USER MOD reduce.3.24.130724 H: found=0, std=0, add=949, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 950 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 30 HIS : no HE2:sc= -6.67 K(o=-5.1,f=-11!) USER MOD Set 1.2: A 124 SER OG : rot -26:sc= 1.56 USER MOD Set 2.1: A 104 SER OG : rot 180:sc= 0.102 USER MOD Set 2.2: A 106 THR OG1 : rot 10:sc=-0.00705 USER MOD Set 3.1: A 100 LYS NZ :NH3+ -116:sc= -0.268 (180deg=0) USER MOD Set 3.2: A 101 ASN : amide:sc= -9.02! C(o=-12!,f=-6.7!) USER MOD Set 3.3: A 107 ASN : amide:sc= -2.49 K(o=-12,f=-7.6) USER MOD Set 4.1: A 87 ASN : amide:sc= -5.16 K(o=-5.8,f=-16!) USER MOD Set 4.2: A 89 LYS NZ :NH3+ 158:sc= -0.665 (180deg=-0.175) USER MOD Set 5.1: A 5 ASN : amide:sc= -0.0446 K(o=0.13,f=-2.6) USER MOD Set 5.2: A 62 LYS NZ :NH3+ 155:sc= 0.177 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ -141:sc= 0.952 (180deg=-0.421) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 ASN : amide:sc= -5.53 K(o=-5.5,f=-14!) USER MOD Single : A 12 GLN : amide:sc= -2.02! K(o=-2!,f=-1.3) USER MOD Single : A 14 LYS NZ :NH3+ -135:sc= 0.115 (180deg=-0.7!) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 119:sc= -4.1! USER MOD Single : A 25 ASN : amide:sc= -0.205 K(o=-0.2,f=-1.7!) USER MOD Single : A 29 TYR OH : rot 71:sc= -3.51 USER MOD Single : A 31 LYS NZ :NH3+ -151:sc= -0.115 (180deg=-0.924) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 THR OG1 : rot 31:sc= -5.37! USER MOD Single : A 42 ASN : amide:sc= -3.96! C(o=-4!,f=-6.4!) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 ASN : amide:sc= -1.75! X(o=-1.8!,f=-1.4) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 THR OG1 : rot 140:sc= -0.24! USER MOD Single : A 59 ASN : amide:sc= -3.64! K(o=-3.6!,f=-1.2) USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 73 ASN : amide:sc= -5.12! C(o=-5.1!,f=-6.7!) USER MOD Single : A 74 SER OG : rot 180:sc= -0.805 USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 81 THR OG1 : rot -62:sc= -1.78! USER MOD Single : A 85 ASN : amide:sc= -4.85 K(o=-4.8,f=-5.7!) USER MOD Single : A 97 MET CE :methyl 158:sc= -6.86! (180deg=-10.8!) USER MOD Single : A 99 SER OG : rot -102:sc= 0.0109 USER MOD Single : A 105 THR OG1 : rot 180:sc= 0.109 USER MOD Single : A 108 THR OG1 : rot 74:sc= 0.578 USER MOD Single : A 109 SER OG : rot -42:sc= 0.00821 USER MOD Single : A 113 ASN : amide:sc= -12.1! C(o=-12!,f=-11!) USER MOD Single : A 114 LYS NZ :NH3+ 140:sc= -1.35 (180deg=-3.73!) USER MOD Single : A 117 SER OG : rot 56:sc= -0.276 USER MOD Single : A 121 TYR OH : rot -138:sc= 0.369 USER MOD Single : A 127 ASN : amide:sc= -6.78! C(o=-6.8!,f=-8.9!) USER MOD Single : A 128 HIS : no HD1:sc= -0.247 X(o=-0.25,f=-0.53) USER MOD ----------------------------------------------------------------- ATOM 32 N LYS A 3 -15.274 21.858 -1.688 1.00 0.00 N ATOM 33 CA LYS A 3 -15.740 21.042 -0.568 1.00 0.00 C ATOM 34 C LYS A 3 -16.078 19.619 -1.018 1.00 0.00 C ATOM 35 O LYS A 3 -16.675 18.849 -0.266 1.00 0.00 O ATOM 36 CB LYS A 3 -16.964 21.689 0.087 1.00 0.00 C ATOM 37 CG LYS A 3 -16.666 22.324 1.434 1.00 0.00 C ATOM 38 CD LYS A 3 -17.743 21.999 2.455 1.00 0.00 C ATOM 39 CE LYS A 3 -17.866 20.500 2.676 1.00 0.00 C ATOM 40 NZ LYS A 3 -19.259 20.020 2.454 1.00 0.00 N ATOM 0 HA LYS A 3 -14.932 20.984 0.161 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -17.365 22.449 -0.583 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -17.740 20.934 0.214 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -15.701 21.972 1.798 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -16.588 23.405 1.318 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -17.510 22.489 3.400 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -18.699 22.398 2.116 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -17.189 19.976 2.001 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -17.555 20.256 3.692 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -19.494 19.296 3.162 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -19.920 20.818 2.543 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -19.337 19.611 1.501 1.00 0.00 H new ATOM 54 N THR A 4 -15.693 19.277 -2.243 1.00 0.00 N ATOM 55 CA THR A 4 -15.954 17.949 -2.787 1.00 0.00 C ATOM 56 C THR A 4 -14.784 17.010 -2.512 1.00 0.00 C ATOM 57 O THR A 4 -14.973 15.809 -2.319 1.00 0.00 O ATOM 58 CB THR A 4 -16.210 18.040 -4.294 1.00 0.00 C ATOM 59 OG1 THR A 4 -17.438 18.696 -4.555 1.00 0.00 O ATOM 60 CG2 THR A 4 -16.255 16.691 -4.981 1.00 0.00 C ATOM 0 H THR A 4 -15.198 19.902 -2.879 1.00 0.00 H new ATOM 0 HA THR A 4 -16.840 17.546 -2.297 1.00 0.00 H new ATOM 0 HB THR A 4 -15.367 18.603 -4.694 1.00 0.00 H new ATOM 0 HG1 THR A 4 -17.583 18.746 -5.523 1.00 0.00 H new ATOM 0 HG21 THR A 4 -16.440 16.831 -6.046 1.00 0.00 H new ATOM 0 HG22 THR A 4 -15.302 16.180 -4.842 1.00 0.00 H new ATOM 0 HG23 THR A 4 -17.055 16.090 -4.550 1.00 0.00 H new ATOM 68 N ASN A 5 -13.575 17.567 -2.504 1.00 0.00 N ATOM 69 CA ASN A 5 -12.362 16.788 -2.262 1.00 0.00 C ATOM 70 C ASN A 5 -12.556 15.794 -1.119 1.00 0.00 C ATOM 71 O ASN A 5 -11.957 14.720 -1.110 1.00 0.00 O ATOM 72 CB ASN A 5 -11.192 17.722 -1.951 1.00 0.00 C ATOM 73 CG ASN A 5 -10.015 17.507 -2.883 1.00 0.00 C ATOM 74 OD1 ASN A 5 -8.879 17.346 -2.441 1.00 0.00 O ATOM 75 ND2 ASN A 5 -10.285 17.503 -4.184 1.00 0.00 N ATOM 0 H ASN A 5 -13.409 18.561 -2.663 1.00 0.00 H new ATOM 0 HA ASN A 5 -12.142 16.221 -3.166 1.00 0.00 H new ATOM 0 HB2 ASN A 5 -11.527 18.757 -2.026 1.00 0.00 H new ATOM 0 HB3 ASN A 5 -10.870 17.565 -0.922 1.00 0.00 H new ATOM 0 HD21 ASN A 5 -9.534 17.362 -4.860 1.00 0.00 H new ATOM 0 HD22 ASN A 5 -11.243 17.641 -4.506 1.00 0.00 H new ATOM 82 N LEU A 6 -13.402 16.157 -0.164 1.00 0.00 N ATOM 83 CA LEU A 6 -13.684 15.306 0.973 1.00 0.00 C ATOM 84 C LEU A 6 -14.655 14.206 0.584 1.00 0.00 C ATOM 85 O LEU A 6 -14.285 13.039 0.516 1.00 0.00 O ATOM 86 CB LEU A 6 -14.270 16.141 2.106 1.00 0.00 C ATOM 87 CG LEU A 6 -13.258 16.967 2.903 1.00 0.00 C ATOM 88 CD1 LEU A 6 -12.834 16.211 4.146 1.00 0.00 C ATOM 89 CD2 LEU A 6 -12.044 17.324 2.053 1.00 0.00 C ATOM 0 H LEU A 6 -13.906 17.044 -0.159 1.00 0.00 H new ATOM 0 HA LEU A 6 -12.754 14.846 1.307 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -15.016 16.817 1.688 1.00 0.00 H new ATOM 0 HB3 LEU A 6 -14.792 15.475 2.793 1.00 0.00 H new ATOM 0 HG LEU A 6 -13.738 17.899 3.202 1.00 0.00 H new ATOM 0 HD11 LEU A 6 -12.114 16.807 4.706 1.00 0.00 H new ATOM 0 HD12 LEU A 6 -13.707 16.016 4.769 1.00 0.00 H new ATOM 0 HD13 LEU A 6 -12.376 15.265 3.858 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -11.344 17.911 2.647 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -11.556 16.410 1.714 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -12.363 17.907 1.189 1.00 0.00 H new ATOM 101 N GLY A 7 -15.900 14.592 0.315 1.00 0.00 N ATOM 102 CA GLY A 7 -16.914 13.629 -0.075 1.00 0.00 C ATOM 103 C GLY A 7 -16.450 12.710 -1.190 1.00 0.00 C ATOM 104 O GLY A 7 -16.999 11.624 -1.371 1.00 0.00 O ATOM 0 H GLY A 7 -16.224 15.558 0.361 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -17.193 13.030 0.792 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -17.810 14.161 -0.397 1.00 0.00 H new ATOM 108 N GLU A 8 -15.441 13.145 -1.936 1.00 0.00 N ATOM 109 CA GLU A 8 -14.907 12.349 -3.034 1.00 0.00 C ATOM 110 C GLU A 8 -13.706 11.522 -2.583 1.00 0.00 C ATOM 111 O GLU A 8 -13.367 10.518 -3.210 1.00 0.00 O ATOM 112 CB GLU A 8 -14.509 13.251 -4.206 1.00 0.00 C ATOM 113 CG GLU A 8 -13.304 14.133 -3.919 1.00 0.00 C ATOM 114 CD GLU A 8 -12.179 13.930 -4.917 1.00 0.00 C ATOM 115 OE1 GLU A 8 -11.351 13.020 -4.701 1.00 0.00 O ATOM 116 OE2 GLU A 8 -12.127 14.680 -5.913 1.00 0.00 O ATOM 0 H GLU A 8 -14.977 14.043 -1.801 1.00 0.00 H new ATOM 0 HA GLU A 8 -15.691 11.666 -3.361 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -14.294 12.629 -5.075 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -15.356 13.884 -4.470 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -13.612 15.178 -3.933 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -12.936 13.923 -2.915 1.00 0.00 H new ATOM 123 N LEU A 9 -13.068 11.939 -1.492 1.00 0.00 N ATOM 124 CA LEU A 9 -11.916 11.218 -0.970 1.00 0.00 C ATOM 125 C LEU A 9 -12.327 10.337 0.201 1.00 0.00 C ATOM 126 O LEU A 9 -11.640 9.373 0.538 1.00 0.00 O ATOM 127 CB LEU A 9 -10.824 12.196 -0.530 1.00 0.00 C ATOM 128 CG LEU A 9 -10.045 12.852 -1.671 1.00 0.00 C ATOM 129 CD1 LEU A 9 -9.136 13.947 -1.136 1.00 0.00 C ATOM 130 CD2 LEU A 9 -9.238 11.811 -2.432 1.00 0.00 C ATOM 0 H LEU A 9 -13.329 12.767 -0.957 1.00 0.00 H new ATOM 0 HA LEU A 9 -11.520 10.586 -1.765 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -11.281 12.979 0.075 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -10.121 11.666 0.113 1.00 0.00 H new ATOM 0 HG LEU A 9 -10.758 13.305 -2.360 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -8.590 14.402 -1.962 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -9.737 14.707 -0.636 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -8.429 13.518 -0.426 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -8.690 12.295 -3.240 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -8.534 11.329 -1.754 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -9.911 11.062 -2.848 1.00 0.00 H new ATOM 142 N ILE A 10 -13.449 10.684 0.820 1.00 0.00 N ATOM 143 CA ILE A 10 -13.949 9.936 1.956 1.00 0.00 C ATOM 144 C ILE A 10 -14.969 8.889 1.534 1.00 0.00 C ATOM 145 O ILE A 10 -14.994 7.786 2.079 1.00 0.00 O ATOM 146 CB ILE A 10 -14.582 10.862 3.008 1.00 0.00 C ATOM 147 CG1 ILE A 10 -15.842 11.564 2.465 1.00 0.00 C ATOM 148 CG2 ILE A 10 -13.582 11.886 3.476 1.00 0.00 C ATOM 149 CD1 ILE A 10 -16.303 12.756 3.300 1.00 0.00 C ATOM 0 H ILE A 10 -14.027 11.480 0.551 1.00 0.00 H new ATOM 0 HA ILE A 10 -13.088 9.433 2.397 1.00 0.00 H new ATOM 0 HB ILE A 10 -14.882 10.241 3.852 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -15.646 11.902 1.447 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -16.653 10.838 2.409 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -14.046 12.534 4.220 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -12.724 11.381 3.919 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -13.252 12.486 2.628 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -17.194 13.193 2.850 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -16.533 12.424 4.312 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -15.511 13.504 3.335 1.00 0.00 H new ATOM 161 N ASN A 11 -15.805 9.235 0.554 1.00 0.00 N ATOM 162 CA ASN A 11 -16.820 8.309 0.052 1.00 0.00 C ATOM 163 C ASN A 11 -16.230 6.916 -0.080 1.00 0.00 C ATOM 164 O ASN A 11 -16.804 5.926 0.375 1.00 0.00 O ATOM 165 CB ASN A 11 -17.333 8.768 -1.312 1.00 0.00 C ATOM 166 CG ASN A 11 -16.217 9.192 -2.248 1.00 0.00 C ATOM 167 OD1 ASN A 11 -15.046 9.213 -1.871 1.00 0.00 O ATOM 168 ND2 ASN A 11 -16.578 9.531 -3.481 1.00 0.00 N ATOM 0 H ASN A 11 -15.799 10.145 0.094 1.00 0.00 H new ATOM 0 HA ASN A 11 -17.649 8.291 0.759 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -17.900 7.959 -1.773 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -18.022 9.602 -1.174 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -15.872 9.823 -4.157 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -17.561 9.499 -3.752 1.00 0.00 H new ATOM 175 N GLN A 12 -15.065 6.870 -0.701 1.00 0.00 N ATOM 176 CA GLN A 12 -14.343 5.624 -0.907 1.00 0.00 C ATOM 177 C GLN A 12 -13.632 5.201 0.372 1.00 0.00 C ATOM 178 O GLN A 12 -13.464 4.013 0.637 1.00 0.00 O ATOM 179 CB GLN A 12 -13.316 5.794 -2.028 1.00 0.00 C ATOM 180 CG GLN A 12 -12.179 6.737 -1.659 1.00 0.00 C ATOM 181 CD GLN A 12 -11.297 7.091 -2.838 1.00 0.00 C ATOM 182 OE1 GLN A 12 -11.305 6.413 -3.864 1.00 0.00 O ATOM 183 NE2 GLN A 12 -10.528 8.165 -2.693 1.00 0.00 N ATOM 0 H GLN A 12 -14.592 7.692 -1.076 1.00 0.00 H new ATOM 0 HA GLN A 12 -15.061 4.852 -1.185 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -12.902 4.819 -2.284 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -13.818 6.171 -2.919 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -12.595 7.651 -1.237 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -11.569 6.276 -0.882 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -10.554 8.697 -1.823 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -9.911 8.457 -3.451 1.00 0.00 H new ATOM 192 N GLY A 13 -13.209 6.186 1.155 1.00 0.00 N ATOM 193 CA GLY A 13 -12.509 5.905 2.393 1.00 0.00 C ATOM 194 C GLY A 13 -13.300 5.012 3.330 1.00 0.00 C ATOM 195 O GLY A 13 -12.907 3.875 3.591 1.00 0.00 O ATOM 0 H GLY A 13 -13.339 7.177 0.953 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -11.555 5.429 2.165 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -12.284 6.844 2.898 1.00 0.00 H new ATOM 199 N LYS A 14 -14.415 5.526 3.838 1.00 0.00 N ATOM 200 CA LYS A 14 -15.258 4.758 4.756 1.00 0.00 C ATOM 201 C LYS A 14 -15.722 3.463 4.098 1.00 0.00 C ATOM 202 O LYS A 14 -15.914 2.448 4.769 1.00 0.00 O ATOM 203 CB LYS A 14 -16.471 5.570 5.245 1.00 0.00 C ATOM 204 CG LYS A 14 -16.795 6.803 4.412 1.00 0.00 C ATOM 205 CD LYS A 14 -16.155 8.056 5.003 1.00 0.00 C ATOM 206 CE LYS A 14 -16.732 9.327 4.392 1.00 0.00 C ATOM 207 NZ LYS A 14 -18.154 9.540 4.782 1.00 0.00 N ATOM 0 H LYS A 14 -14.757 6.465 3.633 1.00 0.00 H new ATOM 0 HA LYS A 14 -14.650 4.519 5.628 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -17.345 4.918 5.258 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -16.290 5.882 6.274 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -16.441 6.658 3.391 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -17.876 6.935 4.359 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -16.309 8.069 6.082 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -15.078 8.028 4.835 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -16.137 10.184 4.709 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -16.659 9.272 3.306 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -18.707 9.813 3.944 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -18.540 8.660 5.180 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -18.209 10.296 5.494 1.00 0.00 H new ATOM 221 N SER A 15 -15.881 3.497 2.778 1.00 0.00 N ATOM 222 CA SER A 15 -16.297 2.317 2.031 1.00 0.00 C ATOM 223 C SER A 15 -15.123 1.357 1.881 1.00 0.00 C ATOM 224 O SER A 15 -15.303 0.148 1.745 1.00 0.00 O ATOM 225 CB SER A 15 -16.828 2.714 0.654 1.00 0.00 C ATOM 226 OG SER A 15 -17.924 1.900 0.274 1.00 0.00 O