USER MOD reduce.3.24.130724 H: found=0, std=0, add=758, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 755 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 13 GLN : amide:sc= -0.384 X(o=-0.4,f=-0.23) USER MOD Set 1.2: A 21 GLN : amide:sc= -0.0169 X(o=-0.4,f=-0.23) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot -4:sc= 0.718! USER MOD Single : A 5 SER OG : rot 180:sc= -0.141 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 10 MET CE :methyl -156:sc= -0.0371 (180deg=-0.296) USER MOD Single : A 12 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 14 HIS : no HD1:sc= -8.8! C(o=-8.8!,f=-13!) USER MOD Single : A 16 SER OG : rot 171:sc= -0.911! USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 24 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 GLN :FLIP amide:sc= -0.268 F(o=-1.8,f=-0.27) USER MOD Single : A 38 SER OG : rot 42:sc= 0.866 USER MOD Single : A 41 SER OG : rot 45:sc= 0.198 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 ASN : amide:sc= 0 X(o=0,f=-0.14) USER MOD Single : A 46 TYR OH : rot 48:sc= 0.91 USER MOD Single : A 47 LYS NZ :NH3+ -136:sc= -1.27 (180deg=-2.25!) USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 GLN :FLIP amide:sc= -1.52 F(o=-3!,f=-1.5) USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 65 THR OG1 : rot -150:sc= -0.0217 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 GLN : amide:sc= -0.0202 X(o=-0.02,f=-0.031) USER MOD Single : A 73 GLN : amide:sc=-0.00163 X(o=-0.0016,f=0) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 GLN : amide:sc=-0.000783 X(o=-0.00078,f=0) USER MOD Single : A 82 THR OG1 : rot 163:sc= -4.15! USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 GLN : amide:sc= 0.00894 X(o=0.0089,f=0) USER MOD Single : A 92 ASN : amide:sc= -3.28! X(o=-3.3!,f=-2.9) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -6.071 -2.507 -13.683 1.00 0.00 N ATOM 2 CA GLY A 1 -6.268 -3.803 -13.055 1.00 0.00 C ATOM 3 C GLY A 1 -7.692 -3.940 -12.514 1.00 0.00 C ATOM 4 O GLY A 1 -8.595 -4.365 -13.233 1.00 0.00 O ATOM 0 H1 GLY A 1 -5.097 -2.439 -14.042 1.00 0.00 H new ATOM 0 H2 GLY A 1 -6.739 -2.399 -14.473 1.00 0.00 H new ATOM 0 H3 GLY A 1 -6.236 -1.754 -12.985 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -6.072 -4.595 -13.778 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -5.553 -3.930 -12.242 1.00 0.00 H new ATOM 8 N SER A 2 -7.849 -3.571 -11.251 1.00 0.00 N ATOM 9 CA SER A 2 -9.148 -3.647 -10.605 1.00 0.00 C ATOM 10 C SER A 2 -9.732 -5.052 -10.768 1.00 0.00 C ATOM 11 O SER A 2 -10.646 -5.260 -11.564 1.00 0.00 O ATOM 12 CB SER A 2 -10.110 -2.603 -11.177 1.00 0.00 C ATOM 13 OG SER A 2 -9.749 -1.279 -10.795 1.00 0.00 O ATOM 0 H SER A 2 -7.098 -3.219 -10.658 1.00 0.00 H new ATOM 0 HA SER A 2 -9.015 -3.436 -9.544 1.00 0.00 H new ATOM 0 HB2 SER A 2 -10.120 -2.677 -12.264 1.00 0.00 H new ATOM 0 HB3 SER A 2 -11.122 -2.816 -10.834 1.00 0.00 H new ATOM 0 HG SER A 2 -10.386 -0.642 -11.181 1.00 0.00 H new ATOM 19 N SER A 3 -9.180 -5.980 -10.001 1.00 0.00 N ATOM 20 CA SER A 3 -9.634 -7.360 -10.050 1.00 0.00 C ATOM 21 C SER A 3 -9.056 -8.144 -8.871 1.00 0.00 C ATOM 22 O SER A 3 -7.840 -8.195 -8.692 1.00 0.00 O ATOM 23 CB SER A 3 -9.241 -8.022 -11.372 1.00 0.00 C ATOM 24 OG SER A 3 -7.910 -8.530 -11.339 1.00 0.00 O ATOM 0 H SER A 3 -8.422 -5.804 -9.342 1.00 0.00 H new ATOM 0 HA SER A 3 -10.722 -7.365 -9.982 1.00 0.00 H new ATOM 0 HB2 SER A 3 -9.934 -8.834 -11.591 1.00 0.00 H new ATOM 0 HB3 SER A 3 -9.333 -7.298 -12.182 1.00 0.00 H new ATOM 0 HG SER A 3 -7.492 -8.297 -10.484 1.00 0.00 H new ATOM 30 N GLY A 4 -9.954 -8.735 -8.097 1.00 0.00 N ATOM 31 CA GLY A 4 -9.548 -9.514 -6.939 1.00 0.00 C ATOM 32 C GLY A 4 -10.727 -9.744 -5.992 1.00 0.00 C ATOM 33 O GLY A 4 -11.339 -8.791 -5.514 1.00 0.00 O ATOM 0 H GLY A 4 -10.962 -8.690 -8.249 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -9.146 -10.473 -7.265 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -8.748 -8.996 -6.410 1.00 0.00 H new ATOM 37 N SER A 5 -11.011 -11.016 -5.751 1.00 0.00 N ATOM 38 CA SER A 5 -12.106 -11.384 -4.870 1.00 0.00 C ATOM 39 C SER A 5 -11.595 -12.295 -3.752 1.00 0.00 C ATOM 40 O SER A 5 -10.514 -12.873 -3.862 1.00 0.00 O ATOM 41 CB SER A 5 -13.229 -12.074 -5.646 1.00 0.00 C ATOM 42 OG SER A 5 -14.282 -12.508 -4.789 1.00 0.00 O ATOM 0 H SER A 5 -10.502 -11.804 -6.151 1.00 0.00 H new ATOM 0 HA SER A 5 -12.512 -10.473 -4.430 1.00 0.00 H new ATOM 0 HB2 SER A 5 -13.629 -11.388 -6.392 1.00 0.00 H new ATOM 0 HB3 SER A 5 -12.824 -12.930 -6.185 1.00 0.00 H new ATOM 0 HG SER A 5 -14.980 -12.942 -5.323 1.00 0.00 H new ATOM 48 N SER A 6 -12.396 -12.396 -2.701 1.00 0.00 N ATOM 49 CA SER A 6 -12.038 -13.228 -1.565 1.00 0.00 C ATOM 50 C SER A 6 -12.913 -14.482 -1.538 1.00 0.00 C ATOM 51 O SER A 6 -14.029 -14.455 -1.023 1.00 0.00 O ATOM 52 CB SER A 6 -12.178 -12.455 -0.252 1.00 0.00 C ATOM 53 OG SER A 6 -11.563 -13.138 0.838 1.00 0.00 O ATOM 0 H SER A 6 -13.291 -11.915 -2.613 1.00 0.00 H new ATOM 0 HA SER A 6 -10.994 -13.524 -1.673 1.00 0.00 H new ATOM 0 HB2 SER A 6 -11.728 -11.469 -0.362 1.00 0.00 H new ATOM 0 HB3 SER A 6 -13.235 -12.300 -0.033 1.00 0.00 H new ATOM 0 HG SER A 6 -11.673 -12.612 1.657 1.00 0.00 H new ATOM 59 N GLY A 7 -12.373 -15.554 -2.101 1.00 0.00 N ATOM 60 CA GLY A 7 -13.091 -16.816 -2.148 1.00 0.00 C ATOM 61 C GLY A 7 -12.591 -17.772 -1.063 1.00 0.00 C ATOM 62 O GLY A 7 -11.508 -17.580 -0.512 1.00 0.00 O ATOM 0 H GLY A 7 -11.447 -15.574 -2.528 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -14.158 -16.637 -2.016 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -12.964 -17.275 -3.129 1.00 0.00 H new ATOM 66 N MET A 8 -13.405 -18.781 -0.788 1.00 0.00 N ATOM 67 CA MET A 8 -13.059 -19.767 0.222 1.00 0.00 C ATOM 68 C MET A 8 -12.893 -19.111 1.595 1.00 0.00 C ATOM 69 O MET A 8 -12.315 -18.031 1.705 1.00 0.00 O ATOM 70 CB MET A 8 -11.756 -20.465 -0.170 1.00 0.00 C ATOM 71 CG MET A 8 -12.028 -21.652 -1.097 1.00 0.00 C ATOM 72 SD MET A 8 -10.967 -21.565 -2.529 1.00 0.00 S ATOM 73 CE MET A 8 -10.378 -23.249 -2.582 1.00 0.00 C ATOM 0 H MET A 8 -14.303 -18.937 -1.247 1.00 0.00 H new ATOM 0 HA MET A 8 -13.868 -20.495 0.283 1.00 0.00 H new ATOM 0 HB2 MET A 8 -11.094 -19.755 -0.666 1.00 0.00 H new ATOM 0 HB3 MET A 8 -11.240 -20.809 0.726 1.00 0.00 H new ATOM 0 HG2 MET A 8 -11.857 -22.587 -0.564 1.00 0.00 H new ATOM 0 HG3 MET A 8 -13.073 -21.649 -1.408 1.00 0.00 H new ATOM 0 HE1 MET A 8 -9.697 -23.370 -3.425 1.00 0.00 H new ATOM 0 HE2 MET A 8 -9.853 -23.480 -1.655 1.00 0.00 H new ATOM 0 HE3 MET A 8 -11.224 -23.927 -2.698 1.00 0.00 H new ATOM 83 N ASP A 9 -13.412 -19.791 2.607 1.00 0.00 N ATOM 84 CA ASP A 9 -13.329 -19.288 3.967 1.00 0.00 C ATOM 85 C ASP A 9 -13.721 -20.400 4.942 1.00 0.00 C ATOM 86 O ASP A 9 -14.905 -20.650 5.160 1.00 0.00 O ATOM 87 CB ASP A 9 -14.286 -18.113 4.180 1.00 0.00 C ATOM 88 CG ASP A 9 -13.964 -17.227 5.385 1.00 0.00 C ATOM 89 OD1 ASP A 9 -14.039 -17.756 6.515 1.00 0.00 O ATOM 90 OD2 ASP A 9 -13.650 -16.040 5.149 1.00 0.00 O ATOM 0 H ASP A 9 -13.892 -20.686 2.512 1.00 0.00 H new ATOM 0 HA ASP A 9 -12.306 -18.955 4.141 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -14.284 -17.495 3.282 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -15.297 -18.504 4.295 1.00 0.00 H new ATOM 95 N MET A 10 -12.704 -21.037 5.503 1.00 0.00 N ATOM 96 CA MET A 10 -12.928 -22.117 6.450 1.00 0.00 C ATOM 97 C MET A 10 -11.619 -22.534 7.124 1.00 0.00 C ATOM 98 O MET A 10 -10.973 -23.489 6.695 1.00 0.00 O ATOM 99 CB MET A 10 -13.533 -23.318 5.721 1.00 0.00 C ATOM 100 CG MET A 10 -14.798 -23.808 6.428 1.00 0.00 C ATOM 101 SD MET A 10 -14.487 -25.378 7.218 1.00 0.00 S ATOM 102 CE MET A 10 -14.361 -26.428 5.780 1.00 0.00 C ATOM 0 H MET A 10 -11.723 -20.826 5.320 1.00 0.00 H new ATOM 0 HA MET A 10 -13.615 -21.765 7.219 1.00 0.00 H new ATOM 0 HB2 MET A 10 -13.770 -23.043 4.693 1.00 0.00 H new ATOM 0 HB3 MET A 10 -12.802 -24.125 5.674 1.00 0.00 H new ATOM 0 HG2 MET A 10 -15.117 -23.075 7.169 1.00 0.00 H new ATOM 0 HG3 MET A 10 -15.611 -23.908 5.709 1.00 0.00 H new ATOM 0 HE1 MET A 10 -14.592 -27.456 6.059 1.00 0.00 H new ATOM 0 HE2 MET A 10 -15.066 -26.091 5.020 1.00 0.00 H new ATOM 0 HE3 MET A 10 -13.348 -26.379 5.382 1.00 0.00 H new ATOM 112 N GLY A 11 -11.268 -21.799 8.169 1.00 0.00 N ATOM 113 CA GLY A 11 -10.049 -22.081 8.907 1.00 0.00 C ATOM 114 C GLY A 11 -8.844 -21.399 8.256 1.00 0.00 C ATOM 115 O GLY A 11 -8.464 -21.739 7.136 1.00 0.00 O ATOM 0 H GLY A 11 -11.807 -21.008 8.522 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -10.154 -21.737 9.936 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -9.884 -23.158 8.947 1.00 0.00 H new ATOM 119 N ASN A 12 -8.275 -20.450 8.985 1.00 0.00 N ATOM 120 CA ASN A 12 -7.121 -19.718 8.493 1.00 0.00 C ATOM 121 C ASN A 12 -7.486 -19.024 7.179 1.00 0.00 C ATOM 122 O ASN A 12 -8.481 -19.370 6.545 1.00 0.00 O ATOM 123 CB ASN A 12 -5.947 -20.660 8.220 1.00 0.00 C ATOM 124 CG ASN A 12 -5.494 -21.358 9.504 1.00 0.00 C ATOM 125 OD1 ASN A 12 -5.729 -22.537 9.716 1.00 0.00 O ATOM 126 ND2 ASN A 12 -4.834 -20.568 10.346 1.00 0.00 N ATOM 0 H ASN A 12 -8.592 -20.171 9.913 1.00 0.00 H new ATOM 0 HA ASN A 12 -6.832 -18.993 9.253 1.00 0.00 H new ATOM 0 HB2 ASN A 12 -6.239 -21.405 7.480 1.00 0.00 H new ATOM 0 HB3 ASN A 12 -5.116 -20.097 7.795 1.00 0.00 H new ATOM 0 HD21 ASN A 12 -4.490 -20.940 11.231 1.00 0.00 H new ATOM 0 HD22 ASN A 12 -4.672 -19.590 10.106 1.00 0.00 H new ATOM 133 N GLN A 13 -6.659 -18.057 6.808 1.00 0.00 N ATOM 134 CA GLN A 13 -6.882 -17.311 5.581 1.00 0.00 C ATOM 135 C GLN A 13 -5.555 -17.066 4.861 1.00 0.00 C ATOM 136 O GLN A 13 -5.291 -15.958 4.398 1.00 0.00 O ATOM 137 CB GLN A 13 -7.604 -15.993 5.864 1.00 0.00 C ATOM 138 CG GLN A 13 -8.099 -15.349 4.568 1.00 0.00 C ATOM 139 CD GLN A 13 -8.818 -14.028 4.850 1.00 0.00 C ATOM 140 OE1 GLN A 13 -9.934 -13.794 4.417 1.00 0.00 O ATOM 141 NE2 GLN A 13 -8.118 -13.181 5.600 1.00 0.00 N ATOM 0 H GLN A 13 -5.834 -17.773 7.336 1.00 0.00 H new ATOM 0 HA GLN A 13 -7.523 -17.905 4.929 1.00 0.00 H new ATOM 0 HB2 GLN A 13 -8.448 -16.172 6.530 1.00 0.00 H new ATOM 0 HB3 GLN A 13 -6.930 -15.309 6.380 1.00 0.00 H new ATOM 0 HG2 GLN A 13 -7.256 -15.172 3.901 1.00 0.00 H new ATOM 0 HG3 GLN A 13 -8.775 -16.032 4.054 1.00 0.00 H new ATOM 0 HE21 GLN A 13 -7.188 -13.440 5.930 1.00 0.00 H new ATOM 0 HE22 GLN A 13 -8.511 -12.272 5.845 1.00 0.00 H new ATOM 150 N HIS A 14 -4.754 -18.119 4.788 1.00 0.00 N ATOM 151 CA HIS A 14 -3.461 -18.032 4.132 1.00 0.00 C ATOM 152 C HIS A 14 -2.592 -16.995 4.845 1.00 0.00 C ATOM 153 O HIS A 14 -3.093 -15.969 5.302 1.00 0.00 O ATOM 154 CB HIS A 14 -3.627 -17.741 2.639 1.00 0.00 C ATOM 155 CG HIS A 14 -2.484 -18.235 1.785 1.00 0.00 C ATOM 156 ND1 HIS A 14 -1.456 -17.413 1.360 1.00 0.00 N ATOM 157 CD2 HIS A 14 -2.219 -19.475 1.283 1.00 0.00 C ATOM 158 CE1 HIS A 14 -0.615 -18.135 0.635 1.00 0.00 C ATOM 159 NE2 HIS A 14 -1.090 -19.413 0.588 1.00 0.00 N ATOM 0 H HIS A 14 -4.976 -19.037 5.173 1.00 0.00 H new ATOM 0 HA HIS A 14 -2.950 -18.992 4.201 1.00 0.00 H new ATOM 0 HB2 HIS A 14 -4.552 -18.201 2.291 1.00 