USER MOD reduce.3.24.130724 H: found=0, std=0, add=889, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 883 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 60 ASN : amide:sc= -12.6! C(o=-20!,f=-17!) USER MOD Set 1.2: A 62 CYS SG : rot -138:sc= -7.36! USER MOD Set 2.1: A 56 MET CE :methyl -152:sc= -1.68 (180deg=-4.67!) USER MOD Set 2.2: A 57 ASN : amide:sc= -2.23 K(o=-5.9,f=-2.7!) USER MOD Set 2.3: A 69 TYR OH : rot -47:sc= -1.95 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 HIS : no HD1:sc= -1.99! C(o=-2!,f=-5.4!) USER MOD Single : A 4 MET CE :methyl -162:sc= -0.0233 (180deg=-0.422) USER MOD Single : A 7 ASN : amide:sc= -8.46! K(o=-8.5!,f=0.23) USER MOD Single : A 8 SER OG : rot -22:sc=-0.00937! USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 ASN : amide:sc= -10! C(o=-10!,f=-3.4!) USER MOD Single : A 15 THR OG1 : rot 73:sc= 1.16 USER MOD Single : A 18 TYR OH : rot 180:sc= 0 USER MOD Single : A 19 HIS : no HD1:sc= -2.28 K(o=-2.3,f=-0.69) USER MOD Single : A 20 HIS : no HD1:sc= 0 X(o=0,f=-0.051) USER MOD Single : A 21 LYS NZ :NH3+ -160:sc= -0.0326 (180deg=-0.574) USER MOD Single : A 25 GLN : amide:sc= -0.97 X(o=-0.97,f=-0.54) USER MOD Single : A 28 LYS NZ :NH3+ -133:sc= -0.258 (180deg=-1.23) USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 159:sc= 0 (180deg=-0.585) USER MOD Single : A 38 SER OG : rot 180:sc= -0.541 USER MOD Single : A 40 HIS : no HD1:sc= -1.34 K(o=-1.3,f=-0.51) USER MOD Single : A 43 GLN : amide:sc= -0.0323 X(o=-0.032,f=0) USER MOD Single : A 44 SER OG : rot 160:sc= -0.636 USER MOD Single : A 47 HIS : no HD1:sc= 0 X(o=0,f=-0.0073) USER MOD Single : A 48 THR OG1 : rot 77:sc= 0.664 USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 SER OG : rot -59:sc= 0.674 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 ASN : amide:sc= -0.314 X(o=-0.31,f=0) USER MOD Single : A 64 THR OG1 : rot 180:sc=-0.00782 USER MOD Single : A 65 ASN : amide:sc= 0 X(o=0,f=-0.29) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 TYR OH : rot -15:sc= -2.17! USER MOD Single : A 77 TYR OH : rot 122:sc= -1.39 USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 79 ASN : amide:sc= 0.583 K(o=0.58,f=-3.2!) USER MOD Single : A 82 SER OG : rot -69:sc= -0.0316! USER MOD Single : A 83 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.014) USER MOD Single : A 84 ASN : amide:sc= -3.17! C(o=-3.2!,f=-3.4!) USER MOD Single : A 85 ASN : amide:sc= -6.25! C(o=-6.2!,f=-4.6!) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 HIS : no HD1:sc= -4.14! C(o=-4.1!,f=-7.4!) USER MOD Single : A 91 LYS NZ :NH3+ -156:sc= -2.09! (180deg=-2.74!) USER MOD Single : A 94 ASN : amide:sc= -1.13 K(o=-1.1,f=-4!) USER MOD Single : A 98 THR OG1 : rot -94:sc= -0.487 USER MOD Single : A 104 THR OG1 : rot 180:sc= -0.39 USER MOD Single : A 105 CYS SG : rot 180:sc= 0 USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 7.368 21.235 -19.502 1.00 0.00 N ATOM 2 CA GLY A 1 7.920 20.027 -20.176 1.00 0.00 C ATOM 3 C GLY A 1 6.830 18.960 -20.313 1.00 0.00 C ATOM 4 O GLY A 1 6.570 18.476 -21.397 1.00 0.00 O ATOM 0 H1 GLY A 1 8.114 21.954 -19.413 1.00 0.00 H new ATOM 0 H2 GLY A 1 6.583 21.619 -20.066 1.00 0.00 H new ATOM 0 H3 GLY A 1 7.021 20.977 -18.556 1.00 0.00 H new ATOM 0 HA2 GLY A 1 8.305 20.294 -21.160 1.00 0.00 H new ATOM 0 HA3 GLY A 1 8.758 19.631 -19.602 1.00 0.00 H new ATOM 10 N SER A 2 6.216 18.616 -19.209 1.00 0.00 N ATOM 11 CA SER A 2 5.145 17.586 -19.258 1.00 0.00 C ATOM 12 C SER A 2 4.031 17.902 -18.263 1.00 0.00 C ATOM 13 O SER A 2 3.278 17.030 -17.876 1.00 0.00 O ATOM 14 CB SER A 2 5.766 16.228 -18.892 1.00 0.00 C ATOM 15 OG SER A 2 6.571 16.509 -17.756 1.00 0.00 O ATOM 0 H SER A 2 6.411 19.002 -18.285 1.00 0.00 H new ATOM 0 HA SER A 2 4.716 17.568 -20.260 1.00 0.00 H new ATOM 0 HB2 SER A 2 4.999 15.488 -18.664 1.00 0.00 H new ATOM 0 HB3 SER A 2 6.361 15.828 -19.713 1.00 0.00 H new ATOM 0 HG SER A 2 7.008 15.686 -17.453 1.00 0.00 H new ATOM 21 N HIS A 3 3.947 19.143 -17.863 1.00 0.00 N ATOM 22 CA HIS A 3 2.887 19.528 -16.894 1.00 0.00 C ATOM 23 C HIS A 3 2.858 18.571 -15.706 1.00 0.00 C ATOM 24 O HIS A 3 3.853 17.961 -15.372 1.00 0.00 O ATOM 25 CB HIS A 3 1.526 19.461 -17.612 1.00 0.00 C ATOM 26 CG HIS A 3 1.643 20.108 -18.995 1.00 0.00 C ATOM 27 ND1 HIS A 3 2.363 19.684 -19.923 1.00 0.00 N ATOM 28 CD2 HIS A 3 1.014 21.231 -19.501 1.00 0.00 C ATOM 29 CE1 HIS A 3 2.260 20.409 -20.960 1.00 0.00 C ATOM 30 NE2 HIS A 3 1.417 21.427 -20.786 1.00 0.00 N ATOM 0 H HIS A 3 4.562 19.899 -18.164 1.00 0.00 H new ATOM 0 HA HIS A 3 3.092 20.534 -16.527 1.00 0.00 H new ATOM 0 HB2 HIS A 3 1.206 18.424 -17.710 1.00 0.00 H new ATOM 0 HB3 HIS A 3 0.767 19.974 -17.022 1.00 0.00 H new ATOM 0 HD2 HIS A 3 0.315 21.853 -18.962 1.00 0.00 H new ATOM 0 HE1 HIS A 3 2.795 20.222 -21.879 1.00 0.00 H new ATOM 0 HE2 HIS A 3 1.146 22.159 -21.442 1.00 0.00 H new ATOM 38 N MET A 4 1.711 18.460 -15.088 1.00 0.00 N ATOM 39 CA MET A 4 1.597 17.551 -13.923 1.00 0.00 C ATOM 40 C MET A 4 2.291 16.203 -14.218 1.00 0.00 C ATOM 41 O MET A 4 2.071 15.614 -15.259 1.00 0.00 O ATOM 42 CB MET A 4 0.101 17.287 -13.673 1.00 0.00 C ATOM 43 CG MET A 4 -0.203 17.473 -12.185 1.00 0.00 C ATOM 44 SD MET A 4 -1.944 17.474 -11.684 1.00 0.00 S ATOM 45 CE MET A 4 -2.410 19.029 -12.483 1.00 0.00 C ATOM 0 H MET A 4 0.858 18.958 -15.341 1.00 0.00 H new ATOM 0 HA MET A 4 2.071 18.010 -13.055 1.00 0.00 H new ATOM 0 HB2 MET A 4 -0.505 17.970 -14.268 1.00 0.00 H new ATOM 0 HB3 MET A 4 -0.159 16.276 -13.986 1.00 0.00 H new ATOM 0 HG2 MET A 4 0.305 16.680 -11.636 1.00 0.00 H new ATOM 0 HG3 MET A 4 0.240 18.416 -11.866 1.00 0.00 H new ATOM 0 HE1 MET A 4 -3.342 19.394 -12.052 1.00 0.00 H new ATOM 0 HE2 MET A 4 -1.624 19.768 -12.327 1.00 0.00 H new ATOM 0 HE3 MET A 4 -2.545 18.863 -13.552 1.00 0.00 H new ATOM 55 N PRO A 5 3.128 15.735 -13.293 1.00 0.00 N ATOM 56 CA PRO A 5 3.833 14.467 -13.477 1.00 0.00 C ATOM 57 C PRO A 5 2.857 13.301 -13.623 1.00 0.00 C ATOM 58 O PRO A 5 1.700 13.495 -13.940 1.00 0.00 O ATOM 59 CB PRO A 5 4.665 14.282 -12.188 1.00 0.00 C ATOM 60 CG PRO A 5 4.367 15.499 -11.264 1.00 0.00 C ATOM 61 CD PRO A 5 3.422 16.436 -12.033 1.00 0.00 C ATOM 0 HA PRO A 5 4.442 14.484 -14.381 1.00 0.00 H new ATOM 0 HB2 PRO A 5 4.401 13.349 -11.691 1.00 0.00 H new ATOM 0 HB3 PRO A 5 5.728 14.229 -12.422 1.00 0.00 H new ATOM 0 HG2 PRO A 5 3.908 15.170 -10.332 1.00 0.00 H new ATOM 0 HG3 PRO A 5 5.290 16.016 -11.000 1.00 0.00 H new ATOM 0 HD2 PRO A 5 2.511 16.628 -11.467 1.00 0.00 H new ATOM 0 HD3 PRO A 5 3.891 17.402 -12.220 1.00 0.00 H new ATOM 69 N ARG A 6 3.349 12.111 -13.382 1.00 0.00 N ATOM 70 CA ARG A 6 2.474 10.913 -13.498 1.00 0.00 C ATOM 71 C ARG A 6 2.030 10.425 -12.124 1.00 0.00 C ATOM 72 O ARG A 6 1.610 11.203 -11.290 1.00 0.00 O ATOM 73 CB ARG A 6 3.278 9.794 -14.179 1.00 0.00 C ATOM 74 CG ARG A 6 3.794 10.295 -15.529 1.00 0.00 C ATOM 75 CD ARG A 6 4.818 9.299 -16.076 1.00 0.00 C ATOM 76 NE ARG A 6 5.816 8.996 -15.011 1.00 0.00 N ATOM 77 CZ ARG A 6 6.949 9.645 -14.990 1.00 0.00 C ATOM 78 NH1 ARG A 6 7.760 9.534 -16.007 1.00 0.00 N ATOM 79 NH2 ARG A 6 7.233 10.383 -13.952 1.00 0.00 N ATOM 0 H ARG A 6 4.314 11.922 -13.112 1.00 0.00 H new ATOM 0 HA ARG A 6 1.589 11.176 -14.077 1.00 0.00 H new ATOM 0 HB2 ARG A 6 4.113 9.493 -13.546 1.00 0.00 H new ATOM 0 HB3 ARG A 6 2.651 8.914 -14.320 1.00 0.00 H new ATOM 0 HG2 ARG A 6 2.967 10.406 -16.230 1.00 0.00 H new ATOM 0 HG3 ARG A 6 4.250 11.279 -15.415 1.00 0.00 H new ATOM 0 HD2 ARG A 6 4.320 8.384 -16.396 1.00 0.00 H new ATOM 0 HD3 ARG A 6 5.316 9.714 -16.952 1.00 0.00 H new ATOM 0 HE ARG A 6 5.616 8.288 -14.305 1.00 0.00 H new ATOM 0 HH11 ARG A 6 7.505 8.947 -16.801 1.00 0.00 H new ATOM 0 HH12 ARG A 6 8.649 10.034 -16.007 1.00 0.00 H new ATOM 0 HH21 ARG A 6 6.575 10.445 -13.175 1.00 0.00 H new ATOM 0 HH22 ARG A 6 8.113 10.897 -13.917 1.00 0.00 H new ATOM 93 N ASN A 7 2.132 9.141 -11.914 1.00 0.00 N ATOM 94 CA ASN A 7 1.722 8.579 -10.604 1.00 0.00 C ATOM 95 C ASN A 7 2.892 8.563 -9.627 1.00 0.00 C ATOM 96 O ASN A 7 4.040 8.588 -10.027 1.00 0.00 O ATOM 97 CB ASN A 7 1.247 7.135 -10.831 1.00 0.00 C ATOM 98 CG ASN A 7 0.401 6.683 -9.637 1.00 0.00 C ATOM 99 OD1 ASN A 7 -0.095 5.575 -9.598 1.00 0.00 O ATOM 100 ND2 ASN A 7 0.212 7.510 -8.645 1.00 0.00 N ATOM 0 H ASN A 7 2.480 8.463 -12.592 1.00 0.00 H new ATOM 0 HA ASN A 7 0.928 9.196 -10.183 1.00 0.00 H new ATOM 0 HB2 ASN A 7 0.662 7.073 -11.749 1.00 0.00 H new ATOM 0 HB3 ASN A 7 2.105 6.474 -10.954 1.00 0.00 H new ATOM 0 HD21 ASN A 7 -0.350 7.224 -7.843 1.00 0.00 H new ATOM 0 HD22 ASN A 7 0.626 8.442 -8.672 1.00 0.00 H new ATOM 107 N SER A 8 2.577 8.518 -8.362 1.00 0.00 N ATOM 108 CA SER A 8 3.652 8.499 -7.341 1.00 0.00 C ATOM 109 C SER A 8 3.174 7.802 -6.075 1.00 0.00 C ATOM 110 O SER A 8 3.935 7.594 -5.151 1.00 0.00 O ATOM 111 CB SER A 8 4.018 9.951 -6.997 1.00 0.00 C ATOM 112 OG SER A 8 4.377 10.523 -8.245 1.00 0.00 O ATOM 0 H SER A 8 1.625 8.494 -7.996 1.00 0.00 H new ATOM 0 HA SER A 8 4.514 7.961 -7.736 1.00 0.00 H new ATOM 0 HB2 SER A 8 3.178 10.477 -6.544 1.00 0.00 H new ATOM 0 HB3 SER A 8 4.843 9.996 -6.286 1.00 0.00 H new ATOM 0 HG SER A 8 4.632 9.812 -8.870 1.00 0.00 H new ATOM 118 N LYS A 9 1.915 7.453 -6.056 1.00 0.00 N ATOM 119 CA LYS A 9 1.367 6.769 -4.860 1.00 0.00 C ATOM 120 C LYS A 9 1.460 5.256 -5.008 1.00 0.00 C ATOM 121 O LYS A 9 1.236 4.523 -4.066 1.00 0.00 O ATOM 122 CB LYS A 9 -0.112 7.163 -4.712 1.00 0.00 C ATOM 123 CG LYS A 9 -0.213 8.686 -4.616 1.00 0.00 C ATOM 124 CD LYS A 9 -1.615 9.125 -5.049 1.00 0.00 C ATOM 125 CE LYS A 9 -1.615 10.635 -5.318 1.00 0.00 C ATOM 126 NZ LYS A 9 -2.600 10.972 -6.383 1.00 0.00 N ATOM 0 H LYS A 9 1.251 7.613 -6.813 1.00 0.00 H new ATOM 0 HA LYS A 9 1.943 7.068 -3.984 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -0.686 6.800 -5.565 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -0.538 6.700 -3.822 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -0.016 9.012 -3.595 1.00 0.00 H new ATOM 0 HG3 LYS A 9 0.540 9.153 -5.251 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -1.917 8.585 -5.946 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -2.340 8.883 -4.272 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -1.860 11.174 -4.403 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -0.618 10.957 -5.620 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -2.589 11.998 -6.554 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -2.348 10.472 -7.259 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -3.552 10.682 -6.080 1.00 0.00 H new ATOM 140 N ASN A 10 1.790 4.813 -6.191 1.00 0.00 N ATOM 141 CA ASN A 10 1.902 3.351 -6.411 1.00 0.00 C ATOM 142 C ASN A 10 2.762 2.711 -5.331 1.00 0.00 C ATOM 143 O ASN A 10 2.687 1.522 -5.095 1.00 0.00 O ATOM 144 CB ASN A 10 2.567 3.117 -7.773 1.00 0.00 C ATOM 145 CG ASN A 10 3.989 3.681 -7.742 1.00 0.00 C ATOM 146 OD1 ASN A 10 4.889 3.157 -8.366 1.00 0.00 O ATOM 147 ND2 ASN A 10 4.233 4.744 -7.027 1.00 0.00 N ATOM 0 H ASN A 10 1.984 5.397 -7.004 1.00 0.00 H new ATOM 0 HA ASN A 10 0.907 2.906 -6.379 1.00 0.00 H new ATOM 0 HB2 ASN A 10 2.590 2.051 -8.001 1.00 0.00 H new ATOM 0 HB3 ASN A 10 1.989 3.599 -8.561 1.00 0.00 H new ATOM 0 HD21 ASN A 10 5.176 5.131 -6.994 1.00 0.00 H new ATOM 0 HD22 ASN A 10 3.481 5.188 -6.501 1.00 0.00 H new ATOM 154 N ASP A 11 3.568 3.516 -4.694 1.00 0.00 N ATOM 155 CA ASP A 11 4.442 2.978 -3.625 1.00 0.00 C ATOM 156 C ASP A 11 3.622 2.275 -2.554 1.00 0.00 C ATOM 157 O ASP A 11 4.165 1.623 -1.682 1.00 0.00 O ATOM 158 CB ASP A 11 5.196 4.152 -2.978 1.00 0.00 C ATOM 159 CG ASP A 11 5.960 4.920 -4.058 1.00 0.00 C ATOM 160 OD1 ASP A 11 5.311 5.287 -5.023 1.00 0.00 O ATOM 161 OD2 ASP A 11 7.149 5.099 -3.855 1.00 0.00 O ATOM 0 H ASP A 11 3.656 4.517 -4.869 1.00 0.00 H new ATOM 0 HA ASP A 11 5.134 2.258 -4.062 1.00 0.00 H new ATOM 0 HB2 ASP A 11 4.494 4.815 -2.472 1.00 0.00 H new ATOM 0 HB3 ASP A 11 5.887 3.782 -2.221 1.00 0.00 H new ATOM 166 N GLY A 12 2.326 2.416 -2.632 1.00 0.00 N ATOM 167 CA GLY A 12 1.464 1.759 -1.623 1.00 0.00 C ATOM 168 C GLY A 12 1.291 0.289 -1.970 1.00 0.00 C ATOM 169 O GLY A 12 1.118 -0.541 -1.101 1.00 0.00 O ATOM 0 H GLY A 12 1.835 2.954 -3.346 1.00 0.00 H new ATOM 0 HA2 GLY A 12 1.908 1.858 -0.632 1.00 0.00 H new ATOM 0 HA3 GLY A 12 0.492 2.250 -1.587 1.00 0.00 H new ATOM 173 N VAL A 13 1.344 -0.010 -3.241 1.00 0.00 N ATOM 174 CA VAL A 13 1.184 -1.417 -3.649 1.00 0.00 C ATOM 175 C VAL A 13 1.938 -1.731 -4.931 1.00 0.00 C ATOM 176 O VAL A 13 1.662 -1.181 -5.976 1.00 0.00 O ATOM 177 CB VAL A 13 -0.314 -1.699 -3.868 1.00 0.00 C ATOM 178 CG1 VAL A 13 -0.807 -1.001 -5.147 1.00 0.00 C ATOM 179 CG2 VAL A 13 -0.515 -3.211 -4.018 1.00 0.00 C ATOM 0 H VAL A 13 1.490 0.657 -3.999 1.00 0.00 H new ATOM 0 HA VAL A 13 1.594 -2.047 -2.859 1.00 0.00 H new ATOM 0 HB VAL A 13 -0.878 -1.320 -3.016 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -1.867 -1.209 -5.289 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -0.657 0.075 -5.055 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -0.246 -1.373 -6.004 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -1.573 -3.424 -4.174 1.00 0.00 H new ATOM 0 HG22 VAL A 13 0.057 -3.571 -4.873 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -0.173 -3.715 -3.114 1.00 0.00 H new ATOM 189 N ASP A 14 2.896 -2.606 -4.821 1.00 0.00 N ATOM 190 CA ASP A 14 3.672 -2.973 -6.014 1.00 0.00 C ATOM 191 C ASP A 14 2.962 -4.136 -6.663 1.00 0.00 C ATOM 192 O ASP A 14 2.567 -5.062 -5.981 1.00 0.00 O ATOM 193 CB ASP A 14 5.086 -3.402 -5.580 1.00 0.00 C ATOM 194 CG ASP A 14 5.715 -4.273 -6.671 1.00 0.00 C ATOM 195 OD1 ASP A 14 5.884 -3.745 -7.758 1.00 0.00 O ATOM 196 OD2 ASP A 14 5.996 -5.418 -6.355 1.00 0.00 O ATOM 0 H ASP A 14 3.167 -3.076 -3.957 1.00 0.00 H new ATOM 0 HA ASP A 14 3.756 -2.137 -6.708 1.00 0.00 H new ATOM 0 HB2 ASP A 14 5.705 -2.523 -5.400 1.00 0.00 H new ATOM 0 HB3 ASP A 14 5.038 -3.955 -4.642 1.00 0.00 H new ATOM 201 N THR A 15 2.801 -4.091 -7.951 