USER MOD reduce.3.24.130724 H: found=0, std=0, add=1076, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1069 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 100 SER OG : rot -39:sc= 1.2 USER MOD Set 1.2: A 101 THR OG1 : rot 90:sc= 1.23 USER MOD Set 2.1: A 23 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 53 MET CE :methyl -170:sc= -2.64 (180deg=-2.68) USER MOD Single : A 1 SER N :NH3+ 175:sc= -0.042 (180deg=-0.0551) USER MOD Single : A 1 SER OG : rot 180:sc= 0.0223 USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 5 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 ASN : amide:sc= -0.189 X(o=-0.19,f=-0.19) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 11 ASN : amide:sc= -0.17 K(o=-0.17,f=-2.3!) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 158:sc= 1.32 (180deg=1.25) USER MOD Single : A 21 LYS NZ :NH3+ 170:sc= 1.14 (180deg=0.66) USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 THR OG1 : rot 180:sc= -0.17 USER MOD Single : A 30 ASN : amide:sc= -0.0734 K(o=-0.073,f=-1.3!) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 ASN : amide:sc= -0.0932 K(o=-0.093,f=-1.7!) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 ASN : amide:sc= -3.39! C(o=-3.4!,f=-2!) USER MOD Single : A 48 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 SER OG : rot -47:sc= 0.979 USER MOD Single : A 57 THR OG1 : rot -40:sc= 0.0499 USER MOD Single : A 58 LYS NZ :NH3+ 158:sc= 0.105 (180deg=0.082) USER MOD Single : A 60 ASN : amide:sc= -0.124 K(o=-0.12,f=-1.4) USER MOD Single : A 61 MET CE :methyl -155:sc=-0.00457 (180deg=-0.386) USER MOD Single : A 67 ASN : amide:sc= -0.492 K(o=-0.49,f=-1.1) USER MOD Single : A 69 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 70 HIS : no HD1:sc=-0.00408 X(o=-0.0041,f=-0.27) USER MOD Single : A 72 ASN : amide:sc= -0.0089 K(o=-0.0089,f=-0.97) USER MOD Single : A 74 MET CE :methyl -136:sc= 0 (180deg=-0.0258) USER MOD Single : A 78 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0111) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 HIS : no HD1:sc= -0.515 X(o=-0.51,f=-0.16) USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 88 GLN : amide:sc= 0.222 X(o=0.22,f=0) USER MOD Single : A 89 GLN : amide:sc= 0 K(o=0,f=-0.67) USER MOD Single : A 95 HIS : no HD1:sc= -0.11 X(o=-0.11,f=0) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 ASN : amide:sc= 0.333 K(o=0.33,f=-7.7!) USER MOD Single : A 107 LYS NZ :NH3+ 178:sc= 1.53 (180deg=1.49) USER MOD Single : A 111 THR OG1 : rot 93:sc= 1.13 USER MOD Single : A 116 THR OG1 : rot 97:sc= 1.24 USER MOD Single : A 119 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.014) USER MOD Single : A 123 HIS : no HD1:sc= -0.0418 X(o=-0.042,f=0) USER MOD Single : A 124 LYS NZ :NH3+ 157:sc= 1.28 (180deg=0.845) USER MOD Single : A 126 ASN : amide:sc= -0.499 K(o=-0.5,f=-4.2!) USER MOD Single : A 130 SER OG : rot 180:sc= 0 USER MOD Single : A 131 MET CE :methyl -171:sc= -1.96 (180deg=-2.41!) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 10.359 3.342 25.732 1.00 0.00 N ATOM 2 CA SER A 1 9.593 3.528 24.487 1.00 0.00 C ATOM 3 C SER A 1 10.415 3.424 23.205 1.00 0.00 C ATOM 4 O SER A 1 9.843 3.257 22.125 1.00 0.00 O ATOM 5 CB SER A 1 8.815 4.838 24.523 1.00 0.00 C ATOM 6 OG SER A 1 8.145 4.953 25.759 1.00 0.00 O ATOM 0 H1 SER A 1 9.739 3.513 26.550 1.00 0.00 H new ATOM 0 H2 SER A 1 10.725 2.369 25.772 1.00 0.00 H new ATOM 0 H3 SER A 1 11.154 4.012 25.754 1.00 0.00 H new ATOM 0 HA SER A 1 8.900 2.687 24.451 1.00 0.00 H new ATOM 0 HB2 SER A 1 9.493 5.680 24.385 1.00 0.00 H new ATOM 0 HB3 SER A 1 8.097 4.870 23.704 1.00 0.00 H new ATOM 0 HG SER A 1 7.646 5.796 25.783 1.00 0.00 H new ATOM 12 N GLN A 2 11.744 3.456 23.292 1.00 0.00 N ATOM 13 CA GLN A 2 12.670 3.541 22.181 1.00 0.00 C ATOM 14 C GLN A 2 12.331 4.664 21.179 1.00 0.00 C ATOM 15 O GLN A 2 11.539 5.563 21.464 1.00 0.00 O ATOM 16 CB GLN A 2 12.843 2.170 21.508 1.00 0.00 C ATOM 17 CG GLN A 2 12.815 0.939 22.414 1.00 0.00 C ATOM 18 CD GLN A 2 13.129 -0.358 21.667 1.00 0.00 C ATOM 19 OE1 GLN A 2 14.218 -0.560 21.136 1.00 0.00 O ATOM 20 NE2 GLN A 2 12.188 -1.289 21.658 1.00 0.00 N ATOM 0 H GLN A 2 12.222 3.421 24.192 1.00 0.00 H new ATOM 0 HA GLN A 2 13.636 3.829 22.596 1.00 0.00 H new ATOM 0 HB2 GLN A 2 12.056 2.058 20.762 1.00 0.00 H new ATOM 0 HB3 GLN A 2 13.792 2.174 20.972 1.00 0.00 H new ATOM 0 HG2 GLN A 2 13.536 1.071 23.220 1.00 0.00 H new ATOM 0 HG3 GLN A 2 11.831 0.857 22.876 1.00 0.00 H new ATOM 0 HE21 GLN A 2 11.288 -1.109 22.103 1.00 0.00 H new ATOM 0 HE22 GLN A 2 12.363 -2.187 21.207 1.00 0.00 H new ATOM 29 N GLU A 3 12.959 4.628 20.004 1.00 0.00 N ATOM 30 CA GLU A 3 12.787 5.560 18.901 1.00 0.00 C ATOM 31 C GLU A 3 12.230 4.842 17.669 1.00 0.00 C ATOM 32 O GLU A 3 12.566 5.179 16.535 1.00 0.00 O ATOM 33 CB GLU A 3 14.131 6.272 18.674 1.00 0.00 C ATOM 34 CG GLU A 3 14.046 7.782 18.827 1.00 0.00 C ATOM 35 CD GLU A 3 15.427 8.419 18.632 1.00 0.00 C ATOM 36 OE1 GLU A 3 16.118 8.120 17.633 1.00 0.00 O ATOM 37 OE2 GLU A 3 15.868 9.182 19.524 1.00 0.00 O ATOM 0 H GLU A 3 13.642 3.902 19.789 1.00 0.00 H new ATOM 0 HA GLU A 3 12.044 6.324 19.130 1.00 0.00 H new ATOM 0 HB2 GLU A 3 14.864 5.883 19.381 1.00 0.00 H new ATOM 0 HB3 GLU A 3 14.495 6.035 17.674 1.00 0.00 H new ATOM 0 HG2 GLU A 3 13.345 8.189 18.098 1.00 0.00 H new ATOM 0 HG3 GLU A 3 13.659 8.032 19.815 1.00 0.00 H new ATOM 44 N VAL A 4 11.373 3.850 17.910 1.00 0.00 N ATOM 45 CA VAL A 4 10.605 3.123 16.903 1.00 0.00 C ATOM 46 C VAL A 4 9.180 3.040 17.449 1.00 0.00 C ATOM 47 O VAL A 4 8.804 2.082 18.128 1.00 0.00 O ATOM 48 CB VAL A 4 11.252 1.758 16.572 1.00 0.00 C ATOM 49 CG1 VAL A 4 10.394 0.891 15.637 1.00 0.00 C ATOM 50 CG2 VAL A 4 12.617 1.951 15.885 1.00 0.00 C ATOM 0 H VAL A 4 11.188 3.517 18.856 1.00 0.00 H new ATOM 0 HA VAL A 4 10.591 3.631 15.939 1.00 0.00 H new ATOM 0 HB VAL A 4 11.355 1.251 17.531 1.00 0.00 H new ATOM 0 HG11 VAL A 4 10.905 -0.052 15.445 1.00 0.00 H new ATOM 0 HG12 VAL A 4 9.431 0.693 16.107 1.00 0.00 H new ATOM 0 HG13 VAL A 4 10.237 1.417 14.695 1.00 0.00 H new ATOM 0 HG21 VAL A 4 13.053 0.977 15.662 1.00 0.00 H new ATOM 0 HG22 VAL A 4 12.482 2.509 14.959 1.00 0.00 H new ATOM 0 HG23 VAL A 4 13.283 2.503 16.548 1.00 0.00 H new ATOM 60 N MET A 5 8.423 4.111 17.229 1.00 0.00 N ATOM 61 CA MET A 5 7.009 4.242 17.513 1.00 0.00 C ATOM 62 C MET A 5 6.275 5.039 16.431 1.00 0.00 C ATOM 63 O MET A 5 5.159 5.514 16.669 1.00 0.00 O ATOM 64 CB MET A 5 6.864 4.844 18.914 1.00 0.00 C ATOM 65 CG MET A 5 7.113 6.355 18.993 1.00 0.00 C ATOM 66 SD MET A 5 6.868 7.039 20.650 1.00 0.00 S ATOM 67 CE MET A 5 6.885 8.809 20.248 1.00 0.00 C ATOM 0 H MET A 5 8.812 4.961 16.821 1.00 0.00 H new ATOM 0 HA MET A 5 6.530 3.263 17.499 1.00 0.00 H new ATOM 0 HB2 MET A 5 5.859 4.636 19.281 1.00 0.00 H new ATOM 0 HB3 MET A 5 7.560 4.340 19.585 1.00 0.00 H new ATOM 0 HG2 MET A 5 8.132 6.565 18.669 1.00 0.00 H new ATOM 0 HG3 MET A 5 6.446 6.862 18.296 1.00 0.00 H new ATOM 0 HE1 MET A 5 6.746 9.390 21.159 1.00 0.00 H new ATOM 0 HE2 MET A 5 7.841 9.070 19.794 1.00 0.00 H new ATOM 0 HE3 MET A 5 6.079 9.031 19.549 1.00 0.00 H new ATOM 77 N LYS A 6 6.896 5.234 15.264 1.00 0.00 N ATOM 78 CA LYS A 6 6.270 5.925 14.150 1.00 0.00 C ATOM 79 C LYS A 6 5.039 5.148 13.710 1.00 0.00 C ATOM 80 O LYS A 6 4.889 3.951 13.979 1.00 0.00 O ATOM 81 CB LYS A 6 7.229 6.118 12.970 1.00 0.00 C ATOM 82 CG LYS A 6 8.397 7.080 13.255 1.00 0.00 C ATOM 83 CD LYS A 6 8.624 8.031 12.073 1.00 0.00 C ATOM 84 CE LYS A 6 9.823 8.969 12.269 1.00 0.00 C ATOM 85 NZ LYS A 6 9.907 9.968 11.178 1.00 0.00 N ATOM 0 H LYS A 6 7.846 4.915 15.072 1.00 0.00 H new ATOM 0 HA LYS A 6 5.984 6.921 14.488 1.00 0.00 H new ATOM 0 HB2 LYS A 6 7.634 5.148 12.684 1.00 0.00 H new ATOM 0 HB3 LYS A 6 6.665 6.493 12.116 1.00 0.00 H new ATOM 0 HG2 LYS A 6 8.187 7.657 14.156 1.00 0.00 H new ATOM 0 HG3 LYS A 6 9.305 6.509 13.447 1.00 0.00 H new ATOM 0 HD2 LYS A 6 8.775 7.444 11.167 1.00 0.00 H new ATOM 0 HD3 LYS A 6 7.726 8.629 11.919 1.00 0.00 H new ATOM 0 HE2 LYS A 6 9.735 9.480 13.228 1.00 0.00 H new ATOM 0 HE3 LYS A 6 10.743 8.385 12.302 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 10.727 10.588 11.337 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 10.015 9.479 10.267 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 9.038 10.540 11.163 1.00 0.00 H new ATOM 99 N ASN A 7 4.167 5.844 13.005 1.00 0.00 N ATOM 100 CA ASN A 7 2.877 5.361 12.552 1.00 0.00 C ATOM 101 C ASN A 7 2.652 5.910 11.148 1.00 0.00 C ATOM 102 O ASN A 7 3.396 6.791 10.712 1.00 0.00 O ATOM 103 CB ASN A 7 1.802 5.811 13.553 1.00 0.00 C ATOM 104 CG ASN A 7 0.523 5.016 13.371 1.00 0.00 C ATOM 105 OD1 ASN A 7 0.455 3.863 13.776 1.00 0.00 O ATOM 106 ND2 ASN A 7 -0.498 5.591 12.759 1.00 0.00 N ATOM 0 H ASN A 7 4.348 6.806 12.720 1.00 0.00 H new ATOM 0 HA ASN A 7 2.830 4.273 12.505 1.00 0.00 H new ATOM 0 HB2 ASN A 7 2.172 5.684 14.571 1.00 0.00 H new ATOM 0 HB3 ASN A 7 1.597 6.873 13.419 1.00 0.00 H new ATOM 0 HD21 ASN A 7 -1.365 5.073 12.616 1.00 0.00 H new ATOM 0 HD22 ASN A 7 -0.419 6.553 12.430 1.00 0.00 H new ATOM 113 N LEU A 8 1.639 5.410 10.447 1.00 0.00 N ATOM 114 CA LEU A 8 1.351 5.732 9.054 1.00 0.00 C ATOM 115 C LEU A 8 1.301 7.251 8.819 1.00 0.00 C ATOM 116 O LEU A 8 0.448 7.941 9.384 1.00 0.00 O ATOM 117 CB LEU A 8 0.059 4.981 8.694 1.00 0.00 C ATOM 118 CG LEU A 8 -0.532 5.226 7.307 1.00 0.00 C ATOM 119 CD1 LEU A 8 -1.366 6.503 7.287 1.00 0.00 C ATOM 120 CD2 LEU A 8 0.538 5.208 6.211 1.00 0.00 C ATOM 0 H LEU A 8 0.974 4.748 10.847 1.00 0.00 H new ATOM 0 HA LEU A 8 2.147 5.404 8.385 1.00 0.00 H new ATOM 0 HB2 LEU A 8 0.251 3.913 8.795 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -0.699 5.240 9.434 1.00 0.00 H new ATOM 0 HG LEU A 8 -1.203 4.397 7.083 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -1.775 6.655 6.288 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -2.182 6.416 8.004 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -0.737 7.352 7.554 1.00 0.00 H new ATOM 0 HD21 LEU A 8 0.070 5.387 5.243 1.00 0.00 H new ATOM 0 HD22 LEU A 8 1.274 5.988 6.408 1.00 0.00 H new ATOM 0 HD23 LEU A 8 1.033 4.237 6.201 1.00 0.00 H new ATOM 132 N SER A 9 2.223 7.775 8.009 1.00 0.00 N ATOM 133 CA SER A 9 2.408 9.204 7.739 1.00 0.00 C ATOM 134 C SER A 9 1.742 9.671 6.433 1.00 0.00 C ATOM 135 O SER A 9 1.540 10.873 6.227 1.00 0.00 O ATOM 136 CB SER A 9 3.918 9.486 7.680 1.00 0.00 C ATOM 137 OG SER A 9 4.312 10.411 8.673 1.00 0.00 O ATOM 0 H SER A 9 2.889 7.192 7.502 1.00 0.00 H new ATOM 0 HA SER A 9 1.925 9.761 8.542 1.00 0.00 H new ATOM 0 HB2 SER A 9 4.468 8.554 7.810 1.00 0.00 H new ATOM 0 HB3 SER A 9 4.178 9.875 6.696 1.00 0.00 H new ATOM 0 HG SER A 9 5.277 10.567 8.610 1.00 0.00 H new ATOM 143 N LEU A 10 1.442 8.750 5.516 1.00 0.00 N ATOM 144 CA LEU A 10 0.758 9.041 4.265 1.00 0.00 C ATOM 145 C LEU A 10 -0.713 9.412 4.509 1.00 0.00 C ATOM 146 O LEU A 10 -1.301 8.995 5.507 1.00 0.00 O ATOM 147 CB LEU A 10 0.881 7.853 3.295 1.00 0.00 C ATOM 148 CG LEU A 10 2.183 7.694 2.468 1.00 0.00 C ATOM 149 CD1 LEU A 10 2.036 6.617 1.387 1.00 0.00 C ATOM 150 CD2 LEU A 10 2.618 9.030 1.843 1.00 0.00 C ATOM 0 H LEU A 10 1.674 7.763 5.629 1.00 0.00 H new ATOM 0 HA LEU A 10 1.239 9.905 3.806 1.00 0.00 H new ATOM 0 HB2 LEU A 10 0.744 6.939 3.874 1.00 0.00 H new ATOM 0 HB3 LEU A 10 0.050 7.913 2.593 1.00 0.00 H new ATOM 0 HG LEU A 10 2.963 7.373 3.159 1.00 0.00 H new ATOM 0 HD11 LEU A 10 2.968 6.533 0.828 1.00 0.00 H new ATOM 0 HD12 LEU A 10 1.807 5.660 1.856 1.00 0.00 H new ATOM 0 HD13 LEU A 10 1.228 6.891 0.708 1.00 0.00 H new ATOM 0 HD21 LEU A 10 3.534 8.883 1.270 1.00 0.00 H new ATOM 0 HD22 LEU A 10 1.832 9.396 1.183 1.00 0.00 H new ATOM 0 HD23 LEU A 10 2.797 9.760 2.633 1.00 0.00 H new ATOM 162 N ASN A 11 -1.338 10.151 3.588 1.00 0.00 N ATOM 163 CA ASN A 11 -2.708 10.647 3.740 1.00 0.00 C ATOM 164 C ASN A 11 -3.717 9.604 3.261 1.00 0.00 C ATOM 165 O ASN A 11 -4.424 9.777 2.263 1.00 0.00 O ATOM 166 CB ASN A 11 -2.904 11.967 2.999 1.00 0.00 C ATOM 167 CG ASN A 11 -4.207 12.646 3.414 1.00 0.00 C ATOM 168 OD1 ASN A 11 -5.068 12.078 4.086 1.00 0.00 O ATOM 169 ND2 ASN A 11 -4.382 13.892 3.024 1.00 0.00 N ATOM 0 H ASN A 11 -0.902 10.424 2.707 1.00 0.00 H new ATOM 0 HA ASN A 11 -2.880 10.831 4.801 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -2.064 12.630 3.204 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -2.912 11.786 1.924 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -5.234 14.391 3.279 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -3.665 14.358 2.467 1.00 0.00 H new ATOM 176 N PHE A 12 -3.747 8.463 3.939 1.00 0.00 N ATOM 177 CA PHE A 12 -4.646 7.389 3.580 1.00 0.00 C ATOM 178 C PHE A 12 -6.101 7.723 3.882 1.00 0.00 C ATOM 179 O PHE A 12 -6.952 7.324 3.093 1.00 0.00 O ATOM 180 CB PHE A 12 -4.190 6.098 4.244 1.00 0.00 C ATOM 181 CG PHE A 12 -3.143 5.420 3.395 1.00 0.00 C ATOM 182 CD1 PHE A 12 -3.560 4.685 2.274 1.00 0.00 C ATOM 183 CD2 PHE A 12 -1.774 5.625 3.632 1.00 0.00 C ATOM 184 CE1 PHE A 12 -2.605 4.157 1.393 1.00 0.00 C ATOM 185 CE2 PHE A 12 -0.818 5.061 2.770 1.00 0.00 C ATOM 186 CZ PHE A 12 -1.237 4.348 1.643 1.00 0.00 C ATOM 0 H PHE A 12 -3.153 8.263 4.744 1.00 0.00 H new ATOM 0 HA PHE A 12 -4.605 7.250 2.500 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -3.785 6.312 5.233 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -5.041 5.432 4.386 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -4.612 4.527 2.091 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -1.456 6.217 4.478 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -2.922 3.603 0.522 1.00 0.00 H new ATOM 0 HE2 PHE A 12 0.235 5.178 2.977 1.00 0.00 H new ATOM 0 HZ PHE A 12 -0.504 3.942 0.961 1.00 0.00 H new ATOM 196 N GLY A 13 -6.406 8.474 4.946 1.00 0.00 N ATOM 197 CA GLY A 13 -7.784 8.754 5.346 1.00 0.00 C ATOM 198 C GLY A 13 -8.593 9.372 4.207 1.00 0.00 C ATOM 199 O GLY A 13 -9.650 8.865 3.837 1.00 0.00 O ATOM 0 H GLY A 13 -5.705 8.902 5.551 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -8.262 7.830 5.672 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -7.784 9.431 6.200 1.00 0.00 H new ATOM 203 N LYS A 14 -8.100 10.450 3.592 1.00 0.00 N ATOM 204 CA LYS A 14 -8.760 11.068 2.440 1.00 0.00 C ATOM 205 C LYS A 14 -8.831 10.102 1.262 1.00 0.00 C ATOM 206 O LYS A 14 -9.898 9.948 0.683 1.00 0.00 O ATOM 207 CB LYS A 14 -7.995 12.334 2.026 1.00 0.00 C ATOM 208 CG LYS A 14 -8.434 13.617 2.757 1.00 0.00 C ATOM 209 CD LYS A 14 -9.572 14.379 2.056 1.00 0.00 C ATOM 210 CE LYS A 14 -9.127 14.897 0.677 1.00 0.00 C ATOM 211 NZ LYS A 14 -10.051 15.897 0.103 1.00 0.00 N ATOM 0 H LYS A 14 -7.238 10.916 3.876 1.00 0.00 H new ATOM 0 HA LYS A 14 -9.778 11.329 2.728 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -6.932 12.175 2.206 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -8.118 12.483 0.953 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -8.753 13.357 3.766 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -7.574 14.279 2.855 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -10.435 13.723 1.940 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -9.889 15.217 2.677 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -8.134 15.338 0.765 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -9.042 14.055 -0.010 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -9.696 16.206 -0.824 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -10.994 15.473 -0.011 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -10.115 16.717 0.740 1.00 0.00 H new ATOM 225 N ALA A 15 -7.716 9.486 0.867 1.00 0.00 N ATOM 226 CA ALA A 15 -7.688 8.604 -0.297 1.00 0.00 C ATOM 227 C ALA A 15 -8.683 7.442 -0.146 1.00 0.00 C ATOM 228 O ALA A 15 -9.400 7.126 -1.094 1.00 0.00 O ATOM 229 CB ALA A 15 -6.264 8.082 -0.471 1.00 0.00 C ATOM 0 H ALA A 15 -6.817 9.583 1.340 1.00 0.00 H new ATOM 0 HA ALA A 15 -7.990 9.164 -1.182 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -6.222 7.421 -1.336 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -5.585 8.921 -0.622 