USER MOD reduce.3.24.130724 H: found=0, std=0, add=1288, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 1286 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 60 HIS : no HD1:sc= -0.102 X(o=2.5,f=2.1) USER MOD Set 1.2: A 80 HIS : no HE2:sc= 0.733 K(o=2.5,f=-2) USER MOD Set 1.3: A 83 THR OG1 : rot -12:sc= 0.521 USER MOD Set 1.4: A 96 HIS : no HE2:sc= 0.852 K(o=2.5,f=-9.2!) USER MOD Set 1.5: A 168 SER OG : rot -111:sc= 0.457 USER MOD Set 2.1: A 151 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 156 TYR OH : rot 180:sc= 0.333 USER MOD Set 3.1: A 116 THR OG1 : rot -83:sc= 0.567 USER MOD Set 3.2: A 121 SER OG : rot 180:sc= 0 USER MOD Set 4.1: A 26 HIS : no HD1:sc= -3.01! C(o=-3!,f=-8.3!) USER MOD Set 4.2: A 71 SER OG : rot 178:sc= 0 USER MOD Single : A 5 THR OG1 : rot 33:sc= 0.0927 USER MOD Single : A 10 THR OG1 : rot 71:sc= 0.418 USER MOD Single : A 11 GLN : amide:sc= 0.124 X(o=0.12,f=0.2) USER MOD Single : A 13 GLN : amide:sc= -0.138 K(o=-0.14,f=-0.78) USER MOD Single : A 15 ASN : amide:sc= -0.0328 K(o=-0.033,f=-1.7) USER MOD Single : A 19 LYS NZ :NH3+ -169:sc= 1.38 (180deg=1.26) USER MOD Single : A 24 SER OG : rot -78:sc= 0.393 USER MOD Single : A 28 GLN : amide:sc=-0.00735 X(o=-0.0073,f=-0.0073) USER MOD Single : A 29 SER OG : rot 34:sc= 0.155 USER MOD Single : A 43 SER OG : rot 150:sc= -0.732 USER MOD Single : A 44 TYR OH : rot 165:sc= 0.319 USER MOD Single : A 51 TYR OH : rot 180:sc= -1.89! USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot 40:sc= 0.42 USER MOD Single : A 65 SER OG : rot 26:sc= 0.186 USER MOD Single : A 70 THR OG1 : rot 180:sc=-0.00682 USER MOD Single : A 75 THR OG1 : rot -122:sc= 0.129 USER MOD Single : A 78 TYR OH : rot 39:sc= 0.144 USER MOD Single : A 85 SER OG : rot -61:sc= 0.493 USER MOD Single : A 92 SER OG : rot 23:sc= 0.0206 USER MOD Single : A 100 GLN : amide:sc= -0.0334 X(o=-0.033,f=0) USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot -45:sc= 0.23 USER MOD Single : A 115 LYS NZ :NH3+ 168:sc= 0.588 (180deg=0.508) USER MOD Single : A 117 THR OG1 : rot 66:sc= 0.0638 USER MOD Single : A 119 GLN : amide:sc= -0.0916 X(o=-0.092,f=-0.026) USER MOD Single : A 120 GLN : amide:sc= -0.351 K(o=-0.35,f=-1.1) USER MOD Single : A 122 TYR OH : rot -100:sc= 0.407 USER MOD Single : A 127 TYR OH : rot -65:sc= 0.0379 USER MOD Single : A 128 MET CE :methyl -145:sc= -0.156 (180deg=-0.503) USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 143 THR OG1 : rot 180:sc= 0 USER MOD Single : A 147 ASN : amide:sc= -0.903 K(o=-0.9,f=-3!) USER MOD Single : A 150 TYR OH : rot 180:sc= 0 USER MOD Single : A 154 CYS SG : rot 70:sc= -2.24! USER MOD Single : A 157 SER OG : rot 73:sc= 0.582 USER MOD Single : A 159 THR OG1 : rot -31:sc= 0.0205 USER MOD Single : A 161 SER OG : rot 72:sc= 0.212 USER MOD Single : A 162 CYS SG : rot 180:sc= 0.0578 USER MOD Single : A 169 ASN : amide:sc= -0.971 K(o=-0.97,f=-2.8) USER MOD Single : A 173 THR OG1 : rot -130:sc=-0.00414 USER MOD Single : A 176 THR OG1 : rot 45:sc= 0.375 USER MOD ----------------------------------------------------------------- ATOM 59 N THR A 5 -12.054 4.893 -15.702 1.00 21.13 N ATOM 60 CA THR A 5 -12.533 3.686 -14.994 1.00 50.23 C ATOM 61 C THR A 5 -11.541 2.524 -15.209 1.00 32.11 C ATOM 62 O THR A 5 -10.954 2.020 -14.245 1.00 3.41 O ATOM 63 CB THR A 5 -13.973 3.284 -15.467 1.00 13.20 C ATOM 64 OG1 THR A 5 -14.854 4.390 -15.246 1.00 1.42 O ATOM 65 CG2 THR A 5 -14.538 2.050 -14.730 1.00 62.14 C ATOM 0 HA THR A 5 -12.589 3.910 -13.929 1.00 50.23 H new ATOM 0 HB THR A 5 -13.902 3.024 -16.523 1.00 13.20 H new ATOM 0 HG1 THR A 5 -14.361 5.229 -15.360 1.00 1.42 H new ATOM 0 HG21 THR A 5 -15.537 1.827 -15.106 1.00 62.14 H new ATOM 0 HG22 THR A 5 -13.886 1.193 -14.902 1.00 62.14 H new ATOM 0 HG23 THR A 5 -14.591 2.257 -13.661 1.00 62.14 H new ATOM 73 N GLU A 6 -11.317 2.147 -16.484 1.00 13.42 N ATOM 74 CA GLU A 6 -10.401 1.041 -16.850 1.00 20.52 C ATOM 75 C GLU A 6 -8.921 1.413 -16.582 1.00 11.21 C ATOM 76 O GLU A 6 -8.074 0.526 -16.442 1.00 12.33 O ATOM 77 CB GLU A 6 -10.586 0.636 -18.338 1.00 1.13 C ATOM 78 CG GLU A 6 -10.215 1.725 -19.356 1.00 34.00 C ATOM 79 CD GLU A 6 -10.439 1.297 -20.809 1.00 65.44 C ATOM 80 OE1 GLU A 6 -11.575 1.437 -21.314 1.00 62.45 O ATOM 81 OE2 GLU A 6 -9.474 0.817 -21.448 1.00 44.52 O ATOM 0 H GLU A 6 -11.761 2.595 -17.286 1.00 13.42 H new ATOM 0 HA GLU A 6 -10.657 0.190 -16.219 1.00 20.52 H new ATOM 0 HB2 GLU A 6 -9.980 -0.248 -18.537 1.00 1.13 H new ATOM 0 HB3 GLU A 6 -11.626 0.351 -18.495 1.00 1.13 H new ATOM 0 HG2 GLU A 6 -10.805 2.619 -19.153 1.00 34.00 H new ATOM 0 HG3 GLU A 6 -9.168 1.997 -19.222 1.00 34.00 H new ATOM 88 N ASP A 7 -8.634 2.739 -16.528 1.00 51.24 N ATOM 89 CA ASP A 7 -7.314 3.292 -16.118 1.00 51.12 C ATOM 90 C ASP A 7 -6.790 2.686 -14.790 1.00 41.24 C ATOM 91 O ASP A 7 -5.581 2.594 -14.588 1.00 25.53 O ATOM 92 CB ASP A 7 -7.371 4.831 -16.003 1.00 32.55 C ATOM 93 CG ASP A 7 -5.985 5.445 -15.752 1.00 61.14 C ATOM 94 OD1 ASP A 7 -5.242 5.659 -16.731 1.00 10.14 O ATOM 95 OD2 ASP A 7 -5.631 5.713 -14.576 1.00 73.42 O ATOM 0 H ASP A 7 -9.315 3.460 -16.769 1.00 51.24 H new ATOM 0 HA ASP A 7 -6.612 3.011 -16.903 1.00 51.12 H new ATOM 0 HB2 ASP A 7 -7.790 5.247 -16.919 1.00 32.55 H new ATOM 0 HB3 ASP A 7 -8.042 5.108 -15.190 1.00 32.55 H new ATOM 100 N TRP A 8 -7.730 2.268 -13.924 1.00 15.43 N ATOM 101 CA TRP A 8 -7.458 1.541 -12.667 1.00 44.52 C ATOM 102 C TRP A 8 -6.453 0.372 -12.876 1.00 64.03 C ATOM 103 O TRP A 8 -5.424 0.300 -12.186 1.00 42.24 O ATOM 104 CB TRP A 8 -8.808 1.038 -12.088 1.00 71.20 C ATOM 105 CG TRP A 8 -8.694 0.114 -10.897 1.00 22.21 C ATOM 106 CD1 TRP A 8 -8.388 0.452 -9.610 1.00 40.23 C ATOM 107 CD2 TRP A 8 -8.898 -1.307 -10.900 1.00 11.35 C ATOM 108 NE1 TRP A 8 -8.383 -0.666 -8.824 1.00 23.10 N ATOM 109 CE2 TRP A 8 -8.705 -1.755 -9.585 1.00 63.33 C ATOM 110 CE3 TRP A 8 -9.233 -2.238 -11.891 1.00 15.43 C ATOM 111 CZ2 TRP A 8 -8.841 -3.091 -9.229 1.00 71.31 C ATOM 112 CZ3 TRP A 8 -9.368 -3.562 -11.536 1.00 3.33 C ATOM 113 CH2 TRP A 8 -9.175 -3.977 -10.214 1.00 42.45 C ATOM 0 H TRP A 8 -8.725 2.429 -14.081 1.00 15.43 H new ATOM 0 HA TRP A 8 -6.985 2.218 -11.956 1.00 44.52 H new ATOM 0 HB2 TRP A 8 -9.406 1.903 -11.801 1.00 71.20 H new ATOM 0 HB3 TRP A 8 -9.353 0.521 -12.878 1.00 71.20 H new ATOM 0 HD1 TRP A 8 -8.181 1.454 -9.264 1.00 40.23 H new ATOM 0 HE1 TRP A 8 -8.172 -0.685 -7.826 1.00 23.10 H new ATOM 0 HE3 TRP A 8 -9.383 -1.924 -12.913 1.00 15.43 H new ATOM 0 HZ2 TRP A 8 -8.688 -3.417 -8.211 1.00 71.31 H new ATOM 0 HZ3 TRP A 8 -9.627 -4.291 -12.290 1.00 3.33 H new ATOM 0 HH2 TRP A 8 -9.293 -5.022 -9.966 1.00 42.45 H new ATOM 124 N GLU A 9 -6.737 -0.506 -13.859 1.00 21.11 N ATOM 125 CA GLU A 9 -5.851 -1.647 -14.195 1.00 32.33 C ATOM 126 C GLU A 9 -4.692 -1.215 -15.126 1.00 64.43 C ATOM 127 O GLU A 9 -3.631 -1.856 -15.130 1.00 45.50 O ATOM 128 CB GLU A 9 -6.649 -2.813 -14.847 1.00 50.22 C ATOM 129 CG GLU A 9 -7.288 -2.475 -16.204 1.00 53.41 C ATOM 130 CD GLU A 9 -7.937 -3.679 -16.889 1.00 64.50 C ATOM 131 OE1 GLU A 9 -9.065 -4.054 -16.504 1.00 4.13 O ATOM 132 OE2 GLU A 9 -7.323 -4.249 -17.814 1.00 24.32 O ATOM 0 H GLU A 9 -7.575 -0.449 -14.438 1.00 21.11 H new ATOM 0 HA GLU A 9 -5.424 -2.000 -13.257 1.00 32.33 H new ATOM 0 HB2 GLU A 9 -5.981 -3.664 -14.978 1.00 50.22 H new ATOM 0 HB3 GLU A 9 -7.434 -3.127 -14.159 1.00 50.22 H new ATOM 0 HG2 GLU A 9 -8.041 -1.700 -16.059 1.00 53.41 H new ATOM 0 HG3 GLU A 9 -6.525 -2.060 -16.863 1.00 53.41 H new ATOM 139 N THR A 10 -4.901 -0.127 -15.894 1.00 75.33 N ATOM 140 CA THR A 10 -3.921 0.379 -16.874 1.00 50.33 C ATOM 141 C THR A 10 -2.670 0.933 -16.165 1.00 4.41 C ATOM 142 O THR A 10 -1.538 0.600 -16.531 1.00 40.32 O ATOM 143 CB THR A 10 -4.568 1.486 -17.769 1.00 13.52 C ATOM 144 OG1 THR A 10 -5.783 0.982 -18.342 1.00 21.45 O ATOM 145 CG2 THR A 10 -3.632 1.976 -18.886 1.00 51.12 C ATOM 0 H THR A 10 -5.757 0.426 -15.851 1.00 75.33 H new ATOM 0 HA THR A 10 -3.615 -0.453 -17.508 1.00 50.33 H new ATOM 0 HB THR A 10 -4.772 2.344 -17.128 1.00 13.52 H new ATOM 0 HG1 THR A 10 -6.465 0.901 -17.643 1.00 21.45 H new ATOM 0 HG21 THR A 10 -4.137 2.743 -19.473 1.00 51.12 H new ATOM 0 HG22 THR A 10 -2.727 2.393 -18.445 1.00 51.12 H new ATOM 0 HG23 THR A 10 -3.368 1.139 -19.533 1.00 51.12 H new ATOM 153 N GLN A 11 -2.883 1.797 -15.156 1.00 40.50 N ATOM 154 CA GLN A 11 -1.797 2.269 -14.291 1.00 5.21 C ATOM 155 C GLN A 11 -1.226 1.109 -13.458 1.00 32.51 C ATOM 156 O GLN A 11 -0.022 1.022 -13.297 1.00 33.13 O ATOM 157 CB GLN A 11 -2.249 3.441 -13.372 1.00 50.14 C ATOM 158 CG GLN A 11 -3.324 3.101 -12.320 1.00 10.05 C ATOM 159 CD GLN A 11 -3.579 4.238 -11.329 1.00 13.10 C ATOM 160 OE1 GLN A 11 -2.960 4.297 -10.266 1.00 71.50 O ATOM 161 NE2 GLN A 11 -4.462 5.164 -11.681 1.00 23.43 N ATOM 0 H GLN A 11 -3.799 2.180 -14.923 1.00 40.50 H new ATOM 0 HA GLN A 11 -1.009 2.655 -14.938 1.00 5.21 H new ATOM 0 HB2 GLN A 11 -1.372 3.829 -12.854 1.00 50.14 H new ATOM 0 HB3 GLN A 11 -2.628 4.245 -14.003 1.00 50.14 H new ATOM 0 HG2 GLN A 11 -4.256 2.856 -12.829 1.00 10.05 H new ATOM 0 HG3 GLN A 11 -3.017 2.211 -11.771 1.00 10.05 H new ATOM 0 HE21 GLN A 11 -4.958 5.085 -12.569 1.00 23.43 H new ATOM 0 HE22 GLN A 11 -4.645 5.955 -11.064 1.00 23.43 H new ATOM 170 N LEU A 12 -2.109 0.186 -12.995 1.00 41.52 N ATOM 171 CA LEU A 12 -1.734 -0.937 -12.101 1.00 51.11 C ATOM 172 C LEU A 12 -0.627 -1.816 -12.710 1.00 32.32 C ATOM 173 O LEU A 12 0.363 -2.113 -12.037 1.00 10.33 O ATOM 174 CB LEU A 12 -2.969 -1.814 -11.785 1.00 53.45 C ATOM 175 CG LEU A 12 -2.702 -3.156 -11.022 1.00 55.23 C ATOM 176 CD1 LEU A 12 -2.143 -2.917 -9.601 1.00 24.13 C ATOM 177 CD2 LEU A 12 -3.963 -4.046 -11.011 1.00 51.31 C ATOM 0 H LEU A 12 -3.101 0.201 -13.232 1.00 41.52 H new ATOM 0 HA LEU A 12 -1.350 -0.496 -11.181 1.00 51.11 H new ATOM 0 HB2 LEU A 12 -3.666 -1.220 -11.194 1.00 53.45 H new ATOM 0 HB3 LEU A 12 -3.468 -2.050 -12.725 1.00 53.45 H new ATOM 0 HG LEU A 12 -1.927 -3.695 -11.567 1.00 55.23 H new ATOM 0 HD11 LEU A 12 -1.974 -3.876 -9.111 1.00 24.13 H new ATOM 0 HD12 LEU A 12 -1.201 -2.372 -9.667 1.00 24.13 H new ATOM 0 HD13 LEU A 12 -2.859 -2.335 -9.021 1.00 24.13 H new ATOM 0 HD21 LEU A 12 -3.751 -4.971 -10.475 1.00 51.31 H new ATOM 0 HD22 LEU A 12 -4.777 -3.518 -10.514 1.00 51.31 H new ATOM 0 HD23 LEU A 12 -4.253 -4.278 -12.036 1.00 51.31 H new ATOM 189 N GLN A 13 -0.797 -2.194 -13.995 1.00 2.11 N ATOM 190 CA GLN A 13 0.147 -3.090 -14.697 1.00 43.23 C ATOM 191 C GLN A 13 1.542 -2.449 -14.858 1.00 33.44 C ATOM 192 O GLN A 13 2.470 -3.133 -15.246 1.00 64.33 O ATOM 193 CB GLN A 13 -0.444 -3.579 -16.069 1.00 4.23 C ATOM 194 CG GLN A 13 -0.861 -2.488 -17.093 1.00 62.13 C ATOM 195 CD GLN A 13 0.301 -1.831 -17.861 1.00 61.33 C ATOM 196 OE1 GLN A 13 0.833 -0.800 -17.450 1.00 42.12 O ATOM 197 NE2 GLN A 13 0.708 -2.432 -18.971 1.00 22.42 N ATOM 0 H GLN A 13 -1.583 -1.891 -14.570 1.00 2.11 H new ATOM 0 HA GLN A 13 0.285 -3.973 -14.072 1.00 43.23 H new ATOM 0 HB2 GLN A 13 0.295 -4.223 -16.545 1.00 4.23 H new ATOM 0 HB3 GLN A 13 -1.317 -4.197 -15.859 1.00 4.23 H new ATOM 0 HG2 GLN A 13 -1.547 -2.933 -17.814 1.00 62.13 H new ATOM 0 HG3 GLN A 13 -1.413 -1.710 -16.566 1.00 62.13 H new ATOM 0 HE21 GLN A 13 0.248 -3.286 -19.287 1.00 22.42 H new ATOM 0 HE22 GLN A 13 1.481 -2.041 -19.509 1.00 22.42 H new ATOM 206 N ALA A 14 1.647 -1.126 -14.581 1.00 23.41 N ATOM 207 CA ALA A 14 2.918 -0.370 -14.575 1.00 52.23 C ATOM 208 C ALA A 14 3.430 -0.166 -13.129 1.00 0.32 C ATOM 209 O ALA A 14 4.630 -0.293 -12.856 1.00 43.01 O ATOM 210 CB ALA A 14 2.708 0.978 -15.280 1.00 44.43 C ATOM 0 H ALA A 14 0.838 -0.548 -14.353 1.00 23.41 H new ATOM 0 HA ALA A 14 3.677 -0.939 -15.113 1.00 52.23 H new ATOM 0 HB1 ALA A 14 3.642 1.539 -15.278 1.00 44.43 H new ATOM 0 HB2 ALA A 14 2.391 0.805 -16.308 1.00 44.43 H new ATOM 0 HB3 ALA A 14 1.942 1.548 -14.755 1.00 44.43 H new ATOM 216 N ASN A 15 2.485 0.156 -12.222 1.00 5.43 N ATOM 217 CA ASN A 15 2.723 0.337 -10.762 1.00 23.10 C ATOM 218 C ASN A 15 3.297 -0.935 -10.110 1.00 13.22 C ATOM 219 O ASN A 15 4.006 -0.854 -9.106 1.00 60.21 O ATOM 220 CB ASN A 15 1.396 0.747 -10.036 1.00 74.44 C ATOM 221 CG ASN A 15 0.892 2.160 -10.382 1.00 11.04 C ATOM 222 OD1 ASN A 15 1.151 2.691 -11.460 1.00 40.25 O ATOM 223 ND2 ASN A 15 0.134 2.768 -9.477 1.00 54.32 N ATOM 0 H ASN A 15 1.510 0.302 -12.483 1.00 5.43 H new ATOM 0 HA ASN A 15 3.459 1.133 -10.654 1.00 23.10 H new ATOM 0 HB2 ASN A 15 0.620 0.025 -10.290 1.00 74.44 H new ATOM 0 HB3 ASN A 15 1.551 0.683 -8.959 1.00 74.44 H new ATOM 0 HD21 ASN A 15 -0.246 3.695 -9.670 1.00 54.32 H new ATOM 0 HD22 ASN A 15 -0.068 2.308 -8.589 1.00 54.32 H new ATOM 230 N ARG A 16 2.954 -2.109 -10.669 1.00 3.42 N ATOM 231 CA ARG A 16 3.488 -3.405 -10.203 1.00 52.41 C ATOM 232 C ARG A 16 4.546 -3.961 -11.170 1.00 42.43 C ATOM 233 O ARG A 16 5.246 -4.907 -10.821 1.00 51.14 O ATOM 234 CB ARG A 16 2.351 -4.435 -9.984 1.00 34.13 C ATOM 235 CG ARG A 16 1.654 -4.941 -11.264 1.00 53.51 C ATOM 236 CD ARG A 16 0.486 -5.884 -10.953 1.00 43.43 C ATOM 237 NE ARG A 16 -0.160 -6.401 -12.169 1.00 75.33 N ATOM 238 CZ ARG A 16 -1.288 -7.124 -12.192 1.00 54.10 C ATOM 239 NH1 ARG A 16 -1.934 -7.428 -11.066 1.00 14.53 N ATOM 240 NH2 ARG A 16 -1.757 -7.559 -13.350 1.00 44.14 N ATOM 0 H ARG A 16 2.304 -2.188 -11.451 1.00 3.42 H new ATOM 0 HA ARG A 16 3.974 -3.227 -9.244 1.00 52.41 H new ATOM 0 HB2 ARG A 16 2.760 -5.293 -9.451 1.00 34.13 H new ATOM 0 HB3 ARG A 16 1.599 -3.986 -9.335 1.00 34.13 H new ATOM 0 HG2 ARG A 16 1.288 -4.089 -11.837 1.00 53.51 H new ATOM 0 HG3 ARG A 16 2.380 -5.459 -11.891 1.00 53.51 H new ATOM 0 HD2 ARG A 16 0.848 -6.720 -10.354 1.00 43.43 H new ATOM 0 HD3 ARG A 16 -0.252 -5.356 -10.350 1.00 43.43 H new ATOM 0 HE ARG A 16 0.285 -6.193 -13.063 1.00 75.33 H new ATOM 0 HH11 ARG A 16 -1.571 -7.109 -10.168 1.00 14.53 H new ATOM 0 HH12 ARG A 16 -2.791 -7.979 -11.103 1.00 14.53 H new ATOM 0 HH21 ARG A 16 -1.261 -7.343 -14.215 1.00 44.14 H new ATOM 0 HH22 ARG A 16 -2.615 -8.110 -13.378 1.00 44.14 H new ATOM 254 N ASP A 17 4.630 -3.392 -12.394 1.00 24.02 N ATOM 255 CA ASP A 17 5.710 -3.725 -13.367 1.00 32.25 C ATOM 256 C ASP A 17 7.064 -3.251 -12.846 1.00 10.23 C ATOM 257 O ASP A 17 8.067 -3.966 -12.942 1.00 41.32 O ATOM 258 CB ASP A 17 5.437 -3.081 -14.742 1.00 62.12 C ATOM 259 CG ASP A 17 6.547 -3.322 -15.773 1.00 33.32 C ATOM 260 OD1 ASP A 17 6.632 -4.447 -16.304 1.00 30.42 O ATOM 261 OD2 ASP A 17 7.326 -2.392 -16.068 1.00 11.25 O ATOM 0 H ASP A 17 3.965 -2.699 -12.737 1.00 24.02 H new ATOM 0 HA ASP A 17 5.726 -4.809 -13.484 1.00 32.25 H new ATOM 0 HB2 ASP A 17 4.498 -3.472 -15.135 1.00 62.12 H new ATOM 0 HB3 ASP A 17 5.305 -2.007 -14.609 1.00 62.12 H new ATOM 266 N GLU A 18 7.069 -2.032 -12.287 1.00 24.11 N ATOM 267 CA GLU A 18 8.256 -1.467 -11.635 1.00 24.21 C ATOM 268 C GLU A 18 8.627 -2.307 -10.399 1.00 52.31 C ATOM 269 O GLU A 18 9.798 -2.430 -10.073 1.00 4.33 O ATOM 270 CB GLU A 18 8.041 0.012 -11.234 1.00 51.42 C ATOM 271 CG GLU A 18 6.871 0.264 -10.254 1.00 54.34 C ATOM 272 CD GLU A 18 7.066 1.514 -9.387 1.00 65.33 C ATOM 273 OE1 GLU A 18 7.907 1.463 -8.464 1.00 34.32 O ATOM 274 OE2 GLU A 18 6.404 2.543 -9.619 1.00 61.13 O ATOM 0 H GLU A 18 6.256 -1.415 -12.275 1.00 24.11 H new ATOM 0 HA GLU A 18 9.077 -1.496 -12.352 1.00 24.21 H new ATOM 0 HB2 GLU A 18 8.960 0.387 -10.782 1.00 51.42 H new ATOM 0 HB3 GLU A 18 7.869 0.596 -12.138 1.00 51.42 H new ATOM 0 HG2 GLU A 18 5.946 0.364 -10.821 1.00 54.34 H new ATOM 0 HG3 GLU A 18 6.755 -0.605 -9.606 1.00 54.34 H new ATOM 281 N LYS A 19 7.596 -2.883 -9.742 1.00 13.25 N ATOM 282 CA LYS A 19 7.752 -3.792 -8.586 1.00 44.30 C ATOM 283 C LYS A 19 8.209 -5.211 -9.030 1.00 5.14 C ATOM 284 O LYS A 19 8.852 -5.936 -8.252 1.00 54.23 O ATOM 285 CB LYS A 19 6.417 -3.868 -7.767 1.00 42.31 C ATOM 286 CG LYS A 19 6.313 -2.907 -6.553 1.00 42.51 C ATOM 287 CD LYS A 19 6.343 -1.421 -6.956 1.00 2.41 C ATOM 288 CE LYS A 19 6.217 -0.469 -5.754 1.00 64.31 C ATOM 289 NZ LYS A 19 6.158 0.952 -6.194 1.00 72.13 N ATOM 0 H LYS A 19 6.622 -2.728 -10.003 1.00 13.25 H new ATOM 0 HA LYS A 19 8.533 -3.384 -7.944 1.00 44.30 H new ATOM 0 HB2 LYS A 19 5.587 -3.661 -8.442 1.00 42.31 H new ATOM 0 HB3 LYS A 19 6.290 -4.890 -7.409 1.00 42.31 H new ATOM 0 HG2 LYS A 19 5.389 -3.112 -6.013 1.00 42.51 H new ATOM 0 HG3 LYS A 19 7.135 -3.108 -5.866 1.00 42.51 H new ATOM 0 HD2 LYS A 19 7.274 -1.212 -7.482 1.00 2.41 H new ATOM 0 HD3 LYS A 19 5.531 -1.224 -7.655 1.00 2.41 H new ATOM 0 HE2 LYS A 19 5.319 -0.714 -5.186 1.00 64.31 H new ATOM 0 HE3 LYS A 19 7.066 -0.610 -5.085 1.00 64.31 H new ATOM 0 HZ1 LYS A 19 6.261 1.576 -5.368 1.00 72.13 H new ATOM 0 HZ2 LYS A 19 6.928 1.139 -6.867 1.00 72.13 H new ATOM 0 HZ3 LYS A 19 5.244 1.135 -6.654 1.00 72.13 H new ATOM 303 N ASP A 20 7.874 -5.585 -10.279 1.00 25.11 N ATOM 304 CA ASP A 20 8.221 -6.900 -10.856 1.00 64.14 C ATOM 305 C ASP A 20 9.721 -6.945 -11.201 1.00 12.04 C ATOM 306 O ASP A 20 10.420 -7.895 -10.834 1.00 43.55 O ATOM 307 CB ASP A 20 7.342 -7.198 -12.102 1.00 32.34 C ATOM 308 CG ASP A 20 7.699 -8.525 -12.805 1.00 53.12 C ATOM 309 OD1 ASP A 20 7.377 -9.608 -12.268 1.00 4.51 O ATOM 310 OD2 ASP A 20 8.318 -8.490 -13.888 1.00 44.24 O ATOM 0 H ASP A 20 7.354 -4.984 -10.918 1.00 25.11 H new ATOM 0 HA ASP A 20 8.020 -7.677 -10.118 1.00 64.14 H new ATOM 0 HB2 ASP A 20 6.295 -7.226 -11.800 1.00 32.34 H new ATOM 0 HB3 ASP A 20 7.446 -6.379 -12.814 1.00 32.34 H new ATOM 315 N ARG A 21 10.211 -5.886 -11.873 1.00 65.31 N ATOM 316 CA ARG A 21 11.647 -5.747 -12.222 1.00 64.01 C ATOM 317 C ARG A 21 12.482 -5.381 -10.980 1.00 61.12 C ATOM 318 O ARG A 21 13.696 -5.606 -10.965 1.00 12.41 O ATOM 319 CB ARG A 21 11.871 -4.661 -13.309 1.00 34.14 C ATOM 320 CG ARG A 21 11.379 -3.239 -12.918 1.00 74.04 C ATOM 321 CD ARG A 21 12.049 -2.109 -13.720 1.00 34.44 C ATOM 322 NE ARG A 21 11.952 -2.305 -15.171 1.00 43.33 N ATOM 323 CZ ARG A 21 10.932 -1.911 -15.946 1.00 70.13 C ATOM 324 NH1 ARG A 21 9.882 -1.278 -15.432 1.00 11.23 N ATOM 325 NH2 ARG A 21 11.000 -2.117 -17.247 1.00 71.02 N ATOM 0 H ARG A 21 9.633 -5.107 -12.189 1.00 65.31 H new ATOM 0 HA ARG A 21 11.969 -6.712 -12.613 1.00 64.01 H new ATOM 0 HB2 ARG A 21 12.935 -4.612 -13.540 1.00 34.14 H new ATOM 0 HB3 ARG A 21 11.361 -4.969 -14.222 1.00 34.14 H new ATOM 0 HG2 ARG A 21 10.300 -3.185 -13.063 1.00 74.04 H new ATOM 0 HG3 ARG A 21 11.566 -3.079 -11.856 1.00 74.04 H new ATOM 0 HD2 ARG A 21 11.586 -1.158 -13.455 1.00 34.44 H new ATOM 0 HD3 ARG A 21 13.099 -2.042 -13.437 1.00 34.44 H new ATOM 0 HE ARG A 21 12.728 -2.782 -15.629 1.00 43.33 H new ATOM 0 HH11 ARG A 21 9.843 -1.084 -14.431 1.00 11.23 H new ATOM 0 HH12 ARG A 21 9.115 -0.986 -16.038 1.00 11.23 H new ATOM 0 HH21 ARG A 21 11.820 -2.570 -17.649 1.00 71.02 H new ATOM 0 HH22 ARG A 21 10.232 -1.823 -17.851 1.00 71.02 H new ATOM 339 N PHE A 22 11.802 -4.769 -9.980 1.00 5.43 N ATOM 340 CA PHE A 22 12.397 -4.310 -8.702 1.00 53.11 C ATOM 341 C PHE A 22 13.171 -5.447 -8.033 1.00 60.35 C ATOM 342 O PHE A 22 14.380 -5.368 -7.868 1.00 65.43 O ATOM 343 CB PHE A 22 11.260 -3.796 -7.755 1.00 12.34 C ATOM 344 CG PHE A 22 11.616 -2.599 -6.905 1.00 21.12 C ATOM 345 CD1 PHE A 22 11.717 -1.335 -7.484 1.00 20.44 C ATOM 346 CD2 PHE A 22 11.831 -2.725 -5.545 1.00 25.53 C ATOM 347 CE1 PHE A 22 12.017 -0.236 -6.717 1.00 42.15 C ATOM 348 CE2 PHE A 22 12.131 -1.626 -4.784 1.00 70.43 C ATOM 349 CZ PHE A 22 12.230 -0.382 -5.364 1.00 43.12 C ATOM 0 H PHE A 22 10.802 -4.577 -10.041 1.00 5.43 H new ATOM 0 HA PHE A 22 13.094 -3.497 -8.904 1.00 53.11 H new ATOM 0 HB2 PHE A 22 10.391 -3.543 -8.363 1.00 12.34 H new ATOM 0 HB3 PHE A 22 10.962 -4.612 -7.097 1.00 