USER MOD reduce.3.24.130724 H: found=0, std=0, add=1175, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1175 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 116 ASN : amide:sc= -2.35! C(o=-1.4!,f=-8.6!) USER MOD Set 1.2: A 125 LYS NZ :NH3+ 167:sc= 0.95 (180deg=-0.275) USER MOD Set 2.1: A 102 HIS : no HE2:sc= -4.18! C(o=-4.5!,f=-5.5!) USER MOD Set 2.2: A 126 MET CE :methyl -109:sc= -0.289 (180deg=-1.45) USER MOD Set 3.1: A 75 SER OG : rot 180:sc= 0.824 USER MOD Set 3.2: A 86 THR OG1 : rot -98:sc= 1.19 USER MOD Set 4.1: A 69 GLN : amide:sc= -0.0542 K(o=-0.82,f=-1.3) USER MOD Set 4.2: A 72 THR OG1 : rot -73:sc= -0.764! USER MOD Set 5.1: A 53 HIS : no HD1:sc= 0.274 K(o=0.52,f=-4.3!) USER MOD Set 5.2: A 55 GLN : amide:sc= 0.249 X(o=0.52,f=0.2) USER MOD Set 6.1: A 31 THR OG1 : rot 180:sc= -0.176 USER MOD Set 6.2: A 32 SER OG : rot 180:sc= 0.049 USER MOD Set 7.1: A 7 ASN : amide:sc= -1.97! K(o=-1.4!,f=0.56) USER MOD Set 7.2: A 119 SER OG : rot 124:sc= 0.535 USER MOD Single : A 1 MET CE :methyl -165:sc= -0.158 (180deg=-0.651) USER MOD Single : A 1 MET N :NH3+ -172:sc= 0 (180deg=-0.111) USER MOD Single : A 3 GLN : amide:sc= -0.551 K(o=-0.55,f=-5!) USER MOD Single : A 4 ASN : amide:sc= 0 X(o=0,f=-0.085) USER MOD Single : A 5 ASN : amide:sc= -0.162 X(o=-0.16,f=-0.16) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ 145:sc= 1.28 (180deg=0.481) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 GLN : amide:sc= -0.515 K(o=-0.51,f=-1.7!) USER MOD Single : A 24 LYS NZ :NH3+ -125:sc= 0.347 (180deg=0) USER MOD Single : A 28 THR OG1 : rot 69:sc= 0.699 USER MOD Single : A 30 SER OG : rot 57:sc= -2.97! USER MOD Single : A 37 LYS NZ :NH3+ 161:sc= -0.0489 (180deg=-0.351) USER MOD Single : A 40 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 42 ASN : amide:sc= -2.09! C(o=-2.1!,f=-4.4!) USER MOD Single : A 45 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 47 LYS NZ :NH3+ -173:sc=-0.00382 (180deg=-0.084) USER MOD Single : A 50 GLN : amide:sc= -21.6! C(o=-22!,f=-18!) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 61 SER OG : rot -68:sc= 1.24 USER MOD Single : A 63 CYS SG : rot -160:sc= 2.3 USER MOD Single : A 64 LYS NZ :NH3+ -152:sc= -0.186 (180deg=-0.699) USER MOD Single : A 80 THR OG1 : rot -84:sc= 1.05 USER MOD Single : A 88 GLN : amide:sc= -0.429 K(o=-0.43,f=-3.7!) USER MOD Single : A 95 LYS NZ :NH3+ 149:sc= 0.897 (180deg=0.308) USER MOD Single : A 96 THR OG1 : rot -73:sc= -1.12! USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 111:sc= 1.11 USER MOD Single : A 106 LYS NZ :NH3+ 163:sc= 2.37 (180deg=1.78) USER MOD Single : A 109 ASN : amide:sc= -0.0177 K(o=-0.018,f=-1.1) USER MOD Single : A 110 GLN : amide:sc= 0 X(o=0,f=-0.23) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 LYS NZ :NH3+ -176:sc= 1.03 (180deg=1.01) USER MOD Single : A 120 SER OG : rot 180:sc= -0.0134 USER MOD Single : A 131 THR OG1 : rot -81:sc= 0.0384 USER MOD Single : A 135 ASN : amide:sc= -4.57! C(o=-4.6!,f=-7.3!) USER MOD Single : A 140 LYS NZ :NH3+ 173:sc= -0.0118 (180deg=-0.084) USER MOD Single : A 147 HIS : no HE2:sc= 0.348 K(o=0.35,f=-4.3!) USER MOD Single : A 148 HIS : no HD1:sc= -0.773 X(o=-0.77,f=-0.77) USER MOD Single : A 149 HIS : no HD1:sc= -0.0447 X(o=-0.045,f=0) USER MOD Single : A 150 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 151 HIS : no HD1:sc= -0.012 X(o=-0.012,f=-0.022) USER MOD Single : A 152 HIS : no HD1:sc= -0.357 X(o=-0.36,f=-0.63) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 25.875 -3.589 -1.576 1.00 0.00 N ATOM 2 CA MET A 1 24.484 -4.063 -1.387 1.00 0.00 C ATOM 3 C MET A 1 23.725 -3.992 -2.704 1.00 0.00 C ATOM 4 O MET A 1 23.519 -5.008 -3.368 1.00 0.00 O ATOM 5 CB MET A 1 23.759 -3.220 -0.333 1.00 0.00 C ATOM 6 CG MET A 1 24.411 -3.243 1.040 1.00 0.00 C ATOM 7 SD MET A 1 24.480 -4.898 1.753 1.00 0.00 S ATOM 8 CE MET A 1 22.735 -5.304 1.833 1.00 0.00 C ATOM 0 H1 MET A 1 26.423 -3.767 -0.710 1.00 0.00 H new ATOM 0 H2 MET A 1 26.310 -4.098 -2.372 1.00 0.00 H new ATOM 0 H3 MET A 1 25.870 -2.569 -1.779 1.00 0.00 H new ATOM 0 HA MET A 1 24.521 -5.097 -1.043 1.00 0.00 H new ATOM 0 HB2 MET A 1 23.708 -2.188 -0.681 1.00 0.00 H new ATOM 0 HB3 MET A 1 22.733 -3.577 -0.242 1.00 0.00 H new ATOM 0 HG2 MET A 1 25.422 -2.843 0.964 1.00 0.00 H new ATOM 0 HG3 MET A 1 23.858 -2.586 1.711 1.00 0.00 H new ATOM 0 HE1 MET A 1 22.591 -6.166 2.484 1.00 0.00 H new ATOM 0 HE2 MET A 1 22.181 -4.453 2.230 1.00 0.00 H new ATOM 0 HE3 MET A 1 22.370 -5.540 0.833 1.00 0.00 H new ATOM 20 N ALA A 2 23.322 -2.785 -3.084 1.00 0.00 N ATOM 21 CA ALA A 2 22.625 -2.571 -4.342 1.00 0.00 C ATOM 22 C ALA A 2 22.916 -1.177 -4.877 1.00 0.00 C ATOM 23 O ALA A 2 22.302 -0.195 -4.453 1.00 0.00 O ATOM 24 CB ALA A 2 21.127 -2.778 -4.162 1.00 0.00 C ATOM 0 H ALA A 2 23.468 -1.938 -2.535 1.00 0.00 H new ATOM 0 HA ALA A 2 22.985 -3.299 -5.069 1.00 0.00 H new ATOM 0 HB1 ALA A 2 20.620 -2.614 -5.113 1.00 0.00 H new ATOM 0 HB2 ALA A 2 20.939 -3.796 -3.821 1.00 0.00 H new ATOM 0 HB3 ALA A 2 20.748 -2.072 -3.423 1.00 0.00 H new ATOM 30 N GLN A 3 23.866 -1.097 -5.795 1.00 0.00 N ATOM 31 CA GLN A 3 24.252 0.175 -6.392 1.00 0.00 C ATOM 32 C GLN A 3 23.412 0.423 -7.636 1.00 0.00 C ATOM 33 O GLN A 3 22.998 1.546 -7.923 1.00 0.00 O ATOM 34 CB GLN A 3 25.734 0.158 -6.771 1.00 0.00 C ATOM 35 CG GLN A 3 26.656 -0.383 -5.685 1.00 0.00 C ATOM 36 CD GLN A 3 26.758 0.518 -4.472 1.00 0.00 C ATOM 37 OE1 GLN A 3 25.816 1.219 -4.113 1.00 0.00 O ATOM 38 NE2 GLN A 3 27.915 0.497 -3.828 1.00 0.00 N ATOM 0 H GLN A 3 24.387 -1.901 -6.145 1.00 0.00 H new ATOM 0 HA GLN A 3 24.084 0.972 -5.667 1.00 0.00 H new ATOM 0 HB2 GLN A 3 25.859 -0.445 -7.670 1.00 0.00 H new ATOM 0 HB3 GLN A 3 26.044 1.173 -7.021 1.00 0.00 H new ATOM 0 HG2 GLN A 3 26.297 -1.363 -5.370 1.00 0.00 H new ATOM 0 HG3 GLN A 3 27.652 -0.528 -6.104 1.00 0.00 H new ATOM 0 HE21 GLN A 3 28.673 -0.100 -4.160 1.00 0.00 H new ATOM 0 HE22 GLN A 3 28.049 1.078 -3.000 1.00 0.00 H new ATOM 47 N ASN A 4 23.156 -0.657 -8.355 1.00 0.00 N ATOM 48 CA ASN A 4 22.381 -0.615 -9.584 1.00 0.00 C ATOM 49 C ASN A 4 21.063 -1.341 -9.357 1.00 0.00 C ATOM 50 O ASN A 4 20.925 -2.085 -8.384 1.00 0.00 O ATOM 51 CB ASN A 4 23.158 -1.300 -10.718 1.00 0.00 C ATOM 52 CG ASN A 4 24.588 -0.800 -10.844 1.00 0.00 C ATOM 53 OD1 ASN A 4 25.486 -1.286 -10.155 1.00 0.00 O ATOM 54 ND2 ASN A 4 24.824 0.143 -11.743 1.00 0.00 N ATOM 0 H ASN A 4 23.481 -1.590 -8.102 1.00 0.00 H new ATOM 0 HA ASN A 4 22.193 0.422 -9.863 1.00 0.00 H new ATOM 0 HB2 ASN A 4 23.169 -2.376 -10.545 1.00 0.00 H new ATOM 0 HB3 ASN A 4 22.636 -1.134 -11.661 1.00 0.00 H new ATOM 0 HD21 ASN A 4 25.773 0.489 -11.882 1.00 0.00 H new ATOM 0 HD22 ASN A 4 24.056 0.523 -12.297 1.00 0.00 H new ATOM 61 N ASN A 5 20.092 -1.130 -10.230 1.00 0.00 N ATOM 62 CA ASN A 5 18.821 -1.819 -10.094 1.00 0.00 C ATOM 63 C ASN A 5 18.850 -3.097 -10.920 1.00 0.00 C ATOM 64 O ASN A 5 19.098 -3.073 -12.126 1.00 0.00 O ATOM 65 CB ASN A 5 17.639 -0.914 -10.490 1.00 0.00 C ATOM 66 CG ASN A 5 17.402 -0.805 -11.987 1.00 0.00 C ATOM 67 OD1 ASN A 5 18.019 0.012 -12.669 1.00 0.00 O ATOM 68 ND2 ASN A 5 16.464 -1.591 -12.499 1.00 0.00 N ATOM 0 H ASN A 5 20.157 -0.498 -11.028 1.00 0.00 H new ATOM 0 HA ASN A 5 18.672 -2.080 -9.046 1.00 0.00 H new ATOM 0 HB2 ASN A 5 16.733 -1.294 -10.018 1.00 0.00 H new ATOM 0 HB3 ASN A 5 17.812 0.085 -10.089 1.00 0.00 H new ATOM 0 HD21 ASN A 5 16.233 -1.530 -13.491 1.00 0.00 H new ATOM 0 HD22 ASN A 5 15.974 -2.256 -11.901 1.00 0.00 H new ATOM 75 N GLU A 6 18.643 -4.218 -10.255 1.00 0.00 N ATOM 76 CA GLU A 6 18.656 -5.504 -10.918 1.00 0.00 C ATOM 77 C GLU A 6 17.239 -6.021 -11.086 1.00 0.00 C ATOM 78 O GLU A 6 16.855 -6.459 -12.171 1.00 0.00 O ATOM 79 CB GLU A 6 19.512 -6.497 -10.126 1.00 0.00 C ATOM 80 CG GLU A 6 19.178 -7.950 -10.408 1.00 0.00 C ATOM 81 CD GLU A 6 20.230 -8.911 -9.892 1.00 0.00 C ATOM 82 OE1 GLU A 6 21.173 -9.217 -10.652 1.00 0.00 O ATOM 83 OE2 GLU A 6 20.118 -9.372 -8.737 1.00 0.00 O ATOM 0 H GLU A 6 18.463 -4.262 -9.252 1.00 0.00 H new ATOM 0 HA GLU A 6 19.096 -5.389 -11.909 1.00 0.00 H new ATOM 0 HB2 GLU A 6 20.563 -6.323 -10.358 1.00 0.00 H new ATOM 0 HB3 GLU A 6 19.385 -6.304 -9.061 1.00 0.00 H new ATOM 0 HG2 GLU A 6 18.218 -8.192 -9.951 1.00 0.00 H new ATOM 0 HG3 GLU A 6 19.063 -8.089 -11.483 1.00 0.00 H new ATOM 90 N ASN A 7 16.461 -5.952 -10.018 1.00 0.00 N ATOM 91 CA ASN A 7 15.104 -6.441 -10.049 1.00 0.00 C ATOM 92 C ASN A 7 14.221 -5.706 -9.047 1.00 0.00 C ATOM 93 O ASN A 7 13.363 -4.916 -9.451 1.00 0.00 O ATOM 94 CB ASN A 7 15.080 -7.942 -9.760 1.00 0.00 C ATOM 95 CG ASN A 7 13.748 -8.592 -10.101 1.00 0.00 C ATOM 96 OD1 ASN A 7 13.305 -9.519 -9.419 1.00 0.00 O ATOM 97 ND2 ASN A 7 13.111 -8.136 -11.172 1.00 0.00 N ATOM 0 H ASN A 7 16.751 -5.561 -9.122 1.00 0.00 H new ATOM 0 HA ASN A 7 14.707 -6.256 -11.047 1.00 0.00 H new ATOM 0 HB2 ASN A 7 15.872 -8.429 -10.330 1.00 0.00 H new ATOM 0 HB3 ASN A 7 15.299 -8.107 -8.705 1.00 0.00 H new ATOM 0 HD21 ASN A 7 12.225 -8.554 -11.455 1.00 0.00 H new ATOM 0 HD22 ASN A 7 13.508 -7.367 -11.712 1.00 0.00 H new ATOM 104 N ALA A 8 14.450 -5.947 -7.747 1.00 0.00 N ATOM 105 CA ALA A 8 13.487 -5.580 -6.712 1.00 0.00 C ATOM 106 C ALA A 8 12.207 -6.329 -7.014 1.00 0.00 C ATOM 107 O ALA A 8 12.213 -7.245 -7.835 1.00 0.00 O ATOM 108 CB ALA A 8 13.249 -4.073 -6.655 1.00 0.00 C ATOM 0 H ALA A 8 15.295 -6.395 -7.393 1.00 0.00 H new ATOM 0 HA ALA A 8 13.873 -5.852 -5.730 1.00 0.00 H new ATOM 0 HB1 ALA A 8 12.526 -3.848 -5.871 1.00 0.00 H new ATOM 0 HB2 ALA A 8 14.188 -3.564 -6.439 1.00 0.00 H new ATOM 0 HB3 ALA A 8 12.862 -3.729 -7.614 1.00 0.00 H new ATOM 114 N LEU A 9 11.116 -6.007 -6.370 1.00 0.00 N ATOM 115 CA LEU A 9 9.887 -6.626 -6.789 1.00 0.00 C ATOM 116 C LEU A 9 9.464 -5.962 -8.089 1.00 0.00 C ATOM 117 O LEU A 9 9.397 -4.735 -8.179 1.00 0.00 O ATOM 118 CB LEU A 9 8.795 -6.621 -5.687 1.00 0.00 C ATOM 119 CG LEU A 9 8.297 -5.279 -5.135 1.00 0.00 C ATOM 120 CD1 LEU A 9 7.414 -4.549 -6.126 1.00 0.00 C ATOM 121 CD2 LEU A 9 7.534 -5.500 -3.840 1.00 0.00 C ATOM 0 H LEU A 9 11.050 -5.352 -5.591 1.00 0.00 H new ATOM 0 HA LEU A 9 10.043 -7.690 -6.968 1.00 0.00 H new ATOM 0 HB2 LEU A 9 7.930 -7.156 -6.079 1.00 0.00 H new ATOM 0 HB3 LEU A 9 9.174 -7.202 -4.846 1.00 0.00 H new ATOM 0 HG LEU A 9 9.174 -4.659 -4.949 1.00 0.00 H new ATOM 0 HD11 LEU A 9 7.085 -3.605 -5.693 1.00 0.00 H new ATOM 0 HD12 LEU A 9 7.976 -4.353 -7.039 1.00 0.00 H new ATOM 0 HD13 LEU A 9 6.545 -5.163 -6.360 1.00 0.00 H new ATOM 0 HD21 LEU A 9 7.184 -4.542 -3.456 1.00 0.00 H new ATOM 0 HD22 LEU A 9 6.679 -6.149 -4.028 1.00 0.00 H new ATOM 0 HD23 LEU A 9 8.190 -5.968 -3.106 1.00 0.00 H new ATOM 133 N PRO A 10 9.312 -6.761 -9.156 1.00 0.00 N ATOM 134 CA PRO A 10 8.843 -6.256 -10.441 1.00 0.00 C ATOM 135 C PRO A 10 7.554 -5.484 -10.245 1.00 0.00 C ATOM 136 O PRO A 10 6.804 -5.785 -9.316 1.00 0.00 O ATOM 137 CB PRO A 10 8.607 -7.526 -11.261 1.00 0.00 C ATOM 138 CG PRO A 10 9.524 -8.537 -10.663 1.00 0.00 C ATOM 139 CD PRO A 10 9.601 -8.206 -9.197 1.00 0.00 C ATOM 0 HA PRO A 10 9.542 -5.574 -10.926 1.00 0.00 H new ATOM 0 HB2 PRO A 10 7.568 -7.849 -11.201 1.00 0.00 H new ATOM 0 HB3 PRO A 10 8.830 -7.364 -12.316 1.00 0.00 H new ATOM 0 HG2 PRO A 10 9.145 -9.547 -10.816 1.00 0.00 H new ATOM 0 HG3 PRO A 10 10.510 -8.493 -11.126 1.00 0.00 H new ATOM 0 HD2 PRO A 10 8.876 -8.777 -8.618 1.00 0.00 H new ATOM 0 HD3 PRO A 10 10.585 -8.431 -8.786 1.00 0.00 H new ATOM 147 N ASP A 11 7.293 -4.510 -11.112 1.00 0.00 N ATOM 148 CA ASP A 11 6.162 -3.613 -10.919 1.00 0.00 C ATOM 149 C ASP A 11 4.898 -4.420 -10.732 1.00 0.00 C ATOM 150 O ASP A 11 4.423 -5.096 -11.649 1.00 0.00 O ATOM 151 CB ASP A 11 5.980 -2.656 -12.099 1.00 0.00 C ATOM 152 CG ASP A 11 7.159 -1.729 -12.311 1.00 0.00 C ATOM 153 OD1 ASP A 11 7.360 -0.814 -11.490 1.00 0.00 O ATOM 154 OD2 ASP A 11 7.876 -1.890 -13.322 1.00 0.00 O ATOM 0 H ASP A 11 7.846 -4.324 -11.949 1.00 0.00 H new ATOM 0 HA ASP A 11 6.366 -3.015 -10.030 1.00 0.00 H new ATOM 0 HB2 ASP A 11 5.817 -3.237 -13.007 1.00 0.00 H new ATOM 0 HB3 ASP A 11 5.083 -2.059 -11.937 1.00 0.00 H new ATOM 159 N ILE A 12 4.362 -4.341 -9.533 1.00 0.00 N ATOM 160 CA ILE A 12 3.239 -5.156 -9.151 1.00 0.00 C ATOM 161 C ILE A 12 1.990 -4.320 -9.176 1.00 0.00 C ATOM 162 O ILE A 12 1.913 -3.272 -8.551 1.00 0.00 O ATOM 163 CB ILE A 12 3.456 -5.752 -7.733 1.00 0.00 C ATOM 164 CG1 ILE A 12 4.331 -7.004 -7.817 1.00 0.00 C ATOM 165 CG2 ILE A 12 2.139 -6.062 -7.021 1.00 0.00 C ATOM 166 CD1 ILE A 12 3.754 -8.098 -8.693 1.00 0.00 C ATOM 0 H ILE A 12 4.694 -3.712 -8.802 1.00 0.00 H new ATOM 0 HA ILE A 12 3.139 -5.981 -9.856 1.00 0.00 H new ATOM 0 HB ILE A 12 3.966 -4.995 -7.137 1.00 0.00 H new ATOM 0 HG12 ILE A 12 5.312 -6.725 -8.200 1.00 0.00 H new ATOM 0 HG13 ILE A 12 4.482 -7.398 -6.812 1.00 0.00 H new ATOM 0 HG21 ILE A 12 2.347 -6.476 -6.035 1.00 0.00 H new ATOM 0 HG22 ILE A 12 1.558 -5.146 -6.915 1.00 0.00 H new ATOM 0 HG23 ILE A 12 1.571 -6.786 -7.606 1.00 0.00 H new ATOM 0 HD11 ILE A 12 4.431 -8.952 -8.702 1.00 0.00 H new ATOM 0 HD12 ILE A 12 2.786 -8.407 -8.299 1.00 0.00 H new ATOM 0 HD13 ILE A 12 3.629 -7.723 -9.709 1.00 0.00 H new ATOM 178 N THR A 13 1.019 -4.781 -9.916 1.00 0.00 N ATOM 179 CA THR A 13 -0.232 -4.105 -9.988 1.00 0.00 C ATOM 180 C THR A 13 -1.326 -5.020 -9.506 1.00 0.00 C ATOM 181 O THR A 13 -1.384 -6.193 -9.876 1.00 0.00 O ATOM 182 CB THR A 13 -0.518 -3.640 -11.423 1.00 0.00 C ATOM 183 OG1 THR A 13 0.256 -4.417 -12.349 1.00 0.00 O ATOM 184 CG2 THR A 13 -0.200 -2.162 -11.592 1.00 0.00 C ATOM 0 H THR A 13 1.079 -5.629 -10.479 1.00 0.00 H new ATOM 0 HA THR A 13 -0.193 -3.222 -9.350 1.00 0.00 H new ATOM 0 HB THR A 13 -1.579 -3.785 -11.626 1.00 0.00 H new ATOM 0 HG1 THR A 13 0.069 -4.118 -13.263 1.00 0.00 H new ATOM 0 HG21 THR A 13 -0.412 -1.859 -12.617 1.00 0.00 H new ATOM 0 HG22 THR A 13 -0.814 -1.577 -10.907 1.00 0.00 H new ATOM 0 HG23 THR A 13 0.854 -1.989 -11.373 1.00 0.00 H new ATOM 192 N LYS A 14 -2.163 -4.495 -8.651 1.00 0.00 N ATOM 193 CA LYS A 14 -3.310 -5.223 -8.180 1.00 0.00 C ATOM 194 C LYS A 14 -4.532 -4.379 -8.402 1.00 0.00 C ATOM 195 O LYS A 14 -4.572 -3.221 -8.003 1.00 0.00 O ATOM 196 CB LYS A 14 -3.137 -5.590 -6.705 1.00 0.00 C ATOM 197 CG LYS A 14 -2.248 -6.809 -6.520 1.00 0.00 C ATOM 198 CD LYS A 14 -2.923 -8.069 -7.044 1.00 0.00 C ATOM 199 CE LYS A 14 -1.914 -9.088 -7.553 1.00 0.00 C ATOM 200 NZ LYS A 14 -1.400 -8.731 -8.903 1.00 0.00 N ATOM 0 H LYS A 14 -2.070 -3.556 -8.264 1.00 0.00 H new ATOM 0 HA LYS A 14 -3.419 -6.157 -8.731 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -2.707 -4.744 -6.169 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -4.114 -5.784 -6.263 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -1.303 -6.656 -7.042 