USER MOD reduce.3.24.130724 H: found=0, std=0, add=918, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 917 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: B 23 ASN : amide:sc= -3.83! C(o=-5.6!,f=-14!) USER MOD Set 1.2: B 55 GLN : amide:sc= -1.77 K(o=-5.6,f=-3.9) USER MOD Set 2.1: B 21 ASN : amide:sc= -3.47! C(o=-9.5!,f=-11!) USER MOD Set 2.2: B 52 ASN : amide:sc= -6.05! C(o=-9.5!,f=-15!) USER MOD Set 3.1: A 28 ASN : amide:sc= -3.18 K(o=-3.4,f=-7.9!) USER MOD Set 3.2: B 10 SER OG : rot -103:sc= -0.249 USER MOD Set 4.1: A 32 GLN : amide:sc= -0.597 K(o=-0.6,f=-2.1!) USER MOD Set 4.2: B 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 5.1: A 21 ASN : amide:sc= -1.53 X(o=-2.3,f=-2.4) USER MOD Set 5.2: A 52 ASN : amide:sc= -0.8 K(o=-2.3,f=-3.5!) USER MOD Set 6.1: A 14 TYR OH : rot 180:sc= -0.72 USER MOD Set 6.2: A 18 HIS : no HD1:sc= -25.9! C(o=-27!,f=-24!) USER MOD Single : A 1 VAL N :NH3+ 176:sc= -0.024 (180deg=-0.0354) USER MOD Single : A 3 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 4 LYS NZ :NH3+ -111:sc= 0.311 (180deg=0) USER MOD Single : A 6 ASN : amide:sc= -0.397 K(o=-0.4,f=-1.2) USER MOD Single : A 7 LYS NZ :NH3+ 164:sc= 0 (180deg=-0.0322) USER MOD Single : A 9 GLN : amide:sc= -5.37! C(o=-5.4!,f=-9.7!) USER MOD Single : A 10 GLN : amide:sc= -2.39! C(o=-2.4!,f=-9.3!) USER MOD Single : A 11 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 23 ASN : amide:sc= -0.809 K(o=-0.81,f=-9.8!) USER MOD Single : A 26 GLN : amide:sc= -0.0867 K(o=-0.087,f=-1.6) USER MOD Single : A 33 SER OG : rot 4:sc= 0.464 USER MOD Single : A 35 LYS NZ :NH3+ 165:sc= 0.416 (180deg=0.256) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 40 GLN : amide:sc= -0.0209 X(o=-0.021,f=0) USER MOD Single : A 41 SER OG : rot -97:sc= 0.276 USER MOD Single : A 43 ASN : amide:sc=-0.00461 X(o=-0.0046,f=0) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 GLN : amide:sc= -0.886 K(o=-0.89,f=-4.8!) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 1 VAL N :NH3+ -158:sc= -0.0453 (180deg=-0.566) USER MOD Single : B 3 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 4 LYS NZ :NH3+ 147:sc= 0.0789 (180deg=0.00323) USER MOD Single : B 6 ASN : amide:sc= -3.64! C(o=-3.6!,f=-9.9!) USER MOD Single : B 18 THR OG1 : rot -42:sc= 0.745 USER MOD Single : B 26 GLN : amide:sc= -4.2! C(o=-4.2!,f=-7.8!) USER MOD Single : B 27 LYS NZ :NH3+ -141:sc= 0.592 (180deg=0.158) USER MOD Single : B 28 LYS NZ :NH3+ -115:sc= 0.414 (180deg=-0.0981) USER MOD Single : B 33 SER OG : rot -16:sc= -1.03! USER MOD Single : B 39 SER OG : rot 180:sc= 0 USER MOD Single : B 40 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 41 SER OG : rot -88:sc= 0.205 USER MOD Single : B 43 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 49 LYS NZ :NH3+ 161:sc= 0.111 (180deg=0.0374) USER MOD Single : B 50 LYS NZ :NH3+ -173:sc= -1.18 (180deg=-1.29) USER MOD Single : B 58 LYS NZ :NH3+ -132:sc= 0.149 (180deg=-0.00131) USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 -3.380 -13.983 13.874 1.00 0.00 N ATOM 2 CA VAL A 1 -2.302 -14.254 14.889 1.00 0.00 C ATOM 3 C VAL A 1 -1.360 -15.393 14.428 1.00 0.00 C ATOM 4 O VAL A 1 -0.168 -15.343 14.680 1.00 0.00 O ATOM 5 CB VAL A 1 -3.036 -14.598 16.213 1.00 0.00 C ATOM 6 CG1 VAL A 1 -3.612 -16.025 16.190 1.00 0.00 C ATOM 7 CG2 VAL A 1 -2.056 -14.472 17.385 1.00 0.00 C ATOM 0 H1 VAL A 1 -4.032 -13.262 14.244 1.00 0.00 H new ATOM 0 H2 VAL A 1 -2.948 -13.639 12.992 1.00 0.00 H new ATOM 0 H3 VAL A 1 -3.905 -14.860 13.683 1.00 0.00 H new ATOM 0 HA VAL A 1 -1.655 -13.387 15.022 1.00 0.00 H new ATOM 0 HB VAL A 1 -3.864 -13.899 16.329 1.00 0.00 H new ATOM 0 HG11 VAL A 1 -4.118 -16.228 17.134 1.00 0.00 H new ATOM 0 HG12 VAL A 1 -4.324 -16.117 15.370 1.00 0.00 H new ATOM 0 HG13 VAL A 1 -2.803 -16.742 16.050 1.00 0.00 H new ATOM 0 HG21 VAL A 1 -2.569 -14.713 18.316 1.00 0.00 H new ATOM 0 HG22 VAL A 1 -1.225 -15.162 17.240 1.00 0.00 H new ATOM 0 HG23 VAL A 1 -1.676 -13.451 17.434 1.00 0.00 H new ATOM 19 N ASP A 2 -1.880 -16.406 13.755 1.00 0.00 N ATOM 20 CA ASP A 2 -1.015 -17.543 13.272 1.00 0.00 C ATOM 21 C ASP A 2 -0.447 -17.280 11.852 1.00 0.00 C ATOM 22 O ASP A 2 0.255 -18.117 11.311 1.00 0.00 O ATOM 23 CB ASP A 2 -1.941 -18.779 13.265 1.00 0.00 C ATOM 24 CG ASP A 2 -3.017 -18.654 12.168 1.00 0.00 C ATOM 25 OD1 ASP A 2 -4.018 -18.000 12.414 1.00 0.00 O ATOM 26 OD2 ASP A 2 -2.815 -19.211 11.100 1.00 0.00 O ATOM 0 H ASP A 2 -2.869 -16.493 13.520 1.00 0.00 H new ATOM 0 HA ASP A 2 -0.146 -17.675 13.917 1.00 0.00 H new ATOM 0 HB2 ASP A 2 -1.350 -19.680 13.100 1.00 0.00 H new ATOM 0 HB3 ASP A 2 -2.419 -18.886 14.239 1.00 0.00 H new ATOM 31 N ASN A 3 -0.746 -16.139 11.248 1.00 0.00 N ATOM 32 CA ASN A 3 -0.230 -15.843 9.870 1.00 0.00 C ATOM 33 C ASN A 3 0.836 -14.737 9.927 1.00 0.00 C ATOM 34 O ASN A 3 0.570 -13.632 10.376 1.00 0.00 O ATOM 35 CB ASN A 3 -1.459 -15.382 9.072 1.00 0.00 C ATOM 36 CG ASN A 3 -2.485 -16.521 8.981 1.00 0.00 C ATOM 37 OD1 ASN A 3 -3.539 -16.450 9.579 1.00 0.00 O ATOM 38 ND2 ASN A 3 -2.221 -17.573 8.251 1.00 0.00 N ATOM 0 H ASN A 3 -1.325 -15.405 11.656 1.00 0.00 H new ATOM 0 HA ASN A 3 0.245 -16.710 9.411 1.00 0.00 H new ATOM 0 HB2 ASN A 3 -1.910 -14.513 9.552 1.00 0.00 H new ATOM 0 HB3 ASN A 3 -1.158 -15.072 8.071 1.00 0.00 H new ATOM 0 HD21 ASN A 3 -2.900 -18.331 8.185 1.00 0.00 H new ATOM 0 HD22 ASN A 3 -1.336 -17.635 7.747 1.00 0.00 H new ATOM 45 N LYS A 4 2.042 -15.034 9.478 1.00 0.00 N ATOM 46 CA LYS A 4 3.144 -14.013 9.500 1.00 0.00 C ATOM 47 C LYS A 4 3.229 -13.277 8.152 1.00 0.00 C ATOM 48 O LYS A 4 2.823 -12.137 8.057 1.00 0.00 O ATOM 49 CB LYS A 4 4.428 -14.814 9.804 1.00 0.00 C ATOM 50 CG LYS A 4 5.666 -13.900 9.733 1.00 0.00 C ATOM 51 CD LYS A 4 6.908 -14.659 10.214 1.00 0.00 C ATOM 52 CE LYS A 4 7.249 -15.789 9.227 1.00 0.00 C ATOM 53 NZ LYS A 4 8.733 -15.942 9.286 1.00 0.00 N ATOM 0 H LYS A 4 2.307 -15.942 9.097 1.00 0.00 H new ATOM 0 HA LYS A 4 2.979 -13.237 10.248 1.00 0.00 H new ATOM 0 HB2 LYS A 4 4.357 -15.263 10.795 1.00 0.00 H new ATOM 0 HB3 LYS A 4 4.531 -15.631 9.090 1.00 0.00 H new ATOM 0 HG2 LYS A 4 5.815 -13.555 8.710 1.00 0.00 H new ATOM 0 HG3 LYS A 4 5.510 -13.014 10.349 1.00 0.00 H new ATOM 0 HD2 LYS A 4 7.752 -13.974 10.301 1.00 0.00 H new ATOM 0 HD3 LYS A 4 6.730 -15.073 11.206 1.00 0.00 H new ATOM 0 HE2 LYS A 4 6.748 -16.716 9.505 1.00 0.00 H new ATOM 0 HE3 LYS A 4 6.921 -15.540 8.218 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 9.151 -15.621 8.389 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 9.110 -15.370 10.068 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 8.973 -16.942 9.441 1.00 0.00 H new ATOM 67 N PHE A 5 3.754 -13.917 7.117 1.00 0.00 N ATOM 68 CA PHE A 5 3.883 -13.244 5.776 1.00 0.00 C ATOM 69 C PHE A 5 2.526 -12.786 5.221 1.00 0.00 C ATOM 70 O PHE A 5 2.478 -11.845 4.448 1.00 0.00 O ATOM 71 CB PHE A 5 4.556 -14.262 4.837 1.00 0.00 C ATOM 72 CG PHE A 5 5.994 -14.488 5.277 1.00 0.00 C ATOM 73 CD1 PHE A 5 6.824 -13.394 5.579 1.00 0.00 C ATOM 74 CD2 PHE A 5 6.488 -15.792 5.402 1.00 0.00 C ATOM 75 CE1 PHE A 5 8.137 -13.609 6.004 1.00 0.00 C ATOM 76 CE2 PHE A 5 7.807 -16.002 5.824 1.00 0.00 C ATOM 77 CZ PHE A 5 8.628 -14.910 6.125 1.00 0.00 C ATOM 0 H PHE A 5 4.097 -14.877 7.148 1.00 0.00 H new ATOM 0 HA PHE A 5 4.479 -12.336 5.866 1.00 0.00 H new ATOM 0 HB2 PHE A 5 4.008 -15.204 4.853 1.00 0.00 H new ATOM 0 HB3 PHE A 5 4.532 -13.896 3.810 1.00 0.00 H new ATOM 0 HD1 PHE A 5 6.446 -12.387 5.482 1.00 0.00 H new ATOM 0 HD2 PHE A 5 5.853 -16.635 5.173 1.00 0.00 H new ATOM 0 HE1 PHE A 5 8.773 -12.768 6.239 1.00 0.00 H new ATOM 0 HE2 PHE A 5 8.190 -17.007 5.917 1.00 0.00 H new ATOM 0 HZ PHE A 5 9.644 -15.074 6.452 1.00 0.00 H new ATOM 87 N ASN A 6 1.426 -13.418 5.614 1.00 0.00 N ATOM 88 CA ASN A 6 0.074 -12.981 5.109 1.00 0.00 C ATOM 89 C ASN A 6 -0.145 -11.490 5.433 1.00 0.00 C ATOM 90 O ASN A 6 -0.428 -10.706 4.544 1.00 0.00 O ATOM 91 CB ASN A 6 -0.958 -13.849 5.845 1.00 0.00 C ATOM 92 CG ASN A 6 -0.826 -15.314 5.405 1.00 0.00 C ATOM 93 OD1 ASN A 6 -0.244 -16.119 6.106 1.00 0.00 O ATOM 94 ND2 ASN A 6 -1.344 -15.699 4.269 1.00 0.00 N ATOM 0 H ASN A 6 1.411 -14.210 6.257 1.00 0.00 H new ATOM 0 HA ASN A 6 -0.013 -13.100 4.029 1.00 0.00 H new ATOM 0 HB2 ASN A 6 -0.809 -13.770 6.922 1.00 0.00 H new ATOM 0 HB3 ASN A 6 -1.965 -13.487 5.635 1.00 0.00 H new ATOM 0 HD21 ASN A 6 -1.259 -16.672 3.973 1.00 0.00 H new ATOM 0 HD22 ASN A 6 -1.833 -15.027 3.678 1.00 0.00 H new ATOM 101 N LYS A 7 0.032 -11.085 6.687 1.00 0.00 N ATOM 102 CA LYS A 7 -0.124 -9.632 7.029 1.00 0.00 C ATOM 103 C LYS A 7 1.229 -8.890 6.988 1.00 0.00 C ATOM 104 O LYS A 7 1.233 -7.680 6.970 1.00 0.00 O ATOM 105 CB LYS A 7 -0.752 -9.544 8.420 1.00 0.00 C ATOM 106 CG LYS A 7 -1.152 -8.089 8.707 1.00 0.00 C ATOM 107 CD LYS A 7 -0.454 -7.567 9.966 1.00 0.00 C ATOM 108 CE LYS A 7 -0.966 -8.312 11.211 1.00 0.00 C ATOM 109 NZ LYS A 7 0.239 -8.955 11.820 1.00 0.00 N ATOM 0 H LYS A 7 0.273 -11.694 7.469 1.00 0.00 H new ATOM 0 HA LYS A 7 -0.765 -9.148 6.292 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -1.627 -10.192 8.478 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -0.046 -9.894 9.173 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -0.891 -7.461 7.855 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -2.233 -8.023 8.832 1.00 0.00 H new ATOM 0 HD2 LYS A 7 0.624 -7.699 9.873 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -0.636 -6.498 10.074 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -1.440 -7.624 11.912 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -1.714 -9.058 10.941 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 0.023 -9.244 12.795 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 0.505 -9.791 11.262 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 1.028 -8.278 11.826 1.00 0.00 H new ATOM 123 N GLU A 8 2.373 -9.571 6.925 1.00 0.00 N ATOM 124 CA GLU A 8 3.670 -8.814 6.814 1.00 0.00 C ATOM 125 C GLU A 8 3.693 -8.168 5.441 1.00 0.00 C ATOM 126 O GLU A 8 4.034 -7.020 5.307 1.00 0.00 O ATOM 127 CB GLU A 8 4.824 -9.804 6.952 1.00 0.00 C ATOM 128 CG GLU A 8 5.069 -10.142 8.426 1.00 0.00 C ATOM 129 CD GLU A 8 5.409 -8.871 9.222 1.00 0.00 C ATOM 130 OE1 GLU A 8 6.401 -8.233 8.899 1.00 0.00 O ATOM 131 OE2 GLU A 8 4.663 -8.554 10.135 1.00 0.00 O ATOM 0 H GLU A 8 2.456 -10.587 6.945 1.00 0.00 H new ATOM 0 HA GLU A 8 3.765 -8.054 7.590 1.00 0.00 H new ATOM 0 HB2 GLU A 8 4.598 -10.714 6.397 1.00 0.00 H new ATOM 0 HB3 GLU A 8 5.728 -9.380 6.515 1.00 0.00 H new ATOM 0 HG2 GLU A 8 4.183 -10.616 8.848 1.00 0.00 H new ATOM 0 HG3 GLU A 8 5.885 -10.860 8.510 1.00 0.00 H new ATOM 138 N GLN A 9 3.244 -8.899 4.435 1.00 0.00 N ATOM 139 CA GLN A 9 3.129 -8.326 3.067 1.00 0.00 C ATOM 140 C GLN A 9 2.105 -7.186 3.119 1.00 0.00 C ATOM 141 O GLN A 9 2.283 -6.164 2.512 1.00 0.00 O ATOM 142 CB GLN A 9 2.591 -9.441 2.172 1.00 0.00 C ATOM 143 CG GLN A 9 3.635 -10.530 1.956 1.00 0.00 C ATOM 144 CD GLN A 9 4.117 -10.457 0.511 1.00 0.00 C ATOM 145 OE1 GLN A 9 5.179 -9.945 0.244 1.00 0.00 O ATOM 146 NE2 GLN A 9 3.374 -10.956 -0.444 1.00 0.00 N ATOM 0 H GLN A 9 2.953 -9.873 4.516 1.00 0.00 H new ATOM 0 HA GLN A 9 4.082 -7.950 2.695 1.00 0.00 H new ATOM 0 HB2 GLN A 9 1.699 -9.874 2.624 1.00 0.00 H new ATOM 0 HB3 GLN A 9 2.291 -9.025 1.210 1.00 0.00 H new ATOM 0 HG2 GLN A 9 4.471 -10.395 2.642 1.00 0.00 H new ATOM 0 HG3 GLN A 9 3.208 -11.511 2.164 1.00 0.00 H new ATOM 0 HE21 GLN A 9 2.478 -11.388 -0.220 1.00 0.00 H new ATOM 0 HE22 GLN A 9 3.691 -10.913 -1.412 1.00 0.00 H new ATOM 155 N GLN A 10 1.044 -7.378 3.887 1.00 0.00 N ATOM 156 CA GLN A 10 -0.018 -6.331 4.064 1.00 0.00 C ATOM 157 C GLN A 10 0.567 -5.102 4.766 1.00 0.00 C ATOM 158 O GLN A 10 0.368 -3.984 4.329 1.00 0.00 O ATOM 159 CB GLN A 10 -1.065 -7.007 4.956 1.00 0.00 C ATOM 160 CG GLN A 10 -2.444 -6.921 4.310 1.00 0.00 C ATOM 161 CD GLN A 10 -2.806 -8.250 3.646 1.00 0.00 C ATOM 162 OE1 GLN A 10 -2.969 -8.315 2.455 1.00 0.00 O ATOM 163 NE2 GLN A 10 -2.962 -9.321 4.380 1.00 0.00 N ATOM 0 H GLN A 10 0.872 -8.238 4.407 1.00 0.00 H new ATOM 0 HA GLN A 10 -0.435 -5.987 3.117 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -0.796 -8.051 5.118 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -1.084 -6.527 5.935 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -3.190 -6.669 5.063 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -2.456 -6.122 3.569 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -2.825 -9.272 5.390 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -3.220 -10.206 3.943 1.00 0.00 H new ATOM 172 N ASN A 11 1.296 -5.316 5.843 1.00 0.00 N ATOM 173 CA ASN A 11 1.924 -4.184 6.588 1.00 0.00 C ATOM 174 C ASN A 11 3.048 -3.572 5.752 1.00 0.00 C ATOM 175 O ASN A 11 3.145 -2.378 5.645 1.00 0.00 O ATOM 176 CB ASN A 11 2.493 -4.793 7.878 1.00 0.00 C ATOM 177 CG ASN A 11 2.854 -3.669 8.857 1.00 0.00 C ATOM 178 OD1 ASN A 11 1.986 -3.094 9.485 1.00 0.00 O ATOM 179 ND2 ASN A 11 4.104 -3.322 9.010 1.00 0.00 N ATOM 0 H ASN A 11 1.481 -6.239 6.236 1.00 0.00 H new ATOM 0 HA ASN A 11 1.205 -3.393 6.804 1.00 0.00 H new ATOM 0 HB2 ASN A 11 1.762 -5.463 8.330 1.00 0.00 H