USER MOD reduce.3.24.130724 H: found=0, std=0, add=857, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 854 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 80 THR OG1 : rot 141:sc= -6.19! USER MOD Set 1.2: A 87 ASN : amide:sc= -3.26 K(o=-9.4,f=-21!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 166:sc= -0.152 (180deg=-0.489) USER MOD Single : A 6 ASN : amide:sc= -0.353 K(o=-0.35,f=-1.1!) USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD Single : A 23 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 25 THR OG1 : rot -100:sc= -1.31 USER MOD Single : A 26 SER OG : rot 180:sc= 0.0464 USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot 65:sc= -0.0577 USER MOD Single : A 31 SER OG : rot 56:sc= 1.05 USER MOD Single : A 34 GLN : amide:sc= 0.0839 X(o=0.084,f=0) USER MOD Single : A 35 SER OG : rot 23:sc= 0.0308 USER MOD Single : A 48 ASN : amide:sc= -0.149 X(o=-0.15,f=0) USER MOD Single : A 50 SER OG : rot -61:sc= 0.273 USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 54 GLN : amide:sc= -1.54 X(o=-1.5,f=-1.1) USER MOD Single : A 61 SER OG : rot 180:sc= -0.137 USER MOD Single : A 62 SER OG : rot 71:sc= -0.555 USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 GLN : amide:sc= -2.2! C(o=-2.2!,f=-1.9!) USER MOD Single : A 82 THR OG1 : rot 180:sc= -0.525 USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 100 SER OG : rot -41:sc= 0.63 USER MOD Single : A 101 CYS SG : rot -9:sc= -1.72! USER MOD Single : A 102 HIS : no HE2:sc= 0.82 K(o=0.82,f=-3.3!) USER MOD Single : A 114 ASN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 81.853 12.116 4.094 1.00 5.40 N ATOM 2 CA MET A 1 81.195 12.681 5.266 1.00 54.52 C ATOM 3 C MET A 1 79.701 12.377 5.251 1.00 72.21 C ATOM 4 O MET A 1 78.872 13.283 5.335 1.00 0.30 O ATOM 5 CB MET A 1 81.418 14.194 5.323 1.00 43.41 C ATOM 6 CG MET A 1 81.062 14.910 4.030 1.00 14.34 C ATOM 7 SD MET A 1 81.456 16.669 4.080 1.00 21.30 S ATOM 8 CE MET A 1 81.005 17.163 2.418 1.00 43.53 C ATOM 0 H1 MET A 1 82.804 12.527 3.998 1.00 5.40 H new ATOM 0 H2 MET A 1 81.931 11.085 4.203 1.00 5.40 H new ATOM 0 H3 MET A 1 81.295 12.333 3.244 1.00 5.40 H new ATOM 0 HA MET A 1 81.632 12.222 6.153 1.00 54.52 H new ATOM 0 HB2 MET A 1 80.822 14.610 6.135 1.00 43.41 H new ATOM 0 HB3 MET A 1 82.463 14.390 5.561 1.00 43.41 H new ATOM 0 HG2 MET A 1 81.597 14.445 3.202 1.00 14.34 H new ATOM 0 HG3 MET A 1 79.998 14.785 3.831 1.00 14.34 H new ATOM 0 HE1 MET A 1 81.192 18.230 2.292 1.00 43.53 H new ATOM 0 HE2 MET A 1 81.601 16.603 1.698 1.00 43.53 H new ATOM 0 HE3 MET A 1 79.948 16.958 2.252 1.00 43.53 H new ATOM 18 N ALA A 2 79.363 11.096 5.142 1.00 44.20 N ATOM 19 CA ALA A 2 77.969 10.673 5.117 1.00 25.11 C ATOM 20 C ALA A 2 77.660 9.731 6.277 1.00 61.15 C ATOM 21 O ALA A 2 76.642 9.878 6.953 1.00 13.45 O ATOM 22 CB ALA A 2 77.644 10.004 3.790 1.00 25.44 C ATOM 0 H ALA A 2 80.036 10.333 5.070 1.00 44.20 H new ATOM 0 HA ALA A 2 77.344 11.559 5.227 1.00 25.11 H new ATOM 0 HB1 ALA A 2 76.599 9.693 3.786 1.00 25.44 H new ATOM 0 HB2 ALA A 2 77.817 10.708 2.976 1.00 25.44 H new ATOM 0 HB3 ALA A 2 78.283 9.131 3.657 1.00 25.44 H new ATOM 28 N ASP A 3 78.544 8.765 6.500 1.00 63.23 N ATOM 29 CA ASP A 3 78.366 7.799 7.577 1.00 15.52 C ATOM 30 C ASP A 3 78.119 8.508 8.905 1.00 34.54 C ATOM 31 O ASP A 3 78.675 9.574 9.165 1.00 54.31 O ATOM 32 CB ASP A 3 79.595 6.895 7.689 1.00 70.33 C ATOM 33 CG ASP A 3 79.320 5.643 8.499 1.00 64.33 C ATOM 34 OD1 ASP A 3 78.305 4.968 8.222 1.00 3.42 O ATOM 35 OD2 ASP A 3 80.119 5.337 9.407 1.00 2.13 O ATOM 0 H ASP A 3 79.392 8.630 5.949 1.00 63.23 H new ATOM 0 HA ASP A 3 77.495 7.187 7.343 1.00 15.52 H new ATOM 0 HB2 ASP A 3 79.927 6.612 6.690 1.00 70.33 H new ATOM 0 HB3 ASP A 3 80.411 7.451 8.151 1.00 70.33 H new ATOM 40 N PHE A 4 77.278 7.908 9.742 1.00 2.14 N ATOM 41 CA PHE A 4 76.955 8.482 11.043 1.00 13.54 C ATOM 42 C PHE A 4 77.458 7.588 12.173 1.00 71.31 C ATOM 43 O PHE A 4 78.441 7.907 12.842 1.00 53.43 O ATOM 44 CB PHE A 4 75.444 8.685 11.173 1.00 61.03 C ATOM 45 CG PHE A 4 74.964 9.994 10.611 1.00 5.23 C ATOM 46 CD1 PHE A 4 75.473 11.193 11.084 1.00 73.20 C ATOM 47 CD2 PHE A 4 74.007 10.023 9.610 1.00 50.10 C ATOM 48 CE1 PHE A 4 75.033 12.398 10.570 1.00 72.13 C ATOM 49 CE2 PHE A 4 73.564 11.225 9.091 1.00 2.13 C ATOM 50 CZ PHE A 4 74.078 12.414 9.571 1.00 23.30 C ATOM 0 H PHE A 4 76.808 7.025 9.542 1.00 2.14 H new ATOM 0 HA PHE A 4 77.453 9.449 11.119 1.00 13.54 H new ATOM 0 HB2 PHE A 4 74.931 7.870 10.663 1.00 61.03 H new ATOM 0 HB3 PHE A 4 75.167 8.627 12.226 1.00 61.03 H new ATOM 0 HD1 PHE A 4 76.221 11.186 11.863 1.00 73.20 H new ATOM 0 HD2 PHE A 4 73.603 9.096 9.231 1.00 50.10 H new ATOM 0 HE1 PHE A 4 75.435 13.326 10.949 1.00 72.13 H new ATOM 0 HE2 PHE A 4 72.817 11.235 8.311 1.00 2.13 H new ATOM 0 HZ PHE A 4 73.734 13.354 9.166 1.00 23.30 H new ATOM 60 N ASP A 5 76.776 6.467 12.379 1.00 2.05 N ATOM 61 CA ASP A 5 77.153 5.525 13.427 1.00 5.14 C ATOM 62 C ASP A 5 76.439 4.190 13.241 1.00 63.11 C ATOM 63 O ASP A 5 75.210 4.125 13.253 1.00 10.25 O ATOM 64 CB ASP A 5 76.826 6.103 14.805 1.00 43.44 C ATOM 65 CG ASP A 5 77.996 6.854 15.410 1.00 12.45 C ATOM 66 OD1 ASP A 5 79.144 6.386 15.257 1.00 54.03 O ATOM 67 OD2 ASP A 5 77.765 7.909 16.038 1.00 23.41 O ATOM 0 H ASP A 5 75.960 6.188 11.835 1.00 2.05 H new ATOM 0 HA ASP A 5 78.228 5.355 13.358 1.00 5.14 H new ATOM 0 HB2 ASP A 5 75.971 6.774 14.721 1.00 43.44 H new ATOM 0 HB3 ASP A 5 76.532 5.295 15.474 1.00 43.44 H new ATOM 72 N ASN A 6 77.218 3.126 13.067 1.00 41.45 N ATOM 73 CA ASN A 6 76.660 1.794 12.875 1.00 31.54 C ATOM 74 C ASN A 6 77.768 0.750 12.776 1.00 65.40 C ATOM 75 O ASN A 6 78.750 0.937 12.057 1.00 25.12 O ATOM 76 CB ASN A 6 75.794 1.756 11.614 1.00 11.32 C ATOM 77 CG ASN A 6 75.533 0.342 11.134 1.00 22.41 C ATOM 78 OD1 ASN A 6 76.397 -0.287 10.523 1.00 62.04 O ATOM 79 ND2 ASN A 6 74.337 -0.166 11.408 1.00 12.11 N ATOM 0 H ASN A 6 78.237 3.162 13.055 1.00 41.45 H new ATOM 0 HA ASN A 6 76.039 1.560 13.740 1.00 31.54 H new ATOM 0 HB2 ASN A 6 74.843 2.250 11.815 1.00 11.32 H new ATOM 0 HB3 ASN A 6 76.286 2.321 10.822 1.00 11.32 H new ATOM 0 HD21 ASN A 6 74.105 -1.113 11.109 1.00 12.11 H new ATOM 0 HD22 ASN A 6 73.651 0.391 11.917 1.00 12.11 H new ATOM 86 N LEU A 7 77.603 -0.352 13.501 1.00 50.15 N ATOM 87 CA LEU A 7 78.588 -1.427 13.494 1.00 21.30 C ATOM 88 C LEU A 7 77.943 -2.755 13.109 1.00 61.22 C ATOM 89 O LEU A 7 78.144 -3.258 12.003 1.00 3.21 O ATOM 90 CB LEU A 7 79.249 -1.548 14.868 1.00 44.12 C ATOM 91 CG LEU A 7 80.060 -0.338 15.332 1.00 41.33 C ATOM 92 CD1 LEU A 7 79.193 0.600 16.157 1.00 43.51 C ATOM 93 CD2 LEU A 7 81.277 -0.784 16.130 1.00 73.41 C ATOM 0 H LEU A 7 76.796 -0.524 14.101 1.00 50.15 H new ATOM 0 HA LEU A 7 79.348 -1.185 12.751 1.00 21.30 H new ATOM 0 HB2 LEU A 7 78.472 -1.744 15.607 1.00 44.12 H new ATOM 0 HB3 LEU A 7 79.906 -2.418 14.858 1.00 44.12 H new ATOM 0 HG LEU A 7 80.408 0.202 14.451 1.00 41.33 H new ATOM 0 HD11 LEU A 7 79.787 1.456 16.479 1.00 43.51 H new ATOM 0 HD12 LEU A 7 78.355 0.947 15.553 1.00 43.51 H new ATOM 0 HD13 LEU A 7 78.815 0.071 17.032 1.00 43.51 H new ATOM 0 HD21 LEU A 7 81.842 0.091 16.452 1.00 73.41 H new ATOM 0 HD22 LEU A 7 80.952 -1.348 17.004 1.00 73.41 H new ATOM 0 HD23 LEU A 7 81.910 -1.415 15.506 1.00 73.41 H new ATOM 105 N PHE A 8 77.164 -3.317 14.027 1.00 13.43 N ATOM 106 CA PHE A 8 76.487 -4.585 13.784 1.00 72.11 C ATOM 107 C PHE A 8 75.361 -4.803 14.790 1.00 11.34 C ATOM 108 O PHE A 8 75.144 -3.983 15.681 1.00 74.02 O ATOM 109 CB PHE A 8 77.486 -5.743 13.859 1.00 75.31 C ATOM 110 CG PHE A 8 78.060 -6.126 12.525 1.00 12.01 C ATOM 111 CD1 PHE A 8 77.230 -6.476 11.473 1.00 12.20 C ATOM 112 CD2 PHE A 8 79.431 -6.137 12.325 1.00 43.33 C ATOM 113 CE1 PHE A 8 77.755 -6.830 10.244 1.00 12.31 C ATOM 114 CE2 PHE A 8 79.962 -6.488 11.098 1.00 23.35 C ATOM 115 CZ PHE A 8 79.123 -6.837 10.057 1.00 43.32 C ATOM 0 H PHE A 8 76.986 -2.914 14.947 1.00 13.43 H new ATOM 0 HA PHE A 8 76.054 -4.551 12.784 1.00 72.11 H new ATOM 0 HB2 PHE A 8 78.300 -5.468 14.530 1.00 75.31 H new ATOM 0 HB3 PHE A 8 76.992 -6.611 14.296 1.00 75.31 H new ATOM 0 HD1 PHE A 8 76.159 -6.472 11.614 1.00 12.20 H new ATOM 0 HD2 PHE A 8 80.092 -5.869 13.136 1.00 43.33 H new ATOM 0 HE1 PHE A 8 77.096 -7.101 9.432 1.00 12.31 H new ATOM 0 HE2 PHE A 8 81.032 -6.489 10.953 1.00 23.35 H new ATOM 0 HZ PHE A 8 79.537 -7.115 9.099 1.00 43.32 H new ATOM 125 N ASP A 9 74.650 -5.914 14.641 1.00 23.42 N ATOM 126 CA ASP A 9 73.546 -6.242 15.536 1.00 11.23 C ATOM 127 C ASP A 9 73.776 -7.591 16.210 1.00 31.33 C ATOM 128 O ASP A 9 74.815 -8.222 16.021 1.00 21.31 O ATOM 129 CB ASP A 9 72.225 -6.262 14.767 1.00 54.25 C ATOM 130 CG ASP A 9 72.029 -5.018 13.921 1.00 3.10 C ATOM 131 OD1 ASP A 9 72.569 -4.975 12.796 1.00 4.44 O ATOM 132 OD2 ASP A 9 71.337 -4.088 14.385 1.00 21.11 O ATOM 0 H ASP A 9 74.818 -6.604 13.909 1.00 23.42 H new ATOM 0 HA ASP A 9 73.496 -5.473 16.307 1.00 11.23 H new ATOM 0 HB2 ASP A 9 72.195 -7.143 14.126 1.00 54.25 H new ATOM 0 HB3 ASP A 9 71.399 -6.352 15.472 1.00 54.25 H new ATOM 137 N ALA A 10 72.799 -8.027 16.999 1.00 33.41 N ATOM 138 CA ALA A 10 72.894 -9.301 17.701 1.00 23.41 C ATOM 139 C ALA A 10 71.534 -9.987 17.780 1.00 31.34 C ATOM 140 O ALA A 10 70.526 -9.442 17.330 1.00 22.34 O ATOM 141 CB ALA A 10 73.465 -9.094 19.096 1.00 61.31 C ATOM 0 H ALA A 10 71.932 -7.516 17.168 1.00 33.41 H new ATOM 0 HA ALA A 10 73.566 -9.949 17.138 1.00 23.41 H new ATOM 0 HB1 ALA A 10 73.530 -10.054 19.609 1.00 61.31 H new ATOM 0 HB2 ALA A 10 74.460 -8.655 19.021 1.00 61.31 H new ATOM 0 HB3 ALA A 10 72.815 -8.425 19.660 1.00 61.31 H new ATOM 147 N ALA A 11 71.514 -11.186 18.354 1.00 75.43 N ATOM 148 CA ALA A 11 70.277 -11.945 18.493 1.00 31.13 C ATOM 149 C ALA A 11 70.175 -12.578 19.876 1.00 24.54 C ATOM 150 O ALA A 11 71.188 -12.898 20.499 1.00 30.35 O ATOM 151 CB ALA A 11 70.190 -13.014 17.413 1.00 41.42 C ATOM 0 H ALA A 11 72.340 -11.652 18.730 1.00 75.43 H new ATOM 0 HA ALA A 11 69.441 -11.256 18.375 1.00 31.13 H new ATOM 0 HB1 ALA A 11 69.262 -13.573 17.529 1.00 41.42 H new ATOM 0 HB2 ALA A 11 70.209 -12.541 16.431 1.00 41.42 H new ATOM 0 HB3 ALA A 11 71.037 -13.694 17.505 1.00 41.42 H new ATOM 157 N ILE A 12 68.947 -12.757 20.351 1.00 71.42 N ATOM 158 CA ILE A 12 68.713 -13.352 21.661 1.00 64.40 C ATOM 159 C ILE A 12 67.625 -14.419 21.593 1.00 14.35 C ATOM 160 O ILE A 12 66.529 -14.236 22.121 1.00 54.34 O ATOM 161 CB ILE A 12 68.310 -12.289 22.699 1.00 4.13 C ATOM 162 CG1 ILE A 12 69.283 -11.108 22.655 1.00 74.31 C ATOM 163 CG2 ILE A 12 68.272 -12.898 24.093 1.00 74.42 C ATOM 164 CD1 ILE A 12 70.698 -11.476 23.042 1.00 43.13 C ATOM 0 H ILE A 12 68.098 -12.498 19.848 1.00 71.42 H new ATOM 0 HA ILE A 12 69.651 -13.812 21.971 1.00 64.40 H new ATOM 0 HB ILE A 12 67.312 -11.924 22.455 1.00 4.13 H new ATOM 0 HG12 ILE A 12 69.288 -10.689 21.649 1.00 74.31 H new ATOM 0 HG13 ILE A 12 68.924 -10.326 23.324 1.00 74.31 H new ATOM 0 HG21 ILE A 12 67.986 -12.134 24.816 1.00 74.42 H new ATOM 0 HG22 ILE A 12 67.545 -13.710 24.116 1.00 74.42 H new ATOM 0 HG23 ILE A 12 69.258 -13.287 24.347 1.00 74.42 H new ATOM 0 HD11 ILE A 12 71.332 -10.591 22.988 1.00 43.13 H new ATOM 0 HD12 ILE A 12 70.707 -11.867 24.059 1.00 43.13 H new ATOM 0 HD13 ILE A 12 71.077 -12.235 22.358 1.00 43.13 H new ATOM 176 N ALA A 13 67.937 -15.534 20.941 1.00 12.05 N ATOM 177 CA ALA A 13 66.988 -16.633 20.808 1.00 15.04 C ATOM 178 C ALA A 13 67.705 -17.978 20.782 1.00 62.24 C ATOM 179 O ALA A 13 68.783 -18.106 20.202 1.00 61.00 O ATOM 180 CB ALA A 13 66.147 -16.454 19.553 1.00 3.34 C ATOM 0 H ALA A 13 68.840 -15.700 20.496 1.00 12.05 H new ATOM 0 HA ALA A 13 66.330 -16.620 21.677 1.00 15.04 H new ATOM 0 HB1 ALA A 13 65.443 -17.281 19.466 1.00 3.34 H new ATOM 0 HB2 ALA A 13 65.598 -15.515 19.614 1.00 3.34 H new ATOM 0 HB3 ALA A 13 66.797 -16.438 18.678 1.00 3.34 H new ATOM 186 N ARG A 14 67.099 -18.979 21.413 1.00 41.22 N ATOM 187 CA ARG A 14 67.682 -20.314 21.462 1.00 71.51 C ATOM 188 C ARG A 14 66.734 -21.296 22.145 1.00 32.25 C ATOM 189 O ARG A 14 66.413 -21.145 23.324 1.00 21.34 O ATOM 190 CB ARG A 14 69.020 -20.283 22.201 1.00 25.04 C ATOM 191 CG ARG A 14 70.017 -21.315 21.698 1.00 0.34 C ATOM 192 CD ARG A 14 70.884 -20.753 20.582 1.00 0.41 C ATOM 193 NE ARG A 14 72.134 -21.493 20.435 1.00 64.35 N ATOM 194 CZ ARG A 14 73.020 -21.257 19.472 1.00 35.15 C ATOM 195 NH1 ARG A 14 72.793 -20.305 18.578 1.00 70.21 N ATOM 196 NH2 ARG A 14 74.134 -21.974 19.404 1.00 21.23 N ATOM 0 H ARG A 14 66.205 -18.890 21.897 1.00 41.22 H new ATOM 0 HA ARG A 14 67.849 -20.648 20.438 1.00 71.51 H new ATOM 0 HB2 ARG A 14 69.457 -19.289 22.102 1.00 25.04 H new ATOM 0 HB3 ARG A 14 68.843 -20.449 23.264 1.00 25.04 H new ATOM 0 HG2 ARG A 14 70.650 -21.643 22.522 1.00 0.34 