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -2.012 -6.933 -5.463 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -3.521 -8.517 -6.250 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -3.609 -7.805 -7.849 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -1.081 -9.155 -6.853 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -2.379 -10.073 -7.590 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -0.401 -9.010 -8.979 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -1.955 -9.229 -9.628 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -1.485 -7.704 -9.046 1.00 0.00 H new ATOM 214 N SER A 15 -5.531 -4.951 -9.019 1.00 0.00 N ATOM 215 CA SER A 15 -6.664 -4.177 -9.419 1.00 0.00 C ATOM 216 C SER A 15 -7.929 -4.735 -8.819 1.00 0.00 C ATOM 217 O SER A 15 -8.153 -5.948 -8.774 1.00 0.00 O ATOM 218 CB SER A 15 -6.773 -4.183 -10.931 1.00 0.00 C ATOM 219 OG SER A 15 -5.490 -4.261 -11.537 1.00 0.00 O ATOM 0 H SER A 15 -5.579 -5.943 -9.252 1.00 0.00 H new ATOM 0 HA SER A 15 -6.532 -3.155 -9.063 1.00 0.00 H new ATOM 0 HB2 SER A 15 -7.382 -5.029 -11.251 1.00 0.00 H new ATOM 0 HB3 SER A 15 -7.282 -3.279 -11.265 1.00 0.00 H new ATOM 0 HG SER A 15 -5.588 -4.265 -12.512 1.00 0.00 H new ATOM 225 N ILE A 16 -8.724 -3.823 -8.340 1.00 0.00 N ATOM 226 CA ILE A 16 -9.995 -4.111 -7.757 1.00 0.00 C ATOM 227 C ILE A 16 -10.895 -2.913 -7.920 1.00 0.00 C ATOM 228 O ILE A 16 -10.434 -1.774 -7.936 1.00 0.00 O ATOM 229 CB ILE A 16 -9.880 -4.469 -6.267 1.00 0.00 C ATOM 230 CG1 ILE A 16 -11.266 -4.398 -5.619 1.00 0.00 C ATOM 231 CG2 ILE A 16 -8.864 -3.579 -5.563 1.00 0.00 C ATOM 232 CD1 ILE A 16 -11.420 -3.411 -4.493 1.00 0.00 C ATOM 0 H ILE A 16 -8.495 -2.829 -8.346 1.00 0.00 H new ATOM 0 HA ILE A 16 -10.412 -4.977 -8.271 1.00 0.00 H new ATOM 0 HB ILE A 16 -9.510 -5.490 -6.167 1.00 0.00 H new ATOM 0 HG12 ILE A 16 -11.994 -4.153 -6.392 1.00 0.00 H new ATOM 0 HG13 ILE A 16 -11.521 -5.389 -5.244 1.00 0.00 H new ATOM 0 HG21 ILE A 16 -8.805 -3.856 -4.511 1.00 0.00 H new ATOM 0 HG22 ILE A 16 -7.886 -3.706 -6.027 1.00 0.00 H new ATOM 0 HG23 ILE A 16 -9.173 -2.537 -5.647 1.00 0.00 H new ATOM 0 HD11 ILE A 16 -12.441 -3.449 -4.113 1.00 0.00 H new ATOM 0 HD12 ILE A 16 -10.725 -3.662 -3.692 1.00 0.00 H new ATOM 0 HD13 ILE A 16 -11.206 -2.406 -4.858 1.00 0.00 H new ATOM 244 N THR A 17 -12.165 -3.159 -8.046 1.00 0.00 N ATOM 245 CA THR A 17 -13.103 -2.082 -8.040 1.00 0.00 C ATOM 246 C THR A 17 -13.635 -1.905 -6.631 1.00 0.00 C ATOM 247 O THR A 17 -14.253 -2.810 -6.068 1.00 0.00 O ATOM 248 CB THR A 17 -14.268 -2.363 -8.990 1.00 0.00 C ATOM 249 OG1 THR A 17 -13.777 -2.601 -10.316 1.00 0.00 O ATOM 250 CG2 THR A 17 -15.237 -1.201 -8.998 1.00 0.00 C ATOM 0 H THR A 17 -12.571 -4.089 -8.153 1.00 0.00 H new ATOM 0 HA THR A 17 -12.600 -1.175 -8.375 1.00 0.00 H new ATOM 0 HB THR A 17 -14.793 -3.252 -8.641 1.00 0.00 H new ATOM 0 HG1 THR A 17 -14.530 -2.782 -10.916 1.00 0.00 H new ATOM 0 HG21 THR A 17 -16.060 -1.418 -9.679 1.00 0.00 H new ATOM 0 HG22 THR A 17 -15.629 -1.047 -7.993 1.00 0.00 H new ATOM 0 HG23 THR A 17 -14.721 -0.299 -9.328 1.00 0.00 H new ATOM 258 N LEU A 18 -13.406 -0.734 -6.068 1.00 0.00 N ATOM 259 CA LEU A 18 -13.898 -0.420 -4.763 1.00 0.00 C ATOM 260 C LEU A 18 -15.225 0.203 -4.978 1.00 0.00 C ATOM 261 O LEU A 18 -15.299 1.298 -5.514 1.00 0.00 O ATOM 262 CB LEU A 18 -12.998 0.599 -4.054 1.00 0.00 C ATOM 263 CG LEU A 18 -11.534 0.222 -3.932 1.00 0.00 C ATOM 264 CD1 LEU A 18 -10.696 1.440 -3.599 1.00 0.00 C ATOM 265 CD2 LEU A 18 -11.342 -0.834 -2.864 1.00 0.00 C ATOM 0 H LEU A 18 -12.874 0.016 -6.510 1.00 0.00 H new ATOM 0 HA LEU A 18 -13.935 -1.317 -4.145 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -13.065 1.547 -4.588 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -13.394 0.769 -3.053 1.00 0.00 H new ATOM 0 HG LEU A 18 -11.210 -0.181 -4.891 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -9.649 1.149 -3.516 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -10.804 2.183 -4.389 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -11.031 1.865 -2.653 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -10.285 -1.091 -2.792 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -11.688 -0.449 -1.905 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -11.915 -1.724 -3.125 1.00 0.00 H new ATOM 277 N GLU A 19 -16.287 -0.469 -4.651 1.00 0.00 N ATOM 278 CA GLU A 19 -17.533 0.199 -4.794 1.00 0.00 C ATOM 279 C GLU A 19 -17.632 1.186 -3.649 1.00 0.00 C ATOM 280 O GLU A 19 -18.183 0.891 -2.598 1.00 0.00 O ATOM 281 CB GLU A 19 -18.638 -0.846 -4.739 1.00 0.00 C ATOM 282 CG GLU A 19 -18.217 -2.093 -3.968 1.00 0.00 C ATOM 283 CD GLU A 19 -19.320 -3.118 -3.858 1.00 0.00 C ATOM 284 OE1 GLU A 19 -20.121 -3.032 -2.906 1.00 0.00 O ATOM 285 OE2 GLU A 19 -19.392 -4.017 -4.722 1.00 0.00 O ATOM 0 H GLU A 19 -16.316 -1.427 -4.302 1.00 0.00 H new ATOM 0 HA GLU A 19 -17.623 0.734 -5.739 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -19.522 -0.413 -4.270 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -18.920 -1.127 -5.754 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -17.356 -2.545 -4.461 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -17.896 -1.804 -2.967 1.00 0.00 H new ATOM 292 N ALA A 20 -17.102 2.372 -3.891 1.00 0.00 N ATOM 293 CA ALA A 20 -17.072 3.417 -2.892 1.00 0.00 C ATOM 294 C ALA A 20 -16.983 4.771 -3.557 1.00 0.00 C ATOM 295 O ALA A 20 -16.677 4.860 -4.732 1.00 0.00 O ATOM 296 CB ALA A 20 -15.896 3.207 -1.956 1.00 0.00 C ATOM 0 H ALA A 20 -16.683 2.634 -4.783 1.00 0.00 H new ATOM 0 HA ALA A 20 -17.993 3.377 -2.310 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -15.881 3.999 -1.207 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -15.993 2.241 -1.461 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -14.968 3.231 -2.527 1.00 0.00 H new ATOM 302 N PRO A 21 -17.201 5.847 -2.824 1.00 0.00 N ATOM 303 CA PRO A 21 -16.873 7.173 -3.313 1.00 0.00 C ATOM 304 C PRO A 21 -15.387 7.461 -3.101 1.00 0.00 C ATOM 305 O PRO A 21 -14.755 6.832 -2.242 1.00 0.00 O ATOM 306 CB PRO A 21 -17.726 8.069 -2.437 1.00 0.00 C ATOM 307 CG PRO A 21 -17.781 7.341 -1.134 1.00 0.00 C ATOM 308 CD PRO A 21 -17.765 5.873 -1.468 1.00 0.00 C ATOM 0 HA PRO A 21 -17.059 7.309 -4.378 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -17.283 9.058 -2.325 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -18.721 8.211 -2.859 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -16.931 7.606 -0.505 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -18.682 7.604 -0.580 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -17.153 5.306 -0.766 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -18.766 5.442 -1.439 1.00 0.00 H new ATOM 316 N ILE A 22 -14.831 8.404 -3.854 1.00 0.00 N ATOM 317 CA ILE A 22 -13.405 8.739 -3.742 1.00 0.00 C ATOM 318 C ILE A 22 -13.036 9.087 -2.300 1.00 0.00 C ATOM 319 O ILE A 22 -11.945 8.793 -1.826 1.00 0.00 O ATOM 320 CB ILE A 22 -13.033 9.908 -4.690 1.00 0.00 C ATOM 321 CG1 ILE A 22 -11.573 10.320 -4.497 1.00 0.00 C ATOM 322 CG2 ILE A 22 -13.961 11.095 -4.488 1.00 0.00 C ATOM 323 CD1 ILE A 22 -11.091 11.371 -5.473 1.00 0.00 C ATOM 0 H ILE A 22 -15.339 8.952 -4.548 1.00 0.00 H new ATOM 0 HA ILE A 22 -12.834 7.860 -4.040 1.00 0.00 H new ATOM 0 HB ILE A 22 -13.156 9.559 -5.715 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -11.445 10.696 -3.482 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -10.942 9.436 -4.591 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -13.676 11.899 -5.166 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -14.988 10.793 -4.694 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -13.886 11.445 -3.458 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -10.047 11.607 -5.268 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -11.184 10.992 -6.491 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -11.694 12.272 -5.364 1.00 0.00 H new ATOM 335 N GLN A 23 -13.996 9.662 -1.616 1.00 0.00 N ATOM 336 CA GLN A 23 -13.856 10.133 -0.246 1.00 0.00 C ATOM 337 C GLN A 23 -13.689 9.007 0.797 1.00 0.00 C ATOM 338 O GLN A 23 -13.043 9.209 1.823 1.00 0.00 O ATOM 339 CB GLN A 23 -15.064 10.982 0.061 1.00 0.00 C ATOM 340 CG GLN A 23 -16.329 10.235 -0.225 1.00 0.00 C ATOM 341 CD GLN A 23 -17.460 11.137 -0.679 1.00 0.00 C ATOM 342 OE1 GLN A 23 -17.235 12.155 -1.331 1.00 0.00 O ATOM 343 NE2 GLN A 23 -18.679 10.778 -0.319 1.00 0.00 N ATOM 0 H GLN A 23 -14.926 9.823 -2.003 1.00 0.00 H new ATOM 0 HA GLN A 23 -12.932 10.707 -0.173 1.00 0.00 H new ATOM 0 HB2 GLN A 23 -15.044 11.284 1.108 1.00 0.00 H new ATOM 0 HB3 GLN A 23 -15.033 11.894 -0.535 1.00 0.00 H new ATOM 0 HG2 GLN A 23 -16.137 9.487 -0.994 1.00 0.00 H new ATOM 0 HG3 GLN A 23 -16.638 9.698 0.672 1.00 0.00 H new ATOM 0 HE21 GLN A 23 -18.821 9.925 0.222 1.00 0.00 H new ATOM 0 HE22 GLN A 23 -19.479 11.354 -0.582 1.00 0.00 H new ATOM 352 N LYS A 24 -14.277 7.836 0.579 1.00 0.00 N ATOM 353 CA LYS A 24 -14.106 6.757 1.552 1.00 0.00 C ATOM 354 C LYS A 24 -12.783 6.039 1.322 1.00 0.00 C ATOM 355 O LYS A 24 -12.083 5.660 2.258 1.00 0.00 O ATOM 356 CB LYS A 24 -15.264 5.762 1.489 1.00 0.00 C ATOM 357 CG LYS A 24 -16.492 6.207 2.262 1.00 0.00 C ATOM 358 CD LYS A 24 -17.536 5.108 2.310 1.00 0.00 C ATOM 359 CE LYS A 24 -18.663 5.438 3.271 1.00 0.00 C ATOM 360 NZ LYS A 24 -19.660 4.337 3.338 1.00 0.00 N ATOM 0 H LYS A 24 -14.856 7.611 -0.230 1.00 0.00 H new ATOM 0 HA LYS A 24 -14.099 7.204 2.546 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -15.539 5.604 0.446 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -14.928 4.801 1.879 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -16.206 6.485 3.276 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -16.917 7.096 1.795 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -17.945 4.952 1.312 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -17.064 4.173 2.611 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -18.254 5.621 4.265 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -19.155 6.358 2.955 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -20.606 4.712 3.126 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -19.415 3.604 2.643 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -19.657 3.924 4.292 1.00 0.00 H new ATOM 374 N VAL A 25 -12.429 5.898 0.066 1.00 0.00 N ATOM 375 CA VAL A 25 -11.094 5.477 -0.318 1.00 0.00 C ATOM 376 C VAL A 25 -10.072 6.513 0.157 1.00 0.00 C ATOM 377 O VAL A 25 -8.948 6.182 0.507 1.00 0.00 O ATOM 378 CB VAL A 25 -10.981 5.235 -1.834 1.00 0.00 C ATOM 379 CG1 VAL A 25 -9.697 4.480 -2.136 1.00 0.00 C ATOM 380 CG2 VAL A 25 -12.200 4.466 -2.346 1.00 0.00 C ATOM 0 H VAL A 25 -13.055 6.071 -0.721 1.00 0.00 H new ATOM 0 HA VAL A 25 -10.883 4.523 0.165 1.00 0.00 H new ATOM 0 HB VAL A 25 -10.952 6.195 -2.349 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -9.619 4.310 -3.210 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -8.842 5.066 -1.799 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -9.708 3.522 -1.617 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -12.103 4.304 -3.420 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -12.263 3.504 -1.838 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -13.104 5.042 -2.146 1.00 0.00 H new ATOM 390 N TRP A 26 -10.484 7.769 0.141 1.00 0.00 N ATOM 391 CA TRP A 26 -9.697 8.885 0.679 1.00 0.00 C ATOM 392 C TRP A 26 -9.334 8.607 2.115 1.00 0.00 C ATOM 393 O TRP A 26 -8.220 8.860 2.543 1.00 0.00 O ATOM 394 CB TRP A 26 -10.595 10.108 0.669 1.00 0.00 C ATOM 395 CG TRP A 26 -9.955 11.435 0.486 1.00 0.00 C ATOM 396 CD1 TRP A 26 -9.043 12.083 1.266 1.00 0.00 C ATOM 397 CD2 TRP A 26 -10.275 12.300 -0.574 1.00 0.00 C ATOM 398 NE1 TRP A 26 -8.770 13.322 0.717 1.00 0.00 N ATOM 399 CE2 TRP A 26 -9.526 13.470 -0.425 1.00 0.00 C ATOM 400 CE3 TRP A 26 -11.135 12.165 -1.646 1.00 0.00 C ATOM 401 CZ2 TRP A 26 -9.625 14.523 -1.336 1.00 0.00 C ATOM 402 CZ3 TRP A 26 -11.242 13.184 -2.545 1.00 0.00 C ATOM 403 CH2 TRP A 26 -10.491 14.362 -2.395 1.00 0.00 C ATOM 0 H TRP A 26 -11.383 8.054 -0.248 1.00 0.00 H new ATOM 0 HA TRP A 26 -8.792 9.027 0.088 1.00 0.00 H new ATOM 0 HB2 TRP A 26 -11.329 9.978 -0.126 1.00 0.00 H new ATOM 0 HB3 TRP A 26 -11.144 10.128 1.610 1.00 0.00 H new ATOM 0 HD1 TRP A 26 -8.603 11.690 2.171 1.00 0.00 H new ATOM 0 HE1 TRP A 26 -8.119 14.010 1.094 1.00 0.00 H new ATOM 0 HE3 TRP A 26 -11.716 11.263 -1.771 1.00 0.00 H new ATOM 0 HZ2 TRP A 26 -9.046 15.427 -1.215 1.00 0.00 H new ATOM 0 HZ3 TRP A 26 -11.914 13.084 -3.385 1.00 0.00 H new ATOM 0 HH2 TRP A 26 -10.594 15.154 -3.122 1.00 0.00 H new ATOM 414 N GLU A 27 -10.314 8.115 2.842 1.00 0.00 N ATOM 415 CA GLU A 27 -10.135 7.644 4.202 1.00 0.00 C ATOM 416 C GLU A 27 -9.262 6.390 4.235 1.00 0.00 C ATOM 417 O GLU A 27 -8.650 6.068 5.253 1.00 0.00 O ATOM 418 CB GLU A 27 -11.497 7.343 4.813 1.00 0.00 C ATOM 419 CG GLU A 27 -11.469 7.131 6.316 1.00 0.00 C ATOM 420 CD GLU A 27 -10.926 8.338 7.051 1.00 0.00 C ATOM 421 OE1 GLU A 27 -11.253 9.477 6.655 1.00 0.00 O ATOM 422 OE2 GLU A 27 -10.179 8.159 8.031 1.00 0.00 O ATOM 0 H GLU A 27 -11.272 8.029 2.502 1.00 0.00 H new ATOM 0 HA GLU A 27 -9.634 8.421 4.779 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -12.175 8.166 4.585 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -11.907 6.451 4.339 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -12.477 6.915 6.670 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -10.856 6.260 6.548 1.00 0.00 H new ATOM 429 N THR A 28 -9.295 5.630 3.153 1.00 0.00 N ATOM 430 CA THR A 28 -8.658 4.328 3.122 1.00 0.00 C ATOM 431 C THR A 28 -7.272 4.221 2.423 1.00 0.00 C ATOM 432 O THR A 28 -6.657 3.175 2.508 1.00 0.00 O ATOM 433 CB THR A 28 -9.619 3.270 2.584 1.00 0.00 C ATOM 434 OG1 THR A 28 -10.917 3.471 3.163 1.00 0.00 O ATOM 435 CG2 THR A 28 -9.130 1.895 2.974 1.00 0.00 C ATOM 0 H THR A 28 -9.758 5.895 2.283 1.00 0.00 H new ATOM 0 HA THR A 28 -8.419 4.145 4.170 1.00 0.00 H new ATOM 0 HB THR A 28 -9.671 3.353 1.498 1.00 0.00 H new ATOM 0 HG1 THR A 28 -11.306 4.300 2.815 1.00 0.00 H new ATOM 0 HG21 THR A 28 -9.817 1.142 2.589 1.00 0.00 H new ATOM 0 HG22 THR A 28 -8.138 1.729 2.554 1.00 0.00 H new ATOM 0 HG23 THR A 28 -9.082 1.821 4.060 1.00 0.00 H new ATOM 443 N VAL A 29 -6.766 5.232 1.712 1.00 0.00 N ATOM 444 CA VAL A 29 -5.484 5.044 0.987 1.00 0.00 C ATOM 445 C VAL A 29 -4.464 6.168 1.206 1.00 0.00 C ATOM 446 O VAL A 29 -3.385 5.934 1.728 1.00 0.00 O ATOM 447 CB VAL A 29 -5.653 4.796 -0.537 1.00 0.00 C ATOM 448 CG1 VAL A 29 -6.415 3.522 -0.783 1.00 0.00 C ATOM 449 CG2 VAL A 29 -6.318 5.961 -1.245 1.00 0.00 C ATOM 0 H VAL A 29 -7.193 6.154 1.617 1.00 0.00 H new ATOM 0 HA VAL A 29 -5.086 4.137 1.441 1.00 0.00 H new ATOM 0 HB VAL