USER MOD reduce.3.24.130724 H: found=0, std=0, add=929, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 930 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 34 TYR OH : rot -108:sc= 0.512 USER MOD Set 1.2: A 53 HIS : no HE2:sc= 0.465 K(o=0.98,f=-2.1!) USER MOD Set 2.1: A 33 GLN : amide:sc= -0.0483 K(o=-0.048,f=-0.81) USER MOD Set 2.2: A 35 TYR OH : rot 180:sc= 0 USER MOD Set 3.1: A 12 GLN : amide:sc= 0.548 K(o=1.6,f=0.72) USER MOD Set 3.2: A 97 CYS SG : rot -81:sc= 0.276 USER MOD Set 3.3: A 99 TYR OH : rot 111:sc= 0.81 USER MOD Set 4.1: A 10 GLN : amide:sc= 0.613 K(o=1.3,f=-1.8) USER MOD Set 4.2: A 11 LYS NZ :NH3+ -170:sc= 0.695 (180deg=0) USER MOD Single : A 2 ASN : amide:sc= 0 X(o=0,f=-0.28) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 16 TYR OH : rot 180:sc= -0.196 USER MOD Single : A 17 ASN : amide:sc= -1.1 K(o=-1.1,f=-0.02) USER MOD Single : A 25 MET CE :methyl 160:sc= -2.17! (180deg=-2.83!) USER MOD Single : A 32 CYS SG : rot -173:sc= 0.896 USER MOD Single : A 40 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 ASN : amide:sc= -1.07 K(o=-1.1,f=-4.6) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc=-0.00864 K(o=-0.0086,f=-1.9!) USER MOD Single : A 79 HIS : no HD1:sc= -3.28! C(o=-3.3!,f=-3.4!) USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= 0.304 K(o=0.3,f=-1.9!) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 ASN : amide:sc= -0.641 X(o=-0.64,f=-0.49) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 20 N ASN A 2 1.790 -2.557 -0.534 1.00 0.00 N ATOM 21 CA ASN A 2 1.818 -3.935 0.041 1.00 0.00 C ATOM 22 C ASN A 2 0.468 -4.680 -0.021 1.00 0.00 C ATOM 23 O ASN A 2 0.433 -5.895 0.204 1.00 0.00 O ATOM 24 CB ASN A 2 2.333 -3.938 1.503 1.00 0.00 C ATOM 25 CG ASN A 2 3.754 -3.404 1.666 1.00 0.00 C ATOM 26 OD1 ASN A 2 4.611 -3.584 0.797 1.00 0.00 O ATOM 27 ND2 ASN A 2 4.001 -2.716 2.769 1.00 0.00 N ATOM 0 HA ASN A 2 2.513 -4.477 -0.600 1.00 0.00 H new ATOM 0 HB2 ASN A 2 1.659 -3.339 2.115 1.00 0.00 H new ATOM 0 HB3 ASN A 2 2.293 -4.957 1.889 1.00 0.00 H new ATOM 0 HD21 ASN A 2 4.926 -2.314 2.923 1.00 0.00 H new ATOM 0 HD22 ASN A 2 3.267 -2.588 3.465 1.00 0.00 H new ATOM 34 N SER A 3 -0.621 -3.959 -0.320 1.00 0.00 N ATOM 35 CA SER A 3 -1.991 -4.500 -0.303 1.00 0.00 C ATOM 36 C SER A 3 -2.186 -5.557 -1.400 1.00 0.00 C ATOM 37 O SER A 3 -2.776 -6.595 -1.140 1.00 0.00 O ATOM 38 CB SER A 3 -3.017 -3.353 -0.457 1.00 0.00 C ATOM 39 OG SER A 3 -2.818 -2.356 0.538 1.00 0.00 O ATOM 0 H SER A 3 -0.578 -2.974 -0.583 1.00 0.00 H new ATOM 0 HA SER A 3 -2.154 -4.989 0.657 1.00 0.00 H new ATOM 0 HB2 SER A 3 -2.924 -2.907 -1.447 1.00 0.00 H new ATOM 0 HB3 SER A 3 -4.028 -3.752 -0.380 1.00 0.00 H new ATOM 0 HG SER A 3 -3.477 -1.640 0.420 1.00 0.00 H new ATOM 45 N GLU A 4 -1.627 -5.304 -2.602 1.00 0.00 N ATOM 46 CA GLU A 4 -1.699 -6.256 -3.747 1.00 0.00 C ATOM 47 C GLU A 4 -0.867 -7.536 -3.481 1.00 0.00 C ATOM 48 O GLU A 4 -0.994 -8.528 -4.207 1.00 0.00 O ATOM 49 CB GLU A 4 -1.245 -5.584 -5.083 1.00 0.00 C ATOM 50 CG GLU A 4 0.262 -5.237 -5.202 1.00 0.00 C ATOM 51 CD GLU A 4 0.675 -3.993 -4.402 1.00 0.00 C ATOM 52 OE1 GLU A 4 0.591 -2.869 -4.946 1.00 0.00 O ATOM 53 OE2 GLU A 4 1.056 -4.122 -3.225 1.00 0.00 O ATOM 0 H GLU A 4 -1.117 -4.446 -2.812 1.00 0.00 H new ATOM 0 HA GLU A 4 -2.745 -6.546 -3.848 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -1.509 -6.248 -5.906 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -1.819 -4.667 -5.216 1.00 0.00 H new ATOM 0 HG2 GLU A 4 0.850 -6.089 -4.861 1.00 0.00 H new ATOM 0 HG3 GLU A 4 0.508 -5.081 -6.252 1.00 0.00 H new ATOM 60 N ILE A 5 0.001 -7.481 -2.455 1.00 0.00 N ATOM 61 CA ILE A 5 0.811 -8.630 -2.001 1.00 0.00 C ATOM 62 C ILE A 5 0.095 -9.348 -0.834 1.00 0.00 C ATOM 63 O ILE A 5 0.225 -10.561 -0.649 1.00 0.00 O ATOM 64 CB ILE A 5 2.247 -8.165 -1.550 1.00 0.00 C ATOM 65 CG1 ILE A 5 2.877 -7.191 -2.596 1.00 0.00 C ATOM 66 CG2 ILE A 5 3.184 -9.370 -1.298 1.00 0.00 C ATOM 67 CD1 ILE A 5 3.040 -7.760 -3.995 1.00 0.00 C ATOM 0 H ILE A 5 0.163 -6.633 -1.912 1.00 0.00 H new ATOM 0 HA ILE A 5 0.925 -9.322 -2.835 1.00 0.00 H new ATOM 0 HB ILE A 5 2.131 -7.630 -0.608 1.00 0.00 H new ATOM 0 HG12 ILE A 5 2.257 -6.297 -2.655 1.00 0.00 H new ATOM 0 HG13 ILE A 5 3.856 -6.877 -2.233 1.00 0.00 H new ATOM 0 HG21 ILE A 5 4.165 -9.010 -0.989 1.00 0.00 H new ATOM 0 HG22 ILE A 5 2.764 -9.999 -0.513 1.00 0.00 H new ATOM 0 HG23 ILE A 5 3.284 -9.951 -2.215 1.00 0.00 H new ATOM 0 HD11 ILE A 5 3.485 -7.006 -4.645 1.00 0.00 H new ATOM 0 HD12 ILE A 5 3.688 -8.636 -3.958 1.00 0.00 H new ATOM 0 HD13 ILE A 5 2.064 -8.046 -4.387 1.00 0.00 H new ATOM 79 N GLU A 6 -0.680 -8.570 -0.067 1.00 0.00 N ATOM 80 CA GLU A 6 -1.472 -9.063 1.078 1.00 0.00 C ATOM 81 C GLU A 6 -2.835 -9.632 0.640 1.00 0.00 C ATOM 82 O GLU A 6 -3.441 -10.396 1.385 1.00 0.00 O ATOM 83 CB GLU A 6 -1.674 -7.911 2.105 1.00 0.00 C ATOM 84 CG GLU A 6 -0.439 -7.598 2.975 1.00 0.00 C ATOM 85 CD GLU A 6 -0.077 -8.745 3.947 1.00 0.00 C ATOM 86 OE1 GLU A 6 -0.977 -9.222 4.666 1.00 0.00 O ATOM 87 OE2 GLU A 6 1.106 -9.130 4.042 1.00 0.00 O ATOM 0 H GLU A 6 -0.779 -7.567 -0.223 1.00 0.00 H new ATOM 0 HA GLU A 6 -0.918 -9.879 1.541 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -1.960 -7.008 1.566 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -2.507 -8.168 2.760 1.00 0.00 H new ATOM 0 HG2 GLU A 6 0.414 -7.396 2.326 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -0.626 -6.690 3.548 1.00 0.00 H new ATOM 94 N LEU A 7 -3.322 -9.244 -0.555 1.00 0.00 N ATOM 95 CA LEU A 7 -4.630 -9.713 -1.081 1.00 0.00 C ATOM 96 C LEU A 7 -4.592 -11.231 -1.399 1.00 0.00 C ATOM 97 O LEU A 7 -5.514 -11.941 -0.979 1.00 0.00 O ATOM 98 CB LEU A 7 -5.106 -8.907 -2.334 1.00 0.00 C ATOM 99 CG LEU A 7 -5.606 -7.456 -2.088 1.00 0.00 C ATOM 100 CD1 LEU A 7 -5.949 -6.739 -3.418 1.00 0.00 C ATOM 101 CD2 LEU A 7 -6.793 -7.433 -1.098 1.00 0.00 C ATOM 0 H LEU A 7 -2.831 -8.605 -1.180 1.00 0.00 H new ATOM 0 HA LEU A 7 -5.358 -9.534 -0.290 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -4.280 -8.866 -3.044 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -5.910 -9.467 -2.812 1.00 0.00 H new ATOM 0 HG LEU A 7 -4.790 -6.899 -1.628 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -6.295 -5.727 -3.207 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -5.060 -6.695 -4.047 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -6.734 -7.290 -3.937 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -7.120 -6.404 -0.946 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -7.617 -8.020 -1.504 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -6.480 -7.858 -0.145 1.00 0.00 H new ATOM 113 N PRO A 8 -3.551 -11.766 -2.150 1.00 0.00 N ATOM 114 CA PRO A 8 -3.394 -13.221 -2.331 1.00 0.00 C ATOM 115 C PRO A 8 -3.347 -13.949 -0.980 1.00 0.00 C ATOM 116 O PRO A 8 -4.172 -14.810 -0.723 1.00 0.00 O ATOM 117 CB PRO A 8 -2.064 -13.379 -3.138 1.00 0.00 C ATOM 118 CG PRO A 8 -1.395 -12.046 -3.054 1.00 0.00 C ATOM 119 CD PRO A 8 -2.507 -11.034 -2.918 1.00 0.00 C ATOM 0 HA PRO A 8 -4.236 -13.668 -2.860 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -1.436 -14.162 -2.713 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -2.262 -13.656 -4.174 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -0.719 -12.001 -2.200 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -0.797 -11.852 -3.944 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -2.174 -10.140 -2.391 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -2.877 -10.711 -3.891 1.00 0.00 H new ATOM 127 N VAL A 9 -2.448 -13.489 -0.102 1.00 0.00 N ATOM 128 CA VAL A 9 -2.184 -14.100 1.219 1.00 0.00 C ATOM 129 C VAL A 9 -3.449 -14.169 2.113 1.00 0.00 C ATOM 130 O VAL A 9 -3.717 -15.199 2.745 1.00 0.00 O ATOM 131 CB VAL A 9 -1.045 -13.297 1.942 1.00 0.00 C ATOM 132 CG1 VAL A 9 -0.795 -13.795 3.389 1.00 0.00 C ATOM 133 CG2 VAL A 9 0.249 -13.349 1.096 1.00 0.00 C ATOM 0 H VAL A 9 -1.871 -12.669 -0.286 1.00 0.00 H new ATOM 0 HA VAL A 9 -1.869 -15.130 1.050 1.00 0.00 H new ATOM 0 HB VAL A 9 -1.371 -12.261 2.031 1.00 0.00 H new ATOM 0 HG11 VAL A 9 0.002 -13.207 3.844 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -1.708 -13.684 3.975 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -0.503 -14.845 3.367 1.00 0.00 H new ATOM 0 HG21 VAL A 9 1.037 -12.790 1.601 1.00 0.00 H new ATOM 0 HG22 VAL A 9 0.561 -14.386 0.972 1.00 0.00 H new ATOM 0 HG23 VAL A 9 0.062 -12.907 0.117 1.00 0.00 H new ATOM 143 N GLN A 10 -4.226 -13.074 2.125 1.00 0.00 N ATOM 144 CA GLN A 10 -5.429 -12.937 2.982 1.00 0.00 C ATOM 145 C GLN A 10 -6.498 -13.958 2.563 1.00 0.00 C ATOM 146 O GLN A 10 -6.935 -14.781 3.373 1.00 0.00 O ATOM 147 CB GLN A 10 -5.979 -11.470 2.918 1.00 0.00 C ATOM 148 CG GLN A 10 -6.954 -11.049 4.060 1.00 0.00 C ATOM 149 CD GLN A 10 -8.437 -11.367 3.814 1.00 0.00 C ATOM 150 OE1 GLN A 10 -9.170 -10.549 3.269 1.00 0.00 O ATOM 151 NE2 GLN A 10 -8.881 -12.556 4.198 1.00 0.00 N ATOM 0 H GLN A 10 -4.044 -12.256 1.544 1.00 0.00 H new ATOM 0 HA GLN A 10 -5.156 -13.144 4.017 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -5.131 -10.786 2.922 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -6.491 -11.337 1.965 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -6.642 -11.543 4.981 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -6.853 -9.976 4.224 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -8.247 -13.216 4.649 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -9.856 -12.811 4.042 1.00 0.00 H new ATOM 160 N LYS A 11 -6.860 -13.927 1.270 1.00 0.00 N ATOM 161 CA LYS A 11 -7.967 -14.739 0.722 1.00 0.00 C ATOM 162 C LYS A 11 -7.574 -16.230 0.654 1.00 0.00 C ATOM 163 O LYS A 11 -8.399 -17.110 0.883 1.00 0.00 O ATOM 164 CB LYS A 11 -8.370 -14.227 -0.687 1.00 0.00 C ATOM 165 CG LYS A 11 -8.617 -12.700 -0.783 1.00 0.00 C ATOM 166 CD LYS A 11 -9.696 -12.177 0.192 1.00 0.00 C ATOM 167 CE LYS A 11 -9.929 -10.661 0.054 1.00 0.00 C ATOM 168 NZ LYS A 11 -10.950 -10.163 1.008 1.00 0.00 N ATOM 0 H LYS A 11 -6.397 -13.342 0.575 1.00 0.00 H new ATOM 0 HA LYS A 11 -8.822 -14.639 1.390 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -7.586 -14.498 -1.394 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -9.275 -14.747 -1.001 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -7.681 -12.178 -0.587 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -8.913 -12.453 -1.803 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -10.633 -12.704 0.009 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -9.397 -12.404 1.215 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -8.990 -10.134 0.221 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -10.244 -10.435 -0.964 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -11.198 -9.182 0.770 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -11.800 -10.759 0.949 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -10.568 -10.199 1.975 1.00 0.00 H new ATOM 182 N GLN A 12 -6.293 -16.483 0.362 1.00 0.00 N ATOM 183 CA GLN A 12 -5.746 -17.843 0.178 1.00 0.00 C ATOM 184 C GLN A 12 -5.635 -18.581 1.530 1.00 0.00 C ATOM 185 O GLN A 12 -5.724 -19.813 1.580 1.00 0.00 O ATOM 186 CB GLN A 12 -4.363 -17.758 -0.504 1.00 0.00 C ATOM 187 CG GLN A 12 -3.778 -19.095 -1.022 1.00 0.00 C ATOM 188 CD GLN A 12 -2.350 -19.348 -0.553 1.00 0.00 C ATOM 189 OE1 GLN A 12 -1.396 -18.907 -1.181 1.00 0.00 O ATOM 190 NE2 GLN A 12 -2.204 -20.050 0.558 1.00 0.00 N ATOM 0 H GLN A 12 -5.597 -15.747 0.245 1.00 0.00 H new ATOM 0 HA GLN A 12 -6.426 -18.410 -0.458 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -4.436 -17.067 -1.344 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -3.657 -17.326 0.205 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -4.414 -19.915 -0.689 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -3.801 -19.096 -2.112 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -3.025 -20.400 1.052 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -1.270 -20.242 0.921 1.00 0.00 H new ATOM 199 N LEU A 13 -5.409 -17.805 2.613 1.00 0.00 N ATOM 200 CA LEU A 13 -5.405 -18.327 3.995 1.00 0.00 C ATOM 201 C LEU A 13 -6.788 -18.887 4.338 1.00 0.00 C ATOM 202 O LEU A 13 -6.915 -20.034 4.793 1.00 0.00 O ATOM 203 CB LEU A 13 -5.036 -17.209 5.011 1.00 0.00 C ATOM 204 CG LEU A 13 -5.065 -17.636 6.517 1.00 0.00 C ATOM 205 CD1 LEU A 13 -3.973 -18.674 6.845 1.00 0.00 C ATOM 206 CD2 LEU A 13 -5.034 -16.412 7.452 1.00 0.00 C ATOM 0 H LEU A 13 -5.225 -16.804 2.553 1.00 0.00 H new ATOM 0 HA LEU A 13 -4.657 -19.117 4.060 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -4.038 -16.841 4.774 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -5.724 -16.375 4.874 1.00 0.00 H new ATOM 0 HG LEU A 13 -6.016 -18.138 6.698 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -4.030 -18.941 7.900 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -4.124 -19.565 6.236 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -2.992 -18.250 6.631 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -5.055 -16.746 8.489 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -4.123 -15.841 7.273 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -5.902 -15.782 7.256 1.00 0.00 H new ATOM 218 N GLU A 14 -7.813 -18.040 4.106 1.00 0.00 N ATOM 219 CA GLU A 14 -9.235 -18.404 4.281 1.00 0.00 C ATOM 220 C GLU A 14 -9.553 -19.681 3.489 1.00 0.00 C ATOM 221 O GLU A 14 -10.153 -20.616 4.005 1.00 0.00 O ATOM 222 CB GLU A 14 -10.159 -17.249 3.802 1.00 0.00 C ATOM 223 CG GLU A 14 -9.818 -15.855 4.366 1.00 0.00 C ATOM 224 CD GLU A 14 -9.795 -15.791 5.905 1.00 0.00 C ATOM 225 OE1 GLU A 14 -10.888 -15.724 6.515 1.00 0.00 O ATOM 226 OE2 GLU A 14 -8.692 -15.780 6.504 1.00 0.00 O ATOM 0 H GLU A 14 -7.677 -17.080 3.790 1.00 0.00 H new ATOM 0 HA GLU A 14 -9.416 -18.581 5.341 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -10.120 -17.202 2.714 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -11.186 -17.491 4.074 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -8.844 -15.548 3.985 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -10.547 -15.135 3.993 1.00 0.00 H new ATOM 233 N ALA A 15 -9.073 -19.695 2.240 1.00 0.00 N ATOM 234 CA ALA A 15 -9.276 -20.789 1.284 1.00 0.00 C ATOM 235 C ALA A 15 -8.595 -22.102 1.739 1.00 0.00 C ATOM 236 O ALA A 15 -9.072 -23.195 1.421 1.00 0.00 O ATOM 237 CB ALA A 15 -8.742 -20.349 -0.083 1.00 0.00 C ATOM 0 H ALA A 15 -8.520 -18.928 1.857 1.00 0.00 H new ATOM 0 HA ALA A 15 -10.343 -21.001 1.222 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -8.886 -21.152 -0.806 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -9.280 -19.461 -0.415 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -7.679 -20.120 -0.002 1.00 0.00 H new ATOM 243 N TYR A 16 -7.477 -21.977 2.484 1.00 0.00 N ATOM 244 CA TYR A 16 -6.686 -23.134 2.955 1.00 0.00 C ATOM 245 C TYR A 16 -7.473 -23.933 4.022 1.00 0.00 C ATOM 246 O TYR A 16 -7.568 -25.165 3.944 1.00 0.00 O ATOM 247 CB TYR A 16 -5.320 -22.645 3.514 1.00 0.00 C ATOM 248 CG TYR A 16 -4.331 -23.762 3.911 1.00 0.00 C ATOM 249 CD1 TYR A 16 -3.806 -24.629 2.947 1.00 0.00 C ATOM 250 CD2 TYR A 16 -3.906 -23.935 5.236 1.00 0.00 C ATOM 251 CE1 TYR A 16 -2.906 -25.622 3.282 1.00 0.00 C ATOM 252 CE2 TYR A 16 -3.004 -24.933 5.577 1.00 0.00 C ATOM 253 CZ TYR A 16 -2.506 -25.772 4.594 1.00 0.00 C ATOM 254 OH TYR A 16 -1.603 -26.764 4.922 1.00 0.00 O ATOM 0 H TYR A 16 -7.098 -21.076 2.775 1.00 0.00 H new ATOM 0 HA TYR A 16 -6.496 -23.802 2.115 1.00 0.00 H new ATOM 0 HB2 TYR A 16 -4.845 -22.012 2.765 1.00 0.00 H new ATOM 0 HB3 TYR A 16 -5.506 -22.020 4.387 1.00 0.00 H new ATOM 0 HD1 TYR A 16 -4.111 -24.520 1.917 1.00 0.00 H new ATOM 0 HD2 TYR A 16 -4.288 -23.280 6.005 1.00 0.00 H new ATOM 0 HE1 TYR A 16 -2.516 -26.279 2.519 1.00 0.00 H new ATOM 0 HE2 TYR A 16 -2.692 -25.055 6.604 1.00 0.00 H new ATOM 0 HH TYR A 16 -1.423 -26.737 5.885 1.00 0.00 H new ATOM 264 N ASN A 17 -8.061 -23.206 4.995 1.00 0.00 N ATOM 265 CA ASN A 17 -8.814 -23.819 6.118 1.00 0.00 C ATOM 266 C ASN A 17 -10.277 -24.123 5.721 1.00 0.00 C ATOM 267 O ASN A 17 -10.911 -24.997 6.317 1.00 0.00 O ATOM 268 CB ASN A 17 -8.759 -22.921 7.391 1.00 0.00 C ATOM 269 CG ASN A 17 -9.421 -21.544 7.225 1.00 0.00 C ATOM 270 OD1 ASN A 17 -10.626 -21.397 7.414 1.00 0.00 O ATOM 271 ND2 ASN A 17 -8.633 -20.526 6.899 1.00 0.00 N ATOM 0 H ASN A 17 -8.030 -22.187 5.028 1.00 0.00 H new ATOM 0 HA ASN A 17 -8.331 -24.767 6.353 1.00 0.00 H new ATOM 0 HB2 ASN A 17 -9.244 -23.447 8.213 1.00 0.00 H new ATOM 0 HB3 ASN A 17 -7.716 -22.778 7.675 1.00 0.00 H new ATOM 0 HD21 ASN A 17 -9.025 -19.590 6.799 1.00 0.00 H new ATOM 0 HD22 ASN A 17 -7.636 -20.681 6.749 1.00 0.00 H new ATOM 278 N ALA A 18 -10.805 -23.396 4.716 1.00 0.00 N ATOM 279 CA ALA A 18 -12.203 -23.566 4.232 1.00 0.00 C ATOM 280 C ALA A 18 -12.287 -24.516 3.019 1.00 0.00 C ATOM 281 O ALA A 18 -13.375 -24.715 2.460 1.00 0.00 O ATOM 282 CB ALA A 18 -12.807 -22.197 3.888 1.00 0.00 C ATOM 0 H ALA A 18 -10.283 -22.677 4.215 1.00 0.00 H new ATOM 0 HA ALA A 18 -12.779 -24.024 5.036 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -13.830 -22.329 3.535 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -12.809 -21.566 4.777 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -12.212 -21.722 3.108 1.00 0.00 H new ATOM 288 N ARG A 19 -11.122 -25.072 2.614 1.00 0.00 N ATOM 289 CA ARG A 19 -10.995 -26.094 1.543 1.00 0.00 C ATOM 290 C ARG A 19 -11.316 -25.532 0.126 1.00 0.00 C ATOM 291 O ARG A 19 -11.485 -26.308 -0.829 1.00 0.00 O ATOM 292 CB ARG A 19 -11.852 -27.370 1.840 1.00 0.00 C ATOM 293 CG ARG A 19 -11.569 -28.074 3.193 1.00 0.00 C ATOM 294 CD ARG A 19 -10.094 -28.477 3.386 1.00 0.00 C ATOM 295 NE ARG A 19 -9.908 -29.309 4.590 1.00 0.00 N ATOM 296 CZ ARG A 19 -9.766 -28.851 5.846 1.00 0.00 C ATOM 297 NH1 ARG A 19 -9.691 -27.550 6.107 1.00 0.00 N ATOM 298 NH2 ARG A 19 -9.690 -29.718 6.847 1.00 0.00 N ATOM 0 H ARG A 19 -10.225 -24.820 3.029 1.00 0.00 H new ATOM 0 HA ARG A 19 -9.945 -26.386 1.542 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -12.906 -27.092 1.810 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -11.689 -28.089 1.037 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -11.864 -27.411 4.006 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -12.192 -28.965 3.266 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -9.749 -29.024 2.509 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -9.479 -27.580 3.465 1.00 0.00 H new ATOM 0 HE ARG A 19 -9.885 -30.320 4.458 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -9.741 -26.873 5.345 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -9.583 -27.228 7.069 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -9.739 -30.719 6.659 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -9.582 -29.383 7.804 1.00 0.00 H new ATOM 312 N ASP A 20 -11.353 -24.189 -0.013 1.00 0.00 N ATOM 313 CA ASP A 20 -11.621 -23.523 -1.306 1.00 0.00 C ATOM 314 C ASP A 20 -10.373 -23.555 -2.204 1.00 0.00 C ATOM 315 O ASP A 20 -9.474 -22.724 -2.070 1.00 0.00 O ATOM 316 CB ASP A 20 -12.115 -22.061 -1.099 1.00 0.00 C ATOM 317 CG ASP A 20 -13.538 -21.984 -0.524 1.00 0.00 C ATOM 318 OD1 ASP A 20 -14.512 -22.023 -1.311 1.00 0.00 O ATOM 319 OD2 ASP A 20 -13.693 -21.916 0.714 1.00 0.00 O ATOM 0 H ASP A 20 -11.200 -23.541 0.760 1.00 0.00 H new ATOM 0 HA ASP A 20 -12.418 -24.075 -1.805 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -11.429 -21.543 -0.428 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -12.086 -21.535 -2.053 1.00 0.00 H new ATOM 324 N ILE A 21 -10.329 -24.545 -3.106 1.00 0.00 N ATOM 325 CA ILE A 21 -9.270 -24.674 -4.123 1.00 0.00 C ATOM 326 C ILE A 21 -9.300 -23.488 -5.111 1.00 0.00 C ATOM 327 O ILE A 21 -8.244 -23.039 -5.563 1.00 0.00 O ATOM 328 CB ILE A 21 -9.386 -26.074 -4.872 1.00 0.00 C ATOM 329 CG1 ILE A 21 -8.725 -27.207 -4.018 1.00 0.00 C ATOM 330 CG2 ILE A 21 -8.810 -26.059 -6.315 1.00 0.00 C ATOM 331 CD1 ILE A 21 -7.214 -27.067 -3.844 1.00 0.00 C ATOM 0 H ILE A 21 -11.030 -25.284 -3.153 1.00 0.00 H new ATOM 0 HA ILE A 21 -8.303 -24.646 -3.621 1.00 0.00 H new ATOM 0 HB ILE A 21 -10.451 -26.277 -4.980 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -9.192 -27.222 -3.033 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -8.937 -28.168 -4.486 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -8.924 -27.046 -6.762 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -9.349 -25.325 -6.914 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -7.753 -25.795 -6.282 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -6.839 -27.893 -3.240 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -6.732 -27.084 -4.822 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -6.991 -26.123 -3.346 1.00 0.00 H new ATOM 343 N ASP A 22 -10.513 -22.969 -5.396 1.00 0.00 N ATOM 344 CA ASP A 22 -10.720 -21.895 -6.395 1.00 0.00 C ATOM 345 C ASP A 22 -9.901 -20.632 -6.052 1.00 0.00 C ATOM 346 O ASP A 22 -9.189 -20.106 -6.904 1.00 0.00 O ATOM 347 CB ASP A 22 -12.227 -21.541 -6.484 1.00 0.00 C ATOM 348 CG ASP A 22 -12.566 -20.521 -7.594 1.00 0.00 C ATOM 349 OD1 ASP A 22 -12.397 -19.298 -7.373 1.00 0.00 O ATOM 350 OD2 ASP A 22 -13.018 -20.933 -8.684 1.00 0.00 O ATOM 0 H ASP A 22 -11.373 -23.279 -4.944 1.00 0.00 H new ATOM 0 HA ASP A 22 -10.373 -22.265 -7.360 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -12.795 -22.455 -6.658 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -12.553 -21.141 -5.524 1.00 0.00 H new ATOM 355 N ALA A 23 -9.988 -20.185 -4.785 1.00 0.00 N ATOM 356 CA ALA A 23 -9.272 -18.983 -4.298 1.00 0.00 C ATOM 357 C ALA A 23 -7.801 -19.312 -3.992 1.00 0.00 C ATOM 358 O ALA A 23 -6.921 -18.454 -4.124 1.00 0.00 O ATOM 359 CB ALA A 23 -9.978 -18.388 -3.073 1.00 0.00 C ATOM 0 H ALA A 23 -10.553 -20.642 -4.070 1.00 0.00 H new ATOM 0 HA ALA A 23 -9.287 -18.231 -5.087 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -9.435 -17.506 -2.733 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -10.996 -18.106 -3.341 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -10.005 -19.128 -2.274 1.00 0.00 H new ATOM 365 N PHE A 24 -7.555 -20.575 -3.600 1.00 0.00 N ATOM 366 CA PHE A 24 -6.197 -21.091 -3.349 1.00 0.00 C ATOM 367 C PHE A 24 -5.396 -21.211 -4.679 1.00 0.00 C ATOM 368 O PHE A 24 -4.187 -21.414 -4.660 1.00 0.00 O ATOM 369 CB PHE A 24 -6.291 -22.462 -2.612 1.00 0.00 C ATOM 370 CG PHE A 24 -4.974 -22.948 -2.006 1.00 0.00 C ATOM 371 CD1 PHE A 24 -4.601 -22.572 -0.715 1.00 0.00 C ATOM 372 CD2 PHE A 24 -4.094 -23.749 -2.734 1.00 0.00 C ATOM 373 CE1 PHE A 24 -3.399 -22.983 -0.177 1.00 0.00 C ATOM 374 CE2 PHE A 24 -2.890 -24.148 -2.196 1.00 0.00 C ATOM 375 CZ PHE A 24 -2.541 -23.766 -0.919 1.00 0.00 C ATOM 0 H PHE A 24 -8.290 -21.266 -3.449 1.00 0.00 H new ATOM 0 HA PHE A 24 -5.657 -20.391 -2.712 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -7.034 -22.383 -1.819 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -6.652 -23.213 -3.314 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -5.262 -21.951 -0.129 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -4.360 -24.061 -3.733 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -3.130 -22.691 0.827 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -2.218 -24.762 -2.777 1.00 0.00 H new ATOM 0 HZ PHE A 24 -1.596 -24.080 -0.500 1.00 0.00 H new ATOM 385 N MET A 25 -6.096 -21.108 -5.828 1.00 0.00 N ATOM 386 CA MET A 25 -5.469 -21.103 -7.176 1.00 0.00 C ATOM 387 C MET A 25 -5.697 -19.773 -7.924 1.00 0.00 C ATOM 388 O MET A 25 -5.001 -19.491 -8.906 1.00 0.00 O ATOM 389 CB MET A 25 -6.024 -22.292 -8.010 1.00 0.00 C ATOM 390 CG MET A 25 -5.611 -23.699 -7.526 1.00 0.00 C ATOM 391 SD MET A 25 -4.026 -24.269 -8.197 1.00 0.00 S ATOM 392 CE MET A 25 -2.790 -23.275 -7.356 1.00 0.00 C ATOM 0 H MET A 25 -7.112 -21.026 -5.853 1.00 0.00 H new ATOM 0 HA MET A 25 -4.393 -21.212 -7.043 1.00 0.00 H new ATOM 0 HB2 MET A 25 -7.112 -22.234 -8.012 1.00 0.00 H new ATOM 0 HB3 MET A 25 -5.696 -22.172 -9.043 1.00 0.00 H new ATOM 0 HG2 MET A 25 -5.554 -23.696 -6.438 1.00 0.00 H new ATOM 0 HG3 MET A 25 -6.389 -24.411 -7.803 1.00 0.00 H new ATOM 0 HE1 MET A 25 -1.821 -23.769 -7.420 1.00 0.00 H new ATOM 0 HE2 MET A 25 -2.729 -22.294 -7.828 1.00 0.00 H new ATOM 0 HE3 MET A 25 -3.069 -23.157 -6.309 1.00 0.00 H new ATOM 402 N ALA A 26 -6.658 -18.957 -7.445 1.00 0.00 N ATOM 403 CA ALA A 26 -7.081 -17.702 -8.116 1.00 0.00 C ATOM 404 C ALA A 26 -5.943 -16.677 -8.204 1.00 0.00 C ATOM 405 O ALA A 26 -5.735 -16.038 -9.242 1.00 0.00 O ATOM 406 CB ALA A 26 -8.275 -17.079 -7.372 1.00 0.00 C ATOM 0 H ALA A 26 -7.166 -19.146 -6.581 1.00 0.00 H new ATOM 0 HA ALA A 26 -7.371 -17.966 -9.133 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -8.576 -16.159 -7.873 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -9.109 -17.781 -7.370 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -7.987 -16.855 -6.345 1.00 0.00 H new ATOM 412 N TRP A 27 -5.208 -16.549 -7.099 1.00 0.00 N ATOM 413 CA TRP A 27 -4.189 -15.509 -6.925 1.00 0.00 C ATOM 414 C TRP A 27 -2.794 -15.985 -7.338 1.00 0.00 C ATOM 415 O TRP A 27 -1.838 -15.230 -7.224 1.00 0.00 O ATOM 416 CB TRP A 27 -4.175 -15.082 -5.451 1.00 0.00 C ATOM 417 CG TRP A 27 -5.486 -14.519 -4.954 1.00 0.00 C ATOM 418 CD1 TRP A 27 -6.506 -15.201 -4.353 1.00 0.00 C ATOM 419 CD2 TRP A 27 -5.897 -13.144 -5.004 1.00 0.00 C ATOM 420 NE1 TRP A 27 -7.522 -14.342 -4.039 1.00 0.00 N ATOM 421 CE2 TRP A 27 -7.174 -13.073 -4.426 1.00 0.00 C ATOM 422 CE3 TRP A 27 -5.304 -11.969 -5.480 1.00 0.00 C ATOM 423 CZ2 TRP A 27 -7.869 -11.875 -4.312 1.00 0.00 C ATOM 424 CZ3 TRP A 27 -5.997 -10.781 -5.363 1.00 0.00 C ATOM 425 CH2 TRP A 27 -7.271 -10.742 -4.783 1.00 0.00 C ATOM 0 H TRP A 27 -5.302 -17.167 -6.293 1.00 0.00 H new ATOM 0 HA TRP A 27 -4.444 -14.670 -7.572 1.00 0.00 H new ATOM 0 HB2 TRP A 27 -3.907 -15.943 -4.838 1.00 0.00 H new ATOM 0 HB3 TRP A 27 -3.395 -14.334 -5.309 1.00 0.00 H new ATOM 0 HD1 TRP A 27 -6.509 -16.263 -4.155 1.00 0.00 H new ATOM 0 HE1 TRP A 27 -8.399 -14.603 -3.589 1.00 0.00 H new ATOM 0 HE3 TRP A 27 -4.323 -11.991 -5.930 1.00 0.00 H new ATOM 0 HZ2 TRP A 27 -8.851 -11.841 -3.865 1.00 0.00 H new ATOM 0 HZ3 TRP A 27 -5.550 -9.867 -5.725 1.00 0.00 H new ATOM 0 HH2 TRP A 27 -7.790 -9.798 -4.707 1.00 0.00 H new ATOM 436 N TRP A 28 -2.688 -17.232 -7.806 1.00 0.00 N ATOM 437 CA TRP A 28 -1.405 -17.853 -8.191 1.00 0.00 C ATOM 438 C TRP A 28 -1.195 -17.727 -9.704 1.00 0.00 C ATOM 439 O TRP A 28 -2.162 -17.698 -10.475 1.00 0.00 O ATOM 440 CB TRP A 28 -1.385 -19.347 -7.771 1.00 0.00 C ATOM 441 CG TRP A 28 -1.431 -19.582 -6.272 1.00 0.00 C ATOM 442 CD1 TRP A 28 -2.373 -19.120 -5.390 1.00 0.00 C ATOM 443 CD2 TRP A 28 -0.509 -20.360 -5.491 1.00 0.00 C ATOM 444 NE1 TRP A 28 -2.083 -19.559 -4.128 1.00 0.00 N ATOM 445 CE2 TRP A 28 -0.951 -20.321 -4.161 1.00 0.00 C ATOM 446 CE3 TRP A 28 0.646 -21.083 -5.785 1.00 0.00 C ATOM 447 CZ2 TRP A 28 -0.284 -20.978 -3.131 1.00 0.00 C ATOM 448 CZ3 TRP A 28 1.308 -21.735 -4.761 1.00 0.00 C ATOM 449 CH2 TRP A 28 0.840 -21.677 -3.445 1.00 0.00 C ATOM 0 H TRP A 28 -3.491 -17.848 -7.931 1.00 0.00 H new ATOM 0 HA TRP A 28 -0.595 -17.335 -7.678 1.00 0.00 H new ATOM 0 HB2 TRP A 28 -2.235 -19.852 -8.231 1.00 0.00 H new ATOM 0 HB3 TRP A 28 -0.484 -19.811 -8.171 1.00 0.00 H new ATOM 0 HD1 TRP A 28 -3.218 -18.501 -5.653 1.00 0.00 H new ATOM 0 HE1 TRP A 28 -2.628 -19.350 -3.292 1.00 0.00 H new ATOM 0 HE3 TRP A 28 1.018 -21.133 -6.798 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 -0.647 -20.934 -2.115 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 2.202 -22.299 -4.982 1.00 0.00 H new ATOM 0 HH2 TRP A 28 1.379 -22.195 -2.666 1.00 0.00 H new ATOM 460 N ALA A 29 0.080 -17.625 -10.110 1.00 0.00 N ATOM 461 CA ALA A 29 0.478 -17.663 -11.531 1.00 0.00 C ATOM 462 C ALA A 29 0.392 -19.108 -12.058 1.00 0.00 C ATOM 463 O ALA A 29 0.615 -20.055 -11.299 1.00 0.00 O ATOM 464 CB ALA A 29 1.900 -17.097 -11.708 1.00 0.00 C ATOM 