USER MOD reduce.3.24.130724 H: found=0, std=0, add=798, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 796 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 99 ASN : amide:sc= -0.276 K(o=-0.61,f=-1.6) USER MOD Set 1.2: A 102 MET CE :methyl 176:sc= -0.334 (180deg=-0.407) USER MOD Set 2.1: A 40 GLN : amide:sc= 0.176 X(o=0.27,f=0.57) USER MOD Set 2.2: A 50 GLN : amide:sc= 0.0965 X(o=0.27,f=0.57) USER MOD Single : A 3 HIS : no HD1:sc= -0.0415 X(o=-0.041,f=-0.041) USER MOD Single : A 4 ASN : amide:sc= -0.0662 X(o=-0.066,f=-0.066) USER MOD Single : A 5 SER OG : rot -100:sc= 0.423 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 10 HIS : no HD1:sc= -0.265 X(o=-0.26,f=-0.27) USER MOD Single : A 14 ASN : amide:sc= -0.205 K(o=-0.2,f=-1.3) USER MOD Single : A 15 GLN : amide:sc= 0.69 K(o=0.69,f=-0.016) USER MOD Single : A 32 GLN : amide:sc= -0.0674 X(o=-0.067,f=-0.067) USER MOD Single : A 39 HIS : no HD1:sc= 0 X(o=0,f=-0.16) USER MOD Single : A 45 CYS SG : rot -1:sc= 0.134 USER MOD Single : A 48 SER OG : rot 85:sc= 0.498 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 55 HIS : no HD1:sc= -0.194 X(o=-0.19,f=-0.41) USER MOD Single : A 57 CYS SG : rot 180:sc=0.000685 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 LYS NZ :NH3+ 174:sc= 1.25 (180deg=1.14) USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ -172:sc= -0.0075 (180deg=-0.132) USER MOD Single : A 98 GLN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : A 101 THR OG1 : rot 57:sc= 0.0253 USER MOD Single : A 117 CYS SG : rot -130:sc= -0.0137 USER MOD Single : A 119 ASN : amide:sc= 1.01 K(o=1,f=0) USER MOD Single : A 121 THR OG1 : rot -49:sc= 1.05 USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 127 SER OG : rot 180:sc= 0.288 USER MOD Single : A 129 ASN : amide:sc= 0 X(o=0,f=-0.0034) USER MOD Single : A 134 THR OG1 : rot -40:sc= 1.16 USER MOD ----------------------------------------------------------------- ATOM 34 N HIS A 3 32.602 82.235 51.455 1.00 32.22 N ATOM 35 CA HIS A 3 33.686 81.272 51.329 1.00 32.43 C ATOM 36 C HIS A 3 33.093 79.866 51.232 1.00 31.35 C ATOM 37 O HIS A 3 32.081 79.571 51.867 1.00 30.05 O ATOM 38 CB HIS A 3 34.632 81.387 52.533 1.00 61.54 C ATOM 39 CG HIS A 3 35.640 80.267 52.596 1.00 73.11 C ATOM 40 ND1 HIS A 3 36.687 80.149 51.694 1.00 33.32 N ATOM 41 CD2 HIS A 3 35.721 79.150 53.393 1.00 33.23 C ATOM 42 CE1 HIS A 3 37.332 79.005 51.981 1.00 2.15 C ATOM 43 NE2 HIS A 3 36.788 78.344 53.005 1.00 63.11 N ATOM 0 HA HIS A 3 34.263 81.476 50.427 1.00 32.43 H new ATOM 0 HB2 HIS A 3 35.158 82.340 52.486 1.00 61.54 H new ATOM 0 HB3 HIS A 3 34.045 81.392 53.451 1.00 61.54 H new ATOM 0 HD2 HIS A 3 35.049 78.928 54.209 1.00 33.23 H new ATOM 0 HE1 HIS A 3 38.199 78.657 51.440 1.00 2.15 H new ATOM 0 HE2 HIS A 3 37.085 77.456 53.409 1.00 63.11 H new ATOM 51 N ASN A 4 33.748 79.005 50.446 1.00 51.12 N ATOM 52 CA ASN A 4 33.425 77.593 50.293 1.00 73.24 C ATOM 53 C ASN A 4 34.731 76.822 50.098 1.00 3.45 C ATOM 54 O ASN A 4 35.754 77.410 49.749 1.00 12.52 O ATOM 55 CB ASN A 4 32.494 77.393 49.088 1.00 43.11 C ATOM 56 CG ASN A 4 31.131 78.050 49.294 1.00 75.54 C ATOM 57 OD1 ASN A 4 30.866 79.120 48.750 1.00 73.53 O ATOM 58 ND2 ASN A 4 30.262 77.412 50.080 1.00 4.35 N ATOM 0 H ASN A 4 34.547 79.289 49.880 1.00 51.12 H new ATOM 0 HA ASN A 4 32.909 77.225 51.180 1.00 73.24 H new ATOM 0 HB2 ASN A 4 32.964 77.808 48.196 1.00 43.11 H new ATOM 0 HB3 ASN A 4 32.358 76.326 48.910 1.00 43.11 H new ATOM 0 HD21 ASN A 4 29.338 77.811 50.248 1.00 4.35 H new ATOM 0 HD22 ASN A 4 30.521 76.526 50.513 1.00 4.35 H new ATOM 65 N SER A 5 34.691 75.505 50.324 1.00 72.35 N ATOM 66 CA SER A 5 35.834 74.619 50.141 1.00 12.33 C ATOM 67 C SER A 5 35.348 73.213 49.782 1.00 10.01 C ATOM 68 O SER A 5 35.721 72.684 48.738 1.00 51.12 O ATOM 69 CB SER A 5 36.728 74.635 51.388 1.00 0.14 C ATOM 70 OG SER A 5 36.016 74.244 52.547 1.00 72.04 O ATOM 0 H SER A 5 33.851 75.023 50.643 1.00 72.35 H new ATOM 0 HA SER A 5 36.446 74.973 49.311 1.00 12.33 H new ATOM 0 HB2 SER A 5 37.575 73.965 51.238 1.00 0.14 H new ATOM 0 HB3 SER A 5 37.135 75.636 51.531 1.00 0.14 H new ATOM 0 HG SER A 5 35.757 75.040 53.056 1.00 72.04 H new ATOM 76 N ILE A 6 34.493 72.635 50.637 1.00 1.23 N ATOM 77 CA ILE A 6 33.806 71.368 50.415 1.00 64.15 C ATOM 78 C ILE A 6 34.830 70.238 50.261 1.00 4.31 C ATOM 79 O ILE A 6 35.090 69.761 49.158 1.00 73.54 O ATOM 80 CB ILE A 6 32.796 71.469 49.249 1.00 21.34 C ATOM 81 CG1 ILE A 6 31.913 72.723 49.410 1.00 21.13 C ATOM 82 CG2 ILE A 6 31.926 70.202 49.210 1.00 35.10 C ATOM 83 CD1 ILE A 6 30.823 72.844 48.343 1.00 3.33 C ATOM 0 H ILE A 6 34.256 73.058 51.534 1.00 1.23 H new ATOM 0 HA ILE A 6 33.202 71.123 51.289 1.00 64.15 H new ATOM 0 HB ILE A 6 33.343 71.555 48.310 1.00 21.34 H new ATOM 0 HG12 ILE A 6 31.446 72.705 50.395 1.00 21.13 H new ATOM 0 HG13 ILE A 6 32.546 73.610 49.374 1.00 21.13 H new ATOM 0 HG21 ILE A 6 31.214 70.274 48.388 1.00 35.10 H new ATOM 0 HG22 ILE A 6 32.562 69.329 49.064 1.00 35.10 H new ATOM 0 HG23 ILE A 6 31.384 70.103 50.151 1.00 35.10 H new ATOM 0 HD11 ILE A 6 30.241 73.749 48.518 1.00 3.33 H new ATOM 0 HD12 ILE A 6 31.284 72.894 47.356 1.00 3.33 H new ATOM 0 HD13 ILE A 6 30.167 71.975 48.393 1.00 3.33 H new ATOM 95 N ARG A 7 35.412 69.828 51.392 1.00 21.15 N ATOM 96 CA ARG A 7 36.437 68.797 51.480 1.00 44.10 C ATOM 97 C ARG A 7 35.821 67.514 52.040 1.00 34.50 C ATOM 98 O ARG A 7 34.956 67.572 52.913 1.00 43.53 O ATOM 99 CB ARG A 7 37.565 69.309 52.384 1.00 3.52 C ATOM 100 CG ARG A 7 38.382 70.397 51.673 1.00 55.05 C ATOM 101 CD ARG A 7 39.168 71.239 52.683 1.00 71.52 C ATOM 102 NE ARG A 7 38.290 72.212 53.350 1.00 74.15 N ATOM 103 CZ ARG A 7 38.601 72.924 54.445 1.00 5.12 C ATOM 104 NH1 ARG A 7 39.751 72.716 55.102 1.00 63.42 N ATOM 105 NH2 ARG A 7 37.744 73.858 54.877 1.00 13.30 N ATOM 0 H ARG A 7 35.170 70.222 52.301 1.00 21.15 H new ATOM 0 HA ARG A 7 36.845 68.574 50.494 1.00 44.10 H new ATOM 0 HB2 ARG A 7 37.145 69.708 53.307 1.00 3.52 H new ATOM 0 HB3 ARG A 7 38.218 68.482 52.663 1.00 3.52 H new ATOM 0 HG2 ARG A 7 39.070 69.936 50.964 1.00 55.05 H new ATOM 0 HG3 ARG A 7 37.716 71.040 51.098 1.00 55.05 H new ATOM 0 HD2 ARG A 7 39.627 70.588 53.427 1.00 71.52 H new ATOM 0 HD3 ARG A 7 39.978 71.762 52.174 1.00 71.52 H new ATOM 0 HE ARG A 7 37.365 72.359 52.946 1.00 74.15 H new ATOM 0 HH11 ARG A 7 40.406 72.007 54.772 1.00 63.42 H new ATOM 0 HH12 ARG A 7 39.971 73.266 55.932 1.00 63.42 H new ATOM 0 HH21 ARG A 7 36.870 74.020 54.376 1.00 13.30 H new ATOM 0 HH22 ARG A 7 37.965 74.408 55.707 1.00 13.30 H new ATOM 119 N SER A 8 36.267 66.359 51.531 1.00 5.32 N ATOM 120 CA SER A 8 35.797 65.043 51.947 1.00 40.00 C ATOM 121 C SER A 8 36.859 63.996 51.610 1.00 4.02 C ATOM 122 O SER A 8 37.600 64.153 50.641 1.00 0.43 O ATOM 123 CB SER A 8 34.473 64.717 51.243 1.00 64.10 C ATOM 124 OG SER A 8 33.995 63.444 51.630 1.00 14.43 O ATOM 0 H SER A 8 36.980 66.319 50.803 1.00 5.32 H new ATOM 0 HA SER A 8 35.625 65.037 53.023 1.00 40.00 H new ATOM 0 HB2 SER A 8 33.731 65.478 51.486 1.00 64.10 H new ATOM 0 HB3 SER A 8 34.615 64.743 50.163 1.00 64.10 H new ATOM 0 HG SER A 8 33.150 63.258 51.170 1.00 14.43 H new ATOM 130 N GLY A 9 36.906 62.920 52.405 1.00 24.22 N ATOM 131 CA GLY A 9 37.744 61.758 52.149 1.00 40.34 C ATOM 132 C GLY A 9 37.038 60.766 51.224 1.00 52.33 C ATOM 133 O GLY A 9 35.875 60.958 50.867 1.00 23.03 O ATOM 0 H GLY A 9 36.351 62.838 53.257 1.00 24.22 H new ATOM 0 HA2 GLY A 9 38.684 62.076 51.698 1.00 40.34 H new ATOM 0 HA3 GLY A 9 37.992 61.269 53.091 1.00 40.34 H new ATOM 137 N HIS A 10 37.755 59.699 50.849 1.00 15.44 N ATOM 138 CA HIS A 10 37.263 58.618 50.002 1.00 64.22 C ATOM 139 C HIS A 10 38.164 57.391 50.180 1.00 74.15 C ATOM 140 O HIS A 10 39.308 57.519 50.614 1.00 41.43 O ATOM 141 CB HIS A 10 37.229 59.080 48.538 1.00 3.22 C ATOM 142 CG HIS A 10 36.730 58.024 47.584 1.00 34.34 C ATOM 143 ND1 HIS A 10 35.437 57.524 47.636 1.00 44.44 N ATOM 144 CD2 HIS A 10 37.352 57.316 46.583 1.00 64.52 C ATOM 145 CE1 HIS A 10 35.345 56.560 46.704 1.00 44.23 C ATOM 146 NE2 HIS A 10 36.480 56.388 46.024 1.00 23.44 N ATOM 0 H HIS A 10 38.724 59.565 51.139 1.00 15.44 H new ATOM 0 HA HIS A 10 36.248 58.347 50.291 1.00 64.22 H new ATOM 0 HB2 HIS A 10 36.592 59.961 48.458 1.00 3.22 H new ATOM 0 HB3 HIS A 10 38.232 59.384 48.238 1.00 3.22 H new ATOM 0 HD2 HIS A 10 38.377 57.461 46.273 1.00 64.52 H new ATOM 0 HE1 HIS A 10 34.448 55.986 46.525 1.00 44.23 H new ATOM 0 HE2 HIS A 10 36.665 55.728 45.269 1.00 23.44 H new ATOM 154 N GLY A 11 37.646 56.203 49.844 1.00 33.30 N ATOM 155 CA GLY A 11 38.381 54.949 49.905 1.00 43.20 C ATOM 156 C GLY A 11 37.565 53.822 49.271 1.00 25.44 C ATOM 157 O GLY A 11 36.508 54.066 48.691 1.00 42.33 O ATOM 0 H GLY A 11 36.686 56.092 49.517 1.00 33.30 H new ATOM 0 HA2 GLY A 11 39.334 55.053 49.386 1.00 43.20 H new ATOM 0 HA3 GLY A 11 38.608 54.703 50.942 1.00 43.20 H new ATOM 161 N GLY A 12 38.062 52.584 49.393 1.00 65.11 N ATOM 162 CA GLY A 12 37.413 51.390 48.867 1.00 21.03 C ATOM 163 C GLY A 12 38.016 50.132 49.492 1.00 41.30 C ATOM 164 O GLY A 12 39.009 50.214 50.215 1.00 42.12 O ATOM 0 H GLY A 12 38.942 52.388 49.870 1.00 65.11 H new ATOM 0 HA2 GLY A 12 36.344 51.429 49.074 1.00 21.03 H new ATOM 0 HA3 GLY A 12 37.527 51.355 47.783 1.00 21.03 H new ATOM 168 N LEU A 13 37.401 48.972 49.216 1.00 25.03 N ATOM 169 CA LEU A 13 37.777 47.676 49.775 1.00 40.02 C ATOM 170 C LEU A 13 37.939 46.644 48.656 1.00 74.53 C ATOM 171 O LEU A 13 37.265 46.721 47.629 1.00 52.02 O ATOM 172 CB LEU A 13 36.703 47.200 50.766 1.00 23.13 C ATOM 173 CG LEU A 13 36.492 48.130 51.973 1.00 14.03 C ATOM 174 CD1 LEU A 13 35.286 47.645 52.786 1.00 74.35 C ATOM 175 CD2 LEU A 13 37.723 48.167 52.888 1.00 15.20 C ATOM 0 H LEU A 13 36.606 48.914 48.579 1.00 25.03 H new ATOM 0 HA LEU A 13 38.727 47.784 50.299 1.00 40.02 H new ATOM 0 HB2 LEU A 13 35.757 47.095 50.235 1.00 23.13 H new ATOM 0 HB3 LEU A 13 36.976 46.209 51.130 1.00 23.13 H new ATOM 0 HG LEU A 13 36.321 49.136 51.589 1.00 14.03 H new ATOM 0 HD11 LEU A 13 35.136 48.303 53.642 1.00 74.35 H new ATOM 0 HD12 LEU A 13 34.395 47.657 52.158 1.00 74.35 H new ATOM 0 HD13 LEU A 13 35.469 46.629 53.137 1.00 74.35 H new ATOM 0 HD21 LEU A 13 37.532 48.835 53.728 1.00 15.20 H new ATOM 0 HD22 LEU A 13 37.929 47.164 53.262 1.00 15.20 H new ATOM 0 HD23 LEU A 13 38.584 48.528 52.325 1.00 15.20 H new ATOM 187 N ASN A 14 38.827 45.666 48.880 1.00 60.22 N ATOM 188 CA ASN A 14 39.056 44.528 47.995 1.00 33.44 C ATOM 189 C ASN A 14 38.086 43.389 48.329 1.00 43.25 C ATOM 190 O ASN A 14 37.429 43.425 49.370 1.00 45.21 O ATOM 191 CB ASN A 14 40.519 44.076 48.107 1.00 44.15 C ATOM 192 CG ASN A 14 40.859 43.547 49.501 1.00 44.25 C ATOM 193 OD1 ASN A 14 40.666 42.367 49.785 1.00 72.03 O ATOM 194 ND2 ASN A 14 41.371 44.417 50.375 1.00 53.34 N ATOM 0 H ASN A 14 39.421 45.649 49.709 1.00 60.22 H new ATOM 0 HA ASN A 14 38.868 44.825 46.963 1.00 33.44 H new ATOM 0 HB2 ASN A 14 40.714 43.298 47.368 1.00 44.15 H new ATOM 0 HB3 ASN A 14 41.175 44.914 47.869 1.00 44.15 H new ATOM 0 HD21 ASN A 14 41.617 44.110 51.316 1.00 53.34 H new ATOM 0 HD22 ASN A 14 41.516 45.389 50.102 1.00 53.34 H new ATOM 201 N GLN A 15 37.988 42.390 47.439 1.00 14.21 N ATOM 202 CA GLN A 15 37.052 41.272 47.552 1.00 43.13 C ATOM 203 C GLN A 15 37.763 39.924 47.370 1.00 71.10 C ATOM 204 O GLN A 15 37.780 39.121 48.301 1.00 60.51 O ATOM 205 CB GLN A 15 35.904 41.439 46.544 1.00 53.24 C ATOM 206 CG GLN A 15 35.003 