A 29 -4.652 4.699 -0.957 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -6.524 3.365 -1.856 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -5.872 2.683 -0.346 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -7.401 3.594 -0.325 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -6.412 5.736 -2.307 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -7.308 6.127 -0.821 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -5.713 6.858 -1.117 1.00 0.00 H new ATOM 459 N SER A 30 -4.763 7.377 0.803 1.00 0.00 N ATOM 460 CA SER A 30 -3.787 8.449 0.950 1.00 0.00 C ATOM 461 C SER A 30 -4.084 9.238 2.204 1.00 0.00 C ATOM 462 O SER A 30 -4.437 10.416 2.156 1.00 0.00 O ATOM 463 CB SER A 30 -3.797 9.344 -0.275 1.00 0.00 C ATOM 464 OG SER A 30 -5.109 9.789 -0.563 1.00 0.00 O ATOM 0 H SER A 30 -5.650 7.649 0.379 1.00 0.00 H new ATOM 0 HA SER A 30 -2.789 8.019 1.040 1.00 0.00 H new ATOM 0 HB2 SER A 30 -3.146 10.202 -0.109 1.00 0.00 H new ATOM 0 HB3 SER A 30 -3.397 8.801 -1.131 1.00 0.00 H new ATOM 0 HG SER A 30 -5.476 10.253 0.218 1.00 0.00 H new ATOM 470 N THR A 31 -3.981 8.560 3.323 1.00 0.00 N ATOM 471 CA THR A 31 -4.541 9.056 4.547 1.00 0.00 C ATOM 472 C THR A 31 -3.859 8.432 5.759 1.00 0.00 C ATOM 473 O THR A 31 -2.853 7.740 5.630 1.00 0.00 O ATOM 474 CB THR A 31 -6.060 8.829 4.538 1.00 0.00 C ATOM 475 OG1 THR A 31 -6.672 9.194 5.783 1.00 0.00 O ATOM 476 CG2 THR A 31 -6.355 7.387 4.193 1.00 0.00 C ATOM 0 H THR A 31 -3.511 7.659 3.406 1.00 0.00 H new ATOM 0 HA THR A 31 -4.361 10.128 4.623 1.00 0.00 H new ATOM 0 HB THR A 31 -6.493 9.479 3.777 1.00 0.00 H new ATOM 0 HG1 THR A 31 -7.638 9.035 5.732 1.00 0.00 H new ATOM 0 HG21 THR A 31 -7.433 7.228 4.187 1.00 0.00 H new ATOM 0 HG22 THR A 31 -5.949 7.158 3.208 1.00 0.00 H new ATOM 0 HG23 THR A 31 -5.896 6.734 4.935 1.00 0.00 H new ATOM 484 N SER A 32 -4.388 8.750 6.917 1.00 0.00 N ATOM 485 CA SER A 32 -3.949 8.227 8.194 1.00 0.00 C ATOM 486 C SER A 32 -4.140 6.718 8.258 1.00 0.00 C ATOM 487 O SER A 32 -4.594 6.092 7.295 1.00 0.00 O ATOM 488 CB SER A 32 -4.704 8.877 9.341 1.00 0.00 C ATOM 489 OG SER A 32 -6.052 9.150 8.987 1.00 0.00 O ATOM 0 H SER A 32 -5.166 9.405 7.001 1.00 0.00 H new ATOM 0 HA SER A 32 -2.888 8.459 8.291 1.00 0.00 H new ATOM 0 HB2 SER A 32 -4.681 8.221 10.211 1.00 0.00 H new ATOM 0 HB3 SER A 32 -4.207 9.804 9.627 1.00 0.00 H new ATOM 0 HG SER A 32 -6.512 9.566 9.746 1.00 0.00 H new ATOM 495 N GLU A 33 -3.671 6.141 9.362 1.00 0.00 N ATOM 496 CA GLU A 33 -3.459 4.702 9.542 1.00 0.00 C ATOM 497 C GLU A 33 -4.648 3.846 9.093 1.00 0.00 C ATOM 498 O GLU A 33 -4.543 2.622 9.066 1.00 0.00 O ATOM 499 CB GLU A 33 -3.201 4.420 11.018 1.00 0.00 C ATOM 500 CG GLU A 33 -2.285 5.430 11.679 1.00 0.00 C ATOM 501 CD GLU A 33 -2.204 5.247 13.178 1.00 0.00 C ATOM 502 OE1 GLU A 33 -1.351 4.461 13.642 1.00 0.00 O ATOM 503 OE2 GLU A 33 -2.989 5.898 13.901 1.00 0.00 O ATOM 0 H GLU A 33 -3.418 6.682 10.189 1.00 0.00 H new ATOM 0 HA GLU A 33 -2.608 4.432 8.917 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -4.153 4.405 11.548 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -2.764 3.426 11.118 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -1.286 5.344 11.252 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -2.640 6.437 11.458 1.00 0.00 H new ATOM 510 N GLY A 34 -5.770 4.471 8.761 1.00 0.00 N ATOM 511 CA GLY A 34 -6.865 3.728 8.179 1.00 0.00 C ATOM 512 C GLY A 34 -6.431 3.030 6.907 1.00 0.00 C ATOM 513 O GLY A 34 -6.812 1.881 6.671 1.00 0.00 O ATOM 0 H GLY A 34 -5.939 5.469 8.884 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -7.231 2.992 8.895 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -7.693 4.403 7.963 1.00 0.00 H new ATOM 517 N ILE A 35 -5.631 3.707 6.076 1.00 0.00 N ATOM 518 CA ILE A 35 -5.042 3.058 4.938 1.00 0.00 C ATOM 519 C ILE A 35 -3.977 2.070 5.375 1.00 0.00 C ATOM 520 O ILE A 35 -3.835 0.974 4.831 1.00 0.00 O ATOM 521 CB ILE A 35 -4.462 4.059 3.931 1.00 0.00 C ATOM 522 CG1 ILE A 35 -3.584 3.347 2.898 1.00 0.00 C ATOM 523 CG2 ILE A 35 -3.694 5.168 4.620 1.00 0.00 C ATOM 524 CD1 ILE A 35 -2.107 3.473 3.188 1.00 0.00 C ATOM 0 H ILE A 35 -5.389 4.692 6.182 1.00 0.00 H new ATOM 0 HA ILE A 35 -5.842 2.517 4.432 1.00 0.00 H new ATOM 0 HB ILE A 35 -5.301 4.519 3.409 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -3.853 2.291 2.867 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -3.790 3.758 1.910 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -3.299 5.856 3.872 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -4.360 5.707 5.294 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -2.870 4.740 5.190 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -1.539 2.947 2.420 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -1.825 4.526 3.191 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -1.889 3.037 4.163 1.00 0.00 H new ATOM 536 N ALA A 36 -3.226 2.483 6.369 1.00 0.00 N ATOM 537 CA ALA A 36 -2.159 1.658 6.915 1.00 0.00 C ATOM 538 C ALA A 36 -2.684 0.293 7.369 1.00 0.00 C ATOM 539 O ALA A 36 -1.970 -0.699 7.302 1.00 0.00 O ATOM 540 CB ALA A 36 -1.465 2.377 8.053 1.00 0.00 C ATOM 0 H ALA A 36 -3.331 3.391 6.823 1.00 0.00 H new ATOM 0 HA ALA A 36 -1.431 1.481 6.123 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -0.670 1.747 8.450 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -1.039 3.311 7.687 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -2.186 2.591 8.842 1.00 0.00 H new ATOM 546 N LYS A 37 -3.925 0.263 7.842 1.00 0.00 N ATOM 547 CA LYS A 37 -4.541 -0.961 8.350 1.00 0.00 C ATOM 548 C LYS A 37 -4.415 -2.132 7.360 1.00 0.00 C ATOM 549 O LYS A 37 -3.994 -3.220 7.750 1.00 0.00 O ATOM 550 CB LYS A 37 -6.011 -0.708 8.689 1.00 0.00 C ATOM 551 CG LYS A 37 -6.605 -1.736 9.643 1.00 0.00 C ATOM 552 CD LYS A 37 -8.057 -1.427 9.964 1.00 0.00 C ATOM 553 CE LYS A 37 -8.585 -2.323 11.076 1.00 0.00 C ATOM 554 NZ LYS A 37 -7.887 -2.076 12.366 1.00 0.00 N ATOM 0 H LYS A 37 -4.532 1.082 7.885 1.00 0.00 H new ATOM 0 HA LYS A 37 -4.003 -1.245 9.254 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -6.107 0.283 9.132 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -6.592 -0.703 7.767 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -6.533 -2.729 9.199 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -6.024 -1.756 10.565 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -8.151 -0.383 10.261 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -8.665 -1.559 9.069 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -9.654 -2.152 11.203 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -8.461 -3.368 10.790 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -8.463 -2.447 13.149 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -6.964 -2.555 12.358 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -7.746 -1.054 12.494 1.00 0.00 H new ATOM 568 N TRP A 38 -4.775 -1.923 6.086 1.00 0.00 N ATOM 569 CA TRP A 38 -4.635 -2.991 5.088 1.00 0.00 C ATOM 570 C TRP A 38 -3.188 -3.077 4.600 1.00 0.00 C ATOM 571 O TRP A 38 -2.663 -4.172 4.402 1.00 0.00 O ATOM 572 CB TRP A 38 -5.625 -2.840 3.894 1.00 0.00 C ATOM 573 CG TRP A 38 -5.662 -1.475 3.278 1.00 0.00 C ATOM 574 CD1 TRP A 38 -6.236 -0.385 3.829 1.00 0.00 C ATOM 575 CD2 TRP A 38 -5.154 -1.046 1.989 1.00 0.00 C ATOM 576 NE1 TRP A 38 -6.051 0.698 3.018 1.00 0.00 N ATOM 577 CE2 TRP A 38 -5.397 0.322 1.892 1.00 0.00 C ATOM 578 CE3 TRP A 38 -4.502 -1.656 0.920 1.00 0.00 C ATOM 579 CZ2 TRP A 38 -5.006 1.081 0.792 1.00 0.00 C ATOM 580 CZ3 TRP A 38 -4.132 -0.885 -0.173 1.00 0.00 C ATOM 581 CH2 TRP A 38 -4.380 0.463 -0.218 1.00 0.00 C ATOM 0 H TRP A 38 -5.156 -1.047 5.729 1.00 0.00 H new ATOM 0 HA TRP A 38 -4.897 -3.926 5.582 1.00 0.00 H new ATOM 0 HB2 TRP A 38 -5.357 -3.564 3.124 1.00 0.00 H new ATOM 0 HB3 TRP A 38 -6.628 -3.096 4.237 1.00 0.00 H new ATOM 0 HD1 TRP A 38 -6.763 -0.371 4.771 1.00 0.00 H new ATOM 0 HE1 TRP A 38 -6.359 1.647 3.228 1.00 0.00 H new ATOM 0 HE3 TRP A 38 -4.287 -2.714 0.941 1.00 0.00 H new ATOM 0 HZ2 TRP A 38 -5.203 2.142 0.754 1.00 0.00 H new ATOM 0 HZ3 TRP A 38 -3.637 -1.358 -1.008 1.00 0.00 H new ATOM 0 HH2 TRP A 38 -4.066 1.034 -1.079 1.00 0.00 H new ATOM 592 N PHE A 39 -2.532 -1.931 4.463 1.00 0.00 N ATOM 593 CA PHE A 39 -1.156 -1.887 3.971 1.00 0.00 C ATOM 594 C PHE A 39 -0.189 -2.578 4.940 1.00 0.00 C ATOM 595 O PHE A 39 0.288 -3.683 4.674 1.00 0.00 O ATOM 596 CB PHE A 39 -0.730 -0.431 3.728 1.00 0.00 C ATOM 597 CG PHE A 39 0.688 -0.273 3.251 1.00 0.00 C ATOM 598 CD1 PHE A 39 1.038 -0.606 1.953 1.00 0.00 C ATOM 599 CD2 PHE A 39 1.667 0.214 4.101 1.00 0.00 C ATOM 600 CE1 PHE A 39 2.339 -0.457 1.512 1.00 0.00 C ATOM 601 CE2 PHE A 39 2.969 0.365 3.666 1.00 0.00 C ATOM 602 CZ PHE A 39 3.306 0.028 2.371 1.00 0.00 C ATOM 0 H PHE A 39 -2.929 -1.018 4.685 1.00 0.00 H new ATOM 0 HA PHE A 39 -1.117 -2.431 3.027 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -1.400 0.014 2.992 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -0.855 0.131 4.653 1.00 0.00 H new ATOM 0 HD1 PHE A 39 0.286 -0.986 1.278 1.00 0.00 H new ATOM 0 HD2 PHE A 39 1.409 0.479 5.116 1.00 0.00 H new ATOM 0 HE1 PHE A 39 2.599 -0.719 0.497 1.00 0.00 H new ATOM 0 HE2 PHE A 39 3.723 0.747 4.339 1.00 0.00 H new ATOM 0 HZ PHE A 39 4.324 0.143 2.030 1.00 0.00 H new ATOM 612 N MET A 40 0.059 -1.932 6.072 1.00 0.00 N ATOM 613 CA MET A 40 1.022 -2.402 7.063 1.00 0.00 C ATOM 614 C MET A 40 1.069 -1.388 8.205 1.00 0.00 C ATOM 615 O MET A 40 0.991 -0.186 7.953 1.00 0.00 O ATOM 616 CB MET A 40 2.411 -2.560 6.425 1.00 0.00 C ATOM 617 CG MET A 40 3.436 -3.209 7.339 1.00 0.00 C ATOM 618 SD MET A 40 4.966 -3.624 6.482 1.00 0.00 S ATOM 619 CE MET A 40 5.924 -4.325 7.824 1.00 0.00 C ATOM 0 H MET A 40 -0.405 -1.061 6.331 1.00 0.00 H new ATOM 0 HA MET A 40 0.719 -3.376 7.446 1.00 0.00 H new ATOM 0 HB2 MET A 40 2.318 -3.157 5.518 1.00 0.00 H new ATOM 0 HB3 MET A 40 2.776 -1.578 6.125 1.00 0.00 H new ATOM 0 HG2 MET A 40 3.659 -2.534 8.166 1.00 0.00 H new ATOM 0 HG3 MET A 40 3.010 -4.114 7.772 1.00 0.00 H new ATOM 0 HE1 MET A 40 6.902 -4.631 7.452 1.00 0.00 H new ATOM 0 HE2 MET A 40 6.052 -3.579 8.608 1.00 0.00 H new ATOM 0 HE3 MET A 40 5.402 -5.192 8.229 1.00 0.00 H new ATOM 629 N PRO A 41 1.150 -1.865 9.472 1.00 0.00 N ATOM 630 CA PRO A 41 1.165 -1.009 10.669 1.00 0.00 C ATOM 631 C PRO A 41 2.004 0.248 10.520 1.00 0.00 C ATOM 632 O PRO A 41 3.235 0.211 10.606 1.00 0.00 O ATOM 633 CB PRO A 41 1.790 -1.902 11.715 1.00 0.00 C ATOM 634 CG PRO A 41 1.354 -3.277 11.347 1.00 0.00 C ATOM 635 CD PRO A 41 1.211 -3.292 9.843 1.00 0.00 C ATOM 0 HA PRO A 41 0.163 -0.647 10.899 1.00 0.00 H new ATOM 0 HB2 PRO A 41 2.877 -1.817 11.711 1.00 0.00 H new ATOM 0 HB3 PRO A 41 1.453 -1.634 12.717 1.00 0.00 H new ATOM 0 HG2 PRO A 41 2.084 -4.017 11.675 1.00 0.00 H new ATOM 0 HG3 PRO A 41 0.409 -3.527 11.829 1.00 0.00 H new ATOM 0 HD2 PRO A 41 2.055 -3.792 9.367 1.00 0.00 H new ATOM 0 HD3 PRO A 41 0.311 -3.823 9.534 1.00 0.00 H new ATOM 643 N ASN A 42 1.320 1.346 10.291 1.00 0.00 N ATOM 644 CA ASN A 42 1.953 2.631 10.064 1.00 0.00 C ATOM 645 C ASN A 42 0.964 3.734 10.367 1.00 0.00 C ATOM 646 O ASN A 42 -0.229 3.475 10.470 1.00 0.00 O ATOM 647 CB ASN A 42 2.437 2.710 8.616 1.00 0.00 C ATOM 648 CG ASN A 42 3.240 3.965 8.322 1.00 0.00 C ATOM 649 OD1 ASN A 42 3.912 4.507 9.195 1.00 0.00 O ATOM 650 ND2 ASN A 42 3.183 4.430 7.083 1.00 0.00 N ATOM 0 H ASN A 42 0.301 1.376 10.256 1.00 0.00 H new ATOM 0 HA ASN A 42 2.815 2.748 10.721 1.00 0.00 H new ATOM 0 HB2 ASN A 42 3.049 1.835 8.396 1.00 0.00 H new ATOM 0 HB3 ASN A 42 1.576 2.673 7.949 1.00 0.00 H new ATOM 0 HD21 ASN A 42 3.709 5.266 6.827 1.00 0.00 H new ATOM 0 HD22 ASN A 42 2.613 3.952 6.385 1.00 0.00 H new ATOM 657 N ASP A 43 1.446 4.945 10.542 1.00 0.00 N ATOM 658 CA ASP A 43 0.580 6.094 10.584 1.00 0.00 C ATOM 659 C ASP A 43 0.872 6.988 9.392 1.00 0.00 C ATOM 660 O ASP A 43 1.140 8.177 9.536 1.00 0.00 O ATOM 661 CB ASP A 43 0.694 6.851 11.919 1.00 0.00 C ATOM 662 CG ASP A 43 2.034 7.509 12.160 1.00 0.00 C ATOM 663 OD1 ASP A 43 3.053 6.793 12.203 1.00 0.00 O ATOM 664 OD2 ASP A 43 2.060 8.750 12.330 1.00 0.00 O ATOM 0 H ASP A 43 2.437 5.156 10.658 1.00 0.00 H new ATOM 0 HA ASP A 43 -0.455 5.757 10.521 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -0.082 7.615 11.955 1.00 0.00 H new ATOM 0 HB3 ASP A 43 0.494 6.155 12.734 1.00 0.00 H new ATOM 669 N PHE A 44 0.859 6.370 8.199 1.00 0.00 N ATOM 670 CA PHE A 44 0.885 7.120 6.948 1.00 0.00 C ATOM 671 C PHE A 44 -0.016 8.341 7.046 1.00 0.00 C ATOM 672 O PHE A 44 -1.104 8.297 7.614 1.00 0.00 O ATOM 673 CB PHE A 44 0.424 6.259 5.758 1.00 0.00 C ATOM 674 CG PHE A 44 0.525 7.001 4.447 1.00 0.00 C ATOM 675 CD1 PHE A 44 1.651 7.746 4.175 1.00 0.00 C ATOM 676 CD2 PHE A 44 -0.497 6.981 3.506 1.00 0.00 C ATOM 677 CE1 PHE A 44 1.772 8.460 3.004 1.00 0.00 C ATOM 678 CE2 PHE A 44 -0.376 7.698 2.319 1.00 0.00 C ATOM 679 CZ PHE A 44 0.761 8.434 2.074 1.00 0.00 C ATOM 0 H PHE A 44 0.831 5.357 8.083 1.00 0.00 H new ATOM 0 HA PHE A 44 1.917 7.427 6.779 1.00 0.00 H new ATOM 0 HB2 PHE A 44 1.030 5.354 5.710 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -0.607 5.944 5.917 1.00 0.00 H new ATOM 0 HD1 PHE A 44 2.456 7.771 4.895 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -1.391 6.406 3.697 1.00 0.00 H new ATOM 0 HE1 PHE A 44 2.663 9.041 2.816 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -1.173 7.677 1.591 1.00 0.00 H new ATOM 0 HZ PHE A 44 0.858 8.990 1.153 1.00 0.00 H new ATOM 689 N GLN A 45 0.479 9.422 6.509 1.00 0.00 N ATOM 690 CA GLN A 45 -0.245 10.668 6.421 1.00 0.00 C ATOM 691 C GLN A 45 -0.001 11.149 5.024 1.00 0.00 C ATOM 692 O GLN A 45 1.124 10.998 4.547 1.00 0.00 O ATOM 693 CB GLN A 45 0.307 11.690 7.423 1.00 0.00 C ATOM 694 CG GLN A 45 0.246 11.239 8.871 1.00 0.00 C ATOM 695 CD GLN A 45 0.897 12.233 9.811 1.00 0.00 C ATOM 696 OE1 GLN A 45 2.094 12.159 10.084 1.00 0.00 O ATOM 697 NE2 GLN A 45 0.115 13.176 10.310 1.00 0.00 N ATOM 0 H GLN A 45 1.417 9.466 6.111 1.00 0.00 H new ATOM 0 HA GLN A 45 -1.304 10.539 6.647 1.00 0.00 H new ATOM 0 HB2 GLN A 45 1.343 11.910 7.166 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -0.251 12.620 7.320 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -0.795 11.096 9.161 1.00 0.00 H new ATOM 0 HG3 GLN A 45 0.740 10.272 8.969 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -0.873 13.204 10.060 1.00 0.00 H new ATOM 0 HE22 GLN A 45 0.500 13.875 10.945 1.00 0.00 H new ATOM 706 N LEU A 46 -0.986 11.694 4.328 1.00 0.00 N ATOM 707 CA LEU A 46 -0.699 12.054 2.963 1.00 0.00 C ATOM 708 C LEU A 46 0.178 13.296 2.976 1.00 0.00 C ATOM 709 O LEU A 46 -0.249 14.431 3.195 1.00 0.00 O ATOM 710 CB LEU A 46 -1.966 12.208 2.103 1.00 0.00 C ATOM 711 CG LEU A 46 -2.761 13.506 