USER MOD reduce.3.24.130724 H: found=0, std=0, add=913, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 911 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 105 GLN : amide:sc= -1.11 K(o=-1.1,f=-1.9) USER MOD Set 1.2: A 106 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: A 50 CYS SG : rot -170:sc= 0 USER MOD Set 2.2: A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 11 CYS SG : rot 180:sc= 0 USER MOD Single : A 13 ASN : amide:sc= -1.34 K(o=-1.3,f=-6.2!) USER MOD Single : A 14 HIS :FLIP no HD1:sc= -1.55 F(o=-3.5!,f=-1.6) USER MOD Single : A 16 ASN : amide:sc= -1.59! C(o=-1.6!,f=-1.1!) USER MOD Single : A 18 THR OG1 : rot 180:sc= -0.449 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 179:sc= 0.198 (180deg=0.197) USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 29 THR OG1 : rot 96:sc= 1.2 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 SER OG : rot -100:sc= 0 USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 56 CYS SG : rot 11:sc= 0.452 USER MOD Single : A 58 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 65 ASN : amide:sc= -5.98! C(o=-6!,f=-8.5!) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 GLN : amide:sc= 0 X(o=0,f=-0.3) USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 80 MET CE :methyl -163:sc= 0 (180deg=-0.448) USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 GLN : amide:sc= -0.393 X(o=-0.39,f=-0.39) USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 ASN :FLIP amide:sc= -2! C(o=-2.9!,f=-2!) USER MOD Single : A 98 MET CE :methyl 162:sc= -0.0498 (180deg=-0.43) USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 HIS :FLIP no HD1:sc= -0.319 F(o=-1.8!,f=-0.32) USER MOD Single : A 115 THR OG1 : rot -23:sc= 0.183! USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 6.585 -6.989 -33.485 1.00 0.00 N ATOM 2 CA GLY A 1 5.636 -7.545 -32.538 1.00 0.00 C ATOM 3 C GLY A 1 4.244 -6.970 -32.706 1.00 0.00 C ATOM 4 O GLY A 1 3.730 -6.886 -33.821 1.00 0.00 O ATOM 0 H1 GLY A 1 7.521 -7.414 -33.329 1.00 0.00 H new ATOM 0 H2 GLY A 1 6.269 -7.194 -34.454 1.00 0.00 H new ATOM 0 H3 GLY A 1 6.646 -5.959 -33.351 1.00 0.00 H new ATOM 0 HA2 GLY A 1 5.596 -8.627 -32.662 1.00 0.00 H new ATOM 0 HA3 GLY A 1 5.985 -7.353 -31.523 1.00 0.00 H new ATOM 8 N SER A 2 3.631 -6.574 -31.595 1.00 0.00 N ATOM 9 CA SER A 2 2.287 -6.009 -31.623 1.00 0.00 C ATOM 10 C SER A 2 2.251 -4.657 -30.918 1.00 0.00 C ATOM 11 O SER A 2 2.800 -4.499 -29.827 1.00 0.00 O ATOM 12 CB SER A 2 1.294 -6.968 -30.964 1.00 0.00 C ATOM 13 OG SER A 2 0.922 -8.007 -31.853 1.00 0.00 O ATOM 0 H SER A 2 4.044 -6.634 -30.664 1.00 0.00 H new ATOM 0 HA SER A 2 2.003 -5.863 -32.665 1.00 0.00 H new ATOM 0 HB2 SER A 2 1.738 -7.396 -30.065 1.00 0.00 H new ATOM 0 HB3 SER A 2 0.407 -6.418 -30.650 1.00 0.00 H new ATOM 0 HG SER A 2 0.288 -8.607 -31.408 1.00 0.00 H new ATOM 19 N SER A 3 1.601 -3.684 -31.548 1.00 0.00 N ATOM 20 CA SER A 3 1.495 -2.344 -30.984 1.00 0.00 C ATOM 21 C SER A 3 0.100 -1.769 -31.204 1.00 0.00 C ATOM 22 O SER A 3 -0.626 -2.199 -32.100 1.00 0.00 O ATOM 23 CB SER A 3 2.544 -1.421 -31.608 1.00 0.00 C ATOM 24 OG SER A 3 2.707 -0.242 -30.839 1.00 0.00 O ATOM 0 H SER A 3 1.139 -3.799 -32.450 1.00 0.00 H new ATOM 0 HA SER A 3 1.674 -2.414 -29.911 1.00 0.00 H new ATOM 0 HB2 SER A 3 3.497 -1.945 -31.682 1.00 0.00 H new ATOM 0 HB3 SER A 3 2.245 -1.159 -32.623 1.00 0.00 H new ATOM 0 HG SER A 3 3.384 0.330 -31.257 1.00 0.00 H new ATOM 30 N GLY A 4 -0.270 -0.794 -30.379 1.00 0.00 N ATOM 31 CA GLY A 4 -1.577 -0.176 -30.500 1.00 0.00 C ATOM 32 C GLY A 4 -2.654 -0.948 -29.764 1.00 0.00 C ATOM 33 O GLY A 4 -3.425 -1.687 -30.376 1.00 0.00 O ATOM 0 H GLY A 4 0.312 -0.421 -29.629 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -1.532 0.841 -30.110 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -1.844 -0.101 -31.554 1.00 0.00 H new ATOM 37 N SER A 5 -2.705 -0.780 -28.447 1.00 0.00 N ATOM 38 CA SER A 5 -3.692 -1.472 -27.626 1.00 0.00 C ATOM 39 C SER A 5 -3.992 -0.681 -26.356 1.00 0.00 C ATOM 40 O SER A 5 -3.094 -0.384 -25.569 1.00 0.00 O ATOM 41 CB SER A 5 -3.193 -2.872 -27.262 1.00 0.00 C ATOM 42 OG SER A 5 -4.137 -3.556 -26.456 1.00 0.00 O ATOM 0 H SER A 5 -2.075 -0.171 -27.925 1.00 0.00 H new ATOM 0 HA SER A 5 -4.612 -1.561 -28.204 1.00 0.00 H new ATOM 0 HB2 SER A 5 -3.005 -3.443 -28.172 1.00 0.00 H new ATOM 0 HB3 SER A 5 -2.244 -2.797 -26.731 1.00 0.00 H new ATOM 0 HG SER A 5 -3.796 -4.448 -26.238 1.00 0.00 H new ATOM 48 N SER A 6 -5.264 -0.343 -26.163 1.00 0.00 N ATOM 49 CA SER A 6 -5.684 0.416 -24.992 1.00 0.00 C ATOM 50 C SER A 6 -5.471 -0.392 -23.715 1.00 0.00 C ATOM 51 O SER A 6 -5.416 -1.621 -23.748 1.00 0.00 O ATOM 52 CB SER A 6 -7.155 0.816 -25.117 1.00 0.00 C ATOM 53 OG SER A 6 -7.382 1.563 -26.300 1.00 0.00 O ATOM 0 H SER A 6 -6.021 -0.583 -26.803 1.00 0.00 H new ATOM 0 HA SER A 6 -5.074 1.317 -24.937 1.00 0.00 H new ATOM 0 HB2 SER A 6 -7.779 -0.078 -25.122 1.00 0.00 H new ATOM 0 HB3 SER A 6 -7.450 1.405 -24.249 1.00 0.00 H new ATOM 0 HG SER A 6 -8.330 1.805 -26.357 1.00 0.00 H new ATOM 59 N GLY A 7 -5.353 0.308 -22.591 1.00 0.00 N ATOM 60 CA GLY A 7 -5.148 -0.360 -21.319 1.00 0.00 C ATOM 61 C GLY A 7 -3.680 -0.514 -20.975 1.00 0.00 C ATOM 62 O GLY A 7 -3.000 -1.393 -21.504 1.00 0.00 O ATOM 0 H GLY A 7 -5.396 1.326 -22.539 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -5.645 0.205 -20.531 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -5.616 -1.344 -21.349 1.00 0.00 H new ATOM 66 N MET A 8 -3.189 0.345 -20.087 1.00 0.00 N ATOM 67 CA MET A 8 -1.792 0.300 -19.673 1.00 0.00 C ATOM 68 C MET A 8 -1.604 -0.648 -18.494 1.00 0.00 C ATOM 69 O MET A 8 -2.460 -0.739 -17.614 1.00 0.00 O ATOM 70 CB MET A 8 -1.304 1.701 -19.299 1.00 0.00 C ATOM 71 CG MET A 8 -1.354 2.691 -20.452 1.00 0.00 C ATOM 72 SD MET A 8 -1.439 4.403 -19.894 1.00 0.00 S ATOM 73 CE MET A 8 -0.218 5.167 -20.959 1.00 0.00 C ATOM 0 H MET A 8 -3.738 1.080 -19.641 1.00 0.00 H new ATOM 0 HA MET A 8 -1.202 -0.071 -20.511 1.00 0.00 H new ATOM 0 HB2 MET A 8 -1.912 2.081 -18.478 1.00 0.00 H new ATOM 0 HB3 MET A 8 -0.280 1.634 -18.933 1.00 0.00 H new ATOM 0 HG2 MET A 8 -0.470 2.560 -21.077 1.00 0.00 H new ATOM 0 HG3 MET A 8 -2.221 2.473 -21.076 1.00 0.00 H new ATOM 0 HE1 MET A 8 -0.154 6.232 -20.734 1.00 0.00 H new ATOM 0 HE2 MET A 8 0.753 4.702 -20.791 1.00 0.00 H new ATOM 0 HE3 MET A 8 -0.509 5.033 -22.001 1.00 0.00 H new ATOM 83 N VAL A 9 -0.478 -1.355 -18.482 1.00 0.00 N ATOM 84 CA VAL A 9 -0.177 -2.296 -17.410 1.00 0.00 C ATOM 85 C VAL A 9 0.087 -1.568 -16.097 1.00 0.00 C ATOM 86 O VAL A 9 0.762 -0.539 -16.054 1.00 0.00 O ATOM 87 CB VAL A 9 1.044 -3.169 -17.756 1.00 0.00 C ATOM 88 CG1 VAL A 9 2.259 -2.299 -18.040 1.00 0.00 C ATOM 89 CG2 VAL A 9 1.333 -4.150 -16.630 1.00 0.00 C ATOM 0 H VAL A 9 0.241 -1.294 -19.203 1.00 0.00 H new ATOM 0 HA VAL A 9 -1.052 -2.937 -17.296 1.00 0.00 H new ATOM 0 HB VAL A 9 0.817 -3.740 -18.656 1.00 0.00 H new ATOM 0 HG11 VAL A 9 3.112 -2.933 -18.282 1.00 0.00 H new ATOM 0 HG12 VAL A 9 2.046 -1.640 -18.882 1.00 0.00 H new ATOM 0 HG13 VAL A 9 2.491 -1.700 -17.160 1.00 0.00 H new ATOM 0 HG21 VAL A 9 2.199 -4.759 -16.891 1.00 0.00 H new ATOM 0 HG22 VAL A 9 1.540 -3.600 -15.712 1.00 0.00 H new ATOM 0 HG23 VAL A 9 0.468 -4.795 -16.479 1.00 0.00 H new ATOM 99 N PRO A 10 -0.456 -2.113 -14.999 1.00 0.00 N ATOM 100 CA PRO A 10 -0.292 -1.532 -13.663 1.00 0.00 C ATOM 101 C PRO A 10 1.136 -1.668 -13.143 1.00 0.00 C ATOM 102 O PRO A 10 1.691 -2.767 -13.106 1.00 0.00 O ATOM 103 CB PRO A 10 -1.255 -2.350 -12.799 1.00 0.00 C ATOM 104 CG PRO A 10 -1.388 -3.653 -13.510 1.00 0.00 C ATOM 105 CD PRO A 10 -1.272 -3.338 -14.976 1.00 0.00 C ATOM 0 HA PRO A 10 -0.497 -0.461 -13.657 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -0.863 -2.487 -11.791 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -2.220 -1.852 -12.701 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -0.610 -4.349 -13.198 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -2.345 -4.124 -13.286 1.00 0.00 H new ATOM 0 HD2 PRO A 10 -0.794 -4.149 -15.525 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -2.249 -3.178 -15.431 1.00 0.00 H new ATOM 113 N CYS A 11 1.724 -0.546 -12.743 1.00 0.00 N ATOM 114 CA CYS A 11 3.088 -0.540 -12.226 1.00 0.00 C ATOM 115 C CYS A 11 3.159 0.191 -10.889 1.00 0.00 C ATOM 116 O CYS A 11 4.088 0.958 -10.639 1.00 0.00 O ATOM 117 CB CYS A 11 4.034 0.117 -13.231 1.00 0.00 C ATOM 118 SG CYS A 11 4.607 -0.991 -14.540 1.00 0.00 S ATOM 0 H CYS A 11 1.278 0.371 -12.767 1.00 0.00 H new ATOM 0 HA CYS A 11 3.396 -1.574 -12.071 1.00 0.00 H new ATOM 0 HB2 CYS A 11 3.528 0.969 -13.686 1.00 0.00 H new ATOM 0 HB3 CYS A 11 4.900 0.508 -12.697 1.00 0.00 H new ATOM 0 HG CYS A 11 5.400 -0.343 -15.341 1.00 0.00 H new ATOM 124 N TRP A 12 2.171 -0.051 -10.036 1.00 0.00 N ATOM 125 CA TRP A 12 2.120 0.586 -8.724 1.00 0.00 C ATOM 126 C TRP A 12 2.410 -0.422 -7.618 1.00 0.00 C ATOM 127 O TRP A 12 2.410 -0.078 -6.437 1.00 0.00 O ATOM 128 CB TRP A 12 0.751 1.229 -8.499 1.00 0.00 C ATOM 129 CG TRP A 12 -0.369 0.494 -9.171 1.00 0.00 C ATOM 130 CD1 TRP A 12 -1.081 0.904 -10.262 1.00 0.00 C ATOM 131 CD2 TRP A 12 -0.905 -0.780 -8.795 1.00 0.00 C ATOM 132 NE1 TRP A 12 -2.028 -0.037 -10.586 1.00 0.00 N ATOM 133 CE2 TRP A 12 -1.940 -1.080 -9.702 1.00 0.00 C ATOM 134 CE3 TRP A 12 -0.610 -1.696 -7.782 1.00 0.00 C ATOM 135 CZ2 TRP A 12 -2.680 -2.257 -9.624 1.00 0.00 C ATOM 136 CZ3 TRP A 12 -1.346 -2.863 -7.705 1.00 0.00 C ATOM 137 CH2 TRP A 12 -2.370 -3.136 -8.622 1.00 0.00 C ATOM 0 H TRP A 12 1.394 -0.683 -10.228 1.00 0.00 H new ATOM 0 HA TRP A 12 2.886 1.361 -8.694 1.00 0.00 H new ATOM 0 HB2 TRP A 12 0.553 1.278 -7.428 1.00 0.00 H new ATOM 0 HB3 TRP A 12 0.775 2.255 -8.867 1.00 0.00 H new ATOM 0 HD1 TRP A 12 -0.923 1.832 -10.792 1.00 0.00 H new ATOM 0 HE1 TRP A 12 -2.690 0.030 -11.359 1.00 0.00 H new ATOM 0 HE3 TRP A 12 0.179 -1.496 -7.072 1.00 0.00 H new ATOM 0 HZ2 TRP A 12 -3.470 -2.469 -10.329 1.00 0.00 H new ATOM 0 HZ3 TRP A 12 -1.128 -3.577 -6.925 1.00 0.00 H new ATOM 0 HH2 TRP A 12 -2.925 -4.058 -8.536 1.00 0.00 H new ATOM 148 N ASN A 13 2.657 -1.669 -8.008 1.00 0.00 N ATOM 149 CA ASN A 13 2.948 -2.727 -7.048 1.00 0.00 C ATOM 150 C ASN A 13 4.384 -3.219 -7.199 1.00 0.00 C ATOM 151 O ASN A 13 4.723 -3.888 -8.176 1.00 0.00 O ATOM 152 CB ASN A 13 1.975 -3.894 -7.233 1.00 0.00 C ATOM 153 CG ASN A 13 2.197 -4.998 -6.218 1.00 0.00 C ATOM 154 OD1 ASN A 13 3.190 -4.997 -5.491 1.00 0.00 O ATOM 155 ND2 ASN A 13 1.271 -5.949 -6.166 1.00 0.00 N ATOM 0 H ASN A 13 2.661 -1.971 -8.982 1.00 0.00 H new ATOM 0 HA ASN A 13 2.827 -2.317 -6.045 1.00 0.00 H new ATOM 0 HB2 ASN A 13 0.952 -3.527 -7.149 1.00 0.00 H new ATOM 0 HB3 ASN A 13 2.086 -4.301 -8.238 1.00 0.00 H new ATOM 0 HD21 ASN A 13 1.367 -6.719 -5.504 1.00 0.00 H new ATOM 0 HD22 ASN A 13 0.464 -5.909 -6.788 1.00 0.00 H new ATOM 162 N HIS A 14 5.224 -2.883 -6.226 1.00 0.00 N ATOM 163 CA HIS A 14 6.624 -3.291 -6.250 1.00 0.00 C ATOM 164 C HIS A 14 6.771 -4.754 -5.840 1.00 0.00 C ATOM 165 O HIS A 14 7.244 -5.582 -6.617 1.00 0.00 O ATOM 166 CB HIS A 14 7.452 -2.404 -5.319 1.00 0.00 C ATOM 167 CG HIS A 14 7.350 -0.944 -5.637 1.00 0.00 C ATOM 168 ND1 HIS A 14 6.294 -0.195 -6.033 1.00 0.00 N flip ATOM 169 CD2 HIS A 14 8.423 -0.081 -5.564 1.00 0.00 C flip ATOM 170 CE1 HIS A 14 6.743 1.093 -6.189 1.00 0.00 C flip ATOM 171 NE2 HIS A 14 8.031 1.135 -5.899 1.00 0.00 N flip ATOM 0 H HIS A 14 4.960 -2.329 -5.411 1.00 0.00 H new ATOM 0 HA HIS A 14 6.992 -3.178 -7.270 1.00 0.00 H new ATOM 0 HB2 HIS A 14 7.128 -2.567 -4.291 1.00 0.00 H new ATOM 0 HB3 HIS A 14 8.497 -2.708 -5.375 1.00 0.00 H new ATOM 0 HD2 HIS A 14 9.427 -0.356 -5.278 1.00 0.00 H new ATOM 0 HE1 HIS A 14 6.141 1.935 -6.498 1.00 0.00 H new ATOM 0 HE2 HIS A 14 8.622 1.965 -5.929 1.00 0.00 H new ATOM 180 N GLY A 15 6.362 -5.064 -4.614 1.00 0.00 N ATOM 181 CA GLY A 15 6.457 -6.426 -4.122 1.00 0.00 C ATOM 182 C GLY A 15 7.866 -6.795 -3.704 1.00 0.00 C ATOM 183 O GLY A 15 8.839 -6.310 -4.281 1.00 0.00 O ATOM 0 H GLY A 15 5.966 -4.396 -3.952 1.00 0.00 H new ATOM 0 HA2 GLY A 15 5.785 -6.550 -3.273 1.00 0.00 H new ATOM 0 HA3 GLY A 15 6.120 -7.113 -4.898 1.00 0.00 H new ATOM 187 N ASN A 16 7.977 -7.653 -2.695 1.00 0.00 N ATOM 188 CA ASN A 16 9.278 -8.084 -2.198 1.00 0.00 C ATOM 189 C ASN A 16 10.213 -6.892 -2.015 1.00 0.00 C ATOM 190 O ASN A 16 11.325 -6.876 -2.545 1.00 0.00 O ATOM 191 CB ASN A 16 9.905 -9.096 -3.160 1.00 0.00 C ATOM 192 CG ASN A 16 11.328 -9.453 -2.776 1.00 0.00 C ATOM 193 OD1 ASN A 16 11.563 -10.107 -1.759 1.00 0.00 O ATOM 194 ND2 ASN A 16 12.286 -9.025 -3.590 1.00 0.00 N ATOM 0 H ASN A 16 7.182 -8.063 -2.206 1.00 0.00 H new ATOM 0 HA ASN A 16 9.130 -8.559 -1.228 1.00 0.00 H new ATOM 0 HB2 ASN A 16 9.298 -10.001 -3.177 1.00 0.00 H new ATOM 0 HB3 ASN A 16 9.896 -8.687 -4.170 1.00 0.00 H new ATOM 0 HD21 ASN A 16 13.262 -9.235 -3.383 1.00 0.00 H new ATOM 0 HD22 ASN A 16 12.045 -8.486 -4.422 1.00 0.00 H new ATOM 201 N ILE A 17 9.754 -5.898 -1.263 1.00 0.00 N ATOM 202 CA ILE A 17 10.550 -4.703 -1.009 1.00 0.00 C ATOM 203 C ILE A 17 10.605 -4.386 0.482 1.00 0.00 C ATOM 204 O ILE A 17 9.680 -4.702 1.230 1.00 0.00 O ATOM 205 CB ILE A 17 9.989 -3.483 -1.762 1.00 0.00 C ATOM 206 CG1 ILE A 17 8.573 -3.164 -1.277 1.00 0.00 C ATOM 207 CG2 ILE A 17 9.997 -3.736 -3.262 1.00 0.00 C ATOM 208 CD1 ILE A 17 8.094 -1.786 -1.675 1.00 0.00 C ATOM 0 H ILE A 17 8.836 -5.896 -0.819 1.00 0.00 H new ATOM 0 HA ILE A 17 11.557 -4.911 -1.371 1.00 0.00 H new ATOM 0 HB ILE A 17 10.626 -2.623 -1.556 1.00 0.00 H new ATOM 0 HG12 ILE A 17 7.884 -3.909 -1.677 1.00 0.00 H new ATOM 0 HG13 ILE A 17 8.541 -3.251 -0.191 1.00 0.00 H new ATOM 0 