USER MOD reduce.3.24.130724 H: found=0, std=0, add=1136, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 1136 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: B 51 TYR OH : rot 180:sc=-0.00418 USER MOD Set 1.2: B 55 GLN : amide:sc= -1.94! K(o=-1.9!,f=-0.0067) USER MOD Set 2.1: A 51 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 55 GLN : amide:sc= -0.111 X(o=-0.11,f=0) USER MOD Set 3.1: A 21 GLN : amide:sc= -2.7! K(o=-2.7!,f=-1.3) USER MOD Set 3.2: A 35 TYR OH : rot -101:sc= -0.0126 USER MOD Single : A 1 MET CE :methyl -160:sc= -0.172 (180deg=-0.876) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 ASN : amide:sc= 0 X(o=0,f=-0.48) USER MOD Single : A 6 MET CE :methyl -163:sc= -0.0988 (180deg=-0.518) USER MOD Single : A 9 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 10 ASN : amide:sc= 0 X(o=0,f=-0.0032) USER MOD Single : A 12 HIS : no HD1:sc= -0.0158 X(o=-0.016,f=-0.016) USER MOD Single : A 14 LYS NZ :NH3+ -168:sc=-0.00768 (180deg=-0.174) USER MOD Single : A 16 THR OG1 : rot 180:sc= 0.0087 USER MOD Single : A 18 THR OG1 : rot 84:sc= 1.19 USER MOD Single : A 25 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot -67:sc= 1.18 USER MOD Single : A 47 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 ASN : amide:sc= 0.734 K(o=0.73,f=-0.041) USER MOD Single : A 64 GLN : amide:sc= -0.0109 K(o=-0.011,f=-1.2!) USER MOD Single : A 67 HIS : no HD1:sc= 0 X(o=0,f=-0.0089) USER MOD Single : A 68 HIS : no HD1:sc= -0.33 X(o=-0.33,f=-0.0038) USER MOD Single : A 69 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 70 HIS : no HD1:sc= 0 X(o=0,f=-0.0065) USER MOD Single : A 71 HIS : no HD1:sc= -0.738 X(o=-0.74,f=-0.81) USER MOD Single : A 72 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ -178:sc= 0 (180deg=-0.00314) USER MOD Single : B 4 ASN : amide:sc= -0.557 K(o=-0.56,f=-6.7!) USER MOD Single : B 6 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 9 ASN : amide:sc= -0.485 K(o=-0.48,f=-3.6!) USER MOD Single : B 10 ASN : amide:sc= 1.03 K(o=1,f=0.11) USER MOD Single : B 12 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 16 THR OG1 : rot 44:sc= 0.0408 USER MOD Single : B 18 THR OG1 : rot 180:sc= -0.194 USER MOD Single : B 21 GLN : amide:sc= 0.064 K(o=0.064,f=-0.58) USER MOD Single : B 25 TYR OH : rot 180:sc= 0 USER MOD Single : B 30 THR OG1 : rot -61:sc= -0.615! USER MOD Single : B 35 TYR OH : rot 180:sc= 0 USER MOD Single : B 47 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 61 LYS NZ :NH3+ 175:sc= 1.2 (180deg=1.16) USER MOD Single : B 62 ASN : amide:sc=-0.00285 K(o=-0.0028,f=-3.9!) USER MOD Single : B 64 GLN : amide:sc= 0 X(o=0,f=-0.5) USER MOD Single : B 67 HIS : no HD1:sc= -0.014 X(o=-0.014,f=-0.012) USER MOD Single : B 68 HIS : no HD1:sc= -0.0147 X(o=-0.015,f=0) USER MOD Single : B 69 HIS : no HD1:sc= -0.187 X(o=-0.19,f=-0.45) USER MOD Single : B 70 HIS : no HD1:sc= 0 X(o=0,f=-0.046) USER MOD Single : B 71 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 72 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 60.425 -1.176 10.758 1.00 0.00 N ATOM 2 CA MET A 1 60.085 0.119 11.388 1.00 0.00 C ATOM 3 C MET A 1 59.001 0.842 10.595 1.00 0.00 C ATOM 4 O MET A 1 59.231 1.282 9.469 1.00 0.00 O ATOM 5 CB MET A 1 61.335 0.999 11.477 1.00 0.00 C ATOM 6 CG MET A 1 61.077 2.370 12.080 1.00 0.00 C ATOM 7 SD MET A 1 62.570 3.377 12.199 1.00 0.00 S ATOM 8 CE MET A 1 63.592 2.349 13.256 1.00 0.00 C ATOM 0 H1 MET A 1 61.165 -1.650 11.315 1.00 0.00 H new ATOM 0 H2 MET A 1 59.578 -1.778 10.724 1.00 0.00 H new ATOM 0 H3 MET A 1 60.772 -1.011 9.791 1.00 0.00 H new ATOM 0 HA MET A 1 59.706 -0.077 12.391 1.00 0.00 H new ATOM 0 HB2 MET A 1 62.088 0.485 12.075 1.00 0.00 H new ATOM 0 HB3 MET A 1 61.752 1.124 10.478 1.00 0.00 H new ATOM 0 HG2 MET A 1 60.338 2.895 11.474 1.00 0.00 H new ATOM 0 HG3 MET A 1 60.646 2.249 13.074 1.00 0.00 H new ATOM 0 HE1 MET A 1 64.375 2.958 13.708 1.00 0.00 H new ATOM 0 HE2 MET A 1 62.976 1.908 14.040 1.00 0.00 H new ATOM 0 HE3 MET A 1 64.047 1.556 12.663 1.00 0.00 H new ATOM 20 N VAL A 2 57.818 0.953 11.185 1.00 0.00 N ATOM 21 CA VAL A 2 56.731 1.714 10.584 1.00 0.00 C ATOM 22 C VAL A 2 56.374 2.899 11.475 1.00 0.00 C ATOM 23 O VAL A 2 56.339 2.779 12.702 1.00 0.00 O ATOM 24 CB VAL A 2 55.473 0.850 10.328 1.00 0.00 C ATOM 25 CG1 VAL A 2 55.745 -0.185 9.249 1.00 0.00 C ATOM 26 CG2 VAL A 2 54.999 0.173 11.606 1.00 0.00 C ATOM 0 H VAL A 2 57.587 0.525 12.081 1.00 0.00 H new ATOM 0 HA VAL A 2 57.082 2.068 9.615 1.00 0.00 H new ATOM 0 HB VAL A 2 54.679 1.512 9.984 1.00 0.00 H new ATOM 0 HG11 VAL A 2 54.848 -0.782 9.084 1.00 0.00 H new ATOM 0 HG12 VAL A 2 56.021 0.319 8.323 1.00 0.00 H new ATOM 0 HG13 VAL A 2 56.561 -0.835 9.566 1.00 0.00 H new ATOM 0 HG21 VAL A 2 54.114 -0.427 11.393 1.00 0.00 H new ATOM 0 HG22 VAL A 2 55.790 -0.471 11.991 1.00 0.00 H new ATOM 0 HG23 VAL A 2 54.754 0.931 12.350 1.00 0.00 H new ATOM 36 N GLU A 3 56.128 4.043 10.862 1.00 0.00 N ATOM 37 CA GLU A 3 55.891 5.267 11.610 1.00 0.00 C ATOM 38 C GLU A 3 54.410 5.593 11.680 1.00 0.00 C ATOM 39 O GLU A 3 53.648 5.228 10.783 1.00 0.00 O ATOM 40 CB GLU A 3 56.625 6.433 10.961 1.00 0.00 C ATOM 41 CG GLU A 3 58.116 6.212 10.808 1.00 0.00 C ATOM 42 CD GLU A 3 58.790 7.387 10.146 1.00 0.00 C ATOM 43 OE1 GLU A 3 58.749 7.473 8.901 1.00 0.00 O ATOM 44 OE2 GLU A 3 59.336 8.246 10.867 1.00 0.00 O ATOM 0 H GLU A 3 56.087 4.151 9.849 1.00 0.00 H new ATOM 0 HA GLU A 3 56.265 5.110 12.622 1.00 0.00 H new ATOM 0 HB2 GLU A 3 56.193 6.620 9.978 1.00 0.00 H new ATOM 0 HB3 GLU A 3 56.460 7.330 11.557 1.00 0.00 H new ATOM 0 HG2 GLU A 3 58.561 6.042 11.788 1.00 0.00 H new ATOM 0 HG3 GLU A 3 58.292 5.312 10.218 1.00 0.00 H new ATOM 51 N ASN A 4 54.022 6.282 12.758 1.00 0.00 N ATOM 52 CA ASN A 4 52.659 6.800 12.925 1.00 0.00 C ATOM 53 C ASN A 4 51.642 5.669 13.092 1.00 0.00 C ATOM 54 O ASN A 4 51.967 4.493 12.898 1.00 0.00 O ATOM 55 CB ASN A 4 52.276 7.688 11.728 1.00 0.00 C ATOM 56 CG ASN A 4 53.165 8.914 11.594 1.00 0.00 C ATOM 57 OD1 ASN A 4 53.621 9.481 12.588 1.00 0.00 O ATOM 58 ND2 ASN A 4 53.427 9.330 10.364 1.00 0.00 N ATOM 0 H ASN A 4 54.642 6.496 13.539 1.00 0.00 H new ATOM 0 HA ASN A 4 52.641 7.399 13.835 1.00 0.00 H new ATOM 0 HB2 ASN A 4 52.335 7.100 10.812 1.00 0.00 H new ATOM 0 HB3 ASN A 4 51.239 8.007 11.835 1.00 0.00 H new ATOM 0 HD21 ASN A 4 54.024 10.144 10.217 1.00 0.00 H new ATOM 0 HD22 ASN A 4 53.032 8.836 9.564 1.00 0.00 H new ATOM 65 N PRO A 5 50.409 5.998 13.519 1.00 0.00 N ATOM 66 CA PRO A 5 49.300 5.045 13.505 1.00 0.00 C ATOM 67 C PRO A 5 49.034 4.564 12.085 1.00 0.00 C ATOM 68 O PRO A 5 48.683 5.362 11.211 1.00 0.00 O ATOM 69 CB PRO A 5 48.107 5.847 14.043 1.00 0.00 C ATOM 70 CG PRO A 5 48.511 7.279 13.929 1.00 0.00 C ATOM 71 CD PRO A 5 50.004 7.300 14.071 1.00 0.00 C ATOM 0 HA PRO A 5 49.501 4.154 14.099 1.00 0.00 H new ATOM 0 HB2 PRO A 5 47.205 5.646 13.465 1.00 0.00 H new ATOM 0 HB3 PRO A 5 47.889 5.581 15.077 1.00 0.00 H new ATOM 0 HG2 PRO A 5 48.204 7.696 12.970 1.00 0.00 H new ATOM 0 HG3 PRO A 5 48.037 7.881 14.704 1.00 0.00 H new ATOM 0 HD2 PRO A 5 50.450 8.128 13.520 1.00 0.00 H new ATOM 0 HD3 PRO A 5 50.309 7.409 15.112 1.00 0.00 H new ATOM 79 N MET A 6 49.217 3.265 11.863 1.00 0.00 N ATOM 80 CA MET A 6 49.171 2.692 10.521 1.00 0.00 C ATOM 81 C MET A 6 47.904 3.094 9.777 1.00 0.00 C ATOM 82 O MET A 6 46.786 2.919 10.270 1.00 0.00 O ATOM 83 CB MET A 6 49.301 1.168 10.577 1.00 0.00 C ATOM 84 CG MET A 6 50.661 0.701 11.078 1.00 0.00 C ATOM 85 SD MET A 6 50.858 -1.092 11.029 1.00 0.00 S ATOM 86 CE MET A 6 49.539 -1.611 12.122 1.00 0.00 C ATOM 0 H MET A 6 49.400 2.585 12.601 1.00 0.00 H new ATOM 0 HA MET A 6 50.019 3.094 9.967 1.00 0.00 H new ATOM 0 HB2 MET A 6 48.524 0.767 11.228 1.00 0.00 H new ATOM 0 HB3 MET A 6 49.127 0.758 9.582 1.00 0.00 H new ATOM 0 HG2 MET A 6 51.442 1.163 10.474 1.00 0.00 H new ATOM 0 HG3 MET A 6 50.803 1.048 12.102 1.00 0.00 H new ATOM 0 HE1 MET A 6 49.709 -2.641 12.434 1.00 0.00 H new ATOM 0 HE2 MET A 6 49.518 -0.965 13.000 1.00 0.00 H new ATOM 0 HE3 MET A 6 48.585 -1.543 11.599 1.00 0.00 H new ATOM 96 N VAL A 7 48.104 3.658 8.595 1.00 0.00 N ATOM 97 CA VAL A 7 47.014 4.119 7.752 1.00 0.00 C ATOM 98 C VAL A 7 46.307 2.923 7.120 1.00 0.00 C ATOM 99 O VAL A 7 46.882 1.838 7.017 1.00 0.00 O ATOM 100 CB VAL A 7 47.541 5.070 6.644 1.00 0.00 C ATOM 101 CG1 VAL A 7 46.398 5.702 5.857 1.00 0.00 C ATOM 102 CG2 VAL A 7 48.437 6.146 7.244 1.00 0.00 C ATOM 0 H VAL A 7 49.030 3.809 8.194 1.00 0.00 H new ATOM 0 HA VAL A 7 46.306 4.671 8.371 1.00 0.00 H new ATOM 0 HB VAL A 7 48.130 4.472 5.948 1.00 0.00 H new ATOM 0 HG11 VAL A 7 46.805 6.361 5.090 1.00 0.00 H new ATOM 0 HG12 VAL A 7 45.805 4.919 5.385 1.00 0.00 H new ATOM 0 HG13 VAL A 7 45.766 6.278 6.533 1.00 0.00 H new ATOM 0 HG21 VAL A 7 48.797 6.803 6.452 1.00 0.00 H new ATOM 0 HG22 VAL A 7 47.870 6.729 7.969 1.00 0.00 H new ATOM 0 HG23 VAL A 7 49.287 5.677 7.740 1.00 0.00 H new ATOM 112 N ILE A 8 45.056 3.110 6.733 1.00 0.00 N ATOM 113 CA ILE A 8 44.306 2.061 6.065 1.00 0.00 C ATOM 114 C ILE A 8 44.826 1.831 4.646 1.00 0.00 C ATOM 115 O ILE A 8 45.318 2.751 3.989 1.00 0.00 O ATOM 116 CB ILE A 8 42.784 2.357 6.053 1.00 0.00 C ATOM 117 CG1 ILE A 8 42.488 3.835 5.744 1.00 0.00 C ATOM 118 CG2 ILE A 8 42.168 1.965 7.387 1.00 0.00 C ATOM 119 CD1 ILE A 8 42.658 4.217 4.289 1.00 0.00 C ATOM 0 H ILE A 8 44.539 3.979 6.870 1.00 0.00 H new ATOM 0 HA ILE A 8 44.456 1.145 6.637 1.00 0.00 H new ATOM 0 HB ILE A 8 42.337 1.761 5.257 1.00 0.00 H new ATOM 0 HG12 ILE A 8 41.466 4.059 6.049 1.00 0.00 H new ATOM 0 HG13 ILE A 8 43.145 4.459 6.350 1.00 0.00 H new ATOM 0 HG21 ILE A 8 41.099 2.176 7.370 1.00 0.00 H new ATOM 0 HG22 ILE A 8 42.325 0.901 7.561 1.00 0.00 H new ATOM 0 HG23 ILE A 8 42.638 2.537 8.187 1.00 0.00 H new ATOM 0 HD11 ILE A 8 42.429 5.275 4.161 1.00 0.00 H new ATOM 0 HD12 ILE A 8 43.686 4.028 3.981 1.00 0.00 H new ATOM 0 HD13 ILE A 8 41.981 3.623 3.675 1.00 0.00 H new ATOM 131 N ASN A 9 44.743 0.592 4.191 1.00 0.00 N ATOM 132 CA ASN A 9 45.206 0.234 2.856 1.00 0.00 C ATOM 133 C ASN A 9 44.123 -0.532 2.121 1.00 0.00 C ATOM 134 O ASN A 9 44.364 -1.148 1.083 1.00 0.00 O ATOM 135 CB ASN A 9 46.486 -0.610 2.928 1.00 0.00 C ATOM 136 CG ASN A 9 47.680 0.170 3.449 1.00 0.00 C ATOM 137 OD1 ASN A 9 48.396 0.814 2.683 1.00 0.00 O ATOM 138 ND2 ASN A 9 47.909 0.114 4.753 1.00 0.00 N ATOM 0 H ASN A 9 44.359 -0.186 4.726 1.00 0.00 H new ATOM 0 HA ASN A 9 45.430 1.152 2.314 1.00 0.00 H new ATOM 0 HB2 ASN A 9 46.311 -1.471 3.573 1.00 0.00 H new ATOM 0 HB3 ASN A 9 46.716 -0.997 1.935 1.00 0.00 H new ATOM 0 HD21 ASN A 9 48.702 0.616 5.154 1.00 0.00 H new ATOM 0 HD22 ASN A 9 47.293 -0.431 5.356 1.00 0.00 H new ATOM 145 N ASN A 10 42.917 -0.474 2.660 1.00 0.00 N ATOM 146 CA ASN A 10 41.803 -1.229 2.115 1.00 0.00 C ATOM 147 C ASN A 10 40.974 -0.348 1.195 1.00 0.00 C ATOM 148 O ASN A 10 40.186 0.475 1.656 1.00 0.00 O ATOM 149 CB ASN A 10 40.930 -1.782 3.245 1.00 0.00 C ATOM 150 CG ASN A 10 41.742 -2.522 4.291 1.00 0.00 C ATOM 151 OD1 ASN A 10 42.216 -1.927 5.257 1.00 0.00 O ATOM 152 ND2 ASN A 10 41.902 -3.824 4.116 1.00 0.00 N ATOM 0 H ASN A 10 42.685 0.090 3.477 1.00 0.00 H new ATOM 0 HA ASN A 10 42.198 -2.066 1.539 1.00 0.00 H new ATOM 0 HB2 ASN A 10 40.392 -0.962 3.720 1.00 0.00 H new ATOM 0 HB3 ASN A 10 40.181 -2.455 2.827 1.00 0.00 H new ATOM 0 HD21 ASN A 10 42.434 -4.368 4.795 1.00 0.00 H new ATOM 0 HD22 ASN A 10 41.494 -4.283 3.302 1.00 0.00 H new ATOM 159 N TRP A 11 41.188 -0.507 -0.105 1.00 0.00 N ATOM 160 CA TRP A 11 40.454 0.255 -1.112 1.00 0.00 C ATOM 161 C TRP A 11 38.955 0.029 -0.949 1.00 0.00 C ATOM 162 O TRP A 11 38.207 0.948 -0.618 1.00 0.00 O ATOM 163 CB TRP A 11 40.895 -0.166 -2.521 1.00 0.00 C ATOM 164 CG TRP A 11 42.166 -0.963 -2.533 1.00 0.00 C ATOM 165 CD1 TRP A 11 42.276 -2.322 -2.609 1.00 0.00 C ATOM 166 CD2 TRP A 11 43.505 -0.457 -2.456 1.00 0.00 C ATOM 167 NE1 TRP A 11 43.596 -2.692 -2.575 1.00 0.00 N ATOM 168 CE2 TRP A 11 44.371 -1.565 -2.486 1.00 0.00 C ATOM 169 CE3 TRP A 11 44.054 0.827 -2.365 1.00 0.00 C ATOM 170 CZ2 TRP A 11 45.758 -1.430 -2.428 1.00 0.00 C ATOM 171 CZ3 TRP A 11 45.429 0.958 -2.308 1.00 0.00 C ATOM 172 CH2 TRP A 11 46.266 -0.163 -2.340 1.00 0.00 C ATOM 0 H TRP A 11 41.869 -1.161 -0.491 1.00 0.00 H new ATOM 0 HA TRP A 11 40.671 1.314 -0.976 1.00 0.00 H new ATOM 0 HB2 TRP A 11 40.101 -0.754 -2.982 1.00 0.00 H new ATOM 0 HB3 TRP A 11 41.028 0.726 -3.134 1.00 0.00 H new ATOM 0 HD1 TRP A 11 41.444 -3.006 -2.685 1.00 0.00 H new ATOM 0 HE1 TRP A 11 43.944 -3.650 -2.610 1.00 0.00 H new ATOM 0 HE3 TRP A 11 43.416 1.698 -2.340 1.00 0.00 H new ATOM 0 HZ2 TRP A 11 46.406 -2.293 -2.452 1.00 0.00 H new ATOM 0 HZ3 TRP A 11 45.865 1.943 -2.237 1.00 0.00 H new ATOM 0 HH2 TRP A 11 47.336 -0.025 -2.294 1.00 0.00 H new ATOM 183 N HIS A 12 38.533 -1.206 -1.187 1.00 0.00 N ATOM 184 CA HIS A 12 37.156 -1.631 -0.957 1.00 0.00 C ATOM 185 C HIS A 12 37.150 -3.099 -0.574 1.00 0.00 C ATOM 186 O HIS A 12 36.632 -3.476 0.475 1.00 0.00 O ATOM 187 CB HIS A 12 36.278 -1.416 -2.198 1.00 0.00 C ATOM 188 CG HIS A 12 35.935 0.017 -2.462 1.00 0.00 C ATOM 189 ND1 HIS A 12 36.450 0.732 -3.519 1.00 0.00 N ATOM 190 CD2 HIS A 12 35.114 0.866 -1.802 1.00 0.00 C ATOM 191 CE1 HIS A 12 35.962 1.958 -3.498 1.00 0.00 C ATOM 192 NE2 HIS A 12 35.148 2.066 -2.466 1.00 0.00 N ATOM 0 H HIS A 12 39.137 -1.945 -1.546 1.00 0.00 H new ATOM 0 HA HIS A 12 36.741 -1.025 -0.151 1.00 0.00 H new ATOM 0 HB2 HIS A 12 36.793 -1.822 -3.069 1.00 0.00 H new ATOM 0 HB3 HIS A 12 35.355 -1.984 -2.080 1.00 0.00 H new ATOM 0 HD2 HIS A 12 34.538 0.641 -0.916 1.00 0.00 H new ATOM 0 HE1 HIS A 12 36.191 2.741 -4.206 1.00 0.00 H new ATOM 0 HE2 HIS A 12 34.629 2.904 -2.204 1.00 0.00 H new ATOM 201 N ASP A 13 37.743 -3.915 -1.446 1.00 0.00 N ATOM 202 CA ASP A 13 37.912 -5.351 -1.212 1.00 0.00 C ATOM 203 C ASP A 13 36.562 -6.062 -1.118 1.00 0.00 C ATOM 204 O ASP A 13 36.038 -6.543 -2.125 1.00 0.00 O ATOM 205 CB ASP A 13 38.747 -5.605 0.050 1.00 0.00 C ATOM 206 CG ASP A 13 39.176 -7.051 0.182 1.00 0.00 C ATOM 207 OD1 ASP A 13 40.232 -7.414 -0.378 1.00 0.00 O ATOM 208 OD2 ASP A 13 38.467 -7.831 0.848 1.00 0.00 O ATOM 0 H ASP A 13 38.121 -3.598 -2.339 1.00 0.00 H new ATOM 0 HA ASP A 13 38.448 -5.764 -2.067 1.00 0.00 H new ATOM 0 HB2 ASP A 13 39.631 -4.968 0.031 1.00 0.00 H new ATOM 0 HB3 ASP A 13 38.168 -5.320 0.928 1.00 0.00 H new ATOM 213 N LYS A 14 35.994 -6.117 0.077 1.00 0.00 N ATOM 214 CA LYS A 14 34.702 -6.756 0.274 1.00 0.00 C ATOM 215 C LYS A 14 33.883 -5.971 1.297 1.00 0.00 C ATOM 216 O LYS A 14 32.930 -6.485 1.888 1.00 0.00 O ATOM 217 CB LYS A 14 34.897 -8.209 0.724 1.00 0.00 C ATOM 218 CG LYS A 14 33.658 -9.075 0.558 1.00 0.00 C ATOM 219 CD LYS A 14 33.943 -10.528 0.899 1.00 0.00 C ATOM 220 CE LYS A 14 32.698 -11.390 0.761 1.00 0.00 C ATOM 221 NZ LYS A 14 31.647 -11.009 1.740 1.00 0.00 N ATOM 0 H LYS A 14 36.407 -5.727 0.924 1.00 0.00 H new ATOM 0 HA LYS A 14 34.156 -6.762 -0.669 1.00 0.00 H new ATOM 0 HB2 LYS A 14 35.715 -8.649 0.154 1.00 0.00 H new ATOM 0 HB3 LYS A 14 35.197 -8.218 1.772 1.00 0.00 H new ATOM 0 HG2 LYS A 14 32.862 -8.699 1.200 1.00 0.00 H new ATOM 0 HG3 LYS A 14 33.299 -9.005 -0.469 1.00 0.00 H new ATOM 0 HD2 LYS A 14 34.725 -10.910 0.243 1.00 0.00 H new ATOM 0 HD3 LYS A 14 34.322 -10.595 1.919 1.00 0.00 H new ATOM 0 HE2 LYS A 14 32.303 -11.297 -0.250 1.00 0.00 H new ATOM 0 HE3 LYS A 14 32.964 -12.437 0.904 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 30.905 -11.738 1.754 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 32.069 -10.925 2.687 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 31.230 -10.097 1.465 1.00 0.00 H new ATOM 235 N LEU A 15 34.258 -4.712 1.494 1.00 0.00 N ATOM 236 CA LEU A 15 33.526 -3.828 2.390 1.00 0.00 C ATOM 237 C LEU A 15 32.288 -3.298 1.677 1.00 0.00 C ATOM 238 O LEU A 15 32.350 -2.932 0.502 1.00 0.00 O ATOM 239 CB LEU A 15 34.418 -2.670 2.850 1.00 0.00 C ATOM 240 CG LEU A 15 33.808 -1.764 3.923 1.00 0.00 C ATOM 241 CD1 LEU A 15 33.514 -2.556 5.187 1.00 0.00 C ATOM 242 CD2 LEU A 15 34.739 -0.600 4.229 1.00 0.00 C ATOM 0 H LEU A 15 35.066 -4.281 1.044 1.00 0.00 H new ATOM 0 HA LEU A 15 33.219 -4.388 3.273 1.00 0.00 H new ATOM 0 HB2 LEU A 15 35.352 -3.082 3.233 1.00 0.00 H new ATOM 0 HB3 LEU A 15 34.670 -2.060 1.983 1.00 0.00 H new ATOM 0 HG LEU A 15 32.869 -1.364 3.542 1.00 0.00 H new ATOM 0 HD11 LEU A 15 33.081 -1.895 5.938 1.00 0.00 H new ATOM 0 HD12 LEU A 15 32.810 -3.357 4.959 1.00 0.00 H new ATOM 0 HD13 LEU A 15 34.440 -2.985 5.571 1.00 0.00 H new ATOM 0 HD21 LEU A 15 34.290 0.034 4.994 1.00 0.00 H new ATOM 0 HD22 LEU A 15 35.694 -0.983 4.590 1.00 0.00 H new ATOM 0 HD23 LEU A 15 34.901 -0.016 3.323 