USER MOD reduce.3.24.130724 H: found=0, std=0, add=689, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 688 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: X 10 TYR OH : rot -152:sc= 1.34 USER MOD Set 1.2: X 40 HIS : no HE2:sc= 0.139 K(o=1.5,f=-4.7!) USER MOD Set 2.1: X 6 SER OG : rot 121:sc= 0.759 USER MOD Set 2.2: X 8 SER OG : rot 180:sc= 0.773 USER MOD Single : X 4 LYS NZ :NH3+ -116:sc= 0.16 (180deg=0) USER MOD Single : X 5 ASN :FLIP amide:sc= 0 F(o=-1.1,f=0) USER MOD Single : X 11 THR OG1 : rot -160:sc= -0.137 USER MOD Single : X 17 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : X 20 LYS NZ :NH3+ 154:sc= 1.15 (180deg=-1.09) USER MOD Single : X 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : X 26 ASN : amide:sc= 1.05 K(o=1,f=-0.28) USER MOD Single : X 30 THR OG1 : rot -67:sc= -1.43! USER MOD Single : X 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : X 45 THR OG1 : rot -93:sc= 0.314 USER MOD Single : X 47 HIS : no HD1:sc= -4.82! C(o=-4.8!,f=-10!) USER MOD Single : X 51 THR OG1 : rot 180:sc= 0.126 USER MOD Single : X 55 TYR OH : rot 180:sc= 0 USER MOD Single : X 64 ASN : amide:sc= 0.806 K(o=0.81,f=-0.012) USER MOD Single : X 77 LYS NZ :NH3+ -146:sc= 1.31 (180deg=0.581) USER MOD Single : X 80 LYS NZ :NH3+ -149:sc= 1.01 (180deg=0.249) USER MOD Single : X 86 ASN : amide:sc= -3.89! C(o=-3.9!,f=-6.5!) USER MOD Single : X 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : X 92 LYS NZ :NH3+ -172:sc= 1.23 (180deg=1.22) USER MOD Single : X 93 GLN : amide:sc= -0.0229 X(o=-0.023,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLU X 2 59.188 2.519 7.280 1.00 0.00 N ATOM 2 CA GLU X 2 59.347 3.965 7.375 1.00 0.00 C ATOM 3 C GLU X 2 60.632 4.366 6.700 1.00 0.00 C ATOM 4 O GLU X 2 61.490 3.516 6.438 1.00 0.00 O ATOM 5 CB GLU X 2 59.352 4.418 8.836 1.00 0.00 C ATOM 6 CG GLU X 2 58.047 4.161 9.560 1.00 0.00 C ATOM 7 CD GLU X 2 56.915 4.939 8.960 1.00 0.00 C ATOM 8 OE1 GLU X 2 56.693 6.085 9.381 1.00 0.00 O ATOM 9 OE2 GLU X 2 56.237 4.429 8.046 1.00 0.00 O ATOM 0 HA GLU X 2 58.506 4.448 6.878 1.00 0.00 H new ATOM 0 HB2 GLU X 2 60.156 3.905 9.363 1.00 0.00 H new ATOM 0 HB3 GLU X 2 59.575 5.484 8.875 1.00 0.00 H new ATOM 0 HG2 GLU X 2 57.815 3.096 9.525 1.00 0.00 H new ATOM 0 HG3 GLU X 2 58.155 4.429 10.611 1.00 0.00 H new ATOM 16 N LEU X 3 60.769 5.635 6.417 1.00 0.00 N ATOM 17 CA LEU X 3 61.933 6.163 5.752 1.00 0.00 C ATOM 18 C LEU X 3 62.537 7.229 6.612 1.00 0.00 C ATOM 19 O LEU X 3 61.828 7.899 7.368 1.00 0.00 O ATOM 20 CB LEU X 3 61.547 6.796 4.409 1.00 0.00 C ATOM 21 CG LEU X 3 60.899 5.877 3.389 1.00 0.00 C ATOM 22 CD1 LEU X 3 60.620 6.616 2.086 1.00 0.00 C ATOM 23 CD2 LEU X 3 61.781 4.688 3.142 1.00 0.00 C ATOM 0 H LEU X 3 60.068 6.340 6.644 1.00 0.00 H new ATOM 0 HA LEU X 3 62.637 5.349 5.580 1.00 0.00 H new ATOM 0 HB2 LEU X 3 60.865 7.623 4.605 1.00 0.00 H new ATOM 0 HB3 LEU X 3 62.445 7.223 3.962 1.00 0.00 H new ATOM 0 HG LEU X 3 59.944 5.535 3.788 1.00 0.00 H new ATOM 0 HD11 LEU X 3 60.156 5.934 1.373 1.00 0.00 H new ATOM 0 HD12 LEU X 3 59.948 7.452 2.279 1.00 0.00 H new ATOM 0 HD13 LEU X 3 61.556 6.991 1.673 1.00 0.00 H new ATOM 0 HD21 LEU X 3 61.311 4.032 2.409 1.00 0.00 H new ATOM 0 HD22 LEU X 3 62.746 5.023 2.762 1.00 0.00 H new ATOM 0 HD23 LEU X 3 61.928 4.144 4.075 1.00 0.00 H new ATOM 35 N LYS X 4 63.817 7.363 6.545 1.00 0.00 N ATOM 36 CA LYS X 4 64.511 8.399 7.251 1.00 0.00 C ATOM 37 C LYS X 4 64.986 9.401 6.209 1.00 0.00 C ATOM 38 O LYS X 4 65.083 9.065 5.053 1.00 0.00 O ATOM 39 CB LYS X 4 65.741 7.848 7.978 1.00 0.00 C ATOM 40 CG LYS X 4 65.588 6.514 8.712 1.00 0.00 C ATOM 41 CD LYS X 4 64.343 6.416 9.535 1.00 0.00 C ATOM 42 CE LYS X 4 64.543 5.396 10.654 1.00 0.00 C ATOM 43 NZ LYS X 4 63.319 5.148 11.441 1.00 0.00 N ATOM 0 H LYS X 4 64.422 6.754 5.995 1.00 0.00 H new ATOM 0 HA LYS X 4 63.847 8.846 7.991 1.00 0.00 H new ATOM 0 HB2 LYS X 4 66.543 7.740 7.248 1.00 0.00 H new ATOM 0 HB3 LYS X 4 66.067 8.595 8.702 1.00 0.00 H new ATOM 0 HG2 LYS X 4 65.594 5.705 7.981 1.00 0.00 H new ATOM 0 HG3 LYS X 4 66.452 6.365 9.359 1.00 0.00 H new ATOM 0 HD2 LYS X 4 64.098 7.390 9.958 1.00 0.00 H new ATOM 0 HD3 LYS X 4 63.503 6.120 8.907 1.00 0.00 H new ATOM 0 HE2 LYS X 4 64.886 4.456 10.223 1.00 0.00 H new ATOM 0 HE3 LYS X 4 65.331 5.747 11.320 1.00 0.00 H new ATOM 0 HZ1 LYS X 4 63.469 5.458 12.422 1.00 0.00 H new ATOM 0 HZ2 LYS X 4 62.527 5.679 11.027 1.00 0.00 H new ATOM 0 HZ3 LYS X 4 63.098 4.132 11.429 1.00 0.00 H new ATOM 57 N ASN X 5 65.295 10.611 6.600 1.00 0.00 N ATOM 58 CA ASN X 5 65.765 11.605 5.613 1.00 0.00 C ATOM 59 C ASN X 5 67.242 11.458 5.333 1.00 0.00 C ATOM 60 O ASN X 5 67.752 11.957 4.323 1.00 0.00 O ATOM 61 CB ASN X 5 65.441 13.048 6.028 1.00 0.00 C ATOM 62 CG ASN X 5 63.982 13.447 5.811 1.00 0.00 C ATOM 63 OD1 ASN X 5 63.080 12.500 5.842 1.00 0.00 O flip ATOM 64 ND2 ASN X 5 63.676 14.625 5.597 1.00 0.00 N flip ATOM 0 H ASN X 5 65.239 10.945 7.562 1.00 0.00 H new ATOM 0 HA ASN X 5 65.217 11.398 4.694 1.00 0.00 H new ATOM 0 HB2 ASN X 5 65.689 13.176 7.082 1.00 0.00 H new ATOM 0 HB3 ASN X 5 66.080 13.729 5.466 1.00 0.00 H new ATOM 0 HD21 ASN X 5 64.399 15.344 5.578 1.00 0.00 H new ATOM 0 HD22 ASN X 5 62.701 14.878 5.439 1.00 0.00 H new ATOM 71 N SER X 6 67.921 10.774 6.208 1.00 0.00 N ATOM 72 CA SER X 6 69.326 10.564 6.083 1.00 0.00 C ATOM 73 C SER X 6 69.702 9.155 6.473 1.00 0.00 C ATOM 74 O SER X 6 68.930 8.456 7.146 1.00 0.00 O ATOM 75 CB SER X 6 70.064 11.562 6.943 1.00 0.00 C ATOM 76 OG SER X 6 69.448 11.656 8.224 1.00 0.00 O ATOM 0 H SER X 6 67.507 10.344 7.035 1.00 0.00 H new ATOM 0 HA SER X 6 69.608 10.707 5.040 1.00 0.00 H new ATOM 0 HB2 SER X 6 71.105 11.259 7.053 1.00 0.00 H new ATOM 0 HB3 SER X 6 70.066 12.539 6.459 1.00 0.00 H new ATOM 0 HG SER X 6 70.098 11.418 8.918 1.00 0.00 H new ATOM 82 N ILE X 7 70.905 8.760 6.081 1.00 0.00 N ATOM 83 CA ILE X 7 71.467 7.437 6.365 1.00 0.00 C ATOM 84 C ILE X 7 71.670 7.265 7.881 1.00 0.00 C ATOM 85 O ILE X 7 71.624 6.170 8.414 1.00 0.00 O ATOM 86 CB ILE X 7 72.858 7.297 5.649 1.00 0.00 C ATOM 87 CG1 ILE X 7 73.405 5.869 5.697 1.00 0.00 C ATOM 88 CG2 ILE X 7 73.889 8.288 6.185 1.00 0.00 C ATOM 89 CD1 ILE X 7 72.636 4.911 4.839 1.00 0.00 C ATOM 0 H ILE X 7 71.534 9.358 5.546 1.00 0.00 H new ATOM 0 HA ILE X 7 70.778 6.674 6.001 1.00 0.00 H new ATOM 0 HB ILE X 7 72.674 7.541 4.603 1.00 0.00 H new ATOM 0 HG12 ILE X 7 74.447 5.876 5.378 1.00 0.00 H new ATOM 0 HG13 ILE X 7 73.389 5.516 6.728 1.00 0.00 H new ATOM 0 HG21 ILE X 7 74.833 8.151 5.658 1.00 0.00 H new ATOM 0 HG22 ILE X 7 73.531 9.306 6.029 1.00 0.00 H new ATOM 0 HG23 ILE X 7 74.040 8.116 7.251 1.00 0.00 H new ATOM 0 HD11 ILE X 7 73.076 3.917 4.919 1.00 0.00 H new ATOM 0 HD12 ILE X 7 71.599 4.876 5.172 1.00 0.00 H new ATOM 0 HD13 ILE X 7 72.673 5.242 3.801 1.00 0.00 H new ATOM 101 N SER X 8 71.769 8.385 8.551 1.00 0.00 N ATOM 102 CA SER X 8 72.161 8.467 9.908 1.00 0.00 C ATOM 103 C SER X 8 71.057 8.057 10.899 1.00 0.00 C ATOM 104 O SER X 8 71.320 7.877 12.092 1.00 0.00 O ATOM 105 CB SER X 8 72.686 9.876 10.127 1.00 0.00 C ATOM 106 OG SER X 8 71.818 10.826 9.534 1.00 0.00 O ATOM 0 H SER X 8 71.567 9.294 8.135 1.00 0.00 H new ATOM 0 HA SER X 8 72.945 7.738 10.115 1.00 0.00 H new ATOM 0 HB2 SER X 8 72.777 10.075 11.195 1.00 0.00 H new ATOM 0 HB3 SER X 8 73.684 9.969 9.699 1.00 0.00 H new ATOM 0 HG SER X 8 72.169 11.729 9.685 1.00 0.00 H new ATOM 112 N ASP X 9 69.830 7.910 10.421 1.00 0.00 N ATOM 113 CA ASP X 9 68.759 7.440 11.300 1.00 0.00 C ATOM 114 C ASP X 9 68.444 5.992 10.962 1.00 0.00 C ATOM 115 O ASP X 9 67.687 5.307 11.662 1.00 0.00 O ATOM 116 CB ASP X 9 67.496 8.300 11.188 1.00 0.00 C ATOM 117 CG ASP X 9 66.482 8.026 12.299 1.00 0.00 C ATOM 118 OD1 ASP X 9 66.893 7.772 13.448 1.00 0.00 O ATOM 119 OD2 ASP X 9 65.262 8.123 12.061 1.00 0.00 O ATOM 0 H ASP X 9 69.552 8.102 9.459 1.00 0.00 H new ATOM 0 HA ASP X 9 69.104 7.521 12.331 1.00 0.00 H new ATOM 0 HB2 ASP X 9 67.777 9.353 11.213 1.00 0.00 H new ATOM 0 HB3 ASP X 9 67.025 8.119 10.222 1.00 0.00 H new ATOM 124 N TYR X 10 69.055 5.516 9.899 1.00 0.00 N ATOM 125 CA TYR X 10 68.868 4.161 9.473 1.00 0.00 C ATOM 126 C TYR X 10 69.782 3.282 10.246 1.00 0.00 C ATOM 127 O TYR X 10 70.992 3.428 10.171 1.00 0.00 O ATOM 128 CB TYR X 10 69.142 3.958 7.961 1.00 0.00 C ATOM 129 CG TYR X 10 68.005 4.337 7.040 1.00 0.00 C ATOM 130 CD1 TYR X 10 66.915 3.492 6.900 1.00 0.00 C ATOM 131 CD2 TYR X 10 68.011 5.523 6.321 1.00 0.00 C ATOM 132 CE1 TYR X 10 65.863 3.810 6.076 1.00 0.00 C ATOM 133 CE2 TYR X 10 66.948 5.858 5.495 1.00 0.00 C ATOM 134 CZ TYR X 10 65.881 4.990 5.383 1.00 0.00 C ATOM 135 OH TYR X 10 64.813 5.321 4.606 1.00 0.00 O ATOM 0 H TYR X 10 69.690 6.059 9.314 1.00 0.00 H new ATOM 0 HA TYR X 10 67.823 3.908 9.652 1.00 0.00 H new ATOM 0 HB2 TYR X 10 70.020 4.543 7.686 1.00 0.00 H new ATOM 0 HB3 TYR X 10 69.391 2.910 7.791 1.00 0.00 H new ATOM 0 HD1 TYR X 10 66.892 2.563 7.451 1.00 0.00 H new ATOM 0 HD2 TYR X 10 68.853 6.194 6.405 1.00 0.00 H new ATOM 0 HE1 TYR X 10 65.027 3.133 5.976 1.00 0.00 H new ATOM 0 HE2 TYR X 10 66.955 6.788 4.946 1.00 0.00 H new ATOM 0 HH TYR X 10 65.110 5.895 3.869 1.00 0.00 H new ATOM 145 N THR X 11 69.225 2.409 11.040 1.00 0.00 N ATOM 146 CA THR X 11 70.026 1.431 11.687 1.00 0.00 C ATOM 147 C THR X 11 70.322 0.405 10.583 1.00 0.00 C ATOM 148 O THR X 11 69.686 0.477 9.498 1.00 0.00 O ATOM 149 CB THR X 11 69.260 0.741 12.867 1.00 0.00 C ATOM 150 OG1 THR X 11 68.294 -0.191 12.375 1.00 0.00 O ATOM 151 CG2 THR X 11 68.523 1.784 13.671 1.00 0.00 C ATOM 0 H THR X 11 68.227 2.362 11.247 1.00 0.00 H new ATOM 0 HA THR X 11 70.923 1.868 12.126 1.00 0.00 H new ATOM 0 HB THR X 11 69.994 0.219 13.481 1.00 0.00 H new ATOM 0 HG1 THR X 11 67.627 -0.369 13.071 1.00 0.00 H new ATOM 0 HG21 THR X 11 67.991 