USER MOD reduce.3.24.130724 H: found=0, std=0, add=937, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 939 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 100 SER OG : rot 140:sc= 0.141 USER MOD Set 1.2: A 102 THR OG1 : rot 180:sc= 0 USER MOD Set 1.3: A 111 ASN : amide:sc=-0.000106 X(o=0.14,f=0.36) USER MOD Set 1.4: A 113 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 96 LYS NZ :NH3+ -126:sc= 0.00441 (180deg=0) USER MOD Set 2.2: A 97 ASN : amide:sc= 0.00443 X(o=0.0088,f=0) USER MOD Set 3.1: A 81 THR OG1 : rot -97:sc= 0.895 USER MOD Set 3.2: A 93 THR OG1 : rot 77:sc= 0.951 USER MOD Set 4.1: A 47 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Set 4.2: A 64 THR OG1 : rot 180:sc= 0 USER MOD Set 5.1: A 51 THR OG1 : rot 170:sc= -0.0336 USER MOD Set 5.2: A 60 GLN : amide:sc= 0.00365 X(o=-0.03,f=-0.028) USER MOD Set 6.1: A 30 GLN : amide:sc= 0.0325 X(o=0.16,f=-0.043) USER MOD Set 6.2: A 33 LYS NZ :NH3+ 147:sc= 0.126 (180deg=0) USER MOD Single : A 4 SER OG : rot 180:sc= -0.0128 USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 TYR OH : rot 153:sc= 0.123 USER MOD Single : A 8 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 10 GLN : amide:sc= 0 X(o=0,f=-0.083) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 12 GLN : amide:sc= -0.0339 X(o=-0.034,f=-0.042) USER MOD Single : A 14 ASN : amide:sc= 0 K(o=0,f=-2.8!) USER MOD Single : A 19 MET CE :methyl 172:sc=-0.00993 (180deg=-0.106) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 LYS NZ :NH3+ -158:sc= 0 (180deg=-0.0806) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 43 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 44 ASN : amide:sc= 0 X(o=0,f=-0.028) USER MOD Single : A 46 LYS NZ :NH3+ -164:sc= 0 (180deg=-0.138) USER MOD Single : A 49 LYS NZ :NH3+ -149:sc= 0 (180deg=-0.764) USER MOD Single : A 53 THR OG1 : rot 108:sc= 0.549 USER MOD Single : A 61 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 69 CYS SG : rot 51:sc= 1.41 USER MOD Single : A 78 LYS NZ :NH3+ -165:sc= 0.0298 (180deg=0.00862) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 GLN : amide:sc= -0.221 X(o=-0.22,f=-0.11) USER MOD Single : A 89 ASN : amide:sc= 0 X(o=0,f=-0.039) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 114 THR OG1 : rot -130:sc= -0.176 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 12 N PHE A 3 9.385 -9.748 -1.978 1.00 0.00 N ATOM 13 CA PHE A 3 8.327 -8.845 -1.436 1.00 0.00 C ATOM 14 C PHE A 3 8.321 -8.540 0.093 1.00 0.00 C ATOM 15 O PHE A 3 7.591 -7.621 0.479 1.00 0.00 O ATOM 16 CB PHE A 3 6.940 -9.376 -1.904 1.00 0.00 C ATOM 17 CG PHE A 3 6.477 -8.873 -3.278 1.00 0.00 C ATOM 18 CD1 PHE A 3 5.959 -7.578 -3.400 1.00 0.00 C ATOM 19 CD2 PHE A 3 6.552 -9.691 -4.410 1.00 0.00 C ATOM 20 CE1 PHE A 3 5.539 -7.103 -4.638 1.00 0.00 C ATOM 21 CE2 PHE A 3 6.118 -9.215 -5.645 1.00 0.00 C ATOM 22 CZ PHE A 3 5.613 -7.923 -5.757 1.00 0.00 C ATOM 0 HA PHE A 3 8.569 -7.866 -1.850 1.00 0.00 H new ATOM 0 HB2 PHE A 3 6.975 -10.465 -1.927 1.00 0.00 H new ATOM 0 HB3 PHE A 3 6.192 -9.096 -1.162 1.00 0.00 H new ATOM 0 HD1 PHE A 3 5.885 -6.945 -2.528 1.00 0.00 H new ATOM 0 HD2 PHE A 3 6.947 -10.693 -4.326 1.00 0.00 H new ATOM 0 HE1 PHE A 3 5.156 -6.097 -4.729 1.00 0.00 H new ATOM 0 HE2 PHE A 3 6.173 -9.850 -6.517 1.00 0.00 H new ATOM 0 HZ PHE A 3 5.278 -7.557 -6.716 1.00 0.00 H new ATOM 32 N SER A 4 9.116 -9.215 0.954 1.00 0.00 N ATOM 33 CA SER A 4 9.229 -8.849 2.392 1.00 0.00 C ATOM 34 C SER A 4 10.067 -7.549 2.563 1.00 0.00 C ATOM 35 O SER A 4 11.272 -7.536 2.280 1.00 0.00 O ATOM 36 CB SER A 4 9.832 -10.008 3.216 1.00 0.00 C ATOM 37 OG SER A 4 8.978 -11.145 3.223 1.00 0.00 O ATOM 0 H SER A 4 9.689 -10.014 0.683 1.00 0.00 H new ATOM 0 HA SER A 4 8.225 -8.660 2.772 1.00 0.00 H new ATOM 0 HB2 SER A 4 10.802 -10.283 2.802 1.00 0.00 H new ATOM 0 HB3 SER A 4 10.005 -9.676 4.240 1.00 0.00 H new ATOM 0 HG SER A 4 9.390 -11.860 3.751 1.00 0.00 H new ATOM 43 N GLY A 5 9.408 -6.459 2.996 1.00 0.00 N ATOM 44 CA GLY A 5 10.061 -5.138 3.088 1.00 0.00 C ATOM 45 C GLY A 5 9.145 -4.036 3.657 1.00 0.00 C ATOM 46 O GLY A 5 7.973 -3.921 3.283 1.00 0.00 O ATOM 0 H GLY A 5 8.430 -6.465 3.286 1.00 0.00 H new ATOM 0 HA2 GLY A 5 10.947 -5.223 3.717 1.00 0.00 H new ATOM 0 HA3 GLY A 5 10.401 -4.840 2.096 1.00 0.00 H new ATOM 50 N LYS A 6 9.732 -3.184 4.517 1.00 0.00 N ATOM 51 CA LYS A 6 9.092 -1.925 4.989 1.00 0.00 C ATOM 52 C LYS A 6 9.487 -0.797 3.997 1.00 0.00 C ATOM 53 O LYS A 6 10.669 -0.461 3.886 1.00 0.00 O ATOM 54 CB LYS A 6 9.569 -1.557 6.423 1.00 0.00 C ATOM 55 CG LYS A 6 9.135 -2.515 7.554 1.00 0.00 C ATOM 56 CD LYS A 6 9.556 -2.013 8.950 1.00 0.00 C ATOM 57 CE LYS A 6 9.169 -2.981 10.082 1.00 0.00 C ATOM 58 NZ LYS A 6 9.608 -2.473 11.394 1.00 0.00 N ATOM 0 H LYS A 6 10.661 -3.341 4.908 1.00 0.00 H new ATOM 0 HA LYS A 6 8.010 -2.053 5.026 1.00 0.00 H new ATOM 0 HB2 LYS A 6 10.658 -1.504 6.419 1.00 0.00 H new ATOM 0 HB3 LYS A 6 9.202 -0.559 6.660 1.00 0.00 H new ATOM 0 HG2 LYS A 6 8.052 -2.636 7.527 1.00 0.00 H new ATOM 0 HG3 LYS A 6 9.571 -3.499 7.379 1.00 0.00 H new ATOM 0 HD2 LYS A 6 10.635 -1.860 8.964 1.00 0.00 H new ATOM 0 HD3 LYS A 6 9.094 -1.043 9.135 1.00 0.00 H new ATOM 0 HE2 LYS A 6 8.088 -3.124 10.088 1.00 0.00 H new ATOM 0 HE3 LYS A 6 9.618 -3.957 9.898 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 9.333 -3.147 12.137 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 10.642 -2.360 11.394 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 9.159 -1.553 11.578 1.00 0.00 H new ATOM 72 N TYR A 7 8.515 -0.245 3.253 1.00 0.00 N ATOM 73 CA TYR A 7 8.806 0.637 2.087 1.00 0.00 C ATOM 74 C TYR A 7 8.453 2.106 2.459 1.00 0.00 C ATOM 75 O TYR A 7 7.278 2.482 2.516 1.00 0.00 O ATOM 76 CB TYR A 7 8.052 0.153 0.810 1.00 0.00 C ATOM 77 CG TYR A 7 8.325 -1.289 0.322 1.00 0.00 C ATOM 78 CD1 TYR A 7 9.529 -1.615 -0.309 1.00 0.00 C ATOM 79 CD2 TYR A 7 7.349 -2.282 0.484 1.00 0.00 C ATOM 80 CE1 TYR A 7 9.770 -2.921 -0.737 1.00 0.00 C ATOM 81 CE2 TYR A 7 7.593 -3.586 0.060 1.00 0.00 C ATOM 82 CZ TYR A 7 8.804 -3.907 -0.539 1.00 0.00 C ATOM 83 OH TYR A 7 9.052 -5.197 -0.927 1.00 0.00 O ATOM 0 H TYR A 7 7.520 -0.387 3.429 1.00 0.00 H new ATOM 0 HA TYR A 7 9.869 0.587 1.849 1.00 0.00 H new ATOM 0 HB2 TYR A 7 6.982 0.248 0.995 1.00 0.00 H new ATOM 0 HB3 TYR A 7 8.297 0.835 -0.004 1.00 0.00 H new ATOM 0 HD1 TYR A 7 10.277 -0.852 -0.466 1.00 0.00 H new ATOM 0 HD2 TYR A 7 6.402 -2.034 0.940 1.00 0.00 H new ATOM 0 HE1 TYR A 7 10.703 -3.168 -1.221 1.00 0.00 H new ATOM 0 HE2 TYR A 7 6.840 -4.348 0.197 1.00 0.00 H new ATOM 0 HH TYR A 7 8.527 -5.812 -0.373 1.00 0.00 H new ATOM 93 N GLN A 8 9.488 2.933 2.697 1.00 0.00 N ATOM 94 CA GLN A 8 9.340 4.361 3.091 1.00 0.00 C ATOM 95 C GLN A 8 9.029 5.245 1.855 1.00 0.00 C ATOM 96 O GLN A 8 9.815 5.268 0.906 1.00 0.00 O ATOM 97 CB GLN A 8 10.678 4.789 3.761 1.00 0.00 C ATOM 98 CG GLN A 8 10.760 6.221 4.342 1.00 0.00 C ATOM 99 CD GLN A 8 9.960 6.438 5.635 1.00 0.00 C ATOM 100 OE1 GLN A 8 10.413 6.099 6.729 1.00 0.00 O ATOM 101 NE2 GLN A 8 8.769 7.005 5.546 1.00 0.00 N ATOM 0 H GLN A 8 10.460 2.634 2.623 1.00 0.00 H new ATOM 0 HA GLN A 8 8.508 4.486 3.783 1.00 0.00 H new ATOM 0 HB2 GLN A 8 10.891 4.086 4.567 1.00 0.00 H new ATOM 0 HB3 GLN A 8 11.474 4.679 3.024 1.00 0.00 H new ATOM 0 HG2 GLN A 8 11.806 6.461 4.534 1.00 0.00 H new ATOM 0 HG3 GLN A 8 10.405 6.924 3.589 1.00 0.00 H new ATOM 0 HE21 GLN A 8 8.403 7.282 4.635 1.00 0.00 H new ATOM 0 HE22 GLN A 8 8.216 7.165 6.388 1.00 0.00 H new ATOM 110 N LEU A 9 7.916 6.002 1.890 1.00 0.00 N ATOM 111 CA LEU A 9 7.469 6.841 0.742 1.00 0.00 C ATOM 112 C LEU A 9 8.458 8.006 0.431 1.00 0.00 C ATOM 113 O LEU A 9 8.792 8.815 1.301 1.00 0.00 O ATOM 114 CB LEU A 9 6.029 7.348 1.030 1.00 0.00 C ATOM 115 CG LEU A 9 5.291 8.100 -0.115 1.00 0.00 C ATOM 116 CD1 LEU A 9 4.952 7.196 -1.319 1.00 0.00 C ATOM 117 CD2 LEU A 9 4.014 8.767 0.433 1.00 0.00 C ATOM 0 H LEU A 9 7.301 6.055 2.702 1.00 0.00 H new ATOM 0 HA LEU A 9 7.460 6.231 -0.161 1.00 0.00 H new ATOM 0 HB2 LEU A 9 5.421 6.490 1.316 1.00 0.00 H new ATOM 0 HB3 LEU A 9 6.072 8.010 1.895 1.00 0.00 H new ATOM 0 HG LEU A 9 5.977 8.861 -0.487 1.00 0.00 H new ATOM 0 HD11 LEU A 9 4.439 7.782 -2.081 1.00 0.00 H new ATOM 0 HD12 LEU A 9 5.872 6.785 -1.736 1.00 0.00 H new ATOM 0 HD13 LEU A 9 4.306 6.381 -0.992 1.00 0.00 H new ATOM 0 HD21 LEU A 9 3.503 9.292 -0.374 1.00 0.00 H new ATOM 0 HD22 LEU A 9 3.354 8.004 0.846 1.00 0.00 H new ATOM 0 HD23 LEU A 9 4.282 9.477 1.215 1.00 0.00 H new ATOM 129 N GLN A 10 8.917 8.042 -0.829 1.00 0.00 N ATOM 130 CA GLN A 10 9.927 9.017 -1.321 1.00 0.00 C ATOM 131 C GLN A 10 9.235 10.087 -2.216 1.00 0.00 C ATOM 132 O GLN A 10 9.207 11.262 -1.841 1.00 0.00 O ATOM 133 CB GLN A 10 11.094 8.301 -2.062 1.00 0.00 C ATOM 134 CG GLN A 10 11.832 7.185 -1.296 1.00 0.00 C ATOM 135 CD GLN A 10 12.760 7.651 -0.158 1.00 0.00 C ATOM 136 OE1 GLN A 10 13.510 8.618 -0.288 1.00 0.00 O ATOM 137 NE2 GLN A 10 12.751 6.961 0.971 1.00 0.00 N ATOM 0 H GLN A 10 8.600 7.393 -1.549 1.00 0.00 H new ATOM 0 HA GLN A 10 10.371 9.526 -0.465 1.00 0.00 H new ATOM 0 HB2 GLN A 10 10.698 7.874 -2.984 1.00 0.00 H new ATOM 0 HB3 GLN A 10 11.826 9.056 -2.349 1.00 0.00 H new ATOM 0 HG2 GLN A 10 11.089 6.505 -0.878 1.00 0.00 H new ATOM 0 HG3 GLN A 10 12.424 6.611 -2.009 1.00 0.00 H new ATOM 0 HE21 GLN A 10 12.128 6.160 1.074 1.00 0.00 H new ATOM 0 HE22 GLN A 10 13.367 7.230 1.738 1.00 0.00 H new ATOM 146 N SER A 11 8.698 9.672 -3.386 1.00 0.00 N ATOM 147 CA SER A 11 8.083 10.584 -4.384 1.00 0.00 C ATOM 148 C SER A 11 6.692 10.020 -4.774 1.00 0.00 C ATOM 149 O SER A 11 6.588 8.937 -5.361 1.00 0.00 O ATOM 150 CB SER A 11 9.023 10.717 -5.604 1.00 0.00 C ATOM 151 OG SER A 11 8.496 11.639 -6.552 1.00 0.00 O ATOM 0 H SER A 11 8.678 8.692 -3.668 1.00 0.00 H new ATOM 0 HA SER A 11 7.943 11.583 -3.971 1.00 0.00 H new ATOM 0 HB2 SER A 11 10.008 11.050 -5.275 1.00 0.00 H new ATOM 0 HB3 SER A 11 9.156 9.742 -6.074 1.00 0.00 H new ATOM 0 HG SER A 11 9.107 11.709 -7.315 1.00 0.00 H new ATOM 157 N GLN A 12 5.632 10.782 -4.446 1.00 0.00 N ATOM 158 CA GLN A 12 4.226 10.368 -4.693 1.00 0.00 C ATOM 159 C GLN A 12 3.656 11.192 -5.880 1.00 0.00 C ATOM 160 O GLN A 12 3.384 12.392 -5.761 1.00 0.00 O ATOM 161 CB GLN A 12 3.424 10.539 -3.376 1.00 0.00 C ATOM 162 CG GLN A 12 2.039 9.852 -3.385 1.00 0.00 C ATOM 163 CD GLN A 12 1.316 9.925 -2.029 1.00 0.00 C ATOM 164 OE1 GLN A 12 1.261 10.967 -1.374 1.00 0.00 O ATOM 165 NE2 GLN A 12 0.738 8.824 -1.578 1.00 0.00 N ATOM 0 H GLN A 12 5.718 11.698 -4.005 1.00 0.00 H new ATOM 0 HA GLN A 12 4.155 9.319 -4.979 1.00 0.00 H new ATOM 0 HB2 GLN A 12 4.012 10.137 -2.551 1.00 0.00 H new ATOM 0 HB3 GLN A 12 3.288 11.603 -3.182 1.00 0.00 H new ATOM 0 HG2 GLN A 12 1.415 10.318 -4.148 1.00 0.00 H new ATOM 0 HG3 GLN A 12 2.161 8.807 -3.668 1.00 0.00 H new ATOM 0 HE21 GLN A 12 0.786 7.963 -2.123 1.00 0.00 H new ATOM 0 HE22 GLN A 12 0.245 8.836 -0.685 1.00 0.00 H new ATOM 174 N GLU A 13 3.484 10.509 -7.023 1.00 0.00 N ATOM 175 CA GLU A 13 2.961 11.109 -8.277 1.00 0.00 C ATOM 176 C GLU A 13 1.413 10.974 -8.331 1.00 0.00 C ATOM 177 O GLU A 13 0.869 9.904 -8.045 1.00 0.00 O ATOM 178 CB GLU A 13 3.663 10.373 -9.456 1.00 0.00 C ATOM 179 CG GLU A 13 3.367 10.864 -10.890 1.00 0.00 C ATOM 180 CD GLU A 13 3.808 12.303 -11.178 1.00 0.00 C ATOM 181 OE1 GLU A 13 5.012 12.527 -11.431 1.00 0.00 O ATOM 182 OE2 GLU A 13 2.952 13.214 -11.150 1.00 0.00 O ATOM 0 H GLU A 13 3.703 9.517 -7.111 1.00 0.00 H new ATOM 0 HA GLU A 13 3.174 12.176 -8.335 1.00 0.00 H new ATOM 0 HB2 GLU A 13 4.739 10.435 -9.296 1.00 0.00 H new ATOM 0 HB3 GLU A 13 3.393 9.318 -9.401 1.00 0.00 H new ATOM 0 HG2 GLU A 13 3.862 10.198 -11.597 1.00 0.00 H new ATOM 0 HG3 GLU A 13 2.296 10.783 -11.073 1.00 0.00 H new ATOM 189 N ASN A 14 0.719 12.060 -8.733 1.00 0.00 N ATOM 190 CA ASN A 14 -0.765 12.074 -8.955 1.00 0.00 C ATOM 191 C ASN A 14 -1.649 11.765 -7.695 1.00 0.00 C ATOM 192 O ASN A 14 -2.618 11.004 -7.781 1.00 0.00 O ATOM 193 CB ASN A 14 -1.150 11.241 -10.226 1.00 0.00 C ATOM 194 CG ASN A 14 -0.880 11.918 -11.585 1.00 0.00 C ATOM 195 OD1 ASN A 14 0.248 11.945 -12.075 1.00 0.00 O ATOM 196 ND2 ASN A 14 -1.903 12.461 -12.228 1.00 0.00 N ATOM 0 H ASN A 14 1.162 12.960 -8.917 1.00 0.00 H new ATOM 0 HA ASN A 14 -1.020 13.115 -9.152 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -0.604 10.298 -10.197 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -2.211 10.997 -10.168 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -1.758 12.905 -13.135 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -2.836 12.435 -11.816 1.00 0.00 H new ATOM 203 N PHE A 15 -1.350 12.386 -6.532 1.00 0.00 N ATOM 204 CA PHE A 15 -2.123 12.170 -5.271 1.00 0.00 C ATOM 205 C PHE A 15 -3.486 12.928 -5.227 1.00 0.00 C ATOM 206 O PHE A 15 -4.489 12.301 -4.882 1.00 0.00 O ATOM 207 CB PHE A 15 -1.209 12.453 -4.043 1.00 0.00 C ATOM 208 CG PHE A 15 -1.682 11.989 -2.643 1.00 0.00 C ATOM 209 CD1 PHE A 15 -2.241 10.720 -2.427 1.00 0.00 C ATOM 210 CD2 PHE A 15 -1.439 12.813 -1.537 1.00 0.00 C ATOM 211 CE1 PHE A 15 -2.563 10.298 -1.140 1.00 0.00 C ATOM 212 CE2 PHE A 15 -1.759 12.381 -0.252 1.00 0.00 C ATOM 213 CZ PHE A 15 -2.330 11.130 -0.055 1.00 0.00 C ATOM 0 H PHE A 15 -0.577 13.045 -6.433 1.00 0.00 H new ATOM 0 HA PHE A 15 -2.421 11.122 -5.237 1.00 0.00 H new ATOM 0 HB2 PHE A 15 -0.242 11.988 -4.236 1.00 0.00 H new ATOM 0 HB3 PHE A 15 -1.042 13.529 -3.996 1.00 0.00 H new ATOM 0 HD1 PHE A 15 -2.423 10.065 -3.266 1.00 0.00 H new ATOM 0 HD2 PHE A 15 -1.001 13.789 -1.681 1.00 0.00 H new ATOM 0 HE1 PHE A 15 -2.995 9.320 -0.986 1.00 0.00 H new ATOM 0 HE2 PHE A 15 -1.562 13.022 0.595 1.00 0.00 H new ATOM 0 HZ PHE A 15 -2.592 10.806 0.941 1.00 0.00 H new ATOM 223 N GLU A 16 -3.543 14.227 -5.597 1.00 0.00 N