42.653 46.822 1.00 62.14 C ATOM 207 CD GLN A 15 34.112 42.457 48.048 1.00 24.31 C ATOM 208 OE1 GLN A 15 33.005 41.936 47.932 1.00 15.45 O ATOM 209 NE2 GLN A 15 34.574 42.885 49.224 1.00 3.42 N ATOM 0 H GLN A 15 38.572 42.340 46.604 1.00 14.21 H new ATOM 0 HA GLN A 15 36.631 41.278 48.558 1.00 43.13 H new ATOM 0 HB2 GLN A 15 36.324 41.532 45.542 1.00 53.24 H new ATOM 0 HB3 GLN A 15 35.293 40.536 46.551 1.00 53.24 H new ATOM 0 HG2 GLN A 15 35.625 43.536 46.967 1.00 62.14 H new ATOM 0 HG3 GLN A 15 34.377 42.843 45.950 1.00 62.14 H new ATOM 0 HE21 GLN A 15 35.498 43.313 49.284 1.00 3.42 H new ATOM 0 HE22 GLN A 15 34.003 42.784 50.063 1.00 3.42 H new ATOM 218 N LEU A 16 38.318 39.668 46.175 1.00 43.34 N ATOM 219 CA LEU A 16 38.891 38.383 45.763 1.00 0.23 C ATOM 220 C LEU A 16 37.822 37.274 45.711 1.00 55.01 C ATOM 221 O LEU A 16 36.652 37.513 46.006 1.00 44.44 O ATOM 222 CB LEU A 16 40.113 37.981 46.614 1.00 31.42 C ATOM 223 CG LEU A 16 41.309 38.953 46.636 1.00 33.25 C ATOM 224 CD1 LEU A 16 41.733 39.402 45.233 1.00 25.40 C ATOM 225 CD2 LEU A 16 41.098 40.173 47.539 1.00 3.01 C ATOM 0 H LEU A 16 38.381 40.378 45.445 1.00 43.34 H new ATOM 0 HA LEU A 16 39.263 38.515 44.747 1.00 0.23 H new ATOM 0 HB2 LEU A 16 39.776 37.837 47.641 1.00 31.42 H new ATOM 0 HB3 LEU A 16 40.470 37.015 46.257 1.00 31.42 H new ATOM 0 HG LEU A 16 42.121 38.369 47.070 1.00 33.25 H new ATOM 0 HD11 LEU A 16 42.579 40.085 45.310 1.00 25.40 H new ATOM 0 HD12 LEU A 16 42.022 38.531 44.644 1.00 25.40 H new ATOM 0 HD13 LEU A 16 40.900 39.909 44.746 1.00 25.40 H new ATOM 0 HD21 LEU A 16 41.982 40.810 47.502 1.00 3.01 H new ATOM 0 HD22 LEU A 16 40.231 40.736 47.194 1.00 3.01 H new ATOM 0 HD23 LEU A 16 40.931 39.842 48.564 1.00 3.01 H new ATOM 375 N PRO A 27 31.141 18.010 38.667 1.00 52.23 N ATOM 376 CA PRO A 27 30.845 17.232 37.467 1.00 4.02 C ATOM 377 C PRO A 27 31.346 17.959 36.207 1.00 24.10 C ATOM 378 O PRO A 27 32.239 18.797 36.298 1.00 30.13 O ATOM 379 CB PRO A 27 29.323 17.023 37.504 1.00 23.11 C ATOM 380 CG PRO A 27 28.821 18.272 38.219 1.00 25.43 C ATOM 381 CD PRO A 27 29.906 18.498 39.268 1.00 1.21 C ATOM 0 HA PRO A 27 31.356 16.270 37.437 1.00 4.02 H new ATOM 0 HB2 PRO A 27 28.903 16.936 36.502 1.00 23.11 H new ATOM 0 HB3 PRO A 27 29.054 16.114 38.042 1.00 23.11 H new ATOM 0 HG2 PRO A 27 28.727 19.120 37.541 1.00 25.43 H new ATOM 0 HG3 PRO A 27 27.842 18.116 38.672 1.00 25.43 H new ATOM 0 HD2 PRO A 27 29.987 19.554 39.527 1.00 1.21 H new ATOM 0 HD3 PRO A 27 29.679 17.960 40.189 1.00 1.21 H new ATOM 389 N GLU A 28 30.801 17.627 35.029 1.00 2.11 N ATOM 390 CA GLU A 28 31.268 18.084 33.722 1.00 50.45 C ATOM 391 C GLU A 28 31.441 19.604 33.581 1.00 34.03 C ATOM 392 O GLU A 28 32.179 20.039 32.701 1.00 71.12 O ATOM 393 CB GLU A 28 30.361 17.540 32.615 1.00 64.41 C ATOM 394 CG GLU A 28 30.349 16.008 32.607 1.00 55.50 C ATOM 395 CD GLU A 28 29.159 15.428 33.362 1.00 21.53 C ATOM 396 OE1 GLU A 28 29.310 15.226 34.586 1.00 25.24 O ATOM 397 OE2 GLU A 28 28.119 15.214 32.704 1.00 54.34 O ATOM 0 H GLU A 28 29.992 17.009 34.963 1.00 2.11 H new ATOM 0 HA GLU A 28 32.275 17.679 33.622 1.00 50.45 H new ATOM 0 HB2 GLU A 28 29.347 17.913 32.757 1.00 64.41 H new ATOM 0 HB3 GLU A 28 30.703 17.908 31.648 1.00 64.41 H new ATOM 0 HG2 GLU A 28 30.329 15.654 31.576 1.00 55.50 H new ATOM 0 HG3 GLU A 28 31.273 15.639 33.053 1.00 55.50 H new ATOM 404 N VAL A 29 30.807 20.414 34.440 1.00 31.11 N ATOM 405 CA VAL A 29 31.050 21.852 34.526 1.00 44.45 C ATOM 406 C VAL A 29 32.546 22.175 34.693 1.00 63.11 C ATOM 407 O VAL A 29 33.021 23.171 34.150 1.00 64.40 O ATOM 408 CB VAL A 29 30.176 22.464 35.638 1.00 74.11 C ATOM 409 CG1 VAL A 29 30.563 21.981 37.041 1.00 52.01 C ATOM 410 CG2 VAL A 29 30.216 23.997 35.595 1.00 62.23 C ATOM 0 H VAL A 29 30.104 20.081 35.100 1.00 31.11 H new ATOM 0 HA VAL A 29 30.759 22.314 33.583 1.00 44.45 H new ATOM 0 HB VAL A 29 29.161 22.119 35.440 1.00 74.11 H new ATOM 0 HG11 VAL A 29 29.911 22.448 37.779 1.00 52.01 H new ATOM 0 HG12 VAL A 29 30.456 20.898 37.095 1.00 52.01 H new ATOM 0 HG13 VAL A 29 31.598 22.254 37.247 1.00 52.01 H new ATOM 0 HG21 VAL A 29 29.590 24.400 36.391 1.00 62.23 H new ATOM 0 HG22 VAL A 29 31.242 24.338 35.732 1.00 62.23 H new ATOM 0 HG23 VAL A 29 29.844 24.344 34.631 1.00 62.23 H new ATOM 420 N VAL A 30 33.291 21.311 35.400 1.00 40.05 N ATOM 421 CA VAL A 30 34.745 21.360 35.507 1.00 14.41 C ATOM 422 C VAL A 30 35.387 21.507 34.128 1.00 13.42 C ATOM 423 O VAL A 30 36.231 22.382 33.958 1.00 15.33 O ATOM 424 CB VAL A 30 35.272 20.119 36.254 1.00 21.11 C ATOM 425 CG1 VAL A 30 36.781 19.909 36.070 1.00 13.53 C ATOM 426 CG2 VAL A 30 34.980 20.260 37.750 1.00 5.34 C ATOM 0 H VAL A 30 32.880 20.539 35.926 1.00 40.05 H new ATOM 0 HA VAL A 30 35.023 22.239 36.088 1.00 14.41 H new ATOM 0 HB VAL A 30 34.760 19.255 35.830 1.00 21.11 H new ATOM 0 HG11 VAL A 30 37.094 19.021 36.619 1.00 13.53 H new ATOM 0 HG12 VAL A 30 37.004 19.779 35.011 1.00 13.53 H new ATOM 0 HG13 VAL A 30 37.318 20.778 36.450 1.00 13.53 H new ATOM 0 HG21 VAL A 30 35.353 19.382 38.278 1.00 5.34 H new ATOM 0 HG22 VAL A 30 35.474 21.152 38.135 1.00 5.34 H new ATOM 0 HG23 VAL A 30 33.904 20.346 37.904 1.00 5.34 H new ATOM 436 N ARG A 31 34.987 20.674 33.154 1.00 34.45 N ATOM 437 CA ARG A 31 35.525 20.689 31.798 1.00 70.00 C ATOM 438 C ARG A 31 35.550 22.112 31.236 1.00 44.22 C ATOM 439 O ARG A 31 36.566 22.559 30.713 1.00 73.34 O ATOM 440 CB ARG A 31 34.681 19.793 30.880 1.00 65.15 C ATOM 441 CG ARG A 31 35.357 19.617 29.514 1.00 10.22 C ATOM 442 CD ARG A 31 34.551 18.669 28.624 1.00 71.13 C ATOM 443 NE ARG A 31 35.286 18.369 27.388 1.00 33.13 N ATOM 444 CZ ARG A 31 34.845 17.571 26.402 1.00 33.41 C ATOM 445 NH1 ARG A 31 33.624 17.022 26.462 1.00 72.33 N ATOM 446 NH2 ARG A 31 35.635 17.320 25.350 1.00 74.02 N ATOM 0 H ARG A 31 34.270 19.963 33.296 1.00 34.45 H new ATOM 0 HA ARG A 31 36.546 20.309 31.838 1.00 70.00 H new ATOM 0 HB2 ARG A 31 34.538 18.819 31.348 1.00 65.15 H new ATOM 0 HB3 ARG A 31 33.692 20.231 30.747 1.00 65.15 H new ATOM 0 HG2 ARG A 31 35.455 20.586 29.025 1.00 10.22 H new ATOM 0 HG3 ARG A 31 36.365 19.225 29.650 1.00 10.22 H new ATOM 0 HD2 ARG A 31 34.343 17.745 29.163 1.00 71.13 H new ATOM 0 HD3 ARG A 31 33.589 19.120 28.381 1.00 71.13 H new ATOM 0 HE ARG A 31 36.203 18.800 27.269 1.00 33.13 H new ATOM 0 HH11 ARG A 31 33.020 17.209 27.262 1.00 72.33 H new ATOM 0 HH12 ARG A 31 33.299 16.417 25.708 1.00 72.33 H new ATOM 0 HH21 ARG A 31 36.566 17.734 25.301 1.00 74.02 H new ATOM 0 HH22 ARG A 31 35.306 16.715 24.598 1.00 74.02 H new ATOM 460 N GLN A 32 34.420 22.817 31.356 1.00 61.31 N ATOM 461 CA GLN A 32 34.244 24.170 30.856 1.00 51.43 C ATOM 462 C GLN A 32 35.239 25.134 31.505 1.00 14.14 C ATOM 463 O GLN A 32 35.728 26.040 30.836 1.00 63.42 O ATOM 464 CB GLN A 32 32.798 24.646 31.071 1.00 13.43 C ATOM 465 CG GLN A 32 31.739 23.683 30.516 1.00 32.51 C ATOM 466 CD GLN A 32 31.997 23.304 29.063 1.00 45.52 C ATOM 467 OE1 GLN A 32 32.044 24.168 28.192 1.00 4.13 O ATOM 468 NE2 GLN A 32 32.159 22.009 28.797 1.00 14.34 N ATOM 0 H GLN A 32 33.588 22.447 31.815 1.00 61.31 H new ATOM 0 HA GLN A 32 34.443 24.160 29.784 1.00 51.43 H new ATOM 0 HB2 GLN A 32 32.626 24.784 32.138 1.00 13.43 H new ATOM 0 HB3 GLN A 32 32.672 25.620 30.599 1.00 13.43 H new ATOM 0 HG2 GLN A 32 31.720 22.780 31.125 1.00 32.51 H new ATOM 0 HG3 GLN A 32 30.755 24.144 30.598 1.00 32.51 H new ATOM 0 HE21 GLN A 32 32.112 21.324 29.551 1.00 14.34 H new ATOM 0 HE22 GLN A 32 32.330 21.703 27.839 1.00 14.34 H new ATOM 477 N ARG A 33 35.552 24.938 32.790 1.00 14.52 N ATOM 478 CA ARG A 33 36.530 25.748 33.505 1.00 45.43 C ATOM 479 C ARG A 33 37.966 25.386 33.122 1.00 41.40 C ATOM 480 O ARG A 33 38.812 26.280 33.055 1.00 21.23 O ATOM 481 CB ARG A 33 36.286 25.663 35.018 1.00 53.35 C ATOM 482 CG ARG A 33 35.154 26.620 35.413 1.00 53.23 C ATOM 483 CD ARG A 33 35.699 28.044 35.599 1.00 1.50 C ATOM 484 NE ARG A 33 34.618 29.037 35.665 1.00 34.41 N ATOM 485 CZ ARG A 33 34.151 29.740 34.618 1.00 72.25 C ATOM 486 NH1 ARG A 33 34.572 29.482 33.372 1.00 54.31 N ATOM 487 NH2 ARG A 33 33.258 30.716 34.823 1.00 71.04 N ATOM 0 H ARG A 33 35.129 24.207 33.362 1.00 14.52 H new ATOM 0 HA ARG A 33 36.397 26.787 33.205 1.00 45.43 H new ATOM 0 HB2 ARG A 33 36.026 24.642 35.298 1.00 53.35 H new ATOM 0 HB3 ARG A 33 37.197 25.919 35.558 1.00 53.35 H new ATOM 0 HG2 ARG A 33 34.381 26.617 34.644 1.00 53.23 H new ATOM 0 HG3 ARG A 33 34.686 26.279 36.337 1.00 53.23 H new ATOM 0 HD2 ARG A 33 36.291 28.090 36.513 1.00 1.50 H new ATOM 0 HD3 ARG A 33 36.367 28.288 34.773 1.00 1.50 H new ATOM 0 HE ARG A 33 34.189 29.206 36.575 1.00 34.41 H new ATOM 0 HH11 ARG A 33 35.256 28.744 33.207 1.00 54.31 H new ATOM 0 HH12 ARG A 33 34.208 30.024 32.588 1.00 54.31 H new ATOM 0 HH21 ARG A 33 32.936 30.922 35.769 1.00 71.04 H new ATOM 0 HH22 ARG A 33 32.900 31.253 34.034 1.00 71.04 H new ATOM 501 N ILE A 34 38.250 24.109 32.834 1.00 12.00 N ATOM 502 CA ILE A 34 39.538 23.718 32.273 1.00 4.10 C ATOM 503 C ILE A 34 39.743 24.449 30.946 1.00 13.13 C ATOM 504 O ILE A 34 40.779 25.082 30.758 1.00 45.11 O ATOM 505 CB ILE A 34 39.666 22.189 32.116 1.00 63.12 C ATOM 506 CG1 ILE A 34 39.490 21.421 33.440 1.00 21.25 C ATOM 507 CG2 ILE A 34 41.021 21.842 31.480 1.00 11.42 C ATOM 508 CD1 ILE A 34 40.241 22.032 34.626 1.00 72.15 C ATOM 0 H ILE A 34 37.603 23.335 32.982 1.00 12.00 H new ATOM 0 HA ILE A 34 40.327 24.008 32.966 1.00 4.10 H new ATOM 0 HB ILE A 34 38.852 21.871 31.465 1.00 63.12 H new ATOM 0 HG12 ILE A 34 38.428 21.375 33.682 1.00 21.25 H new ATOM 0 HG13 ILE A 34 39.829 20.395 33.299 1.00 21.25 H new ATOM 0 HG21 ILE A 34 41.106 20.761 31.372 1.00 11.42 H new ATOM 0 HG22 ILE A 34 41.094 22.312 30.499 1.00 11.42 H new ATOM 0 HG23 ILE A 34 41.826 22.207 32.118 1.00 11.42 H new ATOM 0 HD11 ILE A 34 40.064 21.431 35.518 1.00 72.15 H new ATOM 0 HD12 ILE A 34 41.309 22.053 34.409 1.00 72.15 H new ATOM 0 HD13 ILE A 34 39.886 23.048 34.797 1.00 72.15 H new ATOM 520 N VAL A 35 38.747 24.396 30.054 1.00 5.21 N ATOM 521 CA VAL A 35 38.749 25.108 28.783 1.00 52.25 C ATOM 522 C VAL A 35 38.972 26.608 29.012 1.00 2.21 C ATOM 523 O VAL A 35 39.850 27.193 28.381 1.00 44.02 O ATOM 524 CB VAL A 35 37.438 24.809 28.027 1.00 55.23 C ATOM 525 CG1 VAL A 35 37.255 25.709 26.799 1.00 33.33 C ATOM 526 CG2 VAL A 35 37.397 23.345 27.566 1.00 54.32 C ATOM 0 H VAL A 35 37.903 23.844 30.204 1.00 5.21 H new ATOM 0 HA VAL A 35 39.575 24.762 28.161 1.00 52.25 H new ATOM 0 HB VAL A 35 36.629 25.008 28.730 1.00 55.23 H new ATOM 0 HG11 VAL A 35 36.318 25.459 26.301 1.00 33.33 H new ATOM 0 HG12 VAL A 35 37.232 26.753 27.113 1.00 33.33 H new ATOM 0 HG13 VAL A 35 38.084 25.556 26.109 1.00 33.33 H new ATOM 0 HG21 VAL A 35 36.464 23.157 27.035 1.00 54.32 H new ATOM 0 HG22 VAL A 35 38.238 23.149 26.901 1.00 54.32 H new ATOM 0 HG23 VAL A 35 37.460 22.688 28.434 1.00 54.32 H new ATOM 536 N ASP A 36 38.191 27.215 29.916 1.00 65.41 N ATOM 537 CA ASP A 36 38.223 28.641 30.222 1.00 31.34 C ATOM 538 C ASP A 36 39.643 29.125 30.524 1.00 72.12 C ATOM 539 O ASP A 36 40.108 30.083 29.911 1.00 22.20 O ATOM 540 CB ASP A 36 37.274 28.932 31.393 1.00 34.34 C ATOM 541 CG ASP A 36 37.077 30.424 31.640 1.00 43.11 C ATOM 542 OD1 ASP A 36 37.993 31.030 32.235 1.00 12.41 O ATOM 543 OD2 ASP A 36 35.994 30.922 31.264 1.00 3.41 O ATOM 0 H ASP A 36 37.500 26.707 30.468 1.00 65.41 H new ATOM 0 HA ASP A 36 37.886 29.193 29.344 1.00 31.34 H new ATOM 0 HB2 ASP A 36 36.307 28.471 