new ATOM 0 HB3 ASN A 11 3.376 -5.391 7.652 1.00 0.00 H new ATOM 0 HD21 ASN A 11 4.349 -2.571 9.655 1.00 0.00 H new ATOM 0 HD22 ASN A 11 4.835 -3.802 8.485 1.00 0.00 H new ATOM 186 N ALA A 12 3.879 -4.396 5.140 1.00 0.00 N ATOM 187 CA ALA A 12 4.986 -3.869 4.282 1.00 0.00 C ATOM 188 C ALA A 12 4.388 -3.148 3.077 1.00 0.00 C ATOM 189 O ALA A 12 4.823 -2.072 2.733 1.00 0.00 O ATOM 190 CB ALA A 12 5.790 -5.085 3.827 1.00 0.00 C ATOM 0 H ALA A 12 3.832 -5.413 5.202 1.00 0.00 H new ATOM 0 HA ALA A 12 5.618 -3.162 4.819 1.00 0.00 H new ATOM 0 HB1 ALA A 12 6.616 -4.759 3.194 1.00 0.00 H new ATOM 0 HB2 ALA A 12 6.185 -5.607 4.699 1.00 0.00 H new ATOM 0 HB3 ALA A 12 5.144 -5.758 3.263 1.00 0.00 H new ATOM 196 N PHE A 13 3.359 -3.724 2.474 1.00 0.00 N ATOM 197 CA PHE A 13 2.671 -3.064 1.320 1.00 0.00 C ATOM 198 C PHE A 13 2.156 -1.711 1.797 1.00 0.00 C ATOM 199 O PHE A 13 2.514 -0.681 1.261 1.00 0.00 O ATOM 200 CB PHE A 13 1.486 -3.990 0.944 1.00 0.00 C ATOM 201 CG PHE A 13 0.529 -3.274 0.023 1.00 0.00 C ATOM 202 CD1 PHE A 13 1.014 -2.642 -1.122 1.00 0.00 C ATOM 203 CD2 PHE A 13 -0.846 -3.275 0.289 1.00 0.00 C ATOM 204 CE1 PHE A 13 0.137 -2.015 -1.987 1.00 0.00 C ATOM 205 CE2 PHE A 13 -1.724 -2.657 -0.589 1.00 0.00 C ATOM 206 CZ PHE A 13 -1.234 -2.029 -1.722 1.00 0.00 C ATOM 0 H PHE A 13 2.971 -4.629 2.740 1.00 0.00 H new ATOM 0 HA PHE A 13 3.326 -2.910 0.462 1.00 0.00 H new ATOM 0 HB2 PHE A 13 1.861 -4.892 0.460 1.00 0.00 H new ATOM 0 HB3 PHE A 13 0.963 -4.307 1.847 1.00 0.00 H new ATOM 0 HD1 PHE A 13 2.073 -2.643 -1.332 1.00 0.00 H new ATOM 0 HD2 PHE A 13 -1.223 -3.757 1.179 1.00 0.00 H new ATOM 0 HE1 PHE A 13 0.512 -1.514 -2.867 1.00 0.00 H new ATOM 0 HE2 PHE A 13 -2.785 -2.665 -0.390 1.00 0.00 H new ATOM 0 HZ PHE A 13 -1.917 -1.547 -2.405 1.00 0.00 H new ATOM 216 N TYR A 14 1.341 -1.733 2.830 1.00 0.00 N ATOM 217 CA TYR A 14 0.784 -0.482 3.407 1.00 0.00 C ATOM 218 C TYR A 14 1.910 0.500 3.761 1.00 0.00 C ATOM 219 O TYR A 14 1.911 1.617 3.308 1.00 0.00 O ATOM 220 CB TYR A 14 0.082 -0.929 4.672 1.00 0.00 C ATOM 221 CG TYR A 14 -0.535 0.260 5.345 1.00 0.00 C ATOM 222 CD1 TYR A 14 -1.821 0.666 5.001 1.00 0.00 C ATOM 223 CD2 TYR A 14 0.180 0.942 6.337 1.00 0.00 C ATOM 224 CE1 TYR A 14 -2.395 1.733 5.643 1.00 0.00 C ATOM 225 CE2 TYR A 14 -0.397 2.036 6.981 1.00 0.00 C ATOM 226 CZ TYR A 14 -1.690 2.435 6.638 1.00 0.00 C ATOM 227 OH TYR A 14 -2.277 3.508 7.283 1.00 0.00 O ATOM 0 H TYR A 14 1.038 -2.586 3.300 1.00 0.00 H new ATOM 0 HA TYR A 14 0.121 0.030 2.710 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -0.686 -1.665 4.434 1.00 0.00 H new ATOM 0 HB3 TYR A 14 0.791 -1.413 5.343 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -2.366 0.142 4.230 1.00 0.00 H new ATOM 0 HD2 TYR A 14 1.176 0.621 6.603 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -3.398 2.038 5.382 1.00 0.00 H new ATOM 0 HE2 TYR A 14 0.153 2.571 7.741 1.00 0.00 H new ATOM 0 HH TYR A 14 -1.651 3.877 7.941 1.00 0.00 H new ATOM 237 N GLU A 15 2.874 0.072 4.554 1.00 0.00 N ATOM 238 CA GLU A 15 4.004 0.979 4.937 1.00 0.00 C ATOM 239 C GLU A 15 4.708 1.497 3.679 1.00 0.00 C ATOM 240 O GLU A 15 4.984 2.667 3.596 1.00 0.00 O ATOM 241 CB GLU A 15 4.948 0.153 5.819 1.00 0.00 C ATOM 242 CG GLU A 15 4.305 -0.122 7.196 1.00 0.00 C ATOM 243 CD GLU A 15 3.971 1.195 7.918 1.00 0.00 C ATOM 244 OE1 GLU A 15 4.876 1.992 8.119 1.00 0.00 O ATOM 245 OE2 GLU A 15 2.815 1.384 8.254 1.00 0.00 O ATOM 0 H GLU A 15 2.923 -0.867 4.950 1.00 0.00 H new ATOM 0 HA GLU A 15 3.655 1.855 5.483 1.00 0.00 H new ATOM 0 HB2 GLU A 15 5.182 -0.791 5.326 1.00 0.00 H new ATOM 0 HB3 GLU A 15 5.890 0.686 5.951 1.00 0.00 H new ATOM 0 HG2 GLU A 15 3.397 -0.711 7.067 1.00 0.00 H new ATOM 0 HG3 GLU A 15 4.985 -0.715 7.808 1.00 0.00 H new ATOM 252 N ILE A 16 4.934 0.657 2.673 1.00 0.00 N ATOM 253 CA ILE A 16 5.554 1.164 1.388 1.00 0.00 C ATOM 254 C ILE A 16 4.689 2.319 0.840 1.00 0.00 C ATOM 255 O ILE A 16 5.198 3.376 0.510 1.00 0.00 O ATOM 256 CB ILE A 16 5.586 -0.057 0.438 1.00 0.00 C ATOM 257 CG1 ILE A 16 6.918 -0.767 0.649 1.00 0.00 C ATOM 258 CG2 ILE A 16 5.451 0.355 -1.038 1.00 0.00 C ATOM 259 CD1 ILE A 16 6.744 -2.272 0.491 1.00 0.00 C ATOM 0 H ILE A 16 4.719 -0.340 2.688 1.00 0.00 H new ATOM 0 HA ILE A 16 6.561 1.562 1.516 1.00 0.00 H new ATOM 0 HB ILE A 16 4.742 -0.708 0.666 1.00 0.00 H new ATOM 0 HG12 ILE A 16 7.651 -0.401 -0.070 1.00 0.00 H new ATOM 0 HG13 ILE A 16 7.305 -0.541 1.642 1.00 0.00 H new ATOM 0 HG21 ILE A 16 5.479 -0.534 -1.668 1.00 0.00 H new ATOM 0 HG22 ILE A 16 4.504 0.875 -1.185 1.00 0.00 H new ATOM 0 HG23 ILE A 16 6.274 1.017 -1.308 1.00 0.00 H new ATOM 0 HD11 ILE A 16 7.703 -2.767 0.644 1.00 0.00 H new ATOM 0 HD12 ILE A 16 6.027 -2.635 1.227 1.00 0.00 H new ATOM 0 HD13 ILE A 16 6.378 -2.493 -0.512 1.00 0.00 H new ATOM 271 N LEU A 17 3.387 2.117 0.787 1.00 0.00 N ATOM 272 CA LEU A 17 2.455 3.206 0.310 1.00 0.00 C ATOM 273 C LEU A 17 2.449 4.392 1.303 1.00 0.00 C ATOM 274 O LEU A 17 2.352 5.531 0.903 1.00 0.00 O ATOM 275 CB LEU A 17 1.040 2.597 0.277 1.00 0.00 C ATOM 276 CG LEU A 17 0.949 1.434 -0.717 1.00 0.00 C ATOM 277 CD1 LEU A 17 0.232 0.260 -0.090 1.00 0.00 C ATOM 278 CD2 LEU A 17 0.113 1.812 -1.908 1.00 0.00 C ATOM 0 H LEU A 17 2.928 1.246 1.053 1.00 0.00 H new ATOM 0 HA LEU A 17 2.773 3.570 -0.667 1.00 0.00 H new ATOM 0 HB2 LEU A 17 0.771 2.247 1.273 1.00 0.00 H new ATOM 0 HB3 LEU A 17 0.318 3.367 0.004 1.00 0.00 H new ATOM 0 HG LEU A 17 1.972 1.188 -1.003 1.00 0.00 H new ATOM 0 HD11 LEU A 17 0.175 -0.558 -0.808 1.00 0.00 H new ATOM 0 HD12 LEU A 17 0.778 -0.070 0.793 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -0.776 0.560 0.198 1.00 0.00 H new ATOM 0 HD21 LEU A 17 0.063 0.971 -2.599 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -0.893 2.071 -1.579 1.00 0.00 H new ATOM 0 HD23 LEU A 17 0.562 2.668 -2.411 1.00 0.00 H new ATOM 290 N HIS A 18 2.520 4.116 2.594 1.00 0.00 N ATOM 291 CA HIS A 18 2.477 5.204 3.639 1.00 0.00 C ATOM 292 C HIS A 18 3.877 5.756 4.012 1.00 0.00 C ATOM 293 O HIS A 18 3.970 6.616 4.874 1.00 0.00 O ATOM 294 CB HIS A 18 1.813 4.546 4.870 1.00 0.00 C ATOM 295 CG HIS A 18 0.336 4.329 4.618 1.00 0.00 C ATOM 296 ND1 HIS A 18 -0.632 5.233 5.027 1.00 0.00 N ATOM 297 CD2 HIS A 18 -0.357 3.331 3.973 1.00 0.00 C ATOM 298 CE1 HIS A 18 -1.823 4.749 4.615 1.00 0.00 C ATOM 299 NE2 HIS A 18 -1.697 3.625 3.966 1.00 0.00 N ATOM 0 H HIS A 18 2.607 3.172 2.971 1.00 0.00 H new ATOM 0 HA HIS A 18 1.929 6.068 3.263 1.00 0.00 H new ATOM 0 HB2 HIS A 18 2.296 3.593 5.086 1.00 0.00 H new ATOM 0 HB3 HIS A 18 1.950 5.179 5.747 1.00 0.00 H new ATOM 0 HD2 HIS A 18 0.087 2.448 3.537 1.00 0.00 H new ATOM 0 HE1 HIS A 18 -2.769 5.236 4.801 1.00 0.00 H new ATOM 0 HE2 HIS A 18 -2.443 3.076 3.540 1.00 0.00 H new ATOM 307 N LEU A 19 4.960 5.298 3.388 1.00 0.00 N ATOM 308 CA LEU A 19 6.325 5.842 3.745 1.00 0.00 C ATOM 309 C LEU A 19 6.418 7.322 3.305 1.00 0.00 C ATOM 310 O LEU A 19 5.853 7.694 2.286 1.00 0.00 O ATOM 311 CB LEU A 19 7.365 4.983 3.002 1.00 0.00 C ATOM 312 CG LEU A 19 7.809 3.780 3.867 1.00 0.00 C ATOM 313 CD1 LEU A 19 8.704 2.870 3.025 1.00 0.00 C ATOM 314 CD2 LEU A 19 8.600 4.253 5.101 1.00 0.00 C ATOM 0 H LEU A 19 4.954 4.583 2.660 1.00 0.00 H new ATOM 0 HA LEU A 19 6.504 5.800 4.819 1.00 0.00 H new ATOM 0 HB2 LEU A 19 6.942 4.624 2.063 1.00 0.00 H new ATOM 0 HB3 LEU A 19 8.232 5.593 2.749 1.00 0.00 H new ATOM 0 HG LEU A 19 6.922 3.245 4.204 1.00 0.00 H new ATOM 0 HD11 LEU A 19 9.023 2.018 3.625 1.00 0.00 H new ATOM 0 HD12 LEU A 19 8.148 2.515 2.157 1.00 0.00 H new ATOM 0 HD13 LEU A 19 9.579 3.428 2.692 1.00 0.00 H new ATOM 0 HD21 LEU A 19 8.901 3.389 5.693 1.00 0.00 H new ATOM 0 HD22 LEU A 19 9.487 4.798 4.778 1.00 0.00 H new ATOM 0 HD23 LEU A 19 7.973 4.907 5.707 1.00 0.00 H new ATOM 326 N PRO A 20 7.091 8.130 4.110 1.00 0.00 N ATOM 327 CA PRO A 20 7.208 9.591 3.820 1.00 0.00 C ATOM 328 C PRO A 20 8.058 9.920 2.575 1.00 0.00 C ATOM 329 O PRO A 20 7.871 10.971 1.988 1.00 0.00 O ATOM 330 CB PRO A 20 7.857 10.157 5.084 1.00 0.00 C ATOM 331 CG PRO A 20 8.592 9.009 5.685 1.00 0.00 C ATOM 332 CD PRO A 20 7.810 7.769 5.346 1.00 0.00 C ATOM 0 HA PRO A 20 6.233 10.020 3.588 1.00 0.00 H new ATOM 0 HB2 PRO A 20 8.533 10.978 4.847 1.00 0.00 H new ATOM 0 HB3 PRO A 20 7.107 10.549 5.771 1.00 0.00 H new ATOM 0 HG2 PRO A 20 9.605 8.948 5.288 1.00 0.00 H new ATOM 0 HG3 PRO A 20 8.679 9.128 6.765 1.00 0.00 H new ATOM 0 HD2 PRO A 20 8.466 6.913 5.191 1.00 0.00 H new ATOM 0 HD3 PRO A 20 7.120 7.501 6.146 1.00 0.00 H new ATOM 340 N ASN A 21 8.996 9.070 2.171 1.00 0.00 N ATOM 341 CA ASN A 21 9.839 9.417 0.969 1.00 0.00 C ATOM 342 C ASN A 21 9.728 8.371 -0.162 1.00 0.00 C ATOM 343 O ASN A 21 10.421 8.489 -1.162 1.00 0.00 O ATOM 344 CB ASN A 21 11.283 9.537 1.488 1.00 0.00 C ATOM 345 CG ASN A 21 11.327 10.466 2.711 1.00 0.00 C ATOM 346 OD1 ASN A 21 11.254 10.015 3.835 1.00 0.00 O ATOM 347 ND2 ASN A 21 11.435 11.750 2.539 1.00 0.00 N ATOM 0 H ASN A 21 9.207 8.175 2.612 1.00 0.00 H new ATOM 0 HA ASN A 21 9.494 10.348 0.518 1.00 0.00 H new ATOM 0 HB2 ASN A 21 11.665 8.552 1.756 1.00 0.00 H new ATOM 0 HB3 ASN A 21 11.929 9.927 0.702 1.00 0.00 H new ATOM 0 HD21 ASN A 21 11.458 12.373 3.347 1.00 0.00 H new ATOM 0 HD22 ASN A 21 11.497 12.135 1.596 1.00 0.00 H new ATOM 354 N LEU A 22 8.842 7.383 -0.057 1.00 0.00 N ATOM 355 CA LEU A 22 8.693 6.402 -1.186 1.00 0.00 C ATOM 356 C LEU A 22 7.802 7.043 -2.254 1.00 0.00 C ATOM 357 O LEU A 22 6.734 7.556 -1.957 1.00 0.00 O ATOM 358 CB LEU A 22 8.020 5.127 -0.626 1.00 0.00 C ATOM 359 CG LEU A 22 9.036 4.103 -0.049 1.00 0.00 C ATOM 360 CD1 LEU A 22 8.583 2.688 -0.412 1.00 0.00 C ATOM 361 CD2 LEU A 22 10.448 4.287 -0.609 1.00 0.00 C ATOM 0 H LEU A 22 8.233 7.224 0.746 1.00 0.00 H new ATOM 0 HA LEU A 22 9.657 6.143 -1.623 1.00 0.00 H new ATOM 0 HB2 LEU A 22 7.315 5.409 0.156 1.00 0.00 H new ATOM 0 HB3 LEU A 22 7.443 4.650 -1.419 1.00 0.00 H new ATOM 0 HG LEU A 22 9.066 4.264 1.029 1.00 0.00 H new ATOM 0 HD11 LEU A 22 9.292 1.965 -0.010 1.00 0.00 H new ATOM 0 HD12 LEU A 22 7.596 2.502 0.011 1.00 0.00 H new ATOM 0 HD13 LEU A 22 8.538 2.587 -1.496 1.00 0.00 H new ATOM 0 HD21 LEU A 22 11.113 3.544 -0.170 1.00 0.00 H new ATOM 0 HD22 LEU A 22 10.429 4.162 -1.692 1.00 0.00 H new ATOM 0 HD23 LEU A 22 10.809 5.286 -0.365 1.00 0.00 H new ATOM 373 N ASN A 23 8.241 7.020 -3.487 1.00 0.00 N ATOM 374 CA ASN A 23 7.432 7.639 -4.598 1.00 0.00 C ATOM 375 C ASN A 23 6.757 6.564 -5.451 1.00 0.00 C ATOM 376 O ASN A 23 6.813 5.392 -5.139 1.00 0.00 O ATOM 377 CB ASN A 23 8.394 8.507 -5.440 1.00 0.00 C ATOM 378 CG ASN A 23 9.670 7.740 -5.825 1.00 0.00 C ATOM 379 OD1 ASN A 23 9.633 6.867 -6.662 1.00 0.00 O ATOM 380 ND2 ASN A 23 10.802 8.033 -5.239 1.00 0.00 N ATOM 0 H ASN A 23 9.124 6.601 -3.779 1.00 0.00 H new ATOM 0 HA ASN A 23 6.631 8.255 -4.190 1.00 0.00 H new ATOM 0 HB2 ASN A 23 7.885 8.841 -6.344 1.00 0.00 H new ATOM 0 HB3 ASN A 23 8.663 9.401 -4.877 1.00 0.00 H new ATOM 0 HD21 ASN A 23 11.651 7.526 -5.488 1.00 0.00 H new ATOM 0 HD22 ASN A 23 10.835 8.769 -4.533 1.00 0.00 H new ATOM 387 N GLU A 24 6.108 6.971 -6.518 1.00 0.00 N ATOM 388 CA GLU A 24 5.396 5.993 -7.414 1.00 0.00 C ATOM 389 C GLU A 24 6.378 4.944 -7.959 1.00 0.00 C ATOM 390 O GLU A 24 6.043 3.786 -8.052 1.00 0.00 O ATOM 391 CB GLU A 24 4.805 6.840 -8.555 1.00 0.00 C ATOM 392 CG GLU A 24 3.859 5.987 -9.418 1.00 0.00 C ATOM 393 CD GLU A 24 2.557 5.711 -8.657 1.00 0.00 C ATOM 394 OE1 GLU A 24 1.690 6.570 -8.662 1.00 0.00 O ATOM 395 OE2 GLU A 24 2.451 4.647 -8.077 1.00 0.00 O ATOM 0 H GLU A 24 6.039 7.946 -6.811 1.00 0.00 H new ATOM 0 HA GLU A 24 4.621 5.442 -6.881 1.00 0.00 H new ATOM 0 HB2 GLU A 24 4.264 7.691 -8.142 1.00 0.00 H new ATOM 0 HB3 GLU A 24 5.608 7.242 -9.172 1.00 0.00 H new ATOM 0 HG2 GLU A 24 3.641 6.504 -10.352 1.00 0.00 H new ATOM 0 HG3 GLU A 24 4.343 5.046 -9.680 1.00 0.00 H new ATOM 402 N GLU A 25 7.586 5.346 -8.299 1.00 0.00 N ATOM 403 CA GLU A 25 8.598 4.361 -8.824 1.00 0.00 C ATOM 404 C GLU A 25 9.078 3.413 -7.701 1.00 0.00 C ATOM 405 O GLU A 25 9.170 2.215 -7.905 1.00 0.00 O ATOM 406 CB GLU A 25 9.764 5.216 -9.337 1.00 0.00 C ATOM 407 CG GLU A 25 10.818 4.322 -10.006 1.00 0.00 C ATOM 408 CD GLU A 25 12.096 5.129 -10.260 1.00 0.00 C ATOM 409 OE1 GLU A 25 12.790 5.427 -9.297 1.00 0.00 O ATOM 410 OE2 GLU A 25 12.361 5.437 -11.411 1.00 0.00 O ATOM 0 H GLU A 25 7.915 6.310 -8.236 1.00 0.00 H new ATOM 0 HA GLU A 25 8.177 3.729 -9.606 1.00 0.00 H new ATOM 0 HB2 GLU A 25 9.398 5.955 -10.049 1.00 0.00 H new ATOM 0 HB3 GLU A 25 10.214 5.766 -8.510 1.00 0.00 H new ATOM 0 HG2 GLU A 25 11.038 3.465 -9.370 1.00 0.00 H new ATOM 0 HG3 GLU A 25 10.432 3.930 -10.947 1.00 0.00 H new ATOM 417 N GLN A 26 9.390 3.945 -6.530 1.00 0.00 N ATOM 418 CA GLN A 26 9.882 3.083 -5.393 1.00 0.00 C ATOM 419 C GLN A 26 8.734 2.258 -4.792 1.00 0.00 C ATOM 420 O GLN A 26 8.819 1.052 -4.719 1.00 0.00 O ATOM 421 CB GLN A 26 10.453 4.050 -4.338 1.00 0.00 C ATOM 422 CG GLN A 26 11.617 4.867 -4.923 1.00 0.00 C ATOM 423 CD GLN A 26 12.844 3.976 -5.136 1.00 0.00 C ATOM 424 OE1 GLN A 26 13.607 3.748 -4.221 1.00 0.00 O ATOM 425 NE2 GLN A 26 13.076 3.458 -6.311 1.00 0.00 N ATOM 0 