USER MOD reduce.3.24.130724 H: found=0, std=0, add=1138, rem=0, adj=45 USER MOD reduce.3.24.130724 removed 1013 hydrogens (79 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 52 THR OG1 : rot 143:sc= 0.695 USER MOD Set 1.2: A 132 SER OG : rot 180:sc= -0.108 USER MOD Set 2.1: A 98 THR OG1 : rot -61:sc= 0.717 USER MOD Set 2.2: A 129 HIS :FLIP no HD1:sc= -2.84! F(o=-3.6,f=-2.1!) USER MOD Set 3.1: A 80 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 81 GLN : amide:sc= -1.61! C(o=-1.6!,f=-3.8!) USER MOD Set 4.1: A 55 TYR OH : rot 37:sc= 0.975 USER MOD Set 4.2: A 68 THR OG1 : rot 150:sc= 1.79 USER MOD Set 5.1: A 4 LYS NZ :NH3+ -103:sc= 0.515 (180deg=0.341) USER MOD Set 5.2: A 8 ASN : amide:sc= -13.2! C(o=-13!,f=-39!) USER MOD Single : A 1 PHE N :NH3+ 176:sc= 0.109 (180deg=0.0244) USER MOD Single : A 2 ASN : amide:sc= 0 X(o=0,f=-0.046) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ -161:sc= -0.138 (180deg=-0.768) USER MOD Single : A 17 THR OG1 : rot 73:sc= 0.611! USER MOD Single : A 19 ASN : amide:sc= -11.1! C(o=-11!,f=-13!) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 ASN : amide:sc= 1.03 K(o=1,f=-0.41) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 SER OG : rot 180:sc= 0.00526 USER MOD Single : A 33 GLN : amide:sc= -1.62 K(o=-1.6,f=-2.5!) USER MOD Single : A 34 TYR OH : rot 180:sc= -0.36 USER MOD Single : A 35 LYS NZ :NH3+ 134:sc= -0.189 (180deg=-0.721) USER MOD Single : A 38 ASN :FLIP amide:sc= -0.714 F(o=-4.5!,f=-0.71) USER MOD Single : A 39 SER OG : rot -9:sc= 0.365! USER MOD Single : A 41 ASN :FLIP amide:sc= -0.876 F(o=-4.4!,f=-0.88) USER MOD Single : A 44 LYS NZ :NH3+ 171:sc= -2.67! (180deg=-2.85!) USER MOD Single : A 47 LYS NZ :NH3+ -166:sc= -1.78! (180deg=-2.32!) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 50 THR OG1 : rot 180:sc= -0.596 USER MOD Single : A 56 THR OG1 : rot 159:sc= -1.13! USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 THR OG1 : rot -51:sc= 0.316! USER MOD Single : A 73 LYS NZ :NH3+ -139:sc= -0.0798 (180deg=-0.699) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 GLN :FLIP amide:sc= -0.0127 F(o=-1.6!,f=-0.013) USER MOD Single : A 87 THR OG1 : rot 46:sc= -0.536! USER MOD Single : A 91 GLN :FLIP amide:sc= -0.795 F(o=-3.1!,f=-0.79) USER MOD Single : A 93 MET CE :methyl -117:sc= -0.595 (180deg=-5.64!) USER MOD Single : A 97 SER OG : rot -59:sc= 0.684 USER MOD Single : A 102 TYR OH : rot -48:sc= 0.0106 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 109 TYR OH : rot 145:sc= -4.04! USER MOD Single : A 113 SER OG : rot 140:sc= -5.43! USER MOD Single : A 121 ASN : amide:sc= 0.031! X(o=0.031!,f=-0.4) USER MOD Single : A 123 THR OG1 : rot 160:sc= 0 USER MOD Single : A 127 LYS NZ :NH3+ 153:sc= -6.2! (180deg=-8.35!) USER MOD Single : A 134 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0691) USER MOD Single : A 135 LYS NZ :NH3+ -150:sc= 0.182 (180deg=0) USER MOD Single : A 136 SER OG : rot 180:sc= -1.04! USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 138 RAP O10 : rot 150:sc= -5.43! USER MOD Single : A 138 RAP O13 : rot 28:sc= 0.0112 USER MOD Single : A 138 RAP O6 : rot -18:sc= -1.13 USER MOD ----------------------------------------------------------------- ATOM 1 N PHE A 1 92.624 27.724 4.901 1.00 1.00 N ATOM 2 CA PHE A 1 92.553 26.236 4.955 1.00 1.00 C ATOM 3 C PHE A 1 93.949 25.678 5.223 1.00 1.00 C ATOM 4 O PHE A 1 94.108 24.486 5.490 1.00 1.00 O ATOM 5 CB PHE A 1 92.032 25.704 3.618 1.00 1.00 C ATOM 6 CG PHE A 1 90.689 26.324 3.315 1.00 1.00 C ATOM 7 CD1 PHE A 1 89.516 25.725 3.790 1.00 1.00 C ATOM 8 CD2 PHE A 1 90.618 27.500 2.558 1.00 1.00 C ATOM 9 CE1 PHE A 1 88.272 26.304 3.507 1.00 1.00 C ATOM 10 CE2 PHE A 1 89.375 28.077 2.275 1.00 1.00 C ATOM 11 CZ PHE A 1 88.202 27.479 2.750 1.00 1.00 C ATOM 0 H1 PHE A 1 91.690 28.107 4.652 1.00 1.00 H new ATOM 0 H2 PHE A 1 92.912 28.092 5.830 1.00 1.00 H new ATOM 0 H3 PHE A 1 93.319 28.013 4.183 1.00 1.00 H new ATOM 0 HA PHE A 1 91.878 25.926 5.753 1.00 1.00 H new ATOM 0 HB2 PHE A 1 92.739 25.937 2.822 1.00 1.00 H new ATOM 0 HB3 PHE A 1 91.942 24.618 3.657 1.00 1.00 H new ATOM 0 HD1 PHE A 1 89.570 24.818 4.374 1.00 1.00 H new ATOM 0 HD2 PHE A 1 91.523 27.962 2.192 1.00 1.00 H new ATOM 0 HE1 PHE A 1 87.366 25.843 3.873 1.00 1.00 H new ATOM 0 HE2 PHE A 1 89.321 28.983 1.690 1.00 1.00 H new ATOM 0 HZ PHE A 1 87.243 27.925 2.532 1.00 1.00 H new ATOM 23 N ASN A 2 94.956 26.547 5.161 1.00 1.00 N ATOM 24 CA ASN A 2 96.329 26.118 5.410 1.00 1.00 C ATOM 25 C ASN A 2 96.437 25.595 6.832 1.00 1.00 C ATOM 26 O ASN A 2 97.364 24.864 7.171 1.00 1.00 O ATOM 27 CB ASN A 2 97.305 27.276 5.218 1.00 1.00 C ATOM 28 CG ASN A 2 97.462 27.584 3.734 1.00 1.00 C ATOM 29 OD1 ASN A 2 97.916 26.736 2.966 1.00 1.00 O ATOM 30 ND2 ASN A 2 97.110 28.755 3.281 1.00 1.00 N ATOM 0 H ASN A 2 94.850 27.538 4.944 1.00 1.00 H new ATOM 0 HA ASN A 2 96.584 25.332 4.700 1.00 1.00 H new ATOM 0 HB2 ASN A 2 96.943 28.159 5.745 1.00 1.00 H new ATOM 0 HB3 ASN A 2 98.273 27.022 5.650 1.00 1.00 H new ATOM 0 HD21 ASN A 2 97.211 28.969 2.289 1.00 1.00 H new ATOM 0 HD22 ASN A 2 96.734 29.457 3.919 1.00 1.00 H new ATOM 37 N LYS A 3 95.467 25.960 7.658 1.00 1.00 N ATOM 38 CA LYS A 3 95.450 25.507 9.038 1.00 1.00 C ATOM 39 C LYS A 3 95.653 23.997 9.050 1.00 1.00 C ATOM 40 O LYS A 3 96.366 23.459 9.894 1.00 1.00 O ATOM 41 CB LYS A 3 94.104 25.911 9.662 1.00 1.00 C ATOM 42 CG LYS A 3 93.675 25.012 10.862 1.00 1.00 C ATOM 43 CD LYS A 3 92.142 24.900 10.917 1.00 1.00 C ATOM 44 CE LYS A 3 91.677 23.818 9.942 1.00 1.00 C ATOM 45 NZ LYS A 3 90.193 23.859 9.815 1.00 1.00 N ATOM 0 H LYS A 3 94.688 26.564 7.398 1.00 1.00 H new ATOM 0 HA LYS A 3 96.248 25.962 9.624 1.00 1.00 H new ATOM 0 HB2 LYS A 3 94.166 26.946 9.998 1.00 1.00 H new ATOM 0 HB3 LYS A 3 93.331 25.871 8.895 1.00 1.00 H new ATOM 0 HG2 LYS A 3 94.116 24.021 10.760 1.00 1.00 H new ATOM 0 HG3 LYS A 3 94.050 25.433 11.795 1.00 1.00 H new ATOM 0 HD2 LYS A 3 91.820 24.656 11.929 1.00 1.00 H new ATOM 0 HD3 LYS A 3 91.687 25.857 10.660 1.00 1.00 H new ATOM 0 HE2 LYS A 3 92.139 23.971 8.967 1.00 1.00 H new ATOM 0 HE3 LYS A 3 91.994 22.837 10.295 1.00 1.00 H new ATOM 0 HZ1 LYS A 3 89.881 23.122 9.151 1.00 1.00 H new ATOM 0 HZ2 LYS A 3 89.760 23.692 10.746 1.00 1.00 H new ATOM 0 HZ3 LYS A 3 89.901 24.791 9.459 1.00 1.00 H new ATOM 59 N LYS A 4 95.004 23.324 8.111 1.00 1.00 N ATOM 60 CA LYS A 4 95.097 21.879 8.015 1.00 1.00 C ATOM 61 C LYS A 4 96.537 21.460 7.672 1.00 1.00 C ATOM 62 O LYS A 4 97.033 20.444 8.159 1.00 1.00 O ATOM 63 CB LYS A 4 94.093 21.384 6.959 1.00 1.00 C ATOM 64 CG LYS A 4 93.525 20.008 7.348 1.00 1.00 C ATOM 65 CD LYS A 4 94.594 18.901 7.225 1.00 1.00 C ATOM 66 CE LYS A 4 93.988 17.658 6.548 1.00 1.00 C ATOM 67 NZ LYS A 4 94.980 16.549 6.536 1.00 1.00 N ATOM 0 H LYS A 4 94.408 23.758 7.406 1.00 1.00 H new ATOM 0 HA LYS A 4 94.848 21.423 8.973 1.00 1.00 H new ATOM 0 HB2 LYS A 4 93.280 22.103 6.859 1.00 1.00 H new ATOM 0 HB3 LYS A 4 94.583 21.319 5.987 1.00 1.00 H new ATOM 0 HG2 LYS A 4 93.152 20.043 8.372 1.00 1.00 H new ATOM 0 HG3 LYS A 4 92.676 19.769 6.707 1.00 1.00 H new ATOM 0 HD2 LYS A 4 95.441 19.265 6.644 1.00 1.00 H new ATOM 0 HD3 LYS A 4 94.974 18.639 8.213 1.00 1.00 H new ATOM 0 HE2 LYS A 4 93.089 17.347 7.080 1.00 1.00 H new ATOM 0 HE3 LYS A 4 93.688 17.899 5.528 1.00 1.00 H new ATOM 0 HZ1 LYS A 4 95.392 16.462 5.585 1.00 1.00 H new ATOM 0 HZ2 LYS A 4 95.734 16.750 7.223 1.00 1.00 H new ATOM 0 HZ3 LYS A 4 94.508 15.658 6.791 1.00 1.00 H new ATOM 81 N ALA A 5 97.204 22.267 6.844 1.00 1.00 N ATOM 82 CA ALA A 5 98.588 22.002 6.448 1.00 1.00 C ATOM 83 C ALA A 5 99.451 21.796 7.664 1.00 1.00 C ATOM 84 O ALA A 5 100.334 20.945 7.669 1.00 1.00 O ATOM 85 CB ALA A 5 99.117 23.188 5.637 1.00 1.00 C ATOM 0 H ALA A 5 96.806 23.112 6.434 1.00 1.00 H new ATOM 0 HA ALA A 5 98.618 21.097 5.841 1.00 1.00 H new ATOM 0 HB1 ALA A 5 100.148 22.995 5.340 1.00 1.00 H new ATOM 0 HB2 ALA A 5 98.502 23.323 4.747 1.00 1.00 H new ATOM 0 HB3 ALA A 5 99.078 24.091 6.246 1.00 1.00 H new ATOM 91 N ASP A 6 99.177 22.567 8.694 1.00 1.00 N ATOM 92 CA ASP A 6 99.925 22.458 9.927 1.00 1.00 C ATOM 93 C ASP A 6 99.691 21.094 10.580 1.00 1.00 C ATOM 94 O ASP A 6 100.599 20.515 11.169 1.00 1.00 O ATOM 95 CB ASP A 6 99.497 23.551 10.882 1.00 1.00 C ATOM 96 CG ASP A 6 99.981 24.909 10.384 1.00 1.00 C ATOM 97 OD1 ASP A 6 100.843 24.931 9.520 1.00 1.00 O ATOM 98 OD2 ASP A 6 99.482 25.909 10.876 1.00 1.00 O ATOM 0 H ASP A 6 98.443 23.275 8.702 1.00 1.00 H new ATOM 0 HA ASP A 6 100.986 22.562 9.699 1.00 1.00 H new ATOM 0 HB2 ASP A 6 98.411 23.556 10.976 1.00 1.00 H new ATOM 0 HB3 ASP A 6 99.902 23.355 11.875 1.00 1.00 H new ATOM 103 N GLU A 7 98.460 20.590 10.493 1.00 1.00 N ATOM 104 CA GLU A 7 98.139 19.303 11.098 1.00 1.00 C ATOM 105 C GLU A 7 98.872 18.181 10.388 1.00 1.00 C ATOM 106 O GLU A 7 99.557 17.366 10.999 1.00 1.00 O ATOM 107 CB GLU A 7 96.647 19.057 11.002 1.00 1.00 C ATOM 108 CG GLU A 7 95.903 20.302 11.456 1.00 1.00 C ATOM 109 CD GLU A 7 94.402 20.042 11.481 1.00 1.00 C ATOM 110 OE1 GLU A 7 93.671 20.957 11.823 1.00 1.00 O ATOM 111 OE2 GLU A 7 94.004 18.934 11.161 1.00 1.00 O ATOM 0 H GLU A 7 97.682 21.046 10.017 1.00 1.00 H new ATOM 0 HA GLU A 7 98.449 19.324 12.143 1.00 1.00 H new ATOM 0 HB2 GLU A 7 96.373 18.809 9.977 1.00 1.00 H new ATOM 0 HB3 GLU A 7 96.366 18.205 11.622 1.00 1.00 H new ATOM 0 HG2 GLU A 7 96.244 20.596 12.448 1.00 1.00 H new ATOM 0 HG3 GLU A 7 96.124 21.131 10.784 1.00 1.00 H new ATOM 118 N ASN A 8 98.734 18.168 9.085 1.00 1.00 N ATOM 119 CA ASN A 8 99.388 17.161 8.270 1.00 1.00 C ATOM 120 C ASN A 8 100.873 17.267 8.521 1.00 1.00 C ATOM 121 O ASN A 8 101.601 16.276 8.596 1.00 1.00 O ATOM 122 CB ASN A 8 99.106 17.439 6.803 1.00 1.00 C ATOM 123 CG ASN A 8 97.641 17.738 6.625 1.00 1.00 C ATOM 124 OD1 ASN A 8 96.850 17.530 7.539 1.00 1.00 O ATOM 125 ND2 ASN A 8 97.247 18.230 5.494 1.00 1.00 N ATOM 0 H ASN A 8 98.175 18.842 8.561 1.00 1.00 H new ATOM 0 HA ASN A 8 99.023 16.165 8.520 1.00 1.00 H new ATOM 0 HB2 ASN A 8 99.705 18.282 6.459 1.00 1.00 H new ATOM 0 HB3 ASN A 8 99.389 16.578 6.197 1.00 1.00 H new ATOM 0 HD21 ASN A 8 96.262 18.452 5.350 1.00 1.00 H new ATOM 0 HD22 ASN A 8 97.922 18.395 4.747 1.00 1.00 H new ATOM 132 N LYS A 9 101.288 18.510 8.652 1.00 1.00 N ATOM 133 CA LYS A 9 102.675 18.849 8.905 1.00 1.00 C ATOM 134 C LYS A 9 103.153 18.315 10.256 1.00 1.00 C ATOM 135 O LYS A 9 104.184 17.662 10.332 1.00 1.00 O ATOM 136 CB LYS A 9 102.770 20.377 8.848 1.00 1.00 C ATOM 137 CG LYS A 9 103.992 20.923 9.568 1.00 1.00 C ATOM 138 CD LYS A 9 104.112 22.423 9.299 1.00 1.00 C ATOM 139 CE LYS A 9 105.418 22.942 9.903 1.00 1.00 C ATOM 140 NZ LYS A 9 105.599 24.377 9.544 1.00 1.00 N ATOM 0 H LYS A 9 100.670 19.319 8.586 1.00 1.00 H new ATOM 0 HA LYS A 9 103.322 18.388 8.158 1.00 1.00 H new ATOM 0 HB2 LYS A 9 102.797 20.695 7.806 1.00 1.00 H new ATOM 0 HB3 LYS A 9 101.872 20.808 9.290 1.00 1.00 H new ATOM 0 HG2 LYS A 9 103.908 20.740 10.639 1.00 1.00 H new ATOM 0 HG3 LYS A 9 104.890 20.408 9.226 1.00 1.00 H new ATOM 0 HD2 LYS A 9 104.093 22.614 8.226 1.00 1.00 H new ATOM 0 HD3 LYS A 9 103.262 22.951 9.732 1.00 1.00 H new ATOM 0 HE2 LYS A 9 105.400 22.827 10.987 1.00 1.00 H new ATOM 0 HE3 LYS A 9 106.259 22.355 9.534 1.00 1.00 H new ATOM 0 HZ1 LYS A 9 106.487 24.728 9.955 1.00 1.00 H new ATOM 0 HZ2 LYS A 9 105.634 24.474 8.509 1.00 1.00 H new ATOM 0 HZ3 LYS A 9 104.802 24.931 9.917 1.00 1.00 H new ATOM 154 N VAL A 10 102.416 18.585 11.326 1.00 1.00 N ATOM 155 CA VAL A 10 102.840 18.106 12.640 1.00 1.00 C ATOM 156 C VAL A 10 102.622 16.613 12.790 1.00 1.00 C ATOM 157 O VAL A 10 103.519 15.886 13.212 1.00 1.00 O ATOM 158 CB VAL A 10 102.102 18.851 13.750 1.00 1.00 C ATOM 159 CG1 VAL A 10 102.436 18.225 15.090 1.00 1.00 C ATOM 160 CG2 VAL A 10 102.536 20.312 13.735 1.00 1.00 C ATOM 0 H VAL A 10 101.546 19.117 11.316 1.00 1.00 H new ATOM 0 HA VAL A 10 103.909 18.303 12.725 1.00 1.00 H new ATOM 0 HB VAL A 10 101.026 18.788 13.590 1.00 1.00 H new ATOM 0 HG11 VAL A 10 101.909 18.757 15.882 1.00 1.00 H new ATOM 0 HG12 VAL A 10 102.129 17.179 15.089 1.00 1.00 H new ATOM 0 HG13 VAL A 10 103.510 18.288 15.263 1.00 1.00 H new ATOM 0 HG21 VAL A 10 102.015 20.854 14.524 1.00 1.00 H new ATOM 0 HG22 VAL A 10 103.611 20.374 13.901 1.00 1.00 H new ATOM 0 HG23 VAL A 10 102.292 20.754 12.769 1.00 1.00 H new ATOM 164 N LYS A 11 101.435 16.158 12.440 1.00 1.00 N ATOM 165 CA LYS A 11 101.141 14.751 12.546 1.00 1.00 C ATOM 166 C LYS A 11 102.110 14.010 11.664 1.00 1.00 C ATOM 167 O LYS A 11 102.633 12.972 12.045 1.00 1.00 O ATOM 168 CB LYS A 11 99.698 14.462 12.128 1.00 1.00 C ATOM 169 CG LYS A 11 98.714 14.833 13.257 1.00 1.00 C ATOM 170 CD LYS A 11 98.444 16.338 13.261 1.00 1.00 C ATOM 171 CE LYS A 11 97.688 16.721 14.533 1.00 1.00 C ATOM 172 NZ LYS A 11 96.695 15.656 14.855 1.00 1.00 N ATOM 0 H LYS A 11 100.672 16.735 12.086 1.00 1.00 H new ATOM 0 HA LYS A 11 101.247 14.424 13.580 1.00 1.00 H new ATOM 0 HB2 LYS A 11 99.455 15.027 11.228 1.00 1.00 H new ATOM 0 HB3 LYS A 11 99.591 13.406 11.879 1.00 1.00 H new ATOM 0 HG2 LYS A 11 97.778 14.290 13.124 1.00 1.00 H new ATOM 0 HG3 LYS A 11 99.125 14.529 14.220 1.00 1.00 H new ATOM 0 HD2 LYS A 11 99.384 16.886 13.206 1.00 1.00 H new ATOM 0 HD3 LYS A 11 97.861 16.615 12.382 1.00 1.00 H new ATOM 0 HE2 LYS A 11 98.386 16.846 15.361 1.00 1.00 H new ATOM 0 HE3 LYS A 11 97.182 17.677 14.395 1.00 1.00 H new ATOM 0 HZ1 LYS A 11 95.975 16.037 15.501 1.00 1.00 H new ATOM 0 HZ2 LYS A 11 96.238 15.332 13.979 1.00 1.00 H new ATOM 0 HZ3 LYS A 11 97.179 14.856 15.309 1.00 1.00 H new ATOM 186 N GLY A 12 102.360 14.577 10.494 1.00 1.00 N ATOM 187 CA GLY A 12 103.287 13.970 9.543 1.00 1.00 C ATOM 188 C GLY A 12 104.722 13.954 10.068 1.00 1.00 C ATOM 189 O GLY A 12 105.387 12.921 10.028 1.00 1.00 O ATOM 0 H GLY A 12 101.939 15.451 10.179 1.00 1.00 H new ATOM 0 HA2 GLY A 12 102.969 12.950 9.328 1.00 1.00 H new ATOM 0 HA3 GLY A 12 103.252 14.520 8.602 1.00 1.00 H new ATOM 193 N GLU A 13 105.201 15.082 10.579 1.00 1.00 N ATOM 194 CA GLU A 13 106.556 15.119 11.116 1.00 1.00 C ATOM 195 C GLU A 13 106.654 14.148 12.277 1.00 1.00 C ATOM 196 O GLU A 13 107.699 13.560 12.530 1.00 1.00 O ATOM 197 CB GLU A 13 106.926 16.529 11.597 1.00 1.00 C ATOM 198 CG GLU A 13 107.190 17.432 10.396 1.00 1.00 C ATOM 199 CD GLU A 13 107.493 18.853 10.859 1.00 1.00 C ATOM 200 OE1 GLU A 13 107.442 19.090 12.055 1.00 1.00 O ATOM 201 OE2 GLU A 13 107.771 19.683 10.010 1.00 1.00 O ATOM 0 H GLU A 13 104.688 15.962 10.633 1.00 1.00 H new ATOM 0 HA GLU A 13 107.251 14.837 10.325 1.00 1.00 H new ATOM 0 HB2 GLU A 13 106.118 16.940 12.202 1.00 1.00 H new ATOM 0 HB3 GLU A 13 107.810 16.486 12.233 1.00 1.00 H new ATOM 0 HG2 GLU A 13 108.029 17.044 9.818 1.00 1.00 H new ATOM 0 HG3 GLU A 13 106.322 17.434 9.736 1.00 1.00 H new ATOM 208 N ALA A 14 105.539 13.987 12.970 1.00 1.00 N ATOM 209 CA ALA A 14 105.460 13.088 14.101 1.00 1.00 C ATOM 210 C ALA A 14 105.307 11.657 13.616 1.00 1.00 C ATOM 211 O ALA A 14 105.796 10.710 14.232 1.00 1.00 O ATOM 212 CB ALA A 14 104.261 13.462 14.967 1.00 1.00 C ATOM 0 H ALA A 14 104.668 14.476 12.763 1.00 1.00 H new ATOM 0 HA ALA A 14 106.375 13.171 14.688 1.00 1.00 H new ATOM 0 HB1 ALA A 14 104.202 12.784 15.819 1.00 1.00 H new ATOM 0 HB2 ALA A 14 104.375 14.485 15.325 1.00 1.00 H new ATOM 0 HB3 ALA A 14 103.348 13.384 14.377 1.00 1.00 H new ATOM 218 N PHE A 15 104.608 11.529 12.502 1.00 1.00 N ATOM 219 CA PHE A 15 104.348 10.238 11.896 1.00 1.00 C ATOM 220 C PHE A 15 105.650 9.563 11.510 1.00 1.00 C ATOM 221 O PHE A 15 105.897 8.413 11.878 1.00 1.00 O ATOM 222 CB PHE A 15 103.498 10.483 10.661 1.00 1.00 C ATOM 223 CG PHE A 15 102.999 9.211 10.061 1.00 1.00 C ATOM 224 CD1 PHE A 15 103.597 8.714 8.908 1.00 1.00 C ATOM 225 CD2 PHE A 15 101.879 8.579 10.609 1.00 1.00 C ATOM 226 CE1 PHE A 15 103.075 7.580 8.294 1.00 1.00 C ATOM 227 CE2 PHE A 15 101.368 7.431 10.009 1.00 1.00 C ATOM 228 CZ PHE A 15 101.962 6.935 8.847 1.00 1.00 C ATOM 0 H PHE A 15 104.206 12.317 11.994 1.00 1.00 H new ATOM 0 HA PHE A 15 103.831 9.583 12.597 1.00 1.00 H new ATOM 0 HB2 PHE A 15 102.651 11.116 10.925 1.00 1.00 H new ATOM 0 HB3 PHE A 15 104.084 11.027 9.920 1.00 1.00 H new ATOM 0 HD1 PHE A 15 104.463 