1.00 0.00 H new ATOM 254 N THR A 16 31.167 -3.268 2.381 1.00 0.00 N ATOM 255 CA THR A 16 29.900 -2.912 1.769 1.00 0.00 C ATOM 256 C THR A 16 29.491 -1.461 2.065 1.00 0.00 C ATOM 257 O THR A 16 30.246 -0.527 1.790 1.00 0.00 O ATOM 258 CB THR A 16 28.798 -3.892 2.212 1.00 0.00 C ATOM 259 OG1 THR A 16 28.854 -4.082 3.635 1.00 0.00 O ATOM 260 CG2 THR A 16 28.959 -5.231 1.507 1.00 0.00 C ATOM 0 H THR A 16 31.111 -3.486 3.376 1.00 0.00 H new ATOM 0 HA THR A 16 30.030 -2.987 0.689 1.00 0.00 H new ATOM 0 HB THR A 16 27.830 -3.469 1.943 1.00 0.00 H new ATOM 0 HG1 THR A 16 28.149 -4.705 3.910 1.00 0.00 H new ATOM 0 HG21 THR A 16 28.171 -5.911 1.833 1.00 0.00 H new ATOM 0 HG22 THR A 16 28.890 -5.085 0.429 1.00 0.00 H new ATOM 0 HG23 THR A 16 29.931 -5.658 1.754 1.00 0.00 H new ATOM 268 N GLU A 17 28.308 -1.272 2.641 1.00 0.00 N ATOM 269 CA GLU A 17 27.724 0.058 2.752 1.00 0.00 C ATOM 270 C GLU A 17 28.102 0.745 4.061 1.00 0.00 C ATOM 271 O GLU A 17 27.425 0.588 5.081 1.00 0.00 O ATOM 272 CB GLU A 17 26.203 -0.024 2.621 1.00 0.00 C ATOM 273 CG GLU A 17 25.735 -0.566 1.280 1.00 0.00 C ATOM 274 CD GLU A 17 24.238 -0.799 1.235 1.00 0.00 C ATOM 275 OE1 GLU A 17 23.481 0.185 1.118 1.00 0.00 O ATOM 276 OE2 GLU A 17 23.811 -1.967 1.331 1.00 0.00 O ATOM 0 H GLU A 17 27.738 -2.020 3.036 1.00 0.00 H new ATOM 0 HA GLU A 17 28.128 0.661 1.939 1.00 0.00 H new ATOM 0 HB2 GLU A 17 25.812 -0.659 3.416 1.00 0.00 H new ATOM 0 HB3 GLU A 17 25.780 0.970 2.769 1.00 0.00 H new ATOM 0 HG2 GLU A 17 26.014 0.134 0.492 1.00 0.00 H new ATOM 0 HG3 GLU A 17 26.251 -1.503 1.071 1.00 0.00 H new ATOM 283 N THR A 18 29.201 1.485 4.030 1.00 0.00 N ATOM 284 CA THR A 18 29.580 2.345 5.142 1.00 0.00 C ATOM 285 C THR A 18 29.006 3.741 4.930 1.00 0.00 C ATOM 286 O THR A 18 28.396 4.334 5.824 1.00 0.00 O ATOM 287 CB THR A 18 31.114 2.437 5.272 1.00 0.00 C ATOM 288 OG1 THR A 18 31.695 2.749 3.994 1.00 0.00 O ATOM 289 CG2 THR A 18 31.694 1.132 5.792 1.00 0.00 C ATOM 0 H THR A 18 29.849 1.507 3.243 1.00 0.00 H new ATOM 0 HA THR A 18 29.179 1.914 6.059 1.00 0.00 H new ATOM 0 HB THR A 18 31.350 3.228 5.984 1.00 0.00 H new ATOM 0 HG1 THR A 18 31.674 3.719 3.853 1.00 0.00 H new ATOM 0 HG21 THR A 18 32.777 1.223 5.875 1.00 0.00 H new ATOM 0 HG22 THR A 18 31.272 0.912 6.773 1.00 0.00 H new ATOM 0 HG23 THR A 18 31.449 0.325 5.102 1.00 0.00 H new ATOM 297 N ASP A 19 29.210 4.248 3.724 1.00 0.00 N ATOM 298 CA ASP A 19 28.714 5.556 3.317 1.00 0.00 C ATOM 299 C ASP A 19 28.443 5.543 1.821 1.00 0.00 C ATOM 300 O ASP A 19 28.299 6.585 1.184 1.00 0.00 O ATOM 301 CB ASP A 19 29.738 6.647 3.657 1.00 0.00 C ATOM 302 CG ASP A 19 31.091 6.413 3.005 1.00 0.00 C ATOM 303 OD1 ASP A 19 31.788 5.450 3.398 1.00 0.00 O ATOM 304 OD2 ASP A 19 31.471 7.193 2.109 1.00 0.00 O ATOM 0 H ASP A 19 29.728 3.760 2.993 1.00 0.00 H new ATOM 0 HA ASP A 19 27.791 5.773 3.854 1.00 0.00 H new ATOM 0 HB2 ASP A 19 29.350 7.614 3.339 1.00 0.00 H new ATOM 0 HB3 ASP A 19 29.865 6.695 4.739 1.00 0.00 H new ATOM 309 N VAL A 20 28.352 4.339 1.276 1.00 0.00 N ATOM 310 CA VAL A 20 28.191 4.154 -0.156 1.00 0.00 C ATOM 311 C VAL A 20 26.717 4.026 -0.520 1.00 0.00 C ATOM 312 O VAL A 20 26.003 3.182 0.023 1.00 0.00 O ATOM 313 CB VAL A 20 28.940 2.894 -0.646 1.00 0.00 C ATOM 314 CG1 VAL A 20 28.885 2.784 -2.163 1.00 0.00 C ATOM 315 CG2 VAL A 20 30.382 2.902 -0.160 1.00 0.00 C ATOM 0 H VAL A 20 28.387 3.470 1.810 1.00 0.00 H new ATOM 0 HA VAL A 20 28.614 5.032 -0.645 1.00 0.00 H new ATOM 0 HB VAL A 20 28.442 2.021 -0.225 1.00 0.00 H new ATOM 0 HG11 VAL A 20 29.419 1.889 -2.483 1.00 0.00 H new ATOM 0 HG12 VAL A 20 27.846 2.721 -2.486 1.00 0.00 H new ATOM 0 HG13 VAL A 20 29.351 3.663 -2.609 1.00 0.00 H new ATOM 0 HG21 VAL A 20 30.891 2.006 -0.516 1.00 0.00 H new ATOM 0 HG22 VAL A 20 30.891 3.786 -0.545 1.00 0.00 H new ATOM 0 HG23 VAL A 20 30.399 2.920 0.930 1.00 0.00 H new ATOM 325 N GLN A 21 26.271 4.879 -1.425 1.00 0.00 N ATOM 326 CA GLN A 21 24.915 4.817 -1.944 1.00 0.00 C ATOM 327 C GLN A 21 24.964 4.680 -3.459 1.00 0.00 C ATOM 328 O GLN A 21 25.969 5.014 -4.081 1.00 0.00 O ATOM 329 CB GLN A 21 24.126 6.072 -1.548 1.00 0.00 C ATOM 330 CG GLN A 21 24.867 7.369 -1.829 1.00 0.00 C ATOM 331 CD GLN A 21 23.992 8.593 -1.679 1.00 0.00 C ATOM 332 OE1 GLN A 21 23.869 9.165 -0.596 1.00 0.00 O ATOM 333 NE2 GLN A 21 23.387 9.013 -2.775 1.00 0.00 N ATOM 0 H GLN A 21 26.835 5.631 -1.820 1.00 0.00 H new ATOM 0 HA GLN A 21 24.408 3.952 -1.517 1.00 0.00 H new ATOM 0 HB2 GLN A 21 23.178 6.080 -2.087 1.00 0.00 H new ATOM 0 HB3 GLN A 21 23.888 6.022 -0.485 1.00 0.00 H new ATOM 0 HG2 GLN A 21 25.716 7.451 -1.150 1.00 0.00 H new ATOM 0 HG3 GLN A 21 25.270 7.339 -2.841 1.00 0.00 H new ATOM 0 HE21 GLN A 21 23.515 8.510 -3.653 1.00 0.00 H new ATOM 0 HE22 GLN A 21 22.791 9.840 -2.744 1.00 0.00 H new ATOM 342 N ILE A 22 23.907 4.166 -4.055 1.00 0.00 N ATOM 343 CA ILE A 22 23.838 4.084 -5.502 1.00 0.00 C ATOM 344 C ILE A 22 22.642 4.875 -6.015 1.00 0.00 C ATOM 345 O ILE A 22 21.654 5.050 -5.306 1.00 0.00 O ATOM 346 CB ILE A 22 23.750 2.623 -6.006 1.00 0.00 C ATOM 347 CG1 ILE A 22 24.908 1.786 -5.464 1.00 0.00 C ATOM 348 CG2 ILE A 22 23.766 2.582 -7.524 1.00 0.00 C ATOM 349 CD1 ILE A 22 25.017 0.431 -6.133 1.00 0.00 C ATOM 0 H ILE A 22 23.090 3.801 -3.566 1.00 0.00 H new ATOM 0 HA ILE A 22 24.762 4.512 -5.891 1.00 0.00 H new ATOM 0 HB ILE A 22 22.812 2.203 -5.643 1.00 0.00 H new ATOM 0 HG12 ILE A 22 25.841 2.331 -5.604 1.00 0.00 H new ATOM 0 HG13 ILE A 22 24.778 1.647 -4.391 1.00 0.00 H new ATOM 0 HG21 ILE A 22 23.703 1.547 -7.861 1.00 0.00 H new ATOM 0 HG22 ILE A 22 22.915 3.142 -7.912 1.00 0.00 H new ATOM 0 HG23 ILE A 22 24.691 3.027 -7.890 1.00 0.00 H new ATOM 0 HD11 ILE A 22 25.857 -0.118 -5.707 1.00 0.00 H new ATOM 0 HD12 ILE A 22 24.097 -0.130 -5.971 1.00 0.00 H new ATOM 0 HD13 ILE A 22 25.176 0.565 -7.203 1.00 0.00 H new ATOM 361 N ASP A 23 22.746 5.368 -7.239 1.00 0.00 N ATOM 362 CA ASP A 23 21.689 6.152 -7.841 1.00 0.00 C ATOM 363 C ASP A 23 20.716 5.257 -8.610 1.00 0.00 C ATOM 364 O ASP A 23 20.747 4.029 -8.495 1.00 0.00 O ATOM 365 CB ASP A 23 22.287 7.194 -8.785 1.00 0.00 C ATOM 366 CG ASP A 23 22.795 6.591 -10.080 1.00 0.00 C ATOM 367 OD1 ASP A 23 23.563 5.604 -10.028 1.00 0.00 O ATOM 368 OD2 ASP A 23 22.398 7.089 -11.152 1.00 0.00 O ATOM 0 H ASP A 23 23.562 5.235 -7.837 1.00 0.00 H new ATOM 0 HA ASP A 23 21.140 6.655 -7.045 1.00 0.00 H new ATOM 0 HB2 ASP A 23 21.533 7.947 -9.012 1.00 0.00 H new ATOM 0 HB3 ASP A 23 23.107 7.706 -8.281 1.00 0.00 H new ATOM 373 N PHE A 24 19.865 5.893 -9.397 1.00 0.00 N ATOM 374 CA PHE A 24 18.844 5.217 -10.181 1.00 0.00 C ATOM 375 C PHE A 24 19.471 4.417 -11.323 1.00 0.00 C ATOM 376 O PHE A 24 18.895 3.439 -11.805 1.00 0.00 O ATOM 377 CB PHE A 24 17.882 6.283 -10.724 1.00 0.00 C ATOM 378 CG PHE A 24 16.671 5.751 -11.436 1.00 0.00 C ATOM 379 CD1 PHE A 24 15.634 5.169 -10.726 1.00 0.00 C ATOM 380 CD2 PHE A 24 16.563 5.855 -12.812 1.00 0.00 C ATOM 381 CE1 PHE A 24 14.513 4.695 -11.379 1.00 0.00 C ATOM 382 CE2 PHE A 24 15.444 5.387 -13.470 1.00 0.00 C ATOM 383 CZ PHE A 24 14.417 4.806 -12.752 1.00 0.00 C ATOM 0 H PHE A 24 19.863 6.907 -9.511 1.00 0.00 H new ATOM 0 HA PHE A 24 18.302 4.508 -9.555 1.00 0.00 H new ATOM 0 HB2 PHE A 24 17.550 6.906 -9.894 1.00 0.00 H new ATOM 0 HB3 PHE A 24 18.431 6.930 -11.409 1.00 0.00 H new ATOM 0 HD1 PHE A 24 15.703 5.085 -9.651 1.00 0.00 H new ATOM 0 HD2 PHE A 24 17.364 6.308 -13.377 1.00 0.00 H new ATOM 0 HE1 PHE A 24 13.712 4.238 -10.816 1.00 0.00 H new ATOM 0 HE2 PHE A 24 15.371 5.475 -14.544 1.00 0.00 H new ATOM 0 HZ PHE A 24 13.540 4.439 -13.264 1.00 0.00 H new ATOM 393 N TYR A 25 20.662 4.827 -11.741 1.00 0.00 N ATOM 394 CA TYR A 25 21.324 4.205 -12.875 1.00 0.00 C ATOM 395 C TYR A 25 22.195 3.026 -12.438 1.00 0.00 C ATOM 396 O TYR A 25 22.311 2.039 -13.162 1.00 0.00 O ATOM 397 CB TYR A 25 22.171 5.244 -13.612 1.00 0.00 C ATOM 398 CG TYR A 25 22.487 4.881 -15.043 1.00 0.00 C ATOM 399 CD1 TYR A 25 21.565 5.129 -16.051 1.00 0.00 C ATOM 400 CD2 TYR A 25 23.702 4.304 -15.389 1.00 0.00 C ATOM 401 CE1 TYR A 25 21.842 4.811 -17.365 1.00 0.00 C ATOM 402 CE2 TYR A 25 23.987 3.982 -16.702 1.00 0.00 C ATOM 403 CZ TYR A 25 23.054 4.238 -17.686 1.00 0.00 C ATOM 404 OH TYR A 25 23.336 3.924 -18.998 1.00 0.00 O ATOM 0 H TYR A 25 21.187 5.588 -11.310 1.00 0.00 H new ATOM 0 HA TYR A 25 20.557 3.818 -13.546 1.00 0.00 H new ATOM 0 HB2 TYR A 25 21.647 6.200 -13.598 1.00 0.00 H new ATOM 0 HB3 TYR A 25 23.106 5.385 -13.070 1.00 0.00 H new ATOM 0 HD1 TYR A 25 20.615 5.578 -15.803 1.00 0.00 H new ATOM 0 HD2 TYR A 25 24.434 4.104 -14.621 1.00 0.00 H new ATOM 0 HE1 TYR A 25 21.114 5.010 -18.137 1.00 0.00 H new ATOM 0 HE2 TYR A 25 24.935 3.532 -16.957 1.00 0.00 H new ATOM 0 HH TYR A 25 24.231 3.529 -19.055 1.00 0.00 H new ATOM 414 N GLY A 26 22.802 3.117 -11.258 1.00 0.00 N ATOM 415 CA GLY A 26 23.694 2.066 -10.812 1.00 0.00 C ATOM 416 C GLY A 26 25.143 2.433 -11.038 1.00 0.00 C ATOM 417 O GLY A 26 25.998 1.562 -11.201 1.00 0.00 O ATOM 0 H GLY A 26 22.692 3.895 -10.608 1.00 0.00 H new ATOM 0 HA2 GLY A 26 23.528 1.873 -9.752 1.00 0.00 H new ATOM 0 HA3 GLY A 26 23.465 1.143 -11.344 1.00 0.00 H new ATOM 421 N ASP A 27 25.416 3.731 -11.033 1.00 0.00 N ATOM 422 CA ASP A 27 26.747 4.247 -11.342 1.00 0.00 C ATOM 423 C ASP A 27 27.602 4.328 -10.075 1.00 0.00 C ATOM 424 O ASP A 27 28.816 4.522 -10.146 1.00 0.00 O ATOM 425 CB ASP A 27 26.621 5.635 -11.984 1.00 0.00 C ATOM 426 CG ASP A 27 27.855 6.051 -12.761 1.00 0.00 C ATOM 427 OD1 ASP A 27 28.828 6.526 -12.143 1.00 0.00 O ATOM 428 OD2 ASP A 27 27.846 5.917 -14.004 1.00 0.00 O ATOM 0 H ASP A 27 24.728 4.453 -10.817 1.00 0.00 H new ATOM 0 HA ASP A 27 27.236 3.568 -12.040 1.00 0.00 H new ATOM 0 HB2 ASP A 27 25.760 5.642 -12.652 1.00 0.00 H new ATOM 0 HB3 ASP A 27 26.425 6.372 -11.205 1.00 0.00 H new ATOM 433 N GLU A 28 26.943 4.137 -8.929 1.00 0.00 N ATOM 434 CA GLU A 28 27.554 4.279 -7.601 1.00 0.00 C ATOM 435 C GLU A 28 27.788 5.751 -7.280 1.00 0.00 C ATOM 436 O GLU A 28 28.509 6.452 -7.991 1.00 0.00 O ATOM 437 CB GLU A 28 28.870 3.502 -7.468 1.00 0.00 C ATOM 438 CG GLU A 28 29.348 3.381 -6.030 1.00 0.00 C ATOM 439 CD GLU A 28 30.754 2.828 -5.916 1.00 0.00 C ATOM 440 OE1 GLU A 28 30.971 1.655 -6.278 1.00 0.00 O ATOM 441 OE2 GLU A 28 31.655 3.566 -5.460 1.00 0.00 O ATOM 0 H GLU A 28 25.958 3.876 -8.895 1.00 0.00 H new ATOM 0 HA GLU A 28 26.852 3.852 -6.885 1.00 0.00 H new ATOM 0 HB2 GLU A 28 28.740 2.504 -7.887 1.00 0.00 H new ATOM 0 HB3 GLU A 28 29.639 3.998 -8.060 1.00 0.00 H new ATOM 0 HG2 GLU A 28 29.310 4.362 -5.557 1.00 0.00 H new ATOM 0 HG3 GLU A 28 28.664 2.735 -5.479 1.00 0.00 H new ATOM 448 N VAL A 29 27.176 6.208 -6.203 1.00 0.00 N ATOM 449 CA VAL A 29 27.251 7.602 -5.813 1.00 0.00 C ATOM 450 C VAL A 29 28.011 7.749 -4.505 1.00 0.00 C ATOM 451 O VAL A 29 27.563 7.289 -3.456 1.00 0.00 O ATOM 452 CB VAL A 29 25.847 8.216 -5.656 1.00 0.00 C ATOM 453 CG1 VAL A 29 25.937 9.691 -5.320 1.00 0.00 C ATOM 454 CG2 VAL A 29 25.025 8.008 -6.914 1.00 0.00 C ATOM 0 H VAL A 29 26.617 5.627 -5.578 1.00 0.00 H new ATOM 0 HA VAL A 29 27.779 8.134 -6.604 1.00 0.00 H new ATOM 0 HB VAL A 29 25.348 7.707 -4.831 1.00 0.00 H new ATOM 0 HG11 VAL A 29 24.933 10.102 -5.214 1.00 0.00 H new ATOM 0 HG12 VAL A 29 26.482 9.818 -4.385 1.00 0.00 H new ATOM 0 HG13 VAL A 29 26.461 10.215 -6.119 1.00 0.00 H new ATOM 0 HG21 VAL A 29 24.037 8.450 -6.780 1.00 0.00 H new ATOM 0 HG22 VAL A 29 25.524 8.484 -7.758 1.00 0.00 H new ATOM 0 HG23 VAL A 29 24.922 6.941 -7.109 1.00 0.00 H new ATOM 464 N THR A 30 29.167 8.372 -4.576 1.00 0.00 N ATOM 465 CA THR A 30 29.968 8.614 -3.397 1.00 0.00 C ATOM 466 C THR A 30 29.823 10.074 -2.974 1.00 0.00 C ATOM 467 O THR A 30 29.278 10.881 -3.725 1.00 0.00 O ATOM 468 CB THR A 30 31.449 8.275 -3.667 1.00 0.00 C ATOM 469 OG1 THR A 30 31.999 9.176 -4.638 1.00 0.00 O ATOM 470 CG2 THR A 30 31.580 6.840 -4.169 1.00 0.00 C ATOM 0 H THR A 30 29.575 8.722 -5.443 1.00 0.00 H new ATOM 0 HA THR A 30 29.617 7.971 -2.590 1.00 0.00 H new ATOM 0 HB THR A 30 32.000 8.379 -2.733 1.00 0.00 H new ATOM 0 HG1 THR A 30 31.572 9.022 -5.506 1.00 0.00 H new ATOM 0 HG21 THR A 30 32.630 6.614 -4.355 1.00 0.00 H new ATOM 0 HG22 THR A 30 31.189 6.154 -3.417 1.00 0.00 H new ATOM 0 HG23 THR A 30 31.014 6.725 -5.094 1.00 0.00 H new ATOM 478 N PRO A 31 30.286 10.435 -1.765 1.00 0.00 N ATOM 479 CA PRO A 31 30.255 11.828 -1.280 1.00 0.00 C ATOM 480 C PRO A 31 30.974 12.813 -2.210 1.00 0.00 C ATOM 481 O PRO A 31 30.856 14.029 -2.050 1.00 0.00 O ATOM 482 CB PRO A 31 30.982 11.751 0.065 1.00 0.00 C ATOM 483 CG PRO A 31 30.830 10.337 0.503 1.00 0.00 C ATOM 484 CD PRO A 31 30.832 9.513 -0.752 1.00 0.00 C ATOM 0 HA PRO A 31 29.233 12.201 -1.220 1.00 0.00 H new ATOM 0 HB2 PRO A 31 32.033 12.022 -0.038 1.00 0.00 H new ATOM 0 HB3 PRO A 31 30.545 12.438 0.790 1.00 0.00 H new ATOM 0 HG2 PRO A 31 31.646 10.043 1.164 1.00 0.00 H new ATOM 0 HG3 PRO A 31 29.903 10.198 1.059 1.00 0.00 H new ATOM 0 HD2 PRO A 31 31.836 9.179 -1.012 1.00 0.00 H new ATOM 0 HD3 PRO A 31 30.216 8.620 -0.648 1.00 0.00 H new ATOM 492 N VAL A 32 31.718 12.284 -3.176 1.00 0.00 N ATOM 493 CA VAL A 32 32.462 13.112 -4.117 1.00 0.00 C ATOM 494 C VAL A 32 31.705 13.220 -5.447 1.00 0.00 C ATOM 495 O VAL A 32 32.159 13.865 -6.396 1.00 0.00 O ATOM 496 CB VAL A 32 33.876 12.532 -4.364 1.00 0.00 C ATOM 497 CG1 VAL A 32 34.776 13.544 -5.060 1.00 0.00 C ATOM 498 CG2 VAL A 32 34.504 12.074 -3.056 1.00 0.00 C ATOM 0 H VAL A 32 31.822 11.281 -3.328 1.00 0.00 H new ATOM 0 HA VAL A 32 32.565 14.106 -3.683 1.00 0.00 H new ATOM 0 HB VAL A 32 33.770 11.669 -5.021 1.00 0.00 H new ATOM 0 HG11 VAL A 32 35.761 13.106 -5.219 1.00 0.00 H new ATOM 0 HG12 VAL A 32 34.341 13.817 -6.021 1.00 0.00 H new ATOM 0 HG13 VAL A 32 34.871 14.435 -4.439 1.00 0.00 H new ATOM 0 HG21 VAL A 32 35.497 11.670 -3.251 1.00 0.00 H new ATOM 0 HG22 VAL A 32 34.585 12.921 -2.375 1.00 0.00 H new ATOM 0 HG23 VAL A 32 33.881 11.303 -2.604 1.00 0.00 H new ATOM 508 N ASP A 33 30.538 12.595 -5.511 1.00 0.00 N ATOM 509 CA ASP A 33 29.736 12.598 -6.728 1.00 0.00 C ATOM 510 C ASP A 33 28.517 13.488 -6.560 1.00 0.00 C ATOM 511 O ASP A 33 27.956 13.586 -5.469 1.00 0.00 O ATOM 512 CB ASP A 33 29.288 11.182 -7.105 1.00 0.00 C ATOM 513 CG ASP A 33 30.448 10.258 -7.414 1.00 0.00 C ATOM 514 OD1 ASP A 33 31.259 10.586 -8.306 1.00 0.00 O ATOM 515 OD2 ASP A 33 30.549 9.193 -6.773 1.00 0.00 O ATOM 0 H ASP A 33 30.124 12.079 -4.734 1.00 0.00 H new ATOM 0 HA ASP A 33 30.361 12.988 -7.531 1.00 0.00 H new ATOM 0 HB2 ASP A 33 28.704 10.762 -6.287 1.00 0.00 H new ATOM 0 HB3 ASP A 33 28.630 11.234 -7.973 1.00 0.00 H new ATOM 520 N ASP A 34 28.114 14.132 -7.642 1.00 0.00 N ATOM 521 CA ASP A 34 26.967 15.028 -7.614 1.00 0.00 C ATOM 522 C ASP A 34 25.693 14.259 -7.931 1.00 0.00 C ATOM 523 O ASP A 34 25.636 13.517 -8.918 1.00 0.00 O ATOM 524 CB ASP A 34 27.158 16.160 -8.623 1.00 0.00 C ATOM 525 CG ASP A 34 26.687 17.492 -8.085 1.00 0.00 C ATOM 526 OD1 ASP A 34 27.366 18.039 -7.190 1.00 0.00 O ATOM 527 OD2 ASP A 34 25.661 18.007 -8.567 1.00 0.00 O ATOM 0 H ASP A 34 28.564 14.052 -8.554 1.00 0.00 H new ATOM 0 HA ASP A 34 26.882 15.456 -6.615 1.00 0.00 H new ATOM 0 HB2 ASP A 34 28.212 16.231 -8.891 1.00 0.00 H new ATOM 0 HB3 ASP A 34 26.612 15.926 -9.537 1.00 0.00 H new ATOM 532 N TYR A 35 24.671 14.431 -7.106 1.00 0.00 N ATOM 533 CA TYR A 35 23.429 13.694 -7.277 1.00 0.00 C ATOM 534 C TYR A 35 22.253 14.462 -6.690 1.00 0.00 C ATOM 535 O TYR A 35 22.433 15.359 -5.873 1.00 0.00 O ATOM 536 CB TYR A 35 23.533 12.318 -6.610 1.00 0.00 C ATOM 537 CG TYR A 35 23.558 12.362 -5.095 1.00 0.00 C ATOM 538 CD1 TYR A 35 24.715 12.708 -4.402 1.00 0.00 C ATOM 539 CD2 TYR A 35 22.425 12.048 -4.358 1.00 0.00 C ATOM 540 CE1 TYR A 35 24.736 12.736 -3.020 1.00 0.00 C ATOM 541 CE2 TYR A 35 22.437 12.076 -2.978 1.00 0.00 C ATOM 542 CZ TYR A 35 23.595 12.421 -2.313 1.00 0.00 C ATOM 543 OH TYR A 35 23.612 12.444 -0.938 1.00 0.00 O ATOM 0 H TYR A 35 24.677 15.073 -6.313 1.00 0.00 H new ATOM 0 HA TYR A 35 23.259 13.565 -8.346 1.00 0.00 H new ATOM 0 HB2 TYR A 35 22.689 11.707 -6.931 1.00 0.00 H new ATOM 0 HB3 TYR A 35 24.438 11.823 -6.963 1.00 0.00 H new ATOM 0 HD1 TYR A 35 25.610 12.958 -4.953 1.00 0.00 H new ATOM 0 HD2 TYR A 35 21.516 11.776 -4.874 1.00 0.00 H new ATOM 0 HE1 TYR A 35 25.642 13.003 -2.497 1.00 0.00 H new ATOM 0 HE2 TYR A 35 21.545 11.829 -2.422 1.00 0.00 H new ATOM 0 HH TYR A 35 23.686 11.528 -0.596 1.00 0.00 H new ATOM 553 N VAL A 36 21.054 14.093 -7.106 1.00 0.00 N ATOM 554 CA VAL A 36 19.831 14.696 -6.597 1.00 0.00 C ATOM 555 C VAL A 36 18.885 13.593 -6.133 1.00 0.00 C ATOM 556 O VAL A 36 18.946 12.471 -6.642 1.00 0.00 O ATOM 