ATOM 224 CA GLU A 16 -4.825 14.981 -5.755 1.00 0.00 C ATOM 225 C GLU A 16 -5.763 14.437 -6.875 1.00 0.00 C ATOM 226 O GLU A 16 -6.938 14.188 -6.593 1.00 0.00 O ATOM 227 CB GLU A 16 -4.558 16.500 -5.960 1.00 0.00 C ATOM 228 CG GLU A 16 -4.019 17.249 -4.722 1.00 0.00 C ATOM 229 CD GLU A 16 -3.736 18.726 -4.999 1.00 0.00 C ATOM 230 OE1 GLU A 16 -4.659 19.557 -4.848 1.00 0.00 O ATOM 231 OE2 GLU A 16 -2.589 19.065 -5.362 1.00 0.00 O ATOM 0 H GLU A 16 -2.713 14.786 -5.795 1.00 0.00 H new ATOM 0 HA GLU A 16 -5.362 14.826 -4.819 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -3.845 16.620 -6.775 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -5.486 16.976 -6.276 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -4.743 17.168 -3.911 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -3.103 16.766 -4.381 1.00 0.00 H new ATOM 238 N ALA A 17 -5.259 14.235 -8.111 1.00 0.00 N ATOM 239 CA ALA A 17 -6.052 13.659 -9.234 1.00 0.00 C ATOM 240 C ALA A 17 -6.665 12.239 -9.016 1.00 0.00 C ATOM 241 O ALA A 17 -7.798 12.012 -9.445 1.00 0.00 O ATOM 242 CB ALA A 17 -5.178 13.685 -10.501 1.00 0.00 C ATOM 0 H ALA A 17 -4.298 14.463 -8.364 1.00 0.00 H new ATOM 0 HA ALA A 17 -6.936 14.291 -9.321 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -5.738 13.268 -11.338 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -4.898 14.713 -10.729 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -4.278 13.092 -10.335 1.00 0.00 H new ATOM 248 N PHE A 18 -5.944 11.307 -8.359 1.00 0.00 N ATOM 249 CA PHE A 18 -6.450 9.936 -8.064 1.00 0.00 C ATOM 250 C PHE A 18 -7.461 9.905 -6.881 1.00 0.00 C ATOM 251 O PHE A 18 -8.580 9.426 -7.076 1.00 0.00 O ATOM 252 CB PHE A 18 -5.230 8.991 -7.875 1.00 0.00 C ATOM 253 CG PHE A 18 -5.536 7.485 -7.764 1.00 0.00 C ATOM 254 CD1 PHE A 18 -5.781 6.911 -6.510 1.00 0.00 C ATOM 255 CD2 PHE A 18 -5.502 6.664 -8.897 1.00 0.00 C ATOM 256 CE1 PHE A 18 -5.985 5.539 -6.390 1.00 0.00 C ATOM 257 CE2 PHE A 18 -5.700 5.290 -8.772 1.00 0.00 C ATOM 258 CZ PHE A 18 -5.944 4.732 -7.522 1.00 0.00 C ATOM 0 H PHE A 18 -4.998 11.475 -8.016 1.00 0.00 H new ATOM 0 HA PHE A 18 -7.036 9.575 -8.909 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -4.550 9.140 -8.714 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -4.697 9.298 -6.975 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -5.812 7.537 -5.630 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -5.322 7.096 -9.870 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -6.175 5.103 -5.420 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -5.664 4.658 -9.647 1.00 0.00 H new ATOM 0 HZ PHE A 18 -6.102 3.668 -7.430 1.00 0.00 H new ATOM 268 N MET A 19 -7.071 10.405 -5.688 1.00 0.00 N ATOM 269 CA MET A 19 -7.926 10.440 -4.467 1.00 0.00 C ATOM 270 C MET A 19 -9.277 11.195 -4.651 1.00 0.00 C ATOM 271 O MET A 19 -10.325 10.597 -4.397 1.00 0.00 O ATOM 272 CB MET A 19 -7.096 11.008 -3.283 1.00 0.00 C ATOM 273 CG MET A 19 -6.126 10.028 -2.607 1.00 0.00 C ATOM 274 SD MET A 19 -4.947 9.324 -3.777 1.00 0.00 S ATOM 275 CE MET A 19 -4.670 7.727 -2.997 1.00 0.00 C ATOM 0 H MET A 19 -6.144 10.802 -5.537 1.00 0.00 H new ATOM 0 HA MET A 19 -8.225 9.414 -4.250 1.00 0.00 H new ATOM 0 HB2 MET A 19 -6.524 11.863 -3.644 1.00 0.00 H new ATOM 0 HB3 MET A 19 -7.787 11.383 -2.528 1.00 0.00 H new ATOM 0 HG2 MET A 19 -5.585 10.544 -1.814 1.00 0.00 H new ATOM 0 HG3 MET A 19 -6.693 9.225 -2.136 1.00 0.00 H new ATOM 0 HE1 MET A 19 -4.074 7.098 -3.658 1.00 0.00 H new ATOM 0 HE2 MET A 19 -4.139 7.869 -2.056 1.00 0.00 H new ATOM 0 HE3 MET A 19 -5.628 7.245 -2.804 1.00 0.00 H new ATOM 285 N LYS A 20 -9.267 12.455 -5.132 1.00 0.00 N ATOM 286 CA LYS A 20 -10.511 13.215 -5.462 1.00 0.00 C ATOM 287 C LYS A 20 -11.438 12.562 -6.540 1.00 0.00 C ATOM 288 O LYS A 20 -12.661 12.649 -6.393 1.00 0.00 O ATOM 289 CB LYS A 20 -10.174 14.677 -5.868 1.00 0.00 C ATOM 290 CG LYS A 20 -9.465 15.527 -4.783 1.00 0.00 C ATOM 291 CD LYS A 20 -9.009 16.928 -5.235 1.00 0.00 C ATOM 292 CE LYS A 20 -10.155 17.944 -5.398 1.00 0.00 C ATOM 293 NZ LYS A 20 -9.642 19.253 -5.837 1.00 0.00 N ATOM 0 H LYS A 20 -8.409 12.979 -5.305 1.00 0.00 H new ATOM 0 HA LYS A 20 -11.089 13.196 -4.538 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -9.541 14.652 -6.755 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -11.099 15.179 -6.150 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -10.140 15.639 -3.935 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -8.594 14.977 -4.426 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -8.295 17.317 -4.509 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -8.481 16.837 -6.185 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -10.877 17.570 -6.124 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -10.684 18.056 -4.452 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -10.434 19.920 -5.939 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -8.971 19.618 -5.131 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -9.158 19.147 -6.751 1.00 0.00 H new ATOM 307 N ALA A 21 -10.886 11.896 -7.580 1.00 0.00 N ATOM 308 CA ALA A 21 -11.688 11.102 -8.550 1.00 0.00 C ATOM 309 C ALA A 21 -12.376 9.812 -7.998 1.00 0.00 C ATOM 310 O ALA A 21 -13.492 9.518 -8.436 1.00 0.00 O ATOM 311 CB ALA A 21 -10.804 10.772 -9.766 1.00 0.00 C ATOM 0 H ALA A 21 -9.884 11.891 -7.773 1.00 0.00 H new ATOM 0 HA ALA A 21 -12.532 11.737 -8.820 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -11.379 10.190 -10.486 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -10.468 11.698 -10.233 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -9.939 10.195 -9.441 1.00 0.00 H new ATOM 317 N ILE A 22 -11.751 9.060 -7.062 1.00 0.00 N ATOM 318 CA ILE A 22 -12.383 7.864 -6.415 1.00 0.00 C ATOM 319 C ILE A 22 -13.401 8.246 -5.284 1.00 0.00 C ATOM 320 O ILE A 22 -14.525 7.733 -5.300 1.00 0.00 O ATOM 321 CB ILE A 22 -11.353 6.741 -6.015 1.00 0.00 C ATOM 322 CG1 ILE A 22 -10.268 7.165 -4.977 1.00 0.00 C ATOM 323 CG2 ILE A 22 -10.710 6.103 -7.275 1.00 0.00 C ATOM 324 CD1 ILE A 22 -9.420 6.036 -4.366 1.00 0.00 C ATOM 0 H ILE A 22 -10.806 9.254 -6.731 1.00 0.00 H new ATOM 0 HA ILE A 22 -12.991 7.396 -7.189 1.00 0.00 H new ATOM 0 HB ILE A 22 -11.948 5.992 -5.492 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -9.595 7.874 -5.459 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -10.763 7.697 -4.165 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -10.003 5.331 -6.971 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -11.488 5.659 -7.895 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -10.186 6.871 -7.845 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -8.704 6.459 -3.661 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -10.070 5.334 -3.845 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -8.884 5.514 -5.159 1.00 0.00 H new ATOM 336 N GLY A 23 -13.031 9.135 -4.342 1.00 0.00 N ATOM 337 CA GLY A 23 -13.964 9.706 -3.341 1.00 0.00 C ATOM 338 C GLY A 23 -13.315 9.924 -1.958 1.00 0.00 C ATOM 339 O GLY A 23 -13.767 9.326 -0.978 1.00 0.00 O ATOM 0 H GLY A 23 -12.076 9.481 -4.250 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -14.344 10.658 -3.711 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -14.821 9.041 -3.232 1.00 0.00 H new ATOM 343 N LEU A 24 -12.276 10.779 -1.888 1.00 0.00 N ATOM 344 CA LEU A 24 -11.473 11.011 -0.652 1.00 0.00 C ATOM 345 C LEU A 24 -11.506 12.521 -0.232 1.00 0.00 C ATOM 346 O LEU A 24 -11.616 13.393 -1.104 1.00 0.00 O ATOM 347 CB LEU A 24 -10.003 10.543 -0.887 1.00 0.00 C ATOM 348 CG LEU A 24 -9.561 9.122 -0.447 1.00 0.00 C ATOM 349 CD1 LEU A 24 -9.138 9.025 1.025 1.00 0.00 C ATOM 350 CD2 LEU A 24 -10.559 8.007 -0.788 1.00 0.00 C ATOM 0 H LEU A 24 -11.962 11.334 -2.684 1.00 0.00 H new ATOM 0 HA LEU A 24 -11.910 10.431 0.160 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -9.802 10.629 -1.955 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -9.351 11.256 -0.382 1.00 0.00 H new ATOM 0 HG LEU A 24 -8.674 8.952 -1.057 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -8.844 8.000 1.252 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -8.296 9.693 1.206 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -9.973 9.313 1.663 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -10.167 7.050 -0.444 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -11.511 8.208 -0.296 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -10.709 7.970 -1.867 1.00 0.00 H new ATOM 362 N PRO A 25 -11.361 12.882 1.081 1.00 0.00 N ATOM 363 CA PRO A 25 -11.333 14.294 1.538 1.00 0.00 C ATOM 364 C PRO A 25 -10.000 15.022 1.226 1.00 0.00 C ATOM 365 O PRO A 25 -8.917 14.442 1.351 1.00 0.00 O ATOM 366 CB PRO A 25 -11.541 14.159 3.059 1.00 0.00 C ATOM 367 CG PRO A 25 -11.027 12.770 3.439 1.00 0.00 C ATOM 368 CD PRO A 25 -11.166 11.914 2.179 1.00 0.00 C ATOM 0 HA PRO A 25 -12.084 14.899 1.030 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -10.997 14.936 3.597 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -12.594 14.269 3.319 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -9.989 12.814 3.769 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -11.606 12.351 4.262 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -10.277 11.305 2.015 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -12.011 11.230 2.257 1.00 0.00 H new ATOM 376 N GLU A 26 -10.100 16.322 0.906 1.00 0.00 N ATOM 377 CA GLU A 26 -8.906 17.211 0.765 1.00 0.00 C ATOM 378 C GLU A 26 -8.076 17.463 2.074 1.00 0.00 C ATOM 379 O GLU A 26 -6.892 17.790 1.962 1.00 0.00 O ATOM 380 CB GLU A 26 -9.341 18.517 0.043 1.00 0.00 C ATOM 381 CG GLU A 26 -8.182 19.359 -0.538 1.00 0.00 C ATOM 382 CD GLU A 26 -8.656 20.547 -1.378 1.00 0.00 C ATOM 383 OE1 GLU A 26 -8.881 20.374 -2.597 1.00 0.00 O ATOM 384 OE2 GLU A 26 -8.800 21.660 -0.825 1.00 0.00 O ATOM 0 H GLU A 26 -10.989 16.793 0.738 1.00 0.00 H new ATOM 0 HA GLU A 26 -8.180 16.675 0.153 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -10.023 18.257 -0.767 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -9.901 19.134 0.746 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -7.563 19.726 0.281 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -7.550 18.718 -1.153 1.00 0.00 H new ATOM 391 N GLU A 27 -8.636 17.255 3.287 1.00 0.00 N ATOM 392 CA GLU A 27 -7.853 17.191 4.552 1.00 0.00 C ATOM 393 C GLU A 27 -6.826 16.013 4.590 1.00 0.00 C ATOM 394 O GLU A 27 -5.641 16.287 4.782 1.00 0.00 O ATOM 395 CB GLU A 27 -8.835 17.201 5.756 1.00 0.00 C ATOM 396 CG GLU A 27 -8.156 17.410 7.127 1.00 0.00 C ATOM 397 CD GLU A 27 -9.149 17.441 8.289 1.00 0.00 C ATOM 398 OE1 GLU A 27 -9.454 16.367 8.854 1.00 0.00 O ATOM 399 OE2 GLU A 27 -9.630 18.541 8.645 1.00 0.00 O ATOM 0 H GLU A 27 -9.639 17.127 3.422 1.00 0.00 H new ATOM 0 HA GLU A 27 -7.222 18.078 4.615 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -9.570 17.991 5.604 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -9.380 16.257 5.773 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -7.435 16.610 7.294 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -7.596 18.345 7.110 1.00 0.00 H new ATOM 406 N LEU A 28 -7.234 14.741 4.370 1.00 0.00 N ATOM 407 CA LEU A 28 -6.272 13.596 4.265 1.00 0.00 C ATOM 408 C LEU A 28 -5.271 13.607 3.057 1.00 0.00 C ATOM 409 O LEU A 28 -4.226 12.955 3.144 1.00 0.00 O ATOM 410 CB LEU A 28 -7.024 12.231 4.306 1.00 0.00 C ATOM 411 CG LEU A 28 -7.818 11.866 5.594 1.00 0.00 C ATOM 412 CD1 LEU A 28 -8.584 10.543 5.396 1.00 0.00 C ATOM 413 CD2 LEU A 28 -6.924 11.753 6.846 1.00 0.00 C ATOM 0 H LEU A 28 -8.212 14.473 4.261 1.00 0.00 H new ATOM 0 HA LEU A 28 -5.639 13.732 5.142 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -7.721 12.210 3.468 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -6.292 11.442 4.132 1.00 0.00 H new ATOM 0 HG LEU A 28 -8.516 12.686 5.764 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -9.134 10.301 6.305 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -9.283 10.648 4.566 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -7.877 9.743 5.176 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -7.538 11.497 7.709 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -6.175 10.976 6.690 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -6.426 12.706 7.025 1.00 0.00 H new ATOM 425 N ILE A 29 -5.561 14.339 1.964 1.00 0.00 N ATOM 426 CA ILE A 29 -4.629 14.539 0.816 1.00 0.00 C ATOM 427 C ILE A 29 -3.544 15.618 1.157 1.00 0.00 C ATOM 428 O ILE A 29 -2.356 15.364 0.946 1.00 0.00 O ATOM 429 CB ILE A 29 -5.420 14.854 -0.508 1.00 0.00 C ATOM 430 CG1 ILE A 29 -6.520 13.802 -0.852 1.00 0.00 C ATOM 431 CG2 ILE A 29 -4.479 15.006 -1.733 1.00 0.00 C ATOM 432 CD1 ILE A 29 -7.537 14.236 -1.918 1.00 0.00 C ATOM 0 H ILE A 29 -6.454 14.816 1.843 1.00 0.00 H new ATOM 0 HA ILE A 29 -4.092 13.608 0.636 1.00 0.00 H new ATOM 0 HB ILE A 29 -5.914 15.804 -0.302 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -6.032 12.888 -1.191 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -7.060 13.554 0.062 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -5.071 15.223 -2.622 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -3.779 15.823 -1.555 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -3.925 14.080 -1.883 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -8.256 13.434 -2.082 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -8.061 15.130 -1.579 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -7.016 14.453 -2.851 1.00 0.00 H new ATOM 444 N GLN A 30 -3.941 16.809 1.646 1.00 0.00 N ATOM 445 CA GLN A 30 -2.993 17.906 2.003 1.00 0.00 C ATOM 446 C GLN A 30 -2.187 17.707 3.329 1.00 0.00 C ATOM 447 O GLN A 30 -1.075 18.233 3.432 1.00 0.00 O ATOM 448 CB GLN A 30 -3.729 19.276 1.995 1.00 0.00 C ATOM 