ATOM 0 H SER A 15 -15.728 4.327 2.206 1.00 0.00 H new ATOM 0 HA SER A 15 -17.097 1.821 2.581 1.00 0.00 H new ATOM 0 HB2 SER A 15 -17.135 3.760 0.667 1.00 0.00 H new ATOM 0 HB3 SER A 15 -16.032 2.625 -0.085 1.00 0.00 H new ATOM 0 HG SER A 15 -18.246 2.176 -0.610 1.00 0.00 H new ATOM 232 N LEU A 16 -13.916 1.914 1.927 1.00 0.00 N ATOM 233 CA LEU A 16 -12.699 1.134 1.820 1.00 0.00 C ATOM 234 C LEU A 16 -12.436 0.443 3.149 1.00 0.00 C ATOM 235 O LEU A 16 -12.348 -0.782 3.217 1.00 0.00 O ATOM 236 CB LEU A 16 -11.532 2.049 1.438 1.00 0.00 C ATOM 237 CG LEU A 16 -10.187 1.357 1.228 1.00 0.00 C ATOM 238 CD1 LEU A 16 -10.306 0.267 0.175 1.00 0.00 C ATOM 239 CD2 LEU A 16 -9.122 2.375 0.829 1.00 0.00 C ATOM 0 H LEU A 16 -13.760 2.916 2.039 1.00 0.00 H new ATOM 0 HA LEU A 16 -12.805 0.376 1.044 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -11.794 2.578 0.522 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -11.414 2.801 2.218 1.00 0.00 H new ATOM 0 HG LEU A 16 -9.886 0.893 2.167 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -9.338 -0.215 0.039 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -11.037 -0.473 0.499 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -10.628 0.707 -0.769 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -8.169 1.866 0.683 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -9.417 2.866 -0.098 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -9.018 3.121 1.617 1.00 0.00 H new ATOM 251 N LEU A 17 -12.350 1.241 4.212 1.00 0.00 N ATOM 252 CA LEU A 17 -12.138 0.713 5.553 1.00 0.00 C ATOM 253 C LEU A 17 -13.126 -0.414 5.835 1.00 0.00 C ATOM 254 O LEU A 17 -12.800 -1.390 6.510 1.00 0.00 O ATOM 255 CB LEU A 17 -12.314 1.822 6.588 1.00 0.00 C ATOM 256 CG LEU A 17 -11.207 2.870 6.644 1.00 0.00 C ATOM 257 CD1 LEU A 17 -11.463 3.847 7.781 1.00 0.00 C ATOM 258 CD2 LEU A 17 -9.830 2.224 6.790 1.00 0.00 C ATOM 0 H LEU A 17 -12.424 2.257 4.167 1.00 0.00 H new ATOM 0 HA LEU A 17 -11.123 0.322 5.618 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -13.258 2.330 6.389 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -12.401 1.362 7.572 1.00 0.00 H new ATOM 0 HG LEU A 17 -11.215 3.417 5.701 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -10.665 4.589 7.809 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -12.419 4.347 7.623 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -11.489 3.306 8.727 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -9.066 3.000 6.827 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -9.798 1.640 7.710 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -9.643 1.570 5.938 1.00 0.00 H new ATOM 270 N ASP A 18 -14.341 -0.265 5.311 1.00 0.00 N ATOM 271 CA ASP A 18 -15.384 -1.267 5.502 1.00 0.00 C ATOM 272 C ASP A 18 -14.989 -2.609 4.883 1.00 0.00 C ATOM 273 O ASP A 18 -14.882 -3.617 5.581 1.00 0.00 O ATOM 274 CB ASP A 18 -16.702 -0.783 4.894 1.00 0.00 C ATOM 275 CG ASP A 18 -17.543 -0.002 5.884 1.00 0.00 C ATOM 276 OD1 ASP A 18 -17.768 -0.510 7.003 1.00 0.00 O ATOM 277 OD2 ASP A 18 -17.975 1.119 5.541 1.00 0.00 O ATOM 0 H ASP A 18 -14.626 0.539 4.752 1.00 0.00 H new ATOM 0 HA ASP A 18 -15.512 -1.412 6.575 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -16.491 -0.157 4.027 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -17.271 -1.641 4.536 1.00 0.00 H new ATOM 282 N GLU A 19 -14.783 -2.615 3.568 1.00 0.00 N ATOM 283 CA GLU A 19 -14.411 -3.835 2.853 1.00 0.00 C ATOM 284 C GLU A 19 -13.098 -4.412 3.379 1.00 0.00 C ATOM 285 O GLU A 19 -13.074 -5.503 3.948 1.00 0.00 O ATOM 286 CB GLU A 19 -14.289 -3.551 1.354 1.00 0.00 C ATOM 287 CG GLU A 19 -15.611 -3.642 0.609 1.00 0.00 C ATOM 288 CD GLU A 19 -15.804 -4.981 -0.075 1.00 0.00 C ATOM 289 OE1 GLU A 19 -15.565 -6.020 0.575 1.00 0.00 O ATOM 290 OE2 GLU A 19 -16.194 -4.991 -1.262 1.00 0.00 O ATOM 0 H GLU A 19 -14.867 -1.789 2.975 1.00 0.00 H new ATOM 0 HA GLU A 19 -15.197 -4.572 3.021 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -13.870 -2.554 1.214 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -13.584 -4.257 0.915 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -16.430 -3.474 1.308 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -15.660 -2.847 -0.136 1.00 0.00 H new ATOM 297 N SER A 20 -12.013 -3.670 3.185 1.00 0.00 N ATOM 298 CA SER A 20 -10.695 -4.097 3.639 1.00 0.00 C ATOM 299 C SER A 20 -10.688 -4.267 5.140 1.00 0.00 C ATOM 300 O SER A 20 -10.321 -3.353 5.879 1.00 0.00 O ATOM 301 CB SER A 20 -9.654 -3.058 3.268 1.00 0.00 C ATOM 302 OG SER A 20 -10.190 -1.777 3.468 1.00 0.00 O ATOM 0 H SER A 20 -12.021 -2.765 2.714 1.00 0.00 H new ATOM 0 HA SER A 20 -10.461 -5.047 3.159 1.00 0.00 H new ATOM 0 HB2 SER A 20 -8.759 -3.190 3.876 1.00 0.00 H new ATOM 0 HB3 SER A 20 -9.354 -3.182 2.227 1.00 0.00 H new ATOM 0 HG SER A 20 -9.657 -1.301 4.139 1.00 0.00 H new ATOM 308 N VAL A 21 -11.091 -5.430 5.587 1.00 0.00 N ATOM 309 CA VAL A 21 -11.123 -5.708 7.000 1.00 0.00 C ATOM 310 C VAL A 21 -9.824 -6.342 7.432 1.00 0.00 C ATOM 311 O VAL A 21 -9.207 -7.083 6.678 1.00 0.00 O ATOM 312 CB VAL A 21 -12.289 -6.636 7.352 1.00 0.00 C ATOM 313 CG1 VAL A 21 -12.171 -7.955 6.605 1.00 0.00 C ATOM 314 CG2 VAL A 21 -12.372 -6.861 8.854 1.00 0.00 C ATOM 0 H VAL A 21 -11.401 -6.199 4.993 1.00 0.00 H new ATOM 0 HA VAL A 21 -11.261 -4.764 7.527 1.00 0.00 H new ATOM 0 HB VAL A 21 -13.214 -6.153 7.038 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -13.009 -8.599 6.870 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -12.182 -7.767 5.531 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -11.236 -8.445 6.878 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -13.208 -7.523 9.077 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -11.446 -7.315 9.206 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -12.522 -5.906 9.357 1.00 0.00 H new ATOM 324 N GLU A 22 -9.407 -6.049 8.641 1.00 0.00 N ATOM 325 CA GLU A 22 -8.166 -6.606 9.143 1.00 0.00 C ATOM 326 C GLU A 22 -8.368 -8.078 9.495 1.00 0.00 C ATOM 327 O GLU A 22 -9.050 -8.408 10.465 1.00 0.00 O ATOM 328 CB GLU A 22 -7.705 -5.829 10.376 1.00 0.00 C ATOM 329 CG GLU A 22 -8.737 -5.781 11.489 1.00 0.00 C ATOM 330 CD GLU A 22 -8.392 -6.698 12.646 1.00 0.00 C ATOM 331 OE1 GLU A 22 -7.650 -7.678 12.426 1.00 0.00 O ATOM 332 OE2 GLU A 22 -8.865 -6.436 13.773 1.00 0.00 O ATOM 0 H GLU A 22 -9.899 -5.436 9.291 1.00 0.00 H new ATOM 0 HA GLU A 22 -7.400 -6.526 8.372 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -6.791 -6.283 10.759 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -7.455 -4.810 10.080 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -8.824 -4.758 11.855 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -9.711 -6.060 11.088 1.00 0.00 H new ATOM 339 N GLY A 23 -7.783 -8.957 8.683 1.00 0.00 N ATOM 340 CA GLY A 23 -7.921 -10.384 8.904 1.00 0.00 C ATOM 341 C GLY A 23 -6.598 -11.128 8.857 1.00 0.00 C ATOM 342 O GLY A 23 -5.995 -11.385 9.898 1.00 0.00 O ATOM 0 H GLY A 23 -7.215 -8.703 7.875 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -8.390 -10.551 9.874 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -8.590 -10.799 8.150 1.00 0.00 H new ATOM 346 N PHE A 24 -6.146 -11.490 7.651 1.00 0.00 N ATOM 347 CA PHE A 24 -4.887 -12.226 7.501 1.00 0.00 C ATOM 348 C PHE A 24 -4.697 -12.753 6.072 1.00 0.00 C ATOM 349 O PHE A 24 -4.173 -13.850 5.878 1.00 0.00 O ATOM 350 CB PHE A 24 -4.848 -13.405 8.484 1.00 0.00 C ATOM 351 CG PHE A 24 -3.769 -13.303 9.525 1.00 0.00 C ATOM 352 CD1 PHE A 24 -2.435 -13.423 9.174 1.00 0.00 C ATOM 353 CD2 PHE A 24 -4.092 -13.098 10.857 1.00 0.00 C ATOM 354 CE1 PHE A 24 -1.441 -13.337 10.131 1.00 0.00 C ATOM 355 CE2 PHE A 24 -3.103 -13.013 11.818 1.00 0.00 C ATOM 356 CZ PHE A 24 -1.776 -13.132 11.455 1.00 0.00 C ATOM 0 H PHE A 24 -6.627 -11.288 6.775 1.00 0.00 H new ATOM 0 HA PHE A 24 -4.076 -11.530 7.716 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -5.814 -13.479 8.984 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -4.709 -14.328 7.921 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -2.168 -13.586 8.140 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -5.128 -13.004 11.147 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -0.404 -13.430 9.844 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -3.368 -12.854 12.853 1.00 0.00 H new ATOM 0 HZ PHE A 24 -1.002 -13.065 12.205 1.00 0.00 H new ATOM 366 N ASN A 25 -5.114 -11.978 5.072 1.00 0.00 N ATOM 367 CA ASN A 25 -4.969 -12.405 3.678 1.00 0.00 C ATOM 368 C ASN A 25 -5.492 -11.345 2.712 1.00 0.00 C ATOM 369 O ASN A 25 -6.073 -10.345 3.130 1.00 0.00 O ATOM 370 CB ASN A 25 -5.709 -13.724 3.448 1.00 0.00 C ATOM 371 CG ASN A 25 -4.977 -14.635 2.481 1.00 0.00 C ATOM 372 OD1 ASN A 25 -3.753 -14.582 2.366 1.00 0.00 O ATOM 373 ND2 ASN A 25 -5.727 -15.477 1.780 1.00 0.00 N ATOM 0 H ASN A 25 -5.549 -11.064 5.196 1.00 0.00 H new ATOM 0 HA ASN A 25 -3.906 -12.547 3.485 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -5.836 -14.237 4.401 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -6.707 -13.515 3.062 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -5.291 -16.115 1.114 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -6.739 -15.486 1.908 1.00 0.00 H new ATOM 380 N VAL A 26 -5.285 -11.575 1.413 1.00 0.00 N ATOM 381 CA VAL A 26 -5.738 -10.640 0.383 1.00 0.00 C ATOM 382 C VAL A 26 -7.162 -10.171 0.663 1.00 0.00 C ATOM 383 O VAL A 26 -8.042 -10.975 0.970 1.00 0.00 O ATOM 384 CB VAL A 26 -5.675 -11.267 -1.025 1.00 0.00 C ATOM 385 CG1 VAL A 26 -6.610 -12.463 -1.125 1.00 0.00 C ATOM 386 CG2 VAL A 26 -6.007 -10.229 -2.089 1.00 0.00 C ATOM 0 H VAL A 26 -4.807 -12.400 1.051 1.00 0.00 H new ATOM 0 HA VAL A 26 -5.062 -9.785 0.412 1.00 0.00 H new ATOM 0 HB VAL A 26 -4.658 -11.619 -1.198 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -6.549 -12.889 -2.126 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -6.318 -13.215 -0.392 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -7.633 -12.142 -0.929 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -5.957 -10.690 -3.075 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -7.012 -9.843 -1.919 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -5.290 -9.410 -2.035 1.00 0.00 H new ATOM 396 N GLY A 27 -7.376 -8.864 0.576 1.00 0.00 N ATOM 397 CA GLY A 27 -8.689 -8.314 0.846 1.00 0.00 C ATOM 398 C GLY A 27 -8.869 -7.975 2.315 1.00 0.00 C ATOM 399 O GLY A 27 -9.855 -7.348 2.700 1.00 0.00 O ATOM 0 H GLY A 27 -6.665 -8.177 0.324 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -8.837 -7.417 0.245 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -9.452 -9.030 0.542 1.00 0.00 H new ATOM 403 N GLU A 28 -7.903 -8.388 3.136 1.00 0.00 N ATOM 404 CA GLU A 28 -7.942 -8.127 4.563 1.00 0.00 C ATOM 405 C GLU A 28 -6.536 -7.897 5.088 1.00 0.00 C ATOM 406 O GLU A 28 -5.617 -8.641 4.762 1.00 0.00 O ATOM 407 CB GLU A 28 -8.601 -9.295 5.299 1.00 0.00 C ATOM 408 CG GLU A 28 -10.068 -9.484 4.951 1.00 0.00 C ATOM 409 CD GLU A 28 -10.268 -10.329 3.708 1.00 0.00 C ATOM 410 OE1 GLU A 28 -9.653 -11.413 3.622 1.00 0.00 O ATOM 411 OE2 GLU A 28 -11.037 -9.905 2.820 1.00 0.00 O ATOM 0 H GLU A 28 -7.081 -8.908 2.828 1.00 0.00 H new ATOM 0 HA GLU A 28 -8.534 -7.229 4.740 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -8.060 -10.212 5.066 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -8.509 -9.135 6.373 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -10.579 -9.954 5.791 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -10.531 -8.509 4.801 1.00 0.00 H new ATOM 418 N TYR A 29 -6.363 -6.856 5.890 1.00 0.00 N ATOM 419 CA TYR A 29 -5.042 -6.542 6.428 1.00 0.00 C ATOM 420 C TYR A 29 -4.850 -7.124 7.815 1.00 0.00 C ATOM 421 O TYR A 29 -5.765 -7.701 8.389 1.00 0.00 O ATOM 422 CB TYR A 29 -4.810 -5.030 6.444 1.00 0.00 C ATOM 423 CG TYR A 29 -5.655 -4.286 7.444 1.00 0.00 C ATOM 424 CD1 TYR A 29 -6.988 -4.002 7.174 1.00 0.00 C ATOM 425 CD2 TYR A 29 -5.118 -3.859 8.653 1.00 0.00 C ATOM 426 CE1 TYR A 29 -7.767 -3.311 8.078 1.00 0.00 C ATOM 427 CE2 TYR A 29 -5.893 -3.165 9.564 1.00 0.00 C ATOM 428 CZ TYR A 29 -7.215 -2.894 9.271 1.00 0.00 C ATOM 429 OH TYR A 29 -7.988 -2.208 10.177 1.00 0.00 O ATOM 0 H TYR A 29 -7.107 -6.221 6.181 1.00 0.00 H new ATOM 0 HA TYR A 29 -4.303 -7.002 5.771 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -3.759 -4.837 6.659 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -5.010 -4.633 5.449 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -7.421 -4.328 6.240 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -4.084 -4.072 8.883 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -8.802 -3.098 7.853 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -5.466 -2.836 10.500 1.00 0.00 H new ATOM 0 HH TYR A 29 -8.642 -2.818 10.578 1.00 0.00 H new ATOM 439 N HIS A 30 -3.648 -6.982 8.348 1.00 0.00 N ATOM 440 CA HIS A 30 -3.359 -7.516 9.676 1.00 0.00 C ATOM 441 C HIS A 30 -3.955 -6.637 10.767 1.00 0.00 C ATOM 442 O HIS A 30 -4.879 -7.044 11.471 1.00 0.00 O ATOM 443 CB HIS A 30 -1.859 -7.656 9.892 1.00 0.00 C ATOM 444 CG HIS A 30 -1.513 -8.419 11.132 1.00 0.00 C ATOM 445 ND1 HIS A 30 -1.307 -9.783 11.147 1.00 0.00 N ATOM 446 CD2 HIS A 30 -1.352 -8.003 12.411 1.00 0.00 C ATOM 447 CE1 HIS A 30 -1.035 -10.171 12.379 1.00 0.00 C ATOM 448 NE2 HIS A 30 -1.056 -9.111 13.166 1.00 0.00 N ATOM 0 H HIS A 30 -2.866 -6.510 7.894 1.00 0.00 H new ATOM 0 HA HIS A 30 -3.818 -8.503 9.735 1.00 0.00 H new ATOM 0 HB2 HIS A 30 -1.419 -8.157 9.030 1.00 0.00 H new ATOM 0 HB3 HIS A 30 -1.412 -6.664 9.947 1.00 0.00 H new ATOM 0 HD1 HIS A 30 -1.357 -10.396 10.333 1.00 0.00 H new ATOM 0 HD2 HIS A 30 -1.440 -6.988 12.770 1.00 0.00 H new ATOM 0 HE1 HIS A 30 -0.830 -11.184 12.691 1.00 0.00 H new ATOM 457 N LYS A 31 -3.418 -5.430 10.906 1.00 0.00 N ATOM 458 CA LYS A 31 -3.896 -4.495 11.917 1.00 0.00 C ATOM 459 C LYS A 31 -3.153 -3.169 11.820 1.00 0.00 C ATOM 460 O LYS A 31 -1.974 -3.131 11.470 1.00 0.00 O ATOM 461 CB LYS A 31 -3.723 -5.089 13.316 1.00 0.00 C ATOM 462 CG LYS A 31 -4.833 -4.705 14.281 1.00 0.00 C ATOM 463 CD LYS A 31 -5.138 -5.831 15.255 1.00 0.00 C ATOM 464 CE LYS A 31 -3.968 -6.092 16.190 1.00 0.00 C ATOM 465 NZ LYS A 31 -3.033 -7.111 15.638 1.00 0.00 N ATOM 0 H LYS A 31 -2.652 -5.077 10.332 1.00 0.00 H new ATOM 0 HA LYS A 31 -4.956 -4.313 11.738 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -3.680 -6.175 13.238 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -2.767 -4.761 13.725 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -4.543 -3.812 