2.252 1.00 0.00 C ATOM 712 CD1 LEU A 46 -3.802 13.617 1.149 1.00 0.00 C ATOM 713 CD2 LEU A 46 -3.431 13.579 3.617 1.00 0.00 C ATOM 0 H LEU A 46 -1.930 11.885 4.663 1.00 0.00 H new ATOM 0 HA LEU A 46 -0.156 11.242 2.479 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -1.678 12.107 1.057 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -2.632 11.376 2.332 1.00 0.00 H new ATOM 0 HG LEU A 46 -2.066 14.342 2.167 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -4.360 14.546 1.268 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -3.306 13.613 0.179 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -4.487 12.772 1.209 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -3.990 14.511 3.698 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -4.112 12.736 3.734 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -2.671 13.542 4.398 1.00 0.00 H new ATOM 725 N LYS A 47 1.434 12.998 2.777 1.00 0.00 N ATOM 726 CA LYS A 47 2.533 13.919 2.863 1.00 0.00 C ATOM 727 C LYS A 47 3.376 13.724 1.647 1.00 0.00 C ATOM 728 O LYS A 47 3.285 12.693 1.037 1.00 0.00 O ATOM 729 CB LYS A 47 3.341 13.669 4.124 1.00 0.00 C ATOM 730 CG LYS A 47 2.807 14.423 5.321 1.00 0.00 C ATOM 731 CD LYS A 47 3.494 14.002 6.612 1.00 0.00 C ATOM 732 CE LYS A 47 2.932 14.734 7.821 1.00 0.00 C ATOM 733 NZ LYS A 47 3.185 16.198 7.760 1.00 0.00 N ATOM 0 H LYS A 47 1.733 12.053 2.537 1.00 0.00 H new ATOM 0 HA LYS A 47 2.169 14.945 2.911 1.00 0.00 H new ATOM 0 HB2 LYS A 47 3.342 12.601 4.344 1.00 0.00 H new ATOM 0 HB3 LYS A 47 4.377 13.960 3.950 1.00 0.00 H new ATOM 0 HG2 LYS A 47 2.947 15.493 5.168 1.00 0.00 H new ATOM 0 HG3 LYS A 47 1.734 14.252 5.409 1.00 0.00 H new ATOM 0 HD2 LYS A 47 3.376 12.927 6.752 1.00 0.00 H new ATOM 0 HD3 LYS A 47 4.563 14.198 6.534 1.00 0.00 H new ATOM 0 HE2 LYS A 47 1.859 14.555 7.885 1.00 0.00 H new ATOM 0 HE3 LYS A 47 3.378 14.328 8.729 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 2.892 16.639 8.655 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 4.199 16.369 7.606 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 2.641 16.612 6.976 1.00 0.00 H new ATOM 747 N GLU A 48 4.079 14.722 1.217 1.00 0.00 N ATOM 748 CA GLU A 48 4.966 14.555 0.081 1.00 0.00 C ATOM 749 C GLU A 48 6.395 14.928 0.421 1.00 0.00 C ATOM 750 O GLU A 48 6.650 15.987 0.990 1.00 0.00 O ATOM 751 CB GLU A 48 4.453 15.305 -1.122 1.00 0.00 C ATOM 752 CG GLU A 48 3.352 14.569 -1.844 1.00 0.00 C ATOM 753 CD GLU A 48 2.598 15.488 -2.773 1.00 0.00 C ATOM 754 OE1 GLU A 48 1.776 16.293 -2.290 1.00 0.00 O ATOM 755 OE2 GLU A 48 2.848 15.425 -3.993 1.00 0.00 O ATOM 0 H GLU A 48 4.066 15.658 1.622 1.00 0.00 H new ATOM 0 HA GLU A 48 4.977 13.496 -0.177 1.00 0.00 H new ATOM 0 HB2 GLU A 48 4.085 16.281 -0.806 1.00 0.00 H new ATOM 0 HB3 GLU A 48 5.278 15.483 -1.812 1.00 0.00 H new ATOM 0 HG2 GLU A 48 3.776 13.742 -2.413 1.00 0.00 H new ATOM 0 HG3 GLU A 48 2.663 14.137 -1.118 1.00 0.00 H new ATOM 762 N GLY A 49 7.308 14.038 0.076 1.00 0.00 N ATOM 763 CA GLY A 49 8.724 14.243 0.338 1.00 0.00 C ATOM 764 C GLY A 49 8.990 14.521 1.799 1.00 0.00 C ATOM 765 O GLY A 49 9.786 15.385 2.158 1.00 0.00 O ATOM 0 H GLY A 49 7.092 13.157 -0.391 1.00 0.00 H new ATOM 0 HA2 GLY A 49 9.282 13.360 0.029 1.00 0.00 H new ATOM 0 HA3 GLY A 49 9.088 15.077 -0.263 1.00 0.00 H new ATOM 769 N GLN A 50 8.277 13.793 2.626 1.00 0.00 N ATOM 770 CA GLN A 50 8.285 13.953 4.050 1.00 0.00 C ATOM 771 C GLN A 50 9.017 12.781 4.634 1.00 0.00 C ATOM 772 O GLN A 50 9.363 11.856 3.905 1.00 0.00 O ATOM 773 CB GLN A 50 6.839 13.978 4.544 1.00 0.00 C ATOM 774 CG GLN A 50 6.290 12.606 4.852 1.00 0.00 C ATOM 775 CD GLN A 50 6.258 11.758 3.620 1.00 0.00 C ATOM 776 OE1 GLN A 50 6.519 10.573 3.668 1.00 0.00 O ATOM 777 NE2 GLN A 50 5.925 12.372 2.500 1.00 0.00 N ATOM 0 H GLN A 50 7.656 13.049 2.309 1.00 0.00 H new ATOM 0 HA GLN A 50 8.775 14.880 4.347 1.00 0.00 H new ATOM 0 HB2 GLN A 50 6.779 14.595 5.440 1.00 0.00 H new ATOM 0 HB3 GLN A 50 6.212 14.451 3.788 1.00 0.00 H new ATOM 0 HG2 GLN A 50 6.905 12.126 5.614 1.00 0.00 H new ATOM 0 HG3 GLN A 50 5.285 12.696 5.264 1.00 0.00 H new ATOM 0 HE21 GLN A 50 5.714 13.370 2.509 1.00 0.00 H new ATOM 0 HE22 GLN A 50 5.879 11.849 1.626 1.00 0.00 H new ATOM 786 N GLU A 51 9.274 12.800 5.910 1.00 0.00 N ATOM 787 CA GLU A 51 9.604 11.565 6.559 1.00 0.00 C ATOM 788 C GLU A 51 8.661 11.343 7.733 1.00 0.00 C ATOM 789 O GLU A 51 8.492 12.220 8.577 1.00 0.00 O ATOM 790 CB GLU A 51 11.068 11.558 6.990 1.00 0.00 C ATOM 791 CG GLU A 51 12.024 11.696 5.815 1.00 0.00 C ATOM 792 CD GLU A 51 13.481 11.658 6.220 1.00 0.00 C ATOM 793 OE1 GLU A 51 14.010 12.697 6.653 1.00 0.00 O ATOM 794 OE2 GLU A 51 14.111 10.596 6.086 1.00 0.00 O ATOM 0 H GLU A 51 9.263 13.628 6.506 1.00 0.00 H new ATOM 0 HA GLU A 51 9.477 10.738 5.860 1.00 0.00 H new ATOM 0 HB2 GLU A 51 11.240 12.374 7.692 1.00 0.00 H new ATOM 0 HB3 GLU A 51 11.282 10.631 7.521 1.00 0.00 H new ATOM 0 HG2 GLU A 51 11.831 10.894 5.103 1.00 0.00 H new ATOM 0 HG3 GLU A 51 11.822 12.635 5.300 1.00 0.00 H new ATOM 801 N PHE A 52 8.042 10.170 7.779 1.00 0.00 N ATOM 802 CA PHE A 52 7.085 9.860 8.835 1.00 0.00 C ATOM 803 C PHE A 52 7.321 8.492 9.462 1.00 0.00 C ATOM 804 O PHE A 52 7.597 7.513 8.770 1.00 0.00 O ATOM 805 CB PHE A 52 5.630 10.005 8.364 1.00 0.00 C ATOM 806 CG PHE A 52 5.297 9.503 6.998 1.00 0.00 C ATOM 807 CD1 PHE A 52 5.861 8.367 6.462 1.00 0.00 C ATOM 808 CD2 PHE A 52 4.393 10.216 6.240 1.00 0.00 C ATOM 809 CE1 PHE A 52 5.532 7.956 5.192 1.00 0.00 C ATOM 810 CE2 PHE A 52 4.063 9.818 4.979 1.00 0.00 C ATOM 811 CZ PHE A 52 4.631 8.681 4.445 1.00 0.00 C ATOM 0 H PHE A 52 8.184 9.421 7.102 1.00 0.00 H new ATOM 0 HA PHE A 52 7.256 10.603 9.614 1.00 0.00 H new ATOM 0 HB2 PHE A 52 4.991 9.486 9.079 1.00 0.00 H new ATOM 0 HB3 PHE A 52 5.365 11.061 8.409 1.00 0.00 H new ATOM 0 HD1 PHE A 52 6.568 7.794 7.044 1.00 0.00 H new ATOM 0 HD2 PHE A 52 3.939 11.105 6.652 1.00 0.00 H new ATOM 0 HE1 PHE A 52 5.981 7.064 4.780 1.00 0.00 H new ATOM 0 HE2 PHE A 52 3.357 10.393 4.398 1.00 0.00 H new ATOM 0 HZ PHE A 52 4.371 8.361 3.447 1.00 0.00 H new ATOM 821 N HIS A 53 7.191 8.442 10.778 1.00 0.00 N ATOM 822 CA HIS A 53 7.441 7.233 11.555 1.00 0.00 C ATOM 823 C HIS A 53 6.377 7.118 12.643 1.00 0.00 C ATOM 824 O HIS A 53 5.795 8.125 13.034 1.00 0.00 O ATOM 825 CB HIS A 53 8.853 7.301 12.163 1.00 0.00 C ATOM 826 CG HIS A 53 9.271 6.083 12.933 1.00 0.00 C ATOM 827 ND1 HIS A 53 9.378 4.829 12.370 1.00 0.00 N ATOM 828 CD2 HIS A 53 9.609 5.938 14.235 1.00 0.00 C ATOM 829 CE1 HIS A 53 9.762 3.966 13.295 1.00 0.00 C ATOM 830 NE2 HIS A 53 9.908 4.616 14.433 1.00 0.00 N ATOM 0 H HIS A 53 6.907 9.243 11.343 1.00 0.00 H new ATOM 0 HA HIS A 53 7.387 6.350 10.918 1.00 0.00 H new ATOM 0 HB2 HIS A 53 9.570 7.469 11.360 1.00 0.00 H new ATOM 0 HB3 HIS A 53 8.906 8.166 12.824 1.00 0.00 H new ATOM 0 HD2 HIS A 53 9.638 6.719 14.980 1.00 0.00 H new ATOM 0 HE1 HIS A 53 9.928 2.909 13.144 1.00 0.00 H new ATOM 0 HE2 HIS A 53 10.197 4.201 15.319 1.00 0.00 H new ATOM 839 N LEU A 54 6.146 5.901 13.139 1.00 0.00 N ATOM 840 CA LEU A 54 5.039 5.624 14.069 1.00 0.00 C ATOM 841 C LEU A 54 5.234 6.266 15.448 1.00 0.00 C ATOM 842 O LEU A 54 4.543 5.914 16.403 1.00 0.00 O ATOM 843 CB LEU A 54 4.848 4.111 14.246 1.00 0.00 C ATOM 844 CG LEU A 54 4.332 3.348 13.020 1.00 0.00 C ATOM 845 CD1 LEU A 54 5.428 3.170 11.978 1.00 0.00 C ATOM 846 CD2 LEU A 54 3.771 1.999 13.442 1.00 0.00 C ATOM 0 H LEU A 54 6.713 5.084 12.913 1.00 0.00 H new ATOM 0 HA LEU A 54 4.152 6.069 13.619 1.00 0.00 H new ATOM 0 HB2 LEU A 54 5.803 3.677 14.543 1.00 0.00 H new ATOM 0 HB3 LEU A 54 4.153 3.947 15.070 1.00 0.00 H new ATOM 0 HG LEU A 54 3.535 3.935 12.565 1.00 0.00 H new ATOM 0 HD11 LEU A 54 5.031 2.626 11.121 1.00 0.00 H new ATOM 0 HD12 LEU A 54 5.784 4.148 11.653 1.00 0.00 H new ATOM 0 HD13 LEU A 54 6.255 2.609 12.412 1.00 0.00 H new ATOM 0 HD21 LEU A 54 3.407 1.465 12.564 1.00 0.00 H new ATOM 0 HD22 LEU A 54 4.554 1.414 13.924 1.00 0.00 H new ATOM 0 HD23 LEU A 54 2.949 2.150 14.141 1.00 0.00 H new ATOM 858 N GLN A 55 6.152 7.212 15.547 1.00 0.00 N ATOM 859 CA GLN A 55 6.447 7.880 16.805 1.00 0.00 C ATOM 860 C GLN A 55 6.673 9.363 16.547 1.00 0.00 C ATOM 861 O GLN A 55 6.968 9.744 15.412 1.00 0.00 O ATOM 862 CB GLN A 55 7.695 7.267 17.458 1.00 0.00 C ATOM 863 CG GLN A 55 7.540 5.800 17.825 1.00 0.00 C ATOM 864 CD GLN A 55 8.875 5.120 18.065 1.00 0.00 C ATOM 865 OE1 GLN A 55 9.475 4.571 17.140 1.00 0.00 O ATOM 866 NE2 GLN A 55 9.354 5.157 19.295 1.00 0.00 N ATOM 0 H GLN A 55 6.713 7.539 14.760 1.00 0.00 H new ATOM 0 HA GLN A 55 5.603 7.751 17.483 1.00 0.00 H new ATOM 0 HB2 GLN A 55 8.539 7.374 16.777 1.00 0.00 H new ATOM 0 HB3 GLN A 55 7.938 7.833 18.357 1.00 0.00 H new ATOM 0 HG2 GLN A 55 6.926 5.715 18.722 1.00 0.00 H new ATOM 0 HG3 GLN A 55 7.010 5.282 17.026 1.00 0.00 H new ATOM 0 HE21 GLN A 55 8.826 5.622 20.034 1.00 0.00 H new ATOM 0 HE22 GLN A 55 10.252 4.721 19.506 1.00 0.00 H new ATOM 875 N SER A 56 6.507 10.198 17.566 1.00 0.00 N ATOM 876 CA SER A 56 6.810 11.619 17.429 1.00 0.00 C ATOM 877 C SER A 56 8.280 11.802 17.020 1.00 0.00 C ATOM 878 O SER A 56 8.560 12.430 15.997 1.00 0.00 O ATOM 879 CB SER A 56 6.489 12.375 18.724 1.00 0.00 C ATOM 880 OG SER A 56 5.150 12.137 19.132 1.00 0.00 O ATOM 0 H SER A 56 6.168 9.921 18.487 1.00 0.00 H new ATOM 0 HA SER A 56 6.181 12.041 16.645 1.00 0.00 H new ATOM 0 HB2 SER A 56 7.174 12.062 19.512 1.00 0.00 H new ATOM 0 HB3 SER A 56 6.643 13.444 18.574 1.00 0.00 H new ATOM 0 HG SER A 56 4.968 12.628 19.961 1.00 0.00 H new ATOM 886 N PRO A 57 9.246 11.242 17.791 1.00 0.00 N ATOM 887 CA PRO A 57 10.640 11.183 17.362 1.00 0.00 C ATOM 888 C PRO A 57 10.808 10.176 16.232 1.00 0.00 C ATOM 889 O PRO A 57 10.642 8.970 16.431 1.00 0.00 O ATOM 890 CB PRO A 57 11.407 10.725 18.614 1.00 0.00 C ATOM 891 CG PRO A 57 10.432 10.828 19.738 1.00 0.00 C ATOM 892 CD PRO A 57 9.078 10.643 19.125 1.00 0.00 C ATOM 0 HA PRO A 57 11.000 12.139 16.981 1.00 0.00 H new ATOM 0 HB2 PRO A 57 11.769 9.703 18.501 1.00 0.00 H new ATOM 0 HB3 PRO A 57 12.279 11.354 18.792 1.00 0.00 H new ATOM 0 HG2 PRO A 57 10.626 10.067 20.494 1.00 0.00 H new ATOM 0 HG3 PRO A 57 10.508 11.796 20.233 1.00 0.00 H new ATOM 0 HD2 PRO A 57 8.800 9.591 19.065 1.00 0.00 H new ATOM 0 HD3 PRO A 57 8.300 11.145 19.700 1.00 0.00 H new ATOM 900 N PHE A 58 11.101 10.675 15.042 1.00 0.00 N ATOM 901 CA PHE A 58 11.220 9.818 13.873 1.00 0.00 C ATOM 902 C PHE A 58 12.462 8.949 13.958 1.00 0.00 C ATOM 903 O PHE A 58 12.476 7.824 13.455 1.00 0.00 O ATOM 904 CB PHE A 58 11.252 10.650 12.590 1.00 0.00 C ATOM 905 CG PHE A 58 10.034 11.507 12.399 1.00 0.00 C ATOM 906 CD1 PHE A 58 8.780 10.934 12.264 1.00 0.00 C ATOM 907 CD2 PHE A 58 10.145 12.886 12.360 1.00 0.00 C ATOM 908 CE1 PHE A 58 7.659 11.721 12.091 1.00 0.00 C ATOM 909 CE2 PHE A 58 9.029 13.678 12.188 1.00 0.00 C ATOM 910 CZ PHE A 58 7.784 13.095 12.052 1.00 0.00 C ATOM 0 H PHE A 58 11.260 11.666 14.860 1.00 0.00 H new ATOM 0 HA PHE A 58 10.344 9.169 13.849 1.00 0.00 H new ATOM 0 HB2 PHE A 58 12.136 11.287 12.602 1.00 0.00 H new ATOM 0 HB3 PHE A 58 11.353 9.981 11.735 1.00 0.00 H new ATOM 0 HD1 PHE A 58 8.678 9.859 12.294 1.00 0.00 H new ATOM 0 HD2 PHE A 58 11.116 13.347 12.465 1.00 0.00 H new ATOM 0 HE1 PHE A 58 6.687 11.263 11.986 1.00 0.00 H new ATOM 0 HE2 PHE A 58 9.128 14.753 12.160 1.00 0.00 H new ATOM 0 HZ PHE A 58 6.909 13.714 11.915 1.00 0.00 H new ATOM 920 N GLY A 59 13.491 9.466 14.618 1.00 0.00 N ATOM 921 CA GLY A 59 14.748 8.757 14.702 1.00 0.00 C ATOM 922 C GLY A 59 15.531 8.878 13.414 1.00 0.00 C ATOM 923 O GLY A 59 15.945 9.979 13.040 1.00 0.00 O ATOM 0 H GLY A 59 13.475 10.366 15.097 1.00 0.00 H new ATOM 0 HA2 GLY A 59 15.338 9.154 15.528 1.00 0.00 H new ATOM 0 HA3 GLY A 59 14.562 7.705 14.920 1.00 0.00 H new ATOM 927 N PRO A 60 15.760 7.761 12.715 1.00 0.00 N ATOM 928 CA PRO A 60 16.386 7.774 11.398 1.00 0.00 C ATOM 929 C PRO A 60 15.371 8.105 10.304 1.00 0.00 C ATOM 930 O PRO A 60 14.274 8.587 10.591 1.00 0.00 O ATOM 931 CB PRO A 60 16.886 6.338 11.246 1.00 0.00 C ATOM 932 CG PRO A 60 15.918 5.518 12.029 1.00 0.00 C ATOM 933 CD PRO A 60 15.430 6.392 13.158 1.00 0.00 C ATOM 0 HA PRO A 60 17.171 8.524 11.308 1.00 0.00 H new ATOM 0 HB2 PRO A 60 16.907 6.034 10.199 1.00 0.00 H new ATOM 0 HB3 PRO A 60 17.900 6.229 11.630 1.00 0.00 H new ATOM 0 HG2 PRO A 60 15.087 5.195 11.402 1.00 0.00 H new ATOM 0 HG3 PRO A 60 16.396 4.617 12.414 1.00 0.00 H new ATOM 0 HD2 PRO A 60 14.359 6.272 13.322 1.00 0.00 H new ATOM 0 HD3 PRO A 60 15.926 6.146 14.097 1.00 0.00 H new ATOM 941 N SER A 61 15.739 7.859 9.059 1.00 0.00 N ATOM 942 CA SER A 61 14.812 8.008 7.954 1.00 0.00 C ATOM 943 C SER A 61 13.801 6.865 7.964 1.00 0.00 C ATOM 944 O SER A 61 14.173 5.700 7.813 1.00 0.00 O ATOM 945 CB SER A 61 15.580 8.033 6.634 1.00 0.00 C ATOM 946 OG SER A 61 16.339 9.225 6.521 1.00 0.00 O ATOM 0 H SER A 61 16.674 7.555 8.789 1.00 0.00 H new ATOM 0 HA SER A 61 14.272 8.949 8.062 1.00 0.00 H new ATOM 0 HB2 SER A 61 16.240 7.168 6.575 1.00 0.00 H new ATOM 0 HB3 SER A 61 14.882 7.959 5.800 1.00 0.00 H new ATOM 0 HG SER A 61 15.734 9.990 6.422 1.00 0.00 H new ATOM 952 N PRO A 62 12.515 7.173 8.176 1.00 0.00 N ATOM 953 CA PRO A 62 11.478 6.166 8.229 1.00 0.00 C ATOM 954 C PRO A 62 10.890 5.870 6.862 1.00 0.00 C ATOM 955 O PRO A 62 11.365 5.004 6.137 1.00 0.00 O ATOM 956 CB PRO A 62 10.429 6.799 9.138 1.00 0.00 C ATOM 957 CG PRO A 62 10.616 8.286 9.025 1.00 0.00 C ATOM 958 CD PRO A 62 11.970 8.525 8.382 1.00 0.00 C ATOM 0 HA PRO A 62 11.853 5.207 8.587 1.00 0.00 H new ATOM 0 HB2 PRO A 62 9.424 6.509 8.832 1.00 0.00 H new ATOM 0 HB3 PRO A 62 10.557 6.468 10.169 1.00 0.00 H new ATOM 0 HG2 PRO A 62 9.822 8.728 8.423 1.00 0.00 H new ATOM 0 HG3 PRO A 62 10.570 8.755 10.008 1.00 0.00 H new ATOM 0 HD2 PRO A 62 11.874 9.064 7.439 1.00 0.00 H new ATOM 0 HD3 PRO A 62 12.617 9.122 9.025 1.00 0.00 H new ATOM 966 N CYS A 63 9.853 6.601 6.523 1.00 0.00 N ATOM 967 CA CYS A 63 9.186 6.457 5.253 1.00 0.00 C ATOM 968 C CYS A 63 9.044 7.833 4.616 1.00 0.00 C ATOM 969 O CYS A 63 9.011 8.836 5.328 1.00 0.00 O ATOM 970 CB CYS A 63 7.826 5.810 5.483 1.00 0.00 C ATOM 971 SG CYS A 63 7.895 4.297 6.468 1.00 0.00 S ATOM 0 H CYS A 63 9.447 7.317 7.126 1.00 0.00 H new ATOM 0 HA CYS A 63 9.761 5.821 4.579 1.00 0.00 H new ATOM 0 HB2 CYS A 63 7.173 6.527 5.981 1.00 0.00 H new ATOM 0 HB3 CYS A 63 7.374 5.583 4.517 1.00 0.00 H new ATOM 0 HG CYS A 63 6.816 3.600 6.268 1.00 0.00 H new ATOM 977 N LYS A 64 8.958 7.888 3.293 1.00 0.00 N ATOM 978 CA LYS A 64 8.957 9.165 2.588 1.00 0.00 C ATOM 979 C LYS A 64 8.069 9.073 1.362 1.00 0.00 C ATOM 980 O LYS A 64 8.196 8.135 0.568 1.00 0.00 O ATOM 981 CB LYS A 64 10.393 9.546 2.190 1.00 