USER MOD reduce.3.24.130724 H: found=0, std=0, add=804, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 804 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 44 THR OG1 : rot 131:sc= -0.0488! USER MOD Set 1.2: A 47 SER OG : rot -160:sc= -0.301 USER MOD Set 2.1: A 17 LYS NZ :NH3+ -140:sc= 0.218 (180deg=0) USER MOD Set 2.2: A 66 ASN : amide:sc= -0.762 K(o=-0.54,f=-3.7) USER MOD Set 3.1: A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.2: A 2 SER OG : rot 180:sc= -0.019 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 3 GLN : amide:sc= 0.353 X(o=0.35,f=-0.0057) USER MOD Single : A 5 GLN : amide:sc= 0 X(o=0,f=-0.061) USER MOD Single : A 6 TYR OH : rot 30:sc= 0 USER MOD Single : A 7 THR OG1 : rot 96:sc= 0.561 USER MOD Single : A 9 ASN : amide:sc= -1.87 X(o=-1.9,f=-1.7) USER MOD Single : A 11 LYS NZ :NH3+ 137:sc= -0.357 (180deg=-1.35) USER MOD Single : A 23 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 25 ASN : amide:sc= 0 X(o=0,f=-0.24) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 TYR OH : rot 165:sc= -4.27! USER MOD Single : A 41 ASN : amide:sc= 0.447 K(o=0.45,f=-0.066) USER MOD Single : A 54 SER OG : rot 86:sc= 1.19 USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 60 SER OG : rot 94:sc= 0.149 USER MOD Single : A 63 THR OG1 : rot -150:sc= 0 USER MOD Single : A 69 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 GLN : amide:sc= -0.172 X(o=-0.17,f=-0.0094) USER MOD Single : A 80 GLN : amide:sc= -2.01 K(o=-2,f=-5!) USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 86 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 90 LYS NZ :NH3+ -134:sc= -0.0169 (180deg=-0.156) USER MOD Single : A 93 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 94 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 95 ASN :FLIP amide:sc= -2.83! C(o=-3.9!,f=-2.8!) USER MOD Single : A 97 GLN :FLIP amide:sc= -0.152 F(o=-0.76,f=-0.15) USER MOD Single : A 98 SER OG : rot -57:sc= -1.74! USER MOD Single : A 101 GLN : amide:sc= -0.0177 K(o=-0.018,f=-1.1) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -3.198 6.467 -21.661 1.00 0.00 N ATOM 2 CA MET A 1 -2.430 6.778 -20.421 1.00 0.00 C ATOM 3 C MET A 1 -3.378 7.284 -19.321 1.00 0.00 C ATOM 4 O MET A 1 -3.143 8.321 -18.727 1.00 0.00 O ATOM 5 CB MET A 1 -1.446 7.875 -20.830 1.00 0.00 C ATOM 6 CG MET A 1 -0.458 8.127 -19.689 1.00 0.00 C ATOM 7 SD MET A 1 1.058 8.858 -20.354 1.00 0.00 S ATOM 8 CE MET A 1 0.663 10.584 -19.977 1.00 0.00 C ATOM 0 H1 MET A 1 -2.547 6.126 -22.397 1.00 0.00 H new ATOM 0 H2 MET A 1 -3.905 5.732 -21.457 1.00 0.00 H new ATOM 0 H3 MET A 1 -3.679 7.326 -21.996 1.00 0.00 H new ATOM 0 HA MET A 1 -1.920 5.902 -20.020 1.00 0.00 H new ATOM 0 HB2 MET A 1 -0.909 7.579 -21.731 1.00 0.00 H new ATOM 0 HB3 MET A 1 -1.985 8.792 -21.067 1.00 0.00 H new ATOM 0 HG2 MET A 1 -0.902 8.794 -18.950 1.00 0.00 H new ATOM 0 HG3 MET A 1 -0.230 7.192 -19.178 1.00 0.00 H new ATOM 0 HE1 MET A 1 1.480 11.225 -20.309 1.00 0.00 H new ATOM 0 HE2 MET A 1 -0.254 10.868 -20.493 1.00 0.00 H new ATOM 0 HE3 MET A 1 0.525 10.699 -18.902 1.00 0.00 H new ATOM 20 N SER A 2 -4.446 6.566 -19.042 1.00 0.00 N ATOM 21 CA SER A 2 -5.398 7.017 -17.981 1.00 0.00 C ATOM 22 C SER A 2 -5.811 5.830 -17.098 1.00 0.00 C ATOM 23 O SER A 2 -6.643 5.030 -17.484 1.00 0.00 O ATOM 24 CB SER A 2 -6.603 7.567 -18.740 1.00 0.00 C ATOM 25 OG SER A 2 -6.156 8.234 -19.913 1.00 0.00 O ATOM 0 H SER A 2 -4.695 5.691 -19.504 1.00 0.00 H new ATOM 0 HA SER A 2 -4.957 7.764 -17.320 1.00 0.00 H new ATOM 0 HB2 SER A 2 -7.281 6.756 -19.005 1.00 0.00 H new ATOM 0 HB3 SER A 2 -7.162 8.256 -18.107 1.00 0.00 H new ATOM 0 HG SER A 2 -6.928 8.587 -20.403 1.00 0.00 H new ATOM 31 N GLN A 3 -5.239 5.704 -15.917 1.00 0.00 N ATOM 32 CA GLN A 3 -5.609 4.566 -15.023 1.00 0.00 C ATOM 33 C GLN A 3 -5.929 5.083 -13.609 1.00 0.00 C ATOM 34 O GLN A 3 -5.141 4.922 -12.695 1.00 0.00 O ATOM 35 CB GLN A 3 -4.372 3.665 -15.001 1.00 0.00 C ATOM 36 CG GLN A 3 -4.146 3.071 -16.393 1.00 0.00 C ATOM 37 CD GLN A 3 -5.124 1.913 -16.622 1.00 0.00 C ATOM 38 OE1 GLN A 3 -4.920 0.828 -16.114 1.00 0.00 O ATOM 39 NE2 GLN A 3 -6.186 2.091 -17.370 1.00 0.00 N ATOM 0 H GLN A 3 -4.536 6.340 -15.541 1.00 0.00 H new ATOM 0 HA GLN A 3 -6.494 4.035 -15.372 1.00 0.00 H new ATOM 0 HB2 GLN A 3 -3.498 4.238 -14.693 1.00 0.00 H new ATOM 0 HB3 GLN A 3 -4.504 2.867 -14.271 1.00 0.00 H new ATOM 0 HG2 GLN A 3 -4.289 3.838 -17.154 1.00 0.00 H new ATOM 0 HG3 GLN A 3 -3.119 2.717 -16.486 1.00 0.00 H new ATOM 0 HE21 GLN A 3 -6.362 3.000 -17.798 1.00 0.00 H new ATOM 0 HE22 GLN A 3 -6.837 1.321 -17.523 1.00 0.00 H new ATOM 48 N GLU A 4 -7.080 5.698 -13.419 1.00 0.00 N ATOM 49 CA GLU A 4 -7.434 6.211 -12.052 1.00 0.00 C ATOM 50 C GLU A 4 -8.299 5.186 -11.309 1.00 0.00 C ATOM 51 O GLU A 4 -8.119 4.969 -10.125 1.00 0.00 O ATOM 52 CB GLU A 4 -8.211 7.515 -12.273 1.00 0.00 C ATOM 53 CG GLU A 4 -7.233 8.690 -12.342 1.00 0.00 C ATOM 54 CD GLU A 4 -7.068 9.299 -10.949 1.00 0.00 C ATOM 55 OE1 GLU A 4 -6.521 8.626 -10.090 1.00 0.00 O ATOM 56 OE2 GLU A 4 -7.493 10.427 -10.763 1.00 0.00 O ATOM 0 H GLU A 4 -7.780 5.864 -14.142 1.00 0.00 H new ATOM 0 HA GLU A 4 -6.544 6.381 -11.445 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -8.788 7.454 -13.196 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -8.923 7.668 -11.462 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -6.268 8.352 -12.719 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -7.601 9.443 -13.038 1.00 0.00 H new ATOM 63 N GLN A 5 -9.231 4.540 -11.985 1.00 0.00 N ATOM 64 CA GLN A 5 -10.089 3.514 -11.278 1.00 0.00 C ATOM 65 C GLN A 5 -9.190 2.467 -10.596 1.00 0.00 C ATOM 66 O GLN A 5 -9.468 2.034 -9.493 1.00 0.00 O ATOM 67 CB GLN A 5 -10.998 2.861 -12.342 1.00 0.00 C ATOM 68 CG GLN A 5 -10.160 2.109 -13.382 1.00 0.00 C ATOM 69 CD GLN A 5 -11.090 1.438 -14.401 1.00 0.00 C ATOM 70 OE1 GLN A 5 -11.200 0.229 -14.427 1.00 0.00 O ATOM 71 NE2 GLN A 5 -11.770 2.172 -15.247 1.00 0.00 N ATOM 0 H GLN A 5 -9.434 4.673 -12.976 1.00 0.00 H new ATOM 0 HA GLN A 5 -10.700 3.976 -10.503 1.00 0.00 H new ATOM 0 HB2 GLN A 5 -11.693 2.173 -11.861 1.00 0.00 H new ATOM 0 HB3 GLN A 5 -11.597 3.626 -12.835 1.00 0.00 H new ATOM 0 HG2 GLN A 5 -9.485 2.799 -13.889 1.00 0.00 H new ATOM 0 HG3 GLN A 5 -9.539 1.359 -12.891 1.00 0.00 H new ATOM 0 HE21 GLN A 5 -11.680 3.188 -15.228 1.00 0.00 H new ATOM 0 HE22 GLN A 5 -12.389 1.728 -15.925 1.00 0.00 H new ATOM 80 N TYR A 6 -8.093 2.090 -11.223 1.00 0.00 N ATOM 81 CA TYR A 6 -7.164 1.109 -10.564 1.00 0.00 C ATOM 82 C TYR A 6 -6.419 1.834 -9.433 1.00 0.00 C ATOM 83 O TYR A 6 -6.208 1.285 -8.370 1.00 0.00 O ATOM 84 CB TYR A 6 -6.167 0.643 -11.638 1.00 0.00 C ATOM 85 CG TYR A 6 -6.831 -0.355 -12.553 1.00 0.00 C ATOM 86 CD1 TYR A 6 -7.557 0.089 -13.665 1.00 0.00 C ATOM 87 CD2 TYR A 6 -6.718 -1.725 -12.293 1.00 0.00 C ATOM 88 CE1 TYR A 6 -8.170 -0.838 -14.516 1.00 0.00 C ATOM 89 CE2 TYR A 6 -7.329 -2.652 -13.144 1.00 0.00 C ATOM 90 CZ TYR A 6 -8.056 -2.210 -14.256 1.00 0.00 C ATOM 91 OH TYR A 6 -8.660 -3.123 -15.095 1.00 0.00 O ATOM 0 H TYR A 6 -7.805 2.413 -12.147 1.00 0.00 H new ATOM 0 HA TYR A 6 -7.699 0.256 -10.148 1.00 0.00 H new ATOM 0 HB2 TYR A 6 -5.812 1.498 -12.214 1.00 0.00 H new ATOM 0 HB3 TYR A 6 -5.294 0.193 -11.166 1.00 0.00 H new ATOM 0 HD1 TYR A 6 -7.644 1.147 -13.866 1.00 0.00 H new ATOM 0 HD2 TYR A 6 -6.159 -2.067 -11.435 1.00 0.00 H new ATOM 0 HE1 TYR A 6 -8.731 -0.496 -15.373 1.00 0.00 H new ATOM 0 HE2 TYR A 6 -7.240 -3.709 -12.943 1.00 0.00 H new ATOM 0 HH TYR A 6 -8.698 -2.757 -16.003 1.00 0.00 H new ATOM 101 N THR A 7 -6.026 3.073 -9.659 1.00 0.00 N ATOM 102 CA THR A 7 -5.300 3.838 -8.586 1.00 0.00 C ATOM 103 C THR A 7 -6.199 3.983 -7.348 1.00 0.00 C ATOM 104 O THR A 7 -5.738 3.851 -6.230 1.00 0.00 O ATOM 105 CB THR A 7 -4.982 5.224 -9.188 1.00 0.00 C ATOM 106 OG1 THR A 7 -4.094 5.065 -10.285 1.00 0.00 O ATOM 107 CG2 THR A 7 -4.338 6.140 -8.141 1.00 0.00 C ATOM 0 H THR A 7 -6.175 3.582 -10.530 1.00 0.00 H new ATOM 0 HA THR A 7 -4.390 3.327 -8.272 1.00 0.00 H new ATOM 0 HB THR A 7 -5.914 5.681 -9.521 1.00 0.00 H new ATOM 0 HG1 THR A 7 -4.607 5.040 -11.120 1.00 0.00 H new ATOM 0 HG21 THR A 7 -4.123 7.110 -8.589 1.00 0.00 H new ATOM 0 HG22 THR A 7 -5.022 6.271 -7.302 1.00 0.00 H new ATOM 0 HG23 THR A 7 -3.410 5.691 -7.786 1.00 0.00 H new ATOM 115 N GLU A 8 -7.475 4.252 -7.534 1.00 0.00 N ATOM 116 CA GLU A 8 -8.379 4.399 -6.338 1.00 0.00 C ATOM 117 C GLU A 8 -8.541 3.045 -5.643 1.00 0.00 C ATOM 118 O GLU A 8 -8.520 2.966 -4.428 1.00 0.00 O ATOM 119 CB GLU A 8 -9.735 4.903 -6.858 1.00 0.00 C ATOM 120 CG GLU A 8 -10.639 5.249 -5.673 1.00 0.00 C ATOM 121 CD GLU A 8 -11.533 6.435 -6.042 1.00 0.00 C ATOM 122 OE1 GLU A 8 -10.992 7.490 -6.334 1.00 0.00 O ATOM 123 OE2 GLU A 8 -12.741 6.269 -6.025 1.00 0.00 O ATOM 0 H GLU A 8 -7.923 4.374 -8.442 1.00 0.00 H new ATOM 0 HA GLU A 8 -7.964 5.099 -5.613 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -9.591 5.781 -7.488 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -10.206 4.139 -7.477 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -11.251 4.388 -5.405 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -10.034 5.494 -4.800 1.00 0.00 H new ATOM 130 N ASN A 9 -8.681 1.976 -6.395 1.00 0.00 N ATOM 131 CA ASN A 9 -8.816 0.628 -5.741 1.00 0.00 C ATOM 132 C ASN A 9 -7.450 0.191 -5.201 1.00 0.00 C ATOM 133 O ASN A 9 -7.357 -0.368 -4.124 1.00 0.00 O ATOM 134 CB ASN A 9 -9.311 -0.348 -6.819 1.00 0.00 C ATOM 135 CG ASN A 9 -10.756 0.001 -7.201 1.00 0.00 C ATOM 136 OD1 ASN A 9 -11.000 1.022 -7.811 1.00 0.00 O ATOM 137 ND2 ASN A 9 -11.733 -0.807 -6.868 1.00 0.00 N ATOM 0 H ASN A 9 -8.708 1.975 -7.415 1.00 0.00 H new ATOM 0 HA ASN A 9 -9.517 0.654 -4.907 1.00 0.00 H new ATOM 0 HB2 ASN A 9 -8.668 -0.293 -7.697 1.00 0.00 H new ATOM 0 HB3 ASN A 9 -9.259 -1.372 -6.449 1.00 0.00 H new ATOM 0 HD21 ASN A 9 -12.694 -0.577 -7.121 1.00 0.00 H new ATOM 0 HD22 ASN A 9 -11.532 -1.666 -6.356 1.00 0.00 H new ATOM 144 N LEU A 10 -6.381 0.459 -5.926 1.00 0.00 N ATOM 145 CA LEU A 10 -5.024 0.069 -5.414 1.00 0.00 C ATOM 146 C LEU A 10 -4.685 0.908 -4.175 1.00 0.00 C ATOM 147 O LEU A 10 -4.100 0.409 -3.231 1.00 0.00 O ATOM 148 CB LEU A 10 -4.017 0.349 -6.541 1.00 0.00 C ATOM 149 CG LEU A 10 -2.624 -0.108 -6.104 1.00 0.00 C ATOM 150 CD1 LEU A 10 -2.618 -1.628 -5.919 1.00 0.00 C ATOM 151 CD2 LEU A 10 -1.601 0.278 -7.176 1.00 0.00 C ATOM 0 H LEU A 10 -6.390 0.923 -6.834 1.00 0.00 H new ATOM 0 HA LEU A 10 -4.995 -0.983 -5.130 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -4.316 -0.175 -7.449 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -4.005 1.413 -6.777 1.00 0.00 H new ATOM 0 HG LEU A 10 -2.364 0.374 -5.161 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -1.625 -1.953 -5.608 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -3.346 -1.905 -5.156 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -2.879 -2.110 -6.861 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -0.608 -0.047 -6.865 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -1.862 -0.203 -8.118 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -1.603 1.360 -7.308 1.00 0.00 H new ATOM 163 N LYS A 11 -5.053 2.177 -4.158 1.00 0.00 N ATOM 164 CA LYS A 11 -4.741 3.022 -2.949 1.00 0.00 C ATOM 165 C LYS A 11 -5.375 2.406 -1.691 1.00 0.00 C ATOM 166 O LYS A 11 -4.810 2.483 -0.616 1.00 0.00 O ATOM 167 CB LYS A 11 -5.333 4.417 -3.214 1.00 0.00 C ATOM 168 CG LYS A 11 -4.884 5.383 -2.114 1.00 0.00 C ATOM 169 CD LYS A 11 -5.980 5.501 -1.053 1.00 0.00 C ATOM 170 CE LYS A 11 -5.384 6.059 0.241 1.00 0.00 C ATOM 171 NZ LYS A 11 -4.844 4.872 0.960 1.00 0.00 N ATOM 0 H LYS A 11 -5.546 2.655 -4.912 1.00 0.00 H new ATOM 0 HA LYS A 11 -3.665 3.080 -2.782 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -5.007 4.782 -4.188 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -6.421 