USER MOD reduce.3.24.130724 H: found=0, std=0, add=810, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 805 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 86 THR OG1 : rot -115:sc= 0.986 USER MOD Set 1.2: A 91 GLN : amide:sc= 0.466 K(o=1.5,f=-2!) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 70:sc= 1.07 USER MOD Single : A 3 SER OG : rot 180:sc= -0.0676 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 32:sc= 0.0473 USER MOD Single : A 11 HIS : no HE2:sc= -1.33 K(o=-1.3,f=-3.3!) USER MOD Single : A 14 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 20 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 CYS SG : rot 180:sc= -0.0153 USER MOD Single : A 29 MET CE :methyl -179:sc= 0 (180deg=-0.000165) USER MOD Single : A 31 CYS SG : rot 15:sc= 0.0592 USER MOD Single : A 32 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0599) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 38 THR OG1 : rot 60:sc= 0.999 USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 44 GLN : amide:sc= -0.0262 K(o=-0.026,f=-1.1) USER MOD Single : A 48 LYS NZ :NH3+ 150:sc= -0.138 (180deg=-0.887) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 56 HIS : no HD1:sc= -1.93! K(o=-1.9!,f=-1.2) USER MOD Single : A 57 LYS NZ :NH3+ -160:sc= -0.0408 (180deg=-0.29) USER MOD Single : A 58 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 63 ASN : amide:sc= -1.66 K(o=-1.7,f=-5.4!) USER MOD Single : A 66 HIS : no HD1:sc= -1.64 K(o=-1.6,f=-3.7!) USER MOD Single : A 67 SER OG : rot -18:sc= 0.638 USER MOD Single : A 74 THR OG1 : rot -90:sc= -0.831 USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 81 TYR OH : rot 142:sc= 1.03 USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 CYS SG : rot 146:sc= -3.25! USER MOD Single : A 87 ASN : amide:sc= -6.92! C(o=-6.9!,f=-5!) USER MOD Single : A 92 ASN : amide:sc= -5! C(o=-5!,f=-11!) USER MOD Single : A 93 SER OG : rot 45:sc= 1.29 USER MOD Single : A 95 SER OG : rot 180:sc= 0 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -1.559 38.088 1.812 1.00 0.00 N ATOM 2 CA GLY A 1 -0.182 37.893 1.399 1.00 0.00 C ATOM 3 C GLY A 1 -0.040 36.819 0.339 1.00 0.00 C ATOM 4 O GLY A 1 -0.401 37.029 -0.819 1.00 0.00 O ATOM 0 H1 GLY A 1 -1.602 38.832 2.537 1.00 0.00 H new ATOM 0 H2 GLY A 1 -2.131 38.372 0.991 1.00 0.00 H new ATOM 0 H3 GLY A 1 -1.933 37.200 2.204 1.00 0.00 H new ATOM 0 HA2 GLY A 1 0.215 38.833 1.015 1.00 0.00 H new ATOM 0 HA3 GLY A 1 0.420 37.624 2.267 1.00 0.00 H new ATOM 8 N SER A 2 0.489 35.666 0.734 1.00 0.00 N ATOM 9 CA SER A 2 0.683 34.556 -0.193 1.00 0.00 C ATOM 10 C SER A 2 -0.638 34.152 -0.840 1.00 0.00 C ATOM 11 O SER A 2 -1.586 33.767 -0.155 1.00 0.00 O ATOM 12 CB SER A 2 1.295 33.358 0.534 1.00 0.00 C ATOM 13 OG SER A 2 0.335 32.713 1.353 1.00 0.00 O ATOM 0 H SER A 2 0.791 35.475 1.689 1.00 0.00 H new ATOM 0 HA SER A 2 1.366 34.884 -0.976 1.00 0.00 H new ATOM 0 HB2 SER A 2 1.691 32.650 -0.194 1.00 0.00 H new ATOM 0 HB3 SER A 2 2.135 33.690 1.145 1.00 0.00 H new ATOM 0 HG SER A 2 -0.321 32.254 0.788 1.00 0.00 H new ATOM 19 N SER A 3 -0.693 34.243 -2.165 1.00 0.00 N ATOM 20 CA SER A 3 -1.899 33.891 -2.906 1.00 0.00 C ATOM 21 C SER A 3 -2.574 32.667 -2.296 1.00 0.00 C ATOM 22 O SER A 3 -3.763 32.691 -1.984 1.00 0.00 O ATOM 23 CB SER A 3 -1.560 33.622 -4.374 1.00 0.00 C ATOM 24 OG SER A 3 -0.553 32.632 -4.492 1.00 0.00 O ATOM 0 H SER A 3 0.083 34.557 -2.747 1.00 0.00 H new ATOM 0 HA SER A 3 -2.590 34.732 -2.848 1.00 0.00 H new ATOM 0 HB2 SER A 3 -2.456 33.299 -4.904 1.00 0.00 H new ATOM 0 HB3 SER A 3 -1.225 34.545 -4.848 1.00 0.00 H new ATOM 0 HG SER A 3 -0.356 32.477 -5.439 1.00 0.00 H new ATOM 30 N GLY A 4 -1.803 31.596 -2.128 1.00 0.00 N ATOM 31 CA GLY A 4 -2.343 30.376 -1.556 1.00 0.00 C ATOM 32 C GLY A 4 -1.943 30.190 -0.105 1.00 0.00 C ATOM 33 O GLY A 4 -1.771 31.164 0.628 1.00 0.00 O ATOM 0 H GLY A 4 -0.815 31.552 -2.378 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -3.430 30.393 -1.631 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -1.997 29.521 -2.138 1.00 0.00 H new ATOM 37 N SER A 5 -1.797 28.936 0.311 1.00 0.00 N ATOM 38 CA SER A 5 -1.421 28.625 1.685 1.00 0.00 C ATOM 39 C SER A 5 -0.187 27.729 1.720 1.00 0.00 C ATOM 40 O SER A 5 0.165 27.099 0.723 1.00 0.00 O ATOM 41 CB SER A 5 -2.582 27.944 2.412 1.00 0.00 C ATOM 42 OG SER A 5 -3.582 28.883 2.768 1.00 0.00 O ATOM 0 H SER A 5 -1.933 28.119 -0.284 1.00 0.00 H new ATOM 0 HA SER A 5 -1.184 29.560 2.192 1.00 0.00 H new ATOM 0 HB2 SER A 5 -3.013 27.173 1.773 1.00 0.00 H new ATOM 0 HB3 SER A 5 -2.212 27.445 3.308 1.00 0.00 H new ATOM 0 HG SER A 5 -4.314 28.423 3.230 1.00 0.00 H new ATOM 48 N SER A 6 0.465 27.676 2.878 1.00 0.00 N ATOM 49 CA SER A 6 1.662 26.860 3.044 1.00 0.00 C ATOM 50 C SER A 6 1.442 25.455 2.491 1.00 0.00 C ATOM 51 O SER A 6 0.428 24.817 2.769 1.00 0.00 O ATOM 52 CB SER A 6 2.051 26.783 4.522 1.00 0.00 C ATOM 53 OG SER A 6 0.961 26.345 5.314 1.00 0.00 O ATOM 0 H SER A 6 0.184 28.188 3.714 1.00 0.00 H new ATOM 0 HA SER A 6 2.472 27.329 2.486 1.00 0.00 H new ATOM 0 HB2 SER A 6 2.892 26.100 4.645 1.00 0.00 H new ATOM 0 HB3 SER A 6 2.384 27.763 4.865 1.00 0.00 H new ATOM 0 HG SER A 6 0.404 25.730 4.793 1.00 0.00 H new ATOM 59 N GLY A 7 2.403 24.978 1.705 1.00 0.00 N ATOM 60 CA GLY A 7 2.297 23.653 1.124 1.00 0.00 C ATOM 61 C GLY A 7 3.624 23.144 0.595 1.00 0.00 C ATOM 62 O GLY A 7 4.340 23.863 -0.101 1.00 0.00 O ATOM 0 H GLY A 7 3.253 25.486 1.461 1.00 0.00 H new ATOM 0 HA2 GLY A 7 1.919 22.960 1.875 1.00 0.00 H new ATOM 0 HA3 GLY A 7 1.569 23.672 0.313 1.00 0.00 H new ATOM 66 N PHE A 8 3.953 21.900 0.928 1.00 0.00 N ATOM 67 CA PHE A 8 5.204 21.296 0.485 1.00 0.00 C ATOM 68 C PHE A 8 4.939 20.052 -0.358 1.00 0.00 C ATOM 69 O PHE A 8 3.925 19.376 -0.184 1.00 0.00 O ATOM 70 CB PHE A 8 6.075 20.933 1.689 1.00 0.00 C ATOM 71 CG PHE A 8 5.880 21.844 2.867 1.00 0.00 C ATOM 72 CD1 PHE A 8 4.736 21.758 3.645 1.00 0.00 C ATOM 73 CD2 PHE A 8 6.839 22.789 3.196 1.00 0.00 C ATOM 74 CE1 PHE A 8 4.553 22.595 4.729 1.00 0.00 C ATOM 75 CE2 PHE A 8 6.662 23.628 4.279 1.00 0.00 C ATOM 76 CZ PHE A 8 5.517 23.532 5.046 1.00 0.00 C ATOM 0 H PHE A 8 3.371 21.291 1.503 1.00 0.00 H new ATOM 0 HA PHE A 8 5.732 22.025 -0.130 1.00 0.00 H new ATOM 0 HB2 PHE A 8 5.854 19.909 1.991 1.00 0.00 H new ATOM 0 HB3 PHE A 8 7.123 20.958 1.390 1.00 0.00 H new ATOM 0 HD1 PHE A 8 3.979 21.028 3.401 1.00 0.00 H new ATOM 0 HD2 PHE A 8 7.735 22.870 2.599 1.00 0.00 H new ATOM 0 HE1 PHE A 8 3.657 22.517 5.328 1.00 0.00 H new ATOM 0 HE2 PHE A 8 7.418 24.358 4.526 1.00 0.00 H new ATOM 0 HZ PHE A 8 5.376 24.188 5.892 1.00 0.00 H new ATOM 86 N ARG A 9 5.857 19.757 -1.273 1.00 0.00 N ATOM 87 CA ARG A 9 5.722 18.597 -2.145 1.00 0.00 C ATOM 88 C ARG A 9 5.600 17.314 -1.327 1.00 0.00 C ATOM 89 O ARG A 9 6.130 17.200 -0.222 1.00 0.00 O ATOM 90 CB ARG A 9 6.921 18.500 -3.090 1.00 0.00 C ATOM 91 CG ARG A 9 6.727 19.247 -4.399 1.00 0.00 C ATOM 92 CD ARG A 9 8.051 19.746 -4.957 1.00 0.00 C ATOM 93 NE ARG A 9 7.882 20.940 -5.781 1.00 0.00 N ATOM 94 CZ ARG A 9 8.895 21.673 -6.229 1.00 0.00 C ATOM 95 NH1 ARG A 9 10.143 21.336 -5.934 1.00 0.00 N ATOM 96 NH2 ARG A 9 8.661 22.746 -6.973 1.00 0.00 N ATOM 0 H ARG A 9 6.702 20.306 -1.429 1.00 0.00 H new ATOM 0 HA ARG A 9 4.813 18.720 -2.734 1.00 0.00 H new ATOM 0 HB2 ARG A 9 7.804 18.893 -2.585 1.00 0.00 H new ATOM 0 HB3 ARG A 9 7.118 17.450 -3.306 1.00 0.00 H new ATOM 0 HG2 ARG A 9 6.249 18.591 -5.126 1.00 0.00 H new ATOM 0 HG3 ARG A 9 6.056 20.091 -4.241 1.00 0.00 H new ATOM 0 HD2 ARG A 9 8.731 19.967 -4.134 1.00 0.00 H new ATOM 0 HD3 ARG A 9 8.514 18.958 -5.551 1.00 0.00 H new ATOM 0 HE ARG A 9 6.934 21.227 -6.026 1.00 0.00 H new ATOM 0 HH11 ARG A 9 10.327 20.512 -5.362 1.00 0.00 H new ATOM 0 HH12 ARG A 9 10.919 21.901 -6.279 1.00 0.00 H new ATOM 0 HH21 ARG A 9 7.702 23.009 -7.202 1.00 0.00 H new ATOM 0 HH22 ARG A 9 9.440 23.308 -7.316 1.00 0.00 H new ATOM 110 N PRO A 10 4.884 16.325 -1.882 1.00 0.00 N ATOM 111 CA PRO A 10 4.675 15.033 -1.222 1.00 0.00 C ATOM 112 C PRO A 10 5.953 14.203 -1.154 1.00 0.00 C ATOM 113 O PRO A 10 6.476 13.767 -2.180 1.00 0.00 O ATOM 114 CB PRO A 10 3.636 14.344 -2.111 1.00 0.00 C ATOM 115 CG PRO A 10 3.813 14.967 -3.452 1.00 0.00 C ATOM 116 CD PRO A 10 4.224 16.391 -3.197 1.00 0.00 C ATOM 0 HA PRO A 10 4.358 15.151 -0.186 1.00 0.00 H new ATOM 0 HB2 PRO A 10 3.800 13.267 -2.150 1.00 0.00 H new ATOM 0 HB3 PRO A 10 2.626 14.499 -1.733 1.00 0.00 H new ATOM 0 HG2 PRO A 10 4.572 14.440 -4.030 1.00 0.00 H new ATOM 0 HG3 PRO A 10 2.888 14.925 -4.027 1.00 0.00 H new ATOM 0 HD2 PRO A 10 4.901 16.758 -3.968 1.00 0.00 H new ATOM 0 HD3 PRO A 10 3.364 17.061 -3.182 1.00 0.00 H new ATOM 124 N HIS A 11 6.450 13.987 0.059 1.00 0.00 N ATOM 125 CA HIS A 11 7.666 13.208 0.260 1.00 0.00 C ATOM 126 C HIS A 11 7.413 12.039 1.207 1.00 0.00 C ATOM 127 O HIS A 11 7.032 12.233 2.361 1.00 0.00 O ATOM 128 CB HIS A 11 8.780 14.096 0.815 1.00 0.00 C ATOM 129 CG HIS A 11 9.810 13.345 1.601 1.00 0.00 C ATOM 130 ND1 HIS A 11 10.838 12.639 1.014 1.00 0.00 N ATOM 131 CD2 HIS A 11 9.966 13.193 2.937 1.00 0.00 C ATOM 132 CE1 HIS A 11 11.582 12.084 1.954 1.00 0.00 C ATOM 133 NE2 HIS A 11 11.075 12.405 3.130 1.00 0.00 N ATOM 0 H HIS A 11 6.029 14.341 0.918 1.00 0.00 H new ATOM 0 HA HIS A 11 7.976 12.810 -0.706 1.00 0.00 H new ATOM 0 HB2 HIS A 11 9.270 14.610 -0.012 1.00 0.00 H new ATOM 0 HB3 HIS A 11 8.339 14.864 1.451 1.00 0.00 H new ATOM 0 HD1 HIS A 11 10.999 12.558 0.010 1.00 0.00 H new ATOM 0 HD2 HIS A 11 9.336 13.613 3.707 1.00 0.00 H new ATOM 0 HE1 HIS A 11 12.456 11.472 1.789 1.00 0.00 H new ATOM 141 N PHE A 12 7.626 10.825 0.710 1.00 0.00 N ATOM 142 CA PHE A 12 7.418 9.624 1.511 1.00 0.00 C ATOM 143 C PHE A 12 8.568 9.420 2.493 1.00 0.00 C ATOM 144 O PHE A 12 9.682 9.070 2.098 1.00 0.00 O ATOM 145 CB PHE A 12 7.282 8.398 0.605 1.00 0.00 C ATOM 146 CG PHE A 12 6.076 8.445 -0.289 1.00 0.00 C ATOM 147 CD1 PHE A 12 4.817 8.150 0.207 1.00 0.00 C ATOM 148 CD2 PHE A 12 6.203 8.784 -1.627 1.00 0.00 C ATOM 149 CE1 PHE A 12 3.705 8.192 -0.613 1.00 0.00 C ATOM 150 CE2 PHE A 12 5.095 8.828 -2.452 1.00 0.00 C ATOM 151 CZ PHE A 12 3.845 8.531 -1.945 1.00 0.00 C ATOM 0 H PHE A 12 7.942 10.647 -0.243 1.00 0.00 H new ATOM 0 HA PHE A 12 6.496 9.751 2.079 1.00 0.00 H new ATOM 0 HB2 PHE A 12 8.177 8.310 -0.010 1.00 0.00 H new ATOM 0 HB3 PHE A 12 7.231 7.502 1.224 1.00 0.00 H new ATOM 0 HD1 PHE A 12 4.703 7.884 1.247 1.00 0.00 H new ATOM 0 HD2 PHE A 12 7.178 9.016 -2.029 1.00 0.00 H new ATOM 0 HE1 PHE A 12 2.729 7.960 -0.213 1.00 0.00 H new ATOM 0 HE2 PHE A 12 5.207 9.094 -3.493 1.00 0.00 H new ATOM 0 HZ PHE A 12 2.978 8.564 -2.589 1.00 0.00 H new ATOM 161 N LEU A 13 8.292 9.642 3.773 1.00 0.00 N ATOM 162 CA LEU A 13 9.303 9.483 4.813 1.00 0.00 C ATOM 163 C LEU A 13 9.706 8.019 4.961 1.00 0.00 C ATOM 164 O LEU A 13 10.890 7.685 4.923 1.00 0.00 O ATOM 165 CB LEU A 13 8.779 10.017 6.147 1.00 0.00 C ATOM 166 CG LEU A 13 8.632 11.536 6.250 1.00 0.00 C ATOM 167 CD1 LEU A 13 7.827 11.911 7.485 1.00 0.00 C ATOM 168 CD2 LEU A 13 9.999 12.203 6.280 1.00 0.00 C ATOM 0 H LEU A 13 7.376 9.933 4.116 1.00 0.00 H new ATOM 0 HA LEU A 13 10.183 10.055 4.520 1.00 0.00 H new ATOM 0 HB2 LEU A 13 7.807 9.564 6.340 1.00 0.00 H new ATOM 0 HB3 LEU A 13 9.450 9.682 6.938 1.00 0.00 H new ATOM 0 HG LEU A 13 8.096 11.891 5.370 1.00 0.00 H new ATOM 0 HD11 LEU A 13 7.732 12.995 7.542 1.00 0.00 H new ATOM 0 HD12 LEU A 13 6.835 11.463 7.423 1.00 0.00 H new ATOM 0 HD13 LEU A 13 8.336 11.544 8.376 1.00 0.00 H new ATOM 0 HD21 LEU A 13 9.875 13.283 6.353 1.00 0.00 H new ATOM 0 HD22 LEU A 13 10.561 11.843 7.142 1.00 0.00 H new ATOM 0 HD23 LEU A 13 10.542 11.961 5.366 1.00 0.00 H new ATOM 180 N GLN A 14 8.713 7.151 5.128 1.00 0.00 N ATOM 181 CA GLN A 14 8.965 5.723 5.281 1.00 0.00 C ATOM 182 C GLN A 14 8.224 4.923 4.214 1.00 0.00 C ATOM 183 O GLN A 14 6.994 4.888 4.194 1.00 0.00 