14.835 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -5.733 -4.454 13.720 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -6.023 -5.578 15.839 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -5.371 -6.740 14.700 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -3.428 -5.161 16.365 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -4.343 -6.429 17.156 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -2.568 -7.615 16.420 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -3.564 -7.789 15.055 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -2.313 -6.641 15.053 1.00 0.00 H new ATOM 479 N GLY A 32 -3.850 -2.083 12.131 1.00 0.00 N ATOM 480 CA GLY A 32 -3.238 -0.771 12.070 1.00 0.00 C ATOM 481 C GLY A 32 -3.628 -0.007 10.821 1.00 0.00 C ATOM 482 O GLY A 32 -3.589 1.224 10.803 1.00 0.00 O ATOM 0 H GLY A 32 -4.827 -2.088 12.424 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -3.529 -0.196 12.949 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -2.154 -0.877 12.103 1.00 0.00 H new ATOM 486 N ALA A 33 -4.005 -0.733 9.772 1.00 0.00 N ATOM 487 CA ALA A 33 -4.401 -0.105 8.517 1.00 0.00 C ATOM 488 C ALA A 33 -5.559 0.864 8.730 1.00 0.00 C ATOM 489 O ALA A 33 -5.427 2.061 8.474 1.00 0.00 O ATOM 490 CB ALA A 33 -4.777 -1.161 7.489 1.00 0.00 C ATOM 0 H ALA A 33 -4.044 -1.752 9.767 1.00 0.00 H new ATOM 0 HA ALA A 33 -3.549 0.462 8.141 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -5.070 -0.675 6.558 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -3.921 -1.811 7.305 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -5.610 -1.755 7.866 1.00 0.00 H new ATOM 496 N LYS A 34 -6.697 0.333 9.179 1.00 0.00 N ATOM 497 CA LYS A 34 -7.895 1.142 9.410 1.00 0.00 C ATOM 498 C LYS A 34 -7.548 2.549 9.910 1.00 0.00 C ATOM 499 O LYS A 34 -7.726 3.530 9.192 1.00 0.00 O ATOM 500 CB LYS A 34 -8.809 0.452 10.426 1.00 0.00 C ATOM 501 CG LYS A 34 -9.935 -0.347 9.789 1.00 0.00 C ATOM 502 CD LYS A 34 -11.261 0.392 9.874 1.00 0.00 C ATOM 503 CE LYS A 34 -12.430 -0.519 9.537 1.00 0.00 C ATOM 504 NZ LYS A 34 -13.615 -0.245 10.396 1.00 0.00 N ATOM 0 H LYS A 34 -6.815 -0.658 9.391 1.00 0.00 H new ATOM 0 HA LYS A 34 -8.409 1.240 8.454 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -8.210 -0.213 11.048 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -9.238 1.206 11.086 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -9.695 -0.547 8.745 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -10.023 -1.313 10.286 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -11.390 0.795 10.879 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -11.250 1.240 9.189 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -12.703 -0.387 8.490 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -12.126 -1.559 9.659 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -14.390 -0.887 10.134 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -13.363 -0.396 11.394 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -13.921 0.740 10.261 1.00 0.00 H new ATOM 518 N ASP A 35 -7.060 2.628 11.148 1.00 0.00 N ATOM 519 CA ASP A 35 -6.691 3.899 11.785 1.00 0.00 C ATOM 520 C ASP A 35 -6.174 4.936 10.785 1.00 0.00 C ATOM 521 O ASP A 35 -6.621 6.070 10.799 1.00 0.00 O ATOM 522 CB ASP A 35 -5.634 3.655 12.862 1.00 0.00 C ATOM 523 CG ASP A 35 -5.826 4.548 14.074 1.00 0.00 C ATOM 524 OD1 ASP A 35 -6.497 5.593 13.941 1.00 0.00 O ATOM 525 OD2 ASP A 35 -5.307 4.200 15.155 1.00 0.00 O ATOM 0 H ASP A 35 -6.908 1.812 11.741 1.00 0.00 H new ATOM 0 HA ASP A 35 -7.599 4.304 12.231 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -5.671 2.611 13.174 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -4.644 3.827 12.441 1.00 0.00 H new ATOM 530 N GLY A 36 -5.246 4.546 9.921 1.00 0.00 N ATOM 531 CA GLY A 36 -4.714 5.464 8.932 1.00 0.00 C ATOM 532 C GLY A 36 -5.812 6.037 8.066 1.00 0.00 C ATOM 533 O GLY A 36 -6.167 7.207 8.200 1.00 0.00 O ATOM 0 H GLY A 36 -4.851 3.606 9.887 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -4.183 6.274 9.433 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -3.987 4.946 8.306 1.00 0.00 H new ATOM 537 N LEU A 37 -6.375 5.206 7.189 1.00 0.00 N ATOM 538 CA LEU A 37 -7.461 5.651 6.333 1.00 0.00 C ATOM 539 C LEU A 37 -8.614 6.172 7.186 1.00 0.00 C ATOM 540 O LEU A 37 -9.435 6.951 6.729 1.00 0.00 O ATOM 541 CB LEU A 37 -7.955 4.521 5.425 1.00 0.00 C ATOM 542 CG LEU A 37 -9.369 4.723 4.867 1.00 0.00 C ATOM 543 CD1 LEU A 37 -9.502 6.095 4.237 1.00 0.00 C ATOM 544 CD2 LEU A 37 -9.714 3.649 3.852 1.00 0.00 C ATOM 0 H LEU A 37 -6.097 4.233 7.057 1.00 0.00 H new ATOM 0 HA LEU A 37 -7.084 6.453 5.699 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -7.261 4.413 4.591 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -7.929 3.586 5.984 1.00 0.00 H new ATOM 0 HG LEU A 37 -10.069 4.647 5.699 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -10.512 6.220 3.847 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -9.306 6.861 4.988 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -8.784 6.193 3.423 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -10.722 3.817 3.473 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -9.004 3.688 3.026 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -9.664 2.669 4.327 1.00 0.00 H new ATOM 556 N THR A 38 -8.667 5.738 8.434 1.00 0.00 N ATOM 557 CA THR A 38 -9.714 6.175 9.343 1.00 0.00 C ATOM 558 C THR A 38 -9.335 7.509 9.961 1.00 0.00 C ATOM 559 O THR A 38 -10.178 8.369 10.198 1.00 0.00 O ATOM 560 CB THR A 38 -9.922 5.142 10.437 1.00 0.00 C ATOM 561 OG1 THR A 38 -9.896 3.831 9.913 1.00 0.00 O ATOM 562 CG2 THR A 38 -11.223 5.310 11.160 1.00 0.00 C ATOM 0 H THR A 38 -7.998 5.084 8.841 1.00 0.00 H new ATOM 0 HA THR A 38 -10.642 6.289 8.783 1.00 0.00 H new ATOM 0 HB THR A 38 -9.101 5.299 11.137 1.00 0.00 H new ATOM 0 HG1 THR A 38 -9.304 3.802 9.133 1.00 0.00 H new ATOM 0 HG21 THR A 38 -11.314 4.543 11.929 1.00 0.00 H new ATOM 0 HG22 THR A 38 -11.256 6.295 11.625 1.00 0.00 H new ATOM 0 HG23 THR A 38 -12.047 5.214 10.453 1.00 0.00 H new ATOM 570 N VAL A 39 -8.046 7.664 10.200 1.00 0.00 N ATOM 571 CA VAL A 39 -7.498 8.877 10.770 1.00 0.00 C ATOM 572 C VAL A 39 -7.705 10.033 9.805 1.00 0.00 C ATOM 573 O VAL A 39 -7.716 11.200 10.198 1.00 0.00 O ATOM 574 CB VAL A 39 -6.003 8.657 11.095 1.00 0.00 C ATOM 575 CG1 VAL A 39 -5.162 9.916 10.968 1.00 0.00 C ATOM 576 CG2 VAL A 39 -5.873 8.059 12.481 1.00 0.00 C ATOM 0 H VAL A 39 -7.348 6.947 10.003 1.00 0.00 H new ATOM 0 HA VAL A 39 -8.012 9.126 11.699 1.00 0.00 H new ATOM 0 HB VAL A 39 -5.610 7.966 10.350 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -4.124 9.687 11.211 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -5.221 10.292 9.946 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -5.536 10.674 11.656 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -4.819 7.903 12.713 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -6.308 8.739 13.213 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -6.398 7.104 12.516 1.00 0.00 H new ATOM 586 N GLU A 40 -7.917 9.686 8.541 1.00 0.00 N ATOM 587 CA GLU A 40 -8.179 10.669 7.514 1.00 0.00 C ATOM 588 C GLU A 40 -9.685 10.803 7.340 1.00 0.00 C ATOM 589 O GLU A 40 -10.173 11.851 6.943 1.00 0.00 O ATOM 590 CB GLU A 40 -7.526 10.255 6.200 1.00 0.00 C ATOM 591 CG GLU A 40 -8.045 8.935 5.677 1.00 0.00 C ATOM 592 CD GLU A 40 -8.324 8.963 4.187 1.00 0.00 C ATOM 593 OE1 GLU A 40 -7.357 8.962 3.398 1.00 0.00 O ATOM 594 OE2 GLU A 40 -9.514 8.985 3.807 1.00 0.00 O ATOM 0 H GLU A 40 -7.911 8.722 8.208 1.00 0.00 H new ATOM 0 HA GLU A 40 -7.756 11.629 7.810 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -7.700 11.030 5.453 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -6.448 10.185 6.342 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -7.317 8.153 5.891 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -8.960 8.673 6.209 1.00 0.00 H new ATOM 601 N ILE A 41 -10.416 9.730 7.670 1.00 0.00 N ATOM 602 CA ILE A 41 -11.872 9.737 7.582 1.00 0.00 C ATOM 603 C ILE A 41 -12.440 10.454 8.794 1.00 0.00 C ATOM 604 O ILE A 41 -13.130 11.465 8.658 1.00 0.00 O ATOM 605 CB ILE A 41 -12.446 8.306 7.501 1.00 0.00 C ATOM 606 CG1 ILE A 41 -12.020 7.649 6.192 1.00 0.00 C ATOM 607 CG2 ILE A 41 -13.966 8.320 7.622 1.00 0.00 C ATOM 608 CD1 ILE A 41 -12.646 8.272 4.967 1.00 0.00 C ATOM 0 H ILE A 41 -10.019 8.850 7.999 1.00 0.00 H new ATOM 0 HA ILE A 41 -12.158 10.258 6.668 1.00 0.00 H new ATOM 0 HB ILE A 41 -12.049 7.726 8.334 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -10.935 7.706 6.103 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -12.282 6.591 6.225 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -14.345 7.300 7.562 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -14.251 8.757 8.579 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -14.390 8.913 6.812 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -12.296 7.752 4.075 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -13.731 8.191 5.032 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -12.363 9.323 4.909 1.00 0.00 H new ATOM 620 N ASN A 42 -12.108 9.954 9.988 1.00 0.00 N ATOM 621 CA ASN A 42 -12.549 10.590 11.222 1.00 0.00 C ATOM 622 C ASN A 42 -12.286 12.079 11.106 1.00 0.00 C ATOM 623 O ASN A 42 -13.107 12.915 11.486 1.00 0.00 O ATOM 624 CB ASN A 42 -11.781 10.039 12.429 1.00 0.00 C ATOM 625 CG ASN A 42 -11.803 8.528 12.515 1.00 0.00 C ATOM 626 OD1 ASN A 42 -12.682 7.872 11.956 1.00 0.00 O ATOM 627 ND2 ASN A 42 -10.827 7.972 13.226 1.00 0.00 N ATOM 0 H ASN A 42 -11.540 9.117 10.121 1.00 0.00 H new ATOM 0 HA ASN A 42 -13.610 10.388 11.370 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -10.746 10.378 12.378 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -12.207 10.454 13.342 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -10.784 6.958 13.327 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -10.121 8.559 13.670 1.00 0.00 H new ATOM 634 N LYS A 43 -11.118 12.385 10.555 1.00 0.00 N ATOM 635 CA LYS A 43 -10.697 13.769 10.350 1.00 0.00 C ATOM 636 C LYS A 43 -11.404 14.403 9.144 1.00 0.00 C ATOM 637 O LYS A 43 -11.932 15.510 9.243 1.00 0.00 O ATOM 638 CB LYS A 43 -9.181 13.835 10.154 1.00 0.00 C ATOM 639 CG LYS A 43 -8.590 15.205 10.443 1.00 0.00 C ATOM 640 CD LYS A 43 -8.161 15.331 11.896 1.00 0.00 C ATOM 641 CE LYS A 43 -9.361 15.406 12.826 1.00 0.00 C ATOM 642 NZ LYS A 43 -8.976 15.838 14.198 1.00 0.00 N ATOM 0 H LYS A 43 -10.441 11.690 10.240 1.00 0.00 H new ATOM 0 HA LYS A 43 -10.975 14.334 11.240 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -8.707 13.099 10.804 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -8.943 13.555 9.128 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -7.732 15.377 9.793 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -9.325 15.976 10.211 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -7.541 14.477 12.169 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -7.547 16.223 12.019 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -10.093 16.103 12.418 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -9.843 14.430 12.875 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -9.823 15.876 14.800 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -8.297 15.159 14.598 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -8.539 16.781 14.155 1.00 0.00 H new ATOM 656 N ALA A 44 -11.402 13.705 8.006 1.00 0.00 N ATOM 657 CA ALA A 44 -12.033 14.215 6.788 1.00 0.00 C ATOM 658 C ALA A 44 -13.522 14.446 6.983 1.00 0.00 C ATOM 659 O ALA A 44 -14.014 15.553 6.786 1.00 0.00 O ATOM 660 CB ALA A 44 -11.806 13.263 5.625 1.00 0.00 C ATOM 0 H ALA A 44 -10.971 12.786 7.903 1.00 0.00 H new ATOM 0 HA ALA A 44 -11.567 15.174 6.560 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -12.284 13.662 4.730 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -10.736 13.154 5.448 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -12.235 12.290 5.862 1.00 0.00 H new ATOM 666 N GLU A 45 -14.242 13.399 7.364 1.00 0.00 N ATOM 667 CA GLU A 45 -15.681 13.505 7.579 1.00 0.00 C ATOM 668 C GLU A 45 -16.003 14.707 8.458 1.00 0.00 C ATOM 669 O GLU A 45 -17.001 15.397 8.245 1.00 0.00 O ATOM 670 CB GLU A 45 -16.210 12.227 8.216 1.00 0.00 C ATOM 671 CG GLU A 45 -15.910 10.985 7.398 1.00 0.00 C ATOM 672 CD GLU A 45 -16.963 9.910 7.587 1.00 0.00 C ATOM 673 OE1 GLU A 45 -18.136 10.161 7.243 1.00 0.00 O ATOM 674 OE2 GLU A 45 -16.614 8.820 8.088 1.00 0.00 O ATOM 0 H GLU A 45 -13.856 12.470 7.530 1.00 0.00 H new ATOM 0 HA GLU A 45 -16.168 13.645 6.614 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -15.773 12.115 9.208 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -17.288 12.315 8.350 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -15.850 11.252 6.343 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -14.935 10.591 7.683 1.00 0.00 H new ATOM 681 N GLU A 46 -15.135 14.966 9.429 1.00 0.00 N ATOM 682 CA GLU A 46 -15.309 16.101 10.322 1.00 0.00 C ATOM 683 C GLU A 46 -15.240 17.399 9.527 1.00 0.00 C ATOM 684 O GLU A 46 -15.789 18.418 9.938 1.00 0.00 O ATOM 685 CB GLU A 46 -14.237 16.094 11.413 1.00 0.00 C ATOM 686 CG GLU A 46 -14.606 15.250 12.622 1.00 0.00 C ATOM 687 CD GLU A 46 -13.523 15.249 13.684 1.00 0.00 C ATOM 688 OE1 GLU A 46 -12.360 15.555 13.346 1.00 0.00 O ATOM 689 OE2 GLU A 46 -13.838 14.942 14.852 1.00 0.00 O ATOM 0 H GLU A 46 -14.304 14.404 9.616 1.00 0.00 H new ATOM 0 HA GLU A 46 -16.286 16.025 10.799 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -13.304 15.721 10.991 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -14.054 17.118 11.737 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -15.533 15.626 13.054 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -14.796 14.226 12.301 1.00 0.00 H new ATOM 696 N VAL A 47 -14.570 17.339 8.376 1.00 0.00 N ATOM 697 CA VAL A 47 -14.432 18.491 7.498 1.00 0.00 C ATOM 698 C VAL A 47 -15.496 18.452 6.407 1.00 0.00 C ATOM 699 O VAL A 47 -16.105 19.471 6.083 1.00 0.00 O ATOM 700 CB VAL A 47 -13.010 18.561 6.875 1.00 0.00 C ATOM 701 CG1 VAL A 47 -13.040 18.869 5.381 1.00 0.00 C ATOM 702 CG2 VAL A 47 -12.191 19.609 7.593 1.00 0.00 C ATOM 0 H VAL A 47 -14.112 16.495 8.032 1.00 0.00 H new ATOM 0 HA VAL A 47 -14.574 19.391 8.096 1.00 0.00 H new ATOM 0 HB VAL A 47 -12.556 17.577 6.995 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -12.021 18.906 4.997 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -13.596 18.090 4.860 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -13.525 