USER MOD reduce.3.24.130724 H: found=0, std=0, add=650, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 651 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 36 ASN : amide:sc= -0.438 X(o=-0.43,f=-0.52) USER MOD Set 1.2: A 38 THR OG1 : rot 180:sc= 0.00823 USER MOD Single : A 21 MET CE :methyl -170:sc= -0.0363 (180deg=-0.206) USER MOD Single : A 23 SER OG : rot -153:sc= 0.536 USER MOD Single : A 27 ASN : amide:sc= -0.311 K(o=-0.31,f=-5.7!) USER MOD Single : A 32 ASN : amide:sc= -0.0196 X(o=-0.02,f=0) USER MOD Single : A 34 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 37 SER OG : rot 180:sc= 0.00179 USER MOD Single : A 55 SER OG : rot -166:sc= 0.655 USER MOD Single : A 68 GLN :FLIP amide:sc= -0.0102 F(o=-1.1,f=-0.01) USER MOD Single : A 82 HIS : no HD1:sc= -0.0718 X(o=-0.072,f=0) USER MOD Single : A 84 GLN :FLIP amide:sc= -0.688 F(o=-2.2!,f=-0.69) USER MOD Single : A 85 GLN : amide:sc= 0.191 X(o=0.19,f=0) USER MOD Single : A 87 LYS NZ :NH3+ -168:sc= 0.697 (180deg=0.622) USER MOD Single : A 90 GLN : amide:sc= 0.124 X(o=0.12,f=-0.11) USER MOD Single : A 91 LYS NZ :NH3+ -148:sc= 0.55 (180deg=0.126) USER MOD Single : A 94 TYR OH : rot 180:sc= 0 USER MOD Single : A 95 THR OG1 : rot 48:sc= 0.233 USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 ASN : amide:sc= -0.156 K(o=-0.16,f=-2.4!) USER MOD Single : A 102 SER OG : rot 50:sc= 0.0932 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 SER OG : rot -47:sc= 0.242 USER MOD Single : A 106 GLN : amide:sc= -0.156 X(o=-0.16,f=-0.0048) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 21 -23.989 -39.548 -10.715 1.00 0.00 N ATOM 2 CA MET A 21 -22.963 -38.701 -10.066 1.00 0.00 C ATOM 3 C MET A 21 -21.808 -38.445 -11.054 1.00 0.00 C ATOM 4 O MET A 21 -21.118 -39.381 -11.461 1.00 0.00 O ATOM 5 CB MET A 21 -22.441 -39.381 -8.770 1.00 0.00 C ATOM 6 CG MET A 21 -21.500 -38.516 -7.925 1.00 0.00 C ATOM 7 SD MET A 21 -20.710 -39.444 -6.586 1.00 0.00 S ATOM 8 CE MET A 21 -22.120 -40.090 -5.669 1.00 0.00 C ATOM 0 HA MET A 21 -23.407 -37.745 -9.788 1.00 0.00 H new ATOM 0 HB2 MET A 21 -23.296 -39.668 -8.158 1.00 0.00 H new ATOM 0 HB3 MET A 21 -21.921 -40.299 -9.042 1.00 0.00 H new ATOM 0 HG2 MET A 21 -20.731 -38.089 -8.568 1.00 0.00 H new ATOM 0 HG3 MET A 21 -22.061 -37.683 -7.502 1.00 0.00 H new ATOM 0 HE1 MET A 21 -21.776 -40.524 -4.730 1.00 0.00 H new ATOM 0 HE2 MET A 21 -22.819 -39.281 -5.459 1.00 0.00 H new ATOM 0 HE3 MET A 21 -22.619 -40.857 -6.262 1.00 0.00 H new ATOM 18 N ALA A 22 -21.635 -37.185 -11.475 1.00 0.00 N ATOM 19 CA ALA A 22 -20.525 -36.787 -12.350 1.00 0.00 C ATOM 20 C ALA A 22 -19.210 -36.727 -11.545 1.00 0.00 C ATOM 21 O ALA A 22 -18.870 -35.691 -10.945 1.00 0.00 O ATOM 22 CB ALA A 22 -20.840 -35.457 -13.052 1.00 0.00 C ATOM 0 H ALA A 22 -22.257 -36.417 -11.220 1.00 0.00 H new ATOM 0 HA ALA A 22 -20.396 -37.536 -13.131 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -20.006 -35.179 -13.696 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -21.742 -35.568 -13.654 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -20.996 -34.679 -12.305 1.00 0.00 H new ATOM 28 N SER A 23 -18.515 -37.882 -11.497 1.00 0.00 N ATOM 29 CA SER A 23 -17.249 -38.048 -10.767 1.00 0.00 C ATOM 30 C SER A 23 -16.485 -39.257 -11.323 1.00 0.00 C ATOM 31 O SER A 23 -16.994 -40.378 -11.267 1.00 0.00 O ATOM 32 CB SER A 23 -17.524 -38.225 -9.250 1.00 0.00 C ATOM 33 OG SER A 23 -18.422 -39.300 -8.990 1.00 0.00 O ATOM 0 H SER A 23 -18.823 -38.732 -11.970 1.00 0.00 H new ATOM 0 HA SER A 23 -16.638 -37.155 -10.901 1.00 0.00 H new ATOM 0 HB2 SER A 23 -16.583 -38.405 -8.730 1.00 0.00 H new ATOM 0 HB3 SER A 23 -17.939 -37.301 -8.847 1.00 0.00 H new ATOM 0 HG SER A 23 -18.896 -39.134 -8.149 1.00 0.00 H new ATOM 39 N GLY A 24 -15.281 -39.026 -11.887 1.00 0.00 N ATOM 40 CA GLY A 24 -14.428 -40.118 -12.382 1.00 0.00 C ATOM 41 C GLY A 24 -15.013 -40.855 -13.586 1.00 0.00 C ATOM 42 O GLY A 24 -14.717 -42.034 -13.808 1.00 0.00 O ATOM 0 H GLY A 24 -14.882 -38.095 -12.009 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -13.454 -39.712 -12.654 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -14.262 -40.832 -11.575 1.00 0.00 H new ATOM 46 N TRP A 25 -15.863 -40.155 -14.350 1.00 0.00 N ATOM 47 CA TRP A 25 -16.585 -40.722 -15.511 1.00 0.00 C ATOM 48 C TRP A 25 -15.819 -40.437 -16.814 1.00 0.00 C ATOM 49 O TRP A 25 -15.857 -41.232 -17.755 1.00 0.00 O ATOM 50 CB TRP A 25 -18.027 -40.147 -15.570 1.00 0.00 C ATOM 51 CG TRP A 25 -18.096 -38.639 -15.756 1.00 0.00 C ATOM 52 CD1 TRP A 25 -17.840 -37.680 -14.816 1.00 0.00 C ATOM 53 CD2 TRP A 25 -18.444 -37.927 -16.955 1.00 0.00 C ATOM 54 NE1 TRP A 25 -17.992 -36.434 -15.354 1.00 0.00 N ATOM 55 CE2 TRP A 25 -18.374 -36.554 -16.660 1.00 0.00 C ATOM 56 CE3 TRP A 25 -18.824 -38.321 -18.241 1.00 0.00 C ATOM 57 CZ2 TRP A 25 -18.640 -35.569 -17.614 1.00 0.00 C ATOM 58 CZ3 TRP A 25 -19.089 -37.347 -19.189 1.00 0.00 C ATOM 59 CH2 TRP A 25 -19.006 -35.985 -18.867 1.00 0.00 C ATOM 0 H TRP A 25 -16.074 -39.171 -14.183 1.00 0.00 H new ATOM 0 HA TRP A 25 -16.651 -41.804 -15.395 1.00 0.00 H new ATOM 0 HB2 TRP A 25 -18.563 -40.627 -16.389 1.00 0.00 H new ATOM 0 HB3 TRP A 25 -18.548 -40.411 -14.650 1.00 0.00 H new ATOM 0 HD1 TRP A 25 -17.558 -37.879 -13.793 1.00 0.00 H new ATOM 0 HE1 TRP A 25 -17.844 -35.554 -14.860 1.00 0.00 H new ATOM 0 HE3 TRP A 25 -18.910 -39.368 -18.491 1.00 0.00 H new ATOM 0 HZ2 TRP A 25 -18.560 -34.519 -17.373 1.00 0.00 H new ATOM 0 HZ3 TRP A 25 -19.364 -37.641 -20.191 1.00 0.00 H new ATOM 0 HH2 TRP A 25 -19.235 -35.248 -19.623 1.00 0.00 H new ATOM 70 N ALA A 26 -15.138 -39.281 -16.847 1.00 0.00 N ATOM 71 CA ALA A 26 -14.303 -38.842 -17.991 1.00 0.00 C ATOM 72 C ALA A 26 -13.128 -37.998 -17.487 1.00 0.00 C ATOM 73 O ALA A 26 -12.327 -37.479 -18.270 1.00 0.00 O ATOM 74 CB ALA A 26 -15.158 -38.028 -18.973 1.00 0.00 C ATOM 0 H ALA A 26 -15.147 -38.614 -16.076 1.00 0.00 H new ATOM 0 HA ALA A 26 -13.909 -39.718 -18.506 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -14.541 -37.707 -19.813 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -15.978 -38.646 -19.340 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -15.563 -37.153 -18.464 1.00 0.00 H new ATOM 80 N ASN A 27 -13.023 -37.898 -16.163 1.00 0.00 N ATOM 81 CA ASN A 27 -12.154 -36.936 -15.478 1.00 0.00 C ATOM 82 C ASN A 27 -11.484 -37.607 -14.273 1.00 0.00 C ATOM 83 O ASN A 27 -12.031 -38.549 -13.693 1.00 0.00 O ATOM 84 CB ASN A 27 -12.983 -35.695 -15.039 1.00 0.00 C ATOM 85 CG ASN A 27 -14.182 -36.024 -14.129 1.00 0.00 C ATOM 86 OD1 ASN A 27 -14.772 -37.110 -14.194 1.00 0.00 O ATOM 87 ND2 ASN A 27 -14.566 -35.082 -13.290 1.00 0.00 N ATOM 0 H ASN A 27 -13.548 -38.493 -15.522 1.00 0.00 H new ATOM 0 HA ASN A 27 -11.373 -36.600 -16.160 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -12.326 -34.999 -14.517 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -13.347 -35.182 -15.929 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -15.365 -35.240 -12.676 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -14.064 -34.195 -13.255 1.00 0.00 H new ATOM 94 N ASP A 28 -10.301 -37.097 -13.920 1.00 0.00 N ATOM 95 CA ASP A 28 -9.453 -37.641 -12.835 1.00 0.00 C ATOM 96 C ASP A 28 -8.270 -36.682 -12.602 1.00 0.00 C ATOM 97 O ASP A 28 -8.186 -35.623 -13.235 1.00 0.00 O ATOM 98 CB ASP A 28 -8.933 -39.072 -13.216 1.00 0.00 C ATOM 99 CG ASP A 28 -8.481 -39.923 -12.014 1.00 0.00 C ATOM 100 OD1 ASP A 28 -9.340 -40.563 -11.379 1.00 0.00 O ATOM 101 OD2 ASP A 28 -7.266 -39.953 -11.701 1.00 0.00 O ATOM 0 H ASP A 28 -9.892 -36.284 -14.381 1.00 0.00 H new ATOM 0 HA ASP A 28 -10.038 -37.728 -11.919 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -9.723 -39.604 -13.746 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -8.098 -38.970 -13.909 1.00 0.00 H new ATOM 106 N ASP A 29 -7.358 -37.069 -11.702 1.00 0.00 N ATOM 107 CA ASP A 29 -6.069 -36.378 -11.511 1.00 0.00 C ATOM 108 C ASP A 29 -5.150 -36.704 -12.709 1.00 0.00 C ATOM 109 O ASP A 29 -4.439 -35.834 -13.224 1.00 0.00 O ATOM 110 CB ASP A 29 -5.420 -36.821 -10.171 1.00 0.00 C ATOM 111 CG ASP A 29 -4.153 -36.021 -9.800 1.00 0.00 C ATOM 112 OD1 ASP A 29 -3.039 -36.386 -10.243 1.00 0.00 O ATOM 113 OD2 ASP A 29 -4.267 -35.029 -9.052 1.00 0.00 O ATOM 0 H ASP A 29 -7.489 -37.870 -11.084 1.00 0.00 H new ATOM 0 HA ASP A 29 -6.224 -35.300 -11.464 1.00 0.00 H new ATOM 0 HB2 ASP A 29 -6.152 -36.716 -9.371 1.00 0.00 H new ATOM 0 HB3 ASP A 29 -5.165 -37.879 -10.233 1.00 0.00 H new ATOM 118 N ALA A 30 -5.231 -37.970 -13.173 1.00 0.00 N ATOM 119 CA ALA A 30 -4.501 -38.466 -14.358 1.00 0.00 C ATOM 120 C ALA A 30 -5.032 -37.848 -15.678 1.00 0.00 C ATOM 121 O ALA A 30 -4.400 -37.976 -16.731 1.00 0.00 O ATOM 122 CB ALA A 30 -4.575 -40.004 -14.413 1.00 0.00 C ATOM 0 H ALA A 30 -5.811 -38.683 -12.730 1.00 0.00 H new ATOM 0 HA ALA A 30 -3.461 -38.155 -14.258 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -4.035 -40.363 -15.289 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -4.125 -40.422 -13.513 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -5.617 -40.316 -14.476 1.00 0.00 H new ATOM 128 N VAL A 31 -6.203 -37.192 -15.609 1.00 0.00 N ATOM 129 CA VAL A 31 -6.800 -36.465 -16.747 1.00 0.00 C ATOM 130 C VAL A 31 -6.530 -34.949 -16.601 1.00 0.00 C ATOM 131 O VAL A 31 -6.323 -34.244 -17.598 1.00 0.00 O ATOM 132 CB VAL A 31 -8.345 -36.745 -16.844 1.00 0.00 C ATOM 133 CG1 VAL A 31 -8.994 -36.027 -18.056 1.00 0.00 C ATOM 134 CG2 VAL A 31 -8.631 -38.268 -16.881 1.00 0.00 C ATOM 0 H VAL A 31 -6.766 -37.150 -14.759 1.00 0.00 H new ATOM 0 HA VAL A 31 -6.338 -36.820 -17.668 1.00 0.00 H new ATOM 0 HB VAL A 31 -8.803 -36.332 -15.945 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -10.061 -36.249 -18.082 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -8.850 -34.951 -17.961 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -8.528 -36.376 -18.978 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -9.706 -38.435 -16.948 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -8.140 -38.709 -17.749 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -8.248 -38.732 -15.972 1.00 0.00 H new ATOM 144 N ASN A 32 -6.491 -34.479 -15.334 1.00 0.00 N ATOM 145 CA ASN A 32 -6.252 -33.056 -14.998 1.00 0.00 C ATOM 146 C ASN A 32 -4.869 -32.604 -15.492 1.00 0.00 C ATOM 147 O ASN A 32 -4.718 -31.474 -15.964 1.00 0.00 O ATOM 148 CB ASN A 32 -6.376 -32.826 -13.466 1.00 0.00 C ATOM 149 CG ASN A 32 -6.120 -31.366 -13.042 1.00 0.00 C ATOM 150 OD1 ASN A 32 -7.034 -30.540 -13.025 1.00 0.00 O ATOM 151 ND2 ASN A 32 -4.880 -31.033 -12.713 1.00 0.00 N ATOM 0 H ASN A 32 -6.624 -35.074 -14.516 1.00 0.00 H new ATOM 0 HA ASN A 32 -7.012 -32.459 -15.502 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -7.374 -33.121 -13.142 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -5.669 -33.475 -12.950 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -4.665 -30.075 -12.438 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -4.140 -31.735 -12.735 1.00 0.00 H new ATOM 158 N GLU A 33 -3.880 -33.509 -15.373 1.00 0.00 N ATOM 159 CA GLU A 33 -2.490 -33.268 -15.819 1.00 0.00 C ATOM 160 C GLU A 33 -2.418 -32.970 -17.336 1.00 0.00 C ATOM 161 O GLU A 33 -1.652 -32.106 -17.758 1.00 0.00 O ATOM 162 CB GLU A 33 -1.574 -34.471 -15.453 1.00 0.00 C ATOM 163 CG GLU A 33 -2.074 -35.831 -15.984 1.00 0.00 C ATOM 164 CD GLU A 33 -1.064 -36.977 -15.814 1.00 0.00 C ATOM 165 OE1 GLU A 33 -0.118 -37.068 -16.625 1.00 0.00 O ATOM 166 OE2 GLU A 33 -1.196 -37.776 -14.866 1.00 0.00 O ATOM 0 H GLU A 33 -4.020 -34.433 -14.963 1.00 0.00 H new ATOM 0 HA GLU A 33 -2.129 -32.385 -15.292 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -0.575 -34.285 -15.846 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -1.484 -34.528 -14.368 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -2.997 -36.094 -15.468 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -2.318 -35.729 -17.041 1.00 0.00 H new ATOM 173 N GLN A 34 -3.253 -33.663 -18.136 1.00 0.00 N ATOM 174 CA GLN A 34 -3.321 -33.467 -19.605 1.00 0.00 C ATOM 175 C GLN A 34 -3.781 -32.034 -19.934 1.00 0.00 C ATOM 176 O GLN A 34 -3.285 -31.401 -20.871 1.00 0.00 O ATOM 177 CB GLN A 34 -4.304 -34.486 -20.234 1.00 0.00 C ATOM 178 CG GLN A 34 -4.464 -34.382 -21.770 1.00 0.00 C ATOM 179 CD GLN A 34 -5.534 -35.325 -22.333 1.00 0.00 C ATOM 180 OE1 GLN A 34 -5.251 -36.475 -22.676 1.00 0.00 O ATOM 181 NE2 GLN A 34 -6.772 -34.848 -22.432 1.00 0.00 N ATOM 0 H GLN A 34 -3.898 -34.372 -17.788 1.00 0.00 H new ATOM 0 HA GLN A 34 -2.326 -33.624 -20.021 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -3.967 -35.493 -19.987 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -5.283 -34.355 -19.773 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -4.719 -33.356 -22.033 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -3.508 -34.604 -22.244 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -6.975 -33.892 -22.140 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -7.518 -35.438 -22.800 1.00 0.00 H new ATOM 190 N ILE A 35 -4.741 -31.551 -19.135 1.00 0.00 N ATOM 191 CA ILE A 35 -5.332 -30.209 -19.285 1.00 0.00 C ATOM 192 C ILE A 35 -4.393 -29.130 -18.688 1.00 0.00 C ATOM 193 O ILE A 35 -4.408 -27.969 -19.114 1.00 0.00 O ATOM 194 CB ILE A 35 -6.749 -30.168 -18.586 1.00 0.00 C ATOM 195 CG1 ILE A 35 -7.615 -31.390 -19.048 1.00 0.00 C ATOM 196 CG2 ILE A 35 -7.484 -28.829 -18.856 1.00 0.00 C ATOM 197 CD1 ILE A 35 -8.954 -31.541 -18.340 1.00 0.00 C ATOM 0 H ILE A 35 -5.135 -32.083 -18.359 1.00 0.00 H new ATOM 0 HA ILE A 35 -5.458 -29.994 -20.346 1.00 0.00 H new ATOM 0 HB ILE A 35 -6.596 -30.236 -17.509 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -7.797 -31.302 -20.119 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -7.037 -32.302 -18.897 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -8.454 -28.840 -18.359 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -6.888 -28.002 -18.470 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -7.628 -28.703 -19.929 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -9.476 -32.415 -18.731 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -8.788 -31.666 -17.270 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -9.559 -30.650 -18.511 1.00 0.00 H new ATOM 209 N ASN A 36 -3.561 -29.544 -17.713 1.00 0.00 N ATOM 210 CA ASN A 36 -2.672 -28.647 -16.952 1.00 0.00 C ATOM 211 C ASN A 36 -1.483 -28.176 -17.807 1.00 0.00 C ATOM 212 O ASN A 36 -0.809 -28.986 -18.453 1.00 0.00 O ATOM 213 CB ASN A 36 -2.157 -29.351 -15.669 1.00 0.00 C ATOM 214 CG ASN A 36 -1.279 -28.455 -14.785 1.00 0.00 C ATOM 215 OD1 ASN A 36 -1.447 -27.238 -14.749 1.00 0.00 O ATOM 216 ND2 ASN A 36 -0.339 -29.046 -14.070 1.00 0.00 N ATOM 0 H ASN A 36 -3.487 -30.521 -17.429 1.00 0.00 H new ATOM 0 HA ASN A 36 -3.254 -27.770 -16.668 1.00 0.00 H new ATOM 0 HB2 ASN A 36 -3.011 -29.696 -15.087 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -1.587 -30.236 -15.954 1.00 0.00 H new ATOM 0 HD21 ASN A 36 0.270 -28.490 -13.469 1.00 0.00 H new ATOM 0 HD22 ASN A 36 -0.222 -30.058 -14.119 1.00 0.00 H new ATOM 223 N SER A 37 -1.213 -26.862 -17.746 1.00 0.00 N ATOM 224 CA SER A 37 -0.180 -26.192 -18.548 1.00 0.00 C ATOM 225 C SER A 37 1.245 -26.469 -18.018 1.00 0.00 C ATOM 226 O SER A 37 2.214 -26.286 -18.746 1.00 0.00 O ATOM 227 CB SER A 37 -0.477 -24.673 -18.569 1.00 0.00 C ATOM 228 OG SER A 37 -0.569 -24.142 -17.249 1.00 0.00 O ATOM 0 H SER A 37 -1.716 -26.226 -17.127 1.00 0.00 H new ATOM 0 HA SER A 37 -0.212 -26.593 -19.561 1.00 0.00 H new ATOM 0 HB2 SER A 37 0.310 -24.155 -19.117 1.00 0.00 H new ATOM 0 HB3 SER A 37 -1.410 -24.491 -19.102 1.00 0.00 H new ATOM 0 HG SER A 37 -0.755 -23.181 -17.295 1.00 0.00 H new ATOM 234 N THR A 38 1.365 -26.941 -16.765 1.00 0.00 N ATOM 235 CA THR A 38 2.676 -27.173 -16.116 1.00 0.00 C ATOM 236 C THR A 38 3.513 -28.255 -16.853 1.00 0.00 C ATOM 237 O THR A 38 4.753 -28.253 -16.782 1.00 0.00 O ATOM 238 CB THR A 38 2.487 -27.554 -14.619 1.00 0.00 C ATOM 239 OG1 THR A 38 1.591 -26.617 -13.995 1.00 0.00 O ATOM 240 CG2 THR A 38 3.820 -27.566 -13.853 1.00 0.00 C ATOM 0 H THR A 38 0.566 -27.172 -16.174 1.00 0.00 H new ATOM 0 HA THR A 38 3.234 -26.238 -16.175 1.00 0.00 H new ATOM 0 HB THR A 38 2.072 -28.561 -14.585 1.00 0.00 H new ATOM 0 HG1 THR A 38 1.470 -26.858 -13.053 1.00 0.00 H new ATOM 0 HG21 THR A 38 3.639 -27.837 -12.813 1.00 0.00 H new ATOM 0 HG22 THR A 38 4.493 -28.294 -14.306 1.00 0.00 H new ATOM 0 HG23 THR A 38 4.274 -26.576 -13.896 1.00 0.00 H new ATOM 248 N ILE A 39 2.817 -29.134 -17.598 1.00 0.00 N ATOM 249 CA ILE A 39 3.447 -30.201 -18.401 1.00 0.00 C ATOM 250 C ILE A 39 4.286 -29.581 -19.546 1.00 0.00 C ATOM 251 O ILE A 39 5.388 -30.070 -19.858 1.00 0.00 O ATOM 252 CB ILE A 39 2.377 -31.204 -18.991 1.00 0.00 C ATOM 253 CG1 ILE A 39 1.429 -31.737 -17.864 1.00 0.00 C ATOM 254 CG2 ILE A 39 3.047 -32.375 -19.772 1.00 0.00 C ATOM 255 CD1 ILE A 39 2.128 -32.398 -16.692 1.00 0.00 C ATOM 0 H ILE A 39 1.799 -29.125 -17.661 1.00 0.00 H new ATOM 0 HA ILE A 39 4.101 -30.769 -17.739 1.00 0.00 H new ATOM 0 HB ILE A 39 1.770 -30.651 -19.708 1.00 0.00 H new ATOM 0 HG12 ILE A 39 0.833 -30.905 -17.489 1.00 0.00 H new ATOM 0 HG13 ILE A 39 0.735 -32.453 -18.304 1.00 0.00 H new ATOM 0 HG21 ILE A 39 2.277 -33.041 -20.161 1.00 0.00 H new ATOM 0 HG22 ILE A 39 3.631 -31.973 -20.600 1.00 0.00 H new ATOM 0 HG23 ILE A 39 3.703 -32.931 -19.102 1.00 0.00 H new ATOM 0 HD11 ILE A 39 1.386 -32.732 -15.967 1.00 0.00 H new ATOM 0 HD12 ILE A 39 2.701 -33.255 -17.046 1.00 0.00 H new ATOM 0 HD13 ILE A 39 2.801 -31.682 -16.219 1.00 0.00 H new ATOM 267 N GLU A 40 3.778 -28.467 -20.121 1.00 0.00 N ATOM 268 CA GLU A 40 4.454 -27.772 -21.232 1.00 0.00 C ATOM 269 C GLU A 40 5.718 -27.066 -20.700 1.00 0.00 C ATOM 270 O GLU A 40 6.771 -27.117 -21.323 1.00 0.00 O ATOM 271 CB GLU A 40 3.515 -26.750 -21.973 1.00 0.00 C ATOM 272 CG GLU A 40 3.444 -25.331 -21.366 1.00 0.00 C ATOM 273 CD GLU A 40 2.687 -24.324 -22.229 1.00 0.00 C ATOM 274 OE1 GLU A 40 3.272 -23.850 -23.218 1.00 0.00 O ATOM 275 OE2 GLU A 40 1.522 -24.000 -21.919 1.00 0.00 O ATOM 0 H GLU A 40 2.902 -28.033 -19.831 1.00 0.00 H new ATOM 0 HA GLU A 40 4.732 -28.522 -21.972 1.00 0.00 H new ATOM 0 HB2 GLU A 40 3.849 -26.665 -23.007 1.00 0.00 H new ATOM 0 HB3 GLU A 40 2.507 -27.164 -21.996 1.00 0.00 H new ATOM 0 HG2 GLU A 40 2.965 -25.389 -20.388 1.00 0.00 H new ATOM 0 HG3 GLU A 40 4.458 -24.965 -21.203 1.00 0.00 H new ATOM 282 N ASP A 41 5.592 -26.458 -19.504 1.00 0.00 N ATOM 283 CA ASP A 41 6.670 -25.662 -18.881 1.00 0.00 C ATOM 284 C ASP A 41 7.865 -26.553 -18.535 1.00 0.00 C ATOM 285 O ASP A 41 9.017 -26.166 -18.750 1.00 0.00 O ATOM 286 CB ASP A 41 6.146 -24.945 -17.611 1.00 0.00 C ATOM 287 CG ASP A 41 5.007 -23.959 -17.916 1.00 0.00 C ATOM 288 OD1 ASP A 41 5.250 -22.975 -18.641 1.00 0.00 O ATOM 289 OD2 ASP A 41 3.867 -24.166 -17.449 1.00 0.00 O ATOM 0 H ASP A 41 4.742 -26.504 -18.943 1.00 0.00 H new ATOM 0 HA ASP A 41 6.998 -24.908 -19.596 1.00 0.00 H new ATOM 0 HB2 ASP A 41 5.795 -25.690 -16.897 1.00 0.00 H new ATOM 0 HB3 ASP A 41 6.968 -24.409 -17.136 1.00 0.00 H new ATOM 294 N ALA A 42 7.542 -27.760 -18.041 1.00 0.00 N ATOM 295 CA ALA A 42 8.525 -28.800 -17.700 1.00 0.00 C ATOM 296 C ALA A 42 9.355 -29.204 -18.942 1.00 0.00 C ATOM 297 O ALA A 42 10.581 -29.089 -18.941 1.00 0.00 O ATOM 298 CB ALA A 42 7.801 -30.020 -17.093 1.00 0.00 C ATOM 0 H ALA A 42 6.578 -28.044 -17.865 1.00 0.00 H new ATOM 0 HA ALA A 42 9.219 -28.402 -16.960 1.00 0.00 H new ATOM 0 HB1 ALA A 42 8.532 -30.789 -16.841 1.00 0.00 H new ATOM 0 HB2 ALA A 42 7.269 -29.716 -16.191 1.00 0.00 H new ATOM 0 HB3 ALA A 42 7.090 -30.418 -17.817 1.00 0.00 H new ATOM 304 N ILE A 43 8.652 -29.598 -20.021 1.00 0.00 N ATOM 305 CA ILE A 43 9.278 -30.109 -21.265 1.00 0.00 C ATOM 306 C ILE A 43 10.001 -28.981 -22.052 1.00 0.00 C ATOM 307 O ILE A 43 11.019 -29.230 -22.720 1.00 0.00 O ATOM 308 CB ILE A 43 8.203 -30.833 -22.177 1.00 0.00 C ATOM 309 CG1 ILE A 43 7.533 -32.032 -21.424 1.00 0.00 C ATOM 310 CG2 ILE A 43 8.802 -31.306 -23.528 1.00 0.00 C ATOM 311 CD1 ILE A 43 8.480 -33.164 -21.053 1.00 0.00 C ATOM 0 H ILE A 43 7.633 -29.573 -20.059 1.00 0.00 H new ATOM 0 HA ILE A 43 10.034 -30.839 -20.975 1.00 0.00 H new ATOM 0 HB ILE A 43 7.435 -30.093 -22.401 1.00 0.00 H new ATOM 0 HG12 ILE A 43 7.066 -31.655 -20.514 1.00 0.00 H new ATOM 0 HG13 ILE A 43 6.736 -32.435 -22.049 1.00 0.00 H new ATOM 0 HG21 ILE A 43 8.027 -31.796 -24.118 1.00 0.00 H new ATOM 0 HG22 ILE A 43 9.186 -30.446 -24.077 1.00 0.00 H new ATOM 0 HG23 ILE A 43 9.614 -32.009 -23.340 1.00 0.00 H new ATOM 0 HD11 ILE A 43 7.926 -33.947 -20.536 1.00 0.00 H new ATOM 0 HD12 ILE A 43 8.929 -33.574 -21.958 1.00 0.00 H new ATOM 0 HD13 ILE A 43 9.264 -32.783 -20.399 1.00 0.00 H new ATOM 323 N ALA A 44 9.500 -27.735 -21.933 1.00 0.00 N ATOM 324 CA ALA A 44 10.051 -26.579 -22.670 1.00 0.00 C ATOM 325 C ALA A 44 11.440 -26.193 -22.143 1.00 0.00 C ATOM 326 O ALA A 44 12.368 -25.966 -22.927 1.00 0.00 O ATOM 327 CB ALA A 44 9.095 -25.389 -22.591 1.00 0.00 C ATOM 0 H ALA A 44 8.711 -27.503 -21.330 1.00 0.00 H new ATOM 0 HA ALA A 44 10.160 -26.869 -23.715 1.00 0.00 H new ATOM 0 HB1 ALA A 44 9.517 -24.547 -23.139 1.00 0.00 H new ATOM 0 HB2 ALA A 44 8.135 -25.663 -23.029 1.00 0.00 H new ATOM 0 HB3 ALA A 44 8.950 -25.107 -21.548 1.00 0.00 H new ATOM 333 N ARG A 45 11.585 -26.145 -20.806 1.00 0.00 N ATOM 334 CA ARG A 45 12.881 -25.834 -20.167 1.00 0.00 C ATOM 335 C ARG A 45 13.784 -27.079 -20.097 1.00 0.00 C ATOM 336 O ARG A 45 15.002 -26.954 -19.926 1.00 0.00 O ATOM 337 CB ARG A 45 12.666 -25.204 -18.764 1.00 0.00 C ATOM 338 CG ARG A 45 11.999 -26.119 -17.719 1.00 0.00 C ATOM 339 CD ARG A 45 11.668 -25.373 -16.416 1.00 0.00 C ATOM 340 NE ARG A 45 11.013 -26.242 -15.413 1.00 0.00 N ATOM 341 CZ ARG A 45 10.380 -25.808 -14.310 1.00 0.00 C ATOM 342 NH1 ARG A 45 10.231 -24.504 -14.084 1.00 0.00 N ATOM 343 NH2 ARG A 45 9.875 -26.690 -13.454 1.00 0.00 N ATOM 0 H ARG A 45 10.825 -26.317 -20.148 1.00 0.00 H new ATOM 0 HA ARG A 45 13.395 -25.099 -20.786 1.00 0.00 H new ATOM 0 HB2 ARG A 45 13.634 -24.885 -18.377 1.00 0.00 H new ATOM 0 HB3 ARG A 45 12.057 -24.307 -18.877 1.00 0.00 H new ATOM 0 HG2 ARG A 45 11.084 -26.538 -18.138 1.00 0.00 H new ATOM 0 HG3 ARG A 45 12.661 -26.956 -17.498 1.00 0.00 H new ATOM 0 HD2 ARG A 45 12.585 -24.964 -15.993 1.00 0.00 H new ATOM 0 HD3 ARG A 45 11.016 -24.529 -16.641 1.00 0.00 H new ATOM 0 HE ARG A 45 11.045 -27.249 -15.571 1.00 0.00 H new ATOM 0 HH11 ARG A 45 10.599 -23.826 -14.751 1.00 0.00 H new ATOM 0 HH12 ARG A 45 9.749 -24.184 -13.244 1.00 0.00 H new ATOM 0 HH21 ARG A 45 9.969 -27.689 -13.636 1.00 0.00 H new ATOM 0 HH22 ARG A 45 9.393 -26.368 -12.615 1.00 0.00 H new ATOM 357 N ALA A 46 13.182 -28.276 -20.253 1.00 0.00 N ATOM 358 CA ALA A 46 13.924 -29.549 -20.235 1.00 0.00 C ATOM 359 C ALA A 46 14.730 -29.751 -21.530 1.00 0.00 C ATOM 360 O ALA A 46 15.932 -30.018 -21.480 1.00 0.00 O ATOM 361 CB ALA A 46 12.970 -30.728 -20.022 1.00 0.00 C ATOM 0 H ALA A 46 12.178 -28.385 -20.394 1.00 0.00 H new ATOM 0 HA ALA A 46 14.626 -29.506 -19.402 1.00 0.00 H new ATOM 0 HB1 ALA A 46 13.538 -31.658 -20.012 1.00 0.00 H new ATOM 0 HB2 ALA A 46 12.451 -30.609 -19.071 1.00 0.00 H new ATOM 0 HB3 ALA A 46 12.241 -30.757 -20.832 1.00 0.00 H new ATOM 367 N ARG A 47 14.064 -29.611 -22.698 1.00 0.00 N ATOM 368 CA ARG A 47 14.684 -29.939 -24.008 1.00 0.00 C ATOM 369 C ARG A 47 14.396 -28.867 -25.076 1.00 0.00 C ATOM 370 O ARG A 47 15.103 -28.796 -26.086 1.00 0.00 O ATOM 371 CB ARG A 47 14.192 -31.331 -24.495 1.00 0.00 C ATOM 372 CG ARG A 47 12.739 -31.358 -25.004 1.00 0.00 C ATOM 373 CD ARG A 47 12.254 -32.769 -25.385 1.00 0.00 C ATOM 374 NE ARG A 47 11.949 -33.585 -24.198 1.00 0.00 N ATOM 375 CZ ARG A 47 11.020 -34.547 -24.137 1.00 0.00 C ATOM 376 NH1 ARG A 47 10.288 -34.870 -25.194 1.00 0.00 N ATOM 377 NH2 ARG A 47 10.823 -35.188 -23.008 1.00 0.00 N ATOM 0 H ARG A 47 13.103 -29.275 -22.764 1.00 0.00 H new ATOM 0 HA ARG A 47 15.764 -29.964 -23.861 1.00 0.00 H new ATOM 0 HB2 ARG A 47 14.849 -31.674 -25.294 1.00 0.00 H new ATOM 0 HB3 ARG A 47 14.289 -32.043 -23.675 1.00 0.00 H new ATOM 0 HG2 ARG A 47 12.084 -30.952 -24.234 1.00 0.00 H new ATOM 0 HG3 ARG A 47 12.653 -30.705 -25.872 1.00 0.00 H new ATOM 0 HD2 ARG A 47 11.364 -32.690 -26.010 1.00 0.00 H new ATOM 0 HD3 ARG A 47 13.019 -33.267 -25.981 1.00 0.00 H new ATOM 0 HE ARG A 47 12.490 -33.402 -23.353 1.00 0.00 H new ATOM 0 HH11 ARG A 47 10.427 -34.382 -26.079 1.00 0.00 H new ATOM 0 HH12 ARG A 47 9.586 -35.607 -25.122 1.00 0.00 H new ATOM 0 HH21 ARG A 47 11.376 -34.952 -22.184 1.00 0.00 H new ATOM 0 HH22 ARG A 47 10.117 -35.922 -22.955 1.00 0.00 H new ATOM 391 N GLY A 48 13.363 -28.039 -24.853 1.00 0.00 N ATOM 392 CA GLY A 48 12.941 -27.032 -25.839 1.00 0.00 C ATOM 393 C GLY A 48 12.131 -27.626 -26.981 1.00 0.00 C ATOM 394 O GLY A 48 12.389 -27.347 -28.158 1.00 0.00 O ATOM 0 H GLY A 48 12.805 -28.047 -23.999 1.00 0.00 H new ATOM 0 HA2 GLY A 48 12.347 -26.267 -25.338 1.00 0.00 H new ATOM 0 HA3 GLY A 48 13.823 -26.536 -26.245 1.00 0.00 H new ATOM 398 N GLU A 49 11.147 -28.454 -26.619 1.00 0.00 N ATOM 399 CA GLU A 49 10.257 -29.145 -27.572 1.00 0.00 C ATOM 400 C GLU A 49 9.013 -28.313 -27.871 1.00 0.00 C ATOM 401 O GLU A 49 8.605 -28.178 -29.031 1.00 0.00 O ATOM 402 CB GLU A 49 9.835 -30.504 -26.972 1.00 0.00 C ATOM 403 CG GLU A 49 8.824 -31.321 -27.806 1.00 0.00 C ATOM 404 CD GLU A 49 8.669 -32.767 -27.309 1.00 0.00 C ATOM 405 OE1 GLU A 49 9.515 -33.617 -27.675 1.00 0.00 O ATOM 406 OE2 GLU A 49 7.726 -33.057 -26.539 1.00 0.00 O ATOM 0 H GLU A 49 10.939 -28.670 -25.644 1.00 0.00 H new ATOM 0 HA GLU A 49 10.798 -29.294 -28.507 1.00 0.00 H new ATOM 0 HB2 GLU A 49 10.730 -31.109 -26.826 1.00 0.00 H new ATOM 0 HB3 GLU A 49 9.405 -30.327 -25.986 1.00 0.00 H new ATOM 0 HG2 GLU A 49 7.853 -30.826 -27.777 1.00 0.00 H new ATOM 0 HG3 GLU A 49 9.145 -31.333 -28.848 1.00 0.00 H new ATOM 413 N ILE A 50 8.428 -27.781 -26.789 1.00 0.00 N ATOM 414 CA ILE A 50 7.132 -27.100 -26.807 1.00 0.00 C ATOM 415 C ILE A 50 7.141 -25.918 -27.798 1.00 0.00 C ATOM 416 O ILE A 50 8.071 -25.101 -27.763 1.00 0.00 O ATOM 417 CB ILE A 50 6.756 -26.623 -25.356 1.00 0.00 C ATOM 418 CG1 ILE A 50 6.723 -27.846 -24.381 1.00 0.00 C ATOM 419 CG2 ILE A 50 5.420 -25.842 -25.325 1.00 0.00 C ATOM 420 CD1 ILE A 50 5.728 -28.937 -24.744 1.00 0.00 C ATOM 0 H ILE A 50 8.852 -27.814 -25.862 1.00 0.00 H new ATOM 0 HA ILE A 50 6.373 -27.804 -27.147 1.00 0.00 H new ATOM 0 HB ILE A 50 7.527 -25.929 -25.022 1.00 0.00 H new ATOM 0 HG12 ILE A 50 7.720 -28.285 -24.340 1.00 0.00 H new ATOM 0 HG13 ILE A 50 6.492 -27.485 -23.379 1.00 0.00 H new ATOM 0 HG21 ILE A 50 5.203 -25.533 -24.302 1.00 0.00 H new ATOM 0 HG22 ILE A 50 5.499 -24.960 -25.961 1.00 0.00 H new ATOM 0 HG23 ILE A 50 4.616 -26.481 -25.690 1.00 0.00 H new ATOM 0 HD11 ILE A 50 5.782 -29.739 -24.008 1.00 0.00 H new ATOM 0 HD12 ILE A 50 4.720 -28.522 -24.754 1.00 0.00 H new ATOM 0 HD13 ILE A 50 5.967 -29.334 -25.731 1.00 0.00 H new ATOM 432 N PRO A 51 6.121 -25.830 -28.710 1.00 0.00 N ATOM 433 CA PRO A 51 6.067 -24.774 -29.746 1.00 0.00 C ATOM 434 C PRO A 51 5.791 -23.376 -29.149 1.00 0.00 C ATOM 435 O PRO A 51 5.881 -23.172 -27.932 1.00 0.00 O ATOM 436 CB PRO A 51 4.938 -25.276 -30.681 1.00 0.00 C ATOM 437 CG PRO A 51 4.028 -26.054 -29.783 1.00 0.00 C ATOM 438 CD PRO A 51 4.941 -26.747 -28.804 1.00 0.00 C ATOM 0 HA PRO A 51 7.012 -24.630 -30.270 1.00 0.00 H new ATOM 0 HB2 PRO A 51 4.414 -24.445 -31.153 1.00 0.00 H new ATOM 0 HB3 PRO A 51 5.334 -25.900 -31.482 1.00 0.00 H new ATOM 0 HG2 PRO A 51 3.325 -25.398 -29.270 1.00 0.00 H new ATOM 0 HG3 PRO A 51 3.437 -26.774 -30.349 1.00 0.00 H new ATOM 0 HD2 PRO A 51 4.461 -26.882 -27.835 1.00 0.00 H new ATOM 0 HD3 PRO A 51 5.230 -27.737 -29.157 1.00 0.00 H new ATOM 446 N ARG A 52 5.440 -22.422 -30.017 1.00 0.00 N ATOM 447 CA ARG A 52 5.346 -20.988 -29.664 1.00 0.00 C ATOM 448 C ARG A 52 3.991 -20.631 -29.010 1.00 0.00 C ATOM 449 O ARG A 52 3.693 -19.451 -28.802 1.00 0.00 O ATOM 450 CB ARG A 52 5.607 -20.152 -30.947 1.00 0.00 C ATOM 451 CG ARG A 52 6.964 -20.476 -31.614 1.00 0.00 C ATOM 452 CD ARG A 52 7.197 -19.742 -32.940 1.00 0.00 C ATOM 453 NE ARG A 52 8.495 -20.111 -33.540 1.00 0.00 N ATOM 454 CZ ARG A 52 8.934 -19.729 -34.745 1.00 0.00 C ATOM 455 NH1 ARG A 52 8.194 -18.954 -35.535 1.00 0.00 N ATOM 456 NH2 ARG A 52 10.116 -20.148 -35.160 1.00 0.00 N ATOM 0 H ARG A 52 5.210 -22.616 -30.992 1.00 0.00 H new ATOM 0 HA ARG A 52 6.101 -20.754 -28.913 1.00 0.00 H new ATOM 0 HB2 ARG A 52 4.805 -20.334 -31.662 1.00 0.00 H new ATOM 0 HB3 ARG A 52 5.576 -19.092 -30.696 1.00 0.00 H new ATOM 0 HG2 ARG A 52 7.767 -20.221 -30.923 1.00 0.00 H new ATOM 0 HG3 ARG A 52 7.024 -21.550 -31.789 1.00 0.00 H new ATOM 0 HD2 ARG A 52 6.392 -19.980 -33.636 1.00 0.00 H new ATOM 0 HD3 ARG A 52 7.165 -18.665 -32.772 1.00 0.00 H new ATOM 0 HE ARG A 52 9.110 -20.709 -32.988 1.00 0.00 H new ATOM 0 HH11 ARG A 52 7.274 -18.640 -35.225 1.00 0.00 H new ATOM 0 HH12 ARG A 52 8.547 -18.674 -36.450 1.00 0.00 H new ATOM 0 HH21 ARG A 52 10.680 -20.754 -34.564 1.00 0.00 H new ATOM 0 HH22 ARG A 52 10.464 -19.865 -36.076 1.00 0.00 H new ATOM 470 N GLY A 53 3.187 -21.662 -28.668 1.00 0.00 N ATOM 471 CA GLY A 53 1.897 -21.464 -28.002 1.00 0.00 C ATOM 472 C GLY A 53 0.835 -20.965 -28.953 1.00 0.00 C ATOM 473 O GLY A 53 0.026 -20.106 -28.607 1.00 0.00 O ATOM 0 H GLY A 53 3.417 -22.640 -28.846 1.00 0.00 H new ATOM 0 HA2 GLY A 53 1.571 -22.404 -27.557 1.00 0.00 H new ATOM 0 HA3 GLY A 53 2.017 -20.750 -27.187 1.00 0.00 H new ATOM 477 N GLU A 54 0.861 -21.502 -30.168 1.00 0.00 N ATOM 478 CA GLU A 54 -0.050 -21.108 -31.253 1.00 0.00 C ATOM 479 C GLU A 54 -1.276 -22.080 -31.289 1.00 0.00 C ATOM 480 O GLU A 54 -1.660 -22.624 -30.242 1.00 0.00 O ATOM 481 CB GLU A 54 0.726 -21.040 -32.621 1.00 0.00 C ATOM 482 CG GLU A 54 1.257 -22.379 -33.194 1.00 0.00 C ATOM 483 CD GLU A 54 2.329 -23.049 -32.324 1.00 0.00 C ATOM 484 OE1 GLU A 54 3.500 -22.621 -32.370 1.00 0.00 O ATOM 485 OE2 GLU A 54 1.985 -23.972 -31.554 1.00 0.00 O ATOM 0 H GLU A 54 1.520 -22.232 -30.437 1.00 0.00 H new ATOM 0 HA GLU A 54 -0.440 -20.107 -31.070 1.00 0.00 H new ATOM 0 HB2 GLU A 54 0.066 -20.591 -33.363 1.00 0.00 H new ATOM 0 HB3 GLU A 54 1.572 -20.364 -32.498 1.00 0.00 H new ATOM 0 HG2 GLU A 54 0.421 -23.067 -33.316 1.00 0.00 H new ATOM 0 HG3 GLU A 54 1.670 -22.199 -34.187 1.00 0.00 H new ATOM 492 N SER A 55 -1.894 -22.251 -32.484 1.00 0.00 N ATOM 493 CA SER A 55 -3.125 -23.038 -32.685 1.00 0.00 C ATOM 494 C SER A 55 -3.056 -24.461 -32.084 1.00 0.00 C ATOM 495 O SER A 55 -2.342 -25.339 -32.580 1.00 0.00 O ATOM 496 CB SER A 55 -3.452 -23.097 -34.188 1.00 0.00 C ATOM 497 OG SER A 55 -3.665 -21.786 -34.697 1.00 0.00 O ATOM 0 H SER A 55 -1.541 -21.837 -33.346 1.00 0.00 H new ATOM 0 HA SER A 55 -3.923 -22.529 -32.145 1.00 0.00 H new ATOM 0 HB2 SER A 55 -2.634 -23.576 -34.727 1.00 0.00 H new ATOM 0 HB3 SER A 55 -4.341 -23.707 -34.350 1.00 0.00 H new ATOM 0 HG SER A 55 -4.078 -21.843 -35.584 1.00 0.00 H new ATOM 503 N LEU A 56 -3.801 -24.638 -30.984 1.00 0.00 N ATOM 504 CA LEU A 56 -3.911 -25.918 -30.246 1.00 0.00 C ATOM 505 C LEU A 56 -5.151 -26.714 -30.723 1.00 0.00 C ATOM 506 O LEU A 56 -5.870 -26.259 -31.619 1.00 0.00 O ATOM 507 CB LEU A 56 -3.936 -25.625 -28.702 1.00 0.00 C ATOM 508 CG LEU A 56 -4.757 -24.374 -28.223 1.00 0.00 C ATOM 509 CD1 LEU A 56 -6.262 -24.504 -28.488 1.00 0.00 C ATOM 510 CD2 LEU A 56 -4.492 -24.043 -26.739 1.00 0.00 C ATOM 0 H LEU A 56 -4.355 -23.888 -30.570 1.00 0.00 H new ATOM 0 HA LEU A 56 -3.043 -26.545 -30.452 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -4.335 -26.505 -28.197 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -2.907 -25.503 -28.364 1.00 0.00 H new ATOM 0 HG LEU A 56 -4.398 -23.541 -28.828 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -6.772 -23.608 -28.134 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -6.434 -24.621 -29.558 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -6.650 -25.375 -27.960 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -5.080 -23.172 -26.450 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -4.776 -24.894 -26.120 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -3.433 -23.829 -26.597 1.00 0.00 H new ATOM 522 N ASP A 57 -5.403 -27.892 -30.107 1.00 0.00 N ATOM 523 CA ASP A 57 -6.563 -28.774 -30.453 1.00 0.00 C ATOM 524 C ASP A 57 -7.476 -29.020 -29.236 1.00 0.00 C ATOM 525 O ASP A 57 -8.409 -29.831 -29.301 1.00 0.00 O ATOM 526 CB ASP A 57 -6.073 -30.121 -31.063 1.00 0.00 C ATOM 527 CG ASP A 57 -5.605 -29.991 -32.528 1.00 0.00 C ATOM 528 OD1 ASP A 57 -4.541 -29.383 -32.774 1.00 0.00 O ATOM 529 OD2 ASP A 57 -6.302 -30.488 -33.444 1.00 0.00 O ATOM 0 H ASP A 57 -4.817 -28.264 -29.359 1.00 0.00 H new ATOM 0 HA ASP A 57 -7.156 -28.254 -31.205 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -5.252 -30.508 -30.459 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -6.880 -30.851 -31.010 1.00 0.00 H new ATOM 534 N GLU A 58 -7.237 -28.263 -28.147 1.00 0.00 N ATOM 535 CA GLU A 58 -8.006 -28.346 -26.888 1.00 0.00 C ATOM 536 C GLU A 58 -8.192 -26.936 -26.301 1.00 0.00 C ATOM 537 O GLU A 58 -7.226 -26.308 -25.864 1.00 0.00 O ATOM 538 CB GLU A 58 -7.327 -29.287 -25.842 1.00 0.00 C ATOM 539 CG GLU A 58 -7.383 -30.777 -26.216 1.00 0.00 C ATOM 540 CD GLU A 58 -6.750 -31.698 -25.164 1.00 0.00 C ATOM 541 OE1 GLU A 58 -5.513 -31.856 -25.174 1.00 0.00 O ATOM 542 OE2 GLU A 58 -7.490 -32.274 -24.336 1.00 0.00 O ATOM 0 H GLU A 58 -6.493 -27.566 -28.116 1.00 0.00 H new ATOM 0 HA GLU A 58 -8.979 -28.778 -27.120 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -6.285 -28.991 -25.724 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -7.809 -29.147 -24.875 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -8.423 -31.068 -26.363 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -6.874 -30.923 -27.169 1.00 0.00 H new ATOM 549 N CYS A 59 -9.438 -26.453 -26.350 1.00 0.00 N ATOM 550 CA CYS A 59 -9.882 -25.167 -25.760 1.00 0.00 C ATOM 551 C CYS A 59 -9.459 -25.021 -24.290 1.00 0.00 C ATOM 552 O CYS A 59 -9.826 -25.854 -23.477 1.00 0.00 O ATOM 553 CB CYS A 59 -11.415 -25.120 -25.875 1.00 0.00 C ATOM 554 SG CYS A 59 -12.222 -23.709 -25.073 1.00 0.00 S ATOM 0 H CYS A 59 -10.195 -26.955 -26.814 1.00 0.00 H new ATOM 0 HA CYS A 59 -9.413 -24.343 -26.298 1.00 0.00 H new ATOM 0 HB2 CYS A 59 -11.681 -25.114 -26.932 1.00 0.00 H new ATOM 0 HB3 CYS A 59 -11.821 -26.037 -25.449 1.00 0.00 H new ATOM 559 N GLU A 60 -8.722 -23.948 -23.955 1.00 0.00 N ATOM 560 CA GLU A 60 -8.206 -23.734 -22.575 1.00 0.00 C ATOM 561 C GLU A 60 -9.341 -23.463 -21.550 1.00 0.00 C ATOM 562 O GLU A 60 -9.131 -23.569 -20.339 1.00 0.00 O ATOM 563 CB GLU A 60 -7.181 -22.563 -22.558 1.00 0.00 C ATOM 564 CG GLU A 60 -7.762 -21.197 -22.978 1.00 0.00 C ATOM 565 CD GLU A 60 -6.796 -20.027 -22.728 1.00 0.00 C ATOM 566 OE1 GLU A 60 -5.863 -19.832 -23.527 1.00 0.00 O ATOM 567 OE2 GLU A 60 -6.980 -19.285 -21.739 1.00 0.00 O ATOM 0 H GLU A 60 -8.466 -23.212 -24.613 1.00 0.00 H new ATOM 0 HA GLU A 60 -7.712 -24.658 -22.273 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -6.767 -22.474 -21.554 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -6.354 -22.812 -23.223 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -8.019 -21.228 -24.037 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -8.688 -21.019 -22.431 1.00 0.00 H new ATOM 574 N GLU A 61 -10.543 -23.131 -22.059 1.00 0.00 N ATOM 575 CA GLU A 61 -11.706 -22.754 -21.229 1.00 0.00 C ATOM 576 C GLU A 61 -12.431 -23.999 -20.733 1.00 0.00 C ATOM 577 O GLU A 61 -12.624 -24.191 -19.529 1.00 0.00 O ATOM 578 CB GLU A 61 -12.691 -21.899 -22.066 1.00 0.00 C ATOM 579 CG GLU A 61 -12.090 -20.616 -22.652 1.00 0.00 C ATOM 580 CD GLU A 61 -11.955 -19.459 -21.645 1.00 0.00 C ATOM 581 OE1 GLU A 61 -10.930 -19.380 -20.934 1.00 0.00 O ATOM 582 OE2 GLU A 61 -12.884 -18.617 -21.573 1.00 0.00 O ATOM 0 H GLU A 61 -10.736 -23.116 -23.060 1.00 0.00 H new ATOM 0 HA GLU A 61 -11.349 -22.180 -20.374 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -13.076 -22.509 -22.883 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -13.542 -21.632 -21.439 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -11.105 -20.844 -23.059 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -12.711 -20.286 -23.485 1.00 0.00 H new ATOM 589 N CYS A 62 -12.832 -24.852 -21.689 1.00 0.00 N ATOM 590 CA CYS A 62 -13.746 -25.972 -21.411 1.00 0.00 C ATOM 591 C CYS A 62 -13.201 -27.317 -21.933 1.00 0.00 C ATOM 592 O CYS A 62 -13.910 -28.326 -21.892 1.00 0.00 O ATOM 593 CB CYS A 62 -15.152 -25.650 -21.988 1.00 0.00 C ATOM 594 SG CYS A 62 -15.314 -25.647 -23.805 1.00 0.00 S ATOM 0 H CYS A 62 -12.537 -24.787 -22.663 1.00 0.00 H new ATOM 0 HA CYS A 62 -13.829 -26.087 -20.330 1.00 0.00 H new ATOM 0 HB2 CYS A 62 -15.859 -26.375 -21.585 1.00 0.00 H new ATOM 0 HB3 CYS A 62 -15.455 -24.670 -21.618 1.00 0.00 H new ATOM 599 N GLY A 63 -11.921 -27.322 -22.376 1.00 0.00 N ATOM 600 CA GLY A 63 -11.255 -28.516 -22.960 1.00 0.00 C ATOM 601 C GLY A 63 -11.987 -29.117 -24.162 1.00 0.00 C ATOM 602 O GLY A 63 -11.847 -30.305 -24.462 1.00 0.00 O ATOM 0 H GLY A 63 -11.319 -26.499 -22.339 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -10.245 -28.242 -23.264 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -11.160 -29.279 -22.188 1.00 0.00 H new ATOM 606 N ALA A 64 -12.757 -28.266 -24.850 1.00 0.00 N ATOM 607 CA ALA A 64 -13.569 -28.657 -26.009 1.00 0.00 C ATOM 608 C ALA A 64 -12.680 -28.858 -27.251 1.00 0.00 C ATOM 609 O ALA A 64 -11.660 -28.153 -27.384 1.00 0.00 O ATOM 610 CB ALA A 64 -14.635 -27.587 -26.278 1.00 0.00 C ATOM 0 H ALA A 64 -12.835 -27.276 -24.616 1.00 0.00 H new ATOM 0 HA ALA A 64 -14.063 -29.604 -25.791 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -15.236 -27.880 -27.139 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -15.278 -27.486 -25.404 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -14.149 -26.633 -26.483 1.00 0.00 H new ATOM 616 N PRO A 65 -13.050 -29.808 -28.174 1.00 0.00 N ATOM 617 CA PRO A 65 -12.332 -30.002 -29.450 1.00 0.00 C ATOM 618 C PRO A 65 -12.285 -28.706 -30.293 1.00 0.00 C ATOM 619 O PRO A 65 -13.331 -28.160 -30.677 1.00 0.00 O ATOM 620 CB PRO A 65 -13.141 -31.117 -30.168 1.00 0.00 C ATOM 621 CG PRO A 65 -13.873 -31.823 -29.068 1.00 0.00 C ATOM 622 CD PRO A 65 -14.185 -30.765 -28.039 1.00 0.00 C ATOM 0 HA PRO A 65 -11.287 -30.271 -29.297 1.00 0.00 H new ATOM 0 HB2 PRO A 65 -13.833 -30.697 -30.898 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -12.483 -31.799 -30.707 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -14.786 -32.288 -29.441 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -13.263 -32.618 -28.639 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -15.143 -30.283 -28.236 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -14.240 -31.185 -27.035 1.00 0.00 H new ATOM 630 N ILE A 66 -11.065 -28.187 -30.484 1.00 0.00 N ATOM 631 CA ILE A 66 -10.807 -27.050 -31.374 1.00 0.00 C ATOM 632 C ILE A 66 -10.969 -27.508 -32.834 1.00 0.00 C ATOM 633 O ILE A 66 -10.309 -28.471 -33.241 1.00 0.00 O ATOM 634 CB ILE A 66 -9.357 -26.476 -31.147 1.00 0.00 C ATOM 635 CG1 ILE A 66 -9.209 -25.936 -29.704 1.00 0.00 C ATOM 636 CG2 ILE A 66 -8.989 -25.388 -32.191 1.00 0.00 C ATOM 637 CD1 ILE A 66 -9.934 -24.649 -29.446 1.00 0.00 C ATOM 0 H ILE A 66 -10.228 -28.545 -30.024 1.00 0.00 H new ATOM 0 HA ILE A 66 -11.522 -26.257 -31.152 1.00 0.00 H new ATOM 0 HB ILE A 66 -8.654 -27.297 -31.285 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -9.575 -26.691 -29.008 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -8.150 -25.791 -29.490 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -7.981 -25.022 -31.995 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -9.031 -25.816 -33.193 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -9.696 -24.561 -32.120 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -9.776 -24.344 -28.412 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -9.553 -23.877 -30.114 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -11.000 -24.790 -29.624 1.00 0.00 H new ATOM 649 N PRO A 67 -11.856 -26.848 -33.638 1.00 0.00 N ATOM 650 CA PRO A 67 -11.997 -27.166 -35.063 1.00 0.00 C ATOM 651 C PRO A 67 -10.799 -26.617 -35.862 1.00 0.00 C ATOM 652 O PRO A 67 -10.250 -25.549 -35.533 1.00 0.00 O ATOM 653 CB PRO A 67 -13.329 -26.480 -35.452 1.00 0.00 C ATOM 654 CG PRO A 67 -13.451 -25.325 -34.507 1.00 0.00 C ATOM 655 CD PRO A 67 -12.774 -25.755 -33.221 1.00 0.00 C ATOM 0 HA PRO A 67 -12.011 -28.235 -35.275 1.00 0.00 H new ATOM 0 HB2 PRO A 67 -13.313 -26.144 -36.489 1.00 0.00 H new ATOM 0 HB3 PRO A 67 -14.171 -27.165 -35.352 1.00 0.00 H new ATOM 0 HG2 PRO A 67 -12.975 -24.434 -34.918 1.00 0.00 H new ATOM 0 HG3 PRO A 67 -14.497 -25.075 -34.331 1.00 0.00 H new ATOM 0 HD2 PRO A 67 -12.228 -24.930 -32.763 1.00 0.00 H new ATOM 0 HD3 PRO A 67 -13.500 -26.103 -32.486 1.00 0.00 H new ATOM 663 N GLN A 68 -10.403 -27.350 -36.913 1.00 0.00 N ATOM 664 CA GLN A 68 -9.277 -26.971 -37.775 1.00 