USER MOD reduce.3.24.130724 H: found=0, std=0, add=1160, rem=0, adj=48 USER MOD reduce.3.24.130724 removed 1162 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 147 ASN : amide:sc= -0.705 K(o=0.0022,f=-1.1!) USER MOD Set 1.2: A 151 LYS NZ :NH3+ -162:sc= 0.708 (180deg=0.375) USER MOD Set 2.1: A 38 HIS : no HE2:sc= 0.037 K(o=0.037,f=-0.77) USER MOD Set 2.2: A 148 GLN : amide:sc= 0 K(o=0.037,f=-1.9) USER MOD Set 3.1: A 104 HIS : no HD1:sc= 0.626 K(o=1,f=-2.8) USER MOD Set 3.2: A 123 THR OG1 : rot 127:sc= 0.386 USER MOD Set 4.1: A 66 MET CE :methyl 160:sc= -0.12 (180deg=-0.602) USER MOD Set 4.2: A 68 SER OG : rot -51:sc= 0 USER MOD Set 5.1: A 15 THR OG1 : rot -65:sc= 0.839 USER MOD Set 5.2: A 117 THR OG1 : rot -5:sc= 0.478 USER MOD Single : A 5 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0295) USER MOD Single : A 6 LYS NZ :NH3+ 164:sc= 0.149 (180deg=-0.367) USER MOD Single : A 7 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0709) USER MOD Single : A 8 ASN : amide:sc= 0.277 K(o=0.28,f=-3.4!) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 SER OG : rot 38:sc= 0.419 USER MOD Single : A 21 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 TYR OH : rot 180:sc= -0.161 USER MOD Single : A 28 THR OG1 : rot 76:sc= 1.1 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 GLN : amide:sc= 0.508 K(o=0.51,f=0) USER MOD Single : A 40 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 43 SER OG : rot 180:sc= -0.739 USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 50 ASN : amide:sc= 0 K(o=0,f=-0.52) USER MOD Single : A 52 THR OG1 : rot 180:sc= -0.184 USER MOD Single : A 53 LYS NZ :NH3+ 178:sc= 0.499 (180deg=0.498) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 61:sc= 0.126 USER MOD Single : A 62 GLN : amide:sc= -0.261 X(o=-0.26,f=-0.31) USER MOD Single : A 65 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 TYR OH : rot 82:sc= 0.484 USER MOD Single : A 76 GLN : amide:sc= 0 X(o=0,f=-0.25) USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 TYR OH : rot -166:sc= 0.0937 USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 THR OG1 : rot -50:sc= 0.622 USER MOD Single : A 92 SER OG : rot -36:sc= 1.28 USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 100 MET CE :methyl 157:sc= -0.0867 (180deg=-0.588) USER MOD Single : A 103 MET CE :methyl 145:sc= -1.68 (180deg=-3.54!) USER MOD Single : A 106 THR OG1 : rot 180:sc= -0.0285 USER MOD Single : A 108 ASN : amide:sc= 0.00913 X(o=0.0091,f=-0.15) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 THR OG1 : rot 115:sc= 1.21 USER MOD Single : A 119 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 SER OG : rot 39:sc= -0.696 USER MOD Single : A 121 THR OG1 : rot 180:sc= 0 USER MOD Single : A 122 SER OG : rot 120:sc= -0.702 USER MOD Single : A 126 THR OG1 : rot 31:sc= 0.236 USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 131 GLN : amide:sc= 0.101 X(o=0.1,f=0) USER MOD Single : A 132 GLN : amide:sc= -0.391 K(o=-0.39,f=-5.4!) USER MOD Single : A 136 MET CE :methyl 164:sc= -0.0644 (180deg=-0.388) USER MOD Single : A 140 THR OG1 : rot 180:sc= 0 USER MOD Single : A 142 MET CE :methyl -107:sc= -1 (180deg=-1.73!) USER MOD Single : A 143 ASN : amide:sc= -0.277 X(o=-0.28,f=-0.34) USER MOD Single : A 144 SER OG : rot 68:sc= 0.316 USER MOD Single : A 145 THR OG1 : rot -68:sc= 0.00271 USER MOD Single : A 154 ASN :FLIP amide:sc= -0.0336 F(o=-1.9!,f=-0.034) USER MOD Single : A 155 GLN : amide:sc= 0 K(o=0,f=-0.59) USER MOD ----------------------------------------------------------------- ATOM 34 N ILE A 3 4.226 -16.622 -2.866 1.00 64.11 N ATOM 35 CA ILE A 3 4.569 -15.370 -3.594 1.00 10.10 C ATOM 36 C ILE A 3 6.020 -15.435 -4.122 1.00 20.22 C ATOM 37 O ILE A 3 6.775 -16.353 -3.785 1.00 52.43 O ATOM 38 CB ILE A 3 4.398 -14.090 -2.692 1.00 52.42 C ATOM 39 CG1 ILE A 3 5.371 -14.136 -1.465 1.00 42.43 C ATOM 40 CG2 ILE A 3 2.925 -13.930 -2.241 1.00 13.53 C ATOM 41 CD1 ILE A 3 5.414 -12.869 -0.635 1.00 11.21 C ATOM 0 HA ILE A 3 3.873 -15.288 -4.429 1.00 10.10 H new ATOM 0 HB ILE A 3 4.660 -13.215 -3.286 1.00 52.42 H new ATOM 0 HG12 ILE A 3 5.080 -14.965 -0.820 1.00 42.43 H new ATOM 0 HG13 ILE A 3 6.377 -14.351 -1.826 1.00 42.43 H new ATOM 0 HG21 ILE A 3 2.830 -13.040 -1.619 1.00 13.53 H new ATOM 0 HG22 ILE A 3 2.285 -13.831 -3.118 1.00 13.53 H new ATOM 0 HG23 ILE A 3 2.623 -14.807 -1.668 1.00 13.53 H new ATOM 0 HD11 ILE A 3 6.115 -12.998 0.190 1.00 11.21 H new ATOM 0 HD12 ILE A 3 5.738 -12.036 -1.259 1.00 11.21 H new ATOM 0 HD13 ILE A 3 4.421 -12.660 -0.238 1.00 11.21 H new ATOM 53 N GLU A 4 6.409 -14.445 -4.943 1.00 71.23 N ATOM 54 CA GLU A 4 7.772 -14.364 -5.509 1.00 50.20 C ATOM 55 C GLU A 4 8.619 -13.310 -4.757 1.00 61.31 C ATOM 56 O GLU A 4 8.138 -12.226 -4.467 1.00 50.15 O ATOM 57 CB GLU A 4 7.692 -14.027 -7.024 1.00 31.02 C ATOM 58 CG GLU A 4 9.052 -13.982 -7.747 1.00 64.05 C ATOM 59 CD GLU A 4 9.828 -15.312 -7.682 1.00 61.13 C ATOM 60 OE1 GLU A 4 9.500 -16.241 -8.449 1.00 4.45 O ATOM 61 OE2 GLU A 4 10.770 -15.432 -6.866 1.00 75.34 O ATOM 0 H GLU A 4 5.796 -13.683 -5.233 1.00 71.23 H new ATOM 0 HA GLU A 4 8.261 -15.331 -5.388 1.00 50.20 H new ATOM 0 HB2 GLU A 4 7.060 -14.768 -7.514 1.00 31.02 H new ATOM 0 HB3 GLU A 4 7.201 -13.061 -7.142 1.00 31.02 H new ATOM 0 HG2 GLU A 4 8.890 -13.716 -8.792 1.00 64.05 H new ATOM 0 HG3 GLU A 4 9.662 -13.193 -7.308 1.00 64.05 H new ATOM 68 N LYS A 5 9.875 -13.658 -4.409 1.00 23.34 N ATOM 69 CA LYS A 5 10.815 -12.738 -3.708 1.00 60.35 C ATOM 70 C LYS A 5 12.235 -12.800 -4.316 1.00 31.34 C ATOM 71 O LYS A 5 12.701 -13.871 -4.709 1.00 51.12 O ATOM 72 CB LYS A 5 10.870 -13.000 -2.165 1.00 34.21 C ATOM 73 CG LYS A 5 10.906 -14.485 -1.702 1.00 52.31 C ATOM 74 CD LYS A 5 9.518 -15.173 -1.758 1.00 45.35 C ATOM 75 CE LYS A 5 9.540 -16.621 -1.245 1.00 15.31 C ATOM 76 NZ LYS A 5 10.480 -17.487 -2.007 1.00 52.14 N ATOM 0 H LYS A 5 10.271 -14.578 -4.602 1.00 23.34 H new ATOM 0 HA LYS A 5 10.421 -11.733 -3.856 1.00 60.35 H new ATOM 0 HB2 LYS A 5 11.753 -12.500 -1.768 1.00 34.21 H new ATOM 0 HB3 LYS A 5 10.002 -12.524 -1.709 1.00 34.21 H new ATOM 0 HG2 LYS A 5 11.605 -15.038 -2.330 1.00 52.31 H new ATOM 0 HG3 LYS A 5 11.287 -14.532 -0.682 1.00 52.31 H new ATOM 0 HD2 LYS A 5 8.809 -14.595 -1.165 1.00 45.35 H new ATOM 0 HD3 LYS A 5 9.156 -15.164 -2.786 1.00 45.35 H new ATOM 0 HE2 LYS A 5 9.822 -16.625 -0.192 1.00 15.31 H new ATOM 0 HE3 LYS A 5 8.535 -17.039 -1.308 1.00 15.31 H new ATOM 0 HZ1 LYS A 5 10.393 -18.469 -1.676 1.00 52.14 H new ATOM 0 HZ2 LYS A 5 10.250 -17.441 -3.020 1.00 52.14 H new ATOM 0 HZ3 LYS A 5 11.455 -17.157 -1.858 1.00 52.14 H new ATOM 90 N LYS A 6 12.913 -11.629 -4.404 1.00 75.54 N ATOM 91 CA LYS A 6 14.326 -11.534 -4.847 1.00 3.42 C ATOM 92 C LYS A 6 15.169 -10.731 -3.817 1.00 45.20 C ATOM 93 O LYS A 6 15.223 -9.507 -3.896 1.00 74.14 O ATOM 94 CB LYS A 6 14.483 -10.882 -6.272 1.00 31.00 C ATOM 95 CG LYS A 6 13.992 -11.725 -7.480 1.00 21.40 C ATOM 96 CD LYS A 6 12.460 -11.699 -7.694 1.00 10.35 C ATOM 97 CE LYS A 6 12.040 -12.452 -8.969 1.00 43.20 C ATOM 98 NZ LYS A 6 12.437 -13.883 -8.916 1.00 72.30 N ATOM 0 H LYS A 6 12.497 -10.727 -4.171 1.00 75.54 H new ATOM 0 HA LYS A 6 14.693 -12.558 -4.914 1.00 3.42 H new ATOM 0 HB2 LYS A 6 13.943 -9.935 -6.275 1.00 31.00 H new ATOM 0 HB3 LYS A 6 15.536 -10.648 -6.425 1.00 31.00 H new ATOM 0 HG2 LYS A 6 14.480 -11.361 -8.384 1.00 21.40 H new ATOM 0 HG3 LYS A 6 14.310 -12.758 -7.340 1.00 21.40 H new ATOM 0 HD2 LYS A 6 11.966 -12.145 -6.831 1.00 10.35 H new ATOM 0 HD3 LYS A 6 12.121 -10.665 -7.756 1.00 10.35 H new ATOM 0 HE2 LYS A 6 10.960 -12.378 -9.097 1.00 43.20 H new ATOM 0 HE3 LYS A 6 12.497 -11.979 -9.838 1.00 43.20 H new ATOM 0 HZ1 LYS A 6 11.916 -14.415 -9.642 1.00 72.30 H new ATOM 0 HZ2 LYS A 6 13.459 -13.967 -9.091 1.00 72.30 H new ATOM 0 HZ3 LYS A 6 12.214 -14.271 -7.977 1.00 72.30 H new ATOM 112 N LYS A 7 15.799 -11.446 -2.849 1.00 52.23 N ATOM 113 CA LYS A 7 16.766 -10.877 -1.846 1.00 51.12 C ATOM 114 C LYS A 7 16.178 -9.697 -1.006 1.00 63.14 C ATOM 115 O LYS A 7 15.771 -9.887 0.149 1.00 24.32 O ATOM 116 CB LYS A 7 18.103 -10.457 -2.538 1.00 12.20 C ATOM 117 CG LYS A 7 18.798 -11.574 -3.351 1.00 24.02 C ATOM 118 CD LYS A 7 19.152 -12.809 -2.491 1.00 62.34 C ATOM 119 CE LYS A 7 19.881 -13.902 -3.290 1.00 30.23 C ATOM 120 NZ LYS A 7 21.198 -13.441 -3.795 1.00 71.44 N ATOM 0 H LYS A 7 15.654 -12.449 -2.733 1.00 52.23 H new ATOM 0 HA LYS A 7 16.969 -11.679 -1.136 1.00 51.12 H new ATOM 0 HB2 LYS A 7 17.902 -9.616 -3.202 1.00 12.20 H new ATOM 0 HB3 LYS A 7 18.794 -10.101 -1.774 1.00 12.20 H new ATOM 0 HG2 LYS A 7 18.146 -11.881 -4.169 1.00 24.02 H new ATOM 0 HG3 LYS A 7 19.708 -11.177 -3.801 1.00 24.02 H new ATOM 0 HD2 LYS A 7 19.779 -12.497 -1.656 1.00 62.34 H new ATOM 0 HD3 LYS A 7 18.238 -13.224 -2.066 1.00 62.34 H new ATOM 0 HE2 LYS A 7 20.022 -14.779 -2.658 1.00 30.23 H new ATOM 0 HE3 LYS A 7 19.259 -14.212 -4.130 1.00 30.23 H new ATOM 0 HZ1 LYS A 7 21.712 -14.245 -4.209 1.00 71.44 H new ATOM 0 HZ2 LYS A 7 21.055 -12.711 -4.521 1.00 71.44 H new ATOM 0 HZ3 LYS A 7 21.751 -13.044 -3.009 1.00 71.44 H new ATOM 134 N ASN A 8 16.151 -8.480 -1.601 1.00 1.41 N ATOM 135 CA ASN A 8 15.562 -7.265 -0.984 1.00 62.54 C ATOM 136 C ASN A 8 14.317 -6.787 -1.799 1.00 24.14 C ATOM 137 O ASN A 8 14.054 -5.598 -1.926 1.00 11.24 O ATOM 138 CB ASN A 8 16.632 -6.136 -0.858 1.00 41.42 C ATOM 139 CG ASN A 8 17.142 -5.601 -2.201 1.00 31.33 C ATOM 140 OD1 ASN A 8 17.331 -6.346 -3.157 1.00 74.44 O ATOM 141 ND2 ASN A 8 17.328 -4.295 -2.292 1.00 23.45 N ATOM 0 H ASN A 8 16.540 -8.312 -2.529 1.00 1.41 H new ATOM 0 HA ASN A 8 15.226 -7.513 0.023 1.00 62.54 H new ATOM 0 HB2 ASN A 8 16.207 -5.310 -0.288 1.00 41.42 H new ATOM 0 HB3 ASN A 8 17.479 -6.515 -0.286 1.00 41.42 H new ATOM 0 HD21 ASN A 8 17.636 -3.884 -3.173 1.00 23.45 H new ATOM 0 HD22 ASN A 8 17.163 -3.699 -1.481 1.00 23.45 H new ATOM 148 N LYS A 9 13.542 -7.755 -2.312 1.00 30.30 N ATOM 149 CA LYS A 9 12.306 -7.503 -3.102 1.00 15.14 C ATOM 150 C LYS A 9 11.216 -8.545 -2.763 1.00 2.21 C ATOM 151 O LYS A 9 11.509 -9.733 -2.664 1.00 35.32 O ATOM 152 CB LYS A 9 12.655 -7.562 -4.623 1.00 55.33 C ATOM 153 CG LYS A 9 11.464 -7.411 -5.604 1.00 61.33 C ATOM 154 CD LYS A 9 11.810 -7.866 -7.048 1.00 10.15 C ATOM 155 CE LYS A 9 12.989 -7.097 -7.679 1.00 63.32 C ATOM 156 NZ LYS A 9 12.686 -5.658 -7.896 1.00 21.40 N ATOM 0 H LYS A 9 13.749 -8.747 -2.194 1.00 30.30 H new ATOM 0 HA LYS A 9 11.916 -6.517 -2.851 1.00 15.14 H new ATOM 0 HB2 LYS A 9 13.379 -6.776 -4.839 1.00 55.33 H new ATOM 0 HB3 LYS A 9 13.147 -8.513 -4.825 1.00 55.33 H new ATOM 0 HG2 LYS A 9 10.621 -7.995 -5.236 1.00 61.33 H new ATOM 0 HG3 LYS A 9 11.145 -6.369 -5.623 1.00 61.33 H new ATOM 0 HD2 LYS A 9 12.047 -8.930 -7.036 1.00 10.15 H new ATOM 0 HD3 LYS A 9 10.929 -7.743 -7.678 1.00 10.15 H new ATOM 0 HE2 LYS A 9 13.863 -7.187 -7.033 1.00 63.32 H new ATOM 0 HE3 LYS A 9 13.249 -7.557 -8.632 1.00 63.32 H new ATOM 0 HZ1 LYS A 9 13.511 -5.190 -8.322 1.00 21.40 H new ATOM 0 HZ2 LYS A 9 11.870 -5.567 -8.534 1.00 21.40 H new ATOM 0 HZ3 LYS A 9 12.465 -5.209 -6.985 1.00 21.40 H new ATOM 170 N ILE A 10 9.964 -8.083 -2.569 1.00 43.33 N ATOM 171 CA ILE A 10 8.782 -8.964 -2.374 1.00 41.13 C ATOM 172 C ILE A 10 7.673 -8.622 -3.409 1.00 5.13 C ATOM 173 O ILE A 10 7.002 -7.592 -3.310 1.00 30.45 O ATOM 174 CB ILE A 10 8.213 -8.861 -0.898 1.00 11.41 C ATOM 175 CG1 ILE A 10 9.248 -9.425 0.132 1.00 21.30 C ATOM 176 CG2 ILE A 10 6.840 -9.569 -0.751 1.00 25.34 C ATOM 177 CD1 ILE A 10 8.806 -9.368 1.585 1.00 43.14 C ATOM 0 H ILE A 10 9.738 -7.089 -2.542 1.00 43.33 H new ATOM 0 HA ILE A 10 9.107 -9.992 -2.532 1.00 41.13 H new ATOM 0 HB ILE A 10 8.051 -7.805 -0.684 1.00 11.41 H new ATOM 0 HG12 ILE A 10 9.466 -10.462 -0.125 1.00 21.30 H new ATOM 0 HG13 ILE A 10 10.180 -8.869 0.029 1.00 21.30 H new ATOM 0 HG21 ILE A 10 6.489 -9.473 0.276 1.00 25.34 H new ATOM 0 HG22 ILE A 10 6.119 -9.108 -1.426 1.00 25.34 H new ATOM 0 HG23 ILE A 10 6.946 -10.625 -1.001 1.00 25.34 H new ATOM 0 HD11 ILE A 10 9.590 -9.781 2.220 1.00 43.14 H new ATOM 0 HD12 ILE A 10 8.618 -8.332 1.868 1.00 43.14 H new ATOM 0 HD13 ILE A 10 7.893 -9.950 1.711 1.00 43.14 H new ATOM 189 N ILE A 11 7.518 -9.501 -4.405 1.00 24.31 N ATOM 190 CA ILE A 11 6.435 -9.438 -5.410 1.00 71.33 C ATOM 191 C ILE A 11 5.158 -10.123 -4.838 1.00 55.20 C ATOM 192 O ILE A 11 5.106 -11.354 -4.705 1.00 73.23 O ATOM 193 CB ILE A 11 6.900 -10.146 -6.742 1.00 43.43 C ATOM 194 CG1 ILE A 11 8.240 -9.520 -7.260 1.00 25.41 C ATOM 195 CG2 ILE A 11 5.808 -10.100 -7.831 1.00 5.44 C ATOM 196 CD1 ILE A 11 8.807 -10.152 -8.522 1.00 50.14 C ATOM 0 H ILE A 11 8.148 -10.291 -4.543 1.00 24.31 H new ATOM 0 HA ILE A 11 6.203 -8.397 -5.637 1.00 71.33 H new ATOM 0 HB ILE A 11 7.076 -11.197 -6.512 1.00 43.43 H new ATOM 0 HG12 ILE A 11 8.078 -8.458 -7.446 1.00 25.41 H new ATOM 0 HG13 ILE A 11 8.986 -9.594 -6.469 1.00 25.41 H new ATOM 0 HG21 ILE A 11 6.170 -10.598 -8.730 1.00 5.44 H new ATOM 0 HG22 ILE A 11 4.913 -10.607 -7.470 1.00 5.44 H new ATOM 0 HG23 ILE A 11 5.569 -9.062 -8.063 1.00 5.44 H new ATOM 0 HD11 ILE A 11 9.733 -9.648 -8.797 1.00 50.14 H new ATOM 0 HD12 ILE A 11 9.009 -11.208 -8.341 1.00 50.14 H new ATOM 0 HD13 ILE A 11 8.086 -10.054 -9.334 1.00 50.14 H new ATOM 208 N PHE A 12 4.138 -9.311 -4.504 1.00 32.42 N ATOM 209 CA PHE A 12 2.936 -9.763 -3.765 1.00 21.30 C ATOM 210 C PHE A 12 1.667 -9.623 -4.635 1.00 73.34 C ATOM 211 O PHE A 12 1.400 -8.561 -5.185 1.00 2.11 O ATOM 212 CB PHE A 12 2.774 -8.927 -2.462 1.00 43.43 C ATOM 213 CG PHE A 12 1.884 -9.593 -1.411 1.00 30.34 C ATOM 214 CD1 PHE A 12 2.337 -10.708 -0.713 1.00 5.02 C ATOM 215 CD2 PHE A 12 0.602 -9.126 -1.134 1.00 24.42 C ATOM 216 CE1 PHE A 12 1.544 -11.330 0.227 1.00 41.51 C ATOM 217 CE2 PHE A 12 -0.190 -9.750 -0.193 1.00 21.25 C ATOM 218 CZ PHE A 12 0.280 -10.852 0.487 1.00 53.52 C ATOM 0 H PHE A 12 4.121 -8.318 -4.738 1.00 32.42 H new ATOM 0 HA PHE A 12 3.065 -10.815 -3.511 1.00 21.30 H new ATOM 0 HB2 PHE A 12 3.759 -8.748 -2.031 1.00 43.43 H new ATOM 0 HB3 PHE A 12 2.355 -7.953 -2.715 1.00 43.43 H new ATOM 0 HD1 PHE A 12 3.327 -11.093 -0.911 1.00 5.02 H new ATOM 0 HD2 PHE A 12 0.223 -8.264 -1.663 1.00 24.42 H new ATOM 0 HE1 PHE A 12 1.915 -12.193 0.760 1.00 41.51 H new ATOM 0 HE2 PHE A 12 -1.181 -9.374 0.011 1.00 21.25 H new ATOM 0 HZ PHE A 12 -0.342 -11.340 1.223 1.00 53.52 H new ATOM 228 N THR A 13 0.864 -10.687 -4.700 1.00 41.33 N ATOM 229 CA THR A 13 -0.399 -10.719 -5.486 1.00 63.31 C ATOM 230 C THR A 13 -1.632 -10.777 -4.554 1.00 60.14 C ATOM 231 O THR A 13 -1.550 -11.301 -3.436 1.00 33.12 O ATOM 232 CB THR A 13 -0.420 -11.939 -6.474 1.00 51.44 C ATOM 233 OG1 THR A 13 -1.679 -12.002 -7.167 1.00 4.31 O ATOM 234 CG2 THR A 13 -0.159 -13.277 -5.752 1.00 11.22 C ATOM 0 H THR A 13 1.061 -11.561 -4.212 1.00 41.33 H new ATOM 0 HA THR A 13 -0.443 -9.799 -6.068 1.00 63.31 H new ATOM 0 HB THR A 13 0.386 -11.783 -7.191 1.00 51.44 H new ATOM 0 HG1 THR A 13 -1.677 -12.766 -7.780 1.00 4.31 H new ATOM 0 HG21 THR A 13 -0.183 -14.092 -6.476 1.00 11.22 H new ATOM 0 HG22 THR A 13 0.819 -13.247 -5.272 1.00 11.22 H new ATOM 0 HG23 THR A 13 -0.928 -13.439 -4.997 1.00 11.22 H new ATOM 242 N ARG A 14 -2.762 -10.195 -5.009 1.00 1.23 N ATOM 243 CA ARG A 14 -4.061 -10.274 -4.293 1.00 22.22 C ATOM 244 C ARG A 14 -5.231 -9.988 -5.266 1.00 53.22 C ATOM 245 O ARG A 14 -5.136 -9.096 -6.116 1.00 40.35 O ATOM 246 CB ARG A 14 -4.113 -9.311 -3.061 1.00 51.24 C ATOM 247 CG ARG A 14 -4.380 -7.808 -3.355 1.00 51.14 C ATOM 248 CD ARG A 14 -3.266 -7.102 -4.155 1.00 64.30 C ATOM 249 NE ARG A 14 -1.957 -7.124 -3.466 1.00 63.21 N ATOM 250 CZ ARG A 14 -1.358 -6.079 -2.920 1.00 73.21 C ATOM 251 NH1 ARG A 14 -1.945 -4.921 -2.843 1.00 1.21 N ATOM 252 NH2 ARG A 14 -0.174 -6.206 -2.430 1.00 1.13 N ATOM 0 H ARG A 14 -2.804 -9.660 -5.876 1.00 1.23 H new ATOM 0 HA ARG A 14 -4.163 -11.289 -3.909 1.00 22.22 H new ATOM 0 HB2 ARG A 14 -4.889 -9.668 -2.384 1.00 51.24 H new ATOM 0 HB3 ARG A 14 -3.165 -9.390 -2.529 1.00 51.24 H new ATOM 0 HG2 ARG A 14 -5.316 -7.720 -3.906 1.00 51.14 H new ATOM 0 HG3 ARG A 14 -4.517 -7.285 -2.409 1.00 51.14 H new ATOM 0 HD2 ARG A 14 -3.166 -7.581 -5.129 1.00 64.30 H new ATOM 0 HD3 ARG A 14 -3.557 -6.068 -4.337 1.00 64.30 H new ATOM 0 HE ARG A 14 -1.476 -8.021 -3.407 1.00 63.21 H new ATOM 0 HH11 ARG A 14 -2.890 -4.803 -3.209 1.00 1.21 H new ATOM 0 HH12 ARG A 14 -1.461 -4.131 -2.417 1.00 1.21 H new ATOM 0 HH21 ARG A 14 0.298 -7.110 -2.464 1.00 1.13 H new ATOM 0 HH22 ARG A 14 0.292 -5.403 -2.008 1.00 1.13 H new ATOM 266 N THR A 15 -6.347 -10.707 -5.100 1.00 41.35 N ATOM 267 CA THR A 15 -7.470 -10.706 -6.078 1.00 12.02 C ATOM 268 C THR A 15 -8.805 -10.347 -5.392 1.00 10.41 C ATOM 269 O THR A 15 -9.154 -10.929 -4.364 1.00 72.43 O ATOM 270 CB THR A 15 -7.600 -12.106 -6.782 1.00 44.34 C ATOM 271 OG1 THR A 15 -6.320 -12.510 -7.306 1.00 30.32 O ATOM 272 CG2 THR A 15 -8.636 -12.097 -7.930 1.00 31.13 C ATOM 0 H THR A 15 -6.509 -11.307 -4.291 1.00 41.35 H new ATOM 0 HA THR A 15 -7.247 -9.949 -6.830 1.00 12.02 H new ATOM 0 