0.00 H new ATOM 0 HB3 HIS A 14 -3.733 -16.665 2.499 1.00 0.00 H new ATOM 0 HD2 HIS A 14 -2.825 -20.357 1.427 1.00 0.00 H new ATOM 0 HE1 HIS A 14 0.288 -17.775 0.164 1.00 0.00 H new ATOM 0 HE2 HIS A 14 -0.650 -20.193 0.099 1.00 0.00 H new ATOM 167 N PRO A 15 -1.270 -17.306 4.921 1.00 0.00 N ATOM 168 CA PRO A 15 -0.327 -16.412 5.571 1.00 0.00 C ATOM 169 C PRO A 15 -0.026 -15.198 4.690 1.00 0.00 C ATOM 170 O PRO A 15 0.421 -14.164 5.184 1.00 0.00 O ATOM 171 CB PRO A 15 0.901 -17.267 5.843 1.00 0.00 C ATOM 172 CG PRO A 15 0.781 -18.473 4.926 1.00 0.00 C ATOM 173 CD PRO A 15 -0.641 -18.512 4.391 1.00 0.00 C ATOM 0 HA PRO A 15 -0.717 -15.991 6.498 1.00 0.00 H new ATOM 0 HB2 PRO A 15 1.816 -16.711 5.640 1.00 0.00 H new ATOM 0 HB3 PRO A 15 0.940 -17.574 6.888 1.00 0.00 H new ATOM 0 HG2 PRO A 15 1.496 -18.402 4.106 1.00 0.00 H new ATOM 0 HG3 PRO A 15 1.010 -19.390 5.469 1.00 0.00 H new ATOM 0 HD2 PRO A 15 -0.654 -18.519 3.301 1.00 0.00 H new ATOM 0 HD3 PRO A 15 -1.164 -19.409 4.722 1.00 0.00 H new ATOM 181 N SER A 16 -0.284 -15.363 3.401 1.00 0.00 N ATOM 182 CA SER A 16 -0.046 -14.293 2.447 1.00 0.00 C ATOM 183 C SER A 16 -1.280 -13.392 2.353 1.00 0.00 C ATOM 184 O SER A 16 -1.181 -12.179 2.528 1.00 0.00 O ATOM 185 CB SER A 16 0.309 -14.853 1.069 1.00 0.00 C ATOM 186 OG SER A 16 1.590 -14.412 0.627 1.00 0.00 O ATOM 0 H SER A 16 -0.656 -16.222 2.995 1.00 0.00 H new ATOM 0 HA SER A 16 0.801 -13.703 2.798 1.00 0.00 H new ATOM 0 HB2 SER A 16 0.293 -15.942 1.105 1.00 0.00 H new ATOM 0 HB3 SER A 16 -0.449 -14.547 0.347 1.00 0.00 H new ATOM 0 HG SER A 16 1.846 -14.907 -0.179 1.00 0.00 H new ATOM 192 N ILE A 17 -2.412 -14.022 2.077 1.00 0.00 N ATOM 193 CA ILE A 17 -3.664 -13.293 1.958 1.00 0.00 C ATOM 194 C ILE A 17 -3.913 -12.502 3.244 1.00 0.00 C ATOM 195 O ILE A 17 -4.226 -11.314 3.195 1.00 0.00 O ATOM 196 CB ILE A 17 -4.805 -14.243 1.589 1.00 0.00 C ATOM 197 CG1 ILE A 17 -4.536 -14.927 0.247 1.00 0.00 C ATOM 198 CG2 ILE A 17 -6.150 -13.515 1.602 1.00 0.00 C ATOM 199 CD1 ILE A 17 -5.100 -14.103 -0.912 1.00 0.00 C ATOM 0 H ILE A 17 -2.489 -15.029 1.932 1.00 0.00 H new ATOM 0 HA ILE A 17 -3.608 -12.570 1.144 1.00 0.00 H new ATOM 0 HB ILE A 17 -4.856 -15.026 2.345 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -3.463 -15.063 0.113 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -4.986 -15.920 0.244 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -6.944 -14.213 1.336 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -6.337 -13.114 2.598 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -6.129 -12.698 0.881 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -4.895 -14.612 -1.854 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -6.177 -13.990 -0.788 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -4.630 -13.119 -0.921 1.00 0.00 H new ATOM 211 N SER A 18 -3.765 -13.194 4.364 1.00 0.00 N ATOM 212 CA SER A 18 -3.970 -12.572 5.661 1.00 0.00 C ATOM 213 C SER A 18 -2.982 -11.419 5.851 1.00 0.00 C ATOM 214 O SER A 18 -3.197 -10.544 6.687 1.00 0.00 O ATOM 215 CB SER A 18 -3.820 -13.592 6.791 1.00 0.00 C ATOM 216 OG SER A 18 -4.020 -13.002 8.073 1.00 0.00 O ATOM 0 H SER A 18 -3.505 -14.180 4.400 1.00 0.00 H new ATOM 0 HA SER A 18 -4.986 -12.180 5.695 1.00 0.00 H new ATOM 0 HB2 SER A 18 -4.538 -14.400 6.648 1.00 0.00 H new ATOM 0 HB3 SER A 18 -2.826 -14.037 6.748 1.00 0.00 H new ATOM 0 HG SER A 18 -3.917 -13.686 8.767 1.00 0.00 H new ATOM 222 N ARG A 19 -1.919 -11.457 5.060 1.00 0.00 N ATOM 223 CA ARG A 19 -0.897 -10.427 5.131 1.00 0.00 C ATOM 224 C ARG A 19 -1.349 -9.178 4.372 1.00 0.00 C ATOM 225 O ARG A 19 -1.311 -8.073 4.910 1.00 0.00 O ATOM 226 CB ARG A 19 0.426 -10.923 4.543 1.00 0.00 C ATOM 227 CG ARG A 19 1.613 -10.432 5.374 1.00 0.00 C ATOM 228 CD ARG A 19 1.943 -11.420 6.495 1.00 0.00 C ATOM 229 NE ARG A 19 2.442 -12.689 5.921 1.00 0.00 N ATOM 230 CZ ARG A 19 2.831 -13.742 6.653 1.00 0.00 C ATOM 231 NH1 ARG A 19 2.782 -13.684 7.991 1.00 0.00 N ATOM 232 NH2 ARG A 19 3.270 -14.854 6.046 1.00 0.00 N ATOM 0 H ARG A 19 -1.744 -12.185 4.367 1.00 0.00 H new ATOM 0 HA ARG A 19 -0.745 -10.182 6.182 1.00 0.00 H new ATOM 0 HB2 ARG A 19 0.427 -12.012 4.509 1.00 0.00 H new ATOM 0 HB3 ARG A 19 0.526 -10.572 3.516 1.00 0.00 H new ATOM 0 HG2 ARG A 19 2.483 -10.302 4.731 1.00 0.00 H new ATOM 0 HG3 ARG A 19 1.384 -9.456 5.801 1.00 0.00 H new ATOM 0 HD2 ARG A 19 2.694 -10.992 7.159 1.00 0.00 H new ATOM 0 HD3 ARG A 19 1.055 -11.609 7.098 1.00 0.00 H new ATOM 0 HE ARG A 19 2.493 -12.767 4.905 1.00 0.00 H new ATOM 0 HH11 ARG A 19 2.448 -12.838 8.453 1.00 0.00 H new ATOM 0 HH12 ARG A 19 3.078 -14.486 8.547 1.00 0.00 H new ATOM 0 HH21 ARG A 19 3.308 -14.898 5.028 1.00 0.00 H new ATOM 0 HH22 ARG A 19 3.566 -15.656 6.603 1.00 0.00 H new ATOM 246 N LEU A 20 -1.766 -9.396 3.133 1.00 0.00 N ATOM 247 CA LEU A 20 -2.224 -8.302 2.295 1.00 0.00 C ATOM 248 C LEU A 20 -3.359 -7.561 3.005 1.00 0.00 C ATOM 249 O LEU A 20 -3.424 -6.333 2.967 1.00 0.00 O ATOM 250 CB LEU A 20 -2.601 -8.814 0.903 1.00 0.00 C ATOM 251 CG LEU A 20 -1.434 -9.138 -0.031 1.00 0.00 C ATOM 252 CD1 LEU A 20 -0.572 -10.266 0.538 1.00 0.00 C ATOM 253 CD2 LEU A 20 -1.933 -9.454 -1.443 1.00 0.00 C ATOM 0 H LEU A 20 -1.796 -10.314 2.690 1.00 0.00 H new ATOM 0 HA LEU A 20 -1.421 -7.582 2.138 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -3.207 -9.712 1.020 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -3.230 -8.066 0.420 1.00 0.00 H new ATOM 0 HG LEU A 20 -0.800 -8.254 -0.104 1.00 0.00 H new ATOM 0 HD11 LEU A 20 0.250 -10.476 -0.146 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -0.171 -9.965 1.506 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -1.180 -11.162 0.660 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -1.083 -9.681 -2.087 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -2.602 -10.314 -1.409 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -2.470 -8.593 -1.841 1.00 0.00 H new ATOM 265 N GLN A 21 -4.226 -8.339 3.638 1.00 0.00 N ATOM 266 CA GLN A 21 -5.354 -7.772 4.356 1.00 0.00 C ATOM 267 C GLN A 21 -4.866 -6.969 5.563 1.00 0.00 C ATOM 268 O GLN A 21 -5.561 -6.072 6.039 1.00 0.00 O ATOM 269 CB GLN A 21 -6.335 -8.865 4.785 1.00 0.00 C ATOM 270 CG GLN A 21 -7.317 -9.193 3.659 1.00 0.00 C ATOM 271 CD GLN A 21 -8.654 -9.682 4.222 1.00 0.00 C ATOM 272 OE1 GLN A 21 -9.268 -9.053 5.068 1.00 0.00 O ATOM 273 NE2 GLN A 21 -9.067 -10.837 3.708 1.00 0.00 N ATOM 0 H GLN A 21 -4.169 -9.357 3.668 1.00 0.00 H new ATOM 0 HA GLN A 21 -5.884 -7.096 3.685 1.00 0.00 H new ATOM 0 HB2 GLN A 21 -5.785 -9.763 5.065 1.00 0.00 H new ATOM 0 HB3 GLN A 21 -6.885 -8.539 5.668 1.00 0.00 H new ATOM 0 HG2 GLN A 21 -7.479 -8.308 3.044 1.00 0.00 H new ATOM 0 HG3 GLN A 21 -6.890 -9.958 3.010 1.00 0.00 H new ATOM 0 HE21 GLN A 21 -8.504 -11.312 3.002 1.00 0.00 H new ATOM 0 HE22 GLN A 21 -9.947 -11.248 4.019 1.00 0.00 H new ATOM 282 N GLU A 22 -3.674 -7.318 6.023 1.00 0.00 N ATOM 283 CA GLU A 22 -3.084 -6.641 7.166 1.00 0.00 C ATOM 284 C GLU A 22 -2.224 -5.465 6.699 1.00 0.00 C ATOM 285 O GLU A 22 -1.723 -4.694 7.517 1.00 0.00 O ATOM 286 CB GLU A 22 -2.268 -7.613 8.019 1.00 0.00 C ATOM 287 CG GLU A 22 -3.089 -8.127 9.203 1.00 0.00 C ATOM 288 CD GLU A 22 -2.453 -7.713 10.532 1.00 0.00 C ATOM 289 OE1 GLU A 22 -2.401 -6.488 10.778 1.00 0.00 O ATOM 290 OE2 GLU A 22 -2.034 -8.630 11.270 1.00 0.00 O ATOM 0 H GLU A 22 -3.100 -8.061 5.625 1.00 0.00 H new ATOM 0 HA GLU A 22 -3.889 -6.252 7.789 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -1.941 -8.453 7.407 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -1.369 -7.116 8.384 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -4.104 -7.735 9.144 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -3.164 -9.213 9.154 1.00 0.00 H new ATOM 297 N ILE A 23 -2.078 -5.363 5.386 1.00 0.00 N ATOM 298 CA ILE A 23 -1.287 -4.294 4.801 1.00 0.00 C ATOM 299 C ILE A 23 -2.212 -3.330 4.055 1.00 0.00 C ATOM 300 O ILE A 23 -1.983 -2.122 4.053 1.00 0.00 O ATOM 301 CB ILE A 23 -0.168 -4.870 3.931 1.00 0.00 C ATOM 302 CG1 ILE A 23 1.019 -5.315 4.788 1.00 0.00 C ATOM 303 CG2 ILE A 23 0.249 -3.876 2.845 1.00 0.00 C ATOM 304 CD1 ILE A 23 1.460 -6.733 4.420 1.00 0.00 C ATOM 0 H ILE A 23 -2.495 -6.004 4.710 1.00 0.00 H new ATOM 0 HA ILE A 23 -0.789 -3.718 5.581 1.00 0.00 H new ATOM 0 HB ILE A 23 -0.550 -5.757 3.426 1.00 0.00 H new ATOM 0 HG12 ILE A 23 1.851 -4.624 4.650 1.00 0.00 H new ATOM 0 HG13 ILE A 23 0.745 -5.278 5.842 1.00 0.00 H new ATOM 0 HG21 ILE A 23 1.046 -4.310 2.241 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -0.607 -3.651 2.209 1.00 0.00 H new ATOM 0 HG23 ILE A 23 0.606 -2.957 3.310 1.00 0.00 H new ATOM 0 HD11 ILE A 23 2.305 -7.025 5.044 1.00 0.00 H new ATOM 0 HD12 ILE A 23 0.633 -7.425 4.582 1.00 0.00 H new ATOM 0 HD13 ILE A 23 1.756 -6.761 3.371 1.00 0.00 H new ATOM 316 N GLN A 24 -3.237 -3.902 3.440 1.00 0.00 N ATOM 317 CA GLN A 24 -4.198 -3.108 2.692 1.00 0.00 C ATOM 318 C GLN A 24 -4.917 -2.130 3.622 1.00 0.00 C ATOM 319 O GLN A 24 -5.002 -0.938 3.331 1.00 0.00 O ATOM 320 CB GLN A 24 -5.198 -4.005 1.959 1.00 0.00 C ATOM 321 CG GLN A 24 -4.669 -4.403 0.580 1.00 0.00 C ATOM 322 CD GLN A 24 -5.792 -4.395 -0.460 1.00 0.00 C ATOM 323 OE1 GLN A 24 -6.555 -5.337 -0.595 1.00 0.00 O ATOM 324 NE2 GLN A 24 -5.850 -3.281 -1.185 1.00 0.00 N ATOM 0 H GLN A 24 -3.423 -4.905 3.444 1.00 0.00 H new ATOM 0 HA GLN A 24 -3.658 -2.533 1.940 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -5.391 -4.900 2.551 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -6.149 -3.483 1.851 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -3.881 -3.714 0.276 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -4.222 -5.396 0.630 1.00 0.00 H new ATOM 0 HE21 GLN A 24 -5.180 -2.530 -1.020 1.00 0.00 H new ATOM 0 HE22 GLN A 24 -6.565 -3.178 -1.905 1.00 0.00 H new ATOM 333 N ARG A 25 -5.418 -2.671 4.724 1.00 0.00 N ATOM 334 CA ARG A 25 -6.128 -1.860 5.699 1.00 0.00 C ATOM 335 C ARG A 25 -5.246 -0.702 6.169 1.00 0.00 C ATOM 336 O ARG A 25 -5.751 0.353 6.550 1.00 0.00 O ATOM 337 CB ARG A 25 -6.547 -2.697 6.909 1.00 0.00 C ATOM 338 CG ARG A 25 -5.326 -3.292 7.614 1.00 0.00 C ATOM 339 CD ARG A 25 -5.743 -4.098 8.846 1.00 0.00 C ATOM 340 NE ARG A 25 -5.178 -3.484 10.068 1.00 0.00 N ATOM 341 CZ ARG A 25 -5.460 -3.891 11.313 1.00 0.00 C ATOM 342 NH1 ARG A 25 -6.301 -4.916 11.508 1.00 0.00 N ATOM 343 NH2 ARG A 25 -4.901 -3.274 12.362 1.00 0.00 N ATOM 0 H ARG A 25 -5.346 -3.660 4.963 1.00 0.00 H new ATOM 0 HA ARG A 25 -7.022 -1.467 5.216 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -7.108 -2.077 7.608 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -7.213 -3.498 6.588 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -4.780 -3.934 6.923 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -4.647 -2.492 7.911 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -6.830 -4.134 8.916 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -5.396 -5.127 8.752 1.00 0.00 H new ATOM 0 HE ARG A 25 -4.533 -2.702 9.955 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -6.726 -5.386 10.709 