12.34 H new ATOM 0 HD1 PHE A 22 11.558 -1.219 -8.546 1.00 20.44 H new ATOM 0 HD2 PHE A 22 11.762 -3.697 -5.079 1.00 25.53 H new ATOM 0 HE1 PHE A 22 12.086 0.740 -7.174 1.00 42.15 H new ATOM 0 HE2 PHE A 22 12.291 -1.737 -3.722 1.00 70.43 H new ATOM 0 HZ PHE A 22 12.474 0.479 -4.759 1.00 43.12 H new ATOM 359 N PHE A 23 12.445 -6.541 -7.756 1.00 24.42 N ATOM 360 CA PHE A 23 12.980 -7.732 -7.054 1.00 20.31 C ATOM 361 C PHE A 23 14.055 -8.476 -7.871 1.00 53.02 C ATOM 362 O PHE A 23 14.721 -9.368 -7.339 1.00 64.20 O ATOM 363 CB PHE A 23 11.815 -8.704 -6.681 1.00 64.34 C ATOM 364 CG PHE A 23 10.942 -8.268 -5.497 1.00 24.12 C ATOM 365 CD1 PHE A 23 10.818 -6.925 -5.132 1.00 33.43 C ATOM 366 CD2 PHE A 23 10.257 -9.218 -4.736 1.00 65.05 C ATOM 367 CE1 PHE A 23 10.049 -6.554 -4.051 1.00 53.32 C ATOM 368 CE2 PHE A 23 9.490 -8.840 -3.650 1.00 72.30 C ATOM 369 CZ PHE A 23 9.385 -7.505 -3.310 1.00 71.21 C ATOM 0 H PHE A 23 11.462 -6.631 -8.012 1.00 24.42 H new ATOM 0 HA PHE A 23 13.466 -7.374 -6.146 1.00 20.31 H new ATOM 0 HB2 PHE A 23 11.175 -8.828 -7.555 1.00 64.34 H new ATOM 0 HB3 PHE A 23 12.240 -9.682 -6.455 1.00 64.34 H new ATOM 0 HD1 PHE A 23 11.332 -6.168 -5.705 1.00 33.43 H new ATOM 0 HD2 PHE A 23 10.328 -10.263 -5.000 1.00 65.05 H new ATOM 0 HE1 PHE A 23 9.967 -5.511 -3.783 1.00 53.32 H new ATOM 0 HE2 PHE A 23 8.973 -9.588 -3.067 1.00 72.30 H new ATOM 0 HZ PHE A 23 8.783 -7.208 -2.464 1.00 71.21 H new ATOM 379 N SER A 24 14.221 -8.099 -9.150 1.00 14.43 N ATOM 380 CA SER A 24 15.227 -8.677 -10.040 1.00 23.24 C ATOM 381 C SER A 24 16.519 -7.823 -10.029 1.00 33.51 C ATOM 382 O SER A 24 17.606 -8.351 -9.783 1.00 34.53 O ATOM 383 CB SER A 24 14.644 -8.776 -11.472 1.00 13.35 C ATOM 384 OG SER A 24 15.541 -9.423 -12.360 1.00 43.53 O ATOM 0 H SER A 24 13.653 -7.378 -9.594 1.00 14.43 H new ATOM 0 HA SER A 24 15.487 -9.676 -9.691 1.00 23.24 H new ATOM 0 HB2 SER A 24 13.702 -9.323 -11.444 1.00 13.35 H new ATOM 0 HB3 SER A 24 14.421 -7.776 -11.844 1.00 13.35 H new ATOM 0 HG SER A 24 16.243 -8.795 -12.632 1.00 43.53 H new ATOM 390 N GLU A 25 16.384 -6.495 -10.264 1.00 32.51 N ATOM 391 CA GLU A 25 17.526 -5.607 -10.605 1.00 63.15 C ATOM 392 C GLU A 25 17.880 -4.647 -9.441 1.00 11.12 C ATOM 393 O GLU A 25 19.059 -4.453 -9.133 1.00 71.41 O ATOM 394 CB GLU A 25 17.178 -4.773 -11.872 1.00 12.22 C ATOM 395 CG GLU A 25 16.745 -5.590 -13.107 1.00 12.15 C ATOM 396 CD GLU A 25 17.857 -6.498 -13.649 1.00 61.03 C ATOM 397 OE1 GLU A 25 18.790 -5.985 -14.304 1.00 73.10 O ATOM 398 OE2 GLU A 25 17.814 -7.725 -13.421 1.00 44.43 O ATOM 0 H GLU A 25 15.487 -6.010 -10.223 1.00 32.51 H new ATOM 0 HA GLU A 25 18.393 -6.240 -10.794 1.00 63.15 H new ATOM 0 HB2 GLU A 25 16.378 -4.078 -11.619 1.00 12.22 H new ATOM 0 HB3 GLU A 25 18.048 -4.174 -12.141 1.00 12.22 H new ATOM 0 HG2 GLU A 25 15.881 -6.201 -12.846 1.00 12.15 H new ATOM 0 HG3 GLU A 25 16.427 -4.906 -13.894 1.00 12.15 H new ATOM 405 N HIS A 26 16.849 -4.042 -8.812 1.00 61.33 N ATOM 406 CA HIS A 26 17.038 -3.019 -7.751 1.00 63.34 C ATOM 407 C HIS A 26 17.304 -3.714 -6.402 1.00 40.52 C ATOM 408 O HIS A 26 18.349 -3.513 -5.766 1.00 12.32 O ATOM 409 CB HIS A 26 15.785 -2.086 -7.662 1.00 5.25 C ATOM 410 CG HIS A 26 15.842 -1.044 -6.555 1.00 31.24 C ATOM 411 ND1 HIS A 26 15.630 -1.388 -5.246 1.00 54.51 N ATOM 412 CD2 HIS A 26 16.075 0.295 -6.608 1.00 74.44 C ATOM 413 CE1 HIS A 26 15.737 -0.284 -4.540 1.00 34.44 C ATOM 414 NE2 HIS A 26 16.003 0.766 -5.318 1.00 31.14 N ATOM 0 H HIS A 26 15.871 -4.243 -9.020 1.00 61.33 H new ATOM 0 HA HIS A 26 17.899 -2.399 -8.000 1.00 63.34 H new ATOM 0 HB2 HIS A 26 15.662 -1.575 -8.617 1.00 5.25 H new ATOM 0 HB3 HIS A 26 14.899 -2.704 -7.515 1.00 5.25 H new ATOM 0 HD2 HIS A 26 16.278 0.877 -7.495 1.00 74.44 H new ATOM 0 HE1 HIS A 26 15.624 -0.234 -3.467 1.00 34.44 H new ATOM 0 HE2 HIS A 26 16.129 1.732 -5.015 1.00 31.14 H new ATOM 422 N ARG A 27 16.332 -4.528 -5.978 1.00 41.24 N ATOM 423 CA ARG A 27 16.365 -5.295 -4.726 1.00 40.52 C ATOM 424 C ARG A 27 16.588 -6.779 -5.028 1.00 14.15 C ATOM 425 O ARG A 27 16.307 -7.245 -6.131 1.00 23.00 O ATOM 426 CB ARG A 27 15.022 -5.132 -3.955 1.00 31.34 C ATOM 427 CG ARG A 27 14.749 -3.736 -3.376 1.00 32.11 C ATOM 428 CD ARG A 27 15.768 -3.292 -2.311 1.00 60.13 C ATOM 429 NE ARG A 27 17.051 -2.825 -2.862 1.00 72.14 N ATOM 430 CZ ARG A 27 18.160 -2.607 -2.133 1.00 21.52 C ATOM 431 NH1 ARG A 27 18.157 -2.810 -0.813 1.00 43.54 N ATOM 432 NH2 ARG A 27 19.260 -2.184 -2.725 1.00 71.25 N ATOM 0 H ARG A 27 15.475 -4.677 -6.511 1.00 41.24 H new ATOM 0 HA ARG A 27 17.183 -4.916 -4.113 1.00 40.52 H new ATOM 0 HB2 ARG A 27 14.205 -5.392 -4.628 1.00 31.34 H new ATOM 0 HB3 ARG A 27 15.004 -5.853 -3.138 1.00 31.34 H new ATOM 0 HG2 ARG A 27 14.748 -3.010 -4.189 1.00 32.11 H new ATOM 0 HG3 ARG A 27 13.751 -3.724 -2.937 1.00 32.11 H new ATOM 0 HD2 ARG A 27 15.329 -2.492 -1.715 1.00 60.13 H new ATOM 0 HD3 ARG A 27 15.957 -4.126 -1.635 1.00 60.13 H new ATOM 0 HE ARG A 27 17.102 -2.655 -3.866 1.00 72.14 H new ATOM 0 HH11 ARG A 27 17.308 -3.133 -0.349 1.00 43.54 H new ATOM 0 HH12 ARG A 27 19.003 -2.642 -0.269 1.00 43.54 H new ATOM 0 HH21 ARG A 27 19.268 -2.023 -3.732 1.00 71.25 H new ATOM 0 HH22 ARG A 27 20.103 -2.017 -2.176 1.00 71.25 H new ATOM 446 N GLN A 28 17.152 -7.493 -4.050 1.00 54.33 N ATOM 447 CA GLN A 28 17.129 -8.965 -4.015 1.00 63.41 C ATOM 448 C GLN A 28 15.772 -9.387 -3.435 1.00 45.04 C ATOM 449 O GLN A 28 15.347 -8.804 -2.425 1.00 52.43 O ATOM 450 CB GLN A 28 18.300 -9.495 -3.139 1.00 14.35 C ATOM 451 CG GLN A 28 19.684 -8.972 -3.572 1.00 73.50 C ATOM 452 CD GLN A 28 20.079 -9.387 -4.993 1.00 12.40 C ATOM 453 OE1 GLN A 28 20.713 -10.423 -5.198 1.00 12.32 O ATOM 454 NE2 GLN A 28 19.704 -8.589 -5.984 1.00 13.23 N ATOM 0 H GLN A 28 17.638 -7.071 -3.259 1.00 54.33 H new ATOM 0 HA GLN A 28 17.255 -9.383 -5.014 1.00 63.41 H new ATOM 0 HB2 GLN A 28 18.123 -9.212 -2.101 1.00 14.35 H new ATOM 0 HB3 GLN A 28 18.305 -10.584 -3.176 1.00 14.35 H new ATOM 0 HG2 GLN A 28 19.689 -7.884 -3.505 1.00 73.50 H new ATOM 0 HG3 GLN A 28 20.436 -9.338 -2.873 1.00 73.50 H new ATOM 0 HE21 GLN A 28 19.180 -7.738 -5.783 1.00 13.23 H new ATOM 0 HE22 GLN A 28 19.940 -8.827 -6.947 1.00 13.23 H new ATOM 463 N SER A 29 15.082 -10.345 -4.095 1.00 1.34 N ATOM 464 CA SER A 29 13.743 -10.801 -3.665 1.00 61.11 C ATOM 465 C SER A 29 13.765 -11.291 -2.185 1.00 13.44 C ATOM 466 O SER A 29 14.491 -12.232 -1.864 1.00 11.21 O ATOM 467 CB SER A 29 13.237 -11.921 -4.626 1.00 41.53 C ATOM 468 OG SER A 29 14.158 -13.001 -4.718 1.00 42.44 O ATOM 0 H SER A 29 15.432 -10.817 -4.929 1.00 1.34 H new ATOM 0 HA SER A 29 13.051 -9.960 -3.714 1.00 61.11 H new ATOM 0 HB2 SER A 29 12.275 -12.294 -4.274 1.00 41.53 H new ATOM 0 HB3 SER A 29 13.072 -11.500 -5.618 1.00 41.53 H new ATOM 0 HG SER A 29 14.601 -13.128 -3.853 1.00 42.44 H new ATOM 474 N PRO A 30 12.964 -10.644 -1.262 1.00 1.13 N ATOM 475 CA PRO A 30 12.933 -10.998 0.182 1.00 55.04 C ATOM 476 C PRO A 30 12.245 -12.345 0.448 1.00 4.42 C ATOM 477 O PRO A 30 12.342 -12.887 1.547 1.00 13.02 O ATOM 478 CB PRO A 30 12.151 -9.815 0.840 1.00 33.03 C ATOM 479 CG PRO A 30 12.088 -8.753 -0.216 1.00 53.23 C ATOM 480 CD PRO A 30 12.082 -9.486 -1.527 1.00 74.13 C ATOM 0 HA PRO A 30 13.936 -11.125 0.590 1.00 55.04 H new ATOM 0 HB2 PRO A 30 11.152 -10.125 1.147 1.00 33.03 H new ATOM 0 HB3 PRO A 30 12.661 -9.453 1.733 1.00 33.03 H new ATOM 0 HG2 PRO A 30 11.192 -8.142 -0.104 1.00 53.23 H new ATOM 0 HG3 PRO A 30 12.943 -8.080 -0.147 1.00 53.23 H new ATOM 0 HD2 PRO A 30 11.077 -9.800 -1.810 1.00 74.13 H new ATOM 0 HD3 PRO A 30 12.462 -8.866 -2.339 1.00 74.13 H new ATOM 488 N ILE A 31 11.508 -12.845 -0.555 1.00 1.33 N ATOM 489 CA ILE A 31 10.905 -14.189 -0.503 1.00 22.43 C ATOM 490 C ILE A 31 12.054 -15.236 -0.475 1.00 52.24 C ATOM 491 O ILE A 31 12.799 -15.313 -1.459 1.00 14.31 O ATOM 492 CB ILE A 31 9.956 -14.474 -1.749 1.00 65.30 C ATOM 493 CG1 ILE A 31 9.128 -13.207 -2.167 1.00 42.13 C ATOM 494 CG2 ILE A 31 9.021 -15.677 -1.464 1.00 11.52 C ATOM 495 CD1 ILE A 31 8.167 -12.672 -1.124 1.00 23.43 C ATOM 0 H ILE A 31 11.313 -12.337 -1.418 1.00 1.33 H new ATOM 0 HA ILE A 31 10.287 -14.255 0.392 1.00 22.43 H new ATOM 0 HB ILE A 31 10.599 -14.727 -2.592 1.00 65.30 H new ATOM 0 HG12 ILE A 31 9.825 -12.412 -2.433 1.00 42.13 H new ATOM 0 HG13 ILE A 31 8.561 -13.447 -3.066 1.00 42.13 H new ATOM 0 HG21 ILE A 31 8.381 -15.854 -2.329 1.00 11.52 H new ATOM 0 HG22 ILE A 31 9.621 -16.566 -1.269 1.00 11.52 H new ATOM 0 HG23 ILE A 31 8.402 -15.459 -0.594 1.00 11.52 H new ATOM 0 HD11 ILE A 31 7.650 -11.798 -1.520 1.00 23.43 H new ATOM 0 HD12 ILE A 31 7.438 -13.442 -0.872 1.00 23.43 H new ATOM 0 HD13 ILE A 31 8.721 -12.391 -0.229 1.00 23.43 H new ATOM 507 N PRO A 32 12.251 -16.008 0.657 1.00 41.02 N ATOM 508 CA PRO A 32 13.370 -16.989 0.787 1.00 53.50 C ATOM 509 C PRO A 32 13.445 -17.997 -0.407 1.00 21.21 C ATOM 510 O PRO A 32 12.401 -18.430 -0.895 1.00 61.25 O ATOM 511 CB PRO A 32 13.083 -17.705 2.145 1.00 23.14 C ATOM 512 CG PRO A 32 11.699 -17.285 2.562 1.00 54.14 C ATOM 513 CD PRO A 32 11.440 -15.951 1.904 1.00 75.00 C ATOM 0 HA PRO A 32 14.343 -16.498 0.766 1.00 53.50 H new ATOM 0 HB2 PRO A 32 13.143 -18.788 2.034 1.00 23.14 H new ATOM 0 HB3 PRO A 32 13.819 -17.420 2.897 1.00 23.14 H new ATOM 0 HG2 PRO A 32 10.959 -18.022 2.249 1.00 54.14 H new ATOM 0 HG3 PRO A 32 11.629 -17.203 3.647 1.00 54.14 H new ATOM 0 HD2 PRO A 32 10.381 -15.811 1.687 1.00 75.00 H new ATOM 0 HD3 PRO A 32 11.747 -15.123 2.543 1.00 75.00 H new ATOM 521 N PRO A 33 14.695 -18.343 -0.903 1.00 74.51 N ATOM 522 CA PRO A 33 14.926 -19.219 -2.092 1.00 64.11 C ATOM 523 C PRO A 33 14.027 -20.481 -2.173 1.00 74.23 C ATOM 524 O PRO A 33 13.514 -20.813 -3.250 1.00 53.53 O ATOM 525 CB PRO A 33 16.435 -19.604 -1.990 1.00 1.41 C ATOM 526 CG PRO A 33 16.962 -18.951 -0.734 1.00 21.51 C ATOM 527 CD PRO A 33 15.993 -17.848 -0.377 1.00 42.01 C ATOM 0 HA PRO A 33 14.663 -18.684 -3.005 1.00 64.11 H new ATOM 0 HB2 PRO A 33 16.557 -20.686 -1.945 1.00 1.41 H new ATOM 0 HB3 PRO A 33 16.983 -19.258 -2.866 1.00 1.41 H new ATOM 0 HG2 PRO A 33 17.038 -19.676 0.076 1.00 21.51 H new ATOM 0 HG3 PRO A 33 17.962 -18.549 -0.897 1.00 21.51 H new ATOM 0 HD2 PRO A 33 15.953 -17.682 0.700 1.00 42.01 H new ATOM 0 HD3 PRO A 33 16.277 -16.901 -0.835 1.00 42.01 H new ATOM 535 N GLU A 34 13.827 -21.155 -1.032 1.00 25.24 N ATOM 536 CA GLU A 34 13.029 -22.397 -0.971 1.00 14.03 C ATOM 537 C GLU A 34 11.517 -22.092 -1.122 1.00 22.30 C ATOM 538 O GLU A 34 10.793 -22.818 -1.818 1.00 14.23 O ATOM 539 CB GLU A 34 13.334 -23.161 0.352 1.00 4.42 C ATOM 540 CG GLU A 34 12.936 -22.427 1.651 1.00 21.12 C ATOM 541 CD GLU A 34 13.478 -23.098 2.921 1.00 14.41 C ATOM 542 OE1 GLU A 34 12.875 -24.087 3.386 1.00 1.30 O ATOM 543 OE2 GLU A 34 14.507 -22.633 3.466 1.00 53.34 O ATOM 0 H GLU A 34 14.207 -20.862 -0.132 1.00 25.24 H new ATOM 0 HA GLU A 34 13.311 -23.039 -1.805 1.00 14.03 H new ATOM 0 HB2 GLU A 34 12.817 -24.120 0.324 1.00 4.42 H new ATOM 0 HB3 GLU A 34 14.402 -23.375 0.389 1.00 4.42 H new ATOM 0 HG2 GLU A 34 13.302 -21.401 1.607 1.00 21.12 H new ATOM 0 HG3 GLU A 34 11.849 -22.375 1.712 1.00 21.12 H new ATOM 550 N GLU A 35 11.066 -21.003 -0.469 1.00 21.23 N ATOM 551 CA GLU A 35 9.662 -20.543 -0.479 1.00 45.14 C ATOM 552 C GLU A 35 9.210 -20.089 -1.873 1.00 34.33 C ATOM 553 O GLU A 35 8.137 -20.488 -2.340 1.00 24.43 O ATOM 554 CB GLU A 35 9.505 -19.393 0.550 1.00 3.34 C ATOM 555 CG GLU A 35 8.086 -18.811 0.676 1.00 31.34 C ATOM 556 CD GLU A 35 7.934 -17.854 1.866 1.00 23.41 C ATOM 557 OE1 GLU A 35 7.967 -18.337 3.020 1.00 30.34 O ATOM 558 OE2 GLU A 35 7.781 -16.634 1.659 1.00 12.10 O ATOM 0 H GLU A 35 11.677 -20.408 0.090 1.00 21.23 H new ATOM 0 HA GLU A 35 9.022 -21.381 -0.204 1.00 45.14 H new ATOM 0 HB2 GLU A 35 9.818 -19.758 1.528 1.00 3.34 H new ATOM 0 HB3 GLU A 35 10.187 -18.588 0.277 1.00 3.34 H new ATOM 0 HG2 GLU A 35 7.833 -18.282 -0.243 1.00 31.34 H new ATOM 0 HG3 GLU A 35 7.372 -19.628 0.780 1.00 31.34 H new ATOM 565 N ARG A 36 10.056 -19.281 -2.547 1.00 44.01 N ATOM 566 CA ARG A 36 9.734 -18.690 -3.866 1.00 54.24 C ATOM 567 C ARG A 36 9.722 -19.737 -5.007 1.00 31.53 C ATOM 568 O ARG A 36 9.427 -19.395 -6.159 1.00 70.50 O ATOM 569 CB ARG A 36 10.724 -17.535 -4.190 1.00 42.52 C ATOM 570 CG ARG A 36 12.183 -17.974 -4.390 1.00 43.25 C ATOM 571 CD ARG A 36 13.148 -16.787 -4.555 1.00 33.52 C ATOM 572 NE ARG A 36 12.779 -15.916 -5.685 1.00 50.21 N ATOM 573 CZ ARG A 36 13.436 -15.828 -6.850 1.00 2.32 C ATOM 574 NH1 ARG A 36 14.516 -16.567 -7.095 1.00 51.33 N ATOM 575 NH2 ARG A 36 13.002 -14.989 -7.768 1.00 3.32 N ATOM 0 H ARG A 36 10.977 -19.020 -2.195 1.00 44.01 H new ATOM 0 HA ARG A 36 8.721 -18.292 -3.801 1.00 54.24 H new ATOM 0 HB2 ARG A 36 10.385 -17.027 -5.093 1.00 42.52 H new ATOM 0 HB3 ARG A 36 10.686 -16.805 -3.381 1.00 42.52 H new ATOM 0 HG2 ARG A 36 12.497 -18.575 -3.536 1.00 43.25 H new ATOM 0 HG3 ARG A 36 12.247 -18.613 -5.271 1.00 43.25 H new ATOM 0 HD2 ARG A 36 13.159 -16.201 -3.636 1.00 33.52 H new ATOM 0 HD3 ARG A 36 14.160 -17.163 -4.705 1.00 33.52 H new ATOM 0 HE ARG A 36 11.952 -15.330 -5.571 1.00 50.21 H new ATOM 0 HH11 ARG A 36 14.860 -17.217 -6.389 1.00 51.33 H new ATOM 0 HH12 ARG A 36 14.999 -16.483 -7.989 1.00 51.33 H new ATOM 0 HH21 ARG A 36 12.177 -14.418 -7.587 1.00 3.32 H new ATOM 0 HH22 ARG A 36 13.491 -14.911 -8.660 1.00 3.32 H new ATOM 589 N ASP A 37 10.057 -20.997 -4.683 1.00 41.21 N ATOM 590 CA ASP A 37 9.884 -22.125 -5.608 1.00 4.54 C ATOM 591 C ASP A 37 8.386 -22.461 -5.771 1.00 60.41 C ATOM 592 O ASP A 37 7.882 -22.578 -6.893 1.00 35.11 O ATOM 593 CB ASP A 37 10.676 -23.364 -5.118 1.00 32.11 C ATOM 594 CG ASP A 37 10.585 -24.535 -6.107 1.00 31.43 C ATOM 595 OD1 ASP A 37 11.101 -24.396 -7.238 1.00 13.44 O ATOM 596 OD2 ASP A 37 9.963 -25.571 -5.783 1.00 41.43 O ATOM 0 H ASP A 37 10.452 -21.259 -3.780 1.00 41.21 H new ATOM 0 HA ASP A 37 10.280 -21.836 -6.582 1.00 4.54 H new ATOM 0 HB2 ASP A 37 11.722 -23.092 -4.974 1.00 32.11 H new ATOM 0 HB3 ASP A 37 10.292 -23.679 -4.148 1.00 32.11 H new ATOM 601 N ASP A 38 7.678 -22.583 -4.636 1.00 44.40 N ATOM 602 CA ASP A 38 6.239 -22.947 -4.620 1.00 10.44 C ATOM 603 C ASP A 38 5.340 -21.722 -4.758 1.00 1.44 C ATOM 604 O ASP A 38 4.265 -21.795 -5.363 1.00 44.54 O ATOM 605 CB ASP A 38 5.880 -23.698 -3.322 1.00 51.12 C ATOM 606 CG ASP A 38 6.604 -25.040 -3.227 1.00 3.52 C ATOM 607 OD1 ASP A 38 6.102 -26.039 -3.796 1.00 72.42 O ATOM 608 OD2 ASP A 38 7.683 -25.104 -2.606 1.00 45.33 O ATOM 0 H ASP A 38 8.076 -22.435 -3.709 1.00 44.40 H new ATOM 0 HA ASP A 38 6.068 -23.597 -5.478 1.00 10.44 H new ATOM 0 HB2 ASP A 38 6.141 -23.082 -2.461 1.00 51.12 H new ATOM 0 HB3 ASP A 38 4.803 -23.862 -3.282 1.00 51.12 H new ATOM 613 N PHE A 39 5.783 -20.605 -4.177 1.00 41.12 N ATOM 614 CA PHE A 39 5.045 -19.335 -4.204 1.00 64.43 C ATOM 615 C PHE A 39 5.718 -18.399 -5.204 1.00 12.25 C ATOM 616 O PHE A 39 6.940 -18.364 -5.298 1.00 45.42 O ATOM 617 CB PHE A 39 4.982 -18.712 -2.787 1.00 34.05 C ATOM 618 CG PHE A 39 4.334 -19.646 -1.760 1.00 73.24 C ATOM 619 CD1 PHE A 39 2.983 -19.995 -1.862 1.00 11.20 C ATOM 620 CD2 PHE A 39 5.072 -20.190 -0.709 1.00 50.04 C ATOM 621 CE1 PHE A 39 2.399 -20.849 -0.940 1.00 30.23 C ATOM 622 CE2 PHE A 39 4.485 -21.041 0.210 1.00 31.34 C ATOM 623 CZ PHE A 39 3.148 -21.367 0.092 1.00 13.04 C ATOM 0 H PHE A 39 6.667 -20.553 -3.672 1.00 41.12 H new ATOM 0 HA PHE A 39 4.016 -19.507 -4.521 1.00 64.43 H new ATOM 0 HB2 PHE A 39 5.991 -18.462 -2.459 1.00 34.05 H new ATOM 0 HB3 PHE A 39 4.420 -17.779 -2.829 1.00 34.05 H new ATOM 0 HD1 PHE A 39 2.388 -19.594 -2.669 1.00 11.20 H new ATOM 0 HD2 PHE A 39 6.119 -19.943 -0.611 1.00 50.04 H new ATOM 0 HE1 PHE A 39 1.355 -21.108 -1.031 1.00 30.23 H new ATOM 0 HE2 PHE A 39 5.072 -21.450 1.019 1.00 31.34 H new ATOM 0 HZ PHE A 39 2.689 -22.030 0.811 1.00 13.04 H new ATOM 633 N ASP A 40 4.910 -17.667 -5.966 1.00 33.41 N ATOM 634 CA ASP A 40 5.382 -16.752 -7.021 1.00 14.30 C ATOM 635 C ASP A 40 6.116 -15.537 -6.410 1.00 54.23 C ATOM 636 O ASP A 40 6.191 -15.398 -5.184 1.00 73.45 O ATOM 637 CB ASP A 40 4.190 -16.279 -7.886 1.00 3.43 C ATOM 638 CG ASP A 40 3.330 -17.434 -8.423 1.00 34.32 C ATOM 639 OD1 ASP A 40 3.663 -18.005 -9.482 1.00 32.34 O ATOM 640 OD2 ASP A 40 2.317 -17.776 -7.777 1.00 34.13 O ATOM 0 H ASP A 40 3.894 -17.687 -5.873 1.00 33.41 H new ATOM 0 HA ASP A 40 6.087 -17.292 -7.653 1.00 14.30 H new ATOM 0 HB2 ASP A 40 3.562 -15.613 -7.294 1.00 3.43 H new ATOM 0 HB3 ASP A 40 4.569 -15.697 -8.726 1.00 3.43 H new ATOM 645 N GLY A 41 6.758 -14.754 -7.288 1.00 2.04 N ATOM 646 CA GLY A 41 7.183 -13.356 -7.022 1.00 75.13 C ATOM 647 C GLY A 41 6.104 -12.480 -6.352 1.00 51.22 C ATOM 648 O GLY A 41 5.414 -12.918 -5.424 1.00 34.41 O ATOM 0 H GLY A 41 7.005 -15.073 -8.225 1.00 2.04 H new ATOM 0 HA2 GLY A 41 8.068 -13.373 -6.385 1.00 75.13 H new ATOM 0 HA3 GLY A 41 7.477 -12.893 -7.964 1.00 75.13 H new ATOM 652 N LEU A 42 6.043 -11.186 -6.730 1.00 12.12 N ATOM 653 CA LEU A 42 5.000 -10.269 -6.203 1.00 51.43 C ATOM 654 C LEU A 42 3.604 -10.638 -6.762 1.00 42.51 C ATOM 655 O LEU A 42 3.088 -10.031 -7.706 1.00 60.34 O ATOM 656 CB LEU A 42 5.362 -8.773 -6.437 1.00 13.14 C ATOM 657 CG LEU A 42 6.351 -8.176 -5.389 1.00 60.54 C ATOM 658 CD1 LEU A 42 6.752 -6.743 -5.742 1.00 15.42 C ATOM 659 CD2 LEU A 42 5.773 -8.249 -3.948 1.00 2.02 C ATOM 0 H LEU A 42 6.691 -10.753 -7.388 1.00 12.12 H new ATOM 0 HA LEU A 42 4.959 -10.400 -5.122 1.00 51.43 H new ATOM 0 HB2 LEU A 42 5.798 -8.669 -7.430 1.00 13.14 H new ATOM 0 HB3 LEU A 42 4.445 -8.185 -6.429 1.00 13.14 H new ATOM 0 HG LEU A 42 7.251 -8.790 -5.419 1.00 60.54 H new ATOM 0 HD11 LEU A 42 7.441 -6.362 -4.989 1.00 15.42 H new ATOM 0 HD12 LEU A 42 7.238 -6.731 -6.718 1.00 15.42 H new ATOM 0 HD13 LEU A 42 5.863 -6.113 -5.772 1.00 15.42 H new ATOM 0 HD21 LEU A 42 6.490 -7.824 -3.246 1.00 2.02 H new ATOM 0 HD22 LEU A 42 4.841 -7.685 -3.901 1.00 2.02 H new ATOM 0 HD23 LEU A 42 5.581 -9.289 -3.685 1.00 2.02 H new ATOM 671 N SER A 43 3.052 -11.696 -6.151 1.00 4.33 N ATOM 672 CA SER A 43 1.686 -12.184 -6.339 1.00 0.54 C ATOM 673 C SER A 43 0.943 -11.918 -5.025 1.00 20.42 C ATOM 674 O SER A 43 1.544 -12.018 -3.939 1.00 52.35 O ATOM 675 CB SER A 43 1.701 -13.692 -6.681 1.00 43.33 C ATOM 676 OG SER A 43 2.409 -14.454 -5.705 1.00 2.52 O ATOM 0 H SER A 43 3.575 -12.259 -5.480 1.00 4.33 H new ATOM 0 HA SER A 43 1.189 -11.677 -7.167 1.00 0.54 H new ATOM 0 HB2 SER A 43 0.677 -14.058 -6.753 1.00 43.33 H new ATOM 0 HB3 SER A 43 2.161 -13.838 -7.658 1.00 43.33 H new ATOM 0 HG SER A 43 2.027 -15.355 -5.653 1.00 2.52 H new ATOM 682 N TYR A 44 -0.341 -11.574 -5.115 1.00 35.40 N ATOM 683 CA TYR A 44 -1.067 -10.986 -3.985 1.00 34.11 C ATOM 684 C TYR A 44 -2.587 -11.164 -4.155 1.00 25.34 C ATOM 685 O TYR A 44 -3.035 -11.937 -5.011 1.00 12.35 O ATOM 686 CB TYR A 44 -0.653 -9.484 -3.848 1.00 12.02 C ATOM 687 CG TYR A 44 -0.865 -8.604 -5.110 1.00 54.44 C ATOM 688 CD1 TYR A 44 0.124 -8.475 -6.100 1.00 71.20 C ATOM 689 CD2 TYR A 44 -2.049 -7.893 -5.301 1.00 5.12 C ATOM 690 CE1 TYR A 44 -0.079 -7.680 -7.221 1.00 13.34 C ATOM 691 CE2 TYR A 44 -2.249 -7.105 -6.416 1.00 40.24 C ATOM 692 CZ TYR A 44 -1.270 -7.000 -7.369 1.00 65.54 C ATOM 693 OH TYR A 44 -1.488 -6.209 -8.476 1.00 71.11 O ATOM 0 H TYR A 44 -0.902 -11.692 -5.959 1.00 35.40 H new ATOM 0 HA TYR A 44 -0.803 -11.502 -3.062 1.00 34.11 H new ATOM 0 HB2 TYR A 44 -1.216 -9.046 -3.024 1.00 12.02 H new ATOM 0 HB3 TYR A 44 0.401 -9.441 -3.572 1.00 12.02 H new ATOM 0 HD1 TYR A 44 1.059 -9.004 -5.987 1.00 71.20 H new ATOM 0 HD2 TYR A 44 -2.829 -7.961 -4.557 1.00 5.12 H new ATOM 0 HE1 