USER MOD reduce.3.24.130724 H: found=0, std=0, add=650, rem=0, adj=16 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 103 LYS NZ :NH3+ -147:sc= 0.857 (180deg=0.422) USER MOD Set 1.2: A 105 SER OG : rot 180:sc= 0.216 USER MOD Set 2.1: A 36 ASN : amide:sc= 0.226 K(o=0.47,f=-0.41) USER MOD Set 2.2: A 38 THR OG1 : rot 98:sc= 0.246 USER MOD Single : A 21 MET CE :methyl -168:sc= -0.0486 (180deg=-0.259) USER MOD Single : A 23 SER OG : rot 180:sc= -0.332 USER MOD Single : A 27 ASN : amide:sc= -0.444 X(o=-0.44,f=-0.42) USER MOD Single : A 32 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 37 SER OG : rot 83:sc= 0.291 USER MOD Single : A 55 SER OG : rot -92:sc= 0.828 USER MOD Single : A 68 GLN :FLIP amide:sc=-0.00474 F(o=-0.93,f=-0.0047) USER MOD Single : A 82 HIS : no HD1:sc= -0.037 X(o=-0.037,f=0) USER MOD Single : A 84 GLN : amide:sc= 0.352 K(o=0.35,f=-5.7!) USER MOD Single : A 85 GLN :FLIP amide:sc= -0.0188 F(o=-0.69,f=-0.019) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 GLN : amide:sc= -0.0697 X(o=-0.07,f=-0.069) USER MOD Single : A 91 LYS NZ :NH3+ -163:sc= -0.132 (180deg=-0.529) USER MOD Single : A 94 TYR OH : rot 180:sc= 0 USER MOD Single : A 95 THR OG1 : rot 94:sc= 0.582 USER MOD Single : A 97 TYR OH : rot 30:sc= 0.32 USER MOD Single : A 98 ASN :FLIP amide:sc= -0.265 F(o=-0.98,f=-0.26) USER MOD Single : A 102 SER OG : rot 40:sc= 0.103 USER MOD Single : A 106 GLN :FLIP amide:sc=-0.000332 F(o=-0.68,f=-0.00033) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 21 11.074 -8.028 -51.349 1.00 0.00 N ATOM 2 CA MET A 21 11.687 -7.437 -50.133 1.00 0.00 C ATOM 3 C MET A 21 10.807 -7.784 -48.920 1.00 0.00 C ATOM 4 O MET A 21 9.862 -7.053 -48.583 1.00 0.00 O ATOM 5 CB MET A 21 11.861 -5.897 -50.298 1.00 0.00 C ATOM 6 CG MET A 21 12.628 -5.204 -49.162 1.00 0.00 C ATOM 7 SD MET A 21 12.684 -3.399 -49.339 1.00 0.00 S ATOM 8 CE MET A 21 13.528 -3.177 -50.907 1.00 0.00 C ATOM 0 HA MET A 21 12.683 -7.852 -49.977 1.00 0.00 H new ATOM 0 HB2 MET A 21 12.380 -5.704 -51.237 1.00 0.00 H new ATOM 0 HB3 MET A 21 10.874 -5.442 -50.380 1.00 0.00 H new ATOM 0 HG2 MET A 21 12.161 -5.455 -48.210 1.00 0.00 H new ATOM 0 HG3 MET A 21 13.646 -5.592 -49.130 1.00 0.00 H new ATOM 0 HE1 MET A 21 13.811 -2.131 -51.023 1.00 0.00 H new ATOM 0 HE2 MET A 21 14.423 -3.799 -50.930 1.00 0.00 H new ATOM 0 HE3 MET A 21 12.864 -3.466 -51.722 1.00 0.00 H new ATOM 18 N ALA A 22 11.094 -8.942 -48.299 1.00 0.00 N ATOM 19 CA ALA A 22 10.332 -9.456 -47.153 1.00 0.00 C ATOM 20 C ALA A 22 10.845 -8.825 -45.849 1.00 0.00 C ATOM 21 O ALA A 22 11.699 -9.396 -45.156 1.00 0.00 O ATOM 22 CB ALA A 22 10.397 -10.994 -47.114 1.00 0.00 C ATOM 0 H ALA A 22 11.864 -9.548 -48.581 1.00 0.00 H new ATOM 0 HA ALA A 22 9.284 -9.177 -47.263 1.00 0.00 H new ATOM 0 HB1 ALA A 22 9.828 -11.361 -46.260 1.00 0.00 H new ATOM 0 HB2 ALA A 22 9.974 -11.399 -48.033 1.00 0.00 H new ATOM 0 HB3 ALA A 22 11.435 -11.312 -47.022 1.00 0.00 H new ATOM 28 N SER A 23 10.289 -7.643 -45.524 1.00 0.00 N ATOM 29 CA SER A 23 10.692 -6.833 -44.370 1.00 0.00 C ATOM 30 C SER A 23 9.550 -5.861 -44.034 1.00 0.00 C ATOM 31 O SER A 23 8.891 -5.346 -44.949 1.00 0.00 O ATOM 32 CB SER A 23 12.005 -6.066 -44.677 1.00 0.00 C ATOM 33 OG SER A 23 11.890 -5.270 -45.852 1.00 0.00 O ATOM 0 H SER A 23 9.536 -7.221 -46.067 1.00 0.00 H new ATOM 0 HA SER A 23 10.884 -7.477 -43.512 1.00 0.00 H new ATOM 0 HB2 SER A 23 12.260 -5.429 -43.830 1.00 0.00 H new ATOM 0 HB3 SER A 23 12.822 -6.778 -44.798 1.00 0.00 H new ATOM 0 HG SER A 23 12.735 -4.800 -46.013 1.00 0.00 H new ATOM 39 N GLY A 24 9.310 -5.627 -42.732 1.00 0.00 N ATOM 40 CA GLY A 24 8.215 -4.756 -42.292 1.00 0.00 C ATOM 41 C GLY A 24 6.846 -5.426 -42.415 1.00 0.00 C ATOM 42 O GLY A 24 5.841 -4.758 -42.693 1.00 0.00 O ATOM 0 H GLY A 24 9.859 -6.029 -41.972 1.00 0.00 H new ATOM 0 HA2 GLY A 24 8.381 -4.465 -41.255 1.00 0.00 H new ATOM 0 HA3 GLY A 24 8.222 -3.841 -42.885 1.00 0.00 H new ATOM 46 N TRP A 25 6.814 -6.750 -42.190 1.00 0.00 N ATOM 47 CA TRP A 25 5.593 -7.572 -42.377 1.00 0.00 C ATOM 48 C TRP A 25 5.503 -8.674 -41.295 1.00 0.00 C ATOM 49 O TRP A 25 4.425 -8.935 -40.755 1.00 0.00 O ATOM 50 CB TRP A 25 5.571 -8.200 -43.807 1.00 0.00 C ATOM 51 CG TRP A 25 6.579 -9.312 -44.035 1.00 0.00 C ATOM 52 CD1 TRP A 25 7.935 -9.216 -43.962 1.00 0.00 C ATOM 53 CD2 TRP A 25 6.302 -10.688 -44.348 1.00 0.00 C ATOM 54 NE1 TRP A 25 8.514 -10.430 -44.205 1.00 0.00 N ATOM 55 CE2 TRP A 25 7.535 -11.348 -44.450 1.00 0.00 C ATOM 56 CE3 TRP A 25 5.127 -11.418 -44.555 1.00 0.00 C ATOM 57 CZ2 TRP A 25 7.633 -12.705 -44.746 1.00 0.00 C ATOM 58 CZ3 TRP A 25 5.223 -12.767 -44.851 1.00 0.00 C ATOM 59 CH2 TRP A 25 6.470 -13.397 -44.938 1.00 0.00 C ATOM 0 H TRP A 25 7.624 -7.284 -41.875 1.00 0.00 H new ATOM 0 HA TRP A 25 4.724 -6.923 -42.273 1.00 0.00 H new ATOM 0 HB2 TRP A 25 4.572 -8.590 -44.001 1.00 0.00 H new ATOM 0 HB3 TRP A 25 5.752 -7.411 -44.537 1.00 0.00 H new ATOM 0 HD1 TRP A 25 8.477 -8.308 -43.743 1.00 0.00 H new ATOM 0 HE1 TRP A 25 9.516 -10.619 -44.203 1.00 0.00 H new ATOM 0 HE3 TRP A 25 4.162 -10.938 -44.485 1.00 0.00 H new ATOM 0 HZ2 TRP A 25 8.593 -13.193 -44.821 1.00 0.00 H new ATOM 0 HZ3 TRP A 25 4.323 -13.341 -45.017 1.00 0.00 H new ATOM 0 HH2 TRP A 25 6.514 -14.453 -45.162 1.00 0.00 H new ATOM 70 N ALA A 26 6.659 -9.280 -40.978 1.00 0.00 N ATOM 71 CA ALA A 26 6.771 -10.459 -40.104 1.00 0.00 C ATOM 72 C ALA A 26 8.252 -10.730 -39.813 1.00 0.00 C ATOM 73 O ALA A 26 8.616 -11.054 -38.684 1.00 0.00 O ATOM 74 CB ALA A 26 6.103 -11.704 -40.737 1.00 0.00 C ATOM 0 H ALA A 26 7.560 -8.957 -41.330 1.00 0.00 H new ATOM 0 HA ALA A 26 6.245 -10.253 -39.172 1.00 0.00 H new ATOM 0 HB1 ALA A 26 6.206 -12.554 -40.063 1.00 0.00 H new ATOM 0 HB2 ALA A 26 5.046 -11.502 -40.908 1.00 0.00 H new ATOM 0 HB3 ALA A 26 6.587 -11.933 -41.687 1.00 0.00 H new ATOM 80 N ASN A 27 9.111 -10.593 -40.856 1.00 0.00 N ATOM 81 CA ASN A 27 10.577 -10.729 -40.712 1.00 0.00 C ATOM 82 C ASN A 27 11.147 -9.440 -40.093 1.00 0.00 C ATOM 83 O ASN A 27 11.777 -8.616 -40.773 1.00 0.00 O ATOM 84 CB ASN A 27 11.265 -11.061 -42.071 1.00 0.00 C ATOM 85 CG ASN A 27 10.781 -12.364 -42.715 1.00 0.00 C ATOM 86 OD1 ASN A 27 10.305 -13.278 -42.041 1.00 0.00 O ATOM 87 ND2 ASN A 27 10.926 -12.470 -44.031 1.00 0.00 N ATOM 0 H ASN A 27 8.808 -10.388 -41.808 1.00 0.00 H new ATOM 0 HA ASN A 27 10.787 -11.568 -40.048 1.00 0.00 H new ATOM 0 HB2 ASN A 27 11.090 -10.239 -42.765 1.00 0.00 H new ATOM 0 HB3 ASN A 27 12.342 -11.123 -41.915 1.00 0.00 H new ATOM 0 HD21 ASN A 27 10.640 -13.325 -44.508 1.00 0.00 H new ATOM 0 HD22 ASN A 27 11.323 -11.697 -44.564 1.00 0.00 H new ATOM 94 N ASP A 28 10.879 -9.277 -38.791 1.00 0.00 N ATOM 95 CA ASP A 28 11.215 -8.076 -38.009 1.00 0.00 C ATOM 96 C ASP A 28 11.736 -8.506 -36.639 1.00 0.00 C ATOM 97 O ASP A 28 11.389 -9.585 -36.168 1.00 0.00 O ATOM 98 CB ASP A 28 9.962 -7.174 -37.823 1.00 0.00 C ATOM 99 CG ASP A 28 9.416 -6.583 -39.141 1.00 0.00 C ATOM 100 OD1 ASP A 28 8.650 -7.273 -39.859 1.00 0.00 O ATOM 101 OD2 ASP A 28 9.743 -5.420 -39.460 1.00 0.00 O ATOM 0 H ASP A 28 10.411 -9.994 -38.237 1.00 0.00 H new ATOM 0 HA ASP A 28 11.977 -7.507 -38.542 1.00 0.00 H new ATOM 0 HB2 ASP A 28 9.175 -7.756 -37.344 1.00 0.00 H new ATOM 0 HB3 ASP A 28 10.212 -6.357 -37.146 1.00 0.00 H new ATOM 106 N ASP A 29 12.536 -7.644 -36.003 1.00 0.00 N ATOM 107 CA ASP A 29 13.101 -7.879 -34.651 1.00 0.00 C ATOM 108 C ASP A 29 11.976 -7.983 -33.595 1.00 0.00 C ATOM 109 O ASP A 29 12.021 -8.828 -32.692 1.00 0.00 O ATOM 110 CB ASP A 29 14.077 -6.720 -34.300 1.00 0.00 C ATOM 111 CG ASP A 29 14.788 -6.893 -32.946 1.00 0.00 C ATOM 112 OD1 ASP A 29 15.658 -7.786 -32.841 1.00 0.00 O ATOM 113 OD2 ASP A 29 14.490 -6.145 -31.986 1.00 0.00 O ATOM 0 H ASP A 29 12.818 -6.752 -36.408 1.00 0.00 H new ATOM 0 HA ASP A 29 13.644 -8.824 -34.648 1.00 0.00 H new ATOM 0 HB2 ASP A 29 14.828 -6.640 -35.086 1.00 0.00 H new ATOM 0 HB3 ASP A 29 13.523 -5.781 -34.291 1.00 0.00 H new ATOM 118 N ALA A 30 10.949 -7.137 -33.771 1.00 0.00 N ATOM 119 CA ALA A 30 9.789 -7.047 -32.860 1.00 0.00 C ATOM 120 C ALA A 30 8.837 -8.264 -32.974 1.00 0.00 C ATOM 121 O ALA A 30 7.948 -8.444 -32.133 1.00 0.00 O ATOM 122 CB ALA A 30 9.035 -5.740 -33.139 1.00 0.00 C ATOM 0 H ALA A 30 10.897 -6.488 -34.556 1.00 0.00 H new ATOM 0 HA ALA A 30 10.165 -7.053 -31.837 1.00 0.00 H new ATOM 0 HB1 ALA A 30 8.177 -5.665 -32.471 1.00 0.00 H new ATOM 0 HB2 ALA A 30 9.700 -4.893 -32.971 1.00 0.00 H new ATOM 0 HB3 ALA A 30 8.691 -5.732 -34.173 1.00 0.00 H new ATOM 128 N VAL A 31 9.024 -9.084 -34.025 1.00 0.00 N ATOM 129 CA VAL A 31 8.205 -10.293 -34.279 1.00 0.00 C ATOM 130 C VAL A 31 9.064 -11.564 -34.087 1.00 0.00 C ATOM 131 O VAL A 31 8.550 -12.626 -33.733 1.00 0.00 O ATOM 132 CB VAL A 31 7.587 -10.280 -35.732 1.00 0.00 C ATOM 133 CG1 VAL A 31 6.585 -11.448 -35.947 1.00 0.00 C ATOM 134 CG2 VAL A 31 6.922 -8.922 -36.054 1.00 0.00 C ATOM 0 H VAL A 31 9.748 -8.930 -34.726 1.00 0.00 H new ATOM 0 HA VAL A 31 7.383 -10.295 -33.563 1.00 0.00 H new ATOM 0 HB VAL A 31 8.415 -10.423 -36.426 1.00 0.00 H new ATOM 0 HG11 VAL A 31 6.184 -11.401 -36.959 1.00 0.00 H new ATOM 0 HG12 VAL A 31 7.098 -12.399 -35.804 1.00 0.00 H new ATOM 0 HG13 VAL A 31 5.769 -11.364 -35.229 1.00 0.00 H new ATOM 0 HG21 VAL A 31 6.508 -8.950 -37.062 1.00 0.00 H new ATOM 0 HG22 VAL A 31 6.123 -8.729 -35.338 1.00 0.00 H new ATOM 0 HG23 VAL A 31 7.666 -8.128 -35.989 1.00 0.00 H new ATOM 144 N ASN A 32 10.384 -11.436 -34.299 1.00 0.00 N ATOM 145 CA ASN A 32 11.333 -12.565 -34.190 1.00 0.00 C ATOM 146 C ASN A 32 11.569 -12.928 -32.710 1.00 0.00 C ATOM 147 O ASN A 32 11.944 -14.058 -32.393 1.00 0.00 O ATOM 148 CB ASN A 32 12.664 -12.226 -34.916 1.00 0.00 C ATOM 149 CG ASN A 32 13.654 -13.399 -34.976 1.00 0.00 C ATOM 150 OD1 ASN A 32 13.617 -14.210 -35.903 1.00 0.00 O ATOM 151 ND2 ASN A 32 14.544 -13.500 -33.992 1.00 0.00 N ATOM 0 H ASN A 32 10.826 -10.552 -34.550 1.00 0.00 H new ATOM 0 HA ASN A 32 10.902 -13.438 -34.680 1.00 0.00 H new ATOM 0 HB2 ASN A 32 12.440 -11.900 -35.932 1.00 0.00 H new ATOM 0 HB3 ASN A 32 13.140 -11.387 -34.409 1.00 0.00 H new ATOM 0 HD21 ASN A 32 15.220 -14.264 -33.992 1.00 0.00 H new ATOM 0 HD22 ASN A 32 14.550 -12.813 -33.238 1.00 0.00 H new ATOM 158 N GLU A 33 11.337 -11.946 -31.818 1.00 0.00 N ATOM 159 CA GLU A 33 11.343 -12.156 -30.351 1.00 0.00 C ATOM 160 C GLU A 33 10.157 -13.042 -29.909 1.00 0.00 C ATOM 161 O GLU A 33 10.247 -13.772 -28.917 1.00 0.00 O ATOM 162 CB GLU A 33 11.314 -10.793 -29.611 1.00 0.00 C ATOM 163 CG GLU A 33 10.125 -9.875 -29.972 1.00 0.00 C ATOM 164 CD GLU A 33 10.079 -8.579 -29.143 1.00 0.00 C ATOM 165 OE1 GLU A 33 10.752 -7.594 -29.527 1.00 0.00 O ATOM 166 OE2 GLU A 33 9.401 -8.547 -28.092 1.00 0.00 O ATOM 0 H GLU A 33 11.140 -10.983 -32.091 1.00 0.00 H new ATOM 0 HA GLU A 33 12.264 -12.677 -30.087 1.00 0.00 H new ATOM 0 HB2 GLU A 33 11.295 -10.981 -28.537 1.00 0.00 H new ATOM 0 HB3 GLU A 33 12.241 -10.261 -29.825 1.00 0.00 H new ATOM 0 HG2 GLU A 33 10.182 -9.619 -31.030 1.00 0.00 H new ATOM 0 HG3 GLU A 33 9.195 -10.424 -29.826 1.00 0.00 H new ATOM 173 N GLN A 34 9.044 -12.953 -30.658 1.00 0.00 N ATOM 174 CA GLN A 34 7.878 -13.842 -30.488 1.00 0.00 C ATOM 175 C GLN A 34 8.221 -15.266 -30.968 1.00 0.00 C ATOM 176 O GLN A 34 7.904 -16.256 -30.301 1.00 0.00 O ATOM 177 CB GLN A 34 6.667 -13.283 -31.285 1.00 0.00 C ATOM 178 CG GLN A 34 5.437 -14.214 -31.357 1.00 0.00 C ATOM 179 CD GLN A 34 4.372 -13.722 -32.334 1.00 0.00 C ATOM 180 OE1 GLN A 34 3.469 -12.969 -31.967 1.00 0.00 O ATOM 181 NE2 GLN A 34 4.480 -14.134 -33.596 1.00 0.00 N ATOM 0 H GLN A 34 8.926 -12.262 -31.399 1.00 0.00 H new ATOM 0 HA GLN A 34 7.616 -13.885 -29.431 1.00 0.00 H new ATOM 0 HB2 GLN A 34 6.361 -12.339 -30.834 1.00 0.00 H new ATOM 0 HB3 GLN A 34 6.993 -13.060 -32.301 1.00 0.00 H new ATOM 0 HG2 GLN A 34 5.761 -15.212 -31.653 1.00 0.00 H new ATOM 0 HG3 GLN A 34 4.997 -14.303 -30.364 1.00 0.00 H new ATOM 0 HE21 GLN A 34 5.241 -14.758 -33.866 1.00 0.00 H new ATOM 0 HE22 GLN A 34 3.802 -13.826 -34.293 1.00 0.00 H new ATOM 190 N ILE A 35 8.882 -15.341 -32.141 1.00 0.00 N ATOM 191 CA ILE A 35 9.295 -16.618 -32.760 1.00 0.00 C ATOM 192 C ILE A 35 10.353 -17.327 -31.889 1.00 0.00 C ATOM 193 O ILE A 35 10.437 -18.562 -31.888 1.00 0.00 O ATOM 194 CB ILE A 35 9.819 -16.385 -34.232 1.00 0.00 C ATOM 195 CG1 ILE A 35 8.725 -15.673 -35.099 1.00 0.00 C ATOM 196 CG2 ILE A 35 10.283 -17.704 -34.909 1.00 0.00 C ATOM 197 CD1 ILE A 35 7.395 -16.420 -35.220 1.00 0.00 C ATOM 0 H ILE A 35 9.144 -14.519 -32.686 1.00 0.00 H new ATOM 0 HA ILE A 35 8.424 -17.270 -32.821 1.00 0.00 H new ATOM 0 HB ILE A 35 10.693 -15.737 -34.164 1.00 0.00 H new ATOM 0 HG12 ILE A 35 8.532 -14.688 -34.673 1.00 0.00 H new ATOM 0 HG13 ILE A 35 9.126 -15.514 -36.100 1.00 0.00 H new ATOM 0 HG21 ILE A 35 10.634 -17.491 -35.919 1.00 0.00 H new ATOM 0 HG22 ILE A 35 11.093 -18.145 -34.329 1.00 0.00 H new ATOM 0 HG23 ILE A 35 9.448 -18.403 -34.955 1.00 0.00 H new ATOM 0 HD11 ILE A 35 6.709 -15.843 -35.839 1.00 0.00 H new ATOM 0 HD12 ILE A 35 7.565 -17.394 -35.678 1.00 0.00 H new ATOM 0 HD13 ILE A 35 6.962 -16.556 -34.229 1.00 0.00 H new ATOM 209 N ASN A 36 11.129 -16.521 -31.131 1.00 0.00 N ATOM 210 CA ASN A 36 12.054 -17.017 -30.103 1.00 0.00 C ATOM 211 C ASN A 36 11.241 -17.748 -29.015 1.00 0.00 C ATOM 212 O ASN A 36 10.629 -17.123 -28.137 1.00 0.00 O ATOM 213 CB ASN A 36 12.882 -15.843 -29.498 1.00 0.00 C ATOM 214 CG ASN A 36 13.799 -16.241 -28.333 1.00 0.00 C ATOM 215 OD1 ASN A 36 14.309 -17.362 -28.273 1.00 0.00 O ATOM 216 ND2 ASN A 36 14.007 -15.323 -27.399 1.00 0.00 N ATOM 0 H ASN A 36 11.127 -15.505 -31.220 1.00 0.00 H new ATOM 0 HA ASN A 36 12.762 -17.715 -30.549 1.00 0.00 H new ATOM 0 HB2 ASN A 36 13.490 -15.400 -30.287 1.00 0.00 H new ATOM 0 HB3 ASN A 36 12.194 -15.070 -29.154 1.00 0.00 H new ATOM 0 HD21 ASN A 36 14.605 -15.535 -26.600 1.00 0.00 H new ATOM 0 HD22 ASN A 36 13.569 -14.405 -27.480 1.00 0.00 H new ATOM 223 N SER A 37 11.199 -19.079 -29.139 1.00 0.00 N ATOM 224 CA SER A 37 10.416 -19.956 -28.264 1.00 0.00 C ATOM 225 C SER A 37 11.284 -20.566 -27.153 1.00 0.00 C ATOM 226 O SER A 37 10.784 -21.345 -26.355 1.00 0.00 O ATOM 227 CB SER A 37 9.771 -21.072 -29.119 1.00 0.00 C ATOM 228 OG SER A 37 10.758 -21.826 -29.805 1.00 0.00 O ATOM 0 H SER A 37 11.715 -19.583 -29.860 1.00 0.00 H new ATOM 0 HA SER A 37 9.640 -19.364 -27.779 1.00 0.00 H new ATOM 0 HB2 SER A 37 9.185 -21.732 -28.479 1.00 0.00 H new ATOM 0 HB3 SER A 37 9.081 -20.630 -29.838 1.00 0.00 H new ATOM 0 HG SER A 37 11.120 -22.512 -29.206 1.00 0.00 H new ATOM 234 N THR A 38 12.570 -20.179 -27.100 1.00 0.00 N ATOM 235 CA THR A 38 13.580 -20.779 -26.198 1.00 0.00 C ATOM 236 C THR A 38 13.130 -20.697 -24.720 1.00 0.00 C ATOM 237 O THR A 38 13.273 -21.661 -23.944 1.00 0.00 O ATOM 238 CB THR A 38 14.958 -20.061 -26.378 1.00 0.00 C ATOM 239 OG1 THR A 38 15.374 -20.154 -27.756 1.00 0.00 O ATOM 240 CG2 THR A 38 16.055 -20.653 -25.468 1.00 0.00 C ATOM 0 H THR A 38 12.946 -19.434 -27.686 1.00 0.00 H new ATOM 0 HA THR A 38 13.685 -21.831 -26.463 1.00 0.00 H new ATOM 0 HB THR A 38 14.822 -19.019 -26.090 1.00 0.00 H new ATOM 0 HG1 THR A 38 15.142 -19.325 -28.224 1.00 0.00 H new ATOM 0 HG21 THR A 38 16.991 -20.119 -25.632 1.00 0.00 H new ATOM 0 HG22 THR A 38 15.757 -20.550 -24.425 1.00 0.00 H new ATOM 0 HG23 THR A 38 16.193 -21.708 -25.704 1.00 0.00 H new ATOM 248 N ILE A 39 12.534 -19.541 -24.387 1.00 0.00 N ATOM 249 CA ILE A 39 12.046 -19.226 -23.041 1.00 0.00 C ATOM 250 C ILE A 39 10.900 -20.194 -22.660 1.00 0.00 C ATOM 251 O ILE A 39 10.896 -20.791 -21.577 1.00 0.00 O ATOM 252 CB ILE A 39 11.525 -17.735 -22.968 1.00 0.00 C ATOM 253 CG1 ILE A 39 12.518 -16.734 -23.667 1.00 0.00 C ATOM 254 CG2 ILE A 39 11.232 -17.306 -21.506 1.00 0.00 C ATOM 255 CD1 ILE A 39 13.936 -16.735 -23.122 1.00 0.00 C ATOM 0 H ILE A 39 12.377 -18.789 -25.058 1.00 0.00 H new ATOM 0 HA ILE A 39 12.872 -19.341 -22.339 1.00 0.00 H new ATOM 0 HB ILE A 39 10.585 -17.698 -23.519 1.00 0.00 H new ATOM 0 HG12 ILE A 39 12.556 -16.969 -24.731 1.00 0.00 H new ATOM 0 HG13 ILE A 39 12.113 -15.726 -23.578 1.00 0.00 H new ATOM 0 HG21 ILE A 39 10.876 -16.276 -21.494 1.00 0.00 H new ATOM 0 HG22 ILE A 39 10.469 -17.959 -21.081 1.00 0.00 H new ATOM 0 HG23 ILE A 39 12.145 -17.382 -20.915 1.00 0.00 H new ATOM 0 HD11 ILE A 39 14.538 -16.011 -23.672 1.00 0.00 H new ATOM 0 HD12 ILE A 39 13.920 -16.466 -22.066 1.00 0.00 H new ATOM 0 HD13 ILE A 39 14.369 -17.729 -23.237 1.00 0.00 H new ATOM 267 N GLU A 40 9.962 -20.377 -23.607 1.00 0.00 N ATOM 268 CA GLU A 40 8.721 -21.144 -23.380 1.00 0.00 C ATOM 269 C GLU A 40 8.968 -22.662 -23.532 1.00 0.00 C ATOM 270 O GLU A 40 8.186 -23.465 -23.027 1.00 0.00 O ATOM 271 CB GLU A 40 7.595 -20.628 -24.326 1.00 0.00 C ATOM 272 CG GLU A 40 7.670 -21.095 -25.789 1.00 0.00 C ATOM 273 CD GLU A 40 6.680 -20.357 -26.713 1.00 0.00 C ATOM 274 OE1 GLU A 40 6.923 -19.161 -27.012 1.00 0.00 O ATOM 275 OE2 GLU A 40 5.662 -20.952 -27.132 1.00 0.00 O ATOM 0 H GLU A 40 10.042 -19.998 -24.551 1.00 0.00 H new ATOM 0 HA GLU A 40 8.389 -20.987 -22.354 1.00 0.00 H new ATOM 0 HB2 GLU A 40 6.634 -20.939 -23.916 1.00 0.00 H new ATOM 0 HB3 GLU A 40 7.610 -19.538 -24.313 1.00 0.00 H new ATOM 0 HG2 GLU A 40 8.684 -20.945 -26.160 1.00 0.00 H new ATOM 0 HG3 GLU A 40 7.469 -22.165 -25.833 1.00 0.00 H new ATOM 282 N ASP A 41 10.080 -23.042 -24.209 1.00 0.00 N ATOM 283 CA ASP A 41 10.529 -24.455 -24.319 1.00 0.00 C ATOM 284 C ASP A 41 10.968 -24.964 -22.951 1.00 0.00 C ATOM 285 O ASP A 41 10.667 -26.096 -22.581 1.00 0.00 O ATOM 286 CB ASP A 41 11.706 -24.626 -25.335 1.00 0.00 C ATOM 287 CG ASP A 41 11.244 -24.692 -26.800 1.00 0.00 C ATOM 288 OD1 ASP A 41 10.579 -25.688 -27.172 1.00 0.00 O ATOM 289 OD2 ASP A 41 11.564 -23.787 -27.595 1.00 0.00 O ATOM 0 H ASP A 41 10.689 -22.382 -24.692 1.00 0.00 H new ATOM 0 HA ASP A 41 9.683 -25.036 -24.688 1.00 0.00 H new ATOM 0 HB2 ASP A 41 12.401 -23.794 -25.218 1.00 0.00 H new ATOM 0 HB3 ASP A 41 12.255 -25.536 -25.094 1.00 0.00 H new ATOM 294 N ALA A 42 11.689 -24.098 -22.218 1.00 0.00 N ATOM 295 CA ALA A 42 12.187 -24.397 -20.863 1.00 0.00 C ATOM 296 C ALA A 42 11.019 -24.667 -19.893 1.00 0.00 C ATOM 297 O ALA A 42 11.077 -25.588 -19.071 1.00 0.00 O ATOM 298 CB ALA A 42 13.070 -23.245 -20.355 1.00 0.00 C ATOM 0 H ALA A 42 11.944 -23.168 -22.549 1.00 0.00 H new ATOM 0 HA ALA A 42 12.794 -25.301 -20.910 1.00 0.00 H new ATOM 0 HB1 ALA A 42 13.431 -23.478 -19.353 1.00 0.00 H new ATOM 0 HB2 ALA A 42 13.919 -23.114 -21.026 1.00 0.00 H new ATOM 0 HB3 ALA A 42 12.486 -22.325 -20.325 1.00 0.00 H new ATOM 304 N ILE A 43 9.948 -23.867 -20.024 1.00 0.00 N ATOM 305 CA ILE A 43 8.744 -23.971 -19.175 1.00 0.00 C ATOM 306 C ILE A 43 7.904 -25.216 -19.563 1.00 0.00 C ATOM 307 O ILE A 43 7.363 -25.924 -18.693 1.00 0.00 O ATOM 308 CB ILE A 43 7.868 -22.658 -19.288 1.00 0.00 C ATOM 309 CG1 ILE A 43 8.718 -21.376 -18.983 1.00 0.00 C ATOM 310 CG2 ILE A 43 6.628 -22.719 -18.361 1.00 0.00 C ATOM 311 CD1 ILE A 43 9.296 -21.305 -17.572 1.00 0.00 C ATOM 0 H ILE A 43 9.890 -23.127 -20.723 1.00 0.00 H new ATOM 0 HA ILE A 43 9.067 -24.084 -18.140 1.00 0.00 H new ATOM 0 HB ILE A 43 7.516 -22.597 -20.318 1.00 0.00 H new ATOM 0 HG12 ILE A 43 9.539 -21.324 -19.698 1.00 0.00 H new ATOM 0 HG13 ILE A 43 8.095 -20.497 -19.149 1.00 0.00 H new ATOM 0 HG21 ILE A 43 6.050 -21.801 -18.465 1.00 0.00 H new ATOM 0 HG22 ILE A 43 6.008 -23.571 -18.639 1.00 0.00 H new ATOM 0 HG23 ILE A 43 6.952 -22.828 -17.326 1.00 0.00 H new ATOM 0 HD11 ILE A 43 9.867 -20.383 -17.459 1.00 0.00 H new ATOM 0 HD12 ILE A 43 8.484 -21.321 -16.845 1.00 0.00 H new ATOM 0 HD13 ILE A 43 9.951 -22.160 -17.403 1.00 0.00 H new ATOM 323 N ALA A 44 7.829 -25.480 -20.878 1.00 0.00 N ATOM 324 CA ALA A 44 7.022 -26.578 -21.439 1.00 0.00 C ATOM 325 C ALA A 44 7.646 -27.957 -21.142 1.00 0.00 C ATOM 326 O ALA A 44 6.928 -28.920 -20.863 1.00 0.00 O ATOM 327 CB ALA A 44 6.842 -26.380 -22.947 1.00 0.00 C ATOM 0 H ALA A 44 8.327 -24.937 -21.584 1.00 0.00 H new ATOM 0 HA ALA A 44 6.045 -26.555 -20.957 1.00 0.00 H new ATOM 0 HB1 ALA A 44 6.244 -27.196 -23.352 1.00 0.00 H new ATOM 0 HB2 ALA A 44 6.335 -25.433 -23.132 1.00 0.00 H new ATOM 0 HB3 ALA A 44 7.818 -26.370 -23.432 1.00 0.00 H new ATOM 333 N ARG A 45 8.985 -28.041 -21.190 1.00 0.00 N ATOM 334 CA ARG A 45 9.711 -29.307 -20.943 1.00 0.00 C ATOM 335 C ARG A 45 9.756 -29.624 -19.440 1.00 0.00 C ATOM 