1.00 0.00 N ATOM 202 CA THR A 15 2.105 -5.207 -8.612 1.00 0.00 C ATOM 203 C THR A 15 2.655 -5.474 -10.004 1.00 0.00 C ATOM 204 O THR A 15 2.192 -4.917 -10.983 1.00 0.00 O ATOM 205 CB THR A 15 0.622 -4.831 -8.705 1.00 0.00 C ATOM 206 OG1 THR A 15 0.554 -3.775 -9.641 1.00 0.00 O ATOM 207 CG2 THR A 15 0.144 -4.199 -7.382 1.00 0.00 C ATOM 0 H THR A 15 3.118 -3.339 -8.563 1.00 0.00 H new ATOM 0 HA THR A 15 2.251 -6.118 -8.032 1.00 0.00 H new ATOM 0 HB THR A 15 0.032 -5.714 -8.953 1.00 0.00 H new ATOM 0 HG1 THR A 15 0.699 -4.128 -10.544 1.00 0.00 H new ATOM 0 HG21 THR A 15 -0.911 -3.937 -7.464 1.00 0.00 H new ATOM 0 HG22 THR A 15 0.279 -4.912 -6.569 1.00 0.00 H new ATOM 0 HG23 THR A 15 0.726 -3.300 -7.177 1.00 0.00 H new ATOM 215 N ALA A 16 3.641 -6.326 -10.056 1.00 0.00 N ATOM 216 CA ALA A 16 4.265 -6.673 -11.356 1.00 0.00 C ATOM 217 C ALA A 16 3.938 -8.120 -11.711 1.00 0.00 C ATOM 218 O ALA A 16 4.668 -9.026 -11.360 1.00 0.00 O ATOM 219 CB ALA A 16 5.784 -6.523 -11.211 1.00 0.00 C ATOM 0 H ALA A 16 4.042 -6.798 -9.246 1.00 0.00 H new ATOM 0 HA ALA A 16 3.887 -6.018 -12.141 1.00 0.00 H new ATOM 0 HB1 ALA A 16 6.266 -6.773 -12.156 1.00 0.00 H new ATOM 0 HB2 ALA A 16 6.024 -5.494 -10.942 1.00 0.00 H new ATOM 0 HB3 ALA A 16 6.143 -7.195 -10.431 1.00 0.00 H new ATOM 225 N ILE A 17 2.844 -8.306 -12.405 1.00 0.00 N ATOM 226 CA ILE A 17 2.438 -9.686 -12.797 1.00 0.00 C ATOM 227 C ILE A 17 1.908 -9.711 -14.225 1.00 0.00 C ATOM 228 O ILE A 17 2.529 -10.232 -15.131 1.00 0.00 O ATOM 229 CB ILE A 17 1.266 -10.132 -11.861 1.00 0.00 C ATOM 230 CG1 ILE A 17 1.179 -9.230 -10.636 1.00 0.00 C ATOM 231 CG2 ILE A 17 1.480 -11.588 -11.383 1.00 0.00 C ATOM 232 CD1 ILE A 17 2.340 -9.540 -9.677 1.00 0.00 C ATOM 0 H ILE A 17 2.217 -7.563 -12.715 1.00 0.00 H new ATOM 0 HA ILE A 17 3.305 -10.342 -12.717 1.00 0.00 H new ATOM 0 HB ILE A 17 0.342 -10.061 -12.434 1.00 0.00 H new ATOM 0 HG12 ILE A 17 1.216 -8.184 -10.940 1.00 0.00 H new ATOM 0 HG13 ILE A 17 0.226 -9.381 -10.129 1.00 0.00 H new ATOM 0 HG21 ILE A 17 0.656 -11.882 -10.733 1.00 0.00 H new ATOM 0 HG22 ILE A 17 1.517 -12.253 -12.246 1.00 0.00 H new ATOM 0 HG23 ILE A 17 2.418 -11.656 -10.833 1.00 0.00 H new ATOM 0 HD11 ILE A 17 2.273 -8.892 -8.803 1.00 0.00 H new ATOM 0 HD12 ILE A 17 2.283 -10.582 -9.362 1.00 0.00 H new ATOM 0 HD13 ILE A 17 3.288 -9.366 -10.186 1.00 0.00 H new ATOM 244 N TYR A 18 0.766 -9.134 -14.375 1.00 0.00 N ATOM 245 CA TYR A 18 0.101 -9.068 -15.688 1.00 0.00 C ATOM 246 C TYR A 18 0.575 -7.882 -16.528 1.00 0.00 C ATOM 247 O TYR A 18 0.137 -7.710 -17.647 1.00 0.00 O ATOM 248 CB TYR A 18 -1.386 -8.918 -15.410 1.00 0.00 C ATOM 249 CG TYR A 18 -1.966 -10.280 -15.043 1.00 0.00 C ATOM 250 CD1 TYR A 18 -2.257 -11.206 -16.021 1.00 0.00 C ATOM 251 CD2 TYR A 18 -2.201 -10.603 -13.724 1.00 0.00 C ATOM 252 CE1 TYR A 18 -2.777 -12.437 -15.684 1.00 0.00 C ATOM 253 CE2 TYR A 18 -2.722 -11.833 -13.386 1.00 0.00 C ATOM 254 CZ TYR A 18 -3.013 -12.761 -14.363 1.00 0.00 C ATOM 255 OH TYR A 18 -3.535 -13.992 -14.026 1.00 0.00 O ATOM 0 H TYR A 18 0.248 -8.690 -13.617 1.00 0.00 H new ATOM 0 HA TYR A 18 0.336 -9.968 -16.257 1.00 0.00 H new ATOM 0 HB2 TYR A 18 -1.547 -8.210 -14.597 1.00 0.00 H new ATOM 0 HB3 TYR A 18 -1.894 -8.517 -16.287 1.00 0.00 H new ATOM 0 HD1 TYR A 18 -2.076 -10.966 -17.058 1.00 0.00 H new ATOM 0 HD2 TYR A 18 -1.975 -9.886 -12.949 1.00 0.00 H new ATOM 0 HE1 TYR A 18 -3.002 -13.154 -16.460 1.00 0.00 H new ATOM 0 HE2 TYR A 18 -2.904 -12.072 -12.348 1.00 0.00 H new ATOM 0 HH TYR A 18 -3.635 -14.050 -13.053 1.00 0.00 H new ATOM 265 N HIS A 19 1.412 -7.058 -15.944 1.00 0.00 N ATOM 266 CA HIS A 19 1.934 -5.859 -16.681 1.00 0.00 C ATOM 267 C HIS A 19 2.254 -6.149 -18.154 1.00 0.00 C ATOM 268 O HIS A 19 2.509 -5.236 -18.915 1.00 0.00 O ATOM 269 CB HIS A 19 3.227 -5.402 -15.990 1.00 0.00 C ATOM 270 CG HIS A 19 4.310 -6.459 -16.196 1.00 0.00 C ATOM 271 ND1 HIS A 19 5.537 -6.230 -16.205 1.00 0.00 N ATOM 272 CD2 HIS A 19 4.185 -7.820 -16.389 1.00 0.00 C ATOM 273 CE1 HIS A 19 6.205 -7.293 -16.383 1.00 0.00 C ATOM 274 NE2 HIS A 19 5.425 -8.368 -16.513 1.00 0.00 N ATOM 0 H HIS A 19 1.757 -7.162 -14.990 1.00 0.00 H new ATOM 0 HA HIS A 19 1.156 -5.095 -16.660 1.00 0.00 H new ATOM 0 HB2 HIS A 19 3.553 -4.446 -16.399 1.00 0.00 H new ATOM 0 HB3 HIS A 19 3.050 -5.249 -14.925 1.00 0.00 H new ATOM 0 HD2 HIS A 19 3.253 -8.363 -16.434 1.00 0.00 H new ATOM 0 HE1 HIS A 19 7.284 -7.325 -16.425 1.00 0.00 H new ATOM 0 HE2 HIS A 19 5.688 -9.342 -16.665 1.00 0.00 H new ATOM 282 N HIS A 20 2.237 -7.392 -18.536 1.00 0.00 N ATOM 283 CA HIS A 20 2.542 -7.709 -19.952 1.00 0.00 C ATOM 284 C HIS A 20 1.794 -6.773 -20.915 1.00 0.00 C ATOM 285 O HIS A 20 2.383 -5.872 -21.479 1.00 0.00 O ATOM 286 CB HIS A 20 2.076 -9.150 -20.217 1.00 0.00 C ATOM 287 CG HIS A 20 3.280 -10.094 -20.148 1.00 0.00 C ATOM 288 ND1 HIS A 20 4.211 -10.127 -20.981 1.00 0.00 N ATOM 289 CD2 HIS A 20 3.589 -11.062 -19.211 1.00 0.00 C ATOM 290 CE1 HIS A 20 5.074 -11.007 -20.678 1.00 0.00 C ATOM 291 NE2 HIS A 20 4.762 -11.660 -19.558 1.00 0.00 N ATOM 0 H HIS A 20 2.028 -8.191 -17.938 1.00 0.00 H new ATOM 0 HA HIS A 20 3.612 -7.586 -20.120 1.00 0.00 H new ATOM 0 HB2 HIS A 20 1.327 -9.443 -19.481 1.00 0.00 H new ATOM 0 HB3 HIS A 20 1.603 -9.217 -21.197 1.00 0.00 H new ATOM 0 HD2 HIS A 20 2.995 -11.305 -18.342 1.00 0.00 H new ATOM 0 HE1 HIS A 20 5.961 -11.205 -21.262 1.00 0.00 H new ATOM 0 HE2 HIS A 20 5.268 -12.409 -19.086 1.00 0.00 H new ATOM 299 N LYS A 21 0.506 -7.003 -21.084 1.00 0.00 N ATOM 300 CA LYS A 21 -0.283 -6.127 -22.008 1.00 0.00 C ATOM 301 C LYS A 21 -1.082 -5.073 -21.239 1.00 0.00 C ATOM 302 O LYS A 21 -0.742 -3.906 -21.227 1.00 0.00 O ATOM 303 CB LYS A 21 -1.275 -7.019 -22.780 1.00 0.00 C ATOM 304 CG LYS A 21 -0.507 -8.149 -23.464 1.00 0.00 C ATOM 305 CD LYS A 21 -0.213 -7.754 -24.911 1.00 0.00 C ATOM 306 CE LYS A 21 0.287 -8.983 -25.671 1.00 0.00 C ATOM 307 NZ LYS A 21 1.341 -9.685 -24.885 1.00 0.00 N ATOM 0 H LYS A 21 -0.022 -7.748 -20.628 1.00 0.00 H new ATOM 0 HA LYS A 21 0.408 -5.614 -22.677 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -2.020 -7.430 -22.098 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -1.813 -6.428 -23.521 1.00 0.00 H new ATOM 0 HG2 LYS A 21 0.424 -8.346 -22.932 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -1.090 -9.069 -23.437 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -1.112 -7.359 -25.384 1.00 0.00 H new ATOM 0 HD3 LYS A 21 0.536 -6.963 -24.940 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -0.544 -9.662 -25.865 1.00 0.00 H new ATOM 0 HE3 LYS A 21 0.686 -8.682 -26.640 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 1.902 -10.290 -25.519 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 1.964 -8.984 -24.435 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 0.894 -10.272 -24.152 1.00 0.00 H new ATOM 321 N LEU A 22 -2.136 -5.527 -20.611 1.00 0.00 N ATOM 322 CA LEU A 22 -3.006 -4.610 -19.823 1.00 0.00 C ATOM 323 C LEU A 22 -3.685 -5.384 -18.707 1.00 0.00 C ATOM 324 O LEU A 22 -4.293 -4.815 -17.823 1.00 0.00 O ATOM 325 CB LEU A 22 -4.088 -4.037 -20.759 1.00 0.00 C ATOM 326 CG LEU A 22 -5.101 -5.138 -21.092 1.00 0.00 C ATOM 327 CD1 LEU A 22 -6.125 -4.595 -22.084 1.00 0.00 C ATOM 328 CD2 LEU A 22 -4.370 -6.313 -21.730 1.00 0.00 C ATOM 0 H LEU A 22 -2.432 -6.503 -20.612 1.00 0.00 H new ATOM 0 HA LEU A 22 -2.404 -3.808 -19.396 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -4.591 -3.196 -20.281 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -3.631 -3.658 -21.673 1.00 0.00 H new ATOM 0 HG LEU A 22 -5.603 -5.462 -20.181 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -6.848 -5.375 -22.324 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -6.643 -3.743 -21.643 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -5.617 -4.278 -22.995 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -5.085 -7.100 -21.969 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -3.876 -5.982 -22.643 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -3.625 -6.699 -21.034 1.00 0.00 H new ATOM 340 N ARG A 23 -3.563 -6.678 -18.769 1.00 0.00 N ATOM 341 CA ARG A 23 -4.185 -7.514 -17.739 1.00 0.00 C ATOM 342 C ARG A 23 -3.788 -7.011 -16.375 1.00 0.00 C ATOM 343 O ARG A 23 -4.312 -7.442 -15.369 1.00 0.00 O ATOM 344 CB ARG A 23 -3.686 -8.955 -17.919 1.00 0.00 C ATOM 345 CG ARG A 23 -4.578 -9.671 -18.939 1.00 0.00 C ATOM 346 CD ARG A 23 -3.932 -11.005 -19.318 1.00 0.00 C ATOM 347 NE ARG A 23 -4.802 -11.708 -20.307 1.00 0.00 N ATOM 348 CZ ARG A 23 -5.545 -12.707 -19.913 1.00 0.00 C ATOM 349 NH1 ARG A 23 -4.986 -13.871 -19.714 1.00 0.00 N ATOM 350 NH2 ARG A 23 -6.823 -12.512 -19.731 1.00 0.00 N ATOM 0 H ARG A 23 -3.056 -7.184 -19.495 1.00 0.00 H new ATOM 0 HA ARG A 23 -5.271 -7.477 -17.830 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -2.651 -8.955 -18.260 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -3.707 -9.482 -16.965 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -5.570 -9.839 -18.519 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -4.708 -9.051 -19.826 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -2.942 -10.836 -19.742 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -3.797 -11.623 -18.430 1.00 0.00 H new ATOM 0 HE ARG A 23 -4.816 -11.410 -21.283 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -3.984 -13.988 -19.866 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -5.551 -14.662 -19.406 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -7.227 -11.590 -19.896 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -7.418 -13.282 -19.423 1.00 0.00 H new ATOM 364 N ASP A 24 -2.856 -6.102 -16.366 1.00 0.00 N ATOM 365 CA ASP A 24 -2.404 -5.553 -15.085 1.00 0.00 C ATOM 366 C ASP A 24 -3.246 -4.373 -14.679 1.00 0.00 C ATOM 367 O ASP A 24 -3.777 -4.335 -13.588 1.00 0.00 O ATOM 368 CB ASP A 24 -0.961 -5.090 -15.234 1.00 0.00 C ATOM 369 CG ASP A 24 -0.576 -4.238 -14.024 1.00 0.00 C ATOM 370 OD1 ASP A 24 -1.144 -4.500 -12.976 1.00 0.00 O ATOM 371 OD2 ASP A 24 0.265 -3.375 -14.213 1.00 0.00 O ATOM 0 H ASP A 24 -2.396 -5.724 -17.194 1.00 0.00 H new ATOM 0 HA ASP A 24 -2.491 -6.327 -14.323 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -0.297 -5.951 -15.313 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -0.845 -4.513 -16.151 1.00 0.00 H new ATOM 376 N GLN A 25 -3.366 -3.421 -15.559 1.00 0.00 N ATOM 377 CA GLN A 25 -4.174 -2.253 -15.212 1.00 0.00 C ATOM 378 C GLN A 25 -5.517 -2.726 -14.765 1.00 0.00 C ATOM 379 O GLN A 25 -6.246 -2.011 -14.118 1.00 0.00 O ATOM 380 CB GLN A 25 -4.301 -1.330 -16.452 1.00 0.00 C ATOM 381 CG GLN A 25 -5.497 -1.746 -17.320 1.00 0.00 C ATOM 382 CD GLN A 25 -5.622 -0.766 -18.485 1.00 0.00 C ATOM 383 OE1 GLN A 25 -5.946 -1.139 -19.594 1.00 0.00 O ATOM 384 NE2 GLN A 25 -5.373 0.497 -18.272 1.00 0.00 N ATOM 0 H GLN A 25 -2.942 -3.412 -16.487 1.00 0.00 H new ATOM 0 HA GLN A 25 -3.706 -1.685 -14.408 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -4.422 -0.296 -16.130 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -3.385 -1.376 -17.041 1.00 0.00 H new ATOM 0 HG2 GLN A 25 -5.358 -2.761 -17.693 1.00 0.00 H new ATOM 0 HG3 GLN A 25 -6.412 -1.747 -16.727 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -5.101 0.813 -17.341 1.00 0.00 H new ATOM 0 HE22 GLN A 25 -5.451 1.168 -19.036 1.00 0.00 H new ATOM 393 N VAL A 26 -5.825 -3.944 -15.118 1.00 0.00 N ATOM 394 CA VAL A 26 -7.121 -4.492 -14.720 1.00 0.00 C ATOM 395 C VAL A 26 -7.022 -5.027 -13.314 1.00 0.00 C ATOM 396 O VAL A 26 -7.737 -4.605 -12.439 1.00 0.00 O ATOM 397 CB VAL A 26 -7.500 -5.636 -15.676 1.00 0.00 C ATOM 398 CG1 VAL A 26 -8.907 -6.137 -15.336 1.00 0.00 C ATOM 399 CG2 VAL A 26 -7.486 -5.114 -17.113 1.00 0.00 C ATOM 0 H VAL A 26 -5.229 -4.569 -15.662 1.00 0.00 H new ATOM 0 HA VAL A 26 -7.881 -3.712 -14.762 1.00 0.00 H new ATOM 0 HB VAL A 26 -6.786 -6.453 -15.572 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -9.178 -6.948 -16.012 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -8.926 -6.500 -14.308 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -9.620 -5.320 -15.445 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -7.754 -5.920 -17.796 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -8.205 -4.301 -17.212 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -6.489 -4.748 -17.357 1.00 0.00 H new ATOM 409 N LEU A 27 -6.139 -5.956 -13.120 1.00 0.00 N ATOM 410 CA LEU A 27 -5.971 -6.520 -11.806 1.00 0.00 C ATOM 411 C LEU A 27 -5.752 -5.406 -10.796 1.00 0.00 C ATOM 412 O LEU A 27 -6.073 -5.541 -9.625 1.00 0.00 O ATOM 413 CB LEU A 27 -4.718 -7.424 -11.871 1.00 0.00 C ATOM 414 CG LEU A 27 -4.820 -8.525 -10.821 1.00 0.00 C ATOM 415 CD1 LEU A 27 -4.718 -9.912 -11.476 1.00 0.00 C ATOM 416 CD2 LEU A 27 -3.676 -8.377 -9.816 1.00 0.00 C ATOM 0 H LEU A 27 -5.528 -6.340 -13.841 1.00 0.00 H new ATOM 0 HA LEU A 27 -6.851 -7.087 -11.501 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -4.627 -7.864 -12.864 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -3.820 -6.829 -11.702 1.00 0.00 H new ATOM 0 HG LEU A 27 -5.784 -8.434 -10.320 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -4.793 -10.683 -10.709 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -5.528 -10.035 -12.195 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -3.761 -10.003 -11.989 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -3.748 -9.163 -9.065 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -2.722 -8.458 -10.336 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -3.742 -7.404 -9.330 1.00 0.00 H new ATOM 428 N LYS A 28 -5.241 -4.304 -11.275 1.00 0.00 N ATOM 429 CA LYS A 28 -4.993 -3.169 -10.360 1.00 0.00 C ATOM 430 C LYS A 28 -6.213 -2.283 -10.304 1.00 0.00 C ATOM 431 O LYS A 28 -6.566 -1.773 -9.264 1.00 0.00 O ATOM 432 CB LYS A 28 -3.804 -2.349 -10.887 1.00 0.00 C ATOM 433 CG LYS A 28 -3.414 -1.302 -9.836 1.00 0.00 C ATOM 434 CD LYS A 28 -1.912 -1.033 -9.927 1.00 0.00 C ATOM 435 