USER MOD reduce.3.24.130724 H: found=0, std=0, add=789, rem=0, adj=10 USER MOD reduce.3.24.130724 removed 786 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 Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 4 GLN : amide:sc= 0 X(o=0,f=-0.031) USER MOD Single : A 6 HIS : no HD1:sc= -1.98 X(o=-2,f=-2.4) USER MOD Single : A 7 TYR OH : rot 150:sc= -2.39 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 HIS : no HD1:sc= -0.18 X(o=-0.18,f=-0.049) USER MOD Single : A 17 THR OG1 : rot 64:sc= 1.26 USER MOD Single : A 24 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 31 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 SER OG : rot 120:sc= 0.00769 USER MOD Single : A 43 LYS NZ :NH3+ 160:sc= 0.148 (180deg=0.055) USER MOD Single : A 52 ASN : amide:sc= -0.34 X(o=-0.34,f=-0.012) USER MOD Single : A 54 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 ASN : amide:sc= -0.0198 X(o=-0.02,f=0) USER MOD Single : A 61 ASN : amide:sc= -1.04 K(o=-1,f=-4.7!) USER MOD Single : A 62 SER OG : rot 170:sc= -0.758 USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 79 HIS : no HD1:sc= -0.409 X(o=-0.41,f=-0.016) USER MOD Single : A 89 GLN : amide:sc= 0.636 K(o=0.64,f=-2.8!) USER MOD Single : A 92 HIS : no HD1:sc= 0 X(o=0,f=-0.0094) USER MOD ----------------------------------------------------------------- ATOM 22 N SER A 3 5.853 -1.960 -2.174 1.00 41.43 N ATOM 23 CA SER A 3 6.076 -3.052 -3.114 1.00 32.20 C ATOM 24 C SER A 3 7.555 -3.169 -3.471 1.00 14.02 C ATOM 25 O SER A 3 8.117 -4.264 -3.479 1.00 12.40 O ATOM 26 CB SER A 3 5.249 -2.838 -4.383 1.00 74.20 C ATOM 27 OG SER A 3 4.076 -3.634 -4.368 1.00 65.41 O ATOM 0 HA SER A 3 5.761 -3.980 -2.636 1.00 32.20 H new ATOM 0 HB2 SER A 3 4.977 -1.786 -4.471 1.00 74.20 H new ATOM 0 HB3 SER A 3 5.849 -3.086 -5.258 1.00 74.20 H new ATOM 0 HG SER A 3 3.564 -3.478 -5.189 1.00 65.41 H new ATOM 33 N GLN A 4 8.177 -2.032 -3.765 1.00 63.32 N ATOM 34 CA GLN A 4 9.590 -2.007 -4.124 1.00 4.43 C ATOM 35 C GLN A 4 10.468 -2.004 -2.877 1.00 24.43 C ATOM 36 O GLN A 4 10.331 -1.140 -2.011 1.00 11.23 O ATOM 37 CB GLN A 4 9.899 -0.778 -4.981 1.00 55.20 C ATOM 38 CG GLN A 4 9.490 0.535 -4.332 1.00 60.20 C ATOM 39 CD GLN A 4 8.457 1.291 -5.144 1.00 63.13 C ATOM 40 OE1 GLN A 4 7.258 1.206 -4.879 1.00 31.14 O ATOM 41 NE2 GLN A 4 8.918 2.037 -6.142 1.00 23.25 N ATOM 0 H GLN A 4 7.726 -1.117 -3.762 1.00 63.32 H new ATOM 0 HA GLN A 4 9.808 -2.907 -4.699 1.00 4.43 H new ATOM 0 HB2 GLN A 4 10.968 -0.752 -5.192 1.00 55.20 H new ATOM 0 HB3 GLN A 4 9.387 -0.875 -5.939 1.00 55.20 H new ATOM 0 HG2 GLN A 4 9.090 0.335 -3.338 1.00 60.20 H new ATOM 0 HG3 GLN A 4 10.372 1.161 -4.201 1.00 60.20 H new ATOM 0 HE21 GLN A 4 9.920 2.079 -6.327 1.00 23.25 H new ATOM 0 HE22 GLN A 4 8.270 2.568 -6.723 1.00 23.25 H new ATOM 50 N ILE A 5 11.370 -2.977 -2.792 1.00 74.00 N ATOM 51 CA ILE A 5 12.270 -3.086 -1.651 1.00 62.21 C ATOM 52 C ILE A 5 13.667 -3.509 -2.092 1.00 44.30 C ATOM 53 O ILE A 5 13.836 -4.142 -3.135 1.00 23.14 O ATOM 54 CB ILE A 5 11.744 -4.096 -0.613 1.00 44.45 C ATOM 55 CG1 ILE A 5 12.240 -3.726 0.786 1.00 13.02 C ATOM 56 CG2 ILE A 5 12.179 -5.507 -0.980 1.00 3.33 C ATOM 57 CD1 ILE A 5 11.668 -2.425 1.306 1.00 71.43 C ATOM 0 H ILE A 5 11.496 -3.701 -3.500 1.00 74.00 H new ATOM 0 HA ILE A 5 12.319 -2.098 -1.192 1.00 62.21 H new ATOM 0 HB ILE A 5 10.655 -4.062 -0.613 1.00 44.45 H new ATOM 0 HG12 ILE A 5 11.983 -4.528 1.478 1.00 13.02 H new ATOM 0 HG13 ILE A 5 13.328 -3.655 0.770 1.00 13.02 H new ATOM 0 HG21 ILE A 5 11.800 -6.209 -0.238 1.00 3.33 H new ATOM 0 HG22 ILE A 5 11.782 -5.767 -1.961 1.00 3.33 H new ATOM 0 HG23 ILE A 5 13.268 -5.557 -1.005 1.00 3.33 H new ATOM 0 HD11 ILE A 5 12.063 -2.226 2.302 1.00 71.43 H new ATOM 0 HD12 ILE A 5 11.947 -1.612 0.636 1.00 71.43 H new ATOM 0 HD13 ILE A 5 10.582 -2.499 1.355 1.00 71.43 H new ATOM 69 N HIS A 6 14.667 -3.155 -1.290 1.00 62.34 N ATOM 70 CA HIS A 6 16.051 -3.500 -1.597 1.00 0.05 C ATOM 71 C HIS A 6 16.799 -3.916 -0.334 1.00 24.12 C ATOM 72 O HIS A 6 16.671 -3.281 0.713 1.00 22.13 O ATOM 73 CB HIS A 6 16.759 -2.317 -2.257 1.00 4.33 C ATOM 74 CG HIS A 6 15.962 -1.675 -3.350 1.00 72.31 C ATOM 75 ND1 HIS A 6 14.851 -0.894 -3.112 1.00 51.23 N ATOM 76 CD2 HIS A 6 16.121 -1.702 -4.694 1.00 54.31 C ATOM 77 CE1 HIS A 6 14.360 -0.469 -4.263 1.00 12.34 C ATOM 78 NE2 HIS A 6 15.112 -0.945 -5.238 1.00 44.52 N ATOM 0 H HIS A 6 14.545 -2.630 -0.424 1.00 62.34 H new ATOM 0 HA HIS A 6 16.045 -4.342 -2.289 1.00 0.05 H new ATOM 0 HB2 HIS A 6 16.985 -1.570 -1.497 1.00 4.33 H new ATOM 0 HB3 HIS A 6 17.712 -2.656 -2.664 1.00 4.33 H new ATOM 0 HD2 HIS A 6 16.896 -2.222 -5.237 1.00 54.31 H new ATOM 0 HE1 HIS A 6 13.491 0.161 -4.385 1.00 12.34 H new ATOM 0 HE2 HIS A 6 14.967 -0.778 -6.234 1.00 44.52 H new ATOM 86 N TYR A 7 17.580 -4.986 -0.440 1.00 13.21 N ATOM 87 CA TYR A 7 18.346 -5.489 0.694 1.00 11.52 C ATOM 88 C TYR A 7 19.845 -5.374 0.433 1.00 74.22 C ATOM 89 O TYR A 7 20.271 -5.078 -0.683 1.00 54.44 O ATOM 90 CB TYR A 7 17.976 -6.945 0.981 1.00 45.13 C ATOM 91 CG TYR A 7 16.487 -7.203 0.979 1.00 33.33 C ATOM 92 CD1 TYR A 7 15.597 -6.260 1.479 1.00 25.34 C ATOM 93 CD2 TYR A 7 15.968 -8.391 0.477 1.00 44.55 C ATOM 94 CE1 TYR A 7 14.236 -6.493 1.481 1.00 52.33 C ATOM 95 CE2 TYR A 7 14.608 -8.631 0.472 1.00 10.14 C ATOM 96 CZ TYR A 7 13.746 -7.679 0.976 1.00 71.20 C ATOM 97 OH TYR A 7 12.390 -7.914 0.974 1.00 10.11 O ATOM 0 H TYR A 7 17.699 -5.521 -1.300 1.00 13.21 H new ATOM 0 HA TYR A 7 18.100 -4.881 1.565 1.00 11.52 H new ATOM 0 HB2 TYR A 7 18.448 -7.585 0.235 1.00 45.13 H new ATOM 0 HB3 TYR A 7 18.384 -7.231 1.950 1.00 45.13 H new ATOM 0 HD1 TYR A 7 15.976 -5.329 1.873 1.00 25.34 H new ATOM 0 HD2 TYR A 7 16.640 -9.139 0.084 1.00 44.55 H new ATOM 0 HE1 TYR A 7 13.559 -5.750 1.876 1.00 52.33 H new ATOM 0 HE2 TYR A 7 14.222 -9.558 0.076 1.00 10.14 H new ATOM 0 HH TYR A 7 12.159 -8.492 0.217 1.00 10.11 H new ATOM 107 N SER A 8 20.640 -5.613 1.471 1.00 14.50 N ATOM 108 CA SER A 8 22.091 -5.534 1.356 1.00 1.53 C ATOM 109 C SER A 8 22.744 -6.831 1.822 1.00 63.43 C ATOM 110 O SER A 8 22.882 -7.074 3.021 1.00 64.00 O ATOM 111 CB SER A 8 22.626 -4.358 2.176 1.00 15.23 C ATOM 112 OG SER A 8 21.614 -3.813 3.005 1.00 12.43 O ATOM 0 H SER A 8 20.304 -5.863 2.401 1.00 14.50 H new ATOM 0 HA SER A 8 22.339 -5.379 0.306 1.00 1.53 H new ATOM 0 HB2 SER A 8 23.464 -4.689 2.789 1.00 15.23 H new ATOM 0 HB3 SER A 8 23.007 -3.587 1.506 1.00 15.23 H new ATOM 0 HG SER A 8 21.981 -3.064 3.520 1.00 12.43 H new ATOM 118 N ILE A 9 23.144 -7.662 0.864 1.00 11.43 N ATOM 119 CA ILE A 9 23.783 -8.934 1.175 1.00 24.01 C ATOM 120 C ILE A 9 25.251 -8.927 0.762 1.00 3.10 C ATOM 121 O ILE A 9 25.605 -8.552 -0.356 1.00 64.41 O ATOM 122 CB ILE A 9 23.071 -10.108 0.477 1.00 10.51 C ATOM 123 CG1 ILE A 9 23.901 -11.386 0.606 1.00 65.11 C ATOM 124 CG2 ILE A 9 22.819 -9.779 -0.987 1.00 15.43 C ATOM 125 CD1 ILE A 9 23.274 -12.585 -0.071 1.00 1.23 C ATOM 0 H ILE A 9 23.036 -7.476 -0.133 1.00 11.43 H new ATOM 0 HA ILE A 9 23.712 -9.067 2.255 1.00 24.01 H new ATOM 0 HB ILE A 9 22.109 -10.272 0.964 1.00 10.51 H new ATOM 0 HG12 ILE A 9 24.889 -11.213 0.178 1.00 65.11 H new ATOM 0 HG13 ILE A 9 24.046 -11.610 1.663 1.00 65.11 H new ATOM 0 HG21 ILE A 9 22.315 -10.618 -1.467 1.00 15.43 H new ATOM 0 HG22 ILE A 9 22.191 -8.891 -1.057 1.00 15.43 H new ATOM 0 HG23 ILE A 9 23.770 -9.592 -1.487 1.00 15.43 H new ATOM 0 HD11 ILE A 9 23.917 -13.455 0.061 1.00 1.23 H new ATOM 0 HD12 ILE A 9 22.298 -12.784 0.372 1.00 1.23 H new ATOM 0 HD13 ILE A 9 23.154 -12.381 -1.135 1.00 1.23 H new ATOM 137 N PRO A 10 26.127 -9.352 1.684 1.00 25.32 N ATOM 138 CA PRO A 10 27.572 -9.407 1.438 1.00 14.12 C ATOM 139 C PRO A 10 27.948 -10.493 0.437 1.00 64.51 C ATOM 140 O PRO A 10 27.535 -11.645 0.572 1.00 2.54 O ATOM 141 CB PRO A 10 28.155 -9.725 2.817 1.00 35.23 C ATOM 142 CG PRO A 10 27.055 -10.422 3.542 1.00 61.34 C ATOM 143 CD PRO A 10 25.776 -9.813 3.038 1.00 71.32 C ATOM 0 HA PRO A 10 27.948 -8.480 1.005 1.00 14.12 H new ATOM 0 HB2 PRO A 10 29.039 -10.357 2.737 1.00 35.23 H new ATOM 0 HB3 PRO A 10 28.459 -8.817 3.337 1.00 35.23 H new ATOM 0 HG2 PRO A 10 27.079 -11.495 3.349 1.00 61.34 H new ATOM 0 HG3 PRO A 10 27.152 -10.289 4.620 1.00 61.34 H new ATOM 0 HD2 PRO A 10 24.965 -10.541 3.017 1.00 71.32 H new ATOM 0 HD3 PRO A 10 25.447 -8.988 3.670 1.00 71.32 H new ATOM 151 N GLU A 11 28.735 -10.120 -0.567 1.00 43.52 N ATOM 152 CA GLU A 11 29.167 -11.064 -1.591 1.00 51.21 C ATOM 153 C GLU A 11 29.709 -12.342 -0.958 1.00 74.44 C ATOM 154 O GLU A 11 30.342 -12.305 0.096 1.00 42.32 O ATOM 155 CB GLU A 11 30.237 -10.430 -2.483 1.00 12.15 C ATOM 156 CG GLU A 11 29.966 -10.594 -3.969 1.00 2.24 C ATOM 157 CD GLU A 11 30.267 -11.995 -4.465 1.00 53.33 C ATOM 158 OE1 GLU A 11 30.993 -12.729 -3.763 1.00 61.23 O ATOM 159 OE2 GLU A 11 29.776 -12.356 -5.555 1.00 62.41 O ATOM 0 H GLU A 11 29.086 -9.171 -0.693 1.00 43.52 H new ATOM 0 HA GLU A 11 28.301 -11.320 -2.201 1.00 51.21 H new ATOM 0 HB2 GLU A 11 30.309 -9.368 -2.250 1.00 12.15 H new ATOM 0 HB3 GLU A 11 31.204 -10.874 -2.247 1.00 12.15 H new ATOM 0 HG2 GLU A 11 28.922 -10.357 -4.173 1.00 2.24 H new ATOM 0 HG3 GLU A 11 30.570 -9.878 -4.526 1.00 2.24 H new ATOM 166 N GLU A 12 29.453 -13.472 -1.610 1.00 64.53 N ATOM 167 CA GLU A 12 29.914 -14.763 -1.111 1.00 2.43 C ATOM 168 C GLU A 12 29.245 -15.102 0.218 1.00 1.11 C ATOM 169 O GLU A 12 29.733 -15.942 0.974 1.00 13.41 O ATOM 170 CB GLU A 12 31.435 -14.755 -0.941 1.00 71.44 C ATOM 171 CG GLU A 12 32.060 -16.139 -0.993 1.00 34.53 C ATOM 172 CD GLU A 12 33.547 -16.119 -0.701 1.00 25.22 C ATOM 173 OE1 GLU A 12 34.235 -15.196 -1.184 1.00 11.41 O ATOM 174 OE2 GLU A 12 34.024 -17.028 0.012 1.00 40.44 O ATOM 0 H GLU A 12 28.929 -13.520 -2.484 1.00 64.53 H new ATOM 0 HA GLU A 12 29.641 -15.525 -1.841 1.00 2.43 H new ATOM 0 HB2 GLU A 12 31.876 -14.137 -1.723 1.00 71.44 H new ATOM 0 HB3 GLU A 12 31.683 -14.289 0.013 1.00 71.44 H new ATOM 0 HG2 GLU A 12 31.561 -16.786 -0.272 1.00 34.53 H new ATOM 0 HG3 GLU A 12 31.893 -16.572 -1.979 1.00 34.53 H new ATOM 181 N ALA A 13 28.125 -14.442 0.496 1.00 44.05 N ATOM 182 CA ALA A 13 27.388 -14.674 1.731 1.00 2.14 C ATOM 183 C ALA A 13 27.083 -16.156 1.919 1.00 65.30 C ATOM 184 O ALA A 13 26.402 -16.770 1.097 1.00 1.32 O ATOM 185 CB ALA A 13 26.101 -13.863 1.738 1.00 75.51 C ATOM 0 H ALA A 13 27.709 -13.742 -0.118 1.00 44.05 H new ATOM 0 HA ALA A 13 28.013 -14.351 2.564 1.00 2.14 H new ATOM 0 HB1 ALA A 13 25.561 -14.046 2.667 1.00 75.51 H new ATOM 0 HB2 ALA A 13 26.339 -12.802 1.660 1.00 75.51 H new ATOM 0 HB3 ALA A 13 25.480 -14.159 0.892 1.00 75.51 H new ATOM 191 N LYS A 14 27.593 -16.727 3.005 1.00 30.41 N ATOM 192 CA LYS A 14 27.375 -18.138 3.302 1.00 64.32 C ATOM 193 C LYS A 14 25.892 -18.429 3.504 1.00 32.23 C ATOM 194 O LYS A 14 25.113 -17.535 3.837 1.00 43.11 O ATOM 195 CB LYS A 14 28.161 -18.545 4.551 1.00 71.14 C ATOM 196 CG LYS A 14 29.575 -19.014 4.254 1.00 73.20 C ATOM 197 CD LYS A 14 29.652 -20.529 4.164 1.00 61.13 C ATOM 198 CE LYS A 14 31.093 -21.015 4.178 1.00 22.31 C ATOM 199 NZ LYS A 14 31.192 -22.468 3.865 1.00 54.23 N ATOM 0 H LYS A 14 28.160 -16.234 3.694 1.00 30.41 H new ATOM 0 HA LYS A 14 27.729 -18.721 2.452 1.00 64.32 H new ATOM 0 HB2 LYS A 14 28.204 -17.697 5.235 1.00 71.14 H new ATOM 0 HB3 LYS A 14 27.623 -19.342 5.065 