557 CB VAL A 36 19.162 15.585 -7.679 1.00 0.00 C ATOM 558 CG1 VAL A 36 17.755 16.000 -7.283 1.00 0.00 C ATOM 559 CG2 VAL A 36 20.003 16.823 -7.935 1.00 0.00 C ATOM 0 H VAL A 36 20.899 13.367 -7.806 1.00 0.00 H new ATOM 0 HA VAL A 36 20.071 15.339 -5.751 1.00 0.00 H new ATOM 0 HB VAL A 36 19.094 14.990 -8.590 1.00 0.00 H new ATOM 0 HG11 VAL A 36 17.324 16.621 -8.068 1.00 0.00 H new ATOM 0 HG12 VAL A 36 17.139 15.111 -7.144 1.00 0.00 H new ATOM 0 HG13 VAL A 36 17.791 16.566 -6.352 1.00 0.00 H new ATOM 0 HG21 VAL A 36 19.523 17.438 -8.696 1.00 0.00 H new ATOM 0 HG22 VAL A 36 20.098 17.396 -7.012 1.00 0.00 H new ATOM 0 HG23 VAL A 36 20.993 16.525 -8.281 1.00 0.00 H new ATOM 569 N ILE A 37 18.052 13.885 -5.143 1.00 0.00 N ATOM 570 CA ILE A 37 17.134 12.889 -4.622 1.00 0.00 C ATOM 571 C ILE A 37 15.681 13.293 -4.871 1.00 0.00 C ATOM 572 O ILE A 37 15.185 14.323 -4.363 1.00 0.00 O ATOM 573 CB ILE A 37 17.387 12.601 -3.123 1.00 0.00 C ATOM 574 CG1 ILE A 37 18.767 11.948 -2.958 1.00 0.00 C ATOM 575 CG2 ILE A 37 16.296 11.707 -2.548 1.00 0.00 C ATOM 576 CD1 ILE A 37 19.091 11.519 -1.541 1.00 0.00 C ATOM 0 H ILE A 37 17.995 14.797 -4.690 1.00 0.00 H new ATOM 0 HA ILE A 37 17.321 11.962 -5.164 1.00 0.00 H new ATOM 0 HB ILE A 37 17.365 13.541 -2.572 1.00 0.00 H new ATOM 0 HG12 ILE A 37 18.824 11.077 -3.610 1.00 0.00 H new ATOM 0 HG13 ILE A 37 19.530 12.649 -3.296 1.00 0.00 H new ATOM 0 HG21 ILE A 37 16.497 11.520 -1.493 1.00 0.00 H new ATOM 0 HG22 ILE A 37 15.330 12.200 -2.651 1.00 0.00 H new ATOM 0 HG23 ILE A 37 16.279 10.760 -3.088 1.00 0.00 H new ATOM 0 HD11 ILE A 37 20.083 11.068 -1.515 1.00 0.00 H new ATOM 0 HD12 ILE A 37 19.070 12.388 -0.884 1.00 0.00 H new ATOM 0 HD13 ILE A 37 18.353 10.791 -1.203 1.00 0.00 H new ATOM 588 N ASP A 38 15.015 12.459 -5.666 1.00 0.00 N ATOM 589 CA ASP A 38 13.629 12.672 -6.054 1.00 0.00 C ATOM 590 C ASP A 38 12.730 11.711 -5.294 1.00 0.00 C ATOM 591 O ASP A 38 12.506 10.579 -5.723 1.00 0.00 O ATOM 592 CB ASP A 38 13.429 12.449 -7.564 1.00 0.00 C ATOM 593 CG ASP A 38 14.010 13.546 -8.440 1.00 0.00 C ATOM 594 OD1 ASP A 38 15.138 14.002 -8.165 1.00 0.00 O ATOM 595 OD2 ASP A 38 13.344 13.930 -9.430 1.00 0.00 O ATOM 0 H ASP A 38 15.427 11.613 -6.060 1.00 0.00 H new ATOM 0 HA ASP A 38 13.371 13.704 -5.815 1.00 0.00 H new ATOM 0 HB2 ASP A 38 13.884 11.498 -7.842 1.00 0.00 H new ATOM 0 HB3 ASP A 38 12.362 12.364 -7.769 1.00 0.00 H new ATOM 600 N GLY A 39 12.279 12.138 -4.131 1.00 0.00 N ATOM 601 CA GLY A 39 11.308 11.366 -3.382 1.00 0.00 C ATOM 602 C GLY A 39 11.872 10.076 -2.824 1.00 0.00 C ATOM 603 O GLY A 39 11.245 9.024 -2.923 1.00 0.00 O ATOM 0 H GLY A 39 12.567 13.010 -3.687 1.00 0.00 H new ATOM 0 HA2 GLY A 39 10.926 11.973 -2.561 1.00 0.00 H new ATOM 0 HA3 GLY A 39 10.461 11.135 -4.028 1.00 0.00 H new ATOM 607 N GLY A 40 13.059 10.151 -2.241 1.00 0.00 N ATOM 608 CA GLY A 40 13.666 8.976 -1.649 1.00 0.00 C ATOM 609 C GLY A 40 14.574 8.245 -2.615 1.00 0.00 C ATOM 610 O GLY A 40 15.455 7.492 -2.198 1.00 0.00 O ATOM 0 H GLY A 40 13.613 11.004 -2.167 1.00 0.00 H new ATOM 0 HA2 GLY A 40 14.238 9.270 -0.769 1.00 0.00 H new ATOM 0 HA3 GLY A 40 12.883 8.299 -1.308 1.00 0.00 H new ATOM 614 N GLU A 41 14.362 8.459 -3.904 1.00 0.00 N ATOM 615 CA GLU A 41 15.194 7.832 -4.916 1.00 0.00 C ATOM 616 C GLU A 41 16.363 8.733 -5.280 1.00 0.00 C ATOM 617 O GLU A 41 16.201 9.931 -5.494 1.00 0.00 O ATOM 618 CB GLU A 41 14.378 7.496 -6.166 1.00 0.00 C ATOM 619 CG GLU A 41 13.304 6.446 -5.929 1.00 0.00 C ATOM 620 CD GLU A 41 13.867 5.120 -5.462 1.00 0.00 C ATOM 621 OE1 GLU A 41 14.324 4.326 -6.311 1.00 0.00 O ATOM 622 OE2 GLU A 41 13.847 4.854 -4.242 1.00 0.00 O ATOM 0 H GLU A 41 13.624 9.059 -4.272 1.00 0.00 H new ATOM 0 HA GLU A 41 15.583 6.902 -4.501 1.00 0.00 H new ATOM 0 HB2 GLU A 41 13.908 8.406 -6.538 1.00 0.00 H new ATOM 0 HB3 GLU A 41 15.053 7.144 -6.946 1.00 0.00 H new ATOM 0 HG2 GLU A 41 12.598 6.817 -5.186 1.00 0.00 H new ATOM 0 HG3 GLU A 41 12.744 6.292 -6.851 1.00 0.00 H new ATOM 629 N ILE A 42 17.537 8.142 -5.333 1.00 0.00 N ATOM 630 CA ILE A 42 18.759 8.859 -5.653 1.00 0.00 C ATOM 631 C ILE A 42 19.016 8.802 -7.151 1.00 0.00 C ATOM 632 O ILE A 42 18.915 7.739 -7.748 1.00 0.00 O ATOM 633 CB ILE A 42 19.958 8.223 -4.919 1.00 0.00 C ATOM 634 CG1 ILE A 42 19.720 8.220 -3.407 1.00 0.00 C ATOM 635 CG2 ILE A 42 21.246 8.961 -5.256 1.00 0.00 C ATOM 636 CD1 ILE A 42 20.640 7.287 -2.648 1.00 0.00 C ATOM 0 H ILE A 42 17.675 7.147 -5.155 1.00 0.00 H new ATOM 0 HA ILE A 42 18.644 9.895 -5.336 1.00 0.00 H new ATOM 0 HB ILE A 42 20.058 7.191 -5.254 1.00 0.00 H new ATOM 0 HG12 ILE A 42 19.849 9.233 -3.026 1.00 0.00 H new ATOM 0 HG13 ILE A 42 18.686 7.935 -3.211 1.00 0.00 H new ATOM 0 HG21 ILE A 42 22.080 8.497 -4.729 1.00 0.00 H new ATOM 0 HG22 ILE A 42 21.423 8.911 -6.330 1.00 0.00 H new ATOM 0 HG23 ILE A 42 21.158 10.004 -4.951 1.00 0.00 H new ATOM 0 HD11 ILE A 42 20.413 7.338 -1.583 1.00 0.00 H new ATOM 0 HD12 ILE A 42 20.495 6.266 -3.001 1.00 0.00 H new ATOM 0 HD13 ILE A 42 21.676 7.584 -2.813 1.00 0.00 H new ATOM 648 N ILE A 43 19.319 9.935 -7.764 1.00 0.00 N ATOM 649 CA ILE A 43 19.709 9.945 -9.167 1.00 0.00 C ATOM 650 C ILE A 43 20.983 10.760 -9.346 1.00 0.00 C ATOM 651 O ILE A 43 21.058 11.912 -8.911 1.00 0.00 O ATOM 652 CB ILE A 43 18.618 10.524 -10.107 1.00 0.00 C ATOM 653 CG1 ILE A 43 17.226 9.968 -9.782 1.00 0.00 C ATOM 654 CG2 ILE A 43 18.968 10.219 -11.560 1.00 0.00 C ATOM 655 CD1 ILE A 43 16.496 10.736 -8.700 1.00 0.00 C ATOM 0 H ILE A 43 19.303 10.852 -7.318 1.00 0.00 H new ATOM 0 HA ILE A 43 19.864 8.903 -9.445 1.00 0.00 H new ATOM 0 HB ILE A 43 18.589 11.602 -9.951 1.00 0.00 H new ATOM 0 HG12 ILE A 43 16.622 9.975 -10.689 1.00 0.00 H new ATOM 0 HG13 ILE A 43 17.324 8.928 -9.472 1.00 0.00 H new ATOM 0 HG21 ILE A 43 18.198 10.628 -12.213 1.00 0.00 H new ATOM 0 HG22 ILE A 43 19.929 10.670 -11.805 1.00 0.00 H new ATOM 0 HG23 ILE A 43 19.027 9.140 -11.701 1.00 0.00 H new ATOM 0 HD11 ILE A 43 15.520 10.282 -8.527 1.00 0.00 H new ATOM 0 HD12 ILE A 43 17.078 10.708 -7.779 1.00 0.00 H new ATOM 0 HD13 ILE A 43 16.364 11.771 -9.015 1.00 0.00 H new ATOM 667 N LEU A 44 21.994 10.156 -9.961 1.00 0.00 N ATOM 668 CA LEU A 44 23.237 10.856 -10.245 1.00 0.00 C ATOM 669 C LEU A 44 22.960 12.002 -11.214 1.00 0.00 C ATOM 670 O LEU A 44 22.133 11.865 -12.116 1.00 0.00 O ATOM 671 CB LEU A 44 24.263 9.891 -10.844 1.00 0.00 C ATOM 672 CG LEU A 44 25.697 10.416 -10.915 1.00 0.00 C ATOM 673 CD1 LEU A 44 26.309 10.483 -9.525 1.00 0.00 C ATOM 674 CD2 LEU A 44 26.540 9.541 -11.829 1.00 0.00 C ATOM 0 H LEU A 44 21.975 9.185 -10.271 1.00 0.00 H new ATOM 0 HA LEU A 44 23.645 11.259 -9.318 1.00 0.00 H new ATOM 0 HB2 LEU A 44 24.259 8.973 -10.256 1.00 0.00 H new ATOM 0 HB3 LEU A 44 23.941 9.626 -11.851 1.00 0.00 H new ATOM 0 HG LEU A 44 25.675 11.424 -11.329 1.00 0.00 H new ATOM 0 HD11 LEU A 44 27.330 10.859 -9.595 1.00 0.00 H new ATOM 0 HD12 LEU A 44 25.718 11.152 -8.899 1.00 0.00 H new ATOM 0 HD13 LEU A 44 26.319 9.487 -9.083 1.00 0.00 H new ATOM 0 HD21 LEU A 44 27.558 9.930 -11.868 1.00 0.00 H new ATOM 0 HD22 LEU A 44 26.555 8.521 -11.444 1.00 0.00 H new ATOM 0 HD23 LEU A 44 26.112 9.544 -12.832 1.00 0.00 H new ATOM 686 N ARG A 45 23.657 13.121 -11.036 1.00 0.00 N ATOM 687 CA ARG A 45 23.405 14.328 -11.827 1.00 0.00 C ATOM 688 C ARG A 45 23.664 14.120 -13.323 1.00 0.00 C ATOM 689 O ARG A 45 23.361 14.992 -14.134 1.00 0.00 O ATOM 690 CB ARG A 45 24.245 15.495 -11.297 1.00 0.00 C ATOM 691 CG ARG A 45 23.623 16.193 -10.095 1.00 0.00 C ATOM 692 CD ARG A 45 22.435 17.048 -10.505 1.00 0.00 C ATOM 693 NE ARG A 45 22.836 18.165 -11.357 1.00 0.00 N ATOM 694 CZ ARG A 45 22.322 18.411 -12.560 1.00 0.00 C ATOM 695 NH1 ARG A 45 21.356 17.642 -13.045 1.00 0.00 N ATOM 696 NH2 ARG A 45 22.769 19.434 -13.274 1.00 0.00 N ATOM 0 H ARG A 45 24.404 13.220 -10.349 1.00 0.00 H new ATOM 0 HA ARG A 45 22.346 14.564 -11.719 1.00 0.00 H new ATOM 0 HB2 ARG A 45 25.233 15.126 -11.022 1.00 0.00 H new ATOM 0 HB3 ARG A 45 24.388 16.222 -12.096 1.00 0.00 H new ATOM 0 HG2 ARG A 45 23.303 15.449 -9.365 1.00 0.00 H new ATOM 0 HG3 ARG A 45 24.372 16.817 -9.607 1.00 0.00 H new ATOM 0 HD2 ARG A 45 21.709 16.431 -11.034 1.00 0.00 H new ATOM 0 HD3 ARG A 45 21.939 17.431 -9.613 1.00 0.00 H new ATOM 0 HE ARG A 45 23.556 18.797 -11.008 1.00 0.00 H new ATOM 0 HH11 ARG A 45 21.004 16.858 -12.496 1.00 0.00 H new ATOM 0 HH12 ARG A 45 20.965 17.835 -13.967 1.00 0.00 H new ATOM 0 HH21 ARG A 45 23.506 20.032 -12.902 1.00 0.00 H new ATOM 0 HH22 ARG A 45 22.376 19.623 -14.196 1.00 0.00 H new ATOM 710 N GLU A 46 24.202 12.965 -13.687 1.00 0.00 N ATOM 711 CA GLU A 46 24.408 12.629 -15.090 1.00 0.00 C ATOM 712 C GLU A 46 23.077 12.347 -15.786 1.00 0.00 C ATOM 713 O GLU A 46 22.721 13.015 -16.754 1.00 0.00 O ATOM 714 CB GLU A 46 25.350 11.431 -15.216 1.00 0.00 C ATOM 715 CG GLU A 46 26.796 11.762 -14.875 1.00 0.00 C ATOM 716 CD GLU A 46 27.461 12.641 -15.919 1.00 0.00 C ATOM 717 OE1 GLU A 46 26.790 13.538 -16.473 1.00 0.00 O ATOM 718 OE2 GLU A 46 28.658 12.427 -16.205 1.00 0.00 O ATOM 0 H GLU A 46 24.504 12.244 -13.031 1.00 0.00 H new ATOM 0 HA GLU A 46 24.868 13.485 -15.583 1.00 0.00 H new ATOM 0 HB2 GLU A 46 25.003 10.634 -14.559 1.00 0.00 H new ATOM 0 HB3 GLU A 46 25.303 11.047 -16.235 1.00 0.00 H new ATOM 0 HG2 GLU A 46 26.831 12.265 -13.908 1.00 0.00 H new ATOM 0 HG3 GLU A 46 27.362 10.836 -14.773 1.00 0.00 H new ATOM 725 N ASN A 47 22.327 11.379 -15.275 1.00 0.00 N ATOM 726 CA ASN A 47 21.052 11.005 -15.885 1.00 0.00 C ATOM 727 C ASN A 47 19.889 11.717 -15.204 1.00 0.00 C ATOM 728 O ASN A 47 18.729 11.544 -15.581 1.00 0.00 O ATOM 729 CB ASN A 47 20.845 9.487 -15.834 1.00 0.00 C ATOM 730 CG ASN A 47 21.812 8.739 -16.737 1.00 0.00 C ATOM 731 OD1 ASN A 47 21.549 8.546 -17.925 1.00 0.00 O ATOM 732 ND2 ASN A 47 22.922 8.285 -16.176 1.00 0.00 N ATOM 0 H ASN A 47 22.575 10.840 -14.445 1.00 0.00 H new ATOM 0 HA ASN A 47 21.082 11.316 -16.929 1.00 0.00 H new ATOM 0 HB2 ASN A 47 20.969 9.141 -14.808 1.00 0.00 H new ATOM 0 HB3 ASN A 47 19.822 9.253 -16.128 1.00 0.00 H new ATOM 0 HD21 ASN A 47 23.594 7.755 -16.731 1.00 0.00 H new ATOM 0 HD22 ASN A 47 23.105 8.465 -15.189 1.00 0.00 H new ATOM 739 N LEU A 48 20.218 12.535 -14.210 1.00 0.00 N ATOM 740 CA LEU A 48 19.224 13.301 -13.461 1.00 0.00 C ATOM 741 C LEU A 48 18.497 14.285 -14.386 1.00 0.00 C ATOM 742 O LEU A 48 17.339 14.631 -14.155 1.00 0.00 O ATOM 743 CB LEU A 48 19.930 14.024 -12.297 1.00 0.00 C ATOM 744 CG LEU A 48 19.041 14.692 -11.237 1.00 0.00 C ATOM 745 CD1 LEU A 48 18.663 16.097 -11.660 1.00 0.00 C ATOM 746 CD2 LEU A 48 17.796 13.862 -10.964 1.00 0.00 C ATOM 0 H LEU A 48 21.178 12.687 -13.900 1.00 0.00 H new ATOM 0 HA LEU A 48 18.467 12.633 -13.050 1.00 0.00 H new ATOM 0 HB2 LEU A 48 20.572 13.302 -11.792 1.00 0.00 H new ATOM 0 HB3 LEU A 48 20.581 14.788 -12.721 1.00 0.00 H new ATOM 0 HG LEU A 48 19.614 14.754 -10.312 1.00 0.00 H new ATOM 0 HD11 LEU A 48 18.034 16.551 -10.894 1.00 0.00 H new ATOM 0 HD12 LEU A 48 19.566 16.694 -11.788 1.00 0.00 H new ATOM 0 HD13 LEU A 48 18.117 16.059 -12.603 1.00 0.00 H new ATOM 0 HD21 LEU A 48 17.186 14.359 -10.210 1.00 0.00 H new ATOM 0 HD22 LEU A 48 17.221 13.755 -11.884 1.00 0.00 H new ATOM 0 HD23 LEU A 48 18.088 12.876 -10.602 1.00 0.00 H new ATOM 758 N GLU A 49 19.180 14.701 -15.447 1.00 0.00 N ATOM 759 CA GLU A 49 18.603 15.604 -16.444 1.00 0.00 C ATOM 760 C GLU A 49 17.303 15.027 -17.008 1.00 0.00 C ATOM 761 O GLU A 49 16.277 15.705 -17.072 1.00 0.00 O ATOM 762 CB GLU A 49 19.602 15.817 -17.582 1.00 0.00 C ATOM 763 CG GLU A 49 20.978 16.256 -17.111 1.00 0.00 C ATOM 764 CD GLU A 49 21.004 17.685 -16.612 1.00 0.00 C ATOM 765 OE1 GLU A 49 20.487 17.949 -15.507 1.00 0.00 O ATOM 766 OE2 GLU A 49 21.556 18.550 -17.324 1.00 0.00 O ATOM 0 H GLU A 49 20.143 14.426 -15.642 1.00 0.00 H new ATOM 0 HA GLU A 49 18.382 16.557 -15.963 1.00 0.00 H new ATOM 0 HB2 GLU A 49 19.699 14.890 -18.147 1.00 0.00 H new ATOM 0 HB3 GLU A 49 19.205 16.567 -18.266 1.00 0.00 H new ATOM 0 HG2 GLU A 49 21.312 15.592 -16.313 1.00 0.00 H new ATOM 0 HG3 GLU A 49 21.688 16.150 -17.932 1.00 0.00 H new ATOM 773 N ARG A 50 17.363 13.757 -17.393 1.00 0.00 N ATOM 774 CA ARG A 50 16.206 13.047 -17.928 1.00 0.00 C ATOM 775 C ARG A 50 15.094 12.981 -16.887 1.00 0.00 C ATOM 776 O ARG A 50 13.915 13.197 -17.199 1.00 0.00 O ATOM 777 CB ARG A 50 16.635 11.638 -18.367 1.00 0.00 C ATOM 778 CG ARG A 50 15.491 10.690 -18.702 1.00 0.00 C ATOM 779 CD ARG A 50 14.495 11.304 -19.669 1.00 0.00 C ATOM 780 NE ARG A 50 15.121 11.805 -20.890 1.00 0.00 N ATOM 781 CZ ARG A 50 14.445 12.087 -21.996 1.00 0.00 C ATOM 782 NH1 ARG A 50 13.144 11.832 -22.062 1.00 0.00 N ATOM 783 NH2 ARG A 50 15.071 12.614 -23.037 1.00 0.00 N ATOM 0 H ARG A 50 18.211 13.192 -17.344 1.00 0.00 H new ATOM 0 HA ARG A 50 15.818 13.584 -18.794 1.00 0.00 H new ATOM 0 HB2 ARG A 50 17.280 11.727 -19.241 1.00 0.00 H new ATOM 0 HB3 ARG A 50 17.234 11.193 -17.572 1.00 0.00 H new ATOM 0 HG2 ARG A 50 15.896 9.775 -19.134 1.00 0.00 H new ATOM 0 HG3 ARG A 50 14.976 10.408 -17.784 1.00 0.00 H new ATOM 0 HD2 ARG A 50 13.744 10.558 -19.931 1.00 0.00 H new ATOM 0 HD3 ARG A 50 13.972 12.122 -19.173 1.00 0.00 H new ATOM 0 HE ARG A 50 16.131 11.945 -20.892 1.00 0.00 H new ATOM 0 HH11 ARG A 50 12.664 11.419 -21.262 1.00 0.00 H new ATOM 0 HH12 ARG A 50 12.624 12.049 -22.912 1.00 0.00 H new ATOM 0 HH21 ARG A 50 16.072 12.803 -22.988 1.00 0.00 H new ATOM 0 HH22 ARG A 50 14.552 12.831 -23.888 1.00 0.00 H new ATOM 797 N TYR A 51 15.480 12.718 -15.647 1.00 0.00 N ATOM 798 CA TYR A 51 14.522 12.605 -14.564 1.00 0.00 C ATOM 799 C TYR A 51 13.808 13.938 -14.347 1.00 0.00 C ATOM 800 O TYR A 51 12.607 13.972 -14.097 1.00 0.00 O ATOM 801 CB TYR A 51 15.215 12.149 -13.275 1.00 0.00 C ATOM 802 CG TYR A 51 14.368 11.210 -12.446 1.00 0.00 C ATOM 803 CD1 TYR A 51 13.312 11.686 -11.681 1.00 0.00 C ATOM 804 CD2 TYR A 51 14.611 9.841 -12.447 1.00 0.00 C ATOM 805 CE1 TYR A 51 12.526 10.826 -10.938 1.00 0.00 C ATOM 806 CE2 TYR A 51 13.825 8.975 -11.711 1.00 0.00 C ATOM 807 CZ TYR A 51 12.785 9.473 -10.957 1.00 0.00 C ATOM 808 OH TYR A 51 11.989 8.611 -10.236 1.00 0.00 O ATOM 0 H TYR A 51 16.451 12.579 -15.369 1.00 0.00 H new ATOM 0 HA TYR A 51 13.780 11.854 -14.836 1.00 0.00 H new ATOM 0 HB2 TYR A 51 16.152 11.654 -13.529 1.00 0.00 H new ATOM 0 HB3 TYR A 51 15.468 13.024 -12.677 1.00 0.00 H new ATOM 0 HD1 TYR A 51 13.101 12.745 -11.666 1.00 0.00 H new ATOM 0 HD2 TYR A 51 15.428 9.448 -13.033 1.00 0.00 H new ATOM 0 HE1 TYR A 51 11.711 11.213 -10.344 1.00 0.00 H new ATOM 0 HE2 TYR A 51 14.025 7.914 -11.727 1.00 0.00 H new ATOM 0 HH TYR A 51 12.307 7.692 -10.359 1.00 0.00 H new ATOM 818 N LEU A 52 14.538 15.039 -14.480 1.00 0.00 N ATOM 819 CA LEU A 52 13.948 16.361 -14.309 1.00 0.00 C ATOM 820 C LEU A 52 13.020 16.728 -15.462 1.00 0.00 C ATOM 821 O LEU A 52 12.101 17.521 -15.288 1.00 0.00 O ATOM 822 CB LEU A 52 15.016 17.444 -14.164 1.00 0.00 C ATOM 823 CG LEU A 52 15.760 17.464 -12.830 1.00 0.00 C ATOM 824 CD1 LEU A 52 16.606 18.719 -12.720 1.00 0.00 C ATOM 825 CD2 LEU A 52 14.785 17.377 -11.666 1.00 0.00 C ATOM 0 H LEU A 52 15.533 15.043 -14.704 1.00 0.00 H new ATOM 0 HA LEU A 52 13.364 16.311 -13.390 1.00 0.00 H new ATOM 0 HB2 LEU A 52 15.745 17.319 -14.964 1.00 0.00 H new ATOM 0 HB3 LEU A 52 14.545 18.416 -14.311 1.00 0.00 H new ATOM 0 HG LEU A 52 16.416 16.594 -12.789 1.00 0.00 H new ATOM 0 HD11 LEU A 52 17.131 18.721 -11.765 1.00 0.00 H new ATOM 0 HD12 LEU A 52 17.332 18.741 -13.533 1.00 0.00 H new ATOM 0 HD13 LEU A 52 15.964 19.597 -12.783 1.00 0.00 H new ATOM 0 HD21 LEU A 52 15.338 17.393 -10.727 1.00 0.00 H new ATOM 0 HD22 LEU A 52 14.102 18.226 -11.700 1.00 0.00 H new ATOM 0 HD23 LEU A 52 14.216 16.450 -11.737 1.00 0.00 H new ATOM 837 N ARG A 53 13.252 16.167 -16.638 1.00 0.00 N ATOM 838 CA ARG A 53 12.405 16.498 -17.775 1.00 0.00 C ATOM 839 C ARG A 53 11.020 15.883 -17.604 1.00 0.00 C ATOM 840 O ARG A 53 10.004 16.545 -17.815 1.00 0.00 O ATOM 841 CB ARG A 53 13.016 16.031 -19.099 1.00 0.00 C ATOM 842 CG ARG A 53 12.461 16.802 -20.289 1.00 0.00 C ATOM 843 CD ARG A 53 12.830 16.175 -21.627 1.00 0.00 C ATOM 844 NE ARG A 53 12.060 14.958 -21.916 1.00 0.00 N ATOM 845 CZ ARG A 53 10.732 14.932 -22.111 1.00 0.00 C ATOM 846 NH1 ARG A 53 10.007 16.036 -21.975 1.00 0.00 N ATOM 847 NH2 ARG A 53 10.127 13.801 -22.448 1.00 0.00 N ATOM 0 H ARG A 53 13.998 15.498 -16.829 1.00 0.00 H new ATOM 0 HA ARG A 53 12.321 17.584 -17.808 1.00 0.00 H new ATOM 0 HB2 ARG A 53 14.098 16.153 -19.061 1.00 0.00 H new ATOM 0 HB3 ARG A 53 12.820 14.967 -19.233 1.00 0.00 H new ATOM 0 HG2 ARG A 53 11.376 16.856 -20.206 1.00 0.00 H new ATOM 0 HG3 