336 O ARG A 45 9.908 -30.786 -19.046 1.00 0.00 O ATOM 337 CB ARG A 45 11.145 -29.246 -21.539 1.00 0.00 C ATOM 338 CG ARG A 45 12.144 -28.363 -20.757 1.00 0.00 C ATOM 339 CD ARG A 45 13.468 -28.146 -21.508 1.00 0.00 C ATOM 340 NE ARG A 45 14.470 -27.454 -20.669 1.00 0.00 N ATOM 341 CZ ARG A 45 15.512 -26.742 -21.128 1.00 0.00 C ATOM 342 NH1 ARG A 45 15.656 -26.502 -22.426 1.00 0.00 N ATOM 343 NH2 ARG A 45 16.401 -26.257 -20.275 1.00 0.00 N ATOM 0 H ARG A 45 9.592 -27.248 -21.398 1.00 0.00 H new ATOM 0 HA ARG A 45 9.172 -30.112 -21.443 1.00 0.00 H new ATOM 0 HB2 ARG A 45 11.543 -30.259 -21.591 1.00 0.00 H new ATOM 0 HB3 ARG A 45 11.081 -28.876 -22.562 1.00 0.00 H new ATOM 0 HG2 ARG A 45 11.684 -27.396 -20.555 1.00 0.00 H new ATOM 0 HG3 ARG A 45 12.351 -28.825 -19.792 1.00 0.00 H new ATOM 0 HD2 ARG A 45 13.866 -29.109 -21.829 1.00 0.00 H new ATOM 0 HD3 ARG A 45 13.283 -27.561 -22.409 1.00 0.00 H new ATOM 0 HE ARG A 45 14.361 -27.523 -19.657 1.00 0.00 H new ATOM 0 HH11 ARG A 45 14.970 -26.860 -23.090 1.00 0.00 H new ATOM 0 HH12 ARG A 45 16.453 -25.959 -22.759 1.00 0.00 H new ATOM 0 HH21 ARG A 45 16.292 -26.425 -19.275 1.00 0.00 H new ATOM 0 HH22 ARG A 45 17.194 -25.716 -20.618 1.00 0.00 H new ATOM 357 N ALA A 46 9.617 -28.575 -18.611 1.00 0.00 N ATOM 358 CA ALA A 46 9.678 -28.688 -17.154 1.00 0.00 C ATOM 359 C ALA A 46 8.394 -29.320 -16.592 1.00 0.00 C ATOM 360 O ALA A 46 8.443 -30.366 -15.932 1.00 0.00 O ATOM 361 CB ALA A 46 9.916 -27.304 -16.534 1.00 0.00 C ATOM 0 H ALA A 46 9.459 -27.623 -18.940 1.00 0.00 H new ATOM 0 HA ALA A 46 10.510 -29.342 -16.893 1.00 0.00 H new ATOM 0 HB1 ALA A 46 9.961 -27.394 -15.449 1.00 0.00 H new ATOM 0 HB2 ALA A 46 10.857 -26.897 -16.903 1.00 0.00 H new ATOM 0 HB3 ALA A 46 9.099 -26.637 -16.809 1.00 0.00 H new ATOM 367 N ARG A 47 7.238 -28.690 -16.888 1.00 0.00 N ATOM 368 CA ARG A 47 5.942 -29.079 -16.286 1.00 0.00 C ATOM 369 C ARG A 47 4.781 -29.072 -17.304 1.00 0.00 C ATOM 370 O ARG A 47 3.662 -29.457 -16.956 1.00 0.00 O ATOM 371 CB ARG A 47 5.655 -28.167 -15.047 1.00 0.00 C ATOM 372 CG ARG A 47 5.725 -26.626 -15.293 1.00 0.00 C ATOM 373 CD ARG A 47 4.434 -26.031 -15.890 1.00 0.00 C ATOM 374 NE ARG A 47 3.293 -26.119 -14.955 1.00 0.00 N ATOM 375 CZ ARG A 47 2.046 -26.538 -15.254 1.00 0.00 C ATOM 376 NH1 ARG A 47 1.742 -26.978 -16.465 1.00 0.00 N ATOM 377 NH2 ARG A 47 1.109 -26.519 -14.321 1.00 0.00 N ATOM 0 H ARG A 47 7.174 -27.909 -17.541 1.00 0.00 H new ATOM 0 HA ARG A 47 6.015 -30.114 -15.952 1.00 0.00 H new ATOM 0 HB2 ARG A 47 4.662 -28.408 -14.667 1.00 0.00 H new ATOM 0 HB3 ARG A 47 6.367 -28.421 -14.262 1.00 0.00 H new ATOM 0 HG2 ARG A 47 5.941 -26.126 -14.349 1.00 0.00 H new ATOM 0 HG3 ARG A 47 6.557 -26.412 -15.964 1.00 0.00 H new ATOM 0 HD2 ARG A 47 4.605 -24.987 -16.154 1.00 0.00 H new ATOM 0 HD3 ARG A 47 4.187 -26.556 -16.812 1.00 0.00 H new ATOM 0 HE ARG A 47 3.465 -25.836 -13.990 1.00 0.00 H new ATOM 0 HH11 ARG A 47 2.457 -27.005 -17.192 1.00 0.00 H new ATOM 0 HH12 ARG A 47 0.793 -27.290 -16.671 1.00 0.00 H new ATOM 0 HH21 ARG A 47 1.331 -26.189 -13.382 1.00 0.00 H new ATOM 0 HH22 ARG A 47 0.164 -26.834 -14.541 1.00 0.00 H new ATOM 391 N GLY A 48 5.057 -28.651 -18.554 1.00 0.00 N ATOM 392 CA GLY A 48 4.040 -28.649 -19.621 1.00 0.00 C ATOM 393 C GLY A 48 2.958 -27.592 -19.435 1.00 0.00 C ATOM 394 O GLY A 48 1.776 -27.925 -19.275 1.00 0.00 O ATOM 0 H GLY A 48 5.972 -28.309 -18.848 1.00 0.00 H new ATOM 0 HA2 GLY A 48 4.533 -28.487 -20.580 1.00 0.00 H new ATOM 0 HA3 GLY A 48 3.571 -29.632 -19.666 1.00 0.00 H new ATOM 398 N GLU A 49 3.370 -26.316 -19.413 1.00 0.00 N ATOM 399 CA GLU A 49 2.437 -25.170 -19.313 1.00 0.00 C ATOM 400 C GLU A 49 1.948 -24.783 -20.713 1.00 0.00 C ATOM 401 O GLU A 49 0.761 -24.938 -21.041 1.00 0.00 O ATOM 402 CB GLU A 49 3.135 -23.973 -18.622 1.00 0.00 C ATOM 403 CG GLU A 49 2.284 -22.688 -18.512 1.00 0.00 C ATOM 404 CD GLU A 49 3.051 -21.513 -17.883 1.00 0.00 C ATOM 405 OE1 GLU A 49 3.753 -20.791 -18.626 1.00 0.00 O ATOM 406 OE2 GLU A 49 2.985 -21.325 -16.648 1.00 0.00 O ATOM 0 H GLU A 49 4.352 -26.044 -19.463 1.00 0.00 H new ATOM 0 HA GLU A 49 1.576 -25.455 -18.708 1.00 0.00 H new ATOM 0 HB2 GLU A 49 3.435 -24.278 -17.619 1.00 0.00 H new ATOM 0 HB3 GLU A 49 4.047 -23.739 -19.171 1.00 0.00 H new ATOM 0 HG2 GLU A 49 1.940 -22.400 -19.505 1.00 0.00 H new ATOM 0 HG3 GLU A 49 1.396 -22.897 -17.915 1.00 0.00 H new ATOM 413 N ILE A 50 2.885 -24.274 -21.533 1.00 0.00 N ATOM 414 CA ILE A 50 2.614 -23.907 -22.922 1.00 0.00 C ATOM 415 C ILE A 50 2.707 -25.169 -23.811 1.00 0.00 C ATOM 416 O ILE A 50 3.615 -25.985 -23.626 1.00 0.00 O ATOM 417 CB ILE A 50 3.594 -22.776 -23.444 1.00 0.00 C ATOM 418 CG1 ILE A 50 3.328 -21.433 -22.677 1.00 0.00 C ATOM 419 CG2 ILE A 50 3.479 -22.563 -24.982 1.00 0.00 C ATOM 420 CD1 ILE A 50 3.981 -20.200 -23.284 1.00 0.00 C ATOM 0 H ILE A 50 3.849 -24.108 -21.245 1.00 0.00 H new ATOM 0 HA ILE A 50 1.606 -23.495 -22.975 1.00 0.00 H new ATOM 0 HB ILE A 50 4.613 -23.106 -23.243 1.00 0.00 H new ATOM 0 HG12 ILE A 50 2.252 -21.268 -22.629 1.00 0.00 H new ATOM 0 HG13 ILE A 50 3.680 -21.543 -21.651 1.00 0.00 H new ATOM 0 HG21 ILE A 50 4.169 -21.779 -25.293 1.00 0.00 H new ATOM 0 HG22 ILE A 50 3.728 -23.491 -25.497 1.00 0.00 H new ATOM 0 HG23 ILE A 50 2.460 -22.270 -25.234 1.00 0.00 H new ATOM 0 HD11 ILE A 50 3.737 -19.325 -22.681 1.00 0.00 H new ATOM 0 HD12 ILE A 50 5.062 -20.335 -23.307 1.00 0.00 H new ATOM 0 HD13 ILE A 50 3.612 -20.055 -24.299 1.00 0.00 H new ATOM 432 N PRO A 51 1.734 -25.359 -24.755 1.00 0.00 N ATOM 433 CA PRO A 51 1.837 -26.349 -25.877 1.00 0.00 C ATOM 434 C PRO A 51 2.991 -25.998 -26.857 1.00 0.00 C ATOM 435 O PRO A 51 4.065 -25.547 -26.443 1.00 0.00 O ATOM 436 CB PRO A 51 0.428 -26.217 -26.543 1.00 0.00 C ATOM 437 CG PRO A 51 -0.008 -24.825 -26.203 1.00 0.00 C ATOM 438 CD PRO A 51 0.428 -24.641 -24.780 1.00 0.00 C ATOM 0 HA PRO A 51 2.074 -27.363 -25.555 1.00 0.00 H new ATOM 0 HB2 PRO A 51 0.481 -26.366 -27.621 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -0.268 -26.959 -26.153 1.00 0.00 H new ATOM 0 HG2 PRO A 51 0.457 -24.090 -26.860 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -1.087 -24.709 -26.307 1.00 0.00 H new ATOM 0 HD2 PRO A 51 0.537 -23.588 -24.521 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -0.286 -25.070 -24.077 1.00 0.00 H new ATOM 446 N ARG A 52 2.774 -26.258 -28.153 1.00 0.00 N ATOM 447 CA ARG A 52 3.649 -25.751 -29.237 1.00 0.00 C ATOM 448 C ARG A 52 3.559 -24.209 -29.390 1.00 0.00 C ATOM 449 O ARG A 52 4.310 -23.618 -30.179 1.00 0.00 O ATOM 450 CB ARG A 52 3.295 -26.456 -30.581 1.00 0.00 C ATOM 451 CG ARG A 52 3.724 -27.939 -30.653 1.00 0.00 C ATOM 452 CD ARG A 52 3.248 -28.652 -31.937 1.00 0.00 C ATOM 453 NE ARG A 52 3.654 -27.945 -33.175 1.00 0.00 N ATOM 454 CZ ARG A 52 4.150 -28.518 -34.288 1.00 0.00 C ATOM 455 NH1 ARG A 52 4.439 -29.815 -34.321 1.00 0.00 N ATOM 456 NH2 ARG A 52 4.378 -27.774 -35.359 1.00 0.00 N ATOM 0 H ARG A 52 1.993 -26.822 -28.486 1.00 0.00 H new ATOM 0 HA ARG A 52 4.679 -25.985 -28.967 1.00 0.00 H new ATOM 0 HB2 ARG A 52 2.218 -26.393 -30.738 1.00 0.00 H new ATOM 0 HB3 ARG A 52 3.769 -25.913 -31.399 1.00 0.00 H new ATOM 0 HG2 ARG A 52 4.811 -27.999 -30.595 1.00 0.00 H new ATOM 0 HG3 ARG A 52 3.329 -28.467 -29.785 1.00 0.00 H new ATOM 0 HD2 ARG A 52 3.651 -29.665 -31.955 1.00 0.00 H new ATOM 0 HD3 ARG A 52 2.162 -28.741 -31.915 1.00 0.00 H new ATOM 0 HE ARG A 52 3.548 -26.931 -33.185 1.00 0.00 H new ATOM 0 HH11 ARG A 52 4.286 -30.393 -33.495 1.00 0.00 H new ATOM 0 HH12 ARG A 52 4.814 -30.232 -35.173 1.00 0.00 H new ATOM 0 HH21 ARG A 52 4.178 -26.774 -35.337 1.00 0.00 H new ATOM 0 HH22 ARG A 52 4.754 -28.201 -36.206 1.00 0.00 H new ATOM 470 N GLY A 53 2.608 -23.577 -28.657 1.00 0.00 N ATOM 471 CA GLY A 53 2.375 -22.129 -28.725 1.00 0.00 C ATOM 472 C GLY A 53 1.544 -21.726 -29.938 1.00 0.00 C ATOM 473 O GLY A 53 1.202 -20.551 -30.103 1.00 0.00 O ATOM 0 H GLY A 53 1.989 -24.062 -28.008 1.00 0.00 H new ATOM 0 HA2 GLY A 53 1.868 -21.803 -27.817 1.00 0.00 H new ATOM 0 HA3 GLY A 53 3.334 -21.611 -28.758 1.00 0.00 H new ATOM 477 N GLU A 54 1.215 -22.717 -30.781 1.00 0.00 N ATOM 478 CA GLU A 54 0.485 -22.523 -32.041 1.00 0.00 C ATOM 479 C GLU A 54 -0.998 -22.868 -31.838 1.00 0.00 C ATOM 480 O GLU A 54 -1.466 -23.020 -30.698 1.00 0.00 O ATOM 481 CB GLU A 54 1.122 -23.420 -33.139 1.00 0.00 C ATOM 482 CG GLU A 54 2.631 -23.187 -33.354 1.00 0.00 C ATOM 483 CD GLU A 54 3.237 -24.039 -34.485 1.00 0.00 C ATOM 484 OE1 GLU A 54 3.145 -25.283 -34.409 1.00 0.00 O ATOM 485 OE2 GLU A 54 3.846 -23.480 -35.422 1.00 0.00 O ATOM 0 H GLU A 54 1.454 -23.692 -30.602 1.00 0.00 H new ATOM 0 HA GLU A 54 0.550 -21.482 -32.357 1.00 0.00 H new ATOM 0 HB2 GLU A 54 0.962 -24.465 -32.875 1.00 0.00 H new ATOM 0 HB3 GLU A 54 0.602 -23.246 -34.081 1.00 0.00 H new ATOM 0 HG2 GLU A 54 2.798 -22.133 -33.576 1.00 0.00 H new ATOM 0 HG3 GLU A 54 3.159 -23.405 -32.425 1.00 0.00 H new ATOM 492 N SER A 55 -1.731 -22.963 -32.957 1.00 0.00 N ATOM 493 CA SER A 55 -3.150 -23.308 -32.965 1.00 0.00 C ATOM 494 C SER A 55 -3.374 -24.742 -32.449 1.00 0.00 C ATOM 495 O SER A 55 -3.187 -25.719 -33.185 1.00 0.00 O ATOM 496 CB SER A 55 -3.692 -23.150 -34.390 1.00 0.00 C ATOM 497 OG SER A 55 -3.380 -21.866 -34.906 1.00 0.00 O ATOM 0 H SER A 55 -1.347 -22.800 -33.888 1.00 0.00 H new ATOM 0 HA SER A 55 -3.687 -22.636 -32.296 1.00 0.00 H new ATOM 0 HB2 SER A 55 -3.266 -23.919 -35.034 1.00 0.00 H new ATOM 0 HB3 SER A 55 -4.772 -23.295 -34.392 1.00 0.00 H new ATOM 0 HG SER A 55 -4.120 -21.250 -34.721 1.00 0.00 H new ATOM 503 N LEU A 56 -3.751 -24.840 -31.171 1.00 0.00 N ATOM 504 CA LEU A 56 -3.962 -26.127 -30.475 1.00 0.00 C ATOM 505 C LEU A 56 -5.285 -26.795 -30.917 1.00 0.00 C ATOM 506 O LEU A 56 -6.070 -26.200 -31.672 1.00 0.00 O ATOM 507 CB LEU A 56 -3.879 -25.918 -28.917 1.00 0.00 C ATOM 508 CG LEU A 56 -4.629 -24.679 -28.302 1.00 0.00 C ATOM 509 CD1 LEU A 56 -6.144 -24.737 -28.526 1.00 0.00 C ATOM 510 CD2 LEU A 56 -4.318 -24.494 -26.799 1.00 0.00 C ATOM 0 H LEU A 56 -3.921 -24.026 -30.580 1.00 0.00 H new ATOM 0 HA LEU A 56 -3.166 -26.816 -30.756 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -4.267 -26.816 -28.437 