USER MOD reduce.3.24.130724 H: found=0, std=0, add=1073, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 1051 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 47 LYS NZ :NH3+ -129:sc= 1.58 (180deg=1.24) USER MOD Set 1.2: A 82 THR OG1 : rot 92:sc= 1.32 USER MOD Single : A 1 ASN : amide:sc=-0.00754 X(o=-0.0075,f=-0.5) USER MOD Single : A 1 ASN N :NH3+ -122:sc= 0.0825 (180deg=-0.0145) USER MOD Single : A 7 THR OG1 : rot -109:sc= 0.843 USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 11 SER OG : rot -31:sc= 0.395 USER MOD Single : A 16 GLN :FLIP amide:sc= 0 F(o=-0.69,f=0) USER MOD Single : A 18 GLN : amide:sc= -1.27 K(o=-1.3,f=-6.2!) USER MOD Single : A 20 SER OG : rot -50:sc= 0.0817 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 THR OG1 : rot 52:sc= 0.136 USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 33 GLN : amide:sc= 0 K(o=0,f=-0.65) USER MOD Single : A 35 LYS NZ :NH3+ 168:sc= -0.0231 (180deg=-0.193) USER MOD Single : A 36 GLN : amide:sc= 0.0016 K(o=0.0016,f=-0.51) USER MOD Single : A 39 MET CE :methyl -171:sc= -0.0206 (180deg=-0.182) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 ASN : amide:sc= 0.919 K(o=0.92,f=-0.32) USER MOD Single : A 51 GLN : amide:sc= 0.724 K(o=0.72,f=0) USER MOD Single : A 53 SER OG : rot -169:sc= -1.26 USER MOD Single : A 62 GLN :FLIP amide:sc= -0.15 F(o=-1,f=-0.15) USER MOD Single : A 63 LYS NZ :NH3+ -138:sc= 1.19 (180deg=0.692) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 HIS : no HD1:sc= -1.29! C(o=-1.3!,f=-4.4!) USER MOD Single : A 84 SER OG : rot 180:sc= 0.0972 USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 93 ASN :FLIP amide:sc= 0 F(o=-1.1,f=0) USER MOD Single : A 100 ASN : amide:sc= -0.0782 K(o=-0.078,f=-2.1!) USER MOD Single : A 106 ASN :FLIP amide:sc= 0.494 F(o=-3!,f=0.49) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 125 TYR OH : rot 180:sc= 0 USER MOD Single : A 126 ASN : amide:sc= 0 K(o=0,f=-0.61) USER MOD Single : A 135 MET CE :methyl 166:sc= -0.0609 (180deg=-0.369) USER MOD ----------------------------------------------------------------- ATOM 1 N ASN A 1 -54.046 39.010 -16.203 1.00 0.00 N ATOM 2 CA ASN A 1 -52.647 39.088 -16.624 1.00 0.00 C ATOM 3 C ASN A 1 -52.352 37.938 -17.549 1.00 0.00 C ATOM 4 O ASN A 1 -53.049 36.928 -17.516 1.00 0.00 O ATOM 5 CB ASN A 1 -51.687 39.028 -15.418 1.00 0.00 C ATOM 6 CG ASN A 1 -51.894 40.145 -14.417 1.00 0.00 C ATOM 7 OD1 ASN A 1 -52.360 41.233 -14.761 1.00 0.00 O ATOM 8 ND2 ASN A 1 -51.528 39.903 -13.182 1.00 0.00 N ATOM 0 H1 ASN A 1 -54.538 39.887 -16.468 1.00 0.00 H new ATOM 0 H2 ASN A 1 -54.504 38.202 -16.670 1.00 0.00 H new ATOM 0 H3 ASN A 1 -54.092 38.886 -15.171 1.00 0.00 H new ATOM 0 HA ASN A 1 -52.494 40.041 -17.130 1.00 0.00 H new ATOM 0 HB2 ASN A 1 -51.813 38.071 -14.912 1.00 0.00 H new ATOM 0 HB3 ASN A 1 -50.660 39.063 -15.781 1.00 0.00 H new ATOM 0 HD21 ASN A 1 -51.625 40.627 -12.470 1.00 0.00 H new ATOM 0 HD22 ASN A 1 -51.146 38.991 -12.933 1.00 0.00 H new ATOM 14 N GLU A 2 -51.336 38.077 -18.371 1.00 0.00 N ATOM 15 CA GLU A 2 -50.939 37.018 -19.274 1.00 0.00 C ATOM 16 C GLU A 2 -49.725 36.320 -18.687 1.00 0.00 C ATOM 17 O GLU A 2 -49.086 36.851 -17.782 1.00 0.00 O ATOM 18 CB GLU A 2 -50.564 37.586 -20.649 1.00 0.00 C ATOM 19 CG GLU A 2 -49.312 38.451 -20.623 1.00 0.00 C ATOM 20 CD GLU A 2 -48.883 38.924 -21.972 1.00 0.00 C ATOM 21 OE1 GLU A 2 -48.288 38.131 -22.736 1.00 0.00 O ATOM 22 OE2 GLU A 2 -49.080 40.109 -22.282 1.00 0.00 O ATOM 0 H GLU A 2 -50.765 38.920 -18.433 1.00 0.00 H new ATOM 0 HA GLU A 2 -51.770 36.324 -19.398 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -50.413 36.762 -21.346 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -51.397 38.177 -21.030 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -49.492 39.316 -19.984 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -48.498 37.884 -20.171 1.00 0.00 H new ATOM 29 N PHE A 3 -49.419 35.168 -19.184 1.00 0.00 N ATOM 30 CA PHE A 3 -48.251 34.440 -18.777 1.00 0.00 C ATOM 31 C PHE A 3 -47.831 33.514 -19.917 1.00 0.00 C ATOM 32 O PHE A 3 -48.098 32.319 -19.906 1.00 0.00 O ATOM 33 CB PHE A 3 -48.506 33.667 -17.458 1.00 0.00 C ATOM 34 CG PHE A 3 -47.301 32.958 -16.900 1.00 0.00 C ATOM 35 CD1 PHE A 3 -46.199 33.675 -16.465 1.00 0.00 C ATOM 36 CD2 PHE A 3 -47.280 31.577 -16.799 1.00 0.00 C ATOM 37 CE1 PHE A 3 -45.095 33.027 -15.946 1.00 0.00 C ATOM 38 CE2 PHE A 3 -46.180 30.923 -16.280 1.00 0.00 C ATOM 39 CZ PHE A 3 -45.086 31.649 -15.854 1.00 0.00 C ATOM 0 H PHE A 3 -49.977 34.694 -19.894 1.00 0.00 H new ATOM 0 HA PHE A 3 -47.436 35.133 -18.570 1.00 0.00 H new ATOM 0 HB2 PHE A 3 -48.878 34.366 -16.709 1.00 0.00 H new ATOM 0 HB3 PHE A 3 -49.295 32.934 -17.629 1.00 0.00 H new ATOM 0 HD1 PHE A 3 -46.203 34.753 -16.532 1.00 0.00 H new ATOM 0 HD2 PHE A 3 -48.134 31.005 -17.130 1.00 0.00 H new ATOM 0 HE1 PHE A 3 -44.240 33.597 -15.613 1.00 0.00 H new ATOM 0 HE2 PHE A 3 -46.176 29.845 -16.208 1.00 0.00 H new ATOM 0 HZ PHE A 3 -44.224 31.140 -15.449 1.00 0.00 H new ATOM 49 N GLU A 4 -47.255 34.096 -20.941 1.00 0.00 N ATOM 50 CA GLU A 4 -46.814 33.349 -22.102 1.00 0.00 C ATOM 51 C GLU A 4 -45.314 33.174 -22.069 1.00 0.00 C ATOM 52 O GLU A 4 -44.570 34.139 -21.835 1.00 0.00 O ATOM 53 CB GLU A 4 -47.210 34.068 -23.393 1.00 0.00 C ATOM 54 CG GLU A 4 -48.704 34.170 -23.630 1.00 0.00 C ATOM 55 CD GLU A 4 -49.358 32.821 -23.777 1.00 0.00 C ATOM 56 OE1 GLU A 4 -49.141 32.149 -24.793 1.00 0.00 O ATOM 57 OE2 GLU A 4 -50.130 32.421 -22.900 1.00 0.00 O ATOM 0 H GLU A 4 -47.077 35.099 -20.996 1.00 0.00 H new ATOM 0 HA GLU A 4 -47.297 32.372 -22.078 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -46.789 35.073 -23.376 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -46.757 33.547 -24.236 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -49.165 34.705 -22.800 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -48.887 34.759 -24.529 1.00 0.00 H new ATOM 64 N LEU A 5 -44.870 31.963 -22.275 1.00 0.00 N ATOM 65 CA LEU A 5 -43.451 31.660 -22.300 1.00 0.00 C ATOM 66 C LEU A 5 -43.006 31.426 -23.734 1.00 0.00 C ATOM 67 O LEU A 5 -41.818 31.238 -24.019 1.00 0.00 O ATOM 68 CB LEU A 5 -43.104 30.431 -21.413 1.00 0.00 C ATOM 69 CG LEU A 5 -43.244 30.585 -19.872 1.00 0.00 C ATOM 70 CD1 LEU A 5 -44.671 30.863 -19.443 1.00 0.00 C ATOM 71 CD2 LEU A 5 -42.745 29.342 -19.175 1.00 0.00 C ATOM 0 H LEU A 5 -45.474 31.156 -22.431 1.00 0.00 H new ATOM 0 HA LEU A 5 -42.915 32.514 -21.887 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -43.740 29.602 -21.726 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -42.075 30.143 -21.628 1.00 0.00 H new ATOM 0 HG LEU A 5 -42.638 31.445 -19.585 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -44.712 30.962 -18.358 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -45.016 31.788 -19.905 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -45.312 30.039 -19.757 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -42.849 29.463 -18.097 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -43.330 28.482 -19.501 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -41.696 29.182 -19.423 1.00 0.00 H new ATOM 83 N GLY A 6 -43.969 31.432 -24.634 1.00 0.00 N ATOM 84 CA GLY A 6 -43.688 31.271 -26.030 1.00 0.00 C ATOM 85 C GLY A 6 -43.758 29.827 -26.436 1.00 0.00 C ATOM 86 O GLY A 6 -44.822 29.333 -26.827 1.00 0.00 O ATOM 0 H GLY A 6 -44.958 31.548 -24.412 1.00 0.00 H new ATOM 0 HA2 GLY A 6 -44.401 31.851 -26.616 1.00 0.00 H new ATOM 0 HA3 GLY A 6 -42.697 31.666 -26.252 1.00 0.00 H new ATOM 90 N THR A 7 -42.641 29.147 -26.327 1.00 0.00 N ATOM 91 CA THR A 7 -42.551 27.751 -26.655 1.00 0.00 C ATOM 92 C THR A 7 -41.252 27.153 -26.087 1.00 0.00 C ATOM 93 O THR A 7 -40.140 27.387 -26.598 1.00 0.00 O ATOM 94 CB THR A 7 -42.697 27.482 -28.202 1.00 0.00 C ATOM 95 OG1 THR A 7 -42.595 26.082 -28.491 1.00 0.00 O ATOM 96 CG2 THR A 7 -41.670 28.260 -29.035 1.00 0.00 C ATOM 0 H THR A 7 -41.763 29.555 -26.005 1.00 0.00 H new ATOM 0 HA THR A 7 -43.395 27.246 -26.185 1.00 0.00 H new ATOM 0 HB THR A 7 -43.688 27.838 -28.483 1.00 0.00 H new ATOM 0 HG1 THR A 7 -41.746 25.903 -28.947 1.00 0.00 H new ATOM 0 HG21 THR A 7 -41.816 28.038 -30.092 1.00 0.00 H new ATOM 0 HG22 THR A 7 -41.801 29.329 -28.868 1.00 0.00 H new ATOM 0 HG23 THR A 7 -40.663 27.966 -28.738 1.00 0.00 H new ATOM 104 N ARG A 8 -41.382 26.459 -24.986 1.00 0.00 N ATOM 105 CA ARG A 8 -40.265 25.801 -24.345 1.00 0.00 C ATOM 106 C ARG A 8 -40.739 24.481 -23.783 1.00 0.00 C ATOM 107 O ARG A 8 -41.947 24.215 -23.764 1.00 0.00 O ATOM 108 CB ARG A 8 -39.658 26.667 -23.219 1.00 0.00 C ATOM 109 CG ARG A 8 -39.033 27.976 -23.687 1.00 0.00 C ATOM 110 CD ARG A 8 -38.426 28.742 -22.536 1.00 0.00 C ATOM 111 NE ARG A 8 -37.828 30.012 -22.967 1.00 0.00 N ATOM 112 CZ ARG A 8 -36.819 30.636 -22.336 1.00 0.00 C ATOM 113 NH1 ARG A 8 -36.270 30.093 -21.246 1.00 0.00 N ATOM 114 NH2 ARG A 8 -36.358 31.800 -22.793 1.00 0.00 N ATOM 0 H ARG A 8 -42.271 26.332 -24.503 1.00 0.00 H new ATOM 0 HA ARG A 8 -39.483 25.641 -25.087 1.00 0.00 H new ATOM 0 HB2 ARG A 8 -40.438 26.893 -22.492 1.00 0.00 H new ATOM 0 HB3 ARG A 8 -38.898 26.083 -22.700 1.00 0.00 H new ATOM 0 HG2 ARG A 8 -38.265 27.768 -24.432 1.00 0.00 H new ATOM 0 HG3 ARG A 8 -39.792 28.589 -24.174 1.00 0.00 H new ATOM 0 HD2 ARG A 8 -39.194 28.940 -21.788 1.00 0.00 H new ATOM 0 HD3 ARG A 8 -37.664 28.128 -22.055 1.00 0.00 H new ATOM 0 HE ARG A 8 -38.206 30.452 -23.806 1.00 0.00 H new ATOM 0 HH11 ARG A 8 -36.617 29.202 -20.890 1.00 0.00 H new ATOM 0 HH12 ARG A 8 -35.504 30.569 -20.769 1.00 0.00 H new ATOM 0 HH21 ARG A 8 -36.771 32.221 -23.625 1.00 0.00 H new ATOM 0 HH22 ARG A 8 -35.592 32.270 -22.311 1.00 0.00 H new ATOM 127 N GLY A 9 -39.827 23.649 -23.375 1.00 0.00 N ATOM 128 CA GLY A 9 -40.208 22.414 -22.779 1.00 0.00 C ATOM 129 C GLY A 9 -39.225 21.315 -23.051 1.00 0.00 C ATOM 130 O GLY A 9 -38.825 21.090 -24.197 1.00 0.00 O ATOM 0 H GLY A 9 -38.822 23.806 -23.445 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -40.307 22.550 -21.702 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -41.188 22.121 -23.155 1.00 0.00 H new ATOM 134 N SER A 10 -38.824 20.657 -22.014 1.00 0.00 N ATOM 135 CA SER A 10 -37.931 19.544 -22.091 1.00 0.00 C ATOM 136 C SER A 10 -38.751 18.250 -22.027 1.00 0.00 C ATOM 137 O SER A 10 -38.459 17.269 -22.727 1.00 0.00 O ATOM 138 CB SER A 10 -36.914 19.624 -20.932 1.00 0.00 C ATOM 139 OG SER A 10 -35.986 18.549 -20.953 1.00 0.00 O ATOM 0 H SER A 10 -39.115 20.883 -21.063 1.00 0.00 H new ATOM 0 HA SER A 10 -37.376 19.559 -23.029 1.00 0.00 H new ATOM 0 HB2 SER A 10 -36.373 20.569 -20.991 1.00 0.00 H new ATOM 0 HB3 SER A 10 -37.448 19.621 -19.982 1.00 0.00 H new ATOM 0 HG SER A 10 -35.361 18.641 -20.203 1.00 0.00 H new ATOM 145 N SER A 11 -39.839 18.289 -21.271 1.00 0.00 N ATOM 146 CA SER A 11 -40.671 17.122 -21.069 1.00 0.00 C ATOM 147 C SER A 11 -41.543 16.844 -22.303 1.00 0.00 C ATOM 148 O SER A 11 -42.246 15.841 -22.361 1.00 0.00 O ATOM 149 CB SER A 11 -41.527 17.285 -19.800 1.00 0.00 C ATOM 150 OG SER A 11 -42.263 16.098 -19.507 1.00 0.00 O ATOM 0 H SER A 11 -40.164 19.125 -20.786 1.00 0.00 H new ATOM 0 HA SER A 11 -40.022 16.257 -20.929 1.00 0.00 H new ATOM 0 HB2 SER A 11 -40.884 17.533 -18.956 1.00 0.00 H new ATOM 0 HB3 SER A 11 -42.217 18.119 -19.930 1.00 0.00 H new ATOM 0 HG SER A 11 -42.478 15.632 -20.342 1.00 0.00 H new ATOM 156 N ARG A 12 -41.496 17.748 -23.275 1.00 0.00 N ATOM 157 CA ARG A 12 -42.178 17.540 -24.541 1.00 0.00 C ATOM 158 C ARG A 12 -41.312 16.666 -25.447 1.00 0.00 C ATOM 159 O ARG A 12 -41.747 16.213 -26.498 1.00 0.00 O ATOM 160 CB ARG A 12 -42.537 18.879 -25.222 1.00 0.00 C ATOM 161 CG ARG A 12 -41.354 19.753 -25.594 1.00 0.00 C ATOM 162 CD ARG A 12 -41.815 21.086 -26.168 1.00 0.00 C ATOM 163 NE ARG A 12 -40.682 21.952 -26.532 1.00 0.00 N ATOM 164 CZ ARG A 12 -40.785 23.138 -27.152 1.00 0.00 C ATOM 165 NH1 ARG A 12 -41.981 23.634 -27.457 1.00 0.00 N ATOM 166 NH2 ARG A 12 -39.691 23.825 -27.464 1.00 0.00 N ATOM 0 H ARG A 12 -40.991 18.632 -23.208 1.00 0.00 H new ATOM 0 HA ARG A 12 -43.120 17.026 -24.350 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -43.109 18.667 -26.125 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -43.190 19.443 -24.556 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -40.736 19.927 -24.713 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -40.731 19.236 -26.324 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -42.432 20.907 -27.049 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -42.442 21.598 -25.438 1.00 0.00 H new ATOM 0 HE ARG A 12 -39.745 21.625 -26.295 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -42.825 23.113 -27.220 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -42.054 24.536 -27.928 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -38.771 23.451 -27.232 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -39.772 24.726 -27.935 1.00 0.00 H new ATOM 179 N VAL A 13 -40.079 16.444 -25.024 1.00 0.00 N ATOM 180 CA VAL A 13 -39.168 15.575 -25.739 1.00 0.00 C ATOM 181 C VAL A 13 -39.003 14.281 -24.956 1.00 0.00 C ATOM 182 O VAL A 13 -39.184 13.187 -25.488 1.00 0.00 O ATOM 183 CB VAL A 13 -37.785 16.245 -25.974 1.00 0.00 C ATOM 184 CG1 VAL A 13 -36.843 15.318 -26.741 1.00 0.00 C ATOM 185 CG2 VAL A 13 -37.945 17.564 -26.715 1.00 0.00 C ATOM 0 H VAL A 13 -39.686 16.860 -24.180 1.00 0.00 H new ATOM 0 HA VAL A 13 -39.591 15.368 -26.722 1.00 0.00 H new ATOM 0 HB VAL A 13 -37.344 16.444 -24.997 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -35.884 15.815 -26.890 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -36.692 14.401 -26.172 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -37.280 15.076 -27.710 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -36.965 18.016 -26.869 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -38.417 17.384 -27.681 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -38.567 18.239 -26.127 1.00 0.00 H new ATOM 195 N ASP A 14 -38.685 14.416 -23.698 1.00 0.00 N ATOM 196 CA ASP A 14 -38.544 13.262 -22.812 1.00 0.00 C ATOM 197 C ASP A 14 -39.826 13.080 -22.034 1.00 0.00 C ATOM 198 O ASP A 14 -40.069 13.784 -21.050 1.00 0.00 O ATOM 199 CB ASP A 14 -37.370 13.406 -21.818 1.00 0.00 C ATOM 200 CG ASP A 14 -36.010 13.525 -22.460 1.00 0.00 C ATOM 201 OD1 ASP A 14 -35.519 12.538 -23.033 1.00 0.00 O ATOM 202 OD2 ASP A 14 -35.381 14.596 -22.351 1.00 0.00 O ATOM 0 H ASP A 14 -38.515 15.315 -23.248 1.00 0.00 H new ATOM 0 HA ASP A 14 -38.333 12.396 -23.439 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -37.542 14.286 -21.199 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -37.368 12.543 -21.152 1.00 0.00 H new ATOM 207 N LEU A 15 -40.660 12.173 -22.480 1.00 0.00 N ATOM 208 CA LEU A 15 -41.944 11.947 -21.828 1.00 0.00 C ATOM 209 C LEU A 15 -41.891 10.729 -20.902 1.00 0.00 C ATOM 210 O LEU A 15 -42.134 10.829 -19.691 1.00 0.00 O ATOM 211 CB LEU A 15 -43.099 11.775 -22.853 1.00 0.00 C ATOM 212 CG LEU A 15 -43.460 12.975 -23.761 1.00 0.00 C ATOM 213 CD1 LEU A 15 -42.435 13.195 -24.857 1.00 0.00 C ATOM 214 CD2 LEU A 15 -44.843 12.799 -24.356 1.00 0.00 C ATOM 0 H LEU A 15 -40.482 11.577 -23.288 1.00 0.00 H new ATOM 0 HA LEU A 15 -42.148 12.837 -21.233 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -42.848 10.934 -23.499 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -43.996 11.496 -22.300 1.00 0.00 H new ATOM 0 HG LEU A 15 -43.456 13.865 -23.131 