1.302 14.491 1.00 0.00 H new ATOM 0 HG22 THR X 11 69.236 2.504 14.074 1.00 0.00 H new ATOM 0 HG23 THR X 11 67.809 2.301 13.029 1.00 0.00 H new ATOM 159 N GLU X 12 71.219 -0.523 10.786 1.00 0.00 N ATOM 160 CA GLU X 12 71.478 -1.495 9.733 1.00 0.00 C ATOM 161 C GLU X 12 70.218 -2.327 9.382 1.00 0.00 C ATOM 162 O GLU X 12 69.997 -2.668 8.217 1.00 0.00 O ATOM 163 CB GLU X 12 72.725 -2.345 10.010 1.00 0.00 C ATOM 164 CG GLU X 12 72.782 -2.987 11.378 1.00 0.00 C ATOM 165 CD GLU X 12 74.045 -3.789 11.572 1.00 0.00 C ATOM 166 OE1 GLU X 12 75.153 -3.196 11.612 1.00 0.00 O ATOM 167 OE2 GLU X 12 73.979 -5.021 11.690 1.00 0.00 O ATOM 0 H GLU X 12 71.771 -0.634 11.637 1.00 0.00 H new ATOM 0 HA GLU X 12 71.715 -0.931 8.831 1.00 0.00 H new ATOM 0 HB2 GLU X 12 72.783 -3.130 9.256 1.00 0.00 H new ATOM 0 HB3 GLU X 12 73.607 -1.717 9.885 1.00 0.00 H new ATOM 0 HG2 GLU X 12 72.722 -2.214 12.144 1.00 0.00 H new ATOM 0 HG3 GLU X 12 71.916 -3.636 11.511 1.00 0.00 H new ATOM 174 N ALA X 13 69.381 -2.597 10.382 1.00 0.00 N ATOM 175 CA ALA X 13 68.104 -3.282 10.164 1.00 0.00 C ATOM 176 C ALA X 13 67.102 -2.378 9.441 1.00 0.00 C ATOM 177 O ALA X 13 66.441 -2.819 8.506 1.00 0.00 O ATOM 178 CB ALA X 13 67.518 -3.799 11.465 1.00 0.00 C ATOM 0 H ALA X 13 69.563 -2.352 11.355 1.00 0.00 H new ATOM 0 HA ALA X 13 68.307 -4.141 9.525 1.00 0.00 H new ATOM 0 HB1 ALA X 13 66.572 -4.301 11.264 1.00 0.00 H new ATOM 0 HB2 ALA X 13 68.212 -4.504 11.922 1.00 0.00 H new ATOM 0 HB3 ALA X 13 67.348 -2.964 12.145 1.00 0.00 H new ATOM 184 N GLU X 14 67.012 -1.103 9.867 1.00 0.00 N ATOM 185 CA GLU X 14 66.096 -0.123 9.236 1.00 0.00 C ATOM 186 C GLU X 14 66.401 -0.007 7.768 1.00 0.00 C ATOM 187 O GLU X 14 65.498 0.046 6.924 1.00 0.00 O ATOM 188 CB GLU X 14 66.270 1.276 9.851 1.00 0.00 C ATOM 189 CG GLU X 14 65.759 1.441 11.261 1.00 0.00 C ATOM 190 CD GLU X 14 64.274 1.278 11.359 1.00 0.00 C ATOM 191 OE1 GLU X 14 63.540 2.099 10.774 1.00 0.00 O ATOM 192 OE2 GLU X 14 63.811 0.374 12.084 1.00 0.00 O ATOM 0 H GLU X 14 67.558 -0.725 10.641 1.00 0.00 H new ATOM 0 HA GLU X 14 65.079 -0.478 9.400 1.00 0.00 H new ATOM 0 HB2 GLU X 14 67.330 1.529 9.837 1.00 0.00 H new ATOM 0 HB3 GLU X 14 65.761 1.999 9.213 1.00 0.00 H new ATOM 0 HG2 GLU X 14 66.244 0.709 11.907 1.00 0.00 H new ATOM 0 HG3 GLU X 14 66.038 2.428 11.631 1.00 0.00 H new ATOM 199 N PHE X 15 67.678 0.015 7.472 1.00 0.00 N ATOM 200 CA PHE X 15 68.137 0.169 6.134 1.00 0.00 C ATOM 201 C PHE X 15 67.746 -1.020 5.307 1.00 0.00 C ATOM 202 O PHE X 15 67.106 -0.873 4.282 1.00 0.00 O ATOM 203 CB PHE X 15 69.635 0.312 6.104 1.00 0.00 C ATOM 204 CG PHE X 15 70.139 0.865 4.822 1.00 0.00 C ATOM 205 CD1 PHE X 15 69.865 2.172 4.473 1.00 0.00 C ATOM 206 CD2 PHE X 15 70.891 0.095 3.974 1.00 0.00 C ATOM 207 CE1 PHE X 15 70.336 2.689 3.299 1.00 0.00 C ATOM 208 CE2 PHE X 15 71.368 0.610 2.801 1.00 0.00 C ATOM 209 CZ PHE X 15 71.089 1.907 2.467 1.00 0.00 C ATOM 0 H PHE X 15 68.423 -0.075 8.163 1.00 0.00 H new ATOM 0 HA PHE X 15 67.677 1.068 5.722 1.00 0.00 H new ATOM 0 HB2 PHE X 15 69.949 0.961 6.922 1.00 0.00 H new ATOM 0 HB3 PHE X 15 70.091 -0.663 6.277 1.00 0.00 H new ATOM 0 HD1 PHE X 15 69.274 2.790 5.132 1.00 0.00 H new ATOM 0 HD2 PHE X 15 71.109 -0.930 4.235 1.00 0.00 H new ATOM 0 HE1 PHE X 15 70.115 3.711 3.029 1.00 0.00 H new ATOM 0 HE2 PHE X 15 71.962 -0.004 2.141 1.00 0.00 H new ATOM 0 HZ PHE X 15 71.466 2.316 1.541 1.00 0.00 H new ATOM 219 N VAL X 16 68.135 -2.195 5.754 1.00 0.00 N ATOM 220 CA VAL X 16 67.860 -3.397 5.016 1.00 0.00 C ATOM 221 C VAL X 16 66.369 -3.701 4.875 1.00 0.00 C ATOM 222 O VAL X 16 65.946 -4.348 3.921 1.00 0.00 O ATOM 223 CB VAL X 16 68.681 -4.602 5.468 1.00 0.00 C ATOM 224 CG1 VAL X 16 68.379 -4.992 6.829 1.00 0.00 C ATOM 225 CG2 VAL X 16 68.576 -5.760 4.526 1.00 0.00 C ATOM 0 H VAL X 16 68.643 -2.338 6.627 1.00 0.00 H new ATOM 0 HA VAL X 16 68.207 -3.183 4.005 1.00 0.00 H new ATOM 0 HB VAL X 16 69.722 -4.278 5.449 1.00 0.00 H new ATOM 0 HG11 VAL X 16 68.988 -5.853 7.104 1.00 0.00 H new ATOM 0 HG12 VAL X 16 68.597 -4.163 7.502 1.00 0.00 H new ATOM 0 HG13 VAL X 16 67.324 -5.254 6.907 1.00 0.00 H new ATOM 0 HG21 VAL X 16 69.180 -6.588 4.898 1.00 0.00 H new ATOM 0 HG22 VAL X 16 67.535 -6.075 4.451 1.00 0.00 H new ATOM 0 HG23 VAL X 16 68.936 -5.462 3.541 1.00 0.00 H new ATOM 235 N GLN X 17 65.582 -3.254 5.818 1.00 0.00 N ATOM 236 CA GLN X 17 64.166 -3.360 5.723 1.00 0.00 C ATOM 237 C GLN X 17 63.696 -2.584 4.484 1.00 0.00 C ATOM 238 O GLN X 17 62.929 -3.097 3.667 1.00 0.00 O ATOM 239 CB GLN X 17 63.546 -2.771 6.963 1.00 0.00 C ATOM 240 CG GLN X 17 62.062 -2.783 6.947 1.00 0.00 C ATOM 241 CD GLN X 17 61.473 -1.969 8.062 1.00 0.00 C ATOM 242 OE1 GLN X 17 61.242 -2.467 9.158 1.00 0.00 O ATOM 243 NE2 GLN X 17 61.204 -0.726 7.793 1.00 0.00 N ATOM 0 H GLN X 17 65.914 -2.806 6.672 1.00 0.00 H new ATOM 0 HA GLN X 17 63.868 -4.405 5.634 1.00 0.00 H new ATOM 0 HB2 GLN X 17 63.896 -3.326 7.833 1.00 0.00 H new ATOM 0 HB3 GLN X 17 63.892 -1.744 7.080 1.00 0.00 H new ATOM 0 HG2 GLN X 17 61.708 -2.396 5.992 1.00 0.00 H new ATOM 0 HG3 GLN X 17 61.708 -3.811 7.025 1.00 0.00 H new ATOM 0 HE21 GLN X 17 61.411 -0.348 6.869 1.00 0.00 H new ATOM 0 HE22 GLN X 17 60.786 -0.129 8.506 1.00 0.00 H new ATOM 252 N LEU X 18 64.201 -1.368 4.349 1.00 0.00 N ATOM 253 CA LEU X 18 63.921 -0.517 3.208 1.00 0.00 C ATOM 254 C LEU X 18 64.450 -1.184 1.947 1.00 0.00 C ATOM 255 O LEU X 18 63.795 -1.211 0.908 1.00 0.00 O ATOM 256 CB LEU X 18 64.563 0.871 3.460 1.00 0.00 C ATOM 257 CG LEU X 18 64.441 1.971 2.378 1.00 0.00 C ATOM 258 CD1 LEU X 18 65.527 1.845 1.321 1.00 0.00 C ATOM 259 CD2 LEU X 18 63.074 1.936 1.722 1.00 0.00 C ATOM 0 H LEU X 18 64.823 -0.942 5.036 1.00 0.00 H new ATOM 0 HA LEU X 18 62.849 -0.372 3.073 1.00 0.00 H new ATOM 0 HB2 LEU X 18 64.134 1.268 4.380 1.00 0.00 H new ATOM 0 HB3 LEU X 18 65.625 0.711 3.646 1.00 0.00 H new ATOM 0 HG LEU X 18 64.568 2.930 2.881 1.00 0.00 H new ATOM 0 HD11 LEU X 18 65.407 2.635 0.580 1.00 0.00 H new ATOM 0 HD12 LEU X 18 66.506 1.935 1.792 1.00 0.00 H new ATOM 0 HD13 LEU X 18 65.448 0.874 0.832 1.00 0.00 H new ATOM 0 HD21 LEU X 18 63.013 2.718 0.966 1.00 0.00 H new ATOM 0 HD22 LEU X 18 62.921 0.964 1.252 1.00 0.00 H new ATOM 0 HD23 LEU X 18 62.304 2.100 2.476 1.00 0.00 H new ATOM 271 N LEU X 19 65.604 -1.755 2.089 1.00 0.00 N ATOM 272 CA LEU X 19 66.274 -2.486 1.043 1.00 0.00 C ATOM 273 C LEU X 19 65.447 -3.633 0.508 1.00 0.00 C ATOM 274 O LEU X 19 65.343 -3.824 -0.707 1.00 0.00 O ATOM 275 CB LEU X 19 67.543 -3.002 1.574 1.00 0.00 C ATOM 276 CG LEU X 19 68.597 -1.954 1.871 1.00 0.00 C ATOM 277 CD1 LEU X 19 69.891 -2.609 2.134 1.00 0.00 C ATOM 278 CD2 LEU X 19 68.724 -0.922 0.755 1.00 0.00 C ATOM 0 H LEU X 19 66.129 -1.728 2.963 1.00 0.00 H new ATOM 0 HA LEU X 19 66.442 -1.802 0.211 1.00 0.00 H new ATOM 0 HB2 LEU X 19 67.336 -3.555 2.490 1.00 0.00 H new ATOM 0 HB3 LEU X 19 67.954 -3.714 0.858 1.00 0.00 H new ATOM 0 HG LEU X 19 68.281 -1.409 2.761 1.00 0.00 H new ATOM 0 HD11 LEU X 19 70.645 -1.852 2.347 1.00 0.00 H new ATOM 0 HD12 LEU X 19 69.794 -3.276 2.991 1.00 0.00 H new ATOM 0 HD13 LEU X 19 70.192 -3.185 1.259 1.00 0.00 H new ATOM 0 HD21 LEU X 19 69.492 -0.195 1.018 1.00 0.00 H new ATOM 0 HD22 LEU X 19 69.000 -1.422 -0.173 1.00 0.00 H new ATOM 0 HD23 LEU X 19 67.771 -0.411 0.622 1.00 0.00 H new ATOM 290 N LYS X 20 64.833 -4.373 1.415 1.00 0.00 N ATOM 291 CA LYS X 20 63.947 -5.468 1.063 1.00 0.00 C ATOM 292 C LYS X 20 62.770 -4.961 0.263 1.00 0.00 C ATOM 293 O LYS X 20 62.319 -5.610 -0.687 1.00 0.00 O ATOM 294 CB LYS X 20 63.411 -6.158 2.302 1.00 0.00 C ATOM 295 CG LYS X 20 64.394 -7.015 3.071 1.00 0.00 C ATOM 296 CD LYS X 20 63.700 -7.670 4.255 1.00 0.00 C ATOM 297 CE LYS X 20 64.610 -8.625 5.012 1.00 0.00 C ATOM 298 NZ LYS X 20 65.826 -7.968 5.510 1.00 0.00 N ATOM 0 H LYS X 20 64.936 -4.230 2.420 1.00 0.00 H new ATOM 0 HA LYS X 20 64.529 -6.175 0.472 1.00 0.00 H new ATOM 0 HB2 LYS X 20 63.021 -5.396 2.976 1.00 0.00 H new ATOM 0 HB3 LYS X 20 62.569 -6.784 2.008 1.00 0.00 H new ATOM 0 HG2 LYS X 20 64.812 -7.779 2.416 1.00 0.00 H new ATOM 0 HG3 LYS X 20 65.226 -6.404 3.420 1.00 0.00 H new ATOM 0 HD2 LYS X 20 63.344 -6.897 4.936 1.00 0.00 H new ATOM 0 HD3 LYS X 20 62.823 -8.213 3.902 1.00 0.00 H new ATOM 0 HE2 LYS X 20 64.063 -9.054 5.852 1.00 0.00 H new ATOM 0 HE3 LYS X 20 64.889 -9.451 4.358 1.00 0.00 H new ATOM 0 HZ1 LYS X 20 66.179 -8.478 6.345 1.00 0.00 H new ATOM 0 HZ2 LYS X 20 66.554 -7.975 4.767 1.00 0.00 H new ATOM 0 HZ3 LYS X 20 65.607 -6.985 5.771 1.00 0.00 H new ATOM 312 N GLU X 21 62.286 -3.808 0.649 1.00 0.00 N ATOM 313 CA GLU X 21 61.165 -3.187 0.000 1.00 0.00 C ATOM 314 C GLU X 21 61.526 -2.701 -1.404 1.00 0.00 C ATOM 315 O GLU X 21 60.673 -2.694 -2.297 1.00 0.00 O ATOM 316 CB GLU X 21 60.609 -2.063 0.855 1.00 0.00 C ATOM 317 CG GLU X 21 60.073 -2.530 2.200 1.00 0.00 C ATOM 318 CD GLU X 21 58.859 -3.423 2.069 1.00 0.00 C ATOM 319 OE1 GLU X 21 57.731 -2.901 2.057 1.00 0.00 O ATOM 320 OE2 GLU X 21 59.002 -4.664 2.001 1.00 0.00 O ATOM 0 H GLU X 21 62.664 -3.271 1.430 1.00 0.00 H new ATOM 0 HA GLU X 21 60.384 -3.939 -0.116 1.00 0.00 H new ATOM 0 HB2 GLU X 21 61.392 -1.323 1.022 1.00 0.00 H new ATOM 0 HB3 GLU X 21 59.810 -1.563 0.308 1.00 0.00 H new ATOM 0 HG2 GLU X 21 60.858 -3.067 2.732 1.00 0.00 H new ATOM 0 HG3 GLU X 21 59.815 -1.661 2.805 1.00 0.00 H new ATOM 327 N ILE X 22 62.784 -2.298 -1.606 1.00 0.00 N ATOM 328 CA ILE X 22 63.240 -1.904 -2.945 1.00 0.00 C ATOM 329 C ILE X 22 63.225 -3.141 -3.822 1.00 0.00 C ATOM 330 O ILE X 22 62.677 -3.145 -4.903 1.00 0.00 O ATOM 331 CB ILE X 22 64.679 -1.325 -2.962 1.00 0.00 C ATOM 332 CG1 ILE X 22 64.853 -0.208 -1.925 1.00 0.00 C ATOM 333 CG2 ILE X 22 64.988 -0.791 -4.358 1.00 0.00 C ATOM 334 CD1 ILE X 22 66.244 0.397 -1.906 1.00 