449 CG GLN A 30 -4.421 19.708 0.673 1.00 0.00 C ATOM 450 CD GLN A 30 -3.492 19.908 -0.538 1.00 0.00 C ATOM 451 OE1 GLN A 30 -2.868 20.955 -0.702 1.00 0.00 O ATOM 452 NE2 GLN A 30 -3.392 18.919 -1.415 1.00 0.00 N ATOM 0 H GLN A 30 -4.920 17.046 1.807 1.00 0.00 H new ATOM 0 HA GLN A 30 -2.229 17.881 1.226 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -4.485 19.257 2.780 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -3.008 20.047 2.265 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -5.167 18.957 0.414 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -4.956 20.640 0.854 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -3.913 18.054 -1.270 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -2.794 19.023 -2.234 1.00 0.00 H new ATOM 461 N LYS A 31 -2.702 16.943 4.316 1.00 0.00 N ATOM 462 CA LYS A 31 -1.897 16.446 5.464 1.00 0.00 C ATOM 463 C LYS A 31 -1.022 15.216 5.065 1.00 0.00 C ATOM 464 O LYS A 31 0.176 15.222 5.359 1.00 0.00 O ATOM 465 CB LYS A 31 -2.823 16.136 6.675 1.00 0.00 C ATOM 466 CG LYS A 31 -3.196 17.325 7.595 1.00 0.00 C ATOM 467 CD LYS A 31 -4.150 18.385 6.996 1.00 0.00 C ATOM 468 CE LYS A 31 -4.494 19.557 7.936 1.00 0.00 C ATOM 469 NZ LYS A 31 -5.402 19.179 9.036 1.00 0.00 N ATOM 0 H LYS A 31 -3.679 16.652 4.345 1.00 0.00 H new ATOM 0 HA LYS A 31 -1.204 17.232 5.764 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -3.746 15.700 6.293 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -2.339 15.374 7.285 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -3.654 16.926 8.500 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -2.276 17.825 7.897 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -3.699 18.787 6.089 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -5.076 17.892 6.700 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -3.572 19.958 8.357 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -4.953 20.357 7.355 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -5.884 20.028 9.395 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -6.109 18.502 8.685 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -4.854 18.741 9.804 1.00 0.00 H new ATOM 483 N GLY A 32 -1.594 14.191 4.392 1.00 0.00 N ATOM 484 CA GLY A 32 -0.839 13.014 3.910 1.00 0.00 C ATOM 485 C GLY A 32 0.266 13.176 2.835 1.00 0.00 C ATOM 486 O GLY A 32 1.081 12.260 2.708 1.00 0.00 O ATOM 0 H GLY A 32 -2.589 14.158 4.169 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -0.376 12.550 4.781 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -1.567 12.303 3.519 1.00 0.00 H new ATOM 490 N LYS A 33 0.330 14.295 2.082 1.00 0.00 N ATOM 491 CA LYS A 33 1.501 14.610 1.210 1.00 0.00 C ATOM 492 C LYS A 33 2.814 14.939 1.999 1.00 0.00 C ATOM 493 O LYS A 33 3.881 14.422 1.657 1.00 0.00 O ATOM 494 CB LYS A 33 1.100 15.669 0.148 1.00 0.00 C ATOM 495 CG LYS A 33 0.927 17.127 0.628 1.00 0.00 C ATOM 496 CD LYS A 33 0.381 18.061 -0.469 1.00 0.00 C ATOM 497 CE LYS A 33 0.579 19.568 -0.211 1.00 0.00 C ATOM 498 NZ LYS A 33 -0.155 20.081 0.960 1.00 0.00 N ATOM 0 H LYS A 33 -0.408 14.998 2.055 1.00 0.00 H new ATOM 0 HA LYS A 33 1.773 13.702 0.672 1.00 0.00 H new ATOM 0 HB2 LYS A 33 1.855 15.661 -0.638 1.00 0.00 H new ATOM 0 HB3 LYS A 33 0.162 15.351 -0.308 1.00 0.00 H new ATOM 0 HG2 LYS A 33 0.250 17.145 1.482 1.00 0.00 H new ATOM 0 HG3 LYS A 33 1.888 17.506 0.975 1.00 0.00 H new ATOM 0 HD2 LYS A 33 0.861 17.805 -1.413 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -0.685 17.867 -0.591 1.00 0.00 H new ATOM 0 HE2 LYS A 33 1.642 19.765 -0.075 1.00 0.00 H new ATOM 0 HE3 LYS A 33 0.263 20.121 -1.095 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 0.392 20.846 1.405 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -1.080 20.448 0.657 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -0.295 19.312 1.646 1.00 0.00 H new ATOM 512 N ASP A 34 2.709 15.747 3.076 1.00 0.00 N ATOM 513 CA ASP A 34 3.791 15.948 4.081 1.00 0.00 C ATOM 514 C ASP A 34 4.150 14.695 4.947 1.00 0.00 C ATOM 515 O ASP A 34 5.314 14.567 5.337 1.00 0.00 O ATOM 516 CB ASP A 34 3.421 17.130 5.023 1.00 0.00 C ATOM 517 CG ASP A 34 3.288 18.506 4.351 1.00 0.00 C ATOM 518 OD1 ASP A 34 4.314 19.203 4.190 1.00 0.00 O ATOM 519 OD2 ASP A 34 2.156 18.888 3.976 1.00 0.00 O ATOM 0 H ASP A 34 1.867 16.285 3.280 1.00 0.00 H new ATOM 0 HA ASP A 34 4.683 16.162 3.492 1.00 0.00 H new ATOM 0 HB2 ASP A 34 2.478 16.895 5.516 1.00 0.00 H new ATOM 0 HB3 ASP A 34 4.180 17.199 5.803 1.00 0.00 H new ATOM 524 N ILE A 35 3.186 13.795 5.255 1.00 0.00 N ATOM 525 CA ILE A 35 3.434 12.559 6.050 1.00 0.00 C ATOM 526 C ILE A 35 3.924 11.470 5.049 1.00 0.00 C ATOM 527 O ILE A 35 3.164 11.007 4.190 1.00 0.00 O ATOM 528 CB ILE A 35 2.163 12.095 6.853 1.00 0.00 C ATOM 529 CG1 ILE A 35 1.554 13.191 7.783 1.00 0.00 C ATOM 530 CG2 ILE A 35 2.447 10.822 7.698 1.00 0.00 C ATOM 531 CD1 ILE A 35 0.085 12.951 8.160 1.00 0.00 C ATOM 0 H ILE A 35 2.215 13.901 4.962 1.00 0.00 H new ATOM 0 HA ILE A 35 4.190 12.747 6.812 1.00 0.00 H new ATOM 0 HB ILE A 35 1.426 11.877 6.080 1.00 0.00 H new ATOM 0 HG12 ILE A 35 2.147 13.248 8.696 1.00 0.00 H new ATOM 0 HG13 ILE A 35 1.637 14.159 7.288 1.00 0.00 H new ATOM 0 HG21 ILE A 35 1.544 10.534 8.237 1.00 0.00 H new ATOM 0 HG22 ILE A 35 2.751 10.008 7.039 1.00 0.00 H new ATOM 0 HG23 ILE A 35 3.245 11.029 8.411 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -0.261 13.757 8.807 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -0.523 12.925 7.256 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -0.005 12.000 8.685 1.00 0.00 H new ATOM 543 N LYS A 36 5.193 11.050 5.199 1.00 0.00 N ATOM 544 CA LYS A 36 5.789 9.977 4.362 1.00 0.00 C ATOM 545 C LYS A 36 5.460 8.617 5.039 1.00 0.00 C ATOM 546 O LYS A 36 5.982 8.298 6.113 1.00 0.00 O ATOM 547 CB LYS A 36 7.309 10.204 4.151 1.00 0.00 C ATOM 548 CG LYS A 36 7.687 11.267 3.090 1.00 0.00 C ATOM 549 CD LYS A 36 7.449 12.738 3.488 1.00 0.00 C ATOM 550 CE LYS A 36 7.957 13.747 2.443 1.00 0.00 C ATOM 551 NZ LYS A 36 7.668 15.132 2.857 1.00 0.00 N ATOM 0 H LYS A 36 5.833 11.435 5.893 1.00 0.00 H new ATOM 0 HA LYS A 36 5.362 9.984 3.359 1.00 0.00 H new ATOM 0 HB2 LYS A 36 7.750 10.495 5.104 1.00 0.00 H new ATOM 0 HB3 LYS A 36 7.764 9.255 3.866 1.00 0.00 H new ATOM 0 HG2 LYS A 36 8.742 11.145 2.843 1.00 0.00 H new ATOM 0 HG3 LYS A 36 7.121 11.061 2.182 1.00 0.00 H new ATOM 0 HD2 LYS A 36 6.382 12.896 3.645 1.00 0.00 H new ATOM 0 HD3 LYS A 36 7.943 12.933 4.440 1.00 0.00 H new ATOM 0 HE2 LYS A 36 9.031 13.622 2.305 1.00 0.00 H new ATOM 0 HE3 LYS A 36 7.486 13.546 1.481 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 8.021 15.791 2.134 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 6.641 15.255 2.965 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 8.138 15.328 3.764 1.00 0.00 H new ATOM 565 N GLY A 37 4.542 7.857 4.418 1.00 0.00 N ATOM 566 CA GLY A 37 3.970 6.638 5.027 1.00 0.00 C ATOM 567 C GLY A 37 4.803 5.369 4.770 1.00 0.00 C ATOM 568 O GLY A 37 5.104 5.036 3.620 1.00 0.00 O ATOM 0 H GLY A 37 4.177 8.065 3.489 1.00 0.00 H new ATOM 0 HA2 GLY A 37 3.877 6.789 6.102 1.00 0.00 H new ATOM 0 HA3 GLY A 37 2.963 6.486 4.638 1.00 0.00 H new ATOM 572 N VAL A 38 5.118 4.639 5.858 1.00 0.00 N ATOM 573 CA VAL A 38 5.814 3.321 5.780 1.00 0.00 C ATOM 574 C VAL A 38 4.734 2.255 5.417 1.00 0.00 C ATOM 575 O VAL A 38 3.802 1.994 6.185 1.00 0.00 O ATOM 576 CB VAL A 38 6.599 2.962 7.087 1.00 0.00 C ATOM 577 CG1 VAL A 38 7.372 1.625 6.975 1.00 0.00 C ATOM 578 CG2 VAL A 38 7.622 4.041 7.519 1.00 0.00 C ATOM 0 H VAL A 38 4.904 4.934 6.810 1.00 0.00 H new ATOM 0 HA VAL A 38 6.586 3.355 5.012 1.00 0.00 H new ATOM 0 HB VAL A 38 5.812 2.887 7.837 1.00 0.00 H new ATOM 0 HG11 VAL A 38 7.897 1.429 7.910 1.00 0.00 H new ATOM 0 HG12 VAL A 38 6.671 0.815 6.775 1.00 0.00 H new ATOM 0 HG13 VAL A 38 8.094 1.689 6.161 1.00 0.00 H new ATOM 0 HG21 VAL A 38 8.125 3.721 8.431 1.00 0.00 H new ATOM 0 HG22 VAL A 38 8.359 4.181 6.728 1.00 0.00 H new ATOM 0 HG23 VAL A 38 7.103 4.982 7.702 1.00 0.00 H new ATOM 588 N SER A 39 4.892 1.676 4.222 1.00 0.00 N ATOM 589 CA SER A 39 3.908 0.745 3.619 1.00 0.00 C ATOM 590 C SER A 39 4.561 -0.652 3.531 1.00 0.00 C ATOM 591 O SER A 39 5.575 -0.828 2.855 1.00 0.00 O ATOM 592 CB SER A 39 3.502 1.249 2.218 1.00 0.00 C ATOM 593 OG SER A 39 2.915 2.546 2.277 1.00 0.00 O ATOM 0 H SER A 39 5.710 1.836 3.634 1.00 0.00 H new ATOM 0 HA SER A 39 3.007 0.690 4.230 1.00 0.00 H new ATOM 0 HB2 SER A 39 4.379 1.275 1.572 1.00 0.00 H new ATOM 0 HB3 SER A 39 2.796 0.550 1.769 1.00 0.00 H new ATOM 0 HG SER A 39 2.671 2.836 1.373 1.00 0.00 H new ATOM 599 N GLU A 40 3.980 -1.637 4.225 1.00 0.00 N ATOM 600 CA GLU A 40 4.550 -3.000 4.330 1.00 0.00 C ATOM 601 C GLU A 40 3.936 -3.964 3.280 1.00 0.00 C ATOM 602 O GLU A 40 2.789 -3.818 2.846 1.00 0.00 O ATOM 603 CB GLU A 40 4.301 -3.551 5.759 1.00 0.00 C ATOM 604 CG GLU A 40 5.078 -2.890 6.912 1.00 0.00 C ATOM 605 CD GLU A 40 4.325 -1.770 7.638 1.00 0.00 C ATOM 606 OE1 GLU A 40 3.541 -2.070 8.565 1.00 0.00 O ATOM 607 OE2 GLU A 40 4.516 -0.587 7.287 1.00 0.00 O ATOM 0 H GLU A 40 3.103 -1.520 4.732 1.00 0.00 H new ATOM 0 HA GLU A 40 5.620 -2.936 4.133 1.00 0.00 H new ATOM 0 HB2 GLU A 40 3.236 -3.463 5.975 1.00 0.00 H new ATOM 0 HB3 GLU A 40 4.539 -4.615 5.757 1.00 0.00 H new ATOM 0 HG2 GLU A 40 5.346 -3.658 7.638 1.00 0.00 H new ATOM 0 HG3 GLU A 40 6.010 -2.485 6.518 1.00 0.00 H new ATOM 614 N ILE A 41 4.730 -4.989 2.934 1.00 0.00 N ATOM 615 CA ILE A 41 4.229 -6.240 2.292 1.00 0.00 C ATOM 616 C ILE A 41 5.019 -7.367 3.021 1.00 0.00 C ATOM 617 O ILE A 41 6.252 -7.351 3.058 1.00 0.00 O ATOM 618 CB ILE A 41 4.374 -6.295 0.728 1.00 0.00 C ATOM 619 CG1 ILE A 41 3.631 -5.121 0.017 1.00 0.00 C ATOM 620 CG2 ILE A 41 3.883 -7.657 0.160 1.00 0.00 C ATOM 621 CD1 ILE A 41 3.761 -5.036 -1.509 1.00 0.00 C ATOM 0 H ILE A 41 5.739 -4.986 3.086 1.00 0.00 H new ATOM 0 HA ILE A 41 3.149 -6.332 2.404 1.00 0.00 H new ATOM 0 HB ILE A 41 5.438 -6.188 0.518 1.00 0.00 H new ATOM 0 HG12 ILE A 41 2.572 -5.192 0.263 1.00 0.00 H new ATOM 0 HG13 ILE A 41 3.994 -4.185 0.440 1.00 0.00 H new ATOM 0 HG21 ILE A 41 3.997 -7.662 -0.924 1.00 0.00 H new ATOM 0 HG22 ILE A 41 4.474 -8.465 0.590 1.00 0.00 H new ATOM 0 HG23 ILE A 41 2.833 -7.800 0.415 1.00 0.00 H new ATOM 0 HD11 ILE A 41 3.198 -4.177 -1.875 1.00 0.00 H new ATOM 0 HD12 ILE A 41 4.811 -4.924 -1.779 1.00 0.00 H new ATOM 0 HD13 ILE A 41 3.366 -5.947 -1.959 1.00 0.00 H new ATOM 633 N VAL A 42 4.289 -8.350 3.577 1.00 0.00 N ATOM 634 CA VAL A 42 4.887 -9.488 4.332 1.00 0.00 C ATOM 635 C VAL A 42 4.654 -10.750 3.447 1.00 0.00 C ATOM 636 O VAL A 42 3.550 -11.303 3.415 1.00 0.00 O ATOM 637 CB VAL A 42 4.273 -9.594 5.775 1.00 0.00 C ATOM 638 CG1 VAL A 42 4.860 -10.773 6.586 1.00 0.00 C ATOM 639 CG2 VAL A 42 4.426 -8.310 6.628 1.00 0.00 C ATOM 0 H VAL A 42 3.271 -8.387 3.521 1.00 0.00 H new ATOM 0 HA VAL A 42 5.955 -9.359 4.509 1.00 0.00 H new ATOM 0 HB VAL A 42 3.213 -9.758 5.583 1.00 0.00 H new ATOM 0 HG11 VAL A 42 4.401 -10.799 7.574 1.00 0.00 H new ATOM 0 HG12 VAL A 42 4.656 -11.709 6.066 1.00 0.00 H new ATOM 0 HG13 VAL A 42 5.937 -10.643 6.690 1.00 0.00 H new ATOM 0 HG21 VAL A 42 3.976 -8.468 7.608 1.00 0.00 H new ATOM 0 HG22 VAL A 42 5.484 -8.077 6.748 1.00 0.00 H new ATOM 0 HG23 VAL A 42 3.926 -7.480 6.129 1.00 0.00 H new ATOM 649 N GLN A 43 5.713 -11.200 2.744 1.00 0.00 N ATOM 650 CA GLN A 43 5.650 -12.387 1.849 1.00 0.00 C ATOM 651 C GLN A 43 5.759 -13.702 2.669 1.00 0.00 C ATOM 652 O GLN A 43 6.775 -13.964 3.323 1.00 0.00 O ATOM 653 CB GLN A 43 6.765 -12.263 0.772 1.00 0.00 C ATOM 654 CG GLN A 43 6.858 -13.427 -0.247 1.00 0.00 C ATOM 655 CD GLN A 43 7.876 -13.178 -1.377 1.00 0.00 C ATOM 656 OE1 GLN A 43 9.055 -12.915 -1.136 1.00 0.00 O ATOM 657 NE2 GLN A 43 7.453 -13.265 -2.629 1.00 0.00 N ATOM 0 H GLN A 43 6.632 -10.759 2.776 1.00 0.00 H new ATOM 0 HA GLN A 43 4.686 -12.423 1.341 1.00 0.00 H new ATOM 0 HB2 GLN A 43 6.609 -11.336 0.221 1.00 0.00 H new ATOM 0 HB3 GLN A 43 7.725 -12.174 1.280 1.00 0.00 H new ATOM 0 HG2 GLN A 43 7.131 -14.340 0.281 1.00 0.00 H new ATOM 0 HG3 GLN A 43 5.874 -13.594 -0.686 1.00 0.00 H new ATOM 0 HE21 GLN A 43 6.476 -13.483 -2.823 1.00 0.00 H new ATOM 0 HE22 GLN A 43 8.105 -13.114 -3.399 1.00 0.00 H new ATOM 666 N ASN A 44 4.712 -14.536 2.566 1.00 0.00 N ATOM 667 CA ASN A 44 4.753 -15.955 3.015 1.00 0.00 C ATOM 668 C ASN A 44 4.219 -16.837 1.845 1.00 0.00 C ATOM 669 O ASN A 44 3.099 -17.357 1.901 1.00 0.00 O ATOM 670 CB ASN A 44 3.952 -16.146 4.339 1.00 0.00 C ATOM 671 CG ASN A 44 4.554 -15.477 5.591 1.00 0.00 C ATOM 672 OD1 ASN A 44 4.224 -14.340 5.927 1.00 0.00 O ATOM 673 ND2 ASN A 44 5.442 -16.158 6.299 1.00 0.00 N ATOM 0 H ASN A 44 3.813 -14.257 2.173 1.00 0.00 H new ATOM 0 HA ASN A 44 5.773 -16.261 3.249 1.00 0.00 H new ATOM 0 HB2 ASN A 44 2.945 -15.757 4.191 1.00 0.00 H new ATOM 0 HB3 ASN A 44 3.856 -17.214 4.532 1.00 0.00 H new ATOM 0 HD21 ASN A 44 5.859 -15.741 7.131 1.00 0.00 H new ATOM 0 HD22 ASN A 44 5.709 -17.100 6.012 1.00 0.00 H new ATOM 680 N GLY A 45 5.031 -16.986 0.773 1.00 0.00 N ATOM 681 CA GLY A 45 4.657 -17.766 -0.430 1.00 0.00 C ATOM 682 C GLY A 45 3.511 -17.142 -1.258 1.00 0.00 C ATOM 683 O GLY A 45 3.665 -16.070 -1.851 1.00 0.00 O ATOM 0 H GLY A 45 5.961 -16.571 0.717 1.00 0.00 H new ATOM 0 HA2 GLY A 45 5.535 -17.873 -1.068 1.00 0.00 H new ATOM 0 HA3 GLY A 45 4.363 -18.769 -0.122 1.00 0.00 H new ATOM 687 N LYS A 46 2.358 -17.828 -1.242 1.00 0.00 N ATOM 688 CA LYS A 46 1.084 -17.325 -1.831 1.00 0.00 C ATOM 689 C LYS A 46 0.380 -16.212 -0.989 1.00 0.00 C ATOM 690 O LYS A 46 -0.173 -15.285 -1.585 1.00 0.00 O ATOM 691 CB LYS A 46 0.130 -18.527 -2.085 1.00 0.00 C ATOM 692 CG LYS A 46 0.584 -19.492 -3.211 1.00 0.00 C ATOM 693 CD LYS A 46 -0.149 -20.851 -3.284 1.00 0.00 C ATOM 694 CE LYS A 46 -1.597 -20.840 -3.813 1.00 0.00 C ATOM 695 NZ LYS A 46 -2.591 -20.455 -2.795 1.00 0.00 N ATOM 0 H LYS A 46 2.271 -18.753 -0.821 1.00 0.00 H new ATOM 0 HA LYS A 46 1.340 -16.839 -2.772 1.00 0.00 H new ATOM 0 HB2 LYS A 46 0.028 -19.094 -1.159 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -0.859 -18.142 -2.333 1.00 0.00 H new ATOM 0 HG2 LYS A 46 0.460 -18.984 -4.168 1.00 0.00 H new ATOM 0 HG3 LYS A 46 1.650 -19.684 -3.088 1.00 0.00 H new ATOM 0 HD2 LYS A 46 0.437 -21.518 -3.916 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -0.157 -21.285 -2.284 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -1.663 -20.149 -4.654 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -1.844 -21.831 -4.194 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -3.542 -20.723 -3.119 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -2.380 -20.943 -1.901 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -2.554 -19.427 -2.645 1.00 0.00 H new ATOM 709 N HIS A 47 0.405 -16.279 0.362 1.00 0.00 N ATOM 710 CA HIS A 47 -0.151 -15.223 1.252 1.00 0.00 C ATOM 711 C HIS A 47 0.739 -13.947 1.253 1.00 0.00 C ATOM 712 O HIS A 47 1.973 -14.013 1.258 1.00 0.00 O ATOM 713 CB HIS A 47 -0.311 -15.773 2.702 1.00 0.00 C ATOM 714 CG HIS A 47 -1.566 -16.612 2.978 1.00 0.00 C ATOM 715 ND1 HIS A 47 -2.387 -16.433 4.078 1.00 0.00 N ATOM 716 CD2 HIS A 47 -2.046 -17.687 2.206 1.00 0.00 C ATOM 717 CE1 HIS A 47 -3.304 -17.426 3.857 1.00 0.00 C ATOM 718 NE2 HIS A 47 -3.191 -18.242 2.760 1.00 0.00 N ATOM 0 H HIS A 47 0.810 -17.065 0.870 1.00 0.00 H new ATOM 0 HA HIS A 47 -1.131 -14.942 0.865 1.00 0.00 H new ATOM 0 HB2 HIS A 47 0.564 -16.380 2.936 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -0.306 -14.928 3.391 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -1.581 -18.036 1.296 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -4.120 -17.567 4.550 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -3.772 -19.020 2.447 1.00 0.00 H new ATOM 726 N PHE A 48 0.062 -12.788 1.243 1.00 0.00 N ATOM 727 CA PHE A 48 0.721 -11.455 1.212 1.00 0.00 C ATOM 728 C PHE A 48 -0.099 -10.510 2.124 1.00 0.00 C ATOM 729 O PHE A 48 -1.095 -9.926 1.682 1.00 0.00 O ATOM 730 CB PHE A 48 0.813 -10.879 -0.232 1.00 0.00 C ATOM 731 CG PHE A 48 1.818 -11.559 -1.171 1.00 0.00 C ATOM 732 CD1 PHE A 48 3.170 -11.210 -1.114 1.00 0.00 C ATOM 733 CD2 PHE A 48 1.397 -12.533 -2.083 1.00 0.00 C ATOM 734 CE1 PHE A 48 4.085 -11.829 -1.957 1.00 0.00 C ATOM 735 CE2 PHE A 48 2.324 -13.166 -2.908 1.00 0.00 C ATOM 736 CZ PHE A 48 3.667 -12.808 -2.848 1.00 0.00 C ATOM 0 H PHE A 48 -0.957 -12.739 1.256 1.00 0.00 H new ATOM 0 HA PHE A 48 1.747 -11.549 1.568 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -0.175 -10.938 -0.688 1.00 0.00 H new ATOM 0 HB3 PHE A 48 1.070 -9.822 -0.163 1.00 0.00 H new ATOM 0 HD1 PHE A 48 3.504 -10.458 -0.414 1.00 0.00 H new ATOM 0 HD2 PHE A 48 0.351 -12.795 -2.148 1.00 0.00 H new ATOM 0 HE1 PHE A 48 5.127 -11.547 -1.919 1.00 0.00 H new ATOM 0 HE2 PHE A 48 2.000 -13.935 -3.594 1.00 0.00 H new ATOM 0 HZ PHE A 48 4.384 -13.292 -3.495 1.00 0.00 H new ATOM 746 N LYS A 49 0.339 -10.343 3.389 1.00 0.00 N ATOM 747 CA LYS A 49 -0.291 -9.382 4.332 1.00 0.00 C ATOM 748 C LYS A 49 0.381 -7.994 4.157 1.00 0.00 C ATOM 749 O LYS A 49 1.490 -7.739 4.635 1.00 0.00 O ATOM 750 CB LYS A 49 -0.201 -9.901 5.784 1.00 0.00 C ATOM 751 CG LYS A 49 -1.031 -9.092 6.810 1.00 0.00 C ATOM 752 CD LYS A 49 -1.006 -9.628 8.259 1.00 0.00 C ATOM 753 CE LYS A 49 0.299 -9.409 9.055 1.00 0.00 C ATOM 754 NZ LYS A 49 1.361 -10.382 8.738 1.00 0.00 N ATOM 0 H LYS A 49 1.125 -10.858 3.785 1.00 0.00 H new ATOM 0 HA LYS A 49 -1.353 -9.280 4.108 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -0.532 -10.939 5.806 1.00 0.00 H new ATOM 0 HB3 LYS A 49 0.844 -9.893 6.095 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -0.667 -8.064 6.815 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -2.066 -9.062 6.470 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -1.823 -9.161 8.809 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -1.212 -10.698 8.230 1.00 0.00 H new ATOM 0 HE2 LYS A 49 0.670 -8.403 8.857 1.00 0.00 H new ATOM 0 HE3 LYS A 49 0.077 -9.463 10.121 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 1.949 -10.541 9.581 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 0.931 -11.281 8.441 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 1.953 -10.011 7.968 1.00 0.00 H new ATOM 768 N PHE A 50 -0.347 -7.118 3.464 1.00 0.00 N ATOM 769 CA PHE A 50 0.076 -5.721 3.202 1.00 0.00 C ATOM 770 C PHE A 50 -0.572 -4.766 4.238 1.00 0.00 C ATOM 771 O PHE A 50 -1.788 -4.795 4.458 1.00 0.00 O ATOM 772 CB PHE A 50 -0.177 -5.305 1.724 1.00 0.00 C ATOM 773 CG PHE A 50 -1.635 -5.107 1.259 1.00 0.00 C ATOM 774 CD1 PHE A 50 -2.451 -6.209 0.986 1.00 0.00 C ATOM 775 CD2 PHE A 50 -2.167 -3.817 1.146 1.00 0.00 C ATOM 776 CE1 PHE A 50 -3.781 -6.022 0.626 1.00 0.00 C ATOM 777 CE2 PHE A 50 -3.496 -3.633 0.772 1.00 0.00 C ATOM 778 CZ PHE A 50 -4.301 -4.737 0.507 1.00 0.00 C ATOM 0 H PHE A 50 -1.255 -7.349 3.061 1.00 0.00 H new ATOM 0 HA PHE A 50 1.156 -5.648 3.333 1.00 0.00 H new ATOM 0 HB2 PHE A 50 0.359 -4.373 1.545 1.00 0.00 H new ATOM 0 HB3 PHE A 50 0.276 -6.061 1.083 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -2.047 -7.208 1.055 1.00 0.00 H new ATOM 0 HD2 PHE A 50 -1.543 -2.959 1.350 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -4.413 -6.878 0.438 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -3.901 -2.635 0.688 1.00 0.00 H new ATOM 0 HZ PHE A 50 -5.329 -4.596 0.209 1.00 0.00 H new ATOM 788 N THR A 51 0.266 -3.914 4.844 1.00 0.00 N ATOM 789 CA THR A 51 -0.188 -2.880 5.813 1.00 0.00 C ATOM 790 C THR A 51 0.234 -1.506 5.217 1.00 0.00 C ATOM 791 O THR A 51 1.301 -0.971 5.535 1.00 0.00 O ATOM 792 CB THR A 51 0.376 -3.205 7.228 1.00 0.00 C ATOM 793 OG1 THR A 51 -0.002 -4.519 7.632 1.00 0.00 O ATOM 794 CG2 THR A 51 -0.114 -2.239 8.312 1.00 0.00 C ATOM 0 H THR A 51 1.273 -3.913 4.685 1.00 0.00 H new ATOM 0 HA THR A 51 -1.268 -2.856 5.958 1.00 0.00 H new ATOM 0 HB THR A 51 1.458 -3.111 7.134 1.00 0.00 H new ATOM 0 HG1 THR A 51 0.489 -4.766 8.443 1.00 0.00 H new ATOM 0 HG21 THR A 51 0.316 -2.522 9.273 1.00 0.00 H new ATOM 0 HG22 THR A 51 0.194 -1.224 8.061 1.00 0.00 H new ATOM 0 HG23 THR A 51 -1.201 -2.283 8.374 1.00 0.00 H new ATOM 802 N ILE A 52 -0.622 -0.966 4.328 1.00 0.00 N ATOM 803 CA ILE A 52 -0.295 0.228 3.493 1.00 0.00 C ATOM 804 C ILE A 52 -0.742 1.516 4.233 1.00 0.00 C ATOM 805 O ILE A 52 -1.938 1.746 4.436 1.00 0.00 O ATOM 806 CB ILE A 52 -0.820 0.108 2.017 1.00 0.00 C ATOM 807 CG1 ILE A 52 -0.347 1.289 1.114 1.00 0.00 C ATOM 808 CG2 ILE A 52 -2.350 -0.113 1.872 1.00 0.00 C ATOM 809 CD1 ILE A 52 -0.369 1.030 -0.403 1.00 0.00 C ATOM 0 H ILE A 52 -1.558 -1.336 4.162 1.00 0.00 H new ATOM 0 HA ILE A 52 0.786 0.287 3.369 1.00 0.00 H new ATOM 0 HB ILE A 52 -0.357 -0.812 1.661 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -0.975 2.155 1.324 1.00 0.00 H new ATOM 0 HG13 ILE A 52 0.670 1.556 1.402 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -2.609 -0.182 0.816 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -2.634 -1.037 2.377 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -2.883 0.725 2.322 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -0.020 1.919 -0.929 1.00 0.00 H new ATOM 0 HD12 ILE A 52 0.284 0.190 -0.638 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -1.386 0.798 -0.718 1.00 0.00 H new ATOM 821 N THR A 53 0.242 2.357 4.594 1.00 0.00 N ATOM 822 CA THR A 53 -0.013 3.657 5.274 1.00 0.00 C ATOM 823 C THR A 53 -0.173 4.744 4.176 1.00 0.00 C ATOM 824 O THR A 53 0.819 5.286 3.678 1.00 0.00 O ATOM 825 CB THR A 53 1.093 3.966 6.326 1.00 0.00 C ATOM 826 OG1 THR A 53 1.223 2.880 7.241 1.00 0.00 O ATOM 827 CG2 THR A 53 0.812 5.222 7.170 1.00 0.00 C ATOM 0 H THR A 53 1.230 2.166 4.429 1.00 0.00 H new ATOM 0 HA THR A 53 -0.936 3.627 5.853 1.00 0.00 H new ATOM 0 HB THR A 53 2.000 4.129 5.744 1.00 0.00 H new ATOM 0 HG1 THR A 53 2.063 2.405 7.068 1.00 0.00 H new ATOM 0 HG21 THR A 53 1.625 5.373 7.880 1.00 0.00 H new ATOM 0 HG22 THR A 53 0.736 6.090 6.516 1.00 0.00 H new ATOM 0 HG23 THR A 53 -0.124 5.094 7.713 1.00 0.00 H new ATOM 901 N ILE A 59 -4.442 1.003 6.025 1.00 0.00 N ATOM 902 CA ILE A 59 -5.456 0.037 5.516 1.00 0.00 C ATOM 903 C ILE A 59 -4.743 -1.353 5.510 1.00 0.00 C ATOM 904 O ILE A 59 -3.901 -1.618 4.645 1.00 0.00 O ATOM 905 CB ILE A 59 -6.040 0.432 4.104 1.00 0.00 C ATOM 906 CG1 ILE A 59 -6.531 1.907 3.939 1.00 0.00 C ATOM 907 CG2 ILE A 59 -7.214 -0.507 3.726 1.00 0.00 C ATOM 908 CD1 ILE A 59 -5.451 2.911 3.502 1.00 0.00 C ATOM 0 HA ILE A 59 -6.338 0.027 6.156 1.00 0.00 H new ATOM 0 HB ILE A 59 -5.184 0.325 3.438 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -7.338 1.925 3.207 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -6.953 2.241 4.887 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -7.607 -0.223 2.750 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -6.859 -1.537 3.689 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -8.003 -0.422 4.473 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -5.891 3.904 3.416 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -4.652 2.931 4.243 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -5.044 2.610 2.537 1.00 0.00 H new ATOM 920 N GLN A 60 -5.095 -2.232 6.471 1.00 0.00 N ATOM 921 CA GLN A 60 -4.505 -3.594 6.579 1.00 0.00 C ATOM 922 C GLN A 60 -5.491 -4.646 5.992 1.00 0.00 C ATOM 923 O GLN A 60 -6.627 -4.791 6.458 1.00 0.00 O ATOM 924 CB GLN A 60 -4.155 -3.901 8.059 1.00 0.00 C ATOM 925 CG GLN A 60 -3.362 -5.214 8.272 1.00 0.00 C ATOM 926 CD GLN A 60 -3.046 -5.514 9.745 1.00 0.00 C ATOM 927 OE1 GLN A 60 -3.837 -6.141 10.451 1.00 0.00 O ATOM 928 NE2 GLN A 60 -1.893 -5.090 10.241 1.00 0.00 N ATOM 0 H GLN A 60 -5.789 -2.026 7.190 1.00 0.00 H new ATOM 0 HA GLN A 60 -3.582 -3.642 6.001 1.00 0.00 H new ATOM 0 HB2 GLN A 60 -3.574 -3.071 8.461 1.00 0.00 H new ATOM 0 HB3 GLN A 60 -5.079 -3.952 8.635 1.00 0.00 H new ATOM 0 HG2 GLN A 60 -3.933 -6.044 7.856 1.00 0.00 H new ATOM 0 HG3 GLN A 60 -2.428 -5.158 7.713 1.00 0.00 H new ATOM 0 HE21 GLN A 60 -1.243 -4.571 9.650 1.00 0.00 H new ATOM 0 HE22 GLN A 60 -1.655 -5.282 11.214 1.00 0.00 H new ATOM 937 N ASN A 61 -4.999 -5.401 5.001 1.00 0.00 N ATOM 938 CA ASN A 61 -5.684 -6.612 4.456 1.00 0.00 C ATOM 939 C ASN A 61 -4.608 -7.668 4.044 1.00 0.00 C ATOM 940 O ASN A 61 -3.423 -7.352 3.880 1.00 0.00 O ATOM 941 CB ASN A 61 -6.586 -6.275 3.231 1.00 0.00 C ATOM 942 CG ASN A 61 -7.779 -5.334 3.467 1.00 0.00 C ATOM 943 OD1 ASN A 61 -8.759 -5.684 4.126 1.00 0.00 O ATOM 944 ND2 ASN A 61 -7.716 -4.129 2.931 1.00 0.00 N ATOM 0 H ASN A 61 -4.110 -5.199 4.543 1.00 0.00 H new ATOM 0 HA ASN A 61 -6.331 -7.012 5.237 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -5.955 -5.832 2.460 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -6.971 -7.212 2.828 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -8.486 -3.473 3.060 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -6.897 -3.855 2.388 1.00 0.00 H new ATOM 951 N GLU A 62 -5.037 -8.930 3.824 1.00 0.00 N ATOM 952 CA GLU A 62 -4.209 -9.949 3.118 1.00 0.00 C ATOM 953 C GLU A 62 -4.933 -10.456 1.840 1.00 0.00 C ATOM 954 O GLU A 62 -6.151 -10.672 1.833 1.00 0.00 O ATOM 955 CB GLU A 62 -3.705 -11.081 4.066 1.00 0.00 C ATOM 956 CG GLU A 62 -4.657 -12.230 4.486 1.00 0.00 C ATOM 957 CD GLU A 62 -4.895 -13.315 3.420 1.00 0.00 C ATOM 958 OE1 GLU A 62 -3.913 -13.858 2.866 1.00 0.00 O ATOM 959 OE2 GLU A 62 -6.071 -13.625 3.128 1.00 0.00 O ATOM 0 H GLU A 62 -5.950 -9.273 4.122 1.00 0.00 H new ATOM 0 HA GLU A 62 -3.293 -9.466 2.779 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -2.837 -11.538 3.590 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -3.352 -10.603 4.980 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -4.253 -12.705 5.380 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -5.619 -11.799 4.762 1.00 0.00 H new ATOM 966 N PHE A 63 -4.138 -10.708 0.786 1.00 0.00 N ATOM 967 CA PHE A 63 -4.580 -11.472 -0.410 1.00 0.00 C ATOM 968 C PHE A 63 -3.721 -12.755 -0.570 1.00 0.00 C ATOM 969 O PHE A 63 -2.492 -12.740 -0.444 1.00 0.00 O ATOM 970 CB PHE A 63 -4.604 -10.631 -1.719 1.00 0.00 C ATOM 971 CG PHE A 63 -3.346 -9.833 -2.109 1.00 0.00 C ATOM 972 CD1 PHE A 63 -2.243 -10.470 -2.689 1.00 0.00 C ATOM 973 CD2 PHE A 63 -3.322 -8.446 -1.936 1.00 0.00 C ATOM 974 CE1 PHE A 63 -1.124 -9.732 -3.057 1.00 0.00 C ATOM 975 CE2 PHE A 63 -2.205 -7.708 -2.316 1.00 0.00 C ATOM 976 CZ PHE A 63 -1.107 -8.351 -2.875 1.00 0.00 C ATOM 0 H PHE A 63 -3.170 -10.391 0.732 1.00 0.00 H new ATOM 0 HA PHE A 63 -5.618 -11.755 -0.236 1.00 0.00 H new ATOM 0 HB2 PHE A 63 -4.835 -11.307 -2.542 1.00 0.00 H new ATOM 0 HB3 PHE A 63 -5.432 -9.926 -1.644 1.00 0.00 H new ATOM 0 HD1 PHE A 63 -2.261 -11.538 -2.851 1.00 0.00 H new ATOM 0 HD2 PHE A 63 -4.176 -7.944 -1.505 1.00 0.00 H new ATOM 0 HE1 PHE A 63 -0.266 -10.230 -3.485 1.00 0.00 H new ATOM 0 HE2 PHE A 63 -2.191 -6.637 -2.177 1.00 0.00 H new ATOM 0 HZ PHE A 63 -0.239 -7.779 -3.169 1.00 0.00 H new ATOM 986 N THR A 64 -4.409 -13.847 -0.924 1.00 0.00 N ATOM 987 CA THR A 64 -3.776 -15.114 -1.362 1.00 0.00 C ATOM 988 C THR A 64 -3.776 -15.118 -2.923 1.00 0.00 C ATOM 989 O THR A 64 -4.824 -14.978 -3.562 1.00 0.00 O ATOM 990 CB THR A 64 -4.558 -16.301 -0.724 1.00 0.00 C ATOM 991 OG1 THR A 64 -4.541 -16.189 0.697 1.00 0.00 O ATOM 992 CG2 THR A 64 -3.997 -17.688 -1.076 1.00 0.00 C ATOM 0 H THR A 64 -5.428 -13.885 -0.917 1.00 0.00 H new ATOM 0 HA THR A 64 -2.742 -15.214 -1.033 1.00 0.00 H new ATOM 0 HB THR A 64 -5.565 -16.230 -1.135 1.00 0.00 H new ATOM 0 HG1 THR A 64 -5.036 -16.938 