O ATOM 184 CB GLN A 14 8.541 5.255 6.674 1.00 0.00 C ATOM 185 CG GLN A 14 9.297 4.029 7.160 1.00 0.00 C ATOM 186 CD GLN A 14 8.778 3.511 8.487 1.00 0.00 C ATOM 187 OE1 GLN A 14 7.815 2.745 8.534 1.00 0.00 O ATOM 188 NE2 GLN A 14 9.415 3.928 9.575 1.00 0.00 N ATOM 0 H GLN A 14 7.727 7.412 5.161 1.00 0.00 H new ATOM 0 HA GLN A 14 10.035 5.553 5.159 1.00 0.00 H new ATOM 0 HB2 GLN A 14 8.691 6.069 7.383 1.00 0.00 H new ATOM 0 HB3 GLN A 14 7.474 5.033 6.665 1.00 0.00 H new ATOM 0 HG2 GLN A 14 9.221 3.240 6.412 1.00 0.00 H new ATOM 0 HG3 GLN A 14 10.354 4.274 7.259 1.00 0.00 H new ATOM 0 HE21 GLN A 14 10.209 4.563 9.489 1.00 0.00 H new ATOM 0 HE22 GLN A 14 9.111 3.613 10.496 1.00 0.00 H new ATOM 197 N ALA A 15 8.981 4.281 3.331 1.00 0.00 N ATOM 198 CA ALA A 15 8.396 3.480 2.263 1.00 0.00 C ATOM 199 C ALA A 15 8.740 2.004 2.432 1.00 0.00 C ATOM 200 O ALA A 15 9.825 1.644 2.889 1.00 0.00 O ATOM 201 CB ALA A 15 8.869 3.982 0.906 1.00 0.00 C ATOM 0 H ALA A 15 10.001 4.300 3.334 1.00 0.00 H new ATOM 0 HA ALA A 15 7.312 3.582 2.318 1.00 0.00 H new ATOM 0 HB1 ALA A 15 8.424 3.374 0.118 1.00 0.00 H new ATOM 0 HB2 ALA A 15 8.567 5.021 0.777 1.00 0.00 H new ATOM 0 HB3 ALA A 15 9.955 3.910 0.850 1.00 0.00 H new ATOM 207 N PRO A 16 7.796 1.128 2.056 1.00 0.00 N ATOM 208 CA PRO A 16 7.978 -0.323 2.158 1.00 0.00 C ATOM 209 C PRO A 16 9.003 -0.850 1.160 1.00 0.00 C ATOM 210 O PRO A 16 9.663 -0.077 0.466 1.00 0.00 O ATOM 211 CB PRO A 16 6.587 -0.877 1.839 1.00 0.00 C ATOM 212 CG PRO A 16 5.942 0.175 1.004 1.00 0.00 C ATOM 213 CD PRO A 16 6.480 1.488 1.503 1.00 0.00 C ATOM 0 HA PRO A 16 8.356 -0.619 3.136 1.00 0.00 H new ATOM 0 HB2 PRO A 16 6.651 -1.824 1.303 1.00 0.00 H new ATOM 0 HB3 PRO A 16 6.017 -1.064 2.749 1.00 0.00 H new ATOM 0 HG2 PRO A 16 6.176 0.033 -0.051 1.00 0.00 H new ATOM 0 HG3 PRO A 16 4.857 0.137 1.098 1.00 0.00 H new ATOM 0 HD2 PRO A 16 6.568 2.218 0.699 1.00 0.00 H new ATOM 0 HD3 PRO A 16 5.831 1.926 2.262 1.00 0.00 H new ATOM 221 N GLY A 17 9.130 -2.172 1.092 1.00 0.00 N ATOM 222 CA GLY A 17 10.077 -2.780 0.175 1.00 0.00 C ATOM 223 C GLY A 17 9.598 -4.119 -0.350 1.00 0.00 C ATOM 224 O GLY A 17 8.539 -4.207 -0.970 1.00 0.00 O ATOM 0 H GLY A 17 8.594 -2.832 1.655 1.00 0.00 H new ATOM 0 HA2 GLY A 17 10.250 -2.105 -0.663 1.00 0.00 H new ATOM 0 HA3 GLY A 17 11.034 -2.913 0.680 1.00 0.00 H new ATOM 228 N ASP A 18 10.381 -5.163 -0.102 1.00 0.00 N ATOM 229 CA ASP A 18 10.031 -6.505 -0.554 1.00 0.00 C ATOM 230 C ASP A 18 9.651 -7.394 0.626 1.00 0.00 C ATOM 231 O ASP A 18 10.514 -7.847 1.379 1.00 0.00 O ATOM 232 CB ASP A 18 11.198 -7.127 -1.323 1.00 0.00 C ATOM 233 CG ASP A 18 12.531 -6.898 -0.637 1.00 0.00 C ATOM 234 OD1 ASP A 18 13.075 -5.780 -0.757 1.00 0.00 O ATOM 235 OD2 ASP A 18 13.029 -7.836 0.019 1.00 0.00 O ATOM 0 H ASP A 18 11.262 -5.106 0.409 1.00 0.00 H new ATOM 0 HA ASP A 18 9.170 -6.426 -1.217 1.00 0.00 H new ATOM 0 HB2 ASP A 18 11.028 -8.198 -1.432 1.00 0.00 H new ATOM 0 HB3 ASP A 18 11.233 -6.706 -2.328 1.00 0.00 H new ATOM 240 N LEU A 19 8.355 -7.639 0.781 1.00 0.00 N ATOM 241 CA LEU A 19 7.859 -8.474 1.870 1.00 0.00 C ATOM 242 C LEU A 19 7.466 -9.857 1.361 1.00 0.00 C ATOM 243 O LEU A 19 7.389 -10.088 0.154 1.00 0.00 O ATOM 244 CB LEU A 19 6.660 -7.807 2.546 1.00 0.00 C ATOM 245 CG LEU A 19 6.960 -6.538 3.345 1.00 0.00 C ATOM 246 CD1 LEU A 19 5.743 -5.626 3.374 1.00 0.00 C ATOM 247 CD2 LEU A 19 7.400 -6.889 4.758 1.00 0.00 C ATOM 0 H LEU A 19 7.628 -7.272 0.167 1.00 0.00 H new ATOM 0 HA LEU A 19 8.661 -8.590 2.599 1.00 0.00 H new ATOM 0 HB2 LEU A 19 5.925 -7.564 1.779 1.00 0.00 H new ATOM 0 HB3 LEU A 19 6.196 -8.532 3.214 1.00 0.00 H new ATOM 0 HG LEU A 19 7.775 -6.006 2.854 1.00 0.00 H new ATOM 0 HD11 LEU A 19 5.975 -4.728 3.947 1.00 0.00 H new ATOM 0 HD12 LEU A 19 5.473 -5.347 2.355 1.00 0.00 H new ATOM 0 HD13 LEU A 19 4.908 -6.148 3.841 1.00 0.00 H new ATOM 0 HD21 LEU A 19 7.609 -5.974 5.312 1.00 0.00 H new ATOM 0 HD22 LEU A 19 6.606 -7.443 5.259 1.00 0.00 H new ATOM 0 HD23 LEU A 19 8.300 -7.502 4.717 1.00 0.00 H new ATOM 259 N THR A 20 7.217 -10.775 2.290 1.00 0.00 N ATOM 260 CA THR A 20 6.831 -12.135 1.936 1.00 0.00 C ATOM 261 C THR A 20 5.669 -12.618 2.796 1.00 0.00 C ATOM 262 O THR A 20 5.729 -12.566 4.025 1.00 0.00 O ATOM 263 CB THR A 20 8.011 -13.113 2.091 1.00 0.00 C ATOM 264 OG1 THR A 20 9.245 -12.437 1.825 1.00 0.00 O ATOM 265 CG2 THR A 20 7.861 -14.295 1.146 1.00 0.00 C ATOM 0 H THR A 20 7.276 -10.601 3.293 1.00 0.00 H new ATOM 0 HA THR A 20 6.522 -12.114 0.891 1.00 0.00 H new ATOM 0 HB THR A 20 8.014 -13.485 3.116 1.00 0.00 H new ATOM 0 HG1 THR A 20 9.991 -13.065 1.927 1.00 0.00 H new ATOM 0 HG21 THR A 20 8.706 -14.972 1.273 1.00 0.00 H new ATOM 0 HG22 THR A 20 6.935 -14.824 1.370 1.00 0.00 H new ATOM 0 HG23 THR A 20 7.835 -13.937 0.117 1.00 0.00 H new ATOM 273 N VAL A 21 4.611 -13.090 2.144 1.00 0.00 N ATOM 274 CA VAL A 21 3.435 -13.585 2.850 1.00 0.00 C ATOM 275 C VAL A 21 2.882 -14.840 2.184 1.00 0.00 C ATOM 276 O VAL A 21 2.655 -14.864 0.975 1.00 0.00 O ATOM 277 CB VAL A 21 2.326 -12.518 2.910 1.00 0.00 C ATOM 278 CG1 VAL A 21 1.152 -13.013 3.740 1.00 0.00 C ATOM 279 CG2 VAL A 21 2.872 -11.213 3.469 1.00 0.00 C ATOM 0 H VAL A 21 4.544 -13.140 1.127 1.00 0.00 H new ATOM 0 HA VAL A 21 3.753 -13.825 3.865 1.00 0.00 H new ATOM 0 HB VAL A 21 1.970 -12.332 1.897 1.00 0.00 H new ATOM 0 HG11 VAL A 21 0.379 -12.245 3.771 1.00 0.00 H new ATOM 0 HG12 VAL A 21 0.746 -13.920 3.291 1.00 0.00 H new ATOM 0 HG13 VAL A 21 1.489 -13.229 4.754 1.00 0.00 H new ATOM 0 HG21 VAL A 21 2.075 -10.470 3.504 1.00 0.00 H new ATOM 0 HG22 VAL A 21 3.256 -11.381 4.475 1.00 0.00 H new ATOM 0 HG23 VAL A 21 3.677 -10.851 2.829 1.00 0.00 H new ATOM 289 N GLN A 22 2.668 -15.881 2.982 1.00 0.00 N ATOM 290 CA GLN A 22 2.141 -17.140 2.470 1.00 0.00 C ATOM 291 C GLN A 22 0.661 -17.011 2.125 1.00 0.00 C ATOM 292 O GLN A 22 -0.140 -16.568 2.946 1.00 0.00 O ATOM 293 CB GLN A 22 2.342 -18.257 3.496 1.00 0.00 C ATOM 294 CG GLN A 22 2.362 -19.648 2.885 1.00 0.00 C ATOM 295 CD GLN A 22 2.162 -20.741 3.916 1.00 0.00 C ATOM 296 OE1 GLN A 22 3.126 -21.291 4.449 1.00 0.00 O ATOM 297 NE2 GLN A 22 0.906 -21.063 4.202 1.00 0.00 N ATOM 0 H GLN A 22 2.851 -15.877 3.985 1.00 0.00 H new ATOM 0 HA GLN A 22 2.687 -17.389 1.560 1.00 0.00 H new ATOM 0 HB2 GLN A 22 3.280 -18.088 4.025 1.00 0.00 H new ATOM 0 HB3 GLN A 22 1.544 -18.206 4.237 1.00 0.00 H new ATOM 0 HG2 GLN A 22 1.580 -19.720 2.129 1.00 0.00 H new ATOM 0 HG3 GLN A 22 3.313 -19.804 2.376 1.00 0.00 H new ATOM 0 HE21 GLN A 22 0.137 -20.581 3.736 1.00 0.00 H new ATOM 0 HE22 GLN A 22 0.710 -21.792 4.888 1.00 0.00 H new ATOM 306 N GLU A 23 0.307 -17.401 0.904 1.00 0.00 N ATOM 307 CA GLU A 23 -1.077 -17.327 0.451 1.00 0.00 C ATOM 308 C GLU A 23 -2.041 -17.629 1.595 1.00 0.00 C ATOM 309 O GLU A 23 -1.809 -18.536 2.393 1.00 0.00 O ATOM 310 CB GLU A 23 -1.312 -18.307 -0.701 1.00 0.00 C ATOM 311 CG GLU A 23 -2.656 -18.127 -1.387 1.00 0.00 C ATOM 312 CD GLU A 23 -3.073 -19.349 -2.182 1.00 0.00 C ATOM 313 OE1 GLU A 23 -2.179 -20.098 -2.631 1.00 0.00 O ATOM 314 OE2 GLU A 23 -4.291 -19.558 -2.357 1.00 0.00 O ATOM 0 H GLU A 23 0.959 -17.771 0.212 1.00 0.00 H new ATOM 0 HA GLU A 23 -1.264 -16.312 0.100 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -0.518 -18.186 -1.438 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -1.241 -19.326 -0.321 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -3.416 -17.909 -0.637 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -2.608 -17.265 -2.052 1.00 0.00 H new ATOM 321 N GLY A 24 -3.124 -16.861 1.667 1.00 0.00 N ATOM 322 CA GLY A 24 -4.106 -17.060 2.716 1.00 0.00 C ATOM 323 C GLY A 24 -3.655 -16.496 4.048 1.00 0.00 C ATOM 324 O GLY A 24 -4.073 -16.968 5.105 1.00 0.00 O ATOM 0 H GLY A 24 -3.338 -16.105 1.017 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -5.045 -16.589 2.425 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -4.305 -18.126 2.825 1.00 0.00 H new ATOM 328 N LYS A 25 -2.796 -15.482 3.999 1.00 0.00 N ATOM 329 CA LYS A 25 -2.286 -14.852 5.211 1.00 0.00 C ATOM 330 C LYS A 25 -2.595 -13.358 5.218 1.00 0.00 C ATOM 331 O LYS A 25 -3.099 -12.813 4.235 1.00 0.00 O ATOM 332 CB LYS A 25 -0.776 -15.072 5.328 1.00 0.00 C ATOM 333 CG LYS A 25 -0.395 -16.497 5.689 1.00 0.00 C ATOM 334 CD LYS A 25 -0.691 -16.801 7.148 1.00 0.00 C ATOM 335 CE LYS A 25 -0.966 -18.281 7.365 1.00 0.00 C ATOM 336 NZ LYS A 25 -1.092 -18.616 8.810 1.00 0.00 N ATOM 0 H LYS A 25 -2.439 -15.079 3.132 1.00 0.00 H new ATOM 0 HA LYS A 25 -2.781 -15.312 6.066 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -0.304 -14.807 4.382 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -0.376 -14.396 6.083 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -0.942 -17.193 5.053 1.00 0.00 H new ATOM 0 HG3 LYS A 25 0.666 -16.652 5.492 1.00 0.00 H new ATOM 0 HD2 LYS A 25 0.154 -16.493 7.764 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -1.552 -16.218 7.475 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -1.883 -18.560 6.846 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -0.160 -18.868 6.925 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -1.279 -19.634 8.915 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -0.208 -18.374 9.301 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -1.877 -18.075 9.225 1.00 0.00 H new ATOM 350 N LEU A 26 -2.290 -12.701 6.332 1.00 0.00 N ATOM 351 CA LEU A 26 -2.534 -11.269 6.467 1.00 0.00 C ATOM 352 C LEU A 26 -1.367 -10.463 5.905 1.00 0.00 C ATOM 353 O LEU A 26 -0.206 -10.744 6.203 1.00 0.00 O ATOM 354 CB LEU A 26 -2.760 -10.906 7.935 1.00 0.00 C ATOM 355 CG LEU A 26 -3.209 -9.471 8.211 1.00 0.00 C ATOM 356 CD1 LEU A 26 -2.016 -8.528 8.205 1.00 0.00 C ATOM 357 CD2 LEU A 26 -4.245 -9.031 7.186 1.00 0.00 C ATOM 0 H LEU A 26 -1.873 -13.137 7.155 1.00 0.00 H new ATOM 0 HA LEU A 26 -3.430 -11.023 5.897 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -3.508 -11.585 8.345 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -1.833 -11.086 8.480 1.00 0.00 H new ATOM 0 HG LEU A 26 -3.667 -9.437 9.199 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -2.355 -7.511 8.403 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -1.308 -8.831 8.977 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -1.528 -8.564 7.231 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -4.554 -8.007 7.397 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -3.812 -9.081 6.187 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -5.112 -9.690 7.239 1.00 0.00 H new ATOM 369 N CYS A 27 -1.684 -9.460 5.094 1.00 0.00 N ATOM 370 CA CYS A 27 -0.662 -8.611 4.492 1.00 0.00 C ATOM 371 C CYS A 27 -0.924 -7.141 4.802 1.00 0.00 C ATOM 372 O CYS A 27 -1.812 -6.522 4.215 1.00 0.00 O ATOM 373 CB CYS A 27 -0.618 -8.826 2.979 1.00 0.00 C ATOM 374 SG CYS A 27 0.205 -7.498 2.068 1.00 0.00 S ATOM 0 H CYS A 27 -2.640 -9.215 4.838 1.00 0.00 H new ATOM 0 HA CYS A 27 0.302 -8.887 4.919 1.00 0.00 H new ATOM 0 HB2 CYS A 27 -0.106 -9.766 2.771 1.00 0.00 H new ATOM 0 HB3 CYS A 27 -1.638 -8.929 2.608 1.00 0.00 H new ATOM 0 HG CYS A 27 0.193 -7.772 0.797 1.00 0.00 H new ATOM 380 N ARG A 28 -0.148 -6.589 5.728 1.00 0.00 N ATOM 381 CA ARG A 28 -0.298 -5.193 6.118 1.00 0.00 C ATOM 382 C ARG A 28 0.818 -4.339 5.524 1.00 0.00 C ATOM 383 O ARG A 28 1.954 -4.793 5.386 1.00 0.00 O ATOM 384 CB ARG A 28 -0.296 -5.063 7.643 1.00 0.00 C ATOM 385 CG ARG A 28 -0.349 -3.625 8.132 1.00 0.00 C ATOM 386 CD ARG A 28 -0.856 -3.543 9.564 1.00 0.00 C ATOM 387 NE ARG A 28 -0.568 -2.247 10.172 1.00 0.00 N ATOM 388 CZ ARG A 28 -0.590 -2.029 11.483 1.00 0.00 C ATOM 389 NH1 ARG A 28 -0.884 -3.016 12.317 1.00 0.00 N ATOM 390 NH2 ARG A 28 -0.316 -0.822 11.960 1.00 0.00 N ATOM 0 H ARG A 28 0.592 -7.088 6.223 1.00 0.00 H new ATOM 0 HA ARG A 28 -1.252 -4.835 5.731 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -1.150 -5.607 8.047 1.00 0.00 H