19.831 5.218 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -11.194 19.656 7.154 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -12.676 20.580 7.495 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -12.111 19.348 8.648 1.00 0.00 H new ATOM 712 N PHE A 48 -15.716 17.265 5.845 1.00 0.00 N ATOM 713 CA PHE A 48 -16.710 17.091 4.791 1.00 0.00 C ATOM 714 C PHE A 48 -18.034 17.727 5.191 1.00 0.00 C ATOM 715 O PHE A 48 -18.656 18.443 4.408 1.00 0.00 O ATOM 716 CB PHE A 48 -16.926 15.608 4.490 1.00 0.00 C ATOM 717 CG PHE A 48 -17.909 15.365 3.380 1.00 0.00 C ATOM 718 CD1 PHE A 48 -17.813 16.065 2.188 1.00 0.00 C ATOM 719 CD2 PHE A 48 -18.929 14.439 3.528 1.00 0.00 C ATOM 720 CE1 PHE A 48 -18.715 15.847 1.166 1.00 0.00 C ATOM 721 CE2 PHE A 48 -19.834 14.216 2.509 1.00 0.00 C ATOM 722 CZ PHE A 48 -19.728 14.921 1.326 1.00 0.00 C ATOM 0 H PHE A 48 -15.220 16.412 6.102 1.00 0.00 H new ATOM 0 HA PHE A 48 -16.335 17.584 3.894 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -15.971 15.155 4.226 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -17.277 15.108 5.393 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -17.023 16.790 2.057 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -19.017 13.885 4.451 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -18.629 16.400 0.242 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -20.624 13.491 2.637 1.00 0.00 H new ATOM 0 HZ PHE A 48 -20.435 14.749 0.528 1.00 0.00 H new ATOM 732 N ASN A 49 -18.455 17.457 6.421 1.00 0.00 N ATOM 733 CA ASN A 49 -19.705 18.004 6.933 1.00 0.00 C ATOM 734 C ASN A 49 -19.463 19.320 7.667 1.00 0.00 C ATOM 735 O ASN A 49 -20.366 19.853 8.312 1.00 0.00 O ATOM 736 CB ASN A 49 -20.396 17.007 7.875 1.00 0.00 C ATOM 737 CG ASN A 49 -19.884 15.585 7.720 1.00 0.00 C ATOM 738 OD1 ASN A 49 -19.585 14.910 8.706 1.00 0.00 O ATOM 739 ND2 ASN A 49 -19.780 15.123 6.480 1.00 0.00 N ATOM 0 H ASN A 49 -17.951 16.864 7.080 1.00 0.00 H new ATOM 0 HA ASN A 49 -20.356 18.190 6.079 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -20.249 17.329 8.906 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -21.469 17.023 7.686 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -19.441 14.175 6.316 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -20.039 15.716 5.691 1.00 0.00 H new ATOM 746 N LYS A 50 -18.239 19.841 7.579 1.00 0.00 N ATOM 747 CA LYS A 50 -17.901 21.092 8.253 1.00 0.00 C ATOM 748 C LYS A 50 -18.218 22.305 7.383 1.00 0.00 C ATOM 749 O LYS A 50 -18.344 22.195 6.164 1.00 0.00 O ATOM 750 CB LYS A 50 -16.422 21.106 8.627 1.00 0.00 C ATOM 751 CG LYS A 50 -16.109 21.938 9.859 1.00 0.00 C ATOM 752 CD LYS A 50 -14.651 21.793 10.269 1.00 0.00 C ATOM 753 CE LYS A 50 -14.007 23.145 10.538 1.00 0.00 C ATOM 754 NZ LYS A 50 -13.240 23.149 11.814 1.00 0.00 N ATOM 0 H LYS A 50 -17.473 19.420 7.053 1.00 0.00 H new ATOM 0 HA LYS A 50 -18.509 21.152 9.155 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -16.090 20.082 8.798 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -15.847 21.491 7.785 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -16.330 22.986 9.658 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -16.753 21.629 10.682 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -14.584 21.173 11.163 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -14.101 21.278 9.482 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -13.342 23.401 9.713 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -14.779 23.914 10.576 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -12.817 24.087 11.962 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -13.880 22.930 12.604 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -12.487 22.433 11.769 1.00 0.00 H new ATOM 768 N GLU A 51 -18.328 23.465 8.026 1.00 0.00 N ATOM 769 CA GLU A 51 -18.613 24.709 7.322 1.00 0.00 C ATOM 770 C GLU A 51 -17.328 25.434 6.994 1.00 0.00 C ATOM 771 O GLU A 51 -17.240 26.125 5.979 1.00 0.00 O ATOM 772 CB GLU A 51 -19.540 25.604 8.145 1.00 0.00 C ATOM 773 CG GLU A 51 -21.016 25.372 7.867 1.00 0.00 C ATOM 774 CD GLU A 51 -21.635 24.359 8.811 1.00 0.00 C ATOM 775 OE1 GLU A 51 -21.394 24.461 10.033 1.00 0.00 O ATOM 776 OE2 GLU A 51 -22.361 23.465 8.330 1.00 0.00 O ATOM 0 H GLU A 51 -18.224 23.568 9.035 1.00 0.00 H new ATOM 0 HA GLU A 51 -19.122 24.464 6.390 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -19.348 25.435 9.205 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -19.300 26.647 7.940 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -21.551 26.318 7.953 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -21.139 25.028 6.840 1.00 0.00 H new ATOM 783 N ASP A 52 -16.310 25.244 7.823 1.00 0.00 N ATOM 784 CA ASP A 52 -15.030 25.859 7.548 1.00 0.00 C ATOM 785 C ASP A 52 -14.245 24.990 6.588 1.00 0.00 C ATOM 786 O ASP A 52 -13.043 25.177 6.407 1.00 0.00 O ATOM 787 CB ASP A 52 -14.217 26.108 8.815 1.00 0.00 C ATOM 788 CG ASP A 52 -15.061 26.638 9.957 1.00 0.00 C ATOM 789 OD1 ASP A 52 -16.048 25.967 10.326 1.00 0.00 O ATOM 790 OD2 ASP A 52 -14.734 27.722 10.484 1.00 0.00 O ATOM 0 H ASP A 52 -16.348 24.681 8.672 1.00 0.00 H new ATOM 0 HA ASP A 52 -15.224 26.833 7.098 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -13.739 25.178 9.123 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -13.420 26.819 8.597 1.00 0.00 H new ATOM 795 N ALA A 53 -14.946 24.064 5.933 1.00 0.00 N ATOM 796 CA ALA A 53 -14.334 23.203 4.950 1.00 0.00 C ATOM 797 C ALA A 53 -14.143 24.022 3.696 1.00 0.00 C ATOM 798 O ALA A 53 -14.590 23.663 2.611 1.00 0.00 O ATOM 799 CB ALA A 53 -15.193 21.977 4.687 1.00 0.00 C ATOM 0 H ALA A 53 -15.943 23.899 6.074 1.00 0.00 H new ATOM 0 HA ALA A 53 -13.374 22.833 5.309 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -14.708 21.346 3.942 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -15.318 21.415 5.613 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -16.170 22.289 4.317 1.00 0.00 H new ATOM 805 N THR A 54 -13.498 25.158 3.897 1.00 0.00 N ATOM 806 CA THR A 54 -13.226 26.116 2.846 1.00 0.00 C ATOM 807 C THR A 54 -11.785 25.993 2.362 1.00 0.00 C ATOM 808 O THR A 54 -11.308 24.904 2.050 1.00 0.00 O ATOM 809 CB THR A 54 -13.526 27.526 3.369 1.00 0.00 C ATOM 810 OG1 THR A 54 -12.494 27.975 4.230 1.00 0.00 O ATOM 811 CG2 THR A 54 -14.829 27.613 4.136 1.00 0.00 C ATOM 0 H THR A 54 -13.144 25.443 4.810 1.00 0.00 H new ATOM 0 HA THR A 54 -13.868 25.913 1.989 1.00 0.00 H new ATOM 0 HB THR A 54 -13.599 28.153 2.480 1.00 0.00 H new ATOM 0 HG1 THR A 54 -12.313 28.922 4.057 1.00 0.00 H new ATOM 0 HG21 THR A 54 -14.982 28.636 4.479 1.00 0.00 H new ATOM 0 HG22 THR A 54 -15.654 27.321 3.486 1.00 0.00 H new ATOM 0 HG23 THR A 54 -14.790 26.945 4.996 1.00 0.00 H new ATOM 819 N GLU A 55 -11.109 27.115 2.292 1.00 0.00 N ATOM 820 CA GLU A 55 -9.724 27.152 1.831 1.00 0.00 C ATOM 821 C GLU A 55 -8.749 26.716 2.924 1.00 0.00 C ATOM 822 O GLU A 55 -7.567 26.501 2.657 1.00 0.00 O ATOM 823 CB GLU A 55 -9.367 28.559 1.352 1.00 0.00 C ATOM 824 CG GLU A 55 -9.932 28.897 -0.018 1.00 0.00 C ATOM 825 CD GLU A 55 -9.082 29.904 -0.768 1.00 0.00 C ATOM 826 OE1 GLU A 55 -9.196 31.113 -0.474 1.00 0.00 O ATOM 827 OE2 GLU A 55 -8.300 29.484 -1.647 1.00 0.00 O ATOM 0 H GLU A 55 -11.491 28.025 2.548 1.00 0.00 H new ATOM 0 HA GLU A 55 -9.635 26.448 1.003 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -9.735 29.285 2.077 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -8.282 28.660 1.323 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -10.013 27.984 -0.609 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -10.941 29.293 0.097 1.00 0.00 H new ATOM 834 N GLU A 56 -9.231 26.610 4.157 1.00 0.00 N ATOM 835 CA GLU A 56 -8.375 26.218 5.272 1.00 0.00 C ATOM 836 C GLU A 56 -8.477 24.727 5.612 1.00 0.00 C ATOM 837 O GLU A 56 -7.492 23.994 5.535 1.00 0.00 O ATOM 838 CB GLU A 56 -8.711 27.049 6.512 1.00 0.00 C ATOM 839 CG GLU A 56 -7.649 28.081 6.855 1.00 0.00 C ATOM 840 CD GLU A 56 -8.097 29.040 7.939 1.00 0.00 C ATOM 841 OE1 GLU A 56 -9.208 29.599 7.815 1.00 0.00 O ATOM 842 OE2 GLU A 56 -7.338 29.234 8.912 1.00 0.00 O ATOM 0 H GLU A 56 -10.203 26.788 4.410 1.00 0.00 H new ATOM 0 HA GLU A 56 -7.349 26.407 4.957 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -9.662 27.557 6.353 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -8.845 26.381 7.362 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -6.742 27.570 7.179 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -7.393 28.646 5.958 1.00 0.00 H new ATOM 849 N GLU A 57 -9.662 24.310 6.050 1.00 0.00 N ATOM 850 CA GLU A 57 -9.899 22.931 6.485 1.00 0.00 C ATOM 851 C GLU A 57 -9.817 21.880 5.370 1.00 0.00 C ATOM 852 O GLU A 57 -9.346 20.770 5.611 1.00 0.00 O ATOM 853 CB GLU A 57 -11.263 22.845 7.170 1.00 0.00 C ATOM 854 CG GLU A 57 -11.208 22.235 8.559 1.00 0.00 C ATOM 855 CD GLU A 57 -10.582 23.163 9.581 1.00 0.00 C ATOM 856 OE1 GLU A 57 -11.026 24.327 9.677 1.00 0.00 O ATOM 857 OE2 GLU A 57 -9.645 22.728 10.283 1.00 0.00 O ATOM 0 H GLU A 57 -10.483 24.912 6.114 1.00 0.00 H new ATOM 0 HA GLU A 57 -9.089 22.692 7.174 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -11.690 23.846 7.238 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -11.936 22.253 6.549 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -12.218 21.978 8.879 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -10.639 21.306 8.521 1.00 0.00 H new ATOM 864 N ILE A 58 -10.289 22.201 4.172 1.00 0.00 N ATOM 865 CA ILE A 58 -10.268 21.232 3.075 1.00 0.00 C ATOM 866 C ILE A 58 -8.857 20.748 2.787 1.00 0.00 C ATOM 867 O ILE A 58 -8.527 19.589 3.033 1.00 0.00 O ATOM 868 CB ILE A 58 -10.873 21.815 1.789 1.00 0.00 C ATOM 869 CG1 ILE A 58 -12.266 22.364 2.079 1.00 0.00 C ATOM 870 CG2 ILE A 58 -10.931 20.759 0.691 1.00 0.00 C ATOM 871 CD1 ILE A 58 -12.925 23.022 0.889 1.00 0.00 C ATOM 0 H ILE A 58 -10.686 23.110 3.933 1.00 0.00 H new ATOM 0 HA ILE A 58 -10.876 20.387 3.399 1.00 0.00 H new ATOM 0 HB ILE A 58 -10.237 22.628 1.439 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -12.901 21.550 2.429 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -12.199 23.088 2.891 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -11.363 21.194 -0.210 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -9.924 20.403 0.475 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -11.548 19.924 1.022 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -13.912 23.387 1.175 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -12.313 23.858 0.551 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -13.026 22.296 0.082 1.00 0.00 H new ATOM 883 N ASN A 59 -8.025 21.642 2.272 1.00 0.00 N ATOM 884 CA ASN A 59 -6.637 21.294 1.962 1.00 0.00 C ATOM 885 C ASN A 59 -5.986 20.645 3.177 1.00 0.00 C ATOM 886 O ASN A 59 -5.065 19.838 3.053 1.00 0.00 O ATOM 887 CB ASN A 59 -5.830 22.529 1.542 1.00 0.00 C ATOM 888 CG ASN A 59 -6.652 23.529 0.757 1.00 0.00 C ATOM 889 OD1 ASN A 59 -6.651 23.528 -0.474 1.00 0.00 O ATOM 890 ND2 ASN A 59 -7.359 24.391 1.473 1.00 0.00 N ATOM 0 H ASN A 59 -8.279 22.607 2.060 1.00 0.00 H new ATOM 0 HA ASN A 59 -6.643 20.594 1.127 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -5.428 23.014 2.431 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -4.978 22.213 0.939 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -7.934 25.092 1.005 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -7.329 24.354 2.492 1.00 0.00 H new ATOM 897 N LEU A 60 -6.487 21.009 4.352 1.00 0.00 N ATOM 898 CA LEU A 60 -5.985 20.475 5.604 1.00 0.00 C ATOM 899 C LEU A 60 -6.511 19.059 5.832 1.00 0.00 C ATOM 900 O LEU A 60 -5.823 18.218 6.409 1.00 0.00 O ATOM 901 CB LEU A 60 -6.409 21.390 6.756 1.00 0.00 C ATOM 902 CG LEU A 60 -5.317 22.325 7.280 1.00 0.00 C ATOM 903 CD1 LEU A 60 -5.918 23.651 7.729 1.00 0.00 C ATOM 904 CD2 LEU A 60 -4.557 21.668 8.422 1.00 0.00 C ATOM 0 H LEU A 60 -7.248 21.679 4.459 1.00 0.00 H new ATOM 0 HA LEU A 60 -4.897 20.431 5.560 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -7.255 21.994 6.427 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -6.761 20.770 7.581 1.00 0.00 H new ATOM 0 HG LEU A 60 -4.616 22.524 6.470 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -5.126 24.303 8.098 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -6.417 24.128 6.886 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -6.641 23.472 8.525 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -3.784 22.347 8.783 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -5.247 21.439 9.234 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -4.094 20.746 8.069 1.00 0.00 H new ATOM 916 N ALA A 61 -7.741 18.806 5.384 1.00 0.00 N ATOM 917 CA ALA A 61 -8.359 17.493 5.551 1.00 0.00 C ATOM 918 C ALA A 61 -8.116 16.580 4.347 1.00 0.00 C ATOM 919 O ALA A 61 -8.274 15.364 4.442 1.00 0.00 O ATOM 920 CB ALA A 61 -9.850 17.652 5.791 1.00 0.00 C ATOM 0 H ALA A 61 -8.326 19.491 4.905 1.00 0.00 H new ATOM 0 HA ALA A 61 -7.894 17.019 6.415 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -10.305 16.669 5.915 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -10.012 18.243 6.692 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -10.304 18.157 4.939 1.00 0.00 H new ATOM 926 N LYS A 62 -7.745 17.168 3.213 1.00 0.00 N ATOM 927 CA LYS A 62 -7.497 16.401 1.996 1.00 0.00 C ATOM 928 C LYS A 62 -6.159 15.668 2.063 1.00 0.00 C ATOM 929 O LYS A 62 -6.003 14.588 1.492 1.00 0.00 O ATOM 930 CB LYS A 62 -7.536 17.322 0.771 1.00 0.00 C ATOM 931 CG LYS A 62 -6.250 18.101 0.539 1.00 0.00 C ATOM 932 CD LYS A 62 -6.339 18.969 -0.706 1.00 0.00 C ATOM 933 CE LYS A 62 -5.950 18.194 -1.954 1.00 0.00 C ATOM 934 NZ LYS A 62 -6.409 18.875 -3.197 1.00 0.00 N ATOM 0 H LYS A 62 -7.609 18.174 3.112 1.00 0.00 H new ATOM 0 HA LYS A 62 -8.285 15.653 1.905 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -7.750 16.723 -0.114 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -8.360 18.027 0.886 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -6.042 18.728 1.406 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -5.416 17.406 0.440 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -7.355 19.349 -0.814 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -5.685 19.834 -0.595 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -4.867 18.075 -1.984 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -6.380 17.193 -1.909 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -5.803 18.590 -3.993 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -7.393 