USER MOD reduce.3.24.130724 H: found=0, std=0, add=1038, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1029 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 9 HIS : no HE2:sc= 0 X(o=0,f=-0.29) USER MOD Set 1.2: A 11 HIS : no HD1:sc= 0 X(o=0,f=0.039) USER MOD Set 2.1: A 8 HIS : no HD1:sc= -0.417 X(o=-0.65,f=-0.53) USER MOD Set 2.2: A 10 HIS : no HD1:sc= -0.231 X(o=-0.65,f=-0.53) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -162:sc= -0.0578 (180deg=-0.384) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 HIS : no HE2:sc= 0.142 K(o=0.14,f=-1.1) USER MOD Single : A 12 HIS : no HD1:sc= 0 X(o=0,f=-0.049) USER MOD Single : A 13 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 16 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 MET CE :methyl -178:sc= 0 (180deg=-0.0106) USER MOD Single : A 28 ASN : amide:sc= -1.92! X(o=-1.9!,f=-1.8) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 ASN : amide:sc= -0.632 X(o=-0.63,f=-0.2) USER MOD Single : A 35 ASN : amide:sc= -1.08 K(o=-1.1,f=-3) USER MOD Single : A 37 HIS : no HD1:sc= -0.658 K(o=-0.66,f=-0.11) USER MOD Single : A 40 LYS NZ :NH3+ 148:sc= 0.605 (180deg=0.178) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 ASN : amide:sc= -1.24! K(o=-1.2!,f=-0.04) USER MOD Single : A 50 LYS NZ :NH3+ -171:sc= -0.0243 (180deg=-0.114) USER MOD Single : A 52 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 ASN : amide:sc= -0.652! X(o=-0.65!,f=-0.5) USER MOD Single : A 54 LYS NZ :NH3+ -144:sc= 1.19 (180deg=-0.187) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 64 SER OG : rot -156:sc= -0.628 USER MOD Single : A 67 SER OG : rot 180:sc= 0.0578 USER MOD Single : A 69 SER OG : rot 180:sc= -0.229 USER MOD Single : A 75 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 SER OG : rot 150:sc= 0.0431 USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 83 SER OG : rot 76:sc= 0.0825 USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 93 ASN : amide:sc= 0.326 K(o=0.33,f=-5.3!) USER MOD Single : A 95 LYS NZ :NH3+ 147:sc= 0.221 (180deg=-0.551) USER MOD Single : A 101 SER OG : rot 95:sc= 0.0691 USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 104 ASN : amide:sc= -0.0226 K(o=-0.023,f=-2.4!) USER MOD Single : A 110 LYS NZ :NH3+ -165:sc= 0 (180deg=-0.158) USER MOD Single : A 112 TYR OH : rot 70:sc= 0 USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 119 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 125 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00161) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.961 -15.451 8.109 1.00 0.00 N ATOM 2 CA MET A 1 0.640 -15.767 7.549 1.00 0.00 C ATOM 3 C MET A 1 -0.372 -15.684 8.680 1.00 0.00 C ATOM 4 O MET A 1 -0.199 -16.337 9.709 1.00 0.00 O ATOM 5 CB MET A 1 0.613 -17.157 6.891 1.00 0.00 C ATOM 6 CG MET A 1 1.547 -17.222 5.680 1.00 0.00 C ATOM 7 SD MET A 1 1.737 -18.855 4.927 1.00 0.00 S ATOM 8 CE MET A 1 0.430 -18.745 3.675 1.00 0.00 C ATOM 0 H1 MET A 1 2.613 -15.200 7.339 1.00 0.00 H new ATOM 0 H2 MET A 1 1.877 -14.650 8.766 1.00 0.00 H new ATOM 0 H3 MET A 1 2.329 -16.279 8.619 1.00 0.00 H new ATOM 0 HA MET A 1 0.397 -15.052 6.763 1.00 0.00 H new ATOM 0 HB2 MET A 1 0.908 -17.912 7.620 1.00 0.00 H new ATOM 0 HB3 MET A 1 -0.405 -17.394 6.580 1.00 0.00 H new ATOM 0 HG2 MET A 1 1.177 -16.532 4.921 1.00 0.00 H new ATOM 0 HG3 MET A 1 2.531 -16.865 5.983 1.00 0.00 H new ATOM 0 HE1 MET A 1 0.395 -19.672 3.103 1.00 0.00 H new ATOM 0 HE2 MET A 1 -0.530 -18.584 4.165 1.00 0.00 H new ATOM 0 HE3 MET A 1 0.639 -17.912 3.003 1.00 0.00 H new ATOM 18 N GLY A 2 -1.410 -14.865 8.521 1.00 0.00 N ATOM 19 CA GLY A 2 -2.605 -14.952 9.343 1.00 0.00 C ATOM 20 C GLY A 2 -3.501 -16.073 8.821 1.00 0.00 C ATOM 21 O GLY A 2 -3.162 -16.762 7.856 1.00 0.00 O ATOM 0 H GLY A 2 -1.442 -14.126 7.819 1.00 0.00 H new ATOM 0 HA2 GLY A 2 -2.332 -15.143 10.381 1.00 0.00 H new ATOM 0 HA3 GLY A 2 -3.142 -14.004 9.324 1.00 0.00 H new ATOM 25 N SER A 3 -4.640 -16.287 9.469 1.00 0.00 N ATOM 26 CA SER A 3 -5.628 -17.238 8.984 1.00 0.00 C ATOM 27 C SER A 3 -6.417 -16.630 7.823 1.00 0.00 C ATOM 28 O SER A 3 -6.557 -17.258 6.771 1.00 0.00 O ATOM 29 CB SER A 3 -6.566 -17.650 10.119 1.00 0.00 C ATOM 30 OG SER A 3 -5.848 -17.954 11.305 1.00 0.00 O ATOM 0 H SER A 3 -4.901 -15.813 10.333 1.00 0.00 H new ATOM 0 HA SER A 3 -5.115 -18.129 8.623 1.00 0.00 H new ATOM 0 HB2 SER A 3 -7.274 -16.845 10.317 1.00 0.00 H new ATOM 0 HB3 SER A 3 -7.149 -18.519 9.813 1.00 0.00 H new ATOM 0 HG SER A 3 -6.477 -18.212 12.011 1.00 0.00 H new ATOM 36 N ASP A 4 -6.950 -15.424 8.027 1.00 0.00 N ATOM 37 CA ASP A 4 -7.989 -14.825 7.196 1.00 0.00 C ATOM 38 C ASP A 4 -8.157 -13.346 7.545 1.00 0.00 C ATOM 39 O ASP A 4 -8.317 -12.997 8.718 1.00 0.00 O ATOM 40 CB ASP A 4 -9.337 -15.555 7.400 1.00 0.00 C ATOM 41 CG ASP A 4 -9.966 -15.371 8.786 1.00 0.00 C ATOM 42 OD1 ASP A 4 -9.333 -15.722 9.809 1.00 0.00 O ATOM 43 OD2 ASP A 4 -11.098 -14.841 8.875 1.00 0.00 O ATOM 0 H ASP A 4 -6.660 -14.822 8.798 1.00 0.00 H new ATOM 0 HA ASP A 4 -7.687 -14.920 6.153 1.00 0.00 H new ATOM 0 HB2 ASP A 4 -10.042 -15.203 6.647 1.00 0.00 H new ATOM 0 HB3 ASP A 4 -9.187 -16.620 7.223 1.00 0.00 H new ATOM 48 N LYS A 5 -8.140 -12.472 6.537 1.00 0.00 N ATOM 49 CA LYS A 5 -8.943 -11.249 6.511 1.00 0.00 C ATOM 50 C LYS A 5 -8.975 -10.714 5.083 1.00 0.00 C ATOM 51 O LYS A 5 -8.058 -10.989 4.299 1.00 0.00 O ATOM 52 CB LYS A 5 -8.417 -10.179 7.499 1.00 0.00 C ATOM 53 CG LYS A 5 -9.588 -9.517 8.260 1.00 0.00 C ATOM 54 CD LYS A 5 -9.241 -8.982 9.658 1.00 0.00 C ATOM 55 CE LYS A 5 -8.809 -10.137 10.573 1.00 0.00 C ATOM 56 NZ LYS A 5 -8.811 -9.791 12.009 1.00 0.00 N ATOM 0 H LYS A 5 -7.561 -12.595 5.706 1.00 0.00 H new ATOM 0 HA LYS A 5 -9.955 -11.489 6.838 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -7.729 -10.639 8.209 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -7.854 -9.420 6.955 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -9.972 -8.693 7.658 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -10.395 -10.244 8.357 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -8.440 -8.246 9.586 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -10.105 -8.473 10.086 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -9.475 -10.985 10.412 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -7.808 -10.460 10.288 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -8.510 -10.616 12.565 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -8.155 -9.002 12.177 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -9.770 -9.511 12.297 1.00 0.00 H new ATOM 70 N ILE A 6 -9.972 -9.902 4.743 1.00 0.00 N ATOM 71 CA ILE A 6 -10.013 -9.162 3.489 1.00 0.00 C ATOM 72 C ILE A 6 -10.059 -7.689 3.877 1.00 0.00 C ATOM 73 O ILE A 6 -11.112 -7.148 4.217 1.00 0.00 O ATOM 74 CB ILE A 6 -11.143 -9.658 2.553 1.00 0.00 C ATOM 75 CG1 ILE A 6 -10.926 -11.158 2.230 1.00 0.00 C ATOM 76 CG2 ILE A 6 -11.143 -8.826 1.257 1.00 0.00 C ATOM 77 CD1 ILE A 6 -11.920 -11.751 1.227 1.00 0.00 C ATOM 0 H ILE A 6 -10.783 -9.739 5.339 1.00 0.00 H new ATOM 0 HA ILE A 6 -9.130 -9.329 2.872 1.00 0.00 H new ATOM 0 HB ILE A 6 -12.107 -9.539 3.047 1.00 0.00 H new ATOM 0 HG12 ILE A 6 -9.917 -11.289 1.840 1.00 0.00 H new ATOM 0 HG13 ILE A 6 -10.985 -11.727 3.158 1.00 0.00 H new ATOM 0 HG21 ILE A 6 -11.939 -9.176 0.600 1.00 0.00 H new ATOM 0 HG22 ILE A 6 -11.308 -7.776 1.499 1.00 0.00 H new ATOM 0 HG23 ILE A 6 -10.182 -8.936 0.754 1.00 0.00 H new ATOM 0 HD11 ILE A 6 -11.689 -12.804 1.064 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -12.932 -11.659 1.620 1.00 0.00 H new ATOM 0 HD13 ILE A 6 -11.847 -11.213 0.282 1.00 0.00 H new ATOM 89 N HIS A 7 -8.886 -7.058 3.898 1.00 0.00 N ATOM 90 CA HIS A 7 -8.761 -5.605 3.908 1.00 0.00 C ATOM 91 C HIS A 7 -9.031 -5.069 2.497 1.00 0.00 C ATOM 92 O HIS A 7 -9.093 -5.861 1.549 1.00 0.00 O ATOM 93 CB HIS A 7 -7.350 -5.236 4.375 1.00 0.00 C ATOM 94 CG HIS A 7 -6.238 -5.754 3.492 1.00 0.00 C ATOM 95 ND1 HIS A 7 -5.754 -5.146 2.352 1.00 0.00 N ATOM 96 CD2 HIS A 7 -5.441 -6.837 3.755 1.00 0.00 C ATOM 97 CE1 HIS A 7 -4.680 -5.844 1.943 1.00 0.00 C ATOM 98 NE2 HIS A 7 -4.442 -6.875 2.775 1.00 0.00 N ATOM 0 H HIS A 7 -7.990 -7.546 3.909 1.00 0.00 H new ATOM 0 HA HIS A 7 -9.485 -5.160 4.591 1.00 0.00 H new ATOM 0 HB2 HIS A 7 -7.273 -4.150 4.434 1.00 0.00 H new ATOM 0 HB3 HIS A 7 -7.204 -5.621 5.384 1.00 0.00 H new ATOM 0 HD1 HIS A 7 -6.141 -4.317 1.901 1.00 0.00 H new ATOM 0 HD2 HIS A 7 -5.562 -7.535 4.570 1.00 0.00 H new ATOM 0 HE1 HIS A 7 -4.091 -5.610 1.069 1.00 0.00 H new ATOM 106 N HIS A 8 -9.128 -3.742 2.345 1.00 0.00 N ATOM 107 CA HIS A 8 -9.440 -3.142 1.055 1.00 0.00 C ATOM 108 C HIS A 8 -8.397 -3.524 0.003 1.00 0.00 C ATOM 109 O HIS A 8 -7.184 -3.475 0.253 1.00 0.00 O ATOM 110 CB HIS A 8 -9.602 -1.607 1.130 1.00 0.00 C ATOM 111 CG HIS A 8 -10.922 -1.126 0.568 1.00 0.00 C ATOM 112 ND1 HIS A 8 -11.717 -0.113 1.067 1.00 0.00 N ATOM 113 CD2 HIS A 8 -11.556 -1.625 -0.539 1.00 0.00 C ATOM 114 CE1 HIS A 8 -12.817 -0.037 0.294 1.00 0.00 C ATOM 115 NE2 HIS A 8 -12.775 -0.958 -0.683 1.00 0.00 N ATOM 0 H HIS A 8 -8.994 -3.071 3.101 1.00 0.00 H new ATOM 0 HA HIS A 8 -10.406 -3.547 0.754 1.00 0.00 H new ATOM 0 HB2 HIS A 8 -9.517 -1.288 2.169 1.00 0.00 H new ATOM 0 HB3 HIS A 8 -8.786 -1.133 0.584 1.00 0.00 H new ATOM 0 HD2 HIS A 8 -11.178 -2.401 -1.189 1.00 0.00 H new ATOM 0 HE1 HIS A 8 -13.622 0.668 0.440 1.00 0.00 H new ATOM 0 HE2 HIS A 8 -13.490 -1.135 -1.389 1.00 0.00 H new ATOM 123 N HIS A 9 -8.888 -3.869 -1.181 1.00 0.00 N ATOM 124 CA HIS A 9 -8.149 -3.892 -2.425 1.00 0.00 C ATOM 125 C HIS A 9 -8.548 -2.622 -3.175 1.00 0.00 C ATOM 126 O HIS A 9 -9.736 -2.321 -3.272 1.00 0.00 O ATOM 127 CB HIS A 9 -8.510 -5.177 -3.175 1.00 0.00 C ATOM 128 CG HIS A 9 -7.492 -5.561 -4.210 1.00 0.00 C ATOM 129 ND1 HIS A 9 -6.256 -6.117 -3.959 1.00 0.00 N ATOM 130 CD2 HIS A 9 -7.624 -5.420 -5.562 1.00 0.00 C ATOM 131 CE1 HIS A 9 -5.656 -6.331 -5.142 1.00 0.00 C ATOM 132 NE2 HIS A 9 -6.440 -5.888 -6.142 1.00 0.00 N ATOM 0 H HIS A 9 -9.860 -4.153 -1.299 1.00 0.00 H new ATOM 0 HA HIS A 9 -7.067 -3.900 -2.295 1.00 0.00 H new ATOM 0 HB2 HIS A 9 -8.616 -5.991 -2.458 1.00 0.00 H new ATOM 0 HB3 HIS A 9 -9.479 -5.049 -3.657 1.00 0.00 H new ATOM 0 HD1 HIS A 9 -5.867 -6.328 -3.040 1.00 0.00 H new ATOM 0 HD2 HIS A 9 -8.481 -5.022 -6.085 1.00 0.00 H new ATOM 0 HE1 HIS A 9 -4.687 -6.791 -5.271 1.00 0.00 H new ATOM 140 N HIS A 10 -7.569 -1.840 -3.624 1.00 0.00 N ATOM 141 CA HIS A 10 -7.754 -0.529 -4.230 1.00 0.00 C ATOM 142 C HIS A 10 -6.618 -0.330 -5.231 1.00 0.00 C ATOM 143 O HIS A 10 -5.503 -0.002 -4.827 1.00 0.00 O ATOM 144 CB HIS A 10 -7.732 0.580 -3.154 1.00 0.00 C ATOM 145 CG HIS A 10 -9.063 0.960 -2.546 1.00 0.00 C ATOM 146 ND1 HIS A 10 -10.316 0.618 -2.998 1.00 0.00 N ATOM 147 CD2 HIS A 10 -9.235 1.855 -1.526 1.00 0.00 C ATOM 148 CE1 HIS A 10 -11.218 1.309 -2.281 1.00 0.00 C ATOM 149 NE2 HIS A 10 -10.605 2.069 -1.358 1.00 0.00 N ATOM 0 H HIS A 10 -6.588 -2.115 -3.572 1.00 0.00 H new ATOM 0 HA HIS A 10 -8.721 -0.472 -4.729 1.00 0.00 H new ATOM 0 HB2 HIS A 10 -7.069 0.261 -2.350 1.00 0.00 H new ATOM 0 HB3 HIS A 10 -7.291 1.474 -3.595 1.00 0.00 H new ATOM 0 HD2 HIS A 10 -8.447 2.317 -0.950 1.00 0.00 H new ATOM 0 HE1 HIS A 10 -12.287 1.260 -2.426 1.00 0.00 H new ATOM 0 HE2 HIS A 10 -11.050 2.679 -0.673 1.00 0.00 H new ATOM 157 N HIS A 11 -6.886 -0.540 -6.521 1.00 0.00 N ATOM 158 CA HIS A 11 -5.919 -0.282 -7.581 1.00 0.00 C ATOM 159 C HIS A 11 -5.629 1.218 -7.633 1.00 0.00 C ATOM 160 O HIS A 11 -6.474 1.980 -8.111 1.00 0.00 O ATOM 161 CB HIS A 11 -6.468 -0.768 -8.933 1.00 0.00 C ATOM 162 CG HIS A 11 -6.284 -2.232 -9.218 1.00 0.00 C ATOM 163 ND1 HIS A 11 -5.906 -3.213 -8.331 1.00 0.00 N ATOM 164 CD2 HIS A 11 -6.395 -2.805 -10.454 1.00 0.00 C ATOM 165 CE1 HIS A 11 -5.777 -4.358 -9.020 1.00 0.00 C ATOM 166 NE2 HIS A 11 -6.078 -4.161 -10.320 1.00 0.00 N ATOM 0 H HIS A 11 -7.782 -0.894 -6.857 1.00 0.00 H new ATOM 0 HA HIS A 11 -4.996 -0.824 -7.374 1.00 0.00 H new ATOM 0 HB2 HIS A 11 -7.533 -0.538 -8.977 1.00 0.00 H new ATOM 0 HB3 HIS A 11 -5.986 -0.198 -9.727 1.00 0.00 H new ATOM 0 HD2 HIS A 11 -6.676 -2.302 -11.368 1.00 0.00 H new ATOM 0 HE1 HIS A 11 -5.475 -5.303 -8.594 1.00 0.00 H new ATOM 0 HE2 HIS A 11 -6.075 -4.863 -11.060 1.00 0.00 H new ATOM 174 N HIS A 12 -4.487 1.654 -7.112 1.00 0.00 N ATOM 175 CA HIS A 12 -3.908 2.959 -7.374 1.00 0.00 C ATOM 176 C HIS A 12 -2.388 2.836 -7.227 1.00 0.00 C ATOM 177 O HIS A 12 -1.879 2.700 -6.114 1.00 0.00 O ATOM 178 CB HIS A 12 -4.498 4.039 -6.454 1.00 0.00 C ATOM 179 CG HIS A 12 -4.165 5.416 -6.963 1.00 0.00 C ATOM 180 ND1 HIS A 12 -4.683 5.993 -8.102 1.00 0.00 N ATOM 181 CD2 HIS A 12 -3.238 6.277 -6.441 1.00 0.00 C ATOM 182 CE1 HIS A 12 -4.077 7.179 -8.268 1.00 0.00 C ATOM 183 NE2 HIS A 12 -3.169 7.387 -7.296 1.00 0.00 N ATOM 0 H HIS A 12 -3.924 1.088 -6.476 1.00 0.00 H new ATOM 0 HA HIS A 12 -4.150 3.279 -8.387 1.00 0.00 H new ATOM 0 HB2 HIS A 12 -5.580 3.920 -6.394 1.00 0.00 H new ATOM 0 HB3 HIS A 12 -4.107 3.916 -5.444 1.00 0.00 H new ATOM 0 HD2 HIS A 12 -2.665 6.129 -5.537 1.00 0.00 H new ATOM 0 HE1 HIS A 12 -4.288 7.871 -9.070 1.00 0.00 H new ATOM 0 HE2 HIS A 12 -2.552 8.193 -7.200 1.00 0.00 H new ATOM 191 N MET A 13 -1.681 2.816 -8.359 1.00 0.00 N ATOM 192 CA MET A 13 -0.245 2.551 -8.471 1.00 0.00 C ATOM 193 C MET A 13 0.634 3.444 -7.588 1.00 0.00 C ATOM 194 O MET A 13 0.237 4.537 -7.172 1.00 0.00 O ATOM 195 CB MET A 13 0.189 2.711 -9.937 1.00 0.00 C ATOM 196 CG MET A 13 -0.105 4.119 -10.478 1.00 0.00 C ATOM 197 SD MET A 13 0.362 4.374 -12.203 1.00 0.00 S ATOM 198 CE MET A 13 -0.333 6.029 -12.440 1.00 0.00 C ATOM 0 H MET A 13 -2.115 2.992 -9.265 1.00 0.00 H new ATOM 0 HA MET A 13 -0.098 1.531 -8.117 1.00 0.00 H new ATOM 0 HB2 MET A 13 1.256 2.506 -10.023 1.00 0.00 H new ATOM 0 HB3 MET A 13 -0.328 1.973 -10.550 1.00 0.00 H new ATOM 0 HG2 MET A 13 -1.171 4.320 -10.370 1.00 0.00 H new ATOM 0 HG3 MET A 13 0.421 4.848 -9.861 1.00 0.00 H new ATOM 0 HE1 MET A 13 -0.142 6.361 -13.460 1.00 0.00 H new ATOM 0 HE2 MET A 13 -1.408 6.001 -12.263 1.00 0.00 H new ATOM 0 HE3 MET A 13 0.132 6.723 -11.739 1.00 0.00 H new ATOM 208 N PHE A 14 1.885 3.018 -7.422 1.00 0.00 N ATOM 209 CA PHE A 14 2.987 3.687 -6.733 1.00 0.00 C ATOM 210 C PHE A 14 4.188 3.750 -7.700 1.00 0.00 C ATOM 211 O PHE A 14 4.124 3.128 -8.767 1.00 0.00 O ATOM 212 CB PHE A 14 3.281 2.887 -5.454 1.00 0.00 C ATOM 213 CG PHE A 14 2.278 3.119 -4.337 1.00 0.00 C ATOM 214 CD1 PHE A 14 1.042 2.445 -4.338 1.00 0.00 C ATOM 215 CD2 PHE A 14 2.569 4.029 -3.302 1.00 0.00 C ATOM 216 CE1 PHE A 14 0.091 2.704 -3.337 1.00 0.00 C ATOM 217 CE2 PHE A 14 1.613 4.294 -2.303 