H GLN A 26 9.324 4.940 -6.314 1.00 0.00 H new ATOM 0 HA GLN A 26 10.635 2.374 -5.739 1.00 0.00 H new ATOM 0 HB2 GLN A 26 9.668 4.722 -3.991 1.00 0.00 H new ATOM 0 HB3 GLN A 26 10.797 3.487 -3.470 1.00 0.00 H new ATOM 0 HG2 GLN A 26 11.316 5.313 -5.871 1.00 0.00 H new ATOM 0 HG3 GLN A 26 11.868 5.687 -4.250 1.00 0.00 H new ATOM 0 HE21 GLN A 26 12.439 3.645 -7.086 1.00 0.00 H new ATOM 0 HE22 GLN A 26 13.894 2.866 -6.455 1.00 0.00 H new ATOM 434 N ARG A 27 7.666 2.906 -4.369 1.00 0.00 N ATOM 435 CA ARG A 27 6.495 2.174 -3.760 1.00 0.00 C ATOM 436 C ARG A 27 5.918 1.106 -4.729 1.00 0.00 C ATOM 437 O ARG A 27 5.657 -0.007 -4.320 1.00 0.00 O ATOM 438 CB ARG A 27 5.448 3.281 -3.502 1.00 0.00 C ATOM 439 CG ARG A 27 4.079 2.684 -3.140 1.00 0.00 C ATOM 440 CD ARG A 27 3.021 3.795 -3.122 1.00 0.00 C ATOM 441 NE ARG A 27 2.932 4.290 -4.536 1.00 0.00 N ATOM 442 CZ ARG A 27 2.966 5.578 -4.794 1.00 0.00 C ATOM 443 NH1 ARG A 27 3.931 6.328 -4.310 1.00 0.00 N ATOM 444 NH2 ARG A 27 2.034 6.119 -5.541 1.00 0.00 N ATOM 0 H ARG A 27 7.554 3.919 -4.420 1.00 0.00 H new ATOM 0 HA ARG A 27 6.782 1.635 -2.857 1.00 0.00 H new ATOM 0 HB2 ARG A 27 5.791 3.927 -2.693 1.00 0.00 H new ATOM 0 HB3 ARG A 27 5.351 3.906 -4.390 1.00 0.00 H new ATOM 0 HG2 ARG A 27 3.803 1.917 -3.863 1.00 0.00 H new ATOM 0 HG3 ARG A 27 4.129 2.200 -2.165 1.00 0.00 H new ATOM 0 HD2 ARG A 27 2.059 3.415 -2.778 1.00 0.00 H new ATOM 0 HD3 ARG A 27 3.307 4.598 -2.443 1.00 0.00 H new ATOM 0 HE ARG A 27 2.845 3.622 -5.302 1.00 0.00 H new ATOM 0 HH11 ARG A 27 4.659 5.911 -3.730 1.00 0.00 H new ATOM 0 HH12 ARG A 27 3.952 7.327 -4.514 1.00 0.00 H new ATOM 0 HH21 ARG A 27 1.285 5.540 -5.920 1.00 0.00 H new ATOM 0 HH22 ARG A 27 2.058 7.119 -5.743 1.00 0.00 H new ATOM 458 N ASN A 28 5.712 1.443 -5.999 1.00 0.00 N ATOM 459 CA ASN A 28 5.138 0.447 -6.986 1.00 0.00 C ATOM 460 C ASN A 28 6.107 -0.716 -7.210 1.00 0.00 C ATOM 461 O ASN A 28 5.717 -1.863 -7.114 1.00 0.00 O ATOM 462 CB ASN A 28 4.938 1.238 -8.282 1.00 0.00 C ATOM 463 CG ASN A 28 4.247 0.393 -9.370 1.00 0.00 C ATOM 464 OD1 ASN A 28 4.036 -0.795 -9.218 1.00 0.00 O ATOM 465 ND2 ASN A 28 3.883 0.976 -10.476 1.00 0.00 N ATOM 0 H ASN A 28 5.917 2.362 -6.390 1.00 0.00 H new ATOM 0 HA ASN A 28 4.207 0.010 -6.626 1.00 0.00 H new ATOM 0 HB2 ASN A 28 4.339 2.126 -8.077 1.00 0.00 H new ATOM 0 HB3 ASN A 28 5.904 1.583 -8.650 1.00 0.00 H new ATOM 0 HD21 ASN A 28 3.423 0.437 -11.210 1.00 0.00 H new ATOM 0 HD22 ASN A 28 4.057 1.972 -10.609 1.00 0.00 H new ATOM 472 N ALA A 29 7.368 -0.423 -7.477 1.00 0.00 N ATOM 473 CA ALA A 29 8.384 -1.515 -7.674 1.00 0.00 C ATOM 474 C ALA A 29 8.446 -2.385 -6.413 1.00 0.00 C ATOM 475 O ALA A 29 8.614 -3.588 -6.484 1.00 0.00 O ATOM 476 CB ALA A 29 9.705 -0.796 -7.881 1.00 0.00 C ATOM 0 H ALA A 29 7.734 0.525 -7.566 1.00 0.00 H new ATOM 0 HA ALA A 29 8.142 -2.165 -8.515 1.00 0.00 H new ATOM 0 HB1 ALA A 29 10.498 -1.528 -8.032 1.00 0.00 H new ATOM 0 HB2 ALA A 29 9.635 -0.151 -8.757 1.00 0.00 H new ATOM 0 HB3 ALA A 29 9.932 -0.192 -7.003 1.00 0.00 H new ATOM 482 N PHE A 30 8.266 -1.767 -5.263 1.00 0.00 N ATOM 483 CA PHE A 30 8.251 -2.510 -3.970 1.00 0.00 C ATOM 484 C PHE A 30 7.047 -3.426 -3.922 1.00 0.00 C ATOM 485 O PHE A 30 7.157 -4.578 -3.584 1.00 0.00 O ATOM 486 CB PHE A 30 8.126 -1.435 -2.911 1.00 0.00 C ATOM 487 CG PHE A 30 9.498 -1.088 -2.444 1.00 0.00 C ATOM 488 CD1 PHE A 30 10.525 -0.757 -3.347 1.00 0.00 C ATOM 489 CD2 PHE A 30 9.748 -1.131 -1.102 1.00 0.00 C ATOM 490 CE1 PHE A 30 11.801 -0.481 -2.862 1.00 0.00 C ATOM 491 CE2 PHE A 30 10.994 -0.846 -0.634 1.00 0.00 C ATOM 492 CZ PHE A 30 12.027 -0.526 -1.496 1.00 0.00 C ATOM 0 H PHE A 30 8.127 -0.761 -5.173 1.00 0.00 H new ATOM 0 HA PHE A 30 9.139 -3.127 -3.831 1.00 0.00 H new ATOM 0 HB2 PHE A 30 7.628 -0.555 -3.318 1.00 0.00 H new ATOM 0 HB3 PHE A 30 7.518 -1.789 -2.078 1.00 0.00 H new ATOM 0 HD1 PHE A 30 10.325 -0.717 -4.408 1.00 0.00 H new ATOM 0 HD2 PHE A 30 8.958 -1.391 -0.413 1.00 0.00 H new ATOM 0 HE1 PHE A 30 12.604 -0.235 -3.542 1.00 0.00 H new ATOM 0 HE2 PHE A 30 11.179 -0.870 0.430 1.00 0.00 H new ATOM 0 HZ PHE A 30 13.010 -0.311 -1.104 1.00 0.00 H new ATOM 502 N ILE A 31 5.908 -2.914 -4.309 1.00 0.00 N ATOM 503 CA ILE A 31 4.674 -3.745 -4.362 1.00 0.00 C ATOM 504 C ILE A 31 4.878 -4.854 -5.416 1.00 0.00 C ATOM 505 O ILE A 31 4.342 -5.924 -5.269 1.00 0.00 O ATOM 506 CB ILE A 31 3.562 -2.761 -4.712 1.00 0.00 C ATOM 507 CG1 ILE A 31 3.371 -1.808 -3.526 1.00 0.00 C ATOM 508 CG2 ILE A 31 2.276 -3.509 -4.965 1.00 0.00 C ATOM 509 CD1 ILE A 31 2.659 -0.547 -3.982 1.00 0.00 C ATOM 0 H ILE A 31 5.781 -1.943 -4.594 1.00 0.00 H new ATOM 0 HA ILE A 31 4.428 -4.259 -3.433 1.00 0.00 H new ATOM 0 HB ILE A 31 3.828 -2.203 -5.610 1.00 0.00 H new ATOM 0 HG12 ILE A 31 2.792 -2.299 -2.744 1.00 0.00 H new ATOM 0 HG13 ILE A 31 4.339 -1.553 -3.094 1.00 0.00 H new ATOM 0 HG21 ILE A 31 1.486 -2.801 -5.214 1.00 0.00 H new ATOM 0 HG22 ILE A 31 2.416 -4.203 -5.794 1.00 0.00 H new ATOM 0 HG23 ILE A 31 1.996 -4.064 -4.070 1.00 0.00 H new ATOM 0 HD11 ILE A 31 2.528 0.124 -3.133 1.00 0.00 H new ATOM 0 HD12 ILE A 31 3.254 -0.050 -4.748 1.00 0.00 H new ATOM 0 HD13 ILE A 31 1.684 -0.808 -4.392 1.00 0.00 H new ATOM 521 N GLN A 32 5.702 -4.625 -6.442 1.00 0.00 N ATOM 522 CA GLN A 32 5.980 -5.716 -7.440 1.00 0.00 C ATOM 523 C GLN A 32 6.871 -6.785 -6.769 1.00 0.00 C ATOM 524 O GLN A 32 6.565 -7.960 -6.818 1.00 0.00 O ATOM 525 CB GLN A 32 6.682 -5.044 -8.633 1.00 0.00 C ATOM 526 CG GLN A 32 5.676 -4.159 -9.386 1.00 0.00 C ATOM 527 CD GLN A 32 6.368 -3.440 -10.549 1.00 0.00 C ATOM 528 OE1 GLN A 32 6.820 -2.324 -10.404 1.00 0.00 O ATOM 529 NE2 GLN A 32 6.462 -4.034 -11.709 1.00 0.00 N ATOM 0 H GLN A 32 6.180 -3.742 -6.619 1.00 0.00 H new ATOM 0 HA GLN A 32 5.075 -6.217 -7.784 1.00 0.00 H new ATOM 0 HB2 GLN A 32 7.521 -4.443 -8.283 1.00 0.00 H new ATOM 0 HB3 GLN A 32 7.089 -5.801 -9.303 1.00 0.00 H new ATOM 0 HG2 GLN A 32 4.855 -4.769 -9.763 1.00 0.00 H new ATOM 0 HG3 GLN A 32 5.242 -3.428 -8.704 1.00 0.00 H new ATOM 0 HE21 GLN A 32 6.083 -4.973 -11.834 1.00 0.00 H new ATOM 0 HE22 GLN A 32 6.915 -3.559 -12.490 1.00 0.00 H new ATOM 538 N SER A 33 7.935 -6.371 -6.084 1.00 0.00 N ATOM 539 CA SER A 33 8.820 -7.349 -5.342 1.00 0.00 C ATOM 540 C SER A 33 8.061 -7.965 -4.144 1.00 0.00 C ATOM 541 O SER A 33 8.319 -9.087 -3.754 1.00 0.00 O ATOM 542 CB SER A 33 10.046 -6.545 -4.876 1.00 0.00 C ATOM 543 OG SER A 33 9.634 -5.376 -4.185 1.00 0.00 O ATOM 0 H SER A 33 8.225 -5.396 -6.010 1.00 0.00 H new ATOM 0 HA SER A 33 9.121 -8.182 -5.977 1.00 0.00 H new ATOM 0 HB2 SER A 33 10.667 -7.160 -4.225 1.00 0.00 H new ATOM 0 HB3 SER A 33 10.658 -6.271 -5.735 1.00 0.00 H new ATOM 0 HG SER A 33 8.657 -5.370 -4.107 1.00 0.00 H new ATOM 549 N LEU A 34 7.129 -7.226 -3.574 1.00 0.00 N ATOM 550 CA LEU A 34 6.321 -7.721 -2.413 1.00 0.00 C ATOM 551 C LEU A 34 5.199 -8.666 -2.903 1.00 0.00 C ATOM 552 O LEU A 34 5.053 -9.755 -2.392 1.00 0.00 O ATOM 553 CB LEU A 34 5.775 -6.419 -1.781 1.00 0.00 C ATOM 554 CG LEU A 34 5.016 -6.679 -0.474 1.00 0.00 C ATOM 555 CD1 LEU A 34 5.976 -7.008 0.649 1.00 0.00 C ATOM 556 CD2 LEU A 34 4.244 -5.423 -0.081 1.00 0.00 C ATOM 0 H LEU A 34 6.893 -6.280 -3.875 1.00 0.00 H new ATOM 0 HA LEU A 34 6.889 -8.312 -1.694 1.00 0.00 H new ATOM 0 HB2 LEU A 34 6.603 -5.737 -1.588 1.00 0.00 H new ATOM 0 HB3 LEU A 34 5.112 -5.924 -2.491 1.00 0.00 H new ATOM 0 HG LEU A 34 4.341 -7.519 -0.634 1.00 0.00 H new ATOM 0 HD11 LEU A 34 5.415 -7.189 1.566 1.00 0.00 H new ATOM 0 HD12 LEU A 34 6.546 -7.900 0.391 1.00 0.00 H new ATOM 0 HD13 LEU A 34 6.659 -6.172 0.800 1.00 0.00 H new ATOM 0 HD21 LEU A 34 3.703 -5.604 0.848 1.00 0.00 H new ATOM 0 HD22 LEU A 34 4.941 -4.597 0.060 1.00 0.00 H new ATOM 0 HD23 LEU A 34 3.536 -5.170 -0.870 1.00 0.00 H new ATOM 568 N LYS A 35 4.426 -8.268 -3.904 1.00 0.00 N ATOM 569 CA LYS A 35 3.320 -9.154 -4.433 1.00 0.00 C ATOM 570 C LYS A 35 3.911 -10.448 -5.030 1.00 0.00 C ATOM 571 O LYS A 35 3.285 -11.493 -4.971 1.00 0.00 O ATOM 572 CB LYS A 35 2.548 -8.320 -5.494 1.00 0.00 C ATOM 573 CG LYS A 35 1.395 -7.565 -4.836 1.00 0.00 C ATOM 574 CD LYS A 35 0.113 -7.756 -5.654 1.00 0.00 C ATOM 575 CE LYS A 35 -1.104 -7.734 -4.714 1.00 0.00 C ATOM 576 NZ LYS A 35 -1.664 -9.118 -4.737 1.00 0.00 N ATOM 0 H LYS A 35 4.515 -7.368 -4.376 1.00 0.00 H new ATOM 0 HA LYS A 35 2.640 -9.466 -3.641 1.00 0.00 H new ATOM 0 HB2 LYS A 35 3.225 -7.615 -5.976 1.00 0.00 H new ATOM 0 HB3 LYS A 35 2.164 -8.977 -6.274 1.00 0.00 H new ATOM 0 HG2 LYS A 35 1.245 -7.927 -3.819 1.00 0.00 H new ATOM 0 HG3 LYS A 35 1.637 -6.505 -4.765 1.00 0.00 H new ATOM 0 HD2 LYS A 35 0.024 -6.966 -6.400 1.00 0.00 H new ATOM 0 HD3 LYS A 35 0.151 -8.702 -6.194 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -0.812 -7.448 -3.704 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -1.844 -7.008 -5.050 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -2.323 -9.239 -3.941 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -2.170 -9.273 -5.632 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -0.890 -9.807 -4.653 1.00 0.00 H new ATOM 590 N ASP A 36 5.117 -10.391 -5.577 1.00 0.00 N ATOM 591 CA ASP A 36 5.759 -11.624 -6.148 1.00 0.00 C ATOM 592 C ASP A 36 6.524 -12.419 -5.058 1.00 0.00 C ATOM 593 O ASP A 36 6.547 -13.636 -5.095 1.00 0.00 O ATOM 594 CB ASP A 36 6.724 -11.125 -7.246 1.00 0.00 C ATOM 595 CG ASP A 36 5.962 -10.461 -8.424 1.00 0.00 C ATOM 596 OD1 ASP A 36 4.780 -10.734 -8.608 1.00 0.00 O ATOM 597 OD2 ASP A 36 6.588 -9.692 -9.136 1.00 0.00 O ATOM 0 H ASP A 36 5.678 -9.542 -5.649 1.00 0.00 H new ATOM 0 HA ASP A 36 5.011 -12.307 -6.551 1.00 0.00 H new ATOM 0 HB2 ASP A 36 7.424 -10.409 -6.816 1.00 0.00 H new ATOM 0 HB3 ASP A 36 7.313 -11.962 -7.620 1.00 0.00 H new ATOM 602 N ASP A 37 7.149 -11.745 -4.092 1.00 0.00 N ATOM 603 CA ASP A 37 7.909 -12.476 -3.011 1.00 0.00 C ATOM 604 C ASP A 37 7.271 -12.235 -1.621 1.00 0.00 C ATOM 605 O ASP A 37 7.402 -11.157 -1.065 1.00 0.00 O ATOM 606 CB ASP A 37 9.341 -11.915 -3.049 1.00 0.00 C ATOM 607 CG ASP A 37 10.320 -12.943 -2.458 1.00 0.00 C ATOM 608 OD1 ASP A 37 10.181 -13.272 -1.287 1.00 0.00 O ATOM 609 OD2 ASP A 37 11.190 -13.385 -3.187 1.00 0.00 O ATOM 0 H ASP A 37 7.161 -10.728 -4.013 1.00 0.00 H new ATOM 0 HA ASP A 37 7.892 -13.553 -3.180 1.00 0.00 H new ATOM 0 HB2 ASP A 37 9.622 -11.680 -4.076 1.00 0.00 H new ATOM 0 HB3 ASP A 37 9.392 -10.984 -2.484 1.00 0.00 H new ATOM 614 N PRO A 38 6.598 -13.257 -1.104 1.00 0.00 N ATOM 615 CA PRO A 38 5.935 -13.157 0.234 1.00 0.00 C ATOM 616 C PRO A 38 6.941 -13.080 1.405 1.00 0.00 C ATOM 617 O PRO A 38 6.765 -12.286 2.314 1.00 0.00 O ATOM 618 CB PRO A 38 5.107 -14.442 0.312 1.00 0.00 C ATOM 619 CG PRO A 38 5.801 -15.402 -0.592 1.00 0.00 C ATOM 620 CD PRO A 38 6.379 -14.585 -1.709 1.00 0.00 C ATOM 0 HA PRO A 38 5.346 -12.244 0.325 1.00 0.00 H new ATOM 0 HB2 PRO A 38 5.063 -14.822 1.333 1.00 0.00 H new ATOM 0 HB3 PRO A 38 4.080 -14.270 -0.009 1.00 0.00 H new ATOM 0 HG2 PRO A 38 6.584 -15.941 -0.059 1.00 0.00 H new ATOM 0 HG3 PRO A 38 5.105 -16.148 -0.976 1.00 0.00 H new ATOM 0 HD2 PRO A 38 7.311 -15.015 -2.077 1.00 0.00 H new ATOM 0 HD3 PRO A 38 5.697 -14.530 -2.557 1.00 0.00 H new ATOM 628 N SER A 39 7.970 -13.909 1.400 1.00 0.00 N ATOM 629 CA SER A 39 8.981 -13.913 2.527 1.00 0.00 C ATOM 630 C SER A 39 9.799 -12.611 2.597 1.00 0.00 C ATOM 631 O SER A 39 10.194 -12.199 3.677 1.00 0.00 O ATOM 632 CB SER A 39 9.903 -15.105 2.253 1.00 0.00 C ATOM 633 OG SER A 39 9.153 -16.314 2.330 1.00 0.00 O ATOM 0 H SER A 39 8.155 -14.587 0.661 1.00 0.00 H new ATOM 0 HA SER A 39 8.471 -13.990 3.488 1.00 0.00 H new ATOM 0 HB2 SER A 39 10.357 -15.008 1.267 1.00 0.00 H new ATOM 0 HB3 SER A 39 10.717 -15.123 2.978 1.00 0.00 H new ATOM 0 HG SER A 39 9.743 -17.077 2.153 1.00 0.00 H new ATOM 639 N GLN A 40 10.059 -11.962 1.476 1.00 0.00 N ATOM 640 CA GLN A 40 10.861 -10.690 1.505 1.00 0.00 C ATOM 641 C GLN A 40 10.005 -9.479 1.935 1.00 0.00 C ATOM 642 O GLN A 40 10.503 -8.379 1.953 1.00 0.00 O ATOM 643 CB GLN A 40 11.362 -10.479 0.066 1.00 0.00 C ATOM 644 CG GLN A 40 12.689 -9.714 0.086 1.00 0.00 C ATOM 645 CD GLN A 40 13.005 -9.182 -1.316 1.00 0.00 C ATOM 646 OE1 GLN A 40 13.080 -9.938 -2.266 1.00 0.00 O ATOM 647 NE2 GLN A 40 13.204 -7.902 -1.488 1.00 0.00 N ATOM 0 H GLN A 40 9.752 -12.258 0.550 1.00 0.00 H new ATOM 0 HA GLN A 40 11.674 -10.771 2.227 1.00 0.00 H new ATOM 0 HB2 GLN A 40 11.494 -11.442 -0.428 1.00 0.00 H new ATOM 0 HB3 GLN A 40 10.621 -9.925 -0.509 1.00 0.00 H new ATOM 0 HG2 GLN A 40 12.632 -8.887 0.794 1.00 0.00 H new ATOM 0 HG3 GLN A 40 13.491 -10.369 0.425 1.00 0.00 H new ATOM 0 HE21 GLN A 40 13.142 -7.265 -0.694 1.00 0.00 H new ATOM 0 HE22 GLN A 40 13.421 -7.540 -2.416 1.00 0.00 H new ATOM 656 N SER A 41 8.728 -9.656 2.247 1.00 0.00 N ATOM 657 CA SER A 41 7.858 -8.482 2.622 1.00 0.00 C ATOM 658 C SER A 41 8.433 -7.640 3.768 1.00 0.00 C ATOM 659 O SER A 41 8.517 -6.434 3.630 1.00 0.00 O ATOM 660 CB SER A 41 6.498 -9.071 3.016 1.00 0.00 C ATOM 661 OG SER A 41 6.641 -9.932 4.145 1.00 0.00 O ATOM 0 H SER A 41 8.256 -10.560 2.257 1.00 0.00 H new ATOM 0 HA SER A 41 7.786 -7.796 1.778 1.00 0.00 H