0 H ALA A 29 0.864 -17.514 -9.467 1.00 0.00 H new ATOM 0 HA ALA A 29 -0.205 -17.040 -12.109 1.00 0.00 H new ATOM 0 HB1 ALA A 29 2.177 -17.133 -12.762 1.00 0.00 H new ATOM 0 HB2 ALA A 29 1.926 -16.064 -11.361 1.00 0.00 H new ATOM 0 HB3 ALA A 29 2.604 -17.693 -11.127 1.00 0.00 H new ATOM 470 N ASP A 30 0.094 -19.271 -13.364 1.00 0.00 N ATOM 471 CA ASP A 30 -0.106 -20.610 -13.975 1.00 0.00 C ATOM 472 C ASP A 30 1.210 -21.417 -14.029 1.00 0.00 C ATOM 473 O ASP A 30 1.189 -22.646 -14.119 1.00 0.00 O ATOM 474 CB ASP A 30 -0.726 -20.476 -15.392 1.00 0.00 C ATOM 475 CG ASP A 30 -1.152 -21.831 -16.005 1.00 0.00 C ATOM 476 OD1 ASP A 30 -2.223 -22.355 -15.622 1.00 0.00 O ATOM 477 OD2 ASP A 30 -0.419 -22.377 -16.863 1.00 0.00 O ATOM 0 H ASP A 30 -0.014 -18.496 -14.018 1.00 0.00 H new ATOM 0 HA ASP A 30 -0.801 -21.160 -13.341 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -1.595 -19.820 -15.340 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -0.004 -19.997 -16.053 1.00 0.00 H new ATOM 482 N ASP A 31 2.351 -20.709 -13.952 1.00 0.00 N ATOM 483 CA ASP A 31 3.701 -21.316 -13.982 1.00 0.00 C ATOM 484 C ASP A 31 4.354 -21.333 -12.581 1.00 0.00 C ATOM 485 O ASP A 31 5.576 -21.501 -12.478 1.00 0.00 O ATOM 486 CB ASP A 31 4.597 -20.532 -14.980 1.00 0.00 C ATOM 487 CG ASP A 31 4.082 -20.587 -16.428 1.00 0.00 C ATOM 488 OD1 ASP A 31 4.130 -21.676 -17.043 1.00 0.00 O ATOM 489 OD2 ASP A 31 3.617 -19.551 -16.953 1.00 0.00 O ATOM 0 H ASP A 31 2.366 -19.693 -13.867 1.00 0.00 H new ATOM 0 HA ASP A 31 3.601 -22.351 -14.308 1.00 0.00 H new ATOM 0 HB2 ASP A 31 4.659 -19.491 -14.662 1.00 0.00 H new ATOM 0 HB3 ASP A 31 5.609 -20.937 -14.945 1.00 0.00 H new ATOM 494 N CYS A 32 3.537 -21.189 -11.513 1.00 0.00 N ATOM 495 CA CYS A 32 4.047 -21.033 -10.128 1.00 0.00 C ATOM 496 C CYS A 32 4.843 -22.270 -9.649 1.00 0.00 C ATOM 497 O CYS A 32 4.360 -23.401 -9.726 1.00 0.00 O ATOM 498 CB CYS A 32 2.898 -20.725 -9.153 1.00 0.00 C ATOM 499 SG CYS A 32 3.439 -20.424 -7.450 1.00 0.00 S ATOM 0 H CYS A 32 2.519 -21.177 -11.582 1.00 0.00 H new ATOM 0 HA CYS A 32 4.737 -20.189 -10.140 1.00 0.00 H new ATOM 0 HB2 CYS A 32 2.356 -19.850 -9.511 1.00 0.00 H new ATOM 0 HB3 CYS A 32 2.197 -21.559 -9.159 1.00 0.00 H new ATOM 0 HG CYS A 32 2.399 -20.323 -6.676 1.00 0.00 H new ATOM 505 N GLN A 33 6.075 -22.027 -9.167 1.00 0.00 N ATOM 506 CA GLN A 33 7.008 -23.082 -8.727 1.00 0.00 C ATOM 507 C GLN A 33 6.908 -23.268 -7.204 1.00 0.00 C ATOM 508 O GLN A 33 7.394 -22.432 -6.430 1.00 0.00 O ATOM 509 CB GLN A 33 8.443 -22.694 -9.158 1.00 0.00 C ATOM 510 CG GLN A 33 8.631 -22.626 -10.693 1.00 0.00 C ATOM 511 CD GLN A 33 8.869 -23.989 -11.352 1.00 0.00 C ATOM 512 OE1 GLN A 33 9.475 -24.884 -10.764 1.00 0.00 O ATOM 513 NE2 GLN A 33 8.376 -24.165 -12.571 1.00 0.00 N ATOM 0 H GLN A 33 6.455 -21.085 -9.071 1.00 0.00 H new ATOM 0 HA GLN A 33 6.749 -24.033 -9.193 1.00 0.00 H new ATOM 0 HB2 GLN A 33 8.694 -21.725 -8.726 1.00 0.00 H new ATOM 0 HB3 GLN A 33 9.146 -23.418 -8.746 1.00 0.00 H new ATOM 0 HG2 GLN A 33 7.747 -22.168 -11.137 1.00 0.00 H new ATOM 0 HG3 GLN A 33 9.475 -21.973 -10.917 1.00 0.00 H new ATOM 0 HE21 GLN A 33 7.878 -23.405 -13.034 1.00 0.00 H new ATOM 0 HE22 GLN A 33 8.495 -25.060 -13.045 1.00 0.00 H new ATOM 522 N TYR A 34 6.244 -24.362 -6.802 1.00 0.00 N ATOM 523 CA TYR A 34 5.999 -24.716 -5.399 1.00 0.00 C ATOM 524 C TYR A 34 7.041 -25.748 -4.928 1.00 0.00 C ATOM 525 O TYR A 34 7.088 -26.880 -5.437 1.00 0.00 O ATOM 526 CB TYR A 34 4.558 -25.271 -5.221 1.00 0.00 C ATOM 527 CG TYR A 34 4.111 -25.416 -3.753 1.00 0.00 C ATOM 528 CD1 TYR A 34 3.660 -24.306 -3.033 1.00 0.00 C ATOM 529 CD2 TYR A 34 4.131 -26.649 -3.095 1.00 0.00 C ATOM 530 CE1 TYR A 34 3.249 -24.419 -1.718 1.00 0.00 C ATOM 531 CE2 TYR A 34 3.724 -26.764 -1.778 1.00 0.00 C ATOM 532 CZ TYR A 34 3.283 -25.648 -1.096 1.00 0.00 C ATOM 533 OH TYR A 34 2.849 -25.766 0.209 1.00 0.00 O ATOM 0 H TYR A 34 5.855 -25.039 -7.459 1.00 0.00 H new ATOM 0 HA TYR A 34 6.094 -23.819 -4.787 1.00 0.00 H new ATOM 0 HB2 TYR A 34 3.861 -24.611 -5.737 1.00 0.00 H new ATOM 0 HB3 TYR A 34 4.494 -26.245 -5.706 1.00 0.00 H new ATOM 0 HD1 TYR A 34 3.632 -23.340 -3.514 1.00 0.00 H new ATOM 0 HD2 TYR A 34 4.470 -27.527 -3.624 1.00 0.00 H new ATOM 0 HE1 TYR A 34 2.903 -23.548 -1.181 1.00 0.00 H new ATOM 0 HE2 TYR A 34 3.751 -27.724 -1.285 1.00 0.00 H new ATOM 0 HH TYR A 34 3.619 -25.907 0.798 1.00 0.00 H new ATOM 543 N TYR A 35 7.875 -25.333 -3.961 1.00 0.00 N ATOM 544 CA TYR A 35 8.906 -26.183 -3.344 1.00 0.00 C ATOM 545 C TYR A 35 8.598 -26.429 -1.857 1.00 0.00 C ATOM 546 O TYR A 35 7.914 -25.634 -1.200 1.00 0.00 O ATOM 547 CB TYR A 35 10.315 -25.536 -3.460 1.00 0.00 C ATOM 548 CG TYR A 35 10.863 -25.403 -4.889 1.00 0.00 C ATOM 549 CD1 TYR A 35 10.479 -24.350 -5.725 1.00 0.00 C ATOM 550 CD2 TYR A 35 11.770 -26.335 -5.401 1.00 0.00 C ATOM 551 CE1 TYR A 35 10.977 -24.238 -7.008 1.00 0.00 C ATOM 552 CE2 TYR A 35 12.266 -26.222 -6.683 1.00 0.00 C ATOM 553 CZ TYR A 35 11.870 -25.176 -7.483 1.00 0.00 C ATOM 554 OH TYR A 35 12.361 -25.081 -8.767 1.00 0.00 O ATOM 0 H TYR A 35 7.852 -24.387 -3.581 1.00 0.00 H new ATOM 0 HA TYR A 35 8.900 -27.131 -3.882 1.00 0.00 H new ATOM 0 HB2 TYR A 35 10.279 -24.544 -3.009 1.00 0.00 H new ATOM 0 HB3 TYR A 35 11.017 -26.128 -2.873 1.00 0.00 H new ATOM 0 HD1 TYR A 35 9.781 -23.611 -5.361 1.00 0.00 H new ATOM 0 HD2 TYR A 35 12.089 -27.160 -4.781 1.00 0.00 H new ATOM 0 HE1 TYR A 35 10.668 -23.417 -7.639 1.00 0.00 H new ATOM 0 HE2 TYR A 35 12.965 -26.955 -7.058 1.00 0.00 H new ATOM 0 HH TYR A 35 12.979 -25.823 -8.937 1.00 0.00 H new ATOM 564 N ALA A 36 9.122 -27.555 -1.363 1.00 0.00 N ATOM 565 CA ALA A 36 9.190 -27.881 0.063 1.00 0.00 C ATOM 566 C ALA A 36 10.646 -27.751 0.531 1.00 0.00 C ATOM 567 O ALA A 36 11.569 -27.856 -0.285 1.00 0.00 O ATOM 568 CB ALA A 36 8.670 -29.307 0.289 1.00 0.00 C ATOM 0 H ALA A 36 9.520 -28.281 -1.958 1.00 0.00 H new ATOM 0 HA ALA A 36 8.569 -27.195 0.638 1.00 0.00 H new ATOM 0 HB1 ALA A 36 8.721 -29.549 1.351 1.00 0.00 H new ATOM 0 HB2 ALA A 36 7.636 -29.375 -0.049 1.00 0.00 H new ATOM 0 HB3 ALA A 36 9.283 -30.011 -0.273 1.00 0.00 H new ATOM 574 N PHE A 37 10.835 -27.519 1.839 1.00 0.00 N ATOM 575 CA PHE A 37 12.174 -27.381 2.454 1.00 0.00 C ATOM 576 C PHE A 37 12.998 -28.693 2.296 1.00 0.00 C ATOM 577 O PHE A 37 12.458 -29.774 2.561 1.00 0.00 O ATOM 578 CB PHE A 37 12.014 -27.013 3.956 1.00 0.00 C ATOM 579 CG PHE A 37 13.323 -26.693 4.691 1.00 0.00 C ATOM 580 CD1 PHE A 37 13.995 -25.492 4.456 1.00 0.00 C ATOM 581 CD2 PHE A 37 13.883 -27.586 5.610 1.00 0.00 C ATOM 582 CE1 PHE A 37 15.175 -25.195 5.113 1.00 0.00 C ATOM 583 CE2 PHE A 37 15.064 -27.287 6.266 1.00 0.00 C ATOM 584 CZ PHE A 37 15.710 -26.092 6.015 1.00 0.00 C ATOM 0 H PHE A 37 10.068 -27.421 2.504 1.00 0.00 H new ATOM 0 HA PHE A 37 12.718 -26.586 1.943 1.00 0.00 H new ATOM 0 HB2 PHE A 37 11.351 -26.151 4.034 1.00 0.00 H new ATOM 0 HB3 PHE A 37 11.522 -27.841 4.466 1.00 0.00 H new ATOM 0 HD1 PHE A 37 13.587 -24.784 3.750 1.00 0.00 H new ATOM 0 HD2 PHE A 37 13.386 -28.524 5.811 1.00 0.00 H new ATOM 0 HE1 PHE A 37 15.679 -24.259 4.920 1.00 0.00 H new ATOM 0 HE2 PHE A 37 15.481 -27.988 6.974 1.00 0.00 H new ATOM 0 HZ PHE A 37 16.633 -25.860 6.525 1.00 0.00 H new ATOM 594 N PRO A 38 14.311 -28.643 1.865 1.00 0.00 N ATOM 595 CA PRO A 38 15.024 -27.407 1.440 1.00 0.00 C ATOM 596 C PRO A 38 14.671 -26.938 -0.001 1.00 0.00 C ATOM 597 O PRO A 38 14.418 -25.744 -0.216 1.00 0.00 O ATOM 598 CB PRO A 38 16.516 -27.807 1.569 1.00 0.00 C ATOM 599 CG PRO A 38 16.533 -29.284 1.299 1.00 0.00 C ATOM 600 CD PRO A 38 15.221 -29.824 1.839 1.00 0.00 C ATOM 0 HA PRO A 38 14.744 -26.548 2.049 1.00 0.00 H new ATOM 0 HB2 PRO A 38 17.136 -27.266 0.854 1.00 0.00 H new ATOM 0 HB3 PRO A 38 16.903 -27.580 2.562 1.00 0.00 H new ATOM 0 HG2 PRO A 38 16.627 -29.484 0.232 1.00 0.00 H new ATOM 0 HG3 PRO A 38 17.382 -29.760 1.789 1.00 0.00 H new ATOM 0 HD2 PRO A 38 14.826 -30.615 1.202 1.00 0.00 H new ATOM 0 HD3 PRO A 38 15.347 -30.249 2.835 1.00 0.00 H new ATOM 608 N ALA A 39 14.638 -27.877 -0.975 1.00 0.00 N ATOM 609 CA ALA A 39 14.356 -27.557 -2.390 1.00 0.00 C ATOM 610 C ALA A 39 13.870 -28.814 -3.135 1.00 0.00 C ATOM 611 O ALA A 39 14.575 -29.372 -3.981 1.00 0.00 O ATOM 612 CB ALA A 39 15.594 -26.928 -3.072 1.00 0.00 C ATOM 0 H ALA A 39 14.805 -28.868 -0.803 1.00 0.00 H new ATOM 0 HA ALA A 39 13.557 -26.816 -2.429 1.00 0.00 H new ATOM 0 HB1 ALA A 39 15.361 -26.702 -4.112 1.00 0.00 H new ATOM 0 HB2 ALA A 39 15.868 -26.009 -2.553 1.00 0.00 H new ATOM 0 HB3 ALA A 39 16.427 -27.629 -3.031 1.00 0.00 H new ATOM 618 N THR A 40 12.675 -29.286 -2.758 1.00 0.00 N ATOM 619 CA THR A 40 11.980 -30.386 -3.448 1.00 0.00 C ATOM 620 C THR A 40 10.819 -29.795 -4.254 1.00 0.00 C ATOM 621 O THR A 40 9.908 -29.220 -3.663 1.00 0.00 O ATOM 622 CB THR A 40 11.429 -31.435 -2.420 1.00 0.00 C ATOM 623 OG1 THR A 40 12.490 -31.877 -1.557 1.00 0.00 O ATOM 624 CG2 THR A 40 10.795 -32.661 -3.110 1.00 0.00 C ATOM 0 H THR A 40 12.158 -28.915 -1.961 1.00 0.00 H new ATOM 0 HA THR A 40 12.682 -30.897 -4.107 1.00 0.00 H new ATOM 0 HB THR A 40 10.649 -30.937 -1.843 1.00 0.00 H new ATOM 0 HG1 THR A 40 12.140 -32.530 -0.916 1.00 0.00 H new ATOM 0 HG21 THR A 40 10.430 -33.356 -2.354 1.00 0.00 H new ATOM 0 HG22 THR A 40 9.964 -32.337 -3.736 1.00 0.00 H new ATOM 0 HG23 THR A 40 11.543 -33.158 -3.728 1.00 0.00 H new ATOM 632 N LEU A 41 10.865 -29.906 -5.591 1.00 0.00 N ATOM 633 CA LEU A 41 9.790 -29.386 -6.447 1.00 0.00 C ATOM 634 C LEU A 41 8.570 -30.321 -6.369 1.00 0.00 C ATOM 635 O LEU A 41 8.582 -31.423 -6.929 1.00 0.00 O ATOM 636 CB LEU A 41 10.272 -29.207 -7.916 1.00 0.00 C ATOM 637 CG LEU A 41 9.254 -28.513 -8.880 1.00 0.00 C ATOM 638 CD1 LEU A 41 8.860 -27.106 -8.376 1.00 0.00 C ATOM 639 CD2 LEU A 41 9.793 -28.452 -10.330 1.00 0.00 C ATOM 0 H LEU A 41 11.631 -30.349 -6.099 1.00 0.00 H new ATOM 0 HA LEU A 41 9.500 -28.400 -6.085 1.00 0.00 H new ATOM 0 HB2 LEU A 41 11.194 -28.625 -7.909 1.00 0.00 H new ATOM 0 HB3 LEU A 41 10.518 -30.189 -8.321 1.00 0.00 H new ATOM 0 HG LEU A 41 8.353 -29.126 -8.887 1.00 0.00 H new ATOM 0 HD11 LEU A 41 8.152 -26.655 -9.071 1.00 0.00 H new ATOM 0 HD12 LEU A 41 8.400 -27.188 -7.391 1.00 0.00 H new ATOM 0 HD13 LEU A 41 9.750 -26.481 -8.309 1.00 0.00 H new ATOM 0 HD21 LEU A 41 9.059 -27.963 -10.971 1.00 0.00 H new ATOM 0 HD22 LEU A 41 10.724 -27.886 -10.348 1.00 0.00 H new ATOM 0 HD23 LEU A 41 9.976 -29.463 -10.693 1.00 0.00 H new ATOM 651 N LEU A 42 7.543 -29.882 -5.619 1.00 0.00 N ATOM 652 CA LEU A 42 6.261 -30.602 -5.493 1.00 0.00 C ATOM 653 C LEU A 42 5.413 -30.361 -6.745 1.00 0.00 C ATOM 654 O LEU A 42 4.705 -31.264 -7.213 1.00 0.00 O ATOM 655 CB LEU A 42 5.481 -30.146 -4.210 1.00 0.00 C ATOM 656 CG LEU A 42 5.835 -30.884 -2.879 1.00 0.00 C ATOM 657 CD1 LEU A 42 7.341 -30.849 -2.577 1.00 0.00 C ATOM 658 CD2 LEU A 42 5.009 -30.327 -1.692 1.00 0.00 C ATOM 0 H LEU A 42 7.578 -29.016 -5.082 1.00 0.00 H new ATOM 0 HA LEU A 42 6.468 -31.668 -5.396 1.00 0.00 H new ATOM 0 HB2 LEU A 42 5.656 -29.080 -4.066 1.00 0.00 H new ATOM 0 HB3 LEU A 42 4.414 -30.272 -4.397 1.00 0.00 H new ATOM 0 HG LEU A 42 5.565 -31.931 -3.015 1.00 0.00 H new ATOM 0 HD11 LEU A 42 7.537 -31.375 -1.642 1.00 0.00 H new ATOM 0 HD12 LEU A 42 7.886 -31.334 -3.387 1.00 0.00 H new ATOM 0 HD13 LEU A 42 7.670 -29.814 -2.487 1.00 0.00 H new ATOM 0 HD21 LEU A 42 5.277 -30.860 -0.780 1.00 0.00 H new ATOM 0 HD22 LEU A 42 5.221 -29.265 -1.567 1.00 0.00 H new ATOM 0 HD23 LEU A 42 3.946 -30.463 -1.893 1.00 0.00 H new ATOM 670 N ALA A 43 5.506 -29.132 -7.276 1.00 0.00 N ATOM 671 CA ALA A 43 4.704 -28.707 -8.431 1.00 0.00 C ATOM 672 C ALA A 43 5.356 -27.528 -9.161 1.00 0.00 C ATOM 673 O ALA A 43 5.574 -26.492 -8.557 1.00 0.00 O ATOM 674 CB ALA A 43 3.310 -28.337 -7.940 1.00 0.00 C ATOM 0 H ALA A 43 6.134 -28.411 -6.920 1.00 0.00 H new ATOM 0 HA ALA A 43 4.640 -29.526 -9.147 1.00 0.00 H new ATOM 0 HB1 ALA A 43 2.699 -28.018 -8.785 1.00 0.00 H new ATOM 0 HB2 ALA A 43 2.849 -29.204 -7.466 1.00 0.00 H new ATOM 0 HB3 ALA A 43 3.383 -27.524 -7.218 1.00 0.00 H new ATOM 680 N GLY A 44 5.644 -27.696 -10.465 1.00 0.00 N ATOM 681 CA GLY A 44 6.307 -26.652 -11.272 1.00 0.00 C ATOM 682 C GLY A 44 5.338 -25.787 -12.085 1.00 0.00 C ATOM 683 O GLY A 44 5.728 -25.198 -13.103 1.00 0.00 O ATOM 0 H GLY A 44 5.428 -28.547 -10.984 1.00 0.00 H new ATOM 0 HA2 GLY A 44 6.886 -26.008 -10.610 1.00 0.00 H new ATOM 0 HA3 GLY A 44 7.014 -27.127 -11.953 1.00 0.00 H new ATOM 687 N ASN A 45 4.093 -25.689 -11.593 1.00 0.00 N ATOM 688 CA ASN A 45 2.976 -24.962 -12.238 1.00 0.00 C ATOM 689 C ASN A 45 1.702 -25.103 -11.380 1.00 0.00 C ATOM 690 O ASN A 45 1.565 -26.080 -10.629 1.00 0.00 O ATOM 691 CB ASN A 45 2.692 -25.427 -13.703 1.00 0.00 C ATOM 692 CG ASN A 45 2.218 -26.873 -13.830 1.00 0.00 C ATOM 693 OD1 ASN A 45 1.029 -27.162 -13.697 1.00 0.00 O ATOM 694 ND2 ASN A 45 3.129 -27.785 -14.126 1.00 0.00 N ATOM 0 H ASN A 45 3.823 -26.124 -10.711 1.00 0.00 H new ATOM 0 HA ASN A 45 3.277 -23.916 -12.303 1.00 0.00 H new ATOM 0 HB2 ASN A 45 1.938 -24.772 -14.139 1.00 0.00 H new ATOM 0 HB3 ASN A 45 3.601 -25.303 -14.292 1.00 0.00 H new ATOM 0 HD21 ASN A 45 2.854 -28.759 -14.251 1.00 0.00 H new ATOM 0 HD22 ASN A 45 4.107 -27.514 -14.230 1.00 0.00 H new ATOM 701 N ALA A 46 0.766 -24.143 -11.545 1.00 0.00 N ATOM 702 CA ALA A 46 -0.455 -24.014 -10.709 1.00 0.00 C ATOM 703 C ALA A 46 -1.353 -25.266 -10.751 1.00 0.00 C ATOM 704 O ALA A 46 -1.965 -25.619 -9.739 1.00 0.00 O ATOM 705 CB ALA A 46 -1.254 -22.765 -11.119 1.00 0.00 C ATOM 0 H ALA A 46 0.834 -23.427 -12.268 1.00 0.00 H new ATOM 0 HA ALA A 46 -0.118 -23.909 -9.678 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -2.146 -22.684 -10.498 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -0.636 -21.877 -10.985 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -1.547 -22.848 -12.166 1.00 0.00 H new ATOM 711 N ALA A 47 -1.401 -25.948 -11.912 1.00 0.00 N