USER MOD reduce.3.24.130724 H: found=0, std=0, add=810, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 805 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 86 THR OG1 : rot 160:sc= 0.36 USER MOD Set 1.2: A 91 GLN : amide:sc= 0.389 X(o=0.75,f=0.79) USER MOD Set 2.1: A 42 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 44 GLN : amide:sc= -1.29 K(o=-1.3,f=-7.9!) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= -0.122 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 11 HIS : no HD1:sc= -3.48 K(o=-3.5,f=-4.5!) USER MOD Single : A 14 GLN : amide:sc= -0.917 K(o=-0.92,f=-6.7!) USER MOD Single : A 20 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 CYS SG : rot 180:sc= -0.07 USER MOD Single : A 29 MET CE :methyl 172:sc= 0 (180deg=-0.0702) USER MOD Single : A 31 CYS SG : rot -37:sc= 1.27 USER MOD Single : A 32 LYS NZ :NH3+ -163:sc= 0 (180deg=-0.111) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 38 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ 142:sc= -0.257 (180deg=-1.96!) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 56 HIS : no HD1:sc= -0.0172 K(o=-0.017,f=-0.56) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 MET CE :methyl -152:sc= -1.7 (180deg=-3.21!) USER MOD Single : A 63 ASN : amide:sc= -0.115 K(o=-0.11,f=-0.94) USER MOD Single : A 66 HIS : no HD1:sc= 0 X(o=0,f=-0.017) USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 74 THR OG1 : rot 180:sc= -0.0238 USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 81 TYR OH : rot -31:sc= 0.133 USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 CYS SG : rot 121:sc= -4.9! USER MOD Single : A 87 ASN : amide:sc= -4.71! C(o=-4.7!,f=-22!) USER MOD Single : A 92 ASN : amide:sc= -2.61! C(o=-2.6!,f=-5.1!) USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 95 SER OG : rot 180:sc= 0 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc=-0.00776 (180deg=-0.00776) USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot -54:sc= 0.312 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 19.061 26.517 -9.496 1.00 0.00 N ATOM 2 CA GLY A 1 17.641 26.816 -9.472 1.00 0.00 C ATOM 3 C GLY A 1 17.038 26.658 -8.090 1.00 0.00 C ATOM 4 O GLY A 1 17.327 25.691 -7.386 1.00 0.00 O ATOM 0 H1 GLY A 1 19.425 26.640 -10.462 1.00 0.00 H new ATOM 0 H2 GLY A 1 19.562 27.162 -8.852 1.00 0.00 H new ATOM 0 H3 GLY A 1 19.214 25.535 -9.190 1.00 0.00 H new ATOM 0 HA2 GLY A 1 17.482 27.837 -9.820 1.00 0.00 H new ATOM 0 HA3 GLY A 1 17.122 26.157 -10.169 1.00 0.00 H new ATOM 8 N SER A 2 16.199 27.612 -7.700 1.00 0.00 N ATOM 9 CA SER A 2 15.558 27.578 -6.390 1.00 0.00 C ATOM 10 C SER A 2 14.109 28.047 -6.482 1.00 0.00 C ATOM 11 O SER A 2 13.702 28.649 -7.475 1.00 0.00 O ATOM 12 CB SER A 2 16.328 28.454 -5.400 1.00 0.00 C ATOM 13 OG SER A 2 16.217 29.826 -5.738 1.00 0.00 O ATOM 0 H SER A 2 15.947 28.418 -8.272 1.00 0.00 H new ATOM 0 HA SER A 2 15.566 26.547 -6.035 1.00 0.00 H new ATOM 0 HB2 SER A 2 15.945 28.292 -4.392 1.00 0.00 H new ATOM 0 HB3 SER A 2 17.378 28.162 -5.392 1.00 0.00 H new ATOM 0 HG SER A 2 16.716 30.364 -5.089 1.00 0.00 H new ATOM 19 N SER A 3 13.336 27.766 -5.438 1.00 0.00 N ATOM 20 CA SER A 3 11.931 28.155 -5.401 1.00 0.00 C ATOM 21 C SER A 3 11.425 28.225 -3.964 1.00 0.00 C ATOM 22 O SER A 3 12.097 27.781 -3.034 1.00 0.00 O ATOM 23 CB SER A 3 11.085 27.166 -6.204 1.00 0.00 C ATOM 24 OG SER A 3 9.750 27.623 -6.332 1.00 0.00 O ATOM 0 H SER A 3 13.659 27.271 -4.607 1.00 0.00 H new ATOM 0 HA SER A 3 11.841 29.145 -5.848 1.00 0.00 H new ATOM 0 HB2 SER A 3 11.522 27.028 -7.193 1.00 0.00 H new ATOM 0 HB3 SER A 3 11.094 26.193 -5.713 1.00 0.00 H new ATOM 0 HG SER A 3 9.230 26.974 -6.851 1.00 0.00 H new ATOM 30 N GLY A 4 10.233 28.788 -3.790 1.00 0.00 N ATOM 31 CA GLY A 4 9.655 28.908 -2.463 1.00 0.00 C ATOM 32 C GLY A 4 8.140 28.914 -2.490 1.00 0.00 C ATOM 33 O GLY A 4 7.507 29.841 -1.984 1.00 0.00 O ATOM 0 H GLY A 4 9.657 29.163 -4.544 1.00 0.00 H new ATOM 0 HA2 GLY A 4 10.001 28.081 -1.843 1.00 0.00 H new ATOM 0 HA3 GLY A 4 10.011 29.827 -1.997 1.00 0.00 H new ATOM 37 N SER A 5 7.555 27.878 -3.082 1.00 0.00 N ATOM 38 CA SER A 5 6.104 27.770 -3.177 1.00 0.00 C ATOM 39 C SER A 5 5.517 27.189 -1.894 1.00 0.00 C ATOM 40 O SER A 5 6.140 26.358 -1.234 1.00 0.00 O ATOM 41 CB SER A 5 5.713 26.897 -4.371 1.00 0.00 C ATOM 42 OG SER A 5 4.426 27.239 -4.854 1.00 0.00 O ATOM 0 H SER A 5 8.064 27.101 -3.503 1.00 0.00 H new ATOM 0 HA SER A 5 5.699 28.772 -3.320 1.00 0.00 H new ATOM 0 HB2 SER A 5 6.447 27.016 -5.168 1.00 0.00 H new ATOM 0 HB3 SER A 5 5.728 25.847 -4.078 1.00 0.00 H new ATOM 0 HG SER A 5 4.201 26.668 -5.618 1.00 0.00 H new ATOM 48 N SER A 6 4.313 27.634 -1.548 1.00 0.00 N ATOM 49 CA SER A 6 3.642 27.163 -0.342 1.00 0.00 C ATOM 50 C SER A 6 3.559 25.639 -0.327 1.00 0.00 C ATOM 51 O SER A 6 3.989 24.974 -1.268 1.00 0.00 O ATOM 52 CB SER A 6 2.238 27.763 -0.246 1.00 0.00 C ATOM 53 OG SER A 6 2.257 28.996 0.451 1.00 0.00 O ATOM 0 H SER A 6 3.783 28.320 -2.086 1.00 0.00 H new ATOM 0 HA SER A 6 4.227 27.486 0.519 1.00 0.00 H new ATOM 0 HB2 SER A 6 1.834 27.914 -1.247 1.00 0.00 H new ATOM 0 HB3 SER A 6 1.574 27.064 0.263 1.00 0.00 H new ATOM 0 HG SER A 6 1.348 29.360 0.497 1.00 0.00 H new ATOM 59 N GLY A 7 3.001 25.094 0.749 1.00 0.00 N ATOM 60 CA GLY A 7 2.870 23.653 0.868 1.00 0.00 C ATOM 61 C GLY A 7 4.211 22.947 0.864 1.00 0.00 C ATOM 62 O GLY A 7 5.250 23.573 0.647 1.00 0.00 O ATOM 0 H GLY A 7 2.637 25.624 1.541 1.00 0.00 H new ATOM 0 HA2 GLY A 7 2.340 23.414 1.790 1.00 0.00 H new ATOM 0 HA3 GLY A 7 2.263 23.277 0.045 1.00 0.00 H new ATOM 66 N PHE A 8 4.191 21.641 1.106 1.00 0.00 N ATOM 67 CA PHE A 8 5.416 20.849 1.132 1.00 0.00 C ATOM 68 C PHE A 8 5.350 19.712 0.117 1.00 0.00 C ATOM 69 O PHE A 8 4.467 18.858 0.182 1.00 0.00 O ATOM 70 CB PHE A 8 5.653 20.283 2.534 1.00 0.00 C ATOM 71 CG PHE A 8 5.151 21.176 3.633 1.00 0.00 C ATOM 72 CD1 PHE A 8 5.757 22.396 3.883 1.00 0.00 C ATOM 73 CD2 PHE A 8 4.073 20.794 4.416 1.00 0.00 C ATOM 74 CE1 PHE A 8 5.298 23.218 4.895 1.00 0.00 C ATOM 75 CE2 PHE A 8 3.610 21.613 5.428 1.00 0.00 C ATOM 76 CZ PHE A 8 4.222 22.827 5.668 1.00 0.00 C ATOM 0 H PHE A 8 3.340 21.108 1.287 1.00 0.00 H new ATOM 0 HA PHE A 8 6.247 21.502 0.866 1.00 0.00 H new ATOM 0 HB2 PHE A 8 5.163 19.312 2.613 1.00 0.00 H new ATOM 0 HB3 PHE A 8 6.721 20.114 2.673 1.00 0.00 H new ATOM 0 HD1 PHE A 8 6.597 22.708 3.281 1.00 0.00 H new ATOM 0 HD2 PHE A 8 3.590 19.846 4.233 1.00 0.00 H new ATOM 0 HE1 PHE A 8 5.781 24.166 5.081 1.00 0.00 H new ATOM 0 HE2 PHE A 8 2.769 21.303 6.031 1.00 0.00 H new ATOM 0 HZ PHE A 8 3.861 23.469 6.458 1.00 0.00 H new ATOM 86 N ARG A 9 6.291 19.710 -0.822 1.00 0.00 N ATOM 87 CA ARG A 9 6.340 18.680 -1.853 1.00 0.00 C ATOM 88 C ARG A 9 6.006 17.311 -1.269 1.00 0.00 C ATOM 89 O ARG A 9 6.432 16.956 -0.169 1.00 0.00 O ATOM 90 CB ARG A 9 7.724 18.645 -2.504 1.00 0.00 C ATOM 91 CG ARG A 9 7.749 17.928 -3.844 1.00 0.00 C ATOM 92 CD ARG A 9 9.143 17.932 -4.452 1.00 0.00 C ATOM 93 NE ARG A 9 9.580 19.279 -4.810 1.00 0.00 N ATOM 94 CZ ARG A 9 10.165 20.113 -3.957 1.00 0.00 C ATOM 95 NH1 ARG A 9 10.382 19.740 -2.703 1.00 0.00 N ATOM 96 NH2 ARG A 9 10.534 21.323 -4.358 1.00 0.00 N ATOM 0 H ARG A 9 7.030 20.410 -0.890 1.00 0.00 H new ATOM 0 HA ARG A 9 5.596 18.924 -2.611 1.00 0.00 H new ATOM 0 HB2 ARG A 9 8.077 19.667 -2.642 1.00 0.00 H new ATOM 0 HB3 ARG A 9 8.423 18.155 -1.826 1.00 0.00 H new ATOM 0 HG2 ARG A 9 7.410 16.900 -3.714 1.00 0.00 H new ATOM 0 HG3 ARG A 9 7.051 18.410 -4.529 1.00 0.00 H new ATOM 0 HD2 ARG A 9 9.849 17.498 -3.744 1.00 0.00 H new ATOM 0 HD3 ARG A 9 9.153 17.300 -5.340 1.00 0.00 H new ATOM 0 HE ARG A 9 9.428 19.597 -5.767 1.00 0.00 H new ATOM 0 HH11 ARG A 9 10.100 18.811 -2.391 1.00 0.00 H new ATOM 0 HH12 ARG A 9 10.831 20.382 -2.050 1.00 0.00 H new ATOM 0 HH21 ARG A 9 10.369 21.613 -5.322 1.00 0.00 H new ATOM 0 HH22 ARG A 9 10.983 21.963 -3.703 1.00 0.00 H new ATOM 110 N PRO A 10 5.225 16.521 -2.021 1.00 0.00 N ATOM 111 CA PRO A 10 4.816 15.178 -1.598 1.00 0.00 C ATOM 112 C PRO A 10 5.979 14.192 -1.597 1.00 0.00 C ATOM 113 O PRO A 10 6.394 13.704 -2.649 1.00 0.00 O ATOM 114 CB PRO A 10 3.776 14.777 -2.647 1.00 0.00 C ATOM 115 CG PRO A 10 4.127 15.577 -3.854 1.00 0.00 C ATOM 116 CD PRO A 10 4.680 16.878 -3.341 1.00 0.00 C ATOM 0 HA PRO A 10 4.436 15.170 -0.576 1.00 0.00 H new ATOM 0 HB2 PRO A 10 3.816 13.708 -2.855 1.00 0.00 H new ATOM 0 HB3 PRO A 10 2.764 14.998 -2.306 1.00 0.00 H new ATOM 0 HG2 PRO A 10 4.861 15.056 -4.468 1.00 0.00 H new ATOM 0 HG3 PRO A 10 3.250 15.745 -4.480 1.00 0.00 H new ATOM 0 HD2 PRO A 10 5.452 17.274 -4.001 1.00 0.00 H new ATOM 0 HD3 PRO A 10 3.905 17.641 -3.263 1.00 0.00 H new ATOM 124 N HIS A 11 6.502 13.902 -0.410 1.00 0.00 N ATOM 125 CA HIS A 11 7.617 12.972 -0.272 1.00 0.00 C ATOM 126 C HIS A 11 7.328 11.933 0.807 1.00 0.00 C ATOM 127 O HIS A 11 6.852 12.266 1.893 1.00 0.00 O ATOM 128 CB HIS A 11 8.902 13.729 0.064 1.00 0.00 C ATOM 129 CG HIS A 11 9.912 12.901 0.797 1.00 0.00 C ATOM 130 ND1 HIS A 11 10.177 11.585 0.481 1.00 0.00 N ATOM 131 CD2 HIS A 11 10.725 13.209 1.834 1.00 0.00 C ATOM 132 CE1 HIS A 11 11.108 11.118 1.294 1.00 0.00 C ATOM 133 NE2 HIS A 11 11.458 12.084 2.124 1.00 0.00 N ATOM 0 H HIS A 11 6.172 14.298 0.470 1.00 0.00 H new ATOM 0 HA HIS A 11 7.747 12.456 -1.223 1.00 0.00 H new ATOM 0 HB2 HIS A 11 9.348 14.098 -0.859 1.00 0.00 H new ATOM 0 HB3 HIS A 11 8.652 14.601 0.668 1.00 0.00 H new ATOM 0 HD2 HIS A 11 10.786 14.162 2.339 1.00 0.00 H new ATOM 0 HE1 HIS A 11 11.514 10.117 1.282 1.00 0.00 H new ATOM 0 HE2 HIS A 11 12.159 12.007 2.861 1.00 0.00 H new ATOM 141 N PHE A 12 7.618 10.672 0.501 1.00 0.00 N ATOM 142 CA PHE A 12 7.388 9.584 1.444 1.00 0.00 C ATOM 143 C PHE A 12 8.568 9.433 2.400 1.00 0.00 C ATOM 144 O PHE A 12 9.628 8.933 2.021 1.00 0.00 O ATOM 145 CB PHE A 12 7.154 8.272 0.694 1.00 0.00 C ATOM 146 CG PHE A 12 6.004 8.330 -0.272 1.00 0.00 C ATOM 147 CD1 PHE A 12 6.203 8.734 -1.582 1.00 0.00 C ATOM 148 CD2 PHE A 12 4.726 7.980 0.131 1.00 0.00 C ATOM 149 CE1 PHE A 12 5.147 8.790 -2.472 1.00 0.00 C ATOM 150 CE2 PHE A 12 3.666 8.033 -0.754 1.00 0.00 C ATOM 151 CZ PHE A 12 3.877 8.437 -2.058 1.00 0.00 C ATOM 0 H PHE A 12 8.013 10.379 -0.393 1.00 0.00 H new ATOM 0 HA PHE A 12 6.499 9.825 2.027 1.00 0.00 H new ATOM 0 HB2 PHE A 12 8.061 8.006 0.151 1.00 0.00 H new ATOM 0 HB3 PHE A 12 6.971 7.477 1.417 1.00 0.00 H new ATOM 0 HD1 PHE A 12 7.194 9.008 -1.912 1.00 0.00 H new ATOM 0 HD2 PHE A 12 4.556 7.662 1.149 1.00 0.00 H new ATOM 0 HE1 PHE A 12 5.314 9.109 -3.490 1.00 0.00 H new ATOM 0 HE2 PHE A 12 2.674 7.759 -0.427 1.00 0.00 H new ATOM 0 HZ PHE A 12 3.051 8.477 -2.753 1.00 0.00 H new ATOM 161 N LEU A 13 8.377 9.869 3.640 1.00 0.00 N ATOM 162 CA LEU A 13 9.425 9.784 4.651 1.00 0.00 C ATOM 163 C LEU A 13 9.776 8.330 4.951 1.00 0.00 C ATOM 164 O LEU A 13 10.949 7.961 4.992 1.00 0.00 O ATOM 165 CB LEU A 13 8.982 10.489 5.934 1.00 0.00 C ATOM 166 CG LEU A 13 8.855 12.010 5.854 1.00 0.00 C ATOM 167 CD1 LEU A 13 7.705 12.403 4.940 1.00 0.00 C ATOM 168 CD2 LEU A 13 8.661 12.603 7.242 1.00 0.00 C ATOM 0 H LEU A 13 7.506 10.285 3.970 1.00 0.00 H new ATOM 0 HA LEU A 13 10.314 10.280 4.260 1.00 0.00 H new ATOM 0 HB2 LEU A 13 8.018 10.079 6.236 1.00 0.00 H new ATOM 0 HB3 LEU A 13 9.693 10.245 6.723 1.00 0.00 H new ATOM 0 HG LEU A 13 9.778 12.410 5.435 1.00 0.00 H new ATOM 0 HD11 LEU A 13 7.630 13.490 4.896 1.00 0.00 H new ATOM 0 HD12 LEU A 13 7.885 12.011 3.939 1.00 0.00 H new ATOM 0 HD13 LEU A 13 6.774 11.991 5.329 1.00 0.00 H new ATOM 0 HD21 LEU A 13 8.573 13.687 7.166 1.00 0.00 H new ATOM 0 HD22 LEU A 13 7.754 12.195 7.688 1.00 0.00 H new ATOM 0 HD23 LEU A 13 9.517 12.352 7.868 1.00 0.00 H new ATOM 180 N GLN A 14 8.750 7.510 5.156 1.00 0.00 N ATOM 181 CA GLN A 14 8.950 6.096 5.450 1.00 0.00 C ATOM 182 C GLN A 14 8.204 5.220 4.449 1.00 0.00 C ATOM 183 O GLN A 14 6.974 5.219 