USER MOD reduce.3.24.130724 H: found=0, std=0, add=650, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 651 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 37 SER OG : rot -105:sc= 0.513 USER MOD Set 1.2: A 68 GLN :FLIP amide:sc= -0.0708 F(o=-0.33,f=0.44) USER MOD Single : A 21 MET CE :methyl 154:sc= 0 (180deg=-0.629) USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 27 ASN : amide:sc= 0 K(o=0,f=-0.62) USER MOD Single : A 32 ASN : amide:sc= -0.309 K(o=-0.31,f=-3.7!) USER MOD Single : A 34 GLN : amide:sc= -0.345 K(o=-0.35,f=-4.2!) USER MOD Single : A 36 ASN :FLIP amide:sc= 0 F(o=-0.66,f=0) USER MOD Single : A 38 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot -173:sc= 0.579 USER MOD Single : A 82 HIS : no HD1:sc= -0.245 X(o=-0.24,f=-0.025) USER MOD Single : A 84 GLN : amide:sc= -0.362 X(o=-0.36,f=-0.18) USER MOD Single : A 85 GLN : amide:sc= 0.236 X(o=0.24,f=0) USER MOD Single : A 87 LYS NZ :NH3+ -137:sc= 1.26 (180deg=-0.00574) USER MOD Single : A 90 GLN : amide:sc= 0.258 X(o=0.26,f=-0.13) USER MOD Single : A 91 LYS NZ :NH3+ 160:sc= 0.692 (180deg=0.216) USER MOD Single : A 94 TYR OH : rot 180:sc= 0 USER MOD Single : A 95 THR OG1 : rot 125:sc= 1.23 USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 ASN : amide:sc= -0.135 K(o=-0.14,f=-1.9!) USER MOD Single : A 102 SER OG : rot 37:sc= 0.224 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 SER OG : rot -54:sc= 0.213 USER MOD Single : A 106 GLN : amide:sc= 0.0257 X(o=0.026,f=-0.38) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 21 -10.687 -11.601 -61.401 1.00 0.00 N ATOM 2 CA MET A 21 -9.527 -12.513 -61.528 1.00 0.00 C ATOM 3 C MET A 21 -9.294 -13.252 -60.194 1.00 0.00 C ATOM 4 O MET A 21 -8.968 -12.625 -59.178 1.00 0.00 O ATOM 5 CB MET A 21 -8.258 -11.722 -61.946 1.00 0.00 C ATOM 6 CG MET A 21 -6.993 -12.573 -62.113 1.00 0.00 C ATOM 7 SD MET A 21 -5.586 -11.602 -62.692 1.00 0.00 S ATOM 8 CE MET A 21 -4.321 -12.859 -62.864 1.00 0.00 C ATOM 0 HA MET A 21 -9.738 -13.249 -62.304 1.00 0.00 H new ATOM 0 HB2 MET A 21 -8.460 -11.209 -62.886 1.00 0.00 H new ATOM 0 HB3 MET A 21 -8.065 -10.952 -61.199 1.00 0.00 H new ATOM 0 HG2 MET A 21 -6.743 -13.039 -61.160 1.00 0.00 H new ATOM 0 HG3 MET A 21 -7.191 -13.379 -62.819 1.00 0.00 H new ATOM 0 HE1 MET A 21 -3.592 -12.542 -63.609 1.00 0.00 H new ATOM 0 HE2 MET A 21 -3.821 -13.005 -61.907 1.00 0.00 H new ATOM 0 HE3 MET A 21 -4.780 -13.796 -63.181 1.00 0.00 H new ATOM 18 N ALA A 22 -9.454 -14.593 -60.215 1.00 0.00 N ATOM 19 CA ALA A 22 -9.294 -15.454 -59.031 1.00 0.00 C ATOM 20 C ALA A 22 -7.813 -15.837 -58.840 1.00 0.00 C ATOM 21 O ALA A 22 -7.425 -16.995 -59.022 1.00 0.00 O ATOM 22 CB ALA A 22 -10.193 -16.700 -59.157 1.00 0.00 C ATOM 0 H ALA A 22 -9.699 -15.108 -61.061 1.00 0.00 H new ATOM 0 HA ALA A 22 -9.607 -14.904 -58.144 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -10.067 -17.330 -58.276 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -11.235 -16.390 -59.236 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -9.913 -17.262 -60.048 1.00 0.00 H new ATOM 28 N SER A 23 -6.990 -14.831 -58.490 1.00 0.00 N ATOM 29 CA SER A 23 -5.541 -14.995 -58.262 1.00 0.00 C ATOM 30 C SER A 23 -5.018 -13.822 -57.408 1.00 0.00 C ATOM 31 O SER A 23 -5.308 -12.663 -57.714 1.00 0.00 O ATOM 32 CB SER A 23 -4.786 -15.067 -59.617 1.00 0.00 C ATOM 33 OG SER A 23 -3.404 -15.325 -59.434 1.00 0.00 O ATOM 0 H SER A 23 -7.314 -13.873 -58.356 1.00 0.00 H new ATOM 0 HA SER A 23 -5.364 -15.928 -57.727 1.00 0.00 H new ATOM 0 HB2 SER A 23 -5.224 -15.850 -60.236 1.00 0.00 H new ATOM 0 HB3 SER A 23 -4.913 -14.127 -60.155 1.00 0.00 H new ATOM 0 HG SER A 23 -2.960 -15.365 -60.307 1.00 0.00 H new ATOM 39 N GLY A 24 -4.310 -14.136 -56.303 1.00 0.00 N ATOM 40 CA GLY A 24 -3.663 -13.123 -55.443 1.00 0.00 C ATOM 41 C GLY A 24 -4.573 -12.561 -54.346 1.00 0.00 C ATOM 42 O GLY A 24 -4.172 -12.470 -53.183 1.00 0.00 O ATOM 0 H GLY A 24 -4.171 -15.094 -55.983 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -2.782 -13.566 -54.978 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -3.314 -12.301 -56.068 1.00 0.00 H new ATOM 46 N TRP A 25 -5.815 -12.223 -54.746 1.00 0.00 N ATOM 47 CA TRP A 25 -6.833 -11.545 -53.899 1.00 0.00 C ATOM 48 C TRP A 25 -7.008 -12.168 -52.489 1.00 0.00 C ATOM 49 O TRP A 25 -7.137 -11.446 -51.492 1.00 0.00 O ATOM 50 CB TRP A 25 -8.196 -11.532 -54.648 1.00 0.00 C ATOM 51 CG TRP A 25 -8.788 -12.901 -54.898 1.00 0.00 C ATOM 52 CD1 TRP A 25 -8.289 -13.874 -55.712 1.00 0.00 C ATOM 53 CD2 TRP A 25 -9.986 -13.446 -54.321 1.00 0.00 C ATOM 54 NE1 TRP A 25 -9.096 -14.974 -55.679 1.00 0.00 N ATOM 55 CE2 TRP A 25 -10.143 -14.739 -54.834 1.00 0.00 C ATOM 56 CE3 TRP A 25 -10.948 -12.953 -53.429 1.00 0.00 C ATOM 57 CZ2 TRP A 25 -11.200 -15.566 -54.481 1.00 0.00 C ATOM 58 CZ3 TRP A 25 -12.003 -13.776 -53.075 1.00 0.00 C ATOM 59 CH2 TRP A 25 -12.120 -15.068 -53.601 1.00 0.00 C ATOM 0 H TRP A 25 -6.152 -12.416 -55.689 1.00 0.00 H new ATOM 0 HA TRP A 25 -6.469 -10.532 -53.729 1.00 0.00 H new ATOM 0 HB2 TRP A 25 -8.908 -10.942 -54.070 1.00 0.00 H new ATOM 0 HB3 TRP A 25 -8.065 -11.026 -55.605 1.00 0.00 H new ATOM 0 HD1 TRP A 25 -7.386 -13.787 -56.298 1.00 0.00 H new ATOM 0 HE1 TRP A 25 -8.942 -15.836 -56.203 1.00 0.00 H new ATOM 0 HE3 TRP A 25 -10.868 -11.954 -53.027 1.00 0.00 H new ATOM 0 HZ2 TRP A 25 -11.292 -16.563 -54.885 1.00 0.00 H new ATOM 0 HZ3 TRP A 25 -12.748 -13.415 -52.381 1.00 0.00 H new ATOM 0 HH2 TRP A 25 -12.956 -15.685 -53.305 1.00 0.00 H new ATOM 70 N ALA A 26 -7.028 -13.512 -52.426 1.00 0.00 N ATOM 71 CA ALA A 26 -7.143 -14.271 -51.162 1.00 0.00 C ATOM 72 C ALA A 26 -6.142 -15.439 -51.122 1.00 0.00 C ATOM 73 O ALA A 26 -5.990 -16.103 -50.089 1.00 0.00 O ATOM 74 CB ALA A 26 -8.584 -14.781 -50.993 1.00 0.00 C ATOM 0 H ALA A 26 -6.965 -14.107 -53.252 1.00 0.00 H new ATOM 0 HA ALA A 26 -6.902 -13.605 -50.333 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -8.665 -15.340 -50.061 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -9.269 -13.934 -50.969 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -8.840 -15.431 -51.829 1.00 0.00 H new ATOM 80 N ASN A 27 -5.455 -15.676 -52.258 1.00 0.00 N ATOM 81 CA ASN A 27 -4.493 -16.782 -52.405 1.00 0.00 C ATOM 82 C ASN A 27 -3.087 -16.304 -52.031 1.00 0.00 C ATOM 83 O ASN A 27 -2.268 -15.990 -52.906 1.00 0.00 O ATOM 84 CB ASN A 27 -4.521 -17.358 -53.851 1.00 0.00 C ATOM 85 CG ASN A 27 -5.862 -17.983 -54.235 1.00 0.00 C ATOM 86 OD1 ASN A 27 -6.597 -18.489 -53.387 1.00 0.00 O ATOM 87 ND2 ASN A 27 -6.185 -17.977 -55.522 1.00 0.00 N ATOM 0 H ASN A 27 -5.553 -15.105 -53.098 1.00 0.00 H new ATOM 0 HA ASN A 27 -4.780 -17.586 -51.727 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -4.287 -16.560 -54.556 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -3.738 -18.110 -53.949 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -7.061 -18.399 -55.830 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -5.557 -17.551 -56.203 1.00 0.00 H new ATOM 94 N ASP A 28 -2.850 -16.196 -50.718 1.00 0.00 N ATOM 95 CA ASP A 28 -1.536 -15.850 -50.139 1.00 0.00 C ATOM 96 C ASP A 28 -0.759 -17.151 -49.846 1.00 0.00 C ATOM 97 O ASP A 28 -1.323 -18.251 -49.887 1.00 0.00 O ATOM 98 CB ASP A 28 -1.727 -15.026 -48.822 1.00 0.00 C ATOM 99 CG ASP A 28 -0.456 -14.303 -48.337 1.00 0.00 C ATOM 100 OD1 ASP A 28 -0.177 -13.192 -48.819 1.00 0.00 O ATOM 101 OD2 ASP A 28 0.284 -14.864 -47.496 1.00 0.00 O ATOM 0 H ASP A 28 -3.572 -16.348 -50.014 1.00 0.00 H new ATOM 0 HA ASP A 28 -0.974 -15.241 -50.846 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -2.513 -14.288 -48.980 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -2.073 -15.696 -48.035 1.00 0.00 H new ATOM 106 N ASP A 29 0.518 -17.004 -49.505 1.00 0.00 N ATOM 107 CA ASP A 29 1.441 -18.132 -49.255 1.00 0.00 C ATOM 108 C ASP A 29 1.221 -18.685 -47.840 1.00 0.00 C ATOM 109 O ASP A 29 1.154 -19.902 -47.635 1.00 0.00 O ATOM 110 CB ASP A 29 2.910 -17.664 -49.429 1.00 0.00 C ATOM 111 CG ASP A 29 3.214 -17.182 -50.861 1.00 0.00 C ATOM 112 OD1 ASP A 29 3.561 -18.019 -51.722 1.00 0.00 O ATOM 113 OD2 ASP A 29 3.076 -15.969 -51.139 1.00 0.00 O ATOM 0 H ASP A 29 0.957 -16.090 -49.390 1.00 0.00 H new ATOM 0 HA ASP A 29 1.239 -18.924 -49.976 1.00 0.00 H new ATOM 0 HB2 ASP A 29 3.115 -16.856 -48.727 1.00 0.00 H new ATOM 0 HB3 ASP A 29 3.581 -18.485 -49.176 1.00 0.00 H new ATOM 118 N ALA A 30 1.060 -17.753 -46.882 1.00 0.00 N ATOM 119 CA ALA A 30 0.898 -18.065 -45.450 1.00 0.00 C ATOM 120 C ALA A 30 -0.558 -18.439 -45.082 1.00 0.00 C ATOM 121 O ALA A 30 -0.889 -18.534 -43.897 1.00 0.00 O ATOM 122 CB ALA A 30 1.396 -16.877 -44.606 1.00 0.00 C ATOM 0 H ALA A 30 1.039 -16.753 -47.082 1.00 0.00 H new ATOM 0 HA ALA A 30 1.501 -18.946 -45.230 1.00 0.00 H new ATOM 0 HB1 ALA A 30 1.276 -17.107 -43.547 1.00 0.00 H new ATOM 0 HB2 ALA A 30 2.449 -16.694 -44.821 1.00 0.00 H new ATOM 0 HB3 ALA A 30 0.816 -15.988 -44.852 1.00 0.00 H new ATOM 128 N VAL A 31 -1.420 -18.637 -46.103 1.00 0.00 N ATOM 129 CA VAL A 31 -2.781 -19.197 -45.923 1.00 0.00 C ATOM 130 C VAL A 31 -2.919 -20.497 -46.754 1.00 0.00 C ATOM 131 O VAL A 31 -3.693 -21.393 -46.393 1.00 0.00 O ATOM 132 CB VAL A 31 -3.915 -18.159 -46.305 1.00 0.00 C ATOM 133 CG1 VAL A 31 -3.990 -17.886 -47.832 1.00 0.00 C ATOM 134 CG2 VAL A 31 -5.294 -18.602 -45.736 1.00 0.00 C ATOM 0 H VAL A 31 -1.195 -18.415 -47.073 1.00 0.00 H new ATOM 0 HA VAL A 31 -2.914 -19.425 -44.865 1.00 0.00 H new ATOM 0 HB VAL A 31 -3.644 -17.212 -45.838 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -4.784 -17.168 -48.035 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -3.038 -17.481 -48.176 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -4.200 -18.817 -48.358 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -6.054 -17.871 -46.013 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -5.561 -19.576 -46.146 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -5.235 -18.669 -44.650 1.00 0.00 H new ATOM 144 N ASN A 32 -2.136 -20.597 -47.857 1.00 0.00 N ATOM 145 CA ASN A 32 -2.125 -21.784 -48.743 1.00 0.00 C ATOM 146 C ASN A 32 -1.483 -22.987 -48.018 1.00 0.00 C ATOM 147 O ASN A 32 -1.926 -24.131 -48.165 1.00 0.00 O ATOM 148 CB ASN A 32 -1.376 -21.464 -50.070 1.00 0.00 C ATOM 149 CG ASN A 32 -1.529 -22.548 -51.150 1.00 0.00 C ATOM 150 OD1 ASN A 32 -2.544 -23.238 -51.211 