 1.00 0.00 H new ATOM 0 HB2 GLU A 34 19.204 24.156 -6.805 1.00 0.00 H new ATOM 0 HB3 GLU A 34 18.502 25.359 -7.869 1.00 0.00 H new ATOM 0 HG2 GLU A 34 17.415 24.881 -5.068 1.00 0.00 H new ATOM 0 HG3 GLU A 34 18.758 25.969 -5.360 1.00 0.00 H new ATOM 548 N ALA A 35 18.219 22.271 -9.196 1.00 0.00 N ATOM 549 CA ALA A 35 18.367 21.697 -10.536 1.00 0.00 C ATOM 550 C ALA A 35 17.108 20.935 -10.984 1.00 0.00 C ATOM 551 O ALA A 35 16.709 21.023 -12.145 1.00 0.00 O ATOM 552 CB ALA A 35 19.608 20.801 -10.547 1.00 0.00 C ATOM 0 H ALA A 35 18.812 21.829 -8.494 1.00 0.00 H new ATOM 0 HA ALA A 35 18.494 22.504 -11.258 1.00 0.00 H new ATOM 0 HB1 ALA A 35 19.733 20.365 -11.538 1.00 0.00 H new ATOM 0 HB2 ALA A 35 20.488 21.395 -10.298 1.00 0.00 H new ATOM 0 HB3 ALA A 35 19.488 20.004 -9.813 1.00 0.00 H new ATOM 558 N MET A 36 16.432 20.234 -10.073 1.00 0.00 N ATOM 559 CA MET A 36 15.143 19.592 -10.356 1.00 0.00 C ATOM 560 C MET A 36 14.038 20.627 -10.626 1.00 0.00 C ATOM 561 O MET A 36 13.312 20.485 -11.605 1.00 0.00 O ATOM 562 CB MET A 36 14.777 18.646 -9.202 1.00 0.00 C ATOM 563 CG MET A 36 15.618 17.363 -9.249 1.00 0.00 C ATOM 564 SD MET A 36 15.121 16.189 -10.540 1.00 0.00 S ATOM 565 CE MET A 36 13.653 15.472 -9.749 1.00 0.00 C ATOM 0 H MET A 36 16.761 20.094 -9.118 1.00 0.00 H new ATOM 0 HA MET A 36 15.236 19.004 -11.269 1.00 0.00 H new ATOM 0 HB2 MET A 36 14.934 19.152 -8.249 1.00 0.00 H new ATOM 0 HB3 MET A 36 13.718 18.392 -9.258 1.00 0.00 H new ATOM 0 HG2 MET A 36 16.663 17.633 -9.403 1.00 0.00 H new ATOM 0 HG3 MET A 36 15.557 16.867 -8.280 1.00 0.00 H new ATOM 0 HE1 MET A 36 13.204 14.735 -10.415 1.00 0.00 H new ATOM 0 HE2 MET A 36 13.942 14.989 -8.816 1.00 0.00 H new ATOM 0 HE3 MET A 36 12.930 16.261 -9.540 1.00 0.00 H new ATOM 575 N GLU A 37 13.946 21.711 -9.852 1.00 0.00 N ATOM 576 CA GLU A 37 12.985 22.796 -10.115 1.00 0.00 C ATOM 577 C GLU A 37 13.298 23.544 -11.429 1.00 0.00 C ATOM 578 O GLU A 37 12.384 23.876 -12.186 1.00 0.00 O ATOM 579 CB GLU A 37 12.962 23.770 -8.923 1.00 0.00 C ATOM 580 CG GLU A 37 12.355 23.184 -7.634 1.00 0.00 C ATOM 581 CD GLU A 37 10.812 23.218 -7.615 1.00 0.00 C ATOM 582 OE1 GLU A 37 10.162 22.636 -8.514 1.00 0.00 O ATOM 583 OE2 GLU A 37 10.234 23.797 -6.662 1.00 0.00 O ATOM 0 H GLU A 37 14.529 21.865 -9.030 1.00 0.00 H new ATOM 0 HA GLU A 37 11.998 22.349 -10.235 1.00 0.00 H new ATOM 0 HB2 GLU A 37 13.982 24.095 -8.715 1.00 0.00 H new ATOM 0 HB3 GLU A 37 12.396 24.658 -9.206 1.00 0.00 H new ATOM 0 HG2 GLU A 37 12.690 22.153 -7.519 1.00 0.00 H new ATOM 0 HG3 GLU A 37 12.734 23.740 -6.777 1.00 0.00 H new ATOM 590 N SER A 38 14.588 23.739 -11.747 1.00 0.00 N ATOM 591 CA SER A 38 15.059 24.324 -13.016 1.00 0.00 C ATOM 592 C SER A 38 14.706 23.469 -14.250 1.00 0.00 C ATOM 593 O SER A 38 14.490 24.014 -15.333 1.00 0.00 O ATOM 594 CB SER A 38 16.583 24.507 -12.921 1.00 0.00 C ATOM 595 OG SER A 38 17.137 25.064 -14.106 1.00 0.00 O ATOM 0 H SER A 38 15.350 23.489 -11.117 1.00 0.00 H new ATOM 0 HA SER A 38 14.551 25.278 -13.156 1.00 0.00 H new ATOM 0 HB2 SER A 38 16.816 25.154 -12.075 1.00 0.00 H new ATOM 0 HB3 SER A 38 17.050 23.542 -12.723 1.00 0.00 H new ATOM 0 HG SER A 38 17.829 25.716 -13.868 1.00 0.00 H new ATOM 601 N THR A 39 14.609 22.142 -14.089 1.00 0.00 N ATOM 602 CA THR A 39 14.364 21.185 -15.192 1.00 0.00 C ATOM 603 C THR A 39 12.937 20.621 -15.228 1.00 0.00 C ATOM 604 O THR A 39 12.611 19.827 -16.113 1.00 0.00 O ATOM 605 CB THR A 39 15.383 20.041 -15.163 1.00 0.00 C ATOM 606 OG1 THR A 39 15.330 19.372 -13.927 1.00 0.00 O ATOM 607 CG2 THR A 39 16.811 20.535 -15.367 1.00 0.00 C ATOM 0 H THR A 39 14.699 21.691 -13.179 1.00 0.00 H new ATOM 0 HA THR A 39 14.487 21.763 -16.108 1.00 0.00 H new ATOM 0 HB THR A 39 15.120 19.371 -15.981 1.00 0.00 H new ATOM 0 HG1 THR A 39 15.801 19.900 -13.249 1.00 0.00 H new ATOM 0 HG21 THR A 39 17.497 19.688 -15.338 1.00 0.00 H new ATOM 0 HG22 THR A 39 16.889 21.033 -16.334 1.00 0.00 H new ATOM 0 HG23 THR A 39 17.069 21.238 -14.575 1.00 0.00 H new ATOM 615 N GLY A 40 12.068 21.020 -14.291 1.00 0.00 N ATOM 616 CA GLY A 40 10.687 20.521 -14.204 1.00 0.00 C ATOM 617 C GLY A 40 10.582 19.078 -13.687 1.00 0.00 C ATOM 618 O GLY A 40 9.659 18.348 -14.056 1.00 0.00 O ATOM 0 H GLY A 40 12.302 21.701 -13.568 1.00 0.00 H new ATOM 0 HA2 GLY A 40 10.115 21.175 -13.547 1.00 0.00 H new ATOM 0 HA3 GLY A 40 10.227 20.578 -15.190 1.00 0.00 H new ATOM 622 N GLY A 41 11.552 18.650 -12.869 1.00 0.00 N ATOM 623 CA GLY A 41 11.616 17.300 -12.295 1.00 0.00 C ATOM 624 C GLY A 41 12.256 16.244 -13.202 1.00 0.00 C ATOM 625 O GLY A 41 12.085 15.052 -12.952 1.00 0.00 O ATOM 0 H GLY A 41 12.330 19.244 -12.582 1.00 0.00 H new ATOM 0 HA2 GLY A 41 12.177 17.344 -11.361 1.00 0.00 H new ATOM 0 HA3 GLY A 41 10.605 16.979 -12.045 1.00 0.00 H new ATOM 629 N ARG A 42 13.001 16.640 -14.246 1.00 0.00 N ATOM 630 CA ARG A 42 13.693 15.695 -15.148 1.00 0.00 C ATOM 631 C ARG A 42 15.025 15.278 -14.533 1.00 0.00 C ATOM 632 O ARG A 42 16.038 15.935 -14.752 1.00 0.00 O ATOM 633 CB ARG A 42 13.865 16.334 -16.544 1.00 0.00 C ATOM 634 CG ARG A 42 12.638 16.174 -17.452 1.00 0.00 C ATOM 635 CD ARG A 42 12.507 14.744 -18.003 1.00 0.00 C ATOM 636 NE ARG A 42 11.442 14.670 -19.027 1.00 0.00 N ATOM 637 CZ ARG A 42 11.005 13.592 -19.656 1.00 0.00 C ATOM 638 NH1 ARG A 42 11.493 12.403 -19.427 1.00 0.00 N ATOM 639 NH2 ARG A 42 10.052 13.686 -20.537 1.00 0.00 N ATOM 0 H ARG A 42 13.143 17.620 -14.491 1.00 0.00 H new ATOM 0 HA ARG A 42 13.095 14.793 -15.275 1.00 0.00 H new ATOM 0 HB2 ARG A 42 14.081 17.396 -16.424 1.00 0.00 H new ATOM 0 HB3 ARG A 42 14.730 15.887 -17.034 1.00 0.00 H new ATOM 0 HG2 ARG A 42 11.738 16.430 -16.893 1.00 0.00 H new ATOM 0 HG3 ARG A 42 12.708 16.877 -18.282 1.00 0.00 H new ATOM 0 HD2 ARG A 42 13.456 14.428 -18.436 1.00 0.00 H new ATOM 0 HD3 ARG A 42 12.283 14.055 -17.189 1.00 0.00 H new ATOM 0 HE ARG A 42 10.993 15.551 -19.276 1.00 0.00 H new ATOM 0 HH11 ARG A 42 12.239 12.281 -18.742 1.00 0.00 H new ATOM 0 HH12 ARG A 42 11.129 11.596 -19.933 1.00 0.00 H new ATOM 0 HH21 ARG A 42 9.638 14.595 -20.746 1.00 0.00 H new ATOM 0 HH22 ARG A 42 9.719 12.851 -21.019 1.00 0.00 H new ATOM 653 N VAL A 43 15.037 14.149 -13.819 1.00 0.00 N ATOM 654 CA VAL A 43 16.220 13.640 -13.083 1.00 0.00 C ATOM 655 C VAL A 43 17.460 13.583 -13.979 1.00 0.00 C ATOM 656 O VAL A 43 18.502 14.093 -13.584 1.00 0.00 O ATOM 657 CB VAL A 43 15.924 12.267 -12.433 1.00 0.00 C ATOM 658 CG1 VAL A 43 17.148 11.689 -11.710 1.00 0.00 C ATOM 659 CG2 VAL A 43 14.799 12.382 -11.391 1.00 0.00 C ATOM 0 H VAL A 43 14.218 13.547 -13.728 1.00 0.00 H new ATOM 0 HA VAL A 43 16.437 14.345 -12.281 1.00 0.00 H new ATOM 0 HB VAL A 43 15.635 11.609 -13.252 1.00 0.00 H new ATOM 0 HG11 VAL A 43 16.890 10.725 -11.271 1.00 0.00 H new ATOM 0 HG12 VAL A 43 17.962 11.556 -12.422 1.00 0.00 H new ATOM 0 HG13 VAL A 43 17.463 12.374 -10.923 1.00 0.00 H new ATOM 0 HG21 VAL A 43 14.611 11.403 -10.949 1.00 0.00 H new ATOM 0 HG22 VAL A 43 15.097 13.081 -10.610 1.00 0.00 H new ATOM 0 HG23 VAL A 43 13.891 12.743 -11.874 1.00 0.00 H new ATOM 669 N ARG A 44 17.345 13.086 -15.219 1.00 0.00 N ATOM 670 