9.206 8.491 1.00 1.00 H new ATOM 0 HD2 PHE A 15 101.411 8.980 11.496 1.00 1.00 H new ATOM 0 HE1 PHE A 15 103.528 7.197 7.391 1.00 1.00 H new ATOM 0 HE2 PHE A 15 100.516 6.927 10.441 1.00 1.00 H new ATOM 0 HZ PHE A 15 101.562 6.051 8.373 1.00 1.00 H new ATOM 238 N LEU A 16 106.499 10.290 10.794 1.00 1.00 N ATOM 239 CA LEU A 16 107.786 9.731 10.404 1.00 1.00 C ATOM 240 C LEU A 16 108.657 9.556 11.629 1.00 1.00 C ATOM 241 O LEU A 16 109.346 8.548 11.776 1.00 1.00 O ATOM 242 CB LEU A 16 108.523 10.632 9.406 1.00 1.00 C ATOM 243 CG LEU A 16 107.865 10.578 8.009 1.00 1.00 C ATOM 244 CD1 LEU A 16 106.745 11.630 7.880 1.00 1.00 C ATOM 245 CD2 LEU A 16 108.940 10.837 6.956 1.00 1.00 C ATOM 0 H LEU A 16 106.326 11.244 10.478 1.00 1.00 H new ATOM 0 HA LEU A 16 107.592 8.771 9.926 1.00 1.00 H new ATOM 0 HB2 LEU A 16 108.523 11.659 9.771 1.00 1.00 H new ATOM 0 HB3 LEU A 16 109.565 10.320 9.332 1.00 1.00 H new ATOM 0 HG LEU A 16 107.418 9.595 7.864 1.00 1.00 H new ATOM 0 HD11 LEU A 16 106.301 11.568 6.887 1.00 1.00 H new ATOM 0 HD12 LEU A 16 105.979 11.441 8.632 1.00 1.00 H new ATOM 0 HD13 LEU A 16 107.162 12.626 8.030 1.00 1.00 H new ATOM 0 HD21 LEU A 16 108.492 10.802 5.963 1.00 1.00 H new ATOM 0 HD22 LEU A 16 109.382 11.820 7.121 1.00 1.00 H new ATOM 0 HD23 LEU A 16 109.715 10.074 7.032 1.00 1.00 H new ATOM 257 N THR A 17 108.619 10.547 12.502 1.00 1.00 N ATOM 258 CA THR A 17 109.412 10.489 13.713 1.00 1.00 C ATOM 259 C THR A 17 108.969 9.309 14.550 1.00 1.00 C ATOM 260 O THR A 17 109.785 8.601 15.138 1.00 1.00 O ATOM 261 CB THR A 17 109.295 11.781 14.522 1.00 1.00 C ATOM 262 OG1 THR A 17 109.589 12.892 13.691 1.00 1.00 O ATOM 263 CG2 THR A 17 110.282 11.739 15.678 1.00 1.00 C ATOM 0 H THR A 17 108.055 11.390 12.396 1.00 1.00 H new ATOM 0 HA THR A 17 110.458 10.369 13.432 1.00 1.00 H new ATOM 0 HB THR A 17 108.280 11.878 14.908 1.00 1.00 H new ATOM 0 HG1 THR A 17 108.846 13.041 13.069 1.00 1.00 H new ATOM 0 HG21 THR A 17 110.202 12.658 16.258 1.00 1.00 H new ATOM 0 HG22 THR A 17 110.057 10.886 16.318 1.00 1.00 H new ATOM 0 HG23 THR A 17 111.295 11.643 15.288 1.00 1.00 H new ATOM 271 N GLU A 18 107.664 9.112 14.613 1.00 1.00 N ATOM 272 CA GLU A 18 107.109 8.025 15.376 1.00 1.00 C ATOM 273 C GLU A 18 107.283 6.690 14.661 1.00 1.00 C ATOM 274 O GLU A 18 107.644 5.691 15.282 1.00 1.00 O ATOM 275 CB GLU A 18 105.629 8.282 15.644 1.00 1.00 C ATOM 276 CG GLU A 18 105.082 7.206 16.584 1.00 1.00 C ATOM 277 CD GLU A 18 103.625 7.503 16.926 1.00 1.00 C ATOM 278 OE1 GLU A 18 102.962 6.610 17.430 1.00 1.00 O ATOM 279 OE2 GLU A 18 103.193 8.616 16.676 1.00 1.00 O ATOM 0 H GLU A 18 106.973 9.696 14.141 1.00 1.00 H new ATOM 0 HA GLU A 18 107.649 7.970 16.321 1.00 1.00 H new ATOM 0 HB2 GLU A 18 105.496 9.269 16.088 1.00 1.00 H new ATOM 0 HB3 GLU A 18 105.073 8.277 14.706 1.00 1.00 H new ATOM 0 HG2 GLU A 18 105.161 6.226 16.113 1.00 1.00 H new ATOM 0 HG3 GLU A 18 105.678 7.171 17.496 1.00 1.00 H new ATOM 286 N ASN A 19 106.991 6.668 13.361 1.00 1.00 N ATOM 287 CA ASN A 19 107.078 5.424 12.594 1.00 1.00 C ATOM 288 C ASN A 19 108.476 4.838 12.566 1.00 1.00 C ATOM 289 O ASN A 19 108.646 3.633 12.751 1.00 1.00 O ATOM 290 CB ASN A 19 106.619 5.656 11.163 1.00 1.00 C ATOM 291 CG ASN A 19 106.657 4.341 10.408 1.00 1.00 C ATOM 292 OD1 ASN A 19 106.132 3.333 10.878 1.00 1.00 O ATOM 293 ND2 ASN A 19 107.262 4.293 9.264 1.00 1.00 N ATOM 0 H ASN A 19 106.697 7.483 12.823 1.00 1.00 H new ATOM 0 HA ASN A 19 106.428 4.710 13.099 1.00 1.00 H new ATOM 0 HB2 ASN A 19 105.609 6.065 11.154 1.00 1.00 H new ATOM 0 HB3 ASN A 19 107.263 6.388 10.676 1.00 1.00 H new ATOM 0 HD21 ASN A 19 107.305 3.415 8.746 1.00 1.00 H new ATOM 0 HD22 ASN A 19 107.695 5.133 8.880 1.00 1.00 H new ATOM 300 N LYS A 20 109.473 5.665 12.335 1.00 1.00 N ATOM 301 CA LYS A 20 110.834 5.147 12.293 1.00 1.00 C ATOM 302 C LYS A 20 111.140 4.462 13.617 1.00 1.00 C ATOM 303 O LYS A 20 111.904 3.499 13.675 1.00 1.00 O ATOM 304 CB LYS A 20 111.841 6.270 12.037 1.00 1.00 C ATOM 305 CG LYS A 20 111.769 7.282 13.176 1.00 1.00 C ATOM 306 CD LYS A 20 112.556 8.546 12.812 1.00 1.00 C ATOM 307 CE LYS A 20 114.045 8.228 12.693 1.00 1.00 C ATOM 308 NZ LYS A 20 114.834 9.487 12.800 1.00 1.00 N ATOM 0 H LYS A 20 109.379 6.668 12.177 1.00 1.00 H new ATOM 0 HA LYS A 20 110.918 4.432 11.475 1.00 1.00 H new ATOM 0 HB2 LYS A 20 112.848 5.860 11.962 1.00 1.00 H new ATOM 0 HB3 LYS A 20 111.624 6.759 11.087 1.00 1.00 H new ATOM 0 HG2 LYS A 20 110.729 7.538 13.379 1.00 1.00 H new ATOM 0 HG3 LYS A 20 112.173 6.843 14.088 1.00 1.00 H new ATOM 0 HD2 LYS A 20 112.188 8.953 11.870 1.00 1.00 H new ATOM 0 HD3 LYS A 20 112.400 9.311 13.573 1.00 1.00 H new ATOM 0 HE2 LYS A 20 114.343 7.532 13.478 1.00 1.00 H new ATOM 0 HE3 LYS A 20 114.248 7.739 11.740 1.00 1.00 H new ATOM 0 HZ1 LYS A 20 115.848 9.269 12.719 1.00 1.00 H new ATOM 0 HZ2 LYS A 20 114.557 10.136 12.036 1.00 1.00 H new ATOM 0 HZ3 LYS A 20 114.649 9.936 13.720 1.00 1.00 H new ATOM 322 N ASN A 21 110.525 4.975 14.677 1.00 1.00 N ATOM 323 CA ASN A 21 110.711 4.426 16.015 1.00 1.00 C ATOM 324 C ASN A 21 109.847 3.189 16.243 1.00 1.00 C ATOM 325 O ASN A 21 110.226 2.298 17.003 1.00 1.00 O ATOM 326 CB ASN A 21 110.383 5.504 17.058 1.00 1.00 C ATOM 327 CG ASN A 21 111.582 6.430 17.259 1.00 1.00 C ATOM 328 OD1 ASN A 21 112.592 6.021 17.833 1.00 1.00 O ATOM 329 ND2 ASN A 21 111.534 7.655 16.814 1.00 1.00 N ATOM 0 H ASN A 21 109.891 5.773 14.635 1.00 1.00 H new ATOM 0 HA ASN A 21 111.752 4.119 16.117 1.00 1.00 H new ATOM 0 HB2 ASN A 21 109.518 6.083 16.733 1.00 1.00 H new ATOM 0 HB3 ASN A 21 110.115 5.034 18.004 1.00 1.00 H new ATOM 0 HD21 ASN A 21 112.334 8.275 16.941 1.00 1.00 H new ATOM 0 HD22 ASN A 21 110.697 7.993 16.339 1.00 1.00 H new ATOM 336 N LYS A 22 108.682 3.138 15.609 1.00 1.00 N ATOM 337 CA LYS A 22 107.795 2.004 15.801 1.00 1.00 C ATOM 338 C LYS A 22 108.506 0.682 15.443 1.00 1.00 C ATOM 339 O LYS A 22 109.252 0.637 14.465 1.00 1.00 O ATOM 340 CB LYS A 22 106.532 2.180 14.953 1.00 1.00 C ATOM 341 CG LYS A 22 105.591 3.228 15.591 1.00 1.00 C ATOM 342 CD LYS A 22 104.137 2.972 15.176 1.00 1.00 C ATOM 343 CE LYS A 22 103.975 3.296 13.694 1.00 1.00 C ATOM 344 NZ LYS A 22 102.599 2.932 13.249 1.00 1.00 N ATOM 0 H LYS A 22 108.337 3.854 14.970 1.00 1.00 H new ATOM 0 HA LYS A 22 107.512 1.959 16.853 1.00 1.00 H new ATOM 0 HB2 LYS A 22 106.805 2.494 13.945 1.00 1.00 H new ATOM 0 HB3 LYS A 22 106.013 1.226 14.861 1.00 1.00 H new ATOM 0 HG2 LYS A 22 105.677 3.189 16.677 1.00 1.00 H new ATOM 0 HG3 LYS A 22 105.892 4.230 15.283 1.00 1.00 H new ATOM 0 HD2 LYS A 22 103.870 1.932 15.365 1.00 1.00 H new ATOM 0 HD3 LYS A 22 103.462 3.587 15.771 1.00 1.00 H new ATOM 0 HE2 LYS A 22 104.155 4.357 13.522 1.00 1.00 H new ATOM 0 HE3 LYS A 22 104.714 2.748 13.109 1.00 1.00 H new ATOM 0 HZ1 LYS A 22 102.491 3.154 12.239 1.00 1.00 H new ATOM 0 HZ2 LYS A 22 102.443 1.915 13.399 1.00 1.00 H new ATOM 0 HZ3 LYS A 22 101.902 3.473 13.799 1.00 1.00 H new ATOM 358 N PRO A 23 108.309 -0.394 16.200 1.00 1.00 N ATOM 359 CA PRO A 23 108.975 -1.708 15.907 1.00 1.00 C ATOM 360 C PRO A 23 108.701 -2.241 14.499 1.00 1.00 C ATOM 361 O PRO A 23 107.629 -2.029 13.928 1.00 1.00 O ATOM 362 CB PRO A 23 108.407 -2.674 16.961 1.00 1.00 C ATOM 363 CG PRO A 23 107.915 -1.802 18.064 1.00 1.00 C ATOM 364 CD PRO A 23 107.457 -0.498 17.409 1.00 1.00 C ATOM 0 HA PRO A 23 110.058 -1.597 15.951 1.00 1.00 H new ATOM 0 HB2 PRO A 23 107.600 -3.279 16.547 1.00 1.00 H new ATOM 0 HB3 PRO A 23 109.172 -3.364 17.316 1.00 1.00 H new ATOM 0 HG2 PRO A 23 107.093 -2.278 18.599 1.00 1.00 H new ATOM 0 HG3 PRO A 23 108.704 -1.615 18.793 1.00 1.00 H new ATOM 0 HD2 PRO A 23 106.398 -0.530 17.151 1.00 1.00 H new ATOM 0 HD3 PRO A 23 107.598 0.355 18.073 1.00 1.00 H new ATOM 372 N GLY A 24 109.687 -2.955 13.969 1.00 1.00 N ATOM 373 CA GLY A 24 109.593 -3.560 12.646 1.00 1.00 C ATOM 374 C GLY A 24 109.911 -2.567 11.543 1.00 1.00 C ATOM 375 O GLY A 24 110.231 -2.961 10.426 1.00 1.00 O ATOM 0 H GLY A 24 110.573 -3.131 14.443 1.00 1.00 H new ATOM 0 HA2 GLY A 24 110.280 -4.404 12.583 1.00 1.00 H new ATOM 0 HA3 GLY A 24 108.588 -3.956 12.499 1.00 1.00 H new ATOM 379 N VAL A 25 109.826 -1.282 11.857 1.00 1.00 N ATOM 380 CA VAL A 25 110.098 -0.246 10.867 1.00 1.00 C ATOM 381 C VAL A 25 111.596 0.024 10.758 1.00 1.00 C ATOM 382 O VAL A 25 112.302 0.113 11.764 1.00 1.00 O ATOM 383 CB VAL A 25 109.379 1.056 11.252 1.00 1.00 C ATOM 384 CG1 VAL A 25 109.574 2.122 10.169 1.00 1.00 C ATOM 385 CG2 VAL A 25 107.887 0.799 11.441 1.00 1.00 C ATOM 0 H VAL A 25 109.573 -0.932 12.781 1.00 1.00 H new ATOM 0 HA VAL A 25 109.731 -0.599 9.903 1.00 1.00 H new ATOM 0 HB VAL A 25 109.808 1.415 12.187 1.00 1.00 H new ATOM 0 HG11 VAL A 25 109.057 3.036 10.461 1.00 1.00 H new ATOM 0 HG12 VAL A 25 110.637 2.329 10.049 1.00 1.00 H new ATOM 0 HG13 VAL A 25 109.166 1.760 9.225 1.00 1.00 H new ATOM 0 HG21 VAL A 25 107.389 1.730 11.714 1.00 1.00 H new ATOM 0 HG22 VAL A 25 107.463 0.419 10.512 1.00 1.00 H new ATOM 0 HG23 VAL A 25 107.742 0.064 12.233 1.00 1.00 H new ATOM 389 N VAL A 26 112.059 0.185 9.522 1.00 1.00 N ATOM 390 CA VAL A 26 113.465 0.491 9.250 1.00 1.00 C ATOM 391 C VAL A 26 113.513 1.794 8.466 1.00 1.00 C ATOM 392 O VAL A 26 112.897 1.902 7.412 1.00 1.00 O ATOM 393 CB VAL A 26 114.093 -0.639 8.426 1.00 1.00 C ATOM 394 CG1 VAL A 26 115.490 -0.248 7.967 1.00 1.00 C ATOM 395 CG2 VAL A 26 114.167 -1.902 9.266 1.00 1.00 C ATOM 0 H VAL A 26 111.479 0.109 8.686 1.00 1.00 H new ATOM 0 HA VAL A 26 114.023 0.587 10.182 1.00 1.00 H new ATOM 0 HB VAL A 26 113.473 -0.820 7.548 1.00 1.00 H new ATOM 0 HG11 VAL A 26 115.922 -1.061 7.383 1.00 1.00 H new ATOM 0 HG12 VAL A 26 115.433 0.650 7.352 1.00 1.00 H new ATOM 0 HG13 VAL A 26 116.117 -0.053 8.837 1.00 1.00 H new ATOM 0 HG21 VAL A 26 114.614 -2.704 8.678 1.00 1.00 H new ATOM 0 HG22 VAL A 26 114.778 -1.716 10.150 1.00 1.00 H new ATOM 0 HG23 VAL A 26 113.163 -2.194 9.574 1.00 1.00 H new ATOM 399 N VAL A 27 114.221 2.795 8.991 1.00 1.00 N ATOM 400 CA VAL A 27 114.295 4.102 8.326 1.00 1.00 C ATOM 401 C VAL A 27 115.541 4.235 7.487 1.00 1.00 C ATOM 402 O VAL A 27 116.600 3.695 7.814 1.00 1.00 O ATOM 403 CB VAL A 27 114.207 5.239 9.358 1.00 1.00 C ATOM 404 CG1 VAL A 27 115.291 5.054 10.389 1.00 1.00 C ATOM 405 CG2 VAL A 27 114.343 6.623 8.702 1.00 1.00 C ATOM 0 H VAL A 27 114.746 2.731 9.863 1.00 1.00 H new ATOM 0 HA VAL A 27 113.442 4.176 7.652 1.00 1.00 H new ATOM 0 HB VAL A 27 113.224 5.196 9.828 1.00 1.00 H new ATOM 0 HG11 VAL A 27 115.235 5.857 11.124 1.00 1.00 H new ATOM 0 HG12 VAL A 27 115.158 4.094 10.889 1.00 1.00 H new ATOM 0 HG13 VAL A 27 116.265 5.077 9.901 1.00 1.00 H new ATOM 0 HG21 VAL A 27 114.275 7.396 9.467 1.00 1.00 H new ATOM 0 HG22 VAL A 27 115.307 6.694 8.199 1.00 1.00 H new ATOM 0 HG23 VAL A 27 113.543 6.761 7.975 1.00 1.00 H new ATOM 409 N LEU A 28 115.387 4.965 6.379 1.00 1.00 N ATOM 410 CA LEU A 28 116.487 5.184 5.445 1.00 1.00 C ATOM 411 C LEU A 28 116.894 6.657 5.415 1.00 1.00 C ATOM 412 O LEU A 28 116.156 7.510 5.910 1.00 1.00 O ATOM 413 CB LEU A 28 116.051 4.764 4.037 1.00 1.00 C ATOM 414 CG LEU A 28 115.684 3.283 3.986 1.00 1.00 C ATOM 415 CD1 LEU A 28 115.133 2.991 2.589 1.00 1.00 C ATOM 416 CD2 LEU A 28 116.932 2.425 4.227 1.00 1.00 C ATOM 0 H LEU A 28 114.511 5.413 6.110 1.00 1.00 H new ATOM 0 HA LEU A 28 117.339 4.589 5.774 1.00 1.00 H new ATOM 0 HB2 LEU A 28 115.195 5.363 3.725 1.00 1.00 H new ATOM 0 HB3 LEU A 28 116.856 4.966 3.330 1.00 1.00 H new ATOM 0 HG LEU A 28 114.946 3.049 4.754 1.00 1.00 H new ATOM 0 HD11 LEU A 28 114.860 1.938 2.518 1.00 1.00 H new ATOM 0 HD12 LEU A 28 114.252 3.607 2.409 1.00 1.00 H new ATOM 0 HD13 LEU A 28 115.894 3.220 1.843 1.00 1.00 H new ATOM 0 HD21 LEU A 28 116.661 1.370 4.189 1.00 1.00 H new ATOM 0 HD22 LEU A 28 117.674 2.637 3.457 1.00 1.00 H new ATOM 0 HD23 LEU A 28 117.350 2.657 5.207 1.00 1.00 H new ATOM 428 N PRO A 29 118.040 6.983 4.844 1.00 1.00 N ATOM 429 CA PRO A 29 118.507 8.390 4.765 1.00 1.00 C ATOM 430 C PRO A 29 117.546 9.254 3.950 1.00 1.00 C ATOM 431 O PRO A 29 117.414 10.454 4.194 1.00 1.00 O ATOM 432 CB PRO A 29 119.890 8.296 4.101 1.00 1.00 C ATOM 433 CG PRO A 29 120.302 6.879 4.290 1.00 1.00 C ATOM 434 CD PRO A 29 119.015 6.084 4.216 1.00 1.00 C ATOM 0 HA PRO A 29 118.554 8.866 5.744 1.00 1.00 H new ATOM 0 HB2 PRO A 29 119.841 8.557 3.044 1.00 1.00 H new ATOM 0 HB3 PRO A 29 120.600 8.980 4.565 1.00 1.00 H new ATOM 0 HG2 PRO A 29 121.004 6.566 3.518 1.00 1.00 H new ATOM 0 HG3 PRO A 29 120.799 6.737 5.250 1.00 1.00 H new ATOM 0 HD2 PRO A 29 118.744 5.849 3.187 1.00 1.00 H new ATOM 0 HD3 PRO A 29 119.094 5.137 4.749 1.00 1.00 H new ATOM 442 N SER A 30 116.884 8.630 2.975 1.00 1.00 N ATOM 443 CA SER A 30 115.946 9.344 2.125 1.00 1.00 C ATOM 444 C SER A 30 114.725 9.750 2.933 1.00 1.00 C ATOM 445 O SER A 30 113.907 10.556 2.488 1.00 1.00 O ATOM 446 CB SER A 30 115.514 8.452 0.956 1.00 1.00 C ATOM 447 OG SER A 30 116.636 7.721 0.483 1.00 1.00 O ATOM 0 H SER A 30 116.983 7.638 2.759 1.00 1.00 H new ATOM 0 HA SER A 30 116.433 10.237 1.733 1.00 1.00 H new ATOM 0 HB2 SER A 30 114.729 7.768 1.277 1.00 1.00 H new ATOM 0 HB3 SER A 30 115.098 9.061 0.153 1.00 1.00 H new ATOM 0 HG SER A 30 116.362 7.148 -0.264 1.00 1.00 H new ATOM 453 N GLY A 31 114.604 9.169 4.120 1.00 1.00 N ATOM 454 CA GLY A 31 113.476 9.447 4.995 1.00 1.00 C ATOM 455 C GLY A 31 112.387 8.414 4.774 1.00 1.00 C ATOM 456 O GLY A 31 111.355 8.432 5.441 1.00 1.00 O ATOM 0 H GLY A 31 115.276 8.501 4.498 1.00 1.00 H new ATOM 0 HA2 GLY A 31 113.799 9.431 6.036 1.00 1.00 H new ATOM 0 HA3 GLY A 31 113.088 10.446 4.797 1.00 1.00 H new ATOM 460 N LEU A 32 112.631 7.497 3.837 1.00 1.00 N ATOM 461 CA LEU A 32 111.659 6.455 3.543 1.00 1.00 C ATOM 462 C LEU A 32 111.800 5.355 4.580 1.00 1.00 C ATOM 463 O LEU A 32 112.911 4.930 4.896 1.00 1.00 O ATOM 464 CB LEU A 32 111.898 5.887 2.123 1.00 1.00 C ATOM 465 CG LEU A 32 110.825 4.856 1.660 1.00 1.00 C ATOM 466 CD1 LEU A 32 111.134 3.454 2.171 1.00 1.00 C ATOM 467 CD2 LEU A 32 109.424 5.260 2.106 1.00 1.00 C ATOM 0 H LEU A 32 113.483 7.458 3.278 1.00 1.00 H new ATOM 0 HA LEU A 32 110.651 6.868 3.579 1.00 1.00 H new ATOM 0 HB2 LEU A 32 111.923 6.713 1.412 1.00 1.00 H new ATOM 0 HB3 LEU A 32 112.879 5.412 2.094 1.00 1.00 H new ATOM 0 HG LEU A 32 110.857 4.848 0.571 1.00 1.00 H new ATOM 0 HD11 LEU A 32 110.364 2.764 1.828 1.00 1.00 H new ATOM 0 HD12 LEU A 32 112.104 3.134 1.791 1.00 1.00 H new ATOM 0 HD13 LEU A 32 111.156 3.460 3.261 1.00 1.00 H new ATOM 0 HD21 LEU A 32 108.705 4.516 1.764 1.00 1.00 H new ATOM 0 HD22 LEU A 32 109.392 5.322 3.194 1.00 1.00 H new ATOM 0 HD23 LEU A 32 109.172 6.231 1.680 1.00 1.00 H new ATOM 479 N GLN A 33 110.674 4.899 5.115 1.00 1.00 N ATOM 480 CA GLN A 33 110.679 3.849 6.127 1.00 1.00 C ATOM 481 C GLN A 33 109.854 2.663 5.684 1.00 1.00 C ATOM 482 O GLN A 33 108.767 2.830 5.142 1.00 1.00 O ATOM 483 CB GLN A 33 110.089 4.412 7.419 1.00 1.00 C ATOM 484 CG GLN A 33 110.981 5.538 7.958 1.00 1.00 C ATOM 485 CD GLN A 33 110.400 6.912 7.688 1.00 1.00 C ATOM 486 OE1 GLN A 33 109.461 7.065 6.907 1.00 1.00 O ATOM 487 NE2 GLN A 33 110.921 7.930 8.298 1.00 1.00 N ATOM 0 H GLN A 33 109.746 5.240 4.865 1.00 1.00 H new ATOM 0 HA GLN A 33 111.705 3.516 6.282 1.00 1.00 H new ATOM 0 HB2 GLN A 33 109.084 4.791 7.234 1.00 1.00 H new ATOM 0 HB3 GLN A 33 110.000 3.620 8.163 1.00 1.00 H new ATOM 0 HG2 GLN A 33 111.117 5.408 9.032 1.00 1.00 H new ATOM 0 HG3 GLN A 33 111.968 5.467 7.501 1.00 1.00 H new ATOM 0 HE21 GLN A 33 111.699 7.794 8.944 1.00 1.00 H new ATOM 0 HE22 GLN A 33 110.553 8.867 8.132 1.00 1.00 H new ATOM 496 N TYR A 34 110.365 1.455 5.940 1.00 1.00 N ATOM 497 CA TYR A 34 109.639 0.242 5.582 1.00 1.00 C ATOM 498 C TYR A 34 109.638 -0.746 6.723 1.00 1.00 C ATOM 499 O TYR A 34 110.602 -0.855 7.481 1.00 1.00 O ATOM 500 CB TYR A 34 110.224 -0.408 4.330 1.00 1.00 C ATOM 501 CG TYR A 34 111.646 -0.829 4.583 1.00 1.00 C ATOM 502 CD1 TYR A 34 111.897 -2.008 5.280 1.00 1.00 C ATOM 503 CD2 TYR A 34 112.709 -0.055 4.109 1.00 1.00 C ATOM 504 CE1 TYR A 34 113.213 -2.423 5.510 1.00 1.00 C ATOM 505 CE2 TYR A 34 114.026 -0.466 4.338 1.00 1.00 C ATOM 506 CZ TYR A 34 114.278 -1.652 5.038 1.00 1.00 C ATOM 507 OH TYR A 34 115.578 -2.061 5.262 