4.407 1.00 0.00 O ATOM 184 CB GLN A 14 8.482 5.778 6.871 1.00 0.00 C ATOM 185 CG GLN A 14 9.561 5.972 7.925 1.00 0.00 C ATOM 186 CD GLN A 14 9.575 7.377 8.494 1.00 0.00 C ATOM 187 OE1 GLN A 14 9.067 8.314 7.877 1.00 0.00 O ATOM 188 NE2 GLN A 14 10.158 7.531 9.677 1.00 0.00 N ATOM 0 H GLN A 14 7.773 7.800 5.124 1.00 0.00 H new ATOM 0 HA GLN A 14 10.016 5.882 5.369 1.00 0.00 H new ATOM 0 HB2 GLN A 14 7.630 6.412 7.114 1.00 0.00 H new ATOM 0 HB3 GLN A 14 8.132 4.746 6.907 1.00 0.00 H new ATOM 0 HG2 GLN A 14 9.406 5.258 8.734 1.00 0.00 H new ATOM 0 HG3 GLN A 14 10.535 5.752 7.488 1.00 0.00 H new ATOM 0 HE21 GLN A 14 10.566 6.727 10.153 1.00 0.00 H new ATOM 0 HE22 GLN A 14 10.198 8.454 10.110 1.00 0.00 H new ATOM 197 N ALA A 15 8.957 4.478 3.643 1.00 0.00 N ATOM 198 CA ALA A 15 8.367 3.597 2.643 1.00 0.00 C ATOM 199 C ALA A 15 8.873 2.168 2.803 1.00 0.00 C ATOM 200 O ALA A 15 10.039 1.928 3.118 1.00 0.00 O ATOM 201 CB ALA A 15 8.667 4.112 1.243 1.00 0.00 C ATOM 0 H ALA A 15 9.977 4.470 3.663 1.00 0.00 H new ATOM 0 HA ALA A 15 7.287 3.591 2.792 1.00 0.00 H new ATOM 0 HB1 ALA A 15 8.220 3.444 0.506 1.00 0.00 H new ATOM 0 HB2 ALA A 15 8.250 5.112 1.126 1.00 0.00 H new ATOM 0 HB3 ALA A 15 9.746 4.149 1.092 1.00 0.00 H new ATOM 207 N PRO A 16 7.978 1.194 2.583 1.00 0.00 N ATOM 208 CA PRO A 16 8.312 -0.229 2.697 1.00 0.00 C ATOM 209 C PRO A 16 9.242 -0.698 1.583 1.00 0.00 C ATOM 210 O PRO A 16 9.698 0.100 0.766 1.00 0.00 O ATOM 211 CB PRO A 16 6.951 -0.923 2.584 1.00 0.00 C ATOM 212 CG PRO A 16 6.102 0.031 1.817 1.00 0.00 C ATOM 213 CD PRO A 16 6.571 1.406 2.204 1.00 0.00 C ATOM 0 HA PRO A 16 8.844 -0.449 3.623 1.00 0.00 H new ATOM 0 HB2 PRO A 16 7.036 -1.880 2.069 1.00 0.00 H new ATOM 0 HB3 PRO A 16 6.528 -1.127 3.568 1.00 0.00 H new ATOM 0 HG2 PRO A 16 6.207 -0.129 0.744 1.00 0.00 H new ATOM 0 HG3 PRO A 16 5.048 -0.104 2.058 1.00 0.00 H new ATOM 0 HD2 PRO A 16 6.480 2.109 1.376 1.00 0.00 H new ATOM 0 HD3 PRO A 16 5.989 1.811 3.032 1.00 0.00 H new ATOM 221 N GLY A 17 9.519 -1.998 1.557 1.00 0.00 N ATOM 222 CA GLY A 17 10.394 -2.550 0.539 1.00 0.00 C ATOM 223 C GLY A 17 9.892 -3.874 -0.001 1.00 0.00 C ATOM 224 O GLY A 17 8.867 -3.927 -0.681 1.00 0.00 O ATOM 0 H GLY A 17 9.153 -2.679 2.223 1.00 0.00 H new ATOM 0 HA2 GLY A 17 10.486 -1.838 -0.281 1.00 0.00 H new ATOM 0 HA3 GLY A 17 11.392 -2.686 0.957 1.00 0.00 H new ATOM 228 N ASP A 18 10.615 -4.947 0.302 1.00 0.00 N ATOM 229 CA ASP A 18 10.237 -6.278 -0.158 1.00 0.00 C ATOM 230 C ASP A 18 9.675 -7.111 0.990 1.00 0.00 C ATOM 231 O ASP A 18 10.251 -7.157 2.078 1.00 0.00 O ATOM 232 CB ASP A 18 11.442 -6.988 -0.777 1.00 0.00 C ATOM 233 CG ASP A 18 11.043 -7.963 -1.867 1.00 0.00 C ATOM 234 OD1 ASP A 18 9.949 -7.792 -2.443 1.00 0.00 O ATOM 235 OD2 ASP A 18 11.826 -8.896 -2.145 1.00 0.00 O ATOM 0 H ASP A 18 11.466 -4.921 0.864 1.00 0.00 H new ATOM 0 HA ASP A 18 9.461 -6.167 -0.916 1.00 0.00 H new ATOM 0 HB2 ASP A 18 12.125 -6.245 -1.190 1.00 0.00 H new ATOM 0 HB3 ASP A 18 11.985 -7.522 0.003 1.00 0.00 H new ATOM 240 N LEU A 19 8.546 -7.766 0.741 1.00 0.00 N ATOM 241 CA LEU A 19 7.905 -8.596 1.754 1.00 0.00 C ATOM 242 C LEU A 19 7.589 -9.983 1.202 1.00 0.00 C ATOM 243 O LEU A 19 7.553 -10.186 -0.012 1.00 0.00 O ATOM 244 CB LEU A 19 6.622 -7.928 2.252 1.00 0.00 C ATOM 245 CG LEU A 19 6.696 -6.418 2.479 1.00 0.00 C ATOM 246 CD1 LEU A 19 5.308 -5.846 2.723 1.00 0.00 C ATOM 247 CD2 LEU A 19 7.619 -6.098 3.645 1.00 0.00 C ATOM 0 H LEU A 19 8.056 -7.738 -0.153 1.00 0.00 H new ATOM 0 HA LEU A 19 8.597 -8.707 2.589 1.00 0.00 H new ATOM 0 HB2 LEU A 19 5.829 -8.128 1.532 1.00 0.00 H new ATOM 0 HB3 LEU A 19 6.329 -8.402 3.189 1.00 0.00 H new ATOM 0 HG LEU A 19 7.105 -5.955 1.581 1.00 0.00 H new ATOM 0 HD11 LEU A 19 5.381 -4.770 2.883 1.00 0.00 H new ATOM 0 HD12 LEU A 19 4.676 -6.043 1.857 1.00 0.00 H new ATOM 0 HD13 LEU A 19 4.871 -6.315 3.605 1.00 0.00 H new ATOM 0 HD21 LEU A 19 7.659 -5.019 3.792 1.00 0.00 H new ATOM 0 HD22 LEU A 19 7.240 -6.573 4.550 1.00 0.00 H new ATOM 0 HD23 LEU A 19 8.620 -6.472 3.430 1.00 0.00 H new ATOM 259 N THR A 20 7.357 -10.934 2.101 1.00 0.00 N ATOM 260 CA THR A 20 7.043 -12.301 1.704 1.00 0.00 C ATOM 261 C THR A 20 5.895 -12.864 2.534 1.00 0.00 C ATOM 262 O THR A 20 6.042 -13.108 3.732 1.00 0.00 O ATOM 263 CB THR A 20 8.267 -13.224 1.850 1.00 0.00 C ATOM 264 OG1 THR A 20 9.442 -12.558 1.373 1.00 0.00 O ATOM 265 CG2 THR A 20 8.063 -14.519 1.079 1.00 0.00 C ATOM 0 H THR A 20 7.381 -10.783 3.109 1.00 0.00 H new ATOM 0 HA THR A 20 6.747 -12.265 0.655 1.00 0.00 H new ATOM 0 HB THR A 20 8.390 -13.464 2.906 1.00 0.00 H new ATOM 0 HG1 THR A 20 10.216 -13.151 1.471 1.00 0.00 H new ATOM 0 HG21 THR A 20 8.940 -15.155 1.197 1.00 0.00 H new ATOM 0 HG22 THR A 20 7.185 -15.037 1.464 1.00 0.00 H new ATOM 0 HG23 THR A 20 7.917 -14.294 0.022 1.00 0.00 H new ATOM 273 N VAL A 21 4.750 -13.069 1.890 1.00 0.00 N ATOM 274 CA VAL A 21 3.577 -13.605 2.569 1.00 0.00 C ATOM 275 C VAL A 21 3.032 -14.829 1.840 1.00 0.00 C ATOM 276 O VAL A 21 2.956 -14.849 0.612 1.00 0.00 O ATOM 277 CB VAL A 21 2.461 -12.549 2.680 1.00 0.00 C ATOM 278 CG1 VAL A 21 1.184 -13.176 3.220 1.00 0.00 C ATOM 279 CG2 VAL A 21 2.909 -11.391 3.558 1.00 0.00 C ATOM 0 H VAL A 21 4.610 -12.872 0.899 1.00 0.00 H new ATOM 0 HA VAL A 21 3.895 -13.893 3.571 1.00 0.00 H new ATOM 0 HB VAL A 21 2.253 -12.160 1.683 1.00 0.00 H new ATOM 0 HG11 VAL A 21 0.407 -12.415 3.291 1.00 0.00 H new ATOM 0 HG12 VAL A 21 0.855 -13.968 2.548 1.00 0.00 H new ATOM 0 HG13 VAL A 21 1.374 -13.595 4.208 1.00 0.00 H new ATOM 0 HG21 VAL A 21 2.108 -10.654 3.625 1.00 0.00 H new ATOM 0 HG22 VAL A 21 3.146 -11.761 4.555 1.00 0.00 H new ATOM 0 HG23 VAL A 21 3.794 -10.926 3.124 1.00 0.00 H new ATOM 289 N GLN A 22 2.655 -15.848 2.607 1.00 0.00 N ATOM 290 CA GLN A 22 2.118 -17.076 2.034 1.00 0.00 C ATOM 291 C GLN A 22 0.651 -16.904 1.656 1.00 0.00 C ATOM 292 O GLN A 22 -0.164 -16.478 2.474 1.00 0.00 O ATOM 293 CB GLN A 22 2.271 -18.234 3.022 1.00 0.00 C ATOM 294 CG GLN A 22 1.863 -19.581 2.448 1.00 0.00 C ATOM 295 CD GLN A 22 1.886 -20.688 3.483 1.00 0.00 C ATOM 296 OE1 GLN A 22 2.916 -20.949 4.106 1.00 0.00 O ATOM 297 NE2 GLN A 22 0.749 -21.346 3.673 1.00 0.00 N ATOM 0 H GLN A 22 2.712 -15.847 3.625 1.00 0.00 H new ATOM 0 HA GLN A 22 2.683 -17.303 1.130 1.00 0.00 H new ATOM 0 HB2 GLN A 22 3.310 -18.287 3.349 1.00 0.00 H new ATOM 0 HB3 GLN A 22 1.669 -18.028 3.907 1.00 0.00 H new ATOM 0 HG2 GLN A 22 0.861 -19.503 2.027 1.00 0.00 H new ATOM 0 HG3 GLN A 22 2.534 -19.841 1.629 1.00 0.00 H new ATOM 0 HE21 GLN A 22 -0.081 -21.096 3.135 1.00 0.00 H new ATOM 0 HE22 GLN A 22 0.705 -22.101 4.357 1.00 0.00 H new ATOM 306 N GLU A 23 0.321 -17.239 0.412 1.00 0.00 N ATOM 307 CA GLU A 23 -1.049 -17.120 -0.073 1.00 0.00 C ATOM 308 C GLU A 23 -2.048 -17.452 1.031 1.00 0.00 C ATOM 309 O GLU A 23 -1.853 -18.395 1.797 1.00 0.00 O ATOM 310 CB GLU A 23 -1.271 -18.044 -1.272 1.00 0.00 C ATOM 311 CG GLU A 23 -2.686 -17.998 -1.822 1.00 0.00 C ATOM 312 CD GLU A 23 -3.627 -18.938 -1.094 1.00 0.00 C ATOM 313 OE1 GLU A 23 -3.222 -20.089 -0.824 1.00 0.00 O ATOM 314 OE2 GLU A 23 -4.766 -18.525 -0.794 1.00 0.00 O ATOM 0 H GLU A 23 0.983 -17.595 -0.277 1.00 0.00 H new ATOM 0 HA GLU A 23 -1.208 -16.088 -0.385 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -0.573 -17.772 -2.064 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -1.037 -19.068 -0.979 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -3.067 -16.980 -1.748 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -2.669 -18.256 -2.881 1.00 0.00 H new ATOM 321 N GLY A 24 -3.119 -16.669 1.108 1.00 0.00 N ATOM 322 CA GLY A 24 -4.133 -16.894 2.121 1.00 0.00 C ATOM 323 C GLY A 24 -3.691 -16.434 3.496 1.00 0.00 C ATOM 324 O GLY A 24 -4.077 -17.018 4.509 1.00 0.00 O ATOM 0 H GLY A 24 -3.303 -15.882 0.486 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -5.045 -16.367 1.841 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -4.377 -17.956 2.157 1.00 0.00 H new ATOM 328 N LYS A 25 -2.877 -15.385 3.534 1.00 0.00 N ATOM 329 CA LYS A 25 -2.380 -14.845 4.794 1.00 0.00 C ATOM 330 C LYS A 25 -2.652 -13.347 4.890 1.00 0.00 C ATOM 331 O LYS A 25 -3.116 -12.728 3.932 1.00 0.00 O ATOM 332 CB LYS A 25 -0.880 -15.113 4.930 1.00 0.00 C ATOM 333 CG LYS A 25 -0.549 -16.546 5.307 1.00 0.00 C ATOM 334 CD LYS A 25 -0.900 -16.837 6.756 1.00 0.00 C ATOM 335 CE LYS A 25 -0.948 -18.333 7.029 1.00 0.00 C ATOM 336 NZ LYS A 25 -2.286 -18.910 6.718 1.00 0.00 N ATOM 0 H LYS A 25 -2.547 -14.891 2.705 1.00 0.00 H new ATOM 0 HA LYS A 25 -2.907 -15.344 5.608 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -0.390 -14.872 3.987 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -0.467 -14.443 5.684 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -1.094 -17.230 4.656 1.00 0.00 H new ATOM 0 HG3 LYS A 25 0.513 -16.730 5.145 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -0.164 -16.370 7.410 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -1.866 -16.392 6.994 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -0.188 -18.836 6.432 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -0.706 -18.519 8.075 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -2.279 -19.931 6.917 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -3.009 -18.448 7.306 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -2.506 -18.755 5.713 1.00 0.00 H new ATOM 350 N LEU A 26 -2.358 -12.771 6.050 1.00 0.00 N ATOM 351 CA LEU A 26 -2.568 -11.344 6.270 1.00 0.00 C ATOM 352 C LEU A 26 -1.370 -10.535 5.784 1.00 0.00 C ATOM 353 O LEU A 26 -0.223 -10.854 6.102 1.00 0.00 O ATOM 354 CB LEU A 26 -2.817 -11.068 7.754 1.00 0.00 C ATOM 355 CG LEU A 26 -2.925 -9.596 8.154 1.00 0.00 C ATOM 356 CD1 LEU A 26 -1.582 -8.901 7.998 1.00 0.00 C ATOM 357 CD2 LEU A 26 -3.990 -8.895 7.323 1.00 0.00 C ATOM 0 H LEU A 26 -1.974 -13.269 6.853 1.00 0.00 H new ATOM 0 HA LEU A 26 -3.444 -11.039 5.698 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -3.738 -11.572 8.047 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -2.009 -11.521 8.328 1.00 0.00 H new ATOM 0 HG LEU A 26 -3.218 -9.544 9.203 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -1.678 -7.854 8.287 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -0.844 -9.387 8.636 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -1.259 -8.962 6.959 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -4.053 -7.848 7.621 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -3.726 -8.956 6.267 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -4.954 -9.377 7.485 1.00 0.00 H new ATOM 369 N CYS A 27 -1.643 -9.487 5.015 1.00 0.00 N ATOM 370 CA CYS A 27 -0.587 -8.631 4.486 1.00 0.00 C ATOM 371 C CYS A 27 -0.881 -7.163 4.775 1.00 0.00 C ATOM 372 O CYS A 27 -1.769 -6.566 4.166 1.00 0.00 O ATOM 373 CB CYS A 27 -0.433 -8.846 2.980 1.00 0.00 C ATOM 374 SG CYS A 27 0.504 -7.548 2.141 1.00 0.00 S ATOM 0 H CYS A 27 -2.586 -9.209 4.744 1.00 0.00 H new ATOM 0 HA CYS A 27 0.346 -8.900 4.981 1.00 0.00 H new ATOM 0 HB2 CYS A 27 0.060 -9.803 2.809 1.00 0.00 H new ATOM 0 HB3 CYS A 27 -1.424 -8.913 2.530 1.00 0.00 H new ATOM 0 HG CYS A 27 0.582 -7.820 0.872 1.00 0.00 H new ATOM 380 N ARG A 28 -0.132 -6.587 5.709 1.00 0.00 N ATOM 381 CA ARG A 28 -0.315 -5.189 6.081 1.00 0.00 C ATOM 382 C ARG A 28 0.889 -4.352 5.659 1.00 0.00 C ATOM 383 O ARG A 28 2.024 -4.828 5.673 1.00 0.00 O ATOM 384 CB ARG A 28 -0.532 -5.065 7.590 1.00 0.00 C ATOM 385 CG ARG A 28 -0.721 -3.632 8.062 1.00 0.00 C ATOM 386 CD ARG A 28 -1.350 -3.580 9.446 1.00 0.00 C ATOM 387 NE ARG A 28 -1.367 -2.225 9.989 1.00 0.00 N ATOM 388 CZ ARG A 28 -0.325 -1.661 10.590 1.00 0.00 C ATOM 389 NH1 ARG A 28 0.811 -2.333 10.724 1.00 0.00 N ATOM 390 NH2 ARG A 28 -0.417 -0.423 11.059 1.00 0.00 N ATOM 0 H ARG A 28 0.608 -7.067 6.222 1.00 0.00 H new ATOM 0 HA ARG A 28 -1.197 -4.813 5.562 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -1.407 -5.650 7.872 1.00 0.00 H new ATOM 0 HB3 ARG A 28 0.323 -5.500 8.108 1.00 0.00 H new ATOM 0 HG2 ARG A 28 0.243 -3.123 8.080 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -1.352 -3.095 7.354 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -2.369 -3.963 9.395 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -0.797 -4.234 10.120 1.00 0.00 H new ATOM 0 HE ARG A 28 -2.226 -1.682 9.902 1.00 0.00 H new ATOM 0 HH11 ARG A 28 0.886 -3.285 10.365 1.00 0.00 H new ATOM 0 HH12 ARG A 28 1.610 -1.898 11.186 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -1.289 0.097 10.958 1.00 0.00 H new ATOM 0 HH22 ARG A 28 0.384 0.008 11.520 1.00 0.00 H new ATOM 404 N MET A 29 0.633 -3.103 5.282 1.00 0.00 N ATOM 405 CA MET A 29 1.695 -2.200 4.857 1.00 0.00 C ATOM 406 C MET A 29 1.421 -0.776 5.329 1.00 0.00 C ATOM 407 O MET A 29 0.291 -0.293 5.250 1.00 0.00 O ATOM 408 CB MET A 29 1.836 -2.226 3.333 1.00 0.00 C ATOM 409 CG MET A 29 2.232 -3.586 2.783 1.00 0.00 C ATOM 410 SD MET A 29 2.941 -3.486 1.128 1.00 0.00 S ATOM 411 CE MET A 29 1.726 -4.402 0.183 1.00 0.00 C ATOM 0 H MET A 29 -0.301 -2.694 5.262 1.00 0.00 H new ATOM 0 HA MET A 29 2.628 -2.540 5.308 1.00 0.00 H new ATOM 0 HB2 MET A 29 0.890 -1.923 2.884 1.00 0.00 H new ATOM 0 HB3 MET A 29 2.582 -1.490 3.033 1.00 0.00 H new ATOM 0 HG2 MET A 29 2.953 -4.050 3.456 1.00 0.00 H new ATOM 0 HG3 MET A 29 1.356 -4.234 2.760 1.00 0.00 H new ATOM 0 HE1 MET A 29 1.947 -4.310 -0.880 1.00 0.00 H new ATOM 0 HE2 MET A 29 1.758 -5.453 0.470 1.00 0.00 H new ATOM 0 HE3 MET A 29 0.732 -4.002 0.383 1.00 0.00 H new ATOM 421 N ASP A 30 2.460 -0.110 5.821 1.00 0.00 N ATOM 422 CA ASP A 30 2.330 1.259 6.306 1.00 0.00 C ATOM 423 C ASP A 30 3.242 2.200 5.526 1.00 0.00 C ATOM 424 O ASP A 30 4.367 1.841 5.174 1.00 0.00 O ATOM 425 CB ASP A 30 2.662 1.328 7.798 1.00 0.00 C ATOM 426 CG ASP A 30 1.468 0.998 8.672 1.00 0.00 C ATOM 427 OD1 ASP A 30 1.062 -0.182 8.701 1.00 0.00 O ATOM 428 OD2 ASP A 30 0.938 1.921 9.327 1.00 0.00 O ATOM 0 H ASP A 30 3.401 -0.496 5.894 1.00 0.00 H new ATOM 0 HA ASP A 30 1.298 1.575 6.156 1.00 0.00 H new ATOM 0 HB2 ASP A 30 3.473 0.635 8.019 1.00 0.00 H new ATOM 0 HB3 ASP A 30 3.022 2.328 8.041 1.00 0.00 H new ATOM 433 N CYS A 31 2.751 3.405 5.258 1.00 0.00 N ATOM 434 CA CYS A 31 3.521 4.398 4.518 1.00 0.00 C ATOM 435 C CYS A 31 3.253 5.802 5.050 1.00 0.00 C ATOM 436 O CYS A 31 2.111 6.162 5.336 1.00 0.00 O ATOM 437 CB CYS A 31 3.180 4.331 3.028 1.00 0.00 C ATOM 438 SG CYS A 31 1.463 4.750 2.644 1.00 0.00 S ATOM 0 H CYS A 31 1.823 3.718 5.542 1.00 0.00 H new ATOM 0 HA CYS A 31 4.579 4.174 4.652 1.00 0.00 H new ATOM 0 HB2 CYS A 31 3.838 5.009 2.485 1.00 0.00 H new ATOM 0 HB3 CYS A 31 3.387 3.325 2.664 1.00 0.00 H new ATOM 0 HG CYS A 31 0.684 4.284 3.575 1.00 0.00 H new ATOM 444 N LYS A 32 4.314 6.590 5.184 1.00 0.00 N ATOM 445 CA LYS A 32 4.195 7.955 5.683 1.00 0.00 C ATOM 446 C LYS A 32 4.642 8.961 4.628 1.00 0.00 C ATOM 447 O LYS A 32 5.783 8.926 4.165 1.00 0.00 O ATOM 448 CB LYS A 32 5.029 8.130 6.955 1.00 0.00 C ATOM 449 CG LYS A 32 4.477 9.177 7.906 1.00 0.00 C ATOM 450 CD LYS A 32 4.455 10.555 7.266 1.00 0.00 C ATOM 451 CE LYS A 32 4.309 11.651 8.310 1.00 0.00 C ATOM 452 NZ LYS A 32 4.816 12.961 7.814 1.00 0.00 N ATOM 0 H LYS A 32 5.267 6.307 4.954 1.00 0.00 H new ATOM 0 HA LYS A 32 3.146 8.140 5.915 1.00 0.00 H new ATOM 0 HB2 LYS A 32 5.088 7.174 7.475 1.00 0.00 H new ATOM 0 HB3 LYS A 32 6.047 8.404 6.677 1.00 0.00 H new ATOM 0 HG2 LYS A 32 3.467 8.899 8.208 1.00 0.00 H new ATOM 0 HG3 LYS A 32 5.084 9.205 8.811 1.00 0.00 H new ATOM 0 HD2 LYS A 32 5.374 10.710 6.700 1.00 0.00 H new ATOM 0 HD3 LYS A 32 3.630 10.615 6.556 1.00 0.00 H new ATOM 0 HE2 LYS A 32 3.260 11.750 8.589 1.00 0.00 H new ATOM 0 HE3 LYS A 32 4.853 11.369 9.211 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 4.970 13.601 8.619 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 5.714 12.817 7.310 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 4.119 13.381 7.167 1.00 0.00 H new ATOM 466 N VAL A 33 3.737 9.859 4.252 1.00 0.00 N ATOM 467 CA VAL A 33 4.039 10.877 3.252 1.00 0.00 C ATOM 468 C VAL A 33 3.666 12.268 3.754 1.00 0.00 C ATOM 469 O VAL A 33 2.532 12.506 4.168 1.00 0.00 O ATOM 470 CB VAL A 33 3.297 10.604 1.931 1.00 0.00 C ATOM 471 CG1 VAL A 33 1.793 10.574 2.159 1.00 0.00 C ATOM 472 CG2 VAL A 33 3.664 11.649 0.888 1.00 0.00 C ATOM 0 H VAL A 33 2.789 9.902 4.625 1.00 0.00 H new ATOM 0 HA VAL A 33 5.113 10.835 3.072 1.00 0.00 H new ATOM 0 HB VAL A 33 3.604 9.627 1.558 1.00 0.00 H new ATOM 0 HG11 VAL A 33 1.286 10.380 1.214 1.00 0.00 H new ATOM 0 HG12 VAL A 33 1.549 9.786 2.871 1.00 0.00 H new ATOM 0 HG13 VAL A 33 1.466 11.535 2.556 1.00 0.00 H new ATOM 0 HG21 VAL A 33 3.130 11.441 -0.039 1.00 0.00 H new ATOM 0 HG22 VAL A 33 3.387 12.639 1.251 1.00 0.00 H new ATOM 0 HG23 VAL A 33 4.738 11.618 0.704 1.00 0.00 H new ATOM 482 N SER A 34 4.629 13.183 3.714 1.00 0.00 N ATOM 483 CA SER A 34 4.404 14.550 4.168 1.00 0.00 C ATOM 484 C SER A 34 3.993 15.448 3.005 1.00 0.00 C ATOM 485 O SER A 34 4.426 15.250 1.871 1.00 0.00 O ATOM 486 CB SER A 34 5.665 15.104 4.834 1.00 0.00 C ATOM 487 OG SER A 34 5.525 16.484 5.123 1.00 0.00 O ATOM 0 H SER A 34 5.573 13.002 3.372 1.00 0.00 H new ATOM 0 HA SER A 34 3.594 14.535 4.897 1.00 0.00 H new ATOM 0 HB2 SER A 34 5.865 14.555 5.754 1.00 0.00 H new ATOM 0 HB3 SER A 34 6.523 14.952 4.179 1.00 0.00 H new ATOM 0 HG SER A 34 6.343 16.814 5.550 1.00 0.00 H new ATOM 493 N GLY A 35 3.153 16.437 3.297 1.00 0.00 N ATOM 494 CA GLY A 35 2.697 17.350 2.266 1.00 0.00 C ATOM 495 C GLY A 35 1.561 18.237 2.739 1.00 0.00 C ATOM 496 O GLY A 35 0.847 17.894 3.681 1.00 0.00 O ATOM 0 H GLY A 35 2.781 16.622 4.229 1.00 0.00 H new ATOM 0 HA2 GLY A 35 3.530 17.974 1.942 1.00 0.00 H new ATOM 0 HA3 GLY A 35 2.370 16.779 1.397 1.00 0.00 H new ATOM 500 N LEU A 36 1.394 19.381 2.084 1.00 0.00 N ATOM 501 CA LEU A 36 0.338 20.321 2.443 1.00 0.00 C ATOM 502 C LEU A 36 -0.218 21.014 1.204 1.00 0.00 C ATOM 503 O LEU A 36 0.510 21.637 0.431 1.00 0.00 O ATOM 504 CB LEU A 36 0.870 21.363 3.429 1.00 0.00 C ATOM 505 CG LEU A 36 -0.079 22.514 3.765 1.00 0.00 C ATOM 506 CD1 LEU A 36 -0.937 22.164 4.971 1.00 0.00 C ATOM 507 CD2 LEU A 36 0.705 23.794 4.019 1.00 0.00 C ATOM 0 H LEU A 36 1.976 19.680 1.302 1.00 0.00 H new ATOM 0 HA LEU A 36 -0.469 19.761 2.916 1.00 0.00 H new ATOM 0 HB2 LEU A 36 1.135 20.855 4.356 1.00 0.00 H new ATOM 0 HB3 LEU A 36 1.789 21.784 3.022 1.00 0.00 H new ATOM 0 HG LEU A 36 -0.738 22.678 2.912 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -1.606 22.995 5.195 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -1.526 21.273 4.752 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -0.295 21.973 5.831 1.00 0.00 H new ATOM 0 HD21 LEU A 36 0.014 24.603 4.257 1.00 0.00 H new ATOM 0 HD22 LEU A 36 1.388 23.643 4.855 1.00 0.00 H new ATOM 0 HD23 LEU A 36 1.275 24.054 3.127 1.00 0.00 H new ATOM 519 N PRO A 37 -1.541 20.907 1.010 1.00 0.00 N ATOM 520 CA PRO A 37 -2.418 20.168 1.923 1.00 0.00 C ATOM 521 C PRO A 37 -2.188 18.662 1.857 1.00 0.00 C ATOM 522 O PRO A 37 -1.316 18.188 1.127 1.00 0.00 O ATOM 523 CB PRO A 37 -3.823 20.517 1.425 1.00 0.00 C ATOM 524 CG PRO A 37 -3.641 20.862 -0.013 1.00 0.00 C ATOM 525 CD PRO A 37 -2.283 21.499 -0.117 1.00 0.00 C ATOM 0 HA PRO A 37 -2.241 20.436 2.964 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -4.506 19.677 1.547 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -4.244 21.354 1.983 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -3.703 19.972 -0.639 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -4.420 21.545 -0.352 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -1.807 21.277 -1.072 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -2.341 22.584 -0.034 1.00 0.00 H new ATOM 533 N THR A 38 -2.975 17.913 2.623 1.00 0.00 N ATOM 534 CA THR A 38 -2.856 16.461 2.651 1.00 0.00 C ATOM 535 C THR A 38 -2.730 15.892 1.243 1.00 0.00 C ATOM 536 O THR A 38 -3.612 16.056 0.399 1.00 0.00 O ATOM 537 CB THR A 38 -4.067 15.812 3.348 1.00 0.00 C ATOM 538 OG1 THR A 38 -4.166 16.283 4.697 1.00 0.00 O ATOM 539 CG2 THR A 38 -3.945 14.296 3.343 1.00 0.00 C ATOM 0 H THR A 38 -3.702 18.288 3.232 1.00 0.00 H new ATOM 0 HA THR A 38 -1.953 16.229 3.216 1.00 0.00 H new ATOM 0 HB THR A 38 -4.967 16.090 2.799 1.00 0.00 H new ATOM 0 HG1 THR A 38 -4.939 15.867 5.133 1.00 0.00 H new ATOM 0 HG21 THR A 38 -4.811 13.860 3.840 1.00 0.00 H new ATOM 0 HG22 THR A 38 -3.899 13.938 2.314 1.00 0.00 H new ATOM 0 HG23 THR A 38 -3.038 14.002 3.871 1.00 0.00 H new ATOM 547 N PRO A 39 -1.608 15.206 0.979 1.00 0.00 N ATOM 548 CA PRO A 39 -1.340 14.597 -0.327 1.00 0.00 C ATOM 549 C PRO A 39 -2.251 13.407 -0.609 1.00 0.00 C ATOM 550 O PRO A 39 -2.346 12.481 0.196 1.00 0.00 O ATOM 551 CB PRO A 39 0.116 14.140 -0.214 1.00 0.00 C ATOM 552 CG PRO A 39 0.339 13.944 1.246 1.00 0.00 C ATOM 553 CD PRO A 39 -0.514 14.970 1.937 1.00 0.00 C ATOM 0 HA PRO A 39 -1.520 15.294 -1.146 1.00 0.00 H new ATOM 0 HB2 PRO A 39 0.285 13.217 -0.768 1.00 0.00 H new ATOM 0 HB3 PRO A 39 0.798 14.886 -0.622 1.00 0.00 H new ATOM 0 HG2 PRO A 39 0.060 12.935 1.551 1.00 0.00 H new ATOM 0 HG3 PRO A 39 1.391 14.075 1.501 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -0.889 14.603 2.893 1.00 0.00 H new ATOM 0 HD3 PRO A 39 0.044 15.884 2.143 1.00 0.00 H new ATOM 561 N ASP A 40 -2.919 13.439 -1.757 1.00 0.00 N ATOM 562 CA ASP A 40 -3.822 12.362 -2.147 1.00 0.00 C ATOM 563 C ASP A 40 -3.142 11.411 -3.127 1.00 0.00 C ATOM 564 O ASP A 40 -2.957 11.739 -4.300 1.00 0.00 O ATOM 565 CB ASP A 40 -5.094 12.935 -2.772 1.00 0.00 C ATOM 566 CG ASP A 40 -6.041 13.508 -1.736 1.00 0.00 C ATOM 567 OD1 ASP A 40 -6.371 12.787 -0.771 1.00 0.00 O ATOM 568 OD2 ASP A 40 -6.452 14.677 -1.890 1.00 0.00 O ATOM 0 H ASP A 40 -2.852 14.199 -2.434 1.00 0.00 H new ATOM 0 HA ASP A 40 -4.088 11.802 -1.251 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -4.826 13.714 -3.485 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -5.604 12.152 -3.333 1.00 0.00 H new ATOM 573 N LEU A 41 -2.772 10.232 -2.640 1.00 0.00 N ATOM 574 CA LEU A 41 -2.111 9.233 -3.473 1.00 0.00 C ATOM 575 C LEU A 41 -3.066 8.096 -3.820 1.00 0.00 C ATOM 576 O LEU A 41 -4.015 7.823 -3.085 1.00 0.00 O ATOM 577 CB LEU A 41 -0.878 8.678 -2.757 1.00 0.00 C ATOM 578 CG LEU A 41 -1.144 7.898 -1.469 1.00 0.00 C ATOM 579 CD1 LEU A 41 0.008 6.952 -1.170 1.00 0.00 C ATOM 580 CD2 LEU A 41 -1.369 8.852 -0.305 1.00 0.00 C ATOM 0 H LEU A 41 -2.918 9.944 -1.672 1.00 0.00 H new ATOM 0 HA LEU A 41 -1.799 9.716 -4.399 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -0.343 8.027 -3.449 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -0.213 9.510 -2.524 1.00 0.00 H new ATOM 0 HG LEU A 41 -2.048 7.304 -1.607 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -0.199 6.406 -0.250 1.00 0.00 H new ATOM 0 HD12 LEU A 41 0.122 6.247 -1.993 1.00 0.00 H new ATOM 0 HD13 LEU A 41 0.928 7.525 -1.053 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -1.557 8.280 0.603 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -0.483 9.472 -0.167 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -2.228 9.488 -0.517 1.00 0.00 H new ATOM 592 N SER A 42 -2.807 7.434 -4.943 1.00 0.00 N ATOM 593 CA SER A 42 -3.645 6.327 -5.389 1.00 0.00 C ATOM 594 C SER A 42 -2.818 5.057 -5.566 1.00 0.00 C ATOM 595 O SER A 42 -1.714 5.093 -6.110 1.00 0.00 O ATOM 596 CB SER A 42 -4.340 6.683 -6.704 1.00 0.00 C ATOM 597 OG SER A 42 -5.530 5.931 -6.872 1.00 0.00 O ATOM 0 H SER A 42 -2.023 7.645 -5.561 1.00 0.00 H new ATOM 0 HA SER A 42 -4.400 6.145 -4.625 1.00 0.00 H new ATOM 0 HB2 SER A 42 -4.574 7.748 -6.719 1.00 0.00 H new ATOM 0 HB3 SER A 42 -3.665 6.493 -7.539 1.00 0.00 H new ATOM 0 HG SER A 42 -5.956 6.178 -7.719 1.00 0.00 H new ATOM 603 N TRP A 43 -3.360 3.937 -5.102 1.00 0.00 N ATOM 604 