TYR A 44 0.692 -7.595 -7.973 1.00 13.34 H new ATOM 0 HE2 TYR A 44 -3.179 -6.570 -6.538 1.00 40.24 H new ATOM 0 HH TYR A 44 -2.443 -6.000 -8.546 1.00 71.11 H new ATOM 703 N PHE A 45 -3.356 -10.457 -3.297 1.00 20.14 N ATOM 704 CA PHE A 45 -4.832 -10.401 -3.359 1.00 61.22 C ATOM 705 C PHE A 45 -5.265 -10.008 -4.787 1.00 34.13 C ATOM 706 O PHE A 45 -4.878 -8.952 -5.265 1.00 60.54 O ATOM 707 CB PHE A 45 -5.371 -9.355 -2.330 1.00 74.14 C ATOM 708 CG PHE A 45 -4.972 -9.602 -0.873 1.00 4.53 C ATOM 709 CD1 PHE A 45 -5.711 -10.467 -0.066 1.00 61.01 C ATOM 710 CD2 PHE A 45 -3.863 -8.971 -0.312 1.00 72.11 C ATOM 711 CE1 PHE A 45 -5.357 -10.693 1.249 1.00 3.10 C ATOM 712 CE2 PHE A 45 -3.514 -9.197 1.006 1.00 32.14 C ATOM 713 CZ PHE A 45 -4.259 -10.061 1.785 1.00 5.42 C ATOM 0 H PHE A 45 -2.964 -9.904 -2.535 1.00 20.14 H new ATOM 0 HA PHE A 45 -5.244 -11.379 -3.110 1.00 61.22 H new ATOM 0 HB2 PHE A 45 -5.017 -8.367 -2.623 1.00 74.14 H new ATOM 0 HB3 PHE A 45 -6.459 -9.336 -2.393 1.00 74.14 H new ATOM 0 HD1 PHE A 45 -6.575 -10.968 -0.477 1.00 61.01 H new ATOM 0 HD2 PHE A 45 -3.270 -8.298 -0.914 1.00 72.11 H new ATOM 0 HE1 PHE A 45 -5.942 -11.366 1.857 1.00 3.10 H new ATOM 0 HE2 PHE A 45 -2.656 -8.696 1.429 1.00 32.14 H new ATOM 0 HZ PHE A 45 -3.980 -10.240 2.813 1.00 5.42 H new ATOM 723 N ASP A 46 -6.052 -10.869 -5.455 1.00 40.12 N ATOM 724 CA ASP A 46 -6.377 -10.705 -6.889 1.00 43.21 C ATOM 725 C ASP A 46 -7.270 -9.464 -7.074 1.00 41.03 C ATOM 726 O ASP A 46 -8.288 -9.358 -6.390 1.00 71.22 O ATOM 727 CB ASP A 46 -7.056 -11.984 -7.473 1.00 11.50 C ATOM 728 CG ASP A 46 -6.041 -13.074 -7.873 1.00 63.55 C ATOM 729 OD1 ASP A 46 -5.243 -13.512 -7.014 1.00 22.32 O ATOM 730 OD2 ASP A 46 -6.019 -13.481 -9.058 1.00 63.31 O ATOM 0 H ASP A 46 -6.478 -11.690 -5.025 1.00 40.12 H new ATOM 0 HA ASP A 46 -5.450 -10.560 -7.443 1.00 43.21 H new ATOM 0 HB2 ASP A 46 -7.747 -12.391 -6.735 1.00 11.50 H new ATOM 0 HB3 ASP A 46 -7.648 -11.708 -8.346 1.00 11.50 H new ATOM 735 N PRO A 47 -6.872 -8.500 -7.971 1.00 61.41 N ATOM 736 CA PRO A 47 -7.613 -7.230 -8.199 1.00 23.41 C ATOM 737 C PRO A 47 -9.115 -7.436 -8.517 1.00 0.43 C ATOM 738 O PRO A 47 -9.474 -7.904 -9.604 1.00 23.42 O ATOM 739 CB PRO A 47 -6.853 -6.584 -9.392 1.00 75.41 C ATOM 740 CG PRO A 47 -5.469 -7.154 -9.310 1.00 63.14 C ATOM 741 CD PRO A 47 -5.651 -8.572 -8.823 1.00 15.10 C ATOM 0 HA PRO A 47 -7.632 -6.607 -7.305 1.00 23.41 H new ATOM 0 HB2 PRO A 47 -7.327 -6.828 -10.343 1.00 75.41 H new ATOM 0 HB3 PRO A 47 -6.840 -5.497 -9.312 1.00 75.41 H new ATOM 0 HG2 PRO A 47 -4.976 -7.132 -10.282 1.00 63.14 H new ATOM 0 HG3 PRO A 47 -4.847 -6.579 -8.624 1.00 63.14 H new ATOM 0 HD2 PRO A 47 -5.782 -9.266 -9.653 1.00 15.10 H new ATOM 0 HD3 PRO A 47 -4.786 -8.914 -8.255 1.00 15.10 H new ATOM 749 N ASP A 48 -9.976 -7.096 -7.534 1.00 54.14 N ATOM 750 CA ASP A 48 -11.442 -7.186 -7.670 1.00 23.24 C ATOM 751 C ASP A 48 -12.047 -5.776 -7.669 1.00 41.42 C ATOM 752 O ASP A 48 -11.947 -5.088 -6.650 1.00 61.53 O ATOM 753 CB ASP A 48 -12.098 -8.012 -6.520 1.00 51.12 C ATOM 754 CG ASP A 48 -11.723 -9.500 -6.538 1.00 12.24 C ATOM 755 OD1 ASP A 48 -12.027 -10.178 -7.532 1.00 33.02 O ATOM 756 OD2 ASP A 48 -11.152 -9.998 -5.547 1.00 63.33 O ATOM 0 H ASP A 48 -9.672 -6.751 -6.624 1.00 54.14 H new ATOM 0 HA ASP A 48 -11.645 -7.697 -8.611 1.00 23.24 H new ATOM 0 HB2 ASP A 48 -11.802 -7.583 -5.562 1.00 51.12 H new ATOM 0 HB3 ASP A 48 -13.182 -7.919 -6.590 1.00 51.12 H new ATOM 761 N PRO A 49 -12.688 -5.321 -8.797 1.00 51.44 N ATOM 762 CA PRO A 49 -13.586 -4.129 -8.785 1.00 31.30 C ATOM 763 C PRO A 49 -14.793 -4.320 -7.820 1.00 2.30 C ATOM 764 O PRO A 49 -15.423 -3.351 -7.384 1.00 43.35 O ATOM 765 CB PRO A 49 -14.047 -4.013 -10.268 1.00 61.43 C ATOM 766 CG PRO A 49 -13.013 -4.761 -11.063 1.00 60.35 C ATOM 767 CD PRO A 49 -12.560 -5.893 -10.168 1.00 13.04 C ATOM 0 HA PRO A 49 -13.087 -3.230 -8.423 1.00 31.30 H new ATOM 0 HB2 PRO A 49 -15.038 -4.445 -10.407 1.00 61.43 H new ATOM 0 HB3 PRO A 49 -14.106 -2.971 -10.581 1.00 61.43 H new ATOM 0 HG2 PRO A 49 -13.433 -5.141 -11.995 1.00 60.35 H new ATOM 0 HG3 PRO A 49 -12.178 -4.113 -11.330 1.00 60.35 H new ATOM 0 HD2 PRO A 49 -13.183 -6.779 -10.294 1.00 13.04 H new ATOM 0 HD3 PRO A 49 -11.534 -6.191 -10.385 1.00 13.04 H new ATOM 775 N ASP A 50 -15.101 -5.600 -7.528 1.00 25.25 N ATOM 776 CA ASP A 50 -16.081 -6.010 -6.501 1.00 22.33 C ATOM 777 C ASP A 50 -15.680 -5.521 -5.087 1.00 2.15 C ATOM 778 O ASP A 50 -16.520 -5.003 -4.335 1.00 11.54 O ATOM 779 CB ASP A 50 -16.226 -7.553 -6.512 1.00 2.11 C ATOM 780 CG ASP A 50 -17.185 -8.077 -5.430 1.00 73.51 C ATOM 781 OD1 ASP A 50 -18.410 -7.872 -5.559 1.00 31.53 O ATOM 782 OD2 ASP A 50 -16.713 -8.674 -4.435 1.00 23.33 O ATOM 0 H ASP A 50 -14.669 -6.390 -8.007 1.00 25.25 H new ATOM 0 HA ASP A 50 -17.037 -5.546 -6.744 1.00 22.33 H new ATOM 0 HB2 ASP A 50 -16.584 -7.871 -7.491 1.00 2.11 H new ATOM 0 HB3 ASP A 50 -15.245 -8.005 -6.369 1.00 2.11 H new ATOM 787 N TYR A 51 -14.387 -5.663 -4.754 1.00 25.41 N ATOM 788 CA TYR A 51 -13.863 -5.333 -3.403 1.00 1.31 C ATOM 789 C TYR A 51 -13.517 -3.823 -3.316 1.00 11.42 C ATOM 790 O TYR A 51 -13.277 -3.296 -2.221 1.00 45.23 O ATOM 791 CB TYR A 51 -12.615 -6.220 -3.074 1.00 75.45 C ATOM 792 CG TYR A 51 -12.500 -6.658 -1.593 1.00 40.53 C ATOM 793 CD1 TYR A 51 -12.369 -5.725 -0.555 1.00 24.33 C ATOM 794 CD2 TYR A 51 -12.549 -8.011 -1.235 1.00 14.41 C ATOM 795 CE1 TYR A 51 -12.289 -6.126 0.765 1.00 20.43 C ATOM 796 CE2 TYR A 51 -12.474 -8.406 0.086 1.00 31.11 C ATOM 797 CZ TYR A 51 -12.345 -7.464 1.077 1.00 30.52 C ATOM 798 OH TYR A 51 -12.281 -7.863 2.387 1.00 10.31 O ATOM 0 H TYR A 51 -13.676 -6.005 -5.400 1.00 25.41 H new ATOM 0 HA TYR A 51 -14.633 -5.546 -2.661 1.00 1.31 H new ATOM 0 HB2 TYR A 51 -12.646 -7.112 -3.700 1.00 75.45 H new ATOM 0 HB3 TYR A 51 -11.714 -5.670 -3.346 1.00 75.45 H new ATOM 0 HD1 TYR A 51 -12.330 -4.672 -0.792 1.00 24.33 H new ATOM 0 HD2 TYR A 51 -12.647 -8.760 -2.007 1.00 14.41 H new ATOM 0 HE1 TYR A 51 -12.183 -5.391 1.549 1.00 20.43 H new ATOM 0 HE2 TYR A 51 -12.517 -9.455 0.340 1.00 31.11 H new ATOM 0 HH TYR A 51 -12.335 -8.840 2.434 1.00 10.31 H new ATOM 808 N ARG A 52 -13.491 -3.156 -4.487 1.00 72.24 N ATOM 809 CA ARG A 52 -13.199 -1.717 -4.609 1.00 62.14 C ATOM 810 C ARG A 52 -14.158 -0.855 -3.763 1.00 50.42 C ATOM 811 O ARG A 52 -15.383 -0.985 -3.878 1.00 42.34 O ATOM 812 CB ARG A 52 -13.300 -1.278 -6.092 1.00 5.15 C ATOM 813 CG ARG A 52 -12.965 0.206 -6.334 1.00 61.23 C ATOM 814 CD ARG A 52 -12.983 0.584 -7.820 1.00 22.33 C ATOM 815 NE ARG A 52 -14.335 0.531 -8.396 1.00 74.41 N ATOM 816 CZ ARG A 52 -14.812 1.355 -9.345 1.00 41.51 C ATOM 817 NH1 ARG A 52 -14.053 2.321 -9.861 1.00 45.33 N ATOM 818 NH2 ARG A 52 -16.064 1.211 -9.760 1.00 31.12 N ATOM 0 H ARG A 52 -13.674 -3.608 -5.383 1.00 72.24 H new ATOM 0 HA ARG A 52 -12.186 -1.563 -4.237 1.00 62.14 H new ATOM 0 HB2 ARG A 52 -12.626 -1.893 -6.688 1.00 5.15 H new ATOM 0 HB3 ARG A 52 -14.311 -1.474 -6.449 1.00 5.15 H new ATOM 0 HG2 ARG A 52 -13.681 0.828 -5.797 1.00 61.23 H new ATOM 0 HG3 ARG A 52 -11.980 0.424 -5.920 1.00 61.23 H new ATOM 0 HD2 ARG A 52 -12.579 1.589 -7.941 1.00 22.33 H new ATOM 0 HD3 ARG A 52 -12.329 -0.091 -8.372 1.00 22.33 H new ATOM 0 HE ARG A 52 -14.964 -0.192 -8.046 1.00 74.41 H new ATOM 0 HH11 ARG A 52 -13.094 2.444 -9.537 1.00 45.33 H new ATOM 0 HH12 ARG A 52 -14.431 2.937 -10.580 1.00 45.33 H new ATOM 0 HH21 ARG A 52 -16.653 0.481 -9.359 1.00 31.12 H new ATOM 0 HH22 ARG A 52 -16.437 1.830 -10.480 1.00 31.12 H new ATOM 832 N VAL A 53 -13.584 0.018 -2.924 1.00 33.12 N ATOM 833 CA VAL A 53 -14.339 1.014 -2.145 1.00 73.11 C ATOM 834 C VAL A 53 -13.825 2.428 -2.493 1.00 74.11 C ATOM 835 O VAL A 53 -12.861 2.585 -3.260 1.00 42.42 O ATOM 836 CB VAL A 53 -14.240 0.745 -0.588 1.00 10.02 C ATOM 837 CG1 VAL A 53 -14.750 -0.673 -0.222 1.00 44.24 C ATOM 838 CG2 VAL A 53 -12.808 0.979 -0.054 1.00 31.31 C ATOM 0 H VAL A 53 -12.577 0.055 -2.764 1.00 33.12 H new ATOM 0 HA VAL A 53 -15.393 0.933 -2.411 1.00 73.11 H new ATOM 0 HB VAL A 53 -14.892 1.468 -0.098 1.00 10.02 H new ATOM 0 HG11 VAL A 53 -14.667 -0.823 0.854 1.00 44.24 H new ATOM 0 HG12 VAL A 53 -15.793 -0.774 -0.523 1.00 44.24 H new ATOM 0 HG13 VAL A 53 -14.149 -1.421 -0.740 1.00 44.24 H new ATOM 0 HG21 VAL A 53 -12.783 0.784 1.018 1.00 31.31 H new ATOM 0 HG22 VAL A 53 -12.116 0.307 -0.561 1.00 31.31 H new ATOM 0 HG23 VAL A 53 -12.514 2.012 -0.242 1.00 31.31 H new ATOM 848 N GLU A 54 -14.485 3.444 -1.932 1.00 22.53 N ATOM 849 CA GLU A 54 -14.106 4.860 -2.091 1.00 53.31 C ATOM 850 C GLU A 54 -13.752 5.437 -0.714 1.00 34.41 C ATOM 851 O GLU A 54 -14.261 4.952 0.301 1.00 33.44 O ATOM 852 CB GLU A 54 -15.273 5.661 -2.731 1.00 13.43 C ATOM 853 CG GLU A 54 -16.556 5.735 -1.874 1.00 61.13 C ATOM 854 CD GLU A 54 -17.646 6.625 -2.487 1.00 32.32 C ATOM 855 OE1 GLU A 54 -17.599 7.855 -2.274 1.00 4.12 O ATOM 856 OE2 GLU A 54 -18.554 6.099 -3.169 1.00 70.23 O ATOM 0 H GLU A 54 -15.309 3.310 -1.346 1.00 22.53 H new ATOM 0 HA GLU A 54 -13.242 4.936 -2.751 1.00 53.31 H new ATOM 0 HB2 GLU A 54 -14.930 6.675 -2.934 1.00 13.43 H new ATOM 0 HB3 GLU A 54 -15.521 5.210 -3.692 1.00 13.43 H new ATOM 0 HG2 GLU A 54 -16.952 4.729 -1.738 1.00 61.13 H new ATOM 0 HG3 GLU A 54 -16.302 6.114 -0.884 1.00 61.13 H new ATOM 863 N ALA A 55 -12.893 6.472 -0.682 1.00 34.32 N ATOM 864 CA ALA A 55 -12.478 7.140 0.567 1.00 31.11 C ATOM 865 C ALA A 55 -12.316 8.647 0.341 1.00 1.31 C ATOM 866 O ALA A 55 -11.943 9.079 -0.750 1.00 71.34 O ATOM 867 CB ALA A 55 -11.166 6.542 1.093 1.00 53.42 C ATOM 0 H ALA A 55 -12.467 6.869 -1.519 1.00 34.32 H new ATOM 0 HA ALA A 55 -13.256 6.978 1.313 1.00 31.11 H new ATOM 0 HB1 ALA A 55 -10.879 7.049 2.014 1.00 53.42 H new ATOM 0 HB2 ALA A 55 -11.304 5.479 1.292 1.00 53.42 H new ATOM 0 HB3 ALA A 55 -10.382 6.672 0.347 1.00 53.42 H new ATOM 873 N THR A 56 -12.616 9.433 1.381 1.00 3.10 N ATOM 874 CA THR A 56 -12.409 10.882 1.386 1.00 35.14 C ATOM 875 C THR A 56 -10.988 11.201 1.886 1.00 21.34 C ATOM 876 O THR A 56 -10.590 10.738 2.961 1.00 53.02 O ATOM 877 CB THR A 56 -13.466 11.578 2.299 1.00 10.33 C ATOM 878 OG1 THR A 56 -14.789 11.193 1.873 1.00 23.32 O ATOM 879 CG2 THR A 56 -13.333 13.119 2.275 1.00 54.32 C ATOM 0 H THR A 56 -13.013 9.076 2.250 1.00 3.10 H new ATOM 0 HA THR A 56 -12.526 11.259 0.370 1.00 35.14 H new ATOM 0 HB THR A 56 -13.290 11.254 3.325 1.00 10.33 H new ATOM 0 HG1 THR A 56 -15.456 11.627 2.445 1.00 23.32 H new ATOM 0 HG21 THR A 56 -14.089 13.560 2.925 1.00 54.32 H new ATOM 0 HG22 THR A 56 -12.341 13.404 2.627 1.00 54.32 H new ATOM 0 HG23 THR A 56 -13.475 13.481 1.257 1.00 54.32 H new ATOM 887 N VAL A 57 -10.241 11.975 1.085 1.00 43.41 N ATOM 888 CA VAL A 57 -8.893 12.458 1.432 1.00 45.32 C ATOM 889 C VAL A 57 -8.996 13.594 2.466 1.00 1.10 C ATOM 890 O VAL A 57 -9.809 14.505 2.304 1.00 61.54 O ATOM 891 CB VAL A 57 -8.136 13.003 0.156 1.00 71.42 C ATOM 892 CG1 VAL A 57 -6.669 13.359 0.484 1.00 20.55 C ATOM 893 CG2 VAL A 57 -8.219 11.993 -1.004 1.00 43.44 C ATOM 0 H VAL A 57 -10.558 12.288 0.167 1.00 43.41 H new ATOM 0 HA VAL A 57 -8.334 11.618 1.845 1.00 45.32 H new ATOM 0 HB VAL A 57 -8.632 13.920 -0.161 1.00 71.42 H new ATOM 0 HG11 VAL A 57 -6.175 13.731 -0.414 1.00 20.55 H new ATOM 0 HG12 VAL A 57 -6.645 14.128 1.256 1.00 20.55 H new ATOM 0 HG13 VAL A 57 -6.150 12.470 0.842 1.00 20.55 H new ATOM 0 HG21 VAL A 57 -7.691 12.390 -1.871 1.00 43.44 H new ATOM 0 HG22 VAL A 57 -7.761 11.052 -0.700 1.00 43.44 H new ATOM 0 HG23 VAL A 57 -9.264 11.821 -1.263 1.00 43.44 H new ATOM 903 N THR A 58 -8.173 13.523 3.518 1.00 40.25 N ATOM 904 CA THR A 58 -8.058 14.575 4.533 1.00 1.12 C ATOM 905 C THR A 58 -6.581 14.956 4.658 1.00 23.24 C ATOM 906 O THR A 58 -5.802 14.237 5.293 1.00 31.22 O ATOM 907 CB THR A 58 -8.613 14.087 5.910 1.00 63.05 C ATOM 908 OG1 THR A 58 -9.948 13.573 5.742 1.00 64.34 O ATOM 909 CG2 THR A 58 -8.627 15.211 6.965 1.00 44.04 C ATOM 0 H THR A 58 -7.562 12.725 3.690 1.00 40.25 H new ATOM 0 HA THR A 58 -8.648 15.441 4.233 1.00 1.12 H new ATOM 0 HB THR A 58 -7.947 13.302 6.269 1.00 63.05 H new ATOM 0 HG1 THR A 58 -10.292 13.267 6.607 1.00 64.34 H new ATOM 0 HG21 THR A 58 -9.021 14.823 7.905 1.00 44.04 H new ATOM 0 HG22 THR A 58 -7.612 15.577 7.120 1.00 44.04 H new ATOM 0 HG23 THR A 58 -9.258 16.029 6.617 1.00 44.04 H new ATOM 917 N VAL A 59 -6.198 16.080 4.045 1.00 31.30 N ATOM 918 CA VAL A 59 -4.794 16.511 3.974 1.00 62.33 C ATOM 919 C VAL A 59 -4.467 17.314 5.238 1.00 12.03 C ATOM 920 O VAL A 59 -5.203 18.235 5.593 1.00 32.21 O ATOM 921 CB VAL A 59 -4.493 17.346 2.665 1.00 13.21 C ATOM 922 CG1 VAL A 59 -3.061 17.947 2.670 1.00 51.11 C ATOM 923 CG2 VAL A 59 -4.704 16.458 1.418 1.00 31.10 C ATOM 0 H VAL A 59 -6.848 16.717 3.585 1.00 31.30 H new ATOM 0 HA VAL A 59 -4.154 15.630 3.921 1.00 62.33 H new ATOM 0 HB VAL A 59 -5.190 18.184 2.637 1.00 13.21 H new ATOM 0 HG11 VAL A 59 -2.900 18.512 1.752 1.00 51.11 H new ATOM 0 HG12 VAL A 59 -2.948 18.610 3.528 1.00 51.11 H new ATOM 0 HG13 VAL A 59 -2.329 17.142 2.734 1.00 51.11 H new ATOM 0 HG21 VAL A 59 -4.495 17.038 0.519 1.00 31.10 H new ATOM 0 HG22 VAL A 59 -4.030 15.602 1.462 1.00 31.10 H new ATOM 0 HG23 VAL A 59 -5.735 16.107 1.392 1.00 31.10 H new ATOM 933 N HIS A 60 -3.379 16.930 5.922 1.00 64.10 N ATOM 934 CA HIS A 60 -2.967 17.532 7.202 1.00 32.32 C ATOM 935 C HIS A 60 -2.021 18.708 6.954 1.00 43.04 C ATOM 936 O HIS A 60 -1.018 18.563 6.243 1.00 3.34 O ATOM 937 CB HIS A 60 -2.313 16.446 8.093 1.00 3.32 C ATOM 938 CG HIS A 60 -3.311 15.421 8.563 1.00 43.23 C ATOM 939 ND1 HIS A 60 -3.959 14.560 7.703 1.00 53.13 N ATOM 940 CD2 HIS A 60 -3.838 15.184 9.790 1.00 43.54 C ATOM 941 CE1 HIS A 60 -4.837 13.852 8.377 1.00 74.44 C ATOM 942 NE2 HIS A 60 -4.786 14.205 9.643 1.00 65.22 N ATOM 0 H HIS A 60 -2.756 16.189 5.602 1.00 64.10 H new ATOM 0 HA HIS A 60 -3.840 17.923 7.725 1.00 32.32 H new ATOM 0 HB2 HIS A 60 -1.520 15.949 7.534 1.00 3.32 H new ATOM 0 HB3 HIS A 60 -1.846 16.919 8.957 1.00 3.32 H new ATOM 0 HD2 HIS A 60 -3.562 15.675 10.711 1.00 43.54 H new ATOM 0 HE1 HIS A 60 -5.493 13.103 7.960 1.00 74.44 H new ATOM 0 HE2 HIS A 60 -5.358 13.815 10.392 1.00 65.22 H new ATOM 951 N GLU A 61 -2.376 19.866 7.551 1.00 14.33 N ATOM 952 CA GLU A 61 -1.630 21.142 7.448 1.00 21.34 C ATOM 953 C GLU A 61 -0.166 20.991 7.913 1.00 32.52 C ATOM 954 O GLU A 61 0.737 21.662 7.401 1.00 71.00 O ATOM 955 CB GLU A 61 -2.361 22.230 8.291 1.00 65.43 C ATOM 956 CG GLU A 61 -2.441 21.920 9.798 1.00 61.33 C ATOM 957 CD GLU A 61 -3.236 22.954 10.597 1.00 23.22 C ATOM 958 OE1 GLU A 61 -2.658 23.994 10.975 1.00 61.14 O ATOM 959 OE2 GLU A 61 -4.439 22.731 10.851 1.00 64.12 O ATOM 0 H GLU A 61 -3.210 19.943 8.133 1.00 14.33 H new ATOM 0 HA GLU A 61 -1.602 21.442 6.400 1.00 21.34 H new ATOM 0 HB2 GLU A 61 -1.849 23.183 8.155 1.00 65.43 H new ATOM 0 HB3 GLU A 61 -3.372 22.354 7.904 1.00 65.43 H new ATOM 0 HG2 GLU A 61 -2.897 20.939 9.935 1.00 61.33 H new ATOM 0 HG3 GLU A 61 -1.430 21.861 10.202 1.00 61.33 H new ATOM 966 N THR A 62 0.044 20.096 8.894 1.00 51.31 N ATOM 967 CA THR A 62 1.359 19.768 9.438 1.00 55.22 C ATOM 968 C THR A 62 1.565 18.245 9.303 1.00 23.45 C ATOM 969 O THR A 62 1.017 17.476 10.101 1.00 54.53 O ATOM 970 CB THR A 62 1.480 20.245 10.935 1.00 24.11 C ATOM 971 OG1 THR A 62 0.399 19.710 11.725 1.00 31.43 O ATOM 972 CG2 THR A 62 1.462 21.782 11.046 1.00 51.22 C ATOM 0 H THR A 62 -0.714 19.575 9.334 1.00 51.31 H new ATOM 0 HA THR A 62 2.140 20.288 8.884 1.00 55.22 H new ATOM 0 HB THR A 62 2.435 19.877 11.311 1.00 24.11 H new ATOM 0 HG1 THR A 62 0.227 18.783 11.459 1.00 31.43 H new ATOM 0 HG21 THR A 62 1.547 22.072 12.093 1.00 51.22 H new ATOM 0 HG22 THR A 62 2.299 22.197 10.485 1.00 51.22 H new ATOM 0 HG23 THR A 62 0.527 22.165 10.638 1.00 51.22 H new ATOM 980 N PRO A 63 2.271 17.774 8.223 1.00 2.41 N ATOM 981 CA PRO A 63 2.570 16.337 8.055 1.00 34.15 C ATOM 982 C PRO A 63 3.559 15.844 9.136 1.00 71.20 C ATOM 983 O PRO A 63 4.674 16.368 9.259 1.00 12.12 O ATOM 984 CB PRO A 63 3.174 16.264 6.623 1.00 52.12 C ATOM 985 CG PRO A 63 3.715 17.637 6.356 1.00 53.34 C ATOM 986 CD PRO A 63 2.787 18.586 7.083 1.00 52.05 C ATOM 0 HA PRO A 63 1.697 15.695 8.169 1.00 34.15 H new ATOM 0 HB2 PRO A 63 3.961 15.512 6.565 1.00 52.12 H new ATOM 0 HB3 PRO A 63 2.416 15.989 5.889 1.00 52.12 H new ATOM 0 HG2 PRO A 63 4.738 17.733 6.720 1.00 53.34 H new ATOM 0 HG3 PRO A 63 3.735 17.850 5.287 1.00 53.34 H new ATOM 0 HD2 PRO A 63 3.315 19.474 7.431 1.00 52.05 H new ATOM 0 HD3 PRO A 63 1.978 18.928 6.437 1.00 52.05 H new ATOM 994 N GLU A 64 3.137 14.835 9.910 1.00 34.40 N ATOM 995 CA GLU A 64 3.936 14.284 11.018 1.00 51.02 C ATOM 996 C GLU A 64 4.949 13.256 10.495 1.00 43.35 C ATOM 997 O GLU A 64 4.753 12.660 9.424 1.00 75.53 O ATOM 998 CB GLU A 64 3.001 13.646 12.091 1.00 21.42 C ATOM 999 CG GLU A 64 2.170 12.455 11.585 1.00 3.22 C ATOM 1000 CD GLU A 64 1.170 11.906 12.608 1.00 54.31 C ATOM 1001 OE1 GLU A 64 0.033 12.428 12.677 1.00 31.23 O ATOM 1002 OE2 GLU A 64 1.520 10.963 13.351 1.00 21.30 O ATOM 0 H GLU A 64 2.234 14.377 9.788 1.00 34.40 H new ATOM 0 HA GLU A 64 4.492 15.097 11.485 1.00 51.02 H new ATOM 0 HB2 GLU A 64 3.608 13.317 12.934 1.00 21.42 H new ATOM 0 HB3 GLU A 64 2.323 14.413 12.466 1.00 21.42 H new ATOM 0 HG2 GLU A 64 1.627 12.760 10.690 1.00 3.22 H new ATOM 0 HG3 GLU A 64 2.847 11.654 11.290 1.00 3.22 H new ATOM 1009 N SER A 65 6.026 13.054 11.261 1.00 33.23 N ATOM 1010 CA SER A 65 7.081 12.097 10.934 1.00 63.24 C ATOM 1011 C SER A 65 6.652 10.704 11.425 1.00 52.13 C ATOM 1012 O SER A 65 6.332 10.534 12.609 1.00 21.41 O ATOM 1013 CB SER A 65 8.398 12.550 11.601 1.00 44.25 C ATOM 1014 OG SER A 65 8.253 12.679 13.004 1.00 41.40 O ATOM 0 H SER A 65 6.189 13.557 12.133 1.00 33.23 H new ATOM 0 HA SER A 65 7.244 12.050 9.857 1.00 63.24 H new ATOM 0 HB2 SER A 65 9.185 11.829 11.381 1.00 44.25 H new ATOM 0 HB3 SER A 65 8.712 13.504 11.178 1.00 44.25 H new ATOM 0 HG SER A 65 7.533 12.090 13.314 1.00 41.40 H new ATOM 1020 N VAL A 66 6.600 9.727 10.502 1.00 3.44 N ATOM 1021 CA VAL A 66 6.187 8.334 10.800 1.00 44.42 C ATOM 1022 C VAL A 66 7.252 7.365 10.250 1.00 14.41 C ATOM 1023 O VAL A 66 7.616 7.448 9.075 1.00 10.11 O ATOM 1024 CB VAL A 66 4.769 7.988 10.175 1.00 52.32 C ATOM 1025 CG1 VAL A 66 4.285 6.575 10.595 1.00 14.14 C ATOM 1026 CG2 VAL A 66 3.720 9.074 10.535 1.00 43.51 C ATOM 0 H VAL A 66 6.843 9.877 9.523 1.00 3.44 H new ATOM 0 HA VAL A 66 6.100 8.229 11.881 1.00 44.42 H new ATOM 0 HB VAL A 66 4.884 7.980 9.091 1.00 52.32 H new ATOM 0 HG11 VAL A 66 3.311 6.376 10.147 1.00 14.14 H new ATOM 0 HG12 VAL A 66 5.001 5.828 10.253 1.00 14.14 H new ATOM 0 HG13 VAL A 66 4.202 6.527 11.681 1.00 14.14 H new ATOM 0 HG21 VAL A 66 2.758 8.811 10.094 1.00 43.51 H new ATOM 0 HG22 VAL A 66 3.618 9.136 11.618 1.00 43.51 H new ATOM 0 HG23 VAL A 66 4.046 10.038 10.146 1.00 43.51 H new ATOM 1036 N ASP A 67 7.732 6.448 11.104 1.00 44.31 N ATOM 1037 CA ASP A 67 8.767 5.469 10.733 1.00 0.43 C ATOM 1038 C ASP A 67 8.119 4.308 9.973 1.00 11.31 C ATOM 1039 O ASP A 67 7.388 3.512 10.567 1.00 42.12 O ATOM 1040 CB ASP A 67 9.496 4.936 11.995 1.00 33.45 C ATOM 1041 CG ASP A 67 10.389 5.986 12.661 1.00 14.11 C ATOM 1042 OD1 ASP A 67 9.893 6.745 13.524 1.00 30.32 O ATOM 1043 OD2 ASP A 67 11.590 6.070 12.316 1.00 12.53 O ATOM 0 H ASP A 67 7.415 6.364 12.070 1.00 44.31 H new ATOM 0 HA ASP A 67 9.503 5.958 10.095 1.00 0.43 H new ATOM 0 HB2 ASP A 67 8.756 4.588 12.715 1.00 33.45 H new ATOM 0 HB3 ASP A 67 10.103 4.073 11.720 1.00 33.45 H new ATOM 1048 N LEU A 68 8.362 4.235 8.655 1.00 43.24 N ATOM 1049 CA LEU A 68 7.904 3.112 7.808 1.00 74.43 C ATOM 