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -2.826 -25.841 -28.645 1.00 0.00 H new ATOM 0 HG LEU A 56 -4.246 -23.810 -28.838 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -6.611 -23.858 -28.082 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -6.353 -24.758 -29.596 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -6.546 -25.637 -28.060 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -4.858 -23.627 -26.420 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -4.629 -25.383 -26.251 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -3.247 -24.341 -26.665 1.00 0.00 H new ATOM 522 N ASP A 57 -5.535 -28.018 -30.424 1.00 0.00 N ATOM 523 CA ASP A 57 -6.730 -28.818 -30.785 1.00 0.00 C ATOM 524 C ASP A 57 -7.663 -28.985 -29.555 1.00 0.00 C ATOM 525 O ASP A 57 -8.733 -29.598 -29.635 1.00 0.00 O ATOM 526 CB ASP A 57 -6.257 -30.191 -31.333 1.00 0.00 C ATOM 527 CG ASP A 57 -7.372 -31.026 -31.985 1.00 0.00 C ATOM 528 OD1 ASP A 57 -7.763 -30.724 -33.139 1.00 0.00 O ATOM 529 OD2 ASP A 57 -7.885 -31.972 -31.341 1.00 0.00 O ATOM 0 H ASP A 57 -4.917 -28.487 -29.762 1.00 0.00 H new ATOM 0 HA ASP A 57 -7.306 -28.307 -31.556 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -5.467 -30.025 -32.065 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -5.819 -30.765 -30.516 1.00 0.00 H new ATOM 534 N GLU A 58 -7.284 -28.339 -28.435 1.00 0.00 N ATOM 535 CA GLU A 58 -7.942 -28.495 -27.112 1.00 0.00 C ATOM 536 C GLU A 58 -8.027 -27.123 -26.419 1.00 0.00 C ATOM 537 O GLU A 58 -7.004 -26.554 -26.039 1.00 0.00 O ATOM 538 CB GLU A 58 -7.162 -29.491 -26.206 1.00 0.00 C ATOM 539 CG GLU A 58 -7.218 -30.958 -26.665 1.00 0.00 C ATOM 540 CD GLU A 58 -6.276 -31.872 -25.866 1.00 0.00 C ATOM 541 OE1 GLU A 58 -5.061 -31.902 -26.176 1.00 0.00 O ATOM 542 OE2 GLU A 58 -6.735 -32.535 -24.907 1.00 0.00 O ATOM 0 H GLU A 58 -6.502 -27.684 -28.418 1.00 0.00 H new ATOM 0 HA GLU A 58 -8.943 -28.896 -27.272 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -6.119 -29.179 -26.160 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -7.559 -29.426 -25.193 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -8.240 -31.325 -26.568 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -6.958 -31.013 -27.722 1.00 0.00 H new ATOM 549 N CYS A 59 -9.259 -26.601 -26.312 1.00 0.00 N ATOM 550 CA CYS A 59 -9.590 -25.326 -25.626 1.00 0.00 C ATOM 551 C CYS A 59 -8.970 -25.244 -24.221 1.00 0.00 C ATOM 552 O CYS A 59 -9.075 -26.195 -23.465 1.00 0.00 O ATOM 553 CB CYS A 59 -11.123 -25.250 -25.545 1.00 0.00 C ATOM 554 SG CYS A 59 -11.827 -23.792 -24.737 1.00 0.00 S ATOM 0 H CYS A 59 -10.079 -27.060 -26.708 1.00 0.00 H new ATOM 0 HA CYS A 59 -9.178 -24.487 -26.186 1.00 0.00 H new ATOM 0 HB2 CYS A 59 -11.520 -25.301 -26.559 1.00 0.00 H new ATOM 0 HB3 CYS A 59 -11.480 -26.135 -25.019 1.00 0.00 H new ATOM 559 N GLU A 60 -8.324 -24.115 -23.862 1.00 0.00 N ATOM 560 CA GLU A 60 -7.704 -23.998 -22.509 1.00 0.00 C ATOM 561 C GLU A 60 -8.752 -23.584 -21.446 1.00 0.00 C ATOM 562 O GLU A 60 -8.480 -23.637 -20.245 1.00 0.00 O ATOM 563 CB GLU A 60 -6.510 -23.012 -22.503 1.00 0.00 C ATOM 564 CG GLU A 60 -6.879 -21.564 -22.853 1.00 0.00 C ATOM 565 CD GLU A 60 -5.769 -20.562 -22.526 1.00 0.00 C ATOM 566 OE1 GLU A 60 -4.743 -20.529 -23.242 1.00 0.00 O ATOM 567 OE2 GLU A 60 -5.925 -19.776 -21.576 1.00 0.00 O ATOM 0 H GLU A 60 -8.215 -23.295 -24.459 1.00 0.00 H new ATOM 0 HA GLU A 60 -7.321 -24.985 -22.251 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -6.047 -23.027 -21.516 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -5.761 -23.364 -23.212 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -7.113 -21.503 -23.916 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -7.782 -21.285 -22.311 1.00 0.00 H new ATOM 574 N GLU A 61 -9.958 -23.216 -21.908 1.00 0.00 N ATOM 575 CA GLU A 61 -11.049 -22.752 -21.029 1.00 0.00 C ATOM 576 C GLU A 61 -11.919 -23.926 -20.571 1.00 0.00 C ATOM 577 O GLU A 61 -12.324 -23.990 -19.410 1.00 0.00 O ATOM 578 CB GLU A 61 -11.935 -21.726 -21.770 1.00 0.00 C ATOM 579 CG GLU A 61 -11.185 -20.502 -22.305 1.00 0.00 C ATOM 580 CD GLU A 61 -10.480 -19.666 -21.221 1.00 0.00 C ATOM 581 OE1 GLU A 61 -11.172 -18.919 -20.498 1.00 0.00 O ATOM 582 OE2 GLU A 61 -9.237 -19.747 -21.095 1.00 0.00 O ATOM 0 H GLU A 61 -10.206 -23.231 -22.897 1.00 0.00 H new ATOM 0 HA GLU A 61 -10.596 -22.283 -20.156 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -12.428 -22.227 -22.604 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -12.719 -21.387 -21.093 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -10.443 -20.834 -23.031 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -11.889 -19.864 -22.839 1.00 0.00 H new ATOM 589 N CYS A 62 -12.222 -24.851 -21.509 1.00 0.00 N ATOM 590 CA CYS A 62 -13.141 -25.979 -21.221 1.00 0.00 C ATOM 591 C CYS A 62 -12.741 -27.289 -21.944 1.00 0.00 C ATOM 592 O CYS A 62 -13.548 -28.221 -22.019 1.00 0.00 O ATOM 593 CB CYS A 62 -14.606 -25.567 -21.550 1.00 0.00 C ATOM 594 SG CYS A 62 -15.048 -25.451 -23.326 1.00 0.00 S ATOM 0 H CYS A 62 -11.851 -24.842 -22.459 1.00 0.00 H new ATOM 0 HA CYS A 62 -13.064 -26.198 -20.156 1.00 0.00 H new ATOM 0 HB2 CYS A 62 -15.276 -26.286 -21.079 1.00 0.00 H new ATOM 0 HB3 CYS A 62 -14.800 -24.599 -21.087 1.00 0.00 H new ATOM 599 N GLY A 63 -11.483 -27.361 -22.444 1.00 0.00 N ATOM 600 CA GLY A 63 -10.925 -28.558 -23.136 1.00 0.00 C ATOM 601 C GLY A 63 -11.713 -29.037 -24.346 1.00 0.00 C ATOM 602 O GLY A 63 -11.462 -30.131 -24.864 1.00 0.00 O ATOM 0 H GLY A 63 -10.820 -26.588 -22.380 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -9.907 -28.332 -23.453 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -10.862 -29.375 -22.418 1.00 0.00 H new ATOM 606 N ALA A 64 -12.641 -28.199 -24.812 1.00 0.00 N ATOM 607 CA ALA A 64 -13.586 -28.542 -25.875 1.00 0.00 C ATOM 608 C ALA A 64 -12.886 -28.540 -27.249 1.00 0.00 C ATOM 609 O ALA A 64 -12.016 -27.679 -27.481 1.00 0.00 O ATOM 610 CB ALA A 64 -14.763 -27.565 -25.846 1.00 0.00 C ATOM 0 H ALA A 64 -12.758 -27.250 -24.456 1.00 0.00 H new ATOM 0 HA ALA A 64 -13.967 -29.549 -25.707 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -15.467 -27.820 -26.638 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -15.264 -27.628 -24.880 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -14.397 -26.550 -25.999 1.00 0.00 H new ATOM 616 N PRO A 65 -13.244 -29.504 -28.163 1.00 0.00 N ATOM 617 CA PRO A 65 -12.595 -29.655 -29.490 1.00 0.00 C ATOM 618 C PRO A 65 -12.540 -28.345 -30.309 1.00 0.00 C ATOM 619 O PRO A 65 -13.578 -27.791 -30.687 1.00 0.00 O ATOM 620 CB PRO A 65 -13.471 -30.723 -30.197 1.00 0.00 C ATOM 621 CG PRO A 65 -14.035 -31.539 -29.076 1.00 0.00 C ATOM 622 CD PRO A 65 -14.300 -30.545 -27.967 1.00 0.00 C ATOM 0 HA PRO A 65 -11.547 -29.938 -29.390 1.00 0.00 H new ATOM 0 HB2 PRO A 65 -14.261 -30.261 -30.789 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -12.880 -31.336 -30.877 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -14.951 -32.047 -29.379 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -13.334 -32.310 -28.757 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -15.301 -30.119 -28.042 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -14.225 -31.012 -26.985 1.00 0.00 H new ATOM 630 N ILE A 66 -11.309 -27.842 -30.518 1.00 0.00 N ATOM 631 CA ILE A 66 -11.030 -26.667 -31.361 1.00 0.00 C ATOM 632 C ILE A 66 -11.252 -27.027 -32.854 1.00 0.00 C ATOM 633 O ILE A 66 -10.604 -27.953 -33.364 1.00 0.00 O ATOM 634 CB ILE A 66 -9.547 -26.176 -31.145 1.00 0.00 C ATOM 635 CG1 ILE A 66 -9.258 -25.907 -29.646 1.00 0.00 C ATOM 636 CG2 ILE A 66 -9.240 -24.920 -31.993 1.00 0.00 C ATOM 637 CD1 ILE A 66 -9.712 -24.575 -29.130 1.00 0.00 C ATOM 0 H ILE A 66 -10.471 -28.246 -30.100 1.00 0.00 H new ATOM 0 HA ILE A 66 -11.710 -25.863 -31.078 1.00 0.00 H new ATOM 0 HB ILE A 66 -8.888 -26.977 -31.479 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -9.737 -26.688 -29.056 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -8.184 -25.995 -29.480 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -8.210 -24.608 -31.821 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -9.377 -25.152 -33.049 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -9.916 -24.114 -31.708 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -9.461 -24.490 -28.073 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -9.214 -23.781 -29.686 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -10.791 -24.485 -29.256 1.00 0.00 H new ATOM 649 N PRO A 67 -12.177 -26.313 -33.575 1.00 0.00 N ATOM 650 CA PRO A 67 -12.433 -26.569 -35.007 1.00 0.00 C ATOM 651 C PRO A 67 -11.354 -25.920 -35.908 1.00 0.00 C ATOM 652 O PRO A 67 -10.738 -24.905 -35.527 1.00 0.00 O ATOM 653 CB PRO A 67 -13.827 -25.941 -35.217 1.00 0.00 C ATOM 654 CG PRO A 67 -13.869 -24.795 -34.259 1.00 0.00 C ATOM 655 CD PRO A 67 -13.038 -25.217 -33.058 1.00 0.00 C ATOM 0 HA PRO A 67 -12.398 -27.626 -35.273 1.00 0.00 H new ATOM 0 HB2 PRO A 67 -13.960 -25.604 -36.245 1.00 0.00 H new ATOM 0 HB3 PRO A 67 -14.621 -26.659 -35.012 1.00 0.00 H new ATOM 0 HG2 PRO A 67 -13.464 -23.891 -34.715 1.00 0.00 H new ATOM 0 HG3 PRO A 67 -14.894 -24.571 -33.964 1.00 0.00 H new ATOM 0 HD2 PRO A 67 -12.441 -24.389 -32.676 1.00 0.00 H new ATOM 0 HD3 PRO A 67 -13.669 -25.560 -32.238 1.00 0.00 H new ATOM 663 N GLN A 68 -11.150 -26.507 -37.106 1.00 0.00 N ATOM 664 CA GLN A 68 -10.093 -26.090 -38.049 1.00 0.00 C ATOM 665 C GLN A 68 -10.256 -24.626 -38.478 1.00 0.00 C ATOM 666 O GLN A 68 -9.267 -23.963 -38.777 1.00 0.00 O ATOM 667 CB GLN A 68 -10.062 -27.032 -39.295 1.00 0.00 C ATOM 668 CG GLN A 68 -11.312 -26.962 -40.226 1.00 0.00 C ATOM 669 CD GLN A 68 -11.112 -26.196 -41.558 1.00 0.00 C ATOM 670 OE1 GLN A 68 -10.186 -25.242 -41.619 1.00 0.00 O flip ATOM 671 NE2 GLN A 68 -11.789 -26.485 -42.544 1.00 0.00 N flip ATOM 0 H GLN A 68 -11.715 -27.285 -37.446 1.00 0.00 H new ATOM 0 HA GLN A 68 -9.139 -26.172 -37.528 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -9.178 -26.794 -39.886 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -9.947 -28.059 -38.949 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -11.629 -27.979 -40.457 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -12.127 -26.492 -39.676 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -12.495 -27.219 -42.481 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -11.644 -25.991 -43.425 1.00 0.00 H new ATOM 680 N ALA A 69 -11.515 -24.140 -38.487 1.00 0.00 N ATOM 681 CA ALA A 69 -11.859 -22.756 -38.861 1.00 0.00 C ATOM 682 C ALA A 69 -11.148 -21.748 -37.940 1.00 0.00 C ATOM 683 O ALA A 69 -10.568 -20.773 -38.404 1.00 0.00 O ATOM 684 CB ALA A 69 -13.385 -22.559 -38.812 1.00 0.00 C ATOM 0 H ALA A 69 -12.326 -24.703 -38.233 1.00 0.00 H new ATOM 0 HA ALA A 69 -11.517 -22.576 -39.880 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -13.629 -21.534 -39.090 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -13.863 -23.247 -39.509 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -13.745 -22.757 -37.802 1.00 0.00 H new ATOM 690 N ARG A 70 -11.173 -22.032 -36.627 1.00 0.00 N ATOM 691 CA ARG A 70 -10.541 -21.172 -35.609 1.00 0.00 C ATOM 692 C ARG A 70 -9.009 -21.305 -35.656 1.00 0.00 C ATOM 693 O ARG A 70 -8.289 -20.347 -35.374 1.00 0.00 O ATOM 694 CB ARG A 70 -11.096 -21.502 -34.198 1.00 0.00 C ATOM 695 CG ARG A 70 -12.633 -21.329 -34.039 1.00 0.00 C ATOM 696 CD ARG A 70 -13.137 -19.871 -34.226 1.00 0.00 C ATOM 697 NE ARG A 70 -13.118 -19.421 -35.634 1.00 0.00 N ATOM 698 CZ ARG A 70 -12.827 -18.174 -36.051 1.00 0.00 C ATOM 699 NH1 ARG A 70 -12.507 -17.217 -35.187 1.00 0.00 N ATOM 700 NH2 ARG A 70 -12.845 -17.901 -37.340 1.00 0.00 N ATOM 0 H ARG A 70 -11.629 -22.859 -36.242 1.00 0.00 H new ATOM 0 HA ARG A 70 -10.788 -20.134 -35.831 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -10.834 -22.531 -33.953 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -10.596 -20.864 -33.469 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -13.135 -21.970 -34.763 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -12.925 -21.677 -33.048 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -14.154 -19.793 -33.841 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -12.518 -19.201 -33.629 1.00 0.00 H new ATOM 0 HE ARG A 70 -13.344 -20.112 -36.349 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -12.478 -17.421 -34.188 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -12.290 -16.279 -35.523 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -13.078 -18.631 -38.013 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -12.626 -16.959 -37.665 1.00 0.00 H new ATOM 714 N ARG A 71 -8.532 -22.507 -36.025 1.00 0.00 N ATOM 715 CA ARG A 71 -7.092 -22.819 -36.086 1.00 0.00 C ATOM 716 C ARG A 71 -6.396 -22.092 -37.259 1.00 0.00 C ATOM 717 O ARG A 71 -5.298 -21.550 -37.089 1.00 0.00 O ATOM 718 CB ARG A 71 -6.873 -24.357 -36.173 1.00 0.00 C ATOM 719 CG ARG A 71 -7.500 -25.135 -35.000 1.00 0.00 C ATOM 720 CD ARG A 71 -7.205 -26.648 -35.003 1.00 0.00 C ATOM 721 NE ARG A 71 -5.833 -26.962 -34.556 1.00 0.00 N ATOM 722 CZ ARG A 71 -5.293 -28.193 -34.537 1.00 0.00 C ATOM 723 NH1 ARG A 71 -5.955 -29.236 -35.023 1.00 0.00 N ATOM 724 NH2 ARG A 71 -4.087 -28.372 -34.023 1.00 0.00 N ATOM 0 H ARG A 71 -9.132 -23.288 -36.289 1.00 0.00 H new ATOM 0 HA ARG A 71 -6.634 -22.455 -35.167 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -7.295 -24.724 -37.109 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -5.803 -24.562 -36.204 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -7.138 -24.709 -34.064 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -8.580 -24.989 -35.020 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -7.919 -27.155 -34.354 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -7.354 -27.041 -36.009 1.00 0.00 H new ATOM 0 HE ARG A 71 -5.251 -26.187 -34.238 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -6.887 -29.110 -35.418 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -5.532 -30.164 -35.001 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -3.571 -27.578 -33.643 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -3.673 -29.304 -34.006 1.00 0.00 H new ATOM 738 N GLU A 72 -7.039 -22.066 -38.443 1.00 0.00 N ATOM 739 CA GLU A 72 -6.442 -21.452 -39.654 1.00 0.00 C ATOM 740 C GLU A 72 -6.637 -19.929 -39.666 1.00 0.00 C ATOM 741 O GLU A 72 -5.810 -19.196 -40.221 1.00 0.00 O ATOM 742 CB GLU A 72 -6.977 -22.119 -40.956 1.00 0.00 C ATOM 743 CG GLU A 72 -8.510 -22.090 -41.189 1.00 0.00 C ATOM 744 CD GLU A 72 -9.081 -20.763 -41.735 1.00 0.00 C ATOM 745 OE1 GLU A 72 -8.442 -20.138 -42.615 1.00 0.00 O ATOM 746 OE2 GLU A 72 -10.184 -20.356 -41.306 1.00 0.00 O ATOM 0 H GLU A 72 -7.968 -22.460 -38.590 1.00 0.00 H new ATOM 0 HA GLU A 72 -5.368 -21.636 -39.621 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -6.497 -21.634 -41.806 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -6.654 -23.160 -40.959 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -8.768 -22.888 -41.885 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -9.006 -22.317 -40.245 1.00 0.00 H new ATOM 753 N ALA A 73 -7.746 -19.469 -39.062 1.00 0.00 N ATOM 754 CA ALA A 73 -8.029 -18.033 -38.898 1.00 0.00 C ATOM 755 C ALA A 73 -7.060 -17.405 -37.890 1.00 0.00 C ATOM 756 O ALA A 73 -6.482 -16.344 -38.142 1.00 0.00 O ATOM 757 CB ALA A 73 -9.491 -17.811 -38.460 1.00 0.00 C ATOM 0 H ALA A 73 -8.467 -20.078 -38.676 1.00 0.00 H new ATOM 0 HA ALA A 73 -7.886 -17.544 -39.862 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -9.678 -16.743 -38.345 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -10.163 -18.218 -39.216 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -9.667 -18.315 -37.509 1.00 0.00 H new ATOM 763 N ILE A 74 -6.860 -18.091 -36.754 1.00 0.00 N ATOM 764 CA ILE A 74 -6.073 -17.562 -35.626 1.00 0.00 C ATOM 765 C ILE A 74 -4.835 -18.456 -35.385 1.00 0.00 C ATOM 766 O ILE A 74 -4.976 -19.554 -34.827 1.00 0.00 O ATOM 767 CB ILE A 74 -6.939 -17.488 -34.313 1.00 0.00 C ATOM 768 CG1 ILE A 74 -8.307 -16.788 -34.594 1.00 0.00 C ATOM 769 CG2 ILE A 74 -6.171 -16.769 -33.170 1.00 0.00 C ATOM 770 CD1 ILE A 74 -9.248 -16.731 -33.409 1.00 0.00 C ATOM 0 H ILE A 74 -7.237 -19.025 -36.590 1.00 0.00 H new ATOM 0 HA ILE A 74 -5.752 -16.552 -35.880 1.00 0.00 H new ATOM 0 HB ILE A 74 -7.138 -18.508 -33.985 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -8.115 -15.771 -34.936 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -8.805 -17.311 -35.411 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -6.796 -16.734 -32.278 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -5.253 -17.314 -32.949 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -5.924 -15.754 -33.480 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -10.170 -16.228 -33.700 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -9.477 -17.744 -33.077 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -8.776 -16.180 -32.595 1.00 0.00 H new ATOM 782 N PRO A 75 -3.613 -18.023 -35.834 1.00 0.00 N ATOM 783 CA PRO A 75 -2.349 -18.708 -35.494 1.00 0.00 C ATOM 784 C PRO A 75 -2.010 -18.496 -34.001 1.00 0.00 C ATOM 785 O PRO A 75 -1.570 -17.410 -33.590 1.00 0.00 O ATOM 786 CB PRO A 75 -1.315 -18.057 -36.444 1.00 0.00 C ATOM 787 CG PRO A 75 -1.872 -16.699 -36.741 1.00 0.00 C ATOM 788 CD PRO A 75 -3.380 -16.855 -36.723 1.00 0.00 C ATOM 0 HA PRO A 75 -2.383 -19.790 -35.623 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -0.334 -17.988 -35.974 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -1.191 -18.642 -37.355 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -1.546 -15.972 -35.997 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -1.528 -16.339 -37.711 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -3.869 -15.959 -36.340 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -3.775 -17.031 -37.724 1.00 0.00 H new ATOM 796 N GLY A 76 -2.276 -19.530 -33.199 1.00 0.00 N ATOM 797 CA GLY A 76 -2.167 -19.447 -31.741 1.00 0.00 C ATOM 798 C GLY A 76 -3.530 -19.313 -31.077 1.00 0.00 C ATOM 799 O GLY A 76 -3.672 -18.606 -30.067 1.00 0.00 O ATOM 0 H GLY A 76 -2.572 -20.445 -33.540 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -1.665 -20.338 -31.363 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -1.546 -18.593 -31.471 1.00 0.00 H new ATOM 803 N VAL A 77 -4.549 -19.983 -31.662 1.00 0.00 N ATOM 804 CA VAL A 77 -5.889 -20.059 -31.060 1.00 0.00 C ATOM 805 C VAL A 77 -5.829 -20.917 -29.787 1.00 0.00 C ATOM 806 O VAL A 77 -5.081 -21.894 -29.733 1.00 0.00 O ATOM 807 CB VAL A 77 -6.974 -20.629 -32.053 1.00 0.00 C ATOM 808 CG1 VAL A 77 -6.704 -22.099 -32.444 1.00 0.00 C ATOM 809 CG2 VAL A 77 -8.404 -20.472 -31.476 1.00 0.00 C ATOM 0 H VAL A 77 -4.463 -20.477 -32.550 1.00 0.00 H new ATOM 0 HA VAL A 77 -6.196 -19.042 -30.814 1.00 0.00 H new ATOM 0 HB VAL A 77 -6.901 -20.034 -32.964 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -7.480 -22.442 -33.128 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -5.732 -22.173 -32.931 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -6.710 -22.721 -31.549 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -9.128 -20.874 -32.184 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -8.478 -21.015 -30.534 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -8.613 -19.416 -31.304 1.00 0.00 H new ATOM 819 N ARG A 78 -6.590 -20.511 -28.761 1.00 0.00 N ATOM 820 CA ARG A 78 -6.675 -21.229 -27.472 1.00 0.00 C ATOM 821 C ARG A 78 -8.127 -21.293 -26.960 1.00 0.00 C ATOM 822 O ARG A 78 -8.390 -21.639 -25.799 1.00 0.00 O ATOM 823 CB ARG A 78 -5.664 -20.615 -26.449 1.00 0.00 C ATOM 824 CG ARG A 78 -5.413 -19.088 -26.558 1.00 0.00 C ATOM 825 CD ARG A 78 -6.612 -18.230 -26.141 1.00 0.00 C ATOM 826 NE ARG A 78 -6.935 -18.383 -24.709 1.00 0.00 N ATOM 827 CZ ARG A 78 -7.641 -17.515 -23.969 1.00 0.00 C ATOM 828 NH1 ARG A 78 -8.112 -16.399 -24.499 1.00 0.00 N ATOM 829 NH2 ARG A 78 -7.879 -17.774 -22.700 1.00 0.00 N ATOM 0 H ARG A 78 -7.168 -19.672 -28.798 1.00 0.00 H new ATOM 0 HA ARG A 78 -6.379 -22.268 -27.614 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -6.023 -20.831 -25.443 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -4.709 -21.127 -26.564 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -4.557 -18.825 -25.936 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -5.146 -18.846 -27.587 