ARG A 53 12.834 17.826 -20.258 1.00 0.00 H new ATOM 0 HD2 ARG A 53 12.664 16.902 -22.422 1.00 0.00 H new ATOM 0 HD3 ARG A 53 13.894 15.936 -21.630 1.00 0.00 H new ATOM 0 HE ARG A 53 12.567 14.075 -21.972 1.00 0.00 H new ATOM 0 HH11 ARG A 53 10.458 16.914 -21.720 1.00 0.00 H new ATOM 0 HH12 ARG A 53 8.999 16.006 -22.125 1.00 0.00 H new ATOM 0 HH21 ARG A 53 10.671 12.945 -22.560 1.00 0.00 H new ATOM 0 HH22 ARG A 53 9.118 13.787 -22.595 1.00 0.00 H new ATOM 861 N GLU A 54 10.979 14.618 -17.212 1.00 0.00 N ATOM 862 CA GLU A 54 9.710 13.904 -17.113 1.00 0.00 C ATOM 863 C GLU A 54 9.110 13.949 -15.701 1.00 0.00 C ATOM 864 O GLU A 54 7.887 13.970 -15.551 1.00 0.00 O ATOM 865 CB GLU A 54 9.888 12.467 -17.602 1.00 0.00 C ATOM 866 CG GLU A 54 10.223 12.404 -19.084 1.00 0.00 C ATOM 867 CD GLU A 54 10.382 10.994 -19.611 1.00 0.00 C ATOM 868 OE1 GLU A 54 9.400 10.224 -19.568 1.00 0.00 O ATOM 869 OE2 GLU A 54 11.483 10.660 -20.100 1.00 0.00 O ATOM 0 H GLU A 54 11.800 14.067 -16.959 1.00 0.00 H new ATOM 0 HA GLU A 54 8.992 14.413 -17.755 1.00 0.00 H new ATOM 0 HB2 GLU A 54 10.682 11.986 -17.031 1.00 0.00 H new ATOM 0 HB3 GLU A 54 8.974 11.904 -17.413 1.00 0.00 H new ATOM 0 HG2 GLU A 54 9.437 12.907 -19.647 1.00 0.00 H new ATOM 0 HG3 GLU A 54 11.146 12.956 -19.263 1.00 0.00 H new ATOM 876 N GLN A 55 9.949 13.978 -14.673 1.00 0.00 N ATOM 877 CA GLN A 55 9.463 14.040 -13.293 1.00 0.00 C ATOM 878 C GLN A 55 9.610 15.461 -12.739 1.00 0.00 C ATOM 879 O GLN A 55 8.637 16.065 -12.290 1.00 0.00 O ATOM 880 CB GLN A 55 10.231 13.058 -12.405 1.00 0.00 C ATOM 881 CG GLN A 55 9.700 12.973 -10.984 1.00 0.00 C ATOM 882 CD GLN A 55 8.601 11.942 -10.827 1.00 0.00 C ATOM 883 OE1 GLN A 55 7.426 12.215 -11.067 1.00 0.00 O ATOM 884 NE2 GLN A 55 8.980 10.753 -10.392 1.00 0.00 N ATOM 0 H GLN A 55 10.965 13.960 -14.764 1.00 0.00 H new ATOM 0 HA GLN A 55 8.409 13.764 -13.292 1.00 0.00 H new ATOM 0 HB2 GLN A 55 10.193 12.067 -12.857 1.00 0.00 H new ATOM 0 HB3 GLN A 55 11.280 13.354 -12.374 1.00 0.00 H new ATOM 0 HG2 GLN A 55 10.520 12.728 -10.309 1.00 0.00 H new ATOM 0 HG3 GLN A 55 9.321 13.950 -10.684 1.00 0.00 H new ATOM 0 HE21 GLN A 55 9.966 10.569 -10.205 1.00 0.00 H new ATOM 0 HE22 GLN A 55 8.287 10.020 -10.243 1.00 0.00 H new ATOM 893 N LEU A 56 10.846 15.971 -12.783 1.00 0.00 N ATOM 894 CA LEU A 56 11.182 17.341 -12.360 1.00 0.00 C ATOM 895 C LEU A 56 11.255 17.467 -10.833 1.00 0.00 C ATOM 896 O LEU A 56 10.873 18.485 -10.262 1.00 0.00 O ATOM 897 CB LEU A 56 10.196 18.367 -12.952 1.00 0.00 C ATOM 898 CG LEU A 56 10.594 19.840 -12.799 1.00 0.00 C ATOM 899 CD1 LEU A 56 11.912 20.120 -13.504 1.00 0.00 C ATOM 900 CD2 LEU A 56 9.497 20.747 -13.340 1.00 0.00 C ATOM 0 H LEU A 56 11.651 15.441 -13.116 1.00 0.00 H new ATOM 0 HA LEU A 56 12.175 17.562 -12.752 1.00 0.00 H new ATOM 0 HB2 LEU A 56 10.071 18.152 -14.013 1.00 0.00 H new ATOM 0 HB3 LEU A 56 9.224 18.222 -12.481 1.00 0.00 H new ATOM 0 HG LEU A 56 10.725 20.049 -11.737 1.00 0.00 H new ATOM 0 HD11 LEU A 56 12.174 21.171 -13.382 1.00 0.00 H new ATOM 0 HD12 LEU A 56 12.696 19.498 -13.071 1.00 0.00 H new ATOM 0 HD13 LEU A 56 11.813 19.892 -14.565 1.00 0.00 H new ATOM 0 HD21 LEU A 56 9.796 21.789 -13.224 1.00 0.00 H new ATOM 0 HD22 LEU A 56 9.335 20.532 -14.396 1.00 0.00 H new ATOM 0 HD23 LEU A 56 8.574 20.571 -12.788 1.00 0.00 H new ATOM 912 N GLY A 57 11.768 16.434 -10.179 1.00 0.00 N ATOM 913 CA GLY A 57 12.024 16.517 -8.749 1.00 0.00 C ATOM 914 C GLY A 57 10.842 16.090 -7.908 1.00 0.00 C ATOM 915 O GLY A 57 11.001 15.380 -6.913 1.00 0.00 O ATOM 0 H GLY A 57 12.012 15.541 -10.608 1.00 0.00 H new ATOM 0 HA2 GLY A 57 12.882 15.891 -8.503 1.00 0.00 H new ATOM 0 HA3 GLY A 57 12.293 17.542 -8.493 1.00 0.00 H new ATOM 919 N PHE A 58 9.660 16.538 -8.294 1.00 0.00 N ATOM 920 CA PHE A 58 8.445 16.175 -7.585 1.00 0.00 C ATOM 921 C PHE A 58 8.141 14.711 -7.828 1.00 0.00 C ATOM 922 O PHE A 58 7.881 14.318 -8.960 1.00 0.00 O ATOM 923 CB PHE A 58 7.257 17.008 -8.068 1.00 0.00 C ATOM 924 CG PHE A 58 7.593 18.425 -8.416 1.00 0.00 C ATOM 925 CD1 PHE A 58 7.732 19.380 -7.430 1.00 0.00 C ATOM 926 CD2 PHE A 58 7.762 18.799 -9.740 1.00 0.00 C ATOM 927 CE1 PHE A 58 8.037 20.685 -7.753 1.00 0.00 C ATOM 928 CE2 PHE A 58 8.066 20.104 -10.070 1.00 0.00 C ATOM 929 CZ PHE A 58 8.204 21.049 -9.076 1.00 0.00 C ATOM 0 H PHE A 58 9.516 17.154 -9.094 1.00 0.00 H new ATOM 0 HA PHE A 58 8.601 16.364 -6.523 1.00 0.00 H new ATOM 0 HB2 PHE A 58 6.823 16.525 -8.944 1.00 0.00 H new ATOM 0 HB3 PHE A 58 6.491 17.009 -7.292 1.00 0.00 H new ATOM 0 HD1 PHE A 58 7.601 19.102 -6.395 1.00 0.00 H new ATOM 0 HD2 PHE A 58 7.655 18.061 -10.521 1.00 0.00 H new ATOM 0 HE1 PHE A 58 8.145 21.423 -6.972 1.00 0.00 H new ATOM 0 HE2 PHE A 58 8.196 20.384 -11.105 1.00 0.00 H new ATOM 0 HZ PHE A 58 8.442 22.071 -9.330 1.00 0.00 H new ATOM 939 N GLU A 59 8.131 13.908 -6.783 1.00 0.00 N ATOM 940 CA GLU A 59 7.877 12.495 -6.952 1.00 0.00 C ATOM 941 C GLU A 59 6.388 12.236 -6.794 1.00 0.00 C ATOM 942 O GLU A 59 5.860 12.182 -5.680 1.00 0.00 O ATOM 943 CB GLU A 59 8.688 11.676 -5.943 1.00 0.00 C ATOM 944 CG GLU A 59 8.406 10.185 -5.983 1.00 0.00 C ATOM 945 CD GLU A 59 8.546 9.594 -7.370 1.00 0.00 C ATOM 946 OE1 GLU A 59 9.669 9.227 -7.758 1.00 0.00 O ATOM 947 OE2 GLU A 59 7.521 9.467 -8.070 1.00 0.00 O ATOM 0 H GLU A 59 8.294 14.206 -5.821 1.00 0.00 H new ATOM 0 HA GLU A 59 8.189 12.186 -7.950 1.00 0.00 H new ATOM 0 HB2 GLU A 59 9.750 11.839 -6.129 1.00 0.00 H new ATOM 0 HB3 GLU A 59 8.480 12.047 -4.940 1.00 0.00 H new ATOM 0 HG2 GLU A 59 9.089 9.673 -5.305 1.00 0.00 H new ATOM 0 HG3 GLU A 59 7.396 10.002 -5.616 1.00 0.00 H new ATOM 954 N PHE A 60 5.730 12.075 -7.928 1.00 0.00 N ATOM 955 CA PHE A 60 4.290 11.921 -7.964 1.00 0.00 C ATOM 956 C PHE A 60 3.897 10.467 -7.858 1.00 0.00 C ATOM 957 O PHE A 60 3.718 9.776 -8.865 1.00 0.00 O ATOM 958 CB PHE A 60 3.704 12.525 -9.244 1.00 0.00 C ATOM 959 CG PHE A 60 3.703 14.026 -9.263 1.00 0.00 C ATOM 960 CD1 PHE A 60 2.780 14.736 -8.510 1.00 0.00 C ATOM 961 CD2 PHE A 60 4.616 14.727 -10.033 1.00 0.00 C ATOM 962 CE1 PHE A 60 2.769 16.116 -8.524 1.00 0.00 C ATOM 963 CE2 PHE A 60 4.609 16.109 -10.051 1.00 0.00 C ATOM 964 CZ PHE A 60 3.684 16.803 -9.294 1.00 0.00 C ATOM 0 H PHE A 60 6.177 12.048 -8.844 1.00 0.00 H new ATOM 0 HA PHE A 60 3.883 12.457 -7.106 1.00 0.00 H new ATOM 0 HB2 PHE A 60 4.273 12.161 -10.099 1.00 0.00 H new ATOM 0 HB3 PHE A 60 2.681 12.169 -9.367 1.00 0.00 H new ATOM 0 HD1 PHE A 60 2.061 14.203 -7.905 1.00 0.00 H new ATOM 0 HD2 PHE A 60 5.341 14.188 -10.625 1.00 0.00 H new ATOM 0 HE1 PHE A 60 2.045 16.657 -7.933 1.00 0.00 H new ATOM 0 HE2 PHE A 60 5.325 16.646 -10.656 1.00 0.00 H new ATOM 0 HZ PHE A 60 3.678 17.883 -9.305 1.00 0.00 H new ATOM 974 N LYS A 61 3.784 9.999 -6.633 1.00 0.00 N ATOM 975 CA LYS A 61 3.254 8.679 -6.385 1.00 0.00 C ATOM 976 C LYS A 61 1.736 8.759 -6.344 1.00 0.00 C ATOM 977 O LYS A 61 1.158 9.848 -6.431 1.00 0.00 O ATOM 978 CB LYS A 61 3.779 8.111 -5.061 1.00 0.00 C ATOM 979 CG LYS A 61 5.294 7.984 -4.984 1.00 0.00 C ATOM 980 CD LYS A 61 5.835 6.990 -6.001 1.00 0.00 C ATOM 981 CE LYS A 61 7.335 6.795 -5.832 1.00 0.00 C ATOM 982 NZ LYS A 61 7.927 5.972 -6.922 1.00 0.00 N ATOM 0 H LYS A 61 4.053 10.514 -5.795 1.00 0.00 H new ATOM 0 HA LYS A 61 3.576 8.014 -7.186 1.00 0.00 H new ATOM 0 HB2 LYS A 61 3.439 8.750 -4.246 1.00 0.00 H new ATOM 0 HB3 LYS A 61 3.336 7.128 -4.901 1.00 0.00 H new ATOM 0 HG2 LYS A 61 5.749 8.960 -5.154 1.00 0.00 H new ATOM 0 HG3 LYS A 61 5.581 7.669 -3.981 1.00 0.00 H new ATOM 0 HD2 LYS A 61 5.325 6.033 -5.886 1.00 0.00 H new ATOM 0 HD3 LYS A 61 5.623 7.345 -7.010 1.00 0.00 H new ATOM 0 HE2 LYS A 61 7.825 7.768 -5.809 1.00 0.00 H new ATOM 0 HE3 LYS A 61 7.531 6.317 -4.872 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 8.949 5.868 -6.762 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 7.480 5.033 -6.930 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 7.765 6.440 -7.837 1.00 0.00 H new ATOM 996 N ASN A 62 1.105 7.613 -6.232 1.00 0.00 N ATOM 997 CA ASN A 62 -0.328 7.538 -6.047 1.00 0.00 C ATOM 998 C ASN A 62 -0.612 6.401 -5.093 1.00 0.00 C ATOM 999 O ASN A 62 0.318 5.715 -4.667 1.00 0.00 O ATOM 1000 CB ASN A 62 -1.063 7.304 -7.375 1.00 0.00 C ATOM 1001 CG ASN A 62 -0.909 8.448 -8.362 1.00 0.00 C ATOM 1002 OD1 ASN A 62 -0.068 8.404 -9.261 1.00 0.00 O ATOM 1003 ND2 ASN A 62 -1.698 9.496 -8.187 1.00 0.00 N ATOM 0 H ASN A 62 1.570 6.706 -6.266 1.00 0.00 H new ATOM 0 HA ASN A 62 -0.688 8.485 -5.646 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -0.689 6.388 -7.832 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -2.123 7.150 -7.172 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -1.621 10.302 -8.807 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -2.383 9.498 -7.432 1.00 0.00 H new ATOM 1010 N ALA A 63 -1.873 6.200 -4.747 1.00 0.00 N ATOM 1011 CA ALA A 63 -2.242 5.061 -3.924 1.00 0.00 C ATOM 1012 C ALA A 63 -1.903 3.773 -4.656 1.00 0.00 C ATOM 1013 O ALA A 63 -1.379 2.829 -4.067 1.00 0.00 O ATOM 1014 CB ALA A 63 -3.719 5.104 -3.576 1.00 0.00 C ATOM 0 H ALA A 63 -2.650 6.803 -5.019 1.00 0.00 H new ATOM 0 HA ALA A 63 -1.678 5.101 -2.992 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -3.973 4.242 -2.959 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -3.937 6.020 -3.026 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -4.309 5.081 -4.492 1.00 0.00 H new ATOM 1020 N GLN A 64 -2.196 3.769 -5.958 1.00 0.00 N ATOM 1021 CA GLN A 64 -1.898 2.644 -6.836 1.00 0.00 C ATOM 1022 C GLN A 64 -2.700 1.414 -6.415 1.00 0.00 C ATOM 1023 O GLN A 64 -3.772 1.171 -6.957 1.00 0.00 O ATOM 1024 CB GLN A 64 -0.390 2.361 -6.860 1.00 0.00 C ATOM 1025 CG GLN A 64 0.042 1.347 -7.906 1.00 0.00 C ATOM 1026 CD GLN A 64 1.550 1.298 -8.065 1.00 0.00 C ATOM 1027 OE1 GLN A 64 2.236 2.302 -7.884 1.00 0.00 O ATOM 1028 NE2 GLN A 64 2.075 0.137 -8.411 1.00 0.00 N ATOM 0 H GLN A 64 -2.648 4.551 -6.432 1.00 0.00 H new ATOM 0 HA GLN A 64 -2.197 2.901 -7.852 1.00 0.00 H new ATOM 0 HB2 GLN A 64 0.140 3.297 -7.038 1.00 0.00 H new ATOM 0 HB3 GLN A 64 -0.084 2.003 -5.877 1.00 0.00 H new ATOM 0 HG2 GLN A 64 -0.325 0.359 -7.626 1.00 0.00 H new ATOM 0 HG3 GLN A 64 -0.415 1.597 -8.863 1.00 0.00 H new ATOM 0 HE21 GLN A 64 1.472 -0.674 -8.552 1.00 0.00 H new ATOM 0 HE22 GLN A 64 3.083 0.051 -8.537 1.00 0.00 H new ATOM 1037 N LEU A 65 -2.187 0.657 -5.444 1.00 0.00 N ATOM 1038 CA LEU A 65 -2.911 -0.480 -4.865 1.00 0.00 C ATOM 1039 C LEU A 65 -3.341 -1.483 -5.947 1.00 0.00 C ATOM 1040 O LEU A 65 -4.355 -2.170 -5.810 1.00 0.00 O ATOM 1041 CB LEU A 65 -4.132 0.050 -4.096 1.00 0.00 C ATOM 1042 CG LEU A 65 -4.864 -0.963 -3.215 1.00 0.00 C ATOM 1043 CD1 LEU A 65 -3.932 -1.521 -2.154 1.00 0.00 C ATOM 1044 CD2 LEU A 65 -6.082 -0.317 -2.574 1.00 0.00 C ATOM 0 H LEU A 65 -1.264 0.812 -5.038 1.00 0.00 H new ATOM 0 HA LEU A 65 -2.249 -1.013 -4.182 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -3.808 0.880 -3.468 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -4.843 0.454 -4.817 1.00 0.00 H new ATOM 0 HG LEU A 65 -5.199 -1.790 -3.840 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -4.472 -2.240 -1.537 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -3.088 -2.016 -2.635 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -3.566 -0.708 -1.527 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -6.595 -1.048 -1.949 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -5.766 0.527 -1.960 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -6.760 0.034 -3.352 1.00 0.00 H new ATOM 1056 N GLU A 66 -2.545 -1.559 -7.016 1.00 0.00 N ATOM 1057 CA GLU A 66 -2.841 -2.404 -8.180 1.00 0.00 C ATOM 1058 C GLU A 66 -4.142 -1.978 -8.867 1.00 0.00 C ATOM 1059 O GLU A 66 -4.668 -2.680 -9.729 1.00 0.00 O ATOM 1060 CB GLU A 66 -2.885 -3.886 -7.793 1.00 0.00 C ATOM 1061 CG GLU A 66 -1.552 -4.403 -7.281 1.00 0.00 C ATOM 1062 CD GLU A 66 -1.511 -5.910 -7.162 1.00 0.00 C ATOM 1063 OE1 GLU A 66 -1.259 -6.581 -8.186 1.00 0.00 O ATOM 1064 OE2 GLU A 66 -1.715 -6.430 -6.049 1.00 0.00 O ATOM 0 H GLU A 66 -1.674 -1.035 -7.101 1.00 0.00 H new ATOM 0 HA GLU A 66 -2.030 -2.268 -8.895 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -3.645 -4.034 -7.026 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -3.188 -4.474 -8.659 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -0.759 -4.075 -7.953 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -1.347 -3.961 -6.306 1.00 0.00 H new ATOM 1071 N HIS A 67 -4.635 -0.810 -8.486 1.00 0.00 N ATOM 1072 CA HIS A 67 -5.809 -0.210 -9.097 1.00 0.00 C ATOM 1073 C HIS A 67 -5.435 1.138 -9.693 1.00 0.00 C ATOM 1074 O HIS A 67 -5.740 2.190 -9.130 1.00 0.00 O ATOM 1075 CB HIS A 67 -6.927 -0.034 -8.067 1.00 0.00 C ATOM 1076 CG HIS A 67 -7.822 -1.224 -7.926 1.00 0.00 C ATOM 1077 ND1 HIS A 67 -9.193 -1.146 -8.041 1.00 0.00 N ATOM 1078 CD2 HIS A 67 -7.541 -2.522 -7.667 1.00 0.00 C ATOM 1079 CE1 HIS A 67 -9.717 -2.342 -7.851 1.00 0.00 C ATOM 1080 NE2 HIS A 67 -8.736 -3.194 -7.624 1.00 0.00 N ATOM 0 H HIS A 67 -4.228 -0.248 -7.738 1.00 0.00 H new ATOM 0 HA HIS A 67 -6.172 -0.871 -9.884 1.00 0.00 H new ATOM 0 HB2 HIS A 67 -6.481 0.188 -7.098 1.00 0.00 H new ATOM 0 HB3 HIS A 67 -7.530 0.830 -8.346 1.00 0.00 H new ATOM 0 HD2 HIS A 67 -6.560 -2.949 -7.521 1.00 0.00 H new ATOM 0 HE1 HIS A 67 -10.770 -2.582 -7.877 1.00 0.00 H new ATOM 0 HE2 HIS A 67 -8.848 -4.192 -7.445 1.00 0.00 H new ATOM 1089 N HIS A 68 -4.748 1.103 -10.821 1.00 0.00 N ATOM 1090 CA HIS A 68 -4.226 2.314 -11.435 1.00 0.00 C ATOM 1091 C HIS A 68 -4.408 2.262 -12.944 1.00 0.00 C ATOM 1092 O HIS A 68 -4.241 1.208 -13.558 1.00 0.00 O ATOM 1093 CB HIS A 68 -2.741 2.513 -11.072 1.00 0.00 C ATOM 1094 CG HIS A 68 -1.822 1.415 -11.538 1.00 0.00 C ATOM 1095 ND1 HIS A 68 -0.635 1.654 -12.196 1.00 0.00 N ATOM 1096 CD2 HIS A 68 -1.909 0.066 -11.414 1.00 0.00 C ATOM 1097 CE1 HIS A 68 -0.038 0.506 -12.459 1.00 0.00 C ATOM 1098 NE2 HIS A 68 -0.790 -0.471 -11.995 1.00 0.00 N ATOM 0 H HIS A 68 -4.537 0.246 -11.333 1.00 0.00 H new ATOM 0 HA HIS A 68 -4.786 3.166 -11.049 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -2.401 3.457 -11.498 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -2.656 2.603 -9.989 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -2.712 -0.483 -10.944 1.00 0.00 H new ATOM 0 HE1 HIS A 68 0.907 0.388 -12.968 1.00 0.00 H new ATOM 0 HE2 HIS A 68 -0.574 -1.466 -12.058 1.00 0.00 H new ATOM 1107 N HIS A 69 -4.758 3.389 -13.534 1.00 0.00 N ATOM 1108 CA HIS A 69 -4.971 3.452 -14.973 1.00 0.00 C ATOM 1109 C HIS A 69 -3.894 4.297 -15.634 1.00 0.00 C ATOM 1110 O HIS A 69 -3.442 5.291 -15.067 1.00 0.00 O ATOM 1111 CB HIS A 69 -6.367 4.002 -15.316 1.00 0.00 C ATOM 1112 CG HIS A 69 -6.612 5.421 -14.882 1.00 0.00 C ATOM 1113 ND1 HIS A 69 -6.455 6.507 -15.720 1.00 0.00 N ATOM 1114 CD2 HIS A 69 -7.014 5.925 -13.692 1.00 0.00 C ATOM 1115 CE1 HIS A 69 -6.751 7.613 -15.062 1.00 0.00 C ATOM 1116 NE2 HIS A 69 -7.095 7.284 -13.831 1.00 0.00 N ATOM 0 H HIS A 69 -4.901 4.272 -13.044 1.00 0.00 H new ATOM 0 HA HIS A 69 -4.910 2.435 -15.360 1.00 0.00 H new ATOM 0 HB2 HIS A 69 -6.512 3.937 -16.394 1.00 0.00 H new ATOM 0 HB3 HIS A 69 -7.118 3.361 -14.854 1.00 0.00 H new ATOM 0 HD2 HIS A 69 -7.231 5.359 -12.798 1.00 0.00 H new ATOM 0 HE1 HIS A 69 -6.717 8.615 -15.463 1.00 0.00 H new ATOM 0 HE2 HIS A 69 -7.376 7.938 -13.100 1.00 0.00 H new ATOM 1125 N HIS A 70 -3.483 3.882 -16.821 1.00 0.00 N ATOM 1126 CA HIS A 70 -2.494 4.614 -17.599 1.00 0.00 C ATOM 1127 C HIS A 70 -3.042 5.993 -17.963 1.00 0.00 C ATOM 1128 O HIS A 70 -2.584 7.004 -17.442 1.00 0.00 O ATOM 1129 CB HIS A 70 -2.137 3.809 -18.856 1.00 0.00 C ATOM 1130 CG HIS A 70 -1.093 4.435 -19.732 1.00 0.00 C ATOM 1131 ND1 HIS A 70 -1.204 4.493 -21.105 1.00 0.00 N ATOM 1132 CD2 HIS A 70 0.101 5.000 -19.429 1.00 0.00 C ATOM 1133 CE1 HIS A 70 -0.128 5.062 -21.607 1.00 0.00 C ATOM 1134 NE2 HIS A 70 0.679 5.382 -20.614 1.00 0.00 N ATOM 0 H HIS A 70 -3.823 3.032 -17.272 1.00 0.00 H new ATOM 0 HA HIS A 70 -1.587 4.754 -17.010 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -1.790 2.822 -18.551 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -3.043 3.661 -19.444 1.00 0.00 H new ATOM 0 HD2 HIS A 70 0.519 5.126 -18.441 1.00 0.00 H new ATOM 0 HE1 HIS A 70 0.062 5.237 -22.656 1.00 0.00 H new ATOM 0 HE2 HIS A 70 1.586 5.839 -20.711 1.00 0.00 H new ATOM 1143 N HIS A 71 -4.049 6.004 -18.831 1.00 0.00 N ATOM 1144 CA HIS A 71 -4.733 7.228 -19.266 1.00 0.00 C ATOM 1145 C HIS A 71 -5.932 6.839 -20.115 1.00 0.00 C ATOM 1146 O HIS A 71 -7.077 7.115 -19.763 1.00 0.00 O ATOM 1147 CB HIS A 71 -3.815 8.167 -20.071 1.00 0.00 C ATOM 1148 CG HIS A 71 -3.049 9.156 -19.238 1.00 0.00 C ATOM 