USER MOD reduce.3.24.130724 H: found=0, std=0, add=687, rem=0, adj=9 USER MOD reduce.3.24.130724 removed 687 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: p 11 ASN : amide:sc= -0.0483 K(o=0.01,f=-1.1!) USER MOD Set 1.2: p 71 ASN : amide:sc= 0.0585 K(o=0.01,f=-1.1) USER MOD Set 2.1: p 20 LYS NZ :NH3+ -177:sc= 0.651 (180deg=0) USER MOD Set 2.2: p 24 GLN : amide:sc= -0.268 K(o=0.38,f=-6.6!) USER MOD Single : p 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : p 1 MET N :NH3+ -172:sc= 0 (180deg=-0.0659) USER MOD Single : p 2 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 10 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 16 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 30 GLN : amide:sc= -3.35! K(o=-3.3!,f=-0.28) USER MOD Single : p 33 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 34 CYS SG : rot 180:sc= -0.445 USER MOD Single : p 36 CYS SG : rot 180:sc= 0 USER MOD Single : p 40 ASN : amide:sc= -0.0771 X(o=-0.077,f=0) USER MOD Single : p 41 CYS SG : rot -113:sc= 1.03 USER MOD Single : p 42 SER OG : rot 180:sc= 0 USER MOD Single : p 43 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 44 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : p 48 TYR OH : rot 180:sc= 0 USER MOD Single : p 49 SER OG : rot -36:sc= 0.0253 USER MOD Single : p 51 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 59 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 65 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 73 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 77 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00107) USER MOD Single : p 79 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET p 1 -9.139 23.197 5.454 1.00 0.00 N ATOM 2 CA MET p 1 -9.086 22.873 4.002 1.00 0.00 C ATOM 3 C MET p 1 -7.778 22.169 3.638 1.00 0.00 C ATOM 4 O MET p 1 -7.781 21.218 2.856 1.00 0.00 O ATOM 5 CB MET p 1 -9.241 24.148 3.163 1.00 0.00 C ATOM 6 CG MET p 1 -10.656 24.709 3.152 1.00 0.00 C ATOM 7 SD MET p 1 -10.808 26.191 2.137 1.00 0.00 S ATOM 8 CE MET p 1 -12.551 26.554 2.327 1.00 0.00 C ATOM 0 H1 MET p 1 -10.087 23.549 5.697 1.00 0.00 H new ATOM 0 H2 MET p 1 -8.935 22.341 6.008 1.00 0.00 H new ATOM 0 H3 MET p 1 -8.432 23.928 5.673 1.00 0.00 H new ATOM 0 HA MET p 1 -9.912 22.197 3.783 1.00 0.00 H new ATOM 0 HB2 MET p 1 -8.562 24.909 3.547 1.00 0.00 H new ATOM 0 HB3 MET p 1 -8.936 23.936 2.138 1.00 0.00 H new ATOM 0 HG2 MET p 1 -11.342 23.947 2.781 1.00 0.00 H new ATOM 0 HG3 MET p 1 -10.959 24.940 4.173 1.00 0.00 H new ATOM 0 HE1 MET p 1 -12.801 27.448 1.755 1.00 0.00 H new ATOM 0 HE2 MET p 1 -13.140 25.713 1.961 1.00 0.00 H new ATOM 0 HE3 MET p 1 -12.775 26.723 3.380 1.00 0.00 H new ATOM 20 N GLN p 2 -6.667 22.635 4.231 1.00 0.00 N ATOM 21 CA GLN p 2 -5.336 22.083 3.990 1.00 0.00 C ATOM 22 C GLN p 2 -5.076 20.835 4.846 1.00 0.00 C ATOM 23 O GLN p 2 -4.019 20.230 4.759 1.00 0.00 O ATOM 24 CB GLN p 2 -4.297 23.159 4.294 1.00 0.00 C ATOM 25 CG GLN p 2 -3.992 24.062 3.111 1.00 0.00 C ATOM 26 CD GLN p 2 -2.901 25.072 3.412 1.00 0.00 C ATOM 27 OE1 GLN p 2 -3.174 26.179 3.874 1.00 0.00 O ATOM 28 NE2 GLN p 2 -1.655 24.692 3.152 1.00 0.00 N ATOM 0 H GLN p 2 -6.674 23.410 4.894 1.00 0.00 H new ATOM 0 HA GLN p 2 -5.267 21.777 2.946 1.00 0.00 H new ATOM 0 HB2 GLN p 2 -4.651 23.770 5.125 1.00 0.00 H new ATOM 0 HB3 GLN p 2 -3.375 22.679 4.621 1.00 0.00 H new ATOM 0 HG2 GLN p 2 -3.691 23.450 2.260 1.00 0.00 H new ATOM 0 HG3 GLN p 2 -4.900 24.590 2.819 1.00 0.00 H new ATOM 0 HE21 GLN p 2 -1.474 23.764 2.769 1.00 0.00 H new ATOM 0 HE22 GLN p 2 -0.879 25.328 3.335 1.00 0.00 H new ATOM 37 N ALA p 3 -6.070 20.489 5.663 1.00 0.00 N ATOM 38 CA ALA p 3 -6.047 19.340 6.571 1.00 0.00 C ATOM 39 C ALA p 3 -6.653 18.131 5.877 1.00 0.00 C ATOM 40 O ALA p 3 -6.500 16.996 6.320 1.00 0.00 O ATOM 41 CB ALA p 3 -6.807 19.658 7.850 1.00 0.00 C ATOM 0 H ALA p 3 -6.942 21.016 5.714 1.00 0.00 H new ATOM 0 HA ALA p 3 -5.014 19.116 6.838 1.00 0.00 H new ATOM 0 HB1 ALA p 3 -6.780 18.794 8.514 1.00 0.00 H new ATOM 0 HB2 ALA p 3 -6.344 20.511 8.346 1.00 0.00 H new ATOM 0 HB3 ALA p 3 -7.842 19.898 7.608 1.00 0.00 H new ATOM 47 N LEU p 4 -7.361 18.436 4.786 1.00 0.00 N ATOM 48 CA LEU p 4 -8.034 17.483 3.934 1.00 0.00 C ATOM 49 C LEU p 4 -7.061 17.112 2.835 1.00 0.00 C ATOM 50 O LEU p 4 -6.871 15.945 2.502 1.00 0.00 O ATOM 51 CB LEU p 4 -9.279 18.163 3.355 1.00 0.00 C ATOM 52 CG LEU p 4 -10.390 17.268 2.812 1.00 0.00 C ATOM 53 CD1 LEU p 4 -11.584 18.141 2.517 1.00 0.00 C ATOM 54 CD2 LEU p 4 -9.954 16.538 1.551 1.00 0.00 C ATOM 0 H LEU p 4 -7.479 19.398 4.469 1.00 0.00 H new ATOM 0 HA LEU p 4 -8.343 16.586 4.471 1.00 0.00 H new ATOM 0 HB2 LEU p 4 -9.708 18.795 4.133 1.00 0.00 H new ATOM 0 HB3 LEU p 4 -8.956 18.823 2.550 1.00 0.00 H new ATOM 0 HG LEU p 4 -10.637 16.508 3.554 1.00 0.00 H new ATOM 0 HD11 LEU p 4 -12.396 17.527 2.127 1.00 0.00 H new ATOM 0 HD12 LEU p 4 -11.910 18.634 3.433 1.00 0.00 H new ATOM 0 HD13 LEU p 4 -11.310 18.894 1.778 1.00 0.00 H new ATOM 0 HD21 LEU p 4 -10.770 15.911 1.193 1.00 0.00 H new ATOM 0 HD22 LEU p 4 -9.691 17.265 0.782 1.00 0.00 H new ATOM 0 HD23 LEU p 4 -9.088 15.915 1.773 1.00 0.00 H new ATOM 66 N GLU p 5 -6.468 18.173 2.284 1.00 0.00 N ATOM 67 CA GLU p 5 -5.426 18.087 1.253 1.00 0.00 C ATOM 68 C GLU p 5 -4.172 17.493 1.867 1.00 0.00 C ATOM 69 O GLU p 5 -3.346 16.907 1.176 1.00 0.00 O ATOM 70 CB GLU p 5 -5.091 19.465 0.678 1.00 0.00 C ATOM 71 CG GLU p 5 -6.308 20.331 0.440 1.00 0.00 C ATOM 72 CD GLU p 5 -6.363 20.905 -0.964 1.00 0.00 C ATOM 73 OE1 GLU p 5 -5.820 22.010 -1.173 1.00 0.00 O ATOM 74 OE2 GLU p 5 -6.946 20.248 -1.851 1.00 0.00 O ATOM 0 H GLU p 5 -6.700 19.132 2.544 1.00 0.00 H new ATOM 0 HA GLU p 5 -5.798 17.459 0.444 1.00 0.00 H new ATOM 0 HB2 GLU p 5 -4.416 19.981 1.361 1.00 0.00 H new ATOM 0 HB3 GLU p 5 -4.556 19.337 -0.263 1.00 0.00 H new ATOM 0 HG2 GLU p 5 -7.207 19.742 0.621 1.00 0.00 H new ATOM 0 HG3 GLU p 5 -6.312 21.148 1.161 1.00 0.00 H new ATOM 81 N LYS p 6 -4.068 17.691 3.184 1.00 0.00 N ATOM 82 CA LYS p 6 -2.954 17.160 3.997 1.00 0.00 C ATOM 83 C LYS p 6 -3.291 15.770 4.516 1.00 0.00 C ATOM 84 O LYS p 6 -2.417 15.051 4.980 1.00 0.00 O ATOM 85 CB LYS p 6 -2.625 18.066 5.174 1.00 0.00 C ATOM 86 CG LYS p 6 -1.359 18.886 4.977 1.00 0.00 C ATOM 87 CD LYS p 6 -1.086 19.787 6.171 1.00 0.00 C ATOM 88 CE LYS p 6 0.174 20.613 5.969 1.00 0.00 C ATOM 89 NZ LYS p 6 0.449 21.504 7.131 1.00 0.00 N ATOM 0 H LYS p 6 -4.751 18.223 3.723 1.00 0.00 H new ATOM 0 HA LYS p 6 -2.080 17.112 3.347 1.00 0.00 H new ATOM 0 HB2 LYS p 6 -3.462 18.742 5.346 1.00 0.00 H new ATOM 0 HB3 LYS p 6 -2.517 17.457 6.071 1.00 0.00 H new ATOM 0 HG2 LYS p 6 -0.512 18.218 4.823 1.00 0.00 H new ATOM 0 HG3 LYS p 6 -1.454 19.493 4.076 1.00 0.00 H new ATOM 0 HD2 LYS p 6 -1.936 20.451 6.329 1.00 0.00 H new ATOM 0 HD3 LYS p 6 -0.984 19.180 7.071 1.00 0.00 H new ATOM 0 HE2 LYS p 6 1.023 19.947 5.814 1.00 0.00 H new ATOM 0 HE3 LYS p 6 0.072 21.215 5.066 1.00 0.00 H new ATOM 0 HZ1 LYS p 6 1.316 22.049 6.953 1.00 0.00 H new ATOM 0 HZ2 LYS p 6 -0.349 22.157 7.264 1.00 0.00 H new ATOM 0 HZ3 LYS p 6 0.572 20.928 7.988 1.00 0.00 H new ATOM 103 N GLU p 7 -4.585 15.442 4.453 1.00 0.00 N ATOM 104 CA GLU p 7 -5.129 14.141 4.837 1.00 0.00 C ATOM 105 C GLU p 7 -5.071 13.259 3.595 1.00 0.00 C ATOM 106 O GLU p 7 -5.069 12.033 3.660 1.00 0.00 O ATOM 107 CB GLU p 7 -6.569 14.334 5.330 1.00 0.00 C ATOM 108 CG GLU p 7 -7.501 13.162 5.095 1.00 0.00 C ATOM 109 CD GLU p 7 -8.072 12.591 6.378 1.00 0.00 C ATOM 110 OE1 GLU p 7 -9.146 13.062 6.812 1.00 0.00 O ATOM 111 OE2 GLU p 7 -7.446 11.674 6.950 1.00 0.00 O ATOM 0 H GLU p 7 -5.299 16.092 4.125 1.00 0.00 H new ATOM 0 HA GLU p 7 -4.565 13.674 5.644 1.00 0.00 H new ATOM 0 HB2 GLU p 7 -6.543 14.547 6.399 1.00 0.00 H new ATOM 0 HB3 GLU p 7 -6.988 15.213 4.840 1.00 0.00 H new ATOM 0 HG2 GLU p 7 -8.320 13.480 4.450 1.00 0.00 H new ATOM 0 HG3 GLU p 7 -6.962 12.378 4.563 1.00 0.00 H new ATOM 118 N LEU p 8 -5.034 13.978 2.479 1.00 0.00 N ATOM 119 CA LEU p 8 -4.929 13.469 1.138 1.00 0.00 C ATOM 120 C LEU p 8 -3.450 13.394 0.808 1.00 0.00 C ATOM 121 O LEU p 8 -3.016 12.570 0.011 1.00 0.00 O ATOM 122 CB LEU p 8 -5.675 14.428 0.190 1.00 0.00 C ATOM 123 CG LEU p 8 -5.114 14.579 -1.228 1.00 0.00 C ATOM 124 CD1 LEU p 8 -5.310 13.295 -1.995 1.00 0.00 C ATOM 125 CD2 LEU p 8 -5.764 15.751 -1.937 1.00 0.00 C ATOM 0 H LEU p 8 -5.080 14.997 2.500 1.00 0.00 H new ATOM 0 HA LEU p 8 -5.375 12.480 1.032 1.00 0.00 H new ATOM 0 HB2 LEU p 8 -6.709 14.091 0.111 1.00 0.00 H new ATOM 0 HB3 LEU p 8 -5.696 15.414 0.653 1.00 0.00 H new ATOM 0 HG LEU p 8 -4.045 14.783 -1.169 1.00 0.00 H new ATOM 0 HD11 LEU p 8 -4.909 13.408 -3.002 1.00 0.00 H new ATOM 0 HD12 LEU p 8 -4.789 12.484 -1.486 1.00 0.00 H new ATOM 0 HD13 LEU p 8 -6.374 13.064 -2.051 1.00 0.00 H new ATOM 0 HD21 LEU p 8 -5.352 15.842 -2.942 1.00 0.00 H new ATOM 0 HD22 LEU p 8 -6.840 15.588 -1.999 1.00 0.00 H new ATOM 0 HD23 LEU p 8 -5.568 16.667 -1.380 1.00 0.00 H new ATOM 137 N ALA p 9 -2.724 14.333 1.421 1.00 0.00 N ATOM 138 CA ALA p 9 -1.264 14.422 1.332 1.00 0.00 C ATOM 139 C ALA p 9 -0.675 13.460 2.351 1.00 0.00 C ATOM 140 O ALA p 9 0.490 13.074 2.270 1.00 0.00 O ATOM 141 CB ALA p 9 -0.746 15.832 1.573 1.00 0.00 C ATOM 0 H ALA p 9 -3.139 15.062 2.001 1.00 0.00 H new ATOM 0 HA ALA p 9 -0.959 14.157 0.320 1.00 0.00 H new ATOM 0 HB1 ALA p 9 0.341 15.839 1.495 1.00 0.00 H new ATOM 0 HB2 ALA p 9 -1.167 16.507 0.828 1.00 0.00 H new ATOM 0 HB3 ALA p 9 -1.040 16.162 2.569 1.00 0.00 H new ATOM 147 N GLN p 10 -1.536 13.109 3.322 1.00 0.00 N ATOM 148 CA GLN p 10 -1.242 12.142 4.368 1.00 0.00 C ATOM 149 C GLN p 10 -1.735 10.801 3.855 1.00 0.00 C ATOM 150 O GLN p 10 -1.314 9.745 4.313 1.00 0.00 O ATOM 151 CB GLN p 10 -1.937 12.554 5.673 1.00 0.00 C ATOM 152 CG GLN p 10 -2.426 11.415 6.555 1.00 0.00 C ATOM 153 CD GLN p 10 -1.793 11.421 7.932 1.00 0.00 C ATOM 154 OE1 GLN p 10 -0.748 10.808 8.150 1.00 0.00 O ATOM 155 NE2 GLN p 10 -2.424 12.116 8.871 1.00 0.00 N ATOM 0 H GLN p 10 -2.474 13.504 3.394 1.00 0.00 H new ATOM 0 HA GLN p 10 -0.177 12.088 4.593 1.00 0.00 H new ATOM 0 HB2 GLN p 10 -1.245 13.165 6.253 1.00 0.00 H new ATOM 0 HB3 GLN p 10 -2.789 13.186 5.424 1.00 0.00 H new ATOM 0 HG2 GLN p 10 -3.509 11.482 6.658 1.00 0.00 H new ATOM 0 HG3 GLN p 10 -2.210 10.465 6.066 1.00 0.00 H new ATOM 0 HE21 GLN p 10 -3.288 12.609 8.646 1.00 0.00 H new ATOM 0 HE22 GLN p 10 -2.045 12.157 9.817 1.00 0.00 H new ATOM 164 N ASN p 11 -2.672 10.916 2.907 1.00 0.00 N ATOM 165 CA ASN p 11 -3.251 9.786 2.182 1.00 0.00 C ATOM 166 C ASN p 11 -2.330 9.505 1.009 1.00 0.00 C ATOM 167 O ASN p 11 -2.330 8.419 0.433 1.00 0.00 O ATOM 168 CB ASN p 11 -4.670 10.071 1.679 1.00 0.00 C ATOM 169 CG ASN p 11 -5.514 8.812 1.521 1.00 0.00 C ATOM 170 OD1 ASN p 11 -5.396 7.860 2.296 1.00 0.00 O ATOM 171 ND2 ASN p 11 -6.373 8.804 0.508 1.00 0.00 N ATOM 0 H ASN p 11 -3.055 11.816 2.619 1.00 0.00 H new ATOM 0 HA ASN p 11 -3.336 8.930 2.852 1.00 0.00 H new ATOM 0 HB2 ASN p 11 -5.166 10.748 2.374 1.00 0.00 H new ATOM 0 HB3 ASN p 11 -4.612 10.585 0.720 1.00 0.00 H new ATOM 0 HD21 ASN p 11 -6.966 7.989 0.349 1.00 0.00 H new ATOM 0 HD22 ASN p 11 -6.440 9.612 -0.110 1.00 0.00 H new ATOM 178 N GLU p 12 -1.563 10.558 0.672 1.00 0.00 N ATOM 179 CA GLU p 12 -0.552 10.555 -0.340 1.00 0.00 C ATOM 180 C GLU p 12 0.718 10.040 0.309 1.00 0.00 C ATOM 181 O GLU p 12 1.552 9.387 -0.308 1.00 0.00 O ATOM 182 CB GLU p 12 -0.359 11.986 -0.765 1.00 0.00 C ATOM 183 CG GLU p 12 0.619 12.163 -1.870 1.00 0.00 C ATOM 184 CD GLU p 12 0.008 12.725 -3.138 1.00 0.00 C ATOM 185 OE1 GLU p 12 -0.020 13.965 -3.285 1.00 0.00 O ATOM 186 OE2 GLU p 12 -0.442 11.924 -3.985 1.00 0.00 O ATOM 0 H GLU p 12 -1.654 11.463 1.133 1.00 0.00 H new ATOM 0 HA GLU p 12 -0.813 9.937 -1.199 1.00 0.00 H new ATOM 0 HB2 GLU p 12 -1.321 12.394 -1.076 1.00 0.00 H new ATOM 0 HB3 GLU p 12 -0.029 12.568 0.095 1.00 0.00 H new ATOM 0 HG2 GLU p 12 1.416 12.827 -1.536 1.00 0.00 H new ATOM 0 HG3 GLU p 12 1.079 11.201 -2.094 1.00 0.00 H new ATOM 193 N TRP p 13 0.813 10.434 1.575 1.00 0.00 N ATOM 194 CA TRP p 13 1.889 10.047 2.488 1.00 0.00 C ATOM 195 C TRP p 13 1.593 8.643 2.993 1.00 0.00 C ATOM 196 O TRP p 13 2.472 7.946 3.496 1.00 0.00 O ATOM 197 CB TRP p 13 2.019 11.014 3.667 1.00 0.00 C ATOM 198 CG TRP p 13 3.422 11.131 4.194 1.00 0.00 C ATOM 199 CD1 TRP p 13 3.983 10.384 5.190 1.00 0.00 C ATOM 200 CD2 TRP p 13 4.439 12.047 3.756 1.00 0.00 C ATOM 201 NE1 TRP p 13 5.283 10.776 5.399 1.00 0.00 N ATOM 202 CE2 TRP p 13 5.587 11.794 4.533 1.00 0.00 C ATOM 203 CE3 TRP p 13 4.495 13.055 2.785 1.00 0.00 C ATOM 204 CZ2 TRP p 13 6.771 12.508 4.369 1.00 0.00 C ATOM 205 CZ3 TRP p 13 5.671 13.763 2.625 1.00 0.00 C ATOM 206 CH2 TRP p 13 6.795 13.487 3.414 1.00 0.00 C ATOM 0 H TRP p 13 0.125 11.049 2.009 1.00 0.00 H new ATOM 0 HA TRP p 13 2.837 10.077 1.951 1.00 0.00 H new ATOM 0 HB2 TRP p 13 1.672 12.000 3.358 1.00 0.00 H new ATOM 0 HB3 TRP p 13 1.363 10.683 4.472 1.00 0.00 H new ATOM 0 HD1 TRP p 13 3.478 9.599 5.734 1.00 0.00 H new ATOM 0 HE1 TRP p 13 5.919 10.374 6.088 1.00 0.00 H new ATOM 0 HE3 TRP p 13 3.634 13.275 2.172 1.00 0.00 H new ATOM 0 HZ2 TRP p 13 7.640 12.296 4.975 1.00 0.00 H new ATOM 0 HZ3 TRP p 13 5.724 14.542 1.879 1.00 0.00 H new ATOM 0 HH2 TRP p 13 7.699 14.059 3.265 1.00 0.00 H new ATOM 217 N GLU p 14 0.307 8.279 2.859 1.00 0.00 N ATOM 218 CA GLU p 14 -0.224 6.986 3.174 1.00 0.00 C ATOM 219 C GLU p 14 -0.035 6.137 1.940 1.00 0.00 C ATOM 220 O GLU p 14 0.095 4.930 2.002 1.00 0.00 O ATOM 221 CB GLU p 14 -1.692 7.162 3.439 1.00 0.00 C ATOM 222 CG GLU p 14 -2.394 5.905 3.806 1.00 0.00 C ATOM 223 CD GLU p 14 -3.010 5.936 5.191 1.00 0.00 C ATOM 224 OE1 GLU p 14 -2.317 5.554 6.158 1.00 0.00 O ATOM 225 OE2 GLU p 14 -4.185 6.343 5.308 1.00 0.00 O ATOM 0 H GLU p 14 -0.404 8.922 2.511 1.00 0.00 H new ATOM 0 HA GLU p 14 0.259 6.528 4.037 1.00 0.00 H new ATOM 0 HB2 GLU p 14 -1.821 7.887 4.243 1.00 0.00 H new ATOM 0 HB3 GLU p 14 -2.163 7.583 2.551 1.00 0.00 H new ATOM 0 HG2 GLU p 14 -3.177 5.709 3.074 1.00 0.00 H new ATOM 0 HG3 GLU p 14 -1.689 5.075 3.749 1.00 0.00 H new ATOM 232 N LEU p 15 -0.126 6.862 0.831 1.00 0.00 N ATOM 233 CA LEU p 15 0.087 6.366 -0.521 1.00 0.00 C ATOM 234 C LEU p 15 1.580 6.143 -0.681 1.00 0.00 C ATOM 235 O LEU p 15 2.019 5.253 -1.389 1.00 0.00 O ATOM 236 CB LEU p 15 -0.430 7.395 -1.555 1.00 0.00 C ATOM 237 CG LEU p 15 -0.307 7.054 -3.060 1.00 0.00 C ATOM 238 CD1 LEU p 15 0.995 7.602 -3.615 1.00 0.00 C ATOM 239 CD2 LEU p 15 -0.399 5.557 -3.308 1.00 0.00 C ATOM 0 H LEU p 15 -0.360 7.854 0.852 1.00 0.00 H new ATOM 0 HA LEU p 15 -0.457 5.437 -0.689 1.00 0.00 H new ATOM 0 HB2 LEU p 15 -1.483 7.579 -1.342 1.00 0.00 H new ATOM 0 HB3 LEU p 15 0.099 8.332 -1.383 1.00 0.00 H new ATOM 0 HG LEU p 15 -1.144 7.524 -3.577 1.00 0.00 H new ATOM 0 HD11 LEU p 15 1.071 7.356 -4.674 1.00 0.00 H new ATOM 0 HD12 LEU p 15 1.016 8.685 -3.491 1.00 0.00 H new ATOM 0 HD13 LEU p 15 1.834 7.159 -3.079 1.00 0.00 H new ATOM 0 HD21 LEU p 15 -0.308 5.359 -4.376 1.00 0.00 H new ATOM 0 HD22 LEU p 15 0.405 5.050 -2.775 1.00 0.00 H new ATOM 0 HD23 LEU p 15 -1.360 5.187 -2.951 1.00 0.00 H new ATOM 251 N GLN p 16 2.312 6.993 0.034 1.00 0.00 N ATOM 252 CA GLN p 16 3.741 7.005 0.129 1.00 0.00 C ATOM 253 C GLN p 16 4.143 5.937 1.116 1.00 0.00 C ATOM 254 O GLN p 16 5.225 5.387 1.054 1.00 0.00 O ATOM 255 CB GLN p 16 4.116 8.360 0.663 1.00 0.00 C ATOM 256 CG GLN p 16 5.581 8.589 0.750 1.00 0.00 C ATOM 257 CD GLN p 16 6.072 9.724 -0.127 1.00 0.00 C ATOM 258 OE1 GLN p 16 6.123 10.877 0.300 1.00 0.00 O ATOM 259 NE2 GLN p 16 6.436 9.401 -1.363 1.00 0.00 N ATOM 0 H GLN p 16 1.882 7.731 0.591 1.00 0.00 H new ATOM 0 HA GLN p 16 4.230 6.818 -0.827 1.00 0.00 H new ATOM 0 HB2 GLN p 16 3.676 9.126 0.024 1.00 0.00 H new ATOM 0 HB3 GLN p 16 3.680 8.482 1.654 1.00 0.00 H new ATOM 0 HG2 GLN p 16 5.846 8.801 1.786 1.00 0.00 H new ATOM 0 HG3 GLN p 16 6.101 7.673 0.469 1.00 0.00 H new ATOM 0 HE21 GLN p 16 6.377 8.432 -1.675 1.00 0.00 H new ATOM 0 HE22 GLN p 16 6.774 10.122 -2.000 1.00 0.00 H new ATOM 268 N ALA p 17 3.245 5.789 2.080 1.00 0.00 N ATOM 269 CA ALA p 17 3.311 4.767 3.132 1.00 0.00 C ATOM 270 C ALA p 17 2.785 3.461 2.560 1.00 0.00 C ATOM 271 O ALA p 17 3.015 2.383 3.104 1.00 0.00 O ATOM 272 CB ALA p 17 2.506 5.164 4.361 1.00 0.00 C ATOM 0 H ALA p 17 2.425 6.390 2.160 1.00 0.00 H new ATOM 0 HA ALA p 17 4.347 4.657 3.453 1.00 0.00 H new ATOM 0 HB1 ALA p 17 2.582 4.380 5.115 1.00 0.00 H new ATOM 0 HB2 ALA p 17 2.898 6.097 4.767 1.00 0.00 H new ATOM 0 HB3 ALA p 17 1.461 5.300 4.083 1.00 0.00 H new ATOM 278 N LEU p 18 2.052 3.618 1.444 1.00 0.00 N ATOM 279 CA LEU p 18 1.492 2.525 0.661 1.00 0.00 C ATOM 280 C LEU p 18 2.566 2.078 -0.270 1.00 0.00 C ATOM 281 O LEU p 18 2.694 0.910 -0.593 1.00 0.00 O ATOM 282 CB LEU p 18 0.329 3.019 -0.160 1.00 0.00 C ATOM 283 CG LEU p 18 -0.967 2.262 -0.017 1.00 0.00 C ATOM 284 CD1 LEU p 18 -1.630 2.629 1.294 1.00 0.00 C ATOM 285 CD2 LEU p 18 -1.831 2.615 -1.194 1.00 0.00 C ATOM 0 H LEU p 18 1.832 4.537 1.059 1.00 0.00 H new ATOM 0 HA LEU p 18 1.148 1.722 1.313 1.00 0.00 H new ATOM 0 HB2 LEU p 18 0.146 4.061 0.101 1.00 0.00 H new ATOM 0 HB3 LEU p 18 0.621 3.000 -1.210 1.00 0.00 H new ATOM 0 HG LEU p 18 -0.798 1.185 -0.003 1.00 0.00 H new ATOM 0 HD11 LEU p 18 -2.566 2.080 1.394 1.00 0.00 H new ATOM 0 HD12 LEU p 18 -0.968 2.372 2.121 1.00 0.00 H new ATOM 0 HD13 LEU p 18 -1.833 3.700 1.312 1.00 0.00 H new ATOM 0 HD21 LEU p 18 -2.779 2.083 -1.122 1.00 0.00 H new ATOM 0 HD22 LEU p 18 -2.017 3.689 -1.200 1.00 0.00 H new ATOM 0 HD23 LEU p 18 -1.324 2.330 -2.116 1.00 0.00 H new ATOM 297 N GLU p 19 3.274 3.106 -0.740 1.00 0.00 N ATOM 298 CA GLU p 19 4.471 2.950 -1.588 1.00 0.00 C ATOM 299 C GLU p 19 5.561 2.454 -0.682 1.00 0.00 C ATOM 300 O GLU p 19 6.290 1.544 -0.984 1.00 0.00 O ATOM 301 CB GLU p 19 4.943 4.256 -2.237 1.00 0.00 C ATOM 302 CG GLU p 19 3.914 4.923 -3.109 1.00 0.00 C ATOM 303 CD GLU p 19 4.210 4.791 -4.590 1.00 0.00 C ATOM 304 OE1 GLU p 19 4.921 5.662 -5.133 1.00 0.00 O ATOM 305 OE2 GLU p 19 3.731 3.816 -5.207 1.00 0.00 O ATOM 0 H GLU p 19 3.037 4.079 -0.545 1.00 0.00 H new ATOM 0 HA GLU p 19 4.230 2.270 -2.405 1.00 0.00 H new ATOM 0 HB2 GLU p 19 5.242 4.951 -1.452 1.00 0.00 H new ATOM 0 HB3 GLU p 19 5.831 4.050 -2.835 1.00 0.00 H new ATOM 0 HG2 GLU p 19 2.935 4.491 -2.901 1.00 0.00 H new ATOM 0 HG3 GLU p 19 3.857 5.980 -2.849 1.00 0.00 H new ATOM 312 N LYS p 20 5.620 3.073 0.471 1.00 0.00 N ATOM 313 CA LYS p 20 6.563 2.676 1.526 1.00 0.00 C ATOM 314 C LYS p 20 6.177 1.284 2.018 1.00 0.00 C ATOM 315 O LYS p 20 6.891 0.639 2.778 1.00 0.00 O ATOM 316 CB LYS p 20 6.549 3.667 2.679 1.00 0.00 C ATOM 317 CG LYS p 20 7.924 4.158 3.095 1.00 0.00 C ATOM 318 CD LYS p 20 8.303 3.662 4.480 1.00 0.00 C ATOM 319 CE LYS p 20 9.646 4.220 4.924 1.00 0.00 C ATOM 320 NZ LYS p 20 10.022 3.748 6.286 1.00 0.00 N ATOM 0 H LYS p 20 5.026 3.864 0.719 1.00 0.00 H new ATOM 0 HA LYS p 20 