1.00 1.00 O ATOM 0 H TYR A 34 111.267 1.296 6.388 1.00 1.00 H new ATOM 0 HA TYR A 34 108.610 0.532 5.370 1.00 1.00 H new ATOM 0 HB2 TYR A 34 109.625 -1.274 4.046 1.00 1.00 H new ATOM 0 HB3 TYR A 34 110.187 0.293 3.496 1.00 1.00 H new ATOM 0 HD1 TYR A 34 111.073 -2.604 5.644 1.00 1.00 H new ATOM 0 HD2 TYR A 34 112.514 0.859 3.567 1.00 1.00 H new ATOM 0 HE1 TYR A 34 113.405 -3.338 6.051 1.00 1.00 H new ATOM 0 HE2 TYR A 34 114.849 0.132 3.975 1.00 1.00 H new ATOM 0 HH TYR A 34 116.198 -1.412 4.867 1.00 1.00 H new ATOM 517 N LYS A 35 108.529 -1.467 6.827 1.00 1.00 N ATOM 518 CA LYS A 35 108.351 -2.464 7.859 1.00 1.00 C ATOM 519 C LYS A 35 107.943 -3.770 7.231 1.00 1.00 C ATOM 520 O LYS A 35 107.075 -3.805 6.365 1.00 1.00 O ATOM 521 CB LYS A 35 107.283 -2.002 8.845 1.00 1.00 C ATOM 522 CG LYS A 35 107.158 -2.984 10.013 1.00 1.00 C ATOM 523 CD LYS A 35 105.912 -3.848 9.860 1.00 1.00 C ATOM 524 CE LYS A 35 105.801 -4.765 11.066 1.00 1.00 C ATOM 525 NZ LYS A 35 105.624 -3.946 12.300 1.00 1.00 N ATOM 0 H LYS A 35 107.733 -1.373 6.197 1.00 1.00 H new ATOM 0 HA LYS A 35 109.290 -2.602 8.395 1.00 1.00 H new ATOM 0 HB2 LYS A 35 107.535 -1.011 9.223 1.00 1.00 H new ATOM 0 HB3 LYS A 35 106.324 -1.914 8.334 1.00 1.00 H new ATOM 0 HG2 LYS A 35 108.043 -3.618 10.057 1.00 1.00 H new ATOM 0 HG3 LYS A 35 107.112 -2.434 10.953 1.00 1.00 H new ATOM 0 HD2 LYS A 35 105.025 -3.220 9.781 1.00 1.00 H new ATOM 0 HD3 LYS A 35 105.970 -4.435 8.943 1.00 1.00 H new ATOM 0 HE2 LYS A 35 104.957 -5.444 10.943 1.00 1.00 H new ATOM 0 HE3 LYS A 35 106.696 -5.381 11.151 1.00 1.00 H new ATOM 0 HZ1 LYS A 35 104.859 -4.349 12.878 1.00 1.00 H new ATOM 0 HZ2 LYS A 35 106.508 -3.947 12.847 1.00 1.00 H new ATOM 0 HZ3 LYS A 35 105.381 -2.970 12.037 1.00 1.00 H new ATOM 539 N VAL A 36 108.599 -4.839 7.649 1.00 1.00 N ATOM 540 CA VAL A 36 108.322 -6.156 7.088 1.00 1.00 C ATOM 541 C VAL A 36 107.224 -6.885 7.851 1.00 1.00 C ATOM 542 O VAL A 36 107.429 -7.428 8.935 1.00 1.00 O ATOM 543 CB VAL A 36 109.621 -6.977 7.045 1.00 1.00 C ATOM 544 CG1 VAL A 36 110.316 -6.941 8.402 1.00 1.00 C ATOM 545 CG2 VAL A 36 109.325 -8.434 6.643 1.00 1.00 C ATOM 0 H VAL A 36 109.322 -4.825 8.369 1.00 1.00 H new ATOM 0 HA VAL A 36 107.950 -6.026 6.072 1.00 1.00 H new ATOM 0 HB VAL A 36 110.282 -6.536 6.299 1.00 1.00 H new ATOM 0 HG11 VAL A 36 111.234 -7.527 8.356 1.00 1.00 H new ATOM 0 HG12 VAL A 36 110.556 -5.910 8.661 1.00 1.00 H new ATOM 0 HG13 VAL A 36 109.655 -7.361 9.160 1.00 1.00 H new ATOM 0 HG21 VAL A 36 110.256 -9.001 6.618 1.00 1.00 H new ATOM 0 HG22 VAL A 36 108.647 -8.882 7.370 1.00 1.00 H new ATOM 0 HG23 VAL A 36 108.862 -8.452 5.656 1.00 1.00 H new ATOM 549 N ILE A 37 106.052 -6.916 7.248 1.00 1.00 N ATOM 550 CA ILE A 37 104.925 -7.605 7.839 1.00 1.00 C ATOM 551 C ILE A 37 105.186 -9.101 7.775 1.00 1.00 C ATOM 552 O ILE A 37 104.909 -9.843 8.716 1.00 1.00 O ATOM 553 CB ILE A 37 103.647 -7.280 7.065 1.00 1.00 C ATOM 554 CG1 ILE A 37 103.560 -5.778 6.758 1.00 1.00 C ATOM 555 CG2 ILE A 37 102.457 -7.699 7.905 1.00 1.00 C ATOM 556 CD1 ILE A 37 103.430 -4.926 8.017 1.00 1.00 C ATOM 0 H ILE A 37 105.857 -6.472 6.350 1.00 1.00 H new ATOM 0 HA ILE A 37 104.801 -7.285 8.874 1.00 1.00 H new ATOM 0 HB ILE A 37 103.654 -7.819 6.117 1.00 1.00 H new ATOM 0 HG12 ILE A 37 104.449 -5.472 6.207 1.00 1.00 H new ATOM 0 HG13 ILE A 37 102.704 -5.593 6.109 1.00 1.00 H new ATOM 0 HG21 ILE A 37 101.535 -7.474 7.368 1.00 1.00 H new ATOM 0 HG22 ILE A 37 102.510 -8.770 8.103 1.00 1.00 H new ATOM 0 HG23 ILE A 37 102.469 -7.155 8.849 1.00 1.00 H new ATOM 0 HD11 ILE A 37 103.373 -3.873 7.740 1.00 1.00 H new ATOM 0 HD12 ILE A 37 102.526 -5.209 8.556 1.00 1.00 H new ATOM 0 HD13 ILE A 37 104.299 -5.086 8.656 1.00 1.00 H new ATOM 563 N ASN A 38 105.717 -9.522 6.630 1.00 1.00 N ATOM 564 CA ASN A 38 106.027 -10.921 6.379 1.00 1.00 C ATOM 565 C ASN A 38 107.310 -11.019 5.571 1.00 1.00 C ATOM 566 O ASN A 38 107.439 -10.378 4.533 1.00 1.00 O ATOM 567 CB ASN A 38 104.900 -11.568 5.579 1.00 1.00 C ATOM 568 CG ASN A 38 103.596 -11.534 6.369 1.00 1.00 C ATOM 569 OD1 ASN A 38 102.910 -10.428 6.433 1.00 1.00 O flip ATOM 570 ND2 ASN A 38 103.197 -12.541 6.954 1.00 1.00 N flip ATOM 0 H ASN A 38 105.943 -8.901 5.853 1.00 1.00 H new ATOM 0 HA ASN A 38 106.143 -11.433 7.334 1.00 1.00 H new ATOM 0 HB2 ASN A 38 104.772 -11.045 4.632 1.00 1.00 H new ATOM 0 HB3 ASN A 38 105.161 -12.599 5.341 1.00 1.00 H new ATOM 0 HD21 ASN A 38 103.734 -13.407 6.904 1.00 1.00 H new ATOM 0 HD22 ASN A 38 102.329 -12.510 7.489 1.00 1.00 H new ATOM 577 N SER A 39 108.253 -11.819 6.040 1.00 1.00 N ATOM 578 CA SER A 39 109.515 -11.990 5.328 1.00 1.00 C ATOM 579 C SER A 39 109.395 -13.114 4.304 1.00 1.00 C ATOM 580 O SER A 39 108.913 -14.203 4.618 1.00 1.00 O ATOM 581 CB SER A 39 110.634 -12.313 6.314 1.00 1.00 C ATOM 582 OG SER A 39 110.673 -13.714 6.543 1.00 1.00 O ATOM 0 H SER A 39 108.173 -12.357 6.903 1.00 1.00 H new ATOM 0 HA SER A 39 109.750 -11.060 4.810 1.00 1.00 H new ATOM 0 HB2 SER A 39 111.591 -11.971 5.919 1.00 1.00 H new ATOM 0 HB3 SER A 39 110.470 -11.785 7.253 1.00 1.00 H new ATOM 0 HG SER A 39 109.892 -14.135 6.127 1.00 1.00 H new ATOM 588 N GLY A 40 109.840 -12.845 3.076 1.00 1.00 N ATOM 589 CA GLY A 40 109.790 -13.833 2.003 1.00 1.00 C ATOM 590 C GLY A 40 111.190 -14.098 1.469 1.00 1.00 C ATOM 591 O GLY A 40 111.534 -15.221 1.104 1.00 1.00 O ATOM 0 H GLY A 40 110.240 -11.948 2.801 1.00 1.00 H new ATOM 0 HA2 GLY A 40 109.352 -14.760 2.372 1.00 1.00 H new ATOM 0 HA3 GLY A 40 109.147 -13.475 1.199 1.00 1.00 H new ATOM 595 N ASN A 41 111.995 -13.044 1.444 1.00 1.00 N ATOM 596 CA ASN A 41 113.368 -13.145 0.971 1.00 1.00 C ATOM 597 C ASN A 41 113.421 -13.682 -0.455 1.00 1.00 C ATOM 598 O ASN A 41 114.384 -14.343 -0.844 1.00 1.00 O ATOM 599 CB ASN A 41 114.148 -14.061 1.908 1.00 1.00 C ATOM 600 CG ASN A 41 113.954 -13.589 3.345 1.00 1.00 C ATOM 601 OD1 ASN A 41 113.245 -12.516 3.578 1.00 1.00 O flip ATOM 602 ND2 ASN A 41 114.449 -14.218 4.280 1.00 1.00 N flip ATOM 0 H ASN A 41 111.720 -12.109 1.746 1.00 1.00 H new ATOM 0 HA ASN A 41 113.815 -12.151 0.966 1.00 1.00 H new ATOM 0 HB2 ASN A 41 113.804 -15.090 1.801 1.00 1.00 H new ATOM 0 HB3 ASN A 41 115.207 -14.050 1.649 1.00 1.00 H new ATOM 0 HD21 ASN A 41 115.002 -15.055 4.096 1.00 1.00 H new ATOM 0 HD22 ASN A 41 114.306 -13.902 5.239 1.00 1.00 H new ATOM 609 N GLY A 42 112.384 -13.385 -1.237 1.00 1.00 N ATOM 610 CA GLY A 42 112.322 -13.832 -2.621 1.00 1.00 C ATOM 611 C GLY A 42 112.921 -12.812 -3.568 1.00 1.00 C ATOM 612 O GLY A 42 113.653 -11.908 -3.169 1.00 1.00 O ATOM 0 H GLY A 42 111.579 -12.838 -0.933 1.00 1.00 H new ATOM 0 HA2 GLY A 42 112.854 -14.778 -2.722 1.00 1.00 H new ATOM 0 HA3 GLY A 42 111.284 -14.019 -2.897 1.00 1.00 H new ATOM 616 N VAL A 43 112.564 -12.970 -4.827 1.00 1.00 N ATOM 617 CA VAL A 43 113.007 -12.081 -5.877 1.00 1.00 C ATOM 618 C VAL A 43 112.360 -10.721 -5.698 1.00 1.00 C ATOM 619 O VAL A 43 111.596 -10.517 -4.767 1.00 1.00 O ATOM 620 CB VAL A 43 112.680 -12.669 -7.256 1.00 1.00 C ATOM 621 CG1 VAL A 43 113.347 -14.030 -7.388 1.00 1.00 C ATOM 622 CG2 VAL A 43 111.173 -12.825 -7.451 1.00 1.00 C ATOM 0 H VAL A 43 111.956 -13.723 -5.150 1.00 1.00 H new ATOM 0 HA VAL A 43 114.089 -11.965 -5.815 1.00 1.00 H new ATOM 0 HB VAL A 43 113.053 -11.985 -8.019 1.00 1.00 H new ATOM 0 HG11 VAL A 43 113.119 -14.454 -8.366 1.00 1.00 H new ATOM 0 HG12 VAL A 43 114.426 -13.918 -7.284 1.00 1.00 H new ATOM 0 HG13 VAL A 43 112.975 -14.695 -6.609 1.00 1.00 H new ATOM 0 HG21 VAL A 43 110.975 -13.244 -8.438 1.00 1.00 H new ATOM 0 HG22 VAL A 43 110.774 -13.492 -6.687 1.00 1.00 H new ATOM 0 HG23 VAL A 43 110.693 -11.850 -7.368 1.00 1.00 H new ATOM 626 N LYS A 44 112.655 -9.818 -6.614 1.00 1.00 N ATOM 627 CA LYS A 44 112.105 -8.460 -6.590 1.00 1.00 C ATOM 628 C LYS A 44 112.710 -7.640 -7.742 1.00 1.00 C ATOM 629 O LYS A 44 113.764 -7.987 -8.274 1.00 1.00 O ATOM 630 CB LYS A 44 112.347 -7.759 -5.216 1.00 1.00 C ATOM 631 CG LYS A 44 113.822 -7.331 -4.995 1.00 1.00 C ATOM 632 CD LYS A 44 114.618 -8.438 -4.260 1.00 1.00 C ATOM 633 CE LYS A 44 114.592 -8.215 -2.737 1.00 1.00 C ATOM 634 NZ LYS A 44 115.012 -9.470 -2.061 1.00 1.00 N ATOM 0 H LYS A 44 113.282 -9.997 -7.399 1.00 1.00 H new ATOM 0 HA LYS A 44 111.025 -8.525 -6.724 1.00 1.00 H new ATOM 0 HB2 LYS A 44 111.707 -6.879 -5.147 1.00 1.00 H new ATOM 0 HB3 LYS A 44 112.048 -8.434 -4.414 1.00 1.00 H new ATOM 0 HG2 LYS A 44 114.290 -7.119 -5.956 1.00 1.00 H new ATOM 0 HG3 LYS A 44 113.854 -6.409 -4.414 1.00 1.00 H new ATOM 0 HD2 LYS A 44 114.194 -9.414 -4.496 1.00 1.00 H new ATOM 0 HD3 LYS A 44 115.649 -8.445 -4.613 1.00 1.00 H new ATOM 0 HE2 LYS A 44 115.260 -7.398 -2.464 1.00 1.00 H new ATOM 0 HE3 LYS A 44 113.591 -7.930 -2.415 1.00 1.00 H new ATOM 0 HZ1 LYS A 44 115.146 -9.289 -1.046 1.00 1.00 H new ATOM 0 HZ2 LYS A 44 114.279 -10.196 -2.190 1.00 1.00 H new ATOM 0 HZ3 LYS A 44 115.906 -9.804 -2.474 1.00 1.00 H new ATOM 648 N PRO A 45 111.997 -6.626 -8.200 1.00 1.00 N ATOM 649 CA PRO A 45 112.393 -5.813 -9.397 1.00 1.00 C ATOM 650 C PRO A 45 113.307 -4.618 -9.157 1.00 1.00 C ATOM 651 O PRO A 45 113.340 -4.037 -8.082 1.00 1.00 O ATOM 652 CB PRO A 45 111.038 -5.336 -9.935 1.00 1.00 C ATOM 653 CG PRO A 45 110.125 -5.267 -8.746 1.00 1.00 C ATOM 654 CD PRO A 45 110.733 -6.121 -7.628 1.00 1.00 C ATOM 0 HA PRO A 45 112.998 -6.425 -10.066 1.00 1.00 H new ATOM 0 HB2 PRO A 45 111.129 -4.361 -10.415 1.00 1.00 H new ATOM 0 HB3 PRO A 45 110.651 -6.025 -10.685 1.00 1.00 H new ATOM 0 HG2 PRO A 45 110.008 -4.235 -8.416 1.00 1.00 H new ATOM 0 HG3 PRO A 45 109.132 -5.633 -9.007 1.00 1.00 H new ATOM 0 HD2 PRO A 45 110.911 -5.531 -6.729 1.00 1.00 H new ATOM 0 HD3 PRO A 45 110.069 -6.939 -7.346 1.00 1.00 H new ATOM 662 N GLY A 46 113.987 -4.229 -10.235 1.00 1.00 N ATOM 663 CA GLY A 46 114.846 -3.061 -10.233 1.00 1.00 C ATOM 664 C GLY A 46 114.030 -1.842 -10.608 1.00 1.00 C ATOM 665 O GLY A 46 112.846 -1.940 -10.922 1.00 1.00 O ATOM 0 H GLY A 46 113.953 -4.718 -11.129 1.00 1.00 H new ATOM 0 HA2 GLY A 46 115.293 -2.925 -9.248 1.00 1.00 H new ATOM 0 HA3 GLY A 46 115.665 -3.196 -10.939 1.00 1.00 H new ATOM 669 N LYS A 47 114.676 -0.705 -10.566 1.00 1.00 N ATOM 670 CA LYS A 47 114.030 0.554 -10.886 1.00 1.00 C ATOM 671 C LYS A 47 113.311 0.502 -12.219 1.00 1.00 C ATOM 672 O LYS A 47 112.383 1.273 -12.461 1.00 1.00 O ATOM 673 CB LYS A 47 115.072 1.688 -10.884 1.00 1.00 C ATOM 674 CG LYS A 47 115.904 1.726 -12.190 1.00 1.00 C ATOM 675 CD LYS A 47 116.784 0.476 -12.331 1.00 1.00 C ATOM 676 CE LYS A 47 117.766 0.362 -11.155 1.00 1.00 C ATOM 677 NZ LYS A 47 118.151 1.716 -10.667 1.00 1.00 N ATOM 0 H LYS A 47 115.660 -0.620 -10.311 1.00 1.00 H new ATOM 0 HA LYS A 47 113.277 0.747 -10.121 1.00 1.00 H new ATOM 0 HB2 LYS A 47 114.565 2.644 -10.751 1.00 1.00 H new ATOM 0 HB3 LYS A 47 115.741 1.561 -10.033 1.00 1.00 H new ATOM 0 HG2 LYS A 47 115.235 1.800 -13.047 1.00 1.00 H new ATOM 0 HG3 LYS A 47 116.532 2.617 -12.197 1.00 1.00 H new ATOM 0 HD2 LYS A 47 116.155 -0.413 -12.373 1.00 1.00 H new ATOM 0 HD3 LYS A 47 117.337 0.520 -13.269 1.00 1.00 H new ATOM 0 HE2 LYS A 47 117.309 -0.207 -10.345 1.00 1.00 H new ATOM 0 HE3 LYS A 47 118.655 -0.186 -11.467 1.00 1.00 H new ATOM 0 HZ1 LYS A 47 118.980 1.638 -10.044 1.00 1.00 H new ATOM 0 HZ2 LYS A 47 118.383 2.324 -11.478 1.00 1.00 H new ATOM 0 HZ3 LYS A 47 117.359 2.133 -10.138 1.00 1.00 H new ATOM 691 N SER A 48 113.767 -0.379 -13.096 1.00 1.00 N ATOM 692 CA SER A 48 113.176 -0.481 -14.442 1.00 1.00 C ATOM 693 C SER A 48 112.353 -1.753 -14.633 1.00 1.00 C ATOM 694 O SER A 48 111.674 -1.903 -15.650 1.00 1.00 O ATOM 695 CB SER A 48 114.305 -0.429 -15.472 1.00 1.00 C ATOM 696 OG SER A 48 114.581 0.929 -15.792 1.00 1.00 O ATOM 0 H SER A 48 114.532 -1.029 -12.914 1.00 1.00 H new ATOM 0 HA SER A 48 112.489 0.355 -14.573 1.00 1.00 H new ATOM 0 HB2 SER A 48 115.199 -0.911 -15.075 1.00 1.00 H new ATOM 0 HB3 SER A 48 114.020 -0.977 -16.370 1.00 1.00 H new ATOM 0 HG SER A 48 115.305 0.969 -16.451 1.00 1.00 H new ATOM 702 N ASP A 49 112.406 -2.662 -13.677 1.00 1.00 N ATOM 703 CA ASP A 49 111.637 -3.906 -13.809 1.00 1.00 C ATOM 704 C ASP A 49 110.206 -3.662 -13.363 1.00 1.00 C ATOM 705 O ASP A 49 109.911 -2.633 -12.755 1.00 1.00 O ATOM 706 CB ASP A 49 112.273 -5.018 -12.990 1.00 1.00 C ATOM 707 CG ASP A 49 113.590 -5.447 -13.629 1.00 1.00 C ATOM 708 OD1 ASP A 49 114.346 -6.142 -12.972 1.00 1.00 O ATOM 709 OD2 ASP A 49 113.826 -5.069 -14.765 1.00 1.00 O ATOM 0 H ASP A 49 112.954 -2.577 -12.821 1.00 1.00 H new ATOM 0 HA ASP A 49 111.637 -4.219 -14.853 1.00 1.00 H new ATOM 0 HB2 ASP A 49 112.448 -4.675 -11.970 1.00 1.00 H new ATOM 0 HB3 ASP A 49 111.595 -5.869 -12.928 1.00 1.00 H new ATOM 714 N THR A 50 109.312 -4.598 -13.676 1.00 1.00 N ATOM 715 CA THR A 50 107.904 -4.446 -13.303 1.00 1.00 C ATOM 716 C THR A 50 107.572 -5.355 -12.143 1.00 1.00 C ATOM 717 O THR A 50 108.204 -6.392 -11.941 1.00 1.00 O ATOM 718 CB THR A 50 106.990 -4.711 -14.500 1.00 1.00 C ATOM 719 OG1 THR A 50 107.480 -4.027 -15.641 1.00 1.00 O ATOM 720 CG2 THR A 50 105.576 -4.245 -14.194 1.00 1.00 C ATOM 0 H THR A 50 109.531 -5.458 -14.179 1.00 1.00 H new ATOM 0 HA THR A 50 107.735 -3.416 -12.987 1.00 1.00 H new ATOM 0 HB THR A 50 106.975 -5.782 -14.700 1.00 1.00 H new ATOM 0 HG1 THR A 50 106.892 -4.202 -16.405 1.00 1.00 H new ATOM 0 HG21 THR A 50 104.935 -4.439 -15.054 1.00 1.00 H new ATOM 0 HG22 THR A 50 105.194 -4.785 -13.328 1.00 1.00 H new ATOM 0 HG23 THR A 50 105.583 -3.176 -13.981 1.00 1.00 H new ATOM 728 N VAL A 51 106.608 -4.920 -11.343 1.00 1.00 N ATOM 729 CA VAL A 51 106.216 -5.652 -10.146 1.00 1.00 C ATOM 730 C VAL A 51 104.719 -5.881 -10.085 1.00 1.00 C ATOM 731 O VAL A 51 103.962 -5.166 -10.723 1.00 1.00 O ATOM 732 CB VAL A 51 106.668 -4.852 -8.913 1.00 1.00 C ATOM 733 CG1 VAL A 51 105.763 -3.646 -8.633 1.00 1.00 C ATOM 734 CG2 VAL A 51 106.720 -5.784 -7.707 1.00 1.00 C ATOM 0 H VAL A 51 106.081 -4.061 -11.502 1.00 1.00 H new ATOM 0 HA VAL A 51 106.693 -6.632 -10.169 1.00 1.00 H new ATOM 0 HB VAL A 51 107.661 -4.449 -9.113 1.00 1.00 H new ATOM 0 HG11 VAL A 51 106.126 -3.116 -7.753 1.00 1.00 H new ATOM 0 HG12 VAL A 51 105.775 -2.975 -9.492 1.00 1.00 H new ATOM 0 HG13 VAL A 51 104.744 -3.989 -8.455 1.00 1.00 H new ATOM 0 HG21 VAL A 51 107.040 -5.224 -6.828 1.00 1.00 H new ATOM 0 HG22 VAL A 51 105.730 -6.204 -7.529 1.00 1.00 H new ATOM 0 HG23 VAL A 51 107.427 -6.590 -7.901 1.00 1.00 H new ATOM 738 N THR A 52 104.297 -6.855 -9.274 1.00 1.00 N ATOM 739 CA THR A 52 102.869 -7.136 -9.089 1.00 1.00 C ATOM 740 C THR A 52 102.576 -7.139 -7.592 1.00 1.00 C ATOM 741 O THR A 52 103.186 -7.908 -6.851 1.00 1.00 O ATOM 742 CB THR A 52 102.535 -8.497 -9.692 1.00 1.00 C ATOM 743 OG1 THR A 52 102.871 -8.499 -11.071 1.00 1.00 O ATOM 744 CG2 THR A 52 101.047 -8.793 -9.529 1.00 1.00 C ATOM 0 H THR A 52 104.919 -7.460 -8.737 1.00 1.00 H new ATOM 0 HA THR A 52 102.263 -6.378 -9.585 1.00 1.00 H new ATOM 0 HB THR A 52 103.108 -9.266 -9.174 1.00 1.00 H new ATOM 0 HG1 THR A 52 103.227 -9.378 -11.320 1.00 1.00 H new ATOM 0 HG21 THR A 52 100.820 -9.767 -9.963 1.00 1.00 H new ATOM 0 HG22 THR A 52 100.791 -8.799 -8.469 1.00 1.00 H new ATOM 0 HG23 THR A 52 100.465 -8.024 -10.038 1.00 1.00 H new ATOM 752 N VAL A 53 101.684 -6.250 -7.129 1.00 1.00 N ATOM 753 CA VAL A 53 101.414 -6.158 -5.684 1.00 1.00 C ATOM 754 C VAL A 53 99.979 -5.736 -5.329 1.00 1.00 C ATOM 755 O VAL A 53 99.280 -5.131 -6.142 1.00 1.00 O ATOM 756 CB VAL A 53 102.354 -5.090 -5.105 1.00 1.00 C ATOM 757 CG1 VAL A 53 103.794 -5.366 -5.542 1.00 1.00 C ATOM 758 CG2 VAL A 53 101.948 -3.676 -5.619 1.00 1.00 C ATOM 0 H VAL A 53 101.152 -5.603 -7.711 1.00 1.00 H new ATOM 0 HA VAL A 53 101.566 -7.156 -5.273 1.00 1.00 H new ATOM 0 HB VAL A 53 102.279 -5.125 -4.018 1.00 1.00 H new ATOM 0 HG11 VAL A 53 104.453 -4.603 -5.127 1.00 1.00 H new ATOM 0 HG12 VAL A 53 104.102 -6.347 -5.181 1.00 1.00 H new ATOM 0 HG13 VAL A 53 103.855 -5.344 -6.630 1.00 1.00 H new ATOM 0 HG21 VAL A 53 102.623 -2.929 -5.201 1.00 1.00 H new ATOM 0 HG22 VAL A 53 102.011 -3.653 -6.707 1.00 1.00 H new ATOM 0 HG23 VAL A 53 100.926 -3.456 -5.309 1.00 1.00 H new ATOM 762 N GLU A 54 99.606 -5.948 -4.053 1.00 1.00 N ATOM 763 CA GLU A 54 98.299 -5.478 -3.534 1.00 1.00 