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -42.732 14.048 -25.467 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -41.461 13.391 -24.410 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -42.374 12.304 -25.483 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -45.077 13.653 -24.991 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -44.870 11.886 -24.951 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -45.578 12.731 -23.554 1.00 0.00 H new ATOM 226 N GLN A 16 -41.583 9.593 -21.469 1.00 0.00 N ATOM 227 CA GLN A 16 -41.537 8.341 -20.737 1.00 0.00 C ATOM 228 C GLN A 16 -40.100 7.848 -20.589 1.00 0.00 C ATOM 229 O GLN A 16 -39.665 7.456 -19.498 1.00 0.00 O ATOM 230 CB GLN A 16 -42.376 7.284 -21.471 1.00 0.00 C ATOM 231 CG GLN A 16 -42.395 5.919 -20.797 1.00 0.00 C ATOM 232 CD GLN A 16 -43.141 4.859 -21.591 1.00 0.00 C ATOM 233 OE1 GLN A 16 -44.129 5.255 -22.353 1.00 0.00 O flip ATOM 234 NE2 GLN A 16 -42.811 3.673 -21.516 1.00 0.00 N flip ATOM 0 H GLN A 16 -41.354 9.503 -22.459 1.00 0.00 H new ATOM 0 HA GLN A 16 -41.946 8.508 -19.741 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -43.400 7.647 -21.559 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -41.990 7.170 -22.484 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -41.369 5.587 -20.638 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -42.855 6.015 -19.813 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -42.036 3.396 -20.913 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -43.313 2.969 -22.057 1.00 0.00 H new ATOM 243 N GLU A 17 -39.367 7.881 -21.677 1.00 0.00 N ATOM 244 CA GLU A 17 -38.014 7.373 -21.691 1.00 0.00 C ATOM 245 C GLU A 17 -37.075 8.415 -21.211 1.00 0.00 C ATOM 246 O GLU A 17 -37.241 9.599 -21.549 1.00 0.00 O ATOM 247 CB GLU A 17 -37.594 6.950 -23.078 1.00 0.00 C ATOM 248 CG GLU A 17 -38.496 5.947 -23.740 1.00 0.00 C ATOM 249 CD GLU A 17 -37.972 5.567 -25.086 1.00 0.00 C ATOM 250 OE1 GLU A 17 -37.888 6.443 -25.972 1.00 0.00 O ATOM 251 OE2 GLU A 17 -37.595 4.395 -25.272 1.00 0.00 O ATOM 0 H GLU A 17 -39.687 8.257 -22.570 1.00 0.00 H new ATOM 0 HA GLU A 17 -37.986 6.504 -21.034 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -37.537 7.837 -23.710 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -36.589 6.532 -23.025 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -38.580 5.059 -23.114 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -39.498 6.363 -23.840 1.00 0.00 H new ATOM 258 N GLN A 18 -36.090 7.979 -20.433 1.00 0.00 N ATOM 259 CA GLN A 18 -35.041 8.818 -19.874 1.00 0.00 C ATOM 260 C GLN A 18 -35.567 9.807 -18.822 1.00 0.00 C ATOM 261 O GLN A 18 -35.163 9.735 -17.660 1.00 0.00 O ATOM 262 CB GLN A 18 -34.233 9.516 -20.996 1.00 0.00 C ATOM 263 CG GLN A 18 -33.216 10.529 -20.510 1.00 0.00 C ATOM 264 CD GLN A 18 -32.354 11.072 -21.630 1.00 0.00 C ATOM 265 OE1 GLN A 18 -31.285 10.542 -21.912 1.00 0.00 O ATOM 266 NE2 GLN A 18 -32.822 12.085 -22.299 1.00 0.00 N ATOM 0 H GLN A 18 -35.999 6.999 -20.166 1.00 0.00 H new ATOM 0 HA GLN A 18 -34.355 8.163 -19.337 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -33.716 8.754 -21.580 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -34.930 10.016 -21.669 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -33.735 11.355 -20.023 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -32.578 10.066 -19.758 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -33.715 12.501 -22.036 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -32.296 12.463 -23.087 1.00 0.00 H new ATOM 275 N ARG A 19 -36.483 10.668 -19.247 1.00 0.00 N ATOM 276 CA ARG A 19 -37.084 11.756 -18.461 1.00 0.00 C ATOM 277 C ARG A 19 -36.051 12.731 -17.884 1.00 0.00 C ATOM 278 O ARG A 19 -35.815 13.785 -18.449 1.00 0.00 O ATOM 279 CB ARG A 19 -38.081 11.247 -17.402 1.00 0.00 C ATOM 280 CG ARG A 19 -38.698 12.354 -16.542 1.00 0.00 C ATOM 281 CD ARG A 19 -39.860 11.836 -15.719 1.00 0.00 C ATOM 282 NE ARG A 19 -40.970 11.407 -16.575 1.00 0.00 N ATOM 283 CZ ARG A 19 -42.003 10.656 -16.184 1.00 0.00 C ATOM 284 NH1 ARG A 19 -42.136 10.315 -14.910 1.00 0.00 N ATOM 285 NH2 ARG A 19 -42.909 10.262 -17.073 1.00 0.00 N ATOM 0 H ARG A 19 -36.851 10.630 -20.198 1.00 0.00 H new ATOM 0 HA ARG A 19 -37.669 12.339 -19.172 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -38.881 10.703 -17.904 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -37.572 10.537 -16.751 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -37.938 12.768 -15.880 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -39.039 13.167 -17.183 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -39.528 11.000 -15.104 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -40.203 12.616 -15.039 1.00 0.00 H new ATOM 0 HE ARG A 19 -40.952 11.707 -17.550 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -41.448 10.626 -14.224 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -42.926 9.741 -14.615 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -42.815 10.533 -18.052 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -43.699 9.688 -16.777 1.00 0.00 H new ATOM 298 N SER A 20 -35.423 12.363 -16.805 1.00 0.00 N ATOM 299 CA SER A 20 -34.454 13.200 -16.150 1.00 0.00 C ATOM 300 C SER A 20 -33.267 12.300 -15.798 1.00 0.00 C ATOM 301 O SER A 20 -32.625 12.447 -14.768 1.00 0.00 O ATOM 302 CB SER A 20 -35.107 13.822 -14.897 1.00 0.00 C ATOM 303 OG SER A 20 -34.297 14.823 -14.309 1.00 0.00 O ATOM 0 H SER A 20 -35.570 11.463 -16.348 1.00 0.00 H new ATOM 0 HA SER A 20 -34.110 14.022 -16.778 1.00 0.00 H new ATOM 0 HB2 SER A 20 -36.072 14.251 -15.168 1.00 0.00 H new ATOM 0 HB3 SER A 20 -35.301 13.038 -14.165 1.00 0.00 H new ATOM 0 HG SER A 20 -33.389 14.477 -14.183 1.00 0.00 H new ATOM 309 N VAL A 21 -33.005 11.381 -16.718 1.00 0.00 N ATOM 310 CA VAL A 21 -31.960 10.359 -16.653 1.00 0.00 C ATOM 311 C VAL A 21 -32.091 9.362 -15.504 1.00 0.00 C ATOM 312 O VAL A 21 -31.278 9.312 -14.583 1.00 0.00 O ATOM 313 CB VAL A 21 -30.464 10.804 -16.942 1.00 0.00 C ATOM 314 CG1 VAL A 21 -30.328 11.362 -18.346 1.00 0.00 C ATOM 315 CG2 VAL A 21 -29.900 11.795 -15.918 1.00 0.00 C ATOM 0 H VAL A 21 -33.546 11.323 -17.581 1.00 0.00 H new ATOM 0 HA VAL A 21 -32.205 9.800 -17.556 1.00 0.00 H new ATOM 0 HB VAL A 21 -29.866 9.898 -16.849 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -29.294 11.660 -18.520 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -30.613 10.599 -19.070 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -30.979 12.229 -18.458 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -28.874 12.050 -16.185 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -30.509 12.699 -15.913 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -29.915 11.342 -14.927 1.00 0.00 H new ATOM 325 N LYS A 22 -33.174 8.625 -15.536 1.00 0.00 N ATOM 326 CA LYS A 22 -33.355 7.511 -14.633 1.00 0.00 C ATOM 327 C LYS A 22 -32.868 6.273 -15.341 1.00 0.00 C ATOM 328 O LYS A 22 -31.818 5.712 -15.011 1.00 0.00 O ATOM 329 CB LYS A 22 -34.835 7.356 -14.224 1.00 0.00 C ATOM 330 CG LYS A 22 -35.143 6.115 -13.389 1.00 0.00 C ATOM 331 CD LYS A 22 -34.367 6.080 -12.088 1.00 0.00 C ATOM 332 CE LYS A 22 -34.649 4.795 -11.336 1.00 0.00 C ATOM 333 NZ LYS A 22 -33.916 4.724 -10.061 1.00 0.00 N ATOM 0 H LYS A 22 -33.949 8.777 -16.181 1.00 0.00 H new ATOM 0 HA LYS A 22 -32.790 7.678 -13.716 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -35.136 8.239 -13.661 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -35.446 7.330 -15.126 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -36.211 6.084 -13.172 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -34.910 5.223 -13.971 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -33.299 6.162 -12.292 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -34.640 6.936 -11.472 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -35.719 4.716 -11.143 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -34.374 3.944 -11.959 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -34.139 3.829 -9.581 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -32.894 4.772 -10.245 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -34.196 5.521 -9.454 1.00 0.00 H new ATOM 346 N THR A 23 -33.601 5.890 -16.346 1.00 0.00 N ATOM 347 CA THR A 23 -33.276 4.775 -17.149 1.00 0.00 C ATOM 348 C THR A 23 -32.466 5.244 -18.354 1.00 0.00 C ATOM 349 O THR A 23 -33.030 5.602 -19.406 1.00 0.00 O ATOM 350 CB THR A 23 -34.574 4.063 -17.576 1.00 0.00 C ATOM 351 OG1 THR A 23 -35.548 5.064 -17.983 1.00 0.00 O ATOM 352 CG2 THR A 23 -35.145 3.256 -16.424 1.00 0.00 C ATOM 0 H THR A 23 -34.460 6.364 -16.626 1.00 0.00 H new ATOM 0 HA THR A 23 -32.669 4.063 -16.590 1.00 0.00 H new ATOM 0 HB THR A 23 -34.352 3.387 -18.402 1.00 0.00 H new ATOM 0 HG1 THR A 23 -35.142 5.667 -18.640 1.00 0.00 H new ATOM 0 HG21 THR A 23 -36.061 2.761 -16.746 1.00 0.00 H new ATOM 0 HG22 THR A 23 -34.419 2.507 -16.110 1.00 0.00 H new ATOM 0 HG23 THR A 23 -35.366 3.920 -15.589 1.00 0.00 H new ATOM 360 N ARG A 24 -31.149 5.333 -18.162 1.00 0.00 N ATOM 361 CA ARG A 24 -30.247 5.824 -19.201 1.00 0.00 C ATOM 362 C ARG A 24 -28.814 5.874 -18.688 1.00 0.00 C ATOM 363 O ARG A 24 -27.866 5.772 -19.463 1.00 0.00 O ATOM 364 CB ARG A 24 -30.659 7.245 -19.643 1.00 0.00 C ATOM 365 CG ARG A 24 -30.052 7.706 -20.955 1.00 0.00 C ATOM 366 CD ARG A 24 -30.397 6.748 -22.100 1.00 0.00 C ATOM 367 NE ARG A 24 -31.844 6.423 -22.167 1.00 0.00 N ATOM 368 CZ ARG A 24 -32.525 6.167 -23.300 1.00 0.00 C ATOM 369 NH1 ARG A 24 -31.943 6.337 -24.489 1.00 0.00 N ATOM 370 NH2 ARG A 24 -33.790 5.764 -23.243 1.00 0.00 N ATOM 0 H ARG A 24 -30.684 5.070 -17.293 1.00 0.00 H new ATOM 0 HA ARG A 24 -30.310 5.139 -20.047 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -31.745 7.283 -19.729 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -30.376 7.950 -18.861 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -30.415 8.706 -21.194 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -28.969 7.776 -20.852 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -30.086 7.193 -23.045 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -29.828 5.826 -21.979 1.00 0.00 H new ATOM 0 HE ARG A 24 -32.361 6.391 -21.288 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -30.978 6.662 -24.542 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -32.463 6.142 -25.344 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -34.248 5.648 -22.339 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -34.303 5.571 -24.103 1.00 0.00 H new ATOM 383 N VAL A 25 -28.660 6.059 -17.396 1.00 0.00 N ATOM 384 CA VAL A 25 -27.344 6.216 -16.811 1.00 0.00 C ATOM 385 C VAL A 25 -27.144 5.260 -15.652 1.00 0.00 C ATOM 386 O VAL A 25 -28.114 4.744 -15.080 1.00 0.00 O ATOM 387 CB VAL A 25 -27.094 7.674 -16.325 1.00 0.00 C ATOM 388 CG1 VAL A 25 -27.139 8.651 -17.488 1.00 0.00 C ATOM 389 CG2 VAL A 25 -28.101 8.083 -15.247 1.00 0.00 C ATOM 0 H VAL A 25 -29.430 6.105 -16.728 1.00 0.00 H new ATOM 0 HA VAL A 25 -26.625 5.986 -17.597 1.00 0.00 H new ATOM 0 HB VAL A 25 -26.097 7.705 -15.886 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -26.961 9.662 -17.121 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -26.370 8.388 -18.214 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -28.118 8.605 -17.964 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -27.899 9.106 -14.929 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -29.112 8.022 -15.651 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -28.011 7.413 -14.392 1.00 0.00 H new ATOM 399 N SER A 26 -25.912 5.029 -15.317 1.00 0.00 N ATOM 400 CA SER A 26 -25.558 4.175 -14.224 1.00 0.00 C ATOM 401 C SER A 26 -24.920 5.013 -13.110 1.00 0.00 C ATOM 402 O SER A 26 -24.413 6.117 -13.367 1.00 0.00 O ATOM 403 CB SER A 26 -24.587 3.097 -14.722 1.00 0.00 C ATOM 404 OG SER A 26 -25.163 2.345 -15.789 1.00 0.00 O ATOM 0 H SER A 26 -25.112 5.434 -15.802 1.00 0.00 H new ATOM 0 HA SER A 26 -26.447 3.687 -13.823 1.00 0.00 H new ATOM 0 HB2 SER A 26 -23.661 3.564 -15.059 1.00 0.00 H new ATOM 0 HB3 SER A 26 -24.327 2.429 -13.901 1.00 0.00 H new ATOM 0 HG SER A 26 -24.525 1.665 -16.091 1.00 0.00 H new ATOM 410 N LEU A 27 -24.981 4.525 -11.894 1.00 0.00 N ATOM 411 CA LEU A 27 -24.376 5.195 -10.773 1.00 0.00 C ATOM 412 C LEU A 27 -23.698 4.161 -9.895 1.00 0.00 C ATOM 413 O LEU A 27 -24.197 3.036 -9.742 1.00 0.00 O ATOM 414 CB LEU A 27 -25.432 5.982 -9.976 1.00 0.00 C ATOM 415 CG LEU A 27 -24.918 6.798 -8.778 1.00 0.00 C ATOM 416 CD1 LEU A 27 -23.925 7.866 -9.225 1.00 0.00 C ATOM 417 CD2 LEU A 27 -26.080 7.433 -8.034 1.00 0.00 C ATOM 0 H LEU A 27 -25.452 3.652 -11.656 1.00 0.00 H new ATOM 0 HA LEU A 27 -23.635 5.910 -11.130 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -25.939 6.662 -10.660 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -26.181 5.278 -9.613 1.00 0.00 H new ATOM 0 HG LEU A 27 -24.399 6.117 -8.104 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -23.579 8.427 -8.357 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -23.074 7.390 -9.713 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -24.412 8.545 -9.925 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -25.701 8.007 -7.189 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -26.625 8.095 -8.707 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -26.750 6.653 -7.671 1.00 0.00 H new ATOM 429 N ASP A 28 -22.569 4.509 -9.359 1.00 0.00 N ATOM 430 CA ASP A 28 -21.815 3.614 -8.508 1.00 0.00 C ATOM 431 C ASP A 28 -22.159 3.858 -7.067 1.00 0.00 C ATOM 432 O ASP A 28 -22.226 5.004 -6.621 1.00 0.00 O ATOM 433 CB ASP A 28 -20.297 3.777 -8.711 1.00 0.00 C ATOM 434 CG ASP A 28 -19.814 3.288 -10.057 1.00 0.00 C ATOM 435 OD1 ASP A 28 -19.977 4.013 -11.066 1.00 0.00 O ATOM 436 OD2 ASP A 28 -19.276 2.159 -10.140 1.00 0.00 O ATOM 0 H ASP A 28 -22.135 5.422 -9.494 1.00 0.00 H new ATOM 0 HA ASP A 28 -22.086 2.595 -8.784 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -20.034 4.829 -8.600 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -19.773 3.233 -7.926 1.00 0.00 H new ATOM 441 N ASP A 29 -22.419 2.801 -6.360 1.00 0.00 N ATOM 442 CA ASP A 29 -22.698 2.873 -4.941 1.00 0.00 C ATOM 443 C ASP A 29 -21.456 2.490 -4.173 1.00 0.00 C ATOM 444 O ASP A 29 -21.141 3.068 -3.135 1.00 0.00 O ATOM 445 CB ASP A 29 -23.879 1.971 -4.542 1.00 0.00 C ATOM 446 CG ASP A 29 -25.219 2.457 -5.058 1.00 0.00 C ATOM 447 OD1 ASP A 29 -25.890 3.247 -4.361 1.00 0.00 O ATOM 448 OD2 ASP A 29 -25.652 2.032 -6.159 1.00 0.00 O ATOM 0 H ASP A 29 -22.446 1.856 -6.744 1.00 0.00 H new ATOM 0 HA ASP A 29 -22.983 3.896 -4.697 1.00 0.00 H new ATOM 0 HB2 ASP A 29 -23.699 0.964 -4.918 1.00 0.00 H new ATOM 0 HB3 ASP A 29 -23.921 1.903 -3.455 1.00 0.00 H new ATOM 453 N LEU A 30 -20.741 1.530 -4.706 1.00 0.00 N ATOM 454 CA LEU A 30 -19.499 1.068 -4.126 1.00 0.00 C ATOM 455 C LEU A 30 -18.335 1.749 -4.832 1.00 0.00 C ATOM 456 O LEU A 30 -18.353 1.884 -6.056 1.00 0.00 O ATOM 457 CB LEU A 30 -19.343 -0.473 -4.254 1.00 0.00 C ATOM 458 CG LEU A 30 -20.315 -1.385 -3.467 1.00 0.00 C ATOM 459 CD1 LEU A 30 -21.731 -1.356 -4.031 1.00 0.00 C ATOM 460 CD2 LEU A 30 -19.783 -2.808 -3.427 1.00 0.00 C ATOM 0 H LEU A 30 -21.005 1.042 -5.562 1.00 0.00 H new ATOM 0 HA LEU A 30 -19.506 1.320 -3.065 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -19.432 -0.728 -5.310 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -18.329 -0.729 -3.949 1.00 0.00 H new ATOM 0 HG LEU A 30 -20.374 -0.994 -2.451 