USER MOD reduce.3.24.130724 H: found=0, std=0, add=780, rem=0, adj=45 USER MOD reduce.3.24.130724 removed 782 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 97 THR OG1 : rot 77:sc= 2.04 USER MOD Set 1.2: A 112 LYS NZ :NH3+ 141:sc= 0.923 (180deg=0.962) USER MOD Set 2.1: A 73 TYR OH : rot -1:sc= 1.23 USER MOD Set 2.2: A 83 THR OG1 : rot 138:sc= 1.05 USER MOD Set 3.1: A 71 SER OG : rot 73:sc= 1.95 USER MOD Set 3.2: A 86 THR OG1 : rot 21:sc= 0.201 USER MOD Set 4.1: A 57 ASN : amide:sc= 0.897 K(o=3.3,f=1.3) USER MOD Set 4.2: A 72 GLN : amide:sc= 1.65 K(o=3.3,f=0.091) USER MOD Set 4.3: A 87 SER OG : rot 159:sc= 0.758 USER MOD Set 5.1: A 41 SER OG : rot -159:sc= 1.01 USER MOD Set 5.2: A 53 THR OG1 : rot -165:sc= 0.617 USER MOD Set 6.1: A 23 THR OG1 : rot 72:sc= 0.75 USER MOD Set 6.2: A 39 THR OG1 : rot 180:sc= 0 USER MOD Set 7.1: A 16 GLN : amide:sc= 1.04 K(o=2.8,f=0.84) USER MOD Set 7.2: A 31 GLN : amide:sc= 1.73 K(o=2.8,f=-1.1) USER MOD Set 8.1: A 14 ASN : amide:sc= 1.05 K(o=2.9,f=0.64) USER MOD Set 8.2: A 29 ASN : amide:sc= 1.88 K(o=2.9,f=-0.52) USER MOD Set 9.1: A 12 THR OG1 : rot 118:sc= 1.38 USER MOD Set 9.2: A 15 SER OG : rot 85:sc= 1.88 USER MOD Set10.1: A 8 ASN : amide:sc= 0.617 K(o=2,f=0.32) USER MOD Set10.2: A 24 ASN : amide:sc= 1.38 K(o=2,f=-0.44) USER MOD Set11.1: A 6 ASN : amide:sc= 1.64 K(o=2.4,f=-11!) USER MOD Set11.2: A 9 SER OG : rot 89:sc= 0.77 USER MOD Single : A 7 THR OG1 : rot 77:sc= 0.695 USER MOD Single : A 10 GLN : amide:sc= -0.0321 X(o=-0.032,f=-0.032) USER MOD Single : A 17 CYS SG : rot 180:sc= 0 USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 SER OG : rot 70:sc= 1.41 USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot 86:sc= 1.98 USER MOD Single : A 35 THR OG1 : rot 75:sc= 0.867 USER MOD Single : A 36 SER OG : rot 94:sc= 1.28 USER MOD Single : A 42 GLN : amide:sc= 1.25 K(o=1.2,f=0) USER MOD Single : A 43 TYR OH : rot -155:sc= -0.127 USER MOD Single : A 44 SER OG : rot 180:sc=-0.000618 USER MOD Single : A 47 ASN : amide:sc= 0.597 K(o=0.6,f=0) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 SER OG : rot 53:sc= 1.77 USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ 179:sc= 1.03 (180deg=0.964) USER MOD Single : A 61 SER OG : rot 69:sc= 1.63 USER MOD Single : A 62 GLN : amide:sc= -0.129 X(o=-0.13,f=-0.23) USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 THR OG1 : rot 82:sc= 1.67 USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc= 1.02 K(o=1,f=-1.4!) USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 81 SER OG : rot 59:sc= 1.67 USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 94 SER OG : rot -136:sc= 0.804 USER MOD Single : A 96 SER OG : rot 180:sc= 0.876 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 THR OG1 : rot 180:sc= 0 USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 121 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 46 N VAL A 5 10.784 -2.834 -1.262 1.00 0.00 N ATOM 47 CA VAL A 5 11.309 -1.603 -1.848 1.00 0.00 C ATOM 48 C VAL A 5 12.838 -1.773 -1.882 1.00 0.00 C ATOM 49 O VAL A 5 13.599 -1.030 -1.259 1.00 0.00 O ATOM 50 CB VAL A 5 10.776 -0.364 -1.082 1.00 0.00 C ATOM 51 CG1 VAL A 5 11.104 0.941 -1.825 1.00 0.00 C ATOM 52 CG2 VAL A 5 9.249 -0.412 -0.879 1.00 0.00 C ATOM 0 HA VAL A 5 10.969 -1.423 -2.868 1.00 0.00 H new ATOM 0 HB VAL A 5 11.273 -0.386 -0.112 1.00 0.00 H new ATOM 0 HG11 VAL A 5 10.716 1.789 -1.260 1.00 0.00 H new ATOM 0 HG12 VAL A 5 12.185 1.039 -1.929 1.00 0.00 H new ATOM 0 HG13 VAL A 5 10.644 0.922 -2.813 1.00 0.00 H new ATOM 0 HG21 VAL A 5 8.926 0.477 -0.338 1.00 0.00 H new ATOM 0 HG22 VAL A 5 8.754 -0.446 -1.849 1.00 0.00 H new ATOM 0 HG23 VAL A 5 8.986 -1.301 -0.306 1.00 0.00 H new ATOM 62 N ASN A 6 13.290 -2.847 -2.540 1.00 0.00 N ATOM 63 CA ASN A 6 14.710 -3.155 -2.672 1.00 0.00 C ATOM 64 C ASN A 6 15.311 -2.307 -3.797 1.00 0.00 C ATOM 65 O ASN A 6 14.784 -2.292 -4.913 1.00 0.00 O ATOM 66 CB ASN A 6 14.919 -4.651 -2.956 1.00 0.00 C ATOM 67 CG ASN A 6 16.401 -4.997 -3.039 1.00 0.00 C ATOM 68 OD1 ASN A 6 17.251 -4.222 -2.612 1.00 0.00 O ATOM 69 ND2 ASN A 6 16.750 -6.151 -3.581 1.00 0.00 N ATOM 0 H ASN A 6 12.678 -3.524 -2.994 1.00 0.00 H new ATOM 0 HA ASN A 6 15.213 -2.919 -1.734 1.00 0.00 H new ATOM 0 HB2 ASN A 6 14.449 -5.242 -2.170 1.00 0.00 H new ATOM 0 HB3 ASN A 6 14.428 -4.918 -3.892 1.00 0.00 H new ATOM 0 HD21 ASN A 6 17.735 -6.406 -3.648 1.00 0.00 H new ATOM 0 HD22 ASN A 6 16.034 -6.787 -3.932 1.00 0.00 H new ATOM 76 N THR A 7 16.412 -1.619 -3.505 1.00 0.00 N ATOM 77 CA THR A 7 17.128 -0.761 -4.440 1.00 0.00 C ATOM 78 C THR A 7 18.107 -1.606 -5.276 1.00 0.00 C ATOM 79 O THR A 7 18.029 -1.598 -6.506 1.00 0.00 O ATOM 80 CB THR A 7 17.858 0.343 -3.643 1.00 0.00 C ATOM 81 OG1 THR A 7 17.023 0.900 -2.645 1.00 0.00 O ATOM 82 CG2 THR A 7 18.350 1.476 -4.548 1.00 0.00 C ATOM 0 H THR A 7 16.843 -1.646 -2.581 1.00 0.00 H new ATOM 0 HA THR A 7 16.433 -0.285 -5.132 1.00 0.00 H new ATOM 0 HB THR A 7 18.716 -0.142 -3.178 1.00 0.00 H new ATOM 0 HG1 THR A 7 16.969 0.286 -1.883 1.00 0.00 H new ATOM 0 HG21 THR A 7 18.857 2.229 -3.945 1.00 0.00 H new ATOM 0 HG22 THR A 7 19.044 1.076 -5.287 1.00 0.00 H new ATOM 0 HG23 THR A 7 17.500 1.930 -5.057 1.00 0.00 H new ATOM 90 N ASN A 8 19.020 -2.338 -4.618 1.00 0.00 N ATOM 91 CA ASN A 8 20.096 -3.116 -5.257 1.00 0.00 C ATOM 92 C ASN A 8 20.646 -4.214 -4.325 1.00 0.00 C ATOM 93 O ASN A 8 21.726 -4.759 -4.553 1.00 0.00 O ATOM 94 CB ASN A 8 21.240 -2.166 -5.674 1.00 0.00 C ATOM 95 CG ASN A 8 22.218 -2.835 -6.644 1.00 0.00 C ATOM 96 OD1 ASN A 8 21.817 -3.343 -7.690 1.00 0.00 O ATOM 97 ND2 ASN A 8 23.509 -2.837 -6.355 1.00 0.00 N ATOM 0 H ASN A 8 19.031 -2.408 -3.600 1.00 0.00 H new ATOM 0 HA ASN A 8 19.676 -3.608 -6.134 1.00 0.00 H new ATOM 0 HB2 ASN A 8 20.819 -1.275 -6.141 1.00 0.00 H new ATOM 0 HB3 ASN A 8 21.779 -1.836 -4.786 1.00 0.00 H new ATOM 0 HD21 ASN A 8 24.175 -3.261 -7.001 1.00 0.00 H new ATOM 0 HD22 ASN A 8 23.838 -2.415 -5.487 1.00 0.00 H new ATOM 104 N SER A 9 19.962 -4.486 -3.213 1.00 0.00 N ATOM 105 CA SER A 9 20.407 -5.414 -2.181 1.00 0.00 C ATOM 106 C SER A 9 20.325 -6.849 -2.674 1.00 0.00 C ATOM 107 O SER A 9 19.510 -7.164 -3.549 1.00 0.00 O ATOM 108 CB SER A 9 19.529 -5.265 -0.937 1.00 0.00 C ATOM 109 OG SER A 9 19.365 -3.886 -0.657 1.00 0.00 O ATOM 0 H SER A 9 19.062 -4.055 -3.003 1.00 0.00 H new ATOM 0 HA SER A 9 21.443 -5.180 -1.937 1.00 0.00 H new ATOM 0 HB2 SER A 9 18.559 -5.735 -1.101 1.00 0.00 H new ATOM 0 HB3 SER A 9 19.989 -5.771 -0.088 1.00 0.00 H new ATOM 0 HG SER A 9 18.588 -3.543 -1.146 1.00 0.00 H new ATOM 115 N GLN A 10 21.111 -7.720 -2.044 1.00 0.00 N ATOM 116 CA GLN A 10 21.031 -9.153 -2.277 1.00 0.00 C ATOM 117 C GLN A 10 20.222 -9.782 -1.145 1.00 0.00 C ATOM 118 O GLN A 10 20.543 -9.605 0.031 1.00 0.00 O ATOM 119 CB GLN A 10 22.427 -9.760 -2.495 1.00 0.00 C ATOM 120 CG GLN A 10 23.376 -9.808 -1.292 1.00 0.00 C ATOM 121 CD GLN A 10 24.737 -10.371 -1.705 1.00 0.00 C ATOM 122 OE1 GLN A 10 25.669 -9.630 -2.008 1.00 0.00 O ATOM 123 NE2 GLN A 10 24.883 -11.686 -1.747 1.00 0.00 N ATOM 0 H GLN A 10 21.818 -7.449 -1.360 1.00 0.00 H new ATOM 0 HA GLN A 10 20.502 -9.371 -3.205 1.00 0.00 H new ATOM 0 HB2 GLN A 10 22.297 -10.778 -2.861 1.00 0.00 H new ATOM 0 HB3 GLN A 10 22.918 -9.196 -3.288 1.00 0.00 H new ATOM 0 HG2 GLN A 10 23.500 -8.807 -0.879 1.00 0.00 H new ATOM 0 HG3 GLN A 10 22.944 -10.426 -0.505 1.00 0.00 H new ATOM 0 HE21 GLN A 10 24.104 -12.294 -1.494 1.00 0.00 H new ATOM 0 HE22 GLN A 10 25.774 -12.091 -2.033 1.00 0.00 H new ATOM 132 N ILE A 11 19.159 -10.492 -1.516 1.00 0.00 N ATOM 133 CA ILE A 11 18.196 -11.135 -0.636 1.00 0.00 C ATOM 134 C ILE A 11 18.206 -12.596 -1.085 1.00 0.00 C ATOM 135 O ILE A 11 17.965 -12.860 -2.268 1.00 0.00 O ATOM 136 CB ILE A 11 16.789 -10.491 -0.805 1.00 0.00 C ATOM 137 CG1 ILE A 11 16.779 -8.945 -0.876 1.00 0.00 C ATOM 138 CG2 ILE A 11 15.827 -10.998 0.284 1.00 0.00 C ATOM 139 CD1 ILE A 11 17.242 -8.229 0.389 1.00 0.00 C ATOM 0 H ILE A 11 18.937 -10.641 -2.500 1.00 0.00 H new ATOM 0 HA ILE A 11 18.443 -11.030 0.421 1.00 0.00 H new ATOM 0 HB ILE A 11 16.442 -10.817 -1.786 1.00 0.00 H new ATOM 0 HG12 ILE A 11 17.415 -8.632 -1.704 1.00 0.00 H new ATOM 0 HG13 ILE A 11 15.767 -8.615 -1.110 1.00 0.00 H new ATOM 0 HG21 ILE A 11 14.849 -10.536 0.149 1.00 0.00 H new ATOM 0 HG22 ILE A 11 15.731 -12.081 0.209 1.00 0.00 H new ATOM 0 HG23 ILE A 11 16.219 -10.736 1.267 1.00 0.00 H new ATOM 0 HD11 ILE A 11 17.197 -7.151 0.234 1.00 0.00 H new ATOM 0 HD12 ILE A 11 16.593 -8.503 1.221 1.00 0.00 H new ATOM 0 HD13 ILE A 11 18.267 -8.520 0.617 1.00 0.00 H new ATOM 151 N THR A 12 18.549 -13.532 -0.199 1.00 0.00 N ATOM 152 CA THR A 12 18.620 -14.940 -0.617 1.00 0.00 C ATOM 153 C THR A 12 17.222 -15.501 -0.930 1.00 0.00 C ATOM 154 O THR A 12 16.201 -14.910 -0.563 1.00 0.00 O ATOM 155 CB THR A 12 19.390 -15.817 0.383 1.00 0.00 C ATOM 156 OG1 THR A 12 18.812 -15.777 1.673 1.00 0.00 O ATOM 157 CG2 THR A 12 20.864 -15.414 0.466 1.00 0.00 C ATOM 0 H THR A 12 18.775 -13.355 0.780 1.00 0.00 H new ATOM 0 HA THR A 12 19.196 -14.968 -1.542 1.00 0.00 H new ATOM 0 HB THR A 12 19.327 -16.839 0.009 1.00 0.00 H new ATOM 0 HG1 THR A 12 18.509 -16.675 1.924 1.00 0.00 H new ATOM 0 HG21 THR A 12 21.377 -16.056 1.183 1.00 0.00 H new ATOM 0 HG22 THR A 12 21.327 -15.523 -0.515 1.00 0.00 H new ATOM 0 HG23 THR A 12 20.940 -14.376 0.789 1.00 0.00 H new ATOM 165 N ALA A 13 17.171 -16.675 -1.570 1.00 0.00 N ATOM 166 CA ALA A 13 15.939 -17.336 -1.995 1.00 0.00 C ATOM 167 C ALA A 13 14.947 -17.592 -0.852 1.00 0.00 C ATOM 168 O ALA A 13 13.743 -17.670 -1.107 1.00 0.00 O ATOM 169 CB ALA A 13 16.301 -18.670 -2.654 1.00 0.00 C ATOM 0 H ALA A 13 18.010 -17.203 -1.811 1.00 0.00 H new ATOM 0 HA ALA A 13 15.440 -16.662 -2.692 1.00 0.00 H new ATOM 0 HB1 ALA A 13 15.391 -19.175 -2.977 1.00 0.00 H new ATOM 0 HB2 ALA A 13 16.940 -18.487 -3.518 1.00 0.00 H new ATOM 0 HB3 ALA A 13 16.830 -19.298 -1.937 1.00 0.00 H new ATOM 175 N ASN A 14 15.434 -17.729 0.389 1.00 0.00 N ATOM 176 CA ASN A 14 14.591 -17.980 1.569 1.00 0.00 C ATOM 177 C ASN A 14 14.537 -16.771 2.509 1.00 0.00 C ATOM 178 O ASN A 14 13.857 -16.803 3.537 1.00 0.00 O ATOM 179 CB ASN A 14 15.053 -19.248 2.306 1.00 0.00 C ATOM 180 CG ASN A 14 13.990 -19.733 3.294 1.00 0.00 C ATOM 181 OD1 ASN A 14 12.840 -19.957 2.925 1.00 0.00 O ATOM 182 ND2 ASN A 14 14.339 -19.932 4.552 1.00 0.00 N ATOM 0 H ASN A 14 16.429 -17.669 0.605 1.00 0.00 H new ATOM 0 HA ASN A 14 13.573 -18.144 1.216 1.00 0.00 H new ATOM 0 HB2 ASN A 14 15.266 -20.035 1.582 1.00 0.00 H new ATOM 0 HB3 ASN A 14 15.982 -19.044 2.839 1.00 0.00 H new ATOM 0 HD21 ASN A 14 13.652 -20.274 5.224 1.00 0.00 H new ATOM 0 HD22 ASN A 14 15.296 -19.744 4.852 1.00 0.00 H new ATOM 189 N SER A 15 15.260 -15.701 2.180 1.00 0.00 N ATOM 190 CA SER A 15 15.123 -14.424 2.855 1.00 0.00 C ATOM 191 C SER A 15 13.886 -13.705 2.311 1.00 0.00 C ATOM 192 O SER A 15 13.351 -14.080 1.262 1.00 0.00 O ATOM 193 CB SER A 15 16.369 -13.589 2.586 1.00 0.00 C ATOM 194 OG SER A 15 17.479 -14.127 3.264 1.00 0.00 O ATOM 0 H SER A 15 15.957 -15.702 1.435 1.00 0.00 H new ATOM 0 HA SER A 15 15.011 -14.572 3.929 1.00 0.00 H new ATOM 0 HB2 SER A 15 16.569 -13.559 1.515 1.00 0.00 H new ATOM 0 HB3 SER A 15 16.202 -12.561 2.908 1.00 0.00 H new ATOM 0 HG SER A 15 17.879 -14.840 2.723 1.00 0.00 H new ATOM 200 N GLN A 16 13.451 -12.642 2.990 1.00 0.00 N ATOM 201 CA