CA ARG A 44 18.480 13.007 -16.165 1.00 0.00 C ATOM 671 C ARG A 44 19.103 14.371 -16.494 1.00 0.00 C ATOM 672 O ARG A 44 20.321 14.520 -16.474 1.00 0.00 O ATOM 673 CB ARG A 44 18.071 12.200 -17.419 1.00 0.00 C ATOM 674 CG ARG A 44 17.019 12.852 -18.346 1.00 0.00 C ATOM 675 CD ARG A 44 16.574 11.906 -19.474 1.00 0.00 C ATOM 676 NE ARG A 44 17.692 11.530 -20.363 1.00 0.00 N ATOM 677 CZ ARG A 44 18.119 12.154 -21.450 1.00 0.00 C ATOM 678 NH1 ARG A 44 17.561 13.245 -21.897 1.00 0.00 N ATOM 679 NH2 ARG A 44 19.133 11.689 -22.119 1.00 0.00 N ATOM 0 H ARG A 44 16.469 12.727 -15.598 1.00 0.00 H new ATOM 0 HA ARG A 44 19.286 12.466 -15.668 1.00 0.00 H new ATOM 0 HB2 ARG A 44 18.968 12.004 -18.006 1.00 0.00 H new ATOM 0 HB3 ARG A 44 17.686 11.234 -17.092 1.00 0.00 H new ATOM 0 HG2 ARG A 44 16.150 13.146 -17.757 1.00 0.00 H new ATOM 0 HG3 ARG A 44 17.433 13.762 -18.780 1.00 0.00 H new ATOM 0 HD2 ARG A 44 16.139 11.006 -19.040 1.00 0.00 H new ATOM 0 HD3 ARG A 44 15.792 12.387 -20.061 1.00 0.00 H new ATOM 0 HE ARG A 44 18.199 10.683 -20.107 1.00 0.00 H new ATOM 0 HH11 ARG A 44 16.764 13.649 -21.405 1.00 0.00 H new ATOM 0 HH12 ARG A 44 17.922 13.694 -22.739 1.00 0.00 H new ATOM 0 HH21 ARG A 44 19.604 10.839 -21.807 1.00 0.00 H new ATOM 0 HH22 ARG A 44 19.458 12.174 -22.956 1.00 0.00 H new ATOM 693 N ILE A 45 18.267 15.393 -16.702 1.00 0.00 N ATOM 694 CA ILE A 45 18.724 16.761 -17.021 1.00 0.00 C ATOM 695 C ILE A 45 19.268 17.434 -15.753 1.00 0.00 C ATOM 696 O ILE A 45 20.281 18.121 -15.805 1.00 0.00 O ATOM 697 CB ILE A 45 17.614 17.599 -17.710 1.00 0.00 C ATOM 698 CG1 ILE A 45 16.985 16.845 -18.909 1.00 0.00 C ATOM 699 CG2 ILE A 45 18.201 18.938 -18.200 1.00 0.00 C ATOM 700 CD1 ILE A 45 15.864 17.603 -19.639 1.00 0.00 C ATOM 0 H ILE A 45 17.252 15.301 -16.655 1.00 0.00 H new ATOM 0 HA ILE A 45 19.536 16.698 -17.746 1.00 0.00 H new ATOM 0 HB ILE A 45 16.830 17.779 -16.974 1.00 0.00 H new ATOM 0 HG12 ILE A 45 17.772 16.613 -19.626 1.00 0.00 H new ATOM 0 HG13 ILE A 45 16.588 15.894 -18.553 1.00 0.00 H new ATOM 0 HG21 ILE A 45 17.419 19.523 -18.683 1.00 0.00 H new ATOM 0 HG22 ILE A 45 18.598 19.494 -17.351 1.00 0.00 H new ATOM 0 HG23 ILE A 45 19.002 18.745 -18.913 1.00 0.00 H new ATOM 0 HD11 ILE A 45 15.489 16.994 -20.461 1.00 0.00 H new ATOM 0 HD12 ILE A 45 15.052 17.812 -18.942 1.00 0.00 H new ATOM 0 HD13 ILE A 45 16.255 18.541 -20.032 1.00 0.00 H new ATOM 712 N ALA A 46 18.657 17.193 -14.592 1.00 0.00 N ATOM 713 CA ALA A 46 19.120 17.737 -13.313 1.00 0.00 C ATOM 714 C ALA A 46 20.519 17.204 -12.949 1.00 0.00 C ATOM 715 O ALA A 46 21.424 17.991 -12.677 1.00 0.00 O ATOM 716 CB ALA A 46 18.074 17.421 -12.234 1.00 0.00 C ATOM 0 H ALA A 46 17.823 16.612 -14.511 1.00 0.00 H new ATOM 0 HA ALA A 46 19.225 18.819 -13.390 1.00 0.00 H new ATOM 0 HB1 ALA A 46 18.407 17.821 -11.276 1.00 0.00 H new ATOM 0 HB2 ALA A 46 17.122 17.876 -12.506 1.00 0.00 H new ATOM 0 HB3 ALA A 46 17.950 16.341 -12.153 1.00 0.00 H new ATOM 722 N ILE A 47 20.742 15.885 -13.031 1.00 0.00 N ATOM 723 CA ILE A 47 22.069 15.304 -12.763 1.00 0.00 C ATOM 724 C ILE A 47 23.079 15.698 -13.849 1.00 0.00 C ATOM 725 O ILE A 47 24.222 15.996 -13.513 1.00 0.00 O ATOM 726 CB ILE A 47 22.014 13.783 -12.484 1.00 0.00 C ATOM 727 CG1 ILE A 47 21.707 12.940 -13.738 1.00 0.00 C ATOM 728 CG2 ILE A 47 21.024 13.516 -11.334 1.00 0.00 C ATOM 729 CD1 ILE A 47 21.577 11.432 -13.473 1.00 0.00 C ATOM 0 H ILE A 47 20.026 15.202 -13.279 1.00 0.00 H new ATOM 0 HA ILE A 47 22.434 15.739 -11.833 1.00 0.00 H new ATOM 0 HB ILE A 47 23.009 13.458 -12.179 1.00 0.00 H new ATOM 0 HG12 ILE A 47 20.780 13.299 -14.184 1.00 0.00 H new ATOM 0 HG13 ILE A 47 22.497 13.101 -14.471 1.00 0.00 H new ATOM 0 HG21 ILE A 47 20.981 12.446 -11.132 1.00 0.00 H new ATOM 0 HG22 ILE A 47 21.357 14.041 -10.438 1.00 0.00 H new ATOM 0 HG23 ILE A 47 20.033 13.872 -11.617 1.00 0.00 H new ATOM 0 HD11 ILE A 47 21.361 10.916 -14.408 1.00 0.00 H new ATOM 0 HD12 ILE A 47 22.511 11.054 -13.057 1.00 0.00 H new ATOM 0 HD13 ILE A 47 20.767 11.255 -12.766 1.00 0.00 H new ATOM 741 N ALA A 48 22.660 15.830 -15.116 1.00 0.00 N ATOM 742 CA ALA A 48 23.507 16.390 -16.172 1.00 0.00 C ATOM 743 C ALA A 48 23.955 17.837 -15.869 1.00 0.00 C ATOM 744 O ALA A 48 25.139 18.152 -16.015 1.00 0.00 O ATOM 745 CB ALA A 48 22.746 16.302 -17.501 1.00 0.00 C ATOM 0 H ALA A 48 21.731 15.553 -15.433 1.00 0.00 H new ATOM 0 HA ALA A 48 24.426 15.807 -16.231 1.00 0.00 H new ATOM 0 HB1 ALA A 48 23.361 16.715 -18.301 1.00 0.00 H new ATOM 0 HB2 ALA A 48 22.517 15.259 -17.721 1.00 0.00 H new ATOM 0 HB3 ALA A 48 21.818 16.869 -17.427 1.00 0.00 H new ATOM 751 N LYS A 49 23.056 18.704 -15.372 1.00 0.00 N ATOM 752 CA LYS A 49 23.407 20.077 -14.957 1.00 0.00 C ATOM 753 C LYS A 49 24.351 20.096 -13.752 1.00 0.00 C ATOM 754 O LYS A 49 25.334 20.825 -13.787 1.00 0.00 O ATOM 755 CB LYS A 49 22.142 20.929 -14.719 1.00 0.00 C ATOM 756 CG LYS A 49 21.459 21.303 -16.046 1.00 0.00 C ATOM 757 CD LYS A 49 20.252 22.249 -15.892 1.00 0.00 C ATOM 758 CE LYS A 49 20.686 23.674 -15.508 1.00 0.00 C ATOM 759 NZ LYS A 49 19.574 24.661 -15.656 1.00 0.00 N ATOM 0 H LYS A 49 22.070 18.476 -15.246 1.00 0.00 H new ATOM 0 HA LYS A 49 23.957 20.533 -15.781 1.00 0.00 H new ATOM 0 HB2 LYS A 49 21.443 20.377 -14.091 1.00 0.00 H new ATOM 0 HB3 LYS A 49 22.409 21.836 -14.177 1.00 0.00 H new ATOM 0 HG2 LYS A 49 22.194 21.773 -16.700 1.00 0.00 H new ATOM 0 HG3 LYS A 49 21.130 20.390 -16.542 1.00 0.00 H new ATOM 0 HD2 LYS A 49 19.693 22.279 -16.827 1.00 0.00 H new ATOM 0 HD3 LYS A 49 19.578 21.857 -15.130 1.00 0.00 H new ATOM 0 HE2 LYS A 49 21.039 23.679 -14.477 1.00 0.00 H new ATOM 0 HE3 LYS A 49 21.525 23.978 -16.134 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 19.947 25.624 -15.535 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 19.152 24.569 -16.602 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 18.849 24.478 -14.934 1.00 0.00 H new ATOM 773 N LEU A 50 24.148 19.239 -12.746 1.00 0.00 N ATOM 774 CA LEU A 50 25.099 19.101 -11.622 1.00 0.00 C ATOM 775 C LEU A 50 26.492 18.650 -12.094 1.00 0.00 C ATOM 776 O LEU A 50 27.494 19.239 -11.695 1.00 0.00 O ATOM 777 CB LEU A 50 24.566 18.093 -10.574 1.00 0.00 C ATOM 778 CG LEU A 50 23.758 18.642 -9.385 1.00 0.00 C ATOM 779 CD1 LEU A 50 24.511 19.728 -8.624 1.00 0.00 C ATOM 780 CD2 LEU A 50 22.406 19.198 -9.803 1.00 0.00 C ATOM 0 H LEU A 50 23.335 18.627 -12.681 1.00 0.00 H new ATOM 0 HA LEU A 50 25.194 20.088 -11.169 1.00 0.00 H new ATOM 0 HB2 LEU A 50 23.941 17.369 -11.096 1.00 0.00 H new ATOM 0 HB3 LEU A 50 25.420 17.546 -10.173 1.00 0.00 H new ATOM 0 HG LEU A 50 23.604 17.783 -8.732 1.00 0.00 H new ATOM 0 HD11 LEU A 50 23.899 20.083 -7.795 1.00 0.00 H new ATOM 0 HD12 LEU A 50 25.445 19.320 -8.237 1.00 0.00 H new ATOM 0 HD13 LEU A 50 24.729 20.559 -9.295 1.00 0.00 H new ATOM 0 HD21 LEU A 50 21.879 19.571 -8.925 1.00 0.00 H new ATOM 0 HD22 LEU A 50 22.551 20.012 -10.513 1.00 0.00 H new ATOM 0 HD23 LEU A 50 21.817 18.409 -10.271 1.00 0.00 H new ATOM 792 N LEU A 51 26.563 17.645 -12.974 1.00 0.00 N ATOM 793 CA LEU A 51 27.836 17.128 -13.493 1.00 0.00 C ATOM 794 C LEU A 51 28.545 