new ATOM 0 HB2 SER A 41 5.799 -8.267 3.249 1.00 0.00 H new ATOM 0 HB3 SER A 41 6.077 -9.626 2.177 1.00 0.00 H new ATOM 0 HG SER A 41 6.711 -10.861 3.841 1.00 0.00 H new ATOM 667 N ALA A 42 8.842 -8.227 4.880 1.00 0.00 N ATOM 668 CA ALA A 42 9.428 -7.373 5.975 1.00 0.00 C ATOM 669 C ALA A 42 10.680 -6.667 5.449 1.00 0.00 C ATOM 670 O ALA A 42 10.833 -5.478 5.622 1.00 0.00 O ATOM 671 CB ALA A 42 9.837 -8.307 7.079 1.00 0.00 C ATOM 0 H ALA A 42 8.798 -9.228 5.072 1.00 0.00 H new ATOM 0 HA ALA A 42 8.710 -6.629 6.319 1.00 0.00 H new ATOM 0 HB1 ALA A 42 10.269 -7.734 7.899 1.00 0.00 H new ATOM 0 HB2 ALA A 42 8.963 -8.851 7.438 1.00 0.00 H new ATOM 0 HB3 ALA A 42 10.576 -9.014 6.702 1.00 0.00 H new ATOM 677 N ASN A 43 11.546 -7.405 4.763 1.00 0.00 N ATOM 678 CA ASN A 43 12.772 -6.791 4.152 1.00 0.00 C ATOM 679 C ASN A 43 12.349 -5.686 3.202 1.00 0.00 C ATOM 680 O ASN A 43 13.004 -4.685 3.099 1.00 0.00 O ATOM 681 CB ASN A 43 13.437 -7.882 3.324 1.00 0.00 C ATOM 682 CG ASN A 43 14.737 -8.347 3.992 1.00 0.00 C ATOM 683 OD1 ASN A 43 15.778 -8.360 3.368 1.00 0.00 O ATOM 684 ND2 ASN A 43 14.724 -8.733 5.243 1.00 0.00 N ATOM 0 H ASN A 43 11.447 -8.408 4.605 1.00 0.00 H new ATOM 0 HA ASN A 43 13.435 -6.391 4.920 1.00 0.00 H new ATOM 0 HB2 ASN A 43 12.757 -8.726 3.211 1.00 0.00 H new ATOM 0 HB3 ASN A 43 13.650 -7.508 2.322 1.00 0.00 H new ATOM 0 HD21 ASN A 43 15.587 -9.043 5.690 1.00 0.00 H new ATOM 0 HD22 ASN A 43 13.851 -8.723 5.771 1.00 0.00 H new ATOM 691 N LEU A 44 11.239 -5.887 2.512 1.00 0.00 N ATOM 692 CA LEU A 44 10.721 -4.865 1.564 1.00 0.00 C ATOM 693 C LEU A 44 10.291 -3.645 2.316 1.00 0.00 C ATOM 694 O LEU A 44 10.623 -2.551 1.924 1.00 0.00 O ATOM 695 CB LEU A 44 9.558 -5.503 0.841 1.00 0.00 C ATOM 696 CG LEU A 44 10.138 -6.397 -0.223 1.00 0.00 C ATOM 697 CD1 LEU A 44 9.020 -7.197 -0.851 1.00 0.00 C ATOM 698 CD2 LEU A 44 10.843 -5.514 -1.249 1.00 0.00 C ATOM 0 H LEU A 44 10.671 -6.732 2.576 1.00 0.00 H new ATOM 0 HA LEU A 44 11.484 -4.549 0.852 1.00 0.00 H new ATOM 0 HB2 LEU A 44 8.942 -6.077 1.533 1.00 0.00 H new ATOM 0 HB3 LEU A 44 8.915 -4.742 0.397 1.00 0.00 H new ATOM 0 HG LEU A 44 10.861 -7.098 0.193 1.00 0.00 H new ATOM 0 HD11 LEU A 44 9.428 -7.849 -1.624 1.00 0.00 H new ATOM 0 HD12 LEU A 44 8.532 -7.802 -0.087 1.00 0.00 H new ATOM 0 HD13 LEU A 44 8.292 -6.518 -1.296 1.00 0.00 H new ATOM 0 HD21 LEU A 44 11.273 -6.138 -2.032 1.00 0.00 H new ATOM 0 HD22 LEU A 44 10.124 -4.823 -1.689 1.00 0.00 H new ATOM 0 HD23 LEU A 44 11.636 -4.949 -0.759 1.00 0.00 H new ATOM 710 N LEU A 45 9.613 -3.807 3.424 1.00 0.00 N ATOM 711 CA LEU A 45 9.272 -2.596 4.204 1.00 0.00 C ATOM 712 C LEU A 45 10.576 -2.022 4.768 1.00 0.00 C ATOM 713 O LEU A 45 10.787 -0.846 4.708 1.00 0.00 O ATOM 714 CB LEU A 45 8.324 -3.020 5.302 1.00 0.00 C ATOM 715 CG LEU A 45 8.184 -1.888 6.320 1.00 0.00 C ATOM 716 CD1 LEU A 45 7.891 -0.550 5.603 1.00 0.00 C ATOM 717 CD2 LEU A 45 7.057 -2.240 7.276 1.00 0.00 C ATOM 0 H LEU A 45 9.293 -4.697 3.807 1.00 0.00 H new ATOM 0 HA LEU A 45 8.790 -1.827 3.601 1.00 0.00 H new ATOM 0 HB2 LEU A 45 7.350 -3.267 4.880 1.00 0.00 H new ATOM 0 HB3 LEU A 45 8.697 -3.920 5.792 1.00 0.00 H new ATOM 0 HG LEU A 45 9.115 -1.770 6.875 1.00 0.00 H new ATOM 0 HD11 LEU A 45 7.794 0.245 6.342 1.00 0.00 H new ATOM 0 HD12 LEU A 45 8.709 -0.315 4.922 1.00 0.00 H new ATOM 0 HD13 LEU A 45 6.963 -0.635 5.038 1.00 0.00 H new ATOM 0 HD21 LEU A 45 6.941 -1.443 8.011 1.00 0.00 H new ATOM 0 HD22 LEU A 45 6.128 -2.356 6.717 1.00 0.00 H new ATOM 0 HD23 LEU A 45 7.292 -3.174 7.787 1.00 0.00 H new ATOM 729 N ALA A 46 11.458 -2.860 5.276 1.00 0.00 N ATOM 730 CA ALA A 46 12.781 -2.357 5.797 1.00 0.00 C ATOM 731 C ALA A 46 13.526 -1.598 4.703 1.00 0.00 C ATOM 732 O ALA A 46 14.019 -0.526 4.948 1.00 0.00 O ATOM 733 CB ALA A 46 13.590 -3.597 6.122 1.00 0.00 C ATOM 0 H ALA A 46 11.321 -3.868 5.353 1.00 0.00 H new ATOM 0 HA ALA A 46 12.635 -1.697 6.652 1.00 0.00 H new ATOM 0 HB1 ALA A 46 14.567 -3.304 6.507 1.00 0.00 H new ATOM 0 HB2 ALA A 46 13.066 -4.187 6.874 1.00 0.00 H new ATOM 0 HB3 ALA A 46 13.720 -4.194 5.219 1.00 0.00 H new ATOM 739 N GLU A 47 13.591 -2.144 3.497 1.00 0.00 N ATOM 740 CA GLU A 47 14.280 -1.427 2.384 1.00 0.00 C ATOM 741 C GLU A 47 13.440 -0.203 2.005 1.00 0.00 C ATOM 742 O GLU A 47 13.984 0.824 1.680 1.00 0.00 O ATOM 743 CB GLU A 47 14.483 -2.407 1.216 1.00 0.00 C ATOM 744 CG GLU A 47 13.180 -2.908 0.661 1.00 0.00 C ATOM 745 CD GLU A 47 13.459 -3.913 -0.455 1.00 0.00 C ATOM 746 OE1 GLU A 47 13.832 -5.034 -0.137 1.00 0.00 O ATOM 747 OE2 GLU A 47 13.300 -3.549 -1.609 1.00 0.00 O ATOM 0 H GLU A 47 13.195 -3.051 3.248 1.00 0.00 H new ATOM 0 HA GLU A 47 15.267 -1.069 2.677 1.00 0.00 H new ATOM 0 HB2 GLU A 47 15.047 -1.914 0.424 1.00 0.00 H new ATOM 0 HB3 GLU A 47 15.081 -3.253 1.554 1.00 0.00 H new ATOM 0 HG2 GLU A 47 12.592 -3.377 1.450 1.00 0.00 H new ATOM 0 HG3 GLU A 47 12.591 -2.075 0.277 1.00 0.00 H new ATOM 754 N ALA A 48 12.115 -0.289 2.087 1.00 0.00 N ATOM 755 CA ALA A 48 11.268 0.905 1.797 1.00 0.00 C ATOM 756 C ALA A 48 11.535 1.963 2.879 1.00 0.00 C ATOM 757 O ALA A 48 11.660 3.137 2.594 1.00 0.00 O ATOM 758 CB ALA A 48 9.834 0.387 1.893 1.00 0.00 C ATOM 0 H ALA A 48 11.602 -1.133 2.341 1.00 0.00 H new ATOM 0 HA ALA A 48 11.467 1.360 0.827 1.00 0.00 H new ATOM 0 HB1 ALA A 48 9.139 1.202 1.693 1.00 0.00 H new ATOM 0 HB2 ALA A 48 9.684 -0.406 1.160 1.00 0.00 H new ATOM 0 HB3 ALA A 48 9.655 -0.005 2.894 1.00 0.00 H new ATOM 764 N LYS A 49 11.676 1.517 4.117 1.00 0.00 N ATOM 765 CA LYS A 49 11.991 2.426 5.255 1.00 0.00 C ATOM 766 C LYS A 49 13.432 2.918 5.086 1.00 0.00 C ATOM 767 O LYS A 49 13.746 4.071 5.307 1.00 0.00 O ATOM 768 CB LYS A 49 11.796 1.537 6.480 1.00 0.00 C ATOM 769 CG LYS A 49 10.314 1.593 6.845 1.00 0.00 C ATOM 770 CD LYS A 49 9.941 0.370 7.655 1.00 0.00 C ATOM 771 CE LYS A 49 10.364 0.592 9.098 1.00 0.00 C ATOM 772 NZ LYS A 49 9.746 -0.525 9.876 1.00 0.00 N ATOM 0 H LYS A 49 11.581 0.536 4.380 1.00 0.00 H new ATOM 0 HA LYS A 49 11.373 3.321 5.328 1.00 0.00 H new ATOM 0 HB2 LYS A 49 12.101 0.513 6.265 1.00 0.00 H new ATOM 0 HB3 LYS A 49 12.410 1.885 7.310 1.00 0.00 H new ATOM 0 HG2 LYS A 49 10.104 2.497 7.416 1.00 0.00 H new ATOM 0 HG3 LYS A 49 9.708 1.640 5.940 1.00 0.00 H new ATOM 0 HD2 LYS A 49 8.867 0.193 7.599 1.00 0.00 H new ATOM 0 HD3 LYS A 49 10.431 -0.515 7.250 1.00 0.00 H new ATOM 0 HE2 LYS A 49 11.450 0.582 9.194 1.00 0.00 H new ATOM 0 HE3 LYS A 49 10.020 1.560 9.462 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 9.999 -0.430 10.880 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 8.712 -0.488 9.775 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 10.096 -1.435 9.515 1.00 0.00 H new ATOM 786 N LYS A 50 14.273 2.032 4.599 1.00 0.00 N ATOM 787 CA LYS A 50 15.692 2.360 4.273 1.00 0.00 C ATOM 788 C LYS A 50 15.675 3.426 3.157 1.00 0.00 C ATOM 789 O LYS A 50 16.438 4.374 3.186 1.00 0.00 O ATOM 790 CB LYS A 50 16.253 1.003 3.801 1.00 0.00 C ATOM 791 CG LYS A 50 17.510 1.139 2.936 1.00 0.00 C ATOM 792 CD LYS A 50 17.574 -0.067 1.983 1.00 0.00 C ATOM 793 CE LYS A 50 17.977 -1.330 2.764 1.00 0.00 C ATOM 794 NZ LYS A 50 18.134 -2.402 1.736 1.00 0.00 N ATOM 0 H LYS A 50 14.019 1.062 4.410 1.00 0.00 H new ATOM 0 HA LYS A 50 16.292 2.770 5.086 1.00 0.00 H new ATOM 0 HB2 LYS A 50 16.483 0.389 4.672 1.00 0.00 H new ATOM 0 HB3 LYS A 50 15.485 0.477 3.234 1.00 0.00 H new ATOM 0 HG2 LYS A 50 17.482 2.070 2.369 1.00 0.00 H new ATOM 0 HG3 LYS A 50 18.401 1.175 3.563 1.00 0.00 H new ATOM 0 HD2 LYS A 50 16.605 -0.217 1.507 1.00 0.00 H new ATOM 0 HD3 LYS A 50 18.294 0.125 1.188 1.00 0.00 H new ATOM 0 HE2 LYS A 50 18.906 -1.173 3.312 1.00 0.00 H new ATOM 0 HE3 LYS A 50 17.216 -1.598 3.497 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 18.408 -3.291 2.201 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 17.233 -2.537 1.235 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 18.870 -2.125 1.056 1.00 0.00 H new ATOM 808 N LEU A 51 14.752 3.286 2.209 1.00 0.00 N ATOM 809 CA LEU A 51 14.598 4.294 1.108 1.00 0.00 C ATOM 810 C LEU A 51 14.036 5.591 1.696 1.00 0.00 C ATOM 811 O LEU A 51 14.397 6.667 1.283 1.00 0.00 O ATOM 812 CB LEU A 51 13.567 3.699 0.136 1.00 0.00 C ATOM 813 CG LEU A 51 14.229 3.087 -1.106 1.00 0.00 C ATOM 814 CD1 LEU A 51 15.528 2.359 -0.749 1.00 0.00 C ATOM 815 CD2 LEU A 51 13.258 2.095 -1.719 1.00 0.00 C ATOM 0 H LEU A 51 14.098 2.505 2.161 1.00 0.00 H new ATOM 0 HA LEU A 51 15.547 4.509 0.616 1.00 0.00 H new ATOM 0 HB2 LEU A 51 12.985 2.934 0.650 1.00 0.00 H new ATOM 0 HB3 LEU A 51 12.869 4.477 -0.172 1.00 0.00 H new ATOM 0 HG LEU A 51 14.473 3.887 -1.805 1.00 0.00 H new ATOM 0 HD11 LEU A 51 15.969 1.938 -1.652 1.00 0.00 H new ATOM 0 HD12 LEU A 51 16.227 3.063 -0.297 1.00 0.00 H new ATOM 0 HD13 LEU A 51 15.313 1.557 -0.043 1.00 0.00 H new ATOM 0 HD21 LEU A 51 13.707 1.646 -2.605 1.00 0.00 H new ATOM 0 HD22 LEU A 51 13.029 1.315 -0.993 1.00 0.00 H new ATOM 0 HD23 LEU A 51 12.340 2.611 -2.000 1.00 0.00 H new ATOM 827 N ASN A 52 13.149 5.472 2.667 1.00 0.00 N ATOM 828 CA ASN A 52 12.544 6.675 3.319 1.00 0.00 C ATOM 829 C ASN A 52 13.667 7.558 3.905 1.00 0.00 C ATOM 830 O ASN A 52 13.665 8.756 3.725 1.00 0.00 O ATOM 831 CB ASN A 52 11.574 6.113 4.398 1.00 0.00 C ATOM 832 CG ASN A 52 11.762 6.791 5.769 1.00 0.00 C ATOM 833 OD1 ASN A 52 11.520 7.971 5.919 1.00 0.00 O ATOM 834 ND2 ASN A 52 12.180 6.085 6.784 1.00 0.00 N ATOM 0 H ASN A 52 12.819 4.579 3.035 1.00 0.00 H new ATOM 0 HA ASN A 52 11.995 7.317 2.630 1.00 0.00 H new ATOM 0 HB2 ASN A 52 10.545 6.252 4.065 1.00 0.00 H new ATOM 0 HB3 ASN A 52 11.733 5.040 4.502 1.00 0.00 H new ATOM 0 HD21 ASN A 52 12.301 6.525 7.696 1.00 0.00 H new ATOM 0 HD22 ASN A 52 12.385 5.093 6.665 1.00 0.00 H new ATOM 841 N ASP A 53 14.634 6.961 4.575 1.00 0.00 N ATOM 842 CA ASP A 53 15.775 7.757 5.157 1.00 0.00 C ATOM 843 C ASP A 53 16.822 8.106 4.079 1.00 0.00 C ATOM 844 O ASP A 53 17.359 9.200 4.070 1.00 0.00 O ATOM 845 CB ASP A 53 16.410 6.871 6.238 1.00 0.00 C ATOM 846 CG ASP A 53 15.382 6.519 7.327 1.00 0.00 C ATOM 847 OD1 ASP A 53 14.843 7.432 7.935 1.00 0.00 O ATOM 848 OD2 ASP A 53 15.152 5.339 7.533 1.00 0.00 O ATOM 0 H ASP A 53 14.683 5.956 4.744 1.00 0.00 H new ATOM 0 HA ASP A 53 15.414 8.701 5.566 1.00 0.00 H new ATOM 0 HB2 ASP A 53 16.795 5.957 5.786 1.00 0.00 H new ATOM 0 HB3 ASP A 53 17.259 7.387 6.686 1.00 0.00 H new ATOM 853 N ALA A 54 17.114 7.181 3.177 1.00 0.00 N ATOM 854 CA ALA A 54 18.131 7.447 2.093 1.00 0.00 C ATOM 855 C ALA A 54 17.606 8.513 1.114 1.00 0.00 C ATOM 856 O ALA A 54 18.311 9.448 0.774 1.00 0.00 O ATOM 857 CB ALA A 54 18.325 6.104 1.376 1.00 0.00 C ATOM 0 H ALA A 54 16.690 6.254 3.147 1.00 0.00 H new ATOM 0 HA ALA A 54 19.069 7.826 2.500 1.00 0.00 H new ATOM 0 HB1 ALA A 54 19.053 6.222 0.573 1.00 0.00 H new ATOM 0 HB2 ALA A 54 18.686 5.361 2.087 1.00 0.00 H new ATOM 0 HB3 ALA A 54 17.374 5.774 0.958 1.00 0.00 H new ATOM 863 N GLN A 55 16.364 8.385 0.689 1.00 0.00 N ATOM 864 CA GLN A 55 15.751 9.394 -0.244 1.00 0.00 C ATOM 865 C GLN A 55 15.242 10.630 0.538 1.00 0.00 C ATOM 866 O GLN A 55 14.823 11.604 -0.064 1.00 0.00 O ATOM 867 CB GLN A 55 14.571 8.685 -0.921 1.00 0.00 C ATOM 868 CG GLN A 55 15.061 7.470 -1.728 1.00 0.00 C ATOM 869 CD GLN A 55 13.876 6.847 -2.464 1.00 0.00 C ATOM 870 OE1 GLN A 55 13.891 6.727 -3.672 1.00 0.00 O ATOM 871 NE2 GLN A 55 12.836 6.455 -1.780 1.00 0.00 N ATOM 0 H GLN A 55 15.745 7.618 0.951 1.00 0.00 H new ATOM 0 HA GLN A 55 16.483 9.749 -0.969 1.00 0.00 H new ATOM 0 HB2 GLN A 55 13.853 8.362 -0.167 1.00 0.00 H new ATOM 0 HB3 GLN A 55 14.051 9.381 -1.580 1.00 0.00 H new ATOM 0 HG2 GLN A 55 15.827 7.776 -2.440 1.00 0.00 H new ATOM 0 HG3 GLN A 55 15.518 6.737 -1.063 1.00 0.00 H new ATOM 0 HE21 GLN A 55 12.825 6.557 -0.765 1.00 0.00 H new ATOM 0 HE22 GLN A 55 12.034 6.047 -2.260 1.00 0.00 H new ATOM 880 N ALA A 56 15.264 10.595 1.870 1.00 0.00 N ATOM 881 CA ALA A 56 14.774 11.760 2.683 1.00 0.00 C ATOM 882 C ALA A 56 15.636 13.005 2.465 1.00 0.00 C ATOM 883 O ALA A 56 16.819 12.903 2.187 1.00 0.00 O ATOM 884 CB ALA A 56 14.870 11.345 4.154 1.00 0.00 C ATOM 0 H ALA A 56 15.602 9.804 2.418 1.00 0.00 H new ATOM 0 HA ALA A 56 13.755 12.009 2.387 1.00 0.00 H new ATOM 0 HB1 ALA A 56 14.523 12.163 4.786 1.00 0.00 H new ATOM 0 HB2 ALA A 56 14.249 10.466 4.325 1.00 0.00 H new ATOM 0 HB3 ALA A 56 15.906 11.111 4.399 1.00 0.00 H new ATOM 890 N PRO A 57 15.004 14.150 2.625 1.00 0.00 N ATOM 891 CA PRO A 57 15.714 15.445 2.470 1.00 0.00 C ATOM 892 C PRO A 57 16.719 15.683 3.620 1.00 0.00 C ATOM 893 O PRO A 57 17.743 16.313 3.422 1.00 0.00 O ATOM 894 CB PRO A 57 14.586 16.474 2.486 1.00 0.00 C ATOM 895 CG PRO A 57 13.474 15.818 3.239 1.00 0.00 C ATOM 896 CD PRO A 57 13.579 14.348 2.960 1.00 0.00 C ATOM 0 HA PRO A 57 16.314 15.492 1.561 1.00 0.00 H new ATOM 0 HB2 PRO A 57 14.901 17.397 2.972 1.00 0.00 H new ATOM 0 HB3 PRO A 57 14.277 16.736 1.474 1.00 0.00 H new ATOM 0 HG2 PRO A 57 13.559 16.017 4.307 1.00 0.00 H new ATOM 0 HG3 PRO A 57 12.507 16.206 2.918 1.00 0.00 H new ATOM 0 HD2 PRO A 57 13.286 13.755 3.827 1.00 0.00 H new ATOM 0 HD3 PRO A 57 12.930 14.050 2.136 1.00 