USER MOD reduce.3.24.130724 H: found=0, std=0, add=650, rem=0, adj=13 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 Single : A 21 MET CE :methyl 158:sc= -0.154 (180deg=-0.75) USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 27 ASN : amide:sc= 0.128 K(o=0.13,f=-2.9!) USER MOD Single : A 32 ASN : amide:sc= 0.346 X(o=0.35,f=0) USER MOD Single : A 34 GLN : amide:sc= -0.0141 X(o=-0.014,f=-0.36) USER MOD Single : A 36 ASN : amide:sc= -0.042 X(o=-0.042,f=-0.15) USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 38 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot -150:sc= 0.00355 USER MOD Single : A 68 GLN :FLIP amide:sc= -0.061 F(o=-1.1,f=-0.061) USER MOD Single : A 82 HIS : no HD1:sc= -0.0204 X(o=-0.02,f=-0.017) USER MOD Single : A 84 GLN : amide:sc= -2.19! C(o=-2.2!,f=-7.7!) USER MOD Single : A 85 GLN : amide:sc= 0.338 X(o=0.34,f=0) USER MOD Single : A 87 LYS NZ :NH3+ -150:sc= 0.432 (180deg=0.166) USER MOD Single : A 90 GLN : amide:sc= 0.021 X(o=0.021,f=-0.079) USER MOD Single : A 91 LYS NZ :NH3+ -117:sc= -1.16 (180deg=-3.45!) USER MOD Single : A 94 TYR OH : rot 180:sc= 0 USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 ASN : amide:sc= 0.489 K(o=0.49,f=-4.7!) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 SER OG : rot -28:sc= 0.185 USER MOD Single : A 106 GLN : amide:sc= 0.377 X(o=0.38,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 21 2.443 10.162 -15.981 1.00 0.00 N ATOM 2 CA MET A 21 3.326 9.091 -16.495 1.00 0.00 C ATOM 3 C MET A 21 2.750 7.720 -16.112 1.00 0.00 C ATOM 4 O MET A 21 2.301 7.528 -14.972 1.00 0.00 O ATOM 5 CB MET A 21 4.770 9.251 -15.941 1.00 0.00 C ATOM 6 CG MET A 21 5.755 8.153 -16.383 1.00 0.00 C ATOM 7 SD MET A 21 7.409 8.342 -15.671 1.00 0.00 S ATOM 8 CE MET A 21 7.080 8.257 -13.908 1.00 0.00 C ATOM 0 HA MET A 21 3.375 9.167 -17.581 1.00 0.00 H new ATOM 0 HB2 MET A 21 5.160 10.219 -16.257 1.00 0.00 H new ATOM 0 HB3 MET A 21 4.727 9.264 -14.852 1.00 0.00 H new ATOM 0 HG2 MET A 21 5.354 7.180 -16.099 1.00 0.00 H new ATOM 0 HG3 MET A 21 5.832 8.161 -17.470 1.00 0.00 H new ATOM 0 HE1 MET A 21 7.990 7.970 -13.381 1.00 0.00 H new ATOM 0 HE2 MET A 21 6.748 9.232 -13.552 1.00 0.00 H new ATOM 0 HE3 MET A 21 6.302 7.517 -13.718 1.00 0.00 H new ATOM 18 N ALA A 22 2.759 6.785 -17.077 1.00 0.00 N ATOM 19 CA ALA A 22 2.346 5.392 -16.858 1.00 0.00 C ATOM 20 C ALA A 22 3.516 4.614 -16.221 1.00 0.00 C ATOM 21 O ALA A 22 4.455 4.229 -16.909 1.00 0.00 O ATOM 22 CB ALA A 22 1.900 4.757 -18.193 1.00 0.00 C ATOM 0 H ALA A 22 3.055 6.977 -18.034 1.00 0.00 H new ATOM 0 HA ALA A 22 1.495 5.355 -16.177 1.00 0.00 H new ATOM 0 HB1 ALA A 22 1.596 3.725 -18.021 1.00 0.00 H new ATOM 0 HB2 ALA A 22 1.060 5.320 -18.601 1.00 0.00 H new ATOM 0 HB3 ALA A 22 2.729 4.778 -18.901 1.00 0.00 H new ATOM 28 N SER A 23 3.475 4.440 -14.894 1.00 0.00 N ATOM 29 CA SER A 23 4.529 3.738 -14.146 1.00 0.00 C ATOM 30 C SER A 23 3.909 3.087 -12.896 1.00 0.00 C ATOM 31 O SER A 23 3.598 3.774 -11.913 1.00 0.00 O ATOM 32 CB SER A 23 5.669 4.718 -13.765 1.00 0.00 C ATOM 33 OG SER A 23 6.738 4.056 -13.097 1.00 0.00 O ATOM 0 H SER A 23 2.712 4.781 -14.308 1.00 0.00 H new ATOM 0 HA SER A 23 4.966 2.958 -14.770 1.00 0.00 H new ATOM 0 HB2 SER A 23 6.048 5.202 -14.665 1.00 0.00 H new ATOM 0 HB3 SER A 23 5.272 5.505 -13.124 1.00 0.00 H new ATOM 0 HG SER A 23 7.437 4.706 -12.875 1.00 0.00 H new ATOM 39 N GLY A 24 3.685 1.763 -12.975 1.00 0.00 N ATOM 40 CA GLY A 24 3.097 0.992 -11.870 1.00 0.00 C ATOM 41 C GLY A 24 1.882 0.198 -12.317 1.00 0.00 C ATOM 42 O GLY A 24 1.584 -0.859 -11.751 1.00 0.00 O ATOM 0 H GLY A 24 3.905 1.204 -13.799 1.00 0.00 H new ATOM 0 HA2 GLY A 24 3.845 0.312 -11.463 1.00 0.00 H new ATOM 0 HA3 GLY A 24 2.812 1.670 -11.066 1.00 0.00 H new ATOM 46 N TRP A 25 1.193 0.709 -13.355 1.00 0.00 N ATOM 47 CA TRP A 25 -0.051 0.112 -13.896 1.00 0.00 C ATOM 48 C TRP A 25 0.136 -1.377 -14.288 1.00 0.00 C ATOM 49 O TRP A 25 -0.699 -2.221 -13.967 1.00 0.00 O ATOM 50 CB TRP A 25 -0.550 0.950 -15.111 1.00 0.00 C ATOM 51 CG TRP A 25 0.362 0.901 -16.321 1.00 0.00 C ATOM 52 CD1 TRP A 25 1.568 1.524 -16.477 1.00 0.00 C ATOM 53 CD2 TRP A 25 0.135 0.160 -17.527 1.00 0.00 C ATOM 54 NE1 TRP A 25 2.106 1.209 -17.696 1.00 0.00 N ATOM 55 CE2 TRP A 25 1.242 0.376 -18.360 1.00 0.00 C ATOM 56 CE3 TRP A 25 -0.907 -0.658 -17.980 1.00 0.00 C ATOM 57 CZ2 TRP A 25 1.352 -0.211 -19.614 1.00 0.00 C ATOM 58 CZ3 TRP A 25 -0.797 -1.242 -19.227 1.00 0.00 C ATOM 59 CH2 TRP A 25 0.322 -1.014 -20.032 1.00 0.00 C ATOM 0 H TRP A 25 1.483 1.554 -13.848 1.00 0.00 H new ATOM 0 HA TRP A 25 -0.805 0.135 -13.109 1.00 0.00 H new ATOM 0 HB2 TRP A 25 -1.538 0.594 -15.401 1.00 0.00 H new ATOM 0 HB3 TRP A 25 -0.664 1.988 -14.799 1.00 0.00 H new ATOM 0 HD1 TRP A 25 2.030 2.171 -15.745 1.00 0.00 H new ATOM 0 HE1 TRP A 25 3.003 1.540 -18.052 1.00 0.00 H new ATOM 0 HE3 TRP A 25 -1.779 -0.829 -17.367 1.00 0.00 H new ATOM 0 HZ2 TRP A 25 2.217 -0.041 -20.237 1.00 0.00 H new ATOM 0 HZ3 TRP A 25 -1.588 -1.884 -19.585 1.00 0.00 H new ATOM 0 HH2 TRP A 25 0.377 -1.480 -21.005 1.00 0.00 H new ATOM 70 N ALA A 26 1.248 -1.666 -14.989 1.00 0.00 N ATOM 71 CA ALA A 26 1.688 -3.039 -15.333 1.00 0.00 C ATOM 72 C ALA A 26 3.194 -3.195 -15.052 1.00 0.00 C ATOM 73 O ALA A 26 3.780 -4.253 -15.304 1.00 0.00 O ATOM 74 CB ALA A 26 1.367 -3.362 -16.805 1.00 0.00 C ATOM 0 H ALA A 26 1.878 -0.945 -15.339 1.00 0.00 H new ATOM 0 HA ALA A 26 1.143 -3.748 -14.710 1.00 0.00 H new ATOM 0 HB1 ALA A 26 1.698 -4.374 -17.036 1.00 0.00 H new ATOM 0 HB2 ALA A 26 0.292 -3.286 -16.968 1.00 0.00 H new ATOM 0 HB3 ALA A 26 1.883 -2.654 -17.454 1.00 0.00 H new ATOM 80 N ASN A 27 3.813 -2.121 -14.535 1.00 0.00 N ATOM 81 CA ASN A 27 5.228 -2.113 -14.132 1.00 0.00 C ATOM 82 C ASN A 27 5.309 -2.636 -12.694 1.00 0.00 C ATOM 83 O ASN A 27 5.402 -1.861 -11.729 1.00 0.00 O ATOM 84 CB ASN A 27 5.831 -0.681 -14.259 1.00 0.00 C ATOM 85 CG ASN A 27 5.574 -0.037 -15.627 1.00 0.00 C ATOM 86 OD1 ASN A 27 4.557 0.628 -15.820 1.00 0.00 O ATOM 87 ND2 ASN A 27 6.484 -0.223 -16.581 1.00 0.00 N ATOM 0 H ASN A 27 3.342 -1.229 -14.384 1.00 0.00 H new ATOM 0 HA ASN A 27 5.815 -2.756 -14.788 1.00 0.00 H new ATOM 0 HB2 ASN A 27 5.409 -0.046 -13.480 1.00 0.00 H new ATOM 0 HB3 ASN A 27 6.906 -0.729 -14.083 1.00 0.00 H new ATOM 0 HD21 ASN A 27 6.348 0.191 -17.503 1.00 0.00 H new ATOM 0 HD22 ASN A 27 7.317 -0.780 -16.390 1.00 0.00 H new ATOM 94 N ASP A 28 5.188 -3.965 -12.568 1.00 0.00 N ATOM 95 CA ASP A 28 5.142 -4.660 -11.274 1.00 0.00 C ATOM 96 C ASP A 28 5.845 -6.021 -11.389 1.00 0.00 C ATOM 97 O ASP A 28 6.170 -6.486 -12.494 1.00 0.00 O ATOM 98 CB ASP A 28 3.665 -4.835 -10.807 1.00 0.00 C ATOM 99 CG ASP A 28 3.519 -5.251 -9.329 1.00 0.00 C ATOM 100 OD1 ASP A 28 3.630 -4.380 -8.442 1.00 0.00 O ATOM 101 OD2 ASP A 28 3.326 -6.459 -9.053 1.00 0.00 O ATOM 0 H ASP A 28 5.119 -4.593 -13.369 1.00 0.00 H new ATOM 0 HA ASP A 28 5.664 -4.062 -10.527 1.00 0.00 H new ATOM 0 HB2 ASP A 28 3.132 -3.897 -10.964 1.00 0.00 H new ATOM 0 HB3 ASP A 28 3.183 -5.585 -11.434 1.00 0.00 H new ATOM 106 N ASP A 29 6.034 -6.665 -10.237 1.00 0.00 N ATOM 107 CA ASP A 29 6.812 -7.908 -10.096 1.00 0.00 C ATOM 108 C ASP A 29 5.984 -9.123 -10.542 1.00 0.00 C ATOM 109 O ASP A 29 6.464 -9.996 -11.280 1.00 0.00 O ATOM 110 CB ASP A 29 7.246 -8.067 -8.618 1.00 0.00 C ATOM 111 CG ASP A 29 8.232 -9.219 -8.377 1.00 0.00 C ATOM 112 OD1 ASP A 29 9.439 -9.034 -8.637 1.00 0.00 O ATOM 113 OD2 ASP A 29 7.821 -10.299 -7.904 1.00 0.00 O ATOM 0 H ASP A 29 5.645 -6.335 -9.354 1.00 0.00 H new ATOM 0 HA ASP A 29 7.694 -7.852 -10.734 1.00 0.00 H new ATOM 0 HB2 ASP A 29 7.702 -7.136 -8.282 1.00 0.00 H new ATOM 0 HB3 ASP A 29 6.359 -8.227 -8.005 1.00 0.00 H new ATOM 118 N ALA A 30 4.712 -9.128 -10.117 1.00 0.00 N ATOM 119 CA ALA A 30 3.774 -10.238 -10.366 1.00 0.00 C ATOM 120 C ALA A 30 3.191 -10.210 -11.806 1.00 0.00 C ATOM 121 O ALA A 30 2.332 -11.026 -12.150 1.00 0.00 O ATOM 122 CB ALA A 30 2.664 -10.203 -9.306 1.00 0.00 C ATOM 0 H ALA A 30 4.301 -8.359 -9.588 1.00 0.00 H new ATOM 0 HA ALA A 30 4.321 -11.177 -10.286 1.00 0.00 H new ATOM 0 HB1 ALA A 30 1.966 -11.021 -9.483 1.00 0.00 H new ATOM 0 HB2 ALA A 30 3.104 -10.310 -8.315 1.00 0.00 H new ATOM 0 HB3 ALA A 30 2.133 -9.253 -9.367 1.00 0.00 H new ATOM 128 N VAL A 31 3.684 -9.284 -12.645 1.00 0.00 N ATOM 129 CA VAL A 31 3.290 -9.166 -14.076 1.00 0.00 C ATOM 130 C VAL A 31 4.225 -10.045 -14.933 1.00 0.00 C ATOM 131 O VAL A 31 3.812 -10.624 -15.951 1.00 0.00 O ATOM 132 CB VAL A 31 3.321 -7.674 -14.571 1.00 0.00 C ATOM 133 CG1 VAL A 31 2.926 -7.550 -16.070 1.00 0.00 C ATOM 134 CG2 VAL A 31 2.415 -6.785 -13.687 1.00 0.00 C ATOM 0 H VAL A 31 4.372 -8.588 -12.357 1.00 0.00 H new ATOM 0 HA VAL A 31 2.262 -9.513 -14.181 1.00 0.00 H new ATOM 0 HB VAL A 31 4.348 -7.322 -14.478 1.00 0.00 H new ATOM 0 HG11 VAL A 31 2.961 -6.503 -16.370 1.00 0.00 H new ATOM 0 HG12 VAL A 31 3.624 -8.125 -16.679 1.00 0.00 H new ATOM 0 HG13 VAL A 31 1.916 -7.935 -16.213 1.00 0.00 H new ATOM 0 HG21 VAL A 31 2.451 -5.757 -14.047 1.00 0.00 H new ATOM 0 HG22 VAL A 31 1.389 -7.150 -13.735 1.00 0.00 H new ATOM 0 HG23 VAL A 31 2.765 -6.821 -12.655 1.00 0.00 H new ATOM 144 N ASN A 32 5.488 -10.158 -14.480 1.00 0.00 N ATOM 145 CA ASN A 32 6.456 -11.148 -15.009 1.00 0.00 C ATOM 146 C ASN A 32 5.932 -12.575 -14.728 1.00 0.00 C ATOM 147 O ASN A 32 6.189 -13.510 -15.482 1.00 0.00 O ATOM 148 CB ASN A 32 7.851 -10.928 -14.346 1.00 0.00 C ATOM 149 CG ASN A 32 8.942 -11.883 -14.857 1.00 0.00 C ATOM 150 OD1 ASN A 32 9.628 -11.590 -15.834 1.00 0.00 O ATOM 151 ND2 ASN A 32 9.116 -13.024 -14.196 1.00 0.00 N ATOM 0 H ASN A 32 5.869 -9.569 -13.739 1.00 0.00 H new ATOM 0 HA ASN A 32 6.565 -11.020 -16.086 1.00 0.00 H new ATOM 0 HB2 ASN A 32 8.169 -9.901 -14.524 1.00 0.00 H new ATOM 0 HB3 ASN A 32 7.753 -11.049 -13.267 1.00 0.00 H new ATOM 0 HD21 ASN A 32 9.834 -13.683 -14.497 1.00 0.00 H new ATOM 0 HD22 ASN A 32 8.531 -13.240 -13.389 1.00 0.00 H new ATOM 158 N GLU A 33 5.164 -12.692 -13.633 1.00 0.00 N ATOM 159 CA GLU A 33 4.560 -13.949 -13.159 1.00 0.00 C ATOM 160 C GLU A 33 3.175 -14.182 -13.791 1.00 0.00 C ATOM 161 O GLU