4.362 -3.242 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -3.960 5.027 -1.658 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -4.671 6.363 -2.542 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -6.777 6.154 -1.410 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -6.427 4.524 -0.868 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -4.598 6.785 0.033 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -6.141 6.570 0.836 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -3.910 5.101 1.356 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -5.491 4.608 1.730 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -4.753 4.076 0.297 1.00 0.00 H new ATOM 185 N VAL A 12 -6.534 1.787 -1.810 1.00 0.00 N ATOM 186 CA VAL A 12 -7.166 1.164 -0.595 1.00 0.00 C ATOM 187 C VAL A 12 -6.389 -0.103 -0.219 1.00 0.00 C ATOM 188 O VAL A 12 -6.064 -0.317 0.933 1.00 0.00 O ATOM 189 CB VAL A 12 -8.615 0.818 -0.976 1.00 0.00 C ATOM 190 CG1 VAL A 12 -9.312 0.134 0.203 1.00 0.00 C ATOM 191 CG2 VAL A 12 -9.365 2.103 -1.334 1.00 0.00 C ATOM 0 H VAL A 12 -7.060 1.688 -2.678 1.00 0.00 H new ATOM 0 HA VAL A 12 -7.150 1.838 0.262 1.00 0.00 H new ATOM 0 HB VAL A 12 -8.612 0.143 -1.832 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -10.338 -0.109 -0.072 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -8.779 -0.781 0.460 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -9.316 0.805 1.062 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -10.393 1.861 -1.605 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -9.364 2.776 -0.476 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -8.873 2.589 -2.176 1.00 0.00 H new ATOM 201 N ILE A 13 -6.079 -0.939 -1.185 1.00 0.00 N ATOM 202 CA ILE A 13 -5.307 -2.188 -0.864 1.00 0.00 C ATOM 203 C ILE A 13 -3.902 -1.814 -0.359 1.00 0.00 C ATOM 204 O ILE A 13 -3.373 -2.462 0.525 1.00 0.00 O ATOM 205 CB ILE A 13 -5.231 -3.008 -2.166 1.00 0.00 C ATOM 206 CG1 ILE A 13 -6.658 -3.364 -2.622 1.00 0.00 C ATOM 207 CG2 ILE A 13 -4.436 -4.296 -1.921 1.00 0.00 C ATOM 208 CD1 ILE A 13 -6.798 -3.149 -4.132 1.00 0.00 C ATOM 0 H ILE A 13 -6.322 -0.815 -2.168 1.00 0.00 H new ATOM 0 HA ILE A 13 -5.789 -2.770 -0.079 1.00 0.00 H new ATOM 0 HB ILE A 13 -4.733 -2.421 -2.938 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -6.879 -4.402 -2.373 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -7.382 -2.747 -2.090 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -4.385 -4.873 -2.844 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -3.427 -4.044 -1.594 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -4.930 -4.888 -1.150 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -7.811 -3.404 -4.443 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -6.597 -2.105 -4.371 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -6.086 -3.785 -4.658 1.00 0.00 H new ATOM 220 N VAL A 14 -3.299 -0.767 -0.892 1.00 0.00 N ATOM 221 CA VAL A 14 -1.934 -0.369 -0.395 1.00 0.00 C ATOM 222 C VAL A 14 -2.043 0.068 1.074 1.00 0.00 C ATOM 223 O VAL A 14 -1.216 -0.291 1.892 1.00 0.00 O ATOM 224 CB VAL A 14 -1.462 0.802 -1.274 1.00 0.00 C ATOM 225 CG1 VAL A 14 -0.071 1.258 -0.823 1.00 0.00 C ATOM 226 CG2 VAL A 14 -1.407 0.355 -2.742 1.00 0.00 C ATOM 0 H VAL A 14 -3.684 -0.183 -1.634 1.00 0.00 H new ATOM 0 HA VAL A 14 -1.225 -1.195 -0.453 1.00 0.00 H new ATOM 0 HB VAL A 14 -2.162 1.631 -1.175 1.00 0.00 H new ATOM 0 HG11 VAL A 14 0.260 2.088 -1.448 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -0.114 1.581 0.217 1.00 0.00 H new ATOM 0 HG13 VAL A 14 0.632 0.430 -0.917 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -1.072 1.186 -3.363 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -0.710 -0.477 -2.843 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -2.399 0.038 -3.063 1.00 0.00 H new ATOM 236 N ALA A 15 -3.065 0.826 1.422 1.00 0.00 N ATOM 237 CA ALA A 15 -3.215 1.259 2.859 1.00 0.00 C ATOM 238 C ALA A 15 -3.404 0.027 3.763 1.00 0.00 C ATOM 239 O ALA A 15 -2.963 0.021 4.898 1.00 0.00 O ATOM 240 CB ALA A 15 -4.460 2.159 2.925 1.00 0.00 C ATOM 0 H ALA A 15 -3.790 1.159 0.787 1.00 0.00 H new ATOM 0 HA ALA A 15 -2.329 1.793 3.202 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -4.610 2.498 3.950 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -4.320 3.022 2.274 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -5.334 1.596 2.598 1.00 0.00 H new ATOM 246 N GLU A 16 -4.053 -1.020 3.278 1.00 0.00 N ATOM 247 CA GLU A 16 -4.255 -2.247 4.137 1.00 0.00 C ATOM 248 C GLU A 16 -2.908 -2.744 4.691 1.00 0.00 C ATOM 249 O GLU A 16 -2.830 -3.190 5.820 1.00 0.00 O ATOM 250 CB GLU A 16 -4.873 -3.322 3.229 1.00 0.00 C ATOM 251 CG GLU A 16 -5.281 -4.532 4.071 1.00 0.00 C ATOM 252 CD GLU A 16 -5.351 -5.773 3.178 1.00 0.00 C ATOM 253 OE1 GLU A 16 -4.537 -5.877 2.276 1.00 0.00 O ATOM 254 OE2 GLU A 16 -6.218 -6.599 3.414 1.00 0.00 O ATOM 0 H GLU A 16 -4.446 -1.078 2.339 1.00 0.00 H new ATOM 0 HA GLU A 16 -4.900 -2.023 4.987 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -5.742 -2.918 2.710 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -4.156 -3.623 2.465 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -4.561 -4.689 4.875 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -6.249 -4.353 4.540 1.00 0.00 H new ATOM 261 N LYS A 17 -1.847 -2.664 3.912 1.00 0.00 N ATOM 262 CA LYS A 17 -0.514 -3.133 4.427 1.00 0.00 C ATOM 263 C LYS A 17 0.163 -2.000 5.212 1.00 0.00 C ATOM 264 O LYS A 17 0.720 -2.228 6.270 1.00 0.00 O ATOM 265 CB LYS A 17 0.330 -3.518 3.202 1.00 0.00 C ATOM 266 CG LYS A 17 0.200 -5.022 2.948 1.00 0.00 C ATOM 267 CD LYS A 17 1.349 -5.759 3.638 1.00 0.00 C ATOM 268 CE LYS A 17 1.125 -5.754 5.152 1.00 0.00 C ATOM 269 NZ LYS A 17 2.255 -6.548 5.711 1.00 0.00 N ATOM 0 H LYS A 17 -1.846 -2.301 2.959 1.00 0.00 H new ATOM 0 HA LYS A 17 -0.625 -3.985 5.097 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -0.003 -2.960 2.327 1.00 0.00 H new ATOM 0 HB3 LYS A 17 1.375 -3.255 3.369 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -0.756 -5.384 3.326 1.00 0.00 H new ATOM 0 HG3 LYS A 17 0.216 -5.223 1.877 1.00 0.00 H new ATOM 0 HD2 LYS A 17 1.409 -6.784 3.272 1.00 0.00 H new ATOM 0 HD3 LYS A 17 2.298 -5.279 3.399 1.00 0.00 H new ATOM 0 HE2 LYS A 17 1.123 -4.738 5.547 1.00 0.00 H new ATOM 0 HE3 LYS A 17 0.164 -6.199 5.410 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 1.907 -7.149 6.486 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 2.661 -7.147 4.964 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 2.986 -5.903 6.074 1.00 0.00 H new ATOM 283 N LEU A 18 0.110 -0.779 4.717 1.00 0.00 N ATOM 284 CA LEU A 18 0.753 0.353 5.474 1.00 0.00 C ATOM 285 C LEU A 18 0.037 0.531 6.818 1.00 0.00 C ATOM 286 O LEU A 18 0.659 0.510 7.863 1.00 0.00 O ATOM 287 CB LEU A 18 0.579 1.613 4.616 1.00 0.00 C ATOM 288 CG LEU A 18 1.367 1.457 3.321 1.00 0.00 C ATOM 289 CD1 LEU A 18 0.731 2.326 2.237 1.00 0.00 C ATOM 290 CD2 LEU A 18 2.812 1.899 3.559 1.00 0.00 C ATOM 0 H LEU A 18 -0.341 -0.520 3.839 1.00 0.00 H new ATOM 0 HA LEU A 18 1.808 0.159 5.668 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -0.476 1.773 4.395 1.00 0.00 H new ATOM 0 HB3 LEU A 18 0.927 2.489 5.163 1.00 0.00 H new ATOM 0 HG LEU A 18 1.355 0.415 3.000 1.00 0.00 H new ATOM 0 HD11 LEU A 18 1.291 2.218 1.308 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -0.300 2.012 2.077 1.00 0.00 H new ATOM 0 HD13 LEU A 18 0.748 3.370 2.551 1.00 0.00 H new ATOM 0 HD21 LEU A 18 3.382 1.790 2.637 1.00 0.00 H new ATOM 0 HD22 LEU A 18 2.826 2.943 3.873 1.00 0.00 H new ATOM 0 HD23 LEU A 18 3.259 1.280 4.337 1.00 0.00 H new ATOM 302 N ALA A 19 -1.272 0.689 6.801 1.00 0.00 N ATOM 303 CA ALA A 19 -2.018 0.846 8.100 1.00 0.00 C ATOM 304 C ALA A 19 -1.847 -0.416 8.972 1.00 0.00 C ATOM 305 O ALA A 19 -1.989 -0.352 10.180 1.00 0.00 O ATOM 306 CB ALA A 19 -3.502 1.043 7.746 1.00 0.00 C ATOM 0 H ALA A 19 -1.848 0.716 5.959 1.00 0.00 H new ATOM 0 HA ALA A 19 -1.634 1.696 8.665 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -4.082 1.161 8.661 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -3.613 1.934 7.128 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -3.864 0.173 7.197 1.00 0.00 H new ATOM 312 N GLY A 20 -1.552 -1.566 8.383 1.00 0.00 N ATOM 313 CA GLY A 20 -1.387 -2.808 9.198 1.00 0.00 C ATOM 314 C GLY A 20 0.016 -2.858 9.827 1.00 0.00 C ATOM 315 O GLY A 20 0.177 -3.346 10.930 1.00 0.00 O ATOM 0 H GLY A 20 -1.421 -1.687 7.379 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -2.144 -2.839 9.981 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -1.542 -3.685 8.570 1.00 0.00 H new ATOM 319 N ILE A 21 1.040 -2.370 9.145 1.00 0.00 N ATOM 320 CA ILE A 21 2.433 -2.418 9.740 1.00 0.00 C ATOM 321 C ILE A 21 2.425 -1.798 11.161 1.00 0.00 C ATOM 322 O ILE A 21 1.884 -0.726 11.353 1.00 0.00 O ATOM 323 CB ILE A 21 3.341 -1.610 8.784 1.00 0.00 C ATOM 324 CG1 ILE A 21 3.469 -2.366 7.458 1.00 0.00 C ATOM 325 CG2 ILE A 21 4.738 -1.429 9.386 1.00 0.00 C ATOM 326 CD1 ILE A 21 3.657 -1.372 6.306 1.00 0.00 C ATOM 0 H ILE A 21 0.976 -1.948 8.219 1.00 0.00 H new ATOM 0 HA ILE A 21 2.795 -3.441 9.841 1.00 0.00 H new ATOM 0 HB ILE A 21 2.895 -0.628 8.625 1.00 0.00 H new ATOM 0 HG12 ILE A 21 4.316 -3.051 7.500 1.00 0.00 H new ATOM 0 HG13 ILE A 21 2.578 -2.970 7.287 1.00 0.00 H new ATOM 0 HG21 ILE A 21 5.360 -0.858 8.697 1.00 0.00 H new ATOM 0 HG22 ILE A 21 4.660 -0.894 10.333 1.00 0.00 H new ATOM 0 HG23 ILE A 21 5.190 -2.406 9.558 1.00 0.00 H new ATOM 0 HD11 ILE A 21 3.747 -1.917 5.366 1.00 0.00 H new ATOM 0 HD12 ILE A 21 2.797 -0.705 6.257 1.00 0.00 H new ATOM 0 HD13 ILE A 21 4.561 -0.787 6.474 1.00 0.00 H new ATOM 338 N PRO A 22 3.018 -2.491 12.117 1.00 0.00 N ATOM 339 CA PRO A 22 3.050 -1.978 13.516 1.00 0.00 C ATOM 340 C PRO A 22 3.959 -0.739 13.659 1.00 0.00 C ATOM 341 O PRO A 22 3.796 0.034 14.587 1.00 0.00 O ATOM 342 CB PRO A 22 3.604 -3.152 14.320 1.00 0.00 C ATOM 343 CG PRO A 22 4.385 -3.958 13.336 1.00 0.00 C ATOM 344 CD PRO A 22 3.704 -3.792 12.005 1.00 0.00 C ATOM 0 HA PRO A 22 2.067 -1.650 13.854 1.00 0.00 H new ATOM 0 HB2 PRO A 22 4.236 -2.807 15.138 1.00 0.00 H new ATOM 0 HB3 PRO A 22 2.801 -3.741 14.764 1.00 0.00 H new ATOM 0 HG2 PRO A 22 5.418 -3.615 13.288 1.00 0.00 H new ATOM 0 HG3 PRO A 22 4.411 -5.007 13.629 1.00 0.00 H new ATOM 0 HD2 PRO A 22 4.423 -3.795 11.185 1.00 0.00 H new ATOM 0 HD3 PRO A 22 2.998 -4.600 11.814 1.00 0.00 H new ATOM 352 N ASN A 23 4.905 -0.527 12.764 1.00 0.00 N ATOM 353 CA ASN A 23 5.790 0.678 12.886 1.00 0.00 C ATOM 354 C ASN A 23 5.361 1.765 11.884 1.00 0.00 C ATOM 355 O ASN A 23 6.184 2.522 11.402 1.00 0.00 O ATOM 356 CB ASN A 23 7.208 0.188 12.569 1.00 0.00 C ATOM 357 CG ASN A 23 7.888 -0.284 13.861 1.00 0.00 C ATOM 358 OD1 ASN A 23 8.338 0.524 14.649 1.00 0.00 O ATOM 359 ND2 ASN A 23 7.984 -1.566 14.119 1.00 0.00 N ATOM 0 H ASN A 23 5.098 -1.131 11.965 1.00 0.00 H new ATOM 0 HA ASN A 23 5.731 1.119 13.881 1.00 0.00 H new ATOM 0 HB2 ASN A 23 7.169 -0.628 11.847 1.00 0.00 H new ATOM 0 HB3 ASN A 23 7.788 0.990 12.113 1.00 0.00 H new ATOM 0 HD21 ASN A 23 8.435 -1.881 14.978 1.00 0.00 H new ATOM 0 HD22 ASN A 23 7.608 -2.248 13.461 1.00 0.00 H new ATOM 366 N PHE A 24 4.083 1.859 11.568 1.00 0.00 N ATOM 367 CA PHE A 24 3.622 2.904 10.605 1.00 0.00 C ATOM 368 C PHE A 24 2.495 3.734 11.245 1.00 0.00 C ATOM 369 O PHE A 24 1.339 3.361 11.184 1.00 0.00 O ATOM 370 CB PHE A 24 3.101 2.126 9.389 1.00 0.00 C ATOM 371 CG PHE A 24 3.735 2.663 8.126 1.00 0.00 C ATOM 372 CD1 PHE A 24 3.384 3.932 7.650 1.00 0.00 C ATOM 373 CD2 PHE A 24 4.673 1.891 7.431 1.00 0.00 C ATOM 374 CE1 PHE A 24 3.971 4.428 6.480 1.00 0.00 C ATOM 375 CE2 PHE A 24 5.261 2.387 6.261 1.00 0.00 C ATOM 376 CZ PHE A 24 4.909 3.656 5.785 1.00 0.00 C ATOM 0 H PHE A 24 3.348 1.256 11.938 1.00 0.00 H new ATOM 0 HA PHE A 24 4.415 3.598 