0.00 C ATOM 0 H ILE X 22 63.494 -2.236 -0.876 1.00 0.00 H new ATOM 0 HA ILE X 22 62.571 -1.121 -3.301 1.00 0.00 H new ATOM 0 HB ILE X 22 65.373 -2.125 -2.704 1.00 0.00 H new ATOM 0 HG12 ILE X 22 64.127 0.579 -2.127 1.00 0.00 H new ATOM 0 HG13 ILE X 22 64.626 -0.605 -0.936 1.00 0.00 H new ATOM 0 HG21 ILE X 22 65.998 -0.383 -4.376 1.00 0.00 H new ATOM 0 HG22 ILE X 22 64.911 -1.601 -5.083 1.00 0.00 H new ATOM 0 HG23 ILE X 22 64.275 -0.007 -4.614 1.00 0.00 H new ATOM 0 HD11 ILE X 22 66.290 1.179 -1.148 1.00 0.00 H new ATOM 0 HD12 ILE X 22 66.975 -0.378 -1.673 1.00 0.00 H new ATOM 0 HD13 ILE X 22 66.468 0.825 -2.883 1.00 0.00 H new ATOM 346 N GLU X 23 63.762 -4.211 -3.277 1.00 0.00 N ATOM 347 CA GLU X 23 63.805 -5.515 -3.928 1.00 0.00 C ATOM 348 C GLU X 23 62.424 -6.008 -4.288 1.00 0.00 C ATOM 349 O GLU X 23 62.223 -6.706 -5.294 1.00 0.00 O ATOM 350 CB GLU X 23 64.458 -6.498 -2.996 1.00 0.00 C ATOM 351 CG GLU X 23 65.953 -6.514 -3.088 1.00 0.00 C ATOM 352 CD GLU X 23 66.412 -7.130 -4.396 1.00 0.00 C ATOM 353 OE1 GLU X 23 66.251 -6.496 -5.472 1.00 0.00 O ATOM 354 OE2 GLU X 23 66.888 -8.288 -4.375 1.00 0.00 O ATOM 0 H GLU X 23 64.191 -4.205 -2.352 1.00 0.00 H new ATOM 0 HA GLU X 23 64.374 -5.419 -4.852 1.00 0.00 H new ATOM 0 HB2 GLU X 23 64.168 -6.262 -1.972 1.00 0.00 H new ATOM 0 HB3 GLU X 23 64.079 -7.497 -3.212 1.00 0.00 H new ATOM 0 HG2 GLU X 23 66.337 -5.497 -3.007 1.00 0.00 H new ATOM 0 HG3 GLU X 23 66.366 -7.078 -2.252 1.00 0.00 H new ATOM 361 N LYS X 24 61.491 -5.677 -3.449 1.00 0.00 N ATOM 362 CA LYS X 24 60.123 -6.034 -3.630 1.00 0.00 C ATOM 363 C LYS X 24 59.534 -5.374 -4.877 1.00 0.00 C ATOM 364 O LYS X 24 58.831 -6.027 -5.637 1.00 0.00 O ATOM 365 CB LYS X 24 59.330 -5.672 -2.376 1.00 0.00 C ATOM 366 CG LYS X 24 57.824 -5.970 -2.441 1.00 0.00 C ATOM 367 CD LYS X 24 57.527 -7.457 -2.647 1.00 0.00 C ATOM 368 CE LYS X 24 58.029 -8.301 -1.487 1.00 0.00 C ATOM 369 NZ LYS X 24 57.763 -9.741 -1.685 1.00 0.00 N ATOM 0 H LYS X 24 61.667 -5.139 -2.601 1.00 0.00 H new ATOM 0 HA LYS X 24 60.058 -7.111 -3.785 1.00 0.00 H new ATOM 0 HB2 LYS X 24 59.754 -6.212 -1.530 1.00 0.00 H new ATOM 0 HB3 LYS X 24 59.465 -4.609 -2.175 1.00 0.00 H new ATOM 0 HG2 LYS X 24 57.351 -5.633 -1.519 1.00 0.00 H new ATOM 0 HG3 LYS X 24 57.379 -5.398 -3.255 1.00 0.00 H new ATOM 0 HD2 LYS X 24 56.453 -7.600 -2.762 1.00 0.00 H new ATOM 0 HD3 LYS X 24 57.994 -7.796 -3.572 1.00 0.00 H new ATOM 0 HE2 LYS X 24 59.101 -8.145 -1.364 1.00 0.00 H new ATOM 0 HE3 LYS X 24 57.551 -7.969 -0.565 1.00 0.00 H new ATOM 0 HZ1 LYS X 24 58.123 -10.276 -0.869 1.00 0.00 H new ATOM 0 HZ2 LYS X 24 56.739 -9.896 -1.776 1.00 0.00 H new ATOM 0 HZ3 LYS X 24 58.240 -10.066 -2.550 1.00 0.00 H new ATOM 383 N GLU X 25 59.862 -4.116 -5.129 1.00 0.00 N ATOM 384 CA GLU X 25 59.289 -3.454 -6.260 1.00 0.00 C ATOM 385 C GLU X 25 60.158 -3.694 -7.493 1.00 0.00 C ATOM 386 O GLU X 25 59.654 -3.797 -8.582 1.00 0.00 O ATOM 387 CB GLU X 25 58.989 -1.946 -5.946 1.00 0.00 C ATOM 388 CG GLU X 25 60.168 -1.084 -5.596 1.00 0.00 C ATOM 389 CD GLU X 25 60.909 -0.727 -6.827 1.00 0.00 C ATOM 390 OE1 GLU X 25 60.237 -0.656 -7.900 1.00 0.00 O ATOM 391 OE2 GLU X 25 62.130 -0.561 -6.770 1.00 0.00 O ATOM 0 H GLU X 25 60.507 -3.555 -4.573 1.00 0.00 H new ATOM 0 HA GLU X 25 58.313 -3.881 -6.490 1.00 0.00 H new ATOM 0 HB2 GLU X 25 58.494 -1.510 -6.813 1.00 0.00 H new ATOM 0 HB3 GLU X 25 58.280 -1.905 -5.119 1.00 0.00 H new ATOM 0 HG2 GLU X 25 59.832 -0.180 -5.088 1.00 0.00 H new ATOM 0 HG3 GLU X 25 60.825 -1.613 -4.905 1.00 0.00 H new ATOM 398 N ASN X 26 61.466 -3.857 -7.262 1.00 0.00 N ATOM 399 CA ASN X 26 62.481 -4.129 -8.305 1.00 0.00 C ATOM 400 C ASN X 26 62.067 -5.285 -9.206 1.00 0.00 C ATOM 401 O ASN X 26 62.081 -5.172 -10.434 1.00 0.00 O ATOM 402 CB ASN X 26 63.848 -4.434 -7.633 1.00 0.00 C ATOM 403 CG ASN X 26 64.971 -4.834 -8.601 1.00 0.00 C ATOM 404 OD1 ASN X 26 64.984 -4.459 -9.781 1.00 0.00 O ATOM 405 ND2 ASN X 26 65.943 -5.567 -8.098 1.00 0.00 N ATOM 0 H ASN X 26 61.865 -3.803 -6.325 1.00 0.00 H new ATOM 0 HA ASN X 26 62.570 -3.242 -8.932 1.00 0.00 H new ATOM 0 HB2 ASN X 26 64.166 -3.553 -7.075 1.00 0.00 H new ATOM 0 HB3 ASN X 26 63.709 -5.237 -6.909 1.00 0.00 H new ATOM 0 HD21 ASN X 26 66.732 -5.839 -8.684 1.00 0.00 H new ATOM 0 HD22 ASN X 26 65.907 -5.862 -7.122 1.00 0.00 H new ATOM 412 N VAL X 27 61.635 -6.371 -8.600 1.00 0.00 N ATOM 413 CA VAL X 27 61.246 -7.561 -9.355 1.00 0.00 C ATOM 414 C VAL X 27 59.944 -7.365 -10.155 1.00 0.00 C ATOM 415 O VAL X 27 59.663 -8.117 -11.081 1.00 0.00 O ATOM 416 CB VAL X 27 61.152 -8.828 -8.459 1.00 0.00 C ATOM 417 CG1 VAL X 27 62.521 -9.190 -7.906 1.00 0.00 C ATOM 418 CG2 VAL X 27 60.164 -8.623 -7.318 1.00 0.00 C ATOM 0 H VAL X 27 61.542 -6.462 -7.588 1.00 0.00 H new ATOM 0 HA VAL X 27 62.049 -7.719 -10.075 1.00 0.00 H new ATOM 0 HB VAL X 27 60.791 -9.649 -9.078 1.00 0.00 H new ATOM 0 HG11 VAL X 27 62.437 -10.079 -7.281 1.00 0.00 H new ATOM 0 HG12 VAL X 27 63.205 -9.389 -8.731 1.00 0.00 H new ATOM 0 HG13 VAL X 27 62.903 -8.362 -7.309 1.00 0.00 H new ATOM 0 HG21 VAL X 27 60.120 -9.526 -6.709 1.00 0.00 H new ATOM 0 HG22 VAL X 27 60.489 -7.785 -6.702 1.00 0.00 H new ATOM 0 HG23 VAL X 27 59.176 -8.412 -7.726 1.00 0.00 H new ATOM 428 N ALA X 28 59.180 -6.354 -9.815 1.00 0.00 N ATOM 429 CA ALA X 28 57.936 -6.082 -10.517 1.00 0.00 C ATOM 430 C ALA X 28 58.091 -4.874 -11.432 1.00 0.00 C ATOM 431 O ALA X 28 57.313 -4.690 -12.360 1.00 0.00 O ATOM 432 CB ALA X 28 56.808 -5.856 -9.526 1.00 0.00 C ATOM 0 H ALA X 28 59.392 -5.704 -9.058 1.00 0.00 H new ATOM 0 HA ALA X 28 57.690 -6.948 -11.131 1.00 0.00 H new ATOM 0 HB1 ALA X 28 55.884 -5.654 -10.067 1.00 0.00 H new ATOM 0 HB2 ALA X 28 56.681 -6.746 -8.910 1.00 0.00 H new ATOM 0 HB3 ALA X 28 57.049 -5.005 -8.888 1.00 0.00 H new ATOM 438 N ALA X 29 59.111 -4.072 -11.144 1.00 0.00 N ATOM 439 CA ALA X 29 59.436 -2.842 -11.840 1.00 0.00 C ATOM 440 C ALA X 29 58.291 -1.849 -11.740 1.00 0.00 C ATOM 441 O ALA X 29 57.374 -1.831 -12.574 1.00 0.00 O ATOM 442 CB ALA X 29 59.871 -3.086 -13.281 1.00 0.00 C ATOM 0 H ALA X 29 59.760 -4.275 -10.384 1.00 0.00 H new ATOM 0 HA ALA X 29 60.299 -2.400 -11.342 1.00 0.00 H new ATOM 0 HB1 ALA X 29 60.103 -2.133 -13.757 1.00 0.00 H new ATOM 0 HB2 ALA X 29 60.756 -3.722 -13.291 1.00 0.00 H new ATOM 0 HB3 ALA X 29 59.065 -3.578 -13.826 1.00 0.00 H new ATOM 448 N THR X 30 58.295 -1.068 -10.689 1.00 0.00 N ATOM 449 CA THR X 30 57.244 -0.109 -10.490 1.00 0.00 C ATOM 450 C THR X 30 57.699 1.231 -11.039 1.00 0.00 C ATOM 451 O THR X 30 58.666 1.284 -11.812 1.00 0.00 O ATOM 452 CB THR X 30 56.868 0.002 -8.989 1.00 0.00 C ATOM 453 OG1 THR X 30 57.930 0.585 -8.231 1.00 0.00 O ATOM 454 CG2 THR X 30 56.582 -1.366 -8.436 1.00 0.00 C ATOM 0 H THR X 30 59.011 -1.079 -9.963 1.00 0.00 H new ATOM 0 HA THR X 30 56.349 -0.434 -11.020 1.00 0.00 H new ATOM 0 HB THR X 30 55.986 0.638 -8.912 1.00 0.00 H new ATOM 0 HG1 THR X 30 58.698 -0.024 -8.222 1.00 0.00 H new ATOM 0 HG21 THR X 30 56.318 -1.284 -7.382 1.00 0.00 H new ATOM 0 HG22 THR X 30 55.753 -1.814 -8.984 1.00 0.00 H new ATOM 0 HG23 THR X 30 57.467 -1.993 -8.541 1.00 0.00 H new ATOM 462 N ASP X 31 57.028 2.299 -10.689 1.00 0.00 N ATOM 463 CA ASP X 31 57.468 3.591 -11.151 1.00 0.00 C ATOM 464 C ASP X 31 57.451 4.623 -10.064 1.00 0.00 C ATOM 465 O ASP X 31 58.400 5.403 -9.954 1.00 0.00 O ATOM 466 CB ASP X 31 56.733 4.084 -12.402 1.00 0.00 C ATOM 467 CG ASP X 31 55.282 4.452 -12.157 1.00 0.00 C ATOM 468 OD1 ASP X 31 54.422 3.544 -12.161 1.00 0.00 O ATOM 469 OD2 ASP X 31 54.983 5.640 -11.946 1.00 0.00 O ATOM 0 H ASP X 31 56.195 2.303 -10.100 1.00 0.00 H new ATOM 0 HA ASP X 31 58.506 3.443 -11.450 1.00 0.00 H new ATOM 0 HB2 ASP X 31 57.256 4.954 -12.800 1.00 0.00 H new ATOM 0 HB3 ASP X 31 56.777 3.308 -13.167 1.00 0.00 H new ATOM 474 N ASP X 32 56.415 4.641 -9.247 1.00 0.00 N ATOM 475 CA ASP X 32 56.351 5.624 -8.181 1.00 0.00 C ATOM 476 C ASP X 32 57.352 5.291 -7.139 1.00 0.00 C ATOM 477 O ASP X 32 58.329 6.006 -6.967 1.00 0.00 O ATOM 478 CB ASP X 32 54.963 5.714 -7.533 1.00 0.00 C ATOM 479 CG ASP X 32 54.891 6.771 -6.416 1.00 0.00 C ATOM 480 OD1 ASP X 32 55.227 6.468 -5.246 1.00 0.00 O ATOM 481 OD2 ASP X 32 54.471 7.915 -6.689 1.00 0.00 O ATOM 0 H ASP X 32 55.622 4.002 -9.297 1.00 0.00 H new ATOM 0 HA ASP X 32 56.564 6.594 -8.630 1.00 0.00 H new ATOM 0 HB2 ASP X 32 54.225 5.951 -8.299 1.00 0.00 H new ATOM 0 HB3 ASP X 32 54.695 4.740 -7.123 1.00 0.00 H new ATOM 486 N VAL X 33 57.184 4.144 -6.543 1.00 0.00 N ATOM 487 CA VAL X 33 57.977 3.784 -5.391 1.00 0.00 C ATOM 488 C VAL X 33 59.382 3.389 -5.822 1.00 0.00 C ATOM 489 O VAL X 33 60.333 3.639 -5.122 1.00 0.00 O ATOM 490 CB VAL X 33 57.280 2.705 -4.513 1.00 0.00 C ATOM 491 CG1 VAL X 33 57.204 1.364 -5.190 1.00 0.00 C ATOM 492 CG2 VAL X 33 57.892 2.606 -3.128 1.00 0.00 C ATOM 0 H VAL X 33 56.506 3.439 -6.832 1.00 0.00 H new ATOM 0 HA VAL X 33 58.069 4.660 -4.748 1.00 0.00 H new ATOM 0 HB VAL X 33 56.252 3.043 -4.382 1.00 0.00 H new ATOM 0 HG11 VAL X 33 56.708 0.651 -4.531 1.00 0.00 H new ATOM 0 HG12 VAL X 33 56.638 1.456 -6.117 1.00 0.00 H new ATOM 0 HG13 VAL X 33 58.211 1.012 -5.414 1.00 0.00 H new ATOM 0 HG21 VAL X 33 57.371 1.840 -2.554 1.00 0.00 H new ATOM 0 HG22 VAL X 33 58.946 2.341 -3.214 1.00 0.00 H new ATOM 0 HG23 VAL X 33 57.799 3.566 -2.620 1.00 0.00 H new ATOM 502 N LEU X 34 59.477 2.903 -7.040 1.00 0.00 N ATOM 503 CA LEU X 34 60.741 2.548 -7.690 1.00 0.00 C ATOM 504 C LEU X 34 61.626 3.768 -7.717 1.00 0.00 C ATOM 505 O LEU X 34 62.723 3.753 -7.177 1.00 0.00 O ATOM 506 CB LEU X 34 60.375 2.074 -9.133 1.00 0.00 C ATOM 507 CG LEU X 34 61.448 1.662 -10.181 1.00 0.00 C ATOM 508 CD1 LEU X 34 62.187 2.840 -10.749 1.00 0.00 C ATOM 509 CD2 LEU X 34 62.406 0.628 -9.634 1.00 0.00 C ATOM 0 H LEU X 34 58.662 2.736 -7.630 1.00 0.00 H new ATOM 0 HA LEU X 34 61.279 1.759 -7.165 1.00 0.00 H new ATOM 0 HB2 LEU X 34 59.708 1.220 -9.019 1.00 0.00 H new ATOM 0 HB3 LEU X 34 59.792 2.876 -9.585 1.00 0.00 H new ATOM 0 HG LEU X 34 60.902 1.204 -11.005 1.00 0.00 H new ATOM 0 HD11 LEU X 34 62.923 2.493 -11.474 1.00 0.00 H new ATOM 0 HD12 LEU X 34 61.481 3.510 -11.240 1.00 0.00 H new ATOM 0 HD13 LEU X 34 62.694 3.374 -9.945 1.00 0.00 H new ATOM 0 HD21 LEU X 34 63.138 0.369 -10.399 1.00 0.00 H new ATOM 0 HD22 LEU X 34 62.920 1.033 -8.762 1.00 0.00 H new ATOM 0 HD23 LEU X 34 61.852 -0.265 -9.346 1.00 0.00 H new ATOM 521 N ASP X 35 61.109 4.864 -8.230 1.00 0.00 N ATOM 522 CA ASP X 35 61.932 6.052 -8.348 1.00 0.00 C ATOM 523 C ASP X 35 62.157 6.692 -7.014 1.00 0.00 C ATOM 524 O ASP X 35 63.182 7.327 -6.798 1.00 0.00 O ATOM 525 CB ASP X 35 61.394 7.039 -9.386 1.00 0.00 C ATOM 526 CG ASP X 35 62.316 8.225 -9.605 1.00 0.00 C ATOM 527 OD1 ASP X 35 63.332 8.077 -10.331 1.00 0.00 O ATOM 528 OD2 ASP X 35 62.048 9.312 -9.052 1.00 0.00 O ATOM 0 H ASP X 35 60.150 4.960 -8.564 1.00 0.00 H new ATOM 0 HA ASP X 35 62.905 5.731 -8.720 1.00 0.00 H new ATOM 0 HB2 ASP X 35 61.247 6.519 -10.333 1.00 0.00 H new ATOM 0 HB3 ASP X 35 60.416 7.399 -9.065 1.00 0.00 H new ATOM 533 N VAL X 36 61.248 6.473 -6.087 1.00 0.00 N ATOM 534 CA VAL X 36 61.429 7.039 -4.771 1.00 0.00 C ATOM 535 C VAL X 36 62.562 6.380 -4.101 1.00 0.00 C ATOM 536 O VAL X 36 63.498 7.035 -3.680 1.00 0.00 O ATOM 537 CB VAL X 36 60.239 6.760 -3.848 1.00 0.00 C ATOM 538 CG1 VAL X 36 60.467 7.315 -2.488 1.00 0.00 C ATOM 539 CG2 VAL X 36 59.007 7.283 -4.381 1.00 0.00 C ATOM 0 H VAL X 36 60.399 5.922 -6.216 1.00 0.00 H new ATOM 0 HA VAL X 36 61.568 8.109 -4.924 1.00 0.00 H new ATOM 0 HB VAL X 36 60.150 5.676 -3.780 1.00 0.00 H new ATOM 0 HG11 VAL X 36 59.604 7.100 -1.858 1.00 0.00 H new ATOM 0 HG12 VAL X 36 61.356 6.859 -2.053 1.00 0.00 H new ATOM 0 HG13 VAL X 36 60.608 8.394 -2.554 1.00 0.00 H new ATOM 0 HG21 VAL X 36 58.190 7.062 -3.694 1.00 0.00 H new ATOM 0 HG22 VAL X 36 59.094 8.362 -4.506 1.00 0.00 H new ATOM 0 HG23 VAL X 36 58.803 6.821 -5.347 1.00 0.00 H new ATOM 549 N LEU X 37 62.512 5.086 -4.111 1.00 0.00 N ATOM 550 CA LEU X 37 63.420 4.302 -3.371 1.00 0.00 C ATOM 551 C LEU X 37 64.776 4.391 -3.923 1.00 0.00 C ATOM 552 O LEU X 37 65.730 4.549 -3.189 1.00 0.00 O ATOM 553 CB LEU X 37 62.983 2.877 -3.313 1.00 0.00 C ATOM 554 CG LEU X 37 61.582 2.597 -2.752 1.00 0.00 C ATOM 555 CD1 LEU X 37 61.301 1.109 -2.735 1.00 0.00 C ATOM 556 CD2 LEU X 37 61.419 3.183 -1.360 1.00 0.00 C ATOM 0 H LEU X 37 61.828 4.548 -4.643 1.00 0.00 H new ATOM 0 HA LEU X 37 63.435 4.700 -2.356 1.00 0.00 H new ATOM 0 HB2 LEU X 37 63.031 2.467 -4.322 1.00 0.00 H new ATOM 0 HB3 LEU X 37 63.705 2.326 -2.710 1.00 0.00 H new ATOM 0 HG LEU X 37 60.858 3.081 -3.408 1.00 0.00 H new ATOM 0 HD11 LEU X 37 60.303 0.932 -2.334 1.00 0.00 H new ATOM 0 HD12 LEU X 37 61.359 0.716 -3.750 1.00 0.00 H new ATOM 0 HD13 LEU X 37 62.038 0.607 -2.109 1.00 0.00 H new ATOM 0 HD21 LEU X 37 60.417 2.968 -0.990 1.00 0.00 H new ATOM 0 HD22 LEU X 37 62.156 2.740 -0.690 1.00 0.00 H new ATOM 0 HD23 LEU X 37 61.567 4.262 -1.400 1.00 0.00 H new ATOM 568 N LEU X 38 64.852 4.325 -5.210 1.00 0.00 N ATOM 569 CA LEU X 38 66.093 4.365 -5.889 1.00 0.00 C ATOM 570 C LEU X 38 66.832 5.648 -5.638 1.00 0.00 C ATOM 571 O LEU X 38 68.019 5.619 -5.312 1.00 0.00 O ATOM 572 CB LEU X 38 65.911 4.029 -7.357 1.00 0.00 C ATOM 573 CG LEU X 38 65.450 2.595 -7.644 1.00 0.00 C ATOM 574 CD1 LEU X 38 65.514 2.309 -9.110 1.00 0.00 C ATOM 575 CD2 LEU X 38 66.249 1.568 -6.851 1.00 0.00 C ATOM 0 H LEU X 38 64.041 4.241 -5.823 1.00 0.00 H new ATOM 0 HA LEU X 38 66.740 3.590 -5.478 1.00 0.00 H new ATOM 0 HB2 LEU X 38 65.184 4.720 -7.784 1.00 0.00 H new ATOM 0 HB3 LEU X 38 66.856 4.200 -7.873 1.00 0.00 H new ATOM 0 HG LEU X 38 64.413 2.511 -7.318 1.00 0.00 H new ATOM 0 HD11 LEU X 38 65.183 1.287 -9.296 1.00 0.00 H new ATOM 0 HD12 LEU X 38 64.866 3.003 -9.645 1.00 0.00 H new ATOM 0 HD13 LEU X 38 66.540 2.428 -9.459 1.00 0.00 H new ATOM 0 HD21 LEU X 38 65.888 0.566 -7.086 1.00 0.00 H new ATOM 0 HD22 LEU X 38 67.304 1.645 -7.115 1.00 0.00 H new ATOM 0 HD23 LEU X 38 66.127 1.757 -5.784 1.00 0.00 H new ATOM 587 N GLU X 39 66.137 6.758 -5.707 1.00 0.00 N ATOM 588 CA GLU X 39 66.758 8.022 -5.411 1.00 0.00 C ATOM 589 C GLU X 39 67.048 8.146 -3.920 1.00 0.00 C ATOM 590 O GLU X 39 68.116 8.597 -3.514 1.00 0.00 O ATOM 591 CB GLU X 39 65.871 9.153 -5.808 1.00 0.00 C ATOM 592 CG GLU X 39 65.603 9.302 -7.282 1.00 0.00 C ATOM 593 CD GLU X 39 66.845 9.513 -8.102 1.00 0.00 C ATOM 594 OE1 GLU X 39 67.380 10.646 -8.128 1.00 0.00 O ATOM 595 OE2 GLU X 39 67.305 8.561 -8.748 1.00 0.00 O ATOM 0 H GLU X 39 65.151 6.810 -5.963 1.00 0.00 H new ATOM 0 HA GLU X 39 67.690 8.065 -5.975 1.00 0.00 H new ATOM 0 HB2 GLU X 39 64.916 9.035 -5.296 1.00 0.00 H new ATOM 0 HB3 GLU X 39 66.315 10.080 -5.445 1.00 0.00 H new ATOM 0 HG2 GLU X 39 65.088 8.411 -7.641 1.00 0.00 H new ATOM 0 HG3 GLU X 39 64.928 10.144 -7.437 1.00 0.00 H new ATOM 602 N HIS X 40 66.084 7.732 -3.122 1.00 0.00 N ATOM 603 CA HIS X 40 66.143 7.859 -1.681 1.00 0.00 C ATOM 604 C HIS X 40 67.329 7.108 -1.134 1.00 0.00 C ATOM 605 O HIS X 40 68.099 7.635 -0.348 1.00 0.00 O ATOM 606 CB HIS X 40 64.839 7.332 -1.064 1.00 0.00 C ATOM 607 CG HIS X 40 64.712 7.504 0.411 1.00 0.00 C ATOM 608 ND1 HIS X 40 64.002 8.522 1.004 1.00 0.00 N ATOM 609 CD2 HIS X 40 65.208 6.754 1.418 1.00 0.00 C ATOM 610 CE1 HIS X 40 64.090 8.363 2.318 1.00 0.00 C ATOM 611 NE2 HIS X 40 64.816 7.298 2.619 1.00 0.00 N ATOM 0 H HIS X 40 65.228 7.293 -3.461 1.00 0.00 H new ATOM 0 HA HIS X 40 66.259 8.911 -1.420 1.00 0.00 H new ATOM 0 HB2 HIS X 40 64.000 7.836 -1.545 1.00 0.00 H new ATOM 0 HB3 HIS X 40 64.750 6.271 -1.298 1.00 0.00 H new ATOM 0 HD1 HIS X 40 63.498 9.265 0.520 1.00 0.00 H new ATOM 0 HD2 HIS X 40 65.815 5.869 1.300 1.00 0.00 H new ATOM 0 HE1 HIS X 40 63.630 9.016 3.045 1.00 0.00 H new ATOM 619 N PHE X 41 67.490 5.919 -1.609 1.00 0.00 N ATOM 620 CA PHE X 41 68.558 5.065 -1.217 1.00 0.00 C ATOM 621 C PHE X 41 69.915 5.665 -1.594 1.00 0.00 C ATOM 622 O PHE X 41 70.822 5.727 -0.774 1.00 0.00 O ATOM 623 CB PHE X 41 68.331 3.694 -1.839 1.00 0.00 C ATOM 624 CG PHE X 41 69.517 2.806 -1.857 1.00 0.00 C ATOM 625 CD1 PHE X 41 69.905 2.107 -0.740 1.00 0.00 C ATOM 626 CD2 PHE X 41 70.248 2.674 -3.001 1.00 0.00 C ATOM 627 CE1 PHE X 41 71.017 1.288 -0.778 1.00 0.00 C ATOM 628 CE2 PHE X 41 71.344 1.867 -3.034 1.00 0.00 C ATOM 629 CZ PHE X 41 71.734 1.173 -1.933 1.00 0.00 C ATOM 0 H PHE X 41 66.865 5.504 -2.300 1.00 0.00 H new ATOM 0 HA PHE X 41 68.574 4.958 -0.132 1.00 0.00 H new ATOM 0 HB2 PHE X 41 67.530 3.194 -1.294 1.00 0.00 H new ATOM 0 HB3 PHE X 41 67.983 3.830 -2.863 1.00 0.00 H new ATOM 0 HD1 PHE X 41 69.337 2.198 0.174 1.00 0.00 H new ATOM 0 HD2 PHE X 41 69.955 3.215 -3.889 1.00 0.00 H new ATOM 0 HE1 PHE X 41 71.318 0.741 0.103 1.00 0.00 H new ATOM 0 HE2 PHE X 41 71.912 1.777 -3.948 1.00 0.00 H new ATOM 0 HZ PHE X 41 72.605 0.535 -1.972 1.00 0.00 H new ATOM 639 N VAL X 42 70.053 6.114 -2.811 1.00 0.00 N ATOM 640 CA VAL X 42 71.302 6.699 -3.248 1.00 0.00 C ATOM 641 C VAL X 42 71.617 8.032 -2.553 1.00 0.00 C ATOM 642 O VAL X 42 72.768 8.365 -2.342 1.00 0.00 O ATOM 643 CB VAL X 42 71.451 6.749 -4.791 1.00 0.00 C ATOM 644 CG1 VAL X 42 70.441 7.599 -5.464 1.00 0.00 C ATOM 645 CG2 VAL X 42 72.866 7.060 -5.247 1.00 0.00 C ATOM 0 H VAL X 42 69.321 6.089 -3.521 1.00 0.00 H new ATOM 0 HA VAL X 42 72.080 6.012 -2.915 1.00 0.00 H new ATOM 0 HB VAL X 42 71.241 5.731 -5.119 1.00 0.00 H new ATOM 0 HG11 VAL X 42 70.611 7.583 -6.541 1.00 0.00 H new ATOM 0 HG12 VAL X 42 69.443 7.218 -5.249 1.00 0.00 H new ATOM 0 HG13 VAL X 42 70.525 8.622 -5.099 1.00 0.00 H new ATOM 0 HG21 VAL X 42 72.901 7.080 -6.336 1.00 0.00 H new ATOM 0 HG22 VAL X 42 73.169 8.031 -4.856 1.00 0.00 H new ATOM 0 HG23 VAL X 42 73.545 6.292 -4.876 1.00 0.00 H new ATOM 655 N LYS X 43 70.601 8.780 -2.200 1.00 0.00 N ATOM 656 CA LYS X 43 70.814 10.074 -1.522 1.00 0.00 C ATOM 657 C LYS X 43 71.263 9.897 -0.071 1.00 0.00 C ATOM 658 O LYS X 43 72.039 10.691 0.441 1.00 0.00 O ATOM 659 CB LYS X 43 69.576 10.988 -1.593 1.00 0.00 C ATOM 660 CG LYS X 43 68.481 10.708 -0.549 1.00 0.00 C ATOM 661 CD LYS X 43 67.276 11.583 -0.791 1.00 0.00 C ATOM 662 CE LYS X 43 66.219 11.411 0.285 1.00 0.00 C ATOM 663 NZ LYS X 43 65.048 12.264 0.018 1.00 0.00 N ATOM 0 H LYS X 43 69.623 8.536 -2.360 1.00 0.00 H new ATOM 0 HA LYS X 43 71.619 10.565 -2.068 1.00 0.00 H new ATOM 0 HB2 LYS X 43 69.903 12.022 -1.481 1.00 0.00 H new ATOM 0 HB3 LYS X 43 69.137 10.898 -2.587 1.00 0.00 H new ATOM 0 HG2 LYS X 43 68.189 9.659 -0.593 1.00 0.00 H new ATOM 0 HG3 LYS X 43 68.872 10.888 0.452 1.00 0.00 H new ATOM 0 HD2 LYS X 43 67.588 12.627 -0.828 1.00 0.00 H new ATOM 0 HD3 LYS X 43 66.845 11.344 -1.763 1.00 0.00 H new ATOM 0 HE2 LYS X 43 65.909 10.367 0.332 1.00 0.00 H new ATOM 0 HE3 LYS X 43 66.642 11.662 1.258 1.00 0.00 H new ATOM 0 HZ1 LYS X 43 64.341 12.127 0.768 1.00 0.00 H new ATOM 0 HZ2 LYS X 43 65.342 13.261 -0.003 1.00 0.00 H new ATOM 0 HZ3 LYS X 43 64.633 12.006 -0.900 1.00 0.00 H new ATOM 677 N ILE X 44 70.766 8.886 0.587 1.00 0.00 N ATOM 678 CA ILE X 44 71.157 8.635 1.953 1.00 0.00 C ATOM 679 C ILE X 44 72.520 7.948 1.992 1.00 0.00 C ATOM 680 O ILE X 44 73.315 8.199 2.871 1.00 0.00 O ATOM 681 CB ILE X 44 70.075 7.816 2.723 1.00 0.00 C ATOM 682 CG1 ILE X 44 69.738 6.519 1.982 1.00 0.00 C ATOM 683 CG2 ILE X 44 68.817 8.666 2.904 1.00 0.00 C ATOM 684 CD1 ILE X 44 68.699 5.657 2.645 1.00 0.00 C ATOM 0 H ILE X 44 70.092 8.223 0.204 1.00 0.00 H new ATOM 0 HA ILE X 44 71.243 9.594 2.465 1.00 0.00 H new ATOM 0 HB ILE X 44 70.473 7.549 3.702 1.00 0.00 H new ATOM 0 HG12 ILE X 44 69.393 