H new ATOM 0 HG3 ARG A 14 69.482 -22.194 21.338 1.00 0.34 H new ATOM 0 HD2 ARG A 14 70.332 -20.784 19.643 1.00 0.41 H new ATOM 0 HD3 ARG A 14 71.105 -19.705 20.787 1.00 0.41 H new ATOM 0 HE ARG A 14 72.339 -22.232 21.108 1.00 64.35 H new ATOM 0 HH11 ARG A 14 71.937 -19.752 18.628 1.00 70.21 H new ATOM 0 HH12 ARG A 14 73.474 -20.126 17.840 1.00 70.21 H new ATOM 0 HH21 ARG A 14 74.311 -22.707 20.091 1.00 21.23 H new ATOM 0 HH22 ARG A 14 74.813 -21.792 18.665 1.00 21.23 H new ATOM 210 N ALA A 15 66.289 -22.299 21.397 1.00 24.14 N ATOM 211 CA ALA A 15 65.380 -23.306 21.931 1.00 51.11 C ATOM 212 C ALA A 15 65.069 -24.374 20.887 1.00 34.13 C ATOM 213 O ALA A 15 64.865 -24.066 19.713 1.00 64.04 O ATOM 214 CB ALA A 15 64.096 -22.652 22.418 1.00 12.33 C ATOM 0 H ALA A 15 66.543 -22.437 20.419 1.00 24.14 H new ATOM 0 HA ALA A 15 65.870 -23.792 22.775 1.00 51.11 H new ATOM 0 HB1 ALA A 15 63.426 -23.415 22.814 1.00 12.33 H new ATOM 0 HB2 ALA A 15 64.329 -21.932 23.202 1.00 12.33 H new ATOM 0 HB3 ALA A 15 63.611 -22.140 21.587 1.00 12.33 H new ATOM 220 N ASP A 16 65.033 -25.627 21.323 1.00 23.54 N ATOM 221 CA ASP A 16 64.746 -26.741 20.427 1.00 62.12 C ATOM 222 C ASP A 16 64.627 -28.049 21.203 1.00 35.35 C ATOM 223 O ASP A 16 64.954 -28.109 22.389 1.00 41.21 O ATOM 224 CB ASP A 16 65.840 -26.863 19.364 1.00 74.33 C ATOM 225 CG ASP A 16 67.231 -26.885 19.965 1.00 32.11 C ATOM 226 OD1 ASP A 16 67.671 -25.836 20.479 1.00 12.14 O ATOM 227 OD2 ASP A 16 67.880 -27.952 19.920 1.00 15.40 O ATOM 0 H ASP A 16 65.199 -25.898 22.292 1.00 23.54 H new ATOM 0 HA ASP A 16 63.793 -26.543 19.937 1.00 62.12 H new ATOM 0 HB2 ASP A 16 65.682 -27.774 18.787 1.00 74.33 H new ATOM 0 HB3 ASP A 16 65.761 -26.028 18.668 1.00 74.33 H new ATOM 232 N GLU A 17 64.155 -29.092 20.528 1.00 21.10 N ATOM 233 CA GLU A 17 63.992 -30.397 21.157 1.00 21.52 C ATOM 234 C GLU A 17 64.938 -31.422 20.538 1.00 63.43 C ATOM 235 O GLU A 17 65.781 -31.084 19.706 1.00 33.30 O ATOM 236 CB GLU A 17 62.544 -30.876 21.022 1.00 41.44 C ATOM 237 CG GLU A 17 61.527 -29.912 21.610 1.00 4.24 C ATOM 238 CD GLU A 17 61.201 -28.764 20.675 1.00 64.11 C ATOM 239 OE1 GLU A 17 60.852 -29.034 19.506 1.00 51.11 O ATOM 240 OE2 GLU A 17 61.297 -27.598 21.109 1.00 34.43 O ATOM 0 H GLU A 17 63.879 -29.059 19.547 1.00 21.10 H new ATOM 0 HA GLU A 17 64.237 -30.295 22.214 1.00 21.52 H new ATOM 0 HB2 GLU A 17 62.318 -31.030 19.967 1.00 41.44 H new ATOM 0 HB3 GLU A 17 62.443 -31.843 21.515 1.00 41.44 H new ATOM 0 HG2 GLU A 17 60.612 -30.455 21.845 1.00 4.24 H new ATOM 0 HG3 GLU A 17 61.911 -29.513 22.549 1.00 4.24 H new ATOM 247 N THR A 18 64.792 -32.678 20.949 1.00 32.31 N ATOM 248 CA THR A 18 65.633 -33.753 20.438 1.00 51.13 C ATOM 249 C THR A 18 65.030 -34.373 19.183 1.00 72.23 C ATOM 250 O THR A 18 65.523 -34.159 18.074 1.00 34.55 O ATOM 251 CB THR A 18 65.840 -34.855 21.493 1.00 23.43 C ATOM 252 OG1 THR A 18 66.470 -34.308 22.656 1.00 23.15 O ATOM 253 CG2 THR A 18 66.689 -35.987 20.934 1.00 42.21 C ATOM 0 H THR A 18 64.098 -32.976 21.635 1.00 32.31 H new ATOM 0 HA THR A 18 66.598 -33.310 20.193 1.00 51.13 H new ATOM 0 HB THR A 18 64.863 -35.255 21.765 1.00 23.43 H new ATOM 0 HG1 THR A 18 66.596 -35.015 23.323 1.00 23.15 H new ATOM 0 HG21 THR A 18 66.822 -36.754 21.697 1.00 42.21 H new ATOM 0 HG22 THR A 18 66.191 -36.421 20.067 1.00 42.21 H new ATOM 0 HG23 THR A 18 67.663 -35.599 20.637 1.00 42.21 H new ATOM 261 N ILE A 19 63.960 -35.141 19.363 1.00 32.12 N ATOM 262 CA ILE A 19 63.289 -35.791 18.245 1.00 43.05 C ATOM 263 C ILE A 19 64.265 -36.634 17.432 1.00 24.10 C ATOM 264 O ILE A 19 64.705 -36.230 16.356 1.00 62.43 O ATOM 265 CB ILE A 19 62.621 -34.761 17.314 1.00 21.22 C ATOM 266 CG1 ILE A 19 61.789 -33.769 18.129 1.00 64.50 C ATOM 267 CG2 ILE A 19 61.754 -35.465 16.281 1.00 42.54 C ATOM 268 CD1 ILE A 19 61.169 -32.671 17.294 1.00 33.31 C ATOM 0 H ILE A 19 63.540 -35.328 20.273 1.00 32.12 H new ATOM 0 HA ILE A 19 62.521 -36.437 18.671 1.00 43.05 H new ATOM 0 HB ILE A 19 63.400 -34.208 16.789 1.00 21.22 H new ATOM 0 HG12 ILE A 19 60.998 -34.311 18.647 1.00 64.50 H new ATOM 0 HG13 ILE A 19 62.422 -33.319 18.894 1.00 64.50 H new ATOM 0 HG21 ILE A 19 61.289 -34.724 15.631 1.00 42.54 H new ATOM 0 HG22 ILE A 19 62.372 -36.135 15.684 1.00 42.54 H new ATOM 0 HG23 ILE A 19 60.979 -36.041 16.788 1.00 42.54 H new ATOM 0 HD11 ILE A 19 60.594 -32.005 17.937 1.00 33.31 H new ATOM 0 HD12 ILE A 19 61.956 -32.104 16.796 1.00 33.31 H new ATOM 0 HD13 ILE A 19 60.510 -33.111 16.546 1.00 33.31 H new ATOM 280 N ARG A 20 64.600 -37.810 17.955 1.00 53.00 N ATOM 281 CA ARG A 20 65.524 -38.712 17.278 1.00 20.03 C ATOM 282 C ARG A 20 64.873 -39.333 16.046 1.00 44.43 C ATOM 283 O ARG A 20 63.662 -39.541 16.009 1.00 13.21 O ATOM 284 CB ARG A 20 65.986 -39.814 18.234 1.00 40.51 C ATOM 285 CG ARG A 20 67.398 -40.306 17.959 1.00 15.22 C ATOM 286 CD ARG A 20 68.427 -39.214 18.210 1.00 75.11 C ATOM 287 NE ARG A 20 69.784 -39.747 18.288 1.00 31.33 N ATOM 288 CZ ARG A 20 70.872 -38.987 18.325 1.00 21.11 C ATOM 289 NH1 ARG A 20 70.762 -37.666 18.291 1.00 5.14 N ATOM 290 NH2 ARG A 20 72.073 -39.547 18.396 1.00 51.11 N ATOM 0 H ARG A 20 64.245 -38.160 18.845 1.00 53.00 H new ATOM 0 HA ARG A 20 66.389 -38.132 16.957 1.00 20.03 H new ATOM 0 HB2 ARG A 20 65.933 -39.442 19.257 1.00 40.51 H new ATOM 0 HB3 ARG A 20 65.297 -40.656 18.165 1.00 40.51 H new ATOM 0 HG2 ARG A 20 67.615 -41.165 18.594 1.00 15.22 H new ATOM 0 HG3 ARG A 20 67.471 -40.646 16.926 1.00 15.22 H new ATOM 0 HD2 ARG A 20 68.373 -38.475 17.411 1.00 75.11 H new ATOM 0 HD3 ARG A 20 68.187 -38.697 19.139 1.00 75.11 H new ATOM 0 HE ARG A 20 69.903 -40.760 18.316 1.00 31.33 H new ATOM 0 HH11 ARG A 20 69.840 -37.232 18.236 1.00 5.14 H new ATOM 0 HH12 ARG A 20 71.599 -37.084 18.320 1.00 5.14 H new ATOM 0 HH21 ARG A 20 72.161 -40.563 18.422 1.00 51.11 H new ATOM 0 HH22 ARG A 20 72.908 -38.962 18.424 1.00 51.11 H new ATOM 304 N GLY A 21 65.688 -39.626 15.037 1.00 24.25 N ATOM 305 CA GLY A 21 65.175 -40.219 13.816 1.00 31.31 C ATOM 306 C GLY A 21 66.246 -40.947 13.029 1.00 42.22 C ATOM 307 O GLY A 21 67.304 -41.275 13.565 1.00 1.04 O ATOM 0 H GLY A 21 66.695 -39.463 15.044 1.00 24.25 H new ATOM 0 HA2 GLY A 21 64.374 -40.916 14.063 1.00 31.31 H new ATOM 0 HA3 GLY A 21 64.738 -39.439 13.193 1.00 31.31 H new ATOM 311 N TYR A 22 65.971 -41.202 11.754 1.00 13.24 N ATOM 312 CA TYR A 22 66.918 -41.899 10.893 1.00 5.33 C ATOM 313 C TYR A 22 66.625 -41.619 9.423 1.00 41.32 C ATOM 314 O TYR A 22 67.532 -41.329 8.642 1.00 2.11 O ATOM 315 CB TYR A 22 66.867 -43.405 11.157 1.00 71.14 C ATOM 316 CG TYR A 22 67.838 -44.200 10.315 1.00 64.31 C ATOM 317 CD1 TYR A 22 69.193 -43.895 10.307 1.00 44.45 C ATOM 318 CD2 TYR A 22 67.401 -45.260 9.529 1.00 35.11 C ATOM 319 CE1 TYR A 22 70.085 -44.619 9.538 1.00 34.41 C ATOM 320 CE2 TYR A 22 68.285 -45.991 8.758 1.00 53.40 C ATOM 321 CZ TYR A 22 69.625 -45.666 8.766 1.00 13.22 C ATOM 322 OH TYR A 22 70.510 -46.390 8.000 1.00 73.01 O ATOM 0 H TYR A 22 65.100 -40.936 11.295 1.00 13.24 H new ATOM 0 HA TYR A 22 67.918 -41.531 11.122 1.00 5.33 H new ATOM 0 HB2 TYR A 22 67.078 -43.588 12.211 1.00 71.14 H new ATOM 0 HB3 TYR A 22 65.856 -43.765 10.967 1.00 71.14 H new ATOM 0 HD1 TYR A 22 69.556 -43.078 10.912 1.00 44.45 H new ATOM 0 HD2 TYR A 22 66.352 -45.517 9.521 1.00 35.11 H new ATOM 0 HE1 TYR A 22 71.135 -44.367 9.541 1.00 34.41 H new ATOM 0 HE2 TYR A 22 67.928 -46.812 8.153 1.00 53.40 H new ATOM 0 HH TYR A 22 70.026 -47.092 7.517 1.00 73.01 H new ATOM 332 N MET A 23 65.352 -41.707 9.052 1.00 2.24 N ATOM 333 CA MET A 23 64.939 -41.462 7.675 1.00 34.23 C ATOM 334 C MET A 23 65.473 -40.122 7.178 1.00 74.42 C ATOM 335 O MET A 23 65.584 -39.165 7.943 1.00 13.23 O ATOM 336 CB MET A 23 63.413 -41.488 7.566 1.00 30.34 C ATOM 337 CG MET A 23 62.713 -40.672 8.641 1.00 31.43 C ATOM 338 SD MET A 23 60.936 -40.540 8.366 1.00 64.34 S ATOM 339 CE MET A 23 60.387 -39.954 9.967 1.00 42.34 C ATOM 0 H MET A 23 64.589 -41.946 9.685 1.00 2.24 H new ATOM 0 HA MET A 23 65.354 -42.253 7.051 1.00 34.23 H new ATOM 0 HB2 MET A 23 63.120 -41.110 6.586 1.00 30.34 H new ATOM 0 HB3 MET A 23 63.070 -42.521 7.625 1.00 30.34 H new ATOM 0 HG2 MET A 23 62.893 -41.129 9.614 1.00 31.43 H new ATOM 0 HG3 MET A 23 63.147 -39.673 8.673 1.00 31.43 H new ATOM 0 HE1 MET A 23 59.305 -39.823 9.955 1.00 42.34 H new ATOM 0 HE2 MET A 23 60.656 -40.682 10.733 1.00 42.34 H new ATOM 0 HE3 MET A 23 60.865 -39.000 10.189 1.00 42.34 H new ATOM 349 N GLY A 24 65.801 -40.062 5.891 1.00 52.31 N ATOM 350 CA GLY A 24 66.319 -38.835 5.315 1.00 15.13 C ATOM 351 C GLY A 24 67.817 -38.886 5.093 1.00 13.44 C ATOM 352 O GLY A 24 68.399 -39.965 4.973 1.00 64.13 O ATOM 0 H GLY A 24 65.717 -40.841 5.237 1.00 52.31 H new ATOM 0 HA2 GLY A 24 65.820 -38.645 4.365 1.00 15.13 H new ATOM 0 HA3 GLY A 24 66.081 -37.999 5.973 1.00 15.13 H new ATOM 356 N THR A 25 68.447 -37.716 5.037 1.00 33.15 N ATOM 357 CA THR A 25 69.886 -37.631 4.826 1.00 23.54 C ATOM 358 C THR A 25 70.599 -37.140 6.081 1.00 62.42 C ATOM 359 O THR A 25 70.134 -36.216 6.748 1.00 1.32 O ATOM 360 CB THR A 25 70.228 -36.691 3.655 1.00 71.21 C ATOM 361 OG1 THR A 25 69.908 -37.324 2.410 1.00 54.53 O ATOM 362 CG2 THR A 25 71.701 -36.314 3.675 1.00 0.12 C ATOM 0 H THR A 25 67.982 -36.814 5.135 1.00 33.15 H new ATOM 0 HA THR A 25 70.229 -38.638 4.587 1.00 23.54 H new ATOM 0 HB THR A 25 69.636 -35.782 3.763 1.00 71.21 H new ATOM 0 HG1 THR A 25 70.725 -37.688 2.009 1.00 54.53 H new ATOM 0 HG21 THR A 25 71.918 -35.650 2.838 1.00 0.12 H new ATOM 0 HG22 THR A 25 71.934 -35.807 4.611 1.00 0.12 H new ATOM 0 HG23 THR A 25 72.308 -37.215 3.590 1.00 0.12 H new ATOM 370 N SER A 26 71.729 -37.764 6.396 1.00 14.31 N ATOM 371 CA SER A 26 72.504 -37.391 7.574 1.00 42.01 C ATOM 372 C SER A 26 73.207 -36.053 7.361 1.00 31.15 C ATOM 373 O SER A 26 73.989 -35.893 6.426 1.00 50.25 O ATOM 374 CB SER A 26 73.535 -38.476 7.895 1.00 34.14 C ATOM 375 OG SER A 26 73.175 -39.712 7.304 1.00 4.40 O ATOM 0 H SER A 26 72.128 -38.529 5.853 1.00 14.31 H new ATOM 0 HA SER A 26 71.817 -37.291 8.414 1.00 42.01 H new ATOM 0 HB2 SER A 26 74.516 -38.168 7.533 1.00 34.14 H new ATOM 0 HB3 SER A 26 73.617 -38.596 8.975 1.00 34.14 H new ATOM 0 HG SER A 26 73.850 -40.388 7.522 1.00 4.40 H new ATOM 381 N ALA A 27 72.920 -35.097 8.238 1.00 11.34 N ATOM 382 CA ALA A 27 73.525 -33.774 8.149 1.00 13.33 C ATOM 383 C ALA A 27 73.843 -33.221 9.534 1.00 13.43 C ATOM 384 O ALA A 27 73.317 -33.697 10.541 1.00 42.21 O ATOM 385 CB ALA A 27 72.605 -32.822 7.398 1.00 0.23 C ATOM 0 H ALA A 27 72.273 -35.214 9.018 1.00 11.34 H new ATOM 0 HA ALA A 27 74.462 -33.867 7.599 1.00 13.33 H new ATOM 0 HB1 ALA A 27 73.070 -31.838 7.339 1.00 0.23 H new ATOM 0 HB2 ALA A 27 72.431 -33.202 6.391 1.00 0.23 H new ATOM 0 HB3 ALA A 27 71.654 -32.743 7.925 1.00 0.23 H new ATOM 391 N THR A 28 74.709 -32.213 9.580 1.00 2.32 N ATOM 392 CA THR A 28 75.100 -31.596 10.841 1.00 34.52 C ATOM 393 C THR A 28 74.957 -30.080 10.780 1.00 74.44 C ATOM 394 O THR A 28 75.902 -29.372 10.431 1.00 62.43 O ATOM 395 CB THR A 28 76.551 -31.949 11.214 1.00 61.40 C ATOM 396 OG1 THR A 28 76.635 -33.322 11.612 1.00 32.13 O ATOM 397 CG2 THR A 28 77.053 -31.058 12.340 1.00 23.52 C ATOM 0 H THR A 28 75.153 -31.806 8.757 1.00 2.32 H new ATOM 0 HA THR A 28 74.431 -31.990 11.605 1.00 34.52 H new ATOM 0 HB THR A 28 77.177 -31.787 10.337 1.00 61.40 H new ATOM 0 HG1 THR A 28 77.562 -33.539 11.846 1.00 32.13 H new ATOM 0 HG21 THR A 28 78.080 -31.326 12.586 1.00 23.52 H new ATOM 0 HG22 THR A 28 77.016 -30.016 12.023 1.00 23.52 H new ATOM 0 HG23 THR A 28 76.423 -31.192 13.219 1.00 23.52 H new ATOM 405 N ILE A 29 73.771 -29.588 11.122 1.00 54.33 N ATOM 406 CA ILE A 29 73.507 -28.153 11.107 1.00 62.53 C ATOM 407 C ILE A 29 74.656 -27.376 11.740 1.00 35.41 C ATOM 408 O ILE A 29 75.113 -27.705 12.836 1.00 74.45 O ATOM 409 CB ILE A 29 72.201 -27.814 11.848 1.00 31.12 C ATOM 410 CG1 ILE A 29 71.984 -28.782 13.014 1.00 21.41 C ATOM 411 CG2 ILE A 29 71.020 -27.859 10.890 1.00 74.05 C ATOM 412 CD1 ILE A 29 70.818 -28.408 13.900 1.00 15.05 C ATOM 0 H ILE A 29 72.978 -30.160 11.413 1.00 54.33 H new ATOM 0 HA ILE A 29 73.408 -27.861 10.062 1.00 62.53 H new ATOM 0 HB ILE A 29 72.281 -26.803 12.248 1.00 31.12 H new ATOM 0 HG12 ILE A 29 71.822 -29.785 12.618 1.00 21.41 H new ATOM 0 HG13 ILE A 29 72.891 -28.820 13.618 1.00 21.41 H new ATOM 0 HG21 ILE A 29 70.104 -27.617 11.430 1.00 74.05 H new ATOM 0 HG22 ILE A 29 71.172 -27.134 10.090 1.00 74.05 H new ATOM 0 HG23 ILE A 29 70.936 -28.858 10.463 1.00 74.05 H new ATOM 0 HD11 ILE A 29 70.724 -29.137 14.704 1.00 15.05 H new ATOM 0 HD12 ILE A 29 70.987 -27.419 14.325 1.00 15.05 H new ATOM 0 HD13 ILE A 29 69.901 -28.398 13.310 1.00 15.05 H new ATOM 424 N THR A 30 75.117 -26.342 11.045 