ATOM 712 CA ALA A 47 -2.263 -27.137 -12.109 1.00 0.00 C ATOM 713 C ALA A 47 -1.877 -28.267 -11.144 1.00 0.00 C ATOM 714 O ALA A 47 -2.742 -28.897 -10.534 1.00 0.00 O ATOM 715 CB ALA A 47 -2.176 -27.639 -13.555 1.00 0.00 C ATOM 0 H ALA A 47 -0.851 -25.696 -12.733 1.00 0.00 H new ATOM 0 HA ALA A 47 -3.289 -26.836 -11.899 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -2.817 -28.512 -13.676 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -2.503 -26.852 -14.234 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -1.146 -27.911 -13.785 1.00 0.00 H new ATOM 721 N GLU A 48 -0.562 -28.499 -11.013 1.00 0.00 N ATOM 722 CA GLU A 48 -0.018 -29.557 -10.145 1.00 0.00 C ATOM 723 C GLU A 48 -0.096 -29.137 -8.658 1.00 0.00 C ATOM 724 O GLU A 48 -0.215 -29.993 -7.778 1.00 0.00 O ATOM 725 CB GLU A 48 1.441 -29.886 -10.540 1.00 0.00 C ATOM 726 CG GLU A 48 1.666 -30.144 -12.040 1.00 0.00 C ATOM 727 CD GLU A 48 3.121 -30.544 -12.361 1.00 0.00 C ATOM 728 OE1 GLU A 48 4.046 -29.775 -12.012 1.00 0.00 O ATOM 729 OE2 GLU A 48 3.350 -31.609 -12.977 1.00 0.00 O ATOM 0 H GLU A 48 0.153 -27.961 -11.503 1.00 0.00 H new ATOM 0 HA GLU A 48 -0.622 -30.454 -10.279 1.00 0.00 H new ATOM 0 HB2 GLU A 48 2.081 -29.060 -10.229 1.00 0.00 H new ATOM 0 HB3 GLU A 48 1.763 -30.766 -9.983 1.00 0.00 H new ATOM 0 HG2 GLU A 48 0.994 -30.934 -12.374 1.00 0.00 H new ATOM 0 HG3 GLU A 48 1.407 -29.247 -12.602 1.00 0.00 H new ATOM 736 N ILE A 49 -0.009 -27.807 -8.392 1.00 0.00 N ATOM 737 CA ILE A 49 -0.146 -27.240 -7.021 1.00 0.00 C ATOM 738 C ILE A 49 -1.557 -27.524 -6.488 1.00 0.00 C ATOM 739 O ILE A 49 -1.732 -27.887 -5.316 1.00 0.00 O ATOM 740 CB ILE A 49 0.123 -25.683 -6.991 1.00 0.00 C ATOM 741 CG1 ILE A 49 1.558 -25.370 -7.500 1.00 0.00 C ATOM 742 CG2 ILE A 49 -0.097 -25.084 -5.574 1.00 0.00 C ATOM 743 CD1 ILE A 49 1.895 -23.902 -7.641 1.00 0.00 C ATOM 0 H ILE A 49 0.156 -27.104 -9.112 1.00 0.00 H new ATOM 0 HA ILE A 49 0.603 -27.718 -6.390 1.00 0.00 H new ATOM 0 HB ILE A 49 -0.599 -25.213 -7.659 1.00 0.00 H new ATOM 0 HG12 ILE A 49 2.274 -25.825 -6.816 1.00 0.00 H new ATOM 0 HG13 ILE A 49 1.693 -25.850 -8.469 1.00 0.00 H new ATOM 0 HG21 ILE A 49 0.098 -24.012 -5.598 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -1.126 -25.258 -5.261 1.00 0.00 H new ATOM 0 HG23 ILE A 49 0.583 -25.561 -4.868 1.00 0.00 H new ATOM 0 HD11 ILE A 49 2.918 -23.797 -8.002 1.00 0.00 H new ATOM 0 HD12 ILE A 49 1.210 -23.438 -8.351 1.00 0.00 H new ATOM 0 HD13 ILE A 49 1.800 -23.412 -6.672 1.00 0.00 H new ATOM 755 N ARG A 50 -2.543 -27.373 -7.390 1.00 0.00 N ATOM 756 CA ARG A 50 -3.951 -27.678 -7.119 1.00 0.00 C ATOM 757 C ARG A 50 -4.101 -29.124 -6.636 1.00 0.00 C ATOM 758 O ARG A 50 -4.568 -29.353 -5.534 1.00 0.00 O ATOM 759 CB ARG A 50 -4.787 -27.481 -8.409 1.00 0.00 C ATOM 760 CG ARG A 50 -6.277 -27.848 -8.273 1.00 0.00 C ATOM 761 CD ARG A 50 -7.022 -27.779 -9.611 1.00 0.00 C ATOM 762 NE ARG A 50 -8.480 -27.966 -9.451 1.00 0.00 N ATOM 763 CZ ARG A 50 -9.417 -27.414 -10.238 1.00 0.00 C ATOM 764 NH1 ARG A 50 -9.079 -26.613 -11.242 1.00 0.00 N ATOM 765 NH2 ARG A 50 -10.697 -27.657 -10.003 1.00 0.00 N ATOM 0 H ARG A 50 -2.378 -27.032 -8.337 1.00 0.00 H new ATOM 0 HA ARG A 50 -4.309 -27.003 -6.341 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -4.710 -26.439 -8.720 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -4.350 -28.084 -9.205 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -6.364 -28.854 -7.864 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -6.751 -27.172 -7.561 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -6.831 -26.814 -10.081 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -6.631 -28.544 -10.282 1.00 0.00 H new ATOM 0 HE ARG A 50 -8.798 -28.559 -8.685 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -8.096 -26.410 -11.424 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -9.802 -26.201 -11.831 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -10.967 -28.261 -9.227 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -11.413 -27.240 -10.598 1.00 0.00 H new ATOM 779 N VAL A 51 -3.605 -30.061 -7.462 1.00 0.00 N ATOM 780 CA VAL A 51 -3.757 -31.519 -7.257 1.00 0.00 C ATOM 781 C VAL A 51 -3.061 -31.975 -5.957 1.00 0.00 C ATOM 782 O VAL A 51 -3.634 -32.723 -5.160 1.00 0.00 O ATOM 783 CB VAL A 51 -3.191 -32.308 -8.499 1.00 0.00 C ATOM 784 CG1 VAL A 51 -3.313 -33.842 -8.319 1.00 0.00 C ATOM 785 CG2 VAL A 51 -3.889 -31.847 -9.809 1.00 0.00 C ATOM 0 H VAL A 51 -3.079 -29.828 -8.304 1.00 0.00 H new ATOM 0 HA VAL A 51 -4.820 -31.739 -7.159 1.00 0.00 H new ATOM 0 HB VAL A 51 -2.128 -32.077 -8.572 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -2.911 -34.345 -9.199 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -2.752 -34.151 -7.437 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -4.362 -34.112 -8.195 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -3.483 -32.404 -10.653 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -4.961 -32.031 -9.734 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -3.713 -30.782 -9.959 1.00 0.00 H new ATOM 795 N ARG A 52 -1.841 -31.454 -5.751 1.00 0.00 N ATOM 796 CA ARG A 52 -1.002 -31.756 -4.574 1.00 0.00 C ATOM 797 C ARG A 52 -1.710 -31.331 -3.272 1.00 0.00 C ATOM 798 O ARG A 52 -1.684 -32.050 -2.264 1.00 0.00 O ATOM 799 CB ARG A 52 0.370 -31.032 -4.712 1.00 0.00 C ATOM 800 CG ARG A 52 1.444 -31.426 -3.668 1.00 0.00 C ATOM 801 CD ARG A 52 2.208 -32.727 -4.024 1.00 0.00 C ATOM 802 NE ARG A 52 1.384 -33.960 -3.963 1.00 0.00 N ATOM 803 CZ ARG A 52 1.783 -35.130 -3.435 1.00 0.00 C ATOM 804 NH1 ARG A 52 2.964 -35.251 -2.842 1.00 0.00 N ATOM 805 NH2 ARG A 52 0.988 -36.181 -3.513 1.00 0.00 N ATOM 0 H ARG A 52 -1.402 -30.804 -6.403 1.00 0.00 H new ATOM 0 HA ARG A 52 -0.835 -32.832 -4.527 1.00 0.00 H new ATOM 0 HB2 ARG A 52 0.767 -31.231 -5.707 1.00 0.00 H new ATOM 0 HB3 ARG A 52 0.201 -29.957 -4.645 1.00 0.00 H new ATOM 0 HG2 ARG A 52 2.160 -30.610 -3.570 1.00 0.00 H new ATOM 0 HG3 ARG A 52 0.966 -31.550 -2.696 1.00 0.00 H new ATOM 0 HD2 ARG A 52 2.619 -32.629 -5.029 1.00 0.00 H new ATOM 0 HD3 ARG A 52 3.053 -32.835 -3.344 1.00 0.00 H new ATOM 0 HE ARG A 52 0.442 -33.916 -4.352 1.00 0.00 H new ATOM 0 HH11 ARG A 52 3.588 -34.447 -2.780 1.00 0.00 H new ATOM 0 HH12 ARG A 52 3.247 -36.148 -2.448 1.00 0.00 H new ATOM 0 HH21 ARG A 52 0.080 -36.101 -3.971 1.00 0.00 H new ATOM 0 HH22 ARG A 52 1.282 -37.073 -3.115 1.00 0.00 H new ATOM 819 N HIS A 53 -2.330 -30.139 -3.313 1.00 0.00 N ATOM 820 CA HIS A 53 -3.064 -29.570 -2.175 1.00 0.00 C ATOM 821 C HIS A 53 -4.457 -30.183 -2.016 1.00 0.00 C ATOM 822 O HIS A 53 -4.964 -30.186 -0.916 1.00 0.00 O ATOM 823 CB HIS A 53 -3.125 -28.028 -2.242 1.00 0.00 C ATOM 824 CG HIS A 53 -1.825 -27.374 -1.850 1.00 0.00 C ATOM 825 ND1 HIS A 53 -0.937 -26.851 -2.757 1.00 0.00 N ATOM 826 CD2 HIS A 53 -1.273 -27.165 -0.627 1.00 0.00 C ATOM 827 CE1 HIS A 53 0.098 -26.348 -2.123 1.00 0.00 C ATOM 828 NE2 HIS A 53 -0.076 -26.523 -0.826 1.00 0.00 N ATOM 0 H HIS A 53 -2.335 -29.543 -4.141 1.00 0.00 H new ATOM 0 HA HIS A 53 -2.500 -29.833 -1.280 1.00 0.00 H new ATOM 0 HB2 HIS A 53 -3.389 -27.723 -3.255 1.00 0.00 H new ATOM 0 HB3 HIS A 53 -3.918 -27.672 -1.585 1.00 0.00 H new ATOM 0 HD1 HIS A 53 -1.062 -26.853 -3.769 1.00 0.00 H new ATOM 0 HD2 HIS A 53 -1.697 -27.451 0.325 1.00 0.00 H new ATOM 0 HE1 HIS A 53 0.949 -25.871 -2.586 1.00 0.00 H new ATOM 837 N ILE A 54 -5.082 -30.685 -3.103 1.00 0.00 N ATOM 838 CA ILE A 54 -6.362 -31.425 -3.010 1.00 0.00 C ATOM 839 C ILE A 54 -6.177 -32.628 -2.069 1.00 0.00 C ATOM 840 O ILE A 54 -6.995 -32.862 -1.183 1.00 0.00 O ATOM 841 CB ILE A 54 -6.871 -31.892 -4.432 1.00 0.00 C ATOM 842 CG1 ILE A 54 -7.391 -30.672 -5.254 1.00 0.00 C ATOM 843 CG2 ILE A 54 -7.956 -32.996 -4.348 1.00 0.00 C ATOM 844 CD1 ILE A 54 -7.741 -30.981 -6.697 1.00 0.00 C ATOM 0 H ILE A 54 -4.723 -30.592 -4.053 1.00 0.00 H new ATOM 0 HA ILE A 54 -7.125 -30.759 -2.606 1.00 0.00 H new ATOM 0 HB ILE A 54 -6.016 -32.331 -4.945 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -8.274 -30.268 -4.759 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -6.631 -29.891 -5.238 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -8.268 -33.277 -5.354 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -7.549 -33.868 -3.837 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -8.816 -32.620 -3.794 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -8.093 -30.074 -7.188 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -6.857 -31.354 -7.214 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -8.525 -31.737 -6.727 1.00 0.00 H new ATOM 856 N GLU A 55 -5.042 -33.318 -2.240 1.00 0.00 N ATOM 857 CA GLU A 55 -4.638 -34.468 -1.405 1.00 0.00 C ATOM 858 C GLU A 55 -4.443 -34.051 0.073 1.00 0.00 C ATOM 859 O GLU A 55 -4.750 -34.816 0.996 1.00 0.00 O ATOM 860 CB GLU A 55 -3.346 -35.082 -1.996 1.00 0.00 C ATOM 861 CG GLU A 55 -3.492 -35.503 -3.473 1.00 0.00 C ATOM 862 CD GLU A 55 -2.179 -35.975 -4.105 1.00 0.00 C ATOM 863 OE1 GLU A 55 -1.784 -37.135 -3.864 1.00 0.00 O ATOM 864 OE2 GLU A 55 -1.520 -35.188 -4.828 1.00 0.00 O ATOM 0 H GLU A 55 -4.366 -33.094 -2.971 1.00 0.00 H new ATOM 0 HA GLU A 55 -5.429 -35.218 -1.414 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -2.535 -34.358 -1.910 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -3.061 -35.952 -1.404 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -4.229 -36.303 -3.544 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -3.880 -34.661 -4.046 1.00 0.00 H new ATOM 871 N ARG A 56 -3.951 -32.819 0.273 1.00 0.00 N ATOM 872 CA ARG A 56 -3.792 -32.213 1.613 1.00 0.00 C ATOM 873 C ARG A 56 -5.154 -31.704 2.160 1.00 0.00 C ATOM 874 O ARG A 56 -5.343 -31.620 3.369 1.00 0.00 O ATOM 875 CB ARG A 56 -2.725 -31.078 1.543 1.00 0.00 C ATOM 876 CG ARG A 56 -2.402 -30.335 2.874 1.00 0.00 C ATOM 877 CD ARG A 56 -2.140 -31.275 4.078 1.00 0.00 C ATOM 878 NE ARG A 56 -1.162 -32.346 3.793 1.00 0.00 N ATOM 879 CZ ARG A 56 -1.071 -33.507 4.473 1.00 0.00 C ATOM 880 NH1 ARG A 56 -1.861 -33.751 5.516 1.00 0.00 N ATOM 881 NH2 ARG A 56 -0.184 -34.421 4.100 1.00 0.00 N ATOM 0 H ARG A 56 -3.650 -32.210 -0.488 1.00 0.00 H new ATOM 0 HA ARG A 56 -3.441 -32.970 2.314 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -1.799 -31.506 1.159 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -3.061 -30.340 0.815 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -1.526 -29.705 2.722 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -3.233 -29.673 3.118 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -1.781 -30.682 4.919 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -3.082 -31.728 4.386 1.00 0.00 H new ATOM 0 HE ARG A 56 -0.508 -32.196 3.025 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -2.546 -33.055 5.810 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -1.781 -34.634 6.021 1.00 0.00 H new ATOM 0 HH21 ARG A 56 0.426 -34.244 3.302 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -0.112 -35.300 4.612 1.00 0.00 H new ATOM 895 N PHE A 57 -6.098 -31.389 1.260 1.00 0.00 N ATOM 896 CA PHE A 57 -7.458 -30.925 1.632 1.00 0.00 C ATOM 897 C PHE A 57 -8.383 -32.133 1.920 1.00 0.00 C ATOM 898 O PHE A 57 -9.467 -31.968 2.498 1.00 0.00 O ATOM 899 CB PHE A 57 -8.047 -30.001 0.512 1.00 0.00 C ATOM 900 CG PHE A 57 -7.461 -28.574 0.428 1.00 0.00 C ATOM 901 CD1 PHE A 57 -6.222 -28.245 0.989 1.00 0.00 C ATOM 902 CD2 PHE A 57 -8.164 -27.554 -0.212 1.00 0.00 C ATOM 903 CE1 PHE A 57 -5.714 -26.963 0.909 1.00 0.00 C ATOM 904 CE2 PHE A 57 -7.654 -26.265 -0.289 1.00 0.00 C ATOM 905 CZ PHE A 57 -6.431 -25.972 0.272 1.00 0.00 C ATOM 0 H PHE A 57 -5.948 -31.446 0.253 1.00 0.00 H new ATOM 0 HA PHE A 57 -7.391 -30.335 2.546 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -7.897 -30.490 -0.450 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -9.123 -29.921 0.664 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -5.651 -29.009 1.495 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -9.124 -27.771 -0.657 1.00 0.00 H new ATOM 0 HE1 PHE A 57 -4.753 -26.736 1.346 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -8.217 -25.491 -0.789 1.00 0.00 H new ATOM 0 HZ PHE A 57 -6.035 -24.969 0.213 1.00 0.00 H new ATOM 915 N LYS A 58 -7.936 -33.350 1.511 1.00 0.00 N ATOM 916 CA LYS A 58 -8.601 -34.624 1.875 1.00 0.00 C ATOM 917 C LYS A 58 -8.425 -34.918 3.386 1.00 0.00 C ATOM 918 O LYS A 58 -9.192 -35.701 3.965 1.00 0.00 O ATOM 919 CB LYS A 58 -8.051 -35.817 1.044 1.00 0.00 C ATOM 920 CG LYS A 58 -8.186 -35.718 -0.504 1.00 0.00 C ATOM 921 CD LYS A 58 -9.637 -35.485 -1.034 1.00 0.00 C ATOM 922 CE LYS A 58 -9.993 -33.996 -1.261 1.00 0.00 C ATOM 923 NZ LYS A 58 -11.383 -33.821 -1.738 1.00 0.00 N ATOM 0 H LYS A 58 -7.111 -33.472 0.924 1.00 0.00 H new ATOM 0 HA LYS A 58 -9.661 -34.511 1.649 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -6.995 -35.941 1.285 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -8.561 -36.723 1.372 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -7.553 -34.903 -0.856 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -7.799 -36.636 -0.945 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -9.761 -36.025 -1.973 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -10.345 -35.913 -0.324 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -9.858 -33.446 -0.330 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -9.304 -33.566 -1.988 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -11.578 -32.809 -1.876 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -11.506 -34.324 -2.640 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -12.043 -34.207 -1.033 1.00 0.00 H new ATOM 937 N GLU A 59 -7.398 -34.289 3.990 1.00 0.00 N ATOM 938 CA GLU A 59 -7.146 -34.322 5.443 1.00 0.00 C ATOM 939 C GLU A 59 -8.324 -33.636 6.197 1.00 0.00 C ATOM 940 O GLU A 59 -8.531 -32.424 6.026 1.00 0.00 O ATOM 941 CB GLU A 59 -5.808 -33.580 5.737 1.00 0.00 C ATOM 942 CG GLU A 59 -5.385 -33.511 