18.132 -14.424 1.00 0.00 C ATOM 795 O LEU A 51 29.776 18.163 -14.463 1.00 0.00 O ATOM 796 CB LEU A 51 27.584 15.780 -14.194 1.00 0.00 C ATOM 797 CG LEU A 51 27.191 14.634 -13.238 1.00 0.00 C ATOM 798 CD1 LEU A 51 26.682 13.440 -14.043 1.00 0.00 C ATOM 799 CD2 LEU A 51 28.364 14.158 -12.380 1.00 0.00 C ATOM 0 H LEU A 51 25.742 17.168 -13.346 1.00 0.00 H new ATOM 0 HA LEU A 51 28.515 16.976 -12.654 1.00 0.00 H new ATOM 0 HB2 LEU A 51 26.793 15.910 -14.933 1.00 0.00 H new ATOM 0 HB3 LEU A 51 28.484 15.492 -14.738 1.00 0.00 H new ATOM 0 HG LEU A 51 26.417 15.028 -12.580 1.00 0.00 H new ATOM 0 HD11 LEU A 51 26.406 12.634 -13.363 1.00 0.00 H new ATOM 0 HD12 LEU A 51 25.810 13.739 -14.625 1.00 0.00 H new ATOM 0 HD13 LEU A 51 27.466 13.094 -14.716 1.00 0.00 H new ATOM 0 HD21 LEU A 51 28.033 13.351 -11.726 1.00 0.00 H new ATOM 0 HD22 LEU A 51 29.164 13.796 -13.026 1.00 0.00 H new ATOM 0 HD23 LEU A 51 28.733 14.987 -11.776 1.00 0.00 H new ATOM 811 N SER A 52 27.790 18.995 -15.116 1.00 0.00 N ATOM 812 CA SER A 52 28.342 20.115 -15.901 1.00 0.00 C ATOM 813 C SER A 52 28.821 21.279 -15.019 1.00 0.00 C ATOM 814 O SER A 52 29.846 21.897 -15.315 1.00 0.00 O ATOM 815 CB SER A 52 27.307 20.640 -16.905 1.00 0.00 C ATOM 816 OG SER A 52 26.913 19.620 -17.815 1.00 0.00 O ATOM 0 H SER A 52 26.772 18.938 -15.149 1.00 0.00 H new ATOM 0 HA SER A 52 29.207 19.716 -16.431 1.00 0.00 H new ATOM 0 HB2 SER A 52 26.433 21.012 -16.370 1.00 0.00 H new ATOM 0 HB3 SER A 52 27.725 21.482 -17.457 1.00 0.00 H new ATOM 0 HG SER A 52 26.305 18.997 -17.365 1.00 0.00 H new ATOM 822 N LYS A 53 28.104 21.567 -13.923 1.00 0.00 N ATOM 823 CA LYS A 53 28.414 22.649 -12.972 1.00 0.00 C ATOM 824 C LYS A 53 29.634 22.339 -12.093 1.00 0.00 C ATOM 825 O LYS A 53 30.435 23.237 -11.822 1.00 0.00 O ATOM 826 CB LYS A 53 27.148 22.928 -12.133 1.00 0.00 C ATOM 827 CG LYS A 53 27.283 24.204 -11.292 1.00 0.00 C ATOM 828 CD LYS A 53 26.017 24.494 -10.471 1.00 0.00 C ATOM 829 CE LYS A 53 26.030 25.899 -9.840 1.00 0.00 C ATOM 830 NZ LYS A 53 27.141 26.096 -8.863 1.00 0.00 N ATOM 0 H LYS A 53 27.269 21.040 -13.665 1.00 0.00 H new ATOM 0 HA LYS A 53 28.693 23.543 -13.529 1.00 0.00 H new ATOM 0 HB2 LYS A 53 26.288 23.020 -12.796 1.00 0.00 H new ATOM 0 HB3 LYS A 53 26.955 22.080 -11.476 1.00 0.00 H new ATOM 0 HG2 LYS A 53 28.135 24.106 -10.620 1.00 0.00 H new ATOM 0 HG3 LYS A 53 27.490 25.049 -11.948 1.00 0.00 H new ATOM 0 HD2 LYS A 53 25.142 24.396 -11.113 1.00 0.00 H new ATOM 0 HD3 LYS A 53 25.920 23.747 -9.683 1.00 0.00 H new ATOM 0 HE2 LYS A 53 26.114 26.644 -10.631 1.00 0.00 H new ATOM 0 HE3 LYS A 53 25.078 26.073 -9.338 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 27.095 27.060 -8.474 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 27.050 25.406 -8.090 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 28.054 25.960 -9.343 1.00 0.00 H new ATOM 844 N GLN A 54 29.788 21.073 -11.685 1.00 0.00 N ATOM 845 CA GLN A 54 30.801 20.585 -10.728 1.00 0.00 C ATOM 846 C GLN A 54 30.765 21.339 -9.373 1.00 0.00 C ATOM 847 O GLN A 54 29.799 22.039 -9.063 1.00 0.00 O ATOM 848 CB GLN A 54 32.196 20.564 -11.400 1.00 0.00 C ATOM 849 CG GLN A 54 32.227 19.766 -12.715 1.00 0.00 C ATOM 850 CD GLN A 54 33.633 19.700 -13.305 1.00 0.00 C ATOM 851 OE1 GLN A 54 34.016 20.481 -14.168 1.00 0.00 O ATOM 852 NE2 GLN A 54 34.467 18.782 -12.860 1.00 0.00 N ATOM 0 H GLN A 54 29.185 20.324 -12.026 1.00 0.00 H new ATOM 0 HA GLN A 54 30.556 19.557 -10.461 1.00 0.00 H new ATOM 0 HB2 GLN A 54 32.512 21.588 -11.597 1.00 0.00 H new ATOM 0 HB3 GLN A 54 32.919 20.136 -10.706 1.00 0.00 H new ATOM 0 HG2 GLN A 54 31.860 18.755 -12.536 1.00 0.00 H new ATOM 0 HG3 GLN A 54 31.552 20.227 -13.436 1.00 0.00 H new ATOM 0 HE21 GLN A 54 34.165 18.124 -12.142 1.00 0.00 H new ATOM 0 HE22 GLN A 54 35.415 18.730 -13.234 1.00 0.00 H new ATOM 861 N THR A 55 31.794 21.165 -8.532 1.00 0.00 N ATOM 862 CA THR A 55 31.950 21.860 -7.236 1.00 0.00 C ATOM 863 C THR A 55 33.414 22.236 -6.953 1.00 0.00 C ATOM 864 O THR A 55 34.335 21.558 -7.416 1.00 0.00 O ATOM 865 CB THR A 55 31.336 21.031 -6.091 1.00 0.00 C ATOM 866 OG1 THR A 55 31.322 21.808 -4.911 1.00 0.00 O ATOM 867 CG2 THR A 55 32.071 19.722 -5.792 1.00 0.00 C ATOM 0 H THR A 55 32.561 20.524 -8.734 1.00 0.00 H new ATOM 0 HA THR A 55 31.399 22.798 -7.298 1.00 0.00 H new ATOM 0 HB THR A 55 30.333 20.762 -6.423 1.00 0.00 H new ATOM 0 HG1 THR A 55 30.931 21.286 -4.180 1.00 0.00 H new ATOM 0 HG21 THR A 55 31.572 19.203 -4.974 1.00 0.00 H new ATOM 0 HG22 THR A 55 32.064 19.090 -6.680 1.00 0.00 H new ATOM 0 HG23 THR A 55 33.101 19.939 -5.509 1.00 0.00 H new ATOM 875 N SER A 56 33.632 23.338 -6.228 1.00 0.00 N ATOM 876 CA SER A 56 34.953 23.875 -5.853 1.00 0.00 C ATOM 877 C SER A 56 34.860 24.768 -4.599 1.00 0.00 C ATOM 878 O SER A 56 33.776 25.240 -4.241 1.00 0.00 O ATOM 879 CB SER A 56 35.533 24.679 -7.025 1.00 0.00 C ATOM 880 OG SER A 56 36.905 24.977 -6.798 1.00 0.00 O ATOM 0 H SER A 56 32.865 23.906 -5.870 1.00 0.00 H new ATOM 0 HA SER A 56 35.610 23.037 -5.621 1.00 0.00 H new ATOM 0 HB2 SER A 56 35.427 24.112 -7.950 1.00 0.00 H new ATOM 0 HB3 SER A 56 34.971 25.604 -7.152 1.00 0.00 H new ATOM 0 HG SER A 56 37.258 25.488 -7.556 1.00 0.00 H new ATOM 886 N GLY A 57 35.990 25.014 -3.926 1.00 0.00 N ATOM 887 CA GLY A 57 36.075 25.859 -2.726 1.00 0.00 C ATOM 888 C GLY A 57 35.409 25.238 -1.487 1.00 0.00 C ATOM 889 O GLY A 57 35.527 24.033 -1.245 1.00 0.00 O ATOM 0 H GLY A 57 36.890 24.624 -4.205 1.00 0.00 H new ATOM 0 HA2 GLY A 57 37.124 26.056 -2.504 1.00 0.00 H new ATOM 0 HA3 GLY A 57 35.608 26.821 -2.936 1.00 0.00 H new ATOM 893 N GLY A 58 34.723 26.066 -0.691 1.00 0.00 N ATOM 894 CA GLY A 58 34.024 25.645 0.536 1.00 0.00 C ATOM 895 C GLY A 58 34.913 25.516 1.785 1.00 0.00 C ATOM 896 O GLY A 58 34.490 24.923 2.781 1.00 0.00 O ATOM 0 H GLY A 58 34.634 27.064 -0.881 1.00 0.00 H new ATOM 0 HA2 GLY A 58 33.230 26.362 0.747 1.00 0.00 H new ATOM 0 HA3 GLY A 58 33.544 24.684 0.350 1.00 0.00 H new ATOM 900 N SER A 59 36.140 26.048 1.741 1.00 0.00 N ATOM 901 CA SER A 59 37.118 26.023 2.843 1.00 0.00 C ATOM 902 C SER A 59 36.667 26.842 4.068 1.00 0.00 C ATOM 903 O SER A 59 35.902 27.804 3.949 1.00 0.00 O ATOM 904 CB SER A 59 38.479 26.547 2.356 1.00 0.00 C ATOM 905 OG SER A 59 38.928 25.807 1.225 1.00 0.00 O ATOM 0 H SER A 59 36.494 26.524 0.912 1.00 0.00 H new ATOM 0 HA SER A 59 37.201 24.983 3.158 1.00 0.00 H new ATOM 0 HB2 SER A 59 38.396 27.602 2.097 1.00 0.00 H new ATOM 0 HB3 SER A 59 39.212 26.473 3.160 1.00 0.00 H new ATOM 0 HG SER A 59 39.794 26.156 0.929 1.00 0.00 H new ATOM 911 N GLY A 60 37.175 26.485 5.254 1.00 0.00 N ATOM 912 CA GLY A 60 36.845 27.149 6.524 1.00 0.00 C ATOM 913 C GLY A 60 35.431 26.829 7.038 1.00 0.00 C ATOM 914 O GLY A 60 34.899 25.741 6.796 1.00 0.00 O ATOM 0 H GLY A 60 37.836 25.716 5.361 1.00 0.00 H new ATOM 0 HA2 GLY A 60 37.573 26.852 7.279 1.00 0.00 H new ATOM 0 HA3 GLY A 60 36.940 28.227 6.396 1.00 0.00 H new ATOM 918 N GLY A 61 34.826 27.772 7.769 1.00 0.00 N ATOM 919 CA GLY A 61 33.500 27.619 8.381 1.00 0.00 C ATOM 920 C GLY A 61 33.480 26.654 9.578 1.00 0.00 C ATOM 921 O GLY A 61 