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -22.371 -2.013 -3.442 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -22.119 -0.338 -3.989 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -21.717 -1.696 -5.066 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -20.475 -3.440 -2.871 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -19.682 -3.188 -4.444 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -18.809 -2.819 -2.938 1.00 0.00 H new ATOM 472 N PHE A 31 -17.351 2.185 -4.085 1.00 0.00 N ATOM 473 CA PHE A 31 -16.174 2.834 -4.651 1.00 0.00 C ATOM 474 C PHE A 31 -14.919 2.168 -4.112 1.00 0.00 C ATOM 475 O PHE A 31 -14.911 1.678 -2.980 1.00 0.00 O ATOM 476 CB PHE A 31 -16.154 4.332 -4.313 1.00 0.00 C ATOM 477 CG PHE A 31 -17.314 5.111 -4.868 1.00 0.00 C ATOM 478 CD1 PHE A 31 -17.301 5.552 -6.180 1.00 0.00 C ATOM 479 CD2 PHE A 31 -18.420 5.394 -4.082 1.00 0.00 C ATOM 480 CE1 PHE A 31 -18.363 6.266 -6.696 1.00 0.00 C ATOM 481 CE2 PHE A 31 -19.485 6.104 -4.592 1.00 0.00 C ATOM 482 CZ PHE A 31 -19.459 6.539 -5.902 1.00 0.00 C ATOM 0 H PHE A 31 -17.335 2.105 -3.068 1.00 0.00 H new ATOM 0 HA PHE A 31 -16.210 2.730 -5.735 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -16.141 4.447 -3.229 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -15.228 4.765 -4.691 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -16.449 5.335 -6.807 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -18.447 5.054 -3.057 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -18.337 6.611 -7.719 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -20.339 6.320 -3.968 1.00 0.00 H new ATOM 0 HZ PHE A 31 -20.295 7.092 -6.305 1.00 0.00 H new ATOM 492 N GLU A 32 -13.886 2.135 -4.908 1.00 0.00 N ATOM 493 CA GLU A 32 -12.632 1.507 -4.540 1.00 0.00 C ATOM 494 C GLU A 32 -11.656 2.499 -3.943 1.00 0.00 C ATOM 495 O GLU A 32 -11.381 3.548 -4.524 1.00 0.00 O ATOM 496 CB GLU A 32 -12.002 0.819 -5.751 1.00 0.00 C ATOM 497 CG GLU A 32 -12.734 -0.428 -6.202 1.00 0.00 C ATOM 498 CD GLU A 32 -12.661 -1.526 -5.167 1.00 0.00 C ATOM 499 OE1 GLU A 32 -13.507 -1.562 -4.246 1.00 0.00 O ATOM 500 OE2 GLU A 32 -11.742 -2.365 -5.250 1.00 0.00 O ATOM 0 H GLU A 32 -13.884 2.546 -5.842 1.00 0.00 H new ATOM 0 HA GLU A 32 -12.856 0.761 -3.778 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -11.966 1.526 -6.580 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -10.972 0.556 -5.511 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -13.778 -0.185 -6.401 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -12.305 -0.783 -7.139 1.00 0.00 H new ATOM 507 N GLN A 33 -11.129 2.163 -2.797 1.00 0.00 N ATOM 508 CA GLN A 33 -10.149 2.987 -2.131 1.00 0.00 C ATOM 509 C GLN A 33 -8.824 2.252 -2.139 1.00 0.00 C ATOM 510 O GLN A 33 -8.753 1.082 -1.756 1.00 0.00 O ATOM 511 CB GLN A 33 -10.594 3.317 -0.711 1.00 0.00 C ATOM 512 CG GLN A 33 -11.880 4.133 -0.649 1.00 0.00 C ATOM 513 CD GLN A 33 -12.341 4.396 0.768 1.00 0.00 C ATOM 514 OE1 GLN A 33 -12.103 3.588 1.676 1.00 0.00 O ATOM 515 NE2 GLN A 33 -13.002 5.506 0.976 1.00 0.00 N ATOM 0 H GLN A 33 -11.366 1.308 -2.295 1.00 0.00 H new ATOM 0 HA GLN A 33 -10.040 3.936 -2.656 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -10.736 2.388 -0.158 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -9.799 3.868 -0.209 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -11.726 5.084 -1.158 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -12.666 3.606 -1.190 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -13.179 6.147 0.202 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -13.341 5.730 1.912 1.00 0.00 H new ATOM 524 N ILE A 34 -7.787 2.910 -2.594 1.00 0.00 N ATOM 525 CA ILE A 34 -6.495 2.264 -2.786 1.00 0.00 C ATOM 526 C ILE A 34 -5.414 3.032 -2.046 1.00 0.00 C ATOM 527 O ILE A 34 -5.342 4.261 -2.157 1.00 0.00 O ATOM 528 CB ILE A 34 -6.127 2.223 -4.307 1.00 0.00 C ATOM 529 CG1 ILE A 34 -7.259 1.566 -5.118 1.00 0.00 C ATOM 530 CG2 ILE A 34 -4.809 1.469 -4.528 1.00 0.00 C ATOM 531 CD1 ILE A 34 -7.064 1.631 -6.618 1.00 0.00 C ATOM 0 H ILE A 34 -7.804 3.899 -2.842 1.00 0.00 H new ATOM 0 HA ILE A 34 -6.561 1.248 -2.398 1.00 0.00 H new ATOM 0 HB ILE A 34 -5.999 3.249 -4.653 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -7.347 0.522 -4.819 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -8.202 2.050 -4.864 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -4.573 1.453 -5.592 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -4.007 1.971 -3.986 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -4.909 0.447 -4.163 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -7.904 1.146 -7.115 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -7.008 2.673 -6.933 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -6.139 1.120 -6.887 1.00 0.00 H new ATOM 543 N LYS A 35 -4.586 2.331 -1.295 1.00 0.00 N ATOM 544 CA LYS A 35 -3.489 2.962 -0.590 1.00 0.00 C ATOM 545 C LYS A 35 -2.154 2.420 -1.031 1.00 0.00 C ATOM 546 O LYS A 35 -2.077 1.466 -1.824 1.00 0.00 O ATOM 547 CB LYS A 35 -3.642 2.886 0.932 1.00 0.00 C ATOM 548 CG LYS A 35 -4.751 3.761 1.449 1.00 0.00 C ATOM 549 CD LYS A 35 -4.823 3.782 2.951 1.00 0.00 C ATOM 550 CE LYS A 35 -5.819 4.831 3.409 1.00 0.00 C ATOM 551 NZ LYS A 35 -7.176 4.587 2.879 1.00 0.00 N ATOM 0 H LYS A 35 -4.653 1.322 -1.158 1.00 0.00 H new ATOM 0 HA LYS A 35 -3.525 4.018 -0.858 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -3.834 1.853 1.222 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -2.704 3.180 1.402 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -4.607 4.777 1.082 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -5.702 3.409 1.049 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -5.119 2.801 3.323 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -3.839 3.997 3.367 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -5.854 4.844 4.498 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -5.478 5.816 3.089 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -7.857 5.199 3.373 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -7.195 4.800 1.861 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -7.433 3.591 3.029 1.00 0.00 H new ATOM 564 N GLN A 36 -1.111 3.027 -0.534 1.00 0.00 N ATOM 565 CA GLN A 36 0.233 2.671 -0.895 1.00 0.00 C ATOM 566 C GLN A 36 0.821 1.757 0.153 1.00 0.00 C ATOM 567 O GLN A 36 0.252 1.608 1.235 1.00 0.00 O ATOM 568 CB GLN A 36 1.085 3.919 -0.994 1.00 0.00 C ATOM 569 CG GLN A 36 0.561 4.948 -1.960 1.00 0.00 C ATOM 570 CD GLN A 36 1.391 6.197 -1.940 1.00 0.00 C ATOM 571 OE1 GLN A 36 2.355 6.333 -2.698 1.00 0.00 O ATOM 572 NE2 GLN A 36 1.041 7.108 -1.091 1.00 0.00 N ATOM 0 H GLN A 36 -1.171 3.790 0.140 1.00 0.00 H new ATOM 0 HA GLN A 36 0.215 2.161 -1.858 1.00 0.00 H new ATOM 0 HB2 GLN A 36 1.163 4.371 -0.005 1.00 0.00 H new ATOM 0 HB3 GLN A 36 2.093 3.634 -1.295 1.00 0.00 H new ATOM 0 HG2 GLN A 36 0.553 4.532 -2.967 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -0.471 5.192 -1.708 1.00 0.00 H new ATOM 0 HE21 GLN A 36 0.237 6.956 -0.482 1.00 0.00 H new ATOM 0 HE22 GLN A 36 1.569 7.979 -1.031 1.00 0.00 H new ATOM 581 N GLY A 37 1.931 1.141 -0.158 1.00 0.00 N ATOM 582 CA GLY A 37 2.589 0.322 0.815 1.00 0.00 C ATOM 583 C GLY A 37 3.243 -0.906 0.233 1.00 0.00 C ATOM 584 O GLY A 37 4.156 -1.469 0.849 1.00 0.00 O ATOM 0 H GLY A 37 2.391 1.192 -1.067 1.00 0.00 H new ATOM 0 HA2 GLY A 37 3.345 0.918 1.326 1.00 0.00 H new ATOM 0 HA3 GLY A 37 1.863 0.014 1.568 1.00 0.00 H new ATOM 588 N GLU A 38 2.819 -1.325 -0.938 1.00 0.00 N ATOM 589 CA GLU A 38 3.357 -2.545 -1.504 1.00 0.00 C ATOM 590 C GLU A 38 3.656 -2.381 -2.986 1.00 0.00 C ATOM 591 O GLU A 38 2.939 -1.679 -3.693 1.00 0.00 O ATOM 592 CB GLU A 38 2.380 -3.710 -1.287 1.00 0.00 C ATOM 593 CG GLU A 38 2.922 -5.060 -1.732 1.00 0.00 C ATOM 594 CD GLU A 38 1.916 -6.164 -1.618 1.00 0.00 C ATOM 595 OE1 GLU A 38 1.820 -6.788 -0.549 1.00 0.00 O ATOM 596 OE2 GLU A 38 1.216 -6.444 -2.603 1.00 0.00 O ATOM 0 H GLU A 38 2.118 -0.852 -1.508 1.00 0.00 H new ATOM 0 HA GLU A 38 4.294 -2.766 -0.993 1.00 0.00 H new ATOM 0 HB2 GLU A 38 2.123 -3.763 -0.229 1.00 0.00 H new ATOM 0 HB3 GLU A 38 1.457 -3.503 -1.829 1.00 0.00 H new ATOM 0 HG2 GLU A 38 3.257 -4.987 -2.767 1.00 0.00 H new ATOM 0 HG3 GLU A 38 3.796 -5.310 -1.131 1.00 0.00 H new ATOM 603 N MET A 39 4.732 -3.032 -3.421 1.00 0.00 N ATOM 604 CA MET A 39 5.191 -3.098 -4.822 1.00 0.00 C ATOM 605 C MET A 39 5.937 -1.850 -5.242 1.00 0.00 C ATOM 606 O MET A 39 5.756 -0.781 -4.648 1.00 0.00 O ATOM 607 CB MET A 39 4.091 -3.475 -5.842 1.00 0.00 C ATOM 608 CG MET A 39 3.442 -4.843 -5.622 1.00 0.00 C ATOM 609 SD MET A 39 4.639 -6.208 -5.481 1.00 0.00 S ATOM 610 CE MET A 39 5.532 -6.060 -7.023 1.00 0.00 C ATOM 0 H MET A 39 5.339 -3.552 -2.787 1.00 0.00 H new ATOM 0 HA MET A 39 5.895 -3.930 -4.838 1.00 0.00 H new ATOM 0 HB2 MET A 39 3.313 -2.712 -5.812 1.00 0.00 H new ATOM 0 HB3 MET A 39 4.522 -3.452 -6.843 1.00 0.00 H new ATOM 0 HG2 MET A 39 2.837 -4.807 -4.716 1.00 0.00 H new ATOM 0 HG3 MET A 39 2.764 -5.051 -6.450 1.00 0.00 H new ATOM 0 HE1 MET A 39 6.186 -6.923 -7.149 1.00 0.00 H new ATOM 0 HE2 MET A 39 4.824 -6.018 -7.851 1.00 0.00 H new ATOM 0 HE3 MET A 39 6.131 -5.149 -7.011 1.00 0.00 H new ATOM 620 N LYS A 40 6.783 -1.998 -6.277 1.00 0.00 N ATOM 621 CA LYS A 40 7.703 -0.949 -6.746 1.00 0.00 C ATOM 622 C LYS A 40 8.722 -0.639 -5.670 1.00 0.00 C ATOM 623 O LYS A 40 9.295 0.453 -5.617 1.00 0.00 O ATOM 624 CB LYS A 40 6.986 0.338 -7.209 1.00 0.00 C ATOM 625 CG LYS A 40 6.426 0.316 -8.638 1.00 0.00 C ATOM 626 CD LYS A 40 5.223 -0.593 -8.832 1.00 0.00 C ATOM 627 CE LYS A 40 4.014 -0.114 -8.044 1.00 0.00 C ATOM 628 NZ LYS A 40 2.797 -0.863 -8.402 1.00 0.00 N ATOM 0 H LYS A 40 6.847 -2.861 -6.817 1.00 0.00 H new ATOM 0 HA LYS A 40 8.207 -1.343 -7.629 1.00 0.00 H new ATOM 0 HB2 LYS A 40 6.165 0.541 -6.521 1.00 0.00 H new ATOM 0 HB3 LYS A 40 7.685 1.170 -7.126 1.00 0.00 H new ATOM 0 HG2 LYS A 40 6.147 1.331 -8.921 1.00 0.00 H new ATOM 0 HG3 LYS A 40 7.216 0.001 -9.319 1.00 0.00 H new ATOM 0 HD2 LYS A 40 4.970 -0.639 -9.891 1.00 0.00 H new ATOM 0 HD3 LYS A 40 5.480 -1.606 -8.522 1.00 0.00 H new ATOM 0 HE2 LYS A 40 4.208 -0.224 -6.977 1.00 0.00 H new ATOM 0 HE3 LYS A 40 3.856 0.948 -8.231 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 1.994 -0.508 -7.844 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 2.597 -0.737 -9.415 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 2.939 -1.873 -8.200 1.00 0.00 H new ATOM 641 N GLU A 41 8.982 -1.629 -4.855 1.00 0.00 N ATOM 642 CA GLU A 41 9.862 -1.496 -3.734 1.00 0.00 C ATOM 643 C GLU A 41 11.233 -2.027 -4.084 1.00 0.00 C ATOM 644 O GLU A 41 11.482 -3.244 -4.027 1.00 0.00 O ATOM 645 CB GLU A 41 9.306 -2.271 -2.545 1.00 0.00 C ATOM 646 CG GLU A 41 7.920 -1.839 -2.109 1.00 0.00 C ATOM 647 CD GLU A 41 7.389 -2.706 -1.010 1.00 0.00 C ATOM 648 OE1 GLU A 41 7.857 -2.565 0.143 1.00 0.00 O ATOM 649 OE2 GLU A 41 6.506 -3.566 -1.281 1.00 0.00 O ATOM 0 H GLU A 41 8.580 -2.561 -4.957 1.00 0.00 H new ATOM 0 HA GLU A 41 9.942 -0.441 -3.474 1.00 0.00 H new ATOM 0 HB2 GLU A 41 9.280 -3.331 -2.798 1.00 0.00 H new ATOM 0 HB3 GLU A 41 9.989 -2.161 -1.703 1.00 0.00 H new ATOM 0 HG2 GLU A 41 7.951 -0.803 -1.772 1.00 0.00 H new ATOM 0 HG3 GLU A 41 7.242 -1.877 -2.962 1.00 0.00 H new ATOM 656 N LEU A 42 12.100 -1.152 -4.501 1.00 0.00 N ATOM 657 CA LEU A 42 13.446 -1.544 -4.778 1.00 0.00 C ATOM 658 C LEU A 42 14.312 -1.164 -3.623 1.00 0.00 C ATOM 659 O LEU A 42 14.746 -0.024 -3.496 1.00 0.00 O ATOM 660 CB LEU A 42 13.981 -0.995 -6.106 1.00 0.00 C ATOM 661 CG LEU A 42 13.339 -1.534 -7.397 1.00 0.00 C ATOM 662 CD1 LEU A 42 13.320 -3.049 -7.398 1.00 0.00 C ATOM 663 CD2 LEU A 42 11.948 -0.959 -7.641 1.00 0.00 C ATOM 0 H LEU A 42 11.898 -0.164 -4.656 1.00 0.00 H new ATOM 0 HA LEU A 42 13.462 -2.627 -4.902 1.00 0.00 H new ATOM 0 HB2 LEU A 42 13.863 0.089 -6.096 1.00 0.00 H new ATOM 0 HB3 LEU A 42 15.051 -1.199 -6.150 1.00 0.00 H new ATOM 0 HG LEU A 42 13.961 -1.200 -8.228 1.00 0.00 H new ATOM 0 HD11 LEU A 42 12.862 -3.407 -8.320 1.00 0.00 H new ATOM 0 HD12 LEU A 42 14.341 -3.426 -7.330 1.00 0.00 H new ATOM 0 HD13 LEU A 42 12.744 -3.406 -6.544 1.00 0.00 H new ATOM 0 HD21 LEU A 42 11.540 -1.372 -8.564 1.00 0.00 H new ATOM 0 HD22 LEU A 42 11.295 -1.219 -6.808 1.00 0.00 H new ATOM 0 HD23 LEU A 42 12.012 0.126 -7.726 1.00 0.00 H new ATOM 675 N ASN A 43 14.502 -2.110 -2.759 1.00 0.00 N ATOM 676 CA ASN A 43 15.225 -1.907 -1.531 1.00 0.00 C ATOM 677 C ASN A 43 16.646 -2.351 -1.720 1.00 0.00 C ATOM 678 O ASN A 43 16.896 -3.416 -2.301 1.00 0.00 O ATOM 679 CB ASN A 43 14.576 -2.724 -0.401 1.00 0.00 C ATOM 680 CG ASN A 43 13.109 -2.384 -0.161 1.00 0.00 C ATOM 681 OD1 ASN A 43 12.677 -1.253 -0.349 1.00 0.00 O ATOM 682 ND2 ASN A 43 12.335 -3.367 0.245 1.00 0.00 N ATOM 0 H ASN A 43 14.156 -3.062 -2.883 1.00 0.00 H new ATOM 0 HA ASN A 43 15.200 -0.850 -1.264 1.00 0.00 H new ATOM 0 HB2 ASN A 43 14.660 -3.785 -0.638 1.00 0.00 H new ATOM 0 HB3 ASN A 43 15.133 -2.558 0.521 1.00 0.00 H new ATOM 0 HD21 ASN A 43 11.343 -3.199 0.413 1.00 0.00 H new ATOM 0 HD22 ASN A 43 12.727 -4.297 0.392 1.00 0.00 H new ATOM 689 N LEU A 44 17.578 -1.560 -1.270 1.00 0.00 N ATOM 690 CA LEU A 44 18.981 -1.899 -1.404 1.00 0.00 C ATOM 691 C LEU A 44 19.765 -1.601 -0.137 1.00 0.00 C ATOM 692 O LEU A 44 19.331 -0.816 0.732 1.00 0.00 O ATOM 693 CB LEU A 44 19.623 -1.133 -2.585 1.00 0.00 C ATOM 694 CG LEU A 44 19.133 -1.476 -4.001 1.00 0.00 C ATOM 695 CD1 LEU A 44 19.772 -0.545 -5.016 1.00 0.00 C ATOM 696 CD2 LEU A 44 19.462 -2.924 -4.347 1.00 0.00 C ATOM 0 H LEU A 44 17.399 -0.671 -0.804 1.00 0.00 H new ATOM 0 HA LEU A 44 19.024 -2.972 -1.593 1.00 0.00 H new ATOM 0 HB2 LEU A 44 19.463 -0.067 -2.422 1.00 0.00 H new ATOM 0 HB3 LEU A 44 20.699 -1.302 -2.551 1.00 0.00 H new ATOM 0 HG LEU A 44 18.051 -1.348 -4.030 1.00 0.00 H new ATOM 0 HD11 LEU A 44 19.417 -0.798 -6.015 1.00 0.00 H new ATOM 0 HD12 LEU A 44 19.502 0.485 -4.785 1.00 0.00 H new ATOM 0 HD13 LEU A 44 20.856 -0.654 -4.977 1.00 0.00 H new ATOM 0 HD21 LEU A 44 19.107 -3.147 -5.353 1.00 0.00 H new ATOM 0 HD22 LEU A 44 20.541 -3.073 -4.301 1.00 0.00 H new ATOM 0 HD23 LEU A 44 18.974 -3.588 -3.634 1.00 0.00 H new ATOM 708 N ILE A 45 20.881 -2.262 -0.018 1.00 0.00 N ATOM 709 CA ILE A 45 21.859 -1.992 0.990 1.00 0.00 C ATOM 710 C ILE A 45 23.172 -1.670 0.320 1.00 0.00 C ATOM 711 O ILE A 45 23.603 -2.376 -0.607 1.00 0.00 O ATOM 712 CB ILE A 45 22.014 -3.126 2.074 1.00 0.00 C ATOM 713 CG1 ILE A 45 23.428 -3.138 2.630 1.00 0.00 C ATOM 714 CG2 ILE A 45 21.758 -4.442 1.494 1.00 0.00 C ATOM 715 CD1 ILE A 45 23.642 -3.928 3.892 1.00 0.00 C ATOM 0 H ILE A 45 21.141 -3.027 -0.641 1.00 0.00 H new ATOM 0 HA ILE A 45 21.507 -1.133 1.561 1.00 0.00 H new ATOM 0 HB ILE A 45 21.292 -2.918 2.864 1.00 0.00 H new ATOM 0 HG12 ILE A 45 24.094 -3.533 1.863 1.00 0.00 H new ATOM 0 HG13 ILE A 45 23.731 -2.108 2.816 1.00 0.00 H new ATOM 0 HG21 ILE A 45 21.871 -5.207 2.262 1.00 0.00 H new ATOM 0 HG22 ILE A 45 20.743 -4.474 1.098 1.00 0.00 H new ATOM 0 HG23 ILE A 45 22.468 -4.629 0.689 1.00 0.00 H new ATOM 0 HD11 ILE A 45 24.688 -3.861 4.190 1.00 0.00 H new ATOM 0 HD12 ILE A 45 23.012 -3.525 4.685 1.00 0.00 H new ATOM 0 HD13 ILE A 45 23.381 -4.972 3.717 1.00 0.00 H new ATOM 727 N VAL A 46 23.784 -0.613 0.770 1.00 0.00 N ATOM 728 CA VAL A 46 24.996 -0.134 0.183 1.00 0.00 C ATOM 729 C VAL A 46 26.180 -0.331 1.134 1.00 0.00 C ATOM 730 O VAL A 46 26.128 0.058 2.316 1.00 0.00 O ATOM 