HG21 ILE A 17 9.597 -2.864 -3.780 1.00 0.00 H new ATOM 0 HG22 ILE A 17 11.019 -3.919 -3.595 1.00 0.00 H new ATOM 0 HG23 ILE A 17 9.381 -4.606 -3.487 1.00 0.00 H new ATOM 0 HD11 ILE A 17 7.084 -1.629 -1.298 1.00 0.00 H new ATOM 0 HD12 ILE A 17 8.760 -1.033 -1.253 1.00 0.00 H new ATOM 0 HD13 ILE A 17 8.093 -1.701 -2.762 1.00 0.00 H new ATOM 220 N THR A 18 11.696 -3.757 0.907 1.00 0.00 N ATOM 221 CA THR A 18 11.873 -3.395 2.308 1.00 0.00 C ATOM 222 C THR A 18 10.916 -2.279 2.713 1.00 0.00 C ATOM 223 O THR A 18 10.352 -1.593 1.860 1.00 0.00 O ATOM 224 CB THR A 18 13.318 -2.947 2.595 1.00 0.00 C ATOM 225 OG1 THR A 18 13.347 -2.094 3.744 1.00 0.00 O ATOM 226 CG2 THR A 18 13.905 -2.214 1.398 1.00 0.00 C ATOM 0 H THR A 18 12.471 -3.488 0.301 1.00 0.00 H new ATOM 0 HA THR A 18 11.655 -4.287 2.895 1.00 0.00 H new ATOM 0 HB THR A 18 13.919 -3.836 2.787 1.00 0.00 H new ATOM 0 HG1 THR A 18 14.270 -1.815 3.921 1.00 0.00 H new ATOM 0 HG21 THR A 18 14.926 -1.907 1.624 1.00 0.00 H new ATOM 0 HG22 THR A 18 13.908 -2.876 0.532 1.00 0.00 H new ATOM 0 HG23 THR A 18 13.302 -1.333 1.179 1.00 0.00 H new ATOM 234 N ARG A 19 10.740 -2.102 4.018 1.00 0.00 N ATOM 235 CA ARG A 19 9.851 -1.068 4.535 1.00 0.00 C ATOM 236 C ARG A 19 10.397 0.323 4.227 1.00 0.00 C ATOM 237 O ARG A 19 9.716 1.147 3.618 1.00 0.00 O ATOM 238 CB ARG A 19 9.666 -1.233 6.045 1.00 0.00 C ATOM 239 CG ARG A 19 8.480 -0.463 6.601 1.00 0.00 C ATOM 240 CD ARG A 19 8.232 -0.801 8.062 1.00 0.00 C ATOM 241 NE ARG A 19 6.828 -0.641 8.431 1.00 0.00 N ATOM 242 CZ ARG A 19 6.370 -0.798 9.668 1.00 0.00 C ATOM 243 NH1 ARG A 19 7.201 -1.118 10.650 1.00 0.00 N ATOM 244 NH2 ARG A 19 5.078 -0.636 9.924 1.00 0.00 N ATOM 0 H ARG A 19 11.201 -2.661 4.736 1.00 0.00 H new ATOM 0 HA ARG A 19 8.884 -1.176 4.043 1.00 0.00 H new ATOM 0 HB2 ARG A 19 9.541 -2.291 6.274 1.00 0.00 H new ATOM 0 HB3 ARG A 19 10.573 -0.903 6.552 1.00 0.00 H new ATOM 0 HG2 ARG A 19 8.660 0.607 6.500 1.00 0.00 H new ATOM 0 HG3 ARG A 19 7.589 -0.693 6.017 1.00 0.00 H new ATOM 0 HD2 ARG A 19 8.542 -1.828 8.254 1.00 0.00 H new ATOM 0 HD3 ARG A 19 8.848 -0.159 8.692 1.00 0.00 H new ATOM 0 HE ARG A 19 6.162 -0.395 7.698 1.00 0.00 H new ATOM 0 HH11 ARG A 19 8.195 -1.244 10.457 1.00 0.00 H new ATOM 0 HH12 ARG A 19 6.847 -1.238 11.599 1.00 0.00 H new ATOM 0 HH21 ARG A 19 4.436 -0.391 9.171 1.00 0.00 H new ATOM 0 HH22 ARG A 19 4.727 -0.757 10.874 1.00 0.00 H new ATOM 258 N SER A 20 11.631 0.576 4.653 1.00 0.00 N ATOM 259 CA SER A 20 12.267 1.868 4.427 1.00 0.00 C ATOM 260 C SER A 20 12.121 2.299 2.971 1.00 0.00 C ATOM 261 O SER A 20 12.051 3.490 2.667 1.00 0.00 O ATOM 262 CB SER A 20 13.749 1.804 4.805 1.00 0.00 C ATOM 263 OG SER A 20 14.230 3.077 5.199 1.00 0.00 O ATOM 0 H SER A 20 12.209 -0.097 5.156 1.00 0.00 H new ATOM 0 HA SER A 20 11.769 2.605 5.058 1.00 0.00 H new ATOM 0 HB2 SER A 20 13.890 1.091 5.617 1.00 0.00 H new ATOM 0 HB3 SER A 20 14.328 1.439 3.957 1.00 0.00 H new ATOM 0 HG SER A 20 15.178 3.009 5.437 1.00 0.00 H new ATOM 269 N LYS A 21 12.074 1.320 2.073 1.00 0.00 N ATOM 270 CA LYS A 21 11.934 1.595 0.648 1.00 0.00 C ATOM 271 C LYS A 21 10.543 2.135 0.332 1.00 0.00 C ATOM 272 O LYS A 21 10.401 3.143 -0.360 1.00 0.00 O ATOM 273 CB LYS A 21 12.197 0.326 -0.165 1.00 0.00 C ATOM 274 CG LYS A 21 11.840 0.460 -1.635 1.00 0.00 C ATOM 275 CD LYS A 21 12.709 1.498 -2.327 1.00 0.00 C ATOM 276 CE LYS A 21 13.983 0.878 -2.879 1.00 0.00 C ATOM 277 NZ LYS A 21 14.690 1.801 -3.811 1.00 0.00 N ATOM 0 H LYS A 21 12.131 0.329 2.307 1.00 0.00 H new ATOM 0 HA LYS A 21 12.669 2.353 0.376 1.00 0.00 H new ATOM 0 HB2 LYS A 21 13.251 0.061 -0.078 1.00 0.00 H new ATOM 0 HB3 LYS A 21 11.625 -0.496 0.266 1.00 0.00 H new ATOM 0 HG2 LYS A 21 11.960 -0.504 -2.129 1.00 0.00 H new ATOM 0 HG3 LYS A 21 10.791 0.739 -1.732 1.00 0.00 H new ATOM 0 HD2 LYS A 21 12.148 1.962 -3.138 1.00 0.00 H new ATOM 0 HD3 LYS A 21 12.964 2.289 -1.622 1.00 0.00 H new ATOM 0 HE2 LYS A 21 14.646 0.616 -2.055 1.00 0.00 H new ATOM 0 HE3 LYS A 21 13.740 -0.048 -3.400 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 15.562 1.349 -4.153 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 14.073 2.018 -4.619 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 14.929 2.682 -3.312 1.00 0.00 H new ATOM 291 N ALA A 22 9.520 1.459 0.844 1.00 0.00 N ATOM 292 CA ALA A 22 8.141 1.873 0.619 1.00 0.00 C ATOM 293 C ALA A 22 7.906 3.295 1.118 1.00 0.00 C ATOM 294 O ALA A 22 6.947 3.953 0.716 1.00 0.00 O ATOM 295 CB ALA A 22 7.182 0.908 1.301 1.00 0.00 C ATOM 0 H ALA A 22 9.621 0.622 1.418 1.00 0.00 H new ATOM 0 HA ALA A 22 7.954 1.857 -0.455 1.00 0.00 H new ATOM 0 HB1 ALA A 22 6.156 1.230 1.125 1.00 0.00 H new ATOM 0 HB2 ALA A 22 7.323 -0.094 0.895 1.00 0.00 H new ATOM 0 HB3 ALA A 22 7.379 0.896 2.373 1.00 0.00 H new ATOM 301 N GLU A 23 8.789 3.762 1.996 1.00 0.00 N ATOM 302 CA GLU A 23 8.675 5.106 2.551 1.00 0.00 C ATOM 303 C GLU A 23 9.517 6.097 1.751 1.00 0.00 C ATOM 304 O GLU A 23 8.999 7.080 1.222 1.00 0.00 O ATOM 305 CB GLU A 23 9.112 5.116 4.017 1.00 0.00 C ATOM 306 CG GLU A 23 8.266 4.225 4.910 1.00 0.00 C ATOM 307 CD GLU A 23 8.494 4.492 6.385 1.00 0.00 C ATOM 308 OE1 GLU A 23 8.459 5.673 6.787 1.00 0.00 O ATOM 309 OE2 GLU A 23 8.707 3.518 7.138 1.00 0.00 O ATOM 0 H GLU A 23 9.590 3.230 2.338 1.00 0.00 H new ATOM 0 HA GLU A 23 7.630 5.410 2.490 1.00 0.00 H new ATOM 0 HB2 GLU A 23 10.152 4.796 4.080 1.00 0.00 H new ATOM 0 HB3 GLU A 23 9.070 6.138 4.393 1.00 0.00 H new ATOM 0 HG2 GLU A 23 7.212 4.378 4.676 1.00 0.00 H new ATOM 0 HG3 GLU A 23 8.493 3.181 4.694 1.00 0.00 H new ATOM 316 N GLU A 24 10.816 5.830 1.670 1.00 0.00 N ATOM 317 CA GLU A 24 11.730 6.699 0.937 1.00 0.00 C ATOM 318 C GLU A 24 11.167 7.043 -0.439 1.00 0.00 C ATOM 319 O GLU A 24 11.337 8.159 -0.931 1.00 0.00 O ATOM 320 CB GLU A 24 13.097 6.029 0.788 1.00 0.00 C ATOM 321 CG GLU A 24 13.197 5.111 -0.419 1.00 0.00 C ATOM 322 CD GLU A 24 14.542 4.417 -0.514 1.00 0.00 C ATOM 323 OE1 GLU A 24 15.200 4.253 0.535 1.00 0.00 O ATOM 324 OE2 GLU A 24 14.936 4.037 -1.637 1.00 0.00 O ATOM 0 H GLU A 24 11.260 5.020 2.102 1.00 0.00 H new ATOM 0 HA GLU A 24 11.846 7.622 1.504 1.00 0.00 H new ATOM 0 HB2 GLU A 24 13.864 6.800 0.712 1.00 0.00 H new ATOM 0 HB3 GLU A 24 13.311 5.455 1.689 1.00 0.00 H new ATOM 0 HG2 GLU A 24 12.408 4.361 -0.367 1.00 0.00 H new ATOM 0 HG3 GLU A 24 13.026 5.690 -1.326 1.00 0.00 H new ATOM 331 N LEU A 25 10.496 6.076 -1.056 1.00 0.00 N ATOM 332 CA LEU A 25 9.907 6.274 -2.376 1.00 0.00 C ATOM 333 C LEU A 25 8.860 7.383 -2.344 1.00 0.00 C ATOM 334 O LEU A 25 8.780 8.202 -3.260 1.00 0.00 O ATOM 335 CB LEU A 25 9.275 4.974 -2.875 1.00 0.00 C ATOM 336 CG LEU A 25 10.246 3.841 -3.211 1.00 0.00 C ATOM 337 CD1 LEU A 25 9.501 2.523 -3.347 1.00 0.00 C ATOM 338 CD2 LEU A 25 11.013 4.158 -4.486 1.00 0.00 C ATOM 0 H LEU A 25 10.346 5.147 -0.663 1.00 0.00 H new ATOM 0 HA LEU A 25 10.702 6.570 -3.061 1.00 0.00 H new ATOM 0 HB2 LEU A 25 8.580 4.616 -2.115 1.00 0.00 H new ATOM 0 HB3 LEU A 25 8.687 5.198 -3.765 1.00 0.00 H new ATOM 0 HG LEU A 25 10.962 3.746 -2.395 1.00 0.00 H new ATOM 0 HD11 LEU A 25 10.208 1.728 -3.586 1.00 0.00 H new ATOM 0 HD12 LEU A 25 8.998 2.291 -2.408 1.00 0.00 H new ATOM 0 HD13 LEU A 25 8.762 2.603 -4.144 1.00 0.00 H new ATOM 0 HD21 LEU A 25 11.699 3.341 -4.710 1.00 0.00 H new ATOM 0 HD22 LEU A 25 10.312 4.280 -5.312 1.00 0.00 H new ATOM 0 HD23 LEU A 25 11.578 5.080 -4.351 1.00 0.00 H new ATOM 350 N LEU A 26 8.060 7.403 -1.283 1.00 0.00 N ATOM 351 CA LEU A 26 7.018 8.413 -1.130 1.00 0.00 C ATOM 352 C LEU A 26 7.608 9.735 -0.649 1.00 0.00 C ATOM 353 O LEU A 26 7.351 10.789 -1.230 1.00 0.00 O ATOM 354 CB LEU A 26 5.952 7.929 -0.146 1.00 0.00 C ATOM 355 CG LEU A 26 5.250 6.619 -0.508 1.00 0.00 C ATOM 356 CD1 LEU A 26 4.376 6.146 0.643 1.00 0.00 C ATOM 357 CD2 LEU A 26 4.422 6.790 -1.773 1.00 0.00 C ATOM 0 H LEU A 26 8.113 6.732 -0.517 1.00 0.00 H new ATOM 0 HA LEU A 26 6.557 8.575 -2.104 1.00 0.00 H new ATOM 0 HB2 LEU A 26 6.417 7.811 0.833 1.00 0.00 H new ATOM 0 HB3 LEU A 26 5.196 8.708 -0.048 1.00 0.00 H new ATOM 0 HG LEU A 26 6.011 5.861 -0.695 1.00 0.00 H new ATOM 0 HD11 LEU A 26 3.885 5.213 0.367 1.00 0.00 H new ATOM 0 HD12 LEU A 26 4.994 5.983 1.526 1.00 0.00 H new ATOM 0 HD13 LEU A 26 3.622 6.902 0.862 1.00 0.00 H new ATOM 0 HD21 LEU A 26 3.930 5.848 -2.016 1.00 0.00 H new ATOM 0 HD22 LEU A 26 3.670 7.562 -1.614 1.00 0.00 H new ATOM 0 HD23 LEU A 26 5.073 7.082 -2.597 1.00 0.00 H new ATOM 369 N SER A 27 8.401 9.671 0.416 1.00 0.00 N ATOM 370 CA SER A 27 9.026 10.863 0.976 1.00 0.00 C ATOM 371 C SER A 27 9.622 11.734 -0.126 1.00 0.00 C ATOM 372 O SER A 27 9.289 12.913 -0.248 1.00 0.00 O ATOM 373 CB SER A 27 10.116 10.471 1.976 1.00 0.00 C ATOM 374 OG SER A 27 10.798 11.614 2.461 1.00 0.00 O ATOM 0 H SER A 27 8.626 8.806 0.908 1.00 0.00 H new ATOM 0 HA SER A 27 8.257 11.437 1.493 1.00 0.00 H new ATOM 0 HB2 SER A 27 9.671 9.928 2.810 1.00 0.00 H new ATOM 0 HB3 SER A 27 10.826 9.795 1.499 1.00 0.00 H new ATOM 0 HG SER A 27 11.488 11.337 3.099 1.00 0.00 H new ATOM 380 N ARG A 28 10.503 11.144 -0.926 1.00 0.00 N ATOM 381 CA ARG A 28 11.146 11.865 -2.018 1.00 0.00 C ATOM 382 C ARG A 28 10.107 12.452 -2.969 1.00 0.00 C ATOM 383 O ARG A 28 10.207 13.609 -3.378 1.00 0.00 O ATOM 384 CB ARG A 28 12.088 10.936 -2.786 1.00 0.00 C ATOM 385 CG ARG A 28 11.368 9.959 -3.702 1.00 0.00 C ATOM 386 CD ARG A 28 12.326 8.933 -4.286 1.00 0.00 C ATOM 387 NE ARG A 28 12.889 9.373 -5.560 1.00 0.00 N ATOM 388 CZ ARG A 28 13.957 10.156 -5.660 1.00 0.00 C ATOM 389 NH1 ARG A 28 14.576 10.582 -4.567 1.00 0.00 N ATOM 390 NH2 ARG A 28 14.410 10.513 -6.855 1.00 0.00 N ATOM 0 H ARG A 28 10.788 10.169 -0.839 1.00 0.00 H new ATOM 0 HA ARG A 28 11.724 12.683 -1.589 1.00 0.00 H new ATOM 0 HB2 ARG A 28 12.775 11.539 -3.380 1.00 0.00 H new ATOM 0 HB3 ARG A 28 12.692 10.375 -2.073 1.00 0.00 H new ATOM 0 HG2 ARG A 28 10.582 9.449 -3.145 1.00 0.00 H new ATOM 0 HG3 ARG A 28 10.883 10.506 -4.510 1.00 0.00 H new ATOM 0 HD2 ARG A 28 13.133 8.747 -3.578 1.00 0.00 H new ATOM 0 HD3 ARG A 28 11.802 7.988 -4.428 1.00 0.00 H new ATOM 0 HE ARG A 28 12.437 9.062 -6.420 1.00 0.00 H new ATOM 0 HH11 ARG A 28 14.232 10.308 -3.647 1.00 0.00 H new ATOM 0 HH12 ARG A 28 15.396 11.183 -4.647 1.00 0.00 H new ATOM 0 HH21 ARG A 28 13.938 10.186 -7.698 1.00 0.00 H new ATOM 0 HH22 ARG A 28 15.230 11.114 -6.931 1.00 0.00 H new ATOM 404 N THR A 29 9.109 11.646 -3.317 1.00 0.00 N ATOM 405 CA THR A 29 8.052 12.084 -4.220 1.00 0.00 C ATOM 406 C THR A 29 7.465 13.418 -3.773 1.00 0.00 C ATOM 407 O THR A 29 7.283 14.329 -4.580 1.00 0.00 O ATOM 408 CB THR A 29 6.921 11.042 -4.309 1.00 0.00 C ATOM 409 OG1 THR A 29 7.445 9.787 -4.755 1.00 0.00 O ATOM 410 CG2 THR A 29 5.829 11.509 -5.260 1.00 0.00 C ATOM 0 H THR A 29 9.011 10.686 -2.987 1.00 0.00 H new ATOM 0 HA THR A 29 8.506 12.201 -5.204 1.00 0.00 H new ATOM 0 HB THR A 29 6.489 10.922 -3.316 1.00 0.00 H new ATOM 0 HG1 THR A 29 7.632 9.217 -3.980 1.00 0.00 H new ATOM 0 HG21 THR A 29 5.041 10.757 -5.307 1.00 0.00 H new ATOM 0 HG22 THR A 29 5.412 12.450 -4.901 1.00 0.00 H new ATOM 0 HG23 THR A 29 6.251 11.655 -6.255 1.00 0.00 H new ATOM 418 N GLY A 30 7.171 13.527 -2.481 1.00 0.00 N ATOM 419 CA GLY A 30 6.608 14.755 -1.949 1.00 0.00 C ATOM 420 C GLY A 30 5.368 15.197 -2.701 1.00 0.00 C ATOM 421 O GLY A 30 5.302 16.320 -3.199 1.00 0.00 O ATOM 0 H GLY A 30 7.312 12.787 -1.793 1.00 0.00 H new ATOM 0 HA2 GLY A 30 6.360 14.612 -0.897 1.00 0.00 H new ATOM 0 HA3 GLY A 30 7.358 15.545 -1.995 1.00 0.00 H new ATOM 425 N LYS A 31 4.382 14.311 -2.784 1.00 0.00 N ATOM 426 CA LYS A 31 3.137 14.614 -3.480 1.00 0.00 C ATOM 427 C LYS A 31 1.932 14.148 -2.669 1.00 0.00 C ATOM 428 O LYS A 31 2.036 13.224 -1.861 1.00 0.00 O ATOM 429 CB LYS A 31 3.125 13.950 -4.859 1.00 0.00 C ATOM 430 CG LYS A 31 3.846 14.753 -5.927 1.00 0.00 C ATOM 431 CD LYS A 31 3.564 14.210 -7.318 1.00 0.00 C ATOM 432 CE LYS A 31 4.107 15.134 -8.398 1.00 0.00 C ATOM 433 NZ LYS A 31 5.509 14.792 -8.767 1.00 0.00 N ATOM 0 H LYS A 31 4.421 13.376 -2.378 1.00 0.00 H new ATOM 0 HA LYS A 31 3.073 15.695 -3.603 1.00 0.00 H new ATOM 0 HB2 LYS A 31 3.587 12.966 -4.783 1.00 0.00 H new ATOM 0 HB3 LYS A 31 2.092 13.794 -5.169 1.00 0.00 H new ATOM 0 HG2 LYS A 31 3.534 15.796 -5.872 1.00 0.00 H new ATOM 0 HG3 LYS A 31 4.919 14.731 -5.738 1.00 0.00 H new ATOM 0 HD2 LYS A 31 4.014 13.223 -7.422 1.00 0.00 H new ATOM 0 HD3 LYS A 31 2.489 14.086 -7.450 1.00 0.00 H new ATOM 0 HE2 LYS A 31 3.473 15.071 -9.282 1.00 0.00 H new ATOM 0 HE3 LYS A 31 4.065 16.166 -8.048 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 5.843 15.444 -9.505 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 6.119 14.877 -7.929 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 5.546 13.816 -9.125 1.00 0.00 H new ATOM 447 N ASP A 32 0.791 14.791 -2.890 1.00 0.00 N ATOM 448 CA ASP A 32 -0.434 14.440 -2.181 1.00 0.00 C ATOM 449 C ASP A 32 -1.308 13.522 -3.029 1.00 0.00 C ATOM 450 O ASP A 32 -1.882 13.945 -4.032 1.00 0.00 O ATOM 451 CB ASP A 32 -1.212 15.703 -1.807 1.00 0.00 C ATOM 452 CG ASP A 32 -0.435 16.605 -0.868 1.00 0.00 C ATOM 453 OD1 ASP A 32 0.707 16.975 -1.211 1.00 0.00 O ATOM 454 OD2 ASP A 32 -0.969 16.940 0.210 1.00 0.00 O ATOM 0 H ASP A 32 0.689 15.558 -3.554 1.00 0.00 H new ATOM 0 HA ASP A 32 -0.158 13.910 -1.270 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -1.460 16.255 -2.714 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -2.154 15.420 -1.338 1.00 0.00 H new ATOM 459 N GLY A 33 -1.405 12.260 -2.619 1.00 0.00 N ATOM 460 CA GLY A 33 -2.210 11.301 -3.353 1.00 0.00 C ATOM 461 C GLY A 33 -1.386 10.154 -3.904 1.00 0.00 C ATOM 462 O GLY A 