HB THR A 15 -7.945 -12.812 -6.027 1.00 44.34 H new ATOM 0 HG1 THR A 15 -6.050 -11.895 -8.020 1.00 30.32 H new ATOM 0 HG21 THR A 15 -8.687 -13.087 -8.382 1.00 31.13 H new ATOM 0 HG22 THR A 15 -9.615 -11.828 -7.534 1.00 31.13 H new ATOM 0 HG23 THR A 15 -8.337 -11.369 -8.684 1.00 31.13 H new ATOM 280 N PHE A 16 -9.540 -9.376 -5.965 1.00 13.53 N ATOM 281 CA PHE A 16 -10.880 -8.953 -5.486 1.00 4.33 C ATOM 282 C PHE A 16 -11.867 -8.853 -6.676 1.00 1.31 C ATOM 283 O PHE A 16 -11.491 -8.410 -7.769 1.00 73.52 O ATOM 284 CB PHE A 16 -10.803 -7.582 -4.745 1.00 20.52 C ATOM 285 CG PHE A 16 -9.895 -7.583 -3.511 1.00 70.40 C ATOM 286 CD1 PHE A 16 -10.299 -8.208 -2.329 1.00 75.34 C ATOM 287 CD2 PHE A 16 -8.635 -6.981 -3.538 1.00 72.34 C ATOM 288 CE1 PHE A 16 -9.475 -8.226 -1.219 1.00 63.31 C ATOM 289 CE2 PHE A 16 -7.815 -7.004 -2.426 1.00 34.54 C ATOM 290 CZ PHE A 16 -8.235 -7.626 -1.269 1.00 13.32 C ATOM 0 H PHE A 16 -9.222 -8.855 -6.782 1.00 13.53 H new ATOM 0 HA PHE A 16 -11.239 -9.704 -4.783 1.00 4.33 H new ATOM 0 HB2 PHE A 16 -10.447 -6.824 -5.443 1.00 20.52 H new ATOM 0 HB3 PHE A 16 -11.808 -7.289 -4.442 1.00 20.52 H new ATOM 0 HD1 PHE A 16 -11.268 -8.683 -2.282 1.00 75.34 H new ATOM 0 HD2 PHE A 16 -8.297 -6.491 -4.439 1.00 72.34 H new ATOM 0 HE1 PHE A 16 -9.803 -8.711 -0.311 1.00 63.31 H new ATOM 0 HE2 PHE A 16 -6.843 -6.534 -2.463 1.00 34.54 H new ATOM 0 HZ PHE A 16 -7.592 -7.643 -0.401 1.00 13.32 H new ATOM 300 N SER A 17 -13.127 -9.286 -6.460 1.00 4.52 N ATOM 301 CA SER A 17 -14.217 -9.088 -7.439 1.00 75.33 C ATOM 302 C SER A 17 -14.773 -7.647 -7.316 1.00 61.50 C ATOM 303 O SER A 17 -15.621 -7.355 -6.460 1.00 74.34 O ATOM 304 CB SER A 17 -15.336 -10.133 -7.222 1.00 22.01 C ATOM 305 OG SER A 17 -15.840 -10.099 -5.889 1.00 3.45 O ATOM 0 H SER A 17 -13.415 -9.777 -5.613 1.00 4.52 H new ATOM 0 HA SER A 17 -13.823 -9.225 -8.446 1.00 75.33 H new ATOM 0 HB2 SER A 17 -16.149 -9.946 -7.923 1.00 22.01 H new ATOM 0 HB3 SER A 17 -14.951 -11.129 -7.440 1.00 22.01 H new ATOM 0 HG SER A 17 -15.885 -9.170 -5.580 1.00 3.45 H new ATOM 311 N ALA A 18 -14.250 -6.760 -8.170 1.00 53.41 N ATOM 312 CA ALA A 18 -14.579 -5.320 -8.185 1.00 54.01 C ATOM 313 C ALA A 18 -13.962 -4.665 -9.440 1.00 30.42 C ATOM 314 O ALA A 18 -12.969 -5.179 -9.963 1.00 64.43 O ATOM 315 CB ALA A 18 -14.055 -4.618 -6.903 1.00 3.24 C ATOM 0 H ALA A 18 -13.573 -7.023 -8.886 1.00 53.41 H new ATOM 0 HA ALA A 18 -15.663 -5.209 -8.211 1.00 54.01 H new ATOM 0 HB1 ALA A 18 -14.310 -3.559 -6.938 1.00 3.24 H new ATOM 0 HB2 ALA A 18 -14.515 -5.073 -6.025 1.00 3.24 H new ATOM 0 HB3 ALA A 18 -12.972 -4.729 -6.844 1.00 3.24 H new ATOM 321 N PRO A 19 -14.533 -3.536 -9.967 1.00 65.24 N ATOM 322 CA PRO A 19 -13.873 -2.734 -11.037 1.00 73.34 C ATOM 323 C PRO A 19 -12.452 -2.265 -10.608 1.00 64.24 C ATOM 324 O PRO A 19 -12.252 -1.846 -9.462 1.00 20.03 O ATOM 325 CB PRO A 19 -14.842 -1.529 -11.232 1.00 55.22 C ATOM 326 CG PRO A 19 -15.666 -1.508 -9.980 1.00 42.00 C ATOM 327 CD PRO A 19 -15.853 -2.956 -9.607 1.00 3.42 C ATOM 0 HA PRO A 19 -13.713 -3.301 -11.954 1.00 73.34 H new ATOM 0 HB2 PRO A 19 -14.294 -0.596 -11.363 1.00 55.22 H new ATOM 0 HB3 PRO A 19 -15.466 -1.660 -12.116 1.00 55.22 H new ATOM 0 HG2 PRO A 19 -15.161 -0.959 -9.185 1.00 42.00 H new ATOM 0 HG3 PRO A 19 -16.625 -1.017 -10.148 1.00 42.00 H new ATOM 0 HD2 PRO A 19 -16.079 -3.079 -8.548 1.00 3.42 H new ATOM 0 HD3 PRO A 19 -16.668 -3.419 -10.163 1.00 3.42 H new ATOM 335 N ILE A 20 -11.476 -2.339 -11.535 1.00 51.40 N ATOM 336 CA ILE A 20 -10.054 -2.022 -11.240 1.00 70.34 C ATOM 337 C ILE A 20 -9.857 -0.560 -10.777 1.00 54.52 C ATOM 338 O ILE A 20 -8.910 -0.251 -10.061 1.00 32.35 O ATOM 339 CB ILE A 20 -9.121 -2.315 -12.477 1.00 22.24 C ATOM 340 CG1 ILE A 20 -7.611 -2.239 -12.055 1.00 31.14 C ATOM 341 CG2 ILE A 20 -9.430 -1.351 -13.659 1.00 13.23 C ATOM 342 CD1 ILE A 20 -6.624 -2.700 -13.103 1.00 1.35 C ATOM 0 H ILE A 20 -11.643 -2.617 -12.502 1.00 51.40 H new ATOM 0 HA ILE A 20 -9.768 -2.679 -10.418 1.00 70.34 H new ATOM 0 HB ILE A 20 -9.325 -3.328 -12.825 1.00 22.24 H new ATOM 0 HG12 ILE A 20 -7.377 -1.209 -11.787 1.00 31.14 H new ATOM 0 HG13 ILE A 20 -7.471 -2.841 -11.157 1.00 31.14 H new ATOM 0 HG21 ILE A 20 -8.770 -1.579 -14.496 1.00 13.23 H new ATOM 0 HG22 ILE A 20 -10.467 -1.477 -13.970 1.00 13.23 H new ATOM 0 HG23 ILE A 20 -9.269 -0.321 -13.340 1.00 13.23 H new ATOM 0 HD11 ILE A 20 -5.610 -2.608 -12.713 1.00 1.35 H new ATOM 0 HD12 ILE A 20 -6.822 -3.741 -13.356 1.00 1.35 H new ATOM 0 HD13 ILE A 20 -6.727 -2.083 -13.996 1.00 1.35 H new ATOM 354 N ASN A 21 -10.793 0.308 -11.177 1.00 34.51 N ATOM 355 CA ASN A 21 -10.738 1.748 -10.903 1.00 2.14 C ATOM 356 C ASN A 21 -10.777 2.037 -9.378 1.00 0.14 C ATOM 357 O ASN A 21 -9.938 2.773 -8.878 1.00 11.43 O ATOM 358 CB ASN A 21 -11.898 2.448 -11.646 1.00 31.43 C ATOM 359 CG ASN A 21 -11.744 3.963 -11.708 1.00 20.04 C ATOM 360 OD1 ASN A 21 -11.151 4.503 -12.637 1.00 65.42 O ATOM 361 ND2 ASN A 21 -12.259 4.660 -10.724 1.00 72.13 N ATOM 0 H ASN A 21 -11.619 0.027 -11.706 1.00 34.51 H new ATOM 0 HA ASN A 21 -9.792 2.147 -11.269 1.00 2.14 H new ATOM 0 HB2 ASN A 21 -11.961 2.054 -12.660 1.00 31.43 H new ATOM 0 HB3 ASN A 21 -12.838 2.205 -11.150 1.00 31.43 H new ATOM 0 HD21 ASN A 21 -12.172 5.676 -10.719 1.00 72.13 H new ATOM 0 HD22 ASN A 21 -12.747 4.186 -9.964 1.00 72.13 H new ATOM 368 N LYS A 22 -11.730 1.409 -8.647 1.00 73.25 N ATOM 369 CA LYS A 22 -11.852 1.583 -7.165 1.00 74.40 C ATOM 370 C LYS A 22 -10.724 0.855 -6.401 1.00 24.35 C ATOM 371 O LYS A 22 -10.316 1.289 -5.313 1.00 41.42 O ATOM 372 CB LYS A 22 -13.243 1.120 -6.637 1.00 33.12 C ATOM 373 CG LYS A 22 -13.680 -0.298 -7.068 1.00 0.15 C ATOM 374 CD LYS A 22 -14.953 -0.784 -6.339 1.00 12.43 C ATOM 375 CE LYS A 22 -16.177 0.124 -6.583 1.00 0.34 C ATOM 376 NZ LYS A 22 -17.396 -0.401 -5.923 1.00 72.41 N ATOM 0 H LYS A 22 -12.425 0.780 -9.049 1.00 73.25 H new ATOM 0 HA LYS A 22 -11.754 2.652 -6.976 1.00 74.40 H new ATOM 0 HB2 LYS A 22 -13.231 1.162 -5.548 1.00 33.12 H new ATOM 0 HB3 LYS A 22 -13.996 1.832 -6.975 1.00 33.12 H new ATOM 0 HG2 LYS A 22 -13.858 -0.306 -8.143 1.00 0.15 H new ATOM 0 HG3 LYS A 22 -12.867 -0.998 -6.874 1.00 0.15 H new ATOM 0 HD2 LYS A 22 -15.188 -1.796 -6.668 1.00 12.43 H new ATOM 0 HD3 LYS A 22 -14.754 -0.835 -5.269 1.00 12.43 H new ATOM 0 HE2 LYS A 22 -15.965 1.126 -6.210 1.00 0.34 H new ATOM 0 HE3 LYS A 22 -16.355 0.214 -7.655 1.00 0.34 H new ATOM 0 HZ1 LYS A 22 -18.195 0.238 -6.111 1.00 72.41 H new ATOM 0 HZ2 LYS A 22 -17.613 -1.347 -6.297 1.00 72.41 H new ATOM 0 HZ3 LYS A 22 -17.236 -0.463 -4.897 1.00 72.41 H new ATOM 390 N VAL A 23 -10.241 -0.258 -6.976 1.00 40.22 N ATOM 391 CA VAL A 23 -9.081 -1.016 -6.441 1.00 45.25 C ATOM 392 C VAL A 23 -7.796 -0.147 -6.503 1.00 44.04 C ATOM 393 O VAL A 23 -6.972 -0.147 -5.585 1.00 34.12 O ATOM 394 CB VAL A 23 -8.886 -2.362 -7.243 1.00 50.04 C ATOM 395 CG1 VAL A 23 -7.652 -3.162 -6.739 1.00 74.03 C ATOM 396 CG2 VAL A 23 -10.172 -3.230 -7.165 1.00 12.11 C ATOM 0 H VAL A 23 -10.638 -0.663 -7.824 1.00 40.22 H new ATOM 0 HA VAL A 23 -9.277 -1.266 -5.398 1.00 45.25 H new ATOM 0 HB VAL A 23 -8.700 -2.101 -8.285 1.00 50.04 H new ATOM 0 HG11 VAL A 23 -7.553 -4.081 -7.317 1.00 74.03 H new ATOM 0 HG12 VAL A 23 -6.753 -2.558 -6.861 1.00 74.03 H new ATOM 0 HG13 VAL A 23 -7.784 -3.408 -5.685 1.00 74.03 H new ATOM 0 HG21 VAL A 23 -10.021 -4.154 -7.723 1.00 12.11 H new ATOM 0 HG22 VAL A 23 -10.389 -3.466 -6.123 1.00 12.11 H new ATOM 0 HG23 VAL A 23 -11.009 -2.679 -7.594 1.00 12.11 H new ATOM 406 N PHE A 24 -7.677 0.599 -7.604 1.00 2.42 N ATOM 407 CA PHE A 24 -6.614 1.594 -7.833 1.00 73.11 C ATOM 408 C PHE A 24 -6.782 2.820 -6.895 1.00 3.31 C ATOM 409 O PHE A 24 -5.806 3.314 -6.326 1.00 54.15 O ATOM 410 CB PHE A 24 -6.653 2.020 -9.326 1.00 61.10 C ATOM 411 CG PHE A 24 -5.804 3.240 -9.688 1.00 44.42 C ATOM 412 CD1 PHE A 24 -4.416 3.157 -9.734 1.00 42.15 C ATOM 413 CD2 PHE A 24 -6.401 4.467 -9.987 1.00 3.45 C ATOM 414 CE1 PHE A 24 -3.654 4.256 -10.073 1.00 55.12 C ATOM 415 CE2 PHE A 24 -5.637 5.562 -10.328 1.00 75.53 C ATOM 416 CZ PHE A 24 -4.264 5.456 -10.369 1.00 34.33 C ATOM 0 H PHE A 24 -8.331 0.530 -8.383 1.00 2.42 H new ATOM 0 HA PHE A 24 -5.644 1.153 -7.604 1.00 73.11 H new ATOM 0 HB2 PHE A 24 -6.324 1.177 -9.934 1.00 61.10 H new ATOM 0 HB3 PHE A 24 -7.688 2.226 -9.600 1.00 61.10 H new ATOM 0 HD1 PHE A 24 -3.929 2.221 -9.502 1.00 42.15 H new ATOM 0 HD2 PHE A 24 -7.476 4.559 -9.950 1.00 3.45 H new ATOM 0 HE1 PHE A 24 -2.577 4.176 -10.107 1.00 55.12 H new ATOM 0 HE2 PHE A 24 -6.114 6.502 -10.563 1.00 75.53 H new ATOM 0 HZ PHE A 24 -3.665 6.315 -10.634 1.00 34.33 H new ATOM 426 N ASP A 25 -8.035 3.291 -6.743 1.00 2.24 N ATOM 427 CA ASP A 25 -8.378 4.463 -5.898 1.00 4.10 C ATOM 428 C ASP A 25 -8.127 4.217 -4.391 1.00 73.13 C ATOM 429 O ASP A 25 -8.114 5.167 -3.603 1.00 13.52 O ATOM 430 CB ASP A 25 -9.850 4.889 -6.141 1.00 64.31 C ATOM 431 CG ASP A 25 -10.108 5.488 -7.535 1.00 54.30 C ATOM 432 OD1 ASP A 25 -9.157 6.014 -8.164 1.00 63.42 O ATOM 433 OD2 ASP A 25 -11.269 5.460 -8.007 1.00 52.15 O ATOM 0 H ASP A 25 -8.844 2.872 -7.202 1.00 2.24 H new ATOM 0 HA ASP A 25 -7.711 5.272 -6.196 1.00 4.10 H new ATOM 0 HB2 ASP A 25 -10.495 4.021 -6.005 1.00 64.31 H new ATOM 0 HB3 ASP A 25 -10.135 5.620 -5.385 1.00 64.31 H new ATOM 438 N ALA A 26 -7.949 2.943 -3.999 1.00 62.21 N ATOM 439 CA ALA A 26 -7.484 2.564 -2.640 1.00 22.41 C ATOM 440 C ALA A 26 -6.081 3.151 -2.334 1.00 2.31 C ATOM 441 O ALA A 26 -5.761 3.474 -1.194 1.00 20.01 O ATOM 442 CB ALA A 26 -7.479 1.035 -2.504 1.00 42.12 C ATOM 0 H ALA A 26 -8.121 2.144 -4.609 1.00 62.21 H new ATOM 0 HA ALA A 26 -8.175 2.985 -1.909 1.00 22.41 H new ATOM 0 HB1 ALA A 26 -7.137 0.760 -1.506 1.00 42.12 H new ATOM 0 HB2 ALA A 26 -8.488 0.652 -2.661 1.00 42.12 H new ATOM 0 HB3 ALA A 26 -6.808 0.606 -3.248 1.00 42.12 H new ATOM 448 N TYR A 27 -5.270 3.293 -3.389 1.00 5.32 N ATOM 449 CA TYR A 27 -3.891 3.828 -3.317 1.00 33.12 C ATOM 450 C TYR A 27 -3.853 5.332 -3.653 1.00 2.43 C ATOM 451 O TYR A 27 -2.901 6.038 -3.301 1.00 23.31 O ATOM 452 CB TYR A 27 -3.008 3.055 -4.333 1.00 62.32 C ATOM 453 CG TYR A 27 -3.070 1.525 -4.145 1.00 3.44 C ATOM 454 CD1 TYR A 27 -2.471 0.906 -3.046 1.00 2.31 C ATOM 455 CD2 TYR A 27 -3.774 0.711 -5.042 1.00 70.54 C ATOM 456 CE1 TYR A 27 -2.563 -0.462 -2.856 1.00 2.31 C ATOM 457 CE2 TYR A 27 -3.872 -0.654 -4.848 1.00 64.12 C ATOM 458 CZ TYR A 27 -3.266 -1.235 -3.755 1.00 15.34 C ATOM 459 OH TYR A 27 -3.360 -2.599 -3.561 1.00 74.01 O ATOM 0 H TYR A 27 -5.551 3.037 -4.336 1.00 5.32 H new ATOM 0 HA TYR A 27 -3.518 3.700 -2.301 1.00 33.12 H new ATOM 0 HB2 TYR A 27 -3.326 3.304 -5.345 1.00 62.32 H new ATOM 0 HB3 TYR A 27 -1.974 3.386 -4.233 1.00 62.32 H new ATOM 0 HD1 TYR A 27 -1.926 1.505 -2.332 1.00 2.31 H new ATOM 0 HD2 TYR A 27 -4.250 1.159 -5.902 1.00 70.54 H new ATOM 0 HE1 TYR A 27 -2.085 -0.923 -2.005 1.00 2.31 H new ATOM 0 HE2 TYR A 27 -4.422 -1.263 -5.550 1.00 64.12 H new ATOM 0 HH TYR A 27 -3.890 -2.996 -4.283 1.00 74.01 H new ATOM 469 N THR A 28 -4.903 5.803 -4.344 1.00 2.41 N ATOM 470 CA THR A 28 -4.901 7.113 -5.027 1.00 31.35 C ATOM 471 C THR A 28 -5.804 8.166 -4.319 1.00 64.15 C ATOM 472 O THR A 28 -5.653 9.372 -4.545 1.00 61.32 O ATOM 473 CB THR A 28 -5.314 6.925 -6.529 1.00 70.53 C ATOM 474 OG1 THR A 28 -4.668 5.754 -7.063 1.00 51.32 O ATOM 475 CG2 THR A 28 -4.903 8.112 -7.406 1.00 51.44 C ATOM 0 H THR A 28 -5.778 5.289 -4.447 1.00 2.41 H new ATOM 0 HA THR A 28 -3.887 7.510 -4.979 1.00 31.35 H new ATOM 0 HB THR A 28 -6.400 6.835 -6.545 1.00 70.53 H new ATOM 0 HG1 THR A 28 -5.125 4.951 -6.737 1.00 51.32 H new ATOM 0 HG21 THR A 28 -5.213 7.929 -8.435 1.00 51.44 H new ATOM 0 HG22 THR A 28 -5.383 9.019 -7.038 1.00 51.44 H new ATOM 0 HG23 THR A 28 -3.820 8.234 -7.370 1.00 51.44 H new ATOM 483 N LYS A 29 -6.743 7.712 -3.460 1.00 11.31 N ATOM 484 CA LYS A 29 -7.595 8.603 -2.606 1.00 1.33 C ATOM 485 C LYS A 29 -7.468 8.169 -1.127 1.00 65.12 C ATOM 486 O LYS A 29 -7.531 6.967 -0.833 1.00 4.03 O ATOM 487 CB LYS A 29 -9.109 8.577 -3.018 1.00 3.52 C ATOM 488 CG LYS A 29 -9.469 9.294 -4.348 1.00 64.22 C ATOM 489 CD LYS A 29 -9.058 8.505 -5.608 1.00 12.40 C ATOM 490 CE LYS A 29 -9.509 9.176 -6.915 1.00 2.14 C ATOM 491 NZ LYS A 29 -8.894 10.513 -7.117 1.00 4.12 N ATOM 0 H LYS A 29 -6.940 6.720 -3.331 1.00 11.31 H new ATOM 0 HA LYS A 29 -7.235 9.622 -2.748 1.00 1.33 H new ATOM 0 HB2 LYS A 29 -9.426 7.537 -3.093 1.00 3.52 H new ATOM 0 HB3 LYS A 29 -9.691 9.031 -2.216 1.00 3.52 H new ATOM 0 HG2 LYS A 29 -10.544 9.471 -4.376 1.00 64.22 H new ATOM 0 HG3 LYS A 29 -8.984 10.270 -4.367 1.00 64.22 H new ATOM 0 HD2 LYS A 29 -7.974 8.391 -5.620 1.00 12.40 H new ATOM 0 HD3 LYS A 29 -9.483 7.503 -5.556 1.00 12.40 H new ATOM 0 HE2 LYS A 29 -9.252 8.532 -7.756 1.00 2.14 H new ATOM 0 HE3 LYS A 29 -10.594 9.277 -6.911 1.00 2.14 H new ATOM 0 HZ1 LYS A 29 -9.233 10.919 -8.012 1.00 4.12 H new ATOM 0 HZ2 LYS A 29 -9.159 11.140 -6.330 1.00 4.12 H new ATOM 0 HZ3 LYS A 29 -7.859 10.418 -7.150 1.00 4.12 H new ATOM 505 N ARG A 30 -7.306 9.144 -0.189 1.00 3.15 N ATOM 506 CA ARG A 30 -7.175 8.824 1.256 1.00 3.23 C ATOM 507 C ARG A 30 -8.484 8.294 1.843 1.00 23.33 C ATOM 508 O ARG A 30 -8.441 7.520 2.789 1.00 74.21 O ATOM 509 CB ARG A 30 -6.678 10.012 2.126 1.00 60.04 C ATOM 510 CG ARG A 30 -7.720 11.105 2.451 1.00 14.13 C ATOM 511 CD ARG A 30 -7.184 12.181 3.415 1.00 45.50 C ATOM 512 NE ARG A 30 -8.227 13.170 3.771 1.00 43.01 N ATOM 513 CZ ARG A 30 -8.786 13.313 4.960 1.00 61.12 C ATOM 514 NH1 ARG A 30 -8.488 12.537 5.958 1.00 53.12 N ATOM 515 NH2 ARG A 30 -9.671 14.233 5.137 1.00 53.22 N ATOM 0 H ARG A 30 -7.264 10.140 -0.405 1.00 3.15 H new ATOM 0 HA ARG A 30 -6.410 8.048 1.291 1.00 3.23 H new ATOM 0 HB2 ARG A 30 -6.297 9.612 3.066 1.00 60.04 H new ATOM 0 HB3 ARG A 30 -5.837 10.482 1.616 1.00 60.04 H new ATOM 0 HG2 ARG A 30 -8.039 11.582 1.524 1.00 14.13 H new ATOM 0 HG3 ARG A 30 -8.602 10.639 2.890 1.00 14.13 H new ATOM 0 HD2 ARG A 30 -6.811 11.704 4.321 1.00 45.50 H new ATOM 0 HD3 ARG A 30 -6.339 12.693 2.954 1.00 45.50 H new ATOM 0 HE ARG A 30 -8.543 13.798 3.032 1.00 43.01 H new ATOM 0 HH11 ARG A 30 -7.804 11.790 5.837 1.00 53.12 H new ATOM 0 HH12 ARG A 30 -8.938 12.674 6.863 1.00 53.12 H new ATOM 0 HH21 ARG A 30 -9.934 14.843 4.363 1.00 53.22 H new ATOM 0 HH22 ARG A 30 -10.108 14.351 6.051 1.00 53.22 H new ATOM 529 N GLU A 31 -9.629 8.692 1.246 1.00 31.03 N ATOM 530 CA GLU A 31 -10.981 8.231 1.658 1.00 2.14 C ATOM 531 C GLU A 31 -11.012 6.707 1.855 1.00 53.33 C ATOM 532 O GLU A 31 -11.530 6.193 2.843 1.00 43.51 O ATOM 533 CB GLU A 31 -12.020 8.634 0.569 1.00 14.11 C ATOM 534 CG GLU A 31 -13.399 7.950 0.712 1.00 73.32 C ATOM 535 CD GLU A 31 -14.455 8.423 -0.299 1.00 45.21 C ATOM 536 OE1 GLU A 31 -14.414 7.976 -1.468 1.00 3.22 O ATOM 537 OE2 GLU A 31 -15.341 9.231 0.071 1.00 54.20 O ATOM 0 H GLU A 31 -9.646 9.344 0.462 1.00 31.03 H new ATOM 0 HA GLU A 31 -11.230 8.705 2.608 1.00 2.14 H new ATOM 0 HB2 GLU A 31 -12.160 9.715 0.601 1.00 14.11 H new ATOM 0 HB3 GLU A 31 -11.610 8.394 -0.412 1.00 14.11 H new ATOM 0 HG2 GLU A 31 -13.269 6.873 0.605 1.00 73.32 H new ATOM 0 HG3 GLU A 31 -13.775 8.127 1.720 1.00 73.32 H new ATOM 544 N LEU A 32 -10.383 6.026 0.908 1.00 23.24 N ATOM 545 CA LEU A 32 -10.290 4.571 0.879 1.00 40.32 C ATOM 546 C LEU A 32 -9.003 4.086 1.594 1.00 31.31 C ATOM 547 O LEU A 32 -9.048 3.116 2.359 1.00 52.22 O ATOM 548 CB LEU A 32 -10.325 4.115 -0.593 1.00 51.10 C ATOM 549 CG LEU A 32 -11.501 4.693 -1.449 1.00 53.12 C ATOM 550 CD1 LEU A 32 -11.380 4.242 -2.910 1.00 55.15 C ATOM 551 CD2 LEU A 32 -12.883 4.326 -0.861 1.00 4.51 C ATOM 0 H LEU A 32 -9.914 6.477 0.123 1.00 23.24 H new ATOM 0 HA LEU A 32 -11.131 4.131 1.415 1.00 40.32 H new ATOM 0 HB2 LEU A 32 -9.383 4.395 -1.065 1.00 51.10 H new ATOM 0 HB3 LEU A 32 -10.382 3.027 -0.617 1.00 51.10 H new ATOM 0 HG LEU A 32 -11.424 5.780 -1.418 1.00 53.12 H new ATOM 0 HD11 LEU A 32 -12.207 4.655 -3.488 1.00 55.15 H new ATOM 0 HD12 LEU A 32 -10.436 4.597 -3.323 1.00 55.15 H new ATOM 0 HD13 LEU A 32 -11.411 3.154 -2.959 1.00 55.15 H new ATOM 0 HD21 LEU A 32 -13.669 4.748 -1.488 1.00 4.51 H new ATOM 0 HD22 LEU A 32 -12.988 3.242 -0.828 1.00 4.51 H new ATOM 0 HD23 LEU A 32 -12.968 4.729 0.148 1.00 4.51 H new ATOM 563 N PHE A 33 -7.877 4.801 1.360 1.00 24.42 N ATOM 564 CA PHE A 33 -6.532 4.430 1.877 1.00 54.33 C ATOM 565 C PHE A 33 -6.514 4.242 3.417 1.00 51.34 C ATOM 566 O PHE A 33 -6.100 3.187 3.914 1.00 14.33 O ATOM 567 CB PHE A 33 -5.485 5.489 1.448 1.00 32.25 C ATOM 568 CG PHE A 33 -4.041 5.142 1.825 1.00 72.31 C ATOM 569 CD1 PHE A 33 -3.311 4.220 1.073 1.00 3.44 C ATOM 570 CD2 PHE A 33 -3.415 5.737 2.926 1.00 34.22 C ATOM 571 CE1 PHE A 33 -2.008 3.902 1.411 1.00 11.45 C ATOM 572 CE2 PHE A 33 -2.115 5.417 3.261 1.00 22.31 C ATOM 573 CZ PHE A 33 -1.409 4.504 2.501 1.00 54.41 C ATOM 0 H PHE A 33 -7.873 5.657 0.805 1.00 24.42 H new ATOM 0 HA PHE A 33 -6.274 3.466 1.439 1.00 54.33 H new ATOM 0 HB2 PHE A 33 -5.543 5.623 0.368 1.00 32.25 H new ATOM 0 HB3 PHE A 33 -5.746 6.445 1.902 