1.090 1.00 0.00 H new ATOM 0 HG21 THR A 64 -4.599 -18.457 -0.592 1.00 0.00 H new ATOM 0 HG22 THR A 64 -4.028 -17.829 -2.156 1.00 0.00 H new ATOM 0 HG23 THR A 64 -2.966 -17.762 -0.730 1.00 0.00 H new ATOM 1000 N VAL A 65 -2.585 -15.303 -3.524 1.00 0.00 N ATOM 1001 CA VAL A 65 -2.405 -15.359 -5.007 1.00 0.00 C ATOM 1002 C VAL A 65 -2.985 -16.703 -5.553 1.00 0.00 C ATOM 1003 O VAL A 65 -2.730 -17.780 -5.005 1.00 0.00 O ATOM 1004 CB VAL A 65 -0.901 -15.094 -5.369 1.00 0.00 C ATOM 1005 CG1 VAL A 65 -0.466 -15.482 -6.802 1.00 0.00 C ATOM 1006 CG2 VAL A 65 -0.520 -13.608 -5.167 1.00 0.00 C ATOM 0 H VAL A 65 -1.715 -15.419 -3.005 1.00 0.00 H new ATOM 0 HA VAL A 65 -2.968 -14.569 -5.504 1.00 0.00 H new ATOM 0 HB VAL A 65 -0.375 -15.754 -4.679 1.00 0.00 H new ATOM 0 HG11 VAL A 65 0.591 -15.253 -6.936 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -0.629 -16.549 -6.955 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -1.054 -14.918 -7.526 1.00 0.00 H new ATOM 0 HG21 VAL A 65 0.528 -13.463 -5.427 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -1.143 -12.983 -5.806 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -0.677 -13.331 -4.125 1.00 0.00 H new ATOM 1016 N GLY A 66 -3.797 -16.591 -6.618 1.00 0.00 N ATOM 1017 CA GLY A 66 -4.710 -17.680 -7.045 1.00 0.00 C ATOM 1018 C GLY A 66 -6.184 -17.446 -6.637 1.00 0.00 C ATOM 1019 O GLY A 66 -7.069 -17.451 -7.496 1.00 0.00 O ATOM 0 H GLY A 66 -3.844 -15.758 -7.204 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -4.654 -17.786 -8.128 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -4.367 -18.621 -6.614 1.00 0.00 H new ATOM 1023 N GLU A 67 -6.433 -17.254 -5.327 1.00 0.00 N ATOM 1024 CA GLU A 67 -7.786 -17.011 -4.761 1.00 0.00 C ATOM 1025 C GLU A 67 -8.344 -15.595 -5.104 1.00 0.00 C ATOM 1026 O GLU A 67 -7.599 -14.609 -5.179 1.00 0.00 O ATOM 1027 CB GLU A 67 -7.649 -17.217 -3.223 1.00 0.00 C ATOM 1028 CG GLU A 67 -8.963 -17.248 -2.411 1.00 0.00 C ATOM 1029 CD GLU A 67 -8.721 -17.450 -0.913 1.00 0.00 C ATOM 1030 OE1 GLU A 67 -8.495 -16.450 -0.196 1.00 0.00 O ATOM 1031 OE2 GLU A 67 -8.753 -18.609 -0.445 1.00 0.00 O ATOM 0 H GLU A 67 -5.697 -17.262 -4.620 1.00 0.00 H new ATOM 0 HA GLU A 67 -8.508 -17.701 -5.197 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -7.119 -18.154 -3.050 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -7.022 -16.418 -2.827 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -9.504 -16.315 -2.566 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -9.599 -18.051 -2.785 1.00 0.00 H new ATOM 1038 N GLU A 68 -9.683 -15.515 -5.249 1.00 0.00 N ATOM 1039 CA GLU A 68 -10.414 -14.225 -5.347 1.00 0.00 C ATOM 1040 C GLU A 68 -10.625 -13.649 -3.915 1.00 0.00 C ATOM 1041 O GLU A 68 -11.460 -14.142 -3.149 1.00 0.00 O ATOM 1042 CB GLU A 68 -11.746 -14.454 -6.114 1.00 0.00 C ATOM 1043 CG GLU A 68 -12.410 -13.140 -6.565 1.00 0.00 C ATOM 1044 CD GLU A 68 -13.695 -13.340 -7.369 1.00 0.00 C ATOM 1045 OE1 GLU A 68 -14.771 -13.517 -6.757 1.00 0.00 O ATOM 1046 OE2 GLU A 68 -13.635 -13.314 -8.619 1.00 0.00 O ATOM 0 H GLU A 68 -10.288 -16.334 -5.302 1.00 0.00 H new ATOM 0 HA GLU A 68 -9.842 -13.487 -5.909 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -11.554 -15.077 -6.988 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -12.437 -15.004 -5.476 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -12.634 -12.537 -5.685 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -11.700 -12.574 -7.168 1.00 0.00 H new ATOM 1053 N CYS A 69 -9.815 -12.637 -3.562 1.00 0.00 N ATOM 1054 CA CYS A 69 -9.681 -12.159 -2.165 1.00 0.00 C ATOM 1055 C CYS A 69 -10.508 -10.876 -1.914 1.00 0.00 C ATOM 1056 O CYS A 69 -10.505 -9.934 -2.713 1.00 0.00 O ATOM 1057 CB CYS A 69 -8.195 -11.886 -1.868 1.00 0.00 C ATOM 1058 SG CYS A 69 -7.188 -13.356 -2.248 1.00 0.00 S ATOM 0 H CYS A 69 -9.236 -12.126 -4.228 1.00 0.00 H new ATOM 0 HA CYS A 69 -10.066 -12.933 -1.501 1.00 0.00 H new ATOM 0 HB2 CYS A 69 -7.850 -11.038 -2.460 1.00 0.00 H new ATOM 0 HB3 CYS A 69 -8.071 -11.614 -0.820 1.00 0.00 H new ATOM 0 HG CYS A 69 -7.466 -13.774 -3.447 1.00 0.00 H new ATOM 1064 N GLU A 70 -11.170 -10.851 -0.747 1.00 0.00 N ATOM 1065 CA GLU A 70 -11.988 -9.697 -0.288 1.00 0.00 C ATOM 1066 C GLU A 70 -11.084 -8.580 0.317 1.00 0.00 C ATOM 1067 O GLU A 70 -10.384 -8.805 1.310 1.00 0.00 O ATOM 1068 CB GLU A 70 -13.157 -10.171 0.612 1.00 0.00 C ATOM 1069 CG GLU A 70 -12.788 -10.851 1.941 1.00 0.00 C ATOM 1070 CD GLU A 70 -13.999 -11.196 2.812 1.00 0.00 C ATOM 1071 OE1 GLU A 70 -14.808 -12.065 2.416 1.00 0.00 O ATOM 1072 OE2 GLU A 70 -14.143 -10.605 3.905 1.00 0.00 O ATOM 0 H GLU A 70 -11.159 -11.628 -0.087 1.00 0.00 H new ATOM 0 HA GLU A 70 -12.474 -9.224 -1.142 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -13.783 -9.307 0.837 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -13.768 -10.865 0.035 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -12.231 -11.764 1.730 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -12.123 -10.195 2.502 1.00 0.00 H new ATOM 1079 N LEU A 71 -11.063 -7.407 -0.341 1.00 0.00 N ATOM 1080 CA LEU A 71 -10.062 -6.342 -0.072 1.00 0.00 C ATOM 1081 C LEU A 71 -10.790 -4.975 -0.024 1.00 0.00 C ATOM 1082 O LEU A 71 -11.227 -4.463 -1.063 1.00 0.00 O ATOM 1083 CB LEU A 71 -8.965 -6.311 -1.180 1.00 0.00 C ATOM 1084 CG LEU A 71 -8.016 -7.532 -1.336 1.00 0.00 C ATOM 1085 CD1 LEU A 71 -7.062 -7.302 -2.525 1.00 0.00 C ATOM 1086 CD2 LEU A 71 -7.218 -7.834 -0.054 1.00 0.00 C ATOM 0 H LEU A 71 -11.733 -7.165 -1.071 1.00 0.00 H new ATOM 0 HA LEU A 71 -9.575 -6.547 0.881 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -9.467 -6.160 -2.136 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -8.344 -5.432 -1.004 1.00 0.00 H new ATOM 0 HG LEU A 71 -8.639 -8.406 -1.527 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -6.399 -8.160 -2.631 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -7.643 -7.178 -3.439 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -6.469 -6.405 -2.347 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -6.573 -8.696 -0.222 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -6.608 -6.969 0.207 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -7.908 -8.051 0.762 1.00 0.00 H new ATOM 1180 N LYS A 78 -14.904 -3.105 -0.009 1.00 0.00 N ATOM 1181 CA LYS A 78 -14.757 -4.586 -0.081 1.00 0.00 C ATOM 1182 C LYS A 78 -15.005 -5.103 -1.532 1.00 0.00 C ATOM 1183 O LYS A 78 -16.155 -5.301 -1.935 1.00 0.00 O ATOM 1184 CB LYS A 78 -15.507 -5.348 1.051 1.00 0.00 C ATOM 1185 CG LYS A 78 -15.107 -6.832 1.207 1.00 0.00 C ATOM 1186 CD LYS A 78 -15.805 -7.575 2.365 1.00 0.00 C ATOM 1187 CE LYS A 78 -15.283 -7.203 3.767 1.00 0.00 C ATOM 1188 NZ LYS A 78 -15.916 -8.022 4.816 1.00 0.00 N ATOM 0 HA LYS A 78 -13.717 -4.830 0.137 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -15.326 -4.836 1.996 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -16.579 -5.293 0.859 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -15.328 -7.353 0.275 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -14.029 -6.889 1.356 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -16.874 -7.367 2.322 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -15.683 -8.648 2.218 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -14.202 -7.339 3.801 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -15.478 -6.148 3.961 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -15.744 -7.589 5.746 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -16.940 -8.076 4.643 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -15.511 -8.980 4.800 1.00 0.00 H new ATOM 1202 N VAL A 79 -13.909 -5.304 -2.292 1.00 0.00 N ATOM 1203 CA VAL A 79 -13.950 -5.793 -3.701 1.00 0.00 C ATOM 1204 C VAL A 79 -13.322 -7.219 -3.694 1.00 0.00 C ATOM 1205 O VAL A 79 -12.161 -7.397 -3.303 1.00 0.00 O ATOM 1206 CB VAL A 79 -13.192 -4.860 -4.715 1.00 0.00 C ATOM 1207 CG1 VAL A 79 -13.408 -5.293 -6.186 1.00 0.00 C ATOM 1208 CG2 VAL A 79 -13.548 -3.360 -4.617 1.00 0.00 C ATOM 0 H VAL A 79 -12.963 -5.133 -1.952 1.00 0.00 H new ATOM 0 HA VAL A 79 -14.984 -5.800 -4.046 1.00 0.00 H new ATOM 0 HB VAL A 79 -12.150 -4.980 -4.419 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -12.865 -4.618 -6.847 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -13.040 -6.310 -6.324 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -14.471 -5.256 -6.424 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -12.974 -2.801 -5.356 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -14.613 -3.226 -4.807 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -13.309 -2.994 -3.619 1.00 0.00 H new ATOM 1218 N LYS A 80 -14.076 -8.212 -4.201 1.00 0.00 N ATOM 1219 CA LYS A 80 -13.554 -9.587 -4.423 1.00 0.00 C ATOM 1220 C LYS A 80 -12.820 -9.639 -5.795 1.00 0.00 C ATOM 1221 O LYS A 80 -13.451 -9.589 -6.856 1.00 0.00 O ATOM 1222 CB LYS A 80 -14.695 -10.633 -4.292 1.00 0.00 C ATOM 1223 CG LYS A 80 -15.132 -10.896 -2.831 1.00 0.00 C ATOM 1224 CD LYS A 80 -16.112 -12.069 -2.625 1.00 0.00 C ATOM 1225 CE LYS A 80 -15.480 -13.461 -2.834 1.00 0.00 C ATOM 1226 NZ LYS A 80 -16.407 -14.542 -2.457 1.00 0.00 N ATOM 0 H LYS A 80 -15.053 -8.094 -4.468 1.00 0.00 H new ATOM 0 HA LYS A 80 -12.825 -9.845 -3.654 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -15.557 -10.291 -4.864 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -14.368 -11.572 -4.739 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -14.240 -11.083 -2.233 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -15.593 -9.989 -2.441 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -16.520 -12.015 -1.616 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -16.949 -11.955 -3.314 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -15.192 -13.577 -3.879 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -14.569 -13.540 -2.241 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -15.948 -15.462 -2.611 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -16.663 -14.446 -1.453 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -17.266 -14.482 -3.040 1.00 0.00 H new ATOM 1240 N THR A 81 -11.473 -9.696 -5.738 1.00 0.00 N ATOM 1241 CA THR A 81 -10.583 -9.511 -6.920 1.00 0.00 C ATOM 1242 C THR A 81 -9.371 -10.496 -6.851 1.00 0.00 C ATOM 1243 O THR A 81 -8.783 -10.713 -5.786 1.00 0.00 O ATOM 1244 CB THR A 81 -10.171 -8.012 -7.064 1.00 0.00 C ATOM 1245 OG1 THR A 81 -9.455 -7.837 -8.279 1.00 0.00 O ATOM 1246 CG2 THR A 81 -9.336 -7.399 -5.921 1.00 0.00 C ATOM 0 H THR A 81 -10.964 -9.872 -4.872 1.00 0.00 H new ATOM 0 HA THR A 81 -11.125 -9.763 -7.832 1.00 0.00 H new ATOM 0 HB THR A 81 -11.121 -7.478 -7.038 1.00 0.00 H new ATOM 0 HG1 THR A 81 -8.492 -7.852 -8.097 1.00 0.00 H new ATOM 0 HG21 THR A 81 -9.119 -6.355 -6.148 1.00 0.00 H new ATOM 0 HG22 THR A 81 -9.897 -7.459 -4.988 1.00 0.00 H new ATOM 0 HG23 THR A 81 -8.401 -7.949 -5.818 1.00 0.00 H new ATOM 1254 N VAL A 82 -8.994 -11.069 -8.014 1.00 0.00 N ATOM 1255 CA VAL A 82 -7.931 -12.116 -8.106 1.00 0.00 C ATOM 1256 C VAL A 82 -6.561 -11.413 -8.353 1.00 0.00 C ATOM 1257 O VAL A 82 -6.425 -10.602 -9.277 1.00 0.00 O ATOM 1258 CB VAL A 82 -8.227 -13.190 -9.217 1.00 0.00 C ATOM 1259 CG1 VAL A 82 -7.208 -14.358 -9.182 1.00 0.00 C ATOM 1260 CG2 VAL A 82 -9.635 -13.826 -9.160 1.00 0.00 C ATOM 0 H VAL A 82 -9.409 -10.827 -8.914 1.00 0.00 H new ATOM 0 HA VAL A 82 -7.907 -12.665 -7.165 1.00 0.00 H new ATOM 0 HB VAL A 82 -8.148 -12.611 -10.137 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -7.450 -15.076 -9.966 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -6.203 -13.969 -9.344 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -7.254 -14.852 -8.211 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -9.739 -14.552 -9.966 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -9.769 -14.327 -8.201 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -10.390 -13.048 -9.272 1.00 0.00 H new ATOM 1270 N VAL A 83 -5.548 -11.781 -7.544 1.00 0.00 N ATOM 1271 CA VAL A 83 -4.161 -11.255 -7.687 1.00 0.00 C ATOM 1272 C VAL A 83 -3.283 -12.390 -8.295 1.00 0.00 C ATOM 1273 O VAL A 83 -3.220 -13.496 -7.748 1.00 0.00 O ATOM 1274 CB VAL A 83 -3.564 -10.688 -6.349 1.00 0.00 C ATOM 1275 CG1 VAL A 83 -2.279 -9.868 -6.626 1.00 0.00 C ATOM 1276 CG2 VAL A 83 -4.543 -9.825 -5.514 1.00 0.00 C ATOM 0 H VAL A 83 -5.658 -12.445 -6.777 1.00 0.00 H new ATOM 0 HA VAL A 83 -4.176 -10.393 -8.354 1.00 0.00 H new ATOM 0 HB VAL A 83 -3.342 -11.571 -5.750 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -1.882 -9.485 -5.686 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -1.534 -10.507 -7.100 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -2.515 -9.034 -7.287 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -4.042 -9.479 -4.610 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -4.864 -8.966 -6.103 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -5.413 -10.423 -5.241 1.00 0.00 H new ATOM 1286 N GLN A 84 -2.589 -12.086 -9.407 1.00 0.00 N ATOM 1287 CA GLN A 84 -1.552 -12.984 -9.991 1.00 0.00 C ATOM 1288 C GLN A 84 -0.123 -12.431 -9.749 1.00 0.00 C ATOM 1289 O GLN A 84 0.090 -11.223 -9.610 1.00 0.00 O ATOM 1290 CB GLN A 84 -1.789 -13.228 -11.500 1.00 0.00 C ATOM 1291 CG GLN A 84 -2.974 -14.142 -11.870 1.00 0.00 C ATOM 1292 CD GLN A 84 -3.060 -15.516 -11.172 1.00 0.00 C ATOM 1293 OE1 GLN A 84 -2.135 -16.327 -11.231 1.00 0.00 O ATOM 1294 NE2 GLN A 84 -4.166 -15.804 -10.502 1.00 0.00 N ATOM 0 H GLN A 84 -2.723 -11.220 -9.929 1.00 0.00 H new ATOM 0 HA GLN A 84 -1.639 -13.942 -9.479 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -1.939 -12.262 -11.983 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -0.881 -13.658 -11.923 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -3.896 -13.600 -11.659 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -2.944 -14.313 -12.946 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -4.927 -15.126 -10.458 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -4.257 -16.703 -10.030 1.00 0.00 H new ATOM 1303 N LEU A 85 0.858 -13.353 -9.732 1.00 0.00 N ATOM 1304 CA LEU A 85 2.288 -13.031 -9.508 1.00 0.00 C ATOM 1305 C LEU A 85 3.100 -13.477 -10.755 1.00 0.00 C ATOM 1306 O LEU A 85 3.090 -14.657 -11.124 1.00 0.00 O ATOM 1307 CB LEU A 85 2.749 -13.720 -8.193 1.00 0.00 C ATOM 1308 CG LEU A 85 4.242 -13.564 -7.809 1.00 0.00 C ATOM 1309 CD1 LEU A 85 4.701 -12.096 -7.671 1.00 0.00 C ATOM 1310 CD2 LEU A 85 4.559 -14.341 -6.517 1.00 0.00 C ATOM 0 H LEU A 85 0.684 -14.348 -9.874 1.00 0.00 H new ATOM 0 HA LEU A 85 2.452 -11.960 -9.386 1.00 0.00 H new ATOM 0 HB2 LEU A 85 2.145 -13.328 -7.374 1.00 0.00 H new ATOM 0 HB3 LEU A 85 2.528 -14.784 -8.272 1.00 0.00 H new ATOM 0 HG LEU A 85 4.805 -13.987 -8.641 1.00 0.00 H new ATOM 0 HD11 LEU A 85 5.757 -12.069 -7.401 1.00 0.00 H new ATOM 0 HD12 LEU A 85 4.556 -11.579 -8.619 1.00 0.00 H new ATOM 0 HD13 LEU A 85 4.115 -11.603 -6.895 1.00 0.00 H new ATOM 0 HD21 LEU A 85 5.613 -14.217 -6.267 1.00 0.00 H new ATOM 0 HD22 LEU A 85 3.945 -13.958 -5.702 1.00 0.00 H new ATOM 0 HD23 LEU A 85 4.344 -15.399 -6.667 1.00 0.00 H new ATOM 1322 N GLU A 86 3.831 -12.521 -11.362 1.00 0.00 N ATOM 1323 CA GLU A 86 4.723 -12.784 -12.521 1.00 0.00 C ATOM 1324 C GLU A 86 6.170 -12.341 -12.160 1.00 0.00 C ATOM 1325 O GLU A 86 6.417 -11.201 -11.750 1.00 0.00 O ATOM 1326 CB GLU A 86 4.198 -12.027 -13.767 1.00 0.00 C ATOM 1327 CG GLU A 86 4.795 -12.508 -15.107 1.00 0.00 C ATOM 1328 CD GLU A 86 4.356 -11.644 -16.290 1.00 0.00 C ATOM 1329 OE1 GLU A 86 5.022 -10.622 -16.568 1.00 0.00 O ATOM 1330 OE2 GLU A 86 3.345 -11.979 -16.946 1.00 0.00 O ATOM 0 H GLU A 86 3.823 -11.545 -11.067 1.00 0.00 H new ATOM 0 HA GLU A 86 4.733 -13.849 -12.754 1.00 0.00 H new ATOM 0 HB2 GLU A 86 3.114 -12.130 -13.809 1.00 0.00 H new ATOM 0 HB3 GLU A 86 4.413 -10.965 -13.648 1.00 0.00 H new ATOM 0 HG2 GLU A 86 5.883 -12.500 -15.040 1.00 0.00 H new ATOM 0 HG3 GLU A 86 4.494 -13.541 -15.285 1.00 0.00 H new ATOM 1337 N GLY A 87 7.119 -13.268 -12.354 1.00 0.00 N ATOM 1338 CA GLY A 87 8.572 -13.008 -12.152 1.00 0.00 C ATOM 1339 C GLY A 87 9.149 -12.778 -10.732 1.00 0.00 C ATOM 1340 O GLY A 87 10.271 -12.279 -10.611 1.00 0.00 O ATOM 0 H GLY A 87 6.913 -14.221 -12.655 1.00 0.00 H new ATOM 0 HA2 GLY A 87 9.111 -13.852 -12.583 1.00 0.00 H new ATOM 0 HA3 GLY A 87 8.826 -12.130 -12.746 1.00 0.00 H new ATOM 1344 N ASP A 88 8.374 -13.093 -9.682 1.00 0.00 N ATOM 1345 CA ASP A 88 8.612 -12.628 -8.280 1.00 0.00 C ATOM 1346 C ASP A 88 8.749 -11.072 -8.094 1.00 0.00 C ATOM 1347 O ASP A 88 9.603 -10.599 -7.336 1.00 0.00 O ATOM 1348 CB ASP A 88 9.713 -13.489 -7.588 1.00 0.00 C ATOM 1349 CG ASP A 88 9.641 -13.495 -6.053 1.00 0.00 C ATOM 1350 OD1 ASP A 88 8.814 -14.249 -5.493 1.00 0.00 O ATOM 1351 OD2 ASP A 88 10.405 -12.749 -5.402 1.00 0.00 O ATOM 0 H ASP A 88 7.549 -13.686 -9.770 1.00 0.00 H new ATOM 0 HA ASP A 88 7.687 -12.812 -7.733 1.00 0.00 H new ATOM 0 HB2 ASP A 88 9.634 -14.515 -7.948 1.00 0.00 H new ATOM 0 HB3 ASP A 88 10.692 -13.119 -7.892 1.00 0.00 H new ATOM 1356 N ASN A 89 7.902 -10.280 -8.787 1.00 0.00 N ATOM 1357 CA ASN A 89 7.963 -8.792 -8.770 1.00 0.00 C ATOM 1358 C ASN A 89 6.644 -8.057 -9.162 1.00 0.00 C ATOM 1359 O ASN A 89 6.493 -6.910 -8.740 1.00 0.00 O ATOM 1360 CB ASN A 89 9.182 -8.218 -9.551 1.00 0.00 C ATOM 1361 CG ASN A 89 9.175 -8.292 -11.095 1.00 0.00 C ATOM 1362 OD1 ASN A 89 8.963 -9.348 -11.691 1.00 0.00 O ATOM 1363 ND2 ASN A 89 9.419 -7.173 -11.766 1.00 0.00 N ATOM 0 H ASN A 89 7.155 -10.649 -9.375 1.00 0.00 H new ATOM 0 HA ASN A 89 8.107 -8.571 -7.712 1.00 0.00 H new ATOM 0 HB2 ASN A 89 9.291 -7.170 -9.271 1.00 0.00 H new ATOM 0 HB3 ASN A 89 10.074 -8.736 -9.199 1.00 0.00 H new ATOM 0 HD21 ASN A 89 9.432 -7.182 -12.786 1.00 0.00 H new ATOM 0 HD22 ASN A 89 9.593 -6.304 -11.262 1.00 0.00 H new ATOM 1370 N LYS A 90 5.730 -8.644 -9.965 1.00 0.00 N ATOM 1371 CA LYS A 90 4.520 -7.943 -10.474 1.00 0.00 C ATOM 1372 C LYS A 90 3.252 -8.595 -9.858 1.00 0.00 C ATOM 1373 O LYS A 90 2.793 -9.640 -10.330 1.00 0.00 O ATOM 1374 CB LYS A 90 4.483 -7.970 -12.028 1.00 0.00 C ATOM 1375 CG LYS A 90 5.548 -7.100 -12.729 1.00 0.00 C ATOM 1376 CD LYS A 90 5.427 -7.120 -14.265 1.00 0.00 C ATOM 1377 CE LYS A 90 6.504 -6.264 -14.955 1.00 0.00 C ATOM 1378 NZ LYS A 90 6.366 -6.298 -16.423 1.00 0.00 N ATOM 0 H LYS A 90 5.805 -9.611 -10.280 1.00 0.00 H new ATOM 0 HA LYS A 90 4.551 -6.896 -10.173 1.00 0.00 H new ATOM 0 HB2 LYS A 90 4.604 -9.001 -12.360 1.00 0.00 H new ATOM 0 HB3 LYS A 90 3.497 -7.643 -12.357 1.00 0.00 H new ATOM 0 HG2 LYS A 90 5.459 -6.072 -12.377 1.00 0.00 H new ATOM 0 HG3 LYS A 90 6.540 -7.450 -12.444 1.00 0.00 H new ATOM 0 HD2 LYS A 90 5.504 -8.148 -14.618 1.00 0.00 H new ATOM 0 HD3 LYS A 90 4.440 -6.757 -14.553 1.00 0.00 H new ATOM 0 HE2 LYS A 90 6.430 -5.234 -14.606 1.00 0.00 H new ATOM 0 HE3 LYS A 90 7.493 -6.626 -14.673 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 7.108 -5.711 -16.855 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 6.461 -7.278 -16.758 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 5.432 -5.929 -16.692 1.00 0.00 H new ATOM 1392 N LEU A 91 2.675 -7.946 -8.826 1.00 0.00 N ATOM 1393 CA LEU A 91 1.371 -8.355 -8.232 1.00 0.00 C ATOM 1394 C LEU A 91 0.242 -7.513 -8.892 1.00 0.00 C ATOM 1395 O LEU A 91 0.082 -6.323 -8.599 1.00 0.00 O ATOM 1396 CB LEU A 91 1.388 -8.237 -6.681 1.00 0.00 C ATOM 1397 CG LEU A 91 2.213 -9.319 -5.928 1.00 0.00 C ATOM 1398 CD1 LEU A 91 2.470 -8.917 -4.463 1.00 0.00 C ATOM 1399 CD2 LEU A 91 1.562 -10.715 -5.972 1.00 0.00 C ATOM 0 H LEU A 91 3.090 -7.129 -8.379 1.00 0.00 H new ATOM 0 HA LEU A 91 1.182 -9.409 -8.438 1.00 0.00 H new ATOM 0 HB2 LEU A 91 1.782 -7.256 -6.415 1.00 0.00 H new ATOM 0 HB3 LEU A 91 0.360 -8.276 -6.321 1.00 0.00 H new ATOM 0 HG LEU A 91 3.164 -9.380 -6.458 1.00 0.00 H new ATOM 0 HD11 LEU A 91 3.049 -9.697 -3.968 1.00 0.00 H new ATOM 0 HD12 LEU A 91 3.025 -7.979 -4.435 1.00 0.00 H new ATOM 0 HD13 LEU A 91 1.518 -8.790 -3.948 1.00 0.00 H new ATOM 0 HD21 LEU A 91 2.186 -11.425 -5.429 1.00 0.00 H new ATOM 0 HD22 LEU A 91 0.576 -10.671 -5.510 1.00 0.00 H new ATOM 0 HD23 LEU A 91 1.463 -11.038 -7.008 1.00 0.00 H new ATOM 1411 N VAL A 92 -0.499 -8.146 -9.820 1.00 0.00 N ATOM 1412 CA VAL A 92 -1.406 -7.446 -10.777 1.00 0.00 C ATOM 1413 C VAL A 92 -2.886 -7.798 -10.442 1.00 0.00 C ATOM 1414 O VAL A 92 -3.246 -8.980 -10.393 1.00 0.00 O ATOM 1415 CB VAL A 92 -1.021 -7.741 -12.270 1.00 0.00 C ATOM 1416 CG1 VAL A 92 0.324 -7.087 -12.665 1.00 0.00 C ATOM 1417 CG2 VAL A 92 -1.002 -9.231 -12.697 1.00 0.00 C ATOM 0 H VAL A 92 -0.493 -9.159 -9.936 1.00 0.00 H new ATOM 0 HA VAL A 92 -1.287 -6.369 -10.661 1.00 0.00 H new ATOM 0 HB VAL A 92 -1.848 -7.286 -12.816 1.00 0.00 H new ATOM 0 HG11 VAL A 92 0.549 -7.318 -13.706 1.00 0.00 H new ATOM 0 HG12 VAL A 92 0.254 -6.006 -12.540 1.00 0.00 H new ATOM 0 HG13 VAL A 92 1.118 -7.475 -12.027 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -0.722 -9.305 -13.748 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -0.278 -9.774 -12.090 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -1.992 -9.663 -12.554 1.00 0.00 H new ATOM 1427 N THR A 93 -3.739 -6.775 -10.206 1.00 0.00 N ATOM 1428 CA THR A 93 -5.159 -6.987 -9.801 1.00 0.00 C ATOM 1429 C THR A 93 -6.021 -5.756 -10.188 1.00 0.00 C ATOM 1430 O THR A 93 -5.647 -4.614 -9.906 1.00 0.00 O ATOM 1431 CB THR A 93 -5.284 -7.364 -8.295 1.00 0.00 C ATOM 1432 OG1 THR A 93 -6.618 -7.760 -8.002 1.00 0.00 O ATOM 1433 CG2 THR A 93 -4.851 -6.307 -7.262 1.00 0.00 C ATOM 0 H THR A 93 -3.475 -5.793 -10.287 1.00 0.00 H new ATOM 0 HA THR A 93 -5.549 -7.843 -10.352 1.00 0.00 H new ATOM 0 HB THR A 93 -4.564 -8.175 -8.183 1.00 0.00 H new ATOM 0 HG1 THR A 93 -6.771 -8.668 -8.337 1.00 0.00 H new ATOM 0 HG21 THR A 93 -4.991 -6.703 -6.256 1.00 0.00 H new ATOM 0 HG22 THR A 93 -3.800 -6.061 -7.412 1.00 0.00 H new ATOM 0 HG23 THR A 93 -5.455 -5.408 -7.386 1.00 0.00 H new ATOM 1441 N THR A 94 -7.196 -6.002 -10.792 1.00 0.00 N ATOM 1442 CA THR A 94 -8.128 -4.923 -11.218 1.00 0.00 C ATOM 1443 C THR A 94 -9.299 -4.871 -10.196 1.00 0.00 C ATOM 1444 O THR A 94 -10.112 -5.798 -10.121 1.00 0.00 O ATOM 1445 CB THR A 94 -8.592 -5.144 -12.689 1.00 0.00 C ATOM 1446 OG1 THR A 94 -7.461 -5.268 -13.549 1.00 0.00 O ATOM 1447 CG2 THR A 94 -9.451 -3.995 -13.245 1.00 0.00 C ATOM 0 H THR A 94 -7.532 -6.942 -11.001 1.00 0.00 H new ATOM 0 HA THR A 94 -7.633 -3.952 -11.217 1.00 0.00 H new ATOM 0 HB THR A 94 -9.195 -6.052 -12.666 1.00 0.00 H new ATOM 0 HG1 THR A 94 -7.764 -5.408 -14.470 1.00 0.00 H new ATOM 0 HG21 THR A 94 -9.737 -4.219 -14.273 1.00 0.00 H new ATOM 0 HG22 THR A 94 -10.348 -3.883 -12.635 1.00 0.00 H new ATOM 0 HG23 THR A 94 -8.878 -3.068 -13.221 1.00 0.00 H new ATOM 1455 N PHE A 95 -9.388 -3.756 -9.446 1.00 0.00 N ATOM 1456 CA PHE A 95 -10.481 -3.503 -8.466 1.00 0.00 C ATOM 1457 C PHE A 95 -11.730 -2.927 -9.205 1.00 0.00 C ATOM 1458 O PHE A 95 -11.961 -1.713 -9.201 1.00 0.00 O ATOM 1459 CB PHE A 95 -9.983 -2.522 -7.360 1.00 0.00 C ATOM 1460 CG PHE A 95 -8.952 -3.049 -6.347 1.00 0.00 C ATOM 1461 CD1 PHE A 95 -7.585 -3.044 -6.650 1.00 0.00 C ATOM 1462 CD2 PHE A 95 -9.368 -3.454 -5.073 1.00 0.00 C ATOM 1463 CE1 PHE A 95 -6.653 -3.443 -5.695 1.00 0.00 C ATOM 1464 CE2 PHE A 95 -8.434 -3.851 -4.120 1.00 0.00 C ATOM 1465 CZ PHE A 95 -7.078 -3.850 -4.433 1.00 0.00 C ATOM 0 H PHE A 95 -8.706 -2.999 -9.497 1.00 0.00 H new ATOM 0 HA PHE A 95 -10.767 -4.440 -7.988 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -9.553 -1.651 -7.854 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -10.853 -2.175 -6.803 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -7.252 -2.730 -7.628 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -10.420 -3.458 -4.828 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -5.600 -3.437 -5.934 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -8.762 -4.160 -3.138 1.00 0.00 H new ATOM 0 HZ PHE A 95 -6.354 -4.165 -3.696 1.00 0.00 H new ATOM 1475 N LYS A 96 -12.518 -3.811 -9.858 1.00 0.00 N ATOM 1476 CA LYS A 96 -13.669 -3.435 -10.731 1.00 0.00 C ATOM 1477 C LYS A 96 -13.195 -2.754 -12.058 1.00 0.00 C ATOM 1478 O LYS A 96 -13.091 -3.436 -13.082 1.00 0.00 O ATOM 1479 CB LYS A 96 -14.842 -2.777 -9.934 1.00 0.00 C ATOM 1480 CG LYS A 96 -16.257 -2.875 -10.547 1.00 0.00 C ATOM 1481 CD LYS A 96 -16.553 -1.880 -11.686 1.00 0.00 C ATOM 1482 CE LYS A 96 -18.012 -1.954 -12.172 1.00 0.00 C ATOM 1483 NZ LYS A 96 -18.279 -0.962 -13.227 1.00 0.00 N ATOM 0 H LYS A 96 -12.376 -4.819 -9.797 1.00 0.00 H new ATOM 0 HA LYS A 96 -14.153 -4.339 -11.100 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -14.872 -3.229 -8.943 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -14.606 -1.722 -9.796 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -16.402 -3.887 -10.925 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -16.990 -2.723 -9.754 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -16.339 -0.868 -11.344 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -15.884 -2.082 -12.523 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -18.220 -2.955 -12.551 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -18.686 -1.784 -11.332 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -19.098 -0.381 -12.958 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -17.446 -0.351 -13.348 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -18.482 -1.452 -14.121 1.00 0.00 H new ATOM 1497 N ASN A 97 -12.880 -1.443 -12.029 1.00 0.00 N ATOM 1498 CA ASN A 97 -12.224 -0.715 -13.156 1.00 0.00 C ATOM 1499 C ASN A 97 -10.705 -0.404 -12.938 1.00 0.00 C ATOM 1500 O ASN A 97 -9.964 -0.361 -13.925 1.00 0.00 O ATOM 1501 CB ASN A 97 -12.982 0.614 -13.450 1.00 0.00 C ATOM 1502 CG ASN A 97 -14.427 0.492 -13.975 1.00 0.00 C ATOM 1503 OD1 ASN A 97 -15.388 0.811 -13.276 1.00 0.00 O ATOM 1504 ND2 ASN A 97 -14.613 0.048 -15.211 1.00 0.00 N ATOM 0 H ASN A 97 -13.071 -0.848 -11.223 1.00 0.00 H new ATOM 0 HA ASN A 97 -12.277 -1.395 -14.006 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -13.003 1.203 -12.533 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -12.403 1.181 -14.179 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -15.558 -0.031 -15.588 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -13.811 -0.215 -15.785 1.00 0.00 H new ATOM 1511 N ILE A 98 -10.248 -0.130 -11.696 1.00 0.00 N ATOM 1512 CA ILE A 98 -8.949 0.550 -11.418 1.00 0.00 C ATOM 1513 C ILE A 98 -7.814 -0.521 -11.418 1.00 0.00 C ATOM 1514 O ILE A 98 -7.824 -1.436 -10.589 1.00 0.00 O ATOM 1515 CB ILE A 98 -8.986 1.370 -10.073 1.00 0.00 C ATOM 1516 CG1 ILE A 98 -10.238 2.277 -9.831 1.00 0.00 C ATOM 1517 CG2 ILE A 98 -7.726 2.269 -9.961 1.00 0.00 C ATOM 1518 CD1 ILE A 98 -11.492 1.588 -9.266 1.00 0.00 C ATOM 0 H ILE A 98 -10.766 -0.372 -10.851 1.00 0.00 H new ATOM 0 HA ILE A 98 -8.753 1.281 -12.203 1.00 0.00 H new ATOM 0 HB ILE A 98 -9.029 0.593 -9.310 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -9.952 3.076 -9.147 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -10.505 2.747 -10.777 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -7.762 2.831 -9.028 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -6.832 1.646 -9.975 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -7.698 2.962 -10.801 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -12.287 2.323 -9.144 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -11.820 0.809 -9.954 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -11.258 1.143 -8.299 1.00 0.00 H new ATOM 