USER MOD reduce.3.24.130724 H: found=0, std=0, add=1017, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 1017 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 100 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 102 THR OG1 : rot -64:sc= 0.691 USER MOD Set 1.3: A 111 ASN : amide:sc= 0.611 K(o=1.3,f=-0.49) USER MOD Set 1.4: A 113 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 81 THR OG1 : rot -104:sc= 0.945 USER MOD Set 2.2: A 93 THR OG1 : rot -150:sc= 0.83 USER MOD Set 3.1: A 47 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Set 3.2: A 64 THR OG1 : rot 180:sc= 0 USER MOD Set 4.1: A 19 MET CE :methyl 180:sc= -0.427 (180deg=-0.427) USER MOD Set 4.2: A 74 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot -145:sc= 0.015 USER MOD Single : A 4 SER OG : rot 180:sc= 0.00681 USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 TYR OH : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 10 GLN : amide:sc= 0 X(o=0,f=0.15) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 12 GLN : amide:sc= -0.153 X(o=-0.15,f=-0.15) USER MOD Single : A 14 ASN : amide:sc= 0 X(o=0,f=0.19) USER MOD Single : A 20 LYS NZ :NH3+ -122:sc= 0.134 (180deg=0) USER MOD Single : A 30 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 43 GLN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : A 44 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 THR OG1 : rot 180:sc= -0.0186 USER MOD Single : A 53 THR OG1 : rot -47:sc= 0.742 USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 61 ASN : amide:sc= -0.271 X(o=-0.27,f=-0.099) USER MOD Single : A 69 CYS SG : rot 55:sc= 0.845 USER MOD Single : A 73 THR OG1 : rot -92:sc= 0.017 USER MOD Single : A 75 THR OG1 : rot -162:sc= -0.219 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 LYS NZ :NH3+ -112:sc= 0.0368 (180deg=0) USER MOD Single : A 84 GLN : amide:sc= -0.0493 X(o=-0.049,f=-0.02) USER MOD Single : A 89 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 90 LYS NZ :NH3+ 144:sc= 0.0114 (180deg=0) USER MOD Single : A 94 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 THR OG1 : rot 133:sc= 0.234 USER MOD Single : A 114 THR OG1 : rot 180:sc= -0.272 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 2 11.400 -12.375 -2.356 1.00 0.00 N ATOM 2 CA SER A 2 10.558 -11.483 -3.167 1.00 0.00 C ATOM 3 C SER A 2 9.393 -10.931 -2.309 1.00 0.00 C ATOM 4 O SER A 2 8.613 -11.696 -1.734 1.00 0.00 O ATOM 5 CB SER A 2 10.029 -12.211 -4.425 1.00 0.00 C ATOM 6 OG SER A 2 11.090 -12.557 -5.309 1.00 0.00 O ATOM 0 HA SER A 2 11.165 -10.644 -3.507 1.00 0.00 H new ATOM 0 HB2 SER A 2 9.493 -13.112 -4.127 1.00 0.00 H new ATOM 0 HB3 SER A 2 9.315 -11.572 -4.944 1.00 0.00 H new ATOM 0 HG SER A 2 10.781 -12.483 -6.236 1.00 0.00 H new ATOM 12 N PHE A 3 9.266 -9.590 -2.274 1.00 0.00 N ATOM 13 CA PHE A 3 8.118 -8.860 -1.645 1.00 0.00 C ATOM 14 C PHE A 3 8.125 -8.666 -0.095 1.00 0.00 C ATOM 15 O PHE A 3 7.362 -7.821 0.382 1.00 0.00 O ATOM 16 CB PHE A 3 6.707 -9.258 -2.183 1.00 0.00 C ATOM 17 CG PHE A 3 6.467 -9.011 -3.682 1.00 0.00 C ATOM 18 CD1 PHE A 3 6.124 -7.732 -4.136 1.00 0.00 C ATOM 19 CD2 PHE A 3 6.587 -10.057 -4.606 1.00 0.00 C ATOM 20 CE1 PHE A 3 5.910 -7.501 -5.491 1.00 0.00 C ATOM 21 CE2 PHE A 3 6.374 -9.822 -5.962 1.00 0.00 C ATOM 22 CZ PHE A 3 6.030 -8.546 -6.401 1.00 0.00 C ATOM 0 H PHE A 3 9.960 -8.964 -2.683 1.00 0.00 H new ATOM 0 HA PHE A 3 8.334 -7.858 -2.015 1.00 0.00 H new ATOM 0 HB2 PHE A 3 6.546 -10.317 -1.978 1.00 0.00 H new ATOM 0 HB3 PHE A 3 5.955 -8.707 -1.618 1.00 0.00 H new ATOM 0 HD1 PHE A 3 6.025 -6.920 -3.431 1.00 0.00 H new ATOM 0 HD2 PHE A 3 6.846 -11.049 -4.266 1.00 0.00 H new ATOM 0 HE1 PHE A 3 5.651 -6.511 -5.836 1.00 0.00 H new ATOM 0 HE2 PHE A 3 6.476 -10.629 -6.673 1.00 0.00 H new ATOM 0 HZ PHE A 3 5.856 -8.367 -7.452 1.00 0.00 H new ATOM 32 N SER A 4 8.983 -9.353 0.692 1.00 0.00 N ATOM 33 CA SER A 4 9.171 -9.046 2.137 1.00 0.00 C ATOM 34 C SER A 4 10.020 -7.753 2.302 1.00 0.00 C ATOM 35 O SER A 4 11.191 -7.714 1.908 1.00 0.00 O ATOM 36 CB SER A 4 9.835 -10.237 2.863 1.00 0.00 C ATOM 37 OG SER A 4 8.972 -11.368 2.891 1.00 0.00 O ATOM 0 H SER A 4 9.559 -10.125 0.355 1.00 0.00 H new ATOM 0 HA SER A 4 8.194 -8.878 2.591 1.00 0.00 H new ATOM 0 HB2 SER A 4 10.766 -10.499 2.361 1.00 0.00 H new ATOM 0 HB3 SER A 4 10.093 -9.948 3.882 1.00 0.00 H new ATOM 0 HG SER A 4 9.417 -12.108 3.354 1.00 0.00 H new ATOM 43 N GLY A 5 9.401 -6.697 2.850 1.00 0.00 N ATOM 44 CA GLY A 5 10.044 -5.371 2.945 1.00 0.00 C ATOM 45 C GLY A 5 9.089 -4.279 3.468 1.00 0.00 C ATOM 46 O GLY A 5 7.894 -4.253 3.154 1.00 0.00 O ATOM 0 H GLY A 5 8.457 -6.732 3.235 1.00 0.00 H new ATOM 0 HA2 GLY A 5 10.908 -5.438 3.606 1.00 0.00 H new ATOM 0 HA3 GLY A 5 10.416 -5.082 1.962 1.00 0.00 H new ATOM 50 N LYS A 6 9.675 -3.341 4.225 1.00 0.00 N ATOM 51 CA LYS A 6 8.993 -2.092 4.663 1.00 0.00 C ATOM 52 C LYS A 6 9.424 -0.972 3.680 1.00 0.00 C ATOM 53 O LYS A 6 10.621 -0.721 3.516 1.00 0.00 O ATOM 54 CB LYS A 6 9.374 -1.725 6.124 1.00 0.00 C ATOM 55 CG LYS A 6 8.735 -2.584 7.238 1.00 0.00 C ATOM 56 CD LYS A 6 9.392 -3.956 7.496 1.00 0.00 C ATOM 57 CE LYS A 6 8.765 -4.694 8.693 1.00 0.00 C ATOM 58 NZ LYS A 6 9.393 -6.011 8.905 1.00 0.00 N ATOM 0 H LYS A 6 10.636 -3.417 4.557 1.00 0.00 H new ATOM 0 HA LYS A 6 7.911 -2.224 4.649 1.00 0.00 H new ATOM 0 HB2 LYS A 6 10.458 -1.791 6.221 1.00 0.00 H new ATOM 0 HB3 LYS A 6 9.101 -0.684 6.297 1.00 0.00 H new ATOM 0 HG2 LYS A 6 8.756 -2.013 8.166 1.00 0.00 H new ATOM 0 HG3 LYS A 6 7.687 -2.747 6.987 1.00 0.00 H new ATOM 0 HD2 LYS A 6 9.298 -4.574 6.603 1.00 0.00 H new ATOM 0 HD3 LYS A 6 10.458 -3.817 7.677 1.00 0.00 H new ATOM 0 HE2 LYS A 6 8.874 -4.089 9.593 1.00 0.00 H new ATOM 0 HE3 LYS A 6 7.696 -4.823 8.523 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 8.947 -6.481 9.719 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 9.267 -6.597 8.055 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 10.408 -5.885 9.091 1.00 0.00 H new ATOM 72 N TYR A 7 8.456 -0.331 3.003 1.00 0.00 N ATOM 73 CA TYR A 7 8.748 0.550 1.839 1.00 0.00 C ATOM 74 C TYR A 7 8.303 1.997 2.185 1.00 0.00 C ATOM 75 O TYR A 7 7.112 2.316 2.152 1.00 0.00 O ATOM 76 CB TYR A 7 8.088 0.005 0.540 1.00 0.00 C ATOM 77 CG TYR A 7 8.548 -1.393 0.070 1.00 0.00 C ATOM 78 CD1 TYR A 7 9.744 -1.548 -0.643 1.00 0.00 C ATOM 79 CD2 TYR A 7 7.761 -2.520 0.334 1.00 0.00 C ATOM 80 CE1 TYR A 7 10.140 -2.809 -1.082 1.00 0.00 C ATOM 81 CE2 TYR A 7 8.165 -3.780 -0.099 1.00 0.00 C ATOM 82 CZ TYR A 7 9.353 -3.924 -0.808 1.00 0.00 C ATOM 83 OH TYR A 7 9.737 -5.165 -1.241 1.00 0.00 O ATOM 0 H TYR A 7 7.465 -0.400 3.234 1.00 0.00 H new ATOM 0 HA TYR A 7 9.819 0.562 1.639 1.00 0.00 H new ATOM 0 HB2 TYR A 7 7.009 -0.023 0.691 1.00 0.00 H new ATOM 0 HB3 TYR A 7 8.279 0.716 -0.264 1.00 0.00 H new ATOM 0 HD1 TYR A 7 10.361 -0.687 -0.853 1.00 0.00 H new ATOM 0 HD2 TYR A 7 6.834 -2.411 0.877 1.00 0.00 H new ATOM 0 HE1 TYR A 7 11.060 -2.922 -1.636 1.00 0.00 H new ATOM 0 HE2 TYR A 7 7.556 -4.646 0.116 1.00 0.00 H new ATOM 0 HH TYR A 7 9.072 -5.829 -0.962 1.00 0.00 H new ATOM 93 N GLN A 8 9.277 2.869 2.510 1.00 0.00 N ATOM 94 CA GLN A 8 9.024 4.279 2.910 1.00 0.00 C ATOM 95 C GLN A 8 8.791 5.168 1.660 1.00 0.00 C ATOM 96 O GLN A 8 9.670 5.273 0.803 1.00 0.00 O ATOM 97 CB GLN A 8 10.253 4.758 3.734 1.00 0.00 C ATOM 98 CG GLN A 8 10.196 6.186 4.332 1.00 0.00 C ATOM 99 CD GLN A 8 9.220 6.353 5.507 1.00 0.00 C ATOM 100 OE1 GLN A 8 9.553 6.079 6.659 1.00 0.00 O ATOM 101 NE2 GLN A 8 8.003 6.802 5.248 1.00 0.00 N ATOM 0 H GLN A 8 10.266 2.621 2.504 1.00 0.00 H new ATOM 0 HA GLN A 8 8.122 4.354 3.517 1.00 0.00 H new ATOM 0 HB2 GLN A 8 10.404 4.055 4.553 1.00 0.00 H new ATOM 0 HB3 GLN A 8 11.133 4.695 3.094 1.00 0.00 H new ATOM 0 HG2 GLN A 8 11.195 6.465 4.665 1.00 0.00 H new ATOM 0 HG3 GLN A 8 9.916 6.884 3.543 1.00 0.00 H new ATOM 0 HE21 GLN A 8 7.736 7.027 4.290 1.00 0.00 H new ATOM 0 HE22 GLN A 8 7.332 6.924 6.007 1.00 0.00 H new ATOM 110 N LEU A 9 7.623 5.830 1.591 1.00 0.00 N ATOM 111 CA LEU A 9 7.223 6.681 0.436 1.00 0.00 C ATOM 112 C LEU A 9 8.160 7.901 0.217 1.00 0.00 C ATOM 113 O LEU A 9 8.416 8.680 1.137 1.00 0.00 O ATOM 114 CB LEU A 9 5.753 7.121 0.676 1.00 0.00 C ATOM 115 CG LEU A 9 5.047 7.940 -0.441 1.00 0.00 C ATOM 116 CD1 LEU A 9 4.759 7.107 -1.706 1.00 0.00 C ATOM 117 CD2 LEU A 9 3.750 8.551 0.119 1.00 0.00 C ATOM 0 H LEU A 9 6.922 5.796 2.331 1.00 0.00 H new ATOM 0 HA LEU A 9 7.310 6.102 -0.483 1.00 0.00 H new ATOM 0 HB2 LEU A 9 5.161 6.224 0.858 1.00 0.00 H new ATOM 0 HB3 LEU A 9 5.726 7.712 1.592 1.00 0.00 H new ATOM 0 HG LEU A 9 5.728 8.733 -0.751 1.00 0.00 H new ATOM 0 HD11 LEU A 9 4.266 7.733 -2.449 1.00 0.00 H new ATOM 0 HD12 LEU A 9 5.696 6.729 -2.114 1.00 0.00 H new ATOM 0 HD13 LEU A 9 4.111 6.269 -1.450 1.00 0.00 H new ATOM 0 HD21 LEU A 9 3.252 9.126 -0.662 1.00 0.00 H new ATOM 0 HD22 LEU A 9 3.089 7.754 0.459 1.00 0.00 H new ATOM 0 HD23 LEU A 9 3.989 9.207 0.956 1.00 0.00 H new ATOM 129 N GLN A 10 8.654 8.031 -1.023 1.00 0.00 N ATOM 130 CA GLN A 10 9.626 9.083 -1.420 1.00 0.00 C ATOM 131 C GLN A 10 8.934 10.101 -2.370 1.00 0.00 C ATOM 132 O GLN A 10 8.757 11.261 -1.988 1.00 0.00 O ATOM 133 CB GLN A 10 10.910 8.457 -2.034 1.00 0.00 C ATOM 134 CG GLN A 10 11.606 7.352 -1.213 1.00 0.00 C ATOM 135 CD GLN A 10 12.185 7.790 0.144 1.00 0.00 C ATOM 136 OE1 GLN A 10 11.547 7.640 1.186 1.00 0.00 O ATOM 137 NE2 GLN A 10 13.389 8.338 0.165 1.00 0.00 N ATOM 0 H GLN A 10 8.394 7.410 -1.789 1.00 0.00 H new ATOM 0 HA GLN A 10 9.953 9.629 -0.535 1.00 0.00 H new ATOM 0 HB2 GLN A 10 10.654 8.045 -3.010 1.00 0.00 H new ATOM 0 HB3 GLN A 10 11.630 9.257 -2.205 1.00 0.00 H new ATOM 0 HG2 GLN A 10 10.890 6.549 -1.039 1.00 0.00 H new ATOM 0 HG3 GLN A 10 12.414 6.934 -1.813 1.00 0.00 H new ATOM 0 HE21 GLN A 10 13.910 8.458 -0.704 1.00 0.00 H new ATOM 0 HE22 GLN A 10 13.796 8.640 1.050 1.00 0.00 H new ATOM 146 N SER A 11 8.547 9.656 -3.586 1.00 0.00 N ATOM 147 CA SER A 11 7.894 10.511 -4.610 1.00 0.00 C ATOM 148 C SER A 11 6.485 9.938 -4.917 1.00 0.00 C ATOM 149 O SER A 11 6.354 8.836 -5.465 1.00 0.00 O ATOM 150 CB SER A 11 8.794 10.570 -5.865 1.00 0.00 C ATOM 151 OG SER A 11 8.232 11.420 -6.858 1.00 0.00 O ATOM 0 H SER A 11 8.678 8.691 -3.889 1.00 0.00 H new ATOM 0 HA SER A 11 7.766 11.532 -4.249 1.00 0.00 H new ATOM 0 HB2 SER A 11 9.784 10.933 -5.590 1.00 0.00 H new ATOM 0 HB3 SER A 11 8.923 9.567 -6.271 1.00 0.00 H new ATOM 0 HG SER A 11 8.821 11.442 -7.641 1.00 0.00 H new ATOM 157 N GLN A 12 5.442 10.715 -4.572 1.00 0.00 N ATOM 158 CA GLN A 12 4.025 10.328 -4.799 1.00 0.00 C ATOM 159 C GLN A 12 3.482 11.131 -6.013 1.00 0.00 C ATOM 160 O GLN A 12 3.221 12.335 -5.920 1.00 0.00 O ATOM 161 CB GLN A 12 3.226 10.567 -3.491 1.00 0.00 C ATOM 162 CG GLN A 12 1.845 9.877 -3.472 1.00 0.00 C ATOM 163 CD GLN A 12 1.103 10.008 -2.129 1.00 0.00 C ATOM 164 OE1 GLN A 12 1.019 11.082 -1.533 1.00 0.00 O ATOM 165 NE2 GLN A 12 0.541 8.920 -1.624 1.00 0.00 N ATOM 0 H GLN A 12 5.550 11.627 -4.129 1.00 0.00 H new ATOM 0 HA GLN A 12 3.924 9.270 -5.043 1.00 0.00 H new ATOM 0 HB2 GLN A 12 3.813 10.208 -2.646 1.00 0.00 H new ATOM 0 HB3 GLN A 12 3.089 11.639 -3.351 1.00 0.00 H new ATOM 0 HG2 GLN A 12 1.226 10.303 -4.262 1.00 0.00 H new ATOM 0 HG3 GLN A 12 1.974 8.820 -3.703 1.00 0.00 H new ATOM 0 HE21 GLN A 12 0.612 8.032 -2.120 1.00 0.00 H new ATOM 0 HE22 GLN A 12 0.037 8.970 -0.739 1.00 0.00 H new ATOM 174 N GLU A 13 3.346 10.439 -7.156 1.00 0.00 N ATOM 175 CA GLU A 13 3.008 11.060 -8.465 1.00 0.00 C ATOM 176 C GLU A 13 1.504 10.803 -8.777 1.00 0.00 C ATOM 177 O GLU A 13 1.019 9.682 -8.604 1.00 0.00 O ATOM 178 CB GLU A 13 3.982 10.451 -9.516 1.00 0.00 C ATOM 179 CG GLU A 13 4.175 11.234 -10.833 1.00 0.00 C ATOM 180 CD GLU A 13 3.034 11.120 -11.844 1.00 0.00 C ATOM 181 OE1 GLU A 13 2.722 9.992 -12.288 1.00 0.00 O ATOM 182 OE2 GLU A 13 2.449 12.164 -12.207 1.00 0.00 O ATOM 0 H GLU A 13 3.466 9.427 -7.207 1.00 0.00 H new ATOM 0 HA GLU A 13 3.134 12.143 -8.470 1.00 0.00 H new ATOM 0 HB2 GLU A 13 4.958 10.335 -9.045 1.00 0.00 H new ATOM 0 HB3 GLU A 13 3.628 9.451 -9.766 1.00 0.00 H new ATOM 0 HG2 GLU A 13 4.318 12.287 -10.591 1.00 0.00 H new ATOM 0 HG3 GLU A 13 5.093 10.889 -11.308 1.00 0.00 H new ATOM 189 N ASN A 14 0.770 11.849 -9.213 1.00 0.00 N ATOM 190 CA ASN A 14 -0.721 11.819 -9.389 1.00 0.00 C ATOM 191 C ASN A 14 -1.537 11.607 -8.064 1.00 0.00 C ATOM 192 O ASN A 14 -2.473 10.803 -8.030 1.00 0.00 O ATOM 193 CB ASN A 14 -1.191 10.884 -10.557 1.00 0.00 C ATOM 194 CG ASN A 14 -0.981 11.369 -12.001 1.00 0.00 C ATOM 195 OD1 ASN A 14 -0.087 10.910 -12.710 1.00 0.00 O ATOM 196 ND2 ASN A 14 -1.834 12.254 -12.493 1.00 0.00 N ATOM 0 H ASN A 14 1.185 12.748 -9.457 1.00 0.00 H new ATOM 0 HA ASN A 14 -0.969 12.835 -9.698 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -0.677 9.929 -10.448 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -2.255 10.690 -10.422 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -1.751 12.557 -13.463 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -2.574 12.632 -11.902 1.00 0.00 H new ATOM 203 N PHE A 15 -1.230 12.358 -6.984 1.00 0.00 N ATOM 204 CA PHE A 15 -2.009 12.305 -5.710 1.00 0.00 C ATOM 205 C PHE A 15 -3.306 13.172 -5.724 1.00 0.00 C ATOM 206 O PHE A 15 -4.355 12.679 -5.301 1.00 0.00 O ATOM 207 CB PHE A 15 -1.073 12.632 -4.513 1.00 0.00 C ATOM 208 CG PHE A 15 -1.622 12.371 -3.090 1.00 0.00 C ATOM 209 CD1 PHE A 15 -2.178 11.133 -2.735 1.00 0.00 C ATOM 210 CD2 PHE A 15 -1.489 13.358 -2.108 1.00 0.00 C ATOM 211 CE1 PHE A 15 -2.586 10.890 -1.426 1.00 0.00 C ATOM 212 CE2 PHE A 15 -1.897 13.109 -0.801 1.00 0.00 C ATOM 213 CZ PHE A 15 -2.445 11.878 -0.459 1.00 0.00 C ATOM 0 H PHE A 15 -0.448 13.012 -6.961 1.00 0.00 H new ATOM 0 HA PHE A 15 -2.380 11.287 -5.594 1.00 0.00 H new ATOM 0 HB2 PHE A 15 -0.158 12.053 -4.633 1.00 0.00 H new ATOM 0 HB3 PHE A 15 -0.795 13.684 -4.580 1.00 0.00 H new ATOM 0 HD1 PHE A 15 -2.291 10.362 -3.483 1.00 0.00 H new ATOM 0 HD2 PHE A 15 -1.067 14.318 -2.365 1.00 0.00 H new ATOM 0 HE1 PHE A 15 -3.012 9.933 -1.162 1.00 0.00 H new ATOM 0 HE2 PHE A 15 -1.787 13.876 -0.049 1.00 0.00 H new ATOM 0 HZ PHE A 15 -2.761 11.690 0.557 1.00 0.00 H new ATOM 223 N GLU A 16 -3.239 14.435 -6.200 1.00 0.00 N ATOM 224 CA GLU A 16 -4.425 15.334 -6.325 1.00 0.00 C ATOM 225 C GLU A 16 -5.517 14.829 -7.321 1.00 0.00 C ATOM 226 O GLU A 16 -6.692 14.782 -6.946 1.00 0.00 O ATOM 227 CB GLU A 16 -3.984 16.785 -6.674 1.00 0.00 C ATOM 228 CG GLU A 16 -3.071 17.488 -5.640 1.00 0.00 C ATOM 229 CD GLU A 16 -2.697 18.917 -6.039 1.00 0.00 C ATOM 230 OE1 GLU A 16 -1.711 19.099 -6.787 1.00 0.00 O ATOM 231 OE2 GLU A 16 -3.384 19.867 -5.601 1.00 0.00 O ATOM 0 H GLU A 16 -2.368 14.866 -6.509 1.00 0.00 H new ATOM 0 HA GLU A 16 -4.902 15.325 -5.345 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -3.464 16.764 -7.632 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -4.879 17.392 -6.810 