7.217 1.00 0.00 C ATOM 943 CD GLU A 59 -4.779 -34.810 7.756 1.00 0.00 C ATOM 944 OE1 GLU A 59 -5.530 -35.676 8.253 1.00 0.00 O ATOM 945 OE2 GLU A 59 -3.536 -34.971 7.682 1.00 0.00 O ATOM 0 H GLU A 59 -6.712 -33.737 3.476 1.00 0.00 H new ATOM 0 HA GLU A 59 -7.071 -35.354 5.786 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -5.013 -34.070 5.175 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -5.888 -32.562 5.355 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -4.660 -32.706 7.339 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -6.255 -33.251 7.820 1.00 0.00 H new ATOM 952 N PRO A 60 -9.129 -34.390 7.023 1.00 0.00 N ATOM 953 CA PRO A 60 -10.232 -33.794 7.826 1.00 0.00 C ATOM 954 C PRO A 60 -9.697 -32.948 9.005 1.00 0.00 C ATOM 955 O PRO A 60 -10.381 -32.053 9.506 1.00 0.00 O ATOM 956 CB PRO A 60 -11.021 -35.035 8.319 1.00 0.00 C ATOM 957 CG PRO A 60 -9.988 -36.121 8.392 1.00 0.00 C ATOM 958 CD PRO A 60 -9.041 -35.866 7.234 1.00 0.00 C ATOM 0 HA PRO A 60 -10.846 -33.100 7.252 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -11.480 -34.855 9.291 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -11.825 -35.295 7.631 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -9.458 -36.094 9.344 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -10.449 -37.106 8.311 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -8.024 -36.176 7.473 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -9.341 -36.417 6.342 1.00 0.00 H new ATOM 966 N ASP A 61 -8.447 -33.237 9.407 1.00 0.00 N ATOM 967 CA ASP A 61 -7.763 -32.571 10.528 1.00 0.00 C ATOM 968 C ASP A 61 -6.894 -31.401 10.046 1.00 0.00 C ATOM 969 O ASP A 61 -6.150 -30.819 10.849 1.00 0.00 O ATOM 970 CB ASP A 61 -6.904 -33.602 11.305 1.00 0.00 C ATOM 971 CG ASP A 61 -7.768 -34.598 12.098 1.00 0.00 C ATOM 972 OD1 ASP A 61 -8.362 -35.511 11.480 1.00 0.00 O ATOM 973 OD2 ASP A 61 -7.871 -34.466 13.340 1.00 0.00 O ATOM 0 H ASP A 61 -7.875 -33.951 8.955 1.00 0.00 H new ATOM 0 HA ASP A 61 -8.522 -32.160 11.193 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -6.273 -34.149 10.604 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -6.238 -33.076 11.989 1.00 0.00 H new ATOM 978 N LEU A 62 -6.984 -31.059 8.740 1.00 0.00 N ATOM 979 CA LEU A 62 -6.244 -29.923 8.180 1.00 0.00 C ATOM 980 C LEU A 62 -6.776 -28.613 8.767 1.00 0.00 C ATOM 981 O LEU A 62 -7.927 -28.224 8.520 1.00 0.00 O ATOM 982 CB LEU A 62 -6.326 -29.866 6.630 1.00 0.00 C ATOM 983 CG LEU A 62 -5.562 -28.667 5.975 1.00 0.00 C ATOM 984 CD1 LEU A 62 -4.040 -28.776 6.218 1.00 0.00 C ATOM 985 CD2 LEU A 62 -5.895 -28.527 4.473 1.00 0.00 C ATOM 0 H LEU A 62 -7.562 -31.557 8.063 1.00 0.00 H new ATOM 0 HA LEU A 62 -5.197 -30.060 8.449 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -5.928 -30.797 6.225 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -7.375 -29.813 6.338 1.00 0.00 H new ATOM 0 HG LEU A 62 -5.906 -27.754 6.460 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -3.536 -27.930 5.752 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -3.841 -28.771 7.290 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -3.668 -29.704 5.784 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -5.345 -27.684 4.055 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -5.610 -29.440 3.951 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -6.965 -28.358 4.352 1.00 0.00 H new ATOM 997 N TYR A 63 -5.934 -27.965 9.565 1.00 0.00 N ATOM 998 CA TYR A 63 -6.193 -26.630 10.083 1.00 0.00 C ATOM 999 C TYR A 63 -4.861 -25.883 10.142 1.00 0.00 C ATOM 1000 O TYR A 63 -3.950 -26.291 10.871 1.00 0.00 O ATOM 1001 CB TYR A 63 -6.857 -26.730 11.484 1.00 0.00 C ATOM 1002 CG TYR A 63 -7.256 -25.386 12.112 1.00 0.00 C ATOM 1003 CD1 TYR A 63 -8.148 -24.530 11.459 1.00 0.00 C ATOM 1004 CD2 TYR A 63 -6.746 -24.969 13.351 1.00 0.00 C ATOM 1005 CE1 TYR A 63 -8.515 -23.320 12.013 1.00 0.00 C ATOM 1006 CE2 TYR A 63 -7.119 -23.758 13.909 1.00 0.00 C ATOM 1007 CZ TYR A 63 -7.999 -22.939 13.237 1.00 0.00 C ATOM 1008 OH TYR A 63 -8.372 -21.735 13.790 1.00 0.00 O ATOM 0 H TYR A 63 -5.044 -28.357 9.872 1.00 0.00 H new ATOM 0 HA TYR A 63 -6.881 -26.085 9.437 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -7.747 -27.355 11.404 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -6.170 -27.239 12.159 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -8.558 -24.821 10.503 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -6.050 -25.604 13.879 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -9.204 -22.673 11.491 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -6.722 -23.457 14.867 1.00 0.00 H new ATOM 0 HH TYR A 63 -7.921 -21.617 14.652 1.00 0.00 H new ATOM 1018 N GLY A 64 -4.749 -24.809 9.346 1.00 0.00 N ATOM 1019 CA GLY A 64 -3.591 -23.929 9.388 1.00 0.00 C ATOM 1020 C GLY A 64 -3.932 -22.683 10.170 1.00 0.00 C ATOM 1021 O GLY A 64 -4.599 -21.780 9.646 1.00 0.00 O ATOM 0 H GLY A 64 -5.456 -24.535 8.664 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -2.748 -24.442 9.851 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -3.286 -23.664 8.376 1.00 0.00 H new ATOM 1025 N GLU A 65 -3.495 -22.644 11.435 1.00 0.00 N ATOM 1026 CA GLU A 65 -3.727 -21.500 12.321 1.00 0.00 C ATOM 1027 C GLU A 65 -2.592 -20.500 12.133 1.00 0.00 C ATOM 1028 O GLU A 65 -1.498 -20.720 12.641 1.00 0.00 O ATOM 1029 CB GLU A 65 -3.797 -21.987 13.797 1.00 0.00 C ATOM 1030 CG GLU A 65 -4.047 -20.872 14.836 1.00 0.00 C ATOM 1031 CD GLU A 65 -4.142 -21.393 16.283 1.00 0.00 C ATOM 1032 OE1 GLU A 65 -5.221 -21.879 16.670 1.00 0.00 O ATOM 1033 OE2 GLU A 65 -3.144 -21.308 17.038 1.00 0.00 O ATOM 0 H GLU A 65 -2.972 -23.404 11.871 1.00 0.00 H new ATOM 0 HA GLU A 65 -4.673 -21.017 12.077 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -4.591 -22.729 13.883 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -2.862 -22.491 14.043 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -3.242 -20.140 14.773 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -4.971 -20.351 14.584 1.00 0.00 H new ATOM 1040 N LEU A 66 -2.847 -19.426 11.374 1.00 0.00 N ATOM 1041 CA LEU A 66 -1.853 -18.366 11.145 1.00 0.00 C ATOM 1042 C LEU A 66 -1.759 -17.513 12.413 1.00 0.00 C ATOM 1043 O LEU A 66 -2.732 -16.866 12.816 1.00 0.00 O ATOM 1044 CB LEU A 66 -2.221 -17.531 9.880 1.00 0.00 C ATOM 1045 CG LEU A 66 -1.129 -16.531 9.326 1.00 0.00 C ATOM 1046 CD1 LEU A 66 -1.360 -16.250 7.823 1.00 0.00 C ATOM 1047 CD2 LEU A 66 -1.103 -15.200 10.108 1.00 0.00 C ATOM 0 H LEU A 66 -3.739 -19.267 10.905 1.00 0.00 H new ATOM 0 HA LEU A 66 -0.871 -18.795 10.945 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -2.478 -18.226 9.081 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -3.120 -16.957 10.105 1.00 0.00 H new ATOM 0 HG LEU A 66 -0.161 -17.014 9.461 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -0.598 -15.560 7.461 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -1.298 -17.184 7.265 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -2.346 -15.808 7.683 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -0.337 -14.547 9.690 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -2.076 -14.714 10.031 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -0.878 -15.398 11.156 1.00 0.00 H new ATOM 1059 N LEU A 67 -0.574 -17.540 13.039 1.00 0.00 N ATOM 1060 CA LEU A 67 -0.313 -16.862 14.328 1.00 0.00 C ATOM 1061 C LEU A 67 0.530 -15.588 14.119 1.00 0.00 C ATOM 1062 O LEU A 67 0.351 -14.588 14.826 1.00 0.00 O ATOM 1063 CB LEU A 67 0.309 -17.831 15.415 1.00 0.00 C ATOM 1064 CG LEU A 67 1.496 -18.822 15.076 1.00 0.00 C ATOM 1065 CD1 LEU A 67 1.101 -19.942 14.111 1.00 0.00 C ATOM 1066 CD2 LEU A 67 2.767 -18.109 14.608 1.00 0.00 C ATOM 0 H LEU A 67 0.238 -18.034 12.668 1.00 0.00 H new ATOM 0 HA LEU A 67 -1.277 -16.554 14.733 1.00 0.00 H new ATOM 0 HB2 LEU A 67 0.650 -17.203 16.238 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -0.510 -18.441 15.798 1.00 0.00 H new ATOM 0 HG LEU A 67 1.730 -19.297 16.029 1.00 0.00 H new ATOM 0 HD11 LEU A 67 1.963 -20.582 13.924 1.00 0.00 H new ATOM 0 HD12 LEU A 67 0.298 -20.534 14.550 1.00 0.00 H new ATOM 0 HD13 LEU A 67 0.760 -19.509 13.171 1.00 0.00 H new ATOM 0 HD21 LEU A 67 3.540 -18.847 14.393 1.00 0.00 H new ATOM 0 HD22 LEU A 67 2.552 -17.536 13.706 1.00 0.00 H new ATOM 0 HD23 LEU A 67 3.116 -17.436 15.391 1.00 0.00 H new ATOM 1078 N THR A 68 1.430 -15.628 13.125 1.00 0.00 N ATOM 1079 CA THR A 68 2.339 -14.514 12.813 1.00 0.00 C ATOM 1080 C THR A 68 2.465 -14.356 11.289 1.00 0.00 C ATOM 1081 O THR A 68 2.519 -15.347 10.566 1.00 0.00 O ATOM 1082 CB THR A 68 3.756 -14.742 13.454 1.00 0.00 C ATOM 1083 OG1 THR A 68 3.628 -14.955 14.871 1.00 0.00 O ATOM 1084 CG2 THR A 68 4.715 -13.562 13.213 1.00 0.00 C ATOM 0 H THR A 68 1.548 -16.436 12.513 1.00 0.00 H new ATOM 0 HA THR A 68 1.921 -13.601 13.237 1.00 0.00 H new ATOM 0 HB THR A 68 4.179 -15.622 12.969 1.00 0.00 H new ATOM 0 HG1 THR A 68 4.515 -15.098 15.262 1.00 0.00 H new ATOM 0 HG21 THR A 68 5.678 -13.775 13.678 1.00 0.00 H new ATOM 0 HG22 THR A 68 4.853 -13.419 12.141 1.00 0.00 H new ATOM 0 HG23 THR A 68 4.294 -12.656 13.649 1.00 0.00 H new ATOM 1092 N ARG A 69 2.462 -13.099 10.817 1.00 0.00 N ATOM 1093 CA ARG A 69 2.736 -12.752 9.414 1.00 0.00 C ATOM 1094 C ARG A 69 3.537 -11.439 9.355 1.00 0.00 C ATOM 1095 O ARG A 69 3.217 -10.472 10.066 1.00 0.00 O ATOM 1096 CB ARG A 69 1.420 -12.630 8.582 1.00 0.00 C ATOM 1097 CG ARG A 69 0.321 -11.759 9.249 1.00 0.00 C ATOM 1098 CD ARG A 69 -0.652 -11.123 8.235 1.00 0.00 C ATOM 1099 NE ARG A 69 0.031 -10.142 7.371 1.00 0.00 N ATOM 1100 CZ ARG A 69 0.441 -8.921 7.756 1.00 0.00 C ATOM 1101 NH1 ARG A 69 0.179 -8.454 8.975 1.00 0.00 N ATOM 1102 NH2 ARG A 69 1.114 -8.167 6.899 1.00 0.00 N ATOM 0 H ARG A 69 2.267 -12.288 11.404 1.00 0.00 H new ATOM 0 HA ARG A 69 3.324 -13.556 8.971 1.00 0.00 H new ATOM 0 HB2 ARG A 69 1.659 -12.208 7.606 1.00 0.00 H new ATOM 0 HB3 ARG A 69 1.020 -13.629 8.408 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -0.245 -12.374 9.949 1.00 0.00 H new ATOM 0 HG3 ARG A 69 0.796 -10.969 9.831 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -1.098 -11.904 7.619 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -1.467 -10.634 8.769 1.00 0.00 H new ATOM 0 HE ARG A 69 0.206 -10.412 6.403 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -0.343 -9.026 9.639 1.00 0.00 H new ATOM 0 HH12 ARG A 69 0.500 -7.524 9.245 1.00 0.00 H new ATOM 0 HH21 ARG A 69 1.314 -8.515 5.961 1.00 0.00 H new ATOM 0 HH22 ARG A 69 1.432 -7.238 7.177 1.00 0.00 H new ATOM 1116 N VAL A 70 4.602 -11.431 8.529 1.00 0.00 N ATOM 1117 CA VAL A 70 5.409 -10.228 8.221 1.00 0.00 C ATOM 1118 C VAL A 70 5.483 -10.063 6.694 1.00 0.00 C ATOM 1119 O VAL A 70 5.329 -11.045 5.958 1.00 0.00 O ATOM 1120 CB VAL A 70 6.869 -10.284 8.842 1.00 0.00 C ATOM 1121 CG1 VAL A 70 6.814 -10.493 10.373 1.00 0.00 C ATOM 1122 CG2 VAL A 70 7.768 -11.361 8.183 1.00 0.00 C ATOM 0 H VAL A 70 4.932 -12.269 8.050 1.00 0.00 H new ATOM 0 HA VAL A 70 4.918 -9.369 8.678 1.00 0.00 H new ATOM 0 HB VAL A 70 7.325 -9.317 8.630 1.00 0.00 H new ATOM 0 HG11 VAL A 70 7.828 -10.528 10.772 1.00 0.00 H new ATOM 0 HG12 VAL A 70 6.271 -9.668 10.834 1.00 0.00 H new ATOM 0 HG13 VAL A 70 6.305 -11.431 10.594 1.00 0.00 H new ATOM 0 HG21 VAL A 70 8.752 -11.349 8.651 1.00 0.00 H new ATOM 0 HG22 VAL A 70 7.315 -12.344 8.315 1.00 0.00 H new ATOM 0 HG23 VAL A 70 7.870 -11.149 7.119 1.00 0.00 H new ATOM 1132 N ILE A 71 5.714 -8.828 6.219 1.00 0.00 N ATOM 1133 CA ILE A 71 5.784 -8.535 4.772 1.00 0.00 C ATOM 1134 C ILE A 71 6.949 -7.571 4.456 1.00 0.00 C ATOM 1135 O ILE A 71 7.222 -6.626 5.212 1.00 0.00 O ATOM 1136 CB ILE A 71 4.410 -7.984 4.219 1.00 0.00 C ATOM 1137 CG1 ILE A 71 4.509 -7.646 2.691 1.00 0.00 C ATOM 1138 CG2 ILE A 71 3.910 -6.774 5.043 1.00 0.00 C ATOM 1139 CD1 ILE A 71 3.190 -7.359 2.016 1.00 0.00 C ATOM 0 H ILE A 71 5.856 -8.013 6.815 1.00 0.00 H new ATOM 0 HA ILE A 71 5.981 -9.475 4.257 1.00 0.00 H new ATOM 0 HB ILE A 71 3.668 -8.774 4.331 1.00 0.00 H new ATOM 0 HG12 ILE A 71 5.160 -6.780 2.567 1.00 0.00 H new ATOM 0 HG13 ILE A 71 4.988 -8.481 2.180 1.00 0.00 H new ATOM 0 HG21 ILE A 71 2.963 -6.422 4.634 1.00 0.00 H new ATOM 0 HG22 ILE A 71 3.768 -7.075 6.081 1.00 0.00 H new ATOM 0 HG23 ILE A 71 4.647 -5.972 4.995 1.00 0.00 H new ATOM 0 HD11 ILE A 71 3.361 -7.136 0.963 1.00 0.00 H new ATOM 0 HD12 ILE A 71 2.540 -8.230 2.102 1.00 0.00 H new ATOM 0 HD13 ILE A 71 2.715 -6.503 2.495 1.00 0.00 H new ATOM 1151 N VAL A 72 7.629 -7.849 3.330 1.00 0.00 N ATOM 1152 CA VAL A 72 8.777 -7.087 2.827 1.00 0.00 C ATOM 1153 C VAL A 72 8.713 -7.069 1.276 1.00 0.00 C ATOM 1154 O VAL A 72 8.906 -8.104 0.620 1.00 0.00 O ATOM 1155 CB VAL A 72 10.143 -7.688 3.369 1.00 0.00 C ATOM 1156 CG1 VAL A 72 10.234 -9.228 3.162 1.00 0.00 C ATOM 1157 CG2 VAL A 72 11.368 -6.955 2.757 1.00 0.00 C ATOM 0 H VAL A 72 7.384 -8.636 2.729 1.00 0.00 H new ATOM 0 HA VAL A 72 8.735 -6.061 3.192 1.00 0.00 H new ATOM 0 HB VAL A 72 10.159 -7.516 4.445 1.00 0.00 H new ATOM 0 HG11 VAL A 72 11.186 -9.591 3.549 1.00 0.00 H new ATOM 0 HG12 VAL A 72 9.417 -9.715 3.693 1.00 0.00 H new ATOM 0 HG13 VAL A 72 10.163 -9.457 2.099 1.00 0.00 H new ATOM 0 HG21 VAL A 72 12.287 -7.391 3.149 1.00 0.00 H new ATOM 0 HG22 VAL A 72 11.351 -7.061 1.672 1.00 0.00 H new ATOM 0 HG23 VAL A 72 11.328 -5.898 3.019 1.00 0.00 H new ATOM 1167 N GLY A 73 8.361 -5.894 0.713 1.00 0.00 N ATOM 1168 CA GLY A 73 8.252 -5.708 -0.735 1.00 0.00 C ATOM 1169 C GLY A 73 7.143 -6.554 -1.360 1.00 0.00 C ATOM 1170 O GLY A 73 5.970 -6.425 -0.981 1.00 0.00 O ATOM 0 H GLY A 73 8.147 -5.056 1.253 1.00 0.00 H new ATOM 0 HA2 GLY A 73 8.064 -4.656 -0.948 1.00 0.00 H new ATOM 0 HA3 GLY A 73 9.204 -5.962 -1.202 1.00 0.00 H new ATOM 1174 N ASN A 74 7.523 -7.455 -2.291 1.00 0.00 N ATOM 1175 CA ASN A 74 6.566 -8.333 -3.003 1.00 0.00 C ATOM 1176 C ASN A 74 6.534 -9.753 -2.385 1.00 0.00 C ATOM 1177 O ASN A 74 6.034 -10.696 -2.998 1.00 0.00 O