CE LYS A 28 -1.613 -0.325 -11.248 1.00 0.00 C ATOM 436 NZ LYS A 28 -1.264 -1.319 -12.300 1.00 0.00 N ATOM 0 H LYS A 28 -4.989 -4.147 -12.251 1.00 0.00 H new ATOM 0 HA LYS A 28 -4.774 -3.550 -9.363 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -2.959 -3.004 -11.097 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -4.070 -1.860 -11.824 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -3.971 -0.380 -10.000 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -3.672 -1.657 -8.838 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -1.588 -0.417 -9.088 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -1.357 -1.969 -9.868 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -2.480 0.257 -11.561 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -0.790 0.377 -11.114 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -0.410 -1.006 -12.804 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -1.086 -2.244 -11.859 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -2.052 -1.403 -12.974 1.00 0.00 H new ATOM 450 N ALA A 29 -6.840 -2.112 -11.432 1.00 0.00 N ATOM 451 CA ALA A 29 -8.043 -1.261 -11.459 1.00 0.00 C ATOM 452 C ALA A 29 -9.186 -1.934 -10.726 1.00 0.00 C ATOM 453 O ALA A 29 -10.061 -1.280 -10.224 1.00 0.00 O ATOM 454 CB ALA A 29 -8.468 -1.046 -12.918 1.00 0.00 C ATOM 0 H ALA A 29 -6.570 -2.523 -12.325 1.00 0.00 H new ATOM 0 HA ALA A 29 -7.812 -0.312 -10.976 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -9.358 -0.417 -12.949 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -7.660 -0.559 -13.464 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -8.688 -2.009 -13.379 1.00 0.00 H new ATOM 460 N LEU A 30 -9.148 -3.239 -10.658 1.00 0.00 N ATOM 461 CA LEU A 30 -10.233 -3.952 -9.957 1.00 0.00 C ATOM 462 C LEU A 30 -9.988 -3.949 -8.470 1.00 0.00 C ATOM 463 O LEU A 30 -10.863 -3.610 -7.688 1.00 0.00 O ATOM 464 CB LEU A 30 -10.263 -5.401 -10.458 1.00 0.00 C ATOM 465 CG LEU A 30 -10.578 -5.411 -11.957 1.00 0.00 C ATOM 466 CD1 LEU A 30 -10.038 -6.701 -12.571 1.00 0.00 C ATOM 467 CD2 LEU A 30 -12.094 -5.359 -12.160 1.00 0.00 C ATOM 0 H LEU A 30 -8.417 -3.829 -11.056 1.00 0.00 H new ATOM 0 HA LEU A 30 -11.182 -3.455 -10.157 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -9.302 -5.882 -10.273 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -11.015 -5.971 -9.913 1.00 0.00 H new ATOM 0 HG LEU A 30 -10.115 -4.547 -12.434 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -10.258 -6.716 -13.638 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -8.959 -6.751 -12.422 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -10.510 -7.558 -12.091 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -12.319 -5.366 -13.227 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -12.554 -6.226 -11.686 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -12.490 -4.448 -11.712 1.00 0.00 H new ATOM 479 N TYR A 31 -8.797 -4.301 -8.094 1.00 0.00 N ATOM 480 CA TYR A 31 -8.485 -4.323 -6.661 1.00 0.00 C ATOM 481 C TYR A 31 -8.333 -2.914 -6.084 1.00 0.00 C ATOM 482 O TYR A 31 -8.694 -2.672 -4.959 1.00 0.00 O ATOM 483 CB TYR A 31 -7.163 -5.067 -6.466 1.00 0.00 C ATOM 484 CG TYR A 31 -6.601 -4.707 -5.096 1.00 0.00 C ATOM 485 CD1 TYR A 31 -5.903 -3.530 -4.915 1.00 0.00 C ATOM 486 CD2 TYR A 31 -6.799 -5.540 -4.018 1.00 0.00 C ATOM 487 CE1 TYR A 31 -5.413 -3.191 -3.675 1.00 0.00 C ATOM 488 CE2 TYR A 31 -6.310 -5.203 -2.776 1.00 0.00 C ATOM 489 CZ TYR A 31 -5.611 -4.025 -2.593 1.00 0.00 C ATOM 490 OH TYR A 31 -5.119 -3.688 -1.348 1.00 0.00 O ATOM 0 H TYR A 31 -8.036 -4.571 -8.717 1.00 0.00 H new ATOM 0 HA TYR A 31 -9.308 -4.816 -6.143 1.00 0.00 H new ATOM 0 HB2 TYR A 31 -7.320 -6.143 -6.540 1.00 0.00 H new ATOM 0 HB3 TYR A 31 -6.456 -4.794 -7.249 1.00 0.00 H new ATOM 0 HD1 TYR A 31 -5.740 -2.870 -5.754 1.00 0.00 H new ATOM 0 HD2 TYR A 31 -7.342 -6.465 -4.148 1.00 0.00 H new ATOM 0 HE1 TYR A 31 -4.870 -2.266 -3.547 1.00 0.00 H new ATOM 0 HE2 TYR A 31 -6.474 -5.864 -1.938 1.00 0.00 H new ATOM 0 HH TYR A 31 -5.352 -4.389 -0.704 1.00 0.00 H new ATOM 500 N ASP A 32 -7.811 -2.013 -6.865 1.00 0.00 N ATOM 501 CA ASP A 32 -7.635 -0.622 -6.357 1.00 0.00 C ATOM 502 C ASP A 32 -8.929 0.196 -6.407 1.00 0.00 C ATOM 503 O ASP A 32 -9.083 1.137 -5.653 1.00 0.00 O ATOM 504 CB ASP A 32 -6.567 0.079 -7.218 1.00 0.00 C ATOM 505 CG ASP A 32 -6.165 1.399 -6.554 1.00 0.00 C ATOM 506 OD1 ASP A 32 -5.369 1.322 -5.633 1.00 0.00 O ATOM 507 OD2 ASP A 32 -6.675 2.410 -7.010 1.00 0.00 O ATOM 0 H ASP A 32 -7.501 -2.174 -7.823 1.00 0.00 H new ATOM 0 HA ASP A 32 -7.333 -0.685 -5.312 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -5.695 -0.565 -7.330 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -6.956 0.266 -8.219 1.00 0.00 H new ATOM 512 N VAL A 33 -9.836 -0.156 -7.280 1.00 0.00 N ATOM 513 CA VAL A 33 -11.096 0.627 -7.341 1.00 0.00 C ATOM 514 C VAL A 33 -12.009 0.243 -6.203 1.00 0.00 C ATOM 515 O VAL A 33 -12.645 1.085 -5.599 1.00 0.00 O ATOM 516 CB VAL A 33 -11.815 0.325 -8.660 1.00 0.00 C ATOM 517 CG1 VAL A 33 -13.263 0.809 -8.565 1.00 0.00 C ATOM 518 CG2 VAL A 33 -11.106 1.065 -9.800 1.00 0.00 C ATOM 0 H VAL A 33 -9.760 -0.933 -7.937 1.00 0.00 H new ATOM 0 HA VAL A 33 -10.852 1.687 -7.270 1.00 0.00 H new ATOM 0 HB VAL A 33 -11.799 -0.748 -8.853 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -13.780 0.597 -9.501 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -13.766 0.293 -7.747 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -13.276 1.883 -8.379 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -11.613 0.854 -10.742 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -11.129 2.138 -9.608 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -10.071 0.730 -9.863 1.00 0.00 H new ATOM 528 N LEU A 34 -12.061 -1.025 -5.921 1.00 0.00 N ATOM 529 CA LEU A 34 -12.930 -1.474 -4.825 1.00 0.00 C ATOM 530 C LEU A 34 -12.252 -1.301 -3.475 1.00 0.00 C ATOM 531 O LEU A 34 -12.881 -0.920 -2.507 1.00 0.00 O ATOM 532 CB LEU A 34 -13.246 -2.953 -5.035 1.00 0.00 C ATOM 533 CG LEU A 34 -13.687 -3.166 -6.477 1.00 0.00 C ATOM 534 CD1 LEU A 34 -13.750 -4.665 -6.769 1.00 0.00 C ATOM 535 CD2 LEU A 34 -15.078 -2.556 -6.677 1.00 0.00 C ATOM 0 H LEU A 34 -11.541 -1.759 -6.402 1.00 0.00 H new ATOM 0 HA LEU A 34 -13.839 -0.873 -4.830 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -12.368 -3.560 -4.816 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -14.032 -3.271 -4.350 1.00 0.00 H new ATOM 0 HG LEU A 34 -12.976 -2.689 -7.151 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -14.065 -4.822 -7.801 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -12.765 -5.106 -6.620 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -14.465 -5.137 -6.095 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -15.397 -2.707 -7.708 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -15.787 -3.038 -6.004 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -15.042 -1.488 -6.461 1.00 0.00 H new ATOM 547 N ALA A 35 -10.980 -1.580 -3.428 1.00 0.00 N ATOM 548 CA ALA A 35 -10.260 -1.433 -2.144 1.00 0.00 C ATOM 549 C ALA A 35 -10.220 0.020 -1.698 1.00 0.00 C ATOM 550 O ALA A 35 -10.391 0.321 -0.534 1.00 0.00 O ATOM 551 CB ALA A 35 -8.819 -1.921 -2.330 1.00 0.00 C ATOM 0 H ALA A 35 -10.417 -1.900 -4.216 1.00 0.00 H new ATOM 0 HA ALA A 35 -10.782 -2.018 -1.387 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -8.276 -1.818 -1.391 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -8.826 -2.968 -2.633 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -8.329 -1.324 -3.099 1.00 0.00 H new ATOM 557 N LYS A 36 -9.997 0.899 -2.634 1.00 0.00 N ATOM 558 CA LYS A 36 -9.941 2.339 -2.283 1.00 0.00 C ATOM 559 C LYS A 36 -11.097 2.724 -1.374 1.00 0.00 C ATOM 560 O LYS A 36 -10.895 3.238 -0.291 1.00 0.00 O ATOM 561 CB LYS A 36 -10.038 3.160 -3.578 1.00 0.00 C ATOM 562 CG LYS A 36 -8.630 3.552 -4.031 1.00 0.00 C ATOM 563 CD LYS A 36 -8.239 4.875 -3.368 1.00 0.00 C ATOM 564 CE LYS A 36 -6.727 5.065 -3.486 1.00 0.00 C ATOM 565 NZ LYS A 36 -6.265 4.712 -4.858 1.00 0.00 N ATOM 0 H LYS A 36 -9.852 0.682 -3.620 1.00 0.00 H new ATOM 0 HA LYS A 36 -9.006 2.538 -1.760 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -10.534 2.579 -4.355 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -10.642 4.052 -3.413 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -7.918 2.772 -3.762 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -8.598 3.652 -5.116 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -8.761 5.704 -3.846 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -8.537 4.873 -2.320 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -6.465 6.099 -3.262 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -6.217 4.441 -2.752 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -5.347 5.164 -5.042 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -6.164 3.680 -4.936 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -6.961 5.045 -5.555 1.00 0.00 H new ATOM 579 N GLU A 37 -12.287 2.469 -1.827 1.00 0.00 N ATOM 580 CA GLU A 37 -13.472 2.812 -1.005 1.00 0.00 C ATOM 581 C GLU A 37 -13.415 2.126 0.352 1.00 0.00 C ATOM 582 O GLU A 37 -13.248 2.769 1.370 1.00 0.00 O ATOM 583 CB GLU A 37 -14.726 2.337 -1.747 1.00 0.00 C ATOM 584 CG GLU A 37 -14.838 3.092 -3.071 1.00 0.00 C ATOM 585 CD GLU A 37 -16.293 3.077 -3.541 1.00 0.00 C ATOM 586 OE1 GLU A 37 -17.121 3.494 -2.750 1.00 0.00 O ATOM 587 OE2 GLU A 37 -16.492 2.648 -4.666 1.00 0.00 O ATOM 0 H GLU A 37 -12.490 2.039 -2.729 1.00 0.00 H new ATOM 0 HA GLU A 37 -13.492 3.890 -0.845 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -14.671 1.264 -1.929 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -15.613 2.512 -1.138 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -14.495 4.119 -2.947 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -14.197 2.630 -3.822 1.00 0.00 H new ATOM 594 N SER A 38 -13.558 0.832 0.346 1.00 0.00 N ATOM 595 CA SER A 38 -13.513 0.093 1.629 1.00 0.00 C ATOM 596 C SER A 38 -12.949 -1.308 1.441 1.00 0.00 C ATOM 597 O SER A 38 -13.123 -1.926 0.409 1.00 0.00 O ATOM 598 CB SER A 38 -14.942 -0.006 2.184 1.00 0.00 C ATOM 599 OG SER A 38 -14.797 -0.761 3.380 1.00 0.00 O ATOM 0 H SER A 38 -13.703 0.260 -0.486 1.00 0.00 H new ATOM 0 HA SER A 38 -12.863 0.628 2.321 1.00 0.00 H new ATOM 0 HB2 SER A 38 -15.362 0.980 2.383 1.00 0.00 H new ATOM 0 HB3 SER A 38 -15.610 -0.500 1.479 1.00 0.00 H new ATOM 0 HG SER A 38 -15.673 -0.872 3.805 1.00 0.00 H new ATOM 605 N GLU A 39 -12.274 -1.770 2.451 1.00 0.00 N ATOM 606 CA GLU A 39 -11.670 -3.125 2.401 1.00 0.00 C ATOM 607 C GLU A 39 -12.623 -4.148 2.995 1.00 0.00 C ATOM 608 O GLU A 39 -12.370 -5.335 2.971 1.00 0.00 O ATOM 609 CB GLU A 39 -10.376 -3.109 3.231 1.00 0.00 C ATOM 610 CG GLU A 39 -10.693 -2.605 4.640 1.00 0.00 C ATOM 611 CD GLU A 39 -9.461 -2.778 5.532 1.00 0.00 C ATOM 612 OE1 GLU A 39 -8.835 -3.814 5.394 1.00 0.00 O ATOM 613 OE2 GLU A 39 -9.216 -1.861 6.300 1.00 0.00 O ATOM 0 H GLU A 39 -12.113 -1.260 3.320 1.00 0.00 H new ATOM 0 HA GLU A 39 -11.463 -3.393 1.365 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -9.946 -4.110 3.277 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -9.634 -2.465 2.759 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -10.986 -1.556 4.605 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -11.536 -3.158 5.055 1.00 0.00 H new ATOM 620 N HIS A 40 -13.715 -3.655 3.519 1.00 0.00 N ATOM 621 CA HIS A 40 -14.718 -4.567 4.132 1.00 0.00 C ATOM 622 C HIS A 40 -15.870 -5.020 3.192 1.00 0.00 C ATOM 623 O HIS A 40 -16.634 -5.888 3.565 1.00 0.00 O ATOM 624 CB HIS A 40 -15.351 -3.832 5.314 1.00 0.00 C ATOM 625 CG HIS A 40 -14.277 -3.548 6.362 1.00 0.00 C ATOM 626 ND1 HIS A 40 -14.292 -2.590 7.160 1.00 0.00 N ATOM 627 CD2 HIS A 40 -13.118 -4.244 6.644 1.00 0.00 C ATOM 628 CE1 HIS A 40 -13.276 -2.599 7.917 1.00 0.00 C ATOM 629 NE2 HIS A 40 -12.461 -3.624 7.661 1.00 0.00 N ATOM 0 H HIS A 40 -13.953 -2.663 3.548 1.00 0.00 H new ATOM 0 HA HIS A 40 -14.176 -5.472 4.407 1.00 0.00 H new ATOM 0 HB2 HIS A 40 -15.803 -2.899 4.978 1.00 0.00 H new ATOM 0 HB3 HIS A 40 -16.149 -4.435 5.748 1.00 0.00 H new ATOM 0 HD2 HIS A 40 -12.786 -5.138 6.138 1.00 0.00 H new ATOM 0 HE1 HIS A 40 -13.091 -1.860 8.683 1.00 0.00 H new ATOM 0 HE2 HIS A 40 -11.580 -3.876 8.109 1.00 0.00 H new ATOM 637 N PRO A 41 -15.999 -4.449 1.997 1.00 0.00 N ATOM 638 CA PRO A 41 -17.075 -4.858 1.107 1.00 0.00 C ATOM 639 C PRO A 41 -17.052 -6.388 0.866 1.00 0.00 C ATOM 640 O PRO A 41 -16.057 -6.928 0.428 1.00 0.00 O ATOM 641 CB PRO A 41 -16.809 -4.108 -0.212 1.00 0.00 C ATOM 642 CG PRO A 41 -15.682 -3.080 0.072 1.00 0.00 C ATOM 643 CD PRO A 41 -15.093 -3.435 1.448 1.00 0.00 C ATOM 0 HA PRO A 41 -18.053 -4.626 1.529 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -16.509 -4.802 -0.997 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -17.712 -3.605 -0.559 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -14.914 -3.125 -0.700 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -16.076 -2.064 0.071 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -14.078 -3.821 1.355 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -15.043 -2.559 2.094 1.00 0.00 H new ATOM 651 N PRO A 42 -18.169 -7.060 1.162 1.00 0.00 N ATOM 652 CA PRO A 42 -18.268 -8.515 0.977 1.00 0.00 C ATOM 653 C PRO A 42 -17.891 -8.952 -0.430 1.00 0.00 C ATOM 654 O PRO A 42 -17.445 -10.061 -0.637 1.00 0.00 O ATOM 655 CB PRO A 42 -19.754 -8.836 1.213 1.00 0.00 C ATOM 656 CG PRO A 42 -20.426 -7.550 1.778 1.00 0.00 C ATOM 657 CD PRO A 42 -19.392 -6.420 1.683 1.00 0.00 C ATOM 0 HA PRO A 42 -17.587 -9.032 1.653 1.00 0.00 H new ATOM 0 HB2 PRO A 42 -20.233 -9.142 0.283 1.00 0.00 H new ATOM 0 HB3 PRO A 42 -19.861 -9.664 1.914 1.00 0.00 H new ATOM 0 HG2 PRO A 42 -21.321 -7.301 1.208 1.00 0.00 H new ATOM 0 HG3 PRO A 42 -20.738 -7.701 2.812 1.00 0.00 H new ATOM 0 HD2 PRO A 42 -19.735 -5.627 1.019 1.00 0.00 H new ATOM 0 HD3 PRO A 42 -19.214 -5.965 2.658 1.00 0.00 H new ATOM 665 N GLN A 43 -18.089 -8.071 -1.362 1.00 0.00 N ATOM 666 CA GLN A 43 -17.762 -8.388 -2.773 1.00 0.00 C ATOM 667 C GLN A 43 -16.532 -9.291 -2.902 1.00 0.00 C ATOM 668 O GLN A 43 -16.478 -10.113 -3.791 1.00 0.00 O ATOM 669 CB GLN A 43 -17.507 -7.064 -3.482 1.00 0.00 C ATOM 670 CG GLN A 43 -18.509 -6.041 -2.942 1.00 0.00 C ATOM 671 CD GLN A 43 -18.528 -4.820 -3.861 1.00 0.00 C ATOM 672 OE1 GLN A 43 -17.522 -4.177 -4.074 1.00 0.00 O ATOM 673 NE2 GLN A 43 -19.651 -4.468 -4.422 1.00 0.00 N ATOM 0 H GLN A 43 -18.467 -7.136 -1.206 1.00 0.00 H new ATOM 0 HA GLN A 43 -18.593 -8.935 -3.218 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -16.485 -6.727 -3.306 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -17.623 -7.180 -4.560 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -19.503 -6.484 -2.885 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -18.234 -5.745 -1.930 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -20.500 -5.006 -4.246 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -19.681 -3.655 -5.037 1.00 0.00 H new ATOM 682 N SER A 44 -15.560 -9.111 -2.025 1.00 0.00 N ATOM 683 CA SER A 44 -14.336 -9.955 -2.090 1.00 0.00 C ATOM 684 C SER A 44 -13.411 -9.421 -3.141 1.00 0.00 C ATOM 685 O SER A 44 -13.154 -10.048 -4.139 1.00 0.00 O ATOM 686 CB SER A 44 -14.735 -11.415 -2.420 1.00 0.00 C ATOM 687 OG SER A 44 -13.745 -12.196 -1.769 1.00 0.00 O ATOM 0 H SER A 44 -15.571 -8.418 -1.276 1.00 0.00 H new ATOM 0 HA SER A 44 -13.825 -9.934 -1.128 1.00 0.00 H new ATOM 0 HB2 SER A 44 -15.734 -11.649 -2.052 1.00 0.00 H new ATOM 0 HB3 SER A 44 -14.742 -11.594 -3.495 1.00 0.00 H new ATOM 0 HG SER A 44 -14.077 -13.110 -1.647 1.00 0.00 H new ATOM 693 N ILE A 45 -12.923 -8.256 -2.891 1.00 0.00 N ATOM 694 CA ILE A 45 -12.012 -7.639 -3.849 1.00 0.00 C ATOM 695 C ILE A 45 -10.972 -8.623 -4.304 1.00 0.00 C ATOM 696 O ILE A 45 -10.733 -8.784 -5.484 1.00 0.00 O ATOM 697 CB ILE A 45 -11.291 -6.499 -3.168 1.00 0.00 C ATOM 698 CG1 ILE A 45 -12.276 -5.569 -2.452 1.00 0.00 C ATOM 699 CG2 ILE A 45 -10.549 -5.725 -4.247 1.00 0.00 C ATOM 700 CD1 ILE A 45 -13.614 -5.531 -3.202 1.00 0.00 C ATOM 0 H ILE A 45 -13.121 -7.704 -2.056 1.00 0.00 H new ATOM 0 HA ILE A 45 -12.592 -7.295 -4.705 1.00 0.00 H new ATOM 0 HB ILE A 45 -10.605 -6.891 -2.417 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -12.434 -5.913 -1.430 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -11.858 -4.564 -2.389 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -10.014 -4.891 -3.793 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -9.838 -6.385 -4.744 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -11.263 -5.344 -4.978 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -14.304 -4.866 -2.682 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -13.452 -5.165 -4.216 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -14.037 -6.535 -3.242 1.00 0.00 H new ATOM 712 N LEU A 46 -10.368 -9.270 -3.365 1.00 0.00 N ATOM 713 CA LEU A 46 -9.335 -10.251 -3.729 1.00 0.00 C ATOM 714 C LEU A 46 -9.929 -11.331 -4.608 1.00 0.00 C ATOM 715 O LEU A 46 -9.557 -11.484 -5.747 1.00 0.00 O ATOM 716 CB LEU A 46 -8.792 -10.896 -2.444 1.00 0.00 C ATOM 717 CG LEU A 46 -7.317 -11.264 -2.646 1.00 0.00 C ATOM 718 CD1 LEU A 46 -7.182 -12.123 -3.904 1.00 0.00 C ATOM 719 CD2 LEU A 46 -6.492 -9.986 -2.817 1.00 0.00 C ATOM 0 H LEU A 46 -10.544 -9.162 -2.366 1.00 0.00 H new ATOM 0 HA LEU A 46 -8.535 -9.748 -4.272 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -8.895 -10.207 -1.606 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -9.370 -11.786 -2.198 1.00 0.00 H new ATOM 0 HG LEU A 46 -6.956 -11.818 -1.780 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -6.135 -12.388 -4.053 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -7.773 -13.031 -3.790 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -7.541 -11.563 -4.767 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -5.443 -10.246 -2.961 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -6.851 -9.435 -3.686 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -6.593 -9.366 -1.926 1.00 0.00 H new ATOM 731 N HIS A 47 -10.864 -12.043 -4.061 1.00 0.00 N ATOM 732 CA HIS A 47 -11.516 -13.132 -4.828 1.00 0.00 C ATOM 733 C HIS A 47 -12.319 -12.599 -6.008 1.00 0.00 C ATOM 734 O HIS A 47 -12.781 -13.362 -6.834 1.00 0.00 O ATOM 735 CB HIS A 47 -12.472 -13.863 -3.871 1.00 0.00 C ATOM 736 CG HIS A 47 -12.757 -15.275 -4.398 1.00 0.00 C ATOM 737 ND1 HIS A 47 -13.795 -15.614 -5.003 1.00 0.00 N ATOM 738 CD2 HIS A 47 -11.985 -16.421 -4.320 1.00 0.00 C ATOM 739 CE1 HIS A 47 -13.771 -16.842 -5.317 1.00 0.00 C ATOM 740 NE2 HIS A 47 -12.651 -17.447 -4.922 1.00 0.00 N ATOM 0 H HIS A 47 -11.208 -11.918 -3.109 1.00 0.00 H new ATOM 0 HA HIS A 47 -10.746 -13.793 -5.225 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -12.032 -13.919 -2.875 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -13.404 -13.305 -3.777 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -11.012 -16.491 -3.857 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -14.569 -17.342 -5.846 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -12.367 -18.420 -5.039 1.00 0.00 H new ATOM 748 N THR A 48 -12.474 -11.312 -6.075 1.00 0.00 N ATOM 749 CA THR A 48 -13.248 -10.736 -7.199 1.00 0.00 C ATOM 750 C THR A 48 -12.335 -10.405 -8.361 1.00 0.00 C ATOM 751 O THR A 48 -12.448 -10.982 -9.426 1.00 0.00 O ATOM 752 CB THR A 48 -13.922 -9.448 -6.718 1.00 0.00 C ATOM 753 OG1 THR A 48 -15.004 -9.869 -5.912 1.00 0.00 O ATOM 754 CG2 THR A 48 -14.582 -8.705 -7.891 1.00 0.00 C ATOM 0 H THR A 48 -12.101 -10.639 -5.406 1.00 0.00 H new ATOM 0 HA THR A 48 -13.990 -11.463 -7.530 1.00 0.00 H new ATOM 0 HB THR A 48 -13.188 -8.810 -6.225 1.00 0.00 H new ATOM 0 HG1 THR A 48 -14.667 -10.162 -5.040 1.00 0.00 H new ATOM 0 HG21 THR A 48 -15.054 -7.793 -7.525 1.00 0.00 H new ATOM 0 HG22 THR A 48 -13.825 -8.449 -8.632 1.00 0.00 H new ATOM 0 HG23 THR A 48 -15.336 -9.345 -8.349 1.00 0.00 H new ATOM 762 N ALA A 49 -11.445 -9.482 -8.144 1.00 0.00 N ATOM 763 CA ALA A 49 -10.523 -9.110 -9.230 1.00 0.00 C ATOM 764 C ALA A 49 -9.760 -10.332 -9.720 1.00 0.00 C ATOM 765 O ALA A 49 -9.242 -10.339 -10.819 1.00 0.00 O ATOM 766 CB ALA A 49 -9.523 -8.068 -8.693 1.00 0.00 C ATOM 0 H ALA A 49 -11.322 -8.976 -7.267 1.00 0.00 H new ATOM 0 HA ALA A 49 -11.094 -8.697 -10.062 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -8.833 -7.783 -9.487 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -10.065 -7.187 -8.349 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -8.963 -8.496 -7.862 1.00 0.00 H new ATOM 772 N LYS A 50 -9.697 -11.355 -8.896 1.00 0.00 N ATOM 773 CA LYS A 50 -8.961 -12.576 -9.332 1.00 0.00 C ATOM 774 C LYS A 50 -9.700 -13.287 -10.441 1.00 0.00 C ATOM 775 O LYS A 50 -9.099 -13.766 -11.381 1.00 0.00 O ATOM 776 CB LYS A 50 -8.869 -13.552 -8.160 1.00 0.00 C ATOM 777 CG LYS A 50 -7.696 -14.516 -8.384 1.00 0.00 C ATOM 778 CD LYS A 50 -7.213 -15.039 -7.031 1.00 0.00 C ATOM 779 CE LYS A 50 -8.221 -16.056 -6.498 1.00 0.00 C ATOM 780 NZ LYS A 50 -7.743 -17.441 -6.757 1.00 0.00 N ATOM 0 H LYS A 50 -10.113 -11.394 -7.966 1.00 0.00 H new ATOM 0 HA LYS A 50 -7.976 -12.266 -9.679 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -8.730 -13.005 -7.228 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -9.800 -14.111 -8.065 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -8.007 -15.346 -9.019 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -6.884 -14.006 -8.902 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -6.232 -15.502 -7.136 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -7.103 -14.214 -6.327 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -8.366 -15.908 -5.428 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -9.189 -15.903 -6.975 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -8.438 -18.122 -6.390 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -7.627 -17.583 -7.781 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -6.830 -17.588 -6.282 1.00 0.00 H new ATOM 794 N ALA A 51 -10.994 -13.352 -10.317 1.00 0.00 N ATOM 795 CA ALA A 51 -11.772 -14.038 -11.363 1.00 0.00 C ATOM 796 C ALA A 51 -12.028 -13.141 -12.581 1.00 0.00 C ATOM 797 O ALA A 51 -11.808 -13.545 -13.705 1.00 0.00 O ATOM 798 CB ALA A 51 -13.126 -14.459 -10.767 1.00 0.00 C ATOM 0 H ALA A 51 -11.535 -12.963 -9.544 1.00 0.00 H new ATOM 0 HA ALA A 51 -11.196 -14.900 -11.700 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -13.716 -14.969 -11.529 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -12.960 -15.132 -9.926 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -13.663 -13.575 -10.424 1.00 0.00 H new ATOM 804 N ILE A 52 -12.483 -11.941 -12.336 1.00 0.00 N ATOM 805 CA ILE A 52 -12.758 -11.013 -13.470 1.00 0.00 C ATOM 806 C ILE A 52 -11.538 -10.837 -14.372 1.00 0.00 C ATOM 807 O ILE A 52 -11.627 -10.963 -15.576 1.00 0.00 O ATOM 808 CB ILE A 52 -13.123 -9.649 -12.892 1.00 0.00 C ATOM 809 CG1 ILE A 52 -14.427 -9.746 -12.119 1.00 0.00 C ATOM 810 CG2 ILE A 52 -13.318 -8.666 -14.053 1.00 0.00 C ATOM 811 CD1 ILE A 52 -14.577 -8.502 -11.244 1.00 0.00 C ATOM 0 H ILE A 52 -12.675 -11.566 -11.407 1.00 0.00 H new ATOM 0 HA ILE A 52 -13.567 -11.434 -14.067 1.00 0.00 H new ATOM 0 HB ILE A 52 -12.329 -9.312 -12.225 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -15.268 -9.826 -12.807 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -14.433 -10.644 -11.502 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -13.580 -7.684 -13.658 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -12.394 -8.592 -14.626 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -14.119 -9.022 -14.701 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -15.510 -8.561 -10.684 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -13.740 -8.443 -10.548 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -14.588 -7.613 -11.874 1.00 0.00 H new ATOM 823 N GLU A 53 -10.434 -10.535 -13.768 1.00 0.00 N ATOM 824 CA GLU A 53 -9.181 -10.336 -14.549 1.00 0.00 C ATOM 825 C GLU A 53 -9.058 -11.312 -15.729 1.00 0.00 C ATOM 826 O GLU A 53 -8.534 -10.956 -16.765 1.00 0.00 O ATOM 827 CB GLU A 53 -7.996 -10.565 -13.587 1.00 0.00 C ATOM 828 CG GLU A 53 -6.694 -10.739 -14.390 1.00 0.00 C ATOM 829 CD GLU A 53 -6.387 -9.441 -15.135 1.00 0.00 C ATOM 830 OE1 GLU A 53 -6.333 -8.429 -14.456 1.00 0.00 O ATOM 831 OE2 GLU A 53 -6.223 -9.533 -16.340 1.00 0.00 O ATOM 0 H GLU A 53 -10.338 -10.415 -12.760 1.00 0.00 H new ATOM 0 HA GLU A 53 -9.188 -9.329 -14.966 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -7.902 -9.720 -12.904 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -8.178 -11.450 -12.977 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -5.871 -10.992 -13.721 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -6.796 -11.563 -15.097 1.00 0.00 H new ATOM 838 N SER A 54 -9.537 -12.515 -15.559 1.00 0.00 N ATOM 839 CA SER A 54 -9.437 -13.504 -16.677 1.00 0.00 C ATOM 840 C SER A 54 -10.697 -13.567 -17.543 1.00 0.00 C ATOM 841 O SER A 54 -10.642 -14.047 -18.659 1.00 0.00 O ATOM 842 CB SER A 54 -9.211 -14.892 -16.061 1.00 0.00 C ATOM 843 OG SER A 54 -10.447 -15.199 -15.432 1.00 0.00 O ATOM 0 H SER A 54 -9.987 -12.855 -14.709 1.00 0.00 H new ATOM 0 HA SER A 54 -8.616 -13.190 -17.321 1.00 0.00 H new ATOM 0 HB2 SER A 54 -8.958 -15.629 -16.823 1.00 0.00 H new ATOM 0 HB3 SER A 54 -8.391 -14.881 -15.343 1.00 0.00 H new ATOM 0 HG SER A 54 -10.650 -14.516 -14.759 1.00 0.00 H new ATOM 849 N GLU A 55 -11.802 -13.089 -17.032 1.00 0.00 N ATOM 850 CA GLU A 55 -13.054 -13.138 -17.850 1.00 0.00 C ATOM 851 C GLU A 55 -13.328 -11.847 -18.608 1.00 0.00 C ATOM 852 O GLU A 55 -13.662 -11.882 -19.775 1.00 0.00 O ATOM 853 CB GLU A 55 -14.240 -13.409 -16.909 1.00 0.00 C ATOM 854 CG GLU A 55 -14.062 -14.780 -16.248 1.00 0.00 C ATOM 855 CD GLU A 55 -14.041 -15.869 -17.325 1.00 0.00 C ATOM 856 OE1 GLU A 55 -15.074 -16.027 -17.955 1.00 0.00 O ATOM 857 OE2 GLU A 55 -12.993 -16.480 -17.455 1.00 0.00 O ATOM 0 H GLU A 55 -11.894 -12.675 -16.104 1.00 0.00 H new ATOM 0 HA GLU A 55 -12.926 -13.928 -18.590 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -14.300 -12.631 -16.148 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -15.176 -13.381 -17.468 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -13.134 -14.802 -15.676 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -14.874 -14.965 -15.545 1.00 0.00 H new ATOM 864 N MET A 56 -13.190 -10.739 -17.957 1.00 0.00 N ATOM 865 CA MET A 56 -13.451 -9.472 -18.659 1.00 0.00 C ATOM 866 C MET A 56 -12.607 -9.365 -19.919 1.00 0.00 C ATOM 867 O MET A 56 -12.975 -8.681 -20.855 1.00 0.00 O ATOM 868 CB MET A 56 -13.086 -8.321 -17.715 1.00 0.00 C ATOM 869 CG MET A 56 -13.744 -7.022 -18.200 1.00 0.00 C ATOM 870 SD MET A 56 -12.681 -5.812 -19.012 1.00 0.00 S ATOM 871 CE MET A 56 -11.355 -5.864 -17.791 1.00 0.00 C ATOM 0 H MET A 56 -12.911 -10.657 -16.979 1.00 0.00 H new ATOM 0 HA MET A 56 -14.502 -9.429 -18.945 1.00 0.00 H new ATOM 0 HB2 MET A 56 -13.417 -8.551 -16.702 1.00 0.00 H new ATOM 0 HB3 MET A 56 -12.004 -8.199 -17.677 1.00 0.00 H new ATOM 0 HG2 MET A 56 -14.544 -7.286 -18.891 1.00 0.00 H new ATOM 0 HG3 MET A 56 -14.211 -6.539 -17.342 1.00 0.00 H new ATOM 0 HE1 MET A 56 -10.837 -4.905 -17.775 1.00 0.00 H new ATOM 0 HE2 MET A 56 -11.775 -6.066 -16.806 1.00 0.00 H new ATOM 0 HE3 MET A 56 -10.650 -6.653 -18.053 1.00 0.00 H new ATOM 881 N ASN A 57 -11.490 -10.048 -19.922 1.00 0.00 N ATOM 882 CA ASN A 57 -10.603 -9.995 -21.118 1.00 0.00 C ATOM 883 C ASN A 57 -10.801 -11.199 -22.035 1.00 0.00 C ATOM 884 O ASN A 57 -10.261 -11.231 -23.121 1.00 0.00 O ATOM 885 CB ASN A 57 -9.150 -9.961 -20.647 1.00 0.00 C ATOM 886 CG ASN A 57 -8.999 -8.910 -19.547 1.00 0.00 C ATOM 887 OD1 ASN A 57 -9.259 -9.164 -18.390 1.00 0.00 O ATOM 888 ND2 ASN A 57 -8.586 -7.716 -19.868 1.00 0.00 N ATOM 0 H ASN A 57 -11.158 -10.634 -19.155 1.00 0.00 