1.00 0.00 O ATOM 151 ND2 ASN A 32 -0.534 -22.699 -52.013 1.00 0.00 N ATOM 0 H ASN A 32 -1.498 -19.859 -48.155 1.00 0.00 H new ATOM 0 HA ASN A 32 -3.153 -22.047 -48.992 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -1.745 -20.517 -50.465 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -0.316 -21.328 -49.854 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -0.600 -23.401 -52.750 1.00 0.00 H new ATOM 0 HD22 ASN A 32 0.298 -22.113 -51.940 1.00 0.00 H new ATOM 158 N GLU A 33 -0.451 -22.694 -47.203 1.00 0.00 N ATOM 159 CA GLU A 33 0.200 -23.689 -46.324 1.00 0.00 C ATOM 160 C GLU A 33 -0.746 -24.126 -45.183 1.00 0.00 C ATOM 161 O GLU A 33 -0.637 -25.245 -44.676 1.00 0.00 O ATOM 162 CB GLU A 33 1.515 -23.125 -45.735 1.00 0.00 C ATOM 163 CG GLU A 33 1.334 -21.871 -44.860 1.00 0.00 C ATOM 164 CD GLU A 33 2.646 -21.398 -44.231 1.00 0.00 C ATOM 165 OE1 GLU A 33 3.013 -21.894 -43.147 1.00 0.00 O ATOM 166 OE2 GLU A 33 3.329 -20.539 -44.827 1.00 0.00 O ATOM 0 H GLU A 33 -0.044 -21.761 -47.134 1.00 0.00 H new ATOM 0 HA GLU A 33 0.435 -24.563 -46.932 1.00 0.00 H new ATOM 0 HB2 GLU A 33 1.995 -23.902 -45.140 1.00 0.00 H new ATOM 0 HB3 GLU A 33 2.193 -22.887 -46.554 1.00 0.00 H new ATOM 0 HG2 GLU A 33 0.915 -21.067 -45.466 1.00 0.00 H new ATOM 0 HG3 GLU A 33 0.613 -22.084 -44.071 1.00 0.00 H new ATOM 173 N GLN A 34 -1.686 -23.234 -44.803 1.00 0.00 N ATOM 174 CA GLN A 34 -2.656 -23.481 -43.707 1.00 0.00 C ATOM 175 C GLN A 34 -3.889 -24.258 -44.205 1.00 0.00 C ATOM 176 O GLN A 34 -4.819 -24.516 -43.443 1.00 0.00 O ATOM 177 CB GLN A 34 -3.068 -22.138 -43.041 1.00 0.00 C ATOM 178 CG GLN A 34 -1.884 -21.241 -42.586 1.00 0.00 C ATOM 179 CD GLN A 34 -0.983 -21.818 -41.471 1.00 0.00 C ATOM 180 OE1 GLN A 34 -0.827 -23.026 -41.311 1.00 0.00 O ATOM 181 NE2 GLN A 34 -0.329 -20.938 -40.719 1.00 0.00 N ATOM 0 H GLN A 34 -1.796 -22.322 -45.246 1.00 0.00 H new ATOM 0 HA GLN A 34 -2.168 -24.104 -42.957 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -3.682 -21.575 -43.744 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -3.693 -22.356 -42.175 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -1.261 -21.028 -43.455 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -2.288 -20.289 -42.242 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -0.470 -19.938 -40.865 1.00 0.00 H new ATOM 0 HE22 GLN A 34 0.314 -21.263 -39.996 1.00 0.00 H new ATOM 190 N ILE A 35 -3.900 -24.602 -45.499 1.00 0.00 N ATOM 191 CA ILE A 35 -4.823 -25.615 -46.044 1.00 0.00 C ATOM 192 C ILE A 35 -4.269 -27.018 -45.690 1.00 0.00 C ATOM 193 O ILE A 35 -5.022 -27.972 -45.470 1.00 0.00 O ATOM 194 CB ILE A 35 -4.980 -25.462 -47.602 1.00 0.00 C ATOM 195 CG1 ILE A 35 -5.384 -23.992 -47.971 1.00 0.00 C ATOM 196 CG2 ILE A 35 -6.003 -26.480 -48.169 1.00 0.00 C ATOM 197 CD1 ILE A 35 -5.420 -23.690 -49.466 1.00 0.00 C ATOM 0 H ILE A 35 -3.277 -24.192 -46.195 1.00 0.00 H new ATOM 0 HA ILE A 35 -5.811 -25.479 -45.605 1.00 0.00 H new ATOM 0 HB ILE A 35 -4.015 -25.678 -48.061 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -6.368 -23.785 -47.550 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -4.682 -23.308 -47.494 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -6.088 -26.348 -49.248 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -5.665 -27.494 -47.953 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -6.976 -26.315 -47.705 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -5.709 -22.650 -49.620 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -4.433 -23.859 -49.895 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -6.144 -24.344 -49.952 1.00 0.00 H new ATOM 209 N ASN A 36 -2.920 -27.102 -45.588 1.00 0.00 N ATOM 210 CA ASN A 36 -2.192 -28.325 -45.163 1.00 0.00 C ATOM 211 C ASN A 36 -2.034 -28.345 -43.618 1.00 0.00 C ATOM 212 O ASN A 36 -1.157 -29.033 -43.079 1.00 0.00 O ATOM 213 CB ASN A 36 -0.782 -28.376 -45.833 1.00 0.00 C ATOM 214 CG ASN A 36 -0.803 -28.174 -47.355 1.00 0.00 C ATOM 215 OD1 ASN A 36 -0.636 -26.934 -47.792 1.00 0.00 O flip ATOM 216 ND2 ASN A 36 -0.952 -29.122 -48.125 1.00 0.00 N flip ATOM 0 H ASN A 36 -2.302 -26.319 -45.799 1.00 0.00 H new ATOM 0 HA ASN A 36 -2.768 -29.196 -45.476 1.00 0.00 H new ATOM 0 HB2 ASN A 36 -0.151 -27.609 -45.384 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -0.321 -29.339 -45.611 1.00 0.00 H new ATOM 0 HD21 ASN A 36 -1.078 -30.064 -47.755 1.00 0.00 H new ATOM 0 HD22 ASN A 36 -0.949 -28.966 -49.133 1.00 0.00 H new ATOM 223 N SER A 37 -2.924 -27.612 -42.918 1.00 0.00 N ATOM 224 CA SER A 37 -2.916 -27.473 -41.448 1.00 0.00 C ATOM 225 C SER A 37 -3.198 -28.812 -40.734 1.00 0.00 C ATOM 226 O SER A 37 -2.803 -28.987 -39.596 1.00 0.00 O ATOM 227 CB SER A 37 -3.946 -26.406 -41.028 1.00 0.00 C ATOM 228 OG SER A 37 -5.229 -26.684 -41.580 1.00 0.00 O ATOM 0 H SER A 37 -3.679 -27.093 -43.365 1.00 0.00 H new ATOM 0 HA SER A 37 -1.917 -27.159 -41.144 1.00 0.00 H new ATOM 0 HB2 SER A 37 -4.015 -26.371 -39.941 1.00 0.00 H new ATOM 0 HB3 SER A 37 -3.610 -25.423 -41.358 1.00 0.00 H new ATOM 0 HG SER A 37 -5.407 -26.068 -42.321 1.00 0.00 H new ATOM 234 N THR A 38 -3.856 -29.755 -41.431 1.00 0.00 N ATOM 235 CA THR A 38 -4.165 -31.103 -40.898 1.00 0.00 C ATOM 236 C THR A 38 -2.887 -31.873 -40.446 1.00 0.00 C ATOM 237 O THR A 38 -2.936 -32.700 -39.524 1.00 0.00 O ATOM 238 CB THR A 38 -4.966 -31.924 -41.955 1.00 0.00 C ATOM 239 OG1 THR A 38 -6.116 -31.166 -42.375 1.00 0.00 O ATOM 240 CG2 THR A 38 -5.428 -33.288 -41.408 1.00 0.00 C ATOM 0 H THR A 38 -4.191 -29.608 -42.383 1.00 0.00 H new ATOM 0 HA THR A 38 -4.779 -30.971 -40.007 1.00 0.00 H new ATOM 0 HB THR A 38 -4.301 -32.114 -42.797 1.00 0.00 H new ATOM 0 HG1 THR A 38 -6.620 -31.679 -43.041 1.00 0.00 H new ATOM 0 HG21 THR A 38 -5.981 -33.822 -42.181 1.00 0.00 H new ATOM 0 HG22 THR A 38 -4.558 -33.875 -41.113 1.00 0.00 H new ATOM 0 HG23 THR A 38 -6.072 -33.134 -40.542 1.00 0.00 H new ATOM 248 N ILE A 39 -1.745 -31.541 -41.075 1.00 0.00 N ATOM 249 CA ILE A 39 -0.427 -32.122 -40.747 1.00 0.00 C ATOM 250 C ILE A 39 0.008 -31.720 -39.313 1.00 0.00 C ATOM 251 O ILE A 39 0.527 -32.568 -38.567 1.00 0.00 O ATOM 252 CB ILE A 39 0.675 -31.716 -41.829 1.00 0.00 C ATOM 253 CG1 ILE A 39 0.460 -32.493 -43.186 1.00 0.00 C ATOM 254 CG2 ILE A 39 2.131 -31.925 -41.306 1.00 0.00 C ATOM 255 CD1 ILE A 39 -0.796 -32.154 -43.990 1.00 0.00 C ATOM 0 H ILE A 39 -1.709 -30.857 -41.831 1.00 0.00 H new ATOM 0 HA ILE A 39 -0.521 -33.208 -40.777 1.00 0.00 H new ATOM 0 HB ILE A 39 0.546 -30.650 -42.014 1.00 0.00 H new ATOM 0 HG12 ILE A 39 1.327 -32.312 -43.821 1.00 0.00 H new ATOM 0 HG13 ILE A 39 0.443 -33.560 -42.966 1.00 0.00 H new ATOM 0 HG21 ILE A 39 2.841 -31.634 -42.080 1.00 0.00 H new ATOM 0 HG22 ILE A 39 2.290 -31.312 -40.419 1.00 0.00 H new ATOM 0 HG23 ILE A 39 2.280 -32.975 -41.053 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -0.821 -32.758 -44.897 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -1.681 -32.365 -43.389 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -0.783 -31.097 -44.257 1.00 0.00 H new ATOM 267 N GLU A 40 -0.286 -30.454 -38.915 1.00 0.00 N ATOM 268 CA GLU A 40 0.159 -29.900 -37.604 1.00 0.00 C ATOM 269 C GLU A 40 -0.522 -30.669 -36.447 1.00 0.00 C ATOM 270 O GLU A 40 0.082 -30.859 -35.394 1.00 0.00 O ATOM 271 CB GLU A 40 -0.101 -28.353 -37.488 1.00 0.00 C ATOM 272 CG GLU A 40 -1.522 -27.947 -37.043 1.00 0.00 C ATOM 273 CD GLU A 40 -1.759 -26.422 -37.017 1.00 0.00 C ATOM 274 OE1 GLU A 40 -1.479 -25.783 -35.971 1.00 0.00 O ATOM 275 OE2 GLU A 40 -2.248 -25.871 -38.030 1.00 0.00 O ATOM 0 H GLU A 40 -0.827 -29.799 -39.479 1.00 0.00 H new ATOM 0 HA GLU A 40 1.238 -30.037 -37.535 1.00 0.00 H new ATOM 0 HB2 GLU A 40 0.615 -27.934 -36.781 1.00 0.00 H new ATOM 0 HB3 GLU A 40 0.102 -27.895 -38.456 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -2.247 -28.406 -37.715 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -1.709 -28.351 -36.048 1.00 0.00 H new ATOM 282 N ASP A 41 -1.778 -31.126 -36.686 1.00 0.00 N ATOM 283 CA ASP A 41 -2.569 -31.919 -35.715 1.00 0.00 C ATOM 284 C ASP A 41 -1.886 -33.263 -35.435 1.00 0.00 C ATOM 285 O ASP A 41 -1.614 -33.600 -34.284 1.00 0.00 O ATOM 286 CB ASP A 41 -4.000 -32.170 -36.252 1.00 0.00 C ATOM 287 CG ASP A 41 -4.760 -30.871 -36.534 1.00 0.00 C ATOM 288 OD1 ASP A 41 -4.557 -30.285 -37.610 1.00 0.00 O ATOM 289 OD2 ASP A 41 -5.561 -30.429 -35.683 1.00 0.00 O ATOM 0 H ASP A 41 -2.271 -30.953 -37.562 1.00 0.00 H new ATOM 0 HA ASP A 41 -2.631 -31.349 -34.788 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -3.942 -32.759 -37.167 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -4.557 -32.762 -35.527 1.00 0.00 H new ATOM 294 N ALA A 42 -1.589 -34.007 -36.521 1.00 0.00 N ATOM 295 CA ALA A 42 -0.948 -35.348 -36.456 1.00 0.00 C ATOM 296 C ALA A 42 0.371 -35.316 -35.652 1.00 0.00 C ATOM 297 O ALA A 42 0.658 -36.213 -34.848 1.00 0.00 O ATOM 298 CB ALA A 42 -0.700 -35.881 -37.885 1.00 0.00 C ATOM 0 H ALA A 42 -1.786 -33.698 -37.473 1.00 0.00 H new ATOM 0 HA ALA A 42 -1.628 -36.021 -35.934 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -0.230 -36.863 -37.831 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -1.650 -35.962 -38.413 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -0.044 -35.195 -38.421 1.00 0.00 H new ATOM 304 N ILE A 43 1.139 -34.240 -35.849 1.00 0.00 N ATOM 305 CA ILE A 43 2.459 -34.052 -35.229 1.00 0.00 C ATOM 306 C ILE A 43 2.335 -33.470 -33.788 1.00 0.00 C ATOM 307 O ILE A 43 3.193 -33.721 -32.924 1.00 0.00 O ATOM 308 CB ILE A 43 3.354 -33.135 -36.154 1.00 0.00 C ATOM 309 CG1 ILE A 43 3.397 -33.687 -37.621 1.00 0.00 C ATOM 310 CG2 ILE A 43 4.786 -32.993 -35.602 1.00 0.00 C ATOM 311 CD1 ILE A 43 4.006 -35.075 -37.758 1.00 0.00 C ATOM 0 H ILE A 43 0.860 -33.465 -36.450 1.00 0.00 H new ATOM 0 HA ILE A 43 2.943 -35.024 -35.132 1.00 0.00 H new ATOM 0 HB ILE A 43 2.895 -32.146 -36.163 1.00 0.00 H new ATOM 0 HG12 ILE A 43 2.382 -33.709 -38.017 1.00 0.00 H new ATOM 0 HG13 ILE A 43 3.965 -32.993 -38.240 1.00 0.00 H new ATOM 0 HG21 ILE A 43 5.370 -32.355 -36.266 1.00 0.00 H new ATOM 0 HG22 ILE A 43 4.750 -32.546 -34.608 1.00 0.00 H new ATOM 0 HG23 ILE A 43 5.252 -33.977 -35.541 1.00 0.00 H new ATOM 0 HD11 ILE A 43 3.994 -35.376 -38.806 1.00 0.00 H new ATOM 0 HD12 ILE A 43 5.034 -35.058 -37.397 1.00 0.00 H new ATOM 0 HD13 ILE A 43 3.426 -35.786 -37.170 1.00 0.00 H new ATOM 323 N ALA A 44 1.243 -32.727 -33.523 1.00 0.00 N ATOM 324 CA ALA A 44 0.986 -32.120 -32.194 1.00 0.00 C ATOM 325 C ALA A 44 0.512 -33.181 -31.177 1.00 0.00 C ATOM 326 O ALA A 44 0.747 -33.043 -29.972 1.00 0.00 O ATOM 327 CB ALA A 44 -0.038 -30.983 -32.308 1.00 0.00 C ATOM 0 H ALA A 44 0.519 -32.530 -34.213 1.00 0.00 H new ATOM 0 HA ALA A 44 1.925 -31.704 -31.829 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -0.213 -30.551 -31.323 1.00 0.00 H new ATOM 0 HB2 ALA A 44 0.345 -30.214 -32.979 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -0.975 -31.375 -32.704 1.00 0.00 H new ATOM 333 N ARG A 45 -0.172 -34.235 -31.664 1.00 0.00 N ATOM 334 CA ARG A 45 -0.600 -35.375 -30.818 1.00 0.00 C ATOM 335 C ARG A 45 0.461 -36.490 -30.810 1.00 0.00 C ATOM 336 O ARG A 45 0.351 -37.449 -30.039 1.00 0.00 O ATOM 337 CB ARG A 45 -1.982 -35.909 -31.279 1.00 0.00 C ATOM 338 CG ARG A 45 -2.021 -36.440 -32.728 1.00 0.00 C ATOM 339 CD ARG A 45 -3.451 -36.666 -33.249 1.00 0.00 C ATOM 340 NE ARG A 45 -4.219 -35.404 -33.332 1.00 0.00 N ATOM 341 CZ ARG A 45 -5.344 -35.226 -34.032 1.00 0.00 C ATOM 342 NH1 ARG A 45 -5.897 -36.233 -34.699 1.00 0.00 N ATOM 343 NH2 ARG A 45 -5.914 -34.034 -34.048 1.00 0.00 N ATOM 0 H ARG A 45 -0.443 -34.324 -32.643 1.00 0.00 H new ATOM 0 HA ARG A 45 -0.704 -35.019 -29.793 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -2.290 -36.709 -30.606 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -2.716 -35.109 -31.180 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -1.510 -35.733 -33.382 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -1.469 -37.379 -32.780 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -3.408 -37.129 -34.235 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -3.970 -37.363 -32.591 1.00 0.00 H new ATOM 0 HE ARG A 45 -3.860 -34.603 -32.812 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -5.463 -37.156 -34.681 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -6.756 -36.083 -35.229 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -5.495 -33.262 -33.530 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -6.773 -33.886 -34.579 1.00 0.00 H new ATOM 357 N ALA A 46 1.490 -36.356 -31.677 1.00 0.00 N ATOM 358 CA ALA A 46 2.629 -37.293 -31.725 1.00 0.00 C ATOM 359 C ALA A 46 3.469 -37.194 -30.436 1.00 0.00 C ATOM 360 O ALA A 46 3.690 -38.201 -29.756 1.00 0.00 O ATOM 361 CB ALA A 46 3.492 -37.020 -32.967 1.00 0.00 C ATOM 0 H ALA A 46 1.552 -35.599 -32.358 1.00 0.00 H new ATOM 0 HA ALA A 46 2.241 -38.309 -31.795 1.00 0.00 H new ATOM 0 HB1 ALA A 46 4.328 -37.718 -32.990 1.00 0.00 H new ATOM 0 HB2 ALA A 46 2.888 -37.148 -33.865 1.00 0.00 H new ATOM 0 HB3 ALA A 46 3.873 -35.999 -32.928 1.00 0.00 H new ATOM 367 N ARG A 47 3.920 -35.962 -30.107 1.00 0.00 N ATOM 368 CA ARG A 47 4.657 -35.670 -28.847 1.00 0.00 C ATOM 369 C ARG A 47 4.350 -34.249 -28.311 1.00 0.00 C ATOM 370 O ARG A 47 4.723 -33.914 -27.183 1.00 0.00 O ATOM 371 CB ARG A 47 6.197 -35.883 -29.062 1.00 0.00 C ATOM 372 CG ARG A 47 6.901 -34.946 -30.091 1.00 0.00 C ATOM 373 CD ARG A 47 7.372 -33.606 -29.489 1.00 0.00 C ATOM 374 NE ARG A 47 8.110 -32.762 -30.453 1.00 0.00 N ATOM 375 CZ ARG A 47 8.871 -31.698 -30.116 1.00 0.00 C ATOM 376 NH1 ARG A 47 9.026 -31.347 -28.849 1.00 0.00 N ATOM 377 NH2 ARG A 47 9.478 -31.001 -31.062 1.00 0.00 N ATOM 0 H ARG A 47 3.786 -35.144 -30.701 1.00 0.00 H new ATOM 0 HA ARG A 47 4.313 -36.369 -28.085 1.00 0.00 H new ATOM 0 HB2 ARG A 47 6.694 -35.764 -28.099 1.00 0.00 H new ATOM 0 HB3 ARG A 47 6.356 -36.914 -29.377 1.00 0.00 H new ATOM 0 HG2 ARG A 47 7.760 -35.466 -30.514 1.00 0.00 H new ATOM 0 HG3 ARG A 47 6.215 -34.743 -30.913 1.00 0.00 H new ATOM 0 HD2 ARG A 47 6.506 -33.055 -29.123 1.00 0.00 H new ATOM 0 HD3 ARG A 47 8.010 -33.806 -28.628 1.00 0.00 H new ATOM 0 HE ARG A 47 8.040 -33.000 -31.442 1.00 0.00 H new ATOM 0 HH11 ARG A 47 8.568 -31.882 -28.112 1.00 0.00 H new ATOM 0 HH12 ARG A 47 9.604 -30.541 -28.610 1.00 0.00 H new ATOM 0 HH21 ARG A 47 9.370 -31.268 -32.041 1.00 0.00 H new ATOM 0 HH22 ARG A 47 10.054 -30.197 -30.813 1.00 0.00 H new ATOM 391 N GLY A 48 3.663 -33.426 -29.124 1.00 0.00 N ATOM 392 CA GLY A 48 3.450 -32.011 -28.816 1.00 0.00 C ATOM 393 C GLY A 48 4.536 -31.142 -29.412 1.00 0.00 C ATOM 394 O GLY A 48 5.334 -30.525 -28.686 1.00 0.00 O ATOM 0 H GLY A 48 3.245 -33.726 -30.005 1.00 0.00 H new ATOM 0 HA2 GLY A 48 2.480 -31.696 -29.200 1.00 0.00 H new ATOM 0 HA3 GLY A 48 3.425 -31.873 -27.735 1.00 0.00 H new ATOM 398 N GLU A 49 4.589 -31.148 -30.753 1.00 0.00 N ATOM 399 CA GLU A 49 5.500 -30.303 -31.543 1.00 0.00 C ATOM 400 C GLU A 49 5.154 -28.824 -31.339 1.00 0.00 C ATOM 401 O GLU A 49 6.026 -27.995 -31.061 1.00 0.00 O ATOM 402 CB GLU A 49 5.367 -30.668 -33.041 1.00 0.00 C ATOM 403 CG GLU A 49 6.375 -29.975 -33.991 1.00 0.00 C ATOM 404 CD GLU A 49 7.840 -30.376 -33.739 1.00 0.00 C ATOM 405 OE1 GLU A 49 8.146 -31.593 -33.730 1.00 0.00 O ATOM 406 OE2 GLU A 49 8.687 -29.492 -33.511 1.00 0.00 O ATOM 0 H GLU A 49 3.994 -31.746 -31.326 1.00 0.00 H new ATOM 0 HA GLU A 49 6.525 -30.474 -31.214 1.00 0.00 H new ATOM 0 HB2 GLU A 49 5.480 -31.747 -33.145 1.00 0.00 H new ATOM 0 HB3 GLU A 49 4.357 -30.420 -33.369 1.00 0.00 H new ATOM 0 HG2 GLU A 49 6.114 -30.216 -35.022 1.00 0.00 H new ATOM 0 HG3 GLU A 49 6.279 -28.895 -33.882 1.00 0.00 H new ATOM 413 N ILE A 50 3.857 -28.526 -31.500 1.00 0.00 N ATOM 414 CA ILE A 50 3.315 -27.175 -31.375 1.00 0.00 C ATOM 415 C ILE A 50 3.400 -26.672 -29.904 1.00 0.00 C ATOM 416 O ILE A 50 2.932 -27.364 -28.985 1.00 0.00 O ATOM 417 CB ILE A 50 1.831 -27.125 -31.908 1.00 0.00 C ATOM 418 CG1 ILE A 50 1.771 -27.494 -33.435 1.00 0.00 C ATOM 419 CG2 ILE A 50 1.176 -25.752 -31.634 1.00 0.00 C ATOM 420 CD1 ILE A 50 2.574 -26.578 -34.357 1.00 0.00 C ATOM 0 H ILE A 50 3.151 -29.227 -31.723 1.00 0.00 H new ATOM 0 HA ILE A 50 3.920 -26.506 -31.987 1.00 0.00 H new ATOM 0 HB ILE A 50 1.256 -27.872 -31.360 1.00 0.00 H new ATOM 0 HG12 ILE A 50 2.131 -28.515 -33.560 1.00 0.00 H new ATOM 0 HG13 ILE A 50 0.729 -27.482 -33.755 1.00 0.00 H new ATOM 0 HG21 ILE A 50 0.155 -25.754 -32.015 1.00 0.00 H new ATOM 0 HG22 ILE A 50 1.163 -25.563 -30.561 1.00 0.00 H new ATOM 0 HG23 ILE A 50 1.748 -24.970 -32.133 1.00 0.00 H new ATOM 0 HD11 ILE A 50 2.468 -26.916 -35.388 1.00 0.00 H new ATOM 0 HD12 ILE A 50 2.202 -25.557 -34.270 1.00 0.00 H new ATOM 0 HD13 ILE A 50 3.626 -26.606 -34.072 1.00 0.00 H new ATOM 432 N PRO A 51 4.015 -25.465 -29.668 1.00 0.00 N ATOM 433 CA PRO A 51 4.103 -24.853 -28.327 1.00 0.00 C ATOM 434 C PRO A 51 2.819 -24.088 -27.935 1.00 0.00 C ATOM 435 O PRO A 51 1.868 -23.977 -28.725 1.00 0.00 O ATOM 436 CB PRO A 51 5.308 -23.898 -28.486 1.00 0.00 C ATOM 437 CG PRO A 51 5.198 -23.415 -29.902 1.00 0.00 C ATOM 438 CD PRO A 51 4.683 -24.605 -30.697 1.00 0.00 C ATOM 0 HA PRO A 51 4.220 -25.588 -27.530 1.00 0.00 H new ATOM 0 HB2 PRO A 51 5.260 -23.072 -27.777 1.00 0.00 H new ATOM 0 HB3 PRO A 51 6.253 -24.413 -28.311 1.00 0.00 H new ATOM 0 HG2 PRO A 51 4.516 -22.568 -29.976 1.00 0.00 H new ATOM 0 HG3 PRO A 51 6.164 -23.080 -30.279 1.00 0.00 H new ATOM 0 HD2 PRO A 51 3.983 -24.294 -31.473 1.00 0.00 H new ATOM 0 HD3 PRO A 51 5.495 -25.135 -31.194 1.00 0.00 H new ATOM 446 N ARG A 52 2.821 -23.555 -26.704 1.00 0.00 N ATOM 447 CA ARG A 52 1.705 -22.768 -26.147 1.00 0.00 C ATOM 448 C ARG A 52 1.824 -21.305 -26.591 1.00 0.00 C ATOM 449 O ARG A 52 2.192 -20.414 -25.820 1.00 0.00 O ATOM 450 CB ARG A 52 1.663 -22.932 -24.599 1.00 0.00 C ATOM 451 CG ARG A 52 1.444 -24.400 -24.162 1.00 0.00 C ATOM 452 CD ARG A 52 0.097 -24.966 -24.676 1.00 0.00 C ATOM 453 NE ARG A 52 0.154 -26.412 -24.942 1.00 0.00 N ATOM 454 CZ ARG A 52 -0.851 -27.131 -25.456 1.00 0.00 C ATOM 455 NH1 ARG A 52 -2.051 -26.588 -25.646 1.00 0.00 N ATOM 456 NH2 ARG A 52 -0.638 -28.394 -25.771 1.00 0.00 N ATOM 0 H ARG A 52 3.604 -23.658 -26.059 1.00 0.00 H new ATOM 0 HA ARG A 52 0.755 -23.139 -26.532 1.00 0.00 H new ATOM 0 HB2 ARG A 52 2.597 -22.565 -24.173 1.00 0.00 H new ATOM 0 HB3 ARG A 52 0.863 -22.313 -24.193 1.00 0.00 H new ATOM 0 HG2 ARG A 52 2.262 -25.015 -24.537 1.00 0.00 H new ATOM 0 HG3 ARG A 52 1.471 -24.462 -23.074 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -0.681 -24.767 -23.939 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -0.187 -24.443 -25.589 1.00 0.00 H new ATOM 0 HE ARG A 52 1.021 -26.901 -24.719 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -2.214 -25.612 -25.399 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -2.808 -27.148 -26.039 1.00 0.00 H new ATOM 0 HH21 ARG A 52 0.282 -28.809 -25.622 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -1.393 -28.956 -26.164 1.00 0.00 H new ATOM 470 N GLY A 53 1.532 -21.122 -27.880 1.00 0.00 N ATOM 471 CA GLY A 53 1.615 -19.843 -28.573 1.00 0.00 C ATOM 472 C GLY A 53 0.978 -19.954 -29.953 1.00 0.00 C ATOM 473 O GLY A 53 0.426 -18.985 -30.476 1.00 0.00 O ATOM 0 H GLY A 53 1.223 -21.883 -28.484 1.00 0.00 H new ATOM 0 HA2 GLY A 53 1.110 -19.072 -27.991 1.00 0.00 H new ATOM 0 HA3 GLY A 53 2.657 -19.539 -28.668 1.00 0.00 H new ATOM 477 N GLU A 54 1.054 -21.169 -30.539 1.00 0.00 N ATOM 478 CA GLU A 54 0.378 -21.511 -31.802 1.00 0.00 C ATOM 479 C GLU A 54 -0.932 -22.291 -31.523 1.00 0.00 C ATOM 480 O GLU A 54 -1.329 -22.470 -30.360 1.00 0.00 O ATOM 481 CB GLU A 54 1.345 -22.316 -32.720 1.00 0.00 C ATOM 482 CG GLU A 54 2.645 -21.572 -33.098 1.00 0.00 C ATOM 483 CD GLU A 54 2.383 -20.187 -33.719 1.00 0.00 C ATOM 484 OE1 GLU A 54 1.893 -20.129 -34.867 1.00 0.00 O ATOM 485 OE2 GLU A 54 2.610 -19.159 -33.039 1.00 0.00 O ATOM 0 H GLU A 54 1.590 -21.942 -30.144 1.00 0.00 H new ATOM 0 HA GLU A 54 0.105 -20.594 -32.324 1.00 0.00 H new ATOM 0 HB2 GLU A 54 1.608 -23.248 -32.219 1.00 0.00 H new ATOM 0 HB3 GLU A 54 0.817 -22.584 -33.635 1.00 0.00 H new ATOM 0 HG2 GLU A 54 3.263 -21.455 -32.208 1.00 0.00 H new ATOM 0 HG3 GLU A 54 3.214 -22.179 -33.803 1.00 0.00 H new ATOM 492 N SER A 55 -1.591 -22.737 -32.615 1.00 0.00 N ATOM 493 CA SER A 55 -2.920 -23.389 -32.587 1.00 0.00 C ATOM 494 C SER A 55 -2.884 -24.752 -31.862 1.00 0.00 C ATOM 495 O SER A 55 -1.917 -25.495 -31.982 1.00 0.00 O ATOM 496 CB SER A 55 -3.415 -23.562 -34.034 1.00 0.00 C ATOM 497 OG SER A 55 -3.510 -22.303 -34.689 1.00 0.00 O ATOM 0 H SER A 55 -1.208 -22.653 -33.557 1.00 0.00 H new ATOM 0 HA SER A 55 -3.606 -22.754 -32.027 1.00 0.00 H new ATOM 0 HB2 SER A 55 -2.732 -24.211 -34.582 1.00 0.00 H new ATOM 0 HB3 SER A 55 -4.389 -24.051 -34.034 1.00 0.00 H new ATOM 0 HG SER A 55 -3.931 -22.422 -35.566 1.00 0.00 H new ATOM 503 N LEU A 56 -3.962 -25.070 -31.121 1.00 0.00 N ATOM 504 CA LEU A 56 -4.068 -26.322 -30.322 1.00 0.00 C ATOM 505 C LEU A 56 -5.344 -27.120 -30.693 1.00 0.00 C ATOM 506 O LEU A 56 -6.078 -26.729 -31.601 1.00 0.00 O ATOM 507 CB LEU A 56 -3.979 -25.982 -28.792 1.00 0.00 C ATOM 508 CG LEU A 56 -4.753 -24.711 -28.293 1.00 0.00 C ATOM 509 CD1 LEU A 56 -6.269 -24.819 -28.482 1.00 0.00 C ATOM 510 CD2 LEU A 56 -4.408 -24.375 -26.828 1.00 0.00 C ATOM 0 H LEU A 56 -4.786 -24.473 -31.054 1.00 0.00 H new ATOM 0 HA LEU A 56 -3.230 -26.976 -30.562 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -4.347 -26.842 -28.233 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -2.927 -25.860 -28.534 1.00 0.00 H new ATOM 0 HG LEU A 56 -4.414 -23.889 -28.924 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -6.747 -23.909 -28.118 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -6.495 -24.949 -29.540 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -6.645 -25.675 -27.923 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -4.963 -23.489 -26.518 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -4.679 -25.215 -26.189 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -3.339 -24.182 -26.741 1.00 0.00 H new ATOM 522 N ASP A 57 -5.583 -28.241 -29.985 1.00 0.00 N ATOM 523 CA ASP A 57 -6.744 -29.139 -30.224 1.00 0.00 C ATOM 524 C ASP A 57 -7.758 -29.062 -29.067 1.00 0.00 C ATOM 525 O ASP A 57 -8.881 -29.560 -29.176 1.00 0.00 O ATOM 526 CB ASP A 57 -6.272 -30.606 -30.362 1.00 0.00 C ATOM 527 CG ASP A 57 -5.222 -30.823 -31.448 1.00 0.00 C ATOM 528 OD1 ASP A 57 -4.052 -30.407 -31.242 1.00 0.00 O ATOM 529 OD2 ASP A 57 -5.535 -31.421 -32.507 1.00 0.00 O ATOM 0 H ASP A 57 -4.977 -28.556 -29.227 1.00 0.00 H new ATOM 0 HA ASP A 57 -7.223 -28.809 -31.146 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -5.865 -30.937 -29.407 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -7.136 -31.236 -30.576 1.00 0.00 H new ATOM 534 N GLU A 58 -7.360 -28.424 -27.961 1.00 0.00 N ATOM 535 CA GLU A 58 -8.116 -28.429 -26.698 1.00 0.00 C ATOM 536 C GLU A 58 -8.281 -26.981 -26.211 1.00 0.00 C ATOM 537 O GLU A 58 -7.306 -26.346 -25.801 1.00 0.00 O ATOM 538 CB GLU A 58 -7.409 -29.270 -25.587 1.00 0.00 C ATOM 539 CG GLU A 58 -7.299 -30.803 -25.818 1.00 0.00 C ATOM 540 CD GLU A 58 -6.197 -31.269 -26.794 1.00 0.00 C ATOM 541 OE1 GLU A 58 -5.210 -30.533 -27.015 1.00 0.00 O ATOM 542 OE2 GLU A 58 -6.320 -32.381 -27.358 1.00 0.00 O ATOM 0 H GLU A 58 -6.496 -27.884 -27.914 1.00 0.00 H new ATOM 0 HA GLU A 58 -9.085 -28.889 -26.890 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -6.402 -28.875 -25.454 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -7.941 -29.107 -24.650 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -7.128 -31.283 -24.854 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -8.259 -31.163 -26.188 1.00 0.00 H new ATOM 549 N CYS A 59 -9.510 -26.468 -26.327 1.00 0.00 N ATOM 550 CA CYS A 59 -9.919 -25.156 -25.790 1.00 0.00 C ATOM 551 C CYS A 59 -9.563 -25.007 -24.302 1.00 0.00 C ATOM 552 O CYS A 59 -10.134 -25.700 -23.481 1.00 0.00 O ATOM 553 CB CYS A 59 -11.433 -25.012 -25.970 1.00 0.00 C ATOM 554 SG CYS A 59 -12.162 -23.588 -25.121 1.00 0.00 S ATOM 0 H CYS A 59 -10.266 -26.958 -26.805 1.00 0.00 H new ATOM 0 HA CYS A 59 -9.384 -24.377 -26.333 1.00 0.00 H new ATOM 0 HB2 CYS A 59 -11.653 -24.935 -27.035 1.00 0.00 H new ATOM 0 HB3 CYS A 59 -11.916 -25.920 -25.609 1.00 0.00 H new ATOM 559 N GLU A 60 -8.667 -24.057 -23.959 1.00 0.00 N ATOM 560 CA GLU A 60 -8.141 -23.918 -22.570 1.00 0.00 C ATOM 561 C GLU A 60 -9.205 -23.416 -21.554 1.00 0.00 C ATOM 562 O GLU A 60 -8.927 -23.313 -20.357 1.00 0.00 O ATOM 563 CB GLU A 60 -6.895 -22.994 -22.556 1.00 0.00 C ATOM 564 CG GLU A 60 -7.141 -21.548 -23.037 1.00 0.00 C ATOM 565 CD GLU A 60 -5.907 -20.652 -22.859 1.00 0.00 C ATOM 566 OE1 GLU A 60 -4.909 -20.857 -23.575 1.00 0.00 O ATOM 567 OE2 GLU A 60 -5.915 -19.761 -21.980 1.00 0.00 O ATOM 0 H GLU A 60 -8.290 -23.374 -24.616 1.00 0.00 H new ATOM 0 HA GLU A 60 -7.857 -24.919 -22.244 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -6.500 -22.959 -21.541 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -6.124 -23.442 -23.183 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -7.427 -21.562 -24.089 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -7.978 -21.122 -22.484 1.00 0.00 H new ATOM 574 N GLU A 61 -10.416 -23.116 -22.047 1.00 0.00 N ATOM 575 CA GLU A 61 -11.559 -22.689 -21.217 1.00 0.00 C ATOM 576 C GLU A 61 -12.284 -23.920 -20.684 1.00 0.00 C ATOM 577 O GLU A 61 -12.378 -24.140 -19.478 1.00 0.00 O ATOM 578 CB GLU A 61 -12.554 -21.876 -22.091 1.00 0.00 C ATOM 579 CG GLU A 61 -11.942 -20.668 -22.821 1.00 0.00 C ATOM 580 CD GLU A 61 -12.113 -19.321 -22.088 1.00 0.00 C ATOM 581 OE1 GLU A 61 -11.454 -19.101 -21.063 1.00 0.00 O ATOM 582 OE2 GLU A 61 -12.916 -18.476 -22.559 1.00 0.00 O ATOM 0 H GLU A 61 -10.634 -23.163 -23.042 1.00 0.00 H new ATOM 0 HA GLU A 61 -11.195 -22.078 -20.391 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -12.993 -22.544 -22.831 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -13.368 -21.524 -21.457 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -10.878 -20.852 -22.972 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -12.395 -20.589 -23.809 1.00 0.00 H new ATOM 589 N CYS A 62 -12.780 -24.733 -21.633 1.00 0.00 N ATOM 590 CA CYS A 62 -13.789 -25.770 -21.349 1.00 0.00 C ATOM 591 C CYS A 62 -13.381 -27.147 -21.916 1.00 0.00 C ATOM 592 O CYS A 62 -14.179 -28.084 -21.898 1.00 0.00 O ATOM 593 CB CYS A 62 -15.149 -25.300 -21.924 1.00 0.00 C ATOM 594 SG CYS A 62 -15.299 -25.354 -23.746 1.00 0.00 S ATOM 0 H CYS A 62 -12.496 -24.691 -22.612 1.00 0.00 H new ATOM 0 HA CYS A 62 -13.871 -25.903 -20.270 1.00 0.00 H new ATOM 0 HB2 CYS A 62 -15.938 -25.918 -21.494 1.00 0.00 H new ATOM 0 HB3 CYS A 62 -15.329 -24.277 -21.593 1.00 0.00 H new ATOM 599 N GLY A 63 -12.115 -27.252 -22.377 1.00 0.00 N ATOM 600 CA GLY A 63 -11.555 -28.478 -22.983 1.00 0.00 C ATOM 601 C GLY A 63 -12.334 -29.004 -24.187 1.00 0.00 C ATOM 602 O GLY A 63 -12.335 -30.206 -24.454 1.00 0.00 O ATOM 0 H GLY A 63 -11.448 -26.481 -22.338 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -10.528 -28.280 -23.290 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -11.516 -29.258 -22.223 1.00 0.00 H new ATOM 606 N ALA A 64 -12.988 -28.087 -24.916 1.00 0.00 N ATOM 607 CA ALA A 64 -13.813 -28.431 -26.091 1.00 0.00 C ATOM 608 C ALA A 64 -12.918 -28.635 -27.332 1.00 0.00 C ATOM 609 O ALA A 64 -11.929 -27.893 -27.488 1.00 0.00 O ATOM 610 CB ALA A 64 -14.863 -27.337 -26.346 1.00 0.00 C ATOM 0 H ALA A 64 -12.962 -27.088 -24.711 1.00 0.00 H new ATOM 0 HA ALA A 64 -14.337 -29.365 -25.891 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -15.464 -27.605 -27.215 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -15.509 -27.243 -25.473 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -14.361 -26.387 -26.530 1.00 0.00 H new ATOM 616 N PRO A 65 -13.243 -29.634 -28.220 1.00 0.00 N ATOM 617 CA PRO A 65 -12.468 -29.900 -29.453 1.00 0.00 C ATOM 618 C PRO A 65 -12.384 -28.671 -30.394 1.00 0.00 C ATOM 619 O PRO A 65 -13.404 -28.182 -30.901 1.00 0.00 O ATOM 620 CB PRO A 65 -13.234 -31.075 -30.128 1.00 0.00 C ATOM 621 CG PRO A 65 -13.981 -31.727 -29.006 1.00 0.00 C ATOM 622 CD PRO A 65 -14.376 -30.596 -28.084 1.00 0.00 C ATOM 0 HA PRO A 65 -11.428 -30.135 -29.228 1.00 0.00 H new ATOM 0 HB2 PRO A 65 -13.913 -30.715 -30.901 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -12.548 -31.773 -30.607 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -14.858 -32.260 -29.374 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -13.358 -32.457 -28.489 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -15.324 -30.147 -28.381 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -14.493 -30.937 -27.055 1.00 0.00 H new ATOM 630 N ILE A 66 -11.156 -28.158 -30.549 1.00 0.00 N ATOM 631 CA ILE A 66 -10.827 -27.080 -31.491 1.00 0.00 C ATOM 632 C ILE A 66 -10.874 -27.620 -32.938 1.00 0.00 C ATOM 633 O ILE A 66 -10.206 -28.617 -33.229 1.00 0.00 O ATOM 634 CB ILE A 66 -9.385 -26.516 -31.178 1.00 0.00 C ATOM 635 CG1 ILE A 66 -9.322 -25.957 -29.735 1.00 0.00 C ATOM 636 CG2 ILE A 66 -8.938 -25.446 -32.213 1.00 0.00 C ATOM 637 CD1 ILE A 66 -9.958 -24.614 -29.556 1.00 0.00 C ATOM 0 H ILE A 66 -10.351 -28.485 -30.015 1.00 0.00 H new ATOM 0 HA ILE A 66 -11.556 -26.276 -31.384 1.00 0.00 H new ATOM 0 HB ILE A 66 -8.684 -27.346 -31.259 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -9.807 -26.666 -29.064 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -8.277 -25.893 -29.430 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -7.941 -25.087 -31.958 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -8.920 -25.888 -33.209 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -9.639 -24.611 -32.199 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -9.866 -24.304 -28.515 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -9.459 -23.887 -30.197 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -11.013 -24.672 -29.825 1.00 0.00 H new ATOM 649 N PRO A 67 -11.684 -27.012 -33.854 1.00 0.00 N ATOM 650 CA PRO A 67 -11.665 -27.374 -35.285 1.00 0.00 C ATOM 651 C PRO A 67 -10.468 -26.724 -35.996 1.00 0.00 C ATOM 652 O PRO A 67 -9.982 -25.655 -35.573 1.00 0.00 O ATOM 653 CB PRO A 67 -13.010 -26.815 -35.796 1.00 0.00 C ATOM 654 CG PRO A 67 -13.253 -25.606 -34.944 1.00 0.00 C ATOM 655 CD PRO A 67 -12.680 -25.942 -33.578 1.00 0.00 C ATOM 0 HA PRO A 67 -11.556 -28.443 -35.467 1.00 0.00 H new ATOM 0 HB2 PRO A 67 -12.957 -26.553 -36.853 1.00 0.00 H new ATOM 0 HB3 PRO A 67 -13.812 -27.546 -35.688 1.00 0.00 H new ATOM 0 HG2 PRO A 67 -12.768 -24.726 -35.366 1.00 0.00 H new ATOM 0 HG3 PRO A 67 -14.318 -25.382 -34.877 1.00 0.00 H new ATOM 0 HD2 PRO A 67 -12.213 -25.072 -33.117 1.00 0.00 H new ATOM 0 HD3 PRO A 67 -13.456 -26.287 -32.894 1.00 0.00 H new ATOM 663 N GLN A 68 -10.005 -27.357 -37.091 1.00 0.00 N ATOM 664 CA GLN A 68 -8.913 -26.811 -37.909 1.00 0.00 C ATOM 665 C GLN A 68 -9.340 -25.516 -38.620 1.00 0.00 