31.193 1.00 34.34 H new ATOM 0 HB3 ASP A 36 37.668 28.468 32.297 1.00 34.34 H new ATOM 548 N LEU A 37 40.336 28.460 31.458 1.00 13.34 N ATOM 549 CA LEU A 37 41.687 28.842 31.846 1.00 63.44 C ATOM 550 C LEU A 37 42.700 28.447 30.769 1.00 73.21 C ATOM 551 O LEU A 37 43.506 29.279 30.362 1.00 25.10 O ATOM 552 CB LEU A 37 42.027 28.236 33.215 1.00 43.15 C ATOM 553 CG LEU A 37 43.392 28.679 33.779 1.00 1.04 C ATOM 554 CD1 LEU A 37 43.461 30.191 34.027 1.00 72.03 C ATOM 555 CD2 LEU A 37 43.642 27.954 35.105 1.00 4.22 C ATOM 0 H LEU A 37 39.973 27.649 31.959 1.00 13.34 H new ATOM 0 HA LEU A 37 41.739 29.927 31.939 1.00 63.44 H new ATOM 0 HB2 LEU A 37 41.247 28.510 33.925 1.00 43.15 H new ATOM 0 HB3 LEU A 37 42.016 27.149 33.132 1.00 43.15 H new ATOM 0 HG LEU A 37 44.150 28.427 33.038 1.00 1.04 H new ATOM 0 HD11 LEU A 37 44.443 30.450 34.424 1.00 72.03 H new ATOM 0 HD12 LEU A 37 43.297 30.721 33.089 1.00 72.03 H new ATOM 0 HD13 LEU A 37 42.692 30.477 34.745 1.00 72.03 H new ATOM 0 HD21 LEU A 37 44.606 28.261 35.512 1.00 4.22 H new ATOM 0 HD22 LEU A 37 42.852 28.207 35.813 1.00 4.22 H new ATOM 0 HD23 LEU A 37 43.646 26.877 34.936 1.00 4.22 H new ATOM 567 N ALA A 38 42.657 27.192 30.303 1.00 22.33 N ATOM 568 CA ALA A 38 43.583 26.647 29.313 1.00 3.35 C ATOM 569 C ALA A 38 43.607 27.457 28.014 1.00 11.54 C ATOM 570 O ALA A 38 44.631 27.471 27.332 1.00 2.34 O ATOM 571 CB ALA A 38 43.241 25.184 29.018 1.00 22.25 C ATOM 0 H ALA A 38 41.960 26.515 30.614 1.00 22.33 H new ATOM 0 HA ALA A 38 44.582 26.710 29.745 1.00 3.35 H new ATOM 0 HB1 ALA A 38 43.938 24.789 28.279 1.00 22.25 H new ATOM 0 HB2 ALA A 38 43.316 24.601 29.936 1.00 22.25 H new ATOM 0 HB3 ALA A 38 42.225 25.119 28.629 1.00 22.25 H new ATOM 577 N HIS A 39 42.503 28.143 27.688 1.00 53.51 N ATOM 578 CA HIS A 39 42.402 29.073 26.571 1.00 51.41 C ATOM 579 C HIS A 39 43.560 30.076 26.551 1.00 73.02 C ATOM 580 O HIS A 39 44.045 30.418 25.474 1.00 64.03 O ATOM 581 CB HIS A 39 41.056 29.805 26.645 1.00 2.14 C ATOM 582 CG HIS A 39 40.818 30.754 25.500 1.00 74.23 C ATOM 583 ND1 HIS A 39 41.207 32.085 25.543 1.00 50.41 N ATOM 584 CD2 HIS A 39 40.230 30.587 24.270 1.00 14.23 C ATOM 585 CE1 HIS A 39 40.849 32.641 24.372 1.00 23.14 C ATOM 586 NE2 HIS A 39 40.246 31.779 23.552 1.00 23.40 N ATOM 0 H HIS A 39 41.633 28.059 28.214 1.00 53.51 H new ATOM 0 HA HIS A 39 42.462 28.503 25.644 1.00 51.41 H new ATOM 0 HB2 HIS A 39 40.253 29.068 26.667 1.00 2.14 H new ATOM 0 HB3 HIS A 39 41.006 30.360 27.582 1.00 2.14 H new ATOM 0 HD2 HIS A 39 39.813 29.658 23.910 1.00 14.23 H new ATOM 0 HE1 HIS A 39 41.031 33.676 24.122 1.00 23.14 H new ATOM 0 HE2 HIS A 39 39.881 31.953 22.616 1.00 23.40 H new ATOM 594 N GLN A 40 44.009 30.546 27.726 1.00 21.35 N ATOM 595 CA GLN A 40 45.110 31.499 27.822 1.00 71.43 C ATOM 596 C GLN A 40 46.434 30.928 27.295 1.00 13.20 C ATOM 597 O GLN A 40 47.317 31.693 26.912 1.00 54.32 O ATOM 598 CB GLN A 40 45.234 32.029 29.259 1.00 14.14 C ATOM 599 CG GLN A 40 46.087 31.149 30.187 1.00 33.54 C ATOM 600 CD GLN A 40 45.985 31.584 31.650 1.00 15.10 C ATOM 601 OE1 GLN A 40 45.262 32.519 31.989 1.00 60.13 O ATOM 602 NE2 GLN A 40 46.727 30.910 32.527 1.00 51.52 N ATOM 0 H GLN A 40 43.617 30.274 28.627 1.00 21.35 H new ATOM 0 HA GLN A 40 44.876 32.341 27.171 1.00 71.43 H new ATOM 0 HB2 GLN A 40 45.666 33.029 29.229 1.00 14.14 H new ATOM 0 HB3 GLN A 40 44.236 32.125 29.686 1.00 14.14 H new ATOM 0 HG2 GLN A 40 45.768 30.111 30.095 1.00 33.54 H new ATOM 0 HG3 GLN A 40 47.129 31.191 29.869 1.00 33.54 H new ATOM 0 HE21 GLN A 40 47.316 30.139 32.211 1.00 51.52 H new ATOM 0 HE22 GLN A 40 46.706 31.165 33.515 1.00 51.52 H new ATOM 611 N GLY A 41 46.572 29.595 27.281 1.00 25.42 N ATOM 612 CA GLY A 41 47.754 28.899 26.805 1.00 43.41 C ATOM 613 C GLY A 41 48.737 28.713 27.955 1.00 12.40 C ATOM 614 O GLY A 41 49.697 29.472 28.073 1.00 45.21 O ATOM 0 H GLY A 41 45.841 28.964 27.610 1.00 25.42 H new ATOM 0 HA2 GLY A 41 47.475 27.930 26.391 1.00 43.41 H new ATOM 0 HA3 GLY A 41 48.223 29.466 26.001 1.00 43.41 H new ATOM 618 N VAL A 42 48.487 27.707 28.802 1.00 42.11 N ATOM 619 CA VAL A 42 49.307 27.399 29.965 1.00 61.42 C ATOM 620 C VAL A 42 49.373 25.884 30.174 1.00 52.21 C ATOM 621 O VAL A 42 48.425 25.167 29.852 1.00 70.14 O ATOM 622 CB VAL A 42 48.750 28.146 31.192 1.00 74.51 C ATOM 623 CG1 VAL A 42 47.436 27.538 31.708 1.00 5.01 C ATOM 624 CG2 VAL A 42 49.780 28.208 32.325 1.00 50.23 C ATOM 0 H VAL A 42 47.693 27.077 28.690 1.00 42.11 H new ATOM 0 HA VAL A 42 50.331 27.740 29.809 1.00 61.42 H new ATOM 0 HB VAL A 42 48.534 29.160 30.856 1.00 74.51 H new ATOM 0 HG11 VAL A 42 47.089 28.103 32.573 1.00 5.01 H new ATOM 0 HG12 VAL A 42 46.683 27.579 30.921 1.00 5.01 H new ATOM 0 HG13 VAL A 42 47.604 26.500 31.996 1.00 5.01 H new ATOM 0 HG21 VAL A 42 49.354 28.742 33.175 1.00 50.23 H new ATOM 0 HG22 VAL A 42 50.048 27.196 32.629 1.00 50.23 H new ATOM 0 HG23 VAL A 42 50.671 28.730 31.978 1.00 50.23 H new ATOM 634 N ARG A 43 50.496 25.406 30.719 1.00 44.32 N ATOM 635 CA ARG A 43 50.693 24.010 31.090 1.00 50.23 C ATOM 636 C ARG A 43 49.938 23.704 32.393 1.00 53.02 C ATOM 637 O ARG A 43 49.723 24.618 33.191 1.00 64.00 O ATOM 638 CB ARG A 43 52.200 23.733 31.232 1.00 62.02 C ATOM 639 CG ARG A 43 52.854 24.518 32.380 1.00 53.01 C ATOM 640 CD ARG A 43 54.345 24.185 32.502 1.00 62.51 C ATOM 641 NE ARG A 43 55.117 24.689 31.357 1.00 1.12 N ATOM 642 CZ ARG A 43 55.575 25.946 31.212 1.00 73.15 C ATOM 643 NH1 ARG A 43 55.320 26.893 32.126 1.00 23.45 N ATOM 644 NH2 ARG A 43 56.303 26.257 30.130 1.00 13.22 N ATOM 0 H ARG A 43 51.306 25.993 30.916 1.00 44.32 H new ATOM 0 HA ARG A 43 50.294 23.356 30.315 1.00 50.23 H new ATOM 0 HB2 ARG A 43 52.353 22.666 31.396 1.00 62.02 H new ATOM 0 HB3 ARG A 43 52.699 23.986 30.297 1.00 62.02 H new ATOM 0 HG2 ARG A 43 52.731 25.587 32.209 1.00 53.01 H new ATOM 0 HG3 ARG A 43 52.349 24.285 33.317 1.00 53.01 H new ATOM 0 HD2 ARG A 43 54.739 24.616 33.423 1.00 62.51 H new ATOM 0 HD3 ARG A 43 54.470 23.105 32.577 1.00 62.51 H new ATOM 0 HE ARG A 43 55.323 24.029 30.607 1.00 1.12 H new ATOM 0 HH11 ARG A 43 54.768 26.668 32.954 1.00 23.45 H new ATOM 0 HH12 ARG A 43 55.678 27.839 31.994 1.00 23.45 H new ATOM 0 HH21 ARG A 43 56.504 25.544 29.428 1.00 13.22 H new ATOM 0 HH22 ARG A 43 56.656 27.206 30.008 1.00 13.22 H new ATOM 658 N PRO A 44 49.556 22.440 32.652 1.00 51.22 N ATOM 659 CA PRO A 44 48.879 22.042 33.880 1.00 2.03 C ATOM 660 C PRO A 44 49.876 21.900 35.042 1.00 10.45 C ATOM 661 O PRO A 44 49.978 20.840 35.657 1.00 71.44 O ATOM 662 CB PRO A 44 48.178 20.725 33.524 1.00 44.05 C ATOM 663 CG PRO A 44 49.141 20.099 32.518 1.00 41.30 C ATOM 664 CD PRO A 44 49.630 21.315 31.730 1.00 62.50 C ATOM 0 HA PRO A 44 48.161 22.784 34.229 1.00 2.03 H new ATOM 0 HB2 PRO A 44 48.037 20.091 34.399 1.00 44.05 H new ATOM 0 HB3 PRO A 44 47.192 20.894 33.091 1.00 44.05 H new ATOM 0 HG2 PRO A 44 49.962 19.578 33.011 1.00 41.30 H new ATOM 0 HG3 PRO A 44 48.642 19.373 31.876 1.00 41.30 H new ATOM 0 HD2 PRO A 44 50.650 21.167 31.375 1.00 62.50 H new ATOM 0 HD3 PRO A 44 49.008 21.488 30.851 1.00 62.50 H new ATOM 672 N CYS A 45 50.603 22.985 35.344 1.00 41.15 N ATOM 673 CA CYS A 45 51.542 23.096 36.455 1.00 14.43 C ATOM 674 C CYS A 45 51.409 24.492 37.056 1.00 52.42 C ATOM 675 O CYS A 45 51.085 24.633 38.233 1.00 0.12 O ATOM 676 CB CYS A 45 52.987 22.835 36.011 1.00 32.11 C ATOM 677 SG CYS A 45 53.195 21.164 35.336 1.00 3.43 S ATOM 0 H CYS A 45 50.546 23.842 34.794 1.00 41.15 H new ATOM 0 HA CYS A 45 51.303 22.337 37.200 1.00 14.43 H new ATOM 0 HB2 CYS A 45 53.274 23.569 35.258 1.00 32.11 H new ATOM 0 HB3 CYS A 45 53.658 22.970 36.860 1.00 32.11 H new ATOM 0 HG CYS A 45 52.061 20.530 35.389 1.00 3.43 H new ATOM 683 N ASP A 46 51.631 25.521 36.228 1.00 64.13 N ATOM 684 CA ASP A 46 51.516 26.925 36.606 1.00 61.42 C ATOM 685 C ASP A 46 50.090 27.316 37.008 1.00 21.55 C ATOM 686 O ASP A 46 49.890 28.359 37.625 1.00 63.13 O ATOM 687 CB ASP A 46 52.014 27.822 35.468 1.00 72.13 C ATOM 688 CG ASP A 46 53.529 27.751 35.331 1.00 65.14 C ATOM 689 OD1 ASP A 46 53.988 26.867 34.576 1.00 43.32 O ATOM 690 OD2 ASP A 46 54.196 28.576 35.991 1.00 0.10 O ATOM 0 H ASP A 46 51.902 25.391 35.253 1.00 64.13 H new ATOM 0 HA ASP A 46 52.143 27.070 37.486 1.00 61.42 H new ATOM 0 HB2 ASP A 46 51.547 27.518 34.531 1.00 72.13 H new ATOM 0 HB3 ASP A 46 51.711 28.852 35.655 1.00 72.13 H new ATOM 695 N ILE A 47 49.091 26.483 36.701 1.00 32.12 N ATOM 696 CA ILE A 47 47.754 26.618 37.262 1.00 54.13 C ATOM 697 C ILE A 47 47.839 26.685 38.796 1.00 42.43 C ATOM 698 O ILE A 47 47.129 27.472 39.420 1.00 42.53 O ATOM 699 CB ILE A 47 46.869 25.471 36.743 1.00 45.23 C ATOM 700 CG1 ILE A 47 46.756 25.574 35.208 1.00 41.32 C ATOM 701 CG2 ILE A 47 45.487 25.519 37.405 1.00 52.21 C ATOM 702 CD1 ILE A 47 45.883 24.482 34.587 1.00 54.14 C ATOM 0 H ILE A 47 49.192 25.699 36.057 1.00 32.12 H new ATOM 0 HA ILE A 47 47.287 27.549 36.940 1.00 54.13 H new ATOM 0 HB ILE A 47 47.323 24.514 37.000 1.00 45.23 H new ATOM 0 HG12 ILE A 47 46.346 26.549 34.946 1.00 41.32 H new ATOM 0 HG13 ILE A 47 47.754 25.521 34.774 1.00 41.32 H new ATOM 0 HG21 ILE A 47 44.874 24.701 37.027 1.00 52.21 H new ATOM 0 HG22 ILE A 47 45.597 25.421 38.485 1.00 52.21 H new ATOM 0 HG23 ILE A 47 45.006 26.470 37.175 1.00 52.21 H new ATOM 0 HD11 ILE A 47 45.848 24.615 33.506 1.00 54.14 H new ATOM 0 HD12 ILE A 47 46.304 23.504 34.818 1.00 54.14 H new ATOM 0 HD13 ILE A 47 44.874 24.548 34.994 1.00 54.14 H new ATOM 714 N SER A 48 48.752 25.904 39.391 1.00 61.01 N ATOM 715 CA SER A 48 49.028 25.917 40.820 1.00 71.24 C ATOM 716 C SER A 48 49.439 27.305 41.307 1.00 24.32 C ATOM 717 O SER A 48 48.775 27.852 42.179 1.00 14.32 O ATOM 718 CB SER A 48 50.099 24.878 41.181 1.00 3.13 C ATOM 719 OG SER A 48 49.815 23.625 40.594 1.00 64.23 O ATOM 0 H SER A 48 49.326 25.236 38.876 1.00 61.01 H new ATOM 0 HA SER A 48 48.102 25.651 41.330 1.00 71.24 H new ATOM 0 HB2 SER A 48 51.075 25.227 40.845 1.00 3.13 H new ATOM 0 HB3 SER A 48 50.154 24.771 42.264 1.00 3.13 H new ATOM 0 HG SER A 48 50.161 23.607 39.677 1.00 64.23 H new ATOM 725 N ARG A 49 50.531 27.870 40.776 1.00 44.23 N ATOM 726 CA ARG A 49 51.084 29.126 41.277 1.00 42.20 C ATOM 727 C ARG A 49 50.165 30.325 41.009 1.00 54.11 C ATOM 728 O ARG A 49 50.062 31.201 41.864 1.00 45.52 O ATOM 729 CB ARG A 49 52.535 29.331 40.804 1.00 64.14 C ATOM 730 CG ARG A 49 52.728 29.388 39.282 1.00 51.04 C ATOM 731 CD ARG A 49 52.818 30.808 38.712 1.00 71.11 C ATOM 732 NE ARG A 49 54.047 31.491 39.136 1.00 44.11 N ATOM 733 CZ ARG A 49 55.275 31.293 38.621 1.00 30.15 C ATOM 734 NH1 ARG A 49 55.489 30.418 37.627 1.00 71.31 N ATOM 735 NH2 ARG A 49 56.312 31.984 39.113 1.00 20.43 N ATOM 0 H ARG A 49 51.049 27.470 39.994 1.00 44.23 H new ATOM 0 HA ARG A 49 51.130 29.054 42.364 1.00 42.20 H new ATOM 0 HB2 ARG A 49 52.913 30.257 41.236 1.00 64.14 H new ATOM 0 HB3 ARG A 49 53.147 28.521 41.201 1.00 64.14 H new ATOM 0 HG2 ARG A 49 53.637 28.846 39.022 1.00 51.04 H new ATOM 0 HG3 ARG A 49 51.899 28.868 38.802 1.00 51.04 H new ATOM 0 HD2 ARG A 49 52.784 30.765 37.623 1.00 71.11 H new ATOM 0 HD3 ARG A 49 51.952 31.385 39.036 1.00 71.11 H new ATOM 0 HE ARG A 49 53.963 32.176 39.887 1.00 44.11 H new ATOM 0 HH11 ARG A 49 54.711 29.883 37.242 1.00 71.31 H new ATOM 0 HH12 ARG A 49 56.430 30.288 37.256 1.00 71.31 H new ATOM 0 HH21 ARG A 49 56.167 32.652 39.870 1.00 20.43 H new ATOM 0 HH22 ARG A 49 57.247 31.842 38.731 1.00 20.43 H new ATOM 749 N GLN A 