GLN A 16 12.361 -11.784 2.536 1.00 0.00 C ATOM 202 C GLN A 16 12.657 -10.335 2.927 1.00 0.00 C ATOM 203 O GLN A 16 13.457 -10.082 3.829 1.00 0.00 O ATOM 204 CB GLN A 16 11.018 -12.228 3.146 1.00 0.00 C ATOM 205 CG GLN A 16 10.559 -13.638 2.746 1.00 0.00 C ATOM 206 CD GLN A 16 9.223 -13.990 3.400 1.00 0.00 C ATOM 207 OE1 GLN A 16 8.168 -13.950 2.772 1.00 0.00 O ATOM 208 NE2 GLN A 16 9.242 -14.333 4.677 1.00 0.00 N ATOM 0 H GLN A 16 13.852 -12.351 3.881 1.00 0.00 H new ATOM 0 HA GLN A 16 12.284 -11.864 1.452 1.00 0.00 H new ATOM 0 HB2 GLN A 16 11.096 -12.182 4.232 1.00 0.00 H new ATOM 0 HB3 GLN A 16 10.249 -11.514 2.852 1.00 0.00 H new ATOM 0 HG2 GLN A 16 10.463 -13.698 1.662 1.00 0.00 H new ATOM 0 HG3 GLN A 16 11.314 -14.367 3.041 1.00 0.00 H new ATOM 0 HE21 GLN A 16 10.126 -14.361 5.184 1.00 0.00 H new ATOM 0 HE22 GLN A 16 8.372 -14.569 5.155 1.00 0.00 H new ATOM 217 N CYS A 17 11.968 -9.407 2.254 1.00 0.00 N ATOM 218 CA CYS A 17 12.068 -7.956 2.415 1.00 0.00 C ATOM 219 C CYS A 17 10.671 -7.305 2.492 1.00 0.00 C ATOM 220 O CYS A 17 10.466 -6.190 2.006 1.00 0.00 O ATOM 221 CB CYS A 17 12.950 -7.405 1.278 1.00 0.00 C ATOM 222 SG CYS A 17 12.665 -8.085 -0.388 1.00 0.00 S ATOM 0 H CYS A 17 11.286 -9.666 1.541 1.00 0.00 H new ATOM 0 HA CYS A 17 12.544 -7.704 3.362 1.00 0.00 H new ATOM 0 HB2 CYS A 17 12.810 -6.325 1.232 1.00 0.00 H new ATOM 0 HB3 CYS A 17 13.993 -7.580 1.542 1.00 0.00 H new ATOM 0 HG CYS A 17 13.479 -7.523 -1.231 1.00 0.00 H new ATOM 227 N VAL A 18 9.701 -8.025 3.068 1.00 0.00 N ATOM 228 CA VAL A 18 8.270 -7.710 3.060 1.00 0.00 C ATOM 229 C VAL A 18 8.018 -6.246 3.440 1.00 0.00 C ATOM 230 O VAL A 18 8.360 -5.820 4.547 1.00 0.00 O ATOM 231 CB VAL A 18 7.483 -8.686 3.969 1.00 0.00 C ATOM 232 CG1 VAL A 18 5.976 -8.606 3.684 1.00 0.00 C ATOM 233 CG2 VAL A 18 7.913 -10.152 3.787 1.00 0.00 C ATOM 0 H VAL A 18 9.904 -8.885 3.577 1.00 0.00 H new ATOM 0 HA VAL A 18 7.902 -7.843 2.043 1.00 0.00 H new ATOM 0 HB VAL A 18 7.705 -8.376 4.990 1.00 0.00 H new ATOM 0 HG11 VAL A 18 5.445 -9.301 4.335 1.00 0.00 H new ATOM 0 HG12 VAL A 18 5.624 -7.592 3.871 1.00 0.00 H new ATOM 0 HG13 VAL A 18 5.788 -8.869 2.643 1.00 0.00 H new ATOM 0 HG21 VAL A 18 7.327 -10.788 4.450 1.00 0.00 H new ATOM 0 HG22 VAL A 18 7.747 -10.454 2.753 1.00 0.00 H new ATOM 0 HG23 VAL A 18 8.971 -10.254 4.029 1.00 0.00 H new ATOM 243 N LYS A 19 7.410 -5.496 2.511 1.00 0.00 N ATOM 244 CA LYS A 19 7.115 -4.059 2.574 1.00 0.00 C ATOM 245 C LYS A 19 8.184 -3.228 3.284 1.00 0.00 C ATOM 246 O LYS A 19 7.855 -2.306 4.028 1.00 0.00 O ATOM 247 CB LYS A 19 5.678 -3.789 3.058 1.00 0.00 C ATOM 248 CG LYS A 19 5.332 -4.304 4.460 1.00 0.00 C ATOM 249 CD LYS A 19 3.881 -3.937 4.797 1.00 0.00 C ATOM 250 CE LYS A 19 3.448 -4.519 6.148 1.00 0.00 C ATOM 251 NZ LYS A 19 2.029 -4.205 6.440 1.00 0.00 N ATOM 0 H LYS A 19 7.089 -5.907 1.634 1.00 0.00 H new ATOM 0 HA LYS A 19 7.161 -3.696 1.547 1.00 0.00 H new ATOM 0 HB2 LYS A 19 5.504 -2.713 3.035 1.00 0.00 H new ATOM 0 HB3 LYS A 19 4.986 -4.239 2.346 1.00 0.00 H new ATOM 0 HG2 LYS A 19 5.465 -5.385 4.505 1.00 0.00 H new ATOM 0 HG3 LYS A 19 6.008 -3.869 5.196 1.00 0.00 H new ATOM 0 HD2 LYS A 19 3.775 -2.852 4.817 1.00 0.00 H new ATOM 0 HD3 LYS A 19 3.220 -4.307 4.013 1.00 0.00 H new ATOM 0 HE2 LYS A 19 3.590 -5.600 6.143 1.00 0.00 H new ATOM 0 HE3 LYS A 19 4.082 -4.118 6.939 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 1.766 -4.612 7.360 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 1.900 -3.173 6.468 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 1.424 -4.609 5.697 1.00 0.00 H new ATOM 265 N SER A 20 9.455 -3.541 3.054 1.00 0.00 N ATOM 266 CA SER A 20 10.576 -2.884 3.697 1.00 0.00 C ATOM 267 C SER A 20 11.545 -2.398 2.628 1.00 0.00 C ATOM 268 O SER A 20 11.567 -2.912 1.505 1.00 0.00 O ATOM 269 CB SER A 20 11.229 -3.869 4.660 1.00 0.00 C ATOM 270 OG SER A 20 10.318 -4.232 5.679 1.00 0.00 O ATOM 0 H SER A 20 9.735 -4.274 2.402 1.00 0.00 H new ATOM 0 HA SER A 20 10.251 -2.015 4.269 1.00 0.00 H new ATOM 0 HB2 SER A 20 11.553 -4.758 4.118 1.00 0.00 H new ATOM 0 HB3 SER A 20 12.120 -3.422 5.101 1.00 0.00 H new ATOM 0 HG SER A 20 9.603 -4.783 5.297 1.00 0.00 H new ATOM 276 N THR A 21 12.338 -1.391 2.979 1.00 0.00 N ATOM 277 CA THR A 21 13.286 -0.770 2.074 1.00 0.00 C ATOM 278 C THR A 21 14.635 -1.457 2.276 1.00 0.00 C ATOM 279 O THR A 21 14.996 -1.804 3.402 1.00 0.00 O ATOM 280 CB THR A 21 13.319 0.744 2.351 1.00 0.00 C ATOM 281 OG1 THR A 21 12.012 1.282 2.239 1.00 0.00 O ATOM 282 CG2 THR A 21 14.215 1.507 1.371 1.00 0.00 C ATOM 0 H THR A 21 12.337 -0.981 3.913 1.00 0.00 H new ATOM 0 HA THR A 21 13.005 -0.888 1.027 1.00 0.00 H new ATOM 0 HB THR A 21 13.720 0.862 3.358 1.00 0.00 H new ATOM 0 HG1 THR A 21 12.038 2.245 2.418 1.00 0.00 H new ATOM 0 HG21 THR A 21 14.199 2.569 1.615 1.00 0.00 H new ATOM 0 HG22 THR A 21 15.236 1.133 1.445 1.00 0.00 H new ATOM 0 HG23 THR A 21 13.848 1.363 0.355 1.00 0.00 H new ATOM 290 N ALA A 22 15.395 -1.655 1.203 1.00 0.00 N ATOM 291 CA ALA A 22 16.716 -2.248 1.293 1.00 0.00 C ATOM 292 C ALA A 22 17.623 -1.507 0.327 1.00 0.00 C ATOM 293 O ALA A 22 17.268 -1.323 -0.839 1.00 0.00 O ATOM 294 CB ALA A 22 16.630 -3.753 1.005 1.00 0.00 C ATOM 0 H ALA A 22 15.111 -1.409 0.255 1.00 0.00 H new ATOM 0 HA ALA A 22 17.134 -2.153 2.295 1.00 0.00 H new ATOM 0 HB1 ALA A 22 17.624 -4.194 1.074 1.00 0.00 H new ATOM 0 HB2 ALA A 22 15.972 -4.226 1.734 1.00 0.00 H new ATOM 0 HB3 ALA A 22 16.232 -3.909 0.002 1.00 0.00 H new ATOM 300 N THR A 23 18.788 -1.092 0.809 1.00 0.00 N ATOM 301 CA THR A 23 19.678 -0.191 0.095 1.00 0.00 C ATOM 302 C THR A 23 21.072 -0.829 0.049 1.00 0.00 C ATOM 303 O THR A 23 21.916 -0.584 0.912 1.00 0.00 O ATOM 304 CB THR A 23 19.627 1.226 0.720 1.00 0.00 C ATOM 305 OG1 THR A 23 18.396 1.483 1.378 1.00 0.00 O ATOM 306 CG2 THR A 23 19.843 2.310 -0.339 1.00 0.00 C ATOM 0 H THR A 23 19.145 -1.378 1.721 1.00 0.00 H new ATOM 0 HA THR A 23 19.363 -0.046 -0.938 1.00 0.00 H new ATOM 0 HB THR A 23 20.433 1.255 1.454 1.00 0.00 H new ATOM 0 HG1 THR A 23 18.353 0.961 2.206 1.00 0.00 H new ATOM 0 HG21 THR A 23 19.801 3.292 0.132 1.00 0.00 H new ATOM 0 HG22 THR A 23 20.818 2.173 -0.807 1.00 0.00 H new ATOM 0 HG23 THR A 23 19.064 2.238 -1.098 1.00 0.00 H new ATOM 314 N ASN A 24 21.290 -1.689 -0.953 1.00 0.00 N ATOM 315 CA ASN A 24 22.528 -2.438 -1.194 1.00 0.00 C ATOM 316 C ASN A 24 22.953 -3.255 0.039 1.00 0.00 C ATOM 317 O ASN A 24 24.116 -3.235 0.447 1.00 0.00 O ATOM 318 CB ASN A 24 23.619 -1.507 -1.756 1.00 0.00 C ATOM 319 CG ASN A 24 24.647 -2.274 -2.582 1.00 0.00 C ATOM 320 OD1 ASN A 24 24.645 -2.191 -3.807 1.00 0.00 O ATOM 321 ND2 ASN A 24 25.522 -3.041 -1.956 1.00 0.00 N ATOM 0 H ASN A 24 20.574 -1.891 -1.651 1.00 0.00 H new ATOM 0 HA ASN A 24 22.348 -3.187 -1.965 1.00 0.00 H new ATOM 0 HB2 ASN A 24 23.157 -0.737 -2.374 1.00 0.00 H new ATOM 0 HB3 ASN A 24 24.121 -0.997 -0.934 1.00 0.00 H new ATOM 0 HD21 ASN A 24 26.208 -3.574 -2.491 1.00 0.00 H new ATOM 0 HD22 ASN A 24 25.512 -3.100 -0.938 1.00 0.00 H new ATOM 328 N CYS A 25 21.992 -3.932 0.671 1.00 0.00 N ATOM 329 CA CYS A 25 22.202 -4.755 1.856 1.00 0.00 C ATOM 330 C CYS A 25 22.592 -6.172 1.417 1.00 0.00 C ATOM 331 O CYS A 25 22.507 -6.514 0.232 1.00 0.00 O ATOM 332 CB CYS A 25 20.910 -4.811 2.689 1.00 0.00 C ATOM 333 SG CYS A 25 20.078 -3.222 2.922 1.00 0.00 S ATOM 0 H CYS A 25 21.020 -3.920 0.361 1.00 0.00 H new ATOM 0 HA CYS A 25 22.997 -4.324 2.464 1.00 0.00 H new ATOM 0 HB2 CYS A 25 20.216 -5.500 2.208 1.00 0.00 H new ATOM 0 HB3 CYS A 25 21.145 -5.227 3.668 1.00 0.00 H new ATOM 338 N TYR A 26 22.918 -7.020 2.386 1.00 0.00 N ATOM 339 CA TYR A 26 23.152 -8.445 2.212 1.00 0.00 C ATOM 340 C TYR A 26 22.232 -9.130 3.211 1.00 0.00 C ATOM 341 O TYR A 26 22.341 -8.854 4.403 1.00 0.00 O ATOM 342 CB TYR A 26 24.638 -8.727 2.492 1.00 0.00 C ATOM 343 CG TYR A 26 25.087 -10.181 2.445 1.00 0.00 C ATOM 344 CD1 TYR A 26 24.696 -11.095 3.446 1.00 0.00 C ATOM 345 CD2 TYR A 26 25.990 -10.596 1.448 1.00 0.00 C ATOM 346 CE1 TYR A 26 25.197 -12.408 3.446 1.00 0.00 C ATOM 347 CE2 TYR A 26 26.480 -11.914 1.430 1.00 0.00 C ATOM 348 CZ TYR A 26 26.085 -12.831 2.431 1.00 0.00 C ATOM 349 OH TYR A 26 26.579 -14.100 2.414 1.00 0.00 O ATOM 0 H TYR A 26 23.031 -6.719 3.354 1.00 0.00 H new ATOM 0 HA TYR A 26 22.942 -8.808 1.206 1.00 0.00 H new ATOM 0 HB2 TYR A 26 25.231 -8.166 1.770 1.00 0.00 H new ATOM 0 HB3 TYR A 26 24.878 -8.330 3.478 1.00 0.00 H new ATOM 0 HD1 TYR A 26 24.007 -10.784 4.217 1.00 0.00 H new ATOM 0 HD2 TYR A 26 26.309 -9.896 0.690 1.00 0.00 H new ATOM 0 HE1 TYR A 26 24.902 -13.096 4.224 1.00 0.00 H new ATOM 0 HE2 TYR A 26 27.159 -12.226 0.650 1.00 0.00 H new ATOM 0 HH TYR A 26 27.173 -14.210 1.642 1.00 0.00 H new ATOM 359 N ILE A 27 21.321 -9.987 2.758 1.00 0.00 N ATOM 360 CA ILE A 27 20.320 -10.612 3.611 1.00 0.00 C ATOM 361 C ILE A 27 20.341 -12.103 3.282 1.00 0.00 C ATOM 362 O ILE A 27 19.948 -12.492 2.180 1.00 0.00 O ATOM 363 CB ILE A 27 18.953 -9.913 3.388 1.00 0.00 C ATOM 364 CG1 ILE A 27 19.077 -8.405 3.750 1.00 0.00 C ATOM 365 CG2 ILE A 27 17.827 -10.580 4.186 1.00 0.00 C ATOM 366 CD1 ILE A 27 17.780 -7.632 4.016 1.00 0.00 C ATOM 0 H ILE A 27 21.258 -10.268 1.780 1.00 0.00 H new ATOM 0 HA ILE A 27 20.523 -10.503 4.676 1.00 0.00 H new ATOM 0 HB ILE A 27 18.688 -10.011 2.335 1.00 0.00 H new ATOM 0 HG12 ILE A 27 19.706 -8.323 4.637 1.00 0.00 H new ATOM 0 HG13 ILE A 27 19.605 -7.906 2.937 1.00 0.00 H new ATOM 0 HG21 ILE A 27 16.889 -10.057 3.999 1.00 0.00 H new ATOM 0 HG22 ILE A 27 17.730 -11.621 3.878 1.00 0.00 H new ATOM 0 HG23 ILE A 27 18.060 -10.537 5.250 1.00 0.00 H new ATOM 0 HD11 ILE A 27 18.017 -6.595 4.256 1.00 0.00 H new ATOM 0 HD12 ILE A 27 17.149 -7.664 3.128 1.00 0.00 H new ATOM 0 HD13 ILE A 27 17.251 -8.086 4.854 1.00 0.00 H new ATOM 378 N ASP A 28 20.832 -12.916 4.224 1.00 0.00 N ATOM 379 CA ASP A 28 21.006 -14.360 4.075 1.00 0.00 C ATOM 380 C ASP A 28 20.169 -15.081 5.122 1.00 0.00 C ATOM 381 O ASP A 28 20.298 -14.809 6.316 1.00 0.00 O ATOM 382 CB ASP A 28 22.485 -14.732 4.238 1.00 0.00 C ATOM 383 CG ASP A 28 22.671 -16.245 4.447 1.00 0.00 C ATOM 384 OD1 ASP A 28 22.325 -17.032 3.539 1.00 0.00 O ATOM 385 OD2 ASP A 28 23.195 -16.654 5.507 1.00 0.00 O ATOM 0 H ASP A 28 21.128 -12.574 5.138 1.00 0.00 H new ATOM 0 HA ASP A 28 20.678 -14.661 3.080 1.00 0.00 H new ATOM 0 HB2 ASP A 28 23.039 -14.416 3.354 1.00 0.00 H new ATOM 0 HB3 ASP A 28 22.904 -14.193 5.087 1.00 0.00 H new ATOM 390 N ASN A 29 19.306 -15.991 4.669 1.00 0.00 N ATOM 391 CA ASN A 29 18.251 -16.670 5.429 1.00 0.00 C ATOM 392 C ASN A 29 17.544 -15.761 6.449 1.00 0.00 C ATOM 393 O ASN A 29 17.195 -16.209 7.544 1.00 0.00 O ATOM 394 CB ASN A 29 18.796 -17.959 6.074 1.00 0.00 C ATOM 395 CG ASN A 29 17.655 -18.920 6.401 1.00 0.00 C ATOM 396 OD1 ASN A 29 16.918 -19.322 5.505 1.00 0.00 O ATOM 397 ND2 ASN A 29 17.465 -19.336 7.642 1.00 0.00 N ATOM 0 H ASN A 29 19.325 -16.295 3.696 1.00 0.00 H new ATOM 0 HA ASN A 29 17.474 -16.945 4.715 1.00 0.00 H new ATOM 0 HB2 ASN A 29 19.502 -18.441 5.397 1.00 0.00 H new ATOM 0 HB3 ASN A 29 19.344 -17.713 6.984 1.00 0.00 H new ATOM 0 HD21 ASN A 29 16.709 -19.988 7.851 1.00 0.00 H new ATOM 0 HD22 ASN A 29 18.075 -19.005 8.390 1.00 0.00 H new ATOM 404 N SER A 30 17.345 -14.482 6.122 1.00 0.00 N ATOM 405 CA SER A 30 16.897 -13.469 7.067 1.00 0.00 C ATOM 406 C SER A 30 15.613 -12.791 6.601 1.00 0.00 C ATOM 