0.00 C ATOM 982 CG LYS A 64 11.149 8.452 1.446 1.00 0.00 C ATOM 983 CD LYS A 64 12.615 8.815 1.262 1.00 0.00 C ATOM 984 CE LYS A 64 13.406 7.679 0.631 1.00 0.00 C ATOM 985 NZ LYS A 64 13.016 7.439 -0.784 1.00 0.00 N ATOM 0 H LYS A 64 8.888 7.069 2.689 1.00 0.00 H new ATOM 0 HA LYS A 64 8.564 9.940 3.246 1.00 0.00 H new ATOM 0 HB2 LYS A 64 10.360 10.438 1.564 1.00 0.00 H new ATOM 0 HB3 LYS A 64 10.949 9.808 3.090 1.00 0.00 H new ATOM 0 HG2 LYS A 64 11.071 7.515 1.997 1.00 0.00 H new ATOM 0 HG3 LYS A 64 10.688 8.288 0.472 1.00 0.00 H new ATOM 0 HD2 LYS A 64 12.693 9.703 0.635 1.00 0.00 H new ATOM 0 HD3 LYS A 64 13.051 9.067 2.229 1.00 0.00 H new ATOM 0 HE2 LYS A 64 14.470 7.910 0.678 1.00 0.00 H new ATOM 0 HE3 LYS A 64 13.252 6.767 1.208 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 13.184 6.442 -1.026 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 12.007 7.660 -0.908 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 13.583 8.047 -1.408 1.00 0.00 H new ATOM 999 N VAL A 65 7.146 10.015 1.205 1.00 0.00 N ATOM 1000 CA VAL A 65 6.276 9.980 0.056 1.00 0.00 C ATOM 1001 C VAL A 65 6.972 10.597 -1.132 1.00 0.00 C ATOM 1002 O VAL A 65 7.526 11.685 -1.044 1.00 0.00 O ATOM 1003 CB VAL A 65 4.956 10.720 0.295 1.00 0.00 C ATOM 1004 CG1 VAL A 65 4.142 10.802 -0.978 1.00 0.00 C ATOM 1005 CG2 VAL A 65 4.128 10.050 1.381 1.00 0.00 C ATOM 0 H VAL A 65 6.989 10.792 1.847 1.00 0.00 H new ATOM 0 HA VAL A 65 6.044 8.932 -0.133 1.00 0.00 H new ATOM 0 HB VAL A 65 5.212 11.727 0.623 1.00 0.00 H new ATOM 0 HG11 VAL A 65 3.210 11.332 -0.781 1.00 0.00 H new ATOM 0 HG12 VAL A 65 4.710 11.337 -1.739 1.00 0.00 H new ATOM 0 HG13 VAL A 65 3.919 9.796 -1.333 1.00 0.00 H new ATOM 0 HG21 VAL A 65 3.199 10.602 1.523 1.00 0.00 H new ATOM 0 HG22 VAL A 65 3.900 9.026 1.085 1.00 0.00 H new ATOM 0 HG23 VAL A 65 4.691 10.041 2.314 1.00 0.00 H new ATOM 1015 N LEU A 66 6.951 9.889 -2.232 1.00 0.00 N ATOM 1016 CA LEU A 66 7.451 10.412 -3.476 1.00 0.00 C ATOM 1017 C LEU A 66 6.524 11.495 -3.984 1.00 0.00 C ATOM 1018 O LEU A 66 6.952 12.594 -4.332 1.00 0.00 O ATOM 1019 CB LEU A 66 7.547 9.294 -4.504 1.00 0.00 C ATOM 1020 CG LEU A 66 8.884 8.569 -4.529 1.00 0.00 C ATOM 1021 CD1 LEU A 66 8.938 7.533 -3.422 1.00 0.00 C ATOM 1022 CD2 LEU A 66 9.122 7.938 -5.890 1.00 0.00 C ATOM 0 H LEU A 66 6.588 8.937 -2.290 1.00 0.00 H new ATOM 0 HA LEU A 66 8.442 10.835 -3.314 1.00 0.00 H new ATOM 0 HB2 LEU A 66 6.759 8.568 -4.306 1.00 0.00 H new ATOM 0 HB3 LEU A 66 7.356 9.710 -5.493 1.00 0.00 H new ATOM 0 HG LEU A 66 9.682 9.291 -4.355 1.00 0.00 H new ATOM 0 HD11 LEU A 66 9.900 7.021 -3.450 1.00 0.00 H new ATOM 0 HD12 LEU A 66 8.817 8.025 -2.457 1.00 0.00 H new ATOM 0 HD13 LEU A 66 8.136 6.808 -3.563 1.00 0.00 H new ATOM 0 HD21 LEU A 66 10.083 7.424 -5.890 1.00 0.00 H new ATOM 0 HD22 LEU A 66 8.328 7.223 -6.103 1.00 0.00 H new ATOM 0 HD23 LEU A 66 9.126 8.714 -6.655 1.00 0.00 H new ATOM 1034 N ALA A 67 5.251 11.163 -4.018 1.00 0.00 N ATOM 1035 CA ALA A 67 4.231 12.048 -4.514 1.00 0.00 C ATOM 1036 C ALA A 67 2.904 11.625 -3.944 1.00 0.00 C ATOM 1037 O ALA A 67 2.646 10.432 -3.795 1.00 0.00 O ATOM 1038 CB ALA A 67 4.180 12.022 -6.023 1.00 0.00 C ATOM 0 H ALA A 67 4.897 10.262 -3.698 1.00 0.00 H new ATOM 0 HA ALA A 67 4.462 13.068 -4.206 1.00 0.00 H new ATOM 0 HB1 ALA A 67 3.401 12.699 -6.372 1.00 0.00 H new ATOM 0 HB2 ALA A 67 5.143 12.338 -6.425 1.00 0.00 H new ATOM 0 HB3 ALA A 67 3.960 11.010 -6.362 1.00 0.00 H new ATOM 1044 N VAL A 68 2.067 12.568 -3.617 1.00 0.00 N ATOM 1045 CA VAL A 68 0.761 12.222 -3.128 1.00 0.00 C ATOM 1046 C VAL A 68 -0.295 13.137 -3.721 1.00 0.00 C ATOM 1047 O VAL A 68 -0.119 14.349 -3.826 1.00 0.00 O ATOM 1048 CB VAL A 68 0.664 12.189 -1.581 1.00 0.00 C ATOM 1049 CG1 VAL A 68 0.361 13.559 -0.989 1.00 0.00 C ATOM 1050 CG2 VAL A 68 -0.383 11.173 -1.170 1.00 0.00 C ATOM 0 H VAL A 68 2.260 13.568 -3.678 1.00 0.00 H new ATOM 0 HA VAL A 68 0.574 11.201 -3.459 1.00 0.00 H new ATOM 0 HB VAL A 68 1.636 11.895 -1.184 1.00 0.00 H new ATOM 0 HG11 VAL A 68 0.303 13.482 0.097 1.00 0.00 H new ATOM 0 HG12 VAL A 68 1.153 14.256 -1.261 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -0.591 13.921 -1.378 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -0.456 11.145 -0.083 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -1.348 11.454 -1.591 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -0.099 10.188 -1.540 1.00 0.00 H new ATOM 1060 N GLN A 69 -1.372 12.528 -4.142 1.00 0.00 N ATOM 1061 CA GLN A 69 -2.438 13.219 -4.821 1.00 0.00 C ATOM 1062 C GLN A 69 -3.756 12.653 -4.373 1.00 0.00 C ATOM 1063 O GLN A 69 -3.914 11.429 -4.286 1.00 0.00 O ATOM 1064 CB GLN A 69 -2.294 13.056 -6.318 1.00 0.00 C ATOM 1065 CG GLN A 69 -2.229 14.373 -7.072 1.00 0.00 C ATOM 1066 CD GLN A 69 -3.487 15.197 -6.887 1.00 0.00 C ATOM 1067 OE1 GLN A 69 -3.577 16.023 -5.981 1.00 0.00 O ATOM 1068 NE2 GLN A 69 -4.480 14.952 -7.724 1.00 0.00 N ATOM 0 H GLN A 69 -1.536 11.528 -4.022 1.00 0.00 H new ATOM 0 HA GLN A 69 -2.392 14.281 -4.579 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -1.391 12.483 -6.527 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -3.135 12.473 -6.694 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -1.367 14.945 -6.728 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -2.078 14.176 -8.133 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -4.365 14.258 -8.463 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -5.362 15.457 -7.631 1.00 0.00 H new ATOM 1077 N ALA A 70 -4.718 13.535 -4.194 1.00 0.00 N ATOM 1078 CA ALA A 70 -5.937 13.196 -3.492 1.00 0.00 C ATOM 1079 C ALA A 70 -6.678 12.156 -4.289 1.00 0.00 C ATOM 1080 O ALA A 70 -6.957 12.370 -5.468 1.00 0.00 O ATOM 1081 CB ALA A 70 -6.808 14.425 -3.289 1.00 0.00 C ATOM 0 H ALA A 70 -4.677 14.498 -4.528 1.00 0.00 H new ATOM 0 HA ALA A 70 -5.688 12.802 -2.507 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -7.718 14.143 -2.759 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -6.262 15.165 -2.704 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -7.070 14.850 -4.258 1.00 0.00 H new ATOM 1087 N PRO A 71 -7.044 11.051 -3.612 1.00 0.00 N ATOM 1088 CA PRO A 71 -7.322 9.755 -4.189 1.00 0.00 C ATOM 1089 C PRO A 71 -7.283 9.706 -5.705 1.00 0.00 C ATOM 1090 O PRO A 71 -8.295 9.553 -6.382 1.00 0.00 O ATOM 1091 CB PRO A 71 -8.680 9.501 -3.580 1.00 0.00 C ATOM 1092 CG PRO A 71 -8.470 9.934 -2.161 1.00 0.00 C ATOM 1093 CD PRO A 71 -7.366 10.984 -2.188 1.00 0.00 C ATOM 0 HA PRO A 71 -6.575 8.992 -3.973 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -9.462 10.079 -4.072 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -8.968 8.452 -3.648 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -9.388 10.347 -1.741 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -8.186 9.088 -1.535 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -7.707 11.944 -1.801 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -6.505 10.687 -1.589 1.00 0.00 H new ATOM 1101 N THR A 72 -6.073 9.872 -6.207 1.00 0.00 N ATOM 1102 CA THR A 72 -5.762 9.699 -7.601 1.00 0.00 C ATOM 1103 C THR A 72 -4.426 8.985 -7.723 1.00 0.00 C ATOM 1104 O THR A 72 -4.323 7.971 -8.409 1.00 0.00 O ATOM 1105 CB THR A 72 -5.708 11.053 -8.326 1.00 0.00 C ATOM 1106 OG1 THR A 72 -5.043 12.016 -7.500 1.00 0.00 O ATOM 1107 CG2 THR A 72 -7.108 11.542 -8.653 1.00 0.00 C ATOM 0 H THR A 72 -5.268 10.136 -5.640 1.00 0.00 H new ATOM 0 HA THR A 72 -6.545 9.103 -8.069 1.00 0.00 H new ATOM 0 HB THR A 72 -5.157 10.926 -9.258 1.00 0.00 H new ATOM 0 HG1 THR A 72 -5.631 12.274 -6.760 1.00 0.00 H new ATOM 0 HG21 THR A 72 -7.048 12.502 -9.166 1.00 0.00 H new ATOM 0 HG22 THR A 72 -7.605 10.817 -9.297 1.00 0.00 H new ATOM 0 HG23 THR A 72 -7.677 11.659 -7.731 1.00 0.00 H new ATOM 1115 N GLU A 73 -3.419 9.493 -7.007 1.00 0.00 N ATOM 1116 CA GLU A 73 -2.079 8.906 -7.031 1.00 0.00 C ATOM 1117 C GLU A 73 -1.464 8.980 -5.649 1.00 0.00 C ATOM 1118 O GLU A 73 -1.517 10.009 -4.986 1.00 0.00 O ATOM 1119 CB GLU A 73 -1.172 9.646 -8.020 1.00 0.00 C ATOM 1120 CG GLU A 73 0.182 8.974 -8.229 1.00 0.00 C ATOM 1121 CD GLU A 73 1.106 9.781 -9.119 1.00 0.00 C ATOM 1122 OE1 GLU A 73 0.652 10.272 -10.173 1.00 0.00 O ATOM 1123 OE2 GLU A 73 2.302 9.903 -8.783 1.00 0.00 O ATOM 0 H GLU A 73 -3.508 10.310 -6.403 1.00 0.00 H new ATOM 0 HA GLU A 73 -2.170 7.867 -7.347 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -1.682 9.723 -8.980 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -1.012 10.663 -7.662 1.00 0.00 H new ATOM 0 HG2 GLU A 73 0.660 8.820 -7.261 1.00 0.00 H new ATOM 0 HG3 GLU A 73 0.030 7.989 -8.669 1.00 0.00 H new ATOM 1130 N LEU A 74 -0.900 7.888 -5.213 1.00 0.00 N ATOM 1131 CA LEU A 74 -0.151 7.862 -3.989 1.00 0.00 C ATOM 1132 C LEU A 74 1.153 7.167 -4.269 1.00 0.00 C ATOM 1133 O LEU A 74 1.150 6.077 -4.781 1.00 0.00 O ATOM 1134 CB LEU A 74 -0.974 7.090 -2.957 1.00 0.00 C ATOM 1135 CG LEU A 74 -0.431 6.996 -1.551 1.00 0.00 C ATOM 1136 CD1 LEU A 74 -1.571 6.753 -0.592 1.00 0.00 C ATOM 1137 CD2 LEU A 74 0.575 5.885 -1.426 1.00 0.00 C ATOM 0 H LEU A 74 -0.947 6.991 -5.697 1.00 0.00 H new ATOM 0 HA LEU A 74 0.052 8.862 -3.605 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -1.961 7.549 -2.905 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -1.113 6.076 -3.331 1.00 0.00 H new ATOM 0 HG LEU A 74 0.069 7.935 -1.313 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -1.183 6.684 0.424 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -2.281 7.578 -0.655 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -2.073 5.821 -0.852 1.00 0.00 H new ATOM 0 HD21 LEU A 74 0.947 5.844 -0.402 1.00 0.00 H new ATOM 0 HD22 LEU A 74 0.102 4.936 -1.679 1.00 0.00 H new ATOM 0 HD23 LEU A 74 1.406 6.069 -2.107 1.00 0.00 H new ATOM 1149 N SER A 75 2.261 7.783 -3.965 1.00 0.00 N ATOM 1150 CA SER A 75 3.531 7.081 -4.090 1.00 0.00 C ATOM 1151 C SER A 75 4.406 7.381 -2.907 1.00 0.00 C ATOM 1152 O SER A 75 4.707 8.532 -2.639 1.00 0.00 O ATOM 1153 CB SER A 75 4.251 7.498 -5.366 1.00 0.00 C ATOM 1154 OG SER A 75 3.489 7.183 -6.518 1.00 0.00 O ATOM 0 H SER A 75 2.324 8.746 -3.636 1.00 0.00 H new ATOM 0 HA SER A 75 3.326 6.011 -4.130 1.00 0.00 H new ATOM 0 HB2 SER A 75 4.448 8.570 -5.340 1.00 0.00 H new ATOM 0 HB3 SER A 75 5.218 6.998 -5.420 1.00 0.00 H new ATOM 0 HG SER A 75 3.977 7.464 -7.320 1.00 0.00 H new ATOM 1160 N PHE A 76 4.834 6.357 -2.222 1.00 0.00 N ATOM 1161 CA PHE A 76 5.688 6.531 -1.077 1.00 0.00 C ATOM 1162 C PHE A 76 6.558 5.310 -0.885 1.00 0.00 C ATOM 1163 O PHE A 76 6.228 4.234 -1.372 1.00 0.00 O ATOM 1164 CB PHE A 76 4.868 6.960 0.142 1.00 0.00 C ATOM 1165 CG PHE A 76 4.137 5.887 0.915 1.00 0.00 C ATOM 1166 CD1 PHE A 76 3.118 5.141 0.337 1.00 0.00 C ATOM 1167 CD2 PHE A 76 4.459 5.649 2.250 1.00 0.00 C ATOM 1168 CE1 PHE A 76 2.448 4.176 1.068 1.00 0.00 C ATOM 1169 CE2 PHE A 76 3.788 4.685 2.983 1.00 0.00 C ATOM 1170 CZ PHE A 76 2.783 3.949 2.390 1.00 0.00 C ATOM 0 H PHE A 76 4.604 5.387 -2.438 1.00 0.00 H new ATOM 0 HA PHE A 76 6.388 7.351 -1.239 1.00 0.00 H new ATOM 0 HB2 PHE A 76 5.538 7.472 0.833 1.00 0.00 H new ATOM 0 HB3 PHE A 76 4.133 7.693 -0.191 1.00 0.00 H new ATOM 0 HD1 PHE A 76 2.846 5.316 -0.693 1.00 0.00 H new ATOM 0 HD2 PHE A 76 5.243 6.225 2.719 1.00 0.00 H new ATOM 0 HE1 PHE A 76 1.661 3.599 0.605 1.00 0.00 H new ATOM 0 HE2 PHE A 76 4.051 4.510 4.016 1.00 0.00 H new ATOM 0 HZ PHE A 76 2.258 3.196 2.958 1.00 0.00 H new ATOM 1180 N GLU A 77 7.663 5.466 -0.194 1.00 0.00 N ATOM 1181 CA GLU A 77 8.585 4.355 -0.023 1.00 0.00 C ATOM 1182 C GLU A 77 8.634 3.976 1.439 1.00 0.00 C ATOM 1183 O GLU A 77 8.770 4.829 2.326 1.00 0.00 O ATOM 1184 CB GLU A 77 10.008 4.722 -0.466 1.00 0.00 C ATOM 1185 CG GLU A 77 10.291 4.619 -1.959 1.00 0.00 C ATOM 1186 CD GLU A 77 11.629 5.240 -2.311 1.00 0.00 C ATOM 1187 OE1 GLU A 77 12.658 4.804 -1.759 1.00 0.00 O ATOM 1188 OE2 GLU A 77 11.657 6.208 -3.094 1.00 0.00 O ATOM 0 H GLU A 77 7.948 6.336 0.255 1.00 0.00 H new ATOM 0 HA GLU A 77 8.228 3.529 -0.639 1.00 0.00 H new ATOM 0 HB2 GLU A 77 10.214 5.744 -0.147 1.00 0.00 H new ATOM 0 HB3 GLU A 77 10.709 4.076 0.062 1.00 0.00 H new ATOM 0 HG2 GLU A 77 10.283 3.572 -2.261 1.00 0.00 H new ATOM 0 HG3 GLU A 77 9.498 5.118 -2.517 1.00 0.00 H new ATOM 1195 N TRP A 78 8.496 2.678 1.664 1.00 0.00 N ATOM 1196 CA TRP A 78 8.221 2.145 2.990 1.00 0.00 C ATOM 1197 C TRP A 78 9.481 1.731 3.742 1.00 0.00 C ATOM 1198 O TRP A 78 10.220 0.846 3.315 1.00 0.00 O ATOM 1199 CB TRP A 78 7.244 0.967 2.893 1.00 0.00 C ATOM 1200 CG TRP A 78 7.106 0.182 4.168 1.00 0.00 C ATOM 1201 CD1 TRP A 78 7.558 -1.086 4.399 1.00 0.00 C ATOM 1202 CD2 TRP A 78 6.488 0.610 5.385 1.00 0.00 C ATOM 1203 NE1 TRP A 78 7.264 -1.468 5.681 1.00 0.00 N ATOM 1204 CE2 TRP A 78 6.606 -0.449 6.308 1.00 0.00 C ATOM 1205 CE3 TRP A 78 5.848 1.780 5.789 1.00 0.00 C ATOM 1206 CZ2 TRP A 78 6.110 -0.369 7.604 1.00 0.00 C ATOM 1207 CZ3 TRP A 78 5.357 1.856 7.077 1.00 0.00 C ATOM 1208 CH2 TRP A 78 5.489 0.788 7.971 1.00 0.00 C ATOM 0 H TRP A 78 8.571 1.967 0.936 1.00 0.00 H new ATOM 0 HA TRP A 78 7.768 2.952 3.566 1.00 0.00 H new ATOM 0 HB2 TRP A 78 6.263 1.344 2.602 1.00 0.00 H new ATOM 0 HB3 TRP A 78 7.576 0.297 2.100 1.00 0.00 H new ATOM 0 HD1 TRP A 78 8.073 -1.699 3.675 1.00 0.00 H new ATOM 0 HE1 TRP A 78 7.499 -2.368 6.100 1.00 0.00 H new ATOM 0 HE3 TRP A 78 5.738 2.611 5.108 1.00 0.00 H new ATOM 0 HZ2 TRP A 78 6.213 -1.193 8.295 1.00 0.00 H new ATOM 0 HZ3 TRP A 78 4.861 2.759 7.401 1.00 0.00 H new ATOM 0 HH2 TRP A 78 5.091 0.882 8.971 1.00 0.00 H new ATOM 1219 N ASP A 79 9.688 2.425 4.855 1.00 0.00 N ATOM 1220 CA ASP A 79 10.665 2.084 5.898 1.00 0.00 C ATOM 1221 C ASP A 79 12.017 1.606 5.380 1.00 0.00 C ATOM 1222 O ASP A 79 12.836 2.389 4.899 1.00 0.00 O ATOM 1223 CB ASP A 79 10.082 1.040 6.860 1.00 0.00 C ATOM 1224 CG ASP A 79 10.683 1.144 8.249 1.00 0.00 C ATOM 1225 OD1 ASP A 79 10.133 1.898 9.081 1.00 0.00 O ATOM 1226 OD2 ASP A 79 11.708 0.481 8.518 1.00 0.00 O ATOM 0 H ASP A 79 9.164 3.273 5.070 1.00 0.00 H new ATOM 0 HA ASP A 79 10.860 3.022 6.419 1.00 0.00 H new ATOM 0 HB2 ASP A 79 9.001 1.169 6.923 1.00 0.00 H new ATOM 0 HB3 ASP A 79 10.261 0.041 6.462 1.00 0.00 H new ATOM 1231 N THR A 80 12.230 0.315 5.509 1.00 0.00 N ATOM 1232 CA THR A 80 13.538 -0.293 5.318 1.00 0.00 C ATOM 1233 C THR A 80 13.785 -0.699 3.873 1.00 0.00 C ATOM 1234 O THR A 80 14.924 -0.703 3.402 1.00 0.00 O ATOM 1235 CB THR A 80 13.702 -1.517 6.254 1.00 0.00 C ATOM 1236 OG1 THR A 80 14.897 -2.243 5.937 1.00 0.00 O ATOM 1237 CG2 THR A 80 12.496 -2.443 6.160 1.00 0.00 C ATOM 0 H THR A 80 11.497 -0.352 5.751 1.00 0.00 H new ATOM 0 HA THR A 80 14.283 0.461 5.571 1.00 0.00 H new ATOM 0 HB THR A 80 13.776 -1.143 7.275 1.00 0.00 H new ATOM 0 HG1 THR A 80 14.717 -2.863 5.199 1.00 0.00 H new ATOM 0 HG21 THR A 80 12.637 -3.293 6.827 1.00 0.00 H new ATOM 0 HG22 THR A 80 11.597 -1.900 6.450 1.00 0.00 H new ATOM 0 HG23 THR A 80 12.390 -2.799 5.135 1.00 0.00 H new ATOM 1245 N GLU A 81 12.726 -1.033 3.181 1.00 0.00 N ATOM 1246 CA GLU A 81 12.822 -1.460 1.801 1.00 0.00 C ATOM 1247 C GLU A 81 12.672 -0.246 0.890 1.00 0.00 C ATOM 1248 O GLU A 81 12.055 0.747 1.268 1.00 0.00 O ATOM 1249 CB GLU A 81 11.751 -2.498 1.492 1.00 0.00 C ATOM 1250 CG GLU A 81 11.628 -3.573 2.554 1.00 0.00 C ATOM 1251 CD GLU A 81 10.581 -3.256 3.605 1.00 0.00 C ATOM 1252 OE1 GLU A 81 10.376 -2.063 3.904 1.00 0.00 O ATOM 1253 OE2 GLU A 81 9.956 -4.203 4.121 1.00 0.00 O ATOM 0 H GLU A 81 11.776 -1.018 3.552 1.00 0.00 H new ATOM 0 HA GLU A 81 13.795 -1.919 1.629 1.00 0.00 H new ATOM 0 HB2 GLU A 81 10.790 -1.996 1.382 1.00 0.00 H new ATOM 0 HB3 GLU A 81 11.977 -2.968 0.535 1.00 0.00 H new ATOM 0 HG2 GLU A 81 11.379 -4.520 2.076 1.00 0.00 H new ATOM 0 HG3 GLU A 81 12.594 -3.706 3.041 1.00 0.00 H new ATOM 1260 N GLY A 82 13.227 -0.319 -0.303 1.00 0.00 N ATOM 1261 CA GLY A 82 13.195 0.824 -1.191 1.00 0.00 C ATOM 1262 C GLY A 82 11.984 0.823 -2.098 1.00 0.00 C ATOM 1263 O GLY A 82 12.056 1.292 -3.235 1.00 0.00 O ATOM 0 H GLY A 82 13.698 -1.144 -0.675 1.00 0.00 H new ATOM 0 HA2 GLY A 82 13.200 1.739 -0.599 1.00 0.00 H new ATOM 0 HA3 GLY A 82 14.100 0.832 -1.799 1.00 0.00 H new ATOM 1267 N TRP A 83 10.859 0.297 -1.613 1.00 0.00 N ATOM 1268 CA TRP A 83 9.681 0.210 -2.462 1.00 0.00 C ATOM 1269 C TRP A 83 8.943 1.505 -2.534 1.00 0.00 C ATOM 1270 O TRP A 83 8.412 2.004 -1.535 1.00 0.00 O ATOM 1271 CB TRP A 83 8.666 -0.884 -2.103 1.00 0.00 C ATOM 1272 CG TRP A 83 8.612 -1.330 -0.672 1.00 0.00 C ATOM 1273 CD1 TRP A 83 9.065 -0.681 0.437 1.00 0.00 C ATOM 1274 CD2 TRP A 83 8.029 -2.552 -0.212 1.00 0.00 C ATOM 1275 NE1 TRP A 83 8.829 -1.444 1.552 1.00 0.00 N ATOM 1276 CE2 TRP A 83 8.188 -2.594 1.179 1.00 0.00 C ATOM 1277 CE3 TRP A 83 7.397 -3.620 -0.851 1.00 0.00 C ATOM 1278 CZ2 TRP A 83 7.735 -3.665 1.948 1.00 0.00 C ATOM 1279 CZ3 TRP A 83 6.944 -4.677 -0.090 1.00 0.00 C ATOM 1280 CH2 TRP A 83 7.118 -4.696 1.297 1.00 0.00 C ATOM 0 H TRP A 83 10.743 -0.064 -0.666 1.00 0.00 H new ATOM 0 HA TRP A 83 10.114 -0.059 -3.425 1.00 0.00 H new ATOM 0 HB2 TRP A 83 7.674 -0.529 -2.383 1.00 0.00 H new ATOM 0 HB3 TRP A 83 8.878 -1.757 -2.720 1.00 0.00 H new ATOM 0 HD1 TRP A 83 9.539 0.289 0.438 1.00 0.00 H new ATOM 0 HE1 TRP A 83 9.089 -1.194 2.506 1.00 0.00 H new ATOM 0 HE3 TRP A 83 7.265 -3.619 -1.923 1.00 0.00 H new ATOM 0 HZ2 TRP A 83 7.867 -3.679 3.020 1.00 0.00 H new ATOM 0 HZ3 TRP A 83 6.446 -5.504 -0.574 1.00 0.00 H new ATOM 0 HH2 TRP A 83 6.758 -5.541 1.865 1.00 0.00 H new ATOM 1291 N VAL A 84 8.904 2.000 -3.746 1.00 0.00 N ATOM 1292 CA VAL A 84 8.023 3.066 -4.135 1.00 0.00 C ATOM 1293 C VAL A 84 6.663 2.446 -4.398 1.00 0.00 C ATOM 1294 O VAL A 84 6.333 2.089 -5.529 1.00 0.00 O ATOM 1295 CB VAL A 84 8.515 3.742 -5.421 1.00 0.00 C ATOM 1296 CG1 VAL A 84 7.643 4.936 -5.782 1.00 0.00 C ATOM 1297 CG2 VAL A 84 9.977 4.149 -5.304 1.00 0.00 C ATOM 0 H VAL A 84 9.498 1.664 -4.504 1.00 0.00 H new ATOM 0 HA VAL A 84 7.983 3.820 -3.348 1.00 0.00 H new ATOM 0 HB VAL A 84 8.435 3.014 -6.228 1.00 0.00 H new ATOM 0 HG11 VAL A 84 8.016 5.395 -6.698 1.00 0.00 H new ATOM 0 HG12 VAL A 84 6.616 4.604 -5.935 1.00 0.00 H new ATOM 0 HG13 VAL A 84 7.672 5.666 -4.973 1.00 0.00 H new ATOM 0 HG21 VAL A 84 10.297 4.625 -6.231 1.00 0.00 H new ATOM 0 HG22 VAL A 84 10.095 4.849 -4.477 1.00 0.00 H new ATOM 0 HG23 VAL A 84 10.587 3.265 -5.121 1.00 0.00 H new ATOM 1307 N VAL A 85 5.935 2.205 -3.336 1.00 0.00 N ATOM 1308 CA VAL A 85 4.628 1.624 -3.433 1.00 0.00 C ATOM 1309 C VAL A 85 3.599 2.710 -3.737 1.00 0.00 C ATOM 1310 O VAL A 85 3.490 3.711 -3.024 1.00 0.00 O ATOM 1311 CB VAL A 85 4.296 0.831 -2.152 1.00 0.00 C ATOM 1312 CG1 VAL A 85 5.175 -0.401 -2.067 1.00 0.00 C ATOM 1313 CG2 VAL A 85 4.504 1.672 -0.911 1.00 0.00 C ATOM 0 H VAL A 85 6.236 2.408 -2.383 1.00 0.00 H new ATOM 0 HA VAL A 85 4.601 0.912 -4.258 1.00 0.00 H new ATOM 0 HB VAL A 85 3.246 0.542 -2.203 1.00 0.00 H new ATOM 0 HG11 VAL A 85 4.936 -0.957 -1.160 1.00 0.00 H new ATOM 0 HG12 VAL A 85 5.000 -1.034 -2.937 1.00 0.00 H new ATOM 0 HG13 VAL A 85 6.222 -0.100 -2.042 1.00 0.00 H new ATOM 0 HG21 VAL A 85 4.261 1.082 -0.027 1.00 0.00 H new ATOM 0 HG22 VAL A 85 5.545 1.992 -0.859 1.00 0.00 H new ATOM 0 HG23 VAL A 85 3.856 2.548 -0.952 1.00 0.00 H new ATOM 1323 N THR A 86 2.870 2.509 -4.818 1.00 0.00 N ATOM 1324 CA THR A 86 2.004 3.533 -5.364 1.00 0.00 C ATOM 1325 C THR A 86 0.549 3.073 -5.406 1.00 0.00 C ATOM 1326 O THR A 86 0.245 1.943 -5.757 1.00 0.00 O ATOM 1327 CB THR A 86 2.475 3.931 -6.788 1.00 0.00 C ATOM 1328 OG1 THR A 86 3.796 4.481 -6.715 1.00 0.00 O ATOM 1329 CG2 THR A 86 1.529 4.950 -7.442 1.00 0.00 C ATOM 0 H THR A 86 2.862 1.633 -5.340 1.00 0.00 H new ATOM 0 HA THR A 86 2.064 4.401 -4.708 1.00 0.00 H new ATOM 0 HB THR A 86 2.472 3.033 -7.405 1.00 0.00 H new ATOM 0 HG1 THR A 86 3.743 5.460 -6.708 1.00 0.00 H new ATOM 0 HG21 THR A 86 1.896 5.201 -8.437 1.00 0.00 H new ATOM 0 HG22 THR A 86 0.530 4.521 -7.521 1.00 0.00 H new ATOM 0 HG23 THR A 86 1.489 5.852 -6.832 1.00 0.00 H new ATOM 1337 N PHE A 87 -0.354 3.946 -5.024 1.00 0.00 N ATOM 1338 CA PHE A 87 -1.761 3.639 -5.101 1.00 0.00 C ATOM 1339 C PHE A 87 -2.393 4.528 -6.161 1.00 0.00 C ATOM 1340 O PHE A 87 -2.165 5.733 -6.179 1.00 0.00 O ATOM 1341 CB PHE A 87 -2.431 3.832 -3.723 1.00 0.00 C ATOM 1342 CG PHE A 87 -1.812 2.976 -2.640 1.00 0.00 C ATOM 1343 CD1 PHE A 87 -1.222 1.766 -2.959 1.00 0.00 C ATOM 1344 CD2 PHE A 87 -1.793 3.391 -1.316 1.00 0.00 C ATOM 1345 CE1 PHE A 87 -0.630 0.982 -1.989 1.00 0.00 C ATOM 1346 CE2 PHE A 87 -1.193 2.612 -0.342 1.00 0.00 C ATOM 1347 CZ PHE A 87 -0.614 1.401 -0.686 1.00 0.00 C ATOM 0 H PHE A 87 -0.139 4.873 -4.657 1.00 0.00 H new ATOM 0 HA PHE A 87 -1.904 2.596 -5.382 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -2.360 4.881 -3.434 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -3.492 3.595 -3.804 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -1.225 1.429 -3.985 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -2.251 4.330 -1.043 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -0.180 0.038 -2.258 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -1.176 2.947 0.684 1.00 0.00 H new ATOM 0 HZ PHE A 87 -0.151 0.788 0.073 1.00 0.00 H new ATOM 1357 N GLN A 88 -3.160 3.931 -7.054 1.00 0.00 N ATOM 1358 CA GLN A 88 -3.831 4.682 -8.104 1.00 0.00 C ATOM 1359 C GLN A 88 -5.336 4.568 -7.930 1.00 0.00 C ATOM 1360 O GLN A 88 -5.889 3.471 -7.849 1.00 0.00 O ATOM 1361 CB GLN A 88 -3.401 4.168 -9.467 1.00 0.00 C ATOM 1362 CG GLN A 88 -2.150 4.832 -9.995 1.00 0.00 C ATOM 1363 CD GLN A 88 -2.356 6.254 -10.469 1.00 0.00 C ATOM 1364 OE1 GLN A 88 -2.160 7.201 -9.723 1.00 0.00 O ATOM 1365 NE2 GLN A 88 -2.746 6.409 -11.726 1.00 0.00 N ATOM 0 H GLN A 88 -3.335 2.926 -7.075 1.00 0.00 H new ATOM 0 HA GLN A 88 -3.552 5.734 -8.035 1.00 0.00 H new ATOM 0 HB2 GLN A 88 -3.233 3.093 -9.405 1.00 0.00 H new ATOM 0 HB3 GLN A 88 -4.213 4.323 -10.178 1.00 0.00 H new ATOM 0 HG2 GLN A 88 -1.392 4.828 -9.212 1.00 0.00 H new ATOM 0 HG3 GLN A 88 -1.758 4.239 -10.821 1.00 0.00 H new ATOM 0 HE21 GLN A 88 -2.899 5.592 -12.317 1.00 0.00 H new ATOM 0 HE22 GLN A 88 -2.893 7.345 -12.103 1.00 0.00 H new ATOM 1374 N LEU A 89 -5.984 5.708 -7.864 1.00 0.00 N ATOM 1375 CA LEU A 89 -7.400 5.772 -7.541 1.00 0.00 C ATOM 1376 C LEU A 89 -8.192 6.450 -8.654 1.00 0.00 C ATOM 1377 O LEU A 89 -7.706 7.395 -9.279 1.00 0.00 O ATOM 1378 CB LEU A 89 -7.598 6.476 -6.190 1.00 0.00 C ATOM 1379 CG LEU A 89 -8.928 6.198 -5.465 1.00 0.00 C ATOM 1380 CD1 LEU A 89 -10.029 7.124 -5.953 1.00 0.00 C ATOM 1381 CD2 LEU A 89 -9.349 4.748 -5.651 1.00 0.00 C ATOM 0 H LEU A 89 -5.551 6.616 -8.031 1.00 0.00 H new ATOM 0 HA LEU A 89 -7.785 4.756 -7.455 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -6.781 6.185 -5.530 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -7.513 7.551 -6.348 1.00 0.00 H new ATOM 0 HG LEU A 89 -8.768 6.387 -4.404 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -10.954 6.901 -5.421 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -9.743 8.159 -5.766 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -10.181 6.977 -7.022 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -10.291 4.573 -5.131 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -9.477 4.540 -6.713 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -8.581 4.091 -5.242 1.00 0.00 H new ATOM 1393 N GLU A 90 -9.396 5.958 -8.908 1.00 0.00 N ATOM 1394 CA GLU A 90 -10.285 6.584 -9.864 1.00 0.00 C ATOM 1395 C GLU A 90 -11.447 7.214 -9.113 1.00 0.00 C ATOM 1396 O GLU A 90 -12.197 6.514 -8.416 1.00 0.00 O ATOM 1397 CB GLU A 90 -10.794 5.520 -10.859 1.00 0.00 C ATOM 1398 CG GLU A 90 -12.285 5.606 -11.201 1.00 0.00 C ATOM 1399 CD GLU A 90 -12.740 4.514 -12.150 1.00 0.00 C ATOM 1400 OE1 GLU A 90 -12.529 4.657 -13.371 1.00 0.00 O ATOM 1401 OE2 GLU A 90 -13.319 3.513 -11.679 1.00 0.00 O ATOM 0 H GLU A 90 -9.777 5.124 -8.461 1.00 0.00 H new ATOM 0 HA GLU A 90 -9.759 7.359 -10.422 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -10.221 5.605 -11.782 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -10.589 4.532 -10.446 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -12.867 5.546 -10.281 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -12.494 6.578 -11.648 1.00 0.00 H new ATOM 1408 N ASP A 91 -11.582 8.536 -9.257 1.00 0.00 N ATOM 1409 CA ASP A 91 -12.680 9.262 -8.634 1.00 0.00 C ATOM 1410 C ASP A 91 -13.895 9.141 -9.456 1.00 0.00 C ATOM 1411 O ASP A 91 -13.972 9.638 -10.583 1.00 0.00 O ATOM 1412 CB ASP A 91 -12.423 10.757 -8.415 1.00 0.00 C ATOM 1413 CG ASP A 91 -13.692 11.595 -8.384 1.00 0.00 C ATOM 1414 OD1 ASP A 91 -14.496 11.445 -7.447 1.00 0.00 O ATOM 1415 OD2 ASP A 91 -13.879 12.424 -9.300 1.00 0.00 O ATOM 0 H ASP A 91 -10.944 9.119 -9.799 1.00 0.00 H new ATOM 0 HA ASP A 91 -12.792 8.802 -7.652 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -11.886 10.891 -7.476 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -11.773 11.126 -9.209 1.00 0.00 H new ATOM 1420 N LEU A 92 -14.809 8.445 -8.904 1.00 0.00 N ATOM 1421 CA LEU A 92 -16.139 8.515 -9.332 1.00 0.00 C ATOM 1422 C LEU A 92 -16.970 8.852 -8.112 1.00 0.00 C ATOM 1423 O LEU A 92 -16.826 8.225 -7.069 1.00 0.00 O ATOM 1424 CB LEU A 92 -16.557 7.191 -9.946 1.00 0.00 C ATOM 1425 CG LEU A 92 -15.783 6.705 -11.177 1.00 0.00 C ATOM 1426 CD1 LEU A 92 -16.434 5.459 -11.754 1.00 0.00 C ATOM 1427 CD2 LEU A 92 -15.695 7.787 -12.241 1.00 0.00 C ATOM 0 H LEU A 92 -14.647 7.801 -8.130 1.00 0.00 H new ATOM 0 HA LEU A 92 -16.277 9.275 -10.101 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -16.479 6.424 -9.176 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -17.610 7.264 -10.218 1.00 0.00 H new ATOM 0 HG LEU A 92 -14.770 6.463 -10.857 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -15.873 5.126 -12.627 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -16.438 4.669 -11.003 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -17.459 5.686 -12.046 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -15.140 7.409 -13.099 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -16.699 8.071 -12.555 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -15.182 8.658 -11.833 1.00 0.00 H new ATOM 1439 N GLY A 93 -17.714 9.937 -8.210 1.00 0.00 N ATOM 1440 CA GLY A 93 -18.880 10.142 -7.323 1.00 0.00 C ATOM 1441 C GLY A 93 -19.755 8.892 -7.336 1.00 0.00 C ATOM 1442 O GLY A 93 -20.521 8.599 -6.420 1.00 0.00 O ATOM 0 H GLY A 93 -17.549 10.689 -8.879 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -18.545 10.354 -6.308 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -19.456 11.006 -7.655 1.00 0.00 H new ATOM 1446 N GLU A 94 -19.628 8.228 -8.460 1.00 0.00 N ATOM 1447 CA GLU A 94 -19.782 6.795 -8.655 1.00 0.00 C ATOM 1448 C GLU A 94 -18.891 6.049 -7.652 1.00 0.00 C ATOM 1449 O GLU A 94 -18.630 6.517 -6.548 1.00 0.00 O ATOM 1450 CB GLU A 94 -19.399 6.416 -10.079 1.00 0.00 C ATOM 1451 CG GLU A 94 -20.028 5.123 -10.567 1.00 0.00 C ATOM 1452 CD GLU A 94 -21.539 5.152 -10.512 1.00 0.00 C ATOM 1453 OE1 GLU A 94 -22.101 4.965 -9.412 1.00 0.00 O ATOM 1454 OE2 GLU A 94 -22.171 5.359 -11.565 1.00 0.00 O ATOM 0 H GLU A 94 -19.397 8.706 -9.331 1.00 0.00 H new ATOM 0 HA GLU A 94 -20.823 6.517 -8.491 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -19.690 7.225 -10.749 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -18.314 6.326 -10.140 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -19.709 4.933 -11.592 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -19.662 4.294 -9.961 1.00 0.00 H new ATOM 1461 N LYS A 95 -18.518 4.843 -7.997 1.00 0.00 N ATOM 1462 CA LYS A 95 -17.736 4.011 -7.130 1.00 0.00 C ATOM 1463 C LYS A 95 -16.298 4.168 -7.563 1.00 0.00 C ATOM 1464 O LYS A 95 -16.018 4.841 -8.542 1.00 0.00 O ATOM 1465 CB LYS A 95 -18.138 2.552 -7.363 1.00 0.00 C ATOM 1466 CG LYS A 95 -18.230 2.182 -8.855 1.00 0.00 C ATOM 1467 CD LYS A 95 -17.024 1.404 -9.404 1.00 0.00 C ATOM 1468 CE LYS A 95 -15.868 2.295 -9.889 1.00 0.00 C ATOM 1469 NZ LYS A 95 -15.168 1.724 -11.071 1.00 0.00 N ATOM 0 H LYS A 95 -18.751 4.412 -8.892 1.00 0.00 H new ATOM 0 HA LYS A 95 -17.881 4.280 -6.084 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -17.413 1.899 -6.877 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -19.102 2.367 -6.889 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -19.130 1.587 -9.012 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -18.348 3.097 -9.435 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -16.652 0.736 -8.627 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -17.356 0.777 -10.231 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -16.255 3.282 -10.142 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -15.153 2.431 -9.078 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -14.802 2.496 -11.664 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -14.378 1.128 -10.752 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -15.834 1.148 -11.624 1.00 0.00 H new ATOM 1483 N THR A 96 -15.380 3.569 -6.866 1.00 0.00 N ATOM 1484 CA THR A 96 -14.009 3.964 -7.002 1.00 0.00 C ATOM 1485 C THR A 96 -13.223 2.867 -7.655 1.00 0.00 C ATOM 1486 O THR A 96 -13.268 1.711 -7.242 1.00 0.00 O ATOM 1487 CB THR A 96 -13.416 4.276 -5.621 1.00 0.00 C ATOM 1488 OG1 THR A 96 -14.288 3.783 -4.608 1.00 0.00 O ATOM 1489 CG2 THR A 96 -13.204 5.770 -5.426 1.00 0.00 C ATOM 0 H THR A 96 -15.551 2.812 -6.204 1.00 0.00 H new ATOM 0 HA THR A 96 -13.958 4.858 -7.624 1.00 0.00 H new ATOM 0 HB