50 49.474 30.361 39.860 1.00 43.15 N ATOM 750 CA GLN A 50 48.511 31.406 39.548 1.00 31.13 C ATOM 751 C GLN A 50 47.378 31.475 40.578 1.00 3.33 C ATOM 752 O GLN A 50 47.148 32.536 41.157 1.00 13.24 O ATOM 753 CB GLN A 50 47.937 31.164 38.151 1.00 43.05 C ATOM 754 CG GLN A 50 48.993 31.380 37.065 1.00 1.12 C ATOM 755 CD GLN A 50 48.416 31.011 35.704 1.00 35.41 C ATOM 756 OE1 GLN A 50 48.062 31.879 34.910 1.00 24.35 O ATOM 757 NE2 GLN A 50 48.299 29.709 35.448 1.00 31.44 N ATOM 0 H GLN A 50 49.574 29.661 39.125 1.00 43.15 H new ATOM 0 HA GLN A 50 49.032 32.363 39.579 1.00 31.13 H new ATOM 0 HB2 GLN A 50 47.550 30.147 38.087 1.00 43.05 H new ATOM 0 HB3 GLN A 50 47.096 31.836 37.981 1.00 43.05 H new ATOM 0 HG2 GLN A 50 49.318 32.420 37.063 1.00 1.12 H new ATOM 0 HG3 GLN A 50 49.873 30.772 37.274 1.00 1.12 H new ATOM 0 HE21 GLN A 50 48.607 29.024 36.138 1.00 31.44 H new ATOM 0 HE22 GLN A 50 47.902 29.397 34.562 1.00 31.44 H new ATOM 766 N LEU A 51 46.664 30.362 40.796 1.00 53.13 N ATOM 767 CA LEU A 51 45.518 30.316 41.703 1.00 10.33 C ATOM 768 C LEU A 51 45.961 30.068 43.150 1.00 31.14 C ATOM 769 O LEU A 51 45.137 30.135 44.061 1.00 45.22 O ATOM 770 CB LEU A 51 44.500 29.256 41.240 1.00 31.02 C ATOM 771 CG LEU A 51 43.638 29.626 40.017 1.00 71.32 C ATOM 772 CD1 LEU A 51 42.883 30.947 40.204 1.00 74.21 C ATOM 773 CD2 LEU A 51 44.423 29.659 38.701 1.00 13.51 C ATOM 0 H LEU A 51 46.868 29.470 40.346 1.00 53.13 H new ATOM 0 HA LEU A 51 45.028 31.289 41.676 1.00 10.33 H new ATOM 0 HB2 LEU A 51 45.042 28.338 41.012 1.00 31.02 H new ATOM 0 HB3 LEU A 51 43.834 29.034 42.074 1.00 31.02 H new ATOM 0 HG LEU A 51 42.910 28.818 39.946 1.00 71.32 H new ATOM 0 HD11 LEU A 51 42.292 31.158 39.312 1.00 74.21 H new ATOM 0 HD12 LEU A 51 42.222 30.869 41.067 1.00 74.21 H new ATOM 0 HD13 LEU A 51 43.597 31.754 40.366 1.00 74.21 H new ATOM 0 HD21 LEU A 51 43.753 29.926 37.884 1.00 13.51 H new ATOM 0 HD22 LEU A 51 45.221 30.398 38.772 1.00 13.51 H new ATOM 0 HD23 LEU A 51 44.854 28.676 38.510 1.00 13.51 H new ATOM 785 N ARG A 52 47.255 29.801 43.361 1.00 3.42 N ATOM 786 CA ARG A 52 47.890 29.579 44.649 1.00 63.51 C ATOM 787 C ARG A 52 47.302 28.346 45.337 1.00 31.34 C ATOM 788 O ARG A 52 46.769 28.435 46.442 1.00 65.04 O ATOM 789 CB ARG A 52 47.852 30.848 45.516 1.00 32.15 C ATOM 790 CG ARG A 52 48.483 32.036 44.780 1.00 40.33 C ATOM 791 CD ARG A 52 48.523 33.279 45.669 1.00 52.20 C ATOM 792 NE ARG A 52 49.075 34.423 44.932 1.00 53.22 N ATOM 793 CZ ARG A 52 49.265 35.652 45.442 1.00 64.34 C ATOM 794 NH1 ARG A 52 48.976 35.913 46.726 1.00 72.04 N ATOM 795 NH2 ARG A 52 49.748 36.625 44.658 1.00 45.53 N ATOM 0 H ARG A 52 47.918 29.732 42.589 1.00 3.42 H new ATOM 0 HA ARG A 52 48.947 29.364 44.490 1.00 63.51 H new ATOM 0 HB2 ARG A 52 46.820 31.084 45.777 1.00 32.15 H new ATOM 0 HB3 ARG A 52 48.384 30.670 46.450 1.00 32.15 H new ATOM 0 HG2 ARG A 52 49.494 31.777 44.466 1.00 40.33 H new ATOM 0 HG3 ARG A 52 47.914 32.251 43.876 1.00 40.33 H new ATOM 0 HD2 ARG A 52 47.518 33.515 46.019 1.00 52.20 H new ATOM 0 HD3 ARG A 52 49.130 33.082 46.553 1.00 52.20 H new ATOM 0 HE ARG A 52 49.334 34.273 43.957 1.00 53.22 H new ATOM 0 HH11 ARG A 52 48.608 35.175 47.326 1.00 72.04 H new ATOM 0 HH12 ARG A 52 49.124 36.850 47.102 1.00 72.04 H new ATOM 0 HH21 ARG A 52 49.969 36.431 43.681 1.00 45.53 H new ATOM 0 HH22 ARG A 52 49.895 37.560 45.038 1.00 45.53 H new ATOM 809 N VAL A 53 47.412 27.197 44.659 1.00 63.42 N ATOM 810 CA VAL A 53 46.914 25.907 45.118 1.00 12.31 C ATOM 811 C VAL A 53 48.101 25.132 45.709 1.00 55.10 C ATOM 812 O VAL A 53 48.711 25.612 46.663 1.00 3.22 O ATOM 813 CB VAL A 53 46.161 25.195 43.972 1.00 62.02 C ATOM 814 CG1 VAL A 53 45.329 24.022 44.513 1.00 2.54 C ATOM 815 CG2 VAL A 53 45.222 26.160 43.234 1.00 53.45 C ATOM 0 H VAL A 53 47.866 27.145 43.747 1.00 63.42 H new ATOM 0 HA VAL A 53 46.173 26.002 45.912 1.00 12.31 H new ATOM 0 HB VAL A 53 46.915 24.826 43.277 1.00 62.02 H new ATOM 0 HG11 VAL A 53 44.807 23.535 43.689 1.00 2.54 H new ATOM 0 HG12 VAL A 53 45.988 23.303 45.001 1.00 2.54 H new ATOM 0 HG13 VAL A 53 44.601 24.394 45.234 1.00 2.54 H new ATOM 0 HG21 VAL A 53 44.708 25.627 42.434 1.00 53.45 H new ATOM 0 HG22 VAL A 53 44.488 26.560 43.934 1.00 53.45 H new ATOM 0 HG23 VAL A 53 45.802 26.979 42.810 1.00 53.45 H new ATOM 825 N SER A 54 48.448 23.965 45.148 1.00 3.33 N ATOM 826 CA SER A 54 49.573 23.147 45.573 1.00 61.51 C ATOM 827 C SER A 54 50.136 22.418 44.350 1.00 34.11 C ATOM 828 O SER A 54 51.142 22.854 43.796 1.00 65.03 O ATOM 829 CB SER A 54 49.139 22.181 46.689 1.00 74.14 C ATOM 830 OG SER A 54 48.773 22.898 47.848 1.00 34.42 O ATOM 0 H SER A 54 47.934 23.560 44.365 1.00 3.33 H new ATOM 0 HA SER A 54 50.363 23.769 45.993 1.00 61.51 H new ATOM 0 HB2 SER A 54 48.299 21.576 46.348 1.00 74.14 H new ATOM 0 HB3 SER A 54 49.953 21.494 46.921 1.00 74.14 H new ATOM 0 HG SER A 54 48.498 22.270 48.548 1.00 34.42 H new ATOM 836 N HIS A 55 49.482 21.323 43.935 1.00 21.41 N ATOM 837 CA HIS A 55 49.855 20.491 42.793 1.00 21.44 C ATOM 838 C HIS A 55 48.870 19.325 42.659 1.00 63.02 C ATOM 839 O HIS A 55 48.390 19.041 41.563 1.00 21.34 O ATOM 840 CB HIS A 55 51.297 19.960 42.904 1.00 2.43 C ATOM 841 CG HIS A 55 51.595 19.226 44.188 1.00 24.22 C ATOM 842 ND1 HIS A 55 51.542 17.844 44.284 1.00 34.21 N ATOM 843 CD2 HIS A 55 51.937 19.663 45.446 1.00 63.13 C ATOM 844 CE1 HIS A 55 51.820 17.520 45.559 1.00 62.04 C ATOM 845 NE2 HIS A 55 52.066 18.589 46.321 1.00 51.33 N ATOM 0 H HIS A 55 48.645 20.983 44.409 1.00 21.41 H new ATOM 0 HA HIS A 55 49.811 21.116 41.901 1.00 21.44 H new ATOM 0 HB2 HIS A 55 51.491 19.292 42.065 1.00 2.43 H new ATOM 0 HB3 HIS A 55 51.988 20.798 42.810 1.00 2.43 H new ATOM 0 HD2 HIS A 55 52.085 20.698 45.718 1.00 63.13 H new ATOM 0 HE1 HIS A 55 51.842 16.505 45.927 1.00 62.04 H new ATOM 0 HE2 HIS A 55 52.295 18.613 47.315 1.00 51.33 H new ATOM 853 N GLY A 56 48.581 18.642 43.774 1.00 20.22 N ATOM 854 CA GLY A 56 47.742 17.455 43.806 1.00 12.12 C ATOM 855 C GLY A 56 46.317 17.768 43.359 1.00 33.11 C ATOM 856 O GLY A 56 45.804 17.136 42.439 1.00 11.12 O ATOM 0 H GLY A 56 48.934 18.911 44.692 1.00 20.22 H new ATOM 0 HA2 GLY A 56 48.168 16.689 43.158 1.00 12.12 H new ATOM 0 HA3 GLY A 56 47.726 17.046 44.816 1.00 12.12 H new ATOM 860 N CYS A 57 45.686 18.756 44.007 1.00 54.03 N ATOM 861 CA CYS A 57 44.327 19.177 43.694 1.00 54.44 C ATOM 862 C CYS A 57 44.230 19.609 42.233 1.00 53.50 C ATOM 863 O CYS A 57 43.307 19.201 41.534 1.00 62.24 O ATOM 864 CB CYS A 57 43.897 20.319 44.621 1.00 25.24 C ATOM 865 SG CYS A 57 43.859 19.745 46.341 1.00 22.45 S ATOM 0 H CYS A 57 46.113 19.285 44.767 1.00 54.03 H new ATOM 0 HA CYS A 57 43.655 18.333 43.851 1.00 54.44 H new ATOM 0 HB2 CYS A 57 44.588 21.156 44.524 1.00 25.24 H new ATOM 0 HB3 CYS A 57 42.912 20.683 44.329 1.00 25.24 H new ATOM 0 HG CYS A 57 43.495 20.723 47.117 1.00 22.45 H new ATOM 871 N VAL A 58 45.201 20.405 41.772 1.00 63.42 N ATOM 872 CA VAL A 58 45.281 20.865 40.396 1.00 25.21 C ATOM 873 C VAL A 58 45.258 19.666 39.450 1.00 63.42 C ATOM 874 O VAL A 58 44.333 19.544 38.653 1.00 10.02 O ATOM 875 CB VAL A 58 46.534 21.738 40.217 1.00 25.11 C ATOM 876 CG1 VAL A 58 46.711 22.193 38.764 1.00 25.54 C ATOM 877 CG2 VAL A 58 46.440 22.975 41.115 1.00 62.32 C ATOM 0 H VAL A 58 45.961 20.749 42.359 1.00 63.42 H new ATOM 0 HA VAL A 58 44.418 21.484 40.151 1.00 25.21 H new ATOM 0 HB VAL A 58 47.395 21.130 40.495 1.00 25.11 H new ATOM 0 HG11 VAL A 58 47.608 22.807 38.682 1.00 25.54 H new ATOM 0 HG12 VAL A 58 46.809 21.320 38.119 1.00 25.54 H new ATOM 0 HG13 VAL A 58 45.843 22.776 38.457 1.00 25.54 H new ATOM 0 HG21 VAL A 58 47.331 23.589 40.983 1.00 62.32 H new ATOM 0 HG22 VAL A 58 45.557 23.554 40.845 1.00 62.32 H new ATOM 0 HG23 VAL A 58 46.365 22.663 42.157 1.00 62.32 H new ATOM 887 N SER A 59 46.243 18.768 39.570 1.00 70.53 N ATOM 888 CA SER A 59 46.350 17.555 38.767 1.00 44.34 C ATOM 889 C SER A 59 45.024 16.788 38.717 1.00 62.33 C ATOM 890 O SER A 59 44.595 16.370 37.642 1.00 1.24 O ATOM 891 CB SER A 59 47.484 16.683 39.321 1.00 55.34 C ATOM 892 OG SER A 59 47.633 15.514 38.543 1.00 74.02 O ATOM 0 H SER A 59 47.002 18.871 40.244 1.00 70.53 H new ATOM 0 HA SER A 59 46.583 17.832 37.739 1.00 44.34 H new ATOM 0 HB2 SER A 59 48.417 17.247 39.323 1.00 55.34 H new ATOM 0 HB3 SER A 59 47.272 16.414 40.356 1.00 55.34 H new ATOM 0 HG SER A 59 48.361 14.969 38.908 1.00 74.02 H new ATOM 898 N LYS A 60 44.362 16.627 39.870 1.00 3.13 N ATOM 899 CA LYS A 60 43.102 15.907 39.970 1.00 50.42 C ATOM 900 C LYS A 60 41.994 16.602 39.170 1.00 33.05 C ATOM 901 O LYS A 60 41.403 15.973 38.297 1.00 11.32 O ATOM 902 CB LYS A 60 42.726 15.705 41.445 1.00 34.33 C ATOM 903 CG LYS A 60 43.670 14.690 42.108 1.00 73.55 C ATOM 904 CD LYS A 60 43.533 14.655 43.636 1.00 11.13 C ATOM 905 CE LYS A 60 42.147 14.171 44.082 1.00 31.11 C ATOM 906 NZ LYS A 60 42.085 13.990 45.544 1.00 74.15 N ATOM 0 H LYS A 60 44.694 16.998 40.760 1.00 3.13 H new ATOM 0 HA LYS A 60 43.224 14.920 39.523 1.00 50.42 H new ATOM 0 HB2 LYS A 60 42.778 16.657 41.973 1.00 34.33 H new ATOM 0 HB3 LYS A 60 41.696 15.355 41.519 1.00 34.33 H new ATOM 0 HG2 LYS A 60 43.466 13.697 41.707 1.00 73.55 H new ATOM 0 HG3 LYS A 60 44.699 14.934 41.846 1.00 73.55 H new ATOM 0 HD2 LYS A 60 44.297 13.998 44.053 1.00 11.13 H new ATOM 0 HD3 LYS A 60 43.715 15.651 44.038 1.00 11.13 H new ATOM 0 HE2 LYS A 60 41.391 14.892 43.771 1.00 31.11 H new ATOM 0 HE3 LYS A 60 41.912 13.229 43.587 1.00 31.11 H new ATOM 0 HZ1 LYS A 60 41.135 13.662 45.813 1.00 74.15 H new ATOM 0 HZ2 LYS A 60 42.791 13.284 45.837 1.00 74.15 H new ATOM 0 HZ3 LYS A 60 42.285 14.896 46.015 1.00 74.15 H new ATOM 920 N ILE A 61 41.704 17.881 39.447 1.00 73.20 N ATOM 921 CA ILE A 61 40.622 18.600 38.774 1.00 34.24 C ATOM 922 C ILE A 61 40.881 18.736 37.267 1.00 74.23 C ATOM 923 O ILE A 61 39.941 18.621 36.482 1.00 71.55 O ATOM 924 CB ILE A 61 40.332 19.956 39.451 1.00 2.41 C ATOM 925 CG1 ILE A 61 40.020 19.830 40.956 1.00 22.10 C ATOM 926 CG2 ILE A 61 39.153 20.648 38.749 1.00 3.03 C ATOM 927 CD1 ILE A 61 39.002 18.739 41.289 1.00 74.52 C ATOM 0 H ILE A 61 42.209 18.438 40.137 1.00 73.20 H new ATOM 0 HA ILE A 61 39.717 18.002 38.878 1.00 34.24 H new ATOM 0 HB ILE A 61 41.241 20.550 39.357 1.00 2.41 H new ATOM 0 HG12 ILE A 61 40.946 19.625 41.493 1.00 22.10 H new ATOM 0 HG13 ILE A 61 39.645 20.786 41.321 1.00 22.10 H new ATOM 0 HG21 ILE A 61 38.953 21.605 39.231 1.00 3.03 H new ATOM 0 HG22 ILE A 61 39.401 20.815 37.701 1.00 3.03 H new ATOM 0 HG23 ILE A 61 38.268 20.016 38.816 1.00 3.03 H new ATOM 0 HD11 ILE A 61 38.836 18.713 42.366 1.00 74.52 H new ATOM 0 HD12 ILE A 61 38.061 18.952 40.782 1.00 74.52 H new ATOM 0 HD13 ILE A 61 39.382 17.773 40.957 1.00 74.52 H new ATOM 939 N LEU A 62 42.140 18.942 36.856 1.00 10.32 N ATOM 940 CA LEU A 62 42.541 18.892 35.452 1.00 35.12 C ATOM 941 C LEU A 62 42.148 17.539 34.854 1.00 35.14 C ATOM 942 O LEU A 62 41.434 17.493 33.853 1.00 34.31 O ATOM 943 CB LEU A 62 44.054 19.149 35.311 1.00 4.12 C ATOM 944 CG LEU A 62 44.448 20.624 35.098 1.00 3.35 C ATOM 945 CD1 LEU A 62 44.151 21.061 33.658 1.00 12.41 C ATOM 946 CD2 LEU A 62 43.802 21.594 36.095 1.00 71.24 C ATOM 0 H LEU A 62 42.908 19.148 37.494 1.00 10.32 H new ATOM 0 HA LEU A 62 42.023 19.677 34.901 1.00 35.12 H new ATOM 0 HB2 LEU A 62 44.555 18.781 36.206 1.00 4.12 H new ATOM 0 HB3 LEU A 62 44.430 18.564 34.472 1.00 4.12 H new ATOM 0 HG LEU A 62 45.521 20.673 35.284 1.00 3.35 H new