7.574 2.665 1.120 1.00 0.00 H new ATOM 0 HB2 LYS p 20 5.939 4.525 2.398 1.00 0.00 H new ATOM 0 HB3 LYS p 20 6.067 3.201 3.538 1.00 0.00 H new ATOM 0 HG2 LYS p 20 8.666 3.819 2.372 1.00 0.00 H new ATOM 0 HG3 LYS p 20 7.941 5.248 3.082 1.00 0.00 H new ATOM 0 HD2 LYS p 20 7.533 3.952 5.195 1.00 0.00 H new ATOM 0 HD3 LYS p 20 8.343 2.573 4.479 1.00 0.00 H new ATOM 0 HE2 LYS p 20 10.416 3.923 4.212 1.00 0.00 H new ATOM 0 HE3 LYS p 20 9.607 5.309 4.915 1.00 0.00 H new ATOM 0 HZ1 LYS p 20 10.919 4.191 6.572 1.00 0.00 H new ATOM 0 HZ2 LYS p 20 9.276 4.009 6.962 1.00 0.00 H new ATOM 0 HZ3 LYS p 20 10.134 2.714 6.276 1.00 0.00 H new ATOM 334 N GLU p 21 4.988 0.881 1.606 1.00 0.00 N ATOM 335 CA GLU p 21 4.464 -0.444 1.857 1.00 0.00 C ATOM 336 C GLU p 21 4.727 -1.266 0.601 1.00 0.00 C ATOM 337 O GLU p 21 5.002 -2.467 0.656 1.00 0.00 O ATOM 338 CB GLU p 21 2.968 -0.356 2.200 1.00 0.00 C ATOM 339 CG GLU p 21 2.112 -1.520 1.724 1.00 0.00 C ATOM 340 CD GLU p 21 1.498 -2.305 2.866 1.00 0.00 C ATOM 341 OE1 GLU p 21 2.144 -3.263 3.344 1.00 0.00 O ATOM 342 OE2 GLU p 21 0.370 -1.965 3.282 1.00 0.00 O ATOM 0 H GLU p 21 4.351 1.478 1.079 1.00 0.00 H new ATOM 0 HA GLU p 21 4.947 -0.921 2.710 1.00 0.00 H new ATOM 0 HB2 GLU p 21 2.867 -0.273 3.282 1.00 0.00 H new ATOM 0 HB3 GLU p 21 2.569 0.563 1.771 1.00 0.00 H new ATOM 0 HG2 GLU p 21 1.317 -1.141 1.081 1.00 0.00 H new ATOM 0 HG3 GLU p 21 2.722 -2.189 1.116 1.00 0.00 H new ATOM 349 N LEU p 22 4.626 -0.559 -0.526 1.00 0.00 N ATOM 350 CA LEU p 22 4.838 -1.115 -1.844 1.00 0.00 C ATOM 351 C LEU p 22 6.287 -0.991 -2.287 1.00 0.00 C ATOM 352 O LEU p 22 6.916 -1.982 -2.646 1.00 0.00 O ATOM 353 CB LEU p 22 3.951 -0.368 -2.838 1.00 0.00 C ATOM 354 CG LEU p 22 3.221 -1.200 -3.880 1.00 0.00 C ATOM 355 CD1 LEU p 22 2.354 -0.272 -4.697 1.00 0.00 C ATOM 356 CD2 LEU p 22 4.209 -1.936 -4.769 1.00 0.00 C ATOM 0 H LEU p 22 4.390 0.433 -0.538 1.00 0.00 H new ATOM 0 HA LEU p 22 4.587 -2.175 -1.810 1.00 0.00 H new ATOM 0 HB2 LEU p 22 3.207 0.193 -2.272 1.00 0.00 H new ATOM 0 HB3 LEU p 22 4.570 0.361 -3.361 1.00 0.00 H new ATOM 0 HG LEU p 22 2.603 -1.953 -3.390 1.00 0.00 H new ATOM 0 HD11 LEU p 22 1.819 -0.846 -5.453 1.00 0.00 H new ATOM 0 HD12 LEU p 22 1.637 0.225 -4.044 1.00 0.00 H new ATOM 0 HD13 LEU p 22 2.980 0.476 -5.184 1.00 0.00 H new ATOM 0 HD21 LEU p 22 3.665 -2.525 -5.507 1.00 0.00 H new ATOM 0 HD22 LEU p 22 4.847 -1.214 -5.279 1.00 0.00 H new ATOM 0 HD23 LEU p 22 4.825 -2.597 -4.159 1.00 0.00 H new ATOM 368 N ALA p 23 6.802 0.240 -2.225 1.00 0.00 N ATOM 369 CA ALA p 23 8.176 0.550 -2.669 1.00 0.00 C ATOM 370 C ALA p 23 9.246 0.245 -1.620 1.00 0.00 C ATOM 371 O ALA p 23 10.428 0.203 -1.961 1.00 0.00 O ATOM 372 CB ALA p 23 8.273 2.004 -3.113 1.00 0.00 C ATOM 0 H ALA p 23 6.289 1.047 -1.870 1.00 0.00 H new ATOM 0 HA ALA p 23 8.378 -0.111 -3.512 1.00 0.00 H new ATOM 0 HB1 ALA p 23 9.291 2.218 -3.438 1.00 0.00 H new ATOM 0 HB2 ALA p 23 7.584 2.179 -3.940 1.00 0.00 H new ATOM 0 HB3 ALA p 23 8.013 2.657 -2.280 1.00 0.00 H new ATOM 378 N GLN p 24 8.841 0.009 -0.364 1.00 0.00 N ATOM 379 CA GLN p 24 9.786 -0.295 0.698 1.00 0.00 C ATOM 380 C GLN p 24 9.922 -1.809 0.836 1.00 0.00 C ATOM 381 O GLN p 24 10.887 -2.302 1.377 1.00 0.00 O ATOM 382 CB GLN p 24 9.333 0.374 1.993 1.00 0.00 C ATOM 383 CG GLN p 24 9.698 -0.360 3.271 1.00 0.00 C ATOM 384 CD GLN p 24 10.537 0.476 4.217 1.00 0.00 C ATOM 385 OE1 GLN p 24 10.009 1.171 5.084 1.00 0.00 O ATOM 386 NE2 GLN p 24 11.853 0.413 4.050 1.00 0.00 N ATOM 0 H GLN p 24 7.865 0.025 -0.068 1.00 0.00 H new ATOM 0 HA GLN p 24 10.773 0.101 0.458 1.00 0.00 H new ATOM 0 HB2 GLN p 24 9.763 1.375 2.034 1.00 0.00 H new ATOM 0 HB3 GLN p 24 8.250 0.494 1.960 1.00 0.00 H new ATOM 0 HG2 GLN p 24 8.785 -0.668 3.780 1.00 0.00 H new ATOM 0 HG3 GLN p 24 10.243 -1.269 3.018 1.00 0.00 H new ATOM 0 HE21 GLN p 24 12.246 -0.178 3.317 1.00 0.00 H new ATOM 0 HE22 GLN p 24 12.470 0.955 4.655 1.00 0.00 H new ATOM 395 N LEU p 25 8.896 -2.488 0.346 1.00 0.00 N ATOM 396 CA LEU p 25 8.776 -3.943 0.273 1.00 0.00 C ATOM 397 C LEU p 25 9.756 -4.433 -0.778 1.00 0.00 C ATOM 398 O LEU p 25 10.325 -5.510 -0.682 1.00 0.00 O ATOM 399 CB LEU p 25 7.345 -4.269 -0.165 1.00 0.00 C ATOM 400 CG LEU p 25 6.734 -5.615 0.247 1.00 0.00 C ATOM 401 CD1 LEU p 25 5.479 -5.822 -0.569 1.00 0.00 C ATOM 402 CD2 LEU p 25 7.686 -6.785 0.036 1.00 0.00 C ATOM 0 H LEU p 25 8.076 -2.015 -0.034 1.00 0.00 H new ATOM 0 HA LEU p 25 8.989 -4.417 1.231 1.00 0.00 H new ATOM 0 HB2 LEU p 25 6.696 -3.481 0.217 1.00 0.00 H new ATOM 0 HB3 LEU p 25 7.311 -4.211 -1.253 1.00 0.00 H new ATOM 0 HG LEU p 25 6.517 -5.583 1.315 1.00 0.00 H new ATOM 0 HD11 LEU p 25 5.021 -6.773 -0.298 1.00 0.00 H new ATOM 0 HD12 LEU p 25 4.778 -5.012 -0.370 1.00 0.00 H new ATOM 0 HD13 LEU p 25 5.732 -5.830 -1.629 1.00 0.00 H new ATOM 0 HD21 LEU p 25 7.199 -7.710 0.345 1.00 0.00 H new ATOM 0 HD22 LEU p 25 7.954 -6.850 -1.019 1.00 0.00 H new ATOM 0 HD23 LEU p 25 8.587 -6.633 0.631 1.00 0.00 H new ATOM 414 N GLU p 26 9.865 -3.582 -1.792 1.00 0.00 N ATOM 415 CA GLU p 26 10.766 -3.694 -2.926 1.00 0.00 C ATOM 416 C GLU p 26 12.133 -3.292 -2.449 1.00 0.00 C ATOM 417 O GLU p 26 13.149 -3.634 -3.041 1.00 0.00 O ATOM 418 CB GLU p 26 10.316 -2.753 -4.029 1.00 0.00 C ATOM 419 CG GLU p 26 8.872 -2.948 -4.402 1.00 0.00 C ATOM 420 CD GLU p 26 8.657 -3.134 -5.892 1.00 0.00 C ATOM 421 OE1 GLU p 26 8.463 -2.120 -6.595 1.00 0.00 O ATOM 422 OE2 GLU p 26 8.687 -4.294 -6.355 1.00 0.00 O ATOM 0 H GLU p 26 9.288 -2.743 -1.844 1.00 0.00 H new ATOM 0 HA GLU p 26 10.773 -4.711 -3.318 1.00 0.00 H new ATOM 0 HB2 GLU p 26 10.468 -1.723 -3.707 1.00 0.00 H new ATOM 0 HB3 GLU p 26 10.939 -2.907 -4.910 1.00 0.00 H new ATOM 0 HG2 GLU p 26 8.482 -3.818 -3.874 1.00 0.00 H new ATOM 0 HG3 GLU p 26 8.297 -2.086 -4.064 1.00 0.00 H new ATOM 429 N LYS p 27 12.089 -2.495 -1.379 1.00 0.00 N ATOM 430 CA LYS p 27 13.296 -2.046 -0.667 1.00 0.00 C ATOM 431 C LYS p 27 13.687 -3.134 0.315 1.00 0.00 C ATOM 432 O LYS p 27 14.872 -3.372 0.563 1.00 0.00 O ATOM 433 CB LYS p 27 13.113 -0.724 0.080 1.00 0.00 C ATOM 434 CG LYS p 27 13.075 0.501 -0.820 1.00 0.00 C ATOM 435 CD LYS p 27 13.125 1.789 -0.012 1.00 0.00 C ATOM 436 CE LYS p 27 13.074 3.013 -0.911 1.00 0.00 C ATOM 437 NZ LYS p 27 13.119 4.280 -0.130 1.00 0.00 N ATOM 0 H LYS p 27 11.220 -2.141 -0.980 1.00 0.00 H new ATOM 0 HA LYS p 27 14.073 -1.866 -1.410 1.00 0.00 H new ATOM 0 HB2 LYS p 27 12.187 -0.769 0.653 1.00 0.00 H new ATOM 0 HB3 LYS p 27 13.926 -0.609 0.797 1.00 0.00 H new ATOM 0 HG2 LYS p 27 13.917 0.472 -1.512 1.00 0.00 H new ATOM 0 HG3 LYS p 27 12.167 0.483 -1.422 1.00 0.00 H new ATOM 0 HD2 LYS p 27 12.289 1.814 0.686 1.00 0.00 H new ATOM 0 HD3 LYS p 27 14.038 1.811 0.583 1.00 0.00 H new ATOM 0 HE2 LYS p 27 13.912 2.986 -1.608 1.00 0.00 H new ATOM 0 HE3 LYS p 27 12.162 2.987 -1.508 1.00 0.00 H new ATOM 0 HZ1 LYS p 27 13.082 5.090 -0.781 1.00 0.00 H new ATOM 0 HZ2 LYS p 27 12.306 4.318 0.517 1.00 0.00 H new ATOM 0 HZ3 LYS p 27 14.001 4.318 0.420 1.00 0.00 H new ATOM 451 N GLU p 28 12.652 -3.790 0.872 1.00 0.00 N ATOM 452 CA GLU p 28 12.848 -4.937 1.779 1.00 0.00 C ATOM 453 C GLU p 28 13.250 -6.090 0.910 1.00 0.00 C ATOM 454 O GLU p 28 14.026 -6.969 1.297 1.00 0.00 O ATOM 455 CB GLU p 28 11.585 -5.317 2.556 1.00 0.00 C ATOM 456 CG GLU p 28 10.984 -4.172 3.329 1.00 0.00 C ATOM 457 CD GLU p 28 10.953 -4.413 4.826 1.00 0.00 C ATOM 458 OE1 GLU p 28 11.937 -4.053 5.506 1.00 0.00 O ATOM 459 OE2 GLU p 28 9.945 -4.961 5.318 1.00 0.00 O ATOM 0 H GLU p 28 11.675 -3.547 0.711 1.00 0.00 H new ATOM 0 HA GLU p 28 13.598 -4.676 2.526 1.00 0.00 H new ATOM 0 HB2 GLU p 28 10.842 -5.703 1.858 1.00 0.00 H new ATOM 0 HB3 GLU p 28 11.823 -6.125 3.247 1.00 0.00 H new ATOM 0 HG2 GLU p 28 11.554 -3.266 3.125 1.00 0.00 H new ATOM 0 HG3 GLU p 28 9.968 -3.996 2.975 1.00 0.00 H new ATOM 466 N LEU p 29 12.678 -6.046 -0.292 1.00 0.00 N ATOM 467 CA LEU p 29 12.968 -7.004 -1.340 1.00 0.00 C ATOM 468 C LEU p 29 14.377 -6.762 -1.861 1.00 0.00 C ATOM 469 O LEU p 29 15.156 -7.701 -2.047 1.00 0.00 O ATOM 470 CB LEU p 29 11.971 -6.831 -2.477 1.00 0.00 C ATOM 471 CG LEU p 29 11.572 -8.070 -3.272 1.00 0.00 C ATOM 472 CD1 LEU p 29 10.617 -7.637 -4.356 1.00 0.00 C ATOM 473 CD2 LEU p 29 12.784 -8.759 -3.876 1.00 0.00 C ATOM 0 H LEU p 29 11.996 -5.337 -0.561 1.00 0.00 H new ATOM 0 HA LEU p 29 12.891 -8.016 -0.943 1.00 0.00 H new ATOM 0 HB2 LEU p 29 11.063 -6.394 -2.062 1.00 0.00 H new ATOM 0 HB3 LEU p 29 12.384 -6.104 -3.176 1.00 0.00 H new ATOM 0 HG LEU p 29 11.096 -8.791 -2.608 1.00 0.00 H new ATOM 0 HD11 LEU p 29 10.314 -8.505 -4.942 1.00 0.00 H new ATOM 0 HD12 LEU p 29 9.737 -7.179 -3.904 1.00 0.00 H new ATOM 0 HD13 LEU p 29 11.109 -6.914 -5.006 1.00 0.00 H new ATOM 0 HD21 LEU p 29 12.462 -9.637 -4.435 1.00 0.00 H new ATOM 0 HD22 LEU p 29 13.298 -8.070 -4.547 1.00 0.00 H new ATOM 0 HD23 LEU p 29 13.463 -9.064 -3.080 1.00 0.00 H new ATOM 485 N GLN p 30 14.677 -5.478 -2.092 1.00 0.00 N ATOM 486 CA GLN p 30 16.003 -5.061 -2.580 1.00 0.00 C ATOM 487 C GLN p 30 17.112 -5.395 -1.571 1.00 0.00 C ATOM 488 O GLN p 30 18.215 -5.805 -1.942 1.00 0.00 O ATOM 489 CB GLN p 30 15.974 -3.557 -2.923 1.00 0.00 C ATOM 490 CG GLN p 30 16.726 -2.631 -1.971 1.00 0.00 C ATOM 491 CD GLN p 30 16.959 -1.251 -2.554 1.00 0.00 C ATOM 492 OE1 GLN p 30 17.974 -1.003 -3.206 1.00 0.00 O ATOM 493 NE2 GLN p 30 16.019 -0.346 -2.319 1.00 0.00 N ATOM 0 H GLN p 30 14.022 -4.709 -1.950 1.00 0.00 H new ATOM 0 HA GLN p 30 16.236 -5.622 -3.485 1.00 0.00 H new ATOM 0 HB2 GLN p 30 16.386 -3.426 -3.924 1.00 0.00 H new ATOM 0 HB3 GLN p 30 14.933 -3.235 -2.962 1.00 0.00 H new ATOM 0 HG2 GLN p 30 16.163 -2.538 -1.042 1.00 0.00 H new ATOM 0 HG3 GLN p 30 17.686 -3.080 -1.718 1.00 0.00 H new ATOM 0 HE21 GLN p 30 15.195 -0.597 -1.773 1.00 0.00 H new ATOM 0 HE22 GLN p 30 16.120 0.601 -2.684 1.00 0.00 H new ATOM 502 N ALA p 31 16.772 -5.208 -0.303 1.00 0.00 N ATOM 503 CA ALA p 31 17.681 -5.466 0.826 1.00 0.00 C ATOM 504 C ALA p 31 17.822 -6.965 1.143 1.00 0.00 C ATOM 505 O ALA p 31 18.627 -7.349 2.000 1.00 0.00 O ATOM 506 CB ALA p 31 17.204 -4.707 2.057 1.00 0.00 C ATOM 0 H ALA p 31 15.853 -4.871 -0.018 1.00 0.00 H new ATOM 0 HA ALA p 31 18.670 -5.112 0.534 1.00 0.00 H new ATOM 0 HB1 ALA p 31 17.880 -4.902 2.889 1.00 0.00 H new ATOM 0 HB2 ALA p 31 17.190 -3.638 1.843 1.00 0.00 H new ATOM 0 HB3 ALA p 31 16.199 -5.037 2.321 1.00 0.00 H new ATOM 512 N TRP p 32 17.045 -7.804 0.441 1.00 0.00 N ATOM 513 CA TRP p 32 17.076 -9.261 0.638 1.00 0.00 C ATOM 514 C TRP p 32 18.224 -9.914 -0.153 1.00 0.00 C ATOM 515 O TRP p 32 18.582 -11.066 0.107 1.00 0.00 O ATOM 516 CB TRP p 32 15.733 -9.875 0.223 1.00 0.00 C ATOM 517 CG TRP p 32 15.434 -11.189 0.894 1.00 0.00 C ATOM 518 CD1 TRP p 32 15.685 -12.434 0.393 1.00 0.00 C ATOM 519 CD2 TRP p 32 14.832 -11.389 2.184 1.00 0.00 C ATOM 520 NE1 TRP p 32 15.278 -13.394 1.287 1.00 0.00 N ATOM 521 CE2 TRP p 32 14.751 -12.780 2.393 1.00 0.00 C ATOM 522 CE3 TRP p 32 14.353 -10.533 3.184 1.00 0.00 C ATOM 523 CZ2 TRP p 32 14.215 -13.331 3.554 1.00 0.00 C ATOM 524 CZ3 TRP p 32 13.821 -11.082 4.336 1.00 0.00 C ATOM 525 CH2 TRP p 32 13.756 -12.470 4.513 1.00 0.00 C ATOM 0 H TRP p 32 16.384 -7.496 -0.272 1.00 0.00 H new ATOM 0 HA TRP p 32 17.250 -9.453 1.697 1.00 0.00 H new ATOM 0 HB2 TRP p 32 14.935 -9.170 0.454 1.00 0.00 H new ATOM 0 HB3 TRP p 32 15.728 -10.020 -0.857 1.00 0.00 H new ATOM 0 HD1 TRP p 32 16.138 -12.635 -0.567 1.00 0.00 H new ATOM 0 HE1 TRP p 32 15.356 -14.402 1.150 1.00 0.00 H new ATOM 0 HE3 TRP p 32 14.399 -9.461 3.057 1.00 0.00 H new ATOM 0 HZ2 TRP p 32 14.163 -14.401 3.693 1.00 0.00 H new ATOM 0 HZ3 TRP p 32 13.449 -10.430 5.112 1.00 0.00 H new ATOM 0 HH2 TRP p 32 13.335 -12.868 5.424 1.00 0.00 H new ATOM 536 N ASN p 33 18.787 -9.167 -1.111 1.00 0.00 N ATOM 537 CA ASN p 33 19.892 -9.654 -1.941 1.00 0.00 C ATOM 538 C ASN p 33 21.244 -9.175 -1.405 1.00 0.00 C ATOM 539 O ASN p 33 22.246 -9.888 -1.510 1.00 0.00 O ATOM 540 CB ASN p 33 19.718 -9.193 -3.391 1.00 0.00 C ATOM 541 CG ASN p 33 18.561 -9.885 -4.089 1.00 0.00 C ATOM 542 OD1 ASN p 33 17.427 -9.407 -4.061 1.00 0.00 O ATOM 543 ND2 ASN p 33 18.844 -11.019 -4.720 1.00 0.00 N ATOM 0 H ASN p 33 18.491 -8.216 -1.330 1.00 0.00 H new ATOM 0 HA ASN p 33 19.874 -10.743 -1.906 1.00 0.00 H new ATOM 0 HB2 ASN p 33 19.556 -8.115 -3.409 1.00 0.00 H new ATOM 0 HB3 ASN p 33 20.638 -9.386 -3.943 1.00 0.00 H new ATOM 0 HD21 ASN p 33 18.107 -11.529 -5.207 1.00 0.00 H new ATOM 0 HD22 ASN p 33 19.798 -11.379 -4.718 1.00 0.00 H new ATOM 550 N CYS p 34 21.255 -7.964 -0.830 1.00 0.00 N ATOM 551 CA CYS p 34 22.471 -7.369 -0.269 1.00 0.00 C ATOM 552 C CYS p 34 22.600 -7.687 1.223 1.00 0.00 C ATOM 553 O CYS p 34 21.611 -8.018 1.883 1.00 0.00 O ATOM 554 CB CYS p 34 22.458 -5.851 -0.486 1.00 0.00 C ATOM 555 SG CYS p 34 23.983 -5.016 0.014 1.00 0.00 S ATOM 0 H CYS p 34 20.427 -7.375 -0.742 1.00 0.00 H new ATOM 0 HA CYS p 34 23.331 -7.798 -0.783 1.00 0.00 H new ATOM 0 HB2 CYS p 34 22.275 -5.648 -1.541 1.00 0.00 H new ATOM 0 HB3 CYS p 34 21.624 -5.423 0.070 1.00 0.00 H new ATOM 0 HG CYS p 34 23.873 -3.740 -0.211 1.00 0.00 H new ATOM 561 N ILE p 35 23.841 -7.581 1.747 1.00 0.00 N ATOM 562 CA ILE p 35 24.160 -7.852 3.173 1.00 0.00 C ATOM 563 C ILE p 35 24.008 -9.351 3.492 1.00 0.00 C ATOM 564 O ILE p 35 23.102 -10.014 2.980 1.00 0.00 O ATOM 565 CB ILE p 35 23.303 -7.000 4.178 1.00 0.00 C ATOM 566 CG1 ILE p 35 23.274 -5.519 3.768 1.00 0.00 C ATOM 567 CG2 ILE p 35 23.840 -7.114 5.605 1.00 0.00 C ATOM 568 CD1 ILE p 35 21.919 -5.050 3.284 1.00 0.00 C ATOM 0 H ILE p 35 24.653 -7.305 1.195 1.00 0.00 H new ATOM 0 HA ILE p 35 25.199 -7.551 3.310 1.00 0.00 H new ATOM 0 HB ILE p 35 22.290 -7.401 4.147 1.00 0.00 H new ATOM 0 HG12 ILE p 35 23.577 -4.909 4.619 1.00 0.00 H new ATOM 0 HG13 ILE p 35 24.009 -5.355 2.980 1.00 0.00 H new ATOM 0 HG21 ILE p 35 23.225 -6.513 6.274 1.00 0.00 H new ATOM 0 HG22 ILE p 35 23.810 -8.156 5.923 1.00 0.00 H new ATOM 0 HG23 ILE p 35 24.868 -6.754 5.637 1.00 0.00 H new ATOM 0 HD11 ILE p 35 21.975 -3.996 3.012 1.00 0.00 H new ATOM 0 HD12 ILE p 35 21.622 -5.634 2.413 1.00 0.00 H new ATOM 0 HD13 ILE p 35 21.184 -5.182 4.078 1.00 0.00 H new ATOM 580 N CYS p 36 24.904 -9.860 4.346 1.00 0.00 N ATOM 581 CA CYS p 36 24.893 -11.270 4.745 1.00 0.00 C ATOM 582 C CYS p 36 24.094 -11.486 6.033 1.00 0.00 C ATOM 583 O CYS p 36 23.331 -12.450 6.137 1.00 0.00 O ATOM 584 CB CYS p 36 26.326 -11.780 4.924 1.00 0.00 C ATOM 585 SG CYS p 36 27.342 -11.664 3.434 1.00 0.00 S ATOM 0 H CYS p 36 25.649 -9.312 4.775 1.00 0.00 H new ATOM 0 HA CYS p 36 24.405 -11.835 3.951 1.00 0.00 H new ATOM 0 HB2 CYS p 36 26.805 -11.213 5.722 1.00 0.00 H new ATOM 0 HB3 CYS p 36 26.292 -12.820 5.248 1.00 0.00 H new ATOM 0 HG CYS p 36 28.535 -12.116 3.686 1.00 0.00 H new ATOM 591 N ASP p 37 24.277 -10.584 7.006 1.00 0.00 N ATOM 592 CA ASP p 37 23.578 -10.669 8.290 1.00 0.00 C ATOM 593 C ASP p 37 22.401 -9.696 8.335 1.00 0.00 C ATOM 594 O ASP p 37 22.586 -8.474 8.298 1.00 0.00 O ATOM 595 CB ASP p 37 24.543 -10.392 9.449 1.00 0.00 C ATOM 596 CG ASP p 37 25.553 -11.507 9.649 1.00 0.00 C ATOM 597 OD1 ASP p 37 25.257 -12.447 10.416 1.00 0.00 O ATOM 598 OD2 ASP p 37 26.640 -11.441 9.036 1.00 0.00 O ATOM 0 H ASP p 37 24.906 -9.785 6.925 1.00 0.00 H new ATOM 0 HA ASP p 37 23.189 -11.682 8.396 1.00 0.00 H new ATOM 0 HB2 ASP p 37 25.072 -9.458 9.261 1.00 0.00 H new ATOM 0 HB3 ASP p 37 23.972 -10.256 10.367 1.00 0.00 H new ATOM 603 N ILE p 38 21.187 -10.256 8.402 1.00 0.00 N ATOM 604 CA ILE p 38 19.952 -9.462 8.456 1.00 0.00 C ATOM 605 C ILE p 38 18.879 -10.166 9.286 1.00 0.00 C ATOM 606 O ILE p 38 18.658 -11.371 9.132 1.00 0.00 O ATOM 607 CB ILE p 38 19.384 -9.126 7.040 1.00 0.00 C ATOM 608 CG1 ILE p 38 19.424 -10.335 6.082 1.00 0.00 C ATOM 609 CG2 ILE p 38 20.146 -7.956 6.434 1.00 0.00 C ATOM 610 CD1 ILE p 38 18.166 -11.179 6.108 1.00 0.00 C ATOM 0 H ILE p 38 21.033 -11.264 8.420 1.00 0.00 H new ATOM 0 HA ILE p 38 20.222 -8.521 8.935 1.00 0.00 H new ATOM 0 HB ILE p 38 18.336 -8.855 7.172 1.00 0.00 H new ATOM 0 HG12 ILE p 38 19.588 -9.976 5.066 1.00 0.00 H new ATOM 0 HG13 ILE p 38 20.277 -10.963 6.340 1.00 0.00 H new ATOM 0 HG21 ILE p 38 19.742 -7.730 5.447 1.00 0.00 H new ATOM 0 HG22 ILE p 38 20.042 -7.082 7.077 1.00 0.00 H new ATOM 0 HG23 ILE p 38 21.201 -8.216 6.343 1.00 0.00 H new ATOM 0 HD11 ILE p 38 18.270 -12.009 5.409 1.00 0.00 H new ATOM 0 HD12 ILE p 38 18.010 -11.569 7.114 1.00 0.00 H new ATOM 0 HD13 ILE p 38 17.311 -10.567 5.820 1.00 0.00 H new ATOM 622 N GLU p 39 18.224 -9.403 10.166 1.00 0.00 N ATOM 623 CA GLU p 39 17.169 -9.937 11.030 1.00 0.00 C ATOM 624 C GLU p 39 15.800 -9.413 10.603 1.00 0.00 C ATOM 625 O GLU p 39 15.587 -8.198 10.525 1.00 0.00 O ATOM 626 CB GLU p 39 17.436 -9.574 12.497 1.00 0.00 C ATOM 627 CG GLU p 39 18.618 -10.311 13.109 1.00 0.00 C ATOM 628 CD GLU p 39 18.794 -10.007 14.583 1.00 0.00 C ATOM 629 OE1 GLU p 39 18.205 -10.730 15.413 1.00 0.00 O ATOM 630 OE2 GLU p 39 19.522 -9.046 14.908 1.00 0.00 O ATOM 0 H GLU p 39 18.408 -8.408 10.298 1.00 0.00 H new ATOM 0 HA GLU p 39 17.172 -11.022 10.931 1.00 0.00 H new ATOM 0 HB2 GLU p 39 17.613 -8.501 12.569 1.00 0.00 H new ATOM 0 HB3 GLU p 39 16.543 -9.790 13.083 1.00 0.00 H new ATOM 0 HG2 GLU p 39 18.480 -11.384 12.977 1.00 0.00 H new ATOM 0 HG3 GLU p 39 19.528 -10.038 12.574 1.00 0.00 H new ATOM 637 N ASN p 40 14.880 -10.343 10.324 1.00 0.00 N ATOM 638 CA ASN p 40 13.519 -9.998 9.903 1.00 0.00 C ATOM 639 C ASN p 40 12.481 -10.827 10.663 1.00 0.00 C ATOM 640 O ASN p 40 11.491 -10.283 11.159 1.00 0.00 O ATOM 641 CB ASN p 40 13.351 -10.201 8.390 1.00 0.00 C ATOM 642 CG ASN p 40 14.127 -9.184 7.574 1.00 0.00 C ATOM 643 OD1 ASN p 40 13.614 -8.115 7.241 1.00 0.00 O ATOM 644 ND2 ASN p 40 15.371 -9.514 7.247 1.00 0.00 N ATOM 0 H ASN p 40 15.056 -11.346 10.383 1.00 0.00 H new ATOM 0 HA ASN p 40 13.356 -8.946 10.136 1.00 0.00 H new ATOM 0 HB2 ASN p 40 13.683 -11.204 8.123 1.00 0.00 H new ATOM 0 HB3 ASN p 40 12.294 -10.136 8.134 1.00 0.00 H new ATOM 0 HD21 ASN p 40 15.942 -8.871 6.698 1.00 0.00 H new ATOM 0 HD22 ASN p 40 15.756 -10.411 7.544 1.00 0.00 H new ATOM 651 N CYS p 41 12.719 -12.145 10.746 1.00 0.00 N ATOM 652 CA CYS p 41 11.814 -13.063 11.442 1.00 0.00 C ATOM 653 C CYS p 41 12.596 -14.015 12.346 1.00 0.00 C ATOM 654 O CYS p 41 13.768 -14.305 12.087 1.00 0.00 O ATOM 655 CB CYS p 41 10.985 -13.862 10.432 1.00 0.00 C ATOM 656 SG CYS p 41 9.660 -14.843 11.174 1.00 0.00 S ATOM 0 H CYS p 41 13.536 -12.598 10.336 1.00 0.00 H new ATOM 0 HA CYS p 41 11.142 -12.471 12.063 1.00 0.00 H new ATOM 0 HB2 CYS p 41 10.550 -13.172 9.709 1.00 0.00 H new ATOM 0 HB3 CYS p 41 11.648 -14.527 9.879 1.00 0.00 H new ATOM 0 HG CYS p 41 9.917 -16.108 11.018 1.00 0.00 H new ATOM 662 N SER p 42 11.932 -14.496 13.404 1.00 0.00 N ATOM 663 CA SER p 42 12.550 -15.416 14.362 1.00 0.00 C ATOM 664 C SER p 42 12.193 -16.872 14.047 1.00 0.00 C ATOM 665 O SER p 42 13.060 -17.750 14.094 