USER MOD reduce.3.24.130724 H: found=0, std=0, add=1050, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1045 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 110 ASN : amide:sc= 0.0887 X(o=0.88,f=0.79) USER MOD Set 1.2: A 113 THR OG1 : rot -58:sc= 0.809 USER MOD Set 1.3: A 114 HIS : no HD1:sc= -0.0216 K(o=0.88,f=-0.95) USER MOD Set 2.1: A 35 GLN : amide:sc= -0.364 K(o=0.078,f=-1.5!) USER MOD Set 2.2: A 39 THR OG1 : rot -150:sc= 0.442 USER MOD Single : A 1 ILE N :NH3+ -152:sc= -0.0515 (180deg=-0.343) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 HIS : no HE2:sc= -0.947! C(o=-0.95!,f=-3.3!) USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 16 ASN : amide:sc= -0.014 X(o=-0.014,f=-0.014) USER MOD Single : A 20 THR OG1 : rot -150:sc= 0 USER MOD Single : A 21 GLN : amide:sc= 0.595 K(o=0.6,f=-0.025) USER MOD Single : A 26 THR OG1 : rot -72:sc= -0.651 USER MOD Single : A 27 SER OG : rot 15:sc= 0.693 USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 SER OG : rot 180:sc= 0.105 USER MOD Single : A 48 GLN : amide:sc= 0.0084 X(o=0.0084,f=-0.13) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0.0982 USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 60 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 GLN : amide:sc= -0.487 X(o=-0.49,f=-0.33) USER MOD Single : A 64 HIS : no HE2:sc= -0.415 X(o=-0.41,f=-0.53) USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 69 SER OG : rot 51:sc= 0.359 USER MOD Single : A 72 ASN : amide:sc= 0.213 K(o=0.21,f=-1.9) USER MOD Single : A 74 TYR OH : rot 30:sc= -0.529 USER MOD Single : A 75 MET CE :methyl 147:sc= -0.427 (180deg=-4.33!) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 78 TYR OH : rot -149:sc= 0.886 USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 LYS NZ :NH3+ 171:sc= 0.601 (180deg=0.547) USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 89 THR OG1 : rot 180:sc= 0.0224 USER MOD Single : A 93 THR OG1 : rot 180:sc= 0.00908 USER MOD Single : A 95 MET CE :methyl -160:sc= -0.183 (180deg=-0.74) USER MOD Single : A 98 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 108 TYR OH : rot 72:sc= 0.116 USER MOD Single : A 118 THR OG1 : rot -3:sc= 1.02 USER MOD Single : A 121 GLN : amide:sc= -0.148 X(o=-0.15,f=0) USER MOD Single : A 122 MET CE :methyl -116:sc= -0.317 (180deg=-1.75) USER MOD Single : A 126 GLN : amide:sc= -0.701 K(o=-0.7,f=-0.058) USER MOD Single : A 127 GLN : amide:sc= 0 X(o=0,f=-0.072) USER MOD Single : A 128 MET CE :methyl 168:sc= -0.0351 (180deg=-0.296) USER MOD Single : A 129 GLN : amide:sc=-0.00389 X(o=-0.0039,f=-0.033) USER MOD Single : A 134 ASN : amide:sc= 0.32 K(o=0.32,f=-5.4!) USER MOD Single : A 137 THR OG1 : rot 180:sc=-0.00572 USER MOD Single : A 139 THR OG1 : rot 180:sc= 0 USER MOD Single : A 143 SER OG : rot 180:sc= 0 USER MOD Single : A 144 THR OG1 : rot -39:sc= 0.483 USER MOD ----------------------------------------------------------------- ATOM 1 N ILE A 1 33.331 -18.685 15.686 1.00 0.00 N ATOM 2 CA ILE A 1 32.210 -17.865 15.189 1.00 0.00 C ATOM 3 C ILE A 1 32.848 -16.579 14.660 1.00 0.00 C ATOM 4 O ILE A 1 33.842 -16.163 15.263 1.00 0.00 O ATOM 5 CB ILE A 1 31.184 -17.576 16.322 1.00 0.00 C ATOM 6 CG1 ILE A 1 30.865 -18.808 17.207 1.00 0.00 C ATOM 7 CG2 ILE A 1 29.862 -16.994 15.791 1.00 0.00 C ATOM 8 CD1 ILE A 1 30.337 -20.039 16.455 1.00 0.00 C ATOM 0 H1 ILE A 1 33.082 -19.692 15.617 1.00 0.00 H new ATOM 0 H2 ILE A 1 34.179 -18.498 15.113 1.00 0.00 H new ATOM 0 H3 ILE A 1 33.524 -18.444 16.679 1.00 0.00 H new ATOM 0 HA ILE A 1 31.648 -18.376 14.407 1.00 0.00 H new ATOM 0 HB ILE A 1 31.684 -16.832 16.942 1.00 0.00 H new ATOM 0 HG12 ILE A 1 31.770 -19.092 17.745 1.00 0.00 H new ATOM 0 HG13 ILE A 1 30.128 -18.516 17.955 1.00 0.00 H new ATOM 0 HG21 ILE A 1 29.184 -16.812 16.625 1.00 0.00 H new ATOM 0 HG22 ILE A 1 30.060 -16.056 15.272 1.00 0.00 H new ATOM 0 HG23 ILE A 1 29.405 -17.702 15.099 1.00 0.00 H new ATOM 0 HD11 ILE A 1 30.145 -20.844 17.164 1.00 0.00 H new ATOM 0 HD12 ILE A 1 29.412 -19.781 15.940 1.00 0.00 H new ATOM 0 HD13 ILE A 1 31.079 -20.366 15.727 1.00 0.00 H new ATOM 20 N PRO A 2 32.340 -15.974 13.574 1.00 0.00 N ATOM 21 CA PRO A 2 32.735 -14.628 13.170 1.00 0.00 C ATOM 22 C PRO A 2 32.284 -13.593 14.213 1.00 0.00 C ATOM 23 O PRO A 2 31.619 -13.932 15.196 1.00 0.00 O ATOM 24 CB PRO A 2 32.081 -14.408 11.799 1.00 0.00 C ATOM 25 CG PRO A 2 30.859 -15.322 11.831 1.00 0.00 C ATOM 26 CD PRO A 2 31.345 -16.511 12.656 1.00 0.00 C ATOM 0 HA PRO A 2 33.817 -14.513 13.102 1.00 0.00 H new ATOM 0 HB2 PRO A 2 31.798 -13.366 11.653 1.00 0.00 H new ATOM 0 HB3 PRO A 2 32.757 -14.672 10.986 1.00 0.00 H new ATOM 0 HG2 PRO A 2 30.001 -14.833 12.293 1.00 0.00 H new ATOM 0 HG3 PRO A 2 30.553 -15.623 10.829 1.00 0.00 H new ATOM 0 HD2 PRO A 2 30.521 -16.974 13.199 1.00 0.00 H new ATOM 0 HD3 PRO A 2 31.777 -17.281 12.017 1.00 0.00 H new ATOM 34 N LYS A 3 32.666 -12.333 14.007 1.00 0.00 N ATOM 35 CA LYS A 3 32.246 -11.167 14.790 1.00 0.00 C ATOM 36 C LYS A 3 32.021 -9.982 13.835 1.00 0.00 C ATOM 37 O LYS A 3 32.428 -8.861 14.139 1.00 0.00 O ATOM 38 CB LYS A 3 33.310 -10.838 15.858 1.00 0.00 C ATOM 39 CG LYS A 3 33.559 -11.959 16.884 1.00 0.00 C ATOM 40 CD LYS A 3 34.582 -11.551 17.955 1.00 0.00 C ATOM 41 CE LYS A 3 35.991 -11.422 17.356 1.00 0.00 C ATOM 42 NZ LYS A 3 36.994 -10.998 18.361 1.00 0.00 N ATOM 0 H LYS A 3 33.307 -12.084 13.254 1.00 0.00 H new ATOM 0 HA LYS A 3 31.312 -11.379 15.311 1.00 0.00 H new ATOM 0 HB2 LYS A 3 34.250 -10.608 15.356 1.00 0.00 H new ATOM 0 HB3 LYS A 3 33.004 -9.938 16.391 1.00 0.00 H new ATOM 0 HG2 LYS A 3 32.618 -12.224 17.366 1.00 0.00 H new ATOM 0 HG3 LYS A 3 33.914 -12.850 16.366 1.00 0.00 H new ATOM 0 HD2 LYS A 3 34.286 -10.602 18.402 1.00 0.00 H new ATOM 0 HD3 LYS A 3 34.590 -12.291 18.755 1.00 0.00 H new ATOM 0 HE2 LYS A 3 36.291 -12.379 16.929 1.00 0.00 H new ATOM 0 HE3 LYS A 3 35.971 -10.700 16.539 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 37.928 -10.925 17.910 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 36.725 -10.072 18.751 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 37.034 -11.699 19.128 1.00 0.00 H new ATOM 56 N HIS A 4 31.532 -10.253 12.624 1.00 0.00 N ATOM 57 CA HIS A 4 31.570 -9.372 11.460 1.00 0.00 C ATOM 58 C HIS A 4 30.723 -9.968 10.326 1.00 0.00 C ATOM 59 O HIS A 4 30.452 -11.173 10.341 1.00 0.00 O ATOM 60 CB HIS A 4 33.038 -9.125 11.019 1.00 0.00 C ATOM 61 CG HIS A 4 34.029 -10.195 11.431 1.00 0.00 C ATOM 62 ND1 HIS A 4 35.043 -10.002 12.341 1.00 0.00 N ATOM 63 CD2 HIS A 4 33.979 -11.535 11.144 1.00 0.00 C ATOM 64 CE1 HIS A 4 35.581 -11.201 12.613 1.00 0.00 C ATOM 65 NE2 HIS A 4 34.915 -12.172 11.973 1.00 0.00 N ATOM 0 H HIS A 4 31.074 -11.141 12.420 1.00 0.00 H new ATOM 0 HA HIS A 4 31.142 -8.404 11.722 1.00 0.00 H new ATOM 0 HB2 HIS A 4 33.062 -9.030 9.933 1.00 0.00 H new ATOM 0 HB3 HIS A 4 33.367 -8.171 11.430 1.00 0.00 H new ATOM 0 HD1 HIS A 4 35.334 -9.108 12.738 1.00 0.00 H new ATOM 0 HD2 HIS A 4 33.339 -12.011 10.416 1.00 0.00 H new ATOM 0 HE1 HIS A 4 36.432 -11.361 13.258 1.00 0.00 H new ATOM 73 N PRO A 5 30.316 -9.153 9.333 1.00 0.00 N ATOM 74 CA PRO A 5 29.700 -9.626 8.094 1.00 0.00 C ATOM 75 C PRO A 5 30.724 -10.200 7.105 1.00 0.00 C ATOM 76 O PRO A 5 30.329 -10.776 6.088 1.00 0.00 O ATOM 77 CB PRO A 5 28.998 -8.398 7.513 1.00 0.00 C ATOM 78 CG PRO A 5 29.897 -7.246 7.953 1.00 0.00 C ATOM 79 CD PRO A 5 30.386 -7.695 9.330 1.00 0.00 C ATOM 0 HA PRO A 5 29.012 -10.449 8.287 1.00 0.00 H new ATOM 0 HB2 PRO A 5 28.918 -8.455 6.427 1.00 0.00 H new ATOM 0 HB3 PRO A 5 27.985 -8.291 7.902 1.00 0.00 H new ATOM 0 HG2 PRO A 5 30.725 -7.094 7.261 1.00 0.00 H new ATOM 0 HG3 PRO A 5 29.349 -6.305 8.007 1.00 0.00 H new ATOM 0 HD2 PRO A 5 31.405 -7.354 9.511 1.00 0.00 H new ATOM 0 HD3 PRO A 5 29.764 -7.274 10.120 1.00 0.00 H new ATOM 87 N ASP A 6 32.018 -10.049 7.411 1.00 0.00 N ATOM 88 CA ASP A 6 33.171 -10.576 6.675 1.00 0.00 C ATOM 89 C ASP A 6 33.256 -10.052 5.231 1.00 0.00 C ATOM 90 O ASP A 6 33.898 -10.645 4.367 1.00 0.00 O ATOM 91 CB ASP A 6 33.242 -12.117 6.834 1.00 0.00 C ATOM 92 CG ASP A 6 34.491 -12.618 7.574 1.00 0.00 C ATOM 93 OD1 ASP A 6 35.073 -11.826 8.351 1.00 0.00 O ATOM 94 OD2 ASP A 6 34.782 -13.828 7.454 1.00 0.00 O ATOM 0 H ASP A 6 32.305 -9.520 8.234 1.00 0.00 H new ATOM 0 HA ASP A 6 34.085 -10.184 7.121 1.00 0.00 H new ATOM 0 HB2 ASP A 6 32.356 -12.457 7.370 1.00 0.00 H new ATOM 0 HB3 ASP A 6 33.212 -12.575 5.845 1.00 0.00 H new ATOM 99 N SER A 7 32.608 -8.915 4.952 1.00 0.00 N ATOM 100 CA SER A 7 32.665 -8.210 3.678 1.00 0.00 C ATOM 101 C SER A 7 32.380 -6.716 3.894 1.00 0.00 C ATOM 102 O SER A 7 32.175 -6.283 5.032 1.00 0.00 O ATOM 103 CB SER A 7 31.720 -8.906 2.680 1.00 0.00 C ATOM 104 OG SER A 7 30.435 -9.173 3.223 1.00 0.00 O ATOM 0 H SER A 7 32.010 -8.449 5.635 1.00 0.00 H new ATOM 0 HA SER A 7 33.663 -8.254 3.241 1.00 0.00 H new ATOM 0 HB2 SER A 7 31.611 -8.279 1.795 1.00 0.00 H new ATOM 0 HB3 SER A 7 32.172 -9.843 2.354 1.00 0.00 H new ATOM 0 HG SER A 7 29.879 -9.613 2.546 1.00 0.00 H new ATOM 110 N GLU A 8 32.394 -5.919 2.821 1.00 0.00 N ATOM 111 CA GLU A 8 32.235 -4.476 2.839 1.00 0.00 C ATOM 112 C GLU A 8 31.180 -4.119 1.802 1.00 0.00 C ATOM 113 O GLU A 8 31.459 -3.804 0.644 1.00 0.00 O ATOM 114 CB GLU A 8 33.580 -3.740 2.645 1.00 0.00 C ATOM 115 CG GLU A 8 33.919 -2.875 3.863 1.00 0.00 C ATOM 116 CD GLU A 8 32.783 -1.909 4.237 1.00 0.00 C ATOM 117 OE1 GLU A 8 32.539 -0.934 3.491 1.00 0.00 O ATOM 118 OE2 GLU A 8 32.090 -2.218 5.234 1.00 0.00 O ATOM 0 H GLU A 8 32.523 -6.286 1.878 1.00 0.00 H new ATOM 0 HA GLU A 8 31.893 -4.138 3.817 1.00 0.00 H new ATOM 0 HB2 GLU A 8 34.375 -4.467 2.480 1.00 0.00 H new ATOM 0 HB3 GLU A 8 33.530 -3.114 1.754 1.00 0.00 H new ATOM 0 HG2 GLU A 8 34.136 -3.521 4.714 1.00 0.00 H new ATOM 0 HG3 GLU A 8 34.824 -2.303 3.657 1.00 0.00 H new ATOM 125 N ALA A 9 29.933 -4.247 2.233 1.00 0.00 N ATOM 126 CA ALA A 9 28.747 -3.791 1.534 1.00 0.00 C ATOM 127 C ALA A 9 28.015 -2.840 2.472 1.00 0.00 C ATOM 128 O ALA A 9 27.226 -3.277 3.314 1.00 0.00 O ATOM 129 CB ALA A 9 27.893 -4.985 1.105 1.00 0.00 C ATOM 0 H ALA A 9 29.714 -4.694 3.123 1.00 0.00 H new ATOM 0 HA ALA A 9 28.996 -3.261 0.614 1.00 0.00 H new ATOM 0 HB1 ALA A 9 27.006 -4.628 0.581 1.00 0.00 H new ATOM 0 HB2 ALA A 9 28.472 -5.627 0.442 1.00 0.00 H new ATOM 0 HB3 ALA A 9 27.591 -5.552 1.986 1.00 0.00 H new ATOM 135 N VAL A 10 28.334 -1.551 2.381 1.00 0.00 N ATOM 136 CA VAL A 10 27.709 -0.494 3.162 1.00 0.00 C ATOM 137 C VAL A 10 27.286 0.588 2.174 1.00 0.00 C ATOM 138 O VAL A 10 28.104 1.385 1.699 1.00 0.00 O ATOM 139 CB VAL A 10 28.642 -0.001 4.284 1.00 0.00 C ATOM 140 CG1 VAL A 10 27.987 1.113 5.117 1.00 0.00 C ATOM 141 CG2 VAL A 10 29.016 -1.147 5.233 1.00 0.00 C ATOM 0 H VAL A 10 29.053 -1.207 1.745 1.00 0.00 H new ATOM 0 HA VAL A 10 26.826 -0.847 3.694 1.00 0.00 H new ATOM 0 HB VAL A 10 29.535 0.387 3.794 1.00 0.00 H new ATOM 0 HG11 VAL A 10 28.675 1.435 5.899 1.00 0.00 H new ATOM 0 HG12 VAL A 10 27.750 1.958 4.471 1.00 0.00 H new ATOM 0 HG13 VAL A 10 27.071 0.736 5.573 1.00 0.00 H new ATOM 0 HG21 VAL A 10 29.675 -0.771 6.015 1.00 0.00 H new ATOM 0 HG22 VAL A 10 28.112 -1.555 5.685 1.00 0.00 H new ATOM 0 HG23 VAL A 10 29.527 -1.931 4.674 1.00 0.00 H new ATOM 151 N ALA A 11 26.000 0.580 1.846 1.00 0.00 N ATOM 152 CA ALA A 11 25.320 1.530 0.984 1.00 0.00 C ATOM 153 C ALA A 11 24.165 2.161 1.774 1.00 0.00 C ATOM 154 O ALA A 11 23.767 1.633 2.818 1.00 0.00 O ATOM 155 CB ALA A 11 24.828 0.783 -0.263 1.00 0.00 C ATOM 0 H ALA A 11 25.367 -0.137 2.199 1.00 0.00 H new ATOM 0 HA ALA A 11 25.984 2.331 0.659 1.00 0.00 H new ATOM 0 HB1 ALA A 11 24.313 1.479 -0.925 1.00 0.00 H new ATOM 0 HB2 ALA A 11 25.679 0.347 -0.786 1.00 0.00 H new ATOM 0 HB3 ALA A 11 24.141 -0.009 0.035 1.00 0.00 H new ATOM 161 N PRO A 12 23.608 3.288 1.311 1.00 0.00 N ATOM 162 CA PRO A 12 22.367 3.812 1.852 1.00 0.00 C ATOM 163 C PRO A 12 21.232 2.867 1.473 1.00 0.00 C ATOM 164 O PRO A 12 21.151 2.419 0.326 1.00 0.00 O ATOM 165 CB PRO A 12 22.192 5.185 1.213 1.00 0.00 C ATOM 166 CG PRO A 12 22.941 5.063 -0.108 1.00 0.00 C ATOM 167 CD PRO A 12 24.077 4.104 0.204 1.00 0.00 C ATOM 0 HA PRO A 12 22.371 3.896 2.939 1.00 0.00 H new ATOM 0 HB2 PRO A 12 21.140 5.423 1.057 1.00 0.00 H new ATOM 0 HB3 PRO A 12 22.608 5.974 1.839 1.00 0.00 H new ATOM 0 HG2 PRO A 12 22.297 4.676 -0.898 1.00 0.00 H new ATOM 0 HG3 PRO A 12 23.315 6.029 -0.446 1.00 0.00 H new ATOM 0 HD2 PRO A 12 24.319 3.488 -0.662 1.00 0.00 H new ATOM 0 HD3 PRO A 12 24.984 4.645 0.473 1.00 0.00 H new ATOM 175 N ASP A 13 20.336 2.596 2.417 1.00 0.00 N ATOM 176 CA ASP A 13 19.112 1.863 2.100 1.00 0.00 C ATOM 177 C ASP A 13 18.079 2.876 1.574 1.00 0.00 C ATOM 178 O ASP A 13 18.068 4.017 2.050 1.00 0.00 O ATOM 179 CB ASP A 13 18.604 1.092 3.326 1.00 0.00 C ATOM 180 CG ASP A 13 17.835 -0.169 2.916 1.00 0.00 C ATOM 181 OD1 ASP A 13 18.456 -1.054 2.277 1.00 0.00 O ATOM 182 OD2 ASP A 13 16.629 -0.287 3.242 1.00 0.00 O ATOM 0 H ASP A 13 20.430 2.868 3.396 1.00 0.00 H new ATOM 0 HA ASP A 13 19.300 1.113 1.331 1.00 0.00 H new ATOM 0 HB2 ASP A 13 19.447 0.816 3.959 1.00 0.00 H new ATOM 0 HB3 ASP A 13 17.957 1.737 3.921 1.00 0.00 H new ATOM 187 N PRO A 14 17.228 2.517 0.601 1.00 0.00 N ATOM 188 CA PRO A 14 16.418 3.477 -0.148 1.00 0.00 C ATOM 189 C PRO A 14 15.163 3.966 0.603 1.00 0.00 C ATOM 190 O PRO A 14 14.996 3.760 1.813 1.00 0.00 O ATOM 191 CB PRO A 14 16.104 2.756 -1.470 1.00 0.00 C ATOM 192 CG PRO A 14 16.114 1.283 -1.096 1.00 0.00 C ATOM 193 CD PRO A 14 17.234 1.229 -0.071 1.00 0.00 C ATOM 0 HA PRO A 14 16.955 4.412 -0.310 1.00 0.00 H new ATOM 0 HB2 PRO A 14 15.137 3.060 -1.870 1.00 0.00 H new ATOM 0 HB3 PRO A 14 16.849 2.979 -2.233 1.00 0.00 H new ATOM 0 HG2 PRO A 14 15.161 0.961 -0.677 1.00 0.00 H new ATOM 0 HG3 PRO A 14 16.316 0.644 -1.956 1.00 0.00 H new ATOM 0 HD2 PRO A 14 17.073 0.418 0.639 1.00 0.00 H new ATOM 0 HD3 PRO A 14 18.194 1.045 -0.553 1.00 0.00 H new ATOM 201 N PHE A 15 14.273 4.619 -0.161 1.00 0.00 N ATOM 202 CA PHE A 15 12.987 5.187 0.233 1.00 0.00 C ATOM 203 C PHE A 15 13.176 6.305 1.261 1.00 0.00 C ATOM 204 O PHE A 15 12.961 6.110 2.458 1.00 0.00 O ATOM 205 CB PHE A 15 12.023 4.111 0.742 1.00 0.00 C ATOM 206 CG PHE A 15 11.840 2.863 -0.092 1.00 0.00 C ATOM 207 CD1 PHE A 15 10.848 2.830 -1.082 1.00 0.00 C ATOM 208 CD2 PHE A 15 12.562 1.696 0.212 1.00 0.00 C ATOM 209 CE1 PHE A 15 10.509 1.619 -1.707 1.00 0.00 C ATOM 210 CE2 PHE A 15 12.265 0.494 -0.453 1.00 0.00 C ATOM 211 CZ PHE A 15 11.218 0.446 -1.390 1.00 0.00 C ATOM 0 H PHE A 15 14.456 4.773 -1.153 1.00 0.00 H new ATOM 0 HA PHE A 15 12.533 5.624 -0.656 1.00 0.00 H new ATOM 0 HB2 PHE A 15 12.360 3.803 1.732 1.00 0.00 H new ATOM 0 HB3 PHE A 15 11.044 4.574 0.868 1.00 0.00 H new ATOM 0 HD1 PHE A 15 10.342 3.741 -1.366 1.00 0.00 H new ATOM 0 HD2 PHE A 15 13.344 1.723 0.956 1.00 0.00 H new ATOM 0 HE1 PHE A 15 9.706 1.588 -2.429 1.00 0.00 H new ATOM 0 HE2 PHE A 15 12.842 -0.395 -0.244 1.00 0.00 H new ATOM 0 HZ PHE A 15 10.959 -0.489 -1.865 1.00 0.00 H new ATOM 221 N ASN A 16 13.585 7.484 0.787 1.00 0.00 N ATOM 222 CA ASN A 16 13.855 8.618 1.681 1.00 0.00 C ATOM 223 C ASN A 16 12.583 8.996 2.442 1.00 0.00 C ATOM 224 O ASN A 16 11.509 9.012 1.838 1.00 0.00 O ATOM 225 CB ASN A 16 14.368 9.852 0.909 1.00 0.00 C ATOM 226 CG ASN A 16 15.772 10.225 1.352 1.00 0.00 C ATOM 227 OD1 ASN A 16 16.708 9.474 1.103 1.00 0.00 O ATOM 228 ND2 ASN A 16 15.959 11.363 1.993 1.00 0.00 N ATOM 0 H ASN A 16 13.736 7.680 -0.202 1.00 0.00 H new ATOM 0 HA ASN A 16 14.633 8.305 2.377 1.00 0.00 H new ATOM 0 HB2 ASN A 16 14.363 9.644 -0.161 1.00 