ATOM 0 HD11 LEU A 62 44.436 22.105 33.528 1.00 12.41 H new ATOM 0 HD12 LEU A 62 44.720 20.441 32.965 1.00 12.41 H new ATOM 0 HD13 LEU A 62 43.086 20.948 33.456 1.00 12.41 H new ATOM 0 HD21 LEU A 62 44.130 22.611 35.878 1.00 71.24 H new ATOM 0 HD22 LEU A 62 42.717 21.536 36.008 1.00 71.24 H new ATOM 0 HD23 LEU A 62 44.100 21.326 37.109 1.00 71.24 H new ATOM 958 N GLY A 63 42.592 16.442 35.475 1.00 75.15 N ATOM 959 CA GLY A 63 42.206 15.102 35.075 1.00 22.03 C ATOM 960 C GLY A 63 43.010 14.073 35.859 1.00 44.44 C ATOM 961 O GLY A 63 44.234 14.044 35.742 1.00 65.55 O ATOM 0 H GLY A 63 43.230 16.467 36.270 1.00 75.15 H new ATOM 0 HA2 GLY A 63 41.140 14.954 35.251 1.00 22.03 H new ATOM 0 HA3 GLY A 63 42.374 14.970 34.006 1.00 22.03 H new ATOM 1314 N LYS A 87 -2.000 0.512 5.335 1.00 11.30 N ATOM 1315 CA LYS A 87 -1.808 -0.162 4.058 1.00 64.30 C ATOM 1316 C LYS A 87 -2.645 -1.441 3.948 1.00 63.23 C ATOM 1317 O LYS A 87 -3.003 -1.844 2.845 1.00 20.34 O ATOM 1318 CB LYS A 87 -0.314 -0.440 3.861 1.00 4.22 C ATOM 1319 CG LYS A 87 -0.005 -0.921 2.438 1.00 12.21 C ATOM 1320 CD LYS A 87 1.504 -1.066 2.234 1.00 13.30 C ATOM 1321 CE LYS A 87 1.797 -1.493 0.793 1.00 34.21 C ATOM 1322 NZ LYS A 87 3.246 -1.624 0.556 1.00 41.43 N ATOM 0 HA LYS A 87 -2.159 0.491 3.259 1.00 64.30 H new ATOM 0 HB2 LYS A 87 0.255 0.466 4.069 1.00 4.22 H new ATOM 0 HB3 LYS A 87 0.013 -1.193 4.578 1.00 4.22 H new ATOM 0 HG2 LYS A 87 -0.495 -1.878 2.257 1.00 12.21 H new ATOM 0 HG3 LYS A 87 -0.409 -0.214 1.714 1.00 12.21 H new ATOM 0 HD2 LYS A 87 2.001 -0.121 2.451 1.00 13.30 H new ATOM 0 HD3 LYS A 87 1.904 -1.804 2.930 1.00 13.30 H new ATOM 0 HE2 LYS A 87 1.305 -2.444 0.586 1.00 34.21 H new ATOM 0 HE3 LYS A 87 1.378 -0.761 0.102 1.00 34.21 H new ATOM 0 HZ1 LYS A 87 3.412 -1.914 -0.429 1.00 41.43 H new ATOM 0 HZ2 LYS A 87 3.710 -0.710 0.730 1.00 41.43 H new ATOM 0 HZ3 LYS A 87 3.640 -2.340 1.199 1.00 41.43 H new ATOM 1336 N VAL A 88 -2.980 -2.074 5.079 1.00 24.13 N ATOM 1337 CA VAL A 88 -3.786 -3.288 5.095 1.00 42.21 C ATOM 1338 C VAL A 88 -5.191 -3.041 4.516 1.00 43.14 C ATOM 1339 O VAL A 88 -5.792 -3.966 3.973 1.00 34.05 O ATOM 1340 CB VAL A 88 -3.810 -3.901 6.507 1.00 41.00 C ATOM 1341 CG1 VAL A 88 -4.475 -5.284 6.473 1.00 74.22 C ATOM 1342 CG2 VAL A 88 -2.390 -4.083 7.066 1.00 73.02 C ATOM 0 H VAL A 88 -2.697 -1.754 6.005 1.00 24.13 H new ATOM 0 HA VAL A 88 -3.322 -4.025 4.439 1.00 42.21 H new ATOM 0 HB VAL A 88 -4.369 -3.215 7.143 1.00 41.00 H new ATOM 0 HG11 VAL A 88 -4.486 -5.707 7.477 1.00 74.22 H new ATOM 0 HG12 VAL A 88 -5.498 -5.187 6.109 1.00 74.22 H new ATOM 0 HG13 VAL A 88 -3.914 -5.941 5.808 1.00 74.22 H new ATOM 0 HG21 VAL A 88 -2.445 -4.518 8.064 1.00 73.02 H new ATOM 0 HG22 VAL A 88 -1.824 -4.746 6.412 1.00 73.02 H new ATOM 0 HG23 VAL A 88 -1.893 -3.114 7.119 1.00 73.02 H new ATOM 1352 N VAL A 89 -5.698 -1.798 4.568 1.00 33.22 N ATOM 1353 CA VAL A 89 -6.940 -1.408 3.903 1.00 73.30 C ATOM 1354 C VAL A 89 -6.883 -1.747 2.408 1.00 62.24 C ATOM 1355 O VAL A 89 -7.855 -2.264 1.859 1.00 11.12 O ATOM 1356 CB VAL A 89 -7.221 0.091 4.127 1.00 11.32 C ATOM 1357 CG1 VAL A 89 -8.451 0.563 3.340 1.00 5.11 C ATOM 1358 CG2 VAL A 89 -7.445 0.390 5.617 1.00 2.25 C ATOM 0 H VAL A 89 -5.251 -1.036 5.077 1.00 33.22 H new ATOM 0 HA VAL A 89 -7.763 -1.974 4.340 1.00 73.30 H new ATOM 0 HB VAL A 89 -6.344 0.630 3.769 1.00 11.32 H new ATOM 0 HG11 VAL A 89 -8.616 1.625 3.524 1.00 5.11 H new ATOM 0 HG12 VAL A 89 -8.286 0.401 2.275 1.00 5.11 H new ATOM 0 HG13 VAL A 89 -9.327 -0.001 3.661 1.00 5.11 H new ATOM 0 HG21 VAL A 89 -7.641 1.454 5.749 1.00 2.25 H new ATOM 0 HG22 VAL A 89 -8.298 -0.184 5.979 1.00 2.25 H new ATOM 0 HG23 VAL A 89 -6.555 0.112 6.182 1.00 2.25 H new ATOM 1368 N GLU A 90 -5.744 -1.475 1.756 1.00 55.11 N ATOM 1369 CA GLU A 90 -5.533 -1.798 0.350 1.00 73.24 C ATOM 1370 C GLU A 90 -5.688 -3.301 0.126 1.00 45.23 C ATOM 1371 O GLU A 90 -6.256 -3.713 -0.879 1.00 0.21 O ATOM 1372 CB GLU A 90 -4.138 -1.355 -0.112 1.00 30.02 C ATOM 1373 CG GLU A 90 -3.894 0.148 0.081 1.00 62.15 C ATOM 1374 CD GLU A 90 -2.424 0.518 -0.099 1.00 71.44 C ATOM 1375 OE1 GLU A 90 -1.723 -0.215 -0.832 1.00 40.23 O ATOM 1376 OE2 GLU A 90 -2.017 1.528 0.515 1.00 42.23 O ATOM 0 H GLU A 90 -4.943 -1.022 2.197 1.00 55.11 H new ATOM 0 HA GLU A 90 -6.282 -1.263 -0.234 1.00 73.24 H new ATOM 0 HB2 GLU A 90 -3.383 -1.914 0.441 1.00 30.02 H new ATOM 0 HB3 GLU A 90 -4.013 -1.606 -1.165 1.00 30.02 H new ATOM 0 HG2 GLU A 90 -4.498 0.708 -0.633 1.00 62.15 H new ATOM 0 HG3 GLU A 90 -4.222 0.443 1.077 1.00 62.15 H new ATOM 1383 N LYS A 91 -5.186 -4.112 1.066 1.00 72.13 N ATOM 1384 CA LYS A 91 -5.213 -5.562 0.970 1.00 42.22 C ATOM 1385 C LYS A 91 -6.622 -6.115 1.181 1.00 22.43 C ATOM 1386 O LYS A 91 -6.976 -7.096 0.526 1.00 20.44 O ATOM 1387 CB LYS A 91 -4.200 -6.194 1.936 1.00 54.42 C ATOM 1388 CG LYS A 91 -2.782 -5.609 1.811 1.00 15.44 C ATOM 1389 CD LYS A 91 -2.253 -5.494 0.374 1.00 31.43 C ATOM 1390 CE LYS A 91 -2.147 -6.850 -0.332 1.00 34.44 C ATOM 1391 NZ LYS A 91 -1.776 -6.683 -1.747 1.00 71.04 N ATOM 0 H LYS A 91 -4.747 -3.768 1.920 1.00 72.13 H new ATOM 0 HA LYS A 91 -4.917 -5.835 -0.043 1.00 42.22 H new ATOM 0 HB2 LYS A 91 -4.552 -6.057 2.959 1.00 54.42 H new ATOM 0 HB3 LYS A 91 -4.158 -7.268 1.754 1.00 54.42 H new ATOM 0 HG2 LYS A 91 -2.772 -4.619 2.266 1.00 15.44 H new ATOM 0 HG3 LYS A 91 -2.096 -6.231 2.386 1.00 15.44 H new ATOM 0 HD2 LYS A 91 -2.912 -4.842 -0.199 1.00 31.43 H new ATOM 0 HD3 LYS A 91 -1.271 -5.021 0.390 1.00 31.43 H new ATOM 0 HE2 LYS A 91 -1.404 -7.469 0.171 1.00 34.44 H new ATOM 0 HE3 LYS A 91 -3.099 -7.375 -0.262 1.00 34.44 H new ATOM 0 HZ1 LYS A 91 -1.612 -7.616 -2.175 1.00 71.04 H new ATOM 0 HZ2 LYS A 91 -2.546 -6.200 -2.253 1.00 71.04 H new ATOM 0 HZ3 LYS A 91 -0.908 -6.114 -1.813 1.00 71.04 H new ATOM 1405 N ILE A 92 -7.449 -5.481 2.032 1.00 20.41 N ATOM 1406 CA ILE A 92 -8.864 -5.813 2.065 1.00 4.31 C ATOM 1407 C ILE A 92 -9.459 -5.508 0.690 1.00 34.25 C ATOM 1408 O ILE A 92 -10.177 -6.338 0.141 1.00 30.04 O ATOM 1409 CB ILE A 92 -9.592 -5.051 3.186 1.00 12.22 C ATOM 1410 CG1 ILE A 92 -9.081 -5.406 4.595 1.00 15.40 C ATOM 1411 CG2 ILE A 92 -11.102 -5.302 3.075 1.00 73.43 C ATOM 1412 CD1 ILE A 92 -9.419 -6.826 5.055 1.00 61.32 C ATOM 0 H ILE A 92 -7.161 -4.754 2.687 1.00 20.41 H new ATOM 0 HA ILE A 92 -8.991 -6.873 2.287 1.00 4.31 H new ATOM 0 HB ILE A 92 -9.379 -3.991 3.050 1.00 12.22 H new ATOM 0 HG12 ILE A 92 -7.999 -5.279 4.618 1.00 15.40 H new ATOM 0 HG13 ILE A 92 -9.501 -4.697 5.309 1.00 15.40 H new ATOM 0 HG21 ILE A 92 -11.620 -4.763 3.868 1.00 73.43 H new ATOM 0 HG22 ILE A 92 -11.459 -4.952 2.106 1.00 73.43 H new ATOM 0 HG23 ILE A 92 -11.301 -6.369 3.171 1.00 73.43 H new ATOM 0 HD11 ILE A 92 -9.021 -6.988 6.057 1.00 61.32 H new ATOM 0 HD12 ILE A 92 -10.501 -6.956 5.069 1.00 61.32 H new ATOM 0 HD13 ILE A 92 -8.976 -7.546 4.367 1.00 61.32 H new ATOM 1424 N GLY A 93 -9.125 -4.342 0.122 1.00 53.30 N ATOM 1425 CA GLY A 93 -9.504 -3.950 -1.227 1.00 1.43 C ATOM 1426 C GLY A 93 -9.184 -5.036 -2.257 1.00 31.10 C ATOM 1427 O GLY A 93 -10.072 -5.460 -2.991 1.00 72.22 O ATOM 0 H GLY A 93 -8.571 -3.634 0.605 1.00 53.30 H new ATOM 0 HA2 GLY A 93 -10.571 -3.730 -1.253 1.00 1.43 H new ATOM 0 HA3 GLY A 93 -8.983 -3.031 -1.496 1.00 1.43 H new ATOM 1431 N ASP A 94 -7.929 -5.493 -2.315 1.00 43.05 N ATOM 1432 CA ASP A 94 -7.477 -6.480 -3.285 1.00 11.23 C ATOM 1433 C ASP A 94 -8.244 -7.789 -3.147 1.00 71.14 C ATOM 1434 O ASP A 94 -8.723 -8.320 -4.143 1.00 42.14 O ATOM 1435 CB ASP A 94 -5.974 -6.735 -3.134 1.00 51.34 C ATOM 1436 CG ASP A 94 -5.127 -5.483 -3.353 1.00 75.05 C ATOM 1437 OD1 ASP A 94 -5.556 -4.626 -4.156 1.00 35.52 O ATOM 1438 OD2 ASP A 94 -4.048 -5.414 -2.722 1.00 63.21 O ATOM 0 H ASP A 94 -7.195 -5.181 -1.680 1.00 43.05 H new ATOM 0 HA ASP A 94 -7.671 -6.076 -4.279 1.00 11.23 H new ATOM 0 HB2 ASP A 94 -5.777 -7.129 -2.137 1.00 51.34 H new ATOM 0 HB3 ASP A 94 -5.669 -7.502 -3.846 1.00 51.34 H new ATOM 1443 N TYR A 95 -8.364 -8.316 -1.927 1.00 25.32 N ATOM 1444 CA TYR A 95 -9.073 -9.562 -1.685 1.00 33.54 C ATOM 1445 C TYR A 95 -10.562 -9.431 -2.019 1.00 40.52 C ATOM 1446 O TYR A 95 -11.133 -10.351 -2.600 1.00 23.31 O ATOM 1447 CB TYR A 95 -8.843 -9.997 -0.239 1.00 42.31 C ATOM 1448 CG TYR A 95 -7.409 -10.286 0.175 1.00 65.33 C ATOM 1449 CD1 TYR A 95 -6.378 -10.489 -0.767 1.00 43.42 C ATOM 1450 CD2 TYR A 95 -7.113 -10.368 1.548 1.00 61.43 C ATOM 1451 CE1 TYR A 95 -5.066 -10.745 -0.337 1.00 13.41 C ATOM 1452 CE2 TYR A 95 -5.814 -10.689 1.971 1.00 51.13 C ATOM 1453 CZ TYR A 95 -4.782 -10.846 1.034 1.00 72.33 C ATOM 1454 OH TYR A 95 -3.512 -11.107 1.459 1.00 24.23 O ATOM 0 H TYR A 95 -7.973 -7.890 -1.087 1.00 25.32 H new ATOM 0 HA TYR A 95 -8.681 -10.335 -2.346 1.00 33.54 H new ATOM 0 HB2 TYR A 95 -9.234 -9.218 0.415 1.00 42.31 H new ATOM 0 HB3 TYR A 95 -9.435 -10.894 -0.057 1.00 42.31 H new ATOM 0 HD1 TYR A 95 -6.599 -10.447 -1.823 1.00 43.42 H new ATOM 0 HD2 TYR A 95 -7.887 -10.183 2.278 1.00 61.43 H new ATOM 0 HE1 TYR A 95 -4.274 -10.864 -1.062 1.00 13.41 H new ATOM 0 HE2 TYR A 95 -5.608 -10.816 3.024 1.00 51.13 H new ATOM 0 HH TYR A 95 -3.495 -11.142 2.438 1.00 24.23 H new ATOM 1464 N LYS A 96 -11.187 -8.290 -1.699 1.00 52.33 N ATOM 1465 CA LYS A 96 -12.551 -7.980 -2.096 1.00 32.11 C ATOM 1466 C LYS A 96 -12.696 -8.021 -3.621 1.00 61.33 C ATOM 1467 O LYS A 96 -13.640 -8.623 -4.126 1.00 14.04 O ATOM 1468 CB LYS A 96 -12.936 -6.600 -1.540 1.00 11.34 C ATOM 1469 CG LYS A 96 -14.437 -6.310 -1.629 1.00 11.04 C ATOM 1470 CD LYS A 96 -15.184 -7.034 -0.503 1.00 13.25 C ATOM 1471 CE LYS A 96 -16.700 -6.834 -0.594 1.00 41.34 C ATOM 1472 NZ LYS A 96 -17.081 -5.411 -0.572 1.00 71.02 N ATOM 0 H LYS A 96 -10.746 -7.552 -1.150 1.00 52.33 H new ATOM 0 HA LYS A 96 -13.227 -8.730 -1.685 1.00 32.11 H new ATOM 0 HB2 LYS A 96 -12.621 -6.535 -0.498 1.00 11.34 H new ATOM 0 HB3 LYS A 96 -12.391 -5.830 -2.087 1.00 11.34 H new ATOM 0 HG2 LYS A 96 -14.612 -5.236 -1.560 1.00 11.04 H new ATOM 0 HG3 LYS A 96 -14.821 -6.634 -2.597 1.00 11.04 H new ATOM 0 HD2 LYS A 96 -14.956 -8.099 -0.544 1.00 13.25 H new ATOM 0 HD3 LYS A 96 -14.828 -6.669 0.460 1.00 13.25 H new ATOM 0 HE2 LYS A 96 -17.070 -7.292 -1.511 1.00 41.34 H new ATOM 0 HE3 LYS A 96 -17.182 -7.349 0.237 1.00 41.34 H new ATOM 0 HZ1 LYS A 96 -18.115 -5.330 -0.499 1.00 71.02 H new ATOM 0 HZ2 LYS A 96 -16.638 -4.946 0.246 1.00 71.02 H new ATOM 0 HZ3 LYS A 96 -16.759 -4.952 -1.448 1.00 71.02 H new ATOM 1486 N ARG A 97 -11.765 -7.386 -4.346 1.00 52.41 N ATOM 1487 CA ARG A 97 -11.739 -7.358 -5.803 1.00 52.12 C ATOM 1488 C ARG A 97 -11.571 -8.767 -6.383 1.00 3.24 C ATOM 1489 O ARG A 97 -12.251 -9.112 -7.347 1.00 75.20 O ATOM 1490 CB ARG A 97 -10.614 -6.433 -6.287 1.00 15.41 C ATOM 1491 CG ARG A 97 -10.929 -4.951 -6.031 1.00 33.22 C ATOM 1492 CD ARG A 97 -9.663 -4.091 -6.129 1.00 33.34 C ATOM 1493 NE ARG A 97 -9.015 -4.237 -7.441 1.00 2.53 N ATOM 1494 CZ ARG A 97 -7.722 -4.523 -7.683 1.00 4.53 C ATOM 1495 NH1 ARG A 97 -6.816 -4.627 -6.700 1.00 52.34 N ATOM 1496 NH2 ARG A 97 -7.328 -4.711 -8.950 1.00 35.23 N ATOM 0 H ARG A 97 -10.996 -6.869 -3.921 1.00 52.41 H new ATOM 0 HA ARG A 97 -12.694 -6.969 -6.157 1.00 52.12 H new ATOM 0 HB2 ARG A 97 -9.686 -6.698 -5.781 1.00 15.41 H new ATOM 0 HB3 ARG A 97 -10.452 -6.589 -7.353 1.00 15.41 H new ATOM 0 HG2 ARG A 97 -11.666 -4.603 -6.755 1.00 33.22 H new ATOM 0 HG3 ARG A 97 -11.374 -4.836 -5.043 1.00 33.22 H new ATOM 0 HD2 ARG A 97 -9.918 -3.045 -5.962 1.00 33.34 H new ATOM 