1050 C LEU A 68 9.104 2.533 7.051 1.00 4.53 C ATOM 1051 O LEU A 68 10.131 3.207 6.917 1.00 31.14 O ATOM 1052 CB LEU A 68 6.810 3.554 6.800 1.00 22.30 C ATOM 1053 CG LEU A 68 5.553 4.248 7.406 1.00 25.33 C ATOM 1054 CD1 LEU A 68 4.604 4.719 6.298 1.00 43.34 C ATOM 1055 CD2 LEU A 68 4.814 3.340 8.419 1.00 2.23 C ATOM 0 H LEU A 68 8.880 4.949 8.143 1.00 43.24 H new ATOM 0 HA LEU A 68 7.463 2.355 8.457 1.00 74.43 H new ATOM 0 HB2 LEU A 68 7.263 4.235 6.080 1.00 22.30 H new ATOM 0 HB3 LEU A 68 6.481 2.676 6.245 1.00 22.30 H new ATOM 0 HG LEU A 68 5.902 5.121 7.957 1.00 25.33 H new ATOM 0 HD11 LEU A 68 3.734 5.200 6.744 1.00 43.34 H new ATOM 0 HD12 LEU A 68 5.121 5.430 5.654 1.00 43.34 H new ATOM 0 HD13 LEU A 68 4.281 3.862 5.707 1.00 43.34 H new ATOM 0 HD21 LEU A 68 3.946 3.867 8.814 1.00 2.23 H new ATOM 0 HD22 LEU A 68 4.488 2.427 7.920 1.00 2.23 H new ATOM 0 HD23 LEU A 68 5.487 3.085 9.238 1.00 2.23 H new ATOM 1067 N GLU A 69 8.962 1.294 6.544 1.00 53.44 N ATOM 1068 CA GLU A 69 10.037 0.611 5.807 1.00 11.20 C ATOM 1069 C GLU A 69 10.281 1.309 4.454 1.00 13.40 C ATOM 1070 O GLU A 69 9.341 1.816 3.814 1.00 22.50 O ATOM 1071 CB GLU A 69 9.683 -0.897 5.580 1.00 15.11 C ATOM 1072 CG GLU A 69 8.551 -1.156 4.547 1.00 51.54 C ATOM 1073 CD GLU A 69 8.102 -2.625 4.446 1.00 32.25 C ATOM 1074 OE1 GLU A 69 8.901 -3.483 4.001 1.00 1.55 O ATOM 1075 OE2 GLU A 69 6.939 -2.928 4.803 1.00 43.23 O ATOM 0 H GLU A 69 8.107 0.745 6.633 1.00 53.44 H new ATOM 0 HA GLU A 69 10.948 0.664 6.402 1.00 11.20 H new ATOM 0 HB2 GLU A 69 10.581 -1.420 5.252 1.00 15.11 H new ATOM 0 HB3 GLU A 69 9.390 -1.334 6.535 1.00 15.11 H new ATOM 0 HG2 GLU A 69 7.689 -0.543 4.811 1.00 51.54 H new ATOM 0 HG3 GLU A 69 8.890 -0.825 3.565 1.00 51.54 H new ATOM 1082 N THR A 70 11.551 1.394 4.058 1.00 43.34 N ATOM 1083 CA THR A 70 11.920 1.648 2.664 1.00 63.32 C ATOM 1084 C THR A 70 12.384 0.326 2.050 1.00 21.13 C ATOM 1085 O THR A 70 12.659 -0.645 2.776 1.00 25.43 O ATOM 1086 CB THR A 70 13.028 2.751 2.522 1.00 61.53 C ATOM 1087 OG1 THR A 70 13.202 3.097 1.138 1.00 50.33 O ATOM 1088 CG2 THR A 70 14.388 2.331 3.123 1.00 3.12 C ATOM 0 H THR A 70 12.347 1.290 4.687 1.00 43.34 H new ATOM 0 HA THR A 70 11.049 2.034 2.134 1.00 63.32 H new ATOM 0 HB THR A 70 12.681 3.614 3.091 1.00 61.53 H new ATOM 0 HG1 THR A 70 13.893 3.787 1.058 1.00 50.33 H new ATOM 0 HG21 THR A 70 15.109 3.138 2.991 1.00 3.12 H new ATOM 0 HG22 THR A 70 14.267 2.122 4.186 1.00 3.12 H new ATOM 0 HG23 THR A 70 14.749 1.436 2.616 1.00 3.12 H new ATOM 1096 N SER A 71 12.465 0.295 0.719 1.00 21.02 N ATOM 1097 CA SER A 71 12.920 -0.877 -0.018 1.00 21.31 C ATOM 1098 C SER A 71 14.382 -1.181 0.310 1.00 11.54 C ATOM 1099 O SER A 71 14.745 -2.332 0.493 1.00 2.43 O ATOM 1100 CB SER A 71 12.743 -0.635 -1.524 1.00 2.23 C ATOM 1101 OG SER A 71 13.441 0.523 -1.958 1.00 34.04 O ATOM 0 H SER A 71 12.216 1.085 0.124 1.00 21.02 H new ATOM 0 HA SER A 71 12.322 -1.740 0.276 1.00 21.31 H new ATOM 0 HB2 SER A 71 13.101 -1.504 -2.076 1.00 2.23 H new ATOM 0 HB3 SER A 71 11.683 -0.527 -1.753 1.00 2.23 H new ATOM 0 HG SER A 71 13.338 0.623 -2.927 1.00 34.04 H new ATOM 1107 N ASP A 72 15.212 -0.122 0.328 1.00 50.01 N ATOM 1108 CA ASP A 72 16.651 -0.184 0.653 1.00 12.03 C ATOM 1109 C ASP A 72 16.974 -0.527 2.134 1.00 34.03 C ATOM 1110 O ASP A 72 17.588 0.277 2.843 1.00 22.54 O ATOM 1111 CB ASP A 72 17.311 1.166 0.237 1.00 33.14 C ATOM 1112 CG ASP A 72 17.162 1.448 -1.262 1.00 21.22 C ATOM 1113 OD1 ASP A 72 16.101 1.970 -1.673 1.00 2.02 O ATOM 1114 OD2 ASP A 72 18.086 1.122 -2.039 1.00 23.11 O ATOM 0 H ASP A 72 14.894 0.823 0.112 1.00 50.01 H new ATOM 0 HA ASP A 72 17.068 -1.018 0.088 1.00 12.03 H new ATOM 0 HB2 ASP A 72 16.858 1.979 0.804 1.00 33.14 H new ATOM 0 HB3 ASP A 72 18.369 1.146 0.497 1.00 33.14 H new ATOM 1119 N ASP A 73 16.482 -1.695 2.605 1.00 23.41 N ATOM 1120 CA ASP A 73 17.001 -2.421 3.805 1.00 34.54 C ATOM 1121 C ASP A 73 16.742 -1.718 5.156 1.00 13.35 C ATOM 1122 O ASP A 73 17.005 -2.301 6.211 1.00 50.52 O ATOM 1123 CB ASP A 73 18.524 -2.729 3.666 1.00 30.12 C ATOM 1124 CG ASP A 73 18.906 -3.412 2.337 1.00 24.41 C ATOM 1125 OD1 ASP A 73 18.352 -4.489 2.030 1.00 13.23 O ATOM 1126 OD2 ASP A 73 19.777 -2.877 1.607 1.00 70.54 O ATOM 0 H ASP A 73 15.700 -2.175 2.160 1.00 23.41 H new ATOM 0 HA ASP A 73 16.426 -3.347 3.826 1.00 34.54 H new ATOM 0 HB2 ASP A 73 19.083 -1.798 3.758 1.00 30.12 H new ATOM 0 HB3 ASP A 73 18.832 -3.368 4.493 1.00 30.12 H new ATOM 1131 N ARG A 74 16.182 -0.504 5.126 1.00 73.24 N ATOM 1132 CA ARG A 74 16.200 0.424 6.276 1.00 41.43 C ATOM 1133 C ARG A 74 14.748 0.869 6.631 1.00 60.32 C ATOM 1134 O ARG A 74 13.771 0.382 6.046 1.00 30.31 O ATOM 1135 CB ARG A 74 17.149 1.626 5.891 1.00 33.44 C ATOM 1136 CG ARG A 74 17.680 2.479 7.066 1.00 53.53 C ATOM 1137 CD ARG A 74 18.646 3.597 6.643 1.00 72.53 C ATOM 1138 NE ARG A 74 18.936 4.513 7.765 1.00 32.20 N ATOM 1139 CZ ARG A 74 18.264 5.644 8.038 1.00 22.31 C ATOM 1140 NH1 ARG A 74 17.227 6.026 7.293 1.00 54.44 N ATOM 1141 NH2 ARG A 74 18.627 6.390 9.073 1.00 35.52 N ATOM 0 H ARG A 74 15.702 -0.131 4.307 1.00 73.24 H new ATOM 0 HA ARG A 74 16.588 -0.051 7.177 1.00 41.43 H new ATOM 0 HB2 ARG A 74 18.003 1.227 5.344 1.00 33.44 H new ATOM 0 HB3 ARG A 74 16.611 2.282 5.207 1.00 33.44 H new ATOM 0 HG2 ARG A 74 16.834 2.924 7.590 1.00 53.53 H new ATOM 0 HG3 ARG A 74 18.186 1.825 7.776 1.00 53.53 H new ATOM 0 HD2 ARG A 74 19.576 3.158 6.280 1.00 72.53 H new ATOM 0 HD3 ARG A 74 18.214 4.159 5.815 1.00 72.53 H new ATOM 0 HE ARG A 74 19.709 4.267 8.383 1.00 32.20 H new ATOM 0 HH11 ARG A 74 16.931 5.456 6.500 1.00 54.44 H new ATOM 0 HH12 ARG A 74 16.729 6.888 7.516 1.00 54.44 H new ATOM 0 HH21 ARG A 74 19.413 6.104 9.657 1.00 35.52 H new ATOM 0 HH22 ARG A 74 18.120 7.250 9.285 1.00 35.52 H new ATOM 1155 N THR A 75 14.642 1.805 7.582 1.00 72.13 N ATOM 1156 CA THR A 75 13.398 2.439 8.011 1.00 40.20 C ATOM 1157 C THR A 75 13.642 3.940 7.873 1.00 21.14 C ATOM 1158 O THR A 75 14.753 4.420 8.157 1.00 63.21 O ATOM 1159 CB THR A 75 13.026 2.072 9.482 1.00 74.25 C ATOM 1160 OG1 THR A 75 12.842 0.659 9.584 1.00 14.01 O ATOM 1161 CG2 THR A 75 11.743 2.761 9.962 1.00 23.22 C ATOM 0 H THR A 75 15.455 2.152 8.091 1.00 72.13 H new ATOM 0 HA THR A 75 12.559 2.098 7.405 1.00 40.20 H new ATOM 0 HB THR A 75 13.847 2.416 10.112 1.00 74.25 H new ATOM 0 HG1 THR A 75 11.936 0.470 9.907 1.00 14.01 H new ATOM 0 HG21 THR A 75 11.536 2.467 10.991 1.00 23.22 H new ATOM 0 HG22 THR A 75 11.870 3.842 9.912 1.00 23.22 H new ATOM 0 HG23 THR A 75 10.910 2.464 9.325 1.00 23.22 H new ATOM 1169 N VAL A 76 12.632 4.671 7.421 1.00 65.35 N ATOM 1170 CA VAL A 76 12.786 6.070 6.997 1.00 32.41 C ATOM 1171 C VAL A 76 11.566 6.894 7.395 1.00 3.31 C ATOM 1172 O VAL A 76 10.492 6.354 7.695 1.00 5.11 O ATOM 1173 CB VAL A 76 13.040 6.210 5.444 1.00 13.51 C ATOM 1174 CG1 VAL A 76 14.434 5.685 5.048 1.00 12.21 C ATOM 1175 CG2 VAL A 76 11.939 5.512 4.630 1.00 41.13 C ATOM 0 H VAL A 76 11.679 4.317 7.335 1.00 65.35 H new ATOM 0 HA VAL A 76 13.668 6.453 7.511 1.00 32.41 H new ATOM 0 HB VAL A 76 13.007 7.274 5.208 1.00 13.51 H new ATOM 0 HG11 VAL A 76 14.573 5.797 3.973 1.00 12.21 H new ATOM 0 HG12 VAL A 76 15.200 6.254 5.575 1.00 12.21 H new ATOM 0 HG13 VAL A 76 14.516 4.632 5.316 1.00 12.21 H new ATOM 0 HG21 VAL A 76 12.145 5.628 3.566 1.00 41.13 H new ATOM 0 HG22 VAL A 76 11.917 4.452 4.882 1.00 41.13 H new ATOM 0 HG23 VAL A 76 10.974 5.961 4.864 1.00 41.13 H new ATOM 1185 N ARG A 77 11.774 8.212 7.384 1.00 61.02 N ATOM 1186 CA ARG A 77 10.762 9.210 7.708 1.00 61.13 C ATOM 1187 C ARG A 77 9.795 9.339 6.517 1.00 1.05 C ATOM 1188 O ARG A 77 10.196 9.736 5.422 1.00 51.55 O ATOM 1189 CB ARG A 77 11.491 10.560 8.041 1.00 12.44 C ATOM 1190 CG ARG A 77 10.646 11.696 8.689 1.00 60.31 C ATOM 1191 CD ARG A 77 9.623 12.342 7.734 1.00 64.01 C ATOM 1192 NE ARG A 77 10.206 12.612 6.410 1.00 63.14 N ATOM 1193 CZ ARG A 77 10.766 13.763 6.016 1.00 24.41 C ATOM 1194 NH1 ARG A 77 10.820 14.831 6.808 1.00 5.14 N ATOM 1195 NH2 ARG A 77 11.316 13.827 4.824 1.00 52.34 N ATOM 0 H ARG A 77 12.676 8.622 7.143 1.00 61.02 H new ATOM 0 HA ARG A 77 10.173 8.922 8.579 1.00 61.13 H new ATOM 0 HB2 ARG A 77 12.322 10.337 8.710 1.00 12.44 H new ATOM 0 HB3 ARG A 77 11.921 10.947 7.117 1.00 12.44 H new ATOM 0 HG2 ARG A 77 10.117 11.293 9.553 1.00 60.31 H new ATOM 0 HG3 ARG A 77 11.319 12.469 9.060 1.00 60.31 H new ATOM 0 HD2 ARG A 77 8.762 11.683 7.624 1.00 64.01 H new ATOM 0 HD3 ARG A 77 9.259 13.273 8.168 1.00 64.01 H new ATOM 0 HE ARG A 77 10.181 11.852 5.730 1.00 63.14 H new ATOM 0 HH11 ARG A 77 10.427 14.789 7.748 1.00 5.14 H new ATOM 0 HH12 ARG A 77 11.254 15.692 6.475 1.00 5.14 H new ATOM 0 HH21 ARG A 77 11.312 13.008 4.216 1.00 52.34 H new ATOM 0 HH22 ARG A 77 11.747 14.695 4.507 1.00 52.34 H new ATOM 1209 N TYR A 78 8.545 8.952 6.744 1.00 43.21 N ATOM 1210 CA TYR A 78 7.412 9.250 5.862 1.00 34.33 C ATOM 1211 C TYR A 78 6.587 10.386 6.483 1.00 10.03 C ATOM 1212 O TYR A 78 6.331 10.389 7.691 1.00 22.34 O ATOM 1213 CB TYR A 78 6.530 7.992 5.677 1.00 32.11 C ATOM 1214 CG TYR A 78 7.046 6.970 4.650 1.00 62.21 C ATOM 1215 CD1 TYR A 78 8.198 6.224 4.881 1.00 22.31 C ATOM 1216 CD2 TYR A 78 6.358 6.740 3.455 1.00 51.52 C ATOM 1217 CE1 TYR A 78 8.639 5.287 3.968 1.00 15.23 C ATOM 1218 CE2 TYR A 78 6.796 5.799 2.541 1.00 53.11 C ATOM 1219 CZ TYR A 78 7.941 5.076 2.800 1.00 42.12 C ATOM 1220 OH TYR A 78 8.384 4.131 1.897 1.00 62.02 O ATOM 0 H TYR A 78 8.280 8.409 7.566 1.00 43.21 H new ATOM 0 HA TYR A 78 7.782 9.555 4.883 1.00 34.33 H new ATOM 0 HB2 TYR A 78 6.430 7.494 6.641 1.00 32.11 H new ATOM 0 HB3 TYR A 78 5.531 8.310 5.378 1.00 32.11 H new ATOM 0 HD1 TYR A 78 8.757 6.381 5.791 1.00 22.31 H new ATOM 0 HD2 TYR A 78 5.465 7.309 3.241 1.00 51.52 H new ATOM 0 HE1 TYR A 78 9.534 4.718 4.171 1.00 15.23 H new ATOM 0 HE2 TYR A 78 6.243 5.631 1.628 1.00 53.11 H new ATOM 0 HH TYR A 78 8.715 3.346 2.381 1.00 62.02 H new ATOM 1230 N LEU A 79 6.198 11.348 5.652 1.00 65.01 N ATOM 1231 CA LEU A 79 5.346 12.474 6.053 1.00 44.22 C ATOM 1232 C LEU A 79 3.884 12.094 5.859 1.00 2.51 C ATOM 1233 O LEU A 79 3.495 11.695 4.754 1.00 13.34 O ATOM 1234 CB LEU A 79 5.713 13.723 5.214 1.00 31.42 C ATOM 1235 CG LEU A 79 7.113 14.322 5.523 1.00 12.45 C ATOM 1236 CD1 LEU A 79 7.520 15.380 4.481 1.00 14.00 C ATOM 1237 CD2 LEU A 79 7.157 14.894 6.957 1.00 31.20 C ATOM 0 H LEU A 79 6.466 11.372 4.668 1.00 65.01 H new ATOM 0 HA LEU A 79 5.505 12.709 7.105 1.00 44.22 H new ATOM 0 HB2 LEU A 79 5.670 13.460 4.157 1.00 31.42 H new ATOM 0 HB3 LEU A 79 4.959 14.492 5.382 1.00 31.42 H new ATOM 0 HG LEU A 79 7.843 13.515 5.460 1.00 12.45 H new ATOM 0 HD11 LEU A 79 8.504 15.776 4.730 1.00 14.00 H new ATOM 0 HD12 LEU A 79 7.553 14.923 3.492 1.00 14.00 H new ATOM 0 HD13 LEU A 79 6.792 16.191 4.482 1.00 14.00 H new ATOM 0 HD21 LEU A 79 8.146 15.308 7.153 1.00 31.20 H new ATOM 0 HD22 LEU A 79 6.408 15.679 7.059 1.00 31.20 H new ATOM 0 HD23 LEU A 79 6.949 14.099 7.673 1.00 31.20 H new ATOM 1249 N HIS A 80 3.085 12.193 6.940 1.00 14.12 N ATOM 1250 CA HIS A 80 1.648 11.917 6.874 1.00 34.33 C ATOM 1251 C HIS A 80 0.956 13.087 6.169 1.00 12.15 C ATOM 1252 O HIS A 80 0.634 14.113 6.781 1.00 51.43 O ATOM 1253 CB HIS A 80 1.087 11.702 8.301 1.00 43.14 C ATOM 1254 CG HIS A 80 -0.383 11.393 8.364 1.00 25.04 C ATOM 1255 ND1 HIS A 80 -1.195 11.970 9.307 1.00 10.34 N ATOM 1256 CD2 HIS A 80 -1.121 10.549 7.604 1.00 50.51 C ATOM 1257 CE1 HIS A 80 -2.394 11.470 9.102 1.00 32.20 C ATOM 1258 NE2 HIS A 80 -2.398 10.607 8.079 1.00 54.42 N ATOM 0 H HIS A 80 3.417 12.462 7.866 1.00 14.12 H new ATOM 0 HA HIS A 80 1.461 11.005 6.307 1.00 34.33 H new ATOM 0 HB2 HIS A 80 1.635 10.886 8.772 1.00 43.14 H new ATOM 0 HB3 HIS A 80 1.281 12.598 8.890 1.00 43.14 H new ATOM 0 HD1 HIS A 80 -0.925 12.647 10.020 1.00 10.34 H new ATOM 0 HD2 HIS A 80 -0.767 9.946 6.781 1.00 50.51 H new ATOM 0 HE1 HIS A 80 -3.266 11.724 9.686 1.00 32.20 H new ATOM 1266 N VAL A 81 0.733 12.902 4.868 1.00 51.52 N ATOM 1267 CA VAL A 81 0.173 13.938 3.996 1.00 62.01 C ATOM 1268 C VAL A 81 -1.357 13.921 4.046 1.00 51.12 C ATOM 1269 O VAL A 81 -1.990 14.977 3.990 1.00 44.11 O ATOM 1270 CB VAL A 81 0.697 13.783 2.518 1.00 71.13 C ATOM 1271 CG1 VAL A 81 2.240 13.931 2.468 1.00 73.12 C ATOM 1272 CG2 VAL A 81 0.243 12.448 1.883 1.00 21.01 C ATOM 0 H VAL A 81 0.936 12.026 4.386 1.00 51.52 H new ATOM 0 HA VAL A 81 0.511 14.907 4.364 1.00 62.01 H new ATOM 0 HB VAL A 81 0.256 14.584 1.925 1.00 71.13 H new ATOM 0 HG11 VAL A 81 2.583 13.821 1.439 1.00 73.12 H new ATOM 0 HG12 VAL A 81 2.523 14.915 2.842 1.00 73.12 H new ATOM 0 HG13 VAL A 81 2.700 13.161 3.088 1.00 73.12 H new ATOM 0 HG21 VAL A 81 0.625 12.381 0.864 1.00 21.01 H new ATOM 0 HG22 VAL A 81 0.629 11.615 2.471 1.00 21.01 H new ATOM 0 HG23 VAL A 81 -0.846 12.405 1.865 1.00 21.01 H new ATOM 1282 N ALA A 82 -1.946 12.719 4.200 1.00 24.33 N ATOM 1283 CA ALA A 82 -3.407 12.552 4.141 1.00 75.33 C ATOM 1284 C ALA A 82 -3.890 11.327 4.930 1.00 62.24 C ATOM 1285 O ALA A 82 -3.124 10.413 5.210 1.00 14.35 O ATOM 1286 CB ALA A 82 -3.866 12.462 2.672 1.00 51.55 C ATOM 0 H ALA A 82 -1.432 11.853 4.366 1.00 24.33 H new ATOM 0 HA ALA A 82 -3.855 13.427 4.611 1.00 75.33 H new ATOM 0 HB1 ALA A 82 -4.948 12.338 2.636 1.00 51.55 H new ATOM 0 HB2 ALA A 82 -3.587 13.376 2.147 1.00 51.55 H new ATOM 0 HB3 ALA A 82 -3.387 11.608 2.193 1.00 51.55 H new ATOM 1292 N THR A 83 -5.178 11.356 5.305 1.00 23.22 N ATOM 1293 CA THR A 83 -5.913 10.200 5.836 1.00 31.04 C ATOM 1294 C THR A 83 -7.083 9.914 4.886 1.00 33.22 C ATOM 1295 O THR A 83 -7.859 10.822 4.557 1.00 1.11 O ATOM 1296 CB THR A 83 -6.460 10.459 7.280 1.00 1.03 C ATOM 1297 OG1 THR A 83 -5.367 10.776 8.156 1.00 3.22 O ATOM 1298 CG2 THR A 83 -7.241 9.247 7.843 1.00 32.21 C ATOM 0 H THR A 83 -5.748 12.200 5.246 1.00 23.22 H new ATOM 0 HA THR A 83 -5.234 9.350 5.901 1.00 31.04 H new ATOM 0 HB THR A 83 -7.156 11.295 7.221 1.00 1.03 H new ATOM 0 HG1 THR A 83 -4.520 10.567 7.711 1.00 3.22 H new ATOM 0 HG21 THR A 83 -7.599 9.479 8.846 1.00 32.21 H new ATOM 0 HG22 THR A 83 -8.091 9.029 7.196 1.00 32.21 H new ATOM 0 HG23 THR A 83 -6.584 8.378 7.884 1.00 32.21 H new ATOM 1306 N LEU A 84 -7.182 8.662 4.436 1.00 52.35 N ATOM 1307 CA LEU A 84 -8.224 8.219 3.503 1.00 54.52 C ATOM 1308 C LEU A 84 -9.319 7.524 4.336 1.00 61.35 C ATOM 1309 O LEU A 84 -9.141 6.389 4.787 1.00 21.11 O ATOM 1310 CB LEU A 84 -7.610 7.275 2.417 1.00 71.52 C ATOM 1311 CG LEU A 84 -6.252 7.747 1.776 1.00 64.01 C ATOM 1312 CD1 LEU A 84 -5.798 6.792 0.650 1.00 12.22 C ATOM 1313 CD2 LEU A 84 -6.303 9.219 1.286 1.00 52.11 C ATOM 0 H LEU A 84 -6.538 7.920 4.710 1.00 52.35 H new ATOM 0 HA LEU A 84 -8.662 9.059 2.964 1.00 54.52 H new ATOM 0 HB2 LEU A 84 -7.455 6.293 2.864 1.00 71.52 H new ATOM 0 HB3 LEU A 84 -8.341 7.150 1.618 1.00 71.52 H new ATOM 0 HG LEU A 84 -5.504 7.709 2.568 1.00 64.01 H new ATOM 0 HD11 LEU A 84 -4.857 7.147 0.229 1.00 12.22 H new ATOM 0 HD12 LEU A 84 -5.658 5.790 1.057 1.00 12.22 H new ATOM 0 HD13 LEU A 84 -6.557 6.764 -0.131 1.00 12.22 H new ATOM 0 HD21 LEU A 84 -5.341 9.492 0.853 1.00 52.11 H new ATOM 0 HD22 LEU A 84 -7.083 9.325 0.532 1.00 52.11 H new ATOM 0 HD23 LEU A 84 -6.521 9.876 2.128 1.00 52.11 H new ATOM 1325 N SER A 85 -10.408 8.256 4.590 1.00 44.41 N ATOM 1326 CA SER A 85 -11.508 7.830 5.474 1.00 1.43 C ATOM 1327 C SER A 85 -12.632 7.154 4.669 1.00 32.32 C ATOM 1328 O SER A 85 -13.181 7.761 3.748 1.00 54.52 O ATOM 1329 CB SER A 85 -12.044 9.072 6.214 1.00 34.14 C ATOM 1330 OG SER A 85 -11.020 9.663 6.990 1.00 43.15 O ATOM 0 H SER A 85 -10.557 9.179 4.182 1.00 44.41 H new ATOM 0 HA SER A 85 -11.137 7.098 6.192 1.00 1.43 H new ATOM 0 HB2 SER A 85 -12.427 9.795 5.494 1.00 34.14 H new ATOM 0 HB3 SER A 85 -12.878 8.789 6.856 1.00 34.14 H new ATOM 0 HG SER A 85 -10.705 9.021 7.660 1.00 43.15 H new ATOM 1336 N PHE A 86 -12.996 5.914 5.046 1.00 35.22 N ATOM 1337 CA PHE A 86 -13.989 5.100 4.321 1.00 54.43 C ATOM 1338 C PHE A 86 -14.723 4.149 5.285 1.00 61.32 C ATOM 1339 O PHE A 86 -14.581 4.251 6.506 1.00 72.30 O ATOM 1340 CB PHE A 86 -13.309 4.306 3.163 1.00 32.23 C ATOM 1341 CG PHE A 86 -12.144 3.391 3.562 1.00 74.23 C ATOM 1342 CD1 PHE A 86 -10.855 3.905 3.728 1.00 11.41 C ATOM 1343 CD2 PHE A 86 -12.330 2.022 3.756 1.00 2.01 C ATOM 1344 CE1 PHE A 86 -9.799 3.085 4.072 1.00 75.25 C ATOM 1345 CE2 PHE A 86 -11.270 1.207 4.103 1.00 14.13 C ATOM 1346 CZ PHE A 86 -10.006 1.739 4.262 1.00 25.54 C ATOM 0 H PHE A 86 -12.608 5.447 5.865 1.00 35.22 H new ATOM 0 HA PHE A 86 -14.728 5.771 3.883 1.00 54.43 H new ATOM 0 HB2 PHE A 86 -14.069 3.698 2.672 1.00 32.23 H new ATOM 0 HB3 PHE A 86 -12.946 5.021 2.425 1.00 32.23 H new ATOM 0 HD1 PHE A 86 -10.682 4.961 3.585 1.00 11.41 H new ATOM 0 HD2 PHE A 86 -13.314 1.594 3.633 1.00 2.01 H new ATOM 0 HE1 PHE A 86 -8.810 3.501 4.192 1.00 75.25 H new ATOM 0 HE2 PHE A 86 -11.431 0.149 4.251 1.00 14.13 H new ATOM 0 HZ PHE A 86 -9.181 1.099 4.535 1.00 25.54 H new ATOM 1356 N ASP A 87 -15.541 3.261 4.704 1.00 11.04 N ATOM 1357 CA ASP A 87 -16.187 2.143 5.413 1.00 0.13 C ATOM 1358 C ASP A 87 -15.830 0.845 4.692 1.00 51.42 C ATOM 1359 O ASP A 87 -15.645 0.838 3.465 1.00 41.31 O ATOM 1360 CB ASP A 87 -17.725 2.327 5.475 1.00 14.23 C ATOM 1361 CG ASP A 87 -18.151 3.451 6.431 1.00 42.23 C ATOM 1362 OD1 ASP A 87 -18.235 4.612 5.994 1.00 11.53 O ATOM 1363 OD2 ASP A 87 -18.402 3.181 7.626 1.00 12.32 O ATOM 0 H ASP A 87 -15.778 3.298 3.713 1.00 11.04 H new ATOM 0 HA ASP A 87 -15.827 2.112 6.441 1.00 0.13 H new ATOM 0 HB2 ASP A 87 -18.101 2.544 4.475 1.00 14.23 H new ATOM 0 HB3 ASP A 87 -18.186 1.392 5.793 1.00 14.23 H new ATOM 1368 N LEU A 88 -15.732 -0.238 5.465 1.00 54.05 N ATOM 1369 CA LEU A 88 -15.371 -1.571 4.960 1.00 5.41 C ATOM 1370 C LEU A 88 -15.973 -2.642 5.887 1.00 33.12 C ATOM 1371 O LEU A 88 -15.882 -2.518 7.120 1.00 44.45 O ATOM 1372 CB LEU A 88 -13.825 -1.733 4.883 1.00 52.21 C ATOM 1373 CG LEU A 88 -13.296 -3.096 4.332 1.00 24.14 C ATOM 1374 CD1 LEU A 88 -13.723 -3.310 2.862 1.00 21.33 C ATOM 1375 CD2 LEU A 88 -11.762 -3.213 4.513 1.00 31.24 C ATOM 0 H LEU A 88 -15.902 -0.218 6.471 1.00 54.05 H new ATOM 0 HA LEU A 88 -15.772 -1.691 3.953 1.00 5.41 H new ATOM 0 HB2 LEU A 88 -13.429 -0.934 4.256 1.00 52.21 H new ATOM 0 HB3 LEU A 88 -13.416 -1.587 5.883 1.00 52.21 H new ATOM 0 HG LEU A 88 -13.752 -3.895 4.917 1.00 24.14 H new ATOM 0 HD11 LEU A 88 -13.340 -4.267 2.507 1.00 21.33 H new ATOM 0 HD12 LEU A 88 -14.811 -3.308 2.795 1.00 21.33 H new ATOM 0 HD13 LEU A 88 -13.320 -2.507 2.245 1.00 21.33 H new ATOM 0 HD21 LEU A 88 -11.421 -4.171 4.121 1.00 31.24 H new ATOM 0 HD22 LEU A 88 -11.269 -2.404 3.973 1.00 31.24 H new ATOM 0 HD23 LEU A 88 -11.514 -3.146 5.572 1.00 31.24 H new ATOM 1387 N ASP A 89 -16.595 -3.668 5.267 1.00 71.41 N ATOM 1388 CA ASP A 89 -17.167 -4.851 5.948 1.00 32.43 C ATOM 1389 C ASP A 89 -18.438 -4.498 6.759 1.00 35.33 C ATOM 1390 O ASP A 89 -19.562 -4.759 6.306 1.00 73.02 O ATOM 1391 CB ASP A 89 -16.094 -5.572 6.813 1.00 13.03 C ATOM 1392 CG ASP A 89 -16.648 -6.734 7.652 1.00 21.13 C ATOM 1393 OD1 ASP A 89 -17.208 -7.688 7.075 1.00 13.50 O ATOM 1394 OD2 ASP A 89 -16.499 -6.711 8.891 1.00 32.02 O ATOM 0 H ASP A 89 -16.716 -3.698 4.255 1.00 71.41 H new ATOM 0 HA ASP A 89 -17.485 -5.553 5.177 1.00 32.43 H new ATOM 0 HB2 ASP A 89 -15.309 -5.951 6.159 1.00 13.03 H new ATOM 0 HB3 ASP A 89 -15.630 -4.845 7.479 1.00 13.03 H new ATOM 1399 N GLY A 90 -18.247 -3.882 7.935 1.00 44.24 N ATOM 1400 CA GLY A 90 -19.356 -3.532 8.834 1.00 54.43 C ATOM 1401 C GLY A 90 -19.028 -2.358 9.752 1.00 61.45 C ATOM 1402 O GLY A 90 -19.818 -2.037 10.650 1.00 31.40 O ATOM 0 H