1.00 71.14 H new ATOM 0 HG2 LYS A 14 29.916 -18.575 3.316 1.00 73.20 H new ATOM 0 HG3 LYS A 14 30.248 -18.660 5.035 1.00 73.20 H new ATOM 0 HD2 LYS A 14 29.109 -20.972 4.999 1.00 61.13 H new ATOM 0 HD3 LYS A 14 29.162 -20.866 3.250 1.00 61.13 H new ATOM 0 HE2 LYS A 14 31.675 -20.447 3.452 1.00 22.31 H new ATOM 0 HE3 LYS A 14 31.531 -20.824 5.158 1.00 22.31 H new ATOM 0 HZ1 LYS A 14 32.190 -22.760 3.885 1.00 54.23 H new ATOM 0 HZ2 LYS A 14 30.658 -23.013 4.572 1.00 54.23 H new ATOM 0 HZ3 LYS A 14 30.797 -22.647 2.920 1.00 54.23 H new ATOM 213 N HIS A 15 25.507 -19.686 3.303 1.00 12.52 N ATOM 214 CA HIS A 15 24.116 -20.094 3.466 1.00 22.40 C ATOM 215 C HIS A 15 23.607 -19.746 4.861 1.00 2.54 C ATOM 216 O HIS A 15 24.124 -20.239 5.863 1.00 42.22 O ATOM 217 CB HIS A 15 23.972 -21.596 3.218 1.00 33.25 C ATOM 218 CG HIS A 15 24.515 -22.040 1.895 1.00 21.23 C ATOM 219 ND1 HIS A 15 24.810 -23.356 1.606 1.00 54.22 N ATOM 220 CD2 HIS A 15 24.816 -21.335 0.780 1.00 54.31 C ATOM 221 CE1 HIS A 15 25.269 -23.440 0.370 1.00 24.12 C ATOM 222 NE2 HIS A 15 25.283 -22.227 -0.153 1.00 74.42 N ATOM 0 H HIS A 15 26.138 -20.438 3.027 1.00 12.52 H new ATOM 0 HA HIS A 15 23.516 -19.553 2.735 1.00 22.40 H new ATOM 0 HB2 HIS A 15 24.485 -22.138 4.012 1.00 33.25 H new ATOM 0 HB3 HIS A 15 22.918 -21.866 3.278 1.00 33.25 H new ATOM 0 HD2 HIS A 15 24.709 -20.268 0.649 1.00 54.31 H new ATOM 0 HE1 HIS A 15 25.580 -24.346 -0.128 1.00 24.12 H new ATOM 0 HE2 HIS A 15 25.591 -21.992 -1.097 1.00 74.42 H new ATOM 230 N GLY A 16 22.590 -18.891 4.919 1.00 43.31 N ATOM 231 CA GLY A 16 22.029 -18.490 6.196 1.00 44.11 C ATOM 232 C GLY A 16 22.415 -17.075 6.580 1.00 74.11 C ATOM 233 O GLY A 16 22.149 -16.632 7.698 1.00 30.30 O ATOM 0 H GLY A 16 22.145 -18.469 4.104 1.00 43.31 H new ATOM 0 HA2 GLY A 16 20.943 -18.568 6.153 1.00 44.11 H new ATOM 0 HA3 GLY A 16 22.367 -19.178 6.970 1.00 44.11 H new ATOM 237 N THR A 17 23.045 -16.362 5.651 1.00 32.15 N ATOM 238 CA THR A 17 23.470 -14.990 5.899 1.00 20.31 C ATOM 239 C THR A 17 22.292 -14.026 5.815 1.00 44.02 C ATOM 240 O THR A 17 21.392 -14.200 4.993 1.00 2.12 O ATOM 241 CB THR A 17 24.553 -14.548 4.897 1.00 24.52 C ATOM 242 OG1 THR A 17 25.732 -15.343 5.069 1.00 44.14 O ATOM 243 CG2 THR A 17 24.895 -13.078 5.083 1.00 2.14 C ATOM 0 H THR A 17 23.272 -16.712 4.720 1.00 32.15 H new ATOM 0 HA THR A 17 23.885 -14.965 6.906 1.00 20.31 H new ATOM 0 HB THR A 17 24.164 -14.689 3.889 1.00 24.52 H new ATOM 0 HG1 THR A 17 25.530 -16.278 4.855 1.00 44.14 H new ATOM 0 HG21 THR A 17 25.662 -12.789 4.364 1.00 2.14 H new ATOM 0 HG22 THR A 17 24.002 -12.474 4.923 1.00 2.14 H new ATOM 0 HG23 THR A 17 25.267 -12.916 6.095 1.00 2.14 H new ATOM 251 N PHE A 18 22.305 -13.008 6.669 1.00 31.12 N ATOM 252 CA PHE A 18 21.237 -12.015 6.691 1.00 30.42 C ATOM 253 C PHE A 18 21.307 -11.114 5.462 1.00 72.11 C ATOM 254 O PHE A 18 22.378 -10.636 5.089 1.00 51.50 O ATOM 255 CB PHE A 18 21.324 -11.170 7.963 1.00 2.42 C ATOM 256 CG PHE A 18 20.531 -9.896 7.892 1.00 44.23 C ATOM 257 CD1 PHE A 18 19.189 -9.918 7.549 1.00 62.14 C ATOM 258 CD2 PHE A 18 21.128 -8.676 8.168 1.00 22.41 C ATOM 259 CE1 PHE A 18 18.458 -8.747 7.481 1.00 32.43 C ATOM 260 CE2 PHE A 18 20.402 -7.502 8.103 1.00 73.31 C ATOM 261 CZ PHE A 18 19.064 -7.538 7.760 1.00 64.21 C ATOM 0 H PHE A 18 23.043 -12.849 7.355 1.00 31.12 H new ATOM 0 HA PHE A 18 20.283 -12.543 6.679 1.00 30.42 H new ATOM 0 HB2 PHE A 18 20.971 -11.762 8.808 1.00 2.42 H new ATOM 0 HB3 PHE A 18 22.369 -10.928 8.158 1.00 2.42 H new ATOM 0 HD1 PHE A 18 18.709 -10.861 7.332 1.00 62.14 H new ATOM 0 HD2 PHE A 18 22.173 -8.642 8.437 1.00 22.41 H new ATOM 0 HE1 PHE A 18 17.413 -8.778 7.210 1.00 32.43 H new ATOM 0 HE2 PHE A 18 20.880 -6.558 8.320 1.00 73.31 H new ATOM 0 HZ PHE A 18 18.493 -6.622 7.710 1.00 64.21 H new ATOM 271 N VAL A 19 20.156 -10.888 4.836 1.00 44.55 N ATOM 272 CA VAL A 19 20.085 -10.044 3.649 1.00 44.25 C ATOM 273 C VAL A 19 19.252 -8.795 3.911 1.00 11.42 C ATOM 274 O VAL A 19 19.724 -7.672 3.736 1.00 23.33 O ATOM 275 CB VAL A 19 19.485 -10.807 2.453 1.00 54.51 C ATOM 276 CG1 VAL A 19 19.503 -9.940 1.203 1.00 62.22 C ATOM 277 CG2 VAL A 19 20.236 -12.109 2.220 1.00 13.23 C ATOM 0 H VAL A 19 19.261 -11.277 5.131 1.00 44.55 H new ATOM 0 HA VAL A 19 21.107 -9.751 3.408 1.00 44.25 H new ATOM 0 HB VAL A 19 18.447 -11.050 2.683 1.00 54.51 H new ATOM 0 HG11 VAL A 19 19.075 -10.496 0.369 1.00 62.22 H new ATOM 0 HG12 VAL A 19 18.916 -9.038 1.377 1.00 62.22 H new ATOM 0 HG13 VAL A 19 20.531 -9.664 0.966 1.00 62.22 H new ATOM 0 HG21 VAL A 19 19.798 -12.635 1.371 1.00 13.23 H new ATOM 0 HG22 VAL A 19 21.284 -11.892 2.012 1.00 13.23 H new ATOM 0 HG23 VAL A 19 20.165 -12.734 3.110 1.00 13.23 H new ATOM 287 N GLY A 20 18.008 -8.998 4.333 1.00 15.15 N ATOM 288 CA GLY A 20 17.127 -7.879 4.614 1.00 3.22 C ATOM 289 C GLY A 20 15.721 -8.321 4.966 1.00 72.52 C ATOM 290 O GLY A 20 15.072 -9.024 4.190 1.00 21.15 O ATOM 0 H GLY A 20 17.594 -9.918 4.485 1.00 15.15 H new ATOM 0 HA2 GLY A 20 17.538 -7.295 5.438 1.00 3.22 H new ATOM 0 HA3 GLY A 20 17.091 -7.222 3.745 1.00 3.22 H new ATOM 294 N ARG A 21 15.249 -7.911 6.138 1.00 32.24 N ATOM 295 CA ARG A 21 13.911 -8.272 6.592 1.00 22.42 C ATOM 296 C ARG A 21 12.880 -8.030 5.493 1.00 25.43 C ATOM 297 O ARG A 21 12.484 -6.892 5.240 1.00 22.34 O ATOM 298 CB ARG A 21 13.539 -7.471 7.841 1.00 42.53 C ATOM 299 CG ARG A 21 13.958 -6.011 7.774 1.00 14.20 C ATOM 300 CD ARG A 21 15.207 -5.751 8.600 1.00 24.34 C ATOM 301 NE ARG A 21 14.893 -5.494 10.003 1.00 35.11 N ATOM 302 CZ ARG A 21 14.286 -4.392 10.430 1.00 32.20 C ATOM 303 NH1 ARG A 21 13.930 -3.451 9.567 1.00 2.51 N ATOM 304 NH2 ARG A 21 14.033 -4.231 11.723 1.00 43.23 N ATOM 0 H ARG A 21 15.773 -7.328 6.791 1.00 32.24 H new ATOM 0 HA ARG A 21 13.912 -9.334 6.837 1.00 22.42 H new ATOM 0 HB2 ARG A 21 12.460 -7.525 7.989 1.00 42.53 H new ATOM 0 HB3 ARG A 21 14.004 -7.934 8.711 1.00 42.53 H new ATOM 0 HG2 ARG A 21 14.142 -5.732 6.737 1.00 14.20 H new ATOM 0 HG3 ARG A 21 13.145 -5.381 8.134 1.00 14.20 H new ATOM 0 HD2 ARG A 21 15.873 -6.611 8.530 1.00 24.34 H new ATOM 0 HD3 ARG A 21 15.744 -4.897 8.187 1.00 24.34 H new ATOM 0 HE ARG A 21 15.154 -6.199 10.693 1.00 35.11 H new ATOM 0 HH11 ARG A 21 14.122 -3.572 8.573 1.00 2.51 H new ATOM 0 HH12 ARG A 21 13.464 -2.606 9.897 1.00 2.51 H new ATOM 0 HH21 ARG A 21 14.305 -4.954 12.390 1.00 43.23 H new ATOM 0 HH22 ARG A 21 13.567 -3.385 12.050 1.00 43.23 H new ATOM 318 N ILE A 22 12.452 -9.107 4.844 1.00 34.41 N ATOM 319 CA ILE A 22 11.467 -9.012 3.773 1.00 1.24 C ATOM 320 C ILE A 22 10.077 -8.725 4.329 1.00 15.43 C ATOM 321 O ILE A 22 9.342 -7.896 3.793 1.00 13.32 O ATOM 322 CB ILE A 22 11.417 -10.305 2.938 1.00 53.52 C ATOM 323 CG1 ILE A 22 10.370 -10.181 1.829 1.00 15.42 C ATOM 324 CG2 ILE A 22 11.114 -11.500 3.829 1.00 53.30 C ATOM 325 CD1 ILE A 22 10.566 -11.168 0.700 1.00 54.53 C ATOM 0 H ILE A 22 12.771 -10.056 5.041 1.00 34.41 H new ATOM 0 HA ILE A 22 11.777 -8.187 3.132 1.00 1.24 H new ATOM 0 HB ILE A 22 12.392 -10.460 2.476 1.00 53.52 H new ATOM 0 HG12 ILE A 22 9.379 -10.325 2.259 1.00 15.42 H new ATOM 0 HG13 ILE A 22 10.398 -9.169 1.425 1.00 15.42 H new ATOM 0 HG21 ILE A 22 11.082 -12.406 3.224 1.00 53.30 H new ATOM 0 HG22 ILE A 22 11.893 -11.596 4.586 1.00 53.30 H new ATOM 0 HG23 ILE A 22 10.150 -11.355 4.317 1.00 53.30 H new ATOM 0 HD11 ILE A 22 9.788 -11.022 -0.050 1.00 54.53 H new ATOM 0 HD12 ILE A 22 11.543 -11.010 0.244 1.00 54.53 H new ATOM 0 HD13 ILE A 22 10.508 -12.184 1.091 1.00 54.53 H new ATOM 337 N ALA A 23 9.723 -9.414 5.409 1.00 73.43 N ATOM 338 CA ALA A 23 8.422 -9.231 6.040 1.00 11.23 C ATOM 339 C ALA A 23 8.329 -7.869 6.720 1.00 21.03 C ATOM 340 O ALA A 23 7.412 -7.094 6.453 1.00 52.52 O ATOM 341 CB ALA A 23 8.161 -10.343 7.045 1.00 61.42 C ATOM 0 H ALA A 23 10.319 -10.104 5.865 1.00 73.43 H new ATOM 0 HA ALA A 23 7.660 -9.273 5.262 1.00 11.23 H new ATOM 0 HB1 ALA A 23 7.186 -10.193 7.508 1.00 61.42 H new ATOM 0 HB2 ALA A 23 8.176 -11.306 6.534 1.00 61.42 H new ATOM 0 HB3 ALA A 23 8.934 -10.328 7.813 1.00 61.42 H new ATOM 347 N GLN A 24 9.284 -7.586 7.600 1.00 10.04 N ATOM 348 CA GLN A 24 9.308 -6.318 8.319 1.00 11.34 C ATOM 349 C GLN A 24 9.265 -5.141 7.350 1.00 74.33 C ATOM 350 O GLN A 24 8.610 -4.132 7.611 1.00 35.34 O ATOM 351 CB GLN A 24 10.559 -6.227 9.194 1.00 3.24 C ATOM 352 CG GLN A 24 10.285 -5.707 10.596 1.00 32.55 C ATOM 353 CD GLN A 24 10.145 -6.822 11.615 1.00 54.14 C ATOM 354 OE1 GLN A 24 11.110 -7.521 11.924 1.00 0.32 O ATOM 355 NE2 GLN A 24 8.938 -6.994 12.142 1.00 60.12 N ATOM 0 H GLN A 24 10.051 -8.217 7.832 1.00 10.04 H new ATOM 0 HA GLN A 24 8.424 -6.274 8.955 1.00 11.34 H new ATOM 0 HB2 GLN A 24 11.015 -7.214 9.265 1.00 3.24 H new ATOM 0 HB3 GLN A 24 11.285 -5.574 8.709 1.00 3.24 H new ATOM 0 HG2 GLN A 24 11.095 -5.043 10.898 1.00 32.55 H new ATOM 0 HG3 GLN A 24 9.372 -5.112 10.587 1.00 32.55 H new ATOM 0 HE21 GLN A 24 8.166 -6.391 11.857 1.00 60.12 H new ATOM 0 HE22 GLN A 24 8.783 -7.729 12.832 1.00 60.12 H new ATOM 364 N ASP A 25 9.966 -5.278 6.230 1.00 4.11 N ATOM 365 CA ASP A 25 10.008 -4.226 5.220 1.00 34.55 C ATOM 366 C ASP A 25 8.704 -4.182 4.429 1.00 44.12 C ATOM 367 O ASP A 25 8.294 -3.125 3.946 1.00 23.35 O ATOM 368 CB ASP A 25 11.188 -4.446 4.272 1.00 35.34 C ATOM 369 CG ASP A 25 12.519 -4.114 4.918 1.00 75.22 C ATOM 370 OD1 ASP A 25 12.548 -3.922 6.152 1.00 44.24 O ATOM 371 OD2 ASP A 25 13.530 -4.047 4.189 1.00 24.54 O ATOM 0 H ASP A 25 10.513 -6.107 5.998 1.00 4.11 H new ATOM 0 HA ASP A 25 10.136 -3.271 5.729 1.00 34.55 H new ATOM 0 HB2 ASP A 25 11.197 -5.485 3.942 1.00 35.34 H new ATOM 0 HB3 ASP A 25 11.055 -3.830 3.382 1.00 35.34 H new ATOM 376 N LEU A 26 8.058 -5.335 4.298 1.00 62.12 N ATOM 377 CA LEU A 26 6.801 -5.429 3.563 1.00 1.44 C ATOM 378 C LEU A 26 5.660 -4.799 4.355 1.00 13.42 C ATOM 379 O LEU A 26 4.793 -4.132 3.791 1.00 21.11 O ATOM 380 CB LEU A 26 6.476 -6.891 3.254 1.00 41.11 C ATOM 381 CG LEU A 26 6.711 -7.340 1.811 1.00 13.21 C ATOM 382 CD1 LEU A 26 8.119 -6.982 1.363 1.00 22.01 C ATOM 383 CD2 LEU A 26 6.469 -8.836 1.672 1.00 54.30 C ATOM 0 H LEU A 26 8.384 -6.218 4.691 1.00 62.12 H new ATOM 0 HA LEU A 26 6.914 -4.883 2.626 1.00 1.44 H new ATOM 0 HB2 LEU A 26 7.074 -7.522 3.912 1.00 41.11 H new ATOM 0 HB3 LEU A 26 5.430 -7.071 3.504 1.00 41.11 H new ATOM 0 HG LEU A 26 6.003 -6.816 1.168 1.00 13.21 H new ATOM 0 HD11 LEU A 26 8.268 -7.309 0.334 1.00 22.01 H new ATOM 0 HD12 LEU A 26 8.257 -5.902 1.424 1.00 22.01 H new ATOM 0 HD13 LEU A 26 8.843 -7.477 2.009 1.00 22.01 H new ATOM 0 HD21 LEU A 26 6.641 -9.138 0.639 1.00 54.30 H new ATOM 0 HD22 LEU A 26 7.152 -9.377 2.327 1.00 54.30 H new ATOM 0 HD23 LEU A 26 5.441 -9.066 1.951 1.00 54.30 H new ATOM 395 N GLY A 27 5.667 -5.013 5.667 1.00 24.14 N ATOM 396 CA GLY A 27 4.629 -4.458 6.516 1.00 42.11 C ATOM 397 C GLY A 27 3.448 -5.395 6.676 1.00 43.44 C ATOM 398 O GLY A 27 2.295 -4.977 6.561 1.00 21.12 O ATOM 0 H GLY A 27 6.374 -5.561 6.157 1.00 24.14 H new ATOM 0 HA2 GLY A 27 5.047 -4.235 7.497 1.00 42.11 H new ATOM 0 HA3 GLY A 27 4.285 -3.514 6.094 1.00 42.11 H new ATOM 402 N LEU A 28 3.734 -6.665 6.939 1.00 43.11 N ATOM 403 CA LEU A 28 2.686 -7.665 7.113 1.00 45.11 C ATOM 404 C LEU A 28 2.873 -8.427 8.421 1.00 13.21 C ATOM 405 O LEU A 28 3.855 -8.224 9.134 1.00 42.24 O ATOM 406 CB LEU A 