1530 N LYS A 99 -6.845 -0.396 -12.345 1.00 0.00 N ATOM 1531 CA LYS A 99 -5.835 -1.463 -12.592 1.00 0.00 C ATOM 1532 C LYS A 99 -4.573 -1.236 -11.705 1.00 0.00 C ATOM 1533 O LYS A 99 -3.744 -0.375 -12.009 1.00 0.00 O ATOM 1534 CB LYS A 99 -5.533 -1.510 -14.116 1.00 0.00 C ATOM 1535 CG LYS A 99 -4.756 -2.766 -14.577 1.00 0.00 C ATOM 1536 CD LYS A 99 -4.417 -2.823 -16.083 1.00 0.00 C ATOM 1537 CE LYS A 99 -3.357 -1.801 -16.544 1.00 0.00 C ATOM 1538 NZ LYS A 99 -2.970 -2.002 -17.952 1.00 0.00 N ATOM 0 H LYS A 99 -6.734 0.427 -12.937 1.00 0.00 H new ATOM 0 HA LYS A 99 -6.218 -2.442 -12.303 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -6.475 -1.460 -14.662 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -4.960 -0.624 -14.388 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -3.826 -2.825 -14.011 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -5.342 -3.649 -14.321 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -4.064 -3.826 -16.325 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -5.331 -2.660 -16.654 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -3.747 -0.791 -16.416 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -2.474 -1.884 -15.910 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -2.256 -1.295 -18.220 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -2.573 -2.956 -18.070 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -3.807 -1.897 -18.560 1.00 0.00 H new ATOM 1552 N SER A 100 -4.434 -2.027 -10.619 1.00 0.00 N ATOM 1553 CA SER A 100 -3.268 -1.955 -9.700 1.00 0.00 C ATOM 1554 C SER A 100 -2.146 -2.885 -10.225 1.00 0.00 C ATOM 1555 O SER A 100 -2.331 -4.101 -10.313 1.00 0.00 O ATOM 1556 CB SER A 100 -3.681 -2.369 -8.269 1.00 0.00 C ATOM 1557 OG SER A 100 -4.551 -1.410 -7.679 1.00 0.00 O ATOM 0 H SER A 100 -5.121 -2.732 -10.352 1.00 0.00 H new ATOM 0 HA SER A 100 -2.902 -0.929 -9.665 1.00 0.00 H new ATOM 0 HB2 SER A 100 -4.175 -3.340 -8.298 1.00 0.00 H new ATOM 0 HB3 SER A 100 -2.791 -2.483 -7.651 1.00 0.00 H new ATOM 0 HG SER A 100 -5.252 -1.872 -7.173 1.00 0.00 H new ATOM 1563 N VAL A 101 -0.996 -2.290 -10.575 1.00 0.00 N ATOM 1564 CA VAL A 101 0.186 -3.029 -11.099 1.00 0.00 C ATOM 1565 C VAL A 101 1.332 -2.719 -10.098 1.00 0.00 C ATOM 1566 O VAL A 101 1.913 -1.629 -10.135 1.00 0.00 O ATOM 1567 CB VAL A 101 0.510 -2.616 -12.579 1.00 0.00 C ATOM 1568 CG1 VAL A 101 1.835 -3.221 -13.103 1.00 0.00 C ATOM 1569 CG2 VAL A 101 -0.615 -2.996 -13.572 1.00 0.00 C ATOM 0 H VAL A 101 -0.849 -1.283 -10.507 1.00 0.00 H new ATOM 0 HA VAL A 101 0.017 -4.104 -11.160 1.00 0.00 H new ATOM 0 HB VAL A 101 0.603 -1.531 -12.534 1.00 0.00 H new ATOM 0 HG11 VAL A 101 2.001 -2.898 -14.131 1.00 0.00 H new ATOM 0 HG12 VAL A 101 2.662 -2.883 -12.478 1.00 0.00 H new ATOM 0 HG13 VAL A 101 1.776 -4.309 -13.070 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -0.333 -2.685 -14.578 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -0.766 -4.075 -13.555 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -1.539 -2.496 -13.283 1.00 0.00 H new ATOM 1579 N THR A 102 1.652 -3.683 -9.219 1.00 0.00 N ATOM 1580 CA THR A 102 2.619 -3.465 -8.111 1.00 0.00 C ATOM 1581 C THR A 102 3.993 -4.072 -8.521 1.00 0.00 C ATOM 1582 O THR A 102 4.257 -5.253 -8.279 1.00 0.00 O ATOM 1583 CB THR A 102 2.024 -4.036 -6.788 1.00 0.00 C ATOM 1584 OG1 THR A 102 0.717 -3.516 -6.551 1.00 0.00 O ATOM 1585 CG2 THR A 102 2.872 -3.719 -5.545 1.00 0.00 C ATOM 0 H THR A 102 1.259 -4.624 -9.248 1.00 0.00 H new ATOM 0 HA THR A 102 2.795 -2.406 -7.923 1.00 0.00 H new ATOM 0 HB THR A 102 2.005 -5.116 -6.933 1.00 0.00 H new ATOM 0 HG1 THR A 102 0.363 -3.889 -5.717 1.00 0.00 H new ATOM 0 HG21 THR A 102 2.397 -4.147 -4.662 1.00 0.00 H new ATOM 0 HG22 THR A 102 3.868 -4.146 -5.665 1.00 0.00 H new ATOM 0 HG23 THR A 102 2.953 -2.639 -5.426 1.00 0.00 H new ATOM 1593 N GLU A 103 4.855 -3.240 -9.132 1.00 0.00 N ATOM 1594 CA GLU A 103 6.212 -3.633 -9.597 1.00 0.00 C ATOM 1595 C GLU A 103 7.254 -3.534 -8.452 1.00 0.00 C ATOM 1596 O GLU A 103 7.169 -2.629 -7.622 1.00 0.00 O ATOM 1597 CB GLU A 103 6.627 -2.659 -10.733 1.00 0.00 C ATOM 1598 CG GLU A 103 6.016 -2.978 -12.112 1.00 0.00 C ATOM 1599 CD GLU A 103 6.296 -1.890 -13.147 1.00 0.00 C ATOM 1600 OE1 GLU A 103 5.501 -0.930 -13.246 1.00 0.00 O ATOM 1601 OE2 GLU A 103 7.316 -1.986 -13.865 1.00 0.00 O ATOM 0 H GLU A 103 4.633 -2.263 -9.323 1.00 0.00 H new ATOM 0 HA GLU A 103 6.183 -4.666 -9.942 1.00 0.00 H new ATOM 0 HB2 GLU A 103 6.339 -1.647 -10.449 1.00 0.00 H new ATOM 0 HB3 GLU A 103 7.713 -2.668 -10.822 1.00 0.00 H new ATOM 0 HG2 GLU A 103 6.415 -3.927 -12.471 1.00 0.00 H new ATOM 0 HG3 GLU A 103 4.939 -3.105 -12.007 1.00 0.00 H new ATOM 1608 N LEU A 104 8.261 -4.426 -8.447 1.00 0.00 N ATOM 1609 CA LEU A 104 9.375 -4.384 -7.459 1.00 0.00 C ATOM 1610 C LEU A 104 10.708 -4.500 -8.252 1.00 0.00 C ATOM 1611 O LEU A 104 11.052 -5.572 -8.761 1.00 0.00 O ATOM 1612 CB LEU A 104 9.194 -5.508 -6.396 1.00 0.00 C ATOM 1613 CG LEU A 104 9.784 -5.232 -4.985 1.00 0.00 C ATOM 1614 CD1 LEU A 104 9.538 -6.443 -4.076 1.00 0.00 C ATOM 1615 CD2 LEU A 104 11.280 -4.871 -4.938 1.00 0.00 C ATOM 0 H LEU A 104 8.334 -5.192 -9.117 1.00 0.00 H new ATOM 0 HA LEU A 104 9.383 -3.447 -6.902 1.00 0.00 H new ATOM 0 HB2 LEU A 104 8.128 -5.705 -6.287 1.00 0.00 H new ATOM 0 HB3 LEU A 104 9.649 -6.420 -6.783 1.00 0.00 H new ATOM 0 HG LEU A 104 9.259 -4.342 -4.639 1.00 0.00 H new ATOM 0 HD11 LEU A 104 9.953 -6.246 -3.087 1.00 0.00 H new ATOM 0 HD12 LEU A 104 8.466 -6.622 -3.991 1.00 0.00 H new ATOM 0 HD13 LEU A 104 10.020 -7.322 -4.503 1.00 0.00 H new ATOM 0 HD21 LEU A 104 11.581 -4.700 -3.904 1.00 0.00 H new ATOM 0 HD22 LEU A 104 11.865 -5.690 -5.356 1.00 0.00 H new ATOM 0 HD23 LEU A 104 11.455 -3.967 -5.521 1.00 0.00 H new ATOM 1627 N ASN A 105 11.455 -3.387 -8.362 1.00 0.00 N ATOM 1628 CA ASN A 105 12.648 -3.301 -9.253 1.00 0.00 C ATOM 1629 C ASN A 105 13.912 -3.828 -8.513 1.00 0.00 C ATOM 1630 O ASN A 105 14.184 -5.031 -8.582 1.00 0.00 O ATOM 1631 CB ASN A 105 12.746 -1.885 -9.898 1.00 0.00 C ATOM 1632 CG ASN A 105 11.727 -1.552 -11.012 1.00 0.00 C ATOM 1633 OD1 ASN A 105 12.087 -1.432 -12.184 1.00 0.00 O ATOM 1634 ND2 ASN A 105 10.452 -1.383 -10.693 1.00 0.00 N ATOM 0 H ASN A 105 11.261 -2.528 -7.848 1.00 0.00 H new ATOM 0 HA ASN A 105 12.550 -3.967 -10.110 1.00 0.00 H new ATOM 0 HB2 ASN A 105 12.638 -1.143 -9.107 1.00 0.00 H new ATOM 0 HB3 ASN A 105 13.749 -1.768 -10.309 1.00 0.00 H new ATOM 0 HD21 ASN A 105 9.771 -1.154 -11.417 1.00 0.00 H new ATOM 0 HD22 ASN A 105 10.151 -1.482 -9.723 1.00 0.00 H new ATOM 1641 N GLY A 106 14.656 -2.960 -7.806 1.00 0.00 N ATOM 1642 CA GLY A 106 15.855 -3.363 -7.032 1.00 0.00 C ATOM 1643 C GLY A 106 15.507 -3.573 -5.549 1.00 0.00 C ATOM 1644 O GLY A 106 14.814 -4.537 -5.212 1.00 0.00 O ATOM 0 H GLY A 106 14.449 -1.963 -7.751 1.00 0.00 H new ATOM 0 HA2 GLY A 106 16.268 -4.283 -7.446 1.00 0.00 H new ATOM 0 HA3 GLY A 106 16.626 -2.598 -7.124 1.00 0.00 H new ATOM 1648 N ASP A 107 15.959 -2.645 -4.686 1.00 0.00 N ATOM 1649 CA ASP A 107 15.430 -2.525 -3.294 1.00 0.00 C ATOM 1650 C ASP A 107 14.522 -1.260 -3.186 1.00 0.00 C ATOM 1651 O ASP A 107 14.800 -0.323 -2.432 1.00 0.00 O ATOM 1652 CB ASP A 107 16.593 -2.554 -2.263 1.00 0.00 C ATOM 1653 CG ASP A 107 17.327 -3.899 -2.148 1.00 0.00 C ATOM 1654 OD1 ASP A 107 16.702 -4.894 -1.719 1.00 0.00 O ATOM 1655 OD2 ASP A 107 18.530 -3.964 -2.487 1.00 0.00 O ATOM 0 H ASP A 107 16.685 -1.966 -4.916 1.00 0.00 H new ATOM 0 HA ASP A 107 14.802 -3.383 -3.054 1.00 0.00 H new ATOM 0 HB2 ASP A 107 17.316 -1.785 -2.533 1.00 0.00 H new ATOM 0 HB3 ASP A 107 16.196 -2.289 -1.283 1.00 0.00 H new ATOM 1660 N ILE A 108 13.413 -1.270 -3.953 1.00 0.00 N ATOM 1661 CA ILE A 108 12.371 -0.207 -3.950 1.00 0.00 C ATOM 1662 C ILE A 108 10.962 -0.897 -4.058 1.00 0.00 C ATOM 1663 O ILE A 108 10.813 -2.097 -3.807 1.00 0.00 O ATOM 1664 CB ILE A 108 12.653 0.903 -5.031 1.00 0.00 C ATOM 1665 CG1 ILE A 108 12.631 0.386 -6.497 1.00 0.00 C ATOM 1666 CG2 ILE A 108 13.902 1.771 -4.759 1.00 0.00 C ATOM 1667 CD1 ILE A 108 12.161 1.435 -7.512 1.00 0.00 C ATOM 0 H ILE A 108 13.207 -2.027 -4.605 1.00 0.00 H new ATOM 0 HA ILE A 108 12.392 0.348 -3.012 1.00 0.00 H new ATOM 0 HB ILE A 108 11.795 1.566 -4.919 1.00 0.00 H new ATOM 0 HG12 ILE A 108 13.632 0.051 -6.770 1.00 0.00 H new ATOM 0 HG13 ILE A 108 11.977 -0.484 -6.557 1.00 0.00 H new ATOM 0 HG21 ILE A 108 14.015 2.506 -5.556 1.00 0.00 H new ATOM 0 HG22 ILE A 108 13.787 2.285 -3.805 1.00 0.00 H new ATOM 0 HG23 ILE A 108 14.787 1.135 -4.725 1.00 0.00 H new ATOM 0 HD11 ILE A 108 12.171 1.003 -8.513 1.00 0.00 H new ATOM 0 HD12 ILE A 108 11.148 1.753 -7.264 1.00 0.00 H new ATOM 0 HD13 ILE A 108 12.829 2.296 -7.481 1.00 0.00 H new ATOM 1679 N ILE A 109 9.917 -0.136 -4.447 1.00 0.00 N ATOM 1680 CA ILE A 109 8.652 -0.691 -4.991 1.00 0.00 C ATOM 1681 C ILE A 109 7.936 0.448 -5.782 1.00 0.00 C ATOM 1682 O ILE A 109 7.768 1.560 -5.267 1.00 0.00 O ATOM 1683 CB ILE A 109 7.773 -1.398 -3.895 1.00 0.00 C ATOM 1684 CG1 ILE A 109 6.764 -2.406 -4.497 1.00 0.00 C ATOM 1685 CG2 ILE A 109 7.083 -0.425 -2.904 1.00 0.00 C ATOM 1686 CD1 ILE A 109 6.194 -3.415 -3.496 1.00 0.00 C ATOM 0 H ILE A 109 9.923 0.883 -4.394 1.00 0.00 H new ATOM 0 HA ILE A 109 8.858 -1.506 -5.684 1.00 0.00 H new ATOM 0 HB ILE A 109 8.489 -1.965 -3.300 1.00 0.00 H new ATOM 0 HG12 ILE A 109 5.939 -1.851 -4.943 1.00 0.00 H new ATOM 0 HG13 ILE A 109 7.254 -2.952 -5.304 1.00 0.00 H new ATOM 0 HG21 ILE A 109 6.498 -0.995 -2.183 1.00 0.00 H new ATOM 0 HG22 ILE A 109 7.840 0.156 -2.378 1.00 0.00 H new ATOM 0 HG23 ILE A 109 6.425 0.248 -3.454 1.00 0.00 H new ATOM 0 HD11 ILE A 109 5.497 -4.080 -4.006 1.00 0.00 H new ATOM 0 HD12 ILE A 109 7.007 -4.001 -3.067 1.00 0.00 H new ATOM 0 HD13 ILE A 109 5.672 -2.883 -2.701 1.00 0.00 H new ATOM 1698 N THR A 110 7.506 0.157 -7.025 1.00 0.00 N ATOM 1699 CA THR A 110 6.822 1.144 -7.901 1.00 0.00 C ATOM 1700 C THR A 110 5.341 0.677 -8.060 1.00 0.00 C ATOM 1701 O THR A 110 4.996 -0.064 -8.985 1.00 0.00 O ATOM 1702 CB THR A 110 7.605 1.267 -9.242 1.00 0.00 C ATOM 1703 OG1 THR A 110 8.984 1.543 -9.002 1.00 0.00 O ATOM 1704 CG2 THR A 110 7.094 2.380 -10.167 1.00 0.00 C ATOM 0 H THR A 110 7.619 -0.762 -7.454 1.00 0.00 H new ATOM 0 HA THR A 110 6.806 2.148 -7.477 1.00 0.00 H new ATOM 0 HB THR A 110 7.455 0.304 -9.731 1.00 0.00 H new ATOM 0 HG1 THR A 110 9.457 1.614 -9.857 1.00 0.00 H new ATOM 0 HG21 THR A 110 7.692 2.399 -11.078 1.00 0.00 H new ATOM 0 HG22 THR A 110 6.051 2.191 -10.421 1.00 0.00 H new ATOM 0 HG23 THR A 110 7.176 3.341 -9.659 1.00 0.00 H new ATOM 1712 N ASN A 111 4.472 1.131 -7.138 1.00 0.00 N ATOM 1713 CA ASN A 111 3.020 0.790 -7.130 1.00 0.00 C ATOM 1714 C ASN A 111 2.265 1.752 -8.086 1.00 0.00 C ATOM 1715 O ASN A 111 2.019 2.914 -7.752 1.00 0.00 O ATOM 1716 CB ASN A 111 2.509 0.832 -5.664 1.00 0.00 C ATOM 1717 CG ASN A 111 0.997 0.619 -5.441 1.00 0.00 C ATOM 1718 OD1 ASN A 111 0.228 1.580 -5.374 1.00 0.00 O ATOM 1719 ND2 ASN A 111 0.540 -0.616 -5.317 1.00 0.00 N ATOM 0 H ASN A 111 4.748 1.746 -6.373 1.00 0.00 H new ATOM 0 HA ASN A 111 2.838 -0.218 -7.502 1.00 0.00 H new ATOM 0 HB2 ASN A 111 3.045 0.071 -5.097 1.00 0.00 H new ATOM 0 HB3 ASN A 111 2.781 1.798 -5.238 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -0.455 -0.779 -5.165 1.00 0.00 H new ATOM 0 HD22 ASN A 111 1.183 -1.406 -5.374 1.00 0.00 H new ATOM 1726 N THR A 112 1.916 1.232 -9.273 1.00 0.00 N ATOM 1727 CA THR A 112 1.393 2.047 -10.400 1.00 0.00 C ATOM 1728 C THR A 112 -0.114 1.700 -10.574 1.00 0.00 C ATOM 1729 O THR A 112 -0.468 0.719 -11.237 1.00 0.00 O ATOM 1730 CB THR A 112 2.251 1.767 -11.671 1.00 0.00 C ATOM 1731 OG1 THR A 112 3.643 1.921 -11.400 1.00 0.00 O ATOM 1732 CG2 THR A 112 1.931 2.700 -12.847 1.00 0.00 C ATOM 0 H THR A 112 1.985 0.237 -9.487 1.00 0.00 H new ATOM 0 HA THR A 112 1.467 3.118 -10.210 1.00 0.00 H new ATOM 0 HB THR A 112 2.003 0.742 -11.945 1.00 0.00 H new ATOM 0 HG1 THR A 112 4.157 1.738 -12.214 1.00 0.00 H new ATOM 0 HG21 THR A 112 2.566 2.447 -13.696 1.00 0.00 H new ATOM 0 HG22 THR A 112 0.885 2.584 -13.129 1.00 0.00 H new ATOM 0 HG23 THR A 112 2.115 3.733 -12.552 1.00 0.00 H new ATOM 1740 N MET A 113 -0.987 2.526 -9.972 1.00 0.00 N ATOM 1741 CA MET A 113 -2.462 2.345 -10.043 1.00 0.00 C ATOM 1742 C MET A 113 -3.011 3.260 -11.171 1.00 0.00 C ATOM 1743 O MET A 113 -3.097 4.483 -11.014 1.00 0.00 O ATOM 1744 CB MET A 113 -3.157 2.656 -8.693 1.00 0.00 C ATOM 1745 CG MET A 113 -2.791 1.761 -7.499 1.00 0.00 C ATOM 1746 SD MET A 113 -3.808 2.253 -6.091 1.00 0.00 S ATOM 1747 CE MET A 113 -3.353 1.013 -4.867 1.00 0.00 C ATOM 0 H MET A 113 -0.700 3.336 -9.423 1.00 0.00 H new ATOM 0 HA MET A 113 -2.679 1.300 -10.263 1.00 0.00 H new ATOM 0 HB2 MET A 113 -2.931 3.688 -8.425 1.00 0.00 H new ATOM 0 HB3 MET A 113 -4.235 2.595 -8.845 1.00 0.00 H new ATOM 0 HG2 MET A 113 -2.962 0.713 -7.743 1.00 0.00 H new ATOM 0 HG3 MET A 113 -1.733 1.863 -7.258 1.00 0.00 H new ATOM 0 HE1 MET A 113 -3.905 1.193 -3.944 1.00 0.00 H new ATOM 0 HE2 MET A 113 -3.595 0.021 -5.247 1.00 0.00 H new ATOM 0 HE3 MET A 113 -2.283 1.074 -4.668 1.00 0.00 H new ATOM 1757 N THR A 114 -3.363 2.648 -12.315 1.00 0.00 N ATOM 1758 CA THR A 114 -3.799 3.385 -13.530 1.00 0.00 C ATOM 1759 C THR A 114 -5.348 3.528 -13.516 1.00 0.00 C ATOM 1760 O THR A 114 -6.080 2.548 -13.693 1.00 0.00 O ATOM 1761 CB THR A 114 -3.270 2.721 -14.837 1.00 0.00 C ATOM 1762 OG1 THR A 114 -3.640 1.350 -14.917 1.00 0.00 O ATOM 1763 CG2 THR A 114 -1.748 2.813 -15.028 1.00 0.00 C ATOM 0 H THR A 114 -3.356 1.635 -12.431 1.00 0.00 H new ATOM 0 HA THR A 114 -3.362 4.384 -13.515 1.00 0.00 H new ATOM 0 HB THR A 114 -3.742 3.298 -15.632 1.00 0.00 H new ATOM 0 HG1 THR A 114 -2.850 0.810 -15.126 1.00 0.00 