6.771 0.979 1.00 0.00 H new ATOM 0 HG13 ILE X 44 70.652 5.936 1.867 1.00 0.00 H new ATOM 0 HG21 ILE X 44 68.064 8.091 3.442 1.00 0.00 H new ATOM 0 HG22 ILE X 44 69.063 9.563 3.472 1.00 0.00 H new ATOM 0 HG23 ILE X 44 68.427 8.951 1.927 1.00 0.00 H new ATOM 0 HD11 ILE X 44 68.530 4.763 2.044 1.00 0.00 H new ATOM 0 HD12 ILE X 44 69.046 5.367 3.637 1.00 0.00 H new ATOM 0 HD13 ILE X 44 67.767 6.215 2.735 1.00 0.00 H new ATOM 696 N THR X 45 72.808 7.135 0.992 1.00 0.00 N ATOM 697 CA THR X 45 74.067 6.422 0.953 1.00 0.00 C ATOM 698 C THR X 45 75.181 7.275 0.377 1.00 0.00 C ATOM 699 O THR X 45 76.357 7.132 0.779 1.00 0.00 O ATOM 700 CB THR X 45 73.947 5.132 0.145 1.00 0.00 C ATOM 701 OG1 THR X 45 73.448 5.424 -1.173 1.00 0.00 O ATOM 702 CG2 THR X 45 73.006 4.179 0.831 1.00 0.00 C ATOM 0 H THR X 45 72.190 6.954 0.201 1.00 0.00 H new ATOM 0 HA THR X 45 74.317 6.176 1.985 1.00 0.00 H new ATOM 0 HB THR X 45 74.933 4.674 0.068 1.00 0.00 H new ATOM 0 HG1 THR X 45 72.472 5.333 -1.181 1.00 0.00 H new ATOM 0 HG21 THR X 45 72.927 3.262 0.247 1.00 0.00 H new ATOM 0 HG22 THR X 45 73.386 3.944 1.825 1.00 0.00 H new ATOM 0 HG23 THR X 45 72.022 4.639 0.918 1.00 0.00 H new ATOM 710 N GLU X 46 74.810 8.141 -0.593 1.00 0.00 N ATOM 711 CA GLU X 46 75.730 9.054 -1.269 1.00 0.00 C ATOM 712 C GLU X 46 76.799 8.264 -2.012 1.00 0.00 C ATOM 713 O GLU X 46 77.917 8.739 -2.258 1.00 0.00 O ATOM 714 CB GLU X 46 76.312 10.001 -0.244 1.00 0.00 C ATOM 715 CG GLU X 46 75.307 10.980 0.303 1.00 0.00 C ATOM 716 CD GLU X 46 75.107 12.173 -0.586 1.00 0.00 C ATOM 717 OE1 GLU X 46 74.684 12.026 -1.744 1.00 0.00 O ATOM 718 OE2 GLU X 46 75.364 13.300 -0.114 1.00 0.00 O ATOM 0 H GLU X 46 73.849 8.218 -0.925 1.00 0.00 H new ATOM 0 HA GLU X 46 75.205 9.647 -2.018 1.00 0.00 H new ATOM 0 HB2 GLU X 46 76.729 9.422 0.580 1.00 0.00 H new ATOM 0 HB3 GLU X 46 77.137 10.552 -0.696 1.00 0.00 H new ATOM 0 HG2 GLU X 46 74.352 10.473 0.442 1.00 0.00 H new ATOM 0 HG3 GLU X 46 75.635 11.317 1.286 1.00 0.00 H new ATOM 725 N HIS X 47 76.406 7.069 -2.405 1.00 0.00 N ATOM 726 CA HIS X 47 77.259 6.132 -3.082 1.00 0.00 C ATOM 727 C HIS X 47 77.204 6.456 -4.578 1.00 0.00 C ATOM 728 O HIS X 47 76.155 6.858 -5.069 1.00 0.00 O ATOM 729 CB HIS X 47 76.697 4.714 -2.844 1.00 0.00 C ATOM 730 CG HIS X 47 77.644 3.564 -3.098 1.00 0.00 C ATOM 731 ND1 HIS X 47 78.081 3.145 -4.341 1.00 0.00 N ATOM 732 CD2 HIS X 47 78.198 2.713 -2.219 1.00 0.00 C ATOM 733 CE1 HIS X 47 78.855 2.070 -4.167 1.00 0.00 C ATOM 734 NE2 HIS X 47 78.958 1.766 -2.899 1.00 0.00 N ATOM 0 H HIS X 47 75.459 6.720 -2.255 1.00 0.00 H new ATOM 0 HA HIS X 47 78.285 6.189 -2.719 1.00 0.00 H new ATOM 0 HB2 HIS X 47 76.353 4.652 -1.811 1.00 0.00 H new ATOM 0 HB3 HIS X 47 75.822 4.582 -3.480 1.00 0.00 H new ATOM 0 HD2 HIS X 47 78.073 2.757 -1.147 1.00 0.00 H new ATOM 0 HE1 HIS X 47 79.332 1.524 -4.967 1.00 0.00 H new ATOM 0 HE2 HIS X 47 79.486 0.994 -2.492 1.00 0.00 H new ATOM 742 N PRO X 48 78.303 6.280 -5.332 1.00 0.00 N ATOM 743 CA PRO X 48 78.339 6.535 -6.789 1.00 0.00 C ATOM 744 C PRO X 48 77.695 5.428 -7.589 1.00 0.00 C ATOM 745 O PRO X 48 77.838 5.349 -8.817 1.00 0.00 O ATOM 746 CB PRO X 48 79.815 6.508 -7.115 1.00 0.00 C ATOM 747 CG PRO X 48 80.526 6.550 -5.831 1.00 0.00 C ATOM 748 CD PRO X 48 79.623 5.883 -4.852 1.00 0.00 C ATOM 0 HA PRO X 48 77.813 7.459 -7.029 1.00 0.00 H new ATOM 0 HB2 PRO X 48 80.073 5.607 -7.672 1.00 0.00 H new ATOM 0 HB3 PRO X 48 80.090 7.358 -7.739 1.00 0.00 H new ATOM 0 HG2 PRO X 48 81.484 6.034 -5.896 1.00 0.00 H new ATOM 0 HG3 PRO X 48 80.737 7.577 -5.533 1.00 0.00 H new ATOM 0 HD2 PRO X 48 79.749 4.800 -4.854 1.00 0.00 H new ATOM 0 HD3 PRO X 48 79.805 6.223 -3.833 1.00 0.00 H new ATOM 756 N ASP X 49 77.001 4.587 -6.928 1.00 0.00 N ATOM 757 CA ASP X 49 76.416 3.492 -7.584 1.00 0.00 C ATOM 758 C ASP X 49 74.970 3.535 -7.314 1.00 0.00 C ATOM 759 O ASP X 49 74.173 3.754 -8.216 1.00 0.00 O ATOM 760 CB ASP X 49 77.026 2.132 -7.174 1.00 0.00 C ATOM 761 CG ASP X 49 78.333 1.806 -7.875 1.00 0.00 C ATOM 762 OD1 ASP X 49 79.318 2.541 -7.698 1.00 0.00 O ATOM 763 OD2 ASP X 49 78.380 0.816 -8.629 1.00 0.00 O ATOM 0 H ASP X 49 76.824 4.638 -5.925 1.00 0.00 H new ATOM 0 HA ASP X 49 76.616 3.574 -8.652 1.00 0.00 H new ATOM 0 HB2 ASP X 49 77.193 2.130 -6.097 1.00 0.00 H new ATOM 0 HB3 ASP X 49 76.305 1.343 -7.386 1.00 0.00 H new ATOM 768 N GLY X 50 74.653 3.369 -6.024 1.00 0.00 N ATOM 769 CA GLY X 50 73.341 3.412 -5.479 1.00 0.00 C ATOM 770 C GLY X 50 72.482 2.439 -6.075 1.00 0.00 C ATOM 771 O GLY X 50 72.408 1.303 -5.655 1.00 0.00 O ATOM 0 H GLY X 50 75.364 3.193 -5.314 1.00 0.00 H new ATOM 0 HA2 GLY X 50 73.390 3.242 -4.403 1.00 0.00 H new ATOM 0 HA3 GLY X 50 72.920 4.406 -5.626 1.00 0.00 H new ATOM 775 N THR X 51 71.986 2.825 -7.110 1.00 0.00 N ATOM 776 CA THR X 51 70.991 2.115 -7.790 1.00 0.00 C ATOM 777 C THR X 51 71.599 0.855 -8.398 1.00 0.00 C ATOM 778 O THR X 51 71.006 -0.229 -8.346 1.00 0.00 O ATOM 779 CB THR X 51 70.384 2.990 -8.847 1.00 0.00 C ATOM 780 OG1 THR X 51 70.581 4.362 -8.436 1.00 0.00 O ATOM 781 CG2 THR X 51 68.910 2.706 -8.892 1.00 0.00 C ATOM 0 H THR X 51 72.254 3.697 -7.567 1.00 0.00 H new ATOM 0 HA THR X 51 70.201 1.819 -7.099 1.00 0.00 H new ATOM 0 HB THR X 51 70.833 2.810 -9.824 1.00 0.00 H new ATOM 0 HG1 THR X 51 70.196 4.963 -9.108 1.00 0.00 H new ATOM 0 HG21 THR X 51 68.442 3.330 -9.654 1.00 0.00 H new ATOM 0 HG22 THR X 51 68.749 1.656 -9.134 1.00 0.00 H new ATOM 0 HG23 THR X 51 68.467 2.926 -7.921 1.00 0.00 H new ATOM 789 N ALA X 52 72.839 1.001 -8.874 1.00 0.00 N ATOM 790 CA ALA X 52 73.611 -0.103 -9.408 1.00 0.00 C ATOM 791 C ALA X 52 73.826 -1.151 -8.339 1.00 0.00 C ATOM 792 O ALA X 52 73.858 -2.338 -8.642 1.00 0.00 O ATOM 793 CB ALA X 52 74.930 0.391 -9.975 1.00 0.00 C ATOM 0 H ALA X 52 73.329 1.895 -8.896 1.00 0.00 H new ATOM 0 HA ALA X 52 73.054 -0.562 -10.225 1.00 0.00 H new ATOM 0 HB1 ALA X 52 75.495 -0.453 -10.371 1.00 0.00 H new ATOM 0 HB2 ALA X 52 74.737 1.106 -10.775 1.00 0.00 H new ATOM 0 HB3 ALA X 52 75.506 0.875 -9.187 1.00 0.00 H new ATOM 799 N LEU X 53 73.905 -0.709 -7.076 1.00 0.00 N ATOM 800 CA LEU X 53 74.039 -1.633 -5.956 1.00 0.00 C ATOM 801 C LEU X 53 72.823 -2.519 -5.810 1.00 0.00 C ATOM 802 O LEU X 53 72.974 -3.702 -5.580 1.00 0.00 O ATOM 803 CB LEU X 53 74.307 -0.942 -4.626 1.00 0.00 C ATOM 804 CG LEU X 53 75.622 -0.195 -4.481 1.00 0.00 C ATOM 805 CD1 LEU X 53 75.791 0.234 -3.060 1.00 0.00 C ATOM 806 CD2 LEU X 53 76.804 -1.040 -4.934 1.00 0.00 C ATOM 0 H LEU X 53 73.878 0.276 -6.812 1.00 0.00 H new ATOM 0 HA LEU X 53 74.911 -2.240 -6.200 1.00 0.00 H new ATOM 0 HB2 LEU X 53 73.496 -0.237 -4.443 1.00 0.00 H new ATOM 0 HB3 LEU X 53 74.258 -1.695 -3.839 1.00 0.00 H new ATOM 0 HG LEU X 53 75.594 0.683 -5.126 1.00 0.00 H new ATOM 0 HD11 LEU X 53 76.734 0.770 -2.952 1.00 0.00 H new ATOM 0 HD12 LEU X 53 74.966 0.888 -2.777 1.00 0.00 H new ATOM 0 HD13 LEU X 53 75.796 -0.643 -2.413 1.00 0.00 H new ATOM 0 HD21 LEU X 53 77.726 -0.470 -4.815 1.00 0.00 H new ATOM 0 HD22 LEU X 53 76.857 -1.946 -4.330 1.00 0.00 H new ATOM 0 HD23 LEU X 53 76.678 -1.310 -5.982 1.00 0.00 H new ATOM 818 N ILE X 54 71.606 -1.961 -5.958 1.00 0.00 N ATOM 819 CA ILE X 54 70.394 -2.823 -5.816 1.00 0.00 C ATOM 820 C ILE X 54 70.374 -3.788 -6.958 1.00 0.00 C ATOM 821 O ILE X 54 70.119 -4.979 -6.803 1.00 0.00 O ATOM 822 CB ILE X 54 69.002 -2.089 -5.801 1.00 0.00 C ATOM 823 CG1 ILE X 54 68.916 -1.015 -4.739 1.00 0.00 C ATOM 824 CG2 ILE X 54 67.856 -3.084 -5.602 1.00 0.00 C ATOM 825 CD1 ILE X 54 69.382 0.313 -5.216 1.00 0.00 C ATOM 0 H ILE X 54 71.428 -0.978 -6.164 1.00 0.00 H new ATOM 0 HA ILE X 54 70.494 -3.284 -4.833 1.00 0.00 H new ATOM 0 HB ILE X 54 68.909 -1.608 -6.775 1.00 0.00 H new ATOM 0 HG12 ILE X 54 67.884 -0.931 -4.398 1.00 0.00 H new ATOM 0 HG13 ILE X 54 69.513 -1.315 -3.878 1.00 0.00 H new ATOM 0 HG21 ILE X 54 66.906 -2.549 -5.596 1.00 0.00 H new ATOM 0 HG22 ILE X 54 67.858 -3.809 -6.416 1.00 0.00 H new ATOM 0 HG23 ILE X 54 67.986 -3.603 -4.653 1.00 0.00 H new ATOM 0 HD11 ILE X 54 69.296 1.040 -4.409 1.00 0.00 H new ATOM 0 HD12 ILE X 54 70.423 0.242 -5.530 1.00 0.00 H new ATOM 0 HD13 ILE X 54 68.769 0.632 -6.059 1.00 0.00 H new ATOM 837 N TYR X 55 70.697 -3.261 -8.104 1.00 0.00 N ATOM 838 CA TYR X 55 70.697 -4.014 -9.299 1.00 0.00 C ATOM 839 C TYR X 55 71.696 -5.180 -9.268 1.00 0.00 C ATOM 840 O TYR X 55 71.366 -6.288 -9.698 1.00 0.00 O ATOM 841 CB TYR X 55 70.840 -3.106 -10.505 1.00 0.00 C ATOM 842 CG TYR X 55 69.584 -2.287 -10.774 1.00 0.00 C ATOM 843 CD1 TYR X 55 68.332 -2.900 -10.829 1.00 0.00 C ATOM 844 CD2 TYR X 55 69.640 -0.912 -10.955 1.00 0.00 C ATOM 845 CE1 TYR X 55 67.184 -2.168 -11.048 1.00 0.00 C ATOM 846 CE2 TYR X 55 68.491 -0.175 -11.181 1.00 0.00 C ATOM 847 CZ TYR X 55 67.266 -0.808 -11.222 1.00 0.00 C ATOM 848 OH TYR X 55 66.115 -0.072 -11.429 1.00 0.00 O ATOM 0 H TYR X 55 70.969 -2.285 -8.223 1.00 0.00 H new ATOM 0 HA TYR X 55 69.726 -4.500 -9.391 1.00 0.00 H new ATOM 0 HB2 TYR X 55 71.682 -2.432 -10.350 1.00 0.00 H new ATOM 0 HB3 TYR X 55 71.071 -3.708 -11.383 1.00 0.00 H new ATOM 0 HD1 TYR X 55 68.260 -3.970 -10.697 1.00 0.00 H new ATOM 0 HD2 TYR X 55 70.595 -0.410 -10.919 1.00 0.00 H new ATOM 0 HE1 TYR X 55 66.224 -2.662 -11.083 1.00 0.00 H new ATOM 0 HE2 TYR X 55 68.553 0.894 -11.325 1.00 0.00 H new ATOM 0 HH TYR X 55 66.346 0.875 -11.532 1.00 0.00 H new ATOM 858 N GLU X 56 72.895 -4.957 -8.740 1.00 0.00 N ATOM 859 CA GLU X 56 73.819 -6.066 -8.558 1.00 0.00 C ATOM 860 C GLU X 56 73.360 -6.973 -7.431 1.00 0.00 C ATOM 861 O GLU X 56 73.480 -8.180 -7.532 1.00 0.00 O ATOM 862 CB GLU X 56 75.283 -5.650 -8.351 1.00 0.00 C ATOM 863 CG GLU X 56 75.514 -4.551 -7.338 1.00 0.00 C ATOM 864 CD GLU X 56 76.958 -4.423 -6.948 1.00 0.00 C ATOM 865 OE1 GLU X 56 77.711 -3.733 -7.655 