10.326 1.00 0.00 H new ATOM 0 HB2 PHE A 24 3.330 1.066 9.499 1.00 0.00 H new ATOM 0 HB3 PHE A 24 2.016 2.213 9.328 1.00 0.00 H new ATOM 0 HD1 PHE A 24 2.660 4.528 8.186 1.00 0.00 H new ATOM 0 HD2 PHE A 24 4.944 0.912 7.797 1.00 0.00 H new ATOM 0 HE1 PHE A 24 3.700 5.407 6.113 1.00 0.00 H new ATOM 0 HE2 PHE A 24 5.986 1.791 5.726 1.00 0.00 H new ATOM 0 HZ PHE A 24 5.361 4.039 4.882 1.00 0.00 H new ATOM 386 N ASN A 25 2.821 4.852 11.863 1.00 0.00 N ATOM 387 CA ASN A 25 1.755 5.687 12.507 1.00 0.00 C ATOM 388 C ASN A 25 1.486 6.956 11.679 1.00 0.00 C ATOM 389 O ASN A 25 0.347 7.276 11.393 1.00 0.00 O ATOM 390 CB ASN A 25 2.302 6.055 13.889 1.00 0.00 C ATOM 391 CG ASN A 25 1.242 6.844 14.668 1.00 0.00 C ATOM 392 OD1 ASN A 25 0.098 6.437 14.731 1.00 0.00 O ATOM 393 ND2 ASN A 25 1.569 7.962 15.269 1.00 0.00 N ATOM 0 H ASN A 25 3.770 5.217 11.947 1.00 0.00 H new ATOM 0 HA ASN A 25 0.809 5.149 12.576 1.00 0.00 H new ATOM 0 HB2 ASN A 25 2.573 5.152 14.436 1.00 0.00 H new ATOM 0 HB3 ASN A 25 3.210 6.650 13.786 1.00 0.00 H new ATOM 0 HD21 ASN A 25 0.865 8.487 15.787 1.00 0.00 H new ATOM 0 HD22 ASN A 25 2.528 8.307 15.218 1.00 0.00 H new ATOM 400 N GLU A 26 2.516 7.681 11.293 1.00 0.00 N ATOM 401 CA GLU A 26 2.290 8.924 10.486 1.00 0.00 C ATOM 402 C GLU A 26 2.682 8.681 9.019 1.00 0.00 C ATOM 403 O GLU A 26 3.308 7.689 8.699 1.00 0.00 O ATOM 404 CB GLU A 26 3.193 9.997 11.118 1.00 0.00 C ATOM 405 CG GLU A 26 2.345 11.190 11.571 1.00 0.00 C ATOM 406 CD GLU A 26 3.056 11.917 12.713 1.00 0.00 C ATOM 407 OE1 GLU A 26 3.411 11.260 13.677 1.00 0.00 O ATOM 408 OE2 GLU A 26 3.233 13.119 12.604 1.00 0.00 O ATOM 0 H GLU A 26 3.491 7.467 11.500 1.00 0.00 H new ATOM 0 HA GLU A 26 1.244 9.229 10.491 1.00 0.00 H new ATOM 0 HB2 GLU A 26 3.731 9.578 11.969 1.00 0.00 H new ATOM 0 HB3 GLU A 26 3.942 10.325 10.398 1.00 0.00 H new ATOM 0 HG2 GLU A 26 2.183 11.872 10.737 1.00 0.00 H new ATOM 0 HG3 GLU A 26 1.363 10.848 11.899 1.00 0.00 H new ATOM 415 N ASP A 27 2.316 9.577 8.120 1.00 0.00 N ATOM 416 CA ASP A 27 2.667 9.397 6.672 1.00 0.00 C ATOM 417 C ASP A 27 2.203 8.019 6.164 1.00 0.00 C ATOM 418 O ASP A 27 2.897 7.377 5.400 1.00 0.00 O ATOM 419 CB ASP A 27 4.193 9.508 6.604 1.00 0.00 C ATOM 420 CG ASP A 27 4.627 10.891 7.094 1.00 0.00 C ATOM 421 OD1 ASP A 27 4.685 11.080 8.297 1.00 0.00 O ATOM 422 OD2 ASP A 27 4.895 11.737 6.257 1.00 0.00 O ATOM 0 H ASP A 27 1.789 10.424 8.331 1.00 0.00 H new ATOM 0 HA ASP A 27 2.177 10.142 6.045 1.00 0.00 H new ATOM 0 HB2 ASP A 27 4.652 8.733 7.217 1.00 0.00 H new ATOM 0 HB3 ASP A 27 4.534 9.349 5.581 1.00 0.00 H new ATOM 427 N ILE A 28 1.041 7.559 6.580 1.00 0.00 N ATOM 428 CA ILE A 28 0.554 6.220 6.104 1.00 0.00 C ATOM 429 C ILE A 28 -0.490 6.379 4.979 1.00 0.00 C ATOM 430 O ILE A 28 -0.546 5.563 4.075 1.00 0.00 O ATOM 431 CB ILE A 28 -0.015 5.515 7.361 1.00 0.00 C ATOM 432 CG1 ILE A 28 -0.206 4.008 7.094 1.00 0.00 C ATOM 433 CG2 ILE A 28 -1.346 6.142 7.803 1.00 0.00 C ATOM 434 CD1 ILE A 28 -1.300 3.759 6.043 1.00 0.00 C ATOM 0 H ILE A 28 0.416 8.047 7.221 1.00 0.00 H new ATOM 0 HA ILE A 28 1.351 5.622 5.662 1.00 0.00 H new ATOM 0 HB ILE A 28 0.706 5.647 8.168 1.00 0.00 H new ATOM 0 HG12 ILE A 28 0.734 3.575 6.752 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -0.470 3.503 8.023 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -1.717 5.623 8.687 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -1.192 7.195 8.038 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -2.075 6.053 6.998 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -1.409 2.687 5.878 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -2.245 4.170 6.397 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -1.022 4.243 5.107 1.00 0.00 H new ATOM 446 N LYS A 29 -1.300 7.415 4.998 1.00 0.00 N ATOM 447 CA LYS A 29 -2.294 7.590 3.887 1.00 0.00 C ATOM 448 C LYS A 29 -1.601 8.286 2.707 1.00 0.00 C ATOM 449 O LYS A 29 -1.851 7.960 1.562 1.00 0.00 O ATOM 450 CB LYS A 29 -3.434 8.457 4.441 1.00 0.00 C ATOM 451 CG LYS A 29 -4.757 8.026 3.807 1.00 0.00 C ATOM 452 CD LYS A 29 -4.992 8.823 2.521 1.00 0.00 C ATOM 453 CE LYS A 29 -5.372 10.262 2.875 1.00 0.00 C ATOM 454 NZ LYS A 29 -6.855 10.243 3.018 1.00 0.00 N ATOM 0 H LYS A 29 -1.317 8.135 5.721 1.00 0.00 H new ATOM 0 HA LYS A 29 -2.687 6.636 3.535 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -3.488 8.356 5.525 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -3.242 9.509 4.228 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -4.736 6.959 3.587 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -5.578 8.192 4.505 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -4.092 8.814 1.905 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -5.785 8.360 1.933 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -4.890 10.582 3.799 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -5.059 10.956 2.095 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -7.193 11.196 3.261 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -7.286 9.941 2.121 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -7.123 9.578 3.772 1.00 0.00 H new ATOM 468 N TYR A 30 -0.712 9.227 2.972 1.00 0.00 N ATOM 469 CA TYR A 30 0.006 9.905 1.841 1.00 0.00 C ATOM 470 C TYR A 30 1.048 8.954 1.227 1.00 0.00 C ATOM 471 O TYR A 30 1.347 9.052 0.050 1.00 0.00 O ATOM 472 CB TYR A 30 0.697 11.146 2.429 1.00 0.00 C ATOM 473 CG TYR A 30 -0.347 12.104 2.949 1.00 0.00 C ATOM 474 CD1 TYR A 30 -1.101 12.871 2.053 1.00 0.00 C ATOM 475 CD2 TYR A 30 -0.562 12.226 4.327 1.00 0.00 C ATOM 476 CE1 TYR A 30 -2.069 13.760 2.534 1.00 0.00 C ATOM 477 CE2 TYR A 30 -1.531 13.115 4.809 1.00 0.00 C ATOM 478 CZ TYR A 30 -2.285 13.882 3.912 1.00 0.00 C ATOM 479 OH TYR A 30 -3.239 14.758 4.387 1.00 0.00 O ATOM 0 H TYR A 30 -0.459 9.547 3.907 1.00 0.00 H new ATOM 0 HA TYR A 30 -0.690 10.187 1.051 1.00 0.00 H new ATOM 0 HB2 TYR A 30 1.371 10.853 3.234 1.00 0.00 H new ATOM 0 HB3 TYR A 30 1.305 11.633 1.666 1.00 0.00 H new ATOM 0 HD1 TYR A 30 -0.936 12.777 0.990 1.00 0.00 H new ATOM 0 HD2 TYR A 30 0.020 11.634 5.019 1.00 0.00 H new ATOM 0 HE1 TYR A 30 -2.650 14.352 1.842 1.00 0.00 H new ATOM 0 HE2 TYR A 30 -1.697 13.209 5.872 1.00 0.00 H new ATOM 0 HH TYR A 30 -3.261 14.718 5.366 1.00 0.00 H new ATOM 489 N VAL A 31 1.603 8.028 1.995 1.00 0.00 N ATOM 490 CA VAL A 31 2.616 7.091 1.395 1.00 0.00 C ATOM 491 C VAL A 31 1.921 6.106 0.434 1.00 0.00 C ATOM 492 O VAL A 31 2.480 5.741 -0.584 1.00 0.00 O ATOM 493 CB VAL A 31 3.316 6.361 2.569 1.00 0.00 C ATOM 494 CG1 VAL A 31 2.387 5.332 3.222 1.00 0.00 C ATOM 495 CG2 VAL A 31 4.570 5.653 2.046 1.00 0.00 C ATOM 0 H VAL A 31 1.402 7.886 2.985 1.00 0.00 H new ATOM 0 HA VAL A 31 3.359 7.629 0.806 1.00 0.00 H new ATOM 0 HB VAL A 31 3.584 7.102 3.322 1.00 0.00 H new ATOM 0 HG11 VAL A 31 2.910 4.838 4.041 1.00 0.00 H new ATOM 0 HG12 VAL A 31 1.500 5.835 3.608 1.00 0.00 H new ATOM 0 HG13 VAL A 31 2.089 4.589 2.482 1.00 0.00 H new ATOM 0 HG21 VAL A 31 5.066 5.138 2.868 1.00 0.00 H new ATOM 0 HG22 VAL A 31 4.287 4.929 1.282 1.00 0.00 H new ATOM 0 HG23 VAL A 31 5.250 6.388 1.615 1.00 0.00 H new ATOM 505 N ALA A 32 0.708 5.680 0.736 1.00 0.00 N ATOM 506 CA ALA A 32 0.005 4.727 -0.197 1.00 0.00 C ATOM 507 C ALA A 32 -0.255 5.419 -1.543 1.00 0.00 C ATOM 508 O ALA A 32 -0.109 4.813 -2.589 1.00 0.00 O ATOM 509 CB ALA A 32 -1.324 4.344 0.470 1.00 0.00 C ATOM 0 H ALA A 32 0.184 5.944 1.570 1.00 0.00 H new ATOM 0 HA ALA A 32 0.610 3.840 -0.385 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -1.868 3.652 -0.173 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -1.125 3.867 1.430 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -1.924 5.241 0.628 1.00 0.00 H new ATOM 515 N GLU A 33 -0.631 6.684 -1.534 1.00 0.00 N ATOM 516 CA GLU A 33 -0.885 7.395 -2.841 1.00 0.00 C ATOM 517 C GLU A 33 0.392 7.380 -3.689 1.00 0.00 C ATOM 518 O GLU A 33 0.357 7.057 -4.862 1.00 0.00 O ATOM 519 CB GLU A 33 -1.279 8.841 -2.495 1.00 0.00 C ATOM 520 CG GLU A 33 -2.725 8.871 -1.996 1.00 0.00 C ATOM 521 CD GLU A 33 -3.068 10.281 -1.511 1.00 0.00 C ATOM 522 OE1 GLU A 33 -2.553 10.673 -0.477 1.00 0.00 O ATOM 523 OE2 GLU A 33 -3.840 10.945 -2.183 1.00 0.00 O ATOM 0 H GLU A 33 -0.771 7.247 -0.695 1.00 0.00 H new ATOM 0 HA GLU A 33 -1.676 6.908 -3.412 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -0.611 9.238 -1.731 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -1.173 9.478 -3.373 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -3.403 8.575 -2.796 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -2.856 8.154 -1.185 1.00 0.00 H new ATOM 530 N TYR A 34 1.524 7.703 -3.100 1.00 0.00 N ATOM 531 CA TYR A 34 2.807 7.676 -3.889 1.00 0.00 C ATOM 532 C TYR A 34 3.080 6.239 -4.353 1.00 0.00 C ATOM 533 O TYR A 34 3.500 6.015 -5.473 1.00 0.00 O ATOM 534 CB TYR A 34 3.921 8.161 -2.940 1.00 0.00 C ATOM 535 CG TYR A 34 5.287 8.131 -3.612 1.00 0.00 C ATOM 536 CD1 TYR A 34 5.423 8.247 -5.011 1.00 0.00 C ATOM 537 CD2 TYR A 34 6.432 8.007 -2.815 1.00 0.00 C ATOM 538 CE1 TYR A 34 6.695 8.240 -5.594 1.00 0.00 C ATOM 539 CE2 TYR A 34 7.701 7.996 -3.401 1.00 0.00 C ATOM 540 CZ TYR A 34 7.834 8.114 -4.790 1.00 0.00 C ATOM 541 OH TYR A 34 9.087 8.113 -5.366 1.00 0.00 O ATOM 0 H TYR A 34 1.617 7.980 -2.123 1.00 0.00 H new ATOM 0 HA TYR A 34 2.756 8.313 -4.772 1.00 0.00 H new ATOM 0 HB2 TYR A 34 3.701 9.176 -2.609 1.00 0.00 H new ATOM 0 HB3 TYR A 34 3.940 7.532 -2.050 1.00 0.00 H new ATOM 0 HD1 TYR A 34 4.545 8.341 -5.633 1.00 0.00 H new ATOM 0 HD2 TYR A 34 6.334 7.920 -1.743 1.00 0.00 H new ATOM 0 HE1 TYR A 34 6.798 8.332 -6.665 1.00 0.00 H new ATOM 0 HE2 TYR A 34 8.580 7.896 -2.782 1.00 0.00 H new ATOM 0 HH TYR A 34 9.765 8.259 -4.674 1.00 0.00 H new ATOM 551 N ILE A 35 2.822 5.258 -3.508 1.00 0.00 N ATOM 552 CA ILE A 35 3.050 3.828 -3.928 1.00 0.00 C ATOM 553 C ILE A 35 2.163 3.523 -5.150 1.00 0.00 C ATOM 554 O ILE A 35 2.629 2.984 -6.136 1.00 0.00 O ATOM 555 CB ILE A 35 2.668 2.959 -2.711 1.00 0.00 C ATOM 556 CG1 ILE A 35 3.710 3.175 -1.610 1.00 0.00 C ATOM 557 CG2 ILE A 35 2.636 1.475 -3.086 1.00 0.00 C ATOM 558 CD1 ILE A 35 3.209 2.573 -0.298 1.00 0.00 C ATOM 0 H ILE A 35 2.469 5.383 -2.559 1.00 0.00 H new ATOM 0 HA ILE A 35 4.082 3.630 -4.218 1.00 0.00 H new ATOM 0 HB ILE A 35 1.675 3.249 -2.367 1.00 0.00 H new ATOM 0 HG12 ILE A 35 4.655 2.713 -1.895 1.00 0.00 H new ATOM 0 HG13 ILE A 35 3.902 4.240 -1.482 1.00 0.00 H new ATOM 0 HG21 ILE A 35 2.364 0.884 -2.211 1.00 0.00 H new ATOM 0 HG22 ILE A 35 1.901 1.315 -3.875 1.00 0.00 H new ATOM 0 HG23 ILE A 35 3.620 1.168 -3.440 1.00 0.00 H new ATOM 0 HD11 ILE A 35 3.954 2.729 0.482 1.00 0.00 H new ATOM 0 HD12 ILE A 35 2.275 3.055 -0.010 1.00 0.00 H new ATOM 0 HD13 ILE A 35 3.040 1.504 -0.429 1.00 0.00 H new ATOM 570 N VAL A 36 0.899 3.895 -5.105 1.00 0.00 N ATOM 571 CA VAL A 36 0.010 3.648 -6.297 1.00 0.00 C ATOM 572 C VAL A 36 0.557 4.446 -7.492 1.00 0.00 C ATOM 573 O VAL A 36 0.605 3.948 -8.600 1.00 0.00 O ATOM 574 CB VAL A 36 -1.401 4.132 -5.912 1.00 0.00 C ATOM 575 CG1 VAL A 36 -2.345 4.015 -7.113 1.00 0.00 C ATOM 576 CG2 VAL A 36 -1.936 3.264 -4.773 1.00 0.00 C ATOM 0 H VAL A 36 0.450 4.351 -4.310 1.00 0.00 H new ATOM 0 HA VAL A 36 -0.021 2.595 -6.575 1.00 0.00 H new ATOM 0 HB VAL A 36 -1.346 5.174 -5.598 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -3.339 4.360 -6.829 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -1.969 4.627 -7.933 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -2.399 2.974 -7.433 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -2.935 3.602 -4.496 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -1.982 2.225 -5.098 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -1.274 3.346 -3.911 1.00 0.00 H new ATOM 586 N LEU A 37 0.995 5.674 -7.274 1.00 0.00 N ATOM 587 CA LEU A 37 1.566 6.477 -8.417 1.00 0.00 C ATOM 588 C LEU A 37 2.748 5.702 -9.019 