0.00 H new ATOM 0 HB3 ASN A 16 13.695 10.694 1.073 1.00 0.00 H new ATOM 0 HD21 ASN A 16 16.897 11.632 2.291 1.00 0.00 H new ATOM 0 HD22 ASN A 16 15.166 11.974 2.190 1.00 0.00 H new ATOM 235 N PRO A 17 12.678 9.423 3.712 1.00 0.00 N ATOM 236 CA PRO A 17 11.525 9.840 4.509 1.00 0.00 C ATOM 237 C PRO A 17 10.945 11.184 4.046 1.00 0.00 C ATOM 238 O PRO A 17 9.825 11.545 4.412 1.00 0.00 O ATOM 239 CB PRO A 17 12.040 9.910 5.946 1.00 0.00 C ATOM 240 CG PRO A 17 13.530 10.210 5.778 1.00 0.00 C ATOM 241 CD PRO A 17 13.898 9.482 4.500 1.00 0.00 C ATOM 0 HA PRO A 17 10.699 9.137 4.405 1.00 0.00 H new ATOM 0 HB2 PRO A 17 11.535 10.690 6.515 1.00 0.00 H new ATOM 0 HB3 PRO A 17 11.877 8.972 6.477 1.00 0.00 H new ATOM 0 HG2 PRO A 17 13.717 11.281 5.697 1.00 0.00 H new ATOM 0 HG3 PRO A 17 14.110 9.848 6.627 1.00 0.00 H new ATOM 0 HD2 PRO A 17 14.686 10.010 3.962 1.00 0.00 H new ATOM 0 HD3 PRO A 17 14.274 8.482 4.714 1.00 0.00 H new ATOM 249 N ALA A 18 11.694 11.929 3.232 1.00 0.00 N ATOM 250 CA ALA A 18 11.342 13.228 2.684 1.00 0.00 C ATOM 251 C ALA A 18 10.452 13.109 1.432 1.00 0.00 C ATOM 252 O ALA A 18 10.555 13.929 0.519 1.00 0.00 O ATOM 253 CB ALA A 18 12.648 13.971 2.389 1.00 0.00 C ATOM 0 H ALA A 18 12.615 11.619 2.923 1.00 0.00 H new ATOM 0 HA ALA A 18 10.747 13.787 3.406 1.00 0.00 H new ATOM 0 HB1 ALA A 18 12.422 14.954 1.975 1.00 0.00 H new ATOM 0 HB2 ALA A 18 13.216 14.088 3.312 1.00 0.00 H new ATOM 0 HB3 ALA A 18 13.237 13.401 1.670 1.00 0.00 H new ATOM 259 N ALA A 19 9.601 12.086 1.337 1.00 0.00 N ATOM 260 CA ALA A 19 8.796 11.804 0.150 1.00 0.00 C ATOM 261 C ALA A 19 7.329 11.556 0.493 1.00 0.00 C ATOM 262 O ALA A 19 6.462 11.874 -0.320 1.00 0.00 O ATOM 263 CB ALA A 19 9.426 10.624 -0.597 1.00 0.00 C ATOM 0 H ALA A 19 9.450 11.420 2.095 1.00 0.00 H new ATOM 0 HA ALA A 19 8.795 12.679 -0.500 1.00 0.00 H new ATOM 0 HB1 ALA A 19 8.837 10.400 -1.486 1.00 0.00 H new ATOM 0 HB2 ALA A 19 10.444 10.881 -0.891 1.00 0.00 H new ATOM 0 HB3 ALA A 19 9.446 9.750 0.054 1.00 0.00 H new ATOM 269 N THR A 20 7.020 11.056 1.693 1.00 0.00 N ATOM 270 CA THR A 20 5.631 10.823 2.082 1.00 0.00 C ATOM 271 C THR A 20 4.871 12.150 2.229 1.00 0.00 C ATOM 272 O THR A 20 3.648 12.165 2.166 1.00 0.00 O ATOM 273 CB THR A 20 5.538 9.960 3.353 1.00 0.00 C ATOM 274 OG1 THR A 20 6.449 8.886 3.328 1.00 0.00 O ATOM 275 CG2 THR A 20 4.172 9.284 3.461 1.00 0.00 C ATOM 0 H THR A 20 7.708 10.808 2.404 1.00 0.00 H new ATOM 0 HA THR A 20 5.149 10.259 1.283 1.00 0.00 H new ATOM 0 HB THR A 20 5.737 10.646 4.176 1.00 0.00 H new ATOM 0 HG1 THR A 20 6.082 8.134 3.838 1.00 0.00 H new ATOM 0 HG21 THR A 20 4.135 8.681 4.368 1.00 0.00 H new ATOM 0 HG22 THR A 20 3.392 10.044 3.499 1.00 0.00 H new ATOM 0 HG23 THR A 20 4.013 8.644 2.593 1.00 0.00 H new ATOM 283 N GLN A 21 5.571 13.282 2.347 1.00 0.00 N ATOM 284 CA GLN A 21 4.991 14.612 2.487 1.00 0.00 C ATOM 285 C GLN A 21 4.087 15.030 1.319 1.00 0.00 C ATOM 286 O GLN A 21 3.420 16.055 1.422 1.00 0.00 O ATOM 287 CB GLN A 21 6.118 15.627 2.700 1.00 0.00 C ATOM 288 CG GLN A 21 6.932 15.894 1.440 1.00 0.00 C ATOM 289 CD GLN A 21 8.169 16.732 1.727 1.00 0.00 C ATOM 290 OE1 GLN A 21 8.111 17.766 2.389 1.00 0.00 O ATOM 291 NE2 GLN A 21 9.302 16.272 1.237 1.00 0.00 N ATOM 0 H GLN A 21 6.591 13.293 2.347 1.00 0.00 H new ATOM 0 HA GLN A 21 4.332 14.585 3.355 1.00 0.00 H new ATOM 0 HB2 GLN A 21 5.691 16.565 3.054 1.00 0.00 H new ATOM 0 HB3 GLN A 21 6.783 15.263 3.484 1.00 0.00 H new ATOM 0 HG2 GLN A 21 7.232 14.945 0.995 1.00 0.00 H new ATOM 0 HG3 GLN A 21 6.309 16.407 0.708 1.00 0.00 H new ATOM 0 HE21 GLN A 21 9.309 15.410 0.692 1.00 0.00 H new ATOM 0 HE22 GLN A 21 10.172 16.778 1.402 1.00 0.00 H new ATOM 300 N LEU A 22 4.091 14.283 0.213 1.00 0.00 N ATOM 301 CA LEU A 22 3.415 14.616 -1.039 1.00 0.00 C ATOM 302 C LEU A 22 2.169 13.751 -1.254 1.00 0.00 C ATOM 303 O LEU A 22 1.605 13.738 -2.344 1.00 0.00 O ATOM 304 CB LEU A 22 4.401 14.426 -2.205 1.00 0.00 C ATOM 305 CG LEU A 22 5.733 15.184 -2.052 1.00 0.00 C ATOM 306 CD1 LEU A 22 6.703 14.776 -3.153 1.00 0.00 C ATOM 307 CD2 LEU A 22 5.541 16.697 -2.028 1.00 0.00 C ATOM 0 H LEU A 22 4.587 13.393 0.165 1.00 0.00 H new ATOM 0 HA LEU A 22 3.086 15.654 -0.992 1.00 0.00 H new ATOM 0 HB2 LEU A 22 4.614 13.363 -2.313 1.00 0.00 H new ATOM 0 HB3 LEU A 22 3.918 14.750 -3.127 1.00 0.00 H new ATOM 0 HG LEU A 22 6.156 14.906 -1.087 1.00 0.00 H new ATOM 0 HD11 LEU A 22 7.640 15.320 -3.032 1.00 0.00 H new ATOM 0 HD12 LEU A 22 6.894 13.705 -3.091 1.00 0.00 H new ATOM 0 HD13 LEU A 22 6.270 15.011 -4.125 1.00 0.00 H new ATOM 0 HD21 LEU A 22 6.510 17.185 -1.919 1.00 0.00 H new ATOM 0 HD22 LEU A 22 5.075 17.019 -2.959 1.00 0.00 H new ATOM 0 HD23 LEU A 22 4.901 16.969 -1.189 1.00 0.00 H new ATOM 319 N LEU A 23 1.772 12.955 -0.257 1.00 0.00 N ATOM 320 CA LEU A 23 0.699 11.961 -0.348 1.00 0.00 C ATOM 321 C LEU A 23 -0.680 12.640 -0.305 1.00 0.00 C ATOM 322 O LEU A 23 -1.527 12.289 0.513 1.00 0.00 O ATOM 323 CB LEU A 23 0.900 10.894 0.760 1.00 0.00 C ATOM 324 CG LEU A 23 1.772 9.682 0.377 1.00 0.00 C ATOM 325 CD1 LEU A 23 0.916 8.639 -0.338 1.00 0.00 C ATOM 326 CD2 LEU A 23 2.993 10.002 -0.501 1.00 0.00 C ATOM 0 H LEU A 23 2.203 12.986 0.667 1.00 0.00 H new ATOM 0 HA LEU A 23 0.741 11.446 -1.308 1.00 0.00 H new ATOM 0 HB2 LEU A 23 1.347 11.379 1.628 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -0.080 10.529 1.068 1.00 0.00 H new ATOM 0 HG LEU A 23 2.169 9.310 1.322 1.00 0.00 H new ATOM 0 HD11 LEU A 23 1.535 7.783 -0.608 1.00 0.00 H new ATOM 0 HD12 LEU A 23 0.113 8.312 0.323 1.00 0.00 H new ATOM 0 HD13 LEU A 23 0.488 9.076 -1.240 1.00 0.00 H new ATOM 0 HD21 LEU A 23 3.539 9.083 -0.714 1.00 0.00 H new ATOM 0 HD22 LEU A 23 2.661 10.451 -1.437 1.00 0.00 H new ATOM 0 HD23 LEU A 23 3.646 10.699 0.024 1.00 0.00 H new ATOM 338 N ASP A 24 -0.931 13.645 -1.146 1.00 0.00 N ATOM 339 CA ASP A 24 -2.082 14.540 -0.978 1.00 0.00 C ATOM 340 C ASP A 24 -2.716 15.063 -2.264 1.00 0.00 C ATOM 341 O ASP A 24 -3.748 15.730 -2.202 1.00 0.00 O ATOM 342 CB ASP A 24 -1.722 15.661 -0.003 1.00 0.00 C ATOM 343 CG ASP A 24 -0.849 16.750 -0.610 1.00 0.00 C ATOM 344 OD1 ASP A 24 0.367 16.494 -0.740 1.00 0.00 O ATOM 345 OD2 ASP A 24 -1.309 17.905 -0.716 1.00 0.00 O ATOM 0 H ASP A 24 -0.350 13.862 -1.956 1.00 0.00 H new ATOM 0 HA ASP A 24 -2.878 13.926 -0.557 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -2.641 16.112 0.372 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -1.205 15.231 0.855 1.00 0.00 H new ATOM 350 N ASP A 25 -2.193 14.655 -3.418 1.00 0.00 N ATOM 351 CA ASP A 25 -2.976 14.478 -4.652 1.00 0.00 C ATOM 352 C ASP A 25 -3.013 13.010 -5.086 1.00 0.00 C ATOM 353 O ASP A 25 -3.659 12.657 -6.075 1.00 0.00 O ATOM 354 CB ASP A 25 -2.357 15.308 -5.794 1.00 0.00 C ATOM 355 CG ASP A 25 -1.062 14.686 -6.349 1.00 0.00 C ATOM 356 OD1 ASP A 25 -1.113 13.693 -7.116 1.00 0.00 O ATOM 357 OD2 ASP A 25 0.033 15.198 -6.034 1.00 0.00 O ATOM 0 H ASP A 25 -1.204 14.434 -3.530 1.00 0.00 H new ATOM 0 HA ASP A 25 -3.992 14.813 -4.444 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -3.083 15.405 -6.601 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -2.146 16.314 -5.432 1.00 0.00 H new ATOM 362 N THR A 26 -2.226 12.170 -4.411 1.00 0.00 N ATOM 363 CA THR A 26 -1.759 10.922 -4.984 1.00 0.00 C ATOM 364 C THR A 26 -2.876 9.865 -5.055 1.00 0.00 C ATOM 365 O THR A 26 -4.035 10.123 -4.745 1.00 0.00 O ATOM 366 CB THR A 26 -0.509 10.458 -4.227 1.00 0.00 C ATOM 367 OG1 THR A 26 -0.837 10.238 -2.879 1.00 0.00 O ATOM 368 CG2 THR A 26 0.675 11.427 -4.255 1.00 0.00 C ATOM 0 H THR A 26 -1.901 12.340 -3.459 1.00 0.00 H new ATOM 0 HA THR A 26 -1.472 11.081 -6.024 1.00 0.00 H new ATOM 0 HB THR A 26 -0.190 9.554 -4.746 1.00 0.00 H new ATOM 0 HG1 THR A 26 -0.983 11.098 -2.433 1.00 0.00 H new ATOM 0 HG21 THR A 26 1.506 11.003 -3.691 1.00 0.00 H new ATOM 0 HG22 THR A 26 0.985 11.593 -5.287 1.00 0.00 H new ATOM 0 HG23 THR A 26 0.379 12.376 -3.807 1.00 0.00 H new ATOM 376 N SER A 27 -2.580 8.644 -5.498 1.00 0.00 N ATOM 377 CA SER A 27 -3.618 7.632 -5.635 1.00 0.00 C ATOM 378 C SER A 27 -3.045 6.247 -5.414 1.00 0.00 C ATOM 379 O SER A 27 -3.291 5.671 -4.367 1.00 0.00 O ATOM 380 CB SER A 27 -4.301 7.810 -6.989 1.00 0.00 C ATOM 381 OG SER A 27 -5.188 8.912 -6.992 1.00 0.00 O ATOM 0 H SER A 27 -1.644 8.338 -5.764 1.00 0.00 H new ATOM 0 HA SER A 27 -4.382 7.754 -4.867 1.00 0.00 H new ATOM 0 HB2 SER A 27 -3.545 7.951 -7.761 1.00 0.00 H new ATOM 0 HB3 SER A 27 -4.849 6.902 -7.241 1.00 0.00 H new ATOM 0 HG SER A 27 -5.010 9.478 -6.212 1.00 0.00 H new ATOM 387 N TRP A 28 -2.199 5.761 -6.318 1.00 0.00 N ATOM 388 CA TRP A 28 -1.527 4.468 -6.221 1.00 0.00 C ATOM 389 C TRP A 28 -2.489 3.281 -6.393 1.00 0.00 C ATOM 390 O TRP A 28 -3.712 3.423 -6.337 1.00 0.00 O ATOM 391 CB TRP A 28 -0.673 4.341 -4.935 1.00 0.00 C ATOM 392 CG TRP A 28 0.084 5.551 -4.454 1.00 0.00 C ATOM 393 CD1 TRP A 28 -0.418 6.527 -3.662 1.00 0.00 C ATOM 394 CD2 TRP A 28 1.482 5.915 -4.673 1.00 0.00 C ATOM 395 NE1 TRP A 28 0.542 7.480 -3.420 1.00 0.00 N ATOM 396 CE2 TRP A 28 1.733 7.165 -4.030 1.00 0.00 C ATOM 397 CE3 TRP A 28 2.570 5.319 -5.341 1.00 0.00 C ATOM 398 CZ2 TRP A 28 2.977 7.809 -4.089 1.00 0.00 C ATOM 399 CZ3 TRP A 28 3.818 5.964 -5.420 1.00 0.00 C ATOM 400 CH2 TRP A 28 4.026 7.208 -4.802 1.00 0.00 C ATOM 0 H TRP A 28 -1.954 6.273 -7.166 1.00 0.00 H new ATOM 0 HA TRP A 28 -0.836 4.427 -7.063 1.00 0.00 H new ATOM 0 HB2 TRP A 28 -1.333 4.021 -4.129 1.00 0.00 H new ATOM 0 HB3 TRP A 28 0.049 3.540 -5.094 1.00 0.00 H new ATOM 0 HD1 TRP A 28 -1.426 6.553 -3.276 1.00 0.00 H new ATOM 0 HE1 TRP A 28 0.390 8.317 -2.858 1.00 0.00 H new ATOM 0 HE3 TRP A 28 2.444 4.350 -5.801 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 3.126 8.756 -3.592 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 4.626 5.497 -5.963 1.00 0.00 H new ATOM 0 HH2 TRP A 28 4.986 7.698 -4.875 1.00 0.00 H new ATOM 411 N VAL A 29 -1.934 2.097 -6.659 1.00 0.00 N ATOM 412 CA VAL A 29 -2.659 0.835 -6.803 1.00 0.00 C ATOM 413 C VAL A 29 -1.767 -0.250 -6.197 1.00 0.00 C ATOM 414 O VAL A 29 -0.630 -0.420 -6.639 1.00 0.00 O ATOM 415 CB VAL A 29 -2.986 0.562 -8.291 1.00 0.00 C ATOM 416 CG1 VAL A 29 -3.760 -0.752 -8.485 1.00 0.00 C ATOM 417 CG2 VAL A 29 -3.800 1.690 -8.929 1.00 0.00 C ATOM 0 H VAL A 29 -0.928 1.988 -6.785 1.00 0.00 H new ATOM 0 HA VAL A 29 -3.619 0.860 -6.287 1.00 0.00 H new ATOM 0 HB VAL A 29 -2.016 0.493 -8.783 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -3.966 -0.900 -9.545 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -3.163 -1.584 -8.112 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -4.700 -0.705 -7.936 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -4.002 1.448 -9.972 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -4.743 1.806 -8.394 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -3.236 2.621 -8.875 1.00 0.00 H new ATOM 427 N LEU A 30 -2.252 -0.942 -5.162 1.00 0.00 N ATOM 428 CA LEU A 30 -1.603 -2.106 -4.553 1.00 0.00 C ATOM 429 C LEU A 30 -1.556 -3.191 -5.614 1.00 0.00 C ATOM 430 O LEU A 30 -2.567 -3.411 -6.284 1.00 0.00 O ATOM 431 CB LEU A 30 -2.449 -2.584 -3.361 1.00 0.00 C ATOM 432 CG LEU A 30 -1.971 -3.802 -2.537 1.00 0.00 C ATOM 433 CD1 LEU A 30 -2.381 -5.164 -3.104 1.00 0.00 C ATOM 434 CD2 LEU A 30 -0.477 -3.811 -2.245 1.00 0.00 C ATOM 0 H LEU A 30 -3.134 -0.700 -4.711 1.00 0.00 H new ATOM 0 HA LEU A 30 -0.600 -1.865 -4.199 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -2.553 -1.744 -2.674 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -3.446 -2.813 -3.737 1.00 0.00 H new ATOM 0 HG LEU A 30 -2.505 -3.660 -1.598 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -2.001 -5.956 -2.459 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -3.468 -5.226 -3.152 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -1.966 -5.281 -4.105 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -0.225 -4.698 -1.663 1.00 0.00 H new ATOM 0 HD22 LEU A 30 0.077 -3.823 -3.184 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -0.212 -2.918 -1.679 1.00 0.00 H new ATOM 446 N SER A 31 -0.430 -3.890 -5.743 1.00 0.00 N ATOM 447 CA SER A 31 -0.316 -4.978 -6.704 1.00 0.00 C ATOM 448 C SER A 31 0.337 -6.237 -6.123 1.00 0.00 C ATOM 449 O SER A 31 0.272 -7.306 -6.731 1.00 0.00 O ATOM 450 CB SER A 31 0.449 -4.449 -7.924 1.00 0.00 C ATOM 451 OG SER A 31 0.041 -5.040 -9.139 1.00 0.00 O ATOM 0 H SER A 31 0.413 -3.721 -5.194 1.00 0.00 H new ATOM 0 HA SER A 31 -1.317 -5.298 -6.992 1.00 0.00 H new ATOM 0 HB2 SER A 31 0.313 -3.370 -7.989 1.00 0.00 H new ATOM 0 HB3 SER A 31 1.515 -4.628 -7.781 1.00 0.00 H new ATOM 0 HG SER A 31 0.562 -4.662 -9.878 1.00 0.00 H new ATOM 457 N ALA A 32 0.938 -6.172 -4.931 1.00 0.00 N ATOM 458 CA ALA A 32 1.467 -7.358 -4.271 1.00 0.00 C ATOM 459 C ALA A 32 1.510 -7.124 -2.775 1.00 0.00 C ATOM 460 O ALA A 32 1.715 -6.003 -2.315 1.00 0.00 O ATOM 461 CB ALA A 32 2.873 -7.690 -4.784 1.00 0.00 C ATOM 0 H ALA A 32 1.068 -5.307 -4.407 1.00 0.00 H new ATOM 0 HA ALA A 32 0.814 -8.201 -4.495 1.00 0.00 H new ATOM 0 HB1 ALA A 32 3.245 -8.579 -4.275 1.00 0.00 H new ATOM 0 HB2 ALA A 32 2.834 -7.875 -5.857 1.00 0.00 H new ATOM 0 HB3 ALA A 32 3.541 -6.852 -4.584 1.00 0.00 H new ATOM 467 N TRP A 33 1.389 -8.208 -2.026 1.00 0.00 N ATOM 468 CA TRP A 33 1.417 -8.242 -0.578 1.00 0.00 C ATOM 469 C TRP A 33 2.371 -9.363 -0.211 1.00 0.00 C ATOM 470 O TRP A 33 2.061 -10.534 -0.451 1.00 0.00 O ATOM 471 CB TRP A 33 -0.006 -8.483 -0.059 1.00 0.00 C ATOM 472 CG TRP A 33 -0.273 -8.261 1.394 1.00 0.00 C ATOM 473 CD1 TRP A 33 0.605 -8.322 2.423 1.00 0.00 C ATOM 474 CD2 TRP A 33 -1.552 -7.890 1.982 1.00 0.00 C ATOM 475 NE1 TRP A 33 -0.044 -8.008 3.599 1.00 0.00 N ATOM 476 CE2 TRP A 33 -1.386 -7.773 3.391 1.00 0.00 C ATOM 477 CE3 TRP A 33 -2.836 -7.636 1.454 1.00 0.00 C ATOM 478 CZ2 TRP A 33 -2.457 -7.466 4.239 1.00 0.00 C ATOM 479 CZ3 TRP A 33 -3.914 -7.313 2.297 1.00 0.00 C ATOM 480 CH2 TRP A 33 -3.726 -7.243 3.686 1.00 0.00 C ATOM 0 H TRP A 33 1.262 -9.134 -2.435 1.00 0.00 H new ATOM 0 HA TRP A 33 1.757 -7.309 -0.130 1.00 0.00 H new ATOM 0 HB2 TRP A 33 -0.680 -7.839 -0.624 1.00 0.00 H new ATOM 0 HB3 TRP A 33 -0.277 -9.512 -0.294 1.00 0.00 H new ATOM 0 HD1 TRP A 33 1.651 -8.577 2.336 1.00 0.00 H new ATOM 0 HE1 TRP A 33 0.413 -7.956 4.510 1.00 0.00 H new ATOM 0 HE3 TRP A 33 -2.993 -7.691 0.387 1.00 0.00 H new ATOM 0 HZ2 TRP A 33 -2.307 -7.402 5.307 1.00 0.00 H new ATOM 0 HZ3 TRP A 33 -4.889 -7.118 1.875 1.00 0.00 H new ATOM 0 HH2 TRP A 33 -4.562 -7.017 4.331 1.00 0.00 H new ATOM 491 N LYS A 34 3.563 -9.043 0.283 1.00 0.00 N ATOM 492 CA LYS A 34 4.440 -10.033 0.872 1.00 0.00 C ATOM 493 C LYS A 34 4.160 -10.091 2.364 1.00 0.00 C ATOM 494 O LYS A 34 3.939 -9.055 2.995 1.00 0.00 O ATOM 495 CB LYS A 34 5.903 -9.656 0.620 1.00 0.00 C ATOM 496 CG LYS A 34 6.731 -10.930 0.475 1.00 0.00 C ATOM 497 CD LYS A 34 6.766 -11.403 -0.987 1.00 0.00 C ATOM 498 CE LYS A 34 7.984 -10.767 -1.650 1.00 0.00 C ATOM 499 NZ LYS A 34 8.302 -11.362 -2.959 1.00 0.00 N ATOM 0 H LYS A 34 3.941 -8.095 0.284 1.00 0.00 H new ATOM 0 HA LYS A 34 4.259 -11.009 0.422 1.00 0.00 H new ATOM 0 HB2 LYS A 34 5.985 -9.050 -0.282 1.00 0.00 H new ATOM 0 HB3 LYS A 34 6.283 -9.053 1.445 1.00 0.00 H new ATOM 0 HG2 LYS A 34 7.747 -10.749 0.827 1.00 0.00 H new ATOM 0 HG3 LYS A 34 6.311 -11.714 1.104 1.00 0.00 H new ATOM 0 HD2 LYS A 34 6.828 -12.490 -1.036 1.00 0.00 H new ATOM 0 HD3 LYS A 34 5.852 -11.112 -1.505 1.00 0.00 H new ATOM 0 HE2 LYS A 34 7.806 -9.699 -1.776 1.00 0.00 H new ATOM 0 HE3 LYS A 34 8.846 -10.871 -0.991 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 9.137 -10.890 -3.361 