33 -1.827 9.442 -4.806 1.00 0.00 O ATOM 0 H GLY A 33 -0.940 11.885 -1.792 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -2.986 10.905 -2.697 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -2.715 11.809 -4.174 1.00 0.00 H new ATOM 466 N SER A 34 -0.186 9.975 -3.361 1.00 0.00 N ATOM 467 CA SER A 34 0.704 8.910 -3.807 1.00 0.00 C ATOM 468 C SER A 34 0.423 7.615 -3.051 1.00 0.00 C ATOM 469 O SER A 34 -0.010 7.637 -1.898 1.00 0.00 O ATOM 470 CB SER A 34 2.164 9.321 -3.613 1.00 0.00 C ATOM 471 OG SER A 34 2.574 10.238 -4.614 1.00 0.00 O ATOM 0 H SER A 34 0.192 10.554 -2.611 1.00 0.00 H new ATOM 0 HA SER A 34 0.521 8.738 -4.868 1.00 0.00 H new ATOM 0 HB2 SER A 34 2.290 9.772 -2.629 1.00 0.00 H new ATOM 0 HB3 SER A 34 2.801 8.437 -3.643 1.00 0.00 H new ATOM 0 HG SER A 34 3.081 9.763 -5.305 1.00 0.00 H new ATOM 477 N PHE A 35 0.674 6.487 -3.707 1.00 0.00 N ATOM 478 CA PHE A 35 0.448 5.182 -3.098 1.00 0.00 C ATOM 479 C PHE A 35 1.279 4.106 -3.793 1.00 0.00 C ATOM 480 O PHE A 35 1.813 4.325 -4.881 1.00 0.00 O ATOM 481 CB PHE A 35 -1.036 4.816 -3.161 1.00 0.00 C ATOM 482 CG PHE A 35 -1.533 4.564 -4.557 1.00 0.00 C ATOM 483 CD1 PHE A 35 -1.572 5.589 -5.488 1.00 0.00 C ATOM 484 CD2 PHE A 35 -1.961 3.302 -4.936 1.00 0.00 C ATOM 485 CE1 PHE A 35 -2.027 5.360 -6.773 1.00 0.00 C ATOM 486 CE2 PHE A 35 -2.417 3.067 -6.220 1.00 0.00 C ATOM 487 CZ PHE A 35 -2.451 4.098 -7.139 1.00 0.00 C ATOM 0 H PHE A 35 1.034 6.451 -4.661 1.00 0.00 H new ATOM 0 HA PHE A 35 0.757 5.238 -2.054 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -1.208 3.926 -2.556 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -1.620 5.622 -2.716 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -1.243 6.578 -5.207 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -1.938 2.493 -4.221 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -2.051 6.167 -7.490 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -2.746 2.078 -6.504 1.00 0.00 H new ATOM 0 HZ PHE A 35 -2.809 3.917 -8.142 1.00 0.00 H new ATOM 497 N LEU A 36 1.383 2.945 -3.156 1.00 0.00 N ATOM 498 CA LEU A 36 2.149 1.835 -3.711 1.00 0.00 C ATOM 499 C LEU A 36 1.817 0.531 -2.992 1.00 0.00 C ATOM 500 O LEU A 36 1.409 0.537 -1.831 1.00 0.00 O ATOM 501 CB LEU A 36 3.648 2.120 -3.608 1.00 0.00 C ATOM 502 CG LEU A 36 4.212 2.239 -2.191 1.00 0.00 C ATOM 503 CD1 LEU A 36 4.664 0.879 -1.681 1.00 0.00 C ATOM 504 CD2 LEU A 36 5.364 3.233 -2.157 1.00 0.00 C ATOM 0 H LEU A 36 0.947 2.748 -2.255 1.00 0.00 H new ATOM 0 HA LEU A 36 1.878 1.729 -4.761 1.00 0.00 H new ATOM 0 HB2 LEU A 36 4.185 1.326 -4.126 1.00 0.00 H new ATOM 0 HB3 LEU A 36 3.859 3.047 -4.141 1.00 0.00 H new ATOM 0 HG LEU A 36 3.422 2.606 -1.536 1.00 0.00 H new ATOM 0 HD11 LEU A 36 5.062 0.983 -0.672 1.00 0.00 H new ATOM 0 HD12 LEU A 36 3.815 0.195 -1.668 1.00 0.00 H new ATOM 0 HD13 LEU A 36 5.439 0.483 -2.338 1.00 0.00 H new ATOM 0 HD21 LEU A 36 5.753 3.305 -1.141 1.00 0.00 H new ATOM 0 HD22 LEU A 36 6.156 2.895 -2.826 1.00 0.00 H new ATOM 0 HD23 LEU A 36 5.010 4.212 -2.480 1.00 0.00 H new ATOM 516 N VAL A 37 1.997 -0.586 -3.689 1.00 0.00 N ATOM 517 CA VAL A 37 1.721 -1.898 -3.116 1.00 0.00 C ATOM 518 C VAL A 37 2.998 -2.720 -2.982 1.00 0.00 C ATOM 519 O VAL A 37 3.885 -2.650 -3.833 1.00 0.00 O ATOM 520 CB VAL A 37 0.707 -2.681 -3.971 1.00 0.00 C ATOM 521 CG1 VAL A 37 0.268 -3.948 -3.252 1.00 0.00 C ATOM 522 CG2 VAL A 37 -0.492 -1.808 -4.309 1.00 0.00 C ATOM 0 H VAL A 37 2.333 -0.609 -4.652 1.00 0.00 H new ATOM 0 HA VAL A 37 1.297 -1.728 -2.126 1.00 0.00 H new ATOM 0 HB VAL A 37 1.191 -2.970 -4.904 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -0.448 -4.488 -3.871 1.00 0.00 H new ATOM 0 HG12 VAL A 37 1.136 -4.580 -3.066 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -0.199 -3.685 -2.303 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -1.198 -2.378 -4.913 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -0.979 -1.487 -3.388 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -0.159 -0.933 -4.868 1.00 0.00 H new ATOM 532 N ARG A 38 3.084 -3.498 -1.908 1.00 0.00 N ATOM 533 CA ARG A 38 4.254 -4.333 -1.662 1.00 0.00 C ATOM 534 C ARG A 38 3.847 -5.675 -1.062 1.00 0.00 C ATOM 535 O ARG A 38 2.673 -5.906 -0.771 1.00 0.00 O ATOM 536 CB ARG A 38 5.230 -3.618 -0.726 1.00 0.00 C ATOM 537 CG ARG A 38 4.720 -3.488 0.700 1.00 0.00 C ATOM 538 CD ARG A 38 5.818 -3.019 1.643 1.00 0.00 C ATOM 539 NE ARG A 38 5.329 -2.848 3.009 1.00 0.00 N ATOM 540 CZ ARG A 38 6.121 -2.826 4.075 1.00 0.00 C ATOM 541 NH1 ARG A 38 7.432 -2.963 3.934 1.00 0.00 N ATOM 542 NH2 ARG A 38 5.602 -2.665 5.285 1.00 0.00 N ATOM 0 H ARG A 38 2.358 -3.568 -1.195 1.00 0.00 H new ATOM 0 HA ARG A 38 4.746 -4.516 -2.617 1.00 0.00 H new ATOM 0 HB2 ARG A 38 6.175 -4.161 -0.717 1.00 0.00 H new ATOM 0 HB3 ARG A 38 5.437 -2.623 -1.121 1.00 0.00 H new ATOM 0 HG2 ARG A 38 3.889 -2.783 0.728 1.00 0.00 H new ATOM 0 HG3 ARG A 38 4.334 -4.449 1.039 1.00 0.00 H new ATOM 0 HD2 ARG A 38 6.634 -3.742 1.638 1.00 0.00 H new ATOM 0 HD3 ARG A 38 6.226 -2.075 1.283 1.00 0.00 H new ATOM 0 HE ARG A 38 4.325 -2.740 3.152 1.00 0.00 H new ATOM 0 HH11 ARG A 38 7.835 -3.086 3.005 1.00 0.00 H new ATOM 0 HH12 ARG A 38 8.038 -2.946 4.754 1.00 0.00 H new ATOM 0 HH21 ARG A 38 4.594 -2.558 5.397 1.00 0.00 H new ATOM 0 HH22 ARG A 38 6.211 -2.648 6.103 1.00 0.00 H new ATOM 556 N ALA A 39 4.824 -6.557 -0.880 1.00 0.00 N ATOM 557 CA ALA A 39 4.568 -7.875 -0.313 1.00 0.00 C ATOM 558 C ALA A 39 4.908 -7.909 1.174 1.00 0.00 C ATOM 559 O ALA A 39 6.068 -7.760 1.558 1.00 0.00 O ATOM 560 CB ALA A 39 5.361 -8.935 -1.062 1.00 0.00 C ATOM 0 H ALA A 39 5.801 -6.382 -1.117 1.00 0.00 H new ATOM 0 HA ALA A 39 3.505 -8.089 -0.421 1.00 0.00 H new ATOM 0 HB1 ALA A 39 5.160 -9.914 -0.628 1.00 0.00 H new ATOM 0 HB2 ALA A 39 5.066 -8.936 -2.111 1.00 0.00 H new ATOM 0 HB3 ALA A 39 6.426 -8.715 -0.984 1.00 0.00 H new ATOM 566 N SER A 40 3.889 -8.105 2.005 1.00 0.00 N ATOM 567 CA SER A 40 4.080 -8.154 3.450 1.00 0.00 C ATOM 568 C SER A 40 5.158 -9.168 3.821 1.00 0.00 C ATOM 569 O SER A 40 5.280 -10.218 3.193 1.00 0.00 O ATOM 570 CB SER A 40 2.766 -8.511 4.147 1.00 0.00 C ATOM 571 OG SER A 40 2.974 -8.771 5.524 1.00 0.00 O ATOM 0 H SER A 40 2.923 -8.232 1.703 1.00 0.00 H new ATOM 0 HA SER A 40 4.403 -7.168 3.783 1.00 0.00 H new ATOM 0 HB2 SER A 40 2.055 -7.693 4.031 1.00 0.00 H new ATOM 0 HB3 SER A 40 2.324 -9.386 3.671 1.00 0.00 H new ATOM 0 HG SER A 40 2.119 -8.995 5.947 1.00 0.00 H new ATOM 577 N GLU A 41 5.938 -8.843 4.848 1.00 0.00 N ATOM 578 CA GLU A 41 7.007 -9.725 5.303 1.00 0.00 C ATOM 579 C GLU A 41 6.442 -10.900 6.096 1.00 0.00 C ATOM 580 O GLU A 41 6.617 -12.058 5.718 1.00 0.00 O ATOM 581 CB GLU A 41 8.007 -8.949 6.162 1.00 0.00 C ATOM 582 CG GLU A 41 9.391 -9.573 6.199 1.00 0.00 C ATOM 583 CD GLU A 41 10.240 -9.181 5.004 1.00 0.00 C ATOM 584 OE1 GLU A 41 10.900 -8.123 5.068 1.00 0.00 O ATOM 585 OE2 GLU A 41 10.243 -9.932 4.007 1.00 0.00 O ATOM 0 H GLU A 41 5.850 -7.977 5.380 1.00 0.00 H new ATOM 0 HA GLU A 41 7.520 -10.116 4.424 1.00 0.00 H new ATOM 0 HB2 GLU A 41 8.087 -7.931 5.781 1.00 0.00 H new ATOM 0 HB3 GLU A 41 7.622 -8.879 7.179 1.00 0.00 H new ATOM 0 HG2 GLU A 41 9.898 -9.270 7.115 1.00 0.00 H new ATOM 0 HG3 GLU A 41 9.295 -10.658 6.232 1.00 0.00 H new ATOM 592 N SER A 42 5.765 -10.592 7.197 1.00 0.00 N ATOM 593 CA SER A 42 5.178 -11.622 8.047 1.00 0.00 C ATOM 594 C SER A 42 4.442 -12.663 7.209 1.00 0.00 C ATOM 595 O SER A 42 4.741 -13.855 7.278 1.00 0.00 O ATOM 596 CB SER A 42 4.217 -10.992 9.057 1.00 0.00 C ATOM 597 OG SER A 42 4.847 -9.947 9.778 1.00 0.00 O ATOM 0 H SER A 42 5.609 -9.638 7.522 1.00 0.00 H new ATOM 0 HA SER A 42 5.986 -12.119 8.585 1.00 0.00 H new ATOM 0 HB2 SER A 42 3.342 -10.603 8.537 1.00 0.00 H new ATOM 0 HB3 SER A 42 3.863 -11.754 9.751 1.00 0.00 H new ATOM 0 HG SER A 42 4.211 -9.560 10.415 1.00 0.00 H new ATOM 603 N ILE A 43 3.479 -12.203 6.417 1.00 0.00 N ATOM 604 CA ILE A 43 2.701 -13.093 5.565 1.00 0.00 C ATOM 605 C ILE A 43 2.838 -12.707 4.096 1.00 0.00 C ATOM 606 O ILE A 43 2.059 -11.908 3.578 1.00 0.00 O ATOM 607 CB ILE A 43 1.209 -13.080 5.950 1.00 0.00 C ATOM 608 CG1 ILE A 43 1.050 -13.231 7.464 1.00 0.00 C ATOM 609 CG2 ILE A 43 0.464 -14.187 5.220 1.00 0.00 C ATOM 610 CD1 ILE A 43 -0.274 -12.720 7.986 1.00 0.00 C ATOM 0 H ILE A 43 3.219 -11.219 6.348 1.00 0.00 H new ATOM 0 HA ILE A 43 3.098 -14.097 5.713 1.00 0.00 H new ATOM 0 HB ILE A 43 0.780 -12.123 5.652 1.00 0.00 H new ATOM 0 HG12 ILE A 43 1.154 -14.283 7.729 1.00 0.00 H new ATOM 0 HG13 ILE A 43 1.859 -12.695 7.961 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -0.589 -14.165 5.502 1.00 0.00 H new ATOM 0 HG22 ILE A 43 0.554 -14.038 4.144 1.00 0.00 H new ATOM 0 HG23 ILE A 43 0.892 -15.153 5.490 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -0.317 -12.859 9.066 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -0.373 -11.660 7.752 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -1.088 -13.272 7.516 1.00 0.00 H new ATOM 622 N SER A 44 3.835 -13.282 3.430 1.00 0.00 N ATOM 623 CA SER A 44 4.076 -12.997 2.020 1.00 0.00 C ATOM 624 C SER A 44 2.781 -13.081 1.219 1.00 0.00 C ATOM 625 O SER A 44 2.579 -12.331 0.264 1.00 0.00 O ATOM 626 CB SER A 44 5.107 -13.974 1.450 1.00 0.00 C ATOM 627 OG SER A 44 5.432 -13.647 0.110 1.00 0.00 O ATOM 0 H SER A 44 4.488 -13.947 3.844 1.00 0.00 H new ATOM 0 HA SER A 44 4.465 -11.982 1.941 1.00 0.00 H new ATOM 0 HB2 SER A 44 6.009 -13.954 2.062 1.00 0.00 H new ATOM 0 HB3 SER A 44 4.714 -14.990 1.495 1.00 0.00 H new ATOM 0 HG SER A 44 6.093 -14.285 -0.231 1.00 0.00 H new ATOM 633 N ARG A 45 1.906 -14.000 1.615 1.00 0.00 N ATOM 634 CA ARG A 45 0.631 -14.185 0.934 1.00 0.00 C ATOM 635 C ARG A 45 -0.177 -12.890 0.932 1.00 0.00 C ATOM 636 O ARG A 45 -0.845 -12.565 -0.049 1.00 0.00 O ATOM 637 CB ARG A 45 -0.174 -15.299 1.606 1.00 0.00 C ATOM 638 CG ARG A 45 0.323 -16.696 1.272 1.00 0.00 C ATOM 639 CD ARG A 45 -0.704 -17.755 1.640 1.00 0.00 C ATOM 640 NE ARG A 45 -0.145 -19.103 1.581 1.00 0.00 N ATOM 641 CZ ARG A 45 -0.654 -20.139 2.239 1.00 0.00 C ATOM 642 NH1 ARG A 45 -1.727 -19.982 3.002 1.00 0.00 N ATOM 643 NH2 ARG A 45 -0.089 -21.335 2.135 1.00 0.00 N ATOM 0 H ARG A 45 2.057 -14.628 2.404 1.00 0.00 H new ATOM 0 HA ARG A 45 0.837 -14.467 -0.099 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -0.140 -15.159 2.686 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -1.218 -15.213 1.306 1.00 0.00 H new ATOM 0 HG2 ARG A 45 0.547 -16.759 0.207 1.00 0.00 H new ATOM 0 HG3 ARG A 45 1.254 -16.889 1.805 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -1.080 -17.562 2.645 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -1.555 -17.685 0.963 1.00 0.00 H new ATOM 0 HE ARG A 45 0.681 -19.258 1.003 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -2.164 -19.064 3.085 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -2.116 -20.779 3.506 1.00 0.00 H new ATOM 0 HH21 ARG A 45 0.737 -21.460 1.550 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -0.481 -22.130 2.641 1.00 0.00 H new ATOM 657 N ALA A 46 -0.110 -12.155 2.037 1.00 0.00 N ATOM 658 CA ALA A 46 -0.833 -10.896 2.162 1.00 0.00 C ATOM 659 C ALA A 46 -0.121 -9.777 1.409 1.00 0.00 C ATOM 660 O ALA A 46 0.980 -9.967 0.892 1.00 0.00 O ATOM 661 CB ALA A 46 -0.999 -10.525 3.629 1.00 0.00 C ATOM 0 H ALA A 46 0.438 -12.410 2.859 1.00 0.00 H new ATOM 0 HA ALA A 46 -1.820 -11.027 1.718 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -1.541 -9.582 3.707 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -1.558 -11.308 4.141 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -0.017 -10.418 4.091 1.00 0.00 H new ATOM 667 N TYR A 47 -0.756 -8.612 1.351 1.00 0.00 N ATOM 668 CA TYR A 47 -0.184 -7.463 0.659 1.00 0.00 C ATOM 669 C TYR A 47 -0.168 -6.234 1.563 1.00 0.00 C ATOM 670 O TYR A 47 -0.714 -6.254 2.666 1.00 0.00 O ATOM 671 CB TYR A 47 -0.977 -7.163 -0.615 1.00 0.00 C ATOM 672 CG TYR A 47 -0.606 -8.050 -1.782 1.00 0.00 C ATOM 673 CD1 TYR A 47 0.522 -7.788 -2.549 1.00 0.00 C ATOM 674 CD2 TYR A 47 -1.385 -9.151 -2.116 1.00 0.00 C ATOM 675 CE1 TYR A 47 0.863 -8.595 -3.616 1.00 0.00 C ATOM 676 CE2 TYR A 47 -1.050 -9.965 -3.181 1.00 0.00 C ATOM 677 CZ TYR A 47 0.074 -9.683 -3.928 1.00 0.00 C ATOM 678 OH TYR A 47 0.412 -10.491 -4.990 1.00 0.00 O ATOM 0 H TYR A 47 -1.667 -8.438 1.775 1.00 0.00 H new ATOM 0 HA TYR A 47 0.844 -7.707 0.391 1.00 0.00 H new ATOM 0 HB2 TYR A 47 -2.041 -7.277 -0.406 1.00 0.00 H new ATOM 0 HB3 TYR A 47 -0.817 -6.122 -0.896 1.00 0.00 H new ATOM 0 HD1 TYR A 47 1.143 -6.938 -2.307 1.00 0.00 H new ATOM 0 HD2 TYR A 47 -2.267 -9.374 -1.534 1.00 0.00 H new ATOM 0 HE1 TYR A 47 1.743 -8.376 -4.203 1.00 0.00 H new ATOM 0 HE2 TYR A 47 -1.665 -10.818 -3.427 1.00 0.00 H new ATOM 0 HH TYR A 47 -0.246 -11.213 -5.074 1.00 0.00 H new ATOM 688 N ALA A 48 0.462 -5.166 1.087 1.00 0.00 N ATOM 689 CA ALA A 48 0.548 -3.926 1.849 1.00 0.00 C ATOM 690 C ALA A 48 0.424 -2.711 0.937 1.00 0.00 C ATOM 691 O ALA A 48 1.189 -2.555 -0.015 1.00 0.00 O ATOM 692 CB ALA A 48 1.855 -3.874 2.626 1.00 0.00 C ATOM 0 H ALA A 48 0.921 -5.134 0.177 1.00 0.00 H new ATOM 0 HA ALA A 48 -0.283 -3.904 2.554 1.00 0.00 H new ATOM 0 HB1 ALA A 48 1.906 -2.943 3.190 1.00 0.00 H new ATOM 0 HB2 ALA A 48 1.903 -4.718 3.314 1.00 0.00 H new ATOM 0 HB3 ALA A 48 2.693 -3.924 1.931 1.00 0.00 H new ATOM 698 N LEU A 49 -0.545 -1.852 1.233 1.00 0.00 N ATOM 699 CA LEU A 49 -0.771 -0.649 0.439 1.00 0.00 C ATOM 700 C LEU A 49 -0.427 0.604 1.238 1.00 0.00 C ATOM 701 O LEU A 49 -1.079 0.914 2.235 1.00 0.00 O ATOM 702 CB LEU A 49 -2.226 -0.587 -0.027 1.00 0.00 C ATOM 703 CG LEU A 49 -2.660 0.714 -0.703 1.00 0.00 C ATOM 