GLY A 90 -17.328 -3.614 8.287 1.00 44.24 H new ATOM 0 HA2 GLY A 90 -20.236 -3.287 8.239 1.00 54.43 H new ATOM 0 HA3 GLY A 90 -19.613 -4.400 9.441 1.00 54.43 H new ATOM 1406 N GLU A 91 -17.867 -1.708 9.518 1.00 34.04 N ATOM 1407 CA GLU A 91 -17.370 -0.599 10.356 1.00 2.31 C ATOM 1408 C GLU A 91 -16.621 0.444 9.513 1.00 62.11 C ATOM 1409 O GLU A 91 -16.255 0.187 8.360 1.00 60.05 O ATOM 1410 CB GLU A 91 -16.437 -1.154 11.471 1.00 54.43 C ATOM 1411 CG GLU A 91 -15.240 -1.991 10.958 1.00 64.03 C ATOM 1412 CD GLU A 91 -14.304 -2.468 12.083 1.00 11.44 C ATOM 1413 OE1 GLU A 91 -14.666 -3.419 12.809 1.00 60.15 O ATOM 1414 OE2 GLU A 91 -13.221 -1.881 12.258 1.00 53.51 O ATOM 0 H GLU A 91 -17.248 -1.939 8.741 1.00 34.04 H new ATOM 0 HA GLU A 91 -18.229 -0.108 10.814 1.00 2.31 H new ATOM 0 HB2 GLU A 91 -16.054 -0.317 12.054 1.00 54.43 H new ATOM 0 HB3 GLU A 91 -17.029 -1.770 12.148 1.00 54.43 H new ATOM 0 HG2 GLU A 91 -15.618 -2.858 10.417 1.00 64.03 H new ATOM 0 HG3 GLU A 91 -14.668 -1.396 10.247 1.00 64.03 H new ATOM 1421 N SER A 92 -16.395 1.613 10.124 1.00 40.11 N ATOM 1422 CA SER A 92 -15.604 2.691 9.530 1.00 55.55 C ATOM 1423 C SER A 92 -14.109 2.340 9.629 1.00 75.44 C ATOM 1424 O SER A 92 -13.641 1.889 10.683 1.00 2.52 O ATOM 1425 CB SER A 92 -15.910 4.026 10.243 1.00 34.14 C ATOM 1426 OG SER A 92 -15.259 5.117 9.618 1.00 13.15 O ATOM 0 H SER A 92 -16.759 1.836 11.050 1.00 40.11 H new ATOM 0 HA SER A 92 -15.867 2.804 8.478 1.00 55.55 H new ATOM 0 HB2 SER A 92 -16.986 4.198 10.246 1.00 34.14 H new ATOM 0 HB3 SER A 92 -15.595 3.963 11.284 1.00 34.14 H new ATOM 0 HG SER A 92 -15.060 4.889 8.686 1.00 13.15 H new ATOM 1432 N ARG A 93 -13.373 2.519 8.523 1.00 13.41 N ATOM 1433 CA ARG A 93 -11.945 2.179 8.421 1.00 35.32 C ATOM 1434 C ARG A 93 -11.177 3.368 7.821 1.00 35.51 C ATOM 1435 O ARG A 93 -11.704 4.075 6.961 1.00 2.53 O ATOM 1436 CB ARG A 93 -11.763 0.923 7.525 1.00 61.30 C ATOM 1437 CG ARG A 93 -12.362 -0.399 8.062 1.00 54.22 C ATOM 1438 CD ARG A 93 -11.563 -1.029 9.215 1.00 64.53 C ATOM 1439 NE ARG A 93 -11.703 -0.297 10.477 1.00 71.43 N ATOM 1440 CZ ARG A 93 -10.698 0.215 11.211 1.00 1.22 C ATOM 1441 NH1 ARG A 93 -9.432 0.109 10.815 1.00 33.43 N ATOM 1442 NH2 ARG A 93 -10.969 0.848 12.337 1.00 15.12 N ATOM 0 H ARG A 93 -13.757 2.909 7.662 1.00 13.41 H new ATOM 0 HA ARG A 93 -11.553 1.962 9.415 1.00 35.32 H new ATOM 0 HB2 ARG A 93 -12.209 1.130 6.552 1.00 61.30 H new ATOM 0 HB3 ARG A 93 -10.696 0.773 7.361 1.00 61.30 H new ATOM 0 HG2 ARG A 93 -13.381 -0.212 8.400 1.00 54.22 H new ATOM 0 HG3 ARG A 93 -12.424 -1.116 7.243 1.00 54.22 H new ATOM 0 HD2 ARG A 93 -11.894 -2.057 9.359 1.00 64.53 H new ATOM 0 HD3 ARG A 93 -10.509 -1.069 8.940 1.00 64.53 H new ATOM 0 HE ARG A 93 -12.650 -0.163 10.832 1.00 71.43 H new ATOM 0 HH11 ARG A 93 -9.209 -0.367 9.941 1.00 33.43 H new ATOM 0 HH12 ARG A 93 -8.684 0.504 11.386 1.00 33.43 H new ATOM 0 HH21 ARG A 93 -11.936 0.947 12.646 1.00 15.12 H new ATOM 0 HH22 ARG A 93 -10.212 1.238 12.898 1.00 15.12 H new ATOM 1456 N ASP A 94 -9.936 3.575 8.292 1.00 32.44 N ATOM 1457 CA ASP A 94 -9.031 4.633 7.785 1.00 51.45 C ATOM 1458 C ASP A 94 -7.717 3.999 7.328 1.00 63.33 C ATOM 1459 O ASP A 94 -7.173 3.131 8.019 1.00 21.21 O ATOM 1460 CB ASP A 94 -8.729 5.698 8.879 1.00 25.33 C ATOM 1461 CG ASP A 94 -9.987 6.410 9.398 1.00 45.31 C ATOM 1462 OD1 ASP A 94 -10.686 5.833 10.267 1.00 30.31 O ATOM 1463 OD2 ASP A 94 -10.281 7.539 8.955 1.00 31.43 O ATOM 0 H ASP A 94 -9.526 3.014 9.038 1.00 32.44 H new ATOM 0 HA ASP A 94 -9.526 5.130 6.951 1.00 51.45 H new ATOM 0 HB2 ASP A 94 -8.222 5.216 9.715 1.00 25.33 H new ATOM 0 HB3 ASP A 94 -8.041 6.440 8.474 1.00 25.33 H new ATOM 1468 N LEU A 95 -7.230 4.428 6.152 1.00 10.51 N ATOM 1469 CA LEU A 95 -5.866 4.140 5.680 1.00 31.11 C ATOM 1470 C LEU A 95 -5.146 5.461 5.459 1.00 43.33 C ATOM 1471 O LEU A 95 -5.598 6.293 4.684 1.00 61.14 O ATOM 1472 CB LEU A 95 -5.859 3.282 4.384 1.00 33.10 C ATOM 1473 CG LEU A 95 -6.272 1.795 4.570 1.00 71.11 C ATOM 1474 CD1 LEU A 95 -6.049 0.987 3.278 1.00 32.03 C ATOM 1475 CD2 LEU A 95 -5.533 1.160 5.766 1.00 64.13 C ATOM 0 H LEU A 95 -7.776 4.988 5.498 1.00 10.51 H new ATOM 0 HA LEU A 95 -5.350 3.550 6.438 1.00 31.11 H new ATOM 0 HB2 LEU A 95 -6.532 3.741 3.660 1.00 33.10 H new ATOM 0 HB3 LEU A 95 -4.858 3.313 3.953 1.00 33.10 H new ATOM 0 HG LEU A 95 -7.339 1.771 4.790 1.00 71.11 H new ATOM 0 HD11 LEU A 95 -6.347 -0.049 3.441 1.00 32.03 H new ATOM 0 HD12 LEU A 95 -6.647 1.415 2.473 1.00 32.03 H new ATOM 0 HD13 LEU A 95 -4.995 1.022 3.004 1.00 32.03 H new ATOM 0 HD21 LEU A 95 -5.841 0.120 5.873 1.00 64.13 H new ATOM 0 HD22 LEU A 95 -4.458 1.204 5.594 1.00 64.13 H new ATOM 0 HD23 LEU A 95 -5.778 1.706 6.677 1.00 64.13 H new ATOM 1487 N HIS A 96 -4.027 5.647 6.147 1.00 74.24 N ATOM 1488 CA HIS A 96 -3.287 6.901 6.132 1.00 54.33 C ATOM 1489 C HIS A 96 -2.258 6.847 5.004 1.00 61.11 C ATOM 1490 O HIS A 96 -1.534 5.854 4.871 1.00 44.31 O ATOM 1491 CB HIS A 96 -2.612 7.124 7.503 1.00 2.12 C ATOM 1492 CG HIS A 96 -3.584 7.177 8.652 1.00 22.53 C ATOM 1493 ND1 HIS A 96 -3.883 8.355 9.281 1.00 2.10 N ATOM 1494 CD2 HIS A 96 -4.310 6.181 9.224 1.00 43.34 C ATOM 1495 CE1 HIS A 96 -4.772 8.054 10.205 1.00 44.00 C ATOM 1496 NE2 HIS A 96 -5.066 6.752 10.204 1.00 14.13 N ATOM 0 H HIS A 96 -3.605 4.928 6.734 1.00 74.24 H new ATOM 0 HA HIS A 96 -3.959 7.740 5.954 1.00 54.33 H new ATOM 0 HB2 HIS A 96 -1.896 6.322 7.681 1.00 2.12 H new ATOM 0 HB3 HIS A 96 -2.047 8.055 7.473 1.00 2.12 H new ATOM 0 HD1 HIS A 96 -3.497 9.277 9.076 1.00 2.10 H new ATOM 0 HD2 HIS A 96 -4.292 5.136 8.954 1.00 43.34 H new ATOM 0 HE1 HIS A 96 -5.210 8.773 10.881 1.00 44.00 H new ATOM 1504 N ALA A 97 -2.213 7.914 4.203 1.00 11.13 N ATOM 1505 CA ALA A 97 -1.347 8.029 3.027 1.00 42.52 C ATOM 1506 C ALA A 97 -0.130 8.862 3.406 1.00 50.20 C ATOM 1507 O ALA A 97 -0.270 9.980 3.930 1.00 65.44 O ATOM 1508 CB ALA A 97 -2.126 8.681 1.863 1.00 62.52 C ATOM 0 H ALA A 97 -2.790 8.741 4.357 1.00 11.13 H new ATOM 0 HA ALA A 97 -1.019 7.043 2.697 1.00 42.52 H new ATOM 0 HB1 ALA A 97 -1.476 8.764 0.992 1.00 62.52 H new ATOM 0 HB2 ALA A 97 -2.991 8.066 1.614 1.00 62.52 H new ATOM 0 HB3 ALA A 97 -2.461 9.674 2.161 1.00 62.52 H new ATOM 1514 N PHE A 98 1.065 8.300 3.179 1.00 73.44 N ATOM 1515 CA PHE A 98 2.335 8.947 3.512 1.00 43.33 C ATOM 1516 C PHE A 98 3.233 8.962 2.277 1.00 22.11 C ATOM 1517 O PHE A 98 3.074 8.147 1.360 1.00 62.04 O ATOM 1518 CB PHE A 98 3.091 8.205 4.652 1.00 41.00 C ATOM 1519 CG PHE A 98 2.261 7.696 5.827 1.00 13.54 C ATOM 1520 CD1 PHE A 98 1.621 6.460 5.765 1.00 41.34 C ATOM 1521 CD2 PHE A 98 2.154 8.425 7.002 1.00 72.14 C ATOM 1522 CE1 PHE A 98 0.898 5.977 6.840 1.00 41.55 C ATOM 1523 CE2 PHE A 98 1.431 7.939 8.075 1.00 61.22 C ATOM 1524 CZ PHE A 98 0.805 6.720 7.995 1.00 22.11 C ATOM 0 H PHE A 98 1.175 7.378 2.757 1.00 73.44 H new ATOM 0 HA PHE A 98 2.106 9.958 3.850 1.00 43.33 H new ATOM 0 HB2 PHE A 98 3.612 7.354 4.213 1.00 41.00 H new ATOM 0 HB3 PHE A 98 3.854 8.878 5.044 1.00 41.00 H new ATOM 0 HD1 PHE A 98 1.691 5.870 4.863 1.00 41.34 H new ATOM 0 HD2 PHE A 98 2.642 9.385 7.080 1.00 72.14 H new ATOM 0 HE1 PHE A 98 0.407 5.018 6.774 1.00 41.55 H new ATOM 0 HE2 PHE A 98 1.358 8.522 8.981 1.00 61.22 H new ATOM 0 HZ PHE A 98 0.241 6.345 8.836 1.00 22.11 H new ATOM 1534 N ARG A 99 4.185 9.902 2.288 1.00 60.00 N ATOM 1535 CA ARG A 99 5.151 10.143 1.201 1.00 75.40 C ATOM 1536 C ARG A 99 6.477 10.541 1.870 1.00 50.04 C ATOM 1537 O ARG A 99 6.469 11.445 2.711 1.00 21.03 O ATOM 1538 CB ARG A 99 4.625 11.272 0.261 1.00 32.43 C ATOM 1539 CG ARG A 99 3.176 11.045 -0.234 1.00 11.21 C ATOM 1540 CD ARG A 99 2.561 12.231 -0.967 1.00 60.24 C ATOM 1541 NE ARG A 99 2.926 12.277 -2.391 1.00 15.23 N ATOM 1542 CZ ARG A 99 2.539 13.226 -3.247 1.00 61.20 C ATOM 1543 NH1 ARG A 99 1.784 14.250 -2.850 1.00 12.44 N ATOM 1544 NH2 ARG A 99 2.899 13.130 -4.519 1.00 35.45 N ATOM 0 H ARG A 99 4.311 10.537 3.076 1.00 60.00 H new ATOM 0 HA ARG A 99 5.292 9.256 0.583 1.00 75.40 H new ATOM 0 HB2 ARG A 99 4.674 12.224 0.789 1.00 32.43 H new ATOM 0 HB3 ARG A 99 5.286 11.351 -0.602 1.00 32.43 H new ATOM 0 HG2 ARG A 99 3.164 10.180 -0.897 1.00 11.21 H new ATOM 0 HG3 ARG A 99 2.548 10.799 0.622 1.00 11.21 H new ATOM 0 HD2 ARG A 99 1.476 12.184 -0.877 1.00 60.24 H new ATOM 0 HD3 ARG A 99 2.881 13.155 -0.485 1.00 60.24 H new ATOM 0 HE ARG A 99 3.518 11.529 -2.751 1.00 15.23 H new ATOM 0 HH11 ARG A 99 1.491 14.320 -1.876 1.00 12.44 H new ATOM 0 HH12 ARG A 99 1.500 14.964 -3.521 1.00 12.44 H new ATOM 0 HH21 ARG A 99 3.463 12.340 -4.831 1.00 35.45 H new ATOM 0 HH22 ARG A 99 2.612 13.846 -5.186 1.00 35.45 H new ATOM 1558 N GLN A 100 7.584 9.857 1.497 1.00 53.31 N ATOM 1559 CA GLN A 100 8.891 9.938 2.195 1.00 22.23 C ATOM 1560 C GLN A 100 9.335 11.383 2.543 1.00 20.44 C ATOM 1561 O GLN A 100 9.237 11.793 3.708 1.00 20.34 O ATOM 1562 CB GLN A 100 9.983 9.208 1.354 1.00 32.44 C ATOM 1563 CG GLN A 100 9.924 7.675 1.414 1.00 42.12 C ATOM 1564 CD GLN A 100 10.994 6.997 0.559 1.00 15.42 C ATOM 1565 OE1 GLN A 100 10.760 6.668 -0.604 1.00 1.22 O ATOM 1566 NE2 GLN A 100 12.186 6.821 1.114 1.00 63.11 N ATOM 0 H GLN A 100 7.596 9.227 0.695 1.00 53.31 H new ATOM 0 HA GLN A 100 8.762 9.438 3.155 1.00 22.23 H new ATOM 0 HB2 GLN A 100 9.890 9.521 0.314 1.00 32.44 H new ATOM 0 HB3 GLN A 100 10.965 9.534 1.698 1.00 32.44 H new ATOM 0 HG2 GLN A 100 10.038 7.354 2.449 1.00 42.12 H new ATOM 0 HG3 GLN A 100 8.940 7.343 1.084 1.00 42.12 H new ATOM 0 HE21 GLN A 100 12.346 7.105 2.081 1.00 63.11 H new ATOM 0 HE22 GLN A 100 12.943 6.402 0.574 1.00 63.11 H new ATOM 1575 N ALA A 101 9.811 12.146 1.542 1.00 70.11 N ATOM 1576 CA ALA A 101 10.252 13.539 1.747 1.00 24.43 C ATOM 1577 C ALA A 101 9.413 14.520 0.915 1.00 74.25 C ATOM 1578 O ALA A 101 8.519 15.198 1.439 1.00 30.23 O ATOM 1579 CB ALA A 101 11.755 13.661 1.432 1.00 30.40 C ATOM 0 H ALA A 101 9.900 11.820 0.580 1.00 70.11 H new ATOM 0 HA ALA A 101 10.098 13.806 2.792 1.00 24.43 H new ATOM 0 HB1 ALA A 101 12.076 14.691 1.585 1.00 30.40 H new ATOM 0 HB2 ALA A 101 12.320 13.003 2.093 1.00 30.40 H new ATOM 0 HB3 ALA A 101 11.934 13.375 0.396 1.00 30.40 H new ATOM 1585 N ALA A 102 9.703 14.580 -0.394 1.00 20.35 N ATOM 1586 CA ALA A 102 9.069 15.531 -1.320 1.00 74.34 C ATOM 1587 C ALA A 102 8.540 14.824 -2.578 1.00 1.43 C ATOM 1588 O ALA A 102 8.673 15.361 -3.689 1.00 71.15 O ATOM 1589 CB ALA A 102 10.097 16.629 -1.673 1.00 2.21 C ATOM 0 H ALA A 102 10.386 13.968 -0.841 1.00 20.35 H new ATOM 0 HA ALA A 102 8.203 15.987 -0.839 1.00 74.34 H new ATOM 0 HB1 ALA A 102 9.644 17.344 -2.360 1.00 2.21 H new ATOM 0 HB2 ALA A 102 10.406 17.145 -0.764 1.00 2.21 H new ATOM 0 HB3 ALA A 102 10.968 16.174 -2.145 1.00 2.21 H new ATOM 1595 N ASP A 103 7.941 13.621 -2.412 1.00 44.35 N ATOM 1596 CA ASP A 103 7.392 12.845 -3.554 1.00 12.53 C ATOM 1597 C ASP A 103 6.356 13.674 -4.334 1.00 72.43 C ATOM 1598 O ASP A 103 5.433 14.233 -3.742 1.00 30.41 O ATOM 1599 CB ASP A 103 6.736 11.517 -3.087 1.00 32.23 C ATOM 1600 CG ASP A 103 6.054 10.749 -4.246 1.00 74.41 C ATOM 1601 OD1 ASP A 103 6.761 10.077 -5.022 1.00 2.32 O ATOM 1602 OD2 ASP A 103 4.812 10.857 -4.407 1.00 0.51 O ATOM 0 H ASP A 103 7.825 13.168 -1.506 1.00 44.35 H new ATOM 0 HA ASP A 103 8.233 12.607 -4.205 1.00 12.53 H new ATOM 0 HB2 ASP A 103 7.496 10.881 -2.632 1.00 32.23 H new ATOM 0 HB3 ASP A 103 5.997 11.733 -2.315 1.00 32.23 H new ATOM 1607 N GLU A 104 6.560 13.769 -5.652 1.00 14.13 N ATOM 1608 CA GLU A 104 5.628 14.423 -6.586 1.00 62.11 C ATOM 1609 C GLU A 104 5.118 13.428 -7.656 1.00 21.22 C ATOM 1610 O GLU A 104 4.428 13.832 -8.595 1.00 32.24 O ATOM 1611 CB GLU A 104 6.339 15.639 -7.249 1.00 45.45 C ATOM 1612 CG GLU A 104 7.628 15.284 -8.015 1.00 22.21 C ATOM 1613 CD GLU A 104 8.306 16.509 -8.629 1.00 62.14 C ATOM 1614 OE1 GLU A 104 9.099 17.179 -7.931 1.00 43.42 O ATOM 1615 OE2 GLU A 104 8.037 16.815 -9.808 1.00 41.45 O ATOM 0 H GLU A 104 7.388 13.389 -6.110 1.00 14.13 H new ATOM 0 HA GLU A 104 4.757 14.774 -6.032 1.00 62.11 H new ATOM 0 HB2 GLU A 104 5.643 16.120 -7.937 1.00 45.45 H new ATOM 0 HB3 GLU A 104 6.580 16.369 -6.476 1.00 45.45 H new ATOM 0 HG2 GLU A 104 8.324 14.790 -7.337 1.00 22.21 H new ATOM 0 HG3 GLU A 104 7.392 14.571 -8.805 1.00 22.21 H new ATOM 1622 N SER A 105 5.427 12.123 -7.485 1.00 74.22 N ATOM 1623 CA SER A 105 5.023 11.059 -8.432 1.00 22.11 C ATOM 1624 C SER A 105 3.617 10.504 -8.119 1.00 52.12 C ATOM 1625 O SER A 105 3.249 9.459 -8.663 1.00 43.24 O ATOM 1626 CB SER A 105 6.066 9.915 -8.400 1.00 25.42 C ATOM 1627 OG SER A 105 7.336 10.377 -8.818 1.00 1.44 O ATOM 0 H SER A 105 5.962 11.778 -6.688 1.00 74.22 H new ATOM 0 HA SER A 105 4.982 11.498 -9.429 1.00 22.11 H new ATOM 0 HB2 SER A 105 6.136 9.510 -7.391 1.00 25.42 H new ATOM 0 HB3 SER A 105 5.739 9.102 -9.048 1.00 25.42 H new ATOM 0 HG SER A 105 7.979 9.638 -8.788 1.00 1.44 H new ATOM 1633 N ARG A 106 2.846 11.209 -7.242 1.00 63.42 N ATOM 1634 CA ARG A 106 1.453 10.825 -6.841 1.00 42.42 C ATOM 1635 C ARG A 106 1.430 9.544 -5.983 1.00 42.44 C ATOM 1636 O ARG A 106 0.356 9.001 -5.712 1.00 35.22 O ATOM 1637 CB ARG A 106 0.504 10.664 -8.076 1.00 3.41 C ATOM 1638 CG ARG A 106 0.358 11.916 -8.964 1.00 21.41 C ATOM 1639 CD ARG A 106 -0.319 13.106 -8.263 1.00 53.35 C ATOM 1640 NE ARG A 106 -0.539 14.223 -9.206 1.00 23.33 N ATOM 1641 CZ ARG A 106 -0.432 15.526 -8.912 1.00 55.31 C ATOM 1642 NH1 ARG A 106 -0.105 15.919 -7.690 1.00 62.54 N ATOM 1643 NH2 ARG A 106 -0.678 16.433 -9.845 1.00 72.24 N ATOM 0 H ARG A 106 3.171 12.063 -6.790 1.00 63.42 H new ATOM 0 HA ARG A 106 1.079 11.649 -6.233 1.00 42.42 H new ATOM 0 HB2 ARG A 106 0.872 9.843 -8.692 1.00 3.41 H new ATOM 0 HB3 ARG A 106 -0.484 10.375 -7.718 1.00 3.41 H new ATOM 0 HG2 ARG A 106 1.346 12.223 -9.306 1.00 21.41 H new ATOM 0 HG3 ARG A 106 -0.219 11.654 -9.851 1.00 21.41 H new ATOM 0 HD2 ARG A 106 -1.273 12.789 -7.841 1.00 53.35 H new ATOM 0 HD3 ARG A 106 0.301 13.444 -7.432 1.00 53.35 H new ATOM 0 HE ARG A 106 -0.794 13.981 -10.163 1.00 23.33 H new ATOM 0 HH11 ARG A 106 0.068 15.227 -6.961 1.00 62.54 H new ATOM 0 HH12 ARG A 106 -0.027 16.914 -7.478 1.00 62.54 H new ATOM 0 HH21 ARG A 106 -0.948 16.139 -10.784 1.00 72.24 H new ATOM 0 HH22 ARG A 106 -0.598 17.426 -9.625 1.00 72.24 H new ATOM 1657 N THR A 107 2.602 9.109 -5.500 1.00 3.42 N ATOM 1658 CA THR A 107 2.747 7.815 -4.834 1.00 64.34 C ATOM 1659 C THR A 107 2.238 7.909 -3.381 1.00 74.02 C ATOM 1660 O THR A 107 2.943 8.385 -2.477 1.00 0.15 O ATOM 1661 CB THR A 107 4.234 7.333 -4.889 1.00 3.11 C ATOM 1662 OG1 THR A 107 4.700 7.395 -6.248 1.00 4.24 O ATOM 1663 CG2 THR A 107 4.413 5.898 -4.361 1.00 54.20 C ATOM 0 H THR A 107 3.469 9.643 -5.561 1.00 3.42 H new ATOM 0 HA THR A 107 2.142 7.075 -5.358 1.00 64.34 H new ATOM 0 HB THR A 107 4.814 7.993 -4.244 1.00 3.11 H new ATOM 0 HG1 THR A 107 4.019 7.020 -6.845 1.00 4.24 H new ATOM 0 HG21 THR A 107 5.464 5.616 -4.423 1.00 54.20 H new ATOM 0 HG22 THR A 107 4.084 5.849 -3.323 1.00 54.20 H new ATOM 0 HG23 THR A 107 3.817 5.212 -4.963 1.00 54.20 H new ATOM 1671 N LEU A 108 0.969 7.515 -3.201 1.00 54.43 N ATOM 1672 CA LEU A 108 0.334 7.381 -1.888 1.00 43.22 C ATOM 1673 C LEU A 108 0.669 6.001 -1.332 1.00 42.12 C ATOM 1674 O LEU A 108 0.285 4.974 -1.909 1.00 62.04 O ATOM 1675 CB LEU A 108 -1.205 7.535 -1.996 1.00 21.05 C ATOM 1676 CG LEU A 108 -1.739 8.870 -2.581 1.00 63.44 C ATOM 1677 CD1 LEU A 108 -3.284 8.837 -2.650 1.00 75.03 C ATOM 1678 CD2 LEU A 108 -1.225 10.089 -1.772 1.00 0.14 C ATOM 0 H LEU A 108 0.349 7.278 -3.976 1.00 54.43 H new ATOM 0 HA LEU A 108 0.706 8.164 -1.228 1.00 43.22 H new ATOM 0 HB2 LEU A 108 -1.585 6.719 -2.611 1.00 21.05 H new ATOM 0 HB3 LEU A 108 -1.629 7.408 -1.000 1.00 21.05 H new ATOM 0 HG LEU A 108 -1.355 8.983 -3.595 1.00 63.44 H new ATOM 0 HD11 LEU A 108 -3.650 9.778 -3.062 1.00 75.03 H new ATOM 0 HD12 LEU A 108 -3.602 8.013 -3.289 1.00 75.03 H new ATOM 0 HD13 LEU A 108 -3.690 8.697 -1.648 1.00 75.03 H new ATOM 0 HD21 LEU A 108 -1.618 11.007 -2.209 1.00 0.14 H new ATOM 0 HD22 LEU A 108 -1.560 10.007 -0.738 1.00 0.14 H new ATOM 0 HD23 LEU A 108 -0.136 10.111 -1.800 1.00 0.14 H new ATOM 1690 N PHE A 109 1.391 5.990 -0.227 1.00 54.10 N ATOM 1691 CA PHE A 109 1.817 4.770 0.433 1.00 31.43 C ATOM 1692 C PHE A 109 0.914 4.572 1.653 1.00 1.44 C ATOM 1693 O PHE A 109 1.044 5.309 2.641 1.00 12.12 O ATOM 1694 CB PHE A 109 3.306 4.912 0.837 1.00 14.15 C ATOM 1695 CG PHE A 109 3.956 3.634 1.357 1.00 55.43 C ATOM 1696 CD1 PHE A 109 4.292 2.606 0.477 1.00 44.41 C ATOM 1697 CD2 PHE A 109 4.263 3.473 2.711 1.00 55.32 C ATOM 1698 CE1 PHE A 109 4.915 1.461 0.939 1.00 4.34 C ATOM 1699 CE2 PHE A 109 4.881 2.323 3.171 1.00 70.32 C ATOM 1700 CZ PHE A 109 5.209 1.319 2.285 1.00 55.41 C ATOM 0 H PHE A 109 1.702 6.840 0.244 1.00 54.10 H new ATOM 0 HA PHE A 109 1.733 3.901 -0.219 1.00 31.43 H new ATOM 0 HB2 PHE A 109 3.870 5.263 -0.027 1.00 14.15 H new ATOM 0 HB3 PHE A 109 3.387 5.682 1.605 1.00 14.15 H new ATOM 0 HD1 PHE A 109 4.064 2.705 -0.574 1.00 44.41 H new ATOM 0 HD2 PHE A 109 4.014 4.258 3.409 1.00 55.32 H new ATOM 0 HE1 PHE A 109 5.174 0.673 0.247 1.00 4.34 H new ATOM 0 HE2 PHE A 109 5.106 2.213 4.222 1.00 70.32 H new ATOM 0 HZ PHE A 109 5.695 0.422 2.640 1.00 55.41 H new ATOM 1710 N VAL A 110 -0.052 3.638 1.559 1.00 75.42 N ATOM 1711 CA VAL A 110 -0.941 3.286 2.687 1.00 65.34 C ATOM 1712 C VAL A 110 -0.595 1.865 3.199 1.00 71.01 C ATOM 1713 O VAL A 110 -1.054 0.853 2.657 1.00 11.40 O ATOM 1714 CB VAL A 110 -2.498 3.447 2.346 1.00 10.12 C ATOM 1715 CG1 VAL A 110 -2.845 4.908 1.997 1.00 34.51 C ATOM 1716 CG2 VAL A 110 -2.981 2.523 1.212 1.00 24.41 C ATOM 0 H VAL A 110 -0.239 3.109 0.707 1.00 75.42 H new ATOM 0 HA VAL A 110 -0.758 4.003 3.487 1.00 65.34 H new ATOM 0 HB VAL A 110 -3.022 3.148 3.253 1.00 10.12 H new ATOM 0 HG11 VAL A 110 -3.908 4.985 1.770 1.00 34.51 H new ATOM 0 HG12 VAL A 110 -2.607 5.551 2.844 1.00 34.51 H new ATOM 0 HG13 VAL A 110 -2.265 5.222 1.129 1.00 34.51 H new ATOM 0 HG21 VAL A 110 -4.044 2.687 1.037 1.00 24.41 H new ATOM 0 HG22 VAL A 110 -2.425 2.744 0.301 1.00 24.41 H new ATOM 0 HG23 VAL A 110 -2.816 1.483 1.495 1.00 24.41 H new ATOM 1726 N PRO A 111 0.309 1.756 4.228 1.00 4.22 N ATOM 1727 CA PRO A 111 0.533 0.485 4.923 1.00 32.33 C ATOM 1728 C PRO A 111 -0.677 0.188 5.823 1.00 31.25 C ATOM 1729 O PRO A 111 -1.238 1.103 6.448 1.00 12.40 O ATOM 1730 CB PRO A 111 1.832 0.743 5.730 1.00 44.33 C ATOM 1731 CG PRO A 111 1.824 2.212 6.003 1.00 61.22 C ATOM 1732 CD PRO A 111 1.153 2.848 4.801 1.00 20.04 C ATOM 0 HA PRO A 111 0.639 -0.382 4.271 1.00 32.33 H new ATOM 0 HB2 PRO A 111 1.843 0.168 6.656 1.00 44.33 H new ATOM 0 HB3 PRO A 111 2.715 0.451 5.162 1.00 44.33 H new ATOM 0 HG2 PRO A 111 1.280 2.437 6.920 1.00 61.22 H new ATOM 0 HG3 PRO A 111 2.837 2.592 6.132 1.00 61.22 H new ATOM 0 HD2 PRO A 111 0.548 3.707 5.091 1.00 20.04 H new ATOM 0 HD3 PRO A 111 1.887 3.204 4.078 1.00 20.04 H new ATOM 1740 N PHE A 112 -1.109 -1.069 5.836 1.00 13.14 N ATOM 1741 CA PHE A 112 -2.175 -1.537 6.725 1.00 34.42 C ATOM 1742 C PHE A 112 -1.781 -2.870 7.354 1.00 51.40 C ATOM 1743 O PHE A 112 -0.769 -3.475 6.985 1.00 12.03 O ATOM 1744 CB PHE A 112 -3.542 -1.649 5.991 1.00 22.40 C ATOM 1745 CG PHE A 112 -3.656 -2.703 4.884 1.00 35.10 C ATOM 1746 CD1 PHE A 112 -3.274 -2.407 3.577 1.00 42.33 C ATOM 1747 CD2 PHE A 112 -4.188 -3.973 5.144 1.00 63.30 C ATOM 1748 CE1 PHE A 112 -3.403 -3.349 2.575 1.00 23.22 C ATOM 1749 CE2 PHE A 112 -4.314 -4.912 4.138 1.00 53.01 C ATOM 1750 CZ PHE A 112 -3.927 -4.597 2.853 1.00 41.25 C ATOM 0 H PHE A 112 -0.731 -1.797 5.230 1.00 13.14 H new ATOM 0 HA PHE A 112 -2.302 -0.796 7.514 