1.00 0.00 O ATOM 866 OE2 GLU X 56 77.383 -5.037 -5.941 1.00 0.00 O ATOM 0 H GLU X 56 73.241 -4.046 -8.439 1.00 0.00 H new ATOM 0 HA GLU X 56 73.799 -6.612 -9.501 1.00 0.00 H new ATOM 0 HB2 GLU X 56 75.851 -6.528 -8.044 1.00 0.00 H new ATOM 0 HB3 GLU X 56 75.689 -5.327 -9.310 1.00 0.00 H new ATOM 0 HG2 GLU X 56 75.167 -3.603 -7.749 1.00 0.00 H new ATOM 0 HG3 GLU X 56 74.917 -4.750 -6.448 1.00 0.00 H new ATOM 873 N ALA X 57 72.802 -6.384 -6.375 1.00 0.00 N ATOM 874 CA ALA X 57 72.315 -7.127 -5.217 1.00 0.00 C ATOM 875 C ALA X 57 71.270 -8.143 -5.617 1.00 0.00 C ATOM 876 O ALA X 57 71.262 -9.238 -5.103 1.00 0.00 O ATOM 877 CB ALA X 57 71.762 -6.195 -4.152 1.00 0.00 C ATOM 0 H ALA X 57 72.675 -5.375 -6.299 1.00 0.00 H new ATOM 0 HA ALA X 57 73.168 -7.659 -4.795 1.00 0.00 H new ATOM 0 HB1 ALA X 57 71.408 -6.781 -3.304 1.00 0.00 H new ATOM 0 HB2 ALA X 57 72.547 -5.515 -3.821 1.00 0.00 H new ATOM 0 HB3 ALA X 57 70.934 -5.620 -4.566 1.00 0.00 H new ATOM 883 N ALA X 58 70.406 -7.770 -6.545 1.00 0.00 N ATOM 884 CA ALA X 58 69.376 -8.667 -7.064 1.00 0.00 C ATOM 885 C ALA X 58 69.999 -9.893 -7.760 1.00 0.00 C ATOM 886 O ALA X 58 69.491 -11.015 -7.645 1.00 0.00 O ATOM 887 CB ALA X 58 68.455 -7.919 -8.015 1.00 0.00 C ATOM 0 H ALA X 58 70.395 -6.839 -6.962 1.00 0.00 H new ATOM 0 HA ALA X 58 68.788 -9.030 -6.221 1.00 0.00 H new ATOM 0 HB1 ALA X 58 67.693 -8.600 -8.394 1.00 0.00 H new ATOM 0 HB2 ALA X 58 67.976 -7.096 -7.485 1.00 0.00 H new ATOM 0 HB3 ALA X 58 69.036 -7.524 -8.849 1.00 0.00 H new ATOM 893 N ALA X 59 71.102 -9.675 -8.468 1.00 0.00 N ATOM 894 CA ALA X 59 71.835 -10.764 -9.125 1.00 0.00 C ATOM 895 C ALA X 59 72.572 -11.596 -8.073 1.00 0.00 C ATOM 896 O ALA X 59 72.555 -12.832 -8.091 1.00 0.00 O ATOM 897 CB ALA X 59 72.809 -10.204 -10.149 1.00 0.00 C ATOM 0 H ALA X 59 71.514 -8.752 -8.605 1.00 0.00 H new ATOM 0 HA ALA X 59 71.128 -11.407 -9.649 1.00 0.00 H new ATOM 0 HB1 ALA X 59 73.345 -11.024 -10.628 1.00 0.00 H new ATOM 0 HB2 ALA X 59 72.260 -9.640 -10.903 1.00 0.00 H new ATOM 0 HB3 ALA X 59 73.522 -9.546 -9.652 1.00 0.00 H new ATOM 903 N ARG X 60 73.181 -10.885 -7.138 1.00 0.00 N ATOM 904 CA ARG X 60 73.880 -11.448 -5.981 1.00 0.00 C ATOM 905 C ARG X 60 72.907 -12.258 -5.109 1.00 0.00 C ATOM 906 O ARG X 60 73.305 -13.109 -4.343 1.00 0.00 O ATOM 907 CB ARG X 60 74.599 -10.335 -5.184 1.00 0.00 C ATOM 908 CG ARG X 60 75.711 -9.644 -5.976 1.00 0.00 C ATOM 909 CD ARG X 60 76.244 -8.385 -5.283 1.00 0.00 C ATOM 910 NE ARG X 60 76.878 -8.658 -3.991 1.00 0.00 N ATOM 911 CZ ARG X 60 77.651 -7.789 -3.313 1.00 0.00 C ATOM 912 NH1 ARG X 60 77.912 -6.570 -3.813 1.00 0.00 N ATOM 913 NH2 ARG X 60 78.159 -8.137 -2.129 1.00 0.00 N ATOM 0 H ARG X 60 73.206 -9.866 -7.159 1.00 0.00 H new ATOM 0 HA ARG X 60 74.650 -12.137 -6.330 1.00 0.00 H new ATOM 0 HB2 ARG X 60 73.867 -9.590 -4.873 1.00 0.00 H new ATOM 0 HB3 ARG X 60 75.022 -10.764 -4.276 1.00 0.00 H new ATOM 0 HG2 ARG X 60 76.532 -10.345 -6.126 1.00 0.00 H new ATOM 0 HG3 ARG X 60 75.335 -9.377 -6.964 1.00 0.00 H new ATOM 0 HD2 ARG X 60 76.966 -7.896 -5.938 1.00 0.00 H new ATOM 0 HD3 ARG X 60 75.422 -7.684 -5.136 1.00 0.00 H new ATOM 0 HE ARG X 60 76.722 -9.576 -3.574 1.00 0.00 H new ATOM 0 HH11 ARG X 60 77.523 -6.295 -4.715 1.00 0.00 H new ATOM 0 HH12 ARG X 60 78.499 -5.920 -3.291 1.00 0.00 H new ATOM 0 HH21 ARG X 60 77.961 -9.059 -1.740 1.00 0.00 H new ATOM 0 HH22 ARG X 60 78.745 -7.481 -1.613 1.00 0.00 H new ATOM 927 N ALA X 61 71.648 -11.879 -5.152 1.00 0.00 N ATOM 928 CA ALA X 61 70.578 -12.596 -4.488 1.00 0.00 C ATOM 929 C ALA X 61 70.378 -13.966 -5.115 1.00 0.00 C ATOM 930 O ALA X 61 70.295 -14.983 -4.402 1.00 0.00 O ATOM 931 CB ALA X 61 69.289 -11.811 -4.590 1.00 0.00 C ATOM 0 H ALA X 61 71.333 -11.051 -5.657 1.00 0.00 H new ATOM 0 HA ALA X 61 70.852 -12.721 -3.440 1.00 0.00 H new ATOM 0 HB1 ALA X 61 68.490 -12.357 -4.088 1.00 0.00 H new ATOM 0 HB2 ALA X 61 69.417 -10.838 -4.116 1.00 0.00 H new ATOM 0 HB3 ALA X 61 69.030 -11.672 -5.640 1.00 0.00 H new ATOM 937 N ALA X 62 70.304 -13.996 -6.444 1.00 0.00 N ATOM 938 CA ALA X 62 70.092 -15.236 -7.166 1.00 0.00 C ATOM 939 C ALA X 62 71.304 -16.132 -7.008 1.00 0.00 C ATOM 940 O ALA X 62 71.188 -17.287 -6.594 1.00 0.00 O ATOM 941 CB ALA X 62 69.809 -14.959 -8.637 1.00 0.00 C ATOM 0 H ALA X 62 70.389 -13.171 -7.038 1.00 0.00 H new ATOM 0 HA ALA X 62 69.223 -15.745 -6.750 1.00 0.00 H new ATOM 0 HB1 ALA X 62 69.653 -15.902 -9.161 1.00 0.00 H new ATOM 0 HB2 ALA X 62 68.915 -14.342 -8.726 1.00 0.00 H new ATOM 0 HB3 ALA X 62 70.657 -14.435 -9.078 1.00 0.00 H new ATOM 947 N ALA X 63 72.464 -15.579 -7.259 1.00 0.00 N ATOM 948 CA ALA X 63 73.692 -16.300 -7.068 1.00 0.00 C ATOM 949 C ALA X 63 74.342 -15.828 -5.788 1.00 0.00 C ATOM 950 O ALA X 63 75.327 -15.078 -5.803 1.00 0.00 O ATOM 951 CB ALA X 63 74.634 -16.138 -8.253 1.00 0.00 C ATOM 0 H ALA X 63 72.581 -14.624 -7.599 1.00 0.00 H new ATOM 0 HA ALA X 63 73.468 -17.364 -6.994 1.00 0.00 H new ATOM 0 HB1 ALA X 63 75.550 -16.699 -8.069 1.00 0.00 H new ATOM 0 HB2 ALA X 63 74.153 -16.516 -9.155 1.00 0.00 H new ATOM 0 HB3 ALA X 63 74.874 -15.083 -8.385 1.00 0.00 H new ATOM 957 N ASN X 64 73.741 -16.204 -4.682 1.00 0.00 N ATOM 958 CA ASN X 64 74.226 -15.796 -3.386 1.00 0.00 C ATOM 959 C ASN X 64 75.323 -16.686 -2.924 1.00 0.00 C ATOM 960 O ASN X 64 75.153 -17.909 -2.868 1.00 0.00 O ATOM 961 CB ASN X 64 73.112 -15.701 -2.335 1.00 0.00 C ATOM 962 CG ASN X 64 72.338 -16.986 -2.076 1.00 0.00 C ATOM 963 OD1 ASN X 64 72.693 -17.774 -1.206 1.00 0.00 O ATOM 964 ND2 ASN X 64 71.253 -17.180 -2.784 1.00 0.00 N ATOM 0 H ASN X 64 72.910 -16.795 -4.656 1.00 0.00 H new ATOM 0 HA ASN X 64 74.624 -14.788 -3.506 1.00 0.00 H new ATOM 0 HB2 ASN X 64 73.552 -15.368 -1.395 1.00 0.00 H new ATOM 0 HB3 ASN X 64 72.407 -14.931 -2.648 1.00 0.00 H new ATOM 0 HD21 ASN X 64 70.677 -18.005 -2.619 1.00 0.00 H new ATOM 0 HD22 ASN X 64 70.984 -16.506 -3.501 1.00 0.00 H new ATOM 971 N PRO X 65 76.492 -16.133 -2.659 1.00 0.00 N ATOM 972 CA PRO X 65 77.576 -16.914 -2.173 1.00 0.00 C ATOM 973 C PRO X 65 77.421 -17.206 -0.668 1.00 0.00 C ATOM 974 O PRO X 65 77.192 -18.359 -0.263 1.00 0.00 O ATOM 975 CB PRO X 65 78.835 -16.079 -2.479 1.00 0.00 C ATOM 976 CG PRO X 65 78.341 -14.841 -3.175 1.00 0.00 C ATOM 977 CD PRO X 65 76.880 -14.733 -2.871 1.00 0.00 C ATOM 0 HA PRO X 65 77.626 -17.894 -2.647 1.00 0.00 H new ATOM 0 HB2 PRO X 65 79.370 -15.827 -1.563 1.00 0.00 H new ATOM 0 HB3 PRO X 65 79.529 -16.633 -3.111 1.00 0.00 H new ATOM 0 HG2 PRO X 65 78.876 -13.959 -2.823 1.00 0.00 H new ATOM 0 HG3 PRO X 65 78.509 -14.908 -4.250 1.00 0.00 H new ATOM 0 HD2 PRO X 65 76.694 -14.123 -1.987 1.00 0.00 H new ATOM 0 HD3 PRO X 65 76.327 -14.279 -3.694 1.00 0.00 H new ATOM 985 N GLY X 66 77.514 -16.176 0.140 1.00 0.00 N ATOM 986 CA GLY X 66 77.326 -16.321 1.544 1.00 0.00 C ATOM 987 C GLY X 66 76.528 -15.195 2.073 1.00 0.00 C ATOM 988 O GLY X 66 75.577 -14.720 1.423 1.00 0.00 O ATOM 0 H GLY X 66 77.721 -15.225 -0.165 1.00 0.00 H new ATOM 0 HA2 GLY X 66 76.822 -17.264 1.755 1.00 0.00 H new ATOM 0 HA3 GLY X 66 78.293 -16.358 2.046 1.00 0.00 H new ATOM 992 N GLY X 67 76.931 -14.725 3.206 1.00 0.00 N ATOM 993 CA GLY X 67 76.292 -13.626 3.843 1.00 0.00 C ATOM 994 C GLY X 67 76.875 -12.329 3.355 1.00 0.00 C ATOM 995 O GLY X 67 77.472 -11.553 4.115 1.00 0.00 O ATOM 0 H GLY X 67 77.726 -15.101 3.722 1.00 0.00 H new ATOM 0 HA2 GLY X 67 75.222 -13.651 3.639 1.00 0.00 H new ATOM 0 HA3 GLY X 67 76.412 -13.703 4.924 1.00 0.00 H new ATOM 999 N ASP X 68 76.744 -12.136 2.077 1.00 0.00 N ATOM 1000 CA ASP X 68 77.276 -10.990 1.363 1.00 0.00 C ATOM 1001 C ASP X 68 76.352 -10.670 0.202 1.00 0.00 C ATOM 1002 O ASP X 68 76.239 -9.525 -0.224 1.00 0.00 O ATOM 1003 CB ASP X 68 78.686 -11.299 0.827 1.00 0.00 C ATOM 1004 CG ASP X 68 78.688 -12.341 -0.275 1.00 0.00 C ATOM 1005 OD1 ASP X 68 78.394 -13.529 0.007 1.00 0.00 O ATOM 1006 OD2 ASP X 68 78.971 -11.987 -1.424 1.00 0.00 O ATOM 0 H ASP X 68 76.248 -12.790 1.472 1.00 0.00 H new ATOM 0 HA ASP X 68 77.341 -10.139 2.041 1.00 0.00 H new ATOM 0 HB2 ASP X 68 79.135 -10.380 0.451 1.00 0.00 H new ATOM 0 HB3 ASP X 68 79.313 -11.646 1.649 1.00 0.00 H new ATOM 1011 N GLY X 69 75.726 -11.703 -0.330 1.00 0.00 N ATOM 1012 CA GLY X 69 74.746 -11.530 -1.349 1.00 0.00 C ATOM 1013 C GLY X 69 73.385 -11.622 -0.741 1.00 0.00 C ATOM 1014 O GLY X 69 73.103 -10.950 0.255 1.00 0.00 O ATOM 0 H GLY X 69 75.891 -12.673 -0.061 1.00 0.00 H new ATOM 0 HA2 GLY X 69 74.876 -10.563 -1.835 1.00 0.00 H new ATOM 0 HA3 GLY X 69 74.866 -12.292 -2.119 1.00 0.00 H new ATOM 1018 N GLY X 70 72.529 -12.427 -1.310 1.00 0.00 N ATOM 1019 CA GLY X 70 71.215 -12.629 -0.727 1.00 0.00 C ATOM 1020 C GLY X 70 70.217 -11.621 -1.213 1.00 0.00 C ATOM 1021 O GLY X 70 69.024 -11.877 -1.220 1.00 0.00 O ATOM 0 H GLY X 70 72.707 -12.952 -2.167 1.00 0.00 H new ATOM 0 HA2 GLY X 70 70.863 -13.632 -0.969 1.00 0.00 H new ATOM 0 HA3 GLY X 70 71.289 -12.570 0.359 1.00 0.00 H new ATOM 1025 N GLY X 71 70.708 -10.481 -1.598 1.00 0.00 N ATOM 1026 CA GLY X 71 69.901 -9.452 -2.126 1.00 0.00 C ATOM 1027 C GLY X 71 69.937 -8.259 -1.238 1.00 0.00 C ATOM 1028 O GLY X 71 70.966 -7.572 -1.172 1.00 0.00 O ATOM 0 H GLY X 71 71.700 -10.248 -1.548 1.00 0.00 H new ATOM 0 HA2 GLY X 71 70.250 -9.182 -3.123 1.00 0.00 H new ATOM 0 HA3 GLY X 71 68.875 -9.804 -2.232 1.00 0.00 H new ATOM 1032 N PRO X 72 68.888 -8.057 -0.443 1.00 0.00 N ATOM 1033 CA PRO X 72 68.751 -6.883 0.407 1.00 0.00 C ATOM 1034 C PRO X 72 69.820 -6.813 1.464 1.00 0.00 C ATOM 1035 O PRO X 72 70.284 -5.741 1.818 1.00 0.00 O ATOM 1036 CB PRO X 72 67.374 -7.038 1.049 1.00 0.00 C ATOM 1037 CG PRO X 72 67.027 -8.480 0.906 1.00 0.00 C ATOM 1038 CD PRO X 72 67.759 -8.985 -0.298 1.00 0.00 C ATOM 0 HA PRO X 72 68.855 -5.963 -0.168 1.00 0.00 H new ATOM 