34.466 26.533 10.311 1.00 0.00 O ATOM 0 H GLY A 61 35.252 28.680 7.956 1.00 0.00 H new ATOM 0 HA2 GLY A 61 33.145 28.597 8.708 1.00 0.00 H new ATOM 0 HA3 GLY A 61 32.800 27.262 7.626 1.00 0.00 H new ATOM 925 N SER A 62 32.347 25.975 9.781 1.00 0.00 N ATOM 926 CA SER A 62 32.121 24.999 10.862 1.00 0.00 C ATOM 927 C SER A 62 31.272 23.803 10.396 1.00 0.00 C ATOM 928 O SER A 62 30.519 23.905 9.422 1.00 0.00 O ATOM 929 CB SER A 62 31.454 25.700 12.055 1.00 0.00 C ATOM 930 OG SER A 62 31.341 24.812 13.159 1.00 0.00 O ATOM 0 H SER A 62 31.532 26.091 9.179 1.00 0.00 H new ATOM 0 HA SER A 62 33.090 24.602 11.164 1.00 0.00 H new ATOM 0 HB2 SER A 62 32.038 26.574 12.343 1.00 0.00 H new ATOM 0 HB3 SER A 62 30.466 26.058 11.767 1.00 0.00 H new ATOM 0 HG SER A 62 30.916 25.276 13.910 1.00 0.00 H new ATOM 936 N LYS A 63 31.392 22.670 11.105 1.00 0.00 N ATOM 937 CA LYS A 63 30.673 21.402 10.847 1.00 0.00 C ATOM 938 C LYS A 63 29.941 20.834 12.076 1.00 0.00 C ATOM 939 O LYS A 63 29.773 19.622 12.215 1.00 0.00 O ATOM 940 CB LYS A 63 31.579 20.412 10.076 1.00 0.00 C ATOM 941 CG LYS A 63 32.989 20.136 10.637 1.00 0.00 C ATOM 942 CD LYS A 63 33.010 19.476 12.025 1.00 0.00 C ATOM 943 CE LYS A 63 34.395 18.924 12.405 1.00 0.00 C ATOM 944 NZ LYS A 63 35.431 19.986 12.569 1.00 0.00 N ATOM 0 H LYS A 63 32.017 22.604 11.908 1.00 0.00 H new ATOM 0 HA LYS A 63 29.837 21.616 10.181 1.00 0.00 H new ATOM 0 HB2 LYS A 63 31.053 19.460 10.010 1.00 0.00 H new ATOM 0 HB3 LYS A 63 31.691 20.785 9.058 1.00 0.00 H new ATOM 0 HG2 LYS A 63 33.525 19.495 9.937 1.00 0.00 H new ATOM 0 HG3 LYS A 63 33.535 21.078 10.689 1.00 0.00 H new ATOM 0 HD2 LYS A 63 32.697 20.205 12.773 1.00 0.00 H new ATOM 0 HD3 LYS A 63 32.283 18.665 12.047 1.00 0.00 H new ATOM 0 HE2 LYS A 63 34.311 18.362 13.335 1.00 0.00 H new ATOM 0 HE3 LYS A 63 34.722 18.223 11.637 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 36.339 19.548 12.824 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 35.537 20.508 11.676 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 35.139 20.642 13.321 1.00 0.00 H new ATOM 958 N LEU A 64 29.533 21.725 12.982 1.00 0.00 N ATOM 959 CA LEU A 64 28.946 21.417 14.296 1.00 0.00 C ATOM 960 C LEU A 64 27.470 21.852 14.400 1.00 0.00 C ATOM 961 O LEU A 64 26.981 22.653 13.597 1.00 0.00 O ATOM 962 CB LEU A 64 29.815 22.081 15.385 1.00 0.00 C ATOM 963 CG LEU A 64 31.305 21.680 15.355 1.00 0.00 C ATOM 964 CD1 LEU A 64 32.080 22.496 16.390 1.00 0.00 C ATOM 965 CD2 LEU A 64 31.514 20.197 15.670 1.00 0.00 C ATOM 0 H LEU A 64 29.604 22.729 12.816 1.00 0.00 H new ATOM 0 HA LEU A 64 28.940 20.336 14.436 1.00 0.00 H new ATOM 0 HB2 LEU A 64 29.742 23.163 15.279 1.00 0.00 H new ATOM 0 HB3 LEU A 64 29.404 21.828 16.363 1.00 0.00 H new ATOM 0 HG LEU A 64 31.665 21.876 14.345 1.00 0.00 H new ATOM 0 HD11 LEU A 64 33.132 22.210 16.366 1.00 0.00 H new ATOM 0 HD12 LEU A 64 31.987 23.557 16.160 1.00 0.00 H new ATOM 0 HD13 LEU A 64 31.674 22.303 17.383 1.00 0.00 H new ATOM 0 HD21 LEU A 64 32.578 19.964 15.636 1.00 0.00 H new ATOM 0 HD22 LEU A 64 31.126 19.978 16.665 1.00 0.00 H new ATOM 0 HD23 LEU A 64 30.987 19.591 14.933 1.00 0.00 H new ATOM 977 N GLY A 65 26.764 21.339 15.413 1.00 0.00 N ATOM 978 CA GLY A 65 25.341 21.617 15.660 1.00 0.00 C ATOM 979 C GLY A 65 24.378 20.849 14.739 1.00 0.00 C ATOM 980 O GLY A 65 24.759 19.880 14.074 1.00 0.00 O ATOM 0 H GLY A 65 27.172 20.705 16.100 1.00 0.00 H new ATOM 0 HA2 GLY A 65 25.109 21.370 16.696 1.00 0.00 H new ATOM 0 HA3 GLY A 65 25.165 22.686 15.540 1.00 0.00 H new ATOM 984 N GLY A 66 23.112 21.276 14.718 1.00 0.00 N ATOM 985 CA GLY A 66 22.025 20.656 13.945 1.00 0.00 C ATOM 986 C GLY A 66 20.698 21.426 14.026 1.00 0.00 C ATOM 987 O GLY A 66 20.662 22.573 14.480 1.00 0.00 O ATOM 0 H GLY A 66 22.803 22.087 15.254 1.00 0.00 H new ATOM 0 HA2 GLY A 66 22.329 20.581 12.901 1.00 0.00 H new ATOM 0 HA3 GLY A 66 21.868 19.639 14.305 1.00 0.00 H new ATOM 991 N SER A 67 19.604 20.792 13.588 1.00 0.00 N ATOM 992 CA SER A 67 18.243 21.360 13.587 1.00 0.00 C ATOM 993 C SER A 67 17.164 20.306 13.873 1.00 0.00 C ATOM 994 O SER A 67 17.265 19.157 13.432 1.00 0.00 O ATOM 995 CB SER A 67 17.964 22.037 12.239 1.00 0.00 C ATOM 996 OG SER A 67 16.648 22.575 12.210 1.00 0.00 O ATOM 0 H SER A 67 19.638 19.844 13.214 1.00 0.00 H new ATOM 0 HA SER A 67 18.199 22.094 14.392 1.00 0.00 H new ATOM 0 HB2 SER A 67 18.691 22.831 12.068 1.00 0.00 H new ATOM 0 HB3 SER A 67 18.085 21.315 11.432 1.00 0.00 H new ATOM 0 HG SER A 67 16.489 23.004 11.343 1.00 0.00 H new ATOM 1002 N GLY A 68 16.102 20.709 14.580 1.00 0.00 N ATOM 1003 CA GLY A 68 14.893 19.905 14.820 1.00 0.00 C ATOM 1004 C GLY A 68 13.888 19.899 13.653 1.00 0.00 C ATOM 1005 O GLY A 68 12.874 19.203 13.726 1.00 0.00 O ATOM 0 H GLY A 68 16.056 21.631 15.015 1.00 0.00 H new ATOM 0 HA2 GLY A 68 15.191 18.878 15.032 1.00 0.00 H new ATOM 0 HA3 GLY A 68 14.393 20.282 15.712 1.00 0.00 H new ATOM 1009 N GLY A 69 14.150 20.652 12.576 1.00 0.00 N ATOM 1010 CA GLY A 69 13.259 20.838 11.419 1.00 0.00 C ATOM 1011 C GLY A 69 13.192 19.677 10.412 1.00 0.00 C ATOM 1012 O GLY A 69 12.710 19.874 9.296 1.00 0.00 O ATOM 0 H GLY A 69 15.024 21.170 12.482 1.00 0.00 H new ATOM 0 HA2 GLY A 69 12.252 21.026 11.791 1.00 0.00 H new ATOM 0 HA3 GLY A 69 13.575 21.735 10.886 1.00 0.00 H new ATOM 1016 N SER A 70 13.685 18.482 10.756 1.00 0.00 N ATOM 1017 CA SER A 70 13.678 17.307 9.869 1.00 0.00 C ATOM 1018 C SER A 70 12.264 16.733 9.652 1.00 0.00 C ATOM 1019 O SER A 70 11.403 16.804 10.536 1.00 0.00 O ATOM 1020 CB SER A 70 14.629 16.236 10.413 1.00 0.00 C ATOM 1021 OG SER A 70 14.851 15.246 9.420 1.00 0.00 O ATOM 0 H SER A 70 14.105 18.299 11.667 1.00 0.00 H new ATOM 0 HA SER A 70 14.028 17.635 8.890 1.00 0.00 H new ATOM 0 HB2 SER A 70 15.576 16.691 10.705 1.00 0.00 H new ATOM 0 HB3 SER A 70 14.205 15.779 11.307 1.00 0.00 H new ATOM 0 HG SER A 70 15.461 14.563 9.770 1.00 0.00 H new ATOM 1027 N ARG A 71 12.021 16.162 8.463 1.00 0.00 N ATOM 1028 CA ARG A 71 10.734 15.565 8.045 1.00 0.00 C ATOM 1029 C ARG A 71 10.532 14.150 8.607 1.00 0.00 C ATOM 1030 O ARG A 71 11.487 13.471 8.992 1.00 0.00 O ATOM 1031 CB ARG A 71 10.655 15.531 6.502 1.00 0.00 C ATOM 1032 CG ARG A 71 10.644 16.910 5.817 1.00 0.00 C ATOM 1033 CD ARG A 71 9.242 17.456 5.496 1.00 0.00 C ATOM 1034 NE ARG A 71 8.463 17.784 6.706 1.00 0.00 N ATOM 1035 CZ ARG A 71 7.146 17.837 6.808 1.00 0.00 C ATOM 1036 NH1 ARG A 71 6.350 17.668 5.792 1.00 0.00 N ATOM 1037 NH2 ARG A 71 6.600 18.063 7.967 1.00 0.00 N ATOM 0 H ARG A 71 12.736 16.099 7.738 1.00 0.00 H new ATOM 0 HA ARG A 71 9.938 16.190 8.450 1.00 0.00 H new ATOM 0 HB2 ARG A 71 11.503 14.961 6.123 1.00 0.00 H new ATOM 0 HB3 ARG A 71 9.753 14.991 6.212 1.00 0.00 H new ATOM 0 HG2 ARG A 71 11.159 17.624 6.460 1.00 0.00 H new ATOM 0 HG3 ARG A 71 11.215 16.845 4.891 1.00 0.00 H new ATOM 0 HD2 ARG A 71 9.338 18.349 4.878 1.00 0.00 H new ATOM 0 HD3 ARG A 71 8.696 16.719 4.907 1.00 0.00 H new ATOM 0 HE ARG A 71 8.996 17.991 7.551 1.00 0.00 H new ATOM 0 HH11 ARG A 71 6.737 17.485 4.866 1.00 0.00 H new ATOM 0 HH12 ARG A 71 5.340 17.718 5.922 1.00 0.00 H new ATOM 0 HH21 ARG A 