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -6.399 -17.182 -26.354 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -7.480 -18.506 -26.739 1.00 0.00 H new ATOM 0 HE ARG A 78 -6.591 -19.222 -24.241 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -7.940 -16.189 -25.482 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -8.647 -15.748 -23.925 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -7.527 -18.634 -22.280 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -8.416 -17.114 -22.137 1.00 0.00 H new ATOM 843 N LEU A 79 -9.079 -21.029 -27.870 1.00 0.00 N ATOM 844 CA LEU A 79 -10.520 -20.957 -27.553 1.00 0.00 C ATOM 845 C LEU A 79 -11.331 -21.746 -28.592 1.00 0.00 C ATOM 846 O LEU A 79 -11.165 -21.533 -29.801 1.00 0.00 O ATOM 847 CB LEU A 79 -10.984 -19.479 -27.576 1.00 0.00 C ATOM 848 CG LEU A 79 -10.284 -18.538 -26.561 1.00 0.00 C ATOM 849 CD1 LEU A 79 -10.341 -17.073 -27.012 1.00 0.00 C ATOM 850 CD2 LEU A 79 -10.878 -18.709 -25.156 1.00 0.00 C ATOM 0 H LEU A 79 -8.872 -20.858 -28.854 1.00 0.00 H new ATOM 0 HA LEU A 79 -10.682 -21.385 -26.564 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -10.826 -19.083 -28.579 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -12.057 -19.451 -27.388 1.00 0.00 H new ATOM 0 HG LEU A 79 -9.233 -18.823 -26.521 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -9.840 -16.446 -26.275 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -9.842 -16.969 -27.976 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -11.381 -16.762 -27.107 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -10.371 -18.039 -24.462 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -11.941 -18.470 -25.179 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -10.745 -19.740 -24.828 1.00 0.00 H new ATOM 862 N CYS A 80 -12.192 -22.677 -28.121 1.00 0.00 N ATOM 863 CA CYS A 80 -13.153 -23.398 -28.991 1.00 0.00 C ATOM 864 C CYS A 80 -14.203 -22.403 -29.471 1.00 0.00 C ATOM 865 O CYS A 80 -14.408 -21.412 -28.794 1.00 0.00 O ATOM 866 CB CYS A 80 -13.796 -24.588 -28.238 1.00 0.00 C ATOM 867 SG CYS A 80 -14.980 -24.115 -26.933 1.00 0.00 S ATOM 0 H CYS A 80 -12.242 -22.948 -27.139 1.00 0.00 H new ATOM 0 HA CYS A 80 -12.634 -23.819 -29.852 1.00 0.00 H new ATOM 0 HB2 CYS A 80 -14.308 -25.224 -28.961 1.00 0.00 H new ATOM 0 HB3 CYS A 80 -13.004 -25.188 -27.790 1.00 0.00 H new ATOM 872 N ILE A 81 -14.884 -22.684 -30.604 1.00 0.00 N ATOM 873 CA ILE A 81 -15.712 -21.683 -31.345 1.00 0.00 C ATOM 874 C ILE A 81 -16.761 -20.968 -30.442 1.00 0.00 C ATOM 875 O ILE A 81 -17.147 -19.828 -30.697 1.00 0.00 O ATOM 876 CB ILE A 81 -16.413 -22.351 -32.594 1.00 0.00 C ATOM 877 CG1 ILE A 81 -17.094 -21.282 -33.513 1.00 0.00 C ATOM 878 CG2 ILE A 81 -17.422 -23.445 -32.159 1.00 0.00 C ATOM 879 CD1 ILE A 81 -17.788 -21.843 -34.745 1.00 0.00 C ATOM 0 H ILE A 81 -14.881 -23.607 -31.037 1.00 0.00 H new ATOM 0 HA ILE A 81 -15.025 -20.911 -31.692 1.00 0.00 H new ATOM 0 HB ILE A 81 -15.634 -22.836 -33.181 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -17.825 -20.730 -32.922 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -16.338 -20.566 -33.835 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -17.886 -23.884 -33.042 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -16.899 -24.221 -31.600 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -18.191 -23.000 -31.528 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -18.229 -21.027 -35.318 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -17.061 -22.369 -35.364 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -18.572 -22.535 -34.438 1.00 0.00 H new ATOM 891 N HIS A 82 -17.155 -21.644 -29.352 1.00 0.00 N ATOM 892 CA HIS A 82 -18.123 -21.125 -28.363 1.00 0.00 C ATOM 893 C HIS A 82 -17.432 -20.106 -27.428 1.00 0.00 C ATOM 894 O HIS A 82 -17.939 -19.010 -27.213 1.00 0.00 O ATOM 895 CB HIS A 82 -18.744 -22.303 -27.565 1.00 0.00 C ATOM 896 CG HIS A 82 -19.236 -23.416 -28.454 1.00 0.00 C ATOM 897 ND1 HIS A 82 -20.485 -23.437 -29.025 1.00 0.00 N ATOM 898 CD2 HIS A 82 -18.592 -24.510 -28.926 1.00 0.00 C ATOM 899 CE1 HIS A 82 -20.592 -24.493 -29.806 1.00 0.00 C ATOM 900 NE2 HIS A 82 -19.459 -25.160 -29.761 1.00 0.00 N ATOM 0 H HIS A 82 -16.809 -22.577 -29.127 1.00 0.00 H new ATOM 0 HA HIS A 82 -18.930 -20.606 -28.880 1.00 0.00 H new ATOM 0 HB2 HIS A 82 -18.001 -22.699 -26.873 1.00 0.00 H new ATOM 0 HB3 HIS A 82 -19.573 -21.931 -26.964 1.00 0.00 H new ATOM 0 HD2 HIS A 82 -17.583 -24.813 -28.688 1.00 0.00 H new ATOM 0 HE1 HIS A 82 -21.462 -24.765 -30.385 1.00 0.00 H new ATOM 0 HE2 HIS A 82 -19.259 -26.023 -30.267 1.00 0.00 H new ATOM 909 N CYS A 83 -16.245 -20.474 -26.905 1.00 0.00 N ATOM 910 CA CYS A 83 -15.398 -19.553 -26.106 1.00 0.00 C ATOM 911 C CYS A 83 -14.729 -18.485 -27.004 1.00 0.00 C ATOM 912 O CYS A 83 -14.250 -17.476 -26.505 1.00 0.00 O ATOM 913 CB CYS A 83 -14.297 -20.322 -25.336 1.00 0.00 C ATOM 914 SG CYS A 83 -14.870 -21.591 -24.162 1.00 0.00 S ATOM 0 H CYS A 83 -15.846 -21.406 -27.020 1.00 0.00 H new ATOM 0 HA CYS A 83 -16.058 -19.061 -25.391 1.00 0.00 H new ATOM 0 HB2 CYS A 83 -13.641 -20.800 -26.064 1.00 0.00 H new ATOM 0 HB3 CYS A 83 -13.693 -19.598 -24.789 1.00 0.00 H new ATOM 919 N GLN A 84 -14.660 -18.735 -28.322 1.00 0.00 N ATOM 920 CA GLN A 84 -13.966 -17.837 -29.261 1.00 0.00 C ATOM 921 C GLN A 84 -14.899 -16.695 -29.712 1.00 0.00 C ATOM 922 O GLN A 84 -14.485 -15.542 -29.704 1.00 0.00 O ATOM 923 CB GLN A 84 -13.405 -18.635 -30.485 1.00 0.00 C ATOM 924 CG GLN A 84 -12.057 -18.122 -31.049 1.00 0.00 C ATOM 925 CD GLN A 84 -12.062 -16.639 -31.430 1.00 0.00 C ATOM 926 OE1 GLN A 84 -12.430 -16.279 -32.543 1.00 0.00 O ATOM 927 NE2 GLN A 84 -11.604 -15.775 -30.529 1.00 0.00 N ATOM 0 H GLN A 84 -15.078 -19.554 -28.763 1.00 0.00 H new ATOM 0 HA GLN A 84 -13.117 -17.389 -28.744 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -13.284 -19.678 -30.193 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -14.146 -18.611 -31.284 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -11.277 -18.293 -30.307 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -11.796 -18.711 -31.928 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -11.305 -16.105 -29.611 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -11.551 -14.782 -30.755 1.00 0.00 H new ATOM 936 N GLN A 85 -16.155 -17.037 -30.075 1.00 0.00 N ATOM 937 CA GLN A 85 -17.139 -16.074 -30.648 1.00 0.00 C ATOM 938 C GLN A 85 -17.346 -14.853 -29.724 1.00 0.00 C ATOM 939 O GLN A 85 -17.483 -13.720 -30.191 1.00 0.00 O ATOM 940 CB GLN A 85 -18.506 -16.778 -30.909 1.00 0.00 C ATOM 941 CG GLN A 85 -19.162 -17.389 -29.652 1.00 0.00 C ATOM 942 CD GLN A 85 -20.515 -18.037 -29.914 1.00 0.00 C ATOM 943 OE1 GLN A 85 -20.496 -19.288 -30.347 1.00 0.00 O flip ATOM 944 NE2 GLN A 85 -21.565 -17.407 -29.772 1.00 0.00 N flip ATOM 0 H GLN A 85 -16.521 -17.985 -29.982 1.00 0.00 H new ATOM 0 HA GLN A 85 -16.732 -15.718 -31.594 1.00 0.00 H new ATOM 0 HB2 GLN A 85 -19.194 -16.056 -31.348 1.00 0.00 H new ATOM 0 HB3 GLN A 85 -18.359 -17.567 -31.647 1.00 0.00 H new ATOM 0 HG2 GLN A 85 -18.489 -18.135 -29.229 1.00 0.00 H new ATOM 0 HG3 GLN A 85 -19.284 -16.608 -28.902 1.00 0.00 H new ATOM 0 HE21 GLN A 85 -21.541 -16.444 -29.436 1.00 0.00 H new ATOM 0 HE22 GLN A 85 -22.458 -17.848 -29.991 1.00 0.00 H new ATOM 953 N GLU A 86 -17.347 -15.123 -28.409 1.00 0.00 N ATOM 954 CA GLU A 86 -17.538 -14.111 -27.360 1.00 0.00 C ATOM 955 C GLU A 86 -16.293 -13.214 -27.238 1.00 0.00 C ATOM 956 O GLU A 86 -16.410 -11.986 -27.127 1.00 0.00 O ATOM 957 CB GLU A 86 -17.875 -14.821 -26.016 1.00 0.00 C ATOM 958 CG GLU A 86 -16.847 -15.878 -25.579 1.00 0.00 C ATOM 959 CD GLU A 86 -17.313 -16.758 -24.409 1.00 0.00 C ATOM 960 OE1 GLU A 86 -18.191 -17.621 -24.620 1.00 0.00 O ATOM 961 OE2 GLU A 86 -16.805 -16.596 -23.278 1.00 0.00 O ATOM 0 H GLU A 86 -17.213 -16.064 -28.040 1.00 0.00 H new ATOM 0 HA GLU A 86 -18.373 -13.462 -27.625 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -17.959 -14.068 -25.233 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -18.851 -15.297 -26.106 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -16.614 -16.517 -26.431 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -15.922 -15.375 -25.296 1.00 0.00 H new ATOM 968 N LYS A 87 -15.101 -13.838 -27.318 1.00 0.00 N ATOM 969 CA LYS A 87 -13.817 -13.139 -27.160 1.00 0.00 C ATOM 970 C LYS A 87 -13.455 -12.330 -28.406 1.00 0.00 C ATOM 971 O LYS A 87 -12.793 -11.302 -28.293 1.00 0.00 O ATOM 972 CB LYS A 87 -12.680 -14.146 -26.849 1.00 0.00 C ATOM 973 CG LYS A 87 -12.826 -14.876 -25.500 1.00 0.00 C ATOM 974 CD LYS A 87 -12.935 -13.911 -24.308 1.00 0.00 C ATOM 975 CE LYS A 87 -12.925 -14.641 -22.964 1.00 0.00 C ATOM 976 NZ LYS A 87 -13.093 -13.713 -21.817 1.00 0.00 N ATOM 0 H LYS A 87 -15.005 -14.838 -27.494 1.00 0.00 H new ATOM 0 HA LYS A 87 -13.929 -12.449 -26.324 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -12.640 -14.888 -27.647 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -11.728 -13.615 -26.859 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -13.712 -15.511 -25.530 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -11.968 -15.532 -25.353 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -12.107 -13.203 -24.340 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -13.854 -13.331 -24.396 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -13.725 -15.382 -22.949 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -11.986 -15.184 -22.855 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -13.080 -14.253 -20.928 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -12.316 -13.021 -21.813 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -14.001 -13.213 -21.905 1.00 0.00 H new ATOM 990 N ASP A 88 -13.891 -12.799 -29.586 1.00 0.00 N ATOM 991 CA ASP A 88 -13.523 -12.188 -30.883 1.00 0.00 C ATOM 992 C ASP A 88 -14.163 -10.795 -31.048 1.00 0.00 C ATOM 993 O ASP A 88 -13.659 -9.952 -31.806 1.00 0.00 O ATOM 994 CB ASP A 88 -13.882 -13.119 -32.066 1.00 0.00 C ATOM 995 CG ASP A 88 -13.201 -12.691 -33.386 1.00 0.00 C ATOM 996 OD1 ASP A 88 -11.991 -12.998 -33.574 1.00 0.00 O ATOM 997 OD2 ASP A 88 -13.855 -12.039 -34.228 1.00 0.00 O ATOM 0 H ASP A 88 -14.506 -13.608 -29.673 