0.00 C ATOM 665 C GLN A 68 -9.578 -25.658 -38.526 1.00 0.00 C ATOM 666 O GLN A 68 -8.653 -25.007 -39.017 1.00 0.00 O ATOM 667 CB GLN A 68 -8.918 -28.134 -38.749 1.00 0.00 C ATOM 668 CG GLN A 68 -10.061 -28.591 -39.710 1.00 0.00 C ATOM 669 CD GLN A 68 -9.925 -28.118 -41.173 1.00 0.00 C ATOM 670 OE1 GLN A 68 -9.259 -26.989 -41.412 1.00 0.00 O flip ATOM 671 NE2 GLN A 68 -10.413 -28.778 -42.093 1.00 0.00 N flip ATOM 0 H GLN A 68 -10.855 -28.222 -37.188 1.00 0.00 H new ATOM 0 HA GLN A 68 -8.403 -26.789 -37.149 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -8.063 -27.828 -39.351 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -8.600 -28.993 -38.158 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -10.107 -29.680 -39.701 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -11.011 -28.229 -39.316 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -10.919 -29.640 -41.890 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -10.310 -28.462 -43.057 1.00 0.00 H new ATOM 680 N ALA A 69 -10.879 -25.290 -38.581 1.00 0.00 N ATOM 681 CA ALA A 69 -11.350 -24.033 -39.175 1.00 0.00 C ATOM 682 C ALA A 69 -10.803 -22.841 -38.374 1.00 0.00 C ATOM 683 O ALA A 69 -10.334 -21.861 -38.945 1.00 0.00 O ATOM 684 CB ALA A 69 -12.890 -24.007 -39.208 1.00 0.00 C ATOM 0 H ALA A 69 -11.632 -25.868 -38.209 1.00 0.00 H new ATOM 0 HA ALA A 69 -10.984 -23.961 -40.199 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -13.229 -23.070 -39.650 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -13.255 -24.843 -39.804 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -13.277 -24.089 -38.192 1.00 0.00 H new ATOM 690 N ARG A 70 -10.844 -22.968 -37.034 1.00 0.00 N ATOM 691 CA ARG A 70 -10.321 -21.951 -36.101 1.00 0.00 C ATOM 692 C ARG A 70 -8.786 -21.903 -36.107 1.00 0.00 C ATOM 693 O ARG A 70 -8.203 -20.841 -35.882 1.00 0.00 O ATOM 694 CB ARG A 70 -10.872 -22.190 -34.663 1.00 0.00 C ATOM 695 CG ARG A 70 -12.339 -21.755 -34.486 1.00 0.00 C ATOM 696 CD ARG A 70 -12.514 -20.234 -34.654 1.00 0.00 C ATOM 697 NE ARG A 70 -13.930 -19.814 -34.694 1.00 0.00 N ATOM 698 CZ ARG A 70 -14.596 -19.429 -35.805 1.00 0.00 C ATOM 699 NH1 ARG A 70 -14.048 -19.553 -37.013 1.00 0.00 N ATOM 700 NH2 ARG A 70 -15.820 -18.931 -35.692 1.00 0.00 N ATOM 0 H ARG A 70 -11.242 -23.782 -36.566 1.00 0.00 H new ATOM 0 HA ARG A 70 -10.671 -20.978 -36.445 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -10.784 -23.249 -34.420 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -10.252 -21.647 -33.950 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -12.962 -22.274 -35.215 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -12.689 -22.053 -33.498 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -12.013 -19.724 -33.831 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -12.021 -19.917 -35.573 1.00 0.00 H new ATOM 0 HE ARG A 70 -14.445 -19.815 -33.814 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -13.111 -19.944 -37.110 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -14.566 -19.257 -37.841 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -16.251 -18.841 -34.772 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -16.330 -18.638 -36.525 1.00 0.00 H new ATOM 714 N ARG A 71 -8.139 -23.055 -36.356 1.00 0.00 N ATOM 715 CA ARG A 71 -6.659 -23.145 -36.386 1.00 0.00 C ATOM 716 C ARG A 71 -6.062 -22.374 -37.586 1.00 0.00 C ATOM 717 O ARG A 71 -5.008 -21.737 -37.466 1.00 0.00 O ATOM 718 CB ARG A 71 -6.192 -24.624 -36.412 1.00 0.00 C ATOM 719 CG ARG A 71 -6.712 -25.491 -35.238 1.00 0.00 C ATOM 720 CD ARG A 71 -6.018 -26.865 -35.155 1.00 0.00 C ATOM 721 NE ARG A 71 -6.009 -27.573 -36.451 1.00 0.00 N ATOM 722 CZ ARG A 71 -5.341 -28.708 -36.708 1.00 0.00 C ATOM 723 NH1 ARG A 71 -4.693 -29.353 -35.747 1.00 0.00 N ATOM 724 NH2 ARG A 71 -5.347 -29.209 -37.931 1.00 0.00 N ATOM 0 H ARG A 71 -8.613 -23.939 -36.540 1.00 0.00 H new ATOM 0 HA ARG A 71 -6.291 -22.679 -35.472 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -6.515 -25.076 -37.350 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -5.102 -24.646 -36.407 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -6.559 -24.955 -34.301 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -7.786 -25.638 -35.349 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -4.992 -26.730 -34.811 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -6.525 -27.480 -34.412 1.00 0.00 H new ATOM 0 HE ARG A 71 -6.554 -27.167 -37.211 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -4.697 -28.987 -34.795 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -4.190 -30.215 -35.960 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -5.858 -28.733 -38.675 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -4.841 -30.072 -38.131 1.00 0.00 H new ATOM 738 N GLU A 72 -6.753 -22.443 -38.736 1.00 0.00 N ATOM 739 CA GLU A 72 -6.319 -21.766 -39.985 1.00 0.00 C ATOM 740 C GLU A 72 -6.843 -20.317 -40.059 1.00 0.00 C ATOM 741 O GLU A 72 -6.213 -19.458 -40.693 1.00 0.00 O ATOM 742 CB GLU A 72 -6.774 -22.588 -41.221 1.00 0.00 C ATOM 743 CG GLU A 72 -8.291 -22.853 -41.303 1.00 0.00 C ATOM 744 CD GLU A 72 -8.722 -23.821 -42.418 1.00 0.00 C ATOM 745 OE1 GLU A 72 -7.959 -24.758 -42.749 1.00 0.00 O ATOM 746 OE2 GLU A 72 -9.844 -23.671 -42.950 1.00 0.00 O ATOM 0 H GLU A 72 -7.624 -22.965 -38.834 1.00 0.00 H new ATOM 0 HA GLU A 72 -5.230 -21.712 -39.981 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -6.463 -22.062 -42.123 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -6.253 -23.545 -41.214 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -8.627 -23.252 -40.346 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -8.803 -21.902 -41.450 1.00 0.00 H new ATOM 753 N ALA A 73 -8.006 -20.060 -39.434 1.00 0.00 N ATOM 754 CA ALA A 73 -8.607 -18.704 -39.371 1.00 0.00 C ATOM 755 C ALA A 73 -7.814 -17.800 -38.419 1.00 0.00 C ATOM 756 O ALA A 73 -7.605 -16.608 -38.687 1.00 0.00 O ATOM 757 CB ALA A 73 -10.075 -18.783 -38.918 1.00 0.00 C ATOM 0 H ALA A 73 -8.556 -20.776 -38.960 1.00 0.00 H new ATOM 0 HA ALA A 73 -8.570 -18.274 -40.372 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -10.498 -17.779 -38.878 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -10.642 -19.388 -39.626 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -10.127 -19.238 -37.929 1.00 0.00 H new ATOM 763 N ILE A 74 -7.391 -18.389 -37.294 1.00 0.00 N ATOM 764 CA ILE A 74 -6.685 -17.688 -36.219 1.00 0.00 C ATOM 765 C ILE A 74 -5.290 -18.321 -36.064 1.00 0.00 C ATOM 766 O ILE A 74 -5.196 -19.472 -35.620 1.00 0.00 O ATOM 767 CB ILE A 74 -7.479 -17.805 -34.861 1.00 0.00 C ATOM 768 CG1 ILE A 74 -8.989 -17.453 -35.073 1.00 0.00 C ATOM 769 CG2 ILE A 74 -6.843 -16.924 -33.754 1.00 0.00 C ATOM 770 CD1 ILE A 74 -9.874 -17.726 -33.875 1.00 0.00 C ATOM 0 H ILE A 74 -7.533 -19.381 -37.104 1.00 0.00 H new ATOM 0 HA ILE A 74 -6.598 -16.631 -36.469 1.00 0.00 H new ATOM 0 HB ILE A 74 -7.417 -18.840 -34.524 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -9.069 -16.398 -35.335 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -9.365 -18.022 -35.923 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -7.415 -17.029 -32.832 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -5.815 -17.243 -33.581 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -6.851 -15.881 -34.070 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -10.902 -17.453 -34.112 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -9.829 -18.786 -33.623 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -9.529 -17.137 -33.026 1.00 0.00 H new ATOM 782 N PRO A 75 -4.186 -17.604 -36.453 1.00 0.00 N ATOM 783 CA PRO A 75 -2.801 -18.103 -36.285 1.00 0.00 C ATOM 784 C PRO A 75 -2.378 -18.039 -34.803 1.00 0.00 C ATOM 785 O PRO A 75 -1.624 -17.154 -34.369 1.00 0.00 O ATOM 786 CB PRO A 75 -1.972 -17.165 -37.193 1.00 0.00 C ATOM 787 CG PRO A 75 -2.733 -15.875 -37.195 1.00 0.00 C ATOM 788 CD PRO A 75 -4.202 -16.255 -37.086 1.00 0.00 C ATOM 0 HA PRO A 75 -2.669 -19.149 -36.561 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -0.962 -17.029 -36.806 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -1.876 -17.571 -38.200 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -2.431 -15.242 -36.361 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -2.543 -15.311 -38.108 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -4.755 -15.537 -36.480 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -4.680 -16.280 -38.065 1.00 0.00 H new ATOM 796 N GLY A 76 -2.922 -18.988 -34.034 1.00 0.00 N ATOM 797 CA GLY A 76 -2.759 -19.029 -32.591 1.00 0.00 C ATOM 798 C GLY A 76 -4.091 -19.036 -31.871 1.00 0.00 C ATOM 799 O GLY A 76 -4.355 -18.165 -31.035 1.00 0.00 O ATOM 0 H GLY A 76 -3.490 -19.750 -34.405 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -2.193 -19.919 -32.315 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -2.176 -18.167 -32.267 1.00 0.00 H new ATOM 803 N VAL A 77 -4.951 -20.013 -32.213 1.00 0.00 N ATOM 804 CA VAL A 77 -6.256 -20.184 -31.548 1.00 0.00 C ATOM 805 C VAL A 77 -6.061 -20.844 -30.168 1.00 0.00 C ATOM 806 O VAL A 77 -5.189 -21.702 -29.990 1.00 0.00 O ATOM 807 CB VAL A 77 -7.284 -21.004 -32.418 1.00 0.00 C ATOM 808 CG1 VAL A 77 -6.821 -22.454 -32.659 1.00 0.00 C ATOM 809 CG2 VAL A 77 -8.701 -20.968 -31.795 1.00 0.00 C ATOM 0 H VAL A 77 -4.765 -20.697 -32.947 1.00 0.00 H new ATOM 0 HA VAL A 77 -6.685 -19.190 -31.419 1.00 0.00 H new ATOM 0 HB VAL A 77 -7.329 -20.518 -33.393 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -7.563 -22.977 -33.263 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -5.865 -22.448 -33.183 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -6.707 -22.963 -31.702 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -9.387 -21.542 -32.418 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -8.670 -21.401 -30.795 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -9.045 -19.936 -31.733 1.00 0.00 H new ATOM 819 N ARG A 78 -6.860 -20.390 -29.202 1.00 0.00 N ATOM 820 CA ARG A 78 -6.821 -20.835 -27.796 1.00 0.00 C ATOM 821 C ARG A 78 -8.157 -21.501 -27.424 1.00 0.00 C ATOM 822 O ARG A 78 -8.232 -22.420 -26.596 1.00 0.00 O ATOM 823 CB ARG A 78 -6.647 -19.596 -26.883 1.00 0.00 C ATOM 824 CG ARG A 78 -5.571 -18.583 -27.321 1.00 0.00 C ATOM 