71 7.187 18.198 8.790 1.00 0.00 H new ATOM 0 HH22 ARG A 71 5.584 18.105 8.053 1.00 0.00 H new ATOM 1051 N LYS A 72 9.274 13.691 8.598 1.00 0.00 N ATOM 1052 CA LYS A 72 8.899 12.290 8.870 1.00 0.00 C ATOM 1053 C LYS A 72 9.300 11.390 7.690 1.00 0.00 C ATOM 1054 O LYS A 72 9.466 11.864 6.566 1.00 0.00 O ATOM 1055 CB LYS A 72 7.385 12.192 9.170 1.00 0.00 C ATOM 1056 CG LYS A 72 6.884 13.099 10.312 1.00 0.00 C ATOM 1057 CD LYS A 72 7.559 12.899 11.681 1.00 0.00 C ATOM 1058 CE LYS A 72 7.309 11.498 12.261 1.00 0.00 C ATOM 1059 NZ LYS A 72 7.859 11.364 13.639 1.00 0.00 N ATOM 0 H LYS A 72 8.472 14.289 8.399 1.00 0.00 H new ATOM 0 HA LYS A 72 9.438 11.941 9.751 1.00 0.00 H new ATOM 0 HB2 LYS A 72 6.834 12.439 8.263 1.00 0.00 H new ATOM 0 HB3 LYS A 72 7.146 11.158 9.417 1.00 0.00 H new ATOM 0 HG2 LYS A 72 7.021 14.138 10.010 1.00 0.00 H new ATOM 0 HG3 LYS A 72 5.812 12.940 10.431 1.00 0.00 H new ATOM 0 HD2 LYS A 72 8.632 13.061 11.580 1.00 0.00 H new ATOM 0 HD3 LYS A 72 7.187 13.649 12.379 1.00 0.00 H new ATOM 0 HE2 LYS A 72 6.238 11.297 12.276 1.00 0.00 H new ATOM 0 HE3 LYS A 72 7.765 10.750 11.613 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 7.671 10.406 13.996 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 8.885 11.531 13.621 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 7.405 12.061 14.263 1.00 0.00 H new ATOM 1073 N ASP A 73 9.409 10.083 7.925 1.00 0.00 N ATOM 1074 CA ASP A 73 9.775 9.080 6.909 1.00 0.00 C ATOM 1075 C ASP A 73 8.564 8.720 6.014 1.00 0.00 C ATOM 1076 O ASP A 73 8.017 7.615 6.065 1.00 0.00 O ATOM 1077 CB ASP A 73 10.428 7.879 7.615 1.00 0.00 C ATOM 1078 CG ASP A 73 11.040 6.878 6.625 1.00 0.00 C ATOM 1079 OD1 ASP A 73 11.631 7.321 5.610 1.00 0.00 O ATOM 1080 OD2 ASP A 73 10.954 5.653 6.876 1.00 0.00 O ATOM 0 H ASP A 73 9.243 9.676 8.846 1.00 0.00 H new ATOM 0 HA ASP A 73 10.512 9.485 6.215 1.00 0.00 H new ATOM 0 HB2 ASP A 73 11.204 8.237 8.291 1.00 0.00 H new ATOM 0 HB3 ASP A 73 9.682 7.371 8.226 1.00 0.00 H new ATOM 1085 N LEU A 74 8.115 9.708 5.232 1.00 0.00 N ATOM 1086 CA LEU A 74 6.852 9.714 4.483 1.00 0.00 C ATOM 1087 C LEU A 74 6.832 8.886 3.184 1.00 0.00 C ATOM 1088 O LEU A 74 7.856 8.682 2.526 1.00 0.00 O ATOM 1089 CB LEU A 74 6.389 11.182 4.299 1.00 0.00 C ATOM 1090 CG LEU A 74 7.337 12.140 3.536 1.00 0.00 C ATOM 1091 CD1 LEU A 74 7.216 12.038 2.012 1.00 0.00 C ATOM 1092 CD2 LEU A 74 7.007 13.588 3.912 1.00 0.00 C ATOM 0 H LEU A 74 8.648 10.567 5.097 1.00 0.00 H new ATOM 0 HA LEU A 74 6.121 9.174 5.085 1.00 0.00 H new ATOM 0 HB2 LEU A 74 5.432 11.170 3.778 1.00 0.00 H new ATOM 0 HB3 LEU A 74 6.208 11.604 5.288 1.00 0.00 H new ATOM 0 HG LEU A 74 8.348 11.850 3.822 1.00 0.00 H new ATOM 0 HD11 LEU A 74 7.909 12.737 1.544 1.00 0.00 H new ATOM 0 HD12 LEU A 74 7.456 11.023 1.695 1.00 0.00 H new ATOM 0 HD13 LEU A 74 6.197 12.281 1.711 1.00 0.00 H new ATOM 0 HD21 LEU A 74 7.673 14.264 3.376 1.00 0.00 H new ATOM 0 HD22 LEU A 74 5.974 13.807 3.643 1.00 0.00 H new ATOM 0 HD23 LEU A 74 7.139 13.724 4.985 1.00 0.00 H new ATOM 1104 N SER A 75 5.626 8.459 2.798 1.00 0.00 N ATOM 1105 CA SER A 75 5.332 7.781 1.523 1.00 0.00 C ATOM 1106 C SER A 75 5.141 8.779 0.368 1.00 0.00 C ATOM 1107 O SER A 75 4.787 9.937 0.584 1.00 0.00 O ATOM 1108 CB SER A 75 4.092 6.883 1.673 1.00 0.00 C ATOM 1109 OG SER A 75 4.341 5.819 2.582 1.00 0.00 O ATOM 0 H SER A 75 4.797 8.578 3.381 1.00 0.00 H new ATOM 0 HA SER A 75 6.194 7.162 1.273 1.00 0.00 H new ATOM 0 HB2 SER A 75 3.249 7.477 2.025 1.00 0.00 H new ATOM 0 HB3 SER A 75 3.812 6.478 0.701 1.00 0.00 H new ATOM 0 HG SER A 75 3.538 5.263 2.662 1.00 0.00 H new ATOM 1115 N VAL A 76 5.350 8.321 -0.877 1.00 0.00 N ATOM 1116 CA VAL A 76 5.378 9.182 -2.090 1.00 0.00 C ATOM 1117 C VAL A 76 4.077 9.202 -2.919 1.00 0.00 C ATOM 1118 O VAL A 76 4.007 9.924 -3.913 1.00 0.00 O ATOM 1119 CB VAL A 76 6.613 8.873 -2.963 1.00 0.00 C ATOM 1120 CG1 VAL A 76 7.908 9.145 -2.188 1.00 0.00 C ATOM 1121 CG2 VAL A 76 6.644 7.425 -3.467 1.00 0.00 C ATOM 0 H VAL A 76 5.507 7.334 -1.081 1.00 0.00 H new ATOM 0 HA VAL A 76 5.460 10.200 -1.708 1.00 0.00 H new ATOM 0 HB VAL A 76 6.538 9.533 -3.827 1.00 0.00 H new ATOM 0 HG11 VAL A 76 8.766 8.921 -2.822 1.00 0.00 H new ATOM 0 HG12 VAL A 76 7.941 10.193 -1.891 1.00 0.00 H new ATOM 0 HG13 VAL A 76 7.939 8.515 -1.299 1.00 0.00 H new ATOM 0 HG21 VAL A 76 7.536 7.270 -4.074 1.00 0.00 H new ATOM 0 HG22 VAL A 76 6.662 6.744 -2.616 1.00 0.00 H new ATOM 0 HG23 VAL A 76 5.757 7.230 -4.069 1.00 0.00 H new ATOM 1131 N LYS A 77 3.050 8.453 -2.479 1.00 0.00 N ATOM 1132 CA LYS A 77 1.709 8.266 -3.092 1.00 0.00 C ATOM 1133 C LYS A 77 1.686 7.600 -4.484 1.00 0.00 C ATOM 1134 O LYS A 77 2.621 7.716 -5.279 1.00 0.00 O ATOM 1135 CB LYS A 77 0.884 9.572 -3.050 1.00 0.00 C ATOM 1136 CG LYS A 77 0.685 10.114 -1.624 1.00 0.00 C ATOM 1137 CD LYS A 77 -0.219 11.355 -1.621 1.00 0.00 C ATOM 1138 CE LYS A 77 -0.414 11.867 -0.186 1.00 0.00 C ATOM 1139 NZ LYS A 77 -1.304 13.061 -0.144 1.00 0.00 N ATOM 0 H LYS A 77 3.137 7.916 -1.616 1.00 0.00 H new ATOM 0 HA LYS A 77 1.223 7.525 -2.457 1.00 0.00 H new ATOM 0 HB2 LYS A 77 1.383 10.330 -3.654 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -0.091 9.394 -3.504 1.00 0.00 H new ATOM 0 HG2 LYS A 77 0.245 9.339 -0.996 1.00 0.00 H new ATOM 0 HG3 LYS A 77 1.653 10.365 -1.190 1.00 0.00 H new ATOM 0 HD2 LYS A 77 0.224 12.138 -2.237 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -1.185 11.111 -2.062 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -0.840 11.074 0.429 1.00 0.00 H new ATOM 0 HE3 LYS A 77 0.555 12.120 0.245 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -1.413 13.379 0.840 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -0.885 13.826 -0.711 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -2.236 12.813 -0.532 1.00 0.00 H new ATOM 1153 N GLY A 78 0.585 6.895 -4.765 1.00 0.00 N ATOM 1154 CA GLY A 78 0.365 6.106 -5.990 1.00 0.00 C ATOM 1155 C GLY A 78 1.280 4.879 -6.125 1.00 0.00 C ATOM 1156 O GLY A 78 2.046 4.546 -5.218 1.00 0.00 O ATOM 0 H GLY A 78 -0.208 6.854 -4.125 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -0.673 5.775 -6.013 1.00 0.00 H new ATOM 0 HA3 GLY A 78 0.513 6.752 -6.856 1.00 0.00 H new ATOM 1160 N MET A 79 1.219 4.209 -7.284 1.00 0.00 N ATOM 1161 CA MET A 79 2.184 3.161 -7.654 1.00 0.00 C ATOM 1162 C MET A 79 3.577 3.797 -7.824 1.00 0.00 C ATOM 1163 O MET A 79 3.690 4.897 -8.369 1.00 0.00 O ATOM 1164 CB MET A 79 1.706 2.445 -8.929 1.00 0.00 C ATOM 1165 CG MET A 79 2.581 1.235 -9.290 1.00 0.00 C ATOM 1166 SD MET A 79 2.067 0.331 -10.780 1.00 0.00 S ATOM 1167 CE MET A 79 0.527 -0.445 -10.207 1.00 0.00 C ATOM 0 H MET A 79 0.502 4.376 -7.990 1.00 0.00 H new ATOM 0 HA MET A 79 2.255 2.408 -6.869 1.00 0.00 H new ATOM 0 HB2 MET A 79 0.676 2.116 -8.792 1.00 0.00 H new ATOM 0 HB3 MET A 79 1.707 3.151 -9.760 1.00 0.00 H new ATOM 0 HG2 MET A 79 3.607 1.576 -9.426 1.00 0.00 H new ATOM 0 HG3 MET A 79 2.584 0.544 -8.447 1.00 0.00 H new ATOM 0 HE1 MET A 79 0.150 -1.118 -10.977 1.00 0.00 H new ATOM 0 HE2 MET A 79 0.721 -1.009 -9.295 1.00 0.00 H new ATOM 0 HE3 MET A 79 -0.216 0.327 -10.005 1.00 0.00 H new ATOM 1177 N