1.00 34.42 H new ATOM 0 HB2 PHE A 112 -4.310 -1.857 6.736 1.00 22.40 H new ATOM 0 HB3 PHE A 112 -3.774 -0.676 5.557 1.00 22.40 H new ATOM 0 HD1 PHE A 112 -2.873 -1.431 3.345 1.00 42.33 H new ATOM 0 HD2 PHE A 112 -4.504 -4.222 6.146 1.00 63.30 H new ATOM 0 HE1 PHE A 112 -3.093 -3.109 1.569 1.00 23.22 H new ATOM 0 HE2 PHE A 112 -4.715 -5.890 4.358 1.00 53.01 H new ATOM 0 HZ PHE A 112 -4.033 -5.326 2.063 1.00 41.25 H new ATOM 1760 N ARG A 113 -2.581 -3.299 8.324 1.00 45.33 N ATOM 1761 CA ARG A 113 -2.493 -4.638 8.896 1.00 30.12 C ATOM 1762 C ARG A 113 -3.908 -5.090 9.259 1.00 32.22 C ATOM 1763 O ARG A 113 -4.579 -4.444 10.067 1.00 2.44 O ATOM 1764 CB ARG A 113 -1.544 -4.651 10.127 1.00 61.33 C ATOM 1765 CG ARG A 113 -1.257 -6.065 10.658 1.00 11.51 C ATOM 1766 CD ARG A 113 -0.188 -6.115 11.761 1.00 52.30 C ATOM 1767 NE ARG A 113 0.029 -7.495 12.240 1.00 52.23 N ATOM 1768 CZ ARG A 113 -0.776 -8.159 13.089 1.00 35.24 C ATOM 1769 NH1 ARG A 113 -1.855 -7.592 13.606 1.00 73.33 N ATOM 1770 NH2 ARG A 113 -0.497 -9.404 13.411 1.00 61.11 N ATOM 0 H ARG A 113 -3.314 -2.723 8.739 1.00 45.33 H new ATOM 0 HA ARG A 113 -2.068 -5.334 8.173 1.00 30.12 H new ATOM 0 HB2 ARG A 113 -0.602 -4.174 9.856 1.00 61.33 H new ATOM 0 HB3 ARG A 113 -1.986 -4.054 10.924 1.00 61.33 H new ATOM 0 HG2 ARG A 113 -2.183 -6.491 11.044 1.00 11.51 H new ATOM 0 HG3 ARG A 113 -0.938 -6.695 9.828 1.00 11.51 H new ATOM 0 HD2 ARG A 113 0.749 -5.709 11.380 1.00 52.30 H new ATOM 0 HD3 ARG A 113 -0.494 -5.483 12.595 1.00 52.30 H new ATOM 0 HE ARG A 113 0.857 -7.984 11.899 1.00 52.23 H new ATOM 0 HH11 ARG A 113 -2.092 -6.630 13.363 1.00 73.33 H new ATOM 0 HH12 ARG A 113 -2.449 -8.117 14.248 1.00 73.33 H new ATOM 0 HH21 ARG A 113 0.326 -9.860 13.017 1.00 61.11 H new ATOM 0 HH22 ARG A 113 -1.104 -9.913 14.054 1.00 61.11 H new ATOM 1784 N ASP A 114 -4.357 -6.191 8.647 1.00 54.35 N ATOM 1785 CA ASP A 114 -5.736 -6.684 8.776 1.00 42.13 C ATOM 1786 C ASP A 114 -5.701 -8.089 9.415 1.00 60.53 C ATOM 1787 O ASP A 114 -4.630 -8.551 9.830 1.00 40.12 O ATOM 1788 CB ASP A 114 -6.420 -6.686 7.378 1.00 23.54 C ATOM 1789 CG ASP A 114 -5.947 -7.830 6.470 1.00 73.00 C ATOM 1790 OD1 ASP A 114 -4.753 -7.864 6.110 1.00 12.41 O ATOM 1791 OD2 ASP A 114 -6.763 -8.714 6.162 1.00 24.21 O ATOM 0 H ASP A 114 -3.772 -6.770 8.044 1.00 54.35 H new ATOM 0 HA ASP A 114 -6.325 -6.033 9.422 1.00 42.13 H new ATOM 0 HB2 ASP A 114 -7.500 -6.759 7.510 1.00 23.54 H new ATOM 0 HB3 ASP A 114 -6.223 -5.735 6.884 1.00 23.54 H new ATOM 1796 N LYS A 115 -6.860 -8.772 9.474 1.00 71.01 N ATOM 1797 CA LYS A 115 -6.988 -10.052 10.203 1.00 64.34 C ATOM 1798 C LYS A 115 -6.418 -11.247 9.413 1.00 52.40 C ATOM 1799 O LYS A 115 -6.199 -12.317 10.002 1.00 13.42 O ATOM 1800 CB LYS A 115 -8.464 -10.304 10.621 1.00 4.42 C ATOM 1801 CG LYS A 115 -9.113 -9.202 11.509 1.00 45.35 C ATOM 1802 CD LYS A 115 -8.309 -8.815 12.792 1.00 44.41 C ATOM 1803 CE LYS A 115 -7.459 -7.539 12.619 1.00 41.12 C ATOM 1804 NZ LYS A 115 -6.743 -7.173 13.869 1.00 50.14 N ATOM 0 H LYS A 115 -7.722 -8.460 9.026 1.00 71.01 H new ATOM 0 HA LYS A 115 -6.384 -9.964 11.106 1.00 64.34 H new ATOM 0 HB2 LYS A 115 -9.064 -10.416 9.718 1.00 4.42 H new ATOM 0 HB3 LYS A 115 -8.514 -11.252 11.157 1.00 4.42 H new ATOM 0 HG2 LYS A 115 -9.251 -8.306 10.904 1.00 45.35 H new ATOM 0 HG3 LYS A 115 -10.105 -9.539 11.810 1.00 45.35 H new ATOM 0 HD2 LYS A 115 -9.005 -8.670 13.618 1.00 44.41 H new ATOM 0 HD3 LYS A 115 -7.656 -9.643 13.067 1.00 44.41 H new ATOM 0 HE2 LYS A 115 -6.735 -7.691 11.818 1.00 41.12 H new ATOM 0 HE3 LYS A 115 -8.102 -6.713 12.315 1.00 41.12 H new ATOM 0 HZ1 LYS A 115 -6.034 -6.441 13.661 1.00 50.14 H new ATOM 0 HZ2 LYS A 115 -7.424 -6.807 14.565 1.00 50.14 H new ATOM 0 HZ3 LYS A 115 -6.270 -8.014 14.257 1.00 50.14 H new ATOM 1818 N THR A 116 -6.173 -11.076 8.090 1.00 64.32 N ATOM 1819 CA THR A 116 -5.504 -12.123 7.285 1.00 3.32 C ATOM 1820 C THR A 116 -3.996 -12.121 7.570 1.00 70.02 C ATOM 1821 O THR A 116 -3.349 -13.159 7.465 1.00 65.10 O ATOM 1822 CB THR A 116 -5.744 -11.978 5.740 1.00 61.12 C ATOM 1823 OG1 THR A 116 -5.074 -10.818 5.217 1.00 72.42 O ATOM 1824 CG2 THR A 116 -7.247 -11.927 5.403 1.00 43.11 C ATOM 0 H THR A 116 -6.424 -10.237 7.567 1.00 64.32 H new ATOM 0 HA THR A 116 -5.951 -13.070 7.586 1.00 3.32 H new ATOM 0 HB THR A 116 -5.322 -12.863 5.264 1.00 61.12 H new ATOM 0 HG1 THR A 116 -5.630 -10.025 5.365 1.00 72.42 H new ATOM 0 HG21 THR A 116 -7.375 -11.826 4.325 1.00 43.11 H new ATOM 0 HG22 THR A 116 -7.727 -12.845 5.741 1.00 43.11 H new ATOM 0 HG23 THR A 116 -7.703 -11.073 5.904 1.00 43.11 H new ATOM 1832 N THR A 117 -3.450 -10.951 7.953 1.00 53.22 N ATOM 1833 CA THR A 117 -2.026 -10.816 8.306 1.00 75.12 C ATOM 1834 C THR A 117 -1.710 -11.662 9.568 1.00 44.44 C ATOM 1835 O THR A 117 -2.364 -11.505 10.608 1.00 52.14 O ATOM 1836 CB THR A 117 -1.639 -9.320 8.546 1.00 63.24 C ATOM 1837 OG1 THR A 117 -1.921 -8.540 7.368 1.00 72.11 O ATOM 1838 CG2 THR A 117 -0.149 -9.162 8.923 1.00 33.40 C ATOM 0 H THR A 117 -3.978 -10.082 8.026 1.00 53.22 H new ATOM 0 HA THR A 117 -1.433 -11.184 7.469 1.00 75.12 H new ATOM 0 HB THR A 117 -2.238 -8.960 9.382 1.00 63.24 H new ATOM 0 HG1 THR A 117 -2.889 -8.518 7.214 1.00 72.11 H new ATOM 0 HG21 THR A 117 0.077 -8.107 9.081 1.00 33.40 H new ATOM 0 HG22 THR A 117 0.056 -9.718 9.838 1.00 33.40 H new ATOM 0 HG23 THR A 117 0.473 -9.549 8.116 1.00 33.40 H new ATOM 1846 N GLY A 118 -0.714 -12.562 9.443 1.00 35.41 N ATOM 1847 CA GLY A 118 -0.375 -13.532 10.494 1.00 2.52 C ATOM 1848 C GLY A 118 -1.198 -14.826 10.425 1.00 70.40 C ATOM 1849 O GLY A 118 -0.812 -15.835 11.023 1.00 25.05 O ATOM 0 H GLY A 118 -0.126 -12.634 8.612 1.00 35.41 H new ATOM 0 HA2 GLY A 118 0.684 -13.780 10.420 1.00 2.52 H new ATOM 0 HA3 GLY A 118 -0.526 -13.067 11.468 1.00 2.52 H new ATOM 1853 N GLN A 119 -2.352 -14.793 9.715 1.00 20.14 N ATOM 1854 CA GLN A 119 -3.253 -15.962 9.564 1.00 64.21 C ATOM 1855 C GLN A 119 -3.212 -16.484 8.104 1.00 25.43 C ATOM 1856 O GLN A 119 -2.478 -17.425 7.798 1.00 73.50 O ATOM 1857 CB GLN A 119 -4.711 -15.588 10.004 1.00 32.31 C ATOM 1858 CG GLN A 119 -4.857 -15.150 11.484 1.00 32.01 C ATOM 1859 CD GLN A 119 -4.436 -16.234 12.485 1.00 41.54 C ATOM 1860 OE1 GLN A 119 -5.245 -17.071 12.891 1.00 34.45 O ATOM 1861 NE2 GLN A 119 -3.179 -16.220 12.897 1.00 63.53 N ATOM 0 H GLN A 119 -2.684 -13.958 9.232 1.00 20.14 H new ATOM 0 HA GLN A 119 -2.908 -16.765 10.215 1.00 64.21 H new ATOM 0 HB2 GLN A 119 -5.072 -14.782 9.365 1.00 32.31 H new ATOM 0 HB3 GLN A 119 -5.359 -16.447 9.830 1.00 32.31 H new ATOM 0 HG2 GLN A 119 -4.255 -14.257 11.652 1.00 32.01 H new ATOM 0 HG3 GLN A 119 -5.895 -14.875 11.673 1.00 32.01 H new ATOM 0 HE21 GLN A 119 -2.534 -15.514 12.542 1.00 63.53 H new ATOM 0 HE22 GLN A 119 -2.855 -16.915 13.570 1.00 63.53 H new ATOM 1870 N GLN A 120 -3.976 -15.823 7.204 1.00 73.23 N ATOM 1871 CA GLN A 120 -4.033 -16.169 5.756 1.00 72.24 C ATOM 1872 C GLN A 120 -2.846 -15.539 4.983 1.00 32.15 C ATOM 1873 O GLN A 120 -2.682 -15.753 3.791 1.00 62.42 O ATOM 1874 CB GLN A 120 -5.363 -15.667 5.135 1.00 55.02 C ATOM 1875 CG GLN A 120 -6.645 -16.081 5.882 1.00 31.11 C ATOM 1876 CD GLN A 120 -7.932 -15.595 5.193 1.00 20.31 C ATOM 1877 OE1 GLN A 120 -8.000 -15.479 3.967 1.00 2.40 O ATOM 1878 NE2 GLN A 120 -8.953 -15.296 5.978 1.00 2.13 N ATOM 0 H GLN A 120 -4.572 -15.034 7.456 1.00 73.23 H new ATOM 0 HA GLN A 120 -3.973 -17.254 5.674 1.00 72.24 H new ATOM 0 HB2 GLN A 120 -5.330 -14.579 5.082 1.00 55.02 H new ATOM 0 HB3 GLN A 120 -5.426 -16.034 4.111 1.00 55.02 H new ATOM 0 HG2 GLN A 120 -6.674 -17.167 5.966 1.00 31.11 H new ATOM 0 HG3 GLN A 120 -6.611 -15.683 6.896 1.00 31.11 H new ATOM 0 HE21 GLN A 120 -8.867 -15.402 6.989 1.00 2.13 H new ATOM 0 HE22 GLN A 120 -9.826 -14.959 5.573 1.00 2.13 H new ATOM 1887 N SER A 121 -2.031 -14.779 5.697 1.00 15.13 N ATOM 1888 CA SER A 121 -0.875 -14.056 5.153 1.00 64.13 C ATOM 1889 C SER A 121 0.234 -14.100 6.207 1.00 71.13 C ATOM 1890 O SER A 121 -0.026 -14.436 7.371 1.00 1.54 O ATOM 1891 CB SER A 121 -1.256 -12.592 4.803 1.00 62.13 C ATOM 1892 OG SER A 121 -2.279 -12.537 3.815 1.00 42.00 O ATOM 0 H SER A 121 -2.152 -14.639 6.700 1.00 15.13 H new ATOM 0 HA SER A 121 -0.533 -14.523 4.229 1.00 64.13 H new ATOM 0 HB2 SER A 121 -1.592 -12.078 5.704 1.00 62.13 H new ATOM 0 HB3 SER A 121 -0.374 -12.062 4.444 1.00 62.13 H new ATOM 0 HG SER A 121 -2.495 -11.601 3.620 1.00 42.00 H new ATOM 1898 N TYR A 122 1.471 -13.804 5.802 1.00 13.34 N ATOM 1899 CA TYR A 122 2.594 -13.704 6.743 1.00 73.12 C ATOM 1900 C TYR A 122 2.490 -12.420 7.593 1.00 22.15 C ATOM 1901 O TYR A 122 1.862 -11.428 7.185 1.00 62.12 O ATOM 1902 CB TYR A 122 3.943 -13.782 5.992 1.00 63.51 C ATOM 1903 CG TYR A 122 4.270 -15.190 5.458 1.00 71.35 C ATOM 1904 CD1 TYR A 122 4.706 -16.203 6.321 1.00 64.24 C ATOM 1905 CD2 TYR A 122 4.159 -15.504 4.105 1.00 2.00 C ATOM 1906 CE1 TYR A 122 5.019 -17.462 5.845 1.00 32.11 C ATOM 1907 CE2 TYR A 122 4.469 -16.762 3.631 1.00 3.45 C ATOM 1908 CZ TYR A 122 4.895 -17.733 4.501 1.00 21.00 C ATOM 1909 OH TYR A 122 5.210 -18.980 4.020 1.00 51.24 O ATOM 0 H TYR A 122 1.723 -13.629 4.829 1.00 13.34 H new ATOM 0 HA TYR A 122 2.546 -14.551 7.427 1.00 73.12 H new ATOM 0 HB2 TYR A 122 3.926 -13.081 5.158 1.00 63.51 H new ATOM 0 HB3 TYR A 122 4.741 -13.462 6.661 1.00 63.51 H new ATOM 0 HD1 TYR A 122 4.799 -15.997 7.377 1.00 64.24 H new ATOM 0 HD2 TYR A 122 3.823 -14.746 3.413 1.00 2.00 H new ATOM 0 HE1 TYR A 122 5.359 -18.230 6.524 1.00 32.11 H new ATOM 0 HE2 TYR A 122 4.376 -16.982 2.578 1.00 3.45 H new ATOM 0 HH TYR A 122 6.106 -18.961 3.623 1.00 51.24 H new ATOM 1919 N ASP A 123 3.130 -12.464 8.770 1.00 52.12 N ATOM 1920 CA ASP A 123 3.028 -11.406 9.787 1.00 34.34 C ATOM 1921 C ASP A 123 4.021 -10.270 9.498 1.00 54.33 C ATOM 1922 O ASP A 123 5.095 -10.502 8.942 1.00 11.20 O ATOM 1923 CB ASP A 123 3.253 -11.975 11.209 1.00 72.31 C ATOM 1924 CG ASP A 123 3.049 -10.916 12.308 1.00 53.21 C ATOM 1925 OD1 ASP A 123 1.985 -10.256 12.303 1.00 72.25 O ATOM 1926 OD2 ASP A 123 3.946 -10.718 13.155 1.00 73.31 O ATOM 0 H ASP A 123 3.736 -13.237 9.045 1.00 52.12 H new ATOM 0 HA ASP A 123 2.018 -10.999 9.741 1.00 34.34 H new ATOM 0 HB2 ASP A 123 2.567 -12.805 11.377 1.00 72.31 H new ATOM 0 HB3 ASP A 123 4.264 -12.377 11.280 1.00 72.31 H new ATOM 1931 N GLY A 124 3.625 -9.052 9.897 1.00 3.42 N ATOM 1932 CA GLY A 124 4.389 -7.828 9.661 1.00 54.24 C ATOM 1933 C GLY A 124 3.466 -6.720 9.197 1.00 72.22 C ATOM 1934 O GLY A 124 3.554 -5.573 9.652 1.00 11.12 O ATOM 0 H GLY A 124 2.752 -8.892 10.399 1.00 3.42 H new ATOM 0 HA2 GLY A 124 4.900 -7.527 10.575 1.00 54.24 H new ATOM 0 HA3 GLY A 124 5.158 -8.009 8.911 1.00 54.24 H new ATOM 1938 N GLY A 125 2.554 -7.100 8.288 1.00 22.04 N ATOM 1939 CA GLY A 125 1.571 -6.191 7.705 1.00 24.01 C ATOM 1940 C GLY A 125 1.399 -6.448 6.221 1.00 24.23 C ATOM 1941 O GLY A 125 1.759 -7.528 5.714 1.00 22.31 O ATOM 0 H GLY A 125 2.483 -8.056 7.938 1.00 22.04 H new ATOM 0 HA2 GLY A 125 0.614 -6.313 8.211 1.00 24.01 H new ATOM 0 HA3 GLY A 125 1.886 -5.160 7.864 1.00 24.01 H new ATOM 1945 N ARG A 126 0.844 -5.453 5.530 1.00 4.14 N ATOM 1946 CA ARG A 126 0.739 -5.434 4.068 1.00 30.20 C ATOM 1947 C ARG A 126 0.641 -3.972 3.633 1.00 25.32 C ATOM 1948 O ARG A 126 -0.176 -3.237 4.173 1.00 54.43 O ATOM 1949 CB ARG A 126 -0.517 -6.217 3.579 1.00 72.23 C ATOM 1950 CG ARG A 126 -0.494 -6.562 2.060 1.00 4.03 C ATOM 1951 CD ARG A 126 -0.163 -8.042 1.768 1.00 63.01 C ATOM 1952 NE ARG A 126 0.934 -8.578 2.603 1.00 14.32 N ATOM 1953 CZ ARG A 126 1.440 -9.822 2.509 1.00 33.23 C ATOM 1954 NH1 ARG A 126 0.981 -10.691 1.609 1.00 61.11 N ATOM 1955 NH2 ARG A 126 2.383 -10.206 3.355 1.00 64.30 N ATOM 0 H ARG A 126 0.448 -4.625 5.975 1.00 4.14 H new ATOM 0 HA ARG A 126 1.613 -5.917 3.631 1.00 30.20 H new ATOM 0 HB2 ARG A 126 -0.602 -7.141 4.150 1.00 72.23 H new ATOM 0 HB3 ARG A 126 -1.408 -5.627 3.794 1.00 72.23 H new ATOM 0 HG2 ARG A 126 -1.465 -6.323 1.627 1.00 4.03 H new ATOM 0 HG3 ARG A 126 0.241 -5.929 1.563 1.00 4.03 H new ATOM 0 HD2 ARG A 126 -1.057 -8.644 1.927 1.00 63.01 H new ATOM 0 HD3 ARG A 126 0.108 -8.145 0.717 1.00 63.01 H new ATOM 0 HE ARG A 126 1.338 -7.957 3.304 1.00 14.32 H new ATOM 0 HH11 ARG A 126 0.231 -10.419 0.973 1.00 61.11 H new ATOM 0 HH12 ARG A 126 1.379 -11.628 1.556 1.00 61.11 H new ATOM 0 HH21 ARG A 126 2.720 -9.561 4.070 1.00 64.30 H new ATOM 0 HH22 ARG A 126 2.773 -11.147 3.292 1.00 64.30 H new ATOM 1969 N TYR A 127 1.443 -3.541 2.646 1.00 32.24 N ATOM 1970 CA TYR A 127 1.376 -2.154 2.157 1.00 72.23 C ATOM 1971 C TYR A 127 0.573 -2.116 0.862 1.00 3.15 C ATOM 1972 O TYR A 127 0.549 -3.092 0.110 1.00 51.10 O ATOM 1973 CB TYR A 127 2.791 -1.537 1.988 1.00 31.31 C ATOM 1974 CG TYR A 127 3.687 -2.131 0.874 1.00 23.00 C ATOM 1975 CD1 TYR A 127 4.470 -3.263 1.099 1.00 12.52 C ATOM 1976 CD2 TYR A 127 3.783 -1.520 -0.386 1.00 2.31 C ATOM 1977 CE1 TYR A 127 5.303 -3.764 0.115 1.00 42.54 C ATOM 1978 CE2 TYR A 127 4.624 -2.020 -1.366 1.00 63.13 C ATOM 1979 CZ TYR A 127 5.380 -3.142 -1.108 1.00 12.30 C ATOM 1980 OH TYR A 127 6.221 -3.646 -2.081 1.00 4.02 O ATOM 0 H TYR A 127 2.136 -4.123 2.176 1.00 32.24 H new ATOM 0 HA TYR A 127 0.867 -1.538 2.899 1.00 72.23 H new ATOM 0 HB2 TYR A 127 2.675 -0.470 1.797 1.00 31.31 H new ATOM 0 HB3 TYR A 127 3.319 -1.635 2.936 1.00 31.31 H new ATOM 0 HD1 TYR A 127 4.425 -3.757 2.058 1.00 12.52 H new ATOM 0 HD2 TYR A 127 3.189 -0.643 -0.595 1.00 2.31 H new ATOM 0 HE1 TYR A 127 5.895 -4.647 0.308 1.00 42.54 H new ATOM 0 HE2 TYR A 127 4.687 -1.533 -2.328 1.00 63.13 H new ATOM 0 HH TYR A 127 7.151 -3.567 -1.782 1.00 4.02 H new ATOM 1990 N MET A 128 -0.074 -0.981 0.614 1.00 44.44 N ATOM 1991 CA MET A 128 -0.970 -0.788 -0.532 1.00 20.40 C ATOM 1992 C MET A 128 -0.610 0.569 -1.155 1.00 64.42 C ATOM 1993 O MET A 128 -0.385 1.535 -0.422 1.00 31.54 O ATOM 1994 CB MET A 128 -2.460 -0.854 -0.052 1.00 63.11 C ATOM 1995 CG MET A 128 -3.462 -1.306 -1.132 1.00 61.14 C ATOM 1996 SD MET A 128 -3.833 -0.040 -2.366 1.00 63.30 S ATOM 1997 CE MET A 128 -5.090 0.907 -1.515 1.00 60.24 C ATOM 0 H MET A 128 0.007 -0.156 1.208 1.00 44.44 H new ATOM 0 HA MET A 128 -0.853 -1.570 -1.283 1.00 20.40 H new ATOM 0 HB2 MET A 128 -2.525 -1.537 0.795 1.00 63.11 H new ATOM 0 HB3 MET A 128 -2.755 0.131 0.310 1.00 63.11 H new ATOM 0 HG2 MET A 128 -3.063 -2.186 -1.637 1.00 61.14 H new ATOM 0 HG3 MET A 128 -4.390 -1.610 -0.648 1.00 61.14 H new ATOM 0 HE1 MET A 128 -5.824 1.267 -2.236 1.00 60.24 H new ATOM 0 HE2 MET A 128 -5.585 0.275 -0.778 1.00 60.24 H new ATOM 0 HE3 MET A 128 -4.628 1.757 -1.013 1.00 60.24 H new ATOM 2007 N GLU A 129 -0.507 0.637 -2.489 1.00 44.15 N ATOM 2008 CA GLU A 129 -0.003 1.834 -3.183 1.00 41.23 C ATOM 2009 C GLU A 129 -1.021 2.335 -4.228 1.00 41.00 C ATOM 2010 O GLU A 129 -1.477 1.564 -5.081 1.00 14.42 O ATOM 2011 CB GLU A 129 1.357 1.496 -3.838 1.00 73.02 C ATOM 2012 CG GLU A 129 2.094 2.694 -4.450 1.00 70.24 C ATOM 2013 CD GLU A 129 3.433 2.296 -5.079 1.00 31.51 C ATOM 2014 OE1 GLU A 129 4.464 2.297 -4.364 1.00 15.12 O ATOM 2015 OE2 GLU A 129 3.462 1.959 -6.288 1.00 51.14 O ATOM 0 H GLU A 129 -0.767 -0.126 -3.114 1.00 44.15 H new ATOM 0 HA GLU A 129 0.138 2.641 -2.464 1.00 41.23 H new ATOM 0 HB2 GLU A 129 2.001 1.036 -3.088 1.00 73.02 H new ATOM 0 HB3 GLU A 129 1.194 0.752 -4.617 1.00 73.02 H new ATOM 0 HG2 GLU A 129 1.463 3.157 -5.208 1.00 70.24 H new ATOM 0 HG3 GLU A 129 2.267 3.444 -3.678 1.00 70.24 H new ATOM 2022 N LEU A 130 -1.374 3.633 -4.131 1.00 55.25 N ATOM 2023 CA LEU A 130 -2.306 4.313 -5.052 1.00 70.21 C ATOM 2024 C LEU A 130 -1.552 5.471 -5.718 1.00 11.23 C ATOM 2025 O LEU A 130 -0.669 6.071 -5.096 1.00 42.44 O ATOM 2026 CB LEU A 130 -3.566 4.895 -4.307 1.00 21.05 C ATOM 2027 CG LEU A 130 -4.088 4.134 -3.036 1.00 13.15 C ATOM 2028 CD1 LEU A 130 -3.214 4.411 -1.797 1.00 24.24 C ATOM 2029 CD2 LEU A 130 -5.553 4.491 -2.740 1.00 30.15 C ATOM 0 H LEU A 130 -1.014 4.247 -3.400 1.00 55.25 H new ATOM 0 HA LEU A 130 -2.661 3.584 -5.780 1.00 70.21 H new ATOM 0 HB2 LEU A 130 -3.336 5.919 -4.012 1.00 21.05 H new ATOM 0 HB3 LEU A 130 -4.384 4.946 -5.025 1.00 21.05 H new ATOM 0 HG LEU A 130 -4.024 3.069 -3.258 1.00 13.15 H new ATOM 0 HD11 LEU A 130 -3.612 3.865 -0.942 1.00 24.24 H new ATOM 0 HD12 LEU A 130 -2.192 4.085 -1.992 1.00 24.24 H new ATOM 0 HD13 LEU A 130 -3.219 5.479 -1.580 1.00 24.24 H new ATOM 0 HD21 LEU A 130 -5.888 3.950 -1.855 1.00 30.15 H new ATOM 0 HD22 LEU A 130 -5.638 5.563 -2.563 1.00 30.15 H new ATOM 0 HD23 LEU A 130 -6.174 4.214 -3.592 1.00 30.15 H new ATOM 2041 N GLU A 131 -1.898 5.781 -6.974 1.00 52.04 N ATOM 2042 CA GLU A 131 -1.440 7.002 -7.651 1.00 74.33 C ATOM 2043 C GLU A 131 -2.651 7.695 -8.310 1.00 64.21 C ATOM 2044 O GLU A 131 -3.154 7.212 -9.328 1.00 14.24 O ATOM 2045 CB GLU A 131 -0.319 6.698 -8.689 1.00 24.12 C ATOM 2046 CG GLU A 131 0.967 6.100 -8.069 1.00 61.22 C ATOM 2047 CD GLU A 131 2.128 5.978 -9.060 1.00 5.35 C ATOM 2048 OE1 GLU A 131 1.910 5.465 -10.175 1.00 75.03 O ATOM 2049 OE2 GLU A 131 3.251 6.420 -8.743 1.00 33.32 O ATOM 0 H GLU A 131 -2.502 5.194 -7.549 1.00 52.04 H new ATOM 0 HA GLU A 131 -1.001 7.674 -6.914 1.00 74.33 H new ATOM 0 HB2 GLU A 131 -0.707 6.004 -9.435 1.00 24.12 H new ATOM 0 HB3 GLU A 131 -0.063 7.619 -9.213 1.00 24.12 H new ATOM 0 HG2 GLU A 131 1.280 6.723 -7.231 1.00 61.22 H new ATOM 0 HG3 GLU A 131 0.740 5.113 -7.665 1.00 61.22 H new ATOM 2056 N PRO A 132 -3.181 8.819 -7.698 1.00 40.34 N ATOM 2057 CA PRO A 132 -4.275 9.618 -8.296 1.00 22.34 C ATOM 2058 C PRO A 132 -3.824 10.355 -9.574 1.00 64.02 C ATOM 2059 O PRO A 132 -2.624 10.589 -9.794 1.00 24.41 O ATOM 2060 CB PRO A 132 -4.651 10.618 -7.168 1.00 73.14 C ATOM 2061 CG PRO A 132 -3.408 10.746 -6.348 1.00 10.51 C ATOM 2062 CD PRO A 132 -2.766 9.378 -6.378 1.00 4.12 C ATOM 0 HA PRO A 132 -5.114 9.000 -8.616 1.00 22.34 H new ATOM 0 HB2 PRO A 132 -4.957 11.581 -7.577 1.00 73.14 H new ATOM 0 HB3 PRO A 132 -5.484 10.247 -6.570 1.00 73.14 H new ATOM 0 HG2 PRO A 132 -2.741 11.502 -6.761 1.00 10.51 H new ATOM 0 HG3 PRO A 132 -3.640 11.049 -5.327 1.00 10.51 H new ATOM 0 HD2 PRO A 132 -1.681 9.443 -6.294 1.00 4.12 H new ATOM 0 HD3 PRO A 132 -3.112 8.755 -5.553 1.00 4.12 H new ATOM 2070 N ASP A 133 -4.811 10.725 -10.399 1.00 72.25 N ATOM 2071 CA ASP A 133 -4.590 11.425 -11.683 1.00 24.12 C ATOM 2072 C ASP A 133 -4.312 12.931 -11.479 1.00 12.22 C ATOM 2073 O ASP A 133 -3.806 13.615 -12.379 1.00 32.34 O ATOM 2074 CB ASP A 133 -5.810 11.208 -12.615 1.00 30.22 C ATOM 2075 CG ASP A 133 -5.628 11.851 -13.997 1.00 4.33 C ATOM 2076 OD1 ASP A 133 -4.680 11.459 -14.716 1.00 21.53 O ATOM 2077 OD2 ASP A 133 -6.403 12.765 -14.363 1.00 22.30 O ATOM 0 H ASP A 133 -5.795 10.548 -10.198 1.00 72.25 H new ATOM 0 HA ASP A 133 -3.702 11.001 -12.152 1.00 24.12 H new ATOM 0 HB2 ASP A 133 -5.982 10.139 -12.737 1.00 30.22 H new ATOM 0 HB3 ASP A 133 -6.700 11.622 -12.142 1.00 30.22 H new ATOM 2082 N ARG A 134 -4.589 13.415 -10.270 1.00 53.22 N ATOM 2083 CA ARG A 134 -4.479 14.836 -9.909 1.00 74.15 C ATOM 2084 C ARG A 134 -3.970 14.961 -8.472 1.00 61.21 C ATOM 2085 O ARG A 134 -3.816 13.949 -7.766 1.00 3.20 O ATOM 2086 CB ARG A 134 -5.861 15.531 -10.067 1.00 42.22 C ATOM 2087 CG ARG A 134 -7.026 14.861 -9.271 1.00 4.33 C ATOM 2088 CD ARG A 134 -7.788 15.828 -8.350 1.00 50.33 C ATOM 2089 NE ARG A 134 -8.901 15.170 -7.646 1.00 50.41 N ATOM 2090 CZ ARG A 134 -10.145 15.020 -8.120 1.00 30.02 C ATOM 2091 NH1 ARG A 134 -10.486 15.477 -9.326 1.00 73.24 N ATOM 2092 NH2 ARG A 134 -11.048 14.418 -7.374 1.00 11.01 N ATOM 0 H ARG A 134 -4.901 12.826 -9.498 1.00 53.22 H new ATOM 0 HA ARG A 134 -3.770 