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -6.516 -5.226 12.456 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -4.261 -2.494 12.213 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -5.116 -3.584 13.310 1.00 0.00 H new ATOM 357 N GLU A 26 -3.943 -0.937 6.127 1.00 0.00 N ATOM 358 CA GLU A 26 -2.986 0.074 6.544 1.00 0.00 C ATOM 359 C GLU A 26 -2.923 1.203 5.514 1.00 0.00 C ATOM 360 O GLU A 26 -3.260 2.346 5.819 1.00 0.00 O ATOM 361 CB GLU A 26 -1.603 -0.540 6.769 1.00 0.00 C ATOM 362 CG GLU A 26 -1.535 -1.260 8.118 1.00 0.00 C ATOM 363 CD GLU A 26 -0.767 -0.426 9.146 1.00 0.00 C ATOM 364 OE1 GLU A 26 -1.301 0.637 9.527 1.00 0.00 O ATOM 365 OE2 GLU A 26 0.337 -0.872 9.527 1.00 0.00 O ATOM 0 H GLU A 26 -3.527 -1.813 5.811 1.00 0.00 H new ATOM 0 HA GLU A 26 -3.321 0.493 7.493 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -1.378 -1.242 5.966 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -0.844 0.241 6.731 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -2.544 -1.454 8.482 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -1.050 -2.228 7.994 1.00 0.00 H new ATOM 372 N VAL A 27 -2.491 0.843 4.314 1.00 0.00 N ATOM 373 CA VAL A 27 -2.380 1.812 3.237 1.00 0.00 C ATOM 374 C VAL A 27 -3.731 2.500 3.035 1.00 0.00 C ATOM 375 O VAL A 27 -3.786 3.660 2.628 1.00 0.00 O ATOM 376 CB VAL A 27 -1.862 1.128 1.970 1.00 0.00 C ATOM 377 CG1 VAL A 27 -0.566 0.364 2.249 1.00 0.00 C ATOM 378 CG2 VAL A 27 -2.925 0.204 1.372 1.00 0.00 C ATOM 0 H VAL A 27 -2.214 -0.106 4.064 1.00 0.00 H new ATOM 0 HA VAL A 27 -1.656 2.586 3.492 1.00 0.00 H new ATOM 0 HB VAL A 27 -1.642 1.904 1.237 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -0.220 -0.112 1.332 1.00 0.00 H new ATOM 0 HG12 VAL A 27 0.195 1.057 2.607 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -0.749 -0.398 3.007 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -2.531 -0.269 0.473 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -3.191 -0.563 2.099 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -3.811 0.786 1.118 1.00 0.00 H new ATOM 388 N LYS A 28 -4.788 1.757 3.329 1.00 0.00 N ATOM 389 CA LYS A 28 -6.135 2.281 3.185 1.00 0.00 C ATOM 390 C LYS A 28 -6.466 3.165 4.389 1.00 0.00 C ATOM 391 O LYS A 28 -7.073 4.224 4.239 1.00 0.00 O ATOM 392 CB LYS A 28 -7.133 1.142 2.965 1.00 0.00 C ATOM 393 CG LYS A 28 -8.448 1.669 2.387 1.00 0.00 C ATOM 394 CD LYS A 28 -8.909 0.813 1.205 1.00 0.00 C ATOM 395 CE LYS A 28 -9.007 1.650 -0.072 1.00 0.00 C ATOM 396 NZ LYS A 28 -9.707 0.894 -1.134 1.00 0.00 N ATOM 0 H LYS A 28 -4.738 0.796 3.666 1.00 0.00 H new ATOM 0 HA LYS A 28 -6.205 2.911 2.298 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -6.704 0.404 2.288 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -7.325 0.634 3.910 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -9.215 1.670 3.161 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -8.320 2.702 2.064 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -8.210 -0.009 1.052 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -9.879 0.370 1.429 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -9.541 2.578 0.134 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -8.008 1.925 -0.411 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -9.765 1.476 -1.994 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -9.182 0.021 -1.342 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -10.667 0.653 -0.814 1.00 0.00 H new ATOM 410 N ALA A 29 -6.051 2.697 5.557 1.00 0.00 N ATOM 411 CA ALA A 29 -6.295 3.431 6.787 1.00 0.00 C ATOM 412 C ALA A 29 -5.447 4.705 6.792 1.00 0.00 C ATOM 413 O ALA A 29 -5.674 5.603 7.602 1.00 0.00 O ATOM 414 CB ALA A 29 -6.000 2.530 7.987 1.00 0.00 C ATOM 0 H ALA A 29 -5.547 1.818 5.678 1.00 0.00 H new ATOM 0 HA ALA A 29 -7.341 3.730 6.854 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -6.183 3.081 8.909 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -6.648 1.654 7.953 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -4.958 2.212 7.955 1.00 0.00 H new ATOM 420 N ILE A 30 -4.488 4.743 5.879 1.00 0.00 N ATOM 421 CA ILE A 30 -3.606 5.892 5.768 1.00 0.00 C ATOM 422 C ILE A 30 -3.871 6.608 4.442 1.00 0.00 C ATOM 423 O ILE A 30 -3.175 7.562 4.097 1.00 0.00 O ATOM 424 CB ILE A 30 -2.148 5.468 5.956 1.00 0.00 C ATOM 425 CG1 ILE A 30 -1.698 4.535 4.830 1.00 0.00 C ATOM 426 CG2 ILE A 30 -1.932 4.845 7.337 1.00 0.00 C ATOM 427 CD1 ILE A 30 -0.891 5.297 3.777 1.00 0.00 C ATOM 0 H ILE A 30 -4.302 3.996 5.209 1.00 0.00 H new ATOM 0 HA ILE A 30 -3.812 6.608 6.564 1.00 0.00 H new ATOM 0 HB ILE A 30 -1.524 6.360 5.903 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -1.094 3.727 5.242 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -2.569 4.075 4.363 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -0.888 4.552 7.445 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -2.187 5.572 8.108 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -2.568 3.966 7.443 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -0.583 4.611 2.988 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -1.506 6.089 3.350 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -0.008 5.735 4.242 1.00 0.00 H new ATOM 439 N GLU A 31 -4.880 6.120 3.734 1.00 0.00 N ATOM 440 CA GLU A 31 -5.246 6.701 2.454 1.00 0.00 C ATOM 441 C GLU A 31 -5.773 8.124 2.648 1.00 0.00 C ATOM 442 O GLU A 31 -5.431 9.026 1.884 1.00 0.00 O ATOM 443 CB GLU A 31 -6.274 5.829 1.730 1.00 0.00 C ATOM 444 CG GLU A 31 -6.949 6.604 0.597 1.00 0.00 C ATOM 445 CD GLU A 31 -8.065 5.776 -0.045 1.00 0.00 C ATOM 446 OE1 GLU A 31 -9.083 5.563 0.648 1.00 0.00 O ATOM 447 OE2 GLU A 31 -7.874 5.375 -1.213 1.00 0.00 O ATOM 0 H GLU A 31 -5.455 5.329 4.023 1.00 0.00 H new ATOM 0 HA GLU A 31 -4.354 6.747 1.830 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -5.785 4.942 1.328 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -7.027 5.484 2.439 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -7.360 7.537 0.984 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -6.209 6.870 -0.158 1.00 0.00 H new ATOM 454 N PRO A 32 -6.619 8.285 3.701 1.00 0.00 N ATOM 455 CA PRO A 32 -7.196 9.583 4.005 1.00 0.00 C ATOM 456 C PRO A 32 -6.161 10.506 4.650 1.00 0.00 C ATOM 457 O PRO A 32 -6.461 11.657 4.964 1.00 0.00 O ATOM 458 CB PRO A 32 -8.376 9.285 4.915 1.00 0.00 C ATOM 459 CG PRO A 32 -8.139 7.886 5.461 1.00 0.00 C ATOM 460 CD PRO A 32 -7.046 7.239 4.626 1.00 0.00 C ATOM 0 HA PRO A 32 -7.523 10.117 3.113 1.00 0.00 H new ATOM 0 HB2 PRO A 32 -8.440 10.014 5.723 1.00 0.00 H new ATOM 0 HB3 PRO A 32 -9.316 9.336 4.365 1.00 0.00 H new ATOM 0 HG2 PRO A 32 -7.843 7.930 6.509 1.00 0.00 H new ATOM 0 HG3 PRO A 32 -9.055 7.297 5.413 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -6.219 6.900 5.250 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -7.420 6.366 4.091 1.00 0.00 H new ATOM 468 N GLN A 33 -4.965 9.966 4.830 1.00 0.00 N ATOM 469 CA GLN A 33 -3.884 10.727 5.433 1.00 0.00 C ATOM 470 C GLN A 33 -3.056 11.423 4.350 1.00 0.00 C ATOM 471 O GLN A 33 -2.174 12.224 4.657 1.00 0.00 O ATOM 472 CB GLN A 33 -3.002 9.831 6.305 1.00 0.00 C ATOM 473 CG GLN A 33 -3.606 9.659 7.701 1.00 0.00 C ATOM 474 CD GLN A 33 -2.587 9.053 8.668 1.00 0.00 C ATOM 475 OE1 GLN A 33 -1.985 7.961 8.205 1.00 0.00 O flip ATOM 476 NE2 GLN A 33 -2.363 9.545 9.762 1.00 0.00 N flip ATOM 0 H GLN A 33 -4.721 9.011 4.569 1.00 0.00 H new ATOM 0 HA GLN A 33 -4.320 11.491 6.078 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -2.888 8.856 5.832 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -2.005 10.265 6.387 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -3.941 10.625 8.078 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -4.485 9.017 7.644 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -2.862 10.385 10.055 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -1.677 9.116 10.383 1.00 0.00 H new ATOM 485 N VAL A 34 -3.370 11.092 3.106 1.00 0.00 N ATOM 486 CA VAL A 34 -2.667 11.675 1.977 1.00 0.00 C ATOM 487 C VAL A 34 -3.675 12.363 1.054 1.00 0.00 C ATOM 488 O VAL A 34 -3.389 13.421 0.495 1.00 0.00 O ATOM 489 CB VAL A 34 -1.840 10.602 1.265 1.00 0.00 C ATOM 490 CG1 VAL A 34 -2.394 9.205 1.549 1.00 0.00 C ATOM 491 CG2 VAL A 34 -1.772 10.871 -0.240 1.00 0.00 C ATOM 0 H VAL A 34 -4.102 10.427 2.856 1.00 0.00 H new ATOM 0 HA VAL A 34 -1.965 12.436 2.316 1.00 0.00 H new ATOM 0 HB VAL A 34 -0.824 10.645 1.658 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -1.788 8.461 1.031 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -2.366 9.013 2.622 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -3.424 9.143 1.197 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -1.179 10.094 -0.722 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -2.780 10.869 -0.656 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -1.309 11.842 -0.415 1.00 0.00 H new ATOM 501 N VAL A 35 -4.834 11.734 0.922 1.00 0.00 N ATOM 502 CA VAL A 35 -5.886 12.272 0.076 1.00 0.00 C ATOM 503 C VAL A 35 -5.910 13.796 0.207 1.00 0.00 C ATOM 504 O VAL A 35 -5.567 14.509 -0.735 1.00 0.00 O ATOM 505 CB VAL A 35 -7.224 11.620 0.428 1.00 0.00 C ATOM 506 CG1 VAL A 35 -8.393 12.420 -0.152 1.00 0.00 C ATOM 507 CG2 VAL A 35 -7.267 10.165 -0.043 1.00 0.00 C ATOM 0 H VAL A 35 -5.068 10.857 1.387 1.00 0.00 H new ATOM 0 HA VAL A 35 -5.692 12.039 -0.971 1.00 0.00 H new ATOM 0 HB VAL A 35 -7.322 11.622 1.514 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -9.333 11.935 0.113 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -8.379 13.431 0.255 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -8.301 12.464 -1.237 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -8.229 9.726 0.220 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -7.135 10.129 -1.124 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -6.467 9.603 0.439 1.00 0.00 H new ATOM 517 N GLY A 36 -6.318 14.251 1.383 1.00 0.00 N ATOM 518 CA GLY A 36 -6.391 15.677 1.649 1.00 0.00 C ATOM 519 C GLY A 36 -5.336 16.099 2.673 1.00 0.00 C ATOM 520 O GLY A 36 -5.648 16.781 3.647 1.00 0.00 O ATOM 0 H GLY A 36 -6.601 13.657 2.162 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -6.245 16.231 0.722 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -7.384 15.931 2.019 1.00 0.00 H new ATOM 524 N PHE A 37 -4.107 15.675 2.417 1.00 0.00 N ATOM 525 CA PHE A 37 -3.003 16.000 3.305 1.00 0.00 C ATOM 526 C PHE A 37 -2.475 17.409 3.030 1.00 0.00 C ATOM 527 O PHE A 37 -2.778 17.998 1.993 1.00 0.00 O ATOM 528 CB PHE A 37 -1.890 14.988 3.024 1.00 0.00 C ATOM 529 CG PHE A 37 -0.516 15.414 3.543 1.00 0.00 C ATOM 530 CD1 PHE A 37 -0.253 15.384 4.877 1.00 0.00 C ATOM 531 CD2 PHE A 37 0.443 15.824 2.670 1.00 0.00 C ATOM 532 CE1 PHE A 37 1.023 15.779 5.358 1.00 0.00 C ATOM 533 CE2 PHE A 37 1.719 16.220 3.151 1.00 0.00 C ATOM 534 CZ PHE A 37 1.982 16.189 4.485 1.00 0.00 C ATOM 0 H PHE A 37 -3.851 15.109 1.608 1.00 0.00 H new ATOM 0 HA PHE A 37 -3.336 15.961 4.342 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -2.158 14.034 3.477 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -1.826 14.824 1.948 