1.00 45.42 N ATOM 425 CA THR A 30 76.212 -25.516 11.539 1.00 61.51 C ATOM 426 C THR A 30 76.141 -24.107 10.963 1.00 0.42 C ATOM 427 O THR A 30 76.584 -23.862 9.841 1.00 53.13 O ATOM 428 CB THR A 30 77.581 -26.132 11.193 1.00 71.12 C ATOM 429 OG1 THR A 30 77.574 -27.534 11.481 1.00 23.14 O ATOM 430 CG2 THR A 30 78.693 -25.453 11.976 1.00 0.50 C ATOM 0 H THR A 30 74.749 -26.056 10.138 1.00 45.42 H new ATOM 0 HA THR A 30 76.107 -25.468 12.623 1.00 61.51 H new ATOM 0 HB THR A 30 77.764 -25.982 10.129 1.00 71.12 H new ATOM 0 HG1 THR A 30 76.930 -27.985 10.896 1.00 23.14 H new ATOM 0 HG21 THR A 30 79.650 -25.905 11.715 1.00 0.50 H new ATOM 0 HG22 THR A 30 78.714 -24.391 11.731 1.00 0.50 H new ATOM 0 HG23 THR A 30 78.513 -25.576 13.044 1.00 0.50 H new ATOM 438 N SER A 31 75.582 -23.183 11.738 1.00 35.32 N ATOM 439 CA SER A 31 75.450 -21.798 11.304 1.00 53.54 C ATOM 440 C SER A 31 75.795 -20.837 12.437 1.00 3.42 C ATOM 441 O SER A 31 74.921 -20.171 12.991 1.00 61.13 O ATOM 442 CB SER A 31 74.027 -21.529 10.808 1.00 44.32 C ATOM 443 OG SER A 31 73.096 -21.594 11.874 1.00 63.20 O ATOM 0 H SER A 31 75.213 -23.369 12.671 1.00 35.32 H new ATOM 0 HA SER A 31 76.150 -21.633 10.485 1.00 53.54 H new ATOM 0 HB2 SER A 31 73.981 -20.546 10.340 1.00 44.32 H new ATOM 0 HB3 SER A 31 73.761 -22.259 10.043 1.00 44.32 H new ATOM 0 HG SER A 31 73.366 -20.973 12.582 1.00 63.20 H new ATOM 449 N GLY A 32 77.079 -20.771 12.779 1.00 22.44 N ATOM 450 CA GLY A 32 77.519 -19.891 13.845 1.00 55.20 C ATOM 451 C GLY A 32 79.019 -19.939 14.055 1.00 34.12 C ATOM 452 O GLY A 32 79.697 -20.822 13.530 1.00 33.00 O ATOM 0 H GLY A 32 77.822 -21.312 12.336 1.00 22.44 H new ATOM 0 HA2 GLY A 32 77.220 -18.868 13.614 1.00 55.20 H new ATOM 0 HA3 GLY A 32 77.017 -20.169 14.772 1.00 55.20 H new ATOM 456 N GLU A 33 79.538 -18.988 14.825 1.00 54.41 N ATOM 457 CA GLU A 33 80.969 -18.925 15.102 1.00 62.54 C ATOM 458 C GLU A 33 81.495 -20.284 15.554 1.00 61.01 C ATOM 459 O GLU A 33 82.686 -20.570 15.435 1.00 30.14 O ATOM 460 CB GLU A 33 81.259 -17.872 16.172 1.00 20.15 C ATOM 461 CG GLU A 33 80.396 -18.015 17.415 1.00 3.44 C ATOM 462 CD GLU A 33 81.038 -17.397 18.644 1.00 71.22 C ATOM 463 OE1 GLU A 33 81.169 -16.156 18.683 1.00 70.43 O ATOM 464 OE2 GLU A 33 81.408 -18.154 19.564 1.00 32.54 O ATOM 0 H GLU A 33 78.990 -18.251 15.268 1.00 54.41 H new ATOM 0 HA GLU A 33 81.479 -18.645 14.181 1.00 62.54 H new ATOM 0 HB2 GLU A 33 82.309 -17.937 16.459 1.00 20.15 H new ATOM 0 HB3 GLU A 33 81.106 -16.881 15.745 1.00 20.15 H new ATOM 0 HG2 GLU A 33 79.429 -17.543 17.238 1.00 3.44 H new ATOM 0 HG3 GLU A 33 80.206 -19.072 17.601 1.00 3.44 H new ATOM 471 N GLN A 34 80.599 -21.118 16.072 1.00 54.44 N ATOM 472 CA GLN A 34 80.973 -22.445 16.543 1.00 34.23 C ATOM 473 C GLN A 34 79.741 -23.241 16.964 1.00 41.31 C ATOM 474 O GLN A 34 79.280 -23.135 18.100 1.00 75.22 O ATOM 475 CB GLN A 34 81.949 -22.338 17.715 1.00 13.41 C ATOM 476 CG GLN A 34 83.290 -23.004 17.454 1.00 63.23 C ATOM 477 CD GLN A 34 84.431 -22.331 18.192 1.00 34.43 C ATOM 478 OE1 GLN A 34 84.954 -22.867 19.169 1.00 23.04 O ATOM 479 NE2 GLN A 34 84.821 -21.150 17.728 1.00 4.33 N ATOM 0 H GLN A 34 79.609 -20.897 16.176 1.00 54.44 H new ATOM 0 HA GLN A 34 81.460 -22.970 15.721 1.00 34.23 H new ATOM 0 HB2 GLN A 34 82.114 -21.285 17.944 1.00 13.41 H new ATOM 0 HB3 GLN A 34 81.495 -22.789 18.597 1.00 13.41 H new ATOM 0 HG2 GLN A 34 83.236 -24.051 17.754 1.00 63.23 H new ATOM 0 HG3 GLN A 34 83.496 -22.989 16.384 1.00 63.23 H new ATOM 0 HE21 GLN A 34 84.358 -20.743 16.915 1.00 4.33 H new ATOM 0 HE22 GLN A 34 85.583 -20.649 18.185 1.00 4.33 H new ATOM 488 N SER A 35 79.214 -24.037 16.040 1.00 62.33 N ATOM 489 CA SER A 35 78.033 -24.848 16.314 1.00 43.14 C ATOM 490 C SER A 35 78.114 -26.187 15.587 1.00 72.51 C ATOM 491 O SER A 35 78.934 -26.371 14.689 1.00 23.41 O ATOM 492 CB SER A 35 76.766 -24.101 15.891 1.00 63.41 C ATOM 493 OG SER A 35 76.306 -23.251 16.926 1.00 53.45 O ATOM 0 H SER A 35 79.585 -24.138 15.095 1.00 62.33 H new ATOM 0 HA SER A 35 77.993 -25.038 17.387 1.00 43.14 H new ATOM 0 HB2 SER A 35 76.969 -23.513 14.996 1.00 63.41 H new ATOM 0 HB3 SER A 35 75.987 -24.818 15.632 1.00 63.41 H new ATOM 0 HG SER A 35 77.051 -23.029 17.522 1.00 53.45 H new ATOM 499 N GLY A 36 77.254 -27.121 15.983 1.00 35.24 N ATOM 500 CA GLY A 36 77.243 -28.432 15.361 1.00 10.30 C ATOM 501 C GLY A 36 76.214 -29.358 15.978 1.00 75.41 C ATOM 502 O GLY A 36 76.520 -30.110 16.902 1.00 2.33 O ATOM 0 H GLY A 36 76.565 -26.993 16.724 1.00 35.24 H new ATOM 0 HA2 GLY A 36 77.037 -28.324 14.296 1.00 10.30 H new ATOM 0 HA3 GLY A 36 78.232 -28.882 15.451 1.00 10.30 H new ATOM 506 N ALA A 37 74.988 -29.304 15.466 1.00 41.34 N ATOM 507 CA ALA A 37 73.911 -30.144 15.972 1.00 30.20 C ATOM 508 C ALA A 37 73.543 -31.229 14.966 1.00 74.42 C ATOM 509 O ALA A 37 74.215 -31.403 13.950 1.00 12.31 O ATOM 510 CB ALA A 37 72.693 -29.296 16.306 1.00 32.14 C ATOM 0 H ALA A 37 74.717 -28.687 14.701 1.00 41.34 H new ATOM 0 HA ALA A 37 74.261 -30.632 16.882 1.00 30.20 H new ATOM 0 HB1 ALA A 37 71.896 -29.937 16.683 1.00 32.14 H new ATOM 0 HB2 ALA A 37 72.958 -28.562 17.066 1.00 32.14 H new ATOM 0 HB3 ALA A 37 72.351 -28.781 15.408 1.00 32.14 H new ATOM 516 N VAL A 38 72.469 -31.958 15.255 1.00 72.34 N ATOM 517 CA VAL A 38 72.010 -33.027 14.375 1.00 43.35 C ATOM 518 C VAL A 38 70.877 -32.548 13.473 1.00 4.52 C ATOM 519 O VAL A 38 69.846 -32.076 13.953 1.00 61.24 O ATOM 520 CB VAL A 38 71.529 -34.249 15.179 1.00 1.50 C ATOM 521 CG1 VAL A 38 70.495 -33.833 16.215 1.00 62.21 C ATOM 522 CG2 VAL A 38 70.966 -35.311 14.247 1.00 32.43 C ATOM 0 H VAL A 38 71.901 -31.828 16.092 1.00 72.34 H new ATOM 0 HA VAL A 38 72.862 -33.318 13.761 1.00 43.35 H new ATOM 0 HB VAL A 38 72.383 -34.676 15.705 1.00 1.50 H new ATOM 0 HG11 VAL A 38 70.167 -34.709 16.774 1.00 62.21 H new ATOM 0 HG12 VAL A 38 70.937 -33.110 16.901 1.00 62.21 H new ATOM 0 HG13 VAL A 38 69.639 -33.381 15.714 1.00 62.21 H new ATOM 0 HG21 VAL A 38 70.631 -36.168 14.832 1.00 32.43 H new ATOM 0 HG22 VAL A 38 70.123 -34.898 13.692 1.00 32.43 H new ATOM 0 HG23 VAL A 38 71.740 -35.629 13.548 1.00 32.43 H new ATOM 532 N ILE A 39 71.077 -32.673 12.166 1.00 42.30 N ATOM 533 CA ILE A 39 70.072 -32.255 11.197 1.00 55.54 C ATOM 534 C ILE A 39 69.951 -33.263 10.060 1.00 33.53 C ATOM 535 O ILE A 39 70.920 -33.933 9.705 1.00 24.11 O ATOM 536 CB ILE A 39 70.401 -30.870 10.607 1.00 63.11 C ATOM 537 CG1 ILE A 39 69.231 -30.361 9.761 1.00 0.54 C ATOM 538 CG2 ILE A 39 71.673 -30.938 9.774 1.00 20.10 C ATOM 539 CD1 ILE A 39 69.443 -30.528 8.274 1.00 65.31 C ATOM 0 H ILE A 39 71.926 -33.060 11.754 1.00 42.30 H new ATOM 0 HA ILE A 39 69.124 -32.198 11.731 1.00 55.54 H new ATOM 0 HB ILE A 39 70.563 -30.171 11.427 1.00 63.11 H new ATOM 0 HG12 ILE A 39 68.325 -30.892 10.052 1.00 0.54 H new ATOM 0 HG13 ILE A 39 69.067 -29.306 9.980 1.00 0.54 H new ATOM 0 HG21 ILE A 39 71.892 -29.952 9.364 1.00 20.10 H new ATOM 0 HG22 ILE A 39 72.502 -31.263 10.402 1.00 20.10 H new ATOM 0 HG23 ILE A 39 71.536 -31.648 8.958 1.00 20.10 H new ATOM 0 HD11 ILE A 39 68.574 -30.146 7.737 1.00 65.31 H new ATOM 0 HD12 ILE A 39 70.331 -29.974 7.969 1.00 65.31 H new ATOM 0 HD13 ILE A 39 69.577 -31.585 8.042 1.00 65.31 H new ATOM 551 N ARG A 40 68.753 -33.365 9.492 1.00 31.12 N ATOM 552 CA ARG A 40 68.504 -34.292 8.395 1.00 3.21 C ATOM 553 C ARG A 40 68.305 -33.540 7.082 1.00 13.44 C ATOM 554 O ARG A 40 67.176 -33.333 6.640 1.00 44.24 O ATOM 555 CB ARG A 40 67.276 -35.153 8.694 1.00 33.22 C ATOM 556 CG ARG A 40 67.423 -36.014 9.938 1.00 1.12 C ATOM 557 CD ARG A 40 66.234 -36.944 10.116 1.00 64.13 C ATOM 558 NE ARG A 40 65.472 -36.634 11.323 1.00 23.23 N ATOM 559 CZ ARG A 40 65.835 -37.022 12.540 1.00 33.23 C ATOM 560 NH1 ARG A 40 66.943 -37.731 12.712 1.00 72.43 N ATOM 561 NH2 ARG A 40 65.089 -36.701 13.590 1.00 12.32 N ATOM 0 H ARG A 40 67.940 -32.817 9.774 1.00 31.12 H new ATOM 0 HA ARG A 40 69.376 -34.939 8.295 1.00 3.21 H new ATOM 0 HB2 ARG A 40 66.408 -34.504 8.812 1.00 33.22 H new ATOM 0 HB3 ARG A 40 67.078 -35.798 7.838 1.00 33.22 H new ATOM 0 HG2 ARG A 40 68.339 -36.602 9.869 1.00 1.12 H new ATOM 0 HG3 ARG A 40 67.520 -35.374 10.815 1.00 1.12 H new ATOM 0 HD2 ARG A 40 65.582 -36.869 9.246 1.00 64.13 H new ATOM 0 HD3 ARG A 40 66.584 -37.975 10.163 1.00 64.13 H new ATOM 0 HE ARG A 40 64.615 -36.090 11.226 1.00 23.23 H new ATOM 0 HH11 ARG A 40 67.519 -37.980 11.908 1.00 72.43 H new ATOM 0 HH12 ARG A 40 67.219 -38.027 13.648 1.00 72.43 H new ATOM 0 HH21 ARG A 40 64.236 -36.156 13.462 1.00 12.32 H new ATOM 0 HH22 ARG A 40 65.368 -36.999 14.524 1.00 12.32 H new ATOM 575 N GLY A 41 69.409 -33.133 6.465 1.00 4.45 N ATOM 576 CA GLY A 41 69.335 -32.408 5.211 1.00 70.23 C ATOM 577 C GLY A 41 70.214 -33.014 4.136 1.00 4.33 C ATOM 578 O GLY A 41 71.263 -33.588 4.433 1.00 25.23 O ATOM 0 H GLY A 41 70.355 -33.293 6.812 1.00 4.45 H new ATOM 0 HA2 GLY A 41 68.302 -32.393 4.865 1.00 70.23 H new ATOM 0 HA3 GLY A 41 69.631 -31.372 5.376 1.00 70.23 H new ATOM 582 N VAL A 42 69.788 -32.890 2.883 1.00 23.32 N ATOM 583 CA VAL A 42 70.545 -33.431 1.761 1.00 63.31 C ATOM 584 C VAL A 42 70.786 -32.367 0.696 1.00 53.23 C ATOM 585 O VAL A 42 69.897 -31.576 0.382 1.00 41.24 O ATOM 586 CB VAL A 42 69.819 -34.628 1.119 1.00 32.31 C ATOM 587 CG1 VAL A 42 68.708 -34.147 0.197 1.00 31.33 C ATOM 588 CG2 VAL A 42 70.805 -35.508 0.365 1.00 72.44 C ATOM 0 H VAL A 42 68.922 -32.419 2.620 1.00 23.32 H new ATOM 0 HA VAL A 42 71.503 -33.767 2.159 1.00 63.31 H new ATOM 0 HB VAL A 42 69.368 -35.224 1.912 1.00 32.31 H new ATOM 0 HG11 VAL A 42 68.206 -35.007 -0.247 1.00 31.33 H new ATOM 0 HG12 VAL A 42 67.988 -33.562 0.769 1.00 31.33 H new ATOM 0 HG13 VAL A 42 69.133 -33.527 -0.592 1.00 31.33 H new ATOM 0 HG21 VAL A 42 70.274 -36.349 -0.082 1.00 72.44 H new ATOM 0 HG22 VAL A 42 71.287 -34.925 -0.419 1.00 72.44 H new ATOM 0 HG23 VAL A 42 71.561 -35.882 1.056 1.00 72.44 H new ATOM 598 N PHE A 43 71.995 -32.354 0.143 1.00 31.13 N ATOM 599 CA PHE A 43 72.353 -31.386 -0.887 1.00 0.32 C ATOM 600 C PHE A 43 72.231 -32.001 -2.277 1.00 41.30 C ATOM 601 O PHE A 43 72.770 -33.075 -2.542 1.00 41.10 O ATOM 602 CB PHE A 43 73.780 -30.878 -0.665 1.00 21.52 C ATOM 603 CG PHE A 43 74.822 -31.692 -1.377 1.00 3.43 C ATOM 604 CD1 PHE A 43 75.173 -32.951 -0.916 1.00 52.44 C ATOM 605 CD2 PHE A 43 75.453 -31.197 -2.508 1.00 20.54 C ATOM 606 CE1 PHE A 43 76.133 -33.701 -1.570 1.00 34.42 C ATOM 607 CE2 PHE A 43 76.411 -31.944 -3.166 1.00 4.44 C ATOM 608 CZ PHE A 43 76.753 -33.197 -2.695 1.00 61.14 C ATOM 0 H PHE A 43 72.742 -33.002 0.391 1.00 31.13 H new ATOM 0 HA PHE A 43 71.661 -30.547 -0.818 1.00 0.32 H new ATOM 0 HB2 PHE A 43 73.846 -29.843 -1.002 1.00 21.52 H new ATOM 0 HB3 PHE A 43 73.996 -30.880 0.403 1.00 21.52 H new ATOM 0 HD1 PHE A 43 74.691 -33.351 -0.036 1.00 52.44 H new ATOM 0 HD2 PHE A 43 75.193 -30.217 -2.879 1.00 20.54 H new ATOM 0 HE1 PHE A 43 76.397 -34.681 -1.201 1.00 34.42 H new ATOM 0 HE2 PHE A 43 76.892 -31.549 -4.048 1.00 4.44 H new ATOM 0 HZ PHE A 43 77.504 -33.781 -3.206 1.00 61.14 H new ATOM 618 N ASP A 44 71.517 -31.312 -3.161 1.00 21.24 N ATOM 619 CA ASP A 44 71.323 -31.790 -4.526 1.00 11.41 C ATOM 620 C ASP A 44 72.133 -30.955 -5.513 1.00 5.22 C ATOM 621 O ASP A 44 71.993 -29.733 -5.570 1.00 4.33 O ATOM 622 CB ASP A 44 69.841 -31.746 -4.898 1.00 54.12 C ATOM 623 CG ASP A 44 69.339 -33.072 -5.433 1.00 74.43 C ATOM 624 OD1 ASP A 44 69.792 -34.123 -4.934 1.00 43.11 O ATOM 625 OD2 ASP A 44 68.493 -33.060 -6.353 1.00 30.03 O ATOM 0 H ASP A 44 71.063 -30.421 -2.957 1.00 21.24 H new ATOM 0 HA ASP A 44 71.672 -32.821 -4.577 1.00 11.41 H new ATOM 0 HB2 ASP A 44 69.257 -31.467 -4.021 1.00 54.12 H new ATOM 0 HB3 ASP A 44 69.680 -30.971 -5.647 1.00 54.12 H new ATOM 630 N ASP A 45 72.980 -31.624 -6.288 1.00 50.24 N ATOM 631 CA ASP A 45 73.813 -30.944 -7.274 1.00 22.11 C ATOM 632 C ASP A 45 73.525 -31.464 -8.680 1.00 15.44 C ATOM 633 O ASP A 45 73.913 -32.571 -9.050 1.00 2.32 O ATOM 634 CB ASP A 45 75.293 -31.135 -6.940 1.00 42.32 C ATOM 635 CG ASP A 45 76.085 -29.847 -7.065 1.00 61.42 C ATOM 636 OD1 ASP A 45 75.984 -29.189 -8.122 1.00 1.31 O ATOM 637 OD2 ASP A 45 76.805 -29.499 -6.106 1.00 61.33 O ATOM 0 H ASP A 45 73.108 -32.635 -6.253 1.00 50.24 H new ATOM 0 HA ASP A 45 73.575 -29.881 -7.243 1.00 22.11 H new ATOM 0 HB2 ASP A 45 75.387 -31.519 -5.924 1.00 42.32 H new ATOM 0 HB3 ASP A 45 75.719 -31.886 -7.605 1.00 42.32 H new ATOM 642 N PRO A 46 72.825 -30.645 -9.481 1.00 4.22 N ATOM 643 CA PRO A 46 72.470 -31.001 -10.857 1.00 74.44 C ATOM 644 C PRO A 46 73.682 -31.030 -11.781 1.00 75.44 C ATOM 645 O PRO A 46 73.815 -31.923 -12.617 1.00 22.22 O ATOM 646 CB PRO A 46 71.506 -29.886 -11.274 1.00 23.02 C ATOM 647 CG PRO A 46 71.875 -28.728 -10.413 1.00 