ATOM 1178 CB ASN A 74 6.891 -8.386 -4.533 1.00 0.00 C ATOM 1179 CG ASN A 74 8.111 -9.244 -4.915 1.00 0.00 C ATOM 1180 OD1 ASN A 74 9.108 -9.295 -4.194 1.00 0.00 O ATOM 1181 ND2 ASN A 74 8.029 -9.931 -6.056 1.00 0.00 N ATOM 0 H ASN A 74 8.494 -7.595 -2.570 1.00 0.00 H new ATOM 0 HA ASN A 74 5.570 -7.905 -2.886 1.00 0.00 H new ATOM 0 HB2 ASN A 74 6.018 -8.770 -5.060 1.00 0.00 H new ATOM 0 HB3 ASN A 74 7.057 -7.369 -4.888 1.00 0.00 H new ATOM 0 HD21 ASN A 74 8.807 -10.520 -6.354 1.00 0.00 H new ATOM 0 HD22 ASN A 74 7.189 -9.867 -6.631 1.00 0.00 H new ATOM 1188 N VAL A 75 7.020 -9.871 -1.144 1.00 0.00 N ATOM 1189 CA VAL A 75 7.185 -11.156 -0.428 1.00 0.00 C ATOM 1190 C VAL A 75 6.485 -11.091 0.947 1.00 0.00 C ATOM 1191 O VAL A 75 6.602 -10.089 1.649 1.00 0.00 O ATOM 1192 CB VAL A 75 8.731 -11.467 -0.248 1.00 0.00 C ATOM 1193 CG1 VAL A 75 8.991 -12.587 0.785 1.00 0.00 C ATOM 1194 CG2 VAL A 75 9.393 -11.805 -1.611 1.00 0.00 C ATOM 0 H VAL A 75 7.317 -9.066 -0.593 1.00 0.00 H new ATOM 0 HA VAL A 75 6.727 -11.956 -1.010 1.00 0.00 H new ATOM 0 HB VAL A 75 9.192 -10.560 0.144 1.00 0.00 H new ATOM 0 HG11 VAL A 75 10.064 -12.761 0.871 1.00 0.00 H new ATOM 0 HG12 VAL A 75 8.593 -12.287 1.755 1.00 0.00 H new ATOM 0 HG13 VAL A 75 8.500 -13.504 0.459 1.00 0.00 H new ATOM 0 HG21 VAL A 75 10.452 -12.014 -1.459 1.00 0.00 H new ATOM 0 HG22 VAL A 75 8.909 -12.680 -2.044 1.00 0.00 H new ATOM 0 HG23 VAL A 75 9.284 -10.958 -2.288 1.00 0.00 H new ATOM 1204 N VAL A 76 5.760 -12.168 1.318 1.00 0.00 N ATOM 1205 CA VAL A 76 5.147 -12.316 2.655 1.00 0.00 C ATOM 1206 C VAL A 76 5.638 -13.621 3.308 1.00 0.00 C ATOM 1207 O VAL A 76 5.740 -14.653 2.640 1.00 0.00 O ATOM 1208 CB VAL A 76 3.566 -12.331 2.592 1.00 0.00 C ATOM 1209 CG1 VAL A 76 2.922 -12.486 3.999 1.00 0.00 C ATOM 1210 CG2 VAL A 76 3.016 -11.070 1.893 1.00 0.00 C ATOM 0 H VAL A 76 5.583 -12.959 0.699 1.00 0.00 H new ATOM 0 HA VAL A 76 5.450 -11.453 3.248 1.00 0.00 H new ATOM 0 HB VAL A 76 3.291 -13.205 2.001 1.00 0.00 H new ATOM 0 HG11 VAL A 76 1.836 -12.491 3.904 1.00 0.00 H new ATOM 0 HG12 VAL A 76 3.251 -13.423 4.449 1.00 0.00 H new ATOM 0 HG13 VAL A 76 3.227 -11.653 4.632 1.00 0.00 H new ATOM 0 HG21 VAL A 76 1.927 -11.114 1.867 1.00 0.00 H new ATOM 0 HG22 VAL A 76 3.331 -10.183 2.443 1.00 0.00 H new ATOM 0 HG23 VAL A 76 3.401 -11.021 0.874 1.00 0.00 H new ATOM 1220 N ILE A 77 5.962 -13.540 4.605 1.00 0.00 N ATOM 1221 CA ILE A 77 6.159 -14.700 5.481 1.00 0.00 C ATOM 1222 C ILE A 77 4.846 -14.896 6.251 1.00 0.00 C ATOM 1223 O ILE A 77 4.523 -14.101 7.143 1.00 0.00 O ATOM 1224 CB ILE A 77 7.348 -14.433 6.488 1.00 0.00 C ATOM 1225 CG1 ILE A 77 8.737 -14.402 5.775 1.00 0.00 C ATOM 1226 CG2 ILE A 77 7.363 -15.411 7.695 1.00 0.00 C ATOM 1227 CD1 ILE A 77 9.338 -15.764 5.475 1.00 0.00 C ATOM 0 H ILE A 77 6.097 -12.649 5.083 1.00 0.00 H new ATOM 0 HA ILE A 77 6.413 -15.588 4.903 1.00 0.00 H new ATOM 0 HB ILE A 77 7.160 -13.438 6.893 1.00 0.00 H new ATOM 0 HG12 ILE A 77 8.635 -13.853 4.839 1.00 0.00 H new ATOM 0 HG13 ILE A 77 9.435 -13.843 6.398 1.00 0.00 H new ATOM 0 HG21 ILE A 77 8.204 -15.172 8.346 1.00 0.00 H new ATOM 0 HG22 ILE A 77 6.432 -15.314 8.254 1.00 0.00 H new ATOM 0 HG23 ILE A 77 7.464 -16.434 7.333 1.00 0.00 H new ATOM 0 HD11 ILE A 77 10.301 -15.636 4.980 1.00 0.00 H new ATOM 0 HD12 ILE A 77 9.479 -16.313 6.406 1.00 0.00 H new ATOM 0 HD13 ILE A 77 8.666 -16.322 4.823 1.00 0.00 H new ATOM 1239 N ASP A 78 4.058 -15.890 5.852 1.00 0.00 N ATOM 1240 CA ASP A 78 2.848 -16.303 6.566 1.00 0.00 C ATOM 1241 C ASP A 78 3.176 -17.563 7.382 1.00 0.00 C ATOM 1242 O ASP A 78 3.356 -18.656 6.845 1.00 0.00 O ATOM 1243 CB ASP A 78 1.653 -16.500 5.575 1.00 0.00 C ATOM 1244 CG ASP A 78 1.942 -17.453 4.398 1.00 0.00 C ATOM 1245 OD1 ASP A 78 2.755 -17.081 3.516 1.00 0.00 O ATOM 1246 OD2 ASP A 78 1.355 -18.562 4.348 1.00 0.00 O ATOM 0 H ASP A 78 4.242 -16.440 5.013 1.00 0.00 H new ATOM 0 HA ASP A 78 2.524 -15.525 7.257 1.00 0.00 H new ATOM 0 HB2 ASP A 78 0.797 -16.881 6.131 1.00 0.00 H new ATOM 0 HB3 ASP A 78 1.366 -15.527 5.175 1.00 0.00 H new ATOM 1251 N HIS A 79 3.304 -17.376 8.704 1.00 0.00 N ATOM 1252 CA HIS A 79 3.698 -18.437 9.640 1.00 0.00 C ATOM 1253 C HIS A 79 2.439 -18.989 10.330 1.00 0.00 C ATOM 1254 O HIS A 79 1.784 -18.293 11.124 1.00 0.00 O ATOM 1255 CB HIS A 79 4.710 -17.898 10.692 1.00 0.00 C ATOM 1256 CG HIS A 79 5.308 -18.976 11.571 1.00 0.00 C ATOM 1257 ND1 HIS A 79 4.558 -19.749 12.431 1.00 0.00 N ATOM 1258 CD2 HIS A 79 6.578 -19.432 11.686 1.00 0.00 C ATOM 1259 CE1 HIS A 79 5.334 -20.630 13.026 1.00 0.00 C ATOM 1260 NE2 HIS A 79 6.564 -20.461 12.594 1.00 0.00 N ATOM 0 H HIS A 79 3.136 -16.477 9.156 1.00 0.00 H new ATOM 0 HA HIS A 79 4.191 -19.239 9.090 1.00 0.00 H new ATOM 0 HB2 HIS A 79 5.515 -17.376 10.174 1.00 0.00 H new ATOM 0 HB3 HIS A 79 4.208 -17.164 11.323 1.00 0.00 H new ATOM 0 HD2 HIS A 79 7.443 -19.055 11.160 1.00 0.00 H new ATOM 0 HE1 HIS A 79 5.014 -21.367 13.747 1.00 0.00 H new ATOM 0 HE2 HIS A 79 7.375 -21.006 12.886 1.00 0.00 H new ATOM 1269 N GLU A 80 2.141 -20.258 10.029 1.00 0.00 N ATOM 1270 CA GLU A 80 0.950 -20.979 10.506 1.00 0.00 C ATOM 1271 C GLU A 80 1.352 -22.323 11.152 1.00 0.00 C ATOM 1272 O GLU A 80 2.414 -22.870 10.864 1.00 0.00 O ATOM 1273 CB GLU A 80 -0.079 -21.185 9.331 1.00 0.00 C ATOM 1274 CG GLU A 80 0.515 -21.203 7.899 1.00 0.00 C ATOM 1275 CD GLU A 80 1.622 -22.260 7.675 1.00 0.00 C ATOM 1276 OE1 GLU A 80 1.311 -23.472 7.716 1.00 0.00 O ATOM 1277 OE2 GLU A 80 2.804 -21.875 7.488 1.00 0.00 O ATOM 0 H GLU A 80 2.737 -20.830 9.430 1.00 0.00 H new ATOM 0 HA GLU A 80 0.460 -20.378 11.272 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -0.604 -22.126 9.496 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -0.823 -20.390 9.384 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -0.291 -21.384 7.188 1.00 0.00 H new ATOM 0 HG3 GLU A 80 0.922 -20.217 7.676 1.00 0.00 H new ATOM 1284 N THR A 81 0.508 -22.812 12.069 1.00 0.00 N ATOM 1285 CA THR A 81 0.647 -24.139 12.677 1.00 0.00 C ATOM 1286 C THR A 81 -0.328 -25.126 11.994 1.00 0.00 C ATOM 1287 O THR A 81 -1.552 -24.988 12.115 1.00 0.00 O ATOM 1288 CB THR A 81 0.387 -24.071 14.220 1.00 0.00 C ATOM 1289 OG1 THR A 81 1.242 -23.082 14.806 1.00 0.00 O ATOM 1290 CG2 THR A 81 0.648 -25.412 14.924 1.00 0.00 C ATOM 0 H THR A 81 -0.299 -22.291 12.413 1.00 0.00 H new ATOM 0 HA THR A 81 1.667 -24.494 12.530 1.00 0.00 H new ATOM 0 HB THR A 81 -0.665 -23.817 14.353 1.00 0.00 H new ATOM 0 HG1 THR A 81 1.078 -23.038 15.771 1.00 0.00 H new ATOM 0 HG21 THR A 81 0.452 -25.307 15.991 1.00 0.00 H new ATOM 0 HG22 THR A 81 -0.009 -26.175 14.508 1.00 0.00 H new ATOM 0 HG23 THR A 81 1.687 -25.706 14.773 1.00 0.00 H new ATOM 1298 N VAL A 82 0.242 -26.086 11.252 1.00 0.00 N ATOM 1299 CA VAL A 82 -0.498 -27.160 10.564 1.00 0.00 C ATOM 1300 C VAL A 82 -0.838 -28.286 11.557 1.00 0.00 C ATOM 1301 O VAL A 82 0.059 -28.940 12.084 1.00 0.00 O ATOM 1302 CB VAL A 82 0.360 -27.746 9.372 1.00 0.00 C ATOM 1303 CG1 VAL A 82 -0.267 -29.040 8.782 1.00 0.00 C ATOM 1304 CG2 VAL A 82 0.582 -26.681 8.271 1.00 0.00 C ATOM 0 H VAL A 82 1.250 -26.141 11.109 1.00 0.00 H new ATOM 0 HA VAL A 82 -1.421 -26.741 10.163 1.00 0.00 H new ATOM 0 HB VAL A 82 1.333 -28.020 9.781 1.00 0.00 H new ATOM 0 HG11 VAL A 82 0.356 -29.407 7.966 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -0.331 -29.801 9.560 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -1.266 -28.821 8.405 1.00 0.00 H new ATOM 0 HG21 VAL A 82 1.175 -27.111 7.463 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -0.382 -26.356 7.880 1.00 0.00 H new ATOM 0 HG23 VAL A 82 1.110 -25.826 8.693 1.00 0.00 H new ATOM 1314 N THR A 83 -2.137 -28.503 11.809 1.00 0.00 N ATOM 1315 CA THR A 83 -2.608 -29.581 12.689 1.00 0.00 C ATOM 1316 C THR A 83 -2.563 -30.947 11.955 1.00 0.00 C ATOM 1317 O THR A 83 -3.157 -31.105 10.880 1.00 0.00 O ATOM 1318 CB THR A 83 -4.055 -29.291 13.213 1.00 0.00 C ATOM 1319 OG1 THR A 83 -4.100 -27.983 13.822 1.00 0.00 O ATOM 1320 CG2 THR A 83 -4.521 -30.347 14.238 1.00 0.00 C ATOM 0 H THR A 83 -2.887 -27.939 11.410 1.00 0.00 H new ATOM 0 HA THR A 83 -1.939 -29.626 13.548 1.00 0.00 H new ATOM 0 HB THR A 83 -4.728 -29.333 12.357 1.00 0.00 H new ATOM 0 HG1 THR A 83 -5.007 -27.805 14.147 1.00 0.00 H new ATOM 0 HG21 THR A 83 -5.529 -30.107 14.575 1.00 0.00 H new ATOM 0 HG22 THR A 83 -4.519 -31.332 13.772 1.00 0.00 H new ATOM 0 HG23 THR A 83 -3.844 -30.349 15.092 1.00 0.00 H new ATOM 1328 N ARG A 84 -1.804 -31.903 12.529 1.00 0.00 N ATOM 1329 CA ARG A 84 -1.754 -33.313 12.080 1.00 0.00 C ATOM 1330 C ARG A 84 -2.139 -34.217 13.275 1.00 0.00 C ATOM 1331 O ARG A 84 -2.480 -33.713 14.354 1.00 0.00 O ATOM 1332 CB ARG A 84 -0.329 -33.681 11.555 1.00 0.00 C ATOM 1333 CG ARG A 84 0.200 -32.785 10.410 1.00 0.00 C ATOM 1334 CD ARG A 84 1.609 -33.195 9.932 1.00 0.00 C ATOM 1335 NE ARG A 84 1.651 -34.585 9.427 1.00 0.00 N ATOM 1336 CZ ARG A 84 2.757 -35.346 9.307 1.00 0.00 C ATOM 1337 NH1 ARG A 84 3.960 -34.875 9.619 1.00 0.00 N ATOM 1338 NH2 ARG A 84 2.645 -36.590 8.870 1.00 0.00 N ATOM 0 H ARG A 84 -1.199 -31.716 13.329 1.00 0.00 H new ATOM 0 HA ARG A 84 -2.454 -33.460 11.257 1.00 0.00 H new ATOM 0 HB2 ARG A 84 0.372 -33.631 12.388 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -0.342 -34.715 11.210 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -0.492 -32.832 9.569 1.00 0.00 H new ATOM 0 HG3 ARG A 84 0.223 -31.749 10.747 1.00 0.00 H new ATOM 0 HD2 ARG A 84 1.935 -32.515 9.145 1.00 0.00 H new ATOM 0 HD3 ARG A 84 2.314 -33.089 10.756 1.00 0.00 H new ATOM 0 HE ARG A 84 0.765 -35.004 9.145 1.00 0.00 H new ATOM 0 HH11 ARG A 84 4.061 -33.918 9.958 1.00 0.00 H new ATOM 0 HH12 ARG A 84 4.782 -35.470 9.520 1.00 0.00 H new ATOM 0 HH21 ARG A 84 1.728 -36.965 8.628 1.00 0.00 H new ATOM 0 HH22 ARG A 84 3.476 -37.174 8.776 1.00 0.00 H new ATOM 1352 N ASN A 85 -2.093 -35.548 13.083 1.00 0.00 N ATOM 1353 CA ASN A 85 -2.409 -36.525 14.147 1.00 0.00 C ATOM 1354 C ASN A 85 -1.162 -37.353 14.491 1.00 0.00 C ATOM 1355 O ASN A 85 -0.762 -38.229 13.716 1.00 0.00 O ATOM 1356 CB ASN A 85 -3.566 -37.463 13.712 1.00 0.00 C ATOM 1357 CG ASN A 85 -4.846 -36.711 13.337 1.00 0.00 C ATOM 1358 OD1 ASN A 85 -5.087 -36.414 12.168 1.00 0.00 O ATOM 1359 ND2 ASN A 85 -5.664 -36.384 14.324 1.00 0.00 N ATOM 0 H ASN A 85 -1.838 -35.977 12.193 1.00 0.00 H new ATOM 0 HA ASN A 85 -2.728 -35.974 15.032 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -3.240 -38.059 12.860 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -3.785 -38.158 14.522 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -6.523 -35.871 14.126 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -5.436 -36.645 15.283 1.00 0.00 H new ATOM 1366 N PHE A 86 -0.522 -37.034 15.635 1.00 0.00 N ATOM 1367 CA PHE A 86 0.621 -37.802 16.173 1.00 0.00 C ATOM 1368 C PHE A 86 0.170 -38.558 17.446 1.00 0.00 C ATOM 1369 O PHE A 86 -0.564 -37.987 18.256 1.00 0.00 O ATOM 1370 CB PHE A 86 1.817 -36.862 16.503 1.00 0.00 C ATOM 1371 CG PHE A 86 2.475 -36.131 15.325 1.00 0.00 C ATOM 1372 CD1 PHE A 86 2.170 -36.432 13.995 1.00 0.00 C ATOM 1373 CD2 PHE A 86 3.408 -35.123 15.565 1.00 0.00 C ATOM 1374 CE1 PHE A 86 2.776 -35.753 12.954 1.00 0.00 C ATOM 1375 CE2 PHE A 86 4.010 -34.447 14.521 1.00 0.00 C ATOM 1376 CZ PHE A 86 3.694 -34.759 13.216 1.00 0.00 C ATOM 0 H PHE A 86 -0.783 -36.235 16.213 1.00 0.00 H new ATOM 0 HA PHE A 86 0.954 -38.516 15.419 1.00 0.00 H new ATOM 0 HB2 PHE A 86 1.472 -36.113 17.216 1.00 0.00 H new ATOM 0 HB3 PHE A 86 2.583 -37.452 17.006 1.00 0.00 H new ATOM 0 HD1 PHE A 86 1.450 -37.207 13.777 1.00 0.00 H new ATOM 0 HD2 PHE A 86 3.664 -34.867 16.582 1.00 0.00 H new ATOM 0 HE1 PHE A 86 2.529 -36.002 11.933 1.00 0.00 H new ATOM 0 HE2 PHE A 86 4.731 -33.671 14.728 1.00 0.00 H new ATOM 0 HZ PHE A 86 4.164 -34.227 12.402 1.00 0.00 H new ATOM 1386 N PRO A 87 0.595 -39.854 17.642 1.00 0.00 N ATOM 1387 CA PRO A 87 0.180 -40.685 18.811 1.00 0.00 C ATOM 1388 C PRO A 87 0.653 -40.137 20.183 1.00 0.00 C ATOM 1389 O PRO A 87 0.113 -40.535 21.221 1.00 0.00 O ATOM 1390 CB PRO A 87 0.811 -42.076 18.508 1.00 0.00 C ATOM 1391 CG PRO A 87 1.958 -41.776 17.596 1.00 0.00 C ATOM 1392 CD PRO A 87 1.486 -40.626 16.731 1.00 0.00 C ATOM 0 HA PRO A 87 -0.905 -40.703 18.913 1.00 0.00 H new ATOM 0 HB2 PRO A 87 1.148 -42.567 19.421 1.00 0.00 H new ATOM 0 HB3 PRO A 87 0.091 -42.744 18.034 1.00 0.00 H new ATOM 0 HG2 PRO A 87 2.850 -41.504 18.161 1.00 0.00 H new ATOM 0 HG3 PRO A 87 2.217 -42.644 16.990 1.00 0.00 H new ATOM 0 HD2 PRO A 87 2.320 -40.021 16.376 1.00 0.00 H new ATOM 0 HD3 PRO A 87 0.951 -40.979 15.849 1.00 0.00 H new ATOM 1400 N GLU A 88 1.654 -39.232 20.178 1.00 0.00 N ATOM 1401 CA GLU A 88 2.204 -38.630 21.422 1.00 0.00 C ATOM 1402 C GLU A 88 1.353 -37.437 21.918 1.00 0.00 C ATOM 1403 O GLU A 88 1.564 -36.950 23.036 1.00 0.00 O ATOM 1404 CB GLU A 88 3.700 -38.211 21.247 1.00 0.00 C ATOM 1405 CG GLU A 88 4.003 -37.264 20.050 1.00 0.00 C ATOM 1406 CD GLU A 88 4.560 -37.975 18.800 1.00 0.00 C ATOM 1407 OE1 GLU A 88 3.886 -38.874 18.265 1.00 0.00 O ATOM 1408 OE2 GLU A 88 5.667 -37.627 18.338 1.00 0.00 O ATOM 0 H GLU A 88 2.103 -38.898 19.325 1.00 0.00 H new ATOM 0 HA GLU A 88 2.159 -39.404 22.188 1.00 0.00 H new ATOM 0 HB2 GLU A 88 4.031 -37.724 22.164 1.00 0.00 H new ATOM 0 HB3 GLU A 88 4.299 -39.114 21.132 1.00 0.00 H new ATOM 0 HG2 GLU A 88 3.087 -36.739 19.777 1.00 0.00 H new ATOM 0 HG3 GLU A 88 4.719 -36.508 20.373 1.00 0.00 H new ATOM 1415 N GLY A 89 0.406 -36.961 21.088 1.00 0.00 N ATOM 1416 CA GLY A 89 -0.570 -35.958 21.534 1.00 0.00 C ATOM 1417 C GLY A 89 -1.407 -35.414 20.392 1.00 0.00 C ATOM 1418 O GLY A 89 -2.071 -36.184 19.698 1.00 0.00 O ATOM 0 H GLY A 89 0.299 -37.253 20.116 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -1.227 -36.402 22.282 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -0.045 -35.135 22.019 1.00 0.00 H new ATOM 1422 N LYS A 90 -1.394 -34.079 20.218 1.00 0.00 N ATOM 1423 