new ATOM 0 HB3 ARG A 28 0.601 -5.539 8.039 1.00 0.00 H new ATOM 0 HG2 ARG A 28 0.645 -3.182 8.071 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -0.999 -3.041 7.480 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -1.932 -3.720 9.579 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -0.395 -4.333 10.158 1.00 0.00 H new ATOM 0 HE ARG A 28 -0.337 -1.466 9.557 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -1.094 -3.946 11.953 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -0.900 -2.846 13.323 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -0.088 -0.061 11.321 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -0.333 -0.655 12.966 1.00 0.00 H new ATOM 404 N MET A 29 0.486 -3.101 5.172 1.00 0.00 N ATOM 405 CA MET A 29 1.461 -2.184 4.593 1.00 0.00 C ATOM 406 C MET A 29 1.323 -0.790 5.198 1.00 0.00 C ATOM 407 O MET A 29 0.213 -0.283 5.364 1.00 0.00 O ATOM 408 CB MET A 29 1.287 -2.113 3.075 1.00 0.00 C ATOM 409 CG MET A 29 1.923 -3.279 2.335 1.00 0.00 C ATOM 410 SD MET A 29 2.350 -2.870 0.632 1.00 0.00 S ATOM 411 CE MET A 29 1.594 -4.238 -0.244 1.00 0.00 C ATOM 0 H MET A 29 -0.450 -2.710 5.278 1.00 0.00 H new ATOM 0 HA MET A 29 2.458 -2.562 4.820 1.00 0.00 H new ATOM 0 HB2 MET A 29 0.223 -2.082 2.841 1.00 0.00 H new ATOM 0 HB3 MET A 29 1.721 -1.182 2.711 1.00 0.00 H new ATOM 0 HG2 MET A 29 2.822 -3.594 2.865 1.00 0.00 H new ATOM 0 HG3 MET A 29 1.236 -4.126 2.340 1.00 0.00 H new ATOM 0 HE1 MET A 29 1.787 -4.137 -1.312 1.00 0.00 H new ATOM 0 HE2 MET A 29 2.016 -5.177 0.114 1.00 0.00 H new ATOM 0 HE3 MET A 29 0.518 -4.233 -0.068 1.00 0.00 H new ATOM 421 N ASP A 30 2.455 -0.178 5.525 1.00 0.00 N ATOM 422 CA ASP A 30 2.460 1.158 6.111 1.00 0.00 C ATOM 423 C ASP A 30 3.302 2.115 5.274 1.00 0.00 C ATOM 424 O ASP A 30 4.350 1.739 4.749 1.00 0.00 O ATOM 425 CB ASP A 30 2.995 1.108 7.543 1.00 0.00 C ATOM 426 CG ASP A 30 4.461 0.728 7.601 1.00 0.00 C ATOM 427 OD1 ASP A 30 4.907 -0.052 6.733 1.00 0.00 O ATOM 428 OD2 ASP A 30 5.164 1.212 8.513 1.00 0.00 O ATOM 0 H ASP A 30 3.381 -0.585 5.395 1.00 0.00 H new ATOM 0 HA ASP A 30 1.434 1.525 6.127 1.00 0.00 H new ATOM 0 HB2 ASP A 30 2.856 2.081 8.014 1.00 0.00 H new ATOM 0 HB3 ASP A 30 2.413 0.389 8.120 1.00 0.00 H new ATOM 433 N CYS A 31 2.836 3.354 5.154 1.00 0.00 N ATOM 434 CA CYS A 31 3.545 4.365 4.378 1.00 0.00 C ATOM 435 C CYS A 31 3.164 5.769 4.838 1.00 0.00 C ATOM 436 O CYS A 31 1.983 6.097 4.952 1.00 0.00 O ATOM 437 CB CYS A 31 3.240 4.203 2.888 1.00 0.00 C ATOM 438 SG CYS A 31 1.526 4.568 2.442 1.00 0.00 S ATOM 0 H CYS A 31 1.971 3.682 5.584 1.00 0.00 H new ATOM 0 HA CYS A 31 4.614 4.227 4.539 1.00 0.00 H new ATOM 0 HB2 CYS A 31 3.900 4.859 2.320 1.00 0.00 H new ATOM 0 HB3 CYS A 31 3.472 3.181 2.590 1.00 0.00 H new ATOM 0 HG CYS A 31 0.951 5.209 3.416 1.00 0.00 H new ATOM 444 N LYS A 32 4.172 6.593 5.102 1.00 0.00 N ATOM 445 CA LYS A 32 3.945 7.962 5.550 1.00 0.00 C ATOM 446 C LYS A 32 4.375 8.962 4.482 1.00 0.00 C ATOM 447 O LYS A 32 5.426 8.808 3.860 1.00 0.00 O ATOM 448 CB LYS A 32 4.706 8.228 6.850 1.00 0.00 C ATOM 449 CG LYS A 32 4.077 9.308 7.714 1.00 0.00 C ATOM 450 CD LYS A 32 5.082 9.898 8.689 1.00 0.00 C ATOM 451 CE LYS A 32 4.404 10.794 9.714 1.00 0.00 C ATOM 452 NZ LYS A 32 3.642 10.006 10.722 1.00 0.00 N ATOM 0 H LYS A 32 5.155 6.336 5.013 1.00 0.00 H new ATOM 0 HA LYS A 32 2.877 8.087 5.730 1.00 0.00 H new ATOM 0 HB2 LYS A 32 4.763 7.303 7.424 1.00 0.00 H new ATOM 0 HB3 LYS A 32 5.729 8.517 6.609 1.00 0.00 H new ATOM 0 HG2 LYS A 32 3.679 10.098 7.078 1.00 0.00 H new ATOM 0 HG3 LYS A 32 3.236 8.889 8.266 1.00 0.00 H new ATOM 0 HD2 LYS A 32 5.610 9.093 9.200 1.00 0.00 H new ATOM 0 HD3 LYS A 32 5.829 10.471 8.140 1.00 0.00 H new ATOM 0 HE2 LYS A 32 5.155 11.400 10.220 1.00 0.00 H new ATOM 0 HE3 LYS A 32 3.729 11.482 9.205 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 3.337 10.632 11.494 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 2.807 9.581 10.271 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 4.249 9.254 11.105 1.00 0.00 H new ATOM 466 N VAL A 33 3.557 9.990 4.276 1.00 0.00 N ATOM 467 CA VAL A 33 3.854 11.017 3.286 1.00 0.00 C ATOM 468 C VAL A 33 3.690 12.413 3.876 1.00 0.00 C ATOM 469 O VAL A 33 2.684 12.712 4.519 1.00 0.00 O ATOM 470 CB VAL A 33 2.946 10.885 2.049 1.00 0.00 C ATOM 471 CG1 VAL A 33 1.486 10.797 2.466 1.00 0.00 C ATOM 472 CG2 VAL A 33 3.168 12.051 1.098 1.00 0.00 C ATOM 0 H VAL A 33 2.683 10.133 4.782 1.00 0.00 H new ATOM 0 HA VAL A 33 4.891 10.873 2.983 1.00 0.00 H new ATOM 0 HB VAL A 33 3.206 9.965 1.525 1.00 0.00 H new ATOM 0 HG11 VAL A 33 0.859 10.704 1.579 1.00 0.00 H new ATOM 0 HG12 VAL A 33 1.342 9.926 3.105 1.00 0.00 H new ATOM 0 HG13 VAL A 33 1.209 11.698 3.013 1.00 0.00 H new ATOM 0 HG21 VAL A 33 2.518 11.941 0.230 1.00 0.00 H new ATOM 0 HG22 VAL A 33 2.937 12.986 1.608 1.00 0.00 H new ATOM 0 HG23 VAL A 33 4.208 12.063 0.773 1.00 0.00 H new ATOM 482 N SER A 34 4.686 13.265 3.652 1.00 0.00 N ATOM 483 CA SER A 34 4.654 14.630 4.165 1.00 0.00 C ATOM 484 C SER A 34 4.196 15.605 3.084 1.00 0.00 C ATOM 485 O SER A 34 4.598 15.500 1.926 1.00 0.00 O ATOM 486 CB SER A 34 6.035 15.036 4.682 1.00 0.00 C ATOM 487 OG SER A 34 5.990 16.300 5.320 1.00 0.00 O ATOM 0 H SER A 34 5.524 13.034 3.119 1.00 0.00 H new ATOM 0 HA SER A 34 3.941 14.666 4.989 1.00 0.00 H new ATOM 0 HB2 SER A 34 6.400 14.285 5.382 1.00 0.00 H new ATOM 0 HB3 SER A 34 6.742 15.069 3.853 1.00 0.00 H new ATOM 0 HG SER A 34 6.885 16.536 5.643 1.00 0.00 H new ATOM 493 N GLY A 35 3.351 16.555 3.473 1.00 0.00 N ATOM 494 CA GLY A 35 2.851 17.536 2.527 1.00 0.00 C ATOM 495 C GLY A 35 1.587 18.217 3.012 1.00 0.00 C ATOM 496 O GLY A 35 0.907 17.716 3.908 1.00 0.00 O ATOM 0 H GLY A 35 3.004 16.663 4.426 1.00 0.00 H new ATOM 0 HA2 GLY A 35 3.619 18.288 2.348 1.00 0.00 H new ATOM 0 HA3 GLY A 35 2.654 17.048 1.572 1.00 0.00 H new ATOM 500 N LEU A 36 1.270 19.364 2.420 1.00 0.00 N ATOM 501 CA LEU A 36 0.079 20.116 2.798 1.00 0.00 C ATOM 502 C LEU A 36 -0.577 20.748 1.574 1.00 0.00 C ATOM 503 O LEU A 36 0.056 20.959 0.539 1.00 0.00 O ATOM 504 CB LEU A 36 0.438 21.201 3.815 1.00 0.00 C ATOM 505 CG LEU A 36 0.516 20.753 5.275 1.00 0.00 C ATOM 506 CD1 LEU A 36 1.344 21.733 6.091 1.00 0.00 C ATOM 507 CD2 LEU A 36 -0.880 20.611 5.864 1.00 0.00 C ATOM 0 H LEU A 36 1.821 19.793 1.677 1.00 0.00 H new ATOM 0 HA LEU A 36 -0.630 19.423 3.251 1.00 0.00 H new ATOM 0 HB2 LEU A 36 1.401 21.629 3.535 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -0.300 22.000 3.740 1.00 0.00 H new ATOM 0 HG LEU A 36 1.005 19.779 5.311 1.00 0.00 H new ATOM 0 HD11 LEU A 36 1.388 21.397 7.127 1.00 0.00 H new ATOM 0 HD12 LEU A 36 2.353 21.784 5.683 1.00 0.00 H new ATOM 0 HD13 LEU A 36 0.885 22.721 6.049 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -0.806 20.292 6.903 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -1.395 21.571 5.815 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -1.441 19.869 5.296 1.00 0.00 H new ATOM 519 N PRO A 37 -1.876 21.060 1.693 1.00 0.00 N ATOM 520 CA PRO A 37 -2.640 20.813 2.920 1.00 0.00 C ATOM 521 C PRO A 37 -2.873 19.327 3.168 1.00 0.00 C ATOM 522 O PRO A 37 -3.138 18.909 4.296 1.00 0.00 O ATOM 523 CB PRO A 37 -3.969 21.527 2.659 1.00 0.00 C ATOM 524 CG PRO A 37 -4.099 21.556 1.176 1.00 0.00 C ATOM 525 CD PRO A 37 -2.699 21.677 0.640 1.00 0.00 C ATOM 0 HA PRO A 37 -2.115 21.170 3.806 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -4.801 20.994 3.119 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -3.966 22.534 3.076 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -4.581 20.650 0.809 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -4.714 22.397 0.854 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -2.587 21.159 -0.313 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -2.422 22.718 0.471 1.00 0.00 H new ATOM 533 N THR A 38 -2.772 18.531 2.108 1.00 0.00 N ATOM 534 CA THR A 38 -2.972 17.091 2.211 1.00 0.00 C ATOM 535 C THR A 38 -2.692 16.400 0.881 1.00 0.00 C ATOM 536 O THR A 38 -3.486 16.464 -0.058 1.00 0.00 O ATOM 537 CB THR A 38 -4.407 16.754 2.659 1.00 0.00 C ATOM 538 OG1 THR A 38 -4.525 16.904 4.078 1.00 0.00 O ATOM 539 CG2 THR A 38 -4.779 15.334 2.261 1.00 0.00 C ATOM 0 H THR A 38 -2.553 18.860 1.168 1.00 0.00 H new ATOM 0 HA THR A 38 -2.270 16.727 2.961 1.00 0.00 H new ATOM 0 HB THR A 38 -5.090 17.444 2.163 1.00 0.00 H new ATOM 0 HG1 THR A 38 -4.316 17.828 4.328 1.00 0.00 H new ATOM 0 HG21 THR A 38 -5.796 15.119 2.588 1.00 0.00 H new ATOM 0 HG22 THR A 38 -4.717 15.232 1.178 1.00 0.00 H new ATOM 0 HG23 THR A 38 -4.091 14.632 2.732 1.00 0.00 H new ATOM 547 N PRO A 39 -1.538 15.723 0.797 1.00 0.00 N ATOM 548 CA PRO A 39 -1.127 15.006 -0.414 1.00 0.00 C ATOM 549 C PRO A 39 -1.983 13.772 -0.675 1.00 0.00 C ATOM 550 O PRO A 39 -1.978 12.823 0.110 1.00 0.00 O ATOM 551 CB PRO A 39 0.318 14.600 -0.113 1.00 0.00 C ATOM 552 CG PRO A 39 0.394 14.543 1.374 1.00 0.00 C ATOM 553 CD PRO A 39 -0.544 15.605 1.878 1.00 0.00 C ATOM 0 HA PRO A 39 -1.234 15.621 -1.308 1.00 0.00 H new ATOM 0 HB2 PRO A 39 0.559 13.635 -0.559 1.00 0.00 H new ATOM 0 HB3 PRO A 39 1.025 15.324 -0.518 1.00 0.00 H new ATOM 0 HG2 PRO A 39 0.103 13.559 1.742 1.00 0.00 H new ATOM 0 HG3 PRO A 39 1.411 14.725 1.720 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -1.008 15.317 2.821 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -0.026 16.548 2.053 1.00 0.00 H new ATOM 561 N ASP A 40 -2.717 13.790 -1.782 1.00 0.00 N ATOM 562 CA ASP A 40 -3.578 12.671 -2.147 1.00 0.00 C ATOM 563 C ASP A 40 -2.806 11.633 -2.955 1.00 0.00 C ATOM 564 O ASP A 40 -2.190 11.954 -3.972 1.00 0.00 O ATOM 565 CB ASP A 40 -4.782 13.167 -2.949 1.00 0.00 C ATOM 566 CG ASP A 40 -5.947 12.197 -2.905 1.00 0.00 C ATOM 567 OD1 ASP A 40 -5.774 11.041 -3.345 1.00 0.00 O ATOM 568 OD2 ASP A 40 -7.030 12.594 -2.428 1.00 0.00 O ATOM 0 H ASP A 40 -2.733 14.567 -2.442 1.00 0.00 H new ATOM 0 HA ASP A 40 -3.931 12.202 -1.229 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -5.102 14.133 -2.558 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -4.484 13.326 -3.985 1.00 0.00 H new ATOM 573 N LEU A 41 -2.842 10.387 -2.495 1.00 0.00 N ATOM 574 CA LEU A 41 -2.144 9.300 -3.174 1.00 0.00 C ATOM 575 C LEU A 41 -3.121 8.211 -3.604 1.00 0.00 C ATOM 576 O LEU A 41 -4.136 7.978 -2.947 1.00 0.00 O ATOM 577 CB LEU A 41 -1.071 8.707 -2.260 1.00 0.00 C ATOM 578 CG LEU A 41 -1.557 8.178 -0.910 1.00 0.00 C ATOM 579 CD1 LEU A 41 -0.681 7.026 -0.442 1.00 0.00 C ATOM 580 CD2 LEU A 41 -1.573 9.293 0.125 1.00 0.00 C ATOM 0 H LEU A 41 -3.347 10.104 -1.655 1.00 0.00 H new ATOM 0 HA LEU A 41 -1.668 9.708 -4.066 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -0.579 7.892 -2.791 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -0.315 9.471 -2.078 1.00 0.00 H new ATOM 0 HG LEU A 41 -2.575 7.808 -1.031 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -1.042 6.662 0.520 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -0.720 6.219 -1.173 1.00 0.00 H new ATOM 0 HD13 LEU A 41 0.348 7.371 -0.337 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -1.921 8.898 1.079 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -0.566 9.694 0.244 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -2.243 10.087 -0.206 1.00 0.00 H new ATOM 592 N SER A 42 -2.807 7.544 -4.710 1.00 0.00 N ATOM 593 CA SER A 42 -3.658 6.480 -5.229 1.00 0.00 C ATOM 594 C SER A 42 -2.856 5.200 -5.446 1.00 0.00 C ATOM 595 O SER A 42 -1.723 5.239 -5.924 1.00 0.00 O ATOM 596 CB SER A 42 -4.311 6.914 -6.543 1.00 0.00 C ATOM 597 OG SER A 42 -5.376 6.048 -6.894 1.00 0.00 O ATOM 0 H SER A 42 -1.969 7.722 -5.264 1.00 0.00 H new ATOM 0 HA SER A 42 -4.437 6.281 -4.493 1.00 0.00 H new ATOM 0 HB2 SER A 42 -4.684 7.934 -6.448 1.00 0.00 H new ATOM 0 HB3 SER A 42 -3.566 6.920 -7.338 1.00 0.00 H new ATOM 0 HG SER A 42 -5.778 6.348 -7.736 1.00 0.00 H new ATOM 603 N TRP A 43 -3.453 4.068 -5.090 1.00 0.00 N ATOM 604 CA TRP A 43 -2.795 2.776 -5.245 1.00 0.00 C ATOM 605 C TRP A 43 -2.958 2.249 -6.666 1.00 0.00 C ATOM 606 O TRP A 43 -4.002 2.437 -7.290 1.00 0.00 O ATOM 607 CB TRP A 43 -3.364 1.768 -4.245 1.00 0.00 C ATOM 608 CG TRP A 43 -3.009 2.077 -2.822 1.00 0.00 C ATOM 609 CD1 TRP A 43 -3.679 2.911 -1.973 1.00 0.00 C ATOM 610 CD2 TRP A 43 -1.898 1.557 -2.084 1.00 0.00 C ATOM 611 NE1 TRP A 43 -3.051 2.941 -0.751 1.00 0.00 N ATOM 612 CE2 TRP A 43 -1.957 2.118 -0.793 1.00 0.00 C ATOM 613 CE3 TRP A 43 -0.861 0.671 -2.386 1.00 0.00 C ATOM 614 CZ2 TRP A 43 -1.017 1.822 0.191 1.00 0.00 C ATOM 615 CZ3 TRP A 43 0.071 0.377 -1.409 1.00 0.00 C ATOM 616 CH2 TRP A 43 -0.012 0.951 -0.133 1.00 0.00 C ATOM 0 H TRP A 43 -4.391 4.019 -4.692 1.00 0.00 H new ATOM 0 HA TRP A 43 -1.732 2.912 -5.048 1.00 0.00 H new ATOM 0 HB2 TRP A 43 -4.449 1.742 -4.344 1.00 0.00 H new ATOM 0 HB3 TRP A 43 -2.998 0.772 -4.495 1.00 0.00 H new ATOM 0 HD1 TRP A 43 -4.571 3.465 -2.225 1.00 0.00 H new ATOM 0 HE1 TRP A 43 -3.351 3.488 0.056 1.00 0.00 H new ATOM 0 HE3 TRP A 43 -0.789 0.223 -3.366 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 -1.079 2.264 1.175 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 0.877 -0.306 -1.632 1.00 0.00 H new ATOM 0 HH2 TRP A 43 0.732 0.701 0.609 1.00 0.00 H new ATOM 627 N GLN A 44 -1.921 1.589 -7.171 1.00 0.00 N ATOM 628 CA GLN A 44 -1.952 1.035 -8.519 1.00 0.00 C ATOM 629 C GLN A 44 -1.258 -0.322 -8.567 1.00 0.00 C ATOM 630 O GLN A 44 -0.106 -0.457 -8.151 1.00 0.00 O ATOM 631 CB GLN A 44 -1.284 1.997 -9.503 1.00 0.00 C ATOM 632 CG GLN A 44 -1.790 3.426 -9.396 1.00 0.00 C ATOM 633 CD GLN A 44 -1.601 4.211 -10.679 1.00 0.00 C ATOM 634 OE1 GLN A 44 -0.940 3.751 -11.610 1.00 0.00 O ATOM 635 NE2 GLN A 44 -2.183 5.404 -10.735 1.00 0.00 N ATOM 0 H GLN A 44 -1.049 1.425 -6.667 1.00 0.00 H new ATOM 0 HA GLN A 44 -2.995 0.899 -8.805 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -0.207 1.988 -9.333 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -1.449 1.637 -10.519 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -2.848 3.414 -9.135 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -1.267 3.932 -8.585 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -2.722 5.746 -9.940 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -2.091 5.978 -11.573 1.00 0.00 H new ATOM 644 N LEU A 45 -1.965 -1.325 -9.075 1.00 0.00 N ATOM 645 CA LEU A 45 -1.417 -2.673 -9.177 1.00 0.00 C ATOM 646 C LEU A 45 -1.288 -3.100 -10.635 1.00 0.00 C ATOM 647 O LEU A 45 -2.285 -3.220 -11.348 1.00 0.00 O ATOM 648 CB LEU A 45 -2.303 -3.664 -8.420 1.00 0.00 C ATOM 649 CG LEU A 45 -1.858 -5.126 -8.455 1.00 0.00 C ATOM 650 CD1 LEU A 45 -0.415 -5.255 -7.992 1.00 0.00 C ATOM 651 CD2 LEU A 45 -2.774 -5.984 -7.594 1.00 0.00 C ATOM 0 H LEU A 45 -2.919 -1.230 -9.423 1.00 0.00 H new ATOM 0 HA LEU A 45 -0.423 -2.669 -8.730 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -2.360 -3.347 -7.379 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -3.312 -3.603 -8.827 1.00 0.00 H new ATOM 0 HG LEU A 45 -1.922 -5.481 -9.484 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -0.115 -6.302 -8.023 1.00 0.00 H new ATOM 0 HD12 LEU A 45 0.231 -4.673 -8.649 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -0.326 -4.882 -6.972 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -2.442 -7.021 -7.631 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -2.742 -5.630 -6.564 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -3.795 -5.916 -7.970 1.00 0.00 H new ATOM 663 N ASP A 46 -0.055 -3.331 -11.072 1.00 0.00 N ATOM 664 CA ASP A 46 0.205 -3.748 -12.445 1.00 0.00 C ATOM 665 C ASP A 46 -0.330 -2.719 -13.436 1.00 0.00 C ATOM 666 O ASP A 46 -0.996 -3.068 -14.410 1.00 0.00 O ATOM 667 CB ASP A 46 -0.431 -5.113 -12.715 1.00 0.00 C ATOM 668 CG ASP A 46 -0.007 -6.159 -11.703 1.00 0.00 C ATOM 669 OD1 ASP A 46 1.152 -6.102 -11.242 1.00 0.00 O ATOM 670 OD2 ASP A 46 -0.834 -7.036 -11.373 1.00 0.00 O ATOM 0 H ASP A 46 0.781 -3.236 -10.495 1.00 0.00 H new ATOM 0 HA ASP A 46 1.284 -3.826 -12.577 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -1.516 -5.015 -12.699 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -0.156 -5.447 -13.716 1.00 0.00 H new ATOM 675 N GLY A 47 -0.035 -1.448 -13.179 1.00 0.00 N ATOM 676 CA GLY A 47 -0.495 -0.388 -14.057 1.00 0.00 C ATOM 677 C GLY A 47 -2.007 -0.298 -14.114 1.00 0.00 C ATOM 678 O GLY A 47 -2.583 -0.047 -15.174 1.00 0.00 O ATOM 0 H GLY A 47 0.514 -1.134 -12.379 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -0.090 0.564 -13.715 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -0.106 -0.558 -15.061 1.00 0.00 H new ATOM 682 N LYS A 48 -2.655 -0.505 -12.972 1.00 0.00 N ATOM 683 CA LYS A 48 -4.109 -0.447 -12.896 1.00 0.00 C ATOM 684 C LYS A 48 -4.562 0.083 -11.539 1.00 0.00 C ATOM 685 O LYS A 48 -3.955 -0.192 -10.504 1.00 0.00 O ATOM 686 CB LYS A 48 -4.710 -1.833 -13.139 1.00 0.00 C ATOM 687 CG LYS A 48 -4.566 -2.315 -14.572 1.00 0.00 C ATOM 688 CD LYS A 48 -5.661 -3.301 -14.942 1.00 0.00 C ATOM 689 CE LYS A 48 -5.524 -4.603 -14.167 1.00 0.00 C ATOM 690 NZ LYS A 48 -6.231 -4.546 -12.857 1.00 0.00 N ATOM 0 H LYS A 48 -2.195 -0.715 -12.086 1.00 0.00 H new ATOM 0 HA LYS A 48 -4.460 0.235 -13.670 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -4.230 -2.550 -12.473 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -5.768 -1.813 -12.876 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -4.600 -1.461 -15.249 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -3.592 -2.786 -14.702 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -6.636 -2.857 -14.740 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -5.620 -3.507 -16.012 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -5.926 -5.423 -14.761 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -4.468 -4.817 -14.001 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -6.559 -5.498 -12.598 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -5.580 -4.194 -12.126 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -7.048 -3.906 -12.931 1.00 0.00 H new ATOM 704 N PRO A 49 -5.654 0.861 -11.541 1.00 0.00 N ATOM 705 CA PRO A 49 -6.213 1.445 -10.317 1.00 0.00 C ATOM 706 C PRO A 49 -6.844 0.394 -9.410 1.00 0.00 C ATOM 707 O PRO A 49 -7.951 -0.078 -9.666 1.00 0.00 O ATOM 708 CB PRO A 49 -7.281 2.409 -10.840 1.00 0.00 C ATOM 709 CG PRO A 49 -7.671 1.860 -12.168 1.00 0.00 C ATOM 710 CD PRO A 49 -6.429 1.231 -12.737 1.00 0.00 C ATOM 0 HA PRO A 49 -5.447 1.925 -9.708 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -8.136 2.457 -10.165 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -6.889 3.422 -10.930 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -8.470 1.125 -12.067 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -8.044 2.648 -12.822 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -6.664 0.360 -13.349 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -5.881 1.927 -13.371 1.00 0.00 H new ATOM 718 N VAL A 50 -6.131 0.031 -8.348 1.00 0.00 N ATOM 719 CA VAL A 50 -6.621 -0.963 -7.401 1.00 0.00 C ATOM 720 C VAL A 50 -7.705 -0.378 -6.502 1.00 0.00 C ATOM 721 O VAL A 50 -7.524 0.684 -5.906 1.00 0.00 O ATOM 722 CB VAL A 50 -5.482 -1.512 -6.523 1.00 0.00 C ATOM 723 CG1 VAL A 50 -4.809 -0.385 -5.754 1.00 0.00 C ATOM 724 CG2 VAL A 50 -6.007 -2.577 -5.572 1.00 0.00 C ATOM 0 H VAL A 50 -5.212 0.411 -8.122 1.00 0.00 H new ATOM 0 HA VAL A 50 -7.042 -1.779 -7.988 1.00 0.00 H new ATOM 0 HB VAL A 50 -4.737 -1.972 -7.172 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -4.007 -0.793 -5.139 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -4.396 0.339 -6.457 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -5.542 0.107 -5.115 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -5.188 -2.954 -4.959 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -6.773 -2.144 -4.928 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -6.437 -3.397 -6.146 1.00 0.00 H new ATOM 734 N ARG A 51 -8.830 -1.079 -6.407 1.00 0.00 N ATOM 735 CA ARG A 51 -9.943 -0.628 -5.581 1.00 0.00 C ATOM 736 C ARG A 51 -10.093 -1.510 -4.344 1.00 0.00 C ATOM 737 O ARG A 51 -9.879 -2.721 -4.385 1.00 0.00 O ATOM 738 CB ARG A 51 -11.242 -0.639 -6.388 1.00 0.00 C ATOM 739 CG ARG A 51 -11.714 -2.034 -6.766 1.00 0.00 C ATOM 740 CD ARG A 51 -13.191 -2.044 -7.127 1.00 0.00 C ATOM 741 NE ARG A 51 -13.433 -1.495 -8.458 1.00 0.00 N ATOM 742 CZ ARG A 51 -13.309 -2.199 -9.577 1.00 0.00 C ATOM 743 NH1 ARG A 51 -12.948 -3.474 -9.526 1.00 0.00 N ATOM 744 NH2 ARG A 51 -13.546 -1.629 -10.752 1.00 0.00 N ATOM 0 H ARG A 51 -8.995 -1.961 -6.892 1.00 0.00 H new ATOM 0 HA ARG A 51 -9.733 0.391 -5.257 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -12.023 -0.145 -5.810 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -11.100 -0.054 -7.297 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -11.130 -2.401 -7.610 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -11.537 -2.717 -5.935 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -13.568 -3.066 -7.082 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -13.748 -1.466 -6.390 1.00 0.00 H new ATOM 0 HE ARG A 51 -13.713 -0.517 -8.532 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -12.765 -3.917 -8.625 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -12.854 -4.012 -10.387 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -13.824 -0.649 -10.796 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -13.450 -2.171 -11.611 1.00 0.00 H new ATOM 758 N PRO A 52 -10.470 -0.888 -3.216 1.00 0.00 N ATOM 759 CA PRO A 52 -10.657 -1.596 -1.947 1.00 0.00 C ATOM 760 C PRO A 52 -11.877 -2.510 -1.967 1.00 0.00 C ATOM 761 O PRO A 52 -12.981 -2.079 -2.302 1.00 0.00 O ATOM 762 CB PRO A 52 -10.852 -0.465 -0.935 1.00 0.00 C ATOM 763 CG PRO A 52 -11.378 0.675 -1.737 1.00 0.00 C ATOM 764 CD PRO A 52 -10.742 0.554 -3.094 1.00 0.00 C ATOM 0 HA PRO A 52 -9.816 -2.251 -1.718 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -11.551 -0.753 -0.150 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -9.913 -0.205 -0.446 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -12.465 0.632 -1.810 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -11.127 1.628 -1.272 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -11.408 0.905 -3.882 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -9.827 1.143 -3.163 1.00 0.00 H new ATOM 772 N ASP A 53 -11.672 -3.772 -1.606 1.00 0.00 N ATOM 773 CA ASP A 53 -12.757 -4.746 -1.581 1.00 0.00 C ATOM 774 C ASP A 53 -12.753 -5.531 -0.274 1.00 0.00 C ATOM 775 O ASP A 53 -11.917 -5.298 0.599 1.00 0.00 O ATOM 776 CB ASP A 53 -12.637 -5.705 -2.767 1.00 0.00 C ATOM 777 CG ASP A 53 -13.977 -6.278 -3.186 1.00 0.00 C ATOM 778 OD1 ASP A 53 -14.909 -5.485 -3.433 1.00 0.00 O ATOM 779 OD2 ASP A 53 -14.093 -7.519 -3.265 1.00 0.00 O ATOM 0 H ASP A 53 -10.764 -4.144 -1.327 1.00 0.00 H new ATOM 0 HA ASP A 53 -13.700 -4.204 -1.655 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -12.190 -5.180 -3.611 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -11.963 -6.520 -2.505 1.00 0.00 H new ATOM 784 N SER A 54 -13.693 -6.462 -0.145 1.00 0.00 N ATOM 785 CA SER A 54 -13.800 -7.278 1.059 1.00 0.00 C ATOM 786 C SER A 54 -12.425 -7.757 1.515 1.00 0.00 C ATOM 787 O SER A 54 -12.184 -7.940 2.707 1.00 0.00 O ATOM 788 CB SER A 54 -14.714 -8.479 0.806 1.00 0.00 C ATOM 789 OG SER A 54 -14.831 -9.284 1.966 1.00 0.00 O ATOM 0 H SER A 54 -14.391 -6.670 -0.859 1.00 0.00 H new ATOM 0 HA SER A 54 -14.231 -6.663 1.849 1.00 0.00 H new ATOM 0 HB2 SER A 54 -15.701 -8.131 0.500 1.00 0.00 H new ATOM 0 HB3 SER A 54 -14.317 -9.075 -0.016 1.00 0.00 H new ATOM 0 HG SER A 54 -15.421 -10.044 1.779 1.00 0.00 H new ATOM 795 N ALA A 55 -11.528 -7.959 0.556 1.00 0.00 N ATOM 796 CA ALA A 55 -10.177 -8.415 0.857 1.00 0.00 C ATOM 797 C ALA A 55 -9.223 -7.237 