1.00 0.00 C ATOM 589 O LEU A 37 2.869 5.589 -10.225 1.00 0.00 O ATOM 590 CB LEU A 37 2.050 7.815 -7.834 1.00 0.00 C ATOM 591 CG LEU A 37 1.901 8.914 -8.886 1.00 0.00 C ATOM 592 CD1 LEU A 37 0.504 9.531 -8.788 1.00 0.00 C ATOM 593 CD2 LEU A 37 2.953 9.999 -8.642 1.00 0.00 C ATOM 0 H LEU A 37 0.983 6.148 -6.371 1.00 0.00 H new ATOM 0 HA LEU A 37 0.826 6.652 -9.198 1.00 0.00 H new ATOM 0 HB2 LEU A 37 1.471 8.067 -6.945 1.00 0.00 H new ATOM 0 HB3 LEU A 37 3.092 7.733 -7.524 1.00 0.00 H new ATOM 0 HG LEU A 37 2.041 8.486 -9.879 1.00 0.00 H new ATOM 0 HD11 LEU A 37 0.399 10.314 -9.538 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -0.247 8.760 -8.960 1.00 0.00 H new ATOM 0 HD13 LEU A 37 0.364 9.958 -7.795 1.00 0.00 H new ATOM 0 HD21 LEU A 37 2.848 10.783 -9.392 1.00 0.00 H new ATOM 0 HD22 LEU A 37 2.812 10.425 -7.649 1.00 0.00 H new ATOM 0 HD23 LEU A 37 3.949 9.562 -8.712 1.00 0.00 H new ATOM 605 N LEU A 38 3.600 5.133 -8.186 1.00 0.00 N ATOM 606 CA LEU A 38 4.746 4.329 -8.735 1.00 0.00 C ATOM 607 C LEU A 38 4.174 3.110 -9.480 1.00 0.00 C ATOM 608 O LEU A 38 4.628 2.757 -10.551 1.00 0.00 O ATOM 609 CB LEU A 38 5.589 3.864 -7.536 1.00 0.00 C ATOM 610 CG LEU A 38 6.218 5.074 -6.843 1.00 0.00 C ATOM 611 CD1 LEU A 38 6.680 4.675 -5.440 1.00 0.00 C ATOM 612 CD2 LEU A 38 7.419 5.558 -7.657 1.00 0.00 C ATOM 0 H LEU A 38 3.552 5.190 -7.169 1.00 0.00 H new ATOM 0 HA LEU A 38 5.357 4.913 -9.424 1.00 0.00 H new ATOM 0 HB2 LEU A 38 4.964 3.315 -6.832 1.00 0.00 H new ATOM 0 HB3 LEU A 38 6.368 3.180 -7.871 1.00 0.00 H new ATOM 0 HG LEU A 38 5.482 5.875 -6.769 1.00 0.00 H new ATOM 0 HD11 LEU A 38 7.128 5.537 -4.946 1.00 0.00 H new ATOM 0 HD12 LEU A 38 5.825 4.328 -4.860 1.00 0.00 H new ATOM 0 HD13 LEU A 38 7.417 3.875 -5.513 1.00 0.00 H new ATOM 0 HD21 LEU A 38 7.869 6.420 -7.165 1.00 0.00 H new ATOM 0 HD22 LEU A 38 8.155 4.758 -7.730 1.00 0.00 H new ATOM 0 HD23 LEU A 38 7.090 5.842 -8.657 1.00 0.00 H new ATOM 624 N ILE A 39 3.163 2.475 -8.919 1.00 0.00 N ATOM 625 CA ILE A 39 2.541 1.282 -9.603 1.00 0.00 C ATOM 626 C ILE A 39 1.964 1.721 -10.959 1.00 0.00 C ATOM 627 O ILE A 39 2.202 1.088 -11.970 1.00 0.00 O ATOM 628 CB ILE A 39 1.417 0.792 -8.654 1.00 0.00 C ATOM 629 CG1 ILE A 39 2.047 0.214 -7.369 1.00 0.00 C ATOM 630 CG2 ILE A 39 0.535 -0.268 -9.336 1.00 0.00 C ATOM 631 CD1 ILE A 39 2.741 -1.126 -7.656 1.00 0.00 C ATOM 0 H ILE A 39 2.744 2.728 -8.024 1.00 0.00 H new ATOM 0 HA ILE A 39 3.261 0.487 -9.795 1.00 0.00 H new ATOM 0 HB ILE A 39 0.781 1.641 -8.401 1.00 0.00 H new ATOM 0 HG12 ILE A 39 2.769 0.922 -6.962 1.00 0.00 H new ATOM 0 HG13 ILE A 39 1.276 0.074 -6.612 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -0.244 -0.592 -8.646 1.00 0.00 H new ATOM 0 HG22 ILE A 39 0.075 0.160 -10.227 1.00 0.00 H new ATOM 0 HG23 ILE A 39 1.148 -1.124 -9.619 1.00 0.00 H new ATOM 0 HD11 ILE A 39 3.178 -1.514 -6.736 1.00 0.00 H new ATOM 0 HD12 ILE A 39 2.011 -1.839 -8.040 1.00 0.00 H new ATOM 0 HD13 ILE A 39 3.527 -0.977 -8.396 1.00 0.00 H new ATOM 643 N VAL A 40 1.219 2.805 -10.988 1.00 0.00 N ATOM 644 CA VAL A 40 0.642 3.278 -12.300 1.00 0.00 C ATOM 645 C VAL A 40 1.781 3.570 -13.296 1.00 0.00 C ATOM 646 O VAL A 40 1.640 3.340 -14.482 1.00 0.00 O ATOM 647 CB VAL A 40 -0.157 4.562 -11.999 1.00 0.00 C ATOM 648 CG1 VAL A 40 -0.750 5.122 -13.298 1.00 0.00 C ATOM 649 CG2 VAL A 40 -1.293 4.242 -11.020 1.00 0.00 C ATOM 0 H VAL A 40 0.986 3.377 -10.176 1.00 0.00 H new ATOM 0 HA VAL A 40 -0.002 2.521 -12.747 1.00 0.00 H new ATOM 0 HB VAL A 40 0.510 5.302 -11.557 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -1.313 6.029 -13.079 1.00 0.00 H new ATOM 0 HG12 VAL A 40 0.055 5.354 -13.995 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -1.414 4.381 -13.744 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -1.857 5.150 -10.808 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -1.956 3.498 -11.462 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -0.875 3.850 -10.093 1.00 0.00 H new ATOM 659 N ASN A 41 2.907 4.075 -12.829 1.00 0.00 N ATOM 660 CA ASN A 41 4.042 4.372 -13.775 1.00 0.00 C ATOM 661 C ASN A 41 4.454 3.106 -14.540 1.00 0.00 C ATOM 662 O ASN A 41 4.790 3.173 -15.708 1.00 0.00 O ATOM 663 CB ASN A 41 5.216 4.880 -12.921 1.00 0.00 C ATOM 664 CG ASN A 41 5.120 6.404 -12.774 1.00 0.00 C ATOM 665 OD1 ASN A 41 5.360 7.128 -13.720 1.00 0.00 O ATOM 666 ND2 ASN A 41 4.778 6.931 -11.624 1.00 0.00 N ATOM 0 H ASN A 41 3.088 4.292 -11.849 1.00 0.00 H new ATOM 0 HA ASN A 41 3.742 5.117 -14.512 1.00 0.00 H new ATOM 0 HB2 ASN A 41 5.196 4.407 -11.939 1.00 0.00 H new ATOM 0 HB3 ASN A 41 6.163 4.608 -13.387 1.00 0.00 H new ATOM 0 HD21 ASN A 41 4.714 7.944 -11.526 1.00 0.00 H new ATOM 0 HD22 ASN A 41 4.575 6.328 -10.827 1.00 0.00 H new ATOM 673 N GLY A 42 4.434 1.950 -13.903 1.00 0.00 N ATOM 674 CA GLY A 42 4.833 0.700 -14.633 1.00 0.00 C ATOM 675 C GLY A 42 4.590 -0.539 -13.757 1.00 0.00 C ATOM 676 O GLY A 42 3.851 -1.430 -14.132 1.00 0.00 O ATOM 0 H GLY A 42 4.164 1.822 -12.928 1.00 0.00 H new ATOM 0 HA2 GLY A 42 4.263 0.615 -15.558 1.00 0.00 H new ATOM 0 HA3 GLY A 42 5.886 0.755 -14.911 1.00 0.00 H new ATOM 680 N GLY A 43 5.203 -0.602 -12.595 1.00 0.00 N ATOM 681 CA GLY A 43 5.001 -1.783 -11.707 1.00 0.00 C ATOM 682 C GLY A 43 6.327 -2.543 -11.537 1.00 0.00 C ATOM 683 O GLY A 43 6.398 -3.732 -11.782 1.00 0.00 O ATOM 0 H GLY A 43 5.831 0.113 -12.229 1.00 0.00 H new ATOM 0 HA2 GLY A 43 4.630 -1.459 -10.735 1.00 0.00 H new ATOM 0 HA3 GLY A 43 4.245 -2.443 -12.132 1.00 0.00 H new ATOM 687 N THR A 44 7.372 -1.872 -11.098 1.00 0.00 N ATOM 688 CA THR A 44 8.679 -2.560 -10.890 1.00 0.00 C ATOM 689 C THR A 44 9.028 -2.504 -9.395 1.00 0.00 C ATOM 690 O THR A 44 9.442 -1.477 -8.897 1.00 0.00 O ATOM 691 CB THR A 44 9.685 -1.760 -11.719 1.00 0.00 C ATOM 692 OG1 THR A 44 9.506 -0.373 -11.467 1.00 0.00 O ATOM 693 CG2 THR A 44 9.459 -2.039 -13.207 1.00 0.00 C ATOM 0 H THR A 44 7.369 -0.876 -10.876 1.00 0.00 H new ATOM 0 HA THR A 44 8.670 -3.608 -11.189 1.00 0.00 H new ATOM 0 HB THR A 44 10.698 -2.054 -11.444 1.00 0.00 H new ATOM 0 HG1 THR A 44 10.373 0.038 -11.268 1.00 0.00 H new ATOM 0 HG21 THR A 44 10.176 -1.469 -13.797 1.00 0.00 H new ATOM 0 HG22 THR A 44 9.593 -3.103 -13.402 1.00 0.00 H new ATOM 0 HG23 THR A 44 8.446 -1.744 -13.483 1.00 0.00 H new ATOM 701 N VAL A 45 8.831 -3.587 -8.666 1.00 0.00 N ATOM 702 CA VAL A 45 9.126 -3.563 -7.179 1.00 0.00 C ATOM 703 C VAL A 45 10.522 -2.978 -6.887 1.00 0.00 C ATOM 704 O VAL A 45 10.714 -2.328 -5.878 1.00 0.00 O ATOM 705 CB VAL A 45 9.032 -5.021 -6.677 1.00 0.00 C ATOM 706 CG1 VAL A 45 9.373 -5.086 -5.184 1.00 0.00 C ATOM 707 CG2 VAL A 45 7.606 -5.540 -6.879 1.00 0.00 C ATOM 0 H VAL A 45 8.484 -4.476 -9.026 1.00 0.00 H new ATOM 0 HA VAL A 45 8.409 -2.923 -6.665 1.00 0.00 H new ATOM 0 HB VAL A 45 9.737 -5.633 -7.240 1.00 0.00 H new ATOM 0 HG11 VAL A 45 9.304 -6.118 -4.840 1.00 0.00 H new ATOM 0 HG12 VAL A 45 10.387 -4.718 -5.026 1.00 0.00 H new ATOM 0 HG13 VAL A 45 8.671 -4.469 -4.623 1.00 0.00 H new ATOM 0 HG21 VAL A 45 7.540 -6.569 -6.525 1.00 0.00 H new ATOM 0 HG22 VAL A 45 6.909 -4.917 -6.318 1.00 0.00 H new ATOM 0 HG23 VAL A 45 7.352 -5.504 -7.938 1.00 0.00 H new ATOM 717 N GLU A 46 11.493 -3.194 -7.745 1.00 0.00 N ATOM 718 CA GLU A 46 12.859 -2.624 -7.459 1.00 0.00 C ATOM 719 C GLU A 46 12.832 -1.100 -7.612 1.00 0.00 C ATOM 720 O GLU A 46 13.167 -0.383 -6.687 1.00 0.00 O ATOM 721 CB GLU A 46 13.831 -3.255 -8.467 1.00 0.00 C ATOM 722 CG GLU A 46 15.216 -3.384 -7.828 1.00 0.00 C ATOM 723 CD GLU A 46 16.010 -4.477 -8.546 1.00 0.00 C ATOM 724 OE1 GLU A 46 15.408 -5.470 -8.921 1.00 0.00 O ATOM 725 OE2 GLU A 46 17.206 -4.302 -8.710 1.00 0.00 O ATOM 0 H GLU A 46 11.408 -3.726 -8.611 1.00 0.00 H new ATOM 0 HA GLU A 46 13.173 -2.846 -6.439 1.00 0.00 H new ATOM 0 HB2 GLU A 46 13.468 -4.236 -8.774 1.00 0.00 H new ATOM 0 HB3 GLU A 46 13.889 -2.641 -9.366 1.00 0.00 H new ATOM 0 HG2 GLU A 46 15.747 -2.434 -7.890 1.00 0.00 H new ATOM 0 HG3 GLU A 46 15.119 -3.626 -6.770 1.00 0.00 H new ATOM 732 N SER A 47 12.420 -0.592 -8.754 1.00 0.00 N ATOM 733 CA SER A 47 12.365 0.904 -8.909 1.00 0.00 C ATOM 734 C SER A 47 11.248 1.474 -8.017 1.00 0.00 C ATOM 735 O SER A 47 11.354 2.585 -7.530 1.00 0.00 O ATOM 736 CB SER A 47 12.085 1.201 -10.391 1.00 0.00 C ATOM 737 OG SER A 47 11.724 -0.003 -11.057 1.00 0.00 O ATOM 0 H SER A 47 12.126 -1.132 -9.568 1.00 0.00 H new ATOM 0 HA SER A 47 13.304 1.368 -8.606 1.00 0.00 H new ATOM 0 HB2 SER A 47 11.283 1.933 -10.481 1.00 0.00 H new ATOM 0 HB3 SER A 47 12.968 1.637 -10.859 1.00 0.00 H new ATOM 0 HG SER A 47 11.854 0.106 -12.022 1.00 0.00 H new ATOM 743 N VAL A 48 10.183 0.726 -7.784 1.00 0.00 N ATOM 744 CA VAL A 48 9.086 1.254 -6.905 1.00 0.00 C ATOM 745 C VAL A 48 9.552 1.253 -5.444 1.00 0.00 C ATOM 746 O VAL A 48 9.307 2.200 -4.725 1.00 0.00 O ATOM 747 CB VAL A 48 7.869 0.325 -7.088 1.00 0.00 C ATOM 748 CG1 VAL A 48 6.711 0.805 -6.206 1.00 0.00 C ATOM 749 CG2 VAL A 48 7.424 0.352 -8.552 1.00 0.00 C ATOM 0 H VAL A 48 10.031 -0.210 -8.159 1.00 0.00 H new ATOM 0 HA VAL A 48 8.823 2.278 -7.172 1.00 0.00 H new ATOM 0 HB VAL A 48 8.148 -0.689 -6.803 1.00 0.00 H new ATOM 0 HG11 VAL A 48 5.854 0.145 -6.340 1.00 0.00 H new ATOM 0 HG12 VAL A 48 7.020 0.792 -5.161 1.00 0.00 H new ATOM 0 HG13 VAL A 48 6.434 1.820 -6.490 1.00 0.00 H new ATOM 0 HG21 VAL A 48 6.564 -0.304 -8.683 1.00 0.00 H new ATOM 0 HG22 VAL A 48 7.150 1.370 -8.830 1.00 0.00 H new ATOM 0 HG23 VAL A 48 8.241 0.010 -9.187 1.00 0.00 H new ATOM 759 N VAL A 49 10.236 0.217 -4.998 1.00 0.00 N ATOM 760 CA VAL A 49 10.708 0.218 -3.566 1.00 0.00 C ATOM 761 C VAL A 49 11.787 1.300 -3.392 1.00 0.00 C ATOM 762 O VAL A 49 11.818 1.984 -2.385 1.00 0.00 O ATOM 763 CB VAL A 49 11.261 -1.194 -3.269 1.00 0.00 C ATOM 764 CG1 VAL A 49 11.969 -1.219 -1.907 1.00 0.00 C ATOM 765 CG2 VAL A 49 10.098 -2.188 -3.235 1.00 0.00 C ATOM 0 H VAL A 49 10.483 -0.608 -5.545 1.00 0.00 H new ATOM 0 HA VAL A 49 9.901 0.446 -2.869 1.00 0.00 H new ATOM 0 HB VAL A 49 11.974 -1.463 -4.048 1.00 0.00 H new ATOM 0 HG11 VAL A 49 12.352 -2.221 -1.714 1.00 0.00 H new ATOM 0 HG12 VAL A 49 12.796 -0.509 -1.914 1.00 0.00 H new ATOM 0 HG13 VAL A 49 11.262 -0.944 -1.124 1.00 0.00 H new ATOM 0 HG21 VAL A 49 10.480 -3.187 -3.026 1.00 0.00 H new ATOM 0 HG22 VAL A 49 9.394 -1.898 -2.455 1.00 0.00 H new ATOM 0 HG23 VAL A 49 9.591 -2.188 -4.200 1.00 0.00 H new ATOM 775 N ASP A 50 12.659 1.478 -4.365 1.00 0.00 N ATOM 776 CA ASP A 50 13.712 2.549 -4.228 1.00 0.00 C ATOM 777 C ASP A 50 13.041 3.920 -4.024 1.00 0.00 C ATOM 778 O ASP A 50 13.548 4.756 -3.300 1.00 0.00 O ATOM 779 CB ASP A 50 14.526 2.546 -5.533 1.00 0.00 C ATOM 780 CG ASP A 50 15.744 3.458 -5.377 1.00 0.00 C ATOM 781 OD1 ASP A 50 15.595 4.651 -5.581 1.00 0.00 O ATOM 782 OD2 ASP A 50 16.805 2.948 -5.057 1.00 0.00 O ATOM 0 H ASP A 50 12.689 0.941 -5.232 1.00 0.00 H new ATOM 0 HA ASP A 50 14.356 2.359 -3.369 1.00 0.00 H new ATOM 0 HB2 ASP A 50 14.846 1.532 -5.772 1.00 0.00 H new ATOM 0 HB3 ASP A 50 13.906 2.888 -6.362 1.00 0.00 H new ATOM 787 N GLU A 51 11.903 4.159 -4.650 1.00 0.00 N ATOM 788 CA GLU A 51 11.217 5.488 -4.467 1.00 0.00 C ATOM 789 C GLU A 51 10.722 5.631 -3.024 1.00 0.00 C ATOM 790 O GLU A 51 10.860 6.683 -2.425 1.00 0.00 O ATOM 791 CB GLU A 51 10.028 5.527 -5.445 1.00 0.00 C ATOM 792 CG GLU A 51 10.434 6.281 -6.712 1.00 0.00 C ATOM 793 CD GLU A 51 10.933 5.287 -7.763 1.00 0.00 C ATOM 794 OE1 GLU A 51 12.106 4.951 -7.722 1.00 0.00 O ATOM 795 OE2 GLU A 51 10.135 4.879 -8.590 1.00 0.00 O ATOM 0 H GLU A 51 11.427 3.503 -5.269 1.00 0.00 H new ATOM 0 HA GLU A 51 11.905 6.309 -4.666 1.00 0.00 H new ATOM 0 HB2 GLU A 51 9.717 4.513 -5.696 1.00 0.00 H new ATOM 0 HB3 GLU A 51 9.174 6.016 -4.976 1.00 0.00 H new ATOM 0 HG2 GLU A 51 9.584 6.842 -7.102 1.00 0.00 H new ATOM 0 HG3 GLU A 51 11.215 7.005 -6.482 1.00 0.00 H new ATOM 802 