731 CB VAL A 46 24.871 1.368 -0.213 1.00 0.00 C ATOM 732 CG1 VAL A 46 26.174 1.902 -0.758 1.00 0.00 C ATOM 733 CG2 VAL A 46 23.773 1.572 -1.238 1.00 0.00 C ATOM 0 H VAL A 46 23.452 -0.058 1.559 1.00 0.00 H new ATOM 0 HA VAL A 46 25.176 -0.715 -0.721 1.00 0.00 H new ATOM 0 HB VAL A 46 24.618 1.918 0.693 1.00 0.00 H new ATOM 0 HG11 VAL A 46 26.054 2.952 -1.025 1.00 0.00 H new ATOM 0 HG12 VAL A 46 26.952 1.807 -0.000 1.00 0.00 H new ATOM 0 HG13 VAL A 46 26.459 1.333 -1.643 1.00 0.00 H new ATOM 0 HG21 VAL A 46 23.708 2.629 -1.496 1.00 0.00 H new ATOM 0 HG22 VAL A 46 23.999 0.993 -2.133 1.00 0.00 H new ATOM 0 HG23 VAL A 46 22.821 1.241 -0.823 1.00 0.00 H new ATOM 743 N LYS A 47 27.200 -0.967 0.629 1.00 0.00 N ATOM 744 CA LYS A 47 28.460 -1.134 1.316 1.00 0.00 C ATOM 745 C LYS A 47 29.586 -0.892 0.341 1.00 0.00 C ATOM 746 O LYS A 47 29.454 -1.175 -0.843 1.00 0.00 O ATOM 747 CB LYS A 47 28.650 -2.515 1.966 1.00 0.00 C ATOM 748 CG LYS A 47 27.803 -2.793 3.196 1.00 0.00 C ATOM 749 CD LYS A 47 28.461 -3.887 4.021 1.00 0.00 C ATOM 750 CE LYS A 47 27.703 -4.197 5.291 1.00 0.00 C ATOM 751 NZ LYS A 47 28.490 -5.073 6.199 1.00 0.00 N ATOM 0 H LYS A 47 27.182 -1.397 -0.296 1.00 0.00 H new ATOM 0 HA LYS A 47 28.463 -0.409 2.130 1.00 0.00 H new ATOM 0 HB2 LYS A 47 28.433 -3.279 1.219 1.00 0.00 H new ATOM 0 HB3 LYS A 47 29.699 -2.625 2.239 1.00 0.00 H new ATOM 0 HG2 LYS A 47 27.697 -1.886 3.791 1.00 0.00 H new ATOM 0 HG3 LYS A 47 26.800 -3.099 2.899 1.00 0.00 H new ATOM 0 HD2 LYS A 47 28.539 -4.793 3.419 1.00 0.00 H new ATOM 0 HD3 LYS A 47 29.477 -3.584 4.274 1.00 0.00 H new ATOM 0 HE2 LYS A 47 27.457 -3.268 5.804 1.00 0.00 H new ATOM 0 HE3 LYS A 47 26.760 -4.683 5.043 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 27.908 -5.885 6.488 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 29.338 -5.414 5.703 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 28.774 -4.534 7.041 1.00 0.00 H new ATOM 764 N ALA A 48 30.679 -0.369 0.819 1.00 0.00 N ATOM 765 CA ALA A 48 31.792 -0.076 -0.028 1.00 0.00 C ATOM 766 C ALA A 48 33.072 -0.115 0.752 1.00 0.00 C ATOM 767 O ALA A 48 33.060 -0.199 1.985 1.00 0.00 O ATOM 768 CB ALA A 48 31.623 1.283 -0.695 1.00 0.00 C ATOM 0 H ALA A 48 30.820 -0.136 1.802 1.00 0.00 H new ATOM 0 HA ALA A 48 31.834 -0.838 -0.806 1.00 0.00 H new ATOM 0 HB1 ALA A 48 32.482 1.484 -1.335 1.00 0.00 H new ATOM 0 HB2 ALA A 48 30.715 1.282 -1.297 1.00 0.00 H new ATOM 0 HB3 ALA A 48 31.551 2.057 0.069 1.00 0.00 H new ATOM 774 N ASP A 49 34.165 -0.047 0.027 1.00 0.00 N ATOM 775 CA ASP A 49 35.508 -0.065 0.587 1.00 0.00 C ATOM 776 C ASP A 49 35.814 1.257 1.277 1.00 0.00 C ATOM 777 O ASP A 49 36.561 1.315 2.252 1.00 0.00 O ATOM 778 CB ASP A 49 36.505 -0.336 -0.541 1.00 0.00 C ATOM 779 CG ASP A 49 37.923 -0.451 -0.065 1.00 0.00 C ATOM 780 OD1 ASP A 49 38.305 -1.516 0.444 1.00 0.00 O ATOM 781 OD2 ASP A 49 38.702 0.503 -0.236 1.00 0.00 O ATOM 0 H ASP A 49 34.151 0.024 -0.990 1.00 0.00 H new ATOM 0 HA ASP A 49 35.587 -0.853 1.336 1.00 0.00 H new ATOM 0 HB2 ASP A 49 36.224 -1.258 -1.051 1.00 0.00 H new ATOM 0 HB3 ASP A 49 36.440 0.467 -1.275 1.00 0.00 H new ATOM 786 N VAL A 50 35.205 2.298 0.774 1.00 0.00 N ATOM 787 CA VAL A 50 35.327 3.626 1.299 1.00 0.00 C ATOM 788 C VAL A 50 33.966 4.027 1.864 1.00 0.00 C ATOM 789 O VAL A 50 32.940 3.823 1.191 1.00 0.00 O ATOM 790 CB VAL A 50 35.738 4.598 0.167 1.00 0.00 C ATOM 791 CG1 VAL A 50 35.739 6.023 0.643 1.00 0.00 C ATOM 792 CG2 VAL A 50 37.101 4.224 -0.387 1.00 0.00 C ATOM 0 H VAL A 50 34.591 2.240 -0.039 1.00 0.00 H new ATOM 0 HA VAL A 50 36.088 3.665 2.078 1.00 0.00 H new ATOM 0 HB VAL A 50 35.000 4.512 -0.630 1.00 0.00 H new ATOM 0 HG11 VAL A 50 36.032 6.680 -0.176 1.00 0.00 H new ATOM 0 HG12 VAL A 50 34.740 6.293 0.985 1.00 0.00 H new ATOM 0 HG13 VAL A 50 36.446 6.131 1.466 1.00 0.00 H new ATOM 0 HG21 VAL A 50 37.374 4.918 -1.182 1.00 0.00 H new ATOM 0 HG22 VAL A 50 37.844 4.274 0.409 1.00 0.00 H new ATOM 0 HG23 VAL A 50 37.066 3.211 -0.787 1.00 0.00 H new ATOM 802 N GLN A 51 33.940 4.604 3.070 1.00 0.00 N ATOM 803 CA GLN A 51 32.675 4.928 3.729 1.00 0.00 C ATOM 804 C GLN A 51 31.857 5.888 2.918 1.00 0.00 C ATOM 805 O GLN A 51 30.732 5.614 2.602 1.00 0.00 O ATOM 806 CB GLN A 51 32.830 5.499 5.133 1.00 0.00 C ATOM 807 CG GLN A 51 31.493 5.525 5.880 1.00 0.00 C ATOM 808 CD GLN A 51 31.492 6.377 7.119 1.00 0.00 C ATOM 809 OE1 GLN A 51 31.844 5.926 8.204 1.00 0.00 O ATOM 810 NE2 GLN A 51 31.026 7.585 6.981 1.00 0.00 N ATOM 0 H GLN A 51 34.773 4.853 3.604 1.00 0.00 H new ATOM 0 HA GLN A 51 32.166 3.968 3.814 1.00 0.00 H new ATOM 0 HB2 GLN A 51 33.549 4.901 5.693 1.00 0.00 H new ATOM 0 HB3 GLN A 51 33.234 6.510 5.073 1.00 0.00 H new ATOM 0 HG2 GLN A 51 30.719 5.888 5.203 1.00 0.00 H new ATOM 0 HG3 GLN A 51 31.224 4.505 6.155 1.00 0.00 H new ATOM 0 HE21 GLN A 51 30.744 7.921 6.060 1.00 0.00 H new ATOM 0 HE22 GLN A 51 30.943 8.195 7.794 1.00 0.00 H new ATOM 819 N GLY A 52 32.426 6.980 2.526 1.00 0.00 N ATOM 820 CA GLY A 52 31.630 7.949 1.815 1.00 0.00 C ATOM 821 C GLY A 52 31.317 7.569 0.387 1.00 0.00 C ATOM 822 O GLY A 52 30.691 8.331 -0.330 1.00 0.00 O ATOM 0 H GLY A 52 33.404 7.227 2.674 1.00 0.00 H new ATOM 0 HA2 GLY A 52 30.694 8.097 2.353 1.00 0.00 H new ATOM 0 HA3 GLY A 52 32.154 8.905 1.818 1.00 0.00 H new ATOM 826 N SER A 53 31.701 6.378 -0.018 1.00 0.00 N ATOM 827 CA SER A 53 31.337 5.894 -1.311 1.00 0.00 C ATOM 828 C SER A 53 30.001 5.203 -1.162 1.00 0.00 C ATOM 829 O SER A 53 29.238 5.059 -2.121 1.00 0.00 O ATOM 830 CB SER A 53 32.404 4.960 -1.853 1.00 0.00 C ATOM 831 OG SER A 53 33.649 5.643 -1.925 1.00 0.00 O ATOM 0 H SER A 53 32.265 5.735 0.537 1.00 0.00 H new ATOM 0 HA SER A 53 31.255 6.709 -2.030 1.00 0.00 H new ATOM 0 HB2 SER A 53 32.495 4.085 -1.210 1.00 0.00 H new ATOM 0 HB3 SER A 53 32.118 4.601 -2.841 1.00 0.00 H new ATOM 0 HG SER A 53 34.290 5.102 -2.432 1.00 0.00 H new ATOM 837 N VAL A 54 29.706 4.814 0.085 1.00 0.00 N ATOM 838 CA VAL A 54 28.433 4.263 0.403 1.00 0.00 C ATOM 839 C VAL A 54 27.453 5.410 0.462 1.00 0.00 C ATOM 840 O VAL A 54 26.412 5.390 -0.166 1.00 0.00 O ATOM 841 CB VAL A 54 28.408 3.443 1.760 1.00 0.00 C ATOM 842 CG1 VAL A 54 29.555 2.494 1.887 1.00 0.00 C ATOM 843 CG2 VAL A 54 28.209 4.246 3.049 1.00 0.00 C ATOM 0 H VAL A 54 30.349 4.881 0.874 1.00 0.00 H new ATOM 0 HA VAL A 54 28.169 3.539 -0.368 1.00 0.00 H new ATOM 0 HB VAL A 54 27.486 2.870 1.660 1.00 0.00 H new ATOM 0 HG11 VAL A 54 29.484 1.962 2.836 1.00 0.00 H new ATOM 0 HG12 VAL A 54 29.527 1.778 1.066 1.00 0.00 H new ATOM 0 HG13 VAL A 54 30.492 3.049 1.852 1.00 0.00 H new ATOM 0 HG21 VAL A 54 28.211 3.569 3.903 1.00 0.00 H new ATOM 0 HG22 VAL A 54 29.018 4.968 3.156 1.00 0.00 H new ATOM 0 HG23 VAL A 54 27.256 4.773 3.006 1.00 0.00 H new ATOM 853 N GLU A 55 27.879 6.459 1.141 1.00 0.00 N ATOM 854 CA GLU A 55 27.067 7.634 1.385 1.00 0.00 C ATOM 855 C GLU A 55 26.773 8.394 0.115 1.00 0.00 C ATOM 856 O GLU A 55 25.680 8.913 -0.050 1.00 0.00 O ATOM 857 CB GLU A 55 27.717 8.524 2.426 1.00 0.00 C ATOM 858 CG GLU A 55 27.971 7.803 3.731 1.00 0.00 C ATOM 859 CD GLU A 55 28.522 8.695 4.782 1.00 0.00 C ATOM 860 OE1 GLU A 55 29.742 8.957 4.782 1.00 0.00 O ATOM 861 OE2 GLU A 55 27.745 9.165 5.636 1.00 0.00 O ATOM 0 H GLU A 55 28.814 6.518 1.544 1.00 0.00 H new ATOM 0 HA GLU A 55 26.107 7.296 1.776 1.00 0.00 H new ATOM 0 HB2 GLU A 55 28.661 8.904 2.035 1.00 0.00 H new ATOM 0 HB3 GLU A 55 27.078 9.387 2.611 1.00 0.00 H new ATOM 0 HG2 GLU A 55 27.039 7.364 4.086 1.00 0.00 H new ATOM 0 HG3 GLU A 55 28.665 6.981 3.558 1.00 0.00 H new ATOM 868 N ALA A 56 27.735 8.424 -0.800 1.00 0.00 N ATOM 869 CA ALA A 56 27.539 9.071 -2.095 1.00 0.00 C ATOM 870 C ALA A 56 26.429 8.368 -2.875 1.00 0.00 C ATOM 871 O ALA A 56 25.668 8.998 -3.618 1.00 0.00 O ATOM 872 CB ALA A 56 28.829 9.063 -2.898 1.00 0.00 C ATOM 0 H ALA A 56 28.658 8.009 -0.671 1.00 0.00 H new ATOM 0 HA ALA A 56 27.246 10.106 -1.921 1.00 0.00 H new ATOM 0 HB1 ALA A 56 28.662 9.549 -3.859 1.00 0.00 H new ATOM 0 HB2 ALA A 56 29.603 9.600 -2.349 1.00 0.00 H new ATOM 0 HB3 ALA A 56 29.149 8.034 -3.063 1.00 0.00 H new ATOM 878 N LEU A 57 26.328 7.064 -2.693 1.00 0.00 N ATOM 879 CA LEU A 57 25.312 6.298 -3.354 1.00 0.00 C ATOM 880 C LEU A 57 23.990 6.461 -2.603 1.00 0.00 C ATOM 881 O LEU A 57 22.958 6.759 -3.201 1.00 0.00 O ATOM 882 CB LEU A 57 25.750 4.826 -3.469 1.00 0.00 C ATOM 883 CG LEU A 57 24.813 3.882 -4.229 1.00 0.00 C ATOM 884 CD1 LEU A 57 24.502 4.436 -5.617 1.00 0.00 C ATOM 885 CD2 LEU A 57 25.458 2.512 -4.373 1.00 0.00 C ATOM 0 H LEU A 57 26.944 6.520 -2.089 1.00 0.00 H new ATOM 0 HA LEU A 57 25.163 6.663 -4.370 1.00 0.00 H new ATOM 0 HB2 LEU A 57 26.726 4.799 -3.954 1.00 0.00 H new ATOM 0 HB3 LEU A 57 25.884 4.432 -2.462 1.00 0.00 H new ATOM 0 HG LEU A 57 23.886 3.795 -3.663 1.00 0.00 H new ATOM 0 HD11 LEU A 57 23.835 3.751 -6.141 1.00 0.00 H new ATOM 0 HD12 LEU A 57 24.020 5.409 -5.521 1.00 0.00 H new ATOM 0 HD13 LEU A 57 25.428 4.544 -6.182 1.00 0.00 H new ATOM 0 HD21 LEU A 57 24.784 1.848 -4.915 1.00 0.00 H new ATOM 0 HD22 LEU A 57 26.394 2.607 -4.923 1.00 0.00 H new ATOM 0 HD23 LEU A 57 25.658 2.098 -3.385 1.00 0.00 H new ATOM 897 N VAL A 58 24.063 6.343 -1.287 1.00 0.00 N ATOM 898 CA VAL A 58 22.915 6.485 -0.385 1.00 0.00 C ATOM 899 C VAL A 58 22.209 7.815 -0.559 1.00 0.00 C ATOM 900 O VAL A 58 20.994 7.856 -0.651 1.00 0.00 O ATOM 901 CB VAL A 58 23.351 6.310 1.095 1.00 0.00 C ATOM 902 CG1 VAL A 58 22.251 6.699 2.086 1.00 0.00 C ATOM 903 CG2 VAL A 58 23.760 4.887 1.322 1.00 0.00 C ATOM 0 H VAL A 58 24.936 6.142 -0.799 1.00 0.00 H new ATOM 0 HA VAL A 58 22.210 5.697 -0.649 1.00 0.00 H new ATOM 0 HB VAL A 58 24.190 6.983 1.273 1.00 0.00 H new ATOM 0 HG11 VAL A 58 22.612 6.556 3.105 1.00 0.00 H new ATOM 0 HG12 VAL A 58 21.982 7.745 1.939 1.00 0.00 H new ATOM 0 HG13 VAL A 58 21.374 6.073 1.921 1.00 0.00 H new ATOM 0 HG21 VAL A 58 24.067 4.758 2.360 1.00 0.00 H new ATOM 0 HG22 VAL A 58 22.919 4.228 1.108 1.00 0.00 H new ATOM 0 HG23 VAL A 58 24.592 4.638 0.664 1.00 0.00 H new ATOM 913 N ALA A 59 22.970 8.881 -0.658 1.00 0.00 N ATOM 914 CA ALA A 59 22.414 10.225 -0.777 1.00 0.00 C ATOM 915 C ALA A 59 21.589 10.415 -2.040 1.00 0.00 C ATOM 916 O ALA A 59 20.718 11.281 -2.092 1.00 0.00 O ATOM 917 CB ALA A 59 23.498 11.280 -0.663 1.00 0.00 C ATOM 0 H ALA A 59 23.990 8.850 -0.659 1.00 0.00 H new ATOM 0 HA ALA A 59 21.727 10.350 0.060 1.00 0.00 H new ATOM 0 HB1 ALA A 59 23.053 12.271 -0.756 1.00 0.00 H new ATOM 0 HB2 ALA A 59 23.990 11.193 0.305 1.00 0.00 H new ATOM 0 HB3 ALA A 59 24.231 11.136 -1.457 1.00 0.00 H new ATOM 923 N ALA A 60 21.804 9.584 -3.023 1.00 0.00 N ATOM 924 CA ALA A 60 21.063 9.702 -4.250 1.00 0.00 C ATOM 925 C ALA A 60 19.940 8.723 -4.206 1.00 0.00 C ATOM 926 O ALA A 60 18.881 8.957 -4.724 1.00 0.00 O ATOM 927 CB ALA A 60 21.949 9.418 -5.436 1.00 0.00 C ATOM 0 H ALA A 60 22.482 8.822 -3.000 1.00 0.00 H new ATOM 0 HA ALA A 60 20.680 10.717 -4.355 1.00 0.00 H new ATOM 0 HB1 ALA A 60 21.369 9.513 -6.354 1.00 0.00 H new ATOM 0 HB2 ALA A 60 22.774 10.130 -5.453 1.00 0.00 H new ATOM 0 HB3 ALA A 60 22.345 8.405 -5.360 1.00 0.00 H new ATOM 933 N LEU A 61 20.183 7.679 -3.495 1.00 0.00 N ATOM 934 CA LEU A 61 19.292 6.568 -3.370 1.00 0.00 C ATOM 935 C LEU A 61 18.124 6.925 -2.439 1.00 0.00 C ATOM 936 O LEU A 61 17.005 6.501 -2.636 1.00 0.00 O ATOM 937 CB LEU A 61 20.109 5.395 -2.829 1.00 0.00 C ATOM 938 CG LEU A 61 20.275 4.152 -3.713 1.00 0.00 C ATOM 939 CD1 LEU A 61 18.953 3.454 -3.921 1.00 0.00 C ATOM 940 CD2 LEU A 61 20.895 4.517 -5.054 1.00 0.00 C ATOM 0 H LEU A 61 21.044 7.566 -2.960 1.00 0.00 H new ATOM 0 HA LEU A 61 18.854 6.301 -4.332 1.00 0.00 H new ATOM 0 HB2 LEU A 61 21.105 5.767 -2.589 1.00 0.00 H new ATOM 0 HB3 LEU A 61 19.653 5.077 -1.891 1.00 0.00 H new ATOM 0 HG LEU A 61 20.947 3.467 -3.197 1.00 0.00 H new ATOM 0 HD11 LEU A 61 19.100 2.577 -4.551 1.00 0.00 H new ATOM 0 HD12 LEU A 61 18.549 3.145 -2.957 1.00 0.00 H new ATOM 0 HD13 LEU A 61 18.254 4.136 -4.406 1.00 0.00 H new ATOM 0 HD21 LEU A 61 21.002 3.619 -5.662 1.00 0.00 H new ATOM 0 HD22 LEU A 61 20.252 5.230 -5.570 1.00 0.00 H new ATOM 0 HD23 LEU A 61 21.876 4.964 -4.892 1.00 0.00 H new ATOM 952 N GLN A 62 18.397 7.738 -1.442 1.00 0.00 N ATOM 953 CA GLN A 62 17.368 8.187 -0.515 1.00 0.00 C ATOM 954 C GLN A 62 16.435 9.195 -1.175 1.00 0.00 C ATOM 955 O GLN A 62 15.309 9.395 -0.731 1.00 0.00 O ATOM 956 CB GLN A 62 17.988 8.763 0.760 1.00 0.00 C ATOM 957 CG GLN A 62 18.935 9.923 0.529 1.00 0.00 C ATOM 958 CD GLN A 62 19.600 10.437 1.799 1.00 0.00 C ATOM 959 OE1 GLN A 62 19.779 9.583 2.785 1.00 0.00 O flip ATOM 960 NE2 GLN A 62 19.941 11.613 1.890 1.00 0.00 N flip ATOM 0 H GLN A 62 19.328 8.107 -1.248 1.00 0.00 H new ATOM 0 HA GLN A 62 16.773 7.318 -0.233 1.00 0.00 H new ATOM 0 HB2 GLN A 62 17.187 9.091 1.423 1.00 0.00 H new ATOM 0 HB3 GLN A 62 18.526 7.969 1.278 1.00 0.00 H new ATOM 0 HG2 GLN A 62 19.708 9.614 -0.175 1.00 0.00 H new ATOM 0 HG3 GLN A 62 18.386 10.740 0.061 1.00 0.00 H new ATOM 0 HE21 GLN A 62 19.789 12.250 1.108 1.00 0.00 H new ATOM 0 HE22 GLN A 62 20.377 11.953 2.747 1.00 0.00 H new ATOM 969 N LYS A 63 16.900 9.811 -2.244 1.00 0.00 N ATOM 970 CA LYS A 63 16.093 10.774 -2.962 1.00 0.00 C ATOM 971 C LYS A 63 15.397 10.153 -4.179 1.00 0.00 C ATOM 972 O LYS A 63 14.762 10.865 -4.967 1.00 0.00 O ATOM 973 CB LYS A 63 16.873 12.057 -3.344 1.00 0.00 C ATOM 974 CG LYS A 63 18.123 11.856 -4.177 1.00 0.00 C ATOM 975 CD LYS A 63 18.667 13.179 -4.733 1.00 0.00 C ATOM 976 CE LYS A 63 18.947 14.218 -3.641 1.00 0.00 C ATOM 977 NZ LYS A 63 20.039 13.819 -2.725 1.00 0.00 N ATOM 0 H LYS A 63 17.831 9.661 -2.633 1.00 0.00 H new ATOM 0 HA LYS A 63 15.315 11.085 -2.265 1.00 0.00 H new ATOM 0 HB2 LYS A 63 16.200 12.718 -3.890 1.00 0.00 H new ATOM 0 HB3 LYS A 63 17.152 12.574 -2.426 1.00 0.00 H new ATOM 0 HG2 LYS A 63 18.890 11.377 -3.569 1.00 0.00 H new ATOM 0 HG3 LYS A 63 17.902 11.180 -5.003 1.00 0.00 H new ATOM 0 HD2 LYS A 63 19.586 12.984 -5.285 1.00 0.00 H new ATOM 0 HD3 LYS A 63 17.950 13.591 -5.443 1.00 0.00 H new ATOM 0 HE2 LYS A 63 19.203 15.168 -4.109 1.00 0.00 H new ATOM 0 HE3 LYS A 63 18.038 14.382 -3.063 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 19.774 14.052 -1.747 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 20.203 12.795 -2.805 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 20.909 14.329 -2.979 1.00 0.00 H new ATOM 990 N ILE A 64 15.508 8.837 -4.346 1.00 0.00 N ATOM 991 CA ILE A 64 14.835 8.169 -5.457 1.00 0.00 C ATOM 992 C ILE A 64 13.374 7.885 -5.073 1.00 0.00 C ATOM 993 O ILE A 64 13.025 6.799 -4.592 1.00 0.00 O ATOM 994 CB ILE A 64 15.518 6.837 -5.891 1.00 0.00 C ATOM 995 CG1 ILE A 64 17.024 7.034 -6.152 1.00 0.00 C ATOM 996 CG2 ILE A 64 14.835 6.271 -7.147 1.00 0.00 C ATOM 997 CD1 ILE A 64 17.364 7.841 -7.397 1.00 0.00 C ATOM 0 H ILE A 64 16.048 8.221 -3.738 1.00 0.00 H new ATOM 0 HA ILE A 64 14.895 8.846 -6.309 1.00 0.00 H new ATOM 0 HB ILE A 64 15.408 6.126 -5.072 1.00 0.00 H new ATOM 0 HG12 ILE A 64 17.465 7.528 -5.286 1.00 0.00 H new ATOM 0 HG13 ILE A 64 17.494 6.054 -6.234 1.00 0.00 H new ATOM 0 HG21 ILE A 64 15.323 5.341 -7.438 1.00 0.00 H new ATOM 0 HG22 ILE A 64 13.784 6.078 -6.934 1.00 0.00 H new ATOM 0 HG23 ILE A 64 14.914 6.992 -7.960 1.00 0.00 H new ATOM 0 HD11 ILE A 64 18.447 7.924 -7.493 1.00 0.00 H new ATOM 0 HD12 ILE A 64 16.959 7.341 -8.277 1.00 0.00 H new ATOM 0 HD13 ILE A 64 16.930 8.837 -7.314 1.00 0.00 H new ATOM 1009 N ASP A 65 12.568 8.894 -5.204 1.00 0.00 N ATOM 1010 CA ASP A 65 11.143 8.810 -4.935 1.00 0.00 C ATOM 1011 C ASP A 65 10.399 8.693 -6.237 1.00 0.00 C ATOM 1012 O ASP A 65 9.639 7.752 -6.448 1.00 0.00 O ATOM 1013 CB ASP A 65 10.684 10.045 -4.137 1.00 0.00 C ATOM 1014 CG ASP A 65 9.184 10.291 -4.172 1.00 0.00 C ATOM 1015 OD1 ASP A 65 8.401 9.448 -3.714 1.00 0.00 O ATOM 1016 OD2 ASP A 65 8.777 11.369 -4.666 1.00 0.00 O ATOM 0 H ASP A 65 12.875 9.819 -5.505 1.00 0.00 H new ATOM 0 HA ASP A 65 10.930 7.927 -4.333 1.00 0.00 H new ATOM 0 HB2 ASP A 65 10.997 9.929 -3.099 1.00 0.00 H new ATOM 0 HB3 ASP A 65 11.194 10.926 -4.528 1.00 0.00 H new ATOM 1021 N VAL A 66 10.678 9.640 -7.128 1.00 0.00 N ATOM 1022 CA VAL A 66 10.117 9.717 -8.471 1.00 0.00 C ATOM 1023 C VAL A 66 8.592 9.884 -8.445 1.00 0.00 C ATOM 1024 O VAL A 66 8.078 11.003 -8.572 1.00 0.00 O ATOM 1025 CB VAL A 66 10.554 8.513 -9.369 1.00 0.00 C ATOM 1026 CG1 VAL A 66 10.096 8.713 -10.795 1.00 0.00 C ATOM 1027 CG2 VAL A 66 12.069 8.326 -9.328 1.00 0.00 C ATOM 0 H VAL A 66 11.325 10.402 -6.926 1.00 0.00 H new ATOM 0 HA VAL A 66 10.532 10.615 -8.929 1.00 0.00 H new ATOM 0 HB VAL A 66 10.082 7.614 -8.974 1.00 0.00 H new ATOM 0 HG11 VAL A 66 10.411 7.863 -11.401 1.00 0.00 H new ATOM 0 HG12 VAL A 66 9.009 8.793 -10.820 1.00 0.00 H new ATOM 0 HG13 VAL A 66 10.537 9.627 -11.194 1.00 0.00 H new ATOM 0 HG21 VAL A 66 12.349 7.483 -9.960 1.00 0.00 H new ATOM 0 HG22 VAL A 66 12.557 9.230 -9.692 1.00 0.00 H new ATOM 0 HG23 VAL A 66 12.384 8.131 -8.303 1.00 0.00 H new ATOM 1037 N GLU A 67 7.907 8.798 -8.237 1.00 0.00 N ATOM 1038 CA GLU A 67 6.455 8.739 -8.146 1.00 0.00 C ATOM 1039 C GLU A 67 6.071 7.298 -7.820 1.00 0.00 C ATOM 1040 O GLU A 67 5.695 6.979 -6.679 1.00 0.00 O ATOM 1041 CB GLU A 67 5.777 9.201 -9.480 1.00 0.00 C ATOM 1042 CG GLU A 67 4.274 9.569 -9.390 1.00 0.00 C ATOM 1043 CD GLU A 67 3.345 8.416 -9.054 1.00 0.00 C ATOM 1044 OE1 GLU A 67 2.922 7.689 -9.969 1.00 0.00 O ATOM 1045 OE2 GLU A 67 3.010 8.219 -7.868 1.00 0.00 O ATOM 0 H GLU A 67 8.350 7.887 -8.120 1.00 0.00 H new ATOM 0 HA GLU A 67 6.107 9.416 -7.366 1.00 0.00 H new ATOM 0 HB2 GLU A 67 6.320 10.067 -9.859 1.00 0.00 H new ATOM 0 HB3 GLU A 67 5.892 8.406 -10.216 1.00 0.00 H new ATOM 0 HG2 GLU A 67 4.151 10.345 -8.635 1.00 0.00 H new ATOM 0 HG3 GLU A 67 3.964 9.999 -10.343 1.00 0.00 H new ATOM 1052 N GLY A 68 6.238 6.431 -8.795 1.00 0.00 N ATOM 1053 CA GLY A 68 5.838 5.061 -8.646 1.00 0.00 C ATOM 1054 C GLY A 68 6.979 4.156 -8.324 1.00 0.00 C ATOM 1055 O GLY A 68 6.932 3.422 -7.343 1.00 0.00 O ATOM 0 H GLY A 68 6.650 6.658 -9.700 1.00 0.00 H new ATOM 0 HA2 GLY A 68 5.090 4.990 -7.856 1.00 0.00 H new ATOM 0 HA3 GLY A 68 5.362 4.724 -9.567 1.00 0.00 H new ATOM 1059 N VAL A 69 8.028 4.237 -9.096 1.00 0.00 N ATOM 1060 CA VAL A 69 9.155 3.356 -8.917 1.00 0.00 C ATOM 1061 C VAL A 69 10.159 4.030 -8.025 1.00 0.00 C ATOM 1062 O VAL A 69 10.787 5.018 -8.406 1.00 0.00 O ATOM 1063 CB VAL A 69 9.821 2.988 -10.273 1.00 0.00 C ATOM 1064 CG1 VAL A 69 10.950 1.985 -10.067 1.00 0.00 C ATOM 1065 CG2 VAL A 69 8.794 2.438 -11.255 1.00 0.00 C ATOM 0 H VAL A 69 8.128 4.906 -9.859 1.00 0.00 H new ATOM 0 HA VAL A 69 8.801 2.430 -8.464 1.00 0.00 H new ATOM 0 HB VAL A 69 10.243 3.900 -10.696 1.00 0.00 H new ATOM 0 HG11 VAL A 69 11.401 1.742 -11.029 1.00 0.00 H new ATOM 0 HG12 VAL A 69 11.705 2.417 -9.411 1.00 0.00 H new ATOM 0 HG13 VAL A 69 10.552 1.077 -9.614 1.00 0.00 H new ATOM 0 HG21 VAL A 69 9.286 2.189 -12.195 1.00 0.00 H new ATOM 0 HG22 VAL A 69 8.335 1.542 -10.837 1.00 0.00 H new ATOM 0 HG23 VAL A 69 8.025 3.189 -11.436 1.00 0.00 H new ATOM 1075 N ARG A 70 10.269 3.523 -6.824 1.00 0.00 N ATOM 1076 CA ARG A 70 11.154 4.083 -5.854 1.00 0.00 C ATOM 1077 C ARG A 70 12.231 3.073 -5.559 1.00 0.00 C ATOM 1078 O ARG A 70 11.947 1.880 -5.360 1.00 0.00 O ATOM 1079 CB ARG A 70 10.422 4.391 -4.553 1.00 0.00 C ATOM 1080 CG ARG A 70 9.099 5.120 -4.700 1.00 0.00 C ATOM 1081 CD ARG A 70 8.533 5.411 -3.333 1.00 0.00 C ATOM 1082 NE ARG A 70 7.148 5.882 -3.349 1.00 0.00 N ATOM 1083 CZ ARG A 70 6.580 6.543 -2.333 1.00 0.00 C ATOM 1084 NH1 ARG A 70 7.337 6.982 -1.322 1.00 0.00 N ATOM 1085 NH2 ARG A 70 5.264 6.783 -2.338 1.00 0.00 N ATOM 0 H ARG A 70 9.745 2.711 -6.498 1.00 0.00 H new ATOM 0 HA ARG A 70 11.568 5.009 -6.252 1.00 0.00 H new ATOM 0 HB2 ARG A 70 10.243 3.453 -4.027 1.00 0.00 H new ATOM 0 HB3 ARG A 70 11.078 4.990 -3.921 1.00 0.00 H new ATOM 0 HG2 ARG A 70 9.242 6.049 -5.252 1.00 0.00 H new ATOM 0 HG3 ARG A 70 8.399 4.513 -5.274 1.00 0.00 H new ATOM 0 HD2 ARG A 70 8.591 4.507 -2.727 1.00 0.00 H new ATOM 0 HD3 ARG A 70 9.155 6.162 -2.846 1.00 0.00 H new ATOM 0 HE ARG A 70 6.585 5.697 -4.179 1.00 0.00 H new ATOM 0 HH11 ARG A 70 8.343 6.813 -1.327 1.00 0.00 H new ATOM 0 HH12 ARG A 70 6.909 7.486 -0.546 1.00 0.00 H new ATOM 0 HH21 ARG A 70 4.690 6.462 -3.118 1.00 0.00 H new ATOM 0 HH22 ARG A 70 4.835 7.287 -1.562 1.00 0.00 H new ATOM 1098 N VAL A 71 13.438 3.526 -5.539 1.00 0.00 N ATOM 1099 CA VAL A 71 14.565 2.697 -5.234 1.00 0.00 C ATOM 1100 C VAL A 71 15.241 3.343 -4.067 1.00 0.00 C ATOM 1101 O VAL A 71 15.790 4.410 -4.202 1.00 0.00 O ATOM 1102 CB VAL A 71 15.568 2.608 -6.418 1.00 0.00 C ATOM 1103 CG1 VAL A 71 16.657 1.583 -6.130 1.00 0.00 C ATOM 1104 CG2 VAL A 71 14.859 2.300 -7.734 1.00 0.00 C ATOM 0 H VAL A 71 13.678 4.497 -5.737 1.00 0.00 H new ATOM 0 HA VAL A 71 14.234 1.679 -5.027 1.00 0.00 H new ATOM 0 HB VAL A 71 16.040 3.585 -6.524 1.00 0.00 H new ATOM 0 HG11 VAL A 71 17.347 1.539 -6.973 1.00 0.00 H new ATOM 0 HG12 VAL A 71 17.201 1.873 -5.231 1.00 0.00 H new ATOM 0 HG13 VAL A 71 16.204 0.603 -5.980 1.00 0.00 H new ATOM 0 HG21 VAL A 71 15.593 2.246 -8.538 1.00 0.00 H new ATOM 0 HG22 VAL A 71 14.339 1.346 -7.652 1.00 0.00 H new ATOM 0 HG23 VAL A 71 14.139 3.088 -7.953 1.00 0.00 H new ATOM 1114 N LYS A 72 15.189 2.732 -2.936 1.00 0.00 N ATOM 1115 CA LYS A 72 15.708 3.360 -1.766 1.00 0.00 C ATOM 1116 C LYS A 72 16.490 2.372 -0.936 1.00 0.00 C ATOM 1117 O LYS A 72 16.311 1.150 -1.035 1.00 0.00 O ATOM 1118 CB LYS A 72 14.558 4.034 -0.971 1.00 0.00 C ATOM 1119 CG LYS A 72 14.991 4.851 0.247 1.00 0.00 C ATOM 1120 CD LYS A 72 13.827 5.632 0.831 1.00 0.00 C ATOM 1121 CE LYS A 72 14.259 6.466 2.029 1.00 0.00 C ATOM 1122 NZ LYS A 72 13.146 7.283 2.557 1.00 0.00 N ATOM 0 H LYS A 72 14.795 1.802 -2.793 1.00 0.00 H new ATOM 0 HA LYS A 72 16.406 4.146 -2.053 1.00 0.00 H new ATOM 0 HB2 LYS A 72 14.006 4.687 -1.647 1.00 0.00 H new ATOM 0 HB3 LYS A 72 13.866 3.260 -0.640 1.00 0.00 H new ATOM 0 HG2 LYS A 72 15.402 4.186 1.006 1.00 0.00 H new ATOM 0 HG3 LYS A 72 15.787 5.539 -0.038 1.00 0.00 H new ATOM 0 HD2 LYS A 72 13.405 6.284 0.066 1.00 0.00 H new ATOM 0 HD3 LYS A 72 13.039 4.942 1.132 1.00 0.00 H new ATOM 0 HE2 LYS A 72 14.632 5.809 2.814 1.00 0.00 H new ATOM 0 HE3 LYS A 72 15.084 7.118 1.740 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 13.478 7.837 3.372 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 12.806 7.928 1.815 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 12.369 6.660 2.856 1.00 0.00 H new ATOM 1135 N ILE A 73 17.353 2.897 -0.138 1.00 0.00 N ATOM 1136 CA ILE A 73 18.198 2.122 0.692 1.00 0.00 C ATOM 1137 C ILE A 73 17.601 1.937 2.068 1.00 0.00 C ATOM 1138 O ILE A 73 16.710 2.684 2.474 1.00 0.00 O ATOM 1139 CB ILE A 73 19.632 2.723 0.779 1.00 0.00 C ATOM 1140 CG1 ILE A 73 19.640 4.276 0.850 1.00 0.00 C ATOM 1141 CG2 ILE A 73 20.457 2.254 -0.391 1.00 0.00 C ATOM 1142 CD1 ILE A 73 18.974 4.899 2.063 1.00 0.00 C ATOM 0 H ILE A 73 17.492 3.903 -0.044 1.00 0.00 H new ATOM 0 HA ILE A 73 18.284 1.138 0.231 1.00 0.00 H new ATOM 0 HB ILE A 73 20.068 2.365 1.712 1.00 0.00 H new ATOM 0 HG12 ILE A 73 20.676 4.614 0.817 1.00 0.00 H new ATOM 0 HG13 ILE A 73 19.150 4.662 -0.044 1.00 0.00 H new ATOM 0 HG21 ILE A 73 21.459 2.678 -0.323 1.00 0.00 H new ATOM 0 HG22 ILE A 73 20.522 1.166 -0.377 1.00 0.00 H new ATOM 0 HG23 ILE A 73 19.988 2.578 -1.320 1.00 0.00 H new ATOM 0 HD11 ILE A 73 19.044 5.985 1.999 1.00 0.00 H new ATOM 0 HD12 ILE A 73 17.925 4.604 2.094 1.00 0.00 H new ATOM 0 HD13 ILE A 73 19.474 4.556 2.969 1.00 0.00 H new ATOM 1154 N ILE A 74 18.039 0.916 2.745 1.00 0.00 N ATOM 1155 CA ILE A 74 17.584 0.655 4.092 1.00 0.00 C ATOM 1156 C ILE A 74 18.763 0.673 5.068 1.00 0.00 C ATOM 1157 O ILE A 74 18.628 1.095 6.219 1.00 0.00 O ATOM 1158 CB ILE A 74 16.857 -0.723 4.173 1.00 0.00 C ATOM 1159 CG1 ILE A 74 15.660 -0.745 3.212 1.00 0.00 C ATOM 1160 CG2 ILE A 74 16.398 -1.029 5.607 1.00 0.00 C ATOM 1161 CD1 ILE A 74 14.956 -2.075 3.140 1.00 0.00 C ATOM 0 H ILE A 74 18.716 0.242 2.389 1.00 0.00 H new ATOM 0 HA ILE A 74 16.880 1.440 4.367 1.00 0.00 H new ATOM 0 HB ILE A 74 17.565 -1.497 3.878 1.00 0.00 H new ATOM 0 HG12 ILE A 74 14.945 0.017 3.522 1.00 0.00 H new ATOM 0 HG13 ILE A 74 16.003 -0.473 2.214 1.00 0.00 H new ATOM 0 HG21 ILE A 74 15.895 -1.996 5.630 1.00 0.00 H new ATOM 0 HG22 ILE A 74 17.264 -1.055 6.268 1.00 0.00 H new ATOM 0 HG23 ILE A 74 15.709 -0.254 5.942 1.00 0.00 H new ATOM 0 HD11 ILE A 74 14.123 -2.008 2.440 1.00 0.00 H new ATOM 0 HD12 ILE A 74 15.655 -2.839 2.800 1.00 0.00 H new ATOM 0 HD13 ILE A 74 14.580 -2.342 4.128 1.00 0.00 H new ATOM 1173 N HIS A 75 19.924 0.282 4.584 1.00 0.00 N ATOM 1174 CA HIS A 75 21.083 0.075 5.435 1.00 0.00 C ATOM 1175 C HIS A 75 22.366 0.333 4.610 1.00 0.00 C ATOM 1176 O HIS A 75 22.472 -0.123 3.475 1.00 0.00 O ATOM 1177 CB HIS A 75 20.949 -1.378 5.985 1.00 0.00 C ATOM 1178 CG HIS A 75 22.008 -1.929 6.902 1.00 0.00 C ATOM 1179 ND1 HIS A 75 22.724 -1.196 7.821 1.00 0.00 N ATOM 1180 CD2 HIS A 75 22.455 -3.195 7.013 1.00 0.00 C ATOM 1181 CE1 HIS A 75 23.579 -1.995 8.443 1.00 0.00 C ATOM 1182 NE2 HIS A 75 23.431 -3.216 7.963 1.00 0.00 N ATOM 0 H HIS A 75 20.093 0.099 3.595 1.00 0.00 H new ATOM 0 HA HIS A 75 21.143 0.761 6.280 1.00 0.00 H new ATOM 0 HB2 HIS A 75 19.997 -1.440 6.512 1.00 0.00 H new ATOM 0 HB3 HIS A 75 20.882 -2.046 5.126 1.00 0.00 H new ATOM 0 HD2 HIS A 75 22.101 -4.045 6.448 1.00 0.00 H new ATOM 0 HE1 HIS A 75 24.278 -1.698 9.211 1.00 0.00 H new ATOM 0 HE2 HIS A 75 23.959 -4.038 8.255 1.00 0.00 H new ATOM 1190 N ALA A 76 23.280 1.116 5.164 1.00 0.00 N ATOM 1191 CA ALA A 76 24.516 1.544 4.492 1.00 0.00 C ATOM 1192 C ALA A 76 25.667 1.499 5.476 1.00 0.00 C ATOM 1193 O ALA A 76 25.565 2.064 6.569 1.00 0.00 O ATOM 1194 CB ALA A 76 24.340 2.970 4.038 1.00 0.00 C ATOM 0 H ALA A 76 23.189 1.483 6.111 1.00 0.00 H new ATOM 0 HA ALA A 76 24.723 0.887 3.647 1.00 0.00 H new ATOM 0 HB1 ALA A 76 25.247 3.307 3.536 1.00 0.00 H new ATOM 0 HB2 ALA A 76 23.499 3.031 3.347 1.00 0.00 H new ATOM 0 HB3 ALA A 76 24.146 3.606 4.902 1.00 0.00 H new ATOM 1200 N ALA A 77 26.756 0.864 5.111 1.00 0.00 N ATOM 1201 CA ALA A 77 27.881 0.747 6.022 1.00 0.00 C ATOM 1202 C ALA A 77 29.185 0.577 5.274 1.00 0.00 C ATOM 1203 O ALA A 77 29.202 0.137 4.125 1.00 0.00 O ATOM 1204 CB ALA A 77 27.673 -0.428 6.971 1.00 0.00 C ATOM 0 H ALA A 77 26.891 0.423 4.201 1.00 0.00 H new ATOM 0 HA ALA A 77 27.938 1.671 6.597 1.00 0.00 H new ATOM 0 HB1 ALA A 77 28.524 -0.504 7.648 1.00 0.00 H new ATOM 0 HB2 ALA A 77 26.762 -0.272 7.549 1.00 0.00 H new ATOM 0 HB3 ALA A 77 27.584 -1.349 6.395 1.00 0.00 H new ATOM 1210 N VAL A 78 30.270 0.913 5.930 1.00 0.00 N ATOM 1211 CA VAL A 78 31.581 0.733 5.368 1.00 0.00 C ATOM 1212 C VAL A 78 32.132 -0.600 5.841 1.00 0.00 C ATOM 1213 O VAL A 78 32.639 -0.742 6.958 1.00 0.00 O ATOM 1214 CB VAL A 78 32.558 1.921 5.696 1.00 0.00 C ATOM 1215 CG1 VAL A 78 32.664 2.214 7.200 1.00 0.00 C ATOM 1216 CG2 VAL A 78 33.941 1.682 5.085 1.00 0.00 C ATOM 0 H VAL A 78 30.266 1.318 6.866 1.00 0.00 H new ATOM 0 HA VAL A 78 31.495 0.730 4.281 1.00 0.00 H new ATOM 0 HB VAL A 78 32.125 2.810 5.238 1.00 0.00 H new ATOM 0 HG11 VAL A 78 33.353 3.043 7.361 1.00 0.00 H new ATOM 0 HG12 VAL A 78 31.681 2.478 7.590 1.00 0.00 H new ATOM 0 HG13 VAL A 78 33.034 1.329 7.718 1.00 0.00 H new ATOM 0 HG21 VAL A 78 34.596 2.519 5.328 1.00 0.00 H new ATOM 0 HG22 VAL A 78 34.363 0.762 5.489 1.00 0.00 H new ATOM 0 HG23 VAL A 78 33.850 1.595 4.002 1.00 0.00 H new ATOM 1226 N GLY A 79 31.950 -1.585 5.039 1.00 0.00 N ATOM 1227 CA GLY A 79 32.365 -2.873 5.400 1.00 0.00 C ATOM 1228 C GLY A 79 32.154 -3.820 4.295 1.00 0.00 C ATOM 1229 O GLY A 79 31.609 -3.455 3.246 1.00 0.00 O ATOM 0 H GLY A 79 31.511 -1.513 4.121 1.00 0.00 H new ATOM 0 HA2 GLY A 79 33.420 -2.856 5.674 1.00 0.00 H new ATOM 0 HA3 GLY A 79 31.813 -3.205 6.279 1.00 0.00 H new ATOM 1233 N ALA A 80 32.581 -5.010 4.507 1.00 0.00 N ATOM 1234 CA ALA A 80 32.443 -6.056 3.556 1.00 0.00 C ATOM 1235 C ALA A 80 31.100 -6.746 3.743 1.00 0.00 C ATOM 1236 O ALA A 80 30.359 -6.436 4.691 1.00 0.00 O ATOM 1237 CB ALA A 80 33.604 -7.016 3.722 1.00 0.00 C ATOM 0 H ALA A 80 33.049 -5.294 5.368 1.00 0.00 H new ATOM 0 HA ALA A 80 32.465 -5.661 2.540 1.00 0.00 H new ATOM 0 HB1 ALA A 80 33.513 -7.826 2.998 1.00 0.00 H new ATOM 0 HB2 ALA A 80 34.542 -6.485 3.556 1.00 0.00 H new ATOM 0 HB3 ALA A 80 33.594 -7.428 4.731 1.00 0.00 H new ATOM 1243 N ILE A 81 30.763 -7.646 2.849 1.00 0.00 N ATOM 1244 CA ILE A 81 29.518 -8.366 2.967 1.00 0.00 C ATOM 1245 C ILE A 81 29.663 -9.400 4.047 1.00 0.00 C ATOM 1246 O ILE A 81 30.391 -10.389 3.903 1.00 0.00 O ATOM 1247 CB ILE A 81 28.996 -9.015 1.629 1.00 0.00 C ATOM 1248 CG1 ILE A 81 28.419 -7.975 0.656 1.00 0.00 C ATOM 1249 CG2 ILE A 81 27.935 -10.060 1.907 1.00 0.00 C ATOM 1250 CD1 ILE A 81 29.397 -7.004 0.080 1.00 0.00 C ATOM 0 H ILE A 81 31.329 -7.895 2.038 1.00 0.00 H new ATOM 0 HA ILE A 81 28.753 -7.634 3.225 1.00 0.00 H new ATOM 0 HB ILE A 81 29.865 -9.480 1.163 1.00 0.00 H new ATOM 0 HG12 ILE A 81 27.936 -8.504 -0.165 1.00 0.00 H new ATOM 0 HG13 ILE A 81 27.642 -7.413 1.174 1.00 0.00 H new ATOM 0 HG21 ILE A 81 27.593 -10.491 0.966 1.00 0.00 H new ATOM 0 HG22 ILE A 81 28.354 -10.846 2.535 1.00 0.00 H new ATOM 0 HG23 ILE A 81 27.093 -9.596 2.421 1.00 0.00 H new ATOM 0 HD11 ILE A 81 28.878 -6.320 -0.591 1.00 0.00 H new ATOM 0 HD12 ILE A 81 29.865 -6.438 0.885 1.00 0.00 H new ATOM 0 HD13 ILE A 81 30.163 -7.545 -0.475 1.00 0.00 H new ATOM 1262 N THR A 82 29.032 -9.146 5.125 1.00 0.00 N ATOM 1263 CA THR A 82 29.090 -9.988 6.243 1.00 0.00 C ATOM 1264 C THR A 82 27.791 -10.763 6.379 1.00 0.00 C ATOM 1265 O THR A 82 26.738 -10.293 5.928 1.00 0.00 O ATOM 1266 CB THR A 82 29.403 -9.141 7.474 1.00 0.00 C ATOM 1267 OG1 THR A 82 28.910 -7.805 7.225 1.00 0.00 O ATOM 1268 CG2 THR A 82 30.903 -9.091 7.734 1.00 0.00 C ATOM 0 H THR A 82 28.445 -8.322 5.254 1.00 0.00 H new ATOM 0 HA THR A 82 29.883 -10.728 6.131 1.00 0.00 H new ATOM 0 HB THR A 82 28.926 -9.578 8.352 1.00 0.00 H new ATOM 0 HG1 THR A 82 27.994 -7.726 7.563 1.00 0.00 H new ATOM 0 HG21 THR A 82 31.099 -8.482 8.616 1.00 0.00 H new ATOM 0 HG22 THR A 82 31.277 -10.101 7.900 1.00 0.00 H new ATOM 0 HG23 THR A 82 31.407 -8.655 6.872 1.00 0.00 H new ATOM 1276 N GLU A 83 27.879 -11.937 6.983 1.00 0.00 N ATOM 1277 CA GLU A 83 26.768 -12.876 7.094 1.00 0.00 C ATOM 1278 C GLU A 83 25.523 -12.241 7.718 1.00 0.00 C ATOM 1279 O GLU A 83 24.428 -12.356 7.180 1.00 0.00 O ATOM 1280 CB GLU A 83 27.234 -14.122 7.861 1.00 0.00 C ATOM 1281 CG GLU A 83 26.187 -15.194 8.050 1.00 0.00 C ATOM 1282 CD GLU A 83 26.765 -16.473 8.605 1.00 0.00 C ATOM 1283 OE1 GLU A 83 27.079 -16.530 9.802 1.00 0.00 O ATOM 1284 OE2 GLU A 83 26.933 -17.448 7.847 1.00 0.00 O ATOM 0 H GLU A 83 28.738 -12.273 7.418 1.00 0.00 H new ATOM 0 HA GLU A 83 26.464 -13.174 6.091 1.00 0.00 H new ATOM 0 HB2 GLU A 83 28.083 -14.556 7.334 1.00 0.00 H new ATOM 0 HB3 GLU A 83 27.593 -13.811 8.842 1.00 0.00 H new ATOM 0 HG2 GLU A 83 25.413 -14.827 8.723 1.00 0.00 H new ATOM 0 HG3 GLU A 83 25.706 -15.401 7.094 1.00 0.00 H new ATOM 1291 N SER A 84 25.715 -11.513 8.779 1.00 0.00 N ATOM 1292 CA SER A 84 24.630 -10.883 9.503 1.00 0.00 C ATOM 1293 C SER A 84 23.972 -9.721 8.719 1.00 0.00 C ATOM 1294 O SER A 84 22.838 -9.342 8.989 1.00 0.00 O ATOM 1295 CB SER A 84 25.166 -10.447 10.849 1.00 0.00 C ATOM 1296 OG SER A 84 26.483 -9.943 10.687 1.00 0.00 O ATOM 0 H SER A 84 26.637 -11.333 9.177 1.00 0.00 H new ATOM 0 HA SER A 84 23.822 -11.602 9.642 1.00 0.00 H new ATOM 0 HB2 SER A 84 24.521 -9.681 11.280 1.00 0.00 H new ATOM 0 HB3 SER A 84 25.169 -11.288 11.542 1.00 0.00 H new ATOM 0 HG SER A 84 26.833 -9.658 11.557 1.00 0.00 H new ATOM 1302 N ASP A 85 24.663 -9.194 7.722 1.00 0.00 N ATOM 1303 CA ASP A 85 24.091 -8.121 6.903 1.00 0.00 C ATOM 1304 C ASP A 85 23.184 -8.697 5.859 1.00 0.00 C ATOM 1305 O ASP A 85 22.239 -8.052 5.396 1.00 0.00 O ATOM 1306 CB ASP A 85 25.165 -7.245 6.262 1.00 0.00 C ATOM 1307 CG ASP A 85 25.708 -6.204 7.203 1.00 0.00 C ATOM 1308 OD1 ASP A 85 25.113 -5.121 7.324 1.00 0.00 O ATOM 1309 OD2 ASP A 85 26.782 -6.431 7.791 1.00 0.00 O ATOM 0 H ASP A 85 25.605 -9.481 7.457 1.00 0.00 H new ATOM 0 HA ASP A 85 23.512 -7.477 7.565 1.00 0.00 H new ATOM 0 HB2 ASP A 85 25.983 -7.877 5.915 1.00 0.00 H new ATOM 0 HB3 ASP A 85 24.748 -6.752 5.384 1.00 0.00 H new ATOM 1314 N ILE A 86 23.448 -9.933 5.515 1.00 0.00 N ATOM 1315 CA ILE A 86 22.654 -10.647 4.548 1.00 0.00 C ATOM 1316 C ILE A 86 21.293 -11.021 5.137 1.00 0.00 C ATOM 1317 O ILE A 86 20.308 -11.205 4.405 1.00 0.00 O ATOM 1318 CB ILE A 86 23.417 -11.867 4.051 1.00 0.00 C ATOM 1319 CG1 ILE A 86 24.709 -11.389 3.406 1.00 0.00 C ATOM 1320 CG2 ILE A 86 22.595 -12.687 3.077 1.00 0.00 C ATOM 1321 CD1 ILE A 86 25.505 -12.472 2.785 1.00 0.00 C ATOM 0 H ILE A 86 24.223 -10.474 5.900 1.00 0.00 H new ATOM 0 HA ILE A 86 22.463 -10.001 3.691 1.00 0.00 H new ATOM 0 HB ILE A 86 23.638 -12.521 4.894 1.00 0.00 H new ATOM 0 HG12 ILE A 86 24.471 -10.645 2.646 1.00 0.00 H new ATOM 0 HG13 ILE A 86 25.318 -10.891 4.160 1.00 0.00 H new ATOM 0 HG21 ILE A 86 23.175 -13.548 2.746 1.00 0.00 H new ATOM 0 HG22 ILE A 86 21.684 -13.030 3.568 1.00 0.00 H new ATOM 0 HG23 ILE A 86 22.333 -12.073 2.215 1.00 0.00 H new ATOM 0 HD11 ILE A 86 26.411 -12.053 2.347 1.00 0.00 H new ATOM 0 HD12 ILE A 86 25.776 -13.206 3.544 1.00 0.00 H new ATOM 0 HD13 ILE A 86 24.916 -12.956 2.006 1.00 0.00 H new ATOM 1333 N SER A 87 21.222 -11.036 6.456 1.00 0.00 N ATOM 1334 CA SER A 87 19.982 -11.285 7.154 1.00 0.00 C ATOM 1335 C SER A 87 18.935 -10.208 6.777 1.00 0.00 C ATOM 1336 O SER A 87 17.730 -10.467 6.805 1.00 0.00 O ATOM 1337 CB SER A 87 20.239 -11.287 8.657 1.00 0.00 C ATOM 1338 OG SER A 87 21.288 -12.186 8.986 1.00 0.00 O ATOM 0 H SER A 87 22.022 -10.876 7.068 1.00 0.00 H new ATOM 0 HA SER A 87 19.588 -12.259 6.863 1.00 0.00 H new ATOM 0 HB2 SER A 87 20.498 -10.281 8.988 1.00 0.00 H new ATOM 0 HB3 SER A 87 19.330 -11.572 9.186 1.00 0.00 H new ATOM 0 HG SER A 87 21.439 -12.172 9.954 1.00 0.00 H new ATOM 1344 N LEU A 88 19.420 -9.020 6.398 1.00 0.00 N ATOM 1345 CA LEU A 88 18.573 -7.930 5.960 1.00 0.00 C ATOM 1346 C LEU A 88 18.153 -8.147 4.511 1.00 0.00 C ATOM 1347 O LEU A 88 17.000 -7.880 4.141 1.00 0.00 O ATOM 1348 CB LEU A 88 19.316 -6.568 6.145 1.00 0.00 C ATOM 1349 CG LEU A 88 18.626 -5.262 5.638 1.00 0.00 C ATOM 1350 CD1 LEU A 88 18.778 -5.064 4.132 1.00 0.00 C ATOM 1351 CD2 LEU A 88 17.158 -5.280 5.997 1.00 0.00 C ATOM 0 H LEU A 88 20.415 -8.798 6.390 1.00 0.00 H new ATOM 0 HA LEU A 88 17.670 -7.903 6.570 1.00 0.00 H new ATOM 0 HB2 LEU A 88 19.518 -6.444 7.209 1.00 0.00 H new ATOM 0 HB3 LEU A 88 20.281 -6.647 5.645 1.00 0.00 H new ATOM 0 HG LEU A 88 19.125 -4.428 6.131 1.00 0.00 H new ATOM 0 HD11 LEU A 88 18.280 -4.141 3.834 1.00 0.00 H new ATOM 0 HD12 LEU A 88 19.836 -5.003 3.878 1.00 0.00 H new ATOM 0 HD13 LEU A 88 18.327 -5.906 3.607 1.00 0.00 H new ATOM 0 HD21 LEU A 88 16.685 -4.365 5.640 1.00 0.00 H new ATOM 0 HD22 LEU A 88 16.680 -6.142 5.531 1.00 0.00 H new ATOM 0 HD23 LEU A 88 17.049 -5.346 7.080 1.00 0.00 H new ATOM 1363 N ALA A 89 19.079 -8.647 3.720 1.00 0.00 N ATOM 1364 CA ALA A 89 18.880 -8.849 2.296 1.00 0.00 C ATOM 1365 C ALA A 89 17.629 -9.685 2.022 1.00 0.00 C ATOM 1366 O ALA A 89 16.701 -9.216 1.395 1.00 0.00 O ATOM 1367 CB ALA A 89 20.118 -9.476 1.686 1.00 0.00 C ATOM 0 H ALA A 89 20.002 -8.929 4.049 1.00 0.00 H new ATOM 0 HA ALA A 89 18.720 -7.879 1.825 1.00 0.00 H new ATOM 0 HB1 ALA A 89 19.962 -9.625 0.618 1.00 0.00 H new ATOM 0 HB2 ALA A 89 20.973 -8.817 1.839 1.00 0.00 H new ATOM 0 HB3 ALA A 89 20.311 -10.438 2.162 1.00 0.00 H new ATOM 1373 N THR A 90 17.582 -10.880 2.551 1.00 0.00 N ATOM 1374 CA THR A 90 16.399 -11.731 2.383 1.00 0.00 C ATOM 1375 C THR A 90 15.177 -11.161 3.144 1.00 0.00 C ATOM 1376 O THR A 90 14.035 -11.334 2.706 1.00 0.00 O ATOM 1377 CB THR A 90 16.691 -13.201 2.815 1.00 0.00 C ATOM 1378 OG1 THR A 90 15.488 -13.998 2.862 1.00 0.00 O ATOM 1379 CG2 THR A 90 17.395 -13.241 4.141 1.00 0.00 C ATOM 0 H THR A 90 18.334 -11.297 3.100 1.00 0.00 H new ATOM 0 HA THR A 90 16.153 -11.738 1.321 1.00 0.00 H new ATOM 0 HB THR A 90 17.345 -13.633 2.058 1.00 0.00 H new ATOM 0 HG1 THR A 90 15.712 -14.912 3.135 1.00 0.00 H new ATOM 0 HG21 THR A 90 17.587 -14.277 4.420 1.00 0.00 H new ATOM 0 HG22 THR A 90 18.340 -12.704 4.067 1.00 0.00 H new ATOM 0 HG23 THR A 90 16.769 -12.771 4.900 1.00 0.00 H new ATOM 1387 N ALA A 91 15.436 -10.423 4.236 1.00 0.00 N ATOM 1388 CA ALA A 91 14.371 -9.866 5.074 1.00 0.00 C ATOM 1389 C ALA A 91 13.510 -8.898 4.303 1.00 0.00 C ATOM 1390 O ALA A 91 12.347 -9.164 4.028 1.00 0.00 O ATOM 1391 CB ALA A 91 14.940 -9.180 6.306 1.00 0.00 C ATOM 0 H ALA A 91 16.378 -10.200 4.557 1.00 0.00 H new ATOM 0 HA ALA A 91 13.750 -10.702 5.394 1.00 0.00 H new ATOM 0 HB1 ALA A 91 14.125 -8.777 6.907 1.00 0.00 H new ATOM 0 HB2 ALA A 91 15.504 -9.902 6.897 1.00 0.00 H new ATOM 0 HB3 ALA A 91 15.599 -8.368 5.999 1.00 0.00 H new ATOM 1397 N SER A 92 14.096 -7.811 3.902 1.00 0.00 N ATOM 1398 CA SER A 92 13.374 -6.776 3.221 1.00 0.00 C ATOM 1399 C SER A 92 13.454 -6.930 1.702 1.00 0.00 C ATOM 1400 O SER A 92 13.013 -6.048 0.963 1.00 0.00 O ATOM 1401 CB SER A 92 13.867 -5.422 3.698 1.00 0.00 C ATOM 1402 OG SER A 92 13.717 -5.322 5.114 1.00 0.00 O ATOM 0 H SER A 92 15.088 -7.615 4.037 1.00 0.00 H new ATOM 0 HA SER A 92 12.315 -6.860 3.467 1.00 0.00 H new ATOM 0 HB2 SER A 92 14.914 -5.289 3.424 1.00 0.00 H new ATOM 0 HB3 SER A 92 13.306 -4.627 3.207 1.00 0.00 H new ATOM 0 HG SER A 92 14.038 -4.447 5.416 1.00 0.00 H new ATOM 1408 N ASN A 93 14.058 -8.044 1.255 1.00 0.00 N ATOM 1409 CA ASN A 93 14.173 -8.392 -0.189 1.00 0.00 C ATOM 1410 C ASN A 93 15.096 -7.417 -0.882 1.00 0.00 C ATOM 1411 O ASN A 93 14.959 -7.122 -2.083 1.00 0.00 O ATOM 1412 CB ASN A 93 12.792 -8.456 -0.912 1.00 0.00 C ATOM 1413 CG ASN A 93 11.909 -9.658 -0.534 1.00 0.00 C ATOM 1414 OD1 ASN A 93 11.968 -10.116 0.697 1.00 0.00 O flip ATOM 1415 ND2 ASN A 93 11.155 -10.161 -1.366 1.00 0.00 N flip ATOM 0 H ASN A 93 14.482 -8.733 1.876 1.00 0.00 H new ATOM 0 HA ASN A 93 14.594 -9.396 -0.246 1.00 0.00 H new ATOM 0 HB2 ASN A 93 12.243 -7.540 -0.694 1.00 0.00 H new ATOM 0 HB3 ASN A 93 12.964 -8.476 -1.988 1.00 0.00 H new ATOM 0 HD21 ASN A 93 11.124 -9.791 -2.316 1.00 0.00 H new ATOM 0 HD22 ASN A 93 10.561 -10.948 -1.106 1.00 0.00 H new ATOM 1422 N ALA A 94 16.071 -6.972 -0.129 1.00 0.00 N ATOM 1423 CA ALA A 94 17.039 -6.027 -0.582 1.00 0.00 C ATOM 1424 C ALA A 94 18.261 -6.761 -1.087 1.00 0.00 C ATOM 1425 O ALA A 94 18.540 -7.875 -0.669 1.00 0.00 O ATOM 1426 CB ALA A 94 17.422 -5.099 0.562 1.00 0.00 C ATOM 0 H ALA A 94 16.210 -7.269 0.837 1.00 0.00 H new ATOM 0 HA ALA A 94 16.618 -5.433 -1.393 1.00 0.00 H new ATOM 0 HB1 ALA A 94 18.162 -4.378 0.214 1.00 0.00 H new ATOM 0 HB2 ALA A 94 16.536 -4.569 0.913 1.00 0.00 H new ATOM 0 HB3 ALA A 94 17.843 -5.684 1.380 1.00 0.00 H new ATOM 1432 N ILE A 95 18.962 -6.157 -1.981 1.00 0.00 N ATOM 1433 CA ILE A 95 20.166 -6.744 -2.519 1.00 0.00 C ATOM 1434 C ILE A 95 21.356 -5.981 -1.967 1.00 0.00 C ATOM 1435 O ILE A 95 21.292 -4.749 -1.803 1.00 0.00 O ATOM 1436 CB ILE A 95 20.161 -6.701 -4.086 1.00 0.00 C ATOM 1437 CG1 ILE A 95 19.018 -7.561 -4.661 1.00 0.00 C ATOM 1438 CG2 ILE A 95 21.508 -7.110 -4.686 1.00 0.00 C ATOM 1439 CD1 ILE A 95 19.092 -9.038 -4.298 1.00 0.00 C ATOM 0 H ILE A 95 18.728 -5.243 -2.368 1.00 0.00 H new ATOM 0 HA ILE A 95 20.225 -7.792 -2.225 1.00 0.00 H new ATOM 0 HB ILE A 95 19.988 -5.663 -4.371 1.00 0.00 H new ATOM 0 HG12 ILE A 95 18.067 -7.161 -4.309 1.00 0.00 H new ATOM 0 HG13 ILE A 95 19.021 -7.467 -5.747 1.00 0.00 H new ATOM 0 HG21 ILE A 95 21.451 -7.063 -5.774 1.00 0.00 H new ATOM 0 HG22 ILE A 95 22.284 -6.431 -4.334 1.00 0.00 H new ATOM 0 HG23 ILE A 95 21.749 -8.128 -4.379 1.00 0.00 H new ATOM 0 HD11 ILE A 95 18.249 -9.565 -4.745 1.00 0.00 H new ATOM 0 HD12 ILE A 95 20.024 -9.459 -4.675 1.00 0.00 H new ATOM 0 HD13 ILE A 95 19.056 -9.149 -3.214 1.00 0.00 H new ATOM 1451 N VAL A 96 22.413 -6.698 -1.652 1.00 0.00 N ATOM 1452 CA VAL A 96 23.598 -6.090 -1.108 1.00 0.00 C ATOM 1453 C VAL A 96 24.565 -5.813 -2.232 1.00 0.00 C ATOM 1454 O VAL A 96 24.957 -6.733 -2.969 1.00 0.00 O ATOM 1455 CB VAL A 96 24.302 -6.984 -0.049 1.00 0.00 C ATOM 1456 CG1 VAL A 96 25.355 -6.194 0.710 1.00 0.00 C ATOM 1457 CG2 VAL A 96 23.309 -7.632 0.908 1.00 0.00 C ATOM 0 H VAL A 96 22.471 -7.710 -1.766 1.00 0.00 H new ATOM 0 HA VAL A 96 23.293 -5.170 -0.609 1.00 0.00 H new ATOM 0 HB VAL A 96 24.798 -7.792 -0.587 1.00 0.00 H new ATOM 0 HG11 VAL A 96 25.834 -6.840 1.446 1.00 0.00 H new ATOM 0 HG12 VAL A 96 26.104 -5.821 0.011 1.00 0.00 H new ATOM 0 HG13 VAL A 96 24.883 -5.353 1.218 1.00 0.00 H new ATOM 0 HG21 VAL A 96 23.847 -8.247 1.629 1.00 0.00 H new ATOM 0 HG22 VAL A 96 22.753 -6.857 1.435 1.00 0.00 H new ATOM 0 HG23 VAL A 96 22.616 -8.257 0.345 1.00 0.00 H new ATOM 1467 N ILE A 97 24.904 -4.568 -2.392 1.00 0.00 N ATOM 1468 CA ILE A 97 25.846 -4.161 -3.391 1.00 0.00 C ATOM 1469 C ILE A 97 27.094 -3.648 -2.694 1.00 0.00 C ATOM 1470 O ILE A 97 27.022 -2.720 -1.878 1.00 0.00 O ATOM 1471 CB ILE A 97 25.258 -3.053 -4.323 1.00 0.00 C ATOM 1472 CG1 ILE A 97 23.961 -3.555 -4.993 1.00 0.00 C ATOM 1473 CG2 ILE A 97 26.285 -2.642 -5.384 1.00 0.00 C ATOM 1474 CD1 ILE A 97 23.271 -2.529 -5.879 1.00 0.00 C ATOM 0 H ILE A 97 24.532 -3.802 -1.830 1.00 0.00 H new ATOM 0 HA ILE A 97 26.085 -5.018 -4.021 1.00 0.00 H new ATOM 0 HB ILE A 97 25.022 -2.178 -3.718 1.00 0.00 H new ATOM 0 HG12 ILE A 97 24.194 -4.436 -5.592 1.00 0.00 H new ATOM 0 HG13 ILE A 97 23.265 -3.872 -4.216 1.00 0.00 H new ATOM 0 HG21 ILE A 97 25.858 -1.870 -6.024 1.00 0.00 H new ATOM 0 HG22 ILE A 97 27.179 -2.255 -4.895 1.00 0.00 H new ATOM 0 HG23 ILE A 97 26.550 -3.509 -5.989 1.00 0.00 H new ATOM 0 HD11 ILE A 97 22.370 -2.966 -6.308 1.00 0.00 H new ATOM 0 HD12 ILE A 97 23.003 -1.656 -5.284 1.00 0.00 H new ATOM 0 HD13 ILE A 97 23.946 -2.228 -6.681 1.00 0.00 H new ATOM 1486 N GLY A 98 28.203 -4.280 -2.970 1.00 0.00 N ATOM 1487 CA GLY A 98 29.454 -3.884 -2.408 1.00 0.00 C ATOM 1488 C GLY A 98 30.535 -3.985 -3.444 1.00 0.00 C ATOM 1489 O GLY A 98 30.313 -4.552 -4.514 1.00 0.00 O ATOM 0 H GLY A 98 28.258 -5.085 -3.593 1.00 0.00 H new ATOM 0 HA2 GLY A 98 29.388 -2.861 -2.037 1.00 0.00 H new ATOM 0 HA3 GLY A 98 29.696 -4.518 -1.555 1.00 0.00 H new ATOM 1493 N PHE A 99 31.709 -3.490 -3.147 1.00 0.00 N ATOM 1494 CA PHE A 99 32.786 -3.519 -4.113 1.00 0.00 C ATOM 1495 C PHE A 99 34.118 -3.394 -3.446 1.00 0.00 C ATOM 1496 O PHE A 99 34.263 -2.629 -2.497 1.00 0.00 O ATOM 1497 CB PHE A 99 32.602 -2.481 -5.262 1.00 0.00 C ATOM 1498 CG PHE A 99 32.324 -1.051 -4.852 1.00 0.00 C ATOM 1499 CD1 PHE A 99 33.356 -0.193 -4.520 1.00 0.00 C ATOM 1500 CD2 PHE A 99 31.024 -0.566 -4.833 1.00 0.00 C ATOM 1501 CE1 PHE A 99 33.102 1.120 -4.174 1.00 0.00 C ATOM 1502 CE2 PHE A 99 30.762 0.746 -4.493 1.00 0.00 C ATOM 1503 CZ PHE A 99 31.803 1.589 -4.163 1.00 0.00 C ATOM 0 H PHE A 99 31.947 -3.064 -2.251 1.00 0.00 H new ATOM 0 HA PHE A 99 32.749 -4.497 -4.592 1.00 0.00 H new ATOM 0 HB2 PHE A 99 33.503 -2.489 -5.875 1.00 0.00 H new ATOM 0 HB3 PHE A 99 31.782 -2.818 -5.896 1.00 0.00 H new ATOM 0 HD1 PHE A 99 34.374 -0.554 -4.531 1.00 0.00 H new ATOM 0 HD2 PHE A 99 30.206 -1.224 -5.088 1.00 0.00 H new ATOM 0 HE1 PHE A 99 33.917 1.778 -3.913 1.00 0.00 H new ATOM 0 HE2 PHE A 99 29.746 1.111 -4.485 1.00 0.00 H new ATOM 0 HZ PHE A 99 31.602 2.616 -3.896 1.00 0.00 H new ATOM 1513 N ASN A 100 35.059 -4.253 -3.874 1.00 0.00 N ATOM 1514 CA ASN A 100 36.464 -4.302 -3.391 1.00 0.00 C ATOM 1515 C ASN A 100 36.587 -4.875 -1.988 1.00 0.00 C ATOM 1516 O ASN A 100 37.612 -5.430 -1.608 1.00 0.00 O ATOM 1517 CB ASN A 100 37.187 -2.952 -3.540 1.00 0.00 C ATOM 1518 CG ASN A 100 37.375 -2.550 -5.000 1.00 0.00 C ATOM 1519 OD1 ASN A 100 36.563 -2.882 -5.872 1.00 0.00 O ATOM 1520 ND2 ASN A 100 38.424 -1.844 -5.278 1.00 0.00 N ATOM 0 H ASN A 100 34.865 -4.956 -4.587 1.00 0.00 H new ATOM 0 HA ASN A 100 36.981 -5.001 -4.048 1.00 0.00 H new ATOM 0 HB2 ASN A 100 36.617 -2.179 -3.024 1.00 0.00 H new ATOM 0 HB3 ASN A 100 38.161 -3.009 -3.054 1.00 0.00 H new ATOM 0 HD21 ASN A 100 38.599 -1.546 -6.238 1.00 0.00 H new ATOM 0 HD22 ASN A 100 39.076 -1.586 -4.537 1.00 0.00 H new ATOM 1527 N VAL A 101 35.522 -4.788 -1.261 1.00 0.00 N ATOM 1528 CA VAL A 101 35.415 -5.321 0.068 1.00 0.00 C ATOM 1529 C VAL A 101 35.210 -6.812 0.039 1.00 0.00 C ATOM 1530 O VAL A 101 35.934 -7.541 0.701 1.00 0.00 O ATOM 1531 CB VAL A 101 34.304 -4.635 0.903 1.00 0.00 C ATOM 1532 CG1 VAL A 101 34.795 -3.332 1.454 1.00 0.00 C ATOM 1533 CG2 VAL A 101 33.022 -4.407 0.090 1.00 0.00 C ATOM 0 H VAL A 101 34.670 -4.329 -1.582 1.00 0.00 H new ATOM 0 HA VAL A 101 36.362 -5.106 0.562 1.00 0.00 H new ATOM 0 HB VAL A 101 34.059 -5.310 1.723 1.00 0.00 H new ATOM 0 HG11 VAL A 101 34.003 -2.862 2.038 1.00 0.00 H new ATOM 0 HG12 VAL A 101 35.660 -3.510 2.093 1.00 0.00 H new ATOM 0 HG13 VAL A 101 35.079 -2.674 0.633 1.00 0.00 H new ATOM 0 HG21 VAL A 101 32.274 -3.924 0.718 1.00 0.00 H new ATOM 0 HG22 VAL A 101 33.243 -3.770 -0.766 1.00 0.00 H new ATOM 0 HG23 VAL A 101 32.638 -5.365 -0.260 1.00 0.00 H new ATOM 1543 N ARG A 102 34.232 -7.256 -0.782 1.00 0.00 N ATOM 1544 CA ARG A 102 33.913 -8.678 -0.979 1.00 0.00 C ATOM 1545 C ARG A 102 33.207 -9.270 0.253 1.00 0.00 C ATOM 1546 O ARG A 102 33.018 -8.563 1.226 1.00 0.00 O ATOM 1547 CB ARG A 102 35.174 -9.414 -1.436 1.00 0.00 C ATOM 1548 CG ARG A 102 35.599 -8.920 -2.804 1.00 0.00 C ATOM 1549 CD ARG A 102 37.070 -9.060 -3.051 1.00 0.00 C ATOM 1550 NE ARG A 102 37.874 -8.173 -2.189 1.00 0.00 N ATOM 1551 CZ ARG A 102 39.146 -8.374 -1.841 1.00 0.00 C ATOM 1552 NH1 ARG A 102 39.750 -9.518 -2.132 1.00 0.00 N ATOM 1553 NH2 ARG A 102 39.803 -7.421 -1.194 1.00 0.00 N ATOM 0 H ARG A 102 33.641 -6.629 -1.328 1.00 0.00 H new ATOM 0 HA ARG A 102 33.182 -8.805 -1.778 1.00 0.00 H new ATOM 0 HB2 ARG A 102 35.978 -9.255 -0.717 1.00 0.00 H new ATOM 0 HB3 ARG A 102 34.986 -10.487 -1.471 1.00 0.00 H new ATOM 0 HG2 ARG A 102 35.054 -9.474 -3.569 1.00 0.00 H new ATOM 0 HG3 ARG A 102 35.318 -7.872 -2.908 1.00 0.00 H new ATOM 0 HD2 ARG A 102 37.367 -10.095 -2.880 1.00 0.00 H new ATOM 0 HD3 ARG A 102 37.283 -8.836 -4.096 1.00 0.00 H new ATOM 0 HE ARG A 102 37.419 -7.335 -1.828 