LEU A 80 4.638 3.137 -7.349 1.00 0.00 N ATOM 1178 CA LEU A 80 5.980 3.727 -7.242 1.00 0.00 C ATOM 1179 C LEU A 80 7.107 2.883 -7.849 1.00 0.00 C ATOM 1180 O LEU A 80 7.019 1.657 -7.925 1.00 0.00 O ATOM 1181 CB LEU A 80 6.268 4.173 -5.791 1.00 0.00 C ATOM 1182 CG LEU A 80 6.476 3.077 -4.727 1.00 0.00 C ATOM 1183 CD1 LEU A 80 6.910 3.750 -3.420 1.00 0.00 C ATOM 1184 CD2 LEU A 80 5.212 2.267 -4.434 1.00 0.00 C ATOM 0 H LEU A 80 4.591 2.171 -7.025 1.00 0.00 H new ATOM 0 HA LEU A 80 5.969 4.616 -7.873 1.00 0.00 H new ATOM 0 HB2 LEU A 80 7.160 4.799 -5.805 1.00 0.00 H new ATOM 0 HB3 LEU A 80 5.441 4.803 -5.465 1.00 0.00 H new ATOM 0 HG LEU A 80 7.226 2.390 -5.119 1.00 0.00 H new ATOM 0 HD11 LEU A 80 7.063 2.991 -2.653 1.00 0.00 H new ATOM 0 HD12 LEU A 80 7.841 4.294 -3.582 1.00 0.00 H new ATOM 0 HD13 LEU A 80 6.136 4.445 -3.094 1.00 0.00 H new ATOM 0 HD21 LEU A 80 5.430 1.514 -3.677 1.00 0.00 H new ATOM 0 HD22 LEU A 80 4.430 2.933 -4.069 1.00 0.00 H new ATOM 0 HD23 LEU A 80 4.874 1.776 -5.347 1.00 0.00 H new ATOM 1196 N TYR A 81 8.173 3.568 -8.276 1.00 0.00 N ATOM 1197 CA TYR A 81 9.343 2.984 -8.943 1.00 0.00 C ATOM 1198 C TYR A 81 10.644 3.739 -8.603 1.00 0.00 C ATOM 1199 O TYR A 81 10.614 4.909 -8.227 1.00 0.00 O ATOM 1200 CB TYR A 81 9.087 2.942 -10.460 1.00 0.00 C ATOM 1201 CG TYR A 81 10.202 2.289 -11.257 1.00 0.00 C ATOM 1202 CD1 TYR A 81 10.464 0.915 -11.091 1.00 0.00 C ATOM 1203 CD2 TYR A 81 11.004 3.061 -12.122 1.00 0.00 C ATOM 1204 CE1 TYR A 81 11.540 0.317 -11.776 1.00 0.00 C ATOM 1205 CE2 TYR A 81 12.077 2.463 -12.811 1.00 0.00 C ATOM 1206 CZ TYR A 81 12.352 1.089 -12.637 1.00 0.00 C ATOM 1207 OH TYR A 81 13.392 0.498 -13.289 1.00 0.00 O ATOM 0 H TYR A 81 8.248 4.579 -8.163 1.00 0.00 H new ATOM 0 HA TYR A 81 9.485 1.968 -8.576 1.00 0.00 H new ATOM 0 HB2 TYR A 81 8.158 2.404 -10.646 1.00 0.00 H new ATOM 0 HB3 TYR A 81 8.944 3.960 -10.822 1.00 0.00 H new ATOM 0 HD1 TYR A 81 9.841 0.321 -10.439 1.00 0.00 H new ATOM 0 HD2 TYR A 81 10.795 4.112 -12.256 1.00 0.00 H new ATOM 0 HE1 TYR A 81 11.745 -0.735 -11.643 1.00 0.00 H new ATOM 0 HE2 TYR A 81 12.690 3.056 -13.473 1.00 0.00 H new ATOM 0 HH TYR A 81 13.851 1.163 -13.843 1.00 0.00 H new ATOM 1217 N ASP A 82 11.793 3.071 -8.750 1.00 0.00 N ATOM 1218 CA ASP A 82 13.121 3.571 -8.354 1.00 0.00 C ATOM 1219 C ASP A 82 13.529 4.888 -9.048 1.00 0.00 C ATOM 1220 O ASP A 82 14.119 5.764 -8.412 1.00 0.00 O ATOM 1221 CB ASP A 82 14.141 2.469 -8.668 1.00 0.00 C ATOM 1222 CG ASP A 82 15.558 2.823 -8.180 1.00 0.00 C ATOM 1223 OD1 ASP A 82 15.857 2.585 -6.986 1.00 0.00 O ATOM 1224 OD2 ASP A 82 16.386 3.289 -8.999 1.00 0.00 O ATOM 0 H ASP A 82 11.829 2.138 -9.160 1.00 0.00 H new ATOM 0 HA ASP A 82 13.089 3.807 -7.290 1.00 0.00 H new ATOM 0 HB2 ASP A 82 13.821 1.538 -8.201 1.00 0.00 H new ATOM 0 HB3 ASP A 82 14.163 2.294 -9.744 1.00 0.00 H new ATOM 1229 N SER A 83 13.178 5.045 -10.333 1.00 0.00 N ATOM 1230 CA SER A 83 13.579 6.183 -11.188 1.00 0.00 C ATOM 1231 C SER A 83 12.467 7.225 -11.420 1.00 0.00 C ATOM 1232 O SER A 83 12.586 8.064 -12.314 1.00 0.00 O ATOM 1233 CB SER A 83 14.116 5.676 -12.539 1.00 0.00 C ATOM 1234 OG SER A 83 15.040 4.604 -12.396 1.00 0.00 O ATOM 0 H SER A 83 12.592 4.369 -10.823 1.00 0.00 H new ATOM 0 HA SER A 83 14.366 6.700 -10.638 1.00 0.00 H new ATOM 0 HB2 SER A 83 13.280 5.350 -13.158 1.00 0.00 H new ATOM 0 HB3 SER A 83 14.600 6.499 -13.065 1.00 0.00 H new ATOM 0 HG SER A 83 15.349 4.318 -13.281 1.00 0.00 H new ATOM 1240 N ASP A 84 11.359 7.163 -10.669 1.00 0.00 N ATOM 1241 CA ASP A 84 10.151 7.960 -10.934 1.00 0.00 C ATOM 1242 C ASP A 84 10.355 9.476 -10.722 1.00 0.00 C ATOM 1243 O ASP A 84 10.638 9.930 -9.613 1.00 0.00 O ATOM 1244 CB ASP A 84 9.011 7.431 -10.062 1.00 0.00 C ATOM 1245 CG ASP A 84 7.687 8.131 -10.420 1.00 0.00 C ATOM 1246 OD1 ASP A 84 7.470 9.282 -9.974 1.00 0.00 O ATOM 1247 OD2 ASP A 84 6.890 7.548 -11.196 1.00 0.00 O ATOM 0 H ASP A 84 11.274 6.555 -9.855 1.00 0.00 H new ATOM 0 HA ASP A 84 9.904 7.848 -11.990 1.00 0.00 H new ATOM 0 HB2 ASP A 84 8.909 6.355 -10.201 1.00 0.00 H new ATOM 0 HB3 ASP A 84 9.243 7.596 -9.010 1.00 0.00 H new ATOM 1252 N SER A 85 10.179 10.279 -11.779 1.00 0.00 N ATOM 1253 CA SER A 85 10.474 11.723 -11.786 1.00 0.00 C ATOM 1254 C SER A 85 9.697 12.516 -10.729 1.00 0.00 C ATOM 1255 O SER A 85 10.301 13.225 -9.919 1.00 0.00 O ATOM 1256 CB SER A 85 10.203 12.296 -13.188 1.00 0.00 C ATOM 1257 OG SER A 85 8.911 11.914 -13.649 1.00 0.00 O ATOM 0 H SER A 85 9.821 9.940 -12.672 1.00 0.00 H new ATOM 0 HA SER A 85 11.527 11.830 -11.527 1.00 0.00 H new ATOM 0 HB2 SER A 85 10.278 13.383 -13.162 1.00 0.00 H new ATOM 0 HB3 SER A 85 10.962 11.940 -13.884 1.00 0.00 H new ATOM 0 HG SER A 85 8.758 12.290 -14.541 1.00 0.00 H new ATOM 1263 N GLN A 86 8.369 12.374 -10.689 1.00 0.00 N ATOM 1264 CA GLN A 86 7.512 13.117 -9.761 1.00 0.00 C ATOM 1265 C GLN A 86 7.663 12.654 -8.303 1.00 0.00 C ATOM 1266 O GLN A 86 7.637 13.486 -7.401 1.00 0.00 O ATOM 1267 CB GLN A 86 6.048 13.130 -10.244 1.00 0.00 C ATOM 1268 CG GLN A 86 5.403 11.744 -10.415 1.00 0.00 C ATOM 1269 CD GLN A 86 3.943 11.786 -10.873 1.00 0.00 C ATOM 1270 OE1 GLN A 86 3.298 12.822 -10.978 1.00 0.00 O ATOM 1271 NE2 GLN A 86 3.353 10.642 -11.155 1.00 0.00 N ATOM 0 H GLN A 86 7.857 11.739 -11.301 1.00 0.00 H new ATOM 0 HA GLN A 86 7.857 14.151 -9.764 1.00 0.00 H new ATOM 0 HB2 GLN A 86 5.453 13.705 -9.534 1.00 0.00 H new ATOM 0 HB3 GLN A 86 6.001 13.655 -11.198 1.00 0.00 H new ATOM 0 HG2 GLN A 86 5.983 11.172 -11.139 1.00 0.00 H new ATOM 0 HG3 GLN A 86 5.460 11.209 -9.467 1.00 0.00 H new ATOM 0 HE21 GLN A 86 3.871 9.767 -11.074 1.00 0.00 H new ATOM 0 HE22 GLN A 86 2.378 10.631 -11.454 1.00 0.00 H new ATOM 1280 N GLN A 87 7.896 11.366 -8.040 1.00 0.00 N ATOM 1281 CA GLN A 87 8.103 10.857 -6.675 1.00 0.00 C ATOM 1282 C GLN A 87 9.493 11.202 -6.125 1.00 0.00 C ATOM 1283 O GLN A 87 9.593 11.601 -4.963 1.00 0.00 O ATOM 1284 CB GLN A 87 7.847 9.347 -6.650 1.00 0.00 C ATOM 1285 CG GLN A 87 6.354 9.027 -6.858 1.00 0.00 C ATOM 1286 CD GLN A 87 6.083 7.562 -7.185 1.00 0.00 C ATOM 1287 OE1 GLN A 87 6.949 6.799 -7.594 1.00 0.00 O ATOM 1288 NE2 GLN A 87 4.858 7.111 -7.029 1.00 0.00 N ATOM 0 H GLN A 87 7.947 10.646 -8.761 1.00 0.00 H new ATOM 0 HA GLN A 87 7.390 11.352 -6.016 1.00 0.00 H new ATOM 0 HB2 GLN A 87 8.436 8.863 -7.429 1.00 0.00 H new ATOM 0 HB3 GLN A 87 8.180 8.936 -5.697 1.00 0.00 H new ATOM 0 HG2 GLN A 87 5.804 9.297 -5.956 1.00 0.00 H new ATOM 0 HG3 GLN A 87 5.967 9.648 -7.666 1.00 0.00 H new ATOM 0 HE21 GLN A 87 4.125 7.733 -6.689 1.00 0.00 H new ATOM 0 HE22 GLN A 87 4.641 6.139 -7.248 1.00 0.00 H new ATOM 1297 N ILE A 88 10.542 11.145 -6.957 1.00 0.00 N ATOM 1298 CA ILE A 88 11.875 11.662 -6.606 1.00 0.00 C ATOM 1299 C ILE A 88 11.779 13.165 -6.312 1.00 0.00 C ATOM 1300 O ILE A 88 12.254 13.604 -5.269 1.00 0.00 O ATOM 1301 CB ILE A 88 12.907 11.345 -7.719 1.00 0.00 C ATOM 1302 CG1 ILE A 88 13.177 9.826 -7.855 1.00 0.00 C ATOM 1303 CG2 ILE A 88 14.239 12.094 -7.517 1.00 0.00 C ATOM 1304 CD1 ILE A 88 14.093 9.198 -6.800 1.00 0.00 C ATOM 0 H ILE A 88 10.492 10.740 -7.892 1.00 0.00 H new ATOM 0 HA ILE A 88 12.231 