C ATOM 666 O GLN A 68 -8.486 -24.799 -39.110 1.00 0.00 O ATOM 667 CB GLN A 68 -8.366 -27.826 -38.940 1.00 0.00 C ATOM 668 CG GLN A 68 -9.386 -28.330 -40.003 1.00 0.00 C ATOM 669 CD GLN A 68 -8.803 -28.470 -41.418 1.00 0.00 C ATOM 670 OE1 GLN A 68 -8.000 -27.499 -41.845 1.00 0.00 O flip ATOM 671 NE2 GLN A 68 -9.157 -29.388 -42.161 1.00 0.00 N flip ATOM 0 H GLN A 68 -10.373 -28.247 -37.427 1.00 0.00 H new ATOM 0 HA GLN A 68 -8.104 -26.586 -37.215 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -7.524 -27.369 -39.460 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -7.976 -28.689 -38.400 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -9.777 -29.297 -39.686 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -10.230 -27.641 -40.036 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -9.773 -30.120 -41.809 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -8.833 -29.415 -43.128 1.00 0.00 H new ATOM 680 N ALA A 69 -10.666 -25.230 -38.640 1.00 0.00 N ATOM 681 CA ALA A 69 -11.213 -23.980 -39.198 1.00 0.00 C ATOM 682 C ALA A 69 -10.733 -22.788 -38.364 1.00 0.00 C ATOM 683 O ALA A 69 -10.424 -21.729 -38.898 1.00 0.00 O ATOM 684 CB ALA A 69 -12.749 -24.030 -39.231 1.00 0.00 C ATOM 0 H ALA A 69 -11.378 -25.860 -38.270 1.00 0.00 H new ATOM 0 HA ALA A 69 -10.856 -23.864 -40.221 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -13.135 -23.099 -39.646 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -13.073 -24.865 -39.852 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -13.131 -24.161 -38.218 1.00 0.00 H new ATOM 690 N ARG A 70 -10.684 -22.987 -37.033 1.00 0.00 N ATOM 691 CA ARG A 70 -10.128 -22.005 -36.094 1.00 0.00 C ATOM 692 C ARG A 70 -8.594 -21.959 -36.164 1.00 0.00 C ATOM 693 O ARG A 70 -8.010 -20.916 -35.935 1.00 0.00 O ATOM 694 CB ARG A 70 -10.608 -22.284 -34.644 1.00 0.00 C ATOM 695 CG ARG A 70 -12.132 -22.075 -34.389 1.00 0.00 C ATOM 696 CD ARG A 70 -12.624 -20.623 -34.655 1.00 0.00 C ATOM 697 NE ARG A 70 -12.734 -20.320 -36.101 1.00 0.00 N ATOM 698 CZ ARG A 70 -12.824 -19.100 -36.651 1.00 0.00 C ATOM 699 NH1 ARG A 70 -12.899 -18.011 -35.902 1.00 0.00 N ATOM 700 NH2 ARG A 70 -12.871 -18.986 -37.968 1.00 0.00 N ATOM 0 H ARG A 70 -11.030 -23.834 -36.583 1.00 0.00 H new ATOM 0 HA ARG A 70 -10.500 -21.025 -36.392 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -10.352 -23.312 -34.387 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -10.052 -21.637 -33.965 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -12.694 -22.760 -35.024 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -12.357 -22.341 -33.356 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -13.595 -20.479 -34.181 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -11.935 -19.918 -34.190 1.00 0.00 H new ATOM 0 HE ARG A 70 -12.742 -21.115 -36.739 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -12.889 -18.090 -34.885 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -12.967 -17.093 -36.342 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -12.839 -19.821 -38.554 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -12.940 -18.064 -38.398 1.00 0.00 H new ATOM 714 N ARG A 71 -7.954 -23.105 -36.458 1.00 0.00 N ATOM 715 CA ARG A 71 -6.473 -23.200 -36.507 1.00 0.00 C ATOM 716 C ARG A 71 -5.882 -22.502 -37.754 1.00 0.00 C ATOM 717 O ARG A 71 -4.811 -21.886 -37.670 1.00 0.00 O ATOM 718 CB ARG A 71 -6.016 -24.684 -36.436 1.00 0.00 C ATOM 719 CG ARG A 71 -6.498 -25.430 -35.165 1.00 0.00 C ATOM 720 CD ARG A 71 -5.908 -26.846 -35.020 1.00 0.00 C ATOM 721 NE ARG A 71 -4.440 -26.831 -34.817 1.00 0.00 N ATOM 722 CZ ARG A 71 -3.751 -27.724 -34.079 1.00 0.00 C ATOM 723 NH1 ARG A 71 -4.354 -28.763 -33.556 1.00 0.00 N ATOM 724 NH2 ARG A 71 -2.455 -27.572 -33.886 1.00 0.00 N ATOM 0 H ARG A 71 -8.434 -23.981 -36.666 1.00 0.00 H new ATOM 0 HA ARG A 71 -6.088 -22.673 -35.634 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -6.385 -25.210 -37.316 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -4.927 -24.721 -36.476 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -6.232 -24.843 -34.286 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -7.586 -25.499 -35.185 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -6.383 -27.350 -34.178 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -6.142 -27.427 -35.912 1.00 0.00 H new ATOM 0 HE ARG A 71 -3.910 -26.087 -35.271 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -5.353 -28.902 -33.706 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -3.824 -29.433 -32.999 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -1.968 -26.775 -34.296 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -1.940 -28.251 -33.326 1.00 0.00 H new ATOM 738 N GLU A 72 -6.595 -22.598 -38.898 1.00 0.00 N ATOM 739 CA GLU A 72 -6.143 -22.012 -40.184 1.00 0.00 C ATOM 740 C GLU A 72 -6.540 -20.521 -40.274 1.00 0.00 C ATOM 741 O GLU A 72 -5.751 -19.688 -40.753 1.00 0.00 O ATOM 742 CB GLU A 72 -6.711 -22.822 -41.389 1.00 0.00 C ATOM 743 CG GLU A 72 -8.246 -22.834 -41.498 1.00 0.00 C ATOM 744 CD GLU A 72 -8.779 -23.676 -42.666 1.00 0.00 C ATOM 745 OE1 GLU A 72 -8.957 -23.126 -43.780 1.00 0.00 O ATOM 746 OE2 GLU A 72 -9.055 -24.878 -42.466 1.00 0.00 O ATOM 0 H GLU A 72 -7.492 -23.079 -38.959 1.00 0.00 H new ATOM 0 HA GLU A 72 -5.055 -22.071 -40.226 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -6.299 -22.410 -42.311 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -6.359 -23.851 -41.314 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -8.664 -23.216 -40.567 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -8.601 -21.809 -41.610 1.00 0.00 H new ATOM 753 N ALA A 73 -7.768 -20.194 -39.807 1.00 0.00 N ATOM 754 CA ALA A 73 -8.278 -18.802 -39.805 1.00 0.00 C ATOM 755 C ALA A 73 -7.594 -17.965 -38.718 1.00 0.00 C ATOM 756 O ALA A 73 -7.348 -16.765 -38.899 1.00 0.00 O ATOM 757 CB ALA A 73 -9.801 -18.779 -39.599 1.00 0.00 C ATOM 0 H ALA A 73 -8.424 -20.876 -39.426 1.00 0.00 H new ATOM 0 HA ALA A 73 -8.046 -18.366 -40.777 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -10.153 -17.747 -39.601 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -10.286 -19.329 -40.405 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -10.046 -19.244 -38.644 1.00 0.00 H new ATOM 763 N ILE A 74 -7.317 -18.608 -37.568 1.00 0.00 N ATOM 764 CA ILE A 74 -6.645 -17.974 -36.421 1.00 0.00 C ATOM 765 C ILE A 74 -5.361 -18.775 -36.095 1.00 0.00 C ATOM 766 O ILE A 74 -5.411 -19.735 -35.307 1.00 0.00 O ATOM 767 CB ILE A 74 -7.583 -17.914 -35.142 1.00 0.00 C ATOM 768 CG1 ILE A 74 -9.020 -17.425 -35.520 1.00 0.00 C ATOM 769 CG2 ILE A 74 -6.960 -17.023 -34.032 1.00 0.00 C ATOM 770 CD1 ILE A 74 -10.000 -17.394 -34.360 1.00 0.00 C ATOM 0 H ILE A 74 -7.555 -19.587 -37.409 1.00 0.00 H new ATOM 0 HA ILE A 74 -6.399 -16.947 -36.689 1.00 0.00 H new ATOM 0 HB ILE A 74 -7.670 -18.925 -34.745 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -8.949 -16.424 -35.946 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -9.418 -18.076 -36.299 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -7.624 -17.000 -33.168 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -5.994 -17.432 -33.736 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -6.824 -16.010 -34.412 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -10.970 -17.043 -34.712 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -10.105 -18.397 -33.946 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -9.629 -16.720 -33.588 1.00 0.00 H new ATOM 782 N PRO A 75 -4.196 -18.446 -36.751 1.00 0.00 N ATOM 783 CA PRO A 75 -2.899 -19.056 -36.396 1.00 0.00 C ATOM 784 C PRO A 75 -2.488 -18.619 -34.971 1.00 0.00 C ATOM 785 O PRO A 75 -2.034 -17.487 -34.751 1.00 0.00 O ATOM 786 CB PRO A 75 -1.929 -18.534 -37.495 1.00 0.00 C ATOM 787 CG PRO A 75 -2.562 -17.266 -37.991 1.00 0.00 C ATOM 788 CD PRO A 75 -4.059 -17.482 -37.882 1.00 0.00 C ATOM 0 HA PRO A 75 -2.910 -20.146 -36.370 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -0.935 -18.348 -37.089 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -1.814 -19.260 -38.300 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -2.246 -16.411 -37.393 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -2.270 -17.060 -39.021 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -4.584 -16.549 -37.679 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -4.473 -17.887 -38.805 1.00 0.00 H new ATOM 796 N GLY A 76 -2.728 -19.512 -34.006 1.00 0.00 N ATOM 797 CA GLY A 76 -2.545 -19.219 -32.585 1.00 0.00 C ATOM 798 C GLY A 76 -3.871 -19.165 -31.845 1.00 0.00 C ATOM 799 O GLY A 76 -4.094 -18.272 -31.017 1.00 0.00 O ATOM 0 H GLY A 76 -3.055 -20.460 -34.191 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -1.909 -19.981 -32.136 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -2.028 -18.266 -32.474 1.00 0.00 H new ATOM 803 N VAL A 77 -4.763 -20.125 -32.156 1.00 0.00 N ATOM 804 CA VAL A 77 -6.065 -20.248 -31.479 1.00 0.00 C ATOM 805 C VAL A 77 -5.904 -21.041 -30.163 1.00 0.00 C ATOM 806 O VAL A 77 -5.119 -21.994 -30.091 1.00 0.00 O ATOM 807 CB VAL A 77 -7.153 -20.923 -32.398 1.00 0.00 C ATOM 808 CG1 VAL A 77 -6.767 -22.366 -32.803 1.00 0.00 C ATOM 809 CG2 VAL A 77 -8.553 -20.875 -31.735 1.00 0.00 C ATOM 0 H VAL A 77 -4.603 -20.829 -32.876 1.00 0.00 H new ATOM 0 HA VAL A 77 -6.415 -19.240 -31.255 1.00 0.00 H new ATOM 0 HB VAL A 77 -7.198 -20.342 -33.319 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -7.548 -22.788 -33.435 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -5.825 -22.350 -33.351 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -6.655 -22.978 -31.908 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -9.283 -21.348 -32.392 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -8.523 -21.406 -30.784 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -8.839 -19.837 -31.563 1.00 0.00 H new ATOM 819 N ARG A 78 -6.627 -20.602 -29.118 1.00 0.00 N ATOM 820 CA ARG A 78 -6.623 -21.239 -27.782 1.00 0.00 C ATOM 821 C ARG A 78 -8.053 -21.657 -27.390 1.00 0.00 C ATOM 822 O ARG A 78 -8.260 -22.459 -26.474 1.00 0.00 O ATOM 823 CB ARG A 78 -6.074 -20.273 -26.680 1.00 0.00 C ATOM 824 CG ARG A 78 -4.836 -19.419 -27.056 1.00 0.00 C ATOM 825 CD ARG A 78 -5.209 -18.146 -27.841 1.00 0.00 C ATOM 826 NE ARG A 78 -4.025 -17.353 -28.197 1.00 0.00 N ATOM 827 CZ ARG A 78 -3.644 -16.215 -27.594 1.00 0.00 C ATOM 828 NH1 ARG A 78 -4.305 -15.754 -26.535 1.00 0.00 N ATOM 829 NH2 ARG A 78 -2.581 -15.570 -28.026 1.00 0.00 N ATOM 0 H ARG A 78 -7.238 -19.787 -29.174 1.00 0.00 H new ATOM 0 HA ARG A 78 -5.972 -22.111 -27.845 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -6.878 -19.597 -26.389 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -5.823 -20.867 -25.801 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -4.304 -19.138 -26.147 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -4.151 -20.022 -27.653 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -5.746 -18.424 -28.748 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -5.887 -17.537 -27.243 1.00 0.00 H new ATOM 0 HE ARG A 78 -3.445 -17.694 -28.964 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -5.110 -16.266 -26.173 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -4.007 -14.889 -26.085 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -2.049 -15.935 -28.816 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -2.289 -14.705 -27.570 1.00 0.00 H new ATOM 843 N LEU A 79 -9.026 -21.078 -28.096 1.00 0.00 N ATOM 844 CA LEU A 79 -10.433 -21.030 -27.682 1.00 0.00 C ATOM 845 C LEU A 79 -11.314 -21.680 -28.751 1.00 0.00 C ATOM 846 O LEU A 79 -11.159 -21.376 -29.940 1.00 0.00 O ATOM 847 CB LEU A 79 -10.823 -19.542 -27.520 1.00 0.00 C ATOM 848 CG LEU A 79 -9.884 -18.703 -26.606 1.00 0.00 C ATOM 849 CD1 LEU A 79 -10.137 -17.192 -26.767 1.00 0.00 C ATOM 850 CD2 LEU A 79 -10.022 -19.147 -25.145 1.00 0.00 C ATOM 0 H LEU A 79 -8.856 -20.619 -28.991 1.00 0.00 H new ATOM 0 HA LEU A 79 -10.573 -21.569 -26.745 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -10.849 -19.081 -28.507 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -11.835 -19.491 -27.118 1.00 0.00 H new ATOM 0 HG LEU A 79 -8.856 -18.885 -26.919 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -9.463 -16.639 -26.113 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -9.958 -16.901 -27.802 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -11.169 -16.965 -26.500 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -9.359 -18.550 -24.519 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -11.052 -19.007 -24.818 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -9.753 -20.200 -25.058 1.00 0.00 H new ATOM 862 N CYS A 80 -12.231 -22.580 -28.337 1.00 0.00 N ATOM 863 CA CYS A 80 -13.205 -23.197 -29.269 1.00 0.00 C ATOM 864 C CYS A 80 -14.141 -22.102 -29.768 1.00 0.00 C ATOM 865 O CYS A 80 -14.304 -21.105 -29.070 1.00 0.00 O ATOM 866 CB CYS A 80 -13.990 -24.337 -28.580 1.00 0.00 C ATOM 867 SG CYS A 80 -15.212 -23.793 -27.348 1.00 0.00 S ATOM 0 H CYS A 80 -12.319 -22.895 -27.371 1.00 0.00 H new ATOM 0 HA CYS A 80 -12.680 -23.645 -30.113 1.00 0.00 H new ATOM 0 HB2 CYS A 80 -14.503 -24.919 -29.346 1.00 0.00 H new ATOM 0 HB3 CYS A 80 -13.279 -25.005 -28.094 1.00 0.00 H new ATOM 872 N ILE A 81 -14.782 -22.308 -30.935 1.00 0.00 N ATOM 873 CA ILE A 81 -15.514 -21.240 -31.680 1.00 0.00 C ATOM 874 C ILE A 81 -16.548 -20.479 -30.788 1.00 0.00 C ATOM 875 O ILE A 81 -16.819 -19.292 -31.003 1.00 0.00 O ATOM 876 CB ILE A 81 -16.195 -21.841 -32.981 1.00 0.00 C ATOM 877 CG1 ILE A 81 -16.981 -20.742 -33.781 1.00 0.00 C ATOM 878 CG2 ILE A 81 -17.084 -23.071 -32.645 1.00 0.00 C ATOM 879 CD1 ILE A 81 -17.619 -21.221 -35.075 1.00 0.00 C ATOM 0 H ILE A 81 -14.813 -23.217 -31.396 1.00 0.00 H new ATOM 0 HA ILE A 81 -14.778 -20.496 -31.986 1.00 0.00 H new ATOM 0 HB ILE A 81 -15.398 -22.197 -33.634 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -17.761 -20.335 -33.138 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -16.298 -19.924 -34.011 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -17.534 -23.456 -33.560 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -16.472 -23.848 -32.187 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -17.871 -22.773 -31.952 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -18.138 -20.391 -35.554 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -16.846 -21.600 -35.743 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -18.331 -22.017 -34.857 1.00 0.00 H new ATOM 891 N HIS A 82 -17.019 -21.163 -29.734 1.00 0.00 N ATOM 892 CA HIS A 82 -17.994 -20.628 -28.760 1.00 0.00 C ATOM 893 C HIS A 82 -17.304 -19.698 -27.728 1.00 0.00 C ATOM 894 O HIS A 82 -17.804 -18.607 -27.446 1.00 0.00 O ATOM 895 CB HIS A 82 -18.723 -21.807 -28.058 1.00 0.00 C ATOM 896 CG HIS A 82 -19.284 -22.811 -29.035 1.00 0.00 C ATOM 897 ND1 HIS A 82 -20.550 -22.735 -29.560 1.00 0.00 N ATOM 898 CD2 HIS A 82 -18.707 -23.887 -29.614 1.00 0.00 C ATOM 899 CE1 HIS A 82 -20.718 -23.709 -30.435 1.00 0.00 C ATOM 900 NE2 HIS A 82 -19.618 -24.425 -30.477 1.00 0.00 N ATOM 0 H HIS A 82 -16.731 -22.119 -29.528 1.00 0.00 H new ATOM 0 HA HIS A 82 -18.730 -20.024 -29.291 1.00 0.00 H new ATOM 0 HB2 HIS A 82 -18.028 -22.310 -27.386 1.00 0.00 H new ATOM 0 HB3 HIS A 82 -19.532 -21.414 -27.443 1.00 0.00 H new ATOM 0 HD2 HIS A 82 -17.708 -24.254 -29.428 1.00 0.00 H new ATOM 0 HE1 HIS A 82 -21.610 -23.887 -31.018 1.00 0.00 H new ATOM 0 HE2 HIS A 82 -19.469 -25.249 -31.059 1.00 0.00 H new ATOM 909 N CYS A 83 -16.142 -20.122 -27.166 1.00 0.00 N ATOM 910 CA CYS A 83 -15.368 -19.286 -26.213 1.00 0.00 C ATOM 911 C CYS A 83 -14.522 -18.228 -26.950 1.00 0.00 C ATOM 912 O CYS A 83 -14.022 -17.296 -26.325 1.00 0.00 O ATOM 913 CB CYS A 83 -14.425 -20.121 -25.326 1.00 0.00 C ATOM 914 SG CYS A 83 -15.196 -21.457 -24.370 1.00 0.00 S ATOM 0 H CYS A 83 -15.723 -21.033 -27.355 1.00 0.00 H new ATOM 0 HA CYS A 83 -16.111 -18.799 -25.581 1.00 0.00 H new ATOM 0 HB2 CYS A 83 -13.653 -20.556 -25.961 1.00 0.00 H new ATOM 0 HB3 CYS A 83 -13.924 -19.448 -24.631 1.00 0.00 H new ATOM 919 N GLN A 84 -14.303 -18.414 -28.265 1.00 0.00 N ATOM 920 CA GLN A 84 -13.495 -17.481 -29.062 1.00 0.00 C ATOM 921 C GLN A 84 -14.330 -16.232 -29.365 1.00 0.00 C ATOM 922 O GLN A 84 -13.865 -15.115 -29.147 1.00 0.00 O ATOM 923 CB GLN A 84 -12.987 -18.168 -30.376 1.00 0.00 C ATOM 924 CG GLN A 84 -11.638 -17.638 -30.949 1.00 0.00 C ATOM 925 CD GLN A 84 -11.589 -16.117 -31.154 1.00 0.00 C ATOM 926 OE1 GLN A 84 -11.985 -15.607 -32.197 1.00 0.00 O ATOM 927 NE2 GLN A 84 -11.080 -15.388 -30.165 1.00 0.00 N ATOM 0 H GLN A 84 -14.675 -19.202 -28.795 1.00 0.00 H new ATOM 0 HA GLN A 84 -12.612 -17.185 -28.496 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -12.883 -19.236 -30.187 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -13.754 -18.053 -31.142 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -10.832 -17.927 -30.274 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -11.446 -18.127 -31.904 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -10.759 -15.842 -29.310 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -11.010 -14.375 -30.262 1.00 0.00 H new ATOM 936 N GLN A 85 -15.574 -16.446 -29.840 1.00 0.00 N ATOM 937 CA GLN A 85 -16.469 -15.356 -30.259 1.00 0.00 C ATOM 938 C GLN A 85 -16.772 -14.374 -29.096 1.00 0.00 C ATOM 939 O GLN A 85 -16.881 -13.169 -29.334 1.00 0.00 O ATOM 940 CB GLN A 85 -17.782 -15.912 -30.873 1.00 0.00 C ATOM 941 CG GLN A 85 -18.615 -16.795 -29.931 1.00 0.00 C ATOM 942 CD GLN A 85 -19.895 -17.318 -30.575 1.00 0.00 C ATOM 943 OE1 GLN A 85 -20.962 -16.709 -30.462 1.00 0.00 O ATOM 944 NE2 GLN A 85 -19.784 -18.418 -31.303 1.00 0.00 N ATOM 0 H GLN A 85 -15.982 -17.375 -29.942 1.00 0.00 H new ATOM 0 HA GLN A 85 -15.946 -14.792 -31.031 1.00 0.00 H new ATOM 0 HB2 GLN A 85 -18.397 -15.073 -31.199 1.00 0.00 H new ATOM 0 HB3 GLN A 85 -17.533 -16.490 -31.763 1.00 0.00 H new ATOM 0 HG2 GLN A 85 -18.009 -17.640 -29.604 1.00 0.00 H new ATOM 0 HG3 GLN A 85 -18.872 -16.223 -29.039 1.00 0.00 H new ATOM 0 HE21 GLN A 85 -18.885 -18.895 -31.373 1.00 0.00 H new ATOM 0 HE22 GLN A 85 -20.598 -18.789 -31.794 1.00 0.00 H new ATOM 953 N GLU A 86 -16.860 -14.895 -27.841 1.00 0.00 N ATOM 954 CA GLU A 86 -17.104 -14.055 -26.638 1.00 0.00 C ATOM 955 C GLU A 86 -15.872 -13.160 -26.340 1.00 0.00 C ATOM 956 O GLU A 86 -16.032 -11.994 -25.975 1.00 0.00 O ATOM 957 CB GLU A 86 -17.478 -14.919 -25.389 1.00 0.00 C ATOM 958 CG GLU A 86 -16.344 -15.833 -24.887 1.00 0.00 C ATOM 959 CD GLU A 86 -16.648 -16.581 -23.583 1.00 0.00 C ATOM 960 OE1 GLU A 86 -17.424 -17.557 -23.613 1.00 0.00 O ATOM 961 OE2 GLU A 86 -16.102 -16.207 -22.519 1.00 0.00 O ATOM 0 H GLU A 86 -16.766 -15.890 -27.638 1.00 0.00 H new ATOM 0 HA GLU A 86 -17.958 -13.413 -26.854 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -17.778 -14.254 -24.579 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -18.343 -15.535 -25.634 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -16.115 -16.563 -25.663 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -15.448 -15.230 -24.743 1.00 0.00 H new ATOM 968 N LYS A 87 -14.649 -13.719 -26.524 1.00 0.00 N ATOM 969 CA LYS A 87 -13.381 -12.981 -26.365 1.00 0.00 C ATOM 970 C LYS A 87 -13.149 -12.020 -27.547 1.00 0.00 C ATOM 971 O LYS A 87 -12.446 -11.010 -27.417 1.00 0.00 O ATOM 972 CB LYS A 87 -12.201 -13.981 -26.229 1.00 0.00 C ATOM 973 CG LYS A 87 -12.241 -14.845 -24.943 1.00 0.00 C ATOM 974 CD LYS A 87 -12.183 -13.993 -23.658 1.00 0.00 C ATOM 975 CE LYS A 87 -12.074 -14.837 -22.373 1.00 0.00 C ATOM 976 NZ LYS A 87 -13.266 -15.700 -22.154 1.00 0.00 N ATOM 0 H LYS A 87 -14.520 -14.696 -26.787 1.00 0.00 H new ATOM 0 HA LYS A 87 -13.440 -12.381 -25.457 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -12.198 -14.641 -27.096 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -11.264 -13.424 -26.249 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -13.153 -15.442 -24.938 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -11.403 -15.542 -24.951 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -11.329 -13.319 -23.715 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -13.076 -13.371 -23.602 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -11.182 -15.462 -22.427 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -11.947 -14.174 -21.517 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -13.542 -15.663 -21.152 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -14.053 -15.361 -22.743 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -13.037 -16.681 -22.413 1.00 0.00 H new ATOM 990 N ASP A 88 -13.756 -12.346 -28.700 1.00 0.00 N ATOM 991 