THR A 96 -12.444 3.787 -5.553 1.00 0.00 H new ATOM 0 HG1 THR A 96 -15.085 4.351 -4.558 1.00 0.00 H new ATOM 0 HG21 THR A 96 -12.783 5.952 -4.437 1.00 0.00 H new ATOM 0 HG22 THR A 96 -12.518 6.142 -6.187 1.00 0.00 H new ATOM 0 HG23 THR A 96 -14.159 6.288 -5.514 1.00 0.00 H new ATOM 1497 N GLY A 97 -12.505 3.215 -8.688 1.00 0.00 N ATOM 1498 CA GLY A 97 -11.777 2.196 -9.388 1.00 0.00 C ATOM 1499 C GLY A 97 -10.360 2.160 -8.914 1.00 0.00 C ATOM 1500 O GLY A 97 -9.621 3.127 -9.072 1.00 0.00 O ATOM 0 H GLY A 97 -12.410 4.163 -9.053 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -12.247 1.226 -9.227 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -11.805 2.389 -10.460 1.00 0.00 H new ATOM 1504 N PHE A 98 -9.979 1.059 -8.302 1.00 0.00 N ATOM 1505 CA PHE A 98 -8.700 1.019 -7.641 1.00 0.00 C ATOM 1506 C PHE A 98 -7.677 0.237 -8.438 1.00 0.00 C ATOM 1507 O PHE A 98 -7.898 -0.908 -8.835 1.00 0.00 O ATOM 1508 CB PHE A 98 -8.780 0.440 -6.232 1.00 0.00 C ATOM 1509 CG PHE A 98 -7.556 0.803 -5.443 1.00 0.00 C ATOM 1510 CD1 PHE A 98 -7.423 2.076 -4.913 1.00 0.00 C ATOM 1511 CD2 PHE A 98 -6.529 -0.100 -5.262 1.00 0.00 C ATOM 1512 CE1 PHE A 98 -6.294 2.437 -4.208 1.00 0.00 C ATOM 1513 CE2 PHE A 98 -5.395 0.258 -4.562 1.00 0.00 C ATOM 1514 CZ PHE A 98 -5.276 1.528 -4.034 1.00 0.00 C ATOM 0 H PHE A 98 -10.525 0.199 -8.250 1.00 0.00 H new ATOM 0 HA PHE A 98 -8.383 2.059 -7.567 1.00 0.00 H new ATOM 0 HB2 PHE A 98 -9.670 0.817 -5.728 1.00 0.00 H new ATOM 0 HB3 PHE A 98 -8.878 -0.644 -6.283 1.00 0.00 H new ATOM 0 HD1 PHE A 98 -8.215 2.796 -5.054 1.00 0.00 H new ATOM 0 HD2 PHE A 98 -6.613 -1.096 -5.672 1.00 0.00 H new ATOM 0 HE1 PHE A 98 -6.209 3.431 -3.794 1.00 0.00 H new ATOM 0 HE2 PHE A 98 -4.598 -0.458 -4.427 1.00 0.00 H new ATOM 0 HZ PHE A 98 -4.388 1.807 -3.487 1.00 0.00 H new ATOM 1524 N THR A 99 -6.558 0.879 -8.667 1.00 0.00 N ATOM 1525 CA THR A 99 -5.416 0.240 -9.272 1.00 0.00 C ATOM 1526 C THR A 99 -4.237 0.391 -8.338 1.00 0.00 C ATOM 1527 O THR A 99 -3.818 1.502 -8.045 1.00 0.00 O ATOM 1528 CB THR A 99 -5.083 0.849 -10.646 1.00 0.00 C ATOM 1529 OG1 THR A 99 -6.232 0.770 -11.500 1.00 0.00 O ATOM 1530 CG2 THR A 99 -3.915 0.121 -11.292 1.00 0.00 C ATOM 0 H THR A 99 -6.413 1.862 -8.438 1.00 0.00 H new ATOM 0 HA THR A 99 -5.645 -0.813 -9.435 1.00 0.00 H new ATOM 0 HB THR A 99 -4.803 1.893 -10.502 1.00 0.00 H new ATOM 0 HG1 THR A 99 -6.018 1.160 -12.373 1.00 0.00 H new ATOM 0 HG21 THR A 99 -3.698 0.569 -12.262 1.00 0.00 H new ATOM 0 HG22 THR A 99 -3.037 0.201 -10.651 1.00 0.00 H new ATOM 0 HG23 THR A 99 -4.171 -0.930 -11.427 1.00 0.00 H new ATOM 1538 N LEU A 100 -3.710 -0.700 -7.841 1.00 0.00 N ATOM 1539 CA LEU A 100 -2.629 -0.584 -6.903 1.00 0.00 C ATOM 1540 C LEU A 100 -1.323 -0.989 -7.525 1.00 0.00 C ATOM 1541 O LEU A 100 -1.238 -1.966 -8.260 1.00 0.00 O ATOM 1542 CB LEU A 100 -2.885 -1.384 -5.631 1.00 0.00 C ATOM 1543 CG LEU A 100 -2.075 -0.893 -4.437 1.00 0.00 C ATOM 1544 CD1 LEU A 100 -2.762 -1.257 -3.151 1.00 0.00 C ATOM 1545 CD2 LEU A 100 -0.660 -1.437 -4.467 1.00 0.00 C ATOM 0 H LEU A 100 -4.003 -1.651 -8.063 1.00 0.00 H new ATOM 0 HA LEU A 100 -2.567 0.468 -6.623 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -3.946 -1.335 -5.386 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -2.649 -2.432 -5.815 1.00 0.00 H new ATOM 0 HG LEU A 100 -2.010 0.193 -4.499 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -2.170 -0.899 -2.308 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -3.749 -0.796 -3.123 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -2.865 -2.340 -3.088 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -0.110 -1.068 -3.602 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -0.688 -2.526 -4.441 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -0.163 -1.109 -5.380 1.00 0.00 H new ATOM 1557 N ILE A 101 -0.311 -0.216 -7.213 1.00 0.00 N ATOM 1558 CA ILE A 101 1.016 -0.455 -7.698 1.00 0.00 C ATOM 1559 C ILE A 101 1.950 -0.677 -6.514 1.00 0.00 C ATOM 1560 O ILE A 101 2.005 0.118 -5.588 1.00 0.00 O ATOM 1561 CB ILE A 101 1.555 0.755 -8.496 1.00 0.00 C ATOM 1562 CG1 ILE A 101 0.479 1.373 -9.419 1.00 0.00 C ATOM 1563 CG2 ILE A 101 2.782 0.350 -9.307 1.00 0.00 C ATOM 1564 CD1 ILE A 101 -0.480 2.303 -8.717 1.00 0.00 C ATOM 0 H ILE A 101 -0.392 0.602 -6.610 1.00 0.00 H new ATOM 0 HA ILE A 101 0.978 -1.328 -8.349 1.00 0.00 H new ATOM 0 HB ILE A 101 1.838 1.520 -7.773 1.00 0.00 H new ATOM 0 HG12 ILE A 101 0.975 1.919 -10.221 1.00 0.00 H new ATOM 0 HG13 ILE A 101 -0.089 0.568 -9.885 1.00 0.00 H new ATOM 0 HG21 ILE A 101 3.151 1.212 -9.864 1.00 0.00 H new ATOM 0 HG22 ILE A 101 3.561 -0.008 -8.634 1.00 0.00 H new ATOM 0 HG23 ILE A 101 2.512 -0.444 -10.004 1.00 0.00 H new ATOM 0 HD11 ILE A 101 -1.201 2.692 -9.436 1.00 0.00 H new ATOM 0 HD12 ILE A 101 -1.007 1.759 -7.933 1.00 0.00 H new ATOM 0 HD13 ILE A 101 0.074 3.131 -8.274 1.00 0.00 H new ATOM 1576 N HIS A 102 2.663 -1.760 -6.515 1.00 0.00 N ATOM 1577 CA HIS A 102 3.759 -1.915 -5.598 1.00 0.00 C ATOM 1578 C HIS A 102 5.004 -2.044 -6.431 1.00 0.00 C ATOM 1579 O HIS A 102 5.147 -2.983 -7.207 1.00 0.00 O ATOM 1580 CB HIS A 102 3.551 -3.127 -4.680 1.00 0.00 C ATOM 1581 CG HIS A 102 2.938 -2.780 -3.353 1.00 0.00 C ATOM 1582 ND1 HIS A 102 3.150 -3.543 -2.220 1.00 0.00 N ATOM 1583 CD2 HIS A 102 2.162 -1.727 -2.956 1.00 0.00 C ATOM 1584 CE1 HIS A 102 2.549 -2.977 -1.193 1.00 0.00 C ATOM 1585 NE2 HIS A 102 1.948 -1.877 -1.611 1.00 0.00 N ATOM 0 H HIS A 102 2.509 -2.552 -7.139 1.00 0.00 H new ATOM 0 HA HIS A 102 3.837 -1.055 -4.933 1.00 0.00 H new ATOM 0 HB2 HIS A 102 2.913 -3.851 -5.187 1.00 0.00 H new ATOM 0 HB3 HIS A 102 4.512 -3.613 -4.511 1.00 0.00 H new ATOM 0 HD1 HIS A 102 3.688 -4.409 -2.184 1.00 0.00 H new ATOM 0 HD2 HIS A 102 1.789 -0.930 -3.582 1.00 0.00 H new ATOM 0 HE1 HIS A 102 2.548 -3.350 -0.179 1.00 0.00 H new ATOM 1594 N SER A 103 5.865 -1.063 -6.308 1.00 0.00 N ATOM 1595 CA SER A 103 7.053 -0.984 -7.117 1.00 0.00 C ATOM 1596 C SER A 103 8.177 -0.418 -6.278 1.00 0.00 C ATOM 1597 O SER A 103 7.932 0.092 -5.197 1.00 0.00 O ATOM 1598 CB SER A 103 6.789 -0.103 -8.342 1.00 0.00 C ATOM 1599 OG SER A 103 7.958 0.079 -9.119 1.00 0.00 O ATOM 0 H SER A 103 5.760 -0.297 -5.643 1.00 0.00 H new ATOM 0 HA SER A 103 7.335 -1.976 -7.469 1.00 0.00 H new ATOM 0 HB2 SER A 103 6.011 -0.557 -8.956 1.00 0.00 H new ATOM 0 HB3 SER A 103 6.413 0.867 -8.018 1.00 0.00 H new ATOM 0 HG SER A 103 7.862 -0.396 -9.971 1.00 0.00 H new ATOM 1605 N GLY A 104 9.392 -0.550 -6.755 1.00 0.00 N ATOM 1606 CA GLY A 104 10.540 0.047 -6.093 1.00 0.00 C ATOM 1607 C GLY A 104 11.768 -0.068 -6.961 1.00 0.00 C ATOM 1608 O GLY A 104 11.870 -0.996 -7.766 1.00 0.00 O ATOM 0 H GLY A 104 9.617 -1.068 -7.604 1.00 0.00 H new ATOM 0 HA2 GLY A 104 10.338 1.096 -5.876 1.00 0.00 H new ATOM 0 HA3 GLY A 104 10.715 -0.448 -5.138 1.00 0.00 H new ATOM 1612 N TRP A 105 12.692 0.869 -6.833 1.00 0.00 N ATOM 1613 CA TRP A 105 13.842 0.901 -7.730 1.00 0.00 C ATOM 1614 C TRP A 105 15.176 0.795 -6.995 1.00 0.00 C ATOM 1615 O TRP A 105 15.342 1.354 -5.912 1.00 0.00 O ATOM 1616 CB TRP A 105 13.813 2.175 -8.580 1.00 0.00 C ATOM 1617 CG TRP A 105 12.660 2.222 -9.536 1.00 0.00 C ATOM 1618 CD1 TRP A 105 12.479 1.426 -10.627 1.00 0.00 C ATOM 1619 CD2 TRP A 105 11.534 3.112 -9.497 1.00 0.00 C ATOM 1620 NE1 TRP A 105 11.309 1.758 -11.265 1.00 0.00 N ATOM 1621 CE2 TRP A 105 10.710 2.789 -10.591 1.00 0.00 C ATOM 1622 CE3 TRP A 105 11.144 4.145 -8.643 1.00 0.00 C ATOM 1623 CZ2 TRP A 105 9.519 3.462 -10.852 1.00 0.00 C ATOM 1624 CZ3 TRP A 105 9.961 4.813 -8.904 1.00 0.00 C ATOM 1625 CH2 TRP A 105 9.161 4.469 -10.000 1.00 0.00 C ATOM 0 H TRP A 105 12.673 1.608 -6.130 1.00 0.00 H new ATOM 0 HA TRP A 105 13.763 0.023 -8.372 1.00 0.00 H new ATOM 0 HB2 TRP A 105 13.766 3.042 -7.921 1.00 0.00 H new ATOM 0 HB3 TRP A 105 14.745 2.251 -9.141 1.00 0.00 H new ATOM 0 HD1 TRP A 105 13.157 0.647 -10.944 1.00 0.00 H new ATOM 0 HE1 TRP A 105 10.945 1.309 -12.105 1.00 0.00 H new ATOM 0 HE3 TRP A 105 11.754 4.418 -7.795 1.00 0.00 H new ATOM 0 HZ2 TRP A 105 8.901 3.198 -11.697 1.00 0.00 H new ATOM 0 HZ3 TRP A 105 9.649 5.614 -8.250 1.00 0.00 H new ATOM 0 HH2 TRP A 105 8.243 5.010 -10.176 1.00 0.00 H new ATOM 1636 N LYS A 106 16.106 0.061 -7.631 1.00 0.00 N ATOM 1637 CA LYS A 106 17.518 -0.051 -7.214 1.00 0.00 C ATOM 1638 C LYS A 106 17.762 -1.223 -6.249 1.00 0.00 C ATOM 1639 O LYS A 106 18.611 -1.144 -5.360 1.00 0.00 O ATOM 1640 CB LYS A 106 18.043 1.261 -6.614 1.00 0.00 C ATOM 1641 CG LYS A 106 19.562 1.322 -6.503 1.00 0.00 C ATOM 1642 CD LYS A 106 20.008 2.360 -5.489 1.00 0.00 C ATOM 1643 CE LYS A 106 19.438 2.066 -4.107 1.00 0.00 C ATOM 1644 NZ LYS A 106 19.761 0.688 -3.642 1.00 0.00 N ATOM 0 H LYS A 106 15.894 -0.483 -8.467 1.00 0.00 H new ATOM 0 HA LYS A 106 18.081 -0.259 -8.124 1.00 0.00 H new ATOM 0 HB2 LYS A 106 17.699 2.094 -7.228 1.00 0.00 H new ATOM 0 HB3 LYS A 106 17.610 1.395 -5.623 1.00 0.00 H new ATOM 0 HG2 LYS A 106 19.946 0.343 -6.215 1.00 0.00 H new ATOM 0 HG3 LYS A 106 19.989 1.558 -7.478 1.00 0.00 H new ATOM 0 HD2 LYS A 106 21.097 2.378 -5.439 1.00 0.00 H new ATOM 0 HD3 LYS A 106 19.687 3.350 -5.814 1.00 0.00 H new ATOM 0 HE2 LYS A 106 19.832 2.789 -3.393 1.00 0.00 H new ATOM 0 HE3 LYS A 106 18.356 2.195 -4.128 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 19.615 0.625 -2.614 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 19.141 0.005 -4.122 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 20.753 0.470 -3.864 1.00 0.00 H new ATOM 1658 N GLU A 107 17.034 -2.315 -6.436 1.00 0.00 N ATOM 1659 CA GLU A 107 17.287 -3.542 -5.675 1.00 0.00 C ATOM 1660 C GLU A 107 17.598 -4.706 -6.622 1.00 0.00 C ATOM 1661 O GLU A 107 17.329 -4.617 -7.821 1.00 0.00 O ATOM 1662 CB GLU A 107 16.090 -3.894 -4.784 1.00 0.00 C ATOM 1663 CG GLU A 107 15.996 -3.079 -3.504 1.00 0.00 C ATOM 1664 CD GLU A 107 15.650 -1.624 -3.737 1.00 0.00 C ATOM 1665 OE1 GLU A 107 14.610 -1.358 -4.370 1.00 0.00 O ATOM 1666 OE2 GLU A 107 16.410 -0.747 -3.270 1.00 0.00 O ATOM 0 H GLU A 107 16.266 -2.382 -7.104 1.00 0.00 H new ATOM 0 HA GLU A 107 18.151 -3.367 -5.035 1.00 0.00 H new ATOM 0 HB2 GLU A 107 15.173 -3.754 -5.357 1.00 0.00 H new ATOM 0 HB3 GLU A 107 16.145 -4.951 -4.524 1.00 0.00 H new ATOM 0 HG2 GLU A 107 15.242 -3.524 -2.854 1.00 0.00 H new ATOM 0 HG3 GLU A 107 16.947 -3.138 -2.975 1.00 0.00 H new ATOM 1673 N PRO A 108 18.187 -5.806 -6.107 1.00 0.00 N ATOM 1674 CA PRO A 108 18.533 -6.983 -6.904 1.00 0.00 C ATOM 1675 C PRO A 108 17.428 -8.048 -6.908 1.00 0.00 C ATOM 1676 O PRO A 108 16.255 -7.720 -6.754 1.00 0.00 O ATOM 1677 CB PRO A 108 19.784 -7.493 -6.190 1.00 0.00 C ATOM 1678 CG PRO A 108 19.613 -7.099 -4.753 1.00 0.00 C ATOM 1679 CD PRO A 108 18.584 -5.991 -4.701 1.00 0.00 C ATOM 0 HA PRO A 108 18.677 -6.750 -7.959 1.00 0.00 H new ATOM 0 HB2 PRO A 108 19.881 -8.574 -6.292 1.00 0.00 H new ATOM 0 HB3 PRO A 108 20.686 -7.051 -6.614 1.00 0.00 H new ATOM 0 HG2 PRO A 108 19.287 -7.952 -4.158 1.00 0.00 H new ATOM 0 HG3 PRO A 108 20.561 -6.761 -4.333 1.00 0.00 H new ATOM 0 HD2 PRO A 108 17.732 -6.266 -4.079 1.00 0.00 H new ATOM 0 HD3 PRO A 108 19.003 -5.077 -4.281 1.00 0.00 H new ATOM 1687 N ASN A 109 17.799 -9.313 -7.113 1.00 0.00 N ATOM 1688 CA ASN A 109 16.834 -10.422 -7.023 1.00 0.00 C ATOM 1689 C ASN A 109 16.442 -10.667 -5.565 1.00 0.00 C ATOM 1690 O ASN A 109 15.463 -11.354 -5.258 1.00 0.00 O ATOM 1691 CB ASN A 109 17.405 -11.701 -7.644 1.00 0.00 C ATOM 1692 CG ASN A 109 17.510 -11.624 -9.158 1.00 0.00 C ATOM 1693 OD1 ASN A 109 16.729 -10.938 -9.820 1.00 0.00 O ATOM 1694 ND2 ASN A 109 18.478 -12.330 -9.723 1.00 0.00 N ATOM 0 H ASN A 109 18.751 -9.599 -7.341 1.00 0.00 H new ATOM 0 HA ASN A 109 15.943 -10.143 -7.585 1.00 0.00 H new ATOM 0 HB2 ASN A 109 18.393 -11.893 -7.225 1.00 0.00 H new ATOM 0 HB3 ASN A 109 16.773 -12.546 -7.371 1.00 0.00 H new ATOM 0 HD21 ASN A 109 18.594 -12.316 -10.736 1.00 0.00 H new ATOM 0 HD22 ASN A 109 19.107 -12.887 -9.145 1.00 0.00 H new ATOM 1701 N GLN A 110 17.250 -10.123 -4.676 1.00 0.00 N ATOM 1702 CA GLN A 110 16.914 -9.995 -3.269 1.00 0.00 C ATOM 1703 C GLN A 110 15.901 -8.871 -3.113 1.00 0.00 C ATOM 1704 O GLN A 110 15.769 -8.048 -4.014 1.00 0.00 O ATOM 1705 CB GLN A 110 18.158 -9.730 -2.428 1.00 0.00 C ATOM 1706 CG GLN A 110 17.918 -9.924 -0.944 1.00 0.00 C ATOM 1707 CD GLN A 110 19.200 -10.053 -0.151 1.00 0.00 C ATOM 1708 OE1 GLN A 110 20.234 -9.485 -0.508 1.00 0.00 O ATOM 1709 NE2 GLN A 110 19.147 -10.811 0.933 1.00 0.00 N ATOM 0 H GLN A 110 18.170 -9.752 -4.912 1.00 0.00 H new ATOM 0 HA GLN A 110 16.482 -10.930 -2.912 1.00 0.00 H new ATOM 0 HB2 GLN A 110 18.958 -10.396 -2.752 1.00 0.00 H new ATOM 0 HB3 GLN A 110 18.500 -8.710 -2.606 1.00 0.00 H new ATOM 0 HG2 GLN A 110 17.343 -9.081 -0.561 1.00 0.00 H new ATOM 0 HG3 GLN A 110 17.312 -10.817 -0.793 1.00 0.00 H new ATOM 0 HE21 GLN A 110 18.272 -11.265 1.196 1.00 0.00 H new ATOM 0 HE22 GLN A 110 19.981 -10.941 1.505 1.00 0.00 H new ATOM 1718 N VAL A 111 15.185 -8.798 -1.995 1.00 0.00 N ATOM 1719 CA VAL A 111 14.057 -7.894 -1.932 1.00 0.00 C ATOM 1720 C VAL A 111 14.485 -6.469 -1.799 1.00 0.00 C ATOM 1721 O VAL A 111 15.661 -6.115 -1.719 1.00 0.00 O ATOM 1722 CB VAL A 111 13.151 -8.037 -0.686 1.00 0.00 C ATOM 1723 CG1 VAL A 111 12.317 -9.279 -0.636 1.00 0.00 C ATOM 1724 CG2 VAL A 111 13.948 -7.850 0.597 1.00 0.00 C ATOM 0 H VAL A 111 15.362 -9.338 -1.148 1.00 0.00 H new ATOM 0 HA VAL A 111 13.536 -8.151 -2.854 1.00 0.00 H new ATOM 0 HB VAL A 111 12.425 -7.229 -0.779 1.00 0.00 H new ATOM 0 HG11 VAL A 111 11.720 -9.280 0.276 1.00 0.00 H new ATOM 0 HG12 VAL A 111 11.656 -9.308 -1.502 1.00 0.00 H new ATOM 0 HG13 VAL A 111 12.967 -10.154 -0.646 1.00 0.00 H new ATOM 0 HG21 VAL A 111 13.285 -7.956 1.456 1.00 0.00 H new ATOM 0 HG22 VAL A 111 14.734 -8.603 0.650 1.00 0.00 H new ATOM 0 HG23 VAL A 111 14.396 -6.857 0.605 1.00 0.00 H new ATOM 1734 N ILE A 112 13.445 -5.691 -1.743 1.00 0.00 N ATOM 1735 CA ILE A 112 13.501 -4.261 -1.613 1.00 0.00 C ATOM 1736 C ILE A 112 14.378 -3.809 -0.435 1.00 0.00 C ATOM 1737 O ILE A 112 14.963 -2.731 -0.472 1.00 0.00 O ATOM 1738 CB ILE A 112 12.085 -3.734 -1.401 1.00 0.00 C ATOM 1739 CG1 ILE A 112 11.041 -4.762 -1.825 1.00 0.00 C ATOM 1740 CG2 ILE A 112 11.896 -2.479 -2.198 1.00 0.00 C ATOM 1741 CD1 ILE A 112 11.020 -5.033 -3.310 1.00 0.00 C ATOM 0 H ILE A 112 12.491 -6.050 -1.789 1.00 0.00 H new ATOM 0 HA ILE A 112 13.945 -3.863 -2.526 1.00 0.00 H new ATOM 0 HB ILE A 112 11.953 -3.530 -0.338 1.00 0.00 H new ATOM 0 HG12 ILE A 112 11.230 -5.697 -1.297 1.00 0.00 H new ATOM 0 HG13 ILE A 112 10.056 -4.414 -1.515 1.00 0.00 H new ATOM 0 HG21 ILE A 112 10.885 -2.101 -2.048 1.00 0.00 H new ATOM 0 HG22 ILE A 112 12.616 -1.729 -1.871 1.00 