825 CD ARG A 78 -5.778 -17.224 -26.634 1.00 0.00 C ATOM 826 NE ARG A 78 -5.777 -17.343 -25.168 1.00 0.00 N ATOM 827 CZ ARG A 78 -6.300 -16.457 -24.310 1.00 0.00 C ATOM 828 NH1 ARG A 78 -6.851 -15.331 -24.740 1.00 0.00 N ATOM 829 NH2 ARG A 78 -6.273 -16.707 -23.017 1.00 0.00 N ATOM 0 H ARG A 78 -7.574 -19.683 -29.374 1.00 0.00 H new ATOM 0 HA ARG A 78 -5.998 -21.538 -27.668 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -7.603 -19.077 -26.821 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -6.406 -19.941 -25.877 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -4.582 -18.970 -27.077 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -5.606 -18.456 -28.403 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -4.990 -16.538 -26.943 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -6.723 -16.792 -26.962 1.00 0.00 H new ATOM 0 HE ARG A 78 -5.339 -18.174 -24.769 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -6.882 -15.127 -25.739 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -7.244 -14.668 -24.072 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -5.855 -17.572 -22.673 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -6.670 -16.036 -22.359 1.00 0.00 H new ATOM 843 N LEU A 79 -9.213 -20.985 -28.064 1.00 0.00 N ATOM 844 CA LEU A 79 -10.604 -21.105 -27.618 1.00 0.00 C ATOM 845 C LEU A 79 -11.444 -21.772 -28.707 1.00 0.00 C ATOM 846 O LEU A 79 -11.283 -21.455 -29.892 1.00 0.00 O ATOM 847 CB LEU A 79 -11.146 -19.676 -27.355 1.00 0.00 C ATOM 848 CG LEU A 79 -10.248 -18.753 -26.480 1.00 0.00 C ATOM 849 CD1 LEU A 79 -10.702 -17.283 -26.527 1.00 0.00 C ATOM 850 CD2 LEU A 79 -10.184 -19.260 -25.046 1.00 0.00 C ATOM 0 H LEU A 79 -9.119 -20.457 -28.932 1.00 0.00 H new ATOM 0 HA LEU A 79 -10.657 -21.711 -26.713 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -11.306 -19.188 -28.316 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -12.121 -19.762 -26.875 1.00 0.00 H new ATOM 0 HG LEU A 79 -9.244 -18.788 -26.903 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -10.045 -16.679 -25.901 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -10.658 -16.921 -27.554 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -11.725 -17.206 -26.159 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -9.551 -18.599 -24.454 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -11.188 -19.277 -24.621 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -9.768 -20.267 -25.034 1.00 0.00 H new ATOM 862 N CYS A 80 -12.334 -22.699 -28.307 1.00 0.00 N ATOM 863 CA CYS A 80 -13.289 -23.335 -29.239 1.00 0.00 C ATOM 864 C CYS A 80 -14.277 -22.272 -29.709 1.00 0.00 C ATOM 865 O CYS A 80 -14.473 -21.289 -28.992 1.00 0.00 O ATOM 866 CB CYS A 80 -14.017 -24.526 -28.575 1.00 0.00 C ATOM 867 SG CYS A 80 -15.267 -24.062 -27.344 1.00 0.00 S ATOM 0 H CYS A 80 -12.413 -23.026 -27.344 1.00 0.00 H new ATOM 0 HA CYS A 80 -12.751 -23.741 -30.095 1.00 0.00 H new ATOM 0 HB2 CYS A 80 -14.496 -25.120 -29.353 1.00 0.00 H new ATOM 0 HB3 CYS A 80 -13.276 -25.166 -28.096 1.00 0.00 H new ATOM 872 N ILE A 81 -14.925 -22.500 -30.864 1.00 0.00 N ATOM 873 CA ILE A 81 -15.719 -21.471 -31.598 1.00 0.00 C ATOM 874 C ILE A 81 -16.763 -20.742 -30.688 1.00 0.00 C ATOM 875 O ILE A 81 -17.084 -19.566 -30.907 1.00 0.00 O ATOM 876 CB ILE A 81 -16.415 -22.124 -32.863 1.00 0.00 C ATOM 877 CG1 ILE A 81 -17.295 -21.092 -33.645 1.00 0.00 C ATOM 878 CG2 ILE A 81 -17.219 -23.388 -32.472 1.00 0.00 C ATOM 879 CD1 ILE A 81 -17.923 -21.619 -34.926 1.00 0.00 C ATOM 0 H ILE A 81 -14.919 -23.409 -31.328 1.00 0.00 H new ATOM 0 HA ILE A 81 -15.023 -20.701 -31.931 1.00 0.00 H new ATOM 0 HB ILE A 81 -15.623 -22.438 -33.543 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -18.090 -20.743 -32.986 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -16.680 -20.226 -33.890 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -17.684 -23.813 -33.361 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -16.548 -24.123 -32.027 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -17.991 -23.119 -31.751 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -18.512 -20.830 -35.394 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -17.138 -21.940 -35.611 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -18.569 -22.465 -34.693 1.00 0.00 H new ATOM 891 N HIS A 82 -17.199 -21.430 -29.624 1.00 0.00 N ATOM 892 CA HIS A 82 -18.183 -20.908 -28.646 1.00 0.00 C ATOM 893 C HIS A 82 -17.509 -19.924 -27.647 1.00 0.00 C ATOM 894 O HIS A 82 -18.013 -18.814 -27.428 1.00 0.00 O ATOM 895 CB HIS A 82 -18.861 -22.091 -27.899 1.00 0.00 C ATOM 896 CG HIS A 82 -19.326 -23.198 -28.813 1.00 0.00 C ATOM 897 ND1 HIS A 82 -20.573 -23.232 -29.390 1.00 0.00 N ATOM 898 CD2 HIS A 82 -18.673 -24.289 -29.280 1.00 0.00 C ATOM 899 CE1 HIS A 82 -20.667 -24.294 -30.168 1.00 0.00 C ATOM 900 NE2 HIS A 82 -19.526 -24.952 -30.118 1.00 0.00 N ATOM 0 H HIS A 82 -16.880 -22.375 -29.410 1.00 0.00 H new ATOM 0 HA HIS A 82 -18.950 -20.350 -29.183 1.00 0.00 H new ATOM 0 HB2 HIS A 82 -18.159 -22.502 -27.174 1.00 0.00 H new ATOM 0 HB3 HIS A 82 -19.715 -21.713 -27.337 1.00 0.00 H new ATOM 0 HD2 HIS A 82 -17.663 -24.582 -29.035 1.00 0.00 H new ATOM 0 HE1 HIS A 82 -21.533 -24.576 -30.748 1.00 0.00 H new ATOM 0 HE2 HIS A 82 -19.314 -25.814 -30.621 1.00 0.00 H new ATOM 909 N CYS A 83 -16.348 -20.325 -27.066 1.00 0.00 N ATOM 910 CA CYS A 83 -15.592 -19.476 -26.116 1.00 0.00 C ATOM 911 C CYS A 83 -14.771 -18.411 -26.864 1.00 0.00 C ATOM 912 O CYS A 83 -14.285 -17.457 -26.258 1.00 0.00 O ATOM 913 CB CYS A 83 -14.639 -20.323 -25.244 1.00 0.00 C ATOM 914 SG CYS A 83 -15.398 -21.734 -24.391 1.00 0.00 S ATOM 0 H CYS A 83 -15.917 -21.233 -27.241 1.00 0.00 H new ATOM 0 HA CYS A 83 -16.323 -18.986 -25.473 1.00 0.00 H new ATOM 0 HB2 CYS A 83 -13.832 -20.695 -25.876 1.00 0.00 H new ATOM 0 HB3 CYS A 83 -14.185 -19.672 -24.497 1.00 0.00 H new ATOM 919 N GLN A 84 -14.561 -18.612 -28.176 1.00 0.00 N ATOM 920 CA GLN A 84 -13.737 -17.709 -28.987 1.00 0.00 C ATOM 921 C GLN A 84 -14.550 -16.474 -29.369 1.00 0.00 C ATOM 922 O GLN A 84 -14.090 -15.358 -29.153 1.00 0.00 O ATOM 923 CB GLN A 84 -13.197 -18.443 -30.257 1.00 0.00 C ATOM 924 CG GLN A 84 -11.809 -17.986 -30.779 1.00 0.00 C ATOM 925 CD GLN A 84 -11.649 -16.467 -30.918 1.00 0.00 C ATOM 926 OE1 GLN A 84 -11.036 -15.826 -29.923 1.00 0.00 O flip ATOM 927 NE2 GLN A 84 -12.017 -15.891 -31.934 1.00 0.00 N flip ATOM 0 H GLN A 84 -14.954 -19.396 -28.696 1.00 0.00 H new ATOM 0 HA GLN A 84 -12.875 -17.391 -28.400 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -13.146 -19.510 -30.039 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -13.923 -18.316 -31.060 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -11.040 -18.359 -30.103 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -11.630 -18.448 -31.750 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -12.483 -16.413 -32.676 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -11.857 -14.889 -32.038 1.00 0.00 H new ATOM 936 N GLN A 85 -15.762 -16.697 -29.915 1.00 0.00 N ATOM 937 CA GLN A 85 -16.603 -15.619 -30.485 1.00 0.00 C ATOM 938 C GLN A 85 -16.885 -14.491 -29.471 1.00 0.00 C ATOM 939 O GLN A 85 -16.904 -13.316 -29.844 1.00 0.00 O ATOM 940 CB GLN A 85 -17.928 -16.192 -31.048 1.00 0.00 C ATOM 941 CG GLN A 85 -18.837 -16.880 -30.020 1.00 0.00 C ATOM 942 CD GLN A 85 -20.129 -17.418 -30.634 1.00 0.00 C ATOM 943 OE1 GLN A 85 -21.158 -16.732 -30.675 1.00 0.00 O ATOM 944 NE2 GLN A 85 -20.070 -18.632 -31.155 1.00 0.00 N ATOM 0 H GLN A 85 -16.186 -17.623 -29.975 1.00 0.00 H new ATOM 0 HA GLN A 85 -16.036 -15.177 -31.304 1.00 0.00 H new ATOM 0 HB2 GLN A 85 -18.486 -15.380 -31.515 1.00 0.00 H new ATOM 0 HB3 GLN A 85 -17.689 -16.909 -31.834 1.00 0.00 H new ATOM 0 HG2 GLN A 85 -18.293 -17.701 -29.554 1.00 0.00 H new ATOM 0 HG3 GLN A 85 -19.084 -16.172 -29.229 1.00 0.00 H new ATOM 0 HE21 GLN A 85 -19.204 -19.168 -31.102 1.00 0.00 H new ATOM 0 HE22 GLN A 85 -20.891 -19.032 -31.610 1.00 0.00 H new ATOM 953 N GLU A 86 -17.073 -14.866 -28.196 1.00 0.00 N ATOM 954 CA GLU A 86 -17.271 -13.905 -27.092 1.00 0.00 C ATOM 955 C GLU A 86 -16.007 -13.042 -26.864 1.00 0.00 C ATOM 956 O GLU A 86 -16.096 -11.813 -26.817 1.00 0.00 O ATOM 957 CB GLU A 86 -17.684 -14.645 -25.788 1.00 0.00 C ATOM 958 CG GLU A 86 -16.692 -15.720 -25.316 1.00 0.00 C ATOM 959 CD GLU A 86 -16.977 -16.252 -23.911 1.00 0.00 C ATOM 960 OE1 GLU A 86 -16.808 -15.476 -22.944 1.00 0.00 O ATOM 961 OE2 GLU A 86 -17.361 -17.430 -23.752 1.00 0.00 O ATOM 0 H GLU A 86 -17.093 -15.841 -27.898 1.00 0.00 H new ATOM 0 HA GLU A 86 -18.081 -13.233 -27.374 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -17.807 -13.910 -24.993 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -18.657 -15.111 -25.944 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -16.711 -16.552 -26.020 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -15.684 -15.306 -25.340 1.00 0.00 H new ATOM 968 N LYS A 87 -14.827 -13.697 -26.787 1.00 0.00 N ATOM 969 CA LYS A 87 -13.536 -13.023 -26.520 1.00 0.00 C ATOM 970 C LYS A 87 -13.059 -12.231 -27.750 1.00 0.00 C ATOM 971 O LYS A 87 -12.291 -11.269 -27.626 1.00 0.00 O ATOM 972 CB LYS A 87 -12.460 -14.059 -26.118 1.00 0.00 C ATOM 973 CG LYS A 87 -12.765 -14.861 -24.833 1.00 0.00 C ATOM 974 CD LYS A 87 -12.939 -13.968 -23.587 1.00 0.00 C ATOM 975 CE LYS A 87 -12.947 -14.776 -22.273 1.00 0.00 C ATOM 976 NZ LYS A 87 -14.002 -15.827 -22.245 1.00 0.00 N ATOM 0 H LYS A 87 -14.743 -14.706 -26.908 1.00 0.00 H new ATOM 0 HA LYS A 87 -13.689 -12.325 -25.697 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -12.328 -14.760 -26.942 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -11.511 -13.540 -25.986 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -13.673 -15.445 -24.984 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -11.956 -15.570 -24.654 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -12.132 -13.236 -23.554 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -13.872 -13.410 -23.672 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -11.972 -15.243 -22.134 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -13.097 -14.095 -21.435 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -14.097 -16.198 -21.278 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -14.908 -15.417 -22.550 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -13.738 -16.601 -22.888 1.00 0.00 H new ATOM 990 N ASP A 88 -13.529 -12.659 -28.929 1.00 0.00 N ATOM 991 CA ASP A 88 -13.179 -12.055 -30.221 1.00 0.00 C ATOM 992 C ASP A 88 -13.733 -10.619 -30.303 1.00 0.00 C ATOM 993 O ASP A 88 -13.103 -9.729 -30.880 1.00 0.00 O ATOM 994 CB ASP A 88 -13.741 -12.930 -31.368 1.00 0.00 C ATOM 995 CG ASP A 88 -13.329 -12.471 -32.780 1.00 0.00 C ATOM 996 OD1 ASP A 88 -12.224 -12.837 -33.243 1.00 0.00 O ATOM 997 OD2 ASP A 88 -14.117 -11.774 -33.452 1.00 0.00 O ATOM 0 H ASP A 88 -14.172 -13.446 -29.013 1.00 0.00 H new ATOM 0 HA ASP A 88 -12.094 -12.004 -30.318 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -13.408 -13.957 -31.222 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -14.829 -12.936 -31.304 1.00 0.00 H new ATOM 1002 N LEU A 89 -14.908 -10.411 -29.685 1.00 0.00 N ATOM 1003 CA LEU A 89 -15.549 -9.084 -29.591 1.00 0.00 C ATOM 1004 C LEU A 89 -14.703 -8.138 -28.709 1.00 0.00 C ATOM 1005 O LEU A 89 -14.590 -6.936 -28.980 1.00 0.00 O ATOM 1006 CB LEU A 89 -16.979 -9.218 -28.987 1.00 0.00 C ATOM 1007 CG LEU A 89 -17.901 -10.311 -29.614 1.00 0.00 C ATOM 1008 CD1 LEU A 89 -19.300 -10.317 -28.961 1.00 0.00 C ATOM 1009 CD2 LEU A 89 -17.997 -10.172 -31.152 1.00 0.00 C ATOM 0 H LEU A 89 -15.441 -11.156 -29.236 1.00 0.00 H new ATOM 0 HA LEU A 89 -15.620 -8.666 -30.595 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -16.881 -9.425 -27.921 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -17.480 -8.255 -29.080 1.00 0.00 H new ATOM 0 HG LEU A 89 -17.438 -11.275 -29.406 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -19.914 -11.090 -29.423 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -19.203 -10.520 -27.894 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -19.772 -9.345 -29.104 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -18.648 -10.952 -31.548 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -18.407 -9.194 -31.404 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -17.004 -10.272 -31.589 1.00 0.00 H new ATOM 1021 N GLN A 90 -14.079 -8.729 -27.674 1.00 0.00 N ATOM 1022 CA GLN A 90 -13.422 -7.993 -26.573 1.00 0.00 C ATOM 1023 C GLN A 90 -11.991 -7.550 -26.941 1.00 0.00 C ATOM 1024 O GLN A 90 -11.394 -6.749 -26.206 1.00 0.00 O ATOM 1025 CB GLN A 90 -13.384 -8.887 -25.292 1.00 0.00 C ATOM 1026 CG GLN A 90 -14.683 -9.669 -25.016 1.00 0.00 C ATOM 1027 CD GLN A 90 -15.929 -8.805 -24.807 1.00 0.00 C ATOM 1028 OE1 GLN A 90 -15.861 -7.703 -24.266 1.00 0.00 O ATOM 1029 NE2 GLN A 90 -17.081 -9.300 -25.249 1.00 0.00 N ATOM 0 H GLN A 90 -14.015 -9.742 -27.575 1.00 0.00 H new ATOM 0 HA GLN A 90 -14.006 -7.092 -26.385 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -12.561 -9.596 -25.384 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -13.166 -8.256 -24.431 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -14.865 -10.346 -25.850 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -14.536 -10.287 -24.130 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -17.105 -10.218 -25.694 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -17.941 -8.762 -25.143 1.00 0.00 H new ATOM 1038 N LYS A 91 -11.449 -8.083 -28.062 1.00 0.00 N ATOM 1039 CA LYS A 91 -10.077 -7.768 -28.527 1.00 0.00 C ATOM 1040 C LYS A 91 -9.905 -6.243 -28.747 1.00 0.00 C ATOM 1041 O LYS A 91 -10.789 -5.615 -29.351 1.00 0.00 O ATOM 1042 CB LYS A 91 -9.747 -8.507 -29.859 1.00 0.00 C ATOM 1043 CG LYS A 91 -9.824 -10.053 -29.793 1.00 0.00 C ATOM 1044 CD LYS A 91 -9.439 -10.734 -31.134 1.00 0.00 C ATOM 1045 CE LYS A 91 -10.220 -10.176 -32.341 1.00 0.00 C ATOM 1046 NZ LYS A 91 -9.948 -10.932 -33.583 1.00 0.00 N ATOM 0 H LYS A 91 -11.946 -8.738 -28.665 1.00 0.00 H new ATOM 0 HA LYS A 91 -9.391 -8.106 -27.750 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -10.434 -8.158 -30.629 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -8.743 -8.222 -30.175 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -9.161 -10.412 -29.006 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -10.836 -10.350 -29.518 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -8.371 -10.603 -31.308 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -9.620 -11.806 -31.056 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -11.288 -10.207 -32.126 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -9.955 -9.129 -32.490 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -10.007 -10.291 -34.400 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -8.995 -11.346 -33.536 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -10.651 -11.691 -33.688 1.00 0.00 H new ATOM 1060 N PRO A 92 -8.787 -5.618 -28.236 1.00 0.00 N ATOM 1061 CA PRO A 92 -8.514 -4.183 -28.473 1.00 0.00 C ATOM 1062 C PRO A 92 -8.369 -3.868 -29.982 1.00 0.00 C ATOM 1063 O PRO A 92 -9.117 -3.029 -30.513 1.00 0.00 O ATOM 1064 CB PRO A 92 -7.205 -3.911 -27.669 1.00 0.00 C ATOM 1065 CG PRO A 92 -6.592 -5.265 -27.444 1.00 0.00 C ATOM 1066 CD PRO A 92 -7.746 -6.238 -27.368 1.00 0.00 C ATOM 0 HA PRO A 92 -9.330 -3.538 -28.147 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -6.530 -3.260 -28.225 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -7.420 -3.414 -26.723 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -5.914 -5.526 -28.257 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -6.007 -5.281 -26.524 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -7.461 -7.227 -27.728 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -8.099 -6.361 -26.344 1.00 0.00 H new ATOM 1074 N ALA A 93 -7.417 -4.563 -30.655 1.00 0.00 N ATOM 1075 CA ALA A 93 -7.137 -4.404 -32.106 1.00 0.00 C ATOM 1076 C ALA A 93 -6.654 -2.970 -32.466 1.00 0.00 C ATOM 1077 O ALA A 93 -6.633 -2.580 -33.638 1.00 0.00 O ATOM 1078 CB ALA A 93 -8.359 -4.840 -32.942 1.00 0.00 C ATOM 0 H ALA A 93 -6.818 -5.254 -30.203 1.00 0.00 H new ATOM 0 HA ALA A 93 -6.307 -5.064 -32.358 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -8.137 -4.717 -34.002 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -8.585 -5.886 -32.737 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -9.219 -4.225 -32.678 1.00 0.00 H new ATOM 1084 N TYR A 94 -6.208 -2.228 -31.440 1.00 0.00 N ATOM 1085 CA TYR A 94 -5.681 -0.861 -31.581 1.00 0.00 C ATOM 1086 C TYR A 94 -4.583 -0.655 -30.526 1.00 0.00 C ATOM 1087 O TYR A 94 -4.623 -1.280 -29.457 1.00 0.00 O ATOM 1088 CB TYR A 94 -6.807 0.214 -31.422 1.00 0.00 C ATOM 1089 CG TYR A 94 -7.221 0.545 -29.970 1.00 0.00 C ATOM 1090 CD1 TYR A 94 -8.011 -0.323 -29.219 1.00 0.00 C ATOM 1091 CD2 TYR A 94 -6.799 1.732 -29.349 1.00 0.00 C ATOM 1092 CE1 TYR A 94 -8.371 -0.027 -27.914 1.00 0.00 C ATOM 1093 CE2 TYR A 94 -7.157 2.029 -28.048 1.00 0.00 C ATOM 1094 CZ TYR A 94 -7.940 1.147 -27.333 1.00 0.00 C ATOM 1095 OH TYR A 94 -8.297 1.443 -26.027 1.00 0.00 O ATOM 0 H TYR A 94 -6.203 -2.565 -30.477 1.00 0.00 H new ATOM 0 HA TYR A 94 -5.270 -0.739 -32.583 1.00 0.00 H new ATOM 0 HB2 TYR A 94 -6.476 1.134 -31.904 1.00 0.00 H new ATOM 0 HB3 TYR A 94 -7.689 -0.129 -31.962 1.00 0.00 H new ATOM 0 HD1 TYR A 94 -8.350 -1.247 -29.664 1.00 0.00 H new ATOM 0 HD2 TYR A 94 -6.182 2.427 -29.900 1.00 0.00 H new ATOM 0 HE1 TYR A 94 -8.988 -0.714 -27.353 1.00 0.00 H new ATOM 0 HE2 TYR A 94 -6.824 2.950 -27.592 1.00 0.00 H new ATOM 0 HH TYR A 94 -7.911 2.306 -25.770 1.00 0.00 H new ATOM 1105 N THR A 95 -3.612 0.226 -30.809 1.00 0.00 N ATOM 1106 CA THR A 95 -2.568 0.598 -29.835 1.00 0.00 C ATOM 1107 C THR A 95 -2.554 2.130 -29.672 1.00 0.00 C ATOM 1108 O THR A 95 -1.768 2.838 -30.309 1.00 0.00 O ATOM 1109 CB THR A 95 -1.158 0.035 -30.246 1.00 0.00 C ATOM 1110 OG1 THR A 95 -0.821 0.440 -31.580 1.00 0.00 O ATOM 1111 CG2 THR A 95 -1.101 -1.500 -30.161 1.00 0.00 C ATOM 0 H THR A 95 -3.526 0.698 -31.709 1.00 0.00 H new ATOM 0 HA THR A 95 -2.802 0.144 -28.872 1.00 0.00 H new ATOM 0 HB THR A 95 -0.438 0.447 -29.539 1.00 0.00 H new ATOM 0 HG1 THR A 95 -0.988 1.400 -31.683 1.00 0.00 H new ATOM 0 HG21 THR A 95 -0.109 -1.844 -30.454 1.00 0.00 H new ATOM 0 HG22 THR A 95 -1.307 -1.816 -29.138 1.00 0.00 H new ATOM 0 HG23 THR A 95 -1.846 -1.929 -30.831 1.00 0.00 H new ATOM 1119 N GLY A 96 -3.485 2.626 -28.840 1.00 0.00 N ATOM 1120 CA GLY A 96 -3.705 4.061 -28.661 1.00 0.00 C ATOM 1121 C GLY A 96 -3.137 4.596 -27.358 1.00 0.00 C ATOM 1122 O GLY A 96 -3.791 5.389 -26.665 1.00 0.00 O ATOM 0 H GLY A 96 -4.102 2.041 -28.277 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -3.252 4.598 -29.495 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -4.775 4.265 -28.694 1.00 0.00 H new ATOM 1126 N TYR A 97 -1.913 4.169 -27.011 1.00 0.00 N ATOM 1127 CA TYR A 97 -1.196 4.662 -25.816 1.00 0.00 C ATOM 1128 C TYR A 97 0.127 5.328 -26.216 1.00 0.00 C ATOM 1129 O TYR A 97 0.719 4.987 -27.241 1.00 0.00 O ATOM 1130 CB TYR A 97 -0.967 3.547 -24.760 1.00 0.00 C ATOM 1131 CG TYR A 97 -0.535 2.195 -25.326 1.00 0.00 C ATOM 1132 CD1 TYR A 97 -1.485 1.354 -25.884 1.00 0.00 C ATOM 1133 CD2 TYR A 97 0.790 1.760 -25.295 1.00 0.00 C ATOM 1134 CE1 TYR A 97 -1.141 0.122 -26.392 1.00 0.00 C ATOM 1135 CE2 TYR A 97 1.144 0.522 -25.797 1.00 0.00 C ATOM 1136 CZ TYR A 97 0.176 -0.296 -26.345 1.00 0.00 C ATOM 1137 OH TYR A 97 0.521 -1.541 -26.831 1.00 0.00 O ATOM 0 H TYR A 97 -1.391 3.475 -27.546 1.00 0.00 H new ATOM 0 HA TYR A 97 -1.832 5.411 -25.344 1.00 0.00 H new ATOM 0 HB2 TYR A 97 -0.209 3.887 -24.055 1.00 0.00 H new ATOM 0 HB3 TYR A 97 -1.889 3.409 -24.195 1.00 0.00 H new ATOM 0 HD1 TYR A 97 -2.516 1.672 -25.921 1.00 0.00 H new ATOM 0 HD2 TYR A 97 1.550 2.400 -24.872 1.00 0.00 H new ATOM 0 HE1 TYR A 97 -1.897 -0.516 -26.826 1.00 0.00 H new ATOM 0 HE2 TYR A 97 2.173 0.196 -25.761 1.00 0.00 H new ATOM 0 HH TYR A 97 1.485 -1.678 -26.724 1.00 0.00 H new ATOM 1147 N ASN A 98 0.591 6.251 -25.356 1.00 0.00 N ATOM 1148 CA ASN A 98 1.750 7.127 -25.621 1.00 0.00 C ATOM 1149 C ASN A 98 3.078 6.353 -25.659 1.00 0.00 C ATOM 1150 O ASN A 98 4.083 6.882 -26.160 1.00 0.00 O ATOM 1151 CB ASN A 98 1.828 8.265 -24.562 1.00 0.00 C ATOM 1152 CG ASN A 98 0.614 9.204 -24.567 1.00 0.00 C ATOM 1153 OD1 ASN A 98 -0.503 8.813 -24.909 1.00 0.00 O ATOM 1154 ND2 ASN A 98 0.821 10.450 -24.176 1.00 0.00 N ATOM 0 H ASN A 98 0.166 6.413 -24.443 1.00 0.00 H