0 HD3 ARG A 97 -8.965 -4.378 -5.343 1.00 33.34 H new ATOM 0 HE ARG A 97 -9.611 -4.107 -8.258 1.00 2.53 H new ATOM 0 HH11 ARG A 97 -7.098 -4.488 -5.730 1.00 52.34 H new ATOM 0 HH12 ARG A 97 -5.845 -4.845 -6.923 1.00 52.34 H new ATOM 0 HH21 ARG A 97 -8.004 -4.637 -9.711 1.00 35.23 H new ATOM 0 HH22 ARG A 97 -6.353 -4.929 -9.154 1.00 35.23 H new ATOM 1510 N GLN A 98 -10.670 -9.574 -5.806 1.00 42.30 N ATOM 1511 CA GLN A 98 -10.424 -10.947 -6.230 1.00 50.24 C ATOM 1512 C GLN A 98 -11.702 -11.780 -6.089 1.00 74.12 C ATOM 1513 O GLN A 98 -12.136 -12.431 -7.037 1.00 65.20 O ATOM 1514 CB GLN A 98 -9.303 -11.574 -5.389 1.00 15.02 C ATOM 1515 CG GLN A 98 -7.920 -11.026 -5.760 1.00 11.51 C ATOM 1516 CD GLN A 98 -6.880 -11.336 -4.685 1.00 14.22 C ATOM 1517 OE1 GLN A 98 -6.996 -12.315 -3.950 1.00 64.13 O ATOM 1518 NE2 GLN A 98 -5.854 -10.490 -4.580 1.00 5.12 N ATOM 0 H GLN A 98 -10.087 -9.282 -5.022 1.00 42.30 H new ATOM 0 HA GLN A 98 -10.117 -10.935 -7.276 1.00 50.24 H new ATOM 0 HB2 GLN A 98 -9.495 -11.384 -4.333 1.00 15.02 H new ATOM 0 HB3 GLN A 98 -9.311 -12.655 -5.525 1.00 15.02 H new ATOM 0 HG2 GLN A 98 -7.601 -11.457 -6.709 1.00 11.51 H new ATOM 0 HG3 GLN A 98 -7.983 -9.947 -5.904 1.00 11.51 H new ATOM 0 HE21 GLN A 98 -5.789 -9.688 -5.206 1.00 5.12 H new ATOM 0 HE22 GLN A 98 -5.135 -10.646 -3.874 1.00 5.12 H new ATOM 1527 N ASN A 99 -12.281 -11.759 -4.885 1.00 50.10 N ATOM 1528 CA ASN A 99 -13.448 -12.528 -4.491 1.00 15.34 C ATOM 1529 C ASN A 99 -14.715 -11.980 -5.162 1.00 22.34 C ATOM 1530 O ASN A 99 -14.717 -10.843 -5.632 1.00 2.54 O ATOM 1531 CB ASN A 99 -13.568 -12.426 -2.961 1.00 13.53 C ATOM 1532 CG ASN A 99 -12.444 -13.145 -2.212 1.00 60.50 C ATOM 1533 OD1 ASN A 99 -11.511 -13.675 -2.809 1.00 42.54 O ATOM 1534 ND2 ASN A 99 -12.534 -13.166 -0.881 1.00 4.13 N ATOM 0 H ASN A 99 -11.926 -11.175 -4.128 1.00 50.10 H new ATOM 0 HA ASN A 99 -13.339 -13.567 -4.803 1.00 15.34 H new ATOM 0 HB2 ASN A 99 -13.571 -11.374 -2.674 1.00 13.53 H new ATOM 0 HB3 ASN A 99 -14.526 -12.844 -2.651 1.00 13.53 H new ATOM 0 HD21 ASN A 99 -11.814 -13.632 -0.328 1.00 4.13 H new ATOM 0 HD22 ASN A 99 -13.322 -12.716 -0.416 1.00 4.13 H new ATOM 1541 N PRO A 100 -15.815 -12.755 -5.185 1.00 54.03 N ATOM 1542 CA PRO A 100 -17.129 -12.261 -5.579 1.00 40.04 C ATOM 1543 C PRO A 100 -17.696 -11.345 -4.478 1.00 31.32 C ATOM 1544 O PRO A 100 -16.944 -10.816 -3.659 1.00 24.25 O ATOM 1545 CB PRO A 100 -17.959 -13.529 -5.823 1.00 52.41 C ATOM 1546 CG PRO A 100 -17.371 -14.521 -4.824 1.00 64.21 C ATOM 1547 CD PRO A 100 -15.883 -14.169 -4.840 1.00 43.02 C ATOM 0 HA PRO A 100 -17.121 -11.642 -6.476 1.00 40.04 H new ATOM 0 HB2 PRO A 100 -19.020 -13.357 -5.644 1.00 52.41 H new ATOM 0 HB3 PRO A 100 -17.862 -13.884 -6.849 1.00 52.41 H new ATOM 0 HG2 PRO A 100 -17.805 -14.402 -3.831 1.00 64.21 H new ATOM 0 HG3 PRO A 100 -17.547 -15.553 -5.127 1.00 64.21 H new ATOM 0 HD2 PRO A 100 -15.426 -14.357 -3.869 1.00 43.02 H new ATOM 0 HD3 PRO A 100 -15.345 -14.776 -5.568 1.00 43.02 H new ATOM 1555 N THR A 101 -19.018 -11.137 -4.462 1.00 13.22 N ATOM 1556 CA THR A 101 -19.707 -10.234 -3.545 1.00 23.12 C ATOM 1557 C THR A 101 -19.842 -10.853 -2.145 1.00 43.31 C ATOM 1558 O THR A 101 -20.947 -11.072 -1.650 1.00 42.32 O ATOM 1559 CB THR A 101 -21.066 -9.853 -4.156 1.00 54.54 C ATOM 1560 OG1 THR A 101 -21.770 -11.018 -4.539 1.00 43.45 O ATOM 1561 CG2 THR A 101 -20.883 -8.962 -5.390 1.00 4.02 C ATOM 0 H THR A 101 -19.652 -11.608 -5.107 1.00 13.22 H new ATOM 0 HA THR A 101 -19.120 -9.325 -3.411 1.00 23.12 H new ATOM 0 HB THR A 101 -21.629 -9.306 -3.400 1.00 54.54 H new ATOM 0 HG1 THR A 101 -21.876 -11.607 -3.763 1.00 43.45 H new ATOM 0 HG21 THR A 101 -21.859 -8.707 -5.803 1.00 4.02 H new ATOM 0 HG22 THR A 101 -20.360 -8.049 -5.105 1.00 4.02 H new ATOM 0 HG23 THR A 101 -20.300 -9.495 -6.141 1.00 4.02 H new ATOM 1569 N MET A 102 -18.699 -11.097 -1.496 1.00 23.24 N ATOM 1570 CA MET A 102 -18.595 -11.561 -0.121 1.00 32.21 C ATOM 1571 C MET A 102 -18.744 -10.391 0.851 1.00 15.25 C ATOM 1572 O MET A 102 -18.786 -9.230 0.445 1.00 22.03 O ATOM 1573 CB MET A 102 -17.236 -12.248 0.067 1.00 41.44 C ATOM 1574 CG MET A 102 -17.277 -13.679 -0.474 1.00 52.34 C ATOM 1575 SD MET A 102 -15.682 -14.543 -0.502 1.00 71.14 S ATOM 1576 CE MET A 102 -15.141 -14.275 1.206 1.00 2.21 C ATOM 0 H MET A 102 -17.788 -10.970 -1.937 1.00 23.24 H new ATOM 0 HA MET A 102 -19.395 -12.272 0.087 1.00 32.21 H new ATOM 0 HB2 MET A 102 -16.461 -11.681 -0.448 1.00 41.44 H new ATOM 0 HB3 MET A 102 -16.972 -12.261 1.124 1.00 41.44 H new ATOM 0 HG2 MET A 102 -17.975 -14.259 0.130 1.00 52.34 H new ATOM 0 HG3 MET A 102 -17.677 -13.655 -1.488 1.00 52.34 H new ATOM 0 HE1 MET A 102 -14.204 -14.805 1.378 1.00 2.21 H new ATOM 0 HE2 MET A 102 -14.991 -13.209 1.377 1.00 2.21 H new ATOM 0 HE3 MET A 102 -15.901 -14.649 1.891 1.00 2.21 H new ATOM 1586 N PHE A 103 -18.812 -10.715 2.144 1.00 23.53 N ATOM 1587 CA PHE A 103 -18.897 -9.749 3.229 1.00 71.31 C ATOM 1588 C PHE A 103 -17.496 -9.403 3.735 1.00 41.25 C ATOM 1589 O PHE A 103 -16.615 -10.259 3.768 1.00 72.33 O ATOM 1590 CB PHE A 103 -19.761 -10.319 4.358 1.00 5.05 C ATOM 1591 CG PHE A 103 -21.192 -10.605 3.942 1.00 65.00 C ATOM 1592 CD1 PHE A 103 -22.121 -9.552 3.845 1.00 23.41 C ATOM 1593 CD2 PHE A 103 -21.580 -11.912 3.597 1.00 4.35 C ATOM 1594 CE1 PHE A 103 -23.439 -9.811 3.425 1.00 3.13 C ATOM 1595 CE2 PHE A 103 -22.893 -12.169 3.168 1.00 44.22 C ATOM 1596 CZ PHE A 103 -23.825 -11.120 3.088 1.00 25.33 C ATOM 0 H PHE A 103 -18.809 -11.682 2.468 1.00 23.53 H new ATOM 0 HA PHE A 103 -19.361 -8.833 2.864 1.00 71.31 H new ATOM 0 HB2 PHE A 103 -19.306 -11.240 4.723 1.00 5.05 H new ATOM 0 HB3 PHE A 103 -19.767 -9.615 5.190 1.00 5.05 H new ATOM 0 HD1 PHE A 103 -21.822 -8.544 4.093 1.00 23.41 H new ATOM 0 HD2 PHE A 103 -20.867 -12.720 3.662 1.00 4.35 H new ATOM 0 HE1 PHE A 103 -24.154 -9.004 3.362 1.00 3.13 H new ATOM 0 HE2 PHE A 103 -23.186 -13.173 2.900 1.00 44.22 H new ATOM 0 HZ PHE A 103 -24.837 -11.319 2.768 1.00 25.33 H new ATOM 1606 N ALA A 104 -17.306 -8.144 4.148 1.00 51.22 N ATOM 1607 CA ALA A 104 -16.059 -7.629 4.708 1.00 32.52 C ATOM 1608 C ALA A 104 -15.550 -8.483 5.872 1.00 31.34 C ATOM 1609 O ALA A 104 -14.343 -8.656 6.018 1.00 0.43 O ATOM 1610 CB ALA A 104 -16.273 -6.190 5.169 1.00 1.52 C ATOM 0 H ALA A 104 -18.040 -7.438 4.099 1.00 51.22 H new ATOM 0 HA ALA A 104 -15.299 -7.666 3.928 1.00 32.52 H new ATOM 0 HB1 ALA A 104 -15.345 -5.800 5.588 1.00 1.52 H new ATOM 0 HB2 ALA A 104 -16.573 -5.577 4.319 1.00 1.52 H new ATOM 0 HB3 ALA A 104 -17.054 -6.164 5.929 1.00 1.52 H new ATOM 1616 N TRP A 105 -16.466 -9.022 6.687 1.00 31.01 N ATOM 1617 CA TRP A 105 -16.155 -9.928 7.785 1.00 3.31 C ATOM 1618 C TRP A 105 -15.325 -11.130 7.329 1.00 71.23 C ATOM 1619 O TRP A 105 -14.455 -11.587 8.066 1.00 13.23 O ATOM 1620 CB TRP A 105 -17.458 -10.403 8.436 1.00 13.15 C ATOM 1621 CG TRP A 105 -18.358 -9.309 8.919 1.00 40.45 C ATOM 1622 CD1 TRP A 105 -19.583 -9.020 8.428 1.00 35.03 C ATOM 1623 CD2 TRP A 105 -18.112 -8.332 9.971 1.00 34.43 C ATOM 1624 NE1 TRP A 105 -20.110 -7.930 9.091 1.00 12.43 N ATOM 1625 CE2 TRP A 105 -19.236 -7.462 10.053 1.00 74.42 C ATOM 1626 CE3 TRP A 105 -17.041 -8.080 10.857 1.00 40.34 C ATOM 1627 CZ2 TRP A 105 -19.298 -6.399 10.963 1.00 33.43 C ATOM 1628 CZ3 TRP A 105 -17.096 -7.024 11.786 1.00 43.24 C ATOM 1629 CH2 TRP A 105 -18.221 -6.182 11.839 1.00 2.33 C ATOM 0 H TRP A 105 -17.464 -8.832 6.594 1.00 31.01 H new ATOM 0 HA TRP A 105 -15.552 -9.380 8.509 1.00 3.31 H new ATOM 0 HB2 TRP A 105 -18.005 -11.012 7.717 1.00 13.15 H new ATOM 0 HB3 TRP A 105 -17.211 -11.049 9.279 1.00 13.15 H new ATOM 0 HD1 TRP A 105 -20.077 -9.561 7.635 1.00 35.03 H new ATOM 0 HE1 TRP A 105 -21.025 -7.523 8.896 1.00 12.43 H new ATOM 0 HE3 TRP A 105 -16.164 -8.709 10.821 1.00 40.34 H new ATOM 0 HZ2 TRP A 105 -20.164 -5.754 10.991 1.00 33.43 H new ATOM 0 HZ3 TRP A 105 -16.270 -6.860 12.462 1.00 43.24 H new ATOM 0 HH2 TRP A 105 -18.257 -5.371 12.551 1.00 2.33 H new ATOM 1640 N GLU A 106 -15.584 -11.638 6.118 1.00 15.25 N ATOM 1641 CA GLU A 106 -14.863 -12.760 5.552 1.00 75.31 C ATOM 1642 C GLU A 106 -13.498 -12.297 5.035 1.00 71.03 C ATOM 1643 O GLU A 106 -12.515 -13.022 5.171 1.00 12.11 O ATOM 1644 CB GLU A 106 -15.699 -13.388 4.431 1.00 34.44 C ATOM 1645 CG GLU A 106 -17.117 -13.767 4.884 1.00 22.32 C ATOM 1646 CD GLU A 106 -17.951 -14.283 3.716 1.00 65.21 C ATOM 1647 OE1 GLU A 106 -18.463 -13.425 2.964 1.00 24.30 O ATOM 1648 OE2 GLU A 106 -18.055 -15.521 3.589 1.00 41.01 O ATOM 0 H GLU A 106 -16.311 -11.270 5.505 1.00 15.25 H new ATOM 0 HA GLU A 106 -14.691 -13.515 6.319 1.00 75.31 H new ATOM 0 HB2 GLU A 106 -15.764 -12.689 3.598 1.00 34.44 H new ATOM 0 HB3 GLU A 106 -15.191 -14.279 4.061 1.00 34.44 H new ATOM 0 HG2 GLU A 106 -17.062 -14.531 5.660 1.00 22.32 H new ATOM 0 HG3 GLU A 106 -17.604 -12.898 5.326 1.00 22.32 H new ATOM 1655 N ILE A 107 -13.425 -11.091 4.452 1.00 55.44 N ATOM 1656 CA ILE A 107 -12.180 -10.548 3.916 1.00 3.34 C ATOM 1657 C ILE A 107 -11.184 -10.236 5.041 1.00 55.35 C ATOM 1658 O ILE A 107 -9.987 -10.472 4.888 1.00 14.23 O ATOM 1659 CB ILE A 107 -12.420 -9.318 3.023 1.00 24.31 C ATOM 1660 CG1 ILE A 107 -13.563 -9.486 2.005 1.00 65.31 C ATOM 1661 CG2 ILE A 107 -11.117 -9.015 2.275 1.00 62.21 C ATOM 1662 CD1 ILE A 107 -13.345 -10.617 0.996 1.00 63.43 C ATOM 0 H ILE A 107 -14.227 -10.471 4.342 1.00 55.44 H new ATOM 0 HA ILE A 107 -11.741 -11.318 3.281 1.00 3.34 H new ATOM 0 HB ILE A 107 -12.723 -8.501 3.677 1.00 24.31 H new ATOM 0 HG12 ILE A 107 -14.491 -9.671 2.545 1.00 65.31 H new ATOM 0 HG13 ILE A 107 -13.691 -8.550 1.462 1.00 65.31 H new ATOM 0 HG21 ILE A 107 -11.260 -8.146 1.633 1.00 62.21 H new ATOM 0 HG22 ILE A 107 -10.324 -8.809 2.994 1.00 62.21 H new ATOM 0 HG23 ILE A 107 -10.839 -9.875 1.665 1.00 62.21 H new ATOM 0 HD11 ILE A 107 -14.196 -10.667 0.316 1.00 63.43 H new ATOM 0 HD12 ILE A 107 -12.436 -10.426 0.426 1.00 63.43 H new ATOM 0 HD13 ILE A 107 -13.248 -11.564 1.527 1.00 63.43 H new ATOM 1674 N ARG A 108 -11.680 -9.740 6.181 1.00 2.23 N ATOM 1675 CA ARG A 108 -10.926 -9.635 7.425 1.00 3.21 C ATOM 1676 C ARG A 108 -10.245 -10.977 7.713 1.00 33.33 C ATOM 1677 O ARG A 108 -9.025 -11.040 7.854 1.00 44.41 O ATOM 1678 CB ARG A 108 -11.899 -9.239 8.546 1.00 74.51 C ATOM 1679 CG ARG A 108 -11.283 -9.216 9.954 1.00 50.35 C ATOM 1680 CD ARG A 108 -12.376 -9.297 11.028 1.00 50.52 C ATOM 1681 NE ARG A 108 -13.080 -10.589 10.970 1.00 73.23 N ATOM 1682 CZ ARG A 108 -14.196 -10.914 11.641 1.00 5.23 C ATOM 1683 NH1 ARG A 108 -14.724 -10.075 12.544 1.00 1.14 N ATOM 1684 NH2 ARG A 108 -14.789 -12.092 11.407 1.00 45.41 N ATOM 0 H ARG A 108 -12.637 -9.395 6.261 1.00 2.23 H new ATOM 0 HA ARG A 108 -10.148 -8.875 7.354 1.00 3.21 H new ATOM 0 HB2 ARG A 108 -12.303 -8.251 8.325 1.00 74.51 H new ATOM 0 HB3 ARG A 108 -12.738 -9.935 8.543 1.00 74.51 H new ATOM 0 HG2 ARG A 108 -10.593 -10.052 10.068 1.00 50.35 H new ATOM 0 HG3 ARG A 108 -10.703 -8.303 10.087 1.00 50.35 H new ATOM 0 HD2 ARG A 108 -11.932 -9.165 12.015 1.00 50.52 H new ATOM 0 HD3 ARG A 108 -13.089 -8.484 10.888 1.00 50.52 H new ATOM 0 HE ARG A 108 -12.682 -11.305 10.362 1.00 73.23 H new ATOM 0 HH11 ARG A 108 -14.277 -9.177 12.728 1.00 1.14 H new ATOM 0 HH12 ARG A 108 -15.573 -10.335 13.047 1.00 1.14 H new ATOM 0 HH21 ARG A 108 -14.392 -12.736 10.722 1.00 45.41 H new ATOM 0 HH22 ARG A 108 -15.637 -12.345 11.913 1.00 45.41 H new ATOM 1698 N ASP A 109 -11.040 -12.051 7.773 1.00 33.20 