28 2.686 -8.642 5.936 1.00 42.00 C ATOM 407 CG LEU A 28 3.428 -8.181 4.681 1.00 63.31 C ATOM 408 CD1 LEU A 28 3.512 -9.310 3.666 1.00 63.53 C ATOM 409 CD2 LEU A 28 2.745 -6.965 4.073 1.00 34.13 C ATOM 0 H LEU A 28 4.683 -7.027 7.036 1.00 43.11 H new ATOM 0 HA LEU A 28 1.727 -7.148 7.149 1.00 45.11 H new ATOM 0 HB2 LEU A 28 3.126 -9.582 6.270 1.00 42.00 H new ATOM 0 HB3 LEU A 28 1.652 -8.853 5.665 1.00 42.00 H new ATOM 0 HG LEU A 28 4.442 -7.899 4.965 1.00 63.31 H new ATOM 0 HD11 LEU A 28 4.043 -8.964 2.780 1.00 63.53 H new ATOM 0 HD12 LEU A 28 4.047 -10.153 4.103 1.00 63.53 H new ATOM 0 HD13 LEU A 28 2.506 -9.624 3.387 1.00 63.53 H new ATOM 0 HD21 LEU A 28 3.287 -6.651 3.181 1.00 34.13 H new ATOM 0 HD22 LEU A 28 1.720 -7.220 3.804 1.00 34.13 H new ATOM 0 HD23 LEU A 28 2.738 -6.151 4.798 1.00 34.13 H new ATOM 421 N GLU A 29 1.924 -9.305 8.729 1.00 75.23 N ATOM 422 CA GLU A 29 1.985 -10.098 9.951 1.00 73.31 C ATOM 423 C GLU A 29 2.804 -11.367 9.735 1.00 24.35 C ATOM 424 O GLU A 29 2.614 -12.083 8.751 1.00 25.33 O ATOM 425 CB GLU A 29 0.575 -10.462 10.420 1.00 35.41 C ATOM 426 CG GLU A 29 0.311 -10.122 11.877 1.00 21.23 C ATOM 427 CD GLU A 29 -0.638 -8.951 12.041 1.00 50.04 C ATOM 428 OE1 GLU A 29 -0.612 -8.043 11.183 1.00 3.04 O ATOM 429 OE2 GLU A 29 -1.406 -8.942 13.025 1.00 54.03 O ATOM 0 H GLU A 29 1.104 -9.485 8.150 1.00 75.23 H new ATOM 0 HA GLU A 29 2.472 -9.498 10.719 1.00 73.31 H new ATOM 0 HB2 GLU A 29 -0.152 -9.941 9.797 1.00 35.41 H new ATOM 0 HB3 GLU A 29 0.416 -11.530 10.270 1.00 35.41 H new ATOM 0 HG2 GLU A 29 -0.105 -10.995 12.380 1.00 21.23 H new ATOM 0 HG3 GLU A 29 1.256 -9.891 12.369 1.00 21.23 H new ATOM 436 N LEU A 30 3.717 -11.639 10.662 1.00 73.31 N ATOM 437 CA LEU A 30 4.567 -12.822 10.575 1.00 51.44 C ATOM 438 C LEU A 30 3.728 -14.095 10.545 1.00 54.11 C ATOM 439 O LEU A 30 4.137 -15.109 9.978 1.00 0.14 O ATOM 440 CB LEU A 30 5.538 -12.864 11.756 1.00 34.41 C ATOM 441 CG LEU A 30 6.994 -13.183 11.417 1.00 2.20 C ATOM 442 CD1 LEU A 30 7.123 -14.607 10.900 1.00 73.23 C ATOM 443 CD2 LEU A 30 7.533 -12.192 10.396 1.00 52.25 C ATOM 0 H LEU A 30 3.887 -11.057 11.482 1.00 73.31 H new ATOM 0 HA LEU A 30 5.136 -12.763 9.647 1.00 51.44 H new ATOM 0 HB2 LEU A 30 5.507 -11.898 12.261 1.00 34.41 H new ATOM 0 HB3 LEU A 30 5.180 -13.608 12.468 1.00 34.41 H new ATOM 0 HG LEU A 30 7.586 -13.095 12.328 1.00 2.20 H new ATOM 0 HD11 LEU A 30 8.167 -14.815 10.664 1.00 73.23 H new ATOM 0 HD12 LEU A 30 6.777 -15.304 11.663 1.00 73.23 H new ATOM 0 HD13 LEU A 30 6.518 -14.724 10.001 1.00 73.23 H new ATOM 0 HD21 LEU A 30 8.571 -12.434 10.166 1.00 52.25 H new ATOM 0 HD22 LEU A 30 6.937 -12.248 9.485 1.00 52.25 H new ATOM 0 HD23 LEU A 30 7.478 -11.183 10.804 1.00 52.25 H new ATOM 455 N THR A 31 2.549 -14.035 11.157 1.00 21.33 N ATOM 456 CA THR A 31 1.651 -15.182 11.200 1.00 22.53 C ATOM 457 C THR A 31 0.617 -15.113 10.083 1.00 35.11 C ATOM 458 O THR A 31 -0.267 -15.964 9.990 1.00 32.22 O ATOM 459 CB THR A 31 0.923 -15.275 12.554 1.00 33.13 C ATOM 460 OG1 THR A 31 1.684 -14.607 13.567 1.00 72.51 O ATOM 461 CG2 THR A 31 0.703 -16.727 12.952 1.00 11.24 C ATOM 0 H THR A 31 2.194 -13.204 11.630 1.00 21.33 H new ATOM 0 HA THR A 31 2.267 -16.071 11.066 1.00 22.53 H new ATOM 0 HB THR A 31 -0.049 -14.792 12.453 1.00 33.13 H new ATOM 0 HG1 THR A 31 1.213 -14.669 14.424 1.00 72.51 H new ATOM 0 HG21 THR A 31 0.187 -16.767 13.911 1.00 11.24 H new ATOM 0 HG22 THR A 31 0.098 -17.224 12.194 1.00 11.24 H new ATOM 0 HG23 THR A 31 1.666 -17.231 13.036 1.00 11.24 H new ATOM 469 N GLU A 32 0.733 -14.095 9.237 1.00 44.52 N ATOM 470 CA GLU A 32 -0.194 -13.915 8.125 1.00 25.45 C ATOM 471 C GLU A 32 0.414 -14.428 6.823 1.00 74.13 C ATOM 472 O GLU A 32 -0.295 -14.654 5.841 1.00 71.41 O ATOM 473 CB GLU A 32 -0.570 -12.440 7.979 1.00 13.43 C ATOM 474 CG GLU A 32 -1.737 -12.020 8.857 1.00 14.40 C ATOM 475 CD GLU A 32 -3.060 -12.585 8.378 1.00 34.13 C ATOM 476 OE1 GLU A 32 -3.050 -13.406 7.438 1.00 62.23 O ATOM 477 OE2 GLU A 32 -4.107 -12.206 8.945 1.00 3.02 O ATOM 0 H GLU A 32 1.460 -13.382 9.300 1.00 44.52 H new ATOM 0 HA GLU A 32 -1.094 -14.492 8.338 1.00 25.45 H new ATOM 0 HB2 GLU A 32 0.297 -11.827 8.224 1.00 13.43 H new ATOM 0 HB3 GLU A 32 -0.819 -12.239 6.937 1.00 13.43 H new ATOM 0 HG2 GLU A 32 -1.554 -12.350 9.880 1.00 14.40 H new ATOM 0 HG3 GLU A 32 -1.797 -10.932 8.879 1.00 14.40 H new ATOM 484 N LEU A 33 1.730 -14.609 6.821 1.00 13.51 N ATOM 485 CA LEU A 33 2.434 -15.094 5.639 1.00 10.13 C ATOM 486 C LEU A 33 2.031 -16.529 5.316 1.00 20.14 C ATOM 487 O LEU A 33 1.799 -16.874 4.158 1.00 63.33 O ATOM 488 CB LEU A 33 3.946 -15.013 5.854 1.00 44.44 C ATOM 489 CG LEU A 33 4.499 -13.636 6.225 1.00 33.02 C ATOM 490 CD1 LEU A 33 5.558 -13.761 7.309 1.00 2.20 C ATOM 491 CD2 LEU A 33 5.068 -12.941 4.997 1.00 4.34 C ATOM 0 H LEU A 33 2.331 -14.427 7.625 1.00 13.51 H new ATOM 0 HA LEU A 33 2.158 -14.460 4.796 1.00 10.13 H new ATOM 0 HB2 LEU A 33 4.219 -15.716 6.641 1.00 44.44 H new ATOM 0 HB3 LEU A 33 4.441 -15.347 4.942 1.00 44.44 H new ATOM 0 HG LEU A 33 3.681 -13.029 6.614 1.00 33.02 H new ATOM 0 HD11 LEU A 33 5.940 -12.772 7.560 1.00 2.20 H new ATOM 0 HD12 LEU A 33 5.118 -14.216 8.196 1.00 2.20 H new ATOM 0 HD13 LEU A 33 6.376 -14.385 6.948 1.00 2.20 H new ATOM 0 HD21 LEU A 33 5.457 -11.963 5.280 1.00 4.34 H new ATOM 0 HD22 LEU A 33 5.873 -13.544 4.578 1.00 4.34 H new ATOM 0 HD23 LEU A 33 4.282 -12.817 4.252 1.00 4.34 H new ATOM 503 N VAL A 34 1.947 -17.362 6.349 1.00 3.54 N ATOM 504 CA VAL A 34 1.569 -18.759 6.176 1.00 13.15 C ATOM 505 C VAL A 34 0.262 -18.882 5.400 1.00 25.31 C ATOM 506 O VAL A 34 0.195 -19.515 4.346 1.00 22.32 O ATOM 507 CB VAL A 34 1.416 -19.471 7.534 1.00 72.04 C ATOM 508 CG1 VAL A 34 0.368 -20.571 7.445 1.00 44.52 C ATOM 509 CG2 VAL A 34 2.753 -20.033 7.994 1.00 55.33 C ATOM 0 H VAL A 34 2.136 -17.093 7.315 1.00 3.54 H new ATOM 0 HA VAL A 34 2.370 -19.237 5.612 1.00 13.15 H new ATOM 0 HB VAL A 34 1.081 -18.742 8.272 1.00 72.04 H new ATOM 0 HG11 VAL A 34 0.274 -21.063 8.413 1.00 44.52 H new ATOM 0 HG12 VAL A 34 -0.592 -20.137 7.163 1.00 44.52 H new ATOM 0 HG13 VAL A 34 0.670 -21.302 6.695 1.00 44.52 H new ATOM 0 HG21 VAL A 34 2.627 -20.532 8.955 1.00 55.33 H new ATOM 0 HG22 VAL A 34 3.119 -20.749 7.258 1.00 55.33 H new ATOM 0 HG23 VAL A 34 3.472 -19.221 8.099 1.00 55.33 H new ATOM 519 N PRO A 35 -0.802 -18.263 5.931 1.00 12.01 N ATOM 520 CA PRO A 35 -2.127 -18.288 5.304 1.00 42.13 C ATOM 521 C PRO A 35 -2.173 -17.474 4.015 1.00 33.00 C ATOM 522 O PRO A 35 -3.097 -17.615 3.214 1.00 60.45 O ATOM 523 CB PRO A 35 -3.034 -17.661 6.365 1.00 1.43 C ATOM 524 CG PRO A 35 -2.129 -16.797 7.174 1.00 10.04 C ATOM 525 CD PRO A 35 -0.795 -17.490 7.185 1.00 63.34 C ATOM 0 HA PRO A 35 -2.422 -19.297 5.014 1.00 42.13 H new ATOM 0 HB2 PRO A 35 -3.834 -17.078 5.908 1.00 1.43 H new ATOM 0 HB3 PRO A 35 -3.508 -18.424 6.982 1.00 1.43 H new ATOM 0 HG2 PRO A 35 -2.048 -15.801 6.738 1.00 10.04 H new ATOM 0 HG3 PRO A 35 -2.512 -16.671 8.187 1.00 10.04 H new ATOM 0 HD2 PRO A 35 0.028 -16.776 7.213 1.00 63.34 H new ATOM 0 HD3 PRO A 35 -0.685 -18.137 8.055 1.00 63.34 H new ATOM 533 N ARG A 36 -1.171 -16.623 3.822 1.00 53.41 N ATOM 534 CA ARG A 36 -1.099 -15.786 2.630 1.00 2.33 C ATOM 535 C ARG A 36 -0.359 -16.504 1.506 1.00 43.13 C ATOM 536 O ARG A 36 -0.037 -15.905 0.478 1.00 20.43 O ATOM 537 CB ARG A 36 -0.400 -14.463 2.952 1.00 74.22 C ATOM 538 CG ARG A 36 -1.336 -13.397 3.498 1.00 71.20 C ATOM 539 CD ARG A 36 -0.581 -12.132 3.873 1.00 3.03 C ATOM 540 NE ARG A 36 -1.471 -10.982 4.005 1.00 1.32 N ATOM 541 CZ ARG A 36 -1.059 -9.721 3.926 1.00 34.24 C ATOM 542 NH1 ARG A 36 0.222 -9.450 3.717 1.00 35.31 N ATOM 543 NH2 ARG A 36 -1.930 -8.728 4.057 1.00 71.43 N ATOM 0 H ARG A 36 -0.398 -16.495 4.475 1.00 53.41 H new ATOM 0 HA ARG A 36 -2.117 -15.580 2.298 1.00 2.33 H new ATOM 0 HB2 ARG A 36 0.391 -14.647 3.679 1.00 74.22 H new ATOM 0 HB3 ARG A 36 0.079 -14.086 2.049 1.00 74.22 H new ATOM 0 HG2 ARG A 36 -2.095 -13.161 2.752 1.00 71.20 H new ATOM 0 HG3 ARG A 36 -1.858 -13.783 4.373 1.00 71.20 H new ATOM 0 HD2 ARG A 36 -0.052 -12.291 4.813 1.00 3.03 H new ATOM 0 HD3 ARG A 36 0.173 -11.922 3.114 1.00 3.03 H new ATOM 0 HE ARG A 36 -2.463 -11.156 4.167 1.00 1.32 H new ATOM 0 HH11 ARG A 36 0.894 -10.210 3.616 1.00 35.31 H new ATOM 0 HH12 ARG A 36 0.535 -8.481 3.657 1.00 35.31 H new ATOM 0 HH21 ARG A 36 -2.916 -8.933 4.218 1.00 71.43 H new ATOM 0 HH22 ARG A 36 -1.613 -7.760 3.996 1.00 71.43 H new ATOM 557 N LEU A 37 -0.091 -17.789 1.707 1.00 33.41 N ATOM 558 CA LEU A 37 0.611 -18.590 0.710 1.00 5.05 C ATOM 559 C LEU A 37 1.847 -17.858 0.197 1.00 41.03 C ATOM 560 O LEU A 37 2.008 -17.659 -1.008 1.00 30.52 O ATOM 561 CB LEU A 37 -0.321 -18.921 -0.456 1.00 61.31 C ATOM 562 CG LEU A 37 -1.272 -20.100 -0.242 1.00 5.33 C ATOM 563 CD1 LEU A 37 -2.635 -19.608 0.219 1.00 72.53 C ATOM 564 CD2 LEU A 37 -1.401 -20.920 -1.517 1.00 44.42 C ATOM 0 H LEU A 37 -0.349 -18.299 2.552 1.00 33.41 H new ATOM 0 HA LEU A 37 0.931 -19.518 1.184 1.00 5.05 H new ATOM 0 HB2 LEU A 37 -0.916 -18.036 -0.681 1.00 61.31 H new ATOM 0 HB3 LEU A 37 0.289 -19.127 -1.335 1.00 61.31 H new ATOM 0 HG LEU A 37 -0.857 -20.741 0.536 1.00 5.33 H new ATOM 0 HD11 LEU A 37 -3.299 -20.460 0.366 1.00 72.53 H new ATOM 0 HD12 LEU A 37 -2.527 -19.065 1.158 1.00 72.53 H new ATOM 0 HD13 LEU A 37 -3.057 -18.945 -0.537 1.00 72.53 H new ATOM 0 HD21 LEU A 37 -2.081 -21.754 -1.346 1.00 44.42 H new ATOM 0 HD22 LEU A 37 -1.792 -20.291 -2.316 1.00 44.42 H new ATOM 0 HD23 LEU A 37 -0.422 -21.303 -1.804 1.00 44.42 H new ATOM 576 N PHE A 38 2.719 -17.460 1.118 1.00 74.43 N ATOM 577 CA PHE A 38 3.941 -16.751 0.758 1.00 61.50 C ATOM 578 C PHE A 38 4.857 -17.638 -0.081 1.00 2.13 C ATOM 579 O PHE A 38 4.986 -18.835 0.177 1.00 41.13 O ATOM 580 CB PHE A 38 4.676 -16.287 2.017 1.00 14.42 C ATOM 581 CG PHE A 38 5.283 -14.919 1.886 1.00 12.05 C ATOM 582 CD1 PHE A 38 4.482 -13.789 1.878 1.00 55.30 C ATOM 583 CD2 PHE A 38 6.655 -14.764 1.772 1.00 51.14 C ATOM 584 CE1 PHE A 38 5.037 -12.529 1.758 1.00 1.32 C ATOM 585 CE2 PHE A 38 7.216 -13.507 1.652 1.00 1.51 C ATOM 586 CZ PHE A 38 6.406 -12.388 1.644 1.00 2.31 C ATOM 0 H PHE A 38 2.602 -17.617 2.119 1.00 74.43 H new ATOM 0 HA PHE A 38 3.665 -15.879 0.165 1.00 61.50 H new ATOM 0 HB2 PHE A 38 3.980 -16.288 2.856 1.00 14.42 H new ATOM 0 HB3 PHE A 38 5.462 -17.004 2.254 1.00 14.42 H new ATOM 0 HD1 PHE A 38 3.411 -13.894 1.967 1.00 55.30 H new ATOM 0 HD2 PHE A 38 7.293 -15.635 1.777 1.00 51.14 H new ATOM 0 HE1 PHE A 38 4.401 -11.656 1.753 1.00 1.32 H new ATOM 0 HE2 PHE A 38 8.287 -13.399 1.565 1.00 1.51 H new ATOM 0 HZ PHE A 38 6.843 -11.405 1.549 1.00 2.31 H new ATOM 596 N ARG A 39 5.491 -17.041 -1.085 1.00 74.32 N ATOM 597 CA ARG A 39 6.393 -17.776 -1.963 1.00 41.03 C ATOM 598 C ARG A 39 7.480 -16.859 -2.516 1.00 3.11 C ATOM 599 O ARG A 39 7.263 -15.661 -2.699 1.00 72.15 O ATOM 600 CB ARG A 39 5.613 -18.411 -3.116 1.00 31.55 C ATOM 601 CG ARG A 39 5.829 -19.910 -3.244 1.00 24.40 C ATOM 602 CD ARG A 39 4.734 -20.694 -2.538 1.00 31.01 C ATOM 603 NE ARG A 39 4.518 -22.004 -3.147 1.00 43.32 N ATOM 604 CZ ARG A 39 3.667 -22.905 -2.670 1.00 53.24 C ATOM 605 NH1 ARG A 39 2.954 -22.639 -1.584 1.00 43.12 N ATOM 606 NH2 ARG A 39 3.526 -24.075 -3.281 1.00 11.53 N ATOM 0 H ARG A 39 5.397 -16.051 -1.310 1.00 74.32 H new