1.00 0.00 H new ATOM 0 HH11 ARG A 102 39.242 -10.252 -2.625 1.00 0.00 H new ATOM 0 HH12 ARG A 102 40.723 -9.664 -1.863 1.00 0.00 H new ATOM 0 HH21 ARG A 102 39.335 -6.543 -0.967 1.00 0.00 H new ATOM 0 HH22 ARG A 102 40.776 -7.566 -0.924 1.00 0.00 H new ATOM 1566 N PRO A 103 32.670 -10.498 0.206 1.00 0.00 N ATOM 1567 CA PRO A 103 32.034 -11.075 1.366 1.00 0.00 C ATOM 1568 C PRO A 103 32.957 -11.894 2.214 1.00 0.00 C ATOM 1569 O PRO A 103 34.095 -12.196 1.840 1.00 0.00 O ATOM 1570 CB PRO A 103 30.976 -12.019 0.792 1.00 0.00 C ATOM 1571 CG PRO A 103 31.229 -12.084 -0.689 1.00 0.00 C ATOM 1572 CD PRO A 103 32.548 -11.389 -0.950 1.00 0.00 C ATOM 0 HA PRO A 103 31.653 -10.278 2.005 1.00 0.00 H new ATOM 0 HB2 PRO A 103 31.051 -13.008 1.243 1.00 0.00 H new ATOM 0 HB3 PRO A 103 29.972 -11.650 0.999 1.00 0.00 H new ATOM 0 HG2 PRO A 103 31.266 -13.119 -1.028 1.00 0.00 H new ATOM 0 HG3 PRO A 103 30.423 -11.598 -1.238 1.00 0.00 H new ATOM 0 HD2 PRO A 103 33.375 -12.096 -1.006 1.00 0.00 H new ATOM 0 HD3 PRO A 103 32.537 -10.836 -1.889 1.00 0.00 H new ATOM 1580 N ASP A 104 32.451 -12.228 3.352 1.00 0.00 N ATOM 1581 CA ASP A 104 33.050 -13.187 4.225 1.00 0.00 C ATOM 1582 C ASP A 104 32.678 -14.552 3.645 1.00 0.00 C ATOM 1583 O ASP A 104 31.611 -14.679 3.008 1.00 0.00 O ATOM 1584 CB ASP A 104 32.430 -13.024 5.631 1.00 0.00 C ATOM 1585 CG ASP A 104 33.005 -13.956 6.678 1.00 0.00 C ATOM 1586 OD1 ASP A 104 32.788 -15.169 6.594 1.00 0.00 O ATOM 1587 OD2 ASP A 104 33.635 -13.479 7.639 1.00 0.00 O ATOM 0 H ASP A 104 31.584 -11.831 3.714 1.00 0.00 H new ATOM 0 HA ASP A 104 34.131 -13.069 4.307 1.00 0.00 H new ATOM 0 HB2 ASP A 104 32.572 -11.995 5.961 1.00 0.00 H new ATOM 0 HB3 ASP A 104 31.355 -13.192 5.563 1.00 0.00 H new ATOM 1592 N ALA A 105 33.516 -15.547 3.822 1.00 0.00 N ATOM 1593 CA ALA A 105 33.241 -16.893 3.320 1.00 0.00 C ATOM 1594 C ALA A 105 31.947 -17.472 3.903 1.00 0.00 C ATOM 1595 O ALA A 105 31.303 -18.300 3.286 1.00 0.00 O ATOM 1596 CB ALA A 105 34.411 -17.824 3.575 1.00 0.00 C ATOM 0 H ALA A 105 34.405 -15.458 4.314 1.00 0.00 H new ATOM 0 HA ALA A 105 33.102 -16.807 2.242 1.00 0.00 H new ATOM 0 HB1 ALA A 105 34.177 -18.817 3.191 1.00 0.00 H new ATOM 0 HB2 ALA A 105 35.298 -17.440 3.071 1.00 0.00 H new ATOM 0 HB3 ALA A 105 34.600 -17.885 4.647 1.00 0.00 H new ATOM 1602 N ASN A 106 31.560 -17.027 5.078 1.00 0.00 N ATOM 1603 CA ASN A 106 30.309 -17.470 5.686 1.00 0.00 C ATOM 1604 C ASN A 106 29.147 -16.713 5.081 1.00 0.00 C ATOM 1605 O ASN A 106 28.067 -17.259 4.921 1.00 0.00 O ATOM 1606 CB ASN A 106 30.316 -17.275 7.214 1.00 0.00 C ATOM 1607 CG ASN A 106 31.352 -18.115 7.955 1.00 0.00 C ATOM 1608 OD1 ASN A 106 30.956 -19.260 8.427 1.00 0.00 O flip ATOM 1609 ND2 ASN A 106 32.501 -17.714 8.131 1.00 0.00 N flip ATOM 0 H ASN A 106 32.089 -16.358 5.638 1.00 0.00 H new ATOM 0 HA ASN A 106 30.202 -18.536 5.485 1.00 0.00 H new ATOM 0 HB2 ASN A 106 30.497 -16.223 7.432 1.00 0.00 H new ATOM 0 HB3 ASN A 106 29.327 -17.516 7.603 1.00 0.00 H new ATOM 0 HD21 ASN A 106 32.790 -16.812 7.752 1.00 0.00 H new ATOM 0 HD22 ASN A 106 33.165 -18.283 8.656 1.00 0.00 H new ATOM 1616 N ALA A 107 29.397 -15.487 4.676 1.00 0.00 N ATOM 1617 CA ALA A 107 28.365 -14.644 4.106 1.00 0.00 C ATOM 1618 C ALA A 107 27.991 -15.101 2.710 1.00 0.00 C ATOM 1619 O ALA A 107 26.824 -15.177 2.373 1.00 0.00 O ATOM 1620 CB ALA A 107 28.802 -13.199 4.083 1.00 0.00 C ATOM 0 H ALA A 107 30.315 -15.047 4.731 1.00 0.00 H new ATOM 0 HA ALA A 107 27.483 -14.730 4.741 1.00 0.00 H new ATOM 0 HB1 ALA A 107 28.011 -12.586 3.651 1.00 0.00 H new ATOM 0 HB2 ALA A 107 29.006 -12.864 5.100 1.00 0.00 H new ATOM 0 HB3 ALA A 107 29.706 -13.102 3.481 1.00 0.00 H new ATOM 1626 N LYS A 108 28.985 -15.434 1.915 1.00 0.00 N ATOM 1627 CA LYS A 108 28.761 -15.894 0.540 1.00 0.00 C ATOM 1628 C LYS A 108 27.882 -17.182 0.525 1.00 0.00 C ATOM 1629 O LYS A 108 27.196 -17.459 -0.451 1.00 0.00 O ATOM 1630 CB LYS A 108 30.117 -16.136 -0.144 1.00 0.00 C ATOM 1631 CG LYS A 108 30.888 -17.349 0.364 1.00 0.00 C ATOM 1632 CD LYS A 108 32.265 -17.454 -0.274 1.00 0.00 C ATOM 1633 CE LYS A 108 32.178 -17.596 -1.781 1.00 0.00 C ATOM 1634 NZ LYS A 108 33.503 -17.708 -2.398 1.00 0.00 N ATOM 0 H LYS A 108 29.967 -15.398 2.190 1.00 0.00 H new ATOM 0 HA LYS A 108 28.221 -15.126 -0.014 1.00 0.00 H new ATOM 0 HB2 LYS A 108 29.951 -16.252 -1.215 1.00 0.00 H new ATOM 0 HB3 LYS A 108 30.737 -15.249 -0.012 1.00 0.00 H new ATOM 0 HG2 LYS A 108 30.994 -17.285 1.447 1.00 0.00 H new ATOM 0 HG3 LYS A 108 30.320 -18.255 0.153 1.00 0.00 H new ATOM 0 HD2 LYS A 108 32.849 -16.568 -0.026 1.00 0.00 H new ATOM 0 HD3 LYS A 108 32.794 -18.312 0.142 1.00 0.00 H new ATOM 0 HE2 LYS A 108 31.587 -18.478 -2.029 1.00 0.00 H new ATOM 0 HE3 LYS A 108 31.656 -16.735 -2.197 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 33.399 -17.803 -3.428 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 34.059 -16.856 -2.183 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 33.992 -18.545 -2.021 1.00 0.00 H new ATOM 1647 N ARG A 109 27.915 -17.923 1.643 1.00 0.00 N ATOM 1648 CA ARG A 109 27.155 -19.067 1.890 1.00 0.00 C ATOM 1649 C ARG A 109 25.743 -18.631 2.252 1.00 0.00 C ATOM 1650 O ARG A 109 24.759 -19.013 1.612 1.00 0.00 O ATOM 1651 CB ARG A 109 27.718 -19.663 3.143 1.00 0.00 C ATOM 1652 CG ARG A 109 29.035 -20.358 3.154 1.00 0.00 C ATOM 1653 CD ARG A 109 29.174 -21.091 4.494 1.00 0.00 C ATOM 1654 NE ARG A 109 28.670 -20.271 5.633 1.00 0.00 N ATOM 1655 CZ ARG A 109 28.535 -20.680 6.905 1.00 0.00 C ATOM 1656 NH1 ARG A 109 28.926 -21.894 7.283 1.00 0.00 N ATOM 1657 NH2 ARG A 109 28.012 -19.856 7.813 1.00 0.00 N ATOM 0 H ARG A 109 28.527 -17.688 2.424 1.00 0.00 H new ATOM 0 HA ARG A 109 27.162 -19.742 1.034 1.00 0.00 H new ATOM 0 HB2 ARG A 109 27.779 -18.859 3.876 1.00 0.00 H new ATOM 0 HB3 ARG A 109 26.981 -20.376 3.513 1.00 0.00 H new ATOM 0 HG2 ARG A 109 29.100 -21.063 2.325 1.00 0.00 H new ATOM 0 HG3 ARG A 109 29.845 -19.640 3.027 1.00 0.00 H new ATOM 0 HD2 ARG A 109 28.624 -22.031 4.452 1.00 0.00 H new ATOM 0 HD3 ARG A 109 30.221 -21.342 4.663 1.00 0.00 H new ATOM 0 HE ARG A 109 28.403 -19.309 5.426 1.00 0.00 H new ATOM 0 HH11 ARG A 109 29.337 -22.533 6.602 1.00 0.00 H new ATOM 0 HH12 ARG A 109 28.815 -22.186 8.254 1.00 0.00 H new ATOM 0 HH21 ARG A 109 27.716 -18.919 7.541 1.00 0.00 H new ATOM 0 HH22 ARG A 109 27.908 -20.163 8.780 1.00 0.00 H new ATOM 1670 N ALA A 110 25.692 -17.788 3.308 1.00 0.00 N ATOM 1671 CA ALA A 110 24.477 -17.270 3.903 1.00 0.00 C ATOM 1672 C ALA A 110 23.566 -16.715 2.874 1.00 0.00 C ATOM 1673 O ALA A 110 22.425 -17.092 2.831 1.00 0.00 O ATOM 1674 CB ALA A 110 24.810 -16.221 4.936 1.00 0.00 C ATOM 0 H ALA A 110 26.534 -17.449 3.772 1.00 0.00 H new ATOM 0 HA ALA A 110 23.961 -18.096 4.391 1.00 0.00 H new ATOM 0 HB1 ALA A 110 23.889 -15.839 5.376 1.00 0.00 H new ATOM 0 HB2 ALA A 110 25.429 -16.663 5.717 1.00 0.00 H new ATOM 0 HB3 ALA A 110 25.352 -15.403 4.462 1.00 0.00 H new ATOM 1680 N ALA A 111 24.123 -15.891 1.987 1.00 0.00 N ATOM 1681 CA ALA A 111 23.394 -15.256 0.887 1.00 0.00 C ATOM 1682 C ALA A 111 22.555 -16.255 0.137 1.00 0.00 C ATOM 1683 O ALA A 111 21.385 -16.029 -0.145 1.00 0.00 O ATOM 1684 CB ALA A 111 24.380 -14.612 -0.078 1.00 0.00 C ATOM 0 H ALA A 111 25.112 -15.641 2.012 1.00 0.00 H new ATOM 0 HA ALA A 111 22.735 -14.500 1.314 1.00 0.00 H new ATOM 0 HB1 ALA A 111 23.834 -14.141 -0.895 1.00 0.00 H new ATOM 0 HB2 ALA A 111 24.966 -13.859 0.449 1.00 0.00 H new ATOM 0 HB3 ALA A 111 25.047 -15.375 -0.480 1.00 0.00 H new ATOM 1690 N GLU A 112 23.121 -17.388 -0.103 1.00 0.00 N ATOM 1691 CA GLU A 112 22.489 -18.374 -0.922 1.00 0.00 C ATOM 1692 C GLU A 112 21.508 -19.243 -0.160 1.00 0.00 C ATOM 1693 O GLU A 112 20.570 -19.800 -0.738 1.00 0.00 O ATOM 1694 CB GLU A 112 23.513 -19.188 -1.653 1.00 0.00 C ATOM 1695 CG GLU A 112 24.263 -18.432 -2.726 1.00 0.00 C ATOM 1696 CD GLU A 112 25.190 -19.327 -3.496 1.00 0.00 C ATOM 1697 OE1 GLU A 112 24.724 -20.019 -4.423 1.00 0.00 O ATOM 1698 OE2 GLU A 112 26.396 -19.359 -3.199 1.00 0.00 O ATOM 0 H GLU A 112 24.034 -17.660 0.261 1.00 0.00 H new ATOM 0 HA GLU A 112 21.889 -17.839 -1.659 1.00 0.00 H new ATOM 0 HB2 GLU A 112 24.231 -19.579 -0.932 1.00 0.00 H new ATOM 0 HB3 GLU A 112 23.019 -20.046 -2.108 1.00 0.00 H new ATOM 0 HG2 GLU A 112 23.551 -17.971 -3.411 1.00 0.00 H new ATOM 0 HG3 GLU A 112 24.834 -17.624 -2.269 1.00 0.00 H new ATOM 1705 N SER A 113 21.702 -19.329 1.102 1.00 0.00 N ATOM 1706 CA SER A 113 20.797 -20.028 1.980 1.00 0.00 C ATOM 1707 C SER A 113 19.684 -19.038 2.371 1.00 0.00 C ATOM 1708 O SER A 113 18.708 -19.354 3.078 1.00 0.00 O ATOM 1709 CB SER A 113 21.614 -20.502 3.191 1.00 0.00 C ATOM 1710 OG SER A 113 20.830 -21.116 4.214 1.00 0.00 O ATOM 0 H SER A 113 22.503 -18.914 1.578 1.00 0.00 H new ATOM 0 HA SER A 113 20.332 -20.899 1.519 1.00 0.00 H new ATOM 0 HB2 SER A 113 22.370 -21.210 2.852 1.00 0.00 H new ATOM 0 HB3 SER A 113 22.144 -19.649 3.616 1.00 0.00 H new ATOM 0 HG SER A 113 21.413 -21.394 4.951 1.00 0.00 H new ATOM 1716 N GLU A 114 19.842 -17.845 1.863 1.00 0.00 N ATOM 1717 CA GLU A 114 18.985 -16.761 2.111 1.00 0.00 C ATOM 1718 C GLU A 114 18.375 -16.229 0.891 1.00 0.00 C ATOM 1719 O GLU A 114 17.803 -15.143 0.916 1.00 0.00 O ATOM 1720 CB GLU A 114 19.718 -15.704 2.830 1.00 0.00 C ATOM 1721 CG GLU A 114 19.805 -16.032 4.286 1.00 0.00 C ATOM 1722 CD GLU A 114 20.489 -15.035 5.169 1.00 0.00 C ATOM 1723 OE1 GLU A 114 21.717 -15.051 5.235 1.00 0.00 O ATOM 1724 OE2 GLU A 114 19.796 -14.309 5.910 1.00 0.00 O ATOM 0 H GLU A 114 20.614 -17.612 1.238 1.00 0.00 H new ATOM 0 HA GLU A 114 18.166 -17.127 2.730 1.00 0.00 H new ATOM 0 HB2 GLU A 114 20.720 -15.599 2.413 1.00 0.00 H new ATOM 0 HB3 GLU A 114 19.215 -14.747 2.695 1.00 0.00 H new ATOM 0 HG2 GLU A 114 18.792 -16.178 4.661 1.00 0.00 H new ATOM 0 HG3 GLU A 114 20.323 -16.986 4.388 1.00 0.00 H new ATOM 1731 N LYS A 115 18.488 -16.977 -0.200 1.00 0.00 N ATOM 1732 CA LYS A 115 17.820 -16.652 -1.403 1.00 0.00 C ATOM 1733 C LYS A 115 18.259 -15.314 -2.023 1.00 0.00 C ATOM 1734 O LYS A 115 17.615 -14.814 -2.958 1.00 0.00 O ATOM 1735 CB LYS A 115 16.356 -16.648 -1.071 1.00 0.00 C ATOM 1736 CG LYS A 115 15.716 -18.012 -0.971 1.00 0.00 C ATOM 1737 CD LYS A 115 14.275 -17.911 -0.491 1.00 0.00 C ATOM 1738 CE LYS A 115 13.632 -19.281 -0.364 1.00 0.00 C ATOM 1739 NZ LYS A 115 12.281 -19.209 0.230 1.00 0.00 N ATOM 0 H LYS A 115 19.053 -17.824 -0.251 1.00 0.00 H new ATOM 0 HA LYS A 115 18.069 -17.387 -2.168 1.00 0.00 H new ATOM 0 HB2 LYS A 115 16.216 -16.128 -0.123 1.00 0.00 H new ATOM 0 HB3 LYS A 115 15.829 -16.072 -1.831 1.00 0.00 H new ATOM 0 HG2 LYS A 115 15.744 -18.502 -1.944 1.00 0.00 H new ATOM 0 HG3 LYS A 115 16.288 -18.635 -0.284 1.00 0.00 H new ATOM 0 HD2 LYS A 115 14.247 -17.404 0.474 1.00 0.00 H new ATOM 0 HD3 LYS A 115 13.700 -17.302 -1.188 1.00 0.00 H new ATOM 0 HE2 LYS A 115 13.570 -19.744 -1.349 1.00 0.00 H new ATOM 0 HE3 LYS A 115 14.264 -19.922 0.251 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 11.880 -20.166 0.298 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 12.341 -18.791 1.180 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 11.669 -18.619 -0.369 1.00 0.00 H new ATOM 1752 N VAL A 116 19.347 -14.757 -1.552 1.00 0.00 N ATOM 1753 CA VAL A 116 19.777 -13.472 -2.042 1.00 0.00 C ATOM 1754 C VAL A 116 21.132 -13.519 -2.684 1.00 0.00 C ATOM 1755 O VAL A 116 22.040 -14.192 -2.224 1.00 0.00 O ATOM 1756 CB VAL A 116 19.707 -12.359 -0.975 1.00 0.00 C ATOM 1757 CG1 VAL A 116 18.266 -11.995 -0.691 1.00 0.00 C ATOM 1758 CG2 VAL A 116 20.389 -12.800 0.300 1.00 0.00 C ATOM 0 H VAL A 116 19.946 -15.169 -0.836 1.00 0.00 H new ATOM 0 HA VAL A 116 19.057 -13.212 -2.818 1.00 0.00 H new ATOM 0 HB VAL A 116 20.225 -11.481 -1.361 1.00 0.00 H new ATOM 0 HG11 VAL A 116 18.231 -11.209 0.063 1.00 0.00 H new ATOM 0 HG12 VAL A 116 17.793 -11.640 -1.607 1.00 0.00 H new ATOM 0 HG13 VAL A 116 17.734 -12.873 -0.325 1.00 0.00 H new ATOM 0 HG21 VAL A 116 20.329 -12.002 1.040 1.00 0.00 H new ATOM 0 HG22 VAL A 116 19.895 -13.691 0.687 1.00 0.00 H new ATOM 0 HG23 VAL A 116 21.435 -13.025 0.094 1.00 0.00 H new ATOM 1768 N ASP A 117 21.249 -12.833 -3.761 1.00 0.00 N ATOM 1769 CA ASP A 117 22.484 -12.766 -4.483 1.00 0.00 C ATOM 1770 C ASP A 117 23.211 -11.476 -4.146 1.00 0.00 C ATOM 1771 O ASP A 117 22.627 -10.383 -4.242 1.00 0.00 O ATOM 1772 CB ASP A 117 22.224 -12.875 -5.989 1.00 0.00 C ATOM 1773 CG ASP A 117 23.427 -12.520 -6.832 1.00 0.00 C ATOM 1774 OD1 ASP A 117 24.348 -13.343 -6.983 1.00 0.00 O ATOM 1775 OD2 ASP A 117 23.451 -11.410 -7.384 1.00 0.00 O ATOM 0 H ASP A 117 20.489 -12.294 -4.177 1.00 0.00 H new ATOM 0 HA ASP A 117 23.117 -13.603 -4.189 1.00 0.00 H new ATOM 0 HB2 ASP A 117 21.912 -13.893 -6.224 1.00 0.00 H new ATOM 0 HB3 ASP A 117 21.396 -12.218 -6.256 1.00 0.00 H new ATOM 1780 N ILE A 118 24.457 -11.589 -3.733 1.00 0.00 N ATOM 1781 CA ILE A 118 25.244 -10.429 -3.386 1.00 0.00 C ATOM 1782 C ILE A 118 26.076 -9.949 -4.568 1.00 0.00 C ATOM 1783 O ILE A 118 26.702 -10.739 -5.269 1.00 0.00 O ATOM 1784 CB ILE A 118 26.135 -10.695 -2.150 1.00 0.00 C ATOM 1785 CG1 ILE A 118 26.890 -12.034 -2.295 1.00 0.00 C ATOM 1786 CG2 ILE A 118 25.304 -10.653 -0.875 1.00 0.00 C ATOM 1787 CD1 ILE A 118 27.697 -12.424 -1.087 1.00 0.00 C ATOM 0 H ILE A 118 24.946 -12.478 -3.630 1.00 0.00 H new ATOM 0 HA ILE A 118 24.547 -9.633 -3.124 1.00 0.00 H new ATOM 0 HB ILE A 118 26.884 -9.905 -2.084 1.00 0.00 H new ATOM 0 HG12 ILE A 118 26.169 -12.823 -2.506 1.00 0.00 H new ATOM 0 HG13 ILE A 118 27.555 -11.971 -3.157 1.00 0.00 H new ATOM 0 HG21 ILE A 118 25.947 -10.842 -0.015 1.00 0.00 H new ATOM 0 HG22 ILE A 118 24.842 -9.671 -0.774 1.00 0.00 H new ATOM 0 HG23 ILE A 118 24.527 -11.416 -0.922 1.00 0.00 H new ATOM 0 HD11 ILE A 118 28.194 -13.376 -1.274 1.00 0.00 H new ATOM 0 HD12 ILE A 118 28.445 -11.657 -0.886 1.00 0.00 H new ATOM 0 HD13 ILE A 118 27.037 -12.522 -0.225 1.00 0.00 H new ATOM 1799 N ARG A 119 26.049 -8.655 -4.794 1.00 0.00 N ATOM 1800 CA ARG A 119 26.744 -8.051 -5.909 1.00 0.00 C ATOM 1801 C ARG A 119 28.064 -7.482 -5.466 1.00 0.00 C ATOM 1802 O ARG A 119 28.113 -6.635 -4.571 1.00 0.00 O ATOM 1803 CB ARG A 119 25.901 -6.946 -6.546 1.00 0.00 C ATOM 1804 CG ARG A 119 24.642 -7.404 -7.281 1.00 0.00 C ATOM 1805 CD ARG A 119 24.961 -8.274 -8.503 1.00 0.00 C ATOM 1806 NE ARG A 119 25.279 -9.668 -8.166 1.00 0.00 N ATOM 1807 CZ ARG A 119 26.241 -10.421 -8.716 1.00 0.00 C ATOM 1808 NH1 ARG A 119 27.188 -9.871 -9.491 1.00 0.00 N ATOM 1809 NH2 ARG A 119 26.268 -11.721 -8.454 1.00 0.00 N ATOM 0 H ARG A 119 25.543 -7.990 -4.209 1.00 0.00 H new ATOM 0 HA ARG A 119 26.920 -8.831 -6.650 1.00 0.00 H new ATOM 0 HB2 ARG A 119 25.607 -6.245 -5.765 1.00 0.00 H new ATOM 0 HB3 ARG A 119 26.528 -6.397 -7.248 1.00 0.00 H new ATOM 0 HG2 ARG A 119 24.008 -7.965 -6.595 1.00 0.00 H new ATOM 0 HG3 ARG A 119 24.073 -6.531 -7.599 1.00 0.00 H new ATOM 0 HD2 ARG A 119 24.108 -8.259 -9.182 1.00 0.00 H new ATOM 0 HD3 ARG A 119 25.804 -7.837 -9.039 1.00 0.00 H new ATOM 0 HE ARG A 119 24.711 -10.106 -7.441 1.00 0.00 H new ATOM 0 HH11 ARG A 119 27.182 -8.867 -9.668 1.00 0.00 H new ATOM 0 HH12 ARG A 119 27.914 -10.457 -9.903 1.00 0.00 H new ATOM 0 HH21 ARG A 119 25.563 -12.133 -7.842 1.00 0.00 H new ATOM 0 HH22 ARG A 119 26.993 -12.309 -8.864 1.00 0.00 H new ATOM 1822 N LEU A 120 29.124 -7.945 -6.074 1.00 0.00 N ATOM 1823 CA LEU A 120 30.459 -7.485 -5.765 1.00 0.00 C ATOM 