55.01 C ATOM 648 CD PRO A 46 72.330 -29.311 -9.105 1.00 4.34 C ATOM 0 HA PRO A 46 72.041 -32.001 -10.921 1.00 74.44 H new ATOM 0 HB2 PRO A 46 71.614 -29.644 -12.331 1.00 23.02 H new ATOM 0 HB3 PRO A 46 70.468 -30.181 -11.119 1.00 23.02 H new ATOM 0 HG2 PRO A 46 72.667 -28.137 -10.873 1.00 55.01 H new ATOM 0 HG3 PRO A 46 71.024 -28.063 -10.268 1.00 55.01 H new ATOM 0 HD2 PRO A 46 73.112 -28.707 -8.646 1.00 4.34 H new ATOM 0 HD3 PRO A 46 71.513 -29.373 -8.387 1.00 4.34 H new ATOM 656 N GLU A 47 74.564 -30.048 -11.624 1.00 60.23 N ATOM 657 CA GLU A 47 75.765 -29.962 -12.445 1.00 40.11 C ATOM 658 C GLU A 47 76.926 -29.371 -11.651 1.00 24.01 C ATOM 659 O GLU A 47 77.125 -28.158 -11.633 1.00 3.34 O ATOM 660 CB GLU A 47 75.500 -29.112 -13.689 1.00 63.34 C ATOM 661 CG GLU A 47 75.060 -29.921 -14.898 1.00 23.32 C ATOM 662 CD GLU A 47 74.385 -29.071 -15.956 1.00 51.20 C ATOM 663 OE1 GLU A 47 74.548 -27.833 -15.917 1.00 24.13 O ATOM 664 OE2 GLU A 47 73.693 -29.643 -16.824 1.00 22.10 O ATOM 0 H GLU A 47 74.469 -29.301 -10.936 1.00 60.23 H new ATOM 0 HA GLU A 47 76.035 -30.972 -12.754 1.00 40.11 H new ATOM 0 HB2 GLU A 47 74.732 -28.374 -13.457 1.00 63.34 H new ATOM 0 HB3 GLU A 47 76.406 -28.561 -13.942 1.00 63.34 H new ATOM 0 HG2 GLU A 47 75.928 -30.416 -15.334 1.00 23.32 H new ATOM 0 HG3 GLU A 47 74.375 -30.705 -14.576 1.00 23.32 H new ATOM 671 N ASN A 48 77.689 -30.240 -10.995 1.00 11.30 N ATOM 672 CA ASN A 48 78.830 -29.806 -10.198 1.00 11.33 C ATOM 673 C ASN A 48 79.882 -29.133 -11.075 1.00 0.12 C ATOM 674 O ASN A 48 80.675 -29.804 -11.736 1.00 75.24 O ATOM 675 CB ASN A 48 79.448 -30.996 -9.463 1.00 20.04 C ATOM 676 CG ASN A 48 80.042 -30.605 -8.124 1.00 14.41 C ATOM 677 OD1 ASN A 48 81.190 -30.165 -8.045 1.00 74.23 O ATOM 678 ND2 ASN A 48 79.261 -30.763 -7.061 1.00 63.32 N ATOM 0 H ASN A 48 77.537 -31.249 -11.000 1.00 11.30 H new ATOM 0 HA ASN A 48 78.475 -29.081 -9.466 1.00 11.33 H new ATOM 0 HB2 ASN A 48 78.686 -31.760 -9.310 1.00 20.04 H new ATOM 0 HB3 ASN A 48 80.224 -31.440 -10.086 1.00 20.04 H new ATOM 0 HD21 ASN A 48 79.606 -30.516 -6.133 1.00 63.32 H new ATOM 0 HD22 ASN A 48 78.316 -31.131 -7.172 1.00 63.32 H new ATOM 685 N ILE A 49 79.884 -27.804 -11.074 1.00 75.21 N ATOM 686 CA ILE A 49 80.838 -27.041 -11.867 1.00 4.35 C ATOM 687 C ILE A 49 81.178 -25.716 -11.193 1.00 61.05 C ATOM 688 O ILE A 49 80.662 -25.403 -10.121 1.00 54.35 O ATOM 689 CB ILE A 49 80.299 -26.762 -13.282 1.00 72.14 C ATOM 690 CG1 ILE A 49 78.955 -26.037 -13.205 1.00 73.43 C ATOM 691 CG2 ILE A 49 80.162 -28.061 -14.063 1.00 51.31 C ATOM 692 CD1 ILE A 49 78.721 -25.074 -14.348 1.00 71.23 C ATOM 0 H ILE A 49 79.235 -27.234 -10.532 1.00 75.21 H new ATOM 0 HA ILE A 49 81.740 -27.648 -11.945 1.00 4.35 H new ATOM 0 HB ILE A 49 81.008 -26.120 -13.805 1.00 72.14 H new ATOM 0 HG12 ILE A 49 78.153 -26.775 -13.193 1.00 73.43 H new ATOM 0 HG13 ILE A 49 78.899 -25.491 -12.263 1.00 73.43 H new ATOM 0 HG21 ILE A 49 79.780 -27.847 -15.061 1.00 51.31 H new ATOM 0 HG22 ILE A 49 81.137 -28.542 -14.143 1.00 51.31 H new ATOM 0 HG23 ILE A 49 79.471 -28.726 -13.545 1.00 51.31 H new ATOM 0 HD11 ILE A 49 77.749 -24.596 -14.228 1.00 71.23 H new ATOM 0 HD12 ILE A 49 79.502 -24.313 -14.348 1.00 71.23 H new ATOM 0 HD13 ILE A 49 78.744 -25.618 -15.292 1.00 71.23 H new ATOM 704 N SER A 50 82.047 -24.939 -11.833 1.00 2.04 N ATOM 705 CA SER A 50 82.457 -23.648 -11.294 1.00 44.42 C ATOM 706 C SER A 50 82.155 -22.526 -12.284 1.00 71.02 C ATOM 707 O SER A 50 82.077 -22.753 -13.492 1.00 11.35 O ATOM 708 CB SER A 50 83.951 -23.660 -10.963 1.00 2.03 C ATOM 709 OG SER A 50 84.369 -24.948 -10.543 1.00 55.42 O ATOM 0 H SER A 50 82.480 -25.181 -12.724 1.00 2.04 H new ATOM 0 HA SER A 50 81.891 -23.468 -10.380 1.00 44.42 H new ATOM 0 HB2 SER A 50 84.524 -23.356 -11.839 1.00 2.03 H new ATOM 0 HB3 SER A 50 84.159 -22.933 -10.178 1.00 2.03 H new ATOM 0 HG SER A 50 83.878 -25.204 -9.734 1.00 55.42 H new ATOM 715 N TYR A 51 81.984 -21.317 -11.762 1.00 41.24 N ATOM 716 CA TYR A 51 81.687 -20.159 -12.598 1.00 61.04 C ATOM 717 C TYR A 51 82.663 -19.020 -12.319 1.00 12.01 C ATOM 718 O TYR A 51 83.542 -18.729 -13.129 1.00 23.21 O ATOM 719 CB TYR A 51 80.252 -19.687 -12.360 1.00 74.12 C ATOM 720 CG TYR A 51 79.241 -20.326 -13.285 1.00 2.43 C ATOM 721 CD1 TYR A 51 79.160 -19.954 -14.621 1.00 34.34 C ATOM 722 CD2 TYR A 51 78.369 -21.305 -12.823 1.00 51.10 C ATOM 723 CE1 TYR A 51 78.238 -20.535 -15.470 1.00 30.32 C ATOM 724 CE2 TYR A 51 77.445 -21.893 -13.665 1.00 73.11 C ATOM 725 CZ TYR A 51 77.382 -21.504 -14.987 1.00 30.03 C ATOM 726 OH TYR A 51 76.464 -22.087 -15.829 1.00 55.23 O ATOM 0 H TYR A 51 82.046 -21.113 -10.765 1.00 41.24 H new ATOM 0 HA TYR A 51 81.796 -20.458 -13.641 1.00 61.04 H new ATOM 0 HB2 TYR A 51 79.974 -19.902 -11.328 1.00 74.12 H new ATOM 0 HB3 TYR A 51 80.210 -18.605 -12.482 1.00 74.12 H new ATOM 0 HD1 TYR A 51 79.830 -19.197 -15.003 1.00 34.34 H new ATOM 0 HD2 TYR A 51 78.415 -21.611 -11.788 1.00 51.10 H new ATOM 0 HE1 TYR A 51 78.187 -20.233 -16.506 1.00 30.32 H new ATOM 0 HE2 TYR A 51 76.776 -22.653 -13.290 1.00 73.11 H new ATOM 0 HH TYR A 51 75.940 -22.750 -15.333 1.00 55.23 H new ATOM 736 N ALA A 52 82.499 -18.380 -11.166 1.00 3.01 N ATOM 737 CA ALA A 52 83.367 -17.275 -10.777 1.00 31.02 C ATOM 738 C ALA A 52 84.836 -17.674 -10.861 1.00 75.21 C ATOM 739 O ALA A 52 85.162 -18.847 -11.034 1.00 63.43 O ATOM 740 CB ALA A 52 83.025 -16.806 -9.370 1.00 73.05 C ATOM 0 H ALA A 52 81.774 -18.607 -10.486 1.00 3.01 H new ATOM 0 HA ALA A 52 83.201 -16.453 -11.473 1.00 31.02 H new ATOM 0 HB1 ALA A 52 83.681 -15.981 -9.092 1.00 73.05 H new ATOM 0 HB2 ALA A 52 81.988 -16.472 -9.340 1.00 73.05 H new ATOM 0 HB3 ALA A 52 83.161 -17.629 -8.669 1.00 73.05 H new ATOM 746 N GLY A 53 85.720 -16.688 -10.738 1.00 1.01 N ATOM 747 CA GLY A 53 87.145 -16.958 -10.804 1.00 53.14 C ATOM 748 C GLY A 53 87.962 -15.951 -10.020 1.00 33.22 C ATOM 749 O GLY A 53 87.875 -15.893 -8.794 1.00 14.23 O ATOM 0 H GLY A 53 85.475 -15.708 -10.594 1.00 1.01 H new ATOM 0 HA2 GLY A 53 87.340 -17.959 -10.419 1.00 53.14 H new ATOM 0 HA3 GLY A 53 87.466 -16.949 -11.846 1.00 53.14 H new ATOM 753 N GLN A 54 88.759 -15.157 -10.727 1.00 45.14 N ATOM 754 CA GLN A 54 89.597 -14.149 -10.089 1.00 31.05 C ATOM 755 C GLN A 54 88.764 -13.236 -9.194 1.00 31.31 C ATOM 756 O GLN A 54 87.600 -12.962 -9.483 1.00 15.11 O ATOM 757 CB GLN A 54 90.329 -13.319 -11.145 1.00 32.41 C ATOM 758 CG GLN A 54 89.436 -12.315 -11.855 1.00 51.01 C ATOM 759 CD GLN A 54 88.333 -12.978 -12.656 1.00 11.03 C ATOM 760 OE1 GLN A 54 87.149 -12.715 -12.441 1.00 0.43 O ATOM 761 NE2 GLN A 54 88.716 -13.844 -13.586 1.00 41.45 N ATOM 0 H GLN A 54 88.842 -15.192 -11.743 1.00 45.14 H new ATOM 0 HA GLN A 54 90.332 -14.663 -9.470 1.00 31.05 H new ATOM 0 HB2 GLN A 54 91.154 -12.787 -10.670 1.00 32.41 H new ATOM 0 HB3 GLN A 54 90.766 -13.990 -11.884 1.00 32.41 H new ATOM 0 HG2 GLN A 54 88.992 -11.645 -11.119 1.00 51.01 H new ATOM 0 HG3 GLN A 54 90.043 -11.701 -12.520 1.00 51.01 H new ATOM 0 HE21 GLN A 54 89.708 -14.032 -13.730 1.00 41.45 H new ATOM 0 HE22 GLN A 54 88.018 -14.322 -14.156 1.00 41.45 H new ATOM 770 N GLY A 55 89.369 -12.769 -8.106 1.00 44.31 N ATOM 771 CA GLY A 55 88.668 -11.893 -7.186 1.00 51.45 C ATOM 772 C GLY A 55 87.722 -12.647 -6.274 1.00 11.32 C ATOM 773 O GLY A 55 87.856 -12.597 -5.051 1.00 22.41 O ATOM 0 H GLY A 55 90.332 -12.982 -7.846 1.00 44.31 H new ATOM 0 HA2 GLY A 55 89.395 -11.350 -6.582 1.00 51.45 H new ATOM 0 HA3 GLY A 55 88.106 -11.151 -7.753 1.00 51.45 H new ATOM 777 N VAL A 56 86.761 -13.347 -6.869 1.00 12.31 N ATOM 778 CA VAL A 56 85.787 -14.114 -6.101 1.00 11.34 C ATOM 779 C VAL A 56 86.480 -15.072 -5.137 1.00 40.04 C ATOM 780 O VAL A 56 87.561 -15.585 -5.425 1.00 70.22 O ATOM 781 CB VAL A 56 84.853 -14.919 -7.024 1.00 23.24 C ATOM 782 CG1 VAL A 56 83.783 -15.632 -6.211 1.00 43.22 C ATOM 783 CG2 VAL A 56 84.224 -14.010 -8.068 1.00 10.20 C ATOM 0 H VAL A 56 86.636 -13.399 -7.880 1.00 12.31 H new ATOM 0 HA VAL A 56 85.195 -13.396 -5.534 1.00 11.34 H new ATOM 0 HB VAL A 56 85.445 -15.674 -7.542 1.00 23.24 H new ATOM 0 HG11 VAL A 56 83.133 -16.195 -6.880 1.00 43.22 H new ATOM 0 HG12 VAL A 56 84.257 -16.315 -5.505 1.00 43.22 H new ATOM 0 HG13 VAL A 56 83.192 -14.898 -5.664 1.00 43.22 H new ATOM 0 HG21 VAL A 56 83.567 -14.595 -8.712 1.00 10.20 H new ATOM 0 HG22 VAL A 56 83.646 -13.231 -7.571 1.00 10.20 H new ATOM 0 HG23 VAL A 56 85.008 -13.551 -8.671 1.00 10.20 H new ATOM 793 N ARG A 57 85.849 -15.307 -3.992 1.00 14.34 N ATOM 794 CA ARG A 57 86.404 -16.202 -2.983 1.00 44.01 C ATOM 795 C ARG A 57 85.922 -17.634 -3.203 1.00 10.41 C ATOM 796 O ARG A 57 86.644 -18.592 -2.926 1.00 31.23 O ATOM 797 CB ARG A 57 86.014 -15.731 -1.581 1.00 40.34 C ATOM 798 CG ARG A 57 84.518 -15.546 -1.395 1.00 32.30 C ATOM 799 CD ARG A 57 84.176 -15.177 0.040 1.00 72.12 C ATOM 800 NE ARG A 57 82.916 -14.443 0.131 1.00 32.22 N ATOM 801 CZ ARG A 57 82.367 -14.067 1.280 1.00 32.42 C ATOM 802 NH1 ARG A 57 82.963 -14.353 2.430 1.00 61.35 N ATOM 803 NH2 ARG A 57 81.217 -13.403 1.282 1.00 42.15 N ATOM 0 H ARG A 57 84.953 -14.890 -3.739 1.00 14.34 H new ATOM 0 HA ARG A 57 87.490 -16.183 -3.075 1.00 44.01 H new ATOM 0 HB2 ARG A 57 86.376 -16.454 -0.850 1.00 40.34 H new ATOM 0 HB3 ARG A 57 86.517 -14.787 -1.371 1.00 40.34 H new ATOM 0 HG2 ARG A 57 84.160 -14.766 -2.067 1.00 32.30 H new ATOM 0 HG3 ARG A 57 84.000 -16.465 -1.669 1.00 32.30 H new ATOM 0 HD2 ARG A 57 84.112 -16.083 0.642 1.00 72.12 H new ATOM 0 HD3 ARG A 57 84.979 -14.572 0.460 1.00 72.12 H new ATOM 0 HE ARG A 57 82.432 -14.207 -0.735 1.00 32.22 H new ATOM 0 HH11 ARG A 57 83.846 -14.863 2.434 1.00 61.35 H new ATOM 0 HH12 ARG A 57 82.538 -14.062 3.311 1.00 61.35 H new ATOM 0 HH21 ARG A 57 80.755 -13.181 0.400 1.00 42.15 H new ATOM 0 HH22 ARG A 57 80.796 -13.115 2.165 1.00 42.15 H new ATOM 817 N VAL A 58 84.699 -17.771 -3.703 1.00 15.33 N ATOM 818 CA VAL A 58 84.120 -19.084 -3.960 1.00 51.22 C ATOM 819 C VAL A 58 83.254 -19.066 -5.215 1.00 33.44 C ATOM 820 O VAL A 58 82.502 -18.121 -5.447 1.00 72.12 O ATOM 821 CB VAL A 58 83.271 -19.566 -2.769 1.00 33.03 C ATOM 822 CG1 VAL A 58 82.787 -20.990 -3.001 1.00 55.13 C ATOM 823 CG2 VAL A 58 84.065 -19.468 -1.475 1.00 23.34 C ATOM 0 H VAL A 58 84.089 -16.988 -3.939 1.00 15.33 H new ATOM 0 HA VAL A 58 84.951 -19.774 -4.106 1.00 51.22 H new ATOM 0 HB VAL A 58 82.397 -18.920 -2.682 1.00 33.03 H new ATOM 0 HG11 VAL A 58 82.189 -21.314 -2.149 1.00 55.13 H new ATOM 0 HG12 VAL A 58 82.180 -21.025 -3.905 1.00 55.13 H new ATOM 0 HG13 VAL A 58 83.645 -21.652 -3.114 1.00 55.13 H new ATOM 0 HG21 VAL A 58 83.450 -19.813 -0.644 1.00 23.34 H new ATOM 0 HG22 VAL A 58 84.958 -20.089 -1.548 1.00 23.34 H new ATOM 0 HG23 VAL A 58 84.357 -18.432 -1.305 1.00 23.34 H new ATOM 833 N GLU A 59 83.365 -20.120 -6.018 1.00 55.12 N ATOM 834 CA GLU A 59 82.591 -20.224 -7.249 1.00 61.13 C ATOM 835 C GLU A 59 81.100 -20.059 -6.971 1.00 31.31 C ATOM 836 O GLU A 59 80.677 -19.985 -5.817 1.00 63.24 O ATOM 837 CB GLU A 59 82.848 -21.572 -7.926 1.00 60.03 C ATOM 838 CG GLU A 59 82.505 -22.767 -7.053 1.00 12.11 C ATOM 839 CD GLU A 59 83.274 -24.014 -7.442 1.00 21.14 C ATOM 840 OE1 GLU A 59 84.488 -24.075 -7.158 1.00 23.42 O ATOM 841 OE2 GLU A 59 82.660 -24.930 -8.030 1.00 44.12 O ATOM 0 H GLU A 59 83.982 -20.912 -5.838 1.00 55.12 H new ATOM 0 HA GLU A 59 82.909 -19.423 -7.916 1.00 61.13 H new ATOM 0 HB2 GLU A 59 82.264 -21.625 -8.845 1.00 60.03 H new ATOM 0 HB3 GLU A 59 83.898 -21.631 -8.212 1.00 60.03 H new ATOM 0 HG2 GLU A 59 82.717 -22.524 -6.012 1.00 12.11 H new ATOM 0 HG3 GLU A 59 81.436 -22.968 -7.122 1.00 12.11 H new ATOM 848 N GLY A 60 80.307 -20.002 -8.037 1.00 34.41 N ATOM 849 CA GLY A 60 78.872 -19.845 -7.886 1.00 20.44 C ATOM 850 C GLY A 60 78.127 -21.157 -8.032 1.00 21.33 C ATOM 851 O GLY A 60 77.904 -21.632 -9.145 1.00 23.44 O ATOM 0 H GLY A 60 80.633 -20.062 -9.002 1.00 34.41 H new ATOM 0 HA2 GLY A 60 78.658 -19.416 -6.907 1.00 20.44 H new ATOM 0 HA3 GLY A 60 78.506 -19.138 -8.631 1.00 20.44 H new ATOM 855 N SER A 61 77.742 -21.745 -6.904 1.00 13.04 N ATOM 856 CA SER A 61 77.022 -23.013 -6.910 1.00 64.52 C ATOM 857 C SER A 61 76.054 -23.095 -5.734 1.00 54.22 C ATOM 858 O SER A 61 76.430 -22.847 -4.588 1.00 31.10 O ATOM 859 CB SER A 61 78.008 -24.183 -6.856 1.00 71.54 C ATOM 860 OG SER A 61 79.166 -23.909 -7.623 1.00 44.41 O ATOM 0 H SER A 61 77.917 -21.364 -5.974 1.00 13.04 H new ATOM 0 HA SER A 61 76.448 -23.072 -7.835 1.00 64.52 H new ATOM 0 HB2 SER A 61 78.291 -24.377 -5.821 1.00 71.54 H new ATOM 0 HB3 SER A 61 77.526 -25.086 -7.229 1.00 71.54 H new ATOM 0 HG SER A 61 79.780 -24.671 -7.571 1.00 44.41 H new ATOM 866 N SER A 62 74.806 -23.444 -6.026 1.00 34.31 N ATOM 867 CA SER A 62 73.781 -23.554 -4.994 1.00 24.12 C ATOM 