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -5.967 7.531 0.421 1.00 0.00 H new ATOM 235 N LEU A 16 -8.754 6.825 1.040 1.00 0.00 N ATOM 236 CA LEU A 16 -9.726 5.789 1.388 1.00 0.00 C ATOM 237 C LEU A 16 -11.130 6.371 1.313 1.00 0.00 C ATOM 238 O LEU A 16 -11.977 5.760 0.673 1.00 0.00 O ATOM 239 CB LEU A 16 -9.467 5.220 2.797 1.00 0.00 C ATOM 240 CG LEU A 16 -8.339 4.172 2.806 1.00 0.00 C ATOM 241 CD1 LEU A 16 -7.713 4.011 4.184 1.00 0.00 C ATOM 242 CD2 LEU A 16 -8.826 2.766 2.443 1.00 0.00 C ATOM 0 H LEU A 16 -8.116 7.042 1.805 1.00 0.00 H new ATOM 0 HA LEU A 16 -9.624 4.970 0.676 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -9.208 6.035 3.473 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -10.383 4.768 3.178 1.00 0.00 H new ATOM 0 HG LEU A 16 -7.630 4.553 2.071 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -6.923 3.261 4.139 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -7.292 4.963 4.506 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -8.475 3.693 4.895 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -7.985 2.072 2.467 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -9.581 2.446 3.161 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -9.259 2.778 1.443 1.00 0.00 H new ATOM 254 N ASP A 17 -11.371 7.550 1.894 1.00 0.00 N ATOM 255 CA ASP A 17 -12.683 8.200 1.883 1.00 0.00 C ATOM 256 C ASP A 17 -13.169 8.496 0.470 1.00 0.00 C ATOM 257 O ASP A 17 -14.369 8.491 0.224 1.00 0.00 O ATOM 258 CB ASP A 17 -12.664 9.543 2.619 1.00 0.00 C ATOM 259 CG ASP A 17 -14.092 10.089 2.720 1.00 0.00 C ATOM 260 OD1 ASP A 17 -14.964 9.460 3.361 1.00 0.00 O ATOM 261 OD2 ASP A 17 -14.355 11.180 2.170 1.00 0.00 O ATOM 0 H ASP A 17 -10.656 8.083 2.388 1.00 0.00 H new ATOM 0 HA ASP A 17 -13.348 7.493 2.379 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -12.239 9.418 3.615 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -12.029 10.252 2.088 1.00 0.00 H new ATOM 266 N GLU A 18 -12.267 8.732 -0.481 1.00 0.00 N ATOM 267 CA GLU A 18 -12.672 8.975 -1.858 1.00 0.00 C ATOM 268 C GLU A 18 -12.849 7.648 -2.591 1.00 0.00 C ATOM 269 O GLU A 18 -13.843 7.461 -3.295 1.00 0.00 O ATOM 270 CB GLU A 18 -11.680 9.898 -2.584 1.00 0.00 C ATOM 271 CG GLU A 18 -11.397 11.226 -1.856 1.00 0.00 C ATOM 272 CD GLU A 18 -11.648 12.459 -2.724 1.00 0.00 C ATOM 273 OE1 GLU A 18 -10.990 12.619 -3.779 1.00 0.00 O ATOM 274 OE2 GLU A 18 -12.539 13.267 -2.372 1.00 0.00 O ATOM 0 H GLU A 18 -11.260 8.759 -0.322 1.00 0.00 H new ATOM 0 HA GLU A 18 -13.631 9.493 -1.850 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -10.739 9.365 -2.720 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -12.068 10.118 -3.578 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -12.023 11.284 -0.965 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -10.361 11.233 -1.518 1.00 0.00 H new ATOM 281 N CYS A 19 -11.939 6.693 -2.389 1.00 0.00 N ATOM 282 CA CYS A 19 -11.996 5.378 -3.011 1.00 0.00 C ATOM 283 C CYS A 19 -13.248 4.612 -2.594 1.00 0.00 C ATOM 284 O CYS A 19 -13.932 4.018 -3.428 1.00 0.00 O ATOM 285 CB CYS A 19 -10.794 4.547 -2.590 1.00 0.00 C ATOM 286 SG CYS A 19 -10.849 2.925 -3.392 1.00 0.00 S ATOM 0 H CYS A 19 -11.131 6.818 -1.779 1.00 0.00 H new ATOM 0 HA CYS A 19 -12.006 5.538 -4.089 1.00 0.00 H new ATOM 0 HB2 CYS A 19 -9.873 5.063 -2.859 1.00 0.00 H new ATOM 0 HB3 CYS A 19 -10.787 4.426 -1.507 1.00 0.00 H new ATOM 291 N LYS A 20 -13.568 4.618 -1.301 1.00 0.00 N ATOM 292 CA LYS A 20 -14.761 3.973 -0.767 1.00 0.00 C ATOM 293 C LYS A 20 -16.015 4.555 -1.408 1.00 0.00 C ATOM 294 O LYS A 20 -17.057 3.916 -1.342 1.00 0.00 O ATOM 295 CB LYS A 20 -14.780 4.034 0.778 1.00 0.00 C ATOM 296 CG LYS A 20 -15.080 5.413 1.382 1.00 0.00 C ATOM 297 CD LYS A 20 -16.560 5.744 1.620 1.00 0.00 C ATOM 298 CE LYS A 20 -17.105 4.978 2.834 1.00 0.00 C ATOM 299 NZ LYS A 20 -17.170 5.818 4.049 1.00 0.00 N ATOM 0 H LYS A 20 -12.999 5.076 -0.589 1.00 0.00 H new ATOM 0 HA LYS A 20 -14.741 2.915 -1.027 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -15.525 3.327 1.143 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -13.812 3.697 1.149 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -14.555 5.491 2.334 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -14.661 6.174 0.723 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -16.676 6.816 1.780 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -17.141 5.489 0.734 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -18.101 4.599 2.604 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -16.472 4.112 3.028 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -17.859 5.413 4.714 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -16.233 5.851 4.499 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -17.464 6.781 3.790 1.00 0.00 H new ATOM 313 N LYS A 21 -15.967 5.744 -2.019 1.00 0.00 N ATOM 314 CA LYS A 21 -17.089 6.315 -2.745 1.00 0.00 C ATOM 315 C LYS A 21 -17.038 5.958 -4.234 1.00 0.00 C ATOM 316 O LYS A 21 -18.084 5.912 -4.874 1.00 0.00 O ATOM 317 CB LYS A 21 -17.117 7.831 -2.498 1.00 0.00 C ATOM 318 CG LYS A 21 -17.262 8.090 -0.989 1.00 0.00 C ATOM 319 CD LYS A 21 -17.242 9.562 -0.569 1.00 0.00 C ATOM 320 CE LYS A 21 -17.292 9.551 0.964 1.00 0.00 C ATOM 321 NZ LYS A 21 -17.013 10.853 1.590 1.00 0.00 N ATOM 0 H LYS A 21 -15.137 6.337 -2.019 1.00 0.00 H new ATOM 0 HA LYS A 21 -18.021 5.888 -2.376 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -16.202 8.290 -2.873 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -17.947 8.285 -3.039 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -18.198 7.646 -0.650 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -16.456 7.571 -0.470 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -16.342 10.061 -0.929 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -18.093 10.101 -0.986 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -18.279 9.213 1.281 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -16.571 8.822 1.334 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -17.231 10.804 2.606 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -16.009 11.092 1.462 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -17.602 11.585 1.145 1.00 0.00 H new ATOM 335 N GLU A 22 -15.846 5.720 -4.793 1.00 0.00 N ATOM 336 CA GLU A 22 -15.671 5.205 -6.153 1.00 0.00 C ATOM 337 C GLU A 22 -16.151 3.764 -6.265 1.00 0.00 C ATOM 338 O GLU A 22 -17.081 3.491 -7.020 1.00 0.00 O ATOM 339 CB GLU A 22 -14.219 5.304 -6.636 1.00 0.00 C ATOM 340 CG GLU A 22 -13.829 6.758 -6.882 1.00 0.00 C ATOM 341 CD GLU A 22 -12.497 6.851 -7.619 1.00 0.00 C ATOM 342 OE1 GLU A 22 -11.446 6.973 -6.955 1.00 0.00 O ATOM 343 OE2 GLU A 22 -12.470 6.994 -8.857 1.00 0.00 O ATOM 0 H GLU A 22 -14.965 5.882 -4.306 1.00 0.00 H new ATOM 0 HA GLU A 22 -16.282 5.837 -6.797 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -13.553 4.865 -5.893 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -14.096 4.729 -7.554 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -14.606 7.253 -7.465 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -13.760 7.285 -5.931 1.00 0.00 H new ATOM 350 N MET A 23 -15.527 2.823 -5.548 1.00 0.00 N ATOM 351 CA MET A 23 -15.860 1.408 -5.697 1.00 0.00 C ATOM 352 C MET A 23 -17.148 1.065 -4.962 1.00 0.00 C ATOM 353 O MET A 23 -17.716 -0.007 -5.183 1.00 0.00 O ATOM 354 CB MET A 23 -14.736 0.467 -5.227 1.00 0.00 C ATOM 355 CG MET A 23 -13.316 1.031 -5.122 1.00 0.00 C ATOM 356 SD MET A 23 -12.008 -0.222 -5.162 1.00 0.00 S ATOM 357 CE MET A 23 -11.891 -0.534 -6.943 1.00 0.00 C ATOM 0 H MET A 23 -14.795 3.016 -4.865 1.00 0.00 H new ATOM 0 HA MET A 23 -15.994 1.250 -6.767 1.00 0.00 H new ATOM 0 HB2 MET A 23 -15.014 0.080 -4.247 1.00 0.00 H new ATOM 0 HB3 MET A 23 -14.707 -0.383 -5.908 1.00 0.00 H new ATOM 0 HG2 MET A 23 -13.155 1.733 -5.941 1.00 0.00 H new ATOM 0 HG3 MET A 23 -13.231 1.598 -4.195 1.00 0.00 H new ATOM 0 HE1 MET A 23 -11.125 -1.286 -7.131 1.00 0.00 H new ATOM 0 HE2 MET A 23 -12.851 -0.893 -7.313 1.00 0.00 H new ATOM 0 HE3 MET A 23 -11.626 0.390 -7.458 1.00 0.00 H new ATOM 367 N THR A 24 -17.592 1.957 -4.080 1.00 0.00 N ATOM 368 CA THR A 24 -18.562 1.691 -3.040 1.00 0.00 C ATOM 369 C THR A 24 -18.144 0.441 -2.269 1.00 0.00 C ATOM 370 O THR A 24 -18.847 -0.567 -2.210 1.00 0.00 O ATOM 371 CB THR A 24 -19.984 1.757 -3.594 1.00 0.00 C ATOM 372 OG1 THR A 24 -20.098 3.002 -4.248 1.00 0.00 O ATOM 373 CG2 THR A 24 -21.002 1.750 -2.459 1.00 0.00 C ATOM 0 H THR A 24 -17.267 2.924 -4.077 1.00 0.00 H new ATOM 0 HA THR A 24 -18.580 2.471 -2.279 1.00 0.00 H new ATOM 0 HB THR A 24 -20.170 0.906 -4.250 1.00 0.00 H new ATOM 0 HG1 THR A 24 -20.998 3.092 -4.625 1.00 0.00 H new ATOM 0 HG21 THR A 24 -22.009 1.798 -2.873 1.00 0.00 H new ATOM 0 HG22 THR A 24 -20.892 0.835 -1.877 1.00 0.00 H new ATOM 0 HG23 THR A 24 -20.834 2.613 -1.814 1.00 0.00 H new ATOM 381 N LEU A 25 -16.956 0.527 -1.661 1.00 0.00 N ATOM 382 CA LEU A 25 -16.510 -0.450 -0.669 1.00 0.00 C ATOM 383 C LEU A 25 -17.295 -0.201 0.620 1.00 0.00 C ATOM 384 O LEU A 25 -18.047 0.775 0.725 1.00 0.00 O ATOM 385 CB LEU A 25 -14.996 -0.357 -0.373 1.00 0.00 C ATOM 386 CG LEU A 25 -14.043 -0.351 -1.589 1.00 0.00 C ATOM 387 CD1 LEU A 25 -12.589 -0.165 -1.132 1.00 0.00 C ATOM 388 CD2 LEU A 25 -14.121 -1.653 -2.399 1.00 0.00 C ATOM 0 H LEU A 25 -16.283 1.271 -1.843 1.00 0.00 H new ATOM 0 HA LEU A 25 -16.691 -1.448 -1.067 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -14.818 0.552 0.201 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -14.724 -1.196 0.267 1.00 0.00 H new ATOM 0 HG LEU A 25 -14.360 0.478 -2.221 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -11.932 -0.163 -2.002 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -12.493 0.783 -0.602 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -12.309 -0.982 -0.467 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -13.433 -1.599 -3.242 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -13.849 -2.495 -1.762 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -15.137 -1.791 -2.768 1.00 0.00 H new ATOM 400 N THR A 26 -17.095 -1.067 1.604 1.00 0.00 N ATOM 401 CA THR A 26 -17.755 -1.009 2.896 1.00 0.00 C ATOM 402 C THR A 26 -17.307 0.238 3.667 1.00 0.00 C ATOM 403 O THR A 26 -16.268 0.821 3.364 1.00 0.00 O ATOM 404 CB THR A 26 -17.448 -2.325 3.640 1.00 0.00 C ATOM 405 OG1 THR A 26 -16.135 -2.787 3.375 1.00 0.00 O ATOM 406 CG2 THR A 26 -18.408 -3.413 3.167 1.00 0.00 C ATOM 0 H THR A 26 -16.449 -1.852 1.520 1.00 0.00 H new ATOM 0 HA THR A 26 -18.836 -0.918 2.787 1.00 0.00 H new ATOM 0 HB THR A 26 -17.555 -2.123 4.706 1.00 0.00 H new ATOM 0 HG1 THR A 26 -15.977 -3.621 3.865 1.00 0.00 H new ATOM 0 HG21 THR A 26 -18.191 -4.343 3.693 1.00 0.00 H new ATOM 0 HG22 THR A 26 -19.434 -3.109 3.375 1.00 0.00 H new ATOM 0 HG23 THR A 26 -18.286 -3.565 2.095 1.00 0.00 H new ATOM 414 N ASP A 27 -18.064 0.650 4.690 1.00 0.00 N ATOM 415 CA ASP A 27 -17.635 1.775 5.523 1.00 0.00 C ATOM 416 C ASP A 27 -16.449 1.382 6.408 1.00 0.00 C ATOM 417 O ASP A 27 -15.552 2.184 6.676 1.00 0.00 O ATOM 418 CB ASP A 27 -18.782 2.278 6.400 1.00 0.00 C ATOM 419 CG ASP A 27 -18.371 3.629 6.971 1.00 0.00 C ATOM 420 OD1 ASP A 27 -18.284 4.589 6.178 1.00 0.00 O ATOM 421 OD2 ASP A 27 -18.063 3.752 8.175 1.00 0.00 O ATOM 0 H ASP A 27 -18.956 0.232 4.956 1.00 0.00 H new ATOM 0 HA ASP A 27 -17.326 2.576 4.852 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -19.697 2.372 5.816 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -18.988 1.570 7.203 1.00 0.00 H new ATOM 426 N ALA A 28 -16.439 0.116 6.829 1.00 0.00 N ATOM 427 CA ALA A 28 -15.491 -0.464 7.763 1.00 0.00 C ATOM 428 C ALA A 28 -14.068 -0.564 7.205 1.00 0.00 C ATOM 429 O ALA A 28 -13.155 -0.832 7.988 1.00 0.00 O ATOM 430 CB ALA A 28 -16.025 -1.842 8.175 1.00 0.00 C ATOM 0 H ALA A 28 -17.130 -0.562 6.507 1.00 0.00 H new ATOM 0 HA ALA A 28 -15.407 0.195 8.627 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -15.333 -2.305 8.879 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -17.001 -1.728 8.648 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -16.121 -2.474 7.292 1.00 0.00 H new ATOM 436 N ILE A 29 -13.867 -0.363 5.897 1.00 0.00 N ATOM 437 CA ILE A 29 -12.546 -0.202 5.294 1.00 0.00 C ATOM 438 C ILE A 29 -11.677 0.771 6.086 1.00 0.00 C ATOM 439 O ILE A 29 -10.465 0.583 6.144 1.00 0.00 O ATOM 440 CB ILE A 29 -12.637 0.068 3.773 1.00 0.00 C ATOM 441 CG1 ILE A 29 -13.276 1.428 3.417 1.00 0.00 C ATOM 442 CG2 ILE A 29 -13.394 -1.064 3.055 1.00 0.00 C ATOM 443 CD1 ILE A 29 -12.179 2.473 3.331 1.00 0.00 C ATOM 0 H ILE A 29 -14.630 -0.307 5.222 1.00 0.00 H new ATOM 0 HA ILE A 29 -12.014 -1.151 5.363 1.00 0.00 H new ATOM 0 HB ILE A 29 -11.605 0.103 3.424 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -13.807 1.359 2.468 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -14.009 1.711 4.173 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -13.443 -0.849 1.988 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -12.871 -2.008 3.211 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -14.404 -1.138 3.457 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -12.616 3.439 3.080 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -11.668 2.544 4.291 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -11.464 2.187 2.560 1.00 0.00 H new ATOM 455 N ASN A 30 -12.296 1.805 6.656 1.00 0.00 N ATOM 456 CA ASN A 30 -11.648 2.876 7.388 1.00 0.00 C ATOM 457 C ASN A 30 -10.662 2.366 8.426 1.00 0.00 C ATOM 458 O ASN A 30 -9.613 2.984 8.594 1.00 0.00 O ATOM 459 CB ASN A 30 -12.747 3.723 8.025 1.00 0.00 C ATOM 460 CG ASN A 30 -12.281 5.032 8.651 1.00 0.00 C ATOM 461 OD1 ASN A 30 -11.411 5.066 9.513 1.00 0.00 O ATOM 462 ND2 ASN A 30 -12.939 6.132 8.319 1.00 0.00 N ATOM 0 H ASN A 30 -13.309 1.917 6.614 1.00 0.00 H new ATOM 0 HA ASN A 30 -11.050 3.475 6.701 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -13.495 3.949 7.265 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -13.242 3.128 8.793 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -12.723 7.015 8.782 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -13.662 6.096 7.600 1.00 0.00 H new ATOM 469 N GLU A 31 -11.016 1.284 9.124 1.00 0.00 N ATOM 470 CA GLU A 31 -10.153 0.663 10.123 1.00 0.00 C ATOM 471 C GLU A 31 -9.687 -0.723 9.705 1.00 0.00 C ATOM 472 O GLU A 31 -8.591 -1.091 10.105 1.00 0.00 O ATOM 473 CB GLU A 31 -10.824 0.606 11.500 1.00 0.00 C ATOM 474 CG GLU A 31 -11.232 2.009 11.963 1.00 0.00 C ATOM 475 CD GLU A 31 -11.434 2.161 13.471 1.00 0.00 C ATOM 476 OE1 GLU A 31 -12.066 1.280 14.098 1.00 0.00 O ATOM 477 OE2 GLU A 31 -10.941 3.179 14.021 1.00 0.00 O ATOM 0 H GLU A 31 -11.914 0.814 9.009 1.00 0.00 H new ATOM 0 HA GLU A 31 -9.272 1.300 10.198 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -11.703 -0.037 11.455 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -10.141 0.163 12.225 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -10.469 2.717 11.641 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -12.157 2.287 11.458 1.00 0.00 H new ATOM 484 N ASP A 32 -10.432 -1.469 8.880 1.00 0.00 N ATOM 485 CA ASP A 32 -10.019 -2.796 8.391 1.00 0.00 C ATOM 486 C ASP A 32 -8.664 -2.692 7.705 1.00 0.00 C ATOM 487 O ASP A 32 -7.789 -3.539 7.878 1.00 0.00 O ATOM 488 CB ASP A 32 -11.000 -3.379 7.356 1.00 0.00 C ATOM 489 CG ASP A 32 -12.232 -4.082 7.915 1.00 0.00 C ATOM 490 OD1 ASP A 32 -12.297 -4.327 9.136 1.00 0.00 O ATOM 491 OD2 ASP A 32 -13.109 -4.454 7.097 1.00 0.00 O ATOM 0 H ASP A 32 -11.342 -1.171 8.530 1.00 0.00 H new ATOM 0 HA ASP A 32 -9.989 -3.448 9.264 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -11.333 -2.570 6.706 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -10.457 -4.087 6.730 1.00 0.00 H new ATOM 496 N PHE A 33 -8.494 -1.627 6.921 1.00 0.00 N ATOM 497 CA PHE A 33 -7.284 -1.356 6.175 1.00 0.00 C ATOM 498 C PHE A 33 -6.082 -1.204 7.100 1.00 0.00 C ATOM 499 O PHE A 33 -5.027 -1.752 6.800 1.00 0.00 O ATOM 500 CB PHE A 33 -7.524 -0.100 5.332 1.00 0.00 C ATOM 501 CG PHE A 33 -6.446 0.218 4.322 1.00 0.00 C ATOM 