11.163 -5.705 1.00 0.00 H new ATOM 0 HB ILE A 88 12.453 11.698 -8.645 1.00 0.00 H new ATOM 0 HG12 ILE A 88 12.220 9.306 -7.829 1.00 0.00 H new ATOM 0 HG13 ILE A 88 13.613 9.643 -8.837 1.00 0.00 H new ATOM 0 HG21 ILE A 88 14.927 11.837 -8.323 1.00 0.00 H new ATOM 0 HG22 ILE A 88 14.057 13.169 -7.524 1.00 0.00 H new ATOM 0 HG23 ILE A 88 14.677 11.806 -6.561 1.00 0.00 H new ATOM 0 HD11 ILE A 88 14.205 8.133 -7.003 1.00 0.00 H new ATOM 0 HD12 ILE A 88 15.071 9.678 -6.835 1.00 0.00 H new ATOM 0 HD13 ILE A 88 13.656 9.335 -5.811 1.00 0.00 H new ATOM 1316 N LEU A 89 11.090 13.949 -7.155 1.00 0.00 N ATOM 1317 CA LEU A 89 10.855 15.376 -6.899 1.00 0.00 C ATOM 1318 C LEU A 89 10.090 15.619 -5.596 1.00 0.00 C ATOM 1319 O LEU A 89 10.555 16.404 -4.778 1.00 0.00 O ATOM 1320 CB LEU A 89 10.129 16.007 -8.108 1.00 0.00 C ATOM 1321 CG LEU A 89 9.720 17.486 -7.933 1.00 0.00 C ATOM 1322 CD1 LEU A 89 10.916 18.412 -7.703 1.00 0.00 C ATOM 1323 CD2 LEU A 89 8.988 17.973 -9.185 1.00 0.00 C ATOM 0 H LEU A 89 10.683 13.613 -8.028 1.00 0.00 H new ATOM 0 HA LEU A 89 11.824 15.860 -6.773 1.00 0.00 H new ATOM 0 HB2 LEU A 89 10.776 15.927 -8.982 1.00 0.00 H new ATOM 0 HB3 LEU A 89 9.234 15.422 -8.319 1.00 0.00 H new ATOM 0 HG LEU A 89 9.079 17.524 -7.052 1.00 0.00 H new ATOM 0 HD11 LEU A 89 10.565 19.437 -7.587 1.00 0.00 H new ATOM 0 HD12 LEU A 89 11.445 18.106 -6.801 1.00 0.00 H new ATOM 0 HD13 LEU A 89 11.591 18.354 -8.557 1.00 0.00 H new ATOM 0 HD21 LEU A 89 8.702 19.017 -9.056 1.00 0.00 H new ATOM 0 HD22 LEU A 89 9.645 17.881 -10.050 1.00 0.00 H new ATOM 0 HD23 LEU A 89 8.095 17.369 -9.342 1.00 0.00 H new ATOM 1335 N ASN A 90 8.960 14.949 -5.363 1.00 0.00 N ATOM 1336 CA ASN A 90 8.140 15.180 -4.170 1.00 0.00 C ATOM 1337 C ASN A 90 8.915 14.858 -2.883 1.00 0.00 C ATOM 1338 O ASN A 90 8.977 15.701 -1.984 1.00 0.00 O ATOM 1339 CB ASN A 90 6.826 14.376 -4.290 1.00 0.00 C ATOM 1340 CG ASN A 90 5.841 14.944 -5.312 1.00 0.00 C ATOM 1341 OD1 ASN A 90 6.009 16.016 -5.877 1.00 0.00 O ATOM 1342 ND2 ASN A 90 4.752 14.246 -5.556 1.00 0.00 N ATOM 0 H ASN A 90 8.589 14.236 -5.990 1.00 0.00 H new ATOM 0 HA ASN A 90 7.886 16.238 -4.106 1.00 0.00 H new ATOM 0 HB2 ASN A 90 7.065 13.348 -4.563 1.00 0.00 H new ATOM 0 HB3 ASN A 90 6.342 14.342 -3.314 1.00 0.00 H new ATOM 0 HD21 ASN A 90 4.056 14.600 -6.212 1.00 0.00 H new ATOM 0 HD22 ASN A 90 4.604 13.351 -5.089 1.00 0.00 H new ATOM 1349 N ARG A 91 9.596 13.702 -2.808 1.00 0.00 N ATOM 1350 CA ARG A 91 10.391 13.356 -1.613 1.00 0.00 C ATOM 1351 C ARG A 91 11.623 14.247 -1.462 1.00 0.00 C ATOM 1352 O ARG A 91 11.934 14.624 -0.341 1.00 0.00 O ATOM 1353 CB ARG A 91 10.722 11.848 -1.571 1.00 0.00 C ATOM 1354 CG ARG A 91 10.747 11.341 -0.112 1.00 0.00 C ATOM 1355 CD ARG A 91 11.149 9.863 0.001 1.00 0.00 C ATOM 1356 NE ARG A 91 10.611 9.251 1.237 1.00 0.00 N ATOM 1357 CZ ARG A 91 11.203 9.053 2.403 1.00 0.00 C ATOM 1358 NH1 ARG A 91 12.387 9.496 2.712 1.00 0.00 N ATOM 1359 NH2 ARG A 91 10.586 8.368 3.308 1.00 0.00 N ATOM 0 H ARG A 91 9.614 13.000 -3.547 1.00 0.00 H new ATOM 0 HA ARG A 91 9.774 13.559 -0.738 1.00 0.00 H new ATOM 0 HB2 ARG A 91 9.981 11.291 -2.143 1.00 0.00 H new ATOM 0 HB3 ARG A 91 11.689 11.668 -2.041 1.00 0.00 H new ATOM 0 HG2 ARG A 91 11.445 11.947 0.466 1.00 0.00 H new ATOM 0 HG3 ARG A 91 9.761 11.479 0.332 1.00 0.00 H new ATOM 0 HD2 ARG A 91 10.781 9.317 -0.867 1.00 0.00 H new ATOM 0 HD3 ARG A 91 12.236 9.778 -0.006 1.00 0.00 H new ATOM 0 HE ARG A 91 9.642 8.936 1.181 1.00 0.00 H new ATOM 0 HH11 ARG A 91 12.923 10.036 2.033 1.00 0.00 H new ATOM 0 HH12 ARG A 91 12.779 9.303 3.634 1.00 0.00 H new ATOM 0 HH21 ARG A 91 9.658 7.990 3.117 1.00 0.00 H new ATOM 0 HH22 ARG A 91 11.027 8.205 4.213 1.00 0.00 H new ATOM 1373 N LEU A 92 12.259 14.680 -2.557 1.00 0.00 N ATOM 1374 CA LEU A 92 13.371 15.644 -2.500 1.00 0.00 C ATOM 1375 C LEU A 92 12.903 17.029 -2.031 1.00 0.00 C ATOM 1376 O LEU A 92 13.570 17.653 -1.213 1.00 0.00 O ATOM 1377 CB LEU A 92 14.040 15.704 -3.888 1.00 0.00 C ATOM 1378 CG LEU A 92 15.247 16.654 -4.010 1.00 0.00 C ATOM 1379 CD1 LEU A 92 16.438 16.206 -3.164 1.00 0.00 C ATOM 1380 CD2 LEU A 92 15.676 16.698 -5.472 1.00 0.00 C ATOM 0 H LEU A 92 12.022 14.377 -3.502 1.00 0.00 H new ATOM 0 HA LEU A 92 14.100 15.310 -1.762 1.00 0.00 H new ATOM 0 HB2 LEU A 92 14.364 14.699 -4.158 1.00 0.00 H new ATOM 0 HB3 LEU A 92 13.290 16.004 -4.619 1.00 0.00 H new ATOM 0 HG LEU A 92 14.938 17.634 -3.647 1.00 0.00 H new ATOM 0 HD11 LEU A 92 17.259 16.912 -3.289 1.00 0.00 H new ATOM 0 HD12 LEU A 92 16.146 16.171 -2.114 1.00 0.00 H new ATOM 0 HD13 LEU A 92 16.760 15.215 -3.485 1.00 0.00 H new ATOM 0 HD21 LEU A 92 16.530 17.366 -5.581 1.00 0.00 H new ATOM 0 HD22 LEU A 92 15.954 15.696 -5.800 1.00 0.00 H new ATOM 0 HD23 LEU A 92 14.850 17.063 -6.083 1.00 0.00 H new ATOM 1392 N ARG A 93 11.738 17.495 -2.496 1.00 0.00 N ATOM 1393 CA ARG A 93 11.196 18.823 -2.163 1.00 0.00 C ATOM 1394 C ARG A 93 10.762 18.884 -0.706 1.00 0.00 C ATOM 1395 O ARG A 93 11.102 19.843 -0.027 1.00 0.00 O ATOM 1396 CB ARG A 93 10.078 19.175 -3.165 1.00 0.00 C ATOM 1397 CG ARG A 93 9.666 20.656 -3.124 1.00 0.00 C ATOM 1398 CD ARG A 93 8.695 20.982 -4.273 1.00 0.00 C ATOM 1399 NE ARG A 93 8.773 22.399 -4.671 1.00 0.00 N ATOM 1400 CZ ARG A 93 8.149 23.448 -4.178 1.00 0.00 C ATOM 1401 NH1 ARG A 93 7.314 23.387 -3.177 1.00 0.00 N ATOM 1402 NH2 ARG A 93 8.387 24.600 -4.724 1.00 0.00 N ATOM 0 H ARG A 93 11.137 16.957 -3.121 1.00 0.00 H new ATOM 0 HA ARG A 93 11.969 19.585 -2.261 1.00 0.00 H new ATOM 0 HB2 ARG A 93 10.411 18.926 -4.172 1.00 0.00 H new ATOM 0 HB3 ARG A 93 9.205 18.557 -2.956 1.00 0.00 H new ATOM 0 HG2 ARG A 93 9.194 20.881 -2.168 1.00 0.00 H new ATOM 0 HG3 ARG A 93 10.551 21.287 -3.199 1.00 0.00 H new ATOM 0 HD2 ARG A 93 8.923 20.350 -5.132 1.00 0.00 H new ATOM 0 HD3 ARG A 93 7.676 20.746 -3.966 1.00 0.00 H new ATOM 0 HE ARG A 93 9.406 22.597 -5.446 1.00 0.00 H new ATOM 0 HH11 ARG A 93 7.115 22.491 -2.733 1.00 0.00 H new ATOM 0 HH12 ARG A 93 6.860 24.236 -2.839 1.00 0.00 H new ATOM 0 HH21 ARG A 93 9.038 24.669 -5.506 1.00 0.00 H new ATOM 0 HH22 ARG A 93 7.923 25.437 -4.371 1.00 0.00 H new ATOM 1416 N GLU A 94 10.136 17.828 -0.190 1.00 0.00 N ATOM 1417 CA GLU A 94 9.859 17.685 1.250 1.00 0.00 C ATOM 1418 C GLU A 94 11.151 17.631 2.080 1.00 0.00 C ATOM 1419 O GLU A 94 11.339 18.446 2.983 1.00 0.00 O ATOM 1420 CB GLU A 94 9.025 16.411 1.483 1.00 0.00 C ATOM 1421 CG GLU A 94 7.580 16.563 1.001 1.00 0.00 C ATOM 1422 CD GLU A 94 6.797 17.607 1.828 1.00 0.00 C ATOM 1423 OE1 GLU A 94 6.856 17.565 3.082 1.00 0.00 O ATOM 1424 OE2 GLU A 94 6.122 18.477 1.226 1.00 0.00 O ATOM 0 H GLU A 94 9.804 17.044 -0.752 1.00 0.00 H new ATOM 0 HA GLU A 94 9.300 18.562 1.578 1.00 0.00 H new ATOM 0 HB2 GLU A 94 9.492 15.574 0.964 1.00 0.00 H new ATOM 0 HB3 GLU A 94 9.027 16.168 2.546 1.00 0.00 H new ATOM 0 HG2 GLU A 94 7.578 16.857 -0.049 1.00 0.00 H new ATOM 0 HG3 GLU A 94 7.075 15.599 1.063 1.00 0.00 H new ATOM 1431 N ARG A 95 12.074 16.725 1.724 1.00 0.00 N ATOM 1432 CA ARG A 95 13.345 16.488 2.439 1.00 0.00 C ATOM 1433 C ARG A 95 14.240 17.734 2.501 1.00 0.00 C ATOM 1434 O ARG A 95 14.925 