18.605 -3.397 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -6.352 19.906 -3.070 1.00 0.00 H new ATOM 948 N GLU A 63 -5.194 16.267 2.756 1.00 0.00 N ATOM 949 CA GLU A 63 -3.862 15.680 2.892 1.00 0.00 C ATOM 950 C GLU A 63 -3.937 14.198 3.252 1.00 0.00 C ATOM 951 O GLU A 63 -3.529 13.338 2.471 1.00 0.00 O ATOM 952 CB GLU A 63 -3.060 16.433 3.955 1.00 0.00 C ATOM 953 CG GLU A 63 -1.578 16.096 3.950 1.00 0.00 C ATOM 954 CD GLU A 63 -0.974 16.105 5.341 1.00 0.00 C ATOM 955 OE1 GLU A 63 -1.422 15.305 6.188 1.00 0.00 O ATOM 956 OE2 GLU A 63 -0.052 16.913 5.582 1.00 0.00 O ATOM 0 H GLU A 63 -5.309 17.161 3.234 1.00 0.00 H new ATOM 0 HA GLU A 63 -3.360 15.768 1.928 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -3.181 17.505 3.798 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -3.473 16.206 4.938 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -1.434 15.113 3.502 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -1.048 16.813 3.323 1.00 0.00 H new ATOM 963 N SER A 64 -4.457 13.907 4.439 1.00 0.00 N ATOM 964 CA SER A 64 -4.582 12.534 4.905 1.00 0.00 C ATOM 965 C SER A 64 -5.639 11.768 4.112 1.00 0.00 C ATOM 966 O SER A 64 -5.718 10.548 4.197 1.00 0.00 O ATOM 967 CB SER A 64 -4.934 12.511 6.393 1.00 0.00 C ATOM 968 OG SER A 64 -4.305 11.424 7.049 1.00 0.00 O ATOM 0 H SER A 64 -4.799 14.607 5.097 1.00 0.00 H new ATOM 0 HA SER A 64 -3.621 12.043 4.751 1.00 0.00 H new ATOM 0 HB2 SER A 64 -4.626 13.448 6.857 1.00 0.00 H new ATOM 0 HB3 SER A 64 -6.015 12.436 6.513 1.00 0.00 H new ATOM 0 HG SER A 64 -4.545 11.432 7.999 1.00 0.00 H new ATOM 974 N LEU A 65 -6.447 12.483 3.339 1.00 0.00 N ATOM 975 CA LEU A 65 -7.489 11.849 2.543 1.00 0.00 C ATOM 976 C LEU A 65 -6.895 11.218 1.297 1.00 0.00 C ATOM 977 O LEU A 65 -7.275 10.119 0.894 1.00 0.00 O ATOM 978 CB LEU A 65 -8.549 12.877 2.152 1.00 0.00 C ATOM 979 CG LEU A 65 -9.849 12.794 2.947 1.00 0.00 C ATOM 980 CD1 LEU A 65 -10.812 13.886 2.503 1.00 0.00 C ATOM 981 CD2 LEU A 65 -10.484 11.418 2.793 1.00 0.00 C ATOM 0 H LEU A 65 -6.401 13.498 3.247 1.00 0.00 H new ATOM 0 HA LEU A 65 -7.955 11.067 3.142 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -8.129 13.875 2.274 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -8.779 12.755 1.094 1.00 0.00 H new ATOM 0 HG LEU A 65 -9.621 12.946 4.002 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -11.735 13.814 3.079 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -10.356 14.862 2.668 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -11.036 13.765 1.443 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -11.410 11.378 3.367 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -10.701 11.233 1.741 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -9.796 10.657 3.161 1.00 0.00 H new ATOM 993 N GLU A 66 -5.960 11.933 0.689 1.00 0.00 N ATOM 994 CA GLU A 66 -5.304 11.460 -0.520 1.00 0.00 C ATOM 995 C GLU A 66 -3.997 10.732 -0.207 1.00 0.00 C ATOM 996 O GLU A 66 -3.383 10.142 -1.094 1.00 0.00 O ATOM 997 CB GLU A 66 -5.033 12.631 -1.466 1.00 0.00 C ATOM 998 CG GLU A 66 -6.173 12.910 -2.431 1.00 0.00 C ATOM 999 CD GLU A 66 -5.687 13.365 -3.794 1.00 0.00 C ATOM 1000 OE1 GLU A 66 -5.022 12.563 -4.483 1.00 0.00 O ATOM 1001 OE2 GLU A 66 -5.969 14.521 -4.170 1.00 0.00 O ATOM 0 H GLU A 66 -5.638 12.845 1.014 1.00 0.00 H new ATOM 0 HA GLU A 66 -5.976 10.750 -1.002 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -4.840 13.527 -0.876 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -4.128 12.424 -2.037 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -6.775 12.009 -2.547 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -6.823 13.675 -2.007 1.00 0.00 H new ATOM 1008 N GLY A 67 -3.570 10.781 1.053 1.00 0.00 N ATOM 1009 CA GLY A 67 -2.332 10.126 1.437 1.00 0.00 C ATOM 1010 C GLY A 67 -2.542 8.951 2.374 1.00 0.00 C ATOM 1011 O GLY A 67 -1.637 8.138 2.561 1.00 0.00 O ATOM 0 H GLY A 67 -4.057 11.260 1.811 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -1.819 9.780 0.540 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -1.678 10.853 1.918 1.00 0.00 H new ATOM 1015 N ALA A 68 -3.727 8.858 2.971 1.00 0.00 N ATOM 1016 CA ALA A 68 -4.021 7.769 3.895 1.00 0.00 C ATOM 1017 C ALA A 68 -4.754 6.623 3.200 1.00 0.00 C ATOM 1018 O ALA A 68 -4.496 5.455 3.491 1.00 0.00 O ATOM 1019 CB ALA A 68 -4.820 8.277 5.081 1.00 0.00 C ATOM 0 H ALA A 68 -4.493 9.518 2.833 1.00 0.00 H new ATOM 0 HA ALA A 68 -3.071 7.378 4.258 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -5.030 7.450 5.759 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -4.246 9.041 5.606 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -5.759 8.706 4.730 1.00 0.00 H new ATOM 1025 N ILE A 69 -5.647 6.946 2.261 1.00 0.00 N ATOM 1026 CA ILE A 69 -6.365 5.917 1.531 1.00 0.00 C ATOM 1027 C ILE A 69 -5.375 5.158 0.685 1.00 0.00 C ATOM 1028 O ILE A 69 -5.379 3.929 0.636 1.00 0.00 O ATOM 1029 CB ILE A 69 -7.467 6.498 0.614 1.00 0.00 C ATOM 1030 CG1 ILE A 69 -6.869 7.416 -0.460 1.00 0.00 C ATOM 1031 CG2 ILE A 69 -8.500 7.243 1.435 1.00 0.00 C ATOM 1032 CD1 ILE A 69 -7.911 8.176 -1.258 1.00 0.00 C ATOM 0 H ILE A 69 -5.883 7.902 1.996 1.00 0.00 H new ATOM 0 HA ILE A 69 -6.855 5.269 2.258 1.00 0.00 H new ATOM 0 HB ILE A 69 -7.957 5.666 0.108 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -6.197 8.130 0.017 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -6.266 6.818 -1.143 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -9.268 7.646 0.775 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -8.958 6.560 2.150 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -8.018 8.060 1.971 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -7.415 8.804 -1.998 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -8.569 7.469 -1.764 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -8.499 8.802 -0.586 1.00 0.00 H new ATOM 1044 N ALA A 70 -4.504 5.919 0.036 1.00 0.00 N ATOM 1045 CA ALA A 70 -3.475 5.342 -0.803 1.00 0.00 C ATOM 1046 C ALA A 70 -2.634 4.346 -0.010 1.00 0.00 C ATOM 1047 O ALA A 70 -2.025 3.439 -0.578 1.00 0.00 O ATOM 1048 CB ALA A 70 -2.605 6.438 -1.396 1.00 0.00 C ATOM 0 H ALA A 70 -4.494 6.938 0.078 1.00 0.00 H new ATOM 0 HA ALA A 70 -3.952 4.803 -1.622 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -1.835 5.991 -2.025 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -3.221 7.107 -1.997 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -2.134 7.003 -0.592 1.00 0.00 H new ATOM 1054 N ARG A 71 -2.618 4.517 1.310 1.00 0.00 N ATOM 1055 CA ARG A 71 -1.870 3.630 2.189 1.00 0.00 C ATOM 1056 C ARG A 71 -2.727 2.435 2.592 1.00 0.00 C ATOM 1057 O ARG A 71 -2.341 1.285 2.382 1.00 0.00 O ATOM 1058 CB ARG A 71 -1.402 4.387 3.435 1.00 0.00 C ATOM 1059 CG ARG A 71 0.067 4.171 3.763 1.00 0.00 C ATOM 1060 CD ARG A 71 0.968 4.922 2.796 1.00 0.00 C ATOM 1061 NE ARG A 71 2.382 4.668 3.059 1.00 0.00 N ATOM 1062 CZ ARG A 71 3.370 5.444 2.615 1.00 0.00 C ATOM 1063 NH1 ARG A 71 3.101 6.521 1.886 1.00 0.00 N ATOM 1064 NH2 ARG A 71 4.628 5.142 2.899 1.00 0.00 N ATOM 0 H ARG A 71 -3.117 5.265 1.793 1.00 0.00 H new ATOM 0 HA ARG A 71 -0.995 3.266 1.650 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -1.581 5.453 3.291 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -2.006 4.075 4.287 1.00 0.00 H new ATOM 0 HG2 ARG A 71 0.267 4.504 4.782 1.00 0.00 H new ATOM 0 HG3 ARG A 71 0.297 3.106 3.725 1.00 0.00 H new ATOM 0 HD2 ARG A 71 0.730 4.626 1.774 1.00 0.00 H new ATOM 0 HD3 ARG A 71 0.771 5.991 2.872 1.00 0.00 H new ATOM 0 HE ARG A 71 2.628 3.849 3.615 1.00 0.00 H new ATOM 0 HH11 ARG A 71 2.134 6.758 1.663 1.00 0.00 H new ATOM 0 HH12 ARG A 71 3.861 7.111 1.549 1.00 0.00 H new ATOM 0 HH21 ARG A 71 4.840 4.315 3.458 1.00 0.00 H new ATOM 0 HH22 ARG A 71 5.384 5.736 2.559 1.00 0.00 H new ATOM 1078 N PHE A 72 -3.897 2.712 3.168 1.00 0.00 N ATOM 1079 CA PHE A 72 -4.809 1.669 3.594 1.00 0.00 C ATOM 1080 C PHE A 72 -5.105 0.684 2.464 1.00 0.00 C ATOM 1081 O PHE A 72 -5.202 -0.522 2.689 1.00 0.00 O ATOM 1082 CB PHE A 72 -6.096 2.306 4.089 1.00 0.00 C ATOM 1083 CG PHE A 72 -7.058 1.323 4.657 1.00 0.00 C ATOM 1084 CD1 PHE A 72 -6.795 0.682 5.854 1.00 0.00 C ATOM 1085 CD2 PHE A 72 -8.232 1.052 3.999 1.00 0.00 C ATOM 1086 CE1 PHE A 72 -7.696 -0.221 6.379 1.00 0.00 C ATOM 1087 CE2 PHE A 72 -9.134 0.163 4.514 1.00 0.00 C ATOM 1088 CZ PHE A 72 -8.871 -0.481 5.707 1.00 0.00 C ATOM 0 H PHE A 72 -4.230 3.659 3.348 1.00 0.00 H new ATOM 0 HA PHE A 72 -4.340 1.106 4.400 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -5.856 3.050 4.849 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -6.572 2.835 3.264 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -5.876 0.890 6.382 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -8.446 1.547 3.063 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -7.482 -0.722 7.312 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -10.055 -0.036 3.986 1.00 0.00 H new ATOM 0 HZ PHE A 72 -9.583 -1.185 6.112 1.00 0.00 H new ATOM 1098 N ASN A 73 -5.241 1.207 1.250 1.00 0.00 N ATOM 1099 CA ASN A 73 -5.517 0.376 0.082 1.00 0.00 C ATOM 1100 C ASN A 73 -4.463 -0.713 -0.059 1.00 0.00 C ATOM 1101 O ASN A 73 -4.734 -1.799 -0.569 1.00 0.00 O ATOM 1102 CB ASN A 73 -5.535 1.232 -1.189 1.00 0.00 C ATOM 1103 CG ASN A 73 -6.816 2.023 -1.349 1.00 0.00 C ATOM 1104 OD1 ASN A 73 -7.905 1.454 -1.433 1.00 0.00 O ATOM 1105 ND2 ASN A 73 -6.692 3.345 -1.402 1.00 0.00 N ATOM 0 H ASN A 73 -5.165 2.204 1.048 1.00 0.00 H new ATOM 0 HA ASN A 73 -6.494 -0.087 0.219 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -4.689 1.920 -1.170 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -5.402 0.587 -2.057 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -7.519 3.931 -1.516 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -5.770 3.774 -1.328 1.00 0.00 H new ATOM 1112 N SER A 74 -3.253 -0.402 0.391 1.00 0.00 N ATOM 1113 CA SER A 74 -2.141 -1.344 0.311 1.00 0.00 C ATOM 1114 C SER A 74 -1.787 -1.916 1.683 1.00 0.00 C ATOM 1115 O SER A 74 -0.612 -2.021 2.037 1.00 0.00 O ATOM 1116 CB SER A 74 -0.918 -0.656 -0.299 1.00 0.00 C ATOM 1117 OG SER A 74 -0.930 -0.750 -1.712 1.00 0.00 O ATOM 0 H SER A 74 -3.016 0.495 0.815 1.00 0.00 H new ATOM 0 HA SER A 74 -2.450 -2.173 -0.326 1.00 0.00 H new ATOM 0 HB2 SER A 74 -0.901 0.393 -0.002 1.00 0.00 H new ATOM 0 HB3 SER A 74 -0.008 -1.113 0.091 1.00 0.00 H new ATOM 0 HG SER A 74 -0.139 -0.301 -2.076 1.00 0.00 H new ATOM 1123 N LEU A 75 -2.806 -2.292 2.451 1.00 0.00 N ATOM 1124 CA LEU A 75 -2.588 -2.858 3.780 1.00 0.00 C ATOM 1125 C LEU A 75 -3.252 -4.229 3.913 1.00 0.00 C ATOM 1126 O LEU A 75 -2.774 -5.092 4.650 1.00 0.00 O ATOM 1127 CB LEU A 75 -3.103 -1.902 4.859 1.00 0.00 C ATOM 1128 CG LEU A 75 -2.011 -1.057 5.521 1.00 0.00 C ATOM 1129 CD1 LEU A 75 -2.395 0.413 5.552 1.00 0.00 C ATOM 1130 CD2 LEU A 75 -1.719 -1.560 6.925 1.00 0.00 C ATOM 0 H LEU A 75 -3.786 -2.216 2.178 1.00 0.00 H new ATOM 0 HA LEU A 75 -1.515 -2.993 3.918 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -3.843 -1.236 4.416 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -3.615 -2.481 5.628 1.00 0.00 H new ATOM 0 HG LEU A 75 -1.106 -1.156 4.922 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -1.600 0.987 6.028 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -2.542 0.772 4.533 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -3.319 0.536 6.117 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -0.940 -0.946 7.377 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -2.625 -1.500 7.529 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -1.382 -2.596 6.878 1.00 0.00 H new ATOM 1142 N LEU A 76 -4.341 -4.427 3.176 1.00 0.00 N ATOM 1143 CA LEU A 76 -5.074 -5.694 3.179 1.00 0.00 C ATOM 1144 C LEU A 76 -4.328 -6.741 2.364 1.00 0.00 C ATOM 1145 O LEU A 76 -4.898 -7.381 1.481 1.00 0.00 O ATOM 1146 CB LEU A 76 -6.474 -5.489 2.589 1.00 0.00 C ATOM 1147 CG LEU A 76 -6.549 -4.648 1.302 1.00 0.00 C ATOM 1148 CD1 LEU A 76 -6.734 -3.174 1.634 1.00 0.00 C ATOM 1149 CD2 LEU A 76 -5.314 -4.851 0.422 1.00 0.00 C ATOM 0 H LEU A 76 -4.741 -3.718 2.561 1.00 0.00 H new ATOM 0 HA LEU A 76 -5.161 -6.042 4.208 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -6.907 -6.468 2.385 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -7.099 -5.015 3.346 1.00 0.00 H new ATOM 0 HG LEU A 76 -7.416 -4.989 0.736 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -6.785 -2.597 0.711 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -7.658 -3.041 2.196 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -5.892 -2.827 2.233 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -5.404 -4.241 -0.477 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -4.422 -4.555 0.974 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -5.236 -5.901 0.141 1.00 0.00 H new ATOM 1161 N ILE A 77 -3.041 -6.883 2.638 1.00 0.00 N ATOM 1162 CA ILE A 77 -2.210 -7.820 1.897 1.00 0.00 C ATOM 1163 C ILE A 77 -2.334 -7.509 0.426 1.00 0.00 C ATOM 1164 O ILE A 77 -2.740 -8.358 -0.366 1.00 0.00 O ATOM 1165 CB ILE A 77 -2.614 -9.287 2.150 1.00 0.00 C ATOM 1166 CG1 ILE A 77 -3.049 -9.481 3.603 1.00 0.00 C ATOM 1167 CG2 ILE A 77 -1.463 -10.219 1.805 1.00 0.00 C ATOM 1168 CD1 ILE A 77 -1.955 -9.204 4.609 1.00 0.00 C ATOM 0 H ILE A 77 -2.550 -6.364 3.366 1.00 0.00 H new ATOM 0 HA ILE A 77 -1.180 -7.706 2.237 1.00 0.00 H new ATOM 0 HB ILE A 77 -3.459 -9.530 1.506 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -3.895 -8.825 3.810 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -3.400 -10.505 3.734 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -1.763 -11.251 1.989 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -1.200 -10.099 0.754 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -0.600 -9.976 2.425 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -2.339 -9.363 5.617 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -1.117 -9.877 4.430 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -1.620 -8.172 4.507 1.00 0.00 H new ATOM 1180 N GLU A 78 -2.006 -6.256 0.087 1.00 0.00 N ATOM 1181 CA GLU A 78 -2.089 -5.761 -1.281 1.00 0.00 C ATOM 1182 C GLU A 78 -2.329 -6.896 -2.255 1.00 0.00 C ATOM 1183 O GLU A 78 -1.575 -7.863 -2.304 1.00 0.00 O ATOM 1184 CB GLU A 78 -0.826 -4.991 -1.659 1.00 0.00 C ATOM 1185 CG GLU A 78 -0.528 -3.831 -0.724 1.00 0.00 C ATOM 1186 CD GLU A 78 0.831 -3.945 -0.062 1.00 0.00 C ATOM 1187 OE1 GLU A 78 1.836 -3.560 -0.697 1.00 0.00 O ATOM 1188 OE2 GLU A 78 0.892 -4.419 1.092 1.00 0.00 O ATOM 0 H GLU A 78 -1.676 -5.562 0.758 1.00 0.00 H new ATOM 0 HA GLU A 78 -2.937 -5.078 -1.337 1.00 0.00 H new ATOM 0 HB2 GLU A 78 0.022 -5.676 -1.660 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -0.930 -4.612 -2.676 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -0.577 -2.897 -1.284 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -1.299 -3.783 0.045 1.00 0.00 H new ATOM 1195 N GLU A 79 -3.396 -6.775 -3.010 1.00 0.00 N ATOM 1196 CA GLU A 79 -3.776 -7.790 -3.980 1.00 0.00 C ATOM 1197 C GLU A 79 -2.566 -8.314 -4.764 1.00 0.00 C ATOM 1198 O GLU A 79 -2.614 -9.407 -5.329 1.00 0.00 O ATOM 1199 CB GLU A 79 -4.829 -7.218 -4.922 1.00 0.00 C ATOM 1200 CG GLU A 79 -5.880 -6.372 -4.207 1.00 0.00 C ATOM 1201 CD GLU A 79 -7.290 -6.673 -4.675 1.00 0.00 C ATOM 1202 OE1 GLU A 79 -7.792 -7.777 -4.376 1.00 0.00 O ATOM 1203 OE2 GLU A 79 -7.892 -5.804 -5.341 1.00 0.00 O ATOM 0 H GLU A 79 -4.027 -5.975 -2.974 1.00 0.00 H new ATOM 0 HA GLU A 79 -4.194 -8.641 -3.442 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -4.337 -6.609 -5.680 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -5.324 -8.037 -5.443 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -5.813 -6.547 -3.133 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -5.664 -5.316 -4.372 1.00 0.00 H new ATOM 1210 N SER A 80 -1.485 -7.534 -4.795 1.00 0.00 N ATOM 1211 CA SER A 80 -0.278 -7.933 -5.510 1.00 0.00 C ATOM 1212 C SER A 80 0.925 -8.153 -4.578 1.00 0.00 C ATOM 1213 O SER A 80 2.039 -8.358 -5.061 1.00 0.00 O ATOM 1214 CB SER A 80 0.077 -6.882 -6.563 1.00 0.00 C ATOM 1215 OG SER A 80 0.553 -7.490 -7.752 1.00 0.00 O ATOM 0 H SER A 80 -1.423 -6.626 -4.334 1.00 0.00 H new ATOM 0 HA SER A 80 -0.496 -8.889 -5.987 1.00 0.00 H new ATOM 0 HB2 SER A 80 -0.801 -6.276 -6.787 1.00 0.00 H new ATOM 0 HB3 SER A 80 0.836 -6.208 -6.167 1.00 0.00 H new ATOM 0 HG SER A 80 0.771 -6.797 -8.409 1.00 0.00 H new ATOM 1221 N THR A 81 0.723 -8.126 -3.252 1.00 0.00 N ATOM 1222 CA THR A 81 1.838 -8.340 -2.330 1.00 0.00 C ATOM 1223 C THR A 81 2.464 -9.704 -2.553 1.00 0.00 C ATOM 1224 O THR A 81 2.147 -10.397 -3.520 1.00 0.00 O ATOM 1225 CB THR A 81 1.389 -8.196 -0.876 1.00 0.00 C ATOM 1226 OG1 THR A 81 0.013 -8.490 -0.736 1.00 0.00 O ATOM 1227 CG2 THR A 81 1.627 -6.810 -0.329 1.00 0.00 C ATOM 0 H THR A 81 -0.180 -7.962 -2.807 1.00 0.00 H new ATOM 0 HA THR A 81 2.587 -7.574 -2.532 1.00 0.00 H new ATOM 0 HB THR A 81 1.991 -8.907 -0.311 1.00 0.00 H new ATOM 0 HG1 THR A 81 -0.513 -7.857 -1.268 1.00 0.00 H new ATOM 0 HG21 THR A 81 1.290 -6.765 0.707 1.00 0.00 H new ATOM 0 HG22 THR A 81 2.691 -6.579 -0.374 1.00 0.00 H new ATOM 0 HG23 THR A 81 1.072 -6.084 -0.923 1.00 0.00 H new ATOM 1235 N GLY A 82 3.380 -10.067 -1.671 1.00 0.00 N ATOM 1236 CA GLY A 82 4.067 -11.327 -1.806 1.00 0.00 C ATOM 1237 C GLY A 82 5.422 -11.129 -2.441 1.00 0.00 C ATOM 1238 O GLY A 82 6.362 -11.876 -2.171 1.00 0.00 O ATOM 0 H GLY A 82 3.659 -9.509 -0.864 1.00 0.00 H new ATOM 0 HA2 GLY A 82 4.183 -11.791 -0.826 1.00 0.00 H new ATOM 0 HA3 GLY A 82 3.471 -12.009 -2.413 1.00 0.00 H new ATOM 1242 N ASP A 83 5.527 -10.098 -3.278 1.00 0.00 N ATOM 1243 CA ASP A 83 6.782 -9.788 -3.939 1.00 0.00 C ATOM 1244 C ASP A 83 7.567 -8.775 -3.116 1.00 0.00 C ATOM 1245 O ASP A 83 7.653 -7.597 -3.462 1.00 0.00 O ATOM 1246 CB ASP A 83 6.524 -9.245 -5.349 1.00 0.00 C ATOM 1247 CG ASP A 83 7.113 -10.132 -6.427 1.00 0.00 C ATOM 1248 OD1 ASP A 83 8.348 -10.326 -6.428 1.00 0.00 O ATOM 1249 OD2 ASP A 83 6.342 -10.634 -7.271 1.00 0.00 O ATOM 0 H ASP A 83 4.758 -9.469 -3.510 1.00 0.00 H new ATOM 0 HA ASP A 83 7.369 -10.702 -4.025 1.00 0.00 H new ATOM 0 HB2 ASP A 83 5.450 -9.150 -5.508 1.00 0.00 H new ATOM 0 HB3 ASP A 83 6.949 -8.245 -5.433 1.00 0.00 H new ATOM 1254 N PHE A 84 8.139 -9.259 -2.025 1.00 0.00 N ATOM 1255 CA PHE A 84 8.930 -8.426 -1.130 1.00 0.00 C ATOM 1256 C PHE A 84 10.274 -8.095 -1.757 1.00 0.00 C ATOM 1257 O PHE A 84 10.763 -6.970 -1.650 1.00 0.00 O ATOM 1258 CB PHE A 84 9.154 -9.141 0.203 1.00 0.00 C ATOM 1259 CG PHE A 84 7.880 -9.464 0.935 1.00 0.00 C ATOM 1260 CD1 PHE A 84 7.075 -10.517 0.526 1.00 0.00 C ATOM 1261 CD2 PHE A 84 7.485 -8.712 2.027 1.00 0.00 C ATOM 1262 CE1 PHE A 84 5.902 -10.811 1.195 1.00 0.00 C ATOM 1263 CE2 PHE A 84 6.313 -9.001 2.700 1.00 0.00 C ATOM 1264 CZ PHE A 84 5.520 -10.051 2.284 1.00 0.00 C ATOM 0 H PHE A 84 8.069 -10.234 -1.735 1.00 0.00 H new ATOM 0 HA PHE A 84 8.381 -7.501 -0.955 1.00 0.00 H new ATOM 0 HB2 PHE A 84 9.704 -10.065 0.022 1.00 0.00 H new ATOM 0 HB3 PHE A 84 9.781 -8.517 0.840 1.00 0.00 H new ATOM 0 HD1 PHE A 84 7.368 -11.114 -0.325 1.00 0.00 H new ATOM 0 HD2 PHE A 84 8.100 -7.888 2.358 1.00 0.00 H new ATOM 0 HE1 PHE A 84 5.284 -11.634 0.867 1.00 0.00 H new ATOM 0 HE2 PHE A 84 6.018 -8.405 3.551 1.00 0.00 H new ATOM 0 HZ PHE A 84 4.603 -10.278 2.808 1.00 0.00 H new ATOM 1274 N ASN A 85 10.868 -9.083 -2.413 1.00 0.00 N ATOM 1275 CA ASN A 85 12.159 -8.898 -3.057 1.00 0.00 C ATOM 1276 C ASN A 85 12.077 -7.815 -4.124 1.00 0.00 C ATOM 1277 O ASN A 85 13.088 -7.217 -4.494 1.00 0.00 O ATOM 1278 CB ASN A 85 12.631 -10.209 -3.688 1.00 0.00 C ATOM 1279 CG ASN A 85 13.115 -11.209 -2.658 1.00 0.00 C ATOM 1280 OD1 ASN A 85 14.192 -11.053 -2.083 1.00 0.00 O ATOM 1281 ND2 ASN A 85 12.320 -12.244 -2.418 1.00 0.00 N ATOM 0 H ASN A 85 10.476 -10.019 -2.512 1.00 0.00 H new ATOM 0 HA ASN A 85 12.876 -8.589 -2.297 1.00 0.00 H new ATOM 0 HB2 ASN A 85 11.813 -10.648 -4.259 1.00 0.00 H new ATOM 0 HB3 ASN A 85 13.436 -10.000 -4.393 1.00 0.00 H new ATOM 0 HD21 ASN A 85 12.594 -12.949 -1.734 1.00 0.00 H new ATOM 0 HD22 ASN A 85 11.435 -12.334 -2.918 1.00 0.00 H new ATOM 1288 N GLY A 86 10.869 -7.572 -4.626 1.00 0.00 N ATOM 1289 CA GLY A 86 10.686 -6.569 -5.656 1.00 0.00 C ATOM 1290 C GLY A 86 11.237 -7.018 -6.996 1.00 0.00 C ATOM 1291 O GLY A 86 11.129 -6.301 -7.991 1.00 0.00 O ATOM 0 H GLY A 86 10.016 -8.052 -4.337 1.00 0.00 H new ATOM 0 HA2 GLY A 86 9.624 -6.345 -5.758 1.00 0.00 H new ATOM 0 HA3 GLY A 86 11.179 -5.645 -5.353 1.00 0.00 H new ATOM 1295 N ASN A 87 11.829 -8.210 -7.022 1.00 0.00 N ATOM 1296 CA ASN A 87 12.398 -8.755 -8.250 1.00 0.00 C ATOM 1297 C ASN A 87 11.367 -9.581 -9.015 1.00 0.00 C ATOM 1298 O ASN A 87 11.463 -9.737 -10.232 1.00 0.00 O ATOM 1299 CB ASN A 87 13.623 -9.614 -7.933 1.00 0.00 C ATOM 1300 CG ASN A 87 13.348 -10.638 -6.848 1.00 0.00 C ATOM 1301 OD1 ASN A 87 12.194 -10.910 -6.515 1.00 0.00 O ATOM 1302 ND2 ASN A 87 14.408 -11.209 -6.292 1.00 0.00 N ATOM 0 H ASN A 87 11.927 -8.816 -6.207 1.00 0.00 H new ATOM 0 HA ASN A 87 12.701 -7.918 -8.879 1.00 0.00 H new ATOM 0 HB2 ASN A 87 13.948 -10.127 -8.838 1.00 0.00 H new ATOM 0 HB3 ASN A 87 14.444 -8.969 -7.620 1.00 0.00 H new ATOM 0 HD21 ASN A 87 14.285 -11.905 -5.556 1.00 0.00 H new ATOM 0 HD22 ASN A 87 15.346 -10.952 -6.600 1.00 0.00 H new ATOM 1309 N GLY A 88 10.377 -10.105 -8.297 1.00 0.00 N ATOM 1310 CA GLY A 88 9.342 -10.902 -8.933 1.00 0.00 C ATOM 1311 C GLY A 88 9.382 -12.361 -8.519 1.00 0.00 C ATOM 1312 O GLY A 88 9.486 -13.249 -9.367 1.00 0.00 O ATOM 0 H GLY A 88 10.273 -9.992 -7.289 1.00 0.00 H new ATOM 0 HA2 GLY A 88 8.366 -10.486 -8.684 1.00 0.00 H new ATOM 0 HA3 GLY A 88 9.451 -10.834 -10.015 1.00 0.00 H new ATOM 1316 N LYS A 89 9.293 -12.612 -7.217 1.00 0.00 N ATOM 1317 CA LYS A 89 9.310 -13.975 -6.699 1.00 0.00 C ATOM 1318 C LYS A 89 8.685 -14.027 -5.310 1.00 0.00 C ATOM 1319 O LYS A 89 8.907 -13.139 -4.485 1.00 0.00 O ATOM 1320 CB LYS A 89 10.742 -14.517 -6.657 1.00 0.00 C ATOM 1321 CG LYS A 89 11.643 -13.800 -5.663 1.00 0.00 C ATOM 1322 CD LYS A 89 12.495 -14.782 -4.874 1.00 0.00 C ATOM 1323 CE LYS A 89 13.889 -14.231 -4.620 1.00 0.00 C ATOM 1324 NZ LYS A 89 14.696 -14.163 -5.870 1.00 0.00 N ATOM 0 H LYS A 89 9.208 -11.890 -6.502 1.00 0.00 H new ATOM 0 HA LYS A 89 8.721 -14.602 -7.368 1.00 0.00 H new ATOM 0 HB2 LYS A 89 10.712 -15.577 -6.406 1.00 0.00 H new ATOM 0 HB3 LYS A 89 11.180 -14.438 -7.652 1.00 0.00 H new ATOM 0 HG2 LYS A 89 12.289 -13.101 -6.194 1.00 0.00 H new ATOM 0 HG3 LYS A 89 11.034 -13.212 -4.977 1.00 0.00 H new ATOM 0 HD2 LYS A 89 12.011 -15.003 -3.923 1.00 0.00 H new ATOM 0 HD3 LYS A 89 12.568 -15.722 -5.420 1.00 0.00 H new ATOM 0 HE2 LYS A 89 13.812 -13.235 -4.183 1.00 0.00 H new ATOM 0 HE3 LYS A 89 14.401 -14.860 -3.891 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 15.461 -13.468 -5.752 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 15.105 -15.098 -6.070 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 14.086 -13.875 -6.662 1.00 0.00 H new ATOM 1338 N ILE A 90 7.899 -15.065 -5.056 1.00 0.00 N ATOM 1339 CA ILE A 90 7.241 -15.221 -3.763 1.00 0.00 C ATOM 1340 C ILE A 90 7.524 -16.592 -3.163 1.00 0.00 C ATOM 1341 O ILE A 90 6.852 -17.573 -3.485 1.00 0.00 O ATOM 1342 CB ILE A 90 5.714 -15.024 -3.862 1.00 0.00 C ATOM 1343 CG1 ILE A 90 5.349 -14.151 -5.068 1.00 0.00 C ATOM 1344 CG2 ILE A 90 5.183 -14.410 -2.575 1.00 0.00 C ATOM 1345 CD1 ILE A 90 5.858 -12.728 -4.965 1.00 0.00 C ATOM 0 H ILE A 90 7.701 -15.810 -5.725 1.00 0.00 H new ATOM 0 HA ILE A 90 7.652 -14.446 -3.115 1.00 0.00 H new ATOM 0 HB ILE A 90 5.249 -16.000 -4.004 1.00 0.00 H new ATOM 0 HG12 ILE A 90 5.753 -14.608 -5.972 1.00 0.00 H new ATOM 0 HG13 ILE A 90 4.265 -14.133 -5.177 1.00 0.00 H new ATOM 0 HG21 ILE A 90 4.104 -14.275 -2.654 1.00 0.00 H new ATOM 0 HG22 ILE A 90 5.405 -15.071 -1.738 1.00 0.00 H new ATOM 0 HG23 ILE A 90 5.659 -13.443 -2.410 1.00 0.00 H new ATOM 0 HD11 ILE A 90 5.562 -12.170 -5.854 1.00 0.00 H new ATOM 0 HD12 ILE A 90 5.434 -12.253 -4.080 1.00 0.00 H new ATOM 0 HD13 ILE A 90 6.945 -12.735 -4.887 1.00 0.00 H new ATOM 1357 N ASP A 91 8.520 -16.653 -2.289 1.00 0.00 N ATOM 1358 CA ASP A 91 8.891 -17.904 -1.639 1.00 0.00 C ATOM 1359 C ASP A 91 9.901 -17.659 -0.525 1.00 0.00 C ATOM 1360 O ASP A 91 9.677 -18.038 0.625 1.00 0.00 O ATOM 1361 CB ASP A 91 9.471 -18.882 -2.664 1.00 0.00 C ATOM 1362 CG ASP A 91 9.044 -20.313 -2.403 1.00 0.00 C ATOM 1363 OD1 ASP A 91 9.141 -20.759 -1.240 1.00 0.00 O ATOM 1364 OD2 ASP A 91 8.612 -20.987 -3.361 1.00 0.00 O ATOM 0 H ASP A 91 9.086 -15.851 -2.013 1.00 0.00 H new ATOM 0 HA ASP A 91 7.992 -18.338 -1.200 1.00 0.00 H new ATOM 0 HB2 ASP A 91 9.153 -18.587 -3.664 1.00 0.00 H new ATOM 0 HB3 ASP A 91 10.559 -18.821 -2.645 1.00 0.00 H new ATOM 1369 N ILE A 92 11.010 -17.020 -0.873 1.00 0.00 N ATOM 1370 CA ILE A 92 12.053 -16.719 0.100 1.00 0.00 C ATOM 1371 C ILE A 92 12.009 -15.251 0.519 1.00 0.00 C ATOM 1372 O ILE A 92 12.739 -14.830 1.416 1.00 0.00 O ATOM 1373 CB ILE A 92 13.452 -17.048 -0.457 1.00 0.00 C ATOM 1374 CG1 ILE A 92 14.514 -16.877 0.643 1.00 0.00 C ATOM 1375 CG2 ILE A 92 13.756 -16.183 -1.674 1.00 0.00 C ATOM 1376 CD1 ILE A 92 15.579 -15.841 0.335 1.00 0.00 C ATOM 0 H ILE A 92 11.211 -16.700 -1.820 1.00 0.00 H new ATOM 0 HA ILE A 92 11.864 -17.345 0.972 1.00 0.00 H new ATOM 0 HB ILE A 92 13.473 -18.089 -0.781 1.00 0.00 H new ATOM 0 HG12 ILE A 92 14.015 -16.601 1.572 1.00 0.00 H new ATOM 0 HG13 ILE A 92 14.999 -17.838 0.815 1.00 0.00 H new ATOM 0 HG21 ILE A 92 14.747 -16.427 -2.056 1.00 0.00 H new ATOM 0 HG22 ILE A 92 13.013 -16.371 -2.449 1.00 0.00 H new ATOM 0 HG23 ILE A 92 13.726 -15.131 -1.390 1.00 0.00 H new ATOM 0 HD11 ILE A 92 16.285 -15.787 1.164 1.00 0.00 H new ATOM 0 HD12 ILE A 92 16.109 -16.123 -0.575 1.00 0.00 H new ATOM 0 HD13 ILE A 92 15.110 -14.867 0.194 1.00 0.00 H new ATOM 1388 N GLY A 93 11.150 -14.474 -0.133 1.00 0.00 N ATOM 1389 CA GLY A 93 11.032 -13.068 0.190 1.00 0.00 C ATOM 1390 C GLY A 93 10.497 -12.830 1.591 1.00 0.00 C ATOM 1391 O GLY A 93 10.566 -11.715 2.108 1.00 0.00 O ATOM 0 H GLY A 93 10.534 -14.795 -0.880 1.00 0.00 H new ATOM 0 HA2 GLY A 93 12.009 -12.594 0.094 1.00 0.00 H new ATOM 0 HA3 GLY A 93 10.372 -12.588 -0.533 1.00 0.00 H new ATOM 1395 N ASP A 94 9.952 -13.876 2.207 1.00 0.00 N ATOM 1396 CA ASP A 94 9.398 -13.761 3.553 1.00 0.00 C ATOM 1397 C ASP A 94 10.393 -14.231 4.611 1.00 0.00 C ATOM 1398 O ASP A 94 10.608 -13.557 5.618 1.00 0.00 O ATOM 1399 CB ASP A 94 8.097 -14.561 3.661 1.00 0.00 C ATOM 1400 CG ASP A 94 8.331 -16.059 3.737 1.00 0.00 C ATOM 1401 OD1 ASP A 94 8.653 -16.663 2.691 1.00 0.00 O ATOM 1402 OD2 ASP A 94 8.192 -16.628 4.840 1.00 0.00 O ATOM 0 H ASP A 94 9.882 -14.808 1.798 1.00 0.00 H new ATOM 0 HA ASP A 94 9.188 -12.707 3.736 1.00 0.00 H new ATOM 0 HB2 ASP A 94 7.550 -14.238 4.547 1.00 0.00 H new ATOM 0 HB3 ASP A 94 7.467 -14.340 2.799 1.00 0.00 H new ATOM 1407 N LEU A 95 10.980 -15.402 4.385 1.00 0.00 N ATOM 1408 CA LEU A 95 11.935 -15.977 5.330 1.00 0.00 C ATOM 1409 C LEU A 95 13.363 -15.499 5.071 1.00 0.00 C ATOM 1410 O LEU A 95 14.319 -16.223 5.347 1.00 0.00 O ATOM 1411 CB LEU A 95 11.882 -17.504 5.267 1.00 0.00 C ATOM 1412 CG LEU A 95 12.129 -18.216 6.597 1.00 0.00 C ATOM 1413 CD1 LEU A 95 10.833 -18.343 7.383 1.00 0.00 C ATOM 1414 CD2 LEU A 95 12.748 -19.585 6.361 1.00 0.00 C ATOM 0 H LEU A 95 10.812 -15.972 3.556 1.00 0.00 H new ATOM 0 HA LEU A 95 11.649 -15.638 6.326 1.00 0.00 H new ATOM 0 HB2 LEU A 95 10.905 -17.803 4.888 1.00 0.00 H new ATOM 0 HB3 LEU A 95 12.622 -17.848 4.545 1.00 0.00 H new ATOM 0 HG LEU A 95 12.828 -17.619 7.183 1.00 0.00 H new ATOM 0 HD11 LEU A 95 11.028 -18.852 8.327 1.00 0.00 H new ATOM 0 HD12 LEU A 95 10.430 -17.350 7.583 1.00 0.00 H new ATOM 0 HD13 LEU A 95 10.111 -18.918 6.803 1.00 0.00 H new ATOM 0 HD21 LEU A 95 12.917 -20.078 7.318 1.00 0.00 H new ATOM 0 HD22 LEU A 95 12.073 -20.190 5.756 1.00 0.00 H new ATOM 0 HD23 LEU A 95 13.698 -19.470 5.840 1.00 0.00 H new ATOM 1426 N ALA A 96 13.515 -14.287 4.542 1.00 0.00 N ATOM 1427 CA ALA A 96 14.846 -13.756 4.264 1.00 0.00 C ATOM 1428 C ALA A 96 14.819 -12.273 3.898 1.00 0.00 C ATOM 1429 O ALA A 96 15.759 -11.540 4.201 1.00 0.00 O ATOM 1430 CB ALA A 96 15.502 -14.558 3.150 1.00 0.00 C ATOM 0 H ALA A 96 12.745 -13.663 4.300 1.00 0.00 H new ATOM 0 HA ALA A 96 15.430 -13.850 5.180 1.00 0.00 H new ATOM 0 HB1 ALA A 96 16.495 -14.156 2.948 1.00 0.00 H new ATOM 0 HB2 ALA A 96 15.588 -15.601 3.455 1.00 0.00 H new ATOM 0 HB3 ALA A 96 14.894 -14.493 2.248 1.00 0.00 H new ATOM 1436 N MET A 97 13.756 -11.840 3.228 1.00 0.00 N ATOM 1437 CA MET A 97 13.632 -10.445 2.805 1.00 0.00 C ATOM 1438 C MET A 97 12.930 -9.581 3.851 1.00 0.00 C ATOM 1439 O MET A 97 13.549 -8.756 4.513 1.00 0.00 O ATOM 1440 CB MET A 97 12.866 -10.369 1.485 1.00 0.00 C ATOM 1441 CG MET A 97 13.681 -9.830 0.324 1.00 0.00 C ATOM 1442 SD MET A 97 14.471 -8.254 0.693 1.00 0.00 S ATOM 1443 CE MET A 97 13.686 -7.215 -0.533 1.00 0.00 C ATOM 0 H MET A 97 12.968 -12.432 2.965 1.00 0.00 H new ATOM 0 HA