1.00 0.00 O ATOM 666 CB SER p 42 12.117 -15.060 15.790 1.00 0.00 C ATOM 667 OG SER p 42 12.866 -15.784 16.753 1.00 0.00 O ATOM 0 H SER p 42 10.963 -14.261 13.617 1.00 0.00 H new ATOM 0 HA SER p 42 13.632 -15.312 14.280 1.00 0.00 H new ATOM 0 HB2 SER p 42 12.246 -13.990 15.955 1.00 0.00 H new ATOM 0 HB3 SER p 42 11.056 -15.276 15.915 1.00 0.00 H new ATOM 0 HG SER p 42 12.569 -15.535 17.653 1.00 0.00 H new ATOM 673 N ASN p 43 10.915 -17.116 13.729 1.00 0.00 N ATOM 674 CA ASN p 43 10.431 -18.462 13.406 1.00 0.00 C ATOM 675 C ASN p 43 10.342 -18.664 11.896 1.00 0.00 C ATOM 676 O ASN p 43 10.143 -17.705 11.145 1.00 0.00 O ATOM 677 CB ASN p 43 9.060 -18.705 14.045 1.00 0.00 C ATOM 678 CG ASN p 43 9.131 -18.823 15.557 1.00 0.00 C ATOM 679 OD1 ASN p 43 9.018 -17.829 16.274 1.00 0.00 O ATOM 680 ND2 ASN p 43 9.319 -20.043 16.047 1.00 0.00 N ATOM 0 H ASN p 43 10.196 -16.394 13.689 1.00 0.00 H new ATOM 0 HA ASN p 43 11.145 -19.180 13.809 1.00 0.00 H new ATOM 0 HB2 ASN p 43 8.390 -17.887 13.780 1.00 0.00 H new ATOM 0 HB3 ASN p 43 8.628 -19.617 13.633 1.00 0.00 H new ATOM 0 HD21 ASN p 43 9.375 -20.184 17.056 1.00 0.00 H new ATOM 0 HD22 ASN p 43 9.407 -20.839 15.415 1.00 0.00 H new ATOM 687 N MET p 44 10.491 -19.921 11.462 1.00 0.00 N ATOM 688 CA MET p 44 10.430 -20.270 10.039 1.00 0.00 C ATOM 689 C MET p 44 9.029 -20.755 9.648 1.00 0.00 C ATOM 690 O MET p 44 8.552 -21.778 10.146 1.00 0.00 O ATOM 691 CB MET p 44 11.510 -21.316 9.670 1.00 0.00 C ATOM 692 CG MET p 44 11.590 -22.539 10.591 1.00 0.00 C ATOM 693 SD MET p 44 10.482 -23.870 10.085 1.00 0.00 S ATOM 694 CE MET p 44 10.839 -25.101 11.335 1.00 0.00 C ATOM 0 H MET p 44 10.655 -20.716 12.079 1.00 0.00 H new ATOM 0 HA MET p 44 10.639 -19.366 9.467 1.00 0.00 H new ATOM 0 HB2 MET p 44 11.323 -21.661 8.653 1.00 0.00 H new ATOM 0 HB3 MET p 44 12.482 -20.822 9.666 1.00 0.00 H new ATOM 0 HG2 MET p 44 12.614 -22.911 10.605 1.00 0.00 H new ATOM 0 HG3 MET p 44 11.346 -22.237 11.610 1.00 0.00 H new ATOM 0 HE1 MET p 44 10.230 -25.987 11.158 1.00 0.00 H new ATOM 0 HE2 MET p 44 11.894 -25.371 11.289 1.00 0.00 H new ATOM 0 HE3 MET p 44 10.611 -24.695 12.321 1.00 0.00 H new ATOM 704 N ALA p 45 8.377 -19.988 8.766 1.00 0.00 N ATOM 705 CA ALA p 45 7.029 -20.308 8.283 1.00 0.00 C ATOM 706 C ALA p 45 6.891 -19.982 6.786 1.00 0.00 C ATOM 707 O ALA p 45 7.665 -19.169 6.271 1.00 0.00 O ATOM 708 CB ALA p 45 5.983 -19.538 9.087 1.00 0.00 C ATOM 0 H ALA p 45 8.766 -19.133 8.369 1.00 0.00 H new ATOM 0 HA ALA p 45 6.864 -21.377 8.418 1.00 0.00 H new ATOM 0 HB1 ALA p 45 4.987 -19.784 8.719 1.00 0.00 H new ATOM 0 HB2 ALA p 45 6.059 -19.812 10.139 1.00 0.00 H new ATOM 0 HB3 ALA p 45 6.156 -18.467 8.978 1.00 0.00 H new ATOM 714 N PRO p 46 5.908 -20.605 6.047 1.00 0.00 N ATOM 715 CA PRO p 46 5.706 -20.337 4.600 1.00 0.00 C ATOM 716 C PRO p 46 5.447 -18.851 4.292 1.00 0.00 C ATOM 717 O PRO p 46 6.310 -18.174 3.726 1.00 0.00 O ATOM 718 CB PRO p 46 4.476 -21.188 4.245 1.00 0.00 C ATOM 719 CG PRO p 46 4.443 -22.262 5.270 1.00 0.00 C ATOM 720 CD PRO p 46 4.939 -21.623 6.535 1.00 0.00 C ATOM 0 HA PRO p 46 6.595 -20.584 4.020 1.00 0.00 H new ATOM 0 HB2 PRO p 46 3.564 -20.592 4.268 1.00 0.00 H new ATOM 0 HB3 PRO p 46 4.560 -21.603 3.241 1.00 0.00 H new ATOM 0 HG2 PRO p 46 3.433 -22.653 5.397 1.00 0.00 H new ATOM 0 HG3 PRO p 46 5.075 -23.101 4.980 1.00 0.00 H new ATOM 0 HD2 PRO p 46 4.127 -21.167 7.100 1.00 0.00 H new ATOM 0 HD3 PRO p 46 5.416 -22.350 7.193 1.00 0.00 H new ATOM 728 N LEU p 47 4.245 -18.356 4.674 1.00 0.00 N ATOM 729 CA LEU p 47 3.814 -16.952 4.482 1.00 0.00 C ATOM 730 C LEU p 47 3.666 -16.546 3.006 1.00 0.00 C ATOM 731 O LEU p 47 3.055 -15.523 2.708 1.00 0.00 O ATOM 732 CB LEU p 47 4.769 -16.000 5.201 1.00 0.00 C ATOM 733 CG LEU p 47 4.595 -15.926 6.721 1.00 0.00 C ATOM 734 CD1 LEU p 47 5.937 -15.702 7.399 1.00 0.00 C ATOM 735 CD2 LEU p 47 3.620 -14.817 7.099 1.00 0.00 C ATOM 0 H LEU p 47 3.537 -18.931 5.131 1.00 0.00 H new ATOM 0 HA LEU p 47 2.818 -16.878 4.919 1.00 0.00 H new ATOM 0 HB2 LEU p 47 5.793 -16.305 4.983 1.00 0.00 H new ATOM 0 HB3 LEU p 47 4.639 -15.000 4.787 1.00 0.00 H new ATOM 0 HG LEU p 47 4.185 -16.876 7.064 1.00 0.00 H new ATOM 0 HD11 LEU p 47 5.795 -15.652 8.479 1.00 0.00 H new ATOM 0 HD12 LEU p 47 6.608 -16.527 7.159 1.00 0.00 H new ATOM 0 HD13 LEU p 47 6.371 -14.767 7.046 1.00 0.00 H new ATOM 0 HD21 LEU p 47 3.511 -14.782 8.183 1.00 0.00 H new ATOM 0 HD22 LEU p 47 4.001 -13.860 6.742 1.00 0.00 H new ATOM 0 HD23 LEU p 47 2.650 -15.014 6.643 1.00 0.00 H new ATOM 747 N TYR p 48 4.226 -17.372 2.103 1.00 0.00 N ATOM 748 CA TYR p 48 4.194 -17.190 0.635 1.00 0.00 C ATOM 749 C TYR p 48 4.749 -15.836 0.167 1.00 0.00 C ATOM 750 O TYR p 48 4.659 -14.828 0.873 1.00 0.00 O ATOM 751 CB TYR p 48 2.770 -17.418 0.110 1.00 0.00 C ATOM 752 CG TYR p 48 2.292 -18.851 0.250 1.00 0.00 C ATOM 753 CD1 TYR p 48 1.896 -19.351 1.488 1.00 0.00 C ATOM 754 CD2 TYR p 48 2.243 -19.702 -0.846 1.00 0.00 C ATOM 755 CE1 TYR p 48 1.465 -20.653 1.628 1.00 0.00 C ATOM 756 CE2 TYR p 48 1.810 -21.009 -0.714 1.00 0.00 C ATOM 757 CZ TYR p 48 1.424 -21.480 0.525 1.00 0.00 C ATOM 758 OH TYR p 48 0.995 -22.780 0.661 1.00 0.00 O ATOM 0 H TYR p 48 4.731 -18.213 2.382 1.00 0.00 H new ATOM 0 HA TYR p 48 4.863 -17.939 0.211 1.00 0.00 H new ATOM 0 HB2 TYR p 48 2.085 -16.761 0.646 1.00 0.00 H new ATOM 0 HB3 TYR p 48 2.729 -17.131 -0.941 1.00 0.00 H new ATOM 0 HD1 TYR p 48 1.927 -18.707 2.354 1.00 0.00 H new ATOM 0 HD2 TYR p 48 2.548 -19.338 -1.816 1.00 0.00 H new ATOM 0 HE1 TYR p 48 1.161 -21.023 2.596 1.00 0.00 H new ATOM 0 HE2 TYR p 48 1.774 -21.658 -1.576 1.00 0.00 H new ATOM 0 HH TYR p 48 1.025 -23.227 -0.210 1.00 0.00 H new ATOM 768 N SER p 49 5.335 -15.843 -1.035 1.00 0.00 N ATOM 769 CA SER p 49 5.924 -14.640 -1.630 1.00 0.00 C ATOM 770 C SER p 49 5.335 -14.353 -3.012 1.00 0.00 C ATOM 771 O SER p 49 5.476 -13.246 -3.534 1.00 0.00 O ATOM 772 CB SER p 49 7.439 -14.802 -1.741 1.00 0.00 C ATOM 773 OG SER p 49 8.075 -13.556 -1.965 1.00 0.00 O ATOM 0 H SER p 49 5.414 -16.676 -1.618 1.00 0.00 H new ATOM 0 HA SER p 49 5.691 -13.797 -0.980 1.00 0.00 H new ATOM 0 HB2 SER p 49 7.827 -15.251 -0.827 1.00 0.00 H new ATOM 0 HB3 SER p 49 7.675 -15.485 -2.557 1.00 0.00 H new ATOM 0 HG SER p 49 7.507 -12.997 -2.536 1.00 0.00 H new ATOM 779 N ASP p 50 4.702 -15.367 -3.604 1.00 0.00 N ATOM 780 CA ASP p 50 4.081 -15.239 -4.928 1.00 0.00 C ATOM 781 C ASP p 50 2.575 -14.975 -4.808 1.00 0.00 C ATOM 782 O ASP p 50 2.039 -14.072 -5.459 1.00 0.00 O ATOM 783 CB ASP p 50 4.357 -16.486 -5.797 1.00 0.00 C ATOM 784 CG ASP p 50 4.009 -17.805 -5.115 1.00 0.00 C ATOM 785 OD1 ASP p 50 4.891 -18.375 -4.438 1.00 0.00 O ATOM 786 OD2 ASP p 50 2.857 -18.264 -5.262 1.00 0.00 O ATOM 0 H ASP p 50 4.604 -16.292 -3.186 1.00 0.00 H new ATOM 0 HA ASP p 50 4.533 -14.380 -5.424 1.00 0.00 H new ATOM 0 HB2 ASP p 50 3.786 -16.405 -6.722 1.00 0.00 H new ATOM 0 HB3 ASP p 50 5.411 -16.498 -6.073 1.00 0.00 H new ATOM 791 N GLN p 51 1.910 -15.777 -3.969 1.00 0.00 N ATOM 792 CA GLN p 51 0.466 -15.669 -3.734 1.00 0.00 C ATOM 793 C GLN p 51 0.142 -14.761 -2.538 1.00 0.00 C ATOM 794 O GLN p 51 -1.029 -14.464 -2.282 1.00 0.00 O ATOM 795 CB GLN p 51 -0.143 -17.060 -3.512 1.00 0.00 C ATOM 796 CG GLN p 51 -0.244 -17.897 -4.780 1.00 0.00 C ATOM 797 CD GLN p 51 -0.840 -19.268 -4.528 1.00 0.00 C ATOM 798 OE1 GLN p 51 -2.054 -19.453 -4.602 1.00 0.00 O ATOM 799 NE2 GLN p 51 0.016 -20.239 -4.227 1.00 0.00 N ATOM 0 H GLN p 51 2.359 -16.520 -3.433 1.00 0.00 H new ATOM 0 HA GLN p 51 0.027 -15.216 -4.623 1.00 0.00 H new ATOM 0 HB2 GLN p 51 0.460 -17.598 -2.780 1.00 0.00 H new ATOM 0 HB3 GLN p 51 -1.138 -16.946 -3.083 1.00 0.00 H new ATOM 0 HG2 GLN p 51 -0.855 -17.368 -5.512 1.00 0.00 H new ATOM 0 HG3 GLN p 51 0.749 -18.011 -5.216 1.00 0.00 H new ATOM 0 HE21 GLN p 51 1.015 -20.040 -4.177 1.00 0.00 H new ATOM 0 HE22 GLN p 51 -0.326 -21.183 -4.046 1.00 0.00 H new ATOM 808 N ALA p 52 1.173 -14.353 -1.792 1.00 0.00 N ATOM 809 CA ALA p 52 0.987 -13.504 -0.612 1.00 0.00 C ATOM 810 C ALA p 52 1.466 -12.063 -0.810 1.00 0.00 C ATOM 811 O ALA p 52 1.079 -11.176 -0.056 1.00 0.00 O ATOM 812 CB ALA p 52 1.704 -14.129 0.576 1.00 0.00 C ATOM 0 H ALA p 52 2.145 -14.597 -1.984 1.00 0.00 H new ATOM 0 HA ALA p 52 -0.086 -13.446 -0.431 1.00 0.00 H new ATOM 0 HB1 ALA p 52 1.568 -13.500 1.455 1.00 0.00 H new ATOM 0 HB2 ALA p 52 1.291 -15.119 0.770 1.00 0.00 H new ATOM 0 HB3 ALA p 52 2.768 -14.217 0.354 1.00 0.00 H new ATOM 818 N LEU p 53 2.340 -11.851 -1.786 1.00 0.00 N ATOM 819 CA LEU p 53 2.902 -10.550 -2.079 1.00 0.00 C ATOM 820 C LEU p 53 2.160 -9.866 -3.221 1.00 0.00 C ATOM 821 O LEU p 53 1.423 -8.909 -3.014 1.00 0.00 O ATOM 822 CB LEU p 53 4.382 -10.741 -2.409 1.00 0.00 C ATOM 823 CG LEU p 53 5.291 -9.548 -2.183 1.00 0.00 C ATOM 824 CD1 LEU p 53 6.684 -10.056 -1.899 1.00 0.00 C ATOM 825 CD2 LEU p 53 5.285 -8.649 -3.405 1.00 0.00 C ATOM 0 H LEU p 53 2.679 -12.591 -2.401 1.00 0.00 H new ATOM 0 HA LEU p 53 2.796 -9.897 -1.213 1.00 0.00 H new ATOM 0 HB2 LEU p 53 4.758 -11.573 -1.814 1.00 0.00 H new ATOM 0 HB3 LEU p 53 4.462 -11.036 -3.455 1.00 0.00 H new ATOM 0 HG LEU p 53 4.938 -8.961 -1.335 1.00 0.00 H new ATOM 0 HD11 LEU p 53 7.353 -9.211 -1.734 1.00 0.00 H new ATOM 0 HD12 LEU p 53 6.667 -10.685 -1.009 1.00 0.00 H new ATOM 0 HD13 LEU p 53 7.039 -10.639 -2.749 1.00 0.00 H new ATOM 0 HD21 LEU p 53 5.941 -7.796 -3.232 1.00 0.00 H new ATOM 0 HD22 LEU p 53 5.639 -9.209 -4.271 1.00 0.00 H new ATOM 0 HD23 LEU