C ATOM 764 C GLU A 54 98.615 -4.479 -2.411 1.00 1.00 C ATOM 765 O GLU A 54 99.675 -4.586 -1.793 1.00 1.00 O ATOM 766 CB GLU A 54 97.412 -6.600 -2.948 1.00 1.00 C ATOM 767 CG GLU A 54 97.428 -7.881 -3.805 1.00 1.00 C ATOM 768 CD GLU A 54 97.198 -9.124 -2.939 1.00 1.00 C ATOM 769 OE1 GLU A 54 96.904 -8.967 -1.764 1.00 1.00 O ATOM 770 OE2 GLU A 54 97.314 -10.216 -3.469 1.00 1.00 O ATOM 0 H GLU A 54 100.181 -6.436 -3.366 1.00 1.00 H new ATOM 0 HA GLU A 54 97.738 -5.049 -4.365 1.00 1.00 H new ATOM 0 HB2 GLU A 54 97.753 -6.838 -1.940 1.00 1.00 H new ATOM 0 HB3 GLU A 54 96.387 -6.239 -2.861 1.00 1.00 H new ATOM 0 HG2 GLU A 54 96.656 -7.820 -4.572 1.00 1.00 H new ATOM 0 HG3 GLU A 54 98.384 -7.965 -4.322 1.00 1.00 H new ATOM 777 N TYR A 55 97.756 -3.480 -2.154 1.00 1.00 N ATOM 778 CA TYR A 55 98.103 -2.509 -1.116 1.00 1.00 C ATOM 779 C TYR A 55 96.938 -1.660 -0.607 1.00 1.00 C ATOM 780 O TYR A 55 95.922 -1.503 -1.279 1.00 1.00 O ATOM 781 CB TYR A 55 99.127 -1.560 -1.720 1.00 1.00 C ATOM 782 CG TYR A 55 98.526 -0.971 -2.985 1.00 1.00 C ATOM 783 CD1 TYR A 55 97.626 0.101 -2.902 1.00 1.00 C ATOM 784 CD2 TYR A 55 98.836 -1.517 -4.229 1.00 1.00 C ATOM 785 CE1 TYR A 55 97.040 0.625 -4.060 1.00 1.00 C ATOM 786 CE2 TYR A 55 98.256 -0.988 -5.390 1.00 1.00 C ATOM 787 CZ TYR A 55 97.358 0.079 -5.306 1.00 1.00 C ATOM 788 OH TYR A 55 96.778 0.583 -6.453 1.00 1.00 O ATOM 0 H TYR A 55 96.863 -3.330 -2.624 1.00 1.00 H new ATOM 0 HA TYR A 55 98.464 -3.079 -0.260 1.00 1.00 H new ATOM 0 HB2 TYR A 55 99.379 -0.770 -1.013 1.00 1.00 H new ATOM 0 HB3 TYR A 55 100.052 -2.090 -1.948 1.00 1.00 H new ATOM 0 HD1 TYR A 55 97.384 0.525 -1.939 1.00 1.00 H new ATOM 0 HD2 TYR A 55 99.523 -2.347 -4.298 1.00 1.00 H new ATOM 0 HE1 TYR A 55 96.345 1.448 -3.991 1.00 1.00 H new ATOM 0 HE2 TYR A 55 98.504 -1.407 -6.354 1.00 1.00 H new ATOM 0 HH TYR A 55 96.684 1.555 -6.372 1.00 1.00 H new ATOM 798 N THR A 56 97.156 -1.036 0.569 1.00 1.00 N ATOM 799 CA THR A 56 96.188 -0.102 1.162 1.00 1.00 C ATOM 800 C THR A 56 96.902 1.212 1.458 1.00 1.00 C ATOM 801 O THR A 56 97.955 1.220 2.069 1.00 1.00 O ATOM 802 CB THR A 56 95.485 -0.662 2.422 1.00 1.00 C ATOM 803 OG1 THR A 56 94.391 -1.472 2.033 1.00 1.00 O ATOM 804 CG2 THR A 56 94.939 0.475 3.300 1.00 1.00 C ATOM 0 H THR A 56 98.000 -1.166 1.126 1.00 1.00 H new ATOM 0 HA THR A 56 95.386 0.059 0.441 1.00 1.00 H new ATOM 0 HB THR A 56 96.219 -1.239 2.985 1.00 1.00 H new ATOM 0 HG1 THR A 56 94.163 -2.086 2.762 1.00 1.00 H new ATOM 0 HG21 THR A 56 94.450 0.054 4.178 1.00 1.00 H new ATOM 0 HG22 THR A 56 95.761 1.118 3.615 1.00 1.00 H new ATOM 0 HG23 THR A 56 94.218 1.061 2.730 1.00 1.00 H new ATOM 812 N GLY A 57 96.329 2.327 1.013 1.00 1.00 N ATOM 813 CA GLY A 57 96.954 3.640 1.236 1.00 1.00 C ATOM 814 C GLY A 57 96.130 4.494 2.182 1.00 1.00 C ATOM 815 O GLY A 57 94.910 4.585 2.039 1.00 1.00 O ATOM 0 H GLY A 57 95.446 2.356 0.503 1.00 1.00 H new ATOM 0 HA2 GLY A 57 97.955 3.503 1.646 1.00 1.00 H new ATOM 0 HA3 GLY A 57 97.068 4.157 0.283 1.00 1.00 H new ATOM 819 N ARG A 58 96.795 5.135 3.150 1.00 1.00 N ATOM 820 CA ARG A 58 96.089 5.980 4.095 1.00 1.00 C ATOM 821 C ARG A 58 96.925 7.170 4.546 1.00 1.00 C ATOM 822 O ARG A 58 98.137 7.222 4.344 1.00 1.00 O ATOM 823 CB ARG A 58 95.630 5.161 5.311 1.00 1.00 C ATOM 824 CG ARG A 58 96.780 4.943 6.330 1.00 1.00 C ATOM 825 CD ARG A 58 96.219 4.370 7.634 1.00 1.00 C ATOM 826 NE ARG A 58 96.027 2.922 7.511 1.00 1.00 N ATOM 827 CZ ARG A 58 96.845 2.040 8.091 1.00 1.00 C ATOM 828 NH1 ARG A 58 97.890 2.437 8.765 1.00 1.00 N ATOM 829 NH2 ARG A 58 96.603 0.762 7.971 1.00 1.00 N ATOM 0 H ARG A 58 97.804 5.081 3.291 1.00 1.00 H new ATOM 0 HA ARG A 58 95.215 6.376 3.577 1.00 1.00 H new ATOM 0 HB2 ARG A 58 94.802 5.673 5.802 1.00 1.00 H new ATOM 0 HB3 ARG A 58 95.253 4.194 4.976 1.00 1.00 H new ATOM 0 HG2 ARG A 58 97.523 4.263 5.913 1.00 1.00 H new ATOM 0 HG3 ARG A 58 97.288 5.887 6.526 1.00 1.00 H new ATOM 0 HD2 ARG A 58 96.901 4.585 8.457 1.00 1.00 H new ATOM 0 HD3 ARG A 58 95.270 4.851 7.872 1.00 1.00 H new ATOM 0 HE ARG A 58 95.240 2.575 6.962 1.00 1.00 H new ATOM 0 HH11 ARG A 58 98.091 3.433 8.854 1.00 1.00 H new ATOM 0 HH12 ARG A 58 98.505 1.751 9.202 1.00 1.00 H new ATOM 0 HH21 ARG A 58 95.794 0.444 7.437 1.00 1.00 H new ATOM 0 HH22 ARG A 58 97.223 0.082 8.411 1.00 1.00 H new ATOM 843 N LEU A 59 96.243 8.102 5.195 1.00 1.00 N ATOM 844 CA LEU A 59 96.876 9.299 5.738 1.00 1.00 C ATOM 845 C LEU A 59 97.465 9.006 7.118 1.00 1.00 C ATOM 846 O LEU A 59 97.132 8.007 7.755 1.00 1.00 O ATOM 847 CB LEU A 59 95.821 10.418 5.876 1.00 1.00 C ATOM 848 CG LEU A 59 95.850 11.389 4.684 1.00 1.00 C ATOM 849 CD1 LEU A 59 95.193 10.750 3.466 1.00 1.00 C ATOM 850 CD2 LEU A 59 95.089 12.676 5.026 1.00 1.00 C ATOM 0 H LEU A 59 95.238 8.052 5.361 1.00 1.00 H new ATOM 0 HA LEU A 59 97.673 9.612 5.063 1.00 1.00 H new ATOM 0 HB2 LEU A 59 94.829 9.973 5.957 1.00 1.00 H new ATOM 0 HB3 LEU A 59 95.998 10.971 6.798 1.00 1.00 H new ATOM 0 HG LEU A 59 96.892 11.622 4.465 1.00 1.00 H new ATOM 0 HD11 LEU A 59 95.220 11.448 2.630 1.00 1.00 H new ATOM 0 HD12 LEU A 59 95.731 9.841 3.197 1.00 1.00 H new ATOM 0 HD13 LEU A 59 94.157 10.503 3.699 1.00 1.00 H new ATOM 0 HD21 LEU A 59 95.118 13.354 4.173 1.00 1.00 H new ATOM 0 HD22 LEU A 59 94.053 12.434 5.262 1.00 1.00 H new ATOM 0 HD23 LEU A 59 95.555 13.156 5.887 1.00 1.00 H new ATOM 862 N ILE A 60 98.321 9.910 7.571 1.00 1.00 N ATOM 863 CA ILE A 60 98.939 9.784 8.886 1.00 1.00 C ATOM 864 C ILE A 60 97.879 9.783 9.975 1.00 1.00 C ATOM 865 O ILE A 60 98.080 9.273 11.077 1.00 1.00 O ATOM 866 CB ILE A 60 99.907 10.957 9.149 1.00 1.00 C ATOM 867 CG1 ILE A 60 99.175 12.293 9.448 1.00 1.00 C ATOM 868 CG2 ILE A 60 100.832 11.163 7.955 1.00 1.00 C ATOM 869 CD1 ILE A 60 98.405 12.805 8.240 1.00 1.00 C ATOM 0 H ILE A 60 98.604 10.739 7.049 1.00 1.00 H new ATOM 0 HA ILE A 60 99.489 8.843 8.902 1.00 1.00 H new ATOM 0 HB ILE A 60 100.480 10.683 10.035 1.00 1.00 H new ATOM 0 HG12 ILE A 60 98.488 12.151 10.282 1.00 1.00 H new ATOM 0 HG13 ILE A 60 99.902 13.043 9.759 1.00 1.00 H new ATOM 0 HG21 ILE A 60 101.508 11.994 8.157 1.00 1.00 H new ATOM 0 HG22 ILE A 60 101.413 10.256 7.784 1.00 1.00 H new ATOM 0 HG23 ILE A 60 100.238 11.386 7.069 1.00 1.00 H new ATOM 0 HD11 ILE A 60 97.909 13.741 8.495 1.00 1.00 H new ATOM 0 HD12 ILE A 60 99.095 12.973 7.413 1.00 1.00 H new ATOM 0 HD13 ILE A 60 97.659 12.067 7.945 1.00 1.00 H new ATOM 876 N ASP A 61 96.772 10.417 9.647 1.00 1.00 N ATOM 877 CA ASP A 61 95.653 10.586 10.568 1.00 1.00 C ATOM 878 C ASP A 61 94.637 9.462 10.431 1.00 1.00 C ATOM 879 O ASP A 61 93.607 9.454 11.105 1.00 1.00 O ATOM 880 CB ASP A 61 94.990 11.932 10.290 1.00 1.00 C ATOM 881 CG ASP A 61 94.057 12.307 11.437 1.00 1.00 C ATOM 882 OD1 ASP A 61 92.862 12.112 11.289 1.00 1.00 O ATOM 883 OD2 ASP A 61 94.552 12.782 12.446 1.00 1.00 O ATOM 0 H ASP A 61 96.617 10.834 8.729 1.00 1.00 H new ATOM 0 HA ASP A 61 96.032 10.555 11.589 1.00 1.00 H new ATOM 0 HB2 ASP A 61 95.752 12.702 10.165 1.00 1.00 H new ATOM 0 HB3 ASP A 61 94.429 11.883 9.357 1.00 1.00 H new ATOM 888 N GLY A 62 94.943 8.498 9.575 1.00 1.00 N ATOM 889 CA GLY A 62 94.062 7.352 9.376 1.00 1.00 C ATOM 890 C GLY A 62 93.063 7.552 8.237 1.00 1.00 C ATOM 891 O GLY A 62 92.318 6.630 7.906 1.00 1.00 O ATOM 0 H GLY A 62 95.791 8.484 9.008 1.00 1.00 H new ATOM 0 HA2 GLY A 62 94.666 6.469 9.170 1.00 1.00 H new ATOM 0 HA3 GLY A 62 93.516 7.157 10.299 1.00 1.00 H new ATOM 895 N THR A 63 93.039 8.733 7.623 1.00 1.00 N ATOM 896 CA THR A 63 92.102 8.953 6.522 1.00 1.00 C ATOM 897 C THR A 63 92.496 8.102 5.323 1.00 1.00 C ATOM 898 O THR A 63 93.445 8.423 4.608 1.00 1.00 O ATOM 899 CB THR A 63 92.067 10.429 6.105 1.00 1.00 C ATOM 900 OG1 THR A 63 92.042 11.252 7.262 1.00 1.00 O ATOM 901 CG2 THR A 63 90.824 10.685 5.259 1.00 1.00 C ATOM 0 H THR A 63 93.634 9.527 7.857 1.00 1.00 H new ATOM 0 HA THR A 63 91.109 8.667 6.869 1.00 1.00 H new ATOM 0 HB THR A 63 92.956 10.665 5.521 1.00 1.00 H new ATOM 0 HG1 THR A 63 92.021 12.194 6.993 1.00 1.00 H new ATOM 0 HG21 THR A 63 90.796 11.733 4.961 1.00 1.00 H new ATOM 0 HG22 THR A 63 90.853 10.056 4.370 1.00 1.00 H new ATOM 0 HG23 THR A 63 89.933 10.449 5.841 1.00 1.00 H new ATOM 909 N VAL A 64 91.761 7.015 5.100 1.00 1.00 N ATOM 910 CA VAL A 64 92.055 6.136 3.975 1.00 1.00 C ATOM 911 C VAL A 64 91.567 6.754 2.693 1.00 1.00 C ATOM 912 O VAL A 64 90.380 7.040 2.537 1.00 1.00 O ATOM 913 CB VAL A 64 91.427 4.764 4.188 1.00 1.00 C ATOM 914 CG1 VAL A 64 91.719 3.847 3.001 1.00 1.00 C ATOM 915 CG2 VAL A 64 92.009 4.154 5.449 1.00 1.00 C ATOM 0 H VAL A 64 90.969 6.726 5.675 1.00 1.00 H new ATOM 0 HA VAL A 64 93.135 6.005 3.907 1.00 1.00 H new ATOM 0 HB VAL A 64 90.347 4.876 4.281 1.00 1.00 H new ATOM 0 HG11 VAL A 64 91.262 2.873 3.173 1.00 1.00 H new ATOM 0 HG12 VAL A 64 91.307 4.286 2.092 1.00 1.00 H new ATOM 0 HG13 VAL A 64 92.797 3.728 2.890 1.00 1.00 H new ATOM 0 HG21 VAL A 64 91.568 3.171 5.614 1.00 1.00 H new ATOM 0 HG22 VAL A 64 93.089 4.054 5.340 1.00 1.00 H new ATOM 0 HG23 VAL A 64 91.788 4.798 6.300 1.00 1.00 H new ATOM 919 N PHE A 65 92.508 6.978 1.776 1.00 1.00 N ATOM 920 CA PHE A 65 92.181 7.595 0.495 1.00 1.00 C ATOM 921 C PHE A 65 92.275 6.613 -0.658 1.00 1.00 C ATOM 922 O PHE A 65 91.793 6.891 -1.757 1.00 1.00 O ATOM 923 CB PHE A 65 93.060 8.818 0.264 1.00 1.00 C ATOM 924 CG PHE A 65 94.517 8.485 0.019 1.00 1.00 C ATOM 925 CD1 PHE A 65 95.315 8.064 1.080 1.00 1.00 C ATOM 926 CD2 PHE A 65 95.083 8.673 -1.249 1.00 1.00 C ATOM 927 CE1 PHE A 65 96.682 7.825 0.886 1.00 1.00 C ATOM 928 CE2 PHE A 65 96.448 8.427 -1.451 1.00 1.00 C ATOM 929 CZ PHE A 65 97.251 8.005 -0.380 1.00 1.00 C ATOM 0 H PHE A 65 93.493 6.743 1.896 1.00 1.00 H new ATOM 0 HA PHE A 65 91.141 7.917 0.535 1.00 1.00 H new ATOM 0 HB2 PHE A 65 92.675 9.374 -0.591 1.00 1.00 H new ATOM 0 HB3 PHE A 65 92.988 9.475 1.131 1.00 1.00 H new ATOM 0 HD1 PHE A 65 94.878 7.921 2.057 1.00 1.00 H new ATOM 0 HD2 PHE A 65 94.467 9.008 -2.071 1.00 1.00 H new ATOM 0 HE1 PHE A 65 97.296 7.502 1.713 1.00 1.00 H new ATOM 0 HE2 PHE A 65 96.882 8.562 -2.431 1.00 1.00 H new ATOM 0 HZ PHE A 65 98.304 7.820 -0.532 1.00 1.00 H new ATOM 939 N ASP A 66 92.853 5.455 -0.400 1.00 1.00 N ATOM 940 CA ASP A 66 92.950 4.434 -1.436 1.00 1.00 C ATOM 941 C ASP A 66 93.231 3.068 -0.845 1.00 1.00 C ATOM 942 O ASP A 66 93.829 2.952 0.224 1.00 1.00 O ATOM 943 CB ASP A 66 94.047 4.786 -2.434 1.00 1.00 C ATOM 944 CG ASP A 66 93.891 3.946 -3.698 1.00 1.00 C ATOM 945 OD1 ASP A 66 94.445 2.859 -3.737 1.00 1.00 O ATOM 946 OD2 ASP A 66 93.219 4.401 -4.609 1.00 1.00 O ATOM 0 H ASP A 66 93.257 5.197 0.500 1.00 1.00 H new ATOM 0 HA ASP A 66 91.988 4.400 -1.948 1.00 1.00 H new ATOM 0 HB2 ASP A 66 93.997 5.846 -2.683 1.00 1.00 H new ATOM 0 HB3 ASP A 66 95.026 4.609 -1.988 1.00 1.00 H new ATOM 951 N SER A 67 92.805 2.027 -1.556 1.00 1.00 N ATOM 952 CA SER A 67 93.036 0.672 -1.090 1.00 1.00 C ATOM 953 C SER A 67 92.951 -0.355 -2.213 1.00 1.00 C ATOM 954 O SER A 67 92.293 -0.140 -3.230 1.00 1.00 O ATOM 955 CB SER A 67 92.065 0.333 0.037 1.00 1.00 C ATOM 956 OG SER A 67 90.732 0.364 -0.459 1.00 1.00 O ATOM 0 H SER A 67 92.306 2.098 -2.443 1.00 1.00 H new ATOM 0 HA SER A 67 94.056 0.627 -0.708 1.00 1.00 H new ATOM 0 HB2 SER A 67 92.291 -0.654 0.441 1.00 1.00 H new ATOM 0 HB3 SER A 67 92.177 1.046 0.854 1.00 1.00 H new ATOM 0 HG SER A 67 90.109 0.145 0.265 1.00 1.00 H new ATOM 962 N THR A 68 93.647 -1.474 -2.008 1.00 1.00 N ATOM 963 CA THR A 68 93.686 -2.557 -2.991 1.00 1.00 C ATOM 964 C THR A 68 93.874 -3.898 -2.293 1.00 1.00 C ATOM 965 O THR A 68 93.258 -4.889 -2.658 1.00 1.00 O ATOM 966 CB THR A 68 94.844 -2.343 -3.971 1.00 1.00 C ATOM 967 OG1 THR A 68 94.721 -1.070 -4.591 1.00 1.00 O ATOM 968 CG2 THR A 68 94.824 -3.440 -5.040 1.00 1.00 C ATOM 0 H THR A 68 94.194 -1.654 -1.166 1.00 1.00 H new ATOM 0 HA THR A 68 92.741 -2.557 -3.534 1.00 1.00 H new ATOM 0 HB THR A 68 95.787 -2.387 -3.426 1.00 1.00 H new ATOM 0 HG1 THR A 68 95.612 -0.725 -4.809 1.00 1.00 H new ATOM 0 HG21 THR A 68 95.649 -3.285 -5.736 1.00 1.00 H new ATOM 0 HG22 THR A 68 94.929 -4.415 -4.563 1.00 1.00 H new ATOM 0 HG23 THR A 68 93.880 -3.402 -5.583 1.00 1.00 H new ATOM 976 N GLU A 69 94.727 -3.926 -1.285 1.00 1.00 N ATOM 977 CA GLU A 69 94.963 -5.162 -0.561 1.00 1.00 C ATOM 978 C GLU A 69 93.680 -5.619 0.096 1.00 1.00 C ATOM 979 O GLU A 69 93.471 -6.815 0.306 1.00 1.00 O ATOM 980 CB GLU A 69 96.096 -5.003 0.437 1.00 1.00 C ATOM 981 CG GLU A 69 95.800 -3.887 1.419 1.00 1.00 C ATOM 982 CD GLU A 69 94.881 -4.373 2.538 1.00 1.00 C ATOM 983 OE1 GLU A 69 94.536 -5.542 2.533 1.00 1.00 O ATOM 984 OE2 GLU A 69 94.540 -3.566 3.388 1.00 1.00 O ATOM 0 H GLU A 69 95.260 -3.122 -0.953 1.00 1.00 H new ATOM 0 HA GLU A 69 95.276 -5.935 -1.262 1.00 1.00 H new ATOM 0 HB2 GLU A 69 96.244 -5.938 0.977 1.00 1.00 H new ATOM 0 HB3 GLU A 69 97.025 -4.790 -0.092 1.00 1.00 H new ATOM 0 HG2 GLU A 69 96.732 -3.515 1.845 1.00 1.00 H new ATOM 0 HG3 GLU A 69 95.333 -3.052 0.897 1.00 1.00 H new ATOM 991 N LYS A 70 92.797 -4.670 0.391 1.00 1.00 N ATOM 992 CA LYS A 70 91.527 -5.022 0.988 1.00 1.00 C ATOM 993 C LYS A 70 90.843 -6.006 0.055 1.00 1.00 C ATOM 994 O LYS A 70 90.321 -7.036 0.476 1.00 1.00 O ATOM 995 CB LYS A 70 90.665 -3.773 1.168 1.00 1.00 C ATOM 996 CG LYS A 70 91.403 -2.766 2.054 1.00 1.00 C ATOM 997 CD LYS A 70 91.518 -3.224 3.525 1.00 1.00 C ATOM 998 CE LYS A 70 90.149 -3.596 4.105 1.00 1.00 C ATOM 999 NZ LYS A 70 90.212 -3.523 5.591 1.00 1.00 N ATOM 0 H LYS A 70 92.938 -3.673 0.228 1.00 1.00 H new ATOM 0 HA LYS A 70 91.675 -5.468 1.971 1.00 1.00 H new ATOM 0 HB2 LYS A 70 90.445 -3.327 0.198 1.00 1.00 H new ATOM 0 HB3 LYS A 70 89.710 -4.040 1.620 1.00 1.00 H new ATOM 0 HG2 LYS A 70 92.403 -2.601 1.652 1.00 1.00 H new ATOM 0 HG3 LYS A 70 90.883 -1.809 2.017 1.00 1.00 H new ATOM 0 HD2 LYS A 70 92.187 -4.082 3.589 1.00 1.00 H new ATOM 0 HD3 LYS A 70 91.963 -2.428 4.122 1.00 1.00 H new ATOM 0 HE2 LYS A 70 89.384 -2.918 3.728 1.00 1.00 H new ATOM 0 HE3 LYS A 70 89.868 -4.601 3.790 1.00 1.00 H new ATOM 0 HZ1 LYS A 70 89.285 -3.775 5.991 1.00 1.00 H new ATOM 0 HZ2 LYS A 70 90.932 -4.187 5.941 1.00 1.00 H new ATOM 0 HZ3 LYS A 70 90.463 -2.556 5.881 1.00 1.00 H new ATOM 1013 N THR A 71 90.922 -5.696 -1.235 1.00 1.00 N ATOM 1014 CA THR A 71 90.383 -6.569 -2.261 1.00 1.00 C ATOM 1015 C THR A 71 91.298 -7.780 -2.390 1.00 1.00 C ATOM 1016 O THR A 71 90.846 -8.895 -2.650 1.00 1.00 O ATOM 1017 CB THR A 71 90.292 -5.833 -3.600 1.00 1.00 C ATOM 1018 OG1 THR A 71 91.584 -5.466 -4.047 1.00 1.00 O ATOM 1019 CG2 THR A 71 89.430 -4.579 -3.444 1.00 1.00 C ATOM 0 H THR A 71 91.356 -4.844 -1.591 1.00 1.00 H new ATOM 0 HA THR A 71 89.378 -6.886 -1.983 1.00 1.00 H new ATOM 0 HB THR A 71 89.838 -6.498 -4.335 1.00 1.00 H new ATOM 0 HG1 THR A 71 92.060 -5.002 -3.327 1.00 1.00 H new ATOM 0 HG21 THR A 71 89.368 -4.059 -4.400 1.00 1.00 H new ATOM 0 HG22 THR A 71 88.429 -4.864 -3.121 1.00 1.00 H new ATOM 0 HG23 THR A 71 89.878 -3.920 -2.700 1.00 1.00 H new ATOM 1027 N GLY A 72 92.594 -7.543 -2.183 1.00 1.00 N ATOM 1028 CA GLY A 72 93.585 -8.603 -2.250 1.00 1.00 C ATOM 1029 C GLY A 72 93.959 -8.919 -3.684 1.00 1.00 C ATOM 1030 O GLY A 72 94.522 -9.976 -3.968 1.00 1.00 O ATOM 0 H GLY A 72 92.977 -6.622 -1.967 1.00 1.00 H new ATOM 0 HA2 GLY A 72 94.476 -8.306 -1.697 1.00 1.00 H new ATOM 0 HA3 GLY A 72 93.195 -9.499 -1.768 1.00 1.00 H new ATOM 1034 N LYS A 73 93.635 -8.004 -4.593 1.00 1.00 N ATOM 1035 CA LYS A 73 93.943 -8.210 -6.015 1.00 1.00 C ATOM 1036 C LYS A 73 95.186 -7.414 -6.420 1.00 1.00 C ATOM 1037 O LYS A 73 95.183 -6.187 -6.334 1.00 1.00 O ATOM 1038 CB LYS A 73 92.729 -7.780 -6.860 1.00 1.00 C ATOM 1039 CG LYS A 73 91.722 -8.947 -6.991 1.00 1.00 C ATOM 1040 CD LYS A 73 90.287 -8.411 -6.954 1.00 1.00 C ATOM 1041 CE LYS A 73 89.305 -9.568 -7.095 1.00 1.00 C ATOM 1042 NZ LYS A 73 89.542 -10.268 -8.390 1.00 1.00 N ATOM 0 H LYS A 73 93.166 -7.123 -4.381 1.00 1.00 H new ATOM 0 HA LYS A 73 94.152 -9.266 -6.189 1.00 1.00 H new ATOM 0 HB2 LYS A 73 92.242 -6.921 -6.398 1.00 1.00 H new ATOM 0 HB3 LYS A 73 93.060 -7.464 -7.849 1.00 1.00 H new ATOM 0 HG2 LYS A 73 91.894 -9.483 -7.924 1.00 1.00 H new ATOM 0 HG3 LYS A 73 91.873 -9.661 -6.181 1.00 1.00 H new ATOM 0 HD2 LYS A 73 90.110 -7.882 -6.017 1.00 1.00 H new ATOM 0 HD3 LYS A 73 90.136 -7.692 -7.759 1.00 1.00 H new ATOM 0 HE2 LYS A 73 89.426 -10.265 -6.266 1.00 1.00 H new ATOM 0 HE3 LYS A 73 88.281 -9.197 -7.052 1.00 1.00 H new ATOM 0 HZ1 LYS A 73 88.629 -10.512 -8.825 1.00 1.00 H new ATOM 0 HZ2 LYS A 73 90.075 -9.644 -9.029 1.00 1.00 H new ATOM 0 HZ3 LYS A 73 90.088 -11.137 -8.220 1.00 1.00 H new ATOM 1056 N PRO A 74 96.265 -8.074 -6.831 1.00 1.00 N ATOM 1057 CA PRO A 74 97.519 -7.370 -7.200 1.00 1.00 C ATOM 1058 C PRO A 74 97.370 -6.381 -8.348 1.00 1.00 C ATOM 1059 O PRO A 74 96.528 -6.535 -9.233 1.00 1.00 O ATOM 1060 CB PRO A 74 98.500 -8.492 -7.578 1.00 1.00 C ATOM 1061 CG PRO A 74 97.939 -9.718 -6.967 1.00 1.00 C ATOM 1062 CD PRO A 74 96.445 -9.539 -6.986 1.00 1.00 C ATOM 0 HA PRO A 74 97.857 -6.755 -6.366 1.00 1.00 H new ATOM 0 HB2 PRO A 74 98.584 -8.594 -8.660 1.00 1.00 H new ATOM 0 HB3 PRO A 74 99.501 -8.285 -7.199 1.00 1.00 H new ATOM 0 HG2 PRO A 74 98.234 -10.605 -7.528 1.00 1.00 H new ATOM 0 HG3 PRO A 74 98.304 -9.850 -5.948 1.00 1.00 H new ATOM 0 HD2 PRO A 74 96.010 -9.900 -7.918 1.00 1.00 H new ATOM 0 HD3 PRO A 74 95.965 -10.089 -6.177 1.00 1.00 H new ATOM 1070 N ALA A 75 98.246 -5.386 -8.315 1.00 1.00 N ATOM 1071 CA ALA A 75 98.317 -4.350 -9.336 1.00 1.00 C ATOM 1072 C ALA A 75 99.725 -4.371 -9.914 1.00 1.00 C ATOM 1073 O ALA A 75 100.675 -4.684 -9.194 1.00 1.00 O ATOM 1074 CB ALA A 75 98.043 -2.975 -8.727 1.00 1.00 C ATOM 0 H ALA A 75 98.934 -5.274 -7.571 1.00 1.00 H new ATOM 0 HA ALA A 75 97.570 -4.537 -10.107 1.00 1.00 H new ATOM 0 HB1 ALA A 75 98.101 -2.214 -9.505 1.00 1.00 H new ATOM 0 HB2 ALA A 75 97.047 -2.965 -8.283 1.00 1.00 H new ATOM 0 HB3 ALA A 75 98.785 -2.763 -7.957 1.00 1.00 H new ATOM 1080 N THR A 76 99.877 -4.058 -11.197 1.00 1.00 N ATOM 1081 CA THR A 76 101.202 -4.077 -11.815 1.00 1.00 C ATOM 1082 C THR A 76 101.752 -2.682 -12.021 1.00 1.00 C ATOM 1083 O THR A 76 101.099 -1.822 -12.616 1.00 1.00 O ATOM 1084 CB THR A 76 101.139 -4.797 -13.156 1.00 1.00 C ATOM 1085 OG1 THR A 76 102.228 -4.380 -13.966 1.00 1.00 O ATOM 1086 CG2 THR A 76 99.824 -4.461 -13.859 1.00 1.00 C ATOM 0 H THR A 76 99.115 -3.792 -11.821 1.00 1.00 H new ATOM 0 HA THR A 76 101.871 -4.606 -11.136 1.00 1.00 H new ATOM 0 HB THR A 76 101.196 -5.873 -12.992 1.00 1.00 H new ATOM 0 HG1 THR A 76 102.190 -4.843 -14.829 1.00 1.00 H new ATOM 0 HG21 THR A 76 99.782 -4.977 -14.818 1.00 1.00 H new ATOM 0 HG22 THR A 76 98.987 -4.780 -13.238 1.00 1.00 H new ATOM 0 HG23 THR A 76 99.764 -3.385 -14.023 1.00 1.00 H new ATOM 1094 N PHE A 77 102.980 -2.468 -11.539 1.00 1.00 N ATOM 1095 CA PHE A 77 103.640 -1.185 -11.685 1.00 1.00 C ATOM 1096 C PHE A 77 105.065 -1.364 -12.092 1.00 1.00 C ATOM 1097 O PHE A 77 105.741 -2.307 -11.686 1.00 1.00 O ATOM 1098 CB PHE A 77 103.691 -0.404 -10.379 1.00 1.00 C ATOM 1099 CG PHE A 77 102.319 -0.219 -9.797 1.00 1.00 C ATOM 1100 CD1 PHE A 77 102.089 -0.569 -8.467 1.00 1.00 C ATOM 1101 CD2 PHE A 77 101.291 0.318 -10.574 1.00 1.00 C ATOM 1102 CE1 PHE A 77 100.817 -0.389 -7.908 1.00 1.00 C ATOM 1103 CE2 PHE A 77 100.024 0.498 -10.022 1.00 1.00 C ATOM 1104 CZ PHE A 77 99.782 0.144 -8.690 1.00 1.00 C ATOM 0 H PHE A 77 103.530 -3.172 -11.046 1.00 1.00 H new ATOM 0 HA PHE A 77 103.058 -0.648 -12.434 1.00 1.00 H new ATOM 0 HB2 PHE A 77 104.323 -0.930 -9.664 1.00 1.00 H new ATOM 0 HB3 PHE A 77 104.148 0.570 -10.553 1.00 1.00 H new ATOM 0 HD1 PHE A 77 102.890 -0.978 -7.869 1.00 1.00 H new ATOM 0 HD2 PHE A 77 101.477 0.594 -11.601 1.00 1.00 H new ATOM 0 HE1 PHE A 77 100.634 -0.660 -6.879 1.00 1.00 H new ATOM 0 HE2 PHE A 77 99.228 0.911 -10.623 1.00 1.00 H new ATOM 0 HZ PHE A 77 98.799 0.281 -8.264 1.00 1.00 H new ATOM 1114 N GLN A 78 105.545 -0.382 -12.804 1.00 1.00 N ATOM 1115 CA GLN A 78 106.932 -0.349 -13.175 1.00 1.00 C ATOM 1116 C GLN A 78 107.619 0.478 -12.122 1.00 1.00 C ATOM 1117 O GLN A 78 107.218 1.607 -11.839 1.00 1.00 O ATOM 1118 CB GLN A 78 107.122 0.244 -14.567 1.00 1.00 C ATOM 1119 CG GLN A 78 106.827 -0.819 -15.617 1.00 1.00 C ATOM 1120 CD GLN A 78 107.216 -0.308 -16.992 1.00 1.00 C ATOM 1121 OE1 GLN A 78 107.745 0.872 -17.090 1.00 1.00 O flip ATOM 1122 NE2 GLN A 78 107.048 -1.004 -17.994 1.00 1.00 N flip ATOM 0 H GLN A 78 104.994 0.408 -13.140 1.00 1.00 H new ATOM 0 HA GLN A 78 107.354 -1.353 -13.225 1.00 1.00 H new ATOM 0 HB2 GLN A 78 106.459 1.099 -14.703 1.00 1.00 H new ATOM 0 HB3 GLN A 78 108.142 0.610 -14.682 1.00 1.00 H new ATOM 0 HG2 GLN A 78 107.379 -1.731 -15.389 1.00 1.00 H new ATOM 0 HG3 GLN A 78 105.768 -1.075 -15.601 1.00 1.00 H new ATOM 0 HE21 GLN A 78 106.631 -1.931 -17.907 1.00 1.00 H new ATOM 0 HE22 GLN A 78 107.326 -0.654 -18.911 1.00 1.00 H new ATOM 1131 N VAL A 79 108.615 -0.107 -11.495 1.00 1.00 N ATOM 1132 CA VAL A 79 109.297 0.571 -10.421 1.00 1.00 C ATOM 1133 C VAL A 79 109.692 1.984 -10.841 1.00 1.00 C ATOM 1134 O VAL A 79 109.839 2.859 -9.999 1.00 1.00 O ATOM 1135 CB VAL A 79 110.538 -0.221 -9.985 1.00 1.00 C ATOM 1136 CG1 VAL A 79 111.138 0.421 -8.755 1.00 1.00 C ATOM 1137 CG2 VAL A 79 110.157 -1.651 -9.629 1.00 1.00 C ATOM 0 H VAL A 79 108.966 -1.041 -11.709 1.00 1.00 H new ATOM 0 HA VAL A 79 108.614 0.640 -9.574 1.00 1.00 H new ATOM 0 HB VAL A 79 111.252 -0.222 -10.809 1.00 1.00 H new ATOM 0 HG11 VAL A 79 112.019 -0.141 -8.445 1.00 1.00 H new ATOM 0 HG12 VAL A 79 111.424 1.448 -8.983 1.00 1.00 H new ATOM 0 HG13 VAL A 79 110.404 0.419 -7.949 1.00 1.00 H new ATOM 0 HG21 VAL A 79 111.048 -2.199 -9.322 1.00 1.00 H new ATOM 0 HG22 VAL A 79 109.436 -1.643 -8.811 1.00 1.00 H new ATOM 0 HG23 VAL A 79 109.714 -2.137 -10.498 1.00 1.00 H new ATOM 1141 N SER A 80 109.864 2.214 -12.144 1.00 1.00 N ATOM 1142 CA SER A 80 110.255 3.541 -12.613 1.00 1.00 C ATOM 1143 C SER A 80 109.082 4.511 -12.637 1.00 1.00 C ATOM 1144 O SER A 80 109.269 5.727 -12.583 1.00 1.00 O ATOM 1145 CB SER A 80 110.863 3.449 -14.004 1.00 1.00 C ATOM 1146 OG SER A 80 110.987 4.755 -14.552 1.00 1.00 O ATOM 0 H SER A 80 109.742 1.515 -12.877 1.00 1.00 H new ATOM 0 HA SER A 80 110.993 3.925 -11.909 1.00 1.00 H new ATOM 0 HB2 SER A 80 111.840 2.969 -13.955 1.00 1.00 H new ATOM 0 HB3 SER A 80 110.236 2.831 -14.647 1.00 1.00 H new ATOM 0 HG SER A 80 111.380 4.698 -15.448 1.00 1.00 H new ATOM 1152 N GLN A 81 107.874 3.975 -12.738 1.00 1.00 N ATOM 1153 CA GLN A 81 106.674 4.818 -12.791 1.00 1.00 C ATOM 1154 C GLN A 81 106.015 4.967 -11.421 1.00 1.00 C ATOM 1155 O GLN A 81 105.083 5.751 -11.272 1.00 1.00 O ATOM 1156 CB GLN A 81 105.636 4.193 -13.722 1.00 1.00 C ATOM 1157 CG GLN A 81 106.223 3.929 -15.101 1.00 1.00 C ATOM 1158 CD GLN A 81 106.697 5.231 -15.733 1.00 1.00 C ATOM 1159 OE1 GLN A 81 105.901 6.147 -15.942 1.00 1.00 O ATOM 1160 NE2 GLN A 81 107.956 5.371 -16.046 1.00 1.00 N ATOM 0 H GLN A 81 107.693 2.972 -12.785 1.00 1.00 H new ATOM 0 HA GLN A 81 106.997 5.796 -13.148 1.00 1.00 H new ATOM 0 HB2 GLN A 81 105.274 3.259 -13.293 1.00 1.00 H new ATOM 0 HB3 GLN A 81 104.776 4.857 -13.811 1.00 1.00 H new ATOM 0 HG2 GLN A 81 107.057 3.231 -15.021 1.00 1.00 H new ATOM 0 HG3 GLN A 81 105.474 3.459 -15.738 1.00 1.00 H new ATOM 0 HE21 GLN A 81 108.613 4.610 -15.871 1.00 1.00 H new ATOM 0 HE22 GLN A 81 108.284 6.241 -16.465 1.00 1.00 H new ATOM 1169 N VAL A 82 106.459 4.178 -10.442 1.00 1.00 N ATOM 1170 CA VAL A 82 105.852 4.192 -9.107 1.00 1.00 C ATOM 1171 C VAL A 82 106.338 5.371 -8.250 1.00 1.00 C ATOM 1172 O VAL A 82 107.309 6.044 -8.596 1.00 1.00 O ATOM 1173 CB VAL A 82 106.151 2.831 -8.469 1.00 1.00 C ATOM 1174 CG1 VAL A 82 107.450 2.865 -7.714 1.00 1.00 C ATOM 1175 CG2 VAL A 82 105.050 2.413 -7.531 1.00 1.00 C ATOM 0 H VAL A 82 107.234 3.523 -10.546 1.00 1.00 H new ATOM 0 HA VAL A 82 104.775 4.344 -9.181 1.00 1.00 H new ATOM 0 HB VAL A 82 106.222 2.107 -9.280 1.00 1.00 H new ATOM 0 HG11 VAL A 82 107.639 1.887 -7.271 1.00 1.00 H new ATOM 0 HG12 VAL A 82 108.261 3.117 -8.397 1.00 1.00 H new ATOM 0 HG13 VAL A 82 107.393 3.616 -6.926 1.00 1.00 H new ATOM 0 HG21 VAL A 82 105.292 1.444 -7.095 1.00 1.00 H new ATOM 0 HG22 VAL A 82 104.948 3.153 -6.737 1.00 1.00 H new ATOM 0 HG23 VAL A 82 104.112 2.339 -8.081 1.00 1.00 H new ATOM 1179 N ILE A 83 105.640 5.619 -7.131 1.00 1.00 N ATOM 1180 CA ILE A 83 106.010 6.727 -6.238 1.00 1.00 C ATOM 1181 C ILE A 83 107.475 6.537 -5.787 1.00 1.00 C ATOM 1182 O ILE A 83 107.925 5.402 -5.642 1.00 1.00 O ATOM 1183 CB ILE A 83 105.040 6.813 -5.010 1.00 1.00 C ATOM 1184 CG1 ILE A 83 103.908 5.802 -5.159 1.00 1.00 C ATOM 1185 CG2 ILE A 83 104.406 8.221 -4.903 1.00 1.00 C ATOM 1186 CD1 ILE A 83 103.017 5.866 -3.925 1.00 1.00 C ATOM 0 H ILE A 83 104.831 5.078 -6.827 1.00 1.00 H new ATOM 0 HA ILE A 83 105.920 7.671 -6.776 1.00 1.00 H new ATOM 0 HB ILE A 83 105.627 6.602 -4.116 1.00 1.00 H new ATOM 0 HG12 ILE A 83 103.326 6.019 -6.055 1.00 1.00 H new ATOM 0 HG13 ILE A 83 104.314 4.798 -5.278 1.00 1.00 H new ATOM 0 HG21 ILE A 83 103.737 8.254 -4.043 1.00 1.00 H new ATOM 0 HG22 ILE A 83 105.192 8.966 -4.780 1.00 1.00 H new ATOM 0 HG23 ILE A 83 103.841 8.436 -5.810 1.00 1.00 H new ATOM 0 HD11 ILE A 83 102.205 5.146 -4.025 1.00 1.00 H new ATOM 0 HD12 ILE A 83 103.606 5.629 -3.039 1.00 1.00 H new ATOM 0 HD13 ILE A 83 102.602 6.869 -3.828 1.00 1.00 H new ATOM 1193 N PRO A 84 108.238 7.597 -5.572 1.00 1.00 N ATOM 1194 CA PRO A 84 109.668 7.464 -5.156 1.00 1.00 C ATOM 1195 C PRO A 84 109.863 6.500 -3.995 1.00 1.00 C ATOM 1196 O PRO A 84 110.762 5.662 -4.014 1.00 1.00 O ATOM 1197 CB PRO A 84 110.045 8.878 -4.711 1.00 1.00 C ATOM 1198 CG PRO A 84 109.149 9.788 -5.476 1.00 1.00 C ATOM 1199 CD PRO A 84 107.848 9.019 -5.700 1.00 1.00 C ATOM 0 HA PRO A 84 110.277 7.066 -5.968 1.00 1.00 H new ATOM 0 HB2 PRO A 84 109.906 9.002 -3.637 1.00 1.00 H new ATOM 0 HB3 PRO A 84 111.093 9.090 -4.923 1.00 1.00 H new ATOM 0 HG2 PRO A 84 108.966 10.709 -4.923 1.00 1.00 H new ATOM 0 HG3 PRO A 84 109.602 10.071 -6.426 1.00 1.00 H new ATOM 0 HD2 PRO A 84 107.092 9.292 -4.963 1.00 1.00 H new ATOM 0 HD3 PRO A 84 107.426 9.229 -6.683 1.00 1.00 H new ATOM 1207 N GLY A 85 109.031 6.630 -2.980 1.00 1.00 N ATOM 1208 CA GLY A 85 109.160 5.759 -1.824 1.00 1.00 C ATOM 1209 C GLY A 85 109.049 4.313 -2.258 1.00 1.00 C ATOM 1210 O GLY A 85 109.861 3.462 -1.893 1.00 1.00 O ATOM 0 H GLY A 85 108.275 7.313 -2.929 1.00 1.00 H new ATOM 0 HA2 GLY A 85 110.119 5.929 -1.334 1.00 1.00 H new ATOM 0 HA3 GLY A 85 108.384 5.990 -1.094 1.00 1.00 H new ATOM 1214 N TRP A 86 108.035 4.068 -3.059 1.00 1.00 N ATOM 1215 CA TRP A 86 107.774 2.745 -3.596 1.00 1.00 C ATOM 1216 C TRP A 86 108.917 2.313 -4.513 1.00 1.00 C ATOM 1217 O TRP A 86 109.265 1.141 -4.575 1.00 1.00 O ATOM 1218 CB TRP A 86 106.469 2.792 -4.397 1.00 1.00 C ATOM 1219 CG TRP A 86 105.273 2.525 -3.539 1.00 1.00 C ATOM 1220 CD1 TRP A 86 104.851 3.273 -2.497 1.00 1.00 C ATOM 1221 CD2 TRP A 86 104.316 1.454 -3.679 1.00 1.00 C ATOM 1222 NE1 TRP A 86 103.683 2.731 -2.001 1.00 1.00 N ATOM 1223 CE2 TRP A 86 103.314 1.604 -2.702 1.00 1.00 C ATOM 1224 CE3 TRP A 86 104.221 0.377 -4.558 1.00 1.00 C ATOM 1225 CZ2 TRP A 86 102.253 0.712 -2.615 1.00 1.00 C ATOM 1226 CZ3 TRP A 86 103.161 -0.516 -4.470 1.00 1.00 C ATOM 1227 CH2 TRP A 86 102.173 -0.351 -3.503 1.00 1.00 C ATOM 0 H TRP A 86 107.367 4.778 -3.358 1.00 1.00 H new ATOM 0 HA TRP A 86 107.691 2.029 -2.778 1.00 1.00 H new ATOM 0 HB2 TRP A 86 106.367 3.771 -4.866 1.00 1.00 H new ATOM 0 HB3 TRP A 86 106.510 2.056 -5.200 1.00 1.00 H new ATOM 0 HD1 TRP A 86 105.347 4.153 -2.114 1.00 1.00 H new ATOM 0 HE1 TRP A 86 103.159 3.116 -1.215 1.00 1.00 H new ATOM 0 HE3 TRP A 86 104.979 0.235 -5.315 1.00 1.00 H new ATOM 0 HZ2 TRP A 86 101.493 0.845 -1.859 1.00 1.00 H new ATOM 0 HZ3 TRP A 86 103.103 -1.346 -5.158 1.00 1.00 H new ATOM 0 HH2 TRP A 86 101.349 -1.047 -3.444 1.00 1.00 H new ATOM 1238 N THR A 87 109.473 3.266 -5.248 1.00 1.00 N ATOM 1239 CA THR A 87 110.534 2.955 -6.185 1.00 1.00 C ATOM 1240 C THR A 87 111.641 2.153 -5.518 1.00 1.00 C ATOM 1241 O THR A 87 112.007 1.081 -5.987 1.00 1.00 O ATOM 1242 CB THR A 87 111.119 4.262 -6.730 1.00 1.00 C ATOM 1243 OG1 THR A 87 110.063 5.103 -7.169 1.00 1.00 O ATOM 1244 CG2 THR A 87 112.052 3.968 -7.901 1.00 1.00 C ATOM 0 H THR A 87 109.208 4.250 -5.212 1.00 1.00 H new ATOM 0 HA THR A 87 110.115 2.356 -6.994 1.00 1.00 H new ATOM 0 HB THR A 87 111.682 4.759 -5.940 1.00 1.00 H new ATOM 0 HG1 THR A 87 109.355 5.120 -6.491 1.00 1.00 H new ATOM 0 HG21 THR A 87 112.463 4.903 -8.282 1.00 1.00 H new ATOM 0 HG22 THR A 87 112.865 3.324 -7.566 1.00 1.00 H new ATOM 0 HG23 THR A 87 111.495 3.467 -8.693 1.00 1.00 H new ATOM 1252 N GLU A 88 112.169 2.683 -4.430 1.00 1.00 N ATOM 1253 CA GLU A 88 113.244 2.014 -3.705 1.00 1.00 C ATOM 1254 C GLU A 88 112.755 0.785 -2.927 1.00 1.00 C ATOM 1255 O GLU A 88 113.438 -0.233 -2.875 1.00 1.00 O ATOM 1256 CB GLU A 88 113.906 3.006 -2.747 1.00 1.00 C ATOM 1257 CG GLU A 88 115.140 2.365 -2.106 1.00 1.00 C ATOM 1258 CD GLU A 88 115.794 3.348 -1.138 1.00 1.00 C ATOM 1259 OE1 GLU A 88 116.903 3.078 -0.708 1.00 1.00 O ATOM 1260 OE2 GLU A 88 115.174 4.357 -0.841 1.00 1.00 O ATOM 0 H GLU A 88 111.875 3.572 -4.026 1.00 1.00 H new ATOM 0 HA GLU A 88 113.965 1.660 -4.442 1.00 1.00 H new ATOM 0 HB2 GLU A 88 114.193 3.909 -3.286 1.00 1.00 H new ATOM 0 HB3 GLU A 88 113.198 3.307 -1.974 1.00 1.00 H new ATOM 0 HG2 GLU A 88 114.855 1.456 -1.577 1.00 1.00 H new ATOM 0 HG3 GLU A 88 115.852 2.074 -2.878 1.00 1.00 H new ATOM 1267 N ALA A 89 111.597 0.907 -2.286 1.00 1.00 N ATOM 1268 CA ALA A 89 111.055 -0.182 -1.464 1.00 1.00 C ATOM 1269 C ALA A 89 110.860 -1.491 -2.232 1.00 1.00 C ATOM 1270 O ALA A 89 111.223 -2.557 -1.734 1.00 1.00 O ATOM 1271 CB ALA A 89 109.718 0.236 -0.867 1.00 1.00 C ATOM 0 H ALA A 89 111.014 1.743 -2.316 1.00 1.00 H new ATOM 0 HA ALA A 89 111.795 -0.369 -0.685 1.00 1.00 H new ATOM 0 HB1 ALA A 89 109.321 -0.577 -0.258 1.00 1.00 H new ATOM 0 HB2 ALA A 89 109.858 1.120 -0.245 1.00 1.00 H new ATOM 0 HB3 ALA A 89 109.017 0.464 -1.670 1.00 1.00 H new ATOM 1277 N LEU A 90 110.270 -1.428 -3.422 1.00 1.00 N ATOM 1278 CA LEU A 90 110.030 -2.647 -4.189 1.00 1.00 C ATOM 1279 C LEU A 90 111.354 -3.343 -4.447 1.00 1.00 C ATOM 1280 O LEU A 90 111.462 -4.566 -4.363 1.00 1.00 O ATOM 1281 CB LEU A 90 109.406 -2.304 -5.542 1.00 1.00 C ATOM 1282 CG LEU A 90 108.066 -1.592 -5.356 1.00 1.00 C ATOM 1283 CD1 LEU A 90 107.690 -0.927 -6.676 1.00 1.00 C ATOM 1284 CD2 LEU A 90 106.981 -2.584 -4.964 1.00 1.00 C ATOM 0 H LEU A 90 109.955 -0.567 -3.869 1.00 1.00 H new ATOM 0 HA LEU A 90 109.357 -3.290 -3.622 1.00 1.00 H new ATOM 0 HB2 LEU A 90 110.085 -1.668 -6.110 1.00 1.00 H new ATOM 0 HB3 LEU A 90 109.261 -3.215 -6.123 1.00 1.00 H new ATOM 0 HG LEU A 90 108.156 -0.850 -4.562 1.00 1.00 H new ATOM 0 HD11 LEU A 90 106.735 -0.412 -6.565 1.00 1.00 H new ATOM 0 HD12 LEU A 90 108.460 -0.207 -6.953 1.00 1.00 H new ATOM 0 HD13 LEU A 90 107.605 -1.685 -7.454 1.00 1.00 H new ATOM 0 HD21 LEU A 90 106.035 -2.057 -4.836 1.00 1.00 H new ATOM 0 HD22 LEU A 90 106.875 -3.335 -5.746 1.00 1.00 H new ATOM 0 HD23 LEU A 90 107.254 -3.071 -4.028 1.00 1.00 H new ATOM 1296 N GLN A 91 112.355 -2.537 -4.774 1.00 1.00 N ATOM 1297 CA GLN A 91 113.681 -3.043 -5.065 1.00 1.00 C ATOM 1298 C GLN A 91 114.277 -3.724 -3.842 1.00 1.00 C ATOM 1299 O GLN A 91 115.164 -4.568 -3.960 1.00 1.00 O ATOM 1300 CB GLN A 91 114.577 -1.882 -5.479 1.00 1.00 C ATOM 1301 CG GLN A 91 113.986 -1.200 -6.712 1.00 1.00 C ATOM 1302 CD GLN A 91 114.765 0.076 -7.022 1.00 1.00 C ATOM 1303 OE1 GLN A 91 114.160 1.071 -7.609 1.00 1.00 O flip ATOM 1304 NE2 GLN A 91 115.944 0.184 -6.683 1.00 1.00 N flip ATOM 0 H GLN A 91 112.268 -1.523 -4.844 1.00 1.00 H new ATOM 0 HA GLN A 91 113.610 -3.773 -5.871 1.00 1.00 H new ATOM 0 HB2 GLN A 91 114.665 -1.167 -4.661 1.00 1.00 H new ATOM 0 HB3 GLN A 91 115.582 -2.243 -5.696 1.00 1.00 H new ATOM 0 HG2 GLN A 91 114.024 -1.876 -7.566 1.00 1.00 H new ATOM 0 HG3 GLN A 91 112.936 -0.963 -6.539 1.00 1.00 H new ATOM 0 HE21 GLN A 91 116.416 -0.595 -6.224 1.00 1.00 H new ATOM 0 HE22 GLN A 91 116.448 1.052 -6.861 1.00 1.00 H new ATOM 1313 N LEU A 92 113.792 -3.344 -2.661 1.00 1.00 N ATOM 1314 CA LEU A 92 114.294 -3.921 -1.412 1.00 1.00 C ATOM 1315 C LEU A 92 113.324 -4.939 -0.846 1.00 1.00 C ATOM 1316 O LEU A 92 113.673 -5.669 0.072 1.00 1.00 O ATOM 1317 CB LEU A 92 114.495 -2.820 -0.370 1.00 1.00 C ATOM 1318 CG LEU A 92 115.493 -1.770 -0.868 1.00 1.00 C ATOM 1319 CD1 LEU A 92 115.549 -0.639 0.144 1.00 1.00 C ATOM 1320 CD2 LEU A 92 116.884 -2.383 -1.033 1.00 1.00 C ATOM 0 H LEU A 92 113.058 -2.645 -2.541 1.00 1.00 H new ATOM 0 HA LEU A 92 115.240 -4.413 -1.637 1.00 1.00 H new ATOM 0 HB2 LEU A 92 113.540 -2.344 -0.150 1.00 1.00 H new ATOM 0 HB3 LEU A 92 114.855 -3.257 0.561 1.00 1.00 H new ATOM 0 HG LEU A 92 115.169 -1.395 -1.839 1.00 1.00 H new ATOM 0 HD11 LEU A 92 116.256 0.118 -0.195 1.00 1.00 H new ATOM 0 HD12 LEU A 92 114.560 -0.193 0.246 1.00 1.00 H new ATOM 0 HD13 LEU A 92 115.872 -1.030 1.109 1.00 1.00 H new ATOM 0 HD21 LEU A 92 117.578 -1.621 -1.387 1.00 1.00 H new ATOM 0 HD22 LEU A 92 117.228 -2.769 -0.073 1.00 1.00 H new ATOM 0 HD23 LEU A 92 116.839 -3.197 -1.756 1.00 1.00 H new ATOM 1332 N MET A 93 112.102 -4.968 -1.371 1.00 1.00 N ATOM 1333 CA MET A 93 111.089 -5.898 -0.871 1.00 1.00 C ATOM 1334 C MET A 93 111.161 -7.266 -1.584 1.00 1.00 C ATOM 1335 O MET A 93 110.780 -7.359 -2.751 1.00 1.00 O ATOM 1336 CB MET A 93 109.697 -5.302 -1.091 1.00 1.00 C ATOM 1337 CG MET A 93 108.640 -6.269 -0.546 1.00 1.00 C ATOM 1338 SD MET A 93 107.090 -5.379 -0.255 1.00 1.00 S ATOM 1339 CE MET A 93 106.548 -5.213 -1.974 1.00 1.00 C ATOM 0 H MET A 93 111.790 -4.367 -2.133 1.00 1.00 H new ATOM 0 HA MET A 93 111.280 -6.054 0.191 1.00 1.00 H new ATOM 0 HB2 MET A 93 109.618 -4.338 -0.589 1.00 1.00 H new ATOM 0 HB3 MET A 93 109.529 -5.123 -2.153 1.00 1.00 H new ATOM 0 HG2 MET A 93 108.477 -7.081 -1.254 1.00 1.00 H new ATOM 0 HG3 MET A 93 108.991 -6.721 0.382 1.00 1.00 H new ATOM 0 HE1 MET A 93 106.502 -4.157 -2.241 1.00 1.00 H new ATOM 0 HE2 MET A 93 107.255 -5.722 -2.629 1.00 1.00 H new ATOM 0 HE3 MET A 93 105.560 -5.659 -2.089 1.00 1.00 H new ATOM 1349 N PRO A 94 111.611 -8.333 -0.931 1.00 1.00 N ATOM 1350 CA PRO A 94 111.680 -9.689 -1.562 1.00 1.00 C ATOM 1351 C PRO A 94 110.300 -10.255 -1.872 1.00 1.00 C ATOM 1352 O PRO A 94 109.328 -9.983 -1.168 1.00 1.00 O ATOM 1353 CB PRO A 94 112.422 -10.553 -0.526 1.00 1.00 C ATOM 1354 CG PRO A 94 113.026 -9.595 0.439 1.00 1.00 C ATOM 1355 CD PRO A 94 112.098 -8.400 0.456 1.00 1.00 C ATOM 0 HA PRO A 94 112.188 -9.660 -2.526 1.00 1.00 H new ATOM 0 HB2 PRO A 94 111.737 -11.236 -0.023 1.00 1.00 H new ATOM 0 HB3 PRO A 94 113.188 -11.164 -1.003 1.00 1.00 H new ATOM 0 HG2 PRO A 94 113.113 -10.039 1.431 1.00 1.00 H new ATOM 0 HG3 PRO A 94 114.031 -9.307 0.130 1.00 1.00 H new ATOM 0 HD2 PRO A 94 111.280 -8.535 1.164 1.00 1.00 H new ATOM 0 HD3 PRO A 94 112.621 -7.488 0.744 1.00 1.00 H new ATOM 1363 N ALA A 95 110.230 -11.034 -2.939 1.00 1.00 N ATOM 1364 CA ALA A 95 108.969 -11.628 -3.350 1.00 1.00 C ATOM 1365 C ALA A 95 108.478 -12.634 -2.339 1.00 1.00 C ATOM 1366 O ALA A 95 109.226 -13.484 -1.857 1.00 1.00 O ATOM 1367 CB ALA A 95 109.091 -12.266 -4.728 1.00 1.00 C ATOM 0 H ALA A 95 111.026 -11.269 -3.533 1.00 1.00 H new ATOM 0 HA ALA A 95 108.232 -10.827 -3.407 1.00 1.00 H new ATOM 0 HB1 ALA A 95 108.134 -12.703 -5.012 1.00 1.00 H new ATOM 0 HB2 ALA A 95 109.374 -11.506 -5.457 1.00 1.00 H new ATOM 0 HB3 ALA A 95 109.853 -13.045 -4.702 1.00 1.00 H new ATOM 1373 N GLY A 96 107.203 -12.501 -2.004 1.00 1.00 N ATOM 1374 CA GLY A 96 106.573 -13.358 -1.026 1.00 1.00 C ATOM 1375 C GLY A 96 106.522 -12.623 0.298 1.00 1.00 C ATOM 1376 O GLY A 96 105.742 -12.963 1.187 1.00 1.00 O ATOM 0 H GLY A 96 106.583 -11.797 -2.404 1.00 1.00 H new ATOM 0 HA2 GLY A 96 105.567 -13.626 -1.349 1.00 1.00 H new ATOM 0 HA3 GLY A 96 107.132 -14.288 -0.921 1.00 1.00 H new ATOM 1380 N SER A 97 107.363 -11.590 0.415 1.00 1.00 N ATOM 1381 CA SER A 97 107.408 -10.789 1.625 1.00 1.00 C ATOM 1382 C SER A 97 106.409 -9.649 1.542 1.00 1.00 C ATOM 1383 O SER A 97 106.307 -8.969 0.520 1.00 1.00 O ATOM 1384 CB SER A 97 108.818 -10.218 1.811 1.00 1.00 C ATOM 1385 OG SER A 97 108.915 -8.984 1.113 1.00 1.00 O ATOM 0 H SER A 97 108.015 -11.297 -0.313 1.00 1.00 H new ATOM 0 HA SER A 97 107.152 -11.422 2.474 1.00 1.00 H new ATOM 0 HB2 SER A 97 109.026 -10.068 2.870 1.00 1.00 H new ATOM 0 HB3 SER A 97 109.561 -10.922 1.436 1.00 1.00 H new ATOM 0 HG SER A 97 108.732 -9.131 0.162 1.00 1.00 H new ATOM 1391 N THR A 98 105.692 -9.427 2.639 1.00 1.00 N ATOM 1392 CA THR A 98 104.713 -8.347 2.709 1.00 1.00 C ATOM 1393 C THR A 98 105.229 -7.250 3.607 1.00 1.00 C ATOM 1394 O THR A 98 105.423 -7.462 4.802 1.00 1.00 O ATOM 1395 CB THR A 98 103.383 -8.856 3.251 1.00 1.00 C ATOM 1396 OG1 THR A 98 102.903 -9.911 2.429 1.00 1.00 O ATOM 1397 CG2 THR A 98 102.386 -7.707 3.243 1.00 1.00 C ATOM 0 H THR A 98 105.770 -9.981 3.492 1.00 1.00 H new ATOM 0 HA THR A 98 104.557 -7.960 1.702 1.00 1.00 H new ATOM 0 HB THR A 98 103.513 -9.231 4.266 1.00 1.00 H new ATOM 0 HG1 THR A 98 102.762 -9.578 1.518 1.00 1.00 H new ATOM 0 HG21 THR A 98 101.427 -8.054 3.628 1.00 1.00 H new ATOM 0 HG22 THR A 98 102.758 -6.898 3.872 1.00 1.00 H new ATOM 0 HG23 THR A 98 102.257 -7.344 2.223 1.00 1.00 H new ATOM 1405 N TRP A 99 105.490 -6.078 3.029 1.00 1.00 N ATOM 1406 CA TRP A 99 106.020 -4.953 3.800 1.00 1.00 C ATOM 1407 C TRP A 99 105.030 -3.796 3.839 1.00 1.00 C ATOM 1408 O TRP A 99 104.091 -3.723 3.045 1.00 1.00 O ATOM 1409 CB TRP A 99 107.309 -4.398 3.161 1.00 1.00 C ATOM 1410 CG TRP A 99 108.477 -5.339 3.254 1.00 1.00 C ATOM 1411 CD1 TRP A 99 108.460 -6.633 3.661 1.00 1.00 C ATOM 1412 CD2 TRP A 99 109.863 -5.038 2.936 1.00 1.00 C ATOM 1413 NE1 TRP A 99 109.739 -7.141 3.612 1.00 1.00 N ATOM 1414 CE2 TRP A 99 110.645 -6.195 3.168 1.00 1.00 C ATOM 1415 CE3 TRP A 99 110.509 -3.875 2.468 1.00 1.00 C ATOM 1416 CZ2 TRP A 99 112.021 -6.200 2.949 1.00 1.00 C ATOM 1417 CZ3 TRP A 99 111.897 -3.879 2.247 1.00 1.00 C ATOM 1418 CH2 TRP A 99 112.650 -5.039 2.486 1.00 1.00 C ATOM 0 H TRP A 99 105.345 -5.883 2.038 1.00 1.00 H new ATOM 0 HA TRP A 99 106.213 -5.337 4.802 1.00 1.00 H new ATOM 0 HB2 TRP A 99 107.117 -4.172 2.112 1.00 1.00 H new ATOM 0 HB3 TRP A 99 107.570 -3.458 3.647 1.00 1.00 H new ATOM 0 HD1 TRP A 99 107.582 -7.179 3.974 1.00 1.00 H new ATOM 0 HE1 TRP A 99 109.987 -8.096 3.871 1.00 1.00 H new ATOM 0 HE3 TRP A 99 109.936 -2.979 2.279 1.00 1.00 H new ATOM 0 HZ2 TRP A 99 112.598 -7.094 3.135 1.00 1.00 H new ATOM 0 HZ3 TRP A 99 112.387 -2.985 1.891 1.00 1.00 H new ATOM 0 HH2 TRP A 99 113.716 -5.036 2.312 1.00 1.00 H new ATOM 1429 N GLU A 100 105.327 -2.854 4.725 1.00 1.00 N ATOM 1430 CA GLU A 100 104.569 -1.616 4.861 1.00 1.00 C ATOM 1431 C GLU A 100 105.566 -0.487 4.780 1.00 1.00 C ATOM 1432 O GLU A 100 106.558 -0.508 5.503 1.00 1.00 O ATOM 1433 CB GLU A 100 103.822 -1.530 6.197 1.00 1.00 C ATOM 1434 CG GLU A 100 102.551 -2.368 6.137 1.00 1.00 C ATOM 1435 CD GLU A 100 101.862 -2.376 7.497 1.00 1.00 C ATOM 1436 OE1 GLU A 100 100.833 -3.021 7.614 1.00 1.00 O ATOM 1437 OE2 GLU A 100 102.374 -1.735 8.401 1.00 1.00 O ATOM 0 H GLU A 100 106.109 -2.928 5.376 1.00 1.00 H new ATOM 0 HA GLU A 100 103.816 -1.568 4.074 1.00 1.00 H new ATOM 0 HB2 GLU A 100 104.463 -1.883 7.005 1.00 1.00 H new ATOM 0 HB3 GLU A 100 103.573 -0.492 6.418 1.00 1.00 H new ATOM 0 HG2 GLU A 100 101.876 -1.965 5.382 1.00 1.00 H new ATOM 0 HG3 GLU A 100 102.793 -3.388 5.837 1.00 1.00 H new ATOM 1444 N ILE A 101 105.327 0.495 3.908 1.00 1.00 N ATOM 1445 CA ILE A 101 106.256 1.603 3.775 1.00 1.00 C ATOM 1446 C ILE A 101 105.545 2.913 4.013 1.00 1.00 C ATOM 1447 O ILE A 101 104.414 3.126 3.581 1.00 1.00 O ATOM 1448 CB ILE A 101 106.995 1.556 2.422 1.00 1.00 C ATOM 1449 CG1 ILE A 101 106.215 2.236 1.295 1.00 1.00 C ATOM 1450 CG2 ILE A 101 107.227 0.087 2.061 1.00 1.00 C ATOM 1451 CD1 ILE A 101 107.096 2.248 0.056 1.00 1.00 C ATOM 0 H ILE A 101 104.512 0.541 3.297 1.00 1.00 H new ATOM 0 HA ILE A 101 107.026 1.512 4.541 1.00 1.00 H new ATOM 0 HB ILE A 101 107.934 2.100 2.529 1.00 1.00 H new ATOM 0 HG12 ILE A 101 105.286 1.701 1.097 1.00 1.00 H new ATOM 0 HG13 ILE A 101 105.943 3.253 1.579 1.00 1.00 H new ATOM 0 HG21 ILE A 101 107.749 0.025 1.106 1.00 1.00 H new ATOM 0 HG22 ILE A 101 107.830 -0.387 2.836 1.00 1.00 H new ATOM 0 HG23 ILE A 101 106.268 -0.425 1.984 1.00 1.00 H new ATOM 0 HD11 ILE A 101 106.563 2.728 -0.765 1.00 1.00 H new ATOM 0 HD12 ILE A 101 108.012 2.800 0.266 1.00 1.00 H new ATOM 0 HD13 ILE A 101 107.345 1.224 -0.223 1.00 1.00 H new ATOM 1458 N TYR A 102 106.232 3.772 4.744 1.00 1.00 N ATOM 1459 CA TYR A 102 105.718 5.065 5.124 1.00 1.00 C ATOM 1460 C TYR A 102 106.496 6.078 4.310 1.00 1.00 C ATOM 1461 O TYR A 102 107.685 6.303 4.541 1.00 1.00 O ATOM 1462 CB TYR A 102 105.957 5.265 6.632 1.00 1.00 C ATOM 1463 CG TYR A 102 105.355 4.109 7.445 1.00 1.00 C ATOM 1464 CD1 TYR A 102 105.688 2.771 7.168 1.00 1.00 C ATOM 1465 CD2 TYR A 102 104.457 4.379 8.485 1.00 1.00 C ATOM 1466 CE1 TYR A 102 105.133 1.731 7.909 1.00 1.00 C ATOM 1467 CE2 TYR A 102 103.902 3.331 9.234 1.00 1.00 C ATOM 1468 CZ TYR A 102 104.239 2.007 8.944 1.00 1.00 C ATOM 1469 OH TYR A 102 103.688 0.978 9.679 1.00 1.00 O ATOM 0 H TYR A 102 107.172 3.585 5.092 1.00 1.00 H new ATOM 0 HA TYR A 102 104.649 5.167 4.938 1.00 1.00 H new ATOM 0 HB2 TYR A 102 107.027 5.333 6.828 1.00 1.00 H new ATOM 0 HB3 TYR A 102 105.514 6.208 6.952 1.00 1.00 H new ATOM 0 HD1 TYR A 102 106.382 2.548 6.371 1.00 1.00 H new ATOM 0 HD2 TYR A 102 104.190 5.401 8.712 1.00 1.00 H new ATOM 0 HE1 TYR A 102 105.395 0.708 7.682 1.00 1.00 H new ATOM 0 HE2 TYR A 102 103.213 3.548 10.037 1.00 1.00 H new ATOM 0 HH TYR A 102 103.347 0.288 9.072 1.00 1.00 H new ATOM 1479 N VAL A 103 105.837 6.600 3.283 1.00 1.00 N ATOM 1480 CA VAL A 103 106.485 7.497 2.338 1.00 1.00 C ATOM 1481 C VAL A 103 106.405 8.976 2.693 1.00 1.00 C ATOM 1482 O VAL A 103 105.327 9.569 2.642 1.00 1.00 O ATOM 1483 CB VAL A 103 105.870 7.335 0.955 1.00 1.00 C ATOM 1484 CG1 VAL A 103 106.763 8.031 -0.072 1.00 1.00 C ATOM 1485 CG2 VAL A 103 105.738 5.852 0.610 1.00 1.00 C ATOM 0 H VAL A 103 104.853 6.417 3.084 1.00 1.00 H new ATOM 0 HA VAL A 103 107.536 7.208 2.368 1.00 1.00 H new ATOM 0 HB VAL A 103 104.877 7.785 0.943 1.00 1.00 H new ATOM 0 HG11 VAL A 103 106.330 7.920 -1.066 1.00 1.00 H new ATOM 0 HG12 VAL A 103 106.842 9.090 0.173 1.00 1.00 H new ATOM 0 HG13 VAL A 103 107.755 7.580 -0.056 1.00 1.00 H new ATOM 0 HG21 VAL A 103 105.297 5.747 -0.381 1.00 1.00 H new ATOM 0 HG22 VAL A 103 106.724 5.387 0.620 1.00 1.00 H new ATOM 0 HG23 VAL A 103 105.099 5.363 1.345 1.00 1.00 H new ATOM 1489 N PRO A 104 107.525 9.605 2.963 1.00 1.00 N ATOM 1490 CA PRO A 104 107.545 11.064 3.230 1.00 1.00 C ATOM 1491 C PRO A 104 106.811 11.806 2.114 1.00 1.00 C ATOM 1492 O PRO A 104 106.896 11.419 0.947 1.00 1.00 O ATOM 1493 CB PRO A 104 109.046 11.415 3.220 1.00 1.00 C ATOM 1494 CG PRO A 104 109.773 10.137 3.524 1.00 1.00 C ATOM 1495 CD PRO A 104 108.872 9.003 3.068 1.00 1.00 C ATOM 0 HA PRO A 104 107.056 11.339 4.164 1.00 1.00 H new ATOM 0 HB2 PRO A 104 109.347 11.814 2.251 1.00 1.00 H new ATOM 0 HB3 PRO A 104 109.273 12.179 3.964 1.00 1.00 H new ATOM 0 HG2 PRO A 104 110.730 10.103 3.004 1.00 1.00 H new ATOM 0 HG3 PRO A 104 109.986 10.057 4.590 1.00 1.00 H new ATOM 0 HD2 PRO A 104 109.200 8.599 2.110 1.00 1.00 H new ATOM 0 HD3 PRO A 104 108.882 8.179 3.782 1.00 1.00 H new ATOM 1503 N SER A 105 106.074 12.847 2.466 1.00 1.00 N ATOM 1504 CA SER A 105 105.325 13.584 1.462 1.00 1.00 C ATOM 1505 C SER A 105 106.207 13.923 0.263 1.00 1.00 C ATOM 1506 O SER A 105 105.737 13.946 -0.875 1.00 1.00 O ATOM 1507 CB SER A 105 104.756 14.868 2.064 1.00 1.00 C ATOM 1508 OG SER A 105 105.825 15.702 2.492 1.00 1.00 O ATOM 0 H SER A 105 105.979 13.196 3.420 1.00 1.00 H new ATOM 0 HA SER A 105 104.505 12.952 1.121 1.00 1.00 H new ATOM 0 HB2 SER A 105 104.146 15.389 1.326 1.00 1.00 H new ATOM 0 HB3 SER A 105 104.105 14.631 2.906 1.00 1.00 H new ATOM 0 HG SER A 105 105.462 16.527 2.877 1.00 1.00 H new ATOM 1514 N GLY A 106 107.482 14.181 0.518 1.00 1.00 N ATOM 1515 CA GLY A 106 108.413 14.510 -0.557 1.00 1.00 C ATOM 1516 C GLY A 106 108.636 13.315 -1.476 1.00 1.00 C ATOM 1517 O GLY A 106 108.867 13.475 -2.675 1.00 1.00 O ATOM 0 H GLY A 106 107.895 14.170 1.451 1.00 1.00 H new ATOM 0 HA2 GLY A 106 108.025 15.349 -1.134 1.00 1.00 H new ATOM 0 HA3 GLY A 106 109.365 14.829 -0.133 1.00 1.00 H new ATOM 1521 N LEU A 107 108.577 12.117 -0.903 1.00 1.00 N ATOM 1522 CA LEU A 107 108.787 10.890 -1.676 1.00 1.00 C ATOM 1523 C LEU A 107 107.451 10.258 -2.061 1.00 1.00 C ATOM 1524 O LEU A 107 107.423 9.188 -2.663 1.00 1.00 O ATOM 1525 CB LEU A 107 109.616 9.877 -0.855 1.00 1.00 C ATOM 1526 CG LEU A 107 111.008 10.451 -0.504 1.00 1.00 C ATOM 1527 CD1 LEU A 107 111.844 9.382 0.216 1.00 1.00 C ATOM 1528 CD2 LEU A 107 111.747 10.899 -1.776 1.00 1.00 C ATOM 0 H LEU A 107 108.387 11.966 0.088 1.00 1.00 H new ATOM 0 HA LEU A 107 109.329 11.151 -2.585 1.00 1.00 H new ATOM 0 HB2 LEU A 107 109.082 9.623 0.061 1.00 1.00 H new ATOM 0 HB3 LEU A 107 109.733 8.953 -1.422 1.00 1.00 H new ATOM 0 HG LEU A 107 110.870 11.314 0.147 1.00 1.00 H new ATOM 0 HD11 LEU A 107 112.824 9.791 0.461 1.00 1.00 H new ATOM 0 HD12 LEU A 107 111.337 9.080 1.132 1.00 1.00 H new ATOM 0 HD13 LEU A 107 111.965 8.516 -0.434 1.00 1.00 H new ATOM 0 HD21 LEU A 107 112.724 11.300 -1.507 1.00 1.00 H new ATOM 0 HD22 LEU A 107 111.876 10.046 -2.442 1.00 1.00 H new ATOM 0 HD23 LEU A 107 111.166 11.670 -2.282 1.00 1.00 H new ATOM 1540 N ALA A 108 106.337 10.904 -1.686 1.00 1.00 N ATOM 1541 CA ALA A 108 105.006 10.372 -1.979 1.00 1.00 C ATOM 1542 C ALA A 108 104.284 11.189 -3.057 1.00 1.00 C ATOM 1543 O ALA A 108 104.679 11.182 -4.223 1.00 1.00 O ATOM 1544 CB ALA A 108 104.148 10.376 -0.713 1.00 1.00 C ATOM 0 H ALA A 108 106.335 11.791 -1.182 1.00 1.00 H new ATOM 0 HA ALA A 108 105.144 9.355 -2.347 1.00 1.00 H new ATOM 0 HB1 ALA A 108 103.159 9.978 -0.942 1.00 1.00 H new ATOM 0 HB2 ALA A 108 104.621 9.756 0.049 1.00 1.00 H new ATOM 0 HB3 ALA A 108 104.051 11.396 -0.342 1.00 1.00 H new ATOM 1550 N TYR A 109 103.193 11.867 -2.664 1.00 1.00 N ATOM 1551 CA TYR A 109 102.390 12.646 -3.603 1.00 1.00 C ATOM 1552 C TYR A 109 102.734 14.128 -3.573 1.00 1.00 C ATOM 1553 O TYR A 109 102.121 14.923 -4.287 1.00 1.00 O ATOM 1554 CB TYR A 109 100.897 12.405 -3.304 1.00 1.00 C ATOM 1555 CG TYR A 109 100.582 11.046 -3.864 1.00 1.00 C ATOM 1556 CD1 TYR A 109 100.600 9.934 -3.033 1.00 1.00 C ATOM 1557 CD2 TYR A 109 100.390 10.890 -5.236 1.00 1.00 C ATOM 1558 CE1 TYR A 109 100.440 8.672 -3.564 1.00 1.00 C ATOM 1559 CE2 TYR A 109 100.211 9.622 -5.773 1.00 1.00 C ATOM 1560 CZ TYR A 109 100.250 8.508 -4.932 1.00 1.00 C ATOM 1561 OH TYR A 109 100.125 7.252 -5.449 1.00 1.00 O ATOM 0 H TYR A 109 102.853 11.887 -1.703 1.00 1.00 H new ATOM 0 HA TYR A 109 102.618 12.310 -4.615 1.00 1.00 H new ATOM 0 HB2 TYR A 109 100.702 12.441 -2.232 1.00 1.00 H new ATOM 0 HB3 TYR A 109 100.277 13.172 -3.767 1.00 1.00 H new ATOM 0 HD1 TYR A 109 100.740 10.058 -1.969 1.00 1.00 H new ATOM 0 HD2 TYR A 109 100.380 11.756 -5.882 1.00 1.00 H new ATOM 0 HE1 TYR A 109 100.462 7.808 -2.916 1.00 1.00 H new ATOM 0 HE2 TYR A 109 100.043 9.498 -6.833 1.00 1.00 H new ATOM 0 HH TYR A 109 99.491 7.267 -6.196 1.00 1.00 H new ATOM 1571 N GLY A 110 103.742 14.499 -2.781 1.00 1.00 N ATOM 1572 CA GLY A 110 104.181 15.898 -2.721 1.00 1.00 C ATOM 1573 C GLY A 110 103.828 16.573 -1.394 1.00 1.00 C ATOM 1574 O GLY A 110 102.969 16.099 -0.650 1.00 1.00 O ATOM 0 H GLY A 110 104.264 13.862 -2.180 1.00 1.00 H new ATOM 0 HA2 GLY A 110 105.260 15.942 -2.870 1.00 1.00 H new ATOM 0 HA3 GLY A 110 103.723 16.453 -3.539 1.00 1.00 H new ATOM 1578 N PRO A 111 104.470 17.683 -1.109 1.00 1.00 N ATOM 1579 CA PRO A 111 104.232 18.478 0.130 1.00 1.00 C ATOM 1580 C PRO A 111 102.921 19.256 0.058 1.00 1.00 C ATOM 1581 O PRO A 111 102.475 19.846 1.040 1.00 1.00 O ATOM 1582 CB PRO A 111 105.435 19.417 0.179 1.00 1.00 C ATOM 1583 CG PRO A 111 105.804 19.630 -1.250 1.00 1.00 C ATOM 1584 CD PRO A 111 105.506 18.309 -1.953 1.00 1.00 C ATOM 0 HA PRO A 111 104.139 17.856 1.020 1.00 1.00 H new ATOM 0 HB2 PRO A 111 105.184 20.358 0.668 1.00 1.00 H new ATOM 0 HB3 PRO A 111 106.259 18.976 0.740 1.00 1.00 H new ATOM 0 HG2 PRO A 111 105.227 20.445 -1.686 1.00 1.00 H new ATOM 0 HG3 PRO A 111 106.856 19.897 -1.347 1.00 1.00 H new ATOM 0 HD2 PRO A 111 105.149 18.470 -2.970 1.00 1.00 H new ATOM 