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -1.015 15.060 5.570 1.00 0.00 H new ATOM 0 HD2 PHE A 37 0.234 15.848 1.611 1.00 0.00 H new ATOM 0 HE1 PHE A 37 1.232 15.754 6.417 1.00 0.00 H new ATOM 0 HE2 PHE A 37 2.480 16.546 2.458 1.00 0.00 H new ATOM 0 HZ PHE A 37 2.952 16.490 4.851 1.00 0.00 H new ATOM 544 N SER A 38 -1.695 17.910 3.976 1.00 0.00 N ATOM 545 CA SER A 38 -1.122 19.239 3.849 1.00 0.00 C ATOM 546 C SER A 38 0.260 19.278 4.505 1.00 0.00 C ATOM 547 O SER A 38 0.369 19.287 5.730 1.00 0.00 O ATOM 548 CB SER A 38 -2.036 20.295 4.474 1.00 0.00 C ATOM 549 OG SER A 38 -2.202 20.096 5.875 1.00 0.00 O ATOM 0 H SER A 38 -1.446 17.419 4.835 1.00 0.00 H new ATOM 0 HA SER A 38 -1.020 19.467 2.788 1.00 0.00 H new ATOM 0 HB2 SER A 38 -1.619 21.286 4.296 1.00 0.00 H new ATOM 0 HB3 SER A 38 -3.010 20.266 3.986 1.00 0.00 H new ATOM 0 HG SER A 38 -1.339 19.862 6.277 1.00 0.00 H new ATOM 555 N GLY A 39 1.280 19.301 3.660 1.00 0.00 N ATOM 556 CA GLY A 39 2.650 19.339 4.143 1.00 0.00 C ATOM 557 C GLY A 39 3.642 19.326 2.978 1.00 0.00 C ATOM 558 O GLY A 39 3.374 18.728 1.937 1.00 0.00 O ATOM 0 H GLY A 39 1.185 19.294 2.644 1.00 0.00 H new ATOM 0 HA2 GLY A 39 2.802 20.235 4.745 1.00 0.00 H new ATOM 0 HA3 GLY A 39 2.835 18.483 4.792 1.00 0.00 H new ATOM 562 N LEU A 40 4.767 19.991 3.193 1.00 0.00 N ATOM 563 CA LEU A 40 5.801 20.063 2.174 1.00 0.00 C ATOM 564 C LEU A 40 6.456 18.689 2.020 1.00 0.00 C ATOM 565 O LEU A 40 6.604 17.955 2.996 1.00 0.00 O ATOM 566 CB LEU A 40 6.791 21.184 2.494 1.00 0.00 C ATOM 567 CG LEU A 40 6.762 22.393 1.556 1.00 0.00 C ATOM 568 CD1 LEU A 40 7.329 23.635 2.246 1.00 0.00 C ATOM 569 CD2 LEU A 40 7.484 22.086 0.243 1.00 0.00 C ATOM 0 H LEU A 40 4.986 20.485 4.058 1.00 0.00 H new ATOM 0 HA LEU A 40 5.367 20.319 1.208 1.00 0.00 H new ATOM 0 HB2 LEU A 40 6.599 21.532 3.509 1.00 0.00 H new ATOM 0 HB3 LEU A 40 7.798 20.766 2.485 1.00 0.00 H new ATOM 0 HG LEU A 40 5.723 22.609 1.308 1.00 0.00 H new ATOM 0 HD11 LEU A 40 7.297 24.480 1.558 1.00 0.00 H new ATOM 0 HD12 LEU A 40 6.734 23.864 3.130 1.00 0.00 H new ATOM 0 HD13 LEU A 40 8.361 23.447 2.542 1.00 0.00 H new ATOM 0 HD21 LEU A 40 7.449 22.962 -0.405 1.00 0.00 H new ATOM 0 HD22 LEU A 40 8.523 21.830 0.450 1.00 0.00 H new ATOM 0 HD23 LEU A 40 6.996 21.247 -0.253 1.00 0.00 H new ATOM 581 N SER A 41 6.831 18.382 0.787 1.00 0.00 N ATOM 582 CA SER A 41 7.467 17.110 0.493 1.00 0.00 C ATOM 583 C SER A 41 8.445 16.743 1.611 1.00 0.00 C ATOM 584 O SER A 41 9.505 17.354 1.739 1.00 0.00 O ATOM 585 CB SER A 41 8.192 17.154 -0.853 1.00 0.00 C ATOM 586 OG SER A 41 9.036 18.296 -0.968 1.00 0.00 O ATOM 0 H SER A 41 6.706 18.993 -0.020 1.00 0.00 H new ATOM 0 HA SER A 41 6.691 16.346 0.432 1.00 0.00 H new ATOM 0 HB2 SER A 41 8.788 16.249 -0.973 1.00 0.00 H new ATOM 0 HB3 SER A 41 7.459 17.162 -1.660 1.00 0.00 H new ATOM 0 HG SER A 41 9.541 18.415 -0.137 1.00 0.00 H new ATOM 592 N ASP A 42 8.055 15.746 2.391 1.00 0.00 N ATOM 593 CA ASP A 42 8.885 15.290 3.494 1.00 0.00 C ATOM 594 C ASP A 42 8.845 16.326 4.619 1.00 0.00 C ATOM 595 O ASP A 42 9.743 17.158 4.734 1.00 0.00 O ATOM 596 CB ASP A 42 10.341 15.124 3.056 1.00 0.00 C ATOM 597 CG ASP A 42 10.535 14.445 1.699 1.00 0.00 C ATOM 598 OD1 ASP A 42 10.250 15.115 0.683 1.00 0.00 O ATOM 599 OD2 ASP A 42 10.962 13.270 1.708 1.00 0.00 O ATOM 0 H ASP A 42 7.176 15.241 2.282 1.00 0.00 H new ATOM 0 HA ASP A 42 8.498 14.328 3.832 1.00 0.00 H new ATOM 0 HB2 ASP A 42 10.809 16.108 3.023 1.00 0.00 H new ATOM 0 HB3 ASP A 42 10.869 14.545 3.814 1.00 0.00 H new ATOM 604 N ASP A 43 7.793 16.243 5.420 1.00 0.00 N ATOM 605 CA ASP A 43 7.624 17.163 6.532 1.00 0.00 C ATOM 606 C ASP A 43 6.171 17.117 7.010 1.00 0.00 C ATOM 607 O ASP A 43 5.294 16.635 6.296 1.00 0.00 O ATOM 608 CB ASP A 43 7.937 18.600 6.110 1.00 0.00 C ATOM 609 CG ASP A 43 9.142 19.231 6.810 1.00 0.00 C ATOM 610 OD1 ASP A 43 9.573 18.652 7.830 1.00 0.00 O ATOM 611 OD2 ASP A 43 9.604 20.279 6.310 1.00 0.00 O ATOM 0 H ASP A 43 7.049 15.553 5.321 1.00 0.00 H new ATOM 0 HA ASP A 43 8.308 16.863 7.325 1.00 0.00 H new ATOM 0 HB2 ASP A 43 8.111 18.617 5.034 1.00 0.00 H new ATOM 0 HB3 ASP A 43 7.060 19.218 6.301 1.00 0.00 H new ATOM 616 N LYS A 44 5.962 17.624 8.216 1.00 0.00 N ATOM 617 CA LYS A 44 4.631 17.647 8.799 1.00 0.00 C ATOM 618 C LYS A 44 4.200 16.217 9.129 1.00 0.00 C ATOM 619 O LYS A 44 4.568 15.679 10.172 1.00 0.00 O ATOM 620 CB LYS A 44 3.657 18.386 7.879 1.00 0.00 C ATOM 621 CG LYS A 44 3.511 19.850 8.299 1.00 0.00 C ATOM 622 CD LYS A 44 4.641 20.703 7.716 1.00 0.00 C ATOM 623 CE LYS A 44 4.496 22.166 8.138 1.00 0.00 C ATOM 624 NZ LYS A 44 5.466 23.014 7.409 1.00 0.00 N ATOM 0 H LYS A 44 6.693 18.022 8.806 1.00 0.00 H new ATOM 0 HA LYS A 44 4.634 18.204 9.736 1.00 0.00 H new ATOM 0 HB2 LYS A 44 4.012 18.333 6.850 1.00 0.00 H new ATOM 0 HB3 LYS A 44 2.683 17.897 7.906 1.00 0.00 H new ATOM 0 HG2 LYS A 44 2.549 20.235 7.961 1.00 0.00 H new ATOM 0 HG3 LYS A 44 3.520 19.923 9.387 1.00 0.00 H new ATOM 0 HD2 LYS A 44 5.603 20.317 8.052 1.00 0.00 H new ATOM 0 HD3 LYS A 44 4.631 20.632 6.628 1.00 0.00 H new ATOM 0 HE2 LYS A 44 3.481 22.510 7.938 1.00 0.00 H new ATOM 0 HE3 LYS A 44 4.658 22.259 9.212 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 5.354 24.004 7.707 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 6.433 22.696 7.621 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 5.293 22.939 6.386 1.00 0.00 H new ATOM 638 N ASN A 45 3.425 15.642 8.221 1.00 0.00 N ATOM 639 CA ASN A 45 2.939 14.284 8.404 1.00 0.00 C ATOM 640 C ASN A 45 3.501 13.393 7.295 1.00 0.00 C ATOM 641 O ASN A 45 3.829 12.231 7.533 1.00 0.00 O ATOM 642 CB ASN A 45 1.412 14.231 8.325 1.00 0.00 C ATOM 643 CG ASN A 45 0.840 13.301 9.397 1.00 0.00 C ATOM 644 OD1 ASN A 45 1.392 12.259 9.710 1.00 0.00 O ATOM 645 ND2 ASN A 45 -0.293 13.734 9.941 1.00 0.00 N ATOM 0 H ASN A 45 3.122 16.091 7.357 1.00 0.00 H new ATOM 0 HA ASN A 45 3.262 13.939 9.386 1.00 0.00 H new ATOM 0 HB2 ASN A 45 1.003 15.233 8.452 1.00 0.00 H new ATOM 0 HB3 ASN A 45 1.107 13.885 7.338 1.00 0.00 H new ATOM 0 HD21 ASN A 45 -0.753 13.184 10.667 1.00 0.00 H new ATOM 0 HD22 ASN A 45 -0.702 14.616 9.633 1.00 0.00 H new ATOM 652 N TYR A 46 3.596 13.970 6.106 1.00 0.00 N ATOM 653 CA TYR A 46 4.113 13.243 4.960 1.00 0.00 C ATOM 654 C TYR A 46 5.227 12.281 5.377 1.00 0.00 C ATOM 655 O TYR A 46 5.301 11.158 4.882 1.00 0.00 O ATOM 656 CB TYR A 46 4.693 14.298 4.017 1.00 0.00 C ATOM 657 CG TYR A 46 5.422 13.716 2.804 1.00 0.00 C ATOM 658 CD1 TYR A 46 6.619 13.050 2.972 1.00 0.00 C ATOM 659 CD2 TYR A 46 4.882 13.858 1.541 1.00 0.00 C ATOM 660 CE1 TYR A 46 7.304 12.502 1.830 1.00 0.00 C ATOM 661 CE2 TYR A 46 5.568 13.310 0.400 1.00 0.00 C ATOM 662 CZ TYR A 46 6.745 12.659 0.600 1.00 0.00 C ATOM 663 OH TYR A 46 7.393 12.142 -0.478 1.00 0.00 O ATOM 0 H TYR A 46 3.323 14.934 5.912 1.00 0.00 H new ATOM 0 HA TYR A 46 3.324 12.653 4.493 1.00 0.00 H new ATOM 0 HB2 TYR A 46 3.886 14.942 3.668 1.00 0.00 H new ATOM 0 HB3 TYR A 46 5.385 14.929 4.575 1.00 0.00 H new ATOM 0 HD1 TYR A 46 7.042 12.940 3.960 1.00 0.00 H new ATOM 0 HD2 TYR A 46 3.946 14.380 1.409 1.00 0.00 H new ATOM 0 HE1 TYR A 46 8.241 11.978 1.948 1.00 0.00 H new ATOM 0 HE2 TYR A 46 5.157 13.414 -0.593 1.00 0.00 H new ATOM 0 HH TYR A 46 7.656 11.217 -0.289 1.00 0.00 H new ATOM 673 N LYS A 47 6.067 12.758 6.285 1.00 0.00 N ATOM 674 CA LYS A 47 7.174 11.955 6.775 1.00 0.00 C ATOM 675 C LYS A 47 6.660 10.566 7.159 1.00 0.00 C ATOM 676 O LYS A 47 7.101 9.561 6.604 1.00 0.00 O ATOM 677 CB LYS A 47 7.900 12.679 7.911 1.00 0.00 C ATOM 678 CG LYS A 47 8.932 13.666 7.361 1.00 0.00 C ATOM 679 CD LYS A 47 9.952 12.953 6.471 1.00 0.00 C ATOM 680 CE LYS A 47 11.316 13.644 6.539 1.00 0.00 C ATOM 681 NZ LYS A 47 11.149 15.104 6.716 1.00 0.00 N ATOM 0 H LYS A 47 6.003 13.690 6.694 1.00 0.00 H new ATOM 0 HA LYS A 47 7.919 11.814 5.992 1.00 0.00 H new ATOM 0 HB2 LYS A 47 7.177 13.211 8.529 1.00 0.00 H new ATOM 0 HB3 LYS A 47 8.395 11.951 8.554 1.00 0.00 H new ATOM 0 HG2 LYS A 47 8.427 14.445 6.790 1.00 0.00 H new ATOM 0 HG3 LYS A 47 9.446 14.158 8.187 1.00 0.00 H new ATOM 0 HD2 LYS A 47 10.051 11.914 6.785 1.00 0.00 H new ATOM 0 HD3 LYS A 47 9.597 12.942 5.441 1.00 0.00 H new ATOM 0 HE2 LYS A 47 11.896 13.235 7.366 1.00 0.00 H new ATOM 0 HE3 LYS A 47 11.877 13.444 5.626 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 11.803 15.607 6.083 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 10.171 15.372 6.487 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 11.356 15.360 7.703 1.00 0.00 H new ATOM 695 N ARG A 48 5.736 10.554 8.108 1.00 0.00 N ATOM 696 CA ARG A 48 5.157 9.306 8.574 1.00 0.00 C ATOM 697 C ARG A 48 4.489 8.565 7.414 1.00 0.00 C ATOM 698 O ARG A 48 4.795 7.401 7.157 1.00 0.00 O ATOM 699 CB ARG A 48 4.123 9.554 9.674 1.00 0.00 C ATOM 700 CG ARG A 48 4.106 8.402 10.681 1.00 0.00 C ATOM 701 CD ARG A 48 5.107 8.648 11.812 1.00 0.00 C ATOM 702 NE ARG A 48 4.401 9.152 13.012 1.00 0.00 N ATOM 703 CZ ARG A 48 5.011 9.492 14.155 1.00 0.00 C ATOM 704 NH1 ARG A 48 6.343 9.385 14.261 1.00 0.00 N ATOM 705 NH2 ARG A 48 4.290 9.939 15.192 1.00 0.00 N ATOM 0 H ARG A 48 5.374 11.390 8.567 1.00 0.00 H new ATOM 0 HA ARG A 48 5.965 8.698 8.981 1.00 0.00 H new ATOM 0 HB2 ARG A 48 4.351 10.488 10.188 1.00 0.00 H new ATOM 0 HB3 ARG A 48 3.134 9.668 9.230 1.00 0.00 H new ATOM 0 HG2 ARG A 48 3.104 8.291 11.095 1.00 0.00 H new ATOM 0 HG3 ARG A 48 4.347 7.468 10.174 1.00 0.00 H new ATOM 0 HD2 ARG A 48 5.633 7.724 12.051 1.00 0.00 H new ATOM 0 HD3 ARG A 48 5.859 9.369 11.493 1.00 0.00 H new ATOM 0 HE ARG A 48 3.386 9.246 12.965 1.00 0.00 H new ATOM 0 HH11 ARG A 48 6.892 9.045 13.471 1.00 0.00 H new ATOM 0 HH12 ARG A 48 6.808 9.644 15.131 1.00 0.00 H new ATOM 0 HH21 ARG A 48 3.276 10.020 15.111 1.00 0.00 H new ATOM 0 HH22 ARG A 48 4.755 10.198 16.062 1.00 0.00 H new ATOM 719 N LEU A 49 3.589 9.269 6.744 1.00 0.00 N ATOM 720 CA LEU A 49 2.875 8.693 5.617 1.00 0.00 C ATOM 721 C LEU A 49 3.845 7.859 4.777 1.00 0.00 C ATOM 722 O LEU A 49 3.637 6.661 4.590 1.00 0.00 O ATOM 723 CB LEU A 49 2.156 9.785 4.823 1.00 0.00 C ATOM 724 CG LEU A 49 0.717 10.086 5.246 1.00 0.00 C ATOM 725 CD1 LEU A 49 0.677 11.177 6.317 1.00 0.00 C ATOM 726 CD2 LEU A 49 -0.149 10.439 4.035 1.00 0.00 C ATOM 0 H LEU A 49 3.338 10.234 6.960 1.00 0.00 H new ATOM 0 HA LEU A 49 2.093 8.018 5.966 1.00 0.00 H new ATOM 0 HB2 LEU A 49 2.736 10.704 4.901 1.00 0.00 H new ATOM 0 HB3 LEU A 49 2.152 9.499 3.771 1.00 0.00 H new ATOM 0 HG LEU A 49 0.296 9.184 5.690 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -0.358 11.372 6.600 1.00 0.00 H new ATOM 0 HD12 LEU A 49 1.237 10.848 7.193 1.00 0.00 H new ATOM 0 HD13 LEU A 49 1.123 12.090 5.923 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -1.167 10.648 4.364 1.00 0.00 H new ATOM 0 HD22 LEU A 49 0.260 11.319 3.539 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -0.158 9.601 3.338 1.00 0.00 H new ATOM 738 N GLU A 50 4.882 8.526 4.293 1.00 0.00 N ATOM 739 CA GLU A 50 5.885 7.861 3.478 1.00 0.00 C ATOM 740 C GLU A 50 6.366 6.582 4.166 1.00 0.00 C ATOM 741 O GLU