ATOM 0 HA ARG A 39 6.868 -18.563 -1.377 1.00 41.03 H new ATOM 0 HB2 ARG A 39 4.550 -18.216 -2.975 1.00 31.55 H new ATOM 0 HB3 ARG A 39 5.904 -17.929 -4.049 1.00 31.55 H new ATOM 0 HG2 ARG A 39 5.854 -20.186 -4.298 1.00 24.40 H new ATOM 0 HG3 ARG A 39 6.798 -20.176 -2.822 1.00 24.40 H new ATOM 0 HD2 ARG A 39 4.999 -20.822 -1.488 1.00 31.01 H new ATOM 0 HD3 ARG A 39 3.805 -20.124 -2.565 1.00 31.01 H new ATOM 0 HE ARG A 39 5.050 -22.240 -3.985 1.00 43.32 H new ATOM 0 HH11 ARG A 39 3.058 -21.740 -1.113 1.00 43.12 H new ATOM 0 HH12 ARG A 39 2.301 -23.333 -1.220 1.00 43.12 H new ATOM 0 HH21 ARG A 39 4.072 -24.283 -4.117 1.00 11.53 H new ATOM 0 HH22 ARG A 39 2.872 -24.767 -2.914 1.00 11.53 H new ATOM 620 N VAL A 40 8.652 -17.430 -2.779 1.00 13.43 N ATOM 621 CA VAL A 40 9.773 -16.664 -3.311 1.00 31.24 C ATOM 622 C VAL A 40 10.286 -17.273 -4.611 1.00 2.22 C ATOM 623 O VAL A 40 10.308 -18.493 -4.771 1.00 2.33 O ATOM 624 CB VAL A 40 10.932 -16.590 -2.299 1.00 12.42 C ATOM 625 CG1 VAL A 40 12.110 -15.832 -2.891 1.00 40.42 C ATOM 626 CG2 VAL A 40 10.467 -15.941 -1.004 1.00 31.23 C ATOM 0 H VAL A 40 8.849 -18.420 -2.632 1.00 13.43 H new ATOM 0 HA VAL A 40 9.405 -15.657 -3.505 1.00 31.24 H new ATOM 0 HB VAL A 40 11.260 -17.605 -2.073 1.00 12.42 H new ATOM 0 HG11 VAL A 40 12.919 -15.790 -2.162 1.00 40.42 H new ATOM 0 HG12 VAL A 40 12.457 -16.343 -3.789 1.00 40.42 H new ATOM 0 HG13 VAL A 40 11.799 -14.819 -3.147 1.00 40.42 H new ATOM 0 HG21 VAL A 40 11.298 -15.897 -0.300 1.00 31.23 H new ATOM 0 HG22 VAL A 40 10.112 -14.931 -1.210 1.00 31.23 H new ATOM 0 HG23 VAL A 40 9.657 -16.529 -0.572 1.00 31.23 H new ATOM 636 N ALA A 41 10.699 -16.414 -5.537 1.00 51.02 N ATOM 637 CA ALA A 41 11.215 -16.867 -6.823 1.00 53.21 C ATOM 638 C ALA A 41 12.005 -15.763 -7.517 1.00 51.32 C ATOM 639 O ALA A 41 12.015 -14.617 -7.068 1.00 10.14 O ATOM 640 CB ALA A 41 10.074 -17.341 -7.712 1.00 24.12 C ATOM 0 H ALA A 41 10.686 -15.401 -5.421 1.00 51.02 H new ATOM 0 HA ALA A 41 11.891 -17.703 -6.642 1.00 53.21 H new ATOM 0 HB1 ALA A 41 10.474 -17.676 -8.669 1.00 24.12 H new ATOM 0 HB2 ALA A 41 9.553 -18.167 -7.227 1.00 24.12 H new ATOM 0 HB3 ALA A 41 9.377 -16.520 -7.878 1.00 24.12 H new ATOM 646 N SER A 42 12.667 -16.115 -8.615 1.00 33.43 N ATOM 647 CA SER A 42 13.464 -15.155 -9.368 1.00 52.25 C ATOM 648 C SER A 42 13.637 -15.609 -10.815 1.00 12.42 C ATOM 649 O SER A 42 13.512 -16.793 -11.126 1.00 33.33 O ATOM 650 CB SER A 42 14.834 -14.971 -8.713 1.00 13.54 C ATOM 651 OG SER A 42 15.858 -14.877 -9.688 1.00 15.42 O ATOM 0 H SER A 42 12.667 -17.059 -9.002 1.00 33.43 H new ATOM 0 HA SER A 42 12.937 -14.201 -9.364 1.00 52.25 H new ATOM 0 HB2 SER A 42 14.829 -14.070 -8.099 1.00 13.54 H new ATOM 0 HB3 SER A 42 15.038 -15.810 -8.047 1.00 13.54 H new ATOM 0 HG SER A 42 16.313 -14.013 -9.603 1.00 15.42 H new ATOM 657 N LYS A 43 13.925 -14.657 -11.696 1.00 63.12 N ATOM 658 CA LYS A 43 14.117 -14.956 -13.110 1.00 63.13 C ATOM 659 C LYS A 43 15.520 -15.499 -13.366 1.00 53.22 C ATOM 660 O LYS A 43 15.867 -15.840 -14.497 1.00 75.30 O ATOM 661 CB LYS A 43 13.882 -13.701 -13.955 1.00 25.55 C ATOM 662 CG LYS A 43 12.415 -13.345 -14.120 1.00 22.25 C ATOM 663 CD LYS A 43 12.233 -12.135 -15.020 1.00 61.24 C ATOM 664 CE LYS A 43 10.791 -11.650 -15.018 1.00 25.24 C ATOM 665 NZ LYS A 43 10.694 -10.204 -14.678 1.00 15.34 N ATOM 0 H LYS A 43 14.031 -13.671 -11.455 1.00 63.12 H new ATOM 0 HA LYS A 43 13.393 -15.719 -13.396 1.00 63.13 H new ATOM 0 HB2 LYS A 43 14.402 -12.861 -13.495 1.00 25.55 H new ATOM 0 HB3 LYS A 43 14.325 -13.848 -14.940 1.00 25.55 H new ATOM 0 HG2 LYS A 43 11.878 -14.196 -14.540 1.00 22.25 H new ATOM 0 HG3 LYS A 43 11.977 -13.142 -13.143 1.00 22.25 H new ATOM 0 HD2 LYS A 43 12.889 -11.331 -14.687 1.00 61.24 H new ATOM 0 HD3 LYS A 43 12.531 -12.389 -16.037 1.00 61.24 H new ATOM 0 HE2 LYS A 43 10.348 -11.823 -15.999 1.00 25.24 H new ATOM 0 HE3 LYS A 43 10.213 -12.232 -14.300 1.00 25.24 H new ATOM 0 HZ1 LYS A 43 9.781 -9.831 -15.007 1.00 15.34 H new ATOM 0 HZ2 LYS A 43 10.766 -10.084 -13.647 1.00 15.34 H new ATOM 0 HZ3 LYS A 43 11.467 -9.686 -15.142 1.00 15.34 H new ATOM 679 N ASP A 44 16.321 -15.577 -12.309 1.00 52.44 N ATOM 680 CA ASP A 44 17.685 -16.080 -12.419 1.00 72.55 C ATOM 681 C ASP A 44 17.734 -17.581 -12.147 1.00 14.43 C ATOM 682 O ASP A 44 17.806 -18.388 -13.073 1.00 42.13 O ATOM 683 CB ASP A 44 18.604 -15.342 -11.445 1.00 62.22 C ATOM 684 CG ASP A 44 19.418 -14.259 -12.125 1.00 62.13 C ATOM 685 OD1 ASP A 44 20.529 -14.566 -12.608 1.00 55.22 O ATOM 686 OD2 ASP A 44 18.945 -13.105 -12.175 1.00 54.14 O ATOM 0 H ASP A 44 16.049 -15.298 -11.366 1.00 52.44 H new ATOM 0 HA ASP A 44 18.031 -15.902 -13.437 1.00 72.55 H new ATOM 0 HB2 ASP A 44 18.005 -14.897 -10.651 1.00 62.22 H new ATOM 0 HB3 ASP A 44 19.278 -16.057 -10.973 1.00 62.22 H new ATOM 691 N ARG A 45 17.694 -17.946 -10.870 1.00 23.24 N ATOM 692 CA ARG A 45 17.736 -19.349 -10.475 1.00 24.11 C ATOM 693 C ARG A 45 16.502 -19.721 -9.658 1.00 63.32 C ATOM 694 O ARG A 45 16.170 -20.897 -9.518 1.00 32.41 O ATOM 695 CB ARG A 45 19.002 -19.635 -9.665 1.00 63.32 C ATOM 696 CG ARG A 45 19.999 -20.526 -10.388 1.00 64.03 C ATOM 697 CD ARG A 45 19.404 -21.890 -10.699 1.00 62.42 C ATOM 698 NE ARG A 45 19.456 -22.198 -12.126 1.00 1.11 N ATOM 699 CZ ARG A 45 19.084 -23.365 -12.640 1.00 42.12 C ATOM 700 NH1 ARG A 45 18.635 -24.329 -11.849 1.00 23.15 N ATOM 701 NH2 ARG A 45 19.161 -23.569 -13.949 1.00 74.01 N ATOM 0 H ARG A 45 17.633 -17.290 -10.091 1.00 23.24 H new ATOM 0 HA ARG A 45 17.747 -19.955 -11.381 1.00 24.11 H new ATOM 0 HB2 ARG A 45 19.485 -18.690 -9.417 1.00 63.32 H new ATOM 0 HB3 ARG A 45 18.722 -20.107 -8.723 1.00 63.32 H new ATOM 0 HG2 ARG A 45 20.313 -20.045 -11.314 1.00 64.03 H new ATOM 0 HG3 ARG A 45 20.891 -20.649 -9.774 1.00 64.03 H new ATOM 0 HD2 ARG A 45 19.944 -22.656 -10.143 1.00 62.42 H new ATOM 0 HD3 ARG A 45 18.369 -21.920 -10.359 1.00 62.42 H new ATOM 0 HE ARG A 45 19.797 -21.477 -12.763 1.00 1.11 H new ATOM 0 HH11 ARG A 45 18.574 -24.176 -10.842 1.00 23.15 H new ATOM 0 HH12 ARG A 45 18.350 -25.224 -12.247 1.00 23.15 H new ATOM 0 HH21 ARG A 45 19.506 -22.829 -14.561 1.00 74.01 H new ATOM 0 HH22 ARG A 45 18.875 -24.465 -14.343 1.00 74.01 H new ATOM 715 N GLY A 46 15.827 -18.710 -9.121 1.00 2.33 N ATOM 716 CA GLY A 46 14.638 -18.951 -8.324 1.00 64.32 C ATOM 717 C GLY A 46 14.958 -19.569 -6.977 1.00 44.24 C ATOM 718 O GLY A 46 14.056 -19.946 -6.230 1.00 10.03 O ATOM 0 H GLY A 46 16.082 -17.728 -9.223 1.00 2.33 H new ATOM 0 HA2 GLY A 46 14.109 -18.010 -8.172 1.00 64.32 H new ATOM 0 HA3 GLY A 46 13.965 -19.610 -8.872 1.00 64.32 H new ATOM 722 N ASP A 47 16.246 -19.674 -6.668 1.00 11.04 N ATOM 723 CA ASP A 47 16.683 -20.251 -5.402 1.00 0.13 C ATOM 724 C ASP A 47 17.801 -19.418 -4.782 1.00 62.23 C ATOM 725 O ASP A 47 18.421 -19.825 -3.798 1.00 55.13 O ATOM 726 CB ASP A 47 17.157 -21.690 -5.609 1.00 62.13 C ATOM 727 CG ASP A 47 16.296 -22.696 -4.870 1.00 41.35 C ATOM 728 OD1 ASP A 47 16.394 -22.761 -3.627 1.00 0.10 O ATOM 729 OD2 ASP A 47 15.524 -23.417 -5.536 1.00 13.24 O ATOM 0 H ASP A 47 17.005 -19.367 -7.276 1.00 11.04 H new ATOM 0 HA ASP A 47 15.833 -20.252 -4.719 1.00 0.13 H new ATOM 0 HB2 ASP A 47 17.149 -21.922 -6.674 1.00 62.13 H new ATOM 0 HB3 ASP A 47 18.189 -21.782 -5.271 1.00 62.13 H new ATOM 734 N LEU A 48 18.055 -18.252 -5.365 1.00 43.20 N ATOM 735 CA LEU A 48 19.100 -17.361 -4.871 1.00 61.42 C ATOM 736 C LEU A 48 18.949 -17.123 -3.372 1.00 53.23 C ATOM 737 O LEU A 48 19.925 -17.171 -2.623 1.00 63.52 O ATOM 738 CB LEU A 48 19.056 -16.027 -5.619 1.00 30.54 C ATOM 739 CG LEU A 48 19.131 -16.110 -7.144 1.00 15.23 C ATOM 740 CD1 LEU A 48 17.745 -15.965 -7.754 1.00 62.43 C ATOM 741 CD2 LEU A 48 20.070 -15.044 -7.690 1.00 31.50 C ATOM 0 H LEU A 48 17.552 -17.901 -6.180 1.00 43.20 H new ATOM 0 HA LEU A 48 20.064 -17.838 -5.049 1.00 61.42 H new ATOM 0 HB2 LEU A 48 18.135 -15.512 -5.348 1.00 30.54 H new ATOM 0 HB3 LEU A 48 19.882 -15.409 -5.268 1.00 30.54 H new ATOM 0 HG LEU A 48 19.526 -17.088 -7.417 1.00 15.23 H new ATOM 0 HD11 LEU A 48 17.817 -16.026 -8.840 1.00 62.43 H new ATOM 0 HD12 LEU A 48 17.101 -16.764 -7.387 1.00 62.43 H new ATOM 0 HD13 LEU A 48 17.323 -15.000 -7.472 1.00 62.43 H new ATOM 0 HD21 LEU A 48 20.111 -15.118 -8.777 1.00 31.50 H new ATOM 0 HD22 LEU A 48 19.704 -14.057 -7.407 1.00 31.50 H new ATOM 0 HD23 LEU A 48 21.068 -15.193 -7.278 1.00 31.50 H new ATOM 753 N LEU A 49 17.719 -16.867 -2.941 1.00 13.13 N ATOM 754 CA LEU A 49 17.438 -16.623 -1.530 1.00 62.00 C ATOM 755 C LEU A 49 16.037 -17.101 -1.163 1.00 12.50 C ATOM 756 O LEU A 49 15.226 -17.405 -2.037 1.00 40.53 O ATOM 757 CB LEU A 49 17.582 -15.134 -1.211 1.00 54.23 C ATOM 758 CG LEU A 49 18.933 -14.503 -1.547 1.00 4.20 C ATOM 759 CD1 LEU A 49 18.962 -14.042 -2.996 1.00 23.00 C ATOM 760 CD2 LEU A 49 19.227 -13.340 -0.610 1.00 33.32 C ATOM 0 H LEU A 49 16.900 -16.823 -3.548 1.00 13.13 H new ATOM 0 HA LEU A 49 18.160 -17.186 -0.938 1.00 62.00 H new ATOM 0 HB2 LEU A 49 16.806 -14.591 -1.750 1.00 54.23 H new ATOM 0 HB3 LEU A 49 17.391 -14.991 -0.147 1.00 54.23 H new ATOM 0 HG LEU A 49 19.708 -15.258 -1.412 1.00 4.20 H new ATOM 0 HD11 LEU A 49 19.932 -13.596 -3.216 1.00 23.00 H new ATOM 0 HD12 LEU A 49 18.798 -14.896 -3.653 1.00 23.00 H new ATOM 0 HD13 LEU A 49 18.177 -13.303 -3.159 1.00 23.00 H new ATOM 0 HD21 LEU A 49 20.193 -12.903 -0.864 1.00 33.32 H new ATOM 0 HD22 LEU A 49 18.448 -12.584 -0.713 1.00 33.32 H new ATOM 0 HD23 LEU A 49 19.251 -13.699 0.419 1.00 33.32 H new ATOM 772 N GLU A 50 15.759 -17.162 0.136 1.00 41.34 N ATOM 773 CA GLU A 50 14.455 -17.601 0.617 1.00 13.23 C ATOM 774 C GLU A 50 14.143 -16.988 1.980 1.00 42.13 C ATOM 775 O GLU A 50 15.036 -16.794 2.805 1.00 63.23 O ATOM 776 CB GLU A 50 14.408 -19.127 0.710 1.00 71.41 C ATOM 777 CG GLU A 50 14.200 -19.812 -0.630 1.00 64.44 C ATOM 778 CD GLU A 50 13.654 -21.220 -0.488 1.00 2.31 C ATOM 779 OE1 GLU A 50 14.138 -21.956 0.397 1.00 33.33 O ATOM 780 OE2 GLU A 50 12.744 -21.585 -1.261 1.00 1.30 O ATOM 0 H GLU A 50 16.419 -16.913 0.873 1.00 41.34 H new ATOM 0 HA GLU A 50 13.702 -17.264 -0.095 1.00 13.23 H new ATOM 0 HB2 GLU A 50 15.339 -19.485 1.151 1.00 71.41 H new ATOM 0 HB3 GLU A 50 13.603 -19.417 1.386 1.00 71.41 H new ATOM 0 HG2 GLU A 50 13.513 -19.219 -1.234 1.00 64.44 H new ATOM 0 HG3 GLU A 50 15.148 -19.847 -1.167 1.00 64.44 H new ATOM 787 N VAL A 51 12.869 -16.684 2.208 1.00 25.01 N ATOM 788 CA VAL A 51 12.439 -16.094 3.470 1.00 53.43 C ATOM 789 C VAL A 51 11.985 -17.167 4.452 1.00 21.34 C ATOM 790 O VAL A 51 11.336 -18.140 4.069 1.00 4.40 O ATOM 791 CB VAL A 51 11.290 -15.090 3.256 1.00 31.05 C ATOM 792 CG1 VAL A 51 10.164 -15.729 2.458 1.00 12.03 C ATOM 793 CG2 VAL A 51 10.780 -14.573 4.593 1.00 2.51 C ATOM 0 H VAL A 51 12.117 -16.837 1.536 1.00 25.01 H new ATOM 0 HA VAL A 51 13.300 -15.568 3.884 1.00 53.43 H new ATOM 0 HB VAL A 51 11.672 -14.243 2.686 1.00 31.05 H new ATOM 0 HG11 VAL A 51 9.362 -15.005 2.317 1.00 12.03 H new ATOM 0 HG12 VAL A 51 10.542 -16.046 1.486 1.00 12.03 H new ATOM 0 HG13 VAL A 51 9.781 -16.595 2.998 1.00 12.03 H new ATOM 0 HG21 VAL A 51 9.969 -13.865 4.424 1.00 2.51 H new ATOM 0 HG22 VAL A 51 10.414 -15.408 5.190 1.00 2.51 H new ATOM 0 HG23 VAL A 51 11.591 -14.075 5.124 1.00 2.51 H new ATOM 803 N ASN A 52 12.331 -16.983 5.722 1.00 30.45 