A 33 2.682 -15.317 -13.833 1.00 0.00 O ATOM 162 CB GLU A 33 4.453 -13.868 -11.621 1.00 0.00 C ATOM 163 CG GLU A 33 5.783 -13.482 -10.944 1.00 0.00 C ATOM 164 CD GLU A 33 6.869 -14.571 -11.073 1.00 0.00 C ATOM 165 OE1 GLU A 33 7.623 -14.570 -12.076 1.00 0.00 O ATOM 166 OE2 GLU A 33 6.974 -15.437 -10.180 1.00 0.00 O ATOM 0 H GLU A 33 4.940 -11.895 -13.037 1.00 0.00 H new ATOM 0 HA GLU A 33 5.184 -14.792 -13.454 1.00 0.00 H new ATOM 0 HB2 GLU A 33 3.690 -13.137 -11.353 1.00 0.00 H new ATOM 0 HB3 GLU A 33 4.121 -14.831 -11.234 1.00 0.00 H new ATOM 0 HG2 GLU A 33 6.152 -12.556 -11.385 1.00 0.00 H new ATOM 0 HG3 GLU A 33 5.601 -13.282 -9.888 1.00 0.00 H new ATOM 173 N GLN A 34 2.550 -13.086 -14.252 1.00 0.00 N ATOM 174 CA GLN A 34 1.296 -13.134 -15.027 1.00 0.00 C ATOM 175 C GLN A 34 1.549 -13.811 -16.394 1.00 0.00 C ATOM 176 O GLN A 34 0.702 -14.557 -16.908 1.00 0.00 O ATOM 177 CB GLN A 34 0.739 -11.693 -15.218 1.00 0.00 C ATOM 178 CG GLN A 34 -0.671 -11.610 -15.841 1.00 0.00 C ATOM 179 CD GLN A 34 -1.776 -12.219 -14.963 1.00 0.00 C ATOM 180 OE1 GLN A 34 -1.704 -12.193 -13.729 1.00 0.00 O ATOM 181 NE2 GLN A 34 -2.816 -12.761 -15.591 1.00 0.00 N ATOM 0 H GLN A 34 2.899 -12.140 -14.098 1.00 0.00 H new ATOM 0 HA GLN A 34 0.556 -13.721 -14.484 1.00 0.00 H new ATOM 0 HB2 GLN A 34 0.720 -11.197 -14.248 1.00 0.00 H new ATOM 0 HB3 GLN A 34 1.431 -11.134 -15.848 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -0.910 -10.565 -16.036 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -0.663 -12.121 -16.804 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -2.849 -12.768 -16.610 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -3.581 -13.169 -15.053 1.00 0.00 H new ATOM 190 N ILE A 35 2.735 -13.523 -16.967 1.00 0.00 N ATOM 191 CA ILE A 35 3.229 -14.174 -18.189 1.00 0.00 C ATOM 192 C ILE A 35 3.887 -15.525 -17.793 1.00 0.00 C ATOM 193 O ILE A 35 3.285 -16.591 -17.984 1.00 0.00 O ATOM 194 CB ILE A 35 4.247 -13.235 -18.944 1.00 0.00 C ATOM 195 CG1 ILE A 35 3.588 -11.845 -19.244 1.00 0.00 C ATOM 196 CG2 ILE A 35 4.786 -13.898 -20.238 1.00 0.00 C ATOM 197 CD1 ILE A 35 4.524 -10.801 -19.848 1.00 0.00 C ATOM 0 H ILE A 35 3.378 -12.827 -16.590 1.00 0.00 H new ATOM 0 HA ILE A 35 2.403 -14.364 -18.874 1.00 0.00 H new ATOM 0 HB ILE A 35 5.104 -13.073 -18.291 1.00 0.00 H new ATOM 0 HG12 ILE A 35 2.751 -11.997 -19.925 1.00 0.00 H new ATOM 0 HG13 ILE A 35 3.176 -11.448 -18.316 1.00 0.00 H new ATOM 0 HG21 ILE A 35 5.484 -13.221 -20.730 1.00 0.00 H new ATOM 0 HG22 ILE A 35 5.298 -14.826 -19.985 1.00 0.00 H new ATOM 0 HG23 ILE A 35 3.955 -14.114 -20.910 1.00 0.00 H new ATOM 0 HD11 ILE A 35 3.975 -9.875 -20.019 1.00 0.00 H new ATOM 0 HD12 ILE A 35 5.349 -10.612 -19.162 1.00 0.00 H new ATOM 0 HD13 ILE A 35 4.917 -11.170 -20.796 1.00 0.00 H new ATOM 209 N ASN A 36 5.116 -15.445 -17.216 1.00 0.00 N ATOM 210 CA ASN A 36 5.858 -16.594 -16.625 1.00 0.00 C ATOM 211 C ASN A 36 6.097 -17.741 -17.649 1.00 0.00 C ATOM 212 O ASN A 36 6.339 -18.896 -17.286 1.00 0.00 O ATOM 213 CB ASN A 36 5.119 -17.074 -15.334 1.00 0.00 C ATOM 214 CG ASN A 36 5.992 -17.899 -14.386 1.00 0.00 C ATOM 215 OD1 ASN A 36 5.996 -19.124 -14.431 1.00 0.00 O ATOM 216 ND2 ASN A 36 6.753 -17.222 -13.527 1.00 0.00 N ATOM 0 H ASN A 36 5.628 -14.566 -17.147 1.00 0.00 H new ATOM 0 HA ASN A 36 6.857 -16.260 -16.345 1.00 0.00 H new ATOM 0 HB2 ASN A 36 4.742 -16.203 -14.798 1.00 0.00 H new ATOM 0 HB3 ASN A 36 4.253 -17.669 -15.624 1.00 0.00 H new ATOM 0 HD21 ASN A 36 7.363 -17.723 -12.881 1.00 0.00 H new ATOM 0 HD22 ASN A 36 6.726 -16.202 -13.516 1.00 0.00 H new ATOM 223 N SER A 37 6.115 -17.374 -18.942 1.00 0.00 N ATOM 224 CA SER A 37 6.231 -18.328 -20.065 1.00 0.00 C ATOM 225 C SER A 37 7.651 -18.926 -20.207 1.00 0.00 C ATOM 226 O SER A 37 7.860 -19.823 -21.012 1.00 0.00 O ATOM 227 CB SER A 37 5.797 -17.626 -21.370 1.00 0.00 C ATOM 228 OG SER A 37 4.484 -17.092 -21.249 1.00 0.00 O ATOM 0 H SER A 37 6.049 -16.401 -19.242 1.00 0.00 H new ATOM 0 HA SER A 37 5.572 -19.171 -19.856 1.00 0.00 H new ATOM 0 HB2 SER A 37 6.498 -16.826 -21.607 1.00 0.00 H new ATOM 0 HB3 SER A 37 5.830 -18.335 -22.197 1.00 0.00 H new ATOM 0 HG SER A 37 4.232 -16.651 -22.087 1.00 0.00 H new ATOM 234 N THR A 38 8.609 -18.454 -19.394 1.00 0.00 N ATOM 235 CA THR A 38 9.988 -18.978 -19.398 1.00 0.00 C ATOM 236 C THR A 38 10.019 -20.482 -19.011 1.00 0.00 C ATOM 237 O THR A 38 10.875 -21.246 -19.474 1.00 0.00 O ATOM 238 CB THR A 38 10.886 -18.162 -18.420 1.00 0.00 C ATOM 239 OG1 THR A 38 10.703 -16.758 -18.656 1.00 0.00 O ATOM 240 CG2 THR A 38 12.375 -18.520 -18.581 1.00 0.00 C ATOM 0 H THR A 38 8.454 -17.705 -18.720 1.00 0.00 H new ATOM 0 HA THR A 38 10.378 -18.875 -20.411 1.00 0.00 H new ATOM 0 HB THR A 38 10.587 -18.414 -17.402 1.00 0.00 H new ATOM 0 HG1 THR A 38 11.267 -16.246 -18.039 1.00 0.00 H new ATOM 0 HG21 THR A 38 12.969 -17.930 -17.882 1.00 0.00 H new ATOM 0 HG22 THR A 38 12.519 -19.581 -18.374 1.00 0.00 H new ATOM 0 HG23 THR A 38 12.693 -18.303 -19.601 1.00 0.00 H new ATOM 248 N ILE A 39 9.046 -20.879 -18.175 1.00 0.00 N ATOM 249 CA ILE A 39 8.911 -22.256 -17.674 1.00 0.00 C ATOM 250 C ILE A 39 8.444 -23.195 -18.809 1.00 0.00 C ATOM 251 O ILE A 39 8.876 -24.357 -18.883 1.00 0.00 O ATOM 252 CB ILE A 39 7.912 -22.313 -16.452 1.00 0.00 C ATOM 253 CG1 ILE A 39 8.278 -21.223 -15.384 1.00 0.00 C ATOM 254 CG2 ILE A 39 7.856 -23.727 -15.816 1.00 0.00 C ATOM 255 CD1 ILE A 39 9.688 -21.300 -14.828 1.00 0.00 C ATOM 0 H ILE A 39 8.325 -20.248 -17.825 1.00 0.00 H new ATOM 0 HA ILE A 39 9.887 -22.594 -17.325 1.00 0.00 H new ATOM 0 HB ILE A 39 6.914 -22.096 -16.833 1.00 0.00 H new ATOM 0 HG12 ILE A 39 8.136 -20.239 -15.831 1.00 0.00 H new ATOM 0 HG13 ILE A 39 7.575 -21.301 -14.555 1.00 0.00 H new ATOM 0 HG21 ILE A 39 7.157 -23.722 -14.979 1.00 0.00 H new ATOM 0 HG22 ILE A 39 7.524 -24.449 -16.562 1.00 0.00 H new ATOM 0 HG23 ILE A 39 8.848 -24.005 -15.459 1.00 0.00 H new ATOM 0 HD11 ILE A 39 9.836 -20.503 -14.100 1.00 0.00 H new ATOM 0 HD12 ILE A 39 9.836 -22.266 -14.344 1.00 0.00 H new ATOM 0 HD13 ILE A 39 10.406 -21.187 -15.640 1.00 0.00 H new ATOM 267 N GLU A 40 7.607 -22.666 -19.723 1.00 0.00 N ATOM 268 CA GLU A 40 7.072 -23.460 -20.854 1.00 0.00 C ATOM 269 C GLU A 40 8.129 -23.540 -21.979 1.00 0.00 C ATOM 270 O GLU A 40 8.149 -24.507 -22.743 1.00 0.00 O ATOM 271 CB GLU A 40 5.710 -22.888 -21.378 1.00 0.00 C ATOM 272 CG GLU A 40 5.807 -21.676 -22.330 1.00 0.00 C ATOM 273 CD GLU A 40 4.437 -21.151 -22.789 1.00 0.00 C ATOM 274 OE1 GLU A 40 3.744 -20.482 -21.986 1.00 0.00 O ATOM 275 OE2 GLU A 40 4.038 -21.414 -23.943 1.00 0.00 O ATOM 0 H GLU A 40 7.286 -21.698 -19.703 1.00 0.00 H new ATOM 0 HA GLU A 40 6.863 -24.469 -20.499 1.00 0.00 H new ATOM 0 HB2 GLU A 40 5.177 -23.687 -21.893 1.00 0.00 H new ATOM 0 HB3 GLU A 40 5.104 -22.602 -20.518 1.00 0.00 H new ATOM 0 HG2 GLU A 40 6.347 -20.872 -21.830 1.00 0.00 H new ATOM 0 HG3 GLU A 40 6.393 -21.957 -23.205 1.00 0.00 H new ATOM 282 N ASP A 41 9.006 -22.508 -22.054 1.00 0.00 N ATOM 283 CA ASP A 41 10.195 -22.502 -22.942 1.00 0.00 C ATOM 284 C ASP A 41 11.200 -23.571 -22.499 1.00 0.00 C ATOM 285 O ASP A 41 11.824 -24.237 -23.334 1.00 0.00 O ATOM 286 CB ASP A 41 10.897 -21.115 -22.945 1.00 0.00 C ATOM 287 CG ASP A 41 10.067 -20.012 -23.623 1.00 0.00 C ATOM 288 OD1 ASP A 41 9.765 -20.145 -24.821 1.00 0.00 O ATOM 289 OD2 ASP A 41 9.762 -18.987 -22.982 1.00 0.00 O ATOM 0 H ASP A 41 8.909 -21.657 -21.501 1.00 0.00 H new ATOM 0 HA ASP A 41 9.846 -22.719 -23.951 1.00 0.00 H new ATOM 0 HB2 ASP A 41 11.108 -20.821 -21.917 1.00 0.00 H new ATOM 0 HB3 ASP A 41 11.856 -21.203 -23.455 1.00 0.00 H new ATOM 294 N ALA A 42 11.337 -23.714 -21.162 1.00 0.00 N ATOM 295 CA ALA A 42 12.206 -24.726 -20.533 1.00 0.00 C ATOM 296 C ALA A 42 11.739 -26.149 -20.912 1.00 0.00 C ATOM 297 O ALA A 42 12.557 -27.018 -21.218 1.00 0.00 O ATOM 298 CB ALA A 42 12.237 -24.533 -18.998 1.00 0.00 C ATOM 0 H ALA A 42 10.845 -23.127 -20.489 1.00 0.00 H new ATOM 0 HA ALA A 42 13.222 -24.598 -20.906 1.00 0.00 H new ATOM 0 HB1 ALA A 42 12.883 -25.288 -18.549 1.00 0.00 H new ATOM 0 HB2 ALA A 42 12.622 -23.541 -18.764 1.00 0.00 H new ATOM 0 HB3 ALA A 42 11.228 -24.634 -18.598 1.00 0.00 H new ATOM 304 N ILE A 43 10.405 -26.356 -20.926 1.00 0.00 N ATOM 305 CA ILE A 43 9.781 -27.640 -21.324 1.00 0.00 C ATOM 306 C ILE A 43 9.896 -27.859 -22.854 1.00 0.00 C ATOM 307 O ILE A 43 10.098 -28.996 -23.325 1.00 0.00 O ATOM 308 CB ILE A 43 8.269 -27.709 -20.868 1.00 0.00 C ATOM 309 CG1 ILE A 43 8.138 -27.570 -19.316 1.00 0.00 C ATOM 310 CG2 ILE A 43 7.573 -29.003 -21.364 1.00 0.00 C ATOM 311 CD1 ILE A 43 8.800 -28.680 -18.507 1.00 0.00 C ATOM 0 H ILE A 43 9.729 -25.639 -20.662 1.00 0.00 H new ATOM 0 HA ILE A 43 10.322 -28.440 -20.819 1.00 0.00 H new ATOM 0 HB ILE A 43 7.759 -26.864 -21.330 1.00 0.00 H new ATOM 0 HG12 ILE A 43 8.570 -26.616 -19.015 1.00 0.00 H new ATOM 0 HG13 ILE A 43 7.079 -27.536 -19.058 1.00 0.00 H new ATOM 0 HG21 ILE A 43 6.536 -29.010 -21.029 1.00 0.00 H new ATOM 0 HG22 ILE A 43 7.602 -29.037 -22.453 1.00 0.00 H new ATOM 0 HG23 ILE A 43 8.091 -29.873 -20.959 1.00 0.00 H new ATOM 0 HD11 ILE A 43 8.653 -28.492 -17.443 1.00 0.00 H new ATOM 0 HD12 ILE A 43 8.354 -29.639 -18.771 1.00 0.00 H new ATOM 0 HD13 ILE A 43 9.867 -28.704 -18.727 1.00 0.00 H new ATOM 323 N ALA A 44 9.788 -26.760 -23.616 1.00 0.00 N ATOM 324 CA ALA A 44 9.848 -26.783 -25.089 1.00 0.00 C ATOM 325 C ALA A 44 11.237 -27.219 -25.603 1.00 0.00 C ATOM 326 O ALA A 44 11.343 -27.822 -26.673 1.00 0.00 O ATOM 327 CB ALA A 44 9.467 -25.408 -25.652 1.00 0.00 C ATOM 0 H ALA A 44 9.656 -25.826 -23.228 1.00 0.00 H new ATOM 0 HA ALA A 44 9.130 -27.524 -25.441 1.00 0.00 H new ATOM 0 HB1 ALA A 44 9.514 -25.435 -26.741 1.00 0.00 H new ATOM 0 HB2 ALA A 44 8.454 -25.155 -25.339 1.00 0.00 H new ATOM 0 HB3 ALA A 44 10.162 -24.656 -25.277 1.00 0.00 H new ATOM 333 N ARG A 45 12.301 -26.884 -24.846 1.00 0.00 N ATOM 334 CA ARG A 45 13.675 -27.348 -25.154 1.00 0.00 C ATOM 335 C ARG A 45 14.023 -28.653 -24.400 1.00 0.00 C ATOM 336 O ARG A 45 14.988 -29.340 -24.763 1.00 0.00 O ATOM 337 CB ARG A 45 14.710 -26.235 -24.837 1.00 0.00 C ATOM 338 CG ARG A 45 14.829 -25.844 -23.346 1.00 0.00 C ATOM 339 CD ARG A 45 15.969 -24.843 -23.093 1.00 0.00 C ATOM 340 NE ARG A 45 17.282 -25.397 -23.493 1.00 0.00 N ATOM 341 CZ ARG A 45 18.437 -24.717 -23.531 1.00 0.00 C ATOM 342 NH1 ARG A 45 18.493 -23.437 -23.171 1.00 0.00 N ATOM 343 NH2 ARG A 45 19.539 -25.328 -23.942 1.00 0.00 N ATOM 0 H ARG A 45 12.238 -26.294 -24.016 1.00 0.00 H new ATOM 0 HA ARG A 45 13.717 -27.569 -26.221 1.00 0.00 H new ATOM 0 HB2 ARG A 45 15.689 -26.562 -25.188 1.00 0.00 H new ATOM 0 HB3 ARG A 45 14.447 -25.345 -25.409 1.00 0.00 H new ATOM 0 HG2 ARG A 45 13.887 -25.410 -23.010 1.00 0.00 H new ATOM 0 HG3 ARG A 45 14.997 -26.741 -22.750 1.00 0.00 H new ATOM 0 HD2 ARG A 45 15.777 -23.925 -23.648 1.00 0.00 H new ATOM 0 HD3 ARG A 45 15.993 -24.578 -22.036 1.00 0.00 H new ATOM 0 HE ARG A 45 17.311 -26.380 -23.763 1.00 0.00 H new ATOM 0 HH11 ARG A 45 17.648 -22.957 -22.860 1.00 0.00 H new ATOM 0 HH12 ARG A 45 19.381 -22.936 -23.206 1.00 0.00 H new ATOM 0 HH21 ARG A 45 19.504 -26.307 -24.226 1.00 0.00 H new ATOM 0 HH22 ARG A 45 20.422 -24.819 -23.974 1.00 0.00 H new ATOM 357 N ALA A 46 13.245 -28.980 -23.338 1.00 0.00 N ATOM 358 CA ALA A 46 13.477 -30.188 -22.514 1.00 0.00 C ATOM 359 C ALA A 46 13.147 -31.464 -23.305 1.00 0.00 C ATOM 360 O ALA A 46 13.986 -32.358 -23.435 1.00 0.00 O ATOM 361 CB ALA A 46 12.655 -30.146 -21.213 1.00 0.00 C ATOM 0 H ALA A 46 12.449 -28.420 -23.033 1.00 0.00 H new ATOM 0 HA ALA A 46 14.534 -30.203 -22.250 1.00 0.00 H new ATOM 0 HB1 ALA A 46 12.848 -31.047 -20.631 1.00 0.00 H new ATOM 0 HB2 ALA A 46 12.940 -29.270 -20.631 1.00 0.00 H new ATOM 0 HB3 ALA A 46 11.594 -30.091 -21.455 1.00 0.00 H new ATOM 367 N ARG A 47 11.913 -31.526 -23.840 1.00 0.00 N ATOM 368 CA ARG A 47 11.413 -32.717 -24.567 1.00 0.00 C ATOM 369 C ARG A 47 10.638 -32.329 -25.846 1.00 0.00 C ATOM 370 O ARG A 47 10.037 -33.201 -26.490 1.00 0.00 O ATOM 371 CB ARG A 47 10.512 -33.570 -23.626 1.00 0.00 C ATOM 372 CG ARG A 47 9.254 -32.837 -23.113 1.00 0.00 C ATOM 373 CD ARG A 47 8.273 -33.774 -22.379 1.00 0.00 C ATOM 374 NE ARG A 47 8.801 -34.270 -21.092 1.00 0.00 N ATOM 375 CZ ARG A 47 8.709 -35.533 -20.642 1.00 0.00 C ATOM 376 NH1 ARG A 47 8.275 -36.521 -21.430 1.00 0.00 N ATOM 377 NH2 ARG A 47 9.090 -35.806 -19.405 1.00 0.00 N ATOM 0 H ARG A 47 11.238 -30.763 -23.784 1.00 0.00 H new ATOM 0 HA ARG A 47 12.276 -33.306 -24.877 1.00 0.00 H new ATOM 0 HB2 ARG A 47 10.202 -34.470 -24.157 1.00 0.00 H new ATOM 0 HB3 ARG A 47 11.104 -33.893 -22.770 1.00 0.00 H new ATOM 0 HG2 ARG A 47 9.556 -32.035 -22.439 1.00 0.00 H new ATOM 0 HG3 ARG A 47 8.742 -32.370 -23.955 1.00 0.00 H new ATOM 0 HD2 ARG A 47 7.337 -33.244 -22.201 1.00 0.00 H new ATOM 0 HD3 ARG A 47 8.041 -34.623 -23.022 1.00 0.00 H new ATOM 0 HE ARG A 47 9.277 -33.596 -20.493 1.00 0.00 H new ATOM 0 HH11 ARG A 47 8.006 -36.324 -22.394 1.00 0.00 H new ATOM 0 HH12 ARG A 47 8.213 -37.472 -21.068 1.00 0.00 H new ATOM 0 HH21 ARG A 47 9.448 -35.062 -18.806 1.00 0.00 H new ATOM 0 HH22 ARG A 47 9.026 -36.760 -19.050 1.00 0.00 H new ATOM 391 N GLY A 48 10.664 -31.029 -26.209 1.00 0.00 N ATOM 392 CA GLY A 48 9.966 -30.530 -27.410 1.00 0.00 C ATOM 393 C GLY A 48 8.448 -30.653 -27.328 1.00 0.00 C ATOM 394 O GLY A 48 7.778 -30.872 -28.343 1.00 0.00 O ATOM 0 H GLY A 48 11.161 -30.307 -25.687 1.00 0.00 H new ATOM 0 HA2 GLY A 48 10.230 -29.484 -27.565 1.00 0.00 H new ATOM 0 HA3 GLY A 48 10.320 -31.081 -28.281 1.00 0.00 H new ATOM 398 N GLU A 49 7.918 -30.515 -26.103 1.00 0.00 N ATOM 399 CA GLU A 49 6.486 -30.709 -25.809 1.00 0.00 C ATOM 400 C GLU A 49 5.668 -29.468 -26.206 1.00 0.00 C ATOM 401 O GLU A 49 4.767 -29.545 -27.053 1.00 0.00 O ATOM 402 CB GLU A 49 6.301 -31.008 -24.304 1.00 0.00 C ATOM 403 CG GLU A 49 4.846 -31.273 -23.852 1.00 0.00 C ATOM 404 CD GLU A 49 4.729 -31.515 -22.335 1.00 0.00 C ATOM 405 OE1 GLU A 49 5.012 -32.642 -21.881 1.00 0.00 O ATOM 406 OE2 GLU A 49 4.373 -30.575 -21.593 1.00 0.00 O ATOM 0 H GLU A 49 8.471 -30.265 -25.284 1.00 0.00 H new ATOM 0 HA GLU A 49 6.123 -31.554 -26.395 1.00 0.00 H new ATOM 0 HB2 GLU A 49 6.907 -31.877 -24.047 1.00 0.00 H new ATOM 0 HB3 GLU A 49 6.693 -30.166 -23.733 1.00 0.00 H new ATOM 0 HG2 GLU A 49 4.223 -30.422 -24.129 1.00 0.00 H new ATOM 0 HG3 GLU A 49 4.457 -32.140 -24.385 1.00 0.00 H new ATOM 413 N ILE A 50 6.004 -28.327 -25.575 1.00 0.00 N ATOM 414 CA ILE A 50 5.280 -27.063 -25.753 1.00 0.00 C ATOM 415 C ILE A 50 5.558 -26.487 -27.164 1.00 0.00 C ATOM 416 O ILE A 50 6.725 -26.409 -27.573 1.00 0.00 O ATOM 417 CB ILE A 50 5.678 -26.025 -24.632 1.00 0.00 C ATOM 418 CG1 ILE A 50 5.356 -26.594 -23.206 1.00 0.00 C ATOM 419 CG2 ILE A 50 5.004 -24.648 -24.847 1.00 0.00 C ATOM 420 CD1 ILE A 50 3.894 -26.944 -22.955 1.00 0.00 C ATOM 0 H ILE A 50 6.788 -28.260 -24.926 1.00 0.00 H new ATOM 0 HA ILE A 50 4.211 -27.257 -25.661 1.00 0.00 H new ATOM 0 HB ILE A 50 6.754 -25.867 -24.704 1.00 0.00 H new ATOM 0 HG12 ILE A 50 5.958 -27.488 -23.046 1.00 0.00 H new ATOM 0 HG13 ILE A 50 5.669 -25.861 -22.462 1.00 0.00 H new ATOM 0 HG21 ILE A 50 5.307 -23.967 -24.052 1.00 0.00 H new ATOM 0 HG22 ILE A 50 5.309 -24.240 -25.811 1.00 0.00 H new ATOM 0 HG23 ILE A 50 3.921 -24.767 -24.830 1.00 0.00 H new ATOM 0 HD11 ILE A 50 3.781 -27.328 -21.941 1.00 0.00 H new ATOM 0 HD12 ILE A 50 3.280 -26.051 -23.076 1.00 0.00 H new ATOM 0 HD13 ILE A 50 3.574 -27.703 -23.668 1.00 0.00 H new ATOM 432 N PRO A 51 4.489 -26.116 -27.944 1.00 0.00 N ATOM 433 CA PRO A 51 4.656 -25.493 -29.276 1.00 0.00 C ATOM 434 C PRO A 51 5.232 -24.067 -29.174 1.00 0.00 C ATOM 435 O PRO A 51 5.250 -23.466 -28.093 1.00 0.00 O ATOM 436 CB PRO A 51 3.223 -25.510 -29.864 1.00 0.00 C ATOM 437 CG PRO A 51 2.333 -25.471 -28.665 1.00 0.00 C ATOM 438 CD PRO A 51 3.049 -26.272 -27.594 1.00 0.00 C ATOM 0 HA PRO A 51 5.370 -26.023 -29.906 1.00 0.00 H new ATOM 0 HB2 PRO A 51 3.050 -24.654 -30.516 1.00 0.00 H new ATOM 0 HB3 PRO A 51 3.048 -26.405 -30.461 1.00 0.00 H new ATOM 0 HG2 PRO A 51 2.162 -24.445 -28.338 1.00 0.00 H new ATOM 0 HG3 PRO A 51 1.357 -25.901 -28.888 1.00 0.00 H new ATOM 0 HD2 PRO A 51 2.835 -25.889 -26.596 1.00 0.00 H new ATOM 0 HD3 PRO A 51 2.745 -27.319 -27.605 1.00 0.00 H new ATOM 446 N ARG A 52 5.669 -23.522 -30.314 1.00 0.00 N ATOM 447 CA ARG A 52 6.394 -22.231 -30.369 1.00 0.00 C ATOM 448 C ARG A 52 5.425 -21.027 -30.524 1.00 0.00 C ATOM 449 O ARG A 52 5.830 -19.941 -30.956 1.00 0.00 O ATOM 450 CB ARG A 52 7.441 -22.283 -31.524 1.00 0.00 C ATOM 451 CG ARG A 52 8.461 -23.444 -31.398 1.00 0.00 C ATOM 452 CD ARG A 52 9.535 -23.444 -32.508 1.00 0.00 C ATOM 453 NE ARG A 52 8.969 -23.646 -33.863 1.00 0.00 N ATOM 454 CZ ARG A 52 9.411 -24.549 -34.763 1.00 0.00 C ATOM 455 NH1 ARG A 52 10.371 -25.420 -34.446 1.00 0.00 N ATOM 456 NH2 ARG A 52 8.880 -24.585 -35.977 1.00 0.00 N ATOM 0 H ARG A 52 5.535 -23.956 -31.227 1.00 0.00 H new ATOM 0 HA ARG A 52 6.914 -22.079 -29.423 1.00 0.00 H new ATOM 0 HB2 ARG A 52 6.915 -22.377 -32.474 1.00 0.00 H new ATOM 0 HB3 ARG A 52 7.983 -21.338 -31.552 1.00 0.00 H new ATOM 0 HG2 ARG A 52 8.953 -23.381 -30.427 1.00 0.00 H new ATOM 0 HG3 ARG A 52 7.925 -24.393 -31.422 1.00 0.00 H new ATOM 0 HD2 ARG A 52 10.075 -22.497 -32.483 1.00 0.00 H new ATOM 0 HD3 ARG A 52 10.261 -24.230 -32.303 1.00 0.00 H new ATOM 0 HE ARG A 52 8.183 -23.056 -34.137 1.00 0.00 H new ATOM 0 HH11 ARG A 52 10.781 -25.409 -33.512 1.00 0.00 H new ATOM 0 HH12 ARG A 52 10.694 -26.097 -35.137 1.00 0.00 H new ATOM 0 HH21 ARG A 52 8.139 -23.931 -36.229 1.00 0.00 H new ATOM 0 HH22 ARG A 52 9.212 -25.267 -36.659 1.00 0.00 H new ATOM 470 N GLY A 53 4.159 -21.226 -30.107 1.00 0.00 N ATOM 471 CA GLY A 53 3.131 -20.184 -30.149 1.00 0.00 C ATOM 472 C GLY A 53 2.229 -20.337 -31.360 1.00 0.00 C ATOM 473 O GLY A 53 2.342 -19.569 -32.323 1.00 0.00 O ATOM 0 H GLY A 53 3.827 -22.115 -29.733 1.00 0.00 H new ATOM 0 HA2 GLY A 53 2.531 -20.227 -29.240 1.00 0.00 H new ATOM 0 HA3 GLY A 53 3.607 -19.204 -30.171 1.00 0.00 H new ATOM 477 N GLU A 54 1.337 -21.342 -31.317 1.00 0.00 N ATOM 478 CA GLU A 54 0.419 -21.653 -32.434 1.00 0.00 C ATOM 479 C GLU A 54 -0.903 -22.265 -31.913 1.00 0.00 C ATOM 480 O GLU A 54 -1.126 -22.353 -30.702 1.00 0.00 O ATOM 481 CB GLU A 54 1.106 -22.612 -33.446 1.00 0.00 C ATOM 482 CG GLU A 54 1.421 -24.010 -32.875 1.00 0.00 C ATOM 483 CD GLU A 54 2.164 -24.926 -33.860 1.00 0.00 C ATOM 484 OE1 GLU A 54 1.652 -25.157 -34.972 1.00 0.00 O ATOM 485 OE2 GLU A 54 3.265 -25.413 -33.530 1.00 0.00 O ATOM 0 H GLU A 54 1.230 -21.960 -30.513 1.00 0.00 H new ATOM 0 HA GLU A 54 0.177 -20.722 -32.946 1.00 0.00 H new ATOM 0 HB2 GLU A 54 0.462 -22.724 -34.318 1.00 0.00 H new ATOM 0 HB3 GLU A 54 2.033 -22.155 -33.791 1.00 0.00 H new ATOM 0 HG2 GLU A 54 2.022 -23.897 -31.973 1.00 0.00 H new ATOM 0 HG3 GLU A 54 0.489 -24.490 -32.578 1.00 0.00 H new ATOM 492 N SER A 55 -1.776 -22.672 -32.858 1.00 0.00 N ATOM 493 CA SER A 55 -3.088 -23.273 -32.563 1.00 0.00 C ATOM 494 C SER A 55 -2.956 -24.665 -31.907 1.00 0.00 C ATOM 495 O SER A 55 -1.981 -25.396 -32.148 1.00 0.00 O ATOM 496 CB SER A 55 -3.896 -23.347 -33.875 1.00 0.00 C ATOM 497 OG SER A 55 -3.159 -23.991 -34.905 1.00 0.00 O ATOM 0 H SER A 55 -1.585 -22.591 -33.857 1.00 0.00 H new ATOM 0 HA SER A 55 -3.611 -22.648 -31.839 1.00 0.00 H new ATOM 0 HB2 SER A 55 -4.827 -23.887 -33.700 1.00 0.00 H new ATOM 0 HB3 SER A 55 -4.166 -22.340 -34.194 1.00 0.00 H new ATOM 0 HG SER A 55 -3.430 -23.631 -35.775 1.00 0.00 H new ATOM 503 N LEU A 56 -3.954 -25.014 -31.079 1.00 0.00 N ATOM 504 CA LEU A 56 -3.990 -26.289 -30.320 1.00 0.00 C ATOM 505 C LEU A 56 -5.235 -27.135 -30.698 1.00 0.00 C ATOM 506 O LEU A 56 -6.006 -26.745 -31.579 1.00 0.00 O ATOM 507 CB LEU A 56 -3.907 -25.991 -28.779 1.00 0.00 C ATOM 508 CG LEU A 56 -4.702 -24.748 -28.236 1.00 0.00 C ATOM 509 CD1 LEU A 56 -6.214 -24.872 -28.441 1.00 0.00 C ATOM 510 CD2 LEU A 56 -4.384 -24.459 -26.752 1.00 0.00 C ATOM 0 H LEU A 56 -4.767 -24.421 -30.912 1.00 0.00 H new ATOM 0 HA LEU A 56 -3.123 -26.891 -30.590 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -4.259 -26.874 -28.246 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -2.857 -25.859 -28.518 1.00 0.00 H new ATOM 0 HG LEU A 56 -4.360 -23.901 -28.831 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -6.709 -23.985 -28.046 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -6.430 -24.965 -29.505 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -6.581 -25.755 -27.918 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -4.955 -23.592 -26.420 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -4.653 -25.325 -26.147 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -3.319 -24.256 -26.641 1.00 0.00 H new ATOM 522 N ASP A 57 -5.413 -28.294 -30.024 1.00 0.00 N ATOM 523 CA ASP A 57 -6.546 -29.233 -30.285 1.00 0.00 C ATOM 524 C ASP A 57 -7.646 -29.139 -29.212 1.00 0.00 C ATOM 525 O ASP A 57 -8.753 -29.664 -29.398 1.00 0.00 O ATOM 526 CB ASP A 57 -6.040 -30.698 -30.344 1.00 0.00 C ATOM 527 CG ASP A 57 -5.026 -30.952 -31.472 1.00 0.00 C ATOM 528 OD1 ASP A 57 -3.826 -30.701 -31.268 1.00 0.00 O ATOM 529 OD2 ASP A 57 -5.423 -31.403 -32.567 1.00 0.00 O ATOM 0 H ASP A 57 -4.783 -28.610 -29.286 1.00 0.00 H new ATOM 0 HA ASP A 57 -6.972 -28.939 -31.244 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -5.581 -30.954 -29.389 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -6.893 -31.364 -30.476 1.00 0.00 H new ATOM 534 N GLU A 58 -7.352 -28.428 -28.119 1.00 0.00 N ATOM 535 CA GLU A 58 -8.131 -28.479 -26.862 1.00 0.00 C ATOM 536 C GLU A 58 -8.229 -27.073 -26.244 1.00 0.00 C ATOM 537 O GLU A 58 -7.225 -26.511 -25.793 1.00 0.00 O ATOM 538 CB GLU A 58 -7.489 -29.464 -25.840 1.00 0.00 C ATOM 539 CG GLU A 58 -7.480 -30.943 -26.275 1.00 0.00 C ATOM 540 CD GLU A 58 -6.736 -31.845 -25.280 1.00 0.00 C ATOM 541 OE1 GLU A 58 -5.503 -32.010 -25.416 1.00 0.00 O ATOM 542 OE2 GLU A 58 -7.375 -32.373 -24.343 1.00 0.00 O ATOM 0 H GLU A 58 -6.557 -27.790 -28.074 1.00 0.00 H new ATOM 0 HA GLU A 58 -9.132 -28.840 -27.100 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -6.462 -29.150 -25.652 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -8.025 -29.383 -24.894 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -8.507 -31.293 -26.380 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -7.012 -31.027 -27.256 1.00 0.00 H new ATOM 549 N CYS A 59 -9.444 -26.517 -26.283 1.00 0.00 N ATOM 550 CA CYS A 59 -9.815 -25.235 -25.637 1.00 0.00 C ATOM 551 C CYS A 59 -9.376 -25.166 -24.161 1.00 0.00 C ATOM 552 O CYS A 59 -9.794 -25.995 -23.376 1.00 0.00 O ATOM 553 CB CYS A 59 -11.338 -25.105 -25.712 1.00 0.00 C ATOM 554 SG CYS A 59 -12.060 -23.763 -24.732 1.00 0.00 S ATOM 0 H CYS A 59 -10.224 -26.951 -26.776 1.00 0.00 H new ATOM 0 HA CYS A 59 -9.307 -24.424 -26.159 1.00 0.00 H new ATOM 0 HB2 CYS A 59 -11.621 -24.962 -26.755 1.00 0.00 H new ATOM 0 HB3 CYS A 59 -11.781 -26.046 -25.388 1.00 0.00 H new ATOM 559 N GLU A 60 -8.579 -24.143 -23.793 1.00 0.00 N ATOM 560 CA GLU A 60 -8.029 -24.006 -22.420 1.00 0.00 C ATOM 561 C GLU A 60 -9.113 -23.688 -21.347 1.00 0.00 C ATOM 562 O GLU A 60 -8.818 -23.724 -20.150 1.00 0.00 O ATOM 563 CB GLU A 60 -6.922 -22.915 -22.393 1.00 0.00 C ATOM 564 CG GLU A 60 -7.405 -21.499 -22.775 1.00 0.00 C ATOM 565 CD GLU A 60 -6.365 -20.388 -22.538 1.00 0.00 C ATOM 566 OE1 GLU A 60 -5.180 -20.575 -22.882 1.00 0.00 O ATOM 567 OE2 GLU A 60 -6.741 -19.302 -22.042 1.00 0.00 O ATOM 0 H GLU A 60 -8.298 -23.395 -24.427 1.00 0.00 H new ATOM 0 HA GLU A 60 -7.607 -24.977 -22.160 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -6.490 -22.880 -21.393 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -6.124 -23.209 -23.075 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -7.688 -21.496 -23.827 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -8.303 -21.268 -22.202 1.00 0.00 H new ATOM 574 N GLU A 61 -10.353 -23.383 -21.785 1.00 0.00 N ATOM 575 CA GLU A 61 -11.467 -23.013 -20.876 1.00 0.00 C ATOM 576 C GLU A 61 -12.275 -24.243 -20.469 1.00 0.00 C ATOM 577 O GLU A 61 -12.546 -24.463 -19.282 1.00 0.00 O ATOM 578 CB GLU A 61 -12.409 -22.000 -21.571 1.00 0.00 C ATOM 579 CG GLU A 61 -11.701 -20.743 -22.081 1.00 0.00 C ATOM 580 CD GLU A 61 -11.051 -19.895 -20.976 1.00 0.00 C ATOM 581 OE1 GLU A 61 -11.769 -19.135 -20.297 1.00 0.00 O ATOM 582 OE2 GLU A 61 -9.820 -19.971 -20.782 1.00 0.00 O ATOM 0 H GLU A 61 -10.613 -23.385 -22.771 1.00 0.00 H new ATOM 0 HA GLU A 61 -11.032 -22.563 -19.983 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -12.901 -22.493 -22.409 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -13.190 -21.706 -20.870 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -10.934 -21.037 -22.797 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -12.421 -20.127 -22.620 1.00 0.00 H new ATOM 589 N CYS A 62 -12.667 -25.046 -21.473 1.00 0.00 N ATOM 590 CA CYS A 62 -13.656 -26.130 -21.279 1.00 0.00 C ATOM 591 C CYS A 62 -13.241 -27.423 -22.007 1.00 0.00 C ATOM 592 O CYS A 62 -14.060 -28.329 -22.187 1.00 0.00 O ATOM 593 CB CYS A 62 -15.056 -25.627 -21.724 1.00 0.00 C ATOM 594 SG CYS A 62 -15.333 -25.462 -23.528 1.00 0.00 S ATOM 0 H CYS A 62 -12.317 -24.968 -22.428 1.00 0.00 H new ATOM 0 HA CYS A 62 -13.699 -26.388 -20.221 1.00 0.00 H new ATOM 0 HB2 CYS A 62 -15.806 -26.310 -21.325 1.00 0.00 H new ATOM 0 HB3 CYS A 62 -15.232 -24.656 -21.262 1.00 0.00 H new ATOM 599 N GLY A 63 -11.950 -27.496 -22.396 1.00 0.00 N ATOM 600 CA GLY A 63 -11.347 -28.665 -23.076 1.00 0.00 C ATOM 601 C GLY A 63 -12.026 -29.074 -24.381 1.00 0.00 C ATOM 602 O GLY A 63 -11.768 -30.159 -24.905 1.00 0.00 O ATOM 0 H GLY A 63 -11.288 -26.735 -22.245 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -10.299 -28.446 -23.282 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -11.366 -29.514 -22.392 1.00 0.00 H new ATOM 606 N ALA A 64 -12.853 -28.175 -24.920 1.00 0.00 N ATOM 607 CA ALA A 64 -13.722 -28.460 -26.064 1.00 0.00 C ATOM 608 C ALA A 64 -12.910 -28.546 -27.377 1.00 0.00 C ATOM 609 O ALA A 64 -11.992 -27.724 -27.573 1.00 0.00 O ATOM 610 CB ALA A 64 -14.823 -27.400 -26.140 1.00 0.00 C ATOM 0 H ALA A 64 -12.939 -27.220 -24.571 1.00 0.00 H new ATOM 0 HA ALA A 64 -14.190 -29.435 -25.926 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -15.472 -27.609 -26.991 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -15.411 -27.419 -25.222 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -14.372 -26.415 -26.261 1.00 0.00 H new ATOM 616 N PRO A 65 -13.245 -29.518 -28.293 1.00 0.00 N ATOM 617 CA PRO A 65 -12.441 -29.804 -29.505 1.00 0.00 C ATOM 618 C PRO A 65 -12.352 -28.587 -30.456 1.00 0.00 C ATOM 619 O PRO A 65 -13.369 -28.102 -30.972 1.00 0.00 O ATOM 620 CB PRO A 65 -13.172 -31.010 -30.161 1.00 0.00 C ATOM 621 CG PRO A 65 -14.568 -30.956 -29.623 1.00 0.00 C ATOM 622 CD PRO A 65 -14.446 -30.402 -28.221 1.00 0.00 C ATOM 0 HA PRO A 65 -11.401 -30.026 -29.267 1.00 0.00 H new ATOM 0 HB2 PRO A 65 -13.165 -30.932 -31.248 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -12.687 -31.952 -29.906 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -15.201 -30.320 -30.241 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -15.023 -31.947 -29.614 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -15.337 -29.844 -27.932 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -14.315 -31.197 -27.486 1.00 0.00 H new ATOM 630 N ILE A 66 -11.123 -28.084 -30.614 1.00 0.00 N ATOM 631 CA ILE A 66 -10.795 -26.979 -31.522 1.00 0.00 C ATOM 632 C ILE A 66 -10.913 -27.442 -32.997 1.00 0.00 C ATOM 633 O ILE A 66 -10.234 -28.390 -33.384 1.00 0.00 O ATOM 634 CB ILE A 66 -9.333 -26.463 -31.228 1.00 0.00 C ATOM 635 CG1 ILE A 66 -9.209 -26.037 -29.745 1.00 0.00 C ATOM 636 CG2 ILE A 66 -8.926 -25.301 -32.176 1.00 0.00 C ATOM 637 CD1 ILE A 66 -9.905 -24.756 -29.393 1.00 0.00 C ATOM 0 H ILE A 66 -10.314 -28.440 -30.105 1.00 0.00 H new ATOM 0 HA ILE A 66 -11.500 -26.164 -31.358 1.00 0.00 H new ATOM 0 HB ILE A 66 -8.643 -27.285 -31.419 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -9.609 -26.834 -29.119 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -8.152 -25.938 -29.498 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -7.913 -24.976 -31.939 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -8.965 -25.644 -33.210 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -9.615 -24.466 -32.045 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -9.761 -24.543 -28.334 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -9.490 -23.942 -29.987 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -10.971 -24.852 -29.602 1.00 0.00 H new ATOM 649 N PRO A 67 -11.784 -26.795 -33.835 1.00 0.00 N ATOM 650 CA PRO A 67 -11.918 -27.135 -35.263 1.00 0.00 C ATOM 651 C PRO A 67 -10.815 -26.466 -36.094 1.00 0.00 C ATOM 652 O PRO A 67 -10.212 -25.469 -35.655 1.00 0.00 O ATOM 653 CB PRO A 67 -13.317 -26.573 -35.614 1.00 0.00 C ATOM 654 CG PRO A 67 -13.439 -25.356 -34.757 1.00 0.00 C ATOM 655 CD PRO A 67 -12.697 -25.684 -33.467 1.00 0.00 C ATOM 0 HA PRO A 67 -11.821 -28.201 -35.470 1.00 0.00 H new ATOM 0 HB2 PRO A 67 -13.394 -26.326 -36.673 1.00 0.00 H new ATOM 0 HB3 PRO A 67 -14.104 -27.295 -35.397 1.00 0.00 H new ATOM 0 HG2 PRO A 67 -13.004 -24.486 -35.249 1.00 0.00 H new ATOM 0 HG3 PRO A 67 -14.484 -25.120 -34.558 1.00 0.00 H new ATOM 0 HD2 PRO A 67 -12.143 -24.821 -33.097 1.00 0.00 H new ATOM 0 HD3 PRO A 67 -13.387 -25.982 -32.677 1.00 0.00 H new ATOM 663 N GLN A 68 -10.574 -26.996 -37.305 1.00 0.00 N ATOM 664 CA GLN A 68 -9.571 -26.455 -38.238 1.00 0.00 C ATOM 665 C GLN A 68 -9.911 -25.003 -38.618 1.00 0.00 C ATOM 666 O GLN A 68 -9.021 -24.237 -38.970 1.00 0.00 O ATOM 667 CB GLN A 68 -9.446 -27.355 -39.508 1.00 0.00 C ATOM 668 CG GLN A 68 -10.683 -27.361 -40.468 1.00 0.00 C ATOM 669 CD GLN A 68 -10.507 -26.580 -41.797 1.00 0.00 C ATOM 670 OE1 GLN A 68 -9.660 -25.551 -41.821 1.00 0.00 O flip ATOM 671 NE2 GLN A 68 -11.139 -26.913 -42.802 1.00 0.00 N flip ATOM 0 H GLN A 68 -11.069 -27.812 -37.665 1.00 0.00 H new ATOM 0 HA GLN A 68 -8.604 -26.455 -37.736 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -8.573 -27.031 -40.074 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -9.255 -28.379 -39.186 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -10.930 -28.396 -40.706 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -11.537 -26.944 -39.933 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -11.782 -27.704 -42.761 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -11.019 -26.398 -43.674 1.00 0.00 H new ATOM 680 N ALA A 69 -11.209 -24.649 -38.489 1.00 0.00 N ATOM 681 CA ALA A 69 -11.750 -23.340 -38.864 1.00 0.00 C ATOM 682 C ALA A 69 -11.142 -22.224 -38.005 1.00 0.00 C ATOM 683 O ALA A 69 -10.748 -21.181 -38.517 1.00 0.00 O ATOM 684 CB ALA A 69 -13.283 -23.367 -38.737 1.00 0.00 C ATOM 0 H ALA A 69 -11.916 -25.282 -38.114 1.00 0.00 H new ATOM 0 HA ALA A 69 -11.484 -23.129 -39.900 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -13.688 -22.394 -39.015 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -13.689 -24.132 -39.398 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -13.559 -23.594 -37.707 1.00 0.00 H new ATOM 690 N ARG A 70 -11.059 -22.471 -36.686 1.00 0.00 N ATOM 691 CA ARG A 70 -10.459 -21.516 -35.732 1.00 0.00 C ATOM 692 C ARG A 70 -8.929 -21.485 -35.869 1.00 0.00 C ATOM 693 O ARG A 70 -8.301 -20.457 -35.618 1.00 0.00 O ATOM 694 CB ARG A 70 -10.852 -21.846 -34.268 1.00 0.00 C ATOM 695 CG ARG A 70 -12.371 -21.889 -33.992 1.00 0.00 C ATOM 696 CD ARG A 70 -13.131 -20.639 -34.492 1.00 0.00 C ATOM 697 NE ARG A 70 -12.586 -19.354 -33.999 1.00 0.00 N ATOM 698 CZ ARG A 70 -12.827 -18.160 -34.574 1.00 0.00 C ATOM 699 NH1 ARG A 70 -13.573 -18.064 -35.674 1.00 0.00 N ATOM 700 NH2 ARG A 70 -12.304 -17.056 -34.064 1.00 0.00 N ATOM 0 H ARG A 70 -11.401 -23.328 -36.253 1.00 0.00 H new ATOM 0 HA ARG A 70 -10.854 -20.530 -35.977 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -10.422 -22.812 -34.002 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -10.400 -21.104 -33.610 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -12.793 -22.774 -34.469 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -12.533 -21.997 -32.920 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -13.116 -20.632 -35.582 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -14.175 -20.718 -34.188 1.00 0.00 H new ATOM 0 HE ARG A 70 -11.990 -19.374 -33.171 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -13.972 -18.903 -36.094 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -13.745 -17.151 -36.096 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -11.716 -17.107 -33.232 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -12.489 -16.154 -34.503 1.00 0.00 H new ATOM 714 N ARG A 71 -8.343 -22.636 -36.243 1.00 0.00 N ATOM 715 CA ARG A 71 -6.880 -22.796 -36.373 1.00 0.00 C ATOM 716 C ARG A 71 -6.338 -22.043 -37.608 1.00 0.00 C ATOM 717 O ARG A 71 -5.201 -21.557 -37.591 1.00 0.00 O ATOM 718 CB ARG A 71 -6.514 -24.299 -36.473 1.00 0.00 C ATOM 719 CG ARG A 71 -7.034 -25.176 -35.314 1.00 0.00 C ATOM 720 CD ARG A 71 -6.688 -26.667 -35.505 1.00 0.00 C ATOM 721 NE ARG A 71 -7.403 -27.557 -34.564 1.00 0.00 N ATOM 722 CZ ARG A 71 -6.911 -28.714 -34.085 1.00 0.00 C ATOM 723 NH1 ARG A 71 -5.638 -29.047 -34.276 1.00 0.00 N ATOM 724 NH2 ARG A 71 -7.682 -29.524 -33.381 1.00 0.00 N ATOM 0 H ARG A 71 -8.868 -23.482 -36.464 1.00 0.00 H new ATOM 0 HA ARG A 71 -6.418 -22.368 -35.484 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -6.908 -24.692 -37.411 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -5.429 -24.391 -36.520 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -6.607 -24.824 -34.375 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -8.115 -25.064 -35.234 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -6.928 -26.961 -36.527 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -5.614 -26.803 -35.379 1.00 0.00 H new ATOM 0 HE ARG A 71 -8.334 -27.274 -34.257 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -5.019 -28.422 -34.792 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -5.280 -29.928 -33.906 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -8.654 -29.273 -33.199 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -7.305 -30.400 -33.020 1.00 0.00 H new ATOM 738 N GLU A 72 -7.148 -21.981 -38.685 1.00 0.00 N ATOM 739 CA GLU A 72 -6.755 -21.307 -39.943 1.00 0.00 C ATOM 740 C GLU A 72 -7.146 -19.825 -39.905 1.00 0.00 C ATOM 741 O GLU A 72 -6.498 -18.979 -40.533 1.00 0.00 O ATOM 742 CB GLU A 72 -7.324 -22.057 -41.191 1.00 0.00 C ATOM 743 CG GLU A 72 -8.866 -22.199 -41.293 1.00 0.00 C ATOM 744 CD GLU A 72 -9.580 -21.029 -41.996 1.00 0.00 C ATOM 745 OE1 GLU A 72 -9.454 -20.911 -43.235 1.00 0.00 O ATOM 746 OE2 GLU A 72 -10.277 -20.241 -41.329 1.00 0.00 O ATOM 0 H GLU A 72 -8.082 -22.391 -38.710 1.00 0.00 H new ATOM 0 HA GLU A 72 -5.670 -21.346 -40.037 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -6.973 -21.540 -42.084 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -6.891 -23.057 -41.210 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -9.097 -23.120 -41.828 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -9.274 -22.303 -40.288 1.00 0.00 H new ATOM 753 N ALA A 73 -8.223 -19.527 -39.154 1.00 0.00 N ATOM 754 CA ALA A 73 -8.634 -18.143 -38.849 1.00 0.00 C ATOM 755 C ALA A 73 -7.584 -17.459 -37.954 1.00 0.00 C ATOM 756 O ALA A 73 -7.245 -16.289 -38.151 1.00 0.00 O ATOM 757 CB ALA A 73 -10.013 -18.128 -38.161 1.00 0.00 C ATOM 0 H ALA A 73 -8.831 -20.236 -38.743 1.00 0.00 H new ATOM 0 HA ALA A 73 -8.709 -17.591 -39.786 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -10.300 -17.099 -37.944 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -10.754 -18.580 -38.821 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -9.962 -18.695 -37.231 1.00 0.00 H new ATOM 763 N ILE A 74 -7.099 -18.221 -36.948 1.00 0.00 N ATOM 764 CA ILE A 74 -6.140 -17.744 -35.937 1.00 0.00 C ATOM 765 C ILE A 74 -5.032 -18.812 -35.763 1.00 0.00 C ATOM 766 O ILE A 74 -5.301 -19.884 -35.198 1.00 0.00 O ATOM 767 CB ILE A 74 -6.831 -17.474 -34.537 1.00 0.00 C ATOM 768 CG1 ILE A 74 -8.167 -16.681 -34.708 1.00 0.00 C ATOM 769 CG2 ILE A 74 -5.855 -16.736 -33.574 1.00 0.00 C ATOM 770 CD1 ILE A 74 -8.934 -16.444 -33.420 1.00 0.00 C ATOM 0 H ILE A 74 -7.369 -19.196 -36.817 1.00 0.00 H new ATOM 0 HA ILE A 74 -5.723 -16.799 -36.284 1.00 0.00 H new ATOM 0 HB ILE A 74 -7.078 -18.438 -34.092 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -7.945 -15.717 -35.165 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -8.809 -17.223 -35.402 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -6.350 -16.561 -32.619 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -4.967 -17.349 -33.416 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -5.564 -15.781 -34.012 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -9.846 -15.887 -33.637 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -9.193 -17.402 -32.969 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -8.315 -15.872 -32.728 1.00 0.00 H new ATOM 782 N PRO A 75 -3.773 -18.558 -36.247 1.00 0.00 N ATOM 783 CA PRO A 75 -2.614 -19.477 -36.050 1.00 0.00 C ATOM 784 C PRO A 75 -2.001 -19.343 -34.635 1.00 0.00 C ATOM 785 O PRO A 75 -0.777 -19.330 -34.464 1.00 0.00 O ATOM 786 CB PRO A 75 -1.634 -19.016 -37.158 1.00 0.00 C ATOM 787 CG PRO A 75 -1.885 -17.543 -37.277 1.00 0.00 C ATOM 788 CD PRO A 75 -3.380 -17.369 -37.062 1.00 0.00 C ATOM 0 HA PRO A 75 -2.880 -20.532 -36.121 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -0.599 -19.224 -36.887 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -1.826 -19.531 -38.100 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -1.314 -16.986 -36.534 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -1.583 -17.171 -38.256 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -3.602 -16.438 -36.541 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -3.918 -17.340 -38.009 1.00 0.00 H new ATOM 796 N GLY A 76 -2.884 -19.306 -33.632 1.00 0.00 N ATOM 797 CA GLY A 76 -2.524 -19.066 -32.239 1.00 0.00 C ATOM 798 C GLY A 76 -3.761 -19.072 -31.350 1.00 0.00 C ATOM 799 O GLY A 76 -3.816 -18.378 -30.325 1.00 0.00 O ATOM 0 H GLY A 76 -3.885 -19.445 -33.772 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -1.825 -19.832 -31.902 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -2.013 -18.107 -32.151 1.00 0.00 H new ATOM 803 N VAL A 77 -4.772 -19.866 -31.758 1.00 0.00 N ATOM 804 CA VAL A 77 -6.056 -19.956 -31.051 1.00 0.00 C ATOM 805 C VAL A 77 -5.945 -20.920 -29.860 1.00 0.00 C ATOM 806 O VAL A 77 -5.351 -21.999 -29.974 1.00 0.00 O ATOM 807 CB VAL A 77 -7.227 -20.395 -32.017 1.00 0.00 C ATOM 808 CG1 VAL A 77 -6.999 -21.794 -32.632 1.00 0.00 C ATOM 809 CG2 VAL A 77 -8.596 -20.318 -31.307 1.00 0.00 C ATOM 0 H VAL A 77 -4.717 -20.460 -32.586 1.00 0.00 H new ATOM 0 HA VAL A 77 -6.298 -18.961 -30.677 1.00 0.00 H new ATOM 0 HB VAL A 77 -7.229 -19.685 -32.844 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -7.834 -22.044 -33.287 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -6.074 -21.792 -33.208 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -6.928 -22.535 -31.835 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -9.382 -20.626 -31.997 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -8.594 -20.979 -30.441 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -8.780 -19.294 -30.981 1.00 0.00 H new ATOM 819 N ARG A 78 -6.488 -20.495 -28.708 1.00 0.00 N ATOM 820 CA ARG A 78 -6.533 -21.305 -27.472 1.00 0.00 C ATOM 821 C ARG A 78 -7.976 -21.484 -26.953 1.00 0.00 C ATOM 822 O ARG A 78 -8.201 -22.080 -25.899 1.00 0.00 O ATOM 823 CB ARG A 78 -5.544 -20.718 -26.402 1.00 0.00 C ATOM 824 CG ARG A 78 -5.482 -19.169 -26.253 1.00 0.00 C ATOM 825 CD ARG A 78 -6.748 -18.571 -25.639 1.00 0.00 C ATOM 826 NE ARG A 78 -6.662 -17.117 -25.401 1.00 0.00 N ATOM 827 CZ ARG A 78 -7.302 -16.461 -24.410 1.00 0.00 C ATOM 828 NH1 ARG A 78 -7.951 -17.122 -23.451 1.00 0.00 N ATOM 829 NH2 ARG A 78 -7.243 -15.144 -24.355 1.00 0.00 N ATOM 0 H ARG A 78 -6.912 -19.573 -28.604 1.00 0.00 H new ATOM 0 HA ARG A 78 -6.189 -22.314 -27.699 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -5.809 -21.139 -25.432 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -4.541 -21.073 -26.640 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -4.625 -18.904 -25.633 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -5.316 -18.723 -27.233 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -7.592 -18.773 -26.299 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -6.955 -19.073 -24.694 1.00 0.00 H new ATOM 0 HE ARG A 78 -6.077 -16.568 -26.031 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -7.970 -18.142 -23.458 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -8.429 -16.608 -22.711 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -6.716 -14.627 -25.059 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -7.725 -14.643 -23.609 1.00 0.00 H new ATOM 843 N LEU A 79 -8.957 -21.011 -27.737 1.00 0.00 N ATOM 844 CA LEU A 79 -10.392 -21.046 -27.376 1.00 0.00 C ATOM 845 C LEU A 79 -11.205 -21.776 -28.456 1.00 0.00 C ATOM 846 O LEU A 79 -10.998 -21.543 -29.651 1.00 0.00 O ATOM 847 CB LEU A 79 -10.931 -19.600 -27.210 1.00 0.00 C ATOM 848 CG LEU A 79 -10.205 -18.719 -26.157 1.00 0.00 C ATOM 849 CD1 LEU A 79 -10.601 -17.232 -26.257 1.00 0.00 C ATOM 850 CD2 LEU A 79 -10.421 -19.254 -24.744 1.00 0.00 C ATOM 0 H LEU A 79 -8.780 -20.589 -28.648 1.00 0.00 H new ATOM 0 HA LEU A 79 -10.496 -21.584 -26.434 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -10.873 -19.099 -28.176 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -11.986 -19.655 -26.943 1.00 0.00 H new ATOM 0 HG LEU A 79 -9.140 -18.776 -26.382 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -10.065 -16.661 -25.499 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -10.344 -16.853 -27.246 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -11.674 -17.130 -26.097 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -9.900 -18.616 -24.030 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -11.487 -19.260 -24.516 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -10.030 -20.269 -24.676 1.00 0.00 H new ATOM 862 N CYS A 80 -12.144 -22.657 -28.033 1.00 0.00 N ATOM 863 CA CYS A 80 -13.091 -23.326 -28.962 1.00 0.00 C ATOM 864 C CYS A 80 -14.035 -22.276 -29.523 1.00 0.00 C ATOM 865 O CYS A 80 -14.202 -21.246 -28.881 1.00 0.00 O ATOM 866 CB CYS A 80 -13.887 -24.445 -28.251 1.00 0.00 C ATOM 867 SG CYS A 80 -15.102 -23.860 -27.032 1.00 0.00 S ATOM 0 H CYS A 80 -12.267 -22.921 -27.056 1.00 0.00 H new ATOM 0 HA CYS A 80 -12.529 -23.797 -29.769 1.00 0.00 H new ATOM 0 HB2 CYS A 80 -14.406 -25.037 -29.005 1.00 0.00 H new ATOM 0 HB3 CYS A 80 -13.183 -25.111 -27.751 1.00 0.00 H new ATOM 872 N ILE A 81 -14.685 -22.549 -30.671 1.00 0.00 N ATOM 873 CA ILE A 81 -15.493 -21.551 -31.423 1.00 0.00 C ATOM 874 C ILE A 81 -16.511 -20.813 -30.512 1.00 0.00 C ATOM 875 O ILE A 81 -16.772 -19.635 -30.703 1.00 0.00 O ATOM 876 CB ILE A 81 -16.239 -22.236 -32.637 1.00 0.00 C ATOM 877 CG1 ILE A 81 -17.056 -21.194 -33.474 1.00 0.00 C ATOM 878 CG2 ILE A 81 -17.128 -23.415 -32.171 1.00 0.00 C ATOM 879 CD1 ILE A 81 -17.757 -21.753 -34.705 1.00 0.00 C ATOM 0 H ILE A 81 -14.669 -23.470 -31.110 1.00 0.00 H new ATOM 0 HA ILE A 81 -14.799 -20.804 -31.808 1.00 0.00 H new ATOM 0 HB ILE A 81 -15.473 -22.650 -33.293 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -17.805 -20.739 -32.826 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -16.382 -20.398 -33.790 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -17.624 -23.860 -33.034 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -16.509 -24.166 -31.681 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -17.878 -23.050 -31.470 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -18.294 -20.952 -35.213 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -17.018 -22.181 -35.382 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -18.462 -22.527 -34.402 1.00 0.00 H new ATOM 891 N HIS A 82 -16.975 -21.522 -29.471 1.00 0.00 N ATOM 892 CA HIS A 82 -17.947 -21.018 -28.478 1.00 0.00 C ATOM 893 C HIS A 82 -17.276 -19.980 -27.541 1.00 0.00 C ATOM 894 O HIS A 82 -17.754 -18.849 -27.417 1.00 0.00 O ATOM 895 CB HIS A 82 -18.528 -22.219 -27.675 1.00 0.00 C ATOM 896 CG HIS A 82 -19.003 -23.350 -28.546 1.00 0.00 C ATOM 897 ND1 HIS A 82 -20.218 -23.345 -29.190 1.00 0.00 N ATOM 898 CD2 HIS A 82 -18.390 -24.504 -28.906 1.00 0.00 C ATOM 899 CE1 HIS A 82 -20.335 -24.440 -29.912 1.00 0.00 C ATOM 900 NE2 HIS A 82 -19.241 -25.165 -29.758 1.00 0.00 N ATOM 0 H HIS A 82 -16.681 -22.482 -29.289 1.00 0.00 H new ATOM 0 HA HIS A 82 -18.766 -20.512 -28.990 1.00 0.00 H new ATOM 0 HB2 HIS A 82 -17.765 -22.593 -26.992 1.00 0.00 H new ATOM 0 HB3 HIS A 82 -19.359 -21.869 -27.063 1.00 0.00 H new ATOM 0 HD2 HIS A 82 -17.416 -24.841 -28.584 1.00 0.00 H new ATOM 0 HE1 HIS A 82 -21.183 -24.702 -30.527 1.00 0.00 H new ATOM 0 HE2 HIS A 82 -19.059 -26.067 -30.199 1.00 0.00 H new ATOM 909 N CYS A 83 -16.133 -20.368 -26.924 1.00 0.00 N ATOM 910 CA CYS A 83 -15.354 -19.474 -26.023 1.00 0.00 C ATOM 911 C CYS A 83 -14.577 -18.401 -26.823 1.00 0.00 C ATOM 912 O CYS A 83 -14.107 -17.423 -26.246 1.00 0.00 O ATOM 913 CB CYS A 83 -14.344 -20.256 -25.152 1.00 0.00 C ATOM 914 SG CYS A 83 -15.038 -21.552 -24.095 1.00 0.00 S ATOM 0 H CYS A 83 -15.727 -21.297 -27.033 1.00 0.00 H new ATOM 0 HA CYS A 83 -16.088 -18.995 -25.375 1.00 0.00 H new ATOM 0 HB2 CYS A 83 -13.603 -20.710 -25.810 1.00 0.00 H new ATOM 0 HB3 CYS A 83 -13.814 -19.544 -24.519 1.00 0.00 H new ATOM 919 N GLN A 84 -14.391 -18.621 -28.137 1.00 0.00 N ATOM 920 CA GLN A 84 -13.591 -17.722 -28.984 1.00 0.00 C ATOM 921 C GLN A 84 -14.452 -16.551 -29.442 1.00 0.00 C ATOM 922 O GLN A 84 -14.062 -15.412 -29.256 1.00 0.00 O ATOM 923 CB GLN A 84 -12.973 -18.481 -30.212 1.00 0.00 C ATOM 924 CG GLN A 84 -11.552 -18.018 -30.647 1.00 0.00 C ATOM 925 CD GLN A 84 -11.359 -16.495 -30.688 1.00 0.00 C ATOM 926 OE1 GLN A 84 -11.648 -15.850 -31.680 1.00 0.00 O ATOM 927 NE2 GLN A 84 -10.847 -15.921 -29.605 1.00 0.00 N ATOM 0 H GLN A 84 -14.787 -19.418 -28.636 1.00 0.00 H new ATOM 0 HA GLN A 84 -12.758 -17.342 -28.393 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -12.932 -19.544 -29.975 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -13.647 -18.369 -31.061 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -10.820 -18.445 -29.962 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -11.339 -18.425 -31.636 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -10.615 -16.487 -28.789 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -10.686 -14.914 -29.589 1.00 0.00 H new ATOM 936 N GLN A 85 -15.631 -16.867 -30.011 1.00 0.00 N ATOM 937 CA GLN A 85 -16.503 -15.880 -30.681 1.00 0.00 C ATOM 938 C GLN A 85 -16.908 -14.724 -29.738 1.00 0.00 C ATOM 939 O GLN A 85 -17.017 -13.581 -30.173 1.00 0.00 O ATOM 940 CB GLN A 85 -17.767 -16.562 -31.269 1.00 0.00 C ATOM 941 CG GLN A 85 -18.710 -17.207 -30.230 1.00 0.00 C ATOM 942 CD GLN A 85 -19.907 -17.909 -30.866 1.00 0.00 C ATOM 943 OE1 GLN A 85 -20.973 -17.319 -31.042 1.00 0.00 O ATOM 944 NE2 GLN A 85 -19.719 -19.162 -31.254 1.00 0.00 N ATOM 0 H GLN A 85 -16.007 -17.815 -30.020 1.00 0.00 H new ATOM 0 HA GLN A 85 -15.923 -15.451 -31.498 1.00 0.00 H new ATOM 0 HB2 GLN A 85 -18.330 -15.820 -31.836 1.00 0.00 H new ATOM 0 HB3 GLN A 85 -17.451 -17.330 -31.975 1.00 0.00 H new ATOM 0 HG2 GLN A 85 -18.148 -17.927 -29.635 1.00 0.00 H new ATOM 0 HG3 GLN A 85 -19.068 -16.438 -29.546 1.00 0.00 H new ATOM 0 HE21 GLN A 85 -18.821 -19.617 -31.091 1.00 0.00 H new ATOM 0 HE22 GLN A 85 -20.472 -19.671 -31.716 1.00 0.00 H new ATOM 953 N GLU A 86 -17.112 -15.055 -28.443 1.00 0.00 N ATOM 954 CA GLU A 86 -17.415 -14.071 -27.382 1.00 0.00 C ATOM 955 C GLU A 86 -16.202 -13.129 -27.158 1.00 0.00 C ATOM 956 O GLU A 86 -16.355 -11.907 -27.203 1.00 0.00 O ATOM 957 CB GLU A 86 -17.837 -14.803 -26.064 1.00 0.00 C ATOM 958 CG GLU A 86 -16.836 -15.874 -25.593 1.00 0.00 C ATOM 959 CD GLU A 86 -17.197 -16.545 -24.263 1.00 0.00 C ATOM 960 OE1 GLU A 86 -16.840 -15.998 -23.205 1.00 0.00 O ATOM 961 OE2 GLU A 86 -17.816 -17.628 -24.256 1.00 0.00 O ATOM 0 H GLU A 86 -17.071 -16.016 -28.104 1.00 0.00 H new ATOM 0 HA GLU A 86 -18.256 -13.454 -27.697 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -17.960 -14.063 -25.273 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -18.809 -15.271 -26.216 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -16.757 -16.642 -26.362 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -15.852 -15.416 -25.498 1.00 0.00 H new ATOM 968 N LYS A 87 -14.990 -13.715 -27.001 1.00 0.00 N ATOM 969 CA LYS A 87 -13.738 -12.959 -26.763 1.00 0.00 C ATOM 970 C LYS A 87 -13.264 -12.220 -28.033 1.00 0.00 C ATOM 971 O LYS A 87 -12.485 -11.258 -27.960 1.00 0.00 O ATOM 972 CB LYS A 87 -12.621 -13.903 -26.239 1.00 0.00 C ATOM 973 CG LYS A 87 -12.922 -14.561 -24.871 1.00 0.00 C ATOM 974 CD LYS A 87 -13.207 -13.535 -23.745 1.00 0.00 C ATOM 975 CE LYS A 87 -13.271 -14.182 -22.345 1.00 0.00 C ATOM 976 NZ LYS A 87 -14.301 -15.251 -22.248 1.00 0.00 N ATOM 0 H LYS A 87 -14.854 -14.725 -27.036 1.00 0.00 H new ATOM 0 HA LYS A 87 -13.951 -12.207 -26.003 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -12.452 -14.688 -26.976 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -11.693 -13.337 -26.159 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -13.782 -15.223 -24.976 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -12.075 -15.182 -24.581 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -12.430 -12.771 -23.751 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -14.151 -13.031 -23.950 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -12.295 -14.601 -22.099 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -13.483 -13.412 -21.604 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -14.664 -15.296 -21.274 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -15.084 -15.039 -22.899 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -13.877 -16.166 -22.502 1.00 0.00 H new ATOM 990 N ASP A 88 -13.718 -12.716 -29.188 1.00 0.00 N ATOM 991 CA ASP A 88 -13.368 -12.188 -30.514 1.00 0.00 C ATOM 992 C ASP A 88 -13.949 -10.780 -30.724 1.00 0.00 C ATOM 993 O ASP A 88 -13.355 -9.957 -31.423 1.00 0.00 O ATOM 994 CB ASP A 88 -13.877 -13.152 -31.618 1.00 