1.00 0.00 H new ATOM 0 HA ASP A 88 -12.441 -12.054 -30.889 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -13.586 -14.140 -31.823 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -14.963 -13.125 -32.204 1.00 0.00 H new ATOM 1002 N LEU A 89 -15.256 -10.565 -30.305 1.00 0.00 N ATOM 1003 CA LEU A 89 -15.921 -9.254 -30.226 1.00 0.00 C ATOM 1004 C LEU A 89 -15.045 -8.262 -29.438 1.00 0.00 C ATOM 1005 O LEU A 89 -14.932 -7.084 -29.792 1.00 0.00 O ATOM 1006 CB LEU A 89 -17.297 -9.399 -29.517 1.00 0.00 C ATOM 1007 CG LEU A 89 -18.211 -10.548 -30.036 1.00 0.00 C ATOM 1008 CD1 LEU A 89 -19.519 -10.647 -29.221 1.00 0.00 C ATOM 1009 CD2 LEU A 89 -18.501 -10.407 -31.550 1.00 0.00 C ATOM 0 H LEU A 89 -15.706 -11.285 -29.740 1.00 0.00 H new ATOM 0 HA LEU A 89 -16.071 -8.878 -31.238 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -17.121 -9.553 -28.452 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -17.837 -8.458 -29.618 1.00 0.00 H new ATOM 0 HG LEU A 89 -17.665 -11.481 -29.893 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -20.131 -11.460 -29.612 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -19.282 -10.842 -28.175 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -20.068 -9.709 -29.300 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -19.142 -11.227 -31.876 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -19.003 -9.458 -31.737 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -17.563 -10.437 -32.104 1.00 0.00 H new ATOM 1021 N GLN A 90 -14.422 -8.788 -28.372 1.00 0.00 N ATOM 1022 CA GLN A 90 -13.734 -7.989 -27.347 1.00 0.00 C ATOM 1023 C GLN A 90 -12.324 -7.607 -27.814 1.00 0.00 C ATOM 1024 O GLN A 90 -11.866 -6.476 -27.585 1.00 0.00 O ATOM 1025 CB GLN A 90 -13.663 -8.784 -26.006 1.00 0.00 C ATOM 1026 CG GLN A 90 -14.961 -9.537 -25.635 1.00 0.00 C ATOM 1027 CD GLN A 90 -16.219 -8.660 -25.561 1.00 0.00 C ATOM 1028 OE1 GLN A 90 -16.171 -7.482 -25.204 1.00 0.00 O ATOM 1029 NE2 GLN A 90 -17.363 -9.243 -25.895 1.00 0.00 N ATOM 0 H GLN A 90 -14.382 -9.792 -28.196 1.00 0.00 H new ATOM 0 HA GLN A 90 -14.301 -7.072 -27.185 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -12.846 -9.503 -26.068 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -13.417 -8.092 -25.201 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -15.128 -10.326 -26.369 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -14.818 -10.024 -24.670 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -17.371 -10.220 -26.187 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -18.234 -8.714 -25.860 1.00 0.00 H new ATOM 1038 N LYS A 91 -11.647 -8.571 -28.458 1.00 0.00 N ATOM 1039 CA LYS A 91 -10.278 -8.400 -28.961 1.00 0.00 C ATOM 1040 C LYS A 91 -10.272 -7.504 -30.220 1.00 0.00 C ATOM 1041 O LYS A 91 -11.092 -7.694 -31.126 1.00 0.00 O ATOM 1042 CB LYS A 91 -9.610 -9.785 -29.277 1.00 0.00 C ATOM 1043 CG LYS A 91 -10.388 -10.660 -30.281 1.00 0.00 C ATOM 1044 CD LYS A 91 -9.755 -12.060 -30.552 1.00 0.00 C ATOM 1045 CE LYS A 91 -8.717 -12.048 -31.682 1.00 0.00 C ATOM 1046 NZ LYS A 91 -9.321 -11.653 -32.986 1.00 0.00 N ATOM 0 H LYS A 91 -12.037 -9.495 -28.644 1.00 0.00 H new ATOM 0 HA LYS A 91 -9.694 -7.914 -28.179 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -8.608 -9.609 -29.669 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -9.495 -10.339 -28.345 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -11.403 -10.801 -29.909 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -10.466 -10.123 -31.226 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -9.283 -12.421 -29.638 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -10.546 -12.767 -30.802 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -7.913 -11.356 -31.430 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -8.269 -13.037 -31.774 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -8.684 -11.928 -33.761 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -10.237 -12.132 -33.104 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -9.464 -10.623 -33.004 1.00 0.00 H new ATOM 1060 N PRO A 92 -9.380 -6.472 -30.268 1.00 0.00 N ATOM 1061 CA PRO A 92 -9.014 -5.798 -31.533 1.00 0.00 C ATOM 1062 C PRO A 92 -7.905 -6.575 -32.284 1.00 0.00 C ATOM 1063 O PRO A 92 -7.460 -6.151 -33.350 1.00 0.00 O ATOM 1064 CB PRO A 92 -8.532 -4.424 -31.028 1.00 0.00 C ATOM 1065 CG PRO A 92 -7.877 -4.723 -29.714 1.00 0.00 C ATOM 1066 CD PRO A 92 -8.706 -5.833 -29.094 1.00 0.00 C ATOM 0 HA PRO A 92 -9.825 -5.730 -32.258 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -7.832 -3.966 -31.727 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -9.364 -3.729 -30.909 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -6.842 -5.036 -29.853 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -7.860 -3.841 -29.074 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -8.082 -6.545 -28.554 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -9.431 -5.441 -28.381 1.00 0.00 H new ATOM 1074 N ALA A 93 -7.469 -7.706 -31.663 1.00 0.00 N ATOM 1075 CA ALA A 93 -6.418 -8.612 -32.161 1.00 0.00 C ATOM 1076 C ALA A 93 -5.032 -7.928 -32.167 1.00 0.00 C ATOM 1077 O ALA A 93 -4.099 -8.396 -32.817 1.00 0.00 O ATOM 1078 CB ALA A 93 -6.799 -9.220 -33.526 1.00 0.00 C ATOM 0 H ALA A 93 -7.859 -8.014 -30.772 1.00 0.00 H new ATOM 0 HA ALA A 93 -6.338 -9.448 -31.466 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -6.002 -9.883 -33.864 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -7.725 -9.787 -33.426 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -6.939 -8.421 -34.254 1.00 0.00 H new ATOM 1084 N TYR A 94 -4.904 -6.836 -31.387 1.00 0.00 N ATOM 1085 CA TYR A 94 -3.629 -6.138 -31.171 1.00 0.00 C ATOM 1086 C TYR A 94 -3.568 -5.591 -29.737 1.00 0.00 C ATOM 1087 O TYR A 94 -4.610 -5.354 -29.110 1.00 0.00 O ATOM 1088 CB TYR A 94 -3.400 -4.997 -32.223 1.00 0.00 C ATOM 1089 CG TYR A 94 -4.343 -3.768 -32.143 1.00 0.00 C ATOM 1090 CD1 TYR A 94 -4.146 -2.754 -31.192 1.00 0.00 C ATOM 1091 CD2 TYR A 94 -5.415 -3.620 -33.023 1.00 0.00 C ATOM 1092 CE1 TYR A 94 -4.981 -1.661 -31.122 1.00 0.00 C ATOM 1093 CE2 TYR A 94 -6.254 -2.523 -32.956 1.00 0.00 C ATOM 1094 CZ TYR A 94 -6.036 -1.551 -32.003 1.00 0.00 C ATOM 1095 OH TYR A 94 -6.874 -0.459 -31.928 1.00 0.00 O ATOM 0 H TYR A 94 -5.688 -6.415 -30.889 1.00 0.00 H new ATOM 0 HA TYR A 94 -2.822 -6.858 -31.308 1.00 0.00 H new ATOM 0 HB2 TYR A 94 -2.374 -4.644 -32.122 1.00 0.00 H new ATOM 0 HB3 TYR A 94 -3.492 -5.431 -33.219 1.00 0.00 H new ATOM 0 HD1 TYR A 94 -3.321 -2.833 -30.500 1.00 0.00 H new ATOM 0 HD2 TYR A 94 -5.593 -4.378 -33.772 1.00 0.00 H new ATOM 0 HE1 TYR A 94 -4.810 -0.894 -30.381 1.00 0.00 H new ATOM 0 HE2 TYR A 94 -7.078 -2.428 -33.648 1.00 0.00 H new ATOM 0 HH TYR A 94 -7.566 -0.530 -32.618 1.00 0.00 H new ATOM 1105 N THR A 95 -2.344 -5.401 -29.228 1.00 0.00 N ATOM 1106 CA THR A 95 -2.086 -4.716 -27.949 1.00 0.00 C ATOM 1107 C THR A 95 -1.281 -3.419 -28.191 1.00 0.00 C ATOM 1108 O THR A 95 -1.184 -2.565 -27.305 1.00 0.00 O ATOM 1109 CB THR A 95 -1.315 -5.666 -26.973 1.00 0.00 C ATOM 1110 OG1 THR A 95 -0.156 -6.206 -27.634 1.00 0.00 O ATOM 1111 CG2 THR A 95 -2.202 -6.826 -26.473 1.00 0.00 C ATOM 0 H THR A 95 -1.495 -5.720 -29.695 1.00 0.00 H new ATOM 0 HA THR A 95 -3.040 -4.451 -27.493 1.00 0.00 H new ATOM 0 HB THR A 95 -1.016 -5.074 -26.108 1.00 0.00 H new ATOM 0 HG1 THR A 95 0.625 -5.649 -27.432 1.00 0.00 H new ATOM 0 HG21 THR A 95 -1.626 -7.460 -25.799 1.00 0.00 H new ATOM 0 HG22 THR A 95 -3.065 -6.422 -25.943 1.00 0.00 H new ATOM 0 HG23 THR A 95 -2.542 -7.416 -27.324 1.00 0.00 H new ATOM 1119 N GLY A 96 -0.721 -3.277 -29.412 1.00 0.00 N ATOM 1120 CA GLY A 96 0.150 -2.155 -29.759 1.00 0.00 C ATOM 1121 C GLY A 96 1.597 -2.428 -29.358 1.00 0.00 C ATOM 1122 O GLY A 96 2.464 -2.648 -30.217 1.00 0.00 O ATOM 0 H GLY A 96 -0.865 -3.939 -30.175 1.00 0.00 H new ATOM 0 HA2 GLY A 96 0.097 -1.970 -30.832 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -0.203 -1.251 -29.262 1.00 0.00 H new ATOM 1126 N TYR A 97 1.851 -2.422 -28.036 1.00 0.00 N ATOM 1127 CA TYR A 97 3.169 -2.770 -27.459 1.00 0.00 C ATOM 1128 C TYR A 97 3.450 -4.286 -27.597 1.00 0.00 C ATOM 1129 O TYR A 97 2.533 -5.103 -27.454 1.00 0.00 O ATOM 1130 CB TYR A 97 3.305 -2.314 -25.977 1.00 0.00 C ATOM 1131 CG TYR A 97 2.119 -2.670 -25.079 1.00 0.00 C ATOM 1132 CD1 TYR A 97 0.998 -1.867 -25.082 1.00 0.00 C ATOM 1133 CD2 TYR A 97 2.125 -3.782 -24.234 1.00 0.00 C ATOM 1134 CE1 TYR A 97 -0.094 -2.146 -24.298 1.00 0.00 C ATOM 1135 CE2 TYR A 97 1.032 -4.069 -23.440 1.00 0.00 C ATOM 1136 CZ TYR A 97 -0.072 -3.246 -23.469 1.00 0.00 C ATOM 1137 OH TYR A 97 -1.161 -3.534 -22.670 1.00 0.00 O ATOM 0 H TYR A 97 1.151 -2.176 -27.336 1.00 0.00 H new ATOM 0 HA TYR A 97 3.920 -2.225 -28.031 1.00 0.00 H new ATOM 0 HB2 TYR A 97 4.206 -2.760 -25.557 1.00 0.00 H new ATOM 0 HB3 TYR A 97 3.445 -1.233 -25.957 1.00 0.00 H new ATOM 0 HD1 TYR A 97 0.978 -0.995 -25.719 1.00 0.00 H new ATOM 0 HD2 TYR A 97 2.993 -4.424 -24.201 1.00 0.00 H new ATOM 0 HE1 TYR A 97 -0.964 -1.507 -24.331 1.00 0.00 H new ATOM 0 HE2 TYR A 97 1.043 -4.937 -22.798 1.00 0.00 H new ATOM 0 HH TYR A 97 -1.980 -3.218 -23.106 1.00 0.00 H new ATOM 1147 N ASN A 98 4.723 -4.650 -27.872 1.00 0.00 N ATOM 1148 CA ASN A 98 5.131 -6.056 -28.114 1.00 0.00 C ATOM 1149 C ASN A 98 5.143 -6.871 -26.802 1.00 0.00 C ATOM 1150 O ASN A 98 6.018 -6.675 -25.950 1.00 0.00 O ATOM 1151 CB ASN A 98 6.532 -6.129 -28.789 1.00 0.00 C ATOM 1152 CG ASN A 98 6.567 -5.522 -30.190 1.00 0.00 C ATOM 1153 OD1 ASN A 98 6.232 -6.318 -31.197 1.00 0.00 O flip ATOM 1154 ND2 ASN A 98 6.884 -4.345 -30.370 1.00 0.00 N flip ATOM 0 H ASN A 98 5.493 -3.984 -27.933 1.00 0.00 H new ATOM 0 HA ASN A 98 4.394 -6.491 -28.789 1.00 0.00 H new ATOM 0 HB2 ASN A 98 7.257 -5.612 -28.160 1.00 0.00 H new ATOM 0 HB3 ASN A 98 6.845 -7.172 -28.846 1.00 0.00 H new ATOM 0 HD21 ASN A 98 7.137 -3.758 -29.575 1.00 0.00 H new ATOM 0 HD22 ASN A 98 6.894 -3.958 -31.314 1.00 0.00 H new ATOM 1161 N ARG A 99 4.138 -7.746 -26.642 1.00 0.00 N ATOM 1162 CA ARG A 99 4.103 -8.749 -25.561 1.00 0.00 C ATOM 1163 C ARG A 99 4.801 -10.036 -26.038 1.00 0.00 C ATOM 1164 O ARG A 99 4.670 -10.423 -27.207 1.00 0.00 O ATOM 1165 CB ARG A 99 