407 O SER A 30 15.321 -12.701 5.408 1.00 0.00 O ATOM 408 CB SER A 30 18.017 -12.455 7.294 1.00 0.00 C ATOM 409 OG SER A 30 19.135 -13.052 7.912 1.00 0.00 O ATOM 0 H SER A 30 17.494 -14.121 5.180 1.00 0.00 H new ATOM 0 HA SER A 30 16.663 -13.954 8.015 1.00 0.00 H new ATOM 0 HB2 SER A 30 18.316 -12.021 6.340 1.00 0.00 H new ATOM 0 HB3 SER A 30 17.650 -11.638 7.915 1.00 0.00 H new ATOM 0 HG SER A 30 19.711 -13.453 7.228 1.00 0.00 H new ATOM 415 N GLN A 31 14.839 -12.296 7.564 1.00 0.00 N ATOM 416 CA GLN A 31 13.484 -11.818 7.346 1.00 0.00 C ATOM 417 C GLN A 31 13.419 -10.339 7.722 1.00 0.00 C ATOM 418 O GLN A 31 13.220 -9.998 8.892 1.00 0.00 O ATOM 419 CB GLN A 31 12.487 -12.698 8.131 1.00 0.00 C ATOM 420 CG GLN A 31 12.697 -14.221 7.981 1.00 0.00 C ATOM 421 CD GLN A 31 12.695 -14.719 6.532 1.00 0.00 C ATOM 422 OE1 GLN A 31 11.880 -14.297 5.719 1.00 0.00 O ATOM 423 NE2 GLN A 31 13.589 -15.631 6.180 1.00 0.00 N ATOM 0 H GLN A 31 15.145 -12.216 8.534 1.00 0.00 H new ATOM 0 HA GLN A 31 13.201 -11.899 6.297 1.00 0.00 H new ATOM 0 HB2 GLN A 31 12.553 -12.440 9.188 1.00 0.00 H new ATOM 0 HB3 GLN A 31 11.476 -12.453 7.806 1.00 0.00 H new ATOM 0 HG2 GLN A 31 13.645 -14.492 8.445 1.00 0.00 H new ATOM 0 HG3 GLN A 31 11.913 -14.740 8.532 1.00 0.00 H new ATOM 0 HE21 GLN A 31 14.263 -15.975 6.864 1.00 0.00 H new ATOM 0 HE22 GLN A 31 13.604 -15.989 5.225 1.00 0.00 H new ATOM 432 N LEU A 32 13.639 -9.468 6.738 1.00 0.00 N ATOM 433 CA LEU A 32 13.411 -8.031 6.843 1.00 0.00 C ATOM 434 C LEU A 32 11.913 -7.845 6.588 1.00 0.00 C ATOM 435 O LEU A 32 11.436 -8.246 5.524 1.00 0.00 O ATOM 436 CB LEU A 32 14.257 -7.332 5.757 1.00 0.00 C ATOM 437 CG LEU A 32 14.037 -5.813 5.626 1.00 0.00 C ATOM 438 CD1 LEU A 32 14.880 -5.042 6.638 1.00 0.00 C ATOM 439 CD2 LEU A 32 14.432 -5.322 4.227 1.00 0.00 C ATOM 0 H LEU A 32 13.990 -9.752 5.823 1.00 0.00 H new ATOM 0 HA LEU A 32 13.692 -7.610 7.808 1.00 0.00 H new ATOM 0 HB2 LEU A 32 15.311 -7.513 5.969 1.00 0.00 H new ATOM 0 HB3 LEU A 32 14.041 -7.798 4.796 1.00 0.00 H new ATOM 0 HG LEU A 32 12.977 -5.634 5.808 1.00 0.00 H new ATOM 0 HD11 LEU A 32 14.703 -3.973 6.520 1.00 0.00 H new ATOM 0 HD12 LEU A 32 14.605 -5.346 7.648 1.00 0.00 H new ATOM 0 HD13 LEU A 32 15.936 -5.255 6.470 1.00 0.00 H new ATOM 0 HD21 LEU A 32 14.268 -4.247 4.159 1.00 0.00 H new ATOM 0 HD22 LEU A 32 15.485 -5.540 4.049 1.00 0.00 H new ATOM 0 HD23 LEU A 32 13.824 -5.830 3.478 1.00 0.00 H new ATOM 451 N VAL A 33 11.163 -7.293 7.541 1.00 0.00 N ATOM 452 CA VAL A 33 9.704 -7.237 7.457 1.00 0.00 C ATOM 453 C VAL A 33 9.158 -5.910 8.001 1.00 0.00 C ATOM 454 O VAL A 33 9.834 -5.208 8.758 1.00 0.00 O ATOM 455 CB VAL A 33 9.068 -8.459 8.170 1.00 0.00 C ATOM 456 CG1 VAL A 33 9.440 -9.797 7.512 1.00 0.00 C ATOM 457 CG2 VAL A 33 9.425 -8.549 9.661 1.00 0.00 C ATOM 0 H VAL A 33 11.547 -6.874 8.388 1.00 0.00 H new ATOM 0 HA VAL A 33 9.424 -7.284 6.405 1.00 0.00 H new ATOM 0 HB VAL A 33 7.996 -8.288 8.069 1.00 0.00 H new ATOM 0 HG11 VAL A 33 8.965 -10.614 8.055 1.00 0.00 H new ATOM 0 HG12 VAL A 33 9.097 -9.802 6.477 1.00 0.00 H new ATOM 0 HG13 VAL A 33 10.522 -9.926 7.536 1.00 0.00 H new ATOM 0 HG21 VAL A 33 8.947 -9.426 10.097 1.00 0.00 H new ATOM 0 HG22 VAL A 33 10.506 -8.632 9.772 1.00 0.00 H new ATOM 0 HG23 VAL A 33 9.075 -7.653 10.174 1.00 0.00 H new ATOM 467 N ASP A 34 7.905 -5.631 7.627 1.00 0.00 N ATOM 468 CA ASP A 34 7.080 -4.477 7.980 1.00 0.00 C ATOM 469 C ASP A 34 7.844 -3.162 8.094 1.00 0.00 C ATOM 470 O ASP A 34 8.251 -2.769 9.185 1.00 0.00 O ATOM 471 CB ASP A 34 6.224 -4.731 9.228 1.00 0.00 C ATOM 472 CG ASP A 34 5.347 -3.502 9.560 1.00 0.00 C ATOM 473 OD1 ASP A 34 5.031 -2.699 8.650 1.00 0.00 O ATOM 474 OD2 ASP A 34 4.920 -3.377 10.731 1.00 0.00 O ATOM 0 H ASP A 34 7.398 -6.268 7.013 1.00 0.00 H new ATOM 0 HA ASP A 34 6.411 -4.355 7.128 1.00 0.00 H new ATOM 0 HB2 ASP A 34 5.589 -5.602 9.066 1.00 0.00 H new ATOM 0 HB3 ASP A 34 6.870 -4.960 10.075 1.00 0.00 H new ATOM 479 N THR A 35 7.976 -2.451 6.972 1.00 0.00 N ATOM 480 CA THR A 35 8.479 -1.091 6.922 1.00 0.00 C ATOM 481 C THR A 35 9.828 -0.893 7.643 1.00 0.00 C ATOM 482 O THR A 35 10.097 0.170 8.210 1.00 0.00 O ATOM 483 CB THR A 35 7.351 -0.128 7.344 1.00 0.00 C ATOM 484 OG1 THR A 35 6.051 -0.601 7.004 1.00 0.00 O ATOM 485 CG2 THR A 35 7.533 1.219 6.634 1.00 0.00 C ATOM 0 H THR A 35 7.728 -2.821 6.054 1.00 0.00 H new ATOM 0 HA THR A 35 8.749 -0.847 5.895 1.00 0.00 H new ATOM 0 HB THR A 35 7.420 -0.041 8.428 1.00 0.00 H new ATOM 0 HG1 THR A 35 5.791 -1.317 7.621 1.00 0.00 H new ATOM 0 HG21 THR A 35 6.735 1.899 6.933 1.00 0.00 H new ATOM 0 HG22 THR A 35 8.497 1.648 6.909 1.00 0.00 H new ATOM 0 HG23 THR A 35 7.497 1.069 5.555 1.00 0.00 H new ATOM 493 N SER A 36 10.687 -1.915 7.643 1.00 0.00 N ATOM 494 CA SER A 36 12.059 -1.767 8.080 1.00 0.00 C ATOM 495 C SER A 36 12.838 -1.070 6.961 1.00 0.00 C ATOM 496 O SER A 36 12.356 -0.948 5.827 1.00 0.00 O ATOM 497 CB SER A 36 12.662 -3.143 8.369 1.00 0.00 C ATOM 498 OG SER A 36 12.018 -3.750 9.464 1.00 0.00 O ATOM 0 H SER A 36 10.444 -2.858 7.341 1.00 0.00 H new ATOM 0 HA SER A 36 12.108 -1.175 8.994 1.00 0.00 H new ATOM 0 HB2 SER A 36 12.569 -3.778 7.488 1.00 0.00 H new ATOM 0 HB3 SER A 36 13.727 -3.042 8.578 1.00 0.00 H new ATOM 0 HG SER A 36 11.301 -4.333 9.139 1.00 0.00 H new ATOM 504 N ILE A 37 14.067 -0.655 7.255 1.00 0.00 N ATOM 505 CA ILE A 37 14.997 -0.176 6.249 1.00 0.00 C ATOM 506 C ILE A 37 16.402 -0.646 6.593 1.00 0.00 C ATOM 507 O ILE A 37 16.785 -0.590 7.763 1.00 0.00 O ATOM 508 CB ILE A 37 14.899 1.355 6.076 1.00 0.00 C ATOM 509 CG1 ILE A 37 15.825 1.836 4.934 1.00 0.00 C ATOM 510 CG2 ILE A 37 15.152 2.148 7.361 1.00 0.00 C ATOM 511 CD1 ILE A 37 15.497 3.245 4.423 1.00 0.00 C ATOM 0 H ILE A 37 14.443 -0.643 8.203 1.00 0.00 H new ATOM 0 HA ILE A 37 14.733 -0.599 5.280 1.00 0.00 H new ATOM 0 HB ILE A 37 13.862 1.559 5.809 1.00 0.00 H new ATOM 0 HG12 ILE A 37 16.857 1.818 5.284 1.00 0.00 H new ATOM 0 HG13 ILE A 37 15.757 1.133 4.103 1.00 0.00 H new ATOM 0 HG21 ILE A 37 15.065 3.215 7.154 1.00 0.00 H new ATOM 0 HG22 ILE A 37 14.418 1.863 8.115 1.00 0.00 H new ATOM 0 HG23 ILE A 37 16.154 1.931 7.731 1.00 0.00 H new ATOM 0 HD11 ILE A 37 16.188 3.512 3.624 1.00 0.00 H new ATOM 0 HD12 ILE A 37 14.476 3.265 4.042 1.00 0.00 H new ATOM 0 HD13 ILE A 37 15.593 3.960 5.240 1.00 0.00 H new ATOM 523 N CYS A 38 17.183 -1.042 5.587 1.00 0.00 N ATOM 524 CA CYS A 38 18.600 -1.312 5.741 1.00 0.00 C ATOM 525 C CYS A 38 19.365 -0.534 4.677 1.00 0.00 C ATOM 526 O CYS A 38 18.842 -0.282 3.585 1.00 0.00 O ATOM 527 CB CYS A 38 18.871 -2.824 5.682 1.00 0.00 C ATOM 528 SG CYS A 38 18.483 -3.648 4.116 1.00 0.00 S ATOM 0 H CYS A 38 16.840 -1.183 4.637 1.00 0.00 H new ATOM 0 HA CYS A 38 18.947 -0.979 6.719 1.00 0.00 H new ATOM 0 HB2 CYS A 38 19.925 -2.992 5.905 1.00 0.00 H new ATOM 0 HB3 CYS A 38 18.297 -3.306 6.474 1.00 0.00 H new ATOM 533 N THR A 39 20.614 -0.197 4.983 1.00 0.00 N ATOM 534 CA THR A 39 21.525 0.500 4.095 1.00 0.00 C ATOM 535 C THR A 39 22.899 -0.122 4.317 1.00 0.00 C ATOM 536 O THR A 39 23.483 0.056 5.383 1.00 0.00 O ATOM 537 CB THR A 39 21.509 2.012 4.403 1.00 0.00 C ATOM 538 OG1 THR A 39 20.193 2.531 4.343 1.00 0.00 O ATOM 539 CG2 THR A 39 22.376 2.813 3.424 1.00 0.00 C ATOM 0 H THR A 39 21.030 -0.411 5.889 1.00 0.00 H new ATOM 0 HA THR A 39 21.238 0.400 3.048 1.00 0.00 H new ATOM 0 HB THR A 39 21.914 2.116 5.410 1.00 0.00 H new ATOM 0 HG1 THR A 39 20.210 3.490 4.543 1.00 0.00 H new ATOM 0 HG21 THR A 39 22.333 3.871 3.682 1.00 0.00 H new ATOM 0 HG22 THR A 39 23.408 2.467 3.485 1.00 0.00 H new ATOM 0 HG23 THR A 39 22.005 2.671 2.409 1.00 0.00 H new ATOM 547 N ARG A 40 23.405 -0.883 3.340 1.00 0.00 N ATOM 548 CA ARG A 40 24.699 -1.575 3.396 1.00 0.00 C ATOM 549 C ARG A 40 24.862 -2.506 4.616 1.00 0.00 C ATOM 550 O ARG A 40 25.980 -2.932 4.907 1.00 0.00 O ATOM 551 CB ARG A 40 25.816 -0.517 3.193 1.00 0.00 C ATOM 552 CG ARG A 40 27.273 -1.005 3.103 1.00 0.00 C ATOM 553 CD ARG A 40 27.475 -2.217 2.178 1.00 0.00 C ATOM 554 NE ARG A 40 28.850 -2.738 2.256 1.00 0.00 N ATOM 555 CZ ARG A 40 29.341 -3.527 3.224 1.00 0.00 C ATOM 556 NH1 ARG A 40 28.601 -3.862 4.280 1.00 0.00 N ATOM 557 NH2 ARG A 40 30.587 -3.979 3.129 1.00 0.00 N ATOM 0 H ARG A 40 22.911 -1.039 2.462 1.00 0.00 H new ATOM 0 HA ARG A 40 24.772 -2.295 2.581 1.00 0.00 H new ATOM 0 HB2 ARG A 40 25.592 0.032 2.279 1.00 0.00 H new ATOM 0 HB3 ARG A 40 25.754 0.195 4.016 1.00 0.00 H new ATOM 0 HG2 ARG A 40 27.898 -0.185 2.750 1.00 0.00 H new ATOM 0 HG3 ARG A 40 27.620 -1.263 4.103 1.00 0.00 H new ATOM 0 HD2 ARG A 40 26.772 -3.004 2.450 1.00 0.00 H new ATOM 0 HD3 ARG A 40 27.252 -1.932 1.150 1.00 0.00 H new ATOM 0 HE ARG A 40 29.488 -2.475 1.505 1.00 0.00 H new ATOM 0 HH11 ARG A 40 27.644 -3.518 4.362 1.00 0.00 H new ATOM 0 HH12 ARG A 40 28.991 -4.463 5.006 1.00 0.00 H new ATOM 0 HH21 ARG A 40 31.162 -3.726 2.325 1.00 0.00 H new ATOM 0 HH22 ARG A 40 30.969 -4.579 3.860 1.00 0.00 H new ATOM 571 N SER A 41 23.785 -2.873 5.310 1.00 0.00 N ATOM 572 CA SER A 41 23.870 -3.774 6.453 1.00 0.00 C ATOM 573 C SER A 41 23.889 -5.227 5.965 1.00 0.00 C ATOM 574 O SER A 41 23.472 -5.529 4.842 1.00 0.00 O ATOM 575 CB SER A 41 22.716 -3.515 7.432 1.00 0.00 C ATOM 576 OG SER A 41 22.754 -2.168 7.876 1.00 0.00 O ATOM 0 H SER A 41 22.839 -2.556 5.097 1.00 0.00 H new ATOM 0 HA SER A 41 24.798 -3.586 6.994 1.00 0.00 H new ATOM 0 HB2 SER A 41 21.762 -3.720 6.946 1.00 0.00 H new ATOM 0 HB3 SER A 41 22.792 -4.190 8.284 1.00 0.00 H new ATOM 0 HG SER A 41 22.263 -2.088 8.720 1.00 0.00 H new ATOM 582 N GLN A 42 24.354 -6.123 6.830 1.00 0.00 N ATOM 583 CA GLN A 42 24.468 -7.554 6.597 1.00 0.00 C ATOM 584 C GLN A 42 23.575 -8.250 7.615 1.00 0.00 C ATOM 585 O GLN A 42 23.743 -8.023 8.812 1.00 0.00 O ATOM 586 CB GLN A 42 25.931 -7.977 6.764 1.00 0.00 C ATOM 587 CG GLN A 42 26.114 -9.488 6.555 1.00 0.00 C ATOM 588 CD GLN A 42 27.488 -9.796 5.964 1.00 0.00 C ATOM 589 OE1 GLN A 42 28.519 -9.639 6.614 1.00 0.00 O ATOM 590 NE2 GLN A 42 27.535 -10.201 4.706 1.00 0.00 N ATOM 0 H GLN A 42 24.677 -5.854 7.759 1.00 0.00 H new ATOM 0 HA GLN A 42 24.156 -7.824 5.588 1.00 0.00 H new ATOM 0 HB2 GLN A 42 26.550 -7.433 6.051 1.00 0.00 H new ATOM 0 HB3 GLN A 42 26.277 -7.703 7.761 1.00 0.00 H new ATOM 0 HG2 GLN A 42 25.999 -10.007 7.507 1.00 0.00 H new ATOM 0 HG3 GLN A 42 25.336 -9.864 5.891 1.00 0.00 H new ATOM 0 HE21 GLN A 42 26.671 -10.327 4.178 1.00 0.00 H new ATOM 0 HE22 GLN A 42 28.435 -10.387 4.263 1.00 0.00 H new ATOM 599 N TYR A 43 22.644 -9.089 7.166 1.00 0.00 N ATOM 600 CA TYR A 43 21.833 -9.943 8.022 1.00 0.00 C ATOM 601 C TYR A 43 22.227 -11.382 7.708 1.00 0.00 C ATOM 602 O TYR A 43 22.498 -11.716 6.549 1.00 0.00 O ATOM 603 CB TYR A 43 20.328 -9.781 7.759 1.00 0.00 C ATOM 604 CG TYR A 43 19.648 -8.436 7.944 1.00 0.00 C ATOM 605 CD1 TYR A 43 20.338 -7.263 8.318 1.00 0.00 C ATOM 606 CD2 TYR A 43 18.257 -8.373 7.733 1.00 0.00 C ATOM 607 CE1 TYR A 43 19.663 -6.038 8.413 1.00 0.00 C ATOM 608 CE2 TYR A 43 17.567 -7.161 7.873 1.00 0.00 C ATOM 609 CZ TYR A 43 18.272 -5.981 8.196 1.00 0.00 C ATOM 610 OH TYR A 43 17.619 -4.799 8.351 1.00 0.00 O ATOM 0 H TYR A 43 22.430 -9.194 6.174 1.00 0.00 H new ATOM 0 HA TYR A 43 22.010 -9.671 9.063 1.00 0.00 H new ATOM 0 HB2 TYR A 43 20.147 -10.093 6.730 1.00 0.00 H new ATOM 0 HB3 TYR A 43 19.812 -10.493 8.403 1.00 0.00 H new ATOM 0 HD1 TYR A 43 21.395 -7.310 8.533 