1.00 0.00 C ATOM 218 CZ PHE A 14 0.368 3.641 -2.327 1.00 0.00 C ATOM 0 H PHE A 14 2.179 2.117 -7.799 1.00 0.00 H new ATOM 0 HA PHE A 14 2.751 4.711 -6.443 1.00 0.00 H new ATOM 0 HB2 PHE A 14 3.299 1.825 -5.698 1.00 0.00 H new ATOM 0 HB3 PHE A 14 4.276 3.148 -5.095 1.00 0.00 H new ATOM 0 HD1 PHE A 14 0.824 1.725 -5.113 1.00 0.00 H new ATOM 0 HD2 PHE A 14 3.528 4.525 -3.275 1.00 0.00 H new ATOM 0 HE1 PHE A 14 -0.855 2.182 -3.344 1.00 0.00 H new ATOM 0 HE2 PHE A 14 1.836 5.000 -1.517 1.00 0.00 H new ATOM 0 HZ PHE A 14 -0.373 3.859 -1.572 1.00 0.00 H new ATOM 228 N PRO A 15 5.266 4.503 -7.413 1.00 0.00 N ATOM 229 CA PRO A 15 6.371 4.677 -8.351 1.00 0.00 C ATOM 230 C PRO A 15 7.384 3.528 -8.231 1.00 0.00 C ATOM 231 O PRO A 15 8.222 3.498 -7.327 1.00 0.00 O ATOM 232 CB PRO A 15 6.964 6.034 -7.992 1.00 0.00 C ATOM 233 CG PRO A 15 6.764 6.124 -6.482 1.00 0.00 C ATOM 234 CD PRO A 15 5.450 5.375 -6.257 1.00 0.00 C ATOM 0 HA PRO A 15 6.053 4.651 -9.393 1.00 0.00 H new ATOM 0 HB2 PRO A 15 8.018 6.095 -8.261 1.00 0.00 H new ATOM 0 HB3 PRO A 15 6.455 6.845 -8.513 1.00 0.00 H new ATOM 0 HG2 PRO A 15 7.588 5.662 -5.939 1.00 0.00 H new ATOM 0 HG3 PRO A 15 6.700 7.159 -6.145 1.00 0.00 H new ATOM 0 HD2 PRO A 15 5.488 4.794 -5.335 1.00 0.00 H new ATOM 0 HD3 PRO A 15 4.618 6.072 -6.161 1.00 0.00 H new ATOM 242 N TYR A 16 7.310 2.545 -9.129 1.00 0.00 N ATOM 243 CA TYR A 16 8.194 1.386 -9.101 1.00 0.00 C ATOM 244 C TYR A 16 8.315 0.776 -10.502 1.00 0.00 C ATOM 245 O TYR A 16 7.476 1.045 -11.365 1.00 0.00 O ATOM 246 CB TYR A 16 7.630 0.386 -8.073 1.00 0.00 C ATOM 247 CG TYR A 16 6.333 -0.292 -8.471 1.00 0.00 C ATOM 248 CD1 TYR A 16 6.360 -1.449 -9.270 1.00 0.00 C ATOM 249 CD2 TYR A 16 5.108 0.188 -7.976 1.00 0.00 C ATOM 250 CE1 TYR A 16 5.168 -2.137 -9.558 1.00 0.00 C ATOM 251 CE2 TYR A 16 3.911 -0.508 -8.237 1.00 0.00 C ATOM 252 CZ TYR A 16 3.942 -1.690 -9.013 1.00 0.00 C ATOM 253 OH TYR A 16 2.814 -2.433 -9.178 1.00 0.00 O ATOM 0 H TYR A 16 6.636 2.532 -9.894 1.00 0.00 H new ATOM 0 HA TYR A 16 9.202 1.670 -8.801 1.00 0.00 H new ATOM 0 HB2 TYR A 16 8.381 -0.383 -7.889 1.00 0.00 H new ATOM 0 HB3 TYR A 16 7.472 0.910 -7.130 1.00 0.00 H new ATOM 0 HD1 TYR A 16 7.299 -1.810 -9.663 1.00 0.00 H new ATOM 0 HD2 TYR A 16 5.084 1.096 -7.392 1.00 0.00 H new ATOM 0 HE1 TYR A 16 5.189 -3.008 -10.196 1.00 0.00 H new ATOM 0 HE2 TYR A 16 2.974 -0.140 -7.846 1.00 0.00 H new ATOM 0 HH TYR A 16 2.060 -1.984 -8.741 1.00 0.00 H new ATOM 263 N LYS A 17 9.304 -0.098 -10.720 1.00 0.00 N ATOM 264 CA LYS A 17 9.383 -1.017 -11.859 1.00 0.00 C ATOM 265 C LYS A 17 9.565 -2.448 -11.333 1.00 0.00 C ATOM 266 O LYS A 17 9.793 -2.657 -10.140 1.00 0.00 O ATOM 267 CB LYS A 17 10.462 -0.584 -12.886 1.00 0.00 C ATOM 268 CG LYS A 17 11.910 -0.836 -12.437 1.00 0.00 C ATOM 269 CD LYS A 17 12.972 -0.924 -13.543 1.00 0.00 C ATOM 270 CE LYS A 17 13.505 0.469 -13.872 1.00 0.00 C ATOM 271 NZ LYS A 17 14.364 0.502 -15.075 1.00 0.00 N ATOM 0 H LYS A 17 10.098 -0.187 -10.086 1.00 0.00 H new ATOM 0 HA LYS A 17 8.450 -0.985 -12.421 1.00 0.00 H new ATOM 0 HB2 LYS A 17 10.288 -1.115 -13.822 1.00 0.00 H new ATOM 0 HB3 LYS A 17 10.340 0.479 -13.095 1.00 0.00 H new ATOM 0 HG2 LYS A 17 12.197 -0.038 -11.753 1.00 0.00 H new ATOM 0 HG3 LYS A 17 11.933 -1.766 -11.869 1.00 0.00 H new ATOM 0 HD2 LYS A 17 13.790 -1.568 -13.221 1.00 0.00 H new ATOM 0 HD3 LYS A 17 12.541 -1.377 -14.436 1.00 0.00 H new ATOM 0 HE2 LYS A 17 12.664 1.147 -14.017 1.00 0.00 H new ATOM 0 HE3 LYS A 17 14.072 0.843 -13.020 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 14.691 1.475 -15.241 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 15.185 -0.120 -14.932 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 13.820 0.174 -15.899 1.00 0.00 H new ATOM 285 N ILE A 18 9.523 -3.435 -12.221 1.00 0.00 N ATOM 286 CA ILE A 18 9.670 -4.861 -11.928 1.00 0.00 C ATOM 287 C ILE A 18 10.669 -5.378 -12.948 1.00 0.00 C ATOM 288 O ILE A 18 10.408 -5.274 -14.149 1.00 0.00 O ATOM 289 CB ILE A 18 8.289 -5.555 -12.048 1.00 0.00 C ATOM 290 CG1 ILE A 18 7.411 -5.173 -10.837 1.00 0.00 C ATOM 291 CG2 ILE A 18 8.314 -7.091 -12.208 1.00 0.00 C ATOM 292 CD1 ILE A 18 5.990 -5.733 -10.930 1.00 0.00 C ATOM 0 H ILE A 18 9.378 -3.256 -13.215 1.00 0.00 H new ATOM 0 HA ILE A 18 10.025 -5.060 -10.917 1.00 0.00 H new ATOM 0 HB ILE A 18 7.871 -5.185 -12.984 1.00 0.00 H new ATOM 0 HG12 ILE A 18 7.881 -5.539 -9.924 1.00 0.00 H new ATOM 0 HG13 ILE A 18 7.363 -4.087 -10.758 1.00 0.00 H new ATOM 0 HG21 ILE A 18 7.293 -7.466 -12.282 1.00 0.00 H new ATOM 0 HG22 ILE A 18 8.864 -7.354 -13.112 1.00 0.00 H new ATOM 0 HG23 ILE A 18 8.803 -7.539 -11.343 1.00 0.00 H new ATOM 0 HD11 ILE A 18 5.422 -5.431 -10.050 1.00 0.00 H new ATOM 0 HD12 ILE A 18 5.505 -5.347 -11.826 1.00 0.00 H new ATOM 0 HD13 ILE A 18 6.030 -6.821 -10.980 1.00 0.00 H new ATOM 304 N VAL A 19 11.805 -5.914 -12.509 1.00 0.00 N ATOM 305 CA VAL A 19 12.729 -6.618 -13.355 1.00 0.00 C ATOM 306 C VAL A 19 12.776 -8.091 -12.912 1.00 0.00 C ATOM 307 O VAL A 19 11.878 -8.564 -12.208 1.00 0.00 O ATOM 308 CB VAL A 19 14.053 -5.836 -13.400 1.00 0.00 C ATOM 309 CG1 VAL A 19 13.849 -4.372 -13.837 1.00 0.00 C ATOM 310 CG2 VAL A 19 14.897 -5.842 -12.126 1.00 0.00 C ATOM 0 H VAL A 19 12.103 -5.863 -11.535 1.00 0.00 H new ATOM 0 HA VAL A 19 12.423 -6.669 -14.400 1.00 0.00 H new ATOM 0 HB VAL A 19 14.619 -6.398 -14.144 1.00 0.00 H new ATOM 0 HG11 VAL A 19 14.811 -3.860 -13.854 1.00 0.00 H new ATOM 0 HG12 VAL A 19 13.407 -4.348 -14.833 1.00 0.00 H new ATOM 0 HG13 VAL A 19 13.184 -3.872 -13.133 1.00 0.00 H new ATOM 0 HG21 VAL A 19 15.803 -5.257 -12.287 1.00 0.00 H new ATOM 0 HG22 VAL A 19 14.324 -5.406 -11.308 1.00 0.00 H new ATOM 0 HG23 VAL A 19 15.168 -6.867 -11.874 1.00 0.00 H new ATOM 320 N ASP A 20 13.779 -8.820 -13.391 1.00 0.00 N ATOM 321 CA ASP A 20 13.805 -10.255 -13.682 1.00 0.00 C ATOM 322 C ASP A 20 13.211 -11.146 -12.605 1.00 0.00 C ATOM 323 O ASP A 20 12.459 -12.069 -12.923 1.00 0.00 O ATOM 324 CB ASP A 20 15.245 -10.661 -14.008 1.00 0.00 C ATOM 325 CG ASP A 20 15.648 -10.146 -15.387 1.00 0.00 C ATOM 326 OD1 ASP A 20 15.431 -8.941 -15.665 1.00 0.00 O ATOM 327 OD2 ASP A 20 16.165 -10.937 -16.208 1.00 0.00 O ATOM 0 H ASP A 20 14.676 -8.385 -13.606 1.00 0.00 H new ATOM 0 HA ASP A 20 13.150 -10.413 -14.539 1.00 0.00 H new ATOM 0 HB2 ASP A 20 15.921 -10.261 -13.252 1.00 0.00 H new ATOM 0 HB3 ASP A 20 15.339 -11.747 -13.977 1.00 0.00 H new ATOM 332 N ASP A 21 13.518 -10.887 -11.338 1.00 0.00 N ATOM 333 CA ASP A 21 12.687 -11.302 -10.208 1.00 0.00 C ATOM 334 C ASP A 21 12.822 -10.326 -9.034 1.00 0.00 C ATOM 335 O ASP A 21 12.460 -10.642 -7.900 1.00 0.00 O ATOM 336 CB ASP A 21 12.926 -12.782 -9.845 1.00 0.00 C ATOM 337 CG ASP A 21 13.782 -13.080 -8.611 1.00 0.00 C ATOM 338 OD1 ASP A 21 14.943 -12.631 -8.486 1.00 0.00 O ATOM 339 OD2 ASP A 21 13.307 -13.883 -7.771 1.00 0.00 O ATOM 0 H ASP A 21 14.358 -10.379 -11.062 1.00 0.00 H new ATOM 0 HA ASP A 21 11.639 -11.252 -10.504 1.00 0.00 H new ATOM 0 HB2 ASP A 21 11.954 -13.254 -9.701 1.00 0.00 H new ATOM 0 HB3 ASP A 21 13.392 -13.267 -10.702 1.00 0.00 H new ATOM 344 N VAL A 22 13.299 -9.112 -9.325 1.00 0.00 N ATOM 345 CA VAL A 22 13.627 -8.105 -8.335 1.00 0.00 C ATOM 346 C VAL A 22 12.809 -6.855 -8.627 1.00 0.00 C ATOM 347 O VAL A 22 12.897 -6.285 -9.719 1.00 0.00 O ATOM 348 CB VAL A 22 15.142 -7.816 -8.293 1.00 0.00 C ATOM 349 CG1 VAL A 22 15.409 -6.921 -7.076 1.00 0.00 C ATOM 350 CG2 VAL A 22 16.013 -9.086 -8.279 1.00 0.00 C ATOM 0 H VAL A 22 13.469 -8.803 -10.282 1.00 0.00 H new ATOM 0 HA VAL A 22 13.371 -8.473 -7.341 1.00 0.00 H new ATOM 0 HB VAL A 22 15.430 -7.307 -9.213 1.00 0.00 H new ATOM 0 HG11 VAL A 22 16.474 -6.697 -7.016 1.00 0.00 H new ATOM 0 HG12 VAL A 22 14.848 -5.992 -7.177 1.00 0.00 H new ATOM 0 HG13 VAL A 22 15.095 -7.437 -6.169 1.00 0.00 H new ATOM 0 HG21 VAL A 22 17.066 -8.805 -8.249 1.00 0.00 H new ATOM 0 HG22 VAL A 22 15.772 -9.683 -7.399 1.00 0.00 H new ATOM 0 HG23 VAL A 22 15.819 -9.670 -9.178 1.00 0.00 H new ATOM 360 N VAL A 23 12.000 -6.448 -7.655 1.00 0.00 N ATOM 361 CA VAL A 23 11.196 -5.240 -7.728 1.00 0.00 C ATOM 362 C VAL A 23 12.132 -4.051 -7.513 1.00 0.00 C ATOM 363 O VAL A 23 13.047 -4.132 -6.689 1.00 0.00 O ATOM 364 CB VAL A 23 10.111 -5.311 -6.640 1.00 0.00 C ATOM 365 CG1 VAL A 23 9.193 -4.085 -6.682 1.00 0.00 C ATOM 366 CG2 VAL A 23 9.268 -6.591 -6.762 1.00 0.00 C ATOM 0 H VAL A 23 11.885 -6.959 -6.780 1.00 0.00 H new ATOM 0 HA VAL A 23 10.701 -5.133 -8.693 1.00 0.00 H new ATOM 0 HB VAL A 23 10.631 -5.327 -5.682 1.00 0.00 H new ATOM 0 HG11 VAL A 23 8.438 -4.168 -5.900 1.00 0.00 H new ATOM 0 HG12 VAL A 23 9.783 -3.183 -6.522 1.00 0.00 H new ATOM 0 HG13 VAL A 23 8.703 -4.030 -7.654 1.00 0.00 H new ATOM 0 HG21 VAL A 23 8.512 -6.605 -5.977 1.00 0.00 H new ATOM 0 HG22 VAL A 23 8.779 -6.613 -7.736 1.00 0.00 H new ATOM 0 HG23 VAL A 23 9.914 -7.463 -6.660 1.00 0.00 H new ATOM 376 N ILE A 24 11.900 -2.933 -8.199 1.00 0.00 N ATOM 377 CA ILE A 24 12.656 -1.705 -8.009 1.00 0.00 C ATOM 378 C ILE A 24 11.653 -0.648 -7.566 1.00 0.00 C ATOM 379 O ILE A 24 10.851 -0.172 -8.366 1.00 0.00 O ATOM 380 CB ILE A 24 13.407 -1.280 -9.284 1.00 0.00 C ATOM 381 CG1 ILE A 24 14.068 -2.392 -10.124 1.00 0.00 C ATOM 382 CG2 ILE A 24 14.452 -0.223 -8.917 1.00 0.00 C ATOM 383 CD1 ILE A 24 14.907 -3.397 -9.359 1.00 0.00 C ATOM 0 H ILE A 24 11.172 -2.858 -8.910 1.00 0.00 H new ATOM 0 HA ILE A 24 13.433 -1.847 -7.258 1.00 0.00 H new ATOM 0 HB ILE A 24 12.626 -0.896 -9.940 1.00 0.00 H new ATOM 0 HG12 ILE A 24 13.284 -2.933 -10.655 1.00 0.00 H new ATOM 0 HG13 ILE A 24 14.699 -1.923 -10.879 1.00 0.00 H new ATOM 0 HG21 ILE A 24 14.989 0.084 -9.814 1.00 0.00 H new ATOM 0 HG22 ILE A 24 13.956 0.642 -8.477 1.00 0.00 H new ATOM 0 HG23 ILE A 24 15.156 -0.642 -8.198 1.00 0.00 H new ATOM 0 HD11 ILE A 24 15.320 -4.129 -10.053 1.00 0.00 H new ATOM 0 HD12 ILE A 24 15.721 -2.880 -8.851 1.00 0.00 H new ATOM 0 HD13 ILE A 24 14.284 -3.905 -8.623 1.00 0.00 H new ATOM 395 N LEU A 25 11.651 -0.319 -6.282 1.00 0.00 N ATOM 396 CA LEU A 25 10.803 0.713 -5.704 1.00 0.00 C ATOM 397 C LEU A 25 11.589 2.017 -5.908 1.00 0.00 C ATOM 398 O LEU A 25 12.771 2.080 -5.541 1.00 0.00 O ATOM 399 CB LEU A 25 10.549 0.382 -4.217 1.00 0.00 C ATOM 400 CG LEU A 25 10.020 -1.057 -3.989 1.00 0.00 C ATOM 401 CD1 LEU A 25 10.060 -1.435 -2.512 1.00 0.00 C ATOM 402 CD2 LEU A 25 8.601 -1.278 -4.511 1.00 0.00 C ATOM 0 H LEU A 25 12.254 -0.774 -5.597 1.00 0.00 H new ATOM 0 HA LEU A 25 9.817 0.792 -6.163 1.00 0.00 H new ATOM 0 HB2 LEU A 25 11.477 0.513 -3.660 1.00 0.00 H new ATOM 0 HB3 LEU A 25 9.830 1.094 -3.811 1.00 0.00 H new ATOM 0 HG LEU A 25 10.690 -1.697 -4.562 1.00 0.00 H new ATOM 0 HD11 LEU A 25 9.683 -2.450 -2.386 1.00 0.00 H new ATOM 0 HD12 LEU A 25 11.087 -1.382 -2.151 1.00 0.00 H new ATOM 0 HD13 LEU A 25 9.439 -0.743 -1.943 1.00 0.00 H new ATOM 0 HD21 LEU A 25 8.298 -2.307 -4.317 1.00 0.00 H new ATOM 0 HD22 LEU A 25 7.917 -0.597 -4.005 1.00 0.00 H new ATOM 0 HD23 LEU A 25 8.574 -1.088 -5.584 1.00 0.00 H new ATOM 414 N MET A 26 10.995 3.025 -6.551 1.00 0.00 N ATOM 415 CA MET A 26 11.708 4.209 -7.033 1.00 0.00 C ATOM 416 C MET A 26 11.008 5.464 -6.496 1.00 0.00 C ATOM 417 O MET A 26 10.288 6.120 -7.250 1.00 0.00 O ATOM 418 CB MET A 26 11.812 4.191 -8.570 1.00 0.00 C ATOM 419 CG MET A 26 12.559 2.959 -9.094 1.00 0.00 C ATOM 420 SD MET A 26 13.050 3.000 -10.843 1.00 0.00 S ATOM 421 CE MET A 26 11.428 3.160 -11.640 1.00 0.00 C ATOM 0 H MET A 26 9.995 3.042 -6.753 1.00 0.00 H new ATOM 0 HA MET A 26 12.732 4.212 -6.661 1.00 0.00 H new ATOM 0 HB2 MET A 26 10.810 4.214 -8.999 1.00 0.00 H new ATOM 0 HB3 MET A 26 12.324 5.093 -8.907 1.00 0.00 H new ATOM 0 HG2 MET A 26 13.456 2.820 -8.490 1.00 0.00 H new ATOM 0 HG3 MET A 26 11.929 2.084 -8.936 1.00 0.00 H new ATOM 0 HE1 MET A 26 11.553 3.163 -12.723 1.00 0.00 H new ATOM 0 HE2 MET A 26 10.796 2.321 -11.350 1.00 0.00 H new ATOM 0 HE3 MET A 26 10.959 4.093 -11.327 1.00 0.00 H new ATOM 431 N PRO A 27 11.199 5.808 -5.209 1.00 0.00 N ATOM 432 CA PRO A 27 10.443 6.860 -4.535 1.00 0.00 C ATOM 433 C PRO A 27 10.671 8.213 -5.208 1.00 0.00 C ATOM 434 O PRO A 27 11.763 8.488 -5.700 1.00 0.00 O ATOM 435 CB PRO A 27 10.958 6.863 -3.088 1.00 0.00 C ATOM 436 CG PRO A 27 12.380 6.323 -3.231 1.00 0.00 C ATOM 437 CD PRO A 27 12.196 5.259 -4.306 1.00 0.00 C ATOM 0 HA PRO A 27 9.369 6.681 -4.578 1.00 0.00 H new ATOM 0 HB2 PRO A 27 10.947 7.864 -2.657 1.00 0.00 H new ATOM 0 HB3 PRO A 27 10.349 6.231 -2.441 1.00 0.00 H new ATOM 0 HG2 PRO A 27 13.084 7.097 -3.537 1.00 0.00 H new ATOM 0 HG3 PRO A 27 12.755 5.902 -2.298 1.00 0.00 H new ATOM 0 HD2 PRO A 27 13.132 5.057 -4.827 1.00 0.00 H new ATOM 0 HD3 PRO A 27 11.862 4.315 -3.875 1.00 0.00 H new ATOM 445 N ASN A 28 9.657 9.082 -5.180 1.00 0.00 N ATOM 446 CA ASN A 28 9.762 10.442 -5.708 1.00 0.00 C ATOM 447 C ASN A 28 9.130 11.453 -4.754 1.00 0.00 C ATOM 448 O ASN A 28 9.846 12.036 -3.949 1.00 0.00 O ATOM 449 CB ASN A 28 9.296 10.563 -7.178 1.00 0.00 C ATOM 450 CG ASN A 28 8.215 9.603 -7.661 1.00 0.00 C ATOM 451 OD1 ASN A 28 8.487 8.700 -8.438 1.00 0.00 O ATOM 452 ND2 ASN A 28 6.958 9.740 -7.279 1.00 0.00 N ATOM 0 H ASN A 28 8.741 8.861 -4.790 1.00 0.00 H new ATOM 0 HA ASN A 28 10.821 10.697 -5.756 1.00 0.00 H new ATOM 0 HB2 ASN A 28 8.935 11.580 -7.332 1.00 0.00 H new ATOM 0 HB3 ASN A 28 10.169 10.434 -7.818 1.00 0.00 H new ATOM 0 HD21 ASN A 28 6.245 9.101 -7.632 1.00 0.00 H new ATOM 0 HD22 ASN A 28 6.700 10.484 -6.631 1.00 0.00 H new ATOM 459 N LYS A 29 7.815 11.686 -4.822 1.00 0.00 N ATOM 460 CA LYS A 29 7.087 12.678 -4.016 1.00 0.00 C ATOM 461 C LYS A 29 5.912 11.988 -3.301 1.00 0.00 C ATOM 462 O LYS A 29 4.822 12.542 -3.142 1.00 0.00 O ATOM 463 CB LYS A 29 6.669 13.896 -4.880 1.00 0.00 C ATOM 464 CG LYS A 29 7.727 15.006 -5.012 1.00 0.00 C ATOM 465 CD LYS A 29 8.912 14.755 -5.957 1.00 0.00 C ATOM 466 CE LYS A 29 8.532 14.422 -7.403 1.00 0.00 C ATOM 467 NZ LYS A 29 7.892 15.556 -8.100 1.00 0.00 N ATOM 0 H LYS A 29 7.206 11.174 -5.460 1.00 0.00 H new ATOM 0 HA LYS A 29 7.737 13.086 -3.242 1.00 0.00 H new ATOM 0 HB2 LYS A 29 6.413 13.541 -5.878 1.00 0.00 H new ATOM 0 HB3 LYS A 29 5.764 14.329 -4.454 1.00 0.00 H new ATOM 0 HG2 LYS A 29 7.221 15.914 -5.342 1.00 0.00 H new ATOM 0 HG3 LYS A 29 8.127 15.207 -4.018 1.00 0.00 H new ATOM 0 HD2 LYS A 29 9.548 15.640 -5.960 1.00 0.00 H new ATOM 0 HD3 LYS A 29 9.508 13.935 -5.557 1.00 0.00 H new ATOM 0 HE2 LYS A 29 9.426 14.123 -7.950 1.00 0.00 H new ATOM 0 HE3 LYS A 29 7.854 13.568 -7.409 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 7.656 15.276 -9.073 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 7.023 