1149 ND1 HIS A 71 -1.673 9.217 -19.222 1.00 0.00 N ATOM 1150 CD2 HIS A 71 -3.474 10.125 -18.393 1.00 0.00 C ATOM 1151 CE1 HIS A 71 -1.286 10.177 -18.404 1.00 0.00 C ATOM 1152 NE2 HIS A 71 -2.358 10.747 -17.889 1.00 0.00 N ATOM 0 H HIS A 71 -4.421 5.156 -19.260 1.00 0.00 H new ATOM 0 HA HIS A 71 -5.043 7.773 -18.375 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -3.107 7.563 -20.638 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -4.420 8.713 -20.795 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -4.501 10.364 -18.159 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -0.263 10.450 -18.192 1.00 0.00 H new ATOM 0 HE2 HIS A 71 -2.358 11.522 -17.226 1.00 0.00 H new ATOM 1161 N HIS A 72 -5.653 6.187 -21.232 1.00 0.00 N ATOM 1162 CA HIS A 72 -6.696 5.633 -22.079 1.00 0.00 C ATOM 1163 C HIS A 72 -6.445 4.149 -22.290 1.00 0.00 C ATOM 1164 O HIS A 72 -5.800 3.792 -23.294 1.00 0.00 O ATOM 1165 CB HIS A 72 -6.761 6.351 -23.429 1.00 0.00 C ATOM 1166 CG HIS A 72 -7.365 7.719 -23.365 1.00 0.00 C ATOM 1167 ND1 HIS A 72 -8.721 7.934 -23.279 1.00 0.00 N ATOM 1168 CD2 HIS A 72 -6.795 8.944 -23.388 1.00 0.00 C ATOM 1169 CE1 HIS A 72 -8.959 9.229 -23.257 1.00 0.00 C ATOM 1170 NE2 HIS A 72 -7.808 9.868 -23.321 1.00 0.00 N ATOM 1171 OXT HIS A 72 -6.859 3.349 -21.425 1.00 0.00 O ATOM 0 H HIS A 72 -4.706 6.028 -21.575 1.00 0.00 H new ATOM 0 HA HIS A 72 -7.654 5.777 -21.579 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -5.753 6.429 -23.836 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -7.339 5.743 -24.125 1.00 0.00 H new ATOM 0 HD2 HIS A 72 -5.738 9.157 -23.448 1.00 0.00 H new ATOM 0 HE1 HIS A 72 -9.934 9.690 -23.197 1.00 0.00 H new ATOM 0 HE2 HIS A 72 -7.690 10.881 -23.321 1.00 0.00 H new TER 1180 HIS A 72 ATOM 1181 N MET B 1 9.401 10.394 37.392 1.00 0.00 N ATOM 1182 CA MET B 1 10.325 11.490 37.761 1.00 0.00 C ATOM 1183 C MET B 1 11.684 11.280 37.099 1.00 0.00 C ATOM 1184 O MET B 1 12.226 12.196 36.475 1.00 0.00 O ATOM 1185 CB MET B 1 10.476 11.560 39.289 1.00 0.00 C ATOM 1186 CG MET B 1 11.210 12.798 39.797 1.00 0.00 C ATOM 1187 SD MET B 1 12.994 12.750 39.521 1.00 0.00 S ATOM 1188 CE MET B 1 13.476 14.348 40.172 1.00 0.00 C ATOM 0 H1 MET B 1 8.469 10.566 37.821 1.00 0.00 H new ATOM 0 H2 MET B 1 9.304 10.355 36.357 1.00 0.00 H new ATOM 0 H3 MET B 1 9.780 9.489 37.738 1.00 0.00 H new ATOM 0 HA MET B 1 9.911 12.435 37.408 1.00 0.00 H new ATOM 0 HB2 MET B 1 9.485 11.530 39.741 1.00 0.00 H new ATOM 0 HB3 MET B 1 11.009 10.672 39.630 1.00 0.00 H new ATOM 0 HG2 MET B 1 10.799 13.680 39.306 1.00 0.00 H new ATOM 0 HG3 MET B 1 11.019 12.910 40.864 1.00 0.00 H new ATOM 0 HE1 MET B 1 14.555 14.471 40.073 1.00 0.00 H new ATOM 0 HE2 MET B 1 12.969 15.136 39.615 1.00 0.00 H new ATOM 0 HE3 MET B 1 13.198 14.411 41.224 1.00 0.00 H new ATOM 1200 N VAL B 2 12.219 10.072 37.214 1.00 0.00 N ATOM 1201 CA VAL B 2 13.528 9.761 36.659 1.00 0.00 C ATOM 1202 C VAL B 2 13.532 8.335 36.106 1.00 0.00 C ATOM 1203 O VAL B 2 12.629 7.554 36.406 1.00 0.00 O ATOM 1204 CB VAL B 2 14.632 9.926 37.734 1.00 0.00 C ATOM 1205 CG1 VAL B 2 14.530 8.841 38.796 1.00 0.00 C ATOM 1206 CG2 VAL B 2 16.018 9.946 37.107 1.00 0.00 C ATOM 0 H VAL B 2 11.765 9.291 37.688 1.00 0.00 H new ATOM 0 HA VAL B 2 13.738 10.458 35.847 1.00 0.00 H new ATOM 0 HB VAL B 2 14.475 10.888 38.221 1.00 0.00 H new ATOM 0 HG11 VAL B 2 15.317 8.982 39.537 1.00 0.00 H new ATOM 0 HG12 VAL B 2 13.557 8.900 39.284 1.00 0.00 H new ATOM 0 HG13 VAL B 2 14.643 7.863 38.329 1.00 0.00 H new ATOM 0 HG21 VAL B 2 16.769 10.063 37.888 1.00 0.00 H new ATOM 0 HG22 VAL B 2 16.190 9.010 36.575 1.00 0.00 H new ATOM 0 HG23 VAL B 2 16.089 10.779 36.408 1.00 0.00 H new ATOM 1216 N GLU B 3 14.519 8.015 35.276 1.00 0.00 N ATOM 1217 CA GLU B 3 14.671 6.670 34.733 1.00 0.00 C ATOM 1218 C GLU B 3 14.762 5.645 35.861 1.00 0.00 C ATOM 1219 O GLU B 3 15.681 5.689 36.681 1.00 0.00 O ATOM 1220 CB GLU B 3 15.921 6.566 33.849 1.00 0.00 C ATOM 1221 CG GLU B 3 15.965 7.558 32.693 1.00 0.00 C ATOM 1222 CD GLU B 3 16.388 8.948 33.126 1.00 0.00 C ATOM 1223 OE1 GLU B 3 17.608 9.213 33.167 1.00 0.00 O ATOM 1224 OE2 GLU B 3 15.507 9.773 33.434 1.00 0.00 O ATOM 0 H GLU B 3 15.231 8.675 34.963 1.00 0.00 H new ATOM 0 HA GLU B 3 13.792 6.461 34.123 1.00 0.00 H new ATOM 0 HB2 GLU B 3 16.803 6.714 34.471 1.00 0.00 H new ATOM 0 HB3 GLU B 3 15.982 5.555 33.446 1.00 0.00 H new ATOM 0 HG2 GLU B 3 16.656 7.193 31.934 1.00 0.00 H new ATOM 0 HG3 GLU B 3 14.980 7.611 32.228 1.00 0.00 H new ATOM 1231 N ASN B 4 13.801 4.737 35.897 1.00 0.00 N ATOM 1232 CA ASN B 4 13.750 3.714 36.931 1.00 0.00 C ATOM 1233 C ASN B 4 14.327 2.405 36.395 1.00 0.00 C ATOM 1234 O ASN B 4 14.161 2.097 35.214 1.00 0.00 O ATOM 1235 CB ASN B 4 12.296 3.512 37.386 1.00 0.00 C ATOM 1236 CG ASN B 4 12.169 2.569 38.568 1.00 0.00 C ATOM 1237 OD1 ASN B 4 12.059 1.358 38.400 1.00 0.00 O ATOM 1238 ND2 ASN B 4 12.178 3.120 39.771 1.00 0.00 N ATOM 0 H ASN B 4 13.041 4.687 35.218 1.00 0.00 H new ATOM 0 HA ASN B 4 14.346 4.033 37.786 1.00 0.00 H new ATOM 0 HB2 ASN B 4 11.867 4.478 37.652 1.00 0.00 H new ATOM 0 HB3 ASN B 4 11.711 3.122 36.553 1.00 0.00 H new ATOM 0 HD21 ASN B 4 12.092 2.534 40.601 1.00 0.00 H new ATOM 0 HD22 ASN B 4 12.271 4.131 39.868 1.00 0.00 H new ATOM 1245 N PRO B 5 15.040 1.635 37.244 1.00 0.00 N ATOM 1246 CA PRO B 5 15.611 0.331 36.862 1.00 0.00 C ATOM 1247 C PRO B 5 14.593 -0.608 36.210 1.00 0.00 C ATOM 1248 O PRO B 5 14.954 -1.463 35.399 1.00 0.00 O ATOM 1249 CB PRO B 5 16.082 -0.251 38.195 1.00 0.00 C ATOM 1250 CG PRO B 5 16.367 0.935 39.046 1.00 0.00 C ATOM 1251 CD PRO B 5 15.377 1.990 38.638 1.00 0.00 C ATOM 0 HA PRO B 5 16.398 0.447 36.117 1.00 0.00 H new ATOM 0 HB2 PRO B 5 15.317 -0.885 38.643 1.00 0.00 H new ATOM 0 HB3 PRO B 5 16.971 -0.868 38.065 1.00 0.00 H new ATOM 0 HG2 PRO B 5 16.262 0.690 40.103 1.00 0.00 H new ATOM 0 HG3 PRO B 5 17.390 1.283 38.899 1.00 0.00 H new ATOM 0 HD2 PRO B 5 14.495 1.980 39.278 1.00 0.00 H new ATOM 0 HD3 PRO B 5 15.807 2.989 38.704 1.00 0.00 H new ATOM 1259 N MET B 6 13.323 -0.451 36.565 1.00 0.00 N ATOM 1260 CA MET B 6 12.263 -1.267 35.988 1.00 0.00 C ATOM 1261 C MET B 6 11.901 -0.756 34.598 1.00 0.00 C ATOM 1262 O MET B 6 10.842 -0.167 34.396 1.00 0.00 O ATOM 1263 CB MET B 6 11.022 -1.259 36.885 1.00 0.00 C ATOM 1264 CG MET B 6 11.285 -1.737 38.302 1.00 0.00 C ATOM 1265 SD MET B 6 9.841 -1.559 39.367 1.00 0.00 S ATOM 1266 CE MET B 6 10.519 -2.109 40.932 1.00 0.00 C ATOM 0 H MET B 6 13.003 0.234 37.250 1.00 0.00 H new ATOM 0 HA MET B 6 12.627 -2.291 35.908 1.00 0.00 H new ATOM 0 HB2 MET B 6 10.619 -0.247 36.922 1.00 0.00 H new ATOM 0 HB3 MET B 6 10.256 -1.891 36.435 1.00 0.00 H new ATOM 0 HG2 MET B 6 11.589 -2.783 38.279 1.00 0.00 H new ATOM 0 HG3 MET B 6 12.116 -1.173 38.724 1.00 0.00 H new ATOM 0 HE1 MET B 6 9.748 -2.059 41.700 1.00 0.00 H new ATOM 0 HE2 MET B 6 10.869 -3.137 40.836 1.00 0.00 H new ATOM 0 HE3 MET B 6 11.353 -1.466 41.213 1.00 0.00 H new ATOM 1276 N VAL B 7 12.795 -0.974 33.644 1.00 0.00 N ATOM 1277 CA VAL B 7 12.587 -0.517 32.275 1.00 0.00 C ATOM 1278 C VAL B 7 11.659 -1.457 31.509 1.00 0.00 C ATOM 1279 O VAL B 7 11.405 -1.265 30.322 1.00 0.00 O ATOM 1280 CB VAL B 7 13.923 -0.385 31.513 1.00 0.00 C ATOM 1281 CG1 VAL B 7 14.781 0.709 32.129 1.00 0.00 C ATOM 1282 CG2 VAL B 7 14.670 -1.711 31.502 1.00 0.00 C ATOM 0 H VAL B 7 13.676 -1.467 33.793 1.00 0.00 H new ATOM 0 HA VAL B 7 12.120 0.466 32.341 1.00 0.00 H new ATOM 0 HB VAL B 7 13.704 -0.110 30.481 1.00 0.00 H new ATOM 0 HG11 VAL B 7 15.719 0.788 31.580 1.00 0.00 H new ATOM 0 HG12 VAL B 7 14.250 1.659 32.079 1.00 0.00 H new ATOM 0 HG13 VAL B 7 14.990 0.464 33.170 1.00 0.00 H new ATOM 0 HG21 VAL B 7 15.609 -1.595 30.960 1.00 0.00 H new ATOM 0 HG22 VAL B 7 14.878 -2.020 32.526 1.00 0.00 H new ATOM 0 HG23 VAL B 7 14.059 -2.469 31.012 1.00 0.00 H new ATOM 1292 N ILE B 8 11.142 -2.463 32.203 1.00 0.00 N ATOM 1293 CA ILE B 8 10.241 -3.437 31.597 1.00 0.00 C ATOM 1294 C ILE B 8 8.801 -2.926 31.594 1.00 0.00 C ATOM 1295 O ILE B 8 7.862 -3.683 31.362 1.00 0.00 O ATOM 1296 CB ILE B 8 10.300 -4.792 32.331 1.00 0.00 C ATOM 1297 CG1 ILE B 8 9.992 -4.610 33.823 1.00 0.00 C ATOM 1298 CG2 ILE B 8 11.666 -5.434 32.135 1.00 0.00 C ATOM 1299 CD1 ILE B 8 9.943 -5.911 34.599 1.00 0.00 C ATOM 0 H ILE B 8 11.332 -2.627 33.192 1.00 0.00 H new ATOM 0 HA ILE B 8 10.572 -3.580 30.568 1.00 0.00 H new ATOM 0 HB ILE B 8 9.543 -5.453 31.909 1.00 0.00 H new ATOM 0 HG12 ILE B 8 10.749 -3.962 34.265 1.00 0.00 H new ATOM 0 HG13 ILE B 8 9.035 -4.099 33.927 1.00 0.00 H new ATOM 0 HG21 ILE B 8 11.697 -6.390 32.657 1.00 0.00 H new ATOM 0 HG22 ILE B 8 11.843 -5.595 31.072 1.00 0.00 H new ATOM 0 HG23 ILE B 8 12.438 -4.777 32.535 1.00 0.00 H new ATOM 0 HD11 ILE B 8 9.721 -5.702 35.645 1.00 0.00 H new ATOM 0 HD12 ILE B 8 9.166 -6.553 34.184 1.00 0.00 H new ATOM 0 HD13 ILE B 8 10.907 -6.414 34.526 1.00 0.00 H new ATOM 1311 N ASN B 9 8.640 -1.630 31.833 1.00 0.00 N ATOM 1312 CA ASN B 9 7.323 -1.003 31.839 1.00 0.00 C ATOM 1313 C ASN B 9 6.917 -0.576 30.431 1.00 0.00 C ATOM 1314 O ASN B 9 5.905 0.100 30.242 1.00 0.00 O ATOM 1315 CB ASN B 9 7.298 0.210 32.782 1.00 0.00 C ATOM 1316 CG ASN B 9 8.373 1.246 32.475 1.00 0.00 C ATOM 1317 OD1 ASN B 9 8.852 1.362 31.347 1.00 0.00 O ATOM 1318 ND2 ASN B 9 8.751 2.017 33.482 1.00 0.00 N ATOM 0 H ASN B 9 9.410 -0.989 32.026 1.00 0.00 H new ATOM 0 HA ASN B 9 6.607 -1.741 32.200 1.00 0.00 H new ATOM 0 HB2 ASN B 9 6.319 0.686 32.722 1.00 0.00 H new ATOM 0 HB3 ASN B 9 7.422 -0.136 33.808 1.00 0.00 H new ATOM 0 HD21 ASN B 9 9.461 2.735 33.336 1.00 0.00 H new ATOM 0 HD22 ASN B 9 8.333 1.893 34.404 1.00 0.00 H new ATOM 1325 N ASN B 10 7.707 -0.981 29.449 1.00 0.00 N ATOM 1326 CA ASN B 10 7.455 -0.611 28.066 1.00 0.00 C ATOM 1327 C ASN B 10 6.463 -1.574 27.426 1.00 0.00 C ATOM 1328 O ASN B 10 6.253 -2.686 27.918 1.00 0.00 O ATOM 1329 CB ASN B 10 8.760 -0.582 27.257 1.00 0.00 C ATOM 1330 CG ASN B 10 9.403 -1.952 27.103 1.00 0.00 C ATOM 1331 OD1 ASN B 10 9.110 -2.687 26.158 1.00 0.00 O ATOM 1332 ND2 ASN B 10 10.304 -2.300 28.009 1.00 0.00 N ATOM 0 H ASN B 10 8.530 -1.568 29.585 1.00 0.00 H new ATOM 0 HA ASN B 10 7.026 0.391 28.061 1.00 0.00 H new ATOM 0 HB2 ASN B 10 8.557 -0.170 26.268 1.00 0.00 H new ATOM 0 HB3 ASN B 10 9.466 0.091 27.744 1.00 0.00 H new ATOM 0 HD21 ASN B 10 10.779 -3.200 27.937 1.00 0.00 H new ATOM 0 HD22 ASN B 10 10.523 -1.668 28.779 1.00 0.00 H new ATOM 1339 N TRP B 11 5.856 -1.138 26.334 1.00 0.00 N ATOM 1340 CA TRP B 11 4.877 -1.945 25.627 1.00 0.00 C ATOM 1341 C TRP B 11 5.571 -3.029 24.818 1.00 0.00 C ATOM 1342 O TRP B 11 6.653 -2.810 24.271 1.00 0.00 O ATOM 1343 CB TRP B 11 4.028 -1.061 24.714 1.00 0.00 C ATOM 1344 CG TRP B 11 3.396 0.086 25.440 1.00 0.00 C ATOM 1345 CD1 TRP B 11 3.786 1.393 25.403 1.00 0.00 C ATOM 1346 CD2 TRP B 11 2.277 0.024 26.330 1.00 0.00 C ATOM 1347 NE1 TRP B 11 2.976 2.149 26.214 1.00 0.00 N ATOM 1348 CE2 TRP B 11 2.042 1.332 26.793 1.00 0.00 C ATOM 1349 CE3 TRP B 11 1.452 -1.010 26.778 1.00 0.00 C ATOM 1350 CZ2 TRP B 11 1.014 1.631 27.684 1.00 0.00 C ATOM 1351 CZ3 TRP B 11 0.432 -0.712 27.661 1.00 0.00 C ATOM 1352 CH2 TRP B 11 0.220 0.598 28.105 1.00 0.00 C ATOM 0 H TRP B 11 6.026 -0.223 25.916 1.00 0.00 H new ATOM 0 HA TRP B 11 4.224 -2.423 26.357 1.00 0.00 H new ATOM 0 HB2 TRP B 11 4.651 -0.675 23.907 1.00 0.00 H new ATOM 0 HB3 TRP B 11 3.248 -1.667 24.252 1.00 0.00 H new ATOM 0 HD1 TRP B 11 4.611 1.777 24.821 1.00 0.00 H new ATOM 0 HE1 TRP B 11 3.057 3.155 26.361 1.00 0.00 H new ATOM 0 HE3 TRP B 11 1.608 -2.024 26.440 1.00 0.00 H new ATOM 0 HZ2 TRP B 11 0.849 2.641 28.030 1.00 0.00 H new ATOM 0 HZ3 TRP B 11 -0.212 -1.503 28.014 1.00 0.00 H new ATOM 0 HH2 TRP B 11 -0.587 0.798 28.794 1.00 0.00 H new ATOM 1363 N HIS B 12 4.950 -4.192 24.746 1.00 0.00 N ATOM 1364 CA HIS B 12 5.539 -5.325 24.048 1.00 0.00 C ATOM 1365 C HIS B 12 5.071 -5.374 22.600 1.00 0.00 C ATOM 1366 O HIS B 12 4.368 -4.474 22.132 1.00 0.00 O ATOM 1367 CB HIS B 12 5.205 -6.635 24.768 1.00 0.00 C ATOM 1368 CG HIS B 12 5.945 -6.813 26.059 1.00 0.00 C ATOM 1369 ND1 HIS B 12 7.084 -7.579 26.172 1.00 0.00 N ATOM 1370 CD2 HIS B 12 5.702 -6.324 27.300 1.00 0.00 C ATOM 1371 CE1 HIS B 12 7.507 -7.556 27.420 1.00 0.00 C ATOM 1372 NE2 HIS B 12 6.687 -6.802 28.129 1.00 0.00 N ATOM 0 H HIS B 12 4.038 -4.379 25.162 1.00 0.00 H new ATOM 0 HA HIS B 12 6.622 -5.198 24.050 1.00 0.00 H new ATOM 0 HB2 HIS B 12 4.133 -6.669 24.965 1.00 0.00 H new ATOM 0 HB3 HIS B 12 5.435 -7.472 24.108 1.00 0.00 H new ATOM 0 HD2 HIS B 12 4.885 -5.678 27.584 1.00 0.00 H new ATOM 0 HE1 HIS B 12 8.379 -8.068 27.799 1.00 0.00 H new ATOM 0 HE2 HIS B 12 6.771 -6.607 29.127 1.00 0.00 H new ATOM 1381 N ASP B 13 5.468 -6.424 21.890 1.00 0.00 N ATOM 1382 CA ASP B 13 5.148 -6.554 20.475 1.00 0.00 C ATOM 1383 C ASP B 13 3.671 -6.877 20.268 1.00 0.00 C ATOM 1384 O ASP B 13 3.217 -8.006 20.471 1.00 0.00 O ATOM 1385 CB ASP B 13 6.045 -7.604 19.795 1.00 0.00 C ATOM 1386 CG ASP B 13 5.956 -8.985 20.419 1.00 0.00 C ATOM 1387 OD1 ASP B 13 6.498 -9.179 21.533 1.00 0.00 O ATOM 1388 OD2 ASP B 13 5.354 -9.885 19.803 1.00 0.00 O ATOM 0 H ASP B 13 6.012 -7.197 22.272 1.00 0.00 H new ATOM 0 HA ASP B 13 5.346 -5.591 20.003 1.00 0.00 H new ATOM 0 HB2 ASP B 13 5.772 -7.673 18.742 1.00 0.00 H new ATOM 0 HB3 ASP B 13 7.080 -7.264 19.835 1.00 0.00 H new ATOM 1393 N LYS B 14 2.919 -5.853 19.901 1.00 0.00 N ATOM 1394 CA LYS B 14 1.517 -6.006 19.553 1.00 0.00 C ATOM 1395 C LYS B 14 1.163 -5.011 18.461 1.00 0.00 C ATOM 1396 O LYS B 14 0.452 -5.336 17.512 1.00 0.00 O ATOM 1397 CB LYS B 14 0.616 -5.803 20.775 1.00 0.00 C ATOM 1398 CG LYS B 14 -0.860 -6.038 20.480 1.00 0.00 C ATOM 1399 CD LYS B 14 -1.717 -5.915 21.728 1.00 0.00 C ATOM 1400 CE LYS B 14 -1.357 -6.970 22.764 1.00 0.00 C ATOM 1401 NZ LYS B 14 -2.266 -6.923 23.937 1.00 0.00 N ATOM 0 H LYS B 14 3.262 -4.895 19.836 1.00 0.00 H new ATOM 0 HA LYS B 14 1.353 -7.021 19.191 1.00 0.00 H new ATOM 0 HB2 LYS B 14 0.933 -6.480 21.568 1.00 0.00 H new ATOM 0 HB3 LYS B 14 0.747 -4.788 21.150 1.00 0.00 H new ATOM 0 HG2 LYS B 14 -1.200 -5.319 19.735 1.00 0.00 H new ATOM 0 HG3 LYS B 14 -0.990 -7.030 20.048 1.00 0.00 H new ATOM 0 HD2 LYS B 14 -1.590 -4.922 22.160 1.00 0.00 H new ATOM 0 HD3 LYS B 14 -2.769 -6.013 21.459 1.00 0.00 H new ATOM 0 HE2 LYS B 14 -1.404 -7.959 22.307 1.00 0.00 H new ATOM 0 HE3 LYS B 14 -0.329 -6.819 23.094 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 -1.989 -7.656 24.620 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 -2.203 -5.988 24.388 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 -3.244 -7.092 23.625 1.00 0.00 H new ATOM 1415 N LEU B 15 1.668 -3.790 18.603 1.00 0.00 N ATOM 1416 CA LEU B 15 1.537 -2.789 17.557 1.00 0.00 C ATOM 1417 C LEU B 15 2.459 -3.158 16.404 1.00 0.00 C ATOM 1418 O LEU B 15 3.666 -2.914 16.454 1.00 0.00 O ATOM 1419 CB LEU B 15 1.873 -1.381 18.076 1.00 0.00 C ATOM 1420 CG LEU B 15 0.865 -0.765 19.058 1.00 0.00 C ATOM 1421 CD1 LEU B 15 0.924 -1.450 20.417 1.00 0.00 C ATOM 1422 CD2 LEU B 15 1.115 0.727 19.206 1.00 0.00 C ATOM 0 H LEU B 15 2.171 -3.473 19.432 1.00 0.00 H new ATOM 0 HA LEU B 15 0.501 -2.771 17.218 1.00 0.00 H new ATOM 0 HB2 LEU B 15 2.848 -1.418 18.563 1.00 0.00 H new ATOM 0 HB3 LEU B 15 1.970 -0.714 17.220 1.00 0.00 H new ATOM 0 HG LEU B 15 -0.134 -0.917 18.650 1.00 0.00 H new ATOM 0 HD11 LEU B 15 0.198 -0.990 21.088 1.00 0.00 H new ATOM 0 HD12 LEU B 15 0.691 -2.509 20.301 1.00 0.00 H new ATOM 0 HD13 LEU B 15 1.925 -1.342 20.836 1.00 0.00 H new ATOM 0 HD21 LEU B 15 0.393 1.149 19.905 1.00 0.00 H new ATOM 0 HD22 LEU B 15 2.124 0.891 19.584 1.00 0.00 H new ATOM 0 HD23 LEU B 15 1.007 1.212 18.236 1.00 0.00 H new ATOM 1434 N THR B 16 1.891 -3.779 15.387 1.00 0.00 N ATOM 1435 CA THR B 16 2.668 -4.286 14.273 1.00 0.00 C ATOM 1436 C THR B 16 2.929 -3.207 13.229 1.00 0.00 C ATOM 1437 O THR B 16 1.995 -2.612 12.686 1.00 0.00 O ATOM 1438 CB THR B 16 1.961 -5.486 13.613 1.00 0.00 C ATOM 1439 OG1 THR B 16 0.560 -5.208 13.464 1.00 0.00 O ATOM 1440 CG2 THR B 16 2.148 -6.748 14.440 1.00 0.00 C ATOM 0 H THR B 16 0.888 -3.945 15.310 1.00 0.00 H new ATOM 0 HA THR B 16 3.628 -4.611 14.675 1.00 0.00 H new ATOM 0 HB THR B 16 2.406 -5.647 12.631 1.00 0.00 H new ATOM 0 HG1 THR B 16 0.441 -4.294 13.132 1.00 0.00 H new ATOM 0 HG21 THR B 16 1.640 -7.581 13.953 1.00 0.00 H new ATOM 0 HG22 THR B 16 3.211 -6.972 14.526 1.00 0.00 H new ATOM 0 HG23 THR B 16 1.727 -6.597 15.434 1.00 0.00 H new ATOM 1448 N GLU B 17 4.201 -2.954 12.963 1.00 0.00 N ATOM 1449 CA GLU B 17 4.589 -2.003 11.936 1.00 0.00 C ATOM 1450 C GLU B 17 4.627 -2.690 10.579 1.00 0.00 C ATOM 1451 O GLU B 17 4.459 -3.907 10.477 1.00 0.00 O ATOM 1452 CB GLU