1.00 0.00 H new ATOM 0 HD2 TYR A 43 17.717 -9.267 7.461 1.00 0.00 H new ATOM 0 HE1 TYR A 43 20.209 -5.138 8.653 1.00 0.00 H new ATOM 0 HE2 TYR A 43 16.496 -7.130 7.734 1.00 0.00 H new ATOM 0 HH TYR A 43 16.676 -4.971 8.554 1.00 0.00 H new ATOM 620 N SER A 44 22.244 -12.246 8.717 1.00 0.00 N ATOM 621 CA SER A 44 22.504 -13.665 8.555 1.00 0.00 C ATOM 622 C SER A 44 21.685 -14.427 9.598 1.00 0.00 C ATOM 623 O SER A 44 21.865 -14.231 10.802 1.00 0.00 O ATOM 624 CB SER A 44 24.009 -13.930 8.683 1.00 0.00 C ATOM 625 OG SER A 44 24.723 -13.195 7.699 1.00 0.00 O ATOM 0 H SER A 44 22.074 -11.972 9.685 1.00 0.00 H new ATOM 0 HA SER A 44 22.203 -14.011 7.566 1.00 0.00 H new ATOM 0 HB2 SER A 44 24.352 -13.647 9.678 1.00 0.00 H new ATOM 0 HB3 SER A 44 24.209 -14.995 8.568 1.00 0.00 H new ATOM 0 HG SER A 44 25.683 -13.371 7.792 1.00 0.00 H new ATOM 631 N ASP A 45 20.787 -15.291 9.119 1.00 0.00 N ATOM 632 CA ASP A 45 19.824 -16.071 9.898 1.00 0.00 C ATOM 633 C ASP A 45 19.097 -15.245 10.977 1.00 0.00 C ATOM 634 O ASP A 45 18.942 -15.683 12.118 1.00 0.00 O ATOM 635 CB ASP A 45 20.498 -17.343 10.437 1.00 0.00 C ATOM 636 CG ASP A 45 19.459 -18.361 10.932 1.00 0.00 C ATOM 637 OD1 ASP A 45 18.532 -18.684 10.158 1.00 0.00 O ATOM 638 OD2 ASP A 45 19.608 -18.904 12.052 1.00 0.00 O ATOM 0 H ASP A 45 20.708 -15.475 8.119 1.00 0.00 H new ATOM 0 HA ASP A 45 19.020 -16.382 9.231 1.00 0.00 H new ATOM 0 HB2 ASP A 45 21.107 -17.794 9.653 1.00 0.00 H new ATOM 0 HB3 ASP A 45 21.171 -17.082 11.253 1.00 0.00 H new ATOM 643 N ALA A 46 18.676 -14.023 10.629 1.00 0.00 N ATOM 644 CA ALA A 46 18.166 -13.010 11.551 1.00 0.00 C ATOM 645 C ALA A 46 16.790 -12.482 11.121 1.00 0.00 C ATOM 646 O ALA A 46 16.308 -12.775 10.026 1.00 0.00 O ATOM 647 CB ALA A 46 19.193 -11.870 11.608 1.00 0.00 C ATOM 0 H ALA A 46 18.683 -13.704 9.660 1.00 0.00 H new ATOM 0 HA ALA A 46 18.029 -13.454 12.537 1.00 0.00 H new ATOM 0 HB1 ALA A 46 18.840 -11.096 12.290 1.00 0.00 H new ATOM 0 HB2 ALA A 46 20.148 -12.258 11.962 1.00 0.00 H new ATOM 0 HB3 ALA A 46 19.321 -11.445 10.612 1.00 0.00 H new ATOM 653 N ASN A 47 16.154 -11.660 11.959 1.00 0.00 N ATOM 654 CA ASN A 47 14.879 -11.010 11.651 1.00 0.00 C ATOM 655 C ASN A 47 14.908 -9.572 12.140 1.00 0.00 C ATOM 656 O ASN A 47 15.408 -9.289 13.227 1.00 0.00 O ATOM 657 CB ASN A 47 13.709 -11.779 12.281 1.00 0.00 C ATOM 658 CG ASN A 47 12.437 -10.944 12.434 1.00 0.00 C ATOM 659 OD1 ASN A 47 11.989 -10.687 13.546 1.00 0.00 O ATOM 660 ND2 ASN A 47 11.829 -10.495 11.348 1.00 0.00 N ATOM 0 H ASN A 47 16.516 -11.424 12.883 1.00 0.00 H new ATOM 0 HA ASN A 47 14.732 -11.012 10.571 1.00 0.00 H new ATOM 0 HB2 ASN A 47 13.488 -12.653 11.668 1.00 0.00 H new ATOM 0 HB3 ASN A 47 14.013 -12.146 13.262 1.00 0.00 H new ATOM 0 HD21 ASN A 47 10.983 -9.932 11.433 1.00 0.00 H new ATOM 0 HD22 ASN A 47 12.206 -10.712 10.426 1.00 0.00 H new ATOM 667 N VAL A 48 14.352 -8.672 11.336 1.00 0.00 N ATOM 668 CA VAL A 48 14.318 -7.245 11.611 1.00 0.00 C ATOM 669 C VAL A 48 12.921 -6.742 11.250 1.00 0.00 C ATOM 670 O VAL A 48 12.435 -7.037 10.155 1.00 0.00 O ATOM 671 CB VAL A 48 15.450 -6.537 10.832 1.00 0.00 C ATOM 672 CG1 VAL A 48 15.458 -5.037 11.137 1.00 0.00 C ATOM 673 CG2 VAL A 48 16.838 -7.119 11.166 1.00 0.00 C ATOM 0 H VAL A 48 13.903 -8.923 10.455 1.00 0.00 H new ATOM 0 HA VAL A 48 14.498 -7.025 12.663 1.00 0.00 H new ATOM 0 HB VAL A 48 15.251 -6.703 9.773 1.00 0.00 H new ATOM 0 HG11 VAL A 48 16.262 -4.557 10.579 1.00 0.00 H new ATOM 0 HG12 VAL A 48 14.503 -4.601 10.845 1.00 0.00 H new ATOM 0 HG13 VAL A 48 15.615 -4.884 12.205 1.00 0.00 H new ATOM 0 HG21 VAL A 48 17.601 -6.590 10.595 1.00 0.00 H new ATOM 0 HG22 VAL A 48 17.035 -7.001 12.232 1.00 0.00 H new ATOM 0 HG23 VAL A 48 16.860 -8.178 10.908 1.00 0.00 H new ATOM 683 N LYS A 49 12.274 -6.012 12.166 1.00 0.00 N ATOM 684 CA LYS A 49 10.876 -5.603 12.044 1.00 0.00 C ATOM 685 C LYS A 49 10.735 -4.133 12.425 1.00 0.00 C ATOM 686 O LYS A 49 11.189 -3.727 13.501 1.00 0.00 O ATOM 687 CB LYS A 49 10.007 -6.524 12.916 1.00 0.00 C ATOM 688 CG LYS A 49 8.508 -6.189 12.820 1.00 0.00 C ATOM 689 CD LYS A 49 7.671 -7.173 13.646 1.00 0.00 C ATOM 690 CE LYS A 49 6.182 -6.811 13.549 1.00 0.00 C ATOM 691 NZ LYS A 49 5.326 -7.736 14.334 1.00 0.00 N ATOM 0 H LYS A 49 12.717 -5.685 13.025 1.00 0.00 H new ATOM 0 HA LYS A 49 10.534 -5.700 11.014 1.00 0.00 H new ATOM 0 HB2 LYS A 49 10.164 -7.559 12.613 1.00 0.00 H new ATOM 0 HB3 LYS A 49 10.328 -6.443 13.955 1.00 0.00 H new ATOM 0 HG2 LYS A 49 8.335 -5.173 13.174 1.00 0.00 H new ATOM 0 HG3 LYS A 49 8.190 -6.222 11.778 1.00 0.00 H new ATOM 0 HD2 LYS A 49 7.830 -8.189 13.286 1.00 0.00 H new ATOM 0 HD3 LYS A 49 7.992 -7.150 14.688 1.00 0.00 H new ATOM 0 HE2 LYS A 49 6.034 -5.792 13.905 1.00 0.00 H new ATOM 0 HE3 LYS A 49 5.873 -6.831 12.504 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 4.330 -7.453 14.238 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 5.446 -8.706 13.978 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 5.602 -7.698 15.336 1.00 0.00 H new ATOM 705 N LYS A 50 10.093 -3.353 11.552 1.00 0.00 N ATOM 706 CA LYS A 50 9.972 -1.897 11.586 1.00 0.00 C ATOM 707 C LYS A 50 11.184 -1.208 12.222 1.00 0.00 C ATOM 708 O LYS A 50 11.034 -0.421 13.157 1.00 0.00 O ATOM 709 CB LYS A 50 8.621 -1.505 12.217 1.00 0.00 C ATOM 710 CG LYS A 50 8.183 -0.092 11.795 1.00 0.00 C ATOM 711 CD LYS A 50 6.940 0.355 12.572 1.00 0.00 C ATOM 712 CE LYS A 50 6.465 1.723 12.062 1.00 0.00 C ATOM 713 NZ LYS A 50 5.251 2.199 12.771 1.00 0.00 N ATOM 0 H LYS A 50 9.611 -3.752 10.747 1.00 0.00 H new ATOM 0 HA LYS A 50 9.975 -1.523 10.562 1.00 0.00 H new ATOM 0 HB2 LYS A 50 7.859 -2.226 11.921 1.00 0.00 H new ATOM 0 HB3 LYS A 50 8.700 -1.552 13.303 1.00 0.00 H new ATOM 0 HG2 LYS A 50 8.997 0.612 11.969 1.00 0.00 H new ATOM 0 HG3 LYS A 50 7.972 -0.077 10.726 1.00 0.00 H new ATOM 0 HD2 LYS A 50 6.145 -0.381 12.457 1.00 0.00 H new ATOM 0 HD3 LYS A 50 7.168 0.414 13.636 1.00 0.00 H new ATOM 0 HE2 LYS A 50 7.265 2.452 12.187 1.00 0.00 H new ATOM 0 HE3 LYS A 50 6.257 1.658 10.994 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 4.969 3.126 12.392 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 4.478 1.518 12.631 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 5.455 2.288 13.787 1.00 0.00 H new ATOM 727 N SER A 51 12.390 -1.523 11.752 1.00 0.00 N ATOM 728 CA SER A 51 13.630 -1.028 12.337 1.00 0.00 C ATOM 729 C SER A 51 14.477 -0.385 11.247 1.00 0.00 C ATOM 730 O SER A 51 14.234 -0.593 10.058 1.00 0.00 O ATOM 731 CB SER A 51 14.367 -2.183 13.012 1.00 0.00 C ATOM 732 OG SER A 51 13.630 -2.694 14.107 1.00 0.00 O ATOM 0 H SER A 51 12.533 -2.134 10.948 1.00 0.00 H new ATOM 0 HA SER A 51 13.419 -0.273 13.094 1.00 0.00 H new ATOM 0 HB2 SER A 51 14.543 -2.978 12.287 1.00 0.00 H new ATOM 0 HB3 SER A 51 15.344 -1.843 13.356 1.00 0.00 H new ATOM 0 HG SER A 51 12.723 -2.922 13.813 1.00 0.00 H new ATOM 738 N VAL A 52 15.472 0.396 11.647 1.00 0.00 N ATOM 739 CA VAL A 52 16.270 1.233 10.767 1.00 0.00 C ATOM 740 C VAL A 52 17.710 0.773 10.942 1.00 0.00 C ATOM 741 O VAL A 52 18.172 0.663 12.080 1.00 0.00 O ATOM 742 CB VAL A 52 16.064 2.713 11.173 1.00 0.00 C ATOM 743 CG1 VAL A 52 16.915 3.681 10.336 1.00 0.00 C ATOM 744 CG2 VAL A 52 14.591 3.146 11.076 1.00 0.00 C ATOM 0 H VAL A 52 15.753 0.465 12.625 1.00 0.00 H new ATOM 0 HA VAL A 52 15.988 1.150 9.717 1.00 0.00 H new ATOM 0 HB VAL A 52 16.388 2.766 12.213 1.00 0.00 H new ATOM 0 HG11 VAL A 52 16.731 4.704 10.664 1.00 0.00 H new ATOM 0 HG12 VAL A 52 17.971 3.443 10.466 1.00 0.00 H new ATOM 0 HG13 VAL A 52 16.648 3.583 9.284 1.00 0.00 H new ATOM 0 HG21 VAL A 52 14.499 4.191 11.371 1.00 0.00 H new ATOM 0 HG22 VAL A 52 14.243 3.026 10.050 1.00 0.00 H new ATOM 0 HG23 VAL A 52 13.986 2.527 11.738 1.00 0.00 H new ATOM 754 N THR A 53 18.436 0.507 9.857 1.00 0.00 N ATOM 755 CA THR A 53 19.837 0.112 10.009 1.00 0.00 C ATOM 756 C THR A 53 20.721 0.653 8.892 1.00 0.00 C ATOM 757 O THR A 53 20.306 0.734 7.732 1.00 0.00 O ATOM 758 CB THR A 53 19.950 -1.403 10.271 1.00 0.00 C ATOM 759 OG1 THR A 53 21.299 -1.812 10.338 1.00 0.00 O ATOM 760 CG2 THR A 53 19.295 -2.310 9.247 1.00 0.00 C ATOM 0 H THR A 53 18.095 0.554 8.897 1.00 0.00 H new ATOM 0 HA THR A 53 20.243 0.590 10.900 1.00 0.00 H new ATOM 0 HB THR A 53 19.417 -1.515 11.215 1.00 0.00 H new ATOM 0 HG1 THR A 53 21.349 -2.788 10.266 1.00 0.00 H new ATOM 0 HG21 THR A 53 19.440 -3.351 9.537 1.00 0.00 H new ATOM 0 HG22 THR A 53 18.228 -2.092 9.198 1.00 0.00 H new ATOM 0 HG23 THR A 53 19.746 -2.140 8.269 1.00 0.00 H new ATOM 768 N THR A 54 21.943 1.034 9.266 1.00 0.00 N ATOM 769 CA THR A 54 22.973 1.525 8.374 1.00 0.00 C ATOM 770 C THR A 54 24.296 0.867 8.777 1.00 0.00 C ATOM 771 O THR A 54 24.784 1.076 9.893 1.00 0.00 O ATOM 772 CB THR A 54 23.046 3.062 8.444 1.00 0.00 C ATOM 773 OG1 THR A 54 21.777 3.651 8.212 1.00 0.00 O ATOM 774 CG2 THR A 54 24.018 3.634 7.406 1.00 0.00 C ATOM 0 H THR A 54 22.246 1.005 10.239 1.00 0.00 H new ATOM 0 HA THR A 54 22.749 1.268 7.339 1.00 0.00 H new ATOM 0 HB THR A 54 23.395 3.299 9.449 1.00 0.00 H new ATOM 0 HG1 THR A 54 21.855 4.627 8.264 1.00 0.00 H new ATOM 0 HG21 THR A 54 24.040 4.721 7.488 1.00 0.00 H new ATOM 0 HG22 THR A 54 25.017 3.236 7.585 1.00 0.00 H new ATOM 0 HG23 THR A 54 23.689 3.353 6.406 1.00 0.00 H new ATOM 782 N ASP A 55 24.882 0.116 7.842 1.00 0.00 N ATOM 783 CA ASP A 55 26.162 -0.580 7.946 1.00 0.00 C ATOM 784 C ASP A 55 26.323 -1.301 9.290 1.00 0.00 C ATOM 785 O ASP A 55 27.237 -1.014 10.068 1.00 0.00 O ATOM 786 CB ASP A 55 27.322 0.364 7.599 1.00 0.00 C ATOM 787 CG ASP A 55 28.687 -0.353 7.625 1.00 0.00 C ATOM 788 OD1 ASP A 55 28.782 -1.523 7.193 1.00 0.00 O ATOM 789 OD2 ASP A 55 29.693 0.280 8.025 1.00 0.00 O ATOM 0 H ASP A 55 24.444 -0.030 6.933 1.00 0.00 H new ATOM 0 HA ASP A 55 26.182 -1.377 7.203 1.00 0.00 H new ATOM 0 HB2 ASP A 55 27.157 0.791 6.610 1.00 0.00 H new ATOM 0 HB3 ASP A 55 27.336 1.194 8.306 1.00 0.00 H new ATOM 794 N CYS A 56 25.401 -2.228 9.569 1.00 0.00 N ATOM 795 CA CYS A 56 25.472 -3.109 10.728 1.00 0.00 C ATOM 796 C CYS A 56 25.653 -4.559 10.281 1.00 0.00 C ATOM 797 O CYS A 56 25.476 -4.872 9.102 1.00 0.00 O ATOM 798 CB CYS A 56 24.224 -2.961 11.610 1.00 0.00 C ATOM 799 SG CYS A 56 24.094 -1.403 12.529 1.00 0.00 S ATOM 0 H CYS A 56 24.578 -2.385 8.988 1.00 0.00 H new ATOM 0 HA CYS A 56 26.337 -2.820 11.325 1.00 0.00 H new ATOM 0 HB2 CYS A 56 23.341 -3.065 10.979 1.00 0.00 H new ATOM 0 HB3 CYS A 56 24.205 -3.785 12.323 1.00 0.00 H new ATOM 804 N ASN A 57 25.962 -5.458 11.219 1.00 0.00 N ATOM 805 CA ASN A 57 26.121 -6.887 10.971 1.00 0.00 C ATOM 806 C ASN A 57 25.249 -7.570 12.007 1.00 0.00 C ATOM 807 O ASN A 57 25.505 -7.428 13.199 1.00 0.00 O ATOM 808 CB ASN A 57 27.592 -7.296 11.115 1.00 0.00 C ATOM 809 CG ASN A 57 27.771 -8.813 11.148 1.00 0.00 C ATOM 810 OD1 ASN A 57 27.037 -9.560 10.509 1.00 0.00 O ATOM 811 ND2 ASN A 57 28.752 -9.293 11.894 1.00 0.00 N ATOM 0 H ASN A 57 26.112 -5.202 12.195 1.00 0.00 H new ATOM 0 HA ASN A 57 25.827 -7.167 9.960 1.00 0.00 H new ATOM 0 HB2 ASN A 57 28.165 -6.883 10.285 1.00 0.00 H new ATOM 0 HB3 ASN A 57 27.999 -6.864 12.029 1.00 0.00 H new ATOM 0 HD21 ASN A 57 28.908 -10.300 11.945 1.00 0.00 H new ATOM 0 HD22 ASN A 57 29.352 -8.657 12.418 1.00 0.00 H new ATOM 818 N ILE A 58 24.199 -8.248 11.567 1.00 0.00 N ATOM 819 CA ILE A 58 23.141 -8.762 12.420 1.00 0.00 C