N ATOM 1699 CA ASP A 109 -10.560 -13.389 8.087 1.00 53.10 C ATOM 1700 C ASP A 109 -9.647 -13.961 6.995 1.00 43.31 C ATOM 1701 O ASP A 109 -8.854 -14.852 7.281 1.00 33.34 O ATOM 1702 CB ASP A 109 -11.747 -14.309 8.393 1.00 70.33 C ATOM 1703 CG ASP A 109 -12.596 -13.799 9.558 1.00 1.32 C ATOM 1704 OD1 ASP A 109 -12.031 -13.111 10.433 1.00 15.41 O ATOM 1705 OD2 ASP A 109 -13.812 -14.090 9.559 1.00 13.43 O ATOM 0 H ASP A 109 -12.045 -12.009 7.602 1.00 33.20 H new ATOM 0 HA ASP A 109 -9.936 -13.323 8.979 1.00 53.10 H new ATOM 0 HB2 ASP A 109 -12.372 -14.399 7.504 1.00 70.33 H new ATOM 0 HB3 ASP A 109 -11.378 -15.308 8.626 1.00 70.33 H new ATOM 1710 N ARG A 110 -9.721 -13.441 5.763 1.00 31.40 N ATOM 1711 CA ARG A 110 -8.840 -13.820 4.664 1.00 72.33 C ATOM 1712 C ARG A 110 -7.376 -13.515 5.021 1.00 22.53 C ATOM 1713 O ARG A 110 -6.509 -14.364 4.824 1.00 73.42 O ATOM 1714 CB ARG A 110 -9.305 -13.106 3.385 1.00 50.12 C ATOM 1715 CG ARG A 110 -8.941 -13.790 2.064 1.00 71.55 C ATOM 1716 CD ARG A 110 -7.432 -13.930 1.856 1.00 73.40 C ATOM 1717 NE ARG A 110 -7.088 -13.980 0.429 1.00 0.31 N ATOM 1718 CZ ARG A 110 -5.833 -14.099 -0.032 1.00 23.25 C ATOM 1719 NH1 ARG A 110 -4.805 -14.094 0.823 1.00 13.12 N ATOM 1720 NH2 ARG A 110 -5.606 -14.228 -1.346 1.00 22.11 N ATOM 0 H ARG A 110 -10.408 -12.734 5.503 1.00 31.40 H new ATOM 0 HA ARG A 110 -8.893 -14.894 4.485 1.00 72.33 H new ATOM 0 HB2 ARG A 110 -10.389 -12.996 3.428 1.00 50.12 H new ATOM 0 HB3 ARG A 110 -8.882 -12.101 3.379 1.00 50.12 H new ATOM 0 HG2 ARG A 110 -9.399 -14.779 2.036 1.00 71.55 H new ATOM 0 HG3 ARG A 110 -9.364 -13.219 1.238 1.00 71.55 H new ATOM 0 HD2 ARG A 110 -6.919 -13.091 2.326 1.00 73.40 H new ATOM 0 HD3 ARG A 110 -7.078 -14.836 2.349 1.00 73.40 H new ATOM 0 HE ARG A 110 -7.846 -13.921 -0.251 1.00 0.31 H new ATOM 0 HH11 ARG A 110 -4.975 -14.000 1.824 1.00 13.12 H new ATOM 0 HH12 ARG A 110 -3.851 -14.184 0.474 1.00 13.12 H new ATOM 0 HH21 ARG A 110 -6.388 -14.236 -2.000 1.00 22.11 H new ATOM 0 HH22 ARG A 110 -4.651 -14.318 -1.692 1.00 22.11 H new ATOM 1734 N LEU A 111 -7.099 -12.323 5.571 1.00 1.24 N ATOM 1735 CA LEU A 111 -5.764 -11.949 6.041 1.00 4.30 C ATOM 1736 C LEU A 111 -5.271 -12.914 7.121 1.00 14.52 C ATOM 1737 O LEU A 111 -4.118 -13.341 7.084 1.00 21.50 O ATOM 1738 CB LEU A 111 -5.768 -10.518 6.598 1.00 44.53 C ATOM 1739 CG LEU A 111 -5.895 -9.454 5.500 1.00 64.23 C ATOM 1740 CD1 LEU A 111 -6.431 -8.159 6.106 1.00 40.23 C ATOM 1741 CD2 LEU A 111 -4.538 -9.156 4.847 1.00 22.53 C ATOM 0 H LEU A 111 -7.799 -11.592 5.701 1.00 1.24 H new ATOM 0 HA LEU A 111 -5.088 -12.001 5.188 1.00 4.30 H new ATOM 0 HB2 LEU A 111 -6.594 -10.409 7.301 1.00 44.53 H new ATOM 0 HB3 LEU A 111 -4.848 -10.348 7.158 1.00 44.53 H new ATOM 0 HG LEU A 111 -6.575 -9.839 4.741 1.00 64.23 H new ATOM 0 HD11 LEU A 111 -6.521 -7.403 5.326 1.00 40.23 H new ATOM 0 HD12 LEU A 111 -7.410 -8.342 6.549 1.00 40.23 H new ATOM 0 HD13 LEU A 111 -5.745 -7.806 6.876 1.00 40.23 H new ATOM 0 HD21 LEU A 111 -4.665 -8.398 4.074 1.00 22.53 H new ATOM 0 HD22 LEU A 111 -3.843 -8.791 5.603 1.00 22.53 H new ATOM 0 HD23 LEU A 111 -4.141 -10.068 4.400 1.00 22.53 H new ATOM 1753 N LEU A 112 -6.142 -13.249 8.081 1.00 4.45 N ATOM 1754 CA LEU A 112 -5.815 -14.154 9.175 1.00 22.23 C ATOM 1755 C LEU A 112 -5.466 -15.543 8.633 1.00 24.52 C ATOM 1756 O LEU A 112 -4.463 -16.130 9.034 1.00 42.31 O ATOM 1757 CB LEU A 112 -6.979 -14.240 10.178 1.00 33.34 C ATOM 1758 CG LEU A 112 -7.458 -12.888 10.734 1.00 23.24 C ATOM 1759 CD1 LEU A 112 -8.561 -13.134 11.769 1.00 23.11 C ATOM 1760 CD2 LEU A 112 -6.320 -12.095 11.383 1.00 45.23 C ATOM 0 H LEU A 112 -7.098 -12.894 8.115 1.00 4.45 H new ATOM 0 HA LEU A 112 -4.945 -13.759 9.699 1.00 22.23 H new ATOM 0 HB2 LEU A 112 -7.820 -14.736 9.694 1.00 33.34 H new ATOM 0 HB3 LEU A 112 -6.674 -14.872 11.012 1.00 33.34 H new ATOM 0 HG LEU A 112 -7.837 -12.298 9.899 1.00 23.24 H new ATOM 0 HD11 LEU A 112 -8.905 -12.180 12.168 1.00 23.11 H new ATOM 0 HD12 LEU A 112 -9.395 -13.652 11.296 1.00 23.11 H new ATOM 0 HD13 LEU A 112 -8.168 -13.746 12.581 1.00 23.11 H new ATOM 0 HD21 LEU A 112 -6.706 -11.148 11.761 1.00 45.23 H new ATOM 0 HD22 LEU A 112 -5.900 -12.671 12.208 1.00 45.23 H new ATOM 0 HD23 LEU A 112 -5.544 -11.901 10.643 1.00 45.23 H new ATOM 1772 N ALA A 113 -6.291 -16.053 7.710 1.00 34.31 N ATOM 1773 CA ALA A 113 -6.131 -17.357 7.082 1.00 72.04 C ATOM 1774 C ALA A 113 -4.828 -17.438 6.284 1.00 13.15 C ATOM 1775 O ALA A 113 -4.125 -18.444 6.362 1.00 41.34 O ATOM 1776 CB ALA A 113 -7.339 -17.636 6.184 1.00 12.14 C ATOM 0 H ALA A 113 -7.111 -15.549 7.374 1.00 34.31 H new ATOM 0 HA ALA A 113 -6.076 -18.117 7.861 1.00 72.04 H new ATOM 0 HB1 ALA A 113 -7.224 -18.611 5.712 1.00 12.14 H new ATOM 0 HB2 ALA A 113 -8.248 -17.629 6.785 1.00 12.14 H new ATOM 0 HB3 ALA A 113 -7.406 -16.866 5.415 1.00 12.14 H new ATOM 1782 N GLU A 114 -4.505 -16.380 5.528 1.00 60.04 N ATOM 1783 CA GLU A 114 -3.265 -16.280 4.770 1.00 31.12 C ATOM 1784 C GLU A 114 -2.063 -16.219 5.722 1.00 34.33 C ATOM 1785 O GLU A 114 -0.990 -16.723 5.395 1.00 52.44 O ATOM 1786 CB GLU A 114 -3.363 -15.049 3.857 1.00 2.21 C ATOM 1787 CG GLU A 114 -2.158 -14.824 2.928 1.00 72.41 C ATOM 1788 CD GLU A 114 -2.074 -15.838 1.790 1.00 72.43 C ATOM 1789 OE1 GLU A 114 -1.645 -16.978 2.064 1.00 33.53 O ATOM 1790 OE2 GLU A 114 -2.432 -15.448 0.656 1.00 44.01 O ATOM 0 H GLU A 114 -5.109 -15.564 5.429 1.00 60.04 H new ATOM 0 HA GLU A 114 -3.115 -17.162 4.147 1.00 31.12 H new ATOM 0 HB2 GLU A 114 -4.261 -15.141 3.245 1.00 2.21 H new ATOM 0 HB3 GLU A 114 -3.491 -14.164 4.480 1.00 2.21 H new ATOM 0 HG2 GLU A 114 -2.215 -13.820 2.507 1.00 72.41 H new ATOM 0 HG3 GLU A 114 -1.241 -14.871 3.516 1.00 72.41 H new ATOM 1797 N GLY A 115 -2.251 -15.622 6.905 1.00 53.34 N ATOM 1798 CA GLY A 115 -1.227 -15.487 7.929 1.00 35.52 C ATOM 1799 C GLY A 115 -0.458 -14.186 7.727 1.00 53.24 C ATOM 1800 O GLY A 115 0.769 -14.172 7.779 1.00 42.53 O ATOM 0 H GLY A 115 -3.145 -15.212 7.176 1.00 53.34 H new ATOM 0 HA2 GLY A 115 -1.686 -15.499 8.918 1.00 35.52 H new ATOM 0 HA3 GLY A 115 -0.543 -16.334 7.885 1.00 35.52 H new ATOM 1804 N VAL A 116 -1.202 -13.101 7.489 1.00 41.01 N ATOM 1805 CA VAL A 116 -0.681 -11.768 7.235 1.00 73.41 C ATOM 1806 C VAL A 116 -0.830 -10.949 8.513 1.00 31.34 C ATOM 1807 O VAL A 116 0.151 -10.418 9.031 1.00 34.21 O ATOM 1808 CB VAL A 116 -1.442 -11.140 6.054 1.00 2.21 C ATOM 1809 CG1 VAL A 116 -0.975 -9.703 5.798 1.00 73.54 C ATOM 1810 CG2 VAL A 116 -1.232 -11.968 4.781 1.00 21.44 C ATOM 0 H VAL A 116 -2.221 -13.136 7.469 1.00 41.01 H new ATOM 0 HA VAL A 116 0.374 -11.799 6.963 1.00 73.41 H new ATOM 0 HB VAL A 116 -2.500 -11.128 6.314 1.00 2.21 H new ATOM 0 HG11 VAL A 116 -1.530 -9.284 4.958 1.00 73.54 H new ATOM 0 HG12 VAL A 116 -1.153 -9.099 6.688 1.00 73.54 H new ATOM 0 HG13 VAL A 116 0.090 -9.702 5.566 1.00 73.54 H new ATOM 0 HG21 VAL A 116 -1.777 -11.510 3.955 1.00 21.44 H new ATOM 0 HG22 VAL A 116 -0.169 -12.002 4.540 1.00 21.44 H new ATOM 0 HG23 VAL A 116 -1.600 -12.981 4.941 1.00 21.44 H new ATOM 1820 N CYS A 117 -2.067 -10.862 9.012 1.00 63.23 N ATOM 1821 CA CYS A 117 -2.409 -10.179 10.248 1.00 52.20 C ATOM 1822 C CYS A 117 -2.664 -11.200 11.353 1.00 31.14 C ATOM 1823 O CYS A 117 -2.991 -12.355 11.085 1.00 14.05 O ATOM 1824 CB CYS A 117 -3.650 -9.310 10.027 1.00 31.32 C ATOM 1825 SG CYS A 117 -3.244 -7.940 8.919 1.00 0.35 S ATOM 0 H CYS A 117 -2.875 -11.279 8.549 1.00 63.23 H new ATOM 0 HA CYS A 117 -1.579 -9.540 10.551 1.00 52.20 H new ATOM 0 HB2 CYS A 117 -4.454 -9.909 9.601 1.00 31.32 H new ATOM 0 HB3 CYS A 117 -4.011 -8.925 10.981 1.00 31.32 H new ATOM 0 HG CYS A 117 -3.652 -6.823 9.443 1.00 0.35 H new ATOM 1831 N ASP A 118 -2.527 -10.735 12.597 1.00 74.12 N ATOM 1832 CA ASP A 118 -2.890 -11.454 13.809 1.00 42.24 C ATOM 1833 C ASP A 118 -4.303 -11.035 14.240 1.00 63.33 C ATOM 1834 O ASP A 118 -4.858 -10.074 13.704 1.00 44.11 O ATOM 1835 CB ASP A 118 -1.835 -11.162 14.891 1.00 14.45 C ATOM 1836 CG ASP A 118 -2.066 -11.928 16.193 1.00 44.53 C ATOM 1837 OD1 ASP A 118 -2.490 -13.101 16.103 1.00 23.22 O ATOM 1838 OD2 ASP A 118 -1.831 -11.318 17.258 1.00 21.00 O ATOM 0 H ASP A 118 -2.144 -9.809 12.789 1.00 74.12 H new ATOM 0 HA ASP A 118 -2.907 -12.531 13.639 1.00 42.24 H new ATOM 0 HB2 ASP A 118 -0.848 -11.413 14.502 1.00 14.45 H new ATOM 0 HB3 ASP A 118 -1.831 -10.093 15.104 1.00 14.45 H new ATOM 1843 N ASN A 119 -4.864 -11.779 15.202 1.00 3.14 N ATOM 1844 CA ASN A 119 -6.203 -11.643 15.767 1.00 24.23 C ATOM 1845 C ASN A 119 -6.697 -10.197 15.844 1.00 52.34 C ATOM 1846 O ASN A 119 -7.761 -9.892 15.309 1.00 62.15 O ATOM 1847 CB ASN A 119 -6.221 -12.299 17.153 1.00 62.31 C ATOM 1848 CG ASN A 119 -7.599 -12.195 17.804 1.00 64.21 C ATOM 1849 OD1 ASN A 119 -8.502 -12.959 17.471 1.00 51.30 O ATOM 1850 ND2 ASN A 119 -7.770 -11.249 18.730 1.00 22.51 N ATOM 0 H ASN A 119 -4.351 -12.548 15.634 1.00 3.14 H new ATOM 0 HA ASN A 119 -6.896 -12.147 15.093 1.00 24.23 H new ATOM 0 HB2 ASN A 119 -5.938 -13.348 17.064 1.00 62.31 H new ATOM 0 HB3 ASN A 119 -5.478 -11.822 17.792 1.00 62.31 H new ATOM 0 HD21 ASN A 119 -8.675 -11.141 19.188 1.00 22.51 H new ATOM 0 HD22 ASN A 119 -6.996 -10.634 18.979 1.00 22.51 H new ATOM 1857 N ASP A 120 -5.934 -9.322 16.513 1.00 74.01 N ATOM 1858 CA ASP A 120 -6.276 -7.921 16.702 1.00 64.13 C ATOM 1859 C ASP A 120 -5.104 -7.047 16.297 1.00 31.10 C ATOM 1860 O ASP A 120 -4.379 -6.466 17.100 1.00 1.44 O ATOM 1861 CB ASP A 120 -6.814 -7.642 18.093 1.00 44.24 C ATOM 1862 CG ASP A 120 -5.902 -8.093 19.235 1.00 72.41 C ATOM 1863 OD1 ASP A 120 -5.764 -9.325 19.403 1.00 53.53 O ATOM 1864 OD2 ASP A 120 -5.380 -7.197 19.934 1.00 12.51 O ATOM 0 H ASP A 120 -5.046 -9.581 16.943 1.00 74.01 H new ATOM 0 HA ASP A 120 -7.105 -7.663 16.042 1.00 64.13 H new ATOM 0 HB2 ASP A 120 -6.992 -6.571 18.190 1.00 44.24 H new ATOM 0 HB3 ASP A 120 -7.779 -8.137 18.200 1.00 44.24 H new ATOM 1869 N THR A 121 -4.997 -6.980 14.978 1.00 31.12 N ATOM 1870 CA THR A 121 -4.113 -6.130 14.196 1.00 65.42 C ATOM 1871 C THR A 121 -4.821 -5.791 12.880 1.00 2.23 C ATOM 1872 O THR A 121 -4.824 -4.640 12.447 1.00 13.21 O ATOM 1873 CB THR A 121 -2.757 -6.807 13.934 1.00 61.25 C ATOM 1874 OG1 THR A 121 -2.936 -8.018 13.235 1.00 71.32 O ATOM 1875 CG2 THR A 121 -1.967 -7.084 15.215 1.00 72.13 C ATOM 0 H THR A 121 -5.575 -7.568 14.378 1.00 31.12 H new ATOM 0 HA THR A 121 -3.899 -5.218 14.754 1.00 65.42 H new ATOM 0 HB THR A 121 -2.180 -6.104 13.334 1.00 61.25 H new ATOM 0 HG1 THR A 121 -3.625 -8.554 13.681 1.00 71.32 H new ATOM 0 HG21 THR A 121 -1.021 -7.562 14.963 1.00 72.13 H new ATOM 0 HG22 THR A 121 -1.772 -6.145 15.733 1.00 72.13 H new ATOM 0 HG23 THR A 121 -2.545 -7.743 15.863 1.00 72.13 H new ATOM 1883 N VAL A 122 -5.441 -6.815 12.275 1.00 71.54 N ATOM 1884 CA VAL A 122 -6.324 -6.754 11.120 1.00 13.44 C ATOM 1885 C VAL A 122 -7.299 -5.568 11.222 1.00 43.35 C ATOM 1886 O VAL A 122 -7.863 -5.343 12.294 1.00 22.11 O ATOM 1887 CB VAL A 122 -7.062 -8.106 11.023 1.00 74.30 C ATOM 1888 CG1 VAL A 122 -8.107 -8.314 12.131 1.00 74.33 C ATOM 1889 CG2 VAL A 122 -7.715 -8.299 9.655 1.00 35.50 C ATOM 0 H VAL A 122 -5.325 -7.771 12.610 1.00 71.54 H new ATOM 0 HA VAL A 122 -5.748 -6.586 10.210 1.00 13.44 H new ATOM 0 HB VAL A 122 -6.288 -8.862 11.160 1.00 74.30 H new ATOM 0 HG11 VAL A 122 -8.587 -9.284 12.001 1.00 74.33 H new ATOM 0 HG12 VAL A 122 -7.617 -8.279 13.104 1.00 74.33 H new ATOM 0 HG13 VAL A 122 -8.859 -7.527 12.074 1.00 74.33 H new