0 HB2 PRO X 72 67.395 -6.742 2.098 1.00 0.00 H new ATOM 0 HB3 PRO X 72 66.637 -6.406 0.554 1.00 0.00 H new ATOM 0 HG2 PRO X 72 67.317 -9.037 1.797 1.00 0.00 H new ATOM 0 HG3 PRO X 72 65.951 -8.608 0.786 1.00 0.00 H new ATOM 0 HD2 PRO X 72 68.101 -10.010 -0.156 1.00 0.00 H new ATOM 0 HD3 PRO X 72 67.123 -8.981 -1.183 1.00 0.00 H new ATOM 1046 N GLU X 73 70.266 -7.958 1.892 1.00 0.00 N ATOM 1047 CA GLU X 73 71.206 -8.052 2.988 1.00 0.00 C ATOM 1048 C GLU X 73 72.612 -7.714 2.518 1.00 0.00 C ATOM 1049 O GLU X 73 73.525 -7.515 3.335 1.00 0.00 O ATOM 1050 CB GLU X 73 71.189 -9.459 3.584 1.00 0.00 C ATOM 1051 CG GLU X 73 69.799 -10.081 3.735 1.00 0.00 C ATOM 1052 CD GLU X 73 68.890 -9.302 4.637 1.00 0.00 C ATOM 1053 OE1 GLU X 73 69.164 -9.228 5.857 1.00 0.00 O ATOM 1054 OE2 GLU X 73 67.887 -8.753 4.150 1.00 0.00 O ATOM 0 H GLU X 73 69.993 -8.857 1.496 1.00 0.00 H new ATOM 0 HA GLU X 73 70.907 -7.335 3.753 1.00 0.00 H new ATOM 0 HB2 GLU X 73 71.796 -10.111 2.955 1.00 0.00 H new ATOM 0 HB3 GLU X 73 71.665 -9.428 4.564 1.00 0.00 H new ATOM 0 HG2 GLU X 73 69.338 -10.164 2.751 1.00 0.00 H new ATOM 0 HG3 GLU X 73 69.903 -11.094 4.124 1.00 0.00 H new ATOM 1061 N GLY X 74 72.795 -7.636 1.230 1.00 0.00 N ATOM 1062 CA GLY X 74 74.091 -7.331 0.757 1.00 0.00 C ATOM 1063 C GLY X 74 74.251 -5.912 0.383 1.00 0.00 C ATOM 1064 O GLY X 74 75.331 -5.377 0.512 1.00 0.00 O ATOM 0 H GLY X 74 72.079 -7.777 0.517 1.00 0.00 H new ATOM 0 HA2 GLY X 74 74.821 -7.582 1.527 1.00 0.00 H new ATOM 0 HA3 GLY X 74 74.312 -7.956 -0.108 1.00 0.00 H new ATOM 1068 N ILE X 75 73.171 -5.273 -0.041 1.00 0.00 N ATOM 1069 CA ILE X 75 73.224 -3.847 -0.385 1.00 0.00 C ATOM 1070 C ILE X 75 73.641 -3.067 0.849 1.00 0.00 C ATOM 1071 O ILE X 75 74.508 -2.213 0.798 1.00 0.00 O ATOM 1072 CB ILE X 75 71.864 -3.285 -0.873 1.00 0.00 C ATOM 1073 CG1 ILE X 75 70.802 -4.386 -0.972 1.00 0.00 C ATOM 1074 CG2 ILE X 75 72.042 -2.580 -2.206 1.00 0.00 C ATOM 1075 CD1 ILE X 75 69.422 -3.892 -1.346 1.00 0.00 C ATOM 0 H ILE X 75 72.255 -5.706 -0.157 1.00 0.00 H new ATOM 0 HA ILE X 75 73.937 -3.741 -1.203 1.00 0.00 H new ATOM 0 HB ILE X 75 71.510 -2.563 -0.137 1.00 0.00 H new ATOM 0 HG12 ILE X 75 71.125 -5.120 -1.711 1.00 0.00 H new ATOM 0 HG13 ILE X 75 70.742 -4.903 -0.014 1.00 0.00 H new ATOM 0 HG21 ILE X 75 71.082 -2.188 -2.542 1.00 0.00 H new ATOM 0 HG22 ILE X 75 72.749 -1.758 -2.092 1.00 0.00 H new ATOM 0 HG23 ILE X 75 72.423 -3.287 -2.943 1.00 0.00 H new ATOM 0 HD11 ILE X 75 68.734 -4.736 -1.394 1.00 0.00 H new ATOM 0 HD12 ILE X 75 69.074 -3.182 -0.596 1.00 0.00 H new ATOM 0 HD13 ILE X 75 69.462 -3.402 -2.319 1.00 0.00 H new ATOM 1087 N VAL X 76 73.040 -3.435 1.966 1.00 0.00 N ATOM 1088 CA VAL X 76 73.320 -2.839 3.254 1.00 0.00 C ATOM 1089 C VAL X 76 74.742 -3.073 3.686 1.00 0.00 C ATOM 1090 O VAL X 76 75.423 -2.168 4.167 1.00 0.00 O ATOM 1091 CB VAL X 76 72.325 -3.366 4.307 1.00 0.00 C ATOM 1092 CG1 VAL X 76 72.076 -4.826 4.271 1.00 0.00 C ATOM 1093 CG2 VAL X 76 72.473 -2.780 5.697 1.00 0.00 C ATOM 0 H VAL X 76 72.332 -4.169 2.001 1.00 0.00 H new ATOM 0 HA VAL X 76 73.194 -1.760 3.159 1.00 0.00 H new ATOM 0 HB VAL X 76 71.381 -2.944 3.963 1.00 0.00 H new ATOM 0 HG11 VAL X 76 71.363 -5.093 5.051 1.00 0.00 H new ATOM 0 HG12 VAL X 76 71.670 -5.102 3.298 1.00 0.00 H new ATOM 0 HG13 VAL X 76 73.012 -5.359 4.438 1.00 0.00 H new ATOM 0 HG21 VAL X 76 71.726 -3.218 6.358 1.00 0.00 H new ATOM 0 HG22 VAL X 76 73.470 -2.999 6.080 1.00 0.00 H new ATOM 0 HG23 VAL X 76 72.330 -1.700 5.654 1.00 0.00 H new ATOM 1103 N LYS X 77 75.176 -4.273 3.492 1.00 0.00 N ATOM 1104 CA LYS X 77 76.541 -4.659 3.811 1.00 0.00 C ATOM 1105 C LYS X 77 77.551 -3.846 2.972 1.00 0.00 C ATOM 1106 O LYS X 77 78.538 -3.337 3.498 1.00 0.00 O ATOM 1107 CB LYS X 77 76.761 -6.157 3.612 1.00 0.00 C ATOM 1108 CG LYS X 77 78.102 -6.641 4.126 1.00 0.00 C ATOM 1109 CD LYS X 77 78.275 -8.129 3.925 1.00 0.00 C ATOM 1110 CE LYS X 77 79.582 -8.601 4.533 1.00 0.00 C ATOM 1111 NZ LYS X 77 79.790 -10.051 4.347 1.00 0.00 N ATOM 0 H LYS X 77 74.606 -5.027 3.108 1.00 0.00 H new ATOM 0 HA LYS X 77 76.707 -4.436 4.865 1.00 0.00 H new ATOM 0 HB2 LYS X 77 75.967 -6.704 4.120 1.00 0.00 H new ATOM 0 HB3 LYS X 77 76.681 -6.391 2.550 1.00 0.00 H new ATOM 0 HG2 LYS X 77 78.902 -6.109 3.611 1.00 0.00 H new ATOM 0 HG3 LYS X 77 78.192 -6.404 5.186 1.00 0.00 H new ATOM 0 HD2 LYS X 77 77.441 -8.663 4.382 1.00 0.00 H new ATOM 0 HD3 LYS X 77 78.258 -8.362 2.860 1.00 0.00 H new ATOM 0 HE2 LYS X 77 80.410 -8.056 4.080 1.00 0.00 H new ATOM 0 HE3 LYS X 77 79.591 -8.368 5.598 1.00 0.00 H new ATOM 0 HZ1 LYS X 77 80.292 -10.438 5.171 1.00 0.00 H new ATOM 0 HZ2 LYS X 77 78.869 -10.524 4.249 1.00 0.00 H new ATOM 0 HZ3 LYS X 77 80.356 -10.213 3.489 1.00 0.00 H new ATOM 1125 N GLU X 78 77.273 -3.714 1.687 1.00 0.00 N ATOM 1126 CA GLU X 78 78.111 -2.924 0.782 1.00 0.00 C ATOM 1127 C GLU X 78 78.188 -1.483 1.251 1.00 0.00 C ATOM 1128 O GLU X 78 79.266 -0.887 1.328 1.00 0.00 O ATOM 1129 CB GLU X 78 77.510 -2.968 -0.618 1.00 0.00 C ATOM 1130 CG GLU X 78 77.572 -4.330 -1.273 1.00 0.00 C ATOM 1131 CD GLU X 78 78.972 -4.881 -1.400 1.00 0.00 C ATOM 1132 OE1 GLU X 78 79.465 -5.547 -0.474 1.00 0.00 O ATOM 1133 OE2 GLU X 78 79.584 -4.717 -2.473 1.00 0.00 O ATOM 0 H GLU X 78 76.466 -4.146 1.237 1.00 0.00 H new ATOM 0 HA GLU X 78 79.117 -3.343 0.773 1.00 0.00 H new ATOM 0 HB2 GLU X 78 76.469 -2.649 -0.565 1.00 0.00 H new ATOM 0 HB3 GLU X 78 78.032 -2.249 -1.249 1.00 0.00 H new ATOM 0 HG2 GLU X 78 76.967 -5.029 -0.695 1.00 0.00 H new ATOM 0 HG3 GLU X 78 77.125 -4.267 -2.265 1.00 0.00 H new ATOM 1140 N ILE X 79 77.044 -0.958 1.607 1.00 0.00 N ATOM 1141 CA ILE X 79 76.929 0.398 2.123 1.00 0.00 C ATOM 1142 C ILE X 79 77.710 0.583 3.425 1.00 0.00 C ATOM 1143 O ILE X 79 78.445 1.568 3.560 1.00 0.00 O ATOM 1144 CB ILE X 79 75.444 0.837 2.328 1.00 0.00 C ATOM 1145 CG1 ILE X 79 74.671 0.797 0.999 1.00 0.00 C ATOM 1146 CG2 ILE X 79 75.357 2.237 2.953 1.00 0.00 C ATOM 1147 CD1 ILE X 79 75.232 1.685 -0.057 1.00 0.00 C ATOM 0 H ILE X 79 76.155 -1.456 1.550 1.00 0.00 H new ATOM 0 HA ILE X 79 77.368 1.041 1.360 1.00 0.00 H new ATOM 0 HB ILE X 79 74.985 0.128 3.018 1.00 0.00 H new ATOM 0 HG12 ILE X 79 74.659 -0.228 0.628 1.00 0.00 H new ATOM 0 HG13 ILE X 79 73.635 1.081 1.185 1.00 0.00 H new ATOM 0 HG21 ILE X 79 74.311 2.513 3.083 1.00 0.00 H new ATOM 0 HG22 ILE X 79 75.854 2.234 3.923 1.00 0.00 H new ATOM 0 HG23 ILE X 79 75.844 2.959 2.298 1.00 0.00 H new ATOM 0 HD11 ILE X 79 74.631 1.599 -0.962 1.00 0.00 H new ATOM 0 HD12 ILE X 79 75.218 2.718 0.291 1.00 0.00 H new ATOM 0 HD13 ILE X 79 76.258 1.389 -0.274 1.00 0.00 H new ATOM 1159 N LYS X 80 77.587 -0.362 4.358 1.00 0.00 N ATOM 1160 CA LYS X 80 78.264 -0.223 5.643 1.00 0.00 C ATOM 1161 C LYS X 80 79.771 -0.204 5.447 1.00 0.00 C ATOM 1162 O LYS X 80 80.469 0.591 6.085 1.00 0.00 O ATOM 1163 CB LYS X 80 77.821 -1.297 6.679 1.00 0.00 C ATOM 1164 CG LYS X 80 78.341 -2.708 6.475 1.00 0.00 C ATOM 1165 CD LYS X 80 77.530 -3.726 7.276 1.00 0.00 C ATOM 1166 CE LYS X 80 77.487 -3.414 8.767 1.00 0.00 C ATOM 1167 NZ LYS X 80 76.689 -4.407 9.521 1.00 0.00 N ATOM 0 H LYS X 80 77.037 -1.214 4.250 1.00 0.00 H new ATOM 0 HA LYS X 80 77.963 0.734 6.069 1.00 0.00 H new ATOM 0 HB2 LYS X 80 78.132 -0.961 7.668 1.00 0.00 H new ATOM 0 HB3 LYS X 80 76.732 -1.335 6.683 1.00 0.00 H new ATOM 0 HG2 LYS X 80 78.301 -2.962 5.416 1.00 0.00 H new ATOM 0 HG3 LYS X 80 79.388 -2.758 6.775 1.00 0.00 H new ATOM 0 HD2 LYS X 80 76.512 -3.757 6.888 1.00 0.00 H new ATOM 0 HD3 LYS X 80 77.957 -4.718 7.130 1.00 0.00 H new ATOM 0 HE2 LYS X 80 78.503 -3.391 9.162 1.00 0.00 H new ATOM 0 HE3 LYS X 80 77.064 -2.421 8.917 1.00 0.00 H new ATOM 0 HZ1 LYS X 80 76.246 -3.946 10.341 1.00 0.00 H new ATOM 0 HZ2 LYS X 80 75.950 -4.800 8.903 1.00 0.00 H new ATOM 0 HZ3 LYS X 80 77.310 -5.174 9.849 1.00 0.00 H new ATOM 1181 N GLU X 81 80.255 -1.021 4.512 1.00 0.00 N ATOM 1182 CA GLU X 81 81.664 -1.075 4.217 1.00 0.00 C ATOM 1183 C GLU X 81 82.141 0.181 3.485 1.00 0.00 C ATOM 1184 O GLU X 81 83.173 0.743 3.840 1.00 0.00 O ATOM 1185 CB GLU X 81 82.054 -2.344 3.441 1.00 0.00 C ATOM 1186 CG GLU X 81 81.842 -3.650 4.208 1.00 0.00 C ATOM 1187 CD GLU X 81 82.511 -4.833 3.536 1.00 0.00 C ATOM 1188 OE1 GLU X 81 83.738 -5.011 3.726 1.00 0.00 O ATOM 1189 OE2 GLU X 81 81.843 -5.596 2.787 1.00 0.00 O ATOM 0 H GLU X 81 79.681 -1.651 3.951 1.00 0.00 H new ATOM 0 HA GLU X 81 82.174 -1.116 5.179 1.00 0.00 H new ATOM 0 HB2 GLU X 81 81.475 -2.382 2.518 1.00 0.00 H new ATOM 0 HB3 GLU X 81 83.104 -2.272 3.156 1.00 0.00 H new ATOM 0 HG2 GLU X 81 82.234 -3.541 5.219 1.00 0.00 H new ATOM 0 HG3 GLU X 81 80.773 -3.845 4.299 1.00 0.00 H new ATOM 1196 N TRP X 82 81.369 0.635 2.500 1.00 0.00 N ATOM 1197 CA TRP X 82 81.728 1.812 1.687 1.00 0.00 C ATOM 1198 C TRP X 82 81.776 3.059 2.536 1.00 0.00 C ATOM 1199 O TRP X 82 82.743 3.831 2.496 1.00 0.00 O ATOM 1200 CB TRP X 82 80.674 2.049 0.622 1.00 0.00 C ATOM 1201 CG TRP X 82 81.072 3.065 -0.416 1.00 0.00 C ATOM 1202 CD1 TRP X 82 81.805 2.830 -1.534 1.00 0.00 C ATOM 1203 CD2 TRP X 82 80.747 4.466 -0.443 1.00 0.00 C ATOM 1204 NE1 TRP X 82 81.954 3.980 -2.252 1.00 0.00 N ATOM 1205 CE2 TRP X 82 81.322 4.997 -1.612 1.00 0.00 C ATOM 1206 CE3 TRP X 82 80.030 5.320 0.400 1.00 0.00 C ATOM 1207 CZ2 TRP X 82 81.204 6.334 -1.962 1.00 0.00 C ATOM 1208 CZ3 TRP X 82 79.915 6.649 0.052 1.00 0.00 C ATOM 1209 CH2 TRP X 82 80.498 7.145 -1.121 1.00 0.00 C ATOM 0 H TRP X 82 80.481 0.206 2.238 1.00 0.00 H new ATOM 0 HA TRP X 82 82.704 1.614 1.244 1.00 0.00 H new ATOM 0 HB2 TRP X 82 80.455 1.104 0.125 1.00 0.00 H new ATOM 0 HB3 TRP X 82 79.753 2.378 1.103 1.00 0.00 H new ATOM 0 HD1 TRP X 82 82.212 1.870 -1.815 1.00 0.00 H new ATOM 0 HE1 TRP X 82 82.461 4.063 -3.133 1.00 0.00 H new ATOM 0 HE3 TRP X 