0.00 C ATOM 995 CG ASP A 88 -13.568 -12.673 -33.043 1.00 0.00 C ATOM 996 OD1 ASP A 88 -12.416 -12.850 -33.502 1.00 0.00 O ATOM 997 OD2 ASP A 88 -14.477 -12.121 -33.714 1.00 0.00 O ATOM 0 H ASP A 88 -14.353 -13.513 -29.230 1.00 0.00 H new ATOM 0 HA ASP A 88 -12.282 -12.113 -30.576 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -13.426 -14.133 -31.468 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -14.955 -13.276 -31.511 1.00 0.00 H new ATOM 1002 N LEU A 89 -15.106 -10.520 -30.106 1.00 0.00 N ATOM 1003 CA LEU A 89 -15.792 -9.213 -30.183 1.00 0.00 C ATOM 1004 C LEU A 89 -15.132 -8.195 -29.228 1.00 0.00 C ATOM 1005 O LEU A 89 -15.342 -6.990 -29.349 1.00 0.00 O ATOM 1006 CB LEU A 89 -17.301 -9.388 -29.819 1.00 0.00 C ATOM 1007 CG LEU A 89 -18.029 -10.599 -30.479 1.00 0.00 C ATOM 1008 CD1 LEU A 89 -19.522 -10.644 -30.098 1.00 0.00 C ATOM 1009 CD2 LEU A 89 -17.825 -10.633 -32.017 1.00 0.00 C ATOM 0 H LEU A 89 -15.599 -11.207 -29.536 1.00 0.00 H new ATOM 0 HA LEU A 89 -15.708 -8.833 -31.201 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -17.384 -9.486 -28.737 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -17.829 -8.476 -30.098 1.00 0.00 H new ATOM 0 HG LEU A 89 -17.568 -11.502 -30.080 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -19.994 -11.502 -30.577 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -19.619 -10.734 -29.016 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -20.010 -9.728 -30.431 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -18.349 -11.493 -32.435 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -18.221 -9.718 -32.457 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -16.761 -10.713 -32.241 1.00 0.00 H new ATOM 1021 N GLN A 90 -14.316 -8.711 -28.285 1.00 0.00 N ATOM 1022 CA GLN A 90 -13.759 -7.931 -27.153 1.00 0.00 C ATOM 1023 C GLN A 90 -12.340 -7.421 -27.456 1.00 0.00 C ATOM 1024 O GLN A 90 -11.581 -7.100 -26.540 1.00 0.00 O ATOM 1025 CB GLN A 90 -13.760 -8.822 -25.888 1.00 0.00 C ATOM 1026 CG GLN A 90 -15.104 -9.539 -25.626 1.00 0.00 C ATOM 1027 CD GLN A 90 -16.322 -8.607 -25.573 1.00 0.00 C ATOM 1028 OE1 GLN A 90 -16.241 -7.459 -25.122 1.00 0.00 O ATOM 1029 NE2 GLN A 90 -17.456 -9.088 -26.062 1.00 0.00 N ATOM 0 H GLN A 90 -14.021 -9.688 -28.285 1.00 0.00 H new ATOM 0 HA GLN A 90 -14.383 -7.052 -26.990 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -12.973 -9.570 -25.982 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -13.513 -8.207 -25.023 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -15.264 -10.281 -26.408 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -15.035 -10.080 -24.682 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -17.491 -10.040 -26.427 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -18.294 -8.506 -26.073 1.00 0.00 H new ATOM 1038 N LYS A 91 -11.996 -7.367 -28.746 1.00 0.00 N ATOM 1039 CA LYS A 91 -10.735 -6.763 -29.227 1.00 0.00 C ATOM 1040 C LYS A 91 -10.613 -5.285 -28.765 1.00 0.00 C ATOM 1041 O LYS A 91 -11.494 -4.475 -29.083 1.00 0.00 O ATOM 1042 CB LYS A 91 -10.648 -6.805 -30.779 1.00 0.00 C ATOM 1043 CG LYS A 91 -10.666 -8.208 -31.417 1.00 0.00 C ATOM 1044 CD LYS A 91 -9.567 -9.142 -30.871 1.00 0.00 C ATOM 1045 CE LYS A 91 -9.383 -10.399 -31.742 1.00 0.00 C ATOM 1046 NZ LYS A 91 -10.655 -11.137 -31.978 1.00 0.00 N ATOM 0 H LYS A 91 -12.581 -7.740 -29.494 1.00 0.00 H new ATOM 0 HA LYS A 91 -9.920 -7.348 -28.801 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -11.481 -6.231 -31.186 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -9.733 -6.299 -31.086 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -11.640 -8.665 -31.244 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -10.547 -8.110 -32.496 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -8.624 -8.598 -30.818 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -9.820 -9.441 -29.854 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -8.954 -10.109 -32.701 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -8.667 -11.065 -31.261 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -10.589 -12.086 -31.559 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -11.443 -10.619 -31.540 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -10.823 -11.222 -33.001 1.00 0.00 H new ATOM 1060 N PRO A 92 -9.554 -4.920 -27.972 1.00 0.00 N ATOM 1061 CA PRO A 92 -9.269 -3.504 -27.620 1.00 0.00 C ATOM 1062 C PRO A 92 -8.640 -2.720 -28.794 1.00 0.00 C ATOM 1063 O PRO A 92 -8.746 -1.493 -28.837 1.00 0.00 O ATOM 1064 CB PRO A 92 -8.289 -3.635 -26.428 1.00 0.00 C ATOM 1065 CG PRO A 92 -7.574 -4.927 -26.676 1.00 0.00 C ATOM 1066 CD PRO A 92 -8.586 -5.850 -27.319 1.00 0.00 C ATOM 0 HA PRO A 92 -10.171 -2.941 -27.379 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -7.594 -2.796 -26.391 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -8.820 -3.651 -25.476 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -6.714 -4.777 -27.328 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -7.198 -5.349 -25.744 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -8.117 -6.514 -28.045 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -9.076 -6.483 -26.579 1.00 0.00 H new ATOM 1074 N ALA A 93 -7.997 -3.472 -29.727 1.00 0.00 N ATOM 1075 CA ALA A 93 -7.220 -2.940 -30.884 1.00 0.00 C ATOM 1076 C ALA A 93 -5.832 -2.399 -30.466 1.00 0.00 C ATOM 1077 O ALA A 93 -5.035 -2.001 -31.331 1.00 0.00 O ATOM 1078 CB ALA A 93 -8.022 -1.896 -31.704 1.00 0.00 C ATOM 0 H ALA A 93 -8.004 -4.492 -29.696 1.00 0.00 H new ATOM 0 HA ALA A 93 -7.040 -3.789 -31.543 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -7.413 -1.540 -32.534 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -8.930 -2.358 -32.092 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -8.288 -1.056 -31.062 1.00 0.00 H new ATOM 1084 N TYR A 94 -5.540 -2.417 -29.152 1.00 0.00 N ATOM 1085 CA TYR A 94 -4.277 -1.895 -28.586 1.00 0.00 C ATOM 1086 C TYR A 94 -3.957 -2.632 -27.265 1.00 0.00 C ATOM 1087 O TYR A 94 -4.711 -3.520 -26.850 1.00 0.00 O ATOM 1088 CB TYR A 94 -4.376 -0.348 -28.368 1.00 0.00 C ATOM 1089 CG TYR A 94 -5.234 0.089 -27.158 1.00 0.00 C ATOM 1090 CD1 TYR A 94 -6.623 -0.002 -27.182 1.00 0.00 C ATOM 1091 CD2 TYR A 94 -4.643 0.552 -25.981 1.00 0.00 C ATOM 1092 CE1 TYR A 94 -7.385 0.356 -26.086 1.00 0.00 C ATOM 1093 CE2 TYR A 94 -5.401 0.914 -24.887 1.00 0.00 C ATOM 1094 CZ TYR A 94 -6.768 0.807 -24.940 1.00 0.00 C ATOM 1095 OH TYR A 94 -7.520 1.177 -23.854 1.00 0.00 O ATOM 0 H TYR A 94 -6.174 -2.795 -28.448 1.00 0.00 H new ATOM 0 HA TYR A 94 -3.462 -2.077 -29.287 1.00 0.00 H new ATOM 0 HB2 TYR A 94 -3.369 0.051 -28.243 1.00 0.00 H new ATOM 0 HB3 TYR A 94 -4.789 0.105 -29.269 1.00 0.00 H new ATOM 0 HD1 TYR A 94 -7.115 -0.359 -28.075 1.00 0.00 H new ATOM 0 HD2 TYR A 94 -3.567 0.629 -25.926 1.00 0.00 H new ATOM 0 HE1 TYR A 94 -8.462 0.282 -26.128 1.00 0.00 H new ATOM 0 HE2 TYR A 94 -4.920 1.280 -23.992 1.00 0.00 H new ATOM 0 HH TYR A 94 -6.928 1.469 -23.130 1.00 0.00 H new ATOM 1105 N THR A 95 -2.836 -2.268 -26.616 1.00 0.00 N ATOM 1106 CA THR A 95 -2.453 -2.824 -25.293 1.00 0.00 C ATOM 1107 C THR A 95 -2.195 -1.705 -24.262 1.00 0.00 C ATOM 1108 O THR A 95 -2.264 -1.940 -23.043 1.00 0.00 O ATOM 1109 CB THR A 95 -1.192 -3.737 -25.414 1.00 0.00 C ATOM 1110 OG1 THR A 95 -0.116 -3.004 -26.026 1.00 0.00 O ATOM 1111 CG2 THR A 95 -1.477 -5.017 -26.227 1.00 0.00 C ATOM 0 H THR A 95 -2.172 -1.587 -26.984 1.00 0.00 H new ATOM 0 HA THR A 95 -3.291 -3.426 -24.942 1.00 0.00 H new ATOM 0 HB THR A 95 -0.911 -4.042 -24.406 1.00 0.00 H new ATOM 0 HG1 THR A 95 0.673 -3.581 -26.098 1.00 0.00 H new ATOM 0 HG21 THR A 95 -0.571 -5.621 -26.285 1.00 0.00 H new ATOM 0 HG22 THR A 95 -2.265 -5.590 -25.739 1.00 0.00 H new ATOM 0 HG23 THR A 95 -1.796 -4.745 -27.233 1.00 0.00 H new ATOM 1119 N GLY A 96 -1.892 -0.493 -24.766 1.00 0.00 N ATOM 1120 CA GLY A 96 -1.595 0.667 -23.917 1.00 0.00 C ATOM 1121 C GLY A 96 -0.217 0.598 -23.271 1.00 0.00 C ATOM 1122 O GLY A 96 0.081 1.358 -22.343 1.00 0.00 O ATOM 0 H GLY A 96 -1.848 -0.296 -25.766 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -1.664 1.575 -24.516 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -2.352 0.742 -23.137 1.00 0.00 H new ATOM 1126 N TYR A 97 0.635 -0.313 -23.777 1.00 0.00 N ATOM 1127 CA TYR A 97 1.978 -0.555 -23.233 1.00 0.00 C ATOM 1128 C TYR A 97 2.955 0.569 -23.600 1.00 0.00 C ATOM 1129 O TYR A 97 2.858 1.180 -24.672 1.00 0.00 O ATOM 1130 CB TYR A 97 2.510 -1.961 -23.658 1.00 0.00 C ATOM 1131 CG TYR A 97 2.309 -3.033 -22.580 1.00 0.00 C ATOM 1132 CD1 TYR A 97 1.133 -3.774 -22.489 1.00 0.00 C ATOM 1133 CD2 TYR A 97 3.292 -3.266 -21.623 1.00 0.00 C ATOM 1134 CE1 TYR A 97 0.959 -4.727 -21.501 1.00 0.00 C ATOM 1135 CE2 TYR A 97 3.125 -4.210 -20.637 1.00 0.00 C ATOM 1136 CZ TYR A 97 1.959 -4.932 -20.569 1.00 0.00 C ATOM 1137 OH TYR A 97 1.798 -5.868 -19.568 1.00 0.00 O ATOM 0 H TYR A 97 0.407 -0.902 -24.578 1.00 0.00 H new ATOM 0 HA TYR A 97 1.900 -0.552 -22.146 1.00 0.00 H new ATOM 0 HB2 TYR A 97 2.003 -2.273 -24.571 1.00 0.00 H new ATOM 0 HB3 TYR A 97 3.572 -1.885 -23.893 1.00 0.00 H new ATOM 0 HD1 TYR A 97 0.342 -3.601 -23.203 1.00 0.00 H new ATOM 0 HD2 TYR A 97 4.207 -2.693 -21.655 1.00 0.00 H new ATOM 0 HE1 TYR A 97 0.049 -5.306 -21.458 1.00 0.00 H new ATOM 0 HE2 TYR A 97 3.911 -4.383 -19.916 1.00 0.00 H new ATOM 0 HH TYR A 97 2.598 -5.882 -19.002 1.00 0.00 H new ATOM 1147 N ASN A 98 3.888 0.826 -22.673 1.00 0.00 N ATOM 1148 CA ASN A 98 4.901 1.885 -22.796 1.00 0.00 C ATOM 1149 C ASN A 98 6.284 1.362 -22.362 1.00 0.00 C ATOM 1150 O ASN A 98 7.161 2.151 -21.977 1.00 0.00 O ATOM 1151 CB ASN A 98 4.480 3.120 -21.942 1.00 0.00 C ATOM 1152 CG ASN A 98 4.482 2.860 -20.426 1.00 0.00 C ATOM 1153 OD1 ASN A 98 4.120 1.779 -19.954 1.00 0.00 O ATOM 1154 ND2 ASN A 98 4.913 3.850 -19.659 1.00 0.00 N ATOM 0 H ASN A 98 3.962 0.297 -21.804 1.00 0.00 H new ATOM 0 HA ASN A 98 4.971 2.191 -23.840 1.00 0.00 H new ATOM 0 HB2 ASN A 98 5.156 3.947 -22.160 1.00 0.00 H new ATOM 0 HB3 ASN A 98 3.482 3.436 -22.245 1.00 0.00 H new ATOM 0 HD21 ASN A 98 4.953 3.731 -18.647 1.00 0.00 H new ATOM 0 HD22 ASN