15.827 -7.597 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 8.546 16.364 -8.121 1.00 0.00 H new ATOM 481 N GLU A 30 6.106 10.734 -2.893 1.00 0.00 N ATOM 482 CA GLU A 30 5.090 9.917 -2.220 1.00 0.00 C ATOM 483 C GLU A 30 5.408 9.695 -0.736 1.00 0.00 C ATOM 484 O GLU A 30 4.507 9.371 0.033 1.00 0.00 O ATOM 485 CB GLU A 30 4.927 8.577 -2.930 1.00 0.00 C ATOM 486 CG GLU A 30 6.281 7.870 -3.042 1.00 0.00 C ATOM 487 CD GLU A 30 6.259 6.358 -2.786 1.00 0.00 C ATOM 488 OE1 GLU A 30 5.361 5.869 -2.059 1.00 0.00 O ATOM 489 OE2 GLU A 30 7.218 5.710 -3.250 1.00 0.00 O ATOM 0 H GLU A 30 6.992 10.245 -3.023 1.00 0.00 H new ATOM 0 HA GLU A 30 4.152 10.469 -2.271 1.00 0.00 H new ATOM 0 HB2 GLU A 30 4.225 7.949 -2.381 1.00 0.00 H new ATOM 0 HB3 GLU A 30 4.506 8.732 -3.923 1.00 0.00 H new ATOM 0 HG2 GLU A 30 6.682 8.046 -4.040 1.00 0.00 H new ATOM 0 HG3 GLU A 30 6.971 8.331 -2.335 1.00 0.00 H new ATOM 496 N LEU A 31 6.668 9.885 -0.329 1.00 0.00 N ATOM 497 CA LEU A 31 7.141 9.727 1.040 1.00 0.00 C ATOM 498 C LEU A 31 6.596 10.918 1.828 1.00 0.00 C ATOM 499 O LEU A 31 7.207 11.989 1.813 1.00 0.00 O ATOM 500 CB LEU A 31 8.683 9.652 1.051 1.00 0.00 C ATOM 501 CG LEU A 31 9.276 8.232 0.967 1.00 0.00 C ATOM 502 CD1 LEU A 31 8.748 7.408 -0.210 1.00 0.00 C ATOM 503 CD2 LEU A 31 10.801 8.321 0.864 1.00 0.00 C ATOM 0 H LEU A 31 7.409 10.163 -0.972 1.00 0.00 H new ATOM 0 HA LEU A 31 6.791 8.803 1.499 1.00 0.00 H new ATOM 0 HB2 LEU A 31 9.064 10.237 0.214 1.00 0.00 H new ATOM 0 HB3 LEU A 31 9.046 10.126 1.963 1.00 0.00 H new ATOM 0 HG LEU A 31 8.966 7.718 1.877 1.00 0.00 H new ATOM 0 HD11 LEU A 31 9.212 6.422 -0.201 1.00 0.00 H new ATOM 0 HD12 LEU A 31 7.667 7.301 -0.123 1.00 0.00 H new ATOM 0 HD13 LEU A 31 8.989 7.914 -1.145 1.00 0.00 H new ATOM 0 HD21 LEU A 31 11.221 7.317 0.805 1.00 0.00 H new ATOM 0 HD22 LEU A 31 11.073 8.882 -0.030 1.00 0.00 H new ATOM 0 HD23 LEU A 31 11.196 8.828 1.744 1.00 0.00 H new ATOM 515 N ASN A 32 5.405 10.769 2.411 1.00 0.00 N ATOM 516 CA ASN A 32 4.581 11.872 2.917 1.00 0.00 C ATOM 517 C ASN A 32 4.064 11.563 4.329 1.00 0.00 C ATOM 518 O ASN A 32 3.015 12.076 4.728 1.00 0.00 O ATOM 519 CB ASN A 32 3.436 12.178 1.923 1.00 0.00 C ATOM 520 CG ASN A 32 3.941 12.687 0.576 1.00 0.00 C ATOM 521 OD1 ASN A 32 4.729 13.623 0.505 1.00 0.00 O ATOM 522 ND2 ASN A 32 3.545 12.077 -0.527 1.00 0.00 N ATOM 0 H ASN A 32 4.974 9.855 2.549 1.00 0.00 H new ATOM 0 HA ASN A 32 5.194 12.770 2.998 1.00 0.00 H new ATOM 0 HB2 ASN A 32 2.846 11.275 1.767 1.00 0.00 H new ATOM 0 HB3 ASN A 32 2.770 12.922 2.361 1.00 0.00 H new ATOM 0 HD21 ASN A 32 3.895 12.385 -1.434 1.00 0.00 H new ATOM 0 HD22 ASN A 32 2.889 11.298 -0.471 1.00 0.00 H new ATOM 529 N ILE A 33 4.780 10.724 5.084 1.00 0.00 N ATOM 530 CA ILE A 33 4.448 10.142 6.388 1.00 0.00 C ATOM 531 C ILE A 33 3.258 9.201 6.347 1.00 0.00 C ATOM 532 O ILE A 33 3.380 8.078 6.828 1.00 0.00 O ATOM 533 CB ILE A 33 4.333 11.198 7.516 1.00 0.00 C ATOM 534 CG1 ILE A 33 5.767 11.654 7.848 1.00 0.00 C ATOM 535 CG2 ILE A 33 3.595 10.641 8.756 1.00 0.00 C ATOM 536 CD1 ILE A 33 5.839 12.519 9.105 1.00 0.00 C ATOM 0 H ILE A 33 5.695 10.405 4.766 1.00 0.00 H new ATOM 0 HA ILE A 33 5.306 9.520 6.644 1.00 0.00 H new ATOM 0 HB ILE A 33 3.733 12.046 7.187 1.00 0.00 H new ATOM 0 HG12 ILE A 33 6.401 10.777 7.980 1.00 0.00 H new ATOM 0 HG13 ILE A 33 6.169 12.214 7.004 1.00 0.00 H new ATOM 0 HG21 ILE A 33 3.537 11.414 9.522 1.00 0.00 H new ATOM 0 HG22 ILE A 33 2.588 10.334 8.473 1.00 0.00 H new ATOM 0 HG23 ILE A 33 4.139 9.782 9.148 1.00 0.00 H new ATOM 0 HD11 ILE A 33 6.874 12.810 9.288 1.00 0.00 H new ATOM 0 HD12 ILE A 33 5.230 13.412 8.967 1.00 0.00 H new ATOM 0 HD13 ILE A 33 5.465 11.953 9.958 1.00 0.00 H new ATOM 548 N GLU A 34 2.099 9.611 5.841 1.00 0.00 N ATOM 549 CA GLU A 34 0.941 8.731 5.932 1.00 0.00 C ATOM 550 C GLU A 34 1.175 7.490 5.074 1.00 0.00 C ATOM 551 O GLU A 34 0.805 6.387 5.462 1.00 0.00 O ATOM 552 CB GLU A 34 -0.347 9.450 5.548 1.00 0.00 C ATOM 553 CG GLU A 34 -0.570 10.719 6.375 1.00 0.00 C ATOM 554 CD GLU A 34 -2.020 11.162 6.211 1.00 0.00 C ATOM 555 OE1 GLU A 34 -2.323 11.888 5.247 1.00 0.00 O ATOM 556 OE2 GLU A 34 -2.891 10.693 6.992 1.00 0.00 O ATOM 0 H GLU A 34 1.939 10.508 5.382 1.00 0.00 H new ATOM 0 HA GLU A 34 0.819 8.420 6.970 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -0.315 9.709 4.490 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -1.192 8.776 5.685 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -0.350 10.529 7.425 1.00 0.00 H new ATOM 0 HG3 GLU A 34 0.106 11.508 6.045 1.00 0.00 H new ATOM 563 N ASN A 35 1.905 7.639 3.965 1.00 0.00 N ATOM 564 CA ASN A 35 2.275 6.513 3.111 1.00 0.00 C ATOM 565 C ASN A 35 3.304 5.620 3.820 1.00 0.00 C ATOM 566 O ASN A 35 3.598 4.567 3.278 1.00 0.00 O ATOM 567 CB ASN A 35 2.772 6.970 1.727 1.00 0.00 C ATOM 568 CG ASN A 35 4.284 7.026 1.659 1.00 0.00 C ATOM 569 OD1 ASN A 35 4.958 7.567 2.535 1.00 0.00 O ATOM 570 ND2 ASN A 35 4.846 6.323 0.696 1.00 0.00 N ATOM 0 H ASN A 35 2.253 8.540 3.637 1.00 0.00 H new ATOM 0 HA ASN A 35 1.377 5.922 2.932 1.00 0.00 H new ATOM 0 HB2 ASN A 35 2.400 6.287 0.964 1.00 0.00 H new ATOM 0 HB3 ASN A 35 2.362 7.954 1.501 1.00 0.00 H new ATOM 0 HD21 ASN A 35 5.860 6.218 0.666 1.00 0.00 H new ATOM 0 HD22 ASN A 35 4.267 5.884 -0.019 1.00 0.00 H new ATOM 577 N ALA A 36 3.861 5.999 4.979 1.00 0.00 N ATOM 578 CA ALA A 36 5.005 5.346 5.596 1.00 0.00 C ATOM 579 C ALA A 36 4.627 4.013 6.214 1.00 0.00 C ATOM 580 O ALA A 36 5.095 2.994 5.727 1.00 0.00 O ATOM 581 CB ALA A 36 5.679 6.242 6.632 1.00 0.00 C ATOM 0 H ALA A 36 3.513 6.790 5.521 1.00 0.00 H new ATOM 0 HA ALA A 36 5.722 5.156 4.797 1.00 0.00 H new ATOM 0 HB1 ALA A 36 6.528 5.717 7.069 1.00 0.00 H new ATOM 0 HB2 ALA A 36 6.026 7.157 6.151 1.00 0.00 H new ATOM 0 HB3 ALA A 36 4.965 6.493 7.416 1.00 0.00 H new ATOM 587 N HIS A 37 3.799 3.940 7.265 1.00 0.00 N ATOM 588 CA HIS A 37 3.437 2.606 7.770 1.00 0.00 C ATOM 589 C HIS A 37 2.565 1.852 6.755 1.00 0.00 C ATOM 590 O HIS A 37 2.448 0.628 6.832 1.00 0.00 O ATOM 591 CB HIS A 37 2.806 2.647 9.162 1.00 0.00 C ATOM 592 CG HIS A 37 1.376 3.119 9.212 1.00 0.00 C ATOM 593 ND1 HIS A 37 0.937 4.318 9.716 1.00 0.00 N ATOM 594 CD2 HIS A 37 0.277 2.404 8.823 1.00 0.00 C ATOM 595 CE1 HIS A 37 -0.402 4.344 9.597 1.00 0.00 C ATOM 596 NE2 HIS A 37 -0.853 3.175 9.101 1.00 0.00 N ATOM 0 H HIS A 37 3.388 4.733 7.757 1.00 0.00 H new ATOM 0 HA HIS A 37 4.365 2.047 7.888 1.00 0.00 H new ATOM 0 HB2 HIS A 37 2.856 1.648 9.594 1.00 0.00 H new ATOM 0 HB3 HIS A 37 3.408 3.298 9.796 1.00 0.00 H new ATOM 0 HD2 HIS A 37 0.282 1.419 8.380 1.00 0.00 H new ATOM 0 HE1 HIS A 37 -1.028 5.183 9.862 1.00 0.00 H new ATOM 0 HE2 HIS A 37 -1.827 2.907 8.957 1.00 0.00 H new ATOM 604 N LEU A 38 1.979 2.577 5.798 1.00 0.00 N ATOM 605 CA LEU A 38 1.280 2.055 4.634 1.00 0.00 C ATOM 606 C LEU A 38 2.251 1.584 3.540 1.00 0.00 C ATOM 607 O LEU A 38 1.827 0.945 2.585 1.00 0.00 O ATOM 608 CB LEU A 38 0.335 3.150 4.101 1.00 0.00 C ATOM 609 CG LEU A 38 -0.706 3.662 5.116 1.00 0.00 C ATOM 610 CD1 LEU A 38 -1.655 4.675 4.475 1.00 0.00 C ATOM 611 CD2 LEU A 38 -1.546 2.512 5.656 1.00 0.00 C ATOM 0 H LEU A 38 1.983 3.597 5.821 1.00 0.00 H new ATOM 0 HA LEU A 38 0.705 1.177 4.930 1.00 0.00 H new ATOM 0 HB2 LEU A 38 0.936 3.994 3.762 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -0.191 2.762 3.228 1.00 0.00 H new ATOM 0 HG LEU A 38 -0.150 4.137 5.925 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -2.377 5.017 5.217 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -1.083 5.526 4.106 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -2.182 4.205 3.645 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -2.274 2.897 6.370 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -2.068 2.025 4.833 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -0.898 1.790 6.152 1.00 0.00 H new ATOM 623 N PHE A 39 3.552 1.858 3.664 1.00 0.00 N ATOM 624 CA PHE A 39 4.546 1.659 2.616 1.00 0.00 C ATOM 625 C PHE A 39 4.710 0.173 2.419 1.00 0.00 C ATOM 626 O PHE A 39 4.411 -0.363 1.358 1.00 0.00 O ATOM 627 CB PHE A 39 5.885 2.307 3.004 1.00 0.00 C ATOM 628 CG PHE A 39 6.870 2.522 1.886 1.00 0.00 C ATOM 629 CD1 PHE A 39 6.547 3.451 0.886 1.00 0.00 C ATOM 630 CD2 PHE A 39 8.151 1.941 1.924 1.00 0.00 C ATOM 631 CE1 PHE A 39 7.518 3.886 -0.021 1.00 0.00 C ATOM 632 CE2 PHE A 39 9.108 2.316 0.959 1.00 0.00 C ATOM 633 CZ PHE A 39 8.799 3.304 -0.001 1.00 0.00 C ATOM 0 H PHE A 39 3.951 2.236 4.524 1.00 0.00 H new ATOM 0 HA PHE A 39 4.218 2.130 1.690 1.00 0.00 H new ATOM 0 HB2 PHE A 39 5.677 3.272 3.467 1.00 0.00 H new ATOM 0 HB3 PHE A 39 6.359 1.685 3.763 1.00 0.00 H new ATOM 0 HD1 PHE A 39 5.539 3.834 0.816 1.00 0.00 H new ATOM 0 HD2 PHE A 39 8.399 1.215 2.685 1.00 0.00 H new ATOM 0 HE1 PHE A 39 7.286 4.664 -0.733 1.00 0.00 H new ATOM 0 HE2 PHE A 39 10.080 1.846 0.954 1.00 0.00 H new ATOM 0 HZ PHE A 39 9.545 3.613 -0.719 1.00 0.00 H new ATOM 643 N LYS A 40 5.126 -0.524 3.481 1.00 0.00 N ATOM 644 CA LYS A 40 5.206 -1.953 3.449 1.00 0.00 C ATOM 645 C LYS A 40 3.847 -2.574 3.189 1.00 0.00 C ATOM 646 O LYS A 40 3.835 -3.609 2.562 1.00 0.00 O ATOM 647 CB LYS A 40 5.880 -2.454 4.739 1.00 0.00 C ATOM 648 CG LYS A 40 5.004 -3.067 5.843 1.00 0.00 C ATOM 649 CD LYS A 40 4.208 -2.032 6.632 1.00 0.00 C ATOM 650 CE LYS A 40 3.333 -2.752 7.661 1.00 0.00 C ATOM 651 NZ LYS A 40 2.677 -1.796 8.575 1.00 0.00 N ATOM 0 H LYS A 40 5.409 -0.103 4.366 1.00 0.00 H new ATOM 0 HA LYS A 40 5.829 -2.272 2.614 1.00 0.00 H new ATOM 0 HB2 LYS A 40 6.623 -3.200 4.455 1.00 0.00 H new ATOM 0 HB3 LYS A 40 6.422 -1.615 5.176 1.00 0.00 H new ATOM 0 HG2 LYS A 40 4.313 -3.780 5.394 1.00 0.00 H new ATOM 0 HG3 LYS A 40 5.638 -3.627 6.530 1.00 0.00 H new ATOM 0 HD2 LYS A 40 4.884 -1.339 7.132 1.00 0.00 H new ATOM 0 HD3 LYS A 40 3.587 -1.441 5.958 1.00 0.00 H new ATOM 0 HE2 LYS A 40 2.576 -3.343 7.146 1.00 0.00 H new ATOM 0 HE3 LYS A 40 3.944 -3.447 8.237 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 1.752 -2.172 8.865 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 3.273 -1.655 9.416 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 2.544 -0.886 8.089 1.00 0.00 H new ATOM 665 N LYS A 41 2.733 -2.001 3.653 1.00 0.00 N ATOM 666 CA LYS A 41 1.428 -2.626 3.510 1.00 0.00 C ATOM 667 C LYS A 41 1.105 -2.700 2.025 1.00 0.00 C ATOM 668 O LYS A 41 0.817 -3.792 1.539 1.00 0.00 O ATOM 669 CB LYS A 41 0.367 -1.822 4.272 1.00 0.00 C ATOM 670 CG LYS A 41 -0.285 -2.612 5.411 1.00 0.00 C ATOM 671 CD LYS A 41 -1.579 -1.900 5.809 1.00 0.00 C ATOM 672 CE LYS A 41 -2.316 -2.672 6.904 1.00 0.00 C ATOM 673 NZ LYS A 41 -3.761 -2.382 6.864 1.00 0.00 N ATOM 0 H LYS A 41 2.716 -1.101 4.132 1.00 0.00 H new ATOM 0 HA LYS A 41 1.435 -3.631 3.933 1.00 0.00 H new ATOM 0 HB2 LYS A 41 0.826 -0.921 4.679 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -0.405 -1.499 3.574 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -0.496 -3.633 5.093 1.00 0.00 H new ATOM 0 HG3 LYS A 41 0.391 -2.677 6.264 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -1.351 -0.893 6.160 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -2.224 -1.795 4.936 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -2.151 -3.742 6.775 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -1.913 -2.402 7.880 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -4.243 -2.916 7.615 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -3.915 -1.364 7.009 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -4.146 -2.662 5.939 1.00 0.00 H new ATOM 687 N TRP A 42 1.244 -1.579 1.317 1.00 0.00 N ATOM 688 CA TRP A 42 1.257 -1.545 -0.131 1.00 0.00 C ATOM 689 C TRP A 42 2.222 -2.610 -0.636 1.00 0.00 C ATOM 690 O TRP A 42 1.766 -3.536 -1.301 1.00 0.00 O ATOM 691 CB TRP A 42 1.575 -0.136 -0.657 1.00 0.00 C ATOM 692 CG TRP A 42 2.278 -0.085 -1.976 1.00 0.00 C ATOM 693 CD1 TRP A 42 1.815 -0.613 -3.124 1.00 0.00 C ATOM 694 CD2 TRP A 42 3.603 0.427 -2.288 1.00 0.00 C ATOM 695 NE1 TRP A 42 2.773 -0.518 -4.112 1.00 0.00 N ATOM 696 CE2 TRP A 42 3.911 0.109 -3.644 1.00 0.00 C ATOM 697 CE3 TRP A 42 4.580 1.110 -1.548 1.00 0.00 C ATOM 698 CZ2 TRP A 42 5.141 0.454 -4.227 1.00 0.00 C ATOM 699 CZ3 TRP A 42 5.805 1.474 -2.123 1.00 0.00 C ATOM 700 CH2 TRP A 42 6.085 1.163 -3.468 1.00 0.00 C ATOM 0 H TRP A 42 1.352 -0.660 1.747 1.00 0.00 H new ATOM 0 HA TRP A 42 0.265 -1.776 -0.520 1.00 0.00 H new ATOM 0 HB2 TRP A 42 0.642 0.421 -0.741 1.00 0.00 H new ATOM 0 HB3 TRP A 42 2.188 0.379 0.082 1.00 0.00 H new ATOM 0 HD1 TRP A 42 0.835 -1.048 -3.253 1.00 0.00 H new ATOM 0 HE1 TRP A 42 2.656 -0.865 -5.064 1.00 0.00 H new ATOM 0 HE3 TRP A 42 4.384 1.360 -0.516 1.00 0.00 H new ATOM 0 HZ2 TRP A 42 5.358 0.177 -5.248 1.00 0.00 H new ATOM 0 HZ3 TRP A 42 6.540 1.997 -1.530 1.00 0.00 H new ATOM 0 HH2 TRP A 42 7.021 1.468 -3.913 1.00 0.00 H new ATOM 711 N VAL A 43 3.527 -2.535 -0.327 1.00 0.00 N ATOM 712 CA VAL A 43 4.465 -3.363 -1.036 1.00 0.00 C ATOM 713 C VAL A 43 4.144 -4.858 -0.914 1.00 0.00 C ATOM 714 O VAL A 43 4.196 -5.637 -1.859 1.00 0.00 O ATOM 715 CB VAL A 43 5.887 -3.140 -0.534 1.00 0.00 C ATOM 716 CG1 VAL A 43 6.538 -1.816 -0.937 1.00 0.00 C ATOM 717 CG2 VAL A 43 6.571 -3.912 0.594 1.00 0.00 C ATOM 0 H VAL A 43 3.928 -1.926 0.386 1.00 0.00 H new ATOM 0 HA VAL A 43 4.382 -3.070 -2.083 1.00 0.00 H new ATOM 0 HB VAL A 43 6.132 -4.019 -1.130 1.00 0.00 H new ATOM 0 HG11 VAL A 43 7.546 -1.766 -0.525 1.00 0.00 H new ATOM 0 HG12 VAL A 43 6.586 -1.750 -2.024 1.00 0.00 H new ATOM 0 HG13 VAL A 43 5.946 -0.987 -0.549 1.00 0.00 H new ATOM 0 HG21 VAL A 43 7.584 -3.534 0.731 1.00 0.00 H new ATOM 0 HG22 VAL A 43 6.007 -3.782 1.518 1.00 0.00 H new ATOM 0 HG23 VAL A 43 6.610 -4.971 0.339 1.00 0.00 H new ATOM 727 N PHE A 44 3.867 -5.277 0.303 1.00 0.00 N ATOM 728 CA PHE A 44 3.485 -6.609 0.689 1.00 0.00 C ATOM 729 C PHE A 44 2.342 -7.084 -0.220 1.00 0.00 C ATOM 730 O PHE A 44 2.371 -8.204 -0.706 1.00 0.00 O ATOM 731 CB PHE A 44 3.034 -6.483 2.137 1.00 0.00 C ATOM 732 CG PHE A 44 4.043 -6.499 3.288 1.00 0.00 C ATOM 733 CD1 PHE A 44 5.403 -6.158 3.125 1.00 0.00 C ATOM 734 CD2 PHE A 44 3.568 -6.756 4.588 1.00 0.00 C ATOM 735 CE1 PHE A 44 6.271 -6.108 4.233 1.00 0.00 C ATOM 736 CE2 PHE A 44 4.430 -6.704 5.698 1.00 0.00 C ATOM 737 CZ PHE A 44 5.787 -6.384 5.523 1.00 0.00 C ATOM 0 H PHE A 44 3.908 -4.645 1.103 1.00 0.00 H new ATOM 0 HA PHE A 44 4.291 -7.337 0.594 1.00 0.00 H new ATOM 0 HB2 PHE A 44 2.476 -5.550 2.216 1.00 0.00 H new ATOM 0 HB3 PHE A 44 2.328 -7.293 2.322 1.00 0.00 H new ATOM 0 HD1 PHE A 44 5.782 -5.933 2.139 1.00 0.00 H new ATOM 0 HD2 PHE A 44 2.526 -6.997 4.735 1.00 0.00 H new ATOM 0 HE1 PHE A 44 7.312 -5.857 4.091 