1824 C LEU A 120 31.199 -7.075 -6.997 1.00 0.00 C ATOM 1825 O LEU A 120 30.785 -7.384 -8.115 1.00 0.00 O ATOM 1826 CB LEU A 120 31.301 -8.564 -5.054 1.00 0.00 C ATOM 1827 CG LEU A 120 31.189 -8.686 -3.537 1.00 0.00 C ATOM 1828 CD1 LEU A 120 31.455 -7.342 -2.893 1.00 0.00 C ATOM 1829 CD2 LEU A 120 29.855 -9.272 -3.093 1.00 0.00 C ATOM 0 H LEU A 120 29.089 -8.657 -6.803 1.00 0.00 H new ATOM 0 HA LEU A 120 30.324 -6.631 -5.102 1.00 0.00 H new ATOM 0 HB2 LEU A 120 31.037 -9.530 -5.486 1.00 0.00 H new ATOM 0 HB3 LEU A 120 32.348 -8.382 -5.296 1.00 0.00 H new ATOM 0 HG LEU A 120 31.948 -9.392 -3.201 1.00 0.00 H new ATOM 0 HD11 LEU A 120 31.374 -7.435 -1.810 1.00 0.00 H new ATOM 0 HD12 LEU A 120 32.458 -7.006 -3.154 1.00 0.00 H new ATOM 0 HD13 LEU A 120 30.725 -6.616 -3.251 1.00 0.00 H new ATOM 0 HD21 LEU A 120 29.830 -9.336 -2.005 1.00 0.00 H new ATOM 0 HD22 LEU A 120 29.043 -8.631 -3.438 1.00 0.00 H new ATOM 0 HD23 LEU A 120 29.736 -10.269 -3.518 1.00 0.00 H new ATOM 1841 N HIS A 121 32.286 -6.360 -6.784 1.00 0.00 N ATOM 1842 CA HIS A 121 33.235 -6.070 -7.836 1.00 0.00 C ATOM 1843 C HIS A 121 33.880 -7.401 -8.208 1.00 0.00 C ATOM 1844 O HIS A 121 34.373 -8.110 -7.331 1.00 0.00 O ATOM 1845 CB HIS A 121 34.298 -5.060 -7.342 1.00 0.00 C ATOM 1846 CG HIS A 121 35.386 -4.715 -8.337 1.00 0.00 C ATOM 1847 ND1 HIS A 121 36.696 -5.105 -8.183 1.00 0.00 N ATOM 1848 CD2 HIS A 121 35.354 -3.983 -9.474 1.00 0.00 C ATOM 1849 CE1 HIS A 121 37.416 -4.637 -9.177 1.00 0.00 C ATOM 1850 NE2 HIS A 121 36.626 -3.956 -9.973 1.00 0.00 N ATOM 0 H HIS A 121 32.534 -5.965 -5.877 1.00 0.00 H new ATOM 0 HA HIS A 121 32.747 -5.618 -8.699 1.00 0.00 H new ATOM 0 HB2 HIS A 121 33.791 -4.140 -7.052 1.00 0.00 H new ATOM 0 HB3 HIS A 121 34.766 -5.463 -6.444 1.00 0.00 H new ATOM 0 HD2 HIS A 121 34.486 -3.509 -9.907 1.00 0.00 H new ATOM 0 HE1 HIS A 121 38.477 -4.787 -9.315 1.00 0.00 H new ATOM 0 HE2 HIS A 121 36.915 -3.482 -10.828 1.00 0.00 H new ATOM 1858 N ARG A 122 33.834 -7.730 -9.469 1.00 0.00 N ATOM 1859 CA ARG A 122 34.284 -9.021 -9.980 1.00 0.00 C ATOM 1860 C ARG A 122 35.785 -9.246 -9.774 1.00 0.00 C ATOM 1861 O ARG A 122 36.595 -8.316 -9.903 1.00 0.00 O ATOM 1862 CB ARG A 122 33.955 -9.133 -11.474 1.00 0.00 C ATOM 1863 CG ARG A 122 32.474 -9.005 -11.819 1.00 0.00 C ATOM 1864 CD ARG A 122 32.274 -9.029 -13.325 1.00 0.00 C ATOM 1865 NE ARG A 122 30.870 -8.856 -13.728 1.00 0.00 N ATOM 1866 CZ ARG A 122 30.468 -8.584 -14.979 1.00 0.00 C ATOM 1867 NH1 ARG A 122 31.366 -8.377 -15.942 1.00 0.00 N ATOM 1868 NH2 ARG A 122 29.170 -8.500 -15.258 1.00 0.00 N ATOM 0 H ARG A 122 33.479 -7.106 -10.194 1.00 0.00 H new ATOM 0 HA ARG A 122 33.756 -9.789 -9.415 1.00 0.00 H new ATOM 0 HB2 ARG A 122 34.506 -8.361 -12.011 1.00 0.00 H new ATOM 0 HB3 ARG A 122 34.316 -10.094 -11.839 1.00 0.00 H new ATOM 0 HG2 ARG A 122 31.916 -9.820 -11.359 1.00 0.00 H new ATOM 0 HG3 ARG A 122 32.078 -8.076 -11.408 1.00 0.00 H new ATOM 0 HD2 ARG A 122 32.874 -8.240 -13.777 1.00 0.00 H new ATOM 0 HD3 ARG A 122 32.644 -9.976 -13.719 1.00 0.00 H new ATOM 0 HE ARG A 122 30.154 -8.949 -13.008 1.00 0.00 H new ATOM 0 HH11 ARG A 122 32.362 -8.425 -15.729 1.00 0.00 H new ATOM 0 HH12 ARG A 122 31.057 -8.171 -16.892 1.00 0.00 H new ATOM 0 HH21 ARG A 122 28.480 -8.642 -14.521 1.00 0.00 H new ATOM 0 HH22 ARG A 122 28.865 -8.293 -16.209 1.00 0.00 H new ATOM 1881 N ILE A 123 36.133 -10.465 -9.425 1.00 0.00 N ATOM 1882 CA ILE A 123 37.513 -10.886 -9.321 1.00 0.00 C ATOM 1883 C ILE A 123 37.671 -12.005 -10.324 1.00 0.00 C ATOM 1884 O ILE A 123 36.935 -12.994 -10.258 1.00 0.00 O ATOM 1885 CB ILE A 123 37.909 -11.468 -7.905 1.00 0.00 C ATOM 1886 CG1 ILE A 123 37.578 -10.519 -6.739 1.00 0.00 C ATOM 1887 CG2 ILE A 123 39.392 -11.834 -7.864 1.00 0.00 C ATOM 1888 CD1 ILE A 123 36.126 -10.535 -6.312 1.00 0.00 C ATOM 0 H ILE A 123 35.460 -11.199 -9.203 1.00 0.00 H new ATOM 0 HA ILE A 123 38.149 -10.017 -9.491 1.00 0.00 H new ATOM 0 HB ILE A 123 37.302 -12.363 -7.771 1.00 0.00 H new ATOM 0 HG12 ILE A 123 38.199 -10.785 -5.883 1.00 0.00 H new ATOM 0 HG13 ILE A 123 37.848 -9.503 -7.026 1.00 0.00 H new ATOM 0 HG21 ILE A 123 39.641 -12.232 -6.880 1.00 0.00 H new ATOM 0 HG22 ILE A 123 39.602 -12.586 -8.624 1.00 0.00 H new ATOM 0 HG23 ILE A 123 39.992 -10.945 -8.058 1.00 0.00 H new ATOM 0 HD11 ILE A 123 35.982 -9.838 -5.486 1.00 0.00 H new ATOM 0 HD12 ILE A 123 35.497 -10.238 -7.151 1.00 0.00 H new ATOM 0 HD13 ILE A 123 35.852 -11.540 -5.991 1.00 0.00 H new ATOM 1900 N ILE A 124 38.555 -11.860 -11.266 1.00 0.00 N ATOM 1901 CA ILE A 124 38.756 -12.909 -12.228 1.00 0.00 C ATOM 1902 C ILE A 124 39.881 -13.814 -11.750 1.00 0.00 C ATOM 1903 O ILE A 124 41.058 -13.505 -11.935 1.00 0.00 O ATOM 1904 CB ILE A 124 39.053 -12.355 -13.646 1.00 0.00 C ATOM 1905 CG1 ILE A 124 37.917 -11.409 -14.080 1.00 0.00 C ATOM 1906 CG2 ILE A 124 39.193 -13.505 -14.644 1.00 0.00 C ATOM 1907 CD1 ILE A 124 38.138 -10.732 -15.414 1.00 0.00 C ATOM 0 H ILE A 124 39.144 -11.037 -11.391 1.00 0.00 H new ATOM 0 HA ILE A 124 37.833 -13.483 -12.309 1.00 0.00 H new ATOM 0 HB ILE A 124 39.991 -11.800 -13.623 1.00 0.00 H new ATOM 0 HG12 ILE A 124 36.987 -11.976 -14.124 1.00 0.00 H new ATOM 0 HG13 ILE A 124 37.787 -10.643 -13.315 1.00 0.00 H new ATOM 0 HG21 ILE A 124 39.401 -13.103 -15.636 1.00 0.00 H new ATOM 0 HG22 ILE A 124 40.012 -14.156 -14.337 1.00 0.00 H new ATOM 0 HG23 ILE A 124 38.266 -14.077 -14.672 1.00 0.00 H new ATOM 0 HD11 ILE A 124 37.290 -10.086 -15.639 1.00 0.00 H new ATOM 0 HD12 ILE A 124 39.049 -10.134 -15.372 1.00 0.00 H new ATOM 0 HD13 ILE A 124 38.235 -11.487 -16.194 1.00 0.00 H new ATOM 1919 N TYR A 125 39.492 -14.889 -11.069 1.00 0.00 N ATOM 1920 CA TYR A 125 40.390 -15.891 -10.470 1.00 0.00 C ATOM 1921 C TYR A 125 41.161 -15.284 -9.285 1.00 0.00 C ATOM 1922 O TYR A 125 40.746 -15.408 -8.134 1.00 0.00 O ATOM 1923 CB TYR A 125 41.362 -16.523 -11.494 1.00 0.00 C ATOM 1924 CG TYR A 125 40.713 -17.113 -12.732 1.00 0.00 C ATOM 1925 CD1 TYR A 125 39.774 -18.132 -12.644 1.00 0.00 C ATOM 1926 CD2 TYR A 125 41.075 -16.663 -13.995 1.00 0.00 C ATOM 1927 CE1 TYR A 125 39.211 -18.681 -13.784 1.00 0.00 C ATOM 1928 CE2 TYR A 125 40.515 -17.201 -15.131 1.00 0.00 C ATOM 1929 CZ TYR A 125 39.590 -18.208 -15.025 1.00 0.00 C ATOM 1930 OH TYR A 125 39.043 -18.754 -16.168 1.00 0.00 O ATOM 0 H TYR A 125 38.507 -15.100 -10.909 1.00 0.00 H new ATOM 0 HA TYR A 125 39.758 -16.701 -10.107 1.00 0.00 H new ATOM 0 HB2 TYR A 125 42.077 -15.762 -11.807 1.00 0.00 H new ATOM 0 HB3 TYR A 125 41.930 -17.307 -10.994 1.00 0.00 H new ATOM 0 HD1 TYR A 125 39.479 -18.502 -11.673 1.00 0.00 H new ATOM 0 HD2 TYR A 125 41.809 -15.877 -14.087 1.00 0.00 H new ATOM 0 HE1 TYR A 125 38.481 -19.473 -13.703 1.00 0.00 H new ATOM 0 HE2 TYR A 125 40.803 -16.831 -16.104 1.00 0.00 H new ATOM 0 HH TYR A 125 39.417 -18.306 -16.956 1.00 0.00 H new ATOM 1940 N ASN A 126 42.241 -14.594 -9.592 1.00 0.00 N ATOM 1941 CA ASN A 126 43.092 -13.895 -8.630 1.00 0.00 C ATOM 1942 C ASN A 126 43.676 -12.722 -9.340 1.00 0.00 C ATOM 1943 O ASN A 126 43.967 -12.812 -10.532 1.00 0.00 O ATOM 1944 CB ASN A 126 44.279 -14.753 -8.120 1.00 0.00 C ATOM 1945 CG ASN A 126 43.924 -15.858 -7.144 1.00 0.00 C ATOM 1946 OD1 ASN A 126 42.982 -15.755 -6.368 1.00 0.00 O ATOM 1947 ND2 ASN A 126 44.687 -16.924 -7.169 1.00 0.00 N ATOM 0 H ASN A 126 42.569 -14.497 -10.553 1.00 0.00 H new ATOM 0 HA ASN A 126 42.477 -13.634 -7.769 1.00 0.00 H new ATOM 0 HB2 ASN A 126 44.776 -15.200 -8.981 1.00 0.00 H new ATOM 0 HB3 ASN A 126 45.002 -14.091 -7.643 1.00 0.00 H new ATOM 0 HD21 ASN A 126 44.503 -17.698 -6.530 1.00 0.00 H new ATOM 0 HD22 ASN A 126 45.464 -16.980 -7.827 1.00 0.00 H new ATOM 1954 N VAL A 127 43.835 -11.634 -8.656 1.00 0.00 N ATOM 1955 CA VAL A 127 44.460 -10.464 -9.237 1.00 0.00 C ATOM 1956 C VAL A 127 45.947 -10.534 -8.905 1.00 0.00 C ATOM 1957 O VAL A 127 46.348 -11.390 -8.098 1.00 0.00 O ATOM 1958 CB VAL A 127 43.846 -9.144 -8.657 1.00 0.00 C ATOM 1959 CG1 VAL A 127 42.338 -9.109 -8.874 1.00 0.00 C ATOM 1960 CG2 VAL A 127 44.166 -8.974 -7.173 1.00 0.00 C ATOM 0 H VAL A 127 43.542 -11.520 -7.686 1.00 0.00 H new ATOM 0 HA VAL A 127 44.295 -10.451 -10.314 1.00 0.00 H new ATOM 0 HB VAL A 127 44.302 -8.313 -9.196 1.00 0.00 H new ATOM 0 HG11 VAL A 127 41.933 -8.184 -8.464 1.00 0.00 H new ATOM 0 HG12 VAL A 127 42.123 -9.157 -9.941 1.00 0.00 H new ATOM 0 HG13 VAL A 127 41.878 -9.961 -8.372 1.00 0.00 H new ATOM 0 HG21 VAL A 127 43.723 -8.047 -6.809 1.00 0.00 H new ATOM 0 HG22 VAL A 127 43.757 -9.816 -6.614 1.00 0.00 H new ATOM 0 HG23 VAL A 127 45.247 -8.938 -7.036 1.00 0.00 H new ATOM 1970 N ILE A 128 46.779 -9.700 -9.510 1.00 0.00 N ATOM 1971 CA ILE A 128 48.167 -9.668 -9.093 1.00 0.00 C ATOM 1972 C ILE A 128 48.285 -8.864 -7.804 1.00 0.00 C ATOM 1973 O ILE A 128 48.505 -7.659 -7.796 1.00 0.00 O ATOM 1974 CB ILE A 128 49.195 -9.212 -10.189 1.00 0.00 C ATOM 1975 CG1 ILE A 128 48.850 -7.832 -10.789 1.00 0.00 C ATOM 1976 CG2 ILE A 128 49.298 -10.270 -11.284 1.00 0.00 C ATOM 1977 CD1 ILE A 128 49.877 -7.311 -11.778 1.00 0.00 C ATOM 0 H ILE A 128 46.529 -9.060 -10.263 1.00 0.00 H new ATOM 0 HA ILE A 128 48.460 -10.702 -8.912 1.00 0.00 H new ATOM 0 HB ILE A 128 50.164 -9.105 -9.701 1.00 0.00 H new ATOM 0 HG12 ILE A 128 47.882 -7.896 -11.287 1.00 0.00 H new ATOM 0 HG13 ILE A 128 48.744 -7.111 -9.978 1.00 0.00 H new ATOM 0 HG21 ILE A 128 50.013 -9.944 -12.039 1.00 0.00 H new ATOM 0 HG22 ILE A 128 49.633 -11.212 -10.850 1.00 0.00 H new ATOM 0 HG23 ILE A 128 48.321 -10.411 -11.747 1.00 0.00 H new ATOM 0 HD11 ILE A 128 49.560 -6.338 -12.153 1.00 0.00 H new ATOM 0 HD12 ILE A 128 50.842 -7.212 -11.282 1.00 0.00 H new ATOM 0 HD13 ILE A 128 49.967 -8.009 -12.611 1.00 0.00 H new ATOM 1989 N GLU A 129 48.060 -9.562 -6.723 1.00 0.00 N ATOM 1990 CA GLU A 129 47.993 -9.014 -5.384 1.00 0.00 C ATOM 1991 C GLU A 129 49.399 -9.024 -4.751 1.00 0.00 C ATOM 1992 O GLU A 129 49.589 -8.722 -3.571 1.00 0.00 O ATOM 1993 CB GLU A 129 46.981 -9.879 -4.618 1.00 0.00 C ATOM 1994 CG GLU A 129 46.543 -9.395 -3.257 1.00 0.00 C ATOM 1995 CD GLU A 129 45.427 -10.257 -2.721 1.00 0.00 C ATOM 1996 OE1 GLU A 129 45.703 -11.320 -2.134 1.00 0.00 O ATOM 1997 OE2 GLU A 129 44.240 -9.908 -2.914 1.00 0.00 O ATOM 0 H GLU A 129 47.911 -10.571 -6.747 1.00 0.00 H new ATOM 0 HA GLU A 129 47.665 -7.975 -5.367 1.00 0.00 H new ATOM 0 HB2 GLU A 129 46.092 -9.987 -5.239 1.00 0.00 H new ATOM 0 HB3 GLU A 129 47.410 -10.874 -4.500 1.00 0.00 H new ATOM 0 HG2 GLU A 129 47.388 -9.415 -2.569 1.00 0.00 H new ATOM 0 HG3 GLU A 129 46.210 -8.359 -3.323 1.00 0.00 H new ATOM 2004 N GLU A 130 50.361 -9.354 -5.582 1.00 0.00 N ATOM 2005 CA GLU A 130 51.764 -9.380 -5.242 1.00 0.00 C ATOM 2006 C GLU A 130 52.247 -7.937 -5.047 1.00 0.00 C ATOM 2007 O GLU A 130 52.078 -7.090 -5.942 1.00 0.00 O ATOM 2008 CB GLU A 130 52.515 -10.066 -6.395 1.00 0.00 C ATOM 2009 CG GLU A 130 54.014 -10.201 -6.221 1.00 0.00 C ATOM 2010 CD GLU A 130 54.644 -10.899 -7.395 1.00 0.00 C ATOM 2011 OE1 GLU A 130 54.911 -10.243 -8.417 1.00 0.00 O ATOM 2012 OE2 GLU A 130 54.878 -12.119 -7.329 1.00 0.00 O ATOM 0 H GLU A 130 50.180 -9.622 -6.550 1.00 0.00 H new ATOM 0 HA GLU A 130 51.945 -9.931 -4.319 1.00 0.00 H new ATOM 0 HB2 GLU A 130 52.094 -11.062 -6.536 1.00 0.00 H new ATOM 0 HB3 GLU A 130 52.324 -9.507 -7.311 1.00 0.00 H new ATOM 0 HG2 GLU A 130 54.458 -9.213 -6.103 1.00 0.00 H new ATOM 0 HG3 GLU A 130 54.227 -10.758 -5.308 1.00 0.00 H new ATOM 2019 N ILE A 131 52.821 -7.649 -3.892 1.00 0.00 N ATOM 2020 CA ILE A 131 53.245 -6.295 -3.588 1.00 0.00 C ATOM 2021 C ILE A 131 54.492 -5.896 -4.372 1.00 0.00 C ATOM 2022 O ILE A 131 54.494 -4.878 -5.076 1.00 0.00 O ATOM 2023 CB ILE A 131 53.420 -6.013 -2.051 1.00 0.00 C ATOM 2024 CG1 ILE A 131 53.977 -4.590 -1.820 1.00 0.00 C ATOM 2025 CG2 ILE A 131 54.287 -7.068 -1.364 1.00 0.00 C ATOM 2026 CD1 ILE A 131 54.173 -4.217 -0.369 1.00 0.00 C ATOM 0 H ILE A 131 53.003 -8.330 -3.154 1.00 0.00 H new ATOM 0 HA ILE A 131 52.423 -5.659 -3.916 1.00 0.00 H new ATOM 0 HB ILE A 131 52.433 -6.075 -1.593 1.00 0.00 H new ATOM 0 HG12 ILE A 131 54.933 -4.500 -2.336 1.00 0.00 H new ATOM 0 HG13 ILE A 131 53.298 -3.870 -2.278 1.00 0.00 H new ATOM 0 HG21 ILE A 131 54.379 -6.830 -0.304 1.00 0.00 H new ATOM 0 HG22 ILE A 131 53.825 -8.049 -1.477 1.00 0.00 H new ATOM 0 HG23 ILE A 131 55.277 -7.079 -1.820 1.00 0.00 H new ATOM 0 HD11 ILE A 131 54.567 -3.203 -0.304 1.00 0.00 H new ATOM 0 HD12 ILE A 131 53.217 -4.270 0.152 1.00 0.00 H new ATOM 0 HD13 ILE A 131 54.877 -4.909 0.093 1.00 0.00 H new ATOM 2038 N GLU A 132 55.533 -6.693 -4.310 1.00 0.00 N ATOM 2039 CA GLU A 132 56.737 -6.341 -5.013 1.00 0.00 C ATOM 2040 C GLU A 132 56.767 -6.916 -6.415 1.00 0.00 C ATOM 2041 O GLU A 132 57.490 -7.867 -6.740 1.00 0.00 O ATOM 2042 CB GLU A 132 58.010 -6.580 -4.208 1.00 0.00 C ATOM 2043 CG GLU A 132 58.203 -7.984 -3.689 1.00 0.00 C ATOM 2044 CD GLU A 132 59.473 -8.090 -2.910 1.00 0.00 C ATOM 2045 OE1 GLU A 132 60.550 -8.208 -3.530 1.00 0.00 O ATOM 2046 OE2 GLU A 132 59.424 -8.007 -1.666 1.00 0.00 O ATOM 0 H GLU A 132 55.569 -7.570 -3.791 1.00 0.00 H new ATOM 0 HA GLU A 132 56.713 -5.259 -5.140 1.00 0.00 H new ATOM 0 HB2 GLU A 132 58.866 -6.322 -4.832 1.00 0.00 H new ATOM 0 HB3 GLU A 132 58.016 -5.895 -3.360 1.00 0.00 H new ATOM 0 HG2 GLU A 132 57.359 -8.263 -3.058 1.00 0.00 H new ATOM 0 HG3 GLU A 132 58.223 -8.686 -4.523 1.00 0.00 H new ATOM 2053 N ALA A 133 55.911 -6.344 -7.217 1.00 0.00 N ATOM 2054 CA ALA A 133 55.733 -6.701 -8.599 1.00 0.00 C ATOM 2055 C ALA A 133 56.130 -5.515 -9.457 1.00 0.00 C ATOM 2056 O ALA A 133 55.735 -5.387 -10.619 1.00 0.00 O ATOM 2057 CB ALA A 133 54.274 -7.056 -8.824 1.00 0.00 C ATOM 0 H ALA A 133 55.295 -5.589 -6.915 1.00 0.00 H new ATOM 0 HA ALA A 133 56.352 -7.558 -8.865 1.00 0.00 H new ATOM 0 HB1 ALA A 133 54.123 -7.329 -9.868 1.00 0.00 H new ATOM 0 HB2 ALA A 133 54.002 -7.897 -8.186 1.00 0.00 H new ATOM 0 HB3 ALA A 133 53.649 -6.197 -8.579 1.00 0.00 H new ATOM 2063 N ALA A 134 56.919 -4.649 -8.872 1.00 0.00 N ATOM 2064 CA ALA A 134 57.358 -3.456 -9.530 1.00 0.00 C ATOM 2065 C ALA A 134 58.847 -3.530 -9.813 1.00 0.00 C ATOM 2066 O ALA A 134 59.680 -3.061 -9.014 1.00 0.00 O ATOM 2067 CB ALA A 134 57.011 -2.228 -8.709 1.00 0.00 C ATOM 0 H ALA A 134 57.273 -4.757 -7.922 1.00 0.00 H new ATOM 0 HA ALA A 134 56.836 -3.371 -10.483 1.00 0.00 H new ATOM 0 HB1 ALA A 134 57.354 -1.334 -9.229 1.00 0.00 H new ATOM 0 HB2 ALA A 134 55.931 -2.176 -8.571 1.00 0.00 H new ATOM 0 HB3 ALA A 134 57.498 -2.291 -7.736 1.00 0.00 H new ATOM 2073 N MET A 135 59.169 -4.202 -10.883 1.00 0.00 N ATOM 2074 CA MET A 135 60.524 -4.374 -11.354 1.00 0.00 C ATOM 2075 C MET A 135 60.453 -4.936 -12.745 1.00 0.00 C ATOM 2076 CB MET A 135 61.342 -5.309 -10.441 1.00 0.00 C ATOM 2077 CG MET A 135 62.779 -5.533 -10.909 1.00 0.00 C ATOM 2078 SD MET A 135 63.726 -3.993 -11.081 1.00 0.00 S ATOM 2079 CE MET A 135 63.653 -3.351 -9.413 1.00 0.00 C ATOM 0 H MET A 135 58.476 -4.662 -11.474 1.00 0.00 H new ATOM 0 HA MET A 135 61.033 -3.410 -11.345 1.00 0.00 H new ATOM 0 HB2 MET A 135 61.359 -4.893 -9.434 1.00 0.00 H new ATOM 0 HB3 MET A 135 60.837 -6.273 -10.379 1.00 0.00 H new ATOM 0 HG2 MET A 135 63.287 -6.187 -10.200 1.00 0.00 H new ATOM 0 HG3 MET A 135 62.765 -6.052 -11.867 1.00 0.00 H new ATOM 0 HE1 MET A 135 64.385 -2.552 -9.298 1.00 0.00 H new ATOM 0 HE2 MET A 135 62.655 -2.959 -9.217 1.00 0.00 H new ATOM 0 HE3 MET A 135 63.874 -4.150 -8.706 1.00 0.00 H new TER 2089 MET A 135