502 CD1 PHE A 33 -6.400 -0.472 3.099 1.00 0.00 C ATOM 503 CD2 PHE A 33 -5.505 1.228 4.585 1.00 0.00 C ATOM 504 CE1 PHE A 33 -5.416 -0.156 2.147 1.00 0.00 C ATOM 505 CE2 PHE A 33 -4.546 1.569 3.615 1.00 0.00 C ATOM 506 CZ PHE A 33 -4.485 0.861 2.406 1.00 0.00 C ATOM 0 H PHE A 33 -9.216 -0.918 6.790 1.00 0.00 H new ATOM 0 HA PHE A 33 -7.050 -2.195 5.520 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -8.471 -0.213 4.804 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -7.632 0.752 6.003 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -7.123 -1.247 2.890 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -5.518 1.743 5.534 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -5.376 -0.697 1.213 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -3.855 2.378 3.801 1.00 0.00 H new ATOM 0 HZ PHE A 33 -3.724 1.098 1.677 1.00 0.00 H new ATOM 516 N TYR A 34 -6.247 -0.473 8.202 1.00 0.00 N ATOM 517 CA TYR A 34 -5.197 -0.232 9.185 1.00 0.00 C ATOM 518 C TYR A 34 -4.974 -1.496 10.029 1.00 0.00 C ATOM 519 O TYR A 34 -3.836 -1.889 10.285 1.00 0.00 O ATOM 520 CB TYR A 34 -5.560 0.977 10.065 1.00 0.00 C ATOM 521 CG TYR A 34 -5.546 2.331 9.359 1.00 0.00 C ATOM 522 CD1 TYR A 34 -6.497 2.635 8.367 1.00 0.00 C ATOM 523 CD2 TYR A 34 -4.581 3.300 9.697 1.00 0.00 C ATOM 524 CE1 TYR A 34 -6.502 3.888 7.734 1.00 0.00 C ATOM 525 CE2 TYR A 34 -4.559 4.553 9.053 1.00 0.00 C ATOM 526 CZ TYR A 34 -5.555 4.867 8.101 1.00 0.00 C ATOM 527 OH TYR A 34 -5.638 6.120 7.574 1.00 0.00 O ATOM 0 H TYR A 34 -7.132 -0.024 8.439 1.00 0.00 H new ATOM 0 HA TYR A 34 -4.265 0.001 8.671 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -6.554 0.815 10.483 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -4.864 1.016 10.903 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -7.233 1.895 8.089 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -3.849 3.080 10.460 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -7.231 4.102 6.966 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -3.785 5.270 9.286 1.00 0.00 H new ATOM 0 HH TYR A 34 -4.912 6.673 7.930 1.00 0.00 H new ATOM 537 N ASN A 35 -6.062 -2.152 10.446 1.00 0.00 N ATOM 538 CA ASN A 35 -6.059 -3.359 11.267 1.00 0.00 C ATOM 539 C ASN A 35 -5.284 -4.475 10.594 1.00 0.00 C ATOM 540 O ASN A 35 -4.590 -5.213 11.285 1.00 0.00 O ATOM 541 CB ASN A 35 -7.486 -3.878 11.524 1.00 0.00 C ATOM 542 CG ASN A 35 -8.178 -3.246 12.719 1.00 0.00 C ATOM 543 OD1 ASN A 35 -7.545 -2.593 13.551 1.00 0.00 O ATOM 544 ND2 ASN A 35 -9.477 -3.458 12.838 1.00 0.00 N ATOM 0 H ASN A 35 -7.004 -1.841 10.209 1.00 0.00 H new ATOM 0 HA ASN A 35 -5.589 -3.082 12.211 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -8.090 -3.700 10.634 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -7.446 -4.957 11.672 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -9.985 -3.077 13.636 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -9.972 -4.003 12.132 1.00 0.00 H new ATOM 551 N PHE A 36 -5.385 -4.613 9.268 1.00 0.00 N ATOM 552 CA PHE A 36 -4.699 -5.672 8.538 1.00 0.00 C ATOM 553 C PHE A 36 -3.196 -5.688 8.849 1.00 0.00 C ATOM 554 O PHE A 36 -2.591 -6.757 8.870 1.00 0.00 O ATOM 555 CB PHE A 36 -4.908 -5.469 7.022 1.00 0.00 C ATOM 556 CG PHE A 36 -4.067 -6.341 6.091 1.00 0.00 C ATOM 557 CD1 PHE A 36 -3.927 -7.729 6.302 1.00 0.00 C ATOM 558 CD2 PHE A 36 -3.397 -5.751 5.001 1.00 0.00 C ATOM 559 CE1 PHE A 36 -3.122 -8.505 5.444 1.00 0.00 C ATOM 560 CE2 PHE A 36 -2.596 -6.528 4.143 1.00 0.00 C ATOM 561 CZ PHE A 36 -2.458 -7.909 4.360 1.00 0.00 C ATOM 0 H PHE A 36 -5.942 -3.995 8.678 1.00 0.00 H new ATOM 0 HA PHE A 36 -5.120 -6.627 8.852 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -5.960 -5.646 6.797 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -4.703 -4.424 6.787 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -4.440 -8.200 7.127 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -3.499 -4.691 4.822 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -3.015 -9.565 5.622 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -2.085 -6.060 3.314 1.00 0.00 H new ATOM 0 HZ PHE A 36 -1.847 -8.506 3.699 1.00 0.00 H new ATOM 571 N TRP A 37 -2.576 -4.523 9.061 1.00 0.00 N ATOM 572 CA TRP A 37 -1.138 -4.421 9.286 1.00 0.00 C ATOM 573 C TRP A 37 -0.719 -4.971 10.642 1.00 0.00 C ATOM 574 O TRP A 37 0.470 -5.207 10.864 1.00 0.00 O ATOM 575 CB TRP A 37 -0.723 -2.950 9.240 1.00 0.00 C ATOM 576 CG TRP A 37 -1.255 -2.142 8.104 1.00 0.00 C ATOM 577 CD1 TRP A 37 -1.541 -2.596 6.862 1.00 0.00 C ATOM 578 CD2 TRP A 37 -1.595 -0.728 8.110 1.00 0.00 C ATOM 579 NE1 TRP A 37 -2.038 -1.560 6.105 1.00 0.00 N ATOM 580 CE2 TRP A 37 -2.138 -0.401 6.839 1.00 0.00 C ATOM 581 CE3 TRP A 37 -1.531 0.306 9.068 1.00 0.00 C ATOM 582 CZ2 TRP A 37 -2.650 0.868 6.557 1.00 0.00 C ATOM 583 CZ3 TRP A 37 -1.998 1.600 8.772 1.00 0.00 C ATOM 584 CH2 TRP A 37 -2.578 1.881 7.524 1.00 0.00 C ATOM 0 H TRP A 37 -3.061 -3.626 9.081 1.00 0.00 H new ATOM 0 HA TRP A 37 -0.653 -5.007 8.505 1.00 0.00 H new ATOM 0 HB2 TRP A 37 -1.037 -2.478 10.171 1.00 0.00 H new ATOM 0 HB3 TRP A 37 0.366 -2.904 9.211 1.00 0.00 H new ATOM 0 HD1 TRP A 37 -1.401 -3.611 6.519 1.00 0.00 H new ATOM 0 HE1 TRP A 37 -2.300 -1.641 5.122 1.00 0.00 H new ATOM 0 HE3 TRP A 37 -1.117 0.101 10.044 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 -3.100 1.068 5.596 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 -1.910 2.383 9.510 1.00 0.00 H new ATOM 0 HH2 TRP A 37 -2.964 2.867 7.311 1.00 0.00 H new ATOM 595 N LYS A 38 -1.647 -5.065 11.591 1.00 0.00 N ATOM 596 CA LYS A 38 -1.367 -5.489 12.949 1.00 0.00 C ATOM 597 C LYS A 38 -1.150 -6.999 12.935 1.00 0.00 C ATOM 598 O LYS A 38 -1.746 -7.719 12.133 1.00 0.00 O ATOM 599 CB LYS A 38 -2.557 -5.106 13.838 1.00 0.00 C ATOM 600 CG LYS A 38 -2.849 -3.596 13.870 1.00 0.00 C ATOM 601 CD LYS A 38 -4.103 -3.348 14.711 1.00 0.00 C ATOM 602 CE LYS A 38 -4.289 -1.860 15.012 1.00 0.00 C ATOM 603 NZ LYS A 38 -5.197 -1.643 16.155 1.00 0.00 N ATOM 0 H LYS A 38 -2.629 -4.844 11.429 1.00 0.00 H new ATOM 0 HA LYS A 38 -0.474 -5.005 13.345 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -3.445 -5.631 13.486 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -2.365 -5.451 14.854 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -2.000 -3.057 14.292 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -2.994 -3.219 12.858 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -4.978 -3.726 14.182 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -4.031 -3.904 15.646 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -3.320 -1.408 15.226 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -4.687 -1.358 14.131 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -5.298 -0.623 16.329 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -6.129 -2.052 15.941 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -4.804 -2.101 17.002 1.00 0.00 H new ATOM 617 N GLU A 39 -0.305 -7.498 13.829 1.00 0.00 N ATOM 618 CA GLU A 39 -0.144 -8.935 13.982 1.00 0.00 C ATOM 619 C GLU A 39 -1.427 -9.509 14.579 1.00 0.00 C ATOM 620 O GLU A 39 -2.229 -8.796 15.196 1.00 0.00 O ATOM 621 CB GLU A 39 1.079 -9.291 14.846 1.00 0.00 C ATOM 622 CG GLU A 39 2.410 -8.999 14.151 1.00 0.00 C ATOM 623 CD GLU A 39 2.702 -7.499 13.962 1.00 0.00 C ATOM 624 OE1 GLU A 39 2.263 -6.663 14.790 1.00 0.00 O ATOM 625 OE2 GLU A 39 3.379 -7.141 12.966 1.00 0.00 O ATOM 0 H GLU A 39 0.273 -6.934 14.452 1.00 0.00 H new ATOM 0 HA GLU A 39 0.037 -9.376 13.002 1.00 0.00 H new ATOM 0 HB2 GLU A 39 1.033 -8.730 15.779 1.00 0.00 H new ATOM 0 HB3 GLU A 39 1.037 -10.348 15.107 1.00 0.00 H new ATOM 0 HG2 GLU A 39 3.217 -9.445 14.732 1.00 0.00 H new ATOM 0 HG3 GLU A 39 2.413 -9.485 13.175 1.00 0.00 H new ATOM 632 N GLY A 40 -1.608 -10.811 14.371 1.00 0.00 N ATOM 633 CA GLY A 40 -2.755 -11.611 14.798 1.00 0.00 C ATOM 634 C GLY A 40 -4.087 -11.237 14.138 1.00 0.00 C ATOM 635 O GLY A 40 -5.052 -12.001 14.236 1.00 0.00 O ATOM 0 H GLY A 40 -0.917 -11.370 13.870 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -2.545 -12.660 14.589 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -2.863 -11.516 15.879 1.00 0.00 H new ATOM 639 N TYR A 41 -4.163 -10.090 13.463 1.00 0.00 N ATOM 640 CA TYR A 41 -5.291 -9.624 12.680 1.00 0.00 C ATOM 641 C TYR A 41 -5.216 -10.264 11.288 1.00 0.00 C ATOM 642 O TYR A 41 -4.483 -9.785 10.419 1.00 0.00 O ATOM 643 CB TYR A 41 -5.246 -8.098 12.616 1.00 0.00 C ATOM 644 CG TYR A 41 -6.109 -7.346 13.611 1.00 0.00 C ATOM 645 CD1 TYR A 41 -7.473 -7.189 13.332 1.00 0.00 C ATOM 646 CD2 TYR A 41 -5.557 -6.692 14.729 1.00 0.00 C ATOM 647 CE1 TYR A 41 -8.275 -6.341 14.106 1.00 0.00 C ATOM 648 CE2 TYR A 41 -6.348 -5.824 15.509 1.00 0.00 C ATOM 649 CZ TYR A 41 -7.721 -5.645 15.207 1.00 0.00 C ATOM 650 OH TYR A 41 -8.514 -4.833 15.966 1.00 0.00 O ATOM 0 H TYR A 41 -3.388 -9.427 13.452 1.00 0.00 H new ATOM 0 HA TYR A 41 -6.239 -9.912 13.133 1.00 0.00 H new ATOM 0 HB2 TYR A 41 -4.212 -7.782 12.756 1.00 0.00 H new ATOM 0 HB3 TYR A 41 -5.539 -7.791 11.612 1.00 0.00 H new ATOM 0 HD1 TYR A 41 -7.913 -7.730 12.507 1.00 0.00 H new ATOM 0 HD2 TYR A 41 -4.522 -6.856 14.990 1.00 0.00 H new ATOM 0 HE1 TYR A 41 -9.320 -6.218 13.862 1.00 0.00 H new ATOM 0 HE2 TYR A 41 -5.906 -5.294 16.340 1.00 0.00 H new ATOM 0 HH TYR A 41 -7.980 -4.431 16.682 1.00 0.00 H new ATOM 660 N GLU A 42 -5.923 -11.373 11.063 1.00 0.00 N ATOM 661 CA GLU A 42 -5.980 -12.034 9.767 1.00 0.00 C ATOM 662 C GLU A 42 -7.096 -11.386 8.939 1.00 0.00 C ATOM 663 O GLU A 42 -8.170 -11.950 8.716 1.00 0.00 O ATOM 664 CB GLU A 42 -6.052 -13.561 9.941 1.00 0.00 C ATOM 665 CG GLU A 42 -6.003 -14.258 8.586 1.00 0.00 C ATOM 666 CD GLU A 42 -5.671 -15.751 8.670 1.00 0.00 C ATOM 667 OE1 GLU A 42 -6.543 -16.632 8.877 1.00 0.00 O ATOM 668 OE2 GLU A 42 -4.489 -16.065 8.426 1.00 0.00 O ATOM 0 H GLU A 42 -6.475 -11.838 11.784 1.00 0.00 H new ATOM 0 HA GLU A 42 -5.066 -11.890 9.191 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -5.223 -13.901 10.561 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -6.971 -13.830 10.462 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -6.966 -14.137 8.091 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -5.259 -13.765 7.961 1.00 0.00 H new ATOM 675 N ILE A 43 -6.860 -10.143 8.525 1.00 0.00 N ATOM 676 CA ILE A 43 -7.768 -9.372 7.683 1.00 0.00 C ATOM 677 C ILE A 43 -7.507 -9.819 6.241 1.00 0.00 C ATOM 678 O ILE A 43 -6.538 -9.363 5.634 1.00 0.00 O ATOM 679 CB ILE A 43 -7.607 -7.873 7.971 1.00 0.00 C ATOM 680 CG1 ILE A 43 -7.855 -7.605 9.468 1.00 0.00 C ATOM 681 CG2 ILE A 43 -8.550 -6.973 7.159 1.00 0.00 C ATOM 682 CD1 ILE A 43 -9.139 -8.192 10.041 1.00 0.00 C ATOM 0 H ILE A 43 -6.012 -9.633 8.772 1.00 0.00 H new ATOM 0 HA ILE A 43 -8.822 -9.556 7.890 1.00 0.00 H new ATOM 0 HB ILE A 43 -6.588 -7.622 7.676 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -7.012 -8.002 10.034 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -7.867 -6.527 9.628 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -8.373 -5.930 7.421 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -8.363 -7.116 6.095 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -9.584 -7.233 7.384 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -9.212 -7.943 11.100 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -9.997 -7.778 9.511 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -9.128 -9.276 9.923 1.00 0.00 H new ATOM 694 N LYS A 44 -8.298 -10.759 5.712 1.00 0.00 N ATOM 695 CA LYS A 44 -8.030 -11.475 4.465 1.00 0.00 C ATOM 696 C LYS A 44 -9.196 -11.439 3.462 1.00 0.00 C ATOM 697 O LYS A 44 -9.261 -12.304 2.586 1.00 0.00 O ATOM 698 CB LYS A 44 -7.548 -12.888 4.788 1.00 0.00 C ATOM 699 CG LYS A 44 -8.638 -13.777 5.396 1.00 0.00 C ATOM 700 CD LYS A 44 -8.508 -15.230 4.914 1.00 0.00 C ATOM 701 CE LYS A 44 -9.094 -15.363 3.498 1.00 0.00 C ATOM 702 NZ LYS A 44 -8.528 -16.505 2.753 1.00 0.00 N ATOM 0 H LYS A 44 -9.169 -11.050 6.156 1.00 0.00 H new ATOM 0 HA LYS A 44 -7.232 -10.950 3.940 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -7.175 -13.354 3.876 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -6.709 -12.828 5.481 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -8.571 -13.745 6.483 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -9.620 -13.388 5.125 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -7.460 -15.530 4.914 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -9.031 -15.898 5.598 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -10.176 -15.479 3.566 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -8.906 -14.444 2.943 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -8.957 -16.549 1.806 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -7.499 -16.384 2.662 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -8.729 -17.388 3.265 1.00 0.00 H new ATOM 716 N ASN A 45 -10.126 -10.503 3.641 1.00 0.00 N ATOM 717 CA ASN A 45 -11.342 -10.305 2.851 1.00 0.00 C ATOM 718 C ASN A 45 -10.995 -9.783 1.445 1.00 0.00 C ATOM 719 O ASN A 45 -9.962 -10.097 0.861 1.00 0.00 O ATOM 720 CB ASN A 45 -12.329 -9.425 3.650 1.00 0.00 C ATOM 721 CG ASN A 45 -13.730 -9.465 3.043 1.00 0.00 C ATOM 722 OD1 ASN A 45 -14.320 -10.526 2.862 1.00 0.00 O ATOM 723 ND2 ASN A 45 -14.210 -8.330 2.577 1.00 0.00 N ATOM 0 H ASN A 45 -10.046 -9.817 4.391 1.00 0.00 H new ATOM 0 HA ASN A 45 -11.853 -11.252 2.675 1.00 0.00 H new ATOM 0 HB2 ASN A 45 -12.369 -9.768 4.684 1.00 0.00 H new ATOM 0 HB3 ASN A 45 -11.968 -8.397 3.669 1.00 0.00 H new ATOM 0 HD21 ASN A 45 -15.087 -8.323 2.056 1.00 0.00 H new ATOM 0 HD22 ASN A 45 -13.705 -7.458 2.738 1.00 0.00 H new ATOM 730 N ARG A 46 -11.931 -9.084 0.814 1.00 0.00 N ATOM 731 CA ARG A 46 -11.879 -8.683 -0.586 1.00 0.00 C ATOM 732 C ARG A 46 -11.721 -7.173 -0.637 1.00 0.00 C ATOM 733 O ARG A 46 -10.752 -6.686 -1.220 1.00 0.00 O ATOM 734 CB ARG A 46 -13.116 -9.169 -1.353 1.00 0.00 C ATOM 735 CG ARG A 46 -13.549 -10.576 -0.984 1.00 0.00 C ATOM 736 CD ARG A 46 -14.847 -10.965 -1.677 1.00 0.00 C ATOM 737 NE ARG A 46 -15.068 -10.365 -3.009 1.00 0.00 N ATOM 738 CZ ARG A 46 -16.046 -9.517 -3.340 1.00 0.00 C ATOM 739 NH1 ARG A 46 -16.864 -9.020 -2.418 1.00 0.00 N ATOM 740 NH2 ARG A 46 -16.183 -9.207 -4.618 1.00 0.00 N ATOM 0 H ARG A 46 -12.780 -8.769 1.283 1.00 0.00 H new ATOM 0 HA ARG A 46 -11.026 -9.148 -1.080 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -13.942 -8.483 -1.165 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -12.908 -9.131 -2.422 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -12.765 -11.282 -1.258 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -13.678 -10.646 0.096 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -14.872 -12.050 -1.779 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -15.680 -10.687 -1.031 1.00 0.00 H new ATOM 0 HE ARG A 46 -14.412 -10.623 -3.746 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -16.751 -9.285 -1.440 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -17.605 -8.374 -2.689 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -15.554 -9.612 -5.311 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -16.918 -8.563 -4.911 1.00 0.00 H new ATOM 754 N GLU A 47 -12.612 -6.440 0.038 1.00 0.00 N ATOM 755 CA GLU A 47 -12.641 -4.980 0.006 1.00 0.00 C ATOM 756 C GLU A 47 -11.287 -4.375 0.365 1.00 0.00 C ATOM 757 O GLU A 47 -10.875 -3.451 -0.320 1.00 0.00 O ATOM 758 CB GLU A 47 -13.738 -4.384 0.895 1.00 0.00 C ATOM 759 CG GLU A 47 -15.139 -4.725 0.383 1.00 0.00 C ATOM 760 CD GLU A 47 -15.637 -6.070 0.909 1.00 0.00 C ATOM 761 OE1 GLU A 47 -16.059 -6.142 2.079 1.00 0.00 O ATOM 762 OE2 GLU A 47 -15.581 -7.073 0.158 1.00 0.00 O ATOM 0 H GLU A 47 -13.338 -6.850 0.626 1.00 0.00 H new ATOM 0 HA GLU A 47 -12.877 -4.716 -1.025 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -13.623 -4.758 1.912 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -13.621 -3.301 0.938 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -15.834 -3.940 0.683 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -15.130 -4.744 -0.707 1.00 0.00 H new ATOM 769 N THR A 48 -10.561 -4.883 1.364 1.00 0.00 N ATOM 770 CA THR A 48 -9.254 -4.336 1.736 1.00 0.00 C ATOM 771 C THR A 48 -8.221 -4.505 0.620 1.00 0.00 C ATOM 772 O THR A 48 -7.426 -3.600 0.378 1.00 0.00 O ATOM 773 CB THR A 48 -8.750 -5.003 3.024 1.00 0.00 C ATOM 774 OG1 THR A 48 -9.810 -5.123 3.958 1.00 0.00 O ATOM 775 CG2 THR A 48 -7.612 -4.215 3.678 1.00 0.00 C ATOM 0 H THR A 48 -10.858 -5.676 1.932 1.00 0.00 H new ATOM 0 HA THR A 48 -9.383 -3.267 1.904 1.00 0.00 H new ATOM 0 HB THR A 48 -8.372 -5.986 2.743 1.00 0.00 H new ATOM 0 HG1 THR A 48 -9.479 -5.551 4.775 1.00 0.00 H new ATOM 0 HG21 THR A 48 -7.290 -4.726 4.585 1.00 0.00 H new ATOM 0 HG22 THR A 48 -6.774 -4.143 2.985 1.00 0.00 H new ATOM 0 HG23 THR A 48 -7.961 -3.214 3.931 1.00 0.00 H new ATOM 783 N GLY A 49 -8.219 -5.638 -0.084 1.00 0.00 N ATOM 784 CA GLY A 49 -7.353 -5.818 -1.235 1.00 0.00 C ATOM 785 C GLY A 49 -7.770 -4.872 -2.354 1.00 0.00 C ATOM 786 O GLY A 49 -6.915 -4.345 -3.064 1.00 0.00 O ATOM 0 H GLY A 49 -8.810 -6.442 0.128 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -6.317 -5.628 -0.954 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -7.405 -6.850 -1.582 1.00 0.00 H new ATOM 790 N CYS A 50 -9.075 -4.614 -2.484 1.00 0.00 N ATOM 791 CA CYS A 50 -9.584 -3.592 -3.376 1.00 0.00 C ATOM 792 C CYS A 50 -9.125 -2.198 -2.952 1.00 0.00 C ATOM 793 O CYS A 50 -8.772 -1.404 -3.818 1.00 0.00 O ATOM 794 CB CYS A 50 -11.107 -3.662 -3.503 1.00 0.00 C ATOM 795 SG CYS A 50 -11.601 -3.853 -5.227 1.00 0.00 S ATOM 0 H CYS A 50 -9.801 -5.113 -1.970 1.00 0.00 H new ATOM 0 HA CYS A 50 -9.165 -3.789 -4.363 1.00 0.00 H new ATOM 0 HB2 CYS A 50 -11.487 -4.499 -2.917 1.00 0.00 H new ATOM 0 HB3 CYS A 50 -11.552 -2.756 -3.091 1.00 0.00 H new ATOM 800 N ALA A 51 -9.079 -1.900 -1.648 1.00 0.00 N ATOM 801 CA ALA A 51 -8.572 -0.639 -1.143 1.00 0.00 C ATOM 802 C ALA A 51 -7.131 -0.487 -1.597 1.00 0.00 C ATOM 803 O ALA A 51 -6.847 0.528 -2.215 1.00 0.00 O ATOM 804 CB ALA A 51 -8.725 -0.489 0.381 1.00 0.00 C ATOM 0 H ALA A 51 -9.397 -2.537 -0.918 1.00 0.00 H new ATOM 0 HA ALA A 51 -9.174 0.170 -1.556 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -8.326 0.476 0.693 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -9.780 -0.549 0.648 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -8.177 -1.287 0.882 1.00 0.00 H new ATOM 810 N ILE A 52 -6.250 -1.472 -1.373 1.00 0.00 N ATOM 811 CA ILE A 52 -4.869 -1.445 -1.855 1.00 0.00 C ATOM 812 C ILE A 52 -4.870 -1.168 -3.365 1.00 0.00 C ATOM 813 O ILE A 52 -4.266 -0.197 -3.788 1.00 0.00 O ATOM 814 CB ILE A 52 -4.128 -2.745 -1.463 1.00 0.00 C ATOM 815 CG1 ILE A 52 -4.027 -2.865 0.074 1.00 0.00 C ATOM 816 CG2 ILE A 52 -2.717 -2.801 -2.071 1.00 0.00 C ATOM 817 CD1 ILE A 52 -3.405 -4.172 0.564 1.00 0.00 C ATOM 0 H ILE A 52 -6.481 -2.315 -0.848 1.00 0.00 H new ATOM 0 HA ILE A 52 -4.314 -0.637 -1.378 1.00 0.00 H new ATOM 0 HB ILE A 52 -4.707 -3.579 -1.860 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -3.437 -2.031 0.454 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -5.026 -2.769 0.500 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -2.229 -3.729 -1.773 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -2.787 -2.761 -3.158 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -2.133 -1.953 -1.714 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -3.372 -4.173 1.654 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -4.006 -5.013 0.218 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -2.393 -4.263 0.171 1.00 0.00 H new ATOM 829 N MET A 53 -5.581 -1.953 -4.169 1.00 0.00 N ATOM 830 CA MET A 53 -5.595 -1.844 -5.628 1.00 0.00 C ATOM 831 C MET A 53 -6.088 -0.486 -6.140 1.00 0.00 C ATOM 832 O MET A 53 -5.614 0.050 -7.133 1.00 0.00 O ATOM 833 CB MET A 53 -6.504 -2.958 -6.138 1.00 0.00 C ATOM 834 CG MET A 53 -6.597 -3.026 -7.658 1.00 0.00 C ATOM 835 SD MET A 53 -8.205 -2.570 -8.373 1.00 0.00 S ATOM 836 CE MET A 53 -9.324 -3.712 -7.533 1.00 0.00 C ATOM 0 H MET A 53 -6.179 -2.701 -3.818 1.00 0.00 H new ATOM 0 HA MET A 53 -4.574 -1.935 -5.998 1.00 0.00 H new ATOM 0 HB2 MET A 53 -6.139 -3.914 -5.762 1.00 0.00 H new ATOM 0 HB3 MET A 53 -7.504 -2.815 -5.728 1.00 0.00 H new ATOM 0 HG2 MET A 53 -5.834 -2.371 -8.080 1.00 0.00 H new ATOM 0 HG3 MET A 53 -6.355 -4.041 -7.973 1.00 0.00 H new ATOM 0 HE1 MET A 53 -10.308 -3.667 -8.000 1.00 0.00 H new ATOM 0 HE2 MET A 53 -8.932 -4.726 -7.608 1.00 0.00 H new ATOM 0 HE3 MET A 53 -9.408 -3.433 -6.483 1.00 0.00 H new ATOM 846 N CYS A 54 -7.091 0.089 -5.499 1.00 0.00 N ATOM 847 CA CYS A 54 -7.578 1.424 -5.804 1.00 0.00 C ATOM 848 C CYS A 54 -6.518 2.456 -5.409 1.00 0.00 C ATOM 849 O CYS A 54 -6.210 3.401 -6.134 1.00 0.00 O ATOM 850 CB CYS A 54 -8.853 1.579 -4.984 1.00 0.00 C ATOM 851 SG CYS A 54 -9.755 3.141 -5.076 1.00 0.00 S ATOM 0 H CYS A 54 -7.598 -0.366 -4.740 1.00 0.00 H new ATOM 0 HA CYS A 54 -7.779 1.575 -6.865 1.00 0.00 H new ATOM 0 HB2 CYS A 54 -9.537 0.784 -5.281 1.00 0.00 H new ATOM 0 HB3 CYS A 54 -8.598 1.405 -3.939 1.00 0.00 H new ATOM 856 N LEU A 55 -5.950 2.283 -4.219 1.00 0.00 N ATOM 857 CA LEU A 55 -4.928 3.163 -3.692 1.00 0.00 C ATOM 858 C LEU A 55 -3.644 3.095 -4.513 1.00 0.00 C ATOM 859 O LEU A 55 -2.930 4.097 -4.574 1.00 0.00 O ATOM 860 CB LEU A 55 -4.697 2.866 -2.207 1.00 0.00 C ATOM 861 CG LEU A 55 -5.926 3.254 -1.369 1.00 0.00 C ATOM 862 CD1 LEU A 55 -5.867 2.598 0.006 1.00 0.00 C ATOM 863 CD2 LEU A 55 -6.109 4.755 -1.192 1.00 0.00 C ATOM 0 H LEU A 55 -6.194 1.517 -3.591 1.00 0.00 H new ATOM 0 HA LEU A 55 -5.277 4.192 -3.774 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -4.482 1.806 -2.074 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -3.824 3.415 -1.854 1.00 0.00 H new ATOM 0 HG LEU A 55 -6.784 2.891 -1.935 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -6.745 2.885 0.584 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -5.846 1.514 -0.109 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -4.967 2.925 0.527 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -6.997 4.945 -0.590 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -5.235 5.172 -0.691 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -6.226 5.225 -2.169 1.00 0.00 H new ATOM 875 N SER A 56 -3.412 1.996 -5.239 1.00 0.00 N ATOM 876 CA SER A 56 -2.273 1.821 -6.116 1.00 0.00 C ATOM 877 C SER A 56 -2.392 2.713 -7.364 1.00 0.00 C ATOM 878 O SER A 56 -1.553 2.654 -8.256 1.00 0.00 O ATOM 879 CB SER A 56 -2.006 0.318 -6.373 1.00 0.00 C ATOM 880 OG SER A 56 -2.827 -0.309 -7.329 1.00 0.00 O ATOM 0 H SER A 56 -4.034 1.188 -5.225 1.00 0.00 H new ATOM 0 HA SER A 56 -1.365 2.176 -5.628 1.00 0.00 H new ATOM 0 HB2 SER A 56 -0.968 0.204 -6.687 1.00 0.00 H new ATOM 0 HB3 SER A 56 -2.114 -0.215 -5.428 1.00 0.00 H new ATOM 0 HG SER A 56 -3.764 -0.075 -7.160 1.00 0.00 H new ATOM 886 N THR A 57 -3.394 3.599 -7.445 1.00 0.00 N ATOM 887 CA THR A 57 -3.450 4.676 -8.427 1.00 0.00 C ATOM 888 C THR A 57 -3.933 6.004 -7.803 1.00 0.00 C ATOM 889 O THR A 57 -4.204 6.985 -8.504 1.00 0.00 O ATOM 890 CB THR A 57 -4.225 4.166 -9.654 1.00 0.00 C ATOM 891 OG1 THR A 57 -3.975 4.979 -10.776 1.00 0.00 O ATOM 892 CG2 THR A 57 -5.732 4.037 -9.415 1.00 0.00 C ATOM 0 H THR A 57 -4.198 3.582 -6.818 1.00 0.00 H new ATOM 0 HA THR A 57 -2.456 4.945 -8.784 1.00 0.00 H new ATOM 0 HB THR A 57 -3.855 3.159 -9.846 1.00 0.00 H new ATOM 0 HG1 THR A 57 -3.951 5.919 -10.500 1.00 0.00 H new ATOM 0 HG21 THR A 57 -6.214 3.673 -10.322 1.00 0.00 H new ATOM 0 HG22 THR A 57 -5.913 3.335 -8.601 1.00 0.00 H new ATOM 0 HG23 THR A 57 -6.143 5.011 -9.152 1.00 0.00 H new ATOM 900 N LYS A 58 -3.938 6.098 -6.469 1.00 0.00 N ATOM 901 CA LYS A 58 -4.270 7.302 -5.698 1.00 0.00 C ATOM 902 C LYS A 58 -3.007 7.881 -5.061 1.00 0.00 C ATOM 903 O LYS A 58 -3.094 8.493 -3.995 1.00 0.00 O ATOM 904 CB LYS A 58 -5.358 6.972 -4.659 1.00 0.00 C ATOM 905 CG LYS A 58 -6.770 6.835 -5.237 1.00 0.00 C ATOM 906 CD LYS A 58 -7.530 8.121 -5.011 1.00 0.00 C ATOM 907 CE LYS A 58 -8.873 8.026 -5.704 1.00 0.00 C ATOM 908 NZ LYS A 58 -8.759 8.258 -7.162 1.00 0.00 N ATOM 0 H LYS A 58 -3.701 5.305 -5.872 1.00 0.00 H new ATOM 0 HA LYS A 58 -4.674 8.068 -6.359 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -5.093 6.041 -4.158 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -5.365 7.753 -3.899 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -6.719 6.612 -6.303 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -7.291 6.003 -4.762 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -7.668 8.295 -3.944 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -6.964 8.967 -5.401 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -9.305 7.041 -5.526 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -9.557 8.757 -5.272 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -9.576 7.834 -7.646 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -8.737 9.281 -7.350 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -7.883 7.822 -7.515 1.00 0.00 H new ATOM 922 N LEU A 59 -1.825 7.681 -5.649 1.00 0.00 N ATOM 923 CA LEU A 59 -0.562 8.173 -5.088 1.00 0.00 C ATOM 924 C LEU A 59 -0.575 9.694 -4.982 1.00 0.00 C ATOM 925 O LEU A 59 -0.055 10.233 -4.010 1.00 0.00 O ATOM 926 CB LEU A 59 0.628 7.740 -5.957 1.00 0.00 C ATOM 927 CG LEU A 59 0.628 6.272 -6.416 1.00 0.00 C ATOM 928 CD1 LEU A 59 1.838 6.016 -7.315 1.00 0.00 C ATOM 929 CD2 LEU A 59 0.609 5.281 -5.249 1.00 0.00 C ATOM 0 H LEU A 59 -1.715 7.174 -6.527 1.00 0.00 H new ATOM 0 HA LEU A 59 -0.455 7.742 -4.092 1.00 0.00 H new ATOM 0 HB2 LEU A 59 0.657 8.377 -6.841 1.00 0.00 H new ATOM 0 HB3 LEU A 59 1.546 7.926 -5.400 1.00 0.00 H new ATOM 0 HG LEU A 59 -0.293 6.107 -6.975 1.00 0.00 H new ATOM 0 HD11 LEU A 59 1.837 4.975 -7.639 1.00 0.00 H new ATOM 0 HD12 LEU A 59 1.788 6.668 -8.187 1.00 0.00 H new ATOM 0 HD13 LEU A 59 2.753 6.222 -6.760 1.00 0.00 H new ATOM 0 HD21 LEU A 59 0.610 4.262 -5.637 1.00 0.00 H new ATOM 0 HD22 LEU A 59 1.492 5.434 -4.628 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -0.288 5.441 -4.651 1.00 0.00 H new ATOM 941 N ASN A 60 -1.262 10.363 -5.916 1.00 0.00 N ATOM 942 CA ASN A 60 -1.509 11.802 -5.906 1.00 0.00 C ATOM 943 C ASN A 60 -2.153 12.274 -4.603 1.00 0.00 C ATOM 944 O ASN A 60 -1.922 13.409 -4.191 1.00 0.00 O ATOM 945 CB ASN A 60 -2.424 12.185 -7.081 1.00 0.00 C ATOM 946 CG ASN A 60 -3.851 11.656 -6.926 1.00 0.00 C ATOM 947 OD1 ASN A 60 -4.068 10.443 -6.936 1.00 0.00 O ATOM 948 ND2 ASN A 60 -4.835 12.517 -6.742 1.00 0.00 N ATOM 0 H ASN A 60 -1.673 9.898 -6.725 1.00 0.00 H new ATOM 0 HA ASN A 60 -0.539 12.291 -5.999 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -2.453 13.271 -7.172 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -1.998 11.798 -8.007 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -5.788 12.181 -6.606 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -4.642 13.519 -6.736 1.00 0.00 H new ATOM 955 N MET A 61 -2.958 11.424 -3.958 1.00 0.00 N ATOM 956 CA MET A 61 -3.616 11.746 -2.703 1.00 0.00 C ATOM 957 C MET A 61 -2.676 11.529 -1.526 1.00 0.00 C ATOM 958 O MET A 61 -2.902 12.134 -0.485 1.00 0.00 O ATOM 959 CB MET A 61 -4.851 10.859 -2.504 1.00 0.00 C ATOM 960 CG MET A 61 -5.873 11.001 -3.630 1.00 0.00 C ATOM 961 SD MET A 61 -6.691 12.611 -3.726 1.00 0.00 S ATOM 962 CE MET A 61 -7.820 12.451 -2.317 1.00 0.00 C ATOM 0 H MET A 61 -3.168 10.487 -4.301 1.00 0.00 H new ATOM 0 HA MET A 61 -3.911 12.794 -2.747 1.00 0.00 H new ATOM 0 HB2 MET A 61 -4.537 9.818 -2.435 1.00 0.00 H new ATOM 0 HB3 MET A 61 -5.325 11.113 -1.556 1.00 0.00 H new ATOM 0 HG2 MET A 61 -5.374 10.808 -4.579 1.00 0.00 H new ATOM 0 HG3 MET A 61 -6.635 10.231 -3.508 1.00 0.00 H new ATOM 0 HE1 MET A 61 -8.681 13.103 -2.465 1.00 0.00 H new ATOM 0 HE2 MET A 61 -8.157 11.418 -2.236 1.00 0.00 H new ATOM 0 HE3 MET A 61 -7.302 12.736 -1.401 1.00 0.00 H new ATOM 972 N LEU A 62 -1.667 10.658 -1.636 1.00 0.00 N ATOM 973 CA LEU A 62 -0.767 10.297 -0.562 1.00 0.00 C ATOM 974 C LEU A 62 0.330 11.328 -0.453 1.00 0.00 C ATOM 975 O LEU A 62 0.432 11.978 0.584 1.00 0.00 O ATOM 976 CB LEU A 62 -0.195 8.901 -0.845 1.00 0.00 C ATOM 977 CG LEU A 62 -1.265 7.826 -1.029 1.00 0.00 C ATOM 978 CD1 LEU A 62 -0.622 6.562 -1.581 1.00 0.00 C ATOM 979 CD2 LEU A 62 -2.041 7.559 0.272 1.00 0.00 C ATOM 0 H LEU A 62 -1.457 10.175 -2.509 1.00 0.00 H new ATOM 0 HA LEU A 62 -1.299 10.271 0.389 1.00 0.00 H new ATOM 0 HB2 LEU A 62 0.421 8.945 -1.743 1.00 0.00 H new ATOM 0 HB3 LEU A 62 0.460 8.613 -0.023 1.00 0.00 H new ATOM 0 HG LEU A 62 -2.002 8.184 -1.748 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -1.384 5.794 -1.713 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -0.157 6.780 -2.542 1.00 0.00 H new ATOM 0 HD13 LEU A 62 0.136 6.205 -0.884 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -2.792 6.788 0.096 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -1.350 7.223 1.045 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -2.532 8.476 0.598 1.00 0.00 H new ATOM 991 N ASP A 63 1.132 11.473 -1.504 1.00 0.00 N ATOM 992 CA ASP A 63 2.241 12.417 -1.525 1.00 0.00 C ATOM 993 C ASP A 63 1.859 13.563 -2.461 1.00 0.00 C ATOM 994 O ASP A 63 1.853 13.394 -3.682 1.00 0.00 O ATOM 995 CB ASP A 63 3.583 11.794 -1.914 1.00 0.00 C ATOM 996 CG ASP A 63 4.651 12.889 -1.794 1.00 0.00 C ATOM 997 OD1 ASP A 63 5.054 13.223 -0.648 1.00 0.00 O ATOM 998 OD2 ASP A 63 5.021 13.447 -2.845 1.00 0.00 O ATOM 0 H ASP A 63 1.030 10.937 -2.366 1.00 0.00 H new ATOM 0 HA ASP A 63 2.401 12.781 -0.510 1.00 0.00 H new ATOM 0 HB2 ASP A 63 3.820 10.954 -1.261 1.00 0.00 H new ATOM 0 HB3 ASP A 63 3.545 11.405 -2.932 1.00 0.00 H new ATOM 1003 N PRO A 64 1.475 14.730 -1.924 1.00 0.00 N ATOM 1004 CA PRO A 64 0.949 15.822 -2.733 1.00 0.00 C ATOM 1005 C PRO A 64 2.044 16.494 -3.559 1.00 0.00 C ATOM 1006 O PRO A 64 1.753 17.003 -4.643 1.00 0.00 O ATOM 1007 CB PRO A 64 0.349 16.808 -1.731 1.00 0.00 C ATOM 1008 CG PRO A 64 1.179 16.568 -0.475 1.00 0.00 C ATOM 1009 CD PRO A 64 1.469 15.078 -0.514 1.00 0.00 C ATOM 0 HA PRO A 64 0.213 15.462 -3.452 1.00 0.00 H new ATOM 0 HB2 PRO A 64 0.432 17.838 -2.079 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -0.710 16.614 -1.558 1.00 0.00 H new ATOM 0 HG2 PRO A 64 2.097 17.155 -0.484 1.00 0.00 H new ATOM 0 HG3 PRO A 64 0.632 16.846 0.426 1.00 0.00 H new ATOM 0 HD2 PRO A 64 2.428 14.851 -0.048 1.00 0.00 H new ATOM 0 HD3 PRO A 64 0.710 14.514 0.028 1.00 0.00 H new ATOM 1017 N GLU A 65 3.286 16.466 -3.065 1.00 0.00 N ATOM 1018 CA GLU A 65 4.464 16.989 -3.742 1.00 0.00 C ATOM 1019 C GLU A 65 4.754 16.231 -5.038 1.00 0.00 C ATOM 1020 O GLU A 65 5.438 16.782 -5.906 1.00 0.00 O ATOM 1021 CB GLU A 65 5.685 16.924 -2.814 1.00 0.00 C ATOM 1022 CG GLU A 65 5.529 17.789 -1.566 1.00 0.00 C ATOM 1023 CD GLU A 65 6.747 17.677 -0.661 1.00 0.00 C ATOM 1024 OE1 GLU A 65 7.703 18.451 -0.857 1.00 0.00 O ATOM 1025 OE2 GLU A 65 6.742 16.781 0.220 1.00 0.00 O ATOM 0 H GLU A 65 3.500 16.064 -2.152 1.00 0.00 H new ATOM 0 HA GLU A 65 4.260 18.028 -3.999 1.00 0.00 H new ATOM 0 HB2 GLU A 65 5.853 15.890 -2.514 1.00 0.00 H new ATOM 0 HB3 GLU A 65 6.570 17.244 -3.364 1.00 0.00 H new ATOM 0 HG2 GLU A 65 5.384 18.829 -1.858 1.00 0.00 H new ATOM 0 HG3 GLU A 65 4.637 17.484 -1.019 1.00 0.00 H new ATOM 1032 N GLY A 66 4.242 15.005 -5.166 1.00 0.00 N ATOM 1033 CA GLY A 66 4.335 14.209 -6.360 1.00 0.00 C ATOM 1034 C GLY A 66 5.620 13.402 -6.450 1.00 0.00 C ATOM 1035 O GLY A 66 5.946 12.986 -7.556 1.00 0.00 O ATOM 0 H GLY A 66 3.739 14.538 -4.411 1.00 0.00 H new ATOM 0 HA2 GLY A 66 3.484 13.529 -6.401 1.00 0.00 H new ATOM 0 HA3 GLY A 66 4.263 14.862 -7.230 1.00 0.00 H new ATOM 1039 N ASN A 67 6.320 13.136 -5.342 1.00 0.00 N ATOM 1040 CA ASN A 67 7.491 12.255 -5.360 1.00 0.00 C ATOM 1041 C ASN A 67 7.089 10.816 -5.691 1.00 0.00 C ATOM 1042 O ASN A 67 7.875 10.069 -6.277 1.00 0.00 O ATOM 1043 CB ASN A 67 8.173 12.224 -3.976 1.00 0.00 C ATOM 1044 CG ASN A 67 9.192 13.327 -3.745 1.00 0.00 C ATOM 1045 OD1 ASN A 67 10.378 13.055 -3.601 1.00 0.00 O ATOM 1046 ND2 ASN A 67 8.754 14.566 -3.605 1.00 0.00 N ATOM 