868 C SER A 62 72.930 -24.804 -5.205 1.00 40.13 C ATOM 869 O SER A 62 71.989 -24.818 -5.999 1.00 61.02 O ATOM 870 CB SER A 62 72.890 -22.312 -4.995 1.00 53.43 C ATOM 871 OG SER A 62 71.566 -22.632 -4.607 1.00 31.44 O ATOM 0 H SER A 62 74.479 -23.656 -6.969 1.00 34.31 H new ATOM 0 HA SER A 62 74.280 -23.633 -4.028 1.00 24.12 H new ATOM 0 HB2 SER A 62 73.301 -21.566 -4.315 1.00 53.43 H new ATOM 0 HB3 SER A 62 72.883 -21.867 -5.990 1.00 53.43 H new ATOM 0 HG SER A 62 71.548 -22.847 -3.651 1.00 31.44 H new ATOM 877 N PRO A 63 73.268 -25.878 -4.477 1.00 63.22 N ATOM 878 CA PRO A 63 72.547 -27.152 -4.566 1.00 1.44 C ATOM 879 C PRO A 63 71.146 -27.068 -3.972 1.00 22.51 C ATOM 880 O PRO A 63 70.680 -25.989 -3.606 1.00 22.15 O ATOM 881 CB PRO A 63 73.418 -28.110 -3.748 1.00 51.31 C ATOM 882 CG PRO A 63 74.149 -27.233 -2.791 1.00 73.12 C ATOM 883 CD PRO A 63 74.378 -25.932 -3.511 1.00 61.30 C ATOM 0 HA PRO A 63 72.399 -27.465 -5.600 1.00 1.44 H new ATOM 0 HB2 PRO A 63 72.811 -28.848 -3.224 1.00 51.31 H new ATOM 0 HB3 PRO A 63 74.108 -28.661 -4.387 1.00 51.31 H new ATOM 0 HG2 PRO A 63 73.568 -27.079 -1.882 1.00 73.12 H new ATOM 0 HG3 PRO A 63 75.095 -27.685 -2.492 1.00 73.12 H new ATOM 0 HD2 PRO A 63 74.357 -25.084 -2.826 1.00 61.30 H new ATOM 0 HD3 PRO A 63 75.347 -25.914 -4.010 1.00 61.30 H new ATOM 891 N SER A 64 70.478 -28.214 -3.879 1.00 40.34 N ATOM 892 CA SER A 64 69.127 -28.269 -3.332 1.00 43.10 C ATOM 893 C SER A 64 69.130 -28.889 -1.938 1.00 65.13 C ATOM 894 O SER A 64 69.955 -29.751 -1.631 1.00 52.55 O ATOM 895 CB SER A 64 68.212 -29.073 -4.258 1.00 1.25 C ATOM 896 OG SER A 64 67.042 -28.340 -4.581 1.00 24.54 O ATOM 0 H SER A 64 70.850 -29.116 -4.175 1.00 40.34 H new ATOM 0 HA SER A 64 68.750 -27.249 -3.256 1.00 43.10 H new ATOM 0 HB2 SER A 64 68.748 -29.329 -5.172 1.00 1.25 H new ATOM 0 HB3 SER A 64 67.936 -30.011 -3.777 1.00 1.25 H new ATOM 0 HG SER A 64 66.475 -28.875 -5.175 1.00 24.54 H new ATOM 902 N LEU A 65 68.203 -28.444 -1.098 1.00 31.42 N ATOM 903 CA LEU A 65 68.097 -28.953 0.265 1.00 21.53 C ATOM 904 C LEU A 65 66.785 -29.706 0.465 1.00 60.24 C ATOM 905 O LEU A 65 65.710 -29.197 0.143 1.00 11.44 O ATOM 906 CB LEU A 65 68.197 -27.804 1.269 1.00 23.04 C ATOM 907 CG LEU A 65 68.115 -28.195 2.746 1.00 75.01 C ATOM 908 CD1 LEU A 65 66.663 -28.342 3.178 1.00 44.25 C ATOM 909 CD2 LEU A 65 68.882 -29.483 3.001 1.00 4.32 C ATOM 0 H LEU A 65 67.513 -27.731 -1.337 1.00 31.42 H new ATOM 0 HA LEU A 65 68.921 -29.646 0.433 1.00 21.53 H new ATOM 0 HB2 LEU A 65 69.140 -27.284 1.103 1.00 23.04 H new ATOM 0 HB3 LEU A 65 67.399 -27.092 1.057 1.00 23.04 H new ATOM 0 HG LEU A 65 68.571 -27.402 3.338 1.00 75.01 H new ATOM 0 HD11 LEU A 65 66.623 -28.620 4.231 1.00 44.25 H new ATOM 0 HD12 LEU A 65 66.143 -27.395 3.033 1.00 44.25 H new ATOM 0 HD13 LEU A 65 66.182 -29.116 2.580 1.00 44.25 H new ATOM 0 HD21 LEU A 65 68.812 -29.745 4.057 1.00 4.32 H new ATOM 0 HD22 LEU A 65 68.456 -30.286 2.399 1.00 4.32 H new ATOM 0 HD23 LEU A 65 69.929 -29.343 2.730 1.00 4.32 H new ATOM 921 N PHE A 66 66.879 -30.919 0.998 1.00 10.11 N ATOM 922 CA PHE A 66 65.700 -31.741 1.242 1.00 54.34 C ATOM 923 C PHE A 66 65.555 -32.057 2.728 1.00 15.41 C ATOM 924 O PHE A 66 66.292 -32.878 3.275 1.00 44.22 O ATOM 925 CB PHE A 66 65.782 -33.040 0.438 1.00 0.24 C ATOM 926 CG PHE A 66 64.458 -33.495 -0.103 1.00 72.03 C ATOM 927 CD1 PHE A 66 63.634 -34.320 0.645 1.00 74.21 C ATOM 928 CD2 PHE A 66 64.035 -33.097 -1.363 1.00 1.24 C ATOM 929 CE1 PHE A 66 62.414 -34.740 0.150 1.00 72.11 C ATOM 930 CE2 PHE A 66 62.817 -33.514 -1.863 1.00 60.23 C ATOM 931 CZ PHE A 66 62.006 -34.337 -1.107 1.00 34.54 C ATOM 0 H PHE A 66 67.760 -31.355 1.270 1.00 10.11 H new ATOM 0 HA PHE A 66 64.823 -31.178 0.921 1.00 54.34 H new ATOM 0 HB2 PHE A 66 66.476 -32.901 -0.391 1.00 0.24 H new ATOM 0 HB3 PHE A 66 66.195 -33.825 1.072 1.00 0.24 H new ATOM 0 HD1 PHE A 66 63.949 -34.639 1.628 1.00 74.21 H new ATOM 0 HD2 PHE A 66 64.665 -32.454 -1.959 1.00 1.24 H new ATOM 0 HE1 PHE A 66 61.781 -35.382 0.744 1.00 72.11 H new ATOM 0 HE2 PHE A 66 62.499 -33.196 -2.845 1.00 60.23 H new ATOM 0 HZ PHE A 66 61.054 -34.665 -1.498 1.00 34.54 H new ATOM 941 N VAL A 67 64.600 -31.399 3.376 1.00 14.44 N ATOM 942 CA VAL A 67 64.357 -31.608 4.800 1.00 43.13 C ATOM 943 C VAL A 67 62.865 -31.597 5.110 1.00 74.04 C ATOM 944 O VAL A 67 62.043 -31.290 4.246 1.00 73.24 O ATOM 945 CB VAL A 67 65.056 -30.534 5.653 1.00 42.54 C ATOM 946 CG1 VAL A 67 66.562 -30.575 5.435 1.00 54.13 C ATOM 947 CG2 VAL A 67 64.501 -29.155 5.332 1.00 14.43 C ATOM 0 H VAL A 67 63.981 -30.716 2.939 1.00 14.44 H new ATOM 0 HA VAL A 67 64.770 -32.585 5.051 1.00 43.13 H new ATOM 0 HB VAL A 67 64.859 -30.745 6.704 1.00 42.54 H new ATOM 0 HG11 VAL A 67 67.039 -29.809 6.046 1.00 54.13 H new ATOM 0 HG12 VAL A 67 66.944 -31.556 5.719 1.00 54.13 H new ATOM 0 HG13 VAL A 67 66.783 -30.390 4.384 1.00 54.13 H new ATOM 0 HG21 VAL A 67 65.006 -28.408 5.944 1.00 14.43 H new ATOM 0 HG22 VAL A 67 64.666 -28.933 4.278 1.00 14.43 H new ATOM 0 HG23 VAL A 67 63.432 -29.135 5.544 1.00 14.43 H new ATOM 957 N ARG A 68 62.521 -31.931 6.349 1.00 24.34 N ATOM 958 CA ARG A 68 61.126 -31.960 6.774 1.00 10.21 C ATOM 959 C ARG A 68 60.827 -30.813 7.734 1.00 0.52 C ATOM 960 O ARG A 68 61.671 -30.430 8.546 1.00 64.14 O ATOM 961 CB ARG A 68 60.802 -33.297 7.443 1.00 41.13 C ATOM 962 CG ARG A 68 60.810 -33.236 8.961 1.00 21.22 C ATOM 963 CD ARG A 68 60.502 -34.593 9.575 1.00 14.02 C ATOM 964 NE ARG A 68 61.373 -35.641 9.051 1.00 22.24 N ATOM 965 CZ ARG A 68 61.061 -36.401 8.008 1.00 64.40 C ATOM 966 NH1 ARG A 68 59.906 -36.231 7.380 1.00 41.15 N ATOM 967 NH2 ARG A 68 61.906 -37.335 7.590 1.00 21.03 N ATOM 0 H ARG A 68 63.189 -32.185 7.077 1.00 24.34 H new ATOM 0 HA ARG A 68 60.500 -31.843 5.889 1.00 10.21 H new ATOM 0 HB2 ARG A 68 59.821 -33.634 7.107 1.00 41.13 H new ATOM 0 HB3 ARG A 68 61.525 -34.043 7.114 1.00 41.13 H new ATOM 0 HG2 ARG A 68 61.784 -32.892 9.307 1.00 21.22 H new ATOM 0 HG3 ARG A 68 60.075 -32.506 9.301 1.00 21.22 H new ATOM 0 HD2 ARG A 68 60.615 -34.535 10.658 1.00 14.02 H new ATOM 0 HD3 ARG A 68 59.462 -34.853 9.377 1.00 14.02 H new ATOM 0 HE ARG A 68 62.270 -35.798 9.511 1.00 22.24 H new ATOM 0 HH11 ARG A 68 59.253 -35.514 7.698 1.00 41.15 H new ATOM 0 HH12 ARG A 68 59.670 -36.817 6.579 1.00 41.15 H new ATOM 0 HH21 ARG A 68 62.796 -37.469 8.070 1.00 21.03 H new ATOM 0 HH22 ARG A 68 61.666 -37.918 6.789 1.00 21.03 H new ATOM 981 N THR A 69 59.619 -30.266 7.637 1.00 52.21 N ATOM 982 CA THR A 69 59.209 -29.162 8.495 1.00 73.14 C ATOM 983 C THR A 69 59.749 -29.334 9.910 1.00 42.05 C ATOM 984 O THR A 69 60.451 -28.466 10.427 1.00 54.54 O ATOM 985 CB THR A 69 57.674 -29.036 8.554 1.00 24.05 C ATOM 986 OG1 THR A 69 57.283 -28.395 9.772 1.00 15.25 O ATOM 987 CG2 THR A 69 57.016 -30.405 8.462 1.00 45.04 C ATOM 0 H THR A 69 58.908 -30.570 6.972 1.00 52.21 H new ATOM 0 HA THR A 69 59.624 -28.253 8.060 1.00 73.14 H new ATOM 0 HB THR A 69 57.347 -28.435 7.706 1.00 24.05 H new ATOM 0 HG1 THR A 69 56.307 -28.317 9.802 1.00 15.25 H new ATOM 0 HG21 THR A 69 55.933 -30.292 8.506 1.00 45.04 H new ATOM 0 HG22 THR A 69 57.294 -30.880 7.521 1.00 45.04 H new ATOM 0 HG23 THR A 69 57.350 -31.026 9.294 1.00 45.04 H new ATOM 995 N ASP A 70 59.418 -30.461 10.530 1.00 21.41 N ATOM 996 CA ASP A 70 59.871 -30.749 11.885 1.00 14.54 C ATOM 997 C ASP A 70 61.348 -30.404 12.049 1.00 11.14 C ATOM 998 O ASP A 70 61.714 -29.578 12.886 1.00 70.21 O ATOM 999 CB ASP A 70 59.639 -32.223 12.223 1.00 42.32 C ATOM 1000 CG ASP A 70 60.394 -32.659 13.462 1.00 35.21 C ATOM 1001 OD1 ASP A 70 59.930 -32.348 14.580 1.00 4.32 O ATOM 1002 OD2 ASP A 70 61.447 -33.313 13.316 1.00 2.34 O ATOM 0 H ASP A 70 58.837 -31.190 10.115 1.00 21.41 H new ATOM 0 HA ASP A 70 59.293 -30.132 12.573 1.00 14.54 H new ATOM 0 HB2 ASP A 70 58.573 -32.395 12.372 1.00 42.32 H new ATOM 0 HB3 ASP A 70 59.947 -32.839 11.378 1.00 42.32 H new ATOM 1007 N GLU A 71 62.193 -31.043 11.246 1.00 51.33 N ATOM 1008 CA GLU A 71 63.630 -30.804 11.303 1.00 22.41 C ATOM 1009 C GLU A 71 63.950 -29.338 11.025 1.00 61.53 C ATOM 1010 O GLU A 71 64.797 -28.739 11.688 1.00 60.35 O ATOM 1011 CB GLU A 71 64.358 -31.697 10.296 1.00 41.10 C ATOM 1012 CG GLU A 71 65.399 -32.605 10.930 1.00 44.22 C ATOM 1013 CD GLU A 71 66.321 -31.864 11.879 1.00 74.22 C ATOM 1014 OE1 GLU A 71 66.570 -30.662 11.647 1.00 3.00 O ATOM 1015 OE2 GLU A 71 66.791 -32.486 12.855 1.00 53.24 O ATOM 0 H GLU A 71 61.907 -31.730 10.548 1.00 51.33 H new ATOM 0 HA GLU A 71 63.973 -31.048 12.308 1.00 22.41 H new ATOM 0 HB2 GLU A 71 63.626 -32.309 9.770 1.00 41.10 H new ATOM 0 HB3 GLU A 71 64.843 -31.068 9.549 1.00 41.10 H new ATOM 0 HG2 GLU A 71 64.895 -33.406 11.471 1.00 44.22 H new ATOM 0 HG3 GLU A 71 65.993 -33.074 10.145 1.00 44.22 H new ATOM 1022 N VAL A 72 63.267 -28.767 10.038 1.00 61.42 N ATOM 1023 CA VAL A 72 63.478 -27.372 9.670 1.00 72.42 C ATOM 1024 C VAL A 72 62.679 -26.439 10.575 1.00 64.12 C ATOM 1025 O VAL A 72 62.663 -25.225 10.372 1.00 13.22 O ATOM 1026 CB VAL A 72 63.080 -27.111 8.205 1.00 71.21 C ATOM 1027 CG1 VAL A 72 61.636 -26.644 8.118 1.00 54.21 C ATOM 1028 CG2 VAL A 72 64.018 -26.094 7.573 1.00 74.13 C ATOM 0 H VAL A 72 62.563 -29.249 9.479 1.00 61.42 H new ATOM 0 HA VAL A 72 64.542 -27.170 9.791 1.00 72.42 H new ATOM 0 HB VAL A 72 63.167 -28.046 7.651 1.00 71.21 H new ATOM 0 HG11 VAL A 72 61.374 -26.465 7.075 1.00 54.21 H new ATOM 0 HG12 VAL A 72 60.980 -27.411 8.531 1.00 54.21 H new ATOM 0 HG13 VAL A 72 61.517 -25.721 8.686 1.00 54.21 H new ATOM 0 HG21 VAL A 72 63.723 -25.921 6.538 1.00 74.13 H new ATOM 0 HG22 VAL A 72 63.965 -25.157 8.127 1.00 74.13 H new ATOM 0 HG23 VAL A 72 65.039 -26.475 7.600 1.00 74.13 H new ATOM 1038 N ARG A 73 62.019 -27.015 11.574 1.00 4.01 N ATOM 1039 CA ARG A 73 61.218 -26.235 12.510 1.00 70.50 C ATOM 1040 C ARG A 73 61.996 -25.961 13.794 1.00 44.23 C ATOM 1041 O ARG A 73 61.899 -24.877 14.369 1.00 1.01 O ATOM 1042 CB ARG A 73 59.917 -26.972 12.838 1.00 42.24 C ATOM 1043 CG ARG A 73 59.023 -26.223 13.812 1.00 75.14 C ATOM 1044 CD ARG A 73 58.202 -27.180 14.663 1.00 70.01 C ATOM 1045 NE ARG A 73 57.567 -26.503 15.790 1.00 13.22 N ATOM 1046 CZ ARG A 73 56.539 -27.005 16.465 1.00 61.53 C ATOM 1047 NH1 ARG A 73 56.032 -28.183 16.128 1.00 43.12 N ATOM 1048 NH2 ARG A 73 56.016 -26.329 17.479 1.00 35.00 N ATOM 0 H ARG A 73 62.023 -28.019 11.756 1.00 4.01 H new ATOM 0 HA ARG A 73 60.980 -25.282 12.039 1.00 70.50 H new ATOM 0 HB2 ARG A 73 59.366 -27.148 11.914 1.00 42.24 H new ATOM 0 HB3 ARG A 73 60.158 -27.949 13.257 1.00 42.24 H new ATOM 0 HG2 ARG A 73 59.634 -25.593 14.458 1.00 75.14 H new ATOM 0 HG3 ARG A 73 58.356 -25.561 13.260 1.00 75.14 H new ATOM 0 HD2 ARG A 73 57.437 -27.650 14.045 1.00 70.01 H new ATOM 0 HD3 ARG A 73 58.845 -27.977 15.035 1.00 70.01 H new ATOM 0 HE ARG A 73 57.933 -25.594 16.075 1.00 13.22 H new ATOM 0 HH11 ARG A 73 56.431 -28.706 15.349 1.00 43.12 H new ATOM 0 HH12 ARG A 73 55.243 -28.566 16.648 1.00 43.12 H new ATOM 0 HH21 ARG A 73 56.403 -25.423 17.741 1.00 35.00 H new ATOM 0 HH22 ARG A 73 55.227 -26.716 17.997 1.00 35.00 H new ATOM 1062 N GLN A 74 62.768 -26.949 14.236 1.00 74.40 N ATOM 1063 CA GLN A 74 63.561 -26.813 15.451 1.00 30.32 C ATOM 1064 C GLN A 74 64.645 -25.755 15.279 1.00 23.31 C ATOM 1065 O GLN A 74 65.272 -25.330 16.249 1.00 74.12 O ATOM 1066 CB GLN A 74 64.195 -28.155 15.824 1.00 74.12 C ATOM 1067 CG GLN A 74 63.182 -29.223 16.201 1.00 32.53 C ATOM 1068 CD GLN A 74 63.787 -30.612 16.245 1.00 2.23 C ATOM 1069 OE1 GLN A 74 64.450 -30.983 17.215 1.00 13.12 O ATOM 1070 NE2 GLN A 74 63.562 -31.390 15.193 1.00 3.31 N ATOM 0 H GLN A 74 62.861 -27.852 13.771 1.00 74.40 H new ATOM 0 HA GLN A 74 62.896 -26.497 16.255 1.00 30.32 H new ATOM 0 HB2 GLN A 74 64.791 -28.512 14.984 1.00 74.12 H new ATOM 0 HB3 GLN A 74 64.879 -28.004 16.659 1.00 74.12 H new ATOM 0 HG2 GLN A 74 62.755 -28.986 17.176 1.00 32.53 H new ATOM 0 HG3 GLN A 74 62.362 -29.211 15.483 1.00 32.53 H new ATOM 0 HE21 GLN A 74 63.007 -31.042 14.411 1.00 3.31 H new ATOM 0 HE22 GLN A 74 63.944 -32.335 15.167 1.00 3.31 H new ATOM 1079 N LEU A 75 64.861 -25.334 14.037 1.00 24.24 N ATOM 1080 CA LEU A 75 65.871 -24.325 13.737 1.00 70.11 C ATOM 1081 C LEU A 75 65.219 -22.996 13.368 1.00 13.15 C ATOM 1082 O LEU A 75 63.999 -22.848 13.449 1.00 3.52 O ATOM 1083 CB LEU A 75 66.769 -24.800 12.593 1.00 41.22 C ATOM 1084 CG LEU A 75 67.723 -25.949 12.921 1.00 30.40 C ATOM 1085 CD1 LEU A 75 67.185 -27.262 12.373 1.00 44.21 C ATOM 1086 CD2 LEU A 75 69.111 -25.665 12.367 1.00 41.05 C ATOM 0 H LEU A 75 64.351 -25.675 13.222 1.00 24.24 H new ATOM 0 HA LEU A 75 66.478 -24.176 14.630 1.00 70.11 H new ATOM 0 HB2 LEU A 75 66.133 -25.108 11.763 1.00 41.22 H new ATOM 0 HB3 LEU A 75 67.359 -23.952 