MET A 97 14.642 -10.055 2.678 1.00 0.00 H new ATOM 0 HB2 MET A 97 12.505 -11.365 1.229 1.00 0.00 H new ATOM 0 HB3 MET A 97 11.988 -9.737 1.623 1.00 0.00 H new ATOM 0 HG2 MET A 97 14.445 -10.559 0.054 1.00 0.00 H new ATOM 0 HG3 MET A 97 13.033 -9.711 -0.544 1.00 0.00 H new ATOM 0 HE1 MET A 97 13.744 -6.173 -0.218 1.00 0.00 H new ATOM 0 HE2 MET A 97 14.194 -7.334 -1.490 1.00 0.00 H new ATOM 0 HE3 MET A 97 12.640 -7.504 -0.639 1.00 0.00 H new ATOM 1453 N VAL A 98 11.620 -9.744 3.954 1.00 0.00 N ATOM 1454 CA VAL A 98 10.816 -8.956 4.876 1.00 0.00 C ATOM 1455 C VAL A 98 11.180 -9.176 6.347 1.00 0.00 C ATOM 1456 O VAL A 98 11.297 -8.219 7.109 1.00 0.00 O ATOM 1457 CB VAL A 98 9.310 -9.245 4.675 1.00 0.00 C ATOM 1458 CG1 VAL A 98 8.876 -10.502 5.418 1.00 0.00 C ATOM 1459 CG2 VAL A 98 8.480 -8.053 5.110 1.00 0.00 C ATOM 0 H VAL A 98 11.088 -10.420 3.406 1.00 0.00 H new ATOM 0 HA VAL A 98 11.035 -7.915 4.641 1.00 0.00 H new ATOM 0 HB VAL A 98 9.144 -9.419 3.612 1.00 0.00 H new ATOM 0 HG11 VAL A 98 7.812 -10.673 5.253 1.00 0.00 H new ATOM 0 HG12 VAL A 98 9.442 -11.357 5.048 1.00 0.00 H new ATOM 0 HG13 VAL A 98 9.063 -10.377 6.485 1.00 0.00 H new ATOM 0 HG21 VAL A 98 7.423 -8.272 4.962 1.00 0.00 H new ATOM 0 HG22 VAL A 98 8.664 -7.847 6.164 1.00 0.00 H new ATOM 0 HG23 VAL A 98 8.756 -7.181 4.517 1.00 0.00 H new ATOM 1469 N SER A 99 11.308 -10.433 6.759 1.00 0.00 N ATOM 1470 CA SER A 99 11.592 -10.739 8.157 1.00 0.00 C ATOM 1471 C SER A 99 12.960 -10.250 8.633 1.00 0.00 C ATOM 1472 O SER A 99 13.169 -10.110 9.838 1.00 0.00 O ATOM 1473 CB SER A 99 11.459 -12.232 8.432 1.00 0.00 C ATOM 1474 OG SER A 99 12.597 -12.943 7.978 1.00 0.00 O ATOM 0 H SER A 99 11.221 -11.249 6.153 1.00 0.00 H new ATOM 0 HA SER A 99 10.843 -10.189 8.727 1.00 0.00 H new ATOM 0 HB2 SER A 99 11.328 -12.397 9.501 1.00 0.00 H new ATOM 0 HB3 SER A 99 10.567 -12.617 7.938 1.00 0.00 H new ATOM 0 HG SER A 99 12.389 -13.384 7.128 1.00 0.00 H new ATOM 1480 N LYS A 100 13.897 -9.994 7.723 1.00 0.00 N ATOM 1481 CA LYS A 100 15.214 -9.533 8.158 1.00 0.00 C ATOM 1482 C LYS A 100 15.178 -8.070 8.580 1.00 0.00 C ATOM 1483 O LYS A 100 16.102 -7.584 9.233 1.00 0.00 O ATOM 1484 CB LYS A 100 16.302 -9.781 7.103 1.00 0.00 C ATOM 1485 CG LYS A 100 15.945 -9.328 5.698 1.00 0.00 C ATOM 1486 CD LYS A 100 15.702 -7.830 5.622 1.00 0.00 C ATOM 1487 CE LYS A 100 16.849 -7.031 6.221 1.00 0.00 C ATOM 1488 NZ LYS A 100 17.303 -5.941 5.313 1.00 0.00 N ATOM 0 H LYS A 100 13.778 -10.093 6.715 1.00 0.00 H new ATOM 0 HA LYS A 100 15.481 -10.129 9.031 1.00 0.00 H new ATOM 0 HB2 LYS A 100 17.213 -9.269 7.414 1.00 0.00 H new ATOM 0 HB3 LYS A 100 16.528 -10.847 7.079 1.00 0.00 H new ATOM 0 HG2 LYS A 100 16.750 -9.599 5.015 1.00 0.00 H new ATOM 0 HG3 LYS A 100 15.052 -9.857 5.364 1.00 0.00 H new ATOM 0 HD2 LYS A 100 15.563 -7.539 4.581 1.00 0.00 H new ATOM 0 HD3 LYS A 100 14.778 -7.586 6.147 1.00 0.00 H new ATOM 0 HE2 LYS A 100 16.534 -6.603 7.173 1.00 0.00 H new ATOM 0 HE3 LYS A 100 17.684 -7.698 6.432 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 18.284 -6.121 5.017 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 16.689 -5.909 4.474 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 17.254 -5.030 5.812 1.00 0.00 H new ATOM 1502 N ASN A 101 14.093 -7.380 8.249 1.00 0.00 N ATOM 1503 CA ASN A 101 13.934 -5.991 8.647 1.00 0.00 C ATOM 1504 C ASN A 101 13.094 -5.947 9.911 1.00 0.00 C ATOM 1505 O ASN A 101 13.534 -5.464 10.953 1.00 0.00 O ATOM 1506 CB ASN A 101 13.255 -5.156 7.549 1.00 0.00 C ATOM 1507 CG ASN A 101 13.391 -5.759 6.165 1.00 0.00 C ATOM 1508 OD1 ASN A 101 12.592 -6.602 5.762 1.00 0.00 O ATOM 1509 ND2 ASN A 101 14.408 -5.327 5.429 1.00 0.00 N ATOM 0 H ASN A 101 13.315 -7.759 7.709 1.00 0.00 H new ATOM 0 HA ASN A 101 14.922 -5.563 8.820 1.00 0.00 H new ATOM 0 HB2 ASN A 101 12.197 -5.047 7.788 1.00 0.00 H new ATOM 0 HB3 ASN A 101 13.686 -4.155 7.545 1.00 0.00 H new ATOM 0 HD21 ASN A 101 14.550 -5.696 4.489 1.00 0.00 H new ATOM 0 HD22 ASN A 101 15.047 -4.626 5.804 1.00 0.00 H new ATOM 1516 N ILE A 102 11.875 -6.471 9.790 1.00 0.00 N ATOM 1517 CA ILE A 102 10.914 -6.529 10.881 1.00 0.00 C ATOM 1518 C ILE A 102 11.009 -5.307 11.778 1.00 0.00 C ATOM 1519 O ILE A 102 11.880 -5.205 12.642 1.00 0.00 O ATOM 1520 CB ILE A 102 11.058 -7.823 11.713 1.00 0.00 C ATOM 1521 CG1 ILE A 102 10.819 -9.046 10.820 1.00 0.00 C ATOM 1522 CG2 ILE A 102 10.091 -7.825 12.894 1.00 0.00 C ATOM 1523 CD1 ILE A 102 9.351 -9.342 10.540 1.00 0.00 C ATOM 0 H ILE A 102 11.527 -6.871 8.919 1.00 0.00 H new ATOM 0 HA ILE A 102 9.926 -6.537 10.422 1.00 0.00 H new ATOM 0 HB ILE A 102 12.071 -7.867 12.112 1.00 0.00 H new ATOM 0 HG12 ILE A 102 11.334 -8.895 9.871 1.00 0.00 H new ATOM 0 HG13 ILE A 102 11.270 -9.919 11.292 1.00 0.00 H new ATOM 0 HG21 ILE A 102 10.213 -8.747 13.463 1.00 0.00 H new ATOM 0 HG22 ILE A 102 10.301 -6.971 13.538 1.00 0.00 H new ATOM 0 HG23 ILE A 102 9.067 -7.759 12.526 1.00 0.00 H new ATOM 0 HD11 ILE A 102 9.273 -10.222 9.902 1.00 0.00 H new ATOM 0 HD12 ILE A 102 8.832 -9.528 11.480 1.00 0.00 H new ATOM 0 HD13 ILE A 102 8.897 -8.488 10.038 1.00 0.00 H new ATOM 1535 N GLY A 103 10.092 -4.384 11.551 1.00 0.00 N ATOM 1536 CA GLY A 103 10.059 -3.156 12.322 1.00 0.00 C ATOM 1537 C GLY A 103 10.967 -2.089 11.740 1.00 0.00 C ATOM 1538 O GLY A 103 11.294 -1.110 12.411 1.00 0.00 O ATOM 0 H GLY A 103 9.363 -4.461 10.842 1.00 0.00 H new ATOM 0 HA2 GLY A 103 9.037 -2.780 12.359 1.00 0.00 H new ATOM 0 HA3 GLY A 103 10.359 -3.365 13.349 1.00 0.00 H new ATOM 1542 N SER A 104 11.376 -2.282 10.489 1.00 0.00 N ATOM 1543 CA SER A 104 12.252 -1.333 9.814 1.00 0.00 C ATOM 1544 C SER A 104 11.440 -0.302 9.039 1.00 0.00 C ATOM 1545 O SER A 104 11.008 -0.555 7.913 1.00 0.00 O ATOM 1546 CB SER A 104 13.199 -2.071 8.865 1.00 0.00 C ATOM 1547 OG SER A 104 14.217 -1.208 8.387 1.00 0.00 O ATOM 0 H SER A 104 11.114 -3.089 9.923 1.00 0.00 H new ATOM 0 HA SER A 104 12.838 -0.813 10.571 1.00 0.00 H new ATOM 0 HB2 SER A 104 13.649 -2.918 9.382 1.00 0.00 H new ATOM 0 HB3 SER A 104 12.635 -2.474 8.024 1.00 0.00 H new ATOM 0 HG SER A 104 14.810 -1.704 7.784 1.00 0.00 H new ATOM 1553 N THR A 105 11.237 0.860 9.647 1.00 0.00 N ATOM 1554 CA THR A 105 10.476 1.930 9.013 1.00 0.00 C ATOM 1555 C THR A 105 11.114 2.344 7.691 1.00 0.00 C ATOM 1556 O THR A 105 10.434 2.828 6.786 1.00 0.00 O ATOM 1557 CB THR A 105 10.377 3.135 9.950 1.00 0.00 C ATOM 1558 OG1 THR A 105 10.545 2.734 11.299 1.00 0.00 O ATOM 1559 CG2 THR A 105 9.054 3.862 9.850 1.00 0.00 C ATOM 0 H THR A 105 11.588 1.086 10.578 1.00 0.00 H new ATOM 0 HA THR A 105 9.473 1.557 8.806 1.00 0.00 H new ATOM 0 HB THR A 105 11.171 3.813 9.636 1.00 0.00 H new ATOM 0 HG1 THR A 105 10.480 3.518 11.884 1.00 0.00 H new ATOM 0 HG21 THR A 105 9.049 4.706 10.540 1.00 0.00 H new ATOM 0 HG22 THR A 105 8.915 4.225 8.832 1.00 0.00 H new ATOM 0 HG23 THR A 105 8.244 3.180 10.106 1.00 0.00 H new ATOM 1567 N THR A 106 12.425 2.144 7.582 1.00 0.00 N ATOM 1568 CA THR A 106 13.151 2.491 6.367 1.00 0.00 C ATOM 1569 C THR A 106 12.881 1.468 5.267 1.00 0.00 C ATOM 1570 O THR A 106 12.922 1.793 4.080 1.00 0.00 O ATOM 1571 CB THR A 106 14.652 2.571 6.649 1.00 0.00 C ATOM 1572 OG1 THR A 106 15.097 1.409 7.325 1.00 0.00 O ATOM 1573 CG2 THR A 106 15.040 3.769 7.489 1.00 0.00 C ATOM 0 H THR A 106 13.004 1.744 8.320 1.00 0.00 H new ATOM 0 HA THR A 106 12.802 3.466 6.028 1.00 0.00 H new ATOM 0 HB THR A 106 15.126 2.665 5.672 1.00 0.00 H new ATOM 0 HG1 THR A 106 14.381 0.740 7.332 1.00 0.00 H new ATOM 0 HG21 THR A 106 16.118 3.766 7.652 1.00 0.00 H new ATOM 0 HG22 THR A 106 14.754 4.684 6.971 1.00 0.00 H new ATOM 0 HG23 THR A 106 14.528 3.721 8.450 1.00 0.00 H new ATOM 1581 N ASN A 107 12.604 0.233 5.671 1.00 0.00 N ATOM 1582 CA ASN A 107 12.326 -0.839 4.721 1.00 0.00 C ATOM 1583 C ASN A 107 10.821 -1.049 4.567 1.00 0.00 C ATOM 1584 O ASN A 107 10.304 -2.135 4.833 1.00 0.00 O ATOM 1585 CB ASN A 107 12.994 -2.138 5.176 1.00 0.00 C ATOM 1586 CG ASN A 107 13.324 -3.056 4.016 1.00 0.00 C ATOM 1587 OD1 ASN A 107 14.493 -3.309 3.722 1.00 0.00 O ATOM 1588 ND2 ASN A 107 12.293 -3.560 3.347 1.00 0.00 N ATOM 0 H ASN A 107 12.566 -0.051 6.650 1.00 0.00 H new ATOM 0 HA ASN A 107 12.735 -0.551 3.753 1.00 0.00 H new ATOM 0 HB2 ASN A 107 13.908 -1.902 5.720 1.00 0.00 H new ATOM 0 HB3 ASN A 107 12.335 -2.658 5.871 1.00 0.00 H new ATOM 0 HD21 ASN A 107 12.454 -4.183 2.556 1.00 0.00 H new ATOM 0 HD22 ASN A 107 11.340 -3.324 3.625 1.00 0.00 H new ATOM 1595 N THR A 108 10.127 -0.004 4.133 1.00 0.00 N ATOM 1596 CA THR A 108 8.684 -0.068 3.938 1.00 0.00 C ATOM 1597 C THR A 108 8.337 -0.491 2.512 1.00 0.00 C ATOM 1598 O THR A 108 7.163 -0.613 2.161 1.00 0.00 O ATOM 1599 CB THR A 108 8.047 1.286 4.247 1.00 0.00 C ATOM 1600 OG1 THR A 108 8.526 1.797 5.479 1.00 0.00 O ATOM 1601 CG2 THR A 108 6.537 1.229 4.331 1.00 0.00 C ATOM 0 H THR A 108 10.542 0.900 3.909 1.00 0.00 H new ATOM 0 HA THR A 108 8.287 -0.817 4.623 1.00 0.00 H new ATOM 0 HB THR A 108 8.326 1.934 3.416 1.00 0.00 H new ATOM 0 HG1 THR A 108 9.444 2.119 5.365 1.00 0.00 H new ATOM 0 HG21 THR A 108 6.147 2.222 4.553 1.00 0.00 H new ATOM 0 HG22 THR A 108 6.132 0.885 3.379 1.00 0.00 H new ATOM 0 HG23 THR A 108 6.242 0.539 5.122 1.00 0.00 H new ATOM 1609 N SER A 109 9.362 -0.700 1.691 1.00 0.00 N ATOM 1610 CA SER A 109 9.165 -1.092 0.303 1.00 0.00 C ATOM 1611 C SER A 109 8.529 -2.476 0.180 1.00 0.00 C ATOM 1612 O SER A 109 8.066 -2.851 -0.898 1.00 0.00 O ATOM 1613 CB SER A 109 10.501 -1.071 -0.444 1.00 0.00 C ATOM 1614 OG SER A 109 10.302 -0.941 -1.841 1.00 0.00 O ATOM 0 H SER A 109 10.339 -0.604 1.966 1.00 0.00 H new ATOM 0 HA SER A 109 8.480 -0.371 -0.143 1.00 0.00 H new ATOM 0 HB2 SER A 109 11.111 -0.243 -0.082 1.00 0.00 H new ATOM 0 HB3 SER A 109 11.052 -1.988 -0.236 1.00 0.00 H new ATOM 0 HG SER A 109 9.561 -1.518 -2.121 1.00 0.00 H new ATOM 1620 N LEU A 110 8.508 -3.243 1.270 1.00 0.00 N ATOM 1621 CA LEU A 110 7.924 -4.581 1.223 1.00 0.00 C ATOM 1622 C LEU A 110 7.151 -4.931 2.494 1.00 0.00 C ATOM 1623 O LEU A 110 7.258 -6.046 3.001 1.00 0.00 O ATOM 1624 CB LEU A 110 9.007 -5.634 0.965 1.00 0.00 C ATOM 1625 CG LEU A 110 10.264 -5.527 1.833 1.00 0.00 C ATOM 1626 CD1 LEU A 110 10.021 -6.092 3.228 1.00 0.00 C ATOM 1627 CD2 LEU A 110 11.420 -6.251 1.159 1.00 0.00 C ATOM 0 H LEU A 110 8.881 -2.968 2.179 1.00 0.00 H new ATOM 0 HA LEU A 110 7.211 -4.581 0.398 1.00 0.00 H new ATOM 0 HB2 LEU A 110 8.569 -6.621 1.113 1.00 0.00 H new ATOM 0 HB3 LEU A 110 9.305 -5.572 -0.082 1.00 0.00 H new ATOM 0 HG LEU A 110 10.518 -4.473 1.942 1.00 0.00 H new ATOM 0 HD11 LEU A 110 10.931 -6.002 3.821 1.00 0.00 H new ATOM 0 HD12 LEU A 110 9.217 -5.536 3.711 1.00 0.00 H new ATOM 0 HD13 LEU A 110 9.740 -7.142 3.151 1.00 0.00 H new ATOM 0 HD21 LEU A 110 12.311 -6.171 1.781 1.00 0.00 H new ATOM 0 HD22 LEU A 110 11.163 -7.302 1.026 1.00 0.00 H new ATOM 0 HD23 LEU A 110 11.615 -5.799 0.186 1.00 0.00 H new ATOM 1639 N ASP A 111 6.343 -4.000 2.989 1.00 0.00 N ATOM 1640 CA ASP A 111 5.546 -4.251 4.162 1.00 0.00 C ATOM 1641 C ASP A 111 4.099 -4.421 3.738 1.00 0.00 C ATOM 1642 O ASP A 111 3.443 -3.450 3.365 1.00 0.00 O ATOM 1643 CB ASP A 111 5.669 -3.093 5.156 1.00 0.00 C ATOM 1644 CG ASP A 111 7.104 -2.679 5.415 1.00 0.00 C ATOM 1645 OD1 ASP A 111 7.965 -2.932 4.546 1.00 0.00 O ATOM 1646 OD2 ASP A 111 7.368 -2.100 6.490 1.00 0.00 O ATOM 0 H ASP A 111 6.230 -3.068 2.589 1.00 0.00 H new ATOM 0 HA ASP A 111 5.900 -5.157 4.654 1.00 0.00 H new ATOM 0 HB2 ASP A 111 5.113 -2.236 4.776 1.00 0.00 H new ATOM 0 HB3 ASP A 111 5.205 -3.381 6.099 1.00 0.00 H new ATOM 1651 N LEU A 112 3.599 -5.651 3.794 1.00 0.00 N ATOM 1652 CA LEU A 112 2.214 -5.926 3.417 1.00 0.00 C ATOM 1653 C LEU A 112 1.285 -4.862 4.002 1.00 0.00 C ATOM 1654 O LEU A 112 0.204 -4.596 3.476 1.00 0.00 O ATOM 1655 CB LEU A 112 1.799 -7.308 3.922 1.00 0.00 C ATOM 1656 CG LEU A 112 2.721 -8.462 3.519 1.00 0.00 C ATOM 1657 CD1 LEU A 112 2.232 -9.781 4.113 1.00 0.00 C ATOM 1658 CD2 LEU A 112 2.816 -8.558 2.008 1.00 0.00 C ATOM 0 H LEU A 112 4.127 -6.470 4.095 1.00 0.00 H new ATOM 0 HA LEU A 112 2.137 -5.904 2.330 1.00 0.00 H new ATOM 0 HB2 LEU A 112 1.741 -7.276 5.010 1.00 0.00 H new ATOM 0 HB3 LEU A 112 0.795 -7.523 3.555 1.00 0.00 H new ATOM 0 HG LEU A 112 3.716 -8.261 3.917 1.00 0.00 H new ATOM 0 HD11 LEU A 112 2.903 -10.586 3.813 1.00 0.00 H new ATOM 0 HD12 LEU A 112 2.217 -9.707 5.200 1.00 0.00 H new ATOM 0 HD13 LEU A 112 1.226 -9.993 3.750 1.00 0.00 H new ATOM 0 HD21 LEU A 112 3.475 -9.383 1.737 1.00 0.00 H new ATOM 0 HD22 LEU A 112 1.824 -8.734 1.592 1.00 0.00 H new ATOM 0 HD23 LEU A 112 3.217 -7.627 1.609 1.00 0.00 H new ATOM 1670 N ASN A 113 1.733 -4.264 5.101 1.00 0.00 N ATOM 1671 CA ASN A 113 0.988 -3.230 5.800 1.00 0.00 C ATOM 1672 C ASN A 113 1.476 -1.835 5.424 1.00 0.00 C ATOM 1673 O ASN A 113 0.730 -0.861 5.500 1.00 0.00 O ATOM 1674 CB ASN A 113 1.178 -3.425 7.296 1.00 0.00 C ATOM 1675 CG ASN A 113 -0.113 -3.770 8.013 1.00 0.00 C ATOM 1676 OD1 ASN A 113 -0.361 -3.304 9.126 1.00 0.00 O ATOM 1677 ND2 ASN A 113 -0.943 -4.592 7.381 1.00 0.00 N ATOM 0 H ASN A 113 2.630 -4.487 5.533 1.00 0.00 H new ATOM 0 HA ASN A 113 -0.062 -3.312 5.519 1.00 0.00 H new ATOM 0 HB2 ASN A 113 1.905 -4.219 7.465 1.00 0.00 H new ATOM 0 HB3 ASN A 113 1.595 -2.514 7.726 1.00 0.00 H new ATOM 0 HD21 ASN A 113 -1.825 -4.860 7.817 1.00 0.00 H new ATOM 0 HD22 ASN A 113 -0.698 -4.955 6.460 1.00 0.00 H new ATOM 1684 N LYS A 114 2.748 -1.733 5.068 1.00 0.00 N ATOM 1685 CA LYS A 114 3.332 -0.443 4.736 1.00 0.00 C ATOM 1686 C LYS A 114 3.168 0.504 5.914 1.00 0.00 C ATOM 1687 O LYS A 114 3.102 1.722 5.748 1.00 0.00 O ATOM 1688 CB LYS A 114 2.669 0.154 3.498 1.00 0.00 C ATOM 1689 CG LYS A 114 2.494 -0.835 2.358 1.00 0.00 C ATOM 1690 CD LYS A 114 2.409 -0.129 1.014 1.00 0.00 C ATOM 1691 CE LYS A 114 1.360 0.972 1.022 1.00 0.00 C ATOM 1692 NZ LYS A 114 1.945 2.296 1.373 1.00 0.00 N ATOM 0 H LYS A 114 3.391 -2.522 5.002 1.00 0.00 H new ATOM 0 HA LYS A 114 4.391 -0.586 4.521 1.00 0.00 H new ATOM 0 HB2 LYS A 114 1.692 0.550 3.776 1.00 0.00 H new ATOM 0 HB3 LYS A 114 3.266 0.996 3.148 1.00 0.00 H new ATOM 0 HG2 LYS A 114 3.330 -1.534 2.350 1.00 0.00 H new ATOM 0 HG3 LYS A 114 1.590 -1.421 2.520 1.00 0.00 H new ATOM 0 HD2 LYS A 114 3.381 0.296 0.764 1.00 0.00 H new ATOM 0 HD3 LYS A 114 2.169 -0.854 0.236 1.00 0.00 H new ATOM 0 HE2 LYS A 114 0.890 1.032 0.041 1.00 0.00 H new ATOM 0 HE3 LYS A 114 0.576 0.721 1.736 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 1.517 3.034 0.778 