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -3.575 17.508 -4.674 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -2.160 16.903 -5.512 1.00 0.00 H new ATOM 238 N ALA A 17 -5.133 14.422 -8.552 1.00 0.00 N ATOM 239 CA ALA A 17 -6.054 13.772 -9.523 1.00 0.00 C ATOM 240 C ALA A 17 -6.673 12.407 -9.091 1.00 0.00 C ATOM 241 O ALA A 17 -7.860 12.192 -9.350 1.00 0.00 O ATOM 242 CB ALA A 17 -5.320 13.624 -10.870 1.00 0.00 C ATOM 0 H ALA A 17 -4.182 14.532 -8.903 1.00 0.00 H new ATOM 0 HA ALA A 17 -6.918 14.433 -9.592 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -5.981 13.149 -11.594 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -5.029 14.609 -11.236 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -4.430 13.010 -10.734 1.00 0.00 H new ATOM 248 N PHE A 18 -5.900 11.504 -8.447 1.00 0.00 N ATOM 249 CA PHE A 18 -6.399 10.168 -8.013 1.00 0.00 C ATOM 250 C PHE A 18 -7.401 10.232 -6.824 1.00 0.00 C ATOM 251 O PHE A 18 -8.487 9.666 -6.952 1.00 0.00 O ATOM 252 CB PHE A 18 -5.191 9.226 -7.753 1.00 0.00 C ATOM 253 CG PHE A 18 -5.535 7.744 -7.519 1.00 0.00 C ATOM 254 CD1 PHE A 18 -5.609 6.840 -8.586 1.00 0.00 C ATOM 255 CD2 PHE A 18 -5.737 7.282 -6.215 1.00 0.00 C ATOM 256 CE1 PHE A 18 -5.858 5.491 -8.344 1.00 0.00 C ATOM 257 CE2 PHE A 18 -5.997 5.937 -5.976 1.00 0.00 C ATOM 258 CZ PHE A 18 -6.056 5.044 -7.039 1.00 0.00 C ATOM 0 H PHE A 18 -4.922 11.673 -8.213 1.00 0.00 H new ATOM 0 HA PHE A 18 -6.993 9.748 -8.825 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -4.513 9.292 -8.604 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -4.647 9.595 -6.883 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -5.473 7.190 -9.599 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -5.691 7.975 -5.388 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -5.898 4.792 -9.167 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -6.153 5.587 -4.966 1.00 0.00 H new ATOM 0 HZ PHE A 18 -6.256 3.999 -6.853 1.00 0.00 H new ATOM 268 N MET A 19 -7.055 10.899 -5.703 1.00 0.00 N ATOM 269 CA MET A 19 -7.961 11.064 -4.530 1.00 0.00 C ATOM 270 C MET A 19 -9.296 11.816 -4.815 1.00 0.00 C ATOM 271 O MET A 19 -10.334 11.360 -4.336 1.00 0.00 O ATOM 272 CB MET A 19 -7.179 11.713 -3.359 1.00 0.00 C ATOM 273 CG MET A 19 -6.321 10.745 -2.532 1.00 0.00 C ATOM 274 SD MET A 19 -5.127 9.858 -3.557 1.00 0.00 S ATOM 275 CE MET A 19 -5.039 8.286 -2.681 1.00 0.00 C ATOM 0 H MET A 19 -6.144 11.340 -5.578 1.00 0.00 H new ATOM 0 HA MET A 19 -8.285 10.060 -4.258 1.00 0.00 H new ATOM 0 HB2 MET A 19 -6.533 12.493 -3.762 1.00 0.00 H new ATOM 0 HB3 MET A 19 -7.891 12.202 -2.694 1.00 0.00 H new ATOM 0 HG2 MET A 19 -5.792 11.300 -1.757 1.00 0.00 H new ATOM 0 HG3 MET A 19 -6.968 10.028 -2.026 1.00 0.00 H new ATOM 0 HE1 MET A 19 -4.340 7.624 -3.191 1.00 0.00 H new ATOM 0 HE2 MET A 19 -4.698 8.457 -1.660 1.00 0.00 H new ATOM 0 HE3 MET A 19 -6.026 7.825 -2.661 1.00 0.00 H new ATOM 285 N LYS A 20 -9.299 12.901 -5.617 1.00 0.00 N ATOM 286 CA LYS A 20 -10.555 13.503 -6.158 1.00 0.00 C ATOM 287 C LYS A 20 -11.408 12.556 -7.068 1.00 0.00 C ATOM 288 O LYS A 20 -12.636 12.555 -6.934 1.00 0.00 O ATOM 289 CB LYS A 20 -10.239 14.828 -6.913 1.00 0.00 C ATOM 290 CG LYS A 20 -9.701 16.019 -6.077 1.00 0.00 C ATOM 291 CD LYS A 20 -10.749 17.029 -5.553 1.00 0.00 C ATOM 292 CE LYS A 20 -11.710 16.560 -4.442 1.00 0.00 C ATOM 293 NZ LYS A 20 -11.028 16.288 -3.162 1.00 0.00 N ATOM 0 H LYS A 20 -8.450 13.385 -5.910 1.00 0.00 H new ATOM 0 HA LYS A 20 -11.175 13.698 -5.283 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -9.508 14.606 -7.691 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -11.150 15.154 -7.415 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -9.159 15.617 -5.221 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -8.979 16.563 -6.685 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -10.215 17.905 -5.185 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -11.352 17.356 -6.400 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -12.473 17.322 -4.285 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -12.224 15.657 -4.772 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -11.204 15.303 -2.877 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -10.005 16.439 -3.275 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -11.394 16.930 -2.430 1.00 0.00 H new ATOM 307 N ALA A 21 -10.781 11.754 -7.958 1.00 0.00 N ATOM 308 CA ALA A 21 -11.489 10.740 -8.788 1.00 0.00 C ATOM 309 C ALA A 21 -12.104 9.519 -8.036 1.00 0.00 C ATOM 310 O ALA A 21 -13.179 9.066 -8.442 1.00 0.00 O ATOM 311 CB ALA A 21 -10.535 10.268 -9.901 1.00 0.00 C ATOM 0 H ALA A 21 -9.775 11.787 -8.124 1.00 0.00 H new ATOM 0 HA ALA A 21 -12.366 11.251 -9.184 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -11.037 9.524 -10.520 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -10.247 11.119 -10.519 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -9.644 9.826 -9.454 1.00 0.00 H new ATOM 317 N ILE A 22 -11.462 8.994 -6.967 1.00 0.00 N ATOM 318 CA ILE A 22 -12.035 7.897 -6.128 1.00 0.00 C ATOM 319 C ILE A 22 -13.094 8.411 -5.096 1.00 0.00 C ATOM 320 O ILE A 22 -14.174 7.821 -5.017 1.00 0.00 O ATOM 321 CB ILE A 22 -10.954 6.934 -5.509 1.00 0.00 C ATOM 322 CG1 ILE A 22 -9.935 7.591 -4.528 1.00 0.00 C ATOM 323 CG2 ILE A 22 -10.210 6.139 -6.612 1.00 0.00 C ATOM 324 CD1 ILE A 22 -9.122 6.620 -3.656 1.00 0.00 C ATOM 0 H ILE A 22 -10.542 9.309 -6.658 1.00 0.00 H new ATOM 0 HA ILE A 22 -12.589 7.263 -6.820 1.00 0.00 H new ATOM 0 HB ILE A 22 -11.538 6.255 -4.888 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -9.239 8.197 -5.109 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -10.478 8.271 -3.872 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -9.471 5.483 -6.152 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -10.926 5.540 -7.174 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -9.709 6.834 -7.286 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -8.447 7.186 -3.014 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -9.800 6.030 -3.039 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -8.542 5.955 -4.296 1.00 0.00 H new ATOM 336 N GLY A 23 -12.795 9.481 -4.331 1.00 0.00 N ATOM 337 CA GLY A 23 -13.693 10.037 -3.292 1.00 0.00 C ATOM 338 C GLY A 23 -13.016 10.203 -1.912 1.00 0.00 C ATOM 339 O GLY A 23 -13.508 9.657 -0.921 1.00 0.00 O ATOM 0 H GLY A 23 -11.915 9.990 -4.416 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -14.063 11.007 -3.625 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -14.560 9.385 -3.186 1.00 0.00 H new ATOM 343 N LEU A 24 -11.922 10.984 -1.859 1.00 0.00 N ATOM 344 CA LEU A 24 -11.220 11.363 -0.602 1.00 0.00 C ATOM 345 C LEU A 24 -11.194 12.926 -0.444 1.00 0.00 C ATOM 346 O LEU A 24 -11.219 13.636 -1.459 1.00 0.00 O ATOM 347 CB LEU A 24 -9.791 10.735 -0.541 1.00 0.00 C ATOM 348 CG LEU A 24 -9.604 9.684 0.593 1.00 0.00 C ATOM 349 CD1 LEU A 24 -10.154 8.298 0.215 1.00 0.00 C ATOM 350 CD2 LEU A 24 -8.139 9.592 1.042 1.00 0.00 C ATOM 0 H LEU A 24 -11.489 11.379 -2.694 1.00 0.00 H new ATOM 0 HA LEU A 24 -11.773 10.957 0.245 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -9.573 10.262 -1.499 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -9.061 11.533 -0.406 1.00 0.00 H new ATOM 0 HG LEU A 24 -10.195 10.039 1.437 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -9.997 7.606 1.042 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -11.221 8.375 0.004 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -9.635 7.930 -0.670 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -8.047 8.849 1.834 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -7.517 9.299 0.196 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -7.811 10.562 1.415 1.00 0.00 H new ATOM 362 N PRO A 25 -11.136 13.512 0.789 1.00 0.00 N ATOM 363 CA PRO A 25 -11.253 14.980 0.997 1.00 0.00 C ATOM 364 C PRO A 25 -9.963 15.774 0.654 1.00 0.00 C ATOM 365 O PRO A 25 -8.848 15.264 0.795 1.00 0.00 O ATOM 366 CB PRO A 25 -11.584 15.061 2.503 1.00 0.00 C ATOM 367 CG PRO A 25 -10.942 13.829 3.140 1.00 0.00 C ATOM 368 CD PRO A 25 -10.954 12.762 2.050 1.00 0.00 C ATOM 0 HA PRO A 25 -11.996 15.433 0.340 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -11.189 15.978 2.941 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -12.662 15.068 2.666 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -9.926 14.042 3.471 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -11.501 13.502 4.017 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -10.023 12.194 2.042 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -11.762 12.047 2.205 1.00 0.00 H new ATOM 376 N GLU A 26 -10.138 17.059 0.300 1.00 0.00 N ATOM 377 CA GLU A 26 -9.007 18.031 0.192 1.00 0.00 C ATOM 378 C GLU A 26 -8.194 18.292 1.510 1.00 0.00 C ATOM 379 O GLU A 26 -7.008 18.620 1.416 1.00 0.00 O ATOM 380 CB GLU A 26 -9.537 19.337 -0.460 1.00 0.00 C ATOM 381 CG GLU A 26 -8.440 20.288 -0.991 1.00 0.00 C ATOM 382 CD GLU A 26 -9.009 21.510 -1.714 1.00 0.00 C ATOM 383 OE1 GLU A 26 -9.233 21.436 -2.943 1.00 0.00 O ATOM 384 OE2 GLU A 26 -9.234 22.551 -1.059 1.00 0.00 O ATOM 0 H GLU A 26 -11.050 17.461 0.081 1.00 0.00 H new ATOM 0 HA GLU A 26 -8.254 17.568 -0.446 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -10.199 19.072 -1.285 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -10.140 19.874 0.273 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -7.821 20.621 -0.158 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -7.790 19.739 -1.672 1.00 0.00 H new ATOM 391 N GLU A 27 -8.783 18.089 2.712 1.00 0.00 N ATOM 392 CA GLU A 27 -8.030 17.979 3.994 1.00 0.00 C ATOM 393 C GLU A 27 -6.962 16.840 3.993 1.00 0.00 C ATOM 394 O GLU A 27 -5.795 17.148 4.235 1.00 0.00 O ATOM 395 CB GLU A 27 -9.056 17.877 5.162 1.00 0.00 C ATOM 396 CG GLU A 27 -8.506 18.030 6.601 1.00 0.00 C ATOM 397 CD GLU A 27 -7.772 16.805 7.165 1.00 0.00 C ATOM 398 OE1 GLU A 27 -8.429 15.773 7.429 1.00 0.00 O ATOM 399 OE2 GLU A 27 -6.534 16.867 7.338 1.00 0.00 O ATOM 0 H GLU A 27 -9.792 17.996 2.825 1.00 0.00 H new ATOM 0 HA GLU A 27 -7.431 18.879 4.132 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -9.819 18.640 5.009 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -9.554 16.910 5.091 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -7.825 18.881 6.622 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -9.337 18.271 7.264 1.00 0.00 H new ATOM 406 N LEU A 28 -7.325 15.568 3.710 1.00 0.00 N ATOM 407 CA LEU A 28 -6.329 14.453 3.606 1.00 0.00 C ATOM 408 C LEU A 28 -5.390 14.446 2.350 1.00 0.00 C ATOM 409 O LEU A 28 -4.354 13.778 2.394 1.00 0.00 O ATOM 410 CB LEU A 28 -7.033 13.073 3.772 1.00 0.00 C ATOM 411 CG LEU A 28 -7.725 12.775 5.136 1.00 0.00 C ATOM 412 CD1 LEU A 28 -8.501 11.443 5.071 1.00 0.00 C ATOM 413 CD2 LEU A 28 -6.748 12.748 6.331 1.00 0.00 C ATOM 0 H LEU A 28 -8.290 15.280 3.549 1.00 0.00 H new ATOM 0 HA LEU A 28 -5.645 14.646 4.432 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -7.784 12.983 2.987 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -6.291 12.294 3.594 1.00 0.00 H new ATOM 0 HG LEU A 28 -8.414 13.602 5.308 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -8.977 11.252 6.033 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -9.263 11.504 4.294 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -7.811 10.631 4.840 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -7.299 12.535 7.247 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -5.998 11.973 6.170 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -6.256 13.716 6.421 1.00 0.00 H new ATOM 425 N ILE A 29 -5.697 15.195 1.269 1.00 0.00 N ATOM 426 CA ILE A 29 -4.747 15.463 0.148 1.00 0.00 C ATOM 427 C ILE A 29 -3.651 16.484 0.602 1.00 0.00 C ATOM 428 O ILE A 29 -2.464 16.175 0.504 1.00 0.00 O ATOM 429 CB ILE A 29 -5.497 15.892 -1.169 1.00 0.00 C ATOM 430 CG1 ILE A 29 -6.548 14.846 -1.644 1.00 0.00 C ATOM 431 CG2 ILE A 29 -4.509 16.174 -2.331 1.00 0.00 C ATOM 432 CD1 ILE A 29 -7.510 15.301 -2.756 1.00 0.00 C ATOM 0 H ILE A 29 -6.609 15.635 1.141 1.00 0.00 H new ATOM 0 HA ILE A 29 -4.234 14.535 -0.106 1.00 0.00 H new ATOM 0 HB ILE A 29 -6.024 16.809 -0.907 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -6.016 13.961 -1.993 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -7.141 14.542 -0.782 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -5.067 16.467 -3.220 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -3.832 16.980 -2.046 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -3.932 15.274 -2.545 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -8.193 14.488 -3.001 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -8.081 16.164 -2.413 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -6.938 15.574 -3.643 1.00 0.00 H new ATOM 444 N GLN A 30 -4.039 17.685 1.070 1.00 0.00 N ATOM 445 CA GLN A 30 -3.078 18.736 1.519 1.00 0.00 C ATOM 446 C GLN A 30 -2.305 18.452 2.850 1.00 0.00 C ATOM 447 O GLN A 30 -1.185 18.946 3.003 1.00 0.00 O ATOM 448 CB GLN A 30 -3.799 20.113 1.573 1.00 0.00 C ATOM 449 CG GLN A 30 -4.369 20.666 0.241 1.00 0.00 C ATOM 450 CD GLN A 30 -3.323 20.921 -0.862 1.00 0.00 C ATOM 451 OE1 GLN A 30 -2.508 21.838 -0.770 1.00 0.00 O ATOM 452 NE2 GLN A 30 -3.318 20.121 -1.918 1.00 0.00 N ATOM 0 H GLN A 30 -5.017 17.963 1.151 1.00 0.00 H new ATOM 0 HA GLN A 30 -2.289 18.736 0.767 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -4.620 20.037 2.286 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -3.098 20.846 1.971 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -5.110 19.963 -0.139 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -4.892 21.600 0.447 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -3.997 19.363 -1.987 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -2.635 20.263 -2.662 1.00 0.00 H new ATOM 461 N LYS A 31 -2.872 17.660 3.783 1.00 0.00 N ATOM 462 CA LYS A 31 -2.152 17.158 4.986 1.00 0.00 C ATOM 463 C LYS A 31 -1.283 15.896 4.678 1.00 0.00 C ATOM 464 O LYS A 31 -0.096 15.895 5.021 1.00 0.00 O ATOM 465 CB LYS A 31 -3.190 16.938 6.126 1.00 0.00 C ATOM 466 CG LYS A 31 -2.634 16.649 7.539 1.00 0.00 C ATOM 467 CD LYS A 31 -1.893 17.831 8.199 1.00 0.00 C ATOM 468 CE LYS A 31 -1.434 17.520 9.634 1.00 0.00 C ATOM 469 NZ LYS A 31 -0.745 18.673 10.242 1.00 0.00 N ATOM 0 H LYS A 31 -3.841 17.347 3.730 1.00 0.00 H new ATOM 0 HA LYS A 31 -1.429 17.903 5.318 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -3.820 17.825 6.186 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -3.835 16.107 5.840 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -3.460 16.351 8.185 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -1.953 15.800 7.479 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -1.025 18.094 7.594 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -2.548 18.702 8.213 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -2.297 