2.638 -9.057 -25.132 1.00 0.00 C ATOM 1166 CG ARG A 99 1.902 -7.884 -24.442 1.00 0.00 C ATOM 1167 CD ARG A 99 0.478 -8.272 -23.991 1.00 0.00 C ATOM 1168 NE ARG A 99 -0.174 -7.195 -23.219 1.00 0.00 N ATOM 1169 CZ ARG A 99 -1.466 -7.176 -22.839 1.00 0.00 C ATOM 1170 NH1 ARG A 99 -2.291 -8.171 -23.150 1.00 0.00 N ATOM 1171 NH2 ARG A 99 -1.923 -6.159 -22.141 1.00 0.00 N ATOM 0 H ARG A 99 3.325 -7.780 -27.258 1.00 0.00 H new ATOM 0 HA ARG A 99 4.628 -8.349 -24.693 1.00 0.00 H new ATOM 0 HB2 ARG A 99 2.071 -9.354 -26.014 1.00 0.00 H new ATOM 0 HB3 ARG A 99 2.645 -9.911 -24.455 1.00 0.00 H new ATOM 0 HG2 ARG A 99 2.478 -7.555 -23.577 1.00 0.00 H new ATOM 0 HG3 ARG A 99 1.846 -7.039 -25.128 1.00 0.00 H new ATOM 0 HD2 ARG A 99 -0.127 -8.507 -24.866 1.00 0.00 H new ATOM 0 HD3 ARG A 99 0.524 -9.176 -23.383 1.00 0.00 H new ATOM 0 HE ARG A 99 0.403 -6.398 -22.951 1.00 0.00 H new ATOM 0 HH11 ARG A 99 -1.949 -8.968 -23.686 1.00 0.00 H new ATOM 0 HH12 ARG A 99 -3.266 -8.137 -22.852 1.00 0.00 H new ATOM 0 HH21 ARG A 99 -1.300 -5.391 -21.891 1.00 0.00 H new ATOM 0 HH22 ARG A 99 -2.900 -6.138 -21.850 1.00 0.00 H new ATOM 1185 N ARG A 100 5.551 -10.677 -25.128 1.00 0.00 N ATOM 1186 CA ARG A 100 6.236 -11.960 -25.402 1.00 0.00 C ATOM 1187 C ARG A 100 5.330 -13.144 -24.992 1.00 0.00 C ATOM 1188 O ARG A 100 4.291 -12.943 -24.343 1.00 0.00 O ATOM 1189 CB ARG A 100 7.620 -12.031 -24.675 1.00 0.00 C ATOM 1190 CG ARG A 100 8.725 -11.086 -25.235 1.00 0.00 C ATOM 1191 CD ARG A 100 8.480 -9.595 -24.927 1.00 0.00 C ATOM 1192 NE ARG A 100 8.563 -9.295 -23.483 1.00 0.00 N ATOM 1193 CZ ARG A 100 7.876 -8.331 -22.845 1.00 0.00 C ATOM 1194 NH1 ARG A 100 6.991 -7.576 -23.490 1.00 0.00 N ATOM 1195 NH2 ARG A 100 8.084 -8.120 -21.554 1.00 0.00 N ATOM 0 H ARG A 100 5.702 -10.326 -24.182 1.00 0.00 H new ATOM 0 HA ARG A 100 6.428 -12.025 -26.473 1.00 0.00 H new ATOM 0 HB2 ARG A 100 7.469 -11.799 -23.621 1.00 0.00 H new ATOM 0 HB3 ARG A 100 7.985 -13.057 -24.726 1.00 0.00 H new ATOM 0 HG2 ARG A 100 9.688 -11.381 -24.818 1.00 0.00 H new ATOM 0 HG3 ARG A 100 8.791 -11.219 -26.315 1.00 0.00 H new ATOM 0 HD2 ARG A 100 9.212 -8.991 -25.463 1.00 0.00 H new ATOM 0 HD3 ARG A 100 7.497 -9.307 -25.299 1.00 0.00 H new ATOM 0 HE ARG A 100 9.195 -9.867 -22.923 1.00 0.00 H new ATOM 0 HH11 ARG A 100 6.824 -7.724 -24.485 1.00 0.00 H new ATOM 0 HH12 ARG A 100 6.479 -6.850 -22.989 1.00 0.00 H new ATOM 0 HH21 ARG A 100 8.763 -8.688 -21.047 1.00 0.00 H new ATOM 0 HH22 ARG A 100 7.565 -7.390 -21.066 1.00 0.00 H new ATOM 1209 N GLY A 101 5.743 -14.371 -25.384 1.00 0.00 N ATOM 1210 CA GLY A 101 4.939 -15.591 -25.177 1.00 0.00 C ATOM 1211 C GLY A 101 4.779 -15.973 -23.708 1.00 0.00 C ATOM 1212 O GLY A 101 5.520 -16.821 -23.190 1.00 0.00 O ATOM 0 H GLY A 101 6.635 -14.540 -25.848 1.00 0.00 H new ATOM 0 HA2 GLY A 101 3.952 -15.445 -25.616 1.00 0.00 H new ATOM 0 HA3 GLY A 101 5.406 -16.419 -25.711 1.00 0.00 H new ATOM 1216 N SER A 102 3.800 -15.335 -23.044 1.00 0.00 N ATOM 1217 CA SER A 102 3.506 -15.548 -21.625 1.00 0.00 C ATOM 1218 C SER A 102 2.050 -15.145 -21.325 1.00 0.00 C ATOM 1219 O SER A 102 1.654 -13.990 -21.543 1.00 0.00 O ATOM 1220 CB SER A 102 4.501 -14.744 -20.750 1.00 0.00 C ATOM 1221 OG SER A 102 4.538 -13.371 -21.120 1.00 0.00 O ATOM 0 H SER A 102 3.187 -14.651 -23.486 1.00 0.00 H new ATOM 0 HA SER A 102 3.623 -16.605 -21.386 1.00 0.00 H new ATOM 0 HB2 SER A 102 4.216 -14.831 -19.702 1.00 0.00 H new ATOM 0 HB3 SER A 102 5.498 -15.173 -20.845 1.00 0.00 H new ATOM 0 HG SER A 102 3.631 -13.063 -21.325 1.00 0.00 H new ATOM 1227 N LYS A 103 1.258 -16.125 -20.865 1.00 0.00 N ATOM 1228 CA LYS A 103 -0.144 -15.943 -20.446 1.00 0.00 C ATOM 1229 C LYS A 103 -0.589 -17.158 -19.612 1.00 0.00 C ATOM 1230 O LYS A 103 0.091 -18.190 -19.601 1.00 0.00 O ATOM 1231 CB LYS A 103 -1.086 -15.767 -21.676 1.00 0.00 C ATOM 1232 CG LYS A 103 -1.080 -16.957 -22.667 1.00 0.00 C ATOM 1233 CD LYS A 103 -2.184 -16.863 -23.755 1.00 0.00 C ATOM 1234 CE LYS A 103 -3.606 -16.842 -23.161 1.00 0.00 C ATOM 1235 NZ LYS A 103 -3.848 -17.983 -22.240 1.00 0.00 N ATOM 0 H LYS A 103 1.580 -17.088 -20.771 1.00 0.00 H new ATOM 0 HA LYS A 103 -0.209 -15.037 -19.844 1.00 0.00 H new ATOM 0 HB2 LYS A 103 -2.104 -15.614 -21.318 1.00 0.00 H new ATOM 0 HB3 LYS A 103 -0.797 -14.863 -22.212 1.00 0.00 H new ATOM 0 HG2 LYS A 103 -0.106 -17.010 -23.153 1.00 0.00 H new ATOM 0 HG3 LYS A 103 -1.209 -17.885 -22.109 1.00 0.00 H new ATOM 0 HD2 LYS A 103 -2.029 -15.961 -24.347 1.00 0.00 H new ATOM 0 HD3 LYS A 103 -2.091 -17.710 -24.435 1.00 0.00 H new ATOM 0 HE2 LYS A 103 -3.760 -15.906 -22.625 1.00 0.00 H new ATOM 0 HE3 LYS A 103 -4.336 -16.869 -23.970 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 -4.845 -18.273 -22.301 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 -3.238 -18.781 -22.509 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 -3.630 -17.694 -21.265 1.00 0.00 H new ATOM 1249 N ASP A 104 -1.735 -17.039 -18.924 1.00 0.00 N ATOM 1250 CA ASP A 104 -2.322 -18.153 -18.154 1.00 0.00 C ATOM 1251 C ASP A 104 -2.929 -19.197 -19.122 1.00 0.00 C ATOM 1252 O ASP A 104 -4.108 -19.126 -19.466 1.00 0.00 O ATOM 1253 CB ASP A 104 -3.392 -17.626 -17.156 1.00 0.00 C ATOM 1254 CG ASP A 104 -3.889 -18.707 -16.172 1.00 0.00 C ATOM 1255 OD1 ASP A 104 -3.195 -18.965 -15.159 1.00 0.00 O ATOM 1256 OD2 ASP A 104 -4.961 -19.313 -16.410 1.00 0.00 O ATOM 0 H ASP A 104 -2.279 -16.177 -18.884 1.00 0.00 H new ATOM 0 HA ASP A 104 -1.536 -18.635 -17.572 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -2.973 -16.794 -16.590 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -4.241 -17.236 -17.716 1.00 0.00 H new ATOM 1261 N SER A 105 -2.079 -20.109 -19.617 1.00 0.00 N ATOM 1262 CA SER A 105 -2.477 -21.223 -20.497 1.00 0.00 C ATOM 1263 C SER A 105 -2.385 -22.543 -19.723 1.00 0.00 C ATOM 1264 O SER A 105 -1.417 -22.777 -18.979 1.00 0.00 O ATOM 1265 CB SER A 105 -1.575 -21.262 -21.753 1.00 0.00 C ATOM 1266 OG SER A 105 -1.811 -20.133 -22.580 1.00 0.00 O ATOM 0 H SER A 105 -1.079 -20.095 -19.415 1.00 0.00 H new ATOM 0 HA SER A 105 -3.506 -21.076 -20.824 1.00 0.00 H new ATOM 0 HB2 SER A 105 -0.527 -21.286 -21.453 1.00 0.00 H new ATOM 0 HB3 SER A 105 -1.766 -22.176 -22.315 1.00 0.00 H new ATOM 0 HG SER A 105 -1.229 -20.177 -23.367 1.00 0.00 H new ATOM 1272 N GLN A 106 -3.401 -23.398 -19.902 1.00 0.00 N ATOM 1273 CA GLN A 106 -3.496 -24.691 -19.213 1.00 0.00 C ATOM 1274 C GLN A 106 -4.066 -25.758 -20.157 1.00 0.00 C ATOM 1275 O GLN A 106 -4.386 -25.482 -21.321 1.00 0.00 O ATOM 1276 CB GLN A 106 -4.366 -24.548 -17.930 1.00 0.00 C ATOM 1277 CG GLN A 106 -5.863 -24.271 -18.180 1.00 0.00 C ATOM 1278 CD GLN A 106 -6.657 -23.944 -16.906 1.00 0.00 C ATOM 1279 OE1 GLN A 106 -6.061 -23.190 -15.983 1.00 0.00 O flip ATOM 1280 NE2 GLN A 106 -7.824 -24.319 -16.779 1.00 0.00 N flip ATOM 0 H GLN A 106 -4.182 -23.211 -20.531 1.00 0.00 H new ATOM 0 HA GLN A 106 -2.498 -25.011 -18.913 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -4.275 -25.463 -17.345 1.00 0.00 H new ATOM 0 HB3 GLN A 106 -3.960 -23.739 -17.323 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -5.957 -23.439 -18.878 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -6.308 -25.142 -18.660 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -8.256 -24.896 -17.501 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -8.358 -24.053 -15.952 1.00 0.00 H new ATOM 1289 N LEU A 107 -4.177 -26.977 -19.624 1.00 0.00 N ATOM 1290 CA LEU A 107 -4.700 -28.153 -20.335 1.00 0.00 C ATOM 1291 C LEU A 107 -5.679 -28.925 -19.427 1.00 0.00 C ATOM 1292 O LEU A 107 -6.021 -30.082 -19.701 1.00 0.00 O ATOM 1293 CB LEU A 107 -3.527 -29.071 -20.828 1.00 0.00 C ATOM 1294 CG LEU A 107 -2.540 -29.655 -19.750 1.00 0.00 C ATOM 1295 CD1 LEU A 107 -1.683 -30.808 -20.339 1.00 0.00 C ATOM 1296 CD2 LEU A 107 -1.616 -28.569 -19.162 1.00 0.00 C ATOM 0 H LEU A 107 -3.900 -27.182 -18.664 1.00 0.00 H new ATOM 0 HA LEU A 107 -5.246 -27.820 -21.218 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -3.965 -29.910 -21.369 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -2.937 -28.502 -21.546 1.00 0.00 H new ATOM 0 HG LEU A 107 -3.159 -30.048 -18.943 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -1.011 -31.191 -19.571 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -2.338 -31.610 -20.681 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -1.098 -30.434 -21.179 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -0.952 -29.017 -18.423 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -1.022 -28.125 -19.961 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -2.220 -27.796 -18.686 1.00 0.00 H new ATOM 1308 N ARG A 108 -6.157 -28.242 -18.362 1.00 0.00 N ATOM 1309 CA ARG A 108 -7.049 -28.831 -17.349 1.00 0.00 C ATOM 1310 C ARG A 108 -8.506 -28.906 -17.883 1.00 0.00 C ATOM 1311 O ARG A 108 -8.926 -29.987 -18.359 1.00 0.00 O ATOM 1312 CB ARG A 108 -6.972 -28.001 -16.028 1.00 0.00 C ATOM 1313 CG ARG A 108 -5.575 -27.960 -15.366 1.00 0.00 C ATOM 1314 CD ARG A 108 -5.575 -27.222 -14.010 1.00 0.00 C ATOM 1315 NE ARG A 108 -6.507 -27.839 -13.035 1.00 0.00 N ATOM 1316 CZ ARG A 108 -6.189 -28.251 -11.798 1.00 0.00 C ATOM 1317 NH1 ARG A 108 -4.945 -28.146 -11.339 1.00 0.00 N ATOM 1318 NH2 ARG A 108 -7.126 -28.776 -11.029 1.00 0.00 N ATOM 1319 OXT ARG A 108 -9.221 -27.883 -17.839 1.00 0.00 O ATOM 0 H ARG A 108 -5.931 -27.263 -18.184 1.00 0.00 H new ATOM 0 HA ARG A 108 -6.723 -29.849 -17.135 1.00 0.00 H new ATOM 0 HB2 ARG A 108 -7.288 -26.979 -16.239 1.00 0.00 H new ATOM 0 HB3 ARG A 108 -7.684 -28.414 -15.314 1.00 0.00 H new ATOM 0 HG2 ARG A 108 -5.218 -28.979 -15.219 1.00 0.00 H new ATOM 0 HG3 ARG A 108 -4.873 -27.470 -16.041 1.00 0.00 H new ATOM 0 HD2 ARG A 108 -4.566 -27.225 -13.597 1.00 0.00 H new ATOM 0 HD3 ARG A 108 -5.853 -26.180 -14.166 1.00 0.00 H new ATOM 0 HE ARG A 108 -7.475 -27.961 -13.331 1.00 0.00 H new ATOM 0 HH11 ARG A 108 -4.215 -27.747 -11.930 1.00 0.00 H new ATOM 0 HH12 ARG A 108 -4.721 -28.464 -10.396 1.00 0.00 H new ATOM 0 HH21 ARG A 108 -8.081 -28.865 -11.377 1.00 0.00 H new ATOM 0 HH22 ARG A 108 -6.895 -29.092 -10.087 1.00 0.00 H new TER 1333 ARG A 108 HETATM 1334 ZN ZN A 109 -14.180 -23.737 -24.743 1.00 0.00 ZN