p 53 4.271 -8.295 -3.592 1.00 0.00 H new ATOM 837 N LYS p 54 2.345 -10.428 -4.420 1.00 0.00 N ATOM 838 CA LYS p 54 1.732 -9.927 -5.670 1.00 0.00 C ATOM 839 C LYS p 54 0.202 -9.979 -5.631 1.00 0.00 C ATOM 840 O LYS p 54 -0.468 -9.374 -6.466 1.00 0.00 O ATOM 841 CB LYS p 54 2.243 -10.731 -6.870 1.00 0.00 C ATOM 842 CG LYS p 54 3.687 -10.429 -7.244 1.00 0.00 C ATOM 843 CD LYS p 54 4.138 -11.263 -8.431 1.00 0.00 C ATOM 844 CE LYS p 54 5.578 -10.960 -8.810 1.00 0.00 C ATOM 845 NZ LYS p 54 6.028 -11.772 -9.974 1.00 0.00 N ATOM 0 H LYS p 54 2.929 -11.252 -4.559 1.00 0.00 H new ATOM 0 HA LYS p 54 2.025 -8.882 -5.771 1.00 0.00 H new ATOM 0 HB2 LYS p 54 2.150 -11.794 -6.649 1.00 0.00 H new ATOM 0 HB3 LYS p 54 1.605 -10.527 -7.730 1.00 0.00 H new ATOM 0 HG2 LYS p 54 3.789 -9.370 -7.482 1.00 0.00 H new ATOM 0 HG3 LYS p 54 4.335 -10.628 -6.390 1.00 0.00 H new ATOM 0 HD2 LYS p 54 4.039 -12.322 -8.192 1.00 0.00 H new ATOM 0 HD3 LYS p 54 3.487 -11.067 -9.283 1.00 0.00 H new ATOM 0 HE2 LYS p 54 5.676 -9.901 -9.047 1.00 0.00 H new ATOM 0 HE3 LYS p 54 6.227 -11.157 -7.957 1.00 0.00 H new ATOM 0 HZ1 LYS p 54 7.015 -11.536 -10.201 1.00 0.00 H new ATOM 0 HZ2 LYS p 54 5.959 -12.783 -9.740 1.00 0.00 H new ATOM 0 HZ3 LYS p 54 5.425 -11.565 -10.796 1.00 0.00 H new ATOM 859 N LYS p 55 -0.316 -10.721 -4.655 1.00 0.00 N ATOM 860 CA LYS p 55 -1.729 -10.896 -4.427 1.00 0.00 C ATOM 861 C LYS p 55 -2.202 -9.914 -3.377 1.00 0.00 C ATOM 862 O LYS p 55 -3.284 -9.342 -3.500 1.00 0.00 O ATOM 863 CB LYS p 55 -2.015 -12.327 -4.003 1.00 0.00 C ATOM 864 CG LYS p 55 -2.250 -13.270 -5.171 1.00 0.00 C ATOM 865 CD LYS p 55 -2.867 -14.586 -4.717 1.00 0.00 C ATOM 866 CE LYS p 55 -3.105 -15.530 -5.886 1.00 0.00 C ATOM 867 NZ LYS p 55 -4.278 -15.121 -6.709 1.00 0.00 N ATOM 0 H LYS p 55 0.263 -11.228 -3.986 1.00 0.00 H new ATOM 0 HA LYS p 55 -2.273 -10.701 -5.351 1.00 0.00 H new ATOM 0 HB2 LYS p 55 -1.178 -12.696 -3.411 1.00 0.00 H new ATOM 0 HB3 LYS p 55 -2.892 -12.337 -3.356 1.00 0.00 H new ATOM 0 HG2 LYS p 55 -2.906 -12.792 -5.898 1.00 0.00 H new ATOM 0 HG3 LYS p 55 -1.304 -13.467 -5.676 1.00 0.00 H new ATOM 0 HD2 LYS p 55 -2.210 -15.065 -3.991 1.00 0.00 H new ATOM 0 HD3 LYS p 55 -3.812 -14.389 -4.210 1.00 0.00 H new ATOM 0 HE2 LYS p 55 -2.215 -15.559 -6.514 1.00 0.00 H new ATOM 0 HE3 LYS p 55 -3.262 -16.540 -5.509 1.00 0.00 H new ATOM 0 HZ1 LYS p 55 -4.403 -15.792 -7.494 1.00 0.00 H new ATOM 0 HZ2 LYS p 55 -5.133 -15.118 -6.117 1.00 0.00 H new ATOM 0 HZ3 LYS p 55 -4.118 -14.167 -7.091 1.00 0.00 H new ATOM 881 N LYS p 56 -1.369 -9.729 -2.337 1.00 0.00 N ATOM 882 CA LYS p 56 -1.672 -8.753 -1.261 1.00 0.00 C ATOM 883 C LYS p 56 -1.415 -7.327 -1.765 1.00 0.00 C ATOM 884 O LYS p 56 -1.799 -6.338 -1.139 1.00 0.00 O ATOM 885 CB LYS p 56 -0.845 -9.024 -0.010 1.00 0.00 C ATOM 886 CG LYS p 56 -1.485 -10.033 0.929 1.00 0.00 C ATOM 887 CD LYS p 56 -0.705 -10.158 2.228 1.00 0.00 C ATOM 888 CE LYS p 56 -1.342 -11.173 3.163 1.00 0.00 C ATOM 889 NZ LYS p 56 -0.582 -11.307 4.436 1.00 0.00 N ATOM 0 H LYS p 56 -0.491 -10.233 -2.214 1.00 0.00 H new ATOM 0 HA LYS p 56 -2.723 -8.861 -0.993 1.00 0.00 H new ATOM 0 HB2 LYS p 56 0.139 -9.387 -0.306 1.00 0.00 H new ATOM 0 HB3 LYS p 56 -0.691 -8.087 0.525 1.00 0.00 H new ATOM 0 HG2 LYS p 56 -2.509 -9.731 1.146 1.00 0.00 H new ATOM 0 HG3 LYS p 56 -1.537 -11.005 0.439 1.00 0.00 H new ATOM 0 HD2 LYS p 56 0.321 -10.455 2.011 1.00 0.00 H new ATOM 0 HD3 LYS p 56 -0.658 -9.187 2.721 1.00 0.00 H new ATOM 0 HE2 LYS p 56 -2.367 -10.872 3.382 1.00 0.00 H new ATOM 0 HE3 LYS p 56 -1.393 -12.142 2.667 1.00 0.00 H new ATOM 0 HZ1 LYS p 56 -1.048 -12.008 5.046 1.00 0.00 H new ATOM 0 HZ2 LYS p 56 0.389 -11.618 4.230 1.00 0.00 H new ATOM 0 HZ3 LYS p 56 -0.555 -10.388 4.922 1.00 0.00 H new ATOM 903 N LEU p 57 -0.745 -7.287 -2.916 1.00 0.00 N ATOM 904 CA LEU p 57 -0.393 -6.089 -3.654 1.00 0.00 C ATOM 905 C LEU p 57 -1.487 -5.859 -4.652 1.00 0.00 C ATOM 906 O LEU p 57 -1.953 -4.742 -4.849 1.00 0.00 O ATOM 907 CB LEU p 57 0.923 -6.299 -4.396 1.00 0.00 C ATOM 908 CG LEU p 57 2.177 -5.672 -3.794 1.00 0.00 C ATOM 909 CD1 LEU p 57 2.476 -6.237 -2.411 1.00 0.00 C ATOM 910 CD2 LEU p 57 3.326 -5.933 -4.739 1.00 0.00 C ATOM 0 H LEU p 57 -0.419 -8.137 -3.377 1.00 0.00 H new ATOM 0 HA LEU p 57 -0.278 -5.240 -2.980 1.00 0.00 H new ATOM 0 HB2 LEU p 57 1.092 -7.372 -4.484 1.00 0.00 H new ATOM 0 HB3 LEU p 57 0.805 -5.911 -5.408 1.00 0.00 H new ATOM 0 HG LEU p 57 2.025 -4.600 -3.668 1.00 0.00 H new ATOM 0 HD11 LEU p 57 3.376 -5.768 -2.013 1.00 0.00 H new ATOM 0 HD12 LEU p 57 1.636 -6.035 -1.746 1.00 0.00 H new ATOM 0 HD13 LEU p 57 2.630 -7.314 -2.483 1.00 0.00 H new ATOM 0 HD21 LEU p 57 4.238 -5.495 -4.333 1.00 0.00 H new ATOM 0 HD22 LEU p 57 3.462 -7.008 -4.858 1.00 0.00 H new ATOM 0 HD23 LEU p 57 3.109 -5.485 -5.709 1.00 0.00 H new ATOM 922 N ALA p 58 -1.865 -6.975 -5.294 1.00 0.00 N ATOM 923 CA ALA p 58 -2.984 -6.988 -6.263 1.00 0.00 C ATOM 924 C ALA p 58 -4.304 -6.688 -5.545 1.00 0.00 C ATOM 925 O ALA p 58 -5.301 -6.315 -6.167 1.00 0.00 O ATOM 926 CB ALA p 58 -3.079 -8.319 -6.991 1.00 0.00 C ATOM 0 H ALA p 58 -1.416 -7.882 -5.163 1.00 0.00 H new ATOM 0 HA ALA p 58 -2.790 -6.214 -7.006 1.00 0.00 H new ATOM 0 HB1 ALA p 58 -3.912 -8.291 -7.694 1.00 0.00 H new ATOM 0 HB2 ALA p 58 -2.152 -8.504 -7.534 1.00 0.00 H new ATOM 0 HB3 ALA p 58 -3.241 -9.118 -6.268 1.00 0.00 H new ATOM 932 N GLN p 59 -4.266 -6.866 -4.219 1.00 0.00 N ATOM 933 CA GLN p 59 -5.362 -6.604 -3.325 1.00 0.00 C ATOM 934 C GLN p 59 -5.210 -5.180 -2.786 1.00 0.00 C ATOM 935 O GLN p 59 -6.178 -4.549 -2.384 1.00 0.00 O ATOM 936 CB GLN p 59 -5.302 -7.639 -2.200 1.00 0.00 C ATOM 937 CG GLN p 59 -6.075 -7.266 -0.961 1.00 0.00 C ATOM 938 CD GLN p 59 -7.053 -8.338 -0.521 1.00 0.00 C ATOM 939 OE1 GLN p 59 -8.212 -8.344 -0.935 1.00 0.00 O ATOM 940 NE2 GLN p 59 -6.588 -9.251 0.324 1.00 0.00 N ATOM 0 H GLN p 59 -3.434 -7.209 -3.738 1.00 0.00 H new ATOM 0 HA GLN p 59 -6.328 -6.681 -3.825 1.00 0.00 H new ATOM 0 HB2 GLN p 59 -5.682 -8.588 -2.577 1.00 0.00 H new ATOM 0 HB3 GLN p 59 -4.259 -7.799 -1.927 1.00 0.00 H new ATOM 0 HG2 GLN p 59 -5.375 -7.067 -0.150 1.00 0.00 H new ATOM 0 HG3 GLN p 59 -6.620 -6.340 -1.146 1.00 0.00 H new ATOM 0 HE21 GLN p 59 -5.619 -9.206 0.641 1.00 0.00 H new ATOM 0 HE22 GLN p 59 -7.199 -9.997 0.656 1.00 0.00 H new ATOM 949 N LEU p 60 -3.954 -4.727 -2.788 1.00 0.00 N ATOM 950 CA LEU p 60 -3.560 -3.388 -2.344 1.00 0.00 C ATOM 951 C LEU p 60 -3.669 -2.402 -3.516 1.00 0.00 C ATOM 952 O LEU p 60 -3.628 -1.188 -3.343 1.00 0.00 O ATOM 953 CB LEU p 60 -2.118 -3.433 -1.801 1.00 0.00 C ATOM 954 CG LEU p 60 -1.582 -2.167 -1.100 1.00 0.00 C ATOM 955 CD1 LEU p 60 -0.818 -1.319 -2.100 1.00 0.00 C ATOM 956 CD2 LEU p 60 -2.711 -1.366 -0.470 1.00 0.00 C ATOM 0 H LEU p 60 -3.166 -5.292 -3.105 1.00 0.00 H new ATOM 0 HA LEU p 60 -4.224 -3.052 -1.548 1.00 0.00 H new ATOM 0 HB2 LEU p 60 -2.049 -4.262 -1.097 1.00 0.00 H new ATOM 0 HB3 LEU p 60 -1.452 -3.665 -2.632 1.00 0.00 H new ATOM 0 HG LEU p 60 -0.909 -2.471 -0.298 1.00 0.00 H new ATOM 0 HD11 LEU p 60 -0.440 -0.425 -1.605 1.00 0.00 H new ATOM 0 HD12 LEU p 60 0.017 -1.893 -2.501 1.00 0.00 H new ATOM 0 HD13 LEU p 60 -1.482 -1.029 -2.914 1.00 0.00 H new ATOM 0 HD21 LEU p 60 -2.302 -0.480 0.016 1.00 0.00 H new ATOM 0 HD22 LEU p 60 -3.417 -1.062 -1.243 1.00 0.00 H new ATOM 0 HD23 LEU p 60 -3.225 -1.981 0.269 1.00 0.00 H new ATOM 968 N LYS p 61 -3.793 -2.996 -4.690 1.00 0.00 N ATOM 969 CA LYS p 61 -3.944 -2.340 -5.971 1.00 0.00 C ATOM 970 C LYS p 61 -5.428 -2.275 -6.247 1.00 0.00 C ATOM 971 O LYS p 61 -5.940 -1.345 -6.875 1.00 0.00 O ATOM 972 CB LYS p 61 -3.222 -3.150 -7.045 1.00 0.00 C ATOM 973 CG LYS p 61 -1.810 -2.670 -7.325 1.00 0.00 C ATOM 974 CD LYS p 61 -1.294 -3.195 -8.655 1.00 0.00 C ATOM 975 CE LYS p 61 0.118 -2.707 -8.936 1.00 0.00 C ATOM 976 NZ LYS p 61 0.632 -3.213 -10.239 1.00 0.00 N ATOM 0 H LYS p 61 -3.790 -4.012 -4.776 1.00 0.00 H new ATOM 0 HA LYS p 61 -3.513 -1.339 -5.970 1.00 0.00 H new ATOM 0 HB2 LYS p 61 -3.187 -4.195 -6.737 1.00 0.00 H new ATOM 0 HB3 LYS p 61 -3.800 -3.109 -7.968 1.00 0.00 H new ATOM 0 HG2 LYS p 61 -1.790 -1.580 -7.331 1.00 0.00 H new ATOM 0 HG3 LYS p 61 -1.148 -2.997 -6.523 1.00 0.00 H new ATOM 0 HD2 LYS p 61 -1.309 -4.285 -8.648 1.00 0.00 H new ATOM 0 HD3 LYS p 61 -1.958 -2.873 -9.457 1.00 0.00 H new ATOM 0 HE2 LYS p 61 0.131 -1.617 -8.939 1.00 0.00 H new ATOM 0 HE3 LYS p 61 0.781 -3.032 -8.134 1.00 0.00 H new ATOM 0 HZ1 LYS p 61 1.597 -2.858 -10.393 1.00 0.00 H new ATOM 0 HZ2 LYS p 61 0.644 -4.253 -10.227 1.00 0.00 H new ATOM 0 HZ3 LYS p 61 0.015 -2.882 -11.008 1.00 0.00 H new ATOM 990 N TRP p 62 -6.090 -3.322 -5.742 1.00 0.00 N ATOM 991 CA TRP p 62 -7.533 -3.460 -5.787 1.00 0.00 C ATOM 992 C TRP p 62 -8.096 -2.599 -4.675 1.00 0.00 C ATOM 993 O TRP p 62 -9.211 -2.082 -4.768 1.00 0.00 O ATOM 994 CB TRP p 62 -7.953 -4.915 -5.597 1.00 0.00 C ATOM 995 CG TRP p 62 -8.957 -5.380 -6.611 1.00 0.00 C ATOM 996 CD1 TRP p 62 -8.694 -6.060 -7.765 1.00 0.00 C ATOM 997 CD2 TRP p 62 -10.383 -5.199 -6.569 1.00 0.00 C ATOM 998 NE1 TRP p 62 -9.862 -6.314 -8.442 1.00 0.00 N ATOM 999 CE2 TRP p 62 -10.911 -5.797 -7.729 1.00 0.00 C ATOM 1000 CE3 TRP p 62 -11.265 -4.592 -5.664 1.00 0.00 C ATOM 1001 CZ2 TRP p 62 -12.276 -5.805 -8.007 1.00 0.00 C ATOM 1002 CZ3 TRP p 62 -12.618 -4.602 -5.944 1.00 0.00 C ATOM 1003 CH2 TRP p 62 -13.112 -5.205 -7.106 1.00 0.00 C ATOM 0 H TRP p 62 -5.622 -4.105 -5.285 1.00 0.00 H new ATOM 0 HA TRP p 62 -7.913 -3.144 -6.758 1.00 0.00 H new ATOM 0 HB2 TRP p 62 -7.070 -5.551 -5.652 1.00 0.00 H new ATOM 0 HB3 TRP p 62 -8.372 -5.038 -4.598 1.00 0.00 H new ATOM 0 HD1 TRP p 62 -7.710 -6.356 -8.098 1.00 0.00 H new ATOM 0 HE1 TRP p 62 -9.936 -6.808 -9.332 1.00 0.00 H new ATOM 0 HE3 TRP p 62 -10.893 -4.125 -4.764 1.00 0.00 H new ATOM 0 HZ2 TRP p 62 -12.661 -6.269 -8.903 1.00 0.00 H new ATOM 0 HZ3 TRP p 62 -13.306 -4.136 -5.254 1.00 0.00 H new ATOM 0 HH2 TRP p 62 -14.175 -5.196 -7.295 1.00 0.00 H new ATOM 1014 N LYS p 63 -7.280 -2.467 -3.615 1.00 0.00 N ATOM 1015 CA LYS p 63 -7.625 -1.602 -2.476 1.00 0.00 C ATOM 1016 C LYS p 63 -7.188 -0.161 -2.759 1.00 0.00 C ATOM 1017 O LYS p 63 -7.589 0.757 -2.058 1.00 0.00 O ATOM 1018 CB LYS p 63 -6.994 -2.093 -1.173 1.00 0.00 C ATOM 1019 CG LYS p 63 -7.878 -3.047 -0.373 1.00 0.00 C ATOM 1020 CD LYS p 63 -8.816 -2.300 0.567 1.00 0.00 C ATOM 1021 CE LYS p 63 -9.685 -3.257 1.366 1.00 0.00 C ATOM 1022 NZ LYS p 63 -10.609 -2.534 2.284 1.00 0.00 N ATOM 0 H LYS p 63 -6.383 -2.945 -3.524 1.00 0.00 H new ATOM 0 HA LYS p 63 -8.707 -1.638 -2.352 1.00 0.00 H new ATOM 0 HB2 LYS p 63 -6.053 -2.593 -1.403 1.00 0.00 H new ATOM 0 HB3 LYS p 63 -6.753 -1.231 -0.551 1.00 0.00 H new ATOM 0 HG2 LYS p 63 -8.463 -3.660 -1.058 1.00 0.00 H new ATOM 0 HG3 LYS p 63 -7.250 -3.725 0.204 1.00 0.00 H new ATOM 0 HD2 LYS p 63 -8.232 -1.682 1.249 1.00 0.00 H new ATOM 0 HD3 LYS p 63 -9.450 -1.627 -0.010 1.00 0.00 H new ATOM 0 HE2 LYS p 63 -10.264 -3.878 0.683 1.00 0.00 H new ATOM 0 HE3 LYS p 63 -9.050 -3.927 1.945 1.00 0.00 H new ATOM 0 HZ1 LYS p 63 -11.184 -3.222 2.811 1.00 0.00 H new ATOM 0 HZ2 LYS p 63 -10.056 -1.961 2.953 1.00 0.00 H new ATOM 0 HZ3 LYS p 63 -11.233 -1.913 1.730 1.00 0.00 H new ATOM 1036 N LEU p 64 -6.339 -0.011 -3.786 1.00 0.00 N ATOM 1037 CA LEU p 64 -5.819 1.284 -4.258 1.00 0.00 C ATOM 1038 C LEU p 64 -6.748 1.851 -5.325 1.00 0.00 C ATOM 1039 O LEU p 64 -6.704 3.018 -5.659 1.00 0.00 O ATOM 1040 CB LEU p 64 -4.386 1.078 -4.820 1.00 0.00 C ATOM 1041 CG LEU p 64 -3.604 2.285 -5.410 1.00 0.00 C ATOM 1042 CD1 LEU p 64 -3.825 2.381 -6.910 1.00 0.00 C ATOM 1043 CD2 LEU p 64 -3.981 3.590 -4.741 1.00 0.00 C ATOM 0 H LEU p 64 -5.986 -0.802 -4.324 1.00 0.00 H new ATOM 0 HA LEU p 64 -5.775 1.995 -3.433 1.00 0.00 H new ATOM 0 HB2 LEU p 64 -3.779 0.659 -4.017 1.00 0.00 H new ATOM 0 HB3 LEU p 64 -4.449 0.319 -5.600 1.00 0.00 H new ATOM 0 HG LEU p 64 -2.546 2.110 -5.214 1.00 0.00 H new ATOM 0 HD11 LEU p 64 -3.270 3.232 -7.306 1.00 0.00 H new ATOM 0 HD12 LEU p 64 -3.476 1.466 -7.388 1.00 0.00 H new ATOM 0 HD13 LEU p 64 -4.887 2.515 -7.113 1.00 0.00 H new ATOM 0 HD21 LEU p 64 -3.410 4.405 -5.185 1.00 0.00 H new ATOM 0 HD22 LEU p 64 -5.046 3.776 -4.880 1.00 0.00 H new ATOM 0 HD23 LEU p 64 -3.759 3.530 -3.676 1.00 0.00 H new ATOM 1055 N GLN p 65 -7.553 0.959 -5.833 1.00 0.00 N ATOM 1056 CA GLN p 65 -8.561 1.194 -6.837 1.00 0.00 C ATOM 1057 C GLN p 65 -9.867 1.393 -6.087 1.00 0.00 C ATOM 1058 O GLN p 65 -10.838 1.934 -6.600 1.00 0.00 O ATOM 1059 CB GLN p 65 -8.600 -0.031 -7.763 1.00 0.00 C ATOM 1060 CG GLN p 65 -9.934 -0.281 -8.437 1.00 0.00 C ATOM 1061 CD GLN p 65 -9.813 -0.517 -9.929 1.00 0.00 C ATOM 1062 OE1 GLN p 65 -9.876 0.421 -10.725 1.00 0.00 O ATOM 1063 NE2 GLN p 65 -9.637 -1.774 -10.318 1.00 0.00 N ATOM 0 H GLN p 65 -7.522 -0.017 -5.539 1.00 0.00 H new ATOM 0 HA GLN p 65 -8.365 2.069 -7.456 1.00 0.00 H new ATOM 0 HB2 GLN p 65 -7.838 0.090 -8.533 1.00 0.00 H new ATOM 0 HB3 GLN p 65 -8.331 -0.914 -7.184 1.00 0.00 H new ATOM 0 HG2 GLN p 65 -10.410 -1.146 -7.976 1.00 0.00 H new ATOM 0 HG3 GLN p 65 -10.588 0.573 -8.262 1.00 0.00 H new ATOM 0 HE21 GLN p 65 -9.591 -2.521 -9.625 1.00 0.00 H new ATOM 0 HE22 GLN p 65 -9.548 -1.993 -11.310 1.00 0.00 H new ATOM 1072 N ALA p 66 -9.818 0.894 -4.855 1.00 0.00 N ATOM 1073 CA ALA p 66 -10.907 0.956 -3.888 1.00 0.00 C ATOM 1074 C ALA p 66 -10.686 2.158 -3.000 1.00 0.00 C ATOM 1075 O ALA p 66 -11.630 2.735 -2.464 1.00 0.00 O ATOM 1076 CB ALA p 66 -10.987 -0.317 -3.058 1.00 0.00 C ATOM 0 H ALA p 66 -8.991 0.420 -4.492 1.00 0.00 H new ATOM 0 HA ALA p 66 -11.855 1.050 -4.418 1.00 0.00 H new ATOM 0 HB1 ALA p 66 -11.810 -0.237 -2.347 1.00 0.00 H new ATOM 0 HB2 ALA p 66 -11.157 -1.170 -3.715 1.00 0.00 H new ATOM 0 HB3 ALA p 66 -10.052 -0.457 -2.516 1.00 0.00 H new ATOM 1082 N LEU p 67 -9.397 2.508 -2.861 1.00 0.00 N ATOM 1083 CA LEU p 67 -8.962 3.660 -2.107 1.00 0.00 C ATOM 1084 C LEU p 67 -8.980 4.834 -3.059 1.00 0.00 C ATOM 1085 O LEU p 67 -9.346 5.933 -2.685 1.00 0.00 O ATOM 1086 CB LEU p 67 -7.567 3.416 -1.494 1.00 0.00 C ATOM 1087 CG LEU p 67 -6.425 4.342 -1.939 1.00 0.00 C ATOM 1088 CD1 LEU p 67 -6.576 5.725 -1.345 1.00 0.00 C ATOM 1089 CD2 LEU p 67 -5.100 3.740 -1.563 1.00 0.00 C ATOM 0 H LEU p 67 -8.630 1.982 -3.280 1.00 0.00 H new ATOM 0 HA LEU p 67 -9.622 3.860 -1.263 1.00 0.00 H new ATOM 0 HB2 LEU p 67 -7.658 3.491 -0.410 1.00 0.00 H new ATOM 0 HB3 LEU p 67 -7.275 2.390 -1.719 1.00 0.00 H new ATOM 0 HG LEU p 67 -6.469 4.446 -3.023 1.00 0.00 H new ATOM 0 HD11 LEU p 67 -5.752 6.356 -1.679 1.00 0.00 H new ATOM 0 HD12 LEU p 67 -7.521 6.159 -1.670 1.00 0.00 H new ATOM 0 HD13 LEU p 67 -6.563 5.657 -0.257 1.00 0.00 H new ATOM 0 HD21 LEU p 67 -4.296 4.403 -1.882 1.00 0.00 H new ATOM 0 HD22 LEU p 67 -5.054 3.608 -0.482 1.00 0.00 H new ATOM 0 HD23 LEU p 67 -4.988 2.772 -2.052 1.00 0.00 H new ATOM 1101 N LYS p 68 -8.503 4.566 -4.279 1.00 0.00 N ATOM 1102 CA LYS p 68 -8.535 5.549 -5.373 1.00 0.00 C ATOM 1103 C LYS p 68 -9.979 5.809 -5.738 1.00 0.00 C ATOM 1104 O LYS p 68 -10.332 6.901 -6.186 1.00 0.00 O ATOM 1105 CB LYS p 68 -7.759 5.105 -6.611 1.00 0.00 C ATOM 1106 CG LYS p 68 -6.398 5.769 -6.739 1.00 0.00 C ATOM 1107 CD LYS p 68 -5.829 5.614 -8.140 1.00 0.00 C ATOM 1108 CE LYS p 68 -4.472 6.287 -8.268 1.00 0.00 C ATOM 1109 NZ LYS p 68 -3.911 6.150 -9.640 1.00 0.00 N ATOM 0 H LYS p 68 -8.087 3.671 -4.537 1.00 0.00 H new ATOM 0 HA LYS p 68 -8.045 6.456 -5.018 1.00 0.00 H new ATOM 0 HB2 LYS p 68 -7.626 4.024 -6.579 1.00 0.00 H new ATOM 0 HB3 LYS p 68 -8.349 5.328 -7.500 1.00 0.00 H new ATOM 0 HG2 LYS p 68 -6.485 6.828 -6.496 1.00 0.00 H new ATOM 0 HG3 LYS p 68 -5.710 5.332 -6.016 1.00 0.00 H new ATOM 0 HD2 LYS p 68 -5.735 4.555 -8.381 1.00 0.00 H new ATOM 0 HD3 LYS p 68 -6.520 6.045 -8.864 1.00 0.00 H new ATOM 0 HE2 LYS p 68 -4.566 7.344 -8.018 1.00 0.00 H new ATOM 0 HE3 LYS p 68 -3.781 5.850 -7.548 1.00 0.00 H new ATOM 0 HZ1 LYS p 68 -2.985 6.622 -9.685 1.00 0.00 H new ATOM 0 HZ2 LYS p 68 -3.797 5.142 -9.869 1.00 0.00 H new ATOM 0 HZ3 LYS p 68 -4.558 6.590 -10.325 1.00 0.00 H new ATOM 1123 N LYS p 69 -10.808 4.766 -5.551 1.00 0.00 N ATOM 1124 CA LYS p 69 -12.249 4.887 -5.747 1.00 0.00 C ATOM 1125 C LYS p 69 -12.818 5.601 -4.534 1.00 0.00 C ATOM 1126 O LYS p 69 -13.822 6.296 -4.628 1.00 0.00 O ATOM 1127 CB LYS p 69 -12.917 3.526 -5.914 1.00 0.00 C ATOM 1128 CG LYS p 69 -13.469 3.269 -7.310 1.00 0.00 C ATOM 1129 CD LYS p 69 -14.930 3.686 -7.425 1.00 0.00 C ATOM 1130 CE LYS p 69 -15.483 3.424 -8.820 1.00 0.00 C ATOM 1131 NZ LYS p 69 -15.719 1.974 -9.069 1.00 0.00 N ATOM 0 H LYS p 69 -10.498 3.837 -5.266 1.00 0.00 H new ATOM 0 HA LYS p 69 -12.443 5.448 -6.661 1.00 0.00 H new ATOM 0 HB2 LYS p 69 -12.194 2.747 -5.672 1.00 0.00 H new ATOM 0 HB3 LYS p 69 -13.730 3.442 -5.193 1.00 0.00 H new ATOM 0 HG2 LYS p 69 -12.876 3.817 -8.042 1.00 0.00 H new ATOM 0 HG3 LYS p 69 -13.373 2.210 -7.550 1.00 0.00 H new ATOM 0 HD2 LYS p 69 -15.523 3.141 -6.690 1.00 0.00 H new ATOM 0 HD3 LYS p 69 -15.026 4.746 -7.189 1.00 0.00 H new ATOM 0 HE2 LYS p 69 -16.418 3.969 -8.947 1.00 0.00 H new ATOM 0 HE3 LYS p 69 -14.786 3.810 -9.564 1.00 0.00 H new ATOM 0 HZ1 LYS p 69 -16.095 1.843 -10.030 1.00 0.00 H new ATOM 0 HZ2 LYS p 69 -14.823 1.455 -8.975 1.00 0.00 H new ATOM 0 HZ3 LYS p 69 -16.404 1.610 -8.377 1.00 0.00 H new ATOM 1145 N LYS p 70 -12.106 5.422 -3.407 1.00 0.00 N ATOM 1146 CA LYS p 70 -12.420 6.051 -2.128 1.00 0.00 C ATOM 1147 C LYS p 70 -11.774 7.419 -2.101 1.00 0.00 C ATOM 1148 O LYS p 70 -12.134 8.271 -1.297 1.00 0.00 O ATOM 1149 CB LYS p 70 -11.916 5.200 -0.968 1.00 0.00 C ATOM 1150 CG LYS p 70 -13.006 4.737 -0.014 1.00 0.00 C ATOM 1151 CD LYS p 70 -12.896 5.423 1.337 1.00 0.00 C ATOM 1152 CE LYS p 70 -13.975 4.945 2.296 1.00 0.00 C ATOM 1153 NZ LYS p 70 -13.868 5.604 3.627 1.00 0.00 N ATOM 0 H LYS p 70 -11.282 4.823 -3.367 1.00 0.00 H new ATOM 0 HA LYS p 70 -13.500 6.146 -2.020 1.00 0.00 H new ATOM 0 HB2 LYS p 70 -11.405 4.325 -1.369 1.00 0.00 H new ATOM 0 HB3 LYS p 70 -11.177 5.772 -0.407 1.00 0.00 H new ATOM 0 HG2 LYS p 70 -13.983 4.945 -0.449 1.00 0.00 H new ATOM 0 HG3 LYS p 70 -12.939 3.657 0.119 1.00 0.00 H new ATOM 0 HD2 LYS p 70 -11.914 5.227 1.767 1.00 0.00 H new ATOM 0 HD3 LYS p 70 -12.977 6.502 1.206 1.00 0.00 H new ATOM 0 HE2 LYS p 70 -14.957 5.149 1.868 1.00 0.00 H new ATOM 0 HE3 LYS p 70 -13.899 3.865 2.419 1.00 0.00 H new ATOM 0 HZ1 LYS p 70 -14.621 5.251 4.251 1.00 0.00 H new ATOM 0 HZ2 LYS p 70 -12.941 5.389 4.047 1.00 0.00 H new ATOM 0 HZ3 LYS p 70 -13.967 6.633 3.514 1.00 0.00 H new ATOM 1167 N ASN p 71 -10.766 7.569 -2.980 1.00 0.00 N ATOM 1168 CA ASN p 71 -10.073 8.836 -3.207 1.00 0.00 C ATOM 1169 C ASN p 71 -10.886 9.579 -4.260 1.00 0.00 C ATOM 1170 O ASN p 71 -10.687 10.762 -4.513 1.00 0.00 O ATOM 1171 CB ASN p 71 -8.633 8.630 -3.688 1.00 0.00 C ATOM 1172 CG ASN p 71 -7.728 9.793 -3.327 1.00 0.00 C ATOM 1173 OD1 ASN p 71 -7.108 9.807 -2.263 1.00 0.00 O ATOM 1174 ND2 ASN p 