0.00 H new ATOM 904 N LYS A 58 16.431 15.183 4.811 1.00 0.00 N ATOM 905 CA LYS A 58 17.361 15.369 5.975 1.00 0.00 C ATOM 906 C LYS A 58 17.527 14.044 6.747 1.00 0.00 C ATOM 907 O LYS A 58 16.523 13.396 7.023 1.00 0.00 O ATOM 908 CB LYS A 58 16.691 16.439 6.850 1.00 0.00 C ATOM 909 CG LYS A 58 17.662 16.898 7.943 1.00 0.00 C ATOM 910 CD LYS A 58 16.973 17.931 8.842 1.00 0.00 C ATOM 911 CE LYS A 58 17.989 18.515 9.837 1.00 0.00 C ATOM 912 NZ LYS A 58 18.576 19.712 9.158 1.00 0.00 N ATOM 913 OXT LYS A 58 18.656 13.700 7.049 1.00 0.00 O ATOM 0 H LYS A 58 15.586 14.652 5.022 1.00 0.00 H new ATOM 0 HA LYS A 58 18.361 15.671 5.664 1.00 0.00 H new ATOM 0 HB2 LYS A 58 16.392 17.289 6.236 1.00 0.00 H new ATOM 0 HB3 LYS A 58 15.784 16.037 7.302 1.00 0.00 H new ATOM 0 HG2 LYS A 58 17.987 16.044 8.537 1.00 0.00 H new ATOM 0 HG3 LYS A 58 18.555 17.331 7.492 1.00 0.00 H new ATOM 0 HD2 LYS A 58 16.546 18.729 8.234 1.00 0.00 H new ATOM 0 HD3 LYS A 58 16.148 17.465 9.381 1.00 0.00 H new ATOM 0 HE2 LYS A 58 17.505 18.794 10.773 1.00 0.00 H new ATOM 0 HE3 LYS A 58 18.761 17.786 10.082 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 19.277 20.157 9.784 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 19.038 19.418 8.274 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 17.821 20.394 8.944 1.00 0.00 H new TER 927 LYS A 58 ATOM 928 N VAL B 1 -2.838 -9.614 -21.850 1.00 0.00 N ATOM 929 CA VAL B 1 -3.013 -9.026 -20.479 1.00 0.00 C ATOM 930 C VAL B 1 -2.130 -9.785 -19.466 1.00 0.00 C ATOM 931 O VAL B 1 -2.118 -11.006 -19.437 1.00 0.00 O ATOM 932 CB VAL B 1 -4.514 -9.186 -20.132 1.00 0.00 C ATOM 933 CG1 VAL B 1 -4.766 -8.794 -18.669 1.00 0.00 C ATOM 934 CG2 VAL B 1 -5.359 -8.282 -21.040 1.00 0.00 C ATOM 0 H1 VAL B 1 -3.113 -8.912 -22.566 1.00 0.00 H new ATOM 0 H2 VAL B 1 -1.842 -9.879 -21.990 1.00 0.00 H new ATOM 0 H3 VAL B 1 -3.438 -10.459 -21.945 1.00 0.00 H new ATOM 0 HA VAL B 1 -2.715 -7.978 -20.445 1.00 0.00 H new ATOM 0 HB VAL B 1 -4.794 -10.229 -20.283 1.00 0.00 H new ATOM 0 HG11 VAL B 1 -5.825 -8.911 -18.438 1.00 0.00 H new ATOM 0 HG12 VAL B 1 -4.179 -9.437 -18.014 1.00 0.00 H new ATOM 0 HG13 VAL B 1 -4.474 -7.755 -18.515 1.00 0.00 H new ATOM 0 HG21 VAL B 1 -6.414 -8.399 -20.791 1.00 0.00 H new ATOM 0 HG22 VAL B 1 -5.065 -7.243 -20.894 1.00 0.00 H new ATOM 0 HG23 VAL B 1 -5.199 -8.561 -22.081 1.00 0.00 H new ATOM 946 N ASP B 2 -1.404 -9.062 -18.637 1.00 0.00 N ATOM 947 CA ASP B 2 -0.519 -9.723 -17.612 1.00 0.00 C ATOM 948 C ASP B 2 -1.344 -10.147 -16.379 1.00 0.00 C ATOM 949 O ASP B 2 -2.486 -9.744 -16.216 1.00 0.00 O ATOM 950 CB ASP B 2 0.550 -8.671 -17.235 1.00 0.00 C ATOM 951 CG ASP B 2 -0.065 -7.519 -16.417 1.00 0.00 C ATOM 952 OD1 ASP B 2 -0.649 -6.634 -17.022 1.00 0.00 O ATOM 953 OD2 ASP B 2 0.065 -7.545 -15.204 1.00 0.00 O ATOM 0 H ASP B 2 -1.386 -8.042 -18.625 1.00 0.00 H new ATOM 0 HA ASP B 2 -0.056 -10.630 -18.002 1.00 0.00 H new ATOM 0 HB2 ASP B 2 1.344 -9.146 -16.659 1.00 0.00 H new ATOM 0 HB3 ASP B 2 1.008 -8.273 -18.141 1.00 0.00 H new ATOM 958 N ASN B 3 -0.764 -10.953 -15.510 1.00 0.00 N ATOM 959 CA ASN B 3 -1.497 -11.410 -14.281 1.00 0.00 C ATOM 960 C ASN B 3 -0.834 -10.835 -13.014 1.00 0.00 C ATOM 961 O ASN B 3 -0.628 -11.533 -12.033 1.00 0.00 O ATOM 962 CB ASN B 3 -1.420 -12.948 -14.312 1.00 0.00 C ATOM 963 CG ASN B 3 -2.247 -13.489 -15.487 1.00 0.00 C ATOM 964 OD1 ASN B 3 -1.701 -14.026 -16.430 1.00 0.00 O ATOM 965 ND2 ASN B 3 -3.550 -13.375 -15.472 1.00 0.00 N ATOM 0 H ASN B 3 0.186 -11.313 -15.602 1.00 0.00 H new ATOM 0 HA ASN B 3 -2.531 -11.067 -14.264 1.00 0.00 H new ATOM 0 HB2 ASN B 3 -0.382 -13.267 -14.409 1.00 0.00 H new ATOM 0 HB3 ASN B 3 -1.793 -13.358 -13.374 1.00 0.00 H new ATOM 0 HD21 ASN B 3 -4.103 -13.736 -16.250 1.00 0.00 H new ATOM 0 HD22 ASN B 3 -4.014 -12.925 -14.683 1.00 0.00 H new ATOM 972 N LYS B 4 -0.513 -9.557 -13.036 1.00 0.00 N ATOM 973 CA LYS B 4 0.126 -8.899 -11.848 1.00 0.00 C ATOM 974 C LYS B 4 -0.624 -7.614 -11.478 1.00 0.00 C ATOM 975 O LYS B 4 -0.716 -6.687 -12.268 1.00 0.00 O ATOM 976 CB LYS B 4 1.568 -8.572 -12.276 1.00 0.00 C ATOM 977 CG LYS B 4 2.383 -9.864 -12.416 1.00 0.00 C ATOM 978 CD LYS B 4 3.841 -9.515 -12.728 1.00 0.00 C ATOM 979 CE LYS B 4 4.648 -10.805 -12.947 1.00 0.00 C ATOM 980 NZ LYS B 4 5.278 -11.114 -11.627 1.00 0.00 N ATOM 0 H LYS B 4 -0.668 -8.940 -13.833 1.00 0.00 H new ATOM 0 HA LYS B 4 0.103 -9.547 -10.972 1.00 0.00 H new ATOM 0 HB2 LYS B 4 1.561 -8.033 -13.223 1.00 0.00 H new ATOM 0 HB3 LYS B 4 2.034 -7.917 -11.540 1.00 0.00 H new ATOM 0 HG2 LYS B 4 2.326 -10.445 -11.495 1.00 0.00 H new ATOM 0 HG3 LYS B 4 1.968 -10.484 -13.210 1.00 0.00 H new ATOM 0 HD2 LYS B 4 3.892 -8.887 -13.618 1.00 0.00 H new ATOM 0 HD3 LYS B 4 4.271 -8.941 -11.907 1.00 0.00 H new ATOM 0 HE2 LYS B 4 4.003 -11.620 -13.274 1.00 0.00 H new ATOM 0 HE3 LYS B 4 5.404 -10.668 -13.720 1.00 0.00 H new ATOM 0 HZ1 LYS B 4 5.349 -12.145 -11.509 1.00 0.00 H new ATOM 0 HZ2 LYS B 4 6.229 -10.695 -11.590 1.00 0.00 H new ATOM 0 HZ3 LYS B 4 4.695 -10.717 -10.863 1.00 0.00 H new ATOM 994 N PHE B 5 -1.140 -7.550 -10.269 1.00 0.00 N ATOM 995 CA PHE B 5 -1.871 -6.325 -9.805 1.00 0.00 C ATOM 996 C PHE B 5 -0.972 -5.424 -8.929 1.00 0.00 C ATOM 997 O PHE B 5 -1.441 -4.439 -8.387 1.00 0.00 O ATOM 998 CB PHE B 5 -3.055 -6.853 -8.989 1.00 0.00 C ATOM 999 CG PHE B 5 -4.309 -6.856 -9.836 1.00 0.00 C ATOM 1000 CD1 PHE B 5 -4.606 -7.956 -10.649 1.00 0.00 C ATOM 1001 CD2 PHE B 5 -5.176 -5.756 -9.804 1.00 0.00 C ATOM 1002 CE1 PHE B 5 -5.766 -7.955 -11.431 1.00 0.00 C ATOM 1003 CE2 PHE B 5 -6.335 -5.756 -10.585 1.00 0.00 C ATOM 1004 CZ PHE B 5 -6.631 -6.856 -11.398 1.00 0.00 C ATOM 0 H PHE B 5 -1.085 -8.300 -9.580 1.00 0.00 H new ATOM 0 HA PHE B 5 -2.187 -5.709 -10.647 1.00 0.00 H new ATOM 0 HB2 PHE B 5 -2.843 -7.862 -8.636 1.00 0.00 H new ATOM 0 HB3 PHE B 5 -3.204 -6.232 -8.106 1.00 0.00 H new ATOM 0 HD1 PHE B 5 -3.940 -8.806 -10.673 1.00 0.00 H new ATOM 0 HD2 PHE B 5 -4.949 -4.908 -9.176 1.00 0.00 H new ATOM 0 HE1 PHE B 5 -5.994 -8.803 -12.060 1.00 0.00 H new ATOM 0 HE2 PHE B 5 -7.002 -4.907 -10.561 1.00 0.00 H new ATOM 0 HZ PHE B 5 -7.528 -6.856 -12.000 1.00 0.00 H new ATOM 1014 N ASN B 6 0.310 -5.739 -8.794 1.00 0.00 N ATOM 1015 CA ASN B 6 1.239 -4.881 -7.958 1.00 0.00 C ATOM 1016 C ASN B 6 1.297 -3.450 -8.511 1.00 0.00 C ATOM 1017 O ASN B 6 1.311 -2.487 -7.762 1.00 0.00 O ATOM 1018 CB ASN B 6 2.648 -5.539 -7.957 1.00 0.00 C ATOM 1019 CG ASN B 6 3.001 -6.222 -9.300 1.00 0.00 C ATOM 1020 OD1 ASN B 6 2.822 -5.652 -10.360 1.00 0.00 O ATOM 1021 ND2 ASN B 6 3.500 -7.429 -9.291 1.00 0.00 N ATOM 0 H ASN B 6 0.751 -6.551 -9.226 1.00 0.00 H new ATOM 0 HA ASN B 6 0.867 -4.817 -6.935 1.00 0.00 H new ATOM 0 HB2 ASN B 6 3.397 -4.779 -7.735 1.00 0.00 H new ATOM 0 HB3 ASN B 6 2.697 -6.278 -7.157 1.00 0.00 H new ATOM 0 HD21 ASN B 6 3.738 -7.889 -10.170 1.00 0.00 H new ATOM 0 HD22 ASN B 6 3.652 -7.911 -8.405 1.00 0.00 H new ATOM 1028 N LYS B 7 1.279 -3.312 -9.809 1.00 0.00 N ATOM 1029 CA LYS B 7 1.281 -1.950 -10.449 1.00 0.00 C ATOM 1030 C LYS B 7 0.032 -1.183 -10.045 1.00 0.00 C ATOM 1031 O LYS B 7 0.073 0.010 -9.820 1.00 0.00 O ATOM 1032 CB LYS B 7 1.276 -2.211 -11.956 1.00 0.00 C ATOM 1033 CG LYS B 7 2.617 -2.816 -12.385 1.00 0.00 C ATOM 1034 CD LYS B 7 2.652 -2.975 -13.908 1.00 0.00 C ATOM 1035 CE LYS B 7 3.938 -3.708 -14.323 1.00 0.00 C ATOM 1036 NZ LYS B 7 4.998 -2.654 -14.402 1.00 0.00 N ATOM 0 H LYS B 7 1.263 -4.091 -10.468 1.00 0.00 H new ATOM 0 HA LYS B 7 2.141 -1.355 -10.142 1.00 0.00 H new ATOM 0 HB2 LYS B 7 0.462 -2.889 -12.214 1.00 0.00 H new ATOM 0 HB3 LYS B 7 1.098 -1.280 -12.495 1.00 0.00 H new ATOM 0 HG2 LYS B 7 3.436 -2.176 -12.058 1.00 0.00 H new ATOM 0 HG3 LYS B 7 2.759 -3.785 -11.906 1.00 0.00 H new ATOM 0 HD2 LYS B 7 1.779 -3.533 -14.245 1.00 0.00 H new ATOM 0 HD3 LYS B 7 2.609 -1.997 -14.387 1.00 0.00 H new ATOM 0 HE2 LYS B 7 4.203 -4.476 -13.596 1.00 0.00 H new ATOM 0 HE3 LYS B 7 3.811 -4.208 -15.283 1.00 0.00 H new ATOM 0 HZ1 LYS B 7 5.900 -3.089 -14.681 1.00 0.00 H new ATOM 0 HZ2 LYS B 7 4.726 -1.940 -15.107 1.00 0.00 H new ATOM 0 HZ3 LYS B 7 5.105 -2.199 -13.473 1.00 0.00 H new ATOM 1050 N GLU B 8 -1.069 -1.871 -9.929 1.00 0.00 N ATOM 1051 CA GLU B 8 -2.337 -1.216 -9.510 1.00 0.00 C ATOM 1052 C GLU B 8 -2.273 -0.798 -8.052 1.00 0.00 C ATOM 1053 O GLU B 8 -2.827 0.208 -7.700 1.00 0.00 O ATOM 1054 CB GLU B 8 -3.438 -2.252 -9.738 1.00 0.00 C ATOM 1055 CG GLU B 8 -3.904 -2.179 -11.186 1.00 0.00 C ATOM 1056 CD GLU B 8 -3.167 -3.229 -12.033 1.00 0.00 C ATOM 1057 OE1 GLU B 8 -3.662 -4.339 -12.132 1.00 0.00 O ATOM 1058 OE2 GLU B 8 -2.116 -2.905 -12.562 1.00 0.00 O ATOM 0 H GLU B 8 -1.144 -2.872 -10.109 1.00 0.00 H new ATOM 0 HA GLU B 8 -2.525 -0.307 -10.081 1.00 0.00 H new ATOM 0 HB2 GLU B 8 -3.065 -3.251 -9.514 1.00 0.00 H new ATOM 0 HB3 GLU B 8 -4.274 -2.065 -9.065 1.00 0.00 H new ATOM 0 HG2 GLU B 8 -4.980 -2.348 -11.239 1.00 0.00 H new ATOM 0 HG3 GLU B 8 -3.718 -1.182 -11.586 1.00 0.00 H new ATOM 1065 N LEU B 9 -1.582 -1.531 -7.212 1.00 0.00 N ATOM 1066 CA LEU B 9 -1.492 -1.110 -5.771 1.00 0.00 C ATOM 1067 C LEU B 9 -0.683 0.175 -5.639 1.00 0.00 C ATOM 1068 O LEU B 9 -0.872 0.917 -4.695 1.00 0.00 O ATOM 1069 CB LEU B 9 -0.804 -2.199 -4.951 1.00 0.00 C ATOM 1070 CG LEU B 9 -1.384 -3.593 -5.211 1.00 0.00 C ATOM 1071 CD1 LEU B 9 -0.425 -4.647 -4.630 1.00 0.00 C ATOM 1072 CD2 LEU B 9 -2.756 -3.691 -4.522 1.00 0.00 C ATOM 0 H LEU B 9 -1.084 -2.388 -7.452 1.00 0.00 H new ATOM 0 HA LEU B 9 -2.505 -0.945 -5.403 1.00 0.00 H new ATOM 0 HB2 LEU B 9 0.261 -2.204 -5.183 1.00 0.00 H new ATOM 0 HB3 LEU B 9 -0.898 -1.963 -3.891 1.00 0.00 H new ATOM 0 HG LEU B 9 -1.502 -3.766 -6.281 1.00 0.00 H new ATOM 0 HD11 LEU B 9 -0.828 -5.644 -4.809 1.00 0.00 H new ATOM 0 HD12 LEU B 9 0.549 -4.557 -5.111 1.00 0.00 H new ATOM 0 HD13 LEU B 9 -0.316 -4.487 -3.557 1.00 0.00 H new ATOM 0 HD21 LEU B 9 -3.182 -4.679 -4.698 1.00 0.00 H new ATOM 0 HD22 LEU B 9 -2.637 -3.533 -3.450 1.00 0.00 H new ATOM 0 HD23 LEU B 9 -3.423 -2.931 -4.929 1.00 0.00 H new ATOM 1084 N SER B 10 0.209 0.461 -6.569 1.00 0.00 N ATOM 1085 CA SER B 10 0.993 1.722 -6.462 1.00 0.00 C ATOM 1086 C SER B 10 0.030 2.919 -6.583 1.00 0.00 C ATOM 1087 O SER B 10 0.088 3.852 -5.806 1.00 0.00 O ATOM 1088 CB SER B 10 1.999 1.682 -7.616 1.00 0.00 C ATOM 1089 OG SER B 10 1.393 2.058 -8.844 1.00 0.00 O ATOM 0 H SER B 10 0.419 -0.120 -7.381 1.00 0.00 H new ATOM 0 HA SER B 10 1.514 1.824 -5.510 1.00 0.00 H new ATOM 0 HB2 SER B 10 2.831 2.352 -7.399 1.00 0.00 H new ATOM 0 HB3 SER B 10 2.413 0.678 -7.705 1.00 0.00 H new ATOM 0 HG SER B 10 1.224 1.258 -9.384 1.00 0.00 H new ATOM 1095 N VAL B 11 -0.875 2.858 -7.546 1.00 0.00 N ATOM 1096 CA VAL B 11 -1.866 3.966 -7.756 1.00 0.00 C ATOM 1097 C VAL B 11 -3.115 3.726 -6.893 1.00 0.00 C ATOM 1098 O VAL B 11 -3.521 4.588 -6.135 1.00 0.00 O ATOM 1099 CB VAL B 11 -2.204 3.917 -9.260 1.00 0.00 C ATOM 1100 CG1 VAL B 11 -3.004 5.163 -9.649 1.00 0.00 C ATOM 1101 CG2 VAL B 11 -0.907 3.854 -10.089 1.00 0.00 C ATOM 0 H VAL B 11 -0.965 2.079 -8.198 1.00 0.00 H new ATOM 0 HA VAL B 11 -1.474 4.941 -7.468 1.00 0.00 H new ATOM 0 HB VAL B 11 -2.800 3.027 -9.462 1.00 0.00 H new ATOM 0 HG11 VAL B 11 -3.241 5.126 -10.712 1.00 0.00 H new ATOM 0 HG12 VAL B 11 -3.928 5.197 -9.072 1.00 0.00 H new ATOM 0 HG13 VAL B 11 -2.413 6.055 -9.440 1.00 0.00 H new ATOM 0 HG21 VAL B 11 -1.155 3.820 -11.150 1.00 0.00 H new ATOM 0 HG22 VAL B 11 -0.302 4.738 -9.886 1.00 0.00 H new ATOM 0 HG23 VAL B 11 -0.345 2.960 -9.818 1.00 0.00 H new ATOM 1111 N ALA B 12 -3.708 2.550 -6.999 1.00 0.00 N ATOM 1112 CA ALA B 12 -4.928 2.210 -6.187 1.00 0.00 C ATOM 1113 C ALA B 12 -4.606 2.265 -4.695 1.00 0.00 C ATOM 1114 O ALA B 12 -5.310 2.884 -3.926 1.00 0.00 O ATOM 1115 CB ALA B 12 -5.328 0.773 -6.598 1.00 0.00 C ATOM 0 H ALA B 12 -3.393 1.806 -7.621 1.00 0.00 H new ATOM 0 HA ALA B 12 -5.737 2.917 -6.369 1.00 0.00 H new ATOM 0 HB1 ALA B 12 -6.213 0.468 -6.039 1.00 0.00 H new ATOM 0 HB2 ALA B 12 -5.546 0.747 -7.666 1.00 0.00 H new ATOM 0 HB3 ALA B 12 -4.507 0.090 -6.379 1.00 0.00 H new ATOM 1121 N GLY B 13 -3.529 1.636 -4.306 1.00 0.00 N ATOM 1122 CA GLY B 13 -3.103 1.607 -2.879 1.00 0.00 C ATOM 1123 C GLY B 13 -2.738 2.998 -2.383 1.00 0.00 C ATOM 1124 O GLY B 13 -3.264 3.442 -1.382 1.00 0.00 O ATOM 0 H GLY B 13 -2.911 1.127 -4.938 1.00 0.00 H new ATOM 0 HA2 GLY B 13 -3.906 1.199 -2.266 1.00 0.00 H new ATOM 0 HA3 GLY B 13 -2.247 0.942 -2.766 1.00 0.00 H new ATOM 1128 N ARG B 14 -1.815 3.666 -3.045 1.00 0.00 N ATOM 1129 CA ARG B 14 -1.386 5.020 -2.561 1.00 0.00 C ATOM 1130 C ARG B 14 -2.567 6.017 -2.494 1.00 0.00 C ATOM 1131 O ARG B 14 -2.655 6.781 -1.551 1.00 0.00 O ATOM 1132 CB ARG B 14 -0.311 5.513 -3.524 1.00 0.00 C ATOM 1133 CG ARG B 14 0.252 6.828 -2.992 1.00 0.00 C ATOM 1134 CD ARG B 14 1.453 6.571 -2.080 1.00 0.00 C ATOM 1135 NE ARG B 14 1.119 7.280 -0.816 1.00 0.00 N ATOM 1136 CZ ARG B 14 1.745 8.382 -0.484 1.00 0.00 C ATOM 1137 NH1 ARG B 14 2.698 8.344 0.418 1.00 0.00 N ATOM 1138 NH2 ARG B 14 1.418 9.517 -1.051 1.00 0.00 N ATOM 0 H ARG B 14 -1.347 3.336 -3.889 1.00 0.00 H new ATOM 0 HA ARG B 14 -1.001 4.947 -1.544 1.00 0.00 H new ATOM 