N LEU A 52 10.160 4.588 -2.448 1.00 0.00 N ATOM 803 CA LEU A 52 9.684 4.701 -1.026 1.00 0.00 C ATOM 804 C LEU A 52 10.899 4.796 -0.103 1.00 0.00 C ATOM 805 O LEU A 52 10.910 5.576 0.826 1.00 0.00 O ATOM 806 CB LEU A 52 8.871 3.430 -0.694 1.00 0.00 C ATOM 807 CG LEU A 52 7.421 3.534 -1.207 1.00 0.00 C ATOM 808 CD1 LEU A 52 6.749 4.813 -0.694 1.00 0.00 C ATOM 809 CD2 LEU A 52 7.418 3.529 -2.734 1.00 0.00 C ATOM 0 H LEU A 52 10.012 3.681 -2.890 1.00 0.00 H new ATOM 0 HA LEU A 52 9.064 5.587 -0.891 1.00 0.00 H new ATOM 0 HB2 LEU A 52 9.354 2.561 -1.141 1.00 0.00 H new ATOM 0 HB3 LEU A 52 8.866 3.272 0.384 1.00 0.00 H new ATOM 0 HG LEU A 52 6.860 2.677 -0.834 1.00 0.00 H new ATOM 0 HD11 LEU A 52 5.727 4.863 -1.070 1.00 0.00 H new ATOM 0 HD12 LEU A 52 6.735 4.805 0.396 1.00 0.00 H new ATOM 0 HD13 LEU A 52 7.307 5.682 -1.043 1.00 0.00 H new ATOM 0 HD21 LEU A 52 6.393 3.603 -3.096 1.00 0.00 H new ATOM 0 HD22 LEU A 52 7.994 4.378 -3.102 1.00 0.00 H new ATOM 0 HD23 LEU A 52 7.865 2.603 -3.096 1.00 0.00 H new ATOM 821 N ALA A 53 11.931 4.018 -0.354 1.00 0.00 N ATOM 822 CA ALA A 53 13.149 4.095 0.527 1.00 0.00 C ATOM 823 C ALA A 53 13.762 5.502 0.436 1.00 0.00 C ATOM 824 O ALA A 53 14.216 6.044 1.426 1.00 0.00 O ATOM 825 CB ALA A 53 14.146 3.046 0.009 1.00 0.00 C ATOM 0 H ALA A 53 11.984 3.343 -1.117 1.00 0.00 H new ATOM 0 HA ALA A 53 12.896 3.902 1.570 1.00 0.00 H new ATOM 0 HB1 ALA A 53 15.048 3.067 0.621 1.00 0.00 H new ATOM 0 HB2 ALA A 53 13.694 2.056 0.064 1.00 0.00 H new ATOM 0 HB3 ALA A 53 14.405 3.270 -1.026 1.00 0.00 H new ATOM 831 N SER A 54 13.776 6.103 -0.738 1.00 0.00 N ATOM 832 CA SER A 54 14.363 7.489 -0.861 1.00 0.00 C ATOM 833 C SER A 54 13.640 8.466 0.083 1.00 0.00 C ATOM 834 O SER A 54 14.248 9.379 0.612 1.00 0.00 O ATOM 835 CB SER A 54 14.169 7.925 -2.321 1.00 0.00 C ATOM 836 OG SER A 54 14.847 7.014 -3.177 1.00 0.00 O ATOM 0 H SER A 54 13.413 5.704 -1.604 1.00 0.00 H new ATOM 0 HA SER A 54 15.418 7.488 -0.587 1.00 0.00 H new ATOM 0 HB2 SER A 54 13.107 7.952 -2.567 1.00 0.00 H new ATOM 0 HB3 SER A 54 14.555 8.934 -2.466 1.00 0.00 H new ATOM 0 HG SER A 54 14.259 6.257 -3.380 1.00 0.00 H new ATOM 842 N LEU A 55 12.353 8.288 0.305 1.00 0.00 N ATOM 843 CA LEU A 55 11.615 9.220 1.224 1.00 0.00 C ATOM 844 C LEU A 55 11.455 8.584 2.613 1.00 0.00 C ATOM 845 O LEU A 55 11.650 9.236 3.623 1.00 0.00 O ATOM 846 CB LEU A 55 10.242 9.448 0.579 1.00 0.00 C ATOM 847 CG LEU A 55 10.295 10.686 -0.315 1.00 0.00 C ATOM 848 CD1 LEU A 55 10.846 10.302 -1.689 1.00 0.00 C ATOM 849 CD2 LEU A 55 8.884 11.258 -0.475 1.00 0.00 C ATOM 0 H LEU A 55 11.788 7.545 -0.106 1.00 0.00 H new ATOM 0 HA LEU A 55 12.153 10.158 1.359 1.00 0.00 H new ATOM 0 HB2 LEU A 55 9.955 8.575 -0.008 1.00 0.00 H new ATOM 0 HB3 LEU A 55 9.483 9.577 1.351 1.00 0.00 H new ATOM 0 HG LEU A 55 10.944 11.435 0.140 1.00 0.00 H new ATOM 0 HD11 LEU A 55 10.883 11.186 -2.326 1.00 0.00 H new ATOM 0 HD12 LEU A 55 11.850 9.893 -1.577 1.00 0.00 H new ATOM 0 HD13 LEU A 55 10.198 9.553 -2.145 1.00 0.00 H new ATOM 0 HD21 LEU A 55 8.920 12.141 -1.113 1.00 0.00 H new ATOM 0 HD22 LEU A 55 8.237 10.508 -0.930 1.00 0.00 H new ATOM 0 HD23 LEU A 55 8.490 11.532 0.503 1.00 0.00 H new ATOM 861 N PHE A 56 11.110 7.317 2.674 1.00 0.00 N ATOM 862 CA PHE A 56 10.947 6.642 3.999 1.00 0.00 C ATOM 863 C PHE A 56 12.145 5.712 4.247 1.00 0.00 C ATOM 864 O PHE A 56 12.037 4.508 4.110 1.00 0.00 O ATOM 865 CB PHE A 56 9.645 5.826 3.905 1.00 0.00 C ATOM 866 CG PHE A 56 8.500 6.721 3.485 1.00 0.00 C ATOM 867 CD1 PHE A 56 7.969 7.653 4.385 1.00 0.00 C ATOM 868 CD2 PHE A 56 7.977 6.621 2.190 1.00 0.00 C ATOM 869 CE1 PHE A 56 6.913 8.483 3.990 1.00 0.00 C ATOM 870 CE2 PHE A 56 6.923 7.452 1.796 1.00 0.00 C ATOM 871 CZ PHE A 56 6.390 8.382 2.695 1.00 0.00 C ATOM 0 H PHE A 56 10.935 6.724 1.863 1.00 0.00 H new ATOM 0 HA PHE A 56 10.902 7.357 4.820 1.00 0.00 H new ATOM 0 HB2 PHE A 56 9.766 5.015 3.186 1.00 0.00 H new ATOM 0 HB3 PHE A 56 9.424 5.367 4.869 1.00 0.00 H new ATOM 0 HD1 PHE A 56 8.374 7.732 5.383 1.00 0.00 H new ATOM 0 HD2 PHE A 56 8.387 5.903 1.496 1.00 0.00 H new ATOM 0 HE1 PHE A 56 6.502 9.201 4.684 1.00 0.00 H new ATOM 0 HE2 PHE A 56 6.520 7.376 0.797 1.00 0.00 H new ATOM 0 HZ PHE A 56 5.575 9.022 2.390 1.00 0.00 H new ATOM 881 N ASP A 57 13.286 6.259 4.618 1.00 0.00 N ATOM 882 CA ASP A 57 14.482 5.388 4.877 1.00 0.00 C ATOM 883 C ASP A 57 14.679 5.150 6.390 1.00 0.00 C ATOM 884 O ASP A 57 15.788 4.923 6.837 1.00 0.00 O ATOM 885 CB ASP A 57 15.692 6.131 4.273 1.00 0.00 C ATOM 886 CG ASP A 57 15.961 7.437 5.034 1.00 0.00 C ATOM 887 OD1 ASP A 57 15.348 8.435 4.694 1.00 0.00 O ATOM 888 OD2 ASP A 57 16.775 7.413 5.943 1.00 0.00 O ATOM 0 H ASP A 57 13.438 7.259 4.751 1.00 0.00 H new ATOM 0 HA ASP A 57 14.357 4.404 4.426 1.00 0.00 H new ATOM 0 HB2 ASP A 57 16.574 5.492 4.313 1.00 0.00 H new ATOM 0 HB3 ASP A 57 15.504 6.349 3.222 1.00 0.00 H new ATOM 893 N SER A 58 13.622 5.184 7.180 1.00 0.00 N ATOM 894 CA SER A 58 13.783 4.942 8.654 1.00 0.00 C ATOM 895 C SER A 58 13.433 3.483 8.999 1.00 0.00 C ATOM 896 O SER A 58 14.073 2.874 9.835 1.00 0.00 O ATOM 897 CB SER A 58 12.813 5.906 9.349 1.00 0.00 C ATOM 898 OG SER A 58 13.395 7.201 9.404 1.00 0.00 O ATOM 0 H SER A 58 12.668 5.367 6.870 1.00 0.00 H new ATOM 0 HA SER A 58 14.810 5.110 8.977 1.00 0.00 H new ATOM 0 HB2 SER A 58 11.868 5.942 8.807 1.00 0.00 H new ATOM 0 HB3 SER A 58 12.590 5.552 10.356 1.00 0.00 H new ATOM 0 HG SER A 58 12.776 7.819 9.846 1.00 0.00 H new ATOM 904 N VAL A 59 12.430 2.914 8.361 1.00 0.00 N ATOM 905 CA VAL A 59 12.060 1.488 8.664 1.00 0.00 C ATOM 906 C VAL A 59 12.840 0.526 7.751 1.00 0.00 C ATOM 907 O VAL A 59 13.282 0.902 6.681 1.00 0.00 O ATOM 908 CB VAL A 59 10.540 1.371 8.431 1.00 0.00 C ATOM 909 CG1 VAL A 59 10.201 1.575 6.942 1.00 0.00 C ATOM 910 CG2 VAL A 59 10.070 -0.016 8.881 1.00 0.00 C ATOM 0 H VAL A 59 11.857 3.370 7.651 1.00 0.00 H new ATOM 0 HA VAL A 59 12.312 1.220 9.690 1.00 0.00 H new ATOM 0 HB VAL A 59 10.032 2.143 9.009 1.00 0.00 H new ATOM 0 HG11 VAL A 59 9.124 1.489 6.799 1.00 0.00 H new ATOM 0 HG12 VAL A 59 10.531 2.565 6.626 1.00 0.00 H new ATOM 0 HG13 VAL A 59 10.708 0.816 6.346 1.00 0.00 H new ATOM 0 HG21 VAL A 59 8.996 -0.106 8.719 1.00 0.00 H new ATOM 0 HG22 VAL A 59 10.589 -0.781 8.304 1.00 0.00 H new ATOM 0 HG23 VAL A 59 10.290 -0.149 9.940 1.00 0.00 H new ATOM 920 N SER A 60 13.018 -0.711 8.170 1.00 0.00 N ATOM 921 CA SER A 60 13.785 -1.694 7.316 1.00 0.00 C ATOM 922 C SER A 60 13.187 -1.775 5.898 1.00 0.00 C ATOM 923 O SER A 60 11.987 -1.693 5.722 1.00 0.00 O ATOM 924 CB SER A 60 13.671 -3.060 8.008 1.00 0.00 C ATOM 925 OG SER A 60 13.343 -2.866 9.378 1.00 0.00 O ATOM 0 H SER A 60 12.671 -1.082 9.055 1.00 0.00 H new ATOM 0 HA SER A 60 14.824 -1.381 7.214 1.00 0.00 H new ATOM 0 HB2 SER A 60 12.906 -3.665 7.521 1.00 0.00 H new ATOM 0 HB3 SER A 60 14.611 -3.605 7.921 1.00 0.00 H new ATOM 0 HG SER A 60 12.371 -2.915 9.492 1.00 0.00 H new ATOM 931 N ARG A 61 14.018 -1.945 4.885 1.00 0.00 N ATOM 932 CA ARG A 61 13.488 -2.038 3.472 1.00 0.00 C ATOM 933 C ARG A 61 12.391 -3.113 3.367 1.00 0.00 C ATOM 934 O ARG A 61 11.460 -2.972 2.596 1.00 0.00 O ATOM 935 CB ARG A 61 14.679 -2.424 2.581 1.00 0.00 C ATOM 936 CG ARG A 61 15.489 -1.171 2.237 1.00 0.00 C ATOM 937 CD ARG A 61 15.996 -1.265 0.796 1.00 0.00 C ATOM 938 NE ARG A 61 17.370 -1.827 0.907 1.00 0.00 N ATOM 939 CZ ARG A 61 18.382 -1.183 0.394 1.00 0.00 C ATOM 940 NH1 ARG A 61 19.015 -0.289 1.104 1.00 0.00 N ATOM 941 NH2 ARG A 61 18.761 -1.433 -0.830 1.00 0.00 N ATOM 0 H ARG A 61 15.031 -2.023 4.973 1.00 0.00 H new ATOM 0 HA ARG A 61 13.047 -1.089 3.166 1.00 0.00 H new ATOM 0 HB2 ARG A 61 15.311 -3.148 3.095 1.00 0.00 H new ATOM 0 HB3 ARG A 61 14.324 -2.902 1.668 1.00 0.00 H new ATOM 0 HG2 ARG A 61 14.870 -0.282 2.358 1.00 0.00 H new ATOM 0 HG3 ARG A 61 16.330 -1.070 2.923 1.00 0.00 H new ATOM 0 HD2 ARG A 61 15.354 -1.907 0.193 1.00 0.00 H new ATOM 0 HD3 ARG A 61 16.008 -0.286 0.317 1.00 0.00 H new ATOM 0 HE ARG A 61 17.520 -2.716 1.384 1.00 0.00 H new ATOM 0 HH11 ARG A 61 18.718 -0.094 2.060 1.00 0.00 H new ATOM 0 HH12 ARG A 61 19.806 0.214 0.703 1.00 0.00 H new ATOM 0 HH21 ARG A 61 18.266 -2.131 -1.385 1.00 0.00 H new ATOM 0 HH22 ARG A 61 19.552 -0.930 -1.232 1.00 0.00 H new ATOM 955 N ASP A 62 12.490 -4.185 4.128 1.00 0.00 N ATOM 956 CA ASP A 62 11.433 -5.260 4.048 1.00 0.00 C ATOM 957 C ASP A 62 10.040 -4.670 4.321 1.00 0.00 C ATOM 958 O ASP A 62 9.067 -5.074 3.712 1.00 0.00 O ATOM 959 CB ASP A 62 11.781 -6.308 5.118 1.00 0.00 C ATOM 960 CG ASP A 62 11.199 -7.663 4.714 1.00 0.00 C ATOM 961 OD1 ASP A 62 10.065 -7.688 4.265 1.00 0.00 O ATOM 962 OD2 ASP A 62 11.896 -8.653 4.863 1.00 0.00 O ATOM 0 H ASP A 62 13.244 -4.363 4.792 1.00 0.00 H new ATOM 0 HA ASP A 62 11.411 -5.705 3.053 1.00 0.00 H new ATOM 0 HB2 ASP A 62 12.863 -6.384 5.230 1.00 0.00 H new ATOM 0 HB3 ASP A 62 11.381 -6.002 6.085 1.00 0.00 H new ATOM 967 N THR A 63 9.932 -3.717 5.224 1.00 0.00 N ATOM 968 CA THR A 63 8.579 -3.115 5.507 1.00 0.00 C ATOM 969 C THR A 63 8.100 -2.333 4.276 1.00 0.00 C ATOM 970 O THR A 63 6.948 -2.425 3.892 1.00 0.00 O ATOM 971 CB THR A 63 8.749 -2.176 6.717 1.00 0.00 C ATOM 972 OG1 THR A 63 9.165 -2.935 7.848 1.00 0.00 O ATOM 973 CG2 THR A 63 7.417 -1.489 7.033 1.00 0.00 C ATOM 0 H THR A 63 10.705 -3.335 5.769 1.00 0.00 H new ATOM 0 HA THR A 63 7.837 -3.883 5.725 1.00 0.00 H new ATOM 0 HB THR A 63 9.498 -1.420 6.482 1.00 0.00 H new ATOM 0 HG1 THR A 63 8.832 -2.512 8.667 1.00 0.00 H new ATOM 0 HG21 THR A 63 7.543 -0.827 7.889 1.00 0.00 H new ATOM 0 HG22 THR A 63 7.093 -0.908 6.169 1.00 0.00 H new ATOM 0 HG23 THR A 63 6.665 -2.243 7.266 1.00 0.00 H new ATOM 981 N LEU A 64 8.973 -1.578 3.645 1.00 0.00 N ATOM 982 CA LEU A 64 8.541 -0.810 2.425 1.00 0.00 C ATOM 983 C LEU A 64 8.246 -1.800 1.293 1.00 0.00 C ATOM 984 O LEU A 64 7.252 -1.680 0.602 1.00 0.00 O ATOM 985 CB LEU A 64 9.708 0.116 2.032 1.00 0.00 C ATOM 986 CG LEU A 64 10.082 1.027 3.218 1.00 0.00 C ATOM 987 CD1 LEU A 64 11.529 0.763 3.641 1.00 0.00 C ATOM 988 CD2 LEU A 64 9.945 2.497 2.806 1.00 0.00 C ATOM 0 H LEU A 64 9.950 -1.460 3.915 1.00 0.00 H new ATOM 0 HA LEU A 64 7.642 -0.224 2.618 1.00 0.00 H new ATOM 0 HB2 LEU A 64 10.571 -0.480 1.734 1.00 0.00 H new ATOM 0 HB3 LEU A 64 9.427 0.723 1.171 1.00 0.00 H new ATOM 0 HG LEU A 64 9.412 0.813 4.050 1.00 0.00 H new ATOM 0 HD11 LEU A 64 11.787 1.410 4.479 1.00 0.00 H new ATOM 0 HD12 LEU A 64 11.636 -0.279 3.941 1.00 0.00 H new ATOM 0 HD13 LEU A 64 12.196 0.970 2.804 1.00 0.00 H new ATOM 0 HD21 LEU A 64 10.210 3.137 3.648 1.00 0.00 H new ATOM 0 HD22 LEU A 64 10.611 2.704 1.969 1.00 0.00 H new ATOM 0 HD23 LEU A 64 8.916 2.697 2.509 1.00 0.00 H new ATOM 1000 N ALA A 65 9.094 -2.791 1.108 1.00 0.00 N ATOM 1001 CA ALA A 65 8.834 -3.799 0.020 1.00 0.00 C ATOM 1002 C ALA A 65 7.503 -4.524 0.281 1.00 0.00 C ATOM 1003 O ALA A 65 6.784 -4.848 -0.646 1.00 0.00 O ATOM 1004 CB ALA A 65 9.998 -4.802 0.057 1.00 0.00 C ATOM 0 H ALA A 65 9.942 -2.945 1.653 1.00 0.00 H new ATOM 0 HA ALA A 65 8.765 -3.316 -0.955 1.00 0.00 H new ATOM 0 HB1 ALA A 65 9.854 -5.556 -0.717 1.00 0.00 H new ATOM 0 HB2 ALA A 65 10.937 -4.277 -0.119 1.00 0.00 H new ATOM 0 HB3 ALA A 65 10.030 -5.286 1.033 1.00 0.00 H new ATOM 1010 N ASN A 66 7.165 -4.783 1.530 1.00 0.00 N ATOM 1011 CA ASN A 66 5.866 -5.493 1.819 1.00 0.00 C ATOM 1012 C ASN A 66 4.682 -4.677 1.278 1.00 0.00 C ATOM 1013 O ASN A 66 3.738 -5.236 0.751 1.00 0.00 O ATOM 1014 CB ASN A 66 5.761 -5.626 3.347 1.00 0.00 C ATOM 1015 CG ASN A 66 4.942 -6.876 3.696 1.00 0.00 C ATOM 1016 OD1 ASN A 66 3.851 -7.055 3.191 1.00 0.00 O ATOM 1017 ND2 ASN A 66 5.419 -7.757 4.541 1.00 0.00 N ATOM 0 H ASN A 66 7.721 -4.539 2.349 1.00 0.00 H new ATOM 0 HA ASN A 66 5.842 -6.471 1.338 1.00 0.00 H new ATOM 0 HB2 ASN A 66 6.756 -5.696 3.786 1.00 0.00 H new ATOM 0 HB3 