17.248 10.242 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -0.766 16.659 9.625 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -0.449 18.430 11.209 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 0.092 18.916 9.674 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -1.391 19.487 10.272 1.00 0.00 H new ATOM 483 N GLY A 32 -1.850 14.852 4.035 1.00 0.00 N ATOM 484 CA GLY A 32 -1.095 13.634 3.644 1.00 0.00 C ATOM 485 C GLY A 32 -0.055 13.703 2.491 1.00 0.00 C ATOM 486 O GLY A 32 0.662 12.717 2.301 1.00 0.00 O ATOM 0 H GLY A 32 -2.835 14.826 3.773 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -0.572 13.277 4.532 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -1.826 12.871 3.376 1.00 0.00 H new ATOM 490 N LYS A 33 0.061 14.825 1.749 1.00 0.00 N ATOM 491 CA LYS A 33 1.161 15.048 0.764 1.00 0.00 C ATOM 492 C LYS A 33 2.570 15.243 1.414 1.00 0.00 C ATOM 493 O LYS A 33 3.536 14.614 0.971 1.00 0.00 O ATOM 494 CB LYS A 33 0.781 16.154 -0.263 1.00 0.00 C ATOM 495 CG LYS A 33 0.680 17.612 0.247 1.00 0.00 C ATOM 496 CD LYS A 33 0.114 18.618 -0.775 1.00 0.00 C ATOM 497 CE LYS A 33 1.022 18.951 -1.975 1.00 0.00 C ATOM 498 NZ LYS A 33 2.240 19.698 -1.606 1.00 0.00 N ATOM 0 H LYS A 33 -0.597 15.602 1.809 1.00 0.00 H new ATOM 0 HA LYS A 33 1.269 14.120 0.202 1.00 0.00 H new ATOM 0 HB2 LYS A 33 1.517 16.131 -1.067 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -0.180 15.886 -0.703 1.00 0.00 H new ATOM 0 HG2 LYS A 33 0.051 17.628 1.137 1.00 0.00 H new ATOM 0 HG3 LYS A 33 1.672 17.945 0.552 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -0.828 18.225 -1.157 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -0.116 19.546 -0.251 1.00 0.00 H new ATOM 0 HE2 LYS A 33 1.311 18.024 -2.470 1.00 0.00 H new ATOM 0 HE3 LYS A 33 0.453 19.535 -2.699 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 2.803 19.888 -2.460 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 1.973 20.599 -1.160 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 2.804 19.135 -0.938 1.00 0.00 H new ATOM 512 N ASP A 34 2.667 16.065 2.479 1.00 0.00 N ATOM 513 CA ASP A 34 3.880 16.166 3.341 1.00 0.00 C ATOM 514 C ASP A 34 4.184 14.897 4.204 1.00 0.00 C ATOM 515 O ASP A 34 5.363 14.574 4.382 1.00 0.00 O ATOM 516 CB ASP A 34 3.780 17.420 4.254 1.00 0.00 C ATOM 517 CG ASP A 34 3.772 18.775 3.525 1.00 0.00 C ATOM 518 OD1 ASP A 34 4.863 19.328 3.263 1.00 0.00 O ATOM 519 OD2 ASP A 34 2.674 19.285 3.210 1.00 0.00 O ATOM 0 H ASP A 34 1.909 16.682 2.772 1.00 0.00 H new ATOM 0 HA ASP A 34 4.720 16.255 2.652 1.00 0.00 H new ATOM 0 HB2 ASP A 34 2.870 17.342 4.849 1.00 0.00 H new ATOM 0 HB3 ASP A 34 4.618 17.408 4.951 1.00 0.00 H new ATOM 524 N ILE A 35 3.157 14.181 4.725 1.00 0.00 N ATOM 525 CA ILE A 35 3.341 12.950 5.549 1.00 0.00 C ATOM 526 C ILE A 35 3.732 11.775 4.593 1.00 0.00 C ATOM 527 O ILE A 35 2.970 11.405 3.692 1.00 0.00 O ATOM 528 CB ILE A 35 2.065 12.615 6.410 1.00 0.00 C ATOM 529 CG1 ILE A 35 1.589 13.781 7.334 1.00 0.00 C ATOM 530 CG2 ILE A 35 2.273 11.339 7.274 1.00 0.00 C ATOM 531 CD1 ILE A 35 0.143 13.663 7.844 1.00 0.00 C ATOM 0 H ILE A 35 2.179 14.436 4.589 1.00 0.00 H new ATOM 0 HA ILE A 35 4.141 13.113 6.271 1.00 0.00 H new ATOM 0 HB ILE A 35 1.280 12.445 5.673 1.00 0.00 H new ATOM 0 HG12 ILE A 35 2.257 13.838 8.193 1.00 0.00 H new ATOM 0 HG13 ILE A 35 1.690 14.720 6.789 1.00 0.00 H new ATOM 0 HG21 ILE A 35 1.371 11.141 7.853 1.00 0.00 H new ATOM 0 HG22 ILE A 35 2.481 10.489 6.624 1.00 0.00 H new ATOM 0 HG23 ILE A 35 3.113 11.491 7.951 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -0.091 14.520 8.476 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -0.541 13.640 6.996 1.00 0.00 H new ATOM 0 HD13 ILE A 35 0.035 12.745 8.422 1.00 0.00 H new ATOM 543 N LYS A 36 4.916 11.187 4.840 1.00 0.00 N ATOM 544 CA LYS A 36 5.410 10.004 4.088 1.00 0.00 C ATOM 545 C LYS A 36 4.906 8.710 4.790 1.00 0.00 C ATOM 546 O LYS A 36 5.279 8.425 5.935 1.00 0.00 O ATOM 547 CB LYS A 36 6.960 10.031 4.002 1.00 0.00 C ATOM 548 CG LYS A 36 7.548 11.125 3.082 1.00 0.00 C ATOM 549 CD LYS A 36 9.090 11.134 3.073 1.00 0.00 C ATOM 550 CE LYS A 36 9.670 12.021 1.956 1.00 0.00 C ATOM 551 NZ LYS A 36 11.143 11.971 1.943 1.00 0.00 N ATOM 0 H LYS A 36 5.560 11.511 5.562 1.00 0.00 H new ATOM 0 HA LYS A 36 5.023 10.025 3.069 1.00 0.00 H new ATOM 0 HB2 LYS A 36 7.361 10.168 5.006 1.00 0.00 H new ATOM 0 HB3 LYS A 36 7.306 9.059 3.651 1.00 0.00 H new ATOM 0 HG2 LYS A 36 7.184 10.973 2.066 1.00 0.00 H new ATOM 0 HG3 LYS A 36 7.186 12.100 3.407 1.00 0.00 H new ATOM 0 HD2 LYS A 36 9.453 11.487 4.038 1.00 0.00 H new ATOM 0 HD3 LYS A 36 9.455 10.114 2.949 1.00 0.00 H new ATOM 0 HE2 LYS A 36 9.284 11.693 0.991 1.00 0.00 H new ATOM 0 HE3 LYS A 36 9.340 13.050 2.098 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 11.504 12.578 1.180 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 11.510 12.307 2.856 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 11.456 10.992 1.784 1.00 0.00 H new ATOM 565 N GLY A 37 4.045 7.947 4.094 1.00 0.00 N ATOM 566 CA GLY A 37 3.432 6.718 4.645 1.00 0.00 C ATOM 567 C GLY A 37 4.181 5.431 4.245 1.00 0.00 C ATOM 568 O GLY A 37 4.488 5.223 3.067 1.00 0.00 O ATOM 0 H GLY A 37 3.754 8.160 3.140 1.00 0.00 H new ATOM 0 HA2 GLY A 37 3.403 6.790 5.732 1.00 0.00 H new ATOM 0 HA3 GLY A 37 2.399 6.650 4.303 1.00 0.00 H new ATOM 572 N VAL A 38 4.433 4.547 5.228 1.00 0.00 N ATOM 573 CA VAL A 38 5.146 3.257 4.992 1.00 0.00 C ATOM 574 C VAL A 38 4.113 2.221 4.447 1.00 0.00 C ATOM 575 O VAL A 38 3.117 1.908 5.105 1.00 0.00 O ATOM 576 CB VAL A 38 5.890 2.729 6.271 1.00 0.00 C ATOM 577 CG1 VAL A 38 6.708 1.439 6.004 1.00 0.00 C ATOM 578 CG2 VAL A 38 6.861 3.751 6.909 1.00 0.00 C ATOM 0 H VAL A 38 4.157 4.694 6.199 1.00 0.00 H new ATOM 0 HA VAL A 38 5.933 3.417 4.255 1.00 0.00 H new ATOM 0 HB VAL A 38 5.070 2.531 6.962 1.00 0.00 H new ATOM 0 HG11 VAL A 38 7.199 1.123 6.924 1.00 0.00 H new ATOM 0 HG12 VAL A 38 6.040 0.650 5.659 1.00 0.00 H new ATOM 0 HG13 VAL A 38 7.460 1.637 5.241 1.00 0.00 H new ATOM 0 HG21 VAL A 38 7.332 3.307 7.786 1.00 0.00 H new ATOM 0 HG22 VAL A 38 7.628 4.026 6.185 1.00 0.00 H new ATOM 0 HG23 VAL A 38 6.308 4.642 7.207 1.00 0.00 H new ATOM 588 N SER A 39 4.398 1.675 3.254 1.00 0.00 N ATOM 589 CA SER A 39 3.638 0.537 2.686 1.00 0.00 C ATOM 590 C SER A 39 4.407 -0.762 3.030 1.00 0.00 C ATOM 591 O SER A 39 5.452 -1.063 2.448 1.00 0.00 O ATOM 592 CB SER A 39 3.474 0.698 1.161 1.00 0.00 C ATOM 593 OG SER A 39 2.709 1.855 0.836 1.00 0.00 O ATOM 0 H SER A 39 5.156 2.003 2.655 1.00 0.00 H new ATOM 0 HA SER A 39 2.635 0.500 3.112 1.00 0.00 H new ATOM 0 HB2 SER A 39 4.456 0.767 0.694 1.00 0.00 H new ATOM 0 HB3 SER A 39 2.988 -0.187 0.751 1.00 0.00 H new ATOM 0 HG SER A 39 2.625 1.929 -0.138 1.00 0.00 H new ATOM 599 N GLU A 40 3.874 -1.516 3.999 1.00 0.00 N ATOM 600 CA GLU A 40 4.438 -2.819 4.419 1.00 0.00 C ATOM 601 C GLU A 40 3.851 -3.954 3.549 1.00 0.00 C ATOM 602 O GLU A 40 2.689 -3.916 3.135 1.00 0.00 O ATOM 603 CB GLU A 40 4.109 -3.078 5.908 1.00 0.00 C ATOM 604 CG GLU A 40 4.852 -2.199 6.931 1.00 0.00 C ATOM 605 CD GLU A 40 3.974 -1.160 7.639 1.00 0.00 C ATOM 606 OE1 GLU A 40 3.838 -0.029 7.126 1.00 0.00 O ATOM 607 OE2 GLU A 40 3.408 -1.476 8.709 1.00 0.00 O ATOM 0 H GLU A 40 3.039 -1.246 4.519 1.00 0.00 H new ATOM 0 HA GLU A 40 5.520 -2.795 4.290 1.00 0.00 H new ATOM 0 HB2 GLU A 40 3.037 -2.939 6.051 1.00 0.00 H new ATOM 0 HB3 GLU A 40 4.328 -4.122 6.131 1.00 0.00 H new ATOM 0 HG2 GLU A 40 5.306 -2.845 7.683 1.00 0.00 H new ATOM 0 HG3 GLU A 40 5.665 -1.682 6.422 1.00 0.00 H new ATOM 614 N ILE A 41 4.697 -4.955 3.274 1.00 0.00 N ATOM 615 CA ILE A 41 4.316 -6.148 2.462 1.00 0.00 C ATOM 616 C ILE A 41 5.133 -7.334 3.067 1.00 0.00 C ATOM 617 O ILE A 41 6.357 -7.241 3.219 1.00 0.00 O ATOM 618 CB ILE A 41 4.556 -5.985 0.910 1.00 0.00 C ATOM 619 CG1 ILE A 41 3.965 -4.687 0.272 1.00 0.00 C ATOM 620 CG2 ILE A 41 4.015 -7.219 0.143 1.00 0.00 C ATOM 621 CD1 ILE A 41 4.414 -4.382 -1.165 1.00 0.00 C ATOM 0 H ILE A 41 5.663 -4.974 3.600 1.00 0.00 H new ATOM 0 HA ILE A 41 3.240 -6.314 2.522 1.00 0.00 H new ATOM 0 HB ILE A 41 5.638 -5.901 0.812 1.00 0.00 H new ATOM 0 HG12 ILE A 41 2.878 -4.762 0.284 1.00 0.00 H new ATOM 0 HG13 ILE A 41 4.233 -3.840 0.904 1.00 0.00 H new ATOM 0 HG21 ILE A 41 4.189 -7.089 -0.925 1.00 0.00 H new ATOM 0 HG22 ILE A 41 4.529 -8.116 0.488 1.00 0.00 H new ATOM 0 HG23 ILE A 41 2.945 -7.321 0.326 1.00 0.00 H new ATOM 0 HD11 ILE A 41 3.943 -3.460 -1.506 1.00 0.00 H new ATOM 0 HD12 ILE A 41 5.498 -4.267 -1.191 1.00 0.00 H new ATOM 0 HD13 ILE A 41 4.121 -5.203 -1.820 1.00 0.00 H new ATOM 633 N VAL A 42 4.450 -8.450 3.386 1.00 0.00 N ATOM 634 CA VAL A 42 5.086 -9.656 3.996 1.00 0.00 C ATOM 635 C VAL A 42 4.707 -10.860 3.083 1.00 0.00 C ATOM 636 O VAL A 42 3.537 -11.249 3.015 1.00 0.00 O ATOM 637 CB VAL A 42 4.659 -9.874 5.493 1.00 0.00 C ATOM 638 CG1 VAL A 42 5.327 -11.112 6.137 1.00 0.00 C ATOM 639 CG2 VAL A 42 4.942 -8.659 6.413 1.00 0.00 C ATOM 0 H VAL A 42 3.447 -8.551 3.233 1.00 0.00 H new ATOM 0 HA VAL A 42 6.168 -9.536 4.044 1.00 0.00 H new ATOM 0 HB VAL A 42 3.581 -10.023 5.423 1.00 0.00 H new ATOM 0 HG11 VAL A 42 4.993 -11.210 7.170 1.00 0.00 H new ATOM 0 HG12 VAL A 42 5.049 -12.007 5.580 1.00 0.00 H new ATOM 0 HG13 VAL A 42 6.410 -10.993 6.116 1.00 0.00 H new ATOM 0 HG21 VAL A 42 4.619 -8.889 7.429 1.00 0.00 H new ATOM 0 HG22 VAL A 42 6.010 -8.443 6.412 1.00 0.00 H new ATOM 0 HG23 VAL A 42 4.396 -7.790 6.046 1.00 0.00 H new ATOM 649 N GLN A 43 5.715 -11.478 2.437 1.00 0.00 N ATOM 650 CA GLN A 43 5.536 -12.735 1.660 1.00 0.00 C ATOM 651 C GLN A 43 5.486 -13.973 2.603 1.00 0.00 C ATOM 652 O GLN A 43 6.359 -14.157 3.460 1.00 0.00 O ATOM 653 CB GLN A 43 6.688 -12.843 0.619 1.00 0.00 C ATOM 654 CG GLN A 43 6.751 -14.117 -0.262 1.00 0.00 C ATOM 655 CD GLN A 43 5.595 -14.290 -1.258 1.00 0.00 C ATOM 656 OE1 GLN A 43 4.455 -14.543 -0.872 1.00 0.00 O ATOM 657 NE2 GLN A 43 5.861 -14.181 -2.552 1.00 0.00 N ATOM 0 H GLN A 43 6.673 -11.128 2.434 1.00 0.00 H new ATOM 0 HA GLN A 43 4.583 -12.712 1.132 1.00 0.00 H new ATOM 0 HB2 GLN A 43 6.622 -11.981 -0.044 1.00 0.00 H new ATOM 0 HB3 GLN A 43 7.633 -12.760 1.156 1.00 0.00 H new ATOM 0 HG2 GLN A 43 7.688 -14.107 -0.818 1.00 0.00 H new ATOM 0 HG3 GLN A 43 6.778 -14.989 0.392 1.00 0.00 H new ATOM 0 HE21 GLN A 43 6.810 -13.971 -2.862 1.00 0.00 H new ATOM 0 HE22 GLN A 43 5.117 -14.307 -3.238 1.00 0.00 H new ATOM 666 N ASN A 44 4.473 -14.832 2.388 1.00 0.00 N ATOM 667 CA ASN A 44 4.349 -16.147 3.080 1.00 0.00 C ATOM 668 C ASN A 44 3.954 -17.241 2.031 1.00 0.00 C ATOM 669 O ASN A 44 2.864 -17.819 2.100 1.00 0.00 O ATOM 670 CB ASN A 44 3.330 -16.049 4.260 1.00 0.00 C ATOM 671 CG ASN A 44 3.640 -15.035 5.381 1.00 0.00 C ATOM 672 OD1 ASN A 44 3.123 -13.918 5.390 1.00 0.00 O ATOM 673 ND2 ASN A 44 4.487 -15.395 6.334 1.00 0.00 N ATOM 0 H ASN A 44 3.714 -14.643 1.733 1.00 0.00 H new ATOM 0 HA ASN A 44 5.304 -16.433 3.520 1.00 0.00 H new ATOM 0 HB2 ASN A 44 2.354 -15.802 3.843 1.00 0.00 H new ATOM 0 HB3 ASN A 44 3.243 -17.036 4.713 1.00 0.00 H new ATOM 0 HD21 ASN A 44 4.716 -14.744 7.085 1.00 0.00 H new ATOM 0 HD22 ASN A 44 4.910 -16.323 6.317 1.00 0.00 H new ATOM 680 N GLY A 45 4.841 -17.532 1.052 1.00 0.00 N ATOM 681 CA GLY A 45 4.563 -18.508 -0.033 1.00 0.00 C ATOM 682 C GLY A 45 3.621 -17.957 -1.128 1.00 0.00 C ATOM 683 O GLY A 45 4.029 -17.129 -1.945 1.00 0.00 O ATOM 0 H GLY A 45 5.764 -17.102 0.989 1.00 0.00 H new ATOM 0 HA2 GLY A 45 5.505 -18.808 -0.492 1.00 0.00 H new ATOM 0 HA3 GLY A 45 4.120 -19.405 0.400 1.00 0.00 H new ATOM 687 N LYS A 46 2.357 -18.408 -1.104 1.00 0.00 N ATOM 688 CA LYS A 46 1.228 -17.726 -1.802 1.00 0.00 C ATOM 689 C LYS A 46 0.519 -16.652 -0.912 1.00 0.00 C ATOM 690 O LYS A 46 0.153 -15.597 -1.433 1.00 0.00 O ATOM 691 CB LYS A 46 0.200 -18.775 -2.302 1.00 0.00 C ATOM 692 CG LYS A 46 0.669 -19.639 -3.493 1.00 0.00 C ATOM 693 CD LYS A 46 -0.394 -20.658 -3.947 1.00 0.00 C ATOM 694 CE LYS A 46 0.073 -21.502 -5.145 1.00 0.00 C ATOM 695 NZ LYS A 46 -0.944 -22.494 -5.537 1.00 0.00 N ATOM 0 H LYS A 46 2.077 -19.252 -0.605 1.00 0.00 H new ATOM 0 HA LYS A 46 1.655 -17.194 -2.652 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -0.054 -19.435 -1.473 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -0.715 -18.256 -2.588 1.00 0.00 H new ATOM 0 HG2 LYS A 46 0.923 -18.989 -4.330 1.00 0.00 H new ATOM 0 HG3 LYS A 46 1.579 -20.170 -3.214 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -0.639 -21.318 -3.115 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -1.309 -20.129 -4.214 1.00 0.00 H new ATOM 0 HE2 LYS A 46 0.289 -20.848 -5.990 1.00 0.00 H new ATOM 0 HE3 LYS A 46 1.002 -22.013 -4.891 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -0.597 -23.046 -6.347 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -1.132 -23.133 -4.738 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -1.822 -22.004 -5.803 1.00 0.00 H new ATOM 709 N HIS A 47 0.322 -16.912 0.400 1.00 0.00 N ATOM 710 CA HIS A 47 -0.304 -15.968 1.365 1.00 0.00 C ATOM 711 C HIS A 47 0.493 -14.646 1.557 1.00 0.00 C ATOM 712 O HIS A 47 1.714 -14.593 1.385 1.00 0.00 O ATOM 713 CB HIS A 47 -0.462 -16.696 2.733 1.00 0.00 C ATOM 714 CG HIS A 47 -1.657 -17.650 2.825 1.00 0.00 C ATOM 715 ND1 HIS A 47 -1.663 -18.958 2.371 1.00 0.00 N ATOM 716 CD2 HIS A 47 -2.905 -17.338 3.393 1.00 0.00 C ATOM 717 CE1 HIS A 47 -2.939 -19.319 2.708 1.00 0.00 C ATOM 718 NE2 HIS A 47 -3.771 -18.421 3.332 1.00 0.00 N ATOM 0 H HIS A 47 0.596 -17.796 0.829 1.00 0.00 H new ATOM 0 HA HIS A 47 -1.270 -15.675 0.955 1.00 0.00 H new ATOM 0 HB2 HIS A 47 0.449 -17.259 2.935 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -0.554 -15.946 3.518 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -3.157 -16.379 3.821 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -3.294 -20.314 2.483 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -4.734 -18.520 3.653 1.00 0.00 H new ATOM 726 N PHE A 48 -0.245 -13.584 1.915 1.00 0.00 N ATOM 727 CA PHE A 48 0.327 -12.234 2.167 1.00 0.00 C ATOM 728 C PHE A 48 -0.345 -11.569 3.396 1.00 0.00 C ATOM 729 O PHE A 48 -1.529 -11.771 3.680 1.00 0.00 O ATOM 730 CB PHE A 48 0.183 -11.313 0.917 1.00 0.00 C ATOM 731 CG PHE A 48 1.327 -11.449 -0.097 1.00 0.00 C ATOM 732 CD1 PHE A 48 1.281 -12.413 -1.108 1.00 0.00 C ATOM 733 CD2 PHE A 48 2.426 -10.587 -0.022 1.00 0.00 C ATOM 734 CE1 PHE A 48 2.311 -12.502 -2.040 1.00 0.00 C ATOM 735 CE2 PHE A 48 3.455 -10.682 -0.951 1.00 0.00 C ATOM 736 CZ PHE A 48 3.394 -11.631 -1.965 1.00 0.00 C ATOM 0 H PHE A 48 -1.256 -13.627 2.040 1.00 0.00 H new ATOM 0 HA PHE A 48 1.389 -12.365 2.375 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -0.759 -11.540 0.418 1.00 0.00 H new ATOM 0 HB3 PHE A 48 0.126 -10.276 1.248 1.00 0.00 H new ATOM 0 HD1 PHE A 48 0.443 -13.092 -1.166 1.00 0.00 H new ATOM 0 HD2 PHE A 48 2.475 -9.845 0.761 1.00 0.00 H new