1.00 32.25 H new ATOM 0 HD1 PHE A 33 -3.770 3.749 0.216 1.00 3.44 H new ATOM 0 HD2 PHE A 33 -3.957 6.457 3.522 1.00 34.22 H new ATOM 0 HE1 PHE A 33 -1.458 3.182 0.822 1.00 11.45 H new ATOM 0 HE2 PHE A 33 -1.649 5.881 4.118 1.00 22.31 H new ATOM 0 HZ PHE A 33 -0.389 4.261 2.759 1.00 54.41 H new ATOM 583 N GLU A 34 -6.992 5.259 4.165 1.00 21.54 N ATOM 584 CA GLU A 34 -7.032 5.210 5.650 1.00 63.22 C ATOM 585 C GLU A 34 -8.199 4.345 6.214 1.00 52.43 C ATOM 586 O GLU A 34 -8.445 4.345 7.426 1.00 63.22 O ATOM 587 CB GLU A 34 -7.040 6.640 6.269 1.00 14.53 C ATOM 588 CG GLU A 34 -8.205 7.550 5.837 1.00 54.20 C ATOM 589 CD GLU A 34 -8.174 8.929 6.513 1.00 4.05 C ATOM 590 OE1 GLU A 34 -7.513 9.844 5.988 1.00 11.23 O ATOM 591 OE2 GLU A 34 -8.801 9.097 7.579 1.00 45.55 O ATOM 0 H GLU A 34 -7.356 6.126 3.769 1.00 21.54 H new ATOM 0 HA GLU A 34 -6.112 4.710 5.953 1.00 63.22 H new ATOM 0 HB2 GLU A 34 -7.061 6.546 7.355 1.00 14.53 H new ATOM 0 HB3 GLU A 34 -6.103 7.133 6.010 1.00 14.53 H new ATOM 0 HG2 GLU A 34 -8.174 7.681 4.755 1.00 54.20 H new ATOM 0 HG3 GLU A 34 -9.149 7.058 6.071 1.00 54.20 H new ATOM 598 N GLN A 35 -8.905 3.595 5.347 1.00 54.24 N ATOM 599 CA GLN A 35 -9.876 2.557 5.786 1.00 71.12 C ATOM 600 C GLN A 35 -9.263 1.134 5.708 1.00 51.40 C ATOM 601 O GLN A 35 -9.611 0.267 6.523 1.00 51.34 O ATOM 602 CB GLN A 35 -11.189 2.623 4.956 1.00 42.41 C ATOM 603 CG GLN A 35 -12.005 3.919 5.157 1.00 4.11 C ATOM 604 CD GLN A 35 -13.401 3.865 4.514 1.00 14.30 C ATOM 605 OE1 GLN A 35 -14.374 3.459 5.141 1.00 54.53 O ATOM 606 NE2 GLN A 35 -13.509 4.245 3.256 1.00 61.35 N ATOM 0 H GLN A 35 -8.825 3.684 4.334 1.00 54.24 H new ATOM 0 HA GLN A 35 -10.117 2.767 6.828 1.00 71.12 H new ATOM 0 HB2 GLN A 35 -10.942 2.524 3.899 1.00 42.41 H new ATOM 0 HB3 GLN A 35 -11.814 1.770 5.219 1.00 42.41 H new ATOM 0 HG2 GLN A 35 -12.112 4.111 6.225 1.00 4.11 H new ATOM 0 HG3 GLN A 35 -11.451 4.758 4.736 1.00 4.11 H new ATOM 0 HE21 GLN A 35 -12.688 4.580 2.752 1.00 61.35 H new ATOM 0 HE22 GLN A 35 -14.414 4.204 2.787 1.00 61.35 H new ATOM 615 N TRP A 36 -8.356 0.883 4.734 1.00 71.44 N ATOM 616 CA TRP A 36 -7.761 -0.474 4.544 1.00 15.01 C ATOM 617 C TRP A 36 -6.332 -0.593 5.141 1.00 3.22 C ATOM 618 O TRP A 36 -6.027 -1.586 5.815 1.00 62.13 O ATOM 619 CB TRP A 36 -7.780 -0.907 3.042 1.00 52.13 C ATOM 620 CG TRP A 36 -6.764 -0.238 2.133 1.00 4.52 C ATOM 621 CD1 TRP A 36 -6.905 0.928 1.449 1.00 13.44 C ATOM 622 CD2 TRP A 36 -5.452 -0.729 1.804 1.00 35.42 C ATOM 623 NE1 TRP A 36 -5.759 1.216 0.757 1.00 75.34 N ATOM 624 CE2 TRP A 36 -4.857 0.213 0.953 1.00 23.31 C ATOM 625 CE3 TRP A 36 -4.724 -1.870 2.164 1.00 42.22 C ATOM 626 CZ2 TRP A 36 -3.569 0.058 0.459 1.00 21.40 C ATOM 627 CZ3 TRP A 36 -3.443 -2.026 1.671 1.00 73.40 C ATOM 628 CH2 TRP A 36 -2.877 -1.066 0.825 1.00 32.41 C ATOM 0 H TRP A 36 -8.021 1.585 4.075 1.00 71.44 H new ATOM 0 HA TRP A 36 -8.394 -1.163 5.102 1.00 15.01 H new ATOM 0 HB2 TRP A 36 -7.623 -1.985 2.995 1.00 52.13 H new ATOM 0 HB3 TRP A 36 -8.776 -0.712 2.643 1.00 52.13 H new ATOM 0 HD1 TRP A 36 -7.795 1.540 1.451 1.00 13.44 H new ATOM 0 HE1 TRP A 36 -5.605 2.047 0.187 1.00 75.34 H new ATOM 0 HE3 TRP A 36 -5.156 -2.615 2.816 1.00 42.22 H new ATOM 0 HZ2 TRP A 36 -3.128 0.798 -0.192 1.00 21.40 H new ATOM 0 HZ3 TRP A 36 -2.871 -2.901 1.942 1.00 73.40 H new ATOM 0 HH2 TRP A 36 -1.874 -1.214 0.453 1.00 32.41 H new ATOM 639 N PHE A 37 -5.466 0.420 4.894 1.00 72.01 N ATOM 640 CA PHE A 37 -4.017 0.345 5.222 1.00 1.42 C ATOM 641 C PHE A 37 -3.757 0.566 6.731 1.00 62.10 C ATOM 642 O PHE A 37 -3.354 1.649 7.161 1.00 61.42 O ATOM 643 CB PHE A 37 -3.200 1.342 4.344 1.00 75.15 C ATOM 644 CG PHE A 37 -1.675 1.180 4.472 1.00 52.50 C ATOM 645 CD1 PHE A 37 -1.019 0.116 3.846 1.00 53.03 C ATOM 646 CD2 PHE A 37 -0.906 2.072 5.222 1.00 42.31 C ATOM 647 CE1 PHE A 37 0.349 -0.048 3.969 1.00 73.41 C ATOM 648 CE2 PHE A 37 0.462 1.906 5.341 1.00 14.05 C ATOM 649 CZ PHE A 37 1.088 0.847 4.716 1.00 11.52 C ATOM 0 H PHE A 37 -5.746 1.303 4.467 1.00 72.01 H new ATOM 0 HA PHE A 37 -3.675 -0.664 4.990 1.00 1.42 H new ATOM 0 HB2 PHE A 37 -3.483 1.208 3.300 1.00 75.15 H new ATOM 0 HB3 PHE A 37 -3.472 2.361 4.620 1.00 75.15 H new ATOM 0 HD1 PHE A 37 -1.589 -0.588 3.258 1.00 53.03 H new ATOM 0 HD2 PHE A 37 -1.386 2.904 5.716 1.00 42.31 H new ATOM 0 HE1 PHE A 37 0.839 -0.877 3.480 1.00 73.41 H new ATOM 0 HE2 PHE A 37 1.041 2.607 5.924 1.00 14.05 H new ATOM 0 HZ PHE A 37 2.156 0.718 4.811 1.00 11.52 H new ATOM 659 N HIS A 38 -4.009 -0.480 7.529 1.00 12.23 N ATOM 660 CA HIS A 38 -3.796 -0.452 8.988 1.00 4.13 C ATOM 661 C HIS A 38 -3.579 -1.890 9.541 1.00 54.11 C ATOM 662 O HIS A 38 -4.110 -2.859 8.976 1.00 64.21 O ATOM 663 CB HIS A 38 -4.983 0.258 9.700 1.00 10.00 C ATOM 664 CG HIS A 38 -6.305 -0.454 9.611 1.00 21.34 C ATOM 665 ND1 HIS A 38 -6.704 -1.405 10.528 1.00 53.21 N ATOM 666 CD2 HIS A 38 -7.320 -0.342 8.726 1.00 31.51 C ATOM 667 CE1 HIS A 38 -7.899 -1.845 10.211 1.00 2.31 C ATOM 668 NE2 HIS A 38 -8.300 -1.217 9.122 1.00 63.32 N ATOM 0 H HIS A 38 -4.366 -1.371 7.184 1.00 12.23 H new ATOM 0 HA HIS A 38 -2.892 0.121 9.195 1.00 4.13 H new ATOM 0 HB2 HIS A 38 -4.729 0.388 10.752 1.00 10.00 H new ATOM 0 HB3 HIS A 38 -5.097 1.255 9.274 1.00 10.00 H new ATOM 0 HD1 HIS A 38 -6.155 -1.718 11.329 1.00 53.21 H new ATOM 0 HD2 HIS A 38 -7.354 0.313 7.868 1.00 31.51 H new ATOM 0 HE1 HIS A 38 -8.459 -2.594 10.750 1.00 2.31 H new ATOM 677 N PRO A 39 -2.787 -2.047 10.653 1.00 42.42 N ATOM 678 CA PRO A 39 -2.497 -3.370 11.268 1.00 73.22 C ATOM 679 C PRO A 39 -3.593 -3.869 12.265 1.00 12.44 C ATOM 680 O PRO A 39 -4.739 -3.395 12.250 1.00 32.23 O ATOM 681 CB PRO A 39 -1.149 -3.088 11.972 1.00 35.42 C ATOM 682 CG PRO A 39 -1.279 -1.673 12.447 1.00 11.32 C ATOM 683 CD PRO A 39 -2.078 -0.950 11.382 1.00 4.33 C ATOM 0 HA PRO A 39 -2.471 -4.179 10.538 1.00 73.22 H new ATOM 0 HB2 PRO A 39 -0.981 -3.774 12.802 1.00 35.42 H new ATOM 0 HB3 PRO A 39 -0.309 -3.204 11.287 1.00 35.42 H new ATOM 0 HG2 PRO A 39 -1.785 -1.630 13.412 1.00 11.32 H new ATOM 0 HG3 PRO A 39 -0.299 -1.214 12.580 1.00 11.32 H new ATOM 0 HD2 PRO A 39 -2.782 -0.244 11.822 1.00 4.33 H new ATOM 0 HD3 PRO A 39 -1.430 -0.381 10.715 1.00 4.33 H new ATOM 691 N GLN A 40 -3.198 -4.841 13.124 1.00 74.24 N ATOM 692 CA GLN A 40 -4.094 -5.551 14.069 1.00 0.44 C ATOM 693 C GLN A 40 -4.751 -4.599 15.107 1.00 21.22 C ATOM 694 O GLN A 40 -4.071 -4.108 16.015 1.00 20.03 O ATOM 695 CB GLN A 40 -3.279 -6.641 14.814 1.00 14.34 C ATOM 696 CG GLN A 40 -2.654 -7.720 13.905 1.00 35.42 C ATOM 697 CD GLN A 40 -1.730 -8.670 14.669 1.00 51.31 C ATOM 698 OE1 GLN A 40 -0.521 -8.455 14.755 1.00 34.12 O ATOM 699 NE2 GLN A 40 -2.293 -9.709 15.259 1.00 32.32 N ATOM 0 H GLN A 40 -2.230 -5.159 13.180 1.00 74.24 H new ATOM 0 HA GLN A 40 -4.901 -5.995 13.486 1.00 0.44 H new ATOM 0 HB2 GLN A 40 -2.482 -6.156 15.378 1.00 14.34 H new ATOM 0 HB3 GLN A 40 -3.931 -7.130 15.538 1.00 14.34 H new ATOM 0 HG2 GLN A 40 -3.449 -8.296 13.431 1.00 35.42 H new ATOM 0 HG3 GLN A 40 -2.092 -7.236 13.107 1.00 35.42 H new ATOM 0 HE21 GLN A 40 -3.297 -9.863 15.171 1.00 32.32 H new ATOM 0 HE22 GLN A 40 -1.723 -10.357 15.803 1.00 32.32 H new ATOM 708 N ASP A 41 -6.066 -4.326 14.924 1.00 11.53 N ATOM 709 CA ASP A 41 -6.898 -3.498 15.849 1.00 51.05 C ATOM 710 C ASP A 41 -6.371 -2.049 16.040 1.00 33.12 C ATOM 711 O ASP A 41 -6.836 -1.316 16.925 1.00 51.43 O ATOM 712 CB ASP A 41 -7.080 -4.223 17.212 1.00 24.04 C ATOM 713 CG ASP A 41 -7.931 -5.495 17.085 1.00 22.52 C ATOM 714 OD1 ASP A 41 -7.411 -6.533 16.613 1.00 11.14 O ATOM 715 OD2 ASP A 41 -9.137 -5.461 17.423 1.00 73.31 O ATOM 0 H ASP A 41 -6.590 -4.676 14.122 1.00 11.53 H new ATOM 0 HA ASP A 41 -7.872 -3.388 15.373 1.00 51.05 H new ATOM 0 HB2 ASP A 41 -6.102 -4.482 17.617 1.00 24.04 H new ATOM 0 HB3 ASP A 41 -7.550 -3.543 17.923 1.00 24.04 H new ATOM 720 N ALA A 42 -5.431 -1.642 15.187 1.00 3.02 N ATOM 721 CA ALA A 42 -4.895 -0.276 15.151 1.00 22.45 C ATOM 722 C ALA A 42 -5.400 0.417 13.879 1.00 13.10 C ATOM 723 O ALA A 42 -5.356 -0.165 12.797 1.00 62.14 O ATOM 724 CB ALA A 42 -3.362 -0.297 15.201 1.00 73.02 C ATOM 0 H ALA A 42 -5.013 -2.259 14.491 1.00 3.02 H new ATOM 0 HA ALA A 42 -5.239 0.280 16.023 1.00 22.45 H new ATOM 0 HB1 ALA A 42 -2.983 0.725 15.173 1.00 73.02 H new ATOM 0 HB2 ALA A 42 -3.035 -0.781 16.121 1.00 73.02 H new ATOM 0 HB3 ALA A 42 -2.978 -0.850 14.344 1.00 73.02 H new ATOM 730 N SER A 43 -5.899 1.644 14.035 1.00 23.25 N ATOM 731 CA SER A 43 -6.476 2.450 12.934 1.00 41.55 C ATOM 732 C SER A 43 -5.391 3.314 12.247 1.00 51.41 C ATOM 733 O SER A 43 -4.202 3.201 12.555 1.00 50.24 O ATOM 734 CB SER A 43 -7.634 3.333 13.477 1.00 12.34 C ATOM 735 OG SER A 43 -7.188 4.241 14.472 1.00 63.02 O ATOM 0 H SER A 43 -5.919 2.121 14.937 1.00 23.25 H new ATOM 0 HA SER A 43 -6.878 1.773 12.180 1.00 41.55 H new ATOM 0 HB2 SER A 43 -8.083 3.889 12.654 1.00 12.34 H new ATOM 0 HB3 SER A 43 -8.413 2.694 13.892 1.00 12.34 H new ATOM 0 HG SER A 43 -7.944 4.779 14.787 1.00 63.02 H new ATOM 741 N VAL A 44 -5.812 4.126 11.270 1.00 53.02 N ATOM 742 CA VAL A 44 -4.928 5.057 10.531 1.00 3.13 C ATOM 743 C VAL A 44 -5.724 6.310 10.078 1.00 1.54 C ATOM 744 O VAL A 44 -6.918 6.222 9.770 1.00 23.53 O ATOM 745 CB VAL A 44 -4.272 4.330 9.291 1.00 10.23 C ATOM 746 CG1 VAL A 44 -5.347 3.694 8.385 1.00 62.42 C ATOM 747 CG2 VAL A 44 -3.338 5.266 8.473 1.00 74.03 C ATOM 0 H VAL A 44 -6.784 4.161 10.962 1.00 53.02 H new ATOM 0 HA VAL A 44 -4.128 5.381 11.197 1.00 3.13 H new ATOM 0 HB VAL A 44 -3.646 3.534 9.693 1.00 10.23 H new ATOM 0 HG11 VAL A 44 -4.866 3.201 7.540 1.00 62.42 H new ATOM 0 HG12 VAL A 44 -5.917 2.961 8.956 1.00 62.42 H new ATOM 0 HG13 VAL A 44 -6.019 4.470 8.018 1.00 62.42 H new ATOM 0 HG21 VAL A 44 -2.915 4.714 7.633 1.00 74.03 H new ATOM 0 HG22 VAL A 44 -3.911 6.114 8.098 1.00 74.03 H new ATOM 0 HG23 VAL A 44 -2.533 5.626 9.113 1.00 74.03 H new ATOM 757 N THR A 45 -5.056 7.477 10.073 1.00 73.25 N ATOM 758 CA THR A 45 -5.627 8.741 9.556 1.00 60.01 C ATOM 759 C THR A 45 -4.543 9.527 8.798 1.00 20.43 C ATOM 760 O THR A 45 -3.403 9.647 9.272 1.00 74.41 O ATOM 761 CB THR A 45 -6.225 9.624 10.708 1.00 31.53 C ATOM 762 OG1 THR A 45 -7.247 8.889 11.408 1.00 51.41 O ATOM 763 CG2 THR A 45 -6.827 10.950 10.188 1.00 34.01 C ATOM 0 H THR A 45 -4.104 7.574 10.427 1.00 73.25 H new ATOM 0 HA THR A 45 -6.442 8.489 8.878 1.00 60.01 H new ATOM 0 HB THR A 45 -5.401 9.871 11.378 1.00 31.53 H new ATOM 0 HG1 THR A 45 -7.615 9.444 12.127 1.00 51.41 H new ATOM 0 HG21 THR A 45 -7.226 11.522 11.026 1.00 34.01 H new ATOM 0 HG22 THR A 45 -6.051 11.531 9.689 1.00 34.01 H new ATOM 0 HG23 THR A 45 -7.629 10.733 9.482 1.00 34.01 H new ATOM 771 N VAL A 46 -4.902 10.049 7.615 1.00 61.24 N ATOM 772 CA VAL A 46 -3.975 10.794 6.749 1.00 73.43 C ATOM 773 C VAL A 46 -4.155 12.322 6.944 1.00 70.13 C ATOM 774 O VAL A 46 -5.236 12.866 6.688 1.00 73.10 O ATOM 775 CB VAL A 46 -4.179 10.420 5.234 1.00 13.41 C ATOM 776 CG1 VAL A 46 -3.063 11.025 4.368 1.00 70.01 C ATOM 777 CG2 VAL A 46 -4.277 8.884 5.017 1.00 15.11 C ATOM 0 H VAL A 46 -5.844 9.966 7.232 1.00 61.24 H new ATOM 0 HA VAL A 46 -2.961 10.515 7.036 1.00 73.43 H new ATOM 0 HB VAL A 46 -5.131 10.849 4.922 1.00 13.41 H new ATOM 0 HG11 VAL A 46 -3.224 10.754 3.325 1.00 70.01 H new ATOM 0 HG12 VAL A 46 -3.074 12.110 4.466 1.00 70.01 H new ATOM 0 HG13 VAL A 46 -2.098 10.641 4.698 1.00 70.01 H new ATOM 0 HG21 VAL A 46 -4.417 8.675 3.957 1.00 15.11 H new ATOM 0 HG22 VAL A 46 -3.359 8.408 5.362 1.00 15.11 H new ATOM 0 HG23 VAL A 46 -5.123 8.490 5.580 1.00 15.11 H new ATOM 787 N TYR A 47 -3.077 12.998 7.389 1.00 21.20 N ATOM 788 CA TYR A 47 -3.064 14.464 7.644 1.00 70.12 C ATOM 789 C TYR A 47 -2.918 15.282 6.333 1.00 44.51 C ATOM 790 O TYR A 47 -3.370 16.430 6.257 1.00 21.22 O ATOM 791 CB TYR A 47 -1.911 14.812 8.616 1.00 34.04 C ATOM 792 CG TYR A 47 -2.060 14.192 10.014 1.00 22.44 C ATOM 793 CD1 TYR A 47 -2.831 14.818 10.999 1.00 22.33 C ATOM 794 CD2 TYR A 47 -1.438 12.985 10.349 1.00 1.53 C ATOM 795 CE1 TYR A 47 -2.972 14.269 12.258 1.00 13.01 C ATOM 796 CE2 TYR A 47 -1.581 12.436 11.609 1.00 41.51 C ATOM 797 CZ TYR A 47 -2.345 13.081 12.558 1.00 71.43 C ATOM 798 OH TYR A 47 -2.488 12.535 13.815 1.00 12.31 O ATOM 0 H TYR A 47 -2.184 12.546 7.584 1.00 21.20 H new ATOM 0 HA TYR A 47 -4.021 14.733 8.091 1.00 70.12 H new ATOM 0 HB2 TYR A 47 -0.970 14.477 8.180 1.00 34.04 H new ATOM 0 HB3 TYR A 47 -1.849 15.896 8.716 1.00 34.04 H new ATOM 0 HD1 TYR A 47 -3.326 15.750 10.770 1.00 22.33 H new ATOM 0 HD2 TYR A 47 -0.837 12.474 9.612 1.00 1.53 H new ATOM 0 HE1 TYR A 47 -3.572 14.769 13.004 1.00 13.01 H new ATOM 0 HE2 TYR A 47 -1.095 11.502 11.850 1.00 41.51 H new ATOM 0 HH TYR A 47 -1.985 11.696 13.866 1.00 12.31 H new ATOM 808 N ASP A 48 -2.270 14.679 5.322 1.00 13.20 N ATOM 809 CA ASP A 48 -2.088 15.286 3.983 1.00 52.22 C ATOM 810 C ASP A 48 -1.943 14.158 2.937 1.00 24.31 C ATOM 811 O ASP A 48 -1.185 13.224 3.162 1.00 13.23 O ATOM 812 CB ASP A 48 -0.834 16.205 3.973 1.00 74.42 C ATOM 813 CG ASP A 48 -0.692 17.009 2.667 1.00 1.52 C ATOM 814 OD1 ASP A 48 -0.199 16.456 1.656 1.00 52.22 O ATOM 815 OD2 ASP A 48 -1.105 18.188 2.634 1.00 21.22 O ATOM 0 H ASP A 48 -1.854 13.752 5.406 1.00 13.20 H new ATOM 0 HA ASP A 48 -2.956 15.898 3.737 1.00 52.22 H new ATOM 0 HB2 ASP A 48 -0.889 16.895 4.815 1.00 74.42 H new ATOM 0 HB3 ASP A 48 0.058 15.596 4.118 1.00 74.42 H new ATOM 820 N PHE A 49 -2.642 14.251 1.793 1.00 11.51 N ATOM 821 CA PHE A 49 -2.624 13.181 0.763 1.00 73.22 C ATOM 822 C PHE A 49 -2.662 13.785 -0.659 1.00 51.42 C ATOM 823 O PHE A 49 -3.631 14.458 -1.028 1.00 71.52 O ATOM 824 CB PHE A 49 -3.831 12.220 0.979 1.00 0.51 C ATOM 825 CG PHE A 49 -3.725 10.851 0.278 1.00 32.10 C ATOM 826 CD1 PHE A 49 -4.050 10.697 -1.066 1.00 15.14 C ATOM 827 CD2 PHE A 49 -3.337 9.708 0.987 1.00 13.11 C ATOM 828 CE1 PHE A 49 -3.982 9.461 -1.671 1.00 43.35 C ATOM 829 CE2 PHE A 49 -3.277 8.472 0.375 1.00 23.32 C ATOM 830 CZ PHE A 49 -3.599 8.350 -0.953 1.00 12.24 C ATOM 0 H PHE A 49 -3.227 15.051 1.552 1.00 11.51 H new ATOM 0 HA PHE A 49 -1.697 12.616 0.864 1.00 73.22 H new ATOM 0 HB2 PHE A 49 -3.952 12.052 2.049 1.00 0.51 H new ATOM 0 HB3 PHE A 49 -4.736 12.718 0.630 1.00 0.51 H new ATOM 0 HD1 PHE A 49 -4.359 11.557 -1.642 1.00 15.14 H new ATOM 0 HD2 PHE A 49 -3.080 9.795 2.032 1.00 13.11 H new ATOM 0 HE1 PHE A 49 -4.231 9.363 -2.717 1.00 43.35 H new ATOM 0 HE2 PHE A 49 -2.977 7.602 0.941 1.00 23.32 H new ATOM 0 HZ PHE A 49 -3.552 7.384 -1.434 1.00 12.24 H new ATOM 840 N ASN A 50 -1.599 13.550 -1.444 1.00 60.12 N ATOM 841 CA ASN A 50 -1.564 13.896 -2.878 1.00 41.54 C ATOM 842 C ASN A 50 -0.953 12.718 -3.668 1.00 14.32 C ATOM 843 O ASN A 50 0.263 12.514 -3.655 1.00 71.10 O ATOM 844 CB ASN A 50 -0.754 15.206 -3.108 1.00 52.15 C ATOM 845 CG ASN A 50 -0.805 15.702 -4.558 1.00 72.53 C ATOM 846 OD1 ASN A 50 -1.801 15.519 -5.256 1.00 51.20 O ATOM 847 ND2 ASN A 50 0.260 16.322 -5.028 1.00 53.44 N ATOM 0 H ASN A 50 -0.740 13.116 -1.106 1.00 60.12 H new ATOM 0 HA ASN A 50 -2.579 14.074 -3.234 1.00 41.54 H new ATOM 0 HB2 ASN A 50 -1.141 15.985 -2.451 1.00 52.15 H new ATOM 0 HB3 ASN A 50 0.285 15.037 -2.825 1.00 52.15 H new ATOM 0 HD21 ASN A 50 0.269 16.662 -5.990 1.00 53.44 H new ATOM 0 HD22 ASN A 50 1.074 16.462 -4.430 1.00 53.44 H new ATOM 854 N ALA A 51 -1.813 11.936 -4.342 1.00 32.44 N ATOM 855 CA ALA A 51 -1.384 10.769 -5.139 1.00 62.35 C ATOM 856 C ALA A 51 -1.398 11.099 -6.647 1.00 53.41 C ATOM 857 O ALA A 51 -2.454 11.092 -7.293 1.00 0.13 O ATOM 858 CB ALA A 51 -2.267 9.559 -4.822 1.00 12.25 C ATOM 0 H ALA A 51 -2.821 12.092 -4.351 1.00 32.44 H new ATOM 0 HA ALA A 51 -0.358 10.519 -4.869 1.00 62.35 H new ATOM 0 HB1 ALA A 51 -1.941 8.705 -5.416 1.00 12.25 H new ATOM 0 HB2 ALA A 51 -2.185 9.317 -3.762 1.00 12.25 H new ATOM 0 HB3 ALA A 51 -3.304 9.793 -5.062 1.00 12.25 H new ATOM 864 N THR A 52 -0.207 11.415 -7.171 1.00 23.03 N ATOM 865 CA THR A 52 0.010 11.765 -8.591 1.00 21.22 C ATOM 866 C THR A 52 1.491 11.537 -8.957 1.00 73.24 C ATOM 867 O THR A 52 2.294 11.174 -8.092 1.00 12.21 O ATOM 868 CB THR A 52 -0.403 13.257 -8.878 1.00 14.04 C ATOM 869 OG1 THR A 52 -0.269 13.555 -10.276 1.00 44.14 O ATOM 870 CG2 THR A 52 0.426 14.271 -8.061 1.00 25.03 C ATOM 0 H THR A 52 0.649 11.437 -6.617 1.00 23.03 H new ATOM 0 HA THR A 52 -0.619 11.123 -9.208 1.00 21.22 H new ATOM 0 HB THR A 52 -1.445 13.354 -8.572 1.00 14.04 H new ATOM 0 HG1 THR A 52 -0.531 14.485 -10.439 1.00 44.14 H new ATOM 0 HG21 THR A 52 0.099 15.283 -8.298 1.00 25.03 H new ATOM 0 HG22 THR A 52 0.284 14.084 -6.997 1.00 25.03 H new ATOM 0 HG23 THR A 52 1.482 14.163 -8.310 1.00 25.03 H new ATOM 878 N LYS A 53 1.855 11.731 -10.231 1.00 5.55 N ATOM 879 CA LYS A 53 3.265 11.676 -10.661 1.00 31.30 C ATOM 880 C LYS A 53 4.034 12.894 -10.094 1.00 43.21 C ATOM 881 O LYS A 53 3.782 14.039 -10.479 1.00 20.42 O ATOM 882 CB LYS A 53 3.354 11.595 -12.203 1.00 4.02 C ATOM 883 CG LYS A 53 2.621 10.371 -12.787 1.00 61.45 C ATOM 884 CD LYS A 53 2.821 10.187 -14.300 1.00 65.12 C ATOM 885 CE LYS A 53 2.161 