CA ASP A 88 -13.649 -11.536 -29.922 1.00 0.00 C ATOM 992 C ASP A 88 -14.571 -10.287 -29.830 1.00 0.00 C ATOM 993 O ASP A 88 -14.365 -9.302 -30.543 1.00 0.00 O ATOM 994 CB ASP A 88 -13.967 -12.401 -31.176 1.00 0.00 C ATOM 995 CG ASP A 88 -13.714 -11.658 -32.506 1.00 0.00 C ATOM 996 OD1 ASP A 88 -12.532 -11.435 -32.854 1.00 0.00 O ATOM 997 OD2 ASP A 88 -14.686 -11.296 -33.206 1.00 0.00 O ATOM 0 H ASP A 88 -14.334 -13.179 -28.810 1.00 0.00 H new ATOM 0 HA ASP A 88 -12.624 -11.178 -30.022 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -13.358 -13.305 -31.150 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -15.009 -12.718 -31.136 1.00 0.00 H new ATOM 1002 N LEU A 89 -15.568 -10.325 -28.914 1.00 0.00 N ATOM 1003 CA LEU A 89 -16.411 -9.139 -28.595 1.00 0.00 C ATOM 1004 C LEU A 89 -15.591 -8.084 -27.830 1.00 0.00 C ATOM 1005 O LEU A 89 -15.905 -6.895 -27.852 1.00 0.00 O ATOM 1006 CB LEU A 89 -17.650 -9.526 -27.733 1.00 0.00 C ATOM 1007 CG LEU A 89 -18.540 -10.680 -28.270 1.00 0.00 C ATOM 1008 CD1 LEU A 89 -19.787 -10.887 -27.380 1.00 0.00 C ATOM 1009 CD2 LEU A 89 -18.921 -10.471 -29.759 1.00 0.00 C ATOM 0 H LEU A 89 -15.811 -11.161 -28.382 1.00 0.00 H new ATOM 0 HA LEU A 89 -16.756 -8.731 -29.545 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -17.300 -9.801 -26.738 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -18.274 -8.640 -27.618 1.00 0.00 H new ATOM 0 HG LEU A 89 -17.950 -11.595 -28.223 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -20.390 -11.701 -27.782 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -19.473 -11.134 -26.366 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -20.378 -9.972 -27.364 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -19.543 -11.300 -30.095 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -19.472 -9.537 -29.866 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -18.015 -10.429 -30.364 1.00 0.00 H new ATOM 1021 N GLN A 90 -14.529 -8.558 -27.163 1.00 0.00 N ATOM 1022 CA GLN A 90 -13.717 -7.764 -26.224 1.00 0.00 C ATOM 1023 C GLN A 90 -12.552 -7.058 -26.948 1.00 0.00 C ATOM 1024 O GLN A 90 -11.787 -6.322 -26.313 1.00 0.00 O ATOM 1025 CB GLN A 90 -13.197 -8.705 -25.092 1.00 0.00 C ATOM 1026 CG GLN A 90 -14.265 -9.692 -24.566 1.00 0.00 C ATOM 1027 CD GLN A 90 -15.498 -9.015 -23.963 1.00 0.00 C ATOM 1028 OE1 GLN A 90 -15.411 -7.954 -23.352 1.00 0.00 O ATOM 1029 NE2 GLN A 90 -16.662 -9.603 -24.176 1.00 0.00 N ATOM 0 H GLN A 90 -14.203 -9.520 -27.261 1.00 0.00 H new ATOM 0 HA GLN A 90 -14.334 -6.979 -25.786 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -12.344 -9.271 -25.466 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -12.837 -8.097 -24.262 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -14.582 -10.338 -25.385 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -13.811 -10.334 -23.811 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -16.702 -10.485 -24.687 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -17.521 -9.175 -23.829 1.00 0.00 H new ATOM 1038 N LYS A 91 -12.430 -7.296 -28.277 1.00 0.00 N ATOM 1039 CA LYS A 91 -11.413 -6.649 -29.132 1.00 0.00 C ATOM 1040 C LYS A 91 -11.635 -5.118 -29.176 1.00 0.00 C ATOM 1041 O LYS A 91 -12.707 -4.674 -29.610 1.00 0.00 O ATOM 1042 CB LYS A 91 -11.469 -7.225 -30.577 1.00 0.00 C ATOM 1043 CG LYS A 91 -11.227 -8.746 -30.696 1.00 0.00 C ATOM 1044 CD LYS A 91 -9.813 -9.180 -30.261 1.00 0.00 C ATOM 1045 CE LYS A 91 -9.580 -10.685 -30.475 1.00 0.00 C ATOM 1046 NZ LYS A 91 -9.762 -11.075 -31.901 1.00 0.00 N ATOM 0 H LYS A 91 -13.035 -7.942 -28.783 1.00 0.00 H new ATOM 0 HA LYS A 91 -10.432 -6.854 -28.704 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -12.446 -6.996 -31.003 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -10.726 -6.708 -31.185 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -11.963 -9.272 -30.088 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -11.391 -9.052 -31.729 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -9.071 -8.615 -30.825 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -9.667 -8.937 -29.209 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -8.572 -10.946 -30.152 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -10.271 -11.252 -29.852 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -9.284 -11.982 -32.077 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -10.777 -11.173 -32.107 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -9.353 -10.343 -32.516 1.00 0.00 H new ATOM 1060 N PRO A 92 -10.645 -4.288 -28.718 1.00 0.00 N ATOM 1061 CA PRO A 92 -10.770 -2.814 -28.750 1.00 0.00 C ATOM 1062 C PRO A 92 -10.682 -2.244 -30.184 1.00 0.00 C ATOM 1063 O PRO A 92 -11.136 -1.124 -30.429 1.00 0.00 O ATOM 1064 CB PRO A 92 -9.586 -2.340 -27.861 1.00 0.00 C ATOM 1065 CG PRO A 92 -8.566 -3.427 -27.990 1.00 0.00 C ATOM 1066 CD PRO A 92 -9.350 -4.718 -28.109 1.00 0.00 C ATOM 0 HA PRO A 92 -11.739 -2.468 -28.391 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -9.192 -1.383 -28.202 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -9.896 -2.207 -26.824 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -7.936 -3.270 -28.866 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -7.906 -3.449 -27.123 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -8.833 -5.444 -28.737 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -9.500 -5.187 -27.137 1.00 0.00 H new ATOM 1074 N ALA A 93 -10.097 -3.052 -31.112 1.00 0.00 N ATOM 1075 CA ALA A 93 -9.802 -2.656 -32.517 1.00 0.00 C ATOM 1076 C ALA A 93 -8.726 -1.542 -32.585 1.00 0.00 C ATOM 1077 O ALA A 93 -8.584 -0.859 -33.604 1.00 0.00 O ATOM 1078 CB ALA A 93 -11.091 -2.278 -33.287 1.00 0.00 C ATOM 0 H ALA A 93 -9.814 -4.009 -30.901 1.00 0.00 H new ATOM 0 HA ALA A 93 -9.381 -3.527 -33.020 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -10.835 -1.995 -34.308 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -11.767 -3.133 -33.306 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -11.579 -1.440 -32.790 1.00 0.00 H new ATOM 1084 N TYR A 94 -7.963 -1.399 -31.485 1.00 0.00 N ATOM 1085 CA TYR A 94 -6.792 -0.506 -31.394 1.00 0.00 C ATOM 1086 C TYR A 94 -5.806 -1.064 -30.356 1.00 0.00 C ATOM 1087 O TYR A 94 -6.144 -1.987 -29.608 1.00 0.00 O ATOM 1088 CB TYR A 94 -7.204 0.960 -31.029 1.00 0.00 C ATOM 1089 CG TYR A 94 -7.885 1.145 -29.650 1.00 0.00 C ATOM 1090 CD1 TYR A 94 -7.132 1.299 -28.476 1.00 0.00 C ATOM 1091 CD2 TYR A 94 -9.274 1.176 -29.524 1.00 0.00 C ATOM 1092 CE1 TYR A 94 -7.736 1.457 -27.244 1.00 0.00 C ATOM 1093 CE2 TYR A 94 -9.882 1.335 -28.288 1.00 0.00 C ATOM 1094 CZ TYR A 94 -9.110 1.478 -27.153 1.00 0.00 C ATOM 1095 OH TYR A 94 -9.720 1.636 -25.921 1.00 0.00 O ATOM 0 H TYR A 94 -8.146 -1.909 -30.621 1.00 0.00 H new ATOM 0 HA TYR A 94 -6.313 -0.469 -32.372 1.00 0.00 H new ATOM 0 HB2 TYR A 94 -6.312 1.586 -31.060 1.00 0.00 H new ATOM 0 HB3 TYR A 94 -7.880 1.330 -31.800 1.00 0.00 H new ATOM 0 HD1 TYR A 94 -6.054 1.294 -28.537 1.00 0.00 H new ATOM 0 HD2 TYR A 94 -9.888 1.074 -30.407 1.00 0.00 H new ATOM 0 HE1 TYR A 94 -7.133 1.564 -26.355 1.00 0.00 H new ATOM 0 HE2 TYR A 94 -10.959 1.347 -28.214 1.00 0.00 H new ATOM 0 HH TYR A 94 -10.693 1.630 -26.035 1.00 0.00 H new ATOM 1105 N THR A 95 -4.600 -0.485 -30.300 1.00 0.00 N ATOM 1106 CA THR A 95 -3.567 -0.838 -29.302 1.00 0.00 C ATOM 1107 C THR A 95 -3.186 0.385 -28.435 1.00 0.00 C ATOM 1108 O THR A 95 -2.339 0.279 -27.540 1.00 0.00 O ATOM 1109 CB THR A 95 -2.306 -1.419 -30.023 1.00 0.00 C ATOM 1110 OG1 THR A 95 -1.956 -0.571 -31.132 1.00 0.00 O ATOM 1111 CG2 THR A 95 -2.538 -2.856 -30.526 1.00 0.00 C ATOM 0 H THR A 95 -4.306 0.247 -30.947 1.00 0.00 H new ATOM 0 HA THR A 95 -3.976 -1.599 -28.637 1.00 0.00 H new ATOM 0 HB THR A 95 -1.493 -1.450 -29.298 1.00 0.00 H new ATOM 0 HG1 THR A 95 -1.024 -0.283 -31.042 1.00 0.00 H new ATOM 0 HG21 THR A 95 -1.636 -3.219 -31.020 1.00 0.00 H new ATOM 0 HG22 THR A 95 -2.775 -3.503 -29.682 1.00 0.00 H new ATOM 0 HG23 THR A 95 -3.367 -2.864 -31.233 1.00 0.00 H new ATOM 1119 N GLY A 96 -3.837 1.535 -28.695 1.00 0.00 N ATOM 1120 CA GLY A 96 -3.587 2.781 -27.948 1.00 0.00 C ATOM 1121 C GLY A 96 -2.882 3.824 -28.799 1.00 0.00 C ATOM 1122 O GLY A 96 -2.910 5.019 -28.490 1.00 0.00 O ATOM 0 H GLY A 96 -4.546 1.626 -29.423 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -4.534 3.185 -27.590 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -2.982 2.561 -27.069 1.00 0.00 H new ATOM 1126 N TYR A 97 -2.246 3.358 -29.880 1.00 0.00 N ATOM 1127 CA TYR A 97 -1.490 4.205 -30.823 1.00 0.00 C ATOM 1128 C TYR A 97 -2.045 4.051 -32.253 1.00 0.00 C ATOM 1129 O TYR A 97 -2.884 3.176 -32.510 1.00 0.00 O ATOM 1130 CB TYR A 97 0.049 3.914 -30.753 1.00 0.00 C ATOM 1131 CG TYR A 97 0.426 2.492 -30.323 1.00 0.00 C ATOM 1132 CD1 TYR A 97 0.467 2.159 -28.972 1.00 0.00 C ATOM 1133 CD2 TYR A 97 0.737 1.503 -31.243 1.00 0.00 C ATOM 1134 CE1 TYR A 97 0.814 0.888 -28.553 1.00 0.00 C ATOM 1135 CE2 TYR A 97 1.089 0.230 -30.833 1.00 0.00 C ATOM 1136 CZ TYR A 97 1.122 -0.077 -29.488 1.00 0.00 C ATOM 1137 OH TYR A 97 1.480 -1.352 -29.078 1.00 0.00 O ATOM 0 H TYR A 97 -2.239 2.370 -30.132 1.00 0.00 H new ATOM 0 HA TYR A 97 -1.622 5.246 -30.528 1.00 0.00 H new ATOM 0 HB2 TYR A 97 0.484 4.107 -31.734 1.00 0.00 H new ATOM 0 HB3 TYR A 97 0.505 4.619 -30.058 1.00 0.00 H new ATOM 0 HD1 TYR A 97 0.222 2.910 -28.235 1.00 0.00 H new ATOM 0 HD2 TYR A 97 0.704 1.730 -32.298 1.00 0.00 H new ATOM 0 HE1 TYR A 97 0.844 0.653 -27.499 1.00 0.00 H new ATOM 0 HE2 TYR A 97 1.338 -0.524 -31.565 1.00 0.00 H new ATOM 0 HH TYR A 97 1.664 -1.909 -29.863 1.00 0.00 H new ATOM 1147 N ASN A 98 -1.539 4.894 -33.176 1.00 0.00 N ATOM 1148 CA ASN A 98 -2.063 5.025 -34.561 1.00 0.00 C ATOM 1149 C ASN A 98 -1.477 3.970 -35.538 1.00 0.00 C ATOM 1150 O ASN A 98 -1.670 4.076 -36.757 1.00 0.00 O ATOM 1151 CB ASN A 98 -1.811 6.480 -35.088 1.00 0.00 C ATOM 1152 CG ASN A 98 -0.345 6.954 -35.035 1.00 0.00 C ATOM 1153 OD1 ASN A 98 0.587 6.157 -35.056 1.00 0.00 O ATOM 1154 ND2 ASN A 98 -0.135 8.264 -34.991 1.00 0.00 N ATOM 0 H ASN A 98 -0.749 5.510 -32.985 1.00 0.00 H new ATOM 0 HA ASN A 98 -3.135 4.832 -34.520 1.00 0.00 H new ATOM 0 HB2 ASN A 98 -2.158 6.541 -36.119 1.00 0.00 H new ATOM 0 HB3 ASN A 98 -2.420 7.171 -34.505 1.00 0.00 H new ATOM 0 HD21 ASN A 98 0.818 8.627 -34.974 1.00 0.00 H new ATOM 0 HD22 ASN A 98 -0.927 8.907 -34.974 1.00 0.00 H new ATOM 1161 N ARG A 99 -0.776 2.956 -34.995 1.00 0.00 N ATOM 1162 CA ARG A 99 -0.179 1.868 -35.802 1.00 0.00 C ATOM 1163 C ARG A 99 -1.270 0.948 -36.383 1.00 0.00 C ATOM 1164 O ARG A 99 -1.796 0.072 -35.687 1.00 0.00 O ATOM 1165 CB ARG A 99 0.855 1.054 -34.966 1.00 0.00 C ATOM 1166 CG ARG A 99 2.179 1.798 -34.713 1.00 0.00 C ATOM 1167 CD ARG A 99 3.183 0.976 -33.878 1.00 0.00 C ATOM 1168 NE ARG A 99 3.452 -0.357 -34.456 1.00 0.00 N ATOM 1169 CZ ARG A 99 4.539 -1.104 -34.207 1.00 0.00 C ATOM 1170 NH1 ARG A 99 5.546 -0.622 -33.488 1.00 0.00 N ATOM 1171 NH2 ARG A 99 4.608 -2.328 -34.701 1.00 0.00 N ATOM 0 H ARG A 99 -0.607 2.866 -33.993 1.00 0.00 H new ATOM 0 HA ARG A 99 0.353 2.324 -36.637 1.00 0.00 H new ATOM 0 HB2 ARG A 99 0.407 0.794 -34.007 1.00 0.00 H new ATOM 0 HB3 ARG A 99 1.069 0.118 -35.483 1.00 0.00 H new ATOM 0 HG2 ARG A 99 2.634 2.054 -35.670 1.00 0.00 H new ATOM 0 HG3 ARG A 99 1.970 2.736 -34.199 1.00 0.00 H new ATOM 0 HD2 ARG A 99 4.120 1.528 -33.798 1.00 0.00 H new ATOM 0 HD3 ARG A 99 2.795 0.857 -32.866 1.00 0.00 H new ATOM 0 HE ARG A 99 2.756 -0.740 -35.095 1.00 0.00 H new ATOM 0 HH11 ARG A 99 5.499 0.327 -33.117 1.00 0.00 H new ATOM 0 HH12 ARG A 99 6.366 -1.201 -33.307 1.00 0.00 H new ATOM 0 HH21 ARG A 99 3.841 -2.695 -35.264 1.00 0.00 H new ATOM 0 HH22 ARG A 99 5.429 -2.906 -34.519 1.00 0.00 H new ATOM 1185 N ARG A 100 -1.626 1.204 -37.653 1.00 0.00 N ATOM 1186 CA ARG A 100 -2.535 0.352 -38.436 1.00 0.00 C ATOM 1187 C ARG A 100 -1.851 -0.023 -39.770 1.00 0.00 C ATOM 1188 O ARG A 100 -2.360 0.225 -40.874 1.00 0.00 O ATOM 1189 CB ARG A 100 -3.916 1.055 -38.636 1.00 0.00 C ATOM 1190 CG ARG A 100 -4.981 0.198 -39.369 1.00 0.00 C ATOM 1191 CD ARG A 100 -5.274 -1.137 -38.662 1.00 0.00 C ATOM 1192 NE ARG A 100 -6.059 -2.053 -39.513 1.00 0.00 N ATOM 1193 CZ ARG A 100 -7.001 -2.906 -39.083 1.00 0.00 C ATOM 1194 NH1 ARG A 100 -7.379 -2.920 -37.808 1.00 0.00 N ATOM 1195 NH2 ARG A 100 -7.577 -3.722 -39.946 1.00 0.00 N ATOM 0 H ARG A 100 -1.287 2.016 -38.169 1.00 0.00 H new ATOM 0 HA ARG A 100 -2.742 -0.572 -37.896 1.00 0.00 H new ATOM 0 HB2 ARG A 100 -4.308 1.340 -37.660 1.00 0.00 H new ATOM 0 HB3 ARG A 100 -3.761 1.976 -39.198 1.00 0.00 H new ATOM 0 HG2 ARG A 100 -5.905 0.770 -39.450 1.00 0.00 H new ATOM 0 HG3 ARG A 100 -4.640 -0.003 -40.385 1.00 0.00 H new ATOM 0 HD2 ARG A 100 -4.334 -1.615 -38.386 1.00 0.00 H new ATOM 0 HD3 ARG A 100 -5.818 -0.946 -37.737 1.00 0.00 H new ATOM 0 HE ARG A 100 -5.869 -2.036 -40.515 1.00 0.00 H new ATOM 0 HH11 ARG A 100 -6.951 -2.276 -37.142 1.00 0.00 H new ATOM 0 HH12 ARG A 100 -8.097 -3.574 -37.496 1.00 0.00 H new ATOM 0 HH21 ARG A 100 -7.305 -3.700 -40.929 1.00 0.00 H new ATOM 0 HH22 ARG A 100 -8.294 -4.375 -39.630 1.00 0.00 H new ATOM 1209 N GLY A 101 -0.640 -0.583 -39.642 1.00 0.00 N ATOM 1210 CA GLY A 101 0.054 -1.208 -40.769 1.00 0.00 C ATOM 1211 C GLY A 101 -0.352 -2.667 -40.932 1.00 0.00 C ATOM 1212 O GLY A 101 -0.248 -3.245 -42.023 1.00 0.00 O ATOM 0 H GLY A 101 -0.122 -0.614 -38.764 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -0.171 -0.662 -41.685 1.00 0.00 H new ATOM 0 HA3 GLY A 101 1.131 -1.143 -40.616 1.00 0.00 H new ATOM 1216 N SER A 102 -0.811 -3.258 -39.816 1.00 0.00 N ATOM 1217 CA SER A 102 -1.284 -4.640 -39.759 1.00 0.00 C ATOM 1218 C SER A 102 -2.703 -4.730 -40.347 1.00 0.00 C ATOM 1219 O SER A 102 -3.643 -4.130 -39.797 1.00 0.00 O ATOM 1220 CB SER A 102 -1.253 -5.140 -38.293 1.00 0.00 C ATOM 1221 OG SER A 102 -1.957 -4.263 -37.425 1.00 0.00 O ATOM 0 H SER A 102 -0.862 -2.777 -38.918 1.00 0.00 H new ATOM 0 HA SER A 102 -0.630 -5.278 -40.353 1.00 0.00 H new ATOM 0 HB2 SER A 102 -1.692 -6.136 -38.239 1.00 0.00 H new ATOM 0 HB3 SER A 102 -0.219 -5.229 -37.960 1.00 0.00 H new ATOM 0 HG SER A 102 -2.747 -3.911 -37.886 1.00 0.00 H new ATOM 1227 N LYS A 103 -2.812 -5.441 -41.482 1.00 0.00 N ATOM 1228 CA LYS A 103 -4.078 -5.734 -42.173 1.00 0.00 C ATOM 1229 C LYS A 103 -4.728 -4.433 -42.696 1.00 0.00 C ATOM 1230 O LYS A 103 -5.600 -3.853 -42.035 1.00 0.00 O ATOM 1231 CB LYS A 103 -5.065 -6.574 -41.262 1.00 0.00 C ATOM 1232 CG LYS A 103 -5.768 -7.757 -41.974 1.00 0.00 C ATOM 1233 CD LYS A 103 -4.763 -8.832 -42.447 1.00 0.00 C ATOM 1234 CE LYS A 103 -5.450 -10.037 -43.101 1.00 0.00 C ATOM 1235 NZ LYS A 103 -4.467 -11.048 -43.561 1.00 0.00 N ATOM 0 H LYS A 103 -2.001 -5.838 -41.956 1.00 0.00 H new ATOM 0 HA LYS A 103 -3.854 -6.359 -43.037 1.00 0.00 H new ATOM 0 HB2 LYS A 103 -4.507 -6.962 -40.410 1.00 0.00 H new ATOM 0 HB3 LYS A 103 -5.827 -5.904 -40.865 1.00 0.00 H new ATOM 0 HG2 LYS A 103 -6.490 -8.210 -41.295 1.00 0.00 H new ATOM 0 HG3 LYS A 103 -6.328 -7.383 -42.831 1.00 0.00 H new ATOM 0 HD2 LYS A 103 -4.067 -8.386 -43.158 1.00 0.00 H new ATOM 0 HD3 LYS A 103 -4.174 -9.173 -41.595 1.00 0.00 H new ATOM 0 HE2 LYS A 103 -6.136 -10.495 -42.389 1.00 0.00 H new ATOM 0 HE3 LYS A 103 -6.048 -9.699 -43.948 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 -4.969 -11.847 -43.997 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 -3.828 -10.618 -44.259 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 -3.914 -11.389 -42.749 1.00 0.00 H new ATOM 1249 N ASP A 104 -4.239 -3.947 -43.853 1.00 0.00 N ATOM 1250 CA ASP A 104 -4.818 -2.774 -44.543 1.00 0.00 C ATOM 1251 C ASP A 104 -6.190 -3.149 -45.116 1.00 0.00 C ATOM 1252 O ASP A 104 -6.306 -3.634 -46.244 1.00 0.00 O ATOM 1253 CB ASP A 104 -3.865 -2.222 -45.650 1.00 0.00 C ATOM 1254 CG ASP A 104 -2.657 -1.460 -45.070 1.00 0.00 C ATOM 1255 OD1 ASP A 104 -1.617 -2.090 -44.778 1.00 0.00 O ATOM 1256 OD2 ASP A 104 -2.741 -0.219 -44.909 1.00 0.00 O ATOM 0 H ASP A 104 -3.436 -4.352 -44.335 1.00 0.00 H new ATOM 0 HA ASP A 104 -4.944 -1.969 -43.819 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -3.507 -3.050 -46.262 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -4.426 -1.559 -46.308 1.00 0.00 H new ATOM 1261 N SER A 105 -7.209 -2.980 -44.268 1.00 0.00 N ATOM 1262 CA SER A 105 -8.616 -3.246 -44.581 1.00 0.00 C ATOM 1263 C SER A 105 -9.357 -1.892 -44.637 1.00 0.00 C ATOM 1264 O SER A 105 -10.452 -1.723 -44.080 1.00 0.00 O ATOM 1265 CB SER A 105 -9.199 -4.198 -43.496 1.00 0.00 C ATOM 1266 OG SER A 105 -10.541 -4.573 -43.776 1.00 0.00 O ATOM 0 H SER A 105 -7.073 -2.644 -43.315 1.00 0.00 H new ATOM 0 HA SER A 105 -8.733 -3.739 -45.546 1.00 0.00 H new ATOM 0 HB2 SER A 105 -8.580 -5.093 -43.429 1.00 0.00 H new ATOM 0 HB3 SER A 105 -9.156 -3.707 -42.524 1.00 0.00 H new ATOM 0 HG SER A 105 -11.087 -3.768 -43.898 1.00 0.00 H new ATOM 1272 N GLN A 106 -8.743 -0.942 -45.354 1.00 0.00 N ATOM 1273 CA GLN A 106 -9.251 0.426 -45.494 1.00 0.00 C ATOM 1274 C GLN A 106 -10.461 0.489 -46.442 1.00 0.00 C ATOM 1275 O GLN A 106 -10.719 -0.441 -47.221 1.00 0.00 O ATOM 1276 CB GLN A 106 -8.117 1.357 -46.012 1.00 0.00 C ATOM 1277 CG GLN A 106 -6.907 1.487 -45.056 1.00 0.00 C ATOM 1278 CD GLN A 106 -5.780 2.379 -45.593 1.00 0.00 C ATOM 1279 OE1 GLN A 106 -6.015 3.299 -46.377 1.00 0.00 O ATOM 1280 NE2 GLN A 106 -4.552 2.123 -45.158 1.00 0.00 N ATOM 0 H GLN A 106 -7.871 -1.105 -45.858 1.00 0.00 H new ATOM 0 HA GLN A 106 -9.583 0.764 -44.512 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -7.766 0.981 -46.973 1.00 0.00 H new ATOM 0 HB3 GLN A 106 -8.532 2.349 -46.190 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -7.252 1.889 -44.103 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -6.506 0.493 -44.857 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -4.391 1.353 -44.509 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -3.769 2.696 -45.473 1.00 0.00 H new ATOM 1289 N LEU A 107 -11.181 1.621 -46.360 1.00 0.00 N ATOM 1290 CA LEU A 107 -12.270 1.992 -47.289 1.00 0.00 C ATOM 1291 C LEU A 107 -11.791 2.022 -48.761 1.00 0.00 C ATOM 1292 O LEU A 107 -12.588 1.852 -49.689 1.00 0.00 O ATOM 1293 CB LEU A 107 -12.862 3.388 -46.897 1.00 0.00 C ATOM 1294 CG LEU A 107 -11.942 4.656 -47.113 1.00 0.00 C ATOM 1295 CD1 LEU A 107 -12.740 5.961 -46.951 1.00 0.00 C ATOM 1296 CD2 LEU A 107 -10.701 4.668 -46.180 1.00 0.00 C ATOM 0 H LEU A 107 -11.022 2.319 -45.633 1.00 0.00 H new ATOM 0 HA LEU A 107 -13.043 1.228 -47.205 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -13.779 3.537 -47.467 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -13.143 3.351 -45.844 1.00 0.00 H new ATOM 0 HG LEU A 107 -11.576 4.590 -48.138 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -12.079 6.813 -47.106 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -13.545 5.989 -47.685 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -13.162 6.007 -45.947 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -10.108 5.562 -46.375 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -11.028 4.668 -45.140 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -10.095 3.782 -46.370 1.00 0.00 H new ATOM 1308 N ARG A 108 -10.478 2.261 -48.935 1.00 0.00 N ATOM 1309 CA ARG A 108 -9.811 2.311 -50.242 1.00 0.00 C ATOM 1310 C ARG A 108 -9.399 0.880 -50.673 1.00 0.00 C ATOM 1311 O ARG A 108 -10.165 0.240 -51.416 1.00 0.00 O ATOM 1312 CB ARG A 108 -8.578 3.249 -50.154 1.00 0.00 C ATOM 1313 CG ARG A 108 -8.909 4.700 -49.764 1.00 0.00 C ATOM 1314 CD ARG A 108 -7.654 5.564 -49.573 1.00 0.00 C ATOM 1315 NE ARG A 108 -6.810 5.582 -50.780 1.00 0.00 N ATOM 1316 CZ ARG A 108 -5.584 6.111 -50.850 1.00 0.00 C ATOM 1317 NH1 ARG A 108 -5.039 6.701 -49.792 1.00 0.00 N ATOM 1318 NH2 ARG A 108 -4.908 6.039 -51.985 1.00 0.00 N ATOM 1319 OXT ARG A 108 -8.320 0.397 -50.253 1.00 0.00 O ATOM 0 H ARG A 108 -9.843 2.427 -48.155 1.00 0.00 H new ATOM 0 HA ARG A 108 -10.493 2.708 -50.994 1.00 0.00 H new ATOM 0 HB2 ARG A 108 -7.878 2.841 -49.425 1.00 0.00 H new ATOM 0 HB3 ARG A 108 -8.070 3.252 -51.118 1.00 0.00 H new ATOM 0 HG2 ARG A 108 -9.537 5.145 -50.536 1.00 0.00 H new ATOM 0 HG3 ARG A 108 -9.489 4.700 -48.841 1.00 0.00 H new ATOM 0 HD2 ARG A 108 -7.949 6.583 -49.322 1.00 0.00 H new ATOM 0 HD3 ARG A 108 -7.076 5.183 -48.731 1.00 0.00 H new ATOM 0 HE ARG A 108 -7.190 5.159 -51.627 1.00 0.00 H new ATOM 0 HH11 ARG A 108 -5.557 6.754 -48.915 1.00 0.00 H new ATOM 0 HH12 ARG A 108 -4.103 7.101 -49.857 1.00 0.00 H new ATOM 0 HH21 ARG A 108 -5.323 5.583 -52.798 1.00 0.00 H new ATOM 0 HH22 ARG A 108 -3.972 6.440 -52.048 1.00 0.00 H new TER 1333 ARG A 108 HETATM 1334 ZN ZN A 109 -14.495 -23.555 -25.105 1.00 0.00 ZN