ATOM 0 HE1 PHE A 48 2.270 -13.247 -2.821 1.00 0.00 H new ATOM 0 HE2 PHE A 48 4.304 -10.017 -0.885 1.00 0.00 H new ATOM 0 HZ PHE A 48 4.188 -11.692 -2.695 1.00 0.00 H new ATOM 746 N LYS A 49 0.437 -10.709 4.075 1.00 0.00 N ATOM 747 CA LYS A 49 -0.093 -9.730 5.054 1.00 0.00 C ATOM 748 C LYS A 49 0.601 -8.378 4.744 1.00 0.00 C ATOM 749 O LYS A 49 1.798 -8.199 4.986 1.00 0.00 O ATOM 750 CB LYS A 49 0.164 -10.197 6.506 1.00 0.00 C ATOM 751 CG LYS A 49 -0.602 -9.388 7.578 1.00 0.00 C ATOM 752 CD LYS A 49 -0.189 -9.686 9.037 1.00 0.00 C ATOM 753 CE LYS A 49 1.220 -9.215 9.463 1.00 0.00 C ATOM 754 NZ LYS A 49 1.375 -7.747 9.468 1.00 0.00 N ATOM 0 H LYS A 49 1.450 -10.670 3.964 1.00 0.00 H new ATOM 0 HA LYS A 49 -1.175 -9.629 4.967 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -0.114 -11.247 6.592 1.00 0.00 H new ATOM 0 HB3 LYS A 49 1.232 -10.132 6.713 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -0.455 -8.325 7.384 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -1.668 -9.587 7.470 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -0.919 -9.222 9.700 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -0.252 -10.762 9.197 1.00 0.00 H new ATOM 0 HE2 LYS A 49 1.436 -9.598 10.460 1.00 0.00 H new ATOM 0 HE3 LYS A 49 1.958 -9.648 8.788 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 2.342 -7.501 9.763 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 1.199 -7.376 8.512 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 0.693 -7.328 10.133 1.00 0.00 H new ATOM 768 N PHE A 50 -0.188 -7.440 4.211 1.00 0.00 N ATOM 769 CA PHE A 50 0.290 -6.092 3.806 1.00 0.00 C ATOM 770 C PHE A 50 -0.435 -5.009 4.653 1.00 0.00 C ATOM 771 O PHE A 50 -1.663 -5.037 4.792 1.00 0.00 O ATOM 772 CB PHE A 50 0.183 -5.891 2.266 1.00 0.00 C ATOM 773 CG PHE A 50 -1.213 -5.674 1.650 1.00 0.00 C ATOM 774 CD1 PHE A 50 -2.100 -6.741 1.501 1.00 0.00 C ATOM 775 CD2 PHE A 50 -1.616 -4.389 1.270 1.00 0.00 C ATOM 776 CE1 PHE A 50 -3.379 -6.522 1.000 1.00 0.00 C ATOM 777 CE2 PHE A 50 -2.892 -4.174 0.756 1.00 0.00 C ATOM 778 CZ PHE A 50 -3.774 -5.242 0.618 1.00 0.00 C ATOM 0 H PHE A 50 -1.184 -7.584 4.043 1.00 0.00 H new ATOM 0 HA PHE A 50 1.354 -5.991 4.019 1.00 0.00 H new ATOM 0 HB2 PHE A 50 0.800 -5.033 2.000 1.00 0.00 H new ATOM 0 HB3 PHE A 50 0.626 -6.764 1.786 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -1.793 -7.739 1.775 1.00 0.00 H new ATOM 0 HD2 PHE A 50 -0.933 -3.559 1.376 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -4.069 -7.348 0.907 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -3.197 -3.180 0.465 1.00 0.00 H new ATOM 0 HZ PHE A 50 -4.763 -5.079 0.215 1.00 0.00 H new ATOM 788 N THR A 51 0.348 -4.068 5.209 1.00 0.00 N ATOM 789 CA THR A 51 -0.164 -3.052 6.171 1.00 0.00 C ATOM 790 C THR A 51 0.181 -1.651 5.594 1.00 0.00 C ATOM 791 O THR A 51 1.300 -1.155 5.765 1.00 0.00 O ATOM 792 CB THR A 51 0.411 -3.298 7.605 1.00 0.00 C ATOM 793 OG1 THR A 51 0.293 -4.667 7.988 1.00 0.00 O ATOM 794 CG2 THR A 51 -0.282 -2.465 8.695 1.00 0.00 C ATOM 0 H THR A 51 1.345 -3.983 5.013 1.00 0.00 H new ATOM 0 HA THR A 51 -1.245 -3.124 6.287 1.00 0.00 H new ATOM 0 HB THR A 51 1.456 -2.996 7.534 1.00 0.00 H new ATOM 0 HG1 THR A 51 0.663 -4.788 8.888 1.00 0.00 H new ATOM 0 HG21 THR A 51 0.167 -2.686 9.663 1.00 0.00 H new ATOM 0 HG22 THR A 51 -0.163 -1.404 8.474 1.00 0.00 H new ATOM 0 HG23 THR A 51 -1.343 -2.713 8.723 1.00 0.00 H new ATOM 802 N ILE A 52 -0.791 -1.007 4.919 1.00 0.00 N ATOM 803 CA ILE A 52 -0.599 0.341 4.313 1.00 0.00 C ATOM 804 C ILE A 52 -0.952 1.383 5.412 1.00 0.00 C ATOM 805 O ILE A 52 -2.109 1.506 5.820 1.00 0.00 O ATOM 806 CB ILE A 52 -1.441 0.554 3.007 1.00 0.00 C ATOM 807 CG1 ILE A 52 -1.325 -0.564 1.926 1.00 0.00 C ATOM 808 CG2 ILE A 52 -1.199 1.938 2.354 1.00 0.00 C ATOM 809 CD1 ILE A 52 0.078 -0.832 1.355 1.00 0.00 C ATOM 0 H ILE A 52 -1.724 -1.394 4.775 1.00 0.00 H new ATOM 0 HA ILE A 52 0.435 0.455 3.988 1.00 0.00 H new ATOM 0 HB ILE A 52 -2.463 0.500 3.382 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -1.700 -1.493 2.356 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -1.985 -0.306 1.098 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -1.808 2.028 1.455 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -1.472 2.725 3.057 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -0.146 2.037 2.090 1.00 0.00 H new ATOM 0 HD11 ILE A 52 0.023 -1.630 0.615 1.00 0.00 H new ATOM 0 HD12 ILE A 52 0.458 0.074 0.884 1.00 0.00 H new ATOM 0 HD13 ILE A 52 0.748 -1.131 2.161 1.00 0.00 H new ATOM 821 N THR A 53 0.065 2.133 5.857 1.00 0.00 N ATOM 822 CA THR A 53 -0.096 3.180 6.904 1.00 0.00 C ATOM 823 C THR A 53 -0.100 4.567 6.195 1.00 0.00 C ATOM 824 O THR A 53 0.946 5.206 6.048 1.00 0.00 O ATOM 825 CB THR A 53 0.981 3.049 8.030 1.00 0.00 C ATOM 826 OG1 THR A 53 2.303 3.213 7.522 1.00 0.00 O ATOM 827 CG2 THR A 53 0.942 1.728 8.819 1.00 0.00 C ATOM 0 H THR A 53 1.020 2.041 5.512 1.00 0.00 H new ATOM 0 HA THR A 53 -1.044 3.056 7.427 1.00 0.00 H new ATOM 0 HB THR A 53 0.721 3.854 8.718 1.00 0.00 H new ATOM 0 HG1 THR A 53 2.412 2.671 6.713 1.00 0.00 H new ATOM 0 HG21 THR A 53 1.726 1.733 9.576 1.00 0.00 H new ATOM 0 HG22 THR A 53 -0.029 1.622 9.303 1.00 0.00 H new ATOM 0 HG23 THR A 53 1.101 0.892 8.137 1.00 0.00 H new ATOM 835 N ALA A 54 -1.288 5.002 5.729 1.00 0.00 N ATOM 836 CA ALA A 54 -1.439 6.238 4.920 1.00 0.00 C ATOM 837 C ALA A 54 -2.023 7.377 5.794 1.00 0.00 C ATOM 838 O ALA A 54 -3.243 7.482 5.969 1.00 0.00 O ATOM 839 CB ALA A 54 -2.321 5.918 3.696 1.00 0.00 C ATOM 0 H ALA A 54 -2.167 4.513 5.899 1.00 0.00 H new ATOM 0 HA ALA A 54 -0.471 6.587 4.560 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -2.442 6.816 3.090 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -1.846 5.139 3.099 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -3.299 5.572 4.032 1.00 0.00 H new ATOM 845 N GLY A 55 -1.128 8.211 6.358 1.00 0.00 N ATOM 846 CA GLY A 55 -1.519 9.350 7.221 1.00 0.00 C ATOM 847 C GLY A 55 -2.013 8.913 8.616 1.00 0.00 C ATOM 848 O GLY A 55 -1.225 8.436 9.437 1.00 0.00 O ATOM 0 H GLY A 55 -0.120 8.118 6.232 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -0.666 10.019 7.338 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -2.306 9.920 6.726 1.00 0.00 H new ATOM 852 N SER A 56 -3.328 9.059 8.837 1.00 0.00 N ATOM 853 CA SER A 56 -4.019 8.532 10.046 1.00 0.00 C ATOM 854 C SER A 56 -4.520 7.059 9.914 1.00 0.00 C ATOM 855 O SER A 56 -4.313 6.274 10.845 1.00 0.00 O ATOM 856 CB SER A 56 -5.148 9.501 10.472 1.00 0.00 C ATOM 857 OG SER A 56 -6.172 9.618 9.487 1.00 0.00 O ATOM 0 H SER A 56 -3.950 9.543 8.190 1.00 0.00 H new ATOM 0 HA SER A 56 -3.272 8.485 10.838 1.00 0.00 H new ATOM 0 HB2 SER A 56 -5.587 9.153 11.407 1.00 0.00 H new ATOM 0 HB3 SER A 56 -4.722 10.485 10.667 1.00 0.00 H new ATOM 0 HG SER A 56 -6.861 10.239 9.804 1.00 0.00 H new ATOM 863 N LYS A 57 -5.189 6.688 8.798 1.00 0.00 N ATOM 864 CA LYS A 57 -5.866 5.372 8.652 1.00 0.00 C ATOM 865 C LYS A 57 -4.869 4.235 8.281 1.00 0.00 C ATOM 866 O LYS A 57 -4.032 4.384 7.384 1.00 0.00 O ATOM 867 CB LYS A 57 -6.991 5.455 7.583 1.00 0.00 C ATOM 868 CG LYS A 57 -8.206 6.327 7.979 1.00 0.00 C ATOM 869 CD LYS A 57 -9.331 6.298 6.923 1.00 0.00 C ATOM 870 CE LYS A 57 -10.554 7.178 7.254 1.00 0.00 C ATOM 871 NZ LYS A 57 -11.365 6.655 8.371 1.00 0.00 N ATOM 0 H LYS A 57 -5.276 7.286 7.976 1.00 0.00 H new ATOM 0 HA LYS A 57 -6.301 5.128 9.621 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -6.566 5.849 6.660 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -7.342 4.446 7.367 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -8.601 5.980 8.934 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -7.877 7.356 8.125 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -8.919 6.618 5.966 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -9.666 5.268 6.798 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -10.213 8.183 7.501 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -11.182 7.264 6.367 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -12.170 7.291 8.543 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -11.718 5.707 8.130 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -10.779 6.598 9.229 1.00 0.00 H new ATOM 885 N VAL A 58 -5.013 3.094 8.981 1.00 0.00 N ATOM 886 CA VAL A 58 -4.198 1.870 8.743 1.00 0.00 C ATOM 887 C VAL A 58 -5.133 0.873 7.992 1.00 0.00 C ATOM 888 O VAL A 58 -6.114 0.377 8.558 1.00 0.00 O ATOM 889 CB VAL A 58 -3.609 1.293 10.077 1.00 0.00 C ATOM 890 CG1 VAL A 58 -2.785 0.000 9.855 1.00 0.00 C ATOM 891 CG2 VAL A 58 -2.717 2.303 10.844 1.00 0.00 C ATOM 0 H VAL A 58 -5.697 2.987 9.730 1.00 0.00 H new ATOM 0 HA VAL A 58 -3.316 2.082 8.138 1.00 0.00 H new ATOM 0 HB VAL A 58 -4.490 1.070 10.678 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -2.401 -0.356 10.811 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -3.422 -0.766 9.412 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -1.951 0.210 9.185 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -2.343 1.838 11.756 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -1.876 2.596 10.215 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -3.304 3.185 11.100 1.00 0.00 H new ATOM 901 N ILE A 59 -4.804 0.595 6.718 1.00 0.00 N ATOM 902 CA ILE A 59 -5.629 -0.272 5.825 1.00 0.00 C ATOM 903 C ILE A 59 -4.838 -1.609 5.698 1.00 0.00 C ATOM 904 O ILE A 59 -3.886 -1.703 4.915 1.00 0.00 O ATOM 905 CB ILE A 59 -5.938 0.457 4.464 1.00 0.00 C ATOM 906 CG1 ILE A 59 -6.769 1.767 4.654 1.00 0.00 C ATOM 907 CG2 ILE A 59 -6.665 -0.468 3.451 1.00 0.00 C ATOM 908 CD1 ILE A 59 -6.738 2.742 3.468 1.00 0.00 C ATOM 0 H ILE A 59 -3.963 0.959 6.269 1.00 0.00 H new ATOM 0 HA ILE A 59 -6.621 -0.485 6.224 1.00 0.00 H new ATOM 0 HB ILE A 59 -4.962 0.725 4.059 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -7.806 1.494 4.852 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -6.401 2.286 5.539 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -6.856 0.081 2.529 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -6.039 -1.334 3.235 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -7.611 -0.801 3.877 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -7.345 3.617 3.700 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -5.710 3.053 3.279 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -7.137 2.249 2.581 1.00 0.00 H new ATOM 920 N GLN A 60 -5.247 -2.622 6.489 1.00 0.00 N ATOM 921 CA GLN A 60 -4.540 -3.927 6.572 1.00 0.00 C ATOM 922 C GLN A 60 -5.479 -5.041 6.041 1.00 0.00 C ATOM 923 O GLN A 60 -6.554 -5.292 6.597 1.00 0.00 O ATOM 924 CB GLN A 60 -4.077 -4.185 8.033 1.00 0.00 C ATOM 925 CG GLN A 60 -2.928 -5.205 8.210 1.00 0.00 C ATOM 926 CD GLN A 60 -3.291 -6.692 8.083 1.00 0.00 C ATOM 927 OE1 GLN A 60 -3.162 -7.296 7.018 1.00 0.00 O ATOM 928 NE2 GLN A 60 -3.717 -7.318 9.167 1.00 0.00 N ATOM 0 H GLN A 60 -6.071 -2.564 7.087 1.00 0.00 H new ATOM 0 HA GLN A 60 -3.644 -3.920 5.952 1.00 0.00 H new ATOM 0 HB2 GLN A 60 -3.763 -3.235 8.467 1.00 0.00 H new ATOM 0 HB3 GLN A 60 -4.935 -4.531 8.609 1.00 0.00 H new ATOM 0 HG2 GLN A 60 -2.158 -4.980 7.472 1.00 0.00 H new ATOM 0 HG3 GLN A 60 -2.483 -5.047 9.193 1.00 0.00 H new ATOM 0 HE21 GLN A 60 -3.820 -6.807 10.044 1.00 0.00 H new ATOM 0 HE22 GLN A 60 -3.943 -8.312 9.126 1.00 0.00 H new ATOM 937 N ASN A 61 -5.042 -5.700 4.957 1.00 0.00 N ATOM 938 CA ASN A 61 -5.781 -6.829 4.320 1.00 0.00 C ATOM 939 C ASN A 61 -4.788 -7.984 3.954 1.00 0.00 C ATOM 940 O ASN A 61 -3.564 -7.863 4.087 1.00 0.00 O ATOM 941 CB ASN A 61 -6.602 -6.320 3.095 1.00 0.00 C ATOM 942 CG ASN A 61 -7.770 -5.357 3.383 1.00 0.00 C ATOM 943 OD1 ASN A 61 -8.887 -5.776 3.683 1.00 0.00 O ATOM 944 ND2 ASN A 61 -7.540 -4.056 3.283 1.00 0.00 N ATOM 0 H ASN A 61 -4.165 -5.473 4.488 1.00 0.00 H new ATOM 0 HA ASN A 61 -6.501 -7.242 5.027 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -5.915 -5.823 2.410 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -7.001 -7.188 2.571 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -8.293 -3.390 3.455 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -6.610 -3.720 3.034 1.00 0.00 H new ATOM 951 N GLU A 62 -5.340 -9.139 3.523 1.00 0.00 N ATOM 952 CA GLU A 62 -4.550 -10.373 3.241 1.00 0.00 C ATOM 953 C GLU A 62 -5.026 -11.019 1.908 1.00 0.00 C ATOM 954 O GLU A 62 -6.234 -11.136 1.663 1.00 0.00 O ATOM 955 CB GLU A 62 -4.674 -11.398 4.405 1.00 0.00 C ATOM 956 CG GLU A 62 -4.082 -10.939 5.757 1.00 0.00 C ATOM 957 CD GLU A 62 -3.975 -12.065 6.786 1.00 0.00 C ATOM 958 OE1 GLU A 62 -4.955 -12.305 7.527 1.00 0.00 O ATOM 959 OE2 GLU A 62 -2.908 -12.713 6.861 1.00 0.00 O ATOM 0 H GLU A 62 -6.341 -9.249 3.359 1.00 0.00 H new ATOM 0 HA GLU A 62 -3.501 -10.090 3.149 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -5.729 -11.632 4.550 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -4.180 -12.323 4.107 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -3.092 -10.517 5.587 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -4.703 -10.141 6.165 1.00 0.00 H new ATOM 966 N PHE A 63 -4.066 -11.473 1.071 1.00 0.00 N ATOM 967 CA PHE A 63 -4.368 -12.177 -0.210 1.00 0.00 C ATOM 968 C PHE A 63 -3.512 -13.458 -0.393 1.00 0.00 C ATOM 969 O PHE A 63 -2.287 -13.439 -0.262 1.00 0.00 O ATOM 970 CB PHE A 63 -4.262 -11.270 -1.471 1.00 0.00 C ATOM 971 CG PHE A 63 -2.931 -10.548 -1.768 1.00 0.00 C ATOM 972 CD1 PHE A 63 -1.946 -11.152 -2.558 1.00 0.00 C ATOM 973 CD2 PHE A 63 -2.728 -9.248 -1.300 1.00 0.00 C ATOM 974 CE1 PHE A 63 -0.777 -10.462 -2.868 1.00 0.00 C ATOM 975 CE2 PHE A 63 -1.553 -8.564 -1.602 1.00 0.00 C ATOM 976 CZ PHE A 63 -0.577 -9.173 -2.382 1.00 0.00 C ATOM 0 H PHE A 63 -3.068 -11.367 1.255 1.00 0.00 H new ATOM 0 HA PHE A 63 -5.415 -12.468 -0.121 1.00 0.00 H new ATOM 0 HB2 PHE A 63 -4.503 -11.884 -2.339 1.00 0.00 H new ATOM 0 HB3 PHE A 63 -5.038 -10.509 -1.394 1.00 0.00 H new ATOM 0 HD1 PHE A 63 -2.093 -12.156 -2.928 1.00 0.00 H new ATOM 0 HD2 PHE A 63 -3.488 -8.770 -0.700 1.00 0.00 H new ATOM 0 HE1 PHE A 63 -0.024 -10.928 -3.487 1.00 0.00 H new ATOM 0 HE2 PHE A 63 -1.400 -7.561 -1.231 1.00 0.00 H new ATOM 0 HZ PHE A 63 0.337 -8.646 -2.611 1.00 0.00 H new ATOM 986 N THR A 64 -4.184 -14.541 -0.817 1.00 0.00 N ATOM 987 CA THR A 64 -3.517 -15.743 -1.382 1.00 0.00 C ATOM 988 C THR A 64 -3.449 -15.551 -2.930 1.00 0.00 C ATOM 989 O THR A 64 -4.466 -15.287 -3.582 1.00 0.00 O ATOM 990 CB THR A 64 -4.289 -17.032 -0.971 1.00 0.00 C ATOM 991 OG1 THR A 64 -4.421 -17.094 0.446 1.00 0.00 O ATOM 992 CG2 THR A 64 -3.613 -18.344 -1.409 1.00 0.00 C ATOM 0 H THR A 64 -5.201 -14.616 -0.781 1.00 0.00 H new ATOM 0 HA THR A 64 -2.506 -15.860 -0.992 1.00 0.00 H new ATOM 0 HB THR A 64 -5.250 -16.954 -1.480 1.00 0.00 H new ATOM 0 HG1 THR A 64 -4.909 -17.907 0.694 1.00 0.00 H new ATOM 0 HG21 THR A 64 -4.217 -19.191 -1.083 1.00 0.00 H new ATOM 0 HG22 THR A 64 -3.521 -18.361 -2.495 1.00 0.00 H new ATOM 0 