ATOM 820 C ILE A 58 23.092 -10.267 12.191 1.00 0.00 C ATOM 821 O ILE A 58 22.669 -10.728 11.130 1.00 0.00 O ATOM 822 CB ILE A 58 21.818 -8.017 12.105 1.00 0.00 C ATOM 823 CG1 ILE A 58 21.991 -6.492 12.341 1.00 0.00 C ATOM 824 CG2 ILE A 58 20.665 -8.592 12.946 1.00 0.00 C ATOM 825 CD1 ILE A 58 20.734 -5.648 12.104 1.00 0.00 C ATOM 0 H ILE A 58 24.057 -8.461 10.580 1.00 0.00 H new ATOM 0 HA ILE A 58 23.318 -8.588 13.481 1.00 0.00 H new ATOM 0 HB ILE A 58 21.567 -8.166 11.055 1.00 0.00 H new ATOM 0 HG12 ILE A 58 22.327 -6.335 13.366 1.00 0.00 H new ATOM 0 HG13 ILE A 58 22.783 -6.127 11.687 1.00 0.00 H new ATOM 0 HG21 ILE A 58 19.744 -8.058 12.713 1.00 0.00 H new ATOM 0 HG22 ILE A 58 20.540 -9.650 12.716 1.00 0.00 H new ATOM 0 HG23 ILE A 58 20.894 -8.475 14.005 1.00 0.00 H new ATOM 0 HD11 ILE A 58 20.959 -4.599 12.295 1.00 0.00 H new ATOM 0 HD12 ILE A 58 20.406 -5.766 11.071 1.00 0.00 H new ATOM 0 HD13 ILE A 58 19.942 -5.978 12.777 1.00 0.00 H new ATOM 837 N ASP A 59 23.545 -11.038 13.176 1.00 0.00 N ATOM 838 CA ASP A 59 23.752 -12.471 13.050 1.00 0.00 C ATOM 839 C ASP A 59 22.906 -13.176 14.100 1.00 0.00 C ATOM 840 O ASP A 59 22.981 -12.834 15.281 1.00 0.00 O ATOM 841 CB ASP A 59 25.242 -12.770 13.244 1.00 0.00 C ATOM 842 CG ASP A 59 25.488 -14.272 13.386 1.00 0.00 C ATOM 843 OD1 ASP A 59 25.406 -15.008 12.377 1.00 0.00 O ATOM 844 OD2 ASP A 59 25.784 -14.723 14.513 1.00 0.00 O ATOM 0 H ASP A 59 23.782 -10.674 14.099 1.00 0.00 H new ATOM 0 HA ASP A 59 23.453 -12.828 12.065 1.00 0.00 H new ATOM 0 HB2 ASP A 59 25.807 -12.384 12.395 1.00 0.00 H new ATOM 0 HB3 ASP A 59 25.607 -12.253 14.131 1.00 0.00 H new ATOM 849 N LYS A 60 22.084 -14.144 13.682 1.00 0.00 N ATOM 850 CA LYS A 60 21.270 -14.994 14.562 1.00 0.00 C ATOM 851 C LYS A 60 20.444 -14.187 15.581 1.00 0.00 C ATOM 852 O LYS A 60 20.223 -14.653 16.700 1.00 0.00 O ATOM 853 CB LYS A 60 22.166 -16.063 15.227 1.00 0.00 C ATOM 854 CG LYS A 60 22.920 -16.932 14.208 1.00 0.00 C ATOM 855 CD LYS A 60 23.907 -17.882 14.903 1.00 0.00 C ATOM 856 CE LYS A 60 24.888 -18.502 13.897 1.00 0.00 C ATOM 857 NZ LYS A 60 25.928 -17.540 13.453 1.00 0.00 N ATOM 0 H LYS A 60 21.962 -14.365 12.694 1.00 0.00 H new ATOM 0 HA LYS A 60 20.527 -15.504 13.949 1.00 0.00 H new ATOM 0 HB2 LYS A 60 22.887 -15.570 15.880 1.00 0.00 H new ATOM 0 HB3 LYS A 60 21.550 -16.704 15.858 1.00 0.00 H new ATOM 0 HG2 LYS A 60 22.206 -17.511 13.623 1.00 0.00 H new ATOM 0 HG3 LYS A 60 23.459 -16.292 13.510 1.00 0.00 H new ATOM 0 HD2 LYS A 60 24.462 -17.338 15.667 1.00 0.00 H new ATOM 0 HD3 LYS A 60 23.356 -18.673 15.412 1.00 0.00 H new ATOM 0 HE2 LYS A 60 25.369 -19.369 14.350 1.00 0.00 H new ATOM 0 HE3 LYS A 60 24.335 -18.861 13.029 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 26.575 -18.010 12.788 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 25.474 -16.732 12.981 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 26.464 -17.203 14.278 1.00 0.00 H new ATOM 871 N SER A 61 20.018 -12.974 15.218 1.00 0.00 N ATOM 872 CA SER A 61 19.414 -12.014 16.134 1.00 0.00 C ATOM 873 C SER A 61 18.015 -11.624 15.659 1.00 0.00 C ATOM 874 O SER A 61 17.665 -11.815 14.492 1.00 0.00 O ATOM 875 CB SER A 61 20.317 -10.777 16.246 1.00 0.00 C ATOM 876 OG SER A 61 21.575 -11.110 16.800 1.00 0.00 O ATOM 0 H SER A 61 20.086 -12.629 14.260 1.00 0.00 H new ATOM 0 HA SER A 61 19.315 -12.471 17.119 1.00 0.00 H new ATOM 0 HB2 SER A 61 20.457 -10.335 15.259 1.00 0.00 H new ATOM 0 HB3 SER A 61 19.831 -10.024 16.867 1.00 0.00 H new ATOM 0 HG SER A 61 22.077 -11.661 16.164 1.00 0.00 H new ATOM 882 N GLN A 62 17.229 -11.030 16.557 1.00 0.00 N ATOM 883 CA GLN A 62 15.906 -10.503 16.267 1.00 0.00 C ATOM 884 C GLN A 62 15.894 -9.037 16.689 1.00 0.00 C ATOM 885 O GLN A 62 16.456 -8.680 17.727 1.00 0.00 O ATOM 886 CB GLN A 62 14.812 -11.301 16.994 1.00 0.00 C ATOM 887 CG GLN A 62 14.686 -12.765 16.537 1.00 0.00 C ATOM 888 CD GLN A 62 15.703 -13.700 17.198 1.00 0.00 C ATOM 889 OE1 GLN A 62 16.561 -14.283 16.541 1.00 0.00 O ATOM 890 NE2 GLN A 62 15.628 -13.877 18.510 1.00 0.00 N ATOM 0 H GLN A 62 17.507 -10.901 17.530 1.00 0.00 H new ATOM 0 HA GLN A 62 15.692 -10.592 15.202 1.00 0.00 H new ATOM 0 HB2 GLN A 62 15.016 -11.283 18.065 1.00 0.00 H new ATOM 0 HB3 GLN A 62 13.855 -10.802 16.844 1.00 0.00 H new ATOM 0 HG2 GLN A 62 13.680 -13.121 16.758 1.00 0.00 H new ATOM 0 HG3 GLN A 62 14.811 -12.812 15.455 1.00 0.00 H new ATOM 0 HE21 GLN A 62 14.913 -13.390 19.050 1.00 0.00 H new ATOM 0 HE22 GLN A 62 16.285 -14.500 18.979 1.00 0.00 H new ATOM 899 N VAL A 63 15.263 -8.186 15.891 1.00 0.00 N ATOM 900 CA VAL A 63 15.321 -6.741 16.045 1.00 0.00 C ATOM 901 C VAL A 63 13.909 -6.216 15.809 1.00 0.00 C ATOM 902 O VAL A 63 13.294 -6.562 14.796 1.00 0.00 O ATOM 903 CB VAL A 63 16.328 -6.166 15.025 1.00 0.00 C ATOM 904 CG1 VAL A 63 16.491 -4.650 15.173 1.00 0.00 C ATOM 905 CG2 VAL A 63 17.714 -6.827 15.099 1.00 0.00 C ATOM 0 H VAL A 63 14.687 -8.487 15.105 1.00 0.00 H new ATOM 0 HA VAL A 63 15.659 -6.443 17.037 1.00 0.00 H new ATOM 0 HB VAL A 63 15.897 -6.393 14.050 1.00 0.00 H new ATOM 0 HG11 VAL A 63 17.208 -4.288 14.436 1.00 0.00 H new ATOM 0 HG12 VAL A 63 15.529 -4.163 15.013 1.00 0.00 H new ATOM 0 HG13 VAL A 63 16.852 -4.419 16.175 1.00 0.00 H new ATOM 0 HG21 VAL A 63 18.372 -6.376 14.356 1.00 0.00 H new ATOM 0 HG22 VAL A 63 18.135 -6.680 16.094 1.00 0.00 H new ATOM 0 HG23 VAL A 63 17.619 -7.894 14.900 1.00 0.00 H new ATOM 915 N TYR A 64 13.394 -5.381 16.712 1.00 0.00 N ATOM 916 CA TYR A 64 12.080 -4.766 16.558 1.00 0.00 C ATOM 917 C TYR A 64 12.149 -3.297 16.951 1.00 0.00 C ATOM 918 O TYR A 64 12.735 -2.968 17.983 1.00 0.00 O ATOM 919 CB TYR A 64 11.048 -5.517 17.416 1.00 0.00 C ATOM 920 CG TYR A 64 9.676 -4.861 17.468 1.00 0.00 C ATOM 921 CD1 TYR A 64 8.989 -4.553 16.277 1.00 0.00 C ATOM 922 CD2 TYR A 64 9.096 -4.529 18.709 1.00 0.00 C ATOM 923 CE1 TYR A 64 7.737 -3.915 16.321 1.00 0.00 C ATOM 924 CE2 TYR A 64 7.842 -3.895 18.763 1.00 0.00 C ATOM 925 CZ TYR A 64 7.156 -3.584 17.565 1.00 0.00 C ATOM 926 OH TYR A 64 5.939 -2.968 17.598 1.00 0.00 O ATOM 0 H TYR A 64 13.877 -5.114 17.569 1.00 0.00 H new ATOM 0 HA TYR A 64 11.769 -4.828 15.515 1.00 0.00 H new ATOM 0 HB2 TYR A 64 10.939 -6.529 17.027 1.00 0.00 H new ATOM 0 HB3 TYR A 64 11.434 -5.605 18.432 1.00 0.00 H new ATOM 0 HD1 TYR A 64 9.427 -4.809 15.324 1.00 0.00 H new ATOM 0 HD2 TYR A 64 9.618 -4.763 19.625 1.00 0.00 H new ATOM 0 HE1 TYR A 64 7.219 -3.678 15.403 1.00 0.00 H new ATOM 0 HE2 TYR A 64 7.403 -3.646 19.718 1.00 0.00 H new ATOM 0 HH TYR A 64 5.678 -2.809 18.529 1.00 0.00 H new ATOM 936 N LEU A 65 11.515 -2.415 16.169 1.00 0.00 N ATOM 937 CA LEU A 65 11.358 -0.997 16.464 1.00 0.00 C ATOM 938 C LEU A 65 12.664 -0.290 16.880 1.00 0.00 C ATOM 939 O LEU A 65 12.636 0.650 17.677 1.00 0.00 O ATOM 940 CB LEU A 65 10.218 -0.831 17.490 1.00 0.00 C ATOM 941 CG LEU A 65 9.407 0.434 17.174 1.00 0.00 C ATOM 942 CD1 LEU A 65 8.163 0.082 16.352 1.00 0.00 C ATOM 943 CD2 LEU A 65 8.994 1.169 18.452 1.00 0.00 C ATOM 0 H LEU A 65 11.085 -2.684 15.284 1.00 0.00 H new ATOM 0 HA LEU A 65 11.086 -0.484 15.541 1.00 0.00 H new ATOM 0 HB2 LEU A 65 9.567 -1.705 17.467 1.00 0.00 H new ATOM 0 HB3 LEU A 65 10.630 -0.766 18.497 1.00 0.00 H new ATOM 0 HG LEU A 65 10.047 1.097 16.591 1.00 0.00 H new ATOM 0 HD11 LEU A 65 7.600 0.990 16.137 1.00 0.00 H new ATOM 0 HD12 LEU A 65 8.466 -0.387 15.416 1.00 0.00 H new ATOM 0 HD13 LEU A 65 7.537 -0.608 16.917 1.00 0.00 H new ATOM 0 HD21 LEU A 65 8.422 2.059 18.191 1.00 0.00 H new ATOM 0 HD22 LEU A 65 8.381 0.511 19.068 1.00 0.00 H new ATOM 0 HD23 LEU A 65 9.885 1.461 19.008 1.00 0.00 H new ATOM 955 N THR A 66 13.809 -0.738 16.362 1.00 0.00 N ATOM 956 CA THR A 66 15.141 -0.344 16.814 1.00 0.00 C ATOM 957 C THR A 66 15.902 0.398 15.702 1.00 0.00 C ATOM 958 O THR A 66 15.519 0.342 14.531 1.00 0.00 O ATOM 959 CB THR A 66 15.820 -1.635 17.327 1.00 0.00 C ATOM 960 OG1 THR A 66 15.203 -2.013 18.545 1.00 0.00 O ATOM 961 CG2 THR A 66 17.330 -1.604 17.578 1.00 0.00 C ATOM 0 H THR A 66 13.834 -1.406 15.592 1.00 0.00 H new ATOM 0 HA THR A 66 15.115 0.380 17.629 1.00 0.00 H new ATOM 0 HB THR A 66 15.687 -2.336 16.503 1.00 0.00 H new ATOM 0 HG1 THR A 66 14.377 -2.505 18.354 1.00 0.00 H new ATOM 0 HG21 THR A 66 17.660 -2.580 17.934 1.00 0.00 H new ATOM 0 HG22 THR A 66 17.848 -1.362 16.650 1.00 0.00 H new ATOM 0 HG23 THR A 66 17.559 -0.848 18.329 1.00 0.00 H new ATOM 969 N THR A 67 16.985 1.093 16.059 1.00 0.00 N ATOM 970 CA THR A 67 17.850 1.812 15.127 1.00 0.00 C ATOM 971 C THR A 67 19.294 1.331 15.326 1.00 0.00 C ATOM 972 O THR A 67 19.748 1.208 16.463 1.00 0.00 O ATOM 973 CB THR A 67 17.689 3.327 15.346 1.00 0.00 C ATOM 974 OG1 THR A 67 16.326 3.701 15.230 1.00 0.00 O ATOM 975 CG2 THR A 67 18.490 4.156 14.334 1.00 0.00 C ATOM 0 H THR A 67 17.290 1.172 17.029 1.00 0.00 H new ATOM 0 HA THR A 67 17.573 1.609 14.093 1.00 0.00 H new ATOM 0 HB THR A 67 18.068 3.531 16.347 1.00 0.00 H new ATOM 0 HG1 THR A 67 16.238 4.667 15.373 1.00 0.00 H new ATOM 0 HG21 THR A 67 18.341 5.217 14.534 1.00 0.00 H new ATOM 0 HG22 THR A 67 19.549 3.915 14.424 1.00 0.00 H new ATOM 0 HG23 THR A 67 18.150 3.925 13.324 1.00 0.00 H new ATOM 983 N CYS A 68 20.025 1.075 14.238 1.00 0.00 N ATOM 984 CA CYS A 68 21.375 0.524 14.268 1.00 0.00 C ATOM 985 C CYS A 68 22.271 1.336 13.337 1.00 0.00 C ATOM 986 O CYS A 68 21.936 1.518 12.164 1.00 0.00 O ATOM 987 CB CYS A 68 21.323 -0.949 13.833 1.00 0.00 C ATOM 988 SG CYS A 68 22.855 -1.882 14.084 1.00 0.00 S ATOM 0 H CYS A 68 19.684 1.250 13.293 1.00 0.00 H new ATOM 0 HA CYS A 68 21.786 0.578 15.276 1.00 0.00 H new ATOM 0 HB2 CYS A 68 20.521 -1.445 14.380 1.00 0.00 H new ATOM 0 HB3 CYS A 68 21.061 -0.990 12.776 1.00 0.00 H new ATOM 993 N THR A 69 23.419 1.794 13.838 1.00 0.00 N ATOM 994 CA THR A 69 24.408 2.510 13.044 1.00 0.00 C ATOM 995 C THR A 69 25.790 1.987 13.435 1.00 0.00 C ATOM 996 O THR A 69 26.148 2.032 14.616 1.00 0.00 O ATOM 997 CB THR A 69 24.281 4.028 13.291 1.00 0.00 C ATOM 998 OG1 THR A 69 22.939 4.469 13.174 1.00 0.00 O ATOM 999 CG2 THR A 69 25.122 4.836 12.296 1.00 0.00 C ATOM 0 H THR A 69 23.687 1.675 14.815 1.00 0.00 H new ATOM 0 HA THR A 69 24.250 2.344 11.978 1.00 0.00 H new ATOM 0 HB THR A 69 24.641 4.194 14.306 1.00 0.00 H new ATOM 0 HG1 THR A 69 22.896 5.434 13.338 1.00 0.00 H new ATOM 0 HG21 THR A 69 25.007 5.900 12.502 1.00 0.00 H new ATOM 0 HG22 THR A 69 26.171 4.559 12.397 1.00 0.00 H new ATOM 0 HG23 THR A 69 24.787 4.625 11.281 1.00 0.00 H new ATOM 1007 N GLY A 70 26.566 1.493 12.464 1.00 0.00 N ATOM 1008 CA GLY A 70 27.961 1.095 12.666 1.00 0.00 C ATOM 1009 C GLY A 70 28.138 0.128 13.840 1.00 0.00 C ATOM 1010 O GLY A 70 29.095 0.252 14.604 1.00 0.00 O ATOM 0 H GLY A 70 26.239 1.357 11.507 1.00 0.00 H new ATOM 0 HA2 GLY A 70 28.336 0.627 11.756 1.00 0.00 H new ATOM 0 HA3 GLY A 70 28.566 1.985 12.840 1.00 0.00 H new ATOM 1014 N SER A 71 27.191 -0.792 14.019 1.00 0.00 N ATOM 1015 CA SER A 71 27.068 -1.652 15.186 1.00 0.00 C ATOM 1016 C SER A 71 26.896 -3.101 14.730 1.00 0.00 C ATOM 1017 O SER A 71 26.702 -3.368 13.544 1.00 0.00 O ATOM 1018 CB SER A 71 25.881 -1.155 16.024 1.00 0.00 C ATOM 1019 OG SER A 71 26.184 0.101 16.602 1.00 0.00 O ATOM 0 H SER A 71 26.462 -0.962 13.326 1.00 0.00 H new ATOM 0 HA SER A 71 27.964 -1.615 15.806 1.00 0.00 H new ATOM 0 HB2 SER A 71 24.993 -1.071 15.397 1.00 0.00 H new ATOM 0 HB3 SER A 71 