B 17 5.960 -1.397 12.248 1.00 0.00 C ATOM 1453 CG GLU B 17 5.921 0.092 12.570 1.00 0.00 C ATOM 1454 CD GLU B 17 5.330 0.927 11.450 1.00 0.00 C ATOM 1455 OE1 GLU B 17 5.546 0.590 10.259 1.00 0.00 O ATOM 1456 OE2 GLU B 17 4.661 1.934 11.752 1.00 0.00 O ATOM 0 H GLU B 17 4.983 -3.396 13.446 1.00 0.00 H new ATOM 0 HA GLU B 17 3.851 -1.201 11.915 1.00 0.00 H new ATOM 0 HB2 GLU B 17 6.397 -1.929 13.092 1.00 0.00 H new ATOM 0 HB3 GLU B 17 6.619 -1.557 11.395 1.00 0.00 H new ATOM 0 HG2 GLU B 17 5.337 0.246 13.477 1.00 0.00 H new ATOM 0 HG3 GLU B 17 6.933 0.439 12.779 1.00 0.00 H new ATOM 1463 N THR B 18 4.838 -1.904 9.543 1.00 0.00 N ATOM 1464 CA THR B 18 4.925 -2.413 8.188 1.00 0.00 C ATOM 1465 C THR B 18 5.730 -1.439 7.347 1.00 0.00 C ATOM 1466 O THR B 18 6.812 -1.762 6.853 1.00 0.00 O ATOM 1467 CB THR B 18 3.526 -2.600 7.556 1.00 0.00 C ATOM 1468 OG1 THR B 18 2.656 -3.293 8.462 1.00 0.00 O ATOM 1469 CG2 THR B 18 3.620 -3.377 6.250 1.00 0.00 C ATOM 0 H THR B 18 4.954 -0.893 9.616 1.00 0.00 H new ATOM 0 HA THR B 18 5.411 -3.388 8.220 1.00 0.00 H new ATOM 0 HB THR B 18 3.118 -1.611 7.349 1.00 0.00 H new ATOM 0 HG1 THR B 18 1.774 -3.403 8.049 1.00 0.00 H new ATOM 0 HG21 THR B 18 2.623 -3.496 5.825 1.00 0.00 H new ATOM 0 HG22 THR B 18 4.252 -2.833 5.548 1.00 0.00 H new ATOM 0 HG23 THR B 18 4.052 -4.359 6.441 1.00 0.00 H new ATOM 1477 N ASP B 19 5.189 -0.239 7.224 1.00 0.00 N ATOM 1478 CA ASP B 19 5.834 0.858 6.521 1.00 0.00 C ATOM 1479 C ASP B 19 4.986 2.101 6.716 1.00 0.00 C ATOM 1480 O ASP B 19 4.862 2.940 5.828 1.00 0.00 O ATOM 1481 CB ASP B 19 5.990 0.541 5.026 1.00 0.00 C ATOM 1482 CG ASP B 19 6.867 1.551 4.308 1.00 0.00 C ATOM 1483 OD1 ASP B 19 7.996 1.805 4.785 1.00 0.00 O ATOM 1484 OD2 ASP B 19 6.439 2.097 3.272 1.00 0.00 O ATOM 0 H ASP B 19 4.278 0.004 7.614 1.00 0.00 H new ATOM 0 HA ASP B 19 6.835 1.015 6.922 1.00 0.00 H new ATOM 0 HB2 ASP B 19 6.419 -0.455 4.911 1.00 0.00 H new ATOM 0 HB3 ASP B 19 5.006 0.520 4.557 1.00 0.00 H new ATOM 1489 N VAL B 20 4.399 2.207 7.903 1.00 0.00 N ATOM 1490 CA VAL B 20 3.454 3.279 8.192 1.00 0.00 C ATOM 1491 C VAL B 20 4.142 4.639 8.152 1.00 0.00 C ATOM 1492 O VAL B 20 4.873 5.015 9.070 1.00 0.00 O ATOM 1493 CB VAL B 20 2.760 3.084 9.556 1.00 0.00 C ATOM 1494 CG1 VAL B 20 1.746 4.190 9.811 1.00 0.00 C ATOM 1495 CG2 VAL B 20 2.090 1.719 9.622 1.00 0.00 C ATOM 0 H VAL B 20 4.560 1.565 8.679 1.00 0.00 H new ATOM 0 HA VAL B 20 2.690 3.243 7.416 1.00 0.00 H new ATOM 0 HB VAL B 20 3.520 3.135 10.335 1.00 0.00 H new ATOM 0 HG11 VAL B 20 1.270 4.031 10.778 1.00 0.00 H new ATOM 0 HG12 VAL B 20 2.252 5.155 9.810 1.00 0.00 H new ATOM 0 HG13 VAL B 20 0.989 4.177 9.027 1.00 0.00 H new ATOM 0 HG21 VAL B 20 1.605 1.598 10.591 1.00 0.00 H new ATOM 0 HG22 VAL B 20 1.344 1.641 8.831 1.00 0.00 H new ATOM 0 HG23 VAL B 20 2.840 0.939 9.492 1.00 0.00 H new ATOM 1505 N GLN B 21 3.914 5.351 7.066 1.00 0.00 N ATOM 1506 CA GLN B 21 4.494 6.662 6.854 1.00 0.00 C ATOM 1507 C GLN B 21 3.436 7.733 7.065 1.00 0.00 C ATOM 1508 O GLN B 21 2.239 7.454 6.987 1.00 0.00 O ATOM 1509 CB GLN B 21 5.064 6.750 5.433 1.00 0.00 C ATOM 1510 CG GLN B 21 4.084 6.280 4.368 1.00 0.00 C ATOM 1511 CD GLN B 21 4.659 6.322 2.968 1.00 0.00 C ATOM 1512 OE1 GLN B 21 5.864 6.189 2.767 1.00 0.00 O ATOM 1513 NE2 GLN B 21 3.792 6.492 1.984 1.00 0.00 N ATOM 0 H GLN B 21 3.318 5.034 6.302 1.00 0.00 H new ATOM 0 HA GLN B 21 5.301 6.821 7.569 1.00 0.00 H new ATOM 0 HB2 GLN B 21 5.350 7.781 5.226 1.00 0.00 H new ATOM 0 HB3 GLN B 21 5.972 6.149 5.374 1.00 0.00 H new ATOM 0 HG2 GLN B 21 3.772 5.261 4.595 1.00 0.00 H new ATOM 0 HG3 GLN B 21 3.190 6.903 4.406 1.00 0.00 H new ATOM 0 HE21 GLN B 21 2.799 6.599 2.192 1.00 0.00 H new ATOM 0 HE22 GLN B 21 4.116 6.516 1.017 1.00 0.00 H new ATOM 1522 N ILE B 22 3.863 8.948 7.348 1.00 0.00 N ATOM 1523 CA ILE B 22 2.936 10.057 7.484 1.00 0.00 C ATOM 1524 C ILE B 22 3.413 11.232 6.640 1.00 0.00 C ATOM 1525 O ILE B 22 4.600 11.339 6.330 1.00 0.00 O ATOM 1526 CB ILE B 22 2.762 10.502 8.956 1.00 0.00 C ATOM 1527 CG1 ILE B 22 2.405 9.313 9.851 1.00 0.00 C ATOM 1528 CG2 ILE B 22 1.676 11.557 9.063 1.00 0.00 C ATOM 1529 CD1 ILE B 22 2.064 9.716 11.269 1.00 0.00 C ATOM 0 H ILE B 22 4.843 9.193 7.488 1.00 0.00 H new ATOM 0 HA ILE B 22 1.963 9.715 7.132 1.00 0.00 H new ATOM 0 HB ILE B 22 3.711 10.921 9.292 1.00 0.00 H new ATOM 0 HG12 ILE B 22 1.558 8.782 9.417 1.00 0.00 H new ATOM 0 HG13 ILE B 22 3.243 8.616 9.870 1.00 0.00 H new ATOM 0 HG21 ILE B 22 1.565 11.860 10.104 1.00 0.00 H new ATOM 0 HG22 ILE B 22 1.949 12.423 8.460 1.00 0.00 H new ATOM 0 HG23 ILE B 22 0.733 11.146 8.702 1.00 0.00 H new ATOM 0 HD11 ILE B 22 1.820 8.827 11.851 1.00 0.00 H new ATOM 0 HD12 ILE B 22 2.918 10.222 11.719 1.00 0.00 H new ATOM 0 HD13 ILE B 22 1.207 10.390 11.260 1.00 0.00 H new ATOM 1541 N ASP B 23 2.485 12.095 6.259 1.00 0.00 N ATOM 1542 CA ASP B 23 2.787 13.225 5.401 1.00 0.00 C ATOM 1543 C ASP B 23 3.318 14.405 6.217 1.00 0.00 C ATOM 1544 O ASP B 23 3.702 14.258 7.382 1.00 0.00 O ATOM 1545 CB ASP B 23 1.523 13.644 4.644 1.00 0.00 C ATOM 1546 CG ASP B 23 0.520 14.364 5.529 1.00 0.00 C ATOM 1547 OD1 ASP B 23 0.123 13.803 6.577 1.00 0.00 O ATOM 1548 OD2 ASP B 23 0.153 15.506 5.187 1.00 0.00 O ATOM 0 H ASP B 23 1.505 12.031 6.536 1.00 0.00 H new ATOM 0 HA ASP B 23 3.559 12.926 4.692 1.00 0.00 H new ATOM 0 HB2 ASP B 23 1.800 14.293 3.814 1.00 0.00 H new ATOM 0 HB3 ASP B 23 1.053 12.760 4.214 1.00 0.00 H new ATOM 1553 N PHE B 24 3.333 15.572 5.589 1.00 0.00 N ATOM 1554 CA PHE B 24 3.825 16.791 6.210 1.00 0.00 C ATOM 1555 C PHE B 24 2.875 17.283 7.300 1.00 0.00 C ATOM 1556 O PHE B 24 3.311 17.877 8.288 1.00 0.00 O ATOM 1557 CB PHE B 24 4.006 17.872 5.137 1.00 0.00 C ATOM 1558 CG PHE B 24 4.562 19.168 5.658 1.00 0.00 C ATOM 1559 CD1 PHE B 24 5.921 19.311 5.885 1.00 0.00 C ATOM 1560 CD2 PHE B 24 3.726 20.242 5.920 1.00 0.00 C ATOM 1561 CE1 PHE B 24 6.436 20.499 6.364 1.00 0.00 C ATOM 1562 CE2 PHE B 24 4.236 21.433 6.401 1.00 0.00 C ATOM 1563 CZ PHE B 24 5.592 21.561 6.623 1.00 0.00 C ATOM 0 H PHE B 24 3.003 15.699 4.632 1.00 0.00 H new ATOM 0 HA PHE B 24 4.785 16.576 6.680 1.00 0.00 H new ATOM 0 HB2 PHE B 24 4.669 17.491 4.361 1.00 0.00 H new ATOM 0 HB3 PHE B 24 3.042 18.066 4.666 1.00 0.00 H new ATOM 0 HD1 PHE B 24 6.585 18.483 5.685 1.00 0.00 H new ATOM 0 HD2 PHE B 24 2.664 20.147 5.746 1.00 0.00 H new ATOM 0 HE1 PHE B 24 7.498 20.598 6.536 1.00 0.00 H new ATOM 0 HE2 PHE B 24 3.574 22.262 6.603 1.00 0.00 H new ATOM 0 HZ PHE B 24 5.993 22.491 6.999 1.00 0.00 H new ATOM 1573 N TYR B 25 1.583 17.034 7.125 1.00 0.00 N ATOM 1574 CA TYR B 25 0.588 17.522 8.068 1.00 0.00 C ATOM 1575 C TYR B 25 0.600 16.694 9.348 1.00 0.00 C ATOM 1576 O TYR B 25 0.495 17.239 10.448 1.00 0.00 O ATOM 1577 CB TYR B 25 -0.805 17.509 7.442 1.00 0.00 C ATOM 1578 CG TYR B 25 -1.563 18.799 7.657 1.00 0.00 C ATOM 1579 CD1 TYR B 25 -1.444 19.849 6.756 1.00 0.00 C ATOM 1580 CD2 TYR B 25 -2.386 18.969 8.761 1.00 0.00 C ATOM 1581 CE1 TYR B 25 -2.125 21.034 6.948 1.00 0.00 C ATOM 1582 CE2 TYR B 25 -3.071 20.153 8.960 1.00 0.00 C ATOM 1583 CZ TYR B 25 -2.937 21.182 8.051 1.00 0.00 C ATOM 1584 OH TYR B 25 -3.615 22.364 8.250 1.00 0.00 O ATOM 0 H TYR B 25 1.203 16.500 6.343 1.00 0.00 H new ATOM 0 HA TYR B 25 0.844 18.551 8.321 1.00 0.00 H new ATOM 0 HB2 TYR B 25 -0.714 17.322 6.372 1.00 0.00 H new ATOM 0 HB3 TYR B 25 -1.378 16.683 7.863 1.00 0.00 H new ATOM 0 HD1 TYR B 25 -0.808 19.736 5.891 1.00 0.00 H new ATOM 0 HD2 TYR B 25 -2.493 18.165 9.475 1.00 0.00 H new ATOM 0 HE1 TYR B 25 -2.022 21.841 6.237 1.00 0.00 H new ATOM 0 HE2 TYR B 25 -3.709 20.272 9.824 1.00 0.00 H new ATOM 0 HH TYR B 25 -4.144 22.303 9.073 1.00 0.00 H new ATOM 1594 N GLY B 26 0.732 15.381 9.209 1.00 0.00 N ATOM 1595 CA GLY B 26 0.806 14.531 10.372 1.00 0.00 C ATOM 1596 C GLY B 26 -0.472 13.759 10.612 1.00 0.00 C ATOM 1597 O GLY B 26 -0.869 13.549 11.759 1.00 0.00 O ATOM 0 H GLY B 26 0.789 14.895 8.314 1.00 0.00 H new ATOM 0 HA2 GLY B 26 1.632 13.830 10.253 1.00 0.00 H new ATOM 0 HA3 GLY B 26 1.028 15.140 11.248 1.00 0.00 H new ATOM 1601 N ASP B 27 -1.128 13.346 9.537 1.00 0.00 N ATOM 1602 CA ASP B 27 -2.322 12.521 9.658 1.00 0.00 C ATOM 1603 C ASP B 27 -1.923 11.049 9.694 1.00 0.00 C ATOM 1604 O ASP B 27 -1.679 10.498 10.767 1.00 0.00 O ATOM 1605 CB ASP B 27 -3.295 12.790 8.505 1.00 0.00 C ATOM 1606 CG ASP B 27 -4.643 12.127 8.716 1.00 0.00 C ATOM 1607 OD1 ASP B 27 -5.506 12.728 9.388 1.00 0.00 O ATOM 1608 OD2 ASP B 27 -4.852 11.009 8.205 1.00 0.00 O ATOM 0 H ASP B 27 -0.857 13.566 8.579 1.00 0.00 H new ATOM 0 HA ASP B 27 -2.833 12.776 10.587 1.00 0.00 H new ATOM 0 HB2 ASP B 27 -3.436 13.865 8.396 1.00 0.00 H new ATOM 0 HB3 ASP B 27 -2.858 12.430 7.574 1.00 0.00 H new ATOM 1613 N GLU B 28 -1.836 10.436 8.513 1.00 0.00 N ATOM 1614 CA GLU B 28 -1.335 9.071 8.359 1.00 0.00 C ATOM 1615 C GLU B 28 -1.462 8.646 6.898 1.00 0.00 C ATOM 1616 O GLU B 28 -2.521 8.810 6.287 1.00 0.00 O ATOM 1617 CB GLU B 28 -2.090 8.080 9.252 1.00 0.00 C ATOM 1618 CG GLU B 28 -1.454 6.700 9.288 1.00 0.00 C ATOM 1619 CD GLU B 28 -2.178 5.743 10.212 1.00 0.00 C ATOM 1620 OE1 GLU B 28 -3.265 5.255 9.837 1.00 0.00 O ATOM 1621 OE2 GLU B 28 -1.669 5.480 11.322 1.00 0.00 O ATOM 0 H GLU B 28 -2.112 10.874 7.634 1.00 0.00 H new ATOM 0 HA GLU B 28 -0.289 9.061 8.665 1.00 0.00 H new ATOM 0 HB2 GLU B 28 -2.137 8.478 10.266 1.00 0.00 H new ATOM 0 HB3 GLU B 28 -3.117 7.990 8.897 1.00 0.00 H new ATOM 0 HG2 GLU B 28 -1.441 6.285 8.280 1.00 0.00 H new ATOM 0 HG3 GLU B 28 -0.416 6.792 9.608 1.00 0.00 H new ATOM 1628 N VAL B 29 -0.384 8.114 6.343 1.00 0.00 N ATOM 1629 CA VAL B 29 -0.361 7.717 4.944 1.00 0.00 C ATOM 1630 C VAL B 29 -0.211 6.205 4.812 1.00 0.00 C ATOM 1631 O VAL B 29 0.821 5.632 5.169 1.00 0.00 O ATOM 1632 CB VAL B 29 0.783 8.414 4.175 1.00 0.00 C ATOM 1633 CG1 VAL B 29 0.749 8.040 2.702 1.00 0.00 C ATOM 1634 CG2 VAL B 29 0.702 9.922 4.342 1.00 0.00 C ATOM 0 H VAL B 29 0.490 7.947 6.842 1.00 0.00 H new ATOM 0 HA VAL B 29 -1.311 8.025 4.508 1.00 0.00 H new ATOM 0 HB VAL B 29 1.729 8.072 4.594 1.00 0.00 H new ATOM 0 HG11 VAL B 29 1.564 8.542 2.180 1.00 0.00 H new ATOM 0 HG12 VAL B 29 0.862 6.961 2.598 1.00 0.00 H new ATOM 0 HG13 VAL B 29 -0.203 8.348 2.270 1.00 0.00 H new ATOM 0 HG21 VAL B 29 1.517 10.393 3.792 1.00 0.00 H new ATOM 0 HG22 VAL B 29 -0.252 10.280 3.955 1.00 0.00 H new ATOM 0 HG23 VAL B 29 0.783 10.176 5.399 1.00 0.00 H new ATOM 1644 N THR B 30 -1.250 5.565 4.311 1.00 0.00 N ATOM 1645 CA THR B 30 -1.236 4.130 4.095 1.00 0.00 C ATOM 1646 C THR B 30 -1.111 3.827 2.602 1.00 0.00 C ATOM 1647 O THR B 30 -1.214 4.733 1.776 1.00 0.00 O ATOM 1648 CB THR B 30 -2.514 3.477 4.662 1.00 0.00 C ATOM 1649 OG1 THR B 30 -3.674 4.028 4.030 1.00 0.00 O ATOM 1650 CG2 THR B 30 -2.610 3.683 6.167 1.00 0.00 C ATOM 0 H THR B 30 -2.122 6.021 4.044 1.00 0.00 H new ATOM 0 HA THR B 30 -0.376 3.712 4.619 1.00 0.00 H new ATOM 0 HB THR B 30 -2.463 2.407 4.458 1.00 0.00 H new ATOM 0 HG1 THR B 30 -3.714 4.992 4.202 1.00 0.00 H new ATOM 0 HG21 THR B 30 -3.520 3.213 6.541 1.00 0.00 H new ATOM 0 HG22 THR B 30 -1.743 3.233 6.652 1.00 0.00 H new ATOM 0 HG23 THR B 30 -2.636 4.750 6.387 1.00 0.00 H new ATOM 1658 N PRO B 31 -0.863 2.559 2.238 1.00 0.00 N ATOM 1659 CA PRO B 31 -0.777 2.126 0.831 1.00 0.00 C ATOM 1660 C PRO B 31 -2.047 2.394 0.013 1.00 0.00 C ATOM 1661 O PRO B 31 -2.074 2.143 -1.190 1.00 0.00 O ATOM 1662 CB PRO B 31 -0.535 0.616 0.930 1.00 0.00 C ATOM 1663 CG PRO B 31 0.021 0.397 2.293 1.00 0.00 C ATOM 1664 CD PRO B 31 -0.585 1.454 3.170 1.00 0.00 C ATOM 0 HA PRO B 31 0.004 2.680 0.310 1.00 0.00 H new ATOM 0 HB2 PRO B 31 -1.461 0.059 0.789 1.00 0.00 H new ATOM 0 HB3 PRO B 31 0.161 0.278 0.162 1.00 0.00 H new ATOM 0 HG2 PRO B 31 -0.226 -0.600 2.658 1.00 0.00 H new ATOM 0 HG3 PRO B 31 1.108 0.474 2.286 1.00 0.00 H new ATOM 0 HD2 PRO B 31 -1.495 1.100 3.655 1.00 0.00 H new ATOM 0 HD3 PRO B 31 0.100 1.759 3.961 1.00 0.00 H new ATOM 1672 N VAL B 32 -3.098 2.887 0.657 1.00 0.00 N ATOM 1673 CA VAL B 32 -4.326 3.220 -0.052 1.00 0.00 C ATOM 1674 C VAL B 32 -4.486 4.734 -0.178 1.00 0.00 C ATOM 1675 O VAL B 32 -5.464 5.223 -0.745 1.00 0.00 O ATOM 1676 CB VAL B 32 -5.576 2.627 0.636 1.00 0.00 C ATOM 1677 CG1 VAL B 32 -5.441 1.120 0.791 1.00 0.00 C ATOM 1678 CG2 VAL B 32 -5.833 3.289 1.981 1.00 0.00 C ATOM 0 H VAL B 32 -3.125 3.064 1.661 1.00 0.00 H new ATOM 0 HA VAL B 32 -4.243 2.778 -1.045 1.00 0.00 H new ATOM 0 HB VAL B 32 -6.436 2.830 -0.002 1.00 0.00 H new ATOM 0 HG11 VAL B 32 -6.332 0.723 1.278 1.00 0.00 H new ATOM 0 HG12 VAL B 32 -5.330 0.662 -0.192 1.00 0.00 H new ATOM 0 HG13 VAL B 32 -4.565 0.894 1.398 1.00 0.00 H new ATOM 0 HG21 VAL B 32 -6.719 2.850 2.439 1.00 0.00 H new ATOM 0 HG22 VAL B 32 -4.973 3.135 2.633 1.00 0.00 H new ATOM 0 HG23 VAL B 32 -5.992 4.358 1.836 1.00 0.00 H new ATOM 1688 N ASP B 33 -3.512 5.469 0.346 1.00 0.00 N ATOM 1689 CA ASP B 33 -3.545 6.926 0.300 1.00 0.00 C ATOM 1690 C ASP B 33 -2.731 7.446 -0.867 1.00 0.00 C ATOM 1691 O ASP B 33 -1.631 6.963 -1.138 1.00 0.00 O ATOM 1692 CB ASP B 33 -3.010 7.536 1.599 1.00 0.00 C ATOM 1693 CG ASP B 33 -3.963 7.376 2.761 1.00 0.00 C ATOM 1694 OD1 ASP B 33 -5.031 8.022 2.752 1.00 0.00 O ATOM 1695 OD2 ASP B 33 -3.640 6.619 3.699 1.00 0.00 O ATOM 0 H ASP B 33 -2.690 5.080 0.808 1.00 0.00 H new ATOM 0 HA ASP B 33 -4.587 7.221 0.175 1.00 0.00 H new ATOM 0 HB2 ASP B 33 -2.058 7.067 1.849 1.00 0.00 H new ATOM 0 HB3 ASP B 33 -2.812 8.596 1.442 1.00 0.00 H new ATOM 1700 N ASP B 34 -3.280 8.429 -1.558 1.00 0.00 N ATOM 1701 CA ASP B 34 -2.583 9.063 -2.664 1.00 0.00 C ATOM 1702 C ASP B 34 -1.599 10.084 -2.110 1.00 0.00 C ATOM 1703 O ASP B 34 -2.002 11.122 -1.581 1.00 0.00 O ATOM 1704 CB ASP B 34 -3.584 9.744 -3.605 1.00 0.00 C ATOM 1705 CG ASP B 34 -3.303 9.453 -5.066 1.00 0.00 C ATOM 1706 OD1 ASP B 34 -3.700 8.368 -5.548 1.00 0.00 O ATOM 1707 OD2 ASP B 34 -2.704 10.308 -5.746 1.00 0.00 O ATOM 0 H ASP B 34 -4.209 8.807 -1.372 1.00 0.00 H new ATOM 0 HA ASP B 34 -2.042 8.308 -3.234 1.00 0.00 H new ATOM 0 HB2 ASP B 34 -4.592 9.410 -3.360 1.00 0.00 H new ATOM 0 HB3 ASP B 34 -3.556 10.821 -3.441 1.00 0.00 H new ATOM 1712 N TYR B 35 -0.313 9.782 -2.195 1.00 0.00 N ATOM 1713 CA TYR B 35 0.697 10.656 -1.623 1.00 0.00 C ATOM 1714 C TYR B 35 1.755 11.025 -2.654 1.00 0.00 C ATOM 1715 O TYR B 35 1.975 10.304 -3.623 1.00 0.00 O ATOM 1716 CB TYR B 35 1.358 9.997 -0.404 1.00 0.00 C ATOM 1717 CG TYR B 35 2.375 8.924 -0.744 1.00 0.00 C ATOM 1718 CD1 TYR B 35 1.980 7.628 -1.054 1.00 0.00 C ATOM 1719 CD2 TYR B 35 3.733 9.214 -0.749 1.00 0.00 C ATOM 1720 CE1 TYR B 35 2.913 6.654 -1.361 1.00 0.00 C ATOM 1721 CE2 TYR B 35 4.669 8.249 -1.052 1.00 0.00 C ATOM 1722 CZ TYR B 35 4.257 6.971 -1.359 1.00 0.00 C ATOM 1723 OH TYR B 35 5.193 6.003 -1.657 1.00 0.00 O ATOM 0 H TYR B 35 0.053 8.946 -2.650 1.00 0.00 H new ATOM 0 HA TYR B 35 0.198 11.570 -1.302 1.00 0.00 H new ATOM 0 HB2 TYR B 35 1.848 10.769 0.190 1.00 0.00 H new ATOM 0 HB3 TYR B 35 0.581 9.558 0.222 1.00 0.00 H new ATOM 0 HD1 TYR B 35 0.929 7.378 -1.055 1.00 0.00 H new ATOM 0 HD2 TYR B 35 4.062 10.215 -0.511 1.00 0.00 H new ATOM 0 HE1 TYR B 35 2.592 5.651 -1.601 1.00 0.00 H new ATOM 0 HE2 TYR B 35 5.721 8.494 -1.049 1.00 0.00 H new ATOM 0 HH TYR B 35 6.091 6.392 -1.612 1.00 0.00 H new ATOM 1733 N VAL B 36 2.397 12.154 -2.428 1.00 0.00 N ATOM 1734 CA VAL B 36 3.486 12.622 -3.267 1.00 0.00 C ATOM 1735 C VAL B 36 4.665 12.989 -2.380 1.00 0.00 C ATOM 1736 O VAL B 36 4.470 13.447 -1.257 1.00 0.00 O ATOM 1737 CB VAL B 36 3.051 13.845 -4.110 1.00 0.00 C ATOM 1738 CG1 VAL B 36 4.236 14.547 -4.752 1.00 0.00 C ATOM 1739 CG2 VAL B 36 2.071 13.420 -5.181 1.00 0.00 C ATOM 0 H VAL B 36 2.177 12.778 -1.652 1.00 0.00 H new ATOM 0 HA VAL B 36 3.772 11.828 -3.957 1.00 0.00 H new ATOM 0 HB VAL B 36 2.572 14.551 -3.431 1.00 0.00 H new ATOM 0 HG11 VAL B 36 3.883 15.399 -5.334 1.00 0.00 H new ATOM 0 HG12 VAL B 36 4.917 14.895 -3.975 1.00 0.00 H new ATOM 0 HG13 VAL B 36 4.759 13.851 -5.408 1.00 0.00 H new ATOM 0 HG21 VAL B 36 1.773 14.289 -5.767 1.00 0.00 H new ATOM 0 HG22 VAL B 36 2.542 12.686 -5.835 1.00 0.00 H new ATOM 0 HG23 VAL B 36 1.191 12.978 -4.714 1.00 0.00 H new ATOM 1749 N ILE B 37 5.877 12.769 -2.857 1.00 0.00 N ATOM 1750 CA ILE B 37 7.051 13.090 -2.064 1.00 0.00 C ATOM 1751 C ILE B 37 7.857 14.196 -2.725 1.00 0.00 C ATOM 1752 O ILE B 37 8.226 14.092 -3.894 1.00 0.00 O ATOM 1753 CB ILE B 37 7.959 11.864 -1.839 1.00 0.00 C ATOM 1754 CG1 ILE B 37 7.196 10.752 -1.119 1.00 0.00 C ATOM 1755 CG2 ILE B 37 9.188 12.259 -1.035 1.00 0.00 C ATOM 1756 CD1 ILE B 37 8.068 9.572 -0.755 1.00 0.00 C ATOM 0 H ILE B 37 6.074 12.375 -3.777 1.00 0.00 H new ATOM 0 HA ILE B 37 6.689 13.426 -1.092 1.00 0.00 H