HG23 THR A 64 -2.622 -18.410 -0.960 1.00 0.00 H new ATOM 1000 N VAL A 65 -2.240 -15.705 -3.506 1.00 0.00 N ATOM 1001 CA VAL A 65 -1.996 -15.502 -4.966 1.00 0.00 C ATOM 1002 C VAL A 65 -2.585 -16.711 -5.758 1.00 0.00 C ATOM 1003 O VAL A 65 -2.268 -17.873 -5.481 1.00 0.00 O ATOM 1004 CB VAL A 65 -0.475 -15.241 -5.245 1.00 0.00 C ATOM 1005 CG1 VAL A 65 -0.084 -15.185 -6.742 1.00 0.00 C ATOM 1006 CG2 VAL A 65 0.027 -13.927 -4.599 1.00 0.00 C ATOM 0 H VAL A 65 -1.405 -15.972 -2.985 1.00 0.00 H new ATOM 0 HA VAL A 65 -2.512 -14.608 -5.317 1.00 0.00 H new ATOM 0 HB VAL A 65 0.001 -16.112 -4.795 1.00 0.00 H new ATOM 0 HG11 VAL A 65 0.987 -15.000 -6.832 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -0.330 -16.134 -7.218 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -0.633 -14.381 -7.232 1.00 0.00 H new ATOM 0 HG21 VAL A 65 1.086 -13.793 -4.822 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -0.538 -13.085 -5.000 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -0.113 -13.976 -3.519 1.00 0.00 H new ATOM 1016 N GLY A 66 -3.467 -16.391 -6.719 1.00 0.00 N ATOM 1017 CA GLY A 66 -4.357 -17.391 -7.360 1.00 0.00 C ATOM 1018 C GLY A 66 -5.862 -17.177 -7.069 1.00 0.00 C ATOM 1019 O GLY A 66 -6.665 -17.129 -8.004 1.00 0.00 O ATOM 0 H GLY A 66 -3.588 -15.443 -7.075 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -4.199 -17.364 -8.438 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -4.070 -18.387 -7.021 1.00 0.00 H new ATOM 1023 N GLU A 67 -6.235 -17.087 -5.779 1.00 0.00 N ATOM 1024 CA GLU A 67 -7.650 -16.957 -5.333 1.00 0.00 C ATOM 1025 C GLU A 67 -8.177 -15.491 -5.413 1.00 0.00 C ATOM 1026 O GLU A 67 -7.410 -14.525 -5.324 1.00 0.00 O ATOM 1027 CB GLU A 67 -7.772 -17.485 -3.870 1.00 0.00 C ATOM 1028 CG GLU A 67 -7.438 -18.974 -3.611 1.00 0.00 C ATOM 1029 CD GLU A 67 -8.352 -19.969 -4.337 1.00 0.00 C ATOM 1030 OE1 GLU A 67 -9.449 -20.274 -3.819 1.00 0.00 O ATOM 1031 OE2 GLU A 67 -7.976 -20.445 -5.431 1.00 0.00 O ATOM 0 H GLU A 67 -5.567 -17.102 -5.008 1.00 0.00 H new ATOM 0 HA GLU A 67 -8.266 -17.550 -6.010 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -7.119 -16.881 -3.240 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -8.793 -17.307 -3.534 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -6.408 -19.160 -3.914 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -7.494 -19.164 -2.539 1.00 0.00 H new ATOM 1038 N GLU A 68 -9.515 -15.348 -5.522 1.00 0.00 N ATOM 1039 CA GLU A 68 -10.206 -14.034 -5.391 1.00 0.00 C ATOM 1040 C GLU A 68 -10.294 -13.607 -3.895 1.00 0.00 C ATOM 1041 O GLU A 68 -10.955 -14.261 -3.081 1.00 0.00 O ATOM 1042 CB GLU A 68 -11.549 -13.998 -6.167 1.00 0.00 C ATOM 1043 CG GLU A 68 -12.674 -14.919 -5.662 1.00 0.00 C ATOM 1044 CD GLU A 68 -13.949 -14.834 -6.504 1.00 0.00 C ATOM 1045 OE1 GLU A 68 -13.995 -15.452 -7.591 1.00 0.00 O ATOM 1046 OE2 GLU A 68 -14.912 -14.154 -6.085 1.00 0.00 O ATOM 0 H GLU A 68 -10.147 -16.128 -5.702 1.00 0.00 H new ATOM 0 HA GLU A 68 -9.604 -13.267 -5.879 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -11.920 -12.973 -6.155 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -11.346 -14.251 -7.208 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -12.317 -15.949 -5.659 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -12.910 -14.660 -4.630 1.00 0.00 H new ATOM 1053 N CYS A 69 -9.554 -12.543 -3.546 1.00 0.00 N ATOM 1054 CA CYS A 69 -9.300 -12.145 -2.139 1.00 0.00 C ATOM 1055 C CYS A 69 -10.067 -10.853 -1.770 1.00 0.00 C ATOM 1056 O CYS A 69 -10.182 -9.916 -2.568 1.00 0.00 O ATOM 1057 CB CYS A 69 -7.786 -11.939 -1.960 1.00 0.00 C ATOM 1058 SG CYS A 69 -6.868 -13.446 -2.431 1.00 0.00 S ATOM 0 H CYS A 69 -9.111 -11.928 -4.228 1.00 0.00 H new ATOM 0 HA CYS A 69 -9.656 -12.931 -1.473 1.00 0.00 H new ATOM 0 HB2 CYS A 69 -7.454 -11.099 -2.570 1.00 0.00 H new ATOM 0 HB3 CYS A 69 -7.569 -11.684 -0.923 1.00 0.00 H new ATOM 0 HG CYS A 69 -7.185 -13.785 -3.645 1.00 0.00 H new ATOM 1064 N GLU A 70 -10.555 -10.811 -0.520 1.00 0.00 N ATOM 1065 CA GLU A 70 -11.379 -9.687 0.002 1.00 0.00 C ATOM 1066 C GLU A 70 -10.486 -8.492 0.457 1.00 0.00 C ATOM 1067 O GLU A 70 -9.899 -8.511 1.544 1.00 0.00 O ATOM 1068 CB GLU A 70 -12.426 -10.221 1.017 1.00 0.00 C ATOM 1069 CG GLU A 70 -11.900 -10.810 2.337 1.00 0.00 C ATOM 1070 CD GLU A 70 -13.017 -11.235 3.295 1.00 0.00 C ATOM 1071 OE1 GLU A 70 -13.606 -12.321 3.093 1.00 0.00 O ATOM 1072 OE2 GLU A 70 -13.311 -10.488 4.254 1.00 0.00 O ATOM 0 H GLU A 70 -10.395 -11.550 0.164 1.00 0.00 H new ATOM 0 HA GLU A 70 -11.982 -9.243 -0.791 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -13.105 -9.404 1.260 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -13.017 -10.989 0.518 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -11.271 -11.672 2.117 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -11.268 -10.072 2.831 1.00 0.00 H new ATOM 1079 N LEU A 71 -10.347 -7.481 -0.425 1.00 0.00 N ATOM 1080 CA LEU A 71 -9.328 -6.405 -0.281 1.00 0.00 C ATOM 1081 C LEU A 71 -10.008 -5.014 -0.397 1.00 0.00 C ATOM 1082 O LEU A 71 -10.649 -4.701 -1.408 1.00 0.00 O ATOM 1083 CB LEU A 71 -8.212 -6.530 -1.357 1.00 0.00 C ATOM 1084 CG LEU A 71 -7.352 -7.824 -1.415 1.00 0.00 C ATOM 1085 CD1 LEU A 71 -6.267 -7.691 -2.501 1.00 0.00 C ATOM 1086 CD2 LEU A 71 -6.700 -8.176 -0.069 1.00 0.00 C ATOM 0 H LEU A 71 -10.932 -7.382 -1.255 1.00 0.00 H new ATOM 0 HA LEU A 71 -8.867 -6.511 0.701 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -8.682 -6.405 -2.332 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -7.531 -5.690 -1.222 1.00 0.00 H new ATOM 0 HG LEU A 71 -8.032 -8.639 -1.662 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -5.671 -8.603 -2.533 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -6.740 -7.532 -3.470 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -5.622 -6.843 -2.269 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -6.114 -9.089 -0.176 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -6.048 -7.361 0.244 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -7.475 -8.329 0.682 1.00 0.00 H new ATOM 1098 N GLU A 72 -9.833 -4.178 0.643 1.00 0.00 N ATOM 1099 CA GLU A 72 -10.484 -2.845 0.746 1.00 0.00 C ATOM 1100 C GLU A 72 -9.575 -1.726 0.165 1.00 0.00 C ATOM 1101 O GLU A 72 -8.401 -1.593 0.525 1.00 0.00 O ATOM 1102 CB GLU A 72 -10.867 -2.609 2.233 1.00 0.00 C ATOM 1103 CG GLU A 72 -11.807 -1.407 2.474 1.00 0.00 C ATOM 1104 CD GLU A 72 -12.304 -1.323 3.917 1.00 0.00 C ATOM 1105 OE1 GLU A 72 -13.356 -1.925 4.228 1.00 0.00 O ATOM 1106 OE2 GLU A 72 -11.646 -0.657 4.747 1.00 0.00 O ATOM 0 H GLU A 72 -9.237 -4.402 1.440 1.00 0.00 H new ATOM 0 HA GLU A 72 -11.392 -2.816 0.144 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -11.345 -3.510 2.618 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -9.954 -2.461 2.810 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -11.283 -0.485 2.221 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -12.663 -1.481 1.803 1.00 0.00 H new ATOM 1113 N THR A 73 -10.176 -0.904 -0.715 1.00 0.00 N ATOM 1114 CA THR A 73 -9.523 0.299 -1.310 1.00 0.00 C ATOM 1115 C THR A 73 -9.656 1.520 -0.332 1.00 0.00 C ATOM 1116 O THR A 73 -10.420 1.504 0.641 1.00 0.00 O ATOM 1117 CB THR A 73 -10.146 0.518 -2.731 1.00 0.00 C ATOM 1118 OG1 THR A 73 -10.061 -0.678 -3.505 1.00 0.00 O ATOM 1119 CG2 THR A 73 -9.525 1.622 -3.604 1.00 0.00 C ATOM 0 H THR A 73 -11.132 -1.048 -1.041 1.00 0.00 H new ATOM 0 HA THR A 73 -8.449 0.169 -1.444 1.00 0.00 H new ATOM 0 HB THR A 73 -11.164 0.826 -2.491 1.00 0.00 H new ATOM 0 HG1 THR A 73 -9.229 -0.674 -4.023 1.00 0.00 H new ATOM 0 HG21 THR A 73 -10.048 1.668 -4.559 1.00 0.00 H new ATOM 0 HG22 THR A 73 -9.614 2.582 -3.095 1.00 0.00 H new ATOM 0 HG23 THR A 73 -8.472 1.400 -3.778 1.00 0.00 H new ATOM 1127 N MET A 74 -8.889 2.594 -0.607 1.00 0.00 N ATOM 1128 CA MET A 74 -8.889 3.849 0.209 1.00 0.00 C ATOM 1129 C MET A 74 -10.283 4.539 0.359 1.00 0.00 C ATOM 1130 O MET A 74 -10.701 4.793 1.492 1.00 0.00 O ATOM 1131 CB MET A 74 -7.807 4.846 -0.290 1.00 0.00 C ATOM 1132 CG MET A 74 -6.349 4.363 -0.152 1.00 0.00 C ATOM 1133 SD MET A 74 -5.198 5.655 -0.668 1.00 0.00 S ATOM 1134 CE MET A 74 -5.042 6.640 0.837 1.00 0.00 C ATOM 0 H MET A 74 -8.248 2.627 -1.399 1.00 0.00 H new ATOM 0 HA MET A 74 -8.633 3.528 1.219 1.00 0.00 H new ATOM 0 HB2 MET A 74 -8.000 5.070 -1.339 1.00 0.00 H new ATOM 0 HB3 MET A 74 -7.916 5.780 0.261 1.00 0.00 H new ATOM 0 HG2 MET A 74 -6.150 4.083 0.882 1.00 0.00 H new ATOM 0 HG3 MET A 74 -6.197 3.470 -0.759 1.00 0.00 H new ATOM 0 HE1 MET A 74 -4.360 7.471 0.659 1.00 0.00 H new ATOM 0 HE2 MET A 74 -6.020 7.028 1.121 1.00 0.00 H new ATOM 0 HE3 MET A 74 -4.652 6.016 1.641 1.00 0.00 H new ATOM 1144 N THR A 75 -11.014 4.774 -0.750 1.00 0.00 N ATOM 1145 CA THR A 75 -12.480 5.055 -0.705 1.00 0.00 C ATOM 1146 C THR A 75 -13.339 3.752 -0.563 1.00 0.00 C ATOM 1147 O THR A 75 -14.304 3.767 0.207 1.00 0.00 O ATOM 1148 CB THR A 75 -12.937 5.911 -1.926 1.00 0.00 C ATOM 1149 OG1 THR A 75 -12.118 7.067 -2.062 1.00 0.00 O ATOM 1150 CG2 THR A 75 -14.392 6.411 -1.824 1.00 0.00 C ATOM 0 H THR A 75 -10.621 4.777 -1.691 1.00 0.00 H new ATOM 0 HA THR A 75 -12.655 5.642 0.196 1.00 0.00 H new ATOM 0 HB THR A 75 -12.852 5.243 -2.783 1.00 0.00 H new ATOM 0 HG1 THR A 75 -12.572 7.725 -2.629 1.00 0.00 H new ATOM 0 HG21 THR A 75 -14.638 6.999 -2.709 1.00 0.00 H new ATOM 0 HG22 THR A 75 -15.066 5.557 -1.757 1.00 0.00 H new ATOM 0 HG23 THR A 75 -14.502 7.031 -0.934 1.00 0.00 H new ATOM 1158 N GLY A 76 -13.037 2.673 -1.322 1.00 0.00 N ATOM 1159 CA GLY A 76 -13.936 1.512 -1.476 1.00 0.00 C ATOM 1160 C GLY A 76 -14.207 0.630 -0.237 1.00 0.00 C ATOM 1161 O GLY A 76 -13.842 0.935 0.902 1.00 0.00 O ATOM 0 H GLY A 76 -12.164 2.586 -1.843 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -14.896 1.880 -1.839 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -13.523 0.872 -2.256 1.00 0.00 H new ATOM 1165 N GLU A 77 -14.951 -0.445 -0.519 1.00 0.00 N ATOM 1166 CA GLU A 77 -15.761 -1.180 0.503 1.00 0.00 C ATOM 1167 C GLU A 77 -15.472 -2.709 0.687 1.00 0.00 C ATOM 1168 O GLU A 77 -16.307 -3.416 1.259 1.00 0.00 O ATOM 1169 CB GLU A 77 -17.263 -0.896 0.202 1.00 0.00 C ATOM 1170 CG GLU A 77 -17.815 -1.457 -1.134 1.00 0.00 C ATOM 1171 CD GLU A 77 -19.321 -1.241 -1.295 1.00 0.00 C ATOM 1172 OE1 GLU A 77 -19.728 -0.167 -1.790 1.00 0.00 O ATOM 1173 OE2 GLU A 77 -20.104 -2.144 -0.927 1.00 0.00 O ATOM 0 H GLU A 77 -15.020 -0.843 -1.456 1.00 0.00 H new ATOM 0 HA GLU A 77 -15.455 -0.792 1.475 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -17.859 -1.307 1.017 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -17.415 0.183 0.208 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -17.294 -0.981 -1.965 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -17.598 -2.524 -1.191 1.00 0.00 H new ATOM 1180 N LYS A 78 -14.299 -3.212 0.250 1.00 0.00 N ATOM 1181 CA LYS A 78 -13.869 -4.631 0.386 1.00 0.00 C ATOM 1182 C LYS A 78 -14.483 -5.487 -0.756 1.00 0.00 C ATOM 1183 O LYS A 78 -15.669 -5.831 -0.719 1.00 0.00 O ATOM 1184 CB LYS A 78 -13.983 -5.234 1.817 1.00 0.00 C ATOM 1185 CG LYS A 78 -13.012 -6.406 2.073 1.00 0.00 C ATOM 1186 CD LYS A 78 -13.097 -7.042 3.473 1.00 0.00 C ATOM 1187 CE LYS A 78 -12.569 -6.151 4.614 1.00 0.00 C ATOM 1188 NZ LYS A 78 -12.615 -6.855 5.907 1.00 0.00 N ATOM 0 H LYS A 78 -13.603 -2.633 -0.220 1.00 0.00 H new ATOM 0 HA LYS A 78 -12.787 -4.652 0.254 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -13.793 -4.449 2.549 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -15.005 -5.578 1.977 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -13.200 -7.180 1.329 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -11.993 -6.052 1.915 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -14.136 -7.297 3.680 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -12.535 -7.976 3.469 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -11.544 -5.849 4.398 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -13.164 -5.240 4.672 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -12.253 -6.230 6.656 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -13.597 -7.121 6.123 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -12.027 -7.711 5.857 1.00 0.00 H new ATOM 1202 N VAL A 79 -13.659 -5.769 -1.781 1.00 0.00 N ATOM 1203 CA VAL A 79 -14.103 -6.365 -3.073 1.00 0.00 C ATOM 1204 C VAL A 79 -13.269 -7.648 -3.367 1.00 0.00 C ATOM 1205 O VAL A 79 -12.059 -7.700 -3.116 1.00 0.00 O ATOM 1206 CB VAL A 79 -14.047 -5.337 -4.260 1.00 0.00 C ATOM 1207 CG1 VAL A 79 -15.108 -4.221 -4.130 1.00 0.00 C ATOM 1208 CG2 VAL A 79 -12.660 -4.707 -4.544 1.00 0.00 C ATOM 0 H VAL A 79 -12.655 -5.591 -1.745 1.00 0.00 H new ATOM 0 HA VAL A 79 -15.153 -6.644 -2.980 1.00 0.00 H new ATOM 0 HB VAL A 79 -14.275 -5.962 -5.124 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -15.024 -3.539 -4.976 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -16.103 -4.665 -4.119 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -14.946 -3.671 -3.203 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -12.740 -4.015 -5.382 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -12.317 -4.169 -3.660 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -11.947 -5.494 -4.790 1.00 0.00 H new ATOM 1218 N LYS A 80 -13.932 -8.668 -3.947 1.00 0.00 N ATOM 1219 CA LYS A 80 -13.293 -9.970 -4.282 1.00 0.00 C ATOM 1220 C LYS A 80 -12.513 -9.820 -5.620 1.00 0.00 C ATOM 1221 O LYS A 80 -13.112 -9.657 -6.689 1.00 0.00 O ATOM 1222 CB LYS A 80 -14.350 -11.107 -4.373 1.00 0.00 C ATOM 1223 CG LYS A 80 -14.965 -11.633 -3.052 1.00 0.00 C ATOM 1224 CD LYS A 80 -15.998 -10.718 -2.347 1.00 0.00 C ATOM 1225 CE LYS A 80 -15.456 -10.004 -1.094 1.00 0.00 C ATOM 1226 NZ LYS A 80 -16.436 -9.059 -0.532 1.00 0.00 N ATOM 0 H LYS A 80 -14.920 -8.620 -4.198 1.00 0.00 H new ATOM 0 HA LYS A 80 -12.598 -10.245 -3.489 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -15.166 -10.755 -5.005 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -13.890 -11.951 -4.887 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -15.444 -12.590 -3.258 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -14.152 -11.828 -2.353 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -16.347 -9.968 -3.057 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -16.864 -11.317 -2.065 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -15.193 -10.745 -0.339 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -14.541 -9.469 -1.348 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -16.091 -8.086 -0.657 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -17.346 -9.170 -1.023 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -16.564 -9.253 0.482 1.00 0.00 H new ATOM 1240 N THR A 81 -11.171 -9.830 -5.522 1.00 0.00 N ATOM 1241 CA THR A 81 -10.264 -9.458 -6.642 1.00 0.00 C ATOM 1242 C THR A 81 -9.037 -10.416 -6.662 1.00 0.00 C ATOM 