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 8.500 -12.376 -2.840 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 7.493 -11.240 -3.601 1.00 0.00 H new ATOM 513 N GLN A 35 4.174 -11.292 2.918 1.00 0.00 N ATOM 514 CA GLN A 35 4.211 -11.513 4.342 1.00 0.00 C ATOM 515 C GLN A 35 5.553 -11.087 4.908 1.00 0.00 C ATOM 516 O GLN A 35 6.550 -11.085 4.184 1.00 0.00 O ATOM 517 CB GLN A 35 4.050 -12.997 4.646 1.00 0.00 C ATOM 518 CG GLN A 35 2.621 -13.487 4.435 1.00 0.00 C ATOM 519 CD GLN A 35 2.343 -14.545 5.490 1.00 0.00 C ATOM 520 OE1 GLN A 35 1.541 -14.328 6.394 1.00 0.00 O ATOM 521 NE2 GLN A 35 3.043 -15.657 5.467 1.00 0.00 N ATOM 0 H GLN A 35 4.160 -12.154 2.373 1.00 0.00 H new ATOM 0 HA GLN A 35 3.403 -10.933 4.788 1.00 0.00 H new ATOM 0 HB2 GLN A 35 4.724 -13.570 4.009 1.00 0.00 H new ATOM 0 HB3 GLN A 35 4.347 -13.187 5.677 1.00 0.00 H new ATOM 0 HG2 GLN A 35 1.915 -12.661 4.524 1.00 0.00 H new ATOM 0 HG3 GLN A 35 2.501 -13.902 3.434 1.00 0.00 H new ATOM 0 HE21 GLN A 35 3.706 -15.826 4.711 1.00 0.00 H new ATOM 0 HE22 GLN A 35 2.923 -16.351 6.205 1.00 0.00 H new ATOM 530 N ALA A 36 5.593 -10.927 6.229 1.00 0.00 N ATOM 531 CA ALA A 36 6.815 -10.693 6.975 1.00 0.00 C ATOM 532 C ALA A 36 7.834 -11.813 6.785 1.00 0.00 C ATOM 533 O ALA A 36 9.036 -11.544 6.760 1.00 0.00 O ATOM 534 CB ALA A 36 6.479 -10.529 8.456 1.00 0.00 C ATOM 0 H ALA A 36 4.759 -10.958 6.816 1.00 0.00 H new ATOM 0 HA ALA A 36 7.272 -9.781 6.592 1.00 0.00 H new ATOM 0 HB1 ALA A 36 7.395 -10.353 9.020 1.00 0.00 H new ATOM 0 HB2 ALA A 36 5.805 -9.682 8.585 1.00 0.00 H new ATOM 0 HB3 ALA A 36 5.996 -11.435 8.822 1.00 0.00 H new ATOM 540 N ASP A 37 7.386 -13.062 6.620 1.00 0.00 N ATOM 541 CA ASP A 37 8.292 -14.183 6.376 1.00 0.00 C ATOM 542 C ASP A 37 8.782 -14.222 4.927 1.00 0.00 C ATOM 543 O ASP A 37 9.827 -14.808 4.645 1.00 0.00 O ATOM 544 CB ASP A 37 7.626 -15.516 6.718 1.00 0.00 C ATOM 545 CG ASP A 37 8.687 -16.616 6.768 1.00 0.00 C ATOM 546 OD1 ASP A 37 9.471 -16.618 7.742 1.00 0.00 O ATOM 547 OD2 ASP A 37 8.737 -17.462 5.846 1.00 0.00 O ATOM 0 H ASP A 37 6.400 -13.320 6.652 1.00 0.00 H new ATOM 0 HA ASP A 37 9.153 -14.030 7.027 1.00 0.00 H new ATOM 0 HB2 ASP A 37 7.115 -15.444 7.678 1.00 0.00 H new ATOM 0 HB3 ASP A 37 6.869 -15.759 5.972 1.00 0.00 H new ATOM 552 N GLY A 38 8.062 -13.587 3.998 1.00 0.00 N ATOM 553 CA GLY A 38 8.422 -13.493 2.590 1.00 0.00 C ATOM 554 C GLY A 38 7.488 -14.247 1.640 1.00 0.00 C ATOM 555 O GLY A 38 7.771 -14.296 0.446 1.00 0.00 O ATOM 0 H GLY A 38 7.187 -13.111 4.217 1.00 0.00 H new ATOM 0 HA2 GLY A 38 8.439 -12.442 2.303 1.00 0.00 H new ATOM 0 HA3 GLY A 38 9.435 -13.875 2.461 1.00 0.00 H new ATOM 559 N THR A 39 6.385 -14.807 2.136 1.00 0.00 N ATOM 560 CA THR A 39 5.300 -15.415 1.382 1.00 0.00 C ATOM 561 C THR A 39 4.564 -14.318 0.618 1.00 0.00 C ATOM 562 O THR A 39 3.972 -13.432 1.231 1.00 0.00 O ATOM 563 CB THR A 39 4.327 -16.063 2.380 1.00 0.00 C ATOM 564 OG1 THR A 39 4.998 -16.721 3.435 1.00 0.00 O ATOM 565 CG2 THR A 39 3.235 -16.922 1.743 1.00 0.00 C ATOM 0 H THR A 39 6.219 -14.848 3.142 1.00 0.00 H new ATOM 0 HA THR A 39 5.685 -16.161 0.687 1.00 0.00 H new ATOM 0 HB THR A 39 3.784 -15.227 2.821 1.00 0.00 H new ATOM 0 HG1 THR A 39 4.455 -17.474 3.749 1.00 0.00 H new ATOM 0 HG21 THR A 39 2.597 -17.337 2.523 1.00 0.00 H new ATOM 0 HG22 THR A 39 2.634 -16.308 1.072 1.00 0.00 H new ATOM 0 HG23 THR A 39 3.694 -17.734 1.179 1.00 0.00 H new ATOM 573 N ALA A 40 4.584 -14.329 -0.705 1.00 0.00 N ATOM 574 CA ALA A 40 3.695 -13.491 -1.489 1.00 0.00 C ATOM 575 C ALA A 40 2.256 -14.010 -1.402 1.00 0.00 C ATOM 576 O ALA A 40 1.924 -15.047 -1.972 1.00 0.00 O ATOM 577 CB ALA A 40 4.225 -13.437 -2.910 1.00 0.00 C ATOM 0 H ALA A 40 5.210 -14.913 -1.260 1.00 0.00 H new ATOM 0 HA ALA A 40 3.669 -12.474 -1.097 1.00 0.00 H new ATOM 0 HB1 ALA A 40 3.572 -12.812 -3.518 1.00 0.00 H new ATOM 0 HB2 ALA A 40 5.231 -13.016 -2.908 1.00 0.00 H new ATOM 0 HB3 ALA A 40 4.254 -14.444 -3.326 1.00 0.00 H new ATOM 583 N ARG A 41 1.406 -13.286 -0.667 1.00 0.00 N ATOM 584 CA ARG A 41 -0.026 -13.550 -0.591 1.00 0.00 C ATOM 585 C ARG A 41 -0.677 -13.308 -1.945 1.00 0.00 C ATOM 586 O ARG A 41 -0.286 -12.388 -2.671 1.00 0.00 O ATOM 587 CB ARG A 41 -0.689 -12.617 0.433 1.00 0.00 C ATOM 588 CG ARG A 41 -0.557 -13.088 1.885 1.00 0.00 C ATOM 589 CD ARG A 41 -0.608 -11.849 2.798 1.00 0.00 C ATOM 590 NE ARG A 41 -0.889 -12.183 4.212 1.00 0.00 N ATOM 591 CZ ARG A 41 -0.331 -11.600 5.286 1.00 0.00 C ATOM 592 NH1 ARG A 41 0.460 -10.546 5.125 1.00 0.00 N ATOM 593 NH2 ARG A 41 -0.531 -12.087 6.502 1.00 0.00 N ATOM 0 H ARG A 41 1.702 -12.490 -0.102 1.00 0.00 H new ATOM 0 HA ARG A 41 -0.160 -14.589 -0.289 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -0.248 -11.624 0.343 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -1.747 -12.520 0.189 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -1.362 -13.778 2.136 1.00 0.00 H new ATOM 0 HG3 ARG A 41 0.380 -13.626 2.027 1.00 0.00 H new ATOM 0 HD2 ARG A 41 0.344 -11.321 2.738 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -1.375 -11.167 2.432 1.00 0.00 H new ATOM 0 HE ARG A 41 -1.568 -12.923 4.387 1.00 0.00 H new ATOM 0 HH11 ARG A 41 0.641 -10.183 4.189 1.00 0.00 H new ATOM 0 HH12 ARG A 41 0.886 -10.099 5.937 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -1.114 -12.914 6.631 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -0.102 -11.635 7.309 1.00 0.00 H new ATOM 607 N ALA A 42 -1.738 -14.051 -2.228 1.00 0.00 N ATOM 608 CA ALA A 42 -2.635 -13.766 -3.339 1.00 0.00 C ATOM 609 C ALA A 42 -3.347 -12.433 -3.099 1.00 0.00 C ATOM 610 O ALA A 42 -3.782 -12.160 -1.975 1.00 0.00 O ATOM 611 CB ALA A 42 -3.653 -14.901 -3.488 1.00 0.00 C ATOM 0 H ALA A 42 -2.002 -14.875 -1.688 1.00 0.00 H new ATOM 0 HA ALA A 42 -2.059 -13.693 -4.261 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -4.322 -14.683 -4.321 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -3.129 -15.837 -3.679 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -4.234 -14.992 -2.570 1.00 0.00 H new ATOM 617 N VAL A 43 -3.493 -11.642 -4.162 1.00 0.00 N ATOM 618 CA VAL A 43 -4.255 -10.399 -4.246 1.00 0.00 C ATOM 619 C VAL A 43 -5.003 -10.369 -5.604 1.00 0.00 C ATOM 620 O VAL A 43 -4.641 -11.127 -6.512 1.00 0.00 O ATOM 621 CB VAL A 43 -3.312 -9.183 -4.040 1.00 0.00 C ATOM 622 CG1 VAL A 43 -2.704 -9.162 -2.628 1.00 0.00 C ATOM 623 CG2 VAL A 43 -2.160 -9.101 -5.053 1.00 0.00 C ATOM 0 H VAL A 43 -3.049 -11.871 -5.051 1.00 0.00 H new ATOM 0 HA VAL A 43 -5.002 -10.343 -3.454 1.00 0.00 H new ATOM 0 HB VAL A 43 -3.960 -8.320 -4.192 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -2.051 -8.295 -2.526 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -3.503 -9.103 -1.889 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -2.127 -10.072 -2.467 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -1.549 -8.224 -4.839 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -1.545 -9.998 -4.979 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -2.567 -9.023 -6.061 1.00 0.00 H new ATOM 633 N PRO A 44 -6.056 -9.551 -5.784 1.00 0.00 N ATOM 634 CA PRO A 44 -6.760 -9.445 -7.061 1.00 0.00 C ATOM 635 C PRO A 44 -5.895 -8.732 -8.101 1.00 0.00 C ATOM 636 O PRO A 44 -5.551 -7.565 -7.923 1.00 0.00 O ATOM 637 CB PRO A 44 -8.040 -8.660 -6.770 1.00 0.00 C ATOM 638 CG PRO A 44 -7.712 -7.850 -5.523 1.00 0.00 C ATOM 639 CD PRO A 44 -6.680 -8.696 -4.783 1.00 0.00 C ATOM 0 HA PRO A 44 -6.988 -10.427 -7.476 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -8.308 -8.013 -7.605 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -8.885 -9.327 -6.600 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -7.312 -6.869 -5.780 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -8.600 -7.682 -4.913 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -5.938 -8.064 -4.295 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -7.154 -9.293 -4.003 1.00 0.00 H new ATOM 647 N SER A 45 -5.513 -9.417 -9.175 1.00 0.00 N ATOM 648 CA SER A 45 -4.762 -8.812 -10.258 1.00 0.00 C ATOM 649 C SER A 45 -5.634 -7.854 -11.085 1.00 0.00 C ATOM 650 O SER A 45 -6.869 -7.860 -11.004 1.00 0.00 O ATOM 651 CB SER A 45 -4.092 -9.938 -11.061 1.00 0.00 C ATOM 652 OG SER A 45 -4.592 -10.118 -12.365 1.00 0.00 O ATOM 0 H SER A 45 -5.718 -10.406 -9.314 1.00 0.00 H new ATOM 0 HA SER A 45 -3.969 -8.169 -9.875 1.00 0.00 H new ATOM 0 HB2 SER A 45 -3.023 -9.733 -11.123 1.00 0.00 H new ATOM 0 HB3 SER A 45 -4.206 -10.873 -10.512 1.00 0.00 H new ATOM 0 HG SER A 45 -4.110 -10.850 -12.802 1.00 0.00 H new ATOM 658 N ALA A 46 -4.982 -7.073 -11.949 1.00 0.00 N ATOM 659 CA ALA A 46 -5.662 -6.282 -12.969 1.00 0.00 C ATOM 660 C ALA A 46 -6.474 -7.180 -13.901 1.00 0.00 C ATOM 661 O ALA A 46 -7.598 -6.845 -14.271 1.00 0.00 O ATOM 662 CB ALA A 46 -4.645 -5.467 -13.764 1.00 0.00 C ATOM 0 H ALA A 46 -3.967 -6.973 -11.959 1.00 0.00 H new ATOM 0 HA ALA A 46 -6.351 -5.598 -12.474 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -5.162 -4.880 -14.523 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -4.109 -4.798 -13.091 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -3.937 -6.140 -14.247 1.00 0.00 H new ATOM 668 N ASP A 47 -5.922 -8.343 -14.235 1.00 0.00 N ATOM 669 CA ASP A 47 -6.553 -9.370 -15.053 1.00 0.00 C ATOM 670 C ASP A 47 -7.389 -10.337 -14.201 1.00 0.00 C ATOM 671 O ASP A 47 -7.725 -11.442 -14.630 1.00 0.00 O ATOM 672 CB ASP A 47 -5.465 -10.088 -15.862 1.00 0.00 C ATOM 673 CG ASP A 47 -6.068 -10.884 -17.016 1.00 0.00 C ATOM 674 OD1 ASP A 47 -6.803 -10.268 -17.820 1.00 0.00 O ATOM 675 OD2 ASP A 47 -5.755 -12.088 -17.149 1.00 0.00 O ATOM 0 H ASP A 47 -4.985 -8.605 -13.930 1.00 0.00 H new ATOM 0 HA ASP A 47 -7.257 -8.908 -15.746 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -4.757 -9.357 -16.252 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -4.905 -10.757 -15.209 1.00 0.00 H new ATOM 680 N GLN A 48 -7.699 -9.955 -12.957 1.00 0.00 N ATOM 681 CA GLN A 48 -8.772 -10.543 -12.164 1.00 0.00 C ATOM 682 C GLN A 48 -9.965 -9.587 -12.085 1.00 0.00 C ATOM 683 O GLN A 48 -11.103 -10.032 -11.932 1.00 0.00 O ATOM 684 CB GLN A 48 -8.294 -10.917 -10.764 1.00 0.00 C ATOM 685 CG GLN A 48 -7.236 -12.023 -10.806 1.00 0.00 C ATOM 686 CD GLN A 48 -7.708 -13.342 -11.404 1.00 0.00 C ATOM 687 OE1 GLN A 48 -8.321 -14.168 -10.732 1.00 0.00 O ATOM 688 NE2 GLN A 48 -7.398 -13.586 -12.664 1.00 0.00 N ATOM 0 H GLN A 48 -7.198 -9.213 -12.468 1.00 0.00 H new ATOM 0 HA GLN A 48 -9.088 -11.460 -12.662 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -7.881 -10.036 -10.273 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -9.143 -11.247 -10.165 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -6.381 -11.666 -11.381 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -6.884 -12.207 -9.791 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -6.889 -12.889 -13.208 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -7.668 -14.471 -13.093 1.00 0.00 H new ATOM 697 N GLY A 49 -9.724 -8.279 -12.188 1.00 0.00 N ATOM 698 CA GLY A 49 -10.723 -7.309 -12.600 1.00 0.00 C ATOM 699 C GLY A 49 -10.812 -6.080 -11.705 1.00 0.00 C ATOM 700 O GLY A 49 -11.179 -4.997 -12.175 1.00 0.00 O ATOM 0 H GLY A 49 -8.815 -7.864 -11.983 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -10.502 -6.987 -13.618 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -11.697 -7.797 -12.625 1.00 0.00 H new ATOM 704 N ALA A 50 -10.451 -6.229 -10.430 1.00 0.00 N ATOM 705 CA ALA A 50 -10.487 -5.180 -9.424 1.00 0.00 C ATOM 706 C ALA A 50 -9.204 -5.213 -8.581 1.00 0.00 C ATOM 707 O ALA A 50 -9.238 -5.628 -7.424 1.00 0.00 O ATOM 708 CB ALA A 50 -11.750 -5.334 -8.580 1.00 0.00 C ATOM 0 H ALA A 50 -10.114 -7.118 -10.061 1.00 0.00 H new ATOM 0 HA ALA A 50 -10.525 -4.200 -9.900 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -11.781 -4.549 -7.824 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -12.628 -5.255 -9.221 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -11.744 -6.308 -8.091 1.00 0.00 H new ATOM 714 N PRO A 51 -8.062 -4.783 -9.138 1.00 0.00 N ATOM 715 CA PRO A 51 -6.870 -4.536 -8.348 1.00 0.00 C ATOM 716 C PRO A 51 -7.161 -3.372 -7.399 1.00 0.00 C ATOM 717 O PRO A 51 -7.874 -2.429 -7.754 1.00 0.00 O ATOM 718 CB PRO A 51 -5.771 -4.224 -9.365 1.00 0.00 C ATOM 719 CG PRO A 51 -6.549 -3.540 -10.489 1.00 0.00 C ATOM 720 CD PRO A 51 -7.895 -4.277 -10.486 1.00 0.00 C ATOM 0 HA PRO A 51 -6.560 -5.376 -7.726 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -5.004 -3.572 -8.947 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -5.268 -5.128 -9.710 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -6.674 -2.474 -10.301 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -6.039 -3.637 -11.448 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -8.710 -3.605 -10.756 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -7.898 -5.090 -11.212 1.00 0.00 H new ATOM 728 N ILE A 52 -6.609 -3.462 -6.195 1.00 0.00 N ATOM 729 CA ILE A 52 -6.911 -2.604 -5.061 1.00 0.00 C ATOM 730 C ILE A 52 -6.341 -1.203 -5.320 1.00 0.00 C ATOM 731 O ILE A 52 -5.142 -0.946 -5.160 1.00 0.00 O ATOM 732 CB ILE A 52 -6.427 -3.295 -3.765 1.00 0.00 C ATOM 733 CG1 ILE A 52 -7.292 -4.554 -3.574 1.00 0.00 C ATOM 734 CG2 ILE A 52 -6.557 -2.376 -2.537 1.00 0.00 C ATOM 735 CD1 ILE A 52 -6.916 -5.463 -2.411 1.00 0.00 C ATOM 0 H ILE A 52 -5.907 -4.168 -5.975 1.00 0.00 H new ATOM 0 HA ILE A 52 -7.983 -2.455 -4.928 1.00 0.00 H new ATOM 0 HB ILE A 52 -5.370 -3.544 -3.857 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -8.328 -4.240 -3.442 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -7.251 -5.139 -4.493 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -6.206 -2.903 -1.650 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -5.956 -1.479 -2.688 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -7.601 -2.095 -2.402 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -7.596 -6.314 -2.380 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -5.895 -5.820 -2.543 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -6.988 -4.907 -1.476 1.00 0.00 H new ATOM 747 N THR A 53 -7.199 -0.290 -5.752 1.00 0.00 N ATOM 748 CA THR A 53 -6.896 1.094 -6.089 1.00 0.00 C ATOM 749 C THR A 53 -7.008 1.923 -4.806 1.00 0.00 C ATOM 750 O THR A 53 -7.823 1.596 -3.935 1.00 0.00 O ATOM 751 CB THR A 53 -7.937 1.561 -7.130 1.00 0.00 C ATOM 752 OG1 THR A 53 -9.223 1.056 -6.823 1.00 0.00 O ATOM 753 CG2 THR A 53 -7.637 1.058 -8.544 1.00 0.00 C ATOM 0 H THR A 53 -8.186 -0.509 -5.885 1.00 0.00 H new ATOM 0 HA THR A 53 -5.894 1.206 -6.503 1.00 0.00 H new ATOM 0 HB THR A 53 -7.894 2.650 -7.094 1.00 0.00 H new ATOM 0 HG1 THR A 53 -9.865 1.366 -7.495 1.00 0.00 H new ATOM 0 HG21 THR A 53 -8.404 1.420 -9.229 1.00 0.00 H new ATOM 0 HG22 THR A 53 -6.662 1.428 -8.863 1.00 0.00 H new ATOM 0 HG23 THR A 53 -7.631 -0.032 -8.549 1.00 0.00 H new ATOM 761 N LEU A 54 -6.236 3.005 -4.686 1.00 0.00 N ATOM 762 CA LEU A 54 -6.306 3.977 -3.594 1.00 0.00 C ATOM 763 C LEU A 54 -6.433 5.377 -4.215 1.00 0.00 C ATOM 764 O LEU A 54 -6.080 5.570 -5.380 1.00 0.00 O ATOM 765 CB LEU A 54 -5.047 3.777 -2.719 1.00 0.00 C ATOM 766 CG LEU A 54 -4.690 4.896 -1.727 1.00 0.00 C ATOM 767 CD1 LEU A 54 -5.693 5.118 -0.591 1.00 0.00 C ATOM 768 CD2 LEU A 54 -3.315 4.608 -1.106 1.00 0.00 C ATOM 0 H LEU A 54 -5.518 3.237 -5.373 1.00 0.00 H new ATOM 0 HA LEU A 54 -7.172 3.846 -2.945 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -5.173 2.853 -2.154 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -4.195 3.631 -3.383 1.00 0.00 H new ATOM 0 HG LEU A 54 -4.700 5.810 -2.321 