12.245 1.00 41.22 H new ATOM 0 HG LEU A 75 67.798 -26.036 14.005 1.00 30.40 H new ATOM 0 HD11 LEU A 75 67.877 -28.068 12.616 1.00 44.21 H new ATOM 0 HD12 LEU A 75 66.213 -27.471 12.819 1.00 44.21 H new ATOM 0 HD13 LEU A 75 67.079 -27.188 11.291 1.00 44.21 H new ATOM 0 HD21 LEU A 75 69.776 -26.493 12.610 1.00 41.05 H new ATOM 0 HD22 LEU A 75 69.054 -25.551 11.284 1.00 41.05 H new ATOM 0 HD23 LEU A 75 69.498 -24.747 12.809 1.00 41.05 H new ATOM 1098 N ARG A 76 66.040 -22.033 12.964 1.00 41.25 N ATOM 1099 CA ARG A 76 65.544 -20.717 12.582 1.00 55.12 C ATOM 1100 C ARG A 76 65.857 -20.420 11.119 1.00 63.24 C ATOM 1101 O ARG A 76 66.807 -20.964 10.554 1.00 55.21 O ATOM 1102 CB ARG A 76 66.160 -19.637 13.475 1.00 71.31 C ATOM 1103 CG ARG A 76 67.590 -19.283 13.103 1.00 12.42 C ATOM 1104 CD ARG A 76 68.172 -18.245 14.051 1.00 74.40 C ATOM 1105 NE ARG A 76 68.846 -18.861 15.191 1.00 75.34 N ATOM 1106 CZ ARG A 76 69.468 -18.169 16.138 1.00 52.32 C ATOM 1107 NH1 ARG A 76 69.502 -16.844 16.082 1.00 5.14 N ATOM 1108 NH2 ARG A 76 70.058 -18.802 17.144 1.00 42.13 N ATOM 0 H ARG A 76 67.052 -22.139 12.893 1.00 41.25 H new ATOM 0 HA ARG A 76 64.462 -20.714 12.712 1.00 55.12 H new ATOM 0 HB2 ARG A 76 65.546 -18.738 13.420 1.00 71.31 H new ATOM 0 HB3 ARG A 76 66.136 -19.976 14.511 1.00 71.31 H new ATOM 0 HG2 ARG A 76 68.206 -20.182 13.124 1.00 12.42 H new ATOM 0 HG3 ARG A 76 67.618 -18.901 12.082 1.00 12.42 H new ATOM 0 HD2 ARG A 76 68.878 -17.615 13.510 1.00 74.40 H new ATOM 0 HD3 ARG A 76 67.375 -17.594 14.410 1.00 74.40 H new ATOM 0 HE ARG A 76 68.838 -19.878 15.263 1.00 75.34 H new ATOM 0 HH11 ARG A 76 69.050 -16.354 15.310 1.00 5.14 H new ATOM 0 HH12 ARG A 76 69.981 -16.315 16.811 1.00 5.14 H new ATOM 0 HH21 ARG A 76 70.034 -19.821 17.190 1.00 42.13 H new ATOM 0 HH22 ARG A 76 70.536 -18.270 17.871 1.00 42.13 H new ATOM 1122 N ARG A 77 65.051 -19.556 10.509 1.00 1.15 N ATOM 1123 CA ARG A 77 65.242 -19.189 9.110 1.00 32.45 C ATOM 1124 C ARG A 77 66.682 -18.759 8.853 1.00 64.21 C ATOM 1125 O ARG A 77 67.242 -17.953 9.594 1.00 1.05 O ATOM 1126 CB ARG A 77 64.284 -18.061 8.723 1.00 70.03 C ATOM 1127 CG ARG A 77 64.697 -16.700 9.257 1.00 1.14 C ATOM 1128 CD ARG A 77 63.488 -15.848 9.607 1.00 15.11 C ATOM 1129 NE ARG A 77 63.668 -14.454 9.212 1.00 51.35 N ATOM 1130 CZ ARG A 77 62.803 -13.489 9.505 1.00 2.21 C ATOM 1131 NH1 ARG A 77 61.704 -13.766 10.193 1.00 10.11 N ATOM 1132 NH2 ARG A 77 63.037 -12.244 9.109 1.00 33.44 N ATOM 0 H ARG A 77 64.260 -19.097 10.961 1.00 1.15 H new ATOM 0 HA ARG A 77 65.028 -20.065 8.497 1.00 32.45 H new ATOM 0 HB2 ARG A 77 64.217 -18.010 7.636 1.00 70.03 H new ATOM 0 HB3 ARG A 77 63.287 -18.300 9.093 1.00 70.03 H new ATOM 0 HG2 ARG A 77 65.321 -16.829 10.142 1.00 1.14 H new ATOM 0 HG3 ARG A 77 65.303 -16.185 8.512 1.00 1.14 H new ATOM 0 HD2 ARG A 77 62.604 -16.253 9.114 1.00 15.11 H new ATOM 0 HD3 ARG A 77 63.306 -15.900 10.681 1.00 15.11 H new ATOM 0 HE ARG A 77 64.504 -14.207 8.682 1.00 51.35 H new ATOM 0 HH11 ARG A 77 61.521 -14.722 10.499 1.00 10.11 H new ATOM 0 HH12 ARG A 77 61.042 -13.023 10.417 1.00 10.11 H new ATOM 0 HH21 ARG A 77 63.881 -12.027 8.579 1.00 33.44 H new ATOM 0 HH22 ARG A 77 62.372 -11.504 9.334 1.00 33.44 H new ATOM 1146 N GLY A 78 67.277 -19.305 7.796 1.00 52.33 N ATOM 1147 CA GLY A 78 68.648 -18.965 7.458 1.00 33.25 C ATOM 1148 C GLY A 78 69.655 -19.833 8.187 1.00 54.51 C ATOM 1149 O GLY A 78 70.667 -19.337 8.684 1.00 60.23 O ATOM 0 H GLY A 78 66.835 -19.976 7.168 1.00 52.33 H new ATOM 0 HA2 GLY A 78 68.791 -19.072 6.383 1.00 33.25 H new ATOM 0 HA3 GLY A 78 68.831 -17.918 7.702 1.00 33.25 H new ATOM 1153 N ASP A 79 69.378 -21.131 8.252 1.00 55.22 N ATOM 1154 CA ASP A 79 70.267 -22.068 8.926 1.00 24.23 C ATOM 1155 C ASP A 79 71.078 -22.872 7.913 1.00 13.40 C ATOM 1156 O ASP A 79 70.537 -23.709 7.192 1.00 70.15 O ATOM 1157 CB ASP A 79 69.464 -23.015 9.819 1.00 74.01 C ATOM 1158 CG ASP A 79 69.647 -22.714 11.294 1.00 61.41 C ATOM 1159 OD1 ASP A 79 70.721 -23.046 11.837 1.00 31.21 O ATOM 1160 OD2 ASP A 79 68.716 -22.149 11.904 1.00 32.12 O ATOM 0 H ASP A 79 68.545 -21.557 7.846 1.00 55.22 H new ATOM 0 HA ASP A 79 70.956 -21.494 9.545 1.00 24.23 H new ATOM 0 HB2 ASP A 79 68.407 -22.941 9.564 1.00 74.01 H new ATOM 0 HB3 ASP A 79 69.768 -24.043 9.620 1.00 74.01 H new ATOM 1165 N THR A 80 72.381 -22.609 7.865 1.00 62.12 N ATOM 1166 CA THR A 80 73.267 -23.305 6.940 1.00 52.15 C ATOM 1167 C THR A 80 73.813 -24.585 7.558 1.00 32.25 C ATOM 1168 O THR A 80 74.647 -24.543 8.463 1.00 11.44 O ATOM 1169 CB THR A 80 74.446 -22.411 6.511 1.00 34.04 C ATOM 1170 OG1 THR A 80 75.538 -23.222 6.064 1.00 52.43 O ATOM 1171 CG2 THR A 80 74.902 -21.529 7.665 1.00 45.02 C ATOM 0 H THR A 80 72.845 -21.919 8.456 1.00 62.12 H new ATOM 0 HA THR A 80 72.672 -23.555 6.062 1.00 52.15 H new ATOM 0 HB THR A 80 74.111 -21.771 5.694 1.00 34.04 H new ATOM 0 HG1 THR A 80 75.960 -22.802 5.286 1.00 52.43 H new ATOM 0 HG21 THR A 80 75.735 -20.906 7.340 1.00 45.02 H new ATOM 0 HG22 THR A 80 74.077 -20.893 7.985 1.00 45.02 H new ATOM 0 HG23 THR A 80 75.221 -22.156 8.498 1.00 45.02 H new ATOM 1179 N LEU A 81 73.338 -25.724 7.067 1.00 30.54 N ATOM 1180 CA LEU A 81 73.779 -27.019 7.572 1.00 5.13 C ATOM 1181 C LEU A 81 74.857 -27.616 6.673 1.00 1.24 C ATOM 1182 O LEU A 81 74.739 -27.600 5.448 1.00 71.21 O ATOM 1183 CB LEU A 81 72.594 -27.981 7.673 1.00 63.02 C ATOM 1184 CG LEU A 81 71.530 -27.851 6.583 1.00 33.51 C ATOM 1185 CD1 LEU A 81 70.683 -26.609 6.809 1.00 71.11 C ATOM 1186 CD2 LEU A 81 72.178 -27.814 5.207 1.00 52.11 C ATOM 0 H LEU A 81 72.647 -25.777 6.319 1.00 30.54 H new ATOM 0 HA LEU A 81 74.202 -26.868 8.565 1.00 5.13 H new ATOM 0 HB2 LEU A 81 72.978 -29.001 7.659 1.00 63.02 H new ATOM 0 HB3 LEU A 81 72.114 -27.834 8.641 1.00 63.02 H new ATOM 0 HG LEU A 81 70.878 -28.723 6.632 1.00 33.51 H new ATOM 0 HD11 LEU A 81 69.931 -26.533 6.023 1.00 71.11 H new ATOM 0 HD12 LEU A 81 70.189 -26.677 7.778 1.00 71.11 H new ATOM 0 HD13 LEU A 81 71.320 -25.725 6.788 1.00 71.11 H new ATOM 0 HD21 LEU A 81 71.406 -27.721 4.443 1.00 52.11 H new ATOM 0 HD22 LEU A 81 72.853 -26.961 5.146 1.00 52.11 H new ATOM 0 HD23 LEU A 81 72.740 -28.734 5.045 1.00 52.11 H new ATOM 1198 N THR A 82 75.910 -28.144 7.290 1.00 30.34 N ATOM 1199 CA THR A 82 77.009 -28.747 6.547 1.00 62.14 C ATOM 1200 C THR A 82 76.808 -30.250 6.391 1.00 52.30 C ATOM 1201 O THR A 82 77.054 -31.018 7.321 1.00 31.25 O ATOM 1202 CB THR A 82 78.362 -28.491 7.237 1.00 50.12 C ATOM 1203 OG1 THR A 82 79.417 -29.108 6.492 1.00 40.13 O ATOM 1204 CG2 THR A 82 78.355 -29.030 8.659 1.00 63.40 C ATOM 0 H THR A 82 76.024 -28.166 8.303 1.00 30.34 H new ATOM 0 HA THR A 82 77.018 -28.280 5.562 1.00 62.14 H new ATOM 0 HB THR A 82 78.527 -27.414 7.275 1.00 50.12 H new ATOM 0 HG1 THR A 82 80.274 -28.939 6.937 1.00 40.13 H new ATOM 0 HG21 THR A 82 79.321 -28.838 9.126 1.00 63.40 H new ATOM 0 HG22 THR A 82 77.570 -28.536 9.232 1.00 63.40 H new ATOM 0 HG23 THR A 82 78.169 -30.104 8.640 1.00 63.40 H new ATOM 1212 N ILE A 83 76.360 -30.663 5.210 1.00 62.21 N ATOM 1213 CA ILE A 83 76.129 -32.075 4.932 1.00 75.01 C ATOM 1214 C ILE A 83 76.662 -32.460 3.557 1.00 23.34 C ATOM 1215 O ILE A 83 76.391 -31.788 2.564 1.00 51.24 O ATOM 1216 CB ILE A 83 74.630 -32.425 5.006 1.00 70.12 C ATOM 1217 CG1 ILE A 83 74.181 -33.111 3.713 1.00 35.04 C ATOM 1218 CG2 ILE A 83 73.806 -31.172 5.260 1.00 71.40 C ATOM 1219 CD1 ILE A 83 73.743 -32.144 2.636 1.00 1.22 C ATOM 0 H ILE A 83 76.150 -30.040 4.430 1.00 62.21 H new ATOM 0 HA ILE A 83 76.664 -32.638 5.696 1.00 75.01 H new ATOM 0 HB ILE A 83 74.473 -33.114 5.836 1.00 70.12 H new ATOM 0 HG12 ILE A 83 75.000 -33.720 3.331 1.00 35.04 H new ATOM 0 HG13 ILE A 83 73.358 -33.789 3.938 1.00 35.04 H new ATOM 0 HG21 ILE A 83 72.749 -31.435 5.310 1.00 71.40 H new ATOM 0 HG22 ILE A 83 74.112 -30.720 6.204 1.00 71.40 H new ATOM 0 HG23 ILE A 83 73.965 -30.461 4.449 1.00 71.40 H new ATOM 0 HD11 ILE A 83 73.439 -32.700 1.749 1.00 1.22 H new ATOM 0 HD12 ILE A 83 72.903 -31.552 2.999 1.00 1.22 H new ATOM 0 HD13 ILE A 83 74.571 -31.482 2.383 1.00 1.22 H new ATOM 1231 N GLY A 84 77.424 -33.549 3.507 1.00 60.32 N ATOM 1232 CA GLY A 84 77.983 -34.007 2.249 1.00 61.24 C ATOM 1233 C GLY A 84 79.116 -33.125 1.762 1.00 33.22 C ATOM 1234 O GLY A 84 80.216 -33.608 1.498 1.00 64.14 O ATOM 0 H GLY A 84 77.664 -34.122 4.316 1.00 60.32 H new ATOM 0 HA2 GLY A 84 78.346 -35.028 2.367 1.00 61.24 H new ATOM 0 HA3 GLY A 84 77.197 -34.034 1.494 1.00 61.24 H new ATOM 1238 N GLU A 85 78.846 -31.828 1.645 1.00 64.40 N ATOM 1239 CA GLU A 85 79.852 -30.878 1.185 1.00 1.15 C ATOM 1240 C GLU A 85 80.234 -29.909 2.299 1.00 13.53 C ATOM 1241 O GLU A 85 81.257 -30.080 2.961 1.00 2.11 O ATOM 1242 CB GLU A 85 79.335 -30.102 -0.027 1.00 53.44 C ATOM 1243 CG GLU A 85 79.693 -30.741 -1.358 1.00 22.30 C ATOM 1244 CD GLU A 85 81.186 -30.748 -1.619 1.00 41.21 C ATOM 1245 OE1 GLU A 85 81.924 -30.086 -0.860 1.00 53.13 O ATOM 1246 OE2 GLU A 85 81.618 -31.414 -2.583 1.00 22.54 O ATOM 0 H GLU A 85 77.940 -31.412 1.862 1.00 64.40 H new ATOM 0 HA GLU A 85 80.740 -31.439 0.896 1.00 1.15 H new ATOM 0 HB2 GLU A 85 78.251 -30.014 0.044 1.00 53.44 H new ATOM 0 HB3 GLU A 85 79.739 -29.090 0.001 1.00 53.44 H new ATOM 0 HG2 GLU A 85 79.320 -31.765 -1.377 1.00 22.30 H new ATOM 0 HG3 GLU A 85 79.190 -30.203 -2.162 1.00 22.30 H new ATOM 1253 N GLU A 86 79.403 -28.889 2.500 1.00 5.24 N ATOM 1254 CA GLU A 86 79.656 -27.893 3.533 1.00 51.45 C ATOM 1255 C GLU A 86 78.353 -27.241 3.989 1.00 51.33 C ATOM 1256 O GLU A 86 77.341 -27.298 3.293 1.00 64.42 O ATOM 1257 CB GLU A 86 80.620 -26.823 3.016 1.00 43.40 C ATOM 1258 CG GLU A 86 82.025 -27.342 2.763 1.00 3.30 C ATOM 1259 CD GLU A 86 82.978 -26.250 2.314 1.00 25.34 C ATOM 1260 OE1 GLU A 86 82.496 -25.196 1.850 1.00 33.24 O ATOM 1261 OE2 GLU A 86 84.206 -26.452 2.426 1.00 52.41 O ATOM 0 H GLU A 86 78.551 -28.732 1.961 1.00 5.24 H new ATOM 0 HA GLU A 86 80.109 -28.398 4.386 1.00 51.45 H new ATOM 0 HB2 GLU A 86 80.224 -26.405 2.090 1.00 43.40 H new ATOM 0 HB3 GLU A 86 80.667 -26.008 3.739 1.00 43.40 H new ATOM 0 HG2 GLU A 86 82.408 -27.802 3.674 1.00 3.30 H new ATOM 0 HG3 GLU A 86 81.989 -28.123 2.003 1.00 3.30 H new ATOM 1268 N ASN A 87 78.388 -26.621 5.164 1.00 3.41 N ATOM 1269 CA ASN A 87 77.211 -25.959 5.714 1.00 12.40 C ATOM 1270 C ASN A 87 76.587 -25.017 4.689 1.00 62.15 C ATOM 1271 O ASN A 87 77.241 -24.099 4.194 1.00 12.11 O ATOM 1272 CB ASN A 87 77.583 -25.180 6.978 1.00 70.42 C ATOM 1273 CG ASN A 87 78.946 -24.525 6.874 1.00 5.10 C ATOM 1274 OD1 ASN A 87 79.974 -25.203 6.863 1.00 71.20 O ATOM 1275 ND2 ASN A 87 78.962 -23.199 6.797 1.00 74.50 N ATOM 0 H ASN A 87 79.218 -26.563 5.753 1.00 3.41 H new ATOM 0 HA ASN A 87 76.480 -26.726 5.969 1.00 12.40 H new ATOM 0 HB2 ASN A 87 76.829 -24.415 7.165 1.00 70.42 H new ATOM 0 HB3 ASN A 87 77.572 -25.855 7.834 1.00 70.42 H new ATOM 0 HD21 ASN A 87 79.850 -22.703 6.725 1.00 74.50 H new ATOM 0 HD22 ASN A 87 78.086 -22.677 6.810 1.00 74.50 H new ATOM 1282 N PHE A 88 75.317 -25.252 4.374 1.00 24.24 N ATOM 1283 CA PHE A 88 74.604 -24.426 3.408 1.00 62.15 C ATOM 1284 C PHE A 88 73.252 -23.986 3.961 1.00 52.44 C ATOM 1285 O PHE A 88 72.407 -24.815 4.299 1.00 1.44 O ATOM 1286 CB PHE A 88 74.406 -25.192 2.098 1.00 45.02 C ATOM 1287 CG PHE A 88 75.677 -25.770 1.543 1.00 33.34 C ATOM 1288 CD1 PHE A 88 76.856 -25.045 1.578 1.00 42.12 C ATOM 1289 CD2 PHE A 88 75.692 -27.040 0.988 1.00 75.14 C ATOM 1290 CE1 PHE A 88 78.027 -25.574 1.068 1.00 43.15 C ATOM 1291 CE2 PHE A 88 76.859 -27.574 0.477 1.00 64.12 C ATOM 1292 CZ PHE A 88 78.028 -26.841 0.517 1.00 15.43 C ATOM 0 H PHE A 88 74.761 -26.008 4.774 1.00 24.24 H new ATOM 0 HA PHE A 88 75.205 -23.537 3.215 1.00 62.15 H new ATOM 0 HB2 PHE A 88 73.691 -25.998 2.262 1.00 45.02 H new ATOM 0 HB3 PHE A 88 73.967 -24.523 1.358 1.00 45.02 H new ATOM 0 HD1 PHE A 88 76.861 -24.055 2.009 1.00 42.12 H new ATOM 0 HD2 PHE A 88 74.781 -27.619 0.955 1.00 75.14 H new ATOM 0 HE1 PHE A 88 78.940 -24.998 1.100 1.00 43.15 H new ATOM 0 HE2 PHE A 88 76.857 -28.564 0.046 1.00 64.12 H new ATOM 0 HZ PHE A 88 78.941 -27.257 0.118 1.00 15.43 H new ATOM 1302 N TRP A 89 73.055 -22.675 4.050 1.00 40.34 N ATOM 1303 CA TRP A 89 71.806 -22.123 4.563 1.00 60.11 C ATOM 1304 C TRP A 89 70.724 -22.135 3.489 1.00 41.54 C ATOM 1305 O TRP A 89 70.974 -21.773 2.338 1.00 21.12 O ATOM 1306 CB TRP A 89 72.026 -20.696 5.069 1.00 20.41 C ATOM 1307 CG TRP A 89 72.175 -19.692 3.966 1.00 3.45 C ATOM 1308 CD1 TRP A 89 72.935 -19.820 2.839 1.00 22.02 C ATOM 1309 CD2 TRP A 89 71.552 -18.405 3.889 1.00 32.50 C ATOM 1310 NE1 TRP A 89 72.821 -18.691 2.065 1.00 13.20 N ATOM 1311 CE2 TRP A 89 71.977 -17.808 2.686 1.00 10.21 C ATOM 1312 CE3 TRP A 89 70.674 -17.701 4.717 1.00 13.21 C ATOM 1313 CZ2 TRP