25.651 -1.878 16.807 1.00 0.00 H new ATOM 0 HG SER A 71 26.175 0.792 15.907 1.00 0.00 H new ATOM 1025 N GLN A 72 26.975 -4.059 15.650 1.00 0.00 N ATOM 1026 CA GLN A 72 26.815 -5.468 15.324 1.00 0.00 C ATOM 1027 C GLN A 72 25.932 -6.109 16.377 1.00 0.00 C ATOM 1028 O GLN A 72 26.035 -5.753 17.551 1.00 0.00 O ATOM 1029 CB GLN A 72 28.166 -6.202 15.250 1.00 0.00 C ATOM 1030 CG GLN A 72 29.218 -5.523 14.364 1.00 0.00 C ATOM 1031 CD GLN A 72 30.406 -6.456 14.131 1.00 0.00 C ATOM 1032 OE1 GLN A 72 30.369 -7.326 13.264 1.00 0.00 O ATOM 1033 NE2 GLN A 72 31.468 -6.319 14.907 1.00 0.00 N ATOM 0 H GLN A 72 27.151 -3.878 16.638 1.00 0.00 H new ATOM 0 HA GLN A 72 26.356 -5.546 14.338 1.00 0.00 H new ATOM 0 HB2 GLN A 72 28.568 -6.297 16.259 1.00 0.00 H new ATOM 0 HB3 GLN A 72 27.995 -7.212 14.878 1.00 0.00 H new ATOM 0 HG2 GLN A 72 28.773 -5.246 13.408 1.00 0.00 H new ATOM 0 HG3 GLN A 72 29.559 -4.601 14.836 1.00 0.00 H new ATOM 0 HE21 GLN A 72 31.486 -5.593 15.623 1.00 0.00 H new ATOM 0 HE22 GLN A 72 32.269 -6.940 14.789 1.00 0.00 H new ATOM 1042 N TYR A 73 25.126 -7.083 15.968 1.00 0.00 N ATOM 1043 CA TYR A 73 24.307 -7.897 16.851 1.00 0.00 C ATOM 1044 C TYR A 73 24.678 -9.346 16.557 1.00 0.00 C ATOM 1045 O TYR A 73 24.690 -9.735 15.389 1.00 0.00 O ATOM 1046 CB TYR A 73 22.811 -7.678 16.563 1.00 0.00 C ATOM 1047 CG TYR A 73 22.233 -6.272 16.675 1.00 0.00 C ATOM 1048 CD1 TYR A 73 22.797 -5.288 17.512 1.00 0.00 C ATOM 1049 CD2 TYR A 73 21.076 -5.957 15.935 1.00 0.00 C ATOM 1050 CE1 TYR A 73 22.243 -3.997 17.567 1.00 0.00 C ATOM 1051 CE2 TYR A 73 20.506 -4.676 15.995 1.00 0.00 C ATOM 1052 CZ TYR A 73 21.093 -3.684 16.806 1.00 0.00 C ATOM 1053 OH TYR A 73 20.536 -2.446 16.845 1.00 0.00 O ATOM 0 H TYR A 73 25.024 -7.333 14.984 1.00 0.00 H new ATOM 0 HA TYR A 73 24.482 -7.635 17.894 1.00 0.00 H new ATOM 0 HB2 TYR A 73 22.615 -8.034 15.552 1.00 0.00 H new ATOM 0 HB3 TYR A 73 22.248 -8.320 17.241 1.00 0.00 H new ATOM 0 HD1 TYR A 73 23.660 -5.527 18.115 1.00 0.00 H new ATOM 0 HD2 TYR A 73 20.621 -6.713 15.312 1.00 0.00 H new ATOM 0 HE1 TYR A 73 22.697 -3.242 18.192 1.00 0.00 H new ATOM 0 HE2 TYR A 73 19.619 -4.451 15.421 1.00 0.00 H new ATOM 0 HH TYR A 73 21.040 -1.880 17.466 1.00 0.00 H new ATOM 1063 N ASN A 74 24.963 -10.152 17.578 1.00 0.00 N ATOM 1064 CA ASN A 74 25.157 -11.593 17.430 1.00 0.00 C ATOM 1065 C ASN A 74 24.373 -12.306 18.529 1.00 0.00 C ATOM 1066 O ASN A 74 24.693 -12.156 19.708 1.00 0.00 O ATOM 1067 CB ASN A 74 26.653 -11.954 17.495 1.00 0.00 C ATOM 1068 CG ASN A 74 26.889 -13.397 17.953 1.00 0.00 C ATOM 1069 OD1 ASN A 74 27.373 -13.633 19.055 1.00 0.00 O ATOM 1070 ND2 ASN A 74 26.554 -14.399 17.158 1.00 0.00 N ATOM 0 H ASN A 74 25.066 -9.821 18.537 1.00 0.00 H new ATOM 0 HA ASN A 74 24.790 -11.914 16.455 1.00 0.00 H new ATOM 0 HB2 ASN A 74 27.101 -11.810 16.512 1.00 0.00 H new ATOM 0 HB3 ASN A 74 27.159 -11.272 18.179 1.00 0.00 H new ATOM 0 HD21 ASN A 74 26.698 -15.362 17.462 1.00 0.00 H new ATOM 0 HD22 ASN A 74 26.151 -14.209 16.240 1.00 0.00 H new ATOM 1077 N GLY A 75 23.371 -13.102 18.160 1.00 0.00 N ATOM 1078 CA GLY A 75 22.574 -13.870 19.106 1.00 0.00 C ATOM 1079 C GLY A 75 21.870 -13.000 20.148 1.00 0.00 C ATOM 1080 O GLY A 75 21.926 -13.332 21.336 1.00 0.00 O ATOM 0 H GLY A 75 23.090 -13.231 17.188 1.00 0.00 H new ATOM 0 HA2 GLY A 75 21.827 -14.446 18.559 1.00 0.00 H new ATOM 0 HA3 GLY A 75 23.218 -14.587 19.616 1.00 0.00 H new ATOM 1084 N ILE A 76 21.232 -11.893 19.753 1.00 0.00 N ATOM 1085 CA ILE A 76 20.499 -11.029 20.685 1.00 0.00 C ATOM 1086 C ILE A 76 19.059 -10.839 20.194 1.00 0.00 C ATOM 1087 O ILE A 76 18.773 -11.004 19.008 1.00 0.00 O ATOM 1088 CB ILE A 76 21.242 -9.686 20.947 1.00 0.00 C ATOM 1089 CG1 ILE A 76 20.857 -8.570 19.949 1.00 0.00 C ATOM 1090 CG2 ILE A 76 22.776 -9.863 21.002 1.00 0.00 C ATOM 1091 CD1 ILE A 76 21.601 -7.245 20.165 1.00 0.00 C ATOM 0 H ILE A 76 21.209 -11.572 18.785 1.00 0.00 H new ATOM 0 HA ILE A 76 20.453 -11.520 21.657 1.00 0.00 H new ATOM 0 HB ILE A 76 20.905 -9.363 21.932 1.00 0.00 H new ATOM 0 HG12 ILE A 76 21.052 -8.922 18.936 1.00 0.00 H new ATOM 0 HG13 ILE A 76 19.785 -8.387 20.022 1.00 0.00 H new ATOM 0 HG21 ILE A 76 23.247 -8.898 21.187 1.00 0.00 H new ATOM 0 HG22 ILE A 76 23.034 -10.553 21.806 1.00 0.00 H new ATOM 0 HG23 ILE A 76 23.130 -10.264 20.052 1.00 0.00 H new ATOM 0 HD11 ILE A 76 21.272 -6.518 19.423 1.00 0.00 H new ATOM 0 HD12 ILE A 76 21.387 -6.866 21.164 1.00 0.00 H new ATOM 0 HD13 ILE A 76 22.674 -7.409 20.061 1.00 0.00 H new ATOM 1103 N TYR A 77 18.160 -10.426 21.085 1.00 0.00 N ATOM 1104 CA TYR A 77 16.813 -9.997 20.743 1.00 0.00 C ATOM 1105 C TYR A 77 16.668 -8.587 21.310 1.00 0.00 C ATOM 1106 O TYR A 77 16.639 -8.410 22.527 1.00 0.00 O ATOM 1107 CB TYR A 77 15.788 -11.005 21.282 1.00 0.00 C ATOM 1108 CG TYR A 77 14.331 -10.844 20.855 1.00 0.00 C ATOM 1109 CD1 TYR A 77 13.870 -9.766 20.065 1.00 0.00 C ATOM 1110 CD2 TYR A 77 13.407 -11.815 21.291 1.00 0.00 C ATOM 1111 CE1 TYR A 77 12.511 -9.662 19.719 1.00 0.00 C ATOM 1112 CE2 TYR A 77 12.046 -11.715 20.951 1.00 0.00 C ATOM 1113 CZ TYR A 77 11.590 -10.639 20.157 1.00 0.00 C ATOM 1114 OH TYR A 77 10.269 -10.553 19.833 1.00 0.00 O ATOM 0 H TYR A 77 18.356 -10.381 22.085 1.00 0.00 H new ATOM 0 HA TYR A 77 16.630 -9.966 19.669 1.00 0.00 H new ATOM 0 HB2 TYR A 77 16.114 -12.003 20.987 1.00 0.00 H new ATOM 0 HB3 TYR A 77 15.823 -10.967 22.371 1.00 0.00 H new ATOM 0 HD1 TYR A 77 14.568 -9.016 19.724 1.00 0.00 H new ATOM 0 HD2 TYR A 77 13.748 -12.645 21.893 1.00 0.00 H new ATOM 0 HE1 TYR A 77 12.171 -8.833 19.117 1.00 0.00 H new ATOM 0 HE2 TYR A 77 11.348 -12.462 21.298 1.00 0.00 H new ATOM 0 HH TYR A 77 9.787 -11.313 20.220 1.00 0.00 H new ATOM 1124 N ILE A 78 16.645 -7.582 20.437 1.00 0.00 N ATOM 1125 CA ILE A 78 16.691 -6.174 20.815 1.00 0.00 C ATOM 1126 C ILE A 78 15.399 -5.492 20.361 1.00 0.00 C ATOM 1127 O ILE A 78 14.937 -5.713 19.235 1.00 0.00 O ATOM 1128 CB ILE A 78 17.998 -5.523 20.302 1.00 0.00 C ATOM 1129 CG1 ILE A 78 18.032 -4.028 20.680 1.00 0.00 C ATOM 1130 CG2 ILE A 78 18.233 -5.731 18.794 1.00 0.00 C ATOM 1131 CD1 ILE A 78 19.415 -3.382 20.528 1.00 0.00 C ATOM 0 H ILE A 78 16.593 -7.728 19.429 1.00 0.00 H new ATOM 0 HA ILE A 78 16.729 -6.053 21.898 1.00 0.00 H new ATOM 0 HB ILE A 78 18.824 -6.033 20.798 1.00 0.00 H new ATOM 0 HG12 ILE A 78 17.319 -3.489 20.056 1.00 0.00 H new ATOM 0 HG13 ILE A 78 17.701 -3.916 21.712 1.00 0.00 H new ATOM 0 HG21 ILE A 78 19.166 -5.249 18.501 1.00 0.00 H new ATOM 0 HG22 ILE A 78 18.292 -6.798 18.579 1.00 0.00 H new ATOM 0 HG23 ILE A 78 17.407 -5.293 18.233 1.00 0.00 H new ATOM 0 HD11 ILE A 78 19.359 -2.331 20.812 1.00 0.00 H new ATOM 0 HD12 ILE A 78 20.129 -3.895 21.173 1.00 0.00 H new ATOM 0 HD13 ILE A 78 19.741 -3.461 19.491 1.00 0.00 H new ATOM 1143 N ARG A 79 14.795 -4.682 21.239 1.00 0.00 N ATOM 1144 CA ARG A 79 13.498 -4.066 20.976 1.00 0.00 C ATOM 1145 C ARG A 79 13.463 -2.617 21.443 1.00 0.00 C ATOM 1146 O ARG A 79 13.971 -2.292 22.523 1.00 0.00 O ATOM 1147 CB ARG A 79 12.371 -4.926 21.577 1.00 0.00 C ATOM 1148 CG ARG A 79 12.408 -5.038 23.112 1.00 0.00 C ATOM 1149 CD ARG A 79 11.570 -6.209 23.642 1.00 0.00 C ATOM 1150 NE ARG A 79 12.107 -7.527 23.242 1.00 0.00 N ATOM 1151 CZ ARG A 79 13.151 -8.159 23.800 1.00 0.00 C ATOM 1152 NH1 ARG A 79 13.891 -7.596 24.743 1.00 0.00 N ATOM 1153 NH2 ARG A 79 13.474 -9.391 23.432 1.00 0.00 N ATOM 0 H ARG A 79 15.193 -4.439 22.146 1.00 0.00 H new ATOM 0 HA ARG A 79 13.334 -4.030 19.899 1.00 0.00 H new ATOM 0 HB2 ARG A 79 11.411 -4.506 21.278 1.00 0.00 H new ATOM 0 HB3 ARG A 79 12.427 -5.927 21.150 1.00 0.00 H new ATOM 0 HG2 ARG A 79 13.441 -5.159 23.438 1.00 0.00 H new ATOM 0 HG3 ARG A 79 12.043 -4.109 23.549 1.00 0.00 H new ATOM 0 HD2 ARG A 79 11.526 -6.155 24.730 1.00 0.00 H new ATOM 0 HD3 ARG A 79 10.548 -6.113 23.277 1.00 0.00 H new ATOM 0 HE ARG A 79 11.640 -8.001 22.469 1.00 0.00 H new ATOM 0 HH11 ARG A 79 13.674 -6.653 25.067 1.00 0.00 H new ATOM 0 HH12 ARG A 79 14.678 -8.105 25.146 1.00 0.00 H new ATOM 0 HH21 ARG A 79 12.927 -9.870 22.717 1.00 0.00 H new ATOM 0 HH22 ARG A 79 14.270 -9.860 23.864 1.00 0.00 H new ATOM 1167 N SER A 80 12.833 -1.760 20.642 1.00 0.00 N ATOM 1168 CA SER A 80 12.589 -0.353 20.941 1.00 0.00 C ATOM 1169 C SER A 80 13.862 0.404 21.365 1.00 0.00 C ATOM 1170 O SER A 80 13.791 1.297 22.212 1.00 0.00 O ATOM 1171 CB SER A 80 11.457 -0.270 21.976 1.00 0.00 C ATOM 1172 OG SER A 80 10.321 -1.003 21.536 1.00 0.00 O ATOM 0 H SER A 80 12.465 -2.039 19.732 1.00 0.00 H new ATOM 0 HA SER A 80 12.275 0.159 20.031 1.00 0.00 H new ATOM 0 HB2 SER A 80 11.802 -0.663 22.932 1.00 0.00 H new ATOM 0 HB3 SER A 80 11.183 0.772 22.140 1.00 0.00 H new ATOM 0 HG SER A 80 9.611 -0.940 22.208 1.00 0.00 H new ATOM 1178 N SER A 81 15.024 0.054 20.803 1.00 0.00 N ATOM 1179 CA SER A 81 16.328 0.525 21.262 1.00 0.00 C ATOM 1180 C SER A 81 17.110 1.238 20.149 1.00 0.00 C ATOM 1181 O SER A 81 16.628 1.389 19.026 1.00 0.00 O ATOM 1182 CB SER A 81 17.088 -0.679 21.833 1.00 0.00 C ATOM 1183 OG SER A 81 16.432 -1.186 22.983 1.00 0.00 O ATOM 0 H SER A 81 15.082 -0.576 20.003 1.00 0.00 H new ATOM 0 HA SER A 81 16.197 1.276 22.041 1.00 0.00 H new ATOM 0 HB2 SER A 81 17.163 -1.460 21.077 1.00 0.00 H new ATOM 0 HB3 SER A 81 18.106 -0.385 22.089 1.00 0.00 H new ATOM 0 HG SER A 81 15.520 -1.457 22.747 1.00 0.00 H new ATOM 1189 N THR A 82 18.315 1.727 20.441 1.00 0.00 N ATOM 1190 CA THR A 82 19.199 2.364 19.473 1.00 0.00 C ATOM 1191 C THR A 82 20.649 2.036 19.842 1.00 0.00 C ATOM 1192 O THR A 82 21.014 2.079 21.018 1.00 0.00 O ATOM 1193 CB THR A 82 18.908 3.877 19.455 1.00 0.00 C ATOM 1194 OG1 THR A 82 17.599 4.108 18.967 1.00 0.00 O ATOM 1195 CG2 THR A 82 19.875 4.680 18.575 1.00 0.00 C ATOM 0 H THR A 82 18.710 1.689 21.381 1.00 0.00 H new ATOM 0 HA THR A 82 19.028 1.990 18.463 1.00 0.00 H new ATOM 0 HB THR A 82 19.028 4.213 20.485 1.00 0.00 H new ATOM 0 HG1 THR A 82 17.418 5.071 18.959 1.00 0.00 H new ATOM 0 HG21 THR A 82 19.608 5.736 18.612 1.00 0.00 H new ATOM 0 HG22 THR A 82 20.893 4.550 18.941 1.00 0.00 H new ATOM 0 HG23 THR A 82 19.811 4.325 17.546 1.00 0.00 H new ATOM 1203 N THR A 83 21.483 1.720 18.853 1.00 0.00 N ATOM 1204 CA THR A 83 22.865 1.301 19.063 1.00 0.00 C ATOM 1205 C THR A 83 23.744 1.981 18.011 1.00 0.00 C ATOM 1206 O THR A 83 23.423 1.942 16.816 1.00 0.00 O ATOM 1207 CB THR A 83 22.946 -0.235 19.003 1.00 0.00 C ATOM 1208 OG1 THR A 83 22.317 -0.716 17.832 1.00 0.00 O ATOM 1209 CG2 THR A 83 22.251 -0.896 20.199 1.00 0.00 C ATOM 0 H THR A 83 21.213 1.749 17.870 1.00 0.00 H new ATOM 0 HA THR A 83 23.227 1.602 20.046 1.00 0.00 H new ATOM 0 HB THR A 83 24.006 -0.487 19.013 1.00 0.00 H new ATOM 0 HG1 THR A 83 22.860 -1.430 17.439 1.00 0.00 H new ATOM 0 HG21 THR A 83 22.333 -1.980 20.114 1.00 0.00 H new ATOM 0 HG22 THR A 83 22.726 -0.567 21.123 1.00 0.00 H new ATOM 0 HG23 THR A 83 21.199 -0.612 20.211 1.00 0.00 H new ATOM 1217 N THR A 84 24.824 2.625 18.454 1.00 0.00 N ATOM 1218 CA THR A 84 25.683 3.451 17.622 1.00 0.00 C ATOM 1219 C THR A 84 27.138 3.132 17.974 1.00 0.00 C ATOM 1220 O THR A 84 27.574 3.371 19.104 1.00 0.00 O ATOM 1221 CB THR A 84 25.340 4.936 17.850 1.00 0.00 C ATOM 1222 OG1 THR A 84 23.951 5.174 17.692 1.00 0.00 O ATOM 1223 CG2 THR A 84 26.085 5.850 16.870 1.00 0.00 C ATOM 0 H THR A 84 25.129 2.582 19.426 1.00 0.00 H new ATOM 0 HA THR A 84 25.530 3.243 16.563 1.00 