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -5.344 5.929 0.049 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -6.665 5.379 -1.010 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -5.784 4.205 -0.003 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -3.060 5.401 -0.402 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -3.345 3.653 -0.581 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -2.562 4.566 -1.893 1.00 0.00 H new ATOM 780 N THR A 55 -6.951 6.355 -3.477 1.00 0.00 N ATOM 781 CA THR A 55 -7.077 7.739 -3.905 1.00 0.00 C ATOM 782 C THR A 55 -6.842 8.617 -2.671 1.00 0.00 C ATOM 783 O THR A 55 -7.672 8.604 -1.761 1.00 0.00 O ATOM 784 CB THR A 55 -8.457 7.999 -4.549 1.00 0.00 C ATOM 785 OG1 THR A 55 -9.002 6.873 -5.234 1.00 0.00 O ATOM 786 CG2 THR A 55 -8.334 9.158 -5.541 1.00 0.00 C ATOM 0 H THR A 55 -7.305 6.197 -2.534 1.00 0.00 H new ATOM 0 HA THR A 55 -6.341 7.976 -4.674 1.00 0.00 H new ATOM 0 HB THR A 55 -9.138 8.230 -3.730 1.00 0.00 H new ATOM 0 HG1 THR A 55 -9.874 7.111 -5.613 1.00 0.00 H new ATOM 0 HG21 THR A 55 -9.304 9.348 -6.000 1.00 0.00 H new ATOM 0 HG22 THR A 55 -8.000 10.053 -5.016 1.00 0.00 H new ATOM 0 HG23 THR A 55 -7.611 8.900 -6.314 1.00 0.00 H new ATOM 794 N LEU A 56 -5.704 9.318 -2.584 1.00 0.00 N ATOM 795 CA LEU A 56 -5.465 10.345 -1.576 1.00 0.00 C ATOM 796 C LEU A 56 -5.957 11.658 -2.159 1.00 0.00 C ATOM 797 O LEU A 56 -5.361 12.188 -3.094 1.00 0.00 O ATOM 798 CB LEU A 56 -3.978 10.499 -1.244 1.00 0.00 C ATOM 799 CG LEU A 56 -3.288 9.331 -0.541 1.00 0.00 C ATOM 800 CD1 LEU A 56 -3.997 8.838 0.725 1.00 0.00 C ATOM 801 CD2 LEU A 56 -3.013 8.151 -1.468 1.00 0.00 C ATOM 0 H LEU A 56 -4.919 9.182 -3.221 1.00 0.00 H new ATOM 0 HA LEU A 56 -5.982 10.066 -0.658 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -3.444 10.695 -2.174 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -3.863 11.384 -0.618 1.00 0.00 H new ATOM 0 HG LEU A 56 -2.336 9.760 -0.228 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -3.437 8.008 1.156 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -4.056 9.651 1.449 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -5.003 8.504 0.472 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -2.522 7.355 -0.908 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -3.954 7.781 -1.875 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -2.366 8.473 -2.284 1.00 0.00 H new ATOM 813 N SER A 57 -7.059 12.164 -1.636 1.00 0.00 N ATOM 814 CA SER A 57 -7.747 13.310 -2.212 1.00 0.00 C ATOM 815 C SER A 57 -8.438 14.084 -1.082 1.00 0.00 C ATOM 816 O SER A 57 -8.484 13.620 0.064 1.00 0.00 O ATOM 817 CB SER A 57 -8.750 12.745 -3.238 1.00 0.00 C ATOM 818 OG SER A 57 -9.291 13.725 -4.098 1.00 0.00 O ATOM 0 H SER A 57 -7.505 11.792 -0.797 1.00 0.00 H new ATOM 0 HA SER A 57 -7.074 14.006 -2.713 1.00 0.00 H new ATOM 0 HB2 SER A 57 -8.253 11.982 -3.837 1.00 0.00 H new ATOM 0 HB3 SER A 57 -9.563 12.252 -2.705 1.00 0.00 H new ATOM 0 HG SER A 57 -9.916 13.302 -4.723 1.00 0.00 H new ATOM 824 N THR A 58 -9.032 15.234 -1.409 1.00 0.00 N ATOM 825 CA THR A 58 -9.886 15.999 -0.506 1.00 0.00 C ATOM 826 C THR A 58 -11.299 16.094 -1.081 1.00 0.00 C ATOM 827 O THR A 58 -11.970 17.109 -0.906 1.00 0.00 O ATOM 828 CB THR A 58 -9.254 17.358 -0.143 1.00 0.00 C ATOM 829 OG1 THR A 58 -8.835 18.062 -1.297 1.00 0.00 O ATOM 830 CG2 THR A 58 -8.049 17.176 0.783 1.00 0.00 C ATOM 0 H THR A 58 -8.929 15.665 -2.328 1.00 0.00 H new ATOM 0 HA THR A 58 -9.974 15.474 0.445 1.00 0.00 H new ATOM 0 HB THR A 58 -10.026 17.934 0.368 1.00 0.00 H new ATOM 0 HG1 THR A 58 -8.441 18.919 -1.032 1.00 0.00 H new ATOM 0 HG21 THR A 58 -7.624 18.151 1.022 1.00 0.00 H new ATOM 0 HG22 THR A 58 -8.367 16.684 1.702 1.00 0.00 H new ATOM 0 HG23 THR A 58 -7.297 16.564 0.285 1.00 0.00 H new ATOM 838 N SER A 59 -11.775 15.043 -1.760 1.00 0.00 N ATOM 839 CA SER A 59 -13.129 14.961 -2.297 1.00 0.00 C ATOM 840 C SER A 59 -14.154 15.362 -1.220 1.00 0.00 C ATOM 841 O SER A 59 -14.924 16.296 -1.434 1.00 0.00 O ATOM 842 CB SER A 59 -13.343 13.546 -2.856 1.00 0.00 C ATOM 843 OG SER A 59 -14.457 13.459 -3.724 1.00 0.00 O ATOM 0 H SER A 59 -11.215 14.212 -1.952 1.00 0.00 H new ATOM 0 HA SER A 59 -13.272 15.665 -3.117 1.00 0.00 H new ATOM 0 HB2 SER A 59 -12.447 13.233 -3.391 1.00 0.00 H new ATOM 0 HB3 SER A 59 -13.479 12.850 -2.028 1.00 0.00 H new ATOM 0 HG SER A 59 -14.546 12.540 -4.051 1.00 0.00 H new ATOM 849 N THR A 60 -14.100 14.748 -0.032 1.00 0.00 N ATOM 850 CA THR A 60 -15.020 15.003 1.081 1.00 0.00 C ATOM 851 C THR A 60 -14.572 16.219 1.930 1.00 0.00 C ATOM 852 O THR A 60 -15.026 16.416 3.056 1.00 0.00 O ATOM 853 CB THR A 60 -15.141 13.671 1.854 1.00 0.00 C ATOM 854 OG1 THR A 60 -16.289 13.578 2.668 1.00 0.00 O ATOM 855 CG2 THR A 60 -13.919 13.396 2.738 1.00 0.00 C ATOM 0 H THR A 60 -13.397 14.042 0.187 1.00 0.00 H new ATOM 0 HA THR A 60 -16.011 15.300 0.739 1.00 0.00 H new ATOM 0 HB THR A 60 -15.215 12.924 1.063 1.00 0.00 H new ATOM 0 HG1 THR A 60 -16.298 12.710 3.123 1.00 0.00 H new ATOM 0 HG21 THR A 60 -14.053 12.449 3.260 1.00 0.00 H new ATOM 0 HG22 THR A 60 -13.025 13.345 2.117 1.00 0.00 H new ATOM 0 HG23 THR A 60 -13.809 14.199 3.467 1.00 0.00 H new ATOM 863 N GLY A 61 -13.585 16.983 1.454 1.00 0.00 N ATOM 864 CA GLY A 61 -12.960 18.121 2.115 1.00 0.00 C ATOM 865 C GLY A 61 -11.861 17.675 3.075 1.00 0.00 C ATOM 866 O GLY A 61 -10.786 18.279 3.135 1.00 0.00 O ATOM 0 H GLY A 61 -13.178 16.807 0.535 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -12.540 18.793 1.366 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -13.715 18.686 2.662 1.00 0.00 H new ATOM 870 N GLN A 62 -12.081 16.567 3.785 1.00 0.00 N ATOM 871 CA GLN A 62 -11.063 15.966 4.632 1.00 0.00 C ATOM 872 C GLN A 62 -10.035 15.299 3.738 1.00 0.00 C ATOM 873 O GLN A 62 -10.366 14.781 2.671 1.00 0.00 O ATOM 874 CB GLN A 62 -11.629 14.915 5.596 1.00 0.00 C ATOM 875 CG GLN A 62 -12.466 15.515 6.732 1.00 0.00 C ATOM 876 CD GLN A 62 -13.817 16.067 6.276 1.00 0.00 C ATOM 877 OE1 GLN A 62 -14.110 17.246 6.460 1.00 0.00 O ATOM 878 NE2 GLN A 62 -14.674 15.248 5.685 1.00 0.00 N ATOM 0 H GLN A 62 -12.970 16.066 3.786 1.00 0.00 H new ATOM 0 HA GLN A 62 -10.627 16.760 5.238 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -12.244 14.212 5.034 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -10.805 14.345 6.025 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -12.633 14.750 7.491 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -11.898 16.315 7.206 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -14.425 14.270 5.535 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -15.583 15.595 5.380 1.00 0.00 H new ATOM 887 N ARG A 63 -8.802 15.254 4.231 1.00 0.00 N ATOM 888 CA ARG A 63 -7.757 14.434 3.644 1.00 0.00 C ATOM 889 C ARG A 63 -8.091 12.989 3.977 1.00 0.00 C ATOM 890 O ARG A 63 -7.853 12.523 5.094 1.00 0.00 O ATOM 891 CB ARG A 63 -6.355 14.874 4.099 1.00 0.00 C ATOM 892 CG ARG A 63 -6.138 14.978 5.618 1.00 0.00 C ATOM 893 CD ARG A 63 -4.650 15.103 5.960 1.00 0.00 C ATOM 894 NE ARG A 63 -4.077 16.356 5.456 1.00 0.00 N ATOM 895 CZ ARG A 63 -4.420 17.578 5.867 1.00 0.00 C ATOM 896 NH1 ARG A 63 -5.150 17.738 6.965 1.00 0.00 N ATOM 897 NH2 ARG A 63 -4.039 18.641 5.175 1.00 0.00 N ATOM 0 H ARG A 63 -8.502 15.786 5.048 1.00 0.00 H new ATOM 0 HA ARG A 63 -7.724 14.552 2.561 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -5.627 14.170 3.696 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -6.139 15.845 3.654 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -6.676 15.843 6.006 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -6.553 14.097 6.108 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -4.520 15.053 7.041 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -4.107 14.259 5.535 1.00 0.00 H new ATOM 0 HE ARG A 63 -3.360 16.287 4.734 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -5.452 16.924 7.500 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -5.409 18.675 7.273 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -3.483 18.526 4.328 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -4.301 19.575 5.489 1.00 0.00 H new ATOM 911 N HIS A 64 -8.701 12.272 3.044 1.00 0.00 N ATOM 912 CA HIS A 64 -8.985 10.879 3.232 1.00 0.00 C ATOM 913 C HIS A 64 -8.431 10.069 2.082 1.00 0.00 C ATOM 914 O HIS A 64 -8.277 10.541 0.956 1.00 0.00 O ATOM 915 CB HIS A 64 -10.471 10.658 3.508 1.00 0.00 C ATOM 916 CG HIS A 64 -11.439 10.766 2.364 1.00 0.00 C ATOM 917 ND1 HIS A 64 -12.697 10.215 2.334 1.00 0.00 N ATOM 918 CD2 HIS A 64 -11.261 11.462 1.206 1.00 0.00 C ATOM 919 CE1 HIS A 64 -13.257 10.557 1.166 1.00 0.00 C ATOM 920 NE2 HIS A 64 -12.422 11.320 0.431 1.00 0.00 N ATOM 0 H HIS A 64 -9.006 12.647 2.146 1.00 0.00 H new ATOM 0 HA HIS A 64 -8.473 10.515 4.123 1.00 0.00 H new ATOM 0 HB2 HIS A 64 -10.583 9.665 3.943 1.00 0.00 H new ATOM 0 HB3 HIS A 64 -10.777 11.376 4.269 1.00 0.00 H new ATOM 0 HD1 HIS A 64 -13.126 9.649 3.066 1.00 0.00 H new ATOM 0 HD2 HIS A 64 -10.380 12.024 0.933 1.00 0.00 H new ATOM 0 HE1 HIS A 64 -14.247 10.261 0.854 1.00 0.00 H new ATOM 928 N ALA A 65 -8.138 8.823 2.421 1.00 0.00 N ATOM 929 CA ALA A 65 -8.138 7.755 1.466 1.00 0.00 C ATOM 930 C ALA A 65 -9.603 7.455 1.200 1.00 0.00 C ATOM 931 O ALA A 65 -10.371 7.269 2.154 1.00 0.00 O ATOM 932 CB ALA A 65 -7.446 6.539 2.080 1.00 0.00 C ATOM 0 H ALA A 65 -7.895 8.536 3.369 1.00 0.00 H new ATOM 0 HA ALA A 65 -7.611 8.010 0.546 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -7.441 5.721 1.360 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -6.420 6.798 2.342 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -7.982 6.230 2.977 1.00 0.00 H new ATOM 938 N SER A 66 -9.957 7.328 -0.068 1.00 0.00 N ATOM 939 CA SER A 66 -10.922 6.328 -0.480 1.00 0.00 C ATOM 940 C SER A 66 -10.189 5.356 -1.405 1.00 0.00 C ATOM 941 O SER A 66 -9.029 5.582 -1.758 1.00 0.00 O ATOM 942 CB SER A 66 -12.179 6.993 -1.065 1.00 0.00 C ATOM 943 OG SER A 66 -11.898 7.885 -2.129 1.00 0.00 O ATOM 0 H SER A 66 -9.591 7.904 -0.826 1.00 0.00 H new ATOM 0 HA SER A 66 -11.313 5.748 0.356 1.00 0.00 H new ATOM 0 HB2 SER A 66 -12.860 6.219 -1.419 1.00 0.00 H new ATOM 0 HB3 SER A 66 -12.697 7.535 -0.273 1.00 0.00 H new ATOM 0 HG SER A 66 -12.735 8.274 -2.459 1.00 0.00 H new ATOM 949 N GLY A 67 -10.829 4.258 -1.782 1.00 0.00 N ATOM 950 CA GLY A 67 -10.242 3.268 -2.667 1.00 0.00 C ATOM 951 C GLY A 67 -11.139 2.047 -2.714 1.00 0.00 C ATOM 952 O GLY A 67 -12.125 1.983 -1.979 1.00 0.00 O ATOM 0 H GLY A 67 -11.776 4.030 -1.479 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -10.121 3.684 -3.667 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -9.249 2.991 -2.314 1.00 0.00 H new ATOM 956 N PHE A 68 -10.815 1.068 -3.554 1.00 0.00 N ATOM 957 CA PHE A 68 -11.625 -0.123 -3.756 1.00 0.00 C ATOM 958 C PHE A 68 -10.868 -1.297 -3.140 1.00 0.00 C ATOM 959 O PHE A 68 -9.997 -1.870 -3.795 1.00 0.00 O ATOM 960 CB PHE A 68 -11.897 -0.323 -5.258 1.00 0.00 C ATOM 961 CG PHE A 68 -12.957 -1.349 -5.631 1.00 0.00 C ATOM 962 CD1 PHE A 68 -14.107 -1.511 -4.840 1.00 0.00 C ATOM 963 CD2 PHE A 68 -12.867 -2.044 -6.850 1.00 0.00 C ATOM 964 CE1 PHE A 68 -15.185 -2.287 -5.278 1.00 0.00 C ATOM 965 CE2 PHE A 68 -13.931 -2.863 -7.277 1.00 0.00 C ATOM 966 CZ PHE A 68 -15.096 -2.971 -6.495 1.00 0.00 C ATOM 0 H PHE A 68 -9.968 1.083 -4.121 1.00 0.00 H new ATOM 0 HA PHE A 68 -12.599 -0.034 -3.274 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -12.190 0.638 -5.681 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -10.961 -0.611 -5.738 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -14.159 -1.027 -3.876 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -11.981 -1.950 -7.460 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -16.081 -2.358 -4.680 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -13.852 -3.409 -8.206 1.00 0.00 H new ATOM 0 HZ PHE A 68 -15.920 -3.581 -6.834 1.00 0.00 H new ATOM 976 N SER A 69 -11.155 -1.657 -1.887 1.00 0.00 N ATOM 977 CA SER A 69 -10.550 -2.824 -1.263 1.00 0.00 C ATOM 978 C SER A 69 -11.166 -4.099 -1.849 1.00 0.00 C ATOM 979 O SER A 69 -12.065 -4.709 -1.269 1.00 0.00 O ATOM 980 CB SER A 69 -10.685 -2.790 0.258 1.00 0.00 C ATOM 981 OG SER A 69 -10.276 -1.551 0.778 1.00 0.00 O ATOM 0 H SER A 69 -11.806 -1.151 -1.287 1.00 0.00 H new ATOM 0 HA SER A 69 -9.482 -2.815 -1.481 1.00 0.00 H new ATOM 0 HB2 SER A 69 -11.721 -2.980 0.538 1.00 0.00 H new ATOM 0 HB3 SER A 69 -10.085 -3.587 0.697 1.00 0.00 H new ATOM 0 HG SER A 69 -10.732 -0.828 0.298 1.00 0.00 H new ATOM 987 N GLY A 70 -10.698 -4.498 -3.027 1.00 0.00 N ATOM 988 CA GLY A 70 -10.738 -5.867 -3.503 1.00 0.00 C ATOM 989 C GLY A 70 -12.054 -6.216 -4.171 1.00 0.00 C ATOM 990 O GLY A 70 -12.077 -6.714 -5.297 1.00 0.00 O ATOM 0 H GLY A 70 -10.269 -3.855 -3.693 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -9.923 -6.026 -4.210 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -10.570 -6.544 -2.665 1.00 0.00 H new ATOM 994 N CYS A 71 -13.168 -5.949 -3.498 1.00 0.00 N ATOM 995 CA CYS A 71 -14.427 -5.696 -4.174 1.00 0.00 C ATOM 996 C CYS A 71 -15.344 -4.797 -3.350 1.00 0.00 C ATOM 997 O CYS A 71 -16.546 -4.736 -3.610 1.00 0.00 O ATOM 998 CB CYS A 71 -15.118 -7.011 -4.512 1.00 0.00 C ATOM 999 SG CYS A 71 -15.658 -7.073 -6.251 1.00 0.00 S ATOM 0 H CYS A 71 -13.220 -5.903 -2.480 1.00 0.00 H new ATOM 0 HA CYS A 71 -14.206 -5.166 -5.101 1.00 0.00 H new ATOM 0 HB2 CYS A 71 -14.437 -7.839 -4.314 1.00 0.00 H new ATOM 0 HB3 CYS A 71 -15.981 -7.145 -3.860 1.00 0.00 H new ATOM 1004 N ASN A 72 -14.836 -4.131 -2.314 1.00 0.00 N ATOM 1005 CA ASN A 72 -15.625 -3.308 -1.418 1.00 0.00 C ATOM 1006 C ASN A 72 -14.826 -2.048 -1.096 1.00 0.00 C ATOM 1007 O ASN A 72 -13.768 -2.095 -0.468 1.00 0.00 O ATOM 1008 CB ASN A 72 -15.967 -4.055 -0.132 1.00 0.00 C ATOM 1009 CG ASN A 72 -16.275 -5.532 -0.268 1.00 0.00 C ATOM 1010 OD1 ASN A 72 -15.573 -6.387 0.246 1.00 0.00 O ATOM 1011 ND2 ASN A 72 -17.318 -5.872 -0.996 1.00 0.00 N ATOM 0 H ASN A 72 -13.845 -4.153 -2.075 1.00 0.00 H new ATOM 0 HA ASN A 72 -16.566 -3.050 -1.904 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -15.132 -3.943 0.559 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -16.828 -3.568 0.326 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -17.544 -6.857 -1.134 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -17.900 -5.150 -1.422 1.00 0.00 H new ATOM 1018 N ARG A 73 -15.299 -0.921 -1.617 1.00 0.00 N ATOM 1019 CA ARG A 73 -14.679 0.411 -1.505 1.00 0.00 C ATOM 1020 C ARG A 73 -14.860 1.068 -0.135 1.00 0.00 C ATOM 1021 O ARG A 73 -15.969 1.102 0.396 1.00 0.00 O ATOM 1022 CB ARG A 73 -15.167 1.350 -2.636 1.00 0.00 C ATOM 1023 CG ARG A 73 -16.688 1.519 -2.616 1.00 0.00 C ATOM 1024 CD ARG A 73 -17.085 2.902 -2.080 1.00 0.00 C ATOM 1025 NE ARG A 73 -18.406 2.878 -1.432 1.00 0.00 N ATOM 1026 CZ ARG A 73 -19.541 3.390 -1.920 1.00 0.00 C ATOM 1027 NH1 ARG A 73 -19.616 3.800 -3.183 1.00 0.00 N ATOM 1028 NH2 ARG A 73 -20.600 3.524 -1.128 1.00 0.00 N ATOM 0 H ARG A 73 -16.165 -0.901 -2.156 1.00 0.00 H new ATOM 0 HA ARG A 73 -13.607 0.246 -1.617 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -14.691 2.325 -2.530 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -14.858 0.948 -3.601 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -17.084 1.389 -3.623 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -17.135 0.743 -1.995 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -16.336 3.244 -1.366 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -17.095 3.620 -2.900 1.00 0.00 H new ATOM 0 HE ARG A 73 -18.462 2.426 -0.519 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -18.801 