CA TRP A 43 -2.673 2.655 -5.207 1.00 0.00 C ATOM 605 C TRP A 43 -2.947 2.000 -6.557 1.00 0.00 C ATOM 606 O TRP A 43 -4.097 1.899 -6.985 1.00 0.00 O ATOM 607 CB TRP A 43 -3.111 1.723 -4.076 1.00 0.00 C ATOM 608 CG TRP A 43 -2.851 2.284 -2.711 1.00 0.00 C ATOM 609 CD1 TRP A 43 -3.673 3.103 -1.991 1.00 0.00 C ATOM 610 CD2 TRP A 43 -1.689 2.067 -1.902 1.00 0.00 C ATOM 611 NE1 TRP A 43 -3.092 3.409 -0.784 1.00 0.00 N ATOM 612 CE2 TRP A 43 -1.875 2.785 -0.705 1.00 0.00 C ATOM 613 CE3 TRP A 43 -0.511 1.334 -2.073 1.00 0.00 C ATOM 614 CZ2 TRP A 43 -0.926 2.791 0.314 1.00 0.00 C ATOM 615 CZ3 TRP A 43 0.430 1.342 -1.061 1.00 0.00 C ATOM 616 CH2 TRP A 43 0.218 2.065 0.120 1.00 0.00 C ATOM 0 H TRP A 43 -4.273 3.891 -4.649 1.00 0.00 H new ATOM 0 HA TRP A 43 -1.602 2.837 -5.123 1.00 0.00 H new ATOM 0 HB2 TRP A 43 -4.176 1.514 -4.179 1.00 0.00 H new ATOM 0 HB3 TRP A 43 -2.589 0.772 -4.176 1.00 0.00 H new ATOM 0 HD1 TRP A 43 -4.638 3.458 -2.322 1.00 0.00 H new ATOM 0 HE1 TRP A 43 -3.501 4.004 -0.064 1.00 0.00 H new ATOM 0 HE3 TRP A 43 -0.340 0.772 -2.979 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 -1.087 3.349 1.225 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 1.345 0.781 -1.183 1.00 0.00 H new ATOM 0 HH2 TRP A 43 0.972 2.049 0.893 1.00 0.00 H new ATOM 627 N GLN A 44 -1.885 1.557 -7.222 1.00 0.00 N ATOM 628 CA GLN A 44 -2.013 0.913 -8.523 1.00 0.00 C ATOM 629 C GLN A 44 -1.366 -0.468 -8.513 1.00 0.00 C ATOM 630 O GLN A 44 -0.188 -0.611 -8.182 1.00 0.00 O ATOM 631 CB GLN A 44 -1.376 1.780 -9.611 1.00 0.00 C ATOM 632 CG GLN A 44 -2.238 2.959 -10.031 1.00 0.00 C ATOM 633 CD GLN A 44 -2.263 4.063 -8.993 1.00 0.00 C ATOM 634 OE1 GLN A 44 -3.313 4.380 -8.432 1.00 0.00 O ATOM 635 NE2 GLN A 44 -1.105 4.657 -8.731 1.00 0.00 N ATOM 0 H GLN A 44 -0.927 1.632 -6.881 1.00 0.00 H new ATOM 0 HA GLN A 44 -3.075 0.795 -8.738 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -0.416 2.152 -9.252 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -1.172 1.161 -10.484 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -1.864 3.360 -10.973 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -3.256 2.614 -10.213 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -0.259 4.363 -9.219 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -1.061 5.407 -8.042 1.00 0.00 H new ATOM 644 N LEU A 45 -2.142 -1.483 -8.877 1.00 0.00 N ATOM 645 CA LEU A 45 -1.644 -2.854 -8.910 1.00 0.00 C ATOM 646 C LEU A 45 -1.547 -3.363 -10.344 1.00 0.00 C ATOM 647 O LEU A 45 -2.561 -3.566 -11.012 1.00 0.00 O ATOM 648 CB LEU A 45 -2.558 -3.768 -8.093 1.00 0.00 C ATOM 649 CG LEU A 45 -2.358 -5.271 -8.294 1.00 0.00 C ATOM 650 CD1 LEU A 45 -0.960 -5.686 -7.861 1.00 0.00 C ATOM 651 CD2 LEU A 45 -3.411 -6.057 -7.528 1.00 0.00 C ATOM 0 H LEU A 45 -3.119 -1.383 -9.153 1.00 0.00 H new ATOM 0 HA LEU A 45 -0.646 -2.863 -8.473 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -2.415 -3.541 -7.037 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -3.592 -3.524 -8.335 1.00 0.00 H new ATOM 0 HG LEU A 45 -2.469 -5.494 -9.355 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -0.836 -6.758 -8.011 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -0.221 -5.149 -8.455 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -0.820 -5.449 -6.806 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -3.253 -7.124 -7.683 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -3.333 -5.829 -6.465 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -4.403 -5.782 -7.886 1.00 0.00 H new ATOM 663 N ASP A 46 -0.320 -3.570 -10.811 1.00 0.00 N ATOM 664 CA ASP A 46 -0.090 -4.060 -12.165 1.00 0.00 C ATOM 665 C ASP A 46 -0.719 -3.126 -13.195 1.00 0.00 C ATOM 666 O ASP A 46 -1.354 -3.575 -14.149 1.00 0.00 O ATOM 667 CB ASP A 46 -0.658 -5.471 -12.324 1.00 0.00 C ATOM 668 CG ASP A 46 -0.216 -6.401 -11.211 1.00 0.00 C ATOM 669 OD1 ASP A 46 0.944 -6.281 -10.764 1.00 0.00 O ATOM 670 OD2 ASP A 46 -1.029 -7.250 -10.789 1.00 0.00 O ATOM 0 H ASP A 46 0.530 -3.406 -10.272 1.00 0.00 H new ATOM 0 HA ASP A 46 0.986 -4.089 -12.336 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -1.747 -5.422 -12.342 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -0.342 -5.881 -13.283 1.00 0.00 H new ATOM 675 N GLY A 47 -0.539 -1.824 -12.994 1.00 0.00 N ATOM 676 CA GLY A 47 -1.096 -0.848 -13.912 1.00 0.00 C ATOM 677 C GLY A 47 -2.611 -0.822 -13.882 1.00 0.00 C ATOM 678 O GLY A 47 -3.259 -0.692 -14.921 1.00 0.00 O ATOM 0 H GLY A 47 -0.017 -1.428 -12.212 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -0.714 0.141 -13.661 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -0.760 -1.073 -14.924 1.00 0.00 H new ATOM 682 N LYS A 48 -3.180 -0.947 -12.688 1.00 0.00 N ATOM 683 CA LYS A 48 -4.629 -0.938 -12.525 1.00 0.00 C ATOM 684 C LYS A 48 -5.022 -0.318 -11.188 1.00 0.00 C ATOM 685 O LYS A 48 -4.329 -0.464 -10.181 1.00 0.00 O ATOM 686 CB LYS A 48 -5.182 -2.362 -12.621 1.00 0.00 C ATOM 687 CG LYS A 48 -4.975 -3.005 -13.981 1.00 0.00 C ATOM 688 CD LYS A 48 -5.867 -4.221 -14.165 1.00 0.00 C ATOM 689 CE LYS A 48 -5.255 -5.462 -13.534 1.00 0.00 C ATOM 690 NZ LYS A 48 -5.395 -5.457 -12.052 1.00 0.00 N ATOM 0 H LYS A 48 -2.659 -1.056 -11.818 1.00 0.00 H new ATOM 0 HA LYS A 48 -5.056 -0.334 -13.325 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -4.705 -2.980 -11.860 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -6.248 -2.345 -12.395 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -5.185 -2.277 -14.764 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -3.931 -3.299 -14.090 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -6.843 -4.028 -13.719 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -6.031 -4.396 -15.228 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -5.736 -6.351 -13.941 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -4.199 -5.521 -13.799 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -5.593 -6.422 -11.719 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -4.512 -5.116 -11.621 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -6.178 -4.829 -11.779 1.00 0.00 H new ATOM 704 N PRO A 49 -6.161 0.391 -11.176 1.00 0.00 N ATOM 705 CA PRO A 49 -6.672 1.046 -9.968 1.00 0.00 C ATOM 706 C PRO A 49 -7.170 0.044 -8.932 1.00 0.00 C ATOM 707 O PRO A 49 -8.200 -0.602 -9.122 1.00 0.00 O ATOM 708 CB PRO A 49 -7.833 1.896 -10.491 1.00 0.00 C ATOM 709 CG PRO A 49 -8.276 1.208 -11.736 1.00 0.00 C ATOM 710 CD PRO A 49 -7.036 0.607 -12.340 1.00 0.00 C ATOM 0 HA PRO A 49 -5.900 1.622 -9.458 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -8.641 1.954 -9.762 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -7.514 2.918 -10.696 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -9.015 0.438 -11.515 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -8.745 1.911 -12.425 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -7.253 -0.327 -12.858 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -6.578 1.277 -13.068 1.00 0.00 H new ATOM 718 N VAL A 50 -6.431 -0.081 -7.834 1.00 0.00 N ATOM 719 CA VAL A 50 -6.798 -1.003 -6.766 1.00 0.00 C ATOM 720 C VAL A 50 -7.656 -0.311 -5.713 1.00 0.00 C ATOM 721 O VAL A 50 -7.208 0.623 -5.048 1.00 0.00 O ATOM 722 CB VAL A 50 -5.551 -1.599 -6.086 1.00 0.00 C ATOM 723 CG1 VAL A 50 -4.843 -0.544 -5.250 1.00 0.00 C ATOM 724 CG2 VAL A 50 -5.933 -2.800 -5.233 1.00 0.00 C ATOM 0 H VAL A 50 -5.574 0.445 -7.661 1.00 0.00 H new ATOM 0 HA VAL A 50 -7.372 -1.808 -7.226 1.00 0.00 H new ATOM 0 HB VAL A 50 -4.862 -1.936 -6.860 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -3.965 -0.983 -4.777 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -4.535 0.282 -5.891 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -5.521 -0.173 -4.481 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -5.040 -3.209 -4.760 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -6.641 -2.490 -4.465 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -6.391 -3.562 -5.863 1.00 0.00 H new ATOM 734 N ARG A 51 -8.892 -0.777 -5.566 1.00 0.00 N ATOM 735 CA ARG A 51 -9.814 -0.202 -4.593 1.00 0.00 C ATOM 736 C ARG A 51 -10.254 -1.251 -3.576 1.00 0.00 C ATOM 737 O ARG A 51 -10.285 -2.449 -3.857 1.00 0.00 O ATOM 738 CB ARG A 51 -11.038 0.381 -5.302 1.00 0.00 C ATOM 739 CG ARG A 51 -11.823 -0.643 -6.105 1.00 0.00 C ATOM 740 CD ARG A 51 -11.348 -0.702 -7.549 1.00 0.00 C ATOM 741 NE ARG A 51 -11.370 0.612 -8.186 1.00 0.00 N ATOM 742 CZ ARG A 51 -12.477 1.192 -8.637 1.00 0.00 C ATOM 743 NH1 ARG A 51 -13.646 0.577 -8.520 1.00 0.00 N ATOM 744 NH2 ARG A 51 -12.416 2.389 -9.205 1.00 0.00 N ATOM 0 H ARG A 51 -9.278 -1.550 -6.108 1.00 0.00 H new ATOM 0 HA ARG A 51 -9.294 0.597 -4.064 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -11.697 0.831 -4.560 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -10.715 1.181 -5.967 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -11.717 -1.626 -5.646 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -12.883 -0.392 -6.080 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -10.335 -1.104 -7.581 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -11.981 -1.388 -8.111 1.00 0.00 H new ATOM 0 HE ARG A 51 -10.487 1.112 -8.290 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -13.697 -0.343 -8.083 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -14.495 1.024 -8.867 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -11.519 2.865 -9.296 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -13.267 2.833 -9.551 1.00 0.00 H new ATOM 758 N PRO A 52 -10.603 -0.791 -2.365 1.00 0.00 N ATOM 759 CA PRO A 52 -11.048 -1.672 -1.282 1.00 0.00 C ATOM 760 C PRO A 52 -12.420 -2.279 -1.554 1.00 0.00 C ATOM 761 O PRO A 52 -13.427 -1.572 -1.586 1.00 0.00 O ATOM 762 CB PRO A 52 -11.107 -0.741 -0.068 1.00 0.00 C ATOM 763 CG PRO A 52 -11.315 0.617 -0.643 1.00 0.00 C ATOM 764 CD PRO A 52 -10.591 0.625 -1.961 1.00 0.00 C ATOM 0 HA PRO A 52 -10.381 -2.524 -1.151 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -11.921 -1.016 0.603 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -10.186 -0.788 0.513 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -12.376 0.824 -0.780 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -10.923 1.386 0.022 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -11.095 1.256 -2.693 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -9.575 1.005 -1.859 1.00 0.00 H new ATOM 772 N ASP A 53 -12.452 -3.593 -1.750 1.00 0.00 N ATOM 773 CA ASP A 53 -13.701 -4.296 -2.018 1.00 0.00 C ATOM 774 C ASP A 53 -14.064 -5.220 -0.860 1.00 0.00 C ATOM 775 O ASP A 53 -15.024 -4.972 -0.131 1.00 0.00 O ATOM 776 CB ASP A 53 -13.591 -5.100 -3.314 1.00 0.00 C ATOM 777 CG ASP A 53 -13.956 -4.281 -4.537 1.00 0.00 C ATOM 778 OD1 ASP A 53 -13.485 -3.130 -4.642 1.00 0.00 O ATOM 779 OD2 ASP A 53 -14.715 -4.792 -5.388 1.00 0.00 O ATOM 0 H ASP A 53 -11.627 -4.192 -1.728 1.00 0.00 H new ATOM 0 HA ASP A 53 -14.491 -3.553 -2.127 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -12.573 -5.473 -3.421 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -14.245 -5.970 -3.255 1.00 0.00 H new ATOM 784 N SER A 54 -13.290 -6.289 -0.698 1.00 0.00 N ATOM 785 CA SER A 54 -13.533 -7.254 0.368 1.00 0.00 C ATOM 786 C SER A 54 -12.239 -7.589 1.102 1.00 0.00 C ATOM 787 O SER A 54 -12.132 -7.400 2.314 1.00 0.00 O ATOM 788 CB SER A 54 -14.155 -8.530 -0.203 1.00 0.00 C ATOM 789 OG SER A 54 -14.718 -9.327 0.825 1.00 0.00 O ATOM 0 H SER A 54 -12.490 -6.508 -1.291 1.00 0.00 H new ATOM 0 HA SER A 54 -14.228 -6.807 1.079 1.00 0.00 H new ATOM 0 HB2 SER A 54 -14.925 -8.270 -0.929 1.00 0.00 H new ATOM 0 HB3 SER A 54 -13.395 -9.102 -0.736 1.00 0.00 H new ATOM 0 HG SER A 54 -15.110 -10.136 0.434 1.00 0.00 H new ATOM 795 N ALA A 55 -11.257 -8.089 0.359 1.00 0.00 N ATOM 796 CA ALA A 55 -9.968 -8.449 0.938 1.00 0.00 C ATOM 797 C ALA A 55 -9.095 -7.217 1.144 1.00 0.00 C ATOM 798 