0.00 H new ATOM 0 HB THR A 84 25.648 5.163 18.871 1.00 0.00 H new ATOM 0 HG1 THR A 84 23.762 6.124 17.844 1.00 0.00 H new ATOM 0 HG21 THR A 84 25.816 6.888 17.064 1.00 0.00 H new ATOM 0 HG22 THR A 84 27.160 5.724 17.000 1.00 0.00 H new ATOM 0 HG23 THR A 84 25.810 5.589 15.848 1.00 0.00 H new ATOM 1231 N GLY A 85 27.907 2.624 17.008 1.00 0.00 N ATOM 1232 CA GLY A 85 29.311 2.291 17.212 1.00 0.00 C ATOM 1233 C GLY A 85 29.489 1.200 18.269 1.00 0.00 C ATOM 1234 O GLY A 85 30.330 1.357 19.156 1.00 0.00 O ATOM 0 H GLY A 85 27.570 2.434 16.064 1.00 0.00 H new ATOM 0 HA2 GLY A 85 29.746 1.958 16.270 1.00 0.00 H new ATOM 0 HA3 GLY A 85 29.856 3.185 17.517 1.00 0.00 H new ATOM 1238 N THR A 86 28.695 0.129 18.224 1.00 0.00 N ATOM 1239 CA THR A 86 28.629 -0.860 19.298 1.00 0.00 C ATOM 1240 C THR A 86 28.506 -2.280 18.738 1.00 0.00 C ATOM 1241 O THR A 86 27.504 -2.613 18.111 1.00 0.00 O ATOM 1242 CB THR A 86 27.441 -0.517 20.228 1.00 0.00 C ATOM 1243 OG1 THR A 86 26.349 0.095 19.560 1.00 0.00 O ATOM 1244 CG2 THR A 86 27.863 0.449 21.325 1.00 0.00 C ATOM 0 H THR A 86 28.078 -0.076 17.438 1.00 0.00 H new ATOM 0 HA THR A 86 29.554 -0.827 19.873 1.00 0.00 H new ATOM 0 HB THR A 86 27.127 -1.481 20.628 1.00 0.00 H new ATOM 0 HG1 THR A 86 26.396 -0.108 18.602 1.00 0.00 H new ATOM 0 HG21 THR A 86 27.007 0.672 21.963 1.00 0.00 H new ATOM 0 HG22 THR A 86 28.654 -0.003 21.924 1.00 0.00 H new ATOM 0 HG23 THR A 86 28.230 1.372 20.876 1.00 0.00 H new ATOM 1252 N SER A 87 29.507 -3.133 18.954 1.00 0.00 N ATOM 1253 CA SER A 87 29.384 -4.557 18.660 1.00 0.00 C ATOM 1254 C SER A 87 28.813 -5.223 19.911 1.00 0.00 C ATOM 1255 O SER A 87 29.311 -4.963 21.006 1.00 0.00 O ATOM 1256 CB SER A 87 30.753 -5.130 18.291 1.00 0.00 C ATOM 1257 OG SER A 87 31.246 -4.483 17.127 1.00 0.00 O ATOM 0 H SER A 87 30.414 -2.860 19.333 1.00 0.00 H new ATOM 0 HA SER A 87 28.724 -4.737 17.811 1.00 0.00 H new ATOM 0 HB2 SER A 87 31.450 -4.993 19.118 1.00 0.00 H new ATOM 0 HB3 SER A 87 30.673 -6.203 18.116 1.00 0.00 H new ATOM 0 HG SER A 87 32.219 -4.588 17.082 1.00 0.00 H new ATOM 1263 N ILE A 88 27.770 -6.043 19.774 1.00 0.00 N ATOM 1264 CA ILE A 88 26.990 -6.583 20.882 1.00 0.00 C ATOM 1265 C ILE A 88 26.718 -8.059 20.569 1.00 0.00 C ATOM 1266 O ILE A 88 26.272 -8.401 19.468 1.00 0.00 O ATOM 1267 CB ILE A 88 25.670 -5.780 21.047 1.00 0.00 C ATOM 1268 CG1 ILE A 88 25.891 -4.250 21.152 1.00 0.00 C ATOM 1269 CG2 ILE A 88 24.901 -6.287 22.275 1.00 0.00 C ATOM 1270 CD1 ILE A 88 24.602 -3.432 21.282 1.00 0.00 C ATOM 0 H ILE A 88 27.437 -6.357 18.862 1.00 0.00 H new ATOM 0 HA ILE A 88 27.531 -6.500 21.825 1.00 0.00 H new ATOM 0 HB ILE A 88 25.086 -5.947 20.142 1.00 0.00 H new ATOM 0 HG12 ILE A 88 26.525 -4.045 22.014 1.00 0.00 H new ATOM 0 HG13 ILE A 88 26.434 -3.912 20.269 1.00 0.00 H new ATOM 0 HG21 ILE A 88 23.977 -5.720 22.385 1.00 0.00 H new ATOM 0 HG22 ILE A 88 24.665 -7.343 22.146 1.00 0.00 H new ATOM 0 HG23 ILE A 88 25.514 -6.158 23.167 1.00 0.00 H new ATOM 0 HD11 ILE A 88 24.849 -2.372 21.350 1.00 0.00 H new ATOM 0 HD12 ILE A 88 23.973 -3.603 20.408 1.00 0.00 H new ATOM 0 HD13 ILE A 88 24.066 -3.738 22.180 1.00 0.00 H new ATOM 1282 N SER A 89 26.949 -8.927 21.551 1.00 0.00 N ATOM 1283 CA SER A 89 26.857 -10.370 21.411 1.00 0.00 C ATOM 1284 C SER A 89 26.177 -10.963 22.647 1.00 0.00 C ATOM 1285 O SER A 89 26.307 -10.420 23.745 1.00 0.00 O ATOM 1286 CB SER A 89 28.268 -10.953 21.248 1.00 0.00 C ATOM 1287 OG SER A 89 28.960 -10.353 20.161 1.00 0.00 O ATOM 0 H SER A 89 27.213 -8.633 22.491 1.00 0.00 H new ATOM 0 HA SER A 89 26.264 -10.619 20.531 1.00 0.00 H new ATOM 0 HB2 SER A 89 28.833 -10.802 22.168 1.00 0.00 H new ATOM 0 HB3 SER A 89 28.201 -12.029 21.088 1.00 0.00 H new ATOM 0 HG SER A 89 29.855 -10.746 20.086 1.00 0.00 H new ATOM 1321 N CYS A 93 20.965 -13.172 24.317 1.00 0.00 N ATOM 1322 CA CYS A 93 20.831 -11.887 24.990 1.00 0.00 C ATOM 1323 C CYS A 93 19.455 -11.273 24.697 1.00 0.00 C ATOM 1324 O CYS A 93 18.858 -11.545 23.652 1.00 0.00 O ATOM 1325 CB CYS A 93 21.970 -10.958 24.551 1.00 0.00 C ATOM 1326 SG CYS A 93 21.767 -9.214 24.997 1.00 0.00 S ATOM 0 HA CYS A 93 20.902 -12.029 26.068 1.00 0.00 H new ATOM 0 HB2 CYS A 93 22.901 -11.321 24.987 1.00 0.00 H new ATOM 0 HB3 CYS A 93 22.077 -11.028 23.469 1.00 0.00 H new ATOM 1331 N SER A 94 19.000 -10.372 25.566 1.00 0.00 N ATOM 1332 CA SER A 94 17.822 -9.547 25.370 1.00 0.00 C ATOM 1333 C SER A 94 18.196 -8.097 25.707 1.00 0.00 C ATOM 1334 O SER A 94 18.938 -7.864 26.665 1.00 0.00 O ATOM 1335 CB SER A 94 16.705 -10.093 26.265 1.00 0.00 C ATOM 1336 OG SER A 94 15.425 -9.761 25.754 1.00 0.00 O ATOM 0 H SER A 94 19.463 -10.194 26.457 1.00 0.00 H new ATOM 0 HA SER A 94 17.464 -9.569 24.341 1.00 0.00 H new ATOM 0 HB2 SER A 94 16.797 -11.176 26.345 1.00 0.00 H new ATOM 0 HB3 SER A 94 16.813 -9.689 27.272 1.00 0.00 H new ATOM 0 HG SER A 94 14.849 -9.457 26.486 1.00 0.00 H new ATOM 1342 N ILE A 95 17.694 -7.123 24.942 1.00 0.00 N ATOM 1343 CA ILE A 95 17.871 -5.690 25.189 1.00 0.00 C ATOM 1344 C ILE A 95 16.518 -5.028 24.924 1.00 0.00 C ATOM 1345 O ILE A 95 15.881 -5.330 23.913 1.00 0.00 O ATOM 1346 CB ILE A 95 18.992 -5.087 24.295 1.00 0.00 C ATOM 1347 CG1 ILE A 95 20.360 -5.731 24.617 1.00 0.00 C ATOM 1348 CG2 ILE A 95 19.053 -3.549 24.428 1.00 0.00 C ATOM 1349 CD1 ILE A 95 21.579 -5.113 23.915 1.00 0.00 C ATOM 0 H ILE A 95 17.137 -7.316 24.110 1.00 0.00 H new ATOM 0 HA ILE A 95 18.190 -5.513 26.216 1.00 0.00 H new ATOM 0 HB ILE A 95 18.749 -5.315 23.257 1.00 0.00 H new ATOM 0 HG12 ILE A 95 20.520 -5.677 25.694 1.00 0.00 H new ATOM 0 HG13 ILE A 95 20.312 -6.788 24.355 1.00 0.00 H new ATOM 0 HG21 ILE A 95 19.847 -3.160 23.790 1.00 0.00 H new ATOM 0 HG22 ILE A 95 18.099 -3.119 24.123 1.00 0.00 H new ATOM 0 HG23 ILE A 95 19.256 -3.281 25.465 1.00 0.00 H new ATOM 0 HD11 ILE A 95 22.481 -5.645 24.217 1.00 0.00 H new ATOM 0 HD12 ILE A 95 21.455 -5.191 22.835 1.00 0.00 H new ATOM 0 HD13 ILE A 95 21.666 -4.063 24.195 1.00 0.00 H new ATOM 1361 N SER A 96 16.107 -4.093 25.777 1.00 0.00 N ATOM 1362 CA SER A 96 14.867 -3.354 25.606 1.00 0.00 C ATOM 1363 C SER A 96 15.056 -1.886 25.960 1.00 0.00 C ATOM 1364 O SER A 96 15.775 -1.557 26.911 1.00 0.00 O ATOM 1365 CB SER A 96 13.775 -3.920 26.519 1.00 0.00 C ATOM 1366 OG SER A 96 13.552 -5.302 26.316 1.00 0.00 O ATOM 0 H SER A 96 16.631 -3.828 26.611 1.00 0.00 H new ATOM 0 HA SER A 96 14.575 -3.450 24.560 1.00 0.00 H new ATOM 0 HB2 SER A 96 14.054 -3.751 27.559 1.00 0.00 H new ATOM 0 HB3 SER A 96 12.846 -3.377 26.346 1.00 0.00 H new ATOM 0 HG SER A 96 12.848 -5.612 26.923 1.00 0.00 H new ATOM 1372 N THR A 97 14.333 -1.041 25.217 1.00 0.00 N ATOM 1373 CA THR A 97 14.143 0.382 25.483 1.00 0.00 C ATOM 1374 C THR A 97 15.427 1.123 25.896 1.00 0.00 C ATOM 1375 O THR A 97 15.411 1.906 26.847 1.00 0.00 O ATOM 1376 CB THR A 97 12.958 0.559 26.462 1.00 0.00 C ATOM 1377 OG1 THR A 97 13.028 -0.319 27.572 1.00 0.00 O ATOM 1378 CG2 THR A 97 11.614 0.277 25.792 1.00 0.00 C ATOM 0 H THR A 97 13.844 -1.348 24.376 1.00 0.00 H new ATOM 0 HA THR A 97 13.884 0.875 24.546 1.00 0.00 H new ATOM 0 HB THR A 97 13.031 1.597 26.787 1.00 0.00 H new ATOM 0 HG1 THR A 97 13.689 0.016 28.213 1.00 0.00 H new ATOM 0 HG21 THR A 97 10.811 0.413 26.516 1.00 0.00 H new ATOM 0 HG22 THR A 97 11.472 0.965 24.958 1.00 0.00 H new ATOM 0 HG23 THR A 97 11.600 -0.749 25.423 1.00 0.00 H new ATOM 1386 N CYS A 98 16.547 0.879 25.205 1.00 0.00 N ATOM 1387 CA CYS A 98 17.845 1.423 25.587 1.00 0.00 C ATOM 1388 C CYS A 98 18.489 2.171 24.425 1.00 0.00 C ATOM 1389 O CYS A 98 18.218 1.869 23.265 1.00 0.00 O ATOM 1390 CB CYS A 98 18.750 0.278 26.062 1.00 0.00 C ATOM 1391 SG CYS A 98 20.235 0.802 26.963 1.00 0.00 S ATOM 0 H CYS A 98 16.573 0.299 24.367 1.00 0.00 H new ATOM 0 HA CYS A 98 17.706 2.137 26.399 1.00 0.00 H new ATOM 0 HB2 CYS A 98 18.168 -0.384 26.704 1.00 0.00 H new ATOM 0 HB3 CYS A 98 19.056 -0.307 25.195 1.00 0.00 H new ATOM 1396 N THR A 99 19.390 3.101 24.727 1.00 0.00 N ATOM 1397 CA THR A 99 20.239 3.741 23.737 1.00 0.00 C ATOM 1398 C THR A 99 21.671 3.490 24.197 1.00 0.00 C ATOM 1399 O THR A 99 21.967 3.606 25.389 1.00 0.00 O ATOM 1400 CB THR A 99 19.875 5.228 23.603 1.00 0.00 C ATOM 1401 OG1 THR A 99 18.516 5.363 23.224 1.00 0.00 O ATOM 1402 CG2 THR A 99 20.730 5.948 22.554 1.00 0.00 C ATOM 0 H THR A 99 19.550 3.433 25.678 1.00 0.00 H new ATOM 0 HA THR A 99 20.107 3.335 22.734 1.00 0.00 H new ATOM 0 HB THR A 99 20.060 5.682 24.577 1.00 0.00 H new ATOM 0 HG1 THR A 99 18.292 6.314 23.143 1.00 0.00 H new ATOM 0 HG21 THR A 99 20.433 6.995 22.499 1.00 0.00 H new ATOM 0 HG22 THR A 99 21.781 5.884 22.835 1.00 0.00 H new ATOM 0 HG23 THR A 99 20.585 5.478 21.581 1.00 0.00 H new ATOM 1410 N ILE A 100 22.557 3.110 23.276 1.00 0.00 N ATOM 1411 CA ILE A 100 23.941 2.779 23.580 1.00 0.00 C ATOM 1412 C ILE A 100 24.788 3.436 22.493 1.00 0.00 C ATOM 1413 O ILE A 100 24.506 3.269 21.305 1.00 0.00 O ATOM 1414 CB ILE A 100 24.168 1.243 23.654 1.00 0.00 C ATOM 1415 CG1 ILE A 100 23.024 0.479 24.368 1.00 0.00 C ATOM 1416 CG2 ILE A 100 25.508 0.962 24.364 1.00 0.00 C ATOM 1417 CD1 ILE A 100 23.223 -1.041 24.449 1.00 0.00 C ATOM 0 H ILE A 100 22.326 3.024 22.286 1.00 0.00 H new ATOM 0 HA ILE A 100 24.223 3.151 24.565 1.00 0.00 H new ATOM 0 HB ILE A 100 24.186 0.875 22.628 1.00 0.00 H new ATOM 0 HG12 ILE A 100 22.918 0.873 25.379 1.00 0.00 H new ATOM 0 HG13 ILE A 100 22.089 0.682 23.847 1.00 0.00 H new ATOM 0 HG21 ILE A 100 25.672 -0.114 24.419 1.00 0.00 H new ATOM 0 HG22 ILE A 100 26.321 1.425 23.804 1.00 0.00 H new ATOM 0 HG23 ILE A 100 25.480 1.376 25.372 1.00 0.00 H new ATOM 0 HD11 ILE A 100 22.375 -1.492 24.964 1.00 0.00 H new ATOM 0 HD12 ILE A 100 23.297 -1.452 23.442 1.00 0.00 H new ATOM 0 HD13 ILE A 100 24.139 -1.259 24.998 1.00 0.00 H new ATOM 1429 N THR A 101 25.827 4.168 22.896 1.00 0.00 N ATOM 1430 CA THR A 101 26.750 4.831 21.986 1.00 0.00 C ATOM 1431 C THR A 101 28.161 4.492 22.459 1.00 0.00 C ATOM 1432 O THR A 101 28.490 4.738 23.619 1.00 0.00 O ATOM 1433 CB THR A 101 26.480 6.347 21.967 1.00 0.00 C ATOM 1434 OG1 THR A 101 25.119 6.608 21.671 1.00 0.00 O ATOM 1435 CG2 THR A 101 27.333 7.069 20.916 1.00 0.00 C ATOM 0 H THR A 101 26.051 4.317 23.880 1.00 0.00 H new ATOM 0 HA THR A 101 26.622 4.489 20.959 1.00 0.00 H new ATOM 0 HB THR A 101 26.738 6.718 22.959 1.00 0.00 H new ATOM 0 HG1 THR A 101 24.965 7.576 21.665 1.00 0.00 H new ATOM 0 HG21 THR A 101 27.110 8.136 20.937 1.00 0.00 H new ATOM 0 HG22 THR A 101 28.389 6.914 21.136 1.00 0.00 H new ATOM 0 HG23 THR A 101 27.106 6.671 19.927 1.00 0.00 H new ATOM 1443 N ARG A 102 28.978 3.897 21.579 1.00 0.00 N ATOM 1444 CA ARG A 102 30.348 3.439 21.852 1.00 0.00 C ATOM 1445 C ARG A 102 30.492 2.814 23.249 1.00 0.00 C ATOM 1446 O ARG A 102 31.355 3.203 24.036 1.00 0.00 O ATOM 1447 CB ARG A 102 31.365 4.554 21.542 1.00 0.00 C ATOM 1448 CG ARG A 102 31.346 4.940 20.050 1.00 0.00 C ATOM 1449 CD ARG A 102 32.506 5.873 19.680 1.00 0.00 C ATOM 1450 NE ARG A 102 33.800 5.165 19.682 1.00 0.00 N ATOM 1451 CZ ARG A 102 34.980 5.630 20.103 1.00 0.00 C ATOM 1452 NH1 ARG A 102 35.111 6.853 20.612 1.00 0.00 N ATOM 1453 NH2 ARG A 102 36.028 4.828 19.996 1.00 0.00 N ATOM 0 H ARG A 102 28.691 3.714 20.618 1.00 0.00 H new ATOM 0 HA ARG A 102 30.580 2.620 21.172 1.00 0.00 H new ATOM 0 HB2 ARG A 102 31.140 5.431 22.148 1.00 0.00 H new ATOM 0 HB3 ARG A 102 32.365 4.222 21.820 