3.726 -3.792 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -20.488 4.189 -3.542 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -20.546 3.237 -0.151 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -21.467 3.914 -1.497 1.00 0.00 H new ATOM 1042 N TYR A 74 -13.786 1.658 0.384 1.00 0.00 N ATOM 1043 CA TYR A 74 -13.703 2.306 1.692 1.00 0.00 C ATOM 1044 C TYR A 74 -13.527 3.805 1.540 1.00 0.00 C ATOM 1045 O TYR A 74 -13.227 4.312 0.458 1.00 0.00 O ATOM 1046 CB TYR A 74 -12.532 1.770 2.533 1.00 0.00 C ATOM 1047 CG TYR A 74 -11.138 2.018 1.975 1.00 0.00 C ATOM 1048 CD1 TYR A 74 -10.716 1.353 0.809 1.00 0.00 C ATOM 1049 CD2 TYR A 74 -10.242 2.878 2.638 1.00 0.00 C ATOM 1050 CE1 TYR A 74 -9.412 1.504 0.314 1.00 0.00 C ATOM 1051 CE2 TYR A 74 -8.929 3.034 2.159 1.00 0.00 C ATOM 1052 CZ TYR A 74 -8.507 2.342 1.001 1.00 0.00 C ATOM 1053 OH TYR A 74 -7.226 2.471 0.571 1.00 0.00 O ATOM 0 H TYR A 74 -12.902 1.699 -0.123 1.00 0.00 H new ATOM 0 HA TYR A 74 -14.639 2.082 2.203 1.00 0.00 H new ATOM 0 HB2 TYR A 74 -12.589 2.218 3.525 1.00 0.00 H new ATOM 0 HB3 TYR A 74 -12.664 0.696 2.660 1.00 0.00 H new ATOM 0 HD1 TYR A 74 -11.410 0.713 0.284 1.00 0.00 H new ATOM 0 HD2 TYR A 74 -10.563 3.419 3.516 1.00 0.00 H new ATOM 0 HE1 TYR A 74 -9.104 0.985 -0.582 1.00 0.00 H new ATOM 0 HE2 TYR A 74 -8.241 3.685 2.678 1.00 0.00 H new ATOM 0 HH TYR A 74 -7.193 2.350 -0.401 1.00 0.00 H new ATOM 1063 N MET A 75 -13.686 4.495 2.663 1.00 0.00 N ATOM 1064 CA MET A 75 -13.312 5.876 2.876 1.00 0.00 C ATOM 1065 C MET A 75 -13.024 6.047 4.380 1.00 0.00 C ATOM 1066 O MET A 75 -13.508 5.248 5.194 1.00 0.00 O ATOM 1067 CB MET A 75 -14.429 6.787 2.337 1.00 0.00 C ATOM 1068 CG MET A 75 -15.828 6.490 2.908 1.00 0.00 C ATOM 1069 SD MET A 75 -17.106 6.057 1.691 1.00 0.00 S ATOM 1070 CE MET A 75 -16.787 4.293 1.471 1.00 0.00 C ATOM 0 H MET A 75 -14.104 4.076 3.493 1.00 0.00 H new ATOM 0 HA MET A 75 -12.410 6.161 2.335 1.00 0.00 H new ATOM 0 HB2 MET A 75 -14.173 7.823 2.558 1.00 0.00 H new ATOM 0 HB3 MET A 75 -14.466 6.692 1.252 1.00 0.00 H new ATOM 0 HG2 MET A 75 -15.741 5.671 3.622 1.00 0.00 H new ATOM 0 HG3 MET A 75 -16.165 7.364 3.465 1.00 0.00 H new ATOM 0 HE1 MET A 75 -17.726 3.775 1.275 1.00 0.00 H new ATOM 0 HE2 MET A 75 -16.110 4.148 0.629 1.00 0.00 H new ATOM 0 HE3 MET A 75 -16.333 3.890 2.376 1.00 0.00 H new ATOM 1080 N GLY A 76 -12.231 7.049 4.769 1.00 0.00 N ATOM 1081 CA GLY A 76 -11.951 7.330 6.176 1.00 0.00 C ATOM 1082 C GLY A 76 -11.217 8.655 6.356 1.00 0.00 C ATOM 1083 O GLY A 76 -11.813 9.709 6.149 1.00 0.00 O ATOM 0 H GLY A 76 -11.768 7.685 4.119 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -12.887 7.354 6.735 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -11.351 6.522 6.595 1.00 0.00 H new ATOM 1087 N SER A 77 -9.934 8.625 6.727 1.00 0.00 N ATOM 1088 CA SER A 77 -9.056 9.793 6.843 1.00 0.00 C ATOM 1089 C SER A 77 -7.598 9.293 6.834 1.00 0.00 C ATOM 1090 O SER A 77 -7.378 8.084 6.967 1.00 0.00 O ATOM 1091 CB SER A 77 -9.369 10.524 8.164 1.00 0.00 C ATOM 1092 OG SER A 77 -9.564 11.908 7.942 1.00 0.00 O ATOM 0 H SER A 77 -9.460 7.753 6.964 1.00 0.00 H new ATOM 0 HA SER A 77 -9.210 10.486 6.016 1.00 0.00 H new ATOM 0 HB2 SER A 77 -10.262 10.095 8.619 1.00 0.00 H new ATOM 0 HB3 SER A 77 -8.551 10.376 8.869 1.00 0.00 H new ATOM 0 HG SER A 77 -9.763 12.351 8.793 1.00 0.00 H new ATOM 1098 N TYR A 78 -6.609 10.184 6.703 1.00 0.00 N ATOM 1099 CA TYR A 78 -5.181 9.877 6.866 1.00 0.00 C ATOM 1100 C TYR A 78 -4.410 11.119 7.332 1.00 0.00 C ATOM 1101 O TYR A 78 -4.957 12.223 7.327 1.00 0.00 O ATOM 1102 CB TYR A 78 -4.604 9.314 5.555 1.00 0.00 C ATOM 1103 CG TYR A 78 -4.352 10.360 4.490 1.00 0.00 C ATOM 1104 CD1 TYR A 78 -5.399 10.762 3.649 1.00 0.00 C ATOM 1105 CD2 TYR A 78 -3.082 10.949 4.361 1.00 0.00 C ATOM 1106 CE1 TYR A 78 -5.199 11.756 2.678 1.00 0.00 C ATOM 1107 CE2 TYR A 78 -2.868 11.945 3.398 1.00 0.00 C ATOM 1108 CZ TYR A 78 -3.927 12.353 2.563 1.00 0.00 C ATOM 1109 OH TYR A 78 -3.701 13.314 1.638 1.00 0.00 O ATOM 0 H TYR A 78 -6.782 11.163 6.475 1.00 0.00 H new ATOM 0 HA TYR A 78 -5.071 9.114 7.637 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -3.667 8.801 5.774 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -5.292 8.567 5.159 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -6.371 10.302 3.749 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -2.272 10.635 5.003 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -6.007 12.059 2.029 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -1.893 12.399 3.296 1.00 0.00 H new ATOM 0 HH TYR A 78 -2.766 13.273 1.346 1.00 0.00 H new ATOM 1119 N ALA A 79 -3.146 10.952 7.733 1.00 0.00 N ATOM 1120 CA ALA A 79 -2.222 12.017 8.105 1.00 0.00 C ATOM 1121 C ALA A 79 -0.787 11.573 7.810 1.00 0.00 C ATOM 1122 O ALA A 79 -0.507 10.375 7.776 1.00 0.00 O ATOM 1123 CB ALA A 79 -2.362 12.314 9.602 1.00 0.00 C ATOM 0 H ALA A 79 -2.724 10.026 7.809 1.00 0.00 H new ATOM 0 HA ALA A 79 -2.453 12.914 7.531 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -1.672 13.110 9.881 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -3.384 12.628 9.817 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -2.130 11.416 10.174 1.00 0.00 H new ATOM 1129 N LEU A 80 0.136 12.522 7.636 1.00 0.00 N ATOM 1130 CA LEU A 80 1.546 12.257 7.360 1.00 0.00 C ATOM 1131 C LEU A 80 2.369 12.673 8.568 1.00 0.00 C ATOM 1132 O LEU A 80 2.134 13.737 9.146 1.00 0.00 O ATOM 1133 CB LEU A 80 2.001 13.080 6.143 1.00 0.00 C ATOM 1134 CG LEU A 80 1.617 12.555 4.747 1.00 0.00 C ATOM 1135 CD1 LEU A 80 0.420 11.604 4.690 1.00 0.00 C ATOM 1136 CD2 LEU A 80 1.364 13.731 3.792 1.00 0.00 C ATOM 0 H LEU A 80 -0.083 13.517 7.685 1.00 0.00 H new ATOM 0 HA LEU A 80 1.683 11.196 7.154 1.00 0.00 H new ATOM 0 HB2 LEU A 80 1.596 14.087 6.247 1.00 0.00 H new ATOM 0 HB3 LEU A 80 3.087 13.167 6.183 1.00 0.00 H new ATOM 0 HG LEU A 80 2.476 11.958 4.442 1.00 0.00 H new ATOM 0 HD11 LEU A 80 0.245 11.301 3.658 1.00 0.00 H new ATOM 0 HD12 LEU A 80 0.627 10.722 5.297 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -0.465 12.110 5.075 1.00 0.00 H new ATOM 0 HD21 LEU A 80 1.093 13.349 2.808 1.00 0.00 H new ATOM 0 HD22 LEU A 80 0.551 14.345 4.179 1.00 0.00 H new ATOM 0 HD23 LEU A 80 2.268 14.335 3.711 1.00 0.00 H new ATOM 1148 N LYS A 81 3.363 11.869 8.927 1.00 0.00 N ATOM 1149 CA LYS A 81 4.434 12.167 9.874 1.00 0.00 C ATOM 1150 C LYS A 81 5.562 11.168 9.651 1.00 0.00 C ATOM 1151 O LYS A 81 5.295 10.128 9.071 1.00 0.00 O ATOM 1152 CB LYS A 81 3.897 12.018 11.301 1.00 0.00 C ATOM 1153 CG LYS A 81 3.211 10.665 11.599 1.00 0.00 C ATOM 1154 CD LYS A 81 3.363 10.236 13.058 1.00 0.00 C ATOM 1155 CE LYS A 81 2.800 11.266 14.041 1.00 0.00 C ATOM 1156 NZ LYS A 81 2.996 10.850 15.448 1.00 0.00 N ATOM 0 H LYS A 81 3.449 10.929 8.539 1.00 0.00 H new ATOM 0 HA LYS A 81 4.799 13.184 9.729 1.00 0.00 H new ATOM 0 HB2 LYS A 81 4.722 12.152 12.000 1.00 0.00 H new ATOM 0 HB3 LYS A 81 3.184 12.820 11.491 1.00 0.00 H new ATOM 0 HG2 LYS A 81 2.151 10.738 11.354 1.00 0.00 H new ATOM 0 HG3 LYS A 81 3.635 9.897 10.952 1.00 0.00 H new ATOM 0 HD2 LYS A 81 2.855 9.283 13.207 1.00 0.00 H new ATOM 0 HD3 LYS A 81 4.418 10.072 13.276 1.00 0.00 H new ATOM 0 HE2 LYS A 81 3.285 12.228 13.876 1.00 0.00 H new ATOM 0 HE3 LYS A 81 1.736 11.408 13.849 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 2.601 11.574 16.082 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 2.512 9.944 15.613 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 4.012 10.739 15.639 1.00 0.00 H new ATOM 1170 N ASP A 82 6.767 11.404 10.166 1.00 0.00 N ATOM 1171 CA ASP A 82 7.820 10.390 10.354 1.00 0.00 C ATOM 1172 C ASP A 82 8.142 9.557 9.100 1.00 0.00 C ATOM 1173 O ASP A 82 8.461 8.369 9.176 1.00 0.00 O ATOM 1174 CB ASP A 82 7.469 9.533 11.582 1.00 0.00 C ATOM 1175 CG ASP A 82 8.604 8.609 12.032 1.00 0.00 C ATOM 1176 OD1 ASP A 82 9.796 8.980 11.916 1.00 0.00 O ATOM 1177 OD2 ASP A 82 8.289 7.529 12.586 1.00 0.00 O ATOM 0 H ASP A 82 7.053 12.333 10.476 1.00 0.00 H new ATOM 0 HA ASP A 82 8.758 10.915 10.538 1.00 0.00 H new ATOM 0 HB2 ASP A 82 7.199 10.191 12.408 1.00 0.00 H new ATOM 0 HB3 ASP A 82 6.590 8.930 11.354 1.00 0.00 H new ATOM 1182 N GLY A 83 8.026 10.169 7.916 1.00 0.00 N ATOM 1183 CA GLY A 83 8.169 9.489 6.632 1.00 0.00 C ATOM 1184 C GLY A 83 7.183 8.338 6.444 1.00 0.00 C ATOM 1185 O GLY A 83 7.501 7.373 5.746 1.00 0.00 O ATOM 0 H GLY A 83 7.827 11.165 7.826 1.00 0.00 H new ATOM 0 HA2 GLY A 83 8.030 10.212 5.828 1.00 0.00 H new ATOM 0 HA3 GLY A 83 9.185 9.106 6.543 1.00 0.00 H new ATOM 1189 N LYS A 84 6.008 8.441 7.069 1.00 0.00 N ATOM 1190 CA LYS A 84 4.937 7.463 7.133 1.00 0.00 C ATOM 1191 C LYS A 84 3.612 8.084 6.736 1.00 0.00 C ATOM 1192 O LYS A 84 3.403 9.299 6.833 1.00 0.00 O ATOM 1193 CB LYS A 84 4.850 6.848 8.537 1.00 0.00 C ATOM 1194 CG LYS A 84 6.031 5.916 8.841 1.00 0.00 C ATOM 1195 CD LYS A 84 6.264 5.738 10.340 1.00 0.00 C ATOM 1196 CE LYS A 84 5.053 5.122 11.047 1.00 0.00 C ATOM 1197 NZ LYS A 84 5.394 4.726 12.427 1.00 0.00 N ATOM 0 H LYS A 84 5.768 9.287 7.586 1.00 0.00 H new ATOM 0 HA LYS A 84 5.162 6.667 6.423 1.00 0.00 H new ATOM 0 HB2 LYS A 84 4.820 7.646 9.279 1.00 0.00 H new ATOM 0 HB3 LYS A 84 3.918 6.291 8.630 1.00 0.00 H new ATOM 0 HG2 LYS A 84 5.848 4.942 8.387 1.00 0.00 H new ATOM 0 HG3 LYS A 84 6.934 6.317 8.381 1.00 0.00 H new ATOM 0 HD2 LYS A 84 7.136 5.103 10.497 1.00 0.00 H new ATOM 0 HD3 LYS A 84 6.490 6.706 10.788 1.00 0.00 H new ATOM 0 HE2 LYS A 84 4.232 5.839 11.062 1.00 0.00 H new ATOM 0 HE3 LYS A 84 4.705 4.252 10.490 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 4.528 4.454 12.934 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 6.050 3.919 12.405 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 5.845 5.525 12.916 1.00 0.00 H new ATOM 1211 N LEU A 85 2.728 7.209 6.263 1.00 0.00 N ATOM 1212 CA LEU A 85 1.375 7.508 5.834 1.00 0.00 C ATOM 1213 C LEU A 85 0.492 6.772 6.832 1.00 0.00 C ATOM 1214 O LEU A 85 0.348 5.552 6.758 1.00 0.00 O ATOM 1215 CB LEU A 85 1.168 7.024 4.388 1.00 0.00 C ATOM 1216 CG LEU A 85 -0.074 7.559 3.642 1.00 0.00 C ATOM 1217 CD1 LEU A 85 -0.453 6.574 2.531 1.00 0.00 C ATOM 1218 CD2 LEU A 85 -1.298 7.871 4.506 1.00 0.00 C ATOM 0 H LEU A 85 2.955 6.219 6.166 1.00 0.00 H new ATOM 0 HA LEU A 85 1.144 8.573 5.822 1.00 0.00 H new ATOM 0 HB2 LEU A 85 2.052 7.293 3.811 1.00 0.00 H new ATOM 0 HB3 LEU A 85 1.114 5.935 4.399 1.00 0.00 H new ATOM 0 HG LEU A 85 0.226 8.528 3.244 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -1.329 6.945 1.999 1.00 0.00 H new ATOM 0 HD12 LEU A 85 0.379 6.474 1.834 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -0.679 5.601 2.968 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -2.106 8.239 3.873 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -1.622 6.965 5.018 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -1.039 8.632 5.243 1.00 0.00 H new ATOM 1230 N SER A 86 -0.019 7.498 7.814 1.00 0.00 N ATOM 1231 CA SER A 86 -0.802 6.934 8.901 1.00 0.00 C ATOM 1232 C SER A 86 -2.268 7.203 8.577 1.00 0.00 C ATOM 1233 O SER A 86 -2.594 8.177 7.897 1.00 0.00 O ATOM 1234 CB SER A 86 -0.396 7.576 10.233 1.00 0.00 C ATOM 1235 OG SER A 86 1.002 7.819 10.316 1.00 0.00 O ATOM 0 H SER A 86 0.100 8.509 7.879 1.00 0.00 H new ATOM 0 HA SER A 86 -0.630 5.862 9.001 1.00 0.00 H new ATOM 0 HB2 SER A 86 -0.933 8.516 10.358 1.00 0.00 H new ATOM 0 HB3 SER A 86 -0.698 6.925 11.053 1.00 0.00 H new ATOM 0 HG SER A 86 1.212 8.230 11.181 1.00 0.00 H new ATOM 1241 N PHE A 87 -3.170 6.369 9.075 1.00 0.00 N ATOM 1242 CA PHE A 87 -4.577 6.391 8.696 1.00 0.00 C ATOM 1243 C PHE A 87 -5.440 6.764 9.902 1.00 0.00 C ATOM 1244 O PHE A 87 -5.013 6.693 11.061 1.00 0.00 O ATOM 1245 CB PHE A 87 -4.974 5.062 8.024 1.00 0.00 C ATOM 1246 CG PHE A 87 -4.418 4.913 6.613 1.00 0.00 C ATOM 1247 CD1 PHE A 87 -3.048 4.655 6.403 1.00 0.00 C ATOM 1248 CD2 PHE A 87 -5.266 5.065 5.495 1.00 0.00 C ATOM 1249 CE1 PHE A 87 -2.524 4.613 5.098 1.00 0.00 C ATOM 1250 CE2 PHE A 87 -4.741 5.024 4.193 1.00 0.00 C ATOM 1251 CZ PHE A 87 -3.366 4.837 3.992 1.00 0.00 C ATOM 0 H PHE A 87 -2.943 5.649 9.762 1.00 0.00 H new ATOM 0 HA PHE A 87 -4.752 7.164 7.948 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -4.620 4.233 8.636 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -6.061 4.991 7.989 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -2.397 4.489 7.249 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -6.326 5.214 5.642 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -1.475 4.409 4.944 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -5.399 5.137 3.344 1.00 0.00 H new ATOM 0 HZ PHE A 87 -2.955 4.865 2.994 1.00 0.00 H new ATOM 1261 N GLY A 88 -6.671 7.186 9.622 1.00 0.00 N ATOM 1262 CA GLY A 88 -7.759 7.168 10.586 1.00 0.00 C ATOM 1263 C GLY A 88 -8.333 5.754 10.650 1.00 0.00 C ATOM 1264 O GLY A 88 -7.750 4.806 10.113 1.00 0.00 O ATOM 0 H GLY A 88 -6.940 7.553 8.709 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -7.399 7.474 11.568 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -8.534 7.877 10.295 1.00 0.00 H new ATOM 1268 N THR A 89 -9.483 5.601 11.291 1.00 0.00 N ATOM 1269 CA THR A 89 -10.301 4.417 11.189 1.00 0.00 C ATOM 1270 C THR A 89 -11.036 4.521 9.848 1.00 0.00 C ATOM 1271 O THR A 89 -11.308 5.618 9.341 1.00 0.00 O ATOM 1272 CB THR A 89 -11.272 4.346 12.387 1.00 0.00 C ATOM 1273 OG1 THR A 89 -10.767 5.052 13.512 1.00 0.00 O ATOM 1274 CG2 THR A 89 -11.475 2.894 12.818 1.00 0.00 C ATOM 0 H THR A 89 -9.875 6.314 11.906 1.00 0.00 H new ATOM 0 HA THR A 89 -9.712 3.500 11.220 1.00 0.00 H new ATOM 0 HB THR A 89 -12.210 4.795 12.059 1.00 0.00 H new ATOM 0 HG1 THR A 89 -11.406 4.989 14.252 1.00 0.00 H new ATOM 0 HG21 THR A 89 -12.162 2.858 13.664 1.00 0.00 H new ATOM 0 HG22 THR A 89 -11.891 2.323 11.988 1.00 0.00 H new ATOM 0 HG23 THR A 89 -10.517 2.464 13.110 1.00 0.00 H new ATOM 1282 N LEU A 90 -11.327 3.370 9.265 1.00 0.00 N ATOM 1283 CA LEU A 90 -11.831 3.211 7.906 1.00 0.00 C ATOM 1284 C LEU A 90 -13.118 2.391 7.904 1.00 0.00 C ATOM 1285 O LEU A 90 -13.490 1.788 8.914 1.00 0.00 O ATOM 1286 CB LEU A 90 -10.770 2.490 7.052 1.00 0.00 C ATOM 1287 CG LEU A 90 -9.330 3.030 7.149 1.00 0.00 C ATOM 1288 CD1 LEU A 90 -8.385 2.117 6.376 1.00 0.00 C ATOM 1289 CD2 LEU A 90 -9.203 4.457 6.611 1.00 0.00 C ATOM 0 H LEU A 90 -11.214 2.478 9.747 1.00 0.00 H new ATOM 0 HA LEU A 90 -12.041 4.197 7.492 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -10.760 1.438 7.336 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -11.082 2.536 6.009 1.00 0.00 H new ATOM 0 HG LEU A 90 -9.064 3.049 8.206 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -7.368 2.502 6.447 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -8.423 1.113 6.798 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -8.688 2.082 5.329 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -8.169 4.790 6.702 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -9.500 4.478 5.562 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -9.850 5.121 7.184 1.00 0.00 H new ATOM 1301 N GLY A 91 -13.762 2.326 6.737 1.00 0.00 N ATOM 1302 CA GLY A 91 -14.808 1.363 6.438 1.00 0.00 C ATOM 1303 C GLY A 91 -15.559 1.746 5.169 1.00 0.00 C ATOM 1304 O GLY A 91 -15.325 2.818 4.598 1.00 0.00 O ATOM 0 H GLY A 91 -13.562 2.957 5.961 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -14.371 0.371 6.320 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -15.505 1.307 7.274 1.00 0.00 H new ATOM 1308 N GLY A 92 -16.495 0.904 4.730 1.00 0.00 N ATOM 1309 CA GLY A 92 -17.282 1.146 3.529 1.00 0.00 C ATOM 1310 C GLY