0 HD3 PRO A 111 106.396 17.684 -2.022 1.00 1.00 H new ATOM 1592 N ARG A 112 102.312 19.267 -1.121 1.00 1.00 N ATOM 1593 CA ARG A 112 101.053 19.979 -1.319 1.00 1.00 C ATOM 1594 C ARG A 112 99.904 18.991 -1.359 1.00 1.00 C ATOM 1595 O ARG A 112 100.117 17.788 -1.499 1.00 1.00 O ATOM 1596 CB ARG A 112 101.075 20.725 -2.647 1.00 1.00 C ATOM 1597 CG ARG A 112 102.241 21.708 -2.674 1.00 1.00 C ATOM 1598 CD ARG A 112 102.202 22.496 -3.982 1.00 1.00 C ATOM 1599 NE ARG A 112 101.150 23.504 -3.908 1.00 1.00 N ATOM 1600 CZ ARG A 112 100.962 24.389 -4.881 1.00 1.00 C ATOM 1601 NH1 ARG A 112 101.728 24.378 -5.937 1.00 1.00 N ATOM 1602 NH2 ARG A 112 100.007 25.272 -4.778 1.00 1.00 N ATOM 0 H ARG A 112 102.666 18.794 -1.952 1.00 1.00 H new ATOM 0 HA ARG A 112 100.925 20.681 -0.495 1.00 1.00 H new ATOM 0 HB2 ARG A 112 101.167 20.016 -3.470 1.00 1.00 H new ATOM 0 HB3 ARG A 112 100.135 21.259 -2.789 1.00 1.00 H new ATOM 0 HG2 ARG A 112 102.179 22.388 -1.824 1.00 1.00 H new ATOM 0 HG3 ARG A 112 103.186 21.172 -2.586 1.00 1.00 H new ATOM 0 HD2 ARG A 112 103.166 22.973 -4.161 1.00 1.00 H new ATOM 0 HD3 ARG A 112 102.018 21.823 -4.820 1.00 1.00 H new ATOM 0 HE ARG A 112 100.543 23.530 -3.088 1.00 1.00 H new ATOM 0 HH11 ARG A 112 102.475 23.688 -6.018 1.00 1.00 H new ATOM 0 HH12 ARG A 112 101.580 25.059 -6.682 1.00 1.00 H new ATOM 0 HH21 ARG A 112 99.408 25.281 -3.953 1.00 1.00 H new ATOM 0 HH22 ARG A 112 99.860 25.953 -5.523 1.00 1.00 H new ATOM 1616 N SER A 113 98.687 19.495 -1.258 1.00 1.00 N ATOM 1617 CA SER A 113 97.536 18.625 -1.328 1.00 1.00 C ATOM 1618 C SER A 113 97.367 18.152 -2.766 1.00 1.00 C ATOM 1619 O SER A 113 96.618 18.749 -3.540 1.00 1.00 O ATOM 1620 CB SER A 113 96.285 19.375 -0.883 1.00 1.00 C ATOM 1621 OG SER A 113 96.606 20.211 0.214 1.00 1.00 O ATOM 0 H SER A 113 98.476 20.485 -1.130 1.00 1.00 H new ATOM 0 HA SER A 113 97.683 17.769 -0.669 1.00 1.00 H new ATOM 0 HB2 SER A 113 95.892 19.971 -1.707 1.00 1.00 H new ATOM 0 HB3 SER A 113 95.505 18.668 -0.600 1.00 1.00 H new ATOM 0 HG SER A 113 96.141 21.069 0.119 1.00 1.00 H new ATOM 1627 N VAL A 114 98.076 17.089 -3.130 1.00 1.00 N ATOM 1628 CA VAL A 114 98.005 16.562 -4.495 1.00 1.00 C ATOM 1629 C VAL A 114 97.091 15.341 -4.550 1.00 1.00 C ATOM 1630 O VAL A 114 97.526 14.238 -4.882 1.00 1.00 O ATOM 1631 CB VAL A 114 99.412 16.211 -5.001 1.00 1.00 C ATOM 1632 CG1 VAL A 114 99.355 15.932 -6.505 1.00 1.00 C ATOM 1633 CG2 VAL A 114 100.359 17.394 -4.747 1.00 1.00 C ATOM 0 H VAL A 114 98.702 16.577 -2.508 1.00 1.00 H new ATOM 0 HA VAL A 114 97.585 17.330 -5.145 1.00 1.00 H new ATOM 0 HB VAL A 114 99.776 15.329 -4.474 1.00 1.00 H new ATOM 0 HG11 VAL A 114 100.352 15.683 -6.867 1.00 1.00 H new ATOM 0 HG12 VAL A 114 98.681 15.097 -6.695 1.00 1.00 H new ATOM 0 HG13 VAL A 114 98.991 16.818 -7.026 1.00 1.00 H new ATOM 0 HG21 VAL A 114 101.357 17.144 -5.106 1.00 1.00 H new ATOM 0 HG22 VAL A 114 99.992 18.274 -5.276 1.00 1.00 H new ATOM 0 HG23 VAL A 114 100.400 17.604 -3.678 1.00 1.00 H new ATOM 1637 N GLY A 115 95.817 15.549 -4.219 1.00 1.00 N ATOM 1638 CA GLY A 115 94.845 14.462 -4.238 1.00 1.00 C ATOM 1639 C GLY A 115 93.538 14.867 -3.556 1.00 1.00 C ATOM 1640 O GLY A 115 93.398 15.987 -3.066 1.00 1.00 O ATOM 0 H GLY A 115 95.438 16.453 -3.937 1.00 1.00 H new ATOM 0 HA2 GLY A 115 94.644 14.171 -5.269 1.00 1.00 H new ATOM 0 HA3 GLY A 115 95.263 13.590 -3.736 1.00 1.00 H new ATOM 1644 N GLY A 116 92.589 13.935 -3.525 1.00 1.00 N ATOM 1645 CA GLY A 116 91.288 14.173 -2.899 1.00 1.00 C ATOM 1646 C GLY A 116 91.448 14.515 -1.411 1.00 1.00 C ATOM 1647 O GLY A 116 91.819 15.640 -1.077 1.00 1.00 O ATOM 0 H GLY A 116 92.696 13.004 -3.927 1.00 1.00 H new ATOM 0 HA2 GLY A 116 90.778 14.989 -3.411 1.00 1.00 H new ATOM 0 HA3 GLY A 116 90.661 13.288 -3.007 1.00 1.00 H new ATOM 1651 N PRO A 117 91.164 13.597 -0.508 1.00 1.00 N ATOM 1652 CA PRO A 117 91.270 13.854 0.962 1.00 1.00 C ATOM 1653 C PRO A 117 92.698 14.199 1.344 1.00 1.00 C ATOM 1654 O PRO A 117 92.952 14.718 2.432 1.00 1.00 O ATOM 1655 CB PRO A 117 90.821 12.541 1.604 1.00 1.00 C ATOM 1656 CG PRO A 117 91.096 11.540 0.552 1.00 1.00 C ATOM 1657 CD PRO A 117 90.734 12.212 -0.751 1.00 1.00 C ATOM 0 HA PRO A 117 90.664 14.699 1.289 1.00 1.00 H new ATOM 0 HB2 PRO A 117 91.377 12.329 2.517 1.00 1.00 H new ATOM 0 HB3 PRO A 117 89.765 12.564 1.872 1.00 1.00 H new ATOM 0 HG2 PRO A 117 92.144 11.240 0.561 1.00 1.00 H new ATOM 0 HG3 PRO A 117 90.505 10.637 0.705 1.00 1.00 H new ATOM 0 HD2 PRO A 117 91.254 11.766 -1.599 1.00 1.00 H new ATOM 0 HD3 PRO A 117 89.666 12.147 -0.961 1.00 1.00 H new ATOM 1665 N ILE A 118 93.629 13.924 0.436 1.00 1.00 N ATOM 1666 CA ILE A 118 95.015 14.241 0.712 1.00 1.00 C ATOM 1667 C ILE A 118 95.108 15.750 0.791 1.00 1.00 C ATOM 1668 O ILE A 118 94.873 16.452 -0.191 1.00 1.00 O ATOM 1669 CB ILE A 118 95.944 13.735 -0.400 1.00 1.00 C ATOM 1670 CG1 ILE A 118 95.801 12.206 -0.567 1.00 1.00 C ATOM 1671 CG2 ILE A 118 97.389 14.049 -0.015 1.00 1.00 C ATOM 1672 CD1 ILE A 118 94.631 11.835 -1.497 1.00 1.00 C ATOM 0 H ILE A 118 93.452 13.494 -0.472 1.00 1.00 H new ATOM 0 HA ILE A 118 95.327 13.760 1.639 1.00 1.00 H new ATOM 0 HB ILE A 118 95.677 14.225 -1.336 1.00 1.00 H new ATOM 0 HG12 ILE A 118 96.728 11.797 -0.969 1.00 1.00 H new ATOM 0 HG13 ILE A 118 95.647 11.747 0.410 1.00 1.00 H new ATOM 0 HG21 ILE A 118 98.059 13.694 -0.798 1.00 1.00 H new ATOM 0 HG22 ILE A 118 97.508 15.126 0.104 1.00 1.00 H new ATOM 0 HG23 ILE A 118 97.632 13.551 0.924 1.00 1.00 H new ATOM 0 HD11 ILE A 118 94.567 10.751 -1.586 1.00 1.00 H new ATOM 0 HD12 ILE A 118 93.700 12.221 -1.082 1.00 1.00 H new ATOM 0 HD13 ILE A 118 94.797 12.271 -2.482 1.00 1.00 H new ATOM 1679 N GLY A 119 95.400 16.237 1.982 1.00 1.00 N ATOM 1680 CA GLY A 119 95.470 17.661 2.229 1.00 1.00 C ATOM 1681 C GLY A 119 96.876 18.202 2.075 1.00 1.00 C ATOM 1682 O GLY A 119 97.789 17.497 1.647 1.00 1.00 O ATOM 0 H GLY A 119 95.594 15.659 2.800 1.00 1.00 H new ATOM 0 HA2 GLY A 119 94.805 18.180 1.539 1.00 1.00 H new ATOM 0 HA3 GLY A 119 95.110 17.871 3.236 1.00 1.00 H new ATOM 1686 N PRO A 120 97.060 19.446 2.420 1.00 1.00 N ATOM 1687 CA PRO A 120 98.393 20.113 2.327 1.00 1.00 C ATOM 1688 C PRO A 120 99.438 19.461 3.241 1.00 1.00 C ATOM 1689 O PRO A 120 99.151 19.148 4.390 1.00 1.00 O ATOM 1690 CB PRO A 120 98.102 21.559 2.759 1.00 1.00 C ATOM 1691 CG PRO A 120 96.827 21.482 3.538 1.00 1.00 C ATOM 1692 CD PRO A 120 96.017 20.358 2.930 1.00 1.00 C ATOM 0 HA PRO A 120 98.820 20.039 1.327 1.00 1.00 H new ATOM 0 HB2 PRO A 120 98.913 21.960 3.368 1.00 1.00 H new ATOM 0 HB3 PRO A 120 97.998 22.215 1.895 1.00 1.00 H new ATOM 0 HG2 PRO A 120 97.028 21.289 4.592 1.00 1.00 H new ATOM 0 HG3 PRO A 120 96.283 22.425 3.485 1.00 1.00 H new ATOM 0 HD2 PRO A 120 95.380 19.872 3.669 1.00 1.00 H new ATOM 0 HD3 PRO A 120 95.365 20.714 2.132 1.00 1.00 H new ATOM 1700 N ASN A 121 100.659 19.295 2.735 1.00 1.00 N ATOM 1701 CA ASN A 121 101.737 18.709 3.538 1.00 1.00 C ATOM 1702 C ASN A 121 101.331 17.344 4.089 1.00 1.00 C ATOM 1703 O ASN A 121 101.430 17.101 5.291 1.00 1.00 O ATOM 1704 CB ASN A 121 102.077 19.658 4.695 1.00 1.00 C ATOM 1705 CG ASN A 121 103.482 19.377 5.221 1.00 1.00 C ATOM 1706 OD1 ASN A 121 104.295 20.294 5.344 1.00 1.00 O ATOM 1707 ND2 ASN A 121 103.818 18.156 5.539 1.00 1.00 N ATOM 0 H ASN A 121 100.927 19.553 1.785 1.00 1.00 H new ATOM 0 HA ASN A 121 102.611 18.570 2.902 1.00 1.00 H new ATOM 0 HB2 ASN A 121 102.009 20.692 4.357 1.00 1.00 H new ATOM 0 HB3 ASN A 121 101.350 19.537 5.498 1.00 1.00 H new ATOM 0 HD21 ASN A 121 104.755 17.960 5.890 1.00 1.00 H new ATOM 0 HD22 ASN A 121 103.143 17.398 5.436 1.00 1.00 H new ATOM 1714 N GLU A 122 100.863 16.460 3.207 1.00 1.00 N ATOM 1715 CA GLU A 122 100.423 15.122 3.617 1.00 1.00 C ATOM 1716 C GLU A 122 101.485 14.047 3.380 1.00 1.00 C ATOM 1717 O GLU A 122 101.970 13.873 2.261 1.00 1.00 O ATOM 1718 CB GLU A 122 99.177 14.713 2.799 1.00 1.00 C ATOM 1719 CG GLU A 122 97.902 14.721 3.638 1.00 1.00 C ATOM 1720 CD GLU A 122 97.537 16.130 4.000 1.00 1.00 C ATOM 1721 OE1 GLU A 122 96.413 16.328 4.430 1.00 1.00 O ATOM 1722 OE2 GLU A 122 98.384 16.994 3.847 1.00 1.00 O ATOM 0 H GLU A 122 100.778 16.643 2.207 1.00 1.00 H new ATOM 0 HA GLU A 122 100.215 15.183 4.685 1.00 1.00 H new ATOM 0 HB2 GLU A 122 99.059 15.395 1.957 1.00 1.00 H new ATOM 0 HB3 GLU A 122 99.329 13.717 2.384 1.00 1.00 H new ATOM 0 HG2 GLU A 122 97.088 14.257 3.082 1.00 1.00 H new ATOM 0 HG3 GLU A 122 98.048 14.130 4.542 1.00 1.00 H new ATOM 1729 N THR A 123 101.744 13.256 4.412 1.00 1.00 N ATOM 1730 CA THR A 123 102.634 12.111 4.289 1.00 1.00 C ATOM 1731 C THR A 123 101.736 10.902 4.057 1.00 1.00 C ATOM 1732 O THR A 123 100.775 10.699 4.795 1.00 1.00 O ATOM 1733 CB THR A 123 103.460 11.917 5.561 1.00 1.00 C ATOM 1734 OG1 THR A 123 104.353 13.010 5.713 1.00 1.00 O ATOM 1735 CG2 THR A 123 104.259 10.617 5.456 1.00 1.00 C ATOM 0 H THR A 123 101.350 13.387 5.344 1.00 1.00 H new ATOM 0 HA THR A 123 103.341 12.254 3.472 1.00 1.00 H new ATOM 0 HB THR A 123 102.796 11.866 6.424 1.00 1.00 H new ATOM 0 HG1 THR A 123 104.644 13.067 6.647 1.00 1.00 H new ATOM 0 HG21 THR A 123 104.848 10.478 6.362 1.00 1.00 H new ATOM 0 HG22 THR A 123 103.574 9.778 5.336 1.00 1.00 H new ATOM 0 HG23 THR A 123 104.925 10.668 4.595 1.00 1.00 H new ATOM 1743 N LEU A 124 102.026 10.114 3.028 1.00 1.00 N ATOM 1744 CA LEU A 124 101.198 8.940 2.718 1.00 1.00 C ATOM 1745 C LEU A 124 101.957 7.642 2.996 1.00 1.00 C ATOM 1746 O LEU A 124 103.168 7.553 2.793 1.00 1.00 O ATOM 1747 CB LEU A 124 100.779 8.956 1.231 1.00 1.00 C ATOM 1748 CG LEU A 124 99.902 10.185 0.846 1.00 1.00 C ATOM 1749 CD1 LEU A 124 98.938 10.577 1.953 1.00 1.00 C ATOM 1750 CD2 LEU A 124 100.778 11.389 0.523 1.00 1.00 C ATOM 0 H LEU A 124 102.815 10.258 2.398 1.00 1.00 H new ATOM 0 HA LEU A 124 100.315 8.984 3.356 1.00 1.00 H new ATOM 0 HB2 LEU A 124 101.674 8.949 0.609 1.00 1.00 H new ATOM 0 HB3 LEU A 124 100.229 8.042 1.007 1.00 1.00 H new ATOM 0 HG LEU A 124 99.325 9.888 -0.030 1.00 1.00 H new ATOM 0 HD11 LEU A 124 98.350 11.438 1.635 1.00 1.00 H new ATOM 0 HD12 LEU A 124 98.271 9.742 2.168 1.00 1.00 H new ATOM 0 HD13 LEU A 124 99.500 10.833 2.851 1.00 1.00 H new ATOM 0 HD21 LEU A 124 100.147 12.237 0.257 1.00 1.00 H new ATOM 0 HD22 LEU A 124 101.381 11.645 1.395 1.00 1.00 H new ATOM 0 HD23 LEU A 124 101.434 11.148 -0.313 1.00 1.00 H new ATOM 1762 N ILE A 125 101.211 6.633 3.453 1.00 1.00 N ATOM 1763 CA ILE A 125 101.754 5.316 3.761 1.00 1.00 C ATOM 1764 C ILE A 125 100.992 4.277 2.974 1.00 1.00 C ATOM 1765 O ILE A 125 99.794 4.427 2.741 1.00 1.00 O ATOM 1766 CB ILE A 125 101.579 5.015 5.258 1.00 1.00 C ATOM 1767 CG1 ILE A 125 101.740 3.497 5.530 1.00 1.00 C ATOM 1768 CG2 ILE A 125 100.177 5.449 5.684 1.00 1.00 C ATOM 1769 CD1 ILE A 125 101.698 3.200 7.016 1.00 1.00 C ATOM 0 H ILE A 125 100.208 6.712 3.619 1.00 1.00 H new ATOM 0 HA ILE A 125 102.813 5.295 3.503 1.00 1.00 H new ATOM 0 HB ILE A 125 102.338 5.557 5.822 1.00 1.00 H new ATOM 0 HG12 ILE A 125 100.946 2.948 5.024 1.00 1.00 H new ATOM 0 HG13 ILE A 125 102.685 3.148 5.113 1.00 1.00 H new ATOM 0 HG21 ILE A 125 100.038 5.241 6.745 1.00 1.00 H new ATOM 0 HG22 ILE A 125 100.057 6.517 5.505 1.00 1.00 H new ATOM 0 HG23 ILE A 125 99.434 4.898 5.106 1.00 1.00 H new ATOM 0 HD11 ILE A 125 101.813 2.128 7.176 1.00 1.00 H new ATOM 0 HD12 ILE A 125 102.508 3.731 7.516 1.00 1.00 H new ATOM 0 HD13 ILE A 125 100.742 3.527 7.426 1.00 1.00 H new ATOM 1776 N PHE A 126 101.673 3.199 2.607 1.00 1.00 N ATOM 1777 CA PHE A 126 101.009 2.122 1.893 1.00 1.00 C ATOM 1778 C PHE A 126 101.498 0.762 2.357 1.00 1.00 C ATOM 1779 O PHE A 126 102.651 0.604 2.762 1.00 1.00 O ATOM 1780 CB PHE A 126 101.239 2.248 0.393 1.00 1.00 C ATOM 1781 CG PHE A 126 101.249 3.700 0.011 1.00 1.00 C ATOM 1782 CD1 PHE A 126 100.169 4.259 -0.685 1.00 1.00 C ATOM 1783 CD2 PHE A 126 102.346 4.489 0.351 1.00 1.00 C ATOM 1784 CE1 PHE A 126 100.196 5.611 -1.036 1.00 1.00 C ATOM 1785 CE2 PHE A 126 102.366 5.835 0.000 1.00 1.00 C ATOM 1786 CZ PHE A 126 101.298 6.394 -0.690 1.00 1.00 C ATOM 0 H PHE A 126 102.666 3.050 2.788 1.00 1.00 H new ATOM 0 HA PHE A 126 99.944 2.204 2.108 1.00 1.00 H new ATOM 0 HB2 PHE A 126 102.185 1.782 0.118 1.00 1.00 H new ATOM 0 HB3 PHE A 126 100.455 1.722 -0.152 1.00 1.00 H new ATOM 0 HD1 PHE A 126 99.319 3.647 -0.949 1.00 1.00 H new ATOM 0 HD2 PHE A 126 103.179 4.057 0.886 1.00 1.00 H new ATOM 0 HE1 PHE A 126 99.367 6.048 -1.573 1.00 1.00 H new ATOM 0 HE2 PHE A 126 103.215 6.448 0.265 1.00 1.00 H new ATOM 0 HZ PHE A 126 101.321 7.439 -0.960 1.00 1.00 H new ATOM 1796 N LYS A 127 100.621 -0.236 2.256 1.00 1.00 N ATOM 1797 CA LYS A 127 100.971 -1.588 2.619 1.00 1.00 C ATOM 1798 C LYS A 127 101.286 -2.281 1.325 1.00 1.00 C ATOM 1799 O LYS A 127 100.490 -2.221 0.405 1.00 1.00 O ATOM 1800 CB LYS A 127 99.801 -2.304 3.339 1.00 1.00 C ATOM 1801 CG LYS A 127 98.775 -1.295 3.859 1.00 1.00 C ATOM 1802 CD LYS A 127 99.393 -0.373 4.924 1.00 1.00 C ATOM 1803 CE LYS A 127 98.361 0.672 5.348 1.00 1.00 C ATOM 1804 NZ LYS A 127 98.927 1.518 6.435 1.00 1.00 N ATOM 0 H LYS A 127 99.663 -0.122 1.924 1.00 1.00 H new ATOM 0 HA LYS A 127 101.812 -1.602 3.312 1.00 1.00 H new ATOM 0 HB2 LYS A 127 99.317 -2.998 2.652 1.00 1.00 H new ATOM 0 HB3 LYS A 127 100.188 -2.895 4.169 1.00 1.00 H new ATOM 0 HG2 LYS A 127 98.398 -0.696 3.030 1.00 1.00 H new ATOM 0 HG3 LYS A 127 97.922 -1.825 4.283 1.00 1.00 H new ATOM 0 HD2 LYS A 127 99.711 -0.958 5.787 1.00 1.00 H new ATOM 0 HD3 LYS A 127 100.281 0.117 4.526 1.00 1.00 H new ATOM 0 HE2 LYS A 127 98.086 1.293 4.496 1.00 1.00 H new ATOM 0 HE3 LYS A 127 97.451 0.181 5.692 1.00 1.00 H new ATOM 0 HZ1 LYS A 127 98.477 2.455 6.416 1.00 1.00 H new ATOM 0 HZ2 LYS A 127 98.748 1.067 7.355 1.00 1.00 H new ATOM 0 HZ3 LYS A 127 99.952 1.623 6.295 1.00 1.00 H new ATOM 1818 N ILE A 128 102.463 -2.881 1.209 1.00 1.00 N ATOM 1819 CA ILE A 128 102.825 -3.508 -0.065 1.00 1.00 C ATOM 1820 C ILE A 128 103.113 -4.992 0.081 1.00 1.00 C ATOM 1821 O ILE A 128 104.045 -5.408 0.771 1.00 1.00 O ATOM 1822 CB ILE A 128 104.031 -2.773 -0.674 1.00 1.00 C ATOM 1823 CG1 ILE A 128 103.896 -1.268 -0.362 1.00 1.00 C ATOM 1824 CG2 ILE A 128 104.014 -2.980 -2.193 1.00 1.00 C ATOM 1825 CD1 ILE A 128 105.053 -0.465 -0.959 1.00 1.00 C ATOM 0 H ILE A 128 103.163 -2.949 1.948 1.00 1.00 H new ATOM 0 HA ILE A 128 101.970 -3.424 -0.735 1.00 1.00 H new ATOM 0 HB ILE A 128 104.963 -3.156 -0.259 1.00 1.00 H new ATOM 0 HG12 ILE A 128 102.951 -0.897 -0.759 1.00 1.00 H new ATOM 0 HG13 ILE A 128 103.868 -1.120 0.718 1.00 1.00 H new ATOM 0 HG21 ILE A 128 104.864 -2.464 -2.640 1.00 1.00 H new ATOM 0 HG22 ILE A 128 104.078 -4.045 -2.416 1.00 1.00 H new ATOM 0 HG23 ILE A 128 103.088 -2.578 -2.605 1.00 1.00 H new ATOM 0 HD11 ILE A 128 104.925 0.591 -0.719 1.00 1.00 H new ATOM 0 HD12 ILE A 128 105.996 -0.820 -0.542 1.00 1.00 H new ATOM 0 HD13 ILE A 128 105.064 -0.593 -2.041 1.00 1.00 H new ATOM 1832 N HIS A 129 102.296 -5.776 -0.618 1.00 1.00 N ATOM 1833 CA HIS A 129 102.417 -7.230 -0.638 1.00 1.00 C ATOM 1834 C HIS A 129 102.908 -7.657 -2.008 1.00 1.00 C ATOM 1835 O HIS A 129 102.307 -7.301 -3.015 1.00 1.00 O ATOM 1836 CB HIS A 129 101.057 -7.864 -0.350 1.00 1.00 C ATOM 1837 CG HIS A 129 101.138 -9.349 -0.561 1.00 1.00 C ATOM 1838 ND1 HIS A 129 102.152 -10.264 -0.366 1.00 1.00 N flip ATOM 1839 CD2 HIS A 129 100.080 -10.063 -1.095 1.00 1.00 C flip ATOM 1840 CE1 HIS A 129 101.725 -11.520 -0.798 1.00 1.00 C flip ATOM 1841 NE2 HIS A 129 100.471 -11.339 -1.219 1.00 1.00 N flip ATOM 0 H HIS A 129 101.529 -5.419 -1.188 1.00 1.00 H new ATOM 0 HA HIS A 129 103.124 -7.556 0.125 1.00 1.00 H new ATOM 0 HB2 HIS A 129 100.754 -7.648 0.674 1.00 1.00 H new ATOM 0 HB3 HIS A 129 100.298 -7.434 -1.004 1.00 1.00 H new ATOM 0 HD2 HIS A 129 99.113 -9.664 -1.364 1.00 1.00 H new ATOM 0 HE1 HIS A 129 102.288 -12.441 -0.793 1.00 1.00 H new ATOM 0 HE2 HIS A 129 99.881 -12.083 -1.591 1.00 1.00 H new ATOM 1849 N LEU A 130 104.025 -8.390 -2.060 1.00 1.00 N ATOM 1850 CA LEU A 130 104.578 -8.798 -3.349 1.00 1.00 C ATOM 1851 C LEU A 130 104.120 -10.200 -3.763 1.00 1.00 C ATOM 1852 O LEU A 130 104.517 -11.198 -3.162 1.00 1.00 O ATOM 1853 CB LEU A 130 106.118 -8.738 -3.300 1.00 1.00 C ATOM 