ASN A 66 5.288 -4.739 3.768 1.00 0.00 H new ATOM 0 HD21 ASN A 66 4.875 -8.588 4.772 1.00 0.00 H new ATOM 0 HD22 ASN A 66 6.334 -7.611 4.967 1.00 0.00 H new ATOM 1024 N VAL A 67 4.717 -3.361 1.396 1.00 0.00 N ATOM 1025 CA VAL A 67 3.567 -2.544 0.866 1.00 0.00 C ATOM 1026 C VAL A 67 3.592 -2.544 -0.673 1.00 0.00 C ATOM 1027 O VAL A 67 2.555 -2.589 -1.307 1.00 0.00 O ATOM 1028 CB VAL A 67 3.735 -1.120 1.421 1.00 0.00 C ATOM 1029 CG1 VAL A 67 2.570 -0.250 0.948 1.00 0.00 C ATOM 1030 CG2 VAL A 67 3.743 -1.169 2.953 1.00 0.00 C ATOM 0 H VAL A 67 5.474 -2.829 1.826 1.00 0.00 H new ATOM 0 HA VAL A 67 2.608 -2.959 1.176 1.00 0.00 H new ATOM 0 HB VAL A 67 4.674 -0.698 1.064 1.00 0.00 H new ATOM 0 HG11 VAL A 67 2.687 0.760 1.341 1.00 0.00 H new ATOM 0 HG12 VAL A 67 2.559 -0.217 -0.141 1.00 0.00 H new ATOM 0 HG13 VAL A 67 1.631 -0.672 1.307 1.00 0.00 H new ATOM 0 HG21 VAL A 67 3.862 -0.160 3.349 1.00 0.00 H new ATOM 0 HG22 VAL A 67 2.802 -1.590 3.308 1.00 0.00 H new ATOM 0 HG23 VAL A 67 4.570 -1.792 3.293 1.00 0.00 H new ATOM 1040 N VAL A 68 4.760 -2.518 -1.286 1.00 0.00 N ATOM 1041 CA VAL A 68 4.802 -2.555 -2.792 1.00 0.00 C ATOM 1042 C VAL A 68 4.384 -3.957 -3.274 1.00 0.00 C ATOM 1043 O VAL A 68 3.744 -4.092 -4.300 1.00 0.00 O ATOM 1044 CB VAL A 68 6.252 -2.252 -3.207 1.00 0.00 C ATOM 1045 CG1 VAL A 68 6.358 -2.249 -4.735 1.00 0.00 C ATOM 1046 CG2 VAL A 68 6.657 -0.877 -2.669 1.00 0.00 C ATOM 0 H VAL A 68 5.667 -2.474 -0.821 1.00 0.00 H new ATOM 0 HA VAL A 68 4.121 -1.826 -3.233 1.00 0.00 H new ATOM 0 HB VAL A 68 6.913 -3.016 -2.798 1.00 0.00 H new ATOM 0 HG11 VAL A 68 7.386 -2.034 -5.028 1.00 0.00 H new ATOM 0 HG12 VAL A 68 6.067 -3.226 -5.122 1.00 0.00 H new ATOM 0 HG13 VAL A 68 5.697 -1.485 -5.144 1.00 0.00 H new ATOM 0 HG21 VAL A 68 7.684 -0.660 -2.962 1.00 0.00 H new ATOM 0 HG22 VAL A 68 5.994 -0.116 -3.080 1.00 0.00 H new ATOM 0 HG23 VAL A 68 6.582 -0.875 -1.582 1.00 0.00 H new ATOM 1056 N GLN A 69 4.731 -5.006 -2.542 1.00 0.00 N ATOM 1057 CA GLN A 69 4.327 -6.387 -2.985 1.00 0.00 C ATOM 1058 C GLN A 69 2.797 -6.517 -2.977 1.00 0.00 C ATOM 1059 O GLN A 69 2.224 -7.111 -3.872 1.00 0.00 O ATOM 1060 CB GLN A 69 4.948 -7.378 -1.986 1.00 0.00 C ATOM 1061 CG GLN A 69 6.423 -7.592 -2.330 1.00 0.00 C ATOM 1062 CD GLN A 69 6.883 -8.951 -1.787 1.00 0.00 C ATOM 1063 OE1 GLN A 69 7.569 -9.013 -0.786 1.00 0.00 O ATOM 1064 NE2 GLN A 69 6.534 -10.054 -2.404 1.00 0.00 N ATOM 0 H GLN A 69 5.266 -4.964 -1.675 1.00 0.00 H new ATOM 0 HA GLN A 69 4.673 -6.588 -3.999 1.00 0.00 H new ATOM 0 HB2 GLN A 69 4.852 -6.995 -0.970 1.00 0.00 H new ATOM 0 HB3 GLN A 69 4.414 -8.328 -2.020 1.00 0.00 H new ATOM 0 HG2 GLN A 69 6.565 -7.553 -3.410 1.00 0.00 H new ATOM 0 HG3 GLN A 69 7.027 -6.793 -1.900 1.00 0.00 H new ATOM 0 HE21 GLN A 69 5.958 -10.008 -3.245 1.00 0.00 H new ATOM 0 HE22 GLN A 69 6.838 -10.958 -2.043 1.00 0.00 H new ATOM 1073 N THR A 70 2.126 -5.965 -1.985 1.00 0.00 N ATOM 1074 CA THR A 70 0.621 -6.073 -1.966 1.00 0.00 C ATOM 1075 C THR A 70 0.005 -5.229 -3.098 1.00 0.00 C ATOM 1076 O THR A 70 -1.035 -5.579 -3.625 1.00 0.00 O ATOM 1077 CB THR A 70 0.134 -5.597 -0.581 1.00 0.00 C ATOM 1078 OG1 THR A 70 -1.277 -5.736 -0.510 1.00 0.00 O ATOM 1079 CG2 THR A 70 0.509 -4.133 -0.348 1.00 0.00 C ATOM 0 H THR A 70 2.541 -5.456 -1.205 1.00 0.00 H new ATOM 0 HA THR A 70 0.308 -7.104 -2.133 1.00 0.00 H new ATOM 0 HB THR A 70 0.612 -6.206 0.186 1.00 0.00 H new ATOM 0 HG1 THR A 70 -1.591 -5.436 0.369 1.00 0.00 H new ATOM 0 HG21 THR A 70 0.156 -3.819 0.634 1.00 0.00 H new ATOM 0 HG22 THR A 70 1.592 -4.023 -0.396 1.00 0.00 H new ATOM 0 HG23 THR A 70 0.046 -3.512 -1.115 1.00 0.00 H new ATOM 1087 N ALA A 71 0.640 -4.142 -3.504 1.00 0.00 N ATOM 1088 CA ALA A 71 0.063 -3.330 -4.636 1.00 0.00 C ATOM 1089 C ALA A 71 0.217 -4.112 -5.953 1.00 0.00 C ATOM 1090 O ALA A 71 -0.637 -4.039 -6.818 1.00 0.00 O ATOM 1091 CB ALA A 71 0.857 -2.014 -4.706 1.00 0.00 C ATOM 0 H ALA A 71 1.512 -3.790 -3.110 1.00 0.00 H new ATOM 0 HA ALA A 71 -0.996 -3.127 -4.477 1.00 0.00 H new ATOM 0 HB1 ALA A 71 0.468 -1.397 -5.516 1.00 0.00 H new ATOM 0 HB2 ALA A 71 0.758 -1.478 -3.762 1.00 0.00 H new ATOM 0 HB3 ALA A 71 1.909 -2.233 -4.890 1.00 0.00 H new ATOM 1097 N PHE A 72 1.286 -4.876 -6.111 1.00 0.00 N ATOM 1098 CA PHE A 72 1.452 -5.670 -7.380 1.00 0.00 C ATOM 1099 C PHE A 72 0.373 -6.758 -7.418 1.00 0.00 C ATOM 1100 O PHE A 72 -0.342 -6.893 -8.393 1.00 0.00 O ATOM 1101 CB PHE A 72 2.849 -6.312 -7.329 1.00 0.00 C ATOM 1102 CG PHE A 72 3.893 -5.338 -7.829 1.00 0.00 C ATOM 1103 CD1 PHE A 72 3.971 -4.043 -7.295 1.00 0.00 C ATOM 1104 CD2 PHE A 72 4.796 -5.737 -8.822 1.00 0.00 C ATOM 1105 CE1 PHE A 72 4.946 -3.154 -7.756 1.00 0.00 C ATOM 1106 CE2 PHE A 72 5.772 -4.844 -9.280 1.00 0.00 C ATOM 1107 CZ PHE A 72 5.846 -3.553 -8.747 1.00 0.00 C ATOM 0 H PHE A 72 2.036 -4.981 -5.428 1.00 0.00 H new ATOM 0 HA PHE A 72 1.354 -5.044 -8.267 1.00 0.00 H new ATOM 0 HB2 PHE A 72 3.082 -6.612 -6.307 1.00 0.00 H new ATOM 0 HB3 PHE A 72 2.864 -7.216 -7.938 1.00 0.00 H new ATOM 0 HD1 PHE A 72 3.277 -3.733 -6.527 1.00 0.00 H new ATOM 0 HD2 PHE A 72 4.740 -6.734 -9.235 1.00 0.00 H new ATOM 0 HE1 PHE A 72 5.004 -2.157 -7.345 1.00 0.00 H new ATOM 0 HE2 PHE A 72 6.469 -5.152 -10.046 1.00 0.00 H new ATOM 0 HZ PHE A 72 6.599 -2.865 -9.102 1.00 0.00 H new ATOM 1117 N PHE A 73 0.231 -7.522 -6.350 1.00 0.00 N ATOM 1118 CA PHE A 73 -0.835 -8.586 -6.332 1.00 0.00 C ATOM 1119 C PHE A 73 -2.211 -7.922 -6.496 1.00 0.00 C ATOM 1120 O PHE A 73 -3.065 -8.427 -7.200 1.00 0.00 O ATOM 1121 CB PHE A 73 -0.742 -9.291 -4.970 1.00 0.00 C ATOM 1122 CG PHE A 73 0.239 -10.435 -5.059 1.00 0.00 C ATOM 1123 CD1 PHE A 73 -0.084 -11.576 -5.804 1.00 0.00 C ATOM 1124 CD2 PHE A 73 1.471 -10.356 -4.398 1.00 0.00 C ATOM 1125 CE1 PHE A 73 0.825 -12.638 -5.889 1.00 0.00 C ATOM 1126 CE2 PHE A 73 2.380 -11.417 -4.483 1.00 0.00 C ATOM 1127 CZ PHE A 73 2.057 -12.557 -5.228 1.00 0.00 C ATOM 0 H PHE A 73 0.797 -7.456 -5.504 1.00 0.00 H new ATOM 0 HA PHE A 73 -0.701 -9.303 -7.142 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -0.423 -8.584 -4.204 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -1.723 -9.662 -4.673 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -1.034 -11.637 -6.313 1.00 0.00 H new ATOM 0 HD2 PHE A 73 1.720 -9.477 -3.823 1.00 0.00 H new ATOM 0 HE1 PHE A 73 0.576 -13.518 -6.463 1.00 0.00 H new ATOM 0 HE2 PHE A 73 3.330 -11.356 -3.974 1.00 0.00 H new ATOM 0 HZ PHE A 73 2.759 -13.375 -5.293 1.00 0.00 H new ATOM 1137 N ALA A 74 -2.429 -6.781 -5.863 1.00 0.00 N ATOM 1138 CA ALA A 74 -3.760 -6.088 -6.011 1.00 0.00 C ATOM 1139 C ALA A 74 -4.036 -5.800 -7.495 1.00 0.00 C ATOM 1140 O ALA A 74 -5.157 -5.926 -7.953 1.00 0.00 O ATOM 1141 CB ALA A 74 -3.667 -4.769 -5.225 1.00 0.00 C ATOM 0 H ALA A 74 -1.755 -6.308 -5.261 1.00 0.00 H new ATOM 0 HA ALA A 74 -4.571 -6.710 -5.632 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -4.612 -4.231 -5.304 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -3.458 -4.984 -4.177 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -2.865 -4.156 -5.636 1.00 0.00 H new ATOM 1147 N LEU A 75 -3.025 -5.424 -8.259 1.00 0.00 N ATOM 1148 CA LEU A 75 -3.260 -5.144 -9.726 1.00 0.00 C ATOM 1149 C LEU A 75 -3.915 -6.365 -10.393 1.00 0.00 C ATOM 1150 O LEU A 75 -4.795 -6.224 -11.222 1.00 0.00 O ATOM 1151 CB LEU A 75 -1.883 -4.864 -10.372 1.00 0.00 C ATOM 1152 CG LEU A 75 -1.711 -3.360 -10.635 1.00 0.00 C ATOM 1153 CD1 LEU A 75 -2.823 -2.854 -11.569 1.00 0.00 C ATOM 1154 CD2 LEU A 75 -1.758 -2.596 -9.306 1.00 0.00 C ATOM 0 H LEU A 75 -2.064 -5.300 -7.939 1.00 0.00 H new ATOM 0 HA LEU A 75 -3.924 -4.289 -9.853 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -1.088 -5.218 -9.716 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -1.794 -5.416 -11.308 1.00 0.00 H new ATOM 0 HG LEU A 75 -0.747 -3.191 -11.114 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -2.690 -1.787 -11.748 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -2.774 -3.390 -12.517 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -3.794 -3.026 -11.105 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -1.636 -1.529 -9.495 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -2.718 -2.771 -8.820 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -0.954 -2.944 -8.658 1.00 0.00 H new ATOM 1166 N GLU A 76 -3.502 -7.563 -10.031 1.00 0.00 N ATOM 1167 CA GLU A 76 -4.130 -8.784 -10.650 1.00 0.00 C ATOM 1168 C GLU A 76 -5.590 -8.900 -10.187 1.00 0.00 C ATOM 1169 O GLU A 76 -6.465 -9.224 -10.969 1.00 0.00 O ATOM 1170 CB GLU A 76 -3.319 -9.997 -10.167 1.00 0.00 C ATOM 1171 CG GLU A 76 -3.659 -11.214 -11.030 1.00 0.00 C ATOM 1172 CD GLU A 76 -2.978 -12.456 -10.454 1.00 0.00 C ATOM 1173 OE1 GLU A 76 -1.850 -12.720 -10.835 1.00 0.00 O ATOM 1174 OE2 GLU A 76 -3.596 -13.123 -9.639 1.00 0.00 O ATOM 0 H GLU A 76 -2.770 -7.747 -9.345 1.00 0.00 H new ATOM 0 HA GLU A 76 -4.124 -8.727 -11.738 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -2.252 -9.782 -10.227 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -3.544 -10.205 -9.121 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -4.739 -11.360 -11.061 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -3.330 -11.049 -12.056 1.00 0.00 H new ATOM 1181 N ALA A 77 -5.864 -8.627 -8.928 1.00 0.00 N ATOM 1182 CA ALA A 77 -7.287 -8.716 -8.440 1.00 0.00 C ATOM 1183 C ALA A 77 -8.134 -7.638 -9.129 1.00 0.00 C ATOM 1184 O ALA A 77 -9.249 -7.894 -9.541 1.00 0.00 O ATOM 1185 CB ALA A 77 -7.256 -8.481 -6.921 1.00 0.00 C ATOM 0 H ALA A 77 -5.177 -8.351 -8.226 1.00 0.00 H new ATOM 0 HA ALA A 77 -7.725 -9.688 -8.669 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -8.269 -8.537 -6.523 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -6.638 -9.244 -6.447 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -6.839 -7.496 -6.714 1.00 0.00 H new ATOM 1191 N LEU A 78 -7.611 -6.436 -9.271 1.00 0.00 N ATOM 1192 CA LEU A 78 -8.410 -5.357 -9.957 1.00 0.00 C ATOM 1193 C LEU A 78 -8.643 -5.749 -11.425 1.00 0.00 C ATOM 1194 O LEU A 78 -9.717 -5.544 -11.959 1.00 0.00 O ATOM 1195 CB LEU A 78 -7.586 -4.051 -9.881 1.00 0.00 C ATOM 1196 CG LEU A 78 -8.154 -3.126 -8.794 1.00 0.00 C ATOM 1197 CD1 LEU A 78 -9.604 -2.761 -9.128 1.00 0.00 C ATOM 1198 CD2 LEU A 78 -8.103 -3.828 -7.431 1.00 0.00 C ATOM 0 H LEU A 78 -6.684 -6.158 -8.949 1.00 0.00 H new ATOM 0 HA LEU A 78 -9.380 -5.223 -9.477 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -6.543 -4.283 -9.663 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -7.605 -3.544 -10.846 1.00 0.00 H new ATOM 0 HG LEU A 78 -7.553 -2.218 -8.753 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -10.002 -2.105 -8.354 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -9.638 -2.249 -10.090 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -10.205 -3.669 -9.178 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -8.507 -3.166 -6.665 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -8.696 -4.742 -7.470 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -7.070 -4.076 -7.188 1.00 0.00 H new ATOM 1210 N GLN A 79 -7.651 -6.316 -12.082 1.00 0.00 N ATOM 1211 CA GLN A 79 -7.846 -6.721 -13.524 1.00 0.00 C ATOM 1212 C GLN A 79 -8.971 -7.768 -13.650 1.00 0.00 C ATOM 1213 O GLN A 79 -9.637 -7.832 -14.667 1.00 0.00 O ATOM 1214 CB GLN A 79 -6.513 -7.320 -14.011 1.00 0.00 C ATOM 1215 CG GLN A 79 -6.258 -6.894 -15.459 1.00 0.00 C ATOM 1216 CD GLN A 79 -4.761 -6.623 -15.662 1.00 0.00 C ATOM 1217 OE1 GLN A 79 -4.140 -7.216 -16.521 1.00 0.00 O ATOM 1218 NE2 GLN A 79 -4.145 -5.748 -14.902 1.00 0.00 N ATOM 0 H GLN A 79 -6.729 -6.514 -11.693 1.00 0.00 H new ATOM 0 HA GLN A 79 -8.132 -5.858 -14.125 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -5.696 -6.983 -13.373 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -6.544 -8.407 -13.941 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -6.592 -7.675 -16.142 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -6.834 -5.999 -15.692 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -4.662 -5.247 -14.179 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -3.150 -5.569 -15.034 1.00 0.00 H new ATOM 1227 N GLN A 80 -9.195 -8.588 -12.638 1.00 0.00 N ATOM 1228 CA GLN A 80 -10.288 -9.615 -12.741 1.00 0.00 C ATOM 1229 C GLN A 80 -11.590 -9.074 -12.135 1.00 0.00 C ATOM 1230 O GLN A 80 -12.652 -9.230 -12.710 1.00 0.00 O ATOM 1231 CB GLN A 80 -9.800 -10.843 -11.959 1.00 0.00 C ATOM 1232 CG GLN A 80 -9.039 -11.780 -12.900 1.00 0.00 C ATOM 1233 CD GLN A 80 -7.576 -11.332 -12.995 1.00 0.00 C ATOM 1234 OE1 GLN A 80 -6.835 -11.444 -12.039 1.00 0.00 O ATOM 1235 NE2 GLN A 80 -7.119 -10.824 -14.114 1.00 0.00 N ATOM 0 H GLN A 80 -8.676 -8.589 -11.760 1.00 0.00 H new ATOM 0 HA GLN A 80 -10.498 -9.867 -13.780 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -9.154 -10.531 -11.138 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -10.648 -11.366 -11.516 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -9.093 -12.805 -12.532 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -9.498 -11.771 -13.889 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -7.737 -10.728 -14.920 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -6.146 -10.525 -14.179 1.00 0.00 H new ATOM 1244 N GLY A 81 -11.524 -8.437 -10.986 1.00 0.00 N ATOM 1245 CA GLY A 81 -12.766 -7.891 -10.362 1.00 0.00 C ATOM 1246 C GLY A 81 -12.713 -8.074 -8.838 1.00 0.00 C ATOM 1247 O GLY A 81 -13.319 -8.981 -8.301 1.00 0.00 O ATOM 0 H GLY A 81 -10.666 -8.274 -10.459 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -12.871 -6.834 -10.606 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -13.640 -8.400 -10.767 1.00 0.00 H new ATOM 1251 N GLU A 82 -12.001 -7.216 -8.134 1.00 0.00 N ATOM 1252 CA GLU A 82 -11.926 -7.347 -6.647 1.00 0.00 C ATOM 1253 C GLU A 82 -12.482 -6.077 -5.983 1.00 0.00 C ATOM 1254 O GLU A 82 -12.703 -5.080 -6.644 1.00 0.00 O ATOM 1255 CB GLU A 82 -10.437 -7.506 -6.338 1.00 0.00 C ATOM 1256 CG GLU A 82 -10.254 -8.512 -5.200 1.00 0.00 C ATOM 1257 CD GLU A 82 -9.056 -8.101 -4.342 1.00 0.00 C ATOM 1258 OE1 GLU A 82 -8.943 -6.925 -4.041 1.00 0.00 O ATOM 1259 OE2 GLU A 82 -8.272 -8.971 -4.000 1.00 0.00 O ATOM 0 H GLU A 82 -11.473 -6.437 -8.528 1.00 0.00 H new ATOM 0 HA GLU A 82 -12.510 -8.188 -6.272 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -9.905 -7.846 -7.227 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -10.008 -6.544 -6.059 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -11.155 -8.553 -4.589 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -10.098 -9.512 -5.606 1.00 0.00 H new ATOM 1266 N SER A 83 -12.712 -6.098 -4.684 1.00 0.00 N ATOM 1267 CA SER A 83 -13.253 -4.879 -4.005 1.00 0.00 C ATOM 1268 C SER A 83 -12.204 -4.288 -3.051 1.00 0.00 C ATOM 1269 O SER A 83 -11.520 -5.012 -2.353 1.00 0.00 O ATOM 1270 CB SER A 83 -14.474 -5.356 -3.221 1.00 0.00 C ATOM 1271 OG SER A 83 -15.520 -5.676 -4.129 1.00 0.00 O ATOM 0 H SER A 83 -12.549 -6.900 -4.075 1.00 0.00 H new ATOM 0 HA SER A 83 -13.511 -4.098 -4.721 1.00 0.00 H new ATOM 0 HB2 SER A 83 -14.217 -6.230 -2.622 1.00 0.00 H new ATOM 0 HB3 SER A 83 -14.802 -4.580 -2.529 1.00 0.00 H new ATOM 0 HG SER A 83 -16.304 -5.984 -3.629 1.00 0.00 H new ATOM 1277 N ALA A 84 -12.074 -2.977 -3.012 1.00 0.00 N ATOM 1278 CA ALA A 84 -11.065 -2.354 -2.090 1.00 0.00 C ATOM 1279 C ALA A 84 -11.738 -1.857 -0.792 1.00 0.00 C ATOM 1280 O ALA A 84 -11.144 -1.916 0.268 1.00 0.00 O ATOM 1281 CB ALA A 84 -10.451 -1.181 -2.869 1.00 0.00 C ATOM 0 H ALA A 84 -12.617 -2.320 -3.572 1.00 0.00 H new ATOM 0 HA ALA A 84 -10.305 -3.075 -1.789 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -9.705 -0.684 -2.249 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -9.978 -1.555 -3.777 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -11.234 -0.471 -3.134 1.00 0.00 H new ATOM 1287 N GLU A 85 -12.966 -1.370 -0.856 1.00 0.00 N ATOM 1288 CA GLU A 85 -13.640 -0.880 0.406 1.00 0.00 C ATOM 1289 C GLU A 85 -13.723 -2.014 1.439 1.00 0.00 C ATOM 1290 O GLU A 85 -13.522 -1.794 2.619 1.00 0.00 O ATOM 1291 CB GLU A 85 -15.055 -0.425 0.007 1.00 0.00 C ATOM 1292 CG GLU A 85 -15.534 0.658 0.973 1.00 0.00 C ATOM 1293 CD GLU A 85 -15.066 2.029 0.479 1.00 0.00 C ATOM 1294 OE1 GLU A 85 -13.880 2.299 0.578 1.00 0.00 O ATOM 1295 OE2 GLU A 85 -15.901 2.783 0.008 1.00 0.00 O ATOM 0 H GLU A 85 -13.521 -1.291 -1.708 1.00 0.00 H new ATOM 0 HA GLU A 85 -13.077 -0.062 0.856 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -15.051 -0.041 -1.013 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -15.740 -1.273 0.026 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -16.621 0.639 1.047 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -15.143 0.467 1.972 1.00 0.00 H new ATOM 1302 N ASN A 86 -14.012 -3.225 1.010 1.00 0.00 N ATOM 1303 CA ASN A 86 -14.099 -4.372 1.990 1.00 0.00 C ATOM 1304 C ASN A 86 -12.783 -4.501 2.778 1.00 0.00 C ATOM 1305 O ASN A 86 -12.795 -4.815 3.954 1.00 0.00 O ATOM 1306 CB ASN A 86 -14.349 -5.640 1.154 1.00 0.00 C ATOM 1307 CG ASN A 86 -14.460 -6.865 2.073 1.00 0.00 C ATOM 1308 OD1 ASN A 86 -14.841 -6.741 3.219 1.00 0.00 O ATOM 1309 ND2 ASN A 86 -14.140 -8.051 1.617 1.00 0.00 N ATOM 0 H ASN A 86 -14.190 -3.471 0.036 1.00 0.00 H new ATOM 0 HA ASN A 86 -14.898 -4.214 2.714 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -15.264 -5.527 0.573 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -13.536 -5.782 0.442 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -14.211 -8.867 2.224 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -13.820 -8.158 0.655 1.00 0.00 H new ATOM 1316 N ILE A 87 -11.650 -4.251 2.150 1.00 0.00 N ATOM 1317 CA ILE A 87 -10.351 -4.355 2.904 1.00 0.00 C ATOM 1318 C ILE A 87 -10.289 -3.250 3.978 1.00 0.00 C ATOM 1319 O ILE A 87 -9.774 -3.469 5.059 1.00 0.00 O ATOM 1320 CB ILE A 87 -9.218 -4.184 1.872 1.00 0.00 C ATOM 1321 CG1 ILE A 87 -9.269 -5.335 0.862 1.00 0.00 C ATOM 1322 CG2 ILE A 87 -7.860 -4.207 2.580 1.00 0.00 C ATOM 1323 CD1 ILE A 87 -8.343 -5.020 -0.316 1.00 0.00 C ATOM 0 H ILE A 87 -11.569 -3.985 1.169 1.00 0.00 H new ATOM 0 HA ILE A 87 -10.257 -5.315 3.411 1.00 0.00 H new ATOM 0 HB ILE A 87 -9.347 -3.231 1.359 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -8.964 -6.266 1.340 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -10.290 -5.478 0.508 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -7.064 -4.086 1.845 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -7.813 -3.393 3.303 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -7.735 -5.159 3.096 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -8.378 -5.838 -1.035 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -8.669 -4.098 -0.798 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -7.322 -4.899 0.046 1.00 0.00 H new ATOM 1335 N VAL A 88 -10.811 -2.068 3.699 1.00 0.00 N ATOM 1336 CA VAL A 88 -10.769 -0.973 4.737 1.00 0.00 C ATOM 1337 C VAL A 88 -11.517 -1.419 6.005 1.00 0.00 C ATOM 1338 O VAL A 88 -11.098 -1.114 7.107 1.00 0.00 O ATOM 1339 CB VAL A 88 -11.450 0.264 4.121 1.00 0.00 C ATOM 1340 CG1 VAL A 88 -11.439 1.419 5.129 1.00 0.00 C ATOM 1341 CG2 VAL A 88 -10.687 0.691 2.867 1.00 0.00 C ATOM 0 H VAL A 88 -11.256 -1.818 2.816 1.00 0.00 H new ATOM 0 HA VAL A 88 -9.741 -0.745 5.020 1.00 0.00 H new ATOM 0 HB VAL A 88 -12.479 0.015 3.864 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -11.922 2.291 4.688 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -11.978 1.122 6.029 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -10.409 1.666 5.388 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -11.167 1.566 2.429 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -9.659 0.936 3.133 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -10.690 -0.124 2.144 1.00 0.00 H new ATOM 1351 N SER A 89 -12.615 -2.140 5.869 1.00 0.00 N ATOM 1352 CA SER A 89 -13.363 -2.595 7.100 1.00 0.00 C ATOM 1353 C SER A 89 -12.420 -3.394 8.012 1.00 0.00 C ATOM 1354 O SER A 89 -12.427 -3.223 9.218 1.00 0.00 O ATOM 1355 CB SER A 89 -14.516 -3.487 6.618 1.00 0.00 C ATOM 1356 OG SER A 89 -15.545 -3.495 7.598 1.00 0.00 O ATOM 0 H SER A 89 -13.020 -2.429 4.978 1.00 0.00 H new ATOM 0 HA SER A 89 -13.743 -1.746 7.668 1.00 0.00 H new ATOM 0 HB2 SER A 89 -14.905 -3.117 5.669 1.00 0.00 H new ATOM 0 HB3 SER A 89 -14.157 -4.501 6.442 1.00 0.00 H new ATOM 0 HG SER A 89 -16.283 -4.062 7.292 1.00 0.00 H new ATOM 1362 N LYS A 90 -11.591 -4.248 7.446 1.00 0.00 N ATOM 1363 CA LYS A 90 -10.632 -5.030 8.305 1.00 0.00 C ATOM 1364 C LYS A 90 -9.576 -4.088 8.907 1.00 0.00 C ATOM 1365 O LYS A 90 -9.126 -4.297 10.018 1.00 0.00 O ATOM 1366 CB LYS A 90 -9.963 -6.071 7.393 1.00 0.00 C ATOM 1367 CG LYS A 90 -10.958 -7.190 7.083 1.00 0.00 C ATOM 1368 CD LYS A 90 -10.197 -8.456 6.681 1.00 0.00 C ATOM 1369 CE LYS A 90 -10.045 -8.498 5.159 1.00 0.00 C ATOM 1370 NZ LYS A 90 -8.705 -7.905 4.890 1.00 0.00 N ATOM 0 H LYS A 90 -11.536 -4.436 6.445 1.00 0.00 H new ATOM 0 HA LYS A 90 -11.151 -5.516 9.131 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -9.629 -5.600 6.468 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -9.078 -6.481 7.879 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -11.580 -7.389 7.955 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -11.626 -6.884 6.278 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -9.216 -8.470 7.156 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -10.731 -9.340 7.028 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -10.107 -9.520 4.784 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -10.834 -7.929 4.667 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -8.779 -7.219 4.112 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -8.360 -7.424 5.745 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -8.039 -8.658 4.625 1.00 0.00 H new ATOM 1384 N ILE A 91 -9.182 -3.046 8.197 1.00 0.00 N ATOM 1385 CA ILE A 91 -8.160 -2.103 8.771 1.00 0.00 C ATOM 1386 C ILE A 91 -8.800 -1.260 9.883 1.00 0.00 C ATOM 1387 O ILE A 91 -8.184 -1.013 10.902 1.00 0.00 O ATOM 1388 CB ILE A 91 -7.680 -1.207 7.611 1.00 0.00 C ATOM 1389 CG1 ILE A 91 -7.038 -2.069 6.511 1.00 0.00 C ATOM 1390 CG2 ILE A 91 -6.652 -0.195 8.124 1.00 0.00 C ATOM 1391 CD1 ILE A 91 -5.875 -2.887 7.091 1.00 0.00 C ATOM 0 H ILE A 91 -9.518 -2.813 7.263 1.00 0.00 H new ATOM 0 HA ILE A 91 -7.320 -2.642 9.209 1.00 0.00 H new ATOM 0 HB ILE A 91 -8.539 -0.676 7.200 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -7.784 -2.738 6.081 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -6.677 -1.432 5.703 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -6.318 0.434 7.299 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -7.107 0.428 8.894 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -5.798 -0.726 8.545 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -5.428 -3.493 6.303 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -5.123 -2.212 7.500 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -6.247 -3.537 7.883 1.00 0.00 H new ATOM 1403 N ARG A 92 -10.030 -0.826 9.706 1.00 0.00 N ATOM 1404 CA ARG A 92 -10.687 -0.006 10.786 1.00 0.00 C ATOM 1405 C ARG A 92 -10.946 -0.876 12.023 1.00 0.00 C ATOM 1406 O ARG A 92 -10.803 -0.415 13.141 1.00 0.00 O ATOM 1407 CB ARG A 92 -12.011 0.519 10.210 1.00 0.00 C ATOM 1408 CG ARG A 92 -11.724 1.622 9.189 1.00 0.00 C ATOM 1409 CD ARG A 92 -12.830 2.678 9.251 1.00 0.00 C ATOM 1410 NE ARG A 92 -14.055 1.982 8.769 1.00 0.00 N ATOM 1411 CZ ARG A 92 -14.326 1.947 7.493 1.00 0.00 C ATOM 1412 NH1 ARG A 92 -14.243 3.034 6.777 1.00 0.00 N ATOM 1413 NH2 ARG A 92 -14.680 0.822 6.932 1.00 0.00 N ATOM 0 H ARG A 92 -10.600 -0.999 8.878 1.00 0.00 H new ATOM 0 HA ARG A 92 -10.048 0.822 