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 1.755 2.505 2.374 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 2.972 2.275 1.213 1.00 0.00 H new ATOM 1706 N ASP A 115 3.090 -0.073 7.112 1.00 0.00 N ATOM 1707 CA ASP A 115 2.919 0.708 8.325 1.00 0.00 C ATOM 1708 C ASP A 115 4.259 1.244 8.833 1.00 0.00 C ATOM 1709 O ASP A 115 4.330 1.827 9.915 1.00 0.00 O ATOM 1710 CB ASP A 115 2.234 -0.142 9.404 1.00 0.00 C ATOM 1711 CG ASP A 115 3.130 -1.244 9.933 1.00 0.00 C ATOM 1712 OD1 ASP A 115 3.656 -2.027 9.112 1.00 0.00 O ATOM 1713 OD2 ASP A 115 3.308 -1.326 11.166 1.00 0.00 O ATOM 0 H ASP A 115 3.143 -1.080 7.263 1.00 0.00 H new ATOM 0 HA ASP A 115 2.286 1.565 8.094 1.00 0.00 H new ATOM 0 HB2 ASP A 115 1.930 0.502 10.229 1.00 0.00 H new ATOM 0 HB3 ASP A 115 1.326 -0.583 8.992 1.00 0.00 H new ATOM 1718 N GLY A 116 5.322 1.046 8.050 1.00 0.00 N ATOM 1719 CA GLY A 116 6.632 1.522 8.455 1.00 0.00 C ATOM 1720 C GLY A 116 7.275 0.620 9.486 1.00 0.00 C ATOM 1721 O GLY A 116 7.984 1.087 10.379 1.00 0.00 O ATOM 0 H GLY A 116 5.297 0.568 7.149 1.00 0.00 H new ATOM 0 HA2 GLY A 116 7.279 1.589 7.580 1.00 0.00 H new ATOM 0 HA3 GLY A 116 6.541 2.529 8.862 1.00 0.00 H new ATOM 1725 N SER A 117 7.019 -0.676 9.365 1.00 0.00 N ATOM 1726 CA SER A 117 7.571 -1.657 10.294 1.00 0.00 C ATOM 1727 C SER A 117 7.180 -3.055 9.889 1.00 0.00 C ATOM 1728 O SER A 117 6.025 -3.456 10.028 1.00 0.00 O ATOM 1729 CB SER A 117 7.079 -1.395 11.720 1.00 0.00 C ATOM 1730 OG SER A 117 8.081 -0.770 12.502 1.00 0.00 O ATOM 0 H SER A 117 6.432 -1.074 8.632 1.00 0.00 H new ATOM 0 HA SER A 117 8.656 -1.562 10.264 1.00 0.00 H new ATOM 0 HB2 SER A 117 6.191 -0.764 11.691 1.00 0.00 H new ATOM 0 HB3 SER A 117 6.786 -2.336 12.185 1.00 0.00 H new ATOM 0 HG SER A 117 8.369 0.058 12.064 1.00 0.00 H new ATOM 1736 N ILE A 118 8.153 -3.808 9.418 1.00 0.00 N ATOM 1737 CA ILE A 118 7.902 -5.172 9.035 1.00 0.00 C ATOM 1738 C ILE A 118 7.536 -5.971 10.268 1.00 0.00 C ATOM 1739 O ILE A 118 8.357 -6.243 11.136 1.00 0.00 O ATOM 1740 CB ILE A 118 9.109 -5.783 8.292 1.00 0.00 C ATOM 1741 CG1 ILE A 118 9.131 -5.258 6.859 1.00 0.00 C ATOM 1742 CG2 ILE A 118 9.062 -7.308 8.301 1.00 0.00 C ATOM 1743 CD1 ILE A 118 7.785 -5.364 6.172 1.00 0.00 C ATOM 0 H ILE A 118 9.116 -3.497 9.294 1.00 0.00 H new ATOM 0 HA ILE A 118 7.067 -5.201 8.335 1.00 0.00 H new ATOM 0 HB ILE A 118 10.022 -5.486 8.808 1.00 0.00 H new ATOM 0 HG12 ILE A 118 9.450 -4.216 6.864 1.00 0.00 H new ATOM 0 HG13 ILE A 118 9.871 -5.815 6.285 1.00 0.00 H new ATOM 0 HG21 ILE A 118 9.928 -7.702 7.769 1.00 0.00 H new ATOM 0 HG22 ILE A 118 9.075 -7.666 9.330 1.00 0.00 H new ATOM 0 HG23 ILE A 118 8.149 -7.647 7.810 1.00 0.00 H new ATOM 0 HD11 ILE A 118 7.863 -4.975 5.157 1.00 0.00 H new ATOM 0 HD12 ILE A 118 7.475 -6.408 6.138 1.00 0.00 H new ATOM 0 HD13 ILE A 118 7.047 -4.784 6.726 1.00 0.00 H new ATOM 1755 N ASP A 119 6.271 -6.296 10.358 1.00 0.00 N ATOM 1756 CA ASP A 119 5.766 -7.024 11.516 1.00 0.00 C ATOM 1757 C ASP A 119 4.906 -8.224 11.118 1.00 0.00 C ATOM 1758 O ASP A 119 5.154 -8.871 10.100 1.00 0.00 O ATOM 1759 CB ASP A 119 4.993 -6.064 12.423 1.00 0.00 C ATOM 1760 CG ASP A 119 5.184 -6.377 13.895 1.00 0.00 C ATOM 1761 OD1 ASP A 119 6.235 -6.952 14.248 1.00 0.00 O ATOM 1762 OD2 ASP A 119 4.283 -6.046 14.694 1.00 0.00 O ATOM 0 H ASP A 119 5.568 -6.074 9.653 1.00 0.00 H new ATOM 0 HA ASP A 119 6.619 -7.428 12.062 1.00 0.00 H new ATOM 0 HB2 ASP A 119 5.318 -5.042 12.227 1.00 0.00 H new ATOM 0 HB3 ASP A 119 3.932 -6.113 12.179 1.00 0.00 H new ATOM 1767 N GLU A 120 3.911 -8.534 11.944 1.00 0.00 N ATOM 1768 CA GLU A 120 3.029 -9.672 11.696 1.00 0.00 C ATOM 1769 C GLU A 120 2.176 -9.467 10.445 1.00 0.00 C ATOM 1770 O GLU A 120 1.675 -10.429 9.863 1.00 0.00 O ATOM 1771 CB GLU A 120 2.127 -9.910 12.908 1.00 0.00 C ATOM 1772 CG GLU A 120 1.700 -11.359 13.073 1.00 0.00 C ATOM 1773 CD GLU A 120 0.960 -11.604 14.373 1.00 0.00 C ATOM 1774 OE1 GLU A 120 0.311 -10.661 14.874 1.00 0.00 O ATOM 1775 OE2 GLU A 120 1.030 -12.739 14.892 1.00 0.00 O ATOM 0 H GLU A 120 3.694 -8.012 12.793 1.00 0.00 H new ATOM 0 HA GLU A 120 3.658 -10.547 11.530 1.00 0.00 H new ATOM 0 HB2 GLU A 120 2.651 -9.589 13.809 1.00 0.00 H new ATOM 0 HB3 GLU A 120 1.238 -9.286 12.817 1.00 0.00 H new ATOM 0 HG2 GLU A 120 1.061 -11.643 12.237 1.00 0.00 H new ATOM 0 HG3 GLU A 120 2.581 -12.000 13.034 1.00 0.00 H new ATOM 1782 N TYR A 121 2.015 -8.215 10.038 1.00 0.00 N ATOM 1783 CA TYR A 121 1.222 -7.892 8.857 1.00 0.00 C ATOM 1784 C TYR A 121 1.941 -8.320 7.581 1.00 0.00 C ATOM 1785 O TYR A 121 1.310 -8.510 6.545 1.00 0.00 O ATOM 1786 CB TYR A 121 0.918 -6.388 8.787 1.00 0.00 C ATOM 1787 CG TYR A 121 1.428 -5.577 9.963 1.00 0.00 C ATOM 1788 CD1 TYR A 121 0.762 -5.587 11.182 1.00 0.00 C ATOM 1789 CD2 TYR A 121 2.576 -4.803 9.851 1.00 0.00 C ATOM 1790 CE1 TYR A 121 1.226 -4.850 12.255 1.00 0.00 C ATOM 1791 CE2 TYR A 121 3.047 -4.064 10.920 1.00 0.00 C ATOM 1792 CZ TYR A 121 2.368 -4.090 12.120 1.00 0.00 C ATOM 1793 OH TYR A 121 2.833 -3.356 13.186 1.00 0.00 O ATOM 0 H TYR A 121 2.422 -7.406 10.507 1.00 0.00 H new ATOM 0 HA TYR A 121 0.284 -8.440 8.940 1.00 0.00 H new ATOM 0 HB2 TYR A 121 1.353 -5.987 7.872 1.00 0.00 H new ATOM 0 HB3 TYR A 121 -0.161 -6.254 8.713 1.00 0.00 H new ATOM 0 HD1 TYR A 121 -0.133 -6.181 11.293 1.00 0.00 H new ATOM 0 HD2 TYR A 121 3.110 -4.778 8.912 1.00 0.00 H new ATOM 0 HE1 TYR A 121 0.696 -4.869 13.196 1.00 0.00 H new ATOM 0 HE2 TYR A 121 3.942 -3.469 10.816 1.00 0.00 H new ATOM 0 HH TYR A 121 3.131 -2.477 12.872 1.00 0.00 H new ATOM 1803 N GLU A 122 3.263 -8.453 7.665 1.00 0.00 N ATOM 1804 CA GLU A 122 4.078 -8.838 6.510 1.00 0.00 C ATOM 1805 C GLU A 122 4.136 -10.353 6.334 1.00 0.00 C ATOM 1806 O GLU A 122 4.489 -10.854 5.266 1.00 0.00 O ATOM 1807 CB GLU A 122 5.500 -8.288 6.644 1.00 0.00 C ATOM 1808 CG GLU A 122 5.620 -7.127 7.611 1.00 0.00 C ATOM 1809 CD GLU A 122 4.807 -5.920 7.184 1.00 0.00 C ATOM 1810 OE1 GLU A 122 3.959 -6.067 6.279 1.00 0.00 O ATOM 1811 OE2 GLU A 122 5.013 -4.831 7.756 1.00 0.00 O ATOM 0 H GLU A 122 3.795 -8.300 8.521 1.00 0.00 H new ATOM 0 HA GLU A 122 3.602 -8.409 5.628 1.00 0.00 H new ATOM 0 HB2 GLU A 122 6.160 -9.091 6.972 1.00 0.00 H new ATOM 0 HB3 GLU A 122 5.850 -7.968 5.662 1.00 0.00 H new ATOM 0 HG2 GLU A 122 5.293 -7.448 8.600 1.00 0.00 H new ATOM 0 HG3 GLU A 122 6.668 -6.841 7.699 1.00 0.00 H new ATOM 1818 N ILE A 123 3.794 -11.070 7.387 1.00 0.00 N ATOM 1819 CA ILE A 123 3.806 -12.529 7.370 1.00 0.00 C ATOM 1820 C ILE A 123 2.423 -13.096 7.060 1.00 0.00 C ATOM 1821 O ILE A 123 2.300 -14.205 6.544 1.00 0.00 O ATOM 1822 CB ILE A 123 4.290 -13.105 8.717 1.00 0.00 C ATOM 1823 CG1 ILE A 123 5.319 -12.174 9.365 1.00 0.00 C ATOM 1824 CG2 ILE A 123 4.880 -14.493 8.516 1.00 0.00 C ATOM 1825 CD1 ILE A 123 6.563 -11.971 8.528 1.00 0.00 C ATOM 0 H ILE A 123 3.501 -10.665 8.276 1.00 0.00 H new ATOM 0 HA ILE A 123 4.500 -12.824 6.583 1.00 0.00 H new ATOM 0 HB ILE A 123 3.433 -13.184 9.386 1.00 0.00 H new ATOM 0 HG12 ILE A 123 4.854 -11.206 9.551 1.00 0.00 H new ATOM 0 HG13 ILE A 123 5.606 -12.582 10.334 1.00 0.00 H new ATOM 0 HG21 ILE A 123 5.217 -14.887 9.475 1.00 0.00 H new ATOM 0 HG22 ILE A 123 4.121 -15.154 8.099 1.00 0.00 H new ATOM 0 HG23 ILE A 123 5.725 -14.433 7.830 1.00 0.00 H new ATOM 0 HD11 ILE A 123 7.247 -11.301 9.049 1.00 0.00 H new ATOM 0 HD12 ILE A 123 7.051 -12.931 8.363 1.00 0.00 H new ATOM 0 HD13 ILE A 123 6.288 -11.534 7.568 1.00 0.00 H new ATOM 1837 N SER A 124 1.387 -12.333 7.393 1.00 0.00 N ATOM 1838 CA SER A 124 0.005 -12.757 7.170 1.00 0.00 C ATOM 1839 C SER A 124 -0.198 -13.374 5.786 1.00 0.00 C ATOM 1840 O SER A 124 -1.078 -14.213 5.597 1.00 0.00 O ATOM 1841 CB SER A 124 -0.942 -11.569 7.348 1.00 0.00 C ATOM 1842 OG SER A 124 -0.903 -11.079 8.677 1.00 0.00 O ATOM 0 H SER A 124 1.477 -11.412 7.821 1.00 0.00 H new ATOM 0 HA SER A 124 -0.219 -13.527 7.909 1.00 0.00 H new ATOM 0 HB2 SER A 124 -0.666 -10.773 6.656 1.00 0.00 H new ATOM 0 HB3 SER A 124 -1.959 -11.870 7.098 1.00 0.00 H new ATOM 0 HG SER A 124 -0.639 -11.801 9.284 1.00 0.00 H new ATOM 1848 N PHE A 125 0.609 -12.950 4.819 1.00 0.00 N ATOM 1849 CA PHE A 125 0.495 -13.462 3.457 1.00 0.00 C ATOM 1850 C PHE A 125 1.271 -14.765 3.278 1.00 0.00 C ATOM 1851 O PHE A 125 0.690 -15.815 3.006 1.00 0.00 O ATOM 1852 CB PHE A 125 1.003 -12.421 2.459 1.00 0.00 C ATOM 1853 CG PHE A 125 0.852 -12.843 1.026 1.00 0.00 C ATOM 1854 CD1 PHE A 125 -0.404 -13.034 0.474 1.00 0.00 C ATOM 1855 CD2 PHE A 125 1.967 -13.053 0.233 1.00 0.00 C ATOM 1856 CE1 PHE A 125 -0.545 -13.426 -0.844 1.00 0.00 C ATOM 1857 CE2 PHE A 125 1.834 -13.446 -1.085 1.00 0.00 C ATOM 1858 CZ PHE A 125 0.576 -13.632 -1.624 1.00 0.00 C ATOM 0 H PHE A 125 1.346 -12.257 4.951 1.00 0.00 H new ATOM 0 HA PHE A 125 -0.559 -13.667 3.270 1.00 0.00 H new ATOM 0 HB2 PHE A 125 0.463 -11.487 2.613 1.00 0.00 H new ATOM 0 HB3 PHE A 125 2.055 -12.218 2.661 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -1.283 -12.875 1.080 1.00 0.00 H new ATOM 0 HD2 PHE A 125 2.953 -12.908 0.650 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -1.530 -13.571 -1.263 1.00 0.00 H new ATOM 0 HE2 PHE A 125 2.712 -13.607 -1.693 1.00 0.00 H new ATOM 0 HZ PHE A 125 0.469 -13.938 -2.654 1.00 0.00 H new ATOM 1868 N ILE A 126 2.587 -14.681 3.418 1.00 0.00 N ATOM 1869 CA ILE A 126 3.460 -15.842 3.258 1.00 0.00 C ATOM 1870 C ILE A 126 3.294 -16.844 4.395 1.00 0.00 C ATOM 1871 O ILE A 126 3.825 -17.953 4.332 1.00 0.00 O ATOM 1872 CB ILE A 126 4.939 -15.424 3.158 1.00 0.00 C ATOM 1873 CG1 ILE A 126 5.079 -14.102 2.397 1.00 0.00 C ATOM 1874 CG2 ILE A 126 5.740 -16.516 2.475 1.00 0.00 C ATOM 1875 CD1 ILE A 126 5.424 -12.929 3.287 1.00 0.00 C ATOM 0 H ILE A 126 3.078 -13.816 3.644 1.00 0.00 H new ATOM 0 HA ILE A 126 3.161 -16.323 2.327 1.00 0.00 H new ATOM 0 HB ILE A 126 5.328 -15.277 4.166 1.00 0.00 H new ATOM 0 HG12 ILE A 126 5.851 -14.210 1.635 1.00 0.00 H new ATOM 0 HG13 ILE A 126 4.145 -13.891 1.876 1.00 0.00 H new ATOM 0 HG21 ILE A 126 6.785 -16.213 2.408 1.00 0.00 H new ATOM 0 HG22 ILE A 126 5.666 -17.437 3.053 1.00 0.00 H new ATOM 0 HG23 ILE A 126 5.346 -16.684 1.473 1.00 0.00 H new ATOM 0 HD11 ILE A 126 5.508 -12.026 2.682 1.00 0.00 H new ATOM 0 HD12 ILE A 126 4.640 -12.795 4.033 1.00 0.00 H new ATOM 0 HD13 ILE A 126 6.373 -13.119 3.788 1.00 0.00 H new ATOM 1887 N ASN A 127 2.555 -16.467 5.428 1.00 0.00 N ATOM 1888 CA ASN A 127 2.332 -17.361 6.554 1.00 0.00 C ATOM 1889 C ASN A 127 1.642 -18.640 6.089 1.00 0.00 C ATOM 1890 O ASN A 127 1.853 -19.711 6.658 1.00 0.00 O ATOM 1891 CB ASN A 127 1.485 -16.670 7.626 1.00 0.00 C ATOM 1892 CG ASN A 127 2.322 -16.144 8.775 1.00 0.00 C ATOM 1893 OD1 ASN A 127 3.370 -16.704 9.101 1.00 0.00 O ATOM 1894 ND2 ASN A 127 1.863 -15.066 9.396 1.00 0.00 N ATOM 0 H ASN A 127 2.103 -15.556 5.510 1.00 0.00 H new ATOM 0 HA ASN A 127 3.300 -17.619 6.984 1.00 0.00 H new ATOM 0 HB2 ASN A 127 0.934 -15.845 7.174 1.00 0.00 H new ATOM 0 HB3 ASN A 127 0.746 -17.373 8.011 1.00 0.00 H new ATOM 0 HD21 ASN A 127 2.383 -14.668 10.178 1.00 0.00 H new ATOM 0 HD22 ASN A 127 0.990 -14.635 9.092 1.00 0.00 H new ATOM 1901 N HIS A 128 0.808 -18.518 5.059 1.00 0.00 N ATOM 1902 CA HIS A 128 0.081 -19.667 4.531 1.00 0.00 C ATOM 1903 C HIS A 128 0.803 -20.326 3.366 1.00 0.00 C ATOM 1904 O HIS A 128 0.953 -21.548 3.341 1.00 0.00 O ATOM 1905 CB HIS A 128 -1.335 -19.261 4.118 1.00 0.00 C ATOM 1906 CG HIS A 128 -2.359 -19.489 5.187 1.00 0.00 C ATOM 1907 ND1 HIS A 128 -2.310 -20.553 6.062 1.00 0.00 N ATOM 1908 CD2 HIS A 128 -3.463 -18.779 5.521 1.00 0.00 C ATOM 1909 CE1 HIS A 128 -3.339 -20.490 6.887 1.00 0.00 C ATOM 1910 NE2 HIS A 128 -4.055 -19.422 6.580 1.00 0.00 N ATOM 0 H HIS A 128 0.620 -17.639 4.576 1.00 0.00 H new ATOM 0 HA HIS A 128 0.024 -20.404 5.332 1.00 0.00 H new ATOM 0 HB2 HIS A 128 -1.336 -18.206 3.844 1.00 0.00 H new ATOM 0 HB3 HIS A 128 -1.620 -19.822 3.228 1.00 0.00 H new ATOM 0 HD2 HIS A 128 -3.813 -17.876 5.043 1.00 0.00 H new ATOM 0 HE1 HIS A 128 -3.558 -21.192 7.678 1.00 0.00 H new ATOM 0 HE2 HIS A 128 -4.908 -19.124 7.053 1.00 0.00 H new ATOM 1919 N ARG A 129 1.252 -19.526 2.401 1.00 0.00 N ATOM 1920 CA ARG A 129 1.963 -20.064 1.241 1.00 0.00 C ATOM 1921 C ARG A 129 2.983 -21.114 1.676 1.00 0.00 C ATOM 1922 O ARG A 129 3.304 -22.038 0.929 1.00 0.00 O ATOM 1923 CB ARG A 129 2.665 -18.937 0.479 1.00 0.00 C ATOM 1924 CG ARG A 129 2.795 -19.200 -1.012 1.00 0.00 C ATOM 1925 CD ARG A 129 1.445 -19.143 -1.708 1.00 0.00 C ATOM 1926 NE ARG A 129 1.554 -19.420 -3.138 1.00 0.00 N ATOM 1927 CZ ARG A 129 1.701 -20.640 -3.649 1.00 0.00 C ATOM 1928 NH1 ARG A 129 1.759 -21.698 -2.849 1.00 0.00 N ATOM 1929 NH2 ARG A 129 1.792 -20.803 -4.961 1.00 0.00 N ATOM 0 H ARG A 129 1.138 -18.512 2.397 1.00 0.00 H new ATOM 0 HA ARG A 129 1.235 -20.537 0.582 1.00 0.00 H new ATOM 0 HB2 ARG A 129 2.113 -18.009 0.629 1.00 0.00 H new ATOM 0 HB3 ARG A 129 3.659 -18.788 0.901 1.00 0.00 H new ATOM 0 HG2 ARG A 129 3.465 -18.464 -1.455 1.00 0.00 H new ATOM 0 HG3 ARG A 129 3.247 -20.179 -1.172 1.00 0.00 H new ATOM 0 HD2 ARG A 129 0.770 -19.865 -1.249 1.00 0.00 H new ATOM 0 HD3 ARG A 129 1.003 -18.157 -1.562 1.00 0.00 H new ATOM 0 HE ARG A 129 1.515 -18.631 -3.784 1.00 0.00 H new ATOM 0 HH11 ARG A 129 1.691 -21.578 -1.838 1.00 0.00 H new ATOM 0 HH12 ARG A 129 1.872 -22.631 -3.245 1.00 0.00 H new ATOM 0 HH21 ARG A 129 1.749 -19.993 -5.580 1.00 0.00 H new ATOM 0 HH22 ARG A 129 1.905 -21.738 -5.352 1.00 0.00 H new ATOM 1943 N ILE A 130 3.480 -20.955 2.897 1.00 0.00 N ATOM 1944 CA ILE A 130 4.458 -21.869 3.465 1.00 0.00 C ATOM 1945 C ILE A 130 3.774 -22.959 4.289 1.00 0.00 C ATOM 1946 O ILE A 130 4.213 -24.109 4.303 1.00 0.00 O ATOM 1947 CB ILE A 130 5.464 -21.091 4.342 1.00 0.00 C ATOM 1948 CG1 ILE A 130 6.439 -20.329 3.451 1.00 0.00 C ATOM 1949 CG2 ILE A 130 6.216 -22.019 5.289 1.00 0.00 C ATOM 1950 CD1 ILE A 130 5.748 -19.490 2.402 1.00 0.00 C ATOM 0 H ILE A 130 3.216 -20.190 3.518 1.00 0.00 H new ATOM 0 HA ILE A 130 4.994 -22.348 2.646 1.00 0.00 H new ATOM 0 HB ILE A 130 4.907 -20.383 4.956 1.00 0.00 H new ATOM 0 HG12 ILE A 130 7.062 -19.685 4.071 1.00 0.00 H new ATOM 0 HG13 ILE A 130 7.105 -21.039 2.960 1.00 0.00 H new ATOM 0 HG21 ILE A 130 6.915 -21.437 5.890 1.00 0.00 H new ATOM 0 HG22 ILE A 130 5.506 -22.523 5.945 1.00 0.00 H new ATOM 0 HG23 ILE A 130 6.766 -22.761 4.711 1.00 0.00 H new ATOM 0 HD11 ILE A 130 6.495 -18.972 1.800 1.00 0.00 H new ATOM 0 HD12 ILE A 130 5.147 -20.133 1.760 1.00 0.00 H new ATOM 0 HD13 ILE A 130 5.103 -18.758 2.888 1.00 0.00 H new