1854 CG LEU A 130 106.665 -8.013 -4.538 1.00 1.00 C ATOM 1855 CD1 LEU A 130 108.190 -7.895 -4.453 1.00 1.00 C ATOM 1856 CD2 LEU A 130 106.292 -8.792 -5.804 1.00 1.00 C ATOM 0 H LEU A 130 104.551 -8.705 -1.245 1.00 1.00 H new ATOM 0 HA LEU A 130 104.204 -8.102 -4.100 1.00 1.00 H new ATOM 0 HB2 LEU A 130 106.440 -8.221 -2.396 1.00 1.00 H new ATOM 0 HB3 LEU A 130 106.526 -9.747 -3.252 1.00 1.00 H new ATOM 0 HG LEU A 130 106.228 -7.015 -4.577 1.00 1.00 H new ATOM 0 HD11 LEU A 130 108.565 -7.379 -5.337 1.00 1.00 H new ATOM 0 HD12 LEU A 130 108.462 -7.331 -3.561 1.00 1.00 H new ATOM 0 HD13 LEU A 130 108.630 -8.891 -4.401 1.00 1.00 H new ATOM 0 HD21 LEU A 130 106.683 -8.273 -6.679 1.00 1.00 H new ATOM 0 HD22 LEU A 130 106.720 -9.793 -5.755 1.00 1.00 H new ATOM 0 HD23 LEU A 130 105.207 -8.865 -5.880 1.00 1.00 H new ATOM 1868 N ILE A 131 103.289 -10.260 -4.808 1.00 1.00 N ATOM 1869 CA ILE A 131 102.783 -11.528 -5.318 1.00 1.00 C ATOM 1870 C ILE A 131 103.644 -12.059 -6.471 1.00 1.00 C ATOM 1871 O ILE A 131 103.932 -13.256 -6.523 1.00 1.00 O ATOM 1872 CB ILE A 131 101.331 -11.339 -5.775 1.00 1.00 C ATOM 1873 CG1 ILE A 131 100.431 -11.071 -4.556 1.00 1.00 C ATOM 1874 CG2 ILE A 131 100.842 -12.608 -6.463 1.00 1.00 C ATOM 1875 CD1 ILE A 131 100.434 -9.598 -4.174 1.00 1.00 C ATOM 0 H ILE A 131 102.955 -9.441 -5.315 1.00 1.00 H new ATOM 0 HA ILE A 131 102.827 -12.267 -4.518 1.00 1.00 H new ATOM 0 HB ILE A 131 101.287 -10.496 -6.464 1.00 1.00 H new ATOM 0 HG12 ILE A 131 99.412 -11.388 -4.778 1.00 1.00 H new ATOM 0 HG13 ILE A 131 100.774 -11.668 -3.711 1.00 1.00 H new ATOM 0 HG21 ILE A 131 99.810 -12.472 -6.787 1.00 1.00 H new ATOM 0 HG22 ILE A 131 101.470 -12.817 -7.329 1.00 1.00 H new ATOM 0 HG23 ILE A 131 100.896 -13.444 -5.766 1.00 1.00 H new ATOM 0 HD11 ILE A 131 99.788 -9.445 -3.309 1.00 1.00 H new ATOM 0 HD12 ILE A 131 101.450 -9.288 -3.928 1.00 1.00 H new ATOM 0 HD13 ILE A 131 100.067 -9.004 -5.011 1.00 1.00 H new ATOM 1882 N SER A 132 104.052 -11.185 -7.396 1.00 1.00 N ATOM 1883 CA SER A 132 104.877 -11.628 -8.528 1.00 1.00 C ATOM 1884 C SER A 132 105.740 -10.481 -9.052 1.00 1.00 C ATOM 1885 O SER A 132 105.428 -9.309 -8.841 1.00 1.00 O ATOM 1886 CB SER A 132 103.983 -12.164 -9.651 1.00 1.00 C ATOM 1887 OG SER A 132 103.602 -11.098 -10.510 1.00 1.00 O ATOM 0 H SER A 132 103.832 -10.189 -7.388 1.00 1.00 H new ATOM 0 HA SER A 132 105.535 -12.425 -8.182 1.00 1.00 H new ATOM 0 HB2 SER A 132 104.514 -12.929 -10.218 1.00 1.00 H new ATOM 0 HB3 SER A 132 103.097 -12.638 -9.229 1.00 1.00 H new ATOM 0 HG SER A 132 103.032 -11.444 -11.228 1.00 1.00 H new ATOM 1893 N VAL A 133 106.854 -10.832 -9.707 1.00 1.00 N ATOM 1894 CA VAL A 133 107.796 -9.834 -10.228 1.00 1.00 C ATOM 1895 C VAL A 133 108.149 -10.108 -11.681 1.00 1.00 C ATOM 1896 O VAL A 133 108.381 -11.253 -12.070 1.00 1.00 O ATOM 1897 CB VAL A 133 109.082 -9.865 -9.409 1.00 1.00 C ATOM 1898 CG1 VAL A 133 110.020 -8.761 -9.895 1.00 1.00 C ATOM 1899 CG2 VAL A 133 108.735 -9.643 -7.950 1.00 1.00 C ATOM 0 H VAL A 133 107.125 -11.799 -9.888 1.00 1.00 H new ATOM 0 HA VAL A 133 107.315 -8.858 -10.157 1.00 1.00 H new ATOM 0 HB VAL A 133 109.579 -10.828 -9.525 1.00 1.00 H new ATOM 0 HG11 VAL A 133 110.940 -8.782 -9.311 1.00 1.00 H new ATOM 0 HG12 VAL A 133 110.255 -8.920 -10.947 1.00 1.00 H new ATOM 0 HG13 VAL A 133 109.535 -7.792 -9.774 1.00 1.00 H new ATOM 0 HG21 VAL A 133 109.646 -9.663 -7.352 1.00 1.00 H new ATOM 0 HG22 VAL A 133 108.247 -8.675 -7.835 1.00 1.00 H new ATOM 0 HG23 VAL A 133 108.062 -10.431 -7.612 1.00 1.00 H new ATOM 1903 N LYS A 134 108.219 -9.042 -12.475 1.00 1.00 N ATOM 1904 CA LYS A 134 108.579 -9.154 -13.879 1.00 1.00 C ATOM 1905 C LYS A 134 110.054 -8.792 -14.060 1.00 1.00 C ATOM 1906 O LYS A 134 110.865 -8.933 -13.150 1.00 1.00 O ATOM 1907 CB LYS A 134 107.725 -8.191 -14.711 1.00 1.00 C ATOM 1908 CG LYS A 134 107.505 -8.749 -16.130 1.00 1.00 C ATOM 1909 CD LYS A 134 106.325 -9.722 -16.125 1.00 1.00 C ATOM 1910 CE LYS A 134 106.269 -10.469 -17.459 1.00 1.00 C ATOM 1911 NZ LYS A 134 105.889 -9.521 -18.545 1.00 1.00 N ATOM 0 H LYS A 134 108.030 -8.089 -12.165 1.00 1.00 H new ATOM 0 HA LYS A 134 108.406 -10.178 -14.210 1.00 1.00 H new ATOM 0 HB2 LYS A 134 106.763 -8.035 -14.223 1.00 1.00 H new ATOM 0 HB3 LYS A 134 108.215 -7.219 -14.769 1.00 1.00 H new ATOM 0 HG2 LYS A 134 107.313 -7.933 -16.826 1.00 1.00 H new ATOM 0 HG3 LYS A 134 108.406 -9.257 -16.475 1.00 1.00 H new ATOM 0 HD2 LYS A 134 106.429 -10.431 -15.304 1.00 1.00 H new ATOM 0 HD3 LYS A 134 105.394 -9.179 -15.961 1.00 1.00 H new ATOM 0 HE2 LYS A 134 107.238 -10.919 -17.677 1.00 1.00 H new ATOM 0 HE3 LYS A 134 105.546 -11.282 -17.402 1.00 1.00 H new ATOM 0 HZ1 LYS A 134 105.719 -10.050 -19.424 1.00 1.00 H new ATOM 0 HZ2 LYS A 134 105.024 -9.012 -18.274 1.00 1.00 H new ATOM 0 HZ3 LYS A 134 106.659 -8.839 -18.696 1.00 1.00 H new ATOM 1925 N LYS A 135 110.370 -8.295 -15.242 1.00 1.00 N ATOM 1926 CA LYS A 135 111.728 -7.870 -15.552 1.00 1.00 C ATOM 1927 C LYS A 135 111.771 -7.164 -16.903 1.00 1.00 C ATOM 1928 O LYS A 135 111.144 -7.591 -17.873 1.00 1.00 O ATOM 1929 CB LYS A 135 112.686 -9.080 -15.517 1.00 1.00 C ATOM 1930 CG LYS A 135 113.906 -8.788 -14.644 1.00 1.00 C ATOM 1931 CD LYS A 135 114.895 -7.890 -15.405 1.00 1.00 C ATOM 1932 CE LYS A 135 115.661 -8.684 -16.478 1.00 1.00 C ATOM 1933 NZ LYS A 135 117.121 -8.619 -16.184 1.00 1.00 N ATOM 0 H LYS A 135 109.705 -8.175 -16.006 1.00 1.00 H new ATOM 0 HA LYS A 135 112.058 -7.158 -14.796 1.00 1.00 H new ATOM 0 HB2 LYS A 135 112.160 -9.954 -15.132 1.00 1.00 H new ATOM 0 HB3 LYS A 135 113.009 -9.322 -16.530 1.00 1.00 H new ATOM 0 HG2 LYS A 135 113.594 -8.299 -13.721 1.00 1.00 H new ATOM 0 HG3 LYS A 135 114.393 -9.721 -14.361 1.00 1.00 H new ATOM 0 HD2 LYS A 135 114.355 -7.068 -15.874 1.00 1.00 H new ATOM 0 HD3 LYS A 135 115.602 -7.448 -14.703 1.00 1.00 H new ATOM 0 HE2 LYS A 135 115.326 -9.721 -16.489 1.00 1.00 H new ATOM 0 HE3 LYS A 135 115.458 -8.273 -17.467 1.00 1.00 H new ATOM 0 HZ1 LYS A 135 117.657 -8.675 -17.073 1.00 1.00 H new ATOM 0 HZ2 LYS A 135 117.339 -7.722 -15.704 1.00 1.00 H new ATOM 0 HZ3 LYS A 135 117.387 -9.414 -15.569 1.00 1.00 H new ATOM 1947 N SER A 136 112.520 -6.073 -16.936 1.00 1.00 N ATOM 1948 CA SER A 136 112.660 -5.276 -18.150 1.00 1.00 C ATOM 1949 C SER A 136 113.436 -6.039 -19.220 1.00 1.00 C ATOM 1950 O SER A 136 112.938 -6.258 -20.324 1.00 1.00 O ATOM 1951 CB SER A 136 113.398 -3.978 -17.820 1.00 1.00 C ATOM 1952 OG SER A 136 114.799 -4.200 -17.919 1.00 1.00 O ATOM 0 H SER A 136 113.042 -5.717 -16.136 1.00 1.00 H new ATOM 0 HA SER A 136 111.664 -5.056 -18.536 1.00 1.00 H new ATOM 0 HB2 SER A 136 113.093 -3.188 -18.506 1.00 1.00 H new ATOM 0 HB3 SER A 136 113.140 -3.644 -16.815 1.00 1.00 H new ATOM 0 HG SER A 136 115.277 -3.370 -17.710 1.00 1.00 H new ATOM 1958 N SER A 137 114.657 -6.441 -18.883 1.00 1.00 N ATOM 1959 CA SER A 137 115.502 -7.175 -19.820 1.00 1.00 C ATOM 1960 C SER A 137 116.947 -7.186 -19.327 1.00 1.00 C ATOM 1961 O SER A 137 117.489 -6.113 -19.123 1.00 1.00 O ATOM 1962 CB SER A 137 115.437 -6.524 -21.208 1.00 1.00 C ATOM 1963 OG SER A 137 116.675 -6.713 -21.881 1.00 1.00 O ATOM 1964 OXT SER A 137 117.488 -8.267 -19.166 1.00 1.00 O ATOM 0 H SER A 137 115.083 -6.272 -17.972 1.00 1.00 H new ATOM 0 HA SER A 137 115.139 -8.201 -19.887 1.00 1.00 H new ATOM 0 HB2 SER A 137 114.625 -6.962 -21.789 1.00 1.00 H new ATOM 0 HB3 SER A 137 115.222 -5.460 -21.112 1.00 1.00 H new ATOM 0 HG SER A 137 116.632 -6.298 -22.768 1.00 1.00 H new TER 1970 SER A 137 HETATM 1971 C1 RAP A 138 101.240 4.914 -7.748 1.00 1.00 C HETATM 1972 O1 RAP A 138 102.507 4.976 -8.240 1.00 1.00 O HETATM 1973 O2 RAP A 138 100.254 5.336 -8.349 1.00 1.00 O HETATM 1974 C2 RAP A 138 101.101 4.093 -6.635 1.00 1.00 C HETATM 1975 C3 RAP A 138 101.897 2.824 -6.895 1.00 1.00 C HETATM 1976 C4 RAP A 138 101.799 1.845 -5.736 1.00 1.00 C HETATM 1977 C5 RAP A 138 100.409 1.792 -5.112 1.00 1.00 C HETATM 1978 C6 RAP A 138 99.343 2.358 -6.039 1.00 1.00 C HETATM 1979 N7 RAP A 138 99.679 3.755 -6.394 1.00 1.00 N HETATM 1980 C8 RAP A 138 98.749 4.720 -6.426 1.00 1.00 C HETATM 1981 O3 RAP A 138 99.109 5.860 -6.716 1.00 1.00 O HETATM 1982 C9 RAP A 138 97.396 4.487 -6.211 1.00 1.00 C HETATM 1983 O4 RAP A 138 96.923 3.354 -6.272 1.00 1.00 O HETATM 1984 C10 RAP A 138 96.563 5.601 -6.212 1.00 1.00 C HETATM 1985 O5 RAP A 138 96.614 6.193 -7.520 1.00 1.00 O HETATM 1986 O6 RAP A 138 95.217 5.206 -5.910 1.00 1.00 O HETATM 1987 C11 RAP A 138 97.051 6.594 -5.166 1.00 1.00 C HETATM 1988 C12 RAP A 138 96.249 7.883 -5.255 1.00 1.00 C HETATM 1989 C13 RAP A 138 96.317 8.423 -6.674 1.00 1.00 C HETATM 1990 C14 RAP A 138 95.778 7.356 -7.611 1.00 1.00 C HETATM 1991 C15 RAP A 138 95.750 7.869 -9.045 1.00 1.00 C HETATM 1992 C16 RAP A 138 97.152 8.210 -9.533 1.00 1.00 C HETATM 1993 O7 RAP A 138 97.156 9.554 -10.032 1.00 1.00 O HETATM 1994 C17 RAP A 138 97.538 7.333 -10.541 1.00 1.00 C HETATM 1995 C18 RAP A 138 97.761 7.814 -11.828 1.00 1.00 C HETATM 1996 C19 RAP A 138 98.149 6.978 -12.871 1.00 1.00 C HETATM 1997 C20 RAP A 138 98.359 7.504 -14.140 1.00 1.00 C HETATM 1998 C21 RAP A 138 98.745 6.678 -15.191 1.00 1.00 C HETATM 1999 C22 RAP A 138 98.957 7.210 -16.459 1.00 1.00 C HETATM 2000 C23 RAP A 138 99.343 6.393 -17.517 1.00 1.00 C HETATM 2001 C24 RAP A 138 100.739 6.751 -18.006 1.00 1.00 C HETATM 2002 C25 RAP A 138 101.821 6.258 -17.055 1.00 1.00 C HETATM 2003 C26 RAP A 138 101.626 6.801 -15.790 1.00 1.00 C HETATM 2004 O8 RAP A 138 101.405 8.007 -15.683 1.00 1.00 O HETATM 2005 C27 RAP A 138 101.682 6.019 -14.640 1.00 1.00 C HETATM 2006 O9 RAP A 138 102.966 6.203 -14.025 1.00 1.00 O HETATM 2007 C28 RAP A 138 101.474 4.539 -14.935 1.00 1.00 C HETATM 2008 O10 RAP A 138 100.309 4.367 -15.753 1.00 1.00 O HETATM 2009 C29 RAP A 138 101.301 3.828 -13.754 1.00 1.00 C HETATM 2010 C30 RAP A 138 102.177 4.049 -12.697 1.00 1.00 C HETATM 2011 C31 RAP A 138 102.043 3.382 -11.485 1.00 1.00 C HETATM 2012 C32 RAP A 138 101.378 4.171 -10.554 1.00 1.00 C HETATM 2013 O11 RAP A 138 100.503 3.657 -9.859 1.00 1.00 O HETATM 2014 C33 RAP A 138 101.610 5.541 -10.458 1.00 1.00 C HETATM 2015 C34 RAP A 138 102.652 5.831 -9.388 1.00 1.00 C HETATM 2016 C35 RAP A 138 102.637 7.302 -8.999 1.00 1.00 C HETATM 2017 C36 RAP A 138 102.964 8.153 -10.229 1.00 1.00 C HETATM 2018 C37 RAP A 138 103.836 9.334 -9.832 1.00 1.00 C HETATM 2019 C38 RAP A 138 103.249 10.039 -8.617 1.00 1.00 C HETATM 2020 C39 RAP A 138 104.132 11.216 -8.229 1.00 1.00 C HETATM 2021 O12 RAP A 138 103.595 11.889 -7.081 1.00 1.00 O HETATM 2022 C40 RAP A 138 105.534 10.716 -7.907 1.00 1.00 C HETATM 2023 O13 RAP A 138 106.371 11.831 -7.571 1.00 1.00 O HETATM 2024 C41 RAP A 138 106.117 9.994 -9.111 1.00 1.00 C HETATM 2025 C42 RAP A 138 105.226 8.822 -9.493 1.00 1.00 C HETATM 2026 C43 RAP A 138 96.906 5.996 -3.778 1.00 1.00 C HETATM 2027 C44 RAP A 138 97.728 5.990 -10.237 1.00 1.00 C HETATM 2028 C45 RAP A 138 98.350 6.565 -18.668 1.00 1.00 C HETATM 2029 C46 RAP A 138 103.198 6.694 -17.565 1.00 1.00 C HETATM 2030 C47 RAP A 138 100.573 2.644 -13.801 1.00 1.00 C HETATM 2031 C48 RAP A 138 103.437 3.017 -10.976 1.00 1.00 C HETATM 2032 C49 RAP A 138 101.265 7.728 -8.467 1.00 1.00 C HETATM 2033 C50 RAP A 138 98.476 10.110 -9.941 1.00 1.00 C HETATM 2034 C51 RAP A 138 103.017 7.464 -13.343 1.00 1.00 C HETATM 2035 C52 RAP A 138 102.311 12.449 -7.393 1.00 1.00 C HETATM 0 H523 RAP A 138 102.414 13.163 -8.210 1.00 1.00 H new HETATM 0 H522 RAP A 138 101.629 11.652 -7.691 1.00 1.00 H new HETATM 0 H521 RAP A 138 101.913 12.957 -6.515 1.00 1.00 H new HETATM 0 H513 RAP A 138 102.846 8.270 -14.056 1.00 1.00 H new HETATM 0 H512 RAP A 138 102.247 7.492 -12.572 1.00 1.00 H new HETATM 0 H511 RAP A 138 103.997 7.589 -12.882 1.00 1.00 H new HETATM 0 H503 RAP A 138 98.798 10.114 -8.900 1.00 1.00 H new HETATM 0 H502 RAP A 138 99.166 9.507 -10.532 1.00 1.00 H new HETATM 0 H501 RAP A 138 98.468 11.131 -10.323 1.00 1.00 H new HETATM 0 H493 RAP A 138 100.510 7.567 -9.237 1.00 1.00 H new HETATM 0 H492 RAP A 138 101.016 7.136 -7.586 1.00 1.00 H new HETATM 0 H491 RAP A 138 101.291 8.784 -8.199 1.00 1.00 H new HETATM 0 H483 RAP A 138 103.932 2.373 -11.702 1.00 1.00 H new HETATM 0 H482 RAP A 138 104.023 3.925 -10.838 1.00 1.00 H new HETATM 0 H481 RAP A 138 103.351 2.492 -10.024 1.00 1.00 H new HETATM 0 H473 RAP A 138 99.563 2.852 -14.155 1.00 1.00 H new HETATM 0 H472 RAP A 138 101.059 1.945 -14.481 1.00 1.00 H new HETATM 0 H471 RAP A 138 100.526 2.206 -12.804 1.00 1.00 H new HETATM 0 H463 RAP A 138 103.369 6.272 -18.555 1.00 1.00 H new HETATM 0 H462 RAP A 138 103.237 7.782 -17.622 1.00 1.00 H new HETATM 0 H461 RAP A 138 103.969 6.339 -16.881 1.00 1.00 H new HETATM 0 H453 RAP A 138 97.352 6.284 -18.332 1.00 1.00 H new HETATM 0 H452 RAP A 138 98.344 7.606 -18.991 1.00 1.00 H new HETATM 0 H451 RAP A 138 98.645 5.928 -19.502 1.00 1.00 H new HETATM 0 H443 RAP A 138 98.508 5.895 -9.482 1.00 1.00 H new HETATM 0 H442 RAP A 138 96.799 5.569 -9.853 1.00 1.00 H new HETATM 0 H441 RAP A 138 98.026 5.452 -11.137 1.00 1.00 H new HETATM 0 H433 RAP A 138 95.858 5.762 -3.590 1.00 1.00 H new HETATM 0 H432 RAP A 138 97.499 5.084 -3.711 1.00 1.00 H new HETATM 0 H431 RAP A 138 97.257 6.712 -3.035 1.00 1.00 H new HETATM 0 H422 RAP A 138 105.172 8.109 -8.671 1.00 1.00 H new HETATM 0 H421 RAP A 138 105.649 8.293 -10.347 1.00 1.00 H new HETATM 0 H412 RAP A 138 106.207 10.683 -9.951 1.00 1.00 H new HETATM 0 H411 RAP A 138 107.122 9.639 -8.882 1.00 1.00 H new HETATM 0 H382 RAP A 138 102.240 10.387 -8.839 1.00 1.00 H new HETATM 0 H381 RAP A 138 103.170 9.341 -7.783 1.00 1.00 H new HETATM 0 H362 RAP A 138 103.478 7.546 -10.974 1.00 1.00 H new HETATM 0 H361 RAP A 138 102.043 8.510 -10.689 1.00 1.00 H new HETATM 0 H332 RAP A 138 101.950 5.926 -11.419 1.00 1.00 H new HETATM 0 H331 RAP A 138 100.680 6.057 -10.218 1.00 1.00 H new HETATM 0 H31A RAP A 138 102.943 3.080 -7.066 1.00 1.00 H new HETATM 0 H242 RAP A 138 100.899 6.318 -18.993 1.00 1.00 H new HETATM 0 H241 RAP A 138 100.818 7.833 -18.116 1.00 1.00 H new HETATM 0 H152 RAP A 138 95.309 7.114 -9.696 1.00 1.00 H new HETATM 0 H151 RAP A 138 95.115 8.753 -9.106 1.00 1.00 H new HETATM 0 H132 RAP A 138 95.731 9.338 -6.762 1.00 1.00 H new HETATM 0 H131 RAP A 138 97.344 8.676 -6.936 1.00 1.00 H new HETATM 0 H122 RAP A 138 95.212 7.699 -4.973 1.00 1.00 H new HETATM 0 H121 RAP A 138 96.644 8.619 -4.555 1.00 1.00 H new HETATM 0 HO6 RAP A 138 95.121 4.240 -6.045 1.00 1.00 H new HETATM 0 HO3 RAP A 138 105.823 12.549 -7.192 1.00 1.00 H new HETATM 0 HO1 RAP A 138 100.422 3.576 -16.321 1.00 1.00 H new HETATM 0 H62 RAP A 138 99.273 1.751 -6.941 1.00 1.00 H new HETATM 0 H61 RAP A 138 98.368 2.321 -5.553 1.00 1.00 H new HETATM 0 H52 RAP A 138 100.162 0.760 -4.865 1.00 1.00 H new HETATM 0 H51 RAP A 138 100.410 2.352 -4.177 1.00 1.00 H new HETATM 0 H42 RAP A 138 102.072 0.849 -6.086 1.00 1.00 H new HETATM 0 H41 RAP A 138 102.524 2.124 -4.971 1.00 1.00 H new HETATM 0 H40 RAP A 138 105.483 10.026 -7.065 1.00 1.00 H new HETATM 0 H39 RAP A 138 104.169 11.915 -9.065 1.00 1.00 H new HETATM 0 H37 RAP A 138 103.884 10.042 -10.659 1.00 1.00 H new HETATM 0 H35 RAP A 138 103.379 7.449 -8.214 1.00 1.00 H new HETATM 0 H34 RAP A 138 103.628 5.608 -9.818 1.00 1.00 H new HETATM 0 H32 RAP A 138 101.532 2.347 -7.805 1.00 1.00 H new HETATM 0 H31 RAP A 138 101.451 2.479 -11.631 1.00 1.00 H new HETATM 0 H30 RAP A 138 102.990 4.764 -12.822 1.00 1.00 H new HETATM 0 H28 RAP A 138 102.355 4.165 -15.456 1.00 1.00 H new HETATM 0 H27 RAP A 138 100.877 6.335 -13.976 1.00 1.00 H new HETATM 0 H25 RAP A 138 101.769 5.170 -17.003 1.00 1.00 H new HETATM 0 H23 RAP A 138 99.353 5.360 -17.171 1.00 1.00 H new HETATM 0 H22 RAP A 138 98.819 8.278 -16.625 1.00 1.00 H new HETATM 0 H21 RAP A 138 98.882 5.610 -15.020 1.00 1.00 H new HETATM 0 H20 RAP A 138 98.220 8.571 -14.313 1.00 1.00 H new HETATM 0 H2 RAP A 138 101.469 4.610 -5.749 1.00 1.00 H new HETATM 0 H19 RAP A 138 98.288 5.912 -12.693 1.00 1.00 H new HETATM 0 H18 RAP A 138 97.628 8.878 -12.025 1.00 1.00 H new HETATM 0 H16 RAP A 138 97.856 8.119 -8.706 1.00 1.00 H new HETATM 0 H14 RAP A 138 94.758 7.102 -7.321 1.00 1.00 H new HETATM 0 H11 RAP A 138 98.102 6.815 -5.354 1.00 1.00 H new