1.016 1.00 0.00 C ATOM 798 O ALA A 55 -8.519 -7.125 2.021 1.00 0.00 O ATOM 799 CB ALA A 55 -9.682 -9.355 -0.232 1.00 0.00 C ATOM 0 H ALA A 55 -11.713 -7.814 -0.437 1.00 0.00 H new ATOM 0 HA ALA A 55 -10.205 -8.956 1.803 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -8.672 -9.688 0.006 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -10.343 -10.219 -0.295 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -9.676 -8.832 -1.189 1.00 0.00 H new ATOM 805 N HIS A 56 -9.202 -6.359 0.018 1.00 0.00 N ATOM 806 CA HIS A 56 -8.333 -5.188 0.047 1.00 0.00 C ATOM 807 C HIS A 56 -8.975 -4.055 0.843 1.00 0.00 C ATOM 808 O HIS A 56 -10.037 -3.550 0.479 1.00 0.00 O ATOM 809 CB HIS A 56 -8.027 -4.718 -1.375 1.00 0.00 C ATOM 810 CG HIS A 56 -7.322 -5.746 -2.207 1.00 0.00 C ATOM 811 ND1 HIS A 56 -7.965 -6.828 -2.769 1.00 0.00 N ATOM 812 CD2 HIS A 56 -6.023 -5.850 -2.572 1.00 0.00 C ATOM 813 CE1 HIS A 56 -7.092 -7.555 -3.442 1.00 0.00 C ATOM 814 NE2 HIS A 56 -5.906 -6.983 -3.339 1.00 0.00 N ATOM 0 H HIS A 56 -9.777 -6.436 -0.821 1.00 0.00 H new ATOM 0 HA HIS A 56 -7.401 -5.470 0.536 1.00 0.00 H new ATOM 0 HB2 HIS A 56 -8.960 -4.442 -1.866 1.00 0.00 H new ATOM 0 HB3 HIS A 56 -7.414 -3.818 -1.327 1.00 0.00 H new ATOM 0 HD2 HIS A 56 -5.227 -5.169 -2.309 1.00 0.00 H new ATOM 0 HE1 HIS A 56 -7.311 -8.463 -3.984 1.00 0.00 H new ATOM 0 HE2 HIS A 56 -5.043 -7.327 -3.761 1.00 0.00 H new ATOM 822 N LYS A 57 -8.323 -3.661 1.932 1.00 0.00 N ATOM 823 CA LYS A 57 -8.828 -2.587 2.779 1.00 0.00 C ATOM 824 C LYS A 57 -7.825 -1.442 2.863 1.00 0.00 C ATOM 825 O LYS A 57 -6.695 -1.626 3.315 1.00 0.00 O ATOM 826 CB LYS A 57 -9.132 -3.118 4.183 1.00 0.00 C ATOM 827 CG LYS A 57 -9.875 -2.126 5.060 1.00 0.00 C ATOM 828 CD LYS A 57 -9.533 -2.315 6.529 1.00 0.00 C ATOM 829 CE LYS A 57 -10.334 -3.453 7.145 1.00 0.00 C ATOM 830 NZ LYS A 57 -11.779 -3.113 7.263 1.00 0.00 N ATOM 0 H LYS A 57 -7.444 -4.070 2.249 1.00 0.00 H new ATOM 0 HA LYS A 57 -9.747 -2.208 2.333 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -9.724 -4.029 4.097 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -8.196 -3.391 4.670 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -9.624 -1.110 4.755 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -10.949 -2.246 4.917 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -8.468 -2.521 6.632 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -9.733 -1.392 7.072 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -10.220 -4.349 6.535 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -9.934 -3.686 8.132 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -12.225 -3.733 7.969 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -11.879 -2.122 7.561 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -12.243 -3.246 6.342 1.00 0.00 H new ATOM 844 N MET A 58 -8.245 -0.259 2.426 1.00 0.00 N ATOM 845 CA MET A 58 -7.383 0.916 2.455 1.00 0.00 C ATOM 846 C MET A 58 -7.679 1.778 3.679 1.00 0.00 C ATOM 847 O MET A 58 -8.839 2.009 4.023 1.00 0.00 O ATOM 848 CB MET A 58 -7.567 1.742 1.180 1.00 0.00 C ATOM 849 CG MET A 58 -6.737 1.243 0.009 1.00 0.00 C ATOM 850 SD MET A 58 -7.511 1.579 -1.585 1.00 0.00 S ATOM 851 CE MET A 58 -7.314 -0.004 -2.398 1.00 0.00 C ATOM 0 H MET A 58 -9.177 -0.089 2.048 1.00 0.00 H new ATOM 0 HA MET A 58 -6.349 0.575 2.513 1.00 0.00 H new ATOM 0 HB2 MET A 58 -8.620 1.732 0.899 1.00 0.00 H new ATOM 0 HB3 MET A 58 -7.302 2.779 1.387 1.00 0.00 H new ATOM 0 HG2 MET A 58 -5.755 1.715 0.038 1.00 0.00 H new ATOM 0 HG3 MET A 58 -6.579 0.170 0.112 1.00 0.00 H new ATOM 0 HE1 MET A 58 -7.745 0.044 -3.398 1.00 0.00 H new ATOM 0 HE2 MET A 58 -6.254 -0.246 -2.471 1.00 0.00 H new ATOM 0 HE3 MET A 58 -7.823 -0.775 -1.821 1.00 0.00 H new ATOM 861 N LEU A 59 -6.624 2.249 4.334 1.00 0.00 N ATOM 862 CA LEU A 59 -6.770 3.085 5.520 1.00 0.00 C ATOM 863 C LEU A 59 -6.363 4.525 5.226 1.00 0.00 C ATOM 864 O LEU A 59 -5.454 4.775 4.434 1.00 0.00 O ATOM 865 CB LEU A 59 -5.925 2.529 6.668 1.00 0.00 C ATOM 866 CG LEU A 59 -6.302 1.133 7.164 1.00 0.00 C ATOM 867 CD1 LEU A 59 -5.182 0.545 8.007 1.00 0.00 C ATOM 868 CD2 LEU A 59 -7.600 1.181 7.957 1.00 0.00 C ATOM 0 H LEU A 59 -5.658 2.066 4.064 1.00 0.00 H new ATOM 0 HA LEU A 59 -7.820 3.076 5.812 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -4.883 2.510 6.349 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -5.989 3.221 7.508 1.00 0.00 H new ATOM 0 HG LEU A 59 -6.453 0.489 6.297 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -5.469 -0.449 8.351 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -4.274 0.474 7.408 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -4.999 1.188 8.868 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -7.853 0.178 8.302 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -7.477 1.840 8.816 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -8.401 1.559 7.321 1.00 0.00 H new ATOM 880 N VAL A 60 -7.041 5.470 5.870 1.00 0.00 N ATOM 881 CA VAL A 60 -6.749 6.886 5.679 1.00 0.00 C ATOM 882 C VAL A 60 -6.792 7.639 7.004 1.00 0.00 C ATOM 883 O VAL A 60 -7.861 7.842 7.580 1.00 0.00 O ATOM 884 CB VAL A 60 -7.741 7.537 4.698 1.00 0.00 C ATOM 885 CG1 VAL A 60 -7.345 8.978 4.416 1.00 0.00 C ATOM 886 CG2 VAL A 60 -7.819 6.734 3.408 1.00 0.00 C ATOM 0 H VAL A 60 -7.796 5.280 6.529 1.00 0.00 H new ATOM 0 HA VAL A 60 -5.744 6.948 5.261 1.00 0.00 H new ATOM 0 HB VAL A 60 -8.730 7.541 5.157 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -8.058 9.422 3.721 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -7.346 9.544 5.347 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -6.347 9.002 3.978 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -8.525 7.208 2.726 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -6.834 6.697 2.943 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -8.154 5.721 3.630 1.00 0.00 H new ATOM 896 N ARG A 61 -5.623 8.052 7.483 1.00 0.00 N ATOM 897 CA ARG A 61 -5.527 8.782 8.741 1.00 0.00 C ATOM 898 C ARG A 61 -5.690 10.282 8.512 1.00 0.00 C ATOM 899 O ARG A 61 -5.837 10.734 7.377 1.00 0.00 O ATOM 900 CB ARG A 61 -4.184 8.501 9.417 1.00 0.00 C ATOM 901 CG ARG A 61 -3.951 7.030 9.721 1.00 0.00 C ATOM 902 CD ARG A 61 -4.674 6.601 10.988 1.00 0.00 C ATOM 903 NE ARG A 61 -6.126 6.660 10.837 1.00 0.00 N ATOM 904 CZ ARG A 61 -6.843 5.709 10.250 1.00 0.00 C ATOM 905 NH1 ARG A 61 -6.246 4.630 9.761 1.00 0.00 N ATOM 906 NH2 ARG A 61 -8.160 5.835 10.151 1.00 0.00 N ATOM 0 H ARG A 61 -4.729 7.893 7.018 1.00 0.00 H new ATOM 0 HA ARG A 61 -6.332 8.442 9.393 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -3.381 8.862 8.775 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -4.129 9.068 10.346 1.00 0.00 H new ATOM 0 HG2 ARG A 61 -4.295 6.425 8.882 1.00 0.00 H new ATOM 0 HG3 ARG A 61 -2.882 6.845 9.830 1.00 0.00 H new ATOM 0 HD2 ARG A 61 -4.378 5.585 11.248 1.00 0.00 H new ATOM 0 HD3 ARG A 61 -4.369 7.243 11.814 1.00 0.00 H new ATOM 0 HE ARG A 61 -6.616 7.477 11.203 1.00 0.00 H new ATOM 0 HH11 ARG A 61 -5.234 4.529 9.835 1.00 0.00 H new ATOM 0 HH12 ARG A 61 -6.799 3.901 9.311 1.00 0.00 H new ATOM 0 HH21 ARG A 61 -8.623 6.663 10.526 1.00 0.00 H new ATOM 0 HH22 ARG A 61 -8.710 5.104 9.700 1.00 0.00 H new ATOM 920 N GLU A 62 -5.661 11.048 9.599 1.00 0.00 N ATOM 921 CA GLU A 62 -5.807 12.496 9.515 1.00 0.00 C ATOM 922 C GLU A 62 -4.445 13.183 9.558 1.00 0.00 C ATOM 923 O GLU A 62 -4.344 14.363 9.890 1.00 0.00 O ATOM 924 CB GLU A 62 -6.685 13.009 10.658 1.00 0.00 C ATOM 925 CG GLU A 62 -7.419 14.299 10.331 1.00 0.00 C ATOM 926 CD GLU A 62 -8.454 14.663 11.377 1.00 0.00 C ATOM 927 OE1 GLU A 62 -9.033 13.738 11.985 1.00 0.00 O ATOM 928 OE2 GLU A 62 -8.687 15.872 11.587 1.00 0.00 O ATOM 0 H GLU A 62 -5.538 10.690 10.546 1.00 0.00 H new ATOM 0 HA GLU A 62 -6.285 12.733 8.564 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -7.414 12.242 10.917 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -6.063 13.168 11.539 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -6.697 15.111 10.242 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -7.907 14.199 9.362 1.00 0.00 H new ATOM 935 N ASN A 63 -3.400 12.434 9.221 1.00 0.00 N ATOM 936 CA ASN A 63 -2.044 12.970 9.222 1.00 0.00 C ATOM 937 C ASN A 63 -1.331 12.648 7.912 1.00 0.00 C ATOM 938 O ASN A 63 -0.138 12.911 7.761 1.00 0.00 O ATOM 939 CB ASN A 63 -1.250 12.402 10.400 1.00 0.00 C ATOM 940 CG ASN A 63 -1.852 12.780 11.739 1.00 0.00 C ATOM 941 OD1 ASN A 63 -2.889 13.442 11.802 1.00 0.00 O ATOM 942 ND2 ASN A 63 -1.203 12.362 12.819 1.00 0.00 N ATOM 0 H ASN A 63 -3.466 11.455 8.944 1.00 0.00 H new ATOM 0 HA ASN A 63 -2.108 14.053 9.324 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -1.209 11.316 10.317 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -0.223 12.765 10.351 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -1.560 12.587 13.748 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -0.347 11.816 12.720 1.00 0.00 H new ATOM 949 N GLY A 64 -2.071 12.078 6.966 1.00 0.00 N ATOM 950 CA GLY A 64 -1.494 11.731 5.681 1.00 0.00 C ATOM 951 C GLY A 64 -1.057 10.281 5.614 1.00 0.00 C ATOM 952 O GLY A 64 -0.812 9.747 4.532 1.00 0.00 O ATOM 0 H GLY A 64 -3.060 11.850 7.067 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -2.224 11.924 4.895 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -0.637 12.375 5.485 1.00 0.00 H new ATOM 956 N VAL A 65 -0.959 9.640 6.775 1.00 0.00 N ATOM 957 CA VAL A 65 -0.548 8.243 6.844 1.00 0.00 C ATOM 958 C VAL A 65 -1.521 7.346 6.088 1.00 0.00 C ATOM 959 O VAL A 65 -2.738 7.506 6.191 1.00 0.00 O ATOM 960 CB VAL A 65 -0.449 7.759 8.303 1.00 0.00 C ATOM 961 CG1 VAL A 65 -0.340 6.243 8.357 1.00 0.00 C ATOM 962 CG2 VAL A 65 0.736 8.411 9.001 1.00 0.00 C ATOM 0 H VAL A 65 -1.159 10.066 7.680 1.00 0.00 H new ATOM 0 HA VAL A 65 0.436 8.179 6.380 1.00 0.00 H new ATOM 0 HB VAL A 65 -1.358 8.053 8.827 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -0.271 5.920 9.396 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -1.222 5.798 7.896 1.00 0.00 H new ATOM 0 HG13 VAL A 65 0.551 5.923 7.818 1.00 0.00 H new ATOM 0 HG21 VAL A 65 0.791 8.058 10.031 1.00 0.00 H new ATOM 0 HG22 VAL A 65 1.656 8.149 8.478 1.00 0.00 H new ATOM 0 HG23 VAL A 65 0.611 9.494 8.995 1.00 0.00 H new ATOM 972 N HIS A 66 -0.978 6.400 5.328 1.00 0.00 N ATOM 973 CA HIS A 66 -1.799 5.476 4.554 1.00 0.00 C ATOM 974 C HIS A 66 -1.342 4.035 4.767 1.00 0.00 C ATOM 975 O HIS A 66 -0.218 3.788 5.203 1.00 0.00 O ATOM 976 CB HIS A 66 -1.738 5.828 3.068 1.00 0.00 C ATOM 977 CG HIS A 66 -2.763 6.835 2.648 1.00 0.00 C ATOM 978 ND1 HIS A 66 -3.018 7.990 3.357 1.00 0.00 N ATOM 979 CD2 HIS A 66 -3.599 6.857 1.584 1.00 0.00 C ATOM 980 CE1 HIS A 66 -3.967 8.678 2.749 1.00 0.00 C ATOM 981 NE2 HIS A 66 -4.337 8.012 1.669 1.00 0.00 N ATOM 0 H HIS A 66 0.027 6.253 5.232 1.00 0.00 H new ATOM 0 HA HIS A 66 -2.829 5.567 4.899 1.00 0.00 H new ATOM 0 HB2 HIS A 66 -0.745 6.213 2.835 1.00 0.00 H new ATOM 0 HB3 HIS A 66 -1.873 4.919 2.482 1.00 0.00 H new ATOM 0 HD2 HIS A 66 -3.672 6.106 0.812 1.00 0.00 H new ATOM 0 HE1 HIS A 66 -4.372 9.624 3.078 1.00 0.00 H new ATOM 0 HE2 HIS A 66 -5.054 8.308 1.007 1.00 0.00 H new ATOM 989 N SER A 67 -2.223 3.089 4.458 1.00 0.00 N ATOM 990 CA SER A 67 -1.912 1.673 4.620 1.00 0.00 C ATOM 991 C SER A 67 -2.830 0.813 3.757 1.00 0.00 C ATOM 992 O SER A 67 -4.008 1.125 3.581 1.00 0.00 O ATOM 993 CB SER A 67 -2.043 1.265 6.088 1.00 0.00 C ATOM 994 OG SER A 67 -1.190 2.042 6.912 1.00 0.00 O ATOM 0 H SER A 67 -3.157 3.277 4.094 1.00 0.00 H new ATOM 0 HA SER A 67 -0.883 1.513 4.297 1.00 0.00 H new ATOM 0 HB2 SER A 67 -3.077 1.387 6.412 1.00 0.00 H new ATOM 0 HB3 SER A 67 -1.797 0.209 6.198 1.00 0.00 H new ATOM 0 HG SER A 67 -0.497 2.462 6.361 1.00 0.00 H new ATOM 1000 N LEU A 68 -2.282 -0.271 3.220 1.00 0.00 N ATOM 1001 CA LEU A 68 -3.050 -1.178 2.375 1.00 0.00 C ATOM 1002 C LEU A 68 -2.995 -2.604 