11.290 -15.143 1.00 63.14 C ATOM 886 NZ LYS A 53 2.280 11.011 -16.597 1.00 71.31 N ATOM 0 H LYS A 53 1.196 11.928 -10.984 1.00 5.55 H new ATOM 0 HA LYS A 53 3.734 10.775 -10.265 1.00 31.30 H new ATOM 0 HB2 LYS A 53 2.932 12.503 -12.634 1.00 4.02 H new ATOM 0 HB3 LYS A 53 4.402 11.559 -12.499 1.00 4.02 H new ATOM 0 HG2 LYS A 53 2.967 9.474 -12.273 1.00 61.45 H new ATOM 0 HG3 LYS A 53 1.555 10.466 -12.580 1.00 61.45 H new ATOM 0 HD2 LYS A 53 3.889 10.164 -14.517 1.00 65.12 H new ATOM 0 HD3 LYS A 53 2.414 9.220 -14.598 1.00 65.12 H new ATOM 0 HE2 LYS A 53 1.108 11.375 -14.873 1.00 63.14 H new ATOM 0 HE3 LYS A 53 2.626 12.249 -14.917 1.00 63.14 H new ATOM 0 HZ1 LYS A 53 1.795 11.757 -17.135 1.00 71.31 H new ATOM 0 HZ2 LYS A 53 3.285 10.989 -16.865 1.00 71.31 H new ATOM 0 HZ3 LYS A 53 1.844 10.091 -16.811 1.00 71.31 H new ATOM 900 N GLY A 54 4.953 12.618 -9.157 1.00 13.23 N ATOM 901 CA GLY A 54 5.614 13.665 -8.356 1.00 75.23 C ATOM 902 C GLY A 54 4.797 14.115 -7.129 1.00 2.40 C ATOM 903 O GLY A 54 4.937 15.254 -6.673 1.00 45.41 O ATOM 0 H GLY A 54 5.259 11.671 -8.932 1.00 13.23 H new ATOM 0 HA2 GLY A 54 6.583 13.296 -8.021 1.00 75.23 H new ATOM 0 HA3 GLY A 54 5.805 14.530 -8.991 1.00 75.23 H new ATOM 907 N GLY A 55 3.942 13.212 -6.594 1.00 61.30 N ATOM 908 CA GLY A 55 3.101 13.503 -5.410 1.00 40.10 C ATOM 909 C GLY A 55 3.731 13.095 -4.065 1.00 5.43 C ATOM 910 O GLY A 55 4.887 12.664 -4.017 1.00 34.53 O ATOM 0 H GLY A 55 3.817 12.271 -6.967 1.00 61.30 H new ATOM 0 HA2 GLY A 55 2.885 14.571 -5.387 1.00 40.10 H new ATOM 0 HA3 GLY A 55 2.147 12.987 -5.522 1.00 40.10 H new ATOM 914 N SER A 56 2.952 13.240 -2.965 1.00 64.43 N ATOM 915 CA SER A 56 3.387 12.895 -1.581 1.00 72.50 C ATOM 916 C SER A 56 2.175 12.830 -0.619 1.00 2.30 C ATOM 917 O SER A 56 1.234 13.613 -0.762 1.00 13.22 O ATOM 918 CB SER A 56 4.428 13.916 -1.052 1.00 2.53 C ATOM 919 OG SER A 56 3.929 15.249 -1.072 1.00 13.01 O ATOM 0 H SER A 56 1.999 13.601 -3.009 1.00 64.43 H new ATOM 0 HA SER A 56 3.855 11.911 -1.621 1.00 72.50 H new ATOM 0 HB2 SER A 56 4.710 13.650 -0.033 1.00 2.53 H new ATOM 0 HB3 SER A 56 5.332 13.859 -1.658 1.00 2.53 H new ATOM 0 HG SER A 56 4.614 15.860 -0.730 1.00 13.01 H new ATOM 925 N ALA A 57 2.209 11.912 0.373 1.00 33.40 N ATOM 926 CA ALA A 57 1.096 11.733 1.345 1.00 54.40 C ATOM 927 C ALA A 57 1.604 11.457 2.779 1.00 35.34 C ATOM 928 O ALA A 57 2.164 10.396 3.045 1.00 1.43 O ATOM 929 CB ALA A 57 0.165 10.592 0.896 1.00 63.45 C ATOM 0 H ALA A 57 2.995 11.280 0.525 1.00 33.40 H new ATOM 0 HA ALA A 57 0.542 12.672 1.365 1.00 54.40 H new ATOM 0 HB1 ALA A 57 -0.643 10.476 1.619 1.00 63.45 H new ATOM 0 HB2 ALA A 57 -0.254 10.828 -0.082 1.00 63.45 H new ATOM 0 HB3 ALA A 57 0.732 9.663 0.833 1.00 63.45 H new ATOM 935 N PHE A 58 1.362 12.406 3.701 1.00 25.40 N ATOM 936 CA PHE A 58 1.725 12.273 5.134 1.00 22.51 C ATOM 937 C PHE A 58 0.541 11.687 5.943 1.00 15.32 C ATOM 938 O PHE A 58 -0.504 12.330 6.097 1.00 25.13 O ATOM 939 CB PHE A 58 2.164 13.647 5.723 1.00 0.01 C ATOM 940 CG PHE A 58 2.437 13.638 7.238 1.00 14.34 C ATOM 941 CD1 PHE A 58 3.358 12.750 7.800 1.00 41.44 C ATOM 942 CD2 PHE A 58 1.775 14.520 8.094 1.00 53.23 C ATOM 943 CE1 PHE A 58 3.603 12.743 9.160 1.00 10.14 C ATOM 944 CE2 PHE A 58 2.020 14.511 9.454 1.00 31.23 C ATOM 945 CZ PHE A 58 2.933 13.624 9.987 1.00 60.21 C ATOM 0 H PHE A 58 0.908 13.292 3.478 1.00 25.40 H new ATOM 0 HA PHE A 58 2.568 11.586 5.210 1.00 22.51 H new ATOM 0 HB2 PHE A 58 3.065 13.977 5.207 1.00 0.01 H new ATOM 0 HB3 PHE A 58 1.388 14.383 5.511 1.00 0.01 H new ATOM 0 HD1 PHE A 58 3.887 12.058 7.161 1.00 41.44 H new ATOM 0 HD2 PHE A 58 1.060 15.220 7.687 1.00 53.23 H new ATOM 0 HE1 PHE A 58 4.318 12.049 9.576 1.00 10.14 H new ATOM 0 HE2 PHE A 58 1.496 15.199 10.101 1.00 31.23 H new ATOM 0 HZ PHE A 58 3.124 13.618 11.050 1.00 60.21 H new ATOM 955 N TYR A 59 0.730 10.469 6.471 1.00 33.14 N ATOM 956 CA TYR A 59 -0.265 9.774 7.321 1.00 10.45 C ATOM 957 C TYR A 59 0.373 9.242 8.622 1.00 62.30 C ATOM 958 O TYR A 59 1.589 9.338 8.820 1.00 42.41 O ATOM 959 CB TYR A 59 -0.944 8.628 6.521 1.00 24.45 C ATOM 960 CG TYR A 59 -0.004 7.570 5.904 1.00 20.24 C ATOM 961 CD1 TYR A 59 0.580 7.767 4.643 1.00 23.14 C ATOM 962 CD2 TYR A 59 0.265 6.366 6.561 1.00 30.23 C ATOM 963 CE1 TYR A 59 1.399 6.808 4.073 1.00 73.13 C ATOM 964 CE2 TYR A 59 1.075 5.405 5.989 1.00 12.31 C ATOM 965 CZ TYR A 59 1.638 5.629 4.748 1.00 20.13 C ATOM 966 OH TYR A 59 2.432 4.656 4.176 1.00 71.14 O ATOM 0 H TYR A 59 1.582 9.929 6.323 1.00 33.14 H new ATOM 0 HA TYR A 59 -1.028 10.496 7.610 1.00 10.45 H new ATOM 0 HB2 TYR A 59 -1.644 8.118 7.183 1.00 24.45 H new ATOM 0 HB3 TYR A 59 -1.531 9.073 5.718 1.00 24.45 H new ATOM 0 HD1 TYR A 59 0.387 8.685 4.107 1.00 23.14 H new ATOM 0 HD2 TYR A 59 -0.168 6.184 7.533 1.00 30.23 H new ATOM 0 HE1 TYR A 59 1.848 6.982 3.106 1.00 73.13 H new ATOM 0 HE2 TYR A 59 1.268 4.480 6.511 1.00 12.31 H new ATOM 0 HH TYR A 59 3.330 5.017 4.019 1.00 71.14 H new ATOM 976 N ALA A 60 -0.471 8.685 9.512 1.00 12.30 N ATOM 977 CA ALA A 60 -0.027 8.110 10.799 1.00 24.22 C ATOM 978 C ALA A 60 -0.932 6.933 11.233 1.00 25.12 C ATOM 979 O ALA A 60 -2.161 7.023 11.168 1.00 25.21 O ATOM 980 CB ALA A 60 -0.002 9.195 11.885 1.00 73.01 C ATOM 0 H ALA A 60 -1.478 8.620 9.361 1.00 12.30 H new ATOM 0 HA ALA A 60 0.982 7.721 10.663 1.00 24.22 H new ATOM 0 HB1 ALA A 60 0.327 8.758 12.828 1.00 73.01 H new ATOM 0 HB2 ALA A 60 0.687 9.987 11.592 1.00 73.01 H new ATOM 0 HB3 ALA A 60 -1.002 9.611 12.007 1.00 73.01 H new ATOM 986 N ILE A 61 -0.293 5.836 11.667 1.00 74.13 N ATOM 987 CA ILE A 61 -0.966 4.649 12.219 1.00 24.00 C ATOM 988 C ILE A 61 -1.383 4.923 13.687 1.00 24.43 C ATOM 989 O ILE A 61 -0.533 5.000 14.582 1.00 63.43 O ATOM 990 CB ILE A 61 -0.015 3.390 12.144 1.00 61.14 C ATOM 991 CG1 ILE A 61 0.407 3.088 10.663 1.00 43.33 C ATOM 992 CG2 ILE A 61 -0.653 2.142 12.818 1.00 31.14 C ATOM 993 CD1 ILE A 61 -0.734 2.700 9.726 1.00 5.03 C ATOM 0 H ILE A 61 0.723 5.747 11.644 1.00 74.13 H new ATOM 0 HA ILE A 61 -1.857 4.439 11.628 1.00 24.00 H new ATOM 0 HB ILE A 61 0.888 3.630 12.706 1.00 61.14 H new ATOM 0 HG12 ILE A 61 0.905 3.969 10.258 1.00 43.33 H new ATOM 0 HG13 ILE A 61 1.141 2.282 10.669 1.00 43.33 H new ATOM 0 HG21 ILE A 61 0.033 1.298 12.745 1.00 31.14 H new ATOM 0 HG22 ILE A 61 -0.852 2.357 13.868 1.00 31.14 H new ATOM 0 HG23 ILE A 61 -1.588 1.894 12.315 1.00 31.14 H new ATOM 0 HD11 ILE A 61 -0.338 2.512 8.728 1.00 5.03 H new ATOM 0 HD12 ILE A 61 -1.220 1.799 10.099 1.00 5.03 H new ATOM 0 HD13 ILE A 61 -1.460 3.512 9.681 1.00 5.03 H new ATOM 1005 N GLN A 62 -2.693 5.102 13.902 1.00 43.44 N ATOM 1006 CA GLN A 62 -3.273 5.395 15.228 1.00 74.43 C ATOM 1007 C GLN A 62 -3.552 4.067 16.002 1.00 72.12 C ATOM 1008 O GLN A 62 -4.552 3.392 15.764 1.00 23.21 O ATOM 1009 CB GLN A 62 -4.580 6.252 15.042 1.00 12.02 C ATOM 1010 CG GLN A 62 -4.773 7.349 16.111 1.00 42.44 C ATOM 1011 CD GLN A 62 -4.869 6.806 17.535 1.00 24.42 C ATOM 1012 OE1 GLN A 62 -5.461 5.762 17.784 1.00 24.04 O ATOM 1013 NE2 GLN A 62 -4.234 7.470 18.470 1.00 4.14 N ATOM 0 H GLN A 62 -3.389 5.048 13.158 1.00 43.44 H new ATOM 0 HA GLN A 62 -2.567 5.973 15.825 1.00 74.43 H new ATOM 0 HB2 GLN A 62 -4.558 6.719 14.057 1.00 12.02 H new ATOM 0 HB3 GLN A 62 -5.443 5.587 15.060 1.00 12.02 H new ATOM 0 HG2 GLN A 62 -3.941 8.050 16.054 1.00 42.44 H new ATOM 0 HG3 GLN A 62 -5.679 7.911 15.884 1.00 42.44 H new ATOM 0 HE21 GLN A 62 -3.748 8.337 18.240 1.00 4.14 H new ATOM 0 HE22 GLN A 62 -4.226 7.120 19.428 1.00 4.14 H new ATOM 1022 N ALA A 63 -2.646 3.719 16.922 1.00 61.21 N ATOM 1023 CA ALA A 63 -2.774 2.546 17.825 1.00 61.43 C ATOM 1024 C ALA A 63 -3.089 3.013 19.278 1.00 40.54 C ATOM 1025 O ALA A 63 -2.724 4.138 19.645 1.00 25.44 O ATOM 1026 CB ALA A 63 -1.471 1.714 17.765 1.00 34.53 C ATOM 0 H ALA A 63 -1.786 4.246 17.071 1.00 61.21 H new ATOM 0 HA ALA A 63 -3.602 1.917 17.499 1.00 61.43 H new ATOM 0 HB1 ALA A 63 -1.559 0.852 18.426 1.00 34.53 H new ATOM 0 HB2 ALA A 63 -1.304 1.373 16.743 1.00 34.53 H new ATOM 0 HB3 ALA A 63 -0.631 2.331 18.083 1.00 34.53 H new ATOM 1032 N PRO A 64 -3.741 2.152 20.149 1.00 50.55 N ATOM 1033 CA PRO A 64 -4.162 2.559 21.533 1.00 41.31 C ATOM 1034 C PRO A 64 -2.985 2.820 22.531 1.00 61.14 C ATOM 1035 O PRO A 64 -3.228 3.188 23.688 1.00 60.25 O ATOM 1036 CB PRO A 64 -5.041 1.357 21.992 1.00 24.32 C ATOM 1037 CG PRO A 64 -4.499 0.189 21.224 1.00 61.42 C ATOM 1038 CD PRO A 64 -4.139 0.737 19.862 1.00 34.22 C ATOM 0 HA PRO A 64 -4.676 3.520 21.521 1.00 41.31 H new ATOM 0 HB2 PRO A 64 -4.965 1.196 23.067 1.00 24.32 H new ATOM 0 HB3 PRO A 64 -6.094 1.526 21.769 1.00 24.32 H new ATOM 0 HG2 PRO A 64 -3.626 -0.236 21.720 1.00 61.42 H new ATOM 0 HG3 PRO A 64 -5.240 -0.607 21.144 1.00 61.42 H new ATOM 0 HD2 PRO A 64 -3.324 0.175 19.406 1.00 34.22 H new ATOM 0 HD3 PRO A 64 -4.983 0.689 19.174 1.00 34.22 H new ATOM 1046 N GLN A 65 -1.728 2.613 22.089 1.00 65.31 N ATOM 1047 CA GLN A 65 -0.519 2.888 22.914 1.00 75.40 C ATOM 1048 C GLN A 65 0.563 3.680 22.113 1.00 32.10 C ATOM 1049 O GLN A 65 1.520 4.199 22.700 1.00 23.42 O ATOM 1050 CB GLN A 65 0.058 1.537 23.446 1.00 52.45 C ATOM 1051 CG GLN A 65 1.221 1.664 24.461 1.00 54.00 C ATOM 1052 CD GLN A 65 1.791 0.316 24.912 1.00 22.41 C ATOM 1053 OE1 GLN A 65 2.705 -0.224 24.294 1.00 40.44 O ATOM 1054 NE2 GLN A 65 1.253 -0.241 25.980 1.00 22.14 N ATOM 0 H GLN A 65 -1.516 2.253 21.158 1.00 65.31 H new ATOM 0 HA GLN A 65 -0.809 3.517 23.756 1.00 75.40 H new ATOM 0 HB2 GLN A 65 -0.751 0.976 23.914 1.00 52.45 H new ATOM 0 HB3 GLN A 65 0.403 0.949 22.596 1.00 52.45 H new ATOM 0 HG2 GLN A 65 2.020 2.255 24.013 1.00 54.00 H new ATOM 0 HG3 GLN A 65 0.871 2.212 25.336 1.00 54.00 H new ATOM 0 HE21 GLN A 65 0.495 0.230 26.474 1.00 22.14 H new ATOM 0 HE22 GLN A 65 1.595 -1.143 26.312 1.00 22.14 H new ATOM 1063 N MET A 66 0.388 3.810 20.778 1.00 41.25 N ATOM 1064 CA MET A 66 1.434 4.382 19.884 1.00 75.55 C ATOM 1065 C MET A 66 0.819 5.041 18.624 1.00 1.32 C ATOM 1066 O MET A 66 -0.201 4.595 18.128 1.00 44.54 O ATOM 1067 CB MET A 66 2.417 3.251 19.461 1.00 1.21 C ATOM 1068 CG MET A 66 3.587 3.689 18.559 1.00 33.11 C ATOM 1069 SD MET A 66 4.630 2.303 18.045 1.00 73.52 S ATOM 1070 CE MET A 66 3.470 1.310 17.092 1.00 0.33 C ATOM 0 H MET A 66 -0.464 3.529 20.292 1.00 41.25 H new ATOM 0 HA MET A 66 1.965 5.159 20.434 1.00 75.55 H new ATOM 0 HB2 MET A 66 2.827 2.795 20.362 1.00 1.21 H new ATOM 0 HB3 MET A 66 1.851 2.478 18.942 1.00 1.21 H new ATOM 0 HG2 MET A 66 3.191 4.188 17.674 1.00 33.11 H new ATOM 0 HG3 MET A 66 4.197 4.419 19.091 1.00 33.11 H new ATOM 0 HE1 MET A 66 4.021 0.639 16.433 1.00 0.33 H new ATOM 0 HE2 MET A 66 2.850 0.724 17.770 1.00 0.33 H new ATOM 0 HE3 MET A 66 2.836 1.965 16.495 1.00 0.33 H new ATOM 1080 N ILE A 67 1.456 6.115 18.116 1.00 35.45 N ATOM 1081 CA ILE A 67 1.104 6.736 16.813 1.00 73.11 C ATOM 1082 C ILE A 67 2.377 6.799 15.934 1.00 34.01 C ATOM 1083 O ILE A 67 3.378 7.409 16.332 1.00 13.15 O ATOM 1084 CB ILE A 67 0.477 8.178 16.986 1.00 45.44 C ATOM 1085 CG1 ILE A 67 -0.750 8.146 17.965 1.00 61.33 C ATOM 1086 CG2 ILE A 67 0.063 8.767 15.608 1.00 32.32 C ATOM 1087 CD1 ILE A 67 -1.370 9.506 18.263 1.00 2.13 C ATOM 0 H ILE A 67 2.229 6.580 18.593 1.00 35.45 H new ATOM 0 HA ILE A 67 0.342 6.122 16.332 1.00 73.11 H new ATOM 0 HB ILE A 67 1.239 8.825 17.421 1.00 45.44 H new ATOM 0 HG12 ILE A 67 -1.517 7.498 17.541 1.00 61.33 H new ATOM 0 HG13 ILE A 67 -0.434 7.693 18.905 1.00 61.33 H new ATOM 0 HG21 ILE A 67 -0.366 9.759 15.750 1.00 32.32 H new ATOM 0 HG22 ILE A 67 0.940 8.840 14.965 1.00 32.32 H new ATOM 0 HG23 ILE A 67 -0.676 8.116 15.141 1.00 32.32 H new ATOM 0 HD11 ILE A 67 -2.209 9.381 18.947 1.00 2.13 H new ATOM 0 HD12 ILE A 67 -0.622 10.154 18.720 1.00 2.13 H new ATOM 0 HD13 ILE A 67 -1.722 9.956 17.335 1.00 2.13 H new ATOM 1099 N SER A 68 2.344 6.155 14.747 1.00 51.45 N ATOM 1100 CA SER A 68 3.546 5.987 13.880 1.00 62.22 C ATOM 1101 C SER A 68 3.394 6.743 12.540 1.00 22.31 C ATOM 1102 O SER A 68 2.576 6.376 11.700 1.00 52.22 O ATOM 1103 CB SER A 68 3.795 4.479 13.616 1.00 52.40 C ATOM 1104 OG SER A 68 3.926 3.754 14.830 1.00 73.53 O ATOM 0 H SER A 68 1.497 5.739 14.360 1.00 51.45 H new ATOM 0 HA SER A 68 4.401 6.413 14.404 1.00 62.22 H new ATOM 0 HB2 SER A 68 2.970 4.069 13.033 1.00 52.40 H new ATOM 0 HB3 SER A 68 4.699 4.357 13.019 1.00 52.40 H new ATOM 0 HG SER A 68 4.587 4.194 15.404 1.00 73.53 H new ATOM 1110 N TYR A 69 4.233 7.765 12.332 1.00 35.43 N ATOM 1111 CA TYR A 69 4.105 8.727 11.208 1.00 35.43 C ATOM 1112 C TYR A 69 4.948 8.282 9.987 1.00 64.20 C ATOM 1113 O TYR A 69 6.078 7.807 10.150 1.00 73.55 O ATOM 1114 CB TYR A 69 4.550 10.136 11.688 1.00 41.32 C ATOM 1115 CG TYR A 69 3.858 10.607 12.985 1.00 52.13 C ATOM 1116 CD1 TYR A 69 4.266 10.107 14.225 1.00 52.25 C ATOM 1117 CD2 TYR A 69 2.809 11.532 12.976 1.00 35.23 C ATOM 1118 CE1 TYR A 69 3.658 10.498 15.393 1.00 70.20 C ATOM 1119 CE2 TYR A 69 2.195 11.930 14.153 1.00 2.11 C ATOM 1120 CZ TYR A 69 2.626 11.412 15.358 1.00 62.25 C ATOM 1121 OH TYR A 69 2.014 11.801 16.533 1.00 71.35 O ATOM 0 H TYR A 69 5.030 7.957 12.939 1.00 35.43 H new ATOM 0 HA TYR A 69 3.062 8.759 10.892 1.00 35.43 H new ATOM 0 HB2 TYR A 69 5.629 10.131 11.846 1.00 41.32 H new ATOM 0 HB3 TYR A 69 4.347 10.858 10.897 1.00 41.32 H new ATOM 0 HD1 TYR A 69 5.078 9.397 14.266 1.00 52.25 H new ATOM 0 HD2 TYR A 69 2.472 11.943 12.036 1.00 35.23 H new ATOM 0 HE1 TYR A 69 3.988 10.090 16.337 1.00 70.20 H new ATOM 0 HE2 TYR A 69 1.383 12.642 14.128 1.00 2.11 H new ATOM 0 HH TYR A 69 1.308 12.451 16.334 1.00 71.35 H new ATOM 1131 N THR A 70 4.414 8.480 8.768 1.00 12.33 N ATOM 1132 CA THR A 70 5.035 8.000 7.505 1.00 54.31 C ATOM 1133 C THR A 70 4.541 8.844 6.305 1.00 32.25 C ATOM 1134 O THR A 70 3.354 9.140 6.204 1.00 12.32 O ATOM 1135 CB THR A 70 4.713 6.476 7.238 1.00 32.31 C ATOM 1136 OG1 THR A 70 5.292 5.651 8.266 1.00 54.43 O ATOM 1137 CG2 THR A 70 5.230 5.995 5.871 1.00 24.50 C ATOM 0 H THR A 70 3.536 8.979 8.623 1.00 12.33 H new ATOM 0 HA THR A 70 6.114 8.111 7.614 1.00 54.31 H new ATOM 0 HB THR A 70 3.627 6.385 7.244 1.00 32.31 H new ATOM 0 HG1 THR A 70 5.082 4.710 8.087 1.00 54.43 H new ATOM 0 HG21 THR A 70 4.982 4.942 5.738 1.00 24.50 H new ATOM 0 HG22 THR A 70 4.763 6.580 5.079 1.00 24.50 H new ATOM 0 HG23 THR A 70 6.312 6.122 5.826 1.00 24.50 H new ATOM 1145 N ILE A 71 5.464 9.227 5.400 1.00 75.52 N ATOM 1146 CA ILE A 71 5.129 9.934 4.144 1.00 14.15 C ATOM 1147 C ILE A 71 5.460 9.044 2.926 1.00 52.32 C ATOM 1148 O ILE A 71 6.598 8.603 2.786 1.00 12.02 O ATOM 1149 CB ILE A 71 5.927 11.285 4.004 1.00 21.43 C ATOM 1150 CG1 ILE A 71 5.834 12.123 5.314 1.00 45.25 C ATOM 1151 CG2 ILE A 71 5.417 12.101 2.783 1.00 62.35 C ATOM 1152 CD1 ILE A 71 6.612 13.422 5.299 1.00 50.53 C ATOM 0 H ILE A 71 6.463 9.056 5.518 1.00 75.52 H new ATOM 0 HA ILE A 71 4.062 10.155 4.176 1.00 14.15 H new ATOM 0 HB ILE A 71 6.976 11.044 3.835 1.00 21.43 H new ATOM 0 HG12 ILE A 71 4.786 12.347 5.511 1.00 45.25 H new ATOM 0 HG13 ILE A 71 6.191 11.513 6.144 1.00 45.25 H new ATOM 0 HG21 ILE A 71 5.982 13.030 2.705 1.00 62.35 H new ATOM 0 HG22 ILE A 71 5.552 11.517 1.873 1.00 62.35 H new ATOM 0 HG23 ILE A 71 4.359 12.329 2.914 1.00 62.35 H new ATOM 0 HD11 ILE A 71 6.485 13.933 6.253 1.00 50.53 H new ATOM 0 HD12 ILE A 71 7.669 13.211 5.138 1.00 50.53 H new ATOM 0 HD13 ILE A 71 6.242 14.058 4.495 1.00 50.53 H new ATOM 1164 N ALA A 72 4.483 8.802 2.038 1.00 44.25 N ATOM 1165 CA ALA A 72 4.730 8.078 0.774 1.00 21.53 C ATOM 1166 C ALA A 72 4.892 9.093 -0.382 1.00 71.44 C ATOM 1167 O ALA A 72 3.944 9.801 -0.725 1.00 40.23 O ATOM 1168 CB ALA A 72 3.571 7.097 0.502 1.00 55.53 C ATOM 0 H ALA A 72 3.515 9.095 2.169 1.00 44.25 H new ATOM 0 HA ALA A 72 5.651 7.500 0.851 1.00 21.53 H new ATOM 0 HB1 ALA A 72 3.756 6.565 -0.431 1.00 55.53 H new ATOM 0 HB2 ALA A 72 3.501 6.381 1.321 1.00 55.53 H new ATOM 0 HB3 ALA A 72 2.636 7.651 0.424 1.00 55.53 H new ATOM 1174 N GLU A 73 6.102 9.157 -0.969 1.00 31.12 N ATOM 1175 CA GLU A 73 6.399 10.016 -2.135 1.00 44.14 C ATOM 1176 C GLU A 73 5.999 9.294 -3.435 1.00 13.54 C ATOM 1177 O GLU A 73 6.668 8.348 -3.847 1.00 53.13 O ATOM 1178 CB GLU A 73 7.923 10.327 -2.166 1.00 74.30 C ATOM 1179 CG GLU A 73 8.470 11.063 -0.926 1.00 42.42 C ATOM 1180 CD GLU A 73 8.006 12.526 -0.814 1.00 44.44 C ATOM 1181 OE1 GLU A 73 8.340 13.332 -1.714 1.00 41.12 O ATOM 1182 OE2 GLU A 73 7.341 12.891 0.179 1.00 2.52 O ATOM 0 H GLU A 73 6.904 8.614 -0.649 1.00 31.12 H new ATOM 0 HA GLU A 73 5.833 10.944 -2.053 1.00 44.14 H new ATOM 0 HB2 GLU A 73 8.466 9.389 -2.281 1.00 74.30 H new ATOM 0 HB3 GLU A 73 8.136 10.929 -3.049 1.00 74.30 H new ATOM 0 HG2 GLU A 73 8.161 10.524 -0.030 1.00 42.42 H new ATOM 0 HG3 GLU A 73 9.559 11.039 -0.952 1.00 42.42 H new ATOM 1189 N TYR A 74 4.954 9.777 -4.108 1.00 73.40 N ATOM 1190 CA TYR A 74 4.433 9.131 -5.330 1.00 22.13 C ATOM 1191 C TYR A 74 5.282 9.528 -6.555 1.00 73.30 C ATOM 1192 O TYR A 74 5.101 10.606 -7.118 1.00 60.04 O ATOM 1193 CB TYR A 74 2.937 9.473 -5.530 1.00 54.44 