O ALA A 55 -8.393 -7.101 2.149 1.00 0.00 O ATOM 799 CB ALA A 55 -9.256 -9.461 0.052 1.00 0.00 C ATOM 0 H ALA A 55 -11.329 -8.254 -0.645 1.00 0.00 H new ATOM 0 HA ALA A 55 -10.149 -8.900 1.914 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -8.295 -9.721 0.496 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -9.868 -10.358 -0.040 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -9.094 -9.030 -0.936 1.00 0.00 H new ATOM 805 N HIS A 56 -9.142 -6.297 0.185 1.00 0.00 N ATOM 806 CA HIS A 56 -8.354 -5.072 0.262 1.00 0.00 C ATOM 807 C HIS A 56 -9.007 -4.064 1.202 1.00 0.00 C ATOM 808 O HIS A 56 -10.190 -3.747 1.067 1.00 0.00 O ATOM 809 CB HIS A 56 -8.190 -4.458 -1.129 1.00 0.00 C ATOM 810 CG HIS A 56 -7.593 -5.396 -2.131 1.00 0.00 C ATOM 811 ND1 HIS A 56 -8.312 -6.402 -2.742 1.00 0.00 N ATOM 812 CD2 HIS A 56 -6.338 -5.477 -2.631 1.00 0.00 C ATOM 813 CE1 HIS A 56 -7.524 -7.062 -3.572 1.00 0.00 C ATOM 814 NE2 HIS A 56 -6.321 -6.520 -3.524 1.00 0.00 N ATOM 0 H HIS A 56 -9.717 -6.377 -0.654 1.00 0.00 H new ATOM 0 HA HIS A 56 -7.370 -5.326 0.657 1.00 0.00 H new ATOM 0 HB2 HIS A 56 -9.165 -4.128 -1.488 1.00 0.00 H new ATOM 0 HB3 HIS A 56 -7.561 -3.571 -1.054 1.00 0.00 H new ATOM 0 HD2 HIS A 56 -5.505 -4.840 -2.375 1.00 0.00 H new ATOM 0 HE1 HIS A 56 -7.814 -7.902 -4.185 1.00 0.00 H new ATOM 0 HE2 HIS A 56 -5.511 -6.826 -4.063 1.00 0.00 H new ATOM 822 N LYS A 57 -8.231 -3.562 2.157 1.00 0.00 N ATOM 823 CA LYS A 57 -8.733 -2.590 3.120 1.00 0.00 C ATOM 824 C LYS A 57 -7.822 -1.367 3.184 1.00 0.00 C ATOM 825 O LYS A 57 -6.723 -1.429 3.733 1.00 0.00 O ATOM 826 CB LYS A 57 -8.846 -3.227 4.507 1.00 0.00 C ATOM 827 CG LYS A 57 -9.431 -2.298 5.557 1.00 0.00 C ATOM 828 CD LYS A 57 -9.051 -2.735 6.962 1.00 0.00 C ATOM 829 CE LYS A 57 -9.942 -3.865 7.454 1.00 0.00 C ATOM 830 NZ LYS A 57 -9.672 -4.203 8.879 1.00 0.00 N ATOM 0 H LYS A 57 -7.251 -3.813 2.284 1.00 0.00 H new ATOM 0 HA LYS A 57 -9.722 -2.269 2.792 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -9.467 -4.120 4.438 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -7.857 -3.551 4.831 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -9.077 -1.282 5.383 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -10.517 -2.278 5.462 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -8.010 -3.059 6.974 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -9.129 -1.886 7.642 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -10.988 -3.579 7.340 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -9.784 -4.748 6.835 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -10.299 -4.977 9.177 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -8.681 -4.500 8.983 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -9.847 -3.368 9.473 1.00 0.00 H new ATOM 844 N MET A 58 -8.289 -0.258 2.619 1.00 0.00 N ATOM 845 CA MET A 58 -7.517 0.979 2.615 1.00 0.00 C ATOM 846 C MET A 58 -7.937 1.886 3.767 1.00 0.00 C ATOM 847 O MET A 58 -9.105 2.258 3.884 1.00 0.00 O ATOM 848 CB MET A 58 -7.695 1.711 1.283 1.00 0.00 C ATOM 849 CG MET A 58 -6.847 1.140 0.158 1.00 0.00 C ATOM 850 SD MET A 58 -7.171 -0.609 -0.137 1.00 0.00 S ATOM 851 CE MET A 58 -7.336 -0.626 -1.921 1.00 0.00 C ATOM 0 H MET A 58 -9.197 -0.191 2.159 1.00 0.00 H new ATOM 0 HA MET A 58 -6.465 0.722 2.743 1.00 0.00 H new ATOM 0 HB2 MET A 58 -8.745 1.670 0.993 1.00 0.00 H new ATOM 0 HB3 MET A 58 -7.443 2.763 1.419 1.00 0.00 H new ATOM 0 HG2 MET A 58 -7.039 1.700 -0.757 1.00 0.00 H new ATOM 0 HG3 MET A 58 -5.792 1.275 0.399 1.00 0.00 H new ATOM 0 HE1 MET A 58 -7.993 -1.443 -2.218 1.00 0.00 H new ATOM 0 HE2 MET A 58 -7.760 0.321 -2.256 1.00 0.00 H new ATOM 0 HE3 MET A 58 -6.355 -0.766 -2.376 1.00 0.00 H new ATOM 861 N LEU A 59 -6.978 2.239 4.616 1.00 0.00 N ATOM 862 CA LEU A 59 -7.248 3.102 5.760 1.00 0.00 C ATOM 863 C LEU A 59 -6.778 4.528 5.489 1.00 0.00 C ATOM 864 O LEU A 59 -5.749 4.742 4.849 1.00 0.00 O ATOM 865 CB LEU A 59 -6.560 2.555 7.011 1.00 0.00 C ATOM 866 CG LEU A 59 -7.008 1.167 7.471 1.00 0.00 C ATOM 867 CD1 LEU A 59 -6.078 0.637 8.552 1.00 0.00 C ATOM 868 CD2 LEU A 59 -8.443 1.210 7.974 1.00 0.00 C ATOM 0 H LEU A 59 -6.006 1.941 4.533 1.00 0.00 H new ATOM 0 HA LEU A 59 -8.325 3.119 5.924 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -5.486 2.526 6.827 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -6.725 3.257 7.828 1.00 0.00 H new ATOM 0 HG LEU A 59 -6.963 0.490 6.618 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -6.412 -0.351 8.867 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -5.064 0.569 8.158 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -6.090 1.314 9.406 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -8.745 0.214 8.297 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -8.514 1.901 8.814 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -9.100 1.546 7.172 1.00 0.00 H new ATOM 880 N VAL A 60 -7.538 5.500 5.984 1.00 0.00 N ATOM 881 CA VAL A 60 -7.198 6.906 5.798 1.00 0.00 C ATOM 882 C VAL A 60 -7.098 7.628 7.137 1.00 0.00 C ATOM 883 O VAL A 60 -8.111 7.988 7.737 1.00 0.00 O ATOM 884 CB VAL A 60 -8.237 7.623 4.916 1.00 0.00 C ATOM 885 CG1 VAL A 60 -7.845 9.078 4.705 1.00 0.00 C ATOM 886 CG2 VAL A 60 -8.391 6.905 3.584 1.00 0.00 C ATOM 0 H VAL A 60 -8.393 5.340 6.517 1.00 0.00 H new ATOM 0 HA VAL A 60 -6.229 6.935 5.300 1.00 0.00 H new ATOM 0 HB VAL A 60 -9.199 7.601 5.427 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -8.591 9.569 4.079 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -7.791 9.584 5.669 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -6.872 9.125 4.215 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -9.129 7.425 2.973 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -7.433 6.893 3.064 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -8.721 5.881 3.759 1.00 0.00 H new ATOM 896 N ARG A 61 -5.869 7.838 7.600 1.00 0.00 N ATOM 897 CA ARG A 61 -5.637 8.517 8.868 1.00 0.00 C ATOM 898 C ARG A 61 -5.726 10.031 8.699 1.00 0.00 C ATOM 899 O ARG A 61 -5.643 10.546 7.584 1.00 0.00 O ATOM 900 CB ARG A 61 -4.266 8.136 9.431 1.00 0.00 C ATOM 901 CG ARG A 61 -3.926 6.665 9.261 1.00 0.00 C ATOM 902 CD ARG A 61 -4.415 5.839 10.441 1.00 0.00 C ATOM 903 NE ARG A 61 -4.135 6.490 11.718 1.00 0.00 N ATOM 904 CZ ARG A 61 -4.789 6.217 12.842 1.00 0.00 C ATOM 905 NH1 ARG A 61 -5.755 5.308 12.846 1.00 0.00 N ATOM 906 NH2 ARG A 61 -4.476 6.851 13.964 1.00 0.00 N ATOM 0 H ARG A 61 -5.020 7.547 7.115 1.00 0.00 H new ATOM 0 HA ARG A 61 -6.411 8.201 9.567 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -3.501 8.736 8.939 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -4.235 8.387 10.491 1.00 0.00 H new ATOM 0 HG2 ARG A 61 -4.377 6.290 8.342 1.00 0.00 H new ATOM 0 HG3 ARG A 61 -2.847 6.550 9.157 1.00 0.00 H new ATOM 0 HD2 ARG A 61 -5.488 5.672 10.347 1.00 0.00 H new ATOM 0 HD3 ARG A 61 -3.937 4.860 10.421 1.00 0.00 H new ATOM 0 HE ARG A 61 -3.397 7.193 11.749 1.00 0.00 H new ATOM 0 HH11 ARG A 61 -5.997 4.817 11.985 1.00 0.00 H new ATOM 0 HH12 ARG A 61 -6.256 5.100 13.710 1.00 0.00 H new ATOM 0 HH21 ARG A 61 -3.732 7.549 13.965 1.00 0.00 H new ATOM 0 HH22 ARG A 61 -4.979 6.640 14.826 1.00 0.00 H new ATOM 920 N GLU A 62 -5.896 10.737 9.812 1.00 0.00 N ATOM 921 CA GLU A 62 -5.997 12.192 9.786 1.00 0.00 C ATOM 922 C GLU A 62 -4.628 12.829 9.568 1.00 0.00 C ATOM 923 O GLU A 62 -4.365 13.417 8.520 1.00 0.00 O ATOM 924 CB GLU A 62 -6.609 12.706 11.090 1.00 0.00 C ATOM 925 CG GLU A 62 -8.125 12.611 11.130 1.00 0.00 C ATOM 926 CD GLU A 62 -8.746 13.594 12.104 1.00 0.00 C ATOM 927 OE1 GLU A 62 -8.355 13.581 13.290 1.00 0.00 O ATOM 928 OE2 GLU A 62 -9.622 14.376 11.680 1.00 0.00 O ATOM 0 H GLU A 62 -5.967 10.326 10.743 1.00 0.00 H new ATOM 0 HA GLU A 62 -6.644 12.471 8.955 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -6.196 12.139 11.924 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -6.315 13.745 11.235 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -8.523 12.794 10.132 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -8.415 11.598 11.408 1.00 0.00 H new ATOM 935 N ASN A 63 -3.759 12.707 10.566 1.00 0.00 N ATOM 936 CA ASN A 63 -2.417 13.271 10.485 1.00 0.00 C ATOM 937 C ASN A 63 -1.859 13.146 9.070 1.00 0.00 C ATOM 938 O ASN A 63 -1.392 14.123 8.487 1.00 0.00 O ATOM 939 CB ASN A 63 -1.485 12.571 11.476 1.00 0.00 C ATOM 940 CG ASN A 63 -1.996 12.648 12.902 1.00 0.00 C ATOM 941 OD1 ASN A 63 -2.811 13.508 13.236 1.00 0.00 O ATOM 942 ND2 ASN A 63 -1.518 11.746 13.751 1.00 0.00 N ATOM 0 H ASN A 63 -3.960 12.222 11.441 1.00 0.00 H new ATOM 0 HA ASN A 63 -2.479 14.329 10.741 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -1.373 11.525 11.189 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -0.495 13.024 11.422 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -1.825 11.748 14.724 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -0.844 11.051 13.431 1.00 0.00 H new ATOM 949 N GLY A 64 -1.912 11.935 8.524 1.00 0.00 N ATOM 950 CA GLY A 64 -1.409 11.703 7.183 1.00 0.00 C ATOM 951 C GLY A 64 -0.677 10.382 7.058 1.00 0.00 C ATOM 952 O GLY A 64 0.553 10.347 7.001 1.00 0.00 O ATOM 0 H GLY A 64 -2.294 11.110 8.987 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -2.240 11.722 6.478 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -0.737 12.515 6.905 1.00 0.00 H new ATOM 956 N VAL A 65 -1.433 9.290 7.016 1.00 0.00 N ATOM 957 CA VAL A 65 -0.849 7.959 6.898 1.00 0.00 C ATOM 958 C VAL A 65 -1.832 6.982 6.262 1.00 0.00 C ATOM 959 O VAL A 65 -2.912 6.734 6.797 1.00 0.00 O ATOM 960 CB VAL A 65 -0.415 7.412 8.271 1.00 0.00 C ATOM 961 CG1 VAL A 65 -0.249 5.901 8.216 1.00 0.00 C ATOM 962 CG2 VAL A 65 0.872 8.083 8.728 1.00 0.00 C ATOM 0 H VAL A 65 -2.452 9.301 7.062 1.00 0.00 H new ATOM 0 HA VAL A 65 0.029 8.055 6.259 1.00 0.00 H new ATOM 0 HB VAL A 65 -1.195 7.641 8.998 1.00 0.00 H new ATOM 0 HG11 VAL A 65 0.058 5.533 9.195 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -1.197 5.441 7.936 1.00 0.00 H new ATOM 0 HG13 VAL A 65 0.511 5.645 7.478 1.00 0.00 H new ATOM 0 HG21 VAL A 65 1.165 7.685 9.700 1.00 0.00 H new ATOM 0 HG22 VAL A 65 1.662 7.887 8.003 1.00 0.00 H new ATOM 0 HG23 VAL A 65 0.713 9.158 8.809 1.00 0.00 H new ATOM 972 N HIS A 66 -1.449 6.429 5.115 1.00 0.00 N ATOM 973 CA HIS A 66 -2.296 5.477 4.405 1.00 0.00 C ATOM 974 C HIS A 66 -1.779 4.052 4.582 1.00 0.00 C ATOM 975 O HIS A 66 -0.574 3.808 4.527 1.00 0.00 O ATOM 976 CB HIS A 66 -2.359 5.828 2.919 1.00 0.00 C ATOM 977 CG HIS A 66 -3.393 6.861 2.591 1.00 0.00 C ATOM 978 ND1 HIS A 66 -4.318 6.706 1.580 1.00 0.00 N ATOM 979 CD2 HIS A 66 -3.645 8.069 3.147 1.00 0.00 C ATOM 980 CE1 HIS A 66 -5.093 7.774 1.528 1.00 0.00 C ATOM 981 NE2 HIS A 66 -4.706 8.617 2.469 1.00 0.00 N ATOM 0 H HIS A 66 -0.558 6.624 4.658 1.00 0.00 H new ATOM 0 HA HIS A 66 -3.299 5.536 4.827 1.00 0.00 H new ATOM 0 HB2 HIS A 66 -1.382 6.189 2.598 1.00 0.00 H new ATOM 0 HB3 HIS A 66 -2.568 4.923 2.349 1.00 0.00 H new ATOM 0 HD2 HIS A 66 -3.111 8.519 3.971 1.00 0.00 H new ATOM 0 HE1 HIS A 66 -5.905 7.932 0.834 1.00 0.00 H new ATOM 0 HE2 HIS A 66 -5.127 9.526 2.661 1.00 0.00 H new ATOM 989 N SER A 67 -2.698 3.116 4.795 1.00 0.00 N ATOM 990 CA SER A 67 -2.335 1.717 4.985 1.00 0.00 C ATOM 991 C SER A 67 -3.134 0.816 4.048 1.00 0.00 C ATOM 992 O SER A 67 -4.321 1.045 3.810 1.00 0.00 O ATOM 993 CB SER A 67 -2.571 1.299 6.437 1.00 0.00 C ATOM 994 OG SER A 67 -1.553 1.801 7.285 1.00 0.00 O ATOM 0 H SER A 67 -3.700 3.301 4.840 1.00 0.00 H new ATOM 0 HA SER A 67 -1.276 1.607 4.751 1.00 0.00 H new ATOM 0 HB2 SER A 67 -3.541 1.667 6.771 1.00 0.00 H new ATOM 0 HB3 SER A 67 -2.602 0.212 6.505 1.00 0.00 H new ATOM 0 HG SER A 67 -1.728 1.521 8.208 1.00 0.00 H new ATOM 1000 N LEU A 68 -2.475 -0.209 3.519 1.00 0.00 N ATOM 1001 CA LEU A 68 -3.123 -1.146 2.607 1.00 0.00 C ATOM 1002 C LEU A 68 -3.097 -2.562 3.173 1.00 0.00 C ATOM 1003 