H new ATOM 0 HA ASN A 57 -10.855 -9.100 -21.687 1.00 0.00 H new ATOM 0 HB2 ASN A 57 -8.854 -10.941 -20.272 1.00 0.00 H new ATOM 0 HB3 ASN A 57 -8.490 -9.727 -21.483 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -8.483 -7.001 -19.148 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -8.366 -7.497 -20.839 1.00 0.00 H new ATOM 895 N LYS A 58 -11.552 -12.179 -21.572 1.00 0.00 N ATOM 896 CA LYS A 58 -11.791 -13.395 -22.417 1.00 0.00 C ATOM 897 C LYS A 58 -11.871 -13.021 -23.891 1.00 0.00 C ATOM 898 O LYS A 58 -11.027 -13.405 -24.677 1.00 0.00 O ATOM 899 CB LYS A 58 -13.129 -14.026 -21.990 1.00 0.00 C ATOM 900 CG LYS A 58 -13.234 -15.434 -22.583 1.00 0.00 C ATOM 901 CD LYS A 58 -14.713 -15.800 -22.754 1.00 0.00 C ATOM 902 CE LYS A 58 -14.822 -17.275 -23.162 1.00 0.00 C ATOM 903 NZ LYS A 58 -16.090 -17.522 -23.908 1.00 0.00 N ATOM 0 H LYS A 58 -12.003 -12.188 -20.657 1.00 0.00 H new ATOM 0 HA LYS A 58 -10.966 -14.094 -22.279 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -13.193 -14.071 -20.903 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -13.961 -13.411 -22.333 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -12.723 -15.475 -23.545 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -12.742 -16.154 -21.930 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -15.253 -15.627 -21.823 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -15.172 -15.165 -23.512 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -13.969 -17.550 -23.783 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -14.787 -17.907 -22.274 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -16.146 -18.525 -24.175 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -16.901 -17.279 -23.304 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -16.109 -16.934 -24.765 1.00 0.00 H new ATOM 917 N VAL A 59 -12.886 -12.273 -24.231 1.00 0.00 N ATOM 918 CA VAL A 59 -13.062 -11.844 -25.645 1.00 0.00 C ATOM 919 C VAL A 59 -12.968 -10.333 -25.721 1.00 0.00 C ATOM 920 O VAL A 59 -13.829 -9.637 -25.217 1.00 0.00 O ATOM 921 CB VAL A 59 -14.455 -12.276 -26.117 1.00 0.00 C ATOM 922 CG1 VAL A 59 -15.507 -11.644 -25.206 1.00 0.00 C ATOM 923 CG2 VAL A 59 -14.672 -11.789 -27.553 1.00 0.00 C ATOM 0 H VAL A 59 -13.603 -11.940 -23.586 1.00 0.00 H new ATOM 0 HA VAL A 59 -12.292 -12.295 -26.271 1.00 0.00 H new ATOM 0 HB VAL A 59 -14.539 -13.362 -26.081 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -16.501 -11.946 -25.534 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -15.347 -11.976 -24.180 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -15.424 -10.558 -25.253 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -15.661 -12.093 -27.895 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -14.596 -10.702 -27.584 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -13.914 -12.225 -28.203 1.00 0.00 H new ATOM 933 N ASN A 60 -11.925 -9.841 -26.346 1.00 0.00 N ATOM 934 CA ASN A 60 -11.780 -8.365 -26.448 1.00 0.00 C ATOM 935 C ASN A 60 -11.144 -7.931 -27.766 1.00 0.00 C ATOM 936 O ASN A 60 -10.714 -8.741 -28.563 1.00 0.00 O ATOM 937 CB ASN A 60 -10.878 -7.900 -25.297 1.00 0.00 C ATOM 938 CG ASN A 60 -9.813 -8.964 -25.022 1.00 0.00 C ATOM 939 OD1 ASN A 60 -9.278 -9.055 -23.935 1.00 0.00 O ATOM 940 ND2 ASN A 60 -9.478 -9.788 -25.976 1.00 0.00 N ATOM 0 H ASN A 60 -11.183 -10.390 -26.781 1.00 0.00 H new ATOM 0 HA ASN A 60 -12.774 -7.921 -26.399 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -10.403 -6.953 -25.553 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -11.474 -7.726 -24.401 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -8.771 -10.503 -25.807 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -9.923 -9.717 -26.891 1.00 0.00 H new ATOM 947 N ASN A 61 -11.105 -6.638 -27.951 1.00 0.00 N ATOM 948 CA ASN A 61 -10.515 -6.063 -29.187 1.00 0.00 C ATOM 949 C ASN A 61 -9.051 -5.686 -28.977 1.00 0.00 C ATOM 950 O ASN A 61 -8.409 -5.205 -29.878 1.00 0.00 O ATOM 951 CB ASN A 61 -11.297 -4.797 -29.555 1.00 0.00 C ATOM 952 CG ASN A 61 -12.665 -5.186 -30.122 1.00 0.00 C ATOM 953 OD1 ASN A 61 -12.887 -5.145 -31.314 1.00 0.00 O ATOM 954 ND2 ASN A 61 -13.607 -5.564 -29.303 1.00 0.00 N ATOM 0 H ASN A 61 -11.462 -5.950 -27.288 1.00 0.00 H new ATOM 0 HA ASN A 61 -10.571 -6.809 -29.980 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -11.423 -4.166 -28.675 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -10.740 -4.214 -30.289 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -14.524 -5.823 -29.666 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -13.426 -5.600 -28.300 1.00 0.00 H new ATOM 961 N CYS A 62 -8.586 -5.841 -27.757 1.00 0.00 N ATOM 962 CA CYS A 62 -7.158 -5.502 -27.428 1.00 0.00 C ATOM 963 C CYS A 62 -6.169 -5.896 -28.547 1.00 0.00 C ATOM 964 O CYS A 62 -5.007 -5.548 -28.488 1.00 0.00 O ATOM 965 CB CYS A 62 -6.764 -6.267 -26.151 1.00 0.00 C ATOM 966 SG CYS A 62 -7.385 -7.956 -25.970 1.00 0.00 S ATOM 0 H CYS A 62 -9.135 -6.189 -26.971 1.00 0.00 H new ATOM 0 HA CYS A 62 -7.099 -4.421 -27.302 1.00 0.00 H new ATOM 0 HB2 CYS A 62 -5.676 -6.301 -26.100 1.00 0.00 H new ATOM 0 HB3 CYS A 62 -7.105 -5.688 -25.293 1.00 0.00 H new ATOM 0 HG CYS A 62 -7.770 -8.148 -24.743 1.00 0.00 H new ATOM 972 N ASP A 63 -6.639 -6.607 -29.535 1.00 0.00 N ATOM 973 CA ASP A 63 -5.725 -7.015 -30.636 1.00 0.00 C ATOM 974 C ASP A 63 -5.642 -5.937 -31.727 1.00 0.00 C ATOM 975 O ASP A 63 -4.608 -5.770 -32.343 1.00 0.00 O ATOM 976 CB ASP A 63 -6.282 -8.302 -31.262 1.00 0.00 C ATOM 977 CG ASP A 63 -5.388 -8.730 -32.426 1.00 0.00 C ATOM 978 OD1 ASP A 63 -4.233 -9.004 -32.149 1.00 0.00 O ATOM 979 OD2 ASP A 63 -5.913 -8.760 -33.527 1.00 0.00 O ATOM 0 H ASP A 63 -7.606 -6.920 -29.627 1.00 0.00 H new ATOM 0 HA ASP A 63 -4.726 -7.164 -30.227 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -6.327 -9.093 -30.514 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -7.301 -8.137 -31.613 1.00 0.00 H new ATOM 984 N THR A 64 -6.731 -5.230 -31.946 1.00 0.00 N ATOM 985 CA THR A 64 -6.722 -4.162 -32.996 1.00 0.00 C ATOM 986 C THR A 64 -7.403 -2.881 -32.502 1.00 0.00 C ATOM 987 O THR A 64 -6.865 -1.802 -32.651 1.00 0.00 O ATOM 988 CB THR A 64 -7.486 -4.677 -34.218 1.00 0.00 C ATOM 989 OG1 THR A 64 -8.615 -5.350 -33.700 1.00 0.00 O ATOM 990 CG2 THR A 64 -6.682 -5.765 -34.945 1.00 0.00 C ATOM 0 H THR A 64 -7.614 -5.346 -31.448 1.00 0.00 H new ATOM 0 HA THR A 64 -5.686 -3.929 -33.241 1.00 0.00 H new ATOM 0 HB THR A 64 -7.704 -3.849 -34.893 1.00 0.00 H new ATOM 0 HG1 THR A 64 -9.152 -5.705 -34.439 1.00 0.00 H new ATOM 0 HG21 THR A 64 -7.244 -6.116 -35.810 1.00 0.00 H new ATOM 0 HG22 THR A 64 -5.728 -5.353 -35.275 1.00 0.00 H new ATOM 0 HG23 THR A 64 -6.502 -6.599 -34.267 1.00 0.00 H new ATOM 998 N ASN A 65 -8.574 -3.031 -31.922 1.00 0.00 N ATOM 999 CA ASN A 65 -9.315 -1.837 -31.409 1.00 0.00 C ATOM 1000 C ASN A 65 -9.431 -1.899 -29.891 1.00 0.00 C ATOM 1001 O ASN A 65 -10.493 -2.125 -29.345 1.00 0.00 O ATOM 1002 CB ASN A 65 -10.727 -1.837 -32.028 1.00 0.00 C ATOM 1003 CG ASN A 65 -11.315 -0.426 -31.950 1.00 0.00 C ATOM 1004 OD1 ASN A 65 -12.120 -0.123 -31.091 1.00 0.00 O ATOM 1005 ND2 ASN A 65 -10.942 0.466 -32.829 1.00 0.00 N ATOM 0 H ASN A 65 -9.044 -3.926 -31.784 1.00 0.00 H new ATOM 0 HA ASN A 65 -8.777 -0.929 -31.682 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -10.681 -2.167 -33.066 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -11.369 -2.540 -31.498 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -11.326 1.410 -32.792 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -10.267 0.218 -33.552 1.00 0.00 H new ATOM 1012 N GLU A 66 -8.330 -1.681 -29.240 1.00 0.00 N ATOM 1013 CA GLU A 66 -8.329 -1.721 -27.762 1.00 0.00 C ATOM 1014 C GLU A 66 -9.151 -0.577 -27.195 1.00 0.00 C ATOM 1015 O GLU A 66 -9.414 -0.519 -26.008 1.00 0.00 O ATOM 1016 CB GLU A 66 -6.879 -1.585 -27.284 1.00 0.00 C ATOM 1017 CG GLU A 66 -5.938 -1.753 -28.480 1.00 0.00 C ATOM 1018 CD GLU A 66 -4.504 -1.928 -27.974 1.00 0.00 C ATOM 1019 OE1 GLU A 66 -3.865 -0.904 -27.796 1.00 0.00 O ATOM 1020 OE2 GLU A 66 -4.129 -3.075 -27.795 1.00 0.00 O ATOM 0 H GLU A 66 -7.428 -1.476 -29.671 1.00 0.00 H new ATOM 0 HA GLU A 66 -8.766 -2.660 -27.422 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -6.726 -0.611 -26.820 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -6.661 -2.337 -26.526 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -6.235 -2.618 -29.072 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -6.002 -0.883 -29.133 1.00 0.00 H new ATOM 1027 N ALA A 67 -9.545 0.314 -28.056 1.00 0.00 N ATOM 1028 CA ALA A 67 -10.347 1.462 -27.600 1.00 0.00 C ATOM 1029 C ALA A 67 -11.706 0.985 -27.111 1.00 0.00 C ATOM 1030 O ALA A 67 -12.361 1.643 -26.324 1.00 0.00 O ATOM 1031 CB ALA A 67 -10.541 2.403 -28.796 1.00 0.00 C ATOM 0 H ALA A 67 -9.343 0.291 -29.056 1.00 0.00 H new ATOM 0 HA ALA A 67 -9.840 1.973 -26.782 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -11.133 3.265 -28.488 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -9.569 2.740 -29.155 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -11.059 1.873 -29.595 1.00 0.00 H new ATOM 1037 N ALA A 68 -12.098 -0.164 -27.583 1.00 0.00 N ATOM 1038 CA ALA A 68 -13.404 -0.722 -27.173 1.00 0.00 C ATOM 1039 C ALA A 68 -13.293 -1.429 -25.828 1.00 0.00 C ATOM 1040 O ALA A 68 -13.878 -1.004 -24.852 1.00 0.00 O ATOM 1041 CB ALA A 68 -13.832 -1.741 -28.234 1.00 0.00 C ATOM 0 H ALA A 68 -11.565 -0.738 -28.236 1.00 0.00 H new ATOM 0 HA ALA A 68 -14.131 0.085 -27.080 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -14.795 -2.171 -27.958 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -13.920 -1.245 -29.201 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -13.086 -2.533 -28.299 1.00 0.00 H new ATOM 1047 N TYR A 69 -12.544 -2.502 -25.801 1.00 0.00 N ATOM 1048 CA TYR A 69 -12.384 -3.248 -24.526 1.00 0.00 C ATOM 1049 C TYR A 69 -12.153 -2.282 -23.369 1.00 0.00 C ATOM 1050 O TYR A 69 -12.563 -2.535 -22.255 1.00 0.00 O ATOM 1051 CB TYR A 69 -11.157 -4.181 -24.658 1.00 0.00 C ATOM 1052 CG TYR A 69 -10.546 -4.429 -23.271 1.00 0.00 C ATOM 1053 CD1 TYR A 69 -9.582 -3.580 -22.772 1.00 0.00 C ATOM 1054 CD2 TYR A 69 -10.961 -5.498 -22.496 1.00 0.00 C ATOM 1055 CE1 TYR A 69 -9.042 -3.787 -21.522 1.00 0.00 C ATOM 1056 CE2 TYR A 69 -10.418 -5.705 -21.243 1.00 0.00 C ATOM 1057 CZ TYR A 69 -9.454 -4.851 -20.748 1.00 0.00 C ATOM 1058 OH TYR A 69 -8.907 -5.059 -19.498 1.00 0.00 O ATOM 0 H TYR A 69 -12.042 -2.888 -26.601 1.00 0.00 H new ATOM 0 HA TYR A 69 -13.288 -3.823 -24.327 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -11.454 -5.127 -25.110 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -10.415 -3.732 -25.318 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -9.246 -2.744 -23.367 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -11.714 -6.174 -22.873 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -8.290 -3.110 -21.145 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -10.750 -6.542 -20.646 1.00 0.00 H new ATOM 0 HH TYR A 69 -7.931 -4.987 -19.552 1.00 0.00 H new ATOM 1068 N LYS A 70 -11.505 -1.188 -23.656 1.00 0.00 N ATOM 1069 CA LYS A 70 -11.239 -0.193 -22.586 1.00 0.00 C ATOM 1070 C LYS A 70 -12.508 0.562 -22.200 1.00 0.00 C ATOM 1071 O LYS A 70 -12.851 0.653 -21.038 1.00 0.00 O ATOM 1072 CB LYS A 70 -10.211 0.814 -23.116 1.00 0.00 C ATOM 1073 CG LYS A 70 -9.687 1.656 -21.953 1.00 0.00 C ATOM 1074 CD LYS A 70 -9.113 2.961 -22.505 1.00 0.00 C ATOM 1075 CE LYS A 70 -8.295 3.650 -21.415 1.00 0.00 C ATOM 1076 NZ LYS A 70 -7.309 4.592 -22.017 1.00 0.00 N ATOM 0 H LYS A 70 -11.151 -0.942 -24.580 1.00 0.00 H new ATOM 0 HA LYS A 70 -10.870 -0.715 -21.703 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -9.388 0.290 -23.601 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -10.668 1.456 -23.869 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -10.491 1.866 -21.248 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -8.919 1.108 -21.407 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -8.486 2.758 -23.373 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -9.919 3.614 -22.839 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -8.959 4.191 -20.741 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -7.774 2.903 -20.816 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -6.762 5.051 -21.261 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -6.664 4.067 -22.642 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -7.812 5.316 -22.569 1.00 0.00 H new ATOM 1090 N ALA A 71 -13.179 1.091 -23.181 1.00 0.00 N ATOM 1091 CA ALA A 71 -14.427 1.844 -22.891 1.00 0.00 C ATOM 1092 C ALA A 71 -15.416 0.999 -22.083 1.00 0.00 C ATOM 1093 O ALA A 71 -15.732 1.318 -20.955 1.00 0.00 O ATOM 1094 CB ALA A 71 -15.079 2.227 -24.230 1.00 0.00 C ATOM 0 H ALA A 71 -12.919 1.035 -24.166 1.00 0.00 H new ATOM 0 HA ALA A 71 -14.176 2.727 -22.304 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -15.998 2.781 -24.042 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -14.392 2.848 -24.805 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -15.310 1.323 -24.794 1.00 0.00 H new ATOM 1100 N ARG A 72 -15.881 -0.064 -22.675 1.00 0.00 N ATOM 1101 CA ARG A 72 -16.852 -0.945 -21.964 1.00 0.00 C ATOM 1102 C ARG A 72 -16.321 -1.407 -20.604 1.00 0.00 C ATOM 1103 O ARG A 72 -17.042 -1.429 -19.633 1.00 0.00 O ATOM 1104 CB ARG A 72 -17.094 -2.184 -22.837 1.00 0.00 C ATOM 1105 CG ARG A 72 -15.812 -3.016 -22.891 1.00 0.00 C ATOM 1106 CD ARG A 72 -15.949 -4.082 -23.980 1.00 0.00 C ATOM 1107 NE ARG A 72 -15.251 -5.321 -23.538 1.00 0.00 N ATOM 1108 CZ ARG A 72 -14.891 -6.204 -24.427 1.00 0.00 C ATOM 1109 NH1 ARG A 72 -15.544 -6.265 -25.555 1.00 0.00 N ATOM 1110 NH2 ARG A 72 -13.892 -6.999 -24.157 1.00 0.00 N ATOM 0 H ARG A 72 -15.633 -0.362 -23.618 1.00 0.00 H new ATOM 0 HA ARG A 72 -17.768 -0.380 -21.792 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -17.911 -2.778 -22.428 