C ATOM 1194 CG TYR A 74 2.020 8.934 -4.416 1.00 24.51 C ATOM 1195 CD1 TYR A 74 1.789 9.674 -3.260 1.00 22.20 C ATOM 1196 CD2 TYR A 74 1.406 7.677 -4.514 1.00 74.42 C ATOM 1197 CE1 TYR A 74 0.986 9.189 -2.250 1.00 2.15 C ATOM 1198 CE2 TYR A 74 0.594 7.192 -3.501 1.00 2.50 C ATOM 1199 CZ TYR A 74 0.390 7.953 -2.370 1.00 70.23 C ATOM 1200 OH TYR A 74 -0.414 7.478 -1.353 1.00 4.41 O ATOM 0 H TYR A 74 4.445 10.617 -3.832 1.00 73.40 H new ATOM 0 HA TYR A 74 4.508 8.050 -5.216 1.00 22.13 H new ATOM 0 HB2 TYR A 74 2.826 10.556 -5.586 1.00 54.44 H new ATOM 0 HB3 TYR A 74 2.607 9.069 -6.487 1.00 54.44 H new ATOM 0 HD1 TYR A 74 2.247 10.646 -3.152 1.00 22.20 H new ATOM 0 HD2 TYR A 74 1.569 7.075 -5.396 1.00 74.42 H new ATOM 0 HE1 TYR A 74 0.824 9.780 -1.361 1.00 2.15 H new ATOM 0 HE2 TYR A 74 0.124 6.224 -3.597 1.00 2.50 H new ATOM 0 HH TYR A 74 -1.313 7.858 -1.442 1.00 4.41 H new ATOM 1210 N LEU A 75 6.237 8.652 -6.927 1.00 52.20 N ATOM 1211 CA LEU A 75 7.171 8.900 -8.045 1.00 51.01 C ATOM 1212 C LEU A 75 6.414 8.947 -9.396 1.00 21.24 C ATOM 1213 O LEU A 75 6.450 9.963 -10.101 1.00 11.13 O ATOM 1214 CB LEU A 75 8.287 7.815 -8.060 1.00 3.12 C ATOM 1215 CG LEU A 75 9.412 7.992 -9.136 1.00 64.44 C ATOM 1216 CD1 LEU A 75 10.134 9.352 -8.985 1.00 61.10 C ATOM 1217 CD2 LEU A 75 10.422 6.826 -9.080 1.00 35.02 C ATOM 0 H LEU A 75 6.383 7.755 -6.463 1.00 52.20 H new ATOM 0 HA LEU A 75 7.641 9.872 -7.899 1.00 51.01 H new ATOM 0 HB2 LEU A 75 8.755 7.792 -7.076 1.00 3.12 H new ATOM 0 HB3 LEU A 75 7.817 6.843 -8.212 1.00 3.12 H new ATOM 0 HG LEU A 75 8.932 7.979 -10.114 1.00 64.44 H new ATOM 0 HD11 LEU A 75 10.908 9.440 -9.748 1.00 61.10 H new ATOM 0 HD12 LEU A 75 9.414 10.161 -9.104 1.00 61.10 H new ATOM 0 HD13 LEU A 75 10.590 9.414 -7.997 1.00 61.10 H new ATOM 0 HD21 LEU A 75 11.192 6.975 -9.837 1.00 35.02 H new ATOM 0 HD22 LEU A 75 10.885 6.793 -8.094 1.00 35.02 H new ATOM 0 HD23 LEU A 75 9.903 5.886 -9.269 1.00 35.02 H new ATOM 1229 N GLN A 76 5.711 7.848 -9.728 1.00 13.34 N ATOM 1230 CA GLN A 76 4.868 7.767 -10.940 1.00 4.32 C ATOM 1231 C GLN A 76 3.547 7.023 -10.636 1.00 40.14 C ATOM 1232 O GLN A 76 3.550 5.836 -10.357 1.00 23.30 O ATOM 1233 CB GLN A 76 5.641 7.034 -12.075 1.00 43.44 C ATOM 1234 CG GLN A 76 4.849 6.878 -13.395 1.00 52.55 C ATOM 1235 CD GLN A 76 5.610 6.132 -14.496 1.00 50.14 C ATOM 1236 OE1 GLN A 76 6.832 6.192 -14.581 1.00 42.51 O ATOM 1237 NE2 GLN A 76 4.893 5.424 -15.350 1.00 51.32 N ATOM 0 H GLN A 76 5.710 6.995 -9.169 1.00 13.34 H new ATOM 0 HA GLN A 76 4.628 8.780 -11.264 1.00 4.32 H new ATOM 0 HB2 GLN A 76 6.562 7.580 -12.281 1.00 43.44 H new ATOM 0 HB3 GLN A 76 5.930 6.045 -11.720 1.00 43.44 H new ATOM 0 HG2 GLN A 76 3.919 6.348 -13.188 1.00 52.55 H new ATOM 0 HG3 GLN A 76 4.577 7.868 -13.762 1.00 52.55 H new ATOM 0 HE21 GLN A 76 3.878 5.390 -15.258 1.00 51.32 H new ATOM 0 HE22 GLN A 76 5.355 4.911 -16.101 1.00 51.32 H new ATOM 1246 N VAL A 77 2.418 7.732 -10.714 1.00 74.44 N ATOM 1247 CA VAL A 77 1.068 7.126 -10.673 1.00 51.33 C ATOM 1248 C VAL A 77 0.375 7.452 -12.013 1.00 54.42 C ATOM 1249 O VAL A 77 -0.010 8.602 -12.261 1.00 32.31 O ATOM 1250 CB VAL A 77 0.231 7.679 -9.453 1.00 54.33 C ATOM 1251 CG1 VAL A 77 -1.178 7.036 -9.377 1.00 41.20 C ATOM 1252 CG2 VAL A 77 1.001 7.479 -8.124 1.00 75.11 C ATOM 0 H VAL A 77 2.406 8.748 -10.808 1.00 74.44 H new ATOM 0 HA VAL A 77 1.142 6.047 -10.536 1.00 51.33 H new ATOM 0 HB VAL A 77 0.089 8.748 -9.614 1.00 54.33 H new ATOM 0 HG11 VAL A 77 -1.719 7.445 -8.524 1.00 41.20 H new ATOM 0 HG12 VAL A 77 -1.727 7.254 -10.293 1.00 41.20 H new ATOM 0 HG13 VAL A 77 -1.080 5.957 -9.261 1.00 41.20 H new ATOM 0 HG21 VAL A 77 0.406 7.867 -7.297 1.00 75.11 H new ATOM 0 HG22 VAL A 77 1.189 6.417 -7.969 1.00 75.11 H new ATOM 0 HG23 VAL A 77 1.950 8.013 -8.170 1.00 75.11 H new ATOM 1262 N ASP A 78 0.222 6.434 -12.874 1.00 0.13 N ATOM 1263 CA ASP A 78 -0.153 6.633 -14.290 1.00 1.34 C ATOM 1264 C ASP A 78 -1.137 5.530 -14.742 1.00 11.43 C ATOM 1265 O ASP A 78 -0.781 4.341 -14.727 1.00 41.22 O ATOM 1266 CB ASP A 78 1.136 6.634 -15.156 1.00 12.22 C ATOM 1267 CG ASP A 78 0.896 7.084 -16.603 1.00 72.32 C ATOM 1268 OD1 ASP A 78 0.893 8.312 -16.866 1.00 72.24 O ATOM 1269 OD2 ASP A 78 0.692 6.221 -17.483 1.00 55.15 O ATOM 0 H ASP A 78 0.353 5.456 -12.615 1.00 0.13 H new ATOM 0 HA ASP A 78 -0.658 7.591 -14.412 1.00 1.34 H new ATOM 0 HB2 ASP A 78 1.874 7.292 -14.696 1.00 12.22 H new ATOM 0 HB3 ASP A 78 1.563 5.631 -15.161 1.00 12.22 H new ATOM 1274 N ALA A 79 -2.374 5.952 -15.123 1.00 0.02 N ATOM 1275 CA ALA A 79 -3.505 5.052 -15.481 1.00 25.12 C ATOM 1276 C ALA A 79 -3.994 4.205 -14.257 1.00 52.14 C ATOM 1277 O ALA A 79 -3.269 4.073 -13.266 1.00 71.14 O ATOM 1278 CB ALA A 79 -3.134 4.159 -16.697 1.00 22.11 C ATOM 0 H ALA A 79 -2.616 6.940 -15.191 1.00 0.02 H new ATOM 0 HA ALA A 79 -4.347 5.679 -15.774 1.00 25.12 H new ATOM 0 HB1 ALA A 79 -3.975 3.509 -16.941 1.00 22.11 H new ATOM 0 HB2 ALA A 79 -2.902 4.790 -17.555 1.00 22.11 H new ATOM 0 HB3 ALA A 79 -2.265 3.550 -16.449 1.00 22.11 H new ATOM 1284 N PRO A 80 -5.231 3.583 -14.290 1.00 14.45 N ATOM 1285 CA PRO A 80 -5.641 2.584 -13.252 1.00 71.42 C ATOM 1286 C PRO A 80 -4.907 1.210 -13.371 1.00 61.35 C ATOM 1287 O PRO A 80 -5.407 0.198 -12.887 1.00 71.13 O ATOM 1288 CB PRO A 80 -7.175 2.443 -13.483 1.00 70.43 C ATOM 1289 CG PRO A 80 -7.379 2.802 -14.923 1.00 15.54 C ATOM 1290 CD PRO A 80 -6.338 3.859 -15.248 1.00 21.43 C ATOM 0 HA PRO A 80 -5.377 2.916 -12.248 1.00 71.42 H new ATOM 0 HB2 PRO A 80 -7.515 1.428 -13.276 1.00 70.43 H new ATOM 0 HB3 PRO A 80 -7.737 3.107 -12.826 1.00 70.43 H new ATOM 0 HG2 PRO A 80 -7.259 1.928 -15.563 1.00 15.54 H new ATOM 0 HG3 PRO A 80 -8.386 3.183 -15.090 1.00 15.54 H new ATOM 0 HD2 PRO A 80 -6.000 3.781 -16.281 1.00 21.43 H new ATOM 0 HD3 PRO A 80 -6.737 4.865 -15.118 1.00 21.43 H new ATOM 1298 N TYR A 81 -3.694 1.199 -13.970 1.00 42.43 N ATOM 1299 CA TYR A 81 -2.956 -0.031 -14.325 1.00 65.44 C ATOM 1300 C TYR A 81 -1.521 -0.045 -13.735 1.00 41.43 C ATOM 1301 O TYR A 81 -0.926 -1.118 -13.592 1.00 20.22 O ATOM 1302 CB TYR A 81 -2.902 -0.172 -15.872 1.00 3.55 C ATOM 1303 CG TYR A 81 -4.295 -0.254 -16.534 1.00 14.12 C ATOM 1304 CD1 TYR A 81 -5.045 -1.432 -16.490 1.00 21.33 C ATOM 1305 CD2 TYR A 81 -4.857 0.845 -17.192 1.00 70.40 C ATOM 1306 CE1 TYR A 81 -6.302 -1.506 -17.061 1.00 33.25 C ATOM 1307 CE2 TYR A 81 -6.114 0.772 -17.765 1.00 64.03 C ATOM 1308 CZ TYR A 81 -6.828 -0.403 -17.704 1.00 12.22 C ATOM 1309 OH TYR A 81 -8.078 -0.478 -18.284 1.00 75.21 O ATOM 0 H TYR A 81 -3.197 2.053 -14.222 1.00 42.43 H new ATOM 0 HA TYR A 81 -3.488 -0.878 -13.892 1.00 65.44 H new ATOM 0 HB2 TYR A 81 -2.361 0.678 -16.287 1.00 3.55 H new ATOM 0 HB3 TYR A 81 -2.334 -1.067 -16.127 1.00 3.55 H new ATOM 0 HD1 TYR A 81 -4.634 -2.302 -16.000 1.00 21.33 H new ATOM 0 HD2 TYR A 81 -4.299 1.768 -17.254 1.00 70.40 H new ATOM 0 HE1 TYR A 81 -6.870 -2.423 -17.004 1.00 33.25 H new ATOM 0 HE2 TYR A 81 -6.534 1.635 -18.259 1.00 64.03 H new ATOM 0 HH TYR A 81 -8.301 0.384 -18.694 1.00 75.21 H new ATOM 1319 N TYR A 82 -0.953 1.140 -13.402 1.00 4.54 N ATOM 1320 CA TYR A 82 0.422 1.229 -12.839 1.00 42.00 C ATOM 1321 C TYR A 82 0.521 2.293 -11.721 1.00 63.33 C ATOM 1322 O TYR A 82 0.123 3.451 -11.901 1.00 74.25 O ATOM 1323 CB TYR A 82 1.458 1.535 -13.956 1.00 35.40 C ATOM 1324 CG TYR A 82 2.929 1.443 -13.485 1.00 0.02 C ATOM 1325 CD1 TYR A 82 3.499 0.206 -13.167 1.00 4.34 C ATOM 1326 CD2 TYR A 82 3.737 2.583 -13.350 1.00 11.54 C ATOM 1327 CE1 TYR A 82 4.811 0.105 -12.737 1.00 44.12 C ATOM 1328 CE2 TYR A 82 5.050 2.487 -12.921 1.00 44.34 C ATOM 1329 CZ TYR A 82 5.584 1.251 -12.615 1.00 2.11 C ATOM 1330 OH TYR A 82 6.897 1.160 -12.196 1.00 33.20 O ATOM 0 H TYR A 82 -1.419 2.041 -13.511 1.00 4.54 H new ATOM 0 HA TYR A 82 0.649 0.258 -12.399 1.00 42.00 H new ATOM 0 HB2 TYR A 82 1.306 0.838 -14.780 1.00 35.40 H new ATOM 0 HB3 TYR A 82 1.273 2.536 -14.346 1.00 35.40 H new ATOM 0 HD1 TYR A 82 2.903 -0.690 -13.259 1.00 4.34 H new ATOM 0 HD2 TYR A 82 3.327 3.554 -13.585 1.00 11.54 H new ATOM 0 HE1 TYR A 82 5.231 -0.861 -12.498 1.00 44.12 H new ATOM 0 HE2 TYR A 82 5.655 3.377 -12.826 1.00 44.34 H new ATOM 0 HH TYR A 82 7.225 2.051 -11.952 1.00 33.20 H new ATOM 1340 N ILE A 83 1.068 1.872 -10.564 1.00 43.31 N ATOM 1341 CA ILE A 83 1.362 2.753 -9.416 1.00 72.20 C ATOM 1342 C ILE A 83 2.851 2.582 -9.036 1.00 35.45 C ATOM 1343 O ILE A 83 3.372 1.464 -9.055 1.00 43.03 O ATOM 1344 CB ILE A 83 0.486 2.433 -8.131 1.00 22.40 C ATOM 1345 CG1 ILE A 83 -1.049 2.311 -8.445 1.00 52.14 C ATOM 1346 CG2 ILE A 83 0.741 3.496 -7.024 1.00 24.41 C ATOM 1347 CD1 ILE A 83 -1.500 0.964 -9.013 1.00 22.04 C ATOM 0 H ILE A 83 1.321 0.898 -10.398 1.00 43.31 H new ATOM 0 HA ILE A 83 1.124 3.770 -9.727 1.00 72.20 H new ATOM 0 HB ILE A 83 0.803 1.454 -7.770 1.00 22.40 H new ATOM 0 HG12 ILE A 83 -1.606 2.504 -7.528 1.00 52.14 H new ATOM 0 HG13 ILE A 83 -1.320 3.094 -9.153 1.00 52.14 H new ATOM 0 HG21 ILE A 83 0.134 3.263 -6.149 1.00 24.41 H new ATOM 0 HG22 ILE A 83 1.795 3.487 -6.747 1.00 24.41 H new ATOM 0 HG23 ILE A 83 0.473 4.484 -7.399 1.00 24.41 H new ATOM 0 HD11 ILE A 83 -2.575 0.987 -9.194 1.00 22.04 H new ATOM 0 HD12 ILE A 83 -0.978 0.772 -9.951 1.00 22.04 H new ATOM 0 HD13 ILE A 83 -1.269 0.173 -8.300 1.00 22.04 H new ATOM 1359 N GLU A 84 3.523 3.688 -8.713 1.00 20.24 N ATOM 1360 CA GLU A 84 4.912 3.683 -8.216 1.00 23.04 C ATOM 1361 C GLU A 84 5.106 4.784 -7.153 1.00 50.44 C ATOM 1362 O GLU A 84 4.885 5.973 -7.433 1.00 60.04 O ATOM 1363 CB GLU A 84 5.909 3.859 -9.398 1.00 35.31 C ATOM 1364 CG GLU A 84 7.391 4.046 -8.990 1.00 63.21 C ATOM 1365 CD GLU A 84 8.398 3.880 -10.147 1.00 33.13 C ATOM 1366 OE1 GLU A 84 8.018 4.047 -11.327 1.00 32.20 O ATOM 1367 OE2 GLU A 84 9.581 3.573 -9.874 1.00 70.01 O ATOM 0 H GLU A 84 3.121 4.623 -8.787 1.00 20.24 H new ATOM 0 HA GLU A 84 5.115 2.722 -7.744 1.00 23.04 H new ATOM 0 HB2 GLU A 84 5.835 2.987 -10.047 1.00 35.31 H new ATOM 0 HB3 GLU A 84 5.600 4.722 -9.987 1.00 35.31 H new ATOM 0 HG2 GLU A 84 7.513 5.039 -8.558 1.00 63.21 H new ATOM 0 HG3 GLU A 84 7.633 3.326 -8.208 1.00 63.21 H new ATOM 1374 N TYR A 85 5.508 4.382 -5.934 1.00 11.42 N ATOM 1375 CA TYR A 85 5.830 5.322 -4.844 1.00 51.42 C ATOM 1376 C TYR A 85 6.982 4.798 -3.949 1.00 65.13 C ATOM 1377 O TYR A 85 7.347 3.617 -3.982 1.00 40.41 O ATOM 1378 CB TYR A 85 4.569 5.662 -3.989 1.00 1.21 C ATOM 1379 CG TYR A 85 3.915 4.488 -3.227 1.00 30.33 C ATOM 1380 CD1 TYR A 85 4.312 4.153 -1.924 1.00 34.14 C ATOM 1381 CD2 TYR A 85 2.890 3.732 -3.802 1.00 3.42 C ATOM 1382 CE1 TYR A 85 3.715 3.110 -1.236 1.00 40.15 C ATOM 1383 CE2 TYR A 85 2.293 2.691 -3.114 1.00 32.32 C ATOM 1384 CZ TYR A 85 2.706 2.384 -1.835 1.00 62.42 C ATOM 1385 OH TYR A 85 2.108 1.340 -1.157 1.00 40.54 O ATOM 0 H TYR A 85 5.619 3.401 -5.677 1.00 11.42 H new ATOM 0 HA TYR A 85 6.174 6.243 -5.314 1.00 51.42 H new ATOM 0 HB2 TYR A 85 4.845 6.428 -3.264 1.00 1.21 H new ATOM 0 HB3 TYR A 85 3.819 6.101 -4.647 1.00 1.21 H new ATOM 0 HD1 TYR A 85 5.099 4.720 -1.448 1.00 34.14 H new ATOM 0 HD2 TYR A 85 2.558 3.965 -4.803 1.00 3.42 H new ATOM 0 HE1 TYR A 85 4.038 2.866 -0.235 1.00 40.15 H new ATOM 0 HE2 TYR A 85 1.504 2.119 -3.579 1.00 32.32 H new ATOM 0 HH TYR A 85 1.417 0.936 -1.722 1.00 40.54 H new ATOM 1395 N LEU A 86 7.527 5.714 -3.145 1.00 63.44 N ATOM 1396 CA LEU A 86 8.616 5.459 -2.197 1.00 64.34 C ATOM 1397 C LEU A 86 8.078 5.709 -0.776 1.00 72.21 C ATOM 1398 O LEU A 86 7.618 6.812 -0.484 1.00 11.52 O ATOM 1399 CB LEU A 86 9.782 6.439 -2.494 1.00 44.31 C ATOM 1400 CG LEU A 86 10.312 6.465 -3.963 1.00 55.42 C ATOM 1401 CD1 LEU A 86 11.257 7.663 -4.195 1.00 31.22 C ATOM 1402 CD2 LEU A 86 11.003 5.134 -4.333 1.00 54.24 C ATOM 0 H LEU A 86 7.213 6.684 -3.135 1.00 63.44 H new ATOM 0 HA LEU A 86 8.977 4.434 -2.287 1.00 64.34 H new ATOM 0 HB2 LEU A 86 9.457 7.446 -2.230 1.00 44.31 H new ATOM 0 HB3 LEU A 86 10.614 6.189 -1.835 1.00 44.31 H new ATOM 0 HG LEU A 86 9.451 6.587 -4.621 1.00 55.42 H new ATOM 0 HD11 LEU A 86 11.609 7.654 -5.226 1.00 31.22 H new ATOM 0 HD12 LEU A 86 10.720 8.592 -4.003 1.00 31.22 H new ATOM 0 HD13 LEU A 86 12.109 7.590 -3.520 1.00 31.22 H new ATOM 0 HD21 LEU A 86 11.361 5.183 -5.361 1.00 54.24 H new ATOM 0 HD22 LEU A 86 11.846 4.963 -3.663 1.00 54.24 H new ATOM 0 HD23 LEU A 86 10.290 4.315 -4.236 1.00 54.24 H new ATOM 1414 N ASP A 87 8.154 4.713 0.102 1.00 32.13 N ATOM 1415 CA ASP A 87 7.633 4.829 1.465 1.00 23.55 C ATOM 1416 C ASP A 87 8.764 5.329 2.395 1.00 65.04 C ATOM 1417 O ASP A 87 9.691 4.588 2.734 1.00 21.25 O ATOM 1418 CB ASP A 87 7.077 3.451 1.919 1.00 11.03 C ATOM 1419 CG ASP A 87 6.254 3.545 3.208 1.00 12.02 C ATOM 1420 OD1 ASP A 87 5.118 4.063 3.148 1.00 63.31 O ATOM 1421 OD2 ASP A 87 6.734 3.112 4.285 1.00 70.12 O ATOM 0 H ASP A 87 8.575 3.808 -0.107 1.00 32.13 H new ATOM 0 HA ASP A 87 6.816 5.549 1.507 1.00 23.55 H new ATOM 0 HB2 ASP A 87 6.457 3.034 1.126 1.00 11.03 H new ATOM 0 HB3 ASP A 87 7.907 2.761 2.071 1.00 11.03 H new ATOM 1426 N TYR A 88 8.688 6.611 2.760 1.00 23.11 N ATOM 1427 CA TYR A 88 9.642 7.253 3.676 1.00 51.33 C ATOM 1428 C TYR A 88 9.068 7.268 5.097 1.00 22.02 C ATOM 1429 O TYR A 88 7.961 7.754 5.322 1.00 64.40 O ATOM 1430 CB TYR A 88 9.972 8.706 3.211 1.00 54.32 C ATOM 1431 CG TYR A 88 10.982 8.788 2.054 1.00 42.43 C ATOM 1432 CD1 TYR A 88 10.585 8.621 0.727 1.00 42.14 C ATOM 1433 CD2 TYR A 88 12.340 9.025 2.301 1.00 4.32 C ATOM 1434 CE1 TYR A 88 11.499 8.696 -0.306 1.00 21.02 C ATOM 1435 CE2 TYR A 88 13.254 9.100 1.269 1.00 44.40 C ATOM 1436 CZ TYR A 88 12.830 8.932 -0.032 1.00 31.21 C ATOM 1437 OH TYR A 88 13.738 9.004 -1.067 1.00 42.12 O ATOM 0 H TYR A 88 7.958 7.240 2.427 1.00 23.11 H new ATOM 0 HA TYR A 88 10.568 6.678 3.669 1.00 51.33 H new ATOM 0 HB2 TYR A 88 9.047 9.196 2.906 1.00 54.32 H new ATOM 0 HB3 TYR A 88 10.364 9.266 4.060 1.00 54.32 H new ATOM 0 HD1 TYR A 88 9.546 8.430 0.504 1.00 42.14 H new ATOM 0 HD2 TYR A 88 12.679 9.152 3.319 1.00 4.32 H new ATOM 0 HE1 TYR A 88 11.172 8.570 -1.327 1.00 21.02 H new ATOM 0 HE2 TYR A 88 14.296 9.289 1.480 1.00 44.40 H new ATOM 0 HH TYR A 88 14.633 9.177 -0.706 1.00 42.12 H new ATOM 1447 N PHE A 89 9.839 6.725 6.037 1.00 64.33 N ATOM 1448 CA PHE A 89 9.561 6.831 7.481 1.00 24.33 C ATOM 1449 C PHE A 89 9.631 8.326 7.875 1.00 24.12 C ATOM 1450 O PHE A 89 10.516 9.030 7.392 1.00 51.32 O ATOM 1451 CB PHE A 89 10.611 5.997 8.274 1.00 13.13 C ATOM 1452 CG PHE A 89 10.666 4.510 7.877 1.00 73.13 C ATOM 1453 CD1 PHE A 89 11.283 4.103 6.686 1.00 13.03 C ATOM 1454 CD2 PHE A 89 10.093 3.525 8.683 1.00 11.12 C ATOM 1455 CE1 PHE A 89 11.324 2.769 6.323 1.00 10.30 C ATOM 1456 CE2 PHE A 89 10.135 2.192 8.314 1.00 71.55 C ATOM 1457 CZ PHE A 89 10.749 1.814 7.137 1.00 63.50 C ATOM 0 H PHE A 89 10.683 6.193 5.823 1.00 64.33 H new ATOM 0 HA PHE A 89 8.571 6.440 7.716 1.00 24.33 H new ATOM 0 HB2 PHE A 89 11.597 6.438 8.125 1.00 13.13 H new ATOM 0 HB3 PHE A 89 10.387 6.069 9.338 1.00 13.13 H new ATOM 0 HD1 PHE A 89 11.734 4.843 6.041 1.00 13.03 H new ATOM 0 HD2 PHE A 89 9.610 3.807 9.607 1.00 11.12 H new ATOM 0 HE1 PHE A 89 11.806 2.475 5.402 1.00 10.30 H new ATOM 0 HE2 PHE A 89 9.685 1.444 8.950 1.00 71.55 H new ATOM 0 HZ PHE A 89 10.779 0.772 6.853 1.00 63.50 H new ATOM 1467 N ALA A 90 8.678 8.830 8.679 1.00 62.11 N ATOM 1468 CA ALA A 90 8.666 10.257 9.089 1.00 21.21 C ATOM 1469 C ALA A 90 9.270 10.443 10.500 1.00 31.42 C ATOM 1470 O ALA A 90 9.127 9.580 11.369 1.00 71.50 O ATOM 1471 CB ALA A 90 7.243 10.834 9.014 1.00 21.41 C ATOM 0 H ALA A 90 7.908 8.279 9.059 1.00 62.11 H new ATOM 0 HA ALA A 90 9.293 10.811 8.390 1.00 21.21 H new ATOM 0 HB1 ALA A 90 7.258 11.880 9.319 1.00 21.41 H new ATOM 0 HB2 ALA A 90 6.873 10.759 7.991 1.00 21.41 H new ATOM 0 HB3 ALA A 90 6.587 10.272 9.679 1.00 21.41 H new ATOM 1477 N THR A 91 9.906 11.613 10.727 1.00 34.54 N ATOM 1478 CA THR A 91 10.595 11.962 12.009 1.00 42.42 C ATOM 1479 C THR A 91 9.607 12.481 13.104 1.00 44.10 C ATOM 1480 O THR A 91 9.980 13.263 13.984 1.00 44.32 O ATOM 1481 CB THR A 91 11.723 13.019 11.730 1.00 42.45 C ATOM 1482 OG1 THR A 91 12.502 13.273 12.910 1.00 73.32 O ATOM 1483 CG2 THR A 91 11.167 14.350 11.177 1.00 42.40 C ATOM 0 H THR A 91 9.962 12.353 10.027 1.00 34.54 H new ATOM 0 HA THR A 91 11.038 11.048 12.404 1.00 42.42 H new ATOM 0 HB THR A 91 12.363 12.582 10.964 1.00 42.45 H new ATOM 0 HG1 THR A 91 11.904 13.469 13.661 1.00 73.32 H new ATOM 0 HG21 THR A 91 11.990 15.043 11.002 1.00 42.40 H new ATOM 0 HG22 THR A 91 10.644 14.164 10.239 1.00 42.40 H new ATOM 0 HG23 THR A 91 10.475 14.783 11.899 1.00 42.40 H new ATOM 1491 N SER A 92 8.332 12.049 12.993 1.00 2.33 N ATOM 1492 CA SER A 92 7.206 12.318 13.951 1.00 13.15 C ATOM 1493 C SER A 92 6.654 13.770 13.888 1.00 31.00 C ATOM 1494 O SER A 92 5.485 14.005 14.221 1.00 21.44 O ATOM 1495 CB SER A 92 7.534 11.923 15.428 1.00 12.02 C ATOM 1496 OG SER A 92 8.400 12.845 16.074 1.00 2.04 O ATOM 0 H SER A 92 8.033 11.477 12.203 1.00 2.33 H new ATOM 0 HA SER A 92 6.412 11.658 13.601 1.00 13.15 H new ATOM 0 HB2 SER A 92 