0 H ASN A 67 6.096 13.518 -4.423 1.00 0.00 H new ATOM 0 HA ASN A 67 8.169 12.648 -6.118 1.00 0.00 H new ATOM 0 HB2 ASN A 67 7.405 12.291 -3.206 1.00 0.00 H new ATOM 0 HB3 ASN A 67 8.666 11.260 -3.851 1.00 0.00 H new ATOM 0 HD21 ASN A 67 9.407 15.315 -3.373 1.00 0.00 H new ATOM 0 HD22 ASN A 67 7.763 14.774 -3.729 1.00 0.00 H new ATOM 1053 N LEU A 68 5.915 10.378 -5.222 1.00 0.00 N ATOM 1054 CA LEU A 68 5.522 8.973 -5.279 1.00 0.00 C ATOM 1055 C LEU A 68 4.917 8.655 -6.648 1.00 0.00 C ATOM 1056 O LEU A 68 3.714 8.833 -6.857 1.00 0.00 O ATOM 1057 CB LEU A 68 4.589 8.651 -4.100 1.00 0.00 C ATOM 1058 CG LEU A 68 4.175 7.170 -4.034 1.00 0.00 C ATOM 1059 CD1 LEU A 68 5.370 6.220 -4.139 1.00 0.00 C ATOM 1060 CD2 LEU A 68 3.416 6.920 -2.726 1.00 0.00 C ATOM 0 H LEU A 68 5.217 10.987 -4.795 1.00 0.00 H new ATOM 0 HA LEU A 68 6.393 8.326 -5.173 1.00 0.00 H new ATOM 0 HB2 LEU A 68 5.085 8.924 -3.169 1.00 0.00 H new ATOM 0 HB3 LEU A 68 3.693 9.268 -4.176 1.00 0.00 H new ATOM 0 HG LEU A 68 3.534 6.964 -4.891 1.00 0.00 H new ATOM 0 HD11 LEU A 68 5.021 5.189 -4.087 1.00 0.00 H new ATOM 0 HD12 LEU A 68 5.882 6.382 -5.088 1.00 0.00 H new ATOM 0 HD13 LEU A 68 6.060 6.411 -3.317 1.00 0.00 H new ATOM 0 HD21 LEU A 68 3.119 5.873 -2.672 1.00 0.00 H new ATOM 0 HD22 LEU A 68 4.061 7.159 -1.880 1.00 0.00 H new ATOM 0 HD23 LEU A 68 2.528 7.551 -2.695 1.00 0.00 H new ATOM 1072 N HIS A 69 5.756 8.245 -7.601 1.00 0.00 N ATOM 1073 CA HIS A 69 5.339 7.885 -8.954 1.00 0.00 C ATOM 1074 C HIS A 69 4.912 6.428 -9.049 1.00 0.00 C ATOM 1075 O HIS A 69 5.254 5.600 -8.209 1.00 0.00 O ATOM 1076 CB HIS A 69 6.488 8.127 -9.928 1.00 0.00 C ATOM 1077 CG HIS A 69 6.816 9.587 -10.049 1.00 0.00 C ATOM 1078 ND1 HIS A 69 6.093 10.534 -10.744 1.00 0.00 N ATOM 1079 CD2 HIS A 69 7.879 10.208 -9.458 1.00 0.00 C ATOM 1080 CE1 HIS A 69 6.711 11.716 -10.567 1.00 0.00 C ATOM 1081 NE2 HIS A 69 7.816 11.558 -9.818 1.00 0.00 N ATOM 0 H HIS A 69 6.761 8.153 -7.450 1.00 0.00 H new ATOM 0 HA HIS A 69 4.483 8.509 -9.209 1.00 0.00 H new ATOM 0 HB2 HIS A 69 7.370 7.583 -9.592 1.00 0.00 H new ATOM 0 HB3 HIS A 69 6.223 7.731 -10.908 1.00 0.00 H new ATOM 0 HD2 HIS A 69 8.627 9.745 -8.831 1.00 0.00 H new ATOM 0 HE1 HIS A 69 6.368 12.658 -10.969 1.00 0.00 H new ATOM 0 HE2 HIS A 69 8.483 12.286 -9.561 1.00 0.00 H new ATOM 1089 N HIS A 70 4.218 6.141 -10.142 1.00 0.00 N ATOM 1090 CA HIS A 70 3.797 4.823 -10.580 1.00 0.00 C ATOM 1091 C HIS A 70 5.033 4.088 -11.084 1.00 0.00 C ATOM 1092 O HIS A 70 5.730 4.593 -11.967 1.00 0.00 O ATOM 1093 CB HIS A 70 2.761 5.022 -11.685 1.00 0.00 C ATOM 1094 CG HIS A 70 2.112 3.789 -12.252 1.00 0.00 C ATOM 1095 ND1 HIS A 70 2.712 2.729 -12.893 1.00 0.00 N ATOM 1096 CD2 HIS A 70 0.763 3.611 -12.342 1.00 0.00 C ATOM 1097 CE1 HIS A 70 1.732 1.939 -13.367 1.00 0.00 C ATOM 1098 NE2 HIS A 70 0.521 2.440 -13.065 1.00 0.00 N ATOM 0 H HIS A 70 3.916 6.872 -10.786 1.00 0.00 H new ATOM 0 HA HIS A 70 3.348 4.233 -9.781 1.00 0.00 H new ATOM 0 HB2 HIS A 70 1.974 5.669 -11.297 1.00 0.00 H new ATOM 0 HB3 HIS A 70 3.240 5.558 -12.504 1.00 0.00 H new ATOM 0 HD2 HIS A 70 0.010 4.264 -11.926 1.00 0.00 H new ATOM 0 HE1 HIS A 70 1.896 1.024 -13.917 1.00 0.00 H new ATOM 0 HE2 HIS A 70 -0.387 2.046 -13.313 1.00 0.00 H new ATOM 1106 N GLY A 71 5.308 2.917 -10.517 1.00 0.00 N ATOM 1107 CA GLY A 71 6.452 2.078 -10.852 1.00 0.00 C ATOM 1108 C GLY A 71 7.804 2.739 -10.580 1.00 0.00 C ATOM 1109 O GLY A 71 8.805 2.304 -11.149 1.00 0.00 O ATOM 0 H GLY A 71 4.720 2.513 -9.787 1.00 0.00 H new ATOM 0 HA2 GLY A 71 6.390 1.151 -10.282 1.00 0.00 H new ATOM 0 HA3 GLY A 71 6.396 1.808 -11.906 1.00 0.00 H new ATOM 1113 N ASN A 72 7.864 3.817 -9.784 1.00 0.00 N ATOM 1114 CA ASN A 72 9.107 4.551 -9.556 1.00 0.00 C ATOM 1115 C ASN A 72 9.085 5.310 -8.225 1.00 0.00 C ATOM 1116 O ASN A 72 9.203 6.538 -8.177 1.00 0.00 O ATOM 1117 CB ASN A 72 9.375 5.490 -10.743 1.00 0.00 C ATOM 1118 CG ASN A 72 10.807 6.012 -10.766 1.00 0.00 C ATOM 1119 OD1 ASN A 72 11.690 5.579 -10.023 1.00 0.00 O ATOM 1120 ND2 ASN A 72 11.076 6.931 -11.672 1.00 0.00 N ATOM 0 H ASN A 72 7.059 4.197 -9.287 1.00 0.00 H new ATOM 0 HA ASN A 72 9.926 3.835 -9.485 1.00 0.00 H new ATOM 0 HB2 ASN A 72 9.170 4.961 -11.674 1.00 0.00 H new ATOM 0 HB3 ASN A 72 8.686 6.333 -10.697 1.00 0.00 H new ATOM 0 HD21 ASN A 72 12.025 7.293 -11.765 1.00 0.00 H new ATOM 0 HD22 ASN A 72 10.335 7.280 -12.280 1.00 0.00 H new ATOM 1127 N ALA A 73 8.942 4.572 -7.127 1.00 0.00 N ATOM 1128 CA ALA A 73 8.803 5.100 -5.772 1.00 0.00 C ATOM 1129 C ALA A 73 10.154 5.359 -5.092 1.00 0.00 C ATOM 1130 O ALA A 73 10.185 5.602 -3.888 1.00 0.00 O ATOM 1131 CB ALA A 73 8.003 4.087 -4.945 1.00 0.00 C ATOM 0 H ALA A 73 8.919 3.553 -7.157 1.00 0.00 H new ATOM 0 HA ALA A 73 8.292 6.061 -5.834 1.00 0.00 H new ATOM 0 HB1 ALA A 73 7.886 4.460 -3.927 1.00 0.00 H new ATOM 0 HB2 ALA A 73 7.020 3.945 -5.395 1.00 0.00 H new ATOM 0 HB3 ALA A 73 8.533 3.135 -4.924 1.00 0.00 H new ATOM 1137 N MET A 74 11.277 5.279 -5.810 1.00 0.00 N ATOM 1138 CA MET A 74 12.591 5.135 -5.198 1.00 0.00 C ATOM 1139 C MET A 74 12.984 6.419 -4.483 1.00 0.00 C ATOM 1140 O MET A 74 13.519 6.383 -3.378 1.00 0.00 O ATOM 1141 CB MET A 74 13.635 4.771 -6.261 1.00 0.00 C ATOM 1142 CG MET A 74 13.623 3.275 -6.589 1.00 0.00 C ATOM 1143 SD MET A 74 14.991 2.755 -7.662 1.00 0.00 S ATOM 1144 CE MET A 74 14.844 0.948 -7.537 1.00 0.00 C ATOM 0 H MET A 74 11.296 5.313 -6.829 1.00 0.00 H new ATOM 0 HA MET A 74 12.549 4.330 -4.464 1.00 0.00 H new ATOM 0 HB2 MET A 74 13.442 5.343 -7.169 1.00 0.00 H new ATOM 0 HB3 MET A 74 14.626 5.057 -5.909 1.00 0.00 H new ATOM 0 HG2 MET A 74 13.666 2.707 -5.659 1.00 0.00 H new ATOM 0 HG3 MET A 74 12.678 3.025 -7.072 1.00 0.00 H new ATOM 0 HE1 MET A 74 15.834 0.511 -7.405 1.00 0.00 H new ATOM 0 HE2 MET A 74 14.217 0.692 -6.683 1.00 0.00 H new ATOM 0 HE3 MET A 74 14.393 0.556 -8.448 1.00 0.00 H new ATOM 1154 N GLU A 75 12.675 7.575 -5.070 1.00 0.00 N ATOM 1155 CA GLU A 75 13.019 8.833 -4.415 1.00 0.00 C ATOM 1156 C GLU A 75 12.160 9.046 -3.164 1.00 0.00 C ATOM 1157 O GLU A 75 12.671 9.561 -2.166 1.00 0.00 O ATOM 1158 CB GLU A 75 12.925 10.031 -5.375 1.00 0.00 C ATOM 1159 CG GLU A 75 14.266 10.319 -6.068 1.00 0.00 C ATOM 1160 CD GLU A 75 14.369 11.717 -6.685 1.00 0.00 C ATOM 1161 OE1 GLU A 75 13.352 12.399 -6.946 1.00 0.00 O ATOM 1162 OE2 GLU A 75 15.509 12.205 -6.904 1.00 0.00 O ATOM 0 H GLU A 75 12.202 7.666 -5.969 1.00 0.00 H new ATOM 0 HA GLU A 75 14.061 8.765 -4.103 1.00 0.00 H new ATOM 0 HB2 GLU A 75 12.163 9.833 -6.128 1.00 0.00 H new ATOM 0 HB3 GLU A 75 12.605 10.914 -4.822 1.00 0.00 H new ATOM 0 HG2 GLU A 75 15.070 10.194 -5.343 1.00 0.00 H new ATOM 0 HG3 GLU A 75 14.424 9.577 -6.850 1.00 0.00 H new ATOM 1169 N PHE A 76 10.891 8.635 -3.183 1.00 0.00 N ATOM 1170 CA PHE A 76 10.022 8.611 -2.014 1.00 0.00 C ATOM 1171 C PHE A 76 10.594 7.666 -0.956 1.00 0.00 C ATOM 1172 O PHE A 76 10.687 8.056 0.207 1.00 0.00 O ATOM 1173 CB PHE A 76 8.603 8.229 -2.477 1.00 0.00 C ATOM 1174 CG PHE A 76 7.681 7.706 -1.397 1.00 0.00 C ATOM 1175 CD1 PHE A 76 6.911 8.602 -0.640 1.00 0.00 C ATOM 1176 CD2 PHE A 76 7.572 6.321 -1.168 1.00 0.00 C ATOM 1177 CE1 PHE A 76 6.054 8.122 0.363 1.00 0.00 C ATOM 1178 CE2 PHE A 76 6.681 5.838 -0.194 1.00 0.00 C ATOM 1179 CZ PHE A 76 5.930 6.740 0.579 1.00 0.00 C ATOM 0 H PHE A 76 10.433 8.303 -4.032 1.00 0.00 H new ATOM 0 HA PHE A 76 9.965 9.591 -1.540 1.00 0.00 H new ATOM 0 HB2 PHE A 76 8.140 9.105 -2.932 1.00 0.00 H new ATOM 0 HB3 PHE A 76 8.686 7.472 -3.257 1.00 0.00 H new ATOM 0 HD1 PHE A 76 6.978 9.663 -0.829 1.00 0.00 H new ATOM 0 HD2 PHE A 76 8.173 5.630 -1.741 1.00 0.00 H new ATOM 0 HE1 PHE A 76 5.490 8.816 0.969 1.00 0.00 H new ATOM 0 HE2 PHE A 76 6.574 4.774 -0.040 1.00 0.00 H new ATOM 0 HZ PHE A 76 5.258 6.370 1.339 1.00 0.00 H new ATOM 1189 N ALA A 77 11.004 6.455 -1.342 1.00 0.00 N ATOM 1190 CA ALA A 77 11.575 5.457 -0.448 1.00 0.00 C ATOM 1191 C ALA A 77 12.834 5.992 0.241 1.00 0.00 C ATOM 1192 O ALA A 77 12.962 5.867 1.466 1.00 0.00 O ATOM 1193 CB ALA A 77 11.857 4.173 -1.234 1.00 0.00 C ATOM 0 H ALA A 77 10.945 6.138 -2.310 1.00 0.00 H new ATOM 0 HA ALA A 77 10.859 5.228 0.341 1.00 0.00 H new ATOM 0 HB1 ALA A 77 12.284 3.424 -0.567 1.00 0.00 H new ATOM 0 HB2 ALA A 77 10.927 3.793 -1.657 1.00 0.00 H new ATOM 0 HB3 ALA A 77 12.561 4.386 -2.039 1.00 0.00 H new ATOM 1199 N LYS A 78 13.713 6.670 -0.515 1.00 0.00 N ATOM 1200 CA LYS A 78 14.969 7.224 -0.004 1.00 0.00 C ATOM 1201 C LYS A 78 14.704 8.105 1.207 1.00 0.00 C ATOM 1202 O LYS A 78 15.330 7.894 2.248 1.00 0.00 O ATOM 1203 CB LYS A 78 15.764 7.944 -1.114 1.00 0.00 C ATOM 1204 CG LYS A 78 16.447 6.949 -2.079 1.00 0.00 C ATOM 1205 CD LYS A 78 17.971 7.119 -2.217 1.00 0.00 C ATOM 1206 CE LYS A 78 18.459 7.851 -3.484 1.00 0.00 C ATOM 1207 NZ LYS A 78 17.705 9.079 -3.831 1.00 0.00 N ATOM 0 H LYS A 78 13.566 6.849 -1.508 1.00 0.00 H new ATOM 0 HA LYS A 78 15.604 6.403 0.330 1.00 0.00 H new ATOM 0 HB2 LYS A 78 15.093 8.592 -1.678 1.00 0.00 H new ATOM 0 HB3 LYS A 78 16.520 8.585 -0.660 1.00 0.00 H new ATOM 0 HG2 LYS A 78 16.239 5.935 -1.738 1.00 0.00 H new ATOM 0 HG3 LYS A 78 15.994 7.053 -3.065 1.00 0.00 H new ATOM 0 HD2 LYS A 78 18.336 7.661 -1.345 1.00 0.00 H new ATOM 0 HD3 LYS A 78 18.430 6.131 -2.193 1.00 0.00 H new ATOM 0 HE2 LYS A 78 19.509 8.113 -3.352 1.00 0.00 H new ATOM 0 HE3 LYS A 78 18.407 7.161 -4.326 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 18.146 9.536 -4.654 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 16.722 8.830 -4.060 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 17.717 9.734 -3.023 1.00 0.00 H new ATOM 1221 N LYS A 79 13.722 9.015 1.124 1.00 0.00 N ATOM 1222 CA LYS A 79 13.362 9.903 2.229 1.00 0.00 C ATOM 1223 C LYS A 79 13.044 9.161 3.529 1.00 0.00 C ATOM 1224 O LYS A 79 13.178 9.728 4.616 1.00 0.00 O ATOM 1225 CB LYS A 79 12.196 10.808 1.848 1.00 0.00 C ATOM 1226 CG LYS A 79 12.677 11.828 0.800 1.00 0.00 C ATOM 1227 CD LYS A 79 11.725 11.942 -0.375 1.00 0.00 C ATOM 1228 CE LYS A 79 10.568 12.943 -0.235 1.00 0.00 C ATOM 1229 NZ LYS A 79 9.509 12.547 0.718 1.00 0.00 N ATOM 0 H LYS A 79 13.157 9.153 0.286 1.00 0.00 H new ATOM 0 HA LYS A 79 14.247 10.510 2.419 1.00 0.00 H new ATOM 0 HB2 LYS A 79 11.374 10.215 1.447 1.00 0.00 H new ATOM 0 HB3 LYS A 79 11.816 11.324 2.730 1.00 0.00 H new ATOM 0 HG2 LYS A 79 12.787 12.805 1.271 1.00 0.00 H new ATOM 0 HG3 LYS A 79 13.663 11.536 0.438 1.00 0.00 H new ATOM 0 HD2 LYS A 79 12.305 12.214 -1.257 1.00 0.00 H new ATOM 0 HD3 LYS A 79 11.300 10.956 -0.565 1.00 0.00 H new ATOM 0 HE2 LYS A 79 10.976 13.904 0.077 1.00 0.00 H new ATOM 0 HE3 LYS A 79 10.116 13.092 -1.216 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 8.774 13.282 0.745 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 9.087 11.646 0.414 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 9.920 12.434 1.667 1.00 0.00 H new ATOM 1243 N HIS A 80 12.594 7.911 3.441 1.00 0.00 N ATOM 1244 CA HIS A 80 12.121 7.102 4.548 1.00 0.00 C ATOM 1245 C HIS A 80 13.147 6.005 4.871 1.00 0.00 C ATOM 1246 O HIS A 80 12.820 4.993 5.501 1.00 0.00 O ATOM 1247 CB HIS A 80 10.737 6.585 4.151 1.00 0.00 C ATOM 1248 CG HIS A 80 9.778 7.688 3.759 1.00 0.00 C ATOM 1249 ND1 HIS A 80 9.020 7.744 2.613 1.00 0.00 N ATOM 1250 CD2 HIS A 80 9.688 8.915 4.357 1.00 0.00 C ATOM 1251 CE1 HIS A 80 8.486 8.972 2.535 1.00 0.00 C ATOM 1252 NE2 HIS A 80 8.862 9.724 3.578 1.00 0.00 N ATOM 0 H HIS A 80 12.550 7.416 2.550 1.00 0.00 H new ATOM 0 HA HIS A 80 12.019 7.666 5.475 1.00 0.00 H new ATOM 0 HB2 HIS A 80 10.841 5.890 3.318 1.00 0.00 H new ATOM 0 HB3 HIS A 80 10.314 6.023 4.984 1.00 0.00 H new ATOM 0 HD2 HIS A 80 10.174 9.207 5.276 1.00 0.00 H new ATOM 0 HE1 HIS A 80 7.840 9.309 1.738 1.00 0.00 H new ATOM 0 HE2 HIS A 80 8.598 10.691 3.764 1.00 0.00 H new ATOM 1260 N GLY A 81 14.403 6.209 4.455 1.00 0.00 N ATOM 1261 CA GLY A 81 15.551 5.423 4.876 1.00 0.00 C ATOM 1262 C GLY A 81 15.883 4.257 3.963 1.00 0.00 C ATOM 1263 O GLY A 81 16.909 3.612 4.173 1.00 0.00 O ATOM 0 H GLY A 81 14.647 6.949 3.797 1.00 0.00 H new ATOM 0 HA2 GLY A 81 16.420 6.078 4.939 1.00 0.00 H new ATOM 0 HA3 GLY A 81 15.366 5.041 5.880 1.00 0.00 H new ATOM 1267 N ALA A 82 15.045 4.020 2.957 1.00 0.00 N ATOM 1268 CA ALA A 82 15.161 2.888 2.057 1.00 0.00 C ATOM 1269 C ALA A 82 15.747 3.372 0.728 1.00 0.00 C ATOM 1270 O ALA A 82 15.068 4.048 -0.043 1.00 0.00 O ATOM 1271 CB ALA A 82 13.798 2.200 1.917 1.00 0.00 C ATOM 0 H ALA A 82 14.252 4.625 2.745 1.00 0.00 H new ATOM 0 HA ALA A 82 15.843 2.135 2.451 1.00 0.00 H new ATOM 0 HB1 ALA A 82 13.887 1.350 1.241 1.00 0.00 H new ATOM 0 HB2 ALA A 82 13.464 1.852 2.895 1.00 0.00 H new ATOM 0 HB3 ALA A 82 13.073 2.908 1.516 1.00 0.00 H new ATOM 1277 N ASP A 83 17.018 3.039 0.500 1.00 0.00 N ATOM 1278 CA ASP A 83 17.758 3.429 -0.695 1.00 0.00 C ATOM 1279 C ASP A 83 17.346 2.586 -1.911 1.00 0.00 C ATOM 1280 O ASP A 83 16.458 1.748 -1.822 1.00 0.00 O ATOM 1281 CB ASP A 83 19.261 3.304 -0.443 1.00 0.00 C ATOM 1282 CG ASP A 83 19.667 2.004 0.224 1.00 0.00 C ATOM 1283 OD1 ASP A 83 19.667 0.958 -0.439 1.00 0.00 O ATOM 1284 OD2 ASP A 83 20.082 2.034 1.416 1.00 0.00 O ATOM 0 H ASP A 83 17.569 2.482 1.153 1.00 0.00 H new ATOM 0 HA ASP A 83 17.518 4.469 -0.918 1.00 0.00 H new ATOM 0 HB2 ASP A 83 19.787 3.393 -1.393 1.00 0.00 H new ATOM 0 HB3 ASP A 83 19.585 4.137 0.180 1.00 0.00 H new ATOM 1289 N GLU A 84 18.021 2.817 -3.034 1.00 0.00 N ATOM 1290 CA GLU A 84 17.691 2.247 -4.333 1.00 0.00 C ATOM 1291 C GLU A 84 17.706 0.719 -4.266 1.00 0.00 C ATOM 1292 O GLU A 84 16.817 0.066 -4.802 1.00 0.00 O ATOM 1293 CB GLU A 84 18.706 2.716 -5.391 1.00 0.00 C ATOM 1294 CG GLU A 84 19.006 4.221 -5.423 1.00 0.00 C ATOM 1295 CD GLU A 84 17.829 5.142 -5.745 1.00 0.00 C ATOM 1296 OE1 GLU A 84 17.022 5.393 -4.824 1.00 0.00 O ATOM 1297 OE2 GLU A 84 17.696 5.617 -6.901 1.00 0.00 O ATOM 0 H GLU A 84 18.839 3.426 -3.064 1.00 0.00 H new ATOM 0 HA GLU A 84 16.692 2.585 -4.610 1.00 0.00 H new ATOM 0 HB2 GLU A 84 19.643 2.183 -5.227 1.00 0.00 H new ATOM 0 HB3 GLU A 84 18.339 2.419 -6.373 1.00 0.00 H new ATOM 0 HG2 GLU A 84 19.410 4.510 -4.453 1.00 0.00 H new ATOM 0 HG3 GLU A 84 19.790 4.398 -6.160 1.00 0.00 H new ATOM 1304 N THR A 85 18.733 0.148 -3.637 1.00 0.00 N ATOM 1305 CA THR A 85 18.838 -1.288 -3.442 1.00 0.00 C ATOM 1306 C THR A 85 17.763 -1.811 -2.481 1.00 0.00 C ATOM 1307 O THR A 85 17.188 -2.864 -2.749 1.00 0.00 O ATOM 1308 CB THR A 85 20.260 -1.661 -3.008 1.00 0.00 C ATOM 1309 OG1 THR A 85 21.185 -1.262 -4.020 1.00 0.00 O ATOM 1310 CG2 THR A 85 20.435 -3.155 -2.742 1.00 0.00 C ATOM 0 H THR A 85 19.515 0.675 -3.249 1.00 0.00 H new ATOM 0 HA THR A 85 18.648 -1.784 -4.394 1.00 0.00 H new ATOM 0 HB THR A 85 20.450 -1.139 -2.070 1.00 0.00 H new ATOM 0 HG1 THR A 85 22.095 -1.498 -3.743 1.00 0.00 H new ATOM 0 HG21 THR A 85 21.463 -3.353 -2.439 1.00 0.00 H new ATOM 0 HG22 THR A 85 19.756 -3.465 -1.947 1.00 0.00 H new ATOM 0 HG23 THR A 85 20.210 -3.715 -3.650 1.00 0.00 H new ATOM 1318 N MET A 86 17.490 -1.124 -1.370 1.00 0.00 N ATOM 1319 CA MET A 86 16.407 -1.497 -0.471 1.00 0.00 C ATOM 1320 C MET A 86 15.055 -1.493 -1.198 1.00 0.00 C ATOM 1321 O MET A 86 14.254 -2.399 -0.988 1.00 0.00 O ATOM 1322 CB MET A 86 16.396 -0.524 0.707 1.00 0.00 C ATOM 1323 CG MET A 86 17.371 -0.876 1.831 1.00 0.00 C ATOM 1324 SD MET A 86 17.006 0.063 3.338 1.00 0.00 S ATOM 1325 CE MET A 86 18.453 -0.265 4.347 1.00 0.00 C ATOM 0 H MET A 86 18.012 -0.299 -1.073 1.00 0.00 H new ATOM 0 HA MET A 86 16.570 -2.512 -0.108 1.00 0.00 H new ATOM 0 HB2 MET A 86 16.631 0.475 0.339 1.00 0.00 H new ATOM 0 HB3 MET A 86 15.387 -0.483 1.118 1.00 0.00 H new ATOM 0 HG2 MET A 86 17.315 -1.944 2.043 1.00 0.00 H new ATOM 0 HG3 MET A 86 18.391 -0.668 1.509 1.00 0.00 H new ATOM 0 HE1 MET A 86 18.356 0.253 5.301 1.00 0.00 H new ATOM 0 HE2 MET A 86 18.538 -1.337 4.524 1.00 0.00 H new ATOM 0 HE3 MET A 86 19.345 0.089 3.830 1.00 0.00 H new ATOM 1335 N ALA A 87 14.805 -0.535 -2.085 1.00 0.00 N ATOM 1336 CA ALA A 87 13.635 -0.563 -2.945 1.00 0.00 C ATOM 1337 C ALA A 87 13.717 -1.765 -3.880 1.00 0.00 C ATOM 1338 O ALA A 87 12.803 -2.583 -3.923 1.00 0.00 O ATOM 1339 CB ALA A 87 13.526 0.772 -3.691 1.00 0.00 C ATOM 0 H ALA A 87 15.406 0.277 -2.225 1.00 0.00 H new ATOM 0 HA ALA A 87 12.724 -0.681 -2.358 1.00 0.00 H new ATOM 0 HB1 ALA A 87 12.649 0.757 -4.338 1.00 0.00 H new ATOM 0 HB2 ALA A 87 13.431 1.585 -2.971 1.00 0.00 H new ATOM 0 HB3 ALA A 87 14.420 0.925 -4.295 1.00 0.00 H new ATOM 1345 N GLN A 88 14.825 -1.926 -4.606 1.00 0.00 N ATOM 1346 CA GLN A 88 14.996 -2.982 -5.594 1.00 0.00 C ATOM 1347 C GLN A 88 14.783 -4.373 -5.011 1.00 0.00 C ATOM 1348 O GLN A 88 14.237 -5.215 -5.724 1.00 0.00 O ATOM 1349 CB GLN A 88 16.396 -2.866 -6.226 1.00 0.00 C ATOM 1350 CG GLN A 88 16.730 -3.910 -7.303 1.00 0.00 C ATOM 1351 CD GLN A 88 15.914 -3.706 -8.569 1.00 0.00 C ATOM 1352 OE1 GLN A 88 16.354 -3.032 -9.498 1.00 0.00 O ATOM 1353 NE2 GLN A 88 14.726 -4.289 -8.623 1.00 0.00 N ATOM 0 H GLN A 88 15.638 -1.316 -4.520 1.00 0.00 H new ATOM 0 HA GLN A 88 14.231 -2.850 -6.359 1.00 0.00 H new ATOM 0 HB2 GLN A 88 16.495 -1.873 -6.665 1.00 0.00 H new ATOM 0 HB3 GLN A 88 17.140 -2.939 -5.433 1.00 0.00 H new ATOM 0 HG2 GLN A 88 17.792 -3.855 -7.544 1.00 0.00 H new ATOM 0 HG3 GLN A 88 16.544 -4.909 -6.909 1.00 0.00 H new ATOM 0 HE21 GLN A 88 14.393 -4.841 -7.833 1.00 0.00 H new ATOM 0 HE22 GLN A 88 14.145 -4.186 -9.455 1.00 0.00 H new ATOM 1362 N GLN A 89 15.193 -4.604 -3.761 1.00 0.00 N ATOM 1363 CA GLN A 89 14.860 -5.771 -2.961 1.00 0.00 C ATOM 1364 C GLN A 89 13.354 -6.002 -3.022 1.00 0.00 C ATOM 1365 O GLN A 89 12.905 -7.010 -3.562 1.00 0.00 O ATOM 1366 CB GLN A 89 15.337 -5.544 -1.510 1.00 0.00 C ATOM 1367 CG GLN A 89 16.778 -5.976 -1.241 1.00 0.00 C ATOM 1368 CD GLN A 89 16.942 -7.490 -1.104 1.00 0.00 C ATOM 1369 OE1 GLN A 89 16.012 -8.275 -1.281 1.00 0.00 O ATOM 1370 NE2 GLN A 89 18.137 -7.942 -0.760 1.00 0.00 N ATOM 0 H GLN A 89 15.794 -3.948 -3.262 1.00 0.00 H new ATOM 0 HA GLN A 89 15.360 -6.658 -3.349 1.00 0.00 H new ATOM 0 HB2 GLN A 89 15.238 -4.485 -1.270 1.00 0.00 H new ATOM 0 HB3 GLN A 89 14.676 -6.087 -0.835 1.00 0.00 H new ATOM 0 HG2 GLN A 89 17.413 -5.621 -2.052 1.00 0.00 H new ATOM 0 HG3 GLN A 89 17.129 -5.496 -0.328 1.00 0.00 H new ATOM 0 HE21 GLN A 89 18.907 -7.289 -0.614 1.00 0.00 H new ATOM 0 HE22 GLN A 89 18.289 -8.944 -0.641 1.00 0.00 H new ATOM 1379 N LEU A 90 12.583 -5.057 -2.489 1.00 0.00 N ATOM 1380 CA LEU A 90 11.143 -5.161 -2.307 1.00 0.00 C ATOM 1381 C LEU A 90 10.391 -5.243 -3.629 1.00 0.00 C ATOM 1382 O LEU A 90 9.331 -5.854 -3.680 1.00 0.00 O ATOM 1383 CB LEU A 90 10.658 -3.925 -1.551 1.00 0.00 C ATOM 1384 CG LEU A 90 11.291 -3.772 -0.152 1.00 0.00 C ATOM 1385 CD1 LEU A 90 11.048 -2.357 0.311 1.00 0.00 C ATOM 1386 CD2 LEU A 90 10.713 -4.722 0.901 1.00 0.00 C ATOM 0 H LEU A 90 12.960 -4.168 -2.161 1.00 0.00 H new ATOM 0 HA LEU A 90 10.945 -6.079 -1.754 1.00 0.00 H new ATOM 0 HB2 LEU A 90 10.882 -3.037 -2.142 1.00 0.00 H new ATOM 0 HB3 LEU A 90 9.574 -3.974 -1.447 1.00 0.00 H new ATOM 0 HG LEU A 90 12.349 -4.016 -0.250 1.00 0.00 H new ATOM 0 HD11 LEU A 90 11.485 -2.218 1.300 1.00 0.00 H new ATOM 0 HD12 LEU A 90 11.508 -1.661 -0.390 1.00 0.00 H new ATOM 0 HD13 LEU A 90 9.975 -2.169 0.359 1.00 0.00 H new ATOM 0 HD21 LEU A 90 11.210 -4.552 1.856 1.00 0.00 H new ATOM 0 HD22 LEU A 90 9.644 -4.537 1.010 1.00 0.00 H new ATOM 0 HD23 LEU A 90 10.873 -5.754 0.587 1.00 0.00 H new ATOM 1398 N ILE A 91 10.921 -4.641 -4.681 1.00 0.00 N ATOM 1399 CA ILE A 91 10.303 -4.619 -6.006 1.00 0.00 C ATOM 1400 C ILE A 91 10.469 -5.996 -6.673 1.00 0.00 C ATOM 1401 O ILE A 91 9.559 -6.513 -7.323 1.00 0.00 O ATOM 1402 CB ILE A 91 10.927 -3.443 -6.787 1.00 0.00 C ATOM 1403 CG1 ILE A 91 10.501 -2.109 -6.119 1.00 0.00 C ATOM 1404 CG2 ILE A 91 10.558 -3.487 -8.277 1.00 0.00 C ATOM 1405 CD1 ILE A 91 11.440 -0.937 -6.381 1.00 0.00 C ATOM 0 H ILE A 91 11.810 -4.143 -4.642 1.00 0.00 H new ATOM 0 HA ILE A 91 9.227 -4.449 -5.968 1.00 0.00 H new ATOM 0 HB ILE A 91 12.013 -3.525 -6.747 1.00 0.00 H new ATOM 0 HG12 ILE A 91 9.504 -1.844 -6.471 1.00 0.00 H new ATOM 0 HG13 ILE A 91 10.428 -2.265 -5.043 1.00 0.00 H new ATOM 0 HG21 ILE A 91 11.017 -2.642 -8.791 1.00 0.00 H new ATOM 0 HG22 ILE A 91 10.920 -4.418 -8.714 1.00 0.00 H new ATOM 0 HG23 ILE A 91 9.475 -3.432 -8.385 1.00 0.00 H new ATOM 0 HD11 ILE A 91 11.062 -0.048 -5.875 1.00 0.00 H new ATOM 0 HD12 ILE A 91 12.434 -1.175 -6.002 1.00 0.00 H new ATOM 0 HD13 ILE A 91 11.496 -0.748 -7.453 1.00 0.00 H new ATOM 1417 N ASP A 92 11.623 -6.643 -6.475 1.00 0.00 N ATOM 1418 CA ASP A 92 11.860 -8.025 -6.913 1.00 0.00 C ATOM 1419 C ASP A 92 10.888 -8.970 -6.217 1.00 0.00 C ATOM 1420 O ASP A 92 10.513 -10.018 -6.758 1.00 0.00 O ATOM 1421 CB ASP A 92 13.289 -8.452 -6.528 1.00 0.00 C ATOM 1422 CG ASP A 92 14.097 -9.228 -7.575 1.00 0.00 C ATOM 1423 OD1 ASP A 92 13.541 -9.761 -8.564 1.00 0.00 O ATOM 1424 OD2 ASP A 92 15.334 -9.298 -7.350 1.00 0.00 O ATOM 0 H ASP A 92 12.423 -6.221 -6.004 1.00 0.00 H new ATOM 0 HA ASP A 92 11.722 -8.072 -7.993 1.00 0.00 H new ATOM 0 HB2 ASP A 92 13.850 -7.555 -6.266 1.00 0.00 H new ATOM 0 HB3 ASP A 92 13.227 -9.064 -5.628 1.00 0.00 H new ATOM 1429 N ILE A 93 10.533 -8.618 -4.979 1.00 0.00 N ATOM 1430 CA ILE A 93 9.471 -9.239 -4.216 1.00 0.00 C ATOM 1431 C ILE A 93 8.103 -8.883 -4.814 1.00 0.00 C ATOM 1432 O ILE A 93 7.346 -9.822 -5.002 1.00 0.00 O ATOM 1433 CB ILE A 93 9.608 -8.943 -2.704 1.00 0.00 C ATOM 1434 CG1 ILE A 93 10.982 -9.420 -2.184 1.00 0.00 C ATOM 1435 CG2 ILE A 93 8.504 -9.657 -1.932 1.00 0.00 C ATOM 1436 CD1 ILE A 93 11.227 -9.137 -0.699 1.00 0.00 C ATOM 0 H ILE A 93 10.999 -7.866 -4.471 1.00 0.00 H new ATOM 0 HA ILE A 93 9.559 -10.323 -4.293 1.00 0.00 H new ATOM 0 HB ILE A 93 9.523 -7.867 -2.555 1.00 0.00 H new ATOM 0 HG12 ILE A 93 11.070 -10.493 -2.357 1.00 0.00 H new ATOM 0 HG13 ILE A 93 11.766 -8.937 -2.768 1.00 0.00 H new ATOM 0 HG21 ILE A 93 8.607 -9.444 -0.868 1.00 0.00 H new ATOM 0 HG22 ILE A 93 7.532 -9.307 -2.280 1.00 0.00 H new ATOM 0 HG23 ILE A 93 8.582 -10.732 -2.096 1.00 0.00 H new ATOM 0 HD11 ILE A 93 12.214 -9.504 -0.417 1.00 0.00 H new ATOM 0 HD12 ILE A 93 11.174 -8.063 -0.520 1.00 0.00 H new ATOM 0 HD13 ILE A 93 10.468 -9.642 -0.102 1.00 0.00 H new ATOM 1448 N VAL A 94 7.760 -7.631 -5.162 1.00 0.00 N ATOM 1449 CA VAL A 94 6.404 -7.302 -5.643 1.00 0.00 C ATOM 1450 C VAL A 94 6.121 -8.141 -6.877 1.00 0.00 C ATOM 1451 O VAL A 94 5.115 -8.856 -6.905 1.00 0.00 O ATOM 1452 CB VAL A 94 6.166 -5.784 -5.893 1.00 0.00 C ATOM 1453 CG1 VAL A 94 4.975 -5.468 -6.834 1.00 0.00 C ATOM 1454 CG2 VAL A 94 5.906 -5.042 -4.573 1.00 0.00 C ATOM 0 H VAL A 94 8.396 -6.835 -5.120 1.00 0.00 H new ATOM 0 HA VAL A 94 5.695 -7.546 -4.852 1.00 0.00 H new ATOM 0 HB VAL A 94 7.083 -5.447 -6.376 1.00 0.00 H new ATOM 0 HG11 VAL A 94 4.882 -4.389 -6.953 1.00 0.00 H new ATOM 0 HG12 VAL A 94 5.149 -5.926 -7.808 1.00 0.00 H new ATOM 0 HG13 VAL A 94 4.056 -5.867 -6.404 1.00 0.00 H new ATOM 0 HG21 VAL A 94 5.743 -3.984 -4.777 1.00 0.00 H new ATOM 0 HG22 VAL A 94 5.023 -5.459 -4.089 1.00 0.00 H new ATOM 0 HG23 VAL A 94 6.768 -5.156 -3.915 1.00 0.00 H new ATOM 1464 N HIS A 95 7.027 -8.136 -7.857 1.00 0.00 N ATOM 1465 CA HIS A 95 6.786 -8.893 -9.074 1.00 0.00 C ATOM 1466 C HIS A 95 6.875 -10.390 -8.767 1.00 0.00 C ATOM 1467 O HIS A 95 6.128 -11.193 -9.326 1.00 0.00 O ATOM 1468 CB HIS A 95 7.765 -8.437 -10.156 1.00 0.00 C ATOM 1469 CG HIS A 95 7.734 -6.948 -10.410 1.00 0.00 C ATOM 1470 ND1 HIS A 95 8.805 -6.183 -10.813 1.00 0.00 N ATOM 1471 CD2 HIS A 95 6.679 -6.099 -10.185 1.00 0.00 C ATOM 1472 CE1 HIS A 95 8.399 -4.907 -10.806 1.00 0.00 C ATOM 1473 NE2 HIS A 95 7.107 -4.804 -10.473 1.00 0.00 N ATOM 0 H HIS A 95 7.911 -7.628 -7.830 1.00 0.00 H new ATOM 0 HA HIS A 95 5.782 -8.709 -9.457 1.00 0.00 H new ATOM 0 HB2 HIS A 95 8.775 -8.727 -9.866 1.00 0.00 H new ATOM 0 HB3 HIS A 95 7.537 -8.961 -11.085 1.00 0.00 H new ATOM 0 HD2 HIS A 95 5.694 -6.383 -9.846 1.00 0.00 H new ATOM 0 HE1 HIS A 95 9.035 -4.066 -11.040 1.00 0.00 H new ATOM 0 HE2 HIS A 95 6.549 -3.951 -10.437 1.00 0.00 H new ATOM 1481 N GLY A 96 7.721 -10.776 -7.811 1.00 0.00 N ATOM 1482 CA GLY A 96 7.807 -12.137 -7.301 1.00 0.00 C ATOM 1483 C GLY A 96 6.525 -12.612 -6.632 1.00 0.00 C ATOM 1484 O GLY A 96 6.225 -13.806 -6.657 1.00 0.00 O ATOM 0 H GLY A 96 8.377 -10.136 -7.363 1.00 0.00 H new ATOM 0 HA2 GLY A 96 8.051 -12.811 -8.123 1.00 0.00 H new ATOM 0 HA3 GLY A 96 8.626 -12.198 -6.585 1.00 0.00 H new ATOM 1488 N CYS A 97 5.750 -11.681 -6.098 1.00 0.00 N ATOM 1489 CA CYS A 97 4.574 -11.942 -5.316 1.00 0.00 C ATOM 1490 C CYS A 97 3.361 -11.936 -6.205 1.00 0.00 C ATOM 1491 O CYS A 97 2.449 -12.713 -5.923 1.00 0.00 O ATOM 1492 CB CYS A 97 4.422 -10.920 -4.186 1.00 0.00 C ATOM 1493 SG CYS A 97 5.430 -11.226 -2.713 1.00 0.00 S ATOM 0 H CYS A 97 5.940 -10.685 -6.208 1.00 0.00 H new ATOM 0 HA CYS A 97 4.674 -12.926 -4.858 1.00 0.00 H new ATOM 0 HB2 CYS A 97 4.672 -9.933 -4.577 1.00 0.00 H new ATOM 0 HB3 CYS A 97 3.374 -10.889 -3.887 1.00 0.00 H new ATOM 1498 N GLU A 98 3.382 -11.180 -7.301 1.00 0.00 N ATOM 1499 CA GLU A 98 2.460 -11.421 -8.377 1.00 0.00 C ATOM 1500 C GLU A 98 2.617 -12.873 -8.809 1.00 0.00 C ATOM 1501 O GLU A 98 1.642 -13.602 -8.902 1.00 0.00 O ATOM 1502 CB GLU A 98 2.740 -10.556 -9.584 1.00 0.00 C ATOM 1503 CG GLU A 98 2.543 -9.079 -9.321 1.00 0.00 C ATOM 1504 CD GLU A 98 2.678 -8.346 -10.657 1.00 0.00 C ATOM 1505 OE1 GLU A 98 3.784 -8.378 -11.235 1.00 0.00 O ATOM 1506 OE2 GLU A 98 1.657 -7.920 -11.248 1.00 0.00 O ATOM 0 H GLU A 98 4.027 -10.405 -7.454 1.00 0.00 H new ATOM 0 HA GLU A 98 1.457 -11.191 -8.017 1.00 0.00 H new ATOM 0 HB2 GLU A 98 3.765 -10.726 -9.914 1.00 0.00 H new ATOM 0 HB3 GLU A 98 2.087 -10.863 -10.401 1.00 0.00 H new ATOM 0 HG2 GLU A 98 1.562 -8.896 -8.882 1.00 0.00 H new ATOM 0 HG3 GLU A 98 3.284 -8.715 -8.609 1.00 0.00 H new ATOM 1513 N LYS A 99 3.861 -13.307 -9.056 1.00 0.00 N ATOM 1514 CA LYS A 99 4.152 -14.647 -9.559 1.00 0.00 C ATOM 1515 C LYS A 99 3.662 -15.731 -8.601 1.00 0.00 C ATOM 1516 O LYS A 99 3.274 -16.805 -9.069 1.00 0.00 O ATOM 1517 CB LYS A 99 5.658 -14.781 -9.837 1.00 0.00 C ATOM 1518 CG LYS A 99 6.038 -14.215 -11.218 1.00 0.00 C ATOM 1519 CD LYS A 99 7.430 -13.572 -11.230 1.00 0.00 C ATOM 1520 CE LYS A 99 8.559 -14.565 -10.936 1.00 0.00 C ATOM 1521 NZ LYS A 99 9.890 -13.912 -10.875 1.00 0.00 N ATOM 0 H LYS A 99 4.692 -12.734 -8.911 1.00 0.00 H new ATOM 0 HA LYS A 99 3.609 -14.789 -10.493 1.00 0.00 H new ATOM 0 HB2 LYS A 99 6.218 -14.257 -9.063 1.00 0.00 H new ATOM 0 HB3 LYS A 99 5.945 -15.831 -9.783 1.00 0.00 H new ATOM 0 HG2 LYS A 99 6.006 -15.016 -11.956 1.00 0.00 H new ATOM 0 HG3 LYS A 99 5.297 -13.474 -11.519 1.00 0.00 H new ATOM 0 HD2 LYS A 99 7.603 -13.114 -12.204 1.00 0.00 H new ATOM 0 HD3 LYS A 99 7.459 -12.771 -10.492 1.00 0.00 H new ATOM 0 HE2 LYS A 99 8.360 -15.066 -9.989 1.00 0.00 H new ATOM 0 HE3 LYS A 99 8.571 -15.335 -11.707 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 10.618 -14.627 -10.674 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 10.095 -13.456 -11.787 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 9.891 -13.195 -10.122 1.00 0.00 H new ATOM 1535 N SER A 100 3.669 -15.456 -7.292 1.00 0.00 N ATOM 1536 CA SER A 100 3.140 -16.359 -6.282 1.00 0.00 C ATOM 1537 C SER A 100 1.610 -16.382 -6.204 1.00 0.00 C ATOM 1538 O SER A 100 1.043 -17.248 -5.530 1.00 0.00 O ATOM 1539 CB SER A 100 3.708 -15.978 -4.916 1.00 0.00 C ATOM 1540 OG SER A 100 3.089 -14.837 -4.349 1.00 0.00 O ATOM 0 H SER A 100 4.047 -14.590 -6.907 1.00 0.00 H new ATOM 0 HA SER A 100 3.449 -17.362 -6.576 1.00 0.00 H new ATOM 0 HB2 SER A 100 3.593 -16.821 -4.235 1.00 0.00 H new ATOM 0 HB3 SER A 100 4.777 -15.791 -5.014 1.00 0.00 H new ATOM 0 HG SER A 100 2.915 -14.176 -5.051 1.00 0.00 H new ATOM 1546 N THR A 101 0.941 -15.393 -6.794 1.00 0.00 N ATOM 1547 CA THR A 101 -0.470 -15.134 -6.580 1.00 0.00 C ATOM 1548 C THR A 101 -1.199 -15.417 -7.891 1.00 0.00 C ATOM 1549 O THR A 101 -1.108 -14.629 -8.833 1.00 0.00 O ATOM 1550 CB THR A 101 -0.710 -13.716 -6.062 1.00 0.00 C ATOM 1551 OG1 THR A 101 0.083 -13.468 -4.919 1.00 0.00 O ATOM 1552 CG2 THR A 101 -2.160 -13.577 -5.611 1.00 0.00 C ATOM 0 H THR A 101 1.378 -14.741 -7.445 1.00 0.00 H new ATOM 0 HA THR A 101 -0.864 -15.790 -5.803 1.00 0.00 H new ATOM 0 HB THR A 101 -0.466 -13.022 -6.866 1.00 0.00 H new ATOM 0 HG1 THR A 101 0.946 -13.094 -5.194 1.00 0.00 H new ATOM 0 HG21 THR A 101 -2.331 -12.566 -5.242 1.00 0.00 H new ATOM 0 HG22 THR A 101 -2.823 -13.773 -6.453 1.00 0.00 H new ATOM 0 HG23 THR A 101 -2.364 -14.293 -4.815 1.00 0.00 H new ATOM 1560 N PRO A 102 -1.920 -16.543 -7.975 1.00 0.00 N ATOM 1561 CA PRO A 102 -2.554 -16.944 -9.211 1.00 0.00 C ATOM 1562 C PRO A 102 -3.643 -15.935 -9.547 1.00 0.00 C ATOM 1563 O PRO A 102 -4.332 -15.471 -8.634 1.00 0.00 O ATOM 1564 CB PRO A 102 -3.105 -18.341 -8.941 1.00 0.00 C ATOM 1565 CG PRO A 102 -3.423 -18.310 -7.450 1.00 0.00 C ATOM 1566 CD PRO A 102 -2.356 -17.382 -6.873 1.00 0.00 C ATOM 0 HA PRO A 102 -1.880 -16.970 -10.067 1.00 0.00 H new ATOM 0 HB2 PRO A 102 -3.994 -18.545 -9.538 1.00 0.00 H new ATOM 0 HB3 PRO A 102 -2.375 -19.115 -9.181 1.00 0.00 H new ATOM 0 HG2 PRO A 102 -4.428 -17.931 -7.262 1.00 0.00 H new ATOM 0 HG3 PRO A 102 -3.370 -19.305 -7.008 1.00 0.00 H new ATOM 0 HD2 PRO A 102 -2.761 -16.780 -6.060 1.00 0.00 H new ATOM 0 HD3 PRO A 102 -1.523 -17.952 -6.463 1.00 0.00 H new ATOM 1574 N ALA A 103 -3.782 -15.613 -10.835 1.00 0.00 N ATOM 1575 CA ALA A 103 -4.757 -14.702 -11.408 1.00 0.00 C ATOM 1576 C ALA A 103 -6.145 -15.039 -10.873 1.00 0.00 C ATOM 1577 O ALA A 103 -6.799 -15.965 -11.366 1.00 0.00 O ATOM 1578 CB ALA A 103 -4.673 -14.772 -12.939 1.00 0.00 C ATOM 0 H ALA A 103 -3.172 -16.013 -11.548 1.00 0.00 H new ATOM 0 HA ALA A 103 -4.545 -13.673 -11.118 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -5.403 -14.090 -13.375 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -3.672 -14.487 -13.262 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -4.885 -15.789 -13.269 1.00 0.00 H new ATOM 1584 N ASN A 104 -6.537 -14.330 -9.816 1.00 0.00 N ATOM 1585 CA ASN A 104 -7.789 -14.548 -9.119 1.00 0.00 C ATOM 1586 C ASN A 104 -8.892 -13.936 -9.953 1.00 0.00 C ATOM 1587 O ASN A 104 -8.675 -12.921 -10.627 1.00 0.00 O ATOM 1588 CB ASN A 104 -7.715 -13.986 -7.686 1.00 0.00 C ATOM 1589 CG ASN A 104 -8.895 -14.367 -6.821 1.00 0.00 C ATOM 1590 OD1 ASN A 104 -10.036 -13.980 -7.032 1.00 0.00 O ATOM 1591 ND2 ASN A 104 -8.649 -15.133 -5.791 1.00 0.00 N ATOM 0 H ASN A 104 -5.978 -13.575 -9.418 1.00 0.00 H new ATOM 0 HA ASN A 104 -8.000 -15.611 -9.001 1.00 0.00 H new ATOM 0 HB2 ASN A 104 -6.800 -14.341 -7.213 1.00 0.00 H new ATOM 0 HB3 ASN A 104 -7.648 -12.899 -7.735 1.00 0.00 H new ATOM 0 HD21 ASN A 104 -9.407 -15.406 -5.166 1.00 0.00 H new ATOM 0 HD22 ASN A 104 -7.699 -15.458 -5.612 1.00 0.00 H new ATOM 1598 N ASP A 105 -10.067 -14.533 -9.800 1.00 0.00 N ATOM 1599 CA ASP A 105 -11.371 -14.024 -10.179 1.00 0.00 C ATOM 1600 C ASP A 105 -11.522 -12.523 -9.946 1.00 0.00 C ATOM 1601 O ASP A 105 -12.216 -11.839 -10.697 1.00 0.00 O ATOM 1602 CB ASP A 105 -12.382 -14.743 -9.288 1.00 0.00 C ATOM 1603 CG ASP A 105 -13.786 -14.474 -9.762 1.00 0.00 C ATOM 1604 OD1 ASP A 105 -14.143 -15.118 -10.769 1.00 0.00 O ATOM 1605 OD2 ASP A 105 -14.513 -13.674 -9.127 1.00 0.00 O ATOM 0 H ASP A 105 -10.134 -15.457 -9.374 1.00 0.00 H new ATOM 0 HA ASP A 105 -11.519 -14.197 -11.245 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -12.187 -15.815 -9.299 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -12.269 -14.409 -8.257 1.00 0.00 H new ATOM 1610 N ASP A 106 -10.908 -12.024 -8.872 1.00 0.00 N ATOM 1611 CA ASP A 106 -11.209 -10.725 -8.299 1.00 0.00 C ATOM 1612 C ASP A 106 -9.865 -10.044 -8.062 1.00 0.00 C ATOM 1613 O ASP A 106 -9.077 -10.521 -7.239 1.00 0.00 O ATOM 1614 CB ASP A 106 -11.985 -10.969 -6.998 1.00 0.00 C ATOM 1615 CG ASP A 106 -12.976 -9.872 -6.623 1.00 0.00 C ATOM 1616 OD1 ASP A 106 -12.827 -8.721 -7.096 1.00 0.00 O ATOM 1617 OD2 ASP A 106 -13.942 -10.216 -5.898 