N ATOM 804 CA ASN A 52 11.959 -17.937 6.762 1.00 41.24 C ATOM 805 C ASN A 52 10.750 -17.440 7.548 1.00 73.00 C ATOM 806 O ASN A 52 10.819 -16.420 8.236 1.00 74.43 O ATOM 807 CB ASN A 52 13.136 -18.174 7.710 1.00 11.01 C ATOM 808 CG ASN A 52 13.359 -19.646 7.998 1.00 71.10 C ATOM 809 OD1 ASN A 52 14.492 -20.127 7.991 1.00 43.34 O ATOM 810 ND2 ASN A 52 12.275 -20.370 8.253 1.00 0.31 N ATOM 0 H ASN A 52 12.868 -16.183 6.056 1.00 30.45 H new ATOM 0 HA ASN A 52 11.695 -18.878 6.280 1.00 41.24 H new ATOM 0 HB2 ASN A 52 14.041 -17.751 7.274 1.00 11.01 H new ATOM 0 HB3 ASN A 52 12.956 -17.646 8.647 1.00 11.01 H new ATOM 0 HD21 ASN A 52 12.363 -21.366 8.454 1.00 0.31 H new ATOM 0 HD22 ASN A 52 11.355 -19.930 8.248 1.00 0.31 H new ATOM 817 N LEU A 53 9.643 -18.167 7.442 1.00 21.24 N ATOM 818 CA LEU A 53 8.417 -17.802 8.144 1.00 5.31 C ATOM 819 C LEU A 53 8.610 -17.884 9.655 1.00 31.10 C ATOM 820 O LEU A 53 7.798 -17.367 10.422 1.00 3.01 O ATOM 821 CB LEU A 53 7.268 -18.715 7.714 1.00 24.33 C ATOM 822 CG LEU A 53 6.765 -18.532 6.282 1.00 21.31 C ATOM 823 CD1 LEU A 53 5.586 -19.453 6.009 1.00 61.22 C ATOM 824 CD2 LEU A 53 6.380 -17.081 6.034 1.00 73.35 C ATOM 0 H LEU A 53 9.569 -19.013 6.877 1.00 21.24 H new ATOM 0 HA LEU A 53 8.171 -16.773 7.883 1.00 5.31 H new ATOM 0 HB2 LEU A 53 7.588 -19.750 7.836 1.00 24.33 H new ATOM 0 HB3 LEU A 53 6.431 -18.558 8.395 1.00 24.33 H new ATOM 0 HG LEU A 53 7.571 -18.795 5.597 1.00 21.31 H new ATOM 0 HD11 LEU A 53 5.241 -19.309 4.985 1.00 61.22 H new ATOM 0 HD12 LEU A 53 5.895 -20.489 6.146 1.00 61.22 H new ATOM 0 HD13 LEU A 53 4.776 -19.222 6.701 1.00 61.22 H new ATOM 0 HD21 LEU A 53 6.024 -16.969 5.010 1.00 73.35 H new ATOM 0 HD22 LEU A 53 5.590 -16.791 6.726 1.00 73.35 H new ATOM 0 HD23 LEU A 53 7.250 -16.442 6.188 1.00 73.35 H new ATOM 836 N GLN A 54 9.690 -18.536 10.074 1.00 11.52 N ATOM 837 CA GLN A 54 9.989 -18.684 11.494 1.00 42.44 C ATOM 838 C GLN A 54 9.963 -17.332 12.199 1.00 3.13 C ATOM 839 O GLN A 54 9.198 -17.127 13.141 1.00 41.15 O ATOM 840 CB GLN A 54 11.356 -19.345 11.682 1.00 52.50 C ATOM 841 CG GLN A 54 11.630 -19.777 13.113 1.00 21.32 C ATOM 842 CD GLN A 54 11.807 -21.277 13.246 1.00 62.15 C ATOM 843 OE1 GLN A 54 12.854 -21.823 12.896 1.00 20.43 O ATOM 844 NE2 GLN A 54 10.782 -21.952 13.752 1.00 22.14 N ATOM 0 H GLN A 54 10.372 -18.970 9.451 1.00 11.52 H new ATOM 0 HA GLN A 54 9.222 -19.319 11.938 1.00 42.44 H new ATOM 0 HB2 GLN A 54 11.422 -20.215 11.029 1.00 52.50 H new ATOM 0 HB3 GLN A 54 12.133 -18.649 11.366 1.00 52.50 H new ATOM 0 HG2 GLN A 54 12.528 -19.276 13.474 1.00 21.32 H new ATOM 0 HG3 GLN A 54 10.806 -19.454 13.750 1.00 21.32 H new ATOM 0 HE21 GLN A 54 9.933 -21.459 14.029 1.00 22.14 H new ATOM 0 HE22 GLN A 54 10.843 -22.964 13.864 1.00 22.14 H new ATOM 853 N ASN A 55 10.805 -16.413 11.738 1.00 42.31 N ATOM 854 CA ASN A 55 10.879 -15.080 12.326 1.00 63.21 C ATOM 855 C ASN A 55 10.544 -14.010 11.292 1.00 51.22 C ATOM 856 O ASN A 55 10.074 -12.926 11.635 1.00 51.12 O ATOM 857 CB ASN A 55 12.275 -14.831 12.901 1.00 41.54 C ATOM 858 CG ASN A 55 12.270 -14.744 14.415 1.00 41.04 C ATOM 859 OD1 ASN A 55 12.872 -15.574 15.097 1.00 53.41 O ATOM 860 ND2 ASN A 55 11.589 -13.736 14.947 1.00 35.42 N ATOM 0 H ASN A 55 11.446 -16.567 10.959 1.00 42.31 H new ATOM 0 HA ASN A 55 10.146 -15.024 13.131 1.00 63.21 H new ATOM 0 HB2 ASN A 55 12.942 -15.634 12.588 1.00 41.54 H new ATOM 0 HB3 ASN A 55 12.675 -13.905 12.488 1.00 41.54 H new ATOM 0 HD21 ASN A 55 11.550 -13.626 15.960 1.00 35.42 H new ATOM 0 HD22 ASN A 55 11.105 -13.072 14.342 1.00 35.42 H new ATOM 867 N GLY A 56 10.789 -14.323 10.023 1.00 51.11 N ATOM 868 CA GLY A 56 10.507 -13.378 8.958 1.00 72.20 C ATOM 869 C GLY A 56 11.764 -12.740 8.401 1.00 71.43 C ATOM 870 O GLY A 56 11.700 -11.711 7.728 1.00 74.22 O ATOM 0 H GLY A 56 11.178 -15.214 9.714 1.00 51.11 H new ATOM 0 HA2 GLY A 56 9.976 -13.889 8.155 1.00 72.20 H new ATOM 0 HA3 GLY A 56 9.844 -12.599 9.334 1.00 72.20 H new ATOM 874 N ILE A 57 12.910 -13.351 8.682 1.00 30.11 N ATOM 875 CA ILE A 57 14.187 -12.836 8.204 1.00 10.45 C ATOM 876 C ILE A 57 14.576 -13.475 6.876 1.00 55.13 C ATOM 877 O ILE A 57 14.167 -14.596 6.570 1.00 33.04 O ATOM 878 CB ILE A 57 15.311 -13.081 9.228 1.00 65.42 C ATOM 879 CG1 ILE A 57 16.571 -12.309 8.829 1.00 31.25 C ATOM 880 CG2 ILE A 57 15.609 -14.569 9.341 1.00 62.15 C ATOM 881 CD1 ILE A 57 16.339 -10.825 8.654 1.00 43.33 C ATOM 0 H ILE A 57 12.980 -14.203 9.238 1.00 30.11 H new ATOM 0 HA ILE A 57 14.062 -11.762 8.064 1.00 10.45 H new ATOM 0 HB ILE A 57 14.980 -12.721 10.202 1.00 65.42 H new ATOM 0 HG12 ILE A 57 17.337 -12.462 9.589 1.00 31.25 H new ATOM 0 HG13 ILE A 57 16.960 -12.720 7.897 1.00 31.25 H new ATOM 0 HG21 ILE A 57 16.405 -14.726 10.068 1.00 62.15 H new ATOM 0 HG22 ILE A 57 14.712 -15.096 9.666 1.00 62.15 H new ATOM 0 HG23 ILE A 57 15.924 -14.952 8.370 1.00 62.15 H new ATOM 0 HD11 ILE A 57 17.274 -10.341 8.372 1.00 43.33 H new ATOM 0 HD12 ILE A 57 15.596 -10.662 7.873 1.00 43.33 H new ATOM 0 HD13 ILE A 57 15.979 -10.400 9.591 1.00 43.33 H new ATOM 893 N LEU A 58 15.369 -12.756 6.089 1.00 12.13 N ATOM 894 CA LEU A 58 15.815 -13.253 4.793 1.00 63.34 C ATOM 895 C LEU A 58 17.179 -13.927 4.908 1.00 71.10 C ATOM 896 O LEU A 58 18.171 -13.288 5.258 1.00 43.22 O ATOM 897 CB LEU A 58 15.884 -12.108 3.781 1.00 53.10 C ATOM 898 CG LEU A 58 15.226 -12.370 2.425 1.00 3.54 C ATOM 899 CD1 LEU A 58 15.979 -13.452 1.667 1.00 33.13 C ATOM 900 CD2 LEU A 58 13.767 -12.759 2.607 1.00 74.41 C ATOM 0 H LEU A 58 15.716 -11.827 6.326 1.00 12.13 H new ATOM 0 HA LEU A 58 15.092 -13.992 4.447 1.00 63.34 H new ATOM 0 HB2 LEU A 58 15.417 -11.229 4.225 1.00 53.10 H new ATOM 0 HB3 LEU A 58 16.932 -11.862 3.612 1.00 53.10 H new ATOM 0 HG LEU A 58 15.265 -11.452 1.839 1.00 3.54 H new ATOM 0 HD11 LEU A 58 15.497 -13.625 0.705 1.00 33.13 H new ATOM 0 HD12 LEU A 58 17.009 -13.133 1.505 1.00 33.13 H new ATOM 0 HD13 LEU A 58 15.972 -14.375 2.247 1.00 33.13 H new ATOM 0 HD21 LEU A 58 13.315 -12.942 1.632 1.00 74.41 H new ATOM 0 HD22 LEU A 58 13.704 -13.664 3.211 1.00 74.41 H new ATOM 0 HD23 LEU A 58 13.235 -11.951 3.108 1.00 74.41 H new ATOM 912 N PHE A 59 17.221 -15.221 4.610 1.00 73.44 N ATOM 913 CA PHE A 59 18.463 -15.982 4.679 1.00 71.15 C ATOM 914 C PHE A 59 18.923 -16.399 3.285 1.00 62.22 C ATOM 915 O PHE A 59 18.108 -16.717 2.419 1.00 62.04 O ATOM 916 CB PHE A 59 18.280 -17.220 5.559 1.00 15.21 C ATOM 917 CG PHE A 59 17.234 -18.169 5.048 1.00 33.34 C ATOM 918 CD1 PHE A 59 17.570 -19.180 4.163 1.00 61.32 C ATOM 919 CD2 PHE A 59 15.914 -18.050 5.454 1.00 60.34 C ATOM 920 CE1 PHE A 59 16.610 -20.056 3.691 1.00 3.02 C ATOM 921 CE2 PHE A 59 14.950 -18.923 4.986 1.00 60.13 C ATOM 922 CZ PHE A 59 15.298 -19.926 4.103 1.00 63.45 C ATOM 0 H PHE A 59 16.409 -15.765 4.318 1.00 73.44 H new ATOM 0 HA PHE A 59 19.228 -15.342 5.119 1.00 71.15 H new ATOM 0 HB2 PHE A 59 19.231 -17.747 5.634 1.00 15.21 H new ATOM 0 HB3 PHE A 59 18.011 -16.903 6.567 1.00 15.21 H new ATOM 0 HD1 PHE A 59 18.594 -19.285 3.838 1.00 61.32 H new ATOM 0 HD2 PHE A 59 15.636 -17.267 6.143 1.00 60.34 H new ATOM 0 HE1 PHE A 59 16.885 -20.840 3.002 1.00 3.02 H new ATOM 0 HE2 PHE A 59 13.925 -18.821 5.311 1.00 60.13 H new ATOM 0 HZ PHE A 59 14.546 -20.608 3.735 1.00 63.45 H new ATOM 932 N VAL A 60 20.236 -16.395 3.076 1.00 70.02 N ATOM 933 CA VAL A 60 20.806 -16.773 1.788 1.00 23.23 C ATOM 934 C VAL A 60 20.615 -18.261 1.518 1.00 22.55 C ATOM 935 O VAL A 60 20.667 -19.080 2.435 1.00 63.41 O ATOM 936 CB VAL A 60 22.308 -16.439 1.720 1.00 63.11 C ATOM 937 CG1 VAL A 60 22.893 -16.877 0.386 1.00 72.42 C ATOM 938 CG2 VAL A 60 22.534 -14.952 1.947 1.00 13.12 C ATOM 0 H VAL A 60 20.925 -16.134 3.782 1.00 70.02 H new ATOM 0 HA VAL A 60 20.278 -16.198 1.027 1.00 23.23 H new ATOM 0 HB VAL A 60 22.820 -16.986 2.512 1.00 63.11 H new ATOM 0 HG11 VAL A 60 23.955 -16.633 0.357 1.00 72.42 H new ATOM 0 HG12 VAL A 60 22.765 -17.953 0.268 1.00 72.42 H new ATOM 0 HG13 VAL A 60 22.379 -16.360 -0.424 1.00 72.42 H new ATOM 0 HG21 VAL A 60 23.601 -14.734 1.896 1.00 13.12 H new ATOM 0 HG22 VAL A 60 22.010 -14.383 1.179 1.00 13.12 H new ATOM 0 HG23 VAL A 60 22.153 -14.672 2.929 1.00 13.12 H new ATOM 948 N ASN A 61 20.394 -18.604 0.254 1.00 71.25 N ATOM 949 CA ASN A 61 20.195 -19.995 -0.138 1.00 12.02 C ATOM 950 C ASN A 61 21.268 -20.441 -1.127 1.00 12.33 C ATOM 951 O ASN A 61 22.201 -21.158 -0.765 1.00 15.20 O ATOM 952 CB ASN A 61 18.807 -20.179 -0.756 1.00 45.01 C ATOM 953 CG ASN A 61 18.609 -21.570 -1.327 1.00 13.12 C ATOM 954 OD1 ASN A 61 19.126 -21.894 -2.396 1.00 31.01 O ATOM 955 ND2 ASN A 61 17.856 -22.400 -0.614 1.00 53.41 N ATOM 0 H ASN A 61 20.348 -17.938 -0.517 1.00 71.25 H new ATOM 0 HA ASN A 61 20.272 -20.613 0.757 1.00 12.02 H new ATOM 0 HB2 ASN A 61 18.047 -19.988 0.001 1.00 45.01 H new ATOM 0 HB3 ASN A 61 18.663 -19.441 -1.545 1.00 45.01 H new ATOM 0 HD21 ASN A 61 17.687 -23.349 -0.948 1.00 53.41 H new ATOM 0 HD22 ASN A 61 17.447 -22.088 0.267 1.00 53.41 H new ATOM 962 N SER A 62 21.128 -20.010 -2.377 1.00 24.25 N ATOM 963 CA SER A 62 22.084 -20.367 -3.419 1.00 34.11 C ATOM 964 C SER A 62 23.449 -19.746 -3.141 1.00 11.34 C ATOM 965 O SER A 62 23.660 -19.124 -2.099 1.00 34.52 O ATOM 966 CB SER A 62 21.572 -19.911 -4.787 1.00 2.23 C ATOM 967 OG SER A 62 22.180 -18.692 -5.178 1.00 11.34 O ATOM 0 H SER A 62 20.363 -19.414 -2.692 1.00 24.25 H new ATOM 0 HA SER A 62 22.193 -21.452 -3.422 1.00 34.11 H new ATOM 0 HB2 SER A 62 21.779 -20.680 -5.531 1.00 2.23 H new ATOM 0 HB3 SER A 62 20.490 -19.786 -4.751 1.00 2.23 H new ATOM 0 HG SER A 62 21.963 -18.504 -6.115 1.00 11.34 H new ATOM 973 N ARG A 63 24.373 -19.918 -4.080 1.00 21.41 N ATOM 974 CA ARG A 63 25.719 -19.376 -3.936 1.00 71.33 C ATOM 975 C ARG A 63 25.737 -17.880 -4.236 1.00 63.35 C ATOM 976 O ARG A 63 25.081 -17.416 -5.169 1.00 73.42 O ATOM 977 CB ARG A 63 26.688 -20.106 -4.868 1.00 72.23 C ATOM 978 CG ARG A 63 27.388 -21.286 -4.215 1.00 63.54 C ATOM 979 CD ARG A 63 27.849 -22.302 -5.249 1.00 31.40 C ATOM 980 NE ARG A 63 26.865 -23.363 -5.450 1.00 42.13 N ATOM 981 CZ ARG A 63 26.724 -24.400 -4.632 1.00 5.30 C ATOM 982 NH1 ARG A 63 27.500 -24.515 -3.563 1.00 11.54 N ATOM 983 NH2 ARG A 63 25.806 -25.324 -4.882 1.00 62.33 N ATOM 0 H ARG A 63 24.215 -20.428 -4.949 1.00 21.41 H new ATOM 0 HA ARG A 63 26.036 -19.526 -2.904 1.00 71.33 H new ATOM 0 HB2 ARG A 63 26.142 -20.457 -5.743 1.00 72.23 H new ATOM 0 HB3 ARG A 63 27.439 -19.400 -5.223 1.00 72.23 H new ATOM 0 HG2 ARG A 63 28.246 -20.931 -3.644 1.00 63.54 H new ATOM 0 HG3 ARG A 63 26.711 -21.766 -3.508 1.00 63.54 H new ATOM 0 HD2 ARG A 63 28.035 -21.796 -6.196 1.00 31.40 H new ATOM 0 HD3 ARG A 63 28.795 -22.740 -4.930 1.00 31.40 H new ATOM 0 HE ARG A 63 26.252 -23.304 -6.263 1.00 42.13 H new ATOM 0 HH11 ARG A 63 28.207 -23.806 -3.367 1.00 11.54 H new ATOM 0 HH12 ARG A 63 27.390 -25.312 -2.936 1.00 11.54 H new ATOM 0 HH21 ARG A 63 25.207 -25.239 -5.703 1.00 62.33 H new ATOM 0 HH22 ARG A 63 25.699 -26.120 -4.253 1.00 62.33 H new ATOM 997 N ILE A 64 26.492 -17.132 -3.440 1.00 5.41 N ATOM 998 CA ILE A 64 26.596 -15.689 -3.621 1.00 24.00 C ATOM 999 C ILE A 64 27.966 -15.301 -4.168 1.00 10.12 C ATOM 1000 O ILE A 64 28.155 -14.191 -4.666 1.00 2.02 O ATOM 1001 CB ILE A 64 26.352 -14.937 -2.300 1.00 13.34 C ATOM 1002 CG1 ILE A 64 25.063 -15.430 -1.638 1.00 4.23 C ATOM 1003 CG2 ILE A 64 26.286 -13.437 -2.548 1.00 74.22 C ATOM 1004 CD1 ILE A 64 23.818 -15.134 -2.444 1.00 63.53 C ATOM 0 H ILE A 64 27.041 -17.501 -2.663 1.00 5.41 H new ATOM 0 HA ILE A 64 25.827 -15.405 -4.339 1.00 24.00 H new ATOM 0 HB ILE A 64 27.185 -15.138 -1.626 1.00 13.34 H new ATOM 0 HG12 ILE A 64 25.135 -16.506 -1.478 1.00 4.23 H new ATOM 0 HG13 ILE A 64 24.969 -14.967 -0.656 1.00 4.23 H new ATOM 0 HG21 ILE A 64 26.113 -12.919 -1.604 1.00 74.22 H new ATOM 0 HG22 ILE A 64 27.227 -13.098 -2.981 1.00 74.22 H new ATOM 0 HG23 ILE A 64 25.470 -13.218 -3.237 1.00 74.22 H new ATOM 0 HD11 ILE A 64 22.943 -15.512 -1.914 1.00 63.53 H new ATOM 0 HD12 ILE A 64 23.722 -14.057 -2.582 1.00 63.53 H new ATOM 0 HD13 ILE A 64 23.891 -15.620 -3.417 1.00 63.53 H new ATOM 1016 N ASP A 65 28.918 -16.223 -4.073 1.00 55.02 N ATOM 1017 CA ASP A 65 30.270 -15.979 -4.561 1.00 51.02 C ATOM 1018 C ASP A 65 30.242 -15.402 -5.973 1.00 43.01 C ATOM 1019 O ASP A 65 29.322 -15.670 -6.746 1.00 23.30 O ATOM 1020 CB ASP A 65 31.083 -17.274 -4.542 1.00 24.00 C ATOM 1021 CG ASP A 65 32.574 -17.020 -4.435 1.00 1.24 C ATOM 1022 OD1 ASP A 65 32.972 -15.837 -4.380 1.00 63.23 O ATOM 1023 OD2 ASP A 65 33.343 -18.003 -4.404 1.00 34.50 O ATOM 0 H ASP A 65 28.778 -17.146 -3.662 1.00 55.02 H new ATOM 0 HA ASP A 65 30.743 -15.252 -3.900 1.00 51.02 H new ATOM 0 HB2 ASP A 65 30.761 -17.889 -3.702 1.00 24.00 H new ATOM 0 HB3 ASP A 65 30.878 -17.841 -5.450 1.00 24.00 H new ATOM 1028 N ARG A 66 31.256 -14.608 -6.302 1.00 53.32 N ATOM 1029 CA ARG A 66 31.346 -13.991 -7.620 1.00 42.12 C ATOM 1030 C ARG A 66 31.169 -15.032 -8.721 1.00 70.42 C ATOM 1031 O ARG A 66 30.658 -14.729 -9.799 1.00 4.12 O ATOM 1032 CB ARG A 66 32.693 -13.284 -7.784 1.00 53.34 C ATOM 1033 CG ARG A 66 33.874 -14.098 -7.282 1.00 73.23 C ATOM 1034 CD ARG A 66 35.173 -13.658 -7.939 1.00 20.43 C ATOM 1035 NE ARG A 66 35.421 -14.368 -9.191 1.00 2.31 N ATOM 1036 CZ ARG A 66 36.326 -13.986 -10.085 1.00 4.20 C ATOM 1037 NH1 ARG A 66 37.066 -12.907 -9.866 1.00 34.34 N ATOM 1038 NH2 ARG A 66 36.494 -14.684 -11.201 1.00 51.30 N ATOM 0 H ARG A 66 32.026 -14.377 -5.674 1.00 53.32 H new ATOM 0 HA ARG A 66 30.545 -13.257 -7.706 1.00 42.12 H new ATOM 0 HB2 ARG A 66 32.845 -13.051 -8.838 1.00 53.34 H new ATOM 0 HB3 ARG A 66 32.663 -12.335 -7.249 1.00 53.34 H new ATOM 0 HG2 ARG A 66 33.958 -13.991 -6.200 1.00 73.23 H new ATOM 0 HG3 ARG A 66 33.702 -15.155 -7.486 1.00 73.23 H new ATOM 0 HD2 ARG A 66 35.137 -12.586 -8.131 1.00 20.43 H new ATOM 0 HD3 ARG A 66 36.003 -13.831 -7.254 1.00 20.43 H new ATOM 0 HE ARG A 66 34.869 -15.203 -9.390 1.00 2.31 H new ATOM 0 HH11 ARG A 66 36.941 -12.368 -9.009 1.00 34.34 H new ATOM 0 HH12 ARG A 66 37.760 -12.616 -10.555 1.00 34.34 H new ATOM 0 HH21 ARG A 66 35.928 -15.515 -11.373 1.00 51.30 H new ATOM 0 HH22 ARG A 66 37.189 -14.390 -11.887 1.00 51.30 H new ATOM 1052 N GLU A 67 31.595 -16.260 -8.441 1.00 70.34 N ATOM 1053 CA GLU A 67 31.484 -17.345 -9.409 1.00 62.51 C ATOM 1054 C GLU A 67 30.023 -17.623 -9.750 1.00 40.05 C ATOM 1055 O GLU A 67 29.662 -17.747 -10.920 1.00 55.21 O ATOM 1056 CB GLU A 67 32.142 -18.615 -8.863 1.00 14.41 C ATOM 1057 CG GLU A 67 33.581 -18.797 -9.313 1.00 43.44 C ATOM 1058 CD GLU A 67 34.551 -18.873 -8.150 1.00 44.33 C ATOM 1059 OE1 GLU A 67 34.211 -19.517 -7.136 1.00 12.42 O ATOM 1060 OE2 GLU A 67 35.650 -18.289 -8.254 1.00 41.32 O ATOM 0 H GLU A 67 32.020 -16.528 -7.553 1.00 70.34 H new ATOM 0 HA GLU A 67 32.000 -17.039 -10.319 1.00 62.51 H new ATOM 0 HB2 GLU A 67 32.111 -18.590 -7.774 1.00 14.41 H new ATOM 0 HB3 GLU A 67 31.559 -19.480 -9.179 1.00 14.41 H new ATOM 0 HG2 GLU A 67 33.660 -19.708 -9.907 1.00 43.44 H new ATOM 0 HG3 GLU A 67 33.862 -17.968 -9.962 1.00 43.44 H new ATOM 1067 N GLU A 68 29.189 -17.720 -8.720 1.00 53.11 N ATOM 1068 CA GLU A 68 27.767 -17.984 -8.911 1.00 65.31 C ATOM 1069 C GLU A 68 27.014 -16.698 -9.237 1.00 33.10 C ATOM 1070 O GLU A 68 26.325 -16.609 -10.255 1.00 25.23 O ATOM 1071 CB GLU A 68 27.174 -18.633 -7.659 1.00 11.12 C ATOM 1072 CG GLU A 68 25.696 -18.960 -7.785 1.00 75.33 C ATOM 1073 CD GLU A 68 25.448 -20.269 -8.511 1.00 13.51 C ATOM 1074 OE1 GLU A 68 26.325 -21.155 -8.453 1.00 61.12 O ATOM 1075 OE2 GLU A 68 24.375 -20.405 -9.136 1.00 64.43 O ATOM 0 H GLU A 68 29.473 -17.620 -7.745 1.00 53.11 H new ATOM 0 HA GLU A 68 27.660 -18.669 -9.752 1.00 65.31 H new ATOM 0 HB2 GLU A 68 27.723 -19.549 -7.440 1.00 11.12 H new ATOM 0 HB3 GLU A 68 27.319 -17.964 -6.810 1.00 11.12 H new ATOM 0 HG2 GLU A 68 25.253 -19.011 -6.790 1.00 75.33 H new ATOM 0 HG3 GLU A 68 25.193 -18.153 -8.317 1.00 75.33 H new ATOM 1082 N LEU A 69 27.148 -15.704 -8.366 1.00 70.11 N ATOM 1083 CA LEU A 69 26.480 -14.422 -8.560 1.00 13.23 C ATOM 1084 C LEU A 69 26.672 -13.917 -9.986 1.00 71.53 C ATOM 1085 O LEU A 69 25.745 -13.945 -10.796 1.00 72.02 O ATOM 1086 CB LEU A 69 27.015 -13.390 -7.565 1.00 62.14 C ATOM 1087 CG LEU A 69 25.964 -12.632 -6.753 1.00 64.22 C ATOM 1088 CD1 LEU A 69 25.172 -11.693 -7.649 1.00 45.15 C ATOM 1089 CD2 LEU A 69 25.035 -13.606 -6.044 1.00 15.32 C ATOM 0 H LEU A 69 27.713 -15.761 -7.519 1.00 70.11 H new ATOM 0 HA LEU A 69 25.414 -14.567 -8.387 1.00 13.23 H new ATOM 0 HB2 LEU A 69 27.685 -13.898 -6.871 1.00 62.14 H new ATOM 0 HB3 LEU A 69 27.615 -12.664 -8.113 1.00 62.14 H new ATOM 0 HG LEU A 69 26.476 -12.034 -5.999 1.00 64.22 H new ATOM 0 HD11 LEU A 69 24.429 -11.162 -7.054 1.00 45.15 H new ATOM 0 HD12 LEU A 69 25.848 -10.974 -8.110 1.00 45.15 H new ATOM 0 HD13 LEU A 69 24.670 -12.269 -8.426 1.00 45.15 H new ATOM 0 HD21 LEU A 69 24.293 -13.050 -5.471 1.00 15.32 H new ATOM 0 HD22 LEU A 69 24.530 -14.230 -6.782 1.00 15.32 H new ATOM 0 HD23 LEU A 69 25.615 -14.237 -5.371 1.00 15.32 H new ATOM 1101 N CYS A 70 27.882 -13.459 -10.288 1.00 50.12 N ATOM 1102 CA CYS A 70 28.198 -12.950 -11.617 1.00 52.23 C ATOM 1103 C CYS A 70 29.707 -12.907 -11.839 1.00 10.31 C ATOM 1104 O CYS A 70 30.217 -13.446 -12.820 1.00 54.02 O ATOM 1105 CB CYS A 70 27.603 -11.553 -11.806 1.00 5.44 C ATOM 1106 SG CYS A 70 27.602 -10.535 -10.294 1.00 61.44 S ATOM 0 H CYS A 70 28.661 -13.430 -9.630 1.00 50.12 H new ATOM 0 HA CYS A 70 27.760 -13.626 -12.351 1.00 52.23 H new ATOM 0 HB2 CYS A 70 28.165 -11.032 -12.582 1.00 5.44 H new ATOM 0 HB3 CYS A 70 26.579 -11.651 -12.166 1.00 5.44 H new ATOM 1111 N GLY A 71 30.417 -12.261 -10.918 1.00 54.25 N ATOM 1112 CA GLY A 71 31.860 -12.159 -11.031 1.00 31.10 C ATOM 1113 C GLY A 71 32.292 -11.351 -12.239 1.00 32.42 C ATOM 1114 O GLY A 71 33.395 -11.534 -12.754 1.00 2.24 O ATOM 0 H GLY A 71 30.018 -11.807 -10.096 1.00 54.25 H new ATOM 0 HA2 GLY A 71 32.260 -11.698 -10.128 1.00 31.10 H new ATOM 0 HA3 GLY A 71 32.288 -13.159 -11.095 1.00 31.10 H new ATOM 1118 N ARG A 72 31.420 -10.457 -12.693 1.00 70.23 N ATOM 1119 CA ARG A 72 31.716 -9.621 -13.850 1.00 42.11 C ATOM 1120 C ARG A 72 32.331 -8.293 -13.418 1.00 24.12 C ATOM 1121 O ARG A 72 33.149 -7.714 -14.133 1.00 61.31 O ATOM 1122 CB ARG A 72 30.444 -9.366 -14.661 1.00 2.21 C ATOM 1123 CG ARG A 72 30.554 -9.790 -16.116 1.00 63.03 C ATOM 1124 CD ARG A 72 31.564 -8.938 -16.870 1.00 33.21 C ATOM 1125 NE ARG A 72 31.519 -9.181 -18.309 1.00 71.43 N ATOM 1126 CZ ARG A 72 32.372 -8.642 -19.173 1.00 22.03 C ATOM 1127 NH1 ARG A 72 33.332 -7.834 -18.744 1.00 52.43 N ATOM 1128 NH2 ARG A 72 32.267 -8.912 -20.468 1.00 10.53 N ATOM 0 H ARG A 72 30.503 -10.293 -12.277 1.00 70.23 H new ATOM 0 HA ARG A 72 32.437 -10.150 -14.474 1.00 42.11 H new ATOM 0 HB2 ARG A 72 29.615 -9.900 -14.197 1.00 2.21 H new ATOM 0 HB3 ARG A 72 30.203 -8.304 -14.618 1.00 2.21 H new ATOM 0 HG2 ARG A 72 30.849 -10.838 -16.169 1.00 63.03 H new ATOM 0 HG3 ARG A 72 29.578 -9.708 -16.595 1.00 63.03 H new ATOM 0 HD2 ARG A 72 31.367 -7.884 -16.674 1.00 33.21 H new ATOM 0 HD3 ARG A 72 32.566 -9.150 -16.498 1.00 33.21 H new ATOM 0 HE ARG A 72 30.792 -9.799 -18.671 1.00 71.43 H new ATOM 0 HH11 ARG A 72 33.416 -7.625 -17.749 1.00 52.43 H new ATOM 0 HH12 ARG A 72 33.986 -7.421 -19.409 1.00 52.43 H new ATOM 0 HH21 ARG A 72 31.531 -9.534 -20.801 1.00 10.53 H new ATOM 0 HH22 ARG A 72 32.923 -8.497 -21.130 1.00 10.53 H new ATOM 1142 N SER A 73 31.932 -7.816 -12.243 1.00 71.22 N ATOM 1143 CA SER A 73 32.440 -6.555 -11.717 1.00 44.34 C ATOM 1144 C SER A 73 32.313 -6.509 -10.198 1.00 13.32 C ATOM 1145 O SER A 73 31.607 -7.319 -9.598 1.00 72.15 O ATOM 1146 CB SER A 73 31.687 -5.378 -12.340 1.00 11.33 C ATOM 1147 OG SER A 73 32.488 -4.209 -12.352 1.00 53.40 O ATOM 0 H SER A 73 31.258 -8.284 -11.637 1.00 71.22 H new ATOM 0 HA SER A 73 33.496 -6.480 -11.978 1.00 44.34 H new ATOM 0 HB2 SER A 73 31.390 -5.630 -13.358 1.00 11.33 H new ATOM 0 HB3 SER A 73 30.772 -5.190 -11.779 1.00 11.33 H new ATOM 0 HG SER A 73 31.985 -3.472 -12.757 1.00 53.40 H new ATOM 1153 N ALA A 74 33.002 -5.554 -9.581 1.00 74.11 N ATOM 1154 CA ALA A 74 32.965 -5.400 -8.132 1.00 55.22 C ATOM 1155 C ALA A 74 31.528 -5.338 -7.623 1.00 43.33 C ATOM 1156 O ALA A 74 31.162 -6.045 -6.685 1.00 50.14 O ATOM 1157 CB ALA A 74 33.729 -4.152 -7.715 1.00 31.25 C ATOM 0 H ALA A 74 33.592 -4.876 -10.062 1.00 74.11 H new ATOM 0 HA ALA A 74 33.443 -6.272 -7.686 1.00 55.22 H new ATOM 0 HB1 ALA A 74 33.693 -4.049 -6.630 1.00 31.25 H new ATOM 0 HB2 ALA A 74 34.767 -4.236 -8.038 1.00 31.25 H new ATOM 0 HB3 ALA A 74 33.275 -3.276 -8.178 1.00 31.25 H new ATOM 1163 N GLU A 75 30.720 -4.487 -8.248 1.00 2.31 N ATOM 1164 CA GLU A 75 29.324 -4.332 -7.856 1.00 23.22 C ATOM 1165 C GLU A 75 28.410 -5.146 -8.767 1.00 51.33 C ATOM 1166 O GLU A 75 28.653 -5.258 -9.969 1.00 53.23 O ATOM 1167 CB GLU A 75 28.921 -2.857 -7.895 1.00 54.15 C ATOM 1168 CG GLU A 75 28.761 -2.232 -6.520 1.00 33.45 C ATOM 1169 CD GLU A 75 28.966 -0.730 -6.533 1.00 73.03 C ATOM 1170 OE1 GLU A 75 30.111 -0.290 -6.767 1.00 21.42 O ATOM 1171 OE2 GLU A 75 27.982 0.006 -6.311 1.00 33.35 O ATOM 0 H GLU A 75 31.008 -3.895 -9.027 1.00 2.31 H new ATOM 0 HA GLU A 75 29.216 -4.703 -6.837 1.00 23.22 H new ATOM 0 HB2 GLU A 75 29.673 -2.299 -8.453 1.00 54.15 H new ATOM 0 HB3 GLU A 75 27.982 -2.760 -8.440 1.00 54.15 H new ATOM 0 HG2 GLU A 75 27.765 -2.455 -6.137 1.00 33.45 H new ATOM 0 HG3 GLU A 75 29.475 -2.686 -5.833 1.00 33.45 H new ATOM 1178 N CYS A 76 27.358 -5.712 -8.187 1.00 34.44 N ATOM 1179 CA CYS A 76 26.406 -6.517 -8.944 1.00 45.30 C ATOM 1180 C CYS A 76 25.002 -6.392 -8.360 1.00 23.33 C ATOM 1181 O CYS A 76 24.813 -6.487 -7.147 1.00 74.22 O ATOM 1182 CB CYS A 76 26.840 -7.984 -8.951 1.00 75.13 C ATOM 1183 SG CYS A 76 26.738 -8.781 -10.586 1.00 65.04 S ATOM 0 H CYS A 76 27.142 -5.628 -7.194 1.00 34.44 H new ATOM 0 HA CYS A 76 26.388 -6.146 -9.969 1.00 45.30 H new ATOM 0 HB2 CYS A 76 27.866 -8.050 -8.590 1.00 75.13 H new ATOM 0 HB3 CYS A 76 26.218 -8.539 -8.248 1.00 75.13 H new ATOM 1188 N SER A 77 24.021 -6.179 -9.231 1.00 64.52 N ATOM 1189 CA SER A 77 22.635 -6.038 -8.802 1.00 71.42 C ATOM 1190 C SER A 77 21.863 -7.335 -9.025 1.00 73.21 C ATOM 1191 O SER A 77 22.193 -8.122 -9.912 1.00 63.44 O ATOM 1192 CB SER A 77 21.959 -4.893 -9.558 1.00 1.20 C ATOM 1193 OG SER A 77 21.670 -5.264 -10.895 1.00 22.03 O ATOM 0 H SER A 77 24.161 -6.100 -10.238 1.00 64.52 H new ATOM 0 HA SER A 77 22.632 -5.812 -7.736 1.00 71.42 H new ATOM 0 HB2 SER A 77 21.038 -4.611 -9.049 1.00 1.20 H new ATOM 0 HB3 SER A 77 22.607 -4.017 -9.553 1.00 1.20 