1.00 0.00 H new ATOM 0 HE2 PHE A 44 4.048 -6.910 6.687 1.00 0.00 H new ATOM 0 HZ PHE A 44 6.452 -6.350 6.373 1.00 0.00 H new ATOM 747 N ASP A 45 1.360 -6.222 -0.445 1.00 0.00 N ATOM 748 CA ASP A 45 0.128 -6.436 -1.206 1.00 0.00 C ATOM 749 C ASP A 45 0.288 -6.361 -2.725 1.00 0.00 C ATOM 750 O ASP A 45 -0.642 -6.743 -3.437 1.00 0.00 O ATOM 751 CB ASP A 45 -0.916 -5.409 -0.754 1.00 0.00 C ATOM 752 CG ASP A 45 -2.353 -5.820 -1.064 1.00 0.00 C ATOM 753 OD1 ASP A 45 -2.683 -7.019 -0.962 1.00 0.00 O ATOM 754 OD2 ASP A 45 -3.209 -4.916 -1.230 1.00 0.00 O ATOM 0 H ASP A 45 1.405 -5.274 -0.070 1.00 0.00 H new ATOM 0 HA ASP A 45 -0.185 -7.458 -0.995 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -0.816 -5.251 0.320 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -0.708 -4.455 -1.238 1.00 0.00 H new ATOM 759 N GLU A 46 1.442 -5.931 -3.242 1.00 0.00 N ATOM 760 CA GLU A 46 1.716 -5.875 -4.692 1.00 0.00 C ATOM 761 C GLU A 46 2.966 -6.659 -5.085 1.00 0.00 C ATOM 762 O GLU A 46 3.218 -6.848 -6.280 1.00 0.00 O ATOM 763 CB GLU A 46 1.808 -4.435 -5.228 1.00 0.00 C ATOM 764 CG GLU A 46 0.778 -3.515 -4.588 1.00 0.00 C ATOM 765 CD GLU A 46 0.382 -2.302 -5.429 1.00 0.00 C ATOM 766 OE1 GLU A 46 1.223 -1.731 -6.155 1.00 0.00 O ATOM 767 OE2 GLU A 46 -0.796 -1.889 -5.295 1.00 0.00 O ATOM 0 H GLU A 46 2.221 -5.609 -2.668 1.00 0.00 H new ATOM 0 HA GLU A 46 0.855 -6.352 -5.160 1.00 0.00 H new ATOM 0 HB2 GLU A 46 2.808 -4.043 -5.042 1.00 0.00 H new ATOM 0 HB3 GLU A 46 1.665 -4.442 -6.309 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -0.119 -4.095 -4.370 1.00 0.00 H new ATOM 0 HG3 GLU A 46 1.170 -3.164 -3.634 1.00 0.00 H new ATOM 774 N PHE A 47 3.746 -7.135 -4.107 1.00 0.00 N ATOM 775 CA PHE A 47 5.019 -7.785 -4.342 1.00 0.00 C ATOM 776 C PHE A 47 5.163 -9.030 -3.484 1.00 0.00 C ATOM 777 O PHE A 47 5.306 -10.121 -4.031 1.00 0.00 O ATOM 778 CB PHE A 47 6.152 -6.795 -4.085 1.00 0.00 C ATOM 779 CG PHE A 47 6.032 -5.536 -4.919 1.00 0.00 C ATOM 780 CD1 PHE A 47 6.100 -5.579 -6.324 1.00 0.00 C ATOM 781 CD2 PHE A 47 5.737 -4.322 -4.284 1.00 0.00 C ATOM 782 CE1 PHE A 47 5.914 -4.400 -7.064 1.00 0.00 C ATOM 783 CE2 PHE A 47 5.555 -3.148 -5.014 1.00 0.00 C ATOM 784 CZ PHE A 47 5.654 -3.188 -6.404 1.00 0.00 C ATOM 0 H PHE A 47 3.497 -7.073 -3.120 1.00 0.00 H new ATOM 0 HA PHE A 47 5.067 -8.107 -5.382 1.00 0.00 H new ATOM 0 HB2 PHE A 47 6.161 -6.526 -3.029 1.00 0.00 H new ATOM 0 HB3 PHE A 47 7.106 -7.278 -4.299 1.00 0.00 H new ATOM 0 HD1 PHE A 47 6.294 -6.513 -6.830 1.00 0.00 H new ATOM 0 HD2 PHE A 47 5.649 -4.295 -3.208 1.00 0.00 H new ATOM 0 HE1 PHE A 47 5.971 -4.425 -8.142 1.00 0.00 H new ATOM 0 HE2 PHE A 47 5.340 -2.218 -4.508 1.00 0.00 H new ATOM 0 HZ PHE A 47 5.530 -2.281 -6.977 1.00 0.00 H new ATOM 794 N LEU A 48 5.148 -8.899 -2.154 1.00 0.00 N ATOM 795 CA LEU A 48 5.508 -10.023 -1.290 1.00 0.00 C ATOM 796 C LEU A 48 4.473 -11.139 -1.388 1.00 0.00 C ATOM 797 O LEU A 48 4.822 -12.285 -1.650 1.00 0.00 O ATOM 798 CB LEU A 48 5.697 -9.600 0.172 1.00 0.00 C ATOM 799 CG LEU A 48 6.825 -8.577 0.425 1.00 0.00 C ATOM 800 CD1 LEU A 48 7.186 -8.571 1.912 1.00 0.00 C ATOM 801 CD2 LEU A 48 8.124 -8.822 -0.341 1.00 0.00 C ATOM 0 H LEU A 48 4.895 -8.042 -1.661 1.00 0.00 H new ATOM 0 HA LEU A 48 6.467 -10.397 -1.647 1.00 0.00 H new ATOM 0 HB2 LEU A 48 4.759 -9.179 0.535 1.00 0.00 H new ATOM 0 HB3 LEU A 48 5.897 -10.491 0.767 1.00 0.00 H new ATOM 0 HG LEU A 48 6.415 -7.631 0.071 1.00 0.00 H new ATOM 0 HD11 LEU A 48 7.983 -7.849 2.090 1.00 0.00 H new ATOM 0 HD12 LEU A 48 6.309 -8.296 2.498 1.00 0.00 H new ATOM 0 HD13 LEU A 48 7.524 -9.564 2.208 1.00 0.00 H new ATOM 0 HD21 LEU A 48 8.847 -8.046 -0.089 1.00 0.00 H new ATOM 0 HD22 LEU A 48 8.529 -9.797 -0.069 1.00 0.00 H new ATOM 0 HD23 LEU A 48 7.925 -8.798 -1.412 1.00 0.00 H new ATOM 813 N ASN A 49 3.201 -10.788 -1.201 1.00 0.00 N ATOM 814 CA ASN A 49 2.068 -11.682 -1.390 1.00 0.00 C ATOM 815 C ASN A 49 1.949 -12.091 -2.860 1.00 0.00 C ATOM 816 O ASN A 49 1.410 -13.161 -3.145 1.00 0.00 O ATOM 817 CB ASN A 49 0.750 -11.012 -0.963 1.00 0.00 C ATOM 818 CG ASN A 49 0.655 -10.648 0.513 1.00 0.00 C ATOM 819 OD1 ASN A 49 1.011 -11.420 1.394 1.00 0.00 O ATOM 820 ND2 ASN A 49 0.116 -9.478 0.833 1.00 0.00 N ATOM 0 H ASN A 49 2.927 -9.850 -0.907 1.00 0.00 H new ATOM 0 HA ASN A 49 2.243 -12.560 -0.769 1.00 0.00 H new ATOM 0 HB2 ASN A 49 0.614 -10.106 -1.554 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -0.075 -11.680 -1.210 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -0.002 -9.222 1.813 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -0.180 -8.835 0.099 1.00 0.00 H new ATOM 827 N LYS A 50 2.426 -11.244 -3.780 1.00 0.00 N ATOM 828 CA LYS A 50 2.368 -11.454 -5.220 1.00 0.00 C ATOM 829 C LYS A 50 3.244 -12.639 -5.575 1.00 0.00 C ATOM 830 O LYS A 50 2.783 -13.537 -6.272 1.00 0.00 O ATOM 831 CB LYS A 50 2.787 -10.169 -5.973 1.00 0.00 C ATOM 832 CG LYS A 50 1.722 -9.668 -6.971 1.00 0.00 C ATOM 833 CD LYS A 50 2.288 -9.451 -8.382 1.00 0.00 C ATOM 834 CE LYS A 50 1.243 -8.963 -9.396 1.00 0.00 C ATOM 835 NZ LYS A 50 0.040 -9.815 -9.433 1.00 0.00 N ATOM 0 H LYS A 50 2.877 -10.365 -3.527 1.00 0.00 H new ATOM 0 HA LYS A 50 1.346 -11.676 -5.528 1.00 0.00 H new ATOM 0 HB2 LYS A 50 2.992 -9.382 -5.247 1.00 0.00 H new ATOM 0 HB3 LYS A 50 3.717 -10.358 -6.510 1.00 0.00 H new ATOM 0 HG2 LYS A 50 0.906 -10.389 -7.018 1.00 0.00 H new ATOM 0 HG3 LYS A 50 1.299 -8.732 -6.606 1.00 0.00 H new ATOM 0 HD2 LYS A 50 3.099 -8.725 -8.331 1.00 0.00 H new ATOM 0 HD3 LYS A 50 2.719 -10.386 -8.739 1.00 0.00 H new ATOM 0 HE2 LYS A 50 0.952 -7.942 -9.148 1.00 0.00 H new ATOM 0 HE3 LYS A 50 1.693 -8.934 -10.389 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -0.561 -9.533 -10.234 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 0.322 -10.810 -9.545 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -0.491 -9.704 -8.546 1.00 0.00 H new ATOM 849 N GLY A 51 4.457 -12.665 -5.035 1.00 0.00 N ATOM 850 CA GLY A 51 5.442 -13.708 -5.229 1.00 0.00 C ATOM 851 C GLY A 51 6.783 -13.088 -5.595 1.00 0.00 C ATOM 852 O GLY A 51 7.396 -13.520 -6.571 1.00 0.00 O ATOM 0 H GLY A 51 4.791 -11.921 -4.422 1.00 0.00 H new ATOM 0 HA2 GLY A 51 5.541 -14.301 -4.320 1.00 0.00 H new ATOM 0 HA3 GLY A 51 5.117 -14.386 -6.018 1.00 0.00 H new ATOM 856 N TYR A 52 7.229 -12.065 -4.862 1.00 0.00 N ATOM 857 CA TYR A 52 8.552 -11.469 -5.022 1.00 0.00 C ATOM 858 C TYR A 52 9.313 -11.502 -3.708 1.00 0.00 C ATOM 859 O TYR A 52 8.791 -11.115 -2.661 1.00 0.00 O ATOM 860 CB TYR A 52 8.454 -10.034 -5.540 1.00 0.00 C ATOM 861 CG TYR A 52 7.993 -9.965 -6.975 1.00 0.00 C ATOM 862 CD1 TYR A 52 8.918 -10.186 -8.012 1.00 0.00 C ATOM 863 CD2 TYR A 52 6.637 -9.751 -7.273 1.00 0.00 C ATOM 864 CE1 TYR A 52 8.490 -10.218 -9.349 1.00 0.00 C ATOM 865 CE2 TYR A 52 6.207 -9.731 -8.606 1.00 0.00 C ATOM 866 CZ TYR A 52 7.124 -9.982 -9.648 1.00 0.00 C ATOM 867 OH TYR A 52 6.674 -10.018 -10.929 1.00 0.00 O ATOM 0 H TYR A 52 6.671 -11.623 -4.131 1.00 0.00 H new ATOM 0 HA TYR A 52 9.096 -12.059 -5.759 1.00 0.00 H new ATOM 0 HB2 TYR A 52 7.762 -9.472 -4.913 1.00 0.00 H new ATOM 0 HB3 TYR A 52 9.428 -9.552 -5.452 1.00 0.00 H new ATOM 0 HD1 TYR A 52 9.962 -10.332 -7.778 1.00 0.00 H new ATOM 0 HD2 TYR A 52 5.926 -9.602 -6.474 1.00 0.00 H new ATOM 0 HE1 TYR A 52 9.195 -10.420 -10.142 1.00 0.00 H new ATOM 0 HE2 TYR A 52 5.172 -9.523 -8.836 1.00 0.00 H new ATOM 0 HH TYR A 52 5.712 -9.834 -10.943 1.00 0.00 H new ATOM 877 N ASN A 53 10.572 -11.932 -3.787 1.00 0.00 N ATOM 878 CA ASN A 53 11.495 -12.098 -2.670 1.00 0.00 C ATOM 879 C ASN A 53 12.801 -11.348 -2.913 1.00 0.00 C ATOM 880 O ASN A 53 13.811 -11.667 -2.283 1.00 0.00 O ATOM 881 CB ASN A 53 11.722 -13.599 -2.400 1.00 0.00 C ATOM 882 CG ASN A 53 10.643 -14.236 -1.548 1.00 0.00 C ATOM 883 OD1 ASN A 53 9.464 -14.225 -1.895 1.00 0.00 O ATOM 884 ND2 ASN A 53 11.006 -14.801 -0.410 1.00 0.00 N ATOM 0 H ASN A 53 10.995 -12.187 -4.679 1.00 0.00 H new ATOM 0 HA ASN A 53 11.053 -11.659 -1.775 1.00 0.00 H new ATOM 0 HB2 ASN A 53 11.778 -14.126 -3.353 1.00 0.00 H new ATOM 0 HB3 ASN A 53 12.685 -13.729 -1.907 1.00 0.00 H new ATOM 0 HD21 ASN A 53 10.305 -15.234 0.191 1.00 0.00 H new ATOM 0 HD22 ASN A 53 11.987 -14.804 -0.132 1.00 0.00 H new ATOM 891 N LYS A 54 12.801 -10.336 -3.783 1.00 0.00 N ATOM 892 CA LYS A 54 13.825 -9.307 -3.854 1.00 0.00 C ATOM 893 C LYS A 54 13.154 -7.988 -4.211 1.00 0.00 C ATOM 894 O LYS A 54 12.227 -7.952 -5.021 1.00 0.00 O ATOM 895 CB LYS A 54 14.925 -9.679 -4.841 1.00 0.00 C ATOM 896 CG LYS A 54 16.022 -10.539 -4.195 1.00 0.00 C ATOM 897 CD LYS A 54 16.263 -11.842 -4.955 1.00 0.00 C ATOM 898 CE LYS A 54 15.031 -12.745 -4.951 1.00 0.00 C ATOM 899 NZ LYS A 54 15.227 -13.888 -5.861 1.00 0.00 N ATOM 0 H LYS A 54 12.063 -10.212 -4.476 1.00 0.00 H new ATOM 0 HA LYS A 54 14.317 -9.208 -2.886 1.00 0.00 H new ATOM 0 HB2 LYS A 54 14.489 -10.221 -5.680 1.00 0.00 H new ATOM 0 HB3 LYS A 54 15.370 -8.770 -5.245 1.00 0.00 H new ATOM 0 HG2 LYS A 54 16.950 -9.969 -4.154 1.00 0.00 H new ATOM 0 HG3 LYS A 54 15.742 -10.768 -3.167 1.00 0.00 H new ATOM 0 HD2 LYS A 54 16.542 -11.615 -5.984 1.00 0.00 H new ATOM 0 HD3 LYS A 54 17.103 -12.373 -4.507 1.00 0.00 H new ATOM 0 HE2 LYS A 54 14.840 -13.106 -3.940 1.00 0.00 H new ATOM 0 HE3 LYS A 54 14.154 -12.175 -5.257 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 14.325 -14.122 -6.323 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 15.932 -13.639 -6.584 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 15.562 -14.710 -5.319 1.00 0.00 H new ATOM 913 N ILE A 55 13.646 -6.913 -3.609 1.00 0.00 N ATOM 914 CA ILE A 55 13.191 -5.528 -3.676 1.00 0.00 C ATOM 915 C ILE A 55 14.479 -4.704 -3.684 1.00 0.00 C ATOM 916 O ILE A 55 15.460 -5.105 -3.052 1.00 0.00 O ATOM 917 CB ILE A 55 12.277 -5.273 -2.458 1.00 0.00 C ATOM 918 CG1 ILE A 55 10.840 -5.718 -2.821 1.00 0.00 C ATOM 919 CG2 ILE A 55 12.222 -3.795 -2.062 1.00 0.00 C ATOM 920 CD1 ILE A 55 10.034 -6.230 -1.637 1.00 0.00 C ATOM 0 H ILE A 55 14.458 -6.998 -2.998 1.00 0.00 H new ATOM 0 HA ILE A 55 12.597 -5.269 -4.553 1.00 0.00 H new ATOM 0 HB ILE A 55 12.686 -5.836 -1.619 1.00 0.00 H new ATOM 0 HG12 ILE A 55 10.312 -4.876 -3.270 1.00 0.00 H new ATOM 0 HG13 ILE A 55 10.893 -6.501 -3.577 1.00 0.00 H new ATOM 0 HG21 ILE A 55 11.565 -3.673 -1.201 1.00 0.00 H new ATOM 0 HG22 ILE A 55 13.224 -3.449 -1.806 1.00 0.00 H new ATOM 0 HG23 ILE A 55 11.838 -3.209 -2.897 1.00 0.00 H new ATOM 0 HD11 ILE A 55 9.039 -6.522 -1.973 1.00 0.00 H new ATOM 0 HD12 ILE A 55 10.537 -7.093 -1.200 1.00 0.00 H new ATOM 0 HD13 ILE A 55 9.947 -5.443 -0.888 1.00 0.00 H new ATOM 932 N PHE A 56 14.457 -3.530 -4.313 1.00 0.00 N ATOM 933 CA PHE A 56 15.499 -2.519 -4.238 1.00 0.00 C ATOM 934 C PHE A 56 14.880 -1.153 -4.006 1.00 0.00 C ATOM 935 O PHE A 56 13.736 -0.936 -4.406 1.00 0.00 O ATOM 936 CB PHE A 56 16.330 -2.529 -5.531 1.00 0.00 C ATOM 937 CG PHE A 56 17.270 -3.709 -5.677 1.00 0.00 C ATOM 938 CD1 PHE A 56 17.910 -4.276 -4.558 1.00 0.00 C ATOM 939 CD2 PHE A 56 17.475 -4.279 -6.945 1.00 0.00 C ATOM 940 CE1 PHE A 56 18.706 -5.417 -4.715 1.00 0.00 C ATOM 941 CE2 PHE A 56 18.236 -5.443 -7.097 1.00 0.00 C ATOM 942 CZ PHE A 56 18.845 -6.020 -5.975 1.00 0.00 C ATOM 0 H PHE A 56 13.680 -3.250 -4.911 1.00 0.00 H new ATOM 0 HA PHE A 56 16.160 -2.743 -3.401 1.00 0.00 H new ATOM 0 HB2 PHE A 56 15.650 -2.518 -6.383 1.00 0.00 H new ATOM 0 HB3 PHE A 56 16.914 -1.610 -5.577 1.00 0.00 H new ATOM 0 HD1 PHE A 56 17.787 -3.832 -3.581 1.00 0.00 H new ATOM 0 HD2 PHE A 56 17.039 -3.811 -7.815 1.00 0.00 H new ATOM 0 HE1 PHE A 56 19.217 -5.836 -3.861 1.00 0.00 H new ATOM 0 HE2 PHE A 56 18.353 -5.893 -8.072 1.00 0.00 H new ATOM 0 HZ PHE A 56 19.421 -6.928 -6.079 1.00 0.00 H new ATOM 952 N LEU A 57 15.638 -0.234 -3.394 1.00 0.00 N ATOM 953 CA LEU A 57 15.224 1.153 -3.199 1.00 0.00 C ATOM 954 C LEU A 57 16.225 2.046 -3.931 1.00 0.00 C ATOM 955 O LEU A 57 17.399 2.059 -3.566 1.00 0.00 O ATOM 956 CB LEU A 57 15.139 1.437 -1.689 1.00 0.00 C ATOM 957 CG LEU A 57 14.491 2.771 -1.288 1.00 0.00 C ATOM 958 CD1 LEU A 57 13.019 2.829 -1.715 1.00 0.00 C ATOM 959 CD2 LEU A 57 14.558 2.896 0.238 1.00 0.00 C ATOM 0 H LEU A 57 16.564 -0.439 -3.018 1.00 0.00 H new ATOM 0 HA LEU A 57 14.236 1.355 -3.612 1.00 0.00 H new ATOM 0 HB2 LEU A 57 14.579 0.629 -1.219 1.00 0.00 H new ATOM 0 HB3 LEU A 57 16.148 1.408 -1.277 1.00 0.00 H new ATOM 0 HG LEU A 57 15.026 3.582 -1.782 1.00 0.00 H new ATOM 0 HD11 LEU A 57 12.591 3.786 -1.416 1.00 0.00 H new ATOM 0 HD12 LEU A 57 12.950 2.723 -2.798 1.00 0.00 H new ATOM 0 HD13 LEU A 57 12.469 2.020 -1.235 1.00 0.00 H new ATOM 0 HD21 LEU A 57 14.103 3.837 0.546 1.00 0.00 H new ATOM 0 HD22 LEU A 57 14.020 2.066 0.695 1.00 0.00 H new ATOM 0 HD23 LEU A 57 15.599 2.874 0.559 1.00 0.00 H new ATOM 971 N VAL A 58 15.801 2.706 -5.009 1.00 0.00 N ATOM 972 CA VAL A 58 16.644 3.591 -5.810 1.00 0.00 C ATOM 973 C VAL A 58 16.614 4.982 -5.180 1.00 0.00 C ATOM 974 O VAL A 58 15.641 5.724 -5.314 1.00 0.00 O ATOM 975 CB VAL A 58 16.190 3.569 -7.283 1.00 0.00 C ATOM 976 CG1 VAL A 58 16.950 4.563 -8.167 1.00 0.00 C ATOM 977 CG2 VAL A 58 16.442 2.175 -7.870 1.00 0.00 C ATOM 0 H VAL A 58 14.844 2.639 -5.356 1.00 0.00 H new ATOM 0 HA VAL A 58 17.680 3.253 -5.816 1.00 0.00 H new ATOM 0 HB VAL A 58 15.134 3.841 -7.278 1.00 0.00 H new ATOM 0 HG11 VAL A 58 16.581 4.496 -9.190 1.00 0.00 H new ATOM 0 HG12 VAL A 58 16.796 5.575 -7.792 1.00 0.00 H new ATOM 0 HG13 VAL A 58 18.014 4.327 -8.148 1.00 0.00 H new ATOM 0 HG21 VAL A 58 16.122 2.156 -8.912 1.00 0.00 H new ATOM 0 HG22 VAL A 58 17.505 1.943 -7.813 1.00 0.00 H new ATOM 0 HG23 VAL A 58 15.878 1.434 -7.303 1.00 0.00 H new ATOM 987 N LEU A 59 17.691 5.329 -4.480 1.00 0.00 N ATOM 988 CA LEU A 59 17.883 6.614 -3.820 1.00 0.00 C ATOM 989 C LEU A 59 18.303 7.705 -4.812 1.00 0.00 C ATOM 990 O LEU A 59 18.261 8.887 -4.473 1.00 0.00 O ATOM 991 CB LEU A 59 18.973 6.468 -2.749 1.00 0.00 C ATOM 992 CG LEU A 59 18.570 5.826 -1.424 1.00 0.00 C ATOM 993 CD1 LEU A 59 17.461 6.582 -0.712 1.00 0.00 C ATOM 994 CD2 LEU A 59 18.138 4.374 -1.550 1.00 0.00 C ATOM 0 H LEU A 59 18.482 4.698 -4.353 1.00 0.00 H new ATOM 0 HA LEU A 59 16.934 6.909 -3.372 1.00 0.00 H new ATOM 0 HB2 LEU A 59 19.787 5.882 -3.174 1.00 0.00 H new ATOM 0 HB3 LEU A 59 19.372 7.460 -2.536 1.00 0.00 H new ATOM 0 HG LEU A 59 19.486 5.871 -0.835 1.00 0.00 H new ATOM 0 HD11 LEU A 59 17.219 6.077 0.223 1.00 0.00 H new ATOM 0 HD12 LEU A 59 17.792 7.599 -0.500 1.00 0.00 H new ATOM 0 HD13 LEU A 59 16.576 6.613 -1.347 1.00 0.00 H new ATOM 0 HD21 LEU A 59 17.867 3.988 -0.567 1.00 0.00 H new ATOM 0 HD22 LEU A 59 17.278 4.307 -2.216 1.00 0.00 H new ATOM 0 