6.605 11.850 15.993 1.00 12.02 H new ATOM 0 HB3 SER A 92 7.992 10.934 15.440 1.00 12.02 H new ATOM 0 HG SER A 92 9.054 13.187 15.429 1.00 2.04 H new ATOM 1502 N LYS A 93 7.490 14.730 13.457 1.00 32.31 N ATOM 1503 CA LYS A 93 7.127 16.162 13.382 1.00 5.55 C ATOM 1504 C LYS A 93 6.146 16.463 12.219 1.00 75.23 C ATOM 1505 O LYS A 93 5.149 17.170 12.405 1.00 24.44 O ATOM 1506 CB LYS A 93 8.415 17.009 13.225 1.00 71.33 C ATOM 1507 CG LYS A 93 9.412 16.867 14.396 1.00 11.31 C ATOM 1508 CD LYS A 93 10.692 17.699 14.179 1.00 64.14 C ATOM 1509 CE LYS A 93 11.664 17.645 15.372 1.00 55.41 C ATOM 1510 NZ LYS A 93 12.885 18.456 15.122 1.00 44.51 N ATOM 0 H LYS A 93 8.443 14.537 13.148 1.00 32.31 H new ATOM 0 HA LYS A 93 6.614 16.425 14.307 1.00 5.55 H new ATOM 0 HB2 LYS A 93 8.915 16.722 12.300 1.00 71.33 H new ATOM 0 HB3 LYS A 93 8.137 18.058 13.125 1.00 71.33 H new ATOM 0 HG2 LYS A 93 8.929 17.182 15.321 1.00 11.31 H new ATOM 0 HG3 LYS A 93 9.680 15.817 14.517 1.00 11.31 H new ATOM 0 HD2 LYS A 93 11.204 17.339 13.286 1.00 64.14 H new ATOM 0 HD3 LYS A 93 10.415 18.736 13.992 1.00 64.14 H new ATOM 0 HE2 LYS A 93 11.162 18.010 16.268 1.00 55.41 H new ATOM 0 HE3 LYS A 93 11.947 16.610 15.564 1.00 55.41 H new ATOM 0 HZ1 LYS A 93 13.516 18.396 15.946 1.00 44.51 H new ATOM 0 HZ2 LYS A 93 13.378 18.092 14.281 1.00 44.51 H new ATOM 0 HZ3 LYS A 93 12.616 19.448 14.963 1.00 44.51 H new ATOM 1524 N GLY A 94 6.450 15.922 11.024 1.00 50.23 N ATOM 1525 CA GLY A 94 5.664 16.203 9.808 1.00 3.02 C ATOM 1526 C GLY A 94 6.432 15.919 8.517 1.00 51.22 C ATOM 1527 O GLY A 94 5.827 15.735 7.462 1.00 0.54 O ATOM 0 H GLY A 94 7.235 15.288 10.875 1.00 50.23 H new ATOM 0 HA2 GLY A 94 4.756 15.601 9.823 1.00 3.02 H new ATOM 0 HA3 GLY A 94 5.354 17.248 9.817 1.00 3.02 H new ATOM 1531 N GLU A 95 7.776 15.882 8.604 1.00 60.05 N ATOM 1532 CA GLU A 95 8.669 15.611 7.448 1.00 65.52 C ATOM 1533 C GLU A 95 9.339 14.220 7.585 1.00 70.24 C ATOM 1534 O GLU A 95 9.126 13.525 8.581 1.00 13.51 O ATOM 1535 CB GLU A 95 9.730 16.741 7.326 1.00 20.24 C ATOM 1536 CG GLU A 95 10.654 16.901 8.551 1.00 43.01 C ATOM 1537 CD GLU A 95 11.617 18.093 8.429 1.00 24.12 C ATOM 1538 OE1 GLU A 95 12.652 17.965 7.740 1.00 31.25 O ATOM 1539 OE2 GLU A 95 11.322 19.174 8.983 1.00 34.15 O ATOM 0 H GLU A 95 8.279 16.039 9.477 1.00 60.05 H new ATOM 0 HA GLU A 95 8.074 15.597 6.535 1.00 65.52 H new ATOM 0 HB2 GLU A 95 10.346 16.548 6.448 1.00 20.24 H new ATOM 0 HB3 GLU A 95 9.215 17.686 7.152 1.00 20.24 H new ATOM 0 HG2 GLU A 95 10.043 17.025 9.445 1.00 43.01 H new ATOM 0 HG3 GLU A 95 11.232 15.987 8.684 1.00 43.01 H new ATOM 1546 N LYS A 96 10.128 13.818 6.562 1.00 70.40 N ATOM 1547 CA LYS A 96 10.845 12.508 6.538 1.00 21.02 C ATOM 1548 C LYS A 96 11.853 12.351 7.715 1.00 50.41 C ATOM 1549 O LYS A 96 12.240 13.331 8.357 1.00 32.13 O ATOM 1550 CB LYS A 96 11.593 12.297 5.178 1.00 35.03 C ATOM 1551 CG LYS A 96 12.907 13.119 4.993 1.00 5.31 C ATOM 1552 CD LYS A 96 12.678 14.645 4.859 1.00 11.05 C ATOM 1553 CE LYS A 96 11.983 15.024 3.532 1.00 21.12 C ATOM 1554 NZ LYS A 96 11.777 16.489 3.394 1.00 1.43 N ATOM 0 H LYS A 96 10.290 14.385 5.730 1.00 70.40 H new ATOM 0 HA LYS A 96 10.077 11.743 6.653 1.00 21.02 H new ATOM 0 HB2 LYS A 96 11.831 11.238 5.076 1.00 35.03 H new ATOM 0 HB3 LYS A 96 10.911 12.550 4.366 1.00 35.03 H new ATOM 0 HG2 LYS A 96 13.563 12.933 5.843 1.00 5.31 H new ATOM 0 HG3 LYS A 96 13.427 12.760 4.105 1.00 5.31 H new ATOM 0 HD2 LYS A 96 12.072 14.993 5.695 1.00 11.05 H new ATOM 0 HD3 LYS A 96 13.636 15.160 4.924 1.00 11.05 H new ATOM 0 HE2 LYS A 96 12.583 14.665 2.696 1.00 21.12 H new ATOM 0 HE3 LYS A 96 11.019 14.518 3.473 1.00 21.12 H new ATOM 0 HZ1 LYS A 96 11.308 16.690 2.488 1.00 1.43 H new ATOM 0 HZ2 LYS A 96 11.182 16.831 4.175 1.00 1.43 H new ATOM 0 HZ3 LYS A 96 12.697 16.973 3.422 1.00 1.43 H new ATOM 1568 N ASP A 97 12.282 11.106 7.959 1.00 43.52 N ATOM 1569 CA ASP A 97 13.184 10.741 9.077 1.00 4.31 C ATOM 1570 C ASP A 97 14.673 10.805 8.659 1.00 5.32 C ATOM 1571 O ASP A 97 15.520 11.225 9.455 1.00 74.34 O ATOM 1572 CB ASP A 97 12.791 9.328 9.590 1.00 72.31 C ATOM 1573 CG ASP A 97 13.795 8.696 10.564 1.00 73.13 C ATOM 1574 OD1 ASP A 97 13.910 9.184 11.713 1.00 34.34 O ATOM 1575 OD2 ASP A 97 14.496 7.735 10.169 1.00 14.12 O ATOM 0 H ASP A 97 12.013 10.309 7.383 1.00 43.52 H new ATOM 0 HA ASP A 97 13.067 11.464 9.884 1.00 4.31 H new ATOM 0 HB2 ASP A 97 11.820 9.392 10.081 1.00 72.31 H new ATOM 0 HB3 ASP A 97 12.671 8.666 8.733 1.00 72.31 H new ATOM 1580 N THR A 98 14.973 10.331 7.425 1.00 34.21 N ATOM 1581 CA THR A 98 16.334 10.377 6.803 1.00 71.03 C ATOM 1582 C THR A 98 17.298 9.271 7.343 1.00 43.30 C ATOM 1583 O THR A 98 18.183 8.815 6.605 1.00 63.03 O ATOM 1584 CB THR A 98 17.005 11.809 6.910 1.00 54.34 C ATOM 1585 OG1 THR A 98 16.116 12.796 6.353 1.00 63.12 O ATOM 1586 CG2 THR A 98 18.371 11.907 6.197 1.00 34.13 C ATOM 0 H THR A 98 14.274 9.900 6.821 1.00 34.21 H new ATOM 0 HA THR A 98 16.167 10.166 5.747 1.00 71.03 H new ATOM 0 HB THR A 98 17.185 11.988 7.970 1.00 54.34 H new ATOM 0 HG1 THR A 98 16.528 13.683 6.420 1.00 63.12 H new ATOM 0 HG21 THR A 98 18.770 12.915 6.312 1.00 34.13 H new ATOM 0 HG22 THR A 98 19.064 11.190 6.638 1.00 34.13 H new ATOM 0 HG23 THR A 98 18.245 11.686 5.137 1.00 34.13 H new ATOM 1594 N SER A 99 17.109 8.809 8.607 1.00 11.43 N ATOM 1595 CA SER A 99 17.952 7.737 9.211 1.00 44.31 C ATOM 1596 C SER A 99 17.670 6.377 8.533 1.00 35.10 C ATOM 1597 O SER A 99 18.516 5.478 8.532 1.00 14.11 O ATOM 1598 CB SER A 99 17.717 7.635 10.742 1.00 0.42 C ATOM 1599 OG SER A 99 18.519 6.620 11.340 1.00 25.30 O ATOM 0 H SER A 99 16.381 9.161 9.229 1.00 11.43 H new ATOM 0 HA SER A 99 18.997 8.001 9.045 1.00 44.31 H new ATOM 0 HB2 SER A 99 17.941 8.595 11.208 1.00 0.42 H new ATOM 0 HB3 SER A 99 16.665 7.425 10.934 1.00 0.42 H new ATOM 0 HG SER A 99 18.343 6.589 12.304 1.00 25.30 H new ATOM 1605 N MET A 100 16.456 6.238 7.971 1.00 61.42 N ATOM 1606 CA MET A 100 16.099 5.117 7.076 1.00 52.14 C ATOM 1607 C MET A 100 15.838 5.628 5.629 1.00 53.01 C ATOM 1608 O MET A 100 15.347 6.753 5.448 1.00 64.50 O ATOM 1609 CB MET A 100 14.867 4.360 7.622 1.00 52.13 C ATOM 1610 CG MET A 100 15.046 3.821 9.041 1.00 34.42 C ATOM 1611 SD MET A 100 13.770 2.631 9.507 1.00 64.03 S ATOM 1612 CE MET A 100 14.146 1.255 8.417 1.00 1.55 C ATOM 0 H MET A 100 15.693 6.898 8.123 1.00 61.42 H new ATOM 0 HA MET A 100 16.939 4.424 7.042 1.00 52.14 H new ATOM 0 HB2 MET A 100 14.006 5.028 7.604 1.00 52.13 H new ATOM 0 HB3 MET A 100 14.639 3.529 6.955 1.00 52.13 H new ATOM 0 HG2 MET A 100 16.024 3.348 9.124 1.00 34.42 H new ATOM 0 HG3 MET A 100 15.034 4.653 9.745 1.00 34.42 H new ATOM 0 HE1 MET A 100 13.745 0.335 8.841 1.00 1.55 H new ATOM 0 HE2 MET A 100 13.696 1.431 7.440 1.00 1.55 H new ATOM 0 HE3 MET A 100 15.226 1.163 8.307 1.00 1.55 H new ATOM 1622 N PRO A 101 16.164 4.805 4.576 1.00 2.14 N ATOM 1623 CA PRO A 101 16.034 5.212 3.152 1.00 23.53 C ATOM 1624 C PRO A 101 14.610 4.980 2.554 1.00 63.44 C ATOM 1625 O PRO A 101 13.695 4.516 3.248 1.00 21.35 O ATOM 1626 CB PRO A 101 17.110 4.327 2.474 1.00 11.51 C ATOM 1627 CG PRO A 101 17.124 3.050 3.274 1.00 13.31 C ATOM 1628 CD PRO A 101 16.673 3.408 4.689 1.00 4.00 C ATOM 0 HA PRO A 101 16.174 6.283 3.004 1.00 23.53 H new ATOM 0 HB2 PRO A 101 16.863 4.136 1.430 1.00 11.51 H new ATOM 0 HB3 PRO A 101 18.086 4.812 2.487 1.00 11.51 H new ATOM 0 HG2 PRO A 101 16.457 2.310 2.832 1.00 13.31 H new ATOM 0 HG3 PRO A 101 18.122 2.613 3.286 1.00 13.31 H new ATOM 0 HD2 PRO A 101 15.896 2.730 5.042 1.00 4.00 H new ATOM 0 HD3 PRO A 101 17.499 3.342 5.397 1.00 4.00 H new ATOM 1636 N GLY A 102 14.454 5.314 1.253 1.00 55.20 N ATOM 1637 CA GLY A 102 13.173 5.186 0.540 1.00 43.31 C ATOM 1638 C GLY A 102 12.804 3.737 0.186 1.00 21.50 C ATOM 1639 O GLY A 102 13.525 3.071 -0.563 1.00 42.25 O ATOM 0 H GLY A 102 15.211 5.678 0.675 1.00 55.20 H new ATOM 0 HA2 GLY A 102 12.381 5.613 1.155 1.00 43.31 H new ATOM 0 HA3 GLY A 102 13.217 5.774 -0.376 1.00 43.31 H new ATOM 1643 N MET A 103 11.682 3.264 0.742 1.00 21.10 N ATOM 1644 CA MET A 103 11.142 1.907 0.506 1.00 12.03 C ATOM 1645 C MET A 103 10.358 1.852 -0.852 1.00 15.11 C ATOM 1646 O MET A 103 9.208 2.277 -0.940 1.00 44.52 O ATOM 1647 CB MET A 103 10.250 1.543 1.730 1.00 60.33 C ATOM 1648 CG MET A 103 9.516 0.217 1.630 1.00 52.23 C ATOM 1649 SD MET A 103 10.619 -1.191 1.460 1.00 12.24 S ATOM 1650 CE MET A 103 9.419 -2.467 1.124 1.00 34.22 C ATOM 0 H MET A 103 11.110 3.817 1.380 1.00 21.10 H new ATOM 0 HA MET A 103 11.943 1.173 0.416 1.00 12.03 H new ATOM 0 HB2 MET A 103 10.876 1.526 2.622 1.00 60.33 H new ATOM 0 HB3 MET A 103 9.515 2.336 1.871 1.00 60.33 H new ATOM 0 HG2 MET A 103 8.900 0.082 2.519 1.00 52.23 H new ATOM 0 HG3 MET A 103 8.840 0.247 0.775 1.00 52.23 H new ATOM 0 HE1 MET A 103 9.841 -3.188 0.424 1.00 34.22 H new ATOM 0 HE2 MET A 103 9.157 -2.974 2.053 1.00 34.22 H new ATOM 0 HE3 MET A 103 8.525 -2.020 0.690 1.00 34.22 H new ATOM 1660 N HIS A 104 10.995 1.317 -1.908 1.00 35.34 N ATOM 1661 CA HIS A 104 10.488 1.419 -3.309 1.00 72.31 C ATOM 1662 C HIS A 104 9.396 0.353 -3.658 1.00 0.15 C ATOM 1663 O HIS A 104 9.716 -0.793 -3.951 1.00 42.23 O ATOM 1664 CB HIS A 104 11.697 1.317 -4.290 1.00 11.40 C ATOM 1665 CG HIS A 104 11.326 1.266 -5.756 1.00 20.45 C ATOM 1666 ND1 HIS A 104 11.393 0.108 -6.500 1.00 11.14 N ATOM 1667 CD2 HIS A 104 10.887 2.227 -6.605 1.00 34.30 C ATOM 1668 CE1 HIS A 104 11.020 0.358 -7.732 1.00 12.33 C ATOM 1669 NE2 HIS A 104 10.707 1.630 -7.824 1.00 51.34 N ATOM 0 H HIS A 104 11.872 0.802 -1.827 1.00 35.34 H new ATOM 0 HA HIS A 104 9.994 2.385 -3.412 1.00 72.31 H new ATOM 0 HB2 HIS A 104 12.352 2.172 -4.126 1.00 11.40 H new ATOM 0 HB3 HIS A 104 12.271 0.424 -4.044 1.00 11.40 H new ATOM 0 HD2 HIS A 104 10.712 3.266 -6.366 1.00 34.30 H new ATOM 0 HE1 HIS A 104 10.977 -0.362 -8.536 1.00 12.33 H new ATOM 0 HE2 HIS A 104 10.381 2.099 -8.669 1.00 51.34 H new ATOM 1678 N ILE A 105 8.104 0.755 -3.637 1.00 11.11 N ATOM 1679 CA ILE A 105 6.963 -0.108 -4.080 1.00 32.42 C ATOM 1680 C ILE A 105 6.502 0.296 -5.515 1.00 21.41 C ATOM 1681 O ILE A 105 6.289 1.476 -5.799 1.00 5.34 O ATOM 1682 CB ILE A 105 5.715 -0.044 -3.082 1.00 34.12 C ATOM 1683 CG1 ILE A 105 5.972 -0.796 -1.736 1.00 5.21 C ATOM 1684 CG2 ILE A 105 4.438 -0.627 -3.725 1.00 73.23 C ATOM 1685 CD1 ILE A 105 7.048 -0.213 -0.856 1.00 21.14 C ATOM 0 H ILE A 105 7.815 1.679 -3.316 1.00 11.11 H new ATOM 0 HA ILE A 105 7.331 -1.134 -4.080 1.00 32.42 H new ATOM 0 HB ILE A 105 5.576 1.016 -2.870 1.00 34.12 H new ATOM 0 HG12 ILE A 105 5.040 -0.820 -1.171 1.00 5.21 H new ATOM 0 HG13 ILE A 105 6.234 -1.829 -1.963 1.00 5.21 H new ATOM 0 HG21 ILE A 105 3.613 -0.565 -3.016 1.00 73.23 H new ATOM 0 HG22 ILE A 105 4.190 -0.058 -4.621 1.00 73.23 H new ATOM 0 HG23 ILE A 105 4.609 -1.670 -3.993 1.00 73.23 H new ATOM 0 HD11 ILE A 105 7.142 -0.812 0.050 1.00 21.14 H new ATOM 0 HD12 ILE A 105 7.997 -0.214 -1.392 1.00 21.14 H new ATOM 0 HD13 ILE A 105 6.784 0.810 -0.588 1.00 21.14 H new ATOM 1697 N THR A 106 6.357 -0.706 -6.410 1.00 45.21 N ATOM 1698 CA THR A 106 5.696 -0.549 -7.731 1.00 71.52 C ATOM 1699 C THR A 106 4.590 -1.608 -7.890 1.00 11.11 C ATOM 1700 O THR A 106 4.885 -2.797 -7.990 1.00 0.12 O ATOM 1701 CB THR A 106 6.716 -0.708 -8.918 1.00 70.24 C ATOM 1702 OG1 THR A 106 7.454 -1.941 -8.798 1.00 33.11 O ATOM 1703 CG2 THR A 106 7.699 0.454 -8.976 1.00 5.23 C ATOM 0 H THR A 106 6.696 -1.653 -6.238 1.00 45.21 H new ATOM 0 HA THR A 106 5.275 0.456 -7.766 1.00 71.52 H new ATOM 0 HB THR A 106 6.131 -0.718 -9.838 1.00 70.24 H new ATOM 0 HG1 THR A 106 8.081 -2.021 -9.547 1.00 33.11 H new ATOM 0 HG21 THR A 106 8.387 0.307 -9.809 1.00 5.23 H new ATOM 0 HG22 THR A 106 7.152 1.386 -9.117 1.00 5.23 H new ATOM 0 HG23 THR A 106 8.262 0.501 -8.044 1.00 5.23 H new ATOM 1711 N LEU A 107 3.318 -1.179 -7.955 1.00 53.21 N ATOM 1712 CA LEU A 107 2.181 -2.105 -8.122 1.00 71.15 C ATOM 1713 C LEU A 107 1.700 -2.066 -9.587 1.00 61.45 C ATOM 1714 O LEU A 107 1.202 -1.037 -10.052 1.00 73.04 O ATOM 1715 CB LEU A 107 0.994 -1.769 -7.159 1.00 24.44 C ATOM 1716 CG LEU A 107 1.346 -1.359 -5.684 1.00 41.21 C ATOM 1717 CD1 LEU A 107 1.616 0.154 -5.573 1.00 10.13 C ATOM 1718 CD2 LEU A 107 0.238 -1.793 -4.698 1.00 45.22 C ATOM 0 H LEU A 107 3.050 -0.197 -7.895 1.00 53.21 H new ATOM 0 HA LEU A 107 2.527 -3.106 -7.866 1.00 71.15 H new ATOM 0 HB2 LEU A 107 0.419 -0.957 -7.605 1.00 24.44 H new ATOM 0 HB3 LEU A 107 0.338 -2.639 -7.118 1.00 24.44 H new ATOM 0 HG LEU A 107 2.261 -1.885 -5.411 1.00 41.21 H new ATOM 0 HD11 LEU A 107 1.857 0.406 -4.540 1.00 10.13 H new ATOM 0 HD12 LEU A 107 2.454 0.422 -6.217 1.00 10.13 H new ATOM 0 HD13 LEU A 107 0.729 0.706 -5.884 1.00 10.13 H new ATOM 0 HD21 LEU A 107 0.513 -1.494 -3.687 1.00 45.22 H new ATOM 0 HD22 LEU A 107 -0.702 -1.316 -4.974 1.00 45.22 H new ATOM 0 HD23 LEU A 107 0.120 -2.876 -4.737 1.00 45.22 H new ATOM 1730 N ASN A 108 1.865 -3.183 -10.307 1.00 75.03 N ATOM 1731 CA ASN A 108 1.433 -3.314 -11.717 1.00 25.22 C ATOM 1732 C ASN A 108 0.154 -4.183 -11.800 1.00 10.14 C ATOM 1733 O ASN A 108 -0.008 -5.107 -11.009 1.00 10.32 O ATOM 1734 CB ASN A 108 2.577 -3.947 -12.552 1.00 62.11 C ATOM 1735 CG ASN A 108 2.331 -3.859 -14.058 1.00 23.23 C ATOM 1736 OD1 ASN A 108 2.732 -2.903 -14.715 1.00 24.32 O ATOM 1737 ND2 ASN A 108 1.649 -4.838 -14.613 1.00 24.02 N ATOM 0 H ASN A 108 2.302 -4.026 -9.934 1.00 75.03 H new ATOM 0 HA ASN A 108 1.205 -2.327 -12.121 1.00 25.22 H new ATOM 0 HB2 ASN A 108 3.515 -3.447 -12.312 1.00 62.11 H new ATOM 0 HB3 ASN A 108 2.692 -4.993 -12.268 1.00 62.11 H new ATOM 0 HD21 ASN A 108 1.442 -4.813 -15.612 1.00 24.02 H new ATOM 0 HD22 ASN A 108 1.327 -5.621 -14.045 1.00 24.02 H new ATOM 1744 N PHE A 109 -0.725 -3.894 -12.774 1.00 23.33 N ATOM 1745 CA PHE A 109 -2.026 -4.594 -12.938 1.00 65.52 C ATOM 1746 C PHE A 109 -1.870 -6.097 -13.300 1.00 11.43 C ATOM 1747 O PHE A 109 -0.827 -6.533 -13.819 1.00 0.00 O ATOM 1748 CB PHE A 109 -2.890 -3.879 -14.016 1.00 71.02 C ATOM 1749 CG PHE A 109 -2.385 -4.017 -15.468 1.00 11.42 C ATOM 1750 CD1 PHE A 109 -1.182 -3.434 -15.874 1.00 2.10 C ATOM 1751 CD2 PHE A 109 -3.128 -4.716 -16.423 1.00 74.31 C ATOM 1752 CE1 PHE A 109 -0.741 -3.547 -17.179 1.00 54.23 C ATOM 1753 CE2 PHE A 109 -2.682 -4.829 -17.725 1.00 43.40 C ATOM 1754 CZ PHE A 109 -1.491 -4.245 -18.103 1.00 72.12 C ATOM 0 H PHE A 109 -0.561 -3.170 -13.474 1.00 23.33 H new ATOM 0 HA PHE A 109 -2.525 -4.550 -11.970 1.00 65.52 H new ATOM 0 HB2 PHE A 109 -3.905 -4.273 -13.963 1.00 71.02 H new ATOM 0 HB3 PHE A 109 -2.946 -2.819 -13.768 1.00 71.02 H new ATOM 0 HD1 PHE A 109 -0.588 -2.887 -15.157 1.00 2.10 H new ATOM 0 HD2 PHE A 109 -4.064 -5.174 -16.139 1.00 74.31 H new ATOM 0 HE1 PHE A 109 0.191 -3.089 -17.476 1.00 54.23 H new ATOM 0 HE2 PHE A 109 -3.267 -5.376 -18.449 1.00 43.40 H new ATOM 0 HZ PHE A 109 -1.146 -4.334 -19.122 1.00 72.12 H new ATOM 1764 N GLU A 110 -2.936 -6.863 -13.035 1.00 11.22 N ATOM 1765 CA GLU A 110 -3.013 -8.297 -13.362 1.00 34.21 C ATOM 1766 C GLU A 110 -4.502 -8.687 -13.550 1.00 55.11 C ATOM 1767 O GLU A 110 -5.362 -8.301 -12.750 1.00 43.32 O ATOM 1768 CB GLU A 110 -2.308 -9.163 -12.256 1.00 74.04 C ATOM 1769 CG GLU A 110 -1.472 -10.365 -12.768 1.00 2.41 C ATOM 1770 CD GLU A 110 -2.287 -11.469 -13.475 1.00 2.03 C ATOM 1771 OE1 GLU A 110 -2.571 -11.347 -14.687 1.00 61.20 O ATOM 1772 OE2 GLU A 110 -2.634 -12.474 -12.822 1.00 33.03 O ATOM 0 H GLU A 110 -3.777 -6.504 -12.584 1.00 11.22 H new ATOM 0 HA GLU A 110 -2.481 -8.495 -14.293 1.00 34.21 H new ATOM 0 HB2 GLU A 110 -1.655 -8.513 -11.674 1.00 74.04 H new ATOM 0 HB3 GLU A 110 -3.071 -9.540 -11.575 1.00 74.04 H new ATOM 0 HG2 GLU A 110 -0.714 -9.994 -13.459 1.00 2.41 H new ATOM 0 HG3 GLU A 110 -0.944 -10.808 -11.923 1.00 2.41 H new ATOM 1832 N GLY A 114 -10.495 -11.887 -15.126 1.00 63.12 N ATOM 1833 CA GLY A 114 -11.458 -10.769 -15.132 1.00 60.25 C ATOM 1834 C GLY A 114 -11.661 -10.178 -13.733 1.00 12.10 C ATOM 1835 O GLY A 114 -12.065 -9.016 -13.587 1.00 32.33 O ATOM 0 HA2 GLY A 114 -11.104 -9.990 -15.807 1.00 60.25 H new ATOM 0 HA3 GLY A 114 -12.415 -11.117 -15.521 1.00 60.25 H new ATOM 1839 N LYS A 115 -11.415 -11.007 -12.698 1.00 20.24 N ATOM 1840 CA LYS A 115 -11.347 -10.551 -11.293 1.00 51.34 C ATOM 1841 C LYS A 115 -10.054 -9.735 -11.068 1.00 44.44 C ATOM 1842 O LYS A 115 -8.947 -10.241 -11.291 1.00 0.13 O ATOM 1843 CB LYS A 115 -11.394 -11.755 -10.319 1.00 21.12 C ATOM 1844 CG LYS A 115 -12.717 -12.551 -10.327 1.00 31.25 C ATOM 1845 CD LYS A 115 -12.685 -13.754 -9.353 1.00 21.45 C ATOM 1846 CE LYS A 115 -12.498 -13.328 -7.880 1.00 61.02 C ATOM 1847 NZ LYS A 115 -12.389 -14.493 -6.967 1.00 41.41 N ATOM 0 H LYS A 115 -11.258 -12.009 -12.811 1.00 20.24 H new ATOM 0 HA LYS A 115 -12.211 -9.917 -11.093 1.00 51.34 H new ATOM 0 HB2 LYS A 115 -10.578 -12.434 -10.565 1.00 21.12 H new ATOM 0 HB3 LYS A 115 -11.212 -11.392 -9.307 1.00 21.12 H new ATOM 0 HG2 LYS A 115 -13.539 -11.888 -10.055 1.00 31.25 H new ATOM 0 HG3 LYS A 115 -12.917 -12.909 -11.337 1.00 