71 -7.649 10.779 -4.213 1.00 0.00 N ATOM 0 H ASN p 71 -10.412 6.804 -3.554 1.00 0.00 H new ATOM 0 HA ASN p 71 -9.999 9.398 -2.276 1.00 0.00 H new ATOM 0 HB2 ASN p 71 -8.235 7.714 -3.251 1.00 0.00 H new ATOM 0 HB3 ASN p 71 -8.631 8.494 -4.769 1.00 0.00 H new ATOM 0 HD21 ASN p 71 -7.058 11.588 -4.024 1.00 0.00 H new ATOM 0 HD22 ASN p 71 -8.180 10.727 -5.082 1.00 0.00 H new ATOM 1181 N ALA p 72 -11.783 8.788 -4.876 1.00 0.00 N ATOM 1182 CA ALA p 72 -12.753 9.224 -5.866 1.00 0.00 C ATOM 1183 C ALA p 72 -14.025 9.544 -5.111 1.00 0.00 C ATOM 1184 O ALA p 72 -14.864 10.316 -5.567 1.00 0.00 O ATOM 1185 CB ALA p 72 -13.001 8.151 -6.915 1.00 0.00 C ATOM 0 H ALA p 72 -11.845 7.789 -4.681 1.00 0.00 H new ATOM 0 HA ALA p 72 -12.384 10.097 -6.405 1.00 0.00 H new ATOM 0 HB1 ALA p 72 -13.732 8.512 -7.639 1.00 0.00 H new ATOM 0 HB2 ALA p 72 -12.067 7.920 -7.427 1.00 0.00 H new ATOM 0 HB3 ALA p 72 -13.383 7.251 -6.432 1.00 0.00 H new ATOM 1191 N GLN p 73 -14.135 8.887 -3.936 1.00 0.00 N ATOM 1192 CA GLN p 73 -15.215 9.084 -2.980 1.00 0.00 C ATOM 1193 C GLN p 73 -14.809 10.243 -2.124 1.00 0.00 C ATOM 1194 O GLN p 73 -15.629 10.963 -1.574 1.00 0.00 O ATOM 1195 CB GLN p 73 -15.391 7.869 -2.093 1.00 0.00 C ATOM 1196 CG GLN p 73 -15.753 6.628 -2.856 1.00 0.00 C ATOM 1197 CD GLN p 73 -17.105 6.062 -2.469 1.00 0.00 C ATOM 1198 OE1 GLN p 73 -18.130 6.414 -3.054 1.00 0.00 O ATOM 1199 NE2 GLN p 73 -17.114 5.179 -1.477 1.00 0.00 N ATOM 0 H GLN p 73 -13.453 8.192 -3.631 1.00 0.00 H new ATOM 0 HA GLN p 73 -16.155 9.255 -3.505 1.00 0.00 H new ATOM 0 HB2 GLN p 73 -14.467 7.693 -1.542 1.00 0.00 H new ATOM 0 HB3 GLN p 73 -16.168 8.074 -1.356 1.00 0.00 H new ATOM 0 HG2 GLN p 73 -15.752 6.852 -3.923 1.00 0.00 H new ATOM 0 HG3 GLN p 73 -14.988 5.870 -2.689 1.00 0.00 H new ATOM 0 HE21 GLN p 73 -16.241 4.916 -1.020 1.00 0.00 H new ATOM 0 HE22 GLN p 73 -17.994 4.764 -1.172 1.00 0.00 H new ATOM 1208 N LEU p 74 -13.486 10.333 -2.003 1.00 0.00 N ATOM 1209 CA LEU p 74 -12.803 11.413 -1.295 1.00 0.00 C ATOM 1210 C LEU p 74 -12.727 12.609 -2.225 1.00 0.00 C ATOM 1211 O LEU p 74 -12.731 13.734 -1.794 1.00 0.00 O ATOM 1212 CB LEU p 74 -11.401 10.986 -0.876 1.00 0.00 C ATOM 1213 CG LEU p 74 -10.747 11.768 0.266 1.00 0.00 C ATOM 1214 CD1 LEU p 74 -11.336 11.391 1.624 1.00 0.00 C ATOM 1215 CD2 LEU p 74 -9.260 11.499 0.237 1.00 0.00 C ATOM 0 H LEU p 74 -12.847 9.645 -2.402 1.00 0.00 H new ATOM 0 HA LEU p 74 -13.355 11.667 -0.390 1.00 0.00 H new ATOM 0 HB2 LEU p 74 -11.439 9.935 -0.588 1.00 0.00 H new ATOM 0 HB3 LEU p 74 -10.751 11.054 -1.749 1.00 0.00 H new ATOM 0 HG LEU p 74 -10.941 12.831 0.125 1.00 0.00 H new ATOM 0 HD11 LEU p 74 -10.844 11.969 2.407 1.00 0.00 H new ATOM 0 HD12 LEU p 74 -12.404 11.607 1.630 1.00 0.00 H new ATOM 0 HD13 LEU p 74 -11.180 10.328 1.806 1.00 0.00 H new ATOM 0 HD21 LEU p 74 -8.775 12.048 1.044 1.00 0.00 H new ATOM 0 HD22 LEU p 74 -9.081 10.432 0.365 1.00 0.00 H new ATOM 0 HD23 LEU p 74 -8.850 11.823 -0.720 1.00 0.00 H new ATOM 1227 N LYS p 75 -12.681 12.311 -3.518 1.00 0.00 N ATOM 1228 CA LYS p 75 -12.676 13.315 -4.579 1.00 0.00 C ATOM 1229 C LYS p 75 -14.117 13.699 -4.802 1.00 0.00 C ATOM 1230 O LYS p 75 -14.436 14.758 -5.348 1.00 0.00 O ATOM 1231 CB LYS p 75 -12.079 12.758 -5.867 1.00 0.00 C ATOM 1232 CG LYS p 75 -10.857 13.507 -6.371 1.00 0.00 C ATOM 1233 CD LYS p 75 -11.166 14.293 -7.635 1.00 0.00 C ATOM 1234 CE LYS p 75 -9.946 15.051 -8.131 1.00 0.00 C ATOM 1235 NZ LYS p 75 -10.237 15.818 -9.374 1.00 0.00 N ATOM 0 H LYS p 75 -12.646 11.353 -3.865 1.00 0.00 H new ATOM 0 HA LYS p 75 -12.066 14.172 -4.293 1.00 0.00 H new ATOM 0 HB2 LYS p 75 -11.809 11.714 -5.706 1.00 0.00 H new ATOM 0 HB3 LYS p 75 -12.844 12.773 -6.643 1.00 0.00 H new ATOM 0 HG2 LYS p 75 -10.501 14.187 -5.597 1.00 0.00 H new ATOM 0 HG3 LYS p 75 -10.052 12.800 -6.569 1.00 0.00 H new ATOM 0 HD2 LYS p 75 -11.514 13.612 -8.412 1.00 0.00 H new ATOM 0 HD3 LYS p 75 -11.977 14.995 -7.439 1.00 0.00 H new ATOM 0 HE2 LYS p 75 -9.603 15.735 -7.354 1.00 0.00 H new ATOM 0 HE3 LYS p 75 -9.134 14.349 -8.319 1.00 0.00 H new ATOM 0 HZ1 LYS p 75 -9.380 16.321 -9.680 1.00 0.00 H new ATOM 0 HZ2 LYS p 75 -10.540 15.163 -10.123 1.00 0.00 H new ATOM 0 HZ3 LYS p 75 -10.994 16.506 -9.188 1.00 0.00 H new ATOM 1249 N LYS p 76 -14.976 12.777 -4.348 1.00 0.00 N ATOM 1250 CA LYS p 76 -16.422 12.966 -4.389 1.00 0.00 C ATOM 1251 C LYS p 76 -16.840 13.647 -3.107 1.00 0.00 C ATOM 1252 O LYS p 76 -17.806 14.415 -3.075 1.00 0.00 O ATOM 1253 CB LYS p 76 -17.154 11.638 -4.552 1.00 0.00 C ATOM 1254 CG LYS p 76 -17.850 11.465 -5.895 1.00 0.00 C ATOM 1255 CD LYS p 76 -19.362 11.544 -5.752 1.00 0.00 C ATOM 1256 CE LYS p 76 -20.061 11.346 -7.086 1.00 0.00 C ATOM 1257 NZ LYS p 76 -21.543 11.361 -6.945 1.00 0.00 N ATOM 0 H LYS p 76 -14.685 11.886 -3.945 1.00 0.00 H new ATOM 0 HA LYS p 76 -16.684 13.581 -5.250 1.00 0.00 H new ATOM 0 HB2 LYS p 76 -16.440 10.825 -4.419 1.00 0.00 H new ATOM 0 HB3 LYS p 76 -17.895 11.545 -3.758 1.00 0.00 H new ATOM 0 HG2 LYS p 76 -17.508 12.236 -6.586 1.00 0.00 H new ATOM 0 HG3 LYS p 76 -17.574 10.504 -6.328 1.00 0.00 H new ATOM 0 HD2 LYS p 76 -19.701 10.785 -5.047 1.00 0.00 H new ATOM 0 HD3 LYS p 76 -19.639 12.513 -5.336 1.00 0.00 H new ATOM 0 HE2 LYS p 76 -19.754 12.132 -7.776 1.00 0.00 H new ATOM 0 HE3 LYS p 76 -19.748 10.398 -7.523 1.00 0.00 H new ATOM 0 HZ1 LYS p 76 -21.982 11.223 -7.878 1.00 0.00 H new ATOM 0 HZ2 LYS p 76 -21.839 10.595 -6.306 1.00 0.00 H new ATOM 0 HZ3 LYS p 76 -21.845 12.275 -6.552 1.00 0.00 H new ATOM 1271 N LYS p 77 -16.085 13.342 -2.043 1.00 0.00 N ATOM 1272 CA LYS p 77 -16.306 13.959 -0.741 1.00 0.00 C ATOM 1273 C LYS p 77 -15.516 15.258 -0.636 1.00 0.00 C ATOM 1274 O LYS p 77 -15.809 16.104 0.213 1.00 0.00 O ATOM 1275 CB LYS p 77 -15.908 13.009 0.384 1.00 0.00 C ATOM 1276 CG LYS p 77 -17.087 12.342 1.083 1.00 0.00 C ATOM 1277 CD LYS p 77 -17.570 13.154 2.280 1.00 0.00 C ATOM 1278 CE LYS p 77 -18.728 12.470 2.995 1.00 0.00 C ATOM 1279 NZ LYS p 77 -18.280 11.287 3.785 1.00 0.00 N ATOM 0 H LYS p 77 -15.317 12.671 -2.065 1.00 0.00 H new ATOM 0 HA LYS p 77 -17.369 14.180 -0.642 1.00 0.00 H new ATOM 0 HB2 LYS p 77 -15.256 12.236 -0.022 1.00 0.00 H new ATOM 0 HB3 LYS p 77 -15.327 13.561 1.123 1.00 0.00 H new ATOM 0 HG2 LYS p 77 -17.906 12.217 0.375 1.00 0.00 H new ATOM 0 HG3 LYS p 77 -16.797 11.345 1.414 1.00 0.00 H new ATOM 0 HD2 LYS p 77 -16.746 13.298 2.978 1.00 0.00 H new ATOM 0 HD3 LYS p 77 -17.882 14.144 1.946 1.00 0.00 H new ATOM 0 HE2 LYS p 77 -19.217 13.184 3.658 1.00 0.00 H new ATOM 0 HE3 LYS p 77 -19.471 12.156 2.262 1.00 0.00 H new ATOM 0 HZ1 LYS p 77 -19.097 10.863 4.268 1.00 0.00 H new ATOM 0 HZ2 LYS p 77 -17.852 10.586 3.147 1.00 0.00 H new ATOM 0 HZ3 LYS p 77 -17.578 11.587 4.491 1.00 0.00 H new ATOM 1293 N LEU p 78 -14.505 15.399 -1.513 1.00 0.00 N ATOM 1294 CA LEU p 78 -13.660 16.603 -1.564 1.00 0.00 C ATOM 1295 C LEU p 78 -14.474 17.879 -1.774 1.00 0.00 C ATOM 1296 O LEU p 78 -14.453 18.795 -0.947 1.00 0.00 O ATOM 1297 CB LEU p 78 -12.648 16.462 -2.705 1.00 0.00 C ATOM 1298 CG LEU p 78 -11.180 16.331 -2.302 1.00 0.00 C ATOM 1299 CD1 LEU p 78 -10.350 15.962 -3.516 1.00 0.00 C ATOM 1300 CD2 LEU p 78 -10.675 17.625 -1.694 1.00 0.00 C ATOM 0 H LEU p 78 -14.254 14.688 -2.200 1.00 0.00 H new ATOM 0 HA LEU p 78 -13.154 16.688 -0.602 1.00 0.00 H new ATOM 0 HB2 LEU p 78 -12.919 15.587 -3.295 1.00 0.00 H new ATOM 0 HB3 LEU p 78 -12.747 17.329 -3.358 1.00 0.00 H new ATOM 0 HG LEU p 78 -11.089 15.545 -1.552 1.00 0.00 H new ATOM 0 HD11 LEU p 78 -9.303 15.869 -3.227 1.00 0.00 H new ATOM 0 HD12 LEU p 78 -10.700 15.013 -3.921 1.00 0.00 H new ATOM 0 HD13 LEU p 78 -10.449 16.739 -4.274 1.00 0.00 H new ATOM 0 HD21 LEU p 78 -9.628 17.511 -1.414 1.00 0.00 H new ATOM 0 HD22 LEU p 78 -10.770 18.431 -2.422 1.00 0.00 H new ATOM 0 HD23 LEU p 78 -11.264 17.865 -0.808 1.00 0.00 H new ATOM 1312 N GLN p 79 -15.179 17.901 -2.893 1.00 0.00 N ATOM 1313 CA GLN p 79 -16.036 19.014 -3.292 1.00 0.00 C ATOM 1314 C GLN p 79 -17.404 18.960 -2.611 1.00 0.00 C ATOM 1315 O GLN p 79 -17.938 19.984 -2.177 1.00 0.00 O ATOM 1316 CB GLN p 79 -16.208 19.025 -4.820 1.00 0.00 C ATOM 1317 CG GLN p 79 -16.292 17.648 -5.481 1.00 0.00 C ATOM 1318 CD GLN p 79 -16.488 17.733 -6.982 1.00 0.00 C ATOM 1319 OE1 GLN p 79 -15.524 17.771 -7.745 1.00 0.00 O ATOM 1320 NE2 GLN p 79 -17.744 17.764 -7.414 1.00 0.00 N ATOM 0 H GLN p 79 -15.174 17.133 -3.565 1.00 0.00 H new ATOM 0 HA GLN p 79 -15.547 19.934 -2.972 1.00 0.00 H new ATOM 0 HB2 GLN p 79 -17.113 19.582 -5.063 1.00 0.00 H new ATOM 0 HB3 GLN p 79 -15.372 19.569 -5.259 1.00 0.00 H new ATOM 0 HG2 GLN p 79 -15.380 17.091 -5.268 1.00 0.00 H new ATOM 0 HG3 GLN p 79 -17.117 17.088 -5.042 1.00 0.00 H new ATOM 0 HE21 GLN p 79 -18.514 17.730 -6.746 1.00 0.00 H new ATOM 0 HE22 GLN p 79 -17.938 17.821 -8.414 1.00 0.00 H new ATOM 1329 N ALA p 80 -17.945 17.753 -2.534 1.00 0.00 N ATOM 1330 CA ALA p 80 -19.251 17.510 -1.918 1.00 0.00 C ATOM 1331 C ALA p 80 -19.103 17.037 -0.471 1.00 0.00 C ATOM 1332 O ALA p 80 -18.509 15.958 -0.252 1.00 0.00 O ATOM 1333 CB ALA p 80 -20.044 16.500 -2.738 1.00 0.00 C ATOM 1334 OXT ALA p 80 -19.583 17.752 0.434 1.00 0.00 O ATOM 0 H ALA p 80 -17.495 16.912 -2.895 1.00 0.00 H new ATOM 0 HA ALA p 80 -19.798 18.452 -1.903 1.00 0.00 H new ATOM 0 HB1 ALA p 80 -21.012 16.330 -2.268 1.00 0.00 H new ATOM 0 HB2 ALA p 80 -20.193 16.887 -3.746 1.00 0.00 H new ATOM 0 HB3 ALA p 80 -19.494 15.560 -2.788 1.00 0.00 H new TER 1340 ALA p 80