new ATOM 0 HB ILE B 37 8.278 11.491 -2.812 1.00 0.00 H new ATOM 0 HG12 ILE B 37 6.746 11.157 -0.212 1.00 0.00 H new ATOM 0 HG13 ILE B 37 6.379 10.410 -1.755 1.00 0.00 H new ATOM 0 HG21 ILE B 37 9.820 11.384 -0.883 1.00 0.00 H new ATOM 0 HG22 ILE B 37 9.748 13.022 -1.577 1.00 0.00 H new ATOM 0 HG23 ILE B 37 8.878 12.655 -0.068 1.00 0.00 H new ATOM 0 HD11 ILE B 37 7.467 8.818 -0.247 1.00 0.00 H new ATOM 0 HD12 ILE B 37 8.497 9.144 -1.661 1.00 0.00 H new ATOM 0 HD13 ILE B 37 8.870 9.902 -0.095 1.00 0.00 H new ATOM 1768 N ASP B 38 8.132 15.252 -1.978 1.00 0.00 N ATOM 1769 CA ASP B 38 8.926 16.352 -2.507 1.00 0.00 C ATOM 1770 C ASP B 38 10.368 16.187 -2.059 1.00 0.00 C ATOM 1771 O ASP B 38 10.781 16.718 -1.031 1.00 0.00 O ATOM 1772 CB ASP B 38 8.367 17.709 -2.065 1.00 0.00 C ATOM 1773 CG ASP B 38 8.997 18.876 -2.812 1.00 0.00 C ATOM 1774 OD1 ASP B 38 8.899 18.909 -4.053 1.00 0.00 O ATOM 1775 OD2 ASP B 38 9.589 19.766 -2.161 1.00 0.00 O ATOM 0 H ASP B 38 7.822 15.372 -1.014 1.00 0.00 H new ATOM 0 HA ASP B 38 8.881 16.328 -3.596 1.00 0.00 H new ATOM 0 HB2 ASP B 38 7.289 17.722 -2.223 1.00 0.00 H new ATOM 0 HB3 ASP B 38 8.534 17.835 -0.995 1.00 0.00 H new ATOM 1780 N GLY B 39 11.107 15.371 -2.802 1.00 0.00 N ATOM 1781 CA GLY B 39 12.505 15.127 -2.489 1.00 0.00 C ATOM 1782 C GLY B 39 12.705 14.069 -1.419 1.00 0.00 C ATOM 1783 O GLY B 39 13.523 13.168 -1.574 1.00 0.00 O ATOM 0 H GLY B 39 10.761 14.871 -3.621 1.00 0.00 H new ATOM 0 HA2 GLY B 39 13.025 14.819 -3.396 1.00 0.00 H new ATOM 0 HA3 GLY B 39 12.964 16.059 -2.159 1.00 0.00 H new ATOM 1787 N GLY B 40 11.926 14.157 -0.355 1.00 0.00 N ATOM 1788 CA GLY B 40 12.110 13.282 0.785 1.00 0.00 C ATOM 1789 C GLY B 40 10.961 13.400 1.758 1.00 0.00 C ATOM 1790 O GLY B 40 10.605 12.438 2.433 1.00 0.00 O ATOM 0 H GLY B 40 11.161 14.825 -0.259 1.00 0.00 H new ATOM 0 HA2 GLY B 40 12.196 12.250 0.444 1.00 0.00 H new ATOM 0 HA3 GLY B 40 13.044 13.530 1.290 1.00 0.00 H new ATOM 1794 N GLU B 41 10.369 14.584 1.811 1.00 0.00 N ATOM 1795 CA GLU B 41 9.202 14.821 2.640 1.00 0.00 C ATOM 1796 C GLU B 41 7.944 14.333 1.934 1.00 0.00 C ATOM 1797 O GLU B 41 7.746 14.580 0.742 1.00 0.00 O ATOM 1798 CB GLU B 41 9.068 16.312 2.972 1.00 0.00 C ATOM 1799 CG GLU B 41 10.048 16.818 4.026 1.00 0.00 C ATOM 1800 CD GLU B 41 11.502 16.580 3.669 1.00 0.00 C ATOM 1801 OE1 GLU B 41 11.911 16.912 2.537 1.00 0.00 O ATOM 1802 OE2 GLU B 41 12.253 16.081 4.536 1.00 0.00 O ATOM 0 H GLU B 41 10.682 15.400 1.285 1.00 0.00 H new ATOM 0 HA GLU B 41 9.326 14.266 3.570 1.00 0.00 H new ATOM 0 HB2 GLU B 41 9.208 16.889 2.058 1.00 0.00 H new ATOM 0 HB3 GLU B 41 8.052 16.504 3.317 1.00 0.00 H new ATOM 0 HG2 GLU B 41 9.889 17.886 4.174 1.00 0.00 H new ATOM 0 HG3 GLU B 41 9.831 16.329 4.976 1.00 0.00 H new ATOM 1809 N ILE B 42 7.113 13.625 2.677 1.00 0.00 N ATOM 1810 CA ILE B 42 5.876 13.063 2.156 1.00 0.00 C ATOM 1811 C ILE B 42 4.733 14.051 2.325 1.00 0.00 C ATOM 1812 O ILE B 42 4.635 14.718 3.351 1.00 0.00 O ATOM 1813 CB ILE B 42 5.518 11.754 2.896 1.00 0.00 C ATOM 1814 CG1 ILE B 42 6.695 10.779 2.840 1.00 0.00 C ATOM 1815 CG2 ILE B 42 4.267 11.117 2.300 1.00 0.00 C ATOM 1816 CD1 ILE B 42 6.507 9.545 3.695 1.00 0.00 C ATOM 0 H ILE B 42 7.276 13.422 3.663 1.00 0.00 H new ATOM 0 HA ILE B 42 6.025 12.852 1.097 1.00 0.00 H new ATOM 0 HB ILE B 42 5.310 11.994 3.939 1.00 0.00 H new ATOM 0 HG12 ILE B 42 6.852 10.473 1.806 1.00 0.00 H new ATOM 0 HG13 ILE B 42 7.599 11.297 3.160 1.00 0.00 H new ATOM 0 HG21 ILE B 42 4.036 10.197 2.838 1.00 0.00 H new ATOM 0 HG22 ILE B 42 3.429 11.809 2.387 1.00 0.00 H new ATOM 0 HG23 ILE B 42 4.441 10.889 1.248 1.00 0.00 H new ATOM 0 HD11 ILE B 42 7.382 8.902 3.603 1.00 0.00 H new ATOM 0 HD12 ILE B 42 6.381 9.840 4.737 1.00 0.00 H new ATOM 0 HD13 ILE B 42 5.622 9.003 3.362 1.00 0.00 H new ATOM 1828 N ILE B 43 3.889 14.167 1.313 1.00 0.00 N ATOM 1829 CA ILE B 43 2.714 15.017 1.398 1.00 0.00 C ATOM 1830 C ILE B 43 1.509 14.304 0.797 1.00 0.00 C ATOM 1831 O ILE B 43 1.592 13.753 -0.300 1.00 0.00 O ATOM 1832 CB ILE B 43 2.894 16.365 0.652 1.00 0.00 C ATOM 1833 CG1 ILE B 43 4.272 16.984 0.909 1.00 0.00 C ATOM 1834 CG2 ILE B 43 1.808 17.341 1.071 1.00 0.00 C ATOM 1835 CD1 ILE B 43 5.338 16.528 -0.065 1.00 0.00 C ATOM 0 H ILE B 43 3.996 13.682 0.422 1.00 0.00 H new ATOM 0 HA ILE B 43 2.562 15.226 2.457 1.00 0.00 H new ATOM 0 HB ILE B 43 2.815 16.160 -0.416 1.00 0.00 H new ATOM 0 HG12 ILE B 43 4.187 18.070 0.859 1.00 0.00 H new ATOM 0 HG13 ILE B 43 4.588 16.736 1.922 1.00 0.00 H new ATOM 0 HG21 ILE B 43 1.943 18.284 0.542 1.00 0.00 H new ATOM 0 HG22 ILE B 43 0.831 16.925 0.827 1.00 0.00 H new ATOM 0 HG23 ILE B 43 1.870 17.515 2.145 1.00 0.00 H new ATOM 0 HD11 ILE B 43 6.285 17.009 0.181 1.00 0.00 H new ATOM 0 HD12 ILE B 43 5.452 15.446 0.001 1.00 0.00 H new ATOM 0 HD13 ILE B 43 5.045 16.801 -1.079 1.00 0.00 H new ATOM 1847 N LEU B 44 0.399 14.288 1.524 1.00 0.00 N ATOM 1848 CA LEU B 44 -0.854 13.802 0.962 1.00 0.00 C ATOM 1849 C LEU B 44 -1.245 14.646 -0.238 1.00 0.00 C ATOM 1850 O LEU B 44 -0.939 15.838 -0.291 1.00 0.00 O ATOM 1851 CB LEU B 44 -1.977 13.858 1.999 1.00 0.00 C ATOM 1852 CG LEU B 44 -1.887 12.824 3.115 1.00 0.00 C ATOM 1853 CD1 LEU B 44 -2.948 13.082 4.172 1.00 0.00 C ATOM 1854 CD2 LEU B 44 -2.031 11.419 2.547 1.00 0.00 C ATOM 0 H LEU B 44 0.340 14.602 2.493 1.00 0.00 H new ATOM 0 HA LEU B 44 -0.707 12.766 0.656 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -1.986 14.852 2.447 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -2.930 13.731 1.485 1.00 0.00 H new ATOM 0 HG LEU B 44 -0.908 12.910 3.586 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -2.867 12.333 4.960 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -2.803 14.074 4.599 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -3.937 13.024 3.717 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -1.965 10.691 3.356 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -2.997 11.324 2.052 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -1.234 11.234 1.826 1.00 0.00 H new ATOM 1866 N ARG B 45 -1.940 14.036 -1.186 1.00 0.00 N ATOM 1867 CA ARG B 45 -2.443 14.752 -2.356 1.00 0.00 C ATOM 1868 C ARG B 45 -3.416 15.855 -1.945 1.00 0.00 C ATOM 1869 O ARG B 45 -3.769 16.717 -2.748 1.00 0.00 O ATOM 1870 CB ARG B 45 -3.115 13.768 -3.312 1.00 0.00 C ATOM 1871 CG ARG B 45 -2.129 12.948 -4.123 1.00 0.00 C ATOM 1872 CD ARG B 45 -1.689 13.654 -5.390 1.00 0.00 C ATOM 1873 NE ARG B 45 -0.795 12.795 -6.155 1.00 0.00 N ATOM 1874 CZ ARG B 45 -0.582 12.890 -7.464 1.00 0.00 C ATOM 1875 NH1 ARG B 45 -1.143 13.864 -8.169 1.00 0.00 N ATOM 1876 NH2 ARG B 45 0.210 12.008 -8.064 1.00 0.00 N ATOM 0 H ARG B 45 -2.171 13.043 -1.171 1.00 0.00 H new ATOM 0 HA ARG B 45 -1.603 15.224 -2.865 1.00 0.00 H new ATOM 0 HB2 ARG B 45 -3.752 13.094 -2.739 1.00 0.00 H new ATOM 0 HB3 ARG B 45 -3.764 14.319 -3.992 1.00 0.00 H new ATOM 0 HG2 ARG B 45 -1.254 12.729 -3.511 1.00 0.00 H new ATOM 0 HG3 ARG B 45 -2.584 11.992 -4.383 1.00 0.00 H new ATOM 0 HD2 ARG B 45 -2.560 13.914 -5.992 1.00 0.00 H new ATOM 0 HD3 ARG B 45 -1.184 14.587 -5.140 1.00 0.00 H new ATOM 0 HE ARG B 45 -0.294 12.065 -5.648 1.00 0.00 H new ATOM 0 HH11 ARG B 45 -1.743 14.547 -7.707 1.00 0.00 H new ATOM 0 HH12 ARG B 45 -0.974 13.929 -9.173 1.00 0.00 H new ATOM 0 HH21 ARG B 45 0.649 11.265 -7.521 1.00 0.00 H new ATOM 0 HH22 ARG B 45 0.378 12.074 -9.068 1.00 0.00 H new ATOM 1890 N GLU B 46 -3.829 15.829 -0.682 1.00 0.00 N ATOM 1891 CA GLU B 46 -4.725 16.838 -0.140 1.00 0.00 C ATOM 1892 C GLU B 46 -3.977 18.147 0.106 1.00 0.00 C ATOM 1893 O GLU B 46 -4.516 19.234 -0.109 1.00 0.00 O ATOM 1894 CB GLU B 46 -5.344 16.334 1.164 1.00 0.00 C ATOM 1895 CG GLU B 46 -6.348 17.290 1.783 1.00 0.00 C ATOM 1896 CD GLU B 46 -7.005 16.712 3.017 1.00 0.00 C ATOM 1897 OE1 GLU B 46 -7.818 15.776 2.870 1.00 0.00 O ATOM 1898 OE2 GLU B 46 -6.720 17.196 4.134 1.00 0.00 O ATOM 0 H GLU B 46 -3.553 15.112 -0.011 1.00 0.00 H new ATOM 0 HA GLU B 46 -5.517 17.026 -0.865 1.00 0.00 H new ATOM 0 HB2 GLU B 46 -5.836 15.380 0.975 1.00 0.00 H new ATOM 0 HB3 GLU B 46 -4.547 16.145 1.883 1.00 0.00 H new ATOM 0 HG2 GLU B 46 -5.846 18.222 2.044 1.00 0.00 H new ATOM 0 HG3 GLU B 46 -7.114 17.536 1.047 1.00 0.00 H new ATOM 1905 N ASN B 47 -2.727 18.040 0.534 1.00 0.00 N ATOM 1906 CA ASN B 47 -1.941 19.216 0.880 1.00 0.00 C ATOM 1907 C ASN B 47 -0.807 19.417 -0.118 1.00 0.00 C ATOM 1908 O ASN B 47 0.057 20.275 0.070 1.00 0.00 O ATOM 1909 CB ASN B 47 -1.369 19.090 2.298 1.00 0.00 C ATOM 1910 CG ASN B 47 -2.440 18.856 3.348 1.00 0.00 C ATOM 1911 OD1 ASN B 47 -3.109 19.791 3.789 1.00 0.00 O ATOM 1912 ND2 ASN B 47 -2.585 17.613 3.789 1.00 0.00 N ATOM 0 H ASN B 47 -2.236 17.153 0.650 1.00 0.00 H new ATOM 0 HA ASN B 47 -2.601 20.083 0.844 1.00 0.00 H new ATOM 0 HB2 ASN B 47 -0.655 18.267 2.325 1.00 0.00 H new ATOM 0 HB3 ASN B 47 -0.818 19.998 2.544 1.00 0.00 H new ATOM 0 HD21 ASN B 47 -3.269 17.407 4.517 1.00 0.00 H new ATOM 0 HD22 ASN B 47 -2.013 16.864 3.400 1.00 0.00 H new ATOM 1919 N LEU B 48 -0.830 18.625 -1.185 1.00 0.00 N ATOM 1920 CA LEU B 48 0.224 18.652 -2.192 1.00 0.00 C ATOM 1921 C LEU B 48 0.334 20.026 -2.848 1.00 0.00 C ATOM 1922 O LEU B 48 1.430 20.578 -2.964 1.00 0.00 O ATOM 1923 CB LEU B 48 -0.029 17.589 -3.268 1.00 0.00 C ATOM 1924 CG LEU B 48 0.962 17.612 -4.431 1.00 0.00 C ATOM 1925 CD1 LEU B 48 2.370 17.328 -3.937 1.00 0.00 C ATOM 1926 CD2 LEU B 48 0.555 16.610 -5.498 1.00 0.00 C ATOM 0 H LEU B 48 -1.573 17.952 -1.375 1.00 0.00 H new ATOM 0 HA LEU B 48 1.164 18.435 -1.684 1.00 0.00 H new ATOM 0 HB2 LEU B 48 0.001 16.604 -2.801 1.00 0.00 H new ATOM 0 HB3 LEU B 48 -1.036 17.723 -3.663 1.00 0.00 H new ATOM 0 HG LEU B 48 0.950 18.608 -4.875 1.00 0.00 H new ATOM 0 HD11 LEU B 48 3.062 17.348 -4.779 1.00 0.00 H new ATOM 0 HD12 LEU B 48 2.660 18.086 -3.210 1.00 0.00 H new ATOM 0 HD13 LEU B 48 2.399 16.345 -3.467 1.00 0.00 H new ATOM 0 HD21 LEU B 48 1.272 16.640 -6.318 1.00 0.00 H new ATOM 0 HD22 LEU B 48 0.537 15.608 -5.069 1.00 0.00 H new ATOM 0 HD23 LEU B 48 -0.437 16.861 -5.874 1.00 0.00 H new ATOM 1938 N GLU B 49 -0.803 20.574 -3.260 1.00 0.00 N ATOM 1939 CA GLU B 49 -0.829 21.840 -3.979 1.00 0.00 C ATOM 1940 C GLU B 49 -0.175 22.949 -3.163 1.00 0.00 C ATOM 1941 O GLU B 49 0.663 23.694 -3.675 1.00 0.00 O ATOM 1942 CB GLU B 49 -2.263 22.234 -4.324 1.00 0.00 C ATOM 1943 CG GLU B 49 -2.350 23.421 -5.265 1.00 0.00 C ATOM 1944 CD GLU B 49 -3.750 23.971 -5.363 1.00 0.00 C ATOM 1945 OE1 GLU B 49 -4.584 23.374 -6.076 1.00 0.00 O ATOM 1946 OE2 GLU B 49 -4.026 24.998 -4.716 1.00 0.00 O ATOM 0 H GLU B 49 -1.722 20.159 -3.107 1.00 0.00 H new ATOM 0 HA GLU B 49 -0.264 21.707 -4.901 1.00 0.00 H new ATOM 0 HB2 GLU B 49 -2.767 21.381 -4.779 1.00 0.00 H new ATOM 0 HB3 GLU B 49 -2.799 22.468 -3.404 1.00 0.00 H new ATOM 0 HG2 GLU B 49 -1.677 24.206 -4.920 1.00 0.00 H new ATOM 0 HG3 GLU B 49 -2.009 23.122 -6.256 1.00 0.00 H new ATOM 1953 N ARG B 50 -0.551 23.057 -1.893 1.00 0.00 N ATOM 1954 CA ARG B 50 0.037 24.066 -1.029 1.00 0.00 C ATOM 1955 C ARG B 50 1.522 23.817 -0.829 1.00 0.00 C ATOM 1956 O ARG B 50 2.318 24.736 -0.950 1.00 0.00 O ATOM 1957 CB ARG B 50 -0.660 24.141 0.328 1.00 0.00 C ATOM 1958 CG ARG B 50 -1.929 24.975 0.316 1.00 0.00 C ATOM 1959 CD ARG B 50 -2.040 25.820 1.575 1.00 0.00 C ATOM 1960 NE ARG B 50 -0.939 26.786 1.687 1.00 0.00 N ATOM 1961 CZ ARG B 50 -0.944 27.834 2.514 1.00 0.00 C ATOM 1962 NH1 ARG B 50 -1.977 28.045 3.319 1.00 0.00 N ATOM 1963 NH2 ARG B 50 0.085 28.672 2.534 1.00 0.00 N ATOM 0 H ARG B 50 -1.251 22.465 -1.446 1.00 0.00 H new ATOM 0 HA ARG B 50 -0.101 25.023 -1.532 1.00 0.00 H new ATOM 0 HB2 ARG B 50 -0.902 23.131 0.659 1.00 0.00 H new ATOM 0 HB3 ARG B 50 0.032 24.558 1.060 1.00 0.00 H new ATOM 0 HG2 ARG B 50 -1.935 25.622 -0.561 1.00 0.00 H new ATOM 0 HG3 ARG B 50 -2.797 24.321 0.236 1.00 0.00 H new ATOM 0 HD2 ARG B 50 -2.991 26.353 1.572 1.00 0.00 H new ATOM 0 HD3 ARG B 50 -2.042 25.169 2.450 1.00 0.00 H new ATOM 0 HE ARG B 50 -0.119 26.647 1.096 1.00 0.00 H new ATOM 0 HH11 ARG B 50 -2.771 27.405 3.308 1.00 0.00 H new ATOM 0 HH12 ARG B 50 -1.977 28.847 3.949 1.00 0.00 H new ATOM 0 HH21 ARG B 50 0.882 28.516 1.917 1.00 0.00 H new ATOM 0 HH22 ARG B 50 0.079 29.472 3.167 1.00 0.00 H new ATOM 1977 N TYR B 51 1.898 22.577 -0.553 1.00 0.00 N ATOM 1978 CA TYR B 51 3.292 22.260 -0.268 1.00 0.00 C ATOM 1979 C TYR B 51 4.189 22.641 -1.443 1.00 0.00 C ATOM 1980 O TYR B 51 5.288 23.159 -1.251 1.00 0.00 O ATOM 1981 CB TYR B 51 3.462 20.778 0.061 1.00 0.00 C ATOM 1982 CG TYR B 51 4.826 20.444 0.621 1.00 0.00 C ATOM 1983 CD1 TYR B 51 5.080 20.552 1.983 1.00 0.00 C ATOM 1984 CD2 TYR B 51 5.857 20.018 -0.207 1.00 0.00 C ATOM 1985 CE1 TYR B 51 6.323 20.247 2.502 1.00 0.00 C ATOM 1986 CE2 TYR B 51 7.102 19.711 0.306 1.00 0.00 C ATOM 1987 CZ TYR B 51 7.330 19.826 1.660 1.00 0.00 C ATOM 1988 OH TYR B 51 8.567 19.515 2.176 1.00 0.00 O ATOM 0 H TYR B 51 1.264 21.779 -0.520 1.00 0.00 H new ATOM 0 HA TYR B 51 3.591 22.844 0.602 1.00 0.00 H new ATOM 0 HB2 TYR B 51 2.699 20.483 0.781 1.00 0.00 H new ATOM 0 HB3 TYR B 51 3.293 20.191 -0.842 1.00 0.00 H new ATOM 0 HD1 TYR B 51 4.293 20.880 2.646 1.00 0.00 H new ATOM 0 HD2 TYR B 51 5.682 19.925 -1.269 1.00 0.00 H new ATOM 0 HE1 TYR B 51 6.505 20.338 3.563 1.00 0.00 H new ATOM 0 HE2 TYR B 51 7.893 19.382 -0.351 1.00 0.00 H new ATOM 0 HH TYR B 51 9.163 19.235 1.450 1.00 0.00 H new ATOM 1998 N LEU B 52 3.711 22.405 -2.657 1.00 0.00 N ATOM 1999 CA LEU B 52 4.483 22.736 -3.847 1.00 0.00 C ATOM 2000 C LEU B 52 4.535 24.243 -4.077 1.00 0.00 C ATOM 2001 O LEU B 52 5.497 24.753 -4.640 1.00 0.00 O ATOM 2002 CB LEU B 52 3.916 22.037 -5.083 1.00 0.00 C ATOM 2003 CG LEU B 52 4.024 20.510 -5.072 1.00 0.00 C ATOM 2004 CD1 LEU B 52 3.610 19.942 -6.421 1.00 0.00 C ATOM 2005 CD2 LEU B 52 5.440 20.074 -4.718 1.00 0.00 C ATOM 0 H LEU B 52 2.799 21.989 -2.844 1.00 0.00 H new ATOM 0 HA LEU B 52 5.500 22.380 -3.680 1.00 0.00 H new ATOM 0 HB2 LEU B 52 2.866 22.311 -5.187 1.00 0.00 H new ATOM 0 HB3 LEU B 52 4.433 22.416 -5.965 1.00 0.00 H new ATOM 0 HG LEU B 52 3.348 20.121 -4.310 1.00 0.00 H new ATOM 0 HD11 LEU B 52 3.692 18.855 -6.399 1.00 0.00 H new ATOM 0 HD12 LEU B 52 2.579 20.224 -6.634 1.00 0.00 H new ATOM 0 HD13 LEU B 52 4.262 20.339 -7.199 1.00 0.00 H new ATOM 0 HD21 LEU B 52 5.496 18.985 -4.716 1.00 0.00 H new ATOM 0 HD22 LEU B 52 6.138 20.471 -5.455 1.00 0.00 H new ATOM 0 HD23 LEU B 52 5.701 20.453 -3.730 1.00 0.00 H new ATOM 2017 N ARG B 53 3.513 24.963 -3.638 1.00 0.00 N ATOM 2018 CA ARG B 53 3.509 26.411 -3.810 1.00 0.00 C ATOM 2019 C ARG B 53 4.229 27.086 -2.641 1.00 0.00 C ATOM 2020 O ARG B 53 4.516 28.282 -2.683 1.00 0.00 O ATOM 2021 CB ARG B 53 2.082 26.959 -3.964 1.00 0.00 C ATOM 2022 CG ARG B 53 1.284 27.011 -2.674 1.00 0.00 C ATOM 2023 CD ARG B 53 0.017 27.836 -2.835 1.00 0.00 C ATOM 2024 NE ARG B 53 -0.996 27.179 -3.668 1.00 0.00 N ATOM 2025 CZ ARG B 53 -1.561 27.747 -4.737 1.00 0.00 C ATOM 2026 NH1 ARG B 53 -1.083 28.885 -5.223 1.00 0.00 N ATOM 2027 NH2 ARG B 53 -2.586 27.161 -5.340 1.00 0.00 N ATOM 0 H ARG B 53 2.692 24.580 -3.170 1.00 0.00 H new ATOM 0 HA ARG B 53 4.045 26.641 -4.731 1.00 0.00 H new ATOM 0 HB2 ARG B 53 2.136 27.964 -4.384 1.00 0.00 H new ATOM 0 HB3 ARG B 53 1.545 26.341 -4.684 1.00 0.00 H new ATOM 0 HG2 ARG B 53 1.023 25.999 -2.365 1.00 0.00 H new ATOM 0 HG3 ARG B 53 1.899 27.438 -1.882 1.00 0.00 H new ATOM 0 HD2 ARG B 53 -0.406 28.037 -1.851 1.00 0.00 H new ATOM 0 HD3 ARG B 53 0.272 28.800 -3.276 1.00 0.00 H new ATOM 0 HE ARG B 53 -1.286 26.234 -3.416 1.00 0.00 H new ATOM 0 HH11 ARG B 53 -0.280 29.331 -4.780 1.00 0.00 H new ATOM 0 HH12 ARG B 53 -1.519 29.314 -6.040 1.00 0.00 H new ATOM 0 HH21 ARG B 53 -2.946 26.274 -4.988 1.00 0.00 H new ATOM 0 HH22 ARG B 53 -3.015 27.597 -6.156 1.00 0.00 H new ATOM 2041 N GLU B 54 4.506 26.311 -1.597 1.00 0.00 N ATOM 2042 CA GLU B 54 5.277 26.800 -0.461 1.00 0.00 C ATOM 2043 C GLU B 54 6.759 26.491 -0.658 1.00 0.00 C ATOM 2044 O GLU B 54 7.603 27.388 -0.622 1.00 0.00 O ATOM 2045 CB GLU B 54 4.801 26.160 0.850 1.00 0.00 C ATOM 2046 CG GLU B 54 3.343 26.428 1.202 1.00 0.00 C ATOM 2047 CD GLU B 54 3.026 27.896 1.377 1.00 0.00 C ATOM 2048 OE1 GLU B 54 3.684 28.557 2.203 1.00 0.00 O ATOM 2049 OE2 GLU B 54 2.094 28.391 0.707 1.00 0.00 O ATOM 0 H GLU B 54 4.207 25.339 -1.515 1.00 0.00 H new ATOM 0 HA GLU B 54 5.128 27.878 -0.400 1.00 0.00 H new ATOM 0 HB2 GLU B 54 4.952 25.082 0.787 1.00 0.00 H new ATOM 0 HB3 GLU B 54 5.429 26.523 1.664 1.00 0.00 H new ATOM 0 HG2 GLU B 54 2.707 26.018 0.418 1.00 0.00 H new ATOM 0 HG3 GLU B 54 3.096 25.899 2.122 1.00 0.00 H new ATOM 2056 N GLN B 55 7.068 25.215 -0.886 1.00 0.00 N ATOM 2057 CA GLN B 55 8.447 