H new ATOM 0 HG21 THR A 114 -1.468 2.326 -15.962 1.00 0.00 H new ATOM 0 HG22 THR A 114 -1.448 3.860 -15.061 1.00 0.00 H new ATOM 0 HG23 THR A 114 -1.246 2.318 -14.196 1.00 0.00 H new ATOM 1771 N LEU A 115 -5.817 4.771 -13.308 1.00 0.00 N ATOM 1772 CA LEU A 115 -7.260 5.130 -13.348 1.00 0.00 C ATOM 1773 C LEU A 115 -7.527 5.868 -14.695 1.00 0.00 C ATOM 1774 O LEU A 115 -7.613 7.101 -14.742 1.00 0.00 O ATOM 1775 CB LEU A 115 -7.528 5.986 -12.072 1.00 0.00 C ATOM 1776 CG LEU A 115 -8.951 6.572 -11.855 1.00 0.00 C ATOM 1777 CD1 LEU A 115 -9.986 5.488 -11.512 1.00 0.00 C ATOM 1778 CD2 LEU A 115 -8.932 7.645 -10.748 1.00 0.00 C ATOM 0 H LEU A 115 -5.209 5.564 -13.106 1.00 0.00 H new ATOM 0 HA LEU A 115 -7.942 4.280 -13.327 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -7.287 5.372 -11.205 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -6.824 6.819 -12.078 1.00 0.00 H new ATOM 0 HG LEU A 115 -9.251 7.027 -12.799 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -10.963 5.950 -11.370 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -10.041 4.766 -12.327 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -9.689 4.979 -10.595 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -9.937 8.044 -10.610 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -8.588 7.199 -9.815 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -8.258 8.452 -11.035 1.00 0.00 H new ATOM 1790 N GLY A 116 -7.610 5.099 -15.800 1.00 0.00 N ATOM 1791 CA GLY A 116 -7.675 5.659 -17.171 1.00 0.00 C ATOM 1792 C GLY A 116 -6.339 6.280 -17.640 1.00 0.00 C ATOM 1793 O GLY A 116 -5.379 5.558 -17.927 1.00 0.00 O ATOM 0 H GLY A 116 -7.634 4.080 -15.771 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -7.965 4.870 -17.865 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -8.455 6.420 -17.209 1.00 0.00 H new ATOM 1797 N ASP A 117 -6.300 7.622 -17.670 1.00 0.00 N ATOM 1798 CA ASP A 117 -5.039 8.406 -17.865 1.00 0.00 C ATOM 1799 C ASP A 117 -4.325 8.879 -16.548 1.00 0.00 C ATOM 1800 O ASP A 117 -3.208 9.399 -16.637 1.00 0.00 O ATOM 1801 CB ASP A 117 -5.337 9.639 -18.766 1.00 0.00 C ATOM 1802 CG ASP A 117 -5.675 9.322 -20.231 1.00 0.00 C ATOM 1803 OD1 ASP A 117 -4.740 9.158 -21.046 1.00 0.00 O ATOM 1804 OD2 ASP A 117 -6.876 9.236 -20.571 1.00 0.00 O ATOM 0 H ASP A 117 -7.130 8.205 -17.562 1.00 0.00 H new ATOM 0 HA ASP A 117 -4.339 7.716 -18.336 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -6.169 10.192 -18.331 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -4.470 10.300 -18.746 1.00 0.00 H new ATOM 1809 N ILE A 118 -4.930 8.716 -15.351 1.00 0.00 N ATOM 1810 CA ILE A 118 -4.399 9.239 -14.061 1.00 0.00 C ATOM 1811 C ILE A 118 -3.474 8.129 -13.479 1.00 0.00 C ATOM 1812 O ILE A 118 -3.958 7.144 -12.911 1.00 0.00 O ATOM 1813 CB ILE A 118 -5.598 9.633 -13.121 1.00 0.00 C ATOM 1814 CG1 ILE A 118 -6.490 10.781 -13.695 1.00 0.00 C ATOM 1815 CG2 ILE A 118 -5.130 10.010 -11.692 1.00 0.00 C ATOM 1816 CD1 ILE A 118 -7.868 10.952 -13.034 1.00 0.00 C ATOM 0 H ILE A 118 -5.811 8.213 -15.246 1.00 0.00 H new ATOM 0 HA ILE A 118 -3.812 10.150 -14.179 1.00 0.00 H new ATOM 0 HB ILE A 118 -6.209 8.732 -13.068 1.00 0.00 H new ATOM 0 HG12 ILE A 118 -5.945 11.720 -13.602 1.00 0.00 H new ATOM 0 HG13 ILE A 118 -6.638 10.602 -14.760 1.00 0.00 H new ATOM 0 HG21 ILE A 118 -5.995 10.274 -11.084 1.00 0.00 H new ATOM 0 HG22 ILE A 118 -4.615 9.161 -11.242 1.00 0.00 H new ATOM 0 HG23 ILE A 118 -4.450 10.861 -11.744 1.00 0.00 H new ATOM 0 HD11 ILE A 118 -8.400 11.775 -13.510 1.00 0.00 H new ATOM 0 HD12 ILE A 118 -8.443 10.033 -13.149 1.00 0.00 H new ATOM 0 HD13 ILE A 118 -7.739 11.169 -11.974 1.00 0.00 H new ATOM 1828 N VAL A 119 -2.150 8.303 -13.632 1.00 0.00 N ATOM 1829 CA VAL A 119 -1.156 7.252 -13.273 1.00 0.00 C ATOM 1830 C VAL A 119 -0.611 7.610 -11.858 1.00 0.00 C ATOM 1831 O VAL A 119 0.300 8.434 -11.722 1.00 0.00 O ATOM 1832 CB VAL A 119 -0.045 7.096 -14.370 1.00 0.00 C ATOM 1833 CG1 VAL A 119 0.905 5.919 -14.051 1.00 0.00 C ATOM 1834 CG2 VAL A 119 -0.581 6.882 -15.809 1.00 0.00 C ATOM 0 H VAL A 119 -1.734 9.158 -14.001 1.00 0.00 H new ATOM 0 HA VAL A 119 -1.618 6.265 -13.235 1.00 0.00 H new ATOM 0 HB VAL A 119 0.479 8.051 -14.343 1.00 0.00 H new ATOM 0 HG11 VAL A 119 1.662 5.840 -14.832 1.00 0.00 H new ATOM 0 HG12 VAL A 119 1.391 6.093 -13.091 1.00 0.00 H new ATOM 0 HG13 VAL A 119 0.333 4.992 -14.005 1.00 0.00 H new ATOM 0 HG21 VAL A 119 0.257 6.785 -16.499 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -1.185 5.975 -15.841 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -1.193 7.736 -16.100 1.00 0.00 H new ATOM 1844 N PHE A 120 -1.181 6.967 -10.819 1.00 0.00 N ATOM 1845 CA PHE A 120 -0.775 7.173 -9.405 1.00 0.00 C ATOM 1846 C PHE A 120 0.425 6.248 -9.075 1.00 0.00 C ATOM 1847 O PHE A 120 0.246 5.062 -8.787 1.00 0.00 O ATOM 1848 CB PHE A 120 -2.011 6.965 -8.488 1.00 0.00 C ATOM 1849 CG PHE A 120 -1.768 6.995 -6.965 1.00 0.00 C ATOM 1850 CD1 PHE A 120 -1.363 8.171 -6.327 1.00 0.00 C ATOM 1851 CD2 PHE A 120 -1.906 5.824 -6.211 1.00 0.00 C ATOM 1852 CE1 PHE A 120 -1.077 8.173 -4.966 1.00 0.00 C ATOM 1853 CE2 PHE A 120 -1.634 5.830 -4.846 1.00 0.00 C ATOM 1854 CZ PHE A 120 -1.216 7.003 -4.225 1.00 0.00 C ATOM 0 H PHE A 120 -1.936 6.290 -10.931 1.00 0.00 H new ATOM 0 HA PHE A 120 -0.429 8.192 -9.231 1.00 0.00 H new ATOM 0 HB2 PHE A 120 -2.744 7.734 -8.729 1.00 0.00 H new ATOM 0 HB3 PHE A 120 -2.462 6.005 -8.740 1.00 0.00 H new ATOM 0 HD1 PHE A 120 -1.272 9.085 -6.895 1.00 0.00 H new ATOM 0 HD2 PHE A 120 -2.225 4.911 -6.691 1.00 0.00 H new ATOM 0 HE1 PHE A 120 -0.747 9.082 -4.484 1.00 0.00 H new ATOM 0 HE2 PHE A 120 -1.747 4.924 -4.269 1.00 0.00 H new ATOM 0 HZ PHE A 120 -0.999 7.006 -3.167 1.00 0.00 H new ATOM 1864 N LYS A 121 1.635 6.826 -9.127 1.00 0.00 N ATOM 1865 CA LYS A 121 2.897 6.061 -8.970 1.00 0.00 C ATOM 1866 C LYS A 121 3.547 6.414 -7.606 1.00 0.00 C ATOM 1867 O LYS A 121 4.151 7.480 -7.444 1.00 0.00 O ATOM 1868 CB LYS A 121 3.805 6.321 -10.198 1.00 0.00 C ATOM 1869 CG LYS A 121 5.026 5.380 -10.286 1.00 0.00 C ATOM 1870 CD LYS A 121 5.948 5.652 -11.492 1.00 0.00 C ATOM 1871 CE LYS A 121 5.364 5.210 -12.848 1.00 0.00 C ATOM 1872 NZ LYS A 121 6.303 5.473 -13.953 1.00 0.00 N ATOM 0 H LYS A 121 1.774 7.825 -9.277 1.00 0.00 H new ATOM 0 HA LYS A 121 2.715 4.987 -8.947 1.00 0.00 H new ATOM 0 HB2 LYS A 121 3.211 6.214 -11.106 1.00 0.00 H new ATOM 0 HB3 LYS A 121 4.156 7.353 -10.166 1.00 0.00 H new ATOM 0 HG2 LYS A 121 5.609 5.472 -9.369 1.00 0.00 H new ATOM 0 HG3 LYS A 121 4.674 4.350 -10.337 1.00 0.00 H new ATOM 0 HD2 LYS A 121 6.167 6.719 -11.534 1.00 0.00 H new ATOM 0 HD3 LYS A 121 6.896 5.138 -11.333 1.00 0.00 H new ATOM 0 HE2 LYS A 121 5.129 4.146 -12.815 1.00 0.00 H new ATOM 0 HE3 LYS A 121 4.428 5.738 -13.031 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 5.878 5.164 -14.851 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 6.508 6.492 -14.000 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 7.187 4.950 -13.790 1.00 0.00 H new ATOM 1886 N ARG A 122 3.442 5.477 -6.645 1.00 0.00 N ATOM 1887 CA ARG A 122 4.147 5.573 -5.337 1.00 0.00 C ATOM 1888 C ARG A 122 5.559 4.957 -5.508 1.00 0.00 C ATOM 1889 O ARG A 122 5.693 3.779 -5.859 1.00 0.00 O ATOM 1890 CB ARG A 122 3.416 4.811 -4.200 1.00 0.00 C ATOM 1891 CG ARG A 122 1.977 5.259 -3.863 1.00 0.00 C ATOM 1892 CD ARG A 122 1.299 4.402 -2.773 1.00 0.00 C ATOM 1893 NE ARG A 122 1.866 4.637 -1.417 1.00 0.00 N ATOM 1894 CZ ARG A 122 1.208 5.204 -0.389 1.00 0.00 C ATOM 1895 NH1 ARG A 122 -0.063 5.594 -0.442 1.00 0.00 N ATOM 1896 NH2 ARG A 122 1.865 5.386 0.741 1.00 0.00 N ATOM 0 H ARG A 122 2.873 4.636 -6.744 1.00 0.00 H new ATOM 0 HA ARG A 122 4.184 6.625 -5.054 1.00 0.00 H new ATOM 0 HB2 ARG A 122 3.388 3.754 -4.465 1.00 0.00 H new ATOM 0 HB3 ARG A 122 4.017 4.896 -3.295 1.00 0.00 H new ATOM 0 HG2 ARG A 122 1.997 6.298 -3.535 1.00 0.00 H new ATOM 0 HG3 ARG A 122 1.373 5.222 -4.770 1.00 0.00 H new ATOM 0 HD2 ARG A 122 0.231 4.620 -2.758 1.00 0.00 H new ATOM 0 HD3 ARG A 122 1.405 3.348 -3.028 1.00 0.00 H new ATOM 0 HE ARG A 122 2.830 4.345 -1.254 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -0.599 5.469 -1.301 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -0.501 6.018 0.376 1.00 0.00 H new ATOM 0 HH21 ARG A 122 2.841 5.100 0.815 1.00 0.00 H new ATOM 0 HH22 ARG A 122 1.397 5.813 1.540 1.00 0.00 H new ATOM 1910 N ILE A 123 6.600 5.761 -5.249 1.00 0.00 N ATOM 1911 CA ILE A 123 8.017 5.315 -5.374 1.00 0.00 C ATOM 1912 C ILE A 123 8.503 5.238 -3.902 1.00 0.00 C ATOM 1913 O ILE A 123 8.778 6.273 -3.291 1.00 0.00 O ATOM 1914 CB ILE A 123 8.841 6.272 -6.308 1.00 0.00 C ATOM 1915 CG1 ILE A 123 8.264 6.351 -7.758 1.00 0.00 C ATOM 1916 CG2 ILE A 123 10.337 5.861 -6.361 1.00 0.00 C ATOM 1917 CD1 ILE A 123 8.779 7.510 -8.626 1.00 0.00 C ATOM 0 H ILE A 123 6.498 6.731 -4.949 1.00 0.00 H new ATOM 0 HA ILE A 123 8.144 4.350 -5.866 1.00 0.00 H new ATOM 0 HB ILE A 123 8.757 7.264 -5.865 1.00 0.00 H new ATOM 0 HG12 ILE A 123 8.488 5.414 -8.268 1.00 0.00 H new ATOM 0 HG13 ILE A 123 7.179 6.427 -7.692 1.00 0.00 H new ATOM 0 HG21 ILE A 123 10.879 6.543 -7.016 1.00 0.00 H new ATOM 0 HG22 ILE A 123 10.762 5.906 -5.358 1.00 0.00 H new ATOM 0 HG23 ILE A 123 10.422 4.845 -6.746 1.00 0.00 H new ATOM 0 HD11 ILE A 123 8.311 7.464 -9.609 1.00 0.00 H new ATOM 0 HD12 ILE A 123 8.531 8.459 -8.150 1.00 0.00 H new ATOM 0 HD13 ILE A 123 9.861 7.430 -8.735 1.00 0.00 H new ATOM 1929 N SER A 124 8.548 4.016 -3.337 1.00 0.00 N ATOM 1930 CA SER A 124 8.758 3.815 -1.878 1.00 0.00 C ATOM 1931 C SER A 124 9.957 2.855 -1.653 1.00 0.00 C ATOM 1932 O SER A 124 9.922 1.690 -2.059 1.00 0.00 O ATOM 1933 CB SER A 124 7.464 3.281 -1.219 1.00 0.00 C ATOM 1934 OG SER A 124 6.367 4.169 -1.399 1.00 0.00 O ATOM 0 H SER A 124 8.442 3.149 -3.864 1.00 0.00 H new ATOM 0 HA SER A 124 8.994 4.769 -1.406 1.00 0.00 H new ATOM 0 HB2 SER A 124 7.216 2.308 -1.644 1.00 0.00 H new ATOM 0 HB3 SER A 124 7.636 3.129 -0.153 1.00 0.00 H new ATOM 0 HG SER A 124 5.569 3.795 -0.970 1.00 0.00 H new ATOM 1940 N LYS A 125 11.026 3.359 -1.014 1.00 0.00 N ATOM 1941 CA LYS A 125 12.338 2.672 -0.942 1.00 0.00 C ATOM 1942 C LYS A 125 12.430 1.719 0.279 1.00 0.00 C ATOM 1943 O LYS A 125 12.113 2.101 1.410 1.00 0.00 O ATOM 1944 CB LYS A 125 13.434 3.767 -0.947 1.00 0.00 C ATOM 1945 CG LYS A 125 14.876 3.239 -1.070 1.00 0.00 C ATOM 1946 CD LYS A 125 15.888 4.331 -1.473 1.00 0.00 C ATOM 1947 CE LYS A 125 17.267 3.788 -1.884 1.00 0.00 C ATOM 1948 NZ LYS A 125 18.058 3.280 -0.746 1.00 0.00 N ATOM 0 H LYS A 125 11.010 4.257 -0.530 1.00 0.00 H new ATOM 0 HA LYS A 125 12.477 2.020 -1.804 1.00 0.00 H new ATOM 0 HB2 LYS A 125 13.241 4.450 -1.774 1.00 0.00 H new ATOM 0 HB3 LYS A 125 13.352 4.347 -0.028 1.00 0.00 H new ATOM 0 HG2 LYS A 125 15.180 2.804 -0.118 1.00 0.00 H new ATOM 0 HG3 LYS A 125 14.901 2.438 -1.809 1.00 0.00 H new ATOM 0 HD2 LYS A 125 15.475 4.907 -2.301 1.00 0.00 H new ATOM 0 HD3 LYS A 125 16.015 5.020 -0.638 1.00 0.00 H new ATOM 0 HE2 LYS A 125 17.132 2.986 -2.610 1.00 0.00 H new ATOM 0 HE3 LYS A 125 17.827 4.579 -2.382 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 18.975 2.929 -1.090 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 18.215 4.048 -0.062 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 17.542 2.505 -0.283 1.00 0.00 H new ATOM 1962 N ARG A 126 12.912 0.485 0.032 1.00 0.00 N ATOM 1963 CA ARG A 126 12.988 -0.580 1.060 1.00 0.00 C ATOM 1964 C ARG A 126 14.040 -0.271 2.164 1.00 0.00 C ATOM 1965 O ARG A 126 15.165 0.163 1.892 1.00 0.00 O ATOM 1966 CB ARG A 126 13.253 -1.935 0.353 1.00 0.00 C ATOM 1967 CG ARG A 126 12.849 -3.192 1.163 1.00 0.00 C ATOM 1968 CD ARG A 126 13.866 -3.783 2.161 1.00 0.00 C ATOM 1969 NE ARG A 126 15.127 -4.237 1.519 1.00 0.00 N ATOM 1970 CZ ARG A 126 16.278 -4.467 2.182 1.00 0.00 C ATOM 1971 NH1 ARG A 126 16.421 -4.323 3.499 1.00 0.00 N ATOM 1972 NH2 ARG A 126 17.327 -4.862 1.488 1.00 0.00 N ATOM 0 H ARG A 126 13.260 0.196 -0.882 1.00 0.00 H new ATOM 0 HA ARG A 126 12.035 -0.632 1.587 1.00 0.00 H new ATOM 0 HB2 ARG A 126 12.714 -1.944 -0.594 1.00 0.00 H new ATOM 0 HB3 ARG A 126 14.315 -2.001 0.116 1.00 0.00 H new ATOM 0 HG2 ARG A 126 11.942 -2.952 1.717 1.00 0.00 H new ATOM 0 HG3 ARG A 126 12.589 -3.976 0.451 1.00 0.00 H new ATOM 0 HD2 ARG A 126 14.101 -3.033 2.916 1.00 0.00 H new ATOM 0 HD3 ARG A 126 13.408 -4.625 2.680 1.00 0.00 H new ATOM 0 HE ARG A 126 15.121 -4.384 0.510 1.00 0.00 H new ATOM 0 HH11 ARG A 126 15.630 -4.022 4.068 1.00 0.00 H new ATOM 0 HH12 ARG A 126 17.322 -4.514 3.938 1.00 0.00 H new ATOM 0 HH21 ARG A 126 17.253 -4.985 0.478 1.00 0.00 H new ATOM 0 HH22 ARG A 126 18.212 -5.044 1.961 1.00 0.00 H new ATOM 1986 N ILE A 127 13.604 -0.486 3.410 1.00 0.00 N ATOM 1987 CA ILE A 127 14.382 -0.152 4.630 1.00 0.00 C ATOM 1988 C ILE A 127 14.129 -1.296 5.624 1.00 0.00 C ATOM 1989 O ILE A 127 14.865 -2.281 5.668 1.00 0.00 O ATOM 1990 CB ILE A 127 14.051 1.252 5.254 1.00 0.00 C ATOM 1991 CG1 ILE A 127 12.542 1.499 5.559 1.00 0.00 C ATOM 1992 CG2 ILE A 127 14.637 2.402 4.399 1.00 0.00 C ATOM 1993 CD1 ILE A 127 12.234 2.637 6.540 1.00 0.00 C ATOM 0 H ILE A 127 12.694 -0.900 3.612 1.00 0.00 H new ATOM 0 HA ILE A 127 15.437 -0.063 4.369 1.00 0.00 H new ATOM 0 HB ILE A 127 14.540 1.242 6.228 1.00 0.00 H new ATOM 0 HG12 ILE A 127 12.031 1.707 4.619 1.00 0.00 H new ATOM 0 HG13 ILE A 127 12.116 0.578 5.956 1.00 0.00 H new ATOM 0 HG21 ILE A 127 14.390 3.359 4.858 1.00 0.00 H new ATOM 0 HG22 ILE A 127 15.720 2.296 4.340 1.00 0.00 H new ATOM 0 HG23 ILE A 127 14.214 2.361 3.395 1.00 0.00 H new ATOM 0 HD11 ILE A 127 11.156 2.718 6.677 1.00 0.00 H new ATOM 0 HD12 ILE A 127 12.707 2.428 7.500 1.00 0.00 H new ATOM 0 HD13 ILE A 127 12.620 3.575 6.142 1.00 0.00 H new