704 CD1 LEU A 49 -1.886 0.929 -1.994 1.00 0.00 C ATOM 705 CD2 LEU A 49 -4.158 0.702 -0.972 1.00 0.00 C ATOM 0 H LEU A 49 -1.187 -1.966 2.017 1.00 0.00 H new ATOM 0 HA LEU A 49 -0.118 -0.692 -0.433 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -2.399 -1.409 -0.721 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -2.870 -0.757 0.836 1.00 0.00 H new ATOM 0 HG LEU A 49 -2.439 1.542 -0.029 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -2.208 1.860 -2.461 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -0.820 0.984 -1.774 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -2.074 0.098 -2.674 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -4.449 1.636 -1.453 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -4.404 -0.135 -1.626 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -4.696 0.597 -0.030 1.00 0.00 H new ATOM 717 N CYS A 50 0.600 1.320 0.793 1.00 0.00 N ATOM 718 CA CYS A 50 1.030 2.540 1.466 1.00 0.00 C ATOM 719 C CYS A 50 0.424 3.771 0.799 1.00 0.00 C ATOM 720 O CYS A 50 0.222 3.796 -0.415 1.00 0.00 O ATOM 721 CB CYS A 50 2.556 2.641 1.459 1.00 0.00 C ATOM 722 SG CYS A 50 3.374 1.534 2.632 1.00 0.00 S ATOM 0 H CYS A 50 1.150 1.077 -0.031 1.00 0.00 H new ATOM 0 HA CYS A 50 0.681 2.499 2.498 1.00 0.00 H new ATOM 0 HB2 CYS A 50 2.919 2.422 0.455 1.00 0.00 H new ATOM 0 HB3 CYS A 50 2.843 3.668 1.685 1.00 0.00 H new ATOM 0 HG CYS A 50 4.636 1.836 2.705 1.00 0.00 H new ATOM 728 N VAL A 51 0.135 4.790 1.602 1.00 0.00 N ATOM 729 CA VAL A 51 -0.449 6.025 1.090 1.00 0.00 C ATOM 730 C VAL A 51 0.153 7.244 1.779 1.00 0.00 C ATOM 731 O VAL A 51 0.218 7.308 3.007 1.00 0.00 O ATOM 732 CB VAL A 51 -1.977 6.044 1.280 1.00 0.00 C ATOM 733 CG1 VAL A 51 -2.562 7.351 0.768 1.00 0.00 C ATOM 734 CG2 VAL A 51 -2.616 4.854 0.579 1.00 0.00 C ATOM 0 H VAL A 51 0.295 4.785 2.609 1.00 0.00 H new ATOM 0 HA VAL A 51 -0.222 6.065 0.025 1.00 0.00 H new ATOM 0 HB VAL A 51 -2.194 5.969 2.345 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -3.643 7.346 0.910 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -2.127 8.185 1.319 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -2.336 7.460 -0.293 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -3.696 4.883 0.724 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -2.391 4.896 -0.487 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -2.219 3.929 0.997 1.00 0.00 H new ATOM 744 N LEU A 52 0.593 8.211 0.980 1.00 0.00 N ATOM 745 CA LEU A 52 1.190 9.431 1.513 1.00 0.00 C ATOM 746 C LEU A 52 0.133 10.512 1.713 1.00 0.00 C ATOM 747 O LEU A 52 -0.560 10.898 0.772 1.00 0.00 O ATOM 748 CB LEU A 52 2.284 9.939 0.572 1.00 0.00 C ATOM 749 CG LEU A 52 3.212 11.013 1.141 1.00 0.00 C ATOM 750 CD1 LEU A 52 4.078 10.437 2.250 1.00 0.00 C ATOM 751 CD2 LEU A 52 4.079 11.607 0.040 1.00 0.00 C ATOM 0 H LEU A 52 0.548 8.174 -0.038 1.00 0.00 H new ATOM 0 HA LEU A 52 1.632 9.197 2.482 1.00 0.00 H new ATOM 0 HB2 LEU A 52 2.892 9.089 0.261 1.00 0.00 H new ATOM 0 HB3 LEU A 52 1.809 10.336 -0.325 1.00 0.00 H new ATOM 0 HG LEU A 52 2.599 11.809 1.563 1.00 0.00 H new ATOM 0 HD11 LEU A 52 4.732 11.216 2.643 1.00 0.00 H new ATOM 0 HD12 LEU A 52 3.441 10.060 3.050 1.00 0.00 H new ATOM 0 HD13 LEU A 52 4.683 9.622 1.853 1.00 0.00 H new ATOM 0 HD21 LEU A 52 4.733 12.369 0.463 1.00 0.00 H new ATOM 0 HD22 LEU A 52 4.684 10.820 -0.411 1.00 0.00 H new ATOM 0 HD23 LEU A 52 3.442 12.057 -0.722 1.00 0.00 H new ATOM 763 N TYR A 53 0.017 10.998 2.944 1.00 0.00 N ATOM 764 CA TYR A 53 -0.955 12.035 3.268 1.00 0.00 C ATOM 765 C TYR A 53 -0.496 12.856 4.469 1.00 0.00 C ATOM 766 O TYR A 53 -0.377 12.339 5.580 1.00 0.00 O ATOM 767 CB TYR A 53 -2.321 11.410 3.556 1.00 0.00 C ATOM 768 CG TYR A 53 -3.405 12.426 3.840 1.00 0.00 C ATOM 769 CD1 TYR A 53 -4.170 12.960 2.810 1.00 0.00 C ATOM 770 CD2 TYR A 53 -3.662 12.853 5.136 1.00 0.00 C ATOM 771 CE1 TYR A 53 -5.160 13.890 3.064 1.00 0.00 C ATOM 772 CE2 TYR A 53 -4.651 13.781 5.400 1.00 0.00 C ATOM 773 CZ TYR A 53 -5.397 14.296 4.360 1.00 0.00 C ATOM 774 OH TYR A 53 -6.382 15.222 4.619 1.00 0.00 O ATOM 0 H TYR A 53 0.584 10.690 3.734 1.00 0.00 H new ATOM 0 HA TYR A 53 -1.040 12.699 2.408 1.00 0.00 H new ATOM 0 HB2 TYR A 53 -2.620 10.801 2.702 1.00 0.00 H new ATOM 0 HB3 TYR A 53 -2.231 10.739 4.410 1.00 0.00 H new ATOM 0 HD1 TYR A 53 -3.988 12.643 1.794 1.00 0.00 H new ATOM 0 HD2 TYR A 53 -3.079 12.453 5.952 1.00 0.00 H new ATOM 0 HE1 TYR A 53 -5.745 14.296 2.252 1.00 0.00 H new ATOM 0 HE2 TYR A 53 -4.839 14.101 6.414 1.00 0.00 H new ATOM 0 HH TYR A 53 -6.420 15.398 5.582 1.00 0.00 H new ATOM 784 N ARG A 54 -0.240 14.139 4.236 1.00 0.00 N ATOM 785 CA ARG A 54 0.207 15.034 5.297 1.00 0.00 C ATOM 786 C ARG A 54 1.528 14.555 5.891 1.00 0.00 C ATOM 787 O ARG A 54 1.663 14.427 7.107 1.00 0.00 O ATOM 788 CB ARG A 54 -0.854 15.127 6.395 1.00 0.00 C ATOM 789 CG ARG A 54 -2.075 15.940 5.995 1.00 0.00 C ATOM 790 CD ARG A 54 -2.716 16.611 7.200 1.00 0.00 C ATOM 791 NE ARG A 54 -4.036 17.152 6.886 1.00 0.00 N ATOM 792 CZ ARG A 54 -4.695 17.988 7.681 1.00 0.00 C ATOM 793 NH1 ARG A 54 -4.160 18.377 8.829 1.00 0.00 N ATOM 794 NH2 ARG A 54 -5.893 18.436 7.326 1.00 0.00 N ATOM 0 H ARG A 54 -0.334 14.582 3.322 1.00 0.00 H new ATOM 0 HA ARG A 54 0.360 16.023 4.864 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -1.172 14.121 6.668 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -0.407 15.572 7.284 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -1.787 16.697 5.266 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -2.803 15.290 5.509 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -2.803 15.890 8.013 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -2.070 17.414 7.554 1.00 0.00 H new ATOM 0 HE ARG A 54 -4.476 16.873 6.009 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -3.240 18.035 9.105 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -4.669 19.019 9.437 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -6.308 18.138 6.443 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -6.399 19.078 7.936 1.00 0.00 H new ATOM 808 N ASN A 55 2.500 14.292 5.024 1.00 0.00 N ATOM 809 CA ASN A 55 3.811 13.826 5.463 1.00 0.00 C ATOM 810 C ASN A 55 3.677 12.632 6.403 1.00 0.00 C ATOM 811 O ASN A 55 4.382 12.539 7.408 1.00 0.00 O ATOM 812 CB ASN A 55 4.569 14.956 6.161 1.00 0.00 C ATOM 813 CG ASN A 55 5.383 15.792 5.191 1.00 0.00 C ATOM 814 OD1 ASN A 55 4.896 16.784 4.650 1.00 0.00 O ATOM 815 ND2 ASN A 55 6.629 15.392 4.967 1.00 0.00 N ATOM 0 H ASN A 55 2.405 14.393 4.014 1.00 0.00 H new ATOM 0 HA ASN A 55 4.371 13.511 4.582 1.00 0.00 H new ATOM 0 HB2 ASN A 55 3.859 15.598 6.683 1.00 0.00 H new ATOM 0 HB3 ASN A 55 5.231 14.533 6.916 1.00 0.00 H new ATOM 0 HD21 ASN A 55 7.224 15.914 4.324 1.00 0.00 H new ATOM 0 HD22 ASN A 55 6.991 14.563 5.438 1.00 0.00 H new ATOM 822 N CYS A 56 2.769 11.721 6.068 1.00 0.00 N ATOM 823 CA CYS A 56 2.543 10.532 6.882 1.00 0.00 C ATOM 824 C CYS A 56 2.084 9.362 6.019 1.00 0.00 C ATOM 825 O CYS A 56 1.101 9.465 5.285 1.00 0.00 O ATOM 826 CB CYS A 56 1.502 10.821 7.965 1.00 0.00 C ATOM 827 SG CYS A 56 2.050 12.005 9.217 1.00 0.00 S ATOM 0 H CYS A 56 2.178 11.783 5.239 1.00 0.00 H new ATOM 0 HA CYS A 56 3.486 10.262 7.357 1.00 0.00 H new ATOM 0 HB2 CYS A 56 0.597 11.202 7.492 1.00 0.00 H new ATOM 0 HB3 CYS A 56 1.235 9.885 8.457 1.00 0.00 H new ATOM 0 HG CYS A 56 3.162 12.559 8.833 1.00 0.00 H new ATOM 833 N VAL A 57 2.804 8.248 6.111 1.00 0.00 N ATOM 834 CA VAL A 57 2.472 7.057 5.338 1.00 0.00 C ATOM 835 C VAL A 57 1.385 6.240 6.027 1.00 0.00 C ATOM 836 O VAL A 57 1.422 6.037 7.241 1.00 0.00 O ATOM 837 CB VAL A 57 3.709 6.166 5.121 1.00 0.00 C ATOM 838 CG1 VAL A 57 3.333 4.908 4.353 1.00 0.00 C ATOM 839 CG2 VAL A 57 4.801 6.937 4.394 1.00 0.00 C ATOM 0 H VAL A 57 3.621 8.146 6.713 1.00 0.00 H new ATOM 0 HA VAL A 57 2.106 7.400 4.370 1.00 0.00 H new ATOM 0 HB VAL A 57 4.094 5.867 6.096 1.00 0.00 H new ATOM 0 HG11 VAL A 57 4.220 4.291 4.209 1.00 0.00 H new ATOM 0 HG12 VAL A 57 2.588 4.347 4.917 1.00 0.00 H new ATOM 0 HG13 VAL A 57 2.922 5.184 3.382 1.00 0.00 H new ATOM 0 HG21 VAL A 57 5.667 6.292 4.249 1.00 0.00 H new ATOM 0 HG22 VAL A 57 4.429 7.268 3.424 1.00 0.00 H new ATOM 0 HG23 VAL A 57 5.090 7.805 4.987 1.00 0.00 H new ATOM 849 N TYR A 58 0.418 5.773 5.245 1.00 0.00 N ATOM 850 CA TYR A 58 -0.681 4.979 5.780 1.00 0.00 C ATOM 851 C TYR A 58 -0.662 3.566 5.206 1.00 0.00 C ATOM 852 O TYR A 58 -1.223 3.307 4.140 1.00 0.00 O ATOM 853 CB TYR A 58 -2.021 5.650 5.470 1.00 0.00 C ATOM 854 CG TYR A 58 -2.182 7.007 6.116 1.00 0.00 C ATOM 855 CD1 TYR A 58 -1.375 8.075 5.746 1.00 0.00 C ATOM 856 CD2 TYR A 58 -3.142 7.221 7.098 1.00 0.00 C ATOM 857 CE1 TYR A 58 -1.518 9.317 6.334 1.00 0.00 C ATOM 858 CE2 TYR A 58 -3.293 8.460 7.691 1.00 0.00 C ATOM 859 CZ TYR A 58 -2.479 9.504 7.306 1.00 0.00 C ATOM 860 OH TYR A 58 -2.626 10.739 7.894 1.00 0.00 O ATOM 0 H TYR A 58 0.373 5.931 4.238 1.00 0.00 H new ATOM 0 HA TYR A 58 -0.556 4.914 6.861 1.00 0.00 H new ATOM 0 HB2 TYR A 58 -2.123 5.757 4.390 1.00 0.00 H new ATOM 0 HB3 TYR A 58 -2.829 5.000 5.804 1.00 0.00 H new ATOM 0 HD1 TYR A 58 -0.622 7.932 4.985 1.00 0.00 H new ATOM 0 HD2 TYR A 58 -3.781 6.405 7.403 1.00 0.00 H new ATOM 0 HE1 TYR A 58 -0.881 10.136 6.035 1.00 0.00 H new ATOM 0 HE2 TYR A 58 -4.045 8.610 8.452 1.00 0.00 H new ATOM 0 HH TYR A 58 -3.347 10.702 8.557 1.00 0.00 H new ATOM 870 N THR A 59 -0.014 2.652 5.922 1.00 0.00 N ATOM 871 CA THR A 59 0.080 1.265 5.485 1.00 0.00 C ATOM 872 C THR A 59 -1.247 0.538 5.675 1.00 0.00 C ATOM 873 O THR A 59 -1.840 0.581 6.753 1.00 0.00 O ATOM 874 CB THR A 59 1.181 0.508 6.251 1.00 0.00 C ATOM 875 OG1 THR A 59 2.289 1.379 6.505 1.00 0.00 O ATOM 876 CG2 THR A 59 1.653 -0.704 5.463 1.00 0.00 C ATOM 0 H THR A 59 0.453 2.848 6.807 1.00 0.00 H new ATOM 0 HA THR A 59 0.333 1.284 4.425 1.00 0.00 H new ATOM 0 HB THR A 59 0.764 0.166 7.198 1.00 0.00 H new ATOM 0 HG1 THR A 59 2.984 0.890 6.994 1.00 0.00 H new ATOM 0 HG21 THR A 59 2.430 -1.223 6.024 1.00 0.00 H new ATOM 0 HG22 THR A 59 0.814 -1.379 5.297 1.00 0.00 H new ATOM 0 HG23 THR A 59 2.054 -0.380 4.502 1.00 0.00 H new ATOM 884 N TYR A 60 -1.707 -0.129 4.623 1.00 0.00 N ATOM 885 CA TYR A 60 -2.965 -0.864 4.673 1.00 0.00 C ATOM 886 C TYR A 60 -2.774 -2.303 4.204 1.00 0.00 C ATOM 887 O TYR A 60 -2.978 -2.617 3.031 1.00 0.00 O ATOM 888 CB TYR A 60 -4.020 -0.170 3.811 1.00 0.00 C ATOM 889 CG TYR A 60 -4.514 1.135 4.393 1.00 0.00 C ATOM 890 CD1 TYR A 60 -5.249 1.160 5.572 1.00 0.00 C ATOM 891 CD2 TYR A 60 -4.246 2.345 3.764 1.00 0.00 C ATOM 892 CE1 TYR A 60 -5.702 2.350 6.107 1.00 0.00 C ATOM 893 CE2 TYR A 60 -4.694 3.540 4.292 1.00 0.00 C ATOM 894 CZ TYR A 60 -5.422 3.537 5.463 1.00 0.00 C ATOM 895 OH TYR A 60 -5.871 4.725 5.993 1.00 0.00 O ATOM 0 H TYR A 60 -1.227 -0.176 3.724 1.00 0.00 H new ATOM 0 HA TYR A 60 -3.306 -0.881 5.708 1.00 0.00 H new ATOM 0 HB2 TYR A 60 -3.603 0.018 2.822 1.00 0.00 H new ATOM 0 HB3 TYR A 60 -4.867 -0.842 3.677 1.00 0.00 H new ATOM 0 HD1 TYR A 60 -5.470 0.232 6.079 1.00 0.00 H new ATOM 0 HD2 TYR A 60 -3.677 2.351 2.846 1.00 0.00 H new ATOM 0 HE1 TYR A 60 -6.272 2.351 7.024 1.00 0.00 H new ATOM 0 HE2 TYR A 60 -4.475 4.471 3.791 1.00 0.00 H new ATOM 0 HH TYR A 60 -5.588 5.467 5.419 1.00 0.00 H new ATOM 905 N ARG A 61 -2.382 -3.174 5.128 1.00 0.00 N ATOM 906 CA ARG A 61 -2.163 -4.579 4.810 1.00 0.00 C ATOM 907 C ARG A 61 -3.461 -5.244 4.360 1.00 0.00 C ATOM 908 O ARG A 61 -4.505 -5.080 4.992 1.00 0.00 O ATOM 909 CB ARG A 61 -1.595 -5.317 6.024 1.00 0.00 C ATOM 910 CG ARG A 61 -2.436 -5.161 7.280 1.00 0.00 C ATOM 911 CD ARG A 61 -1.788 -5.845 8.474 1.00 0.00 C ATOM 912 NE ARG A 61 -1.355 -7.203 8.157 1.00 0.00 N ATOM 913 CZ ARG A 61 -0.649 -7.961 8.988 1.00 0.00 C ATOM 914 NH1 ARG A 61 -0.297 -7.497 10.179 1.00 0.00 N ATOM 915 NH2 ARG A 61 -0.292 -9.188 8.628 1.00 0.00 N ATOM 0 H ARG A 61 -2.210 -2.931 6.103 1.00 0.00 H new ATOM 0 HA ARG A 61 -1.445 -4.632 3.992 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -1.507 -6.377 5.786 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -0.588 -4.950 6.223 1.00 0.00 H new ATOM 0 HG2 ARG A 61 -2.574 -4.102 7.497 1.00 0.00 H new ATOM 0 HG3 ARG A 61 -3.426 -5.584 7.111 1.00 0.00 H new ATOM 0 HD2 ARG A 61 -0.931 -5.259 8.806 1.00 0.00 H new ATOM 0 HD3 ARG A 61 -2.495 -5.874 9.303 1.00 0.00 H new ATOM 0 HE ARG A 61 -1.609 -7.590 7.248 1.00 0.00 H new ATOM 0 HH11 ARG A 61 -0.568 -6.555 10.460 1.00 0.00 H new ATOM 0 HH12 ARG A 61 0.245 -8.082 10.814 1.00 0.00 H new ATOM 0 HH21 ARG A 61 -0.560 -9.549 7.712 1.00 0.00 H new ATOM 0 HH22 ARG A 61 0.250 -9.769 9.267 1.00 0.00 H new ATOM 929 N ILE A 62 -3.388 -5.993 3.265 1.00 0.00 N ATOM 930 CA ILE A 62 -4.557 -6.681 2.732 1.00 0.00 C ATOM 931 C ILE A 62 -4.500 -8.175 3.034 1.00 0.00 C ATOM 932 O ILE A 62 -3.682 -8.903 2.470 1.00 0.00 O ATOM 933 CB ILE A 62 -4.682 -6.482 1.210 1.00 0.00 C ATOM 934 CG1 ILE A 62 -4.782 -4.992 0.876 1.00 0.00 C ATOM 935 CG2 ILE A 62 -5.892 -7.232 0.675 1.00 0.00 C ATOM 936 CD1 ILE A 62 -3.439 -4.329 0.662 1.00 0.00 C ATOM 0 H ILE A 62 -2.532 -6.139 2.730 1.00 0.00 H new ATOM 0 HA ILE A 62 -5.429 -6.246 3.220 1.00 0.00 H new ATOM 0 HB ILE A 62 -3.789 -6.884 0.731 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -5.386 -4.869 -0.023 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -5.306 -4.481 1.684 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -5.967 -7.081 -0.402 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -5.783 -8.296 0.886 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -6.795 -6.857 1.157 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -3.587 -3.274 0.429 