31.25 H new ATOM 0 HD2 LYS A 115 -13.613 -14.317 -9.448 1.00 21.45 H new ATOM 0 HD3 LYS A 115 -11.874 -14.425 -9.638 1.00 21.45 H new ATOM 0 HE2 LYS A 115 -11.601 -12.715 -7.792 1.00 61.02 H new ATOM 0 HE3 LYS A 115 -13.340 -12.707 -7.574 1.00 61.02 H new ATOM 0 HZ1 LYS A 115 -12.265 -14.158 -5.990 1.00 41.41 H new ATOM 0 HZ2 LYS A 115 -13.255 -15.065 -7.029 1.00 41.41 H new ATOM 0 HZ3 LYS A 115 -11.570 -15.073 -7.241 1.00 41.41 H new ATOM 1861 N THR A 116 -10.211 -8.483 -10.605 1.00 31.52 N ATOM 1862 CA THR A 116 -9.104 -7.504 -10.521 1.00 33.34 C ATOM 1863 C THR A 116 -7.989 -7.935 -9.541 1.00 41.45 C ATOM 1864 O THR A 116 -8.257 -8.366 -8.421 1.00 61.03 O ATOM 1865 CB THR A 116 -9.630 -6.087 -10.122 1.00 10.21 C ATOM 1866 OG1 THR A 116 -10.508 -5.595 -11.149 1.00 41.41 O ATOM 1867 CG2 THR A 116 -8.488 -5.076 -9.906 1.00 13.45 C ATOM 0 H THR A 116 -11.106 -8.118 -10.278 1.00 31.52 H new ATOM 0 HA THR A 116 -8.669 -7.463 -11.519 1.00 33.34 H new ATOM 0 HB THR A 116 -10.163 -6.192 -9.177 1.00 10.21 H new ATOM 0 HG1 THR A 116 -11.416 -5.511 -10.790 1.00 41.41 H new ATOM 0 HG21 THR A 116 -8.906 -4.108 -9.631 1.00 13.45 H new ATOM 0 HG22 THR A 116 -7.835 -5.429 -9.108 1.00 13.45 H new ATOM 0 HG23 THR A 116 -7.913 -4.974 -10.826 1.00 13.45 H new ATOM 1875 N THR A 117 -6.737 -7.793 -10.001 1.00 61.24 N ATOM 1876 CA THR A 117 -5.525 -8.061 -9.208 1.00 11.11 C ATOM 1877 C THR A 117 -4.478 -6.974 -9.488 1.00 1.15 C ATOM 1878 O THR A 117 -4.374 -6.483 -10.613 1.00 64.43 O ATOM 1879 CB THR A 117 -4.953 -9.478 -9.556 1.00 21.42 C ATOM 1880 OG1 THR A 117 -5.940 -10.464 -9.250 1.00 61.41 O ATOM 1881 CG2 THR A 117 -3.643 -9.821 -8.810 1.00 55.53 C ATOM 0 H THR A 117 -6.533 -7.483 -10.951 1.00 61.24 H new ATOM 0 HA THR A 117 -5.777 -8.045 -8.148 1.00 11.11 H new ATOM 0 HB THR A 117 -4.712 -9.469 -10.619 1.00 21.42 H new ATOM 0 HG1 THR A 117 -6.712 -10.034 -8.827 1.00 61.41 H new ATOM 0 HG21 THR A 117 -3.308 -10.816 -9.102 1.00 55.53 H new ATOM 0 HG22 THR A 117 -2.876 -9.090 -9.067 1.00 55.53 H new ATOM 0 HG23 THR A 117 -3.820 -9.799 -7.735 1.00 55.53 H new ATOM 1889 N VAL A 118 -3.728 -6.563 -8.455 1.00 21.31 N ATOM 1890 CA VAL A 118 -2.610 -5.615 -8.626 1.00 44.02 C ATOM 1891 C VAL A 118 -1.367 -6.122 -7.840 1.00 23.23 C ATOM 1892 O VAL A 118 -1.358 -6.225 -6.606 1.00 54.04 O ATOM 1893 CB VAL A 118 -3.026 -4.139 -8.243 1.00 31.11 C ATOM 1894 CG1 VAL A 118 -3.335 -3.983 -6.742 1.00 15.01 C ATOM 1895 CG2 VAL A 118 -1.968 -3.114 -8.722 1.00 31.31 C ATOM 0 H VAL A 118 -3.873 -6.870 -7.493 1.00 21.31 H new ATOM 0 HA VAL A 118 -2.339 -5.573 -9.681 1.00 44.02 H new ATOM 0 HB VAL A 118 -3.956 -3.926 -8.770 1.00 31.11 H new ATOM 0 HG11 VAL A 118 -3.615 -2.950 -6.534 1.00 15.01 H new ATOM 0 HG12 VAL A 118 -4.157 -4.644 -6.469 1.00 15.01 H new ATOM 0 HG13 VAL A 118 -2.451 -4.244 -6.160 1.00 15.01 H new ATOM 0 HG21 VAL A 118 -2.283 -2.108 -8.443 1.00 31.31 H new ATOM 0 HG22 VAL A 118 -1.009 -3.336 -8.255 1.00 31.31 H new ATOM 0 HG23 VAL A 118 -1.866 -3.175 -9.806 1.00 31.31 H new ATOM 1905 N THR A 119 -0.351 -6.505 -8.601 1.00 53.03 N ATOM 1906 CA THR A 119 0.881 -7.131 -8.105 1.00 34.04 C ATOM 1907 C THR A 119 1.887 -6.082 -7.556 1.00 25.44 C ATOM 1908 O THR A 119 2.531 -5.364 -8.330 1.00 22.42 O ATOM 1909 CB THR A 119 1.531 -7.937 -9.271 1.00 63.23 C ATOM 1910 OG1 THR A 119 0.578 -8.889 -9.794 1.00 74.33 O ATOM 1911 CG2 THR A 119 2.801 -8.682 -8.839 1.00 13.41 C ATOM 0 H THR A 119 -0.355 -6.388 -9.614 1.00 53.03 H new ATOM 0 HA THR A 119 0.626 -7.792 -7.277 1.00 34.04 H new ATOM 0 HB THR A 119 1.817 -7.216 -10.037 1.00 63.23 H new ATOM 0 HG1 THR A 119 0.988 -9.393 -10.528 1.00 74.33 H new ATOM 0 HG21 THR A 119 3.211 -9.226 -9.690 1.00 13.41 H new ATOM 0 HG22 THR A 119 3.538 -7.965 -8.477 1.00 13.41 H new ATOM 0 HG23 THR A 119 2.557 -9.385 -8.042 1.00 13.41 H new ATOM 1919 N SER A 120 2.008 -5.995 -6.214 1.00 41.34 N ATOM 1920 CA SER A 120 2.929 -5.049 -5.545 1.00 35.44 C ATOM 1921 C SER A 120 4.370 -5.609 -5.470 1.00 62.10 C ATOM 1922 O SER A 120 4.665 -6.503 -4.683 1.00 73.41 O ATOM 1923 CB SER A 120 2.414 -4.722 -4.116 1.00 43.13 C ATOM 1924 OG SER A 120 2.490 -5.829 -3.233 1.00 74.43 O ATOM 0 H SER A 120 1.474 -6.574 -5.567 1.00 41.34 H new ATOM 0 HA SER A 120 2.955 -4.137 -6.141 1.00 35.44 H new ATOM 0 HB2 SER A 120 2.996 -3.897 -3.706 1.00 43.13 H new ATOM 0 HB3 SER A 120 1.380 -4.383 -4.177 1.00 43.13 H new ATOM 0 HG SER A 120 3.319 -6.325 -3.400 1.00 74.43 H new ATOM 1930 N THR A 121 5.263 -5.052 -6.280 1.00 13.20 N ATOM 1931 CA THR A 121 6.700 -5.377 -6.252 1.00 74.33 C ATOM 1932 C THR A 121 7.439 -4.382 -5.331 1.00 73.04 C ATOM 1933 O THR A 121 7.728 -3.245 -5.720 1.00 65.31 O ATOM 1934 CB THR A 121 7.305 -5.358 -7.693 1.00 12.34 C ATOM 1935 OG1 THR A 121 6.569 -6.267 -8.536 1.00 20.23 O ATOM 1936 CG2 THR A 121 8.794 -5.741 -7.706 1.00 72.25 C ATOM 0 H THR A 121 5.017 -4.356 -6.983 1.00 13.20 H new ATOM 0 HA THR A 121 6.826 -6.385 -5.856 1.00 74.33 H new ATOM 0 HB THR A 121 7.224 -4.338 -8.069 1.00 12.34 H new ATOM 0 HG1 THR A 121 6.947 -6.254 -9.440 1.00 20.23 H new ATOM 0 HG21 THR A 121 9.168 -5.713 -8.729 1.00 72.25 H new ATOM 0 HG22 THR A 121 9.357 -5.035 -7.095 1.00 72.25 H new ATOM 0 HG23 THR A 121 8.915 -6.747 -7.303 1.00 72.25 H new ATOM 1944 N SER A 122 7.712 -4.821 -4.101 1.00 1.24 N ATOM 1945 CA SER A 122 8.353 -3.998 -3.056 1.00 60.20 C ATOM 1946 C SER A 122 9.871 -4.135 -3.160 1.00 43.33 C ATOM 1947 O SER A 122 10.361 -5.163 -3.605 1.00 34.24 O ATOM 1948 CB SER A 122 7.892 -4.444 -1.649 1.00 51.12 C ATOM 1949 OG SER A 122 8.471 -5.676 -1.260 1.00 51.22 O ATOM 0 H SER A 122 7.494 -5.768 -3.792 1.00 1.24 H new ATOM 0 HA SER A 122 8.062 -2.958 -3.205 1.00 60.20 H new ATOM 0 HB2 SER A 122 8.155 -3.676 -0.922 1.00 51.12 H new ATOM 0 HB3 SER A 122 6.806 -4.535 -1.637 1.00 51.12 H new ATOM 0 HG SER A 122 8.997 -5.547 -0.443 1.00 51.22 H new ATOM 1955 N THR A 123 10.607 -3.086 -2.809 1.00 52.45 N ATOM 1956 CA THR A 123 12.075 -3.146 -2.709 1.00 71.13 C ATOM 1957 C THR A 123 12.512 -2.670 -1.313 1.00 71.31 C ATOM 1958 O THR A 123 12.497 -1.465 -1.022 1.00 41.42 O ATOM 1959 CB THR A 123 12.796 -2.313 -3.828 1.00 3.43 C ATOM 1960 OG1 THR A 123 12.255 -2.648 -5.127 1.00 14.40 O ATOM 1961 CG2 THR A 123 14.316 -2.570 -3.837 1.00 23.32 C ATOM 0 H THR A 123 10.213 -2.172 -2.585 1.00 52.45 H new ATOM 0 HA THR A 123 12.374 -4.184 -2.859 1.00 71.13 H new ATOM 0 HB THR A 123 12.623 -1.259 -3.611 1.00 3.43 H new ATOM 0 HG1 THR A 123 11.974 -1.829 -5.586 1.00 14.40 H new ATOM 0 HG21 THR A 123 14.781 -1.977 -4.624 1.00 23.32 H new ATOM 0 HG22 THR A 123 14.738 -2.288 -2.873 1.00 23.32 H new ATOM 0 HG23 THR A 123 14.505 -3.628 -4.020 1.00 23.32 H new ATOM 1969 N PHE A 124 12.836 -3.644 -0.452 1.00 63.43 N ATOM 1970 CA PHE A 124 13.401 -3.413 0.890 1.00 13.22 C ATOM 1971 C PHE A 124 14.850 -2.856 0.798 1.00 5.05 C ATOM 1972 O PHE A 124 15.523 -3.049 -0.224 1.00 44.11 O ATOM 1973 CB PHE A 124 13.354 -4.741 1.710 1.00 62.03 C ATOM 1974 CG PHE A 124 11.959 -5.094 2.248 1.00 5.44 C ATOM 1975 CD1 PHE A 124 10.971 -5.610 1.408 1.00 52.33 C ATOM 1976 CD2 PHE A 124 11.645 -4.924 3.601 1.00 40.14 C ATOM 1977 CE1 PHE A 124 9.720 -5.939 1.902 1.00 21.22 C ATOM 1978 CE2 PHE A 124 10.393 -5.252 4.089 1.00 5.45 C ATOM 1979 CZ PHE A 124 9.432 -5.762 3.242 1.00 15.23 C ATOM 0 H PHE A 124 12.712 -4.633 -0.670 1.00 63.43 H new ATOM 0 HA PHE A 124 12.801 -2.662 1.404 1.00 13.22 H new ATOM 0 HB2 PHE A 124 13.707 -5.558 1.080 1.00 62.03 H new ATOM 0 HB3 PHE A 124 14.046 -4.663 2.548 1.00 62.03 H new ATOM 0 HD1 PHE A 124 11.185 -5.755 0.359 1.00 52.33 H new ATOM 0 HD2 PHE A 124 12.392 -4.531 4.275 1.00 40.14 H new ATOM 0 HE1 PHE A 124 8.966 -6.335 1.238 1.00 21.22 H new ATOM 0 HE2 PHE A 124 10.168 -5.108 5.135 1.00 5.45 H new ATOM 0 HZ PHE A 124 8.456 -6.023 3.625 1.00 15.23 H new ATOM 1989 N PRO A 125 15.355 -2.163 1.875 1.00 12.01 N ATOM 1990 CA PRO A 125 16.673 -1.478 1.843 1.00 61.45 C ATOM 1991 C PRO A 125 17.868 -2.460 1.625 1.00 55.43 C ATOM 1992 O PRO A 125 18.492 -2.463 0.556 1.00 13.21 O ATOM 1993 CB PRO A 125 16.732 -0.758 3.229 1.00 11.13 C ATOM 1994 CG PRO A 125 15.790 -1.531 4.109 1.00 4.22 C ATOM 1995 CD PRO A 125 14.682 -2.001 3.196 1.00 54.41 C ATOM 0 HA PRO A 125 16.765 -0.790 1.002 1.00 61.45 H new ATOM 0 HB2 PRO A 125 17.744 -0.763 3.634 1.00 11.13 H new ATOM 0 HB3 PRO A 125 16.427 0.285 3.145 1.00 11.13 H new ATOM 0 HG2 PRO A 125 16.295 -2.374 4.580 1.00 4.22 H new ATOM 0 HG3 PRO A 125 15.399 -0.905 4.911 1.00 4.22 H new ATOM 0 HD2 PRO A 125 14.249 -2.940 3.542 1.00 54.41 H new ATOM 0 HD3 PRO A 125 13.870 -1.275 3.145 1.00 54.41 H new ATOM 2003 N THR A 126 18.118 -3.332 2.625 1.00 62.02 N ATOM 2004 CA THR A 126 19.326 -4.200 2.686 1.00 71.31 C ATOM 2005 C THR A 126 19.255 -5.124 3.932 1.00 25.40 C ATOM 2006 O THR A 126 18.203 -5.194 4.579 1.00 60.45 O ATOM 2007 CB THR A 126 20.656 -3.337 2.692 1.00 5.11 C ATOM 2008 OG1 THR A 126 21.821 -4.177 2.571 1.00 73.05 O ATOM 2009 CG2 THR A 126 20.774 -2.456 3.956 1.00 11.53 C ATOM 0 H THR A 126 17.489 -3.458 3.418 1.00 62.02 H new ATOM 0 HA THR A 126 19.347 -4.822 1.791 1.00 71.31 H new ATOM 0 HB THR A 126 20.602 -2.677 1.826 1.00 5.11 H new ATOM 0 HG1 THR A 126 21.598 -4.971 2.042 1.00 73.05 H new ATOM 0 HG21 THR A 126 21.701 -1.883 3.915 1.00 11.53 H new ATOM 0 HG22 THR A 126 19.927 -1.772 4.003 1.00 11.53 H new ATOM 0 HG23 THR A 126 20.778 -3.090 4.842 1.00 11.53 H new ATOM 2017 N GLU A 127 20.364 -5.859 4.231 1.00 75.51 N ATOM 2018 CA GLU A 127 20.435 -6.866 5.337 1.00 73.51 C ATOM 2019 C GLU A 127 19.457 -8.056 5.054 1.00 63.50 C ATOM 2020 O GLU A 127 19.094 -8.822 5.957 1.00 30.34 O ATOM 2021 CB GLU A 127 20.160 -6.183 6.729 1.00 3.12 C ATOM 2022 CG GLU A 127 20.463 -7.048 7.975 1.00 2.25 C ATOM 2023 CD GLU A 127 20.138 -6.337 9.304 1.00 21.10 C ATOM 2024 OE1 GLU A 127 18.939 -6.253 9.667 1.00 51.34 O ATOM 2025 OE2 GLU A 127 21.070 -5.841 9.982 1.00 43.51 O ATOM 0 H GLU A 127 21.238 -5.771 3.712 1.00 75.51 H new ATOM 0 HA GLU A 127 21.443 -7.278 5.379 1.00 73.51 H new ATOM 0 HB2 GLU A 127 20.755 -5.272 6.789 1.00 3.12 H new ATOM 0 HB3 GLU A 127 19.113 -5.883 6.764 1.00 3.12 H new ATOM 0 HG2 GLU A 127 19.889 -7.972 7.915 1.00 2.25 H new ATOM 0 HG3 GLU A 127 21.517 -7.326 7.968 1.00 2.25 H new ATOM 2032 N SER A 128 19.072 -8.210 3.757 1.00 51.02 N ATOM 2033 CA SER A 128 18.028 -9.165 3.304 1.00 54.24 C ATOM 2034 C SER A 128 16.707 -8.970 4.082 1.00 13.21 C ATOM 2035 O SER A 128 16.001 -9.926 4.354 1.00 54.43 O ATOM 2036 CB SER A 128 18.545 -10.628 3.388 1.00 14.44 C ATOM 2037 OG SER A 128 19.656 -10.828 2.521 1.00 24.44 O ATOM 0 H SER A 128 19.481 -7.671 2.994 1.00 51.02 H new ATOM 0 HA SER A 128 17.809 -8.956 2.257 1.00 54.24 H new ATOM 0 HB2 SER A 128 18.834 -10.857 4.414 1.00 14.44 H new ATOM 0 HB3 SER A 128 17.743 -11.317 3.122 1.00 14.44 H new ATOM 0 HG SER A 128 19.964 -11.755 2.593 1.00 24.44 H new ATOM 2043 N ALA A 129 16.368 -7.691 4.381 1.00 4.11 N ATOM 2044 CA ALA A 129 15.147 -7.308 5.142 1.00 53.23 C ATOM 2045 C ALA A 129 13.850 -7.897 4.530 1.00 1.14 C ATOM 2046 O ALA A 129 12.885 -8.183 5.247 1.00 65.42 O ATOM 2047 CB ALA A 129 15.049 -5.772 5.237 1.00 41.02 C ATOM 0 H ALA A 129 16.935 -6.891 4.101 1.00 4.11 H new ATOM 0 HA ALA A 129 15.242 -7.733 6.141 1.00 53.23 H new ATOM 0 HB1 ALA A 129 14.153 -5.498 5.795 1.00 41.02 H new ATOM 0 HB2 ALA A 129 15.929 -5.382 5.749 1.00 41.02 H new ATOM 0 HB3 ALA A 129 14.995 -5.348 4.234 1.00 41.02 H new ATOM 2053 N ALA A 130 13.851 -8.072 3.198 1.00 70.13 N ATOM 2054 CA ALA A 130 12.728 -8.705 2.460 1.00 71.14 C ATOM 2055 C ALA A 130 12.640 -10.224 2.701 1.00 20.12 C ATOM 2056 O ALA A 130 11.551 -10.766 2.904 1.00 54.42 O ATOM 2057 CB ALA A 130 12.867 -8.412 0.974 1.00 32.24 C ATOM 0 H ALA A 130 14.623 -7.782 2.598 1.00 70.13 H new ATOM 0 HA ALA A 130 11.801 -8.274 2.840 1.00 71.14 H new ATOM 0 HB1 ALA A 130 12.043 -8.877 0.433 1.00 32.24 H new ATOM 0 HB2 ALA A 130 12.846 -7.334 0.812 1.00 32.24 H new ATOM 0 HB3 ALA A 130 13.812 -8.815 0.611 1.00 32.24 H new ATOM 2063 N GLN A 131 13.799 -10.907 2.644 1.00 24.43 N ATOM 2064 CA GLN A 131 13.896 -12.345 2.980 1.00 22.00 C ATOM 2065 C GLN A 131 13.456 -12.600 4.439 1.00 43.35 C ATOM 2066 O GLN A 131 12.631 -13.471 4.705 1.00 74.44 O ATOM 2067 CB GLN A 131 15.341 -12.870 2.778 1.00 72.24 C ATOM 2068 CG GLN A 131 15.538 -14.353 3.169 1.00 4.13 C ATOM 2069 CD GLN A 131 14.763 -15.323 2.270 1.00 71.12 C ATOM 2070 OE1 GLN A 131 15.252 -15.759 1.233 1.00 22.10 O ATOM 2071 NE2 GLN A 131 13.547 -15.665 2.660 1.00 74.23 N ATOM 0 H GLN A 131 14.686 -10.486 2.368 1.00 24.43 H new ATOM 0 HA GLN A 131 13.228 -12.882 2.306 1.00 22.00 H new ATOM 0 HB2 GLN A 131 15.619 -12.742 1.732 1.00 72.24 H new ATOM 0 HB3 GLN A 131 16.024 -12.257 3.367 1.00 72.24 H new ATOM 0 HG2 GLN A 131 16.600 -14.596 3.124 1.00 4.13 H new ATOM 0 HG3 GLN A 131 15.222 -14.495 4.203 1.00 4.13 H new ATOM 0 HE21 GLN A 131 13.164 -15.288 3.527 1.00 74.23 H new ATOM 0 HE22 GLN A 131 12.991 -16.306 2.094 1.00 74.23 H new ATOM 2080 N GLN A 132 14.025 -11.817 5.365 1.00 12.35 N ATOM 2081 CA GLN A 132 13.689 -11.869 6.805 1.00 63.43 C ATOM 2082 C GLN A 132 12.183 -11.545 7.058 1.00 74.20 C ATOM 2083 O GLN A 132 11.602 -12.006 8.047 1.00 1.25 O ATOM 2084 CB GLN A 132 14.610 -10.899 7.625 1.00 64.33 C ATOM 2085 CG GLN A 132 15.986 -11.469 8.098 1.00 23.43 C ATOM 2086 CD GLN A 132 17.023 -11.790 7.002 1.00 72.44 C ATOM 2087 OE1 GLN A 132 16.707 -12.201 5.896 1.00 73.10 O ATOM 2088 NE2 GLN A 132 18.290 -11.603 7.310 1.00 72.23 N ATOM 0 H GLN A 132 14.737 -11.123 5.140 1.00 12.35 H new ATOM 0 HA GLN A 132 13.867 -12.889 7.147 1.00 63.43 H new ATOM 0 HB2 GLN A 132 14.799 -10.014 7.017 1.00 64.33 H new ATOM 0 HB3 GLN A 132 14.058 -10.569 8.505 1.00 64.33 H new ATOM 0 HG2 GLN A 132 16.432 -10.751 8.787 1.00 23.43 H new ATOM 0 HG3 GLN A 132 15.799 -12.381 8.665 1.00 23.43 H new ATOM 0 HE21 GLN A 132 18.544 -11.259 8.236 1.00 72.23 H new ATOM 0 HE22 GLN A 132 19.017 -11.802 6.622 1.00 72.23 H new ATOM 2097 N ALA A 133 11.571 -10.738 6.164 1.00 23.32 N ATOM 2098 CA ALA A 133 10.111 -10.469 6.179 1.00 61.24 C ATOM 2099 C ALA A 133 9.299 -11.736 5.793 1.00 72.44 C ATOM 2100 O ALA A 133 8.223 -11.986 6.344 1.00 32.12 O ATOM 2101 CB ALA A 133 9.763 -9.288 5.256 1.00 71.30 C ATOM 0 H ALA A 133 12.069 -10.256 5.415 1.00 23.32 H new ATOM 0 HA ALA A 133 9.833 -10.197 7.197 1.00 61.24 H new ATOM 0 HB1 ALA A 133 8.688 -9.109 5.283 1.00 71.30 H new ATOM 0 HB2 ALA A 133 10.288 -8.395 5.595 1.00 71.30 H new ATOM 0 HB3 ALA A 133 10.066 -9.522 4.236 1.00 71.30 H new ATOM 2107 N ILE A 134 9.830 -12.537 4.849 1.00 73.23 N ATOM 2108 CA ILE A 134 9.245 -13.855 4.485 1.00 1.12 C ATOM 2109 C ILE A 134 9.316 -14.830 5.696 1.00 4.22 C ATOM 2110 O ILE A 134 8.360 -15.563 5.979 1.00 43.51 O ATOM 2111 CB ILE A 134 9.968 -14.486 3.232 1.00 54.32 C ATOM 2112 CG1 ILE A 134 9.937 -13.511 2.012 1.00 71.14 C ATOM 2113 CG2 ILE A 134 9.367 -15.865 2.854 1.00 22.24 C ATOM 2114 CD1 ILE A 134 8.544 -13.151 1.513 1.00 21.11 C ATOM 0 H ILE A 134 10.668 -12.298 4.319 1.00 73.23 H new ATOM 0 HA ILE A 134 8.201 -13.692 4.218 1.00 1.12 H new ATOM 0 HB ILE A 134 11.009 -14.648 3.510 1.00 54.32 H new ATOM 0 HG12 ILE A 134 10.457 -12.593 2.286 1.00 71.14 H new ATOM 0 HG13 ILE A 134 10.496 -13.961 1.192 1.00 71.14 H new ATOM 0 HG21 ILE A 134 9.892 -16.265 1.987 1.00 22.24 H new ATOM 0 HG22 ILE A 134 9.476 -16.552 3.693 1.00 22.24 H new ATOM 0 HG23 ILE A 134 8.310 -15.748 2.616 1.00 22.24 H new ATOM 0 HD11 ILE A 134 8.626 -12.471 0.665 1.00 21.11 H new ATOM 0 HD12 ILE A 134 8.023 -14.057 1.202 1.00 21.11 H new ATOM 0 HD13 ILE A 134 7.984 -12.667 2.314 1.00 21.11 H new ATOM 2126 N ASP A 135 10.454 -14.796 6.422 1.00 4.12 N ATOM 2127 CA ASP A 135 10.633 -15.531 7.701 1.00 53.43 C ATOM 2128 C ASP A 135 9.689 -15.000 8.812 1.00 53.41 C ATOM 2129 O ASP A 135 9.301 -15.744 9.720 1.00 13.42 O ATOM 2130 CB ASP A 135 12.108 -15.441 8.164 1.00 45.02 C ATOM 2131 CG ASP A 135 13.057 -16.243 7.263 1.00 62.25 C ATOM 2132 OD1 ASP A 135 13.444 -15.743 6.189 1.00 64.54 O ATOM 2133 OD2 ASP A 135 13.397 -17.395 7.614 1.00 11.34 O ATOM 0 H ASP A 135 11.276 -14.260 6.142 1.00 4.12 H new ATOM 0 HA ASP A 135 10.372 -16.574 7.521 1.00 53.43 H new ATOM 0 HB2 ASP A 135 12.419 -14.396 8.175 1.00 45.02 H new ATOM 0 HB3 ASP A 135 12.187 -15.808 9.187 1.00 45.02 H new ATOM 2138 N MET A 136 9.332 -13.704 8.725 1.00 21.15 N ATOM 2139 CA MET A 136 8.362 -13.048 9.640 1.00 15.42 C ATOM 2140 C MET A 136 6.893 -13.426 9.276 1.00 53.22 C ATOM 2141 O MET A 136 5.970 -13.225 10.075 1.00 13.23 O ATOM 2142 CB MET A 136 8.567 -11.502 9.584 1.00 14.13 C ATOM 2143 CG MET A 136 7.854 -10.698 10.680 1.00 54.22 C ATOM 2144 SD MET A 136 8.413 -11.141 12.344 1.00 23.43 S ATOM 2145 CE MET A 136 10.158 -10.710 12.284 1.00 2.33 C ATOM 0 H MET A 136 9.707 -13.074 8.016 1.00 21.15 H new ATOM 0 HA MET A 136 8.543 -13.400 10.656 1.00 15.42 H new ATOM 0 HB2 MET A 136 9.635 -11.293 9.642 1.00 14.13 H new ATOM 0 HB3 MET A 136 8.224 -11.143 8.614 