0 HB2 ARG B 14 0.483 4.772 -3.617 1.00 0.00 H new ATOM 0 HB3 ARG B 14 -0.731 5.656 -4.519 1.00 0.00 H new ATOM 0 HG2 ARG B 14 0.551 7.465 -3.825 1.00 0.00 H new ATOM 0 HG3 ARG B 14 -0.521 7.364 -2.442 1.00 0.00 H new ATOM 0 HD2 ARG B 14 1.601 5.505 -1.910 1.00 0.00 H new ATOM 0 HD3 ARG B 14 2.374 6.955 -2.519 1.00 0.00 H new ATOM 0 HE ARG B 14 0.396 6.905 -0.202 1.00 0.00 H new ATOM 0 HH11 ARG B 14 2.949 7.459 0.858 1.00 0.00 H new ATOM 0 HH12 ARG B 14 3.188 9.200 0.679 1.00 0.00 H new ATOM 0 HH21 ARG B 14 0.676 9.542 -1.751 1.00 0.00 H new ATOM 0 HH22 ARG B 14 1.905 10.375 -0.793 1.00 0.00 H new ATOM 1152 N GLU B 15 -3.487 6.007 -3.452 1.00 0.00 N ATOM 1153 CA GLU B 15 -4.671 6.951 -3.369 1.00 0.00 C ATOM 1154 C GLU B 15 -5.480 6.611 -2.104 1.00 0.00 C ATOM 1155 O GLU B 15 -5.867 7.482 -1.348 1.00 0.00 O ATOM 1156 CB GLU B 15 -5.509 6.707 -4.631 1.00 0.00 C ATOM 1157 CG GLU B 15 -4.853 7.378 -5.850 1.00 0.00 C ATOM 1158 CD GLU B 15 -4.818 8.904 -5.663 1.00 0.00 C ATOM 1159 OE1 GLU B 15 -5.882 9.497 -5.544 1.00 0.00 O ATOM 1160 OE2 GLU B 15 -3.729 9.452 -5.655 1.00 0.00 O ATOM 0 H GLU B 15 -3.471 5.399 -4.271 1.00 0.00 H new ATOM 0 HA GLU B 15 -4.368 7.996 -3.311 1.00 0.00 H new ATOM 0 HB2 GLU B 15 -5.608 5.636 -4.807 1.00 0.00 H new ATOM 0 HB3 GLU B 15 -6.515 7.101 -4.489 1.00 0.00 H new ATOM 0 HG2 GLU B 15 -3.840 6.997 -5.982 1.00 0.00 H new ATOM 0 HG3 GLU B 15 -5.408 7.128 -6.754 1.00 0.00 H new ATOM 1167 N ILE B 16 -5.658 5.328 -1.854 1.00 0.00 N ATOM 1168 CA ILE B 16 -6.356 4.831 -0.622 1.00 0.00 C ATOM 1169 C ILE B 16 -5.513 5.187 0.637 1.00 0.00 C ATOM 1170 O ILE B 16 -6.044 5.334 1.721 1.00 0.00 O ATOM 1171 CB ILE B 16 -6.477 3.303 -0.863 1.00 0.00 C ATOM 1172 CG1 ILE B 16 -7.565 3.063 -1.919 1.00 0.00 C ATOM 1173 CG2 ILE B 16 -6.851 2.569 0.418 1.00 0.00 C ATOM 1174 CD1 ILE B 16 -7.395 1.694 -2.577 1.00 0.00 C ATOM 0 H ILE B 16 -5.337 4.585 -2.475 1.00 0.00 H new ATOM 0 HA ILE B 16 -7.334 5.278 -0.446 1.00 0.00 H new ATOM 0 HB ILE B 16 -5.514 2.922 -1.202 1.00 0.00 H new ATOM 0 HG12 ILE B 16 -8.549 3.128 -1.454 1.00 0.00 H new ATOM 0 HG13 ILE B 16 -7.519 3.844 -2.678 1.00 0.00 H new ATOM 0 HG21 ILE B 16 -6.928 1.501 0.216 1.00 0.00 H new ATOM 0 HG22 ILE B 16 -6.084 2.741 1.173 1.00 0.00 H new ATOM 0 HG23 ILE B 16 -7.809 2.939 0.783 1.00 0.00 H new ATOM 0 HD11 ILE B 16 -8.178 1.548 -3.321 1.00 0.00 H new ATOM 0 HD12 ILE B 16 -6.420 1.642 -3.061 1.00 0.00 H new ATOM 0 HD13 ILE B 16 -7.466 0.914 -1.818 1.00 0.00 H new ATOM 1186 N VAL B 17 -4.207 5.339 0.476 1.00 0.00 N ATOM 1187 CA VAL B 17 -3.293 5.713 1.614 1.00 0.00 C ATOM 1188 C VAL B 17 -3.362 7.224 1.921 1.00 0.00 C ATOM 1189 O VAL B 17 -3.236 7.620 3.067 1.00 0.00 O ATOM 1190 CB VAL B 17 -1.864 5.364 1.117 1.00 0.00 C ATOM 1191 CG1 VAL B 17 -0.786 6.090 1.934 1.00 0.00 C ATOM 1192 CG2 VAL B 17 -1.625 3.871 1.217 1.00 0.00 C ATOM 0 H VAL B 17 -3.730 5.216 -0.417 1.00 0.00 H new ATOM 0 HA VAL B 17 -3.573 5.186 2.526 1.00 0.00 H new ATOM 0 HB VAL B 17 -1.796 5.689 0.079 1.00 0.00 H new ATOM 0 HG11 VAL B 17 0.200 5.820 1.556 1.00 0.00 H new ATOM 0 HG12 VAL B 17 -0.926 7.167 1.845 1.00 0.00 H new ATOM 0 HG13 VAL B 17 -0.865 5.799 2.981 1.00 0.00 H new ATOM 0 HG21 VAL B 17 -0.620 3.639 0.866 1.00 0.00 H new ATOM 0 HG22 VAL B 17 -1.729 3.555 2.255 1.00 0.00 H new ATOM 0 HG23 VAL B 17 -2.355 3.344 0.603 1.00 0.00 H new ATOM 1202 N THR B 18 -3.468 8.065 0.902 1.00 0.00 N ATOM 1203 CA THR B 18 -3.426 9.543 1.147 1.00 0.00 C ATOM 1204 C THR B 18 -4.613 10.341 0.542 1.00 0.00 C ATOM 1205 O THR B 18 -4.452 11.512 0.232 1.00 0.00 O ATOM 1206 CB THR B 18 -2.062 9.976 0.547 1.00 0.00 C ATOM 1207 OG1 THR B 18 -1.807 11.341 0.852 1.00 0.00 O ATOM 1208 CG2 THR B 18 -2.034 9.777 -0.980 1.00 0.00 C ATOM 0 H THR B 18 -3.580 7.788 -0.073 1.00 0.00 H new ATOM 0 HA THR B 18 -3.524 9.762 2.210 1.00 0.00 H new ATOM 0 HB THR B 18 -1.288 9.349 0.990 1.00 0.00 H new ATOM 0 HG1 THR B 18 -2.630 11.861 0.740 1.00 0.00 H new ATOM 0 HG21 THR B 18 -1.065 10.090 -1.370 1.00 0.00 H new ATOM 0 HG22 THR B 18 -2.197 8.725 -1.213 1.00 0.00 H new ATOM 0 HG23 THR B 18 -2.820 10.376 -1.439 1.00 0.00 H new ATOM 1216 N LEU B 19 -5.810 9.767 0.412 1.00 0.00 N ATOM 1217 CA LEU B 19 -6.970 10.595 -0.124 1.00 0.00 C ATOM 1218 C LEU B 19 -7.218 11.824 0.814 1.00 0.00 C ATOM 1219 O LEU B 19 -6.708 11.867 1.924 1.00 0.00 O ATOM 1220 CB LEU B 19 -8.192 9.668 -0.246 1.00 0.00 C ATOM 1221 CG LEU B 19 -8.413 8.840 1.014 1.00 0.00 C ATOM 1222 CD1 LEU B 19 -9.877 8.941 1.395 1.00 0.00 C ATOM 1223 CD2 LEU B 19 -8.045 7.373 0.737 1.00 0.00 C ATOM 0 H LEU B 19 -6.028 8.798 0.644 1.00 0.00 H new ATOM 0 HA LEU B 19 -6.754 11.004 -1.111 1.00 0.00 H new ATOM 0 HB2 LEU B 19 -9.081 10.266 -0.447 1.00 0.00 H new ATOM 0 HB3 LEU B 19 -8.057 9.002 -1.098 1.00 0.00 H new ATOM 0 HG LEU B 19 -7.788 9.210 1.827 1.00 0.00 H new ATOM 0 HD11 LEU B 19 -10.060 8.355 2.296 1.00 0.00 H new ATOM 0 HD12 LEU B 19 -10.133 9.984 1.582 1.00 0.00 H new ATOM 0 HD13 LEU B 19 -10.492 8.557 0.581 1.00 0.00 H new ATOM 0 HD21 LEU B 19 -8.203 6.782 1.639 1.00 0.00 H new ATOM 0 HD22 LEU B 19 -8.673 6.986 -0.066 1.00 0.00 H new ATOM 0 HD23 LEU B 19 -6.998 7.310 0.441 1.00 0.00 H new ATOM 1235 N PRO B 20 -7.907 12.829 0.293 1.00 0.00 N ATOM 1236 CA PRO B 20 -8.108 14.138 1.026 1.00 0.00 C ATOM 1237 C PRO B 20 -8.799 14.091 2.412 1.00 0.00 C ATOM 1238 O PRO B 20 -8.528 14.961 3.224 1.00 0.00 O ATOM 1239 CB PRO B 20 -8.932 14.967 0.037 1.00 0.00 C ATOM 1240 CG PRO B 20 -9.597 13.961 -0.836 1.00 0.00 C ATOM 1241 CD PRO B 20 -8.593 12.859 -1.011 1.00 0.00 C ATOM 0 HA PRO B 20 -7.133 14.543 1.296 1.00 0.00 H new ATOM 0 HB2 PRO B 20 -9.663 15.588 0.554 1.00 0.00 H new ATOM 0 HB3 PRO B 20 -8.298 15.637 -0.543 1.00 0.00 H new ATOM 0 HG2 PRO B 20 -10.513 13.588 -0.378 1.00 0.00 H new ATOM 0 HG3 PRO B 20 -9.874 14.396 -1.796 1.00 0.00 H new ATOM 0 HD2 PRO B 20 -9.073 11.907 -1.237 1.00 0.00 H new ATOM 0 HD3 PRO B 20 -7.901 13.068 -1.827 1.00 0.00 H new ATOM 1249 N ASN B 21 -9.695 13.166 2.702 1.00 0.00 N ATOM 1250 CA ASN B 21 -10.386 13.202 4.056 1.00 0.00 C ATOM 1251 C ASN B 21 -10.285 11.886 4.840 1.00 0.00 C ATOM 1252 O ASN B 21 -11.207 11.533 5.564 1.00 0.00 O ATOM 1253 CB ASN B 21 -11.859 13.447 3.739 1.00 0.00 C ATOM 1254 CG ASN B 21 -12.111 14.829 3.128 1.00 0.00 C ATOM 1255 OD1 ASN B 21 -11.292 15.724 3.199 1.00 0.00 O ATOM 1256 ND2 ASN B 21 -13.246 15.036 2.535 1.00 0.00 N ATOM 0 H ASN B 21 -9.976 12.405 2.084 1.00 0.00 H new ATOM 0 HA ASN B 21 -9.916 13.964 4.677 1.00 0.00 H new ATOM 0 HB2 ASN B 21 -12.210 12.680 3.049 1.00 0.00 H new ATOM 0 HB3 ASN B 21 -12.445 13.346 4.653 1.00 0.00 H new ATOM 0 HD21 ASN B 21 -13.450 15.949 2.129 1.00 0.00 H new ATOM 0 HD22 ASN B 21 -13.934 14.286 2.475 1.00 0.00 H new ATOM 1263 N LEU B 22 -9.216 11.146 4.708 1.00 0.00 N ATOM 1264 CA LEU B 22 -9.137 9.852 5.453 1.00 0.00 C ATOM 1265 C LEU B 22 -8.074 9.864 6.546 1.00 0.00 C ATOM 1266 O LEU B 22 -7.113 10.613 6.503 1.00 0.00 O ATOM 1267 CB LEU B 22 -8.769 8.820 4.411 1.00 0.00 C ATOM 1268 CG LEU B 22 -9.373 7.465 4.768 1.00 0.00 C ATOM 1269 CD1 LEU B 22 -10.867 7.427 4.419 1.00 0.00 C ATOM 1270 CD2 LEU B 22 -8.642 6.388 3.979 1.00 0.00 C ATOM 0 H LEU B 22 -8.408 11.374 4.129 1.00 0.00 H new ATOM 0 HA LEU B 22 -10.083 9.649 5.955 1.00 0.00 H new ATOM 0 HB2 LEU B 22 -9.127 9.138 3.432 1.00 0.00 H new ATOM 0 HB3 LEU B 22 -7.685 8.735 4.341 1.00 0.00 H new ATOM 0 HG LEU B 22 -9.267 7.295 5.839 1.00 0.00 H new ATOM 0 HD11 LEU B 22 -11.277 6.452 4.682 1.00 0.00 H new ATOM 0 HD12 LEU B 22 -11.391 8.203 4.977 1.00 0.00 H new ATOM 0 HD13 LEU B 22 -10.995 7.599 3.350 1.00 0.00 H new ATOM 0 HD21 LEU B 22 -9.061 5.411 4.222 1.00 0.00 H new ATOM 0 HD22 LEU B 22 -8.758 6.577 2.912 1.00 0.00 H new ATOM 0 HD23 LEU B 22 -7.583 6.403 4.238 1.00 0.00 H new ATOM 1282 N ASN B 23 -8.243 8.982 7.498 1.00 0.00 N ATOM 1283 CA ASN B 23 -7.239 8.842 8.617 1.00 0.00 C ATOM 1284 C ASN B 23 -6.595 7.430 8.590 1.00 0.00 C ATOM 1285 O ASN B 23 -7.073 6.537 7.909 1.00 0.00 O ATOM 1286 CB ASN B 23 -7.985 9.159 9.936 1.00 0.00 C ATOM 1287 CG ASN B 23 -9.076 8.126 10.263 1.00 0.00 C ATOM 1288 OD1 ASN B 23 -9.523 7.401 9.411 1.00 0.00 O ATOM 1289 ND2 ASN B 23 -9.531 8.043 11.484 1.00 0.00 N ATOM 0 H ASN B 23 -9.037 8.344 7.556 1.00 0.00 H new ATOM 0 HA ASN B 23 -6.407 9.538 8.511 1.00 0.00 H new ATOM 0 HB2 ASN B 23 -7.267 9.195 10.755 1.00 0.00 H new ATOM 0 HB3 ASN B 23 -8.437 10.148 9.865 1.00 0.00 H new ATOM 0 HD21 ASN B 23 -10.260 7.367 11.712 1.00 0.00 H new ATOM 0 HD22 ASN B 23 -9.157 8.654 12.210 1.00 0.00 H new ATOM 1296 N ASP B 24 -5.476 7.261 9.279 1.00 0.00 N ATOM 1297 CA ASP B 24 -4.700 5.953 9.271 1.00 0.00 C ATOM 1298 C ASP B 24 -5.527 4.636 9.423 1.00 0.00 C ATOM 1299 O ASP B 24 -5.182 3.679 8.750 1.00 0.00 O ATOM 1300 CB ASP B 24 -3.599 6.076 10.355 1.00 0.00 C ATOM 1301 CG ASP B 24 -4.182 6.203 11.769 1.00 0.00 C ATOM 1302 OD1 ASP B 24 -4.564 7.303 12.138 1.00 0.00 O ATOM 1303 OD2 ASP B 24 -4.220 5.199 12.463 1.00 0.00 O ATOM 0 H ASP B 24 -5.057 7.988 9.859 1.00 0.00 H new ATOM 0 HA ASP B 24 -4.289 5.832 8.269 1.00 0.00 H new ATOM 0 HB2 ASP B 24 -2.949 5.202 10.310 1.00 0.00 H new ATOM 0 HB3 ASP B 24 -2.978 6.946 10.141 1.00 0.00 H new ATOM 1308 N PRO B 25 -6.558 4.569 10.271 1.00 0.00 N ATOM 1309 CA PRO B 25 -7.322 3.284 10.411 1.00 0.00 C ATOM 1310 C PRO B 25 -8.118 2.923 9.132 1.00 0.00 C ATOM 1311 O PRO B 25 -8.242 1.754 8.800 1.00 0.00 O ATOM 1312 CB PRO B 25 -8.268 3.550 11.582 1.00 0.00 C ATOM 1313 CG PRO B 25 -8.427 5.030 11.611 1.00 0.00 C ATOM 1314 CD PRO B 25 -7.118 5.610 11.156 1.00 0.00 C ATOM 0 HA PRO B 25 -6.658 2.435 10.574 1.00 0.00 H new ATOM 0 HB2 PRO B 25 -9.227 3.052 11.438 1.00 0.00 H new ATOM 0 HB3 PRO B 25 -7.853 3.178 12.519 1.00 0.00 H new ATOM 0 HG2 PRO B 25 -9.239 5.346 10.956 1.00 0.00 H new ATOM 0 HG3 PRO B 25 -8.675 5.374 12.615 1.00 0.00 H new ATOM 0 HD2 PRO B 25 -7.261 6.551 10.625 1.00 0.00 H new ATOM 0 HD3 PRO B 25 -6.458 5.816 11.998 1.00 0.00 H new ATOM 1322 N GLN B 26 -8.659 3.902 8.421 1.00 0.00 N ATOM 1323 CA GLN B 26 -9.454 3.593 7.177 1.00 0.00 C ATOM 1324 C GLN B 26 -8.516 3.124 6.063 1.00 0.00 C ATOM 1325 O GLN B 26 -8.688 2.041 5.534 1.00 0.00 O ATOM 1326 CB GLN B 26 -10.157 4.898 6.766 1.00 0.00 C ATOM 1327 CG GLN B 26 -10.920 5.517 7.948 1.00 0.00 C ATOM 1328 CD GLN B 26 -12.245 4.805 8.215 1.00 0.00 C ATOM 1329 OE1 GLN B 26 -12.398 3.622 7.976 1.00 0.00 O ATOM 1330 NE2 GLN B 26 -13.218 5.501 8.723 1.00 0.00 N ATOM 0 H GLN B 26 -8.583 4.893 8.649 1.00 0.00 H new ATOM 0 HA GLN B 26 -10.180 2.800 7.358 1.00 0.00 H new ATOM 0 HB2 GLN B 26 -9.420 5.609 6.394 1.00 0.00 H new ATOM 0 HB3 GLN B 26 -10.849 4.699 5.948 1.00 0.00 H new ATOM 0 HG2 GLN B 26 -10.299 5.473 8.843 1.00 0.00 H new ATOM 0 HG3 GLN B 26 -11.110 6.571 7.744 1.00 0.00 H new ATOM 0 HE21 GLN B 26 -13.086 6.493 8.922 1.00 0.00 H new ATOM 0 HE22 GLN B 26 -14.114 5.056 8.923 1.00 0.00 H new ATOM 1339 N LYS B 27 -7.518 3.935 5.711 1.00 0.00 N ATOM 1340 CA LYS B 27 -6.535 3.542 4.626 1.00 0.00 C ATOM 1341 C LYS B 27 -5.963 2.157 4.904 1.00 0.00 C ATOM 1342 O LYS B 27 -5.834 1.349 4.004 1.00 0.00 O ATOM 1343 CB LYS B 27 -5.409 4.597 4.582 1.00 0.00 C ATOM 1344 CG LYS B 27 -4.955 5.080 5.972 1.00 0.00 C ATOM 1345 CD LYS B 27 -4.413 6.515 5.863 1.00 0.00 C ATOM 1346 CE LYS B 27 -5.509 7.476 5.373 1.00 0.00 C ATOM 1347 NZ LYS B 27 -4.958 8.847 5.585 1.00 0.00 N ATOM 0 H LYS B 27 -7.346 4.849 6.130 1.00 0.00 H new ATOM 0 HA LYS B 27 -7.041 3.504 3.661 1.00 0.00 H new ATOM 0 HB2 LYS B 27 -4.552 4.178 4.055 1.00 0.00 H new ATOM 0 HB3 LYS B 27 -5.750 5.455 4.003 1.00 0.00 H new ATOM 0 HG2 LYS B 27 -5.791 5.047 6.671 1.00 0.00 H new ATOM 0 HG3 LYS B 27 -4.184 4.417 6.365 1.00 0.00 H new ATOM 0 HD2 LYS B 27 -4.042 6.843 6.834 1.00 0.00 H new ATOM 0 HD3 LYS B 27 -3.568 6.538 5.175 1.00 0.00 H new ATOM 0 HE2 LYS B 27 -5.741 7.304 4.322 1.00 0.00 H new ATOM 0 HE3 LYS B 27 -6.434 7.334 5.931 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 -5.715 9.477 5.919 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 -4.199 8.810 6.295 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 -4.576 9.210 4.688 1.00 0.00 H new ATOM 1361 N LYS B 28 -5.668 1.870 6.153 1.00 0.00 N ATOM 1362 CA LYS B 28 -5.150 0.516 6.528 1.00 0.00 C ATOM 1363 C LYS B 28 -6.176 -0.568 6.137 1.00 0.00 C ATOM 1364 O LYS B 28 -5.827 -1.603 5.603 1.00 0.00 O ATOM 1365 CB LYS B 28 -5.060 0.526 8.068 1.00 0.00 C ATOM 1366 CG LYS B 28 -3.641 0.795 8.536 1.00 0.00 C ATOM 1367 CD LYS B 28 -2.976 -0.533 8.915 1.00 0.00 C ATOM 1368 CE LYS B 28 -1.481 -0.487 8.588 1.00 0.00 C ATOM 1369 NZ LYS B 28 -0.844 0.335 9.663 1.00 0.00 N ATOM 0 H LYS B 28 -5.765 2.521 6.932 1.00 0.00 H new ATOM 0 HA LYS B 28 -4.200 0.308 6.035 1.00 0.00 H new ATOM 0 HB2 LYS B 28 -5.728 1.289 8.468 1.00 0.00 H new ATOM 0 HB3 LYS B 28 -5.399 -0.433 8.460 1.00 0.00 H new ATOM 0 HG2 LYS B 28 -3.073 1.288 7.748 1.00 0.00 H new ATOM 0 HG3 LYS B 28 -3.649 1.469 9.393 1.00 0.00 H new ATOM 0 HD2 LYS B 28 -3.117 -0.729 9.978 1.00 0.00 H new ATOM 0 HD3 LYS B 28 -3.449 -1.353 8.374 1.00 0.00 H new ATOM 0 HE2 LYS B 28 -1.057 -1.491 