11.093 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -12.562 -0.294 9.737 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -12.640 0.906 11.012 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -10.757 2.081 9.396 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -11.668 1.198 8.186 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -12.962 3.052 10.266 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -12.591 3.537 8.624 1.00 0.00 H new ATOM 0 HE ARG A 92 -14.682 1.533 9.436 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -13.966 3.913 7.214 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -14.455 3.005 5.780 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -14.745 -0.029 7.491 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -14.892 0.794 5.935 1.00 0.00 H new ATOM 1427 N MET A 93 -11.310 -2.130 11.844 1.00 0.00 N ATOM 1428 CA MET A 93 -11.552 -3.006 13.044 1.00 0.00 C ATOM 1429 C MET A 93 -10.208 -3.402 13.670 1.00 0.00 C ATOM 1430 O MET A 93 -10.079 -3.449 14.880 1.00 0.00 O ATOM 1431 CB MET A 93 -12.305 -4.250 12.544 1.00 0.00 C ATOM 1432 CG MET A 93 -13.733 -3.860 12.159 1.00 0.00 C ATOM 1433 SD MET A 93 -14.678 -5.351 11.759 1.00 0.00 S ATOM 1434 CE MET A 93 -16.307 -4.567 11.663 1.00 0.00 C ATOM 0 H MET A 93 -11.448 -2.578 10.938 1.00 0.00 H new ATOM 0 HA MET A 93 -12.135 -2.489 13.806 1.00 0.00 H new ATOM 0 HB2 MET A 93 -11.790 -4.680 11.685 1.00 0.00 H new ATOM 0 HB3 MET A 93 -12.322 -5.015 13.321 1.00 0.00 H new ATOM 0 HG2 MET A 93 -14.209 -3.324 12.980 1.00 0.00 H new ATOM 0 HG3 MET A 93 -13.719 -3.185 11.303 1.00 0.00 H new ATOM 0 HE1 MET A 93 -17.059 -5.318 11.422 1.00 0.00 H new ATOM 0 HE2 MET A 93 -16.547 -4.108 12.622 1.00 0.00 H new ATOM 0 HE3 MET A 93 -16.297 -3.801 10.887 1.00 0.00 H new ATOM 1444 N MET A 94 -9.201 -3.669 12.864 1.00 0.00 N ATOM 1445 CA MET A 94 -7.864 -4.040 13.445 1.00 0.00 C ATOM 1446 C MET A 94 -7.189 -2.794 14.035 1.00 0.00 C ATOM 1447 O MET A 94 -6.532 -2.874 15.057 1.00 0.00 O ATOM 1448 CB MET A 94 -7.021 -4.616 12.297 1.00 0.00 C ATOM 1449 CG MET A 94 -7.517 -6.022 11.955 1.00 0.00 C ATOM 1450 SD MET A 94 -6.724 -6.587 10.429 1.00 0.00 S ATOM 1451 CE MET A 94 -5.259 -7.324 11.194 1.00 0.00 C ATOM 0 H MET A 94 -9.245 -3.647 11.845 1.00 0.00 H new ATOM 0 HA MET A 94 -7.971 -4.771 14.246 1.00 0.00 H new ATOM 0 HB2 MET A 94 -7.091 -3.971 11.421 1.00 0.00 H new ATOM 0 HB3 MET A 94 -5.970 -4.650 12.585 1.00 0.00 H new ATOM 0 HG2 MET A 94 -7.290 -6.708 12.771 1.00 0.00 H new ATOM 0 HG3 MET A 94 -8.600 -6.018 11.835 1.00 0.00 H new ATOM 0 HE1 MET A 94 -4.616 -7.743 10.420 1.00 0.00 H new ATOM 0 HE2 MET A 94 -4.712 -6.559 11.745 1.00 0.00 H new ATOM 0 HE3 MET A 94 -5.565 -8.115 11.878 1.00 0.00 H new ATOM 1461 N ASN A 95 -7.353 -1.638 13.420 1.00 0.00 N ATOM 1462 CA ASN A 95 -6.717 -0.400 13.994 1.00 0.00 C ATOM 1463 C ASN A 95 -7.471 0.031 15.263 1.00 0.00 C ATOM 1464 O ASN A 95 -6.869 0.525 16.198 1.00 0.00 O ATOM 1465 CB ASN A 95 -6.799 0.691 12.915 1.00 0.00 C ATOM 1466 CG ASN A 95 -5.625 0.528 11.939 1.00 0.00 C ATOM 1467 OD1 ASN A 95 -5.731 0.961 10.707 1.00 0.00 O flip ATOM 1468 ND2 ASN A 95 -4.594 0.000 12.303 1.00 0.00 N flip ATOM 0 H ASN A 95 -7.889 -1.500 12.563 1.00 0.00 H new ATOM 0 HA ASN A 95 -5.679 -0.581 14.272 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -7.745 0.618 12.379 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -6.769 1.678 13.376 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -4.505 -0.339 13.261 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -3.817 -0.104 11.651 1.00 0.00 H new ATOM 1475 N ALA A 96 -8.776 -0.164 15.318 1.00 0.00 N ATOM 1476 CA ALA A 96 -9.531 0.233 16.559 1.00 0.00 C ATOM 1477 C ALA A 96 -9.149 -0.699 17.718 1.00 0.00 C ATOM 1478 O ALA A 96 -9.016 -0.262 18.846 1.00 0.00 O ATOM 1479 CB ALA A 96 -11.027 0.099 16.235 1.00 0.00 C ATOM 0 H ALA A 96 -9.340 -0.572 14.573 1.00 0.00 H new ATOM 0 HA ALA A 96 -9.293 1.254 16.858 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -11.615 0.378 17.109 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -11.279 0.757 15.403 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -11.249 -0.933 15.962 1.00 0.00 H new ATOM 1485 N GLN A 97 -8.959 -1.979 17.454 1.00 0.00 N ATOM 1486 CA GLN A 97 -8.570 -2.915 18.570 1.00 0.00 C ATOM 1487 C GLN A 97 -7.182 -2.534 19.102 1.00 0.00 C ATOM 1488 O GLN A 97 -6.948 -2.545 20.296 1.00 0.00 O ATOM 1489 CB GLN A 97 -8.542 -4.332 17.976 1.00 0.00 C ATOM 1490 CG GLN A 97 -9.943 -4.944 18.050 1.00 0.00 C ATOM 1491 CD GLN A 97 -10.147 -5.901 16.868 1.00 0.00 C ATOM 1492 OE1 GLN A 97 -11.093 -5.665 15.993 1.00 0.00 O flip ATOM 1493 NE2 GLN A 97 -9.436 -6.877 16.739 1.00 0.00 N flip ATOM 0 H GLN A 97 -9.054 -2.409 16.534 1.00 0.00 H new ATOM 0 HA GLN A 97 -9.276 -2.859 19.399 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -8.203 -4.297 16.941 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -7.833 -4.953 18.523 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -10.068 -5.480 18.991 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -10.697 -4.157 18.029 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -8.698 -7.064 17.418 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -9.576 -7.510 15.951 1.00 0.00 H new ATOM 1502 N SER A 98 -6.258 -2.186 18.228 1.00 0.00 N ATOM 1503 CA SER A 98 -4.883 -1.795 18.710 1.00 0.00 C ATOM 1504 C SER A 98 -4.979 -0.602 19.676 1.00 0.00 C ATOM 1505 O SER A 98 -4.241 -0.524 20.641 1.00 0.00 O ATOM 1506 CB SER A 98 -4.070 -1.403 17.467 1.00 0.00 C ATOM 1507 OG SER A 98 -4.566 -0.175 16.950 1.00 0.00 O ATOM 0 H SER A 98 -6.391 -2.155 17.217 1.00 0.00 H new ATOM 0 HA SER A 98 -4.409 -2.618 19.244 1.00 0.00 H new ATOM 0 HB2 SER A 98 -3.016 -1.303 17.724 1.00 0.00 H new ATOM 0 HB3 SER A 98 -4.141 -2.185 16.710 1.00 0.00 H new ATOM 0 HG SER A 98 -5.520 -0.268 16.746 1.00 0.00 H new ATOM 1513 N LEU A 99 -5.884 0.326 19.432 1.00 0.00 N ATOM 1514 CA LEU A 99 -6.018 1.499 20.347 1.00 0.00 C ATOM 1515 C LEU A 99 -7.385 1.475 21.053 1.00 0.00 C ATOM 1516 O LEU A 99 -7.977 2.512 21.289 1.00 0.00 O ATOM 1517 CB LEU A 99 -5.907 2.726 19.439 1.00 0.00 C ATOM 1518 CG LEU A 99 -4.433 3.089 19.248 1.00 0.00 C ATOM 1519 CD1 LEU A 99 -3.888 2.376 18.010 1.00 0.00 C ATOM 1520 CD2 LEU A 99 -4.301 4.602 19.063 1.00 0.00 C ATOM 0 H LEU A 99 -6.529 0.316 18.642 1.00 0.00 H new ATOM 0 HA LEU A 99 -5.258 1.498 21.129 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -6.370 2.520 18.474 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -6.445 3.566 19.878 1.00 0.00 H new ATOM 0 HG LEU A 99 -3.866 2.778 20.125 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -2.838 2.635 17.874 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -3.982 1.298 18.140 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -4.455 2.687 17.132 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -3.251 4.862 18.927 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -4.868 4.912 18.185 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -4.689 5.112 19.945 1.00 0.00 H new ATOM 1532 N GLY A 100 -7.894 0.306 21.394 1.00 0.00 N ATOM 1533 CA GLY A 100 -9.217 0.238 22.082 1.00 0.00 C ATOM 1534 C GLY A 100 -9.162 -0.816 23.196 1.00 0.00 C ATOM 1535 O GLY A 100 -9.929 -1.761 23.195 1.00 0.00 O ATOM 0 H GLY A 100 -7.447 -0.595 21.223 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -9.471 1.212 22.501 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -9.999 -0.015 21.366 1.00 0.00 H new ATOM 1539 N GLN A 101 -8.262 -0.668 24.148 1.00 0.00 N ATOM 1540 CA GLN A 101 -8.169 -1.669 25.253 1.00 0.00 C ATOM 1541 C GLN A 101 -8.487 -1.003 26.601 1.00 0.00 C ATOM 1542 O GLN A 101 -8.279 0.182 26.773 1.00 0.00 O ATOM 1543 CB GLN A 101 -6.720 -2.157 25.225 1.00 0.00 C ATOM 1544 CG GLN A 101 -6.674 -3.643 25.587 1.00 0.00 C ATOM 1545 CD GLN A 101 -5.280 -4.203 25.274 1.00 0.00 C ATOM 1546 OE1 GLN A 101 -4.688 -3.852 24.274 1.00 0.00 O ATOM 1547 NE2 GLN A 101 -4.724 -5.066 26.089 1.00 0.00 N ATOM 0 H GLN A 101 -7.594 0.101 24.202 1.00 0.00 H new ATOM 0 HA GLN A 101 -8.877 -2.488 25.129 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -6.291 -2.000 24.235 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -6.118 -1.582 25.928 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -6.903 -3.778 26.644 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -7.432 -4.189 25.025 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -5.218 -5.364 26.930 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -3.798 -5.440 25.882 1.00 0.00 H new ATOM 1556 N SER A 102 -8.992 -1.754 27.565 1.00 0.00 N ATOM 1557 CA SER A 102 -9.323 -1.160 28.903 1.00 0.00 C ATOM 1558 C SER A 102 -10.225 0.078 28.745 1.00 0.00 C ATOM 1559 O SER A 102 -10.071 1.052 29.456 1.00 0.00 O ATOM 1560 CB SER A 102 -7.978 -0.767 29.517 1.00 0.00 C ATOM 1561 OG SER A 102 -8.017 -0.995 30.920 1.00 0.00 O ATOM 0 H SER A 102 -9.187 -2.751 27.478 1.00 0.00 H new ATOM 0 HA SER A 102 -9.868 -1.865 29.531 1.00 0.00 H new ATOM 0 HB2 SER A 102 -7.175 -1.349 29.065 1.00 0.00 H new ATOM 0 HB3 SER A 102 -7.765 0.282 29.313 1.00 0.00 H new ATOM 0 HG SER A 102 -7.156 -0.746 31.316 1.00 0.00 H new ATOM 1567 N ASP A 103 -11.166 0.048 27.821 1.00 0.00 N ATOM 1568 CA ASP A 103 -12.066 1.226 27.630 1.00 0.00 C ATOM 1569 C ASP A 103 -13.479 0.760 27.245 1.00 0.00 C ATOM 1570 O ASP A 103 -13.740 0.452 26.097 1.00 0.00 O ATOM 1571 CB ASP A 103 -11.435 2.025 26.489 1.00 0.00 C ATOM 1572 CG ASP A 103 -11.634 3.520 26.742 1.00 0.00 C ATOM 1573 OD1 ASP A 103 -11.059 4.022 27.693 1.00 0.00 O ATOM 1574 OD2 ASP A 103 -12.358 4.139 25.979 1.00 0.00 O ATOM 0 H ASP A 103 -11.344 -0.739 27.197 1.00 0.00 H new ATOM 0 HA ASP A 103 -12.166 1.821 28.538 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -10.372 1.796 26.415 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -11.889 1.743 25.539 1.00 0.00 H new ATOM 1579 N ILE A 104 -14.395 0.704 28.192 1.00 0.00 N ATOM 1580 CA ILE A 104 -15.782 0.256 27.867 1.00 0.00 C ATOM 1581 C ILE A 104 -16.776 1.404 28.110 1.00 0.00 C ATOM 1582 O ILE A 104 -16.633 2.159 29.053 1.00 0.00 O ATOM 1583 CB ILE A 104 -16.061 -0.913 28.819 1.00 0.00 C ATOM 1584 CG1 ILE A 104 -15.038 -2.027 28.576 1.00 0.00 C ATOM 1585 CG2 ILE A 104 -17.469 -1.460 28.566 1.00 0.00 C ATOM 1586 CD1 ILE A 104 -13.808 -1.791 29.455 1.00 0.00 C ATOM 0 H ILE A 104 -14.237 0.949 29.169 1.00 0.00 H new ATOM 0 HA ILE A 104 -15.887 -0.041 26.824 1.00 0.00 H new ATOM 0 HB ILE A 104 -15.985 -0.562 29.848 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -15.480 -2.997 28.803 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -14.749 -2.047 27.525 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -17.664 -2.291 29.244 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -18.202 -0.672 28.738 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -17.545 -1.808 27.536 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -13.080 -2.584 29.282 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -13.362 -0.828 29.206 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -14.105 -1.793 30.504 1.00 0.00 H new ATOM 1598 N ALA A 105 -17.782 1.545 27.269 1.00 0.00 N ATOM 1599 CA ALA A 105 -18.773 2.645 27.464 1.00 0.00 C ATOM 1600 C ALA A 105 -20.184 2.068 27.603 1.00 0.00 C ATOM 1601 O ALA A 105 -21.129 2.808 27.389 1.00 0.00 O ATOM 1602 CB ALA A 105 -18.666 3.502 26.202 1.00 0.00 C ATOM 1603 OXT ALA A 105 -20.294 0.895 27.921 1.00 0.00 O ATOM 0 H ALA A 105 -17.953 0.945 26.462 1.00 0.00 H new ATOM 0 HA ALA A 105 -18.576 3.223 28.367 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -19.366 4.335 26.268 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -17.651 3.887 26.109 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -18.905 2.895 25.329 1.00 0.00 H new TER 1609 ALA A 105