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -2.840 -4.420 1.568 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -2.921 -4.814 -0.166 1.00 0.00 H new ATOM 948 N LEU A 63 -5.375 -8.626 3.926 1.00 0.00 N ATOM 949 CA LEU A 63 -5.427 -10.034 4.302 1.00 0.00 C ATOM 950 C LEU A 63 -6.477 -10.779 3.484 1.00 0.00 C ATOM 951 O LEU A 63 -7.550 -10.255 3.182 1.00 0.00 O ATOM 952 CB LEU A 63 -5.735 -10.173 5.794 1.00 0.00 C ATOM 953 CG LEU A 63 -4.649 -9.681 6.752 1.00 0.00 C ATOM 954 CD1 LEU A 63 -3.400 -10.541 6.630 1.00 0.00 C ATOM 955 CD2 LEU A 63 -4.320 -8.220 6.481 1.00 0.00 C ATOM 0 H LEU A 63 -6.058 -8.037 4.402 1.00 0.00 H new ATOM 0 HA LEU A 63 -4.452 -10.475 4.095 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -6.654 -9.627 6.007 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -5.931 -11.224 6.008 1.00 0.00 H new ATOM 0 HG LEU A 63 -5.026 -9.765 7.771 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -2.638 -10.176 7.319 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -3.645 -11.575 6.874 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -3.021 -10.489 5.609 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -3.545 -7.887 7.172 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -3.964 -8.111 5.457 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -5.215 -7.614 6.620 1.00 0.00 H new ATOM 967 N PRO A 64 -6.165 -12.031 3.118 1.00 0.00 N ATOM 968 CA PRO A 64 -7.069 -12.875 2.332 1.00 0.00 C ATOM 969 C PRO A 64 -8.295 -13.310 3.128 1.00 0.00 C ATOM 970 O PRO A 64 -8.244 -13.418 4.353 1.00 0.00 O ATOM 971 CB PRO A 64 -6.205 -14.087 1.977 1.00 0.00 C ATOM 972 CG PRO A 64 -5.174 -14.145 3.051 1.00 0.00 C ATOM 973 CD PRO A 64 -4.904 -12.718 3.443 1.00 0.00 C ATOM 0 HA PRO A 64 -7.466 -12.348 1.464 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -6.798 -15.001 1.948 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -5.747 -13.973 0.994 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -5.531 -14.723 3.903 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -4.266 -14.630 2.694 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -4.660 -12.631 4.502 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -4.064 -12.301 2.888 1.00 0.00 H new ATOM 981 N ASN A 65 -9.395 -13.558 2.425 1.00 0.00 N ATOM 982 CA ASN A 65 -10.633 -13.981 3.067 1.00 0.00 C ATOM 983 C ASN A 65 -11.001 -15.404 2.656 1.00 0.00 C ATOM 984 O ASN A 65 -10.285 -16.042 1.885 1.00 0.00 O ATOM 985 CB ASN A 65 -11.772 -13.025 2.707 1.00 0.00 C ATOM 986 CG ASN A 65 -11.763 -12.641 1.240 1.00 0.00 C ATOM 987 OD1 ASN A 65 -12.483 -13.226 0.430 1.00 0.00 O ATOM 988 ND2 ASN A 65 -10.945 -11.655 0.891 1.00 0.00 N ATOM 0 H ASN A 65 -9.454 -13.473 1.410 1.00 0.00 H new ATOM 0 HA ASN A 65 -10.478 -13.961 4.146 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -12.726 -13.492 2.952 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -11.693 -12.124 3.316 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -10.895 -11.354 -0.082 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -10.366 -11.199 1.596 1.00 0.00 H new ATOM 995 N GLU A 66 -12.122 -15.894 3.177 1.00 0.00 N ATOM 996 CA GLU A 66 -12.584 -17.241 2.864 1.00 0.00 C ATOM 997 C GLU A 66 -12.547 -17.493 1.359 1.00 0.00 C ATOM 998 O GLU A 66 -12.327 -18.619 0.913 1.00 0.00 O ATOM 999 CB GLU A 66 -14.004 -17.453 3.393 1.00 0.00 C ATOM 1000 CG GLU A 66 -14.105 -17.386 4.908 1.00 0.00 C ATOM 1001 CD GLU A 66 -15.537 -17.261 5.392 1.00 0.00 C ATOM 1002 OE1 GLU A 66 -16.222 -16.303 4.977 1.00 0.00 O ATOM 1003 OE2 GLU A 66 -15.971 -18.121 6.186 1.00 0.00 O ATOM 0 H GLU A 66 -12.726 -15.379 3.817 1.00 0.00 H new ATOM 0 HA GLU A 66 -11.913 -17.950 3.350 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -14.661 -16.699 2.960 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -14.367 -18.424 3.056 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -13.657 -18.282 5.338 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -13.528 -16.535 5.270 1.00 0.00 H new ATOM 1010 N ASP A 67 -12.766 -16.437 0.583 1.00 0.00 N ATOM 1011 CA ASP A 67 -12.757 -16.542 -0.871 1.00 0.00 C ATOM 1012 C ASP A 67 -11.384 -16.191 -1.434 1.00 0.00 C ATOM 1013 O ASP A 67 -11.266 -15.727 -2.568 1.00 0.00 O ATOM 1014 CB ASP A 67 -13.820 -15.623 -1.476 1.00 0.00 C ATOM 1015 CG ASP A 67 -15.226 -16.021 -1.074 1.00 0.00 C ATOM 1016 OD1 ASP A 67 -15.536 -15.968 0.135 1.00 0.00 O ATOM 1017 OD2 ASP A 67 -16.018 -16.383 -1.969 1.00 0.00 O ATOM 0 H ASP A 67 -12.952 -15.499 0.937 1.00 0.00 H new ATOM 0 HA ASP A 67 -12.985 -17.574 -1.137 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -13.632 -14.597 -1.160 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -13.737 -15.642 -2.563 1.00 0.00 H new ATOM 1022 N ASP A 68 -10.347 -16.415 -0.633 1.00 0.00 N ATOM 1023 CA ASP A 68 -8.981 -16.123 -1.050 1.00 0.00 C ATOM 1024 C ASP A 68 -8.928 -14.844 -1.881 1.00 0.00 C ATOM 1025 O ASP A 68 -8.080 -14.697 -2.761 1.00 0.00 O ATOM 1026 CB ASP A 68 -8.410 -17.292 -1.855 1.00 0.00 C ATOM 1027 CG ASP A 68 -6.896 -17.346 -1.802 1.00 0.00 C ATOM 1028 OD1 ASP A 68 -6.354 -17.768 -0.759 1.00 0.00 O ATOM 1029 OD2 ASP A 68 -6.253 -16.965 -2.802 1.00 0.00 O ATOM 0 H ASP A 68 -10.427 -16.798 0.309 1.00 0.00 H new ATOM 0 HA ASP A 68 -8.377 -15.979 -0.154 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -8.818 -18.227 -1.471 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -8.732 -17.206 -2.893 1.00 0.00 H new ATOM 1034 N LYS A 69 -9.841 -13.922 -1.595 1.00 0.00 N ATOM 1035 CA LYS A 69 -9.900 -12.655 -2.315 1.00 0.00 C ATOM 1036 C LYS A 69 -9.057 -11.593 -1.615 1.00 0.00 C ATOM 1037 O LYS A 69 -8.763 -11.704 -0.425 1.00 0.00 O ATOM 1038 CB LYS A 69 -11.349 -12.177 -2.430 1.00 0.00 C ATOM 1039 CG LYS A 69 -12.132 -12.868 -3.533 1.00 0.00 C ATOM 1040 CD LYS A 69 -13.285 -12.008 -4.021 1.00 0.00 C ATOM 1041 CE LYS A 69 -14.397 -12.855 -4.621 1.00 0.00 C ATOM 1042 NZ LYS A 69 -15.570 -12.029 -5.020 1.00 0.00 N ATOM 0 H LYS A 69 -10.550 -14.028 -0.870 1.00 0.00 H new ATOM 0 HA LYS A 69 -9.496 -12.814 -3.315 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -11.854 -12.343 -1.479 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -11.355 -11.102 -2.610 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -11.467 -13.093 -4.367 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -12.517 -13.820 -3.166 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -13.680 -11.422 -3.191 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -12.922 -11.300 -4.767 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -14.017 -13.390 -5.491 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -14.712 -13.607 -3.897 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -16.306 -12.643 -5.424 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -15.949 -11.538 -4.185 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -15.276 -11.328 -5.730 1.00 0.00 H new ATOM 1056 N PHE A 70 -8.673 -10.563 -2.362 1.00 0.00 N ATOM 1057 CA PHE A 70 -7.864 -9.480 -1.813 1.00 0.00 C ATOM 1058 C PHE A 70 -8.746 -8.325 -1.349 1.00 0.00 C ATOM 1059 O PHE A 70 -9.392 -7.657 -2.157 1.00 0.00 O ATOM 1060 CB PHE A 70 -6.862 -8.984 -2.858 1.00 0.00 C ATOM 1061 CG PHE A 70 -5.809 -9.996 -3.207 1.00 0.00 C ATOM 1062 CD1 PHE A 70 -4.828 -10.339 -2.291 1.00 0.00 C ATOM 1063 CD2 PHE A 70 -5.801 -10.606 -4.451 1.00 0.00 C ATOM 1064 CE1 PHE A 70 -3.858 -11.270 -2.610 1.00 0.00 C ATOM 1065 CE2 PHE A 70 -4.833 -11.538 -4.776 1.00 0.00 C ATOM 1066 CZ PHE A 70 -3.861 -11.871 -3.853 1.00 0.00 C ATOM 0 H PHE A 70 -8.909 -10.455 -3.349 1.00 0.00 H new ATOM 0 HA PHE A 70 -7.319 -9.867 -0.952 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -7.401 -8.706 -3.763 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -6.378 -8.081 -2.485 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -4.821 -9.873 -1.317 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -6.560 -10.350 -5.175 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -3.098 -11.527 -1.887 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -4.837 -12.005 -5.750 1.00 0.00 H new ATOM 0 HZ PHE A 70 -3.105 -12.600 -4.103 1.00 0.00 H new ATOM 1076 N THR A 71 -8.768 -8.095 -0.039 1.00 0.00 N ATOM 1077 CA THR A 71 -9.571 -7.022 0.535 1.00 0.00 C ATOM 1078 C THR A 71 -8.757 -6.195 1.524 1.00 0.00 C ATOM 1079 O THR A 71 -8.037 -6.741 2.360 1.00 0.00 O ATOM 1080 CB THR A 71 -10.818 -7.575 1.249 1.00 0.00 C ATOM 1081 OG1 THR A 71 -11.486 -6.522 1.954 1.00 0.00 O ATOM 1082 CG2 THR A 71 -10.439 -8.681 2.222 1.00 0.00 C ATOM 0 H THR A 71 -8.239 -8.637 0.644 1.00 0.00 H new ATOM 0 HA THR A 71 -9.887 -6.386 -0.292 1.00 0.00 H new ATOM 0 HB THR A 71 -11.487 -7.989 0.495 1.00 0.00 H new ATOM 0 HG1 THR A 71 -12.279 -6.881 2.404 1.00 0.00 H new ATOM 0 HG21 THR A 71 -11.336 -9.056 2.714 1.00 0.00 H new ATOM 0 HG22 THR A 71 -9.957 -9.494 1.679 1.00 0.00 H new ATOM 0 HG23 THR A 71 -9.752 -8.287 2.971 1.00 0.00 H new ATOM 1090 N VAL A 72 -8.876 -4.875 1.423 1.00 0.00 N ATOM 1091 CA VAL A 72 -8.152 -3.972 2.310 1.00 0.00 C ATOM 1092 C VAL A 72 -8.819 -3.896 3.679 1.00 0.00 C ATOM 1093 O VAL A 72 -10.033 -4.059 3.798 1.00 0.00 O ATOM 1094 CB VAL A 72 -8.062 -2.554 1.716 1.00 0.00 C ATOM 1095 CG1 VAL A 72 -7.111 -1.693 2.533 1.00 0.00 C ATOM 1096 CG2 VAL A 72 -7.623 -2.614 0.260 1.00 0.00 C ATOM 0 H VAL A 72 -9.467 -4.407 0.736 1.00 0.00 H new ATOM 0 HA VAL A 72 -7.146 -4.376 2.421 1.00 0.00 H new ATOM 0 HB VAL A 72 -9.051 -2.098 1.755 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -7.060 -0.695 2.099 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -7.473 -1.624 3.559 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -6.118 -2.142 2.528 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -7.565 -1.603 -0.144 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -6.644 -3.088 0.194 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -8.346 -3.193 -0.314 1.00 0.00 H new ATOM 1106 N GLN A 73 -8.016 -3.647 4.709 1.00 0.00 N ATOM 1107 CA GLN A 73 -8.529 -3.550 6.070 1.00 0.00 C ATOM 1108 C GLN A 73 -8.354 -2.137 6.618 1.00 0.00 C ATOM 1109 O GLN A 73 -7.520 -1.898 7.490 1.00 0.00 O ATOM 1110 CB GLN A 73 -7.818 -4.554 6.979 1.00 0.00 C ATOM 1111 CG GLN A 73 -8.119 -6.004 6.637 1.00 0.00 C ATOM 1112 CD GLN A 73 -7.776 -6.954 7.768 1.00 0.00 C ATOM 1113 OE1 GLN A 73 -6.874 -6.690 8.563 1.00 0.00 O ATOM 1114 NE2 GLN A 73 -8.497 -8.066 7.846 1.00 0.00 N ATOM 0 H GLN A 73 -7.009 -3.509 4.627 1.00 0.00 H new ATOM 0 HA GLN A 73 -9.594 -3.782 6.047 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -6.742 -4.390 6.916 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -8.109 -4.365 8.012 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -9.176 -6.104 6.392 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -7.558 -6.287 5.747 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -9.235 -8.244 7.165 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -8.313 -8.742 8.587 1.00 0.00 H new ATOM 1123 N ALA A 74 -9.147 -1.205 6.100 1.00 0.00 N ATOM 1124 CA ALA A 74 -9.081 0.184 6.538 1.00 0.00 C ATOM 1125 C ALA A 74 -9.849 0.386 7.839 1.00 0.00 C ATOM 1126 O ALA A 74 -9.263 0.702 8.875 1.00 0.00 O ATOM 1127 CB ALA A 74 -9.621 1.106 5.455 1.00 0.00 C ATOM 0 H ALA A 74 -9.843 -1.387 5.377 1.00 0.00 H new ATOM 0 HA ALA A 74 -8.036 0.432 6.722 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -9.565 2.140 5.796 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -9.026 0.990 4.549 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -10.659 0.849 5.243 1.00 0.00 H new ATOM 1133 N SER A 75 -11.164 0.202 7.780 1.00 0.00 N ATOM 1134 CA SER A 75 -12.014 0.369 8.953 1.00 0.00 C ATOM 1135 C SER A 75 -12.081 -0.923 9.763 1.00 0.00 C ATOM 1136 O SER A 75 -11.449 -1.919 9.415 1.00 0.00 O ATOM 1137 CB SER A 75 -13.422 0.795 8.533 1.00 0.00 C ATOM 1138 OG SER A 75 -13.404 2.063 7.901 1.00 0.00 O ATOM 0 H SER A 75 -11.664 -0.063 6.932 1.00 0.00 H new ATOM 0 HA SER A 75 -11.579 1.148 9.579 1.00 0.00 H new ATOM 0 HB2 SER A 75 -13.843 0.053 7.854 1.00 0.00 H new ATOM 0 HB3 SER A 75 -14.071 0.831 9.408 1.00 0.00 H new ATOM 0 HG SER A 75 -14.315 2.312 7.641 1.00 0.00 H new ATOM 1144 N GLU A 76 -12.853 -0.896 10.845 1.00 0.00 N ATOM 1145 CA GLU A 76 -13.003 -2.064 11.705 1.00 0.00 C ATOM 1146 C GLU A 76 -14.079 -3.002 11.166 1.00 0.00 C ATOM 1147 O GLU A 76 -15.021 -3.355 11.874 1.00 0.00 O ATOM 1148 CB GLU A 76 -13.353 -1.633 13.131 1.00 0.00 C ATOM 1149 CG GLU A 76 -13.332 -2.774 14.133 1.00 0.00 C ATOM 1150 CD GLU A 76 -14.180 -2.490 15.358 1.00 0.00 C ATOM 1151 OE1 GLU A 76 -15.394 -2.247 15.197 1.00 0.00 O ATOM 1152 OE2 GLU A 76 -13.629 -2.513 16.479 1.00 0.00 O ATOM 0 H GLU A 76 -13.384 -0.079 11.147 1.00 0.00 H new ATOM 0 HA GLU A 76 -12.053 -2.599 11.718 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -12.649 -0.865 13.453 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -14.344 -1.178 13.131 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -13.690 -3.683 13.650 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -12.304 -2.962 14.443 1.00 0.00 H new ATOM 1159 N GLY A 77 -13.932 -3.401 9.906 1.00 0.00 N ATOM 1160 CA GLY A 77 -14.898 -4.293 9.293 1.00 0.00 C ATOM 1161 C GLY A 77 -16.211 -3.602 8.983 1.00 0.00 C ATOM 1162 O GLY A 77 -17.071 -3.469 9.853 1.00 0.00 O ATOM 0 H GLY A 77 -13.161 -3.122 9.299 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -14.479 -4.700 8.373 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -15.083 -5.136 9.959 1.00 0.00 H new ATOM 1166 N VAL A 78 -16.365 -3.158 7.739 1.00 0.00 N ATOM 1167 CA VAL A 78 -17.582 -2.476 7.317 1.00 0.00 C ATOM 1168 C VAL A 78 -17.769 -2.570 