A 50 6.172 5.483 3.649 1.00 0.00 O ATOM 742 CB GLU A 50 7.057 8.797 3.179 1.00 0.00 C ATOM 743 CG GLU A 50 8.085 8.116 2.273 1.00 0.00 C ATOM 744 CD GLU A 50 8.720 9.122 1.311 1.00 0.00 C ATOM 745 OE1 GLU A 50 8.030 9.489 0.336 1.00 0.00 O ATOM 746 OE2 GLU A 50 9.882 9.502 1.573 1.00 0.00 O ATOM 0 H GLU A 50 5.050 9.520 4.449 1.00 0.00 H new ATOM 0 HA GLU A 50 5.429 7.588 2.526 1.00 0.00 H new ATOM 0 HB2 GLU A 50 6.689 9.704 2.700 1.00 0.00 H new ATOM 0 HB3 GLU A 50 7.533 9.099 4.112 1.00 0.00 H new ATOM 0 HG2 GLU A 50 8.860 7.651 2.882 1.00 0.00 H new ATOM 0 HG3 GLU A 50 7.604 7.319 1.706 1.00 0.00 H new ATOM 753 N ARG A 51 6.986 6.768 5.323 1.00 0.00 N ATOM 754 CA ARG A 51 7.496 5.643 6.087 1.00 0.00 C ATOM 755 C ARG A 51 6.454 4.524 6.146 1.00 0.00 C ATOM 756 O ARG A 51 6.751 3.377 5.817 1.00 0.00 O ATOM 757 CB ARG A 51 7.862 6.066 7.511 1.00 0.00 C ATOM 758 CG ARG A 51 9.335 6.470 7.602 1.00 0.00 C ATOM 759 CD ARG A 51 10.248 5.251 7.461 1.00 0.00 C ATOM 760 NE ARG A 51 11.637 5.615 7.822 1.00 0.00 N ATOM 761 CZ ARG A 51 12.720 4.934 7.421 1.00 0.00 C ATOM 762 NH1 ARG A 51 12.581 3.851 6.645 1.00 0.00 N ATOM 763 NH2 ARG A 51 13.941 5.337 7.797 1.00 0.00 N ATOM 0 H ARG A 51 7.146 7.681 5.749 1.00 0.00 H new ATOM 0 HA ARG A 51 8.393 5.281 5.585 1.00 0.00 H new ATOM 0 HB2 ARG A 51 7.233 6.901 7.819 1.00 0.00 H new ATOM 0 HB3 ARG A 51 7.663 5.245 8.200 1.00 0.00 H new ATOM 0 HG2 ARG A 51 9.566 7.194 6.821 1.00 0.00 H new ATOM 0 HG3 ARG A 51 9.523 6.961 8.557 1.00 0.00 H new ATOM 0 HD2 ARG A 51 9.895 4.446 8.105 1.00 0.00 H new ATOM 0 HD3 ARG A 51 10.215 4.878 6.437 1.00 0.00 H new ATOM 0 HE ARG A 51 11.779 6.435 8.412 1.00 0.00 H new ATOM 0 HH11 ARG A 51 11.651 3.544 6.359 1.00 0.00 H new ATOM 0 HH12 ARG A 51 13.405 3.333 6.340 1.00 0.00 H new ATOM 0 HH21 ARG A 51 14.046 6.162 8.388 1.00 0.00 H new ATOM 0 HH22 ARG A 51 14.765 4.819 7.492 1.00 0.00 H new ATOM 777 N ILE A 52 5.255 4.898 6.568 1.00 0.00 N ATOM 778 CA ILE A 52 4.167 3.940 6.675 1.00 0.00 C ATOM 779 C ILE A 52 4.070 3.139 5.375 1.00 0.00 C ATOM 780 O ILE A 52 4.214 1.917 5.383 1.00 0.00 O ATOM 781 CB ILE A 52 2.866 4.648 7.060 1.00 0.00 C ATOM 782 CG1 ILE A 52 3.003 5.348 8.413 1.00 0.00 C ATOM 783 CG2 ILE A 52 1.685 3.676 7.034 1.00 0.00 C ATOM 784 CD1 ILE A 52 1.895 6.386 8.607 1.00 0.00 C ATOM 0 H ILE A 52 5.013 5.851 6.840 1.00 0.00 H new ATOM 0 HA ILE A 52 4.364 3.227 7.476 1.00 0.00 H new ATOM 0 HB ILE A 52 2.664 5.420 6.317 1.00 0.00 H new ATOM 0 HG12 ILE A 52 2.960 4.610 9.214 1.00 0.00 H new ATOM 0 HG13 ILE A 52 3.977 5.833 8.479 1.00 0.00 H new ATOM 0 HG21 ILE A 52 0.773 4.204 7.311 1.00 0.00 H new ATOM 0 HG22 ILE A 52 1.575 3.264 6.031 1.00 0.00 H new ATOM 0 HG23 ILE A 52 1.865 2.866 7.741 1.00 0.00 H new ATOM 0 HD11 ILE A 52 2.015 6.869 9.577 1.00 0.00 H new ATOM 0 HD12 ILE A 52 1.956 7.135 7.818 1.00 0.00 H new ATOM 0 HD13 ILE A 52 0.924 5.893 8.565 1.00 0.00 H new ATOM 796 N LEU A 53 3.827 3.859 4.290 1.00 0.00 N ATOM 797 CA LEU A 53 3.710 3.230 2.985 1.00 0.00 C ATOM 798 C LEU A 53 4.992 2.453 2.681 1.00 0.00 C ATOM 799 O LEU A 53 4.947 1.252 2.418 1.00 0.00 O ATOM 800 CB LEU A 53 3.352 4.269 1.920 1.00 0.00 C ATOM 801 CG LEU A 53 1.898 4.746 1.910 1.00 0.00 C ATOM 802 CD1 LEU A 53 1.745 6.018 1.074 1.00 0.00 C ATOM 803 CD2 LEU A 53 0.959 3.634 1.440 1.00 0.00 C ATOM 0 H LEU A 53 3.708 4.872 4.287 1.00 0.00 H new ATOM 0 HA LEU A 53 2.892 2.509 2.981 1.00 0.00 H new ATOM 0 HB2 LEU A 53 3.997 5.137 2.056 1.00 0.00 H new ATOM 0 HB3 LEU A 53 3.583 3.851 0.940 1.00 0.00 H new ATOM 0 HG LEU A 53 1.613 4.996 2.932 1.00 0.00 H new ATOM 0 HD11 LEU A 53 0.703 6.336 1.083 1.00 0.00 H new ATOM 0 HD12 LEU A 53 2.369 6.807 1.494 1.00 0.00 H new ATOM 0 HD13 LEU A 53 2.055 5.819 0.048 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -0.068 4.000 1.442 1.00 0.00 H new ATOM 0 HD22 LEU A 53 1.233 3.329 0.430 1.00 0.00 H new ATOM 0 HD23 LEU A 53 1.041 2.780 2.112 1.00 0.00 H new ATOM 815 N THR A 54 6.105 3.171 2.725 1.00 0.00 N ATOM 816 CA THR A 54 7.398 2.564 2.457 1.00 0.00 C ATOM 817 C THR A 54 7.524 1.229 3.195 1.00 0.00 C ATOM 818 O THR A 54 8.087 0.273 2.664 1.00 0.00 O ATOM 819 CB THR A 54 8.482 3.573 2.839 1.00 0.00 C ATOM 820 OG1 THR A 54 9.410 3.510 1.759 1.00 0.00 O ATOM 821 CG2 THR A 54 9.295 3.127 4.056 1.00 0.00 C ATOM 0 H THR A 54 6.138 4.167 2.942 1.00 0.00 H new ATOM 0 HA THR A 54 7.512 2.327 1.399 1.00 0.00 H new ATOM 0 HB THR A 54 8.022 4.540 3.045 1.00 0.00 H new ATOM 0 HG1 THR A 54 10.146 4.135 1.924 1.00 0.00 H new ATOM 0 HG21 THR A 54 10.050 3.879 4.284 1.00 0.00 H new ATOM 0 HG22 THR A 54 8.632 3.007 4.913 1.00 0.00 H new ATOM 0 HG23 THR A 54 9.783 2.177 3.839 1.00 0.00 H new ATOM 829 N LYS A 55 6.989 1.207 4.407 1.00 0.00 N ATOM 830 CA LYS A 55 7.034 0.005 5.222 1.00 0.00 C ATOM 831 C LYS A 55 6.055 -1.027 4.658 1.00 0.00 C ATOM 832 O LYS A 55 6.413 -2.188 4.467 1.00 0.00 O ATOM 833 CB LYS A 55 6.787 0.346 6.693 1.00 0.00 C ATOM 834 CG LYS A 55 7.956 -0.114 7.567 1.00 0.00 C ATOM 835 CD LYS A 55 9.211 0.715 7.285 1.00 0.00 C ATOM 836 CE LYS A 55 10.408 -0.188 6.983 1.00 0.00 C ATOM 837 NZ LYS A 55 11.629 0.623 6.772 1.00 0.00 N ATOM 0 H LYS A 55 6.522 2.002 4.844 1.00 0.00 H new ATOM 0 HA LYS A 55 8.027 -0.443 5.184 1.00 0.00 H new ATOM 0 HB2 LYS A 55 6.648 1.422 6.802 1.00 0.00 H new ATOM 0 HB3 LYS A 55 5.867 -0.130 7.031 1.00 0.00 H new ATOM 0 HG2 LYS A 55 7.685 -0.024 8.619 1.00 0.00 H new ATOM 0 HG3 LYS A 55 8.162 -1.168 7.380 1.00 0.00 H new ATOM 0 HD2 LYS A 55 9.030 1.380 6.440 1.00 0.00 H new ATOM 0 HD3 LYS A 55 9.435 1.346 8.145 1.00 0.00 H new ATOM 0 HE2 LYS A 55 10.564 -0.883 7.808 1.00 0.00 H new ATOM 0 HE3 LYS A 55 10.204 -0.787 6.096 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 12.432 -0.005 6.568 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 11.482 1.269 5.970 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 11.831 1.176 7.629 1.00 0.00 H new ATOM 851 N GLN A 56 4.839 -0.565 4.406 1.00 0.00 N ATOM 852 CA GLN A 56 3.806 -1.433 3.867 1.00 0.00 C ATOM 853 C GLN A 56 4.245 -2.007 2.518 1.00 0.00 C ATOM 854 O GLN A 56 4.132 -3.209 2.285 1.00 0.00 O ATOM 855 CB GLN A 56 2.475 -0.689 3.740 1.00 0.00 C ATOM 856 CG GLN A 56 1.928 -0.304 5.116 1.00 0.00 C ATOM 857 CD GLN A 56 1.984 -1.491 6.079 1.00 0.00 C ATOM 858 OE1 GLN A 56 0.948 -2.319 5.978 1.00 0.00 O flip ATOM 859 NE2 GLN A 56 2.906 -1.645 6.863 1.00 0.00 N flip ATOM 0 H GLN A 56 4.546 0.399 4.565 1.00 0.00 H new ATOM 0 HA GLN A 56 3.657 -2.261 4.560 1.00 0.00 H new ATOM 0 HB2 GLN A 56 2.612 0.208 3.135 1.00 0.00 H new ATOM 0 HB3 GLN A 56 1.752 -1.317 3.220 1.00 0.00 H new ATOM 0 HG2 GLN A 56 2.506 0.526 5.522 1.00 0.00 H new ATOM 0 HG3 GLN A 56 0.899 0.042 5.019 1.00 0.00 H new ATOM 0 HE21 GLN A 56 3.671 -0.971 6.889 1.00 0.00 H new ATOM 0 HE22 GLN A 56 2.912 -2.448 7.492 1.00 0.00 H new ATOM 868 N LEU A 57 4.736 -1.119 1.666 1.00 0.00 N ATOM 869 CA LEU A 57 5.192 -1.522 0.346 1.00 0.00 C ATOM 870 C LEU A 57 6.229 -2.638 0.489 1.00 0.00 C ATOM 871 O LEU A 57 6.053 -3.727 -0.055 1.00 0.00 O ATOM 872 CB LEU A 57 5.697 -0.310 -0.439 1.00 0.00 C ATOM 873 CG LEU A 57 6.440 -0.616 -1.741 1.00 0.00 C ATOM 874 CD1 LEU A 57 7.866 -1.095 -1.460 1.00 0.00 C ATOM 875 CD2 LEU A 57 5.658 -1.616 -2.596 1.00 0.00 C ATOM 0 H LEU A 57 4.828 -0.123 1.864 1.00 0.00 H new ATOM 0 HA LEU A 57 4.365 -1.928 -0.236 1.00 0.00 H new ATOM 0 HB2 LEU A 57 4.844 0.328 -0.672 1.00 0.00 H new ATOM 0 HB3 LEU A 57 6.359 0.266 0.207 1.00 0.00 H new ATOM 0 HG LEU A 57 6.518 0.308 -2.315 1.00 0.00 H new ATOM 0 HD11 LEU A 57 8.372 -1.305 -2.402 1.00 0.00 H new ATOM 0 HD12 LEU A 57 8.411 -0.320 -0.921 1.00 0.00 H new ATOM 0 HD13 LEU A 57 7.833 -2.002 -0.856 1.00 0.00 H new ATOM 0 HD21 LEU A 57 6.208 -1.816 -3.516 1.00 0.00 H new ATOM 0 HD22 LEU A 57 5.528 -2.545 -2.041 1.00 0.00 H new ATOM 0 HD23 LEU A 57 4.681 -1.199 -2.841 1.00 0.00 H new ATOM 887 N PHE A 58 7.288 -2.329 1.223 1.00 0.00 N ATOM 888 CA PHE A 58 8.353 -3.292 1.444 1.00 0.00 C ATOM 889 C PHE A 58 7.785 -4.653 1.851 1.00 0.00 C ATOM 890 O PHE A 58 8.398 -5.688 1.592 1.00 0.00 O ATOM 891 CB PHE A 58 9.216 -2.751 2.585 1.00 0.00 C ATOM 892 CG PHE A 58 10.704 -3.080 2.449 1.00 0.00 C ATOM 893 CD1 PHE A 58 11.170 -4.294 2.846 1.00 0.00 C ATOM 894 CD2 PHE A 58 11.560 -2.159 1.932 1.00 0.00 C ATOM 895 CE1 PHE A 58 12.551 -4.600 2.721 1.00 0.00 C ATOM 896 CE2 PHE A 58 12.941 -2.465 1.807 1.00 0.00 C ATOM 897 CZ PHE A 58 13.408 -3.679 2.204 1.00 0.00 C ATOM 0 H PHE A 58 7.431 -1.425 1.672 1.00 0.00 H new ATOM 0 HA PHE A 58 8.928 -3.427 0.528 1.00 0.00 H new ATOM 0 HB2 PHE A 58 9.097 -1.669 2.635 1.00 0.00 H new ATOM 0 HB3 PHE A 58 8.849 -3.156 3.528 1.00 0.00 H new ATOM 0 HD1 PHE A 58 10.490 -5.026 3.256 1.00 0.00 H new ATOM 0 HD2 PHE A 58 11.190 -1.195 1.616 1.00 0.00 H new ATOM 0 HE1 PHE A 58 12.921 -5.564 3.037 1.00 0.00 H new ATOM 0 HE2 PHE A 58 13.621 -1.733 1.396 1.00 0.00 H new ATOM 0 HZ PHE A 58 14.458 -3.912 2.109 1.00 0.00 H new ATOM 907 N GLU A 59 6.621 -4.608 2.481 1.00 0.00 N ATOM 908 CA GLU A 59 5.964 -5.825 2.927 1.00 0.00 C ATOM 909 C GLU A 59 5.277 -6.520 1.749 1.00 0.00 C ATOM 910 O GLU A 59 5.189 -7.746 1.713 1.00 0.00 O ATOM 911 CB GLU A 59 4.964 -5.530 4.048 1.00 0.00 C ATOM 912 CG GLU A 59 5.615 -5.702 5.422 1.00 0.00 C ATOM 913 CD GLU A 59 5.206 -7.032 6.059 1.00 0.00 C ATOM 914 OE1 GLU A 59 4.006 -7.364 5.958 1.00 0.00 O ATOM 915 OE2 GLU A 59 6.104 -7.685 6.633 1.00 0.00 O ATOM 0 H GLU A 59 6.116 -3.748 2.693 1.00 0.00 H new ATOM 0 HA GLU A 59 6.722 -6.497 3.329 1.00 0.00 H new ATOM 0 HB2 GLU A 59 4.587 -4.513 3.945 1.00 0.00 H new ATOM 0 HB3 GLU A 59 4.107 -6.198 3.961 1.00 0.00 H new ATOM 0 HG2 GLU A 59 6.700 -5.661 5.322 1.00 0.00 H new ATOM 0 HG3 GLU A 59 5.323 -4.878 6.073 1.00 0.00 H new ATOM 922 N ILE A 60 4.809 -5.706 0.815 1.00 0.00 N ATOM 923 CA ILE A 60 4.133 -6.226 -0.362 1.00 0.00 C ATOM 924 C ILE A 60 5.111 -7.082 -1.170 1.00 0.00 C ATOM 925 O ILE A 60 4.780 -8.194 -1.576 1.00 0.00 O ATOM 926 CB ILE A 60 3.503 -5.088 -1.165 1.00 0.00 C ATOM 927 CG1 ILE A 60 2.517 -4.292 -0.308 1.00 0.00 C ATOM 928 CG2 ILE A 60 2.853 -5.615 -2.446 1.00 0.00 C ATOM 929 CD1 ILE A 60 1.781 -3.245 -1.148 1.00 0.00 C ATOM 0 H ILE A 60 4.884 -4.689 0.849 1.00 0.00 H new ATOM 0 HA ILE A 60 3.306 -6.874 -0.071 1.00 0.00 H new ATOM 0 HB ILE A 60 4.296 -4.402 -1.464 1.00 0.00 H new ATOM 0 HG12 ILE A 60 1.796 -4.970 0.148 1.00 0.00 H new ATOM 0 HG13 ILE A 60 3.051 -3.801 0.506 1.00 0.00 H new ATOM 0 HG21 ILE A 60 2.412 -4.785 -2.998 1.00 0.00 H new ATOM 0 HG22 ILE A 60 3.608 -6.102 -3.063 1.00 0.00 H new ATOM 0 HG23 ILE A 60 2.075 -6.334 -2.190 1.00 0.00 H new ATOM 0 HD11 ILE A 60 1.086 -2.693 -0.515 1.00 0.00 H new ATOM 0 HD12 ILE A 60 2.503 -2.554 -1.582 1.00 0.00 H new ATOM 0 HD13 ILE A 60 1.229 -3.741 -1.946 1.00 0.00 H new ATOM 941 N ASP A 61 6.297 -6.529 -1.379 1.00 0.00 N ATOM 942 CA ASP A 61 7.326 -7.227 -2.131 1.00 0.00 C ATOM 943 C ASP A 61 7.870 -8.384 -1.290 1.00 0.00 C ATOM 944 O ASP A 61 8.535 -9.277 -1.813 1.00 0.00 O ATOM 945 CB ASP A 61 8.493 -6.296 -2.464 1.00 0.00 C