1243 O THR A 81 -8.402 -10.664 -5.630 1.00 0.00 O ATOM 1244 CB THR A 81 -9.886 -7.947 -6.580 1.00 0.00 C ATOM 1245 OG1 THR A 81 -9.140 -7.617 -7.744 1.00 0.00 O ATOM 1246 CG2 THR A 81 -9.088 -7.467 -5.351 1.00 0.00 C ATOM 0 H THR A 81 -10.678 -10.095 -4.669 1.00 0.00 H new ATOM 0 HA THR A 81 -10.779 -9.585 -7.594 1.00 0.00 H new ATOM 0 HB THR A 81 -10.846 -7.436 -6.506 1.00 0.00 H new ATOM 0 HG1 THR A 81 -8.190 -7.542 -7.514 1.00 0.00 H new ATOM 0 HG21 THR A 81 -8.894 -6.398 -5.438 1.00 0.00 H new ATOM 0 HG22 THR A 81 -9.664 -7.659 -4.446 1.00 0.00 H new ATOM 0 HG23 THR A 81 -8.141 -8.005 -5.299 1.00 0.00 H new ATOM 1254 N VAL A 82 -8.696 -10.927 -7.860 1.00 0.00 N ATOM 1255 CA VAL A 82 -7.614 -11.936 -8.039 1.00 0.00 C ATOM 1256 C VAL A 82 -6.267 -11.166 -8.148 1.00 0.00 C ATOM 1257 O VAL A 82 -6.067 -10.371 -9.074 1.00 0.00 O ATOM 1258 CB VAL A 82 -7.866 -12.873 -9.275 1.00 0.00 C ATOM 1259 CG1 VAL A 82 -6.744 -13.923 -9.471 1.00 0.00 C ATOM 1260 CG2 VAL A 82 -9.209 -13.638 -9.222 1.00 0.00 C ATOM 0 H VAL A 82 -9.154 -10.660 -8.731 1.00 0.00 H new ATOM 0 HA VAL A 82 -7.590 -12.607 -7.180 1.00 0.00 H new ATOM 0 HB VAL A 82 -7.886 -12.177 -10.114 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -6.972 -14.541 -10.339 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -5.793 -13.414 -9.628 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -6.676 -14.553 -8.584 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -9.307 -14.262 -10.110 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -9.235 -14.267 -8.332 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -10.033 -12.925 -9.186 1.00 0.00 H new ATOM 1270 N VAL A 83 -5.345 -11.458 -7.213 1.00 0.00 N ATOM 1271 CA VAL A 83 -3.955 -10.930 -7.265 1.00 0.00 C ATOM 1272 C VAL A 83 -3.087 -12.058 -7.888 1.00 0.00 C ATOM 1273 O VAL A 83 -2.897 -13.111 -7.270 1.00 0.00 O ATOM 1274 CB VAL A 83 -3.396 -10.436 -5.887 1.00 0.00 C ATOM 1275 CG1 VAL A 83 -2.117 -9.593 -6.104 1.00 0.00 C ATOM 1276 CG2 VAL A 83 -4.387 -9.628 -5.017 1.00 0.00 C ATOM 0 H VAL A 83 -5.530 -12.057 -6.408 1.00 0.00 H new ATOM 0 HA VAL A 83 -3.933 -10.025 -7.872 1.00 0.00 H new ATOM 0 HB VAL A 83 -3.188 -11.350 -5.331 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -1.736 -9.255 -5.140 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -1.360 -10.201 -6.600 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -2.352 -8.729 -6.725 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -3.900 -9.335 -4.087 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -4.702 -8.736 -5.558 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -5.259 -10.243 -4.792 1.00 0.00 H new ATOM 1286 N GLN A 84 -2.584 -11.819 -9.111 1.00 0.00 N ATOM 1287 CA GLN A 84 -1.743 -12.800 -9.850 1.00 0.00 C ATOM 1288 C GLN A 84 -0.292 -12.285 -9.991 1.00 0.00 C ATOM 1289 O GLN A 84 -0.039 -11.095 -10.198 1.00 0.00 O ATOM 1290 CB GLN A 84 -2.346 -13.142 -11.244 1.00 0.00 C ATOM 1291 CG GLN A 84 -2.884 -14.584 -11.366 1.00 0.00 C ATOM 1292 CD GLN A 84 -1.811 -15.689 -11.267 1.00 0.00 C ATOM 1293 OE1 GLN A 84 -0.886 -15.760 -12.077 1.00 0.00 O ATOM 1294 NE2 GLN A 84 -1.908 -16.565 -10.279 1.00 0.00 N ATOM 0 H GLN A 84 -2.742 -10.949 -9.620 1.00 0.00 H new ATOM 0 HA GLN A 84 -1.727 -13.720 -9.266 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -3.156 -12.445 -11.457 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -1.582 -12.986 -12.006 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -3.626 -14.747 -10.584 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -3.400 -14.684 -12.321 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -2.677 -16.499 -9.613 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -1.213 -17.306 -10.184 1.00 0.00 H new ATOM 1303 N LEU A 85 0.651 -13.238 -9.938 1.00 0.00 N ATOM 1304 CA LEU A 85 2.095 -12.957 -10.077 1.00 0.00 C ATOM 1305 C LEU A 85 2.510 -13.206 -11.552 1.00 0.00 C ATOM 1306 O LEU A 85 2.657 -14.353 -11.989 1.00 0.00 O ATOM 1307 CB LEU A 85 2.862 -13.818 -9.036 1.00 0.00 C ATOM 1308 CG LEU A 85 4.407 -13.693 -9.045 1.00 0.00 C ATOM 1309 CD1 LEU A 85 4.914 -12.250 -8.834 1.00 0.00 C ATOM 1310 CD2 LEU A 85 5.043 -14.637 -8.007 1.00 0.00 C ATOM 0 H LEU A 85 0.438 -14.226 -9.798 1.00 0.00 H new ATOM 0 HA LEU A 85 2.343 -11.917 -9.863 1.00 0.00 H new ATOM 0 HB2 LEU A 85 2.503 -13.552 -8.042 1.00 0.00 H new ATOM 0 HB3 LEU A 85 2.603 -14.864 -9.200 1.00 0.00 H new ATOM 0 HG LEU A 85 4.720 -13.989 -10.046 1.00 0.00 H new ATOM 0 HD11 LEU A 85 6.004 -12.241 -8.852 1.00 0.00 H new ATOM 0 HD12 LEU A 85 4.532 -11.610 -9.630 1.00 0.00 H new ATOM 0 HD13 LEU A 85 4.564 -11.879 -7.871 1.00 0.00 H new ATOM 0 HD21 LEU A 85 6.127 -14.530 -8.034 1.00 0.00 H new ATOM 0 HD22 LEU A 85 4.678 -14.383 -7.012 1.00 0.00 H new ATOM 0 HD23 LEU A 85 4.775 -15.667 -8.240 1.00 0.00 H new ATOM 1322 N GLU A 86 2.724 -12.100 -12.286 1.00 0.00 N ATOM 1323 CA GLU A 86 3.316 -12.126 -13.645 1.00 0.00 C ATOM 1324 C GLU A 86 4.857 -11.983 -13.498 1.00 0.00 C ATOM 1325 O GLU A 86 5.378 -11.013 -12.937 1.00 0.00 O ATOM 1326 CB GLU A 86 2.703 -10.992 -14.497 1.00 0.00 C ATOM 1327 CG GLU A 86 2.987 -11.082 -16.011 1.00 0.00 C ATOM 1328 CD GLU A 86 2.270 -9.982 -16.799 1.00 0.00 C ATOM 1329 OE1 GLU A 86 2.808 -8.857 -16.899 1.00 0.00 O ATOM 1330 OE2 GLU A 86 1.160 -10.236 -17.317 1.00 0.00 O ATOM 0 H GLU A 86 2.494 -11.162 -11.959 1.00 0.00 H new ATOM 0 HA GLU A 86 3.099 -13.064 -14.156 1.00 0.00 H new ATOM 0 HB2 GLU A 86 1.624 -10.988 -14.345 1.00 0.00 H new ATOM 0 HB3 GLU A 86 3.080 -10.038 -14.129 1.00 0.00 H new ATOM 0 HG2 GLU A 86 4.061 -11.009 -16.183 1.00 0.00 H new ATOM 0 HG3 GLU A 86 2.671 -12.057 -16.381 1.00 0.00 H new ATOM 1337 N GLY A 87 5.554 -13.008 -13.993 1.00 0.00 N ATOM 1338 CA GLY A 87 7.022 -13.131 -13.861 1.00 0.00 C ATOM 1339 C GLY A 87 7.477 -13.506 -12.434 1.00 0.00 C ATOM 1340 O GLY A 87 7.038 -14.511 -11.868 1.00 0.00 O ATOM 0 H GLY A 87 5.123 -13.782 -14.499 1.00 0.00 H new ATOM 0 HA2 GLY A 87 7.381 -13.887 -14.560 1.00 0.00 H new ATOM 0 HA3 GLY A 87 7.486 -12.187 -14.147 1.00 0.00 H new ATOM 1344 N ASP A 88 8.354 -12.659 -11.880 1.00 0.00 N ATOM 1345 CA ASP A 88 8.787 -12.723 -10.452 1.00 0.00 C ATOM 1346 C ASP A 88 8.534 -11.408 -9.636 1.00 0.00 C ATOM 1347 O ASP A 88 8.610 -11.460 -8.403 1.00 0.00 O ATOM 1348 CB ASP A 88 10.279 -13.168 -10.431 1.00 0.00 C ATOM 1349 CG ASP A 88 10.837 -13.552 -9.052 1.00 0.00 C ATOM 1350 OD1 ASP A 88 10.567 -14.679 -8.581 1.00 0.00 O ATOM 1351 OD2 ASP A 88 11.540 -12.724 -8.432 1.00 0.00 O ATOM 0 H ASP A 88 8.794 -11.901 -12.401 1.00 0.00 H new ATOM 0 HA ASP A 88 8.165 -13.453 -9.934 1.00 0.00 H new ATOM 0 HB2 ASP A 88 10.395 -14.020 -11.100 1.00 0.00 H new ATOM 0 HB3 ASP A 88 10.887 -12.359 -10.837 1.00 0.00 H new ATOM 1356 N ASN A 89 8.249 -10.257 -10.281 1.00 0.00 N ATOM 1357 CA ASN A 89 8.144 -8.934 -9.602 1.00 0.00 C ATOM 1358 C ASN A 89 6.893 -8.070 -9.970 1.00 0.00 C ATOM 1359 O ASN A 89 6.977 -6.847 -9.840 1.00 0.00 O ATOM 1360 CB ASN A 89 9.492 -8.164 -9.780 1.00 0.00 C ATOM 1361 CG ASN A 89 9.849 -7.657 -11.198 1.00 0.00 C ATOM 1362 OD1 ASN A 89 10.097 -8.440 -12.114 1.00 0.00 O ATOM 1363 ND2 ASN A 89 9.889 -6.350 -11.409 1.00 0.00 N ATOM 0 H ASN A 89 8.084 -10.211 -11.287 1.00 0.00 H new ATOM 0 HA ASN A 89 7.969 -9.141 -8.546 1.00 0.00 H new ATOM 0 HB2 ASN A 89 9.478 -7.304 -9.110 1.00 0.00 H new ATOM 0 HB3 ASN A 89 10.298 -8.817 -9.444 1.00 0.00 H new ATOM 0 HD21 ASN A 89 10.126 -5.990 -12.333 1.00 0.00 H new ATOM 0 HD22 ASN A 89 9.683 -5.704 -10.647 1.00 0.00 H new ATOM 1370 N LYS A 90 5.736 -8.640 -10.369 1.00 0.00 N ATOM 1371 CA LYS A 90 4.529 -7.843 -10.738 1.00 0.00 C ATOM 1372 C LYS A 90 3.281 -8.536 -10.140 1.00 0.00 C ATOM 1373 O LYS A 90 2.800 -9.531 -10.688 1.00 0.00 O ATOM 1374 CB LYS A 90 4.403 -7.654 -12.277 1.00 0.00 C ATOM 1375 CG LYS A 90 5.473 -6.736 -12.915 1.00 0.00 C ATOM 1376 CD LYS A 90 5.375 -6.582 -14.446 1.00 0.00 C ATOM 1377 CE LYS A 90 5.786 -7.844 -15.232 1.00 0.00 C ATOM 1378 NZ LYS A 90 5.830 -7.590 -16.683 1.00 0.00 N ATOM 0 H LYS A 90 5.605 -9.649 -10.446 1.00 0.00 H new ATOM 0 HA LYS A 90 4.621 -6.839 -10.323 1.00 0.00 H new ATOM 0 HB2 LYS A 90 4.456 -8.633 -12.753 1.00 0.00 H new ATOM 0 HB3 LYS A 90 3.417 -7.245 -12.498 1.00 0.00 H new ATOM 0 HG2 LYS A 90 5.399 -5.748 -12.461 1.00 0.00 H new ATOM 0 HG3 LYS A 90 6.460 -7.128 -12.667 1.00 0.00 H new ATOM 0 HD2 LYS A 90 4.350 -6.320 -14.709 1.00 0.00 H new ATOM 0 HD3 LYS A 90 6.007 -5.750 -14.758 1.00 0.00 H new ATOM 0 HE2 LYS A 90 6.765 -8.183 -14.892 1.00 0.00 H new ATOM 0 HE3 LYS A 90 5.080 -8.648 -15.024 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 6.612 -8.129 -17.106 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 4.932 -7.886 -17.115 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 5.978 -6.575 -16.853 1.00 0.00 H new ATOM 1392 N LEU A 91 2.743 -7.986 -9.031 1.00 0.00 N ATOM 1393 CA LEU A 91 1.462 -8.468 -8.434 1.00 0.00 C ATOM 1394 C LEU A 91 0.314 -7.553 -8.948 1.00 0.00 C ATOM 1395 O LEU A 91 0.203 -6.392 -8.545 1.00 0.00 O ATOM 1396 CB LEU A 91 1.528 -8.528 -6.881 1.00 0.00 C ATOM 1397 CG LEU A 91 2.432 -9.637 -6.273 1.00 0.00 C ATOM 1398 CD1 LEU A 91 2.726 -9.352 -4.790 1.00 0.00 C ATOM 1399 CD2 LEU A 91 1.834 -11.051 -6.416 1.00 0.00 C ATOM 0 H LEU A 91 3.169 -7.209 -8.526 1.00 0.00 H new ATOM 0 HA LEU A 91 1.271 -9.494 -8.749 1.00 0.00 H new ATOM 0 HB2 LEU A 91 1.878 -7.563 -6.516 1.00 0.00 H new ATOM 0 HB3 LEU A 91 0.516 -8.665 -6.500 1.00 0.00 H new ATOM 0 HG LEU A 91 3.359 -9.615 -6.845 1.00 0.00 H new ATOM 0 HD11 LEU A 91 3.360 -10.141 -4.387 1.00 0.00 H new ATOM 0 HD12 LEU A 91 3.237 -8.394 -4.698 1.00 0.00 H new ATOM 0 HD13 LEU A 91 1.789 -9.319 -4.233 1.00 0.00 H new ATOM 0 HD21 LEU A 91 2.512 -11.780 -5.972 1.00 0.00 H new ATOM 0 HD22 LEU A 91 0.872 -11.093 -5.905 1.00 0.00 H new ATOM 0 HD23 LEU A 91 1.694 -11.282 -7.472 1.00 0.00 H new ATOM 1411 N VAL A 92 -0.502 -8.090 -9.876 1.00 0.00 N ATOM 1412 CA VAL A 92 -1.453 -7.292 -10.702 1.00 0.00 C ATOM 1413 C VAL A 92 -2.889 -7.573 -10.168 1.00 0.00 C ATOM 1414 O VAL A 92 -3.335 -8.727 -10.152 1.00 0.00 O ATOM 1415 CB VAL A 92 -1.283 -7.638 -12.225 1.00 0.00 C ATOM 1416 CG1 VAL A 92 -2.281 -6.884 -13.136 1.00 0.00 C ATOM 1417 CG2 VAL A 92 0.145 -7.368 -12.765 1.00 0.00 C ATOM 0 H VAL A 92 -0.527 -9.089 -10.080 1.00 0.00 H new ATOM 0 HA VAL A 92 -1.252 -6.224 -10.619 1.00 0.00 H new ATOM 0 HB VAL A 92 -1.487 -8.708 -12.264 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -2.111 -7.167 -14.175 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -3.301 -7.143 -12.851 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -2.135 -5.810 -13.024 1.00 0.00 H new ATOM 0 HG21 VAL A 92 0.190 -7.629 -13.822 1.00 0.00 H new ATOM 0 HG22 VAL A 92 0.387 -6.312 -12.642 1.00 0.00 H new ATOM 0 HG23 VAL A 92 0.864 -7.972 -12.211 1.00 0.00 H new ATOM 1427 N THR A 93 -3.610 -6.507 -9.766 1.00 0.00 N ATOM 1428 CA THR A 93 -5.003 -6.630 -9.238 1.00 0.00 C ATOM 1429 C THR A 93 -5.830 -5.348 -9.540 1.00 0.00 C ATOM 1430 O THR A 93 -5.425 -4.243 -9.172 1.00 0.00 O ATOM 1431 CB THR A 93 -5.023 -7.027 -7.732 1.00 0.00 C ATOM 1432 OG1 THR A 93 -6.350 -7.346 -7.336 1.00 0.00 O ATOM 1433 CG2 THR A 93 -4.455 -6.007 -6.727 1.00 0.00 C ATOM 0 H THR A 93 -3.260 -5.549 -9.793 1.00 0.00 H new ATOM 0 HA THR A 93 -5.490 -7.450 -9.766 1.00 0.00 H new ATOM 0 HB THR A 93 -4.344 -7.879 -7.688 1.00 0.00 H new ATOM 0 HG1 THR A 93 -6.469 -7.131 -6.387 1.00 0.00 H new ATOM 0 HG21 THR A 93 -4.531 -6.410 -5.717 1.00 0.00 H new ATOM 0 HG22 THR A 93 -3.409 -5.809 -6.961 1.00 0.00 H new ATOM 0 HG23 THR A 93 -5.023 -5.079 -6.790 1.00 0.00 H new ATOM 1441 N THR A 94 -7.016 -5.524 -10.154 1.00 0.00 N ATOM 1442 CA THR A 94 -7.972 -4.411 -10.418 1.00 0.00 C ATOM 1443 C THR A 94 -9.155 -4.480 -9.409 1.00 0.00 C ATOM 1444 O THR A 94 -9.861 -5.489 -9.323 1.00 0.00 O ATOM 1445 CB THR A 94 -8.393 -4.328 -11.914 1.00 0.00 C ATOM 1446 OG1 THR A 94 -9.065 -3.093 -12.140 1.00 0.00 O ATOM 1447 CG2 THR A 94 -9.290 -5.460 -12.441 1.00 0.00 C ATOM 0 H THR A 94 -7.344 -6.432 -10.482 1.00 0.00 H new ATOM 0 HA THR A 94 -7.470 -3.460 -10.243 1.00 0.00 H new ATOM 0 HB THR A 94 -7.456 -4.421 -12.463 1.00 0.00 H new ATOM 0 HG1 THR A 94 -9.332 -3.033 -13.081 1.00 0.00 H new ATOM 0 HG21 THR A 94 -9.513 -5.287 -13.494 1.00 0.00 H new ATOM 0 HG22 THR A 94 -8.774 -6.414 -12.331 1.00 0.00 H new ATOM 0 HG23 THR A 94 -10.220 -5.482 -11.872 1.00 0.00 H new ATOM 1455 N PHE A 95 -9.362 -3.386 -8.659 1.00 0.00 N ATOM 1456 CA PHE A 95 -10.357 -3.331 -7.548 1.00 0.00 C ATOM 1457 C PHE A 95 -11.784 -3.090 -8.117 1.00 0.00 C ATOM 1458 O PHE A 95 -12.542 -4.048 -8.296 1.00 0.00 O ATOM 1459 CB PHE A 95 -9.911 -2.344 -6.424 1.00 0.00 C ATOM 1460 CG PHE A 95 -8.593 -2.679 -5.695 1.00 0.00 C ATOM 1461 CD1 PHE A 95 -8.580 -3.579 -4.622 1.00 0.00 C ATOM 1462 CD2 PHE A 95 -7.398 -2.067 -6.088 1.00 0.00 C ATOM 1463 CE1 PHE A 95 -7.385 -3.865 -3.964 1.00 0.00 C ATOM 1464 CE2 PHE A 95 -6.208 -2.355 -5.428 1.00 0.00 C ATOM 1465 CZ PHE A 95 -6.201 -3.254 -4.367 1.00 0.00 C ATOM 0 H PHE A 95 -8.853 -2.513 -8.795 1.00 0.00 H new ATOM 0 HA PHE A 95 -10.402 -4.297 -7.046 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -9.816 -1.350 -6.861 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -10.707 -2.291 -5.682 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -9.497 -4.052 -4.304 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -7.399 -1.366 -6.910 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -7.378 -4.562 -3.139 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -5.289 -1.880 -5.740 1.00 0.00 H new ATOM 0 HZ PHE A 95 -5.277 -3.478 -3.856 1.00 0.00 H new ATOM 1475 N LYS A 96 -12.104 -1.830 -8.452 1.00 0.00 N ATOM 1476 CA LYS A 96 -13.259 -1.470 -9.318 1.00 0.00 C ATOM 1477 C LYS A 96 -12.698 -1.255 -10.757 1.00 0.00 C ATOM 1478 O LYS A 96 -12.769 -2.180 -11.570 1.00 0.00 O ATOM 1479 CB LYS A 96 -14.042 -0.291 -8.666 1.00 0.00 C ATOM 1480 CG LYS A 96 -15.316 0.185 -9.400 1.00 0.00 C ATOM 1481 CD LYS A 96 -16.485 -0.828 -9.399 1.00 0.00 C ATOM 1482 CE LYS A 96 -17.760 -0.346 -10.118 1.00 0.00 C ATOM 1483 NZ LYS A 96 -18.473 0.725 -9.393 1.00 0.00 N ATOM 0 H LYS A 96 -11.571 -1.021 -8.132 1.00 0.00 H new ATOM 0 HA LYS A 96 -14.016 -2.249 -9.411 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -14.322 -0.586 -7.655 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -13.365 0.558 -8.574 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -15.658 1.112 -8.940 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -15.057 0.418 -10.433 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -16.147 -1.751 -9.869 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -16.737 -1.070 -8.366 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -17.494 0.013 -11.112 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -18.433 -1.192 -10.255 