O LEU A 68 -2.103 -3.276 3.038 1.00 0.00 O ATOM 1004 CB LEU A 68 -2.435 -1.117 1.241 1.00 0.00 C ATOM 1005 CG LEU A 68 -2.916 -2.154 0.226 1.00 0.00 C ATOM 1006 CD1 LEU A 68 -4.312 -1.809 -0.269 1.00 0.00 C ATOM 1007 CD2 LEU A 68 -1.943 -2.248 -0.941 1.00 0.00 C ATOM 0 H LEU A 68 -1.493 -0.413 3.706 1.00 0.00 H new ATOM 0 HA LEU A 68 -4.163 -0.841 2.489 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -2.570 -0.125 0.809 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -1.364 -1.255 1.393 1.00 0.00 H new ATOM 0 HG LEU A 68 -2.957 -3.125 0.719 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -4.638 -2.558 -0.991 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -5.003 -1.792 0.574 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -4.297 -0.829 -0.745 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -2.301 -2.991 -1.654 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -1.870 -1.278 -1.433 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -0.960 -2.543 -0.573 1.00 0.00 H new ATOM 1019 N ILE A 69 -4.196 -2.962 3.804 1.00 0.00 N ATOM 1020 CA ILE A 69 -4.299 -4.294 4.386 1.00 0.00 C ATOM 1021 C ILE A 69 -5.032 -5.249 3.449 1.00 0.00 C ATOM 1022 O ILE A 69 -6.173 -4.998 3.060 1.00 0.00 O ATOM 1023 CB ILE A 69 -5.030 -4.261 5.741 1.00 0.00 C ATOM 1024 CG1 ILE A 69 -4.268 -3.382 6.735 1.00 0.00 C ATOM 1025 CG2 ILE A 69 -5.195 -5.670 6.289 1.00 0.00 C ATOM 1026 CD1 ILE A 69 -5.046 -3.082 7.997 1.00 0.00 C ATOM 0 H ILE A 69 -5.027 -2.383 3.925 1.00 0.00 H new ATOM 0 HA ILE A 69 -3.280 -4.650 4.540 1.00 0.00 H new ATOM 0 HB ILE A 69 -6.021 -3.833 5.592 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -3.334 -3.876 7.003 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -4.004 -2.443 6.249 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -5.713 -5.629 7.247 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -5.776 -6.268 5.587 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -4.214 -6.124 6.426 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -4.444 -2.455 8.655 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -5.968 -2.560 7.741 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -5.287 -4.015 8.506 1.00 0.00 H new ATOM 1038 N ILE A 70 -4.369 -6.344 3.093 1.00 0.00 N ATOM 1039 CA ILE A 70 -4.959 -7.337 2.204 1.00 0.00 C ATOM 1040 C ILE A 70 -5.112 -8.682 2.907 1.00 0.00 C ATOM 1041 O ILE A 70 -4.128 -9.286 3.333 1.00 0.00 O ATOM 1042 CB ILE A 70 -4.111 -7.529 0.933 1.00 0.00 C ATOM 1043 CG1 ILE A 70 -3.706 -6.172 0.354 1.00 0.00 C ATOM 1044 CG2 ILE A 70 -4.879 -8.343 -0.098 1.00 0.00 C ATOM 1045 CD1 ILE A 70 -2.445 -6.223 -0.480 1.00 0.00 C ATOM 0 H ILE A 70 -3.424 -6.566 3.406 1.00 0.00 H new ATOM 0 HA ILE A 70 -5.943 -6.963 1.922 1.00 0.00 H new ATOM 0 HB ILE A 70 -3.205 -8.075 1.197 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -4.522 -5.789 -0.259 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -3.563 -5.465 1.171 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -4.267 -8.470 -0.991 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -5.122 -9.321 0.318 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -5.800 -7.822 -0.361 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -2.218 -5.226 -0.858 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -1.616 -6.575 0.134 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -2.590 -6.904 -1.318 1.00 0.00 H new ATOM 1057 N GLU A 71 -6.353 -9.145 3.024 1.00 0.00 N ATOM 1058 CA GLU A 71 -6.634 -10.419 3.674 1.00 0.00 C ATOM 1059 C GLU A 71 -8.062 -10.874 3.384 1.00 0.00 C ATOM 1060 O GLU A 71 -9.032 -10.158 3.633 1.00 0.00 O ATOM 1061 CB GLU A 71 -6.421 -10.303 5.185 1.00 0.00 C ATOM 1062 CG GLU A 71 -6.373 -11.645 5.897 1.00 0.00 C ATOM 1063 CD GLU A 71 -7.750 -12.156 6.274 1.00 0.00 C ATOM 1064 OE1 GLU A 71 -8.735 -11.420 6.059 1.00 0.00 O ATOM 1065 OE2 GLU A 71 -7.841 -13.292 6.785 1.00 0.00 O ATOM 0 H GLU A 71 -7.179 -8.657 2.677 1.00 0.00 H new ATOM 0 HA GLU A 71 -5.945 -11.163 3.273 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -5.490 -9.768 5.372 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -7.225 -9.703 5.612 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -5.882 -12.376 5.254 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -5.765 -11.553 6.797 1.00 0.00 H new ATOM 1072 N PRO A 72 -8.194 -12.095 2.844 1.00 0.00 N ATOM 1073 CA PRO A 72 -7.047 -12.957 2.543 1.00 0.00 C ATOM 1074 C PRO A 72 -6.213 -12.426 1.382 1.00 0.00 C ATOM 1075 O PRO A 72 -6.526 -11.385 0.804 1.00 0.00 O ATOM 1076 CB PRO A 72 -7.695 -14.292 2.170 1.00 0.00 C ATOM 1077 CG PRO A 72 -9.057 -13.931 1.686 1.00 0.00 C ATOM 1078 CD PRO A 72 -9.475 -12.728 2.486 1.00 0.00 C ATOM 0 HA PRO A 72 -6.355 -13.024 3.383 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -7.124 -14.807 1.397 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -7.745 -14.961 3.029 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -9.045 -13.706 0.620 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -9.754 -14.757 1.830 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -10.106 -12.057 1.903 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -10.044 -13.012 3.371 1.00 0.00 H new ATOM 1086 N VAL A 73 -5.150 -13.149 1.044 1.00 0.00 N ATOM 1087 CA VAL A 73 -4.272 -12.752 -0.050 1.00 0.00 C ATOM 1088 C VAL A 73 -4.260 -13.802 -1.154 1.00 0.00 C ATOM 1089 O VAL A 73 -4.455 -14.991 -0.899 1.00 0.00 O ATOM 1090 CB VAL A 73 -2.830 -12.524 0.442 1.00 0.00 C ATOM 1091 CG1 VAL A 73 -1.861 -12.509 -0.730 1.00 0.00 C ATOM 1092 CG2 VAL A 73 -2.737 -11.232 1.239 1.00 0.00 C ATOM 0 H VAL A 73 -4.876 -14.013 1.512 1.00 0.00 H new ATOM 0 HA VAL A 73 -4.665 -11.816 -0.447 1.00 0.00 H new ATOM 0 HB VAL A 73 -2.554 -13.349 1.099 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -0.848 -12.347 -0.362 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -1.908 -13.464 -1.254 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -2.131 -11.706 -1.415 1.00 0.00 H new ATOM 0 HG21 VAL A 73 -1.711 -11.087 1.579 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -3.032 -10.393 0.608 1.00 0.00 H new ATOM 0 HG23 VAL A 73 -3.400 -11.288 2.102 1.00 0.00 H new ATOM 1102 N THR A 74 -4.030 -13.356 -2.385 1.00 0.00 N ATOM 1103 CA THR A 74 -3.993 -14.257 -3.531 1.00 0.00 C ATOM 1104 C THR A 74 -2.739 -14.033 -4.367 1.00 0.00 C ATOM 1105 O THR A 74 -2.173 -12.940 -4.373 1.00 0.00 O ATOM 1106 CB THR A 74 -5.234 -14.078 -4.426 1.00 0.00 C ATOM 1107 OG1 THR A 74 -5.240 -12.764 -4.996 1.00 0.00 O ATOM 1108 CG2 THR A 74 -6.512 -14.298 -3.632 1.00 0.00 C ATOM 0 H THR A 74 -3.866 -12.376 -2.614 1.00 0.00 H new ATOM 0 HA THR A 74 -3.984 -15.272 -3.135 1.00 0.00 H new ATOM 0 HB THR A 74 -5.190 -14.820 -5.223 1.00 0.00 H new ATOM 0 HG1 THR A 74 -6.031 -12.658 -5.565 1.00 0.00 H new ATOM 0 HG21 THR A 74 -7.374 -14.166 -4.286 1.00 0.00 H new ATOM 0 HG22 THR A 74 -6.517 -15.309 -3.224 1.00 0.00 H new ATOM 0 HG23 THR A 74 -6.562 -13.577 -2.816 1.00 0.00 H new ATOM 1116 N SER A 75 -2.310 -15.073 -5.074 1.00 0.00 N ATOM 1117 CA SER A 75 -1.120 -14.990 -5.912 1.00 0.00 C ATOM 1118 C SER A 75 -1.074 -13.660 -6.659 1.00 0.00 C ATOM 1119 O SER A 75 0.000 -13.118 -6.918 1.00 0.00 O ATOM 1120 CB SER A 75 -1.091 -16.149 -6.910 1.00 0.00 C ATOM 1121 OG SER A 75 -2.255 -16.155 -7.719 1.00 0.00 O ATOM 0 H SER A 75 -2.769 -15.984 -5.083 1.00 0.00 H new ATOM 0 HA SER A 75 -0.245 -15.055 -5.265 1.00 0.00 H new ATOM 0 HB2 SER A 75 -0.206 -16.067 -7.541 1.00 0.00 H new ATOM 0 HB3 SER A 75 -1.013 -17.094 -6.372 1.00 0.00 H new ATOM 0 HG SER A 75 -2.211 -16.904 -8.349 1.00 0.00 H new ATOM 1127 N ARG A 76 -2.248 -13.141 -7.003 1.00 0.00 N ATOM 1128 CA ARG A 76 -2.343 -11.876 -7.721 1.00 0.00 C ATOM 1129 C ARG A 76 -1.696 -10.748 -6.922 1.00 0.00 C ATOM 1130 O ARG A 76 -0.936 -9.946 -7.465 1.00 0.00 O ATOM 1131 CB ARG A 76 -3.807 -11.537 -8.009 1.00 0.00 C ATOM 1132 CG ARG A 76 -4.424 -12.386 -9.108 1.00 0.00 C ATOM 1133 CD ARG A 76 -5.841 -11.938 -9.429 1.00 0.00 C ATOM 1134 NE ARG A 76 -6.817 -12.503 -8.501 1.00 0.00 N ATOM 1135 CZ ARG A 76 -7.284 -13.743 -8.590 1.00 0.00 C ATOM 1136 NH1 ARG A 76 -6.866 -14.544 -9.560 1.00 0.00 N ATOM 1137 NH2 ARG A 76 -8.170 -14.185 -7.707 1.00 0.00 N ATOM 0 H ARG A 76 -3.147 -13.577 -6.796 1.00 0.00 H new ATOM 0 HA ARG A 76 -1.809 -11.982 -8.666 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -4.387 -11.664 -7.095 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -3.879 -10.486 -8.289 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -3.809 -12.323 -10.006 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -4.433 -13.432 -8.800 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -5.894 -10.850 -9.393 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -6.094 -12.236 -10.447 1.00 0.00 H new ATOM 0 HE ARG A 76 -7.159 -11.913 -7.743 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -6.184 -14.208 -10.240 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -7.226 -15.496 -9.626 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -8.493 -13.572 -6.959 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -8.528 -15.138 -7.777 1.00 0.00 H new ATOM 1151 N ASP A 77 -2.005 -10.691 -5.631 1.00 0.00 N ATOM 1152 CA ASP A 77 -1.453 -9.662 -4.758 1.00 0.00 C ATOM 1153 C ASP A 77 0.030 -9.447 -5.040 1.00 0.00 C ATOM 1154 O ASP A 77 0.552 -8.346 -4.868 1.00 0.00 O ATOM 1155 CB ASP A 77 -1.655 -10.046 -3.291 1.00 0.00 C ATOM 1156 CG ASP A 77 -1.666 -8.840 -2.373 1.00 0.00 C ATOM 1157 OD1 ASP A 77 -2.676 -8.105 -2.371 1.00 0.00 O ATOM 1158 OD2 ASP A 77 -0.664 -8.629 -1.657 1.00 0.00 O ATOM 0 H ASP A 77 -2.635 -11.345 -5.166 1.00 0.00 H new ATOM 0 HA ASP A 77 -1.981 -8.730 -4.958 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -2.595 -10.587 -3.186 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -0.860 -10.726 -2.984 1.00 0.00 H new ATOM 1163 N ALA A 78 0.704 -10.507 -5.474 1.00 0.00 N ATOM 1164 CA ALA A 78 2.127 -10.434 -5.782 1.00 0.00 C ATOM 1165 C ALA A 78 2.375 -9.610 -7.041 1.00 0.00 C ATOM 1166 O ALA A 78 2.017 -10.021 -8.144 1.00 0.00 O ATOM 1167 CB ALA A 78 2.706 -11.832 -5.941 1.00 0.00 C ATOM 0 H ALA A 78 0.287 -11.426 -5.620 1.00 0.00 H new ATOM 0 HA ALA A 78 2.628 -9.938 -4.950 1.00 0.00 H new ATOM 0 HB1 ALA A 78 3.769 -11.762 -6.171 1.00 0.00 H new ATOM 0 HB2 ALA A 78 2.571 -12.389 -5.014 1.00 0.00 H new ATOM 0 HB3 ALA A 78 2.193 -12.348 -6.752 1.00 0.00 H new ATOM 1173 N GLY A 79 2.992 -8.444 -6.869 1.00 0.00 N ATOM 1174 CA GLY A 79 3.276 -7.581 -8.000 1.00 0.00 C ATOM 1175 C GLY A 79 4.037 -6.333 -7.600 1.00 0.00 C ATOM 1176 O GLY A 79 4.684 -6.302 -6.553 1.00 0.00 O ATOM 0 H GLY A 79 3.300 -8.082 -5.966 1.00 0.00 H new ATOM 0 HA2 GLY A 79 3.855 -8.135 -8.739 1.00 0.00 H new ATOM 0 HA3 GLY A 79 2.340 -7.294 -8.478 1.00 0.00 H new ATOM 1180 N ILE A 80 3.962 -5.303 -8.436 1.00 0.00 N ATOM 1181 CA ILE A 80 4.650 -4.047 -8.163 1.00 0.00 C ATOM 1182 C ILE A 80 3.658 -2.937 -7.831 1.00 0.00 C ATOM 1183 O ILE A 80 3.011 -2.382 -8.720 1.00 0.00 O ATOM 1184 CB ILE A 80 5.514 -3.607 -9.360 1.00 0.00 C ATOM 1185 CG1 ILE A 80 6.535 -4.693 -9.707 1.00 0.00 C ATOM 1186 CG2 ILE A 80 6.214 -2.292 -9.053 1.00 0.00 C ATOM 1187 CD1 ILE A 80 7.538 -4.952 -8.605 1.00 0.00 C ATOM 0 H ILE A 80 3.432 -5.313 -9.307 1.00 0.00 H new ATOM 0 HA ILE A 80 5.297 -4.222 -7.303 1.00 0.00 H new ATOM 0 HB ILE A 80 4.864 -3.457 -10.222 1.00 0.00 H new ATOM 0 HG12 ILE A 80 6.006 -5.619 -9.931 1.00 0.00 H new ATOM 0 HG13 ILE A 80 7.068 -4.403 -10.612 1.00 0.00 H new ATOM 0 HG21 ILE A 80 6.821 -1.994 -9.908 1.00 0.00 H new ATOM 0 HG22 ILE A 80 5.469 -1.522 -8.851 1.00 0.00 H new ATOM 0 HG23 ILE A 80 6.854 -2.416 -8.180 1.00 0.00 H new ATOM 0 HD11 ILE A 80 8.230 -5.733 -8.919 1.00 0.00 H new ATOM 0 HD12 ILE A 80 8.093 -4.037 -8.396 1.00 0.00 H new ATOM 0 HD13 ILE A 80 7.014 -5.273 -7.704 1.00 0.00 