ATOM 946 CG ASP A 61 9.182 -6.575 -3.801 1.00 0.00 C ATOM 947 OD1 ASP A 61 8.553 -6.272 -4.838 1.00 0.00 O ATOM 948 OD2 ASP A 61 10.322 -7.086 -3.757 1.00 0.00 O ATOM 0 H ASP A 61 6.568 -5.606 -1.041 1.00 0.00 H new ATOM 0 HA ASP A 61 6.879 -7.590 -3.057 1.00 0.00 H new ATOM 0 HB2 ASP A 61 8.129 -5.269 -2.468 1.00 0.00 H new ATOM 0 HB3 ASP A 61 9.234 -6.369 -1.668 1.00 0.00 H new ATOM 953 N SER A 62 7.567 -8.330 -0.001 1.00 0.00 N ATOM 954 CA SER A 62 8.018 -9.363 0.917 1.00 0.00 C ATOM 955 C SER A 62 7.060 -10.555 0.874 1.00 0.00 C ATOM 956 O SER A 62 7.489 -11.704 0.973 1.00 0.00 O ATOM 957 CB SER A 62 8.127 -8.821 2.344 1.00 0.00 C ATOM 958 OG SER A 62 9.402 -9.091 2.921 1.00 0.00 O ATOM 0 H SER A 62 7.015 -7.588 0.429 1.00 0.00 H new ATOM 0 HA SER A 62 9.010 -9.690 0.604 1.00 0.00 H new ATOM 0 HB2 SER A 62 7.952 -7.745 2.338 1.00 0.00 H new ATOM 0 HB3 SER A 62 7.348 -9.267 2.962 1.00 0.00 H new ATOM 0 HG SER A 62 9.433 -8.728 3.831 1.00 0.00 H new ATOM 964 N VAL A 63 5.782 -10.242 0.726 1.00 0.00 N ATOM 965 CA VAL A 63 4.760 -11.273 0.668 1.00 0.00 C ATOM 966 C VAL A 63 5.038 -12.194 -0.521 1.00 0.00 C ATOM 967 O VAL A 63 5.017 -11.754 -1.670 1.00 0.00 O ATOM 968 CB VAL A 63 3.372 -10.633 0.617 1.00 0.00 C ATOM 969 CG1 VAL A 63 2.318 -11.644 0.161 1.00 0.00 C ATOM 970 CG2 VAL A 63 2.998 -10.023 1.970 1.00 0.00 C ATOM 0 H VAL A 63 5.430 -9.288 0.644 1.00 0.00 H new ATOM 0 HA VAL A 63 4.786 -11.887 1.568 1.00 0.00 H new ATOM 0 HB VAL A 63 3.402 -9.827 -0.116 1.00 0.00 H new ATOM 0 HG11 VAL A 63 1.340 -11.163 0.134 1.00 0.00 H new ATOM 0 HG12 VAL A 63 2.571 -12.009 -0.834 1.00 0.00 H new ATOM 0 HG13 VAL A 63 2.291 -12.481 0.859 1.00 0.00 H new ATOM 0 HG21 VAL A 63 2.007 -9.575 1.905 1.00 0.00 H new ATOM 0 HG22 VAL A 63 2.995 -10.802 2.732 1.00 0.00 H new ATOM 0 HG23 VAL A 63 3.726 -9.257 2.237 1.00 0.00 H new ATOM 980 N ASP A 64 5.291 -13.456 -0.206 1.00 0.00 N ATOM 981 CA ASP A 64 5.573 -14.443 -1.234 1.00 0.00 C ATOM 982 C ASP A 64 4.254 -14.981 -1.793 1.00 0.00 C ATOM 983 O ASP A 64 3.322 -15.254 -1.039 1.00 0.00 O ATOM 984 CB ASP A 64 6.361 -15.624 -0.664 1.00 0.00 C ATOM 985 CG ASP A 64 7.069 -16.492 -1.705 1.00 0.00 C ATOM 986 OD1 ASP A 64 7.625 -15.899 -2.655 1.00 0.00 O ATOM 987 OD2 ASP A 64 7.039 -17.729 -1.528 1.00 0.00 O ATOM 0 H ASP A 64 5.307 -13.818 0.748 1.00 0.00 H new ATOM 0 HA ASP A 64 6.162 -13.959 -2.013 1.00 0.00 H new ATOM 0 HB2 ASP A 64 7.105 -15.241 0.035 1.00 0.00 H new ATOM 0 HB3 ASP A 64 5.680 -16.253 -0.091 1.00 0.00 H new ATOM 992 N THR A 65 4.219 -15.118 -3.111 1.00 0.00 N ATOM 993 CA THR A 65 3.030 -15.618 -3.780 1.00 0.00 C ATOM 994 C THR A 65 3.178 -17.110 -4.085 1.00 0.00 C ATOM 995 O THR A 65 2.195 -17.849 -4.076 1.00 0.00 O ATOM 996 CB THR A 65 2.794 -14.763 -5.026 1.00 0.00 C ATOM 997 OG1 THR A 65 3.699 -15.296 -5.989 1.00 0.00 O ATOM 998 CG2 THR A 65 3.256 -13.317 -4.841 1.00 0.00 C ATOM 0 H THR A 65 4.995 -14.891 -3.733 1.00 0.00 H new ATOM 0 HA THR A 65 2.151 -15.535 -3.141 1.00 0.00 H new ATOM 0 HB THR A 65 1.734 -14.775 -5.278 1.00 0.00 H new ATOM 0 HG1 THR A 65 3.976 -14.586 -6.606 1.00 0.00 H new ATOM 0 HG21 THR A 65 3.065 -12.754 -5.755 1.00 0.00 H new ATOM 0 HG22 THR A 65 2.709 -12.863 -4.015 1.00 0.00 H new ATOM 0 HG23 THR A 65 4.324 -13.301 -4.621 1.00 0.00 H new ATOM 1006 N GLU A 66 4.414 -17.508 -4.346 1.00 0.00 N ATOM 1007 CA GLU A 66 4.704 -18.898 -4.654 1.00 0.00 C ATOM 1008 C GLU A 66 3.892 -19.354 -5.868 1.00 0.00 C ATOM 1009 O GLU A 66 3.381 -20.472 -5.894 1.00 0.00 O ATOM 1010 CB GLU A 66 4.430 -19.795 -3.444 1.00 0.00 C ATOM 1011 CG GLU A 66 5.574 -20.789 -3.229 1.00 0.00 C ATOM 1012 CD GLU A 66 5.045 -22.131 -2.719 1.00 0.00 C ATOM 1013 OE1 GLU A 66 4.053 -22.098 -1.960 1.00 0.00 O ATOM 1014 OE2 GLU A 66 5.646 -23.159 -3.099 1.00 0.00 O ATOM 0 H GLU A 66 5.227 -16.892 -4.351 1.00 0.00 H new ATOM 0 HA GLU A 66 5.763 -18.983 -4.897 1.00 0.00 H new ATOM 0 HB2 GLU A 66 4.304 -19.181 -2.552 1.00 0.00 H new ATOM 0 HB3 GLU A 66 3.496 -20.337 -3.592 1.00 0.00 H new ATOM 0 HG2 GLU A 66 6.112 -20.938 -4.165 1.00 0.00 H new ATOM 0 HG3 GLU A 66 6.287 -20.379 -2.513 1.00 0.00 H new ATOM 1021 N GLY A 67 3.800 -18.464 -6.845 1.00 0.00 N ATOM 1022 CA GLY A 67 3.059 -18.760 -8.060 1.00 0.00 C ATOM 1023 C GLY A 67 1.582 -19.012 -7.754 1.00 0.00 C ATOM 1024 O GLY A 67 1.046 -20.068 -8.086 1.00 0.00 O ATOM 0 H GLY A 67 4.226 -17.538 -6.820 1.00 0.00 H new ATOM 0 HA2 GLY A 67 3.153 -17.929 -8.759 1.00 0.00 H new ATOM 0 HA3 GLY A 67 3.488 -19.636 -8.547 1.00 0.00 H new ATOM 1028 N LYS A 68 0.964 -18.023 -7.123 1.00 0.00 N ATOM 1029 CA LYS A 68 -0.441 -18.125 -6.768 1.00 0.00 C ATOM 1030 C LYS A 68 -1.174 -16.868 -7.241 1.00 0.00 C ATOM 1031 O LYS A 68 -1.256 -15.881 -6.512 1.00 0.00 O ATOM 1032 CB LYS A 68 -0.597 -18.401 -5.272 1.00 0.00 C ATOM 1033 CG LYS A 68 0.143 -19.678 -4.869 1.00 0.00 C ATOM 1034 CD LYS A 68 -0.100 -20.012 -3.396 1.00 0.00 C ATOM 1035 CE LYS A 68 0.746 -21.209 -2.958 1.00 0.00 C ATOM 1036 NZ LYS A 68 -0.107 -22.400 -2.754 1.00 0.00 N ATOM 0 H LYS A 68 1.411 -17.148 -6.849 1.00 0.00 H new ATOM 0 HA LYS A 68 -0.901 -18.973 -7.275 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -0.210 -17.557 -4.701 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -1.654 -18.496 -5.025 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -0.190 -20.507 -5.493 1.00 0.00 H new ATOM 0 HG3 LYS A 68 1.211 -19.554 -5.046 1.00 0.00 H new ATOM 0 HD2 LYS A 68 0.141 -19.147 -2.779 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -1.156 -20.232 -3.239 1.00 0.00 H new ATOM 0 HE2 LYS A 68 1.503 -21.422 -3.712 1.00 0.00 H new ATOM 0 HE3 LYS A 68 1.274 -20.970 -2.035 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 0.483 -23.203 -2.457 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -0.814 -22.199 -2.018 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -0.591 -22.637 -3.643 1.00 0.00 H new ATOM 1050 N GLY A 69 -1.688 -16.945 -8.460 1.00 0.00 N ATOM 1051 CA GLY A 69 -2.411 -15.825 -9.039 1.00 0.00 C ATOM 1052 C GLY A 69 -3.288 -15.138 -7.991 1.00 0.00 C ATOM 1053 O GLY A 69 -3.139 -13.943 -7.739 1.00 0.00 O ATOM 0 H GLY A 69 -1.618 -17.765 -9.062 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -1.704 -15.107 -9.454 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -3.031 -16.175 -9.864 1.00 0.00 H new ATOM 1057 N ASP A 70 -4.184 -15.922 -7.409 1.00 0.00 N ATOM 1058 CA ASP A 70 -5.084 -15.403 -6.394 1.00 0.00 C ATOM 1059 C ASP A 70 -4.329 -14.414 -5.504 1.00 0.00 C ATOM 1060 O ASP A 70 -4.886 -13.402 -5.082 1.00 0.00 O ATOM 1061 CB ASP A 70 -5.617 -16.528 -5.503 1.00 0.00 C ATOM 1062 CG ASP A 70 -6.929 -17.158 -5.972 1.00 0.00 C ATOM 1063 OD1 ASP A 70 -7.976 -16.503 -5.775 1.00 0.00 O ATOM 1064 OD2 ASP A 70 -6.857 -18.280 -6.518 1.00 0.00 O ATOM 0 H ASP A 70 -4.306 -16.912 -7.621 1.00 0.00 H new ATOM 0 HA ASP A 70 -5.918 -14.917 -6.901 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -4.859 -17.309 -5.438 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -5.759 -16.137 -4.496 1.00 0.00 H new ATOM 1069 N ILE A 71 -3.071 -14.740 -5.246 1.00 0.00 N ATOM 1070 CA ILE A 71 -2.233 -13.893 -4.415 1.00 0.00 C ATOM 1071 C ILE A 71 -1.479 -12.901 -5.303 1.00 0.00 C ATOM 1072 O ILE A 71 -1.579 -11.690 -5.111 1.00 0.00 O ATOM 1073 CB ILE A 71 -1.320 -14.745 -3.531 1.00 0.00 C ATOM 1074 CG1 ILE A 71 -2.136 -15.574 -2.537 1.00 0.00 C ATOM 1075 CG2 ILE A 71 -0.272 -13.878 -2.829 1.00 0.00 C ATOM 1076 CD1 ILE A 71 -1.245 -16.566 -1.788 1.00 0.00 C ATOM 0 H ILE A 71 -2.612 -15.580 -5.598 1.00 0.00 H new ATOM 0 HA ILE A 71 -2.845 -13.306 -3.729 1.00 0.00 H new ATOM 0 HB ILE A 71 -0.783 -15.446 -4.170 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -2.628 -14.912 -1.824 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -2.921 -16.113 -3.067 1.00 0.00 H new ATOM 0 HG21 ILE A 71 0.364 -14.508 -2.207 1.00 0.00 H new ATOM 0 HG22 ILE A 71 0.339 -13.370 -3.575 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -0.772 -13.138 -2.204 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -1.850 -17.142 -1.088 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -0.773 -17.242 -2.501 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -0.476 -16.022 -1.240 1.00 0.00 H new ATOM 1088 N GLN A 72 -0.739 -13.452 -6.255 1.00 0.00 N ATOM 1089 CA GLN A 72 0.032 -12.630 -7.172 1.00 0.00 C ATOM 1090 C GLN A 72 -0.801 -11.436 -7.644 1.00 0.00 C ATOM 1091 O GLN A 72 -0.316 -10.306 -7.662 1.00 0.00 O ATOM 1092 CB GLN A 72 0.529 -13.455 -8.361 1.00 0.00 C ATOM 1093 CG GLN A 72 2.046 -13.333 -8.517 1.00 0.00 C ATOM 1094 CD GLN A 72 2.416 -12.845 -9.919 1.00 0.00 C ATOM 1095 OE1 GLN A 72 2.020 -13.410 -10.925 1.00 0.00 O ATOM 1096 NE2 GLN A 72 3.196 -11.768 -9.929 1.00 0.00 N ATOM 0 H GLN A 72 -0.657 -14.457 -6.411 1.00 0.00 H new ATOM 0 HA GLN A 72 0.906 -12.251 -6.642 1.00 0.00 H new ATOM 0 HB2 GLN A 72 0.257 -14.501 -8.221 1.00 0.00 H new ATOM 0 HB3 GLN A 72 0.038 -13.117 -9.273 1.00 0.00 H new ATOM 0 HG2 GLN A 72 2.437 -12.640 -7.772 1.00 0.00 H new ATOM 0 HG3 GLN A 72 2.513 -14.300 -8.330 1.00 0.00 H new ATOM 0 HE21 GLN A 72 3.491 -11.344 -9.050 1.00 0.00 H new ATOM 0 HE22 GLN A 72 3.499 -11.366 -10.816 1.00 0.00 H new ATOM 1105 N GLN A 73 -2.039 -11.728 -8.013 1.00 0.00 N ATOM 1106 CA GLN A 73 -2.944 -10.693 -8.483 1.00 0.00 C ATOM 1107 C GLN A 73 -3.128 -9.620 -7.408 1.00 0.00 C ATOM 1108 O GLN A 73 -2.911 -8.437 -7.662 1.00 0.00 O ATOM 1109 CB GLN A 73 -4.290 -11.288 -8.900 1.00 0.00 C ATOM 1110 CG GLN A 73 -4.456 -11.258 -10.421 1.00 0.00 C ATOM 1111 CD GLN A 73 -4.013 -12.583 -11.047 1.00 0.00 C ATOM 1112 OE1 GLN A 73 -4.644 -13.615 -10.888 1.00 0.00 O ATOM 1113 NE2 GLN A 73 -2.897 -12.495 -11.764 1.00 0.00 N ATOM 0 H GLN A 73 -2.437 -12.667 -7.996 1.00 0.00 H new ATOM 0 HA GLN A 73 -2.503 -10.226 -9.363 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -4.364 -12.315 -8.543 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -5.100 -10.729 -8.431 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -5.498 -11.063 -10.673 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -3.869 -10.440 -10.839 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -2.419 -11.599 -11.856 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -2.519 -13.324 -12.222 1.00 0.00 H new ATOM 1122 N ALA A 74 -3.527 -10.073 -6.228 1.00 0.00 N ATOM 1123 CA ALA A 74 -3.743 -9.167 -5.113 1.00 0.00 C ATOM 1124 C ALA A 74 -2.459 -8.380 -4.845 1.00 0.00 C ATOM 1125 O ALA A 74 -2.474 -7.150 -4.823 1.00 0.00 O ATOM 1126 CB ALA A 74 -4.204 -9.963 -3.890 1.00 0.00 C ATOM 0 H ALA A 74 -3.706 -11.055 -6.020 1.00 0.00 H new ATOM 0 HA ALA A 74 -4.528 -8.448 -5.349 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -4.366 -9.283 -3.053 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -5.135 -10.481 -4.122 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -3.440 -10.693 -3.622 1.00 0.00 H new ATOM 1132 N ARG A 75 -1.378 -9.121 -4.648 1.00 0.00 N ATOM 1133 CA ARG A 75 -0.088 -8.507 -4.383 1.00 0.00 C ATOM 1134 C ARG A 75 0.212 -7.429 -5.426 1.00 0.00 C ATOM 1135 O ARG A 75 