17.941 3.501 1.00 0.00 O ATOM 1435 CB ARG A 95 14.017 15.283 1.752 1.00 0.00 C ATOM 1436 CG ARG A 95 15.384 14.853 2.295 1.00 0.00 C ATOM 1437 CD ARG A 95 15.805 13.530 1.626 1.00 0.00 C ATOM 1438 NE ARG A 95 17.259 13.363 1.677 1.00 0.00 N ATOM 1439 CZ ARG A 95 17.970 12.266 1.513 1.00 0.00 C ATOM 1440 NH1 ARG A 95 17.479 11.084 1.323 1.00 0.00 N ATOM 1441 NH2 ARG A 95 19.254 12.381 1.533 1.00 0.00 N ATOM 0 H ARG A 95 11.958 16.120 0.911 1.00 0.00 H new ATOM 0 HA ARG A 95 13.158 16.264 3.489 1.00 0.00 H new ATOM 0 HB2 ARG A 95 13.340 14.431 1.822 1.00 0.00 H new ATOM 0 HB3 ARG A 95 14.130 15.515 0.693 1.00 0.00 H new ATOM 0 HG2 ARG A 95 16.126 15.626 2.097 1.00 0.00 H new ATOM 0 HG3 ARG A 95 15.335 14.727 3.377 1.00 0.00 H new ATOM 0 HD2 ARG A 95 15.320 12.693 2.128 1.00 0.00 H new ATOM 0 HD3 ARG A 95 15.469 13.518 0.589 1.00 0.00 H new ATOM 0 HE ARG A 95 17.794 14.211 1.865 1.00 0.00 H new ATOM 0 HH11 ARG A 95 16.468 10.951 1.291 1.00 0.00 H new ATOM 0 HH12 ARG A 95 18.103 10.286 1.205 1.00 0.00 H new ATOM 0 HH21 ARG A 95 19.682 13.296 1.672 1.00 0.00 H new ATOM 0 HH22 ARG A 95 19.842 11.557 1.410 1.00 0.00 H new ATOM 1455 N VAL A 96 14.199 18.580 1.467 1.00 0.00 N ATOM 1456 CA VAL A 96 14.931 19.862 1.415 1.00 0.00 C ATOM 1457 C VAL A 96 14.166 21.021 2.071 1.00 0.00 C ATOM 1458 O VAL A 96 14.787 21.842 2.749 1.00 0.00 O ATOM 1459 CB VAL A 96 15.337 20.179 -0.038 1.00 0.00 C ATOM 1460 CG1 VAL A 96 15.941 21.576 -0.215 1.00 0.00 C ATOM 1461 CG2 VAL A 96 16.404 19.172 -0.479 1.00 0.00 C ATOM 0 H VAL A 96 13.650 18.396 0.627 1.00 0.00 H new ATOM 0 HA VAL A 96 15.837 19.747 2.011 1.00 0.00 H new ATOM 0 HB VAL A 96 14.425 20.125 -0.632 1.00 0.00 H new ATOM 0 HG11 VAL A 96 16.203 21.729 -1.262 1.00 0.00 H new ATOM 0 HG12 VAL A 96 15.214 22.328 0.091 1.00 0.00 H new ATOM 0 HG13 VAL A 96 16.837 21.666 0.400 1.00 0.00 H new ATOM 0 HG21 VAL A 96 16.702 19.384 -1.506 1.00 0.00 H new ATOM 0 HG22 VAL A 96 17.273 19.253 0.174 1.00 0.00 H new ATOM 0 HG23 VAL A 96 15.998 18.162 -0.420 1.00 0.00 H new ATOM 1471 N SER A 97 12.837 21.099 1.914 1.00 0.00 N ATOM 1472 CA SER A 97 12.041 22.207 2.481 1.00 0.00 C ATOM 1473 C SER A 97 11.922 22.132 4.012 1.00 0.00 C ATOM 1474 O SER A 97 11.884 23.170 4.680 1.00 0.00 O ATOM 1475 CB SER A 97 10.628 22.260 1.886 1.00 0.00 C ATOM 1476 OG SER A 97 10.677 22.477 0.485 1.00 0.00 O ATOM 0 H SER A 97 12.287 20.411 1.400 1.00 0.00 H new ATOM 0 HA SER A 97 12.586 23.113 2.215 1.00 0.00 H new ATOM 0 HB2 SER A 97 10.106 21.327 2.095 1.00 0.00 H new ATOM 0 HB3 SER A 97 10.058 23.058 2.362 1.00 0.00 H new ATOM 0 HG SER A 97 10.849 21.627 0.028 1.00 0.00 H new ATOM 1482 N GLY A 98 11.892 20.916 4.579 1.00 0.00 N ATOM 1483 CA GLY A 98 11.811 20.679 6.025 1.00 0.00 C ATOM 1484 C GLY A 98 10.415 20.898 6.634 1.00 0.00 C ATOM 1485 O GLY A 98 9.463 21.307 5.964 1.00 0.00 O ATOM 0 H GLY A 98 11.924 20.055 4.033 1.00 0.00 H new ATOM 0 HA2 GLY A 98 12.126 19.656 6.230 1.00 0.00 H new ATOM 0 HA3 GLY A 98 12.519 21.337 6.528 1.00 0.00 H new ATOM 1489 N SER A 99 10.304 20.606 7.931 1.00 0.00 N ATOM 1490 CA SER A 99 9.111 20.839 8.763 1.00 0.00 C ATOM 1491 C SER A 99 9.033 22.284 9.288 1.00 0.00 C ATOM 1492 O SER A 99 10.050 22.973 9.408 1.00 0.00 O ATOM 1493 CB SER A 99 9.116 19.860 9.941 1.00 0.00 C ATOM 1494 OG SER A 99 9.044 18.529 9.450 1.00 0.00 O ATOM 0 H SER A 99 11.070 20.184 8.456 1.00 0.00 H new ATOM 0 HA SER A 99 8.234 20.676 8.136 1.00 0.00 H new ATOM 0 HB2 SER A 99 10.021 19.992 10.534 1.00 0.00 H new ATOM 0 HB3 SER A 99 8.271 20.062 10.600 1.00 0.00 H new ATOM 0 HG SER A 99 9.796 18.009 9.804 1.00 0.00 H new ATOM 1500 N THR A 100 7.824 22.737 9.644 1.00 0.00 N ATOM 1501 CA THR A 100 7.574 24.051 10.274 1.00 0.00 C ATOM 1502 C THR A 100 6.417 23.993 11.283 1.00 0.00 C ATOM 1503 O THR A 100 5.517 23.156 11.166 1.00 0.00 O ATOM 1504 CB THR A 100 7.342 25.147 9.217 1.00 0.00 C ATOM 1505 OG1 THR A 100 7.178 26.399 9.855 1.00 0.00 O ATOM 1506 CG2 THR A 100 6.116 24.912 8.332 1.00 0.00 C ATOM 0 H THR A 100 6.972 22.194 9.502 1.00 0.00 H new ATOM 0 HA THR A 100 8.473 24.314 10.831 1.00 0.00 H new ATOM 0 HB THR A 100 8.223 25.124 8.575 1.00 0.00 H new ATOM 0 HG1 THR A 100 7.032 27.094 9.179 1.00 0.00 H new ATOM 0 HG21 THR A 100 6.023 25.728 7.615 1.00 0.00 H new ATOM 0 HG22 THR A 100 6.229 23.969 7.797 1.00 0.00 H new ATOM 0 HG23 THR A 100 5.221 24.871 8.953 1.00 0.00 H new ATOM 1514 N ALA A 101 6.441 24.887 12.278 1.00 0.00 N ATOM 1515 CA ALA A 101 5.423 25.025 13.324 1.00 0.00 C ATOM 1516 C ALA A 101 4.431 26.190 13.082 1.00 0.00 C ATOM 1517 O ALA A 101 3.573 26.453 13.930 1.00 0.00 O ATOM 1518 CB ALA A 101 6.150 25.145 14.671 1.00 0.00 C ATOM 0 H ALA A 101 7.200 25.560 12.380 1.00 0.00 H new ATOM 0 HA ALA A 101 4.788 24.139 13.315 1.00 0.00 H new ATOM 0 HB1 ALA A 101 5.418 25.249 15.472 1.00 0.00 H new ATOM 0 HB2 ALA A 101 6.750 24.251 14.842 1.00 0.00 H new ATOM 0 HB3 ALA A 101 6.800 26.020 14.657 1.00 0.00 H new ATOM 1524 N GLN A 102 4.546 26.898 11.948 1.00 0.00 N ATOM 1525 CA GLN A 102 3.755 28.096 11.614 1.00 0.00 C ATOM 1526 C GLN A 102 3.303 28.146 10.140 1.00 0.00 C ATOM 1527 O GLN A 102 3.794 27.397 9.291 1.00 0.00 O ATOM 1528 CB GLN A 102 4.563 29.361 11.973 1.00 0.00 C ATOM 1529 CG GLN A 102 5.880 29.508 11.186 1.00 0.00 C ATOM 1530 CD GLN A 102 6.397 30.944 11.220 1.00 0.00 C ATOM 1531 OE1 GLN A 102 7.219 31.325 12.046 1.00 0.00 O ATOM 1532 NE2 GLN A 102 5.929 31.801 10.333 1.00 0.00 N ATOM 0 H GLN A 102 5.211 26.647 11.216 1.00 0.00 H new ATOM 0 HA GLN A 102 2.841 28.049 12.206 1.00 0.00 H new ATOM 0 HB2 GLN A 102 3.943 30.239 11.791 1.00 0.00 H new ATOM 0 HB3 GLN A 102 4.789 29.345 13.039 1.00 0.00 H new ATOM 0 HG2 GLN A 102 6.632 28.840 11.606 1.00 0.00 H new ATOM 0 HG3 GLN A 102 5.723 29.202 10.152 1.00 0.00 H new ATOM 0 HE21 GLN A 102 5.245 31.496 9.641 1.00 0.00 H new ATOM 0 HE22 GLN A 102 6.251 32.769 10.339 1.00 0.00 H new ATOM 1541 N SER A 103 2.393 29.075 9.830 1.00 0.00 N ATOM 1542 CA SER A 103 2.012 29.431 8.454 1.00 0.00 C ATOM 1543 C SER A 103 3.139 30.191 7.732 1.00 0.00 C ATOM 1544 O SER A 103 3.959 30.861 8.375 1.00 0.00 O ATOM 1545 CB SER A 103 0.734 30.283 8.451 1.00 0.00 C ATOM 1546 OG SER A 103 -0.339 29.578 9.069 1.00 0.00 O ATOM 0 H SER A 103 1.891 29.611 10.538 1.00 0.00 H new ATOM 0 HA SER A 103 1.828 28.500 7.918 1.00 0.00 H new ATOM 0 HB2 SER A 103 0.913 31.219 8.979 1.00 0.00 H new ATOM 0 HB3 SER A 103 0.465 30.541 7.427 1.00 0.00 H new ATOM 0 HG SER A 103 -1.145 30.136 9.060 1.00 0.00 H new ATOM 1552 N ALA A 104 3.168 30.109 6.396 1.00 0.00 N ATOM 1553 CA ALA A 104 4.144 30.764 5.513 1.00 0.00 C ATOM 1554 C ALA A 104 3.501 31.269 4.204 1.00 0.00 C ATOM 1555 O ALA A 104 2.703 30.525 3.584 1.00 0.00 O ATOM 1556 CB ALA A 104 5.300 29.787 5.242 1.00 0.00 C ATOM 1557 OXT ALA A 104 3.790 32.422 3.806 1.00 0.00 O ATOM 0 H ALA A 104 2.482 29.560 5.877 1.00 0.00 H new ATOM 0 HA ALA A 104 4.531 31.652 6.012 1.00 0.00 H new ATOM 0 HB1 ALA A 104 6.031 30.261 4.588 1.00 0.00 H new ATOM 0 HB2 ALA A 104 5.777 29.517 6.184 1.00 0.00 H new ATOM 0 HB3 ALA A 104 4.912 28.889 4.762 1.00 0.00 H new TER 1563 ALA A 104