A 98 5.205 4.732 -20.081 1.00 0.00 H new ATOM 1161 N ARG A 99 6.486 0.024 -22.446 1.00 0.00 N ATOM 1162 CA ARG A 99 7.780 -0.607 -22.121 1.00 0.00 C ATOM 1163 C ARG A 99 8.827 -0.232 -23.186 1.00 0.00 C ATOM 1164 O ARG A 99 8.977 -0.922 -24.200 1.00 0.00 O ATOM 1165 CB ARG A 99 7.657 -2.159 -21.993 1.00 0.00 C ATOM 1166 CG ARG A 99 6.880 -2.666 -20.756 1.00 0.00 C ATOM 1167 CD ARG A 99 6.884 -4.213 -20.649 1.00 0.00 C ATOM 1168 NE ARG A 99 6.261 -4.856 -21.818 1.00 0.00 N ATOM 1169 CZ ARG A 99 6.033 -6.172 -21.966 1.00 0.00 C ATOM 1170 NH1 ARG A 99 6.369 -7.046 -21.021 1.00 0.00 N ATOM 1171 NH2 ARG A 99 5.457 -6.606 -23.078 1.00 0.00 N ATOM 0 H ARG A 99 5.765 -0.636 -22.737 1.00 0.00 H new ATOM 0 HA ARG A 99 8.102 -0.230 -21.150 1.00 0.00 H new ATOM 0 HB2 ARG A 99 7.169 -2.542 -22.889 1.00 0.00 H new ATOM 0 HB3 ARG A 99 8.660 -2.585 -21.970 1.00 0.00 H new ATOM 0 HG2 ARG A 99 7.321 -2.241 -19.854 1.00 0.00 H new ATOM 0 HG3 ARG A 99 5.851 -2.311 -20.806 1.00 0.00 H new ATOM 0 HD2 ARG A 99 7.911 -4.565 -20.548 1.00 0.00 H new ATOM 0 HD3 ARG A 99 6.353 -4.514 -19.746 1.00 0.00 H new ATOM 0 HE ARG A 99 5.977 -4.247 -22.585 1.00 0.00 H new ATOM 0 HH11 ARG A 99 6.810 -6.722 -20.160 1.00 0.00 H new ATOM 0 HH12 ARG A 99 6.185 -8.040 -21.157 1.00 0.00 H new ATOM 0 HH21 ARG A 99 5.193 -5.944 -23.808 1.00 0.00 H new ATOM 0 HH22 ARG A 99 5.278 -7.602 -23.204 1.00 0.00 H new ATOM 1185 N ARG A 100 9.489 0.917 -22.969 1.00 0.00 N ATOM 1186 CA ARG A 100 10.636 1.358 -23.773 1.00 0.00 C ATOM 1187 C ARG A 100 11.833 0.429 -23.495 1.00 0.00 C ATOM 1188 O ARG A 100 12.551 0.010 -24.410 1.00 0.00 O ATOM 1189 CB ARG A 100 10.981 2.835 -23.432 1.00 0.00 C ATOM 1190 CG ARG A 100 12.256 3.380 -24.118 1.00 0.00 C ATOM 1191 CD ARG A 100 12.570 4.838 -23.740 1.00 0.00 C ATOM 1192 NE ARG A 100 11.562 5.781 -24.247 1.00 0.00 N ATOM 1193 CZ ARG A 100 11.720 7.111 -24.310 1.00 0.00 C ATOM 1194 NH1 ARG A 100 12.836 7.695 -23.873 1.00 0.00 N ATOM 1195 NH2 ARG A 100 10.748 7.850 -24.814 1.00 0.00 N ATOM 0 H ARG A 100 9.240 1.569 -22.225 1.00 0.00 H new ATOM 0 HA ARG A 100 10.392 1.306 -24.834 1.00 0.00 H new ATOM 0 HB2 ARG A 100 10.137 3.465 -23.714 1.00 0.00 H new ATOM 0 HB3 ARG A 100 11.100 2.925 -22.352 1.00 0.00 H new ATOM 0 HG2 ARG A 100 13.104 2.750 -23.848 1.00 0.00 H new ATOM 0 HG3 ARG A 100 12.138 3.309 -25.199 1.00 0.00 H new ATOM 0 HD2 ARG A 100 12.630 4.924 -22.655 1.00 0.00 H new ATOM 0 HD3 ARG A 100 13.549 5.110 -24.136 1.00 0.00 H new ATOM 0 HE ARG A 100 10.677 5.395 -24.575 1.00 0.00 H new ATOM 0 HH11 ARG A 100 13.589 7.128 -23.482 1.00 0.00 H new ATOM 0 HH12 ARG A 100 12.937 8.708 -23.930 1.00 0.00 H new ATOM 0 HH21 ARG A 100 9.892 7.408 -25.149 1.00 0.00 H new ATOM 0 HH22 ARG A 100 10.853 8.863 -24.869 1.00 0.00 H new ATOM 1209 N GLY A 101 12.004 0.111 -22.206 1.00 0.00 N ATOM 1210 CA GLY A 101 13.016 -0.822 -21.744 1.00 0.00 C ATOM 1211 C GLY A 101 12.833 -1.141 -20.269 1.00 0.00 C ATOM 1212 O GLY A 101 12.662 -0.223 -19.457 1.00 0.00 O ATOM 0 H GLY A 101 11.435 0.502 -21.455 1.00 0.00 H new ATOM 0 HA2 GLY A 101 12.961 -1.741 -22.328 1.00 0.00 H new ATOM 0 HA3 GLY A 101 14.007 -0.399 -21.908 1.00 0.00 H new ATOM 1216 N SER A 102 12.826 -2.437 -19.927 1.00 0.00 N ATOM 1217 CA SER A 102 12.785 -2.899 -18.535 1.00 0.00 C ATOM 1218 C SER A 102 14.073 -2.469 -17.792 1.00 0.00 C ATOM 1219 O SER A 102 15.153 -2.438 -18.397 1.00 0.00 O ATOM 1220 CB SER A 102 12.613 -4.436 -18.505 1.00 0.00 C ATOM 1221 OG SER A 102 11.437 -4.834 -19.204 1.00 0.00 O ATOM 0 H SER A 102 12.849 -3.194 -20.610 1.00 0.00 H new ATOM 0 HA SER A 102 11.936 -2.444 -18.025 1.00 0.00 H new ATOM 0 HB2 SER A 102 13.485 -4.911 -18.954 1.00 0.00 H new ATOM 0 HB3 SER A 102 12.559 -4.779 -17.472 1.00 0.00 H new ATOM 0 HG SER A 102 11.352 -5.810 -19.172 1.00 0.00 H new ATOM 1227 N LYS A 103 13.932 -2.125 -16.492 1.00 0.00 N ATOM 1228 CA LYS A 103 15.052 -1.664 -15.635 1.00 0.00 C ATOM 1229 C LYS A 103 16.194 -2.705 -15.604 1.00 0.00 C ATOM 1230 O LYS A 103 17.377 -2.341 -15.704 1.00 0.00 O ATOM 1231 CB LYS A 103 14.543 -1.371 -14.192 1.00 0.00 C ATOM 1232 CG LYS A 103 15.605 -0.884 -13.143 1.00 0.00 C ATOM 1233 CD LYS A 103 16.144 0.564 -13.382 1.00 0.00 C ATOM 1234 CE LYS A 103 17.279 0.659 -14.427 1.00 0.00 C ATOM 1235 NZ LYS A 103 17.662 2.055 -14.733 1.00 0.00 N ATOM 0 H LYS A 103 13.037 -2.159 -16.005 1.00 0.00 H new ATOM 0 HA LYS A 103 15.449 -0.743 -16.062 1.00 0.00 H new ATOM 0 HB2 LYS A 103 13.760 -0.615 -14.257 1.00 0.00 H new ATOM 0 HB3 LYS A 103 14.079 -2.279 -13.807 1.00 0.00 H new ATOM 0 HG2 LYS A 103 15.162 -0.932 -12.148 1.00 0.00 H new ATOM 0 HG3 LYS A 103 16.447 -1.576 -13.151 1.00 0.00 H new ATOM 0 HD2 LYS A 103 15.317 1.198 -13.703 1.00 0.00 H new ATOM 0 HD3 LYS A 103 16.504 0.965 -12.435 1.00 0.00 H new ATOM 0 HE2 LYS A 103 18.152 0.120 -14.058 1.00 0.00 H new ATOM 0 HE3 LYS A 103 16.963 0.164 -15.345 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 18.426 2.059 -15.439 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 16.839 2.566 -15.111 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 17.991 2.523 -13.864 1.00 0.00 H new ATOM 1249 N ASP A 104 15.799 -3.993 -15.492 1.00 0.00 N ATOM 1250 CA ASP A 104 16.726 -5.137 -15.423 1.00 0.00 C ATOM 1251 C ASP A 104 17.664 -5.000 -14.207 1.00 0.00 C ATOM 1252 O ASP A 104 18.773 -4.450 -14.295 1.00 0.00 O ATOM 1253 CB ASP A 104 17.501 -5.320 -16.761 1.00 0.00 C ATOM 1254 CG ASP A 104 18.531 -6.470 -16.738 1.00 0.00 C ATOM 1255 OD1 ASP A 104 18.121 -7.648 -16.757 1.00 0.00 O ATOM 1256 OD2 ASP A 104 19.756 -6.205 -16.719 1.00 0.00 O ATOM 0 H ASP A 104 14.817 -4.267 -15.447 1.00 0.00 H new ATOM 0 HA ASP A 104 16.144 -6.048 -15.280 1.00 0.00 H new ATOM 0 HB2 ASP A 104 16.785 -5.504 -17.562 1.00 0.00 H new ATOM 0 HB3 ASP A 104 18.016 -4.390 -17.001 1.00 0.00 H new ATOM 1261 N SER A 105 17.160 -5.454 -13.058 1.00 0.00 N ATOM 1262 CA SER A 105 17.860 -5.383 -11.763 1.00 0.00 C ATOM 1263 C SER A 105 17.640 -6.691 -10.964 1.00 0.00 C ATOM 1264 O SER A 105 18.228 -6.886 -9.893 1.00 0.00 O ATOM 1265 CB SER A 105 17.357 -4.142 -10.977 1.00 0.00 C ATOM 1266 OG SER A 105 18.078 -3.942 -9.772 1.00 0.00 O ATOM 0 H SER A 105 16.240 -5.889 -12.994 1.00 0.00 H new ATOM 0 HA SER A 105 18.932 -5.276 -11.927 1.00 0.00 H new ATOM 0 HB2 SER A 105 17.448 -3.255 -11.604 1.00 0.00 H new ATOM 0 HB3 SER A 105 16.298 -4.263 -10.749 1.00 0.00 H new ATOM 0 HG SER A 105 18.416 -4.802 -9.447 1.00 0.00 H new ATOM 1272 N GLN A 106 16.780 -7.585 -11.502 1.00 0.00 N ATOM 1273 CA GLN A 106 16.526 -8.927 -10.936 1.00 0.00 C ATOM 1274 C GLN A 106 17.199 -9.992 -11.813 1.00 0.00 C ATOM 1275 O GLN A 106 17.215 -9.866 -13.041 1.00 0.00 O ATOM 1276 CB GLN A 106 15.003 -9.223 -10.853 1.00 0.00 C ATOM 1277 CG GLN A 106 14.207 -8.214 -10.025 1.00 0.00 C ATOM 1278 CD GLN A 106 12.734 -8.584 -9.877 1.00 0.00 C ATOM 1279 OE1 GLN A 106 11.904 -8.211 -10.706 1.00 0.00 O ATOM 1280 NE2 GLN A 106 12.400 -9.319 -8.820 1.00 0.00 N ATOM 0 H GLN A 106 16.240 -7.393 -12.346 1.00 0.00 H new ATOM 0 HA GLN A 106 16.940 -8.953 -9.928 1.00 0.00 H new ATOM 0 HB2 GLN A 106 14.595 -9.248 -11.863 1.00 0.00 H new ATOM 0 HB3 GLN A 106 14.861 -10.216 -10.427 1.00 0.00 H new ATOM 0 HG2 GLN A 106 14.655 -8.133 -9.035 1.00 0.00 H new ATOM 0 HG3 GLN A 106 14.283 -7.232 -10.491 1.00 0.00 H new ATOM 0 HE21 GLN A 106 13.116 -9.610 -8.154 1.00 0.00 H new ATOM 0 HE22 GLN A 106 11.428 -9.592 -8.675 1.00 0.00 H new ATOM 1289 N LEU A 107 17.720 -11.051 -11.166 1.00 0.00 N ATOM 1290 CA LEU A 107 18.357 -12.208 -11.850 1.00 0.00 C ATOM 1291 C LEU A 107 17.513 -13.482 -11.617 1.00 0.00 C ATOM 1292 O LEU A 107 18.015 -14.615 -11.692 1.00 0.00 O ATOM 1293 CB LEU A 107 19.841 -12.402 -11.377 1.00 0.00 C ATOM 1294 CG LEU A 107 20.101 -12.822 -9.876 1.00 0.00 C ATOM 1295 CD1 LEU A 107 21.529 -13.380 -9.698 1.00 0.00 C ATOM 1296 CD2 LEU A 107 19.851 -11.664 -8.878 1.00 0.00 C ATOM 0 H LEU A 107 17.714 -11.135 -10.149 1.00 0.00 H new ATOM 0 HA LEU A 107 18.391 -12.009 -12.921 1.00 0.00 H new ATOM 0 HB2 LEU A 107 20.298 -13.157 -12.017 1.00 0.00 H new ATOM 0 HB3 LEU A 107 20.372 -11.467 -11.557 1.00 0.00 H new ATOM 0 HG LEU A 107 19.380 -13.607 -9.647 1.00 0.00 H new ATOM 0 HD11 LEU A 107 21.682 -13.662 -8.656 1.00 0.00 H new ATOM 0 HD12 LEU A 107 21.659 -14.256 -10.334 1.00 0.00 H new ATOM 0 HD13 LEU A 107 22.255 -12.617 -9.978 1.00 0.00 H new ATOM 0 HD21 LEU A 107 20.045 -12.010 -7.863 1.00 0.00 H new ATOM 0 HD22 LEU A 107 20.516 -10.833 -9.111 1.00 0.00 H new ATOM 0 HD23 LEU A 107 18.815 -11.333 -8.957 1.00 0.00 H new ATOM 1308 N ARG A 108 16.206 -13.254 -11.406 1.00 0.00 N ATOM 1309 CA ARG A 108 15.239 -14.272 -10.959 1.00 0.00 C ATOM 1310 C ARG A 108 15.092 -15.472 -11.949 1.00 0.00 C ATOM 1311 O ARG A 108 15.348 -16.627 -11.541 1.00 0.00 O ATOM 1312 CB ARG A 108 13.860 -13.592 -10.655 1.00 0.00 C ATOM 1313 CG ARG A 108 13.224 -12.793 -11.829 1.00 0.00 C ATOM 1314 CD ARG A 108 11.869 -12.154 -11.461 1.00 0.00 C ATOM 1315 NE ARG A 108 10.943 -13.153 -10.893 1.00 0.00 N ATOM 1316 CZ ARG A 108 10.071 -12.930 -9.899 1.00 0.00 C ATOM 1317 NH1 ARG A 108 9.888 -11.713 -9.423 1.00 0.00 N ATOM 1318 NH2 ARG A 108 9.371 -13.927 -9.402 1.00 0.00 N ATOM 1319 OXT ARG A 108 14.745 -15.256 -13.129 1.00 0.00 O ATOM 0 H ARG A 108 15.782 -12.337 -11.544 1.00 0.00 H new ATOM 0 HA ARG A 108 15.631 -14.712 -10.042 1.00 0.00 H new ATOM 0 HB2 ARG A 108 13.157 -14.364 -10.343 1.00 0.00 H new ATOM 0 HB3 ARG A 108 13.988 -12.917 -9.809 1.00 0.00 H new ATOM 0 HG2 ARG A 108 13.914 -12.011 -12.144 1.00 0.00 H new ATOM 0 HG3 ARG A 108 13.086 -13.459 -12.681 1.00 0.00 H new ATOM 0 HD2 ARG A 108 12.027 -11.350 -10.742 1.00 0.00 H new ATOM 0 HD3 ARG A 108 11.423 -11.705 -12.348 1.00 0.00 H new ATOM 0 HE ARG A 108 10.968 -14.092 -11.290 1.00 0.00 H new ATOM 0 HH11 ARG A 108 10.413 -10.929 -9.811 1.00 0.00 H new ATOM 0 HH12 ARG A 108 9.222 -11.556 -8.667 1.00 0.00 H new ATOM 0 HH21 ARG A 108 9.492 -14.870 -9.773 1.00 0.00 H new ATOM 0 HH22 ARG A 108 8.708 -13.757 -8.646 1.00 0.00 H new TER 1333 ARG A 108 HETATM 1334 ZN ZN A 109 -14.399 -23.671 -24.792 1.00 0.00 ZN