A 89 71.555 -16.541 2.295 1.00 52.21 C ATOM 1314 CZ3 TRP A 89 70.256 -16.442 4.328 1.00 23.31 C ATOM 1315 CH2 TRP A 89 70.696 -15.873 3.126 1.00 64.12 C ATOM 0 H TRP A 89 73.744 -21.975 3.774 1.00 40.34 H new ATOM 0 HA TRP A 89 71.474 -22.748 5.392 1.00 60.11 H new ATOM 0 HB2 TRP A 89 71.186 -20.409 5.701 1.00 20.41 H new ATOM 0 HB3 TRP A 89 72.918 -20.673 5.695 1.00 20.41 H new ATOM 0 HD1 TRP A 89 73.537 -20.682 2.592 1.00 22.02 H new ATOM 0 HE1 TRP A 89 73.289 -18.535 1.172 1.00 13.20 H new ATOM 0 HE3 TRP A 89 70.328 -18.133 5.645 1.00 13.21 H new ATOM 0 HZ2 TRP A 89 71.893 -16.100 1.369 1.00 52.21 H new ATOM 0 HZ3 TRP A 89 69.579 -15.888 4.961 1.00 23.31 H new ATOM 0 HH2 TRP A 89 70.351 -14.888 2.849 1.00 64.12 H new ATOM 1326 N VAL A 90 69.521 -22.550 3.871 1.00 42.13 N ATOM 1327 CA VAL A 90 68.400 -22.607 2.940 1.00 11.21 C ATOM 1328 C VAL A 90 67.589 -21.317 2.978 1.00 41.15 C ATOM 1329 O VAL A 90 67.333 -20.763 4.048 1.00 65.41 O ATOM 1330 CB VAL A 90 67.471 -23.794 3.253 1.00 63.32 C ATOM 1331 CG1 VAL A 90 66.249 -23.327 4.029 1.00 71.01 C ATOM 1332 CG2 VAL A 90 67.059 -24.500 1.969 1.00 70.50 C ATOM 0 H VAL A 90 69.297 -22.852 4.819 1.00 42.13 H new ATOM 0 HA VAL A 90 68.822 -22.739 1.944 1.00 11.21 H new ATOM 0 HB VAL A 90 68.016 -24.505 3.874 1.00 63.32 H new ATOM 0 HG11 VAL A 90 65.605 -24.180 4.241 1.00 71.01 H new ATOM 0 HG12 VAL A 90 66.566 -22.870 4.967 1.00 71.01 H new ATOM 0 HG13 VAL A 90 65.699 -22.595 3.437 1.00 71.01 H new ATOM 0 HG21 VAL A 90 66.403 -25.337 2.208 1.00 70.50 H new ATOM 0 HG22 VAL A 90 66.532 -23.799 1.321 1.00 70.50 H new ATOM 0 HG23 VAL A 90 67.947 -24.871 1.457 1.00 70.50 H new ATOM 1342 N ASP A 91 67.186 -20.843 1.804 1.00 61.22 N ATOM 1343 CA ASP A 91 66.402 -19.618 1.702 1.00 61.14 C ATOM 1344 C ASP A 91 65.030 -19.796 2.346 1.00 12.35 C ATOM 1345 O ASP A 91 64.755 -19.237 3.408 1.00 51.21 O ATOM 1346 CB ASP A 91 66.241 -19.210 0.237 1.00 23.31 C ATOM 1347 CG ASP A 91 66.485 -17.730 0.018 1.00 75.21 C ATOM 1348 OD1 ASP A 91 67.600 -17.260 0.326 1.00 50.00 O ATOM 1349 OD2 ASP A 91 65.561 -17.042 -0.463 1.00 15.13 O ATOM 0 H ASP A 91 67.390 -21.289 0.909 1.00 61.22 H new ATOM 0 HA ASP A 91 66.935 -18.830 2.234 1.00 61.14 H new ATOM 0 HB2 ASP A 91 66.936 -19.784 -0.376 1.00 23.31 H new ATOM 0 HB3 ASP A 91 65.236 -19.463 -0.099 1.00 23.31 H new ATOM 1354 N ARG A 92 64.173 -20.577 1.697 1.00 41.40 N ATOM 1355 CA ARG A 92 62.830 -20.826 2.205 1.00 25.24 C ATOM 1356 C ARG A 92 62.312 -22.180 1.729 1.00 74.24 C ATOM 1357 O ARG A 92 62.209 -22.430 0.528 1.00 52.14 O ATOM 1358 CB ARG A 92 61.878 -19.716 1.757 1.00 62.23 C ATOM 1359 CG ARG A 92 60.470 -19.863 2.308 1.00 32.21 C ATOM 1360 CD ARG A 92 59.551 -20.555 1.313 1.00 32.02 C ATOM 1361 NE ARG A 92 58.141 -20.358 1.642 1.00 61.20 N ATOM 1362 CZ ARG A 92 57.493 -19.216 1.442 1.00 62.40 C ATOM 1363 NH1 ARG A 92 58.123 -18.174 0.918 1.00 63.25 N ATOM 1364 NH2 ARG A 92 56.210 -19.115 1.766 1.00 23.22 N ATOM 0 H ARG A 92 64.385 -21.048 0.818 1.00 41.40 H new ATOM 0 HA ARG A 92 62.876 -20.837 3.294 1.00 25.24 H new ATOM 0 HB2 ARG A 92 62.283 -18.753 2.070 1.00 62.23 H new ATOM 0 HB3 ARG A 92 61.834 -19.705 0.668 1.00 62.23 H new ATOM 0 HG2 ARG A 92 60.499 -20.434 3.236 1.00 32.21 H new ATOM 0 HG3 ARG A 92 60.069 -18.879 2.552 1.00 32.21 H new ATOM 0 HD2 ARG A 92 59.747 -20.172 0.312 1.00 32.02 H new ATOM 0 HD3 ARG A 92 59.774 -21.622 1.295 1.00 32.02 H new ATOM 0 HE ARG A 92 57.626 -21.140 2.047 1.00 61.20 H new ATOM 0 HH11 ARG A 92 59.109 -18.248 0.667 1.00 63.25 H new ATOM 0 HH12 ARG A 92 57.622 -17.299 0.766 1.00 63.25 H new ATOM 0 HH21 ARG A 92 55.721 -19.915 2.169 1.00 23.22 H new ATOM 0 HH22 ARG A 92 55.713 -18.238 1.612 1.00 23.22 H new ATOM 1378 N VAL A 93 61.985 -23.051 2.678 1.00 3.10 N ATOM 1379 CA VAL A 93 61.476 -24.379 2.356 1.00 5.12 C ATOM 1380 C VAL A 93 60.096 -24.601 2.965 1.00 2.41 C ATOM 1381 O VAL A 93 59.849 -24.241 4.117 1.00 65.14 O ATOM 1382 CB VAL A 93 62.429 -25.481 2.854 1.00 11.13 C ATOM 1383 CG1 VAL A 93 63.850 -25.212 2.383 1.00 1.23 C ATOM 1384 CG2 VAL A 93 62.373 -25.588 4.371 1.00 23.43 C ATOM 0 H VAL A 93 62.064 -22.861 3.677 1.00 3.10 H new ATOM 0 HA VAL A 93 61.404 -24.436 1.270 1.00 5.12 H new ATOM 0 HB VAL A 93 62.107 -26.433 2.433 1.00 11.13 H new ATOM 0 HG11 VAL A 93 64.509 -26.001 2.745 1.00 1.23 H new ATOM 0 HG12 VAL A 93 63.874 -25.190 1.293 1.00 1.23 H new ATOM 0 HG13 VAL A 93 64.187 -24.251 2.773 1.00 1.23 H new ATOM 0 HG21 VAL A 93 63.053 -26.372 4.706 1.00 23.43 H new ATOM 0 HG22 VAL A 93 62.669 -24.637 4.814 1.00 23.43 H new ATOM 0 HG23 VAL A 93 61.357 -25.832 4.681 1.00 23.43 H new ATOM 1394 N SER A 94 59.201 -25.198 2.186 1.00 71.14 N ATOM 1395 CA SER A 94 57.844 -25.466 2.647 1.00 73.01 C ATOM 1396 C SER A 94 57.395 -26.863 2.231 1.00 32.32 C ATOM 1397 O SER A 94 57.481 -27.250 1.066 1.00 24.03 O ATOM 1398 CB SER A 94 56.877 -24.420 2.088 1.00 33.51 C ATOM 1399 OG SER A 94 55.530 -24.829 2.257 1.00 63.31 O ATOM 0 H SER A 94 59.391 -25.506 1.232 1.00 71.14 H new ATOM 0 HA SER A 94 57.839 -25.411 3.736 1.00 73.01 H new ATOM 0 HB2 SER A 94 57.037 -23.467 2.591 1.00 33.51 H new ATOM 0 HB3 SER A 94 57.082 -24.260 1.029 1.00 33.51 H new ATOM 0 HG SER A 94 54.932 -24.143 1.893 1.00 63.31 H new ATOM 1405 N PRO A 95 56.903 -27.640 3.208 1.00 22.15 N ATOM 1406 CA PRO A 95 56.431 -29.007 2.970 1.00 61.43 C ATOM 1407 C PRO A 95 55.139 -29.041 2.160 1.00 65.23 C ATOM 1408 O PRO A 95 54.419 -28.046 2.081 1.00 21.01 O ATOM 1409 CB PRO A 95 56.191 -29.551 4.380 1.00 5.21 C ATOM 1410 CG PRO A 95 55.933 -28.343 5.213 1.00 71.31 C ATOM 1411 CD PRO A 95 56.771 -27.245 4.620 1.00 11.11 C ATOM 0 HA PRO A 95 57.147 -29.589 2.390 1.00 61.43 H new ATOM 0 HB2 PRO A 95 55.343 -30.235 4.401 1.00 5.21 H new ATOM 0 HB3 PRO A 95 57.057 -30.105 4.743 1.00 5.21 H new ATOM 0 HG2 PRO A 95 54.876 -28.078 5.199 1.00 71.31 H new ATOM 0 HG3 PRO A 95 56.203 -28.522 6.254 1.00 71.31 H new ATOM 0 HD2 PRO A 95 56.289 -26.273 4.722 1.00 11.11 H new ATOM 0 HD3 PRO A 95 57.742 -27.172 5.109 1.00 11.11 H new ATOM 1419 N ASP A 96 54.852 -30.191 1.559 1.00 12.23 N ATOM 1420 CA ASP A 96 53.646 -30.354 0.756 1.00 65.01 C ATOM 1421 C ASP A 96 52.741 -31.430 1.348 1.00 74.34 C ATOM 1422 O ASP A 96 51.528 -31.418 1.139 1.00 60.33 O ATOM 1423 CB ASP A 96 54.012 -30.715 -0.685 1.00 42.21 C ATOM 1424 CG ASP A 96 52.926 -30.333 -1.671 1.00 14.32 C ATOM 1425 OD1 ASP A 96 51.735 -30.490 -1.332 1.00 35.43 O ATOM 1426 OD2 ASP A 96 53.267 -29.877 -2.781 1.00 44.34 O ATOM 0 H ASP A 96 55.438 -31.024 1.613 1.00 12.23 H new ATOM 0 HA ASP A 96 53.106 -29.407 0.759 1.00 65.01 H new ATOM 0 HB2 ASP A 96 54.940 -30.212 -0.958 1.00 42.21 H new ATOM 0 HB3 ASP A 96 54.199 -31.787 -0.752 1.00 42.21 H new ATOM 1431 N ASP A 97 53.337 -32.358 2.087 1.00 3.54 N ATOM 1432 CA ASP A 97 52.586 -33.442 2.709 1.00 55.34 C ATOM 1433 C ASP A 97 53.518 -34.392 3.455 1.00 71.25 C ATOM 1434 O ASP A 97 53.948 -35.409 2.911 1.00 52.54 O ATOM 1435 CB ASP A 97 51.790 -34.210 1.653 1.00 33.54 C ATOM 1436 CG ASP A 97 50.308 -33.891 1.699 1.00 32.11 C ATOM 1437 OD1 ASP A 97 49.697 -34.062 2.775 1.00 75.31 O ATOM 1438 OD2 ASP A 97 49.760 -33.469 0.660 1.00 54.30 O ATOM 0 H ASP A 97 54.340 -32.382 2.270 1.00 3.54 H new ATOM 0 HA ASP A 97 51.893 -33.005 3.428 1.00 55.34 H new ATOM 0 HB2 ASP A 97 52.180 -33.971 0.664 1.00 33.54 H new ATOM 0 HB3 ASP A 97 51.933 -35.280 1.802 1.00 33.54 H new ATOM 1443 N GLY A 98 53.825 -34.053 4.702 1.00 2.35 N ATOM 1444 CA GLY A 98 54.705 -34.886 5.502 1.00 24.40 C ATOM 1445 C GLY A 98 56.126 -34.359 5.541 1.00 40.14 C ATOM 1446 O GLY A 98 57.070 -35.071 5.202 1.00 21.12 O ATOM 0 H GLY A 98 53.481 -33.217 5.174 1.00 2.35 H new ATOM 0 HA2 GLY A 98 54.316 -34.949 6.518 1.00 24.40 H new ATOM 0 HA3 GLY A 98 54.707 -35.899 5.099 1.00 24.40 H new ATOM 1450 N GLY A 99 56.279 -33.104 5.955 1.00 72.43 N ATOM 1451 CA GLY A 99 57.597 -32.502 6.028 1.00 31.42 C ATOM 1452 C GLY A 99 58.472 -32.879 4.849 1.00 61.23 C ATOM 1453 O GLY A 99 59.351 -33.733 4.967 1.00 44.24 O ATOM 0 H GLY A 99 55.513 -32.494 6.241 1.00 72.43 H new ATOM 0 HA2 GLY A 99 57.496 -31.417 6.070 1.00 31.42 H new ATOM 0 HA3 GLY A 99 58.084 -32.812 6.952 1.00 31.42 H new ATOM 1457 N SER A 100 58.231 -32.242 3.707 1.00 21.30 N ATOM 1458 CA SER A 100 59.000 -32.519 2.500 1.00 63.25 C ATOM 1459 C SER A 100 59.598 -31.236 1.931 1.00 4.22 C ATOM 1460 O SER A 100 60.095 -31.215 0.804 1.00 21.41 O ATOM 1461 CB SER A 100 58.116 -33.192 1.449 1.00 75.14 C ATOM 1462 OG SER A 100 58.885 -33.647 0.349 1.00 34.23 O ATOM 0 H SER A 100 57.509 -31.531 3.593 1.00 21.30 H new ATOM 0 HA SER A 100 59.814 -33.193 2.765 1.00 63.25 H new ATOM 0 HB2 SER A 100 57.587 -34.032 1.899 1.00 75.14 H new ATOM 0 HB3 SER A 100 57.360 -32.488 1.101 1.00 75.14 H new ATOM 0 HG SER A 100 59.562 -32.975 0.123 1.00 34.23 H new ATOM 1468 N CYS A 101 59.549 -30.167 2.719 1.00 73.45 N ATOM 1469 CA CYS A 101 60.085 -28.879 2.295 1.00 33.12 C ATOM 1470 C CYS A 101 61.477 -29.041 1.693 1.00 3.34 C ATOM 1471 O CYS A 101 62.278 -29.850 2.164 1.00 33.50 O ATOM 1472 CB CYS A 101 60.137 -27.910 3.477 1.00 32.10 C ATOM 1473 SG CYS A 101 61.046 -28.539 4.908 1.00 32.45 S ATOM 0 H CYS A 101 59.143 -30.167 3.655 1.00 73.45 H new ATOM 0 HA CYS A 101 59.423 -28.472 1.530 1.00 33.12 H new ATOM 0 HB2 CYS A 101 60.597 -26.978 3.149 1.00 32.10 H new ATOM 0 HB3 CYS A 101 59.118 -27.672 3.783 1.00 32.10 H new ATOM 0 HG CYS A 101 61.324 -29.796 4.727 1.00 32.45 H new ATOM 1479 N HIS A 102 61.760 -28.267 0.650 1.00 35.52 N ATOM 1480 CA HIS A 102 63.055 -28.326 -0.017 1.00 75.43 C ATOM 1481 C HIS A 102 63.310 -27.054 -0.821 1.00 65.41 C ATOM 1482 O HIS A 102 62.468 -26.629 -1.614 1.00 23.32 O ATOM 1483 CB HIS A 102 63.126 -29.547 -0.935 1.00 35.30 C ATOM 1484 CG HIS A 102 62.032 -29.591 -1.958 1.00 44.25 C ATOM 1485 ND1 HIS A 102 60.731 -29.932 -1.655 1.00 55.53 N ATOM 1486 CD2 HIS A 102 62.053 -29.332 -3.287 1.00 2.11 C ATOM 1487 CE1 HIS A 102 59.998 -29.882 -2.753 1.00 44.12 C ATOM 1488 NE2 HIS A 102 60.777 -29.521 -3.758 1.00 34.40 N ATOM 0 H HIS A 102 61.109 -27.592 0.249 1.00 35.52 H new ATOM 0 HA HIS A 102 63.826 -28.412 0.748 1.00 75.43 H new ATOM 0 HB2 HIS A 102 64.089 -29.553 -1.445 1.00 35.30 H new ATOM 0 HB3 HIS A 102 63.081 -30.451 -0.328 1.00 35.30 H new ATOM 0 HD1 HIS A 102 60.388 -30.184 -0.728 1.00 55.53 H new ATOM 0 HD2 HIS A 102 62.913 -29.033 -3.868 1.00 2.11 H new ATOM 0 HE1 HIS A 102 58.942 -30.099 -2.818 1.00 44.12 H new ATOM 1496 N LEU A 103 64.474 -26.452 -0.613 1.00 1.44 N ATOM 1497 CA LEU A 103 64.841 -25.228 -1.318 1.00 72.24 C ATOM 1498 C LEU A 103 66.353 -25.130 -1.489 1.00 61.11 C ATOM 1499 O LEU A 103 67.115 -25.606 -0.648 1.00 71.31 O ATOM 1500 CB LEU A 103 64.321 -24.005 -0.560 1.00 53.43 C ATOM 1501 CG LEU A 103 64.311 -22.689 -1.339 1.00 14.34 C ATOM 1502 CD1 LEU A 103 65.718 -22.120 -1.442 1.00 14.51 C ATOM 1503 CD2 LEU A 103 63.712 -22.891 -2.722 1.00 4.51 C ATOM 0 H LEU A 103 65.182 -26.791 0.039 1.00 1.44 H new ATOM 0 HA LEU A 103 64.384 -25.256 -2.307 1.00 72.24 H new ATOM 0 HB2 LEU A 103 63.305 -24.214 -0.226 1.00 53.43 H new ATOM 0 HB3 LEU A 103 64.929 -23.870 0.334 1.00 53.43 H new ATOM 0 HG LEU A 103 63.690 -21.974 -0.799 1.00 14.34 H new ATOM 0 HD11 LEU A 103 65.692 -21.184 -1.999 1.00 14.51 H new ATOM 0 HD12 LEU A 103 66.110 -21.936 -0.442 1.00 14.51 H new ATOM 0 HD13 LEU A 103 66.361 -22.832 -1.959 1.00 14.51 H new ATOM 0 HD21 LEU A 103 63.713 -21.944 -3.261 1.00 4.51 H new ATOM 0 HD22 LEU A 103 64.304 -23.622 -3.272 1.00 4.51 H new ATOM 0 HD23 LEU A 103 62.688 -23.252 -2.626 1.00 4.51 H new ATOM 1515 N TRP A 104 66.780 -24.507 -2.582 1.00 60.34 N ATOM 1516 CA TRP A 104 68.202 -24.345 -2.863 1.00 52.20 C ATOM 1517 C TRP A 104 68.867 -23.466 -1.809 1.00 41.25 C ATOM 1518 O TRP A 104 68.519 -22.294 -1.653 1.00 64.23 O ATOM 1519 CB TRP A 104 68.402 -23.737 -4.252 1.00 62.10 C ATOM 1520 CG TRP A 104 67.591 -22.498 -4.481 1.00 13.21 C ATOM 1521 CD1 TRP A 104 66.311 -22.432 -4.951 1.00 14.00 C ATOM 1522 CD2 TRP A 104 68.006 -21.146 -4.252 1.00 64.30 C ATOM 1523 NE1 TRP A 104 65.905 -21.121 -5.028 1.00 32.30 N ATOM 1524 CE2 TRP A 104 66.926 -20.314 -4.604 1.00 43.42 C ATOM 1525 CE3 TRP A 104 69.184 -20.561 -3.782 1.00 52.33 C ATOM 1526 CZ2 TRP A 104 66.993 -18.927 -4.501 1.00 20.01 C ATOM 1527 CZ3 TRP A 104 69.249 -19.184 -3.681 1.00 11.02 C ATOM 1528 CH2 TRP A 104 68.158 -18.380 -4.038 1.00 41.44 C ATOM 0 H TRP A 104 66.162 -24.106 -3.288 1.00 60.34 H new ATOM 0 HA TRP A 104 68.668 -25.330 -2.835 1.00 52.20 H new ATOM 0 HB2 TRP A 104 69.458 -23.502 -4.389 1.00 62.10 H new ATOM 0 HB3 TRP A 104 68.140 -24.479 -5.006 1.00 62.10 H new ATOM 0 HD1 TRP A 104 65.706 -23.285 -5.222 1.00 14.00 H new ATOM 0 HE1 TRP A 104 64.991 -20.801 -5.349 1.00 