82 79.575 4.946 1.306 1.00 0.00 H new ATOM 0 HZ2 TRP X 82 81.654 6.719 -2.865 1.00 0.00 H new ATOM 0 HZ3 TRP X 82 79.365 7.320 0.696 1.00 0.00 H new ATOM 0 HH2 TRP X 82 80.387 8.191 -1.365 1.00 0.00 H new ATOM 1220 N ARG X 83 80.735 3.234 3.321 1.00 0.00 N ATOM 1221 CA ARG X 83 80.550 4.420 4.116 1.00 0.00 C ATOM 1222 C ARG X 83 81.717 4.543 5.089 1.00 0.00 C ATOM 1223 O ARG X 83 82.329 5.606 5.221 1.00 0.00 O ATOM 1224 CB ARG X 83 79.276 4.281 4.910 1.00 0.00 C ATOM 1225 CG ARG X 83 78.665 5.565 5.356 1.00 0.00 C ATOM 1226 CD ARG X 83 77.895 6.300 4.266 1.00 0.00 C ATOM 1227 NE ARG X 83 77.339 7.539 4.819 1.00 0.00 N ATOM 1228 CZ ARG X 83 77.101 8.676 4.166 1.00 0.00 C ATOM 1229 NH1 ARG X 83 77.121 8.730 2.846 1.00 0.00 N ATOM 1230 NH2 ARG X 83 76.765 9.751 4.854 1.00 0.00 N ATOM 0 H ARG X 83 79.988 2.547 3.424 1.00 0.00 H new ATOM 0 HA ARG X 83 80.499 5.298 3.472 1.00 0.00 H new ATOM 0 HB2 ARG X 83 78.547 3.740 4.306 1.00 0.00 H new ATOM 0 HB3 ARG X 83 79.479 3.669 5.789 1.00 0.00 H new ATOM 0 HG2 ARG X 83 77.991 5.364 6.189 1.00 0.00 H new ATOM 0 HG3 ARG X 83 79.452 6.218 5.733 1.00 0.00 H new ATOM 0 HD2 ARG X 83 78.554 6.526 3.428 1.00 0.00 H new ATOM 0 HD3 ARG X 83 77.094 5.668 3.881 1.00 0.00 H new ATOM 0 HE ARG X 83 77.109 7.530 5.813 1.00 0.00 H new ATOM 0 HH11 ARG X 83 77.322 7.889 2.304 1.00 0.00 H new ATOM 0 HH12 ARG X 83 76.936 9.612 2.369 1.00 0.00 H new ATOM 0 HH21 ARG X 83 76.691 9.704 5.870 1.00 0.00 H new ATOM 0 HH22 ARG X 83 76.580 10.629 4.370 1.00 0.00 H new ATOM 1244 N ALA X 84 82.046 3.419 5.711 1.00 0.00 N ATOM 1245 CA ALA X 84 83.126 3.334 6.671 1.00 0.00 C ATOM 1246 C ALA X 84 84.485 3.521 5.993 1.00 0.00 C ATOM 1247 O ALA X 84 85.374 4.162 6.547 1.00 0.00 O ATOM 1248 CB ALA X 84 83.068 2.002 7.407 1.00 0.00 C ATOM 0 H ALA X 84 81.562 2.534 5.558 1.00 0.00 H new ATOM 0 HA ALA X 84 83.005 4.140 7.395 1.00 0.00 H new ATOM 0 HB1 ALA X 84 83.885 1.948 8.127 1.00 0.00 H new ATOM 0 HB2 ALA X 84 82.116 1.917 7.931 1.00 0.00 H new ATOM 0 HB3 ALA X 84 83.162 1.186 6.690 1.00 0.00 H new ATOM 1254 N ALA X 85 84.627 2.969 4.788 1.00 0.00 N ATOM 1255 CA ALA X 85 85.868 3.065 4.014 1.00 0.00 C ATOM 1256 C ALA X 85 86.155 4.502 3.617 1.00 0.00 C ATOM 1257 O ALA X 85 87.306 4.934 3.581 1.00 0.00 O ATOM 1258 CB ALA X 85 85.810 2.176 2.781 1.00 0.00 C ATOM 0 H ALA X 85 83.888 2.444 4.321 1.00 0.00 H new ATOM 0 HA ALA X 85 86.682 2.718 4.650 1.00 0.00 H new ATOM 0 HB1 ALA X 85 86.743 2.265 2.224 1.00 0.00 H new ATOM 0 HB2 ALA X 85 85.667 1.139 3.086 1.00 0.00 H new ATOM 0 HB3 ALA X 85 84.978 2.485 2.148 1.00 0.00 H new ATOM 1264 N ASN X 86 85.111 5.232 3.291 1.00 0.00 N ATOM 1265 CA ASN X 86 85.249 6.644 2.967 1.00 0.00 C ATOM 1266 C ASN X 86 85.486 7.434 4.249 1.00 0.00 C ATOM 1267 O ASN X 86 86.329 8.342 4.300 1.00 0.00 O ATOM 1268 CB ASN X 86 83.983 7.181 2.288 1.00 0.00 C ATOM 1269 CG ASN X 86 84.125 8.641 1.857 1.00 0.00 C ATOM 1270 OD1 ASN X 86 83.944 9.554 2.650 1.00 0.00 O ATOM 1271 ND2 ASN X 86 84.352 8.867 0.598 1.00 0.00 N ATOM 0 H ASN X 86 84.156 4.876 3.242 1.00 0.00 H new ATOM 0 HA ASN X 86 86.091 6.756 2.284 1.00 0.00 H new ATOM 0 HB2 ASN X 86 83.755 6.568 1.416 1.00 0.00 H new ATOM 0 HB3 ASN X 86 83.140 7.088 2.973 1.00 0.00 H new ATOM 0 HD21 ASN X 86 84.383 9.825 0.249 1.00 0.00 H new ATOM 0 HD22 ASN X 86 84.500 8.086 -0.042 1.00 0.00 H new ATOM 1278 N GLY X 87 84.745 7.078 5.278 1.00 0.00 N ATOM 1279 CA GLY X 87 84.823 7.765 6.544 1.00 0.00 C ATOM 1280 C GLY X 87 83.598 8.621 6.767 1.00 0.00 C ATOM 1281 O GLY X 87 83.660 9.671 7.412 1.00 0.00 O ATOM 0 H GLY X 87 84.076 6.308 5.258 1.00 0.00 H new ATOM 0 HA2 GLY X 87 84.917 7.039 7.352 1.00 0.00 H new ATOM 0 HA3 GLY X 87 85.717 8.388 6.570 1.00 0.00 H new ATOM 1285 N LYS X 88 82.482 8.171 6.242 1.00 0.00 N ATOM 1286 CA LYS X 88 81.257 8.855 6.322 1.00 0.00 C ATOM 1287 C LYS X 88 80.409 8.193 7.391 1.00 0.00 C ATOM 1288 O LYS X 88 80.517 6.984 7.581 1.00 0.00 O ATOM 1289 CB LYS X 88 80.574 8.724 4.976 1.00 0.00 C ATOM 1290 CG LYS X 88 81.119 9.601 3.865 1.00 0.00 C ATOM 1291 CD LYS X 88 80.502 9.233 2.514 1.00 0.00 C ATOM 1292 CE LYS X 88 81.052 10.074 1.355 1.00 0.00 C ATOM 1293 NZ LYS X 88 80.712 11.512 1.451 1.00 0.00 N ATOM 0 H LYS X 88 82.423 7.288 5.735 1.00 0.00 H new ATOM 0 HA LYS X 88 81.401 9.906 6.572 1.00 0.00 H new ATOM 0 HB2 LYS X 88 80.641 7.684 4.657 1.00 0.00 H new ATOM 0 HB3 LYS X 88 79.516 8.951 5.104 1.00 0.00 H new ATOM 0 HG2 LYS X 88 80.911 10.647 4.089 1.00 0.00 H new ATOM 0 HG3 LYS X 88 82.203 9.495 3.813 1.00 0.00 H new ATOM 0 HD2 LYS X 88 80.688 8.178 2.311 1.00 0.00 H new ATOM 0 HD3 LYS X 88 79.421 9.361 2.568 1.00 0.00 H new ATOM 0 HE2 LYS X 88 82.136 9.967 1.323 1.00 0.00 H new ATOM 0 HE3 LYS X 88 80.665 9.680 0.416 1.00 0.00 H new ATOM 0 HZ1 LYS X 88 81.115 12.019 0.637 1.00 0.00 H new ATOM 0 HZ2 LYS X 88 79.678 11.625 1.452 1.00 0.00 H new ATOM 0 HZ3 LYS X 88 81.104 11.903 2.331 1.00 0.00 H new ATOM 1307 N PRO X 89 79.583 8.957 8.114 1.00 0.00 N ATOM 1308 CA PRO X 89 78.682 8.391 9.120 1.00 0.00 C ATOM 1309 C PRO X 89 77.663 7.488 8.445 1.00 0.00 C ATOM 1310 O PRO X 89 76.997 7.895 7.476 1.00 0.00 O ATOM 1311 CB PRO X 89 78.002 9.620 9.735 1.00 0.00 C ATOM 1312 CG PRO X 89 78.150 10.685 8.703 1.00 0.00 C ATOM 1313 CD PRO X 89 79.461 10.423 8.030 1.00 0.00 C ATOM 0 HA PRO X 89 79.192 7.783 9.867 1.00 0.00 H new ATOM 0 HB2 PRO X 89 76.953 9.424 9.955 1.00 0.00 H new ATOM 0 HB3 PRO X 89 78.476 9.908 10.673 1.00 0.00 H new ATOM 0 HG2 PRO X 89 77.329 10.652 7.986 1.00 0.00 H new ATOM 0 HG3 PRO X 89 78.135 11.675 9.158 1.00 0.00 H new ATOM 0 HD2 PRO X 89 79.462 10.771 6.997 1.00 0.00 H new ATOM 0 HD3 PRO X 89 80.284 10.927 8.537 1.00 0.00 H new ATOM 1321 N GLY X 90 77.566 6.284 8.911 1.00 0.00 N ATOM 1322 CA GLY X 90 76.717 5.331 8.289 1.00 0.00 C ATOM 1323 C GLY X 90 75.531 4.969 9.109 1.00 0.00 C ATOM 1324 O GLY X 90 74.740 5.841 9.491 1.00 0.00 O ATOM 0 H GLY X 90 78.071 5.940 9.728 1.00 0.00 H new ATOM 0 HA2 GLY X 90 76.379 5.727 7.331 1.00 0.00 H new ATOM 0 HA3 GLY X 90 77.291 4.429 8.076 1.00 0.00 H new ATOM 1328 N PHE X 91 75.437 3.707 9.433 1.00 0.00 N ATOM 1329 CA PHE X 91 74.264 3.175 10.065 1.00 0.00 C ATOM 1330 C PHE X 91 74.216 3.427 11.531 1.00 0.00 C ATOM 1331 O PHE X 91 75.241 3.559 12.216 1.00 0.00 O ATOM 1332 CB PHE X 91 74.098 1.685 9.794 1.00 0.00 C ATOM 1333 CG PHE X 91 73.957 1.365 8.352 1.00 0.00 C ATOM 1334 CD1 PHE X 91 73.056 2.055 7.575 1.00 0.00 C ATOM 1335 CD2 PHE X 91 74.717 0.375 7.767 1.00 0.00 C ATOM 1336 CE1 PHE X 91 72.925 1.771 6.253 1.00 0.00 C ATOM 1337 CE2 PHE X 91 74.575 0.090 6.430 1.00 0.00 C ATOM 1338 CZ PHE X 91 73.683 0.789 5.679 1.00 0.00 C ATOM 0 H PHE X 91 76.173 3.020 9.265 1.00 0.00 H new ATOM 0 HA PHE X 91 73.431 3.714 9.614 1.00 0.00 H new ATOM 0 HB2 PHE X 91 74.959 1.151 10.195 1.00 0.00 H new ATOM 0 HB3 PHE X 91 73.220 1.321 10.328 1.00 0.00 H new ATOM 0 HD1 PHE X 91 72.448 2.829 8.019 1.00 0.00 H new ATOM 0 HD2 PHE X 91 75.428 -0.179 8.362 1.00 0.00 H new ATOM 0 HE1 PHE X 91 72.218 2.324 5.652 1.00 0.00 H new ATOM 0 HE2 PHE X 91 75.171 -0.688 5.977 1.00 0.00 H new ATOM 0 HZ PHE X 91 73.573 0.568 4.628 1.00 0.00 H new ATOM 1348 N LYS X 92 73.023 3.548 11.990 1.00 0.00 N ATOM 1349 CA LYS X 92 72.722 3.675 13.315 1.00 0.00 C ATOM 1350 C LYS X 92 72.565 2.265 13.878 1.00 0.00 C ATOM 1351 O LYS X 92 72.571 1.281 13.126 1.00 0.00 O ATOM 1352 CB LYS X 92 71.407 4.388 13.404 1.00 0.00 C ATOM 1353 CG LYS X 92 71.295 5.112 14.647 1.00 0.00 C ATOM 1354 CD LYS X 92 70.031 5.954 14.792 1.00 0.00 C ATOM 1355 CE LYS X 92 68.781 5.113 14.892 1.00 0.00 C ATOM 1356 NZ LYS X 92 67.585 5.925 15.197 1.00 0.00 N ATOM 0 H LYS X 92 72.200 3.558 11.388 1.00 0.00 H new ATOM 0 HA LYS X 92 73.489 4.221 13.863 1.00 0.00 H new ATOM 0 HB2 LYS X 92 71.306 5.078 12.566 1.00 0.00 H new ATOM 0 HB3 LYS X 92 70.593 3.668 13.324 1.00 0.00 H new ATOM 0 HG2 LYS X 92 71.335 4.399 15.470 1.00 0.00 H new ATOM 0 HG3 LYS X 92 72.162 5.765 14.749 1.00 0.00 H new ATOM 0 HD2 LYS X 92 70.116 6.579 15.681 1.00 0.00 H new ATOM 0 HD3 LYS X 92 69.946 6.625 13.937 1.00 0.00 H new ATOM 0 HE2 LYS X 92 68.627 4.581 13.953 1.00 0.00 H new ATOM 0 HE3 LYS X 92 68.914 4.359 15.668 1.00 0.00 H new ATOM 0 HZ1 LYS X 92 66.779 5.297 15.390 1.00 0.00 H new ATOM 0 HZ2 LYS X 92 67.771 6.516 16.032 1.00 0.00 H new ATOM 0 HZ3 LYS X 92 67.362 6.534 14.384 1.00 0.00 H new ATOM 1370 N GLN X 93 72.417 2.149 15.159 1.00 0.00 N ATOM 1371 CA GLN X 93 72.217 0.875 15.752 1.00 0.00 C ATOM 1372 C GLN X 93 71.326 0.946 16.971 1.00 0.00 C ATOM 1373 O GLN X 93 71.363 0.076 17.843 1.00 0.00 O ATOM 1374 CB GLN X 93 73.519 0.222 16.097 1.00 0.00 C ATOM 1375 CG GLN X 93 74.548 1.056 16.887 1.00 0.00 C ATOM 1376 CD GLN X 93 75.547 1.799 15.986 1.00 0.00 C ATOM 1377 OE1 GLN X 93 76.577 1.253 15.620 1.00 0.00 O ATOM 1378 NE2 GLN X 93 75.294 3.041 15.682 1.00 0.00 N ATOM 0 H GLN X 93 72.432 2.930 15.815 1.00 0.00 H new ATOM 0 HA GLN X 93 71.710 0.263 15.006 1.00 0.00 H new ATOM 0 HB2 GLN X 93 73.302 -0.677 16.673 1.00 0.00 H new ATOM 0 HB3 GLN X 93 73.990 -0.101 15.168 1.00 0.00 H new ATOM 0 HG2 GLN X 93 74.020 1.780 17.507 1.00 0.00 H new ATOM 0 HG3 GLN X 93 75.097 0.399 17.562 1.00 0.00 H new ATOM 0 HE21 GLN X 93 74.428 3.477 15.998 1.00 0.00 H new ATOM 0 HE22 GLN X 93 75.962 3.577 15.128 1.00 0.00 H new ATOM 1387 N GLY X 94 70.481 1.903 16.983 1.00 0.00 N ATOM 1388 CA GLY X 94 69.619 2.112 18.105 1.00 0.00 C ATOM 1389 C GLY X 94 68.359 2.806 17.702 1.00 0.00 C ATOM 1390 O GLY X 94 67.779 3.541 18.506 1.00 0.00 O ATOM 1391 OXT GLY X 94 67.951 2.659 16.558 1.00 0.00 O ATOM 0 H GLY X 94 70.358 2.570 16.221 1.00 0.00 H new ATOM 0 HA2 GLY X 94 69.377 1.153 18.564 1.00 0.00 H new ATOM 0 HA3 GLY X 94 70.137 2.704 18.859 1.00 0.00 H new TER 1395 GLY X 94