5.807 1.00 0.00 C ATOM 1169 O VAL A 78 -16.922 -2.117 5.036 1.00 0.00 O ATOM 1170 CB VAL A 78 -17.565 -0.992 7.729 1.00 0.00 C ATOM 1171 CG1 VAL A 78 -16.184 -0.393 7.513 1.00 0.00 C ATOM 1172 CG2 VAL A 78 -18.620 -0.213 6.957 1.00 0.00 C ATOM 0 H VAL A 78 -15.662 -3.259 7.007 1.00 0.00 H new ATOM 0 HA VAL A 78 -18.413 -2.975 7.815 1.00 0.00 H new ATOM 0 HB VAL A 78 -17.801 -0.925 8.791 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -16.192 0.656 7.810 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -15.454 -0.935 8.115 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -15.915 -0.470 6.460 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -18.594 0.834 7.260 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -18.417 -0.286 5.889 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -19.606 -0.628 7.168 1.00 0.00 H new ATOM 1182 N SER A 79 -18.884 -3.162 5.390 1.00 0.00 N ATOM 1183 CA SER A 79 -19.181 -3.319 3.971 1.00 0.00 C ATOM 1184 C SER A 79 -17.920 -3.670 3.187 1.00 0.00 C ATOM 1185 O SER A 79 -17.778 -3.303 2.021 1.00 0.00 O ATOM 1186 CB SER A 79 -19.802 -2.037 3.413 1.00 0.00 C ATOM 1187 OG SER A 79 -21.137 -1.880 3.861 1.00 0.00 O ATOM 0 H SER A 79 -19.596 -3.541 6.014 1.00 0.00 H new ATOM 0 HA SER A 79 -19.894 -4.136 3.863 1.00 0.00 H new ATOM 0 HB2 SER A 79 -19.208 -1.177 3.722 1.00 0.00 H new ATOM 0 HB3 SER A 79 -19.781 -2.064 2.324 1.00 0.00 H new ATOM 0 HG SER A 79 -21.511 -1.053 3.492 1.00 0.00 H new ATOM 1193 N MET A 80 -17.006 -4.383 3.837 1.00 0.00 N ATOM 1194 CA MET A 80 -15.757 -4.785 3.202 1.00 0.00 C ATOM 1195 C MET A 80 -16.019 -5.414 1.837 1.00 0.00 C ATOM 1196 O MET A 80 -16.412 -6.577 1.744 1.00 0.00 O ATOM 1197 CB MET A 80 -15.000 -5.771 4.094 1.00 0.00 C ATOM 1198 CG MET A 80 -14.421 -5.136 5.347 1.00 0.00 C ATOM 1199 SD MET A 80 -12.954 -5.995 5.948 1.00 0.00 S ATOM 1200 CE MET A 80 -13.509 -7.697 5.885 1.00 0.00 C ATOM 0 H MET A 80 -17.107 -4.694 4.803 1.00 0.00 H new ATOM 0 HA MET A 80 -15.147 -3.893 3.060 1.00 0.00 H new ATOM 0 HB2 MET A 80 -15.674 -6.577 4.383 1.00 0.00 H new ATOM 0 HB3 MET A 80 -14.192 -6.222 3.518 1.00 0.00 H new ATOM 0 HG2 MET A 80 -14.169 -4.096 5.139 1.00 0.00 H new ATOM 0 HG3 MET A 80 -15.179 -5.129 6.130 1.00 0.00 H new ATOM 0 HE1 MET A 80 -12.851 -8.317 6.494 1.00 0.00 H new ATOM 0 HE2 MET A 80 -14.527 -7.762 6.269 1.00 0.00 H new ATOM 0 HE3 MET A 80 -13.487 -8.049 4.854 1.00 0.00 H new ATOM 1210 N ARG A 81 -15.798 -4.638 0.781 1.00 0.00 N ATOM 1211 CA ARG A 81 -16.012 -5.119 -0.579 1.00 0.00 C ATOM 1212 C ARG A 81 -14.891 -6.063 -1.005 1.00 0.00 C ATOM 1213 O ARG A 81 -13.744 -5.647 -1.167 1.00 0.00 O ATOM 1214 CB ARG A 81 -16.099 -3.942 -1.552 1.00 0.00 C ATOM 1215 CG ARG A 81 -17.468 -3.281 -1.588 1.00 0.00 C ATOM 1216 CD ARG A 81 -17.755 -2.669 -2.950 1.00 0.00 C ATOM 1217 NE ARG A 81 -18.818 -1.669 -2.887 1.00 0.00 N ATOM 1218 CZ ARG A 81 -19.520 -1.275 -3.944 1.00 0.00 C ATOM 1219 NH1 ARG A 81 -19.274 -1.795 -5.138 1.00 0.00 N ATOM 1220 NH2 ARG A 81 -20.471 -0.360 -3.806 1.00 0.00 N ATOM 0 H ARG A 81 -15.471 -3.674 0.841 1.00 0.00 H new ATOM 0 HA ARG A 81 -16.953 -5.668 -0.599 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -15.353 -3.197 -1.276 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -15.847 -4.290 -2.554 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -18.235 -4.018 -1.350 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -17.520 -2.507 -0.822 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -16.847 -2.209 -3.339 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -18.038 -3.456 -3.649 1.00 0.00 H new ATOM 0 HE ARG A 81 -19.033 -1.250 -1.982 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -18.544 -2.499 -5.247 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -19.814 -1.491 -5.948 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -20.663 0.041 -2.888 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -21.010 -0.058 -4.618 1.00 0.00 H new ATOM 1234 N PHE A 82 -15.231 -7.335 -1.183 1.00 0.00 N ATOM 1235 CA PHE A 82 -14.253 -8.338 -1.588 1.00 0.00 C ATOM 1236 C PHE A 82 -14.008 -8.282 -3.093 1.00 0.00 C ATOM 1237 O PHE A 82 -14.939 -8.403 -3.890 1.00 0.00 O ATOM 1238 CB PHE A 82 -14.730 -9.736 -1.190 1.00 0.00 C ATOM 1239 CG PHE A 82 -15.095 -9.853 0.263 1.00 0.00 C ATOM 1240 CD1 PHE A 82 -14.110 -9.934 1.234 1.00 0.00 C ATOM 1241 CD2 PHE A 82 -16.423 -9.883 0.656 1.00 0.00 C ATOM 1242 CE1 PHE A 82 -14.443 -10.041 2.571 1.00 0.00 C ATOM 1243 CE2 PHE A 82 -16.762 -9.990 1.992 1.00 0.00 C ATOM 1244 CZ PHE A 82 -15.770 -10.071 2.951 1.00 0.00 C ATOM 0 H PHE A 82 -16.176 -7.696 -1.053 1.00 0.00 H new ATOM 0 HA PHE A 82 -13.315 -8.122 -1.076 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -15.596 -10.002 -1.797 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -13.946 -10.458 -1.419 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -13.070 -9.913 0.943 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -17.202 -9.822 -0.089 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -13.666 -10.101 3.318 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -17.801 -10.010 2.286 1.00 0.00 H new ATOM 0 HZ PHE A 82 -16.032 -10.158 3.995 1.00 0.00 H new ATOM 1254 N PHE A 83 -12.749 -8.096 -3.475 1.00 0.00 N ATOM 1255 CA PHE A 83 -12.380 -8.022 -4.885 1.00 0.00 C ATOM 1256 C PHE A 83 -11.568 -9.245 -5.299 1.00 0.00 C ATOM 1257 O PHE A 83 -10.825 -9.814 -4.497 1.00 0.00 O ATOM 1258 CB PHE A 83 -11.580 -6.747 -5.158 1.00 0.00 C ATOM 1259 CG PHE A 83 -12.324 -5.488 -4.816 1.00 0.00 C ATOM 1260 CD1 PHE A 83 -12.272 -4.963 -3.535 1.00 0.00 C ATOM 1261 CD2 PHE A 83 -13.075 -4.829 -5.776 1.00 0.00 C ATOM 1262 CE1 PHE A 83 -12.955 -3.804 -3.217 1.00 0.00 C ATOM 1263 CE2 PHE A 83 -13.759 -3.670 -5.465 1.00 0.00 C ATOM 1264 CZ PHE A 83 -13.700 -3.157 -4.183 1.00 0.00 C ATOM 0 H PHE A 83 -11.967 -7.994 -2.829 1.00 0.00 H new ATOM 0 HA PHE A 83 -13.296 -8.000 -5.475 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -10.654 -6.779 -4.585 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -11.302 -6.721 -6.212 1.00 0.00 H new ATOM 0 HD1 PHE A 83 -11.691 -5.465 -2.776 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -13.126 -5.226 -6.779 1.00 0.00 H new ATOM 0 HE1 PHE A 83 -12.906 -3.405 -2.215 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -14.339 -3.165 -6.223 1.00 0.00 H new ATOM 0 HZ PHE A 83 -14.236 -2.252 -3.937 1.00 0.00 H new ATOM 1274 N THR A 84 -11.714 -9.647 -6.558 1.00 0.00 N ATOM 1275 CA THR A 84 -10.995 -10.803 -7.080 1.00 0.00 C ATOM 1276 C THR A 84 -9.588 -10.421 -7.525 1.00 0.00 C ATOM 1277 O THR A 84 -8.601 -10.982 -7.048 1.00 0.00 O ATOM 1278 CB THR A 84 -11.742 -11.438 -8.268 1.00 0.00 C ATOM 1279 OG1 THR A 84 -13.105 -11.693 -7.910 1.00 0.00 O ATOM 1280 CG2 THR A 84 -11.073 -12.736 -8.695 1.00 0.00 C ATOM 0 H THR A 84 -12.324 -9.189 -7.235 1.00 0.00 H new ATOM 0 HA THR A 84 -10.932 -11.529 -6.269 1.00 0.00 H new ATOM 0 HB THR A 84 -11.711 -10.739 -9.104 1.00 0.00 H new ATOM 0 HG1 THR A 84 -13.573 -12.095 -8.671 1.00 0.00 H new ATOM 0 HG21 THR A 84 -11.618 -13.167 -9.535 1.00 0.00 H new ATOM 0 HG22 THR A 84 -10.045 -12.534 -8.994 1.00 0.00 H new ATOM 0 HG23 THR A 84 -11.077 -13.439 -7.862 1.00 0.00 H new ATOM 1288 N LYS A 85 -9.502 -9.462 -8.440 1.00 0.00 N ATOM 1289 CA LYS A 85 -8.215 -9.003 -8.949 1.00 0.00 C ATOM 1290 C LYS A 85 -7.664 -7.868 -8.091 1.00 0.00 C ATOM 1291 O LYS A 85 -8.423 -7.073 -7.535 1.00 0.00 O ATOM 1292 CB LYS A 85 -8.353 -8.538 -10.400 1.00 0.00 C ATOM 1293 CG LYS A 85 -9.055 -9.544 -11.296 1.00 0.00 C ATOM 1294 CD LYS A 85 -8.711 -9.322 -12.760 1.00 0.00 C ATOM 1295 CE LYS A 85 -9.688 -10.042 -13.677 1.00 0.00 C ATOM 1296 NZ LYS A 85 -9.769 -9.397 -15.017 1.00 0.00 N ATOM 0 H LYS A 85 -10.309 -8.987 -8.845 1.00 0.00 H new ATOM 0 HA LYS A 85 -7.517 -9.839 -8.907 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -8.905 -7.598 -10.421 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -7.361 -8.334 -10.804 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -8.770 -10.555 -11.003 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -10.133 -9.465 -11.159 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -8.723 -8.254 -12.980 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -7.699 -9.676 -12.955 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -9.380 -11.081 -13.792 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -10.677 -10.052 -13.218 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -10.445 -9.917 -15.612 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -10.088 -8.413 -14.910 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -8.831 -9.410 -15.466 1.00 0.00 H new ATOM 1310 N LEU A 86 -6.342 -7.797 -7.989 1.00 0.00 N ATOM 1311 CA LEU A 86 -5.690 -6.758 -7.200 1.00 0.00 C ATOM 1312 C LEU A 86 -5.945 -5.379 -7.799 1.00 0.00 C ATOM 1313 O LEU A 86 -6.396 -4.465 -7.107 1.00 0.00 O ATOM 1314 CB LEU A 86 -4.185 -7.021 -7.119 1.00 0.00 C ATOM 1315 CG LEU A 86 -3.485 -6.529 -5.851 1.00 0.00 C ATOM 1316 CD1 LEU A 86 -4.021 -5.167 -5.440 1.00 0.00 C ATOM 1317 CD2 LEU A 86 -3.658 -7.536 -4.722 1.00 0.00 C ATOM 0 H LEU A 86 -5.700 -8.447 -8.443 1.00 0.00 H new ATOM 0 HA LEU A 86 -6.111 -6.781 -6.195 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -4.019 -8.094 -7.209 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -3.708 -6.552 -7.979 1.00 0.00 H new ATOM 0 HG LEU A 86 -2.420 -6.429 -6.062 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -3.511 -4.833 -4.536 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -3.845 -4.450 -6.242 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -5.091 -5.240 -5.247 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -3.154 -7.170 -3.828 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -4.719 -7.668 -4.512 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -3.225 -8.492 -5.017 1.00 0.00 H new ATOM 1329 N ASP A 87 -5.657 -5.236 -9.087 1.00 0.00 N ATOM 1330 CA ASP A 87 -5.859 -3.969 -9.781 1.00 0.00 C ATOM 1331 C ASP A 87 -7.296 -3.484 -9.618 1.00 0.00 C ATOM 1332 O ASP A 87 -7.534 -2.352 -9.199 1.00 0.00 O ATOM 1333 CB ASP A 87 -5.522 -4.117 -11.265 1.00 0.00 C ATOM 1334 CG ASP A 87 -6.079 -2.981 -12.101 1.00 0.00 C ATOM 1335 OD1 ASP A 87 -5.798 -1.810 -11.773 1.00 0.00 O ATOM 1336 OD2 ASP A 87 -6.798 -3.264 -13.083 1.00 0.00 O ATOM 0 H ASP A 87 -5.282 -5.982 -9.673 1.00 0.00 H new ATOM 0 HA ASP A 87 -5.193 -3.229 -9.338 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -4.440 -4.157 -11.387 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -5.919 -5.063 -11.632 1.00 0.00 H new ATOM 1341 N GLN A 88 -8.248 -4.348 -9.954 1.00 0.00 N ATOM 1342 CA GLN A 88 -9.662 -4.005 -9.847 1.00 0.00 C ATOM 1343 C GLN A 88 -9.959 -3.334 -8.510 1.00 0.00 C ATOM 1344 O GLN A 88 -10.704 -2.355 -8.447 1.00 0.00 O ATOM 1345 CB GLN A 88 -10.525 -5.258 -10.006 1.00 0.00 C ATOM 1346 CG GLN A 88 -10.639 -5.740 -11.443 1.00 0.00 C ATOM 1347 CD GLN A 88 -11.091 -4.647 -12.391 1.00 0.00 C ATOM 1348 OE1 GLN A 88 -10.340 -4.219 -13.268 1.00 0.00 O ATOM 1349 NE2 GLN A 88 -12.325 -4.187 -12.220 1.00 0.00 N ATOM 0 H GLN A 88 -8.067 -5.289 -10.302 1.00 0.00 H new ATOM 0 HA GLN A 88 -9.902 -3.303 -10.646 1.00 0.00 H new ATOM 0 HB2 GLN A 88 -10.106 -6.058 -9.396 1.00 0.00 H new ATOM 0 HB3 GLN A 88 -11.524 -5.053 -9.620 1.00 0.00 H new ATOM 0 HG2 GLN A 88 -9.673 -6.124 -11.771 1.00 0.00 H new ATOM 0 HG3 GLN A 88 -11.344 -6.570 -11.489 1.00 0.00 H new ATOM 0 HE21 GLN A 88 -12.914 -4.570 -11.481 1.00 0.00 H new ATOM 0 HE22 GLN A 88 -12.684 -3.451 -12.828 1.00 0.00 H new ATOM 1358 N LEU A 89 -9.373 -3.866 -7.443 1.00 0.00 N ATOM 1359 CA LEU A 89 -9.575 -3.319 -6.106 1.00 0.00 C ATOM 1360 C LEU A 89 -9.020 -1.902 -6.008 1.00 0.00 C ATOM 1361 O LEU A 89 -9.693 -0.993 -5.520 1.00 0.00 O ATOM 1362 CB LEU A 89 -8.908 -4.214 -5.061 1.00 0.00 C ATOM 1363 CG LEU A 89 -8.773 -3.622 -3.658 1.00 0.00 C ATOM 1364 CD1 LEU A 89 -8.814 -4.721 -2.608 1.00 0.00 C ATOM 1365 CD2 LEU A 89 -7.487 -2.817 -3.540 1.00 0.00 C ATOM 0 H LEU A 89 -8.754 -4.676 -7.478 1.00 0.00 H new ATOM 0 HA LEU A 89 -10.647 -3.283 -5.913 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -9.477 -5.141 -4.989 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -7.913 -4.478 -5.420 1.00 0.00 H new ATOM 0 HG LEU A 89 -9.615 -2.952 -3.485 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -8.716 -4.280 -1.616 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -9.762 -5.254 -2.676 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -7.993 -5.417 -2.778 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -7.408 -2.403 -2.535 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -6.633 -3.466 -3.734 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -7.498 -2.005 -4.267 1.00 0.00 H new ATOM 1377 N ILE A 90 -7.790 -1.720 -6.476 1.00 0.00 N ATOM 1378 CA ILE A 90 -7.146 -0.413 -6.444 1.00 0.00 C ATOM 1379 C ILE A 90 -7.923 0.603 -7.275 1.00 0.00 C ATOM 1380 O ILE A 90 -8.066 1.760 -6.882 1.00 0.00 O ATOM 1381 CB ILE A 90 -5.698 -0.486 -6.964 1.00 0.00 C ATOM 1382 CG1 ILE A 90 -4.884 -1.480 -6.133 1.00 0.00 C ATOM 1383 CG2 ILE A 90 -5.054 0.892 -6.932 1.00 0.00 C ATOM 1384 CD1 ILE A 90 -4.619 -1.011 -4.720 1.00 0.00 C ATOM 0 H ILE A 90 -7.219 -2.462 -6.882 1.00 0.00 H new ATOM 0 HA ILE A 90 -7.133 -0.093 -5.402 1.00 0.00 H new ATOM 0 HB ILE A 90 -5.715 -0.834 -7.997 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -5.414 -2.432 -6.098 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -3.932 -1.664 -6.631 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -4.031 0.824 -7.302 