HD23 LEU A 59 18.959 3.784 -1.958 1.00 0.00 H new ATOM 1006 N SER A 60 18.687 7.327 -6.035 1.00 0.00 N ATOM 1007 CA SER A 60 18.996 8.240 -7.135 1.00 0.00 C ATOM 1008 C SER A 60 17.873 9.258 -7.338 1.00 0.00 C ATOM 1009 O SER A 60 18.139 10.408 -7.697 1.00 0.00 O ATOM 1010 CB SER A 60 19.257 7.411 -8.410 1.00 0.00 C ATOM 1011 OG SER A 60 18.621 7.879 -9.590 1.00 0.00 O ATOM 0 H SER A 60 18.794 6.346 -6.293 1.00 0.00 H new ATOM 0 HA SER A 60 19.892 8.812 -6.896 1.00 0.00 H new ATOM 0 HB2 SER A 60 20.332 7.380 -8.587 1.00 0.00 H new ATOM 0 HB3 SER A 60 18.934 6.386 -8.227 1.00 0.00 H new ATOM 0 HG SER A 60 18.849 7.290 -10.340 1.00 0.00 H new ATOM 1017 N ASP A 61 16.615 8.826 -7.192 1.00 0.00 N ATOM 1018 CA ASP A 61 15.492 9.623 -7.660 1.00 0.00 C ATOM 1019 C ASP A 61 15.079 10.652 -6.605 1.00 0.00 C ATOM 1020 O ASP A 61 14.875 11.827 -6.915 1.00 0.00 O ATOM 1021 CB ASP A 61 14.320 8.725 -8.068 1.00 0.00 C ATOM 1022 CG ASP A 61 13.511 9.374 -9.189 1.00 0.00 C ATOM 1023 OD1 ASP A 61 12.902 10.453 -9.012 1.00 0.00 O ATOM 1024 OD2 ASP A 61 13.543 8.826 -10.312 1.00 0.00 O ATOM 0 H ASP A 61 16.358 7.939 -6.758 1.00 0.00 H new ATOM 0 HA ASP A 61 15.805 10.173 -8.547 1.00 0.00 H new ATOM 0 HB2 ASP A 61 14.695 7.756 -8.397 1.00 0.00 H new ATOM 0 HB3 ASP A 61 13.677 8.543 -7.207 1.00 0.00 H new ATOM 1029 N VAL A 62 14.981 10.206 -5.353 1.00 0.00 N ATOM 1030 CA VAL A 62 14.706 11.006 -4.162 1.00 0.00 C ATOM 1031 C VAL A 62 15.981 11.771 -3.744 1.00 0.00 C ATOM 1032 O VAL A 62 17.010 11.715 -4.428 1.00 0.00 O ATOM 1033 CB VAL A 62 14.087 10.043 -3.108 1.00 0.00 C ATOM 1034 CG1 VAL A 62 15.053 9.001 -2.542 1.00 0.00 C ATOM 1035 CG2 VAL A 62 13.379 10.718 -1.925 1.00 0.00 C ATOM 0 H VAL A 62 15.099 9.217 -5.131 1.00 0.00 H new ATOM 0 HA VAL A 62 13.977 11.801 -4.319 1.00 0.00 H new ATOM 0 HB VAL A 62 13.336 9.544 -3.721 1.00 0.00 H new ATOM 0 HG11 VAL A 62 14.531 8.377 -1.817 1.00 0.00 H new ATOM 0 HG12 VAL A 62 15.431 8.377 -3.352 1.00 0.00 H new ATOM 0 HG13 VAL A 62 15.887 9.505 -2.053 1.00 0.00 H new ATOM 0 HG21 VAL A 62 12.986 9.955 -1.253 1.00 0.00 H new ATOM 0 HG22 VAL A 62 14.089 11.345 -1.386 1.00 0.00 H new ATOM 0 HG23 VAL A 62 12.559 11.334 -2.295 1.00 0.00 H new ATOM 1045 N GLU A 63 15.912 12.534 -2.654 1.00 0.00 N ATOM 1046 CA GLU A 63 17.061 13.153 -2.009 1.00 0.00 C ATOM 1047 C GLU A 63 17.115 12.693 -0.547 1.00 0.00 C ATOM 1048 O GLU A 63 18.199 12.386 -0.047 1.00 0.00 O ATOM 1049 CB GLU A 63 16.942 14.679 -2.165 1.00 0.00 C ATOM 1050 CG GLU A 63 18.033 15.496 -1.459 1.00 0.00 C ATOM 1051 CD GLU A 63 19.425 15.381 -2.097 1.00 0.00 C ATOM 1052 OE1 GLU A 63 20.088 14.334 -1.934 1.00 0.00 O ATOM 1053 OE2 GLU A 63 19.871 16.359 -2.737 1.00 0.00 O ATOM 0 H GLU A 63 15.030 12.742 -2.185 1.00 0.00 H new ATOM 0 HA GLU A 63 18.001 12.851 -2.471 1.00 0.00 H new ATOM 0 HB2 GLU A 63 16.959 14.922 -3.227 1.00 0.00 H new ATOM 0 HB3 GLU A 63 15.971 14.993 -1.782 1.00 0.00 H new ATOM 0 HG2 GLU A 63 17.736 16.545 -1.451 1.00 0.00 H new ATOM 0 HG3 GLU A 63 18.095 15.174 -0.420 1.00 0.00 H new ATOM 1060 N SER A 64 15.972 12.617 0.156 1.00 0.00 N ATOM 1061 CA SER A 64 15.982 12.175 1.542 1.00 0.00 C ATOM 1062 C SER A 64 14.667 11.559 1.999 1.00 0.00 C ATOM 1063 O SER A 64 13.609 11.728 1.393 1.00 0.00 O ATOM 1064 CB SER A 64 16.352 13.385 2.416 1.00 0.00 C ATOM 1065 OG SER A 64 16.788 13.103 3.734 1.00 0.00 O ATOM 0 H SER A 64 15.051 12.853 -0.213 1.00 0.00 H new ATOM 0 HA SER A 64 16.716 11.375 1.640 1.00 0.00 H new ATOM 0 HB2 SER A 64 17.138 13.944 1.909 1.00 0.00 H new ATOM 0 HB3 SER A 64 15.483 14.040 2.477 1.00 0.00 H new ATOM 0 HG SER A 64 16.633 13.885 4.304 1.00 0.00 H new ATOM 1071 N ILE A 65 14.769 10.888 3.138 1.00 0.00 N ATOM 1072 CA ILE A 65 13.746 10.222 3.916 1.00 0.00 C ATOM 1073 C ILE A 65 14.004 10.616 5.381 1.00 0.00 C ATOM 1074 O ILE A 65 15.151 10.886 5.758 1.00 0.00 O ATOM 1075 CB ILE A 65 13.852 8.703 3.639 1.00 0.00 C ATOM 1076 CG1 ILE A 65 12.727 7.949 4.355 1.00 0.00 C ATOM 1077 CG2 ILE A 65 15.248 8.158 3.984 1.00 0.00 C ATOM 1078 CD1 ILE A 65 12.586 6.499 3.872 1.00 0.00 C ATOM 0 H ILE A 65 15.680 10.789 3.587 1.00 0.00 H new ATOM 0 HA ILE A 65 12.726 10.509 3.661 1.00 0.00 H new ATOM 0 HB ILE A 65 13.723 8.537 2.569 1.00 0.00 H new ATOM 0 HG12 ILE A 65 12.918 7.953 5.428 1.00 0.00 H new ATOM 0 HG13 ILE A 65 11.785 8.474 4.196 1.00 0.00 H new ATOM 0 HG21 ILE A 65 15.283 7.089 3.776 1.00 0.00 H new ATOM 0 HG22 ILE A 65 15.998 8.670 3.380 1.00 0.00 H new ATOM 0 HG23 ILE A 65 15.454 8.329 5.041 1.00 0.00 H new ATOM 0 HD11 ILE A 65 11.774 6.013 4.413 1.00 0.00 H new ATOM 0 HD12 ILE A 65 12.367 6.491 2.804 1.00 0.00 H new ATOM 0 HD13 ILE A 65 13.517 5.962 4.055 1.00 0.00 H new ATOM 1090 N ASP A 66 12.969 10.628 6.219 1.00 0.00 N ATOM 1091 CA ASP A 66 13.023 11.223 7.560 1.00 0.00 C ATOM 1092 C ASP A 66 12.936 10.141 8.626 1.00 0.00 C ATOM 1093 O ASP A 66 12.672 8.972 8.329 1.00 0.00 O ATOM 1094 CB ASP A 66 11.910 12.258 7.835 1.00 0.00 C ATOM 1095 CG ASP A 66 11.475 13.072 6.632 1.00 0.00 C ATOM 1096 OD1 ASP A 66 10.556 12.588 5.938 1.00 0.00 O ATOM 1097 OD2 ASP A 66 12.039 14.155 6.369 1.00 0.00 O ATOM 0 H ASP A 66 12.062 10.223 5.988 1.00 0.00 H new ATOM 0 HA ASP A 66 13.978 11.746 7.601 1.00 0.00 H new ATOM 0 HB2 ASP A 66 11.041 11.736 8.234 1.00 0.00 H new ATOM 0 HB3 ASP A 66 12.255 12.942 8.611 1.00 0.00 H new ATOM 1102 N SER A 67 13.077 10.554 9.890 1.00 0.00 N ATOM 1103 CA SER A 67 12.906 9.779 11.122 1.00 0.00 C ATOM 1104 C SER A 67 11.482 9.235 11.336 1.00 0.00 C ATOM 1105 O SER A 67 11.095 8.900 12.463 1.00 0.00 O ATOM 1106 CB SER A 67 13.382 10.642 12.303 1.00 0.00 C ATOM 1107 OG SER A 67 12.899 11.977 12.213 1.00 0.00 O ATOM 0 H SER A 67 13.335 11.520 10.094 1.00 0.00 H new ATOM 0 HA SER A 67 13.516 8.879 11.041 1.00 0.00 H new ATOM 0 HB2 SER A 67 13.044 10.196 13.238 1.00 0.00 H new ATOM 0 HB3 SER A 67 14.472 10.651 12.330 1.00 0.00 H new ATOM 0 HG SER A 67 13.221 12.494 12.981 1.00 0.00 H new ATOM 1113 N PHE A 68 10.678 9.163 10.278 1.00 0.00 N ATOM 1114 CA PHE A 68 9.432 8.443 10.240 1.00 0.00 C ATOM 1115 C PHE A 68 9.621 7.274 9.283 1.00 0.00 C ATOM 1116 O PHE A 68 9.742 6.137 9.745 1.00 0.00 O ATOM 1117 CB PHE A 68 8.282 9.390 9.882 1.00 0.00 C ATOM 1118 CG PHE A 68 6.949 8.879 10.366 1.00 0.00 C ATOM 1119 CD1 PHE A 68 6.348 7.772 9.743 1.00 0.00 C ATOM 1120 CD2 PHE A 68 6.331 9.486 11.472 1.00 0.00 C ATOM 1121 CE1 PHE A 68 5.124 7.275 10.220 1.00 0.00 C ATOM 1122 CE2 PHE A 68 5.086 9.018 11.921 1.00 0.00 C ATOM 1123 CZ PHE A 68 4.483 7.911 11.299 1.00 0.00 C ATOM 0 H PHE A 68 10.895 9.626 9.396 1.00 0.00 H new ATOM 0 HA PHE A 68 9.154 8.035 11.212 1.00 0.00 H new ATOM 0 HB2 PHE A 68 8.473 10.371 10.318 1.00 0.00 H new ATOM 0 HB3 PHE A 68 8.247 9.523 8.801 1.00 0.00 H new ATOM 0 HD1 PHE A 68 6.828 7.303 8.897 1.00 0.00 H new ATOM 0 HD2 PHE A 68 6.813 10.311 11.976 1.00 0.00 H new ATOM 0 HE1 PHE A 68 4.676 6.407 9.760 1.00 0.00 H new ATOM 0 HE2 PHE A 68 4.591 9.509 12.746 1.00 0.00 H new ATOM 0 HZ PHE A 68 3.528 7.549 11.649 1.00 0.00 H new ATOM 1133 N SER A 69 9.680 7.509 7.972 1.00 0.00 N ATOM 1134 CA SER A 69 9.694 6.442 7.009 1.00 0.00 C ATOM 1135 C SER A 69 10.951 5.574 7.069 1.00 0.00 C ATOM 1136 O SER A 69 10.820 4.387 6.784 1.00 0.00 O ATOM 1137 CB SER A 69 9.533 7.052 5.633 1.00 0.00 C ATOM 1138 OG SER A 69 8.278 7.670 5.458 1.00 0.00 O ATOM 0 H SER A 69 9.719 8.443 7.564 1.00 0.00 H new ATOM 0 HA SER A 69 8.870 5.768 7.242 1.00 0.00 H new ATOM 0 HB2 SER A 69 10.322 7.787 5.471 1.00 0.00 H new ATOM 0 HB3 SER A 69 9.660 6.276 4.878 1.00 0.00 H new ATOM 0 HG SER A 69 8.223 8.050 4.556 1.00 0.00 H new ATOM 1144 N LEU A 70 12.122 6.093 7.475 1.00 0.00 N ATOM 1145 CA LEU A 70 13.367 5.311 7.563 1.00 0.00 C ATOM 1146 C LEU A 70 13.114 3.997 8.305 1.00 0.00 C ATOM 1147 O LEU A 70 13.491 2.921 7.843 1.00 0.00 O ATOM 1148 CB LEU A 70 14.434 6.092 8.362 1.00 0.00 C ATOM 1149 CG LEU A 70 15.239 7.110 7.544 1.00 0.00 C ATOM 1150 CD1 LEU A 70 15.837 8.197 8.432 1.00 0.00 C ATOM 1151 CD2 LEU A 70 16.417 6.458 6.819 1.00 0.00 C ATOM 0 H LEU A 70 12.232 7.068 7.752 1.00 0.00 H new ATOM 0 HA LEU A 70 13.712 5.119 6.547 1.00 0.00 H new ATOM 0 HB2 LEU A 70 13.942 6.615 9.182 1.00 0.00 H new ATOM 0 HB3 LEU A 70 15.126 5.378 8.809 1.00 0.00 H new ATOM 0 HG LEU A 70 14.530 7.530 6.831 1.00 0.00 H new ATOM 0 HD11 LEU A 70 16.400 8.900 7.818 1.00 0.00 H new ATOM 0 HD12 LEU A 70 15.036 8.727 8.948 1.00 0.00 H new ATOM 0 HD13 LEU A 70 16.503 7.742 9.166 1.00 0.00 H new ATOM 0 HD21 LEU A 70 16.959 7.215 6.252 1.00 0.00 H new ATOM 0 HD22 LEU A 70 17.086 6.002 7.549 1.00 0.00 H new ATOM 0 HD23 LEU A 70 16.046 5.692 6.138 1.00 0.00 H new ATOM 1163 N GLY A 71 12.420 4.081 9.442 1.00 0.00 N ATOM 1164 CA GLY A 71 12.126 2.921 10.267 1.00 0.00 C ATOM 1165 C GLY A 71 11.290 1.884 9.520 1.00 0.00 C ATOM 1166 O GLY A 71 11.460 0.685 9.746 1.00 0.00 O ATOM 0 H GLY A 71 12.049 4.957 9.811 1.00 0.00 H new ATOM 0 HA2 GLY A 71 13.059 2.465 10.597 1.00 0.00 H new ATOM 0 HA3 GLY A 71 11.593 3.239 11.163 1.00 0.00 H new ATOM 1170 N VAL A 72 10.403 2.316 8.619 1.00 0.00 N ATOM 1171 CA VAL A 72 9.551 1.414 7.856 1.00 0.00 C ATOM 1172 C VAL A 72 10.343 0.715 6.745 1.00 0.00 C ATOM 1173 O VAL A 72 10.037 -0.426 6.399 1.00 0.00 O ATOM 1174 CB VAL A 72 8.287 2.108 7.307 1.00 0.00 C ATOM 1175 CG1 VAL A 72 7.293 0.988 6.935 1.00 0.00 C ATOM 1176 CG2 VAL A 72 7.665 3.084 8.324 1.00 0.00 C ATOM 0 H VAL A 72 10.259 3.302 8.402 1.00 0.00 H new ATOM 0 HA VAL A 72 9.199 0.650 8.550 1.00 0.00 H new ATOM 0 HB VAL A 72 8.543 2.715 6.439 1.00 0.00 H new ATOM 0 HG11 VAL A 72 6.378 1.430 6.540 1.00 0.00 H new ATOM 0 HG12 VAL A 72 7.739 0.341 6.180 1.00 0.00 H new ATOM 0 HG13 VAL A 72 7.058 0.400 7.823 1.00 0.00 H new ATOM 0 HG21 VAL A 72 6.779 3.546 7.889 1.00 0.00 H new ATOM 0 HG22 VAL A 72 7.385 2.540 9.226 1.00 0.00 H new ATOM 0 HG23 VAL A 72 8.390 3.857 8.577 1.00 0.00 H new ATOM 1186 N ILE A 73 11.383 1.352 6.207 1.00 0.00 N ATOM 1187 CA ILE A 73 12.258 0.706 5.232 1.00 0.00 C ATOM 1188 C ILE A 73 12.984 -0.470 5.919 1.00 0.00 C ATOM 1189 O ILE A 73 13.071 -1.557 5.346 1.00 0.00 O ATOM 1190 CB ILE A 73 13.170 1.764 4.558 1.00 0.00 C ATOM 1191 CG1 ILE A 73 12.472 2.508 3.392 1.00 0.00 C ATOM 1192 CG2 ILE A 73 14.414 1.108 3.947 1.00 0.00 C ATOM 1193 CD1 ILE A 73 11.117 3.156 3.677 1.00 0.00 C ATOM 0 H ILE A 73 11.639 2.314 6.430 1.00 0.00 H new ATOM 0 HA ILE A 73 11.699 0.265 4.407 1.00 0.00 H new ATOM 0 HB ILE A 73 13.423 2.464 5.354 1.00 0.00 H new ATOM 0 HG12 ILE A 73 13.148 3.286 3.037 1.00 0.00 H new ATOM 0 HG13 ILE A 73 12.341 1.801 2.573 1.00 0.00 H new ATOM 0 HG21 ILE A 73 15.036 1.872 3.481 1.00 0.00 H new ATOM 0 HG22 ILE A 73 14.982 0.605 4.730 1.00 0.00 H new ATOM 0 HG23 ILE A 73 14.109 0.380 3.195 1.00 0.00 H new ATOM 0 HD11 ILE A 73 10.748 3.640 2.773 1.00 0.00 H new ATOM 0 HD12 ILE A 73 10.408 2.392 3.995 1.00 0.00 H new ATOM 0 HD13 ILE A 73 11.228 3.899 4.466 1.00 0.00 H new ATOM 1205 N VAL A 74 13.433 -0.323 7.172 1.00 0.00 N ATOM 1206 CA VAL A 74 13.931 -1.463 7.949 1.00 0.00 C ATOM 1207 C VAL A 74 12.821 -2.511 8.123 1.00 0.00 C ATOM 1208 O VAL A 74 13.095 -3.692 7.936 1.00 0.00 O ATOM 1209 CB VAL A 74 14.519 -0.975 9.293 1.00 0.00 C ATOM 1210 CG1 VAL A 74 14.708 -2.098 10.323 1.00 0.00 C ATOM 1211 CG2 VAL A 74 15.872 -0.298 9.044 1.00 0.00 C ATOM 0 H VAL A 74 13.461 0.569 7.666 1.00 0.00 H new ATOM 0 HA VAL A 74 14.742 -1.952 7.410 1.00 0.00 H new ATOM 0 HB VAL A 74 13.796 -0.275 9.711 1.00 0.00 H new ATOM 0 HG11 VAL A 74 15.124 -1.683 11.241 1.00 0.00 H new ATOM 0 HG12 VAL A 74 13.745 -2.561 10.538 1.00 0.00 H new ATOM 0 HG13 VAL A 74 15.390 -2.848 9.922 1.00 0.00 H new ATOM 0 HG21 VAL A 74 16.287 0.046 9.992 1.00 0.00 H new ATOM 0 HG22 VAL A 74 16.557 -1.011 8.586 1.00 0.00 H new ATOM 0 HG23 VAL A 74 15.736 0.553 8.377 1.00 0.00 H new ATOM 1221 N ASN A 75 11.581 -2.121 8.432 1.00 0.00 N ATOM 1222 CA ASN A 75 10.442 -3.024 8.624 1.00 0.00 C ATOM 1223 C ASN A 75 10.273 -3.997 7.457 1.00 0.00 C ATOM 1224 O ASN A 75 10.036 -5.189 7.665 1.00 0.00 O ATOM 1225 CB ASN A 75 9.173 -2.164 8.747 1.00 0.00 C ATOM 1226 CG ASN A 75 8.081 -2.732 9.620 1.00 0.00 C ATOM 1227 OD1 ASN A 75 6.947 -2.900 9.178 1.00 0.00 O ATOM 1228 ND2 ASN A 75 8.353 -2.884 10.897 1.00 0.00 N ATOM 0 H ASN A 75 11.335 -1.139 8.559 1.00 0.00 H new ATOM 0 HA ASN A 75 10.617 -3.618 9.521 1.00 0.00 H new ATOM 0 HB2 ASN A 75 9.455 -1.187 9.139 1.00 0.00 H new ATOM 0 HB3 ASN A 75 8.767 -2.002 7.748 1.00 0.00 H new ATOM 0 HD21 ASN A 75 7.613 -3.148 11.548 1.00 0.00 H new ATOM 0 HD22 ASN A 75 9.304 -2.738 11.237 1.00 0.00 H new ATOM 1235 N ILE A 76 10.407 -3.486 6.230 1.00 0.00 N ATOM 1236 CA ILE A 76 10.379 -4.272 5.003 1.00 0.00 C ATOM 1237 C ILE A 76 11.488 -5.325 5.050 1.00 0.00 C ATOM 1238 O ILE A 76 11.228 -6.492 4.754 1.00 0.00 O ATOM 1239 CB ILE A 76 10.456 -3.314 3.782 1.00 0.00 C ATOM 1240 CG1 ILE A 76 9.067 -2.670 3.616 1.00 0.00 C ATOM 1241 CG2 ILE A 76 10.867 -4.011 2.474 1.00 0.00 C ATOM 1242 CD1 ILE A 76 8.978 -1.527 2.614 1.00 0.00 C ATOM 0 H ILE A 76 10.541 -2.489 6.063 1.00 0.00 H new ATOM 0 HA ILE A 76 9.444 -4.823 4.901 1.00 0.00 H new ATOM 0 HB ILE A 76 11.233 -2.575 3.978 1.00 0.00 H new ATOM 0 HG12 ILE A 76 8.362 -3.446 3.316 1.00 0.00 H new ATOM 0 HG13 ILE A 76 8.741 -2.301 4.588 1.00 0.00 H new ATOM 0 HG21 ILE A 76 10.899 -3.280 1.667 1.00 0.00 H new ATOM 0 HG22 ILE A 76 11.852 -4.461 2.596 1.00 0.00 H new ATOM 0 HG23 ILE A 76 10.141 -4.787 2.232 1.00 0.00 H new ATOM 0 HD11 ILE A 76 7.955 -1.151 2.580 1.00 0.00 H new ATOM 0 HD12 ILE A 76 9.650 -0.724 2.917 1.00 0.00 H new ATOM 0 HD13 ILE A 76 9.265 -1.886 1.626 1.00 0.00 H new ATOM 1254 N LEU A 77 12.703 -4.949 5.462 1.00 0.00 N ATOM 1255 CA LEU A 77 13.841 -5.854 5.483 1.00 0.00 C ATOM 1256 C LEU A 77 13.584 -6.962 6.485 1.00 0.00 C ATOM 1257 O LEU A 77 13.729 -8.135 6.144 1.00 0.00 O ATOM 1258 CB LEU A 77 15.126 -5.080 5.826 1.00 0.00 C ATOM 1259 CG LEU A 77 16.439 -5.861 5.647 1.00 0.00 C ATOM 1260 CD1 LEU A 77 16.676 -6.957 6.687 1.00 0.00 C ATOM 1261 CD2 LEU A 77 16.569 -6.506 4.264 1.00 0.00 C ATOM 0 H LEU A 77 12.918 -4.007 5.789 1.00 0.00 H new ATOM 0 HA LEU A 77 13.974 -6.301 4.498 1.00 0.00 H new ATOM 0 HB2 LEU A 77 15.168 -4.186 5.203 1.00 0.00 H new ATOM 0 HB3 LEU A 77 15.062 -4.745 6.861 1.00 0.00 H new ATOM 0 HG LEU A 77 17.194 -5.086 5.778 1.00 0.00 H new ATOM 0 HD11 LEU A 77 17.624 -7.454 6.482 1.00 0.00 H new ATOM 0 HD12 LEU A 77 16.706 -6.514 7.682 1.00 0.00 H new ATOM 0 HD13 LEU A 77 15.867 -7.686 6.639 1.00 0.00 H new ATOM 0 HD21 LEU A 77 17.516 -7.042 4.200 1.00 0.00 H new ATOM 0 HD22 LEU A 77 15.746 -7.204 4.109 1.00 0.00 H new ATOM 0 HD23 LEU A 77 16.538 -5.732 3.497 1.00 0.00 H new ATOM 1273 N LYS A 78 13.174 -6.592 7.703 1.00 0.00 N ATOM 1274 CA LYS A 78 12.885 -7.544 8.766 1.00 0.00 C ATOM 1275 C LYS A 78 11.932 -8.608 8.252 1.00 0.00 C ATOM 1276 O LYS A 78 12.205 -9.791 8.415 1.00 0.00 O ATOM 1277 CB LYS A 78 12.280 -6.850 9.993 1.00 0.00 C ATOM 1278 CG LYS A 78 13.206 -5.811 10.635 1.00 0.00 C ATOM 1279 CD LYS A 78 12.645 -5.387 11.999 1.00 0.00 C ATOM 1280 CE LYS A 78 13.685 -4.696 12.885 1.00 0.00 C ATOM 1281 NZ LYS A 78 13.266 -4.708 14.303 1.00 0.00 N ATOM 0 H LYS A 78 13.035 -5.619 7.974 1.00 0.00 H new ATOM 0 HA LYS A 78 13.824 -8.006 9.072 1.00 0.00 H new ATOM 0 HB2 LYS A 78 11.350 -6.363 9.701 1.00 0.00 H new ATOM 0 HB3 LYS A 78 12.025 -7.605 10.737 1.00 0.00 H new ATOM 0 HG2 LYS A 78 14.206 -6.227 10.756 1.00 0.00 H new ATOM 0 HG3 LYS A 78 13.299 -4.942 9.984 1.00 0.00 H new ATOM 0 HD2 LYS A 78 11.802 -4.714 11.845 1.00 0.00 H new ATOM 0 HD3 LYS A 78 12.261 -6.266 12.517 1.00 0.00 H new ATOM 0 HE2 LYS A 78 14.647 -5.198 12.782 1.00 0.00 H new ATOM 0 HE3 LYS A 78 13.825 -3.668 12.552 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 13.988 -4.234 14.882 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 12.360 -4.208 14.401 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 13.155 -5.691 14.624 1.00 0.00 H new ATOM 1295 N SER A 79 10.838 -8.192 7.614 1.00 0.00 N ATOM 1296 CA SER A 79 9.819 -9.110 7.146 1.00 0.00 C ATOM 1297 C SER A 79 10.406 -10.026 6.072 1.00 0.00 C ATOM 1298 O SER A 79 10.254 -11.241 6.173 1.00 0.00 O ATOM 1299 CB SER A 79 8.610 -8.301 6.671 1.00 0.00 C ATOM 1300 OG SER A 79 7.494 -9.130 6.425 1.00 0.00 O ATOM 0 H SER A 79 10.641 -7.212 7.411 1.00 0.00 H new ATOM 0 HA SER A 79 9.474 -9.764 7.947 1.00 0.00 H new ATOM 0 HB2 SER A 79 8.352 -7.556 7.424 1.00 0.00 H new ATOM 0 HB3 SER A 79 8.869 -7.759 5.761 1.00 0.00 H new ATOM 0 HG SER A 79 6.670 -8.628 6.596 1.00 0.00 H new ATOM 1306 N ILE A 80 11.117 -9.462 5.095 1.00 0.00 N ATOM 1307 CA ILE A 80 11.715 -10.179 3.976 1.00 0.00 C ATOM 1308 C ILE A 80 12.725 -11.224 4.448 1.00 0.00 C ATOM 1309 O ILE A 80 12.705 -12.349 3.952 1.00 0.00 O ATOM 1310 CB ILE A 80 12.276 -9.142 2.987 1.00 0.00 C ATOM 1311 CG1 ILE A 80 11.079 -8.547 2.224 1.00 0.00 C ATOM 1312 CG2 ILE A 80 13.287 -9.715 1.989 1.00 0.00 C ATOM 1313 CD1 ILE A 80 11.500 -7.319 1.437 1.00 0.00 C ATOM 0 H ILE A 80 11.297 -8.458 5.063 1.00 0.00 H new ATOM 0 HA ILE A 80 10.965 -10.767 3.447 1.00 0.00 H new ATOM 0 HB ILE A 80 12.823 -8.392 3.559 1.00 0.00 H new ATOM 0 HG12 ILE A 80 10.665 -9.294 1.547 1.00 0.00 H new ATOM 0 HG13 ILE A 80 10.289 -8.281 2.927 1.00 0.00 H new ATOM 0 HG21 ILE A 80 13.635 -8.922 1.327 1.00 0.00 H new ATOM 0 HG22 ILE A 80 14.135 -10.134 2.530 1.00 0.00 H new ATOM 0 HG23 ILE A 80 12.811 -10.498 1.398 1.00 0.00 H new ATOM 0 HD11 ILE A 80 10.639 -6.915 0.905 1.00 0.00 H new ATOM 0 HD12 ILE A 80 11.891 -6.565 2.120 1.00 0.00 H new ATOM 0 HD13 ILE A 80 12.273 -7.594 0.719 1.00 0.00 H new ATOM 1325 N SER A 81 13.605 -10.887 5.387 1.00 0.00 N ATOM 1326 CA SER A 81 14.552 -11.844 5.940 1.00 0.00 C ATOM 1327 C SER A 81 13.882 -12.822 6.922 1.00 0.00 C ATOM 1328 O SER A 81 14.377 -13.941 7.074 1.00 0.00 O ATOM 1329 CB SER A 81 15.702 -11.066 6.574 1.00 0.00 C ATOM 1330 OG SER A 81 16.397 -10.330 5.575 1.00 0.00 O ATOM 0 H SER A 81 13.680 -9.950 5.782 1.00 0.00 H new ATOM 0 HA SER A 81 14.946 -12.474 5.142 1.00 0.00 H new ATOM 0 HB2 SER A 81 15.317 -10.388 7.336 1.00 0.00 H new ATOM 0 HB3 SER A 81 16.385 -11.753 7.074 1.00 0.00 H new ATOM 0 HG SER A 81 17.133 -9.832 5.988 1.00 0.00 H new ATOM 1336 N SER A 82 12.741 -12.467 7.530 1.00 0.00 N ATOM 1337 CA SER A 82 11.904 -13.419 8.252 1.00 0.00 C ATOM 1338 C SER A 82 11.375 -14.459 7.254 1.00 0.00 C ATOM 1339 O SER A 82 11.452 -15.654 7.539 1.00 0.00 O ATOM 1340 CB SER A 82 10.769 -12.696 9.003 1.00 0.00 C ATOM 1341 OG SER A 82 10.433 -13.322 10.230 1.00 0.00 O ATOM 0 H SER A 82 12.379 -11.514 7.532 1.00 0.00 H new ATOM 0 HA SER A 82 12.491 -13.933 9.013 1.00 0.00 H new ATOM 0 HB2 SER A 82 11.067 -11.665 9.196 1.00 0.00 H new ATOM 0 HB3 SER A 82 9.885 -12.658 8.366 1.00 0.00 H new ATOM 0 HG SER A 82 9.711 -12.823 10.665 1.00 0.00 H new ATOM 1347 N SER A 83 10.888 -14.016 6.089 1.00 0.00 N ATOM 1348 CA SER A 83 10.374 -14.844 5.010 1.00 0.00 C ATOM 1349 C SER A 83 11.459 -15.742 4.409 1.00 0.00 C ATOM 1350 O SER A 83 11.425 -16.957 4.602 1.00 0.00 O ATOM 1351 CB SER A 83 9.712 -13.948 3.945 1.00 0.00 C ATOM 1352 OG SER A 83 8.562 -13.315 4.476 1.00 0.00 O ATOM 0 H SER A 83 10.843 -13.021 5.870 1.00 0.00 H new ATOM 0 HA SER A 83 9.620 -15.517 5.417 1.00 0.00 H new ATOM 0 HB2 SER A 83 10.422 -13.196 3.601 1.00 0.00 H new ATOM 0 HB3 SER A 83 9.437 -14.547 3.077 1.00 0.00 H new ATOM 0 HG SER A 83 8.835 -12.579 5.062 1.00 0.00 H new ATOM 1358 N GLY A 84 12.407 -15.159 3.678 1.00 0.00 N ATOM 1359 CA GLY A 84 13.312 -15.875 2.790 1.00 0.00 C ATOM 1360 C GLY A 84 13.563 -15.088 1.506 1.00 0.00 C ATOM 1361 O GLY A 84 13.662 -15.671 0.427 1.00 0.00 O ATOM 0 H GLY A 84 12.569 -14.152 3.689 1.00 0.00 H new ATOM 0 HA2 GLY A 84 14.258 -16.056 3.300 1.00 0.00 H new ATOM 0 HA3 GLY A 84 12.890 -16.850 2.546 1.00 0.00 H new ATOM 1365 N GLY A 85 13.590 -13.753 1.561 1.00 0.00 N ATOM 1366 CA GLY A 85 14.034 -12.926 0.458 1.00 0.00 C ATOM 1367 C GLY A 85 15.119 -11.978 0.937 1.00 0.00 C ATOM 1368 O GLY A 85 15.564 -12.034 2.090 1.00 0.00 O ATOM 0 H GLY A 85 13.300 -13.222 2.382 1.00 0.00 H new ATOM 0 HA2 GLY A 85 14.414 -13.552 -0.349 1.00 0.00 H new ATOM 0 HA3 GLY A 85 13.195 -12.360 0.054 1.00 0.00 H new ATOM 1372 N PHE A 86 15.521 -11.076 0.050 1.00 0.00 N ATOM 1373 CA PHE A 86 16.548 -10.078 0.302 1.00 0.00 C ATOM 1374 C PHE A 86 16.049 -8.695 -0.131 1.00 0.00 C ATOM 1375 O PHE A 86 15.038 -8.583 -0.830 1.00 0.00 O ATOM 1376 CB PHE A 86 17.839 -10.525 -0.402 1.00 0.00 C ATOM 1377 CG PHE A 86 18.767 -11.326 0.499 1.00 0.00 C ATOM 1378 CD1 PHE A 86 18.453 -12.663 0.825 1.00 0.00 C ATOM 1379 CD2 PHE A 86 19.921 -10.733 1.057 1.00 0.00 C ATOM 1380 CE1 PHE A 86 19.267 -13.388 1.716 1.00 0.00 C ATOM 1381 CE2 PHE A 86 20.718 -11.458 1.958 1.00 0.00 C ATOM 1382 CZ PHE A 86 20.397 -12.784 2.289 1.00 0.00 C ATOM 0 H PHE A 86 15.129 -11.019 -0.890 1.00 0.00 H new ATOM 0 HA PHE A 86 16.771 -9.991 1.365 1.00 0.00 H new ATOM 0 HB2 PHE A 86 17.580 -11.127 -1.273 1.00 0.00 H new ATOM 0 HB3 PHE A 86 18.369 -9.646 -0.768 1.00 0.00 H new ATOM 0 HD1 PHE A 86 17.584 -13.132 0.389 1.00 0.00 H new ATOM 0 HD2 PHE A 86 20.191 -9.722 0.791 1.00 0.00 H new ATOM 0 HE1 PHE A 86 19.021 -14.411 1.959 1.00 0.00 H new ATOM 0 HE2 PHE A 86 21.586 -10.991 2.400 1.00 0.00 H new ATOM 0 HZ PHE A 86 21.016 -13.336 2.981 1.00 0.00 H new ATOM 1392 N PHE A 87 16.712 -7.628 0.313 1.00 0.00 N ATOM 1393 CA PHE A 87 16.430 -6.250 -0.070 1.00 0.00 C ATOM 1394 C PHE A 87 17.692 -5.408 0.131 1.00 0.00 C ATOM 1395 O PHE A 87 18.419 -5.593 1.107 1.00 0.00 O ATOM 1396 CB PHE A 87 15.227 -5.724 0.739 1.00 0.00 C ATOM 1397 CG PHE A 87 15.126 -4.217 0.921 1.00 0.00 C ATOM 1398 CD1 PHE A 87 15.227 -3.350 -0.182 1.00 0.00 C ATOM 1399 CD2 PHE A 87 14.957 -3.667 2.206 1.00 0.00 C ATOM 1400 CE1 PHE A 87 15.137 -1.965 -0.002 1.00 0.00 C ATOM 1401 CE2 PHE A 87 14.873 -2.279 2.389 1.00 0.00 C ATOM 1402 CZ PHE A 87 14.966 -1.423 1.279 1.00 0.00 C ATOM 0 H PHE A 87 17.487 -7.705 0.972 1.00 0.00 H new ATOM 0 HA PHE A 87 16.157 -6.188 -1.123 1.00 0.00 H new ATOM 0 HB2 PHE A 87 14.314 -6.069 0.253 1.00 0.00 H new ATOM 0 HB3 PHE A 87 15.255 -6.184 1.727 1.00 0.00 H new ATOM 0 HD1 PHE A 87 15.375 -3.755 -1.172 1.00 0.00 H new ATOM 0 HD2 PHE A 87 14.891 -4.322 3.062 1.00 0.00 H new ATOM 0 HE1 PHE A 87 15.200 -1.309 -0.857 1.00 0.00 H new ATOM 0 HE2 PHE A 87 14.737 -1.870 3.379 1.00 0.00 H new ATOM 0 HZ PHE A 87 14.906 -0.353 1.412 1.00 0.00 H new ATOM 1412 N ALA A 88 17.950 -4.473 -0.790 1.00 0.00 N ATOM 1413 CA ALA A 88 19.040 -3.510 -0.683 1.00 0.00 C ATOM 1414 C ALA A 88 18.687 -2.170 -1.315 1.00 0.00 C ATOM 1415 O ALA A 88 17.597 -1.998 -1.860 1.00 0.00 O ATOM 1416 CB ALA A 88 20.283 -4.074 -1.353 1.00 0.00 C ATOM 0 H ALA A 88 17.397 -4.366 -1.641 1.00 0.00 H new ATOM 0 HA ALA A 88 19.225 -3.337 0.377 1.00 0.00 H new ATOM 0 HB1 ALA A 88 21.098 -3.354 -1.273 1.00 0.00 H new ATOM 0 HB2 ALA A 88 20.571 -5.004 -0.862 1.00 0.00 H new ATOM 0 HB3 ALA A 88 20.073 -4.269 -2.405 1.00 0.00 H new ATOM 1422 N LEU A 89 19.609 -1.213 -1.239 1.00 0.00 N ATOM 1423 CA LEU A 89 19.416 0.129 -1.763 1.00 0.00 C ATOM 1424 C LEU A 89 20.483 0.439 -2.794 1.00 0.00 C ATOM 1425 O LEU A 89 21.489 -0.262 -2.861 1.00 0.00 O ATOM 1426 CB LEU A 89 19.396 1.204 -0.671 1.00 0.00 C ATOM 1427 CG LEU A 89 19.139 0.808 0.789 1.00 0.00 C ATOM 1428 CD1 LEU A 89 19.007 2.080 1.636 1.00 0.00 C ATOM 1429 CD2 LEU A 89 17.909 -0.072 0.997 1.00 0.00 C ATOM 0 H LEU A 89 20.521 -1.354 -0.805 1.00 0.00 H new ATOM 0 HA LEU A 89 18.432 0.150 -2.232 1.00 0.00 H new ATOM 0 HB2 LEU A 89 20.357 1.717 -0.704 1.00 0.00 H new ATOM 0 HB3 LEU A 89 18.635 1.934 -0.948 1.00 0.00 H new ATOM 0 HG LEU A 89 19.993 0.206 1.099 1.00 0.00 H new ATOM 0 HD11 LEU A 89 18.824 1.808 2.675 1.00 0.00 H new ATOM 0 HD12 LEU A 89 19.928 2.659 1.569 1.00 0.00 H new ATOM 0 HD13 LEU A 89 18.175 2.679 1.266 1.00 0.00 H new ATOM 0 HD21 LEU A 89 17.803 -0.304 2.057 1.00 0.00 H new ATOM 0 HD22 LEU A 89 17.021 0.456 0.650 1.00 0.00 H new ATOM 0 HD23 LEU A 89 18.024 -0.997 0.433 1.00 0.00 H new ATOM 1441 N VAL A 90 20.244 1.474 -3.593 1.00 0.00 N ATOM 1442 CA VAL A 90 20.952 1.716 -4.834 1.00 0.00 C ATOM 1443 C VAL A 90 21.134 3.220 -5.012 1.00 0.00 C ATOM 1444 O VAL A 90 20.158 3.966 -4.887 1.00 0.00 O ATOM 1445 CB VAL A 90 20.127 1.069 -5.962 1.00 0.00 C ATOM 1446 CG1 VAL A 90 20.569 1.518 -7.356 1.00 0.00 C ATOM 1447 CG2 VAL A 90 20.205 -0.463 -5.851 1.00 0.00 C ATOM 0 H VAL A 90 19.537 2.180 -3.387 1.00 0.00 H new ATOM 0 HA VAL A 90 21.949 1.276 -4.842 1.00 0.00 H new ATOM 0 HB VAL A 90 19.097 1.402 -5.837 1.00 0.00 H new ATOM 0 HG11 VAL A 90 19.951 1.029 -8.109 1.00 0.00 H new ATOM 0 HG12 VAL A 90 20.458 2.599 -7.442 1.00 0.00 H new ATOM 0 HG13 VAL A 90 21.613 1.247 -7.512 1.00 0.00 H new ATOM 0 HG21 VAL A 90 19.620 -0.916 -6.651 1.00 0.00 H new ATOM 0 HG22 VAL A 90 21.244 -0.782 -5.936 1.00 0.00 H new ATOM 0 HG23 VAL A 90 19.807 -0.779 -4.887 1.00 0.00 H new ATOM 1457 N SER A 91 22.352 3.629 -5.370 1.00 0.00 N ATOM 1458 CA SER A 91 22.832 5.003 -5.436 1.00 0.00 C ATOM 1459 C SER A 91 22.502 5.787 -4.149 1.00 0.00 C ATOM 1460 O SER A 91 21.776 6.784 -4.200 1.00 0.00 O ATOM 1461 CB SER A 91 22.324 5.654 -6.730 1.00 0.00 C ATOM 1462 OG SER A 91 23.121 6.775 -7.031 1.00 0.00 O ATOM 0 H SER A 91 23.075 2.961 -5.639 1.00 0.00 H new ATOM 0 HA SER A 91 23.921 5.016 -5.482 1.00 0.00 H new ATOM 0 HB2 SER A 91 22.360 4.937 -7.550 1.00 0.00 H new ATOM 0 HB3 SER A 91 21.282 5.954 -6.615 1.00 0.00 H new ATOM 0 HG SER A 91 22.800 7.192 -7.858 1.00 0.00 H new ATOM 1468 N PRO A 92 22.980 5.329 -2.974 1.00 0.00 N ATOM 1469 CA PRO A 92 22.797 6.013 -1.708 1.00 0.00 C ATOM 1470 C PRO A 92 23.716 7.234 -1.673 1.00 0.00 C ATOM 1471 O PRO A 92 24.880 7.181 -1.267 1.00 0.00 O ATOM 1472 CB PRO A 92 23.102 4.975 -0.631 1.00 0.00 C ATOM 1473 CG PRO A 92 24.200 4.145 -1.299 1.00 0.00 C ATOM 1474 CD PRO A 92 23.836 4.172 -2.777 1.00 0.00 C ATOM 0 HA PRO A 92 21.789 6.397 -1.551 1.00 0.00 H new ATOM 0 HB2 PRO A 92 23.444 5.436 0.296 1.00 0.00 H new ATOM 0 HB3 PRO A 92 22.228 4.373 -0.384 1.00 0.00 H new ATOM 0 HG2 PRO A 92 25.187 4.574 -1.123 1.00 0.00 H new ATOM 0 HG3 PRO A 92 24.221 3.126 -0.912 1.00 0.00 H new ATOM 0 HD2 PRO A 92 24.731 4.243 -3.395 1.00 0.00 H new ATOM 0 HD3 PRO A 92 23.321 3.256 -3.066 1.00 0.00 H new ATOM 1482 N ASN A 93 23.155 8.349 -2.112 1.00 0.00 N ATOM 1483 CA ASN A 93 23.715 9.679 -2.042 1.00 0.00 C ATOM 1484 C ASN A 93 24.172 10.033 -0.638 1.00 0.00 C ATOM 1485 O ASN A 93 23.591 9.596 0.354 1.00 0.00 O ATOM 1486 CB ASN A 93 22.688 10.720 -2.544 1.00 0.00 C ATOM 1487 CG ASN A 93 21.294 10.598 -1.906 1.00 0.00 C ATOM 1488 OD1 ASN A 93 20.737 9.512 -1.795 1.00 0.00 O ATOM 1489 ND2 ASN A 93 20.659 11.664 -1.465 1.00 0.00 N ATOM 0 H ASN A 93 22.236 8.343 -2.555 1.00 0.00 H new ATOM 0 HA ASN A 93 24.593 9.695 -2.687 1.00 0.00 H new ATOM 0 HB2 ASN A 93 23.077 11.719 -2.349 1.00 0.00 H new ATOM 0 HB3 ASN A 93 22.589 10.622 -3.625 1.00 0.00 H new ATOM 0 HD21 ASN A 93 19.733 11.570 -1.047 1.00 0.00 H new ATOM 0 HD22 ASN A 93 21.093 12.584 -1.541 1.00 0.00 H new ATOM 1496 N GLU A 94 25.152 10.937 -0.563 1.00 0.00 N ATOM 1497 CA GLU A 94 25.813 11.391 0.664 1.00 0.00 C ATOM 1498 C GLU A 94 24.792 11.891 1.691 1.00 0.00 C ATOM 1499 O GLU A 94 24.979 11.756 2.900 1.00 0.00 O ATOM 1500 CB GLU A 94 26.823 12.501 0.294 1.00 0.00 C ATOM 1501 CG GLU A 94 27.603 13.059 1.493 1.00 0.00 C ATOM 1502 CD GLU A 94 28.504 14.245 1.125 1.00 0.00 C ATOM 1503 OE1 GLU A 94 27.983 15.377 0.981 1.00 0.00 O ATOM 1504 OE2 GLU A 94 29.739 14.075 1.001 1.00 0.00 O ATOM 0 H GLU A 94 25.524 11.394 -1.395 1.00 0.00 H new ATOM 0 HA GLU A 94 26.340 10.556 1.126 1.00 0.00 H new ATOM 0 HB2 GLU A 94 27.531 12.106 -0.435 1.00 0.00 H new ATOM 0 HB3 GLU A 94 26.288 13.318 -0.191 1.00 0.00 H new ATOM 0 HG2 GLU A 94 26.898 13.371 2.264 1.00 0.00 H new ATOM 0 HG3 GLU A 94 28.214 12.265 1.922 1.00 0.00 H new ATOM 1511 N LYS A 95 23.685 12.444 1.194 1.00 0.00 N ATOM 1512 CA LYS A 95 22.595 13.025 1.945 1.00 0.00 C ATOM 1513 C LYS A 95 21.900 11.936 2.739 1.00 0.00 C ATOM 1514 O LYS A 95 21.630 12.144 3.918 1.00 0.00 O ATOM 1515 CB LYS A 95 21.696 13.761 0.932 1.00 0.00 C ATOM 1516 CG LYS A 95 21.057 15.071 1.402 1.00 0.00 C ATOM 1517 CD LYS A 95 19.683 14.884 2.027 1.00 0.00 C ATOM 1518 CE LYS A 95 19.619 14.270 3.422 1.00 0.00 C ATOM 1519 NZ LYS A 95 20.663 14.786 4.322 1.00 0.00 N ATOM 0 H LYS A 95 23.525 12.496 0.188 1.00 0.00 H new ATOM 0 HA LYS A 95 22.921 13.754 2.686 1.00 0.00 H new ATOM 0 HB2 LYS A 95 22.289 13.972 0.042 1.00 0.00 H new ATOM 0 HB3 LYS A 95 20.898 13.083 0.630 1.00 0.00 H new ATOM 0 HG2 LYS A 95 21.716 15.548 2.128 1.00 0.00 H new ATOM 0 HG3 LYS A 95 20.972 15.750 0.554 1.00 0.00 H new ATOM 0 HD2 LYS A 95 19.196 15.859 2.066 1.00 0.00 H new ATOM 0 HD3 LYS A 95 19.092 14.259 1.358 1.00 0.00 H new ATOM 0 HE2 LYS A 95 18.640 14.470 3.857 1.00 0.00 H new ATOM 0 HE3 LYS A 95 19.717 13.187 3.342 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 20.298 14.818 5.295 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 21.494 14.161 4.284 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 20.936 15.744 4.023 1.00 0.00 H new