A 92 -18.571 0.321 3.552 1.00 0.00 C ATOM 1311 O GLY A 92 -19.408 0.486 4.442 1.00 0.00 O ATOM 0 H GLY A 92 -16.727 0.031 5.203 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -17.524 2.206 3.454 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -16.696 0.890 2.646 1.00 0.00 H new ATOM 1315 N THR A 93 -18.689 -0.602 2.606 1.00 0.00 N ATOM 1316 CA THR A 93 -19.773 -1.555 2.356 1.00 0.00 C ATOM 1317 C THR A 93 -19.262 -2.998 2.564 1.00 0.00 C ATOM 1318 O THR A 93 -18.141 -3.195 3.026 1.00 0.00 O ATOM 1319 CB THR A 93 -20.441 -1.252 1.005 1.00 0.00 C ATOM 1320 OG1 THR A 93 -21.438 -2.186 0.644 1.00 0.00 O ATOM 1321 CG2 THR A 93 -19.369 -1.236 -0.049 1.00 0.00 C ATOM 0 H THR A 93 -17.946 -0.717 1.916 1.00 0.00 H new ATOM 0 HA THR A 93 -20.579 -1.446 3.082 1.00 0.00 H new ATOM 0 HB THR A 93 -20.943 -0.289 1.093 1.00 0.00 H new ATOM 0 HG1 THR A 93 -21.823 -1.935 -0.222 1.00 0.00 H new ATOM 0 HG21 THR A 93 -19.816 -1.023 -1.020 1.00 0.00 H new ATOM 0 HG22 THR A 93 -18.636 -0.466 0.190 1.00 0.00 H new ATOM 0 HG23 THR A 93 -18.877 -2.208 -0.082 1.00 0.00 H new ATOM 1329 N ARG A 94 -20.077 -4.020 2.287 1.00 0.00 N ATOM 1330 CA ARG A 94 -19.754 -5.445 2.394 1.00 0.00 C ATOM 1331 C ARG A 94 -20.415 -6.177 1.226 1.00 0.00 C ATOM 1332 O ARG A 94 -21.263 -7.054 1.390 1.00 0.00 O ATOM 1333 CB ARG A 94 -20.248 -5.979 3.752 1.00 0.00 C ATOM 1334 CG ARG A 94 -19.608 -5.310 4.980 1.00 0.00 C ATOM 1335 CD ARG A 94 -18.163 -5.751 5.229 1.00 0.00 C ATOM 1336 NE ARG A 94 -17.652 -5.308 6.542 1.00 0.00 N ATOM 1337 CZ ARG A 94 -16.355 -5.244 6.881 1.00 0.00 C ATOM 1338 NH1 ARG A 94 -15.392 -5.480 6.001 1.00 0.00 N ATOM 1339 NH2 ARG A 94 -15.989 -4.940 8.115 1.00 0.00 N ATOM 0 H ARG A 94 -21.032 -3.866 1.964 1.00 0.00 H new ATOM 0 HA ARG A 94 -18.677 -5.608 2.345 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -21.329 -5.848 3.807 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -20.054 -7.051 3.797 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -19.632 -4.228 4.849 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -20.207 -5.538 5.862 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -18.103 -6.838 5.168 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -17.524 -5.352 4.441 1.00 0.00 H new ATOM 0 HE ARG A 94 -18.337 -5.029 7.245 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -15.628 -5.718 5.038 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -14.415 -5.424 6.287 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -16.697 -4.750 8.825 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -14.999 -4.895 8.357 1.00 0.00 H new ATOM 1353 N MET A 95 -20.105 -5.735 0.010 1.00 0.00 N ATOM 1354 CA MET A 95 -20.664 -6.305 -1.212 1.00 0.00 C ATOM 1355 C MET A 95 -20.133 -7.733 -1.409 1.00 0.00 C ATOM 1356 O MET A 95 -19.092 -8.071 -0.841 1.00 0.00 O ATOM 1357 CB MET A 95 -20.402 -5.378 -2.416 1.00 0.00 C ATOM 1358 CG MET A 95 -20.515 -3.881 -2.073 1.00 0.00 C ATOM 1359 SD MET A 95 -20.597 -2.721 -3.470 1.00 0.00 S ATOM 1360 CE MET A 95 -18.872 -2.159 -3.565 1.00 0.00 C ATOM 0 H MET A 95 -19.455 -4.967 -0.156 1.00 0.00 H new ATOM 0 HA MET A 95 -21.748 -6.380 -1.125 1.00 0.00 H new ATOM 0 HB2 MET A 95 -19.405 -5.579 -2.809 1.00 0.00 H new ATOM 0 HB3 MET A 95 -21.111 -5.616 -3.209 1.00 0.00 H new ATOM 0 HG2 MET A 95 -21.406 -3.739 -1.462 1.00 0.00 H new ATOM 0 HG3 MET A 95 -19.659 -3.609 -1.456 1.00 0.00 H new ATOM 0 HE1 MET A 95 -18.826 -1.215 -4.108 1.00 0.00 H new ATOM 0 HE2 MET A 95 -18.479 -2.017 -2.558 1.00 0.00 H new ATOM 0 HE3 MET A 95 -18.274 -2.907 -4.086 1.00 0.00 H new ATOM 1370 N ALA A 96 -20.820 -8.569 -2.197 1.00 0.00 N ATOM 1371 CA ALA A 96 -20.531 -9.999 -2.362 1.00 0.00 C ATOM 1372 C ALA A 96 -19.999 -10.271 -3.756 1.00 0.00 C ATOM 1373 O ALA A 96 -20.761 -10.163 -4.720 1.00 0.00 O ATOM 1374 CB ALA A 96 -21.791 -10.848 -2.160 1.00 0.00 C ATOM 0 H ALA A 96 -21.616 -8.260 -2.754 1.00 0.00 H new ATOM 0 HA ALA A 96 -19.788 -10.267 -1.611 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -21.544 -11.902 -2.289 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -22.181 -10.687 -1.155 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -22.545 -10.560 -2.892 1.00 0.00 H new ATOM 1380 N CYS A 97 -18.727 -10.649 -3.857 1.00 0.00 N ATOM 1381 CA CYS A 97 -18.044 -10.872 -5.126 1.00 0.00 C ATOM 1382 C CYS A 97 -17.556 -12.290 -5.358 1.00 0.00 C ATOM 1383 O CYS A 97 -17.225 -12.596 -6.498 1.00 0.00 O ATOM 1384 CB CYS A 97 -16.932 -9.840 -5.315 1.00 0.00 C ATOM 1385 SG CYS A 97 -17.598 -8.320 -6.028 1.00 0.00 S ATOM 0 H CYS A 97 -18.133 -10.811 -3.044 1.00 0.00 H new ATOM 0 HA CYS A 97 -18.800 -10.733 -5.899 1.00 0.00 H new ATOM 0 HB2 CYS A 97 -16.461 -9.624 -4.356 1.00 0.00 H new ATOM 0 HB3 CYS A 97 -16.157 -10.246 -5.966 1.00 0.00 H new ATOM 1390 N MET A 98 -17.604 -13.164 -4.351 1.00 0.00 N ATOM 1391 CA MET A 98 -17.340 -14.595 -4.493 1.00 0.00 C ATOM 1392 C MET A 98 -15.920 -14.892 -4.991 1.00 0.00 C ATOM 1393 O MET A 98 -15.635 -15.986 -5.483 1.00 0.00 O ATOM 1394 CB MET A 98 -18.450 -15.258 -5.332 1.00 0.00 C ATOM 1395 CG MET A 98 -19.847 -14.899 -4.820 1.00 0.00 C ATOM 1396 SD MET A 98 -21.242 -15.609 -5.728 1.00 0.00 S ATOM 1397 CE MET A 98 -21.242 -14.505 -7.161 1.00 0.00 C ATOM 0 H MET A 98 -17.832 -12.890 -3.395 1.00 0.00 H new ATOM 0 HA MET A 98 -17.372 -15.050 -3.503 1.00 0.00 H new ATOM 0 HB2 MET A 98 -18.354 -14.946 -6.372 1.00 0.00 H new ATOM 0 HB3 MET A 98 -18.323 -16.340 -5.311 1.00 0.00 H new ATOM 0 HG2 MET A 98 -19.921 -15.214 -3.779 1.00 0.00 H new ATOM 0 HG3 MET A 98 -19.947 -13.814 -4.833 1.00 0.00 H new ATOM 0 HE1 MET A 98 -22.044 -14.792 -7.841 1.00 0.00 H new ATOM 0 HE2 MET A 98 -21.397 -13.478 -6.829 1.00 0.00 H new ATOM 0 HE3 MET A 98 -20.285 -14.579 -7.677 1.00 0.00 H new ATOM 1407 N THR A 99 -15.005 -13.951 -4.795 1.00 0.00 N ATOM 1408 CA THR A 99 -13.601 -14.022 -5.173 1.00 0.00 C ATOM 1409 C THR A 99 -12.745 -14.030 -3.907 1.00 0.00 C ATOM 1410 O THR A 99 -13.163 -13.453 -2.898 1.00 0.00 O ATOM 1411 CB THR A 99 -13.245 -12.824 -6.070 1.00 0.00 C ATOM 1412 OG1 THR A 99 -13.675 -11.611 -5.479 1.00 0.00 O ATOM 1413 CG2 THR A 99 -13.877 -12.947 -7.452 1.00 0.00 C ATOM 0 H THR A 99 -15.237 -13.067 -4.342 1.00 0.00 H new ATOM 0 HA THR A 99 -13.409 -14.936 -5.734 1.00 0.00 H new ATOM 0 HB THR A 99 -12.160 -12.821 -6.177 1.00 0.00 H new ATOM 0 HG1 THR A 99 -13.438 -10.861 -6.063 1.00 0.00 H new ATOM 0 HG21 THR A 99 -13.602 -12.082 -8.056 1.00 0.00 H new ATOM 0 HG22 THR A 99 -13.519 -13.856 -7.936 1.00 0.00 H new ATOM 0 HG23 THR A 99 -14.962 -12.991 -7.353 1.00 0.00 H new ATOM 1421 N PRO A 100 -11.524 -14.589 -3.934 1.00 0.00 N ATOM 1422 CA PRO A 100 -10.607 -14.434 -2.816 1.00 0.00 C ATOM 1423 C PRO A 100 -10.225 -12.961 -2.669 1.00 0.00 C ATOM 1424 O PRO A 100 -10.217 -12.433 -1.557 1.00 0.00 O ATOM 1425 CB PRO A 100 -9.416 -15.336 -3.133 1.00 0.00 C ATOM 1426 CG PRO A 100 -9.436 -15.504 -4.656 1.00 0.00 C ATOM 1427 CD PRO A 100 -10.881 -15.230 -5.073 1.00 0.00 C ATOM 0 HA PRO A 100 -11.041 -14.724 -1.859 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -8.481 -14.887 -2.798 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -9.505 -16.298 -2.629 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -8.749 -14.808 -5.138 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -9.127 -16.509 -4.945 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -10.916 -14.586 -5.952 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -11.391 -16.156 -5.336 1.00 0.00 H new ATOM 1435 N GLY A 101 -9.991 -12.281 -3.793 1.00 0.00 N ATOM 1436 CA GLY A 101 -9.653 -10.873 -3.845 1.00 0.00 C ATOM 1437 C GLY A 101 -10.810 -9.948 -3.486 1.00 0.00 C ATOM 1438 O GLY A 101 -10.556 -8.758 -3.396 1.00 0.00 O ATOM 0 H GLY A 101 -10.035 -12.715 -4.715 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -8.824 -10.683 -3.164 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -9.304 -10.630 -4.848 1.00 0.00 H new ATOM 1442 N GLY A 102 -12.039 -10.435 -3.268 1.00 0.00 N ATOM 1443 CA GLY A 102 -13.110 -9.633 -2.697 1.00 0.00 C ATOM 1444 C GLY A 102 -12.922 -9.520 -1.189 1.00 0.00 C ATOM 1445 O GLY A 102 -12.798 -8.429 -0.639 1.00 0.00 O ATOM 0 H GLY A 102 -12.310 -11.394 -3.484 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -13.114 -8.641 -3.148 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -14.075 -10.088 -2.919 1.00 0.00 H new ATOM 1449 N GLN A 103 -12.881 -10.671 -0.524 1.00 0.00 N ATOM 1450 CA GLN A 103 -12.970 -10.779 0.928 1.00 0.00 C ATOM 1451 C GLN A 103 -11.721 -10.225 1.618 1.00 0.00 C ATOM 1452 O GLN A 103 -11.771 -9.940 2.812 1.00 0.00 O ATOM 1453 CB GLN A 103 -13.199 -12.243 1.329 1.00 0.00 C ATOM 1454 CG GLN A 103 -14.272 -12.931 0.474 1.00 0.00 C ATOM 1455 CD GLN A 103 -14.683 -14.271 1.053 1.00 0.00 C ATOM 1456 OE1 GLN A 103 -14.155 -15.319 0.677 1.00 0.00 O ATOM 1457 NE2 GLN A 103 -15.615 -14.274 1.982 1.00 0.00 N ATOM 0 H GLN A 103 -12.783 -11.573 -0.990 1.00 0.00 H new ATOM 0 HA GLN A 103 -13.817 -10.177 1.258 1.00 0.00 H new ATOM 0 HB2 GLN A 103 -12.261 -12.791 1.238 1.00 0.00 H new ATOM 0 HB3 GLN A 103 -13.493 -12.286 2.378 1.00 0.00 H new ATOM 0 HG2 GLN A 103 -15.146 -12.284 0.399 1.00 0.00 H new ATOM 0 HG3 GLN A 103 -13.893 -13.074 -0.538 1.00 0.00 H new ATOM 0 HE21 GLN A 103 -16.041 -13.396 2.280 1.00 0.00 H new ATOM 0 HE22 GLN A 103 -15.912 -15.154 2.404 1.00 0.00 H new ATOM 1466 N ILE A 104 -10.620 -10.032 0.879 1.00 0.00 N ATOM 1467 CA ILE A 104 -9.401 -9.410 1.388 1.00 0.00 C ATOM 1468 C ILE A 104 -9.640 -7.946 1.804 1.00 0.00 C ATOM 1469 O ILE A 104 -8.752 -7.351 2.409 1.00 0.00 O ATOM 1470 CB ILE A 104 -8.259 -9.580 0.360 1.00 0.00 C ATOM 1471 CG1 ILE A 104 -6.878 -9.361 1.015 1.00 0.00 C ATOM 1472 CG2 ILE A 104 -8.446 -8.662 -0.858 1.00 0.00 C ATOM 1473 CD1 ILE A 104 -5.715 -9.930 0.200 1.00 0.00 C ATOM 0 H ILE A 104 -10.555 -10.309 -0.101 1.00 0.00 H new ATOM 0 HA ILE A 104 -9.092 -9.919 2.301 1.00 0.00 H new ATOM 0 HB ILE A 104 -8.300 -10.608 0.001 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -6.720 -8.292 1.161 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -6.877 -9.821 2.003 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -7.623 -8.812 -1.556 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -9.388 -8.900 -1.351 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -8.460 -7.622 -0.531 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -4.777 -9.739 0.722 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -5.849 -11.005 0.076 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -5.689 -9.452 -0.779 1.00 0.00 H new ATOM 1485 N GLU A 105 -10.827 -7.370 1.558 1.00 0.00 N ATOM 1486 CA GLU A 105 -11.243 -6.114 2.176 1.00 0.00 C ATOM 1487 C GLU A 105 -10.906 -6.116 3.674 1.00 0.00 C ATOM 1488 O GLU A 105 -10.263 -5.182 4.162 1.00 0.00 O ATOM 1489 CB GLU A 105 -12.766 -5.913 1.977 1.00 0.00 C ATOM 1490 CG GLU A 105 -13.235 -4.607 2.657 1.00 0.00 C ATOM 1491 CD GLU A 105 -14.707 -4.498 3.048 1.00 0.00 C ATOM 1492 OE1 GLU A 105 -15.383 -5.530 3.248 1.00 0.00 O ATOM 1493 OE2 GLU A 105 -15.143 -3.337 3.253 1.00 0.00 O ATOM 0 H GLU A 105 -11.521 -7.767 0.924 1.00 0.00 H new ATOM 0 HA GLU A 105 -10.706 -5.293 1.700 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -12.998 -5.879 0.912 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -13.308 -6.762 2.394 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -12.638 -4.465 3.558 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -13.004 -3.779 1.987 1.00 0.00 H new ATOM 1500 N GLY A 106 -11.339 -7.154 4.397 1.00 0.00 N ATOM 1501 CA GLY A 106 -11.210 -7.213 5.843 1.00 0.00 C ATOM 1502 C GLY A 106 -9.756 -7.161 6.302 1.00 0.00 C ATOM 1503 O GLY A 106 -9.426 -6.403 7.221 1.00 0.00 O ATOM 0 H GLY A 106 -11.788 -7.974 3.989 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -11.758 -6.382 6.288 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -11.671 -8.131 6.209 1.00 0.00 H new ATOM 1507 N ALA A 107 -8.887 -7.950 5.666 1.00 0.00 N ATOM 1508 CA ALA A 107 -7.468 -7.943 5.969 1.00 0.00 C ATOM 1509 C ALA A 107 -6.858 -6.609 5.555 1.00 0.00 C ATOM 1510 O ALA A 107 -5.980 -6.105 6.243 1.00 0.00 O ATOM 1511 CB ALA A 107 -6.759 -9.094 5.249 1.00 0.00 C ATOM 0 H ALA A 107 -9.153 -8.606 4.931 1.00 0.00 H new ATOM 0 HA ALA A 107 -7.338 -8.077 7.043 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -5.696 -9.073 5.488 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -7.185 -10.043 5.573 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -6.891 -8.986 4.172 1.00 0.00 H new ATOM 1517 N TYR A 108 -7.273 -6.028 4.430 1.00 0.00 N ATOM 1518 CA TYR A 108 -6.619 -4.832 3.931 1.00 0.00 C ATOM 1519 C TYR A 108 -6.888 -3.638 4.846 1.00 0.00 C ATOM 1520 O TYR A 108 -5.943 -2.973 5.261 1.00 0.00 O ATOM 1521 CB TYR A 108 -7.002 -4.561 2.477 1.00 0.00 C ATOM 1522 CG TYR A 108 -6.222 -3.390 1.929 1.00 0.00 C ATOM 1523 CD1 TYR A 108 -4.814 -3.420 1.976 1.00 0.00 C ATOM 1524 CD2 TYR A 108 -6.892 -2.230 1.500 1.00 0.00 C ATOM 1525 CE1 TYR A 108 -4.077 -2.279 1.634 1.00 0.00 C ATOM 1526 CE2 TYR A 108 -6.158 -1.090 1.139 1.00 0.00 C ATOM 1527 CZ TYR A 108 -4.751 -1.105 1.240 1.00 0.00 C ATOM 1528 OH TYR A 108 -4.042 0.031 1.035 1.00 0.00 O ATOM 0 H TYR A 108 -8.048 -6.364 3.858 1.00 0.00 H new ATOM 0 HA TYR A 108 -5.542 -4.998 3.942 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -6.808 -5.448 1.873 1.00 0.00 H new ATOM 0 HB3 TYR A 108 -8.070 -4.356 2.409 1.00 0.00 H new ATOM 0 HD1 TYR A 108 -4.303 -4.323 2.276 1.00 0.00 H new ATOM 0 HD2 TYR A 108 -7.971 -2.217 1.449 1.00 0.00 H new ATOM 0 HE1 TYR A 108 -2.998 -2.298 1.672 1.00 0.00 H new ATOM 0 HE2 TYR A 108 -6.667 -0.206 0.786 1.00 0.00 H new ATOM 0 HH TYR A 108 -3.520 -0.054 0.210 1.00 0.00 H new ATOM 1538 N LEU A 109 -8.141 -3.408 5.252 1.00 0.00 N ATOM 1539 CA LEU A 109 -8.460 -2.372 6.243 1.00 0.00 C ATOM 1540 C LEU A 109 -7.742 -2.642 7.572 1.00 0.00 C ATOM 1541 O LEU A 109 -7.411 -1.696 8.287 1.00 0.00 O ATOM 1542 CB LEU A 109 -9.981 -2.301 6.465 1.00 0.00 C ATOM 1543 CG LEU A 109 -10.721 -1.318 5.543 1.00 0.00 C ATOM 1544 CD1 LEU A 109 -10.572 -1.593 4.045 1.00 0.00 C ATOM 1545 CD2 LEU A 109 -12.210 -1.378 5.890 1.00 0.00 C ATOM 0 H LEU A 109 -8.951 -3.925 4.910 1.00 0.00 H new ATOM 0 HA LEU A 109 -8.112 -1.414 5.858 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -10.402 -3.297 6.324 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -10.170 -2.019 7.501 1.00 0.00 H new ATOM 0 HG LEU A 109 -10.272 -0.340 5.717 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -11.130 -0.846 3.481 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -9.519 -1.544 3.769 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -10.961 -2.585 3.817 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -12.761 -0.689 5.250 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -12.579 -2.392 5.734 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -12.352 -1.096 6.933 1.00 0.00 H new ATOM 1557 N ASN A 110 -7.474 -3.912 7.898 1.00 0.00 N ATOM 1558 CA ASN A 110 -6.639 -4.285 9.044 1.00 0.00 C ATOM 1559 C ASN A 110 -5.193 -3.836 8.846 1.00 0.00 C ATOM 1560 O ASN A 110 -4.550 -3.395 9.790 1.00 0.00 O ATOM 1561 CB ASN A 110 -6.616 -5.809 9.244 1.00 0.00 C ATOM 1562 CG ASN A 110 -6.322 -6.244 10.668 1.00 0.00 C ATOM 1563 OD1 ASN A 110 -6.897 -7.231 11.118 1.00 0.00 O ATOM 1564 ND2 ASN A 110 -5.434 -5.582 11.389 1.00 0.00 N ATOM 0 H ASN A 110 -7.831 -4.711 7.373 1.00 0.00 H new ATOM 0 HA ASN A 110 -7.075 -3.792 9.913 1.00 0.00 H new ATOM 0 HB2 ASN A 110 -7.580 -6.219 8.942 1.00 0.00 H new ATOM 0 HB3 ASN A 110 -5.865 -6.240 8.582 1.00 0.00 