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -19.320 1.003 -9.929 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -18.756 0.379 -8.454 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -17.846 1.548 -9.285 1.00 0.00 H new ATOM 1497 N ASN A 97 -12.082 -0.089 -11.040 1.00 0.00 N ATOM 1498 CA ASN A 97 -11.093 0.050 -12.146 1.00 0.00 C ATOM 1499 C ASN A 97 -9.814 0.768 -11.601 1.00 0.00 C ATOM 1500 O ASN A 97 -9.445 1.846 -12.072 1.00 0.00 O ATOM 1501 CB ASN A 97 -11.785 0.748 -13.354 1.00 0.00 C ATOM 1502 CG ASN A 97 -10.956 0.769 -14.656 1.00 0.00 C ATOM 1503 OD1 ASN A 97 -10.642 -0.274 -15.231 1.00 0.00 O ATOM 1504 ND2 ASN A 97 -10.589 1.943 -15.146 1.00 0.00 N ATOM 0 H ASN A 97 -12.247 0.774 -10.522 1.00 0.00 H new ATOM 0 HA ASN A 97 -10.749 -0.914 -12.519 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -12.732 0.245 -13.552 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -12.022 1.775 -13.075 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -10.042 1.988 -16.006 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -10.853 2.802 -14.664 1.00 0.00 H new ATOM 1511 N ILE A 98 -9.132 0.153 -10.612 1.00 0.00 N ATOM 1512 CA ILE A 98 -7.880 0.694 -10.010 1.00 0.00 C ATOM 1513 C ILE A 98 -6.856 -0.459 -10.213 1.00 0.00 C ATOM 1514 O ILE A 98 -6.755 -1.351 -9.366 1.00 0.00 O ATOM 1515 CB ILE A 98 -8.089 1.148 -8.513 1.00 0.00 C ATOM 1516 CG1 ILE A 98 -8.994 2.408 -8.318 1.00 0.00 C ATOM 1517 CG2 ILE A 98 -6.742 1.442 -7.804 1.00 0.00 C ATOM 1518 CD1 ILE A 98 -10.511 2.158 -8.292 1.00 0.00 C ATOM 0 H ILE A 98 -9.428 -0.733 -10.203 1.00 0.00 H new ATOM 0 HA ILE A 98 -7.527 1.614 -10.476 1.00 0.00 H new ATOM 0 HB ILE A 98 -8.599 0.293 -8.070 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -8.711 2.892 -7.383 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -8.777 3.113 -9.120 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -6.932 1.751 -6.776 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -6.127 0.542 -7.805 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -6.219 2.239 -8.332 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -11.033 3.104 -8.152 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -10.822 1.708 -9.235 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -10.755 1.484 -7.471 1.00 0.00 H new ATOM 1530 N LYS A 99 -6.107 -0.438 -11.336 1.00 0.00 N ATOM 1531 CA LYS A 99 -5.219 -1.568 -11.721 1.00 0.00 C ATOM 1532 C LYS A 99 -3.817 -1.399 -11.069 1.00 0.00 C ATOM 1533 O LYS A 99 -2.925 -0.758 -11.631 1.00 0.00 O ATOM 1534 CB LYS A 99 -5.202 -1.688 -13.267 1.00 0.00 C ATOM 1535 CG LYS A 99 -4.531 -2.974 -13.798 1.00 0.00 C ATOM 1536 CD LYS A 99 -4.588 -3.090 -15.336 1.00 0.00 C ATOM 1537 CE LYS A 99 -3.926 -4.359 -15.908 1.00 0.00 C ATOM 1538 NZ LYS A 99 -2.452 -4.326 -15.839 1.00 0.00 N ATOM 0 H LYS A 99 -6.096 0.343 -11.992 1.00 0.00 H new ATOM 0 HA LYS A 99 -5.597 -2.516 -11.339 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -6.228 -1.649 -13.634 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -4.683 -0.824 -13.681 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -3.490 -2.994 -13.475 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -5.019 -3.842 -13.355 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -5.631 -3.067 -15.651 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -4.104 -2.216 -15.772 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -4.290 -5.229 -15.361 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -4.232 -4.484 -16.947 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -2.066 -5.205 -16.238 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -2.097 -3.514 -16.383 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -2.153 -4.235 -14.847 1.00 0.00 H new ATOM 1552 N SER A 100 -3.656 -1.999 -9.874 1.00 0.00 N ATOM 1553 CA SER A 100 -2.432 -1.889 -9.046 1.00 0.00 C ATOM 1554 C SER A 100 -1.373 -2.920 -9.505 1.00 0.00 C ATOM 1555 O SER A 100 -1.478 -4.115 -9.214 1.00 0.00 O ATOM 1556 CB SER A 100 -2.835 -2.091 -7.568 1.00 0.00 C ATOM 1557 OG SER A 100 -1.735 -1.828 -6.703 1.00 0.00 O ATOM 0 H SER A 100 -4.378 -2.581 -9.449 1.00 0.00 H new ATOM 0 HA SER A 100 -1.977 -0.905 -9.160 1.00 0.00 H new ATOM 0 HB2 SER A 100 -3.665 -1.430 -7.319 1.00 0.00 H new ATOM 0 HB3 SER A 100 -3.185 -3.112 -7.418 1.00 0.00 H new ATOM 0 HG SER A 100 -2.012 -1.960 -5.772 1.00 0.00 H new ATOM 1563 N VAL A 101 -0.360 -2.419 -10.228 1.00 0.00 N ATOM 1564 CA VAL A 101 0.733 -3.247 -10.803 1.00 0.00 C ATOM 1565 C VAL A 101 1.954 -3.001 -9.869 1.00 0.00 C ATOM 1566 O VAL A 101 2.588 -1.940 -9.925 1.00 0.00 O ATOM 1567 CB VAL A 101 0.990 -2.845 -12.298 1.00 0.00 C ATOM 1568 CG1 VAL A 101 2.194 -3.583 -12.926 1.00 0.00 C ATOM 1569 CG2 VAL A 101 -0.234 -3.059 -13.221 1.00 0.00 C ATOM 0 H VAL A 101 -0.267 -1.425 -10.436 1.00 0.00 H new ATOM 0 HA VAL A 101 0.500 -4.311 -10.840 1.00 0.00 H new ATOM 0 HB VAL A 101 1.205 -1.778 -12.237 1.00 0.00 H new ATOM 0 HG11 VAL A 101 2.319 -3.261 -13.960 1.00 0.00 H new ATOM 0 HG12 VAL A 101 3.097 -3.351 -12.362 1.00 0.00 H new ATOM 0 HG13 VAL A 101 2.016 -4.658 -12.900 1.00 0.00 H new ATOM 0 HG21 VAL A 101 0.020 -2.759 -14.238 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -0.516 -4.112 -13.213 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -1.069 -2.457 -12.863 1.00 0.00 H new ATOM 1579 N THR A 102 2.258 -3.981 -9.000 1.00 0.00 N ATOM 1580 CA THR A 102 3.194 -3.781 -7.860 1.00 0.00 C ATOM 1581 C THR A 102 4.626 -4.208 -8.309 1.00 0.00 C ATOM 1582 O THR A 102 4.985 -5.388 -8.231 1.00 0.00 O ATOM 1583 CB THR A 102 2.655 -4.557 -6.618 1.00 0.00 C ATOM 1584 OG1 THR A 102 1.275 -4.278 -6.380 1.00 0.00 O ATOM 1585 CG2 THR A 102 3.402 -4.239 -5.317 1.00 0.00 C ATOM 0 H THR A 102 1.873 -4.924 -9.059 1.00 0.00 H new ATOM 0 HA THR A 102 3.259 -2.735 -7.562 1.00 0.00 H new ATOM 0 HB THR A 102 2.811 -5.605 -6.873 1.00 0.00 H new ATOM 0 HG1 THR A 102 1.167 -3.331 -6.152 1.00 0.00 H new ATOM 0 HG21 THR A 102 2.970 -4.816 -4.499 1.00 0.00 H new ATOM 0 HG22 THR A 102 4.455 -4.499 -5.429 1.00 0.00 H new ATOM 0 HG23 THR A 102 3.313 -3.175 -5.097 1.00 0.00 H new ATOM 1593 N GLU A 103 5.419 -3.239 -8.807 1.00 0.00 N ATOM 1594 CA GLU A 103 6.675 -3.518 -9.544 1.00 0.00 C ATOM 1595 C GLU A 103 7.889 -3.474 -8.583 1.00 0.00 C ATOM 1596 O GLU A 103 8.281 -2.389 -8.150 1.00 0.00 O ATOM 1597 CB GLU A 103 6.872 -2.452 -10.655 1.00 0.00 C ATOM 1598 CG GLU A 103 5.887 -2.497 -11.839 1.00 0.00 C ATOM 1599 CD GLU A 103 6.103 -1.357 -12.837 1.00 0.00 C ATOM 1600 OE1 GLU A 103 5.622 -0.231 -12.581 1.00 0.00 O ATOM 1601 OE2 GLU A 103 6.754 -1.582 -13.882 1.00 0.00 O ATOM 0 H GLU A 103 5.212 -2.245 -8.712 1.00 0.00 H new ATOM 0 HA GLU A 103 6.605 -4.512 -9.986 1.00 0.00 H new ATOM 0 HB2 GLU A 103 6.807 -1.466 -10.196 1.00 0.00 H new ATOM 0 HB3 GLU A 103 7.883 -2.554 -11.049 1.00 0.00 H new ATOM 0 HG2 GLU A 103 5.992 -3.451 -12.356 1.00 0.00 H new ATOM 0 HG3 GLU A 103 4.867 -2.451 -11.458 1.00 0.00 H new ATOM 1608 N LEU A 104 8.513 -4.625 -8.277 1.00 0.00 N ATOM 1609 CA LEU A 104 9.696 -4.663 -7.374 1.00 0.00 C ATOM 1610 C LEU A 104 10.999 -4.648 -8.224 1.00 0.00 C ATOM 1611 O LEU A 104 11.444 -5.683 -8.731 1.00 0.00 O ATOM 1612 CB LEU A 104 9.603 -5.866 -6.392 1.00 0.00 C ATOM 1613 CG LEU A 104 10.206 -5.644 -4.977 1.00 0.00 C ATOM 1614 CD1 LEU A 104 10.183 -6.963 -4.188 1.00 0.00 C ATOM 1615 CD2 LEU A 104 11.624 -5.040 -4.952 1.00 0.00 C ATOM 0 H LEU A 104 8.228 -5.537 -8.633 1.00 0.00 H new ATOM 0 HA LEU A 104 9.716 -3.773 -6.745 1.00 0.00 H new ATOM 0 HB2 LEU A 104 8.553 -6.135 -6.279 1.00 0.00 H new ATOM 0 HB3 LEU A 104 10.104 -6.720 -6.848 1.00 0.00 H new ATOM 0 HG LEU A 104 9.569 -4.894 -4.508 1.00 0.00 H new ATOM 0 HD11 LEU A 104 10.607 -6.802 -3.197 1.00 0.00 H new ATOM 0 HD12 LEU A 104 9.155 -7.311 -4.091 1.00 0.00 H new ATOM 0 HD13 LEU A 104 10.771 -7.713 -4.716 1.00 0.00 H new ATOM 0 HD21 LEU A 104 11.953 -4.926 -3.919 1.00 0.00 H new ATOM 0 HD22 LEU A 104 12.311 -5.702 -5.480 1.00 0.00 H new ATOM 0 HD23 LEU A 104 11.613 -4.065 -5.439 1.00 0.00 H new ATOM 1627 N ASN A 105 11.604 -3.456 -8.372 1.00 0.00 N ATOM 1628 CA ASN A 105 12.760 -3.241 -9.288 1.00 0.00 C ATOM 1629 C ASN A 105 14.104 -3.647 -8.619 1.00 0.00 C ATOM 1630 O ASN A 105 14.646 -4.706 -8.952 1.00 0.00 O ATOM 1631 CB ASN A 105 12.733 -1.806 -9.893 1.00 0.00 C ATOM 1632 CG ASN A 105 11.590 -1.509 -10.889 1.00 0.00 C ATOM 1633 OD1 ASN A 105 11.737 -1.684 -12.098 1.00 0.00 O ATOM 1634 ND2 ASN A 105 10.440 -1.058 -10.411 1.00 0.00 N ATOM 0 H ASN A 105 11.316 -2.616 -7.870 1.00 0.00 H new ATOM 0 HA ASN A 105 12.667 -3.912 -10.142 1.00 0.00 H new ATOM 0 HB2 ASN A 105 12.669 -1.090 -9.074 1.00 0.00 H new ATOM 0 HB3 ASN A 105 13.683 -1.629 -10.398 1.00 0.00 H new ATOM 0 HD21 ASN A 105 9.669 -0.853 -11.046 1.00 0.00 H new ATOM 0 HD22 ASN A 105 10.326 -0.915 -9.408 1.00 0.00 H new ATOM 1641 N GLY A 106 14.616 -2.832 -7.684 1.00 0.00 N ATOM 1642 CA GLY A 106 15.870 -3.141 -6.963 1.00 0.00 C ATOM 1643 C GLY A 106 16.095 -2.211 -5.772 1.00 0.00 C ATOM 1644 O GLY A 106 16.395 -1.023 -5.922 1.00 0.00 O ATOM 0 H GLY A 106 14.183 -1.951 -7.406 1.00 0.00 H new ATOM 0 HA2 GLY A 106 15.842 -4.174 -6.615 1.00 0.00 H new ATOM 0 HA3 GLY A 106 16.712 -3.059 -7.650 1.00 0.00 H new ATOM 1648 N ASP A 107 15.900 -2.797 -4.586 1.00 0.00 N ATOM 1649 CA ASP A 107 15.751 -2.076 -3.288 1.00 0.00 C ATOM 1650 C ASP A 107 14.740 -0.876 -3.253 1.00 0.00 C ATOM 1651 O ASP A 107 14.920 0.089 -2.502 1.00 0.00 O ATOM 1652 CB ASP A 107 17.125 -1.759 -2.644 1.00 0.00 C ATOM 1653 CG ASP A 107 18.042 -2.959 -2.352 1.00 0.00 C ATOM 1654 OD1 ASP A 107 17.798 -3.678 -1.358 1.00 0.00 O ATOM 1655 OD2 ASP A 107 19.003 -3.188 -3.120 1.00 0.00 O ATOM 0 H ASP A 107 15.838 -3.810 -4.484 1.00 0.00 H new ATOM 0 HA ASP A 107 15.244 -2.797 -2.647 1.00 0.00 H new ATOM 0 HB2 ASP A 107 17.660 -1.074 -3.302 1.00 0.00 H new ATOM 0 HB3 ASP A 107 16.948 -1.229 -1.708 1.00 0.00 H new ATOM 1660 N ILE A 108 13.661 -0.978 -4.047 1.00 0.00 N ATOM 1661 CA ILE A 108 12.544 0.001 -4.090 1.00 0.00 C ATOM 1662 C ILE A 108 11.195 -0.785 -4.275 1.00 0.00 C ATOM 1663 O ILE A 108 11.152 -2.019 -4.228 1.00 0.00 O ATOM 1664 CB ILE A 108 12.798 1.120 -5.165 1.00 0.00 C ATOM 1665 CG1 ILE A 108 12.892 0.594 -6.625 1.00 0.00 C ATOM 1666 CG2 ILE A 108 13.996 2.049 -4.857 1.00 0.00 C ATOM 1667 CD1 ILE A 108 12.312 1.587 -7.641 1.00 0.00 C ATOM 0 H ILE A 108 13.531 -1.757 -4.693 1.00 0.00 H new ATOM 0 HA ILE A 108 12.477 0.546 -3.148 1.00 0.00 H new ATOM 0 HB ILE A 108 11.894 1.724 -5.089 1.00 0.00 H new ATOM 0 HG12 ILE A 108 13.935 0.394 -6.870 1.00 0.00 H new ATOM 0 HG13 ILE A 108 12.359 -0.354 -6.702 1.00 0.00 H new ATOM 0 HG21 ILE A 108 14.096 2.789 -5.651 1.00 0.00 H new ATOM 0 HG22 ILE A 108 13.828 2.556 -3.907 1.00 0.00 H new ATOM 0 HG23 ILE A 108 14.909 1.457 -4.796 1.00 0.00 H new ATOM 0 HD11 ILE A 108 12.401 1.174 -8.646 1.00 0.00 H new ATOM 0 HD12 ILE A 108 11.261 1.767 -7.415 1.00 0.00 H new ATOM 0 HD13 ILE A 108 12.861 2.527 -7.585 1.00 0.00 H new ATOM 1679 N ILE A 109 10.077 -0.072 -4.522 1.00 0.00 N ATOM 1680 CA ILE A 109 8.862 -0.678 -5.131 1.00 0.00 C ATOM 1681 C ILE A 109 8.073 0.454 -5.853 1.00 0.00 C ATOM 1682 O ILE A 109 7.703 1.459 -5.235 1.00 0.00 O ATOM 1683 CB ILE A 109 8.027 -1.557 -4.129 1.00 0.00 C ATOM 1684 CG1 ILE A 109 7.217 -2.659 -4.863 1.00 0.00 C ATOM 1685 CG2 ILE A 109 7.150 -0.762 -3.129 1.00 0.00 C ATOM 1686 CD1 ILE A 109 6.741 -3.802 -3.958 1.00 0.00 C ATOM 0 H ILE A 109 9.985 0.922 -4.312 1.00 0.00 H new ATOM 0 HA ILE A 109 9.146 -1.417 -5.880 1.00 0.00 H new ATOM 0 HB ILE A 109 8.776 -2.044 -3.504 1.00 0.00 H new ATOM 0 HG12 ILE A 109 6.349 -2.201 -5.336 1.00 0.00 H new ATOM 0 HG13 ILE A 109 7.832 -3.075 -5.661 1.00 0.00 H new ATOM 0 HG21 ILE A 109 6.614 -1.457 -2.482 1.00 0.00 H new ATOM 0 HG22 ILE A 109 7.785 -0.117 -2.522 1.00 0.00 H new ATOM 0 HG23 ILE A 109 6.433 -0.152 -3.679 1.00 0.00 H new ATOM 0 HD11 ILE A 109 6.184 -4.527 -4.551 1.00 0.00 H new ATOM 0 HD12 ILE A 109 7.604 -4.290 -3.504 1.00 0.00 H new ATOM 0 HD13 ILE A 109 6.097 -3.402 -3.175 1.00 0.00 H new ATOM 1698 N THR A 110 7.809 0.263 -7.157 1.00 0.00 N ATOM 1699 CA THR A 110 7.044 1.239 -7.986 1.00 0.00 C ATOM 1700 C THR A 110 5.590 0.697 -8.151 1.00 0.00 C ATOM 1701 O THR A 110 5.272 -0.018 -9.105 1.00 0.00 O ATOM 1702 CB THR A 110 7.809 1.468 -9.322 1.00 0.00 C ATOM 1703 OG1 THR A 110 9.134 1.928 -9.068 1.00 0.00 O ATOM 1704 CG2 THR A 110 7.163 2.490 -10.268 1.00 0.00 C ATOM 0 H THR A 110 8.113 -0.563 -7.673 1.00 0.00 H new ATOM 0 HA THR A 110 6.961 2.220 -7.517 1.00 0.00 H new ATOM 0 HB THR A 110 7.789 0.493 -9.809 1.00 0.00 H new ATOM 0 HG1 THR A 110 9.601 2.065 -9.918 1.00 0.00 H new ATOM 0 HG21 THR A 110 7.767 2.582 -11.171 1.00 0.00 H new ATOM 0 HG22 THR A 110 6.160 2.156 -10.534 1.00 0.00 H new ATOM 0 HG23 THR A 110 7.103 3.458 -9.771 1.00 0.00 H new ATOM 1712 N ASN A 111 4.708 1.055 -7.203 1.00 0.00 N ATOM 1713 CA ASN A 111 3.305 0.559 -7.169 1.00 0.00 C ATOM 1714 C ASN A 111 2.413 1.494 -8.029 1.00 0.00 C ATOM 1715 O ASN A 111 2.111 2.623 -7.630 1.00 0.00 O ATOM 1716 CB ASN A 111 2.836 0.441 -5.695 1.00 0.00 C ATOM 1717 CG ASN A 111 1.463 -0.237 -5.515 1.00 0.00 C ATOM 1718 OD1 ASN A 111 1.303 -1.434 -5.746 1.00 0.00 O ATOM 1719 ND2 ASN A 111 0.447 0.509 -5.112 1.00 0.00 N ATOM 0 H ASN A 111 4.937 1.692 -6.440 1.00 0.00 H new ATOM 0 HA ASN A 111 3.229 -0.438 -7.602 1.00 0.00 H new ATOM 0 HB2 ASN A 111 3.582 -0.122 -5.133 1.00 0.00 H new ATOM 0 HB3 ASN A 111 2.795 1.439 -5.259 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -0.476 0.092 -4.991 1.00 0.00 H new ATOM 0 HD22 ASN A 111 0.587 1.501 -4.922 1.00 0.00 H new ATOM 1726 N THR A 112 2.029 1.007 -9.221 1.00 0.00 N ATOM 1727 CA THR A 112 1.450 1.864 -10.289 1.00 0.00 C ATOM 1728 C THR A 112 -0.063 1.529 -10.421 1.00 0.00 C ATOM 1729 O THR A 112 -0.441 0.554 -11.076 1.00 0.00 O ATOM 1730 CB THR A 112 2.260 1.672 -11.606 1.00 0.00 C ATOM 1731 OG1 THR A 112 3.657 1.841 -11.374 1.00 0.00 O ATOM 1732 CG2 THR A 112 1.878 2.669 -12.710 1.00 0.00 C ATOM 0 H THR A 112 2.106 0.023 -9.477 1.00 0.00 H new ATOM 0 HA THR A 112 1.524 2.924 -10.044 1.00 0.00 H new ATOM 0 HB THR A 112 2.021 0.661 -11.934 1.00 0.00 H new ATOM 0 HG1 THR A 112 4.150 1.107 -11.797 1.00 0.00 H new ATOM 0 HG21 THR A 112 2.481 2.478 -13.598 1.00 0.00 H new ATOM 0 HG22 THR A 112 0.823 2.553 -12.956 1.00 0.00 H new ATOM 0 HG23 THR A 112 2.059 3.686 -12.361 1.00 0.00 H new ATOM 1740 N MET A 113 -0.905 2.370 -9.798 1.00 0.00 N ATOM 1741 CA MET A 113 -2.385 2.222 -9.818 1.00 0.00 C ATOM 1742 C MET A 113 -2.967 3.051 -10.995 1.00 0.00 C ATOM 1743 O MET A 113 -3.088 4.278 -10.905 1.00 0.00 O ATOM 1744 CB MET A 113 -2.999 2.691 -8.474 1.00 0.00 C ATOM 1745 CG MET A 113 -2.692 1.848 -7.229 1.00 0.00 C ATOM 1746 SD MET A 113 -3.682 2.484 -5.857 1.00 0.00 S ATOM 1747 CE MET A 113 -2.923 1.653 -4.451 1.00 0.00 C ATOM 