8.563 1.00 0.00 H new ATOM 0 HE3 LYS B 28 -1.311 -0.044 7.607 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 -0.455 1.206 9.249 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 -1.556 0.580 10.380 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 -0.078 -0.209 10.108 1.00 0.00 H new ATOM 1383 N ALA B 29 -7.447 -0.322 6.447 1.00 0.00 N ATOM 1384 CA ALA B 29 -8.542 -1.311 6.159 1.00 0.00 C ATOM 1385 C ALA B 29 -8.642 -1.661 4.666 1.00 0.00 C ATOM 1386 O ALA B 29 -8.643 -2.834 4.326 1.00 0.00 O ATOM 1387 CB ALA B 29 -9.839 -0.644 6.639 1.00 0.00 C ATOM 0 H ALA B 29 -7.766 0.538 6.894 1.00 0.00 H new ATOM 0 HA ALA B 29 -8.344 -2.254 6.669 1.00 0.00 H new ATOM 0 HB1 ALA B 29 -10.681 -1.313 6.458 1.00 0.00 H new ATOM 0 HB2 ALA B 29 -9.766 -0.432 7.706 1.00 0.00 H new ATOM 0 HB3 ALA B 29 -9.992 0.287 6.094 1.00 0.00 H new ATOM 1393 N PHE B 30 -8.717 -0.684 3.766 1.00 0.00 N ATOM 1394 CA PHE B 30 -8.808 -1.067 2.308 1.00 0.00 C ATOM 1395 C PHE B 30 -7.425 -1.456 1.752 1.00 0.00 C ATOM 1396 O PHE B 30 -7.359 -2.274 0.869 1.00 0.00 O ATOM 1397 CB PHE B 30 -9.426 0.052 1.419 1.00 0.00 C ATOM 1398 CG PHE B 30 -9.891 1.296 2.133 1.00 0.00 C ATOM 1399 CD1 PHE B 30 -8.960 2.244 2.520 1.00 0.00 C ATOM 1400 CD2 PHE B 30 -11.258 1.541 2.320 1.00 0.00 C ATOM 1401 CE1 PHE B 30 -9.383 3.440 3.095 1.00 0.00 C ATOM 1402 CE2 PHE B 30 -11.678 2.728 2.908 1.00 0.00 C ATOM 1403 CZ PHE B 30 -10.740 3.684 3.293 1.00 0.00 C ATOM 0 H PHE B 30 -8.719 0.316 3.969 1.00 0.00 H new ATOM 0 HA PHE B 30 -9.478 -1.926 2.268 1.00 0.00 H new ATOM 0 HB2 PHE B 30 -8.687 0.343 0.673 1.00 0.00 H new ATOM 0 HB3 PHE B 30 -10.274 -0.370 0.880 1.00 0.00 H new ATOM 0 HD1 PHE B 30 -7.906 2.057 2.376 1.00 0.00 H new ATOM 0 HD2 PHE B 30 -11.986 0.807 2.007 1.00 0.00 H new ATOM 0 HE1 PHE B 30 -8.655 4.182 3.389 1.00 0.00 H new ATOM 0 HE2 PHE B 30 -12.731 2.910 3.067 1.00 0.00 H new ATOM 0 HZ PHE B 30 -11.064 4.611 3.743 1.00 0.00 H new ATOM 1413 N ILE B 31 -6.321 -0.899 2.243 1.00 0.00 N ATOM 1414 CA ILE B 31 -4.978 -1.319 1.685 1.00 0.00 C ATOM 1415 C ILE B 31 -4.720 -2.792 1.992 1.00 0.00 C ATOM 1416 O ILE B 31 -4.320 -3.546 1.124 1.00 0.00 O ATOM 1417 CB ILE B 31 -3.897 -0.447 2.334 1.00 0.00 C ATOM 1418 CG1 ILE B 31 -3.851 0.890 1.566 1.00 0.00 C ATOM 1419 CG2 ILE B 31 -2.516 -1.171 2.259 1.00 0.00 C ATOM 1420 CD1 ILE B 31 -2.430 1.234 1.189 1.00 0.00 C ATOM 0 H ILE B 31 -6.293 -0.196 2.981 1.00 0.00 H new ATOM 0 HA ILE B 31 -4.964 -1.190 0.603 1.00 0.00 H new ATOM 0 HB ILE B 31 -4.124 -0.267 3.385 1.00 0.00 H new ATOM 0 HG12 ILE B 31 -4.465 0.822 0.668 1.00 0.00 H new ATOM 0 HG13 ILE B 31 -4.273 1.685 2.181 1.00 0.00 H new ATOM 0 HG21 ILE B 31 -1.752 -0.546 2.722 1.00 0.00 H new ATOM 0 HG22 ILE B 31 -2.575 -2.123 2.787 1.00 0.00 H new ATOM 0 HG23 ILE B 31 -2.255 -1.350 1.216 1.00 0.00 H new ATOM 0 HD11 ILE B 31 -2.416 2.180 0.648 1.00 0.00 H new ATOM 0 HD12 ILE B 31 -1.826 1.323 2.092 1.00 0.00 H new ATOM 0 HD13 ILE B 31 -2.021 0.447 0.555 1.00 0.00 H new ATOM 1432 N PHE B 32 -4.931 -3.195 3.227 1.00 0.00 N ATOM 1433 CA PHE B 32 -4.692 -4.618 3.600 1.00 0.00 C ATOM 1434 C PHE B 32 -5.593 -5.530 2.729 1.00 0.00 C ATOM 1435 O PHE B 32 -5.135 -6.543 2.226 1.00 0.00 O ATOM 1436 CB PHE B 32 -4.964 -4.699 5.123 1.00 0.00 C ATOM 1437 CG PHE B 32 -3.674 -4.341 5.878 1.00 0.00 C ATOM 1438 CD1 PHE B 32 -3.027 -3.075 5.695 1.00 0.00 C ATOM 1439 CD2 PHE B 32 -3.074 -5.296 6.751 1.00 0.00 C ATOM 1440 CE1 PHE B 32 -1.835 -2.819 6.351 1.00 0.00 C ATOM 1441 CE2 PHE B 32 -1.889 -4.994 7.393 1.00 0.00 C ATOM 1442 CZ PHE B 32 -1.275 -3.775 7.191 1.00 0.00 C ATOM 0 H PHE B 32 -5.257 -2.597 3.986 1.00 0.00 H new ATOM 0 HA PHE B 32 -3.676 -4.966 3.411 1.00 0.00 H new ATOM 0 HB2 PHE B 32 -5.765 -4.014 5.400 1.00 0.00 H new ATOM 0 HB3 PHE B 32 -5.294 -5.702 5.394 1.00 0.00 H new ATOM 0 HD1 PHE B 32 -3.466 -2.327 5.051 1.00 0.00 H new ATOM 0 HD2 PHE B 32 -3.546 -6.254 6.910 1.00 0.00 H new ATOM 0 HE1 PHE B 32 -1.337 -1.871 6.209 1.00 0.00 H new ATOM 0 HE2 PHE B 32 -1.440 -5.717 8.058 1.00 0.00 H new ATOM 0 HZ PHE B 32 -0.344 -3.560 7.694 1.00 0.00 H new ATOM 1452 N SER B 33 -6.835 -5.129 2.461 1.00 0.00 N ATOM 1453 CA SER B 33 -7.708 -5.938 1.533 1.00 0.00 C ATOM 1454 C SER B 33 -7.252 -5.729 0.061 1.00 0.00 C ATOM 1455 O SER B 33 -7.354 -6.632 -0.745 1.00 0.00 O ATOM 1456 CB SER B 33 -9.151 -5.458 1.760 1.00 0.00 C ATOM 1457 OG SER B 33 -9.282 -4.098 1.387 1.00 0.00 O ATOM 0 H SER B 33 -7.270 -4.288 2.842 1.00 0.00 H new ATOM 0 HA SER B 33 -7.635 -7.007 1.733 1.00 0.00 H new ATOM 0 HB2 SER B 33 -9.840 -6.070 1.178 1.00 0.00 H new ATOM 0 HB3 SER B 33 -9.422 -5.582 2.808 1.00 0.00 H new ATOM 0 HG SER B 33 -8.393 -3.690 1.319 1.00 0.00 H new ATOM 1463 N LEU B 34 -6.712 -4.552 -0.274 1.00 0.00 N ATOM 1464 CA LEU B 34 -6.190 -4.278 -1.672 1.00 0.00 C ATOM 1465 C LEU B 34 -5.060 -5.267 -1.970 1.00 0.00 C ATOM 1466 O LEU B 34 -4.985 -5.828 -3.044 1.00 0.00 O ATOM 1467 CB LEU B 34 -5.638 -2.831 -1.638 1.00 0.00 C ATOM 1468 CG LEU B 34 -5.201 -2.354 -3.029 1.00 0.00 C ATOM 1469 CD1 LEU B 34 -6.410 -1.826 -3.809 1.00 0.00 C ATOM 1470 CD2 LEU B 34 -4.168 -1.226 -2.879 1.00 0.00 C ATOM 0 H LEU B 34 -6.613 -3.769 0.372 1.00 0.00 H new ATOM 0 HA LEU B 34 -6.958 -4.388 -2.438 1.00 0.00 H new ATOM 0 HB2 LEU B 34 -6.403 -2.160 -1.247 1.00 0.00 H new ATOM 0 HB3 LEU B 34 -4.791 -2.781 -0.954 1.00 0.00 H new ATOM 0 HG LEU B 34 -4.762 -3.192 -3.570 1.00 0.00 H new ATOM 0 HD11 LEU B 34 -6.088 -1.490 -4.795 1.00 0.00 H new ATOM 0 HD12 LEU B 34 -7.147 -2.621 -3.919 1.00 0.00 H new ATOM 0 HD13 LEU B 34 -6.855 -0.991 -3.268 1.00 0.00 H new ATOM 0 HD21 LEU B 34 -3.856 -0.885 -3.866 1.00 0.00 H new ATOM 0 HD22 LEU B 34 -4.614 -0.395 -2.332 1.00 0.00 H new ATOM 0 HD23 LEU B 34 -3.301 -1.597 -2.332 1.00 0.00 H new ATOM 1482 N TRP B 35 -4.202 -5.493 -0.996 1.00 0.00 N ATOM 1483 CA TRP B 35 -3.084 -6.466 -1.165 1.00 0.00 C ATOM 1484 C TRP B 35 -3.635 -7.899 -1.344 1.00 0.00 C ATOM 1485 O TRP B 35 -3.167 -8.641 -2.190 1.00 0.00 O ATOM 1486 CB TRP B 35 -2.276 -6.378 0.120 1.00 0.00 C ATOM 1487 CG TRP B 35 -1.032 -7.167 -0.074 1.00 0.00 C ATOM 1488 CD1 TRP B 35 -0.771 -8.376 0.468 1.00 0.00 C ATOM 1489 CD2 TRP B 35 0.102 -6.836 -0.901 1.00 0.00 C ATOM 1490 NE1 TRP B 35 0.463 -8.795 0.029 1.00 0.00 N ATOM 1491 CE2 TRP B 35 1.046 -7.873 -0.809 1.00 0.00 C ATOM 1492 CE3 TRP B 35 0.406 -5.736 -1.708 1.00 0.00 C ATOM 1493 CZ2 TRP B 35 2.245 -7.817 -1.494 1.00 0.00 C ATOM 1494 CZ3 TRP B 35 1.611 -5.679 -2.396 1.00 0.00 C ATOM 1495 CH2 TRP B 35 2.524 -6.711 -2.288 1.00 0.00 C ATOM 0 H TRP B 35 -4.235 -5.036 -0.084 1.00 0.00 H new ATOM 0 HA TRP B 35 -2.483 -6.239 -2.046 1.00 0.00 H new ATOM 0 HB2 TRP B 35 -2.038 -5.340 0.352 1.00 0.00 H new ATOM 0 HB3 TRP B 35 -2.850 -6.769 0.960 1.00 0.00 H new ATOM 0 HD1 TRP B 35 -1.422 -8.922 1.134 1.00 0.00 H new ATOM 0 HE1 TRP B 35 0.893 -9.681 0.293 1.00 0.00 H new ATOM 0 HE3 TRP B 35 -0.301 -4.925 -1.797 1.00 0.00 H new ATOM 0 HZ2 TRP B 35 2.958 -8.624 -1.413 1.00 0.00 H new ATOM 0 HZ3 TRP B 35 1.836 -4.825 -3.018 1.00 0.00 H new ATOM 0 HH2 TRP B 35 3.460 -6.658 -2.824 1.00 0.00 H new ATOM 1506 N ASP B 36 -4.629 -8.283 -0.547 1.00 0.00 N ATOM 1507 CA ASP B 36 -5.222 -9.662 -0.660 1.00 0.00 C ATOM 1508 C ASP B 36 -5.980 -9.813 -1.980 1.00 0.00 C ATOM 1509 O ASP B 36 -5.811 -10.795 -2.682 1.00 0.00 O ATOM 1510 CB ASP B 36 -6.200 -9.817 0.522 1.00 0.00 C ATOM 1511 CG ASP B 36 -5.446 -9.959 1.856 1.00 0.00 C ATOM 1512 OD1 ASP B 36 -4.522 -10.758 1.925 1.00 0.00 O ATOM 1513 OD2 ASP B 36 -5.819 -9.274 2.792 1.00 0.00 O ATOM 0 H ASP B 36 -5.049 -7.695 0.173 1.00 0.00 H new ATOM 0 HA ASP B 36 -4.441 -10.422 -0.637 1.00 0.00 H new ATOM 0 HB2 ASP B 36 -6.861 -8.952 0.566 1.00 0.00 H new ATOM 0 HB3 ASP B 36 -6.830 -10.692 0.363 1.00 0.00 H new ATOM 1518 N ASP B 37 -6.812 -8.845 -2.320 1.00 0.00 N ATOM 1519 CA ASP B 37 -7.584 -8.925 -3.587 1.00 0.00 C ATOM 1520 C ASP B 37 -7.553 -7.577 -4.329 1.00 0.00 C ATOM 1521 O ASP B 37 -8.520 -6.828 -4.290 1.00 0.00 O ATOM 1522 CB ASP B 37 -9.026 -9.312 -3.185 1.00 0.00 C ATOM 1523 CG ASP B 37 -9.041 -10.693 -2.516 1.00 0.00 C ATOM 1524 OD1 ASP B 37 -8.991 -11.679 -3.234 1.00 0.00 O ATOM 1525 OD2 ASP B 37 -9.100 -10.738 -1.298 1.00 0.00 O ATOM 0 H ASP B 37 -6.981 -8.006 -1.765 1.00 0.00 H new ATOM 0 HA ASP B 37 -7.159 -9.661 -4.270 1.00 0.00 H new ATOM 0 HB2 ASP B 37 -9.433 -8.566 -2.503 1.00 0.00 H new ATOM 0 HB3 ASP B 37 -9.667 -9.321 -4.067 1.00 0.00 H new ATOM 1530 N PRO B 38 -6.446 -7.311 -5.011 1.00 0.00 N ATOM 1531 CA PRO B 38 -6.325 -6.049 -5.799 1.00 0.00 C ATOM 1532 C PRO B 38 -7.262 -6.051 -7.021 1.00 0.00 C ATOM 1533 O PRO B 38 -7.408 -5.036 -7.668 1.00 0.00 O ATOM 1534 CB PRO B 38 -4.876 -6.008 -6.220 1.00 0.00 C ATOM 1535 CG PRO B 38 -4.434 -7.438 -6.202 1.00 0.00 C ATOM 1536 CD PRO B 38 -5.222 -8.123 -5.118 1.00 0.00 C ATOM 0 HA PRO B 38 -6.614 -5.174 -5.217 1.00 0.00 H new ATOM 0 HB2 PRO B 38 -4.764 -5.572 -7.213 1.00 0.00 H new ATOM 0 HB3 PRO B 38 -4.282 -5.401 -5.536 1.00 0.00 H new ATOM 0 HG2 PRO B 38 -4.614 -7.910 -7.168 1.00 0.00 H new ATOM 0 HG3 PRO B 38 -3.364 -7.510 -6.006 1.00 0.00 H new ATOM 0 HD2 PRO B 38 -5.449 -9.157 -5.380 1.00 0.00 H new ATOM 0 HD3 PRO B 38 -4.673 -8.146 -4.177 1.00 0.00 H new ATOM 1544 N SER B 39 -7.937 -7.159 -7.317 1.00 0.00 N ATOM 1545 CA SER B 39 -8.921 -7.167 -8.459 1.00 0.00 C ATOM 1546 C SER B 39 -9.999 -6.102 -8.160 1.00 0.00 C ATOM 1547 O SER B 39 -10.518 -5.455 -9.050 1.00 0.00 O ATOM 1548 CB SER B 39 -9.540 -8.568 -8.465 1.00 0.00 C ATOM 1549 OG SER B 39 -9.677 -9.018 -9.809 1.00 0.00 O ATOM 0 H SER B 39 -7.846 -8.044 -6.819 1.00 0.00 H new ATOM 0 HA SER B 39 -8.464 -6.943 -9.423 1.00 0.00 H new ATOM 0 HB2 SER B 39 -8.912 -9.258 -7.901 1.00 0.00 H new ATOM 0 HB3 SER B 39 -10.513 -8.550 -7.975 1.00 0.00 H new ATOM 0 HG SER B 39 -10.071 -9.915 -9.815 1.00 0.00 H new ATOM 1555 N GLN B 40 -10.281 -5.904 -6.877 1.00 0.00 N ATOM 1556 CA GLN B 40 -11.267 -4.864 -6.426 1.00 0.00 C ATOM 1557 C GLN B 40 -10.546 -3.507 -6.220 1.00 0.00 C ATOM 1558 O GLN B 40 -11.071 -2.647 -5.554 1.00 0.00 O ATOM 1559 CB GLN B 40 -11.800 -5.331 -5.045 1.00 0.00 C ATOM 1560 CG GLN B 40 -12.001 -6.847 -4.987 1.00 0.00 C ATOM 1561 CD GLN B 40 -12.702 -7.229 -3.681 1.00 0.00 C ATOM 1562 OE1 GLN B 40 -12.198 -6.966 -2.606 1.00 0.00 O ATOM 1563 NE2 GLN B 40 -13.847 -7.848 -3.727 1.00 0.00 N ATOM 0 H GLN B 40 -9.856 -6.434 -6.116 1.00 0.00 H new ATOM 0 HA GLN B 40 -12.061 -4.744 -7.163 1.00 0.00 H new ATOM 0 HB2 GLN B 40 -11.100 -5.029 -4.266 1.00 0.00 H new ATOM 0 HB3 GLN B 40 -12.746 -4.832 -4.835 1.00 0.00 H new ATOM 0 HG2 GLN B 40 -12.595 -7.177 -5.839 1.00 0.00 H new ATOM 0 HG3 GLN B 40 -11.038 -7.353 -5.055 1.00 0.00 H new ATOM 0 HE21 GLN B 40 -14.271 -8.069 -4.628 1.00 0.00 H new ATOM 0 HE22 GLN B 40 -14.319 -8.111 -2.862 1.00 0.00 H new ATOM 1572 N SER B 41 -9.333 -3.325 -6.748 1.00 0.00 N ATOM 1573 CA SER B 41 -8.572 -2.039 -6.532 1.00 0.00 C ATOM 1574 C SER B 41 -9.384 -0.804 -6.954 1.00 0.00 C ATOM 1575 O SER B 41 -9.364 0.200 -6.265 1.00 0.00 O ATOM 1576 CB SER B 41 -7.303 -2.144 -7.368 1.00 0.00 C ATOM 1577 OG SER B 41 -7.623 -2.348 -8.741 1.00 0.00 O ATOM 0 H SER B 41 -8.846 -4.017 -7.317 1.00 0.00 H new ATOM 0 HA SER B 41 -8.353 -1.910 -5.472 1.00 0.00 H new ATOM 0 HB2 SER B 41 -6.712 -1.235 -7.258 1.00 0.00 H new ATOM 0 HB3 SER B 41 -6.689 -2.969 -7.006 1.00 0.00 H new ATOM 0 HG SER B 41 -7.707 -3.308 -8.918 1.00 0.00 H new ATOM 1583 N ALA B 42 -10.121 -0.882 -8.053 1.00 0.00 N ATOM 1584 CA ALA B 42 -10.966 0.285 -8.480 1.00 0.00 C ATOM 1585 C ALA B 42 -12.046 0.514 -7.411 1.00 0.00 C ATOM 1586 O ALA B 42 -12.263 1.629 -6.970 1.00 0.00 O ATOM 1587 CB ALA B 42 -11.596 -0.117 -9.820 1.00 0.00 C ATOM 0 H ALA B 42 -10.170 -1.698 -8.663 1.00 0.00 H new ATOM 0 HA ALA B 42 -10.395 1.207 -8.590 1.00 0.00 H new ATOM 0 HB1 ALA B 42 -12.226 0.695 -10.184 1.00 0.00 H new ATOM 0 HB2 ALA B 42 -10.809 -0.319 -10.546 1.00 0.00 H new ATOM 0 HB3 ALA B 42 -12.202 -1.013 -9.683 1.00 0.00 H new ATOM 1593 N ASN B 43 -12.682 -0.558 -6.962 1.00 0.00 N ATOM 1594 CA ASN B 43 -13.709 -0.460 -5.884 1.00 0.00 C ATOM 1595 C ASN B 43 -13.052 -0.033 -4.552 1.00 0.00 C ATOM 1596 O ASN B 43 -13.665 0.647 -3.759 1.00 0.00 O ATOM 1597 CB ASN B 43 -14.314 -1.869 -5.759 1.00 0.00 C ATOM 1598 CG ASN B 43 -15.517 -1.839 -4.809 1.00 0.00 C ATOM 1599 OD1 ASN B 43 -15.415 -2.260 -3.674 1.00 0.00 O ATOM 1600 ND2 ASN B 43 -16.660 -1.360 -5.224 1.00 0.00 N ATOM 0 H ASN B 43 -12.522 -1.504 -7.309 1.00 0.00 H new ATOM 0 HA ASN B 43 -14.470 0.285 -6.117 1.00 0.00 H new ATOM 0 HB2 ASN B 43 -14.623 -2.230 -6.740 1.00 0.00 H new ATOM 0 HB3 ASN B 43 -13.563 -2.565 -5.386 1.00 0.00 H new ATOM 0 HD21 ASN B 43 -17.463 -1.340 -4.595 1.00 0.00 H new ATOM 0 HD22 ASN B 43 -16.749 -1.006 -6.176 1.00 0.00 H new ATOM 1607 N LEU B 44 -11.806 -0.434 -4.313 1.00 0.00 N ATOM 1608 CA LEU B 44 -11.095 -0.060 -3.041 1.00 0.00 C ATOM 1609 C LEU B 44 -10.760 1.427 -3.031 1.00 0.00 C ATOM 1610 O LEU B 44 -11.034 2.122 -2.077 1.00 0.00 O ATOM 1611 CB LEU B 44 -9.824 -0.909 -3.048 1.00 0.00 C ATOM 1612 CG LEU B 44 -10.110 -2.226 -2.341 