15.328 -10.575 1.00 74.15 H new ATOM 0 HB2 ARG A 134 -5.769 16.568 -9.745 1.00 42.22 H new ATOM 0 HB3 ARG A 134 -6.125 15.548 -11.124 1.00 42.22 H new ATOM 0 HG2 ARG A 134 -7.728 14.418 -9.977 1.00 4.33 H new ATOM 0 HG3 ARG A 134 -6.621 14.046 -8.671 1.00 4.33 H new ATOM 0 HD2 ARG A 134 -7.098 16.250 -7.619 1.00 50.33 H new ATOM 0 HD3 ARG A 134 -8.175 16.659 -8.940 1.00 50.33 H new ATOM 0 HE ARG A 134 -8.708 14.796 -6.717 1.00 50.41 H new ATOM 0 HH11 ARG A 134 -9.794 15.951 -9.906 1.00 73.24 H new ATOM 0 HH12 ARG A 134 -11.439 15.352 -9.668 1.00 73.24 H new ATOM 0 HH21 ARG A 134 -10.796 14.073 -6.448 1.00 11.01 H new ATOM 0 HH22 ARG A 134 -11.999 14.297 -7.722 1.00 11.01 H new ATOM 2106 N ASP A 135 -3.691 16.205 -8.052 1.00 2.02 N ATOM 2107 CA ASP A 135 -3.266 16.499 -6.674 1.00 1.02 C ATOM 2108 C ASP A 135 -4.493 16.486 -5.749 1.00 42.04 C ATOM 2109 O ASP A 135 -5.530 17.060 -6.093 1.00 70.54 O ATOM 2110 CB ASP A 135 -2.540 17.868 -6.610 1.00 74.21 C ATOM 2111 CG ASP A 135 -1.770 18.061 -5.291 1.00 62.13 C ATOM 2112 OD1 ASP A 135 -0.591 17.647 -5.217 1.00 61.35 O ATOM 2113 OD2 ASP A 135 -2.340 18.603 -4.320 1.00 62.33 O ATOM 0 H ASP A 135 -3.753 17.028 -8.651 1.00 2.02 H new ATOM 0 HA ASP A 135 -2.564 15.734 -6.342 1.00 1.02 H new ATOM 0 HB2 ASP A 135 -1.847 17.949 -7.448 1.00 74.21 H new ATOM 0 HB3 ASP A 135 -3.270 18.669 -6.722 1.00 74.21 H new ATOM 2118 N LEU A 136 -4.375 15.814 -4.596 1.00 22.42 N ATOM 2119 CA LEU A 136 -5.480 15.669 -3.632 1.00 3.21 C ATOM 2120 C LEU A 136 -5.444 16.800 -2.585 1.00 43.51 C ATOM 2121 O LEU A 136 -4.387 17.116 -2.028 1.00 53.52 O ATOM 2122 CB LEU A 136 -5.392 14.281 -2.947 1.00 51.53 C ATOM 2123 CG LEU A 136 -5.374 13.045 -3.905 1.00 22.20 C ATOM 2124 CD1 LEU A 136 -5.274 11.728 -3.114 1.00 24.43 C ATOM 2125 CD2 LEU A 136 -6.597 13.032 -4.851 1.00 1.21 C ATOM 0 H LEU A 136 -3.512 15.355 -4.303 1.00 22.42 H new ATOM 0 HA LEU A 136 -6.428 15.741 -4.165 1.00 3.21 H new ATOM 0 HB2 LEU A 136 -4.490 14.256 -2.336 1.00 51.53 H new ATOM 0 HB3 LEU A 136 -6.239 14.178 -2.269 1.00 51.53 H new ATOM 0 HG LEU A 136 -4.483 13.134 -4.527 1.00 22.20 H new ATOM 0 HD11 LEU A 136 -5.264 10.887 -3.807 1.00 24.43 H new ATOM 0 HD12 LEU A 136 -4.356 11.725 -2.526 1.00 24.43 H new ATOM 0 HD13 LEU A 136 -6.132 11.638 -2.447 1.00 24.43 H new ATOM 0 HD21 LEU A 136 -6.546 12.157 -5.500 1.00 1.21 H new ATOM 0 HD22 LEU A 136 -7.513 12.993 -4.261 1.00 1.21 H new ATOM 0 HD23 LEU A 136 -6.596 13.936 -5.460 1.00 1.21 H new ATOM 2137 N SER A 137 -6.609 17.421 -2.360 1.00 12.22 N ATOM 2138 CA SER A 137 -6.818 18.434 -1.309 1.00 62.05 C ATOM 2139 C SER A 137 -7.635 17.817 -0.153 1.00 34.20 C ATOM 2140 O SER A 137 -8.120 16.682 -0.265 1.00 24.54 O ATOM 2141 CB SER A 137 -7.553 19.650 -1.916 1.00 54.14 C ATOM 2142 OG SER A 137 -6.800 20.227 -2.971 1.00 31.34 O ATOM 0 H SER A 137 -7.448 17.233 -2.910 1.00 12.22 H new ATOM 0 HA SER A 137 -5.859 18.767 -0.912 1.00 62.05 H new ATOM 0 HB2 SER A 137 -8.529 19.340 -2.289 1.00 54.14 H new ATOM 0 HB3 SER A 137 -7.730 20.396 -1.141 1.00 54.14 H new ATOM 0 HG SER A 137 -7.287 20.993 -3.340 1.00 31.34 H new ATOM 2148 N ASP A 138 -7.761 18.544 0.970 1.00 14.20 N ATOM 2149 CA ASP A 138 -8.627 18.114 2.083 1.00 21.34 C ATOM 2150 C ASP A 138 -10.105 18.311 1.679 1.00 62.52 C ATOM 2151 O ASP A 138 -10.546 19.430 1.387 1.00 20.21 O ATOM 2152 CB ASP A 138 -8.269 18.849 3.413 1.00 74.21 C ATOM 2153 CG ASP A 138 -8.387 20.379 3.347 1.00 13.53 C ATOM 2154 OD1 ASP A 138 -7.453 21.031 2.831 1.00 74.14 O ATOM 2155 OD2 ASP A 138 -9.404 20.934 3.810 1.00 33.04 O ATOM 0 H ASP A 138 -7.277 19.427 1.132 1.00 14.20 H new ATOM 0 HA ASP A 138 -8.460 17.055 2.279 1.00 21.34 H new ATOM 0 HB2 ASP A 138 -8.922 18.481 4.204 1.00 74.21 H new ATOM 0 HB3 ASP A 138 -7.249 18.588 3.694 1.00 74.21 H new ATOM 2160 N GLY A 139 -10.831 17.186 1.590 1.00 10.21 N ATOM 2161 CA GLY A 139 -12.217 17.155 1.100 1.00 32.40 C ATOM 2162 C GLY A 139 -12.329 16.510 -0.277 1.00 32.23 C ATOM 2163 O GLY A 139 -13.430 16.417 -0.831 1.00 43.10 O ATOM 0 H GLY A 139 -10.472 16.269 1.857 1.00 10.21 H new ATOM 0 HA2 GLY A 139 -12.838 16.606 1.808 1.00 32.40 H new ATOM 0 HA3 GLY A 139 -12.607 18.172 1.055 1.00 32.40 H new ATOM 2167 N ASP A 140 -11.181 16.060 -0.831 1.00 41.43 N ATOM 2168 CA ASP A 140 -11.131 15.350 -2.132 1.00 42.33 C ATOM 2169 C ASP A 140 -11.515 13.863 -1.907 1.00 73.42 C ATOM 2170 O ASP A 140 -11.763 13.459 -0.770 1.00 25.14 O ATOM 2171 CB ASP A 140 -9.704 15.482 -2.745 1.00 63.22 C ATOM 2172 CG ASP A 140 -9.658 15.321 -4.276 1.00 71.24 C ATOM 2173 OD1 ASP A 140 -9.663 14.184 -4.772 1.00 52.32 O ATOM 2174 OD2 ASP A 140 -9.617 16.342 -4.988 1.00 64.51 O ATOM 0 H ASP A 140 -10.267 16.177 -0.393 1.00 41.43 H new ATOM 0 HA ASP A 140 -11.839 15.790 -2.834 1.00 42.33 H new ATOM 0 HB2 ASP A 140 -9.296 16.458 -2.481 1.00 63.22 H new ATOM 0 HB3 ASP A 140 -9.055 14.732 -2.292 1.00 63.22 H new ATOM 2179 N GLU A 141 -11.606 13.059 -2.983 1.00 62.45 N ATOM 2180 CA GLU A 141 -11.867 11.600 -2.888 1.00 52.34 C ATOM 2181 C GLU A 141 -10.705 10.798 -3.506 1.00 15.35 C ATOM 2182 O GLU A 141 -9.801 11.373 -4.113 1.00 15.35 O ATOM 2183 CB GLU A 141 -13.214 11.280 -3.590 1.00 22.54 C ATOM 2184 CG GLU A 141 -14.425 11.969 -2.931 1.00 70.21 C ATOM 2185 CD GLU A 141 -15.706 11.883 -3.770 1.00 30.13 C ATOM 2186 OE1 GLU A 141 -16.306 10.794 -3.849 1.00 71.41 O ATOM 2187 OE2 GLU A 141 -16.112 12.911 -4.363 1.00 15.12 O ATOM 0 H GLU A 141 -11.502 13.395 -3.940 1.00 62.45 H new ATOM 0 HA GLU A 141 -11.938 11.308 -1.840 1.00 52.34 H new ATOM 0 HB2 GLU A 141 -13.154 11.588 -4.634 1.00 22.54 H new ATOM 0 HB3 GLU A 141 -13.371 10.201 -3.584 1.00 22.54 H new ATOM 0 HG2 GLU A 141 -14.606 11.515 -1.957 1.00 70.21 H new ATOM 0 HG3 GLU A 141 -14.185 13.017 -2.754 1.00 70.21 H new ATOM 2194 N ILE A 142 -10.733 9.463 -3.315 1.00 44.24 N ATOM 2195 CA ILE A 142 -9.678 8.528 -3.788 1.00 22.33 C ATOM 2196 C ILE A 142 -10.223 7.074 -3.780 1.00 1.31 C ATOM 2197 O ILE A 142 -11.048 6.720 -2.930 1.00 33.11 O ATOM 2198 CB ILE A 142 -8.374 8.650 -2.899 1.00 60.11 C ATOM 2199 CG1 ILE A 142 -7.208 7.724 -3.403 1.00 30.11 C ATOM 2200 CG2 ILE A 142 -8.695 8.399 -1.407 1.00 34.32 C ATOM 2201 CD1 ILE A 142 -6.658 8.060 -4.789 1.00 50.45 C ATOM 0 H ILE A 142 -11.494 8.994 -2.824 1.00 44.24 H new ATOM 0 HA ILE A 142 -9.405 8.794 -4.809 1.00 22.33 H new ATOM 0 HB ILE A 142 -8.016 9.674 -3.001 1.00 60.11 H new ATOM 0 HG12 ILE A 142 -6.390 7.774 -2.684 1.00 30.11 H new ATOM 0 HG13 ILE A 142 -7.563 6.693 -3.411 1.00 30.11 H new ATOM 0 HG21 ILE A 142 -7.782 8.489 -0.818 1.00 34.32 H new ATOM 0 HG22 ILE A 142 -9.423 9.134 -1.063 1.00 34.32 H new ATOM 0 HG23 ILE A 142 -9.107 7.397 -1.287 1.00 34.32 H new ATOM 0 HD11 ILE A 142 -5.859 7.363 -5.042 1.00 50.45 H new ATOM 0 HD12 ILE A 142 -7.457 7.980 -5.527 1.00 50.45 H new ATOM 0 HD13 ILE A 142 -6.266 9.077 -4.788 1.00 50.45 H new ATOM 2213 N THR A 143 -9.784 6.255 -4.750 1.00 71.43 N ATOM 2214 CA THR A 143 -10.230 4.857 -4.913 1.00 44.21 C ATOM 2215 C THR A 143 -9.299 3.898 -4.139 1.00 10.32 C ATOM 2216 O THR A 143 -8.093 3.889 -4.385 1.00 64.31 O ATOM 2217 CB THR A 143 -10.242 4.493 -6.433 1.00 34.30 C ATOM 2218 OG1 THR A 143 -11.117 5.395 -7.137 1.00 31.15 O ATOM 2219 CG2 THR A 143 -10.696 3.054 -6.670 1.00 62.13 C ATOM 0 H THR A 143 -9.103 6.546 -5.451 1.00 71.43 H new ATOM 0 HA THR A 143 -11.237 4.753 -4.508 1.00 44.21 H new ATOM 0 HB THR A 143 -9.222 4.587 -6.806 1.00 34.30 H new ATOM 0 HG1 THR A 143 -11.123 5.168 -8.090 1.00 31.15 H new ATOM 0 HG21 THR A 143 -10.690 2.842 -7.739 1.00 62.13 H new ATOM 0 HG22 THR A 143 -10.017 2.370 -6.161 1.00 62.13 H new ATOM 0 HG23 THR A 143 -11.705 2.922 -6.280 1.00 62.13 H new ATOM 2227 N LEU A 144 -9.876 3.076 -3.231 1.00 40.22 N ATOM 2228 CA LEU A 144 -9.119 2.189 -2.308 1.00 42.45 C ATOM 2229 C LEU A 144 -9.373 0.715 -2.690 1.00 32.32 C ATOM 2230 O LEU A 144 -10.481 0.195 -2.490 1.00 44.14 O ATOM 2231 CB LEU A 144 -9.543 2.446 -0.815 1.00 4.45 C ATOM 2232 CG LEU A 144 -8.760 3.551 -0.016 1.00 65.14 C ATOM 2233 CD1 LEU A 144 -7.330 3.089 0.356 1.00 11.23 C ATOM 2234 CD2 LEU A 144 -8.723 4.887 -0.783 1.00 64.40 C ATOM 0 H LEU A 144 -10.887 3.007 -3.115 1.00 40.22 H new ATOM 0 HA LEU A 144 -8.055 2.409 -2.399 1.00 42.45 H new ATOM 0 HB2 LEU A 144 -10.600 2.711 -0.807 1.00 4.45 H new ATOM 0 HB3 LEU A 144 -9.446 1.506 -0.272 1.00 4.45 H new ATOM 0 HG LEU A 144 -9.306 3.714 0.913 1.00 65.14 H new ATOM 0 HD11 LEU A 144 -6.823 3.881 0.907 1.00 11.23 H new ATOM 0 HD12 LEU A 144 -7.386 2.195 0.976 1.00 11.23 H new ATOM 0 HD13 LEU A 144 -6.772 2.865 -0.553 1.00 11.23 H new ATOM 0 HD21 LEU A 144 -8.174 5.626 -0.200 1.00 64.40 H new ATOM 0 HD22 LEU A 144 -8.228 4.742 -1.743 1.00 64.40 H new ATOM 0 HD23 LEU A 144 -9.741 5.239 -0.949 1.00 64.40 H new ATOM 2246 N ASP A 145 -8.354 0.066 -3.273 1.00 44.30 N ATOM 2247 CA ASP A 145 -8.368 -1.385 -3.532 1.00 2.30 C ATOM 2248 C ASP A 145 -7.258 -2.072 -2.729 1.00 20.24 C ATOM 2249 O ASP A 145 -6.075 -1.952 -3.042 1.00 53.35 O ATOM 2250 CB ASP A 145 -8.192 -1.698 -5.035 1.00 60.03 C ATOM 2251 CG ASP A 145 -9.431 -1.390 -5.869 1.00 3.22 C ATOM 2252 OD1 ASP A 145 -9.654 -0.201 -6.183 1.00 4.35 O ATOM 2253 OD2 ASP A 145 -10.171 -2.334 -6.224 1.00 54.51 O ATOM 0 H ASP A 145 -7.498 0.529 -3.578 1.00 44.30 H new ATOM 0 HA ASP A 145 -9.340 -1.767 -3.219 1.00 2.30 H new ATOM 0 HB2 ASP A 145 -7.351 -1.123 -5.422 1.00 60.03 H new ATOM 0 HB3 ASP A 145 -7.938 -2.752 -5.151 1.00 60.03 H new ATOM 2258 N PHE A 146 -7.679 -2.791 -1.687 1.00 24.34 N ATOM 2259 CA PHE A 146 -6.800 -3.644 -0.834 1.00 20.21 C ATOM 2260 C PHE A 146 -6.324 -4.885 -1.625 1.00 51.15 C ATOM 2261 O PHE A 146 -5.439 -5.626 -1.194 1.00 43.12 O ATOM 2262 CB PHE A 146 -7.573 -4.056 0.457 1.00 61.31 C ATOM 2263 CG PHE A 146 -8.514 -2.957 0.940 1.00 1.40 C ATOM 2264 CD1 PHE A 146 -8.009 -1.759 1.435 1.00 61.31 C ATOM 2265 CD2 PHE A 146 -9.898 -3.090 0.804 1.00 30.02 C ATOM 2266 CE1 PHE A 146 -8.857 -0.736 1.794 1.00 21.01 C ATOM 2267 CE2 PHE A 146 -10.742 -2.060 1.153 1.00 22.13 C ATOM 2268 CZ PHE A 146 -10.221 -0.885 1.646 1.00 43.25 C ATOM 0 H PHE A 146 -8.656 -2.808 -1.394 1.00 24.34 H new ATOM 0 HA PHE A 146 -5.914 -3.080 -0.543 1.00 20.21 H new ATOM 0 HB2 PHE A 146 -8.146 -4.963 0.262 1.00 61.31 H new ATOM 0 HB3 PHE A 146 -6.859 -4.293 1.246 1.00 61.31 H new ATOM 0 HD1 PHE A 146 -6.942 -1.630 1.539 1.00 61.31 H new ATOM 0 HD2 PHE A 146 -10.311 -4.012 0.421 1.00 30.02 H new ATOM 0 HE1 PHE A 146 -8.455 0.184 2.192 1.00 21.01 H new ATOM 0 HE2 PHE A 146 -11.810 -2.173 1.040 1.00 22.13 H new ATOM 0 HZ PHE A 146 -10.883 -0.076 1.918 1.00 43.25 H new ATOM 2278 N ASN A 147 -6.956 -5.078 -2.788 1.00 24.31 N ATOM 2279 CA ASN A 147 -6.624 -6.120 -3.759 1.00 33.22 C ATOM 2280 C ASN A 147 -5.516 -5.654 -4.731 1.00 54.43 C ATOM 2281 O ASN A 147 -5.227 -6.337 -5.712 1.00 11.32 O ATOM 2282 CB ASN A 147 -7.901 -6.532 -4.536 1.00 11.01 C ATOM 2283 CG ASN A 147 -9.040 -7.035 -3.640 1.00 1.31 C ATOM 2284 OD1 ASN A 147 -9.228 -6.580 -2.510 1.00 52.21 O ATOM 2285 ND2 ASN A 147 -9.801 -7.989 -4.131 1.00 13.33 N ATOM 0 H ASN A 147 -7.737 -4.493 -3.086 1.00 24.31 H new ATOM 0 HA ASN A 147 -6.238 -6.985 -3.220 1.00 33.22 H new ATOM 0 HB2 ASN A 147 -8.256 -5.677 -5.112 1.00 11.01 H new ATOM 0 HB3 ASN A 147 -7.643 -7.313 -5.251 1.00 11.01 H new ATOM 0 HD21 ASN A 147 -10.566 -8.368 -3.574 1.00 13.33 H new ATOM 0 HD22 ASN A 147 -9.626 -8.349 -5.069 1.00 13.33 H new ATOM 2292 N LEU A 148 -4.930 -4.460 -4.481 1.00 60.50 N ATOM 2293 CA LEU A 148 -3.714 -3.983 -5.185 1.00 43.44 C ATOM 2294 C LEU A 148 -2.537 -3.905 -4.183 1.00 31.44 C ATOM 2295 O LEU A 148 -1.532 -3.236 -4.437 1.00 72.20 O ATOM 2296 CB LEU A 148 -3.959 -2.593 -5.854 1.00 31.32 C ATOM 2297 CG LEU A 148 -5.205 -2.470 -6.796 1.00 62.35 C ATOM 2298 CD1 LEU A 148 -5.229 -1.119 -7.552 1.00 15.42 C ATOM 2299 CD2 LEU A 148 -5.324 -3.656 -7.767 1.00 0.22 C ATOM 0 H LEU A 148 -5.285 -3.801 -3.788 1.00 60.50 H new ATOM 0 HA LEU A 148 -3.467 -4.690 -5.977 1.00 43.44 H new ATOM 0 HB2 LEU A 148 -4.056 -1.849 -5.064 1.00 31.32 H new ATOM 0 HB3 LEU A 148 -3.071 -2.332 -6.430 1.00 31.32 H new ATOM 0 HG LEU A 148 -6.082 -2.498 -6.149 1.00 62.35 H new ATOM 0 HD11 LEU A 148 -6.109 -1.077 -8.193 1.00 15.42 H new ATOM 0 HD12 LEU A 148 -5.264 -0.300 -6.833 1.00 15.42 H new ATOM 0 HD13 LEU A 148 -4.331 -1.028 -8.163 1.00 15.42 H new ATOM 0 HD21 LEU A 148 -6.203 -3.523 -8.398 1.00 0.22 H new ATOM 0 HD22 LEU A 148 -4.433 -3.705 -8.393 1.00 0.22 H new ATOM 0 HD23 LEU A 148 -5.421 -4.582 -7.200 1.00 0.22 H new ATOM 2311 N ALA A 149 -2.670 -4.631 -3.056 1.00 44.31 N ATOM 2312 CA ALA A 149 -1.701 -4.585 -1.945 1.00 55.41 C ATOM 2313 C ALA A 149 -0.567 -5.593 -2.158 1.00 1.02 C ATOM 2314 O ALA A 149 -0.820 -6.745 -2.483 1.00 11.44 O ATOM 2315 CB ALA A 149 -2.407 -4.853 -0.607 1.00 73.43 C ATOM 0 H ALA A 149 -3.452 -5.265 -2.891 1.00 44.31 H new ATOM 0 HA ALA A 149 -1.266 -3.586 -1.920 1.00 55.41 H new ATOM 0 HB1 ALA A 149 -1.678 -4.816 0.203 1.00 73.43 H new ATOM 0 HB2 ALA A 149 -3.173 -4.095 -0.441 1.00 73.43 H new ATOM 0 HB3 ALA A 149 -2.872 -5.839 -0.632 1.00 73.43 H new ATOM 2321 N TYR A 150 0.673 -5.150 -1.904 1.00 42.42 N ATOM 2322 CA TYR A 150 1.895 -5.926 -2.189 1.00 52.33 C ATOM 2323 C TYR A 150 2.501 -6.452 -0.878 1.00 23.23 C ATOM 2324 O TYR A 150 2.285 -5.871 0.199 1.00 73.31 O ATOM 2325 CB TYR A 150 2.929 -5.044 -2.938 1.00 4.24 C ATOM 2326 CG TYR A 150 2.328 -4.194 -4.075 1.00 11.51 C ATOM 2327 CD1 TYR A 150 1.835 -4.785 -5.242 1.00 33.24 C ATOM 2328 CD2 TYR A 150 2.246 -2.798 -3.970 1.00 75.20 C ATOM 2329 CE1 TYR A 150 1.291 -4.017 -6.258 1.00 44.41 C ATOM 2330 CE2 TYR A 150 1.703 -2.032 -4.983 1.00 53.03 C ATOM 2331 CZ TYR A 150 1.228 -2.643 -6.127 1.00 61.34 C ATOM 2332 OH TYR A 150 0.689 -1.881 -7.146 1.00 12.34 O ATOM 0 H TYR A 150 0.860 -4.236 -1.492 1.00 42.42 H new ATOM 0 HA TYR A 150 1.633 -6.773 -2.823 1.00 52.33 H new ATOM 0 HB2 TYR A 150 3.412 -4.381 -2.220 1.00 4.24 H new ATOM 0 HB3 TYR A 150 3.706 -5.687 -3.352 1.00 4.24 H new ATOM 0 HD1 TYR A 150 1.879 -5.858 -5.353 1.00 33.24 H new ATOM 0 HD2 TYR A 150 2.615 -2.312 -3.079 1.00 75.20 H new ATOM 0 HE1 TYR A 150 0.916 -4.492 -7.153 1.00 44.41 H new ATOM 0 HE2 TYR A 150 1.650 -0.958 -4.881 1.00 53.03 H new ATOM 0 HH TYR A 150 0.718 -0.934 -6.897 1.00 12.34 H new ATOM 2342 N SER A 151 3.256 -7.552 -0.991 1.00 41.42 N ATOM 2343 CA SER A 151 3.932 -8.194 0.141 1.00 11.42 C ATOM 2344 C SER A 151 5.129 -7.340 0.639 1.00 3.52 C ATOM 2345 O SER A 151 5.993 -6.980 -0.169 1.00 33.54 O ATOM 2346 CB SER A 151 4.395 -9.602 -0.289 1.00 22.11 C ATOM 2347 OG SER A 151 3.292 -10.387 -0.724 1.00 13.33 O ATOM 0 H SER A 151 3.416 -8.025 -1.880 1.00 41.42 H new ATOM 0 HA SER A 151 3.235 -8.280 0.975 1.00 11.42 H new ATOM 0 HB2 SER A 151 5.127 -9.519 -1.092 1.00 22.11 H new ATOM 0 HB3 SER A 151 4.892 -10.097 0.545 1.00 22.11 H new ATOM 0 HG SER A 151 3.608 -11.275 -0.993 1.00 13.33 H new ATOM 2353 N PRO A 152 5.170 -6.970 1.974 1.00 13.05 N ATOM 2354 CA PRO A 152 6.278 -6.173 2.573 1.00 55.41 C ATOM 2355 C PRO A 152 7.639 -6.879 2.502 1.00 52.15 C ATOM 2356 O PRO A 152 7.724 -8.095 2.719 1.00 43.54 O ATOM 2357 CB PRO A 152 5.833 -5.979 4.052 1.00 23.02 C ATOM 2358 CG PRO A 152 4.360 -6.203 4.036 1.00 13.24 C ATOM 2359 CD PRO A 152 4.138 -7.275 2.998 1.00 41.14 C ATOM 0 HA PRO A 152 6.431 -5.238 2.034 1.00 55.41 H new ATOM 0 HB2 PRO A 152 6.334 -6.687 4.712 1.00 23.02 H new ATOM 0 HB3 PRO A 152 6.078 -4.979 4.411 1.00 23.02 H new ATOM 0 HG2 PRO A 152 3.999 -6.520 5.014 1.00 13.24 H new ATOM 0 HG3 PRO A 152 3.825 -5.289 3.780 1.00 13.24 H new ATOM 0 HD2 PRO A 152 4.267 -8.274 3.416 1.00 41.14 H new ATOM 0 HD3 PRO A 152 3.132 -7.231 2.582 1.00 41.14 H new ATOM 2367 N PHE A 153 8.688 -6.093 2.206 1.00 73.22 N ATOM 2368 CA PHE A 153 10.092 -6.539 2.231 1.00 2.14 C ATOM 2369 C PHE A 153 10.467 -7.100 3.611 1.00 20.33 C ATOM 2370 O PHE A 153 11.069 -8.177 3.726 1.00 72.11 O ATOM 2371 CB PHE A 153 11.030 -5.343 1.907 1.00 11.52 C ATOM 2372 CG PHE A 153 10.825 -4.716 0.531 1.00 33.21 C ATOM 2373 CD1 PHE A 153 9.815 -3.772 0.308 1.00 22.34 C ATOM 2374 CD2 PHE A 153 11.641 -5.072 -0.538 1.00 44.20 C ATOM 2375 CE1 PHE A 153 9.637 -3.208 -0.941 1.00 23.40 C ATOM 2376 CE2 PHE A 153 11.461 -4.508 -1.782 1.00 45.41 C ATOM 2377 CZ PHE A 153 10.458 -3.579 -1.987 1.00 53.32 C ATOM 0 H PHE A 153 8.583 -5.114 1.938 1.00 73.22 H new ATOM 0 HA PHE A 153 10.209 -7.324 1.484 1.00 2.14 H new ATOM 0 HB2 PHE A 153 10.887 -4.573 2.665 1.00 11.52 H new ATOM 0 HB3 PHE A 153 12.064 -5.680 1.986 1.00 11.52 H new ATOM 0 HD1 PHE A 153 9.167 -3.481 1.122 1.00 22.34 H new ATOM 0 HD2 PHE A 153 12.425 -5.800 -0.391 1.00 44.20 H new ATOM 0 HE1 PHE A 153 8.857 -2.478 -1.099 1.00 23.40 H new ATOM 0 HE2 PHE A 153 12.106 -4.793 -2.600 1.00 45.41 H new ATOM 0 HZ PHE A 153 10.317 -3.144 -2.965 1.00 53.32 H new ATOM 2387 N CYS A 154 10.050 -6.351 4.643 1.00 3.32 N ATOM 2388 CA CYS A 154 10.418 -6.596 6.032 1.00 72.34 C ATOM 2389 C CYS A 154 9.797 -7.893 6.568 1.00 62.44 C ATOM 2390 O CYS A 154 10.497 -8.693 7.183 1.00 3.14 O ATOM 2391 CB CYS A 154 9.973 -5.408 6.895 1.00 43.11 C ATOM 2392 SG CYS A 154 8.179 -5.191 6.988 1.00 14.22 S ATOM 0 H CYS A 154 9.436 -5.545 4.526 1.00 3.32 H new ATOM 0 HA CYS A 154 11.501 -6.707 6.079 1.00 72.34 H new ATOM 0 HB2 CYS A 154 10.365 -5.539 7.904 1.00 43.11 H new ATOM 0 HB3 CYS A 154 10.418 -4.496 6.496 1.00 43.11 H new ATOM 0 HG CYS A 154 7.660 -6.158 7.685 1.00 14.22 H new ATOM 2398 N ALA A 155 8.482 -8.087 6.330 1.00 71.33 N ATOM 2399 CA ALA A 155 7.745 -9.284 6.787 1.00 65.45 C ATOM 2400 C ALA A 155 8.447 -10.592 6.355 1.00 61.01 C ATOM 2401 O ALA A 155 8.631 -11.507 7.160 1.00 15.12 O ATOM 2402 CB ALA A 155 6.303 -9.233 6.251 1.00 43.22 C ATOM 0 H ALA A 155 7.904 -7.421 5.818 1.00 71.33 H new ATOM 0 HA ALA A 155 7.727 -9.280 7.877 1.00 65.45 H new ATOM 0 HB1 ALA A 155 5.758 -10.115 6.587 1.00 43.22 H new ATOM 0 HB2 ALA A 155 5.808 -8.337 6.624 1.00 43.22 H new ATOM 0 HB3 ALA A 155 6.320 -9.211 5.161 1.00 43.22 H new ATOM 2408 N TYR A 156 8.858 -10.631 5.078 1.00 0.13 N ATOM 2409 CA TYR A 156 9.495 -11.816 4.457 1.00 41.51 C ATOM 2410 C TYR A 156 11.024 -11.884 4.685 1.00 12.34 C ATOM 2411 O TYR A 156 11.625 -12.948 4.472 1.00 40.13 O ATOM 2412 CB TYR A 156 9.139 -11.858 2.945 1.00 22.14 C ATOM 2413 CG TYR A 156 7.629 -12.074 2.680 1.00 34.50 C ATOM 2414 CD1 TYR A 156 6.697 -11.080 2.987 1.00 70.31 C ATOM 2415 CD2 TYR A 156 7.137 -13.272 2.154 1.00 2.25 C ATOM 2416 CE1 TYR A 156 5.348 -11.269 2.788 1.00 0.04 C ATOM 2417 CE2 TYR A 156 5.783 -13.458 1.941 1.00 62.02 C ATOM 2418 CZ TYR A 156 4.893 -12.456 2.266 1.00 32.35 C ATOM 2419 OH TYR A 156 3.536 -12.647 2.080 1.00 63.31 O ATOM 0 H TYR A 156 8.760 -9.841 4.440 1.00 0.13 H new ATOM 0 HA TYR A 156 9.095 -12.701 4.951 1.00 41.51 H new ATOM 0 HB2 TYR A 156 9.453 -10.925 2.478 1.00 22.14 H new ATOM 0 HB3 TYR A 156 9.703 -12.659 2.468 1.00 22.14 H new ATOM 0 HD1 TYR A 156 7.043 -10.140 3.390 1.00 70.31 H new ATOM 0 HD2 TYR A 156 7.826 -14.067 1.910 1.00 2.25 H new ATOM 0 HE1 TYR A 156 4.649 -10.486 3.042 1.00 0.04 H new ATOM 0 HE2 TYR A 156 5.424 -14.386 1.521 1.00 62.02 H new ATOM 0 HH TYR A 156 3.380 -13.538 1.702 1.00 63.31 H new ATOM 2429 N SER A 157 11.642 -10.775 5.136 1.00 23.02 N ATOM 2430 CA SER A 157 13.090 -10.731 5.458 1.00 54.21 C ATOM 2431 C SER A 157 13.384 -9.661 6.528 1.00 44.42 C ATOM 2432 O SER A 157 13.111 -8.473 6.322 1.00 24.53 O ATOM 2433 CB SER A 157 13.940 -10.447 4.201 1.00 4.12 C ATOM 2434 OG SER A 157 13.962 -11.548 3.314 1.00 41.30 O ATOM 0 H SER A 157 11.160 -9.889 5.288 1.00 23.02 H new ATOM 0 HA SER A 157 13.361 -11.712 5.848 1.00 54.21 H new ATOM 0 HB2 SER A 157 13.542 -9.574 3.684 1.00 4.12 H new ATOM 0 HB3 SER A 157 14.959 -10.203 4.501 1.00 4.12 H new ATOM 0 HG SER A 157 13.093 -11.626 2.868 1.00 41.30 H new ATOM 2440 N ASP A 158 14.030 -10.096 7.624 1.00 5.50 N ATOM 2441 CA ASP A 158 14.322 -9.248 8.802 1.00 33.24 C ATOM 2442 C ASP A 158 15.461 -8.252 8.508 1.00 32.20 C ATOM 2443 O ASP A 158 15.608 -7.248 9.218 1.00 61.23 O ATOM 2444 CB ASP A 158 14.698 -10.129 10.023 1.00 1.33 C ATOM 2445 CG ASP A 158 13.574 -11.087 10.438 1.00 22.04 C ATOM 2446 OD1 ASP A 158 12.694 -10.687 11.229 1.00 73.34 O ATOM 2447 OD2 ASP A 158 13.564 -12.245 9.969 1.00 55.43 O ATOM 0 H ASP A 158 14.368 -11.053 7.722 1.00 5.50 H new ATOM 0 HA ASP A 158 13.421 -8.680 9.031 1.00 33.24 H new ATOM 0 HB2 ASP A 158 15.592 -10.707 9.786 1.00 1.33 H new ATOM 0 HB3 ASP A 158 14.949 -9.485 10.866 1.00 1.33 H new ATOM 2452 N THR A 159 16.266 -8.551 7.458 1.00 20.22 N ATOM 2453 CA THR A 159 17.371 -7.680 6.994 1.00 54.34 C ATOM 2454 C THR A 159 16.844 -6.329 6.460 1.00 44.32 C ATOM 2455 O THR A 159 17.586 -5.344 6.412 1.00 41.11 O ATOM 2456 CB THR A 159 18.258 -8.402 5.912 1.00 73.40 C ATOM 2457 OG1 THR A 159 19.391 -7.578 5.576 1.00 3.22 O ATOM 2458 CG2 THR A 159 17.457 -8.752 4.634 1.00 64.52 C ATOM 0 H THR A 159 16.166 -9.405 6.909 1.00 20.22 H new ATOM 0 HA THR A 159 18.001 -7.473 7.859 1.00 54.34 H new ATOM 0 HB THR A 159 18.602 -9.341 6.346 1.00 73.40 H new ATOM 0 HG1 THR A 159 19.144 -6.633 5.657 1.00 3.22 H new ATOM 0 HG21 THR A 159 18.112 -9.248 3.918 1.00 64.52 H new ATOM 0 HG22 THR A 159 16.632 -9.416 4.892 1.00 64.52 H new ATOM 0 HG23 THR A 159 17.062 -7.838 4.191 1.00 64.52 H new ATOM 2466 N PHE A 160 15.558 -6.294 6.071 1.00 10.43 N ATOM 2467 CA PHE A 160 14.847 -5.046 5.780 1.00 21.32 C ATOM 2468 C PHE A 160 14.178 -4.605 7.093 1.00 0.31 C ATOM 2469 O PHE A 160 13.427 -5.387 7.699 1.00 0.24 O ATOM 2470 CB PHE A 160 13.795 -5.252 4.658 1.00 70.15 C ATOM 2471 CG PHE A 160 14.366 -5.772 3.332 1.00 73.45 C ATOM 2472 CD1 PHE A 160 14.502 -7.136 3.102 1.00 31.04 C ATOM 2473 CD2 PHE A 160 14.756 -4.901 2.314 1.00 33.22 C ATOM 2474 CE1 PHE A 160 15.005 -7.615 1.907 1.00 63.35 C ATOM 2475 CE2 PHE A 160 15.259 -5.384 1.114 1.00 24.33 C ATOM 2476 CZ PHE A 160 15.384 -6.740 0.915 1.00 60.42 C ATOM 0 H PHE A 160 14.987 -7.130 5.951 1.00 10.43 H new ATOM 0 HA PHE A 160 15.535 -4.281 5.419 1.00 21.32 H new ATOM 0 HB2 PHE A 160 13.039 -5.953 5.012 1.00 70.15 H new ATOM 0 HB3 PHE A 160 13.290 -4.304 4.474 1.00 70.15 H new ATOM 0 HD1 PHE A 160 14.209 -7.835 3.872 1.00 31.04 H new ATOM 0 HD2 PHE A 160 14.665 -3.835 2.462 1.00 33.22 H new ATOM 0 HE1 PHE A 160 15.101 -8.679 1.751 1.00 63.35 H new ATOM 0 HE2 PHE A 160 15.553 -4.695 0.336 1.00 24.33 H new ATOM 0 HZ PHE A 160 15.779 -7.116 -0.017 1.00 60.42 H new ATOM 2486 N SER A 161 14.492 -3.387 7.554 1.00 62.23 N ATOM 2487 CA SER A 161 14.009 -2.874 8.847 1.00 2.25 C ATOM 2488 C SER A 161 12.514 -2.505 8.731 1.00 12.42 C ATOM 2489 O SER A 161 12.137 -1.720 7.855 1.00 73.44 O ATOM 2490 CB SER A 161 14.870 -1.669 9.273 1.00 24.31 C ATOM 2491 OG SER A 161 16.251 -2.001 9.229 1.00 73.40 O ATOM 0 H SER A 161 15.085 -2.731 7.046 1.00 62.23 H new ATOM 0 HA SER A 161 14.102 -3.640 9.617 1.00 2.25 H new ATOM 0 HB2 SER A 161 14.673 -0.823 8.615 1.00 24.31 H new ATOM 0 HB3 SER A 161 14.597 -1.358 10.282 1.00 24.31 H new ATOM 0 HG SER A 161 16.540 -2.076 8.296 1.00 73.40 H new ATOM 2497 N CYS A 162 11.685 -3.068 9.633 1.00 15.42 N ATOM 2498 CA CYS A 162 10.210 -3.053 9.528 1.00 64.41 C ATOM 2499 C CYS A 162 9.594 -1.670 9.857 1.00 50.52 C ATOM 2500 O CYS A 162 10.250 -0.829 10.484 1.00 63.41 O ATOM 2501 CB CYS A 162 9.645 -4.157 10.472 1.00 4.25 C ATOM 2502 SG CYS A 162 10.144 -3.982 12.195 1.00 13.14 S ATOM 0 H CYS A 162 12.024 -3.552 10.465 1.00 15.42 H new ATOM 0 HA CYS A 162 9.934 -3.256 8.493 1.00 64.41 H new ATOM 0 HB2 CYS A 162 8.556 -4.144 10.418 1.00 4.25 H new ATOM 0 HB3 CYS A 162 9.970 -5.132 10.108 1.00 4.25 H new ATOM 0 HG CYS A 162 9.623 -4.944 12.898 1.00 13.14 H new ATOM 2508 N PRO A 163 8.309 -1.402 9.420 1.00 22.14 N ATOM 2509 CA PRO A 163 7.576 -0.185 9.814 1.00 32.50 C ATOM 2510 C PRO A 163 7.142 -0.230 11.291 1.00 63.32 C ATOM 2511 O PRO A 163 7.198 -1.281 11.942 1.00 45.50 O ATOM 2512 CB PRO A 163 6.332 -0.162 8.863 1.00 32.04 C ATOM 2513 CG PRO A 163 6.538 -1.271 7.868 1.00 22.32 C ATOM 2514 CD PRO A 163 7.478 -2.254 8.524 1.00 72.34 C ATOM 0 HA PRO A 163 8.192 0.709 9.724 1.00 32.50 H new ATOM 0 HB2 PRO A 163 5.410 -0.311 9.425 1.00 32.04 H new ATOM 0 HB3 PRO A 163 6.246 0.801 8.359 1.00 32.04 H new ATOM 0 HG2 PRO A 163 5.591 -1.747 7.614 1.00 22.32 H new ATOM 0 HG3 PRO A 163 6.961 -0.888 6.939 1.00 22.32 H new ATOM 0 HD2 PRO A 163 6.935 -3.015 9.085 1.00 72.34 H new ATOM 0 HD3 PRO A 163 8.089 -2.776 7.788 1.00 72.34 H new ATOM 2522 N LEU A 164 6.744 0.932 11.816 1.00 41.01 N ATOM 2523 CA LEU A 164 6.038 1.054 13.101 1.00 41.41 C ATOM 2524 C LEU A 164 4.590 1.475 12.760 1.00 33.23 C ATOM 2525 O LEU A 164 4.313 2.677 12.668 1.00 13.31 O ATOM 2526 CB LEU A 164 6.729 2.092 14.060 1.00 24.42 C ATOM 2527 CG LEU A 164 8.112 1.682 14.690 1.00 14.44 C ATOM 2528 CD1 LEU A 164 9.233 1.549 13.634 1.00 63.32 C ATOM 2529 CD2 LEU A 164 8.518 2.669 15.812 1.00 43.22 C ATOM 0 H LEU A 164 6.904 1.829 11.357 1.00 41.01 H new ATOM 0 HA LEU A 164 6.057 0.107 13.641 1.00 41.41 H new ATOM 0 HB2 LEU A 164 6.872 3.020 13.506 1.00 24.42 H new ATOM 0 HB3 LEU A 164 6.039 2.310 14.875 1.00 24.42 H new ATOM 0 HG LEU A 164 7.979 0.692 15.127 1.00 14.44 H new ATOM 0 HD11 LEU A 164 10.164 1.265 14.125 1.00 63.32 H new ATOM 0 HD12 LEU A 164 8.959 0.785 12.906 1.00 63.32 H new ATOM 0 HD13 LEU A 164 9.368 2.503 13.125 1.00 63.32 H new ATOM 0 HD21 LEU A 164 9.477 2.367 16.233 1.00 43.22 H new ATOM 0 HD22 LEU A 164 8.604 3.674 15.399 1.00 43.22 H new ATOM 0 HD23 LEU A 164 7.759 2.662 16.595 1.00 43.22 H new ATOM 2541 N PRO A 165 3.660 0.486 12.485 1.00 63.42 N ATOM 2542 CA PRO A 165 2.284 0.797 12.029 1.00 22.31 C ATOM 2543 C PRO A 165 1.486 1.595 13.086 1.00 71.34 C ATOM 2544 O PRO A 165 1.338 1.126 14.222 1.00 43.20 O ATOM 2545 CB PRO A 165 1.658 -0.611 11.777 1.00 4.41 C ATOM 2546 CG PRO A 165 2.826 -1.544 11.653 1.00 35.01 C ATOM 2547 CD PRO A 165 3.870 -0.988 12.588 1.00 70.22 C ATOM 0 HA PRO A 165 2.272 1.432 11.143 1.00 22.31 H new ATOM 0 HB2 PRO A 165 1.005 -0.905 12.599 1.00 4.41 H new ATOM 0 HB3 PRO A 165 1.052 -0.616 10.871 1.00 4.41 H new ATOM 0 HG2 PRO A 165 2.550 -2.561 11.930 1.00 35.01 H new ATOM 0 HG3 PRO A 165 3.194 -1.582 10.628 1.00 35.01 H new ATOM 0 HD2 PRO A 165 3.730 -1.346 13.608 1.00 70.22 H new ATOM 0 HD3 PRO A 165 4.877 -1.275 12.285 1.00 70.22 H new ATOM 2555 N PRO A 166 0.977 2.826 12.734 1.00 71.21 N ATOM 2556 CA PRO A 166 0.120 3.623 13.642 1.00 54.11 C ATOM 2557 C PRO A 166 -1.233 2.905 13.847 1.00 32.35 C ATOM 2558 O PRO A 166 -1.770 2.344 12.901 1.00 23.04 O ATOM 2559 CB PRO A 166 -0.034 4.982 12.901 1.00 30.10 C ATOM 2560 CG PRO A 166 0.201 4.669 11.455 1.00 72.31 C ATOM 2561 CD PRO A 166 1.199 3.530 11.430 1.00 61.35 C ATOM 0 HA PRO A 166 0.534 3.758 14.641 1.00 54.11 H new ATOM 0 HB2 PRO A 166 -1.027 5.405 13.056 1.00 30.10 H new ATOM 0 HB3 PRO A 166 0.685 5.714 13.268 1.00 30.10 H new ATOM 0 HG2 PRO A 166 -0.728 4.384 10.962 1.00 72.31 H new ATOM 0 HG3 PRO A 166 0.589 5.539 10.926 1.00 72.31 H new ATOM 0 HD2 PRO A 166 1.026 2.866 10.583 1.00 61.35 H new ATOM 0 HD3 PRO A 166 2.222 3.897 11.343 1.00 61.35 H new ATOM 2569 N GLU A 167 -1.761 2.938 15.083 1.00 34.12 N ATOM 2570 CA GLU A 167 -2.948 2.134 15.507 1.00 10.50 C ATOM 2571 C GLU A 167 -4.175 2.244 14.559 1.00 12.01 C ATOM 2572 O GLU A 167 -4.969 1.300 14.440 1.00 61.54 O ATOM 2573 CB GLU A 167 -3.369 2.511 16.953 1.00 31.42 C ATOM 2574 CG GLU A 167 -2.299 2.243 18.024 1.00 24.50 C ATOM 2575 CD GLU A 167 -2.840 2.397 19.449 1.00 73.04 C ATOM 2576 OE1 GLU A 167 -2.817 3.520 19.992 1.00 71.51 O ATOM 2577 OE2 GLU A 167 -3.316 1.394 20.024 1.00 51.45 O ATOM 0 H GLU A 167 -1.383 3.522 15.829 1.00 34.12 H new ATOM 0 HA GLU A 167 -2.623 1.095 15.461 1.00 10.50 H new ATOM 0 HB2 GLU A 167 -3.630 3.569 16.977 1.00 31.42 H new ATOM 0 HB3 GLU A 167 -4.270 1.954 17.211 1.00 31.42 H new ATOM 0 HG2 GLU A 167 -1.906 1.234 17.895 1.00 24.50 H new ATOM 0 HG3 GLU A 167 -1.465 2.930 17.880 1.00 24.50 H new ATOM 2584 N SER A 168 -4.296 3.388 13.876 1.00 1.43 N ATOM 2585 CA SER A 168 -5.448 3.704 13.010 1.00 1.40 C ATOM 2586 C SER A 168 -5.289 3.169 11.557 1.00 21.02 C ATOM 2587 O SER A 168 -6.184 3.375 10.726 1.00 20.14 O ATOM 2588 CB SER A 168 -5.682 5.230 13.020 1.00 51.23 C ATOM 2589 OG SER A 168 -6.876 5.567 12.347 1.00 25.34 O ATOM 0 H SER A 168 -3.595 4.128 13.906 1.00 1.43 H new ATOM 0 HA SER A 168 -6.320 3.191 13.415 1.00 1.40 H new ATOM 0 HB2 SER A 168 -5.728 5.587 14.049 1.00 51.23 H new ATOM 0 HB3 SER A 168 -4.839 5.733 12.546 1.00 51.23 H new ATOM 0 HG SER A 168 -6.661 6.037 11.515 1.00 25.34 H new ATOM 2595 N ASN A 169 -4.166 2.476 11.252 1.00 41.34 N ATOM 2596 CA ASN A 169 -3.970 1.811 9.932 1.00 4.23 C ATOM 2597 C ASN A 169 -4.302 0.304 10.047 1.00 40.41 C ATOM 2598 O ASN A 169 -4.332 -0.419 9.042 1.00 5.44 O ATOM 2599 CB ASN A 169 -2.520 2.045 9.366 1.00 13.11 C ATOM 2600 CG ASN A 169 -1.408 1.111 9.910 1.00 74.32 C ATOM 2601 OD1 ASN A 169 -1.473 0.591 11.012 1.00 61.24 O ATOM 2602 ND2 ASN A 169 -0.349 0.917 9.134 1.00 1.42 N ATOM 0 H ASN A 169 -3.383 2.361 11.895 1.00 41.34 H new ATOM 0 HA ASN A 169 -4.656 2.263 9.216 1.00 4.23 H new ATOM 0 HB2 ASN A 169 -2.555 1.939 8.282 1.00 13.11 H new ATOM 0 HB3 ASN A 169 -2.234 3.076 9.576 1.00 13.11 H new ATOM 0 HD21 ASN A 169 0.419 0.329 9.457 1.00 1.42 H new ATOM 0 HD22 ASN A 169 -0.303 1.356 8.214 1.00 1.42 H new ATOM 2609 N TRP A 170 -4.555 -0.155 11.291 1.00 71.20 N ATOM 2610 CA TRP A 170 -4.924 -1.546 11.573 1.00 1.32 C ATOM 2611 C TRP A 170 -6.408 -1.742 11.217 1.00 54.41 C ATOM 2612 O TRP A 170 -7.290 -1.252 11.935 1.00 52.42 O ATOM 2613 CB TRP A 170 -4.699 -1.910 13.071 1.00 2.40 C ATOM 2614 CG TRP A 170 -3.291 -1.764 13.599 1.00 32.03 C ATOM 2615 CD1 TRP A 170 -2.121 -1.772 12.897 1.00 72.14 C ATOM 2616 CD2 TRP A 170 -2.925 -1.637 14.982 1.00 74.14 C ATOM 2617 NE1 TRP A 170 -1.060 -1.616 13.754 1.00 53.14 N ATOM 2618 CE2 TRP A 170 -1.527 -1.536 15.037 1.00 63.35 C ATOM 2619 CE3 TRP A 170 -3.653 -1.579 16.178 1.00 75.20 C ATOM 2620 CZ2 TRP A 170 -0.835 -1.391 16.238 1.00 33.04 C ATOM 2621 CZ3 TRP A 170 -2.967 -1.441 17.370 1.00 22.55 C ATOM 2622 CH2 TRP A 170 -1.569 -1.344 17.393 1.00 22.30 C ATOM 0 H TRP A 170 -4.507 0.433 12.123 1.00 71.20 H new ATOM 0 HA TRP A 170 -4.291 -2.200 10.974 1.00 1.32 H new ATOM 0 HB2 TRP A 170 -5.356 -1.285 13.676 1.00 2.40 H new ATOM 0 HB3 TRP A 170 -5.014 -2.943 13.222 1.00 2.40 H new ATOM 0 HD1 TRP A 170 -2.041 -1.884 11.826 1.00 72.14 H new ATOM 0 HE1 TRP A 170 -0.079 -1.567 13.478 1.00 53.14 H new ATOM 0 HE3 TRP A 170 -4.731 -1.641 16.169 1.00 75.20 H new ATOM 0 HZ2 TRP A 170 0.242 -1.318 16.257 1.00 33.04 H new ATOM 0 HZ3 TRP A 170 -3.517 -1.407 18.299 1.00 22.55 H new ATOM 0 HH2 TRP A 170 -1.061 -1.230 18.339 1.00 22.30 H new ATOM 2633 N LEU A 171 -6.680 -2.447 10.106 1.00 44.11 N ATOM 2634 CA LEU A 171 -8.051 -2.754 9.684 1.00 22.30 C ATOM 2635 C LEU A 171 -8.565 -3.905 10.553 1.00 51.24 C ATOM 2636 O LEU A 171 -8.018 -5.012 10.495 1.00 40.45 O ATOM 2637 CB LEU A 171 -8.099 -3.119 8.170 1.00 21.14 C ATOM 2638 CG LEU A 171 -7.562 -2.030 7.183 1.00 51.30 C ATOM 2639 CD1 LEU A 171 -7.679 -2.496 5.709 1.00 71.51 C ATOM 2640 CD2 LEU A 171 -8.264 -0.669 7.399 1.00 4.10 C ATOM 0 H LEU A 171 -5.962 -2.816 9.483 1.00 44.11 H new ATOM 0 HA LEU A 171 -8.690 -1.881 9.815 1.00 22.30 H new ATOM 0 HB2 LEU A 171 -7.524 -4.033 8.019 1.00 21.14 H new ATOM 0 HB3 LEU A 171 -9.132 -3.344 7.904 1.00 21.14 H new ATOM 0 HG LEU A 171 -6.504 -1.889 7.402 1.00 51.30 H new ATOM 0 HD11 LEU A 171 -7.297 -1.716 5.050 1.00 71.51 H new ATOM 0 HD12 LEU A 171 -7.098 -3.407 5.568 1.00 71.51 H new ATOM 0 HD13 LEU A 171 -8.724 -2.693 5.471 1.00 71.51 H new ATOM 0 HD21 LEU A 171 -7.865 0.062 6.696 1.00 4.10 H new ATOM 0 HD22 LEU A 171 -9.336 -0.782 7.235 1.00 4.10 H new ATOM 0 HD23 LEU A 171 -8.087 -0.326 8.418 1.00 4.10 H new ATOM 2652 N GLU A 172 -9.590 -3.634 11.386 1.00 14.00 N ATOM 2653 CA GLU A 172 -10.149 -4.626 12.334 1.00 53.32 C ATOM 2654 C GLU A 172 -11.219 -5.500 11.622 1.00 4.33 C ATOM 2655 O GLU A 172 -12.367 -5.633 12.066 1.00 50.13 O ATOM 2656 CB GLU A 172 -10.737 -3.883 13.575 1.00 35.25 C ATOM 2657 CG GLU A 172 -11.046 -4.774 14.803 1.00 65.11 C ATOM 2658 CD GLU A 172 -9.785 -5.218 15.564 1.00 53.25 C ATOM 2659 OE1 GLU A 172 -9.208 -6.270 15.230 1.00 52.24 O ATOM 2660 OE2 GLU A 172 -9.361 -4.505 16.503 1.00 35.21 O ATOM 0 H GLU A 172 -10.054 -2.726 11.423 1.00 14.00 H new ATOM 0 HA GLU A 172 -9.361 -5.294 12.681 1.00 53.32 H new ATOM 0 HB2 GLU A 172 -10.034 -3.108 13.879 1.00 35.25 H new ATOM 0 HB3 GLU A 172 -11.656 -3.380 13.273 1.00 35.25 H new ATOM 0 HG2 GLU A 172 -11.700 -4.229 15.484 1.00 65.11 H new ATOM 0 HG3 GLU A 172 -11.594 -5.657 14.474 1.00 65.11 H new ATOM 2667 N THR A 173 -10.800 -6.076 10.488 1.00 63.31 N ATOM 2668 CA THR A 173 -11.609 -6.958 9.643 1.00 5.22 C ATOM 2669 C THR A 173 -10.668 -7.737 8.700 1.00 34.42 C ATOM 2670 O THR A 173 -9.508 -7.343 8.508 1.00 54.14 O ATOM 2671 CB THR A 173 -12.674 -6.159 8.817 1.00 14.35 C ATOM 2672 OG1 THR A 173 -13.489 -7.068 8.067 1.00 4.54 O ATOM 2673 CG2 THR A 173 -12.038 -5.115 7.871 1.00 65.10 C ATOM 0 H THR A 173 -9.858 -5.935 10.123 1.00 63.31 H new ATOM 0 HA THR A 173 -12.158 -7.649 10.282 1.00 5.22 H new ATOM 0 HB THR A 173 -13.287 -5.609 9.531 1.00 14.35 H new ATOM 0 HG1 THR A 173 -13.531 -6.775 7.133 1.00 4.54 H new ATOM 0 HG21 THR A 173 -12.823 -4.593 7.325 1.00 65.10 H new ATOM 0 HG22 THR A 173 -11.463 -4.397 8.456 1.00 65.10 H new ATOM 0 HG23 THR A 173 -11.378 -5.619 7.164 1.00 65.10 H new ATOM 2681 N ALA A 174 -11.164 -8.849 8.141 1.00 2.24 N ATOM 2682 CA ALA A 174 -10.383 -9.728 7.255 1.00 31.54 C ATOM 2683 C ALA A 174 -10.599 -9.318 5.789 1.00 14.12 C ATOM 2684 O ALA A 174 -11.745 -9.216 5.332 1.00 3.34 O ATOM 2685 CB ALA A 174 -10.776 -11.204 7.486 1.00 32.41 C ATOM 0 H ALA A 174 -12.122 -9.167 8.290 1.00 2.24 H new ATOM 0 HA ALA A 174 -9.323 -9.623 7.487 1.00 31.54 H new ATOM 0 HB1 ALA A 174 -10.192 -11.844 6.825 1.00 32.41 H new ATOM 0 HB2 ALA A 174 -10.577 -11.475 8.523 1.00 32.41 H new ATOM 0 HB3 ALA A 174 -11.837 -11.336 7.274 1.00 32.41 H new ATOM 2691 N VAL A 175 -9.494 -9.090 5.067 1.00 40.04 N ATOM 2692 CA VAL A 175 -9.522 -8.762 3.637 1.00 55.03 C ATOM 2693 C VAL A 175 -9.251 -10.060 2.869 1.00 13.12 C ATOM 2694 O VAL A 175 -8.101 -10.431 2.635 1.00 23.42 O ATOM 2695 CB VAL A 175 -8.474 -7.637 3.253 1.00 61.34 C ATOM 2696 CG1 VAL A 175 -8.489 -7.351 1.728 1.00 20.11 C ATOM 2697 CG2 VAL A 175 -8.731 -6.344 4.077 1.00 4.20 C ATOM 0 H VAL A 175 -8.553 -9.128 5.460 1.00 40.04 H new ATOM 0 HA VAL A 175 -10.497 -8.352 3.374 1.00 55.03 H new ATOM 0 HB VAL A 175 -7.478 -8.002 3.504 1.00 61.34 H new ATOM 0 HG11 VAL A 175 -7.760 -6.575 1.496 1.00 20.11 H new ATOM 0 HG12 VAL A 175 -8.236 -8.261 1.185 1.00 20.11 H new ATOM 0 HG13 VAL A 175 -9.483 -7.016 1.430 1.00 20.11 H new ATOM 0 HG21 VAL A 175 -8.001 -5.584 3.799 1.00 4.20 H new ATOM 0 HG22 VAL A 175 -9.736 -5.975 3.871 1.00 4.20 H new ATOM 0 HG23 VAL A 175 -8.637 -6.565 5.140 1.00 4.20 H new ATOM 2707 N THR A 176 -10.325 -10.791 2.558 1.00 70.12 N ATOM 2708 CA THR A 176 -10.246 -12.078 1.866 1.00 34.34 C ATOM 2709 C THR A 176 -10.327 -11.876 0.345 1.00 61.11 C ATOM 2710 O THR A 176 -11.391 -11.544 -0.185 1.00 35.51 O ATOM 2711 CB THR A 176 -11.395 -13.014 2.363 1.00 22.10 C ATOM 2712 OG1 THR A 176 -12.660 -12.342 2.233 1.00 75.44 O ATOM 2713 CG2 THR A 176 -11.197 -13.424 3.832 1.00 12.04 C ATOM 0 H THR A 176 -11.278 -10.504 2.781 1.00 70.12 H new ATOM 0 HA THR A 176 -9.288 -12.547 2.092 1.00 34.34 H new ATOM 0 HB THR A 176 -11.377 -13.914 1.748 1.00 22.10 H new ATOM 0 HG1 THR A 176 -12.712 -11.909 1.355 1.00 75.44 H new ATOM 0 HG21 THR A 176 -12.015 -14.074 4.142 1.00 12.04 H new ATOM 0 HG22 THR A 176 -10.251 -13.956 3.937 1.00 12.04 H new ATOM 0 HG23 THR A 176 -11.184 -12.533 4.460 1.00 12.04 H new ATOM 2721 N ALA A 177 -9.190 -12.059 -0.337 1.00 42.20 N ATOM 2722 CA ALA A 177 -9.092 -11.902 -1.796 1.00 4.43 C ATOM 2723 C ALA A 177 -7.874 -12.675 -2.326 1.00 55.44 C ATOM 2724 O ALA A 177 -6.883 -12.840 -1.610 1.00 62.34 O ATOM 2725 CB ALA A 177 -9.014 -10.407 -2.168 1.00 44.40 C ATOM 0 H ALA A 177 -8.310 -12.321 0.107 1.00 42.20 H new ATOM 0 HA ALA A 177 -9.986 -12.316 -2.263 1.00 4.43 H new ATOM 0 HB1 ALA A 177 -8.942 -10.305 -3.251 1.00 44.40 H new ATOM 0 HB2 ALA A 177 -9.910 -9.897 -1.814 1.00 44.40 H new ATOM 0 HB3 ALA A 177 -8.135 -9.962 -1.702 1.00 44.40 H new ATOM 2731 N GLY A 178 -7.978 -13.143 -3.583 1.00 4.55 N ATOM 2732 CA GLY A 178 -6.901 -13.871 -4.264 1.00 33.02 C ATOM 2733 C GLY A 178 -6.315 -15.052 -3.506 1.00 3.21 C ATOM 2734 O GLY A 178 -7.027 -15.744 -2.771 1.00 23.53 O ATOM 0 H GLY A 178 -8.815 -13.025 -4.153 1.00 4.55 H new ATOM 0 HA2 GLY A 178 -7.280 -14.230 -5.221 1.00 33.02 H new ATOM 0 HA3 GLY A 178 -6.096 -13.169 -4.483 1.00 33.02 H new ATOM 2738 N GLU A 179 -5.009 -15.287 -3.732 1.00 64.41 N ATOM 2739 CA GLU A 179 -4.246 -16.340 -3.050 1.00 22.00 C ATOM 2740 C GLU A 179 -3.791 -15.874 -1.657 1.00 32.44 C ATOM 2741 O GLU A 179 -3.528 -14.680 -1.432 1.00 54.02 O ATOM 2742 CB GLU A 179 -3.023 -16.770 -3.911 1.00 64.45 C ATOM 2743 CG GLU A 179 -3.384 -17.343 -5.295 1.00 11.23 C ATOM 2744 CD GLU A 179 -4.348 -18.543 -5.224 1.00 12.11 C ATOM 2745 OE1 GLU A 179 -3.898 -19.660 -4.894 1.00 4.01 O ATOM 2746 OE2 GLU A 179 -5.561 -18.366 -5.477 1.00 5.31 O ATOM 0 H GLU A 179 -4.454 -14.747 -4.396 1.00 64.41 H new ATOM 0 HA GLU A 179 -4.898 -17.203 -2.920 1.00 22.00 H new ATOM 0 HB2 GLU A 179 -2.370 -15.908 -4.048 1.00 64.45 H new ATOM 0 HB3 GLU A 179 -2.452 -17.518 -3.360 1.00 64.45 H new ATOM 0 HG2 GLU A 179 -3.837 -16.557 -5.899 1.00 11.23 H new ATOM 0 HG3 GLU A 179 -2.470 -17.649 -5.804 1.00 11.23 H new ATOM 2753 N ARG A 180 -3.685 -16.845 -0.738 1.00 3.13 N ATOM 2754 CA ARG A 180 -3.330 -16.605 0.664 1.00 10.32 C ATOM 2755 C ARG A 180 -2.260 -17.636 1.100 1.00 55.12 C ATOM 2756 O ARG A 180 -2.355 -18.815 0.739 1.00 3.44 O ATOM 2757 CB ARG A 180 -4.622 -16.682 1.561 1.00 62.31 C ATOM 2758 CG ARG A 180 -5.174 -18.100 1.904 1.00 41.41 C ATOM 2759 CD ARG A 180 -5.744 -18.869 0.692 1.00 31.53 C ATOM 2760 NE ARG A 180 -6.110 -20.255 1.042 1.00 24.42 N ATOM 2761 CZ ARG A 180 -7.067 -20.982 0.447 1.00 72.32 C ATOM 2762 NH1 ARG A 180 -7.799 -20.479 -0.540 1.00 44.54 N ATOM 2763 NH2 ARG A 180 -7.282 -22.222 0.841 1.00 50.22 N ATOM 0 H ARG A 180 -3.846 -17.829 -0.952 1.00 3.13 H new ATOM 0 HA ARG A 180 -2.908 -15.607 0.783 1.00 10.32 H new ATOM 0 HB2 ARG A 180 -4.413 -16.166 2.498 1.00 62.31 H new ATOM 0 HB3 ARG A 180 -5.413 -16.124 1.060 1.00 62.31 H new ATOM 0 HG2 ARG A 180 -4.374 -18.690 2.351 1.00 41.41 H new ATOM 0 HG3 ARG A 180 -5.956 -18.001 2.657 1.00 41.41 H new ATOM 0 HD2 ARG A 180 -6.622 -18.347 0.311 1.00 31.53 H new ATOM 0 HD3 ARG A 180 -5.006 -18.880 -0.110 1.00 31.53 H new ATOM 0 HE ARG A 180 -5.591 -20.697 1.801 1.00 24.42 H new ATOM 0 HH11 ARG A 180 -7.638 -19.523 -0.858 1.00 44.54 H new ATOM 0 HH12 ARG A 180 -8.522 -21.048 -0.980 1.00 44.54 H new ATOM 0 HH21 ARG A 180 -6.722 -22.622 1.594 1.00 50.22 H new ATOM 0 HH22 ARG A 180 -8.008 -22.781 0.393 1.00 50.22 H new