H new ATOM 0 HD21 ASN A 110 -5.216 -5.889 12.337 1.00 0.00 H new ATOM 0 HD22 ASN A 110 -4.967 -4.764 10.997 1.00 0.00 H new ATOM 1571 N ALA A 111 -4.644 -3.999 7.648 1.00 0.00 N ATOM 1572 CA ALA A 111 -3.242 -3.743 7.363 1.00 0.00 C ATOM 1573 C ALA A 111 -2.893 -2.254 7.474 1.00 0.00 C ATOM 1574 O ALA A 111 -1.718 -1.912 7.624 1.00 0.00 O ATOM 1575 CB ALA A 111 -2.927 -4.298 5.975 1.00 0.00 C ATOM 0 H ALA A 111 -5.172 -4.318 6.836 1.00 0.00 H new ATOM 0 HA ALA A 111 -2.624 -4.245 8.108 1.00 0.00 H new ATOM 0 HB1 ALA A 111 -1.878 -4.117 5.740 1.00 0.00 H new ATOM 0 HB2 ALA A 111 -3.122 -5.370 5.959 1.00 0.00 H new ATOM 0 HB3 ALA A 111 -3.556 -3.804 5.234 1.00 0.00 H new ATOM 1581 N LEU A 112 -3.888 -1.361 7.431 1.00 0.00 N ATOM 1582 CA LEU A 112 -3.700 0.053 7.740 1.00 0.00 C ATOM 1583 C LEU A 112 -3.472 0.309 9.235 1.00 0.00 C ATOM 1584 O LEU A 112 -3.060 1.416 9.581 1.00 0.00 O ATOM 1585 CB LEU A 112 -4.876 0.908 7.217 1.00 0.00 C ATOM 1586 CG LEU A 112 -4.887 1.243 5.707 1.00 0.00 C ATOM 1587 CD1 LEU A 112 -3.495 1.447 5.114 1.00 0.00 C ATOM 1588 CD2 LEU A 112 -5.631 0.238 4.838 1.00 0.00 C ATOM 0 H LEU A 112 -4.847 -1.603 7.180 1.00 0.00 H new ATOM 0 HA LEU A 112 -2.792 0.358 7.220 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -5.804 0.388 7.455 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -4.885 1.846 7.772 1.00 0.00 H new ATOM 0 HG LEU A 112 -5.433 2.186 5.685 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -3.582 1.678 4.052 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -2.999 2.272 5.626 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -2.909 0.537 5.240 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -5.586 0.555 3.796 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -5.168 -0.744 4.939 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -6.672 0.183 5.156 1.00 0.00 H new ATOM 1600 N THR A 113 -3.704 -0.655 10.133 1.00 0.00 N ATOM 1601 CA THR A 113 -3.599 -0.428 11.573 1.00 0.00 C ATOM 1602 C THR A 113 -2.216 -0.794 12.120 1.00 0.00 C ATOM 1603 O THR A 113 -2.087 -0.969 13.330 1.00 0.00 O ATOM 1604 CB THR A 113 -4.752 -1.103 12.350 1.00 0.00 C ATOM 1605 OG1 THR A 113 -4.631 -2.505 12.511 1.00 0.00 O ATOM 1606 CG2 THR A 113 -6.124 -0.842 11.724 1.00 0.00 C ATOM 0 H THR A 113 -3.968 -1.608 9.881 1.00 0.00 H new ATOM 0 HA THR A 113 -3.709 0.644 11.735 1.00 0.00 H new ATOM 0 HB THR A 113 -4.672 -0.633 13.330 1.00 0.00 H new ATOM 0 HG1 THR A 113 -4.562 -2.931 11.631 1.00 0.00 H new ATOM 0 HG21 THR A 113 -6.894 -1.341 12.313 1.00 0.00 H new ATOM 0 HG22 THR A 113 -6.318 0.230 11.707 1.00 0.00 H new ATOM 0 HG23 THR A 113 -6.139 -1.229 10.705 1.00 0.00 H new ATOM 1614 N HIS A 114 -1.200 -0.990 11.269 1.00 0.00 N ATOM 1615 CA HIS A 114 0.105 -1.515 11.672 1.00 0.00 C ATOM 1616 C HIS A 114 1.258 -0.814 10.929 1.00 0.00 C ATOM 1617 O HIS A 114 2.292 -1.437 10.702 1.00 0.00 O ATOM 1618 CB HIS A 114 0.100 -3.045 11.469 1.00 0.00 C ATOM 1619 CG HIS A 114 -0.757 -3.802 12.453 1.00 0.00 C ATOM 1620 ND1 HIS A 114 -0.379 -4.232 13.707 1.00 0.00 N ATOM 1621 CD2 HIS A 114 -2.051 -4.191 12.251 1.00 0.00 C ATOM 1622 CE1 HIS A 114 -1.442 -4.834 14.266 1.00 0.00 C ATOM 1623 NE2 HIS A 114 -2.481 -4.849 13.408 1.00 0.00 N ATOM 0 H HIS A 114 -1.265 -0.785 10.272 1.00 0.00 H new ATOM 0 HA HIS A 114 0.279 -1.304 12.727 1.00 0.00 H new ATOM 0 HB2 HIS A 114 -0.248 -3.264 10.459 1.00 0.00 H new ATOM 0 HB3 HIS A 114 1.124 -3.412 11.540 1.00 0.00 H new ATOM 0 HD2 HIS A 114 -2.636 -4.021 11.359 1.00 0.00 H new ATOM 0 HE1 HIS A 114 -1.461 -5.248 15.263 1.00 0.00 H new ATOM 0 HE2 HIS A 114 -3.400 -5.260 13.570 1.00 0.00 H new ATOM 1631 N ILE A 115 1.108 0.451 10.516 1.00 0.00 N ATOM 1632 CA ILE A 115 2.122 1.242 9.830 1.00 0.00 C ATOM 1633 C ILE A 115 3.204 1.588 10.854 1.00 0.00 C ATOM 1634 O ILE A 115 3.218 2.690 11.410 1.00 0.00 O ATOM 1635 CB ILE A 115 1.541 2.532 9.177 1.00 0.00 C ATOM 1636 CG1 ILE A 115 0.155 2.382 8.518 1.00 0.00 C ATOM 1637 CG2 ILE A 115 2.566 3.110 8.191 1.00 0.00 C ATOM 1638 CD1 ILE A 115 0.083 1.417 7.334 1.00 0.00 C ATOM 0 H ILE A 115 0.240 0.967 10.659 1.00 0.00 H new ATOM 0 HA ILE A 115 2.534 0.658 9.007 1.00 0.00 H new ATOM 0 HB ILE A 115 1.362 3.225 9.999 1.00 0.00 H new ATOM 0 HG12 ILE A 115 -0.553 2.050 9.277 1.00 0.00 H new ATOM 0 HG13 ILE A 115 -0.175 3.365 8.182 1.00 0.00 H new ATOM 0 HG21 ILE A 115 2.161 4.013 7.733 1.00 0.00 H new ATOM 0 HG22 ILE A 115 3.485 3.354 8.723 1.00 0.00 H new ATOM 0 HG23 ILE A 115 2.780 2.374 7.416 1.00 0.00 H new ATOM 0 HD11 ILE A 115 -0.936 1.389 6.949 1.00 0.00 H new ATOM 0 HD12 ILE A 115 0.759 1.754 6.548 1.00 0.00 H new ATOM 0 HD13 ILE A 115 0.375 0.419 7.660 1.00 0.00 H new ATOM 1650 N ASP A 116 4.118 0.664 11.132 1.00 0.00 N ATOM 1651 CA ASP A 116 5.332 1.029 11.852 1.00 0.00 C ATOM 1652 C ASP A 116 6.328 1.658 10.884 1.00 0.00 C ATOM 1653 O ASP A 116 6.988 2.632 11.242 1.00 0.00 O ATOM 1654 CB ASP A 116 5.943 -0.148 12.611 1.00 0.00 C ATOM 1655 CG ASP A 116 6.541 0.382 13.916 1.00 0.00 C ATOM 1656 OD1 ASP A 116 7.645 0.967 13.885 1.00 0.00 O ATOM 1657 OD2 ASP A 116 5.820 0.336 14.939 1.00 0.00 O ATOM 0 H ASP A 116 4.045 -0.321 10.877 1.00 0.00 H new ATOM 0 HA ASP A 116 5.066 1.762 12.614 1.00 0.00 H new ATOM 0 HB2 ASP A 116 5.183 -0.901 12.820 1.00 0.00 H new ATOM 0 HB3 ASP A 116 6.713 -0.630 12.009 1.00 0.00 H new ATOM 1662 N ARG A 117 6.363 1.192 9.625 1.00 0.00 N ATOM 1663 CA ARG A 117 7.316 1.645 8.607 1.00 0.00 C ATOM 1664 C ARG A 117 6.579 2.123 7.356 1.00 0.00 C ATOM 1665 O ARG A 117 5.392 1.853 7.177 1.00 0.00 O ATOM 1666 CB ARG A 117 8.317 0.530 8.308 1.00 0.00 C ATOM 1667 CG ARG A 117 9.383 0.506 9.410 1.00 0.00 C ATOM 1668 CD ARG A 117 10.609 -0.313 9.026 1.00 0.00 C ATOM 1669 NE ARG A 117 11.363 0.240 7.880 1.00 0.00 N ATOM 1670 CZ ARG A 117 12.694 0.276 7.709 1.00 0.00 C ATOM 1671 NH1 ARG A 117 13.526 -0.299 8.567 1.00 0.00 N ATOM 1672 NH2 ARG A 117 13.189 0.897 6.646 1.00 0.00 N ATOM 0 H ARG A 117 5.719 0.479 9.284 1.00 0.00 H new ATOM 0 HA ARG A 117 7.878 2.500 8.984 1.00 0.00 H new ATOM 0 HB2 ARG A 117 7.806 -0.431 8.258 1.00 0.00 H new ATOM 0 HB3 ARG A 117 8.784 0.694 7.337 1.00 0.00 H new ATOM 0 HG2 ARG A 117 9.690 1.527 9.635 1.00 0.00 H new ATOM 0 HG3 ARG A 117 8.948 0.096 10.321 1.00 0.00 H new ATOM 0 HD2 ARG A 117 11.274 -0.380 9.887 1.00 0.00 H new ATOM 0 HD3 ARG A 117 10.295 -1.329 8.786 1.00 0.00 H new ATOM 0 HE ARG A 117 10.804 0.643 7.128 1.00 0.00 H new ATOM 0 HH11 ARG A 117 13.159 -0.786 9.385 1.00 0.00 H new ATOM 0 HH12 ARG A 117 14.533 -0.254 8.409 1.00 0.00 H new ATOM 0 HH21 ARG A 117 12.561 1.338 5.974 1.00 0.00 H new ATOM 0 HH22 ARG A 117 14.198 0.934 6.501 1.00 0.00 H new ATOM 1686 N THR A 118 7.250 2.857 6.474 1.00 0.00 N ATOM 1687 CA THR A 118 6.726 3.299 5.183 1.00 0.00 C ATOM 1688 C THR A 118 7.940 3.667 4.336 1.00 0.00 C ATOM 1689 O THR A 118 8.918 4.215 4.857 1.00 0.00 O ATOM 1690 CB THR A 118 5.827 4.530 5.388 1.00 0.00 C ATOM 1691 OG1 THR A 118 4.668 4.231 6.141 1.00 0.00 O ATOM 1692 CG2 THR A 118 5.319 5.236 4.121 1.00 0.00 C ATOM 0 H THR A 118 8.205 3.172 6.642 1.00 0.00 H new ATOM 0 HA THR A 118 6.129 2.525 4.700 1.00 0.00 H new ATOM 0 HB THR A 118 6.514 5.201 5.904 1.00 0.00 H new ATOM 0 HG1 THR A 118 4.643 3.271 6.336 1.00 0.00 H new ATOM 0 HG21 THR A 118 4.697 6.086 4.403 1.00 0.00 H new ATOM 0 HG22 THR A 118 6.168 5.586 3.534 1.00 0.00 H new ATOM 0 HG23 THR A 118 4.730 4.537 3.526 1.00 0.00 H new ATOM 1700 N GLY A 119 7.865 3.418 3.034 1.00 0.00 N ATOM 1701 CA GLY A 119 8.927 3.655 2.090 1.00 0.00 C ATOM 1702 C GLY A 119 8.304 4.069 0.768 1.00 0.00 C ATOM 1703 O GLY A 119 7.976 3.213 -0.052 1.00 0.00 O ATOM 0 H GLY A 119 7.027 3.031 2.600 1.00 0.00 H new ATOM 0 HA2 GLY A 119 9.594 4.435 2.457 1.00 0.00 H new ATOM 0 HA3 GLY A 119 9.529 2.755 1.961 1.00 0.00 H new ATOM 1707 N VAL A 120 8.121 5.368 0.533 1.00 0.00 N ATOM 1708 CA VAL A 120 7.823 5.845 -0.814 1.00 0.00 C ATOM 1709 C VAL A 120 9.116 6.110 -1.573 1.00 0.00 C ATOM 1710 O VAL A 120 10.053 6.736 -1.068 1.00 0.00 O ATOM 1711 CB VAL A 120 6.774 6.959 -0.850 1.00 0.00 C ATOM 1712 CG1 VAL A 120 7.156 8.107 0.067 1.00 0.00 C ATOM 1713 CG2 VAL A 120 6.522 7.403 -2.300 1.00 0.00 C ATOM 0 H VAL A 120 8.173 6.097 1.245 1.00 0.00 H new ATOM 0 HA VAL A 120 7.316 5.053 -1.366 1.00 0.00 H new ATOM 0 HB VAL A 120 5.831 6.572 -0.465 1.00 0.00 H new ATOM 0 HG11 VAL A 120 6.391 8.882 0.018 1.00 0.00 H new ATOM 0 HG12 VAL A 120 7.239 7.743 1.091 1.00 0.00 H new ATOM 0 HG13 VAL A 120 8.113 8.522 -0.249 1.00 0.00 H new ATOM 0 HG21 VAL A 120 5.774 8.196 -2.313 1.00 0.00 H new ATOM 0 HG22 VAL A 120 7.451 7.773 -2.734 1.00 0.00 H new ATOM 0 HG23 VAL A 120 6.162 6.555 -2.883 1.00 0.00 H new ATOM 1723 N GLN A 121 9.160 5.600 -2.801 1.00 0.00 N ATOM 1724 CA GLN A 121 10.130 5.936 -3.812 1.00 0.00 C ATOM 1725 C GLN A 121 9.433 6.961 -4.700 1.00 0.00 C ATOM 1726 O GLN A 121 8.770 6.631 -5.690 1.00 0.00 O ATOM 1727 CB GLN A 121 10.529 4.667 -4.563 1.00 0.00 C ATOM 1728 CG GLN A 121 11.496 4.975 -5.710 1.00 0.00 C ATOM 1729 CD GLN A 121 11.749 3.711 -6.506 1.00 0.00 C ATOM 1730 OE1 GLN A 121 12.831 3.132 -6.438 1.00 0.00 O ATOM 1731 NE2 GLN A 121 10.737 3.271 -7.228 1.00 0.00 N ATOM 0 H GLN A 121 8.483 4.909 -3.123 1.00 0.00 H new ATOM 0 HA GLN A 121 11.056 6.353 -3.415 1.00 0.00 H new ATOM 0 HB2 GLN A 121 10.995 3.965 -3.872 1.00 0.00 H new ATOM 0 HB3 GLN A 121 9.637 4.181 -4.958 1.00 0.00 H new ATOM 0 HG2 GLN A 121 11.078 5.747 -6.356 1.00 0.00 H new ATOM 0 HG3 GLN A 121 12.435 5.364 -5.315 1.00 0.00 H new ATOM 0 HE21 GLN A 121 9.860 3.792 -7.248 1.00 0.00 H new ATOM 0 HE22 GLN A 121 10.831 2.410 -7.766 1.00 0.00 H new ATOM 1740 N MET A 122 9.555 8.231 -4.333 1.00 0.00 N ATOM 1741 CA MET A 122 9.045 9.334 -5.123 1.00 0.00 C ATOM 1742 C MET A 122 10.072 9.660 -6.210 1.00 0.00 C ATOM 1743 O MET A 122 10.578 10.781 -6.291 1.00 0.00 O ATOM 1744 CB MET A 122 8.735 10.511 -4.189 1.00 0.00 C ATOM 1745 CG MET A 122 7.914 11.589 -4.891 1.00 0.00 C ATOM 1746 SD MET A 122 6.222 11.112 -5.336 1.00 0.00 S ATOM 1747 CE MET A 122 5.462 10.914 -3.707 1.00 0.00 C ATOM 0 H MET A 122 10.015 8.522 -3.471 1.00 0.00 H new ATOM 0 HA MET A 122 8.112 9.085 -5.628 1.00 0.00 H new ATOM 0 HB2 MET A 122 8.190 10.149 -3.317 1.00 0.00 H new ATOM 0 HB3 MET A 122 9.668 10.943 -3.826 1.00 0.00 H new ATOM 0 HG2 MET A 122 7.868 12.465 -4.245 1.00 0.00 H new ATOM 0 HG3 MET A 122 8.439 11.889 -5.798 1.00 0.00 H new ATOM 0 HE1 MET A 122 5.168 9.874 -3.567 1.00 0.00 H new ATOM 0 HE2 MET A 122 6.178 11.196 -2.935 1.00 0.00 H new ATOM 0 HE3 MET A 122 4.582 11.553 -3.636 1.00 0.00 H new ATOM 1757 N ARG A 123 10.420 8.685 -7.049 1.00 0.00 N ATOM 1758 CA ARG A 123 11.334 8.859 -8.168 1.00 0.00 C ATOM 1759 C ARG A 123 10.795 7.940 -9.252 1.00 0.00 C ATOM 1760 O ARG A 123 10.677 6.753 -8.973 1.00 0.00 O ATOM 1761 CB ARG A 123 12.772 8.484 -7.730 1.00 0.00 C ATOM 1762 CG ARG A 123 13.843 9.251 -8.521 1.00 0.00 C ATOM 1763 CD ARG A 123 14.005 10.699 -8.018 1.00 0.00 C ATOM 1764 NE ARG A 123 14.216 11.620 -9.140 1.00 0.00 N ATOM 1765 CZ ARG A 123 14.290 12.953 -9.141 1.00 0.00 C ATOM 1766 NH1 ARG A 123 14.401 13.654 -8.020 1.00 0.00 N ATOM 1767 NH2 ARG A 123 14.220 13.581 -10.306 1.00 0.00 N ATOM 0 H ARG A 123 10.064 7.733 -6.964 1.00 0.00 H new ATOM 0 HA ARG A 123 11.392 9.886 -8.528 1.00 0.00 H new ATOM 0 HB2 ARG A 123 12.891 8.692 -6.667 1.00 0.00 H new ATOM 0 HB3 ARG A 123 12.922 7.413 -7.864 1.00 0.00 H new ATOM 0 HG2 ARG A 123 14.797 8.730 -8.439 1.00 0.00 H new ATOM 0 HG3 ARG A 123 13.575 9.262 -9.578 1.00 0.00 H new ATOM 0 HD2 ARG A 123 13.117 10.996 -7.460 1.00 0.00 H new ATOM 0 HD3 ARG A 123 14.848 10.758 -7.330 1.00 0.00 H new ATOM 0 HE ARG A 123 14.322 11.177 -10.053 1.00 0.00 H new ATOM 0 HH11 ARG A 123 14.432 13.175 -7.120 1.00 0.00 H new ATOM 0 HH12 ARG A 123 14.455 14.672 -8.058 1.00 0.00 H new ATOM 0 HH21 ARG A 123 14.113 13.046 -11.168 1.00 0.00 H new ATOM 0 HH22 ARG A 123 14.273 14.599 -10.341 1.00 0.00 H new ATOM 1781 N ALA A 124 10.355 8.469 -10.401 1.00 0.00 N ATOM 1782 CA ALA A 124 9.896 7.662 -11.521 1.00 0.00 C ATOM 1783 C ALA A 124 10.925 6.575 -11.822 1.00 0.00 C ATOM 1784 O ALA A 124 12.085 6.939 -12.047 1.00 0.00 O ATOM 1785 CB ALA A 124 9.622 8.532 -12.744 1.00 0.00 C ATOM 0 H ALA A 124 10.310 9.473 -10.573 1.00 0.00 H new ATOM 0 HA ALA A 124 8.954 7.182 -11.255 1.00 0.00 H new ATOM 0 HB1 ALA A 124 9.280 7.905 -13.567 1.00 0.00 H new ATOM 0 HB2 ALA A 124 8.853 9.266 -12.503 1.00 0.00 H new ATOM 0 HB3 ALA A 124 10.537 9.048 -13.036 1.00 0.00 H new ATOM 1791 N PRO A 125 10.544 5.287 -11.856 1.00 0.00 N ATOM 1792 CA PRO A 125 9.179 4.770 -11.749 1.00 0.00 C ATOM 1793 C PRO A 125 8.643 4.803 -10.308 1.00 0.00 C ATOM 1794 O PRO A 125 9.186 4.168 -9.407 1.00 0.00 O ATOM 1795 CB PRO A 125 9.258 3.338 -12.288 1.00 0.00 C ATOM 1796 CG PRO A 125 10.674 2.924 -11.891 1.00 0.00 C ATOM 1797 CD PRO A 125 11.471 4.199 -12.109 1.00 0.00 C ATOM 0 HA PRO A 125 8.479 5.387 -12.313 1.00 0.00 H new ATOM 0 HB2 PRO A 125 8.504 2.692 -11.840 1.00 0.00 H new ATOM 0 HB3 PRO A 125 9.110 3.300 -13.367 1.00 0.00 H new ATOM 0 HG2 PRO A 125 10.722 2.589 -10.855 1.00 0.00 H new ATOM 0 HG3 PRO A 125 11.044 2.105 -12.508 1.00 0.00 H new ATOM 0 HD2 PRO A 125 12.326 4.247 -11.434 1.00 0.00 H new ATOM 0 HD3 PRO A 125 11.864 4.247 -13.125 1.00 0.00 H new ATOM 1805 N GLN A 126 7.606 5.606 -10.062 1.00 0.00 N ATOM 1806 CA GLN A 126 7.199 5.922 -8.704 1.00 0.00 C ATOM 1807 C GLN A 126 6.406 4.744 -8.162 1.00 0.00 C ATOM 1808 O GLN A 126 5.449 4.282 -8.786 1.00 0.00 O ATOM 1809 CB GLN A 126 6.371 7.208 -8.658 1.00 0.00 C ATOM 1810 CG GLN A 126 7.147 8.415 -9.203 1.00 0.00 C ATOM 1811 CD GLN A 126 6.335 9.697 -9.256 1.00 0.00 C ATOM 1812 OE1 GLN A 126 6.411 10.440 -10.228 1.00 0.00 O ATOM 1813 NE2 GLN A 126 5.612 10.014 -8.201 1.00 0.00 N ATOM 0 H GLN A 126 7.038 6.045 -10.787 1.00 0.00 H new ATOM 0 HA GLN A 126 8.081 6.093 -8.086 1.00 0.00 H new ATOM 0 HB2 GLN A 126 5.459 7.072 -9.239 1.00 0.00 H new ATOM 0 HB3 GLN A 126 6.068 7.407 -7.630 1.00 0.00 H new ATOM 0 HG2 GLN A 126 8.027 8.580 -8.581 1.00 0.00 H new ATOM 0 HG3 GLN A 126 7.505 8.182 -10.206 1.00 0.00 H new ATOM 0 HE21 GLN A 126 5.565 9.378 -7.405 1.00 0.00 H new ATOM 0 HE22 GLN A 126 5.099 10.895 -8.180 1.00 0.00 H new ATOM 1822 N GLN A 127 6.793 4.298 -6.976 1.00 0.00 N ATOM 1823 CA GLN A 127 6.189 3.192 -6.254 1.00 0.00 C ATOM 1824 C GLN A 127 6.233 3.508 -4.765 1.00 0.00 C ATOM 1825 O GLN A 127 7.003 4.361 -4.310 1.00 0.00 O ATOM 1826 CB GLN A 127 6.933 1.884 -6.587 1.00 0.00 C ATOM 1827 CG GLN A 127 6.287 1.146 -7.770 1.00 0.00 C ATOM 1828 CD GLN A 127 7.293 0.666 -8.799 1.00 0.00 C ATOM 1829 OE1 GLN A 127 7.541 1.334 -9.799 1.00 0.00 O ATOM 1830 NE2 GLN A 127 7.893 -0.492 -8.615 1.00 0.00 N ATOM 0 H GLN A 127 7.572 4.718 -6.469 1.00 0.00 H new ATOM 0 HA GLN A 127 5.149 3.057 -6.551 1.00 0.00 H new ATOM 0 HB2 GLN A 127 7.974 2.107 -6.822 1.00 0.00 H new ATOM 0 HB3 GLN A 127 6.936 1.235 -5.712 1.00 0.00 H new ATOM 0 HG2 GLN A 127 5.727 0.290 -7.393 1.00 0.00 H new ATOM 0 HG3 GLN A 127 5.570 1.808 -8.255 1.00 0.00 H new ATOM 0 HE21 GLN A 127 7.687 -1.047 -7.784 1.00 0.00 H new ATOM 0 HE22 GLN A 127 8.564 -0.834 -9.303 1.00 0.00 H new ATOM 1839 N MET A 128 5.386 2.826 -4.007 1.00 0.00 N ATOM 1840 CA MET A 128 5.244 3.006 -2.578 1.00 0.00 C ATOM 1841 C MET A 128 5.219 1.613 -1.969 1.00 0.00 C ATOM 1842 O MET A 128 4.429 0.767 -2.397 1.00 0.00 O ATOM 1843 CB MET A 128 3.987 3.836 -2.288 1.00 0.00 C ATOM 1844 CG MET A 128 3.937 4.197 -0.806 1.00 0.00 C ATOM 1845 SD MET A 128 2.630 5.330 -0.299 1.00 0.00 S ATOM 1846 CE MET A 128 