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -17.390 -1.884 -23.842 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -14.956 -2.374 -23.100 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -15.629 -3.487 -21.925 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -17.001 -4.291 -24.172 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -15.520 -3.722 -24.915 1.00 0.00 H new ATOM 0 HE ARG A 72 -15.056 -5.477 -22.549 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -16.322 -5.628 -25.729 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -15.277 -6.949 -26.263 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -13.407 -6.923 -23.263 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -13.596 -7.696 -24.840 1.00 0.00 H new ATOM 1124 N TYR A 73 -15.079 -1.771 -20.564 1.00 0.00 N ATOM 1125 CA TYR A 73 -14.493 -2.237 -19.279 1.00 0.00 C ATOM 1126 C TYR A 73 -14.801 -1.279 -18.122 1.00 0.00 C ATOM 1127 O TYR A 73 -15.404 -1.664 -17.138 1.00 0.00 O ATOM 1128 CB TYR A 73 -12.972 -2.318 -19.455 1.00 0.00 C ATOM 1129 CG TYR A 73 -12.304 -2.359 -18.082 1.00 0.00 C ATOM 1130 CD1 TYR A 73 -12.828 -3.137 -17.068 1.00 0.00 C ATOM 1131 CD2 TYR A 73 -11.165 -1.622 -17.839 1.00 0.00 C ATOM 1132 CE1 TYR A 73 -12.220 -3.175 -15.830 1.00 0.00 C ATOM 1133 CE2 TYR A 73 -10.558 -1.659 -16.601 1.00 0.00 C ATOM 1134 CZ TYR A 73 -11.080 -2.437 -15.587 1.00 0.00 C ATOM 1135 OH TYR A 73 -10.471 -2.475 -14.350 1.00 0.00 O ATOM 0 H TYR A 73 -14.442 -1.768 -21.360 1.00 0.00 H new ATOM 0 HA TYR A 73 -14.928 -3.206 -19.034 1.00 0.00 H new ATOM 0 HB2 TYR A 73 -12.708 -3.208 -20.027 1.00 0.00 H new ATOM 0 HB3 TYR A 73 -12.614 -1.458 -20.020 1.00 0.00 H new ATOM 0 HD1 TYR A 73 -13.720 -3.720 -17.245 1.00 0.00 H new ATOM 0 HD2 TYR A 73 -10.745 -1.011 -18.624 1.00 0.00 H new ATOM 0 HE1 TYR A 73 -12.640 -3.787 -15.045 1.00 0.00 H new ATOM 0 HE2 TYR A 73 -9.667 -1.075 -16.423 1.00 0.00 H new ATOM 0 HH TYR A 73 -11.085 -2.868 -13.695 1.00 0.00 H new ATOM 1145 N ARG A 74 -14.389 -0.054 -18.266 1.00 0.00 N ATOM 1146 CA ARG A 74 -14.645 0.942 -17.184 1.00 0.00 C ATOM 1147 C ARG A 74 -16.116 1.348 -17.095 1.00 0.00 C ATOM 1148 O ARG A 74 -16.698 1.345 -16.029 1.00 0.00 O ATOM 1149 CB ARG A 74 -13.820 2.206 -17.486 1.00 0.00 C ATOM 1150 CG ARG A 74 -12.358 1.816 -17.755 1.00 0.00 C ATOM 1151 CD ARG A 74 -11.523 2.019 -16.483 1.00 0.00 C ATOM 1152 NE ARG A 74 -11.754 0.871 -15.563 1.00 0.00 N ATOM 1153 CZ ARG A 74 -10.964 0.703 -14.539 1.00 0.00 C ATOM 1154 NH1 ARG A 74 -9.672 0.769 -14.720 1.00 0.00 N ATOM 1155 NH2 ARG A 74 -11.490 0.473 -13.368 1.00 0.00 N ATOM 0 H ARG A 74 -13.888 0.303 -19.080 1.00 0.00 H new ATOM 0 HA ARG A 74 -14.365 0.481 -16.237 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -14.234 2.724 -18.351 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -13.874 2.897 -16.645 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -12.303 0.776 -18.075 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -11.954 2.421 -18.567 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -10.465 2.093 -16.735 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -11.800 2.954 -15.996 1.00 0.00 H new ATOM 0 HE ARG A 74 -12.523 0.222 -15.732 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -9.296 0.949 -15.651 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -9.039 0.640 -13.930 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -12.504 0.427 -13.264 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -10.888 0.339 -12.556 1.00 0.00 H new ATOM 1169 N ILE A 75 -16.687 1.686 -18.210 1.00 0.00 N ATOM 1170 CA ILE A 75 -18.120 2.099 -18.206 1.00 0.00 C ATOM 1171 C ILE A 75 -19.030 1.041 -17.588 1.00 0.00 C ATOM 1172 O ILE A 75 -19.951 1.361 -16.862 1.00 0.00 O ATOM 1173 CB ILE A 75 -18.558 2.324 -19.652 1.00 0.00 C ATOM 1174 CG1 ILE A 75 -17.766 3.474 -20.255 1.00 0.00 C ATOM 1175 CG2 ILE A 75 -20.049 2.699 -19.657 1.00 0.00 C ATOM 1176 CD1 ILE A 75 -18.089 3.574 -21.747 1.00 0.00 C ATOM 0 H ILE A 75 -16.231 1.696 -19.122 1.00 0.00 H new ATOM 0 HA ILE A 75 -18.206 3.005 -17.606 1.00 0.00 H new ATOM 0 HB ILE A 75 -18.386 1.418 -20.233 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -18.017 4.408 -19.752 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -16.698 3.311 -20.111 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -20.379 2.864 -20.683 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -20.629 1.889 -19.214 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -20.197 3.610 -19.078 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -17.525 4.396 -22.187 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -17.817 2.642 -22.242 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -19.156 3.755 -21.877 1.00 0.00 H new ATOM 1188 N ILE A 76 -18.761 -0.196 -17.882 1.00 0.00 N ATOM 1189 CA ILE A 76 -19.605 -1.280 -17.318 1.00 0.00 C ATOM 1190 C ILE A 76 -19.062 -1.801 -15.982 1.00 0.00 C ATOM 1191 O ILE A 76 -19.729 -2.548 -15.297 1.00 0.00 O ATOM 1192 CB ILE A 76 -19.636 -2.416 -18.327 1.00 0.00 C ATOM 1193 CG1 ILE A 76 -20.075 -1.859 -19.675 1.00 0.00 C ATOM 1194 CG2 ILE A 76 -20.672 -3.460 -17.858 1.00 0.00 C ATOM 1195 CD1 ILE A 76 -20.200 -2.996 -20.673 1.00 0.00 C ATOM 0 H ILE A 76 -17.998 -0.503 -18.485 1.00 0.00 H new ATOM 0 HA ILE A 76 -20.603 -0.885 -17.127 1.00 0.00 H new ATOM 0 HB ILE A 76 -18.651 -2.874 -18.414 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -21.029 -1.342 -19.574 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -19.352 -1.126 -20.031 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -20.707 -4.283 -18.571 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -20.386 -3.841 -16.878 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -21.655 -2.993 -17.793 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -20.514 -2.600 -21.639 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -19.236 -3.493 -20.781 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -20.940 -3.713 -20.317 1.00 0.00 H new ATOM 1207 N TYR A 77 -17.862 -1.390 -15.637 1.00 0.00 N ATOM 1208 CA TYR A 77 -17.253 -1.850 -14.347 1.00 0.00 C ATOM 1209 C TYR A 77 -18.299 -1.968 -13.241 1.00 0.00 C ATOM 1210 O TYR A 77 -18.288 -2.907 -12.475 1.00 0.00 O ATOM 1211 CB TYR A 77 -16.200 -0.812 -13.914 1.00 0.00 C ATOM 1212 CG TYR A 77 -15.447 -1.314 -12.669 1.00 0.00 C ATOM 1213 CD1 TYR A 77 -15.966 -1.121 -11.397 1.00 0.00 C ATOM 1214 CD2 TYR A 77 -14.230 -1.956 -12.798 1.00 0.00 C ATOM 1215 CE1 TYR A 77 -15.278 -1.562 -10.287 1.00 0.00 C ATOM 1216 CE2 TYR A 77 -13.548 -2.394 -11.687 1.00 0.00 C ATOM 1217 CZ TYR A 77 -14.063 -2.203 -10.427 1.00 0.00 C ATOM 1218 OH TYR A 77 -13.380 -2.656 -9.322 1.00 0.00 O ATOM 0 H TYR A 77 -17.282 -0.759 -16.190 1.00 0.00 H new ATOM 0 HA TYR A 77 -16.809 -2.833 -14.505 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -15.497 -0.634 -14.727 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -16.684 0.140 -13.697 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -16.916 -0.622 -11.276 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -13.811 -2.115 -13.780 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -15.692 -1.405 -9.302 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -12.598 -2.893 -11.806 1.00 0.00 H new ATOM 0 HH TYR A 77 -13.231 -3.621 -9.402 1.00 0.00 H new ATOM 1228 N SER A 78 -19.184 -1.018 -13.186 1.00 0.00 N ATOM 1229 CA SER A 78 -20.235 -1.060 -12.137 1.00 0.00 C ATOM 1230 C SER A 78 -21.067 -2.331 -12.241 1.00 0.00 C ATOM 1231 O SER A 78 -21.238 -3.047 -11.273 1.00 0.00 O ATOM 1232 CB SER A 78 -21.160 0.150 -12.335 1.00 0.00 C ATOM 1233 OG SER A 78 -22.131 0.018 -11.308 1.00 0.00 O ATOM 0 H SER A 78 -19.226 -0.218 -13.818 1.00 0.00 H new ATOM 0 HA SER A 78 -19.757 -1.040 -11.158 1.00 0.00 H new ATOM 0 HB2 SER A 78 -20.612 1.088 -12.247 1.00 0.00 H new ATOM 0 HB3 SER A 78 -21.621 0.141 -13.323 1.00 0.00 H new ATOM 0 HG SER A 78 -22.768 0.761 -11.362 1.00 0.00 H new ATOM 1239 N ASN A 79 -21.570 -2.587 -13.409 1.00 0.00 N ATOM 1240 CA ASN A 79 -22.394 -3.802 -13.600 1.00 0.00 C ATOM 1241 C ASN A 79 -21.595 -5.066 -13.300 1.00 0.00 C ATOM 1242 O ASN A 79 -22.124 -6.026 -12.780 1.00 0.00 O ATOM 1243 CB ASN A 79 -22.854 -3.839 -15.061 1.00 0.00 C ATOM 1244 CG ASN A 79 -23.412 -2.469 -15.445 1.00 0.00 C ATOM 1245 OD1 ASN A 79 -22.679 -1.515 -15.621 1.00 0.00 O ATOM 1246 ND2 ASN A 79 -24.701 -2.326 -15.580 1.00 0.00 N ATOM 0 H ASN A 79 -21.446 -2.008 -14.239 1.00 0.00 H new ATOM 0 HA ASN A 79 -23.243 -3.767 -12.917 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -22.019 -4.101 -15.711 1.00 0.00 H new ATOM 0 HB3 ASN A 79 -23.616 -4.607 -15.196 1.00 0.00 H new ATOM 0 HD21 ASN A 79 -25.090 -1.417 -15.832 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -25.321 -3.123 -15.434 1.00 0.00 H new ATOM 1253 N VAL A 80 -20.336 -5.046 -13.634 1.00 0.00 N ATOM 1254 CA VAL A 80 -19.495 -6.242 -13.372 1.00 0.00 C ATOM 1255 C VAL A 80 -19.408 -6.527 -11.879 1.00 0.00 C ATOM 1256 O VAL A 80 -19.338 -7.668 -11.466 1.00 0.00 O ATOM 1257 CB VAL A 80 -18.081 -5.971 -13.903 1.00 0.00 C ATOM 1258 CG1 VAL A 80 -17.256 -7.257 -13.816 1.00 0.00 C ATOM 1259 CG2 VAL A 80 -18.168 -5.530 -15.365 1.00 0.00 C ATOM 0 H VAL A 80 -19.857 -4.260 -14.073 1.00 0.00 H new ATOM 0 HA VAL A 80 -19.942 -7.103 -13.869 1.00 0.00 H new ATOM 0 HB VAL A 80 -17.609 -5.188 -13.309 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -16.250 -7.070 -14.192 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -17.200 -7.584 -12.778 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -17.729 -8.034 -14.416 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -17.166 -5.336 -15.747 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -18.635 -6.318 -15.956 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -18.765 -4.621 -15.436 1.00 0.00 H new ATOM 1269 N ILE A 81 -19.411 -5.484 -11.095 1.00 0.00 N ATOM 1270 CA ILE A 81 -19.328 -5.677 -9.627 1.00 0.00 C ATOM 1271 C ILE A 81 -20.726 -5.777 -9.024 1.00 0.00 C ATOM 1272 O ILE A 81 -20.882 -6.051 -7.850 1.00 0.00 O ATOM 1273 CB ILE A 81 -18.600 -4.465 -9.031 1.00 0.00 C ATOM 1274 CG1 ILE A 81 -17.302 -4.225 -9.793 1.00 0.00 C ATOM 1275 CG2 ILE A 81 -18.256 -4.757 -7.558 1.00 0.00 C ATOM 1276 CD1 ILE A 81 -16.234 -5.202 -9.296 1.00 0.00 C ATOM 0 H ILE A 81 -19.467 -4.515 -11.408 1.00 0.00 H new ATOM 0 HA ILE A 81 -18.791 -6.599 -9.404 1.00 0.00 H new ATOM 0 HB ILE A 81 -19.242 -3.587 -9.103 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -17.465 -4.360 -10.862 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -16.967 -3.198 -9.648 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -17.738 -3.899 -7.128 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -19.174 -4.944 -7.000 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -17.612 -5.635 -7.502 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -15.305 -5.032 -9.840 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -16.065 -5.045 -8.231 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -16.571 -6.225 -9.463 1.00 0.00 H new ATOM 1288 N SER A 82 -21.719 -5.561 -9.842 1.00 0.00 N ATOM 1289 CA SER A 82 -23.110 -5.639 -9.336 1.00 0.00 C ATOM 1290 C SER A 82 -23.589 -7.085 -9.287 1.00 0.00 C ATOM 1291 O SER A 82 -23.959 -7.581 -8.240 1.00 0.00 O ATOM 1292 CB SER A 82 -24.018 -4.852 -10.289 1.00 0.00 C ATOM 1293 OG SER A 82 -24.120 -5.683 -11.436 1.00 0.00 O ATOM 0 H SER A 82 -21.625 -5.335 -10.832 1.00 0.00 H new ATOM 0 HA SER A 82 -23.145 -5.224 -8.329 1.00 0.00 H new ATOM 0 HB2 SER A 82 -24.995 -4.665 -9.844 1.00 0.00 H new ATOM 0 HB3 SER A 82 -23.589 -3.881 -10.537 1.00 0.00 H new ATOM 0 HG SER A 82 -23.257 -5.708 -11.900 1.00 0.00 H new ATOM 1299 N LYS A 83 -23.576 -7.731 -10.431 1.00 0.00 N ATOM 1300 CA LYS A 83 -24.026 -9.150 -10.489 1.00 0.00 C ATOM 1301 C LYS A 83 -23.006 -10.004 -11.231 1.00 0.00 C ATOM 1302 O LYS A 83 -21.922 -10.241 -10.736 1.00 0.00 O ATOM 1303 CB LYS A 83 -25.365 -9.207 -11.239 1.00 0.00 C ATOM 1304 CG LYS A 83 -26.471 -8.656 -10.333 1.00 0.00 C ATOM 1305 CD LYS A 83 -26.971 -9.773 -9.412 1.00 0.00 C ATOM 1306 CE LYS A 83 -28.086 -9.226 -8.518 1.00 0.00 C ATOM 1307 NZ LYS A 83 -29.362 -9.123 -9.282 1.00 0.00 N ATOM 0 H LYS A 83 -23.274 -7.334 -11.321 1.00 0.00 H new ATOM 0 HA LYS A 83 -24.134 -9.534 -9.475 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -25.306 -8.624 -12.158 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -25.591 -10.234 -11.527 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -26.091 -7.823 -9.741 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -27.293 -8.270 -10.936 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -27.341 -10.610 -10.004 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -26.151 -10.151 -8.801 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -28.223 -9.879 -7.656 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -27.805 -8.245 -8.134 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -30.128 -8.831 -8.641 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -29.257 -8.418 -10.040 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -29.593 -10.048 -9.699 1.00 0.00 H new ATOM 1321 N ASN A 84 -23.362 -10.446 -12.410 1.00 0.00 N ATOM 1322 CA ASN A 84 -22.412 -11.284 -13.185 1.00 0.00 C ATOM 1323 C ASN A 84 -22.769 -11.303 -14.669 1.00 0.00 C ATOM 1324 O ASN A 84 -23.721 -10.680 -15.093 1.00 0.00 O ATOM 1325 CB ASN A 84 -22.494 -12.724 -12.649 1.00 0.00 C ATOM 1326 CG ASN A 84 -21.877 -12.785 -11.249 1.00 0.00 C ATOM 1327 OD1 ASN A 84 -20.703 -12.537 -11.065 1.00 0.00 O ATOM 1328 ND2 ASN A 84 -22.634 -13.111 -10.236 1.00 0.00 N ATOM 0 H ASN A 84 -24.258 -10.264 -12.861 1.00 0.00 H new ATOM 0 HA ASN A 84 -21.410 -10.869 -13.075 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -23.533 -13.052 -12.614 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -21.968 -13.403 -13.320 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -22.238 -13.156 -9.297 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -23.621 -13.321 -10.384 1.00 0.00 H new ATOM 1335 N ASN A 85 -21.988 -12.027 -15.428 1.00 0.00 N ATOM 1336 CA ASN A 85 -22.245 -12.118 -16.891 1.00 0.00 C ATOM 1337 C ASN A 85 -22.659 -10.768 -17.481 1.00 0.00 C ATOM 1338 O ASN A 85 -23.828 -10.499 -17.680 1.00 0.00 O ATOM 1339 CB ASN A 85 -23.387 -13.126 -17.118 1.00 0.00 C ATOM 1340 CG ASN A 85 -24.298 -13.158 -15.886 1.00 0.00 C ATOM 1341 OD1 ASN A 85 -25.320 -12.502 -15.839 1.00 0.00 O ATOM 1342 ND2 ASN A 85 -23.964 -13.907 -14.868 1.00 0.00 N ATOM 0 H ASN A 85 -21.184 -12.558 -15.095 1.00 0.00 H new ATOM 0 HA ASN A 85 -21.326 -12.434 -17.384 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -23.962 -12.846 -18.001 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -22.977 -14.119 -17.306 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -24.560 -13.938 -14.041 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -23.108 -14.460 -14.901 1.00 0.00 H new ATOM 1349 N PRO A 86 -21.672 -9.942 -17.745 1.00 0.00 N ATOM 1350 CA PRO A 86 -21.903 -8.617 -18.313 1.00 0.00 C ATOM 1351 C PRO A 86 -22.294 -8.722 -19.784 1.00 0.00 C ATOM 1352 O PRO A 86 -22.826 -7.794 -20.357 1.00 0.00 O ATOM 1353 CB PRO A 86 -20.542 -7.899 -18.192 1.00 0.00 C ATOM 1354 CG PRO A 86 -19.514 -8.946 -17.658 1.00 0.00 C ATOM 1355 CD PRO A 86 -20.273 -10.267 -17.464 1.00 0.00 C ATOM 0 HA PRO A 86 -22.709 -8.091 -17.802 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -20.226 -7.508 -19.159 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -20.614 -7.049 -17.513 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -18.693 -9.074 -18.363 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -19.077 -8.611 -16.717 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -19.903 -11.038 -18.140 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -20.152 -10.647 -16.450 1.00 0.00 H new ATOM 1363 N ASP A 87 -22.006 -9.860 -20.367 1.00 0.00 N ATOM 1364 CA ASP A 87 -22.341 -10.070 -21.796 1.00 0.00 C ATOM 1365 C ASP A 87 -21.707 -8.997 -22.655 1.00 0.00 C ATOM 1366 O ASP A 87 -22.300 -8.526 -23.600 1.00 0.00 O ATOM 1367 CB ASP A 87 -23.871 -10.012 -21.969 1.00 0.00 C ATOM 1368 CG ASP A 87 -24.527 -10.979 -20.983 1.00 0.00 C ATOM 1369 OD1 ASP A 87 -24.017 -12.082 -20.887 1.00 0.00 O ATOM 1370 OD2 ASP A 87 -25.503 -10.560 -20.382 1.00 0.00 O ATOM 0 H ASP A 87 -21.552 -10.650 -19.908 1.00 0.00 H new ATOM 0 HA ASP A 87 -21.960 -11.043 -22.107 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -24.230 -8.998 -21.795 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -24.143 -10.276 -22.991 1.00 0.00 H new ATOM 1375 N LEU A 88 -20.504 -8.628 -22.309 1.00 0.00 N ATOM 1376 CA LEU A 88 -19.816 -7.582 -23.100 1.00 0.00 C ATOM 1377 C LEU A 88 -19.920 -7.890 -24.590 1.00 0.00 C ATOM 1378 O LEU A 88 -19.716 -7.032 -25.425 1.00 0.00 O ATOM 1379 CB LEU A 88 -18.329 -7.563 -22.702 1.00 0.00 C ATOM 1380 CG LEU A 88 -18.212 -7.480 -21.178 1.00 0.00 C ATOM 1381 CD1 LEU A 88 -16.744 -7.629 -20.780 1.00 0.00 C ATOM 1382 CD2 LEU A 88 -18.725 -6.118 -20.705 1.00 0.00 C ATOM 0 H LEU A 88 -19.977 -9.004 -21.521 1.00 0.00 H new ATOM 0 HA LEU A 88 -20.283 -6.617 -22.901 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -17.832 -8.461 -23.068 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -17.828 -6.712 -23.163 1.00 0.00 H new ATOM 0 HG LEU A 88 -18.802 -8.274 -20.720 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -16.653 -7.571 -19.695 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -16.370 -8.593 -21.124 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -16.160 -6.829 -21.236 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -18.643 -6.055 -19.620 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -18.129 -5.327 -21.160 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -19.768 -6.001 -20.998 1.00 0.00 H new ATOM 1394 N LYS A 89 -20.239 -9.118 -24.886 1.00 0.00 N ATOM 1395 CA LYS A 89 -20.369 -9.532 -26.306 1.00 0.00 C ATOM 1396 C LYS A 89 -21.456 -8.732 -27.017 1.00 0.00 C ATOM 1397 O LYS A 89 -21.633 -8.858 -28.212 1.00 0.00 O ATOM 1398 CB LYS A 89 -20.749 -11.018 -26.340 1.00 0.00 C ATOM 1399 CG LYS A 89 -19.722 -11.816 -25.535 1.00 0.00 C ATOM 1400 CD LYS A 89 -20.328 -13.168 -25.147 1.00 0.00 C ATOM 1401 CE LYS A 89 -20.278 -14.106 -26.356 1.00 0.00 C ATOM 1402 NZ LYS A 89 -18.988 -14.852 -26.386 1.00 0.00 N ATOM 0 H LYS A 89 -20.415 -9.854 -24.202 1.00 0.00 H new ATOM 0 HA LYS A 89 -19.422 -9.353 -26.814 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -21.746 -11.161 -25.924 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -20.779 -11.375 -27.369 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -18.817 -11.965 -26.124 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -19.433 -11.263 -24.641 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -19.777 -13.601 -24.312 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -21.358 -13.037 -24.815 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -21.110 -14.809 -26.313 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -20.394 -13.531 -27.275 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -18.971 -15.483 -27.212 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -18.199 -14.178 -26.449 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -18.893 -15.416 -25.517 1.00 0.00 H new ATOM 1416 N HIS A 90 -22.176 -7.940 -26.256 1.00 0.00 N ATOM 1417 CA HIS A 90 -23.269 -7.111 -26.849 1.00 0.00 C ATOM 1418 C HIS A 90 -22.930 -6.646 -28.264 1.00 0.00 C ATOM 1419 O HIS A 90 -23.809 -6.460 -29.081 1.00 0.00 O ATOM 1420 CB HIS A 90 -23.460 -5.870 -25.964 1.00 0.00 C ATOM 1421 CG HIS A 90 -23.937 -6.301 -24.577 1.00 0.00 C ATOM 1422 ND1 HIS A 90 -25.010 -6.894 -24.341 1.00 0.00 N ATOM 1423 CD2 HIS A 90 -23.328 -6.140 -23.346 1.00 0.00 C ATOM 1424 CE1 HIS A 90 -25.151 -7.126 -23.103 1.00 0.00 C ATOM 1425 NE2 HIS A 90 -24.122 -6.680 -22.382 1.00 0.00 N ATOM 0 H HIS A 90 -22.052 -7.834 -25.249 1.00 0.00 H new ATOM 0 HA HIS A 90 -24.172 -7.719 -26.900 1.00 0.00 H new ATOM 0 HB2 HIS A 90 -22.522 -5.320 -25.883 1.00 0.00 H new ATOM 0 HB3 HIS A 90 -24.187 -5.196 -26.417 1.00 0.00 H new ATOM 0 HD2 HIS A 90 -22.374 -5.662 -23.177 1.00 0.00 H new ATOM 0 HE1 HIS A 90 -26.008 -7.628 -22.680 1.00 0.00 H new ATOM 0 HE2 HIS A 90 -23.970 -6.730 -21.375 1.00 0.00 H new ATOM 1433 N LYS A 91 -21.665 -6.468 -28.531 1.00 0.00 N ATOM 1434 CA LYS A 91 -21.273 -6.018 -29.890 1.00 0.00 C ATOM 1435 C LYS A 91 -21.881 -6.927 -30.951 1.00 0.00 C ATOM 1436 O LYS A 91 -22.488 -6.463 -31.895 1.00 0.00 O ATOM 1437 CB LYS A 91 -19.742 -6.082 -30.004 1.00 0.00 C ATOM 1438 CG LYS A 91 -19.124 -5.013 -29.101 1.00 0.00 C ATOM 1439 CD LYS A 91 -17.601 -5.068 -29.231 1.00 0.00 C ATOM 1440 CE LYS A 91 -17.119 -6.482 -28.906 1.00 0.00 C ATOM 1441 NZ LYS A 91 -17.940 -7.072 -27.811 1.00 0.00 N ATOM 0 H LYS A 91 -20.898 -6.613 -27.875 1.00 0.00 H new ATOM 0 HA LYS A 91 -21.633 -5.001 -30.047 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -19.385 -7.070 -29.714 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -19.436 -5.923 -31.038 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -19.490 -4.026 -29.382 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -19.419 -5.179 -28.065 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -17.300 -4.792 -30.242 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -17.140 -4.349 -28.554 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -17.184 -7.109 -29.796 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -16.070 -6.456 -28.610 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -17.393 -7.813 -27.328 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -18.195 -6.329 -27.129 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -18.806 -7.486 -28.211 1.00 0.00 H new ATOM 1455 N ILE A 92 -21.705 -8.207 -30.775 1.00 0.00 N ATOM 1456 CA ILE A 92 -22.266 -9.164 -31.762 1.00 0.00 C ATOM 1457 C ILE A 92 -23.784 -9.066 -31.803 1.00 0.00 C ATOM 1458 O ILE A 92 -24.401 -9.366 -32.806 1.00 0.00 O ATOM 1459 CB ILE A 92 -21.878 -10.580 -31.333 1.00 0.00 C ATOM 1460 CG1 ILE A 92 -20.447 -10.872 -31.757 1.00 0.00 C ATOM 1461 CG2 ILE A 92 -22.812 -11.581 -32.036 1.00 0.00 C ATOM 1462 CD1 ILE A 92 -19.558 -9.692 -31.360 1.00 0.00 C ATOM 0 H ILE A 92 -21.200 -8.627 -29.995 1.00 0.00 H new ATOM 0 HA ILE A 92 -21.872 -8.930 -32.751 1.00 0.00 H new ATOM 0 HB ILE A 92 -21.964 -10.669 -30.250 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -20.093 -11.787 -31.281 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -20.399 -11.034 -32.834 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -22.547 -12.596 -31.739 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -23.844 -11.377 -31.751 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -22.707 -11.480 -33.116 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -18.530 -9.894 -31.661 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -19.910 -8.788 -31.856 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -19.599 -9.553 -30.280 1.00 0.00 H new ATOM 1474 N ALA A 93 -24.357 -8.649 -30.708 1.00 0.00 N ATOM 1475 CA ALA A 93 -25.835 -8.521 -30.657 1.00 0.00 C ATOM 1476 C ALA A 93 -26.267 -7.102 -31.003 1.00 0.00 C ATOM 1477 O ALA A 93 -27.432 -6.843 -31.229 1.00 0.00 O ATOM 1478 CB ALA A 93 -26.300 -8.843 -29.226 1.00 0.00 C ATOM 0 H ALA A 93 -23.866 -8.393 -29.851 1.00 0.00 H new ATOM 0 HA ALA A 93 -26.277 -9.208 -31.379 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -27.385 -8.754 -29.167 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -26.004 -9.860 -28.968 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -25.841 -8.143 -28.528 1.00 0.00 H new ATOM 1484 N ASN A 94 -25.315 -6.207 -31.039 1.00 0.00 N ATOM 1485 CA ASN A 94 -25.643 -4.796 -31.368 1.00 0.00 C ATOM 1486 C ASN A 94 -24.534 -4.168 -32.200 1.00 0.00 C ATOM 1487 O ASN A 94 -23.845 -3.278 -31.747 1.00 0.00 O ATOM 1488 CB ASN A 94 -25.772 -4.012 -30.054 1.00 0.00 C ATOM 1489 CG ASN A 94 -27.092 -4.371 -29.374 1.00 0.00 C ATOM 1490 OD1 ASN A 94 -27.300 -5.490 -28.950 1.00 0.00 O ATOM 1491 ND2 ASN A 94 -28.010 -3.452 -29.251 1.00 0.00 N ATOM 0 H ASN A 94 -24.329 -6.395 -30.855 1.00 0.00 H new ATOM 0 HA ASN A 94 -26.572 -4.767 -31.937 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -24.936 -4.246 -29.395 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -25.732 -2.941 -30.252 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -28.898 -3.675 -28.800 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -27.840 -2.511 -29.605 1.00 0.00 H new ATOM 1498 N GLY A 95 -24.384 -4.643 -33.406 1.00 0.00 N ATOM 1499 CA GLY A 95 -23.319 -4.085 -34.291 1.00 0.00 C ATOM 1500 C GLY A 95 -23.863 -2.934 -35.147 1.00 0.00 C ATOM 1501 O GLY A 95 -23.116 -2.263 -35.826 1.00 0.00 O ATOM 0 H GLY A 95 -24.948 -5.388 -33.816 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -22.486 -3.730 -33.684 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -22.930 -4.871 -34.938 1.00 0.00 H new ATOM 1505 N ASP A 96 -25.153 -2.739 -35.106 1.00 0.00 N ATOM 1506 CA ASP A 96 -25.747 -1.639 -35.913 1.00 0.00 C ATOM 1507 C ASP A 96 -25.603 -0.285 -35.218 1.00 0.00 C ATOM 1508 O ASP A 96 -25.493 0.732 -35.873 1.00 0.00 O ATOM 1509 CB ASP A 96 -27.244 -1.933 -36.106 1.00 0.00 C ATOM 1510 CG ASP A 96 -27.955 -0.661 -36.574 1.00 0.00 C ATOM 1511 OD1 ASP A 96 -27.389 -0.011 -37.439 1.00 0.00 O ATOM 1512 OD2 ASP A 96 -29.024 -0.410 -36.041 1.00 0.00 O ATOM 0 H ASP A 96 -25.814 -3.287 -34.555 1.00 0.00 H new ATOM 0 HA ASP A 96 -25.222 -1.590 -36.867 1.00 0.00 H new ATOM 0 HB2 ASP A 96 -27.378 -2.729 -36.839 1.00 0.00 H new ATOM 0 HB3 ASP A 96 -27.681 -2.284 -35.171 1.00 0.00 H new ATOM 1517 N ILE A 97 -25.603 -0.293 -33.907 1.00 0.00 N ATOM 1518 CA ILE A 97 -25.467 0.999 -33.174 1.00 0.00 C ATOM 1519 C ILE A 97 -24.019 1.274 -32.762 1.00 0.00 C ATOM 1520 O ILE A 97 -23.638 2.413 -32.579 1.00 0.00 O ATOM 1521 CB ILE A 97 -26.330 0.937 -31.910 1.00 0.00 C ATOM 1522 CG1 ILE A 97 -27.783 1.239 -32.261 1.00 0.00 C ATOM 1523 CG2 ILE A 97 -25.830 2.013 -30.930 1.00 0.00 C ATOM 1524 CD1 ILE A 97 -28.294 0.182 -33.240 1.00 0.00 C ATOM 0 H ILE A 97 -25.690 -1.125 -33.323 1.00 0.00 H new ATOM 0 HA ILE A 97 -25.789 1.801 -33.839 1.00 0.00 H new ATOM 0 HB ILE A 97 -26.262 -0.056 -31.467 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -28.394 1.242 -31.359 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -27.864 2.232 -32.704 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -26.432 1.986 -30.022 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -24.787 1.821 -30.680 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -25.917 2.996 -31.393 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -29.333 0.393 -33.494 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -27.688 0.201 -34.146 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -28.227 -0.804 -32.779 1.00 0.00 H new ATOM 1536 N THR A 98 -23.233 0.241 -32.619 1.00 0.00 N ATOM 1537 CA THR A 98 -21.824 0.474 -32.222 1.00 0.00 C ATOM 1538 C THR A 98 -21.108 1.396 -33.221 1.00 0.00 C ATOM 1539 O THR A 98 -20.485 2.365 -32.832 1.00 0.00 O ATOM 1540 CB THR A 98 -21.092 -0.863 -32.141 1.00 0.00 C ATOM 1541 OG1 THR A 98 -22.045 -1.842 -32.489 1.00 0.00 O ATOM 1542 CG2 THR A 98 -20.719 -1.188 -30.687 1.00 0.00 C ATOM 0 H THR A 98 -23.502 -0.733 -32.757 1.00 0.00 H new ATOM 0 HA THR A 98 -21.818 0.962 -31.247 1.00 0.00 H new ATOM 0 HB THR A 98 -20.203 -0.834 -32.771 1.00 0.00 H new ATOM 0 HG1 THR A 98 -22.466 -2.192 -31.676 1.00 0.00 H new ATOM 0 HG21 THR A 98 -20.198 -2.145 -30.650 1.00 0.00 H new ATOM 0 HG22 THR A 98 -20.069 -0.406 -30.294 1.00 0.00 H new ATOM 0 HG23 THR A 98 -21.625 -1.244 -30.083 1.00 0.00 H new ATOM 1550 N PRO A 99 -21.211 1.075 -34.502 1.00 0.00 N ATOM 1551 CA PRO A 99 -20.573 1.879 -35.544 1.00 0.00 C ATOM 1552 C PRO A 99 -21.270 