0.262 -6.244 -5.103 1.00 0.00 O ATOM 1136 CB ARG A 75 1.032 -9.549 -4.400 1.00 0.00 C ATOM 1137 CG ARG A 75 2.191 -9.124 -3.497 1.00 0.00 C ATOM 1138 CD ARG A 75 3.523 -9.661 -4.024 1.00 0.00 C ATOM 1139 NE ARG A 75 4.457 -8.541 -4.277 1.00 0.00 N ATOM 1140 CZ ARG A 75 4.492 -7.835 -5.415 1.00 0.00 C ATOM 1141 NH1 ARG A 75 3.646 -8.128 -6.412 1.00 0.00 N ATOM 1142 NH2 ARG A 75 5.372 -6.835 -5.556 1.00 0.00 N ATOM 0 H ARG A 75 -1.369 -10.141 -4.667 1.00 0.00 H new ATOM 0 HA ARG A 75 -0.134 -8.055 -3.392 1.00 0.00 H new ATOM 0 HB2 ARG A 75 0.643 -10.512 -4.069 1.00 0.00 H new ATOM 0 HB3 ARG A 75 1.392 -9.684 -5.420 1.00 0.00 H new ATOM 0 HG2 ARG A 75 2.231 -8.036 -3.439 1.00 0.00 H new ATOM 0 HG3 ARG A 75 2.022 -9.492 -2.485 1.00 0.00 H new ATOM 0 HD2 ARG A 75 3.958 -10.351 -3.301 1.00 0.00 H new ATOM 0 HD3 ARG A 75 3.359 -10.223 -4.943 1.00 0.00 H new ATOM 0 HE ARG A 75 5.115 -8.291 -3.539 1.00 0.00 H new ATOM 0 HH11 ARG A 75 2.975 -8.889 -6.305 1.00 0.00 H new ATOM 0 HH12 ARG A 75 3.673 -7.590 -7.278 1.00 0.00 H new ATOM 0 HH21 ARG A 75 6.015 -6.611 -4.797 1.00 0.00 H new ATOM 0 HH22 ARG A 75 5.399 -6.297 -6.422 1.00 0.00 H new ATOM 1156 N LYS A 76 0.403 -7.880 -6.658 1.00 0.00 N ATOM 1157 CA LYS A 76 0.696 -6.969 -7.751 1.00 0.00 C ATOM 1158 C LYS A 76 -0.324 -5.828 -7.746 1.00 0.00 C ATOM 1159 O LYS A 76 -0.042 -4.737 -8.238 1.00 0.00 O ATOM 1160 CB LYS A 76 0.764 -7.728 -9.077 1.00 0.00 C ATOM 1161 CG LYS A 76 -0.639 -8.039 -9.603 1.00 0.00 C ATOM 1162 CD LYS A 76 -0.810 -7.538 -11.039 1.00 0.00 C ATOM 1163 CE LYS A 76 -1.433 -8.619 -11.925 1.00 0.00 C ATOM 1164 NZ LYS A 76 -1.639 -8.106 -13.299 1.00 0.00 N ATOM 0 H LYS A 76 0.360 -8.864 -6.923 1.00 0.00 H new ATOM 0 HA LYS A 76 1.679 -6.518 -7.618 1.00 0.00 H new ATOM 0 HB2 LYS A 76 1.309 -7.135 -9.812 1.00 0.00 H new ATOM 0 HB3 LYS A 76 1.319 -8.656 -8.941 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -0.815 -9.114 -9.566 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -1.384 -7.571 -8.960 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -1.441 -6.649 -11.045 1.00 0.00 H new ATOM 0 HD3 LYS A 76 0.159 -7.244 -11.444 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -0.785 -9.495 -11.951 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -2.386 -8.939 -11.503 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -2.062 -8.851 -13.888 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -2.275 -7.284 -13.271 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -0.724 -7.822 -13.704 1.00 0.00 H new ATOM 1178 N ARG A 77 -1.488 -6.120 -7.185 1.00 0.00 N ATOM 1179 CA ARG A 77 -2.551 -5.133 -7.109 1.00 0.00 C ATOM 1180 C ARG A 77 -2.325 -4.199 -5.918 1.00 0.00 C ATOM 1181 O ARG A 77 -2.686 -3.025 -5.968 1.00 0.00 O ATOM 1182 CB ARG A 77 -3.918 -5.805 -6.970 1.00 0.00 C ATOM 1183 CG ARG A 77 -4.608 -5.932 -8.329 1.00 0.00 C ATOM 1184 CD ARG A 77 -5.496 -4.717 -8.609 1.00 0.00 C ATOM 1185 NE ARG A 77 -6.601 -4.661 -7.626 1.00 0.00 N ATOM 1186 CZ ARG A 77 -7.401 -3.600 -7.455 1.00 0.00 C ATOM 1187 NH1 ARG A 77 -7.225 -2.501 -8.201 1.00 0.00 N ATOM 1188 NH2 ARG A 77 -8.378 -3.638 -6.539 1.00 0.00 N ATOM 0 H ARG A 77 -1.718 -7.027 -6.779 1.00 0.00 H new ATOM 0 HA ARG A 77 -2.535 -4.557 -8.034 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -3.798 -6.793 -6.526 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -4.545 -5.225 -6.293 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -3.858 -6.027 -9.114 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -5.210 -6.840 -8.352 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -4.904 -3.803 -8.556 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -5.900 -4.776 -9.620 1.00 0.00 H new ATOM 0 HE ARG A 77 -6.764 -5.481 -7.042 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -6.482 -2.472 -8.899 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -7.834 -1.693 -8.071 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -8.513 -4.475 -5.972 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -8.987 -2.830 -6.409 1.00 0.00 H new ATOM 1202 N ALA A 78 -1.729 -4.757 -4.875 1.00 0.00 N ATOM 1203 CA ALA A 78 -1.451 -3.990 -3.673 1.00 0.00 C ATOM 1204 C ALA A 78 -0.201 -3.137 -3.895 1.00 0.00 C ATOM 1205 O ALA A 78 0.000 -2.133 -3.213 1.00 0.00 O ATOM 1206 CB ALA A 78 -1.305 -4.940 -2.482 1.00 0.00 C ATOM 0 H ALA A 78 -1.431 -5.732 -4.837 1.00 0.00 H new ATOM 0 HA ALA A 78 -2.276 -3.314 -3.451 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -1.096 -4.364 -1.581 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -2.230 -5.501 -2.348 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -0.484 -5.633 -2.668 1.00 0.00 H new ATOM 1212 N ALA A 79 0.607 -3.567 -4.853 1.00 0.00 N ATOM 1213 CA ALA A 79 1.833 -2.856 -5.174 1.00 0.00 C ATOM 1214 C ALA A 79 1.484 -1.517 -5.827 1.00 0.00 C ATOM 1215 O ALA A 79 2.169 -0.519 -5.610 1.00 0.00 O ATOM 1216 CB ALA A 79 2.711 -3.731 -6.071 1.00 0.00 C ATOM 0 H ALA A 79 0.437 -4.399 -5.418 1.00 0.00 H new ATOM 0 HA ALA A 79 2.402 -2.643 -4.269 1.00 0.00 H new ATOM 0 HB1 ALA A 79 3.631 -3.198 -6.312 1.00 0.00 H new ATOM 0 HB2 ALA A 79 2.954 -4.657 -5.550 1.00 0.00 H new ATOM 0 HB3 ALA A 79 2.174 -3.963 -6.991 1.00 0.00 H new ATOM 1222 N GLN A 80 0.418 -1.538 -6.614 1.00 0.00 N ATOM 1223 CA GLN A 80 -0.030 -0.339 -7.300 1.00 0.00 C ATOM 1224 C GLN A 80 -0.833 0.549 -6.347 1.00 0.00 C ATOM 1225 O GLN A 80 -0.729 1.773 -6.397 1.00 0.00 O ATOM 1226 CB GLN A 80 -0.850 -0.691 -8.543 1.00 0.00 C ATOM 1227 CG GLN A 80 0.003 -1.444 -9.566 1.00 0.00 C ATOM 1228 CD GLN A 80 -0.799 -1.741 -10.835 1.00 0.00 C ATOM 1229 OE1 GLN A 80 -1.165 -0.856 -11.591 1.00 0.00 O ATOM 1230 NE2 GLN A 80 -1.050 -3.034 -11.026 1.00 0.00 N ATOM 0 H GLN A 80 -0.148 -2.367 -6.792 1.00 0.00 H new ATOM 0 HA GLN A 80 0.848 0.216 -7.630 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -1.706 -1.302 -8.257 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -1.245 0.220 -8.993 1.00 0.00 H new ATOM 0 HG2 GLN A 80 0.883 -0.852 -9.818 1.00 0.00 H new ATOM 0 HG3 GLN A 80 0.361 -2.377 -9.131 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -0.714 -3.723 -10.354 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -1.578 -3.335 -11.845 1.00 0.00 H new ATOM 1239 N GLU A 81 -1.617 -0.104 -5.501 1.00 0.00 N ATOM 1240 CA GLU A 81 -2.438 0.611 -4.538 1.00 0.00 C ATOM 1241 C GLU A 81 -1.570 1.541 -3.688 1.00 0.00 C ATOM 1242 O GLU A 81 -1.740 2.759 -3.724 1.00 0.00 O ATOM 1243 CB GLU A 81 -3.223 -0.363 -3.658 1.00 0.00 C ATOM 1244 CG GLU A 81 -4.710 -0.354 -4.021 1.00 0.00 C ATOM 1245 CD GLU A 81 -4.938 -0.954 -5.410 1.00 0.00 C ATOM 1246 OE1 GLU A 81 -4.709 -0.215 -6.392 1.00 0.00 O ATOM 1247 OE2 GLU A 81 -5.338 -2.137 -5.458 1.00 0.00 O ATOM 0 H GLU A 81 -1.701 -1.120 -5.462 1.00 0.00 H new ATOM 0 HA GLU A 81 -3.160 1.218 -5.084 1.00 0.00 H new ATOM 0 HB2 GLU A 81 -2.822 -1.370 -3.776 1.00 0.00 H new ATOM 0 HB3 GLU A 81 -3.099 -0.092 -2.609 1.00 0.00 H new ATOM 0 HG2 GLU A 81 -5.273 -0.921 -3.279 1.00 0.00 H new ATOM 0 HG3 GLU A 81 -5.088 0.668 -3.996 1.00 0.00 H new ATOM 1254 N THR A 82 -0.659 0.932 -2.943 1.00 0.00 N ATOM 1255 CA THR A 82 0.235 1.690 -2.085 1.00 0.00 C ATOM 1256 C THR A 82 0.901 2.819 -2.874 1.00 0.00 C ATOM 1257 O THR A 82 0.760 3.991 -2.528 1.00 0.00 O ATOM 1258 CB THR A 82 1.234 0.713 -1.462 1.00 0.00 C ATOM 1259 OG1 THR A 82 0.607 0.302 -0.250 1.00 0.00 O ATOM 1260 CG2 THR A 82 2.519 1.404 -1.002 1.00 0.00 C ATOM 0 H THR A 82 -0.521 -0.078 -2.916 1.00 0.00 H new ATOM 0 HA THR A 82 -0.311 2.178 -1.278 1.00 0.00 H new ATOM 0 HB THR A 82 1.480 -0.066 -2.184 1.00 0.00 H new ATOM 0 HG1 THR A 82 1.036 -0.516 0.079 1.00 0.00 H new ATOM 0 HG21 THR A 82 3.193 0.666 -0.568 1.00 0.00 H new ATOM 0 HG22 THR A 82 3.002 1.879 -1.856 1.00 0.00 H new ATOM 0 HG23 THR A 82 2.278 2.160 -0.254 1.00 0.00 H new ATOM 1268 N GLU A 83 1.612 2.426 -3.921 1.00 0.00 N ATOM 1269 CA GLU A 83 2.301 3.391 -4.762 1.00 0.00 C ATOM 1270 C GLU A 83 1.347 4.516 -5.170 1.00 0.00 C ATOM 1271 O GLU A 83 1.738 5.681 -5.209 1.00 0.00 O ATOM 1272 CB GLU A 83 2.905 2.712 -5.993 1.00 0.00 C ATOM 1273 CG GLU A 83 3.934 1.655 -5.586 1.00 0.00 C ATOM 1274 CD GLU A 83 5.352 2.229 -5.621 1.00 0.00 C ATOM 1275 OE1 GLU A 83 5.501 3.398 -5.203 1.00 0.00 O ATOM 1276 OE2 GLU A 83 6.255 1.487 -6.063 1.00 0.00 O ATOM 0 H GLU A 83 1.726 1.453 -4.206 1.00 0.00 H new ATOM 0 HA GLU A 83 3.120 3.825 -4.188 1.00 0.00 H new ATOM 0 HB2 GLU A 83 2.114 2.247 -6.581 1.00 0.00 H new ATOM 0 HB3 GLU A 83 3.378 3.459 -6.630 1.00 0.00 H new ATOM 0 HG2 GLU A 83 3.710 1.291 -4.583 1.00 0.00 H new ATOM 0 HG3 GLU A 83 3.867 0.799 -6.258 1.00 0.00 H new ATOM 1283 N ARG A 84 0.115 4.127 -5.463 1.00 0.00 N ATOM 1284 CA ARG A 84 -0.897 5.088 -5.865 1.00 0.00 C ATOM 1285 C ARG A 84 -0.926 6.268 -4.892 1.00 0.00 C ATOM 1286 O ARG A 84 -0.701 7.411 -5.289 1.00 0.00 O ATOM 1287 CB ARG A 84 -2.283 4.442 -5.913 1.00 0.00 C ATOM 1288 CG ARG A 84 -3.018 4.814 -7.203 1.00 0.00 C ATOM 1289 CD ARG A 84 -3.804 3.621 -7.750 1.00 0.00 C ATOM 1290 NE ARG A 84 -3.320 3.275 -9.105 1.00 0.00 N ATOM 1291 CZ ARG A 84 -3.809 2.269 -9.843 1.00 0.00 C ATOM 1292 NH1 ARG A 84 -4.798 1.504 -9.362 1.00 0.00 N ATOM 1293 NH2 ARG A 84 -3.308 2.028 -11.062 1.00 0.00 N ATOM 0 H ARG A 84 -0.205 3.159 -5.430 1.00 0.00 H new ATOM 0 HA ARG A 84 -0.639 5.442 -6.863 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -2.185 3.358 -5.845 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -2.868 4.764 -5.051 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -3.697 5.645 -7.012 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -2.300 5.154 -7.949 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -3.691 2.765 -7.085 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -4.867 3.860 -7.784 1.00 0.00 H new ATOM 0 HE ARG A 84 -2.567 3.837 -9.502 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -5.179 1.687 -8.434 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -5.170 0.738 -9.924 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -2.555 2.610 -11.428 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -3.680 1.262 -11.624 1.00 0.00 H new ATOM 1307 N LEU A 85 -1.205 5.951 -3.636 1.00 0.00 N ATOM 1308 CA LEU A 85 -1.266 6.971 -2.603 1.00 0.00 C ATOM 1309 C LEU A 85 0.064 7.726 -2.558 1.00 0.00 C ATOM 1310 O LEU A 85 0.087 8.954 -2.612 1.00 0.00 O ATOM 1311 CB LEU A 85 -1.668 6.352 -1.262 1.00 0.00 C ATOM 1312 CG LEU A 85 -3.166 6.341 -0.951 1.00 0.00 C ATOM 1313 CD1 LEU A 85 -3.752 7.752 -1.025 1.00 0.00 C ATOM 1314 CD2 LEU A 85 -3.908 5.364 -1.864 1.00 0.00 C ATOM 0 H LEU A 85 -1.391 5.002 -3.311 1.00 0.00 H new ATOM 0 HA LEU A 85 -2.040 7.702 -2.835 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -1.304 5.325 -1.235 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -1.156 6.893 -0.466 1.00 0.00 H new ATOM 0 HG LEU A 85 -3.300 5.990 0.072 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -4.818 7.716 -0.800 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -3.250 8.393 -0.301 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -3.607 