32.30 H new ATOM 0 HE3 TRP A 104 70.029 -21.173 -3.503 1.00 52.33 H new ATOM 0 HZ2 TRP A 104 66.154 -18.305 -4.777 1.00 20.01 H new ATOM 0 HZ3 TRP A 104 70.155 -18.720 -3.321 1.00 11.02 H new ATOM 0 HH2 TRP A 104 68.239 -17.307 -3.946 1.00 41.44 H new ATOM 1539 N LEU A 105 69.825 -24.036 -1.088 1.00 21.24 N ATOM 1540 CA LEU A 105 70.540 -23.304 -0.048 1.00 62.13 C ATOM 1541 C LEU A 105 71.826 -22.696 -0.598 1.00 15.44 C ATOM 1542 O LEU A 105 72.311 -23.093 -1.656 1.00 71.42 O ATOM 1543 CB LEU A 105 70.861 -24.229 1.126 1.00 34.53 C ATOM 1544 CG LEU A 105 71.052 -25.707 0.784 1.00 22.34 C ATOM 1545 CD1 LEU A 105 72.272 -25.896 -0.105 1.00 35.24 C ATOM 1546 CD2 LEU A 105 71.180 -26.537 2.053 1.00 13.31 C ATOM 0 H LEU A 105 70.125 -25.004 -1.204 1.00 21.24 H new ATOM 0 HA LEU A 105 69.897 -22.496 0.301 1.00 62.13 H new ATOM 0 HB2 LEU A 105 71.769 -23.868 1.609 1.00 34.53 H new ATOM 0 HB3 LEU A 105 70.057 -24.147 1.857 1.00 34.53 H new ATOM 0 HG LEU A 105 70.173 -26.050 0.238 1.00 22.34 H new ATOM 0 HD11 LEU A 105 72.392 -26.954 -0.338 1.00 35.24 H new ATOM 0 HD12 LEU A 105 72.139 -25.334 -1.029 1.00 35.24 H new ATOM 0 HD13 LEU A 105 73.160 -25.536 0.414 1.00 35.24 H new ATOM 0 HD21 LEU A 105 71.315 -27.586 1.790 1.00 13.31 H new ATOM 0 HD22 LEU A 105 72.040 -26.193 2.627 1.00 13.31 H new ATOM 0 HD23 LEU A 105 70.276 -26.427 2.652 1.00 13.31 H new ATOM 1558 N GLY A 106 72.376 -21.729 0.132 1.00 25.04 N ATOM 1559 CA GLY A 106 73.602 -21.083 -0.297 1.00 2.21 C ATOM 1560 C GLY A 106 74.840 -21.765 0.252 1.00 65.44 C ATOM 1561 O GLY A 106 74.766 -22.507 1.232 1.00 53.22 O ATOM 0 H GLY A 106 71.994 -21.382 1.012 1.00 25.04 H new ATOM 0 HA2 GLY A 106 73.645 -21.080 -1.386 1.00 2.21 H new ATOM 0 HA3 GLY A 106 73.592 -20.042 0.025 1.00 2.21 H new ATOM 1565 N ARG A 107 75.981 -21.517 -0.384 1.00 34.05 N ATOM 1566 CA ARG A 107 77.240 -22.115 0.046 1.00 62.34 C ATOM 1567 C ARG A 107 77.646 -21.599 1.423 1.00 40.24 C ATOM 1568 O ARG A 107 77.218 -20.527 1.846 1.00 74.43 O ATOM 1569 CB ARG A 107 78.343 -21.815 -0.971 1.00 11.32 C ATOM 1570 CG ARG A 107 78.946 -20.427 -0.823 1.00 23.55 C ATOM 1571 CD ARG A 107 79.094 -19.738 -2.171 1.00 22.11 C ATOM 1572 NE ARG A 107 77.845 -19.123 -2.612 1.00 3.05 N ATOM 1573 CZ ARG A 107 77.373 -17.984 -2.117 1.00 62.40 C ATOM 1574 NH1 ARG A 107 78.041 -17.341 -1.171 1.00 2.43 N ATOM 1575 NH2 ARG A 107 76.228 -17.487 -2.569 1.00 5.31 N ATOM 0 H ARG A 107 76.059 -20.907 -1.198 1.00 34.05 H new ATOM 0 HA ARG A 107 77.098 -23.194 0.111 1.00 62.34 H new ATOM 0 HB2 ARG A 107 79.133 -22.558 -0.867 1.00 11.32 H new ATOM 0 HB3 ARG A 107 77.937 -21.920 -1.977 1.00 11.32 H new ATOM 0 HG2 ARG A 107 78.315 -19.822 -0.171 1.00 23.55 H new ATOM 0 HG3 ARG A 107 79.921 -20.502 -0.342 1.00 23.55 H new ATOM 0 HD2 ARG A 107 79.870 -18.975 -2.105 1.00 22.11 H new ATOM 0 HD3 ARG A 107 79.423 -20.464 -2.915 1.00 22.11 H new ATOM 0 HE ARG A 107 77.306 -19.593 -3.339 1.00 3.05 H new ATOM 0 HH11 ARG A 107 78.921 -17.720 -0.820 1.00 2.43 H new ATOM 0 HH12 ARG A 107 77.676 -16.467 -0.793 1.00 2.43 H new ATOM 0 HH21 ARG A 107 75.710 -17.980 -3.297 1.00 5.31 H new ATOM 0 HH22 ARG A 107 75.866 -16.613 -2.189 1.00 5.31 H new ATOM 1589 N GLY A 108 78.477 -22.371 2.116 1.00 15.50 N ATOM 1590 CA GLY A 108 78.927 -21.974 3.438 1.00 21.35 C ATOM 1591 C GLY A 108 79.993 -22.900 3.989 1.00 4.32 C ATOM 1592 O GLY A 108 79.715 -24.052 4.322 1.00 32.31 O ATOM 0 H GLY A 108 78.846 -23.263 1.787 1.00 15.50 H new ATOM 0 HA2 GLY A 108 79.319 -20.958 3.395 1.00 21.35 H new ATOM 0 HA3 GLY A 108 78.076 -21.959 4.119 1.00 21.35 H new ATOM 1596 N VAL A 109 81.220 -22.397 4.085 1.00 45.22 N ATOM 1597 CA VAL A 109 82.333 -23.187 4.598 1.00 74.10 C ATOM 1598 C VAL A 109 82.377 -23.148 6.122 1.00 25.40 C ATOM 1599 O VAL A 109 82.254 -22.095 6.745 1.00 51.43 O ATOM 1600 CB VAL A 109 83.680 -22.686 4.043 1.00 33.42 C ATOM 1601 CG1 VAL A 109 83.896 -21.225 4.405 1.00 55.03 C ATOM 1602 CG2 VAL A 109 84.822 -23.546 4.562 1.00 33.33 C ATOM 0 H VAL A 109 81.468 -21.445 3.814 1.00 45.22 H new ATOM 0 HA VAL A 109 82.172 -24.213 4.268 1.00 74.10 H new ATOM 0 HB VAL A 109 83.659 -22.767 2.956 1.00 33.42 H new ATOM 0 HG11 VAL A 109 84.852 -20.889 4.005 1.00 55.03 H new ATOM 0 HG12 VAL A 109 83.093 -20.622 3.981 1.00 55.03 H new ATOM 0 HG13 VAL A 109 83.898 -21.115 5.489 1.00 55.03 H new ATOM 0 HG21 VAL A 109 85.766 -23.178 4.160 1.00 33.33 H new ATOM 0 HG22 VAL A 109 84.848 -23.498 5.651 1.00 33.33 H new ATOM 0 HG23 VAL A 109 84.672 -24.579 4.248 1.00 33.33 H new ATOM 1612 N PRO A 110 82.556 -24.327 6.738 1.00 3.34 N ATOM 1613 CA PRO A 110 82.622 -24.455 8.197 1.00 0.50 C ATOM 1614 C PRO A 110 83.895 -23.846 8.775 1.00 2.23 C ATOM 1615 O PRO A 110 84.836 -23.512 8.054 1.00 12.02 O ATOM 1616 CB PRO A 110 82.604 -25.969 8.421 1.00 31.30 C ATOM 1617 CG PRO A 110 83.152 -26.545 7.162 1.00 61.33 C ATOM 1618 CD PRO A 110 82.710 -25.624 6.058 1.00 4.32 C ATOM 0 HA PRO A 110 81.805 -23.928 8.690 1.00 0.50 H new ATOM 0 HB2 PRO A 110 83.211 -26.249 9.282 1.00 31.30 H new ATOM 0 HB3 PRO A 110 81.593 -26.329 8.614 1.00 31.30 H new ATOM 0 HG2 PRO A 110 84.239 -26.610 7.204 1.00 61.33 H new ATOM 0 HG3 PRO A 110 82.778 -27.556 7.000 1.00 61.33 H new ATOM 0 HD2 PRO A 110 83.448 -25.573 5.257 1.00 4.32 H new ATOM 0 HD3 PRO A 110 81.774 -25.956 5.608 1.00 4.32 H new ATOM 1626 N PRO A 111 83.928 -23.698 10.108 1.00 14.31 N ATOM 1627 CA PRO A 111 85.082 -23.130 10.813 1.00 72.02 C ATOM 1628 C PRO A 111 86.291 -24.058 10.788 1.00 43.24 C ATOM 1629 O PRO A 111 87.389 -23.672 11.187 1.00 51.35 O ATOM 1630 CB PRO A 111 84.571 -22.955 12.245 1.00 12.21 C ATOM 1631 CG PRO A 111 83.484 -23.964 12.386 1.00 41.32 C ATOM 1632 CD PRO A 111 82.843 -24.074 11.029 1.00 54.22 C ATOM 0 HA PRO A 111 85.426 -22.204 10.352 1.00 72.02 H new ATOM 0 HB2 PRO A 111 85.365 -23.125 12.972 1.00 12.21 H new ATOM 0 HB3 PRO A 111 84.197 -21.945 12.411 1.00 12.21 H new ATOM 0 HG2 PRO A 111 83.883 -24.926 12.708 1.00 41.32 H new ATOM 0 HG3 PRO A 111 82.758 -23.653 13.137 1.00 41.32 H new ATOM 0 HD2 PRO A 111 82.483 -25.085 10.835 1.00 54.22 H new ATOM 0 HD3 PRO A 111 81.986 -23.407 10.934 1.00 54.22 H new ATOM 1640 N ALA A 112 86.082 -25.282 10.316 1.00 61.15 N ATOM 1641 CA ALA A 112 87.156 -26.264 10.237 1.00 63.03 C ATOM 1642 C ALA A 112 88.292 -25.764 9.351 1.00 45.21 C ATOM 1643 O ALA A 112 88.110 -24.852 8.545 1.00 74.00 O ATOM 1644 CB ALA A 112 86.622 -27.590 9.715 1.00 15.31 C ATOM 0 H ALA A 112 85.178 -25.617 9.982 1.00 61.15 H new ATOM 0 HA ALA A 112 87.552 -26.415 11.241 1.00 63.03 H new ATOM 0 HB1 ALA A 112 87.435 -28.314 9.661 1.00 15.31 H new ATOM 0 HB2 ALA A 112 85.849 -27.961 10.388 1.00 15.31 H new ATOM 0 HB3 ALA A 112 86.198 -27.446 8.721 1.00 15.31 H new ATOM 1650 N VAL A 113 89.466 -26.368 9.505 1.00 2.42 N ATOM 1651 CA VAL A 113 90.633 -25.984 8.719 1.00 25.53 C ATOM 1652 C VAL A 113 90.764 -26.852 7.472 1.00 44.24 C ATOM 1653 O VAL A 113 90.819 -28.078 7.559 1.00 14.11 O ATOM 1654 CB VAL A 113 91.928 -26.093 9.545 1.00 21.42 C ATOM 1655 CG1 VAL A 113 92.079 -27.494 10.120 1.00 74.03 C ATOM 1656 CG2 VAL A 113 93.135 -25.724 8.696 1.00 13.10 C ATOM 0 H VAL A 113 89.634 -27.125 10.167 1.00 2.42 H new ATOM 0 HA VAL A 113 90.487 -24.945 8.423 1.00 25.53 H new ATOM 0 HB VAL A 113 91.868 -25.390 10.375 1.00 21.42 H new ATOM 0 HG11 VAL A 113 93.000 -27.552 10.700 1.00 74.03 H new ATOM 0 HG12 VAL A 113 91.229 -27.716 10.765 1.00 74.03 H new ATOM 0 HG13 VAL A 113 92.117 -28.219 9.307 1.00 74.03 H new ATOM 0 HG21 VAL A 113 94.041 -25.807 9.296 1.00 13.10 H new ATOM 0 HG22 VAL A 113 93.201 -26.401 7.844 1.00 13.10 H new ATOM 0 HG23 VAL A 113 93.029 -24.700 8.338 1.00 13.10 H new ATOM 1666 N ASN A 114 90.815 -26.206 6.312 1.00 62.44 N ATOM 1667 CA ASN A 114 90.940 -26.919 5.045 1.00 43.51 C ATOM 1668 C ASN A 114 92.089 -26.353 4.214 1.00 74.43 C ATOM 1669 O ASN A 114 92.356 -25.152 4.242 1.00 13.31 O ATOM 1670 CB ASN A 114 89.633 -26.832 4.255 1.00 73.51 C ATOM 1671 CG ASN A 114 88.705 -27.996 4.543 1.00 71.01 C ATOM 1672 OD1 ASN A 114 88.604 -28.458 5.680 1.00 13.21 O ATOM 1673 ND2 ASN A 114 88.023 -28.478 3.511 1.00 54.33 N ATOM 0 H ASN A 114 90.772 -25.191 6.222 1.00 62.44 H new ATOM 0 HA ASN A 114 91.154 -27.965 5.265 1.00 43.51 H new ATOM 0 HB2 ASN A 114 89.126 -25.898 4.498 1.00 73.51 H new ATOM 0 HB3 ASN A 114 89.857 -26.805 3.189 1.00 73.51 H new ATOM 0 HD21 ASN A 114 87.384 -29.262 3.643 1.00 54.33 H new ATOM 0 HD22 ASN A 114 88.138 -28.064 2.586 1.00 54.33 H new ATOM 1680 N ARG A 115 92.762 -27.228 3.474 1.00 54.02 N ATOM 1681 CA ARG A 115 93.881 -26.816 2.635 1.00 44.35 C ATOM 1682 C ARG A 115 93.387 -26.270 1.298 1.00 31.40 C ATOM 1683 O ARG A 115 92.997 -27.031 0.412 1.00 3.53 O ATOM 1684 CB ARG A 115 94.829 -27.994 2.397 1.00 13.23 C ATOM 1685 CG ARG A 115 95.811 -28.222 3.534 1.00 4.45 C ATOM 1686 CD ARG A 115 97.134 -28.774 3.024 1.00 33.43 C ATOM 1687 NE ARG A 115 97.775 -29.650 4.001 1.00 14.50 N ATOM 1688 CZ ARG A 115 99.034 -30.063 3.904 1.00 53.22 C ATOM 1689 NH1 ARG A 115 99.783 -29.680 2.880 1.00 40.14 N ATOM 1690 NH2 ARG A 115 99.546 -30.858 4.833 1.00 22.05 N ATOM 0 H ARG A 115 92.552 -28.226 3.438 1.00 54.02 H new ATOM 0 HA ARG A 115 94.419 -26.024 3.155 1.00 44.35 H new ATOM 0 HB2 ARG A 115 94.240 -28.899 2.249 1.00 13.23 H new ATOM 0 HB3 ARG A 115 95.386 -27.822 1.476 1.00 13.23 H new ATOM 0 HG2 ARG A 115 95.985 -27.283 4.060 1.00 4.45 H new ATOM 0 HG3 ARG A 115 95.380 -28.916 4.255 1.00 4.45 H new ATOM 0 HD2 ARG A 115 96.964 -29.325 2.099 1.00 33.43 H new ATOM 0 HD3 ARG A 115 97.803 -27.948 2.784 1.00 33.43 H new ATOM 0 HE ARG A 115 97.226 -29.962 4.802 1.00 14.50 H new ATOM 0 HH11 ARG A 115 99.393 -29.067 2.164 1.00 40.14 H new ATOM 0 HH12 ARG A 115 100.749 -29.998 2.808 1.00 40.14 H new ATOM 0 HH21 ARG A 115 98.973 -31.153 5.624 1.00 22.05 H new ATOM 0 HH22 ARG A 115 100.513 -31.174 4.757 1.00 22.05 H new ATOM 1704 N ARG A 116 93.405 -24.948 1.162 1.00 31.45 N ATOM 1705 CA ARG A 116 92.956 -24.301 -0.065 1.00 1.14 C ATOM 1706 C ARG A 116 94.113 -23.581 -0.753 1.00 65.22 C ATOM 1707 O ARG A 116 94.928 -22.929 -0.101 1.00 12.42 O ATOM 1708 CB ARG A 116 91.832 -23.309 0.237 1.00 32.13 C ATOM 1709 CG ARG A 116 90.529 -23.973 0.653 1.00 62.43 C ATOM 1710 CD ARG A 116 89.621 -24.212 -0.544 1.00 32.30 C ATOM 1711 NE ARG A 116 90.010 -25.400 -1.299 1.00 34.04 N ATOM 1712 CZ ARG A 116 89.342 -25.853 -2.353 1.00 34.42 C ATOM 1713 NH1 ARG A 116 88.256 -25.220 -2.775 1.00 23.21 N ATOM 1714 NH2 ARG A 116 89.758 -26.942 -2.987 1.00 54.41 N ATOM 0 H ARG A 116 93.725 -24.305 1.886 1.00 31.45 H new ATOM 0 HA ARG A 116 92.579 -25.073 -0.736 1.00 1.14 H new ATOM 0 HB2 ARG A 116 92.156 -22.636 1.031 1.00 32.13 H new ATOM 0 HB3 ARG A 116 91.652 -22.697 -0.647 1.00 32.13 H new ATOM 0 HG2 ARG A 116 90.743 -24.922 1.144 1.00 62.43 H new ATOM 0 HG3 ARG A 116 90.016 -23.346 1.382 1.00 62.43 H new ATOM 0 HD2 ARG A 116 88.592 -24.321 -0.202 1.00 32.30 H new ATOM 0 HD3 ARG A 116 89.649 -23.341 -1.199 1.00 32.30 H new ATOM 0 HE ARG A 116 90.841 -25.910 -1.000 1.00 34.04 H new ATOM 0 HH11 ARG A 116 87.932 -24.383 -2.290 1.00 23.21 H new ATOM 0 HH12 ARG A 116 87.744 -25.570 -3.585 1.00 23.21 H new ATOM 0 HH21 ARG A 116 90.592 -27.432 -2.665 1.00 54.41 H new ATOM 0 HH22 ARG A 116 89.243 -27.289 -3.797 1.00 54.41 H new ATOM 1728 N ARG A 117 94.177 -23.704 -2.075 1.00 32.13 N ATOM 1729 CA ARG A 117 95.234 -23.067 -2.851 1.00 62.43 C ATOM 1730 C ARG A 117 95.329 -21.580 -2.522 1.00 64.23 C ATOM 1731 O ARG A 117 96.407 -20.989 -2.583 1.00 42.11 O ATOM 1732 CB ARG A 117 94.980 -23.254 -4.348 1.00 24.33 C ATOM 1733 CG ARG A 117 96.032 -22.603 -5.230 1.00 53.23 C ATOM 1734 CD ARG A 117 97.314 -23.421 -5.266 1.00 53.40 C ATOM 1735 NE ARG A 117 98.343 -22.790 -6.087 1.00 50.15 N ATOM 1736 CZ ARG A 117 99.380 -23.445 -6.599 1.00 34.14 C ATOM 1737 NH1 ARG A 117 99.523 -24.744 -6.374 1.00 13.51 N ATOM 1738 NH2 ARG A 117 100.275 -22.801 -7.336 1.00 64.20 N ATOM 0 H ARG A 117 93.509 -24.239 -2.631 1.00 32.13 H new ATOM 0 HA ARG A 117 96.180 -23.541 -2.588 1.00 62.43 H new ATOM 0 HB2 ARG A 117 94.941 -24.320 -4.571 1.00 24.33 H new ATOM 0 HB3 ARG A 117 94.003 -22.840 -4.597 1.00 24.33 H new ATOM 0 HG2 ARG A 117 95.642 -22.492 -6.242 1.00 53.23 H new ATOM 0 HG3 ARG A 117 96.249 -21.601 -4.860 1.00 53.23 H new ATOM 0 HD2 ARG A 117 97.689 -23.551 -4.251 1.00 53.40 H new ATOM 0 HD3 ARG A 117 97.098 -24.416 -5.656 1.00 53.40 H new ATOM 0 HE ARG A 117 98.262 -21.791 -6.278 1.00 50.15 H new ATOM 0 HH11 ARG A 117 98.837 -25.242 -5.807 1.00 13.51 H new ATOM 0 HH12 ARG A 117 100.319 -25.245 -6.768 1.00 13.51 H new ATOM 0 HH21 ARG A 117 100.168 -21.802 -7.511 1.00 64.20 H new ATOM 0 HH22 ARG A 117 101.070 -23.305 -7.728 1.00 64.20 H new TER 1752 ARG A 117