24.768 -0.981 1.00 0.00 C ATOM 2058 C GLN B 55 8.868 24.560 -2.433 1.00 0.00 C ATOM 2059 O GLN B 55 9.725 25.294 -2.930 1.00 0.00 O ATOM 2060 CB GLN B 55 8.646 23.481 -0.170 1.00 0.00 C ATOM 2061 CG GLN B 55 10.040 22.875 -0.296 1.00 0.00 C ATOM 2062 CD GLN B 55 10.363 21.907 0.829 1.00 0.00 C ATOM 2063 OE1 GLN B 55 11.106 20.944 0.647 1.00 0.00 O ATOM 2064 NE2 GLN B 55 9.818 22.166 2.009 1.00 0.00 N ATOM 0 H GLN B 55 6.376 24.475 -1.008 1.00 0.00 H new ATOM 0 HA GLN B 55 9.083 25.549 -0.563 1.00 0.00 H new ATOM 0 HB2 GLN B 55 8.447 23.692 0.881 1.00 0.00 H new ATOM 0 HB3 GLN B 55 7.911 22.744 -0.492 1.00 0.00 H new ATOM 0 HG2 GLN B 55 10.121 22.356 -1.251 1.00 0.00 H new ATOM 0 HG3 GLN B 55 10.780 23.675 -0.305 1.00 0.00 H new ATOM 0 HE21 GLN B 55 9.206 22.974 2.122 1.00 0.00 H new ATOM 0 HE22 GLN B 55 10.010 21.557 2.804 1.00 0.00 H new ATOM 2073 N LEU B 56 8.260 23.575 -3.107 1.00 0.00 N ATOM 2074 CA LEU B 56 8.665 23.211 -4.471 1.00 0.00 C ATOM 2075 C LEU B 56 10.161 22.900 -4.470 1.00 0.00 C ATOM 2076 O LEU B 56 10.904 23.326 -5.356 1.00 0.00 O ATOM 2077 CB LEU B 56 8.377 24.369 -5.439 1.00 0.00 C ATOM 2078 CG LEU B 56 8.277 23.994 -6.921 1.00 0.00 C ATOM 2079 CD1 LEU B 56 6.829 23.732 -7.307 1.00 0.00 C ATOM 2080 CD2 LEU B 56 8.880 25.084 -7.795 1.00 0.00 C ATOM 0 H LEU B 56 7.491 23.019 -2.733 1.00 0.00 H new ATOM 0 HA LEU B 56 8.101 22.338 -4.799 1.00 0.00 H new ATOM 0 HB2 LEU B 56 7.442 24.843 -5.140 1.00 0.00 H new ATOM 0 HB3 LEU B 56 9.163 25.116 -5.325 1.00 0.00 H new ATOM 0 HG LEU B 56 8.846 23.078 -7.083 1.00 0.00 H new ATOM 0 HD11 LEU B 56 6.776 23.467 -8.363 1.00 0.00 H new ATOM 0 HD12 LEU B 56 6.435 22.912 -6.707 1.00 0.00 H new ATOM 0 HD13 LEU B 56 6.237 24.629 -7.128 1.00 0.00 H new ATOM 0 HD21 LEU B 56 8.798 24.797 -8.843 1.00 0.00 H new ATOM 0 HD22 LEU B 56 8.344 26.019 -7.632 1.00 0.00 H new ATOM 0 HD23 LEU B 56 9.930 25.218 -7.537 1.00 0.00 H new ATOM 2092 N GLY B 57 10.594 22.154 -3.465 1.00 0.00 N ATOM 2093 CA GLY B 57 12.007 22.057 -3.177 1.00 0.00 C ATOM 2094 C GLY B 57 12.671 20.796 -3.681 1.00 0.00 C ATOM 2095 O GLY B 57 13.702 20.884 -4.360 1.00 0.00 O ATOM 0 H GLY B 57 9.991 21.614 -2.844 1.00 0.00 H new ATOM 0 HA2 GLY B 57 12.513 22.917 -3.615 1.00 0.00 H new ATOM 0 HA3 GLY B 57 12.149 22.119 -2.098 1.00 0.00 H new ATOM 2099 N PHE B 58 12.077 19.635 -3.369 1.00 0.00 N ATOM 2100 CA PHE B 58 12.726 18.318 -3.547 1.00 0.00 C ATOM 2101 C PHE B 58 14.149 18.325 -2.967 1.00 0.00 C ATOM 2102 O PHE B 58 14.569 19.309 -2.354 1.00 0.00 O ATOM 2103 CB PHE B 58 12.688 17.793 -5.004 1.00 0.00 C ATOM 2104 CG PHE B 58 12.586 18.819 -6.105 1.00 0.00 C ATOM 2105 CD1 PHE B 58 11.430 19.570 -6.276 1.00 0.00 C ATOM 2106 CD2 PHE B 58 13.635 19.006 -6.988 1.00 0.00 C ATOM 2107 CE1 PHE B 58 11.332 20.491 -7.300 1.00 0.00 C ATOM 2108 CE2 PHE B 58 13.537 19.920 -8.019 1.00 0.00 C ATOM 2109 CZ PHE B 58 12.384 20.664 -8.174 1.00 0.00 C ATOM 0 H PHE B 58 11.133 19.577 -2.986 1.00 0.00 H new ATOM 0 HA PHE B 58 12.131 17.603 -2.978 1.00 0.00 H new ATOM 0 HB2 PHE B 58 13.589 17.204 -5.174 1.00 0.00 H new ATOM 0 HB3 PHE B 58 11.841 17.114 -5.096 1.00 0.00 H new ATOM 0 HD1 PHE B 58 10.599 19.432 -5.601 1.00 0.00 H new ATOM 0 HD2 PHE B 58 14.541 18.430 -6.870 1.00 0.00 H new ATOM 0 HE1 PHE B 58 10.431 21.076 -7.416 1.00 0.00 H new ATOM 0 HE2 PHE B 58 14.362 20.053 -8.704 1.00 0.00 H new ATOM 0 HZ PHE B 58 12.307 21.380 -8.979 1.00 0.00 H new ATOM 2119 N GLU B 59 14.902 17.237 -3.098 1.00 0.00 N ATOM 2120 CA GLU B 59 16.181 17.217 -2.416 1.00 0.00 C ATOM 2121 C GLU B 59 17.333 17.448 -3.380 1.00 0.00 C ATOM 2122 O GLU B 59 17.750 16.552 -4.114 1.00 0.00 O ATOM 2123 CB GLU B 59 16.381 15.918 -1.641 1.00 0.00 C ATOM 2124 CG GLU B 59 17.557 15.986 -0.685 1.00 0.00 C ATOM 2125 CD GLU B 59 17.648 14.782 0.224 1.00 0.00 C ATOM 2126 OE1 GLU B 59 16.701 14.550 1.007 1.00 0.00 O ATOM 2127 OE2 GLU B 59 18.679 14.084 0.183 1.00 0.00 O ATOM 0 H GLU B 59 14.665 16.405 -3.638 1.00 0.00 H new ATOM 0 HA GLU B 59 16.173 18.039 -1.700 1.00 0.00 H new ATOM 0 HB2 GLU B 59 15.474 15.690 -1.081 1.00 0.00 H new ATOM 0 HB3 GLU B 59 16.536 15.100 -2.344 1.00 0.00 H new ATOM 0 HG2 GLU B 59 18.480 16.072 -1.258 1.00 0.00 H new ATOM 0 HG3 GLU B 59 17.473 16.887 -0.078 1.00 0.00 H new ATOM 2134 N PHE B 60 17.844 18.668 -3.354 1.00 0.00 N ATOM 2135 CA PHE B 60 19.021 19.020 -4.120 1.00 0.00 C ATOM 2136 C PHE B 60 20.276 18.747 -3.313 1.00 0.00 C ATOM 2137 O PHE B 60 20.634 19.512 -2.415 1.00 0.00 O ATOM 2138 CB PHE B 60 18.997 20.493 -4.537 1.00 0.00 C ATOM 2139 CG PHE B 60 18.135 20.781 -5.734 1.00 0.00 C ATOM 2140 CD1 PHE B 60 18.561 20.426 -7.005 1.00 0.00 C ATOM 2141 CD2 PHE B 60 16.913 21.411 -5.593 1.00 0.00 C ATOM 2142 CE1 PHE B 60 17.780 20.697 -8.111 1.00 0.00 C ATOM 2143 CE2 PHE B 60 16.130 21.686 -6.695 1.00 0.00 C ATOM 2144 CZ PHE B 60 16.564 21.326 -7.957 1.00 0.00 C ATOM 0 H PHE B 60 17.456 19.435 -2.805 1.00 0.00 H new ATOM 0 HA PHE B 60 19.022 18.405 -5.020 1.00 0.00 H new ATOM 0 HB2 PHE B 60 18.644 21.091 -3.697 1.00 0.00 H new ATOM 0 HB3 PHE B 60 20.016 20.815 -4.751 1.00 0.00 H new ATOM 0 HD1 PHE B 60 19.513 19.933 -7.131 1.00 0.00 H new ATOM 0 HD2 PHE B 60 16.567 21.691 -4.609 1.00 0.00 H new ATOM 0 HE1 PHE B 60 18.122 20.416 -9.096 1.00 0.00 H new ATOM 0 HE2 PHE B 60 15.179 22.182 -6.572 1.00 0.00 H new ATOM 0 HZ PHE B 60 15.951 21.537 -8.821 1.00 0.00 H new ATOM 2154 N LYS B 61 20.917 17.636 -3.605 1.00 0.00 N ATOM 2155 CA LYS B 61 22.228 17.361 -3.057 1.00 0.00 C ATOM 2156 C LYS B 61 23.278 17.887 -4.024 1.00 0.00 C ATOM 2157 O LYS B 61 22.972 18.157 -5.188 1.00 0.00 O ATOM 2158 CB LYS B 61 22.418 15.861 -2.815 1.00 0.00 C ATOM 2159 CG LYS B 61 21.771 15.344 -1.536 1.00 0.00 C ATOM 2160 CD LYS B 61 22.461 15.902 -0.299 1.00 0.00 C ATOM 2161 CE LYS B 61 22.220 15.039 0.934 1.00 0.00 C ATOM 2162 NZ LYS B 61 20.798 15.034 1.369 1.00 0.00 N ATOM 0 H LYS B 61 20.552 16.908 -4.219 1.00 0.00 H new ATOM 0 HA LYS B 61 22.331 17.860 -2.094 1.00 0.00 H new ATOM 0 HB2 LYS B 61 22.007 15.313 -3.663 1.00 0.00 H new ATOM 0 HB3 LYS B 61 23.485 15.643 -2.782 1.00 0.00 H new ATOM 0 HG2 LYS B 61 20.717 15.621 -1.522 1.00 0.00 H new ATOM 0 HG3 LYS B 61 21.815 14.255 -1.519 1.00 0.00 H new ATOM 0 HD2 LYS B 61 23.532 15.976 -0.485 1.00 0.00 H new ATOM 0 HD3 LYS B 61 22.100 16.913 -0.109 1.00 0.00 H new ATOM 0 HE2 LYS B 61 22.533 14.017 0.722 1.00 0.00 H new ATOM 0 HE3 LYS B 61 22.843 15.401 1.752 1.00 0.00 H new ATOM 0 HZ1 LYS B 61 20.678 14.366 2.157 1.00 0.00 H new ATOM 0 HZ2 LYS B 61 20.527 15.989 1.680 1.00 0.00 H new ATOM 0 HZ3 LYS B 61 20.193 14.743 0.575 1.00 0.00 H new ATOM 2176 N ASN B 62 24.495 18.059 -3.548 1.00 0.00 N ATOM 2177 CA ASN B 62 25.566 18.559 -4.390 1.00 0.00 C ATOM 2178 C ASN B 62 26.904 18.210 -3.764 1.00 0.00 C ATOM 2179 O ASN B 62 27.065 18.298 -2.543 1.00 0.00 O ATOM 2180 CB ASN B 62 25.436 20.078 -4.574 1.00 0.00 C ATOM 2181 CG ASN B 62 26.235 20.600 -5.756 1.00 0.00 C ATOM 2182 OD1 ASN B 62 27.388 21.007 -5.619 1.00 0.00 O ATOM 2183 ND2 ASN B 62 25.621 20.588 -6.928 1.00 0.00 N ATOM 0 H ASN B 62 24.768 17.861 -2.585 1.00 0.00 H new ATOM 0 HA ASN B 62 25.500 18.092 -5.373 1.00 0.00 H new ATOM 0 HB2 ASN B 62 24.385 20.334 -4.711 1.00 0.00 H new ATOM 0 HB3 ASN B 62 25.771 20.579 -3.666 1.00 0.00 H new ATOM 0 HD21 ASN B 62 26.105 20.925 -7.761 1.00 0.00 H new ATOM 0 HD22 ASN B 62 24.664 20.242 -6.999 1.00 0.00 H new ATOM 2190 N ALA B 63 27.847 17.790 -4.590 1.00 0.00 N ATOM 2191 CA ALA B 63 29.170 17.430 -4.112 1.00 0.00 C ATOM 2192 C ALA B 63 29.930 18.682 -3.707 1.00 0.00 C ATOM 2193 O ALA B 63 30.589 18.712 -2.668 1.00 0.00 O ATOM 2194 CB ALA B 63 29.937 16.665 -5.178 1.00 0.00 C ATOM 0 H ALA B 63 27.720 17.690 -5.597 1.00 0.00 H new ATOM 0 HA ALA B 63 29.063 16.782 -3.242 1.00 0.00 H new ATOM 0 HB1 ALA B 63 30.925 16.405 -4.799 1.00 0.00 H new ATOM 0 HB2 ALA B 63 29.395 15.754 -5.433 1.00 0.00 H new ATOM 0 HB3 ALA B 63 30.041 17.286 -6.068 1.00 0.00 H new ATOM 2200 N GLN B 64 29.827 19.712 -4.554 1.00 0.00 N ATOM 2201 CA GLN B 64 30.457 21.017 -4.325 1.00 0.00 C ATOM 2202 C GLN B 64 31.979 20.931 -4.423 1.00 0.00 C ATOM 2203 O GLN B 64 32.674 21.944 -4.328 1.00 0.00 O ATOM 2204 CB GLN B 64 30.047 21.600 -2.968 1.00 0.00 C ATOM 2205 CG GLN B 64 28.544 21.755 -2.800 1.00 0.00 C ATOM 2206 CD GLN B 64 28.157 22.396 -1.483 1.00 0.00 C ATOM 2207 OE1 GLN B 64 28.859 22.265 -0.479 1.00 0.00 O ATOM 2208 NE2 GLN B 64 27.030 23.090 -1.472 1.00 0.00 N ATOM 0 H GLN B 64 29.299 19.663 -5.426 1.00 0.00 H new ATOM 0 HA GLN B 64 30.103 21.685 -5.110 1.00 0.00 H new ATOM 0 HB2 GLN B 64 30.428 20.956 -2.175 1.00 0.00 H new ATOM 0 HB3 GLN B 64 30.520 22.574 -2.843 1.00 0.00 H new ATOM 0 HG2 GLN B 64 28.153 22.358 -3.620 1.00 0.00 H new ATOM 0 HG3 GLN B 64 28.073 20.775 -2.872 1.00 0.00 H new ATOM 0 HE21 GLN B 64 26.476 23.176 -2.324 1.00 0.00 H new ATOM 0 HE22 GLN B 64 26.716 23.539 -0.612 1.00 0.00 H new ATOM 2217 N LEU B 65 32.491 19.728 -4.620 1.00 0.00 N ATOM 2218 CA LEU B 65 33.922 19.516 -4.714 1.00 0.00 C ATOM 2219 C LEU B 65 34.286 18.758 -5.979 1.00 0.00 C ATOM 2220 O LEU B 65 34.010 17.564 -6.103 1.00 0.00 O ATOM 2221 CB LEU B 65 34.466 18.748 -3.500 1.00 0.00 C ATOM 2222 CG LEU B 65 34.722 19.575 -2.234 1.00 0.00 C ATOM 2223 CD1 LEU B 65 33.422 19.918 -1.526 1.00 0.00 C ATOM 2224 CD2 LEU B 65 35.657 18.827 -1.299 1.00 0.00 C ATOM 0 H LEU B 65 31.932 18.880 -4.718 1.00 0.00 H new ATOM 0 HA LEU B 65 34.378 20.506 -4.740 1.00 0.00 H new ATOM 0 HB2 LEU B 65 33.761 17.954 -3.254 1.00 0.00 H new ATOM 0 HB3 LEU B 65 35.400 18.267 -3.790 1.00 0.00 H new ATOM 0 HG LEU B 65 35.195 20.511 -2.531 1.00 0.00 H new ATOM 0 HD11 LEU B 65 33.638 20.504 -0.633 1.00 0.00 H new ATOM 0 HD12 LEU B 65 32.785 20.497 -2.195 1.00 0.00 H new ATOM 0 HD13 LEU B 65 32.909 18.999 -1.242 1.00 0.00 H new ATOM 0 HD21 LEU B 65 35.831 19.424 -0.404 1.00 0.00 H new ATOM 0 HD22 LEU B 65 35.206 17.875 -1.018 1.00 0.00 H new ATOM 0 HD23 LEU B 65 36.606 18.644 -1.803 1.00 0.00 H new ATOM 2236 N GLU B 66 34.892 19.461 -6.917 1.00 0.00 N ATOM 2237 CA GLU B 66 35.549 18.826 -8.049 1.00 0.00 C ATOM 2238 C GLU B 66 37.029 18.683 -7.708 1.00 0.00 C ATOM 2239 O GLU B 66 37.908 18.776 -8.565 1.00 0.00 O ATOM 2240 CB GLU B 66 35.364 19.658 -9.321 1.00 0.00 C ATOM 2241 CG GLU B 66 33.909 19.867 -9.707 1.00 0.00 C ATOM 2242 CD GLU B 66 33.757 20.571 -11.041 1.00 0.00 C ATOM 2243 OE1 GLU B 66 33.978 21.796 -11.100 1.00 0.00 O ATOM 2244 OE2 GLU B 66 33.426 19.896 -12.041 1.00 0.00 O ATOM 0 H GLU B 66 34.944 20.480 -6.919 1.00 0.00 H new ATOM 0 HA GLU B 66 35.109 17.847 -8.238 1.00 0.00 H new ATOM 0 HB2 GLU B 66 35.837 20.630 -9.181 1.00 0.00 H new ATOM 0 HB3 GLU B 66 35.882 19.167 -10.145 1.00 0.00 H new ATOM 0 HG2 GLU B 66 33.406 18.901 -9.750 1.00 0.00 H new ATOM 0 HG3 GLU B 66 33.412 20.451 -8.933 1.00 0.00 H new ATOM 2251 N HIS B 67 37.278 18.431 -6.429 1.00 0.00 N ATOM 2252 CA HIS B 67 38.616 18.479 -5.873 1.00 0.00 C ATOM 2253 C HIS B 67 39.108 17.084 -5.493 1.00 0.00 C ATOM 2254 O HIS B 67 39.397 16.807 -4.329 1.00 0.00 O ATOM 2255 CB HIS B 67 38.616 19.406 -4.652 1.00 0.00 C ATOM 2256 CG HIS B 67 39.979 19.778 -4.157 1.00 0.00 C ATOM 2257 ND1 HIS B 67 40.762 20.734 -4.766 1.00 0.00 N ATOM 2258 CD2 HIS B 67 40.692 19.327 -3.098 1.00 0.00 C ATOM 2259 CE1 HIS B 67 41.897 20.855 -4.102 1.00 0.00 C ATOM 2260 NE2 HIS B 67 41.878 20.012 -3.088 1.00 0.00 N ATOM 0 H HIS B 67 36.555 18.188 -5.752 1.00 0.00 H new ATOM 0 HA HIS B 67 39.300 18.868 -6.627 1.00 0.00 H new ATOM 0 HB2 HIS B 67 38.073 20.317 -4.903 1.00 0.00 H new ATOM 0 HB3 HIS B 67 38.069 18.921 -3.843 1.00 0.00 H new ATOM 0 HD2 HIS B 67 40.383 18.569 -2.393 1.00 0.00 H new ATOM 0 HE1 HIS B 67 42.704 21.530 -4.348 1.00 0.00 H new ATOM 0 HE2 HIS B 67 42.626 19.890 -2.406 1.00 0.00 H new ATOM 2269 N HIS B 68 39.166 16.198 -6.476 1.00 0.00 N ATOM 2270 CA HIS B 68 39.777 14.888 -6.290 1.00 0.00 C ATOM 2271 C HIS B 68 40.193 14.324 -7.641 1.00 0.00 C ATOM 2272 O HIS B 68 39.449 13.588 -8.285 1.00 0.00 O ATOM 2273 CB HIS B 68 38.833 13.915 -5.566 1.00 0.00 C ATOM 2274 CG HIS B 68 39.539 12.728 -4.965 1.00 0.00 C ATOM 2275 ND1 HIS B 68 39.631 12.516 -3.603 1.00 0.00 N ATOM 2276 CD2 HIS B 68 40.199 11.692 -5.544 1.00 0.00 C ATOM 2277 CE1 HIS B 68 40.314 11.409 -3.375 1.00 0.00 C ATOM 2278 NE2 HIS B 68 40.672 10.889 -4.533 1.00 0.00 N ATOM 0 H HIS B 68 38.797 16.362 -7.413 1.00 0.00 H new ATOM 0 HA HIS B 68 40.658 15.009 -5.659 1.00 0.00 H new ATOM 0 HB2 HIS B 68 38.306 14.452 -4.777 1.00 0.00 H new ATOM 0 HB3 HIS B 68 38.079 13.561 -6.270 1.00 0.00 H new ATOM 0 HD2 HIS B 68 40.329 11.529 -6.604 1.00 0.00 H new ATOM 0 HE1 HIS B 68 40.541 10.998 -2.403 1.00 0.00 H new ATOM 0 HE2 HIS B 68 41.211 10.032 -4.658 1.00 0.00 H new ATOM 2287 N HIS B 69 41.385 14.695 -8.073 1.00 0.00 N ATOM 2288 CA HIS B 69 41.889 14.279 -9.374 1.00 0.00 C ATOM 2289 C HIS B 69 42.643 12.958 -9.264 1.00 0.00 C ATOM 2290 O HIS B 69 43.589 12.832 -8.490 1.00 0.00 O ATOM 2291 CB HIS B 69 42.782 15.370 -9.987 1.00 0.00 C ATOM 2292 CG HIS B 69 43.876 15.865 -9.085 1.00 0.00 C ATOM 2293 ND1 HIS B 69 43.724 16.952 -8.256 1.00 0.00 N ATOM 2294 CD2 HIS B 69 45.137 15.420 -8.888 1.00 0.00 C ATOM 2295 CE1 HIS B 69 44.842 17.153 -7.589 1.00 0.00 C ATOM 2296 NE2 HIS B 69 45.718 16.237 -7.951 1.00 0.00 N ATOM 0 H HIS B 69 42.025 15.285 -7.542 1.00 0.00 H new ATOM 0 HA HIS B 69 41.037 14.128 -10.037 1.00 0.00 H new ATOM 0 HB2 HIS B 69 43.231 14.982 -10.901 1.00 0.00 H new ATOM 0 HB3 HIS B 69 42.156 16.215 -10.273 1.00 0.00 H new ATOM 0 HD2 HIS B 69 45.602 14.577 -9.378 1.00 0.00 H new ATOM 0 HE1 HIS B 69 45.012 17.937 -6.866 1.00 0.00 H new ATOM 0 HE2 HIS B 69 46.670 16.150 -7.594 1.00 0.00 H new ATOM 2305 N HIS B 70 42.203 11.963 -10.023 1.00 0.00 N ATOM 2306 CA HIS B 70 42.865 10.665 -10.016 1.00 0.00 C ATOM 2307 C HIS B 70 43.616 10.449 -11.329 1.00 0.00 C ATOM 2308 O HIS B 70 44.843 10.380 -11.345 1.00 0.00 O ATOM 2309 CB HIS B 70 41.846 9.544 -9.772 1.00 0.00 C ATOM 2310 CG HIS B 70 42.460 8.255 -9.306 1.00 0.00 C ATOM 2311 ND1 HIS B 70 43.164 8.143 -8.127 1.00 0.00 N ATOM 2312 CD2 HIS B 70 42.466 7.022 -9.863 1.00 0.00 C ATOM 2313 CE1 HIS B 70 43.574 6.896 -7.978 1.00 0.00 C ATOM 2314 NE2 HIS B 70 43.164 6.195 -9.018 1.00 0.00 N ATOM 0 H HIS B 70 41.398 12.028 -10.646 1.00 0.00 H new ATOM 0 HA HIS B 70 43.589 10.643 -9.202 1.00 0.00 H new ATOM 0 HB2 HIS B 70 41.122 9.880 -9.029 1.00 0.00 H new ATOM 0 HB3 HIS B 70 41.295 9.360 -10.694 1.00 0.00 H new ATOM 0 HD2 HIS B 70 42.007 6.740 -10.799 1.00 0.00 H new ATOM 0 HE1 HIS B 70 44.148 6.515 -7.146 1.00 0.00 H new ATOM 0 HE2 HIS B 70 43.337 5.201 -9.169 1.00 0.00 H new ATOM 2323 N HIS B 71 42.880 10.343 -12.431 1.00 0.00 N ATOM 2324 CA HIS B 71 43.500 10.248 -13.755 1.00 0.00 C ATOM 2325 C HIS B 71 43.269 11.521 -14.557 1.00 0.00 C ATOM 2326 O HIS B 71 43.616 11.598 -15.734 1.00 0.00 O ATOM 2327 CB HIS B 71 42.961 9.045 -14.526 1.00 0.00 C ATOM 2328 CG HIS B 71 43.748 7.790 -14.313 1.00 0.00 C ATOM 2329 ND1 HIS B 71 44.174 6.986 -15.347 1.00 0.00 N ATOM 2330 CD2 HIS B 71 44.186 7.200 -13.177 1.00 0.00 C ATOM 2331 CE1 HIS B 71 44.835 5.955 -14.857 1.00 0.00 C ATOM 2332 NE2 HIS B 71 44.859 6.061 -13.543 1.00 0.00 N ATOM 0 H HIS B 71 41.860 10.321 -12.438 1.00 0.00 H new ATOM 0 HA HIS B 71 44.572 10.117 -13.607 1.00 0.00 H new ATOM 0 HB2 HIS B 71 41.927 8.869 -14.230 1.00 0.00 H new ATOM 0 HB3 HIS B 71 42.952 9.281 -15.590 1.00 0.00 H new ATOM 0 HD2 HIS B 71 44.034 7.558 -12.170 1.00 0.00 H new ATOM 0 HE1 HIS B 71 45.281 5.159 -15.434 1.00 0.00 H new ATOM 0 HE2 HIS B 71 45.305 5.404 -12.903 1.00 0.00 H new ATOM 2341 N HIS B 72 42.683 12.517 -13.914 1.00 0.00 N ATOM 2342 CA HIS B 72 42.427 13.794 -14.562 1.00 0.00 C ATOM 2343 C HIS B 72 43.532 14.775 -14.227 1.00 0.00 C ATOM 2344 O HIS B 72 43.502 15.356 -13.127 1.00 0.00 O ATOM 2345 CB HIS B 72 41.067 14.364 -14.149 1.00 0.00 C ATOM 2346 CG HIS B 72 39.915 13.787 -14.915 1.00 0.00 C ATOM 2347 ND1 HIS B 72 39.066 14.553 -15.681 1.00 0.00 N ATOM 2348 CD2 HIS B 72 39.466 12.514 -15.019 1.00 0.00 C ATOM 2349 CE1 HIS B 72 38.149 13.778 -16.228 1.00 0.00 C ATOM 2350 NE2 HIS B 72 38.369 12.538 -15.838 1.00 0.00 N ATOM 2351 OXT HIS B 72 44.440 14.951 -15.058 1.00 0.00 O ATOM 0 H HIS B 72 42.375 12.467 -12.943 1.00 0.00 H new ATOM 0 HA HIS B 72 42.407 13.631 -15.640 1.00 0.00 H new ATOM 0 HB2 HIS B 72 40.914 14.180 -13.086 1.00 0.00 H new ATOM 0 HB3 HIS B 72 41.079 15.445 -14.287 1.00 0.00 H new ATOM 0 HD2 HIS B 72 39.893 11.643 -14.545 1.00 0.00 H new ATOM 0 HE1 HIS B 72 37.354 14.104 -16.883 1.00 0.00 H new ATOM 0 HE2 HIS B 72 37.811 11.726 -16.104 1.00 0.00 H new TER 2360 HIS B 72