8.154 -2.028 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -4.971 5.376 -1.622 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -3.769 5.661 -2.904 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -3.514 4.358 -1.718 1.00 0.00 H new ATOM 1326 N LEU A 86 1.140 6.959 -2.458 1.00 0.00 N ATOM 1327 CA LEU A 86 2.471 7.539 -2.405 1.00 0.00 C ATOM 1328 C LEU A 86 2.558 8.696 -3.403 1.00 0.00 C ATOM 1329 O LEU A 86 2.811 9.836 -3.016 1.00 0.00 O ATOM 1330 CB LEU A 86 3.535 6.461 -2.620 1.00 0.00 C ATOM 1331 CG LEU A 86 4.439 6.164 -1.422 1.00 0.00 C ATOM 1332 CD1 LEU A 86 5.326 4.947 -1.693 1.00 0.00 C ATOM 1333 CD2 LEU A 86 5.260 7.396 -1.036 1.00 0.00 C ATOM 0 H LEU A 86 1.117 5.940 -2.412 1.00 0.00 H new ATOM 0 HA LEU A 86 2.666 7.954 -1.416 1.00 0.00 H new ATOM 0 HB2 LEU A 86 3.035 5.537 -2.910 1.00 0.00 H new ATOM 0 HB3 LEU A 86 4.163 6.761 -3.459 1.00 0.00 H new ATOM 0 HG LEU A 86 3.806 5.918 -0.569 1.00 0.00 H new ATOM 0 HD11 LEU A 86 5.959 4.758 -0.826 1.00 0.00 H new ATOM 0 HD12 LEU A 86 4.700 4.075 -1.883 1.00 0.00 H new ATOM 0 HD13 LEU A 86 5.952 5.140 -2.564 1.00 0.00 H new ATOM 0 HD21 LEU A 86 5.894 7.158 -0.182 1.00 0.00 H new ATOM 0 HD22 LEU A 86 5.884 7.696 -1.878 1.00 0.00 H new ATOM 0 HD23 LEU A 86 4.588 8.213 -0.773 1.00 0.00 H new ATOM 1345 N LYS A 87 2.344 8.363 -4.667 1.00 0.00 N ATOM 1346 CA LYS A 87 2.395 9.359 -5.723 1.00 0.00 C ATOM 1347 C LYS A 87 1.740 10.652 -5.230 1.00 0.00 C ATOM 1348 O LYS A 87 2.352 11.718 -5.275 1.00 0.00 O ATOM 1349 CB LYS A 87 1.777 8.809 -7.010 1.00 0.00 C ATOM 1350 CG LYS A 87 2.717 7.808 -7.685 1.00 0.00 C ATOM 1351 CD LYS A 87 3.369 8.419 -8.927 1.00 0.00 C ATOM 1352 CE LYS A 87 2.576 8.074 -10.189 1.00 0.00 C ATOM 1353 NZ LYS A 87 3.324 8.482 -11.399 1.00 0.00 N ATOM 0 H LYS A 87 2.135 7.416 -4.984 1.00 0.00 H new ATOM 0 HA LYS A 87 3.429 9.598 -5.971 1.00 0.00 H new ATOM 0 HB2 LYS A 87 0.827 8.325 -6.784 1.00 0.00 H new ATOM 0 HB3 LYS A 87 1.562 9.630 -7.694 1.00 0.00 H new ATOM 0 HG2 LYS A 87 3.489 7.497 -6.981 1.00 0.00 H new ATOM 0 HG3 LYS A 87 2.161 6.913 -7.965 1.00 0.00 H new ATOM 0 HD2 LYS A 87 3.429 9.502 -8.815 1.00 0.00 H new ATOM 0 HD3 LYS A 87 4.391 8.052 -9.024 1.00 0.00 H new ATOM 0 HE2 LYS A 87 2.379 7.002 -10.220 1.00 0.00 H new ATOM 0 HE3 LYS A 87 1.608 8.575 -10.166 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 2.772 8.241 -12.246 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 3.490 9.508 -11.375 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 4.237 7.984 -11.427 1.00 0.00 H new ATOM 1367 N GLU A 88 0.504 10.514 -4.773 1.00 0.00 N ATOM 1368 CA GLU A 88 -0.240 11.658 -4.272 1.00 0.00 C ATOM 1369 C GLU A 88 0.510 12.312 -3.110 1.00 0.00 C ATOM 1370 O GLU A 88 0.560 13.537 -3.010 1.00 0.00 O ATOM 1371 CB GLU A 88 -1.654 11.251 -3.853 1.00 0.00 C ATOM 1372 CG GLU A 88 -2.493 10.852 -5.069 1.00 0.00 C ATOM 1373 CD GLU A 88 -3.096 12.084 -5.746 1.00 0.00 C ATOM 1374 OE1 GLU A 88 -2.307 12.846 -6.346 1.00 0.00 O ATOM 1375 OE2 GLU A 88 -4.333 12.236 -5.649 1.00 0.00 O ATOM 0 H GLU A 88 -0.001 9.628 -4.739 1.00 0.00 H new ATOM 0 HA GLU A 88 -0.331 12.388 -5.076 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -1.604 10.418 -3.152 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -2.135 12.078 -3.331 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -1.872 10.308 -5.781 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -3.290 10.176 -4.760 1.00 0.00 H new ATOM 1382 N LEU A 89 1.074 11.466 -2.261 1.00 0.00 N ATOM 1383 CA LEU A 89 1.819 11.946 -1.109 1.00 0.00 C ATOM 1384 C LEU A 89 2.727 13.099 -1.540 1.00 0.00 C ATOM 1385 O LEU A 89 3.035 13.984 -0.742 1.00 0.00 O ATOM 1386 CB LEU A 89 2.566 10.793 -0.436 1.00 0.00 C ATOM 1387 CG LEU A 89 3.023 11.041 1.004 1.00 0.00 C ATOM 1388 CD1 LEU A 89 1.906 11.678 1.832 1.00 0.00 C ATOM 1389 CD2 LEU A 89 3.546 9.752 1.642 1.00 0.00 C ATOM 0 H LEU A 89 1.030 10.451 -2.348 1.00 0.00 H new ATOM 0 HA LEU A 89 1.140 12.340 -0.353 1.00 0.00 H new ATOM 0 HB2 LEU A 89 1.922 9.914 -0.446 1.00 0.00 H new ATOM 0 HB3 LEU A 89 3.442 10.553 -1.038 1.00 0.00 H new ATOM 0 HG LEU A 89 3.851 11.749 0.983 1.00 0.00 H new ATOM 0 HD11 LEU A 89 2.257 11.843 2.851 1.00 0.00 H new ATOM 0 HD12 LEU A 89 1.622 12.631 1.387 1.00 0.00 H new ATOM 0 HD13 LEU A 89 1.042 11.014 1.850 1.00 0.00 H new ATOM 0 HD21 LEU A 89 3.864 9.955 2.664 1.00 0.00 H new ATOM 0 HD22 LEU A 89 2.754 9.003 1.651 1.00 0.00 H new ATOM 0 HD23 LEU A 89 4.393 9.378 1.066 1.00 0.00 H new ATOM 1401 N GLU A 90 3.132 13.053 -2.801 1.00 0.00 N ATOM 1402 CA GLU A 90 3.999 14.083 -3.347 1.00 0.00 C ATOM 1403 C GLU A 90 3.169 15.277 -3.826 1.00 0.00 C ATOM 1404 O GLU A 90 3.409 16.410 -3.412 1.00 0.00 O ATOM 1405 CB GLU A 90 4.864 13.528 -4.480 1.00 0.00 C ATOM 1406 CG GLU A 90 5.297 14.641 -5.436 1.00 0.00 C ATOM 1407 CD GLU A 90 6.730 14.418 -5.923 1.00 0.00 C ATOM 1408 OE1 GLU A 90 7.581 14.111 -5.061 1.00 0.00 O ATOM 1409 OE2 GLU A 90 6.942 14.561 -7.147 1.00 0.00 O ATOM 0 H GLU A 90 2.875 12.318 -3.460 1.00 0.00 H new ATOM 0 HA GLU A 90 4.668 14.423 -2.557 1.00 0.00 H new ATOM 0 HB2 GLU A 90 5.744 13.039 -4.064 1.00 0.00 H new ATOM 0 HB3 GLU A 90 4.307 12.769 -5.029 1.00 0.00 H new ATOM 0 HG2 GLU A 90 4.620 14.676 -6.290 1.00 0.00 H new ATOM 0 HG3 GLU A 90 5.226 15.605 -4.933 1.00 0.00 H new ATOM 1416 N GLN A 91 2.210 14.981 -4.691 1.00 0.00 N ATOM 1417 CA GLN A 91 1.343 16.016 -5.230 1.00 0.00 C ATOM 1418 C GLN A 91 0.619 16.744 -4.097 1.00 0.00 C ATOM 1419 O GLN A 91 0.710 17.966 -3.980 1.00 0.00 O ATOM 1420 CB GLN A 91 0.346 15.429 -6.231 1.00 0.00 C ATOM 1421 CG GLN A 91 1.037 15.074 -7.549 1.00 0.00 C ATOM 1422 CD GLN A 91 0.392 13.844 -8.192 1.00 0.00 C ATOM 1423 OE1 GLN A 91 -0.613 13.926 -8.879 1.00 0.00 O ATOM 1424 NE2 GLN A 91 1.024 12.704 -7.931 1.00 0.00 N ATOM 0 H GLN A 91 2.014 14.040 -5.032 1.00 0.00 H new ATOM 0 HA GLN A 91 1.960 16.739 -5.764 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -0.118 14.538 -5.808 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -0.453 16.146 -6.417 1.00 0.00 H new ATOM 0 HG2 GLN A 91 0.978 15.920 -8.234 1.00 0.00 H new ATOM 0 HG3 GLN A 91 2.095 14.882 -7.369 1.00 0.00 H new ATOM 0 HE21 GLN A 91 1.861 12.707 -7.348 1.00 0.00 H new ATOM 0 HE22 GLN A 91 0.672 11.827 -8.314 1.00 0.00 H new ATOM 1433 N ASN A 92 -0.086 15.965 -3.289 1.00 0.00 N ATOM 1434 CA ASN A 92 -0.826 16.521 -2.169 1.00 0.00 C ATOM 1435 C ASN A 92 0.110 17.391 -1.327 1.00 0.00 C ATOM 1436 O ASN A 92 -0.256 18.496 -0.929 1.00 0.00 O ATOM 1437 CB ASN A 92 -1.378 15.413 -1.270 1.00 0.00 C ATOM 1438 CG ASN A 92 -2.906 15.372 -1.328 1.00 0.00 C ATOM 1439 OD1 ASN A 92 -3.596 16.257 -0.849 1.00 0.00 O ATOM 1440 ND2 ASN A 92 -3.396 14.296 -1.939 1.00 0.00 N ATOM 0 H ASN A 92 -0.160 14.953 -3.388 1.00 0.00 H new ATOM 0 HA ASN A 92 -1.654 17.107 -2.569 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -0.973 14.451 -1.582 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -1.054 15.578 -0.243 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -4.405 14.175 -2.028 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -2.763 13.592 -2.318 1.00 0.00 H new ATOM 1447 N ALA A 93 1.298 16.860 -1.082 1.00 0.00 N ATOM 1448 CA ALA A 93 2.289 17.575 -0.294 1.00 0.00 C ATOM 1449 C ALA A 93 2.270 19.055 -0.681 1.00 0.00 C ATOM 1450 O ALA A 93 1.628 19.866 -0.015 1.00 0.00 O ATOM 1451 CB ALA A 93 3.663 16.935 -0.500 1.00 0.00 C ATOM 0 H ALA A 93 1.598 15.943 -1.415 1.00 0.00 H new ATOM 0 HA ALA A 93 2.055 17.510 0.769 1.00 0.00 H new ATOM 0 HB1 ALA A 93 4.406 17.471 0.091 1.00 0.00 H new ATOM 0 HB2 ALA A 93 3.630 15.893 -0.183 1.00 0.00 H new ATOM 0 HB3 ALA A 93 3.933 16.985 -1.555 1.00 0.00 H new ATOM 1457 N SER A 94 2.982 19.362 -1.755 1.00 0.00 N ATOM 1458 CA SER A 94 3.056 20.730 -2.238 1.00 0.00 C ATOM 1459 C SER A 94 3.758 20.769 -3.597 1.00 0.00 C ATOM 1460 O SER A 94 3.347 21.506 -4.492 1.00 0.00 O ATOM 1461 CB SER A 94 3.785 21.629 -1.238 1.00 0.00 C ATOM 1462 OG SER A 94 3.403 22.996 -1.371 1.00 0.00 O ATOM 0 H SER A 94 3.513 18.686 -2.305 1.00 0.00 H new ATOM 0 HA SER A 94 2.040 21.107 -2.351 1.00 0.00 H new ATOM 0 HB2 SER A 94 3.572 21.290 -0.224 1.00 0.00 H new ATOM 0 HB3 SER A 94 4.861 21.537 -1.386 1.00 0.00 H new ATOM 0 HG SER A 94 3.889 23.537 -0.714 1.00 0.00 H new ATOM 1468 N GLY A 95 4.805 19.965 -3.709 1.00 0.00 N ATOM 1469 CA GLY A 95 5.569 19.897 -4.943 1.00 0.00 C ATOM 1470 C GLY A 95 6.197 21.253 -5.274 1.00 0.00 C ATOM 1471 O GLY A 95 5.770 22.282 -4.753 1.00 0.00 O ATOM 0 H GLY A 95 5.142 19.355 -2.965 1.00 0.00 H new ATOM 0 HA2 GLY A 95 6.351 19.143 -4.850 1.00 0.00 H new ATOM 0 HA3 GLY A 95 4.920 19.584 -5.760 1.00 0.00 H new ATOM 1475 N PRO A 96 7.226 21.208 -6.161 1.00 0.00 N ATOM 1476 CA PRO A 96 7.917 22.419 -6.568 1.00 0.00 C ATOM 1477 C PRO A 96 7.067 23.234 -7.544 1.00 0.00 C ATOM 1478 O PRO A 96 6.941 24.449 -7.398 1.00 0.00 O ATOM 1479 CB PRO A 96 9.226 21.941 -7.177 1.00 0.00 C ATOM 1480 CG PRO A 96 9.017 20.473 -7.511 1.00 0.00 C ATOM 1481 CD PRO A 96 7.758 20.006 -6.799 1.00 0.00 C ATOM 0 HA PRO A 96 8.105 23.095 -5.734 1.00 0.00 H new ATOM 0 HB2 PRO A 96 9.473 22.514 -8.071 1.00 0.00 H new ATOM 0 HB3 PRO A 96 10.052 22.069 -6.478 1.00 0.00 H new ATOM 0 HG2 PRO A 96 8.919 20.337 -8.588 1.00 0.00 H new ATOM 0 HG3 PRO A 96 9.876 19.883 -7.192 1.00 0.00 H new ATOM 0 HD2 PRO A 96 7.041 19.580 -7.501 1.00 0.00 H new ATOM 0 HD3 PRO A 96 7.982 19.233 -6.064 1.00 0.00 H new ATOM 1489 N SER A 97 6.505 22.533 -8.518 1.00 0.00 N ATOM 1490 CA SER A 97 5.670 23.177 -9.517 1.00 0.00 C ATOM 1491 C SER A 97 4.193 22.930 -9.203 1.00 0.00 C ATOM 1492 O SER A 97 3.739 21.787 -9.191 1.00 0.00 O ATOM 1493 CB SER A 97 6.004 22.672 -10.922 1.00 0.00 C ATOM 1494 OG SER A 97 7.186 23.276 -11.440 1.00 0.00 O ATOM 0 H SER A 97 6.612 21.526 -8.636 1.00 0.00 H new ATOM 0 HA SER A 97 5.867 24.249 -9.488 1.00 0.00 H new ATOM 0 HB2 SER A 97 6.131 21.590 -10.897 1.00 0.00 H new ATOM 0 HB3 SER A 97 5.168 22.880 -11.590 1.00 0.00 H new ATOM 0 HG SER A 97 7.366 22.926 -12.338 1.00 0.00 H new ATOM 1500 N SER A 98 3.483 24.022 -8.955 1.00 0.00 N ATOM 1501 CA SER A 98 2.067 23.939 -8.641 1.00 0.00 C ATOM 1502 C SER A 98 1.850 23.009 -7.446 1.00 0.00 C ATOM 1503 O SER A 98 2.760 22.286 -7.044 1.00 0.00 O ATOM 1504 CB SER A 98 1.263 23.449 -9.848 1.00 0.00 C ATOM 1505 OG SER A 98 0.688 24.528 -10.579 1.00 0.00 O ATOM 0 H SER A 98 3.863 24.969 -8.965 1.00 0.00 H new ATOM 0 HA SER A 98 1.714 24.938 -8.385 1.00 0.00 H new ATOM 0 HB2 SER A 98 1.912 22.871 -10.506 1.00 0.00 H new ATOM 0 HB3 SER A 98 0.473 22.778 -9.510 1.00 0.00 H new ATOM 0 HG SER A 98 0.185 24.175 -11.342 1.00 0.00 H new ATOM 1511 N GLY A 99 0.639 23.058 -6.911 1.00 0.00 N ATOM 1512 CA GLY A 99 0.290 22.230 -5.769 1.00 0.00 C ATOM 1513 C GLY A 99 -0.714 22.942 -4.861 1.00 0.00 C ATOM 1514 O GLY A 99 -1.889 22.579 -4.825 1.00 0.00 O ATOM 0 H GLY A 99 -0.113 23.659 -7.248 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -0.133 21.287 -6.115 1.00 0.00 H new ATOM 0 HA3 GLY A 99 1.189 21.988 -5.203 1.00 0.00 H new TER 1518 GLY A 99