1.00 0.00 H new ATOM 0 HG2 ARG A 102 31.400 4.037 19.442 1.00 0.00 H new ATOM 0 HG3 ARG A 102 30.400 5.427 19.814 1.00 0.00 H new ATOM 0 HD2 ARG A 102 32.328 6.301 18.694 1.00 0.00 H new ATOM 0 HD3 ARG A 102 32.544 6.703 20.386 1.00 0.00 H new ATOM 0 HE ARG A 102 33.793 4.211 19.321 1.00 0.00 H new ATOM 0 HH11 ARG A 102 34.297 7.463 20.689 1.00 0.00 H new ATOM 0 HH12 ARG A 102 36.025 7.180 20.925 1.00 0.00 H new ATOM 0 HH21 ARG A 102 35.917 3.893 19.604 1.00 0.00 H new ATOM 0 HH22 ARG A 102 36.947 5.145 20.306 1.00 0.00 H new ATOM 1467 N GLY A 103 29.617 1.853 23.563 1.00 0.00 N ATOM 1468 CA GLY A 103 29.678 1.055 24.785 1.00 0.00 C ATOM 1469 C GLY A 103 29.040 1.722 26.007 1.00 0.00 C ATOM 1470 O GLY A 103 28.905 1.064 27.039 1.00 0.00 O ATOM 0 H GLY A 103 28.832 1.606 22.961 1.00 0.00 H new ATOM 0 HA2 GLY A 103 29.182 0.101 24.607 1.00 0.00 H new ATOM 0 HA3 GLY A 103 30.722 0.835 25.009 1.00 0.00 H new ATOM 1474 N VAL A 104 28.621 2.988 25.919 1.00 0.00 N ATOM 1475 CA VAL A 104 28.007 3.720 27.019 1.00 0.00 C ATOM 1476 C VAL A 104 26.493 3.665 26.805 1.00 0.00 C ATOM 1477 O VAL A 104 25.977 4.268 25.860 1.00 0.00 O ATOM 1478 CB VAL A 104 28.559 5.164 27.074 1.00 0.00 C ATOM 1479 CG1 VAL A 104 28.000 5.930 28.282 1.00 0.00 C ATOM 1480 CG2 VAL A 104 30.097 5.181 27.168 1.00 0.00 C ATOM 0 H VAL A 104 28.703 3.538 25.064 1.00 0.00 H new ATOM 0 HA VAL A 104 28.245 3.276 27.985 1.00 0.00 H new ATOM 0 HB VAL A 104 28.243 5.647 26.149 1.00 0.00 H new ATOM 0 HG11 VAL A 104 28.407 6.941 28.292 1.00 0.00 H new ATOM 0 HG12 VAL A 104 26.913 5.977 28.212 1.00 0.00 H new ATOM 0 HG13 VAL A 104 28.282 5.416 29.201 1.00 0.00 H new ATOM 0 HG21 VAL A 104 30.448 6.212 27.205 1.00 0.00 H new ATOM 0 HG22 VAL A 104 30.412 4.658 28.071 1.00 0.00 H new ATOM 0 HG23 VAL A 104 30.520 4.685 26.295 1.00 0.00 H new ATOM 1490 N ALA A 105 25.785 2.904 27.646 1.00 0.00 N ATOM 1491 CA ALA A 105 24.326 2.935 27.694 1.00 0.00 C ATOM 1492 C ALA A 105 23.889 4.261 28.325 1.00 0.00 C ATOM 1493 O ALA A 105 24.559 4.767 29.231 1.00 0.00 O ATOM 1494 CB ALA A 105 23.802 1.748 28.508 1.00 0.00 C ATOM 0 H ALA A 105 26.208 2.253 28.308 1.00 0.00 H new ATOM 0 HA ALA A 105 23.915 2.858 26.687 1.00 0.00 H new ATOM 0 HB1 ALA A 105 22.713 1.780 28.538 1.00 0.00 H new ATOM 0 HB2 ALA A 105 24.125 0.817 28.043 1.00 0.00 H new ATOM 0 HB3 ALA A 105 24.195 1.801 29.523 1.00 0.00 H new ATOM 1548 N ALA A 110 14.992 3.339 31.433 1.00 0.00 N ATOM 1549 CA ALA A 110 14.274 2.421 30.556 1.00 0.00 C ATOM 1550 C ALA A 110 15.208 1.342 29.989 1.00 0.00 C ATOM 1551 O ALA A 110 14.730 0.259 29.648 1.00 0.00 O ATOM 1552 CB ALA A 110 13.615 3.221 29.427 1.00 0.00 C ATOM 0 HA ALA A 110 13.506 1.907 31.134 1.00 0.00 H new ATOM 0 HB1 ALA A 110 13.076 2.542 28.767 1.00 0.00 H new ATOM 0 HB2 ALA A 110 12.918 3.943 29.852 1.00 0.00 H new ATOM 0 HB3 ALA A 110 14.382 3.747 28.859 1.00 0.00 H new ATOM 1558 N CYS A 111 16.517 1.613 29.917 1.00 0.00 N ATOM 1559 CA CYS A 111 17.526 0.650 29.495 1.00 0.00 C ATOM 1560 C CYS A 111 17.408 -0.639 30.308 1.00 0.00 C ATOM 1561 O CYS A 111 17.579 -0.618 31.530 1.00 0.00 O ATOM 1562 CB CYS A 111 18.938 1.239 29.673 1.00 0.00 C ATOM 1563 SG CYS A 111 19.586 2.213 28.293 1.00 0.00 S ATOM 0 H CYS A 111 16.905 2.525 30.156 1.00 0.00 H new ATOM 0 HA CYS A 111 17.361 0.425 28.441 1.00 0.00 H new ATOM 0 HB2 CYS A 111 18.936 1.868 30.563 1.00 0.00 H new ATOM 0 HB3 CYS A 111 19.629 0.418 29.865 1.00 0.00 H new ATOM 1568 N LYS A 112 17.187 -1.764 29.623 1.00 0.00 N ATOM 1569 CA LYS A 112 17.254 -3.104 30.196 1.00 0.00 C ATOM 1570 C LYS A 112 18.109 -3.937 29.251 1.00 0.00 C ATOM 1571 O LYS A 112 17.926 -3.861 28.035 1.00 0.00 O ATOM 1572 CB LYS A 112 15.838 -3.689 30.337 1.00 0.00 C ATOM 1573 CG LYS A 112 15.018 -2.990 31.439 1.00 0.00 C ATOM 1574 CD LYS A 112 13.546 -3.437 31.465 1.00 0.00 C ATOM 1575 CE LYS A 112 12.758 -3.010 30.215 1.00 0.00 C ATOM 1576 NZ LYS A 112 12.581 -1.539 30.114 1.00 0.00 N ATOM 0 H LYS A 112 16.951 -1.764 28.631 1.00 0.00 H new ATOM 0 HA LYS A 112 17.692 -3.094 31.194 1.00 0.00 H new ATOM 0 HB2 LYS A 112 15.314 -3.598 29.386 1.00 0.00 H new ATOM 0 HB3 LYS A 112 15.909 -4.753 30.561 1.00 0.00 H new ATOM 0 HG2 LYS A 112 15.472 -3.196 32.408 1.00 0.00 H new ATOM 0 HG3 LYS A 112 15.062 -1.911 31.289 1.00 0.00 H new ATOM 0 HD2 LYS A 112 13.505 -4.522 31.559 1.00 0.00 H new ATOM 0 HD3 LYS A 112 13.063 -3.022 32.350 1.00 0.00 H new ATOM 0 HE2 LYS A 112 13.276 -3.370 29.326 1.00 0.00 H new ATOM 0 HE3 LYS A 112 11.778 -3.488 30.229 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 12.681 -1.245 29.122 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 11.635 -1.279 30.459 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 13.303 -1.062 30.691 1.00 0.00 H new ATOM 1590 N ILE A 113 19.047 -4.705 29.801 1.00 0.00 N ATOM 1591 CA ILE A 113 19.993 -5.544 29.075 1.00 0.00 C ATOM 1592 C ILE A 113 20.118 -6.816 29.918 1.00 0.00 C ATOM 1593 O ILE A 113 20.246 -6.728 31.145 1.00 0.00 O ATOM 1594 CB ILE A 113 21.359 -4.817 28.908 1.00 0.00 C ATOM 1595 CG1 ILE A 113 21.221 -3.533 28.055 1.00 0.00 C ATOM 1596 CG2 ILE A 113 22.418 -5.754 28.291 1.00 0.00 C ATOM 1597 CD1 ILE A 113 22.508 -2.713 27.890 1.00 0.00 C ATOM 0 H ILE A 113 19.173 -4.761 30.812 1.00 0.00 H new ATOM 0 HA ILE A 113 19.659 -5.772 28.063 1.00 0.00 H new ATOM 0 HB ILE A 113 21.690 -4.528 29.905 1.00 0.00 H new ATOM 0 HG12 ILE A 113 20.858 -3.811 27.066 1.00 0.00 H new ATOM 0 HG13 ILE A 113 20.460 -2.897 28.507 1.00 0.00 H new ATOM 0 HG21 ILE A 113 23.361 -5.218 28.187 1.00 0.00 H new ATOM 0 HG22 ILE A 113 22.561 -6.618 28.940 1.00 0.00 H new ATOM 0 HG23 ILE A 113 22.080 -6.089 27.310 1.00 0.00 H new ATOM 0 HD11 ILE A 113 22.304 -1.835 27.277 1.00 0.00 H new ATOM 0 HD12 ILE A 113 22.866 -2.396 28.870 1.00 0.00 H new ATOM 0 HD13 ILE A 113 23.270 -3.325 27.406 1.00 0.00 H new ATOM 1609 N SER A 114 20.112 -7.979 29.268 1.00 0.00 N ATOM 1610 CA SER A 114 20.179 -9.283 29.911 1.00 0.00 C ATOM 1611 C SER A 114 21.051 -10.199 29.053 1.00 0.00 C ATOM 1612 O SER A 114 20.756 -10.397 27.874 1.00 0.00 O ATOM 1613 CB SER A 114 18.762 -9.861 30.051 1.00 0.00 C ATOM 1614 OG SER A 114 17.896 -8.978 30.752 1.00 0.00 O ATOM 0 H SER A 114 20.059 -8.038 28.251 1.00 0.00 H new ATOM 0 HA SER A 114 20.613 -9.196 30.907 1.00 0.00 H new ATOM 0 HB2 SER A 114 18.352 -10.061 29.061 1.00 0.00 H new ATOM 0 HB3 SER A 114 18.809 -10.815 30.575 1.00 0.00 H new ATOM 0 HG SER A 114 17.004 -9.379 30.819 1.00 0.00 H new ATOM 1620 N GLY A 115 22.112 -10.760 29.635 1.00 0.00 N ATOM 1621 CA GLY A 115 22.909 -11.815 29.013 1.00 0.00 C ATOM 1622 C GLY A 115 23.800 -11.353 27.857 1.00 0.00 C ATOM 1623 O GLY A 115 24.232 -12.199 27.071 1.00 0.00 O ATOM 0 H GLY A 115 22.444 -10.491 30.561 1.00 0.00 H new ATOM 0 HA2 GLY A 115 23.538 -12.273 29.776 1.00 0.00 H new ATOM 0 HA3 GLY A 115 22.236 -12.590 28.647 1.00 0.00 H new ATOM 1627 N CYS A 116 24.073 -10.049 27.721 1.00 0.00 N ATOM 1628 CA CYS A 116 24.930 -9.521 26.661 1.00 0.00 C ATOM 1629 C CYS A 116 26.363 -9.272 27.137 1.00 0.00 C ATOM 1630 O CYS A 116 26.640 -9.131 28.330 1.00 0.00 O ATOM 1631 CB CYS A 116 24.366 -8.201 26.113 1.00 0.00 C ATOM 1632 SG CYS A 116 23.517 -8.340 24.528 1.00 0.00 S ATOM 0 H CYS A 116 23.703 -9.332 28.346 1.00 0.00 H new ATOM 0 HA CYS A 116 24.950 -10.281 25.880 1.00 0.00 H new ATOM 0 HB2 CYS A 116 23.673 -7.787 26.845 1.00 0.00 H new ATOM 0 HB3 CYS A 116 25.184 -7.488 26.010 1.00 0.00 H new ATOM 1637 N SER A 117 27.235 -9.122 26.144 1.00 0.00 N ATOM 1638 CA SER A 117 28.612 -8.665 26.209 1.00 0.00 C ATOM 1639 C SER A 117 28.759 -7.714 25.016 1.00 0.00 C ATOM 1640 O SER A 117 28.144 -7.949 23.971 1.00 0.00 O ATOM 1641 CB SER A 117 29.567 -9.859 26.080 1.00 0.00 C ATOM 1642 OG SER A 117 29.344 -10.815 27.107 1.00 0.00 O ATOM 0 H SER A 117 26.965 -9.339 25.185 1.00 0.00 H new ATOM 0 HA SER A 117 28.851 -8.174 27.152 1.00 0.00 H new ATOM 0 HB2 SER A 117 29.433 -10.331 25.107 1.00 0.00 H new ATOM 0 HB3 SER A 117 30.598 -9.509 26.125 1.00 0.00 H new ATOM 0 HG SER A 117 29.966 -11.564 26.997 1.00 0.00 H new ATOM 1648 N LEU A 118 29.520 -6.625 25.147 1.00 0.00 N ATOM 1649 CA LEU A 118 29.653 -5.642 24.074 1.00 0.00 C ATOM 1650 C LEU A 118 31.030 -4.987 24.067 1.00 0.00 C ATOM 1651 O LEU A 118 31.782 -5.091 25.040 1.00 0.00 O ATOM 1652 CB LEU A 118 28.485 -4.629 24.109 1.00 0.00 C ATOM 1653 CG LEU A 118 28.230 -3.836 25.407 1.00 0.00 C ATOM 1654 CD1 LEU A 118 29.323 -2.806 25.719 1.00 0.00 C ATOM 1655 CD2 LEU A 118 26.887 -3.104 25.274 1.00 0.00 C ATOM 0 H LEU A 118 30.053 -6.403 25.988 1.00 0.00 H new ATOM 0 HA LEU A 118 29.581 -6.164 23.120 1.00 0.00 H new ATOM 0 HB2 LEU A 118 28.649 -3.908 23.308 1.00 0.00 H new ATOM 0 HB3 LEU A 118 27.570 -5.171 23.868 1.00 0.00 H new ATOM 0 HG LEU A 118 28.226 -4.554 26.227 1.00 0.00 H new ATOM 0 HD11 LEU A 118 29.079 -2.286 26.645 1.00 0.00 H new ATOM 0 HD12 LEU A 118 30.281 -3.314 25.830 1.00 0.00 H new ATOM 0 HD13 LEU A 118 29.387 -2.085 24.904 1.00 0.00 H new ATOM 0 HD21 LEU A 118 26.690 -2.537 26.184 1.00 0.00 H new ATOM 0 HD22 LEU A 118 26.926 -2.423 24.424 1.00 0.00 H new ATOM 0 HD23 LEU A 118 26.090 -3.831 25.120 1.00 0.00 H new ATOM 1667 N SER A 119 31.332 -4.302 22.964 1.00 0.00 N ATOM 1668 CA SER A 119 32.586 -3.613 22.702 1.00 0.00 C ATOM 1669 C SER A 119 32.278 -2.344 21.905 1.00 0.00 C ATOM 1670 O SER A 119 31.409 -2.348 21.027 1.00 0.00 O ATOM 1671 CB SER A 119 33.524 -4.527 21.896 1.00 0.00 C ATOM 1672 OG SER A 119 33.744 -5.772 22.545 1.00 0.00 O ATOM 0 H SER A 119 30.671 -4.211 22.192 1.00 0.00 H new ATOM 0 HA SER A 119 33.078 -3.354 23.640 1.00 0.00 H new ATOM 0 HB2 SER A 119 33.097 -4.704 20.909 1.00 0.00 H new ATOM 0 HB3 SER A 119 34.479 -4.023 21.745 1.00 0.00 H new ATOM 0 HG SER A 119 34.343 -6.324 22.000 1.00 0.00 H new ATOM 1678 N ALA A 120 32.983 -1.256 22.213 1.00 0.00 N ATOM 1679 CA ALA A 120 32.873 -0.004 21.479 1.00 0.00 C ATOM 1680 C ALA A 120 33.608 -0.106 20.139 1.00 0.00 C ATOM 1681 O ALA A 120 34.652 -0.760 20.042 1.00 0.00 O ATOM 1682 CB ALA A 120 33.491 1.121 22.315 1.00 0.00 C ATOM 0 H ALA A 120 33.650 -1.222 22.984 1.00 0.00 H new ATOM 0 HA ALA A 120 31.821 0.207 21.287 1.00 0.00 H new ATOM 0 HB1 ALA A 120 33.413 2.063 21.772 1.00 0.00 H new ATOM 0 HB2 ALA A 120 32.960 1.204 23.263 1.00 0.00 H new ATOM 0 HB3 ALA A 120 34.541 0.898 22.505 1.00 0.00 H new ATOM 1688 N MET A 121 33.072 0.568 19.121 1.00 0.00 N ATOM 1689 CA MET A 121 33.734 0.779 17.842 1.00 0.00 C ATOM 1690 C MET A 121 34.982 1.619 18.103 1.00 0.00 C ATOM 1691 O MET A 121 36.075 1.235 17.637 1.00 0.00 O ATOM 1692 CB MET A 121 32.761 1.479 16.884 1.00 0.00 C ATOM 1693 CG MET A 121 33.375 1.768 15.512 1.00 0.00 C ATOM 1694 SD MET A 121 32.213 2.548 14.359 1.00 0.00 S ATOM 1695 CE MET A 121 33.290 2.700 12.909 1.00 0.00 C ATOM 1696 OXT MET A 121 34.859 2.660 18.785 1.00 0.00 O ATOM 0 H MET A 121 32.145 0.990 19.168 1.00 0.00 H new ATOM 0 HA MET A 121 34.030 -0.162 17.378 1.00 0.00 H new ATOM 0 HB2 MET A 121 31.876 0.856 16.756 1.00 0.00 H new ATOM 0 HB3 MET A 121 32.430 2.416 17.332 1.00 0.00 H new ATOM 0 HG2 MET A 121 34.242 2.417 15.638 1.00 0.00 H new ATOM 0 HG3 MET A 121 33.736 0.835 15.079 1.00 0.00 H new ATOM 0 HE1 MET A 121 32.737 3.164 12.092 1.00 0.00 H new ATOM 0 HE2 MET A 121 34.153 3.317 13.160 1.00 0.00 H new ATOM 0 HE3 MET A 121 33.628 1.710 12.602 1.00 0.00 H new