H new ATOM 0 HG SER A 77 21.237 -4.515 -11.356 1.00 22.03 H new ATOM 1199 N ILE A 78 20.833 -7.550 -8.213 1.00 60.13 N ATOM 1200 CA ILE A 78 20.013 -8.750 -8.322 1.00 32.22 C ATOM 1201 C ILE A 78 18.533 -8.421 -8.162 1.00 15.40 C ATOM 1202 O ILE A 78 18.155 -7.596 -7.329 1.00 44.30 O ATOM 1203 CB ILE A 78 20.410 -9.801 -7.268 1.00 40.21 C ATOM 1204 CG1 ILE A 78 21.909 -10.095 -7.350 1.00 23.15 C ATOM 1205 CG2 ILE A 78 19.603 -11.076 -7.461 1.00 41.02 C ATOM 1206 CD1 ILE A 78 22.719 -9.411 -6.270 1.00 72.12 C ATOM 0 H ILE A 78 20.547 -6.909 -7.473 1.00 60.13 H new ATOM 0 HA ILE A 78 20.186 -9.161 -9.317 1.00 32.22 H new ATOM 0 HB ILE A 78 20.190 -9.402 -6.278 1.00 40.21 H new ATOM 0 HG12 ILE A 78 22.064 -11.172 -7.282 1.00 23.15 H new ATOM 0 HG13 ILE A 78 22.280 -9.780 -8.325 1.00 23.15 H new ATOM 0 HG21 ILE A 78 19.895 -11.809 -6.709 1.00 41.02 H new ATOM 0 HG22 ILE A 78 18.541 -10.854 -7.358 1.00 41.02 H new ATOM 0 HG23 ILE A 78 19.794 -11.481 -8.455 1.00 41.02 H new ATOM 0 HD11 ILE A 78 23.772 -9.664 -6.390 1.00 72.12 H new ATOM 0 HD12 ILE A 78 22.594 -8.331 -6.350 1.00 72.12 H new ATOM 0 HD13 ILE A 78 22.375 -9.744 -5.291 1.00 72.12 H new ATOM 1218 N HIS A 79 17.697 -9.072 -8.965 1.00 32.04 N ATOM 1219 CA HIS A 79 16.256 -8.850 -8.911 1.00 22.11 C ATOM 1220 C HIS A 79 15.532 -10.098 -8.414 1.00 44.03 C ATOM 1221 O HIS A 79 15.904 -11.221 -8.756 1.00 23.52 O ATOM 1222 CB HIS A 79 15.728 -8.455 -10.290 1.00 51.12 C ATOM 1223 CG HIS A 79 16.279 -7.156 -10.793 1.00 15.12 C ATOM 1224 ND1 HIS A 79 15.483 -6.135 -11.269 1.00 20.13 N ATOM 1225 CD2 HIS A 79 17.554 -6.714 -10.890 1.00 41.53 C ATOM 1226 CE1 HIS A 79 16.245 -5.122 -11.639 1.00 4.31 C ATOM 1227 NE2 HIS A 79 17.507 -5.447 -11.419 1.00 75.11 N ATOM 0 H HIS A 79 17.992 -9.757 -9.660 1.00 32.04 H new ATOM 0 HA HIS A 79 16.064 -8.037 -8.210 1.00 22.11 H new ATOM 0 HB2 HIS A 79 15.971 -9.243 -11.002 1.00 51.12 H new ATOM 0 HB3 HIS A 79 14.641 -8.387 -10.248 1.00 51.12 H new ATOM 0 HD2 HIS A 79 18.443 -7.256 -10.605 1.00 41.53 H new ATOM 0 HE1 HIS A 79 15.896 -4.187 -12.051 1.00 4.31 H new ATOM 0 HE2 HIS A 79 18.314 -4.854 -11.611 1.00 75.11 H new ATOM 1235 N LEU A 80 14.498 -9.894 -7.606 1.00 51.32 N ATOM 1236 CA LEU A 80 13.722 -11.002 -7.062 1.00 32.43 C ATOM 1237 C LEU A 80 12.233 -10.671 -7.051 1.00 31.23 C ATOM 1238 O LEU A 80 11.848 -9.504 -7.002 1.00 51.42 O ATOM 1239 CB LEU A 80 14.193 -11.333 -5.644 1.00 51.23 C ATOM 1240 CG LEU A 80 13.417 -12.433 -4.919 1.00 2.35 C ATOM 1241 CD1 LEU A 80 14.325 -13.178 -3.953 1.00 24.01 C ATOM 1242 CD2 LEU A 80 12.221 -11.846 -4.183 1.00 42.54 C ATOM 0 H LEU A 80 14.177 -8.971 -7.313 1.00 51.32 H new ATOM 0 HA LEU A 80 13.877 -11.870 -7.702 1.00 32.43 H new ATOM 0 HB2 LEU A 80 15.242 -11.626 -5.690 1.00 51.23 H new ATOM 0 HB3 LEU A 80 14.142 -10.424 -5.044 1.00 51.23 H new ATOM 0 HG LEU A 80 13.050 -13.142 -5.661 1.00 2.35 H new ATOM 0 HD11 LEU A 80 13.756 -13.957 -3.446 1.00 24.01 H new ATOM 0 HD12 LEU A 80 15.149 -13.631 -4.504 1.00 24.01 H new ATOM 0 HD13 LEU A 80 14.722 -12.481 -3.215 1.00 24.01 H new ATOM 0 HD21 LEU A 80 11.681 -12.643 -3.673 1.00 42.54 H new ATOM 0 HD22 LEU A 80 12.567 -11.116 -3.451 1.00 42.54 H new ATOM 0 HD23 LEU A 80 11.558 -11.358 -4.897 1.00 42.54 H new ATOM 1254 N GLU A 81 11.401 -11.707 -7.094 1.00 21.30 N ATOM 1255 CA GLU A 81 9.954 -11.525 -7.087 1.00 63.34 C ATOM 1256 C GLU A 81 9.292 -12.467 -6.086 1.00 30.10 C ATOM 1257 O GLU A 81 9.418 -13.688 -6.188 1.00 13.55 O ATOM 1258 CB GLU A 81 9.381 -11.765 -8.486 1.00 25.32 C ATOM 1259 CG GLU A 81 9.793 -10.712 -9.501 1.00 35.10 C ATOM 1260 CD GLU A 81 10.916 -11.181 -10.405 1.00 51.44 C ATOM 1261 OE1 GLU A 81 11.723 -12.023 -9.962 1.00 24.24 O ATOM 1262 OE2 GLU A 81 10.987 -10.704 -11.558 1.00 33.23 O ATOM 0 H GLU A 81 11.704 -12.680 -7.134 1.00 21.30 H new ATOM 0 HA GLU A 81 9.744 -10.498 -6.787 1.00 63.34 H new ATOM 0 HB2 GLU A 81 9.705 -12.744 -8.839 1.00 25.32 H new ATOM 0 HB3 GLU A 81 8.293 -11.792 -8.424 1.00 25.32 H new ATOM 0 HG2 GLU A 81 8.930 -10.442 -10.110 1.00 35.10 H new ATOM 0 HG3 GLU A 81 10.107 -9.810 -8.976 1.00 35.10 H new ATOM 1269 N VAL A 82 8.586 -11.891 -5.118 1.00 3.11 N ATOM 1270 CA VAL A 82 7.903 -12.677 -4.098 1.00 24.52 C ATOM 1271 C VAL A 82 6.451 -12.934 -4.482 1.00 54.55 C ATOM 1272 O VAL A 82 5.623 -12.022 -4.463 1.00 31.03 O ATOM 1273 CB VAL A 82 7.944 -11.976 -2.727 1.00 40.33 C ATOM 1274 CG1 VAL A 82 7.673 -12.971 -1.609 1.00 50.14 C ATOM 1275 CG2 VAL A 82 9.283 -11.284 -2.523 1.00 42.31 C ATOM 0 H VAL A 82 8.472 -10.882 -5.019 1.00 3.11 H new ATOM 0 HA VAL A 82 8.430 -13.628 -4.027 1.00 24.52 H new ATOM 0 HB VAL A 82 7.161 -11.218 -2.703 1.00 40.33 H new ATOM 0 HG11 VAL A 82 7.706 -12.457 -0.648 1.00 50.14 H new ATOM 0 HG12 VAL A 82 6.688 -13.416 -1.749 1.00 50.14 H new ATOM 0 HG13 VAL A 82 8.431 -13.754 -1.628 1.00 50.14 H new ATOM 0 HG21 VAL A 82 9.295 -10.794 -1.549 1.00 42.31 H new ATOM 0 HG22 VAL A 82 10.084 -12.022 -2.568 1.00 42.31 H new ATOM 0 HG23 VAL A 82 9.431 -10.540 -3.306 1.00 42.31 H new ATOM 1285 N ILE A 83 6.148 -14.179 -4.832 1.00 34.24 N ATOM 1286 CA ILE A 83 4.794 -14.556 -5.219 1.00 52.53 C ATOM 1287 C ILE A 83 3.941 -14.877 -3.997 1.00 21.14 C ATOM 1288 O ILE A 83 4.237 -15.808 -3.247 1.00 41.12 O ATOM 1289 CB ILE A 83 4.796 -15.772 -6.164 1.00 23.12 C ATOM 1290 CG1 ILE A 83 5.849 -15.592 -7.260 1.00 30.45 C ATOM 1291 CG2 ILE A 83 3.417 -15.971 -6.774 1.00 61.53 C ATOM 1292 CD1 ILE A 83 7.175 -16.244 -6.936 1.00 61.21 C ATOM 0 H ILE A 83 6.822 -14.944 -4.856 1.00 34.24 H new ATOM 0 HA ILE A 83 4.367 -13.701 -5.742 1.00 52.53 H new ATOM 0 HB ILE A 83 5.048 -16.662 -5.587 1.00 23.12 H new ATOM 0 HG12 ILE A 83 5.467 -16.008 -8.192 1.00 30.45 H new ATOM 0 HG13 ILE A 83 6.008 -14.527 -7.428 1.00 30.45 H new ATOM 0 HG21 ILE A 83 3.435 -16.834 -7.439 1.00 61.53 H new ATOM 0 HG22 ILE A 83 2.689 -16.139 -5.980 1.00 61.53 H new ATOM 0 HG23 ILE A 83 3.138 -15.082 -7.340 1.00 61.53 H new ATOM 0 HD11 ILE A 83 7.873 -16.076 -7.756 1.00 61.21 H new ATOM 0 HD12 ILE A 83 7.579 -15.811 -6.021 1.00 61.21 H new ATOM 0 HD13 ILE A 83 7.029 -17.315 -6.797 1.00 61.21 H new ATOM 1304 N VAL A 84 2.879 -14.101 -3.802 1.00 24.33 N ATOM 1305 CA VAL A 84 1.981 -14.305 -2.672 1.00 11.13 C ATOM 1306 C VAL A 84 0.566 -14.620 -3.144 1.00 41.22 C ATOM 1307 O VAL A 84 0.051 -13.982 -4.062 1.00 53.42 O ATOM 1308 CB VAL A 84 1.941 -13.067 -1.756 1.00 50.23 C ATOM 1309 CG1 VAL A 84 3.226 -12.957 -0.950 1.00 42.01 C ATOM 1310 CG2 VAL A 84 1.706 -11.807 -2.575 1.00 43.43 C ATOM 0 H VAL A 84 2.620 -13.326 -4.412 1.00 24.33 H new ATOM 0 HA VAL A 84 2.370 -15.153 -2.108 1.00 11.13 H new ATOM 0 HB VAL A 84 1.112 -13.179 -1.058 1.00 50.23 H new ATOM 0 HG11 VAL A 84 3.179 -12.077 -0.309 1.00 42.01 H new ATOM 0 HG12 VAL A 84 3.347 -13.848 -0.334 1.00 42.01 H new ATOM 0 HG13 VAL A 84 4.074 -12.867 -1.628 1.00 42.01 H new ATOM 0 HG21 VAL A 84 1.681 -10.942 -1.912 1.00 43.43 H new ATOM 0 HG22 VAL A 84 2.513 -11.687 -3.298 1.00 43.43 H new ATOM 0 HG23 VAL A 84 0.756 -11.888 -3.103 1.00 43.43 H new ATOM 1320 N ASP A 85 -0.057 -15.607 -2.511 1.00 30.31 N ATOM 1321 CA ASP A 85 -1.414 -16.007 -2.865 1.00 51.30 C ATOM 1322 C ASP A 85 -2.395 -15.640 -1.756 1.00 34.00 C ATOM 1323 O ASP A 85 -2.312 -16.160 -0.643 1.00 72.12 O ATOM 1324 CB ASP A 85 -1.471 -17.511 -3.137 1.00 55.31 C ATOM 1325 CG ASP A 85 -2.168 -17.836 -4.444 1.00 23.52 C ATOM 1326 OD1 ASP A 85 -3.321 -17.394 -4.628 1.00 40.25 O ATOM 1327 OD2 ASP A 85 -1.559 -18.533 -5.282 1.00 71.51 O ATOM 0 H ASP A 85 0.356 -16.145 -1.749 1.00 30.31 H new ATOM 0 HA ASP A 85 -1.700 -15.471 -3.770 1.00 51.30 H new ATOM 0 HB2 ASP A 85 -0.458 -17.912 -3.159 1.00 55.31 H new ATOM 0 HB3 ASP A 85 -1.992 -18.006 -2.318 1.00 55.31 H new ATOM 1332 N ARG A 86 -3.323 -14.741 -2.067 1.00 51.22 N ATOM 1333 CA ARG A 86 -4.319 -14.303 -1.096 1.00 44.23 C ATOM 1334 C ARG A 86 -3.663 -13.525 0.041 1.00 12.12 C ATOM 1335 O ARG A 86 -3.372 -14.065 1.109 1.00 74.14 O ATOM 1336 CB ARG A 86 -5.078 -15.506 -0.534 1.00 60.13 C ATOM 1337 CG ARG A 86 -6.520 -15.591 -1.006 1.00 53.53 C ATOM 1338 CD ARG A 86 -7.345 -14.422 -0.489 1.00 31.53 C ATOM 1339 NE ARG A 86 -8.743 -14.513 -0.903 1.00 64.20 N ATOM 1340 CZ ARG A 86 -9.163 -14.248 -2.135 1.00 3.10 C ATOM 1341 NH1 ARG A 86 -8.297 -13.878 -3.069 1.00 12.33 N ATOM 1342 NH2 ARG A 86 -10.451 -14.353 -2.435 1.00 61.12 N ATOM 0 H ARG A 86 -3.406 -14.302 -2.984 1.00 51.22 H new ATOM 0 HA ARG A 86 -5.022 -13.645 -1.606 1.00 44.23 H new ATOM 0 HB2 ARG A 86 -4.557 -16.420 -0.820 1.00 60.13 H new ATOM 0 HB3 ARG A 86 -5.063 -15.458 0.555 1.00 60.13 H new ATOM 0 HG2 ARG A 86 -6.547 -15.603 -2.096 1.00 53.53 H new ATOM 0 HG3 ARG A 86 -6.961 -16.528 -0.665 1.00 53.53 H new ATOM 0 HD2 ARG A 86 -7.290 -14.393 0.599 1.00 31.53 H new ATOM 0 HD3 ARG A 86 -6.919 -13.488 -0.855 1.00 31.53 H new ATOM 0 HE ARG A 86 -9.434 -14.795 -0.208 1.00 64.20 H new ATOM 0 HH11 ARG A 86 -7.306 -13.796 -2.842 1.00 12.33 H new ATOM 0 HH12 ARG A 86 -8.622 -13.675 -4.014 1.00 12.33 H new ATOM 0 HH21 ARG A 86 -11.120 -14.637 -1.719 1.00 61.12 H new ATOM 0 HH22 ARG A 86 -10.772 -14.149 -3.381 1.00 61.12 H new ATOM 1356 N PRO A 87 -3.424 -12.226 -0.191 1.00 12.31 N ATOM 1357 CA PRO A 87 -3.765 -11.572 -1.458 1.00 15.02 C ATOM 1358 C PRO A 87 -2.882 -12.041 -2.609 1.00 2.14 C ATOM 1359 O PRO A 87 -1.764 -12.513 -2.394 1.00 52.34 O ATOM 1360 CB PRO A 87 -3.524 -10.089 -1.168 1.00 5.51 C ATOM 1361 CG PRO A 87 -2.518 -10.076 -0.069 1.00 30.42 C ATOM 1362 CD PRO A 87 -2.802 -11.295 0.765 1.00 3.14 C ATOM 0 HA PRO A 87 -4.784 -11.798 -1.772 1.00 15.02 H new ATOM 0 HB2 PRO A 87 -3.153 -9.568 -2.051 1.00 5.51 H new ATOM 0 HB3 PRO A 87 -4.445 -9.590 -0.867 1.00 5.51 H new ATOM 0 HG2 PRO A 87 -1.504 -10.103 -0.468 1.00 30.42 H new ATOM 0 HG3 PRO A 87 -2.602 -9.167 0.527 1.00 30.42 H new ATOM 0 HD2 PRO A 87 -1.890 -11.710 1.194 1.00 3.14 H new ATOM 0 HD3 PRO A 87 -3.470 -11.067 1.596 1.00 3.14 H new ATOM 1370 N LEU A 88 -3.388 -11.908 -3.829 1.00 74.14 N ATOM 1371 CA LEU A 88 -2.644 -12.318 -5.015 1.00 73.03 C ATOM 1372 C LEU A 88 -1.881 -11.140 -5.613 1.00 71.53 C ATOM 1373 O LEU A 88 -2.480 -10.214 -6.160 1.00 22.44 O ATOM 1374 CB LEU A 88 -3.594 -12.908 -6.059 1.00 54.32 C ATOM 1375 CG LEU A 88 -2.943 -13.429 -7.341 1.00 14.31 C ATOM 1376 CD1 LEU A 88 -1.590 -14.052 -7.037 1.00 32.41 C ATOM 1377 CD2 LEU A 88 -3.854 -14.435 -8.030 1.00 44.34 C ATOM 0 H LEU A 88 -4.311 -11.519 -4.024 1.00 74.14 H new ATOM 0 HA LEU A 88 -1.924 -13.080 -4.717 1.00 73.03 H new ATOM 0 HB2 LEU A 88 -4.146 -13.727 -5.597 1.00 54.32 H new ATOM 0 HB3 LEU A 88 -4.323 -12.145 -6.330 1.00 54.32 H new ATOM 0 HG LEU A 88 -2.788 -12.587 -8.016 1.00 14.31 H new ATOM 0 HD11 LEU A 88 -1.142 -14.417 -7.961 1.00 32.41 H new ATOM 0 HD12 LEU A 88 -0.937 -13.303 -6.588 1.00 32.41 H new ATOM 0 HD13 LEU A 88 -1.720 -14.883 -6.344 1.00 32.41 H new ATOM 0 HD21 LEU A 88 -3.375 -14.795 -8.940 1.00 44.34 H new ATOM 0 HD22 LEU A 88 -4.040 -15.275 -7.361 1.00 44.34 H new ATOM 0 HD23 LEU A 88 -4.800 -13.956 -8.283 1.00 44.34 H new ATOM 1389 N GLN A 89 -0.557 -11.185 -5.507 1.00 50.13 N ATOM 1390 CA GLN A 89 0.288 -10.122 -6.039 1.00 55.03 C ATOM 1391 C GLN A 89 1.764 -10.484 -5.912 1.00 35.22 C ATOM 1392 O GLN A 89 2.109 -11.579 -5.467 1.00 14.12 O ATOM 1393 CB GLN A 89 0.008 -8.807 -5.310 1.00 42.41 C ATOM 1394 CG GLN A 89 -0.533 -7.712 -6.216 1.00 21.13 C ATOM 1395 CD GLN A 89 0.545 -6.752 -6.678 1.00 51.44 C ATOM 1396 OE1 GLN A 89 1.440 -7.124 -7.438 1.00 54.42 O ATOM 1397 NE2 GLN A 89 0.465 -5.507 -6.222 1.00 21.22 N ATOM 0 H GLN A 89 -0.046 -11.945 -5.058 1.00 50.13 H new ATOM 0 HA GLN A 89 0.053 -10.000 -7.096 1.00 55.03 H new ATOM 0 HB2 GLN A 89 -0.708 -8.991 -4.509 1.00 42.41 H new ATOM 0 HB3 GLN A 89 0.928 -8.458 -4.842 1.00 42.41 H new ATOM 0 HG2 GLN A 89 -1.007 -8.167 -7.086 1.00 21.13 H new ATOM 0 HG3 GLN A 89 -1.306 -7.156 -5.686 1.00 21.13 H new ATOM 0 HE21 GLN A 89 -0.294 -5.242 -5.594 1.00 21.22 H new ATOM 0 HE22 GLN A 89 1.162 -4.816 -6.500 1.00 21.22 H new ATOM 1406 N VAL A 90 2.631 -9.558 -6.306 1.00 4.42 N ATOM 1407 CA VAL A 90 4.071 -9.779 -6.235 1.00 12.21 C ATOM 1408 C VAL A 90 4.770 -8.623 -5.528 1.00 63.14 C ATOM 1409 O VAL A 90 4.292 -7.489 -5.548 1.00 44.43 O ATOM 1410 CB VAL A 90 4.682 -9.954 -7.638 1.00 14.40 C ATOM 1411 CG1 VAL A 90 6.127 -10.416 -7.537 1.00 61.24 C ATOM 1412 CG2 VAL A 90 3.856 -10.932 -8.460 1.00 0.02 C ATOM 0 H VAL A 90 2.362 -8.647 -6.678 1.00 4.42 H new ATOM 0 HA VAL A 90 4.223 -10.695 -5.664 1.00 12.21 H new ATOM 0 HB VAL A 90 4.670 -8.989 -8.144 1.00 14.40 H new ATOM 0 HG11 VAL A 90 6.542 -10.534 -8.538 1.00 61.24 H new ATOM 0 HG12 VAL A 90 6.708 -9.675 -6.988 1.00 61.24 H new ATOM 0 HG13 VAL A 90 6.168 -11.370 -7.012 1.00 61.24 H new ATOM 0 HG21 VAL A 90 4.302 -11.044 -9.448 1.00 0.02 H new ATOM 0 HG22 VAL A 90 3.835 -11.900 -7.960 1.00 0.02 H new ATOM 0 HG23 VAL A 90 2.839 -10.554 -8.562 1.00 0.02 H new ATOM 1422 N PHE A 91 5.906 -8.918 -4.905 1.00 32.55 N ATOM 1423 CA PHE A 91 6.672 -7.904 -4.191 1.00 2.23 C ATOM 1424 C PHE A 91 8.025 -7.675 -4.858 1.00 24.04 C ATOM 1425 O PHE A 91 8.826 -8.600 -4.996 1.00 64.12 O ATOM 1426 CB PHE A 91 6.874 -8.319 -2.732 1.00 33.02 C ATOM 1427 CG PHE A 91 5.588 -8.485 -1.973 1.00 3.23 C ATOM 1428 CD1 PHE A 91 4.619 -7.495 -2.002 1.00 31.25 C ATOM 1429 CD2 PHE A 91 5.349 -9.630 -1.231 1.00 22.31 C ATOM 1430 CE1 PHE A 91 3.436 -7.645 -1.303 1.00 53.02 C ATOM 1431 CE2 PHE A 91 4.168 -9.786 -0.531 1.00 15.11 C ATOM 1432 CZ PHE A 91 3.209 -8.792 -0.568 1.00 61.21 C ATOM 0 H PHE A 91 6.316 -9.851 -4.880 1.00 32.55 H new ATOM 0 HA PHE A 91 6.109 -6.971 -4.221 1.00 2.23 H new ATOM 0 HB2 PHE A 91 7.428 -9.257 -2.703 1.00 33.02 H new ATOM 0 HB3 PHE A 91 7.488 -7.571 -2.231 1.00 33.02 H new ATOM 0 HD1 PHE A 91 4.790 -6.597 -2.577 1.00 31.25 H new ATOM 0 HD2 PHE A 91 6.095 -10.410 -1.199 1.00 22.31 H new ATOM 0 HE1 PHE A 91 2.689 -6.865 -1.332 1.00 53.02 H new ATOM 0 HE2 PHE A 91 3.995 -10.684 0.044 1.00 15.11 H new ATOM 0 HZ PHE A 91 2.284 -8.912 -0.023 1.00 61.21 H new ATOM 1442 N HIS A 92 8.273 -6.436 -5.270 1.00 3.21 N ATOM 1443 CA HIS A 92 9.529 -6.084 -5.923 1.00 24.22 C ATOM 1444 C HIS A 92 10.682 -6.092 -4.923 1.00 40.22 C ATOM 1445 O HIS A 92 10.639 -5.402 -3.905 1.00 14.43 O ATOM 1446 CB HIS A 92 9.419 -4.709 -6.581 1.00 12.41 C ATOM 1447 CG HIS A 92 9.166 -4.769 -8.056 1.00 13.11 C ATOM 1448 ND1 HIS A 92 10.084 -4.350 -8.995 1.00 5.21 N ATOM 1449 CD2 HIS A 92 8.090 -5.204 -8.752 1.00 70.45 C ATOM 1450 CE1 HIS A 92 9.584 -4.523 -10.205 1.00 61.32 C ATOM 1451 NE2 HIS A 92 8.375 -5.041 -10.086 1.00 31.02 N ATOM 0 H HIS A 92 7.621 -5.659 -5.163 1.00 3.21 H new ATOM 0 HA HIS A 92 9.732 -6.830 -6.691 1.00 24.22 H new ATOM 0 HB2 HIS A 92 8.613 -4.151 -6.105 1.00 12.41 H new ATOM 0 HB3 HIS A 92 10.340 -4.155 -6.401 1.00 12.41 H new ATOM 0 HD2 HIS A 92 7.177 -5.605 -8.336 1.00 70.45 H new ATOM 0 HE1 HIS A 92 10.079 -4.282 -11.134 1.00 61.32 H new ATOM 0 HE2 HIS A 92 7.754 -5.281 -10.859 1.00 31.02 H new ATOM 1459 N VAL A 93 11.712 -6.878 -5.221 1.00 0.42 N ATOM 1460 CA VAL A 93 12.876 -6.975 -4.349 1.00 4.12 C ATOM 1461 C VAL A 93 14.171 -6.894 -5.150 1.00 1.03 C ATOM 1462 O VAL A 93 14.311 -7.539 -6.188 1.00 54.45 O ATOM 1463 CB VAL A 93 12.866 -8.287 -3.542 1.00 73.24 C ATOM 1464 CG1 VAL A 93 14.115 -8.395 -2.682 1.00 30.35 C ATOM 1465 CG2 VAL A 93 11.610 -8.377 -2.688 1.00 41.22 C ATOM 0 H VAL A 93 11.764 -7.456 -6.059 1.00 0.42 H new ATOM 0 HA VAL A 93 12.825 -6.133 -3.659 1.00 4.12 H new ATOM 0 HB VAL A 93 12.863 -9.123 -4.241 1.00 73.24 H new ATOM 0 HG11 VAL A 93 14.090 -9.328 -2.119 1.00 30.35 H new ATOM 0 HG12 VAL A 93 14.999 -8.380 -3.320 1.00 30.35 H new ATOM 0 HG13 VAL A 93 14.153 -7.555 -1.989 1.00 30.35 H new ATOM 0 HG21 VAL A 93 11.619 -9.310 -2.125 1.00 41.22 H new ATOM 0 HG22 VAL A 93 11.579 -7.535 -1.996 1.00 41.22 H new ATOM 0 HG23 VAL A 93 10.730 -8.350 -3.331 1.00 41.22 H new ATOM 1475 N GLU A 94 15.116 -6.098 -4.659 1.00 13.25 N ATOM 1476 CA GLU A 94 16.400 -5.933 -5.330 1.00 13.24 C ATOM 1477 C GLU A 94 17.548 -5.975 -4.325 1.00 71.04 C ATOM 1478 O GLU A 94 17.750 -5.035 -3.556 1.00 71.14 O ATOM 1479 CB GLU A 94 16.431 -4.612 -6.101 1.00 51.13 C ATOM 1480 CG GLU A 94 16.383 -4.787 -7.610 1.00 33.01 C ATOM 1481 CD GLU A 94 15.991 -3.513 -8.333 1.00 34.11 C ATOM 1482 OE1 GLU A 94 14.866 -3.022 -8.103 1.00 1.33 O ATOM 1483 OE2 GLU A 94 16.809 -3.008 -9.129 1.00 44.41 O ATOM 0 H GLU A 94 15.016 -5.558 -3.800 1.00 13.25 H new ATOM 0 HA GLU A 94 16.523 -6.758 -6.032 1.00 13.24 H new ATOM 0 HB2 GLU A 94 15.586 -3.998 -5.788 1.00 51.13 H new ATOM 0 HB3 GLU A 94 17.337 -4.067 -5.835 1.00 51.13 H new ATOM 0 HG2 GLU A 94 17.360 -5.116 -7.965 1.00 33.01 H new ATOM 0 HG3 GLU A 94 15.672 -5.575 -7.858 1.00 33.01 H new ATOM 1490 N VAL A 95 18.297 -7.073 -4.338 1.00 43.20 N ATOM 1491 CA VAL A 95 19.426 -7.239 -3.430 1.00 13.33 C ATOM 1492 C VAL A 95 20.748 -6.982 -4.143 1.00 61.14 C ATOM 1493 O VAL A 95 20.934 -7.387 -5.290 1.00 71.14 O ATOM 1494 CB VAL A 95 19.451 -8.652 -2.818 1.00 72.11 C ATOM 1495 CG1 VAL A 95 18.207 -8.892 -1.976 1.00 73.14 C ATOM 1496 CG2 VAL A 95 19.576 -9.703 -3.911 1.00 11.10 C ATOM 0 H VAL A 95 18.142 -7.861 -4.967 1.00 43.20 H new ATOM 0 HA VAL A 95 19.300 -6.508 -2.632 1.00 13.33 H new ATOM 0 HB VAL A 95 20.322 -8.732 -2.167 1.00 72.11 H new ATOM 0 HG11 VAL A 95 18.243 -9.896 -1.552 1.00 73.14 H new ATOM 0 HG12 VAL A 95 18.166 -8.159 -1.170 1.00 73.14 H new ATOM 0 HG13 VAL A 95 17.320 -8.794 -2.602 1.00 73.14 H new ATOM 0 HG21 VAL A 95 19.592 -10.696 -3.461 1.00 11.10 H new ATOM 0 HG22 VAL A 95 18.726 -9.626 -4.589 1.00 11.10 H new ATOM 0 HG23 VAL A 95 20.499 -9.542 -4.467 1.00 11.10 H new ATOM 1506 N GLU A 96 21.664 -6.307 -3.456 1.00 61.00 N ATOM 1507 CA GLU A 96 22.970 -5.996 -4.025 1.00 60.25 C ATOM 1508 C GLU A 96 24.083 -6.685 -3.241 1.00 44.32 C ATOM 1509 O GLU A 96 23.928 -6.990 -2.059 1.00 32.42 O ATOM 1510 CB GLU A 96 23.199 -4.483 -4.037 1.00 23.54 C ATOM 1511 CG GLU A 96 23.537 -3.909 -2.671 1.00 14.10 C ATOM 1512 CD GLU A 96 23.102 -2.464 -2.522 1.00 52.25 C ATOM 1513 OE1 GLU A 96 21.896 -2.228 -2.295 1.00 45.03 O ATOM 1514 OE2 GLU A 96 23.966 -1.569 -2.634 1.00 33.23 O ATOM 0 H GLU A 96 21.526 -5.965 -2.505 1.00 61.00 H new ATOM 0 HA GLU A 96 22.989 -6.366 -5.050 1.00 60.25 H new ATOM 0 HB2 GLU A 96 24.008 -4.252 -4.730 1.00 23.54 H new ATOM 0 HB3 GLU A 96 22.304 -3.991 -4.417 1.00 23.54 H new ATOM 0 HG2 GLU A 96 23.057 -4.511 -1.899 1.00 14.10 H new ATOM 0 HG3 GLU A 96 24.612 -3.980 -2.507 1.00 14.10 H new ATOM 1521 N VAL A 97 25.207 -6.926 -3.909 1.00 23.43 N ATOM 1522 CA VAL A 97 26.347 -7.578 -3.275 1.00 65.04 C ATOM 1523 C VAL A 97 27.219 -6.567 -2.540 1.00 4.24 C ATOM 1524 O VAL A 97 27.324 -5.410 -2.947 1.00 12.44 O ATOM 1525 CB VAL A 97 27.210 -8.328 -4.308 1.00 20.02 C ATOM 1526 CG1 VAL A 97 26.510 -9.598 -4.767 1.00 30.01 C ATOM 1527 CG2 VAL A 97 27.527 -7.427 -5.491 1.00 45.25 C ATOM 0 H VAL A 97 25.352 -6.680 -4.888 1.00 23.43 H new ATOM 0 HA VAL A 97 25.944 -8.295 -2.559 1.00 65.04 H new ATOM 0 HB VAL A 97 28.150 -8.611 -3.834 1.00 20.02 H new ATOM 0 HG11 VAL A 97 27.134 -10.114 -5.496 1.00 30.01 H new ATOM 0 HG12 VAL A 97 26.339 -10.249 -3.910 1.00 30.01 H new ATOM 0 HG13 VAL A 97 25.554 -9.342 -5.224 1.00 30.01 H new ATOM 0 HG21 VAL A 97 28.137 -7.973 -6.211 1.00 45.25 H new ATOM 0 HG22 VAL A 97 26.599 -7.112 -5.967 1.00 45.25 H new ATOM 0 HG23 VAL A 97 28.073 -6.550 -5.144 1.00 45.25 H new ATOM 1537 N ARG A 98 27.844 -7.012 -1.454 1.00 44.54 N ATOM 1538 CA ARG A 98 28.707 -6.145 -0.661 1.00 25.03 C ATOM 1539 C ARG A 98 29.971 -6.884 -0.229 1.00 34.13 C ATOM 1540 O ARG A 98 30.007 -7.501 0.836 1.00 24.00 O ATOM 1541 CB ARG A 98 27.958 -5.632 0.570 1.00 12.11 C ATOM 1542 CG ARG A 98 28.437 -4.272 1.052 1.00 75.12 C ATOM 1543 CD ARG A 98 28.891 -4.323 2.502 1.00 32.11 C ATOM 1544 NE ARG A 98 30.051 -5.192 2.682 1.00 11.31 N ATOM 1545 CZ ARG A 98 31.292 -4.834 2.371 1.00 31.25 C ATOM 1546 NH1 ARG A 98 31.533 -3.631 1.868 1.00 34.35 N ATOM 1547 NH2 ARG A 98 32.295 -5.681 2.564 1.00 5.44 N ATOM 0 H ARG A 98 27.769 -7.967 -1.104 1.00 44.54 H new ATOM 0 HA ARG A 98 28.996 -5.297 -1.281 1.00 25.03 H new ATOM 0 HB2 ARG A 98 26.894 -5.572 0.339 1.00 12.11 H new ATOM 0 HB3 ARG A 98 28.068 -6.354 1.379 1.00 12.11 H new ATOM 0 HG2 ARG A 98 29.260 -3.931 0.424 1.00 75.12 H new ATOM 0 HG3 ARG A 98 27.633 -3.544 0.947 1.00 75.12 H new ATOM 0 HD2 ARG A 98 29.136 -3.316 2.841 1.00 32.11 H new ATOM 0 HD3 ARG A 98 28.071 -4.679 3.126 1.00 32.11 H new ATOM 0 HE ARG A 98 29.900 -6.124 3.067 1.00 11.31 H new ATOM 0 HH11 ARG A 98 30.764 -2.977 1.719 1.00 34.35 H new ATOM 0 HH12 ARG A 98 32.487 -3.359 1.630 1.00 34.35 H new ATOM 0 HH21 ARG A 98 32.113 -6.607 2.951 1.00 5.44 H new ATOM 0 HH22 ARG A 98 33.248 -5.406 2.325 1.00 5.44 H new ATOM 1561 N ASP A 99 31.003 -6.817 -1.062 1.00 70.31 N ATOM 1562 CA ASP A 99 32.268 -7.479 -0.766 1.00 63.45 C ATOM 1563 C ASP A 99 33.230 -7.365 -1.945 1.00 52.03 C ATOM 1564 O ASP A 99 32.916 -6.736 -2.956 1.00 52.40 O ATOM 1565 CB ASP A 99 32.031 -8.952 -0.427 1.00 11.30 C ATOM 1566 CG ASP A 99 32.620 -9.339 0.915 1.00 4.31 C ATOM 1567 OD1 ASP A 99 33.824 -9.668 0.962 1.00 62.31 O ATOM 1568 OD2 ASP A 99 31.878 -9.311 1.919 1.00 61.23 O ATOM 0 H ASP A 99 30.989 -6.311 -1.948 1.00 70.31 H new ATOM 0 HA ASP A 99 32.716 -6.983 0.095 1.00 63.45 H new ATOM 0 HB2 ASP A 99 30.960 -9.153 -0.422 1.00 11.30 H new ATOM 0 HB3 ASP A 99 32.469 -9.576 -1.206 1.00 11.30 H new ATOM 1573 N ILE A 100 34.402 -7.976 -1.808 1.00 34.12 N ATOM 1574 CA ILE A 100 35.408 -7.943 -2.861 1.00 43.53 C ATOM 1575 C ILE A 100 35.323 -9.184 -3.743 1.00 3.13 C ATOM 1576 O ILE A 100 34.824 -10.225 -3.319 1.00 72.20 O ATOM 1577 CB ILE A 100 36.830 -7.837 -2.278 1.00 51.03 C ATOM 1578 CG1 ILE A 100 36.867 -6.802 -1.152 1.00 22.32 C ATOM 1579 CG2 ILE A 100 37.825 -7.475 -3.371 1.00 12.42 C ATOM 1580 CD1 ILE A 100 36.421 -5.423 -1.583 1.00 55.02 C ATOM 0 H ILE A 100 34.678 -8.500 -0.977 1.00 34.12 H new ATOM 0 HA ILE A 100 35.204 -7.058 -3.464 1.00 43.53 H new ATOM 0 HB ILE A 100 37.111 -8.806 -1.865 1.00 51.03 H new ATOM 0 HG12 ILE A 100 36.230 -7.142 -0.336 1.00 22.32 H new ATOM 0 HG13 ILE A 100 37.882 -6.740 -0.760 1.00 22.32 H new ATOM 0 HG21 ILE A 100 38.825 -7.404 -2.944 1.00 12.42 H new ATOM 0 HG22 ILE A 100 37.814 -8.245 -4.142 1.00 12.42 H new ATOM 0 HG23 ILE A 100 37.549 -6.517 -3.811 1.00 12.42 H new ATOM 0 HD11 ILE A 100 36.473 -4.742 -0.734 1.00 55.02 H new ATOM 0 HD12 ILE A 100 37.073 -5.062 -2.378 1.00 55.02 H new ATOM 0 HD13 ILE A 100 35.395 -5.470 -1.948 1.00 55.02 H new