ATOM 0 HG21 VAL A 122 -8.224 -9.262 9.627 1.00 35.50 H new ATOM 0 HG22 VAL A 122 -8.438 -7.502 9.481 1.00 35.50 H new ATOM 0 HG23 VAL A 122 -6.950 -8.271 8.879 1.00 35.50 H new ATOM 1899 N PRO A 123 -7.502 -4.787 10.147 1.00 23.32 N ATOM 1900 CA PRO A 123 -8.369 -3.624 10.188 1.00 42.24 C ATOM 1901 C PRO A 123 -9.837 -4.032 10.281 1.00 73.21 C ATOM 1902 O PRO A 123 -10.261 -5.046 9.727 1.00 34.22 O ATOM 1903 CB PRO A 123 -8.090 -2.836 8.909 1.00 2.32 C ATOM 1904 CG PRO A 123 -7.596 -3.908 7.941 1.00 12.22 C ATOM 1905 CD PRO A 123 -6.850 -4.882 8.853 1.00 73.00 C ATOM 0 HA PRO A 123 -8.170 -3.017 11.071 1.00 42.24 H new ATOM 0 HB2 PRO A 123 -8.987 -2.340 8.538 1.00 2.32 H new ATOM 0 HB3 PRO A 123 -7.340 -2.061 9.069 1.00 2.32 H new ATOM 0 HG2 PRO A 123 -8.422 -4.394 7.422 1.00 12.22 H new ATOM 0 HG3 PRO A 123 -6.941 -3.490 7.176 1.00 12.22 H new ATOM 0 HD2 PRO A 123 -6.899 -5.899 8.464 1.00 73.00 H new ATOM 0 HD3 PRO A 123 -5.795 -4.620 8.926 1.00 73.00 H new ATOM 1913 N SER A 124 -10.605 -3.201 10.987 1.00 30.04 N ATOM 1914 CA SER A 124 -12.040 -3.339 11.159 1.00 60.25 C ATOM 1915 C SER A 124 -12.790 -3.099 9.850 1.00 25.03 C ATOM 1916 O SER A 124 -12.302 -2.407 8.956 1.00 5.23 O ATOM 1917 CB SER A 124 -12.500 -2.315 12.201 1.00 42.42 C ATOM 1918 OG SER A 124 -11.999 -2.651 13.477 1.00 11.30 O ATOM 0 H SER A 124 -10.225 -2.386 11.469 1.00 30.04 H new ATOM 0 HA SER A 124 -12.258 -4.356 11.485 1.00 60.25 H new ATOM 0 HB2 SER A 124 -12.156 -1.320 11.919 1.00 42.42 H new ATOM 0 HB3 SER A 124 -13.589 -2.279 12.229 1.00 42.42 H new ATOM 0 HG SER A 124 -12.300 -1.987 14.132 1.00 11.30 H new ATOM 1924 N VAL A 125 -14.025 -3.608 9.788 1.00 64.04 N ATOM 1925 CA VAL A 125 -14.993 -3.267 8.755 1.00 0.13 C ATOM 1926 C VAL A 125 -15.298 -1.764 8.806 1.00 2.41 C ATOM 1927 O VAL A 125 -15.437 -1.122 7.770 1.00 60.31 O ATOM 1928 CB VAL A 125 -16.253 -4.132 8.926 1.00 12.45 C ATOM 1929 CG1 VAL A 125 -17.319 -3.781 7.878 1.00 41.02 C ATOM 1930 CG2 VAL A 125 -15.877 -5.612 8.788 1.00 40.14 C ATOM 0 H VAL A 125 -14.380 -4.279 10.469 1.00 64.04 H new ATOM 0 HA VAL A 125 -14.584 -3.479 7.767 1.00 0.13 H new ATOM 0 HB VAL A 125 -16.667 -3.937 9.915 1.00 12.45 H new ATOM 0 HG11 VAL A 125 -18.196 -4.410 8.027 1.00 41.02 H new ATOM 0 HG12 VAL A 125 -17.602 -2.734 7.983 1.00 41.02 H new ATOM 0 HG13 VAL A 125 -16.917 -3.950 6.879 1.00 41.02 H new ATOM 0 HG21 VAL A 125 -16.769 -6.227 8.909 1.00 40.14 H new ATOM 0 HG22 VAL A 125 -15.446 -5.788 7.802 1.00 40.14 H new ATOM 0 HG23 VAL A 125 -15.148 -5.875 9.555 1.00 40.14 H new ATOM 1940 N SER A 126 -15.348 -1.191 10.013 1.00 22.11 N ATOM 1941 CA SER A 126 -15.411 0.250 10.210 1.00 33.31 C ATOM 1942 C SER A 126 -14.171 0.951 9.632 1.00 23.53 C ATOM 1943 O SER A 126 -14.279 2.056 9.102 1.00 70.11 O ATOM 1944 CB SER A 126 -15.560 0.546 11.708 1.00 61.13 C ATOM 1945 OG SER A 126 -15.691 1.936 11.922 1.00 13.20 O ATOM 0 H SER A 126 -15.346 -1.723 10.883 1.00 22.11 H new ATOM 0 HA SER A 126 -16.276 0.642 9.675 1.00 33.31 H new ATOM 0 HB2 SER A 126 -16.433 0.026 12.103 1.00 61.13 H new ATOM 0 HB3 SER A 126 -14.692 0.168 12.248 1.00 61.13 H new ATOM 0 HG SER A 126 -15.787 2.112 12.881 1.00 13.20 H new ATOM 1951 N SER A 127 -12.992 0.320 9.740 1.00 44.45 N ATOM 1952 CA SER A 127 -11.721 0.952 9.415 1.00 42.14 C ATOM 1953 C SER A 127 -11.407 0.906 7.921 1.00 15.34 C ATOM 1954 O SER A 127 -10.582 1.698 7.478 1.00 44.14 O ATOM 1955 CB SER A 127 -10.578 0.360 10.247 1.00 64.12 C ATOM 1956 OG SER A 127 -9.375 1.061 9.995 1.00 12.43 O ATOM 0 H SER A 127 -12.902 -0.645 10.057 1.00 44.45 H new ATOM 0 HA SER A 127 -11.818 2.005 9.678 1.00 42.14 H new ATOM 0 HB2 SER A 127 -10.824 0.415 11.307 1.00 64.12 H new ATOM 0 HB3 SER A 127 -10.450 -0.695 10.004 1.00 64.12 H new ATOM 0 HG SER A 127 -8.653 0.675 10.533 1.00 12.43 H new ATOM 1962 N ILE A 128 -12.044 0.016 7.149 1.00 21.52 N ATOM 1963 CA ILE A 128 -12.057 0.103 5.690 1.00 61.41 C ATOM 1964 C ILE A 128 -13.168 1.068 5.246 1.00 42.52 C ATOM 1965 O ILE A 128 -12.939 1.923 4.390 1.00 11.44 O ATOM 1966 CB ILE A 128 -12.163 -1.290 5.031 1.00 20.35 C ATOM 1967 CG1 ILE A 128 -13.514 -1.954 5.334 1.00 41.54 C ATOM 1968 CG2 ILE A 128 -10.989 -2.180 5.456 1.00 11.31 C ATOM 1969 CD1 ILE A 128 -13.626 -3.410 4.900 1.00 31.44 C ATOM 0 H ILE A 128 -12.562 -0.780 7.520 1.00 21.52 H new ATOM 0 HA ILE A 128 -11.105 0.509 5.346 1.00 61.41 H new ATOM 0 HB ILE A 128 -12.108 -1.157 3.951 1.00 20.35 H new ATOM 0 HG12 ILE A 128 -13.699 -1.895 6.407 1.00 41.54 H new ATOM 0 HG13 ILE A 128 -14.301 -1.382 4.843 1.00 41.54 H new ATOM 0 HG21 ILE A 128 -11.082 -3.157 4.981 1.00 11.31 H new ATOM 0 HG22 ILE A 128 -10.051 -1.716 5.150 1.00 11.31 H new ATOM 0 HG23 ILE A 128 -10.998 -2.301 6.539 1.00 11.31 H new ATOM 0 HD11 ILE A 128 -14.615 -3.791 5.156 1.00 31.44 H new ATOM 0 HD12 ILE A 128 -13.478 -3.481 3.822 1.00 31.44 H new ATOM 0 HD13 ILE A 128 -12.866 -4.001 5.410 1.00 31.44 H new ATOM 1981 N ASN A 129 -14.363 0.946 5.848 1.00 22.02 N ATOM 1982 CA ASN A 129 -15.552 1.731 5.527 1.00 42.25 C ATOM 1983 C ASN A 129 -15.277 3.232 5.560 1.00 25.54 C ATOM 1984 O ASN A 129 -15.650 3.931 4.623 1.00 71.20 O ATOM 1985 CB ASN A 129 -16.685 1.377 6.498 1.00 11.32 C ATOM 1986 CG ASN A 129 -17.930 2.230 6.274 1.00 53.13 C ATOM 1987 OD1 ASN A 129 -18.154 3.207 6.985 1.00 55.32 O ATOM 1988 ND2 ASN A 129 -18.750 1.864 5.287 1.00 43.55 N ATOM 0 H ASN A 129 -14.526 0.273 6.597 1.00 22.02 H new ATOM 0 HA ASN A 129 -15.849 1.481 4.509 1.00 42.25 H new ATOM 0 HB2 ASN A 129 -16.943 0.324 6.382 1.00 11.32 H new ATOM 0 HB3 ASN A 129 -16.337 1.509 7.522 1.00 11.32 H new ATOM 0 HD21 ASN A 129 -19.597 2.402 5.102 1.00 43.55 H new ATOM 0 HD22 ASN A 129 -18.530 1.047 4.718 1.00 43.55 H new ATOM 1995 N ARG A 130 -14.640 3.722 6.632 1.00 40.42 N ATOM 1996 CA ARG A 130 -14.376 5.144 6.839 1.00 74.02 C ATOM 1997 C ARG A 130 -13.667 5.819 5.654 1.00 23.34 C ATOM 1998 O ARG A 130 -13.861 7.013 5.437 1.00 31.44 O ATOM 1999 CB ARG A 130 -13.638 5.369 8.169 1.00 53.03 C ATOM 2000 CG ARG A 130 -12.220 4.788 8.181 1.00 11.11 C ATOM 2001 CD ARG A 130 -11.556 4.954 9.552 1.00 64.03 C ATOM 2002 NE ARG A 130 -10.300 4.195 9.637 1.00 43.23 N ATOM 2003 CZ ARG A 130 -9.160 4.475 8.986 1.00 70.43 C ATOM 2004 NH1 ARG A 130 -9.040 5.588 8.248 1.00 20.33 N ATOM 2005 NH2 ARG A 130 -8.130 3.623 9.076 1.00 54.20 N ATOM 0 H ARG A 130 -14.291 3.131 7.387 1.00 40.42 H new ATOM 0 HA ARG A 130 -15.346 5.638 6.900 1.00 74.02 H new ATOM 0 HB2 ARG A 130 -13.587 6.439 8.372 1.00 53.03 H new ATOM 0 HB3 ARG A 130 -14.215 4.919 8.977 1.00 53.03 H new ATOM 0 HG2 ARG A 130 -12.257 3.731 7.919 1.00 11.11 H new ATOM 0 HG3 ARG A 130 -11.616 5.284 7.421 1.00 11.11 H new ATOM 0 HD2 ARG A 130 -11.358 6.010 9.736 1.00 64.03 H new ATOM 0 HD3 ARG A 130 -12.239 4.617 10.332 1.00 64.03 H new ATOM 0 HE ARG A 130 -10.294 3.379 10.248 1.00 43.23 H new ATOM 0 HH11 ARG A 130 -9.823 6.238 8.175 1.00 20.33 H new ATOM 0 HH12 ARG A 130 -8.166 5.785 7.760 1.00 20.33 H new ATOM 0 HH21 ARG A 130 -8.218 2.774 9.634 1.00 54.20 H new ATOM 0 HH22 ARG A 130 -7.258 3.824 8.586 1.00 54.20 H new ATOM 2019 N ILE A 131 -12.873 5.075 4.870 1.00 44.21 N ATOM 2020 CA ILE A 131 -12.238 5.582 3.665 1.00 24.24 C ATOM 2021 C ILE A 131 -13.289 5.690 2.558 1.00 74.43 C ATOM 2022 O ILE A 131 -13.479 6.766 1.996 1.00 33.25 O ATOM 2023 CB ILE A 131 -11.048 4.686 3.264 1.00 20.25 C ATOM 2024 CG1 ILE A 131 -9.973 4.652 4.366 1.00 13.41 C ATOM 2025 CG2 ILE A 131 -10.404 5.214 1.974 1.00 35.13 C ATOM 2026 CD1 ILE A 131 -10.172 3.527 5.382 1.00 4.54 C ATOM 0 H ILE A 131 -12.658 4.097 5.064 1.00 44.21 H new ATOM 0 HA ILE A 131 -11.830 6.577 3.844 1.00 24.24 H new ATOM 0 HB ILE A 131 -11.434 3.678 3.113 1.00 20.25 H new ATOM 0 HG12 ILE A 131 -8.993 4.542 3.902 1.00 13.41 H new ATOM 0 HG13 ILE A 131 -9.972 5.608 4.890 1.00 13.41 H new ATOM 0 HG21 ILE A 131 -9.565 4.575 1.698 1.00 35.13 H new ATOM 0 HG22 ILE A 131 -11.141 5.211 1.171 1.00 35.13 H new ATOM 0 HG23 ILE A 131 -10.048 6.232 2.135 1.00 35.13 H new ATOM 0 HD11 ILE A 131 -9.378 3.565 6.128 1.00 4.54 H new ATOM 0 HD12 ILE A 131 -11.137 3.647 5.874 1.00 4.54 H new ATOM 0 HD13 ILE A 131 -10.143 2.565 4.870 1.00 4.54 H new ATOM 2038 N ILE A 132 -13.976 4.583 2.254 1.00 53.32 N ATOM 2039 CA ILE A 132 -14.991 4.502 1.205 1.00 64.13 C ATOM 2040 C ILE A 132 -16.060 5.587 1.393 1.00 21.32 C ATOM 2041 O ILE A 132 -16.502 6.179 0.411 1.00 23.45 O ATOM 2042 CB ILE A 132 -15.613 3.090 1.143 1.00 53.03 C ATOM 2043 CG1 ILE A 132 -14.525 2.011 0.956 1.00 2.53 C ATOM 2044 CG2 ILE A 132 -16.625 3.011 -0.015 1.00 53.23 C ATOM 2045 CD1 ILE A 132 -15.072 0.581 1.025 1.00 30.41 C ATOM 0 H ILE A 132 -13.836 3.699 2.744 1.00 53.32 H new ATOM 0 HA ILE A 132 -14.506 4.684 0.246 1.00 64.13 H new ATOM 0 HB ILE A 132 -16.124 2.904 2.088 1.00 53.03 H new ATOM 0 HG12 ILE A 132 -14.037 2.160 -0.007 1.00 2.53 H new ATOM 0 HG13 ILE A 132 -13.761 2.138 1.723 1.00 2.53 H new ATOM 0 HG21 ILE A 132 -17.059 2.012 -0.051 1.00 53.23 H new ATOM 0 HG22 ILE A 132 -17.416 3.744 0.142 1.00 53.23 H new ATOM 0 HG23 ILE A 132 -16.118 3.221 -0.957 1.00 53.23 H new ATOM 0 HD11 ILE A 132 -14.256 -0.128 0.886 1.00 30.41 H new ATOM 0 HD12 ILE A 132 -15.535 0.415 1.998 1.00 30.41 H new ATOM 0 HD13 ILE A 132 -15.815 0.437 0.240 1.00 30.41 H new ATOM 2057 N ARG A 133 -16.451 5.860 2.646 1.00 10.23 N ATOM 2058 CA ARG A 133 -17.383 6.918 3.023 1.00 54.02 C ATOM 2059 C ARG A 133 -17.025 8.250 2.361 1.00 35.14 C ATOM 2060 O ARG A 133 -17.887 8.873 1.745 1.00 52.11 O ATOM 2061 CB ARG A 133 -17.392 7.080 4.551 1.00 64.22 C ATOM 2062 CG ARG A 133 -18.142 5.947 5.265 1.00 15.22 C ATOM 2063 CD ARG A 133 -19.648 6.217 5.363 1.00 4.12 C ATOM 2064 NE ARG A 133 -19.928 7.345 6.262 1.00 63.52 N ATOM 2065 CZ ARG A 133 -21.137 7.888 6.473 1.00 22.23 C ATOM 2066 NH1 ARG A 133 -22.225 7.405 5.856 1.00 34.14 N ATOM 2067 NH2 ARG A 133 -21.256 8.926 7.313 1.00 30.23 N ATOM 0 H ARG A 133 -16.112 5.329 3.448 1.00 10.23 H new ATOM 0 HA ARG A 133 -18.375 6.630 2.676 1.00 54.02 H new ATOM 0 HB2 ARG A 133 -16.365 7.115 4.914 1.00 64.22 H new ATOM 0 HB3 ARG A 133 -17.853 8.033 4.808 1.00 64.22 H new ATOM 0 HG2 ARG A 133 -17.977 5.012 4.730 1.00 15.22 H new ATOM 0 HG3 ARG A 133 -17.732 5.818 6.267 1.00 15.22 H new ATOM 0 HD2 ARG A 133 -20.047 6.431 4.372 1.00 4.12 H new ATOM 0 HD3 ARG A 133 -20.157 5.324 5.726 1.00 4.12 H new ATOM 0 HE ARG A 133 -19.139 7.748 6.767 1.00 63.52 H new ATOM 0 HH11 ARG A 133 -22.140 6.615 5.217 1.00 34.14 H new ATOM 0 HH12 ARG A 133 -23.138 7.828 6.026 1.00 34.14 H new ATOM 0 HH21 ARG A 133 -20.432 9.297 7.786 1.00 30.23 H new ATOM 0 HH22 ARG A 133 -22.171 9.345 7.479 1.00 30.23 H new ATOM 2081 N THR A 134 -15.766 8.686 2.492 1.00 43.35 N ATOM 2082 CA THR A 134 -15.325 9.970 1.962 1.00 21.43 C ATOM 2083 C THR A 134 -15.363 9.999 0.430 1.00 72.33 C ATOM 2084 O THR A 134 -15.584 11.062 -0.146 1.00 53.40 O ATOM 2085 CB THR A 134 -13.945 10.366 2.513 1.00 31.23 C ATOM 2086 OG1 THR A 134 -12.939 9.470 2.091 1.00 51.40 O ATOM 2087 CG2 THR A 134 -13.948 10.445 4.043 1.00 41.45 C ATOM 0 H THR A 134 -15.033 8.158 2.966 1.00 43.35 H new ATOM 0 HA THR A 134 -16.034 10.722 2.307 1.00 21.43 H new ATOM 0 HB THR A 134 -13.725 11.355 2.111 1.00 31.23 H new ATOM 0 HG1 THR A 134 -13.286 8.554 2.114 1.00 51.40 H new ATOM 0 HG21 THR A 134 -12.956 10.727 4.395 1.00 41.45 H new ATOM 0 HG22 THR A 134 -14.674 11.191 4.367 1.00 41.45 H new ATOM 0 HG23 THR A 134 -14.217 9.473 4.457 1.00 41.45 H new