H new ATOM 1199 N TYR A 81 3.545 -2.617 -6.547 1.00 0.00 N ATOM 1200 CA TYR A 81 2.632 -1.574 -6.097 1.00 0.00 C ATOM 1201 C TYR A 81 3.243 -0.191 -6.298 1.00 0.00 C ATOM 1202 O TYR A 81 4.303 0.119 -5.753 1.00 0.00 O ATOM 1203 CB TYR A 81 2.278 -1.778 -4.623 1.00 0.00 C ATOM 1204 CG TYR A 81 1.324 -2.926 -4.382 1.00 0.00 C ATOM 1205 CD1 TYR A 81 1.796 -4.219 -4.194 1.00 0.00 C ATOM 1206 CD2 TYR A 81 -0.049 -2.718 -4.342 1.00 0.00 C ATOM 1207 CE1 TYR A 81 0.928 -5.272 -3.975 1.00 0.00 C ATOM 1208 CE2 TYR A 81 -0.924 -3.764 -4.122 1.00 0.00 C ATOM 1209 CZ TYR A 81 -0.431 -5.039 -3.940 1.00 0.00 C ATOM 1210 OH TYR A 81 -1.299 -6.084 -3.720 1.00 0.00 O ATOM 0 H TYR A 81 4.075 -3.065 -5.799 1.00 0.00 H new ATOM 0 HA TYR A 81 1.723 -1.640 -6.695 1.00 0.00 H new ATOM 0 HB2 TYR A 81 3.194 -1.954 -4.059 1.00 0.00 H new ATOM 0 HB3 TYR A 81 1.835 -0.861 -4.234 1.00 0.00 H new ATOM 0 HD1 TYR A 81 2.860 -4.405 -4.219 1.00 0.00 H new ATOM 0 HD2 TYR A 81 -0.439 -1.721 -4.485 1.00 0.00 H new ATOM 0 HE1 TYR A 81 1.312 -6.271 -3.832 1.00 0.00 H new ATOM 0 HE2 TYR A 81 -1.989 -3.584 -4.093 1.00 0.00 H new ATOM 0 HH TYR A 81 -0.916 -6.909 -4.084 1.00 0.00 H new ATOM 1220 N THR A 82 2.566 0.640 -7.085 1.00 0.00 N ATOM 1221 CA THR A 82 3.041 1.990 -7.360 1.00 0.00 C ATOM 1222 C THR A 82 2.026 3.033 -6.904 1.00 0.00 C ATOM 1223 O THR A 82 0.862 2.997 -7.304 1.00 0.00 O ATOM 1224 CB THR A 82 3.327 2.190 -8.860 1.00 0.00 C ATOM 1225 OG1 THR A 82 4.086 1.087 -9.365 1.00 0.00 O ATOM 1226 CG2 THR A 82 4.087 3.486 -9.097 1.00 0.00 C ATOM 0 H THR A 82 1.687 0.401 -7.543 1.00 0.00 H new ATOM 0 HA THR A 82 3.968 2.120 -6.801 1.00 0.00 H new ATOM 0 HB THR A 82 2.374 2.245 -9.385 1.00 0.00 H new ATOM 0 HG1 THR A 82 4.262 1.221 -10.320 1.00 0.00 H new ATOM 0 HG21 THR A 82 4.278 3.606 -10.163 1.00 0.00 H new ATOM 0 HG22 THR A 82 3.494 4.327 -8.738 1.00 0.00 H new ATOM 0 HG23 THR A 82 5.035 3.455 -8.560 1.00 0.00 H new ATOM 1234 N CYS A 83 2.475 3.961 -6.066 1.00 0.00 N ATOM 1235 CA CYS A 83 1.606 5.015 -5.555 1.00 0.00 C ATOM 1236 C CYS A 83 2.088 6.387 -6.013 1.00 0.00 C ATOM 1237 O CYS A 83 3.290 6.655 -6.044 1.00 0.00 O ATOM 1238 CB CYS A 83 1.550 4.963 -4.028 1.00 0.00 C ATOM 1239 SG CYS A 83 0.263 3.876 -3.372 1.00 0.00 S ATOM 0 H CYS A 83 3.436 4.005 -5.726 1.00 0.00 H new ATOM 0 HA CYS A 83 0.605 4.851 -5.953 1.00 0.00 H new ATOM 0 HB2 CYS A 83 2.517 4.631 -3.651 1.00 0.00 H new ATOM 0 HB3 CYS A 83 1.388 5.971 -3.647 1.00 0.00 H new ATOM 0 HG CYS A 83 0.808 2.953 -2.636 1.00 0.00 H new ATOM 1245 N ILE A 84 1.144 7.252 -6.370 1.00 0.00 N ATOM 1246 CA ILE A 84 1.474 8.596 -6.827 1.00 0.00 C ATOM 1247 C ILE A 84 0.750 9.651 -5.998 1.00 0.00 C ATOM 1248 O ILE A 84 -0.454 9.854 -6.147 1.00 0.00 O ATOM 1249 CB ILE A 84 1.114 8.790 -8.312 1.00 0.00 C ATOM 1250 CG1 ILE A 84 1.965 7.871 -9.190 1.00 0.00 C ATOM 1251 CG2 ILE A 84 1.304 10.244 -8.717 1.00 0.00 C ATOM 1252 CD1 ILE A 84 1.387 6.482 -9.350 1.00 0.00 C ATOM 0 H ILE A 84 0.145 7.046 -6.351 1.00 0.00 H new ATOM 0 HA ILE A 84 2.550 8.716 -6.704 1.00 0.00 H new ATOM 0 HB ILE A 84 0.066 8.528 -8.454 1.00 0.00 H new ATOM 0 HG12 ILE A 84 2.077 8.325 -10.175 1.00 0.00 H new ATOM 0 HG13 ILE A 84 2.963 7.793 -8.759 1.00 0.00 H new ATOM 0 HG21 ILE A 84 1.046 10.365 -9.769 1.00 0.00 H new ATOM 0 HG22 ILE A 84 0.659 10.878 -8.109 1.00 0.00 H new ATOM 0 HG23 ILE A 84 2.344 10.532 -8.563 1.00 0.00 H new ATOM 0 HD11 ILE A 84 2.043 5.886 -9.985 1.00 0.00 H new ATOM 0 HD12 ILE A 84 1.300 6.009 -8.372 1.00 0.00 H new ATOM 0 HD13 ILE A 84 0.401 6.549 -9.809 1.00 0.00 H new ATOM 1264 N ALA A 85 1.494 10.322 -5.124 1.00 0.00 N ATOM 1265 CA ALA A 85 0.924 11.360 -4.274 1.00 0.00 C ATOM 1266 C ALA A 85 1.020 12.729 -4.939 1.00 0.00 C ATOM 1267 O ALA A 85 2.113 13.266 -5.124 1.00 0.00 O ATOM 1268 CB ALA A 85 1.622 11.377 -2.922 1.00 0.00 C ATOM 0 H ALA A 85 2.492 10.165 -4.986 1.00 0.00 H new ATOM 0 HA ALA A 85 -0.131 11.132 -4.123 1.00 0.00 H new ATOM 0 HB1 ALA A 85 1.186 12.157 -2.297 1.00 0.00 H new ATOM 0 HB2 ALA A 85 1.496 10.410 -2.435 1.00 0.00 H new ATOM 0 HB3 ALA A 85 2.684 11.577 -3.063 1.00 0.00 H new ATOM 1274 N THR A 86 -0.131 13.289 -5.298 1.00 0.00 N ATOM 1275 CA THR A 86 -0.176 14.595 -5.944 1.00 0.00 C ATOM 1276 C THR A 86 -0.857 15.627 -5.052 1.00 0.00 C ATOM 1277 O THR A 86 -2.057 15.542 -4.794 1.00 0.00 O ATOM 1278 CB THR A 86 -0.917 14.529 -7.292 1.00 0.00 C ATOM 1279 OG1 THR A 86 -0.598 13.307 -7.968 1.00 0.00 O ATOM 1280 CG2 THR A 86 -0.546 15.713 -8.173 1.00 0.00 C ATOM 0 H THR A 86 -1.044 12.859 -5.152 1.00 0.00 H new ATOM 0 HA THR A 86 0.857 14.896 -6.120 1.00 0.00 H new ATOM 0 HB THR A 86 -1.988 14.565 -7.094 1.00 0.00 H new ATOM 0 HG1 THR A 86 -1.286 13.116 -8.640 1.00 0.00 H new ATOM 0 HG21 THR A 86 -1.082 15.644 -9.120 1.00 0.00 H new ATOM 0 HG22 THR A 86 -0.817 16.641 -7.669 1.00 0.00 H new ATOM 0 HG23 THR A 86 0.527 15.703 -8.362 1.00 0.00 H new ATOM 1288 N ASN A 87 -0.084 16.601 -4.585 1.00 0.00 N ATOM 1289 CA ASN A 87 -0.614 17.650 -3.721 1.00 0.00 C ATOM 1290 C ASN A 87 -0.447 19.022 -4.367 1.00 0.00 C ATOM 1291 O ASN A 87 0.009 19.133 -5.505 1.00 0.00 O ATOM 1292 CB ASN A 87 0.089 17.625 -2.363 1.00 0.00 C ATOM 1293 CG ASN A 87 1.342 18.479 -2.344 1.00 0.00 C ATOM 1294 OD1 ASN A 87 1.916 18.783 -3.390 1.00 0.00 O ATOM 1295 ND2 ASN A 87 1.773 18.871 -1.151 1.00 0.00 N ATOM 0 H ASN A 87 0.912 16.686 -4.790 1.00 0.00 H new ATOM 0 HA ASN A 87 -1.678 17.463 -3.575 1.00 0.00 H new ATOM 0 HB2 ASN A 87 -0.599 17.977 -1.594 1.00 0.00 H new ATOM 0 HB3 ASN A 87 0.349 16.597 -2.111 1.00 0.00 H new ATOM 0 HD21 ASN A 87 2.611 19.448 -1.076 1.00 0.00 H new ATOM 0 HD22 ASN A 87 1.266 18.596 -0.310 1.00 0.00 H new ATOM 1302 N ARG A 88 -0.819 20.065 -3.632 1.00 0.00 N ATOM 1303 CA ARG A 88 -0.712 21.430 -4.133 1.00 0.00 C ATOM 1304 C ARG A 88 0.718 21.739 -4.568 1.00 0.00 C ATOM 1305 O ARG A 88 0.941 22.382 -5.592 1.00 0.00 O ATOM 1306 CB ARG A 88 -1.157 22.426 -3.061 1.00 0.00 C ATOM 1307 CG ARG A 88 -1.056 23.878 -3.499 1.00 0.00 C ATOM 1308 CD ARG A 88 -1.701 24.812 -2.486 1.00 0.00 C ATOM 1309 NE ARG A 88 -3.104 24.481 -2.253 1.00 0.00 N ATOM 1310 CZ ARG A 88 -3.758 24.796 -1.141 1.00 0.00 C ATOM 1311 NH1 ARG A 88 -3.140 25.447 -0.166 1.00 0.00 N ATOM 1312 NH2 ARG A 88 -5.035 24.461 -1.003 1.00 0.00 N ATOM 0 H ARG A 88 -1.197 19.991 -2.688 1.00 0.00 H new ATOM 0 HA ARG A 88 -1.366 21.524 -5.000 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -2.189 22.210 -2.782 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -0.549 22.282 -2.168 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -0.008 24.148 -3.629 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -1.539 24.001 -4.468 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -1.155 24.759 -1.544 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -1.625 25.840 -2.841 1.00 0.00 H new ATOM 0 HE ARG A 88 -3.609 23.981 -2.984 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -2.159 25.708 -0.268 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -3.645 25.687 0.687 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -5.515 23.961 -1.751 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -5.536 24.703 -0.148 1.00 0.00 H new ATOM 1326 N ALA A 89 1.683 21.276 -3.780 1.00 0.00 N ATOM 1327 CA ALA A 89 3.091 21.501 -4.084 1.00 0.00 C ATOM 1328 C ALA A 89 3.469 20.883 -5.426 1.00 0.00 C ATOM 1329 O ALA A 89 3.807 21.592 -6.373 1.00 0.00 O ATOM 1330 CB ALA A 89 3.967 20.935 -2.975 1.00 0.00 C ATOM 0 H ALA A 89 1.516 20.743 -2.927 1.00 0.00 H new ATOM 0 HA ALA A 89 3.256 22.576 -4.150 1.00 0.00 H new ATOM 0 HB1 ALA A 89 5.016 21.110 -3.215 1.00 0.00 H new ATOM 0 HB2 ALA A 89 3.723 21.426 -2.033 1.00 0.00 H new ATOM 0 HB3 ALA A 89 3.790 19.864 -2.882 1.00 0.00 H new ATOM 1336 N GLY A 90 3.410 19.557 -5.500 1.00 0.00 N ATOM 1337 CA GLY A 90 3.750 18.867 -6.730 1.00 0.00 C ATOM 1338 C GLY A 90 3.211 17.450 -6.768 1.00 0.00 C ATOM 1339 O GLY A 90 2.023 17.226 -6.541 1.00 0.00 O ATOM 0 H GLY A 90 3.133 18.948 -4.730 1.00 0.00 H new ATOM 0 HA2 GLY A 90 3.354 19.426 -7.578 1.00 0.00 H new ATOM 0 HA3 GLY A 90 4.834 18.843 -6.842 1.00 0.00 H new ATOM 1343 N GLN A 91 4.087 16.493 -7.057 1.00 0.00 N ATOM 1344 CA GLN A 91 3.691 15.092 -7.127 1.00 0.00 C ATOM 1345 C GLN A 91 4.910 14.178 -7.053 1.00 0.00 C ATOM 1346 O GLN A 91 5.998 14.542 -7.496 1.00 0.00 O ATOM 1347 CB GLN A 91 2.914 14.823 -8.416 1.00 0.00 C ATOM 1348 CG GLN A 91 2.613 13.351 -8.649 1.00 0.00 C ATOM 1349 CD GLN A 91 2.228 13.054 -10.085 1.00 0.00 C ATOM 1350 OE1 GLN A 91 3.068 12.667 -10.898 1.00 0.00 O ATOM 1351 NE2 GLN A 91 0.952 13.235 -10.406 1.00 0.00 N ATOM 0 H GLN A 91 5.075 16.662 -7.246 1.00 0.00 H new ATOM 0 HA GLN A 91 3.048 14.879 -6.273 1.00 0.00 H new ATOM 0 HB2 GLN A 91 1.976 15.377 -8.387 1.00 0.00 H new ATOM 0 HB3 GLN A 91 3.485 15.207 -9.261 1.00 0.00 H new ATOM 0 HG2 GLN A 91 3.488 12.758 -8.381 1.00 0.00 H new ATOM 0 HG3 GLN A 91 1.804 13.041 -7.988 1.00 0.00 H new ATOM 0 HE21 GLN A 91 0.289 13.557 -9.701 1.00 0.00 H new ATOM 0 HE22 GLN A 91 0.635 13.052 -11.358 1.00 0.00 H new ATOM 1360 N ASN A 92 4.718 12.989 -6.491 1.00 0.00 N ATOM 1361 CA ASN A 92 5.803 12.022 -6.359 1.00 0.00 C ATOM 1362 C ASN A 92 5.304 10.605 -6.627 1.00 0.00 C ATOM 1363 O ASN A 92 4.102 10.371 -6.746 1.00 0.00 O ATOM 1364 CB ASN A 92 6.418 12.103 -4.961 1.00 0.00 C ATOM 1365 CG ASN A 92 7.545 13.115 -4.882 1.00 0.00 C ATOM 1366 OD1 ASN A 92 7.349 14.300 -5.149 1.00 0.00 O ATOM 1367 ND2 ASN A 92 8.733 12.649 -4.514 1.00 0.00 N ATOM 0 H ASN A 92 3.822 12.672 -6.120 1.00 0.00 H new ATOM 0 HA ASN A 92 6.566 12.265 -7.099 1.00 0.00 H new ATOM 0 HB2 ASN A 92 5.644 12.369 -4.241 1.00 0.00 H new ATOM 0 HB3 ASN A 92 6.795 11.121 -4.675 1.00 0.00 H new ATOM 0 HD21 ASN A 92 9.530 13.282 -4.443 1.00 0.00 H new ATOM 0 HD22 ASN A 92 8.849 11.658 -4.302 1.00 0.00 H new ATOM 1374 N SER A 93 6.238 9.663 -6.719 1.00 0.00 N ATOM 1375 CA SER A 93 5.894 8.270 -6.976 1.00 0.00 C ATOM 1376 C SER A 93 6.899 7.332 -6.315 1.00 0.00 C ATOM 1377 O SER A 93 8.032 7.720 -6.027 1.00 0.00 O ATOM 1378 CB SER A 93 5.844 8.003 -8.482 1.00 0.00 C ATOM 1379 OG SER A 93 7.065 8.365 -9.104 1.00 0.00 O ATOM 0 H SER A 93 7.238 9.840 -6.619 1.00 0.00 H new ATOM 0 HA SER A 93 4.910 8.080 -6.548 1.00 0.00 H new ATOM 0 HB2 SER A 93 5.640 6.947 -8.661 1.00 0.00 H new ATOM 0 HB3 SER A 93 5.024 8.566 -8.928 1.00 0.00 H new ATOM 0 HG SER A 93 7.009 8.183 -10.065 1.00 0.00 H new ATOM 1385 N PHE A 94 6.477 6.094 -6.078 1.00 0.00 N ATOM 1386 CA PHE A 94 7.339 5.099 -5.450 1.00 0.00 C ATOM 1387 C PHE A 94 6.816 3.689 -5.703 1.00 0.00 C ATOM 1388 O PHE A 94 5.622 3.423 -5.562 1.00 0.00 O ATOM 1389 CB PHE A 94 7.438 5.356 -3.945 1.00 0.00 C ATOM 1390 CG PHE A 94 6.377 4.656 -3.146 1.00 0.00 C ATOM 1391 CD1 PHE A 94 6.513 3.318 -2.810 1.00 0.00 C ATOM 1392 CD2 PHE A 94 5.242 5.334 -2.731 1.00 0.00 C ATOM 1393 CE1 PHE A 94 5.537 2.671 -2.076 1.00 0.00 C ATOM 1394 CE2 PHE A 94 4.263 4.693 -1.996 1.00 0.00 C ATOM 1395 CZ PHE A 94 4.412 3.359 -1.667 1.00 0.00 C ATOM 0 H PHE A 94 5.543 5.756 -6.311 1.00 0.00 H new ATOM 0 HA PHE A 94 8.332 5.184 -5.892 1.00 0.00 H new ATOM 0 HB2 PHE A 94 8.418 5.034 -3.593 1.00 0.00 H new ATOM 0 HB3 PHE A 94 7.371 6.429 -3.763 1.00 0.00 H new ATOM 0 HD1 PHE A 94 7.392 2.775 -3.125 1.00 0.00 H new ATOM 0 HD2 PHE A 94 5.121 6.377 -2.985 1.00 0.00 H new ATOM 0 HE1 PHE A 94 5.654 1.628 -1.822 1.00 0.00 H new ATOM 0 HE2 PHE A 94 3.383 5.233 -1.679 1.00 0.00 H new ATOM 0 HZ PHE A 94 3.650 2.856 -1.091 1.00 0.00 H new ATOM 1405 N SER A 95 7.718 2.788 -6.079 1.00 0.00 N ATOM 1406 CA SER A 95 7.348 1.405 -6.357 1.00 0.00 C ATOM 1407 C SER A 95 7.913 0.468 -5.294 1.00 0.00 C ATOM 1408 O SER A 95 8.811 0.838 -4.536 1.00 0.00 O ATOM 1409 CB SER A 95 7.852 0.988 -7.740 1.00 0.00 C ATOM 1410 OG SER A 95 9.231 1.276 -7.889 1.00 0.00 O ATOM 0 H SER A 95 