CA LYS A 90 -2.051 -33.394 19.102 1.00 0.00 C ATOM 1424 C LYS A 90 -1.363 -33.749 17.771 1.00 0.00 C ATOM 1425 O LYS A 90 -1.859 -34.586 17.013 1.00 0.00 O ATOM 1426 CB LYS A 90 -2.037 -31.861 19.370 1.00 0.00 C ATOM 1427 CG LYS A 90 -2.566 -30.966 18.227 1.00 0.00 C ATOM 1428 CD LYS A 90 -4.042 -31.195 17.862 1.00 0.00 C ATOM 1429 CE LYS A 90 -5.004 -30.985 19.046 1.00 0.00 C ATOM 1430 NZ LYS A 90 -6.392 -30.737 18.586 1.00 0.00 N ATOM 0 H LYS A 90 -0.920 -33.443 20.859 1.00 0.00 H new ATOM 0 HA LYS A 90 -3.087 -33.723 19.022 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -2.630 -31.663 20.263 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -1.013 -31.561 19.595 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -2.434 -29.922 18.511 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -1.956 -31.135 17.340 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -4.318 -30.517 17.054 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -4.161 -32.210 17.482 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -4.986 -31.864 19.691 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -4.663 -30.142 19.647 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -7.012 -30.600 19.410 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -6.413 -29.884 17.991 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -6.726 -31.553 18.034 1.00 0.00 H new ATOM 1444 N GLY A 91 -0.197 -33.146 17.518 1.00 0.00 N ATOM 1445 CA GLY A 91 0.536 -33.356 16.272 1.00 0.00 C ATOM 1446 C GLY A 91 0.582 -32.125 15.397 1.00 0.00 C ATOM 1447 O GLY A 91 0.758 -32.227 14.180 1.00 0.00 O ATOM 0 H GLY A 91 0.259 -32.505 18.167 1.00 0.00 H new ATOM 0 HA2 GLY A 91 1.554 -33.667 16.505 1.00 0.00 H new ATOM 0 HA3 GLY A 91 0.072 -34.172 15.717 1.00 0.00 H new ATOM 1451 N GLU A 92 0.493 -30.953 16.025 1.00 0.00 N ATOM 1452 CA GLU A 92 0.427 -29.677 15.306 1.00 0.00 C ATOM 1453 C GLU A 92 1.857 -29.139 15.120 1.00 0.00 C ATOM 1454 O GLU A 92 2.558 -28.872 16.084 1.00 0.00 O ATOM 1455 CB GLU A 92 -0.484 -28.665 16.069 1.00 0.00 C ATOM 1456 CG GLU A 92 -0.103 -28.419 17.548 1.00 0.00 C ATOM 1457 CD GLU A 92 -0.960 -27.338 18.230 1.00 0.00 C ATOM 1458 OE1 GLU A 92 -2.199 -27.512 18.308 1.00 0.00 O ATOM 1459 OE2 GLU A 92 -0.403 -26.326 18.698 1.00 0.00 O ATOM 0 H GLU A 92 0.465 -30.859 17.040 1.00 0.00 H new ATOM 0 HA GLU A 92 -0.020 -29.823 14.323 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -0.461 -27.711 15.541 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -1.512 -29.026 16.031 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -0.203 -29.353 18.101 1.00 0.00 H new ATOM 0 HG3 GLU A 92 0.946 -28.127 17.601 1.00 0.00 H new ATOM 1466 N VAL A 93 2.302 -29.033 13.861 1.00 0.00 N ATOM 1467 CA VAL A 93 3.677 -28.630 13.535 1.00 0.00 C ATOM 1468 C VAL A 93 3.663 -27.175 13.053 1.00 0.00 C ATOM 1469 O VAL A 93 2.773 -26.785 12.286 1.00 0.00 O ATOM 1470 CB VAL A 93 4.315 -29.597 12.449 1.00 0.00 C ATOM 1471 CG1 VAL A 93 4.179 -31.072 12.898 1.00 0.00 C ATOM 1472 CG2 VAL A 93 3.700 -29.400 11.037 1.00 0.00 C ATOM 0 H VAL A 93 1.723 -29.223 13.043 1.00 0.00 H new ATOM 0 HA VAL A 93 4.300 -28.706 14.426 1.00 0.00 H new ATOM 0 HB VAL A 93 5.371 -29.338 12.372 1.00 0.00 H new ATOM 0 HG11 VAL A 93 4.620 -31.724 12.144 1.00 0.00 H new ATOM 0 HG12 VAL A 93 4.696 -31.213 13.847 1.00 0.00 H new ATOM 0 HG13 VAL A 93 3.124 -31.320 13.019 1.00 0.00 H new ATOM 0 HG21 VAL A 93 4.173 -30.086 10.335 1.00 0.00 H new ATOM 0 HG22 VAL A 93 2.629 -29.601 11.075 1.00 0.00 H new ATOM 0 HG23 VAL A 93 3.865 -28.374 10.708 1.00 0.00 H new ATOM 1482 N ASP A 94 4.600 -26.354 13.556 1.00 0.00 N ATOM 1483 CA ASP A 94 4.699 -24.953 13.124 1.00 0.00 C ATOM 1484 C ASP A 94 5.474 -24.907 11.801 1.00 0.00 C ATOM 1485 O ASP A 94 6.373 -25.721 11.577 1.00 0.00 O ATOM 1486 CB ASP A 94 5.364 -24.042 14.200 1.00 0.00 C ATOM 1487 CG ASP A 94 6.904 -24.121 14.248 1.00 0.00 C ATOM 1488 OD1 ASP A 94 7.436 -25.149 14.698 1.00 0.00 O ATOM 1489 OD2 ASP A 94 7.586 -23.147 13.827 1.00 0.00 O ATOM 0 H ASP A 94 5.291 -26.633 14.253 1.00 0.00 H new ATOM 0 HA ASP A 94 3.693 -24.558 12.982 1.00 0.00 H new ATOM 0 HB2 ASP A 94 5.072 -23.009 14.012 1.00 0.00 H new ATOM 0 HB3 ASP A 94 4.969 -24.312 15.179 1.00 0.00 H new ATOM 1494 N VAL A 95 5.076 -23.998 10.913 1.00 0.00 N ATOM 1495 CA VAL A 95 5.663 -23.837 9.571 1.00 0.00 C ATOM 1496 C VAL A 95 5.736 -22.330 9.255 1.00 0.00 C ATOM 1497 O VAL A 95 4.871 -21.565 9.689 1.00 0.00 O ATOM 1498 CB VAL A 95 4.801 -24.563 8.446 1.00 0.00 C ATOM 1499 CG1 VAL A 95 5.480 -24.503 7.056 1.00 0.00 C ATOM 1500 CG2 VAL A 95 4.430 -26.021 8.822 1.00 0.00 C ATOM 0 H VAL A 95 4.323 -23.337 11.103 1.00 0.00 H new ATOM 0 HA VAL A 95 6.652 -24.294 9.572 1.00 0.00 H new ATOM 0 HB VAL A 95 3.869 -24.002 8.382 1.00 0.00 H new ATOM 0 HG11 VAL A 95 4.854 -25.012 6.323 1.00 0.00 H new ATOM 0 HG12 VAL A 95 5.613 -23.462 6.760 1.00 0.00 H new ATOM 0 HG13 VAL A 95 6.452 -24.993 7.105 1.00 0.00 H new ATOM 0 HG21 VAL A 95 3.843 -26.466 8.019 1.00 0.00 H new ATOM 0 HG22 VAL A 95 5.341 -26.601 8.970 1.00 0.00 H new ATOM 0 HG23 VAL A 95 3.845 -26.022 9.742 1.00 0.00 H new ATOM 1510 N ALA A 96 6.798 -21.905 8.561 1.00 0.00 N ATOM 1511 CA ALA A 96 6.862 -20.593 7.913 1.00 0.00 C ATOM 1512 C ALA A 96 6.708 -20.806 6.410 1.00 0.00 C ATOM 1513 O ALA A 96 7.622 -21.334 5.762 1.00 0.00 O ATOM 1514 CB ALA A 96 8.187 -19.876 8.213 1.00 0.00 C ATOM 0 H ALA A 96 7.641 -22.465 8.433 1.00 0.00 H new ATOM 0 HA ALA A 96 6.063 -19.960 8.300 1.00 0.00 H new ATOM 0 HB1 ALA A 96 8.197 -18.906 7.715 1.00 0.00 H new ATOM 0 HB2 ALA A 96 8.288 -19.733 9.289 1.00 0.00 H new ATOM 0 HB3 ALA A 96 9.018 -20.480 7.848 1.00 0.00 H new ATOM 1520 N CYS A 97 5.553 -20.434 5.865 1.00 0.00 N ATOM 1521 CA CYS A 97 5.321 -20.461 4.422 1.00 0.00 C ATOM 1522 C CYS A 97 5.641 -19.058 3.881 1.00 0.00 C ATOM 1523 O CYS A 97 5.355 -18.057 4.536 1.00 0.00 O ATOM 1524 CB CYS A 97 3.867 -20.891 4.117 1.00 0.00 C ATOM 1525 SG CYS A 97 3.621 -21.522 2.445 1.00 0.00 S ATOM 0 H CYS A 97 4.754 -20.106 6.408 1.00 0.00 H new ATOM 0 HA CYS A 97 5.963 -21.192 3.931 1.00 0.00 H new ATOM 0 HB2 CYS A 97 3.569 -21.659 4.831 1.00 0.00 H new ATOM 0 HB3 CYS A 97 3.207 -20.038 4.273 1.00 0.00 H new ATOM 0 HG CYS A 97 3.505 -20.526 1.618 1.00 0.00 H new ATOM 1531 N ILE A 98 6.316 -19.002 2.736 1.00 0.00 N ATOM 1532 CA ILE A 98 6.783 -17.751 2.130 1.00 0.00 C ATOM 1533 C ILE A 98 6.388 -17.718 0.643 1.00 0.00 C ATOM 1534 O ILE A 98 6.749 -18.611 -0.135 1.00 0.00 O ATOM 1535 CB ILE A 98 8.346 -17.578 2.375 1.00 0.00 C ATOM 1536 CG1 ILE A 98 8.912 -16.204 1.858 1.00 0.00 C ATOM 1537 CG2 ILE A 98 9.166 -18.776 1.837 1.00 0.00 C ATOM 1538 CD1 ILE A 98 9.283 -16.121 0.383 1.00 0.00 C ATOM 0 H ILE A 98 6.559 -19.831 2.194 1.00 0.00 H new ATOM 0 HA ILE A 98 6.301 -16.895 2.602 1.00 0.00 H new ATOM 0 HB ILE A 98 8.467 -17.566 3.458 1.00 0.00 H new ATOM 0 HG12 ILE A 98 8.170 -15.433 2.065 1.00 0.00 H new ATOM 0 HG13 ILE A 98 9.798 -15.960 2.445 1.00 0.00 H new ATOM 0 HG21 ILE A 98 10.226 -18.607 2.030 1.00 0.00 H new ATOM 0 HG22 ILE A 98 8.847 -19.690 2.338 1.00 0.00 H new ATOM 0 HG23 ILE A 98 9.004 -18.875 0.764 1.00 0.00 H new ATOM 0 HD11 ILE A 98 9.659 -15.123 0.158 1.00 0.00 H new ATOM 0 HD12 ILE A 98 10.054 -16.858 0.160 1.00 0.00 H new ATOM 0 HD13 ILE A 98 8.402 -16.322 -0.226 1.00 0.00 H new ATOM 1550 N TYR A 99 5.612 -16.688 0.259 1.00 0.00 N ATOM 1551 CA TYR A 99 5.175 -16.481 -1.134 1.00 0.00 C ATOM 1552 C TYR A 99 5.902 -15.279 -1.726 1.00 0.00 C ATOM 1553 O TYR A 99 6.095 -14.264 -1.049 1.00 0.00 O ATOM 1554 CB TYR A 99 3.642 -16.225 -1.226 1.00 0.00 C ATOM 1555 CG TYR A 99 2.769 -17.226 -0.458 1.00 0.00 C ATOM 1556 CD1 TYR A 99 3.091 -18.579 -0.401 1.00 0.00 C ATOM 1557 CD2 TYR A 99 1.634 -16.800 0.229 1.00 0.00 C ATOM 1558 CE1 TYR A 99 2.323 -19.469 0.318 1.00 0.00 C ATOM 1559 CE2 TYR A 99 0.852 -17.688 0.941 1.00 0.00 C ATOM 1560 CZ TYR A 99 1.210 -19.021 0.991 1.00 0.00 C ATOM 1561 OH TYR A 99 0.460 -19.907 1.735 1.00 0.00 O ATOM 0 H TYR A 99 5.270 -15.976 0.905 1.00 0.00 H new ATOM 0 HA TYR A 99 5.411 -17.389 -1.689 1.00 0.00 H new ATOM 0 HB2 TYR A 99 3.433 -15.223 -0.852 1.00 0.00 H new ATOM 0 HB3 TYR A 99 3.349 -16.241 -2.276 1.00 0.00 H new ATOM 0 HD1 TYR A 99 3.961 -18.939 -0.931 1.00 0.00 H new ATOM 0 HD2 TYR A 99 1.361 -15.755 0.204 1.00 0.00 H new ATOM 0 HE1 TYR A 99 2.594 -20.514 0.353 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -0.033 -17.343 1.455 1.00 0.00 H new ATOM 0 HH TYR A 99 0.562 -19.702 2.688 1.00 0.00 H new ATOM 1571 N GLU A 100 6.317 -15.412 -2.988 1.00 0.00 N ATOM 1572 CA GLU A 100 6.748 -14.281 -3.805 1.00 0.00 C ATOM 1573 C GLU A 100 5.626 -13.968 -4.801 1.00 0.00 C ATOM 1574 O GLU A 100 5.339 -14.764 -5.703 1.00 0.00 O ATOM 1575 CB GLU A 100 8.057 -14.612 -4.548 1.00 0.00 C ATOM 1576 CG GLU A 100 8.591 -13.468 -5.426 1.00 0.00 C ATOM 1577 CD GLU A 100 9.886 -13.839 -6.155 1.00 0.00 C ATOM 1578 OE1 GLU A 100 9.817 -14.408 -7.265 1.00 0.00 O ATOM 1579 OE2 GLU A 100 10.982 -13.563 -5.623 1.00 0.00 O ATOM 0 H GLU A 100 6.363 -16.309 -3.471 1.00 0.00 H new ATOM 0 HA GLU A 100 6.944 -13.415 -3.173 1.00 0.00 H new ATOM 0 HB2 GLU A 100 8.819 -14.879 -3.816 1.00 0.00 H new ATOM 0 HB3 GLU A 100 7.894 -15.490 -5.174 1.00 0.00 H new ATOM 0 HG2 GLU A 100 7.832 -13.193 -6.159 1.00 0.00 H new ATOM 0 HG3 GLU A 100 8.767 -12.590 -4.805 1.00 0.00 H new ATOM 1586 N VAL A 101 4.989 -12.816 -4.595 1.00 0.00 N ATOM 1587 CA VAL A 101 3.906 -12.322 -5.447 1.00 0.00 C ATOM 1588 C VAL A 101 4.481 -11.341 -6.486 1.00 0.00 C ATOM 1589 O VAL A 101 4.902 -10.237 -6.143 1.00 0.00 O ATOM 1590 CB VAL A 101 2.810 -11.606 -4.563 1.00 0.00 C ATOM 1591 CG1 VAL A 101 1.616 -11.091 -5.413 1.00 0.00 C ATOM 1592 CG2 VAL A 101 2.322 -12.540 -3.424 1.00 0.00 C ATOM 0 H VAL A 101 5.213 -12.190 -3.821 1.00 0.00 H new ATOM 0 HA VAL A 101 3.440 -13.159 -5.966 1.00 0.00 H new ATOM 0 HB VAL A 101 3.280 -10.732 -4.113 1.00 0.00 H new ATOM 0 HG11 VAL A 101 0.888 -10.606 -4.762 1.00 0.00 H new ATOM 0 HG12 VAL A 101 1.977 -10.374 -6.151 1.00 0.00 H new ATOM 0 HG13 VAL A 101 1.144 -11.930 -5.923 1.00 0.00 H new ATOM 0 HG21 VAL A 101 1.568 -12.025 -2.829 1.00 0.00 H new ATOM 0 HG22 VAL A 101 1.890 -13.443 -3.854 1.00 0.00 H new ATOM 0 HG23 VAL A 101 3.165 -12.809 -2.787 1.00 0.00 H new ATOM 1602 N GLU A 102 4.486 -11.756 -7.756 1.00 0.00 N ATOM 1603 CA GLU A 102 4.919 -10.921 -8.884 1.00 0.00 C ATOM 1604 C GLU A 102 3.700 -10.575 -9.752 1.00 0.00 C ATOM 1605 O GLU A 102 2.951 -11.478 -10.145 1.00 0.00 O ATOM 1606 CB GLU A 102 5.979 -11.671 -9.730 1.00 0.00 C ATOM 1607 CG GLU A 102 6.477 -10.905 -10.967 1.00 0.00 C ATOM 1608 CD GLU A 102 7.391 -11.747 -11.872 1.00 0.00 C ATOM 1609 OE1 GLU A 102 6.871 -12.455 -12.767 1.00 0.00 O ATOM 1610 OE2 GLU A 102 8.626 -11.717 -11.690 1.00 0.00 O ATOM 0 H GLU A 102 4.187 -12.691 -8.035 1.00 0.00 H new ATOM 0 HA GLU A 102 5.368 -10.003 -8.504 1.00 0.00 H new ATOM 0 HB2 GLU A 102 6.834 -11.901 -9.094 1.00 0.00 H new ATOM 0 HB3 GLU A 102 5.557 -12.622 -10.055 1.00 0.00 H new ATOM 0 HG2 GLU A 102 5.618 -10.564 -11.545 1.00 0.00 H new ATOM 0 HG3 GLU A 102 7.017 -10.015 -10.643 1.00 0.00 H new ATOM 1617 N ASN A 103 3.518 -9.270 -10.035 1.00 0.00 N ATOM 1618 CA ASN A 103 2.444 -8.757 -10.925 1.00 0.00 C ATOM 1619 C ASN A 103 1.034 -9.065 -10.357 1.00 0.00 C ATOM 1620 O ASN A 103 0.062 -9.204 -11.113 1.00 0.00 O ATOM 1621 CB ASN A 103 2.606 -9.331 -12.370 1.00 0.00 C ATOM 1622 CG ASN A 103 3.970 -9.029 -13.001 1.00 0.00 C ATOM 1623 OD1 ASN A 103 4.549 -7.963 -12.789 1.00 0.00 O ATOM 1624 ND2 ASN A 103 4.515 -9.983 -13.741 1.00 0.00 N ATOM 0 H ASN A 103 4.112 -8.534 -9.653 1.00 0.00 H new ATOM 0 HA ASN A 103 2.543 -7.673 -10.973 1.00 0.00 H new ATOM 0 HB2 ASN A 103 2.459 -10.411 -12.342 1.00 0.00 H new ATOM 0 HB3 ASN A 103 1.822 -8.919 -13.005 1.00 0.00 H new ATOM 0 HD21 ASN A 103 5.438 -9.845 -14.152 1.00 0.00 H new ATOM 0 HD22 ASN A 103 4.012 -10.856 -13.899 1.00 0.00 H new ATOM 1631 N GLY A 104 0.939 -9.118 -9.011 1.00 0.00 N ATOM 1632 CA GLY A 104 -0.319 -9.410 -8.310 1.00 0.00 C ATOM 1633 C GLY A 104 -0.687 -10.897 -8.296 1.00 0.00 C ATOM 1634 O GLY A 104 -1.801 -11.268 -7.898 1.00 0.00 O ATOM 0 H GLY A 104 1.730 -8.960 -8.387 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -0.243 -9.054 -7.283 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -1.126 -8.850 -8.782 1.00 0.00 H new ATOM 1638 N ARG A 105 0.256 -11.749 -8.726 1.00 0.00 N ATOM 1639 CA ARG A 105 0.090 -13.212 -8.772 1.00 0.00 C ATOM 1640 C ARG A 105 1.279 -13.875 -8.078 1.00 0.00 C ATOM 1641 O ARG A 105 2.414 -13.476 -8.308 1.00 0.00 O ATOM 1642 CB ARG A 105 -0.007 -13.712 -10.245 1.00 0.00 C ATOM 1643 CG ARG A 105 -1.264 -13.237 -11.005 1.00 0.00 C ATOM 1644 CD ARG A 105 -2.563 -13.782 -10.387 1.00 0.00 C ATOM 1645 NE ARG A 105 -3.767 -13.191 -10.996 1.00 0.00 N ATOM 1646 CZ ARG A 105 -4.603 -12.329 -10.385 1.00 0.00 C ATOM 1647 NH1 ARG A 105 -4.368 -11.913 -9.140 1.00 0.00 N ATOM 1648 NH2 ARG A 105 -5.653 -11.866 -11.041 1.00 0.00 N ATOM 0 H ARG A 105 1.169 -11.438 -9.057 1.00 0.00 H new ATOM 0 HA ARG A 105 -0.834 -13.478 -8.259 1.00 0.00 H new ATOM 0 HB2 ARG A 105 0.877 -13.377 -10.787 1.00 0.00 H new ATOM 0 HB3 ARG A 105 0.012 -14.802 -10.247 1.00 0.00 H new ATOM 0 HG2 ARG A 105 -1.295 -12.147 -11.006 1.00 0.00 H new ATOM 0 HG3 ARG A 105 -1.198 -13.555 -12.045 1.00 0.00 H new ATOM 0 HD2 ARG A 105 -2.593 -14.865 -10.507 1.00 0.00 H new ATOM 0 HD3 ARG A 105 -2.565 -13.580 -9.316 1.00 0.00 H new ATOM 0 HE ARG A 105 -3.985 -13.455 -11.957 1.00 0.00 H new ATOM 0 HH11 ARG A 105 -3.546 -12.248 -8.637 1.00 0.00 H new ATOM 0 HH12 ARG A 105 -5.010 -11.260 -8.691 1.00 0.00 H new ATOM 0 HH21 ARG A 105 -5.825 -12.162 -12.002 1.00 0.00 H new ATOM 0 HH22 ARG A 105 -6.291 -11.213 -10.586 1.00 0.00 H new ATOM 1662 N ILE A 106 1.019 -14.879 -7.228 1.00 0.00 N ATOM 1663 CA ILE A 106 2.064 -15.677 -6.580 1.00 0.00 C ATOM 1664 C ILE