ATOM 1533 N VAL A 96 21.639 10.792 2.123 1.00 0.00 N ATOM 1534 CA VAL A 96 21.119 9.595 2.751 1.00 0.00 C ATOM 1535 C VAL A 96 22.196 8.916 3.571 1.00 0.00 C ATOM 1536 O VAL A 96 21.895 8.582 4.715 1.00 0.00 O ATOM 1537 CB VAL A 96 20.450 8.735 1.661 1.00 0.00 C ATOM 1538 CG1 VAL A 96 20.965 7.291 1.567 1.00 0.00 C ATOM 1539 CG2 VAL A 96 18.933 8.849 1.865 1.00 0.00 C ATOM 0 H VAL A 96 21.793 10.672 1.122 1.00 0.00 H new ATOM 0 HA VAL A 96 20.342 9.815 3.483 1.00 0.00 H new ATOM 0 HB VAL A 96 20.726 9.123 0.680 1.00 0.00 H new ATOM 0 HG11 VAL A 96 20.434 6.766 0.772 1.00 0.00 H new ATOM 0 HG12 VAL A 96 22.032 7.299 1.347 1.00 0.00 H new ATOM 0 HG13 VAL A 96 20.794 6.781 2.515 1.00 0.00 H new ATOM 0 HG21 VAL A 96 18.419 8.253 1.111 1.00 0.00 H new ATOM 0 HG22 VAL A 96 18.671 8.483 2.858 1.00 0.00 H new ATOM 0 HG23 VAL A 96 18.631 9.892 1.771 1.00 0.00 H new ATOM 1549 N GLU A 97 23.428 8.761 3.077 1.00 0.00 N ATOM 1550 CA GLU A 97 24.471 8.039 3.800 1.00 0.00 C ATOM 1551 C GLU A 97 24.718 8.678 5.150 1.00 0.00 C ATOM 1552 O GLU A 97 25.135 8.007 6.087 1.00 0.00 O ATOM 1553 CB GLU A 97 25.785 7.980 3.008 1.00 0.00 C ATOM 1554 CG GLU A 97 25.793 6.734 2.126 1.00 0.00 C ATOM 1555 CD GLU A 97 27.197 6.271 1.748 1.00 0.00 C ATOM 1556 OE1 GLU A 97 27.999 7.066 1.197 1.00 0.00 O ATOM 1557 OE2 GLU A 97 27.517 5.091 1.999 1.00 0.00 O ATOM 0 H GLU A 97 23.725 9.130 2.174 1.00 0.00 H new ATOM 0 HA GLU A 97 24.117 7.018 3.939 1.00 0.00 H new ATOM 0 HB2 GLU A 97 25.892 8.874 2.394 1.00 0.00 H new ATOM 0 HB3 GLU A 97 26.634 7.960 3.692 1.00 0.00 H new ATOM 0 HG2 GLU A 97 25.279 5.926 2.646 1.00 0.00 H new ATOM 0 HG3 GLU A 97 25.228 6.938 1.216 1.00 0.00 H new ATOM 1564 N ARG A 98 24.393 9.959 5.291 1.00 0.00 N ATOM 1565 CA ARG A 98 24.473 10.696 6.510 1.00 0.00 C ATOM 1566 C ARG A 98 23.675 10.026 7.600 1.00 0.00 C ATOM 1567 O ARG A 98 24.142 9.613 8.657 1.00 0.00 O ATOM 1568 CB ARG A 98 23.865 12.042 6.122 1.00 0.00 C ATOM 1569 CG ARG A 98 24.618 13.186 6.679 1.00 0.00 C ATOM 1570 CD ARG A 98 24.148 13.634 8.057 1.00 0.00 C ATOM 1571 NE ARG A 98 24.900 14.827 8.456 1.00 0.00 N ATOM 1572 CZ ARG A 98 24.808 16.063 7.958 1.00 0.00 C ATOM 1573 NH1 ARG A 98 23.875 16.401 7.073 1.00 0.00 N ATOM 1574 NH2 ARG A 98 25.686 16.963 8.357 1.00 0.00 N ATOM 0 H ARG A 98 24.053 10.522 4.511 1.00 0.00 H new ATOM 0 HA ARG A 98 25.485 10.778 6.907 1.00 0.00 H new ATOM 0 HB2 ARG A 98 23.837 12.124 5.035 1.00 0.00 H new ATOM 0 HB3 ARG A 98 22.834 12.085 6.472 1.00 0.00 H new ATOM 0 HG2 ARG A 98 25.673 12.918 6.737 1.00 0.00 H new ATOM 0 HG3 ARG A 98 24.540 14.027 5.990 1.00 0.00 H new ATOM 0 HD2 ARG A 98 23.080 13.852 8.038 1.00 0.00 H new ATOM 0 HD3 ARG A 98 24.297 12.835 8.783 1.00 0.00 H new ATOM 0 HE ARG A 98 25.578 14.697 9.207 1.00 0.00 H new ATOM 0 HH11 ARG A 98 23.200 15.706 6.753 1.00 0.00 H new ATOM 0 HH12 ARG A 98 23.834 17.355 6.714 1.00 0.00 H new ATOM 0 HH21 ARG A 98 26.410 16.707 9.028 1.00 0.00 H new ATOM 0 HH22 ARG A 98 25.641 17.915 7.994 1.00 0.00 H new ATOM 1588 N VAL A 99 22.398 9.973 7.296 1.00 0.00 N ATOM 1589 CA VAL A 99 21.324 9.637 8.170 1.00 0.00 C ATOM 1590 C VAL A 99 21.451 8.151 8.385 1.00 0.00 C ATOM 1591 O VAL A 99 21.415 7.688 9.512 1.00 0.00 O ATOM 1592 CB VAL A 99 19.989 9.979 7.480 1.00 0.00 C ATOM 1593 CG1 VAL A 99 18.847 10.119 8.489 1.00 0.00 C ATOM 1594 CG2 VAL A 99 20.103 11.244 6.642 1.00 0.00 C ATOM 0 H VAL A 99 22.070 10.182 6.353 1.00 0.00 H new ATOM 0 HA VAL A 99 21.353 10.180 9.114 1.00 0.00 H new ATOM 0 HB VAL A 99 19.757 9.145 6.818 1.00 0.00 H new ATOM 0 HG11 VAL A 99 17.924 10.360 7.962 1.00 0.00 H new ATOM 0 HG12 VAL A 99 18.722 9.181 9.029 1.00 0.00 H new ATOM 0 HG13 VAL A 99 19.081 10.916 9.195 1.00 0.00 H new ATOM 0 HG21 VAL A 99 19.144 11.455 6.170 1.00 0.00 H new ATOM 0 HG22 VAL A 99 20.385 12.080 7.282 1.00 0.00 H new ATOM 0 HG23 VAL A 99 20.863 11.104 5.873 1.00 0.00 H new ATOM 1604 N LEU A 100 21.655 7.421 7.290 1.00 0.00 N ATOM 1605 CA LEU A 100 21.819 5.995 7.272 1.00 0.00 C ATOM 1606 C LEU A 100 23.021 5.540 8.064 1.00 0.00 C ATOM 1607 O LEU A 100 23.021 4.388 8.509 1.00 0.00 O ATOM 1608 CB LEU A 100 21.821 5.496 5.808 1.00 0.00 C ATOM 1609 CG LEU A 100 20.364 5.385 5.300 1.00 0.00 C ATOM 1610 CD1 LEU A 100 19.477 6.380 4.620 1.00 0.00 C ATOM 1611 CD2 LEU A 100 20.027 4.021 4.671 1.00 0.00 C ATOM 0 H LEU A 100 21.710 7.838 6.361 1.00 0.00 H new ATOM 0 HA LEU A 100 20.971 5.536 7.780 1.00 0.00 H new ATOM 0 HB2 LEU A 100 22.386 6.184 5.179 1.00 0.00 H new ATOM 0 HB3 LEU A 100 22.315 4.527 5.743 1.00 0.00 H new ATOM 0 HG LEU A 100 20.115 5.671 6.322 1.00 0.00 H new ATOM 0 HD11 LEU A 100 18.508 5.924 4.416 1.00 0.00 H new ATOM 0 HD12 LEU A 100 19.341 7.247 5.266 1.00 0.00 H new ATOM 0 HD13 LEU A 100 19.935 6.695 3.682 1.00 0.00 H new ATOM 0 HD21 LEU A 100 18.989 4.020 4.339 1.00 0.00 H new ATOM 0 HD22 LEU A 100 20.681 3.842 3.818 1.00 0.00 H new ATOM 0 HD23 LEU A 100 20.172 3.233 5.411 1.00 0.00 H new ATOM 1623 N SER A 101 23.966 6.435 8.316 1.00 0.00 N ATOM 1624 CA SER A 101 25.061 6.094 9.214 1.00 0.00 C ATOM 1625 C SER A 101 24.627 6.409 10.650 1.00 0.00 C ATOM 1626 O SER A 101 24.589 5.517 11.501 1.00 0.00 O ATOM 1627 CB SER A 101 26.319 6.816 8.737 1.00 0.00 C ATOM 1628 OG SER A 101 26.892 6.074 7.673 1.00 0.00 O ATOM 0 H SER A 101 23.999 7.376 7.925 1.00 0.00 H new ATOM 0 HA SER A 101 25.307 5.032 9.205 1.00 0.00 H new ATOM 0 HB2 SER A 101 26.073 7.825 8.405 1.00 0.00 H new ATOM 0 HB3 SER A 101 27.032 6.915 9.556 1.00 0.00 H new ATOM 0 HG SER A 101 26.574 6.430 6.817 1.00 0.00 H new ATOM 1634 N LEU A 102 24.201 7.649 10.909 1.00 0.00 N ATOM 1635 CA LEU A 102 23.760 8.142 12.215 1.00 0.00 C ATOM 1636 C LEU A 102 22.703 7.247 12.869 1.00 0.00 C ATOM 1637 O LEU A 102 22.826 6.880 14.035 1.00 0.00 O ATOM 1638 CB LEU A 102 23.187 9.562 12.042 1.00 0.00 C ATOM 1639 CG LEU A 102 24.243 10.650 11.797 1.00 0.00 C ATOM 1640 CD1 LEU A 102 23.540 11.935 11.363 1.00 0.00 C ATOM 1641 CD2 LEU A 102 25.070 10.913 13.057 1.00 0.00 C ATOM 0 H LEU A 102 24.152 8.365 10.184 1.00 0.00 H new ATOM 0 HA LEU A 102 24.628 8.142 12.874 1.00 0.00 H new ATOM 0 HB2 LEU A 102 22.487 9.558 11.206 1.00 0.00 H new ATOM 0 HB3 LEU A 102 22.617 9.821 12.934 1.00 0.00 H new ATOM 0 HG LEU A 102 24.922 10.309 11.015 1.00 0.00 H new ATOM 0 HD11 LEU A 102 24.282 12.714 11.187 1.00 0.00 H new ATOM 0 HD12 LEU A 102 22.981 11.752 10.445 1.00 0.00 H new ATOM 0 HD13 LEU A 102 22.855 12.257 12.147 1.00 0.00 H new ATOM 0 HD21 LEU A 102 25.809 11.688 12.852 1.00 0.00 H new ATOM 0 HD22 LEU A 102 24.413 11.242 13.862 1.00 0.00 H new ATOM 0 HD23 LEU A 102 25.579 9.997 13.356 1.00 0.00 H new ATOM 1653 N THR A 103 21.643 6.926 12.138 1.00 0.00 N ATOM 1654 CA THR A 103 20.423 6.306 12.633 1.00 0.00 C ATOM 1655 C THR A 103 20.485 4.776 12.557 1.00 0.00 C ATOM 1656 O THR A 103 19.496 4.112 12.876 1.00 0.00 O ATOM 1657 CB THR A 103 19.248 6.915 11.845 1.00 0.00 C ATOM 1658 OG1 THR A 103 18.067 6.907 12.619 1.00 0.00 O ATOM 1659 CG2 THR A 103 18.973 6.269 10.481 1.00 0.00 C ATOM 0 H THR A 103 21.611 7.100 11.134 1.00 0.00 H new ATOM 0 HA THR A 103 20.287 6.514 13.694 1.00 0.00 H new ATOM 0 HB THR A 103 19.562 7.937 11.633 1.00 0.00 H new ATOM 0 HG1 THR A 103 17.334 7.299 12.101 1.00 0.00 H new ATOM 0 HG21 THR A 103 18.128 6.768 10.006 1.00 0.00 H new ATOM 0 HG22 THR A 103 19.855 6.366 9.848 1.00 0.00 H new ATOM 0 HG23 THR A 103 18.740 5.213 10.619 1.00 0.00 H new ATOM 1667 N ASN A 104 21.629 4.218 12.138 1.00 0.00 N ATOM 1668 CA ASN A 104 21.853 2.804 11.869 1.00 0.00 C ATOM 1669 C ASN A 104 20.825 2.304 10.856 1.00 0.00 C ATOM 1670 O ASN A 104 19.837 1.656 11.196 1.00 0.00 O ATOM 1671 CB ASN A 104 21.874 1.959 13.156 1.00 0.00 C ATOM 1672 CG ASN A 104 22.695 2.595 14.260 1.00 0.00 C ATOM 1673 OD1 ASN A 104 23.904 2.746 14.123 1.00 0.00 O ATOM 1674 ND2 ASN A 104 22.069 3.022 15.341 1.00 0.00 N ATOM 0 H ASN A 104 22.465 4.778 11.971 1.00 0.00 H new ATOM 0 HA ASN A 104 22.845 2.689 11.433 1.00 0.00 H new ATOM 0 HB2 ASN A 104 20.852 1.813 13.507 1.00 0.00 H new ATOM 0 HB3 ASN A 104 22.278 0.972 12.931 1.00 0.00 H new ATOM 0 HD21 ASN A 104 22.592 3.488 16.083 1.00 0.00 H new ATOM 0 HD22 ASN A 104 21.062 2.886 15.435 1.00 0.00 H new ATOM 1681 N LEU A 105 21.054 2.622 9.587 1.00 0.00 N ATOM 1682 CA LEU A 105 20.220 2.196 8.469 1.00 0.00 C ATOM 1683 C LEU A 105 21.094 1.447 7.466 1.00 0.00 C ATOM 1684 O LEU A 105 20.877 0.264 7.218 1.00 0.00 O ATOM 1685 CB LEU A 105 19.445 3.374 7.918 1.00 0.00 C ATOM 1686 CG LEU A 105 18.021 3.063 7.414 1.00 0.00 C ATOM 1687 CD1 LEU A 105 17.866 1.765 6.612 1.00 0.00 C ATOM 1688 CD2 LEU A 105 17.071 3.045 8.611 1.00 0.00 C ATOM 0 H LEU A 105 21.845 3.198 9.300 1.00 0.00 H new ATOM 0 HA LEU A 105 19.450 1.490 8.779 1.00 0.00 H new ATOM 0 HB2 LEU A 105 19.377 4.136 8.695 1.00 0.00 H new ATOM 0 HB3 LEU A 105 20.015 3.807 7.096 1.00 0.00 H new ATOM 0 HG LEU A 105 17.779 3.855 6.706 1.00 0.00 H new ATOM 0 HD11 LEU A 105 16.826 1.647 6.308 1.00 0.00 H new ATOM 0 HD12 LEU A 105 18.500 1.807 5.726 1.00 0.00 H new ATOM 0 HD13 LEU A 105 18.162 0.918 7.231 1.00 0.00 H new ATOM 0 HD21 LEU A 105 16.059 2.826 8.269 1.00 0.00 H new ATOM 0 HD22 LEU A 105 17.390 2.278 9.317 1.00 0.00 H new ATOM 0 HD23 LEU A 105 17.086 4.018 9.102 1.00 0.00 H new ATOM 1700 N ASP A 106 22.166 2.096 7.003 1.00 0.00 N ATOM 1701 CA ASP A 106 23.242 1.494 6.211 1.00 0.00 C ATOM 1702 C ASP A 106 23.916 0.375 6.998 1.00 0.00 C ATOM 1703 O ASP A 106 24.335 -0.631 6.431 1.00 0.00 O ATOM 1704 CB ASP A 106 24.272 2.579 5.850 1.00 0.00 C ATOM 1705 CG ASP A 106 25.612 2.024 5.368 1.00 0.00 C ATOM 1706 OD1 ASP A 106 26.439 1.662 6.231 1.00 0.00 O ATOM 1707 OD2 ASP A 106 25.885 2.035 4.149 1.00 0.00 O ATOM 0 H ASP A 106 22.314 3.090 7.176 1.00 0.00 H new ATOM 0 HA ASP A 106 22.823 1.070 5.298 1.00 0.00 H new ATOM 0 HB2 ASP A 106 23.854 3.219 5.073 1.00 0.00 H new ATOM 0 HB3 ASP A 106 24.443 3.209 6.723 1.00 0.00 H new ATOM 1712 N ARG A 107 23.965 0.515 8.327 1.00 0.00 N ATOM 1713 CA ARG A 107 24.592 -0.478 9.187 1.00 0.00 C ATOM 1714 C ARG A 107 23.753 -1.746 9.344 1.00 0.00 C ATOM 1715 O ARG A 107 24.164 -2.610 10.125 1.00 0.00 O ATOM 1716 CB ARG A 107 24.947 0.129 10.562 1.00 0.00 C ATOM 1717 CG ARG A 107 25.869 1.353 10.477 1.00 0.00 C ATOM 1718 CD ARG A 107 26.439 1.747 11.848 1.00 0.00 C ATOM 1719 NE ARG A 107 27.667 2.537 11.687 1.00 0.00 N ATOM 1720 CZ ARG A 107 28.528 2.937 12.629 1.00 0.00 C ATOM 1721 NH1 ARG A 107 28.303 2.766 13.928 1.00 0.00 N ATOM 1722 NH2 ARG A 107 29.636 3.542 12.237 1.00 0.00 N ATOM 0 H ARG A 107 23.574 1.313 8.827 1.00 0.00 H new ATOM 0 HA ARG A 107 25.515 -0.780 8.692 1.00 0.00 H new ATOM 0 HB2 ARG A 107 24.027 0.413 11.072 1.00 0.00 H new ATOM 0 HB3 ARG A 107 25.427 -0.635 11.173 1.00 0.00 H new ATOM 0 HG2 ARG A 107 26.690 1.141 9.792 1.00 0.00 H new ATOM 0 HG3 ARG A 107 25.315 2.194 10.060 1.00 0.00 H new ATOM 0 HD2 ARG A 107 25.699 2.323 12.404 1.00 0.00 H new ATOM 0 HD3 ARG A 107 26.650 0.851 12.432 1.00 0.00 H new ATOM 0 HE ARG A 107 27.892 2.817 10.732 1.00 0.00 H new ATOM 0 HH11 ARG A 107 27.444 2.313 14.242 1.00 0.00 H new ATOM 0 HH12 ARG A 107 28.989 3.088 14.611 1.00 0.00 H new ATOM 0 HH21 ARG A 107 29.812 3.690 11.243 1.00 0.00 H new ATOM 0 HH22 ARG A 107 30.315 3.860 12.928 1.00 0.00 H new ATOM 1736 N ILE A 108 22.588 -1.841 8.692 1.00 0.00 N ATOM 1737 CA ILE A 108 21.603 -2.879 8.917 1.00 0.00 C ATOM 1738 C ILE A 108 21.101 -3.446 7.583 1.00 0.00 C ATOM 1739 O ILE A 108 20.910 -4.658 7.494 1.00 0.00 O ATOM 1740 CB ILE A 108 20.462 -2.314 9.797 1.00 0.00 C ATOM 1741 CG1 ILE A 108 21.007 -1.544 11.025 1.00 0.00 C ATOM 1742 CG2 ILE A 108 19.552 -3.451 10.270 1.00 0.00 C ATOM 1743 CD1 ILE A 108 19.962 -1.236 12.105 1.00 0.00 C ATOM 0 H ILE A 108 22.307 -1.173 7.974 1.00 0.00 H new ATOM 0 HA ILE A 108 22.054 -3.714 9.452 1.00 0.00 H new ATOM 0 HB ILE A 108 19.894 -1.613 9.185 1.00 0.00 H new ATOM 0 HG12 ILE A 108 21.812 -2.126 11.473 1.00 0.00 H new ATOM 0 HG13 ILE A 108 21.444 -0.606 10.684 1.00 0.00 H new ATOM 0 HG21 ILE A 108 18.752 -3.044 10.888 1.00 0.00 H new ATOM 0 HG22 ILE A 108 19.121 -3.956 9.405 1.00 0.00 H new ATOM 0 HG23 ILE A 108 20.134 -4.164 10.853 1.00 0.00 H new ATOM 0 HD11 ILE A 108 20.435 -0.695 12.925 1.00 0.00 H new ATOM 0 HD12 ILE A 108 19.167 -0.625 11.678 1.00 0.00 H new ATOM 0 HD13 ILE A 108 19.541 -2.169 12.480 1.00 0.00 H new ATOM 1755 N VAL A 109 20.887 -2.621 6.552 1.00 0.00 N ATOM 1756 CA VAL A 109 20.413 -3.067 5.244 1.00 0.00 C ATOM 1757 C VAL A 109 21.573 -3.017 4.258 1.00 0.00 C ATOM 1758 O VAL A 109 22.504 -2.228 4.423 1.00 0.00 O ATOM 1759 CB VAL A 109 19.252 -2.180 4.748 1.00 0.00 C ATOM 1760 CG1 VAL A 109 18.499 -2.836 3.587 1.00 0.00 C ATOM 1761 CG2 VAL A 109 18.191 -1.885 5.828 1.00 0.00 C ATOM 0 H VAL A 109 21.041 -1.614 6.607 1.00 0.00 H new ATOM 0 HA VAL A 109 20.040 -4.088 5.326 1.00 0.00 H new ATOM 0 HB VAL A 109 19.740 -1.253 4.447 1.00 0.00 H new ATOM 0 HG11 VAL A 109 17.688 -2.183 3.264 1.00 0.00 H new ATOM 0 HG12 VAL A 109 19.185 -3.002 2.756 1.00 0.00 H new ATOM 0 HG13 VAL A 109 18.087 -3.791 3.914 1.00 0.00 H new ATOM 0 HG21 VAL A 109 17.407 -1.257 5.406 1.00 0.00 H new ATOM 0 HG22 VAL A 109 17.757 -2.822 6.177 1.00 0.00 H new ATOM 0 HG23 VAL A 109 18.659 -1.368 6.666 1.00 0.00 H new ATOM 1771 N LYS A 110 21.518 -3.844 3.215 1.00 0.00 N ATOM 1772 CA LYS A 110 22.488 -3.822 2.135 1.00 0.00 C ATOM 1773 C LYS A 110 22.332 -2.583 1.273 1.00 0.00 C ATOM 1774 O LYS A 110 21.249 -2.002 1.177 1.00 0.00 O ATOM 1775 CB LYS A 110 22.332 -5.091 1.315 1.00 0.00 C ATOM 1776 CG LYS A 110 22.985 -6.268 2.051 1.00 0.00 C ATOM 1777 CD LYS A 110 24.327 -6.692 1.454 1.00 0.00 C ATOM 1778 CE LYS A 110 25.412 -5.612 1.309 1.00 0.00 C ATOM 1779 NZ LYS A 110 25.974 -5.103 2.577 1.00 0.00 N ATOM 0 H LYS A 110 20.792 -4.551 3.100 1.00 0.00 H new ATOM 0 HA LYS A 110 23.493 -3.783 2.554 1.00 0.00 H new ATOM 0 HB2 LYS A 110 21.275 -5.298 1.145 1.00 0.00 H new ATOM 0 HB3 LYS A 110 22.793 -4.961 0.336 1.00 0.00 H new ATOM 0 HG2 LYS A 110 23.131 -5.996 3.096 1.00 0.00 H new ATOM 0 HG3 LYS A 110 22.304 -7.119 2.035 1.00 0.00 H new ATOM 0 HD2 LYS A 110 24.731 -7.494 2.071 1.00 0.00 H new ATOM 0 HD3 LYS A 110 24.138 -7.114 0.467 1.00 0.00 H new ATOM 0 HE2 LYS A 110 26.226 -6.017 0.708 1.00 0.00 H new ATOM 0 HE3 LYS A 110 24.993 -4.772 0.754 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 26.496 -4.222 2.396 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 25.202 -4.917 3.249 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 26.620 -5.812 2.980 1.00 0.00 H new ATOM 1793 N ILE A 111 23.414 -2.237 0.590 1.00 0.00 N ATOM 