2.914 1.00 0.00 C ATOM 1003 O LEU A 68 -1.972 -3.281 2.800 1.00 0.00 O ATOM 1004 CB LEU A 68 -2.520 -1.142 0.940 1.00 0.00 C ATOM 1005 CG LEU A 68 -3.135 -2.153 -0.028 1.00 0.00 C ATOM 1006 CD1 LEU A 68 -4.531 -1.715 -0.443 1.00 0.00 C ATOM 1007 CD2 LEU A 68 -2.245 -2.332 -1.249 1.00 0.00 C ATOM 0 H LEU A 68 -1.308 -0.543 3.355 1.00 0.00 H new ATOM 0 HA LEU A 68 -4.089 -0.847 2.381 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -2.681 -0.141 0.539 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -1.443 -1.305 0.968 1.00 0.00 H new ATOM 0 HG LEU A 68 -3.215 -3.113 0.482 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -4.952 -2.447 -1.132 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -5.166 -1.640 0.440 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -4.476 -0.744 -0.935 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -2.698 -3.055 -1.927 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -2.132 -1.376 -1.760 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -1.266 -2.693 -0.936 1.00 0.00 H new ATOM 1019 N ILE A 69 -4.100 -3.054 3.499 1.00 0.00 N ATOM 1020 CA ILE A 69 -4.177 -4.400 4.052 1.00 0.00 C ATOM 1021 C ILE A 69 -4.912 -5.342 3.105 1.00 0.00 C ATOM 1022 O ILE A 69 -5.888 -4.955 2.461 1.00 0.00 O ATOM 1023 CB ILE A 69 -4.887 -4.407 5.419 1.00 0.00 C ATOM 1024 CG1 ILE A 69 -4.141 -3.511 6.410 1.00 0.00 C ATOM 1025 CG2 ILE A 69 -4.991 -5.827 5.954 1.00 0.00 C ATOM 1026 CD1 ILE A 69 -4.964 -3.135 7.622 1.00 0.00 C ATOM 0 H ILE A 69 -4.954 -2.506 3.602 1.00 0.00 H new ATOM 0 HA ILE A 69 -3.152 -4.747 4.182 1.00 0.00 H new ATOM 0 HB ILE A 69 -5.895 -4.013 5.291 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -3.236 -4.022 6.739 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -3.825 -2.602 5.899 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -5.495 -5.816 6.920 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -5.561 -6.438 5.255 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -3.992 -6.246 6.071 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -4.372 -2.500 8.281 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -5.856 -2.596 7.303 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -5.258 -4.038 8.157 1.00 0.00 H new ATOM 1038 N ILE A 70 -4.439 -6.581 3.027 1.00 0.00 N ATOM 1039 CA ILE A 70 -5.053 -7.580 2.161 1.00 0.00 C ATOM 1040 C ILE A 70 -5.226 -8.908 2.890 1.00 0.00 C ATOM 1041 O ILE A 70 -4.295 -9.406 3.521 1.00 0.00 O ATOM 1042 CB ILE A 70 -4.218 -7.811 0.887 1.00 0.00 C ATOM 1043 CG1 ILE A 70 -4.116 -6.518 0.076 1.00 0.00 C ATOM 1044 CG2 ILE A 70 -4.829 -8.923 0.048 1.00 0.00 C ATOM 1045 CD1 ILE A 70 -3.024 -6.545 -0.970 1.00 0.00 C ATOM 0 H ILE A 70 -3.632 -6.917 3.553 1.00 0.00 H new ATOM 0 HA ILE A 70 -6.032 -7.193 1.878 1.00 0.00 H new ATOM 0 HB ILE A 70 -3.213 -8.114 1.179 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -5.072 -6.329 -0.413 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -3.936 -5.685 0.756 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -4.228 -9.074 -0.849 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -4.854 -9.845 0.629 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -5.844 -8.647 -0.238 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -3.010 -5.596 -1.506 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -2.060 -6.702 -0.486 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -3.214 -7.356 -1.673 1.00 0.00 H new ATOM 1057 N GLU A 71 -6.424 -9.476 2.796 1.00 0.00 N ATOM 1058 CA GLU A 71 -6.719 -10.748 3.447 1.00 0.00 C ATOM 1059 C GLU A 71 -8.092 -11.267 3.030 1.00 0.00 C ATOM 1060 O GLU A 71 -9.109 -10.587 3.171 1.00 0.00 O ATOM 1061 CB GLU A 71 -6.659 -10.594 4.968 1.00 0.00 C ATOM 1062 CG GLU A 71 -6.286 -11.874 5.695 1.00 0.00 C ATOM 1063 CD GLU A 71 -7.461 -12.820 5.851 1.00 0.00 C ATOM 1064 OE1 GLU A 71 -8.590 -12.431 5.485 1.00 0.00 O ATOM 1065 OE2 GLU A 71 -7.251 -13.950 6.340 1.00 0.00 O ATOM 0 H GLU A 71 -7.205 -9.076 2.276 1.00 0.00 H new ATOM 0 HA GLU A 71 -5.966 -11.471 3.133 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -5.934 -9.820 5.218 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -7.629 -10.251 5.328 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -5.488 -12.378 5.149 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -5.891 -11.626 6.680 1.00 0.00 H new ATOM 1072 N PRO A 72 -8.123 -12.500 2.504 1.00 0.00 N ATOM 1073 CA PRO A 72 -6.919 -13.317 2.330 1.00 0.00 C ATOM 1074 C PRO A 72 -5.999 -12.771 1.244 1.00 0.00 C ATOM 1075 O PRO A 72 -6.285 -11.740 0.635 1.00 0.00 O ATOM 1076 CB PRO A 72 -7.474 -14.684 1.923 1.00 0.00 C ATOM 1077 CG PRO A 72 -8.796 -14.387 1.304 1.00 0.00 C ATOM 1078 CD PRO A 72 -9.337 -13.191 2.036 1.00 0.00 C ATOM 0 HA PRO A 72 -6.309 -13.341 3.233 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -6.811 -15.187 1.219 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -7.580 -15.341 2.786 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -8.690 -14.178 0.239 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -9.470 -15.239 1.396 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -9.934 -12.556 1.382 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -9.978 -13.485 2.867 1.00 0.00 H new ATOM 1086 N VAL A 73 -4.893 -13.468 1.005 1.00 0.00 N ATOM 1087 CA VAL A 73 -3.931 -13.053 -0.009 1.00 0.00 C ATOM 1088 C VAL A 73 -3.818 -14.094 -1.118 1.00 0.00 C ATOM 1089 O VAL A 73 -3.655 -15.285 -0.852 1.00 0.00 O ATOM 1090 CB VAL A 73 -2.537 -12.817 0.602 1.00 0.00 C ATOM 1091 CG1 VAL A 73 -1.471 -12.822 -0.482 1.00 0.00 C ATOM 1092 CG2 VAL A 73 -2.511 -11.511 1.381 1.00 0.00 C ATOM 0 H VAL A 73 -4.641 -14.323 1.500 1.00 0.00 H new ATOM 0 HA VAL A 73 -4.298 -12.117 -0.429 1.00 0.00 H new ATOM 0 HB VAL A 73 -2.321 -13.631 1.294 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -0.493 -12.654 -0.031 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -1.475 -13.786 -0.992 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -1.680 -12.030 -1.201 1.00 0.00 H new ATOM 0 HG21 VAL A 73 -1.519 -11.360 1.806 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -2.749 -10.684 0.712 1.00 0.00 H new ATOM 0 HG23 VAL A 73 -3.247 -11.552 2.184 1.00 0.00 H new ATOM 1102 N THR A 74 -3.906 -13.636 -2.363 1.00 0.00 N ATOM 1103 CA THR A 74 -3.814 -14.526 -3.513 1.00 0.00 C ATOM 1104 C THR A 74 -2.487 -14.350 -4.240 1.00 0.00 C ATOM 1105 O THR A 74 -1.699 -13.464 -3.909 1.00 0.00 O ATOM 1106 CB THR A 74 -4.967 -14.283 -4.505 1.00 0.00 C ATOM 1107 OG1 THR A 74 -4.900 -12.946 -5.015 1.00 0.00 O ATOM 1108 CG2 THR A 74 -6.314 -14.508 -3.835 1.00 0.00 C ATOM 0 H THR A 74 -4.041 -12.653 -2.600 1.00 0.00 H new ATOM 0 HA THR A 74 -3.882 -15.544 -3.131 1.00 0.00 H new ATOM 0 HB THR A 74 -4.865 -14.991 -5.327 1.00 0.00 H new ATOM 0 HG1 THR A 74 -5.422 -12.349 -4.438 1.00 0.00 H new ATOM 0 HG21 THR A 74 -7.113 -14.330 -4.555 1.00 0.00 H new ATOM 0 HG22 THR A 74 -6.373 -15.534 -3.473 1.00 0.00 H new ATOM 0 HG23 THR A 74 -6.422 -13.821 -2.996 1.00 0.00 H new ATOM 1116 N SER A 75 -2.245 -15.198 -5.235 1.00 0.00 N ATOM 1117 CA SER A 75 -1.010 -15.137 -6.008 1.00 0.00 C ATOM 1118 C SER A 75 -0.974 -13.883 -6.877 1.00 0.00 C ATOM 1119 O SER A 75 0.097 -13.366 -7.195 1.00 0.00 O ATOM 1120 CB SER A 75 -0.871 -16.383 -6.885 1.00 0.00 C ATOM 1121 OG SER A 75 -1.999 -16.541 -7.729 1.00 0.00 O ATOM 0 H SER A 75 -2.888 -15.935 -5.525 1.00 0.00 H new ATOM 0 HA SER A 75 -0.174 -15.098 -5.309 1.00 0.00 H new ATOM 0 HB2 SER A 75 0.032 -16.307 -7.490 1.00 0.00 H new ATOM 0 HB3 SER A 75 -0.758 -17.265 -6.254 1.00 0.00 H new ATOM 0 HG SER A 75 -1.885 -17.343 -8.280 1.00 0.00 H new ATOM 1127 N ARG A 76 -2.152 -13.400 -7.256 1.00 0.00 N ATOM 1128 CA ARG A 76 -2.257 -12.208 -8.088 1.00 0.00 C ATOM 1129 C ARG A 76 -1.893 -10.957 -7.294 1.00 0.00 C ATOM 1130 O ARG A 76 -1.557 -9.921 -7.869 1.00 0.00 O ATOM 1131 CB ARG A 76 -3.674 -12.074 -8.649 1.00 0.00 C ATOM 1132 CG ARG A 76 -4.619 -11.305 -7.741 1.00 0.00 C ATOM 1133 CD ARG A 76 -6.071 -11.658 -8.021 1.00 0.00 C ATOM 1134 NE ARG A 76 -6.926 -11.420 -6.860 1.00 0.00 N ATOM 1135 CZ ARG A 76 -8.253 -11.409 -6.915 1.00 0.00 C ATOM 1136 NH1 ARG A 76 -8.874 -11.619 -8.067 1.00 0.00 N ATOM 1137 NH2 ARG A 76 -8.961 -11.186 -5.816 1.00 0.00 N ATOM 0 H ARG A 76 -3.047 -13.816 -7.000 1.00 0.00 H new ATOM 0 HA ARG A 76 -1.554 -12.310 -8.915 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -3.627 -11.574 -9.617 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -4.082 -13.070 -8.824 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -4.384 -11.525 -6.700 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -4.470 -10.234 -7.882 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -6.431 -11.068 -8.864 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -6.140 -12.706 -8.313 1.00 0.00 H new ATOM 0 HE ARG A 76 -6.479 -11.253 -5.958 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -8.333 -11.790 -8.914 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -9.893 -11.610 -8.106 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -8.486 -11.023 -4.928 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -9.980 -11.178 -5.859 1.00 0.00 H new ATOM 1151 N ASP A 77 -1.962 -11.061 -5.972 1.00 0.00 N ATOM 1152 CA ASP A 77 -1.639 -9.938 -5.099 1.00 0.00 C ATOM 1153 C ASP A 77 -0.176 -9.536 -5.249 1.00 0.00 C ATOM 1154 O ASP A 77 0.185 -8.379 -5.038 1.00 0.00 O ATOM 1155 CB ASP A 77 -1.936 -10.296 -3.641 1.00 0.00 C ATOM 1156 CG ASP A 77 -3.413 -10.526 -3.391 1.00 0.00 C ATOM 1157 OD1 ASP A 77 -4.206 -10.387 -4.346 1.00 0.00 O ATOM 1158 OD2 ASP A 77 -3.776 -10.845 -2.239 1.00 0.00 O ATOM 0 H ASP A 77 -2.239 -11.911 -5.481 1.00 0.00 H new ATOM 0 HA ASP A 77 -2.261 -9.092 -5.391 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -1.380 -11.194 -3.370 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -1.581 -9.494 -2.993 1.00 0.00 H new ATOM 1163 N ALA A 78 0.663 -10.500 -5.614 1.00 0.00 N ATOM 1164 CA ALA A 78 2.087 -10.247 -5.794 1.00 0.00 C ATOM 1165 C ALA A 78 2.345 -9.431 -7.056 1.00 0.00 C ATOM 1166 O ALA A 78 1.846 -9.760 -8.132 1.00 0.00 O ATOM 1167 CB ALA A 78 2.855 -11.559 -5.845 1.00 0.00 C ATOM 0 H ALA A 78 0.381 -11.464 -5.791 1.00 0.00 H new ATOM 0 HA ALA A 78 2.438 -9.667 -4.940 1.00 0.00 H new ATOM 0 HB1 ALA A 78 3.917 -11.354 -5.980 1.00 0.00 H new ATOM 0 HB2 ALA A 78 2.706 -12.104 -4.913 1.00 0.00 H new ATOM 0 HB3 ALA A 78 2.493 -12.160 -6.679 1.00 0.00 H new ATOM 1173 N GLY A 79 3.127 -8.365 -6.917 1.00 0.00 N ATOM 1174 CA GLY A 79 3.436 -7.518 -8.055 1.00 0.00 C ATOM 1175 C GLY A 79 4.164 -6.251 -7.653 1.00 0.00 C ATOM 1176 O GLY A 79 4.863 -6.223 -6.640 1.00 0.00 O ATOM 0 H GLY A 79 3.552 -8.073 -6.037 1.00 0.00 H new ATOM 0 HA2 GLY A 79 4.048 -8.076 -8.764 1.00 0.00 H new ATOM 0 HA3 GLY A 79 2.512 -7.255 -8.570 1.00 0.00 H new ATOM 1180 N ILE A 80 4.000 -5.199 -8.449 1.00 0.00 N ATOM 1181 CA ILE A 80 4.648 -3.923 -8.171 1.00 0.00 C ATOM 1182 C ILE A 80 3.618 -2.827 -7.923 1.00 0.00 C ATOM 1183 O ILE A 80 3.006 -2.311 -8.859 1.00 0.00 O ATOM 1184 CB ILE A 80 5.568 -3.495 -9.329 1.00 0.00 C ATOM 1185 CG1 ILE A 80 6.680 -4.526 -9.534 1.00 0.00 C ATOM 1186 CG2 ILE A 80 6.158 -2.119 -9.056 1.00 0.00 C ATOM 1187 CD1 ILE A 80 7.639 -4.620 -8.368 1.00 0.00 C ATOM 0 H ILE A 80 3.424 -5.205 -9.291 1.00 0.00 H new ATOM 0 HA ILE A 80 5.250 -4.063 -7.273 1.00 0.00 H new ATOM 0 HB ILE A 80 4.976 -3.440 -10.243 1.00 0.00 H new ATOM 0 HG12 ILE A 80 6.230 -5.504 -9.704 1.00 0.00 H new ATOM 0 HG13 ILE A 80 7.239 -4.271 -10.434 1.00 0.00 H new ATOM 0 HG21 ILE A 80 6.806 -1.830 -9.883 1.00 0.00 H new ATOM 0 HG22 ILE A 80 5.353 -1.391 -8.955 1.00 0.00 H new ATOM 0 HG23 ILE A 80 6.738 -2.148 -8.134 1.00 0.00 H new ATOM 0 HD11 ILE A 80 8.400 -5.370 -8.583 1.00 0.00 H new ATOM 0 HD12 ILE A 80 8.116 -3.653 -8.211 1.00 0.00 H new ATOM 0 HD13 ILE A 80 7.092 -4.905 -7.469 1.00 0.00 H new ATOM 1199 N TYR A 81 3.432 -2.473 -6.656 1.00 0.00 N ATOM 1200 CA TYR A 81 2.475 -1.438 -6.284 1.00 0.00 C ATOM 1201 C TYR A 81 3.080 -0.048 -6.462 1.00 0.00 C ATOM 1202 O TYR A 81 3.990 0.345 -5.731 1.00 0.00 O ATOM 1203 CB TYR A 81 2.024 -1.628 -4.835 1.00 0.00 C ATOM 1204 CG TYR A 81 1.145 -2.841 -4.628 1.00 0.00 C ATOM 1205 CD1 TYR A 81 -0.227 -2.771 -4.831 1.00 0.00 C ATOM 1206 CD2 TYR A 81 1.688 -4.056 -4.230 1.00 0.00 C ATOM 1207 CE1 TYR A 81 -1.034 -3.877 -4.643 1.00 0.00 C ATOM 1208 CE2 TYR A 81 0.889 -5.167 -4.040 1.00 0.00 C ATOM 1209 CZ TYR A 81 -0.472 -5.072 -4.248 1.00 0.00 C ATOM 1210 OH TYR A 81 -1.271 -6.176 -4.060 1.00 0.00 O ATOM 0 H TYR A 81 3.932 -2.888 -5.869 1.00 0.00 H new ATOM 0 HA TYR A 81 1.610 -1.525 -6.941 1.00 0.00 H new ATOM 0 HB2 TYR A 81 2.904 -1.715 -4.198 1.00 0.00 H new ATOM 0 HB3 TYR A 81 1.483 -0.738 -4.512 1.00 0.00 H new ATOM 0 HD1 TYR A 81 -0.671 -1.836 -5.141 1.00 0.00 H new ATOM 0 HD2 TYR A 81 2.753 -4.134 -4.066 1.00 0.00 H new ATOM 0 HE1 TYR A 81 -2.099 -3.805 -4.805 1.00 0.00 H new ATOM 0 HE2 TYR A 81 1.327 -6.104 -3.730 1.00 0.00 H new ATOM 0 HH TYR A 81 -0.801 -6.977 -4.373 1.00 0.00 H new ATOM 1220 N THR A 82 2.566 0.692 -7.440 1.00 0.00 N ATOM 1221 CA THR A 82 3.054 2.038 -7.716 1.00 0.00 C ATOM 1222 C THR A 82 2.062 3.091 -7.238 1.00 0.00 C ATOM 1223 O THR A 82 0.961 3.210 -7.777 1.00 0.00 O ATOM 1224 CB THR A 82 3.318 2.242 -9.220 1.00 0.00 C ATOM 1225 OG1 THR A 82 3.931 1.072 -9.773 1.00 0.00 O ATOM 1226 CG2 THR A 82 4.214 3.449 -9.453 1.00 0.00 C ATOM 0 H THR A 82 1.812 0.382 -8.054 1.00 0.00 H new ATOM 0 HA THR A 82 3.991 2.153 -7.171 1.00 0.00 H new ATOM 0 HB THR A 82 2.362 2.418 -9.714 1.00 0.00 H new ATOM 0 HG1 THR A 82 4.094 1.209 -10.730 1.00 0.00 H new ATOM 0 HG21 THR A 82 4.386 3.573 -10.522 1.00 0.00 H new ATOM 0 HG22 THR A 82 3.731 4.342 -9.057 1.00 0.00 H new ATOM 0 HG23 THR A 82 5.167 3.298 -8.947 1.00 0.00 H new ATOM 1234 N CYS A 83 2.458 3.854 -6.225 1.00 0.00 N ATOM 1235 CA CYS A 83 1.602 4.898 -5.674 1.00 0.00 C ATOM 1236 C CYS A 83 2.112 6.281 -6.064 1.00 0.00 C ATOM 1237 O CYS A 83 3.318 6.531 -6.067 1.00 0.00 O ATOM 1238 CB CYS A 83 1.531 4.778 -4.151 1.00 0.00 C ATOM 1239 SG CYS A 83 -0.016 5.381 -3.434 1.00 0.00 S ATOM 0 H CYS A 83 3.366 3.769 -5.769 1.00 0.00 H new ATOM 0 HA CYS A 83 0.602 4.769 -6.088 1.00 0.00 H new ATOM 0 HB2 CYS A 83 1.665 3.733 -3.873 1.00 0.00 H new ATOM 0 HB3 CYS A 83 2.362 5.332 -3.714 1.00 0.00 H new ATOM 0 HG CYS A 83 -0.324 4.660 -2.397 1.00 0.00 H new ATOM 1245 N ILE A 84 1.188 7.176 -6.395 1.00 0.00 N ATOM 1246 CA ILE A 84 1.545 8.534 -6.788 1.00 0.00 C ATOM 1247 C ILE A 84 0.844 9.563 -5.908 1.00 0.00 C ATOM 1248 O ILE A 84 -0.377 9.713 -5.963 1.00 0.00 O ATOM 1249 CB ILE A 84 1.188 8.806 -8.261 1.00 0.00 C ATOM 1250 CG1 ILE A 84 1.856 7.772 -9.170 1.00 0.00 C ATOM 1251 CG2 ILE A 84 1.605 10.215 -8.655 1.00 0.00 C ATOM 1252 CD1 ILE A 84 1.070 7.477 -10.428 1.00 0.00 C ATOM 0 H ILE A 84 0.186 6.986 -6.399 1.00 0.00 H new ATOM 0 HA ILE A 84 2.624 8.626 -6.661 1.00 0.00 H new ATOM 0 HB ILE A 84 0.108 8.721 -8.380 1.00 0.00 H new ATOM 0 HG12 ILE A 84 2.848 8.130 -9.446 1.00 0.00 H new ATOM 0 HG13 ILE A 84 1.995 6.846 -8.612 1.00 0.00 H new ATOM 0 HG21 ILE A 84 1.346 10.393 -9.699 1.00 0.00 H new ATOM 0 HG22 ILE A 84 1.087 10.938 -8.025 1.00 0.00 H new ATOM 0 HG23 ILE A 84 2.681 10.326 -8.524 1.00 0.00 H new ATOM 0 HD11 ILE A 84 1.602 6.736 -11.024 1.00 0.00 H new ATOM 0 HD12 ILE A 84 0.087 7.089 -10.160 1.00 0.00 H new ATOM 0 HD13 ILE A 84 0.953 8.393 -11.007 1.00 0.00 H new ATOM 1264 N ALA A 85 1.624 10.271 -5.098 1.00 0.00 N ATOM 1265 CA ALA A 85 1.079 11.289 -4.208 1.00 0.00 C ATOM 1266 C ALA A 85 1.148 12.671 -4.849 1.00 0.00 C ATOM 1267 O ALA A 85 2.231 13.180 -5.138 1.00 0.00 O ATOM 1268 CB ALA A 85 1.822 11.283 -2.881 1.00 0.00 C ATOM 0 H ALA A 85 2.636 10.158 -5.040 1.00 0.00 H new ATOM 0 HA ALA A 85 0.031 11.053 -4.025 1.00 0.00 H new ATOM 0 HB1 ALA A 85 1.404 12.048 -2.227 1.00 0.00 H new ATOM 0 HB2 ALA A 85 1.717 10.306 -2.410 1.00 0.00 H new ATOM 0 HB3 ALA A 85 2.878 11.491 -3.054 1.00 0.00 H new ATOM 1274 N THR A 86 -0.016 13.275 -5.069 1.00 0.00 N ATOM 1275 CA THR A 86 -0.088 14.597 -5.678 1.00 0.00 C ATOM 1276 C THR A 86 -0.596 15.634 -4.682 1.00 0.00 C ATOM 1277 O THR A 86 -1.717 15.533 -4.185 1.00 0.00 O ATOM 1278 CB THR A 86 -1.005 14.598 -6.915 1.00 0.00 C ATOM 1279 OG1 THR A 86 -0.915 13.339 -7.592 1.00 0.00 O ATOM 1280 CG2 THR A 86 -0.626 15.720 -7.869 1.00 0.00 C ATOM 0 H THR A 86 -0.922 12.869 -4.834 1.00 0.00 H new ATOM 0 HA THR A 86 0.924 14.858 -5.986 1.00 0.00 H new ATOM 0 HB THR A 86 -2.030 14.758 -6.580 1.00 0.00 H new ATOM 0 HG1 THR A 86 -0.517 13.472 -8.478 1.00 0.00 H new ATOM 0 HG21 THR A 86 -1.288 15.700 -8.735 1.00 0.00 H new ATOM 0 HG22 THR A 86 -0.723 16.679 -7.360 1.00 0.00 H new ATOM 0 HG23 THR A 86 0.405 15.586 -8.197 1.00 0.00 H new ATOM 1288 N ASN A 87 0.236 16.630 -4.395 1.00 0.00 N ATOM 1289 CA ASN A 87 -0.131 17.685 -3.458 1.00 0.00 C ATOM 1290 C ASN A 87 -0.139 19.046 -4.147 1.00 0.00 C ATOM 1291 O ASN A 87 0.489 19.229 -5.190 1.00 0.00 O ATOM 1292 CB ASN A 87 0.840 17.706 -2.275 1.00 0.00 C ATOM 1293 CG ASN A 87 0.187 18.200 -0.999 1.00 0.00 C ATOM 1294 OD1 ASN A 87 -1.013 18.475 -0.969 1.00 0.00 O ATOM 1295 ND2 ASN A 87 0.975 18.316 0.063 1.00 0.00 N ATOM 0 H ASN A 87 1.168 16.728 -4.798 1.00 0.00 H new ATOM 0 HA ASN A 87 -1.136 17.477 -3.091 1.00 0.00 H new ATOM 0 HB2 ASN A 87 1.233 16.702 -2.114 1.00 0.00 H new ATOM 0 HB3 ASN A 87 1.689 18.346 -2.517 1.00 0.00 H new ATOM 0 HD21 ASN A 87 0.591 18.644 0.949 1.00 0.00 H new ATOM 0 HD22 ASN A 87 1.964 18.077 -0.007 1.00 0.00 H new ATOM 1302 N ARG A 88 -0.853 19.999 -3.557 1.00 0.00 N ATOM 1303 CA ARG A 88 -0.944 21.343 -4.114 1.00 0.00 C ATOM 1304 C ARG A 88 0.438 21.869 -4.491 1.00 0.00 C ATOM 1305 O ARG A 88 0.563 22.796 -5.290 1.00 0.00 O ATOM 1306 CB ARG A 88 -1.606 22.290 -3.112 1.00 0.00 C ATOM 1307 CG ARG A 88 -1.501 23.756 -3.499 1.00 0.00 C ATOM 1308 CD ARG A 88 -2.315 24.062 -4.747 1.00 0.00 C ATOM 1309 NE ARG A 88 -2.462 25.499 -4.965 1.00 0.00 N ATOM 1310 CZ ARG A 88 -3.393 26.240 -4.374 1.00 0.00 C ATOM 1311 NH1 ARG A 88 -4.254 25.683 -3.534 1.00 0.00 N ATOM 1312 NH2 ARG A 88 -3.464 27.541 -4.624 1.00 0.00 N ATOM 0 H ARG A 88 -1.377 19.865 -2.692 1.00 0.00 H new ATOM 0 HA ARG A 88 -1.555 21.295 -5.016 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -2.658 22.023 -3.014 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -1.148 22.148 -2.133 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -1.850 24.377 -2.674 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -0.456 24.014 -3.672 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -1.833 23.611 -5.614 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -3.301 23.606 -4.658 1.00 0.00 H new ATOM 0 HE ARG A 88 -1.815 25.958 -5.606 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -4.203 24.683 -3.340 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -4.968 26.254 -3.082 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -2.804 27.973 -5.270 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -4.179 28.109 -4.170 1.00 0.00 H new ATOM 1326 N ALA A 89 1.472 21.271 -3.909 1.00 0.00 N ATOM 1327 CA ALA A 89 2.845 21.678 -4.185 1.00 0.00 C ATOM 1328 C ALA A 89 3.382 20.985 -5.432 1.00 0.00 C ATOM 1329 O ALA A 89 3.852 21.638 -6.363 1.00 0.00 O ATOM 1330 CB ALA A 89 3.734 21.379 -2.987 1.00 0.00 C ATOM 0 H ALA A 89 1.385 20.503 -3.243 1.00 0.00 H new ATOM 0 HA ALA A 89 2.851 22.752 -4.368 1.00 0.00 H new ATOM 0 HB1 ALA A 89 4.756 21.688 -3.206 1.00 0.00 H new ATOM 0 HB2 ALA A 89 3.369 21.925 -2.117 1.00 0.00 H new ATOM 0 HB3 ALA A 89 3.715 20.309 -2.778 1.00 0.00 H new ATOM 1336 N GLY A 90 3.311 19.657 -5.444 1.00 0.00 N ATOM 1337 CA GLY A 90 3.795 18.898 -6.582 1.00 0.00 C ATOM 1338 C GLY A 90 3.250 17.484 -6.610 1.00 0.00 C ATOM 1339 O GLY A 90 2.096 17.250 -6.252 1.00 0.00 O ATOM 0 H GLY A 90 2.927 19.094 -4.686 1.00 0.00 H new ATOM 0 HA2 GLY A 90 3.515 19.410 -7.502 1.00 0.00 H new ATOM 0 HA3 GLY A 90 4.884 18.864 -6.555 1.00 0.00 H new ATOM 1343 N GLN A 91 4.082 16.540 -7.038 1.00 0.00 N ATOM 1344 CA GLN A 91 3.675 15.142 -7.114 1.00 0.00 C ATOM 1345 C GLN A 91 4.878 14.216 -6.967 1.00 0.00 C ATOM 1346 O GLN A 91 5.984 14.548 -7.392 1.00 0.00 O ATOM 1347 CB GLN A 91 2.963 14.867 -8.439 1.00 0.00 C ATOM 1348 CG GLN A 91 2.419 13.452 -8.556 1.00 0.00 C ATOM 1349 CD GLN A 91 1.495 13.278 -9.745 1.00 0.00 C ATOM 1350 OE1 GLN A 91 0.371 12.794 -9.607 1.00 0.00 O ATOM 1351 NE2 GLN A 91 1.964 13.674 -10.922 1.00 0.00 N ATOM 0 H GLN A 91 5.041 16.718 -7.337 1.00 0.00 H new ATOM 0 HA GLN A 91 2.986 14.945 -6.293 1.00 0.00 H new ATOM 0 HB2 GLN A 91 2.141 15.574 -8.554 1.00 0.00 H new ATOM 0 HB3 GLN A 91 3.657 15.049 -9.259 1.00 0.00 H new ATOM 0 HG2 GLN A 91 3.251 12.753 -8.642 1.00 0.00 H new ATOM 0 HG3 GLN A 91 1.881 13.197 -7.643 1.00 0.00 H new ATOM 0 HE21 GLN A 91 2.902 14.070 -10.990 1.00 0.00 H new ATOM 0 HE22 GLN A 91 1.387 13.583 -11.758 1.00 0.00 H new ATOM 1360 N ASN A 92 4.654 13.053 -6.363 1.00 0.00 N ATOM 1361 CA ASN A 92 5.721 12.079 -6.160 1.00 0.00 C ATOM 1362 C ASN A 92 5.197 10.656 -6.328 1.00 0.00 C ATOM 1363 O ASN A 92 3.988 10.424 -6.321 1.00 0.00 O ATOM 1364 CB ASN A 92 6.336 12.248 -4.770 1.00 0.00 C ATOM 1365 CG ASN A 92 7.202 13.489 -4.667 1.00 0.00 C ATOM 1366 OD1 ASN A 92 6.792 14.580 -5.063 1.00 0.00 O ATOM 1367 ND2 ASN A 92 8.408 13.326 -4.134 1.00 0.00 N ATOM 0 H ASN A 92 3.744 12.762 -6.006 1.00 0.00 H new ATOM 0 HA ASN A 92 6.489 12.255 -6.913 1.00 0.00 H new ATOM 0 HB2 ASN A 92 5.540 12.301 -4.028 1.00 0.00 H new ATOM 0 HB3 ASN A 92 6.935 11.369 -4.532 1.00 0.00 H new ATOM 0 HD21 ASN A 92 9.036 14.124 -4.040 1.00 0.00 H new ATOM 0 HD22 ASN A 92 8.706 12.403 -3.819 1.00 0.00 H new ATOM 1374 N SER A 93 6.116 9.707 -6.477 1.00 0.00 N ATOM 1375 CA SER A 93 5.747 8.307 -6.650 1.00 0.00 C ATOM 1376 C SER A 93 6.870 7.388 -6.179 1.00 0.00 C ATOM 1377 O SER A 93 8.008 7.821 -6.000 1.00 0.00 O ATOM 1378 CB SER A 93 5.419 8.021 -8.117 1.00 0.00 C ATOM 1379 OG SER A 93 4.685 6.816 -8.249 1.00 0.00 O ATOM 0 H SER A 93 7.121 9.882 -6.481 1.00 0.00 H new ATOM 0 HA SER A 93 4.863 8.112 -6.043 1.00 0.00 H new ATOM 0 HB2 SER A 93 4.844 8.848 -8.532 1.00 0.00 H new ATOM 0 HB3 SER A 93 6.342 7.953 -8.693 1.00 0.00 H new ATOM 0 HG SER A 93 3.983 6.784 -7.566 1.00 0.00 H new ATOM 1385 N PHE A 94 6.541 6.116 -5.980 1.00 0.00 N ATOM 1386 CA PHE A 94 7.520 5.134 -5.529 1.00 0.00 C ATOM 1387 C PHE A 94 7.132 3.730 -5.984 1.00 0.00 C ATOM 1388 O PHE A 94 5.982 3.479 -6.346 1.00 0.00 O ATOM 1389 CB PHE A 94 7.647 5.172 -4.005 1.00 0.00 C ATOM 1390 CG PHE A 94 6.485 4.542 -3.291 1.00 0.00 C ATOM 1391 CD1 PHE A 94 6.421 3.169 -3.122 1.00 0.00 C ATOM 1392 CD2 PHE A 94 5.458 5.324 -2.788 1.00 0.00 C ATOM 1393 CE1 PHE A 94 5.353 2.587 -2.466 1.00 0.00 C ATOM 1394 CE2 PHE A 94 4.387 4.748 -2.131 1.00 0.00 C ATOM 1395 CZ PHE A 94 4.335 3.378 -1.969 1.00 0.00 C ATOM 0 H PHE A 94 5.603 5.741 -6.124 1.00 0.00 H new ATOM 0 HA PHE A 94 8.483 5.387 -5.973 1.00 0.00 H new ATOM 0 HB2 PHE A 94 8.564 4.661 -3.712 1.00 0.00 H new ATOM 0 HB3 PHE A 94 7.743 6.209 -3.682 1.00 0.00 H new ATOM 0 HD1 PHE A 94 7.215 2.546 -3.507 1.00 0.00 H new ATOM 0 HD2 PHE A 94 5.495 6.396 -2.911 1.00 0.00 H new ATOM 0 HE1 PHE A 94 5.314 1.515 -2.342 1.00 0.00 H new ATOM 0 HE2 PHE A 94 3.592 5.369 -1.745 1.00 0.00 H new ATOM 0 HZ PHE A 94 3.500 2.925 -1.455 1.00 0.00 H new ATOM 1405 N SER A 95 8.099 2.819 -5.963 1.00 0.00 N ATOM 1406 CA SER A 95 7.861 1.441 -6.376 1.00 0.00 C ATOM 1407 C SER A 95 8.138 0.474 -5.230 1.00 0.00 C ATOM 1408 O SER A 95 8.897 0.784 -4.310 1.00 0.00 O ATOM 1409 CB SER A 95 8.738 1.089 -7.579 1.00 0.00 C ATOM 1410 OG SER A 95 10.102 0.996 -7.206 1.00 0.00 O ATOM 0 H SER