A 106 2.845 -16.433 -7.667 1.00 0.00 C ATOM 1665 O ILE A 106 2.374 -17.444 -8.203 1.00 0.00 O ATOM 1666 CB ILE A 106 1.455 -16.670 -5.517 1.00 0.00 C ATOM 1667 CG1 ILE A 106 0.654 -15.875 -4.440 1.00 0.00 C ATOM 1668 CG2 ILE A 106 2.550 -17.549 -4.854 1.00 0.00 C ATOM 1669 CD1 ILE A 106 -0.123 -16.739 -3.463 1.00 0.00 C ATOM 0 H ILE A 106 0.073 -15.160 -6.971 1.00 0.00 H new ATOM 0 HA ILE A 106 2.740 -15.017 -6.037 1.00 0.00 H new ATOM 0 HB ILE A 106 0.775 -17.344 -6.038 1.00 0.00 H new ATOM 0 HG12 ILE A 106 1.348 -15.249 -3.879 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -0.042 -15.205 -4.945 1.00 0.00 H new ATOM 0 HG21 ILE A 106 2.089 -18.219 -4.128 1.00 0.00 H new ATOM 0 HG22 ILE A 106 3.057 -18.137 -5.619 1.00 0.00 H new ATOM 0 HG23 ILE A 106 3.273 -16.909 -4.349 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -0.648 -16.102 -2.752 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -0.845 -17.346 -4.009 1.00 0.00 H new ATOM 0 HD13 ILE A 106 0.566 -17.391 -2.926 1.00 0.00 H new ATOM 1681 N ALA A 107 4.021 -15.890 -8.004 1.00 0.00 N ATOM 1682 CA ALA A 107 4.861 -16.377 -9.102 1.00 0.00 C ATOM 1683 C ALA A 107 5.593 -17.651 -8.690 1.00 0.00 C ATOM 1684 O ALA A 107 5.861 -18.520 -9.523 1.00 0.00 O ATOM 1685 CB ALA A 107 5.867 -15.286 -9.498 1.00 0.00 C ATOM 0 H ALA A 107 4.420 -15.089 -7.514 1.00 0.00 H new ATOM 0 HA ALA A 107 4.229 -16.611 -9.959 1.00 0.00 H new ATOM 0 HB1 ALA A 107 6.492 -15.647 -10.315 1.00 0.00 H new ATOM 0 HB2 ALA A 107 5.329 -14.394 -9.820 1.00 0.00 H new ATOM 0 HB3 ALA A 107 6.495 -15.041 -8.641 1.00 0.00 H new ATOM 1691 N LYS A 108 5.913 -17.732 -7.389 1.00 0.00 N ATOM 1692 CA LYS A 108 6.608 -18.875 -6.766 1.00 0.00 C ATOM 1693 C LYS A 108 6.227 -18.928 -5.282 1.00 0.00 C ATOM 1694 O LYS A 108 5.910 -17.889 -4.682 1.00 0.00 O ATOM 1695 CB LYS A 108 8.157 -18.758 -6.904 1.00 0.00 C ATOM 1696 CG LYS A 108 8.702 -18.948 -8.339 1.00 0.00 C ATOM 1697 CD LYS A 108 10.219 -18.729 -8.460 1.00 0.00 C ATOM 1698 CE LYS A 108 10.720 -18.928 -9.904 1.00 0.00 C ATOM 1699 NZ LYS A 108 12.157 -18.597 -10.034 1.00 0.00 N ATOM 0 H LYS A 108 5.692 -16.990 -6.725 1.00 0.00 H new ATOM 0 HA LYS A 108 6.302 -19.787 -7.278 1.00 0.00 H new ATOM 0 HB2 LYS A 108 8.466 -17.778 -6.541 1.00 0.00 H new ATOM 0 HB3 LYS A 108 8.622 -19.499 -6.254 1.00 0.00 H new ATOM 0 HG2 LYS A 108 8.461 -19.955 -8.679 1.00 0.00 H new ATOM 0 HG3 LYS A 108 8.190 -18.255 -9.007 1.00 0.00 H new ATOM 0 HD2 LYS A 108 10.467 -17.721 -8.126 1.00 0.00 H new ATOM 0 HD3 LYS A 108 10.739 -19.421 -7.798 1.00 0.00 H new ATOM 0 HE2 LYS A 108 10.556 -19.962 -10.207 1.00 0.00 H new ATOM 0 HE3 LYS A 108 10.139 -18.301 -10.581 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 12.459 -18.743 -11.018 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 12.310 -17.603 -9.768 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 12.713 -19.212 -9.407 1.00 0.00 H new ATOM 1713 N ALA A 109 6.293 -20.129 -4.693 1.00 0.00 N ATOM 1714 CA ALA A 109 5.925 -20.352 -3.288 1.00 0.00 C ATOM 1715 C ALA A 109 6.794 -21.470 -2.709 1.00 0.00 C ATOM 1716 O ALA A 109 7.013 -22.497 -3.346 1.00 0.00 O ATOM 1717 CB ALA A 109 4.431 -20.690 -3.163 1.00 0.00 C ATOM 0 H ALA A 109 6.602 -20.973 -5.176 1.00 0.00 H new ATOM 0 HA ALA A 109 6.101 -19.438 -2.720 1.00 0.00 H new ATOM 0 HB1 ALA A 109 4.181 -20.851 -2.114 1.00 0.00 H new ATOM 0 HB2 ALA A 109 3.837 -19.864 -3.555 1.00 0.00 H new ATOM 0 HB3 ALA A 109 4.214 -21.595 -3.731 1.00 0.00 H new ATOM 1723 N TRP A 110 7.300 -21.240 -1.497 1.00 0.00 N ATOM 1724 CA TRP A 110 8.191 -22.167 -0.786 1.00 0.00 C ATOM 1725 C TRP A 110 7.684 -22.273 0.663 1.00 0.00 C ATOM 1726 O TRP A 110 7.031 -21.350 1.145 1.00 0.00 O ATOM 1727 CB TRP A 110 9.658 -21.624 -0.817 1.00 0.00 C ATOM 1728 CG TRP A 110 10.147 -21.137 -2.181 1.00 0.00 C ATOM 1729 CD1 TRP A 110 10.673 -21.888 -3.190 1.00 0.00 C ATOM 1730 CD2 TRP A 110 10.145 -19.782 -2.670 1.00 0.00 C ATOM 1731 NE1 TRP A 110 11.008 -21.096 -4.255 1.00 0.00 N ATOM 1732 CE2 TRP A 110 10.698 -19.804 -3.963 1.00 0.00 C ATOM 1733 CE3 TRP A 110 9.739 -18.559 -2.140 1.00 0.00 C ATOM 1734 CZ2 TRP A 110 10.859 -18.654 -4.727 1.00 0.00 C ATOM 1735 CZ3 TRP A 110 9.891 -17.416 -2.903 1.00 0.00 C ATOM 1736 CH2 TRP A 110 10.447 -17.471 -4.186 1.00 0.00 C ATOM 0 H TRP A 110 7.101 -20.390 -0.970 1.00 0.00 H new ATOM 0 HA TRP A 110 8.189 -23.149 -1.259 1.00 0.00 H new ATOM 0 HB2 TRP A 110 9.738 -20.802 -0.106 1.00 0.00 H new ATOM 0 HB3 TRP A 110 10.327 -22.412 -0.470 1.00 0.00 H new ATOM 0 HD1 TRP A 110 10.807 -22.959 -3.154 1.00 0.00 H new ATOM 0 HE1 TRP A 110 11.423 -21.422 -5.128 1.00 0.00 H new ATOM 0 HE3 TRP A 110 9.312 -18.505 -1.149 1.00 0.00 H new ATOM 0 HZ2 TRP A 110 11.295 -18.695 -5.714 1.00 0.00 H new ATOM 0 HZ3 TRP A 110 9.575 -16.464 -2.502 1.00 0.00 H new ATOM 0 HH2 TRP A 110 10.552 -16.561 -4.758 1.00 0.00 H new ATOM 1747 N PHE A 111 7.950 -23.393 1.359 1.00 0.00 N ATOM 1748 CA PHE A 111 7.614 -23.509 2.798 1.00 0.00 C ATOM 1749 C PHE A 111 8.698 -24.293 3.543 1.00 0.00 C ATOM 1750 O PHE A 111 9.327 -25.202 2.982 1.00 0.00 O ATOM 1751 CB PHE A 111 6.197 -24.124 3.031 1.00 0.00 C ATOM 1752 CG PHE A 111 6.077 -25.641 2.847 1.00 0.00 C ATOM 1753 CD1 PHE A 111 5.838 -26.203 1.596 1.00 0.00 C ATOM 1754 CD2 PHE A 111 6.186 -26.507 3.944 1.00 0.00 C ATOM 1755 CE1 PHE A 111 5.716 -27.573 1.442 1.00 0.00 C ATOM 1756 CE2 PHE A 111 6.068 -27.871 3.792 1.00 0.00 C ATOM 1757 CZ PHE A 111 5.829 -28.409 2.541 1.00 0.00 C ATOM 0 H PHE A 111 8.390 -24.222 0.960 1.00 0.00 H new ATOM 0 HA PHE A 111 7.580 -22.499 3.207 1.00 0.00 H new ATOM 0 HB2 PHE A 111 5.878 -23.876 4.043 1.00 0.00 H new ATOM 0 HB3 PHE A 111 5.498 -23.640 2.349 1.00 0.00 H new ATOM 0 HD1 PHE A 111 5.746 -25.560 0.733 1.00 0.00 H new ATOM 0 HD2 PHE A 111 6.366 -26.097 4.927 1.00 0.00 H new ATOM 0 HE1 PHE A 111 5.532 -27.991 0.463 1.00 0.00 H new ATOM 0 HE2 PHE A 111 6.162 -28.520 4.650 1.00 0.00 H new ATOM 0 HZ PHE A 111 5.731 -29.478 2.421 1.00 0.00 H new ATOM 1767 N LYS A 112 8.903 -23.915 4.811 1.00 0.00 N ATOM 1768 CA LYS A 112 9.891 -24.526 5.707 1.00 0.00 C ATOM 1769 C LYS A 112 9.222 -24.846 7.057 1.00 0.00 C ATOM 1770 O LYS A 112 8.672 -23.956 7.706 1.00 0.00 O ATOM 1771 CB LYS A 112 11.119 -23.574 5.868 1.00 0.00 C ATOM 1772 CG LYS A 112 10.767 -22.128 6.295 1.00 0.00 C ATOM 1773 CD LYS A 112 11.988 -21.183 6.383 1.00 0.00 C ATOM 1774 CE LYS A 112 12.699 -20.984 5.028 1.00 0.00 C ATOM 1775 NZ LYS A 112 13.778 -19.968 5.108 1.00 0.00 N ATOM 0 H LYS A 112 8.376 -23.161 5.251 1.00 0.00 H new ATOM 0 HA LYS A 112 10.259 -25.461 5.285 1.00 0.00 H new ATOM 0 HB2 LYS A 112 11.798 -24.001 6.606 1.00 0.00 H new ATOM 0 HB3 LYS A 112 11.659 -23.537 4.922 1.00 0.00 H new ATOM 0 HG2 LYS A 112 10.051 -21.715 5.585 1.00 0.00 H new ATOM 0 HG3 LYS A 112 10.272 -22.157 7.266 1.00 0.00 H new ATOM 0 HD2 LYS A 112 11.663 -20.214 6.762 1.00 0.00 H new ATOM 0 HD3 LYS A 112 12.700 -21.585 7.104 1.00 0.00 H new ATOM 0 HE2 LYS A 112 13.119 -21.934 4.697 1.00 0.00 H new ATOM 0 HE3 LYS A 112 11.970 -20.679 4.278 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 14.229 -19.866 4.176 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 13.374 -19.055 5.399 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 14.488 -20.270 5.805 1.00 0.00 H new ATOM 1789 N ILE A 113 9.282 -26.120 7.484 1.00 0.00 N ATOM 1790 CA ILE A 113 8.622 -26.582 8.723 1.00 0.00 C ATOM 1791 C ILE A 113 9.589 -26.410 9.905 1.00 0.00 C ATOM 1792 O ILE A 113 10.741 -26.853 9.837 1.00 0.00 O ATOM 1793 CB ILE A 113 8.163 -28.088 8.601 1.00 0.00 C ATOM 1794 CG1 ILE A 113 7.015 -28.221 7.547 1.00 0.00 C ATOM 1795 CG2 ILE A 113 7.710 -28.678 9.974 1.00 0.00 C ATOM 1796 CD1 ILE A 113 6.670 -29.652 7.161 1.00 0.00 C ATOM 0 H ILE A 113 9.785 -26.855 6.986 1.00 0.00 H new ATOM 0 HA ILE A 113 7.729 -25.980 8.890 1.00 0.00 H new ATOM 0 HB ILE A 113 9.026 -28.665 8.269 1.00 0.00 H new ATOM 0 HG12 ILE A 113 6.120 -27.740 7.942 1.00 0.00 H new ATOM 0 HG13 ILE A 113 7.301 -27.675 6.648 1.00 0.00 H new ATOM 0 HG21 ILE A 113 7.403 -29.715 9.841 1.00 0.00 H new ATOM 0 HG22 ILE A 113 8.539 -28.632 10.681 1.00 0.00 H new ATOM 0 HG23 ILE A 113 6.871 -28.098 10.360 1.00 0.00 H new ATOM 0 HD11 ILE A 113 5.865 -29.647 6.427 1.00 0.00 H new ATOM 0 HD12 ILE A 113 7.548 -30.135 6.733 1.00 0.00 H new ATOM 0 HD13 ILE A 113 6.350 -30.201 8.047 1.00 0.00 H new ATOM 1808 N GLY A 114 9.107 -25.729 10.960 1.00 0.00 N ATOM 1809 CA GLY A 114 9.886 -25.490 12.187 1.00 0.00 C ATOM 1810 C GLY A 114 10.288 -26.786 12.899 1.00 0.00 C ATOM 1811 O GLY A 114 11.427 -27.240 12.759 1.00 0.00 O ATOM 0 H GLY A 114 8.169 -25.330 10.986 1.00 0.00 H new ATOM 0 HA2 GLY A 114 10.784 -24.925 11.937 1.00 0.00 H new ATOM 0 HA3 GLY A 114 9.301 -24.873 12.869 1.00 0.00 H new ATOM 1815 N GLU A 115 9.353 -27.357 13.678 1.00 0.00 N ATOM 1816 CA GLU A 115 9.467 -28.730 14.212 1.00 0.00 C ATOM 1817 C GLU A 115 8.062 -29.239 14.621 1.00 0.00 C ATOM 1818 O GLU A 115 7.094 -28.459 14.588 1.00 0.00 O ATOM 1819 CB GLU A 115 10.488 -28.818 15.409 1.00 0.00 C ATOM 1820 CG GLU A 115 9.978 -28.343 16.788 1.00 0.00 C ATOM 1821 CD GLU A 115 9.837 -26.821 16.916 1.00 0.00 C ATOM 1822 OE1 GLU A 115 10.867 -26.117 16.822 1.00 0.00 O ATOM 1823 OE2 GLU A 115 8.715 -26.319 17.138 1.00 0.00 O ATOM 0 H GLU A 115 8.495 -26.881 13.957 1.00 0.00 H new ATOM 0 HA GLU A 115 9.865 -29.375 13.428 1.00 0.00 H new ATOM 0 HB2 GLU A 115 10.813 -29.854 15.504 1.00 0.00 H new ATOM 0 HB3 GLU A 115 11.368 -28.230 15.150 1.00 0.00 H new ATOM 0 HG2 GLU A 115 9.010 -28.804 16.983 1.00 0.00 H new ATOM 0 HG3 GLU A 115 10.662 -28.699 17.558 1.00 0.00 H new ATOM 1830 N PRO A 116 7.901 -30.561 14.983 1.00 0.00 N ATOM 1831 CA PRO A 116 6.661 -31.054 15.632 1.00 0.00 C ATOM 1832 C PRO A 116 6.416 -30.413 17.016 1.00 0.00 C ATOM 1833 O PRO A 116 7.334 -30.338 17.845 1.00 0.00 O ATOM 1834 CB PRO A 116 6.899 -32.589 15.747 1.00 0.00 C ATOM 1835 CG PRO A 116 8.384 -32.748 15.697 1.00 0.00 C ATOM 1836 CD PRO A 116 8.855 -31.688 14.731 1.00 0.00 C ATOM 0 HA PRO A 116 5.769 -30.798 15.060 1.00 0.00 H new ATOM 0 HB2 PRO A 116 6.490 -32.985 16.677 1.00 0.00 H new ATOM 0 HB3 PRO A 116 6.416 -33.127 14.931 1.00 0.00 H new ATOM 0 HG2 PRO A 116 8.830 -32.611 16.682 1.00 0.00 H new ATOM 0 HG3 PRO A 116 8.663 -33.745 15.357 1.00 0.00 H new ATOM 0 HD2 PRO A 116 9.887 -31.395 14.924 1.00 0.00 H new ATOM 0 HD3 PRO A 116 8.809 -32.033 13.698 1.00 0.00 H new ATOM 1844 N ARG A 117 5.181 -29.923 17.244 1.00 0.00 N ATOM 1845 CA ARG A 117 4.741 -29.416 18.554 1.00 0.00 C ATOM 1846 C ARG A 117 3.556 -30.256 19.072 1.00 0.00 C ATOM 1847 O ARG A 117 2.669 -30.655 18.304 1.00 0.00 O ATOM 1848 CB ARG A 117 4.343 -27.915 18.475 1.00 0.00 C ATOM 1849 CG ARG A 117 5.480 -26.969 18.022 1.00 0.00 C ATOM 1850 CD ARG A 117 5.029 -25.502 17.991 1.00 0.00 C ATOM 1851 NE ARG A 117 6.122 -24.573 17.634 1.00 0.00 N ATOM 1852 CZ ARG A 117 6.040 -23.230 17.679 1.00 0.00 C ATOM 1853 NH1 ARG A 117 4.908 -22.621 18.018 1.00 0.00 N ATOM 1854 NH2 ARG A 117 7.093 -22.501 17.362 1.00 0.00 N ATOM 0 H ARG A 117 4.462 -29.869 16.523 1.00 0.00 H new ATOM 0 HA ARG A 117 5.575 -29.504 19.250 1.00 0.00 H new ATOM 0 HB2 ARG A 117 3.505 -27.811 17.785 1.00 0.00 H new ATOM 0 HB3 ARG A 117 3.991 -27.594 19.455 1.00 0.00 H new ATOM 0 HG2 ARG A 117 6.329 -27.073 18.698 1.00 0.00 H new ATOM 0 HG3 ARG A 117 5.824 -27.264 17.030 1.00 0.00 H new ATOM 0 HD2 ARG A 117 4.216 -25.392 17.273 1.00 0.00 H new ATOM 0 HD3 ARG A 117 4.631 -25.229 18.968 1.00 0.00 H new ATOM 0 HE ARG A 117 7.006 -24.981 17.330 1.00 0.00 H new ATOM 0 HH11 ARG A 117 4.082 -23.172 18.250 1.00 0.00 H new ATOM 0 HH12 ARG A 117 4.866 -21.602 18.046 1.00 0.00 H new ATOM 0 HH21 ARG A 117 7.963 -22.955 17.085 1.00 0.00 H new ATOM 0 HH22 ARG A 117 7.037 -21.483 17.394 1.00 0.00 H new ATOM 1868 N ILE A 118 3.570 -30.543 20.382 1.00 0.00 N ATOM 1869 CA ILE A 118 2.493 -31.258 21.082 1.00 0.00 C ATOM 1870 C ILE A 118 1.979 -30.364 22.212 1.00 0.00 C ATOM 1871 O ILE A 118 2.779 -29.775 22.944 1.00 0.00 O ATOM 1872 CB ILE A 118 2.988 -32.649 21.651 1.00 0.00 C ATOM 1873 CG1 ILE A 118 3.458 -33.589 20.496 1.00 0.00 C ATOM 1874 CG2 ILE A 118 1.895 -33.339 22.507 1.00 0.00 C ATOM 1875 CD1 ILE A 118 2.369 -33.964 19.503 1.00 0.00 C ATOM 0 H ILE A 118 4.342 -30.281 20.994 1.00 0.00 H new ATOM 0 HA ILE A 118 1.690 -31.475 20.378 1.00 0.00 H new ATOM 0 HB ILE A 118 3.840 -32.449 22.301 1.00 0.00 H new ATOM 0 HG12 ILE A 118 4.271 -33.102 19.957 1.00 0.00 H new ATOM 0 HG13 ILE A 118 3.865 -34.502 20.931 1.00 0.00 H new ATOM 0 HG21 ILE A 118 2.272 -34.291 22.880 1.00 0.00 H new ATOM 0 HG22 ILE A 118 1.633 -32.698 23.349 1.00 0.00 H new ATOM 0 HG23 ILE A 118 1.010 -33.514 21.895 1.00 0.00 H new ATOM 0 HD11 ILE A 118 2.785 -34.618 18.737 1.00 0.00 H new ATOM 0 HD12 ILE A 118 1.564 -34.482 20.024 1.00 0.00 H new ATOM 0 HD13 ILE A 118 1.976 -33.061 19.035 1.00 0.00 H new ATOM 1887 N VAL A 119 0.646 -30.273 22.345 1.00 0.00 N ATOM 1888 CA VAL A 119 -0.006 -29.402 23.347 1.00 0.00 C ATOM 1889 C VAL A 119 0.262 -29.922 24.780 1.00 0.00 C ATOM 1890 O VAL A 119 0.644 -29.157 25.660 1.00 0.00 O ATOM 1891 CB VAL A 119 -1.557 -29.284 23.092 1.00 0.00 C ATOM 1892 CG1 VAL A 119 -2.233 -28.317 24.102 1.00 0.00 C ATOM 1893 CG2 VAL A 119 -1.842 -28.854 21.630 1.00 0.00 C ATOM 0 H VAL A 119 -0.011 -30.797 21.766 1.00 0.00 H new ATOM 0 HA VAL A 119 0.427 -28.407 23.246 1.00 0.00 H new ATOM 0 HB VAL A 119 -1.993 -30.271 23.249 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -3.302 -28.262 23.894 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -2.079 -28.685 25.116 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -1.793 -27.324 24.005 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -2.918 -28.779 21.476 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -1.380 -27.886 21.439 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -1.429 -29.595 20.946 1.00 0.00 H new