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -5.624 1.575 -7.563 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -5.045 1.266 -5.908 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -4.037 -1.765 -4.189 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -4.062 -0.075 -4.746 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -5.567 -0.855 -4.205 1.00 0.00 H new ATOM 1396 N GLU A 91 -8.423 0.160 -8.424 1.00 0.00 N ATOM 1397 CA GLU A 91 -9.186 1.032 -9.310 1.00 0.00 C ATOM 1398 C GLU A 91 -10.465 1.513 -8.630 1.00 0.00 C ATOM 1399 O GLU A 91 -10.901 2.646 -8.835 1.00 0.00 O ATOM 1400 CB GLU A 91 -9.531 0.300 -10.609 1.00 0.00 C ATOM 1401 CG GLU A 91 -8.315 -0.057 -11.447 1.00 0.00 C ATOM 1402 CD GLU A 91 -8.658 -0.280 -12.907 1.00 0.00 C ATOM 1403 OE1 GLU A 91 -9.737 -0.845 -13.183 1.00 0.00 O ATOM 1404 OE2 GLU A 91 -7.848 0.110 -13.774 1.00 0.00 O ATOM 0 H GLU A 91 -8.314 -0.796 -8.763 1.00 0.00 H new ATOM 0 HA GLU A 91 -8.570 1.900 -9.543 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -10.077 -0.612 -10.368 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -10.200 0.924 -11.202 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -7.577 0.742 -11.369 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -7.853 -0.958 -11.044 1.00 0.00 H new ATOM 1411 N PHE A 92 -11.061 0.644 -7.821 1.00 0.00 N ATOM 1412 CA PHE A 92 -12.291 0.979 -7.112 1.00 0.00 C ATOM 1413 C PHE A 92 -12.027 2.021 -6.030 1.00 0.00 C ATOM 1414 O PHE A 92 -12.917 2.790 -5.663 1.00 0.00 O ATOM 1415 CB PHE A 92 -12.903 -0.277 -6.488 1.00 0.00 C ATOM 1416 CG PHE A 92 -13.956 0.017 -5.459 1.00 0.00 C ATOM 1417 CD1 PHE A 92 -13.603 0.448 -4.191 1.00 0.00 C ATOM 1418 CD2 PHE A 92 -15.300 -0.137 -5.760 1.00 0.00 C ATOM 1419 CE1 PHE A 92 -14.571 0.719 -3.242 1.00 0.00 C ATOM 1420 CE2 PHE A 92 -16.272 0.133 -4.816 1.00 0.00 C ATOM 1421 CZ PHE A 92 -15.907 0.562 -3.555 1.00 0.00 C ATOM 0 H PHE A 92 -10.713 -0.297 -7.640 1.00 0.00 H new ATOM 0 HA PHE A 92 -12.994 1.398 -7.832 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -13.339 -0.890 -7.277 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -12.111 -0.867 -6.027 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -12.560 0.574 -3.941 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -15.591 -0.472 -6.745 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -14.283 1.053 -2.256 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -17.316 0.009 -5.064 1.00 0.00 H new ATOM 0 HZ PHE A 92 -16.665 0.774 -2.815 1.00 0.00 H new ATOM 1431 N TYR A 93 -10.800 2.041 -5.522 1.00 0.00 N ATOM 1432 CA TYR A 93 -10.420 2.986 -4.479 1.00 0.00 C ATOM 1433 C TYR A 93 -9.969 4.312 -5.084 1.00 0.00 C ATOM 1434 O TYR A 93 -9.684 5.271 -4.367 1.00 0.00 O ATOM 1435 CB TYR A 93 -9.301 2.401 -3.614 1.00 0.00 C ATOM 1436 CG TYR A 93 -9.803 1.545 -2.474 1.00 0.00 C ATOM 1437 CD1 TYR A 93 -10.418 0.323 -2.715 1.00 0.00 C ATOM 1438 CD2 TYR A 93 -9.661 1.958 -1.155 1.00 0.00 C ATOM 1439 CE1 TYR A 93 -10.879 -0.463 -1.676 1.00 0.00 C ATOM 1440 CE2 TYR A 93 -10.117 1.178 -0.109 1.00 0.00 C ATOM 1441 CZ TYR A 93 -10.726 -0.031 -0.375 1.00 0.00 C ATOM 1442 OH TYR A 93 -11.182 -0.811 0.663 1.00 0.00 O ATOM 0 H TYR A 93 -10.051 1.413 -5.816 1.00 0.00 H new ATOM 0 HA TYR A 93 -11.294 3.170 -3.855 1.00 0.00 H new ATOM 0 HB2 TYR A 93 -8.641 1.803 -4.243 1.00 0.00 H new ATOM 0 HB3 TYR A 93 -8.702 3.217 -3.209 1.00 0.00 H new ATOM 0 HD1 TYR A 93 -10.538 -0.019 -3.732 1.00 0.00 H new ATOM 0 HD2 TYR A 93 -9.186 2.905 -0.943 1.00 0.00 H new ATOM 0 HE1 TYR A 93 -11.356 -1.410 -1.881 1.00 0.00 H new ATOM 0 HE2 TYR A 93 -9.997 1.513 0.911 1.00 0.00 H new ATOM 0 HH TYR A 93 -10.996 -0.363 1.515 1.00 0.00 H new ATOM 1452 N LYS A 94 -9.908 4.359 -6.411 1.00 0.00 N ATOM 1453 CA LYS A 94 -9.494 5.567 -7.116 1.00 0.00 C ATOM 1454 C LYS A 94 -10.472 6.709 -6.858 1.00 0.00 C ATOM 1455 O LYS A 94 -10.081 7.876 -6.809 1.00 0.00 O ATOM 1456 CB LYS A 94 -9.395 5.296 -8.619 1.00 0.00 C ATOM 1457 CG LYS A 94 -8.346 4.259 -8.982 1.00 0.00 C ATOM 1458 CD LYS A 94 -6.954 4.866 -9.027 1.00 0.00 C ATOM 1459 CE LYS A 94 -6.047 4.109 -9.985 1.00 0.00 C ATOM 1460 NZ LYS A 94 -4.949 4.970 -10.506 1.00 0.00 N ATOM 0 H LYS A 94 -10.140 3.574 -7.020 1.00 0.00 H new ATOM 0 HA LYS A 94 -8.514 5.860 -6.740 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -10.366 4.962 -8.984 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -9.165 6.229 -9.134 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -8.367 3.448 -8.254 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -8.585 3.822 -9.952 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -7.021 5.909 -9.335 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -6.519 4.856 -8.028 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -5.620 3.245 -9.475 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -6.637 3.728 -10.819 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -4.353 4.418 -11.155 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -5.355 5.781 -11.014 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -4.371 5.313 -9.713 1.00 0.00 H new ATOM 1474 N LYS A 95 -11.745 6.366 -6.692 1.00 0.00 N ATOM 1475 CA LYS A 95 -12.779 7.362 -6.437 1.00 0.00 C ATOM 1476 C LYS A 95 -12.374 8.284 -5.291 1.00 0.00 C ATOM 1477 O LYS A 95 -11.570 7.912 -4.438 1.00 0.00 O ATOM 1478 CB LYS A 95 -14.107 6.676 -6.108 1.00 0.00 C ATOM 1479 CG LYS A 95 -14.969 6.405 -7.329 1.00 0.00 C ATOM 1480 CD LYS A 95 -16.272 5.721 -6.950 1.00 0.00 C ATOM 1481 CE LYS A 95 -16.118 4.208 -6.915 1.00 0.00 C ATOM 1482 NZ LYS A 95 -17.423 3.513 -7.094 1.00 0.00 N ATOM 0 H LYS A 95 -12.085 5.405 -6.730 1.00 0.00 H new ATOM 0 HA LYS A 95 -12.901 7.962 -7.339 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -13.904 5.733 -5.600 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -14.666 7.300 -5.410 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -15.185 7.344 -7.839 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -14.419 5.779 -8.032 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -16.600 6.077 -5.973 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -17.048 5.992 -7.666 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -15.429 3.895 -7.700 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -15.675 3.910 -5.965 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -17.275 2.484 -7.064 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -18.072 3.792 -6.331 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -17.834 3.777 -8.012 1.00 0.00 H new ATOM 1496 N GLU A 96 -12.939 9.488 -5.279 1.00 0.00 N ATOM 1497 CA GLU A 96 -12.636 10.462 -4.237 1.00 0.00 C ATOM 1498 C GLU A 96 -12.997 9.914 -2.859 1.00 0.00 C ATOM 1499 O GLU A 96 -14.041 9.289 -2.681 1.00 0.00 O ATOM 1500 CB GLU A 96 -13.393 11.767 -4.493 1.00 0.00 C ATOM 1501 CG GLU A 96 -12.580 12.803 -5.251 1.00 0.00 C ATOM 1502 CD GLU A 96 -13.351 14.086 -5.493 1.00 0.00 C ATOM 1503 OE1 GLU A 96 -13.337 14.964 -4.605 1.00 0.00 O ATOM 1504 OE2 GLU A 96 -13.967 14.213 -6.572 1.00 0.00 O ATOM 0 H GLU A 96 -13.608 9.811 -5.978 1.00 0.00 H new ATOM 0 HA GLU A 96 -11.565 10.661 -4.261 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -14.300 11.547 -5.056 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -13.705 12.190 -3.538 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -11.673 13.029 -4.690 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -12.268 12.385 -6.208 1.00 0.00 H new ATOM 1511 N ASN A 97 -12.123 10.154 -1.886 1.00 0.00 N ATOM 1512 CA ASN A 97 -12.348 9.685 -0.524 1.00 0.00 C ATOM 1513 C ASN A 97 -13.051 8.330 -0.524 1.00 0.00 C ATOM 1514 O ASN A 97 -13.823 8.020 0.382 1.00 0.00 O ATOM 1515 CB ASN A 97 -13.180 10.703 0.258 1.00 0.00 C ATOM 1516 CG ASN A 97 -14.668 10.423 0.171 1.00 0.00 C ATOM 1517 OD1 ASN A 97 -15.276 10.798 -0.948 1.00 0.00 O flip ATOM 1518 ND2 ASN A 97 -15.263 9.876 1.100 1.00 0.00 N flip ATOM 0 H ASN A 97 -11.253 10.670 -2.016 1.00 0.00 H new ATOM 0 HA ASN A 97 -11.377 9.571 -0.041 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -12.872 10.693 1.303 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -12.978 11.704 -0.125 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -14.755 9.605 1.942 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -16.264 9.694 1.028 1.00 0.00 H new ATOM 1525 N MET A 98 -12.777 7.528 -1.548 1.00 0.00 N ATOM 1526 CA MET A 98 -13.382 6.206 -1.665 1.00 0.00 C ATOM 1527 C MET A 98 -12.604 5.179 -0.849 1.00 0.00 C ATOM 1528 O MET A 98 -11.906 4.331 -1.404 1.00 0.00 O ATOM 1529 CB MET A 98 -13.435 5.775 -3.132 1.00 0.00 C ATOM 1530 CG MET A 98 -14.443 4.670 -3.404 1.00 0.00 C ATOM 1531 SD MET A 98 -16.142 5.274 -3.445 1.00 0.00 S ATOM 1532 CE MET A 98 -16.972 4.013 -2.480 1.00 0.00 C ATOM 0 H MET A 98 -12.141 7.770 -2.308 1.00 0.00 H new ATOM 0 HA MET A 98 -14.398 6.262 -1.273 1.00 0.00 H new ATOM 0 HB2 MET A 98 -13.681 6.640 -3.748 1.00 0.00 H new ATOM 0 HB3 MET A 98 -12.445 5.437 -3.439 1.00 0.00 H new ATOM 0 HG2 MET A 98 -14.207 4.195 -4.356 1.00 0.00 H new ATOM 0 HG3 MET A 98 -14.352 3.903 -2.634 1.00 0.00 H new ATOM 0 HE1 MET A 98 -17.938 4.390 -2.143 1.00 0.00 H new ATOM 0 HE2 MET A 98 -17.123 3.125 -3.094 1.00 0.00 H new ATOM 0 HE3 MET A 98 -16.361 3.756 -1.615 1.00 0.00 H new ATOM 1542 N GLY A 99 -12.730 5.260 0.472 1.00 0.00 N ATOM 1543 CA GLY A 99 -12.033 4.332 1.342 1.00 0.00 C ATOM 1544 C GLY A 99 -10.759 4.919 1.915 1.00 0.00 C ATOM 1545 O GLY A 99 -10.800 5.712 2.858 1.00 0.00 O ATOM 0 H GLY A 99 -13.303 5.952 0.955 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -12.693 4.039 2.158 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -11.793 3.427 0.785 1.00 0.00 H new ATOM 1549 N LEU A 100 -9.623 4.530 1.348 1.00 0.00 N ATOM 1550 CA LEU A 100 -8.329 5.022 1.809 1.00 0.00 C ATOM 1551 C LEU A 100 -8.423 6.483 2.235 1.00 0.00 C ATOM 1552 O LEU A 100 -9.257 7.235 1.731 1.00 0.00 O ATOM 1553 CB LEU A 100 -7.280 4.866 0.707 1.00 0.00 C ATOM 1554 CG LEU A 100 -6.820 3.437 0.415 1.00 0.00 C ATOM 1555 CD1 LEU A 100 -6.224 3.343 -0.981 1.00 0.00 C ATOM 1556 CD2 LEU A 100 -5.814 2.976 1.459 1.00 0.00 C ATOM 0 H LEU A 100 -9.571 3.875 0.568 1.00 0.00 H new ATOM 0 HA LEU A 100 -8.029 4.429 2.673 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -7.682 5.292 -0.212 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -6.407 5.459 0.978 1.00 0.00 H new ATOM 0 HG LEU A 100 -7.688 2.780 0.462 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -5.902 2.319 -1.171 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -6.975 3.630 -1.717 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -5.367 4.012 -1.057 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -5.498 1.957 1.235 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -4.947 3.636 1.445 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -6.275 3.004 2.446 1.00 0.00 H new ATOM 1568 N VAL A 101 -7.560 6.880 3.165 1.00 0.00 N ATOM 1569 CA VAL A 101 -7.543 8.253 3.656 1.00 0.00 C ATOM 1570 C VAL A 101 -7.594 9.250 2.504 1.00 0.00 C ATOM 1571 O VAL A 101 -8.347 10.223 2.542 1.00 0.00 O ATOM 1572 CB VAL A 101 -6.287 8.530 4.505 1.00 0.00 C ATOM 1573 CG1 VAL A 101 -5.033 8.105 3.757 1.00 0.00 C ATOM 1574 CG2 VAL A 101 -6.217 10.000 4.888 1.00 0.00 C ATOM 0 H VAL A 101 -6.864 6.270 3.593 1.00 0.00 H new ATOM 0 HA VAL A 101 -8.429 8.377 4.279 1.00 0.00 H new ATOM 0 HB VAL A 101 -6.351 7.942 5.421 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -4.156 8.308 4.372 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -5.084 7.038 3.538 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -4.959 8.663 2.824 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -5.324 10.178 5.487 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -6.176 10.610 3.985 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -7.101 10.268 5.466 1.00 0.00 H new ATOM 1584 N THR A 102 -6.787 9.001 1.477 1.00 0.00 N ATOM 1585 CA THR A 102 -6.739 9.876 0.313 1.00 0.00 C ATOM 1586 C THR A 102 -6.979 9.094 -0.974 1.00 0.00 C ATOM 1587 O THR A 102 -6.426 8.011 -1.166 1.00 0.00 O ATOM 1588 CB THR A 102 -5.385 10.604 0.213 1.00 0.00 C ATOM 1589 OG1 THR A 102 -5.369 11.453 -0.941 1.00 0.00 O ATOM 1590 CG2 THR A 102 -4.239 9.607 0.131 1.00 0.00 C ATOM 0 H THR A 102 -6.158 8.200 1.428 1.00 0.00 H new ATOM 0 HA THR A 102 -7.532 10.614 0.440 1.00 0.00 H new ATOM 0 HB THR A 102 -5.256 11.209 1.111 1.00 0.00 H new ATOM 0 HG1 THR A 102 -4.506 11.913 -0.996 1.00 0.00 H new ATOM 0 HG21 THR A 102 -3.293 10.145 0.061 1.00 0.00 H new ATOM 0 HG22 THR A 102 -4.236 8.982 1.024 1.00 0.00 H new ATOM 0 HG23 THR A 102 -4.365 8.979 -0.751 1.00 0.00 H new ATOM 1598 N HIS A 103 -7.806 9.650 -1.853 1.00 0.00 N ATOM 1599 CA HIS A 103 -8.118 9.005 -3.123 1.00 0.00 C ATOM 1600 C HIS A 103 -6.883 8.935 -4.015 1.00 0.00 C ATOM 1601 O HIS A 103 -6.314 9.962 -4.388 1.00 0.00 O ATOM 1602 CB HIS A 103 -9.238 9.759 -3.841 1.00 0.00 C ATOM 1603 CG HIS A 103 -9.004 11.235 -3.930 1.00 0.00 C ATOM 1604 ND1 HIS A 103 -9.116 12.207 -2.995 1.00 0.00 N flip ATOM 1605 CD2 HIS A 103 -8.607 11.866 -5.090 1.00 0.00 C flip ATOM 1606 CE1 HIS A 103 -8.786 13.395 -3.600 1.00 0.00 C flip ATOM 1607 NE2 HIS A 103 -8.483 13.162 -4.864 1.00 0.00 N flip ATOM 0 H HIS A 103 -8.272 10.546 -1.709 1.00 0.00 H new ATOM 0 HA HIS A 103 -8.451 7.988 -2.913 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -9.349 9.356 -4.847 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -10.178 9.579 -3.320 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -8.426 11.377 -6.036 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -8.776 14.362 -3.120 1.00 0.00 H new ATOM 0 HE2 HIS A 