0 H MET A 113 -0.586 3.177 -9.262 1.00 0.00 H new ATOM 0 HA MET A 113 -2.637 1.170 -9.956 1.00 0.00 H new ATOM 0 HB2 MET A 113 -2.659 3.709 -8.285 1.00 0.00 H new ATOM 0 HB3 MET A 113 -4.082 2.734 -8.594 1.00 0.00 H new ATOM 0 HG2 MET A 113 -2.927 0.800 -7.413 1.00 0.00 H new ATOM 0 HG3 MET A 113 -1.630 1.900 -6.987 1.00 0.00 H new ATOM 0 HE1 MET A 113 -3.432 1.951 -3.534 1.00 0.00 H new ATOM 0 HE2 MET A 113 -3.006 0.574 -4.578 1.00 0.00 H new ATOM 0 HE3 MET A 113 -1.871 1.931 -4.388 1.00 0.00 H new ATOM 1757 N THR A 114 -3.329 2.371 -12.097 1.00 0.00 N ATOM 1758 CA THR A 114 -3.822 3.043 -13.330 1.00 0.00 C ATOM 1759 C THR A 114 -5.378 3.099 -13.302 1.00 0.00 C ATOM 1760 O THR A 114 -6.059 2.101 -13.562 1.00 0.00 O ATOM 1761 CB THR A 114 -3.246 2.405 -14.630 1.00 0.00 C ATOM 1762 OG1 THR A 114 -3.567 1.024 -14.732 1.00 0.00 O ATOM 1763 CG2 THR A 114 -1.725 2.555 -14.793 1.00 0.00 C ATOM 0 H THR A 114 -3.292 1.354 -12.167 1.00 0.00 H new ATOM 0 HA THR A 114 -3.451 4.068 -13.345 1.00 0.00 H new ATOM 0 HB THR A 114 -3.726 2.970 -15.429 1.00 0.00 H new ATOM 0 HG1 THR A 114 -3.190 0.661 -15.561 1.00 0.00 H new ATOM 0 HG21 THR A 114 -1.410 2.083 -15.724 1.00 0.00 H new ATOM 0 HG22 THR A 114 -1.464 3.613 -14.817 1.00 0.00 H new ATOM 0 HG23 THR A 114 -1.220 2.076 -13.954 1.00 0.00 H new ATOM 1771 N LEU A 115 -5.913 4.294 -12.985 1.00 0.00 N ATOM 1772 CA LEU A 115 -7.370 4.587 -13.015 1.00 0.00 C ATOM 1773 C LEU A 115 -7.677 5.370 -14.323 1.00 0.00 C ATOM 1774 O LEU A 115 -7.717 6.606 -14.330 1.00 0.00 O ATOM 1775 CB LEU A 115 -7.718 5.338 -11.693 1.00 0.00 C ATOM 1776 CG LEU A 115 -9.150 5.919 -11.507 1.00 0.00 C ATOM 1777 CD1 LEU A 115 -10.274 4.869 -11.595 1.00 0.00 C ATOM 1778 CD2 LEU A 115 -9.240 6.671 -10.165 1.00 0.00 C ATOM 0 H LEU A 115 -5.347 5.093 -12.698 1.00 0.00 H new ATOM 0 HA LEU A 115 -8.001 3.699 -13.045 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -7.532 4.652 -10.867 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -7.013 6.162 -11.588 1.00 0.00 H new ATOM 0 HG LEU A 115 -9.309 6.601 -12.342 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -11.239 5.356 -11.455 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -10.248 4.390 -12.574 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -10.131 4.117 -10.819 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -10.245 7.075 -10.041 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -9.022 5.984 -9.348 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -8.517 7.487 -10.156 1.00 0.00 H new ATOM 1790 N GLY A 116 -7.866 4.629 -15.435 1.00 0.00 N ATOM 1791 CA GLY A 116 -8.098 5.224 -16.772 1.00 0.00 C ATOM 1792 C GLY A 116 -6.829 5.855 -17.385 1.00 0.00 C ATOM 1793 O GLY A 116 -5.926 5.141 -17.829 1.00 0.00 O ATOM 0 H GLY A 116 -7.863 3.609 -15.434 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -8.474 4.454 -17.445 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -8.874 5.986 -16.694 1.00 0.00 H new ATOM 1797 N ASP A 117 -6.782 7.196 -17.363 1.00 0.00 N ATOM 1798 CA ASP A 117 -5.556 7.985 -17.700 1.00 0.00 C ATOM 1799 C ASP A 117 -4.701 8.452 -16.469 1.00 0.00 C ATOM 1800 O ASP A 117 -3.571 8.904 -16.675 1.00 0.00 O ATOM 1801 CB ASP A 117 -5.951 9.217 -18.565 1.00 0.00 C ATOM 1802 CG ASP A 117 -6.480 8.890 -19.972 1.00 0.00 C ATOM 1803 OD1 ASP A 117 -5.661 8.619 -20.877 1.00 0.00 O ATOM 1804 OD2 ASP A 117 -7.714 8.900 -20.170 1.00 0.00 O ATOM 0 H ASP A 117 -7.583 7.776 -17.114 1.00 0.00 H new ATOM 0 HA ASP A 117 -4.912 7.301 -18.252 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -6.713 9.786 -18.031 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -5.080 9.865 -18.664 1.00 0.00 H new ATOM 1809 N ILE A 118 -5.207 8.359 -15.220 1.00 0.00 N ATOM 1810 CA ILE A 118 -4.519 8.850 -13.993 1.00 0.00 C ATOM 1811 C ILE A 118 -3.548 7.722 -13.529 1.00 0.00 C ATOM 1812 O ILE A 118 -3.994 6.658 -13.089 1.00 0.00 O ATOM 1813 CB ILE A 118 -5.581 9.227 -12.896 1.00 0.00 C ATOM 1814 CG1 ILE A 118 -6.600 10.326 -13.336 1.00 0.00 C ATOM 1815 CG2 ILE A 118 -4.905 9.673 -11.573 1.00 0.00 C ATOM 1816 CD1 ILE A 118 -7.894 10.376 -12.505 1.00 0.00 C ATOM 0 H ILE A 118 -6.115 7.937 -15.027 1.00 0.00 H new ATOM 0 HA ILE A 118 -3.946 9.757 -14.184 1.00 0.00 H new ATOM 0 HB ILE A 118 -6.143 8.306 -12.741 1.00 0.00 H new ATOM 0 HG12 ILE A 118 -6.111 11.298 -13.280 1.00 0.00 H new ATOM 0 HG13 ILE A 118 -6.862 10.161 -14.381 1.00 0.00 H new ATOM 0 HG21 ILE A 118 -5.671 9.925 -10.840 1.00 0.00 H new ATOM 0 HG22 ILE A 118 -4.288 8.861 -11.188 1.00 0.00 H new ATOM 0 HG23 ILE A 118 -4.280 10.546 -11.760 1.00 0.00 H new ATOM 0 HD11 ILE A 118 -8.539 11.169 -12.884 1.00 0.00 H new ATOM 0 HD12 ILE A 118 -8.412 9.420 -12.580 1.00 0.00 H new ATOM 0 HD13 ILE A 118 -7.649 10.575 -11.462 1.00 0.00 H new ATOM 1828 N VAL A 119 -2.231 7.977 -13.622 1.00 0.00 N ATOM 1829 CA VAL A 119 -1.191 6.947 -13.331 1.00 0.00 C ATOM 1830 C VAL A 119 -0.614 7.278 -11.922 1.00 0.00 C ATOM 1831 O VAL A 119 0.350 8.041 -11.800 1.00 0.00 O ATOM 1832 CB VAL A 119 -0.126 6.874 -14.484 1.00 0.00 C ATOM 1833 CG1 VAL A 119 0.935 5.781 -14.231 1.00 0.00 C ATOM 1834 CG2 VAL A 119 -0.727 6.609 -15.888 1.00 0.00 C ATOM 0 H VAL A 119 -1.851 8.883 -13.895 1.00 0.00 H new ATOM 0 HA VAL A 119 -1.605 5.939 -13.302 1.00 0.00 H new ATOM 0 HB VAL A 119 0.325 7.866 -14.474 1.00 0.00 H new ATOM 0 HG11 VAL A 119 1.649 5.769 -15.055 1.00 0.00 H new ATOM 0 HG12 VAL A 119 1.460 5.992 -13.299 1.00 0.00 H new ATOM 0 HG13 VAL A 119 0.447 4.809 -14.160 1.00 0.00 H new ATOM 0 HG21 VAL A 119 0.074 6.573 -16.626 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -1.258 5.657 -15.883 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -1.421 7.410 -16.144 1.00 0.00 H new ATOM 1844 N PHE A 120 -1.220 6.691 -10.866 1.00 0.00 N ATOM 1845 CA PHE A 120 -0.834 6.948 -9.453 1.00 0.00 C ATOM 1846 C PHE A 120 0.370 6.056 -9.048 1.00 0.00 C ATOM 1847 O PHE A 120 0.207 4.906 -8.634 1.00 0.00 O ATOM 1848 CB PHE A 120 -2.088 6.808 -8.545 1.00 0.00 C ATOM 1849 CG PHE A 120 -1.887 6.970 -7.022 1.00 0.00 C ATOM 1850 CD1 PHE A 120 -1.319 8.137 -6.497 1.00 0.00 C ATOM 1851 CD2 PHE A 120 -2.287 5.955 -6.144 1.00 0.00 C ATOM 1852 CE1 PHE A 120 -1.151 8.283 -5.125 1.00 0.00 C ATOM 1853 CE2 PHE A 120 -2.119 6.103 -4.769 1.00 0.00 C ATOM 1854 CZ PHE A 120 -1.552 7.268 -4.262 1.00 0.00 C ATOM 0 H PHE A 120 -1.988 6.027 -10.964 1.00 0.00 H new ATOM 0 HA PHE A 120 -0.479 7.971 -9.325 1.00 0.00 H new ATOM 0 HB2 PHE A 120 -2.821 7.547 -8.868 1.00 0.00 H new ATOM 0 HB3 PHE A 120 -2.525 5.826 -8.724 1.00 0.00 H new ATOM 0 HD1 PHE A 120 -1.009 8.929 -7.163 1.00 0.00 H new ATOM 0 HD2 PHE A 120 -2.729 5.051 -6.536 1.00 0.00 H new ATOM 0 HE1 PHE A 120 -0.709 9.185 -4.729 1.00 0.00 H new ATOM 0 HE2 PHE A 120 -2.428 5.315 -4.098 1.00 0.00 H new ATOM 0 HZ PHE A 120 -1.423 7.385 -3.196 1.00 0.00 H new ATOM 1864 N LYS A 121 1.576 6.630 -9.186 1.00 0.00 N ATOM 1865 CA LYS A 121 2.849 5.884 -9.065 1.00 0.00 C ATOM 1866 C LYS A 121 3.527 6.253 -7.719 1.00 0.00 C ATOM 1867 O LYS A 121 4.048 7.360 -7.546 1.00 0.00 O ATOM 1868 CB LYS A 121 3.697 6.198 -10.325 1.00 0.00 C ATOM 1869 CG LYS A 121 4.962 5.330 -10.466 1.00 0.00 C ATOM 1870 CD LYS A 121 5.750 5.561 -11.771 1.00 0.00 C ATOM 1871 CE LYS A 121 5.090 4.943 -13.020 1.00 0.00 C ATOM 1872 NZ LYS A 121 5.900 5.165 -14.230 1.00 0.00 N ATOM 0 H LYS A 121 1.701 7.623 -9.384 1.00 0.00 H new ATOM 0 HA LYS A 121 2.707 4.804 -9.034 1.00 0.00 H new ATOM 0 HB2 LYS A 121 3.076 6.062 -11.210 1.00 0.00 H new ATOM 0 HB3 LYS A 121 3.991 7.247 -10.300 1.00 0.00 H new ATOM 0 HG2 LYS A 121 5.619 5.527 -9.619 1.00 0.00 H new ATOM 0 HG3 LYS A 121 4.676 4.280 -10.410 1.00 0.00 H new ATOM 0 HD2 LYS A 121 5.867 6.633 -11.928 1.00 0.00 H new ATOM 0 HD3 LYS A 121 6.751 5.144 -11.658 1.00 0.00 H new ATOM 0 HE2 LYS A 121 4.951 3.873 -12.866 1.00 0.00 H new ATOM 0 HE3 LYS A 121 4.100 5.376 -13.160 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 5.425 4.736 -15.049 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 6.012 6.186 -14.390 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 6.836 4.730 -14.106 1.00 0.00 H new ATOM 1886 N ARG A 122 3.509 5.291 -6.780 1.00 0.00 N ATOM 1887 CA ARG A 122 4.121 5.446 -5.435 1.00 0.00 C ATOM 1888 C ARG A 122 5.536 4.814 -5.476 1.00 0.00 C ATOM 1889 O ARG A 122 5.682 3.594 -5.599 1.00 0.00 O ATOM 1890 CB ARG A 122 3.248 4.780 -4.336 1.00 0.00 C ATOM 1891 CG ARG A 122 1.869 5.442 -4.099 1.00 0.00 C ATOM 1892 CD ARG A 122 1.164 5.037 -2.790 1.00 0.00 C ATOM 1893 NE ARG A 122 0.761 3.609 -2.742 1.00 0.00 N ATOM 1894 CZ ARG A 122 0.173 3.025 -1.677 1.00 0.00 C ATOM 1895 NH1 ARG A 122 -0.144 3.673 -0.557 1.00 0.00 N ATOM 1896 NH2 ARG A 122 -0.105 1.737 -1.746 1.00 0.00 N ATOM 0 H ARG A 122 3.071 4.381 -6.926 1.00 0.00 H new ATOM 0 HA ARG A 122 4.190 6.504 -5.183 1.00 0.00 H new ATOM 0 HB2 ARG A 122 3.090 3.735 -4.603 1.00 0.00 H new ATOM 0 HB3 ARG A 122 3.803 4.789 -3.398 1.00 0.00 H new ATOM 0 HG2 ARG A 122 1.998 6.524 -4.104 1.00 0.00 H new ATOM 0 HG3 ARG A 122 1.216 5.195 -4.936 1.00 0.00 H new ATOM 0 HD2 ARG A 122 1.828 5.246 -1.951 1.00 0.00 H new ATOM 0 HD3 ARG A 122 0.279 5.659 -2.658 1.00 0.00 H new ATOM 0 HE ARG A 122 0.940 3.034 -3.565 1.00 0.00 H new ATOM 0 HH11 ARG A 122 0.057 4.669 -0.470 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -0.588 3.173 0.213 1.00 0.00 H new ATOM 0 HH21 ARG A 122 0.125 1.210 -2.589 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -0.549 1.268 -0.957 1.00 0.00 H new ATOM 1910 N ILE A 123 6.570 5.669 -5.394 1.00 0.00 N ATOM 1911 CA ILE A 123 7.992 5.251 -5.560 1.00 0.00 C ATOM 1912 C ILE A 123 8.556 5.222 -4.113 1.00 0.00 C ATOM 1913 O ILE A 123 8.812 6.276 -3.525 1.00 0.00 O ATOM 1914 CB ILE A 123 8.765 6.208 -6.540 1.00 0.00 C ATOM 1915 CG1 ILE A 123 8.125 6.273 -7.965 1.00 0.00 C ATOM 1916 CG2 ILE A 123 10.263 5.819 -6.659 1.00 0.00 C ATOM 1917 CD1 ILE A 123 8.567 7.453 -8.845 1.00 0.00 C ATOM 0 H ILE A 123 6.455 6.666 -5.212 1.00 0.00 H new ATOM 0 HA ILE A 123 8.103 4.274 -6.031 1.00 0.00 H new ATOM 0 HB ILE A 123 8.687 7.201 -6.097 1.00 0.00 H new ATOM 0 HG12 ILE A 123 8.358 5.346 -8.490 1.00 0.00 H new ATOM 0 HG13 ILE A 123 7.041 6.313 -7.854 1.00 0.00 H new ATOM 0 HG21 ILE A 123 10.763 6.503 -7.345 1.00 0.00 H new ATOM 0 HG22 ILE A 123 10.734 5.880 -5.678 1.00 0.00 H new ATOM 0 HG23 ILE A 123 10.345 4.800 -7.038 1.00 0.00 H new ATOM 0 HD11 ILE A 123 8.061 7.398 -9.809 1.00 0.00 H new ATOM 0 HD12 ILE A 123 8.309 8.391 -8.353 1.00 0.00 H new ATOM 0 HD13 ILE A 123 9.645 7.409 -8.998 1.00 0.00 H new ATOM 1929 N SER A 124 8.689 4.012 -3.542 1.00 0.00 N ATOM 1930 CA SER A 124 8.860 3.832 -2.079 1.00 0.00 C ATOM 1931 C SER A 124 10.104 2.949 -1.807 1.00 0.00 C ATOM 1932 O SER A 124 10.146 1.779 -2.197 1.00 0.00 O ATOM 1933 CB SER A 124 7.571 3.205 -1.495 1.00 0.00 C ATOM 1934 OG SER A 124 6.427 4.024 -1.719 1.00 0.00 O ATOM 0 H SER A 124 8.682 3.138 -4.068 1.00 0.00 H new ATOM 0 HA SER A 124 9.024 4.793 -1.591 1.00 0.00 H new ATOM 0 HB2 SER A 124 7.409 2.226 -1.945 1.00 0.00 H new ATOM 0 HB3 SER A 124 7.699 3.046 -0.424 1.00 0.00 H new ATOM 0 HG SER A 124 5.635 3.591 -1.337 1.00 0.00 H new ATOM 1940 N LYS A 125 11.120 3.520 -1.134 1.00 0.00 N ATOM 1941 CA LYS A 125 12.445 2.873 -0.942 1.00 0.00 C ATOM 1942 C LYS A 125 12.419 1.790 0.165 1.00 0.00 C ATOM 1943 O LYS A 125 11.858 1.992 1.246 1.00 0.00 O ATOM 1944 CB LYS A 125 13.522 3.955 -0.608 1.00 0.00 C ATOM 1945 CG LYS A 125 14.468 4.244 -1.787 1.00 0.00 C ATOM 1946 CD LYS A 125 15.403 5.450 -1.567 1.00 0.00 C ATOM 1947 CE LYS A 125 16.385 5.718 -2.726 1.00 0.00 C ATOM 1948 NZ LYS A 125 17.446 4.697 -2.831 1.00 0.00 N ATOM 0 H LYS A 125 11.052 4.443 -0.705 1.00 0.00 H new ATOM 0 HA LYS A 125 12.701 2.373 -1.876 1.00 0.00 H new ATOM 0 HB2 LYS A 125 13.023 4.879 -0.315 1.00 0.00 H new ATOM 0 HB3 LYS A 125 14.109 3.624 0.249 1.00 0.00 H new ATOM 0 HG2 LYS A 125 15.074 3.358 -1.977 1.00 0.00 H new ATOM 0 HG3 LYS A 125 13.871 4.420 -2.682 1.00 0.00 H new ATOM 0 HD2 LYS A 125 14.795 6.341 -1.409 1.00 0.00 H new ATOM 0 HD3 LYS A 125 15.975 5.288 -0.653 1.00 0.00 H new ATOM 0 HE2 LYS A 125 15.830 5.755 -3.664 1.00 0.00 H new ATOM 0 HE3 LYS A 125 16.843 6.697 -2.588 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 18.074 4.930 -3.626 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 17.997 4.677 -1.949 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 17.015 3.764 -2.992 1.00 0.00 H new ATOM 1962 N ARG A 126 13.094 0.662 -0.109 1.00 0.00 N ATOM 1963 CA ARG A 126 13.157 -0.495 0.813 1.00 0.00 C ATOM 1964 C ARG A 126 14.119 -0.203 2.003 1.00 0.00 C ATOM 1965 O ARG A 126 15.322 0.007 1.816 1.00 0.00 O ATOM 1966 CB ARG A 126 13.584 -1.733 -0.017 1.00 0.00 C ATOM 1967 CG ARG A 126 13.378 -3.068 0.714 1.00 0.00 C ATOM 1968 CD ARG A 126 13.744 -4.291 -0.150 1.00 0.00 C ATOM 1969 NE ARG A 126 13.619 -5.567 0.602 1.00 0.00 N ATOM 1970 CZ ARG A 126 14.608 -6.132 1.327 1.00 0.00 C ATOM 1971 NH1 ARG A 126 15.820 -5.600 1.479 1.00 0.00 N ATOM 1972 NH2 ARG A 126 14.360 -7.282 1.926 1.00 0.00 N ATOM 0 H ARG A 126 13.613 0.522 -0.975 1.00 0.00 H new ATOM 0 HA ARG A 126 12.184 -0.690 1.264 1.00 0.00 H new ATOM 0 HB2 ARG A 126 13.018 -1.748 -0.948 1.00 0.00 H new ATOM 0 HB3 ARG A 126 14.636 -1.634 -0.285 1.00 0.00 H new ATOM 0 HG2 ARG A 126 13.983 -3.077 1.621 1.00 0.00 H new ATOM 0 HG3 ARG A 126 12.336 -3.149 1.025 1.00 0.00 H new ATOM 0 HD2 ARG A 126 13.096 -4.322 -1.026 1.00 0.00 H new ATOM 0 HD3 ARG A 126 14.766 -4.184 -0.514 1.00 0.00 H new ATOM 0 HE ARG A 126 12.722 -6.051 0.568 1.00 0.00 H new ATOM 0 HH11 ARG A 126 16.046 -4.711 1.033 1.00 0.00 H new ATOM 0 HH12 ARG A 126 16.521 -6.081 2.042 1.00 0.00 H new ATOM 0 HH21 ARG A 126 13.442 -7.718 1.834 1.00 0.00 H new ATOM 0 HH22 ARG A 126 15.086 -7.735 2.481 1.00 0.00 H new ATOM 1986 N ILE A 127 13.540 -0.178 3.214 1.00 0.00 N ATOM 1987 CA ILE A 127 14.249 0.189 4.467 1.00 0.00 C ATOM 1988 C ILE A 127 14.217 -1.050 5.375 1.00 0.00 C ATOM 1989 O ILE A 127 15.104 -1.902 5.320 1.00 0.00 O ATOM 1990 CB ILE A 127 13.653 1.459 5.170 1.00 0.00 C ATOM 1991 CG1 ILE A 127 12.122 1.405 5.476 1.00 0.00 C ATOM 1992 CG2 ILE A 127 14.020 2.746 4.390 1.00 0.00 C ATOM 1993 CD1 ILE A 127 11.625 2.386 6.549 1.00 0.00 C ATOM 0 H ILE A 127 12.558 -0.413 3.361 1.00 0.00 H new ATOM 0 HA ILE A 127 15.276 0.474 4.238 1.00 0.00 H new ATOM 0 HB ILE A 127 14.125 1.476 6.152 1.00 0.00 H new ATOM 0 HG12 ILE A 127 11.578 1.599 4.552 1.00 0.00 H new ATOM 0 HG13 ILE A 127 11.868 0.392 5.789 1.00 0.00 H new ATOM 0 HG21 ILE A 127 13.595 3.612 4.897 1.00 0.00 H new ATOM 0 HG22 ILE A 127 15.104 2.847 4.345 1.00 0.00 H new ATOM 0 HG23 ILE A 127 13.619 2.685 3.378 1.00 0.00 H new ATOM 0 HD11 ILE A 127 10.550 2.265 6.683 1.00 0.00 H new ATOM 0 HD12 ILE A 127 12.133 2.182 7.492 1.00 0.00 H new ATOM 0 HD13 ILE A 127 11.839 3.408 6.235 1.00 0.00 H new TER 2005 ILE A 127