1.00 14.13 H new ATOM 0 HG2 MET A 136 8.025 -9.634 10.515 1.00 54.22 H new ATOM 0 HG3 MET A 136 6.779 -10.863 10.606 1.00 54.22 H new ATOM 0 HE1 MET A 136 10.555 -10.660 13.298 1.00 2.33 H new ATOM 0 HE2 MET A 136 10.701 -11.468 11.719 1.00 2.33 H new ATOM 0 HE3 MET A 136 10.277 -9.741 11.799 1.00 2.33 H new ATOM 2155 N GLY A 137 6.698 -13.996 8.070 1.00 44.10 N ATOM 2156 CA GLY A 137 5.358 -14.353 7.575 1.00 51.34 C ATOM 2157 C GLY A 137 4.552 -13.132 7.137 1.00 23.24 C ATOM 2158 O GLY A 137 3.347 -13.033 7.409 1.00 34.40 O ATOM 0 H GLY A 137 7.454 -14.218 7.422 1.00 44.10 H new ATOM 0 HA2 GLY A 137 5.456 -15.040 6.735 1.00 51.34 H new ATOM 0 HA3 GLY A 137 4.814 -14.882 8.358 1.00 51.34 H new ATOM 2162 N VAL A 138 5.243 -12.211 6.436 1.00 0.12 N ATOM 2163 CA VAL A 138 4.687 -10.914 5.975 1.00 75.01 C ATOM 2164 C VAL A 138 3.450 -11.100 5.054 1.00 72.43 C ATOM 2165 O VAL A 138 2.610 -10.207 4.947 1.00 54.41 O ATOM 2166 CB VAL A 138 5.802 -10.074 5.238 1.00 42.03 C ATOM 2167 CG1 VAL A 138 6.176 -10.695 3.862 1.00 22.41 C ATOM 2168 CG2 VAL A 138 5.410 -8.583 5.103 1.00 61.13 C ATOM 0 H VAL A 138 6.218 -12.345 6.168 1.00 0.12 H new ATOM 0 HA VAL A 138 4.352 -10.370 6.858 1.00 75.01 H new ATOM 0 HB VAL A 138 6.693 -10.114 5.864 1.00 42.03 H new ATOM 0 HG11 VAL A 138 6.946 -10.088 3.386 1.00 22.41 H new ATOM 0 HG12 VAL A 138 6.552 -11.707 4.010 1.00 22.41 H new ATOM 0 HG13 VAL A 138 5.293 -10.725 3.224 1.00 22.41 H new ATOM 0 HG21 VAL A 138 6.206 -8.043 4.590 1.00 61.13 H new ATOM 0 HG22 VAL A 138 4.487 -8.500 4.529 1.00 61.13 H new ATOM 0 HG23 VAL A 138 5.261 -8.155 6.094 1.00 61.13 H new ATOM 2178 N GLU A 139 3.360 -12.286 4.410 1.00 13.21 N ATOM 2179 CA GLU A 139 2.201 -12.682 3.580 1.00 62.05 C ATOM 2180 C GLU A 139 0.889 -12.607 4.386 1.00 32.41 C ATOM 2181 O GLU A 139 -0.041 -11.905 3.998 1.00 42.10 O ATOM 2182 CB GLU A 139 2.399 -14.123 3.040 1.00 32.24 C ATOM 2183 CG GLU A 139 3.665 -14.306 2.195 1.00 21.21 C ATOM 2184 CD GLU A 139 3.861 -15.752 1.723 1.00 75.40 C ATOM 2185 OE1 GLU A 139 4.463 -16.550 2.464 1.00 44.54 O ATOM 2186 OE2 GLU A 139 3.398 -16.112 0.618 1.00 52.11 O ATOM 0 H GLU A 139 4.091 -12.996 4.452 1.00 13.21 H new ATOM 0 HA GLU A 139 2.133 -11.986 2.744 1.00 62.05 H new ATOM 0 HB2 GLU A 139 2.434 -14.814 3.883 1.00 32.24 H new ATOM 0 HB3 GLU A 139 1.532 -14.397 2.440 1.00 32.24 H new ATOM 0 HG2 GLU A 139 3.615 -13.649 1.327 1.00 21.21 H new ATOM 0 HG3 GLU A 139 4.533 -13.998 2.778 1.00 21.21 H new ATOM 2193 N THR A 140 0.877 -13.281 5.546 1.00 2.44 N ATOM 2194 CA THR A 140 -0.308 -13.375 6.428 1.00 73.13 C ATOM 2195 C THR A 140 -0.725 -11.987 6.974 1.00 5.41 C ATOM 2196 O THR A 140 -1.913 -11.638 6.974 1.00 31.21 O ATOM 2197 CB THR A 140 -0.027 -14.350 7.624 1.00 24.54 C ATOM 2198 OG1 THR A 140 0.424 -15.620 7.118 1.00 13.23 O ATOM 2199 CG2 THR A 140 -1.269 -14.572 8.517 1.00 11.22 C ATOM 0 H THR A 140 1.691 -13.780 5.905 1.00 2.44 H new ATOM 0 HA THR A 140 -1.129 -13.766 5.828 1.00 73.13 H new ATOM 0 HB THR A 140 0.742 -13.885 8.241 1.00 24.54 H new ATOM 0 HG1 THR A 140 0.600 -16.227 7.867 1.00 13.23 H new ATOM 0 HG21 THR A 140 -1.017 -15.255 9.328 1.00 11.22 H new ATOM 0 HG22 THR A 140 -1.593 -13.618 8.933 1.00 11.22 H new ATOM 0 HG23 THR A 140 -2.075 -15.000 7.920 1.00 11.22 H new ATOM 2207 N GLY A 141 0.280 -11.198 7.413 1.00 22.32 N ATOM 2208 CA GLY A 141 0.046 -9.844 7.948 1.00 22.23 C ATOM 2209 C GLY A 141 -0.535 -8.863 6.913 1.00 33.53 C ATOM 2210 O GLY A 141 -1.513 -8.153 7.196 1.00 34.32 O ATOM 0 H GLY A 141 1.261 -11.478 7.406 1.00 22.32 H new ATOM 0 HA2 GLY A 141 -0.636 -9.910 8.796 1.00 22.23 H new ATOM 0 HA3 GLY A 141 0.987 -9.444 8.326 1.00 22.23 H new ATOM 2214 N MET A 142 0.060 -8.845 5.703 1.00 34.12 N ATOM 2215 CA MET A 142 -0.411 -7.988 4.590 1.00 3.12 C ATOM 2216 C MET A 142 -1.778 -8.461 4.038 1.00 12.22 C ATOM 2217 O MET A 142 -2.573 -7.635 3.611 1.00 34.23 O ATOM 2218 CB MET A 142 0.640 -7.904 3.448 1.00 25.10 C ATOM 2219 CG MET A 142 1.928 -7.148 3.827 1.00 61.21 C ATOM 2220 SD MET A 142 3.035 -6.873 2.419 1.00 3.52 S ATOM 2221 CE MET A 142 3.463 -8.545 1.933 1.00 35.11 C ATOM 0 H MET A 142 0.872 -9.416 5.469 1.00 34.12 H new ATOM 0 HA MET A 142 -0.545 -6.987 5.000 1.00 3.12 H new ATOM 0 HB2 MET A 142 0.904 -8.915 3.138 1.00 25.10 H new ATOM 0 HB3 MET A 142 0.185 -7.415 2.587 1.00 25.10 H new ATOM 0 HG2 MET A 142 1.661 -6.186 4.265 1.00 61.21 H new ATOM 0 HG3 MET A 142 2.460 -7.711 4.594 1.00 61.21 H new ATOM 0 HE1 MET A 142 4.492 -8.756 2.223 1.00 35.11 H new ATOM 0 HE2 MET A 142 2.795 -9.250 2.428 1.00 35.11 H new ATOM 0 HE3 MET A 142 3.362 -8.647 0.852 1.00 35.11 H new ATOM 2231 N ASN A 143 -2.046 -9.788 4.060 1.00 53.33 N ATOM 2232 CA ASN A 143 -3.372 -10.351 3.673 1.00 4.23 C ATOM 2233 C ASN A 143 -4.487 -9.904 4.648 1.00 43.54 C ATOM 2234 O ASN A 143 -5.637 -9.798 4.245 1.00 31.04 O ATOM 2235 CB ASN A 143 -3.355 -11.914 3.554 1.00 5.43 C ATOM 2236 CG ASN A 143 -3.023 -12.414 2.139 1.00 51.51 C ATOM 2237 OD1 ASN A 143 -3.888 -12.457 1.271 1.00 63.44 O ATOM 2238 ND2 ASN A 143 -1.799 -12.835 1.902 1.00 52.34 N ATOM 0 H ASN A 143 -1.365 -10.493 4.341 1.00 53.33 H new ATOM 0 HA ASN A 143 -3.590 -9.949 2.684 1.00 4.23 H new ATOM 0 HB2 ASN A 143 -2.623 -12.317 4.255 1.00 5.43 H new ATOM 0 HB3 ASN A 143 -4.329 -12.304 3.850 1.00 5.43 H new ATOM 0 HD21 ASN A 143 -1.556 -13.205 0.983 1.00 52.34 H new ATOM 0 HD22 ASN A 143 -1.093 -12.791 2.637 1.00 52.34 H new ATOM 2245 N SER A 144 -4.138 -9.676 5.929 1.00 21.40 N ATOM 2246 CA SER A 144 -5.093 -9.142 6.945 1.00 4.14 C ATOM 2247 C SER A 144 -5.414 -7.644 6.683 1.00 72.12 C ATOM 2248 O SER A 144 -6.557 -7.203 6.849 1.00 33.43 O ATOM 2249 CB SER A 144 -4.522 -9.312 8.372 1.00 4.33 C ATOM 2250 OG SER A 144 -4.277 -10.678 8.679 1.00 61.44 O ATOM 0 H SER A 144 -3.202 -9.851 6.295 1.00 21.40 H new ATOM 0 HA SER A 144 -6.017 -9.714 6.860 1.00 4.14 H new ATOM 0 HB2 SER A 144 -3.595 -8.746 8.463 1.00 4.33 H new ATOM 0 HB3 SER A 144 -5.222 -8.896 9.096 1.00 4.33 H new ATOM 0 HG SER A 144 -3.535 -11.009 8.131 1.00 61.44 H new ATOM 2256 N THR A 145 -4.382 -6.876 6.280 1.00 34.34 N ATOM 2257 CA THR A 145 -4.526 -5.450 5.878 1.00 14.32 C ATOM 2258 C THR A 145 -5.341 -5.321 4.552 1.00 43.21 C ATOM 2259 O THR A 145 -6.142 -4.396 4.376 1.00 22.52 O ATOM 2260 CB THR A 145 -3.111 -4.786 5.731 1.00 42.33 C ATOM 2261 OG1 THR A 145 -2.388 -4.907 6.974 1.00 71.31 O ATOM 2262 CG2 THR A 145 -3.177 -3.299 5.338 1.00 43.21 C ATOM 0 H THR A 145 -3.424 -7.220 6.222 1.00 34.34 H new ATOM 0 HA THR A 145 -5.078 -4.925 6.658 1.00 14.32 H new ATOM 0 HB THR A 145 -2.601 -5.314 4.926 1.00 42.33 H new ATOM 0 HG1 THR A 145 -2.817 -4.351 7.657 1.00 71.31 H new ATOM 0 HG21 THR A 145 -2.166 -2.900 5.253 1.00 43.21 H new ATOM 0 HG22 THR A 145 -3.689 -3.198 4.381 1.00 43.21 H new ATOM 0 HG23 THR A 145 -3.723 -2.745 6.102 1.00 43.21 H new ATOM 2270 N LEU A 146 -5.130 -6.280 3.636 1.00 41.12 N ATOM 2271 CA LEU A 146 -5.901 -6.407 2.372 1.00 42.10 C ATOM 2272 C LEU A 146 -7.298 -7.024 2.612 1.00 45.22 C ATOM 2273 O LEU A 146 -8.205 -6.844 1.802 1.00 52.13 O ATOM 2274 CB LEU A 146 -5.101 -7.240 1.348 1.00 12.31 C ATOM 2275 CG LEU A 146 -3.761 -6.590 0.881 1.00 75.43 C ATOM 2276 CD1 LEU A 146 -2.904 -7.589 0.100 1.00 23.13 C ATOM 2277 CD2 LEU A 146 -4.007 -5.309 0.052 1.00 22.55 C ATOM 0 H LEU A 146 -4.415 -6.999 3.746 1.00 41.12 H new ATOM 0 HA LEU A 146 -6.058 -5.406 1.970 1.00 42.10 H new ATOM 0 HB2 LEU A 146 -4.883 -8.215 1.784 1.00 12.31 H new ATOM 0 HB3 LEU A 146 -5.728 -7.415 0.474 1.00 12.31 H new ATOM 0 HG LEU A 146 -3.212 -6.302 1.777 1.00 75.43 H new ATOM 0 HD11 LEU A 146 -1.977 -7.107 -0.212 1.00 23.13 H new ATOM 0 HD12 LEU A 146 -2.673 -8.444 0.735 1.00 23.13 H new ATOM 0 HD13 LEU A 146 -3.451 -7.928 -0.780 1.00 23.13 H new ATOM 0 HD21 LEU A 146 -3.051 -4.885 -0.255 1.00 22.55 H new ATOM 0 HD22 LEU A 146 -4.596 -5.555 -0.832 1.00 22.55 H new ATOM 0 HD23 LEU A 146 -4.548 -4.582 0.658 1.00 22.55 H new ATOM 2289 N ASN A 147 -7.452 -7.774 3.713 1.00 40.25 N ATOM 2290 CA ASN A 147 -8.771 -8.270 4.177 1.00 65.15 C ATOM 2291 C ASN A 147 -9.655 -7.081 4.637 1.00 74.44 C ATOM 2292 O ASN A 147 -10.876 -7.173 4.645 1.00 62.23 O ATOM 2293 CB ASN A 147 -8.583 -9.318 5.309 1.00 11.31 C ATOM 2294 CG ASN A 147 -9.879 -9.996 5.751 1.00 63.42 C ATOM 2295 OD1 ASN A 147 -10.509 -9.602 6.724 1.00 74.21 O ATOM 2296 ND2 ASN A 147 -10.299 -11.009 5.026 1.00 30.23 N ATOM 0 H ASN A 147 -6.674 -8.057 4.309 1.00 40.25 H new ATOM 0 HA ASN A 147 -9.282 -8.765 3.351 1.00 65.15 H new ATOM 0 HB2 ASN A 147 -7.883 -10.082 4.970 1.00 11.31 H new ATOM 0 HB3 ASN A 147 -8.129 -8.829 6.171 1.00 11.31 H new ATOM 0 HD21 ASN A 147 -11.167 -11.485 5.270 1.00 30.23 H new ATOM 0 HD22 ASN A 147 -9.756 -11.319 4.220 1.00 30.23 H new ATOM 2303 N GLN A 148 -9.006 -5.966 5.028 1.00 41.40 N ATOM 2304 CA GLN A 148 -9.695 -4.676 5.276 1.00 43.23 C ATOM 2305 C GLN A 148 -10.093 -3.995 3.936 1.00 3.15 C ATOM 2306 O GLN A 148 -11.127 -3.336 3.857 1.00 0.04 O ATOM 2307 CB GLN A 148 -8.799 -3.727 6.121 1.00 3.11 C ATOM 2308 CG GLN A 148 -8.211 -4.346 7.409 1.00 60.02 C ATOM 2309 CD GLN A 148 -9.267 -4.929 8.353 1.00 23.50 C ATOM 2310 OE1 GLN A 148 -9.806 -4.232 9.207 1.00 35.22 O ATOM 2311 NE2 GLN A 148 -9.564 -6.212 8.217 1.00 30.10 N ATOM 0 H GLN A 148 -7.998 -5.930 5.181 1.00 41.40 H new ATOM 0 HA GLN A 148 -10.605 -4.883 5.839 1.00 43.23 H new ATOM 0 HB2 GLN A 148 -7.976 -3.380 5.496 1.00 3.11 H new ATOM 0 HB3 GLN A 148 -9.385 -2.849 6.394 1.00 3.11 H new ATOM 0 HG2 GLN A 148 -7.508 -5.133 7.135 1.00 60.02 H new ATOM 0 HG3 GLN A 148 -7.643 -3.583 7.941 1.00 60.02 H new ATOM 0 HE21 GLN A 148 -9.101 -6.769 7.499 1.00 30.10 H new ATOM 0 HE22 GLN A 148 -10.256 -6.643 8.830 1.00 30.10 H new ATOM 2320 N LEU A 149 -9.243 -4.168 2.890 1.00 42.25 N ATOM 2321 CA LEU A 149 -9.512 -3.674 1.510 1.00 43.03 C ATOM 2322 C LEU A 149 -10.728 -4.408 0.886 1.00 43.25 C ATOM 2323 O LEU A 149 -11.505 -3.816 0.139 1.00 33.34 O ATOM 2324 CB LEU A 149 -8.232 -3.829 0.628 1.00 1.42 C ATOM 2325 CG LEU A 149 -8.319 -3.329 -0.854 1.00 12.24 C ATOM 2326 CD1 LEU A 149 -8.779 -1.864 -0.934 1.00 53.25 C ATOM 2327 CD2 LEU A 149 -6.975 -3.512 -1.598 1.00 60.52 C ATOM 0 H LEU A 149 -8.351 -4.654 2.978 1.00 42.25 H new ATOM 0 HA LEU A 149 -9.765 -2.615 1.558 1.00 43.03 H new ATOM 0 HB2 LEU A 149 -7.418 -3.295 1.118 1.00 1.42 H new ATOM 0 HB3 LEU A 149 -7.958 -4.884 0.613 1.00 1.42 H new ATOM 0 HG LEU A 149 -9.068 -3.947 -1.349 1.00 12.24 H new ATOM 0 HD11 LEU A 149 -8.827 -1.554 -1.978 1.00 53.25 H new ATOM 0 HD12 LEU A 149 -9.766 -1.767 -0.481 1.00 53.25 H new ATOM 0 HD13 LEU A 149 -8.071 -1.231 -0.400 1.00 53.25 H new ATOM 0 HD21 LEU A 149 -7.075 -3.154 -2.623 1.00 60.52 H new ATOM 0 HD22 LEU A 149 -6.197 -2.943 -1.089 1.00 60.52 H new ATOM 0 HD23 LEU A 149 -6.705 -4.568 -1.607 1.00 60.52 H new ATOM 2339 N GLU A 150 -10.872 -5.698 1.226 1.00 32.20 N ATOM 2340 CA GLU A 150 -12.086 -6.511 0.943 1.00 54.11 C ATOM 2341 C GLU A 150 -13.367 -5.794 1.445 1.00 10.33 C ATOM 2342 O GLU A 150 -14.288 -5.501 0.676 1.00 30.11 O ATOM 2343 CB GLU A 150 -11.922 -7.882 1.663 1.00 24.15 C ATOM 2344 CG GLU A 150 -13.169 -8.794 1.707 1.00 70.02 C ATOM 2345 CD GLU A 150 -13.012 -9.953 2.715 1.00 14.25 C ATOM 2346 OE1 GLU A 150 -13.327 -9.762 3.919 1.00 62.43 O ATOM 2347 OE2 GLU A 150 -12.564 -11.054 2.323 1.00 52.03 O ATOM 0 H GLU A 150 -10.144 -6.222 1.712 1.00 32.20 H new ATOM 0 HA GLU A 150 -12.191 -6.652 -0.133 1.00 54.11 H new ATOM 0 HB2 GLU A 150 -11.117 -8.430 1.174 1.00 24.15 H new ATOM 0 HB3 GLU A 150 -11.602 -7.693 2.688 1.00 24.15 H new ATOM 0 HG2 GLU A 150 -14.042 -8.199 1.974 1.00 70.02 H new ATOM 0 HG3 GLU A 150 -13.353 -9.202 0.713 1.00 70.02 H new ATOM 2354 N LYS A 151 -13.355 -5.457 2.742 1.00 4.51 N ATOM 2355 CA LYS A 151 -14.509 -4.862 3.462 1.00 53.52 C ATOM 2356 C LYS A 151 -14.767 -3.402 3.030 1.00 44.03 C ATOM 2357 O LYS A 151 -15.898 -2.906 3.096 1.00 32.41 O ATOM 2358 CB LYS A 151 -14.233 -4.945 4.982 1.00 62.34 C ATOM 2359 CG LYS A 151 -13.832 -6.360 5.442 1.00 3.12 C ATOM 2360 CD LYS A 151 -13.603 -6.477 6.962 1.00 4.12 C ATOM 2361 CE LYS A 151 -13.030 -7.843 7.356 1.00 64.21 C ATOM 2362 NZ LYS A 151 -13.748 -8.967 6.703 1.00 40.33 N ATOM 0 H LYS A 151 -12.536 -5.588 3.336 1.00 4.51 H new ATOM 0 HA LYS A 151 -15.410 -5.423 3.213 1.00 53.52 H new ATOM 0 HB2 LYS A 151 -13.438 -4.245 5.241 1.00 62.34 H new ATOM 0 HB3 LYS A 151 -15.124 -4.630 5.526 1.00 62.34 H new ATOM 0 HG2 LYS A 151 -14.611 -7.063 5.146 1.00 3.12 H new ATOM 0 HG3 LYS A 151 -12.921 -6.657 4.923 1.00 3.12 H new ATOM 0 HD2 LYS A 151 -12.921 -5.691 7.287 1.00 4.12 H new ATOM 0 HD3 LYS A 151 -14.546 -6.316 7.484 1.00 4.12 H new ATOM 0 HE2 LYS A 151 -11.975 -7.883 7.085 1.00 64.21 H new ATOM 0 HE3 LYS A 151 -13.086 -7.959 8.438 1.00 64.21 H new ATOM 0 HZ1 LYS A 151 -13.545 -9.851 7.212 1.00 40.33 H new ATOM 0 HZ2 LYS A 151 -14.771 -8.783 6.722 1.00 40.33 H new ATOM 0 HZ3 LYS A 151 -13.431 -9.055 5.717 1.00 40.33 H new ATOM 2376 N LEU A 152 -13.688 -2.741 2.601 1.00 43.33 N ATOM 2377 CA LEU A 152 -13.707 -1.378 2.043 1.00 42.31 C ATOM 2378 C LEU A 152 -14.458 -1.321 0.687 1.00 55.33 C ATOM 2379 O LEU A 152 -15.341 -0.481 0.484 1.00 63.23 O ATOM 2380 CB LEU A 152 -12.237 -0.893 1.879 1.00 15.12 C ATOM 2381 CG LEU A 152 -12.005 0.381 1.011 1.00 72.10 C ATOM 2382 CD1 LEU A 152 -12.780 1.586 1.559 1.00 23.04 C ATOM 2383 CD2 LEU A 152 -10.506 0.695 0.888 1.00 13.22 C ATOM 0 H LEU A 152 -12.752 -3.145 2.631 1.00 43.33 H new ATOM 0 HA LEU A 152 -14.245 -0.721 2.727 1.00 42.31 H new ATOM 0 HB2 LEU A 152 -11.829 -0.705 2.872 1.00 15.12 H new ATOM 0 HB3 LEU A 152 -11.658 -1.708 1.446 1.00 15.12 H new ATOM 0 HG LEU A 152 -12.390 0.174 0.012 1.00 72.10 H new ATOM 0 HD11 LEU A 152 -12.594 2.456 0.929 1.00 23.04 H new ATOM 0 HD12 LEU A 152 -13.847 1.362 1.562 1.00 23.04 H new ATOM 0 HD13 LEU A 152 -12.451 1.798 2.576 1.00 23.04 H new ATOM 0 HD21 LEU A 152 -10.370 1.588 0.278 1.00 13.22 H new ATOM 0 HD22 LEU A 152 -10.088 0.866 1.880 1.00 13.22 H new ATOM 0 HD23 LEU A 152 -9.995 -0.146 0.419 1.00 13.22 H new ATOM 2395 N LEU A 153 -14.083 -2.217 -0.232 1.00 63.12 N ATOM 2396 CA LEU A 153 -14.665 -2.278 -1.592 1.00 15.03 C ATOM 2397 C LEU A 153 -16.100 -2.862 -1.575 1.00 0.35 C ATOM 2398 O LEU A 153 -16.889 -2.614 -2.493 1.00 51.42 O ATOM 2399 CB LEU A 153 -13.713 -3.082 -2.508 1.00 24.50 C ATOM 2400 CG LEU A 153 -12.274 -2.470 -2.636 1.00 3.35 C ATOM 2401 CD1 LEU A 153 -11.292 -3.438 -3.319 1.00 52.10 C ATOM 2402 CD2 LEU A 153 -12.300 -1.097 -3.350 1.00 30.34 C ATOM 0 H LEU A 153 -13.368 -2.924 -0.061 1.00 63.12 H new ATOM 0 HA LEU A 153 -14.762 -1.268 -1.990 1.00 15.03 H new ATOM 0 HB2 LEU A 153 -13.630 -4.099 -2.124 1.00 24.50 H new ATOM 0 HB3 LEU A 153 -14.156 -3.152 -3.502 1.00 24.50 H new ATOM 0 HG LEU A 153 -11.910 -2.307 -1.622 1.00 3.35 H new ATOM 0 HD11 LEU A 153 -10.309 -2.972 -3.386 1.00 52.10 H new ATOM 0 HD12 LEU A 153 -11.220 -4.355 -2.735 1.00 52.10 H new ATOM 0 HD13 LEU A 153 -11.651 -3.673 -4.321 1.00 52.10 H new ATOM 0 HD21 LEU A 153 -11.286 -0.704 -3.420 1.00 30.34 H new ATOM 0 HD22 LEU A 153 -12.713 -1.216 -4.352 1.00 30.34 H new ATOM 0 HD23 LEU A 153 -12.919 -0.403 -2.782 1.00 30.34 H new ATOM 2414 N ASN A 154 -16.417 -3.636 -0.520 1.00 34.22 N ATOM 2415 CA ASN A 154 -17.804 -4.070 -0.208 1.00 14.03 C ATOM 2416 C ASN A 154 -18.592 -2.942 0.527 1.00 1.50 C ATOM 2417 O ASN A 154 -19.825 -2.977 0.565 1.00 42.34 O ATOM 2418 CB ASN A 154 -17.779 -5.359 0.660 1.00 52.40 C ATOM 2419 CG ASN A 154 -17.249 -6.624 -0.044 1.00 62.03 C ATOM 2420 OD1 ASN A 154 -16.346 -6.488 -0.997 1.00 52.25 O flip ATOM 2421 ND2 ASN A 154 -17.649 -7.735 0.288 1.00 23.13 N flip ATOM 0 H ASN A 154 -15.724 -3.981 0.144 1.00 34.22 H new ATOM 0 HA ASN A 154 -18.313 -4.283 -1.148 1.00 14.03 H new ATOM 0 HB2 ASN A 154 -17.165 -5.171 1.541 1.00 52.40 H new ATOM 0 HB3 ASN A 154 -18.791 -5.558 1.013 1.00 52.40 H new ATOM 0 HD21 ASN A 154 -18.347 -7.826 1.026 1.00 23.13 H new ATOM 0 HD22 ASN A 154 -17.283 -8.568 -0.174 1.00 23.13 H new ATOM 2428 N GLN A 155 -17.841 -1.973 1.118 1.00 12.42 N ATOM 2429 CA GLN A 155 -18.369 -0.769 1.825 1.00 22.52 C ATOM 2430 C GLN A 155 -19.139 -1.115 3.130 1.00 33.24 C ATOM 2431 O GLN A 155 -20.229 -1.689 3.076 1.00 62.35 O ATOM 2432 CB GLN A 155 -19.235 0.136 0.891 1.00 61.04 C ATOM 2433 CG GLN A 155 -18.459 0.778 -0.289 1.00 22.33 C ATOM 2434 CD GLN A 155 -19.280 1.799 -1.090 1.00 72.32 C ATOM 2435 OE1 GLN A 155 -20.163 2.463 -0.556 1.00 33.21 O ATOM 2436 NE2 GLN A 155 -18.997 1.939 -2.375 1.00 53.51 N ATOM 0 H GLN A 155 -16.822 -2.007 1.117 1.00 12.42 H new ATOM 0 HA GLN A 155 -17.487 -0.199 2.119 1.00 22.52 H new ATOM 0 HB2 GLN A 155 -20.054 -0.459 0.488 1.00 61.04 H new ATOM 0 HB3 GLN A 155 -19.682 0.930 1.489 1.00 61.04 H new ATOM 0 HG2 GLN A 155 -17.567 1.268 0.100 1.00 22.33 H new ATOM 0 HG3 GLN A 155 -18.122 -0.011 -0.962 1.00 22.33 H new ATOM 0 HE21 GLN A 155 -18.259 1.377 -2.799 1.00 53.51 H new ATOM 0 HE22 GLN A 155 -19.517 2.609 -2.942 1.00 53.51 H new