1.198 4.370 -0.843 1.00 0.00 C ATOM 0 H MET A 128 4.763 2.113 -4.385 1.00 0.00 H new ATOM 0 HA MET A 128 6.068 3.564 -2.134 1.00 0.00 H new ATOM 0 HB2 MET A 128 3.991 4.743 -2.893 1.00 0.00 H new ATOM 0 HB3 MET A 128 3.096 3.272 -2.565 1.00 0.00 H new ATOM 0 HG2 MET A 128 3.831 3.275 -0.234 1.00 0.00 H new ATOM 0 HG3 MET A 128 4.896 4.636 -0.529 1.00 0.00 H new ATOM 0 HE1 MET A 128 0.289 4.805 -0.428 1.00 0.00 H new ATOM 0 HE2 MET A 128 1.143 4.384 -1.931 1.00 0.00 H new ATOM 0 HE3 MET A 128 1.298 3.341 -0.498 1.00 0.00 H new ATOM 1856 N GLN A 129 6.072 1.347 -0.983 1.00 0.00 N ATOM 1857 CA GLN A 129 6.237 0.030 -0.389 1.00 0.00 C ATOM 1858 C GLN A 129 5.996 0.136 1.109 1.00 0.00 C ATOM 1859 O GLN A 129 6.751 0.815 1.811 1.00 0.00 O ATOM 1860 CB GLN A 129 7.633 -0.505 -0.697 1.00 0.00 C ATOM 1861 CG GLN A 129 7.617 -2.028 -0.837 1.00 0.00 C ATOM 1862 CD GLN A 129 9.027 -2.614 -0.885 1.00 0.00 C ATOM 1863 OE1 GLN A 129 9.855 -2.369 -0.011 1.00 0.00 O ATOM 1864 NE2 GLN A 129 9.338 -3.398 -1.903 1.00 0.00 N ATOM 0 H GLN A 129 6.677 2.056 -0.569 1.00 0.00 H new ATOM 0 HA GLN A 129 5.516 -0.671 -0.809 1.00 0.00 H new ATOM 0 HB2 GLN A 129 8.004 -0.055 -1.618 1.00 0.00 H new ATOM 0 HB3 GLN A 129 8.321 -0.216 0.098 1.00 0.00 H new ATOM 0 HG2 GLN A 129 7.072 -2.463 0.001 1.00 0.00 H new ATOM 0 HG3 GLN A 129 7.079 -2.303 -1.744 1.00 0.00 H new ATOM 0 HE21 GLN A 129 8.645 -3.596 -2.624 1.00 0.00 H new ATOM 0 HE22 GLN A 129 10.271 -3.805 -1.967 1.00 0.00 H new ATOM 1873 N LEU A 130 4.895 -0.413 1.603 1.00 0.00 N ATOM 1874 CA LEU A 130 4.512 -0.296 3.011 1.00 0.00 C ATOM 1875 C LEU A 130 5.034 -1.511 3.756 1.00 0.00 C ATOM 1876 O LEU A 130 5.014 -2.616 3.213 1.00 0.00 O ATOM 1877 CB LEU A 130 2.984 -0.175 3.182 1.00 0.00 C ATOM 1878 CG LEU A 130 2.445 1.262 3.068 1.00 0.00 C ATOM 1879 CD1 LEU A 130 0.918 1.258 3.033 1.00 0.00 C ATOM 1880 CD2 LEU A 130 2.896 2.158 4.223 1.00 0.00 C ATOM 0 H LEU A 130 4.238 -0.954 1.041 1.00 0.00 H new ATOM 0 HA LEU A 130 4.949 0.615 3.420 1.00 0.00 H new ATOM 0 HB2 LEU A 130 2.496 -0.794 2.429 1.00 0.00 H new ATOM 0 HB3 LEU A 130 2.706 -0.578 4.156 1.00 0.00 H new ATOM 0 HG LEU A 130 2.853 1.665 2.141 1.00 0.00 H new ATOM 0 HD11 LEU A 130 0.553 2.282 2.952 1.00 0.00 H new ATOM 0 HD12 LEU A 130 0.575 0.682 2.174 1.00 0.00 H new ATOM 0 HD13 LEU A 130 0.534 0.807 3.948 1.00 0.00 H new ATOM 0 HD21 LEU A 130 2.485 3.159 4.089 1.00 0.00 H new ATOM 0 HD22 LEU A 130 2.540 1.743 5.166 1.00 0.00 H new ATOM 0 HD23 LEU A 130 3.985 2.211 4.238 1.00 0.00 H new ATOM 1892 N VAL A 131 5.469 -1.306 4.998 1.00 0.00 N ATOM 1893 CA VAL A 131 6.016 -2.339 5.863 1.00 0.00 C ATOM 1894 C VAL A 131 5.321 -2.199 7.207 1.00 0.00 C ATOM 1895 O VAL A 131 5.097 -1.081 7.680 1.00 0.00 O ATOM 1896 CB VAL A 131 7.550 -2.207 5.954 1.00 0.00 C ATOM 1897 CG1 VAL A 131 8.194 -3.102 7.026 1.00 0.00 C ATOM 1898 CG2 VAL A 131 8.223 -2.548 4.609 1.00 0.00 C ATOM 0 H VAL A 131 5.448 -0.387 5.440 1.00 0.00 H new ATOM 0 HA VAL A 131 5.835 -3.339 5.470 1.00 0.00 H new ATOM 0 HB VAL A 131 7.713 -1.165 6.228 1.00 0.00 H new ATOM 0 HG11 VAL A 131 9.273 -2.950 7.026 1.00 0.00 H new ATOM 0 HG12 VAL A 131 7.791 -2.844 8.005 1.00 0.00 H new ATOM 0 HG13 VAL A 131 7.974 -4.147 6.807 1.00 0.00 H new ATOM 0 HG21 VAL A 131 9.304 -2.445 4.707 1.00 0.00 H new ATOM 0 HG22 VAL A 131 7.980 -3.573 4.330 1.00 0.00 H new ATOM 0 HG23 VAL A 131 7.862 -1.867 3.838 1.00 0.00 H new ATOM 1908 N LEU A 132 4.920 -3.330 7.786 1.00 0.00 N ATOM 1909 CA LEU A 132 4.139 -3.328 9.011 1.00 0.00 C ATOM 1910 C LEU A 132 5.045 -3.493 10.220 1.00 0.00 C ATOM 1911 O LEU A 132 6.219 -3.851 10.104 1.00 0.00 O ATOM 1912 CB LEU A 132 3.047 -4.413 8.975 1.00 0.00 C ATOM 1913 CG LEU A 132 1.739 -3.962 8.298 1.00 0.00 C ATOM 1914 CD1 LEU A 132 1.907 -3.386 6.890 1.00 0.00 C ATOM 1915 CD2 LEU A 132 0.768 -5.143 8.242 1.00 0.00 C ATOM 0 H LEU A 132 5.127 -4.260 7.421 1.00 0.00 H new ATOM 0 HA LEU A 132 3.637 -2.364 9.095 1.00 0.00 H new ATOM 0 HB2 LEU A 132 3.434 -5.286 8.450 1.00 0.00 H new ATOM 0 HB3 LEU A 132 2.827 -4.727 9.995 1.00 0.00 H new ATOM 0 HG LEU A 132 1.355 -3.146 8.911 1.00 0.00 H new ATOM 0 HD11 LEU A 132 0.932 -3.097 6.496 1.00 0.00 H new ATOM 0 HD12 LEU A 132 2.556 -2.511 6.930 1.00 0.00 H new ATOM 0 HD13 LEU A 132 2.352 -4.139 6.240 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -0.160 -4.829 7.764 1.00 0.00 H new ATOM 0 HD22 LEU A 132 1.215 -5.955 7.669 1.00 0.00 H new ATOM 0 HD23 LEU A 132 0.556 -5.488 9.254 1.00 0.00 H new ATOM 1927 N ASP A 133 4.447 -3.322 11.393 1.00 0.00 N ATOM 1928 CA ASP A 133 5.035 -3.661 12.689 1.00 0.00 C ATOM 1929 C ASP A 133 5.531 -5.107 12.750 1.00 0.00 C ATOM 1930 O ASP A 133 6.489 -5.393 13.462 1.00 0.00 O ATOM 1931 CB ASP A 133 4.056 -3.391 13.846 1.00 0.00 C ATOM 1932 CG ASP A 133 2.909 -4.398 14.005 1.00 0.00 C ATOM 1933 OD1 ASP A 133 2.447 -5.007 13.016 1.00 0.00 O ATOM 1934 OD2 ASP A 133 2.377 -4.513 15.134 1.00 0.00 O ATOM 0 H ASP A 133 3.508 -2.931 11.474 1.00 0.00 H new ATOM 0 HA ASP A 133 5.901 -3.008 12.804 1.00 0.00 H new ATOM 0 HB2 ASP A 133 4.623 -3.366 14.777 1.00 0.00 H new ATOM 0 HB3 ASP A 133 3.626 -2.399 13.708 1.00 0.00 H new ATOM 1939 N ASN A 134 4.939 -6.013 11.973 1.00 0.00 N ATOM 1940 CA ASN A 134 5.340 -7.408 11.919 1.00 0.00 C ATOM 1941 C ASN A 134 6.395 -7.664 10.844 1.00 0.00 C ATOM 1942 O ASN A 134 7.046 -8.705 10.907 1.00 0.00 O ATOM 1943 CB ASN A 134 4.119 -8.311 11.705 1.00 0.00 C ATOM 1944 CG ASN A 134 3.305 -7.994 10.452 1.00 0.00 C ATOM 1945 OD1 ASN A 134 3.825 -7.827 9.356 1.00 0.00 O ATOM 1946 ND2 ASN A 134 1.997 -7.894 10.591 1.00 0.00 N ATOM 0 H ASN A 134 4.157 -5.790 11.357 1.00 0.00 H new ATOM 0 HA ASN A 134 5.795 -7.651 12.879 1.00 0.00 H new ATOM 0 HB2 ASN A 134 4.454 -9.347 11.652 1.00 0.00 H new ATOM 0 HB3 ASN A 134 3.468 -8.231 12.575 1.00 0.00 H new ATOM 0 HD21 ASN A 134 1.413 -7.677 9.783 1.00 0.00 H new ATOM 0 HD22 ASN A 134 1.569 -8.034 11.506 1.00 0.00 H new ATOM 1953 N GLY A 135 6.581 -6.745 9.890 1.00 0.00 N ATOM 1954 CA GLY A 135 7.582 -6.856 8.845 1.00 0.00 C ATOM 1955 C GLY A 135 7.048 -7.199 7.450 1.00 0.00 C ATOM 1956 O GLY A 135 7.871 -7.467 6.571 1.00 0.00 O ATOM 0 H GLY A 135 6.026 -5.891 9.829 1.00 0.00 H new ATOM 0 HA2 GLY A 135 8.125 -5.913 8.785 1.00 0.00 H new ATOM 0 HA3 GLY A 135 8.303 -7.620 9.137 1.00 0.00 H new ATOM 1960 N ASP A 136 5.723 -7.211 7.220 1.00 0.00 N ATOM 1961 CA ASP A 136 5.096 -7.401 5.894 1.00 0.00 C ATOM 1962 C ASP A 136 5.716 -6.453 4.855 1.00 0.00 C ATOM 1963 O ASP A 136 6.357 -5.467 5.209 1.00 0.00 O ATOM 1964 CB ASP A 136 3.576 -7.121 5.948 1.00 0.00 C ATOM 1965 CG ASP A 136 2.633 -8.307 6.171 1.00 0.00 C ATOM 1966 OD1 ASP A 136 3.051 -9.449 6.448 1.00 0.00 O ATOM 1967 OD2 ASP A 136 1.408 -8.093 5.996 1.00 0.00 O ATOM 0 H ASP A 136 5.040 -7.086 7.967 1.00 0.00 H new ATOM 0 HA ASP A 136 5.270 -8.438 5.608 1.00 0.00 H new ATOM 0 HB2 ASP A 136 3.398 -6.399 6.745 1.00 0.00 H new ATOM 0 HB3 ASP A 136 3.292 -6.640 5.012 1.00 0.00 H new ATOM 1972 N THR A 137 5.491 -6.679 3.558 1.00 0.00 N ATOM 1973 CA THR A 137 5.947 -5.773 2.506 1.00 0.00 C ATOM 1974 C THR A 137 4.887 -5.690 1.401 1.00 0.00 C ATOM 1975 O THR A 137 4.814 -6.557 0.527 1.00 0.00 O ATOM 1976 CB THR A 137 7.332 -6.201 1.989 1.00 0.00 C ATOM 1977 OG1 THR A 137 8.204 -6.556 3.043 1.00 0.00 O ATOM 1978 CG2 THR A 137 7.984 -5.072 1.196 1.00 0.00 C ATOM 0 H THR A 137 4.988 -7.495 3.210 1.00 0.00 H new ATOM 0 HA THR A 137 6.070 -4.767 2.907 1.00 0.00 H new ATOM 0 HB THR A 137 7.168 -7.070 1.352 1.00 0.00 H new ATOM 0 HG1 THR A 137 9.072 -6.823 2.674 1.00 0.00 H new ATOM 0 HG21 THR A 137 8.962 -5.395 0.840 1.00 0.00 H new ATOM 0 HG22 THR A 137 7.354 -4.815 0.344 1.00 0.00 H new ATOM 0 HG23 THR A 137 8.102 -4.198 1.837 1.00 0.00 H new ATOM 1986 N LEU A 138 4.017 -4.679 1.445 1.00 0.00 N ATOM 1987 CA LEU A 138 3.051 -4.412 0.379 1.00 0.00 C ATOM 1988 C LEU A 138 3.717 -3.527 -0.675 1.00 0.00 C ATOM 1989 O LEU A 138 4.487 -2.639 -0.315 1.00 0.00 O ATOM 1990 CB LEU A 138 1.804 -3.687 0.910 1.00 0.00 C ATOM 1991 CG LEU A 138 0.814 -4.541 1.725 1.00 0.00 C ATOM 1992 CD1 LEU A 138 1.288 -4.767 3.168 1.00 0.00 C ATOM 1993 CD2 LEU A 138 -0.551 -3.840 1.754 1.00 0.00 C ATOM 0 H LEU A 138 3.963 -4.021 2.223 1.00 0.00 H new ATOM 0 HA LEU A 138 2.738 -5.367 -0.044 1.00 0.00 H new ATOM 0 HB2 LEU A 138 2.131 -2.855 1.533 1.00 0.00 H new ATOM 0 HB3 LEU A 138 1.269 -3.259 0.062 1.00 0.00 H new ATOM 0 HG LEU A 138 0.744 -5.515 1.241 1.00 0.00 H new ATOM 0 HD11 LEU A 138 0.556 -5.374 3.701 1.00 0.00 H new ATOM 0 HD12 LEU A 138 2.249 -5.282 3.159 1.00 0.00 H new ATOM 0 HD13 LEU A 138 1.396 -3.806 3.670 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -1.256 -4.440 2.330 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -0.446 -2.859 2.217 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -0.921 -3.723 0.736 1.00 0.00 H new ATOM 2005 N THR A 139 3.363 -3.692 -1.948 1.00 0.00 N ATOM 2006 CA THR A 139 3.952 -2.980 -3.079 1.00 0.00 C ATOM 2007 C THR A 139 2.838 -2.300 -3.875 1.00 0.00 C ATOM 2008 O THR A 139 1.895 -2.966 -4.309 1.00 0.00 O ATOM 2009 CB THR A 139 4.727 -3.972 -3.962 1.00 0.00 C ATOM 2010 OG1 THR A 139 5.732 -4.648 -3.223 1.00 0.00 O ATOM 2011 CG2 THR A 139 5.395 -3.274 -5.147 1.00 0.00 C ATOM 0 H THR A 139 2.634 -4.347 -2.229 1.00 0.00 H new ATOM 0 HA THR A 139 4.647 -2.219 -2.724 1.00 0.00 H new ATOM 0 HB THR A 139 3.992 -4.689 -4.329 1.00 0.00 H new ATOM 0 HG1 THR A 139 6.206 -5.273 -3.811 1.00 0.00 H new ATOM 0 HG21 THR A 139 5.932 -4.009 -5.746 1.00 0.00 H new ATOM 0 HG22 THR A 139 4.635 -2.791 -5.761 1.00 0.00 H new ATOM 0 HG23 THR A 139 6.095 -2.524 -4.780 1.00 0.00 H new ATOM 2019 N PHE A 140 2.951 -0.987 -4.082 1.00 0.00 N ATOM 2020 CA PHE A 140 1.979 -0.183 -4.816 1.00 0.00 C ATOM 2021 C PHE A 140 2.663 0.533 -5.982 1.00 0.00 C ATOM 2022 O PHE A 140 3.714 1.152 -5.789 1.00 0.00 O ATOM 2023 CB PHE A 140 1.350 0.887 -3.912 1.00 0.00 C ATOM 2024 CG PHE A 140 0.480 0.456 -2.746 1.00 0.00 C ATOM 2025 CD1 PHE A 140 1.003 -0.341 -1.708 1.00 0.00 C ATOM 2026 CD2 PHE A 140 -0.827 0.971 -2.632 1.00 0.00 C ATOM 2027 CE1 PHE A 140 0.240 -0.603 -0.562 1.00 0.00 C ATOM 2028 CE2 PHE A 140 -1.600 0.685 -1.496 1.00 0.00 C ATOM 2029 CZ PHE A 140 -1.069 -0.119 -0.479 1.00 0.00 C ATOM 0 H PHE A 140 3.741 -0.443 -3.735 1.00 0.00 H new ATOM 0 HA PHE A 140 1.205 -0.859 -5.179 1.00 0.00 H new ATOM 0 HB2 PHE A 140 2.161 1.493 -3.509 1.00 0.00 H new ATOM 0 HB3 PHE A 140 0.749 1.539 -4.546 1.00 0.00 H new ATOM 0 HD1 PHE A 140 1.998 -0.752 -1.796 1.00 0.00 H new ATOM 0 HD2 PHE A 140 -1.234 1.587 -3.420 1.00 0.00 H new ATOM 0 HE1 PHE A 140 0.661 -1.175 0.252 1.00 0.00 H new ATOM 0 HE2 PHE A 140 -2.600 1.083 -1.406 1.00 0.00 H new ATOM 0 HZ PHE A 140 -1.677 -0.368 0.378 1.00 0.00 H new ATOM 2039 N ASP A 141 2.037 0.511 -7.158 1.00 0.00 N ATOM 2040 CA ASP A 141 2.416 1.311 -8.324 1.00 0.00 C ATOM 2041 C ASP A 141 1.834 2.715 -8.154 1.00 0.00 C ATOM 2042 O ASP A 141 0.731 2.853 -7.617 1.00 0.00 O ATOM 2043 CB ASP A 141 1.809 0.707 -9.603 1.00 0.00 C ATOM 2044 CG ASP A 141 2.633 -0.443 -10.179 1.00 0.00 C ATOM 2045 OD1 ASP A 141 3.823 -0.219 -10.502 1.00 0.00 O ATOM 2046 OD2 ASP A 141 2.076 -1.560 -10.305 1.00 0.00 O ATOM 0 H ASP A 141 1.226 -0.083 -7.332 1.00 0.00 H new ATOM 0 HA ASP A 141 3.503 1.333 -8.405 1.00 0.00 H new ATOM 0 HB2 ASP A 141 0.802 0.350 -9.385 1.00 0.00 H new ATOM 0 HB3 ASP A 141 1.714 1.489 -10.356 1.00 0.00 H new ATOM 2051 N ARG A 142 2.493 3.774 -8.646 1.00 0.00 N ATOM 2052 CA ARG A 142 1.840 5.080 -8.789 1.00 0.00 C ATOM 2053 C ARG A 142 0.920 5.043 -10.005 1.00 0.00 C ATOM 2054 O ARG A 142 1.377 5.308 -11.119 1.00 0.00 O ATOM 2055 CB ARG A 142 2.850 6.230 -8.943 1.00 0.00 C ATOM 2056 CG ARG A 142 2.132 7.599 -9.023 1.00 0.00 C ATOM 2057 CD ARG A 142 2.108 8.327 -7.672 1.00 0.00 C ATOM 2058 NE ARG A 142 1.854 9.771 -7.801 1.00 0.00 N ATOM 2059 CZ ARG A 142 0.701 10.454 -7.788 1.00 0.00 C ATOM 2060 NH1 ARG A 142 -0.484 9.844 -7.875 1.00 0.00 N ATOM 2061 NH2 ARG A 142 0.756 11.774 -7.669 1.00 0.00 N ATOM 0 H ARG A 142 3.467 3.752 -8.948 1.00 0.00 H new ATOM 0 HA ARG A 142 1.272 5.270 -7.878 1.00 0.00 H new ATOM 0 HB2 ARG A 142 3.540 6.227 -8.099 1.00 0.00 H new ATOM 0 HB3 ARG A 142 3.446 6.076 -9.842 1.00 0.00 H new ATOM 0 HG2 ARG A 142 2.632 8.226 -9.762 1.00 0.00 H new ATOM 0 HG3 ARG A 142 1.110 7.450 -9.371 1.00 0.00 H new ATOM 0 HD2 ARG A 142 1.338 7.883 -7.040 1.00 0.00 H new ATOM 0 HD3 ARG A 142 3.062 8.175 -7.167 1.00 0.00 H new ATOM 0 HE ARG A 142 2.690 10.344 -7.919 1.00 0.00 H new ATOM 0 HH11 ARG A 142 -0.530 8.828 -7.954 1.00 0.00 H new ATOM 0 HH12 ARG A 142 -1.343 10.394 -7.862 1.00 0.00 H new ATOM 0 HH21 ARG A 142 1.659 12.242 -7.591 1.00 0.00 H new ATOM 0 HH22 ARG A 142 -0.105 12.321 -7.656 1.00 0.00 H new ATOM 2075 N SER A 143 -0.380 4.868 -9.793 1.00 0.00 N ATOM 2076 CA SER A 143 -1.340 5.512 -10.669 1.00 0.00 C ATOM 2077 C SER A 143 -1.373 6.997 -10.268 1.00 0.00 C ATOM 2078 O SER A 143 -1.465 7.321 -9.073 1.00 0.00 O ATOM 2079 CB SER A 143 -2.688 4.791 -10.556 1.00 0.00 C ATOM 2080 OG SER A 143 -3.605 5.255 -11.529 1.00 0.00 O ATOM 0 H SER A 143 -0.781 4.303 -9.045 1.00 0.00 H new ATOM 0 HA SER A 143 -1.071 5.455 -11.724 1.00 0.00 H new ATOM 0 HB2 SER A 143 -2.540 3.718 -10.676 1.00 0.00 H new ATOM 0 HB3 SER A 143 -3.103 4.946 -9.560 1.00 0.00 H new ATOM 0 HG SER A 143 -4.454 4.776 -11.433 1.00 0.00 H new ATOM 2086 N THR A 144 -1.196 7.887 -11.247 1.00 0.00 N ATOM 2087 CA THR A 144 -1.309 9.340 -11.131 1.00 0.00 C ATOM 2088 C THR A 144 -2.181 9.963 -12.239 1.00 0.00 C ATOM 2089 O THR A 144 -2.077 11.170 -12.478 1.00 0.00 O ATOM 2090 CB THR A 144 0.116 9.928 -11.065 1.00 0.00 C ATOM 2091 OG1 THR A 144 0.118 11.298 -10.748 1.00 0.00 O ATOM 2092 CG2 THR A 144 0.961 9.701 -12.313 1.00 0.00 C ATOM 0 H THR A 144 -0.957 7.595 -12.195 1.00 0.00 H new ATOM 0 HA THR A 144 -1.838 9.594 -10.212 1.00 0.00 H new ATOM 0 HB THR A 144 0.583 9.364 -10.257 1.00 0.00 H new ATOM 0 HG1 THR A 144 -0.628 11.741 -11.205 1.00 0.00 H new ATOM 0 HG21 THR A 144 1.945 10.149 -12.173 1.00 0.00 H new ATOM 0 HG22 THR A 144 1.071 8.631 -12.488 1.00 0.00 H new ATOM 0 HG23 THR A 144 0.472 10.160 -13.172 1.00 0.00 H new ATOM 2100 N ARG A 145 -3.000 9.170 -12.939 1.00 0.00 N ATOM 2101 CA ARG A 145 -4.006 9.714 -13.854 1.00 0.00 C ATOM 2102 C ARG A 145 -5.107 10.413 -13.065 1.00 0.00 C ATOM 2103 O ARG A 145 -5.191 10.204 -11.834 1.00 0.00 O ATOM 2104 CB ARG A 145 -4.574 8.614 -14.766 1.00 0.00 C ATOM 2105 CG ARG A 145 -5.354 7.535 -14.002 1.00 0.00 C ATOM 2106 CD ARG A 145 -6.073 6.577 -14.953 1.00 0.00 C ATOM 2107 NE ARG A 145 -6.956 5.695 -14.184 1.00 0.00 N ATOM 2108 CZ ARG A 145 -6.748 4.435 -13.801 1.00 0.00 C ATOM 2109 NH1 ARG A 145 -5.749 3.694 -14.266 1.00 0.00 N ATOM 2110 NH2 ARG A 145 -7.575 3.917 -12.914 1.00 0.00 N ATOM 0 H ARG A 145 -2.985 8.151 -12.889 1.00 0.00 H new ATOM 0 HA ARG A 145 -3.530 10.452 -14.499 1.00 0.00 H new ATOM 0 HB2 ARG A 145 -5.230 9.070 -15.508 1.00 0.00 H new ATOM 0 HB3 ARG A 145 -3.755 8.144 -15.310 1.00 0.00 H new ATOM 0 HG2 ARG A 145 -4.670 6.972 -13.367 1.00 0.00 H new ATOM 0 HG3 ARG A 145 -6.082 8.009 -13.344 1.00 0.00 H new ATOM 0 HD2 ARG A 145 -6.652 7.141 -15.685 1.00 0.00 H new ATOM 0 HD3 ARG A 145 -5.346 5.986 -15.509 1.00 0.00 H new ATOM 0 HE ARG A 145 -7.850 6.100 -13.904 1.00 0.00 H new ATOM 0 HH11 ARG A 145 -5.099 4.085 -14.948 1.00 0.00 H new ATOM 0 HH12 ARG A 145 -5.632 2.734 -13.941 1.00 0.00 H new ATOM 0 HH21 ARG A 145 -8.343 4.477 -12.544 1.00 0.00 H new ATOM 0 HH22 ARG A 145 -7.447 2.956 -12.598 1.00 0.00 H new TER 2124 ARG A 145