1794 CA ILE A 111 23.543 -1.009 -0.172 1.00 0.00 C ATOM 1795 C ILE A 111 24.500 -1.298 -1.345 1.00 0.00 C ATOM 1796 O ILE A 111 25.428 -2.099 -1.193 1.00 0.00 O ATOM 1797 CB ILE A 111 24.029 0.095 0.822 1.00 0.00 C ATOM 1798 CG1 ILE A 111 22.968 1.206 1.036 1.00 0.00 C ATOM 1799 CG2 ILE A 111 25.397 0.715 0.491 1.00 0.00 C ATOM 1800 CD1 ILE A 111 22.503 1.324 2.495 1.00 0.00 C ATOM 0 H ILE A 111 24.249 -2.822 0.551 1.00 0.00 H new ATOM 0 HA ILE A 111 22.614 -0.648 -0.613 1.00 0.00 H new ATOM 0 HB ILE A 111 24.167 -0.447 1.758 1.00 0.00 H new ATOM 0 HG12 ILE A 111 23.382 2.162 0.715 1.00 0.00 H new ATOM 0 HG13 ILE A 111 22.105 1.003 0.402 1.00 0.00 H new ATOM 0 HG21 ILE A 111 25.645 1.469 1.238 1.00 0.00 H new ATOM 0 HG22 ILE A 111 26.160 -0.064 0.494 1.00 0.00 H new ATOM 0 HG23 ILE A 111 25.357 1.180 -0.494 1.00 0.00 H new ATOM 0 HD11 ILE A 111 21.761 2.119 2.577 1.00 0.00 H new ATOM 0 HD12 ILE A 111 22.060 0.380 2.813 1.00 0.00 H new ATOM 0 HD13 ILE A 111 23.357 1.557 3.131 1.00 0.00 H new ATOM 1812 N TYR A 112 24.256 -0.673 -2.501 1.00 0.00 N ATOM 1813 CA TYR A 112 24.961 -0.860 -3.774 1.00 0.00 C ATOM 1814 C TYR A 112 24.965 0.440 -4.582 1.00 0.00 C ATOM 1815 O TYR A 112 24.224 1.367 -4.254 1.00 0.00 O ATOM 1816 CB TYR A 112 24.245 -1.941 -4.592 1.00 0.00 C ATOM 1817 CG TYR A 112 24.287 -3.312 -3.961 1.00 0.00 C ATOM 1818 CD1 TYR A 112 25.383 -4.151 -4.218 1.00 0.00 C ATOM 1819 CD2 TYR A 112 23.258 -3.734 -3.099 1.00 0.00 C ATOM 1820 CE1 TYR A 112 25.474 -5.415 -3.620 1.00 0.00 C ATOM 1821 CE2 TYR A 112 23.341 -5.007 -2.501 1.00 0.00 C ATOM 1822 CZ TYR A 112 24.456 -5.841 -2.741 1.00 0.00 C ATOM 1823 OH TYR A 112 24.552 -7.029 -2.088 1.00 0.00 O ATOM 0 H TYR A 112 23.513 0.022 -2.578 1.00 0.00 H new ATOM 0 HA TYR A 112 25.989 -1.155 -3.563 1.00 0.00 H new ATOM 0 HB2 TYR A 112 23.205 -1.648 -4.732 1.00 0.00 H new ATOM 0 HB3 TYR A 112 24.698 -1.993 -5.582 1.00 0.00 H new ATOM 0 HD1 TYR A 112 26.165 -3.818 -4.884 1.00 0.00 H new ATOM 0 HD2 TYR A 112 22.415 -3.090 -2.898 1.00 0.00 H new ATOM 0 HE1 TYR A 112 26.316 -6.058 -3.830 1.00 0.00 H new ATOM 0 HE2 TYR A 112 22.546 -5.348 -1.854 1.00 0.00 H new ATOM 0 HH TYR A 112 25.258 -6.974 -1.411 1.00 0.00 H new ATOM 1833 N ASP A 113 25.742 0.510 -5.670 1.00 0.00 N ATOM 1834 CA ASP A 113 25.776 1.705 -6.509 1.00 0.00 C ATOM 1835 C ASP A 113 24.688 1.611 -7.567 1.00 0.00 C ATOM 1836 O ASP A 113 23.920 2.556 -7.745 1.00 0.00 O ATOM 1837 CB ASP A 113 27.149 1.918 -7.165 1.00 0.00 C ATOM 1838 CG ASP A 113 28.023 2.876 -6.357 1.00 0.00 C ATOM 1839 OD1 ASP A 113 27.584 4.023 -6.118 1.00 0.00 O ATOM 1840 OD2 ASP A 113 29.174 2.512 -6.017 1.00 0.00 O ATOM 0 H ASP A 113 26.351 -0.245 -5.985 1.00 0.00 H new ATOM 0 HA ASP A 113 25.596 2.569 -5.870 1.00 0.00 H new ATOM 0 HB2 ASP A 113 27.657 0.959 -7.264 1.00 0.00 H new ATOM 0 HB3 ASP A 113 27.013 2.312 -8.172 1.00 0.00 H new ATOM 1845 N THR A 114 24.584 0.479 -8.262 1.00 0.00 N ATOM 1846 CA THR A 114 23.618 0.268 -9.334 1.00 0.00 C ATOM 1847 C THR A 114 22.731 -0.924 -9.006 1.00 0.00 C ATOM 1848 O THR A 114 22.928 -1.625 -8.012 1.00 0.00 O ATOM 1849 CB THR A 114 24.340 0.108 -10.681 1.00 0.00 C ATOM 1850 OG1 THR A 114 25.262 -0.964 -10.621 1.00 0.00 O ATOM 1851 CG2 THR A 114 25.005 1.421 -11.095 1.00 0.00 C ATOM 0 H THR A 114 25.181 -0.330 -8.091 1.00 0.00 H new ATOM 0 HA THR A 114 22.972 1.142 -9.421 1.00 0.00 H new ATOM 0 HB THR A 114 23.608 -0.136 -11.451 1.00 0.00 H new ATOM 0 HG1 THR A 114 25.714 -1.056 -11.486 1.00 0.00 H new ATOM 0 HG21 THR A 114 25.511 1.287 -12.051 1.00 0.00 H new ATOM 0 HG22 THR A 114 24.247 2.198 -11.191 1.00 0.00 H new ATOM 0 HG23 THR A 114 25.732 1.715 -10.338 1.00 0.00 H new ATOM 1859 N ILE A 115 21.716 -1.145 -9.841 1.00 0.00 N ATOM 1860 CA ILE A 115 20.842 -2.290 -9.712 1.00 0.00 C ATOM 1861 C ILE A 115 21.609 -3.545 -10.096 1.00 0.00 C ATOM 1862 O ILE A 115 21.372 -4.582 -9.498 1.00 0.00 O ATOM 1863 CB ILE A 115 19.585 -2.080 -10.576 1.00 0.00 C ATOM 1864 CG1 ILE A 115 18.720 -0.947 -9.995 1.00 0.00 C ATOM 1865 CG2 ILE A 115 18.755 -3.360 -10.733 1.00 0.00 C ATOM 1866 CD1 ILE A 115 17.972 -1.312 -8.714 1.00 0.00 C ATOM 0 H ILE A 115 21.484 -0.531 -10.622 1.00 0.00 H new ATOM 0 HA ILE A 115 20.508 -2.407 -8.681 1.00 0.00 H new ATOM 0 HB ILE A 115 19.927 -1.800 -11.572 1.00 0.00 H new ATOM 0 HG12 ILE A 115 19.358 -0.086 -9.795 1.00 0.00 H new ATOM 0 HG13 ILE A 115 17.995 -0.638 -10.748 1.00 0.00 H new ATOM 0 HG21 ILE A 115 17.881 -3.154 -11.351 1.00 0.00 H new ATOM 0 HG22 ILE A 115 19.362 -4.131 -11.208 1.00 0.00 H new ATOM 0 HG23 ILE A 115 18.431 -3.706 -9.752 1.00 0.00 H new ATOM 0 HD11 ILE A 115 17.389 -0.455 -8.376 1.00 0.00 H new ATOM 0 HD12 ILE A 115 17.304 -2.151 -8.909 1.00 0.00 H new ATOM 0 HD13 ILE A 115 18.688 -1.591 -7.941 1.00 0.00 H new ATOM 1878 N SER A 116 22.506 -3.489 -11.078 1.00 0.00 N ATOM 1879 CA SER A 116 23.169 -4.685 -11.567 1.00 0.00 C ATOM 1880 C SER A 116 24.220 -5.181 -10.574 1.00 0.00 C ATOM 1881 O SER A 116 24.420 -6.393 -10.455 1.00 0.00 O ATOM 1882 CB SER A 116 23.786 -4.348 -12.916 1.00 0.00 C ATOM 1883 OG SER A 116 24.217 -5.486 -13.631 1.00 0.00 O ATOM 0 H SER A 116 22.787 -2.628 -11.547 1.00 0.00 H new ATOM 0 HA SER A 116 22.451 -5.498 -11.679 1.00 0.00 H new ATOM 0 HB2 SER A 116 23.056 -3.805 -13.516 1.00 0.00 H new ATOM 0 HB3 SER A 116 24.634 -3.680 -12.764 1.00 0.00 H new ATOM 0 HG SER A 116 24.602 -5.207 -14.488 1.00 0.00 H new ATOM 1889 N GLU A 117 24.832 -4.270 -9.806 1.00 0.00 N ATOM 1890 CA GLU A 117 25.667 -4.652 -8.683 1.00 0.00 C ATOM 1891 C GLU A 117 24.851 -5.337 -7.592 1.00 0.00 C ATOM 1892 O GLU A 117 25.420 -6.041 -6.766 1.00 0.00 O ATOM 1893 CB GLU A 117 26.352 -3.410 -8.090 1.00 0.00 C ATOM 1894 CG GLU A 117 27.756 -3.179 -8.649 1.00 0.00 C ATOM 1895 CD GLU A 117 28.662 -2.559 -7.584 1.00 0.00 C ATOM 1896 OE1 GLU A 117 28.599 -1.332 -7.360 1.00 0.00 O ATOM 1897 OE2 GLU A 117 29.440 -3.325 -6.965 1.00 0.00 O ATOM 0 H GLU A 117 24.758 -3.263 -9.951 1.00 0.00 H new ATOM 0 HA GLU A 117 26.416 -5.353 -9.051 1.00 0.00 H new ATOM 0 HB2 GLU A 117 25.738 -2.532 -8.291 1.00 0.00 H new ATOM 0 HB3 GLU A 117 26.411 -3.517 -7.007 1.00 0.00 H new ATOM 0 HG2 GLU A 117 28.179 -4.125 -8.989 1.00 0.00 H new ATOM 0 HG3 GLU A 117 27.704 -2.523 -9.518 1.00 0.00 H new ATOM 1904 N ALA A 118 23.531 -5.142 -7.568 1.00 0.00 N ATOM 1905 CA ALA A 118 22.686 -5.579 -6.484 1.00 0.00 C ATOM 1906 C ALA A 118 21.968 -6.853 -6.909 1.00 0.00 C ATOM 1907 O ALA A 118 21.845 -7.769 -6.108 1.00 0.00 O ATOM 1908 CB ALA A 118 21.715 -4.450 -6.121 1.00 0.00 C ATOM 0 H ALA A 118 23.024 -4.669 -8.316 1.00 0.00 H new ATOM 0 HA ALA A 118 23.269 -5.807 -5.592 1.00 0.00 H new ATOM 0 HB1 ALA A 118 21.072 -4.772 -5.302 1.00 0.00 H new ATOM 0 HB2 ALA A 118 22.279 -3.569 -5.814 1.00 0.00 H new ATOM 0 HB3 ALA A 118 21.102 -4.204 -6.988 1.00 0.00 H new ATOM 1914 N MET A 119 21.509 -6.953 -8.159 1.00 0.00 N ATOM 1915 CA MET A 119 20.600 -7.936 -8.689 1.00 0.00 C ATOM 1916 C MET A 119 21.028 -9.341 -8.302 1.00 0.00 C ATOM 1917 O MET A 119 20.216 -10.115 -7.808 1.00 0.00 O ATOM 1918 CB MET A 119 20.583 -7.741 -10.229 1.00 0.00 C ATOM 1919 CG MET A 119 19.445 -8.578 -10.772 1.00 0.00 C ATOM 1920 SD MET A 119 19.252 -8.693 -12.567 1.00 0.00 S ATOM 1921 CE MET A 119 18.762 -7.002 -12.996 1.00 0.00 C ATOM 0 H MET A 119 21.796 -6.286 -8.875 1.00 0.00 H new ATOM 0 HA MET A 119 19.598 -7.806 -8.279 1.00 0.00 H new ATOM 0 HB2 MET A 119 20.443 -6.690 -10.482 1.00 0.00 H new ATOM 0 HB3 MET A 119 21.532 -8.051 -10.667 1.00 0.00 H new ATOM 0 HG2 MET A 119 19.561 -9.590 -10.384 1.00 0.00 H new ATOM 0 HG3 MET A 119 18.516 -8.183 -10.361 1.00 0.00 H new ATOM 0 HE1 MET A 119 18.610 -6.929 -14.073 1.00 0.00 H new ATOM 0 HE2 MET A 119 17.835 -6.750 -12.481 1.00 0.00 H new ATOM 0 HE3 MET A 119 19.546 -6.308 -12.693 1.00 0.00 H new ATOM 1931 N GLU A 120 22.293 -9.660 -8.532 1.00 0.00 N ATOM 1932 CA GLU A 120 22.848 -10.989 -8.335 1.00 0.00 C ATOM 1933 C GLU A 120 23.640 -11.106 -7.040 1.00 0.00 C ATOM 1934 O GLU A 120 24.138 -12.191 -6.767 1.00 0.00 O ATOM 1935 CB GLU A 120 23.723 -11.314 -9.548 1.00 0.00 C ATOM 1936 CG GLU A 120 24.850 -10.283 -9.743 1.00 0.00 C ATOM 1937 CD GLU A 120 26.098 -10.820 -10.438 1.00 0.00 C ATOM 1938 OE1 GLU A 120 26.065 -11.923 -11.038 1.00 0.00 O ATOM 1939 OE2 GLU A 120 27.125 -10.110 -10.364 1.00 0.00 O ATOM 0 H GLU A 120 22.978 -8.984 -8.869 1.00 0.00 H new ATOM 0 HA GLU A 120 22.033 -11.707 -8.246 1.00 0.00 H new ATOM 0 HB2 GLU A 120 24.157 -12.306 -9.426 1.00 0.00 H new ATOM 0 HB3 GLU A 120 23.103 -11.346 -10.444 1.00 0.00 H new ATOM 0 HG2 GLU A 120 24.461 -9.446 -10.323 1.00 0.00 H new ATOM 0 HG3 GLU A 120 25.136 -9.890 -8.767 1.00 0.00 H new ATOM 1946 N GLU A 121 23.750 -10.034 -6.258 1.00 0.00 N ATOM 1947 CA GLU A 121 24.684 -9.936 -5.144 1.00 0.00 C ATOM 1948 C GLU A 121 23.963 -9.725 -3.832 1.00 0.00 C ATOM 1949 O GLU A 121 24.299 -10.328 -2.831 1.00 0.00 O ATOM 1950 CB GLU A 121 25.655 -8.793 -5.398 1.00 0.00 C ATOM 1951 CG GLU A 121 26.940 -9.000 -4.585 1.00 0.00 C ATOM 1952 CD GLU A 121 28.186 -8.368 -5.201 1.00 0.00 C ATOM 1953 OE1 GLU A 121 28.534 -8.681 -6.356 1.00 0.00 O ATOM 1954 OE2 GLU A 121 28.949 -7.718 -4.445 1.00 0.00 O ATOM 0 H GLU A 121 23.182 -9.196 -6.385 1.00 0.00 H new ATOM 0 HA GLU A 121 25.231 -10.876 -5.071 1.00 0.00 H new ATOM 0 HB2 GLU A 121 25.893 -8.737 -6.460 1.00 0.00 H new ATOM 0 HB3 GLU A 121 25.192 -7.845 -5.125 1.00 0.00 H new ATOM 0 HG2 GLU A 121 26.794 -8.587 -3.587 1.00 0.00 H new ATOM 0 HG3 GLU A 121 27.111 -10.070 -4.466 1.00 0.00 H new ATOM 1961 N VAL A 122 22.869 -8.982 -3.848 1.00 0.00 N ATOM 1962 CA VAL A 122 21.855 -9.092 -2.818 1.00 0.00 C ATOM 1963 C VAL A 122 21.405 -10.543 -2.698 1.00 0.00 C ATOM 1964 O VAL A 122 21.012 -11.019 -1.636 1.00 0.00 O ATOM 1965 CB VAL A 122 20.688 -8.151 -3.159 1.00 0.00 C ATOM 1966 CG1 VAL A 122 19.539 -8.752 -4.006 1.00 0.00 C ATOM 1967 CG2 VAL A 122 20.199 -7.596 -1.826 1.00 0.00 C ATOM 0 H VAL A 122 22.662 -8.292 -4.570 1.00 0.00 H new ATOM 0 HA VAL A 122 22.257 -8.792 -1.850 1.00 0.00 H new ATOM 0 HB VAL A 122 21.058 -7.375 -3.829 1.00 0.00 H new ATOM 0 HG11 VAL A 122 18.778 -7.991 -4.179 1.00 0.00 H new ATOM 0 HG12 VAL A 122 19.933 -9.095 -4.963 1.00 0.00 H new ATOM 0 HG13 VAL A 122 19.096 -9.594 -3.473 1.00 0.00 H new ATOM 0 HG21 VAL A 122 19.365 -6.916 -1.999 1.00 0.00 H new ATOM 0 HG22 VAL A 122 19.871 -8.417 -1.188 1.00 0.00 H new ATOM 0 HG23 VAL A 122 21.011 -7.058 -1.336 1.00 0.00 H new ATOM 1977 N ARG A 123 21.482 -11.280 -3.799 1.00 0.00 N ATOM 1978 CA ARG A 123 21.427 -12.710 -3.773 1.00 0.00 C ATOM 1979 C ARG A 123 22.791 -13.078 -3.258 1.00 0.00 C ATOM 1980 O ARG A 123 23.823 -12.835 -3.866 1.00 0.00 O ATOM 1981 CB ARG A 123 21.179 -13.297 -5.150 1.00 0.00 C ATOM 1982 CG ARG A 123 19.951 -12.679 -5.805 1.00 0.00 C ATOM 1983 CD ARG A 123 19.683 -13.164 -7.240 1.00 0.00 C ATOM 1984 NE ARG A 123 20.784 -13.984 -7.770 1.00 0.00 N ATOM 1985 CZ ARG A 123 20.814 -15.322 -7.737 1.00 0.00 C ATOM 1986 NH1 ARG A 123 19.711 -16.032 -7.526 1.00 0.00 N ATOM 1987 NH2 ARG A 123 21.972 -15.950 -7.840 1.00 0.00 N ATOM 0 H ARG A 123 21.585 -10.886 -4.734 1.00 0.00 H new ATOM 0 HA ARG A 123 20.609 -13.094 -3.163 1.00 0.00 H new ATOM 0 HB2 ARG A 123 22.052 -13.130 -5.781 1.00 0.00 H new ATOM 0 HB3 ARG A 123 21.046 -14.376 -5.069 1.00 0.00 H new ATOM 0 HG2 ARG A 123 19.078 -12.899 -5.191 1.00 0.00 H new ATOM 0 HG3 ARG A 123 20.067 -11.595 -5.817 1.00 0.00 H new ATOM 0 HD2 ARG A 123 18.760 -13.744 -7.258 1.00 0.00 H new ATOM 0 HD3 ARG A 123 19.530 -12.302 -7.889 1.00 0.00 H new ATOM 0 HE ARG A 123 21.577 -13.501 -8.191 1.00 0.00 H new ATOM 0 HH11 ARG A 123 18.819 -15.558 -7.385 1.00 0.00 H new ATOM 0 HH12 ARG A 123 19.757 -17.051 -7.505 1.00 0.00 H new ATOM 0 HH21 ARG A 123 22.835 -15.416 -7.944 1.00 0.00 H new ATOM 0 HH22 ARG A 123 22.003 -16.969 -7.816 1.00 0.00 H new ATOM 2001 N ARG A 124 22.728 -13.715 -2.123 1.00 0.00 N ATOM 2002 CA ARG A 124 23.785 -14.466 -1.483 1.00 0.00 C ATOM 2003 C ARG A 124 24.736 -13.675 -0.623 1.00 0.00 C ATOM 2004 O ARG A 124 25.791 -14.192 -0.249 1.00 0.00 O ATOM 2005 CB ARG A 124 24.509 -15.442 -2.452 1.00 0.00 C ATOM 2006 CG ARG A 124 23.766 -16.008 -3.693 1.00 0.00 C ATOM 2007 CD ARG A 124 24.241 -15.412 -5.040 1.00 0.00 C ATOM 2008 NE ARG A 124 24.500 -16.459 -6.031 1.00 0.00 N ATOM 2009 CZ ARG A 124 25.562 -16.544 -6.839 1.00 0.00 C ATOM 2010 NH1 ARG A 124 26.505 -15.615 -6.882 1.00 0.00 N ATOM 2011 NH2 ARG A 124 25.667 -17.588 -7.641 1.00 0.00 N ATOM 0 H ARG A 124 21.869 -13.727 -1.573 1.00 0.00 H new ATOM 0 HA ARG A 124 23.248 -15.077 -0.757 1.00 0.00 H new ATOM 0 HB2 ARG A 124 25.402 -14.933 -2.815 1.00 0.00 H new ATOM 0 HB3 ARG A 124 24.845 -16.294 -1.861 1.00 0.00 H new ATOM 0 HG2 ARG A 124 23.898 -17.090 -3.720 1.00 0.00 H new ATOM 0 HG3 ARG A 124 22.698 -15.820 -3.581 1.00 0.00 H new ATOM 0 HD2 ARG A 124 23.484 -14.727 -5.423 1.00 0.00 H new ATOM 0 HD3 ARG A 124 25.148 -14.828 -4.881 1.00 0.00 H new ATOM 0 HE ARG A 124 23.801 -17.197 -6.113 1.00 0.00 H new ATOM 0 HH11 ARG A 124 26.438 -14.792 -6.283 1.00 0.00 H new ATOM 0 HH12 ARG A 124 27.298 -15.722 -7.515 1.00 0.00 H new ATOM 0 HH21 ARG A 124 24.946 -18.310 -7.636 1.00 0.00 H new ATOM 0 HH22 ARG A 124 26.469 -17.673 -8.266 1.00 0.00 H new ATOM 2025 N LYS A 125 24.284 -12.522 -0.140 1.00 0.00 N ATOM 2026 CA LYS A 125 25.037 -11.674 0.761 1.00 0.00 C ATOM 2027 C LYS A 125 24.224 -11.328 1.998 1.00 0.00 C ATOM 2028 O LYS A 125 23.966 -12.232 2.822 1.00 0.00 O ATOM 2029 CB LYS A 125 25.491 -10.459 -0.049 1.00 0.00 C ATOM 2030 CG LYS A 125 26.556 -10.819 -1.102 1.00 0.00 C ATOM 2031 CD LYS A 125 27.966 -11.035 -0.531 1.00 0.00 C ATOM 2032 CE LYS A 125 29.015 -11.151 -1.650 1.00 0.00 C ATOM 2033 NZ LYS A 125 29.489 -9.850 -2.173 1.00 0.00 N ATOM 0 H LYS A 125 23.364 -12.148 -0.372 1.00 0.00 H new ATOM 0 HA LYS A 125 25.918 -12.182 1.154 1.00 0.00 H new ATOM 0 HB2 LYS A 125 24.629 -10.014 -0.546 1.00 0.00 H new ATOM 0 HB3 LYS A 125 25.893 -9.705 0.627 1.00 0.00 H new ATOM 0 HG2 LYS A 125 26.245 -11.726 -1.621 1.00 0.00 H new ATOM 0 HG3 LYS A 125 26.597 -10.024 -1.846 1.00 0.00 H new ATOM 0 HD2 LYS A 125 28.224 -10.205 0.127 1.00 0.00 H new ATOM 0 HD3 LYS A 125 27.979 -11.940 0.077 1.00 0.00 H new ATOM 0 HE2 LYS A 125 29.870 -11.712 -1.274 1.00 0.00 H new ATOM 0 HE3 LYS A 125 28.591 -11.728 -2.472 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 30.179 -10.012 -2.934 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 28.682 -9.311 -2.547 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 29.939 -9.311 -1.406 1.00 0.00 H new TER 2047 LYS A 125