new ATOM 0 HA ASN A 98 1.597 7.560 -26.610 1.00 0.00 H new ATOM 0 HB2 ASN A 98 1.927 7.820 -23.572 1.00 0.00 H new ATOM 0 HB3 ASN A 98 2.729 8.852 -24.739 1.00 0.00 H new ATOM 0 HD21 ASN A 98 0.046 11.113 -24.153 1.00 0.00 H new ATOM 0 HD22 ASN A 98 1.756 10.749 -23.898 1.00 0.00 H new ATOM 1161 N ARG A 99 3.084 5.110 -25.131 1.00 0.00 N ATOM 1162 CA ARG A 99 4.277 4.241 -25.143 1.00 0.00 C ATOM 1163 C ARG A 99 4.510 3.690 -26.560 1.00 0.00 C ATOM 1164 O ARG A 99 4.047 2.600 -26.914 1.00 0.00 O ATOM 1165 CB ARG A 99 4.159 3.096 -24.105 1.00 0.00 C ATOM 1166 CG ARG A 99 4.009 3.582 -22.646 1.00 0.00 C ATOM 1167 CD ARG A 99 4.012 2.428 -21.634 1.00 0.00 C ATOM 1168 NE ARG A 99 3.710 2.896 -20.267 1.00 0.00 N ATOM 1169 CZ ARG A 99 3.699 2.134 -19.174 1.00 0.00 C ATOM 1170 NH1 ARG A 99 4.115 0.873 -19.217 1.00 0.00 N ATOM 1171 NH2 ARG A 99 3.303 2.657 -18.025 1.00 0.00 N ATOM 0 H ARG A 99 2.269 4.685 -24.689 1.00 0.00 H new ATOM 0 HA ARG A 99 5.141 4.840 -24.856 1.00 0.00 H new ATOM 0 HB2 ARG A 99 3.300 2.475 -24.360 1.00 0.00 H new ATOM 0 HB3 ARG A 99 5.043 2.462 -24.177 1.00 0.00 H new ATOM 0 HG2 ARG A 99 4.822 4.268 -22.411 1.00 0.00 H new ATOM 0 HG3 ARG A 99 3.080 4.143 -22.548 1.00 0.00 H new ATOM 0 HD2 ARG A 99 3.277 1.681 -21.933 1.00 0.00 H new ATOM 0 HD3 ARG A 99 4.986 1.939 -21.644 1.00 0.00 H new ATOM 0 HE ARG A 99 3.491 3.885 -20.149 1.00 0.00 H new ATOM 0 HH11 ARG A 99 4.449 0.476 -20.095 1.00 0.00 H new ATOM 0 HH12 ARG A 99 4.101 0.302 -18.372 1.00 0.00 H new ATOM 0 HH21 ARG A 99 3.011 3.633 -17.983 1.00 0.00 H new ATOM 0 HH22 ARG A 99 3.290 2.084 -17.181 1.00 0.00 H new ATOM 1185 N ARG A 100 5.181 4.511 -27.377 1.00 0.00 N ATOM 1186 CA ARG A 100 5.553 4.193 -28.754 1.00 0.00 C ATOM 1187 C ARG A 100 7.056 4.418 -28.890 1.00 0.00 C ATOM 1188 O ARG A 100 7.515 5.556 -29.040 1.00 0.00 O ATOM 1189 CB ARG A 100 4.742 5.068 -29.750 1.00 0.00 C ATOM 1190 CG ARG A 100 3.226 4.784 -29.733 1.00 0.00 C ATOM 1191 CD ARG A 100 2.422 5.759 -30.600 1.00 0.00 C ATOM 1192 NE ARG A 100 0.991 5.386 -30.653 1.00 0.00 N ATOM 1193 CZ ARG A 100 -0.026 6.106 -30.153 1.00 0.00 C ATOM 1194 NH1 ARG A 100 0.200 7.215 -29.454 1.00 0.00 N ATOM 1195 NH2 ARG A 100 -1.267 5.693 -30.331 1.00 0.00 N ATOM 0 H ARG A 100 5.487 5.440 -27.087 1.00 0.00 H new ATOM 0 HA ARG A 100 5.320 3.155 -28.991 1.00 0.00 H new ATOM 0 HB2 ARG A 100 4.908 6.119 -29.515 1.00 0.00 H new ATOM 0 HB3 ARG A 100 5.122 4.903 -30.758 1.00 0.00 H new ATOM 0 HG2 ARG A 100 3.049 3.766 -30.081 1.00 0.00 H new ATOM 0 HG3 ARG A 100 2.864 4.837 -28.706 1.00 0.00 H new ATOM 0 HD2 ARG A 100 2.521 6.769 -30.201 1.00 0.00 H new ATOM 0 HD3 ARG A 100 2.833 5.773 -31.610 1.00 0.00 H new ATOM 0 HE ARG A 100 0.757 4.504 -31.109 1.00 0.00 H new ATOM 0 HH11 ARG A 100 1.157 7.529 -29.291 1.00 0.00 H new ATOM 0 HH12 ARG A 100 -0.583 7.751 -29.081 1.00 0.00 H new ATOM 0 HH21 ARG A 100 -1.449 4.831 -30.846 1.00 0.00 H new ATOM 0 HH22 ARG A 100 -2.044 6.235 -29.954 1.00 0.00 H new ATOM 1209 N GLY A 101 7.811 3.328 -28.748 1.00 0.00 N ATOM 1210 CA GLY A 101 9.261 3.352 -28.803 1.00 0.00 C ATOM 1211 C GLY A 101 9.840 2.179 -28.038 1.00 0.00 C ATOM 1212 O GLY A 101 10.662 2.360 -27.129 1.00 0.00 O ATOM 0 H GLY A 101 7.423 2.398 -28.590 1.00 0.00 H new ATOM 0 HA2 GLY A 101 9.592 3.316 -29.841 1.00 0.00 H new ATOM 0 HA3 GLY A 101 9.631 4.287 -28.382 1.00 0.00 H new ATOM 1216 N SER A 102 9.381 0.969 -28.400 1.00 0.00 N ATOM 1217 CA SER A 102 9.857 -0.290 -27.808 1.00 0.00 C ATOM 1218 C SER A 102 11.274 -0.608 -28.325 1.00 0.00 C ATOM 1219 O SER A 102 11.455 -1.345 -29.304 1.00 0.00 O ATOM 1220 CB SER A 102 8.846 -1.431 -28.112 1.00 0.00 C ATOM 1221 OG SER A 102 8.517 -1.487 -29.492 1.00 0.00 O ATOM 0 H SER A 102 8.666 0.838 -29.115 1.00 0.00 H new ATOM 0 HA SER A 102 9.921 -0.192 -26.724 1.00 0.00 H new ATOM 0 HB2 SER A 102 9.270 -2.385 -27.800 1.00 0.00 H new ATOM 0 HB3 SER A 102 7.939 -1.279 -27.527 1.00 0.00 H new ATOM 0 HG SER A 102 9.339 -1.479 -30.025 1.00 0.00 H new ATOM 1227 N LYS A 103 12.275 0.024 -27.689 1.00 0.00 N ATOM 1228 CA LYS A 103 13.675 -0.060 -28.108 1.00 0.00 C ATOM 1229 C LYS A 103 14.424 -1.041 -27.209 1.00 0.00 C ATOM 1230 O LYS A 103 14.393 -0.906 -25.977 1.00 0.00 O ATOM 1231 CB LYS A 103 14.330 1.351 -28.061 1.00 0.00 C ATOM 1232 CG LYS A 103 13.591 2.434 -28.885 1.00 0.00 C ATOM 1233 CD LYS A 103 13.324 1.976 -30.335 1.00 0.00 C ATOM 1234 CE LYS A 103 12.482 2.970 -31.147 1.00 0.00 C ATOM 1235 NZ LYS A 103 12.121 2.419 -32.480 1.00 0.00 N ATOM 0 H LYS A 103 12.130 0.609 -26.866 1.00 0.00 H new ATOM 0 HA LYS A 103 13.726 -0.424 -29.134 1.00 0.00 H new ATOM 0 HB2 LYS A 103 14.384 1.677 -27.022 1.00 0.00 H new ATOM 0 HB3 LYS A 103 15.355 1.273 -28.424 1.00 0.00 H new ATOM 0 HG2 LYS A 103 12.645 2.675 -28.401 1.00 0.00 H new ATOM 0 HG3 LYS A 103 14.185 3.348 -28.897 1.00 0.00 H new ATOM 0 HD2 LYS A 103 14.278 1.822 -30.840 1.00 0.00 H new ATOM 0 HD3 LYS A 103 12.815 1.012 -30.315 1.00 0.00 H new ATOM 0 HE2 LYS A 103 11.574 3.215 -30.596 1.00 0.00 H new ATOM 0 HE3 LYS A 103 13.037 3.899 -31.275 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 11.553 3.116 -33.002 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 12.988 2.209 -33.015 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 11.570 1.546 -32.357 1.00 0.00 H new ATOM 1249 N ASP A 104 15.071 -2.041 -27.827 1.00 0.00 N ATOM 1250 CA ASP A 104 15.891 -3.026 -27.116 1.00 0.00 C ATOM 1251 C ASP A 104 17.097 -2.336 -26.456 1.00 0.00 C ATOM 1252 O ASP A 104 18.121 -2.080 -27.102 1.00 0.00 O ATOM 1253 CB ASP A 104 16.361 -4.151 -28.071 1.00 0.00 C ATOM 1254 CG ASP A 104 15.223 -5.094 -28.486 1.00 0.00 C ATOM 1255 OD1 ASP A 104 14.500 -4.785 -29.458 1.00 0.00 O ATOM 1256 OD2 ASP A 104 15.057 -6.158 -27.850 1.00 0.00 O ATOM 0 H ASP A 104 15.038 -2.187 -28.836 1.00 0.00 H new ATOM 0 HA ASP A 104 15.280 -3.482 -26.337 1.00 0.00 H new ATOM 0 HB2 ASP A 104 16.800 -3.704 -28.963 1.00 0.00 H new ATOM 0 HB3 ASP A 104 17.147 -4.729 -27.585 1.00 0.00 H new ATOM 1261 N SER A 105 16.935 -2.035 -25.162 1.00 0.00 N ATOM 1262 CA SER A 105 17.952 -1.382 -24.322 1.00 0.00 C ATOM 1263 C SER A 105 18.890 -2.454 -23.700 1.00 0.00 C ATOM 1264 O SER A 105 19.405 -2.294 -22.589 1.00 0.00 O ATOM 1265 CB SER A 105 17.206 -0.551 -23.234 1.00 0.00 C ATOM 1266 OG SER A 105 18.088 0.263 -22.492 1.00 0.00 O ATOM 0 H SER A 105 16.074 -2.243 -24.656 1.00 0.00 H new ATOM 0 HA SER A 105 18.582 -0.714 -24.909 1.00 0.00 H new ATOM 0 HB2 SER A 105 16.450 0.074 -23.710 1.00 0.00 H new ATOM 0 HB3 SER A 105 16.681 -1.227 -22.558 1.00 0.00 H new ATOM 0 HG SER A 105 18.866 -0.265 -22.215 1.00 0.00 H new ATOM 1272 N GLN A 106 19.138 -3.535 -24.472 1.00 0.00 N ATOM 1273 CA GLN A 106 19.827 -4.757 -24.002 1.00 0.00 C ATOM 1274 C GLN A 106 21.105 -5.012 -24.822 1.00 0.00 C ATOM 1275 O GLN A 106 21.216 -4.564 -25.968 1.00 0.00 O ATOM 1276 CB GLN A 106 18.867 -5.981 -24.102 1.00 0.00 C ATOM 1277 CG GLN A 106 17.587 -5.855 -23.249 1.00 0.00 C ATOM 1278 CD GLN A 106 17.859 -5.823 -21.735 1.00 0.00 C ATOM 1279 OE1 GLN A 106 17.884 -6.860 -21.077 1.00 0.00 O ATOM 1280 NE2 GLN A 106 18.071 -4.635 -21.172 1.00 0.00 N ATOM 0 H GLN A 106 18.861 -3.584 -25.453 1.00 0.00 H new ATOM 0 HA GLN A 106 20.114 -4.615 -22.960 1.00 0.00 H new ATOM 0 HB2 GLN A 106 18.582 -6.121 -25.145 1.00 0.00 H new ATOM 0 HB3 GLN A 106 19.407 -6.877 -23.796 1.00 0.00 H new ATOM 0 HG2 GLN A 106 17.058 -4.946 -23.534 1.00 0.00 H new ATOM 0 HG3 GLN A 106 16.926 -6.692 -23.474 1.00 0.00 H new ATOM 0 HE21 GLN A 106 18.045 -3.789 -21.741 1.00 0.00 H new ATOM 0 HE22 GLN A 106 18.260 -4.571 -20.172 1.00 0.00 H new ATOM 1289 N LEU A 107 22.054 -5.739 -24.213 1.00 0.00 N ATOM 1290 CA LEU A 107 23.362 -6.096 -24.816 1.00 0.00 C ATOM 1291 C LEU A 107 23.222 -7.214 -25.891 1.00 0.00 C ATOM 1292 O LEU A 107 23.691 -8.354 -25.744 1.00 0.00 O ATOM 1293 CB LEU A 107 24.405 -6.444 -23.685 1.00 0.00 C ATOM 1294 CG LEU A 107 24.234 -7.773 -22.847 1.00 0.00 C ATOM 1295 CD1 LEU A 107 25.402 -7.960 -21.859 1.00 0.00 C ATOM 1296 CD2 LEU A 107 22.880 -7.851 -22.102 1.00 0.00 C ATOM 0 H LEU A 107 21.938 -6.106 -23.268 1.00 0.00 H new ATOM 0 HA LEU A 107 23.747 -5.230 -25.354 1.00 0.00 H new ATOM 0 HB2 LEU A 107 25.391 -6.476 -24.149 1.00 0.00 H new ATOM 0 HB3 LEU A 107 24.411 -5.613 -22.980 1.00 0.00 H new ATOM 0 HG LEU A 107 24.245 -8.589 -23.569 1.00 0.00 H new ATOM 0 HD11 LEU A 107 25.258 -8.882 -21.296 1.00 0.00 H new ATOM 0 HD12 LEU A 107 26.340 -8.015 -22.411 1.00 0.00 H new ATOM 0 HD13 LEU A 107 25.435 -7.116 -21.170 1.00 0.00 H new ATOM 0 HD21 LEU A 107 22.824 -8.787 -21.546 1.00 0.00 H new ATOM 0 HD22 LEU A 107 22.796 -7.012 -21.411 1.00 0.00 H new ATOM 0 HD23 LEU A 107 22.065 -7.809 -22.824 1.00 0.00 H new ATOM 1308 N ARG A 108 22.568 -6.852 -27.004 1.00 0.00 N ATOM 1309 CA ARG A 108 22.284 -7.777 -28.122 1.00 0.00 C ATOM 1310 C ARG A 108 22.736 -7.173 -29.474 1.00 0.00 C ATOM 1311 O ARG A 108 22.967 -5.950 -29.552 1.00 0.00 O ATOM 1312 CB ARG A 108 20.771 -8.148 -28.161 1.00 0.00 C ATOM 1313 CG ARG A 108 19.819 -6.957 -28.375 1.00 0.00 C ATOM 1314 CD ARG A 108 18.359 -7.395 -28.573 1.00 0.00 C ATOM 1315 NE ARG A 108 18.190 -8.242 -29.778 1.00 0.00 N ATOM 1316 CZ ARG A 108 17.023 -8.544 -30.371 1.00 0.00 C ATOM 1317 NH1 ARG A 108 15.874 -8.068 -29.911 1.00 0.00 N ATOM 1318 NH2 ARG A 108 17.020 -9.334 -31.429 1.00 0.00 N ATOM 1319 OXT ARG A 108 22.862 -7.934 -30.452 1.00 0.00 O ATOM 0 H ARG A 108 22.218 -5.907 -27.159 1.00 0.00 H new ATOM 0 HA ARG A 108 22.856 -8.690 -27.955 1.00 0.00 H new ATOM 0 HB2 ARG A 108 20.609 -8.872 -28.960 1.00 0.00 H new ATOM 0 HB3 ARG A 108 20.508 -8.641 -27.225 1.00 0.00 H new ATOM 0 HG2 ARG A 108 19.881 -6.289 -27.516 1.00 0.00 H new ATOM 0 HG3 ARG A 108 20.145 -6.388 -29.246 1.00 0.00 H new ATOM 0 HD2 ARG A 108 18.023 -7.945 -27.694 1.00 0.00 H new ATOM 0 HD3 ARG A 108 17.725 -6.513 -28.658 1.00 0.00 H new ATOM 0 HE ARG A 108 19.036 -8.631 -30.194 1.00 0.00 H new ATOM 0 HH11 ARG A 108 15.865 -7.460 -29.092 1.00 0.00 H new ATOM 0 HH12 ARG A 108 14.999 -8.310 -30.376 1.00 0.00 H new ATOM 0 HH21 ARG A 108 17.898 -9.709 -31.788 1.00 0.00 H new ATOM 0 HH22 ARG A 108 16.140 -9.570 -31.887 1.00 0.00 H new TER 1333 ARG A 108 HETATM 1334 ZN ZN A 109 -14.570 -23.792 -25.110 1.00 0.00 ZN