1.00 0.00 O ATOM 0 H ASP A 106 -10.175 -12.526 -8.372 1.00 0.00 H new ATOM 0 HA ASP A 106 -11.821 -10.087 -8.937 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -12.526 -11.911 -7.086 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -11.271 -11.087 -6.183 1.00 0.00 H new ATOM 1622 N LYS A 107 -9.530 -8.989 -8.813 1.00 0.00 N ATOM 1623 CA LYS A 107 -8.309 -8.236 -8.655 1.00 0.00 C ATOM 1624 C LYS A 107 -8.223 -7.687 -7.237 1.00 0.00 C ATOM 1625 O LYS A 107 -7.117 -7.636 -6.709 1.00 0.00 O ATOM 1626 CB LYS A 107 -8.227 -7.163 -9.755 1.00 0.00 C ATOM 1627 CG LYS A 107 -6.799 -7.060 -10.307 1.00 0.00 C ATOM 1628 CD LYS A 107 -5.884 -6.581 -9.205 1.00 0.00 C ATOM 1629 CE LYS A 107 -4.721 -5.647 -9.594 1.00 0.00 C ATOM 1630 NZ LYS A 107 -3.632 -6.249 -10.399 1.00 0.00 N ATOM 0 H LYS A 107 -10.125 -8.637 -9.563 1.00 0.00 H new ATOM 0 HA LYS A 107 -7.434 -8.873 -8.782 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -8.917 -7.409 -10.562 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -8.537 -6.199 -9.353 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -6.467 -8.030 -10.678 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -6.769 -6.369 -11.149 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -6.494 -6.066 -8.463 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -5.460 -7.458 -8.716 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -5.131 -4.804 -10.151 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -4.287 -5.244 -8.679 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -2.926 -5.520 -10.628 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -3.179 -7.011 -9.856 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -4.026 -6.638 -11.279 1.00 0.00 H new ATOM 1644 N CYS A 108 -9.338 -7.364 -6.578 1.00 0.00 N ATOM 1645 CA CYS A 108 -9.343 -7.037 -5.159 1.00 0.00 C ATOM 1646 C CYS A 108 -8.624 -8.154 -4.373 1.00 0.00 C ATOM 1647 O CYS A 108 -7.645 -7.905 -3.670 1.00 0.00 O ATOM 1648 CB CYS A 108 -10.789 -6.889 -4.666 1.00 0.00 C ATOM 1649 SG CYS A 108 -11.974 -5.831 -5.554 1.00 0.00 S ATOM 0 H CYS A 108 -10.258 -7.323 -7.016 1.00 0.00 H new ATOM 0 HA CYS A 108 -8.820 -6.094 -5.000 1.00 0.00 H new ATOM 0 HB2 CYS A 108 -11.219 -7.890 -4.630 1.00 0.00 H new ATOM 0 HB3 CYS A 108 -10.742 -6.525 -3.640 1.00 0.00 H new ATOM 1654 N ILE A 109 -9.086 -9.401 -4.509 1.00 0.00 N ATOM 1655 CA ILE A 109 -8.563 -10.565 -3.792 1.00 0.00 C ATOM 1656 C ILE A 109 -7.136 -10.902 -4.248 1.00 0.00 C ATOM 1657 O ILE A 109 -6.290 -11.203 -3.405 1.00 0.00 O ATOM 1658 CB ILE A 109 -9.546 -11.749 -3.962 1.00 0.00 C ATOM 1659 CG1 ILE A 109 -10.930 -11.379 -3.373 1.00 0.00 C ATOM 1660 CG2 ILE A 109 -9.001 -13.010 -3.271 1.00 0.00 C ATOM 1661 CD1 ILE A 109 -11.996 -12.460 -3.570 1.00 0.00 C ATOM 0 H ILE A 109 -9.855 -9.633 -5.138 1.00 0.00 H new ATOM 0 HA ILE A 109 -8.488 -10.341 -2.728 1.00 0.00 H new ATOM 0 HB ILE A 109 -9.655 -11.957 -5.026 1.00 0.00 H new ATOM 0 HG12 ILE A 109 -10.819 -11.181 -2.307 1.00 0.00 H new ATOM 0 HG13 ILE A 109 -11.275 -10.454 -3.834 1.00 0.00 H new ATOM 0 HG21 ILE A 109 -9.707 -13.830 -3.402 1.00 0.00 H new ATOM 0 HG22 ILE A 109 -8.042 -13.282 -3.713 1.00 0.00 H new ATOM 0 HG23 ILE A 109 -8.867 -12.813 -2.207 1.00 0.00 H new ATOM 0 HD11 ILE A 109 -12.937 -12.128 -3.131 1.00 0.00 H new ATOM 0 HD12 ILE A 109 -12.137 -12.642 -4.635 1.00 0.00 H new ATOM 0 HD13 ILE A 109 -11.674 -13.381 -3.084 1.00 0.00 H new ATOM 1673 N TRP A 110 -6.832 -10.863 -5.550 1.00 0.00 N ATOM 1674 CA TRP A 110 -5.467 -11.054 -6.044 1.00 0.00 C ATOM 1675 C TRP A 110 -4.539 -10.053 -5.354 1.00 0.00 C ATOM 1676 O TRP A 110 -3.554 -10.466 -4.754 1.00 0.00 O ATOM 1677 CB TRP A 110 -5.400 -10.935 -7.571 1.00 0.00 C ATOM 1678 CG TRP A 110 -4.031 -11.049 -8.167 1.00 0.00 C ATOM 1679 CD1 TRP A 110 -3.426 -12.177 -8.594 1.00 0.00 C ATOM 1680 CD2 TRP A 110 -3.068 -9.987 -8.395 1.00 0.00 C ATOM 1681 NE1 TRP A 110 -2.165 -11.883 -9.077 1.00 0.00 N ATOM 1682 CE2 TRP A 110 -1.905 -10.530 -9.011 1.00 0.00 C ATOM 1683 CE3 TRP A 110 -3.066 -8.610 -8.117 1.00 0.00 C ATOM 1684 CZ2 TRP A 110 -0.826 -9.717 -9.399 1.00 0.00 C ATOM 1685 CZ3 TRP A 110 -1.975 -7.803 -8.442 1.00 0.00 C ATOM 1686 CH2 TRP A 110 -0.876 -8.338 -9.117 1.00 0.00 C ATOM 0 H TRP A 110 -7.520 -10.699 -6.285 1.00 0.00 H new ATOM 0 HA TRP A 110 -5.137 -12.064 -5.801 1.00 0.00 H new ATOM 0 HB2 TRP A 110 -6.032 -11.709 -8.006 1.00 0.00 H new ATOM 0 HB3 TRP A 110 -5.825 -9.975 -7.862 1.00 0.00 H new ATOM 0 HD1 TRP A 110 -3.863 -13.164 -8.563 1.00 0.00 H new ATOM 0 HE1 TRP A 110 -1.510 -12.578 -9.436 1.00 0.00 H new ATOM 0 HE3 TRP A 110 -3.928 -8.166 -7.641 1.00 0.00 H new ATOM 0 HZ2 TRP A 110 0.028 -10.143 -9.905 1.00 0.00 H new ATOM 0 HZ3 TRP A 110 -1.981 -6.758 -8.170 1.00 0.00 H new ATOM 0 HH2 TRP A 110 -0.064 -7.694 -9.423 1.00 0.00 H new ATOM 1697 N THR A 111 -4.873 -8.761 -5.376 1.00 0.00 N ATOM 1698 CA THR A 111 -4.062 -7.717 -4.747 1.00 0.00 C ATOM 1699 C THR A 111 -3.786 -8.012 -3.268 1.00 0.00 C ATOM 1700 O THR A 111 -2.649 -7.857 -2.813 1.00 0.00 O ATOM 1701 CB THR A 111 -4.733 -6.352 -4.946 1.00 0.00 C ATOM 1702 OG1 THR A 111 -4.980 -6.159 -6.318 1.00 0.00 O ATOM 1703 CG2 THR A 111 -3.882 -5.183 -4.458 1.00 0.00 C ATOM 0 H THR A 111 -5.715 -8.409 -5.831 1.00 0.00 H new ATOM 0 HA THR A 111 -3.087 -7.698 -5.234 1.00 0.00 H new ATOM 0 HB THR A 111 -5.651 -6.367 -4.358 1.00 0.00 H new ATOM 0 HG1 THR A 111 -5.885 -6.468 -6.534 1.00 0.00 H new ATOM 0 HG21 THR A 111 -4.416 -4.248 -4.629 1.00 0.00 H new ATOM 0 HG22 THR A 111 -3.683 -5.298 -3.393 1.00 0.00 H new ATOM 0 HG23 THR A 111 -2.939 -5.167 -5.004 1.00 0.00 H new ATOM 1711 N LEU A 112 -4.783 -8.475 -2.503 1.00 0.00 N ATOM 1712 CA LEU A 112 -4.532 -8.904 -1.138 1.00 0.00 C ATOM 1713 C LEU A 112 -3.535 -10.056 -1.086 1.00 0.00 C ATOM 1714 O LEU A 112 -2.602 -10.011 -0.291 1.00 0.00 O ATOM 1715 CB LEU A 112 -5.812 -9.305 -0.452 1.00 0.00 C ATOM 1716 CG LEU A 112 -5.607 -9.471 1.068 1.00 0.00 C ATOM 1717 CD1 LEU A 112 -4.714 -8.453 1.798 1.00 0.00 C ATOM 1718 CD2 LEU A 112 -6.994 -9.281 1.628 1.00 0.00 C ATOM 0 H LEU A 112 -5.753 -8.558 -2.807 1.00 0.00 H new ATOM 0 HA LEU A 112 -4.101 -8.053 -0.611 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -6.578 -8.552 -0.637 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -6.176 -10.241 -0.876 1.00 0.00 H new ATOM 0 HG LEU A 112 -5.103 -10.426 1.217 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -4.668 -8.703 2.858 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -3.710 -8.481 1.375 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -5.130 -7.453 1.679 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -6.965 -9.379 2.713 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -7.361 -8.289 1.363 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -7.661 -10.037 1.213 1.00 0.00 H new ATOM 1730 N GLY A 113 -3.718 -11.067 -1.931 1.00 0.00 N ATOM 1731 CA GLY A 113 -2.794 -12.173 -2.118 1.00 0.00 C ATOM 1732 C GLY A 113 -1.362 -11.684 -2.291 1.00 0.00 C ATOM 1733 O GLY A 113 -0.498 -12.089 -1.517 1.00 0.00 O ATOM 0 H GLY A 113 -4.545 -11.138 -2.524 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -2.849 -12.843 -1.260 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -3.090 -12.751 -2.993 1.00 0.00 H new ATOM 1737 N VAL A 114 -1.110 -10.776 -3.236 1.00 0.00 N ATOM 1738 CA VAL A 114 0.209 -10.201 -3.486 1.00 0.00 C ATOM 1739 C VAL A 114 0.736 -9.555 -2.195 1.00 0.00 C ATOM 1740 O VAL A 114 1.844 -9.864 -1.770 1.00 0.00 O ATOM 1741 CB VAL A 114 0.156 -9.221 -4.675 1.00 0.00 C ATOM 1742 CG1 VAL A 114 1.539 -8.645 -5.006 1.00 0.00 C ATOM 1743 CG2 VAL A 114 -0.321 -9.946 -5.936 1.00 0.00 C ATOM 0 H VAL A 114 -1.832 -10.414 -3.859 1.00 0.00 H new ATOM 0 HA VAL A 114 0.912 -10.984 -3.770 1.00 0.00 H new ATOM 0 HB VAL A 114 -0.524 -8.421 -4.383 1.00 0.00 H new ATOM 0 HG11 VAL A 114 1.455 -7.960 -5.850 1.00 0.00 H new ATOM 0 HG12 VAL A 114 1.927 -8.109 -4.140 1.00 0.00 H new ATOM 0 HG13 VAL A 114 2.219 -9.457 -5.264 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -0.354 -9.244 -6.769 1.00 0.00 H new ATOM 0 HG22 VAL A 114 0.368 -10.757 -6.172 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -1.317 -10.355 -5.766 1.00 0.00 H new ATOM 1753 N ALA A 115 -0.040 -8.703 -1.514 1.00 0.00 N ATOM 1754 CA ALA A 115 0.388 -8.063 -0.263 1.00 0.00 C ATOM 1755 C ALA A 115 0.661 -9.084 0.866 1.00 0.00 C ATOM 1756 O ALA A 115 1.508 -8.877 1.738 1.00 0.00 O ATOM 1757 CB ALA A 115 -0.690 -7.058 0.157 1.00 0.00 C ATOM 0 H ALA A 115 -0.979 -8.438 -1.813 1.00 0.00 H new ATOM 0 HA ALA A 115 1.335 -7.554 -0.440 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -0.391 -6.571 1.085 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -0.812 -6.307 -0.624 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -1.635 -7.580 0.309 1.00 0.00 H new ATOM 1763 N THR A 116 -0.049 -10.207 0.861 1.00 0.00 N ATOM 1764 CA THR A 116 0.044 -11.294 1.831 1.00 0.00 C ATOM 1765 C THR A 116 1.149 -12.295 1.435 1.00 0.00 C ATOM 1766 O THR A 116 1.559 -13.131 2.243 1.00 0.00 O ATOM 1767 CB THR A 116 -1.337 -11.966 1.938 1.00 0.00 C ATOM 1768 OG1 THR A 116 -2.329 -10.983 2.172 1.00 0.00 O ATOM 1769 CG2 THR A 116 -1.444 -12.963 3.088 1.00 0.00 C ATOM 0 H THR A 116 -0.745 -10.394 0.139 1.00 0.00 H new ATOM 0 HA THR A 116 0.325 -10.903 2.809 1.00 0.00 H new ATOM 0 HB THR A 116 -1.477 -12.495 0.996 1.00 0.00 H new ATOM 0 HG1 THR A 116 -2.755 -10.740 1.324 1.00 0.00 H new ATOM 0 HG21 THR A 116 -2.444 -13.397 3.102 1.00 0.00 H new ATOM 0 HG22 THR A 116 -0.707 -13.755 2.953 1.00 0.00 H new ATOM 0 HG23 THR A 116 -1.258 -12.451 4.032 1.00 0.00 H new ATOM 1777 N CYS A 117 1.663 -12.240 0.212 1.00 0.00 N ATOM 1778 CA CYS A 117 3.028 -12.631 -0.077 1.00 0.00 C ATOM 1779 C CYS A 117 3.966 -11.574 0.513 1.00 0.00 C ATOM 1780 O CYS A 117 4.704 -11.919 1.434 1.00 0.00 O ATOM 1781 CB CYS A 117 3.206 -12.892 -1.574 1.00 0.00 C ATOM 1782 SG CYS A 117 4.907 -13.104 -2.144 1.00 0.00 S ATOM 0 H CYS A 117 1.141 -11.922 -0.604 1.00 0.00 H new ATOM 0 HA CYS A 117 3.284 -13.579 0.396 1.00 0.00 H new ATOM 0 HB2 CYS A 117 2.642 -13.787 -1.836 1.00 0.00 H new ATOM 0 HB3 CYS A 117 2.761 -12.062 -2.123 1.00 0.00 H new ATOM 1787 N PHE A 118 3.895 -10.295 0.097 1.00 0.00 N ATOM 1788 CA PHE A 118 4.928 -9.284 0.323 1.00 0.00 C ATOM 1789 C PHE A 118 5.443 -9.314 1.767 1.00 0.00 C ATOM 1790 O PHE A 118 6.605 -9.590 2.046 1.00 0.00 O ATOM 1791 CB PHE A 118 4.383 -7.897 -0.099 1.00 0.00 C ATOM 1792 CG PHE A 118 5.348 -6.716 -0.041 1.00 0.00 C ATOM 1793 CD1 PHE A 118 6.686 -6.907 0.324 1.00 0.00 C ATOM 1794 CD2 PHE A 118 4.949 -5.424 -0.438 1.00 0.00 C ATOM 1795 CE1 PHE A 118 7.596 -5.849 0.282 1.00 0.00 C ATOM 1796 CE2 PHE A 118 5.835 -4.336 -0.353 1.00 0.00 C ATOM 1797 CZ PHE A 118 7.168 -4.546 -0.003 1.00 0.00 C ATOM 0 H PHE A 118 3.093 -9.934 -0.419 1.00 0.00 H new ATOM 0 HA PHE A 118 5.797 -9.506 -0.296 1.00 0.00 H new ATOM 0 HB2 PHE A 118 4.011 -7.978 -1.120 1.00 0.00 H new ATOM 0 HB3 PHE A 118 3.527 -7.664 0.535 1.00 0.00 H new ATOM 0 HD1 PHE A 118 7.018 -7.884 0.642 1.00 0.00 H new ATOM 0 HD2 PHE A 118 3.948 -5.268 -0.813 1.00 0.00 H new ATOM 0 HE1 PHE A 118 8.642 -6.037 0.472 1.00 0.00 H new ATOM 0 HE2 PHE A 118 5.483 -3.336 -0.559 1.00 0.00 H new ATOM 0 HZ PHE A 118 7.859 -3.718 0.048 1.00 0.00 H new ATOM 1807 N LYS A 119 4.557 -9.117 2.727 1.00 0.00 N ATOM 1808 CA LYS A 119 4.870 -8.988 4.142 1.00 0.00 C ATOM 1809 C LYS A 119 5.684 -10.172 4.681 1.00 0.00 C ATOM 1810 O LYS A 119 6.684 -9.979 5.372 1.00 0.00 O ATOM 1811 CB LYS A 119 3.541 -8.874 4.889 1.00 0.00 C ATOM 1812 CG LYS A 119 3.571 -7.786 5.968 1.00 0.00 C ATOM 1813 CD LYS A 119 2.465 -7.975 7.015 1.00 0.00 C ATOM 1814 CE LYS A 119 2.906 -8.747 8.270 1.00 0.00 C ATOM 1815 NZ LYS A 119 2.859 -10.218 8.126 1.00 0.00 N ATOM 0 H LYS A 119 3.558 -9.039 2.536 1.00 0.00 H new ATOM 0 HA LYS A 119 5.492 -8.106 4.291 1.00 0.00 H new ATOM 0 HB2 LYS A 119 2.745 -8.655 4.178 1.00 0.00 H new ATOM 0 HB3 LYS A 119 3.302 -9.833 5.350 1.00 0.00 H new ATOM 0 HG2 LYS A 119 4.542 -7.795 6.463 1.00 0.00 H new ATOM 0 HG3 LYS A 119 3.461 -6.808 5.499 1.00 0.00 H new ATOM 0 HD2 LYS A 119 2.095 -6.995 7.317 1.00 0.00 H new ATOM 0 HD3 LYS A 119 1.630 -8.502 6.553 1.00 0.00 H new ATOM 0 HE2 LYS A 119 3.923 -8.451 8.526 1.00 0.00 H new ATOM 0 HE3 LYS A 119 2.269 -8.455 9.105 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 3.105 -10.664 9.033 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 1.901 -10.509 7.846 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 3.538 -10.517 7.398 1.00 0.00 H new ATOM 1829 N ALA A 120 5.316 -11.395 4.310 1.00 0.00 N ATOM 1830 CA ALA A 120 5.995 -12.628 4.680 1.00 0.00 C ATOM 1831 C ALA A 120 7.408 -12.668 4.097 1.00 0.00 C ATOM 1832 O ALA A 120 8.312 -13.243 4.704 1.00 0.00 O ATOM 1833 CB ALA A 120 5.175 -13.832 4.195 1.00 0.00 C ATOM 0 H ALA A 120 4.501 -11.558 3.718 1.00 0.00 H new ATOM 0 HA ALA A 120 6.082 -12.670 5.766 1.00 0.00 H new ATOM 0 HB1 ALA A 120 5.684 -14.755 4.473 1.00 0.00 H new ATOM 0 HB2 ALA A 120 4.188 -13.810 4.657 1.00 0.00 H new ATOM 0 HB3 ALA A 120 5.070 -13.788 3.111 1.00 0.00 H new ATOM 1839 N GLU A 121 7.614 -12.050 2.939 1.00 0.00 N ATOM 1840 CA GLU A 121 8.910 -11.911 2.310 1.00 0.00 C ATOM 1841 C GLU A 121 9.714 -10.785 2.968 1.00 0.00 C ATOM 1842 O GLU A 121 10.929 -10.904 3.056 1.00 0.00 O ATOM 1843 CB GLU A 121 8.758 -11.624 0.821 1.00 0.00 C ATOM 1844 CG GLU A 121 7.880 -12.601 0.032 1.00 0.00 C ATOM 1845 CD GLU A 121 8.674 -13.823 -0.419 1.00 0.00 C ATOM 1846 OE1 GLU A 121 9.010 -14.680 0.429 1.00 0.00 O ATOM 1847 OE2 GLU A 121 8.967 -13.957 -1.630 1.00 0.00 O ATOM 0 H GLU A 121 6.859 -11.622 2.402 1.00 0.00 H new ATOM 0 HA GLU A 121 9.445 -12.852 2.438 1.00 0.00 H new ATOM 0 HB2 GLU A 121 8.345 -10.622 0.705 1.00 0.00 H new ATOM 0 HB3 GLU A 121 9.750 -11.614 0.370 1.00 0.00 H new ATOM 0 HG2 GLU A 121 7.040 -12.919 0.650 1.00 0.00 H new ATOM 0 HG3 GLU A 121 7.462 -12.095 -0.838 1.00 0.00 H new ATOM 1854 N ILE A 122 9.096 -9.714 3.485 1.00 0.00 N ATOM 1855 CA ILE A 122 9.798 -8.766 4.352 1.00 0.00 C ATOM 1856 C ILE A 122 10.287 -9.514 5.602 1.00 0.00 C ATOM 1857 O ILE A 122 11.406 -9.291 6.052 1.00 0.00 O ATOM 1858 CB ILE A 122 8.953 -7.509 4.681 1.00 0.00 C ATOM 1859 CG1 ILE A 122 8.433 -6.807 3.415 1.00 0.00 C ATOM 1860 CG2 ILE A 122 9.741 -6.526 5.566 1.00 0.00 C ATOM 1861 CD1 ILE A 122 7.559 -5.579 3.714 1.00 0.00 C ATOM 0 H ILE A 122 8.116 -9.486 3.317 1.00 0.00 H new ATOM 0 HA ILE A 122 10.663 -8.370 3.821 1.00 0.00 H new ATOM 0 HB ILE A 122 8.082 -7.853 5.239 1.00 0.00 H new ATOM 0 HG12 ILE A 122 9.282 -6.500 2.804 1.00 0.00 H new ATOM 0 HG13 ILE A 122 7.857 -7.519 2.824 1.00 0.00 H new ATOM 0 HG21 ILE A 122 9.123 -5.654 5.781 1.00 0.00 H new ATOM 0 HG22 ILE A 122 10.014 -7.016 6.501 1.00 0.00 H new ATOM 0 HG23 ILE A 122 10.645 -6.211 5.044 1.00 0.00 H new ATOM 0 HD11 ILE A 122 7.226 -5.132 2.777 1.00 0.00 H new ATOM 0 HD12 ILE A 122 6.691 -5.884 4.299 1.00 0.00 H new ATOM 0 HD13 ILE A 122 8.139 -4.849 4.278 1.00 0.00 H new ATOM 1873 N HIS A 123 9.526 -10.492 6.106 1.00 0.00 N ATOM 1874 CA HIS A 123 9.993 -11.394 7.164 1.00 0.00 C ATOM 1875 C HIS A 123 11.195 -12.258 6.714 1.00 0.00 C ATOM 1876 O HIS A 123 11.882 -12.828 7.559 1.00 0.00 O ATOM 1877 CB HIS A 123 8.821 -12.265 7.657 1.00 0.00 C ATOM 1878 CG HIS A 123 8.600 -12.269 9.152 1.00 0.00 C ATOM 1879 ND1 HIS A 123 8.404 -13.385 9.938 1.00 0.00 N ATOM 1880 CD2 HIS A 123 8.412 -11.169 9.949 1.00 0.00 C ATOM 1881 CE1 HIS A 123 8.095 -12.962 11.173 1.00 0.00 C ATOM 1882 NE2 HIS A 123 8.092 -11.619 11.234 1.00 0.00 N ATOM 0 H HIS A 123 8.573 -10.680 5.793 1.00 0.00 H new ATOM 0 HA HIS A 123 10.354 -10.785 7.993 1.00 0.00 H new ATOM 0 HB2 HIS A 123 7.907 -11.922 7.173 1.00 0.00 H new ATOM 0 HB3 HIS A 123 8.990 -13.291 7.329 1.00 0.00 H new ATOM 0 HD2 HIS A 123 8.496 -10.138 9.639 1.00 0.00 H new ATOM 0 HE1 HIS A 123 7.878 -13.613 12.007 1.00 0.00 H new ATOM 0 HE2 HIS A 123 7.896 -11.044 12.053 1.00 0.00 H new ATOM 1890 N LYS A 124 11.477 -12.358 5.406 1.00 0.00 N ATOM 1891 CA LYS A 124 12.667 -12.994 4.826 1.00 0.00 C ATOM 1892 C LYS A 124 13.821 -11.992 4.653 1.00 0.00 C ATOM 1893 O LYS A 124 14.948 -12.414 4.389 1.00 0.00 O ATOM 1894 CB LYS A 124 12.280 -13.766 3.536 1.00 0.00 C ATOM 1895 CG LYS A 124 12.942 -13.248 2.252 1.00 0.00 C ATOM 1896 CD LYS A 124 12.235 -13.568 0.928 1.00 0.00 C ATOM 1897 CE LYS A 124 12.550 -14.956 0.355 1.00 0.00 C ATOM 1898 NZ LYS A 124 11.464 -15.942 0.516 1.00 0.00 N ATOM 0 H LYS A 124 10.853 -11.980 4.693 1.00 0.00 H new ATOM 0 HA LYS A 124 13.059 -13.737 5.520 1.00 0.00 H new ATOM 0 HB2 LYS A 124 12.543 -14.816 3.665 1.00 0.00 H new ATOM 0 HB3 LYS A 124 11.198 -13.721 3.414 1.00 0.00 H new ATOM 0 HG2 LYS A 124 13.037 -12.165 2.333 1.00 0.00 H new ATOM 0 HG3 LYS A 124 13.952 -13.654 2.204 1.00 0.00 H new ATOM 0 HD2 LYS A 124 11.158 -13.487 1.077 1.00 0.00 H new ATOM 0 HD3 LYS A 124 12.512 -12.814 0.192 1.00 0.00 H new ATOM 0 HE2 LYS A 124 12.778 -14.855 -0.706 1.00 0.00 H new ATOM 0 HE3 LYS A 124 13.448 -15.340 0.839 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 11.566 -16.691 -0.198 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 11.514 -16.361 1.467 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 10.545 -15.470 0.393 1.00 0.00 H new ATOM 1912 N LEU A 125 13.568 -10.682 4.734 1.00 0.00 N ATOM 1913 CA LEU A 125 14.629 -9.687 4.677 1.00 0.00 C ATOM 1914 C LEU A 125 15.330 -9.645 6.021 1.00 0.00 C ATOM 1915 O LEU A 125 14.790 -10.055 7.053 1.00 0.00 O ATOM 1916 CB LEU A 125 14.095 -8.280 4.349 1.00 0.00 C ATOM 1917 CG LEU A 125 13.650 -8.124 2.884 1.00 0.00 C ATOM 1918 CD1 LEU A 125 12.836 -6.846 2.679 1.00 0.00 C ATOM 1919 CD2 LEU A 125 14.895 -8.045 1.996 1.00 0.00 C ATOM 0 H LEU A 125 12.632 -10.291 4.840 1.00 0.00 H new ATOM 0 HA LEU A 125 15.315 -9.975 3.880 1.00 0.00 H new ATOM 0 HB2 LEU A 125 13.252 -8.057 5.003 1.00 0.00 H new ATOM 0 HB3 LEU A 125 14.870 -7.545 4.566 1.00 0.00 H new ATOM 0 HG LEU A 125 13.029 -8.981 2.625 1.00 0.00 H new ATOM 0 HD11 LEU A 125 12.538 -6.768 1.633 1.00 0.00 H new ATOM 0 HD12 LEU A 125 11.946 -6.876 3.308 1.00 0.00 H new ATOM 0 HD13 LEU A 125 13.442 -5.981 2.949 1.00 0.00 H new ATOM 0 HD21 LEU A 125 14.593 -7.934 0.955 1.00 0.00 H new ATOM 0 HD22 LEU A 125 15.499 -7.187 2.292 1.00 0.00 H new ATOM 0 HD23 LEU A 125 15.481 -8.957 2.109 1.00 0.00 H new ATOM 1931 N ASN A 126 16.519 -9.061 6.005 1.00 0.00 N ATOM 1932 CA ASN A 126 17.360 -8.803 7.144 1.00 0.00 C ATOM 1933 C ASN A 126 17.171 -7.397 7.711 1.00 0.00 C ATOM 1934 O ASN A 126 17.779 -7.081 8.737 1.00 0.00 O ATOM 1935 CB ASN A 126 18.806 -9.071 6.724 1.00 0.00 C ATOM 1936 CG ASN A 126 19.404 -8.123 5.689 1.00 0.00 C ATOM 1937 OD1 ASN A 126 18.982 -6.983 5.520 1.00 0.00 O ATOM 1938 ND2 ASN A 126 20.421 -8.575 4.979 1.00 0.00 N ATOM 0 H ASN A 126 16.941 -8.737 5.135 1.00 0.00 H new ATOM 0 HA ASN A 126 17.081 -9.468 7.961 1.00 0.00 H new ATOM 0 HB2 ASN A 126 19.431 -9.039 7.616 1.00 0.00 H new ATOM 0 HB3 ASN A 126 18.864 -10.086 6.330 1.00 0.00 H new ATOM 0 HD21 ASN A 126 20.863 -7.975 4.283 1.00 0.00 H new ATOM 0 HD22 ASN A 126 20.764 -9.524 5.127 1.00 0.00 H new ATOM 1945 N TRP A 127 16.328 -6.565 7.088 1.00 0.00 N ATOM 1946 CA TRP A 127 15.968 -5.229 7.570 1.00 0.00 C ATOM 1947 C TRP A 127 14.455 -5.114 7.777 1.00 0.00 C ATOM 1948 O TRP A 127 13.736 -6.107 7.650 1.00 0.00 O ATOM 1949 CB TRP A 127 16.560 -4.156 6.642 1.00 0.00 C ATOM 1950 CG TRP A 127 16.082 -4.148 5.220 1.00 0.00 C ATOM 1951 CD1 TRP A 127 16.399 -5.065 4.276 1.00 0.00 C ATOM 1952 CD2 TRP A 127 15.248 -3.155 4.546 1.00 0.00 C ATOM 1953 NE1 TRP A 127 15.787 -4.732 3.087 1.00 0.00 N ATOM 1954 CE2 TRP A 127 15.048 -3.579 3.201 1.00 0.00 C ATOM 1955 CE3 TRP A 127 14.664 -1.925 4.920 1.00 0.00 C ATOM 1956 CZ2 TRP A 127 14.266 -2.858 2.295 1.00 0.00 C ATOM 1957 CZ3 TRP A 127 13.923 -1.160 3.996 1.00 0.00 C ATOM 1958 CH2 TRP A 127 13.709 -1.633 2.689 1.00 0.00 C ATOM 0 H TRP A 127 15.866 -6.810 6.212 1.00 0.00 H new ATOM 0 HA TRP A 127 16.408 -5.058 8.552 1.00 0.00 H new ATOM 0 HB2 TRP A 127 16.349 -3.179 7.076 1.00 0.00 H new ATOM 0 HB3 TRP A 127 17.644 -4.274 6.635 1.00 0.00 H new ATOM 0 HD1 TRP A 127 17.034 -5.925 4.431 1.00 0.00 H new ATOM 0 HE1 TRP A 127 15.872 -5.275 2.228 1.00 0.00 H new ATOM 0 HE3 TRP A 127 14.787 -1.564 5.931 1.00 0.00 H new ATOM 0 HZ2 TRP A 127 14.092 -3.241 1.300 1.00 0.00 H new ATOM 0 HZ3 TRP A 127 13.517 -0.205 4.294 1.00 0.00 H new ATOM 0 HH2 TRP A 127 13.119 -1.056 1.993 1.00 0.00 H new ATOM 1969 N ALA A 128 13.975 -3.937 8.192 1.00 0.00 N ATOM 1970 CA ALA A 128 12.569 -3.670 8.491 1.00 0.00 C ATOM 1971 C ALA A 128 12.186 -2.308 7.884 1.00 0.00 C ATOM 1972 O ALA A 128 12.466 -1.275 8.509 1.00 0.00 O ATOM 1973 CB ALA A 128 12.319 -3.737 10.004 1.00 0.00 C ATOM 0 H ALA A 128 14.573 -3.123 8.332 1.00 0.00 H new ATOM 0 HA ALA A 128 11.932 -4.433 8.043 1.00 0.00 H new ATOM 0 HB1 ALA A 128 11.267 -3.536 10.208 1.00 0.00 H new ATOM 0 HB2 ALA A 128 12.576 -4.730 10.372 1.00 0.00 H new ATOM 0 HB3 ALA A 128 12.935 -2.993 10.508 1.00 0.00 H new ATOM 1979 N PRO A 129 11.633 -2.271 6.660 1.00 0.00 N ATOM 1980 CA PRO A 129 11.139 -1.053 6.025 1.00 0.00 C ATOM 1981 C PRO A 129 10.092 -0.368 6.899 1.00 0.00 C ATOM 1982 O PRO A 129 9.265 -1.055 7.509 1.00 0.00 O ATOM 1983 CB PRO A 129 10.512 -1.494 4.704 1.00 0.00 C ATOM 1984 CG PRO A 129 10.942 -2.948 4.489 1.00 0.00 C ATOM 1985 CD PRO A 129 11.303 -3.446 5.874 1.00 0.00 C ATOM 0 HA PRO A 129 11.945 -0.336 5.873 1.00 0.00 H new ATOM 0 HB2 PRO A 129 9.426 -1.411 4.742 1.00 0.00 H new ATOM 0 HB3 PRO A 129 10.851 -0.863 3.883 1.00 0.00 H new ATOM 0 HG2 PRO A 129 10.137 -3.539 4.052 1.00 0.00 H new ATOM 0 HG3 PRO A 129 11.792 -3.014 3.809 1.00 0.00 H new ATOM 0 HD2 PRO A 129 10.471 -3.990 6.320 1.00 0.00 H new ATOM 0 HD3 PRO A 129 12.147 -4.134 5.831 1.00 0.00 H new ATOM 1993 N SER A 130 10.086 0.969 6.935 1.00 0.00 N ATOM 1994 CA SER A 130 8.962 1.663 7.535 1.00 0.00 C ATOM 1995 C SER A 130 7.717 1.380 6.700 1.00 0.00 C ATOM 1996 O SER A 130 7.783 1.175 5.484 1.00 0.00 O ATOM 1997 CB SER A 130 9.192 3.168 7.568 1.00 0.00 C ATOM 1998 OG SER A 130 10.480 3.503 8.048 1.00 0.00 O ATOM 0 H SER A 130 10.825 1.568 6.567 1.00 0.00 H new ATOM 0 HA SER A 130 8.842 1.309 8.559 1.00 0.00 H new ATOM 0 HB2 SER A 130 9.063 3.575 6.565 1.00 0.00 H new ATOM 0 HB3 SER A 130 8.438 3.635 8.201 1.00 0.00 H new ATOM 0 HG SER A 130 10.585 4.477 8.051 1.00 0.00 H new ATOM 2004 N MET A 131 6.560 1.433 7.344 1.00 0.00 N ATOM 2005 CA MET A 131 5.309 1.070 6.723 1.00 0.00 C ATOM 2006 C MET A 131 4.960 1.963 5.540 1.00 0.00 C ATOM 2007 O MET A 131 4.468 1.473 4.527 1.00 0.00 O ATOM 2008 CB MET A 131 4.219 1.117 7.798 1.00 0.00 C ATOM 2009 CG MET A 131 3.341 -0.099 7.697 1.00 0.00 C ATOM 2010 SD MET A 131 1.752 0.165 6.894 1.00 0.00 S ATOM 2011 CE MET A 131 1.477 -1.541 6.360 1.00 0.00 C ATOM 0 H MET A 131 6.470 1.731 8.315 1.00 0.00 H new ATOM 0 HA MET A 131 5.395 0.064 6.312 1.00 0.00 H new ATOM 0 HB2 MET A 131 4.675 1.165 8.787 1.00 0.00 H new ATOM 0 HB3 MET A 131 3.619 2.019 7.679 1.00 0.00 H new ATOM 0 HG2 MET A 131 3.881 -0.873 7.151 1.00 0.00 H new ATOM 0 HG3 MET A 131 3.163 -0.483 8.702 1.00 0.00 H new ATOM 0 HE1 MET A 131 0.613 -1.580 5.696 1.00 0.00 H new ATOM 0 HE2 MET A 131 2.358 -1.903 5.831 1.00 0.00 H new ATOM 0 HE3 MET A 131 1.293 -2.170 7.231 1.00 0.00 H new ATOM 2021 N ASP A 132 5.270 3.259 5.628 1.00 0.00 N ATOM 2022 CA ASP A 132 4.990 4.194 4.543 1.00 0.00 C ATOM 2023 C ASP A 132 5.715 3.775 3.269 1.00 0.00 C ATOM 2024 O ASP A 132 5.202 4.014 2.181 1.00 0.00 O ATOM 2025 CB ASP A 132 5.409 5.618 4.917 1.00 0.00 C ATOM 2026 CG ASP A 132 4.390 6.304 5.825 1.00 0.00 C ATOM 2027 OD1 ASP A 132 4.176 5.851 6.971 1.00 0.00 O ATOM 2028 OD2 ASP A 132 3.852 7.348 5.411 1.00 0.00 O ATOM 0 H ASP A 132 5.716 3.682 6.442 1.00 0.00 H new ATOM 0 HA ASP A 132 3.914 4.177 4.369 1.00 0.00 H new ATOM 0 HB2 ASP A 132 6.377 5.590 5.418 1.00 0.00 H new ATOM 0 HB3 ASP A 132 5.537 6.207 4.009 1.00 0.00 H new ATOM 2033 N VAL A 133 6.884 3.138 3.389 1.00 0.00 N ATOM 2034 CA VAL A 133 7.603 2.550 2.269 1.00 0.00 C ATOM 2035 C VAL A 133 6.857 1.291 1.825 1.00 0.00 C ATOM 2036 O VAL A 133 6.310 1.278 0.729 1.00 0.00 O ATOM 2037 CB VAL A 133 9.081 2.308 2.641 1.00 0.00 C ATOM 2038 CG1 VAL A 133 9.851 1.627 1.520 1.00 0.00 C ATOM 2039 CG2 VAL A 133 9.785 3.628 2.983 1.00 0.00 C ATOM 0 H VAL A 133 7.359 3.018 4.283 1.00 0.00 H new ATOM 0 HA VAL A 133 7.632 3.230 1.418 1.00 0.00 H new ATOM 0 HB VAL A 133 9.073 1.652 3.511 1.00 0.00 H new ATOM 0 HG11 VAL A 133 10.886 1.478 1.828 1.00 0.00 H new ATOM 0 HG12 VAL A 133 9.395 0.662 1.300 1.00 0.00 H new ATOM 0 HG13 VAL A 133 9.825 2.253 0.628 1.00 0.00 H new ATOM 0 HG21 VAL A 133 10.825 3.429 3.242 1.00 0.00 H new ATOM 0 HG22 VAL A 133 9.746 4.295 2.122 1.00 0.00 H new ATOM 0 HG23 VAL A 133 9.284 4.099 3.829 1.00 0.00 H new ATOM 2049 N ALA A 134 6.755 0.253 2.665 1.00 0.00 N ATOM 2050 CA ALA A 134 6.203 -1.035 2.228 1.00 0.00 C ATOM 2051 C ALA A 134 4.774 -0.930 1.683 1.00 0.00 C ATOM 2052 O ALA A 134 4.322 -1.837 0.988 1.00 0.00 O ATOM 2053 CB ALA A 134 6.156 -2.030 3.390 1.00 0.00 C ATOM 0 H ALA A 134 7.045 0.279 3.643 1.00 0.00 H new ATOM 0 HA ALA A 134 6.868 -1.371 1.433 1.00 0.00 H new ATOM 0 HB1 ALA A 134 5.743 -2.977 3.042 1.00 0.00 H new ATOM 0 HB2 ALA A 134 7.164 -2.192 3.771 1.00 0.00 H new ATOM 0 HB3 ALA A 134 5.527 -1.631 4.186 1.00 0.00 H new ATOM 2059 N VAL A 135 4.010 0.102 2.045 1.00 0.00 N ATOM 2060 CA VAL A 135 2.747 0.412 1.399 1.00 0.00 C ATOM 2061 C VAL A 135 3.012 1.254 0.154 1.00 0.00 C ATOM 2062 O VAL A 135 2.596 0.840 -0.921 1.00 0.00 O ATOM 2063 CB VAL A 135 1.774 1.099 2.369 1.00 0.00 C ATOM 2064 CG1 VAL A 135 0.437 1.318 1.649 1.00 0.00 C ATOM 2065 CG2 VAL A 135 1.518 0.248 3.623 1.00 0.00 C ATOM 0 H VAL A 135 4.256 0.745 2.798 1.00 0.00 H new ATOM 0 HA VAL A 135 2.263 -0.515 1.091 1.00 0.00 H new ATOM 0 HB VAL A 135 2.219 2.043 2.682 1.00 0.00 H new ATOM 0 HG11 VAL A 135 -0.265 1.805 2.326 1.00 0.00 H new ATOM 0 HG12 VAL A 135 0.594 1.948 0.774 1.00 0.00 H new ATOM 0 HG13 VAL A 135 0.031 0.356 1.336 1.00 0.00 H new ATOM 0 HG21 VAL A 135 0.825 0.771 4.282 1.00 0.00 H new ATOM 0 HG22 VAL A 135 1.088 -0.710 3.331 1.00 0.00 H new ATOM 0 HG23 VAL A 135 2.459 0.079 4.147 1.00 0.00 H new ATOM 2075 N GLY A 136 3.649 2.420 0.290 1.00 0.00 N ATOM 2076 CA GLY A 136 3.812 3.383 -0.784 1.00 0.00 C ATOM 2077 C GLY A 136 4.402 2.745 -2.042 1.00 0.00 C ATOM 2078 O GLY A 136 3.994 3.106 -3.141 1.00 0.00 O ATOM 0 H GLY A 136 4.071 2.720 1.169 1.00 0.00 H new ATOM 0 HA2 GLY A 136 2.846 3.827 -1.022 1.00 0.00 H new ATOM 0 HA3 GLY A 136 4.461 4.192 -0.450 1.00 0.00 H new ATOM 2082 N GLU A 137 5.295 1.767 -1.890 1.00 0.00 N ATOM 2083 CA GLU A 137 5.944 1.082 -2.990 1.00 0.00 C ATOM 2084 C GLU A 137 4.973 0.104 -3.644 1.00 0.00 C ATOM 2085 O GLU A 137 4.662 0.297 -4.811 1.00 0.00 O ATOM 2086 CB GLU A 137 7.234 0.407 -2.522 1.00 0.00 C ATOM 2087 CG GLU A 137 8.245 1.426 -1.965 1.00 0.00 C ATOM 2088 CD GLU A 137 9.633 0.833 -1.852 1.00 0.00 C ATOM 2089 OE1 GLU A 137 9.788 -0.064 -0.998 1.00 0.00 O ATOM 2090 OE2 GLU A 137 10.570 1.357 -2.494 1.00 0.00 O ATOM 0 H GLU A 137 5.589 1.427 -0.974 1.00 0.00 H new ATOM 0 HA GLU A 137 6.231 1.810 -3.749 1.00 0.00 H new ATOM 0 HB2 GLU A 137 7.000 -0.330 -1.754 1.00 0.00 H new ATOM 0 HB3 GLU A 137 7.684 -0.133 -3.355 1.00 0.00 H new ATOM 0 HG2 GLU A 137 8.275 2.301 -2.614 1.00 0.00 H new ATOM 0 HG3 GLU A 137 7.914 1.768 -0.984 1.00 0.00 H new ATOM 2097 N ILE A 138 4.399 -0.871 -2.917 1.00 0.00 N ATOM 2098 CA ILE A 138 3.489 -1.824 -3.576 1.00 0.00 C ATOM 2099 C ILE A 138 2.299 -1.088 -4.222 1.00 0.00 C ATOM 2100 O ILE A 138 1.753 -1.552 -5.218 1.00 0.00 O ATOM 2101 CB ILE A 138 3.064 -2.989 -2.641 1.00 0.00 C ATOM 2102 CG1 ILE A 138 2.295 -4.102 -3.402 1.00 0.00 C ATOM 2103 CG2 ILE A 138 2.237 -2.488 -1.439 1.00 0.00 C ATOM 2104 CD1 ILE A 138 2.112 -5.447 -2.662 1.00 0.00 C ATOM 0 H ILE A 138 4.539 -1.018 -1.917 1.00 0.00 H new ATOM 0 HA ILE A 138 4.039 -2.305 -4.385 1.00 0.00 H new ATOM 0 HB ILE A 138 3.987 -3.425 -2.260 1.00 0.00 H new ATOM 0 HG12 ILE A 138 1.308 -3.718 -3.661 1.00 0.00 H new ATOM 0 HG13 ILE A 138 2.817 -4.297 -4.339 1.00 0.00 H new ATOM 0 HG21 ILE A 138 1.960 -3.334 -0.810 1.00 0.00 H new ATOM 0 HG22 ILE A 138 2.831 -1.783 -0.858 1.00 0.00 H new ATOM 0 HG23 ILE A 138 1.335 -1.993 -1.799 1.00 0.00 H new ATOM 0 HD11 ILE A 138 1.560 -6.140 -3.298 1.00 0.00 H new ATOM 0 HD12 ILE A 138 3.089 -5.869 -2.427 1.00 0.00 H new ATOM 0 HD13 ILE A 138 1.557 -5.282 -1.739 1.00 0.00 H new ATOM 2116 N LEU A 139 1.907 0.082 -3.703 1.00 0.00 N ATOM 2117 CA LEU A 139 0.918 0.943 -4.340 1.00 0.00 C ATOM 2118 C LEU A 139 1.446 1.604 -5.612 1.00 0.00 C ATOM 2119 O LEU A 139 0.727 1.689 -6.601 1.00 0.00 O ATOM 2120 CB LEU A 139 0.494 2.056 -3.388 1.00 0.00 C ATOM 2121 CG LEU A 139 -0.338 1.610 -2.180 1.00 0.00 C ATOM 2122 CD1 LEU A 139 -0.862 2.863 -1.492 1.00 0.00 C ATOM 2123 CD2 LEU A 139 -1.519 0.688 -2.479 1.00 0.00 C ATOM 0 H LEU A 139 2.272 0.454 -2.826 1.00 0.00 H new ATOM 0 HA LEU A 139 0.078 0.299 -4.598 1.00 0.00 H new ATOM 0 HB2 LEU A 139 1.389 2.560 -3.024 1.00 0.00 H new ATOM 0 HB3 LEU A 139 -0.080 2.792 -3.950 1.00 0.00 H new ATOM 0 HG LEU A 139 0.332 1.015 -1.560 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -1.460 2.579 -0.626 1.00 0.00 H new ATOM 0 HD12 LEU A 139 -0.023 3.478 -1.168 1.00 0.00 H new ATOM 0 HD13 LEU A 139 -1.479 3.430 -2.189 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -2.031 0.440 -1.549 1.00 0.00 H new ATOM 0 HD22 LEU A 139 -2.212 1.192 -3.152 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -1.157 -0.226 -2.949 1.00 0.00 H new ATOM 2135 N ALA A 140 2.667 2.122 -5.605 1.00 0.00 N ATOM 2136 CA ALA A 140 3.314 2.555 -6.839 1.00 0.00 C ATOM 2137 C ALA A 140 3.274 1.461 -7.915 1.00 0.00 C ATOM 2138 O ALA A 140 3.144 1.779 -9.099 1.00 0.00 O ATOM 2139 CB ALA A 140 4.748 3.012 -6.571 1.00 0.00 C ATOM 0 H ALA A 140 3.228 2.253 -4.763 1.00 0.00 H new ATOM 0 HA ALA A 140 2.752 3.407 -7.223 1.00 0.00 H new ATOM 0 HB1 ALA A 140 5.209 3.330 -7.506 1.00 0.00 H new ATOM 0 HB2 ALA A 140 4.739 3.846 -5.869 1.00 0.00 H new ATOM 0 HB3 ALA A 140 5.320 2.187 -6.147 1.00 0.00 H new ATOM 2145 N GLU A 141 3.380 0.193 -7.527 1.00 0.00 N ATOM 2146 CA GLU A 141 3.719 -0.886 -8.440 1.00 0.00 C ATOM 2147 C GLU A 141 2.504 -1.646 -8.982 1.00 0.00 C ATOM 2148 O GLU A 141 2.463 -1.942 -10.180 1.00 0.00 O ATOM 2149 CB GLU A 141 4.641 -1.831 -7.688 1.00 0.00 C ATOM 2150 CG GLU A 141 5.962 -1.135 -7.384 1.00 0.00 C ATOM 2151 CD GLU A 141 6.836 -2.115 -6.615 1.00 0.00 C ATOM 2152 OE1 GLU A 141 7.525 -2.854 -7.350 1.00 0.00 O ATOM 2153 OE2 GLU A 141 6.969 -1.969 -5.379 1.00 0.00 O ATOM 0 H GLU A 141 3.232 -0.113 -6.565 1.00 0.00 H new ATOM 0 HA GLU A 141 4.199 -0.457 -9.320 1.00 0.00 H new ATOM 0 HB2 GLU A 141 4.168 -2.153 -6.760 1.00 0.00 H new ATOM 0 HB3 GLU A 141 4.820 -2.727 -8.282 1.00 0.00 H new ATOM 0 HG2 GLU A 141 6.453 -0.828 -8.307 1.00 0.00 H new ATOM 0 HG3 GLU A 141 5.792 -0.232 -6.797 1.00 0.00 H new ATOM 2160 N VAL A 142 1.538 -1.995 -8.130 1.00 0.00 N ATOM 2161 CA VAL A 142 0.554 -3.038 -8.437 1.00 0.00 C ATOM 2162 C VAL A 142 -0.650 -2.479 -9.208 1.00 0.00 C ATOM 2163 O VAL A 142 -1.280 -3.232 -9.988 1.00 0.00 O ATOM 2164 CB VAL A 142 0.188 -3.759 -7.120 1.00 0.00 C ATOM 2165 CG1 VAL A 142 -1.217 -4.362 -7.101 1.00 0.00 C ATOM 2166 CG2 VAL A 142 1.230 -4.853 -6.839 1.00 0.00 C ATOM 0 H VAL A 142 1.415 -1.566 -7.213 1.00 0.00 H new ATOM 0 HA VAL A 142 0.979 -3.777 -9.116 1.00 0.00 H new ATOM 0 HB VAL A 142 0.193 -2.999 -6.339 1.00 0.00 H new ATOM 0 HG11 VAL A 142 -1.391 -4.848 -6.141 1.00 0.00 H new ATOM 0 HG12 VAL A 142 -1.954 -3.572 -7.247 1.00 0.00 H new ATOM 0 HG13 VAL A 142 -1.309 -5.096 -7.902 1.00 0.00 H new ATOM 0 HG21 VAL A 142 0.978 -5.366 -5.911 1.00 0.00 H new ATOM 0 HG22 VAL A 142 1.235 -5.570 -7.660 1.00 0.00 H new ATOM 0 HG23 VAL A 142 2.217 -4.400 -6.747 1.00 0.00 H new TER 2176 VAL A 142