A 95 9.055 3.010 -5.664 1.00 0.00 H new ATOM 0 HA SER A 95 6.813 1.349 -6.660 1.00 0.00 H new ATOM 0 HB2 SER A 95 8.410 0.142 -8.008 1.00 0.00 H new ATOM 0 HB3 SER A 95 8.620 1.847 -8.353 1.00 0.00 H new ATOM 0 HG SER A 95 10.641 0.768 -7.992 1.00 0.00 H new ATOM 1416 N LEU A 96 7.519 -0.700 -5.291 1.00 0.00 N ATOM 1417 CA LEU A 96 7.698 -1.715 -4.259 1.00 0.00 C ATOM 1418 C LEU A 96 7.390 -3.106 -4.803 1.00 0.00 C ATOM 1419 O LEU A 96 6.723 -3.247 -5.827 1.00 0.00 O ATOM 1420 CB LEU A 96 6.798 -1.413 -3.058 1.00 0.00 C ATOM 1421 CG LEU A 96 5.379 -1.980 -3.124 1.00 0.00 C ATOM 1422 CD1 LEU A 96 5.369 -3.444 -2.713 1.00 0.00 C ATOM 1423 CD2 LEU A 96 4.440 -1.170 -2.242 1.00 0.00 C ATOM 0 H LEU A 96 6.888 -0.973 -6.045 1.00 0.00 H new ATOM 0 HA LEU A 96 8.740 -1.693 -3.940 1.00 0.00 H new ATOM 0 HB2 LEU A 96 7.281 -1.800 -2.161 1.00 0.00 H new ATOM 0 HB3 LEU A 96 6.731 -0.331 -2.943 1.00 0.00 H new ATOM 0 HG LEU A 96 5.028 -1.911 -4.154 1.00 0.00 H new ATOM 0 HD11 LEU A 96 4.351 -3.830 -2.766 1.00 0.00 H new ATOM 0 HD12 LEU A 96 6.009 -4.015 -3.385 1.00 0.00 H new ATOM 0 HD13 LEU A 96 5.740 -3.538 -1.692 1.00 0.00 H new ATOM 0 HD21 LEU A 96 3.435 -1.587 -2.301 1.00 0.00 H new ATOM 0 HD22 LEU A 96 4.788 -1.207 -1.210 1.00 0.00 H new ATOM 0 HD23 LEU A 96 4.424 -0.135 -2.583 1.00 0.00 H new ATOM 1435 N GLU A 97 7.878 -4.129 -4.109 1.00 0.00 N ATOM 1436 CA GLU A 97 7.653 -5.509 -4.523 1.00 0.00 C ATOM 1437 C GLU A 97 6.994 -6.312 -3.405 1.00 0.00 C ATOM 1438 O GLU A 97 7.176 -6.017 -2.223 1.00 0.00 O ATOM 1439 CB GLU A 97 8.975 -6.165 -4.927 1.00 0.00 C ATOM 1440 CG GLU A 97 8.858 -7.657 -5.190 1.00 0.00 C ATOM 1441 CD GLU A 97 10.117 -8.243 -5.799 1.00 0.00 C ATOM 1442 OE1 GLU A 97 11.222 -7.818 -5.402 1.00 0.00 O ATOM 1443 OE2 GLU A 97 9.997 -9.126 -6.673 1.00 0.00 O ATOM 0 H GLU A 97 8.431 -4.028 -3.258 1.00 0.00 H new ATOM 0 HA GLU A 97 6.983 -5.499 -5.383 1.00 0.00 H new ATOM 0 HB2 GLU A 97 9.355 -5.675 -5.824 1.00 0.00 H new ATOM 0 HB3 GLU A 97 9.709 -6.000 -4.138 1.00 0.00 H new ATOM 0 HG2 GLU A 97 8.639 -8.171 -4.254 1.00 0.00 H new ATOM 0 HG3 GLU A 97 8.017 -7.839 -5.859 1.00 0.00 H new ATOM 1450 N LEU A 98 6.228 -7.327 -3.787 1.00 0.00 N ATOM 1451 CA LEU A 98 5.541 -8.174 -2.818 1.00 0.00 C ATOM 1452 C LEU A 98 5.606 -9.640 -3.232 1.00 0.00 C ATOM 1453 O LEU A 98 5.117 -10.018 -4.297 1.00 0.00 O ATOM 1454 CB LEU A 98 4.082 -7.737 -2.674 1.00 0.00 C ATOM 1455 CG LEU A 98 3.108 -8.805 -2.172 1.00 0.00 C ATOM 1456 CD1 LEU A 98 3.521 -9.299 -0.795 1.00 0.00 C ATOM 1457 CD2 LEU A 98 1.688 -8.259 -2.142 1.00 0.00 C ATOM 0 H LEU A 98 6.067 -7.584 -4.761 1.00 0.00 H new ATOM 0 HA LEU A 98 6.044 -8.065 -1.857 1.00 0.00 H new ATOM 0 HB2 LEU A 98 4.043 -6.889 -1.991 1.00 0.00 H new ATOM 0 HB3 LEU A 98 3.733 -7.382 -3.643 1.00 0.00 H new ATOM 0 HG LEU A 98 3.137 -9.649 -2.861 1.00 0.00 H new ATOM 0 HD11 LEU A 98 2.817 -10.058 -0.454 1.00 0.00 H new ATOM 0 HD12 LEU A 98 4.521 -9.730 -0.848 1.00 0.00 H new ATOM 0 HD13 LEU A 98 3.522 -8.464 -0.094 1.00 0.00 H new ATOM 0 HD21 LEU A 98 1.009 -9.032 -1.783 1.00 0.00 H new ATOM 0 HD22 LEU A 98 1.643 -7.398 -1.475 1.00 0.00 H new ATOM 0 HD23 LEU A 98 1.394 -7.956 -3.147 1.00 0.00 H new ATOM 1469 N VAL A 99 6.212 -10.464 -2.382 1.00 0.00 N ATOM 1470 CA VAL A 99 6.339 -11.890 -2.658 1.00 0.00 C ATOM 1471 C VAL A 99 5.279 -12.690 -1.911 1.00 0.00 C ATOM 1472 O VAL A 99 5.040 -12.468 -0.724 1.00 0.00 O ATOM 1473 CB VAL A 99 7.734 -12.415 -2.269 1.00 0.00 C ATOM 1474 CG1 VAL A 99 7.864 -13.890 -2.614 1.00 0.00 C ATOM 1475 CG2 VAL A 99 8.820 -11.600 -2.954 1.00 0.00 C ATOM 0 H VAL A 99 6.623 -10.168 -1.496 1.00 0.00 H new ATOM 0 HA VAL A 99 6.198 -12.019 -3.731 1.00 0.00 H new ATOM 0 HB VAL A 99 7.857 -12.307 -1.191 1.00 0.00 H new ATOM 0 HG11 VAL A 99 8.856 -14.244 -2.332 1.00 0.00 H new ATOM 0 HG12 VAL A 99 7.108 -14.458 -2.072 1.00 0.00 H new ATOM 0 HG13 VAL A 99 7.721 -14.027 -3.686 1.00 0.00 H new ATOM 0 HG21 VAL A 99 9.799 -11.985 -2.668 1.00 0.00 H new ATOM 0 HG22 VAL A 99 8.703 -11.674 -4.035 1.00 0.00 H new ATOM 0 HG23 VAL A 99 8.738 -10.556 -2.651 1.00 0.00 H new ATOM 1485 N VAL A 100 4.646 -13.624 -2.613 1.00 0.00 N ATOM 1486 CA VAL A 100 3.612 -14.461 -2.016 1.00 0.00 C ATOM 1487 C VAL A 100 3.917 -15.941 -2.218 1.00 0.00 C ATOM 1488 O VAL A 100 3.881 -16.444 -3.340 1.00 0.00 O ATOM 1489 CB VAL A 100 2.225 -14.148 -2.609 1.00 0.00 C ATOM 1490 CG1 VAL A 100 2.229 -14.357 -4.115 1.00 0.00 C ATOM 1491 CG2 VAL A 100 1.157 -15.005 -1.946 1.00 0.00 C ATOM 0 H VAL A 100 4.831 -13.820 -3.597 1.00 0.00 H new ATOM 0 HA VAL A 100 3.602 -14.238 -0.949 1.00 0.00 H new ATOM 0 HB VAL A 100 1.992 -13.101 -2.412 1.00 0.00 H new ATOM 0 HG11 VAL A 100 1.241 -14.131 -4.516 1.00 0.00 H new ATOM 0 HG12 VAL A 100 2.966 -13.697 -4.572 1.00 0.00 H new ATOM 0 HG13 VAL A 100 2.483 -15.393 -4.338 1.00 0.00 H new ATOM 0 HG21 VAL A 100 0.183 -14.771 -2.377 1.00 0.00 H new ATOM 0 HG22 VAL A 100 1.383 -16.059 -2.110 1.00 0.00 H new ATOM 0 HG23 VAL A 100 1.139 -14.800 -0.876 1.00 0.00 H new ATOM 1501 N ALA A 101 4.217 -16.632 -1.124 1.00 0.00 N ATOM 1502 CA ALA A 101 4.526 -18.056 -1.180 1.00 0.00 C ATOM 1503 C ALA A 101 3.258 -18.897 -1.078 1.00 0.00 C ATOM 1504 O ALA A 101 2.526 -18.816 -0.092 1.00 0.00 O ATOM 1505 CB ALA A 101 5.500 -18.429 -0.072 1.00 0.00 C ATOM 0 H ALA A 101 4.253 -16.229 -0.188 1.00 0.00 H new ATOM 0 HA ALA A 101 4.992 -18.264 -2.143 1.00 0.00 H new ATOM 0 HB1 ALA A 101 5.722 -19.495 -0.126 1.00 0.00 H new ATOM 0 HB2 ALA A 101 6.422 -17.860 -0.191 1.00 0.00 H new ATOM 0 HB3 ALA A 101 5.055 -18.200 0.896 1.00 0.00 H new ATOM 1511 N ALA A 102 3.005 -19.704 -2.103 1.00 0.00 N ATOM 1512 CA ALA A 102 1.826 -20.561 -2.128 1.00 0.00 C ATOM 1513 C ALA A 102 1.754 -21.430 -0.878 1.00 0.00 C ATOM 1514 O ALA A 102 2.760 -21.652 -0.203 1.00 0.00 O ATOM 1515 CB ALA A 102 1.831 -21.429 -3.378 1.00 0.00 C ATOM 0 H ALA A 102 3.601 -19.782 -2.927 1.00 0.00 H new ATOM 0 HA ALA A 102 0.943 -19.923 -2.146 1.00 0.00 H new ATOM 0 HB1 ALA A 102 0.945 -22.064 -3.384 1.00 0.00 H new ATOM 0 HB2 ALA A 102 1.827 -20.793 -4.263 1.00 0.00 H new ATOM 0 HB3 ALA A 102 2.725 -22.053 -3.384 1.00 0.00 H new ATOM 1521 N LYS A 103 0.557 -21.921 -0.572 1.00 0.00 N ATOM 1522 CA LYS A 103 0.352 -22.768 0.597 1.00 0.00 C ATOM 1523 C LYS A 103 1.001 -24.134 0.400 1.00 0.00 C ATOM 1524 O LYS A 103 1.204 -24.577 -0.730 1.00 0.00 O ATOM 1525 CB LYS A 103 -1.143 -22.936 0.875 1.00 0.00 C ATOM 1526 CG LYS A 103 -1.464 -23.211 2.334 1.00 0.00 C ATOM 1527 CD LYS A 103 -2.770 -23.973 2.483 1.00 0.00 C ATOM 1528 CE LYS A 103 -3.112 -24.210 3.946 1.00 0.00 C ATOM 1529 NZ LYS A 103 -2.358 -25.363 4.513 1.00 0.00 N ATOM 0 H LYS A 103 -0.286 -21.746 -1.118 1.00 0.00 H new ATOM 0 HA LYS A 103 0.822 -22.283 1.453 1.00 0.00 H new ATOM 0 HB2 LYS A 103 -1.666 -22.033 0.561 1.00 0.00 H new ATOM 0 HB3 LYS A 103 -1.527 -23.755 0.267 1.00 0.00 H new ATOM 0 HG2 LYS A 103 -0.654 -23.784 2.784 1.00 0.00 H new ATOM 0 HG3 LYS A 103 -1.528 -22.268 2.878 1.00 0.00 H new ATOM 0 HD2 LYS A 103 -3.575 -23.414 2.006 1.00 0.00 H new ATOM 0 HD3 LYS A 103 -2.696 -24.930 1.966 1.00 0.00 H new ATOM 0 HE2 LYS A 103 -2.888 -23.312 4.521 1.00 0.00 H new ATOM 0 HE3 LYS A 103 -4.182 -24.393 4.044 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 -2.619 -25.491 5.511 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 -2.591 -26.226 3.981 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 -1.337 -25.178 4.443 1.00 0.00 H new ATOM 1543 N GLU A 104 1.323 -24.797 1.507 1.00 0.00 N ATOM 1544 CA GLU A 104 1.947 -26.113 1.453 1.00 0.00 C ATOM 1545 C GLU A 104 0.894 -27.211 1.333 1.00 0.00 C ATOM 1546 O GLU A 104 0.727 -28.028 2.239 1.00 0.00 O ATOM 1547 CB GLU A 104 2.803 -26.347 2.700 1.00 0.00 C ATOM 1548 CG GLU A 104 2.048 -26.146 4.003 1.00 0.00 C ATOM 1549 CD GLU A 104 2.780 -26.727 5.198 1.00 0.00 C ATOM 1550 OE1 GLU A 104 3.878 -26.228 5.521 1.00 0.00 O ATOM 1551 OE2 GLU A 104 2.254 -27.681 5.808 1.00 0.00 O ATOM 0 H GLU A 104 1.162 -24.444 2.450 1.00 0.00 H new ATOM 0 HA GLU A 104 2.585 -26.148 0.570 1.00 0.00 H new ATOM 0 HB2 GLU A 104 3.200 -27.362 2.673 1.00 0.00 H new ATOM 0 HB3 GLU A 104 3.657 -25.670 2.677 1.00 0.00 H new ATOM 0 HG2 GLU A 104 1.886 -25.080 4.164 1.00 0.00 H new ATOM 0 HG3 GLU A 104 1.065 -26.609 3.924 1.00 0.00 H new ATOM 1558 N SER A 105 0.186 -27.223 0.209 1.00 0.00 N ATOM 1559 CA SER A 105 -0.854 -28.216 -0.030 1.00 0.00 C ATOM 1560 C SER A 105 -0.276 -29.628 0.010 1.00 0.00 C ATOM 1561 O SER A 105 0.665 -29.946 -0.714 1.00 0.00 O ATOM 1562 CB SER A 105 -1.528 -27.967 -1.380 1.00 0.00 C ATOM 1563 OG SER A 105 -2.777 -28.632 -1.458 1.00 0.00 O ATOM 0 H SER A 105 0.314 -26.555 -0.552 1.00 0.00 H new ATOM 0 HA SER A 105 -1.598 -28.123 0.761 1.00 0.00 H new ATOM 0 HB2 SER A 105 -1.673 -26.897 -1.525 1.00 0.00 H new ATOM 0 HB3 SER A 105 -0.878 -28.313 -2.184 1.00 0.00 H new ATOM 0 HG SER A 105 -3.188 -28.455 -2.330 1.00 0.00 H new ATOM 1569 N GLY A 106 -0.849 -30.471 0.864 1.00 0.00 N ATOM 1570 CA GLY A 106 -0.379 -31.839 0.983 1.00 0.00 C ATOM 1571 C GLY A 106 -1.331 -32.712 1.776 1.00 0.00 C ATOM 1572 O GLY A 106 -2.254 -32.227 2.430 1.00 0.00 O ATOM 0 H GLY A 106 -1.630 -30.231 1.475 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -0.247 -32.262 -0.013 1.00 0.00 H new ATOM 0 HA3 GLY A 106 0.599 -31.843 1.464 1.00 0.00 H new ATOM 1576 N PRO A 107 -1.111 -34.034 1.723 1.00 0.00 N ATOM 1577 CA PRO A 107 -1.947 -35.005 2.435 1.00 0.00 C ATOM 1578 C PRO A 107 -1.757 -34.936 3.946 1.00 0.00 C ATOM 1579 O PRO A 107 -2.358 -35.708 4.693 1.00 0.00 O ATOM 1580 CB PRO A 107 -1.462 -36.354 1.896 1.00 0.00 C ATOM 1581 CG PRO A 107 -0.061 -36.104 1.455 1.00 0.00 C ATOM 1582 CD PRO A 107 -0.029 -34.683 0.963 1.00 0.00 C ATOM 0 HA PRO A 107 -3.010 -34.823 2.274 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -1.503 -37.126 2.665 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -2.083 -36.696 1.068 1.00 0.00 H new ATOM 0 HG2 PRO A 107 0.639 -36.248 2.278 1.00 0.00 H new ATOM 0 HG3 PRO A 107 0.229 -36.797 0.665 1.00 0.00 H new ATOM 0 HD2 PRO A 107 0.935 -34.213 1.156 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -0.203 -34.626 -0.112 1.00 0.00 H new ATOM 1590 N SER A 108 -0.917 -34.007 4.390 1.00 0.00 N ATOM 1591 CA SER A 108 -0.645 -33.839 5.813 1.00 0.00 C ATOM 1592 C SER A 108 -1.562 -32.782 6.420 1.00 0.00 C ATOM 1593 O SER A 108 -2.049 -31.892 5.723 1.00 0.00 O ATOM 1594 CB SER A 108 0.818 -33.448 6.031 1.00 0.00 C ATOM 1595 OG SER A 108 1.196 -33.624 7.386 1.00 0.00 O ATOM 0 H SER A 108 -0.413 -33.359 3.785 1.00 0.00 H new ATOM 0 HA SER A 108 -0.837 -34.790 6.310 1.00 0.00 H new ATOM 0 HB2 SER A 108 1.459 -34.053 5.390 1.00 0.00 H new ATOM 0 HB3 SER A 108 0.967 -32.408 5.741 1.00 0.00 H new ATOM 0 HG SER A 108 2.135 -33.369 7.499 1.00 0.00 H new ATOM 1601 N SER A 109 -1.792 -32.887 7.725 1.00 0.00 N ATOM 1602 CA SER A 109 -2.654 -31.943 8.428 1.00 0.00 C ATOM 1603 C SER A 109 -1.825 -30.901 9.172 1.00 0.00 C ATOM 1604 O SER A 109 -1.119 -31.220 10.127 1.00 0.00 O ATOM 1605 CB SER A 109 -3.564 -32.683 9.409 1.00 0.00 C ATOM 1606 OG SER A 109 -4.404 -33.602 8.732 1.00 0.00 O ATOM 0 H SER A 109 -1.394 -33.616 8.317 1.00 0.00 H new ATOM 0 HA SER A 109 -3.270 -31.431 7.688 1.00 0.00 H new ATOM 0 HB2 SER A 109 -2.957 -33.213 10.143 1.00 0.00 H new ATOM 0 HB3 SER A 109 -4.173 -31.965 9.957 1.00 0.00 H new ATOM 0 HG SER A 109 -4.975 -34.063 9.382 1.00 0.00 H new ATOM 1612 N GLY A 110 -1.916 -29.652 8.726 1.00 0.00 N ATOM 1613 CA GLY A 110 -1.170 -28.581 9.360 1.00 0.00 C ATOM 1614 C GLY A 110 -2.042 -27.711 10.244 1.00 0.00 C ATOM 1615 O GLY A 110 -1.666 -26.590 10.587 1.00 0.00 O ATOM 0 H GLY A 110 -2.493 -29.363 7.936 1.00 0.00 H new ATOM 0 HA2 GLY A 110 -0.364 -29.008 9.957 1.00 0.00 H new ATOM 0 HA3 GLY A 110 -0.705 -27.963 8.592 1.00 0.00 H new TER 1619 GLY A 110