103 -8.201 13.863 -5.549 1.00 0.00 H new ATOM 1616 N LEU A 104 -6.471 7.718 -4.354 1.00 0.00 N ATOM 1617 CA LEU A 104 -5.302 7.514 -5.202 1.00 0.00 C ATOM 1618 C LEU A 104 -5.241 8.564 -6.307 1.00 0.00 C ATOM 1619 O LEU A 104 -6.251 8.872 -6.939 1.00 0.00 O ATOM 1620 CB LEU A 104 -5.331 6.113 -5.815 1.00 0.00 C ATOM 1621 CG LEU A 104 -5.479 4.952 -4.831 1.00 0.00 C ATOM 1622 CD1 LEU A 104 -5.377 3.620 -5.556 1.00 0.00 C ATOM 1623 CD2 LEU A 104 -4.429 5.046 -3.733 1.00 0.00 C ATOM 0 H LEU A 104 -6.930 6.858 -4.054 1.00 0.00 H new ATOM 0 HA LEU A 104 -4.411 7.614 -4.582 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -6.155 6.067 -6.527 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -4.412 5.967 -6.382 1.00 0.00 H new ATOM 0 HG LEU A 104 -6.465 5.016 -4.370 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -5.485 2.806 -4.839 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -6.167 3.551 -6.304 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -4.406 3.546 -6.046 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -4.550 4.212 -3.042 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -3.434 5.009 -4.177 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -4.550 5.985 -3.193 1.00 0.00 H new ATOM 1635 N GLN A 105 -4.050 9.107 -6.535 1.00 0.00 N ATOM 1636 CA GLN A 105 -3.857 10.121 -7.565 1.00 0.00 C ATOM 1637 C GLN A 105 -2.733 9.724 -8.516 1.00 0.00 C ATOM 1638 O GLN A 105 -2.943 9.598 -9.723 1.00 0.00 O ATOM 1639 CB GLN A 105 -3.546 11.475 -6.926 1.00 0.00 C ATOM 1640 CG GLN A 105 -4.770 12.175 -6.357 1.00 0.00 C ATOM 1641 CD GLN A 105 -4.411 13.358 -5.480 1.00 0.00 C ATOM 1642 OE1 GLN A 105 -3.659 14.243 -5.888 1.00 0.00 O ATOM 1643 NE2 GLN A 105 -4.950 13.380 -4.266 1.00 0.00 N ATOM 0 H GLN A 105 -3.204 8.862 -6.021 1.00 0.00 H new ATOM 0 HA GLN A 105 -4.781 10.201 -8.137 1.00 0.00 H new ATOM 0 HB2 GLN A 105 -2.816 11.332 -6.129 1.00 0.00 H new ATOM 0 HB3 GLN A 105 -3.082 12.121 -7.671 1.00 0.00 H new ATOM 0 HG2 GLN A 105 -5.403 12.514 -7.177 1.00 0.00 H new ATOM 0 HG3 GLN A 105 -5.355 11.461 -5.776 1.00 0.00 H new ATOM 0 HE21 GLN A 105 -5.568 12.625 -3.969 1.00 0.00 H new ATOM 0 HE22 GLN A 105 -4.746 14.152 -3.631 1.00 0.00 H new ATOM 1652 N TYR A 106 -1.540 9.529 -7.965 1.00 0.00 N ATOM 1653 CA TYR A 106 -0.382 9.150 -8.765 1.00 0.00 C ATOM 1654 C TYR A 106 0.137 7.775 -8.355 1.00 0.00 C ATOM 1655 O TYR A 106 0.603 7.568 -7.234 1.00 0.00 O ATOM 1656 CB TYR A 106 0.729 10.191 -8.618 1.00 0.00 C ATOM 1657 CG TYR A 106 0.217 11.600 -8.426 1.00 0.00 C ATOM 1658 CD1 TYR A 106 -0.613 12.194 -9.369 1.00 0.00 C ATOM 1659 CD2 TYR A 106 0.562 12.338 -7.300 1.00 0.00 C ATOM 1660 CE1 TYR A 106 -1.083 13.481 -9.198 1.00 0.00 C ATOM 1661 CE2 TYR A 106 0.095 13.626 -7.120 1.00 0.00 C ATOM 1662 CZ TYR A 106 -0.726 14.193 -8.072 1.00 0.00 C ATOM 1663 OH TYR A 106 -1.194 15.476 -7.897 1.00 0.00 O ATOM 0 H TYR A 106 -1.350 9.627 -6.968 1.00 0.00 H new ATOM 0 HA TYR A 106 -0.693 9.105 -9.809 1.00 0.00 H new ATOM 0 HB2 TYR A 106 1.357 9.923 -7.768 1.00 0.00 H new ATOM 0 HB3 TYR A 106 1.363 10.161 -9.504 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -0.896 11.639 -10.251 1.00 0.00 H new ATOM 0 HD2 TYR A 106 1.206 11.897 -6.553 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -1.726 13.928 -9.942 1.00 0.00 H new ATOM 0 HE2 TYR A 106 0.371 14.186 -6.239 1.00 0.00 H new ATOM 0 HH TYR A 106 -0.851 15.837 -7.053 1.00 0.00 H new ATOM 1673 N PRO A 107 0.055 6.811 -9.284 1.00 0.00 N ATOM 1674 CA PRO A 107 0.511 5.439 -9.044 1.00 0.00 C ATOM 1675 C PRO A 107 2.030 5.344 -8.938 1.00 0.00 C ATOM 1676 O PRO A 107 2.712 5.042 -9.917 1.00 0.00 O ATOM 1677 CB PRO A 107 0.012 4.679 -10.275 1.00 0.00 C ATOM 1678 CG PRO A 107 -0.100 5.714 -11.340 1.00 0.00 C ATOM 1679 CD PRO A 107 -0.490 6.987 -10.641 1.00 0.00 C ATOM 0 HA PRO A 107 0.135 5.043 -8.101 1.00 0.00 H new ATOM 0 HB2 PRO A 107 0.707 3.890 -10.562 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -0.950 4.203 -10.083 1.00 0.00 H new ATOM 0 HG2 PRO A 107 0.845 5.833 -11.869 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -0.847 5.431 -12.082 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -0.067 7.862 -11.134 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -1.571 7.122 -10.625 1.00 0.00 H new ATOM 1687 N VAL A 108 2.553 5.602 -7.744 1.00 0.00 N ATOM 1688 CA VAL A 108 3.991 5.543 -7.510 1.00 0.00 C ATOM 1689 C VAL A 108 4.636 4.432 -8.330 1.00 0.00 C ATOM 1690 O VAL A 108 4.624 3.260 -7.951 1.00 0.00 O ATOM 1691 CB VAL A 108 4.308 5.318 -6.020 1.00 0.00 C ATOM 1692 CG1 VAL A 108 5.810 5.207 -5.804 1.00 0.00 C ATOM 1693 CG2 VAL A 108 3.722 6.439 -5.175 1.00 0.00 C ATOM 0 H VAL A 108 2.002 5.854 -6.923 1.00 0.00 H new ATOM 0 HA VAL A 108 4.402 6.504 -7.820 1.00 0.00 H new ATOM 0 HB VAL A 108 3.849 4.380 -5.707 1.00 0.00 H new ATOM 0 HG11 VAL A 108 6.015 5.048 -4.745 1.00 0.00 H new ATOM 0 HG12 VAL A 108 6.199 4.367 -6.379 1.00 0.00 H new ATOM 0 HG13 VAL A 108 6.294 6.127 -6.133 1.00 0.00 H new ATOM 0 HG21 VAL A 108 3.956 6.263 -4.125 1.00 0.00 H new ATOM 0 HG22 VAL A 108 4.149 7.392 -5.488 1.00 0.00 H new ATOM 0 HG23 VAL A 108 2.640 6.466 -5.306 1.00 0.00 H new ATOM 1703 N PRO A 109 5.214 4.805 -9.481 1.00 0.00 N ATOM 1704 CA PRO A 109 5.877 3.854 -10.378 1.00 0.00 C ATOM 1705 C PRO A 109 7.174 3.309 -9.790 1.00 0.00 C ATOM 1706 O PRO A 109 7.775 3.925 -8.910 1.00 0.00 O ATOM 1707 CB PRO A 109 6.166 4.688 -11.628 1.00 0.00 C ATOM 1708 CG PRO A 109 6.239 6.093 -11.138 1.00 0.00 C ATOM 1709 CD PRO A 109 5.266 6.184 -9.995 1.00 0.00 C ATOM 0 HA PRO A 109 5.260 2.976 -10.568 1.00 0.00 H new ATOM 0 HB2 PRO A 109 7.101 4.384 -12.099 1.00 0.00 H new ATOM 0 HB3 PRO A 109 5.380 4.569 -12.374 1.00 0.00 H new ATOM 0 HG2 PRO A 109 7.249 6.340 -10.811 1.00 0.00 H new ATOM 0 HG3 PRO A 109 5.979 6.796 -11.929 1.00 0.00 H new ATOM 0 HD2 PRO A 109 5.606 6.885 -9.232 1.00 0.00 H new ATOM 0 HD3 PRO A 109 4.286 6.526 -10.328 1.00 0.00 H new ATOM 1717 N LEU A 110 7.600 2.150 -10.281 1.00 0.00 N ATOM 1718 CA LEU A 110 8.827 1.522 -9.804 1.00 0.00 C ATOM 1719 C LEU A 110 10.017 2.462 -9.962 1.00 0.00 C ATOM 1720 O LEU A 110 9.918 3.499 -10.618 1.00 0.00 O ATOM 1721 CB LEU A 110 9.086 0.220 -10.565 1.00 0.00 C ATOM 1722 CG LEU A 110 7.957 -0.811 -10.535 1.00 0.00 C ATOM 1723 CD1 LEU A 110 8.230 -1.930 -11.528 1.00 0.00 C ATOM 1724 CD2 LEU A 110 7.784 -1.371 -9.131 1.00 0.00 C ATOM 0 H LEU A 110 7.114 1.626 -11.009 1.00 0.00 H new ATOM 0 HA LEU A 110 8.703 1.298 -8.744 1.00 0.00 H new ATOM 0 HB2 LEU A 110 9.298 0.467 -11.605 1.00 0.00 H new ATOM 0 HB3 LEU A 110 9.985 -0.243 -10.158 1.00 0.00 H new ATOM 0 HG LEU A 110 7.030 -0.316 -10.824 1.00 0.00 H new ATOM 0 HD11 LEU A 110 7.416 -2.654 -11.493 1.00 0.00 H new ATOM 0 HD12 LEU A 110 8.303 -1.515 -12.533 1.00 0.00 H new ATOM 0 HD13 LEU A 110 9.167 -2.424 -11.271 1.00 0.00 H new ATOM 0 HD21 LEU A 110 6.976 -2.103 -9.128 1.00 0.00 H new ATOM 0 HD22 LEU A 110 8.710 -1.851 -8.814 1.00 0.00 H new ATOM 0 HD23 LEU A 110 7.542 -0.561 -8.443 1.00 0.00 H new ATOM 1736 N GLU A 111 11.142 2.091 -9.359 1.00 0.00 N ATOM 1737 CA GLU A 111 12.352 2.902 -9.435 1.00 0.00 C ATOM 1738 C GLU A 111 13.253 2.430 -10.573 1.00 0.00 C ATOM 1739 O GLU A 111 14.111 1.569 -10.382 1.00 0.00 O ATOM 1740 CB GLU A 111 13.114 2.845 -8.109 1.00 0.00 C ATOM 1741 CG GLU A 111 13.941 4.088 -7.829 1.00 0.00 C ATOM 1742 CD GLU A 111 14.835 4.469 -8.993 1.00 0.00 C ATOM 1743 OE1 GLU A 111 15.988 3.990 -9.036 1.00 0.00 O ATOM 1744 OE2 GLU A 111 14.383 5.245 -9.860 1.00 0.00 O ATOM 0 H GLU A 111 11.241 1.235 -8.813 1.00 0.00 H new ATOM 0 HA GLU A 111 12.057 3.932 -9.632 1.00 0.00 H new ATOM 0 HB2 GLU A 111 12.402 2.702 -7.296 1.00 0.00 H new ATOM 0 HB3 GLU A 111 13.771 1.975 -8.114 1.00 0.00 H new ATOM 0 HG2 GLU A 111 13.274 4.919 -7.601 1.00 0.00 H new ATOM 0 HG3 GLU A 111 14.555 3.920 -6.944 1.00 0.00 H new ATOM 1751 N GLU A 112 13.049 3.001 -11.756 1.00 0.00 N ATOM 1752 CA GLU A 112 13.842 2.638 -12.925 1.00 0.00 C ATOM 1753 C GLU A 112 14.707 3.809 -13.381 1.00 0.00 C ATOM 1754 O GLU A 112 14.254 4.952 -13.413 1.00 0.00 O ATOM 1755 CB GLU A 112 12.929 2.188 -14.068 1.00 0.00 C ATOM 1756 CG GLU A 112 11.838 3.191 -14.406 1.00 0.00 C ATOM 1757 CD GLU A 112 10.822 2.639 -15.387 1.00 0.00 C ATOM 1758 OE1 GLU A 112 10.115 1.673 -15.028 1.00 0.00 O ATOM 1759 OE2 GLU A 112 10.733 3.171 -16.512 1.00 0.00 O ATOM 0 H GLU A 112 12.342 3.716 -11.930 1.00 0.00 H new ATOM 0 HA GLU A 112 14.497 1.813 -12.646 1.00 0.00 H new ATOM 0 HB2 GLU A 112 13.534 2.009 -14.957 1.00 0.00 H new ATOM 0 HB3 GLU A 112 12.467 1.238 -13.800 1.00 0.00 H new ATOM 0 HG2 GLU A 112 11.328 3.490 -13.490 1.00 0.00 H new ATOM 0 HG3 GLU A 112 12.292 4.089 -14.826 1.00 0.00 H new ATOM 1766 N GLU A 113 15.955 3.514 -13.732 1.00 0.00 N ATOM 1767 CA GLU A 113 16.884 4.543 -14.184 1.00 0.00 C ATOM 1768 C GLU A 113 16.907 4.623 -15.708 1.00 0.00 C ATOM 1769 O GLU A 113 17.551 3.812 -16.373 1.00 0.00 O ATOM 1770 CB GLU A 113 18.292 4.258 -13.657 1.00 0.00 C ATOM 1771 CG GLU A 113 19.304 5.334 -14.010 1.00 0.00 C ATOM 1772 CD GLU A 113 19.199 6.551 -13.112 1.00 0.00 C ATOM 1773 OE1 GLU A 113 18.090 6.820 -12.605 1.00 0.00 O ATOM 1774 OE2 GLU A 113 20.225 7.235 -12.916 1.00 0.00 O ATOM 0 H GLU A 113 16.345 2.572 -13.712 1.00 0.00 H new ATOM 0 HA GLU A 113 16.544 5.501 -13.791 1.00 0.00 H new ATOM 0 HB2 GLU A 113 18.250 4.152 -12.573 1.00 0.00 H new ATOM 0 HB3 GLU A 113 18.634 3.304 -14.058 1.00 0.00 H new ATOM 0 HG2 GLU A 113 20.310 4.919 -13.938 1.00 0.00 H new ATOM 0 HG3 GLU A 113 19.158 5.638 -15.046 1.00 0.00 H new ATOM 1781 N ASP A 114 16.199 5.606 -16.253 1.00 0.00 N ATOM 1782 CA ASP A 114 16.137 5.794 -17.698 1.00 0.00 C ATOM 1783 C ASP A 114 17.512 6.143 -18.259 1.00 0.00 C ATOM 1784 O ASP A 114 18.471 6.333 -17.511 1.00 0.00 O ATOM 1785 CB ASP A 114 15.135 6.895 -18.048 1.00 0.00 C ATOM 1786 CG ASP A 114 13.822 6.740 -17.307 1.00 0.00 C ATOM 1787 OD1 ASP A 114 13.533 5.618 -16.841 1.00 0.00 O ATOM 1788 OD2 ASP A 114 13.082 7.740 -17.194 1.00 0.00 O ATOM 0 H ASP A 114 15.660 6.285 -15.716 1.00 0.00 H new ATOM 0 HA ASP A 114 15.807 4.858 -18.148 1.00 0.00 H new ATOM 0 HB2 ASP A 114 15.570 7.866 -17.812 1.00 0.00 H new ATOM 0 HB3 ASP A 114 14.947 6.883 -19.122 1.00 0.00 H new ATOM 1793 N THR A 115 17.602 6.225 -19.583 1.00 0.00 N ATOM 1794 CA THR A 115 18.859 6.549 -20.246 1.00 0.00 C ATOM 1795 C THR A 115 18.715 7.786 -21.125 1.00 0.00 C ATOM 1796 O THR A 115 19.706 8.357 -21.577 1.00 0.00 O ATOM 1797 CB THR A 115 19.357 5.375 -21.109 1.00 0.00 C ATOM 1798 OG1 THR A 115 20.529 5.763 -21.835 1.00 0.00 O ATOM 1799 CG2 THR A 115 18.279 4.923 -22.082 1.00 0.00 C ATOM 0 H THR A 115 16.818 6.071 -20.218 1.00 0.00 H new ATOM 0 HA THR A 115 19.588 6.748 -19.461 1.00 0.00 H new ATOM 0 HB THR A 115 19.599 4.544 -20.447 1.00 0.00 H new ATOM 0 HG1 THR A 115 20.554 6.739 -21.918 1.00 0.00 H new ATOM 0 HG21 THR A 115 18.654 4.093 -22.681 1.00 0.00 H new ATOM 0 HG22 THR A 115 17.399 4.601 -21.526 1.00 0.00 H new ATOM 0 HG23 THR A 115 18.010 5.751 -22.738 1.00 0.00 H new ATOM 1807 N GLY A 116 17.472 8.196 -21.363 1.00 0.00 N ATOM 1808 CA GLY A 116 17.222 9.364 -22.187 1.00 0.00 C ATOM 1809 C GLY A 116 15.774 9.466 -22.623 1.00 0.00 C ATOM 1810 O GLY A 116 14.861 9.314 -21.810 1.00 0.00 O ATOM 0 H GLY A 116 16.635 7.740 -21.000 1.00 0.00 H new ATOM 0 HA2 GLY A 116 17.495 10.262 -21.632 1.00 0.00 H new ATOM 0 HA3 GLY A 116 17.862 9.327 -23.069 1.00 0.00 H new ATOM 1814 N ASP A 117 15.561 9.725 -23.908 1.00 0.00 N ATOM 1815 CA ASP A 117 14.213 9.848 -24.451 1.00 0.00 C ATOM 1816 C ASP A 117 13.587 8.474 -24.666 1.00 0.00 C ATOM 1817 O ASP A 117 14.052 7.692 -25.495 1.00 0.00 O ATOM 1818 CB ASP A 117 14.240 10.623 -25.770 1.00 0.00 C ATOM 1819 CG ASP A 117 12.892 11.225 -26.115 1.00 0.00 C ATOM 1820 OD1 ASP A 117 12.473 12.176 -25.423 1.00 0.00 O ATOM 1821 OD2 ASP A 117 12.257 10.745 -27.077 1.00 0.00 O ATOM 0 H ASP A 117 16.305 9.854 -24.594 1.00 0.00 H new ATOM 0 HA ASP A 117 13.606 10.395 -23.730 1.00 0.00 H new ATOM 0 HB2 ASP A 117 14.984 11.417 -25.706 1.00 0.00 H new ATOM 0 HB3 ASP A 117 14.553 9.956 -26.573 1.00 0.00 H new ATOM 1826 N ASP A 118 12.530 8.187 -23.914 1.00 0.00 N ATOM 1827 CA ASP A 118 11.839 6.908 -24.022 1.00 0.00 C ATOM 1828 C ASP A 118 10.331 7.090 -23.879 1.00 0.00 C ATOM 1829 O ASP A 118 9.853 7.975 -23.170 1.00 0.00 O ATOM 1830 CB ASP A 118 12.351 5.936 -22.957 1.00 0.00 C ATOM 1831 CG ASP A 118 12.676 6.630 -21.649 1.00 0.00 C ATOM 1832 OD1 ASP A 118 11.938 7.564 -21.273 1.00 0.00 O ATOM 1833 OD2 ASP A 118 13.669 6.238 -21.001 1.00 0.00 O ATOM 0 H ASP A 118 12.133 8.823 -23.223 1.00 0.00 H new ATOM 0 HA ASP A 118 12.045 6.495 -25.010 1.00 0.00 H new ATOM 0 HB2 ASP A 118 11.599 5.167 -22.780 1.00 0.00 H new ATOM 0 HB3 ASP A 118 13.243 5.431 -23.329 1.00 0.00 H new ATOM 1838 N PRO A 119 9.563 6.234 -24.570 1.00 0.00 N ATOM 1839 CA PRO A 119 8.099 6.282 -24.537 1.00 0.00 C ATOM 1840 C PRO A 119 7.535 5.851 -23.187 1.00 0.00 C ATOM 1841 O PRO A 119 7.280 6.683 -22.316 1.00 0.00 O ATOM 1842 CB PRO A 119 7.687 5.291 -25.629 1.00 0.00 C ATOM 1843 CG PRO A 119 8.834 4.346 -25.735 1.00 0.00 C ATOM 1844 CD PRO A 119 10.066 5.155 -25.436 1.00 0.00 C ATOM 0 HA PRO A 119 7.721 7.292 -24.694 1.00 0.00 H new ATOM 0 HB2 PRO A 119 6.767 4.769 -25.364 1.00 0.00 H new ATOM 0 HB3 PRO A 119 7.504 5.799 -26.576 1.00 0.00 H new ATOM 0 HG2 PRO A 119 8.727 3.522 -25.029 1.00 0.00 H new ATOM 0 HG3 PRO A 119 8.887 3.907 -26.731 1.00 0.00 H new ATOM 0 HD2 PRO A 119 10.827 4.558 -24.933 1.00 0.00 H new ATOM 0 HD3 PRO A 119 10.519 5.548 -26.346 1.00 0.00 H new TER 1852 PRO A 119