1.00 0.00 C ATOM 1613 CD1 LEU B 44 -9.282 -3.348 -2.977 1.00 0.00 C ATOM 1614 CD2 LEU B 44 -9.742 -2.056 -0.866 1.00 0.00 C ATOM 0 H LEU B 44 -11.256 -1.007 -4.953 1.00 0.00 H new ATOM 0 HA LEU B 44 -11.703 -0.240 -2.155 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -9.499 -1.093 -4.072 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -9.014 -0.380 -2.547 1.00 0.00 H new ATOM 0 HG LEU B 44 -11.163 -2.492 -2.433 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -9.491 -4.288 -2.467 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -9.544 -3.441 -4.031 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -8.221 -3.114 -2.886 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -9.937 -2.986 -0.333 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -8.685 -1.804 -0.781 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -10.342 -1.256 -0.431 1.00 0.00 H new ATOM 1626 N LEU B 45 -10.198 1.902 -4.110 1.00 0.00 N ATOM 1627 CA LEU B 45 -9.866 3.360 -4.242 1.00 0.00 C ATOM 1628 C LEU B 45 -11.163 4.174 -4.128 1.00 0.00 C ATOM 1629 O LEU B 45 -11.205 5.193 -3.461 1.00 0.00 O ATOM 1630 CB LEU B 45 -9.241 3.522 -5.634 1.00 0.00 C ATOM 1631 CG LEU B 45 -8.063 4.492 -5.558 1.00 0.00 C ATOM 1632 CD1 LEU B 45 -7.332 4.497 -6.897 1.00 0.00 C ATOM 1633 CD2 LEU B 45 -8.576 5.897 -5.240 1.00 0.00 C ATOM 0 H LEU B 45 -9.949 1.336 -4.921 1.00 0.00 H new ATOM 0 HA LEU B 45 -9.182 3.709 -3.468 1.00 0.00 H new ATOM 0 HB2 LEU B 45 -8.905 2.555 -6.007 1.00 0.00 H new ATOM 0 HB3 LEU B 45 -9.986 3.894 -6.337 1.00 0.00 H new ATOM 0 HG LEU B 45 -7.377 4.178 -4.771 1.00 0.00 H new ATOM 0 HD11 LEU B 45 -6.490 5.188 -6.849 1.00 0.00 H new ATOM 0 HD12 LEU B 45 -6.967 3.494 -7.116 1.00 0.00 H new ATOM 0 HD13 LEU B 45 -8.017 4.813 -7.684 1.00 0.00 H new ATOM 0 HD21 LEU B 45 -7.735 6.588 -5.186 1.00 0.00 H new ATOM 0 HD22 LEU B 45 -9.261 6.220 -6.024 1.00 0.00 H new ATOM 0 HD23 LEU B 45 -9.098 5.886 -4.283 1.00 0.00 H new ATOM 1645 N ALA B 46 -12.234 3.686 -4.735 1.00 0.00 N ATOM 1646 CA ALA B 46 -13.563 4.369 -4.624 1.00 0.00 C ATOM 1647 C ALA B 46 -14.030 4.283 -3.165 1.00 0.00 C ATOM 1648 O ALA B 46 -14.477 5.257 -2.597 1.00 0.00 O ATOM 1649 CB ALA B 46 -14.501 3.568 -5.526 1.00 0.00 C ATOM 0 H ALA B 46 -12.236 2.839 -5.304 1.00 0.00 H new ATOM 0 HA ALA B 46 -13.531 5.419 -4.914 1.00 0.00 H new ATOM 0 HB1 ALA B 46 -15.498 4.009 -5.497 1.00 0.00 H new ATOM 0 HB2 ALA B 46 -14.125 3.586 -6.549 1.00 0.00 H new ATOM 0 HB3 ALA B 46 -14.550 2.537 -5.176 1.00 0.00 H new ATOM 1655 N GLU B 47 -13.877 3.113 -2.555 1.00 0.00 N ATOM 1656 CA GLU B 47 -14.246 2.912 -1.117 1.00 0.00 C ATOM 1657 C GLU B 47 -13.426 3.875 -0.238 1.00 0.00 C ATOM 1658 O GLU B 47 -13.912 4.377 0.746 1.00 0.00 O ATOM 1659 CB GLU B 47 -13.869 1.449 -0.808 1.00 0.00 C ATOM 1660 CG GLU B 47 -14.368 1.043 0.587 1.00 0.00 C ATOM 1661 CD GLU B 47 -13.976 -0.417 0.892 1.00 0.00 C ATOM 1662 OE1 GLU B 47 -12.858 -0.812 0.578 1.00 0.00 O ATOM 1663 OE2 GLU B 47 -14.803 -1.117 1.453 1.00 0.00 O ATOM 0 H GLU B 47 -13.504 2.281 -3.012 1.00 0.00 H new ATOM 0 HA GLU B 47 -15.301 3.107 -0.922 1.00 0.00 H new ATOM 0 HB2 GLU B 47 -14.302 0.790 -1.561 1.00 0.00 H new ATOM 0 HB3 GLU B 47 -12.787 1.328 -0.862 1.00 0.00 H new ATOM 0 HG2 GLU B 47 -13.942 1.706 1.340 1.00 0.00 H new ATOM 0 HG3 GLU B 47 -15.451 1.155 0.640 1.00 0.00 H new ATOM 1670 N ALA B 48 -12.189 4.135 -0.622 1.00 0.00 N ATOM 1671 CA ALA B 48 -11.307 5.071 0.148 1.00 0.00 C ATOM 1672 C ALA B 48 -11.825 6.510 0.010 1.00 0.00 C ATOM 1673 O ALA B 48 -12.112 7.159 0.998 1.00 0.00 O ATOM 1674 CB ALA B 48 -9.904 4.922 -0.475 1.00 0.00 C ATOM 0 H ALA B 48 -11.752 3.729 -1.450 1.00 0.00 H new ATOM 0 HA ALA B 48 -11.290 4.842 1.214 1.00 0.00 H new ATOM 0 HB1 ALA B 48 -9.205 5.580 0.041 1.00 0.00 H new ATOM 0 HB2 ALA B 48 -9.570 3.889 -0.376 1.00 0.00 H new ATOM 0 HB3 ALA B 48 -9.944 5.191 -1.530 1.00 0.00 H new ATOM 1680 N LYS B 49 -11.961 6.997 -1.213 1.00 0.00 N ATOM 1681 CA LYS B 49 -12.473 8.400 -1.437 1.00 0.00 C ATOM 1682 C LYS B 49 -13.905 8.552 -0.895 1.00 0.00 C ATOM 1683 O LYS B 49 -14.204 9.508 -0.209 1.00 0.00 O ATOM 1684 CB LYS B 49 -12.441 8.618 -2.958 1.00 0.00 C ATOM 1685 CG LYS B 49 -10.985 8.657 -3.443 1.00 0.00 C ATOM 1686 CD LYS B 49 -10.943 8.985 -4.938 1.00 0.00 C ATOM 1687 CE LYS B 49 -9.495 8.893 -5.444 1.00 0.00 C ATOM 1688 NZ LYS B 49 -8.993 10.299 -5.514 1.00 0.00 N ATOM 0 H LYS B 49 -11.739 6.482 -2.065 1.00 0.00 H new ATOM 0 HA LYS B 49 -11.863 9.136 -0.914 1.00 0.00 H new ATOM 0 HB2 LYS B 49 -12.981 7.816 -3.462 1.00 0.00 H new ATOM 0 HB3 LYS B 49 -12.945 9.551 -3.212 1.00 0.00 H new ATOM 0 HG2 LYS B 49 -10.425 9.405 -2.882 1.00 0.00 H new ATOM 0 HG3 LYS B 49 -10.505 7.696 -3.259 1.00 0.00 H new ATOM 0 HD2 LYS B 49 -11.577 8.292 -5.491 1.00 0.00 H new ATOM 0 HD3 LYS B 49 -11.337 9.986 -5.112 1.00 0.00 H new ATOM 0 HE2 LYS B 49 -8.883 8.293 -4.770 1.00 0.00 H new ATOM 0 HE3 LYS B 49 -9.453 8.415 -6.423 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 -7.953 10.296 -5.534 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 -9.355 10.754 -6.376 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 -9.321 10.827 -4.680 1.00 0.00 H new ATOM 1702 N LYS B 50 -14.780 7.605 -1.177 1.00 0.00 N ATOM 1703 CA LYS B 50 -16.187 7.691 -0.647 1.00 0.00 C ATOM 1704 C LYS B 50 -16.190 7.596 0.889 1.00 0.00 C ATOM 1705 O LYS B 50 -16.977 8.258 1.538 1.00 0.00 O ATOM 1706 CB LYS B 50 -16.979 6.551 -1.294 1.00 0.00 C ATOM 1707 CG LYS B 50 -17.238 6.907 -2.763 1.00 0.00 C ATOM 1708 CD LYS B 50 -18.156 5.856 -3.395 1.00 0.00 C ATOM 1709 CE LYS B 50 -18.402 6.203 -4.872 1.00 0.00 C ATOM 1710 NZ LYS B 50 -17.326 5.500 -5.638 1.00 0.00 N ATOM 0 H LYS B 50 -14.582 6.783 -1.747 1.00 0.00 H new ATOM 0 HA LYS B 50 -16.647 8.648 -0.895 1.00 0.00 H new ATOM 0 HB2 LYS B 50 -16.423 5.616 -1.224 1.00 0.00 H new ATOM 0 HB3 LYS B 50 -17.922 6.400 -0.769 1.00 0.00 H new ATOM 0 HG2 LYS B 50 -17.696 7.893 -2.833 1.00 0.00 H new ATOM 0 HG3 LYS B 50 -16.295 6.955 -3.307 1.00 0.00 H new ATOM 0 HD2 LYS B 50 -17.703 4.868 -3.314 1.00 0.00 H new ATOM 0 HD3 LYS B 50 -19.104 5.817 -2.858 1.00 0.00 H new ATOM 0 HE2 LYS B 50 -19.390 5.873 -5.192 1.00 0.00 H new ATOM 0 HE3 LYS B 50 -18.358 7.280 -5.034 1.00 0.00 H new ATOM 0 HZ1 LYS B 50 -17.365 5.790 -6.636 1.00 0.00 H new ATOM 0 HZ2 LYS B 50 -16.398 5.749 -5.241 1.00 0.00 H new ATOM 0 HZ3 LYS B 50 -17.467 4.472 -5.570 1.00 0.00 H new ATOM 1724 N LEU B 51 -15.296 6.817 1.479 1.00 0.00 N ATOM 1725 CA LEU B 51 -15.232 6.745 2.978 1.00 0.00 C ATOM 1726 C LEU B 51 -14.763 8.110 3.521 1.00 0.00 C ATOM 1727 O LEU B 51 -15.284 8.590 4.513 1.00 0.00 O ATOM 1728 CB LEU B 51 -14.233 5.620 3.316 1.00 0.00 C ATOM 1729 CG LEU B 51 -14.292 5.296 4.816 1.00 0.00 C ATOM 1730 CD1 LEU B 51 -13.579 3.964 5.086 1.00 0.00 C ATOM 1731 CD2 LEU B 51 -13.642 6.420 5.634 1.00 0.00 C ATOM 0 H LEU B 51 -14.617 6.236 0.988 1.00 0.00 H new ATOM 0 HA LEU B 51 -16.199 6.529 3.432 1.00 0.00 H new ATOM 0 HB2 LEU B 51 -14.466 4.729 2.734 1.00 0.00 H new ATOM 0 HB3 LEU B 51 -13.223 5.925 3.041 1.00 0.00 H new ATOM 0 HG LEU B 51 -15.336 5.211 5.118 1.00 0.00 H new ATOM 0 HD11 LEU B 51 -13.623 3.737 6.151 1.00 0.00 H new ATOM 0 HD12 LEU B 51 -14.070 3.168 4.525 1.00 0.00 H new ATOM 0 HD13 LEU B 51 -12.537 4.039 4.774 1.00 0.00 H new ATOM 0 HD21 LEU B 51 -13.693 6.174 6.695 1.00 0.00 H new ATOM 0 HD22 LEU B 51 -12.599 6.530 5.336 1.00 0.00 H new ATOM 0 HD23 LEU B 51 -14.172 7.355 5.453 1.00 0.00 H new ATOM 1743 N ASN B 52 -13.810 8.752 2.849 1.00 0.00 N ATOM 1744 CA ASN B 52 -13.332 10.116 3.282 1.00 0.00 C ATOM 1745 C ASN B 52 -14.531 11.075 3.355 1.00 0.00 C ATOM 1746 O ASN B 52 -14.549 11.986 4.162 1.00 0.00 O ATOM 1747 CB ASN B 52 -12.273 10.531 2.211 1.00 0.00 C ATOM 1748 CG ASN B 52 -12.741 11.581 1.152 1.00 0.00 C ATOM 1749 OD1 ASN B 52 -13.574 12.429 1.384 1.00 0.00 O ATOM 1750 ND2 ASN B 52 -12.173 11.592 -0.015 1.00 0.00 N ATOM 0 H ASN B 52 -13.346 8.383 2.019 1.00 0.00 H new ATOM 0 HA ASN B 52 -12.882 10.132 4.275 1.00 0.00 H new ATOM 0 HB2 ASN B 52 -11.401 10.931 2.728 1.00 0.00 H new ATOM 0 HB3 ASN B 52 -11.948 9.634 1.684 1.00 0.00 H new ATOM 0 HD21 ASN B 52 -12.433 12.300 -0.702 1.00 0.00 H new ATOM 0 HD22 ASN B 52 -11.467 10.893 -0.245 1.00 0.00 H new ATOM 1757 N ASP B 53 -15.528 10.863 2.501 1.00 0.00 N ATOM 1758 CA ASP B 53 -16.732 11.748 2.490 1.00 0.00 C ATOM 1759 C ASP B 53 -17.471 11.659 3.840 1.00 0.00 C ATOM 1760 O ASP B 53 -18.079 12.619 4.281 1.00 0.00 O ATOM 1761 CB ASP B 53 -17.662 11.228 1.374 1.00 0.00 C ATOM 1762 CG ASP B 53 -17.007 11.283 -0.025 1.00 0.00 C ATOM 1763 OD1 ASP B 53 -15.982 11.929 -0.190 1.00 0.00 O ATOM 1764 OD2 ASP B 53 -17.560 10.668 -0.917 1.00 0.00 O ATOM 0 H ASP B 53 -15.546 10.109 1.814 1.00 0.00 H new ATOM 0 HA ASP B 53 -16.442 12.785 2.322 1.00 0.00 H new ATOM 0 HB2 ASP B 53 -17.949 10.200 1.596 1.00 0.00 H new ATOM 0 HB3 ASP B 53 -18.578 11.820 1.365 1.00 0.00 H new ATOM 1769 N ALA B 54 -17.421 10.501 4.497 1.00 0.00 N ATOM 1770 CA ALA B 54 -18.117 10.336 5.819 1.00 0.00 C ATOM 1771 C ALA B 54 -17.432 11.194 6.899 1.00 0.00 C ATOM 1772 O ALA B 54 -18.090 11.764 7.752 1.00 0.00 O ATOM 1773 CB ALA B 54 -17.993 8.845 6.143 1.00 0.00 C ATOM 0 H ALA B 54 -16.927 9.672 4.167 1.00 0.00 H new ATOM 0 HA ALA B 54 -19.157 10.659 5.784 1.00 0.00 H new ATOM 0 HB1 ALA B 54 -18.478 8.638 7.097 1.00 0.00 H new ATOM 0 HB2 ALA B 54 -18.473 8.261 5.358 1.00 0.00 H new ATOM 0 HB3 ALA B 54 -16.939 8.572 6.205 1.00 0.00 H new ATOM 1779 N GLN B 55 -16.119 11.296 6.845 1.00 0.00 N ATOM 1780 CA GLN B 55 -15.356 12.122 7.837 1.00 0.00 C ATOM 1781 C GLN B 55 -15.364 13.610 7.422 1.00 0.00 C ATOM 1782 O GLN B 55 -15.320 14.487 8.266 1.00 0.00 O ATOM 1783 CB GLN B 55 -13.944 11.520 7.815 1.00 0.00 C ATOM 1784 CG GLN B 55 -13.959 10.181 8.569 1.00 0.00 C ATOM 1785 CD GLN B 55 -12.655 9.424 8.318 1.00 0.00 C ATOM 1786 OE1 GLN B 55 -11.998 8.997 9.244 1.00 0.00 O ATOM 1787 NE2 GLN B 55 -12.250 9.239 7.094 1.00 0.00 N ATOM 0 H GLN B 55 -15.539 10.834 6.145 1.00 0.00 H new ATOM 0 HA GLN B 55 -15.786 12.101 8.838 1.00 0.00 H new ATOM 0 HB2 GLN B 55 -13.615 11.369 6.787 1.00 0.00 H new ATOM 0 HB3 GLN B 55 -13.235 12.206 8.279 1.00 0.00 H new ATOM 0 HG2 GLN B 55 -14.087 10.357 9.637 1.00 0.00 H new ATOM 0 HG3 GLN B 55 -14.807 9.579 8.242 1.00 0.00 H new ATOM 0 HE21 GLN B 55 -12.802 9.598 6.315 1.00 0.00 H new ATOM 0 HE22 GLN B 55 -11.381 8.735 6.915 1.00 0.00 H new ATOM 1796 N ALA B 56 -15.422 13.890 6.128 1.00 0.00 N ATOM 1797 CA ALA B 56 -15.435 15.309 5.635 1.00 0.00 C ATOM 1798 C ALA B 56 -16.166 15.396 4.274 1.00 0.00 C ATOM 1799 O ALA B 56 -16.108 14.464 3.501 1.00 0.00 O ATOM 1800 CB ALA B 56 -13.962 15.664 5.482 1.00 0.00 C ATOM 0 H ALA B 56 -15.461 13.185 5.392 1.00 0.00 H new ATOM 0 HA ALA B 56 -15.956 15.988 6.310 1.00 0.00 H new ATOM 0 HB1 ALA B 56 -13.870 16.689 5.124 1.00 0.00 H new ATOM 0 HB2 ALA B 56 -13.463 15.571 6.447 1.00 0.00 H new ATOM 0 HB3 ALA B 56 -13.497 14.986 4.766 1.00 0.00 H new ATOM 1806 N PRO B 57 -16.843 16.511 4.030 1.00 0.00 N ATOM 1807 CA PRO B 57 -17.610 16.697 2.750 1.00 0.00 C ATOM 1808 C PRO B 57 -16.677 16.988 1.545 1.00 0.00 C ATOM 1809 O PRO B 57 -16.687 18.077 0.991 1.00 0.00 O ATOM 1810 CB PRO B 57 -18.502 17.903 3.055 1.00 0.00 C ATOM 1811 CG PRO B 57 -17.764 18.669 4.104 1.00 0.00 C ATOM 1812 CD PRO B 57 -16.958 17.685 4.904 1.00 0.00 C ATOM 0 HA PRO B 57 -18.165 15.804 2.463 1.00 0.00 H new ATOM 0 HB2 PRO B 57 -18.665 18.509 2.164 1.00 0.00 H new ATOM 0 HB3 PRO B 57 -19.483 17.589 3.411 1.00 0.00 H new ATOM 0 HG2 PRO B 57 -17.113 19.415 3.647 1.00 0.00 H new ATOM 0 HG3 PRO B 57 -18.461 19.206 4.748 1.00 0.00 H new ATOM 0 HD2 PRO B 57 -15.978 18.088 5.159 1.00 0.00 H new ATOM 0 HD3 PRO B 57 -17.454 17.435 5.842 1.00 0.00 H new ATOM 1820 N LYS B 58 -15.887 16.007 1.140 1.00 0.00 N ATOM 1821 CA LYS B 58 -14.933 16.155 -0.030 1.00 0.00 C ATOM 1822 C LYS B 58 -14.123 17.480 0.053 1.00 0.00 C ATOM 1823 O LYS B 58 -14.341 18.373 -0.758 1.00 0.00 O ATOM 1824 CB LYS B 58 -15.814 16.074 -1.299 1.00 0.00 C ATOM 1825 CG LYS B 58 -16.296 14.632 -1.500 1.00 0.00 C ATOM 1826 CD LYS B 58 -17.062 14.516 -2.823 1.00 0.00 C ATOM 1827 CE LYS B 58 -17.606 13.083 -2.992 1.00 0.00 C ATOM 1828 NZ LYS B 58 -18.904 13.051 -2.249 1.00 0.00 N ATOM 1829 OXT LYS B 58 -13.288 17.573 0.939 1.00 0.00 O ATOM 0 H LYS B 58 -15.862 15.088 1.581 1.00 0.00 H new ATOM 0 HA LYS B 58 -14.176 15.371 -0.035 1.00 0.00 H new ATOM 0 HB2 LYS B 58 -16.669 16.744 -1.204 1.00 0.00 H new ATOM 0 HB3 LYS B 58 -15.246 16.403 -2.169 1.00 0.00 H new ATOM 0 HG2 LYS B 58 -15.444 13.952 -1.502 1.00 0.00 H new ATOM 0 HG3 LYS B 58 -16.938 14.335 -0.671 1.00 0.00 H new ATOM 0 HD2 LYS B 58 -17.885 15.231 -2.841 1.00 0.00 H new ATOM 0 HD3 LYS B 58 -16.405 14.765 -3.656 1.00 0.00 H new ATOM 0 HE2 LYS B 58 -17.752 12.841 -4.045 1.00 0.00 H new ATOM 0 HE3 LYS B 58 -16.907 12.349 -2.590 1.00 0.00 H new ATOM 0 HZ1 LYS B 58 -18.934 12.210 -1.638 1.00 0.00 H new ATOM 0 HZ2 LYS B 58 -18.990 13.907 -1.664 1.00 0.00 H new ATOM 0 HZ3 LYS B 58 -19.691 13.015 -2.927 1.00 0.00 H new TER 1843 LYS B 58