3.226 -35.707 1.00 0.00 C ATOM 1553 O PRO A 99 -21.004 3.953 -36.645 1.00 0.00 O ATOM 1554 CB PRO A 99 -20.759 1.065 -36.841 1.00 0.00 C ATOM 1555 CG PRO A 99 -21.666 -0.154 -36.499 1.00 0.00 C ATOM 1556 CD PRO A 99 -21.947 -0.104 -34.987 1.00 0.00 C ATOM 0 HA PRO A 99 -19.529 2.079 -35.302 1.00 0.00 H new ATOM 0 HB2 PRO A 99 -21.217 1.678 -37.617 1.00 0.00 H new ATOM 0 HB3 PRO A 99 -19.796 0.731 -37.226 1.00 0.00 H new ATOM 0 HG2 PRO A 99 -22.597 -0.111 -37.065 1.00 0.00 H new ATOM 0 HG3 PRO A 99 -21.172 -1.088 -36.768 1.00 0.00 H new ATOM 0 HD2 PRO A 99 -23.015 -0.013 -34.787 1.00 0.00 H new ATOM 0 HD3 PRO A 99 -21.606 -1.013 -34.492 1.00 0.00 H new ATOM 1564 N GLU A 100 -22.150 3.535 -34.791 1.00 0.00 N ATOM 1565 CA GLU A 100 -22.873 4.831 -34.883 1.00 0.00 C ATOM 1566 C GLU A 100 -22.191 5.909 -34.054 1.00 0.00 C ATOM 1567 O GLU A 100 -21.598 6.821 -34.587 1.00 0.00 O ATOM 1568 CB GLU A 100 -24.298 4.625 -34.337 1.00 0.00 C ATOM 1569 CG GLU A 100 -25.238 5.663 -34.957 1.00 0.00 C ATOM 1570 CD GLU A 100 -26.677 5.146 -34.890 1.00 0.00 C ATOM 1571 OE1 GLU A 100 -26.874 4.034 -35.349 1.00 0.00 O ATOM 1572 OE2 GLU A 100 -27.498 5.891 -34.381 1.00 0.00 O ATOM 0 H GLU A 100 -22.396 2.951 -33.992 1.00 0.00 H new ATOM 0 HA GLU A 100 -22.883 5.153 -35.924 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -24.646 3.619 -34.570 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -24.300 4.720 -33.251 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -25.155 6.610 -34.424 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -24.956 5.854 -35.992 1.00 0.00 H new ATOM 1579 N PHE A 101 -22.281 5.778 -32.764 1.00 0.00 N ATOM 1580 CA PHE A 101 -21.645 6.788 -31.887 1.00 0.00 C ATOM 1581 C PHE A 101 -20.146 6.597 -31.832 1.00 0.00 C ATOM 1582 O PHE A 101 -19.390 7.443 -32.265 1.00 0.00 O ATOM 1583 CB PHE A 101 -22.215 6.618 -30.475 1.00 0.00 C ATOM 1584 CG PHE A 101 -23.642 6.090 -30.570 1.00 0.00 C ATOM 1585 CD1 PHE A 101 -24.498 6.558 -31.551 1.00 0.00 C ATOM 1586 CD2 PHE A 101 -24.102 5.149 -29.666 1.00 0.00 C ATOM 1587 CE1 PHE A 101 -25.794 6.092 -31.625 1.00 0.00 C ATOM 1588 CE2 PHE A 101 -25.399 4.687 -29.743 1.00 0.00 C ATOM 1589 CZ PHE A 101 -26.243 5.159 -30.722 1.00 0.00 C ATOM 0 H PHE A 101 -22.765 5.020 -32.283 1.00 0.00 H new ATOM 0 HA PHE A 101 -21.850 7.783 -32.283 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -21.597 5.928 -29.901 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -22.202 7.572 -29.947 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -24.150 7.292 -32.263 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -23.443 4.775 -28.897 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -26.457 6.461 -32.394 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -25.753 3.953 -29.034 1.00 0.00 H new ATOM 0 HZ PHE A 101 -27.258 4.796 -30.781 1.00 0.00 H new ATOM 1599 N LEU A 102 -19.741 5.490 -31.296 1.00 0.00 N ATOM 1600 CA LEU A 102 -18.295 5.221 -31.200 1.00 0.00 C ATOM 1601 C LEU A 102 -17.603 5.558 -32.513 1.00 0.00 C ATOM 1602 O LEU A 102 -16.402 5.730 -32.558 1.00 0.00 O ATOM 1603 CB LEU A 102 -18.099 3.729 -30.896 1.00 0.00 C ATOM 1604 CG LEU A 102 -19.167 3.288 -29.896 1.00 0.00 C ATOM 1605 CD1 LEU A 102 -18.892 1.849 -29.456 1.00 0.00 C ATOM 1606 CD2 LEU A 102 -19.123 4.209 -28.677 1.00 0.00 C ATOM 0 H LEU A 102 -20.349 4.762 -30.921 1.00 0.00 H new ATOM 0 HA LEU A 102 -17.863 5.836 -30.410 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -18.175 3.144 -31.812 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -17.104 3.554 -30.487 1.00 0.00 H new ATOM 0 HG LEU A 102 -20.150 3.342 -30.363 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -19.654 1.535 -28.743 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -18.916 1.192 -30.325 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -17.910 1.794 -28.986 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -19.883 3.899 -27.960 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -18.139 4.150 -28.212 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -19.316 5.235 -28.989 1.00 0.00 H new ATOM 1618 N ALA A 103 -18.382 5.651 -33.563 1.00 0.00 N ATOM 1619 CA ALA A 103 -17.787 5.976 -34.886 1.00 0.00 C ATOM 1620 C ALA A 103 -17.894 7.466 -35.192 1.00 0.00 C ATOM 1621 O ALA A 103 -16.911 8.181 -35.172 1.00 0.00 O ATOM 1622 CB ALA A 103 -18.559 5.202 -35.963 1.00 0.00 C ATOM 0 H ALA A 103 -19.393 5.517 -33.557 1.00 0.00 H new ATOM 0 HA ALA A 103 -16.732 5.701 -34.872 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -18.139 5.426 -36.944 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -18.479 4.132 -35.770 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -19.608 5.497 -35.942 1.00 0.00 H new ATOM 1628 N THR A 104 -19.090 7.906 -35.473 1.00 0.00 N ATOM 1629 CA THR A 104 -19.287 9.345 -35.787 1.00 0.00 C ATOM 1630 C THR A 104 -20.696 9.795 -35.408 1.00 0.00 C ATOM 1631 O THR A 104 -21.657 9.098 -35.664 1.00 0.00 O ATOM 1632 CB THR A 104 -19.096 9.530 -37.293 1.00 0.00 C ATOM 1633 OG1 THR A 104 -19.640 8.366 -37.879 1.00 0.00 O ATOM 1634 CG2 THR A 104 -17.605 9.487 -37.666 1.00 0.00 C ATOM 0 H THR A 104 -19.934 7.333 -35.498 1.00 0.00 H new ATOM 0 HA THR A 104 -18.570 9.940 -35.221 1.00 0.00 H new ATOM 0 HB THR A 104 -19.541 10.473 -37.610 1.00 0.00 H new ATOM 0 HG1 THR A 104 -19.552 8.419 -38.854 1.00 0.00 H new ATOM 0 HG21 THR A 104 -17.495 9.621 -38.742 1.00 0.00 H new ATOM 0 HG22 THR A 104 -17.076 10.285 -37.145 1.00 0.00 H new ATOM 0 HG23 THR A 104 -17.185 8.524 -37.375 1.00 0.00 H new ATOM 1642 N CYS A 105 -20.801 10.956 -34.817 1.00 0.00 N ATOM 1643 CA CYS A 105 -22.147 11.448 -34.426 1.00 0.00 C ATOM 1644 C CYS A 105 -22.758 12.327 -35.515 1.00 0.00 C ATOM 1645 O CYS A 105 -23.691 11.930 -36.186 1.00 0.00 O ATOM 1646 CB CYS A 105 -22.000 12.288 -33.147 1.00 0.00 C ATOM 1647 SG CYS A 105 -23.501 13.044 -32.474 1.00 0.00 S ATOM 0 H CYS A 105 -20.022 11.575 -34.592 1.00 0.00 H new ATOM 0 HA CYS A 105 -22.800 10.589 -34.269 1.00 0.00 H new ATOM 0 HB2 CYS A 105 -21.566 11.653 -32.374 1.00 0.00 H new ATOM 0 HB3 CYS A 105 -21.282 13.083 -33.346 1.00 0.00 H new ATOM 0 HG CYS A 105 -23.206 13.713 -31.399 1.00 0.00 H new ATOM 1653 N ASP A 106 -22.220 13.505 -35.666 1.00 0.00 N ATOM 1654 CA ASP A 106 -22.751 14.433 -36.704 1.00 0.00 C ATOM 1655 C ASP A 106 -21.939 14.365 -37.991 1.00 0.00 C ATOM 1656 O ASP A 106 -22.480 14.451 -39.076 1.00 0.00 O ATOM 1657 CB ASP A 106 -22.664 15.865 -36.147 1.00 0.00 C ATOM 1658 CG ASP A 106 -23.124 16.859 -37.215 1.00 0.00 C ATOM 1659 OD1 ASP A 106 -24.003 16.476 -37.969 1.00 0.00 O ATOM 1660 OD2 ASP A 106 -22.569 17.946 -37.217 1.00 0.00 O ATOM 0 H ASP A 106 -21.439 13.865 -35.118 1.00 0.00 H new ATOM 0 HA ASP A 106 -23.777 14.148 -36.936 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -23.286 15.958 -35.257 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -21.640 16.087 -35.845 1.00 0.00 H new ATOM 1665 N ALA A 107 -20.659 14.215 -37.845 1.00 0.00 N ATOM 1666 CA ALA A 107 -19.789 14.143 -39.042 1.00 0.00 C ATOM 1667 C ALA A 107 -20.163 12.979 -39.943 1.00 0.00 C ATOM 1668 O ALA A 107 -19.768 12.935 -41.091 1.00 0.00 O ATOM 1669 CB ALA A 107 -18.343 13.953 -38.568 1.00 0.00 C ATOM 0 H ALA A 107 -20.177 14.139 -36.949 1.00 0.00 H new ATOM 0 HA ALA A 107 -19.909 15.063 -39.614 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -17.681 13.897 -39.432 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -18.052 14.796 -37.942 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -18.267 13.031 -37.992 1.00 0.00 H new ATOM 1675 N LYS A 108 -20.917 12.057 -39.428 1.00 0.00 N ATOM 1676 CA LYS A 108 -21.301 10.905 -40.275 1.00 0.00 C ATOM 1677 C LYS A 108 -22.183 11.364 -41.414 1.00 0.00 C ATOM 1678 O LYS A 108 -22.282 10.703 -42.428 1.00 0.00 O ATOM 1679 CB LYS A 108 -22.068 9.890 -39.417 1.00 0.00 C ATOM 1680 CG LYS A 108 -23.436 10.470 -39.066 1.00 0.00 C ATOM 1681 CD LYS A 108 -24.155 9.523 -38.107 1.00 0.00 C ATOM 1682 CE LYS A 108 -25.548 10.080 -37.812 1.00 0.00 C ATOM 1683 NZ LYS A 108 -26.119 9.444 -36.594 1.00 0.00 N ATOM 0 H LYS A 108 -21.279 12.050 -38.474 1.00 0.00 H new ATOM 0 HA LYS A 108 -20.402 10.447 -40.687 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -22.185 8.951 -39.958 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -21.509 9.667 -38.508 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -23.321 11.452 -38.607 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -24.028 10.608 -39.971 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -24.232 8.529 -38.547 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -23.587 9.420 -37.183 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -25.492 11.160 -37.673 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -26.205 9.902 -38.664 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -27.065 9.835 -36.409 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -26.191 8.417 -36.740 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -25.501 9.635 -35.780 1.00 0.00 H new ATOM 1697 N ASP A 109 -22.815 12.491 -41.238 1.00 0.00 N ATOM 1698 CA ASP A 109 -23.683 12.982 -42.320 1.00 0.00 C ATOM 1699 C ASP A 109 -22.828 13.285 -43.510 1.00 0.00 C ATOM 1700 O ASP A 109 -23.226 13.103 -44.644 1.00 0.00 O ATOM 1701 CB ASP A 109 -24.388 14.265 -41.858 1.00 0.00 C ATOM 1702 CG ASP A 109 -25.483 13.908 -40.854 1.00 0.00 C ATOM 1703 OD1 ASP A 109 -25.202 13.052 -40.030 1.00 0.00 O ATOM 1704 OD2 ASP A 109 -26.537 14.508 -40.967 1.00 0.00 O ATOM 0 H ASP A 109 -22.764 13.077 -40.405 1.00 0.00 H new ATOM 0 HA ASP A 109 -24.431 12.232 -42.577 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -23.668 14.945 -41.402 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -24.819 14.785 -42.714 1.00 0.00 H new ATOM 1709 N LEU A 110 -21.655 13.746 -43.225 1.00 0.00 N ATOM 1710 CA LEU A 110 -20.728 14.072 -44.300 1.00 0.00 C ATOM 1711 C LEU A 110 -19.310 14.035 -43.775 1.00 0.00 C ATOM 1712 O LEU A 110 -18.744 15.048 -43.420 1.00 0.00 O ATOM 1713 CB LEU A 110 -21.038 15.492 -44.785 1.00 0.00 C ATOM 1714 CG LEU A 110 -21.202 16.396 -43.564 1.00 0.00 C ATOM 1715 CD1 LEU A 110 -20.296 17.617 -43.713 1.00 0.00 C ATOM 1716 CD2 LEU A 110 -22.657 16.855 -43.465 1.00 0.00 C ATOM 0 H LEU A 110 -21.304 13.909 -42.281 1.00 0.00 H new ATOM 0 HA LEU A 110 -20.832 13.354 -45.113 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -20.233 15.859 -45.423 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -21.948 15.497 -45.385 1.00 0.00 H new ATOM 0 HG LEU A 110 -20.930 15.846 -42.663 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -20.411 18.264 -42.843 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -19.258 17.293 -43.789 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -20.572 18.167 -44.613 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -22.777 17.500 -42.595 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -22.926 17.407 -44.365 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -23.307 15.986 -43.364 1.00 0.00 H new ATOM 1728 N ALA A 111 -18.763 12.857 -43.736 1.00 0.00 N ATOM 1729 CA ALA A 111 -17.375 12.722 -43.239 1.00 0.00 C ATOM 1730 C ALA A 111 -16.352 13.131 -44.313 1.00 0.00 C ATOM 1731 O ALA A 111 -15.422 13.866 -44.040 1.00 0.00 O ATOM 1732 CB ALA A 111 -17.134 11.253 -42.849 1.00 0.00 C ATOM 0 H ALA A 111 -19.214 11.989 -44.025 1.00 0.00 H new ATOM 0 HA ALA A 111 -17.247 13.380 -42.380 1.00 0.00 H new ATOM 0 HB1 ALA A 111 -16.115 11.137 -42.481 1.00 0.00 H new ATOM 0 HB2 ALA A 111 -17.837 10.964 -42.068 1.00 0.00 H new ATOM 0 HB3 ALA A 111 -17.279 10.616 -43.722 1.00 0.00 H new ATOM 1738 N PRO A 112 -16.548 12.638 -45.527 1.00 0.00 N ATOM 1739 CA PRO A 112 -15.645 12.951 -46.638 1.00 0.00 C ATOM 1740 C PRO A 112 -15.783 14.408 -47.081 1.00 0.00 C ATOM 1741 O PRO A 112 -16.224 15.250 -46.324 1.00 0.00 O ATOM 1742 CB PRO A 112 -16.096 12.023 -47.785 1.00 0.00 C ATOM 1743 CG PRO A 112 -17.367 11.260 -47.295 1.00 0.00 C ATOM 1744 CD PRO A 112 -17.659 11.736 -45.861 1.00 0.00 C ATOM 0 HA PRO A 112 -14.603 12.807 -46.351 1.00 0.00 H new ATOM 0 HB2 PRO A 112 -16.317 12.601 -48.682 1.00 0.00 H new ATOM 0 HB3 PRO A 112 -15.304 11.321 -48.045 1.00 0.00 H new ATOM 0 HG2 PRO A 112 -18.215 11.465 -47.949 1.00 0.00 H new ATOM 0 HG3 PRO A 112 -17.201 10.183 -47.317 1.00 0.00 H new ATOM 0 HD2 PRO A 112 -18.617 12.252 -45.804 1.00 0.00 H new ATOM 0 HD3 PRO A 112 -17.707 10.896 -45.168 1.00 0.00 H new ATOM 1752 N ALA A 113 -15.401 14.675 -48.304 1.00 0.00 N ATOM 1753 CA ALA A 113 -15.501 16.066 -48.818 1.00 0.00 C ATOM 1754 C ALA A 113 -14.871 16.175 -50.211 1.00 0.00 C ATOM 1755 O ALA A 113 -13.808 16.739 -50.380 1.00 0.00 O ATOM 1756 CB ALA A 113 -14.739 16.994 -47.853 1.00 0.00 C ATOM 0 H ALA A 113 -15.027 13.992 -48.962 1.00 0.00 H new ATOM 0 HA ALA A 113 -16.551 16.349 -48.886 1.00 0.00 H new ATOM 0 HB1 ALA A 113 -14.800 18.021 -48.212 1.00 0.00 H new ATOM 0 HB2 ALA A 113 -15.183 16.930 -46.860 1.00 0.00 H new ATOM 0 HB3 ALA A 113 -13.694 16.688 -47.803 1.00 0.00 H new ATOM 1762 N PRO A 114 -15.555 15.618 -51.187 1.00 0.00 N ATOM 1763 CA PRO A 114 -15.082 15.643 -52.568 1.00 0.00 C ATOM 1764 C PRO A 114 -15.032 17.068 -53.113 1.00 0.00 C ATOM 1765 O PRO A 114 -15.880 17.837 -52.693 1.00 0.00 O ATOM 1766 CB PRO A 114 -16.123 14.818 -53.358 1.00 0.00 C ATOM 1767 CG PRO A 114 -17.219 14.361 -52.346 1.00 0.00 C ATOM 1768 CD PRO A 114 -16.832 14.925 -50.968 1.00 0.00 C ATOM 1769 OXT PRO A 114 -14.147 17.309 -53.916 1.00 0.00 O ATOM 0 HA PRO A 114 -14.072 15.242 -52.649 1.00 0.00 H new ATOM 0 HB2 PRO A 114 -16.562 15.417 -54.156 1.00 0.00 H new ATOM 0 HB3 PRO A 114 -15.652 13.956 -53.829 1.00 0.00 H new ATOM 0 HG2 PRO A 114 -18.200 14.728 -52.650 1.00 0.00 H new ATOM 0 HG3 PRO A 114 -17.282 13.273 -52.312 1.00 0.00 H new ATOM 0 HD2 PRO A 114 -17.593 15.609 -50.593 1.00 0.00 H new ATOM 0 HD3 PRO A 114 -16.728 14.129 -50.231 1.00 0.00 H new TER 1777 PRO A 114