8.710 2.991 -6.198 1.00 0.00 H new ATOM 0 HA SER A 95 6.260 1.335 -6.338 1.00 0.00 H new ATOM 0 HB2 SER A 95 7.682 -0.079 -7.886 1.00 0.00 H new ATOM 0 HB3 SER A 95 7.283 1.509 -8.510 1.00 0.00 H new ATOM 0 HG SER A 95 9.529 0.998 -8.780 1.00 0.00 H new ATOM 1416 N LEU A 96 7.380 -0.748 -5.243 1.00 0.00 N ATOM 1417 CA LEU A 96 7.829 -1.741 -4.273 1.00 0.00 C ATOM 1418 C LEU A 96 7.539 -3.155 -4.766 1.00 0.00 C ATOM 1419 O LEU A 96 6.710 -3.354 -5.654 1.00 0.00 O ATOM 1420 CB LEU A 96 7.147 -1.509 -2.923 1.00 0.00 C ATOM 1421 CG LEU A 96 5.669 -1.894 -2.844 1.00 0.00 C ATOM 1422 CD1 LEU A 96 5.518 -3.394 -2.643 1.00 0.00 C ATOM 1423 CD2 LEU A 96 4.980 -1.132 -1.721 1.00 0.00 C ATOM 0 H LEU A 96 6.636 -1.070 -5.862 1.00 0.00 H new ATOM 0 HA LEU A 96 8.907 -1.633 -4.152 1.00 0.00 H new ATOM 0 HB2 LEU A 96 7.690 -2.071 -2.163 1.00 0.00 H new ATOM 0 HB3 LEU A 96 7.241 -0.454 -2.667 1.00 0.00 H new ATOM 0 HG LEU A 96 5.192 -1.625 -3.786 1.00 0.00 H new ATOM 0 HD11 LEU A 96 4.460 -3.649 -2.589 1.00 0.00 H new ATOM 0 HD12 LEU A 96 5.976 -3.921 -3.480 1.00 0.00 H new ATOM 0 HD13 LEU A 96 6.010 -3.688 -1.716 1.00 0.00 H new ATOM 0 HD21 LEU A 96 3.929 -1.418 -1.679 1.00 0.00 H new ATOM 0 HD22 LEU A 96 5.459 -1.371 -0.772 1.00 0.00 H new ATOM 0 HD23 LEU A 96 5.057 -0.061 -1.907 1.00 0.00 H new ATOM 1435 N GLU A 97 8.226 -4.132 -4.183 1.00 0.00 N ATOM 1436 CA GLU A 97 8.040 -5.527 -4.563 1.00 0.00 C ATOM 1437 C GLU A 97 7.393 -6.319 -3.430 1.00 0.00 C ATOM 1438 O GLU A 97 7.654 -6.066 -2.253 1.00 0.00 O ATOM 1439 CB GLU A 97 9.382 -6.160 -4.940 1.00 0.00 C ATOM 1440 CG GLU A 97 9.266 -7.601 -5.406 1.00 0.00 C ATOM 1441 CD GLU A 97 10.491 -8.068 -6.167 1.00 0.00 C ATOM 1442 OE1 GLU A 97 10.919 -7.355 -7.098 1.00 0.00 O ATOM 1443 OE2 GLU A 97 11.023 -9.147 -5.831 1.00 0.00 O ATOM 0 H GLU A 97 8.916 -3.983 -3.446 1.00 0.00 H new ATOM 0 HA GLU A 97 7.377 -5.555 -5.428 1.00 0.00 H new ATOM 0 HB2 GLU A 97 9.844 -5.568 -5.730 1.00 0.00 H new ATOM 0 HB3 GLU A 97 10.049 -6.118 -4.079 1.00 0.00 H new ATOM 0 HG2 GLU A 97 9.112 -8.247 -4.542 1.00 0.00 H new ATOM 0 HG3 GLU A 97 8.387 -7.704 -6.042 1.00 0.00 H new ATOM 1450 N LEU A 98 6.548 -7.277 -3.793 1.00 0.00 N ATOM 1451 CA LEU A 98 5.862 -8.106 -2.808 1.00 0.00 C ATOM 1452 C LEU A 98 5.845 -9.568 -3.244 1.00 0.00 C ATOM 1453 O LEU A 98 5.131 -9.940 -4.175 1.00 0.00 O ATOM 1454 CB LEU A 98 4.431 -7.607 -2.600 1.00 0.00 C ATOM 1455 CG LEU A 98 3.516 -8.514 -1.776 1.00 0.00 C ATOM 1456 CD1 LEU A 98 3.977 -8.563 -0.328 1.00 0.00 C ATOM 1457 CD2 LEU A 98 2.074 -8.038 -1.863 1.00 0.00 C ATOM 0 H LEU A 98 6.321 -7.499 -4.762 1.00 0.00 H new ATOM 0 HA LEU A 98 6.406 -8.033 -1.866 1.00 0.00 H new ATOM 0 HB2 LEU A 98 4.475 -6.632 -2.115 1.00 0.00 H new ATOM 0 HB3 LEU A 98 3.974 -7.456 -3.578 1.00 0.00 H new ATOM 0 HG LEU A 98 3.570 -9.522 -2.187 1.00 0.00 H new ATOM 0 HD11 LEU A 98 3.314 -9.213 0.243 1.00 0.00 H new ATOM 0 HD12 LEU A 98 4.994 -8.952 -0.283 1.00 0.00 H new ATOM 0 HD13 LEU A 98 3.954 -7.559 0.095 1.00 0.00 H new ATOM 0 HD21 LEU A 98 1.437 -8.695 -1.271 1.00 0.00 H new ATOM 0 HD22 LEU A 98 2.003 -7.021 -1.478 1.00 0.00 H new ATOM 0 HD23 LEU A 98 1.747 -8.056 -2.903 1.00 0.00 H new ATOM 1469 N VAL A 99 6.634 -10.392 -2.562 1.00 0.00 N ATOM 1470 CA VAL A 99 6.707 -11.814 -2.876 1.00 0.00 C ATOM 1471 C VAL A 99 5.602 -12.591 -2.169 1.00 0.00 C ATOM 1472 O VAL A 99 5.310 -12.348 -0.997 1.00 0.00 O ATOM 1473 CB VAL A 99 8.071 -12.407 -2.479 1.00 0.00 C ATOM 1474 CG1 VAL A 99 8.124 -13.892 -2.804 1.00 0.00 C ATOM 1475 CG2 VAL A 99 9.199 -11.660 -3.175 1.00 0.00 C ATOM 0 H VAL A 99 7.231 -10.099 -1.789 1.00 0.00 H new ATOM 0 HA VAL A 99 6.579 -11.907 -3.954 1.00 0.00 H new ATOM 0 HB VAL A 99 8.198 -12.291 -1.403 1.00 0.00 H new ATOM 0 HG11 VAL A 99 9.096 -14.293 -2.516 1.00 0.00 H new ATOM 0 HG12 VAL A 99 7.339 -14.413 -2.255 1.00 0.00 H new ATOM 0 HG13 VAL A 99 7.975 -14.036 -3.874 1.00 0.00 H new ATOM 0 HG21 VAL A 99 10.156 -12.092 -2.883 1.00 0.00 H new ATOM 0 HG22 VAL A 99 9.078 -11.743 -4.255 1.00 0.00 H new ATOM 0 HG23 VAL A 99 9.172 -10.609 -2.886 1.00 0.00 H new ATOM 1485 N VAL A 100 4.991 -13.527 -2.887 1.00 0.00 N ATOM 1486 CA VAL A 100 3.918 -14.341 -2.328 1.00 0.00 C ATOM 1487 C VAL A 100 4.145 -15.821 -2.616 1.00 0.00 C ATOM 1488 O VAL A 100 4.212 -16.236 -3.772 1.00 0.00 O ATOM 1489 CB VAL A 100 2.546 -13.925 -2.890 1.00 0.00 C ATOM 1490 CG1 VAL A 100 1.445 -14.806 -2.319 1.00 0.00 C ATOM 1491 CG2 VAL A 100 2.273 -12.458 -2.596 1.00 0.00 C ATOM 0 H VAL A 100 5.221 -13.741 -3.858 1.00 0.00 H new ATOM 0 HA VAL A 100 3.925 -14.177 -1.250 1.00 0.00 H new ATOM 0 HB VAL A 100 2.560 -14.059 -3.972 1.00 0.00 H new ATOM 0 HG11 VAL A 100 0.483 -14.497 -2.728 1.00 0.00 H new ATOM 0 HG12 VAL A 100 1.636 -15.845 -2.586 1.00 0.00 H new ATOM 0 HG13 VAL A 100 1.427 -14.708 -1.234 1.00 0.00 H new ATOM 0 HG21 VAL A 100 1.299 -12.181 -3.000 1.00 0.00 H new ATOM 0 HG22 VAL A 100 2.278 -12.296 -1.518 1.00 0.00 H new ATOM 0 HG23 VAL A 100 3.046 -11.844 -3.059 1.00 0.00 H new ATOM 1501 N ALA A 101 4.263 -16.613 -1.555 1.00 0.00 N ATOM 1502 CA ALA A 101 4.480 -18.048 -1.693 1.00 0.00 C ATOM 1503 C ALA A 101 3.155 -18.798 -1.780 1.00 0.00 C ATOM 1504 O ALA A 101 2.324 -18.715 -0.876 1.00 0.00 O ATOM 1505 CB ALA A 101 5.309 -18.571 -0.529 1.00 0.00 C ATOM 0 H ALA A 101 4.212 -16.285 -0.591 1.00 0.00 H new ATOM 0 HA ALA A 101 5.026 -18.220 -2.620 1.00 0.00 H new ATOM 0 HB1 ALA A 101 5.463 -19.644 -0.645 1.00 0.00 H new ATOM 0 HB2 ALA A 101 6.274 -18.065 -0.514 1.00 0.00 H new ATOM 0 HB3 ALA A 101 4.784 -18.379 0.407 1.00 0.00 H new ATOM 1511 N ALA A 102 2.964 -19.528 -2.874 1.00 0.00 N ATOM 1512 CA ALA A 102 1.741 -20.293 -3.078 1.00 0.00 C ATOM 1513 C ALA A 102 1.664 -21.473 -2.114 1.00 0.00 C ATOM 1514 O ALA A 102 2.687 -21.994 -1.671 1.00 0.00 O ATOM 1515 CB ALA A 102 1.656 -20.779 -4.518 1.00 0.00 C ATOM 0 H ALA A 102 3.641 -19.605 -3.633 1.00 0.00 H new ATOM 0 HA ALA A 102 0.894 -19.637 -2.877 1.00 0.00 H new ATOM 0 HB1 ALA A 102 0.737 -21.349 -4.656 1.00 0.00 H new ATOM 0 HB2 ALA A 102 1.656 -19.922 -5.192 1.00 0.00 H new ATOM 0 HB3 ALA A 102 2.514 -21.414 -4.739 1.00 0.00 H new ATOM 1521 N LYS A 103 0.443 -21.889 -1.793 1.00 0.00 N ATOM 1522 CA LYS A 103 0.232 -23.007 -0.882 1.00 0.00 C ATOM 1523 C LYS A 103 1.001 -24.240 -1.346 1.00 0.00 C ATOM 1524 O LYS A 103 1.409 -25.069 -0.533 1.00 0.00 O ATOM 1525 CB LYS A 103 -1.260 -23.333 -0.779 1.00 0.00 C ATOM 1526 CG LYS A 103 -1.860 -23.851 -2.075 1.00 0.00 C ATOM 1527 CD LYS A 103 -1.766 -25.365 -2.167 1.00 0.00 C ATOM 1528 CE LYS A 103 -2.359 -25.882 -3.468 1.00 0.00 C ATOM 1529 NZ LYS A 103 -1.361 -25.879 -4.573 1.00 0.00 N ATOM 0 H LYS A 103 -0.415 -21.468 -2.150 1.00 0.00 H new ATOM 0 HA LYS A 103 0.604 -22.717 0.101 1.00 0.00 H new ATOM 0 HB2 LYS A 103 -1.408 -24.078 0.003 1.00 0.00 H new ATOM 0 HB3 LYS A 103 -1.799 -22.437 -0.472 1.00 0.00 H new ATOM 0 HG2 LYS A 103 -2.904 -23.546 -2.141 1.00 0.00 H new ATOM 0 HG3 LYS A 103 -1.342 -23.401 -2.922 1.00 0.00 H new ATOM 0 HD2 LYS A 103 -0.722 -25.671 -2.095 1.00 0.00 H new ATOM 0 HD3 LYS A 103 -2.289 -25.815 -1.323 1.00 0.00 H new ATOM 0 HE2 LYS A 103 -2.733 -26.895 -3.319 1.00 0.00 H new ATOM 0 HE3 LYS A 103 -3.213 -25.265 -3.748 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 -1.805 -26.238 -5.442 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 -1.023 -24.909 -4.733 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 -0.558 -26.488 -4.317 1.00 0.00 H new ATOM 1543 N GLU A 104 1.196 -24.352 -2.656 1.00 0.00 N ATOM 1544 CA GLU A 104 1.917 -25.484 -3.226 1.00 0.00 C ATOM 1545 C GLU A 104 3.275 -25.659 -2.552 1.00 0.00 C ATOM 1546 O GLU A 104 3.933 -24.682 -2.195 1.00 0.00 O ATOM 1547 CB GLU A 104 2.104 -25.292 -4.732 1.00 0.00 C ATOM 1548 CG GLU A 104 2.285 -23.840 -5.143 1.00 0.00 C ATOM 1549 CD GLU A 104 3.139 -23.687 -6.386 1.00 0.00 C ATOM 1550 OE1 GLU A 104 2.671 -24.069 -7.479 1.00 0.00 O ATOM 1551 OE2 GLU A 104 4.276 -23.185 -6.266 1.00 0.00 O ATOM 0 H GLU A 104 0.865 -23.673 -3.342 1.00 0.00 H new ATOM 0 HA GLU A 104 1.326 -26.383 -3.052 1.00 0.00 H new ATOM 0 HB2 GLU A 104 2.973 -25.864 -5.057 1.00 0.00 H new ATOM 0 HB3 GLU A 104 1.239 -25.703 -5.252 1.00 0.00 H new ATOM 0 HG2 GLU A 104 1.307 -23.392 -5.321 1.00 0.00 H new ATOM 0 HG3 GLU A 104 2.743 -23.288 -4.322 1.00 0.00 H new ATOM 1558 N SER A 105 3.688 -26.911 -2.382 1.00 0.00 N ATOM 1559 CA SER A 105 4.965 -27.215 -1.747 1.00 0.00 C ATOM 1560 C SER A 105 6.116 -27.046 -2.734 1.00 0.00 C ATOM 1561 O SER A 105 6.131 -27.664 -3.799 1.00 0.00 O ATOM 1562 CB SER A 105 4.957 -28.642 -1.194 1.00 0.00 C ATOM 1563 OG SER A 105 6.167 -28.933 -0.517 1.00 0.00 O ATOM 0 H SER A 105 3.157 -27.731 -2.675 1.00 0.00 H new ATOM 0 HA SER A 105 5.109 -26.515 -0.924 1.00 0.00 H new ATOM 0 HB2 SER A 105 4.116 -28.766 -0.512 1.00 0.00 H new ATOM 0 HB3 SER A 105 4.813 -29.351 -2.010 1.00 0.00 H new ATOM 0 HG SER A 105 6.136 -29.850 -0.172 1.00 0.00 H new ATOM 1569 N GLY A 106 7.080 -26.205 -2.372 1.00 0.00 N ATOM 1570 CA GLY A 106 8.222 -25.969 -3.236 1.00 0.00 C ATOM 1571 C GLY A 106 9.428 -25.456 -2.475 1.00 0.00 C ATOM 1572 O GLY A 106 9.303 -24.756 -1.470 1.00 0.00 O ATOM 0 H GLY A 106 7.090 -25.683 -1.496 1.00 0.00 H new ATOM 0 HA2 GLY A 106 8.485 -26.896 -3.746 1.00 0.00 H new ATOM 0 HA3 GLY A 106 7.948 -25.248 -4.006 1.00 0.00 H new ATOM 1576 N PRO A 107 10.630 -25.807 -2.957 1.00 0.00 N ATOM 1577 CA PRO A 107 11.887 -25.389 -2.330 1.00 0.00 C ATOM 1578 C PRO A 107 12.148 -23.896 -2.494 1.00 0.00 C ATOM 1579 O PRO A 107 11.466 -23.217 -3.262 1.00 0.00 O ATOM 1580 CB PRO A 107 12.945 -26.203 -3.079 1.00 0.00 C ATOM 1581 CG PRO A 107 12.329 -26.497 -4.403 1.00 0.00 C ATOM 1582 CD PRO A 107 10.853 -26.639 -4.151 1.00 0.00 C ATOM 0 HA PRO A 107 11.882 -25.560 -1.253 1.00 0.00 H new ATOM 0 HB2 PRO A 107 13.872 -25.641 -3.190 1.00 0.00 H new ATOM 0 HB3 PRO A 107 13.191 -27.120 -2.544 1.00 0.00 H new ATOM 0 HG2 PRO A 107 12.528 -25.694 -5.113 1.00 0.00 H new ATOM 0 HG3 PRO A 107 12.741 -27.411 -4.831 1.00 0.00 H new ATOM 0 HD2 PRO A 107 10.265 -26.290 -5.000 1.00 0.00 H new ATOM 0 HD3 PRO A 107 10.573 -27.678 -3.975 1.00 0.00 H new ATOM 1590 N SER A 108 13.141 -23.390 -1.770 1.00 0.00 N ATOM 1591 CA SER A 108 13.491 -21.976 -1.833 1.00 0.00 C ATOM 1592 C SER A 108 12.238 -21.105 -1.806 1.00 0.00 C ATOM 1593 O SER A 108 12.140 -20.116 -2.533 1.00 0.00 O ATOM 1594 CB SER A 108 14.300 -21.685 -3.099 1.00 0.00 C ATOM 1595 OG SER A 108 15.689 -21.844 -2.863 1.00 0.00 O ATOM 0 H SER A 108 13.718 -23.939 -1.132 1.00 0.00 H new ATOM 0 HA SER A 108 14.098 -21.738 -0.959 1.00 0.00 H new ATOM 0 HB2 SER A 108 13.984 -22.355 -3.898 1.00 0.00 H new ATOM 0 HB3 SER A 108 14.099 -20.669 -3.437 1.00 0.00 H new ATOM 0 HG SER A 108 16.185 -21.654 -3.687 1.00 0.00 H new ATOM 1601 N SER A 109 11.282 -21.480 -0.962 1.00 0.00 N ATOM 1602 CA SER A 109 10.034 -20.737 -0.842 1.00 0.00 C ATOM 1603 C SER A 109 9.213 -20.842 -2.123 1.00 0.00 C ATOM 1604 O SER A 109 8.603 -19.869 -2.565 1.00 0.00 O ATOM 1605 CB SER A 109 10.319 -19.268 -0.525 1.00 0.00 C ATOM 1606 OG SER A 109 9.134 -18.587 -0.151 1.00 0.00 O ATOM 0 H SER A 109 11.348 -22.294 -0.351 1.00 0.00 H new ATOM 0 HA SER A 109 9.458 -21.173 -0.026 1.00 0.00 H new ATOM 0 HB2 SER A 109 11.050 -19.202 0.281 1.00 0.00 H new ATOM 0 HB3 SER A 109 10.761 -18.784 -1.396 1.00 0.00 H new ATOM 0 HG SER A 109 8.452 -18.712 -0.844 1.00 0.00 H new ATOM 1612 N GLY A 110 9.203 -22.032 -2.716 1.00 0.00 N ATOM 1613 CA GLY A 110 8.455 -22.244 -3.942 1.00 0.00 C ATOM 1614 C GLY A 110 9.032 -21.475 -5.114 1.00 0.00 C ATOM 1615 O GLY A 110 8.342 -20.664 -5.732 1.00 0.00 O ATOM 0 H GLY A 110 9.699 -22.853 -2.369 1.00 0.00 H new ATOM 0 HA2 GLY A 110 8.446 -23.308 -4.179 1.00 0.00 H new ATOM 0 HA3 GLY A 110 7.419 -21.943 -3.788 1.00 0.00 H new TER 1619 GLY A 110