0.00 H new ATOM 0 HG23 ILE A 112 12.050 -2.693 -3.256 1.00 0.00 H new ATOM 0 HD11 ILE A 112 10.252 -5.774 -3.534 1.00 0.00 H new ATOM 0 HD12 ILE A 112 10.800 -4.109 -3.845 1.00 0.00 H new ATOM 0 HD13 ILE A 112 11.993 -5.412 -3.625 1.00 0.00 H new ATOM 1753 N GLY A 113 14.438 -4.612 0.620 1.00 0.00 N ATOM 1754 CA GLY A 113 15.309 -4.297 1.740 1.00 0.00 C ATOM 1755 C GLY A 113 14.725 -4.731 3.068 1.00 0.00 C ATOM 1756 O GLY A 113 14.278 -3.894 3.842 1.00 0.00 O ATOM 0 H GLY A 113 13.902 -5.474 0.722 1.00 0.00 H new ATOM 0 HA2 GLY A 113 16.273 -4.784 1.594 1.00 0.00 H new ATOM 0 HA3 GLY A 113 15.494 -3.223 1.762 1.00 0.00 H new ATOM 1760 N LYS A 114 14.762 -6.043 3.328 1.00 0.00 N ATOM 1761 CA LYS A 114 14.116 -6.658 4.503 1.00 0.00 C ATOM 1762 C LYS A 114 12.609 -6.783 4.289 1.00 0.00 C ATOM 1763 O LYS A 114 11.853 -7.004 5.235 1.00 0.00 O ATOM 1764 CB LYS A 114 14.390 -5.883 5.801 1.00 0.00 C ATOM 1765 CG LYS A 114 15.860 -5.794 6.180 1.00 0.00 C ATOM 1766 CD LYS A 114 16.040 -5.037 7.486 1.00 0.00 C ATOM 1767 CE LYS A 114 17.507 -4.853 7.832 1.00 0.00 C ATOM 1768 NZ LYS A 114 17.685 -4.097 9.100 1.00 0.00 N ATOM 0 H LYS A 114 15.242 -6.715 2.729 1.00 0.00 H new ATOM 0 HA LYS A 114 14.554 -7.650 4.612 1.00 0.00 H new ATOM 0 HB2 LYS A 114 13.992 -4.874 5.698 1.00 0.00 H new ATOM 0 HB3 LYS A 114 13.845 -6.359 6.616 1.00 0.00 H new ATOM 0 HG2 LYS A 114 16.276 -6.797 6.276 1.00 0.00 H new ATOM 0 HG3 LYS A 114 16.415 -5.294 5.386 1.00 0.00 H new ATOM 0 HD2 LYS A 114 15.559 -4.062 7.410 1.00 0.00 H new ATOM 0 HD3 LYS A 114 15.541 -5.577 8.291 1.00 0.00 H new ATOM 0 HE2 LYS A 114 17.985 -5.829 7.921 1.00 0.00 H new ATOM 0 HE3 LYS A 114 18.008 -4.325 7.021 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 18.700 -3.992 9.302 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 17.251 -3.156 9.007 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 17.229 -4.613 9.879 1.00 0.00 H new ATOM 1782 N ALA A 115 12.187 -6.655 3.033 1.00 0.00 N ATOM 1783 CA ALA A 115 10.775 -6.763 2.664 1.00 0.00 C ATOM 1784 C ALA A 115 10.248 -8.169 2.935 1.00 0.00 C ATOM 1785 O ALA A 115 9.064 -8.362 3.210 1.00 0.00 O ATOM 1786 CB ALA A 115 10.588 -6.392 1.196 1.00 0.00 C ATOM 0 H ALA A 115 12.809 -6.474 2.245 1.00 0.00 H new ATOM 0 HA ALA A 115 10.203 -6.067 3.277 1.00 0.00 H new ATOM 0 HB1 ALA A 115 9.534 -6.475 0.931 1.00 0.00 H new ATOM 0 HB2 ALA A 115 10.923 -5.367 1.034 1.00 0.00 H new ATOM 0 HB3 ALA A 115 11.173 -7.068 0.573 1.00 0.00 H new ATOM 1792 N ASN A 116 11.150 -9.141 2.861 1.00 0.00 N ATOM 1793 CA ASN A 116 10.831 -10.544 3.124 1.00 0.00 C ATOM 1794 C ASN A 116 12.099 -11.367 2.960 1.00 0.00 C ATOM 1795 O ASN A 116 12.665 -11.856 3.932 1.00 0.00 O ATOM 1796 CB ASN A 116 9.753 -11.069 2.159 1.00 0.00 C ATOM 1797 CG ASN A 116 9.106 -12.378 2.615 1.00 0.00 C ATOM 1798 OD1 ASN A 116 7.961 -12.659 2.270 1.00 0.00 O ATOM 1799 ND2 ASN A 116 9.817 -13.184 3.393 1.00 0.00 N ATOM 0 H ASN A 116 12.127 -8.980 2.616 1.00 0.00 H new ATOM 0 HA ASN A 116 10.441 -10.629 4.138 1.00 0.00 H new ATOM 0 HB2 ASN A 116 8.978 -10.311 2.046 1.00 0.00 H new ATOM 0 HB3 ASN A 116 10.199 -11.217 1.176 1.00 0.00 H new ATOM 0 HD21 ASN A 116 9.415 -14.062 3.720 1.00 0.00 H new ATOM 0 HD22 ASN A 116 10.766 -12.925 3.664 1.00 0.00 H new ATOM 1806 N GLU A 117 12.540 -11.493 1.715 1.00 0.00 N ATOM 1807 CA GLU A 117 13.771 -12.195 1.388 1.00 0.00 C ATOM 1808 C GLU A 117 14.084 -12.002 -0.091 1.00 0.00 C ATOM 1809 O GLU A 117 14.994 -11.258 -0.456 1.00 0.00 O ATOM 1810 CB GLU A 117 13.647 -13.687 1.708 1.00 0.00 C ATOM 1811 CG GLU A 117 14.945 -14.455 1.540 1.00 0.00 C ATOM 1812 CD GLU A 117 14.780 -15.925 1.835 1.00 0.00 C ATOM 1813 OE1 GLU A 117 14.929 -16.320 3.010 1.00 0.00 O ATOM 1814 OE2 GLU A 117 14.493 -16.692 0.891 1.00 0.00 O ATOM 0 H GLU A 117 12.053 -11.111 0.904 1.00 0.00 H new ATOM 0 HA GLU A 117 14.582 -11.785 1.990 1.00 0.00 H new ATOM 0 HB2 GLU A 117 13.297 -13.802 2.734 1.00 0.00 H new ATOM 0 HB3 GLU A 117 12.888 -14.127 1.061 1.00 0.00 H new ATOM 0 HG2 GLU A 117 15.310 -14.330 0.521 1.00 0.00 H new ATOM 0 HG3 GLU A 117 15.702 -14.036 2.203 1.00 0.00 H new ATOM 1821 N LYS A 118 13.297 -12.655 -0.935 1.00 0.00 N ATOM 1822 CA LYS A 118 13.432 -12.531 -2.379 1.00 0.00 C ATOM 1823 C LYS A 118 12.548 -11.424 -2.920 1.00 0.00 C ATOM 1824 O LYS A 118 11.391 -11.295 -2.525 1.00 0.00 O ATOM 1825 CB LYS A 118 13.025 -13.817 -3.055 1.00 0.00 C ATOM 1826 CG LYS A 118 13.825 -15.033 -2.640 1.00 0.00 C ATOM 1827 CD LYS A 118 15.292 -14.903 -3.018 1.00 0.00 C ATOM 1828 CE LYS A 118 16.086 -16.145 -2.637 1.00 0.00 C ATOM 1829 NZ LYS A 118 16.231 -16.292 -1.163 1.00 0.00 N ATOM 0 H LYS A 118 12.550 -13.283 -0.639 1.00 0.00 H new ATOM 0 HA LYS A 118 14.477 -12.302 -2.586 1.00 0.00 H new ATOM 0 HB2 LYS A 118 11.972 -14.004 -2.845 1.00 0.00 H new ATOM 0 HB3 LYS A 118 13.118 -13.689 -4.134 1.00 0.00 H new ATOM 0 HG2 LYS A 118 13.739 -15.174 -1.563 1.00 0.00 H new ATOM 0 HG3 LYS A 118 13.406 -15.922 -3.112 1.00 0.00 H new ATOM 0 HD2 LYS A 118 15.377 -14.732 -4.091 1.00 0.00 H new ATOM 0 HD3 LYS A 118 15.719 -14.032 -2.522 1.00 0.00 H new ATOM 0 HE2 LYS A 118 15.591 -17.028 -3.041 1.00 0.00 H new ATOM 0 HE3 LYS A 118 17.074 -16.096 -3.094 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 16.835 -17.112 -0.954 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 16.665 -15.433 -0.770 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 15.294 -16.434 -0.734 1.00 0.00 H new ATOM 1843 N SER A 119 13.082 -10.648 -3.843 1.00 0.00 N ATOM 1844 CA SER A 119 12.303 -9.629 -4.532 1.00 0.00 C ATOM 1845 C SER A 119 11.119 -10.291 -5.249 1.00 0.00 C ATOM 1846 O SER A 119 10.031 -9.727 -5.368 1.00 0.00 O ATOM 1847 CB SER A 119 13.182 -8.889 -5.532 1.00 0.00 C ATOM 1848 OG SER A 119 13.628 -9.753 -6.562 1.00 0.00 O ATOM 0 H SER A 119 14.057 -10.702 -4.137 1.00 0.00 H new ATOM 0 HA SER A 119 11.923 -8.909 -3.807 1.00 0.00 H new ATOM 0 HB2 SER A 119 12.624 -8.060 -5.966 1.00 0.00 H new ATOM 0 HB3 SER A 119 14.041 -8.460 -5.017 1.00 0.00 H new ATOM 0 HG SER A 119 13.364 -9.388 -7.432 1.00 0.00 H new ATOM 1854 N SER A 120 11.354 -11.491 -5.748 1.00 0.00 N ATOM 1855 CA SER A 120 10.314 -12.257 -6.407 1.00 0.00 C ATOM 1856 C SER A 120 9.220 -12.696 -5.423 1.00 0.00 C ATOM 1857 O SER A 120 8.034 -12.645 -5.747 1.00 0.00 O ATOM 1858 CB SER A 120 10.937 -13.467 -7.104 1.00 0.00 C ATOM 1859 OG SER A 120 11.890 -14.099 -6.263 1.00 0.00 O ATOM 0 H SER A 120 12.260 -11.957 -5.709 1.00 0.00 H new ATOM 0 HA SER A 120 9.835 -11.619 -7.150 1.00 0.00 H new ATOM 0 HB2 SER A 120 10.156 -14.178 -7.375 1.00 0.00 H new ATOM 0 HB3 SER A 120 11.416 -13.151 -8.031 1.00 0.00 H new ATOM 0 HG SER A 120 12.275 -14.871 -6.727 1.00 0.00 H new ATOM 1865 N VAL A 121 9.609 -13.110 -4.219 1.00 0.00 N ATOM 1866 CA VAL A 121 8.630 -13.593 -3.246 1.00 0.00 C ATOM 1867 C VAL A 121 7.790 -12.443 -2.737 1.00 0.00 C ATOM 1868 O VAL A 121 6.599 -12.602 -2.505 1.00 0.00 O ATOM 1869 CB VAL A 121 9.246 -14.384 -2.058 1.00 0.00 C ATOM 1870 CG1 VAL A 121 10.097 -15.533 -2.568 1.00 0.00 C ATOM 1871 CG2 VAL A 121 10.038 -13.487 -1.120 1.00 0.00 C ATOM 0 H VAL A 121 10.577 -13.122 -3.897 1.00 0.00 H new ATOM 0 HA VAL A 121 8.004 -14.307 -3.780 1.00 0.00 H new ATOM 0 HB VAL A 121 8.421 -14.796 -1.476 1.00 0.00 H new ATOM 0 HG11 VAL A 121 10.520 -16.076 -1.723 1.00 0.00 H new ATOM 0 HG12 VAL A 121 9.479 -16.208 -3.160 1.00 0.00 H new ATOM 0 HG13 VAL A 121 10.903 -15.141 -3.188 1.00 0.00 H new ATOM 0 HG21 VAL A 121 10.449 -14.084 -0.306 1.00 0.00 H new ATOM 0 HG22 VAL A 121 10.852 -13.014 -1.670 1.00 0.00 H new ATOM 0 HG23 VAL A 121 9.382 -12.719 -0.711 1.00 0.00 H new ATOM 1881 N VAL A 122 8.407 -11.275 -2.585 1.00 0.00 N ATOM 1882 CA VAL A 122 7.697 -10.119 -2.078 1.00 0.00 C ATOM 1883 C VAL A 122 6.632 -9.660 -3.074 1.00 0.00 C ATOM 1884 O VAL A 122 5.518 -9.278 -2.689 1.00 0.00 O ATOM 1885 CB VAL A 122 8.666 -8.980 -1.722 1.00 0.00 C ATOM 1886 CG1 VAL A 122 9.374 -8.459 -2.947 1.00 0.00 C ATOM 1887 CG2 VAL A 122 7.942 -7.865 -0.995 1.00 0.00 C ATOM 0 H VAL A 122 9.389 -11.110 -2.805 1.00 0.00 H new ATOM 0 HA VAL A 122 7.190 -10.409 -1.158 1.00 0.00 H new ATOM 0 HB VAL A 122 9.425 -9.384 -1.052 1.00 0.00 H new ATOM 0 HG11 VAL A 122 10.052 -7.655 -2.661 1.00 0.00 H new ATOM 0 HG12 VAL A 122 9.943 -9.266 -3.409 1.00 0.00 H new ATOM 0 HG13 VAL A 122 8.640 -8.079 -3.658 1.00 0.00 H new ATOM 0 HG21 VAL A 122 8.648 -7.070 -0.753 1.00 0.00 H new ATOM 0 HG22 VAL A 122 7.152 -7.468 -1.633 1.00 0.00 H new ATOM 0 HG23 VAL A 122 7.505 -8.254 -0.076 1.00 0.00 H new ATOM 1897 N ARG A 123 6.952 -9.731 -4.363 1.00 0.00 N ATOM 1898 CA ARG A 123 5.955 -9.447 -5.382 1.00 0.00 C ATOM 1899 C ARG A 123 4.872 -10.523 -5.337 1.00 0.00 C ATOM 1900 O ARG A 123 3.708 -10.262 -5.631 1.00 0.00 O ATOM 1901 CB ARG A 123 6.579 -9.356 -6.783 1.00 0.00 C ATOM 1902 CG ARG A 123 6.646 -10.672 -7.546 1.00 0.00 C ATOM 1903 CD ARG A 123 6.959 -10.439 -9.014 1.00 0.00 C ATOM 1904 NE ARG A 123 6.903 -11.670 -9.797 1.00 0.00 N ATOM 1905 CZ ARG A 123 6.535 -11.722 -11.077 1.00 0.00 C ATOM 1906 NH1 ARG A 123 6.192 -10.611 -11.719 1.00 0.00 N ATOM 1907 NH2 ARG A 123 6.511 -12.886 -11.713 1.00 0.00 N ATOM 0 H ARG A 123 7.876 -9.978 -4.719 1.00 0.00 H new ATOM 0 HA ARG A 123 5.512 -8.474 -5.172 1.00 0.00 H new ATOM 0 HB2 ARG A 123 6.007 -8.640 -7.373 1.00 0.00 H new ATOM 0 HB3 ARG A 123 7.589 -8.956 -6.689 1.00 0.00 H new ATOM 0 HG2 ARG A 123 7.410 -11.313 -7.106 1.00 0.00 H new ATOM 0 HG3 ARG A 123 5.696 -11.198 -7.453 1.00 0.00 H new ATOM 0 HD2 ARG A 123 6.251 -9.718 -9.424 1.00 0.00 H new ATOM 0 HD3 ARG A 123 7.952 -9.998 -9.106 1.00 0.00 H new ATOM 0 HE ARG A 123 7.161 -12.543 -9.337 1.00 0.00 H new ATOM 0 HH11 ARG A 123 6.210 -9.715 -11.232 1.00 0.00 H new ATOM 0 HH12 ARG A 123 5.911 -10.654 -12.699 1.00 0.00 H new ATOM 0 HH21 ARG A 123 6.774 -13.741 -11.222 1.00 0.00 H new ATOM 0 HH22 ARG A 123 6.229 -12.926 -12.693 1.00 0.00 H new ATOM 1921 N GLY A 124 5.273 -11.725 -4.931 1.00 0.00 N ATOM 1922 CA GLY A 124 4.340 -12.831 -4.795 1.00 0.00 C ATOM 1923 C GLY A 124 3.410 -12.637 -3.614 1.00 0.00 C ATOM 1924 O GLY A 124 2.261 -13.103 -3.620 1.00 0.00 O ATOM 0 H GLY A 124 6.238 -11.954 -4.692 1.00 0.00 H new ATOM 0 HA2 GLY A 124 3.753 -12.927 -5.709 1.00 0.00 H new ATOM 0 HA3 GLY A 124 4.894 -13.762 -4.673 1.00 0.00 H new ATOM 1928 N LYS A 125 3.903 -11.917 -2.611 1.00 0.00 N ATOM 1929 CA LYS A 125 3.116 -11.576 -1.441 1.00 0.00 C ATOM 1930 C LYS A 125 1.943 -10.755 -1.874 1.00 0.00 C ATOM 1931 O LYS A 125 0.807 -10.967 -1.454 1.00 0.00 O ATOM 1932 CB LYS A 125 3.953 -10.736 -0.495 1.00 0.00 C ATOM 1933 CG LYS A 125 5.277 -11.388 -0.172 1.00 0.00 C ATOM 1934 CD LYS A 125 6.048 -10.615 0.889 1.00 0.00 C ATOM 1935 CE LYS A 125 5.358 -10.668 2.246 1.00 0.00 C ATOM 1936 NZ LYS A 125 5.244 -12.057 2.764 1.00 0.00 N ATOM 0 H LYS A 125 4.857 -11.557 -2.591 1.00 0.00 H new ATOM 0 HA LYS A 125 2.790 -12.489 -0.944 1.00 0.00 H new ATOM 0 HB2 LYS A 125 4.131 -9.758 -0.941 1.00 0.00 H new ATOM 0 HB3 LYS A 125 3.398 -10.569 0.428 1.00 0.00 H new ATOM 0 HG2 LYS A 125 5.105 -12.407 0.175 1.00 0.00 H new ATOM 0 HG3 LYS A 125 5.878 -11.457 -1.079 1.00 0.00 H new ATOM 0 HD2 LYS A 125 7.054 -11.025 0.977 1.00 0.00 H new ATOM 0 HD3 LYS A 125 6.154 -9.576 0.576 1.00 0.00 H new ATOM 0 HE2 LYS A 125 5.915 -10.061 2.959 1.00 0.00 H new ATOM 0 HE3 LYS A 125 4.363 -10.230 2.163 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 4.975 -12.032 3.768 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 4.518 -12.570 2.224 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 6.159 -12.542 2.662 1.00 0.00 H new ATOM 1950 N MET A 126 2.245 -9.834 -2.759 1.00 0.00 N ATOM 1951 CA MET A 126 1.245 -8.959 -3.309 1.00 0.00 C ATOM 1952 C MET A 126 0.427 -9.724 -4.334 1.00 0.00 C ATOM 1953 O MET A 126 -0.749 -9.447 -4.555 1.00 0.00 O ATOM 1954 CB MET A 126 1.921 -7.743 -3.938 1.00 0.00 C ATOM 1955 CG MET A 126 3.081 -7.230 -3.103 1.00 0.00 C ATOM 1956 SD MET A 126 2.577 -6.671 -1.464 1.00 0.00 S ATOM 1957 CE MET A 126 4.159 -6.622 -0.626 1.00 0.00 C ATOM 0 H MET A 126 3.187 -9.673 -3.115 1.00 0.00 H new ATOM 0 HA MET A 126 0.577 -8.607 -2.523 1.00 0.00 H new ATOM 0 HB2 MET A 126 2.281 -8.005 -4.933 1.00 0.00 H new ATOM 0 HB3 MET A 126 1.187 -6.947 -4.064 1.00 0.00 H new ATOM 0 HG2 MET A 126 3.824 -8.021 -2.999 1.00 0.00 H new ATOM 0 HG3 MET A 126 3.564 -6.406 -3.629 1.00 0.00 H new ATOM 0 HE1 MET A 126 4.210 -7.431 0.102 1.00 0.00 H new ATOM 0 HE2 MET A 126 4.961 -6.739 -1.355 1.00 0.00 H new ATOM 0 HE3 MET A 126 4.270 -5.666 -0.114 1.00 0.00 H new ATOM 1967 N ASP A 127 1.023 -10.771 -4.872 1.00 0.00 N ATOM 1968 CA ASP A 127 0.420 -11.480 -5.985 1.00 0.00 C ATOM 1969 C ASP A 127 -0.723 -12.370 -5.503 1.00 0.00 C ATOM 1970 O ASP A 127 -1.588 -12.772 -6.282 1.00 0.00 O ATOM 1971 CB ASP A 127 1.493 -12.308 -6.691 1.00 0.00 C ATOM 1972 CG ASP A 127 0.924 -13.279 -7.702 1.00 0.00 C ATOM 1973 OD1 ASP A 127 0.497 -12.829 -8.785 1.00 0.00 O ATOM 1974 OD2 ASP A 127 0.910 -14.496 -7.421 1.00 0.00 O ATOM 0 H ASP A 127 1.918 -11.148 -4.559 1.00 0.00 H new ATOM 0 HA ASP A 127 0.002 -10.760 -6.688 1.00 0.00 H new ATOM 0 HB2 ASP A 127 2.190 -11.637 -7.193 1.00 0.00 H new ATOM 0 HB3 ASP A 127 2.065 -12.862 -5.946 1.00 0.00 H new ATOM 1979 N GLY A 128 -0.769 -12.602 -4.204 1.00 0.00 N ATOM 1980 CA GLY A 128 -1.911 -13.286 -3.624 1.00 0.00 C ATOM 1981 C GLY A 128 -2.581 -12.480 -2.523 1.00 0.00 C ATOM 1982 O GLY A 128 -3.770 -12.125 -2.605 1.00 0.00 O ATOM 0 H GLY A 128 -0.043 -12.333 -3.540 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -2.639 -13.498 -4.407 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -1.588 -14.246 -3.221 1.00 0.00 H new ATOM 1986 N GLY A 129 -1.804 -12.147 -1.508 1.00 0.00 N ATOM 1987 CA GLY A 129 -2.360 -11.522 -0.330 1.00 0.00 C ATOM 1988 C GLY A 129 -2.786 -10.093 -0.568 1.00 0.00 C ATOM 1989 O GLY A 129 -3.556 -9.536 0.212 1.00 0.00 O ATOM 0 H GLY A 129 -0.796 -12.299 -1.479 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -3.219 -12.100 0.010 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -1.621 -11.547 0.471 1.00 0.00 H new ATOM 1993 N TRP A 130 -2.320 -9.491 -1.654 1.00 0.00 N ATOM 1994 CA TRP A 130 -2.571 -8.085 -1.868 1.00 0.00 C ATOM 1995 C TRP A 130 -3.952 -7.849 -2.469 1.00 0.00 C ATOM 1996 O TRP A 130 -4.502 -6.770 -2.329 1.00 0.00 O ATOM 1997 CB TRP A 130 -1.493 -7.514 -2.752 1.00 0.00 C ATOM 1998 CG TRP A 130 -1.302 -6.056 -2.634 1.00 0.00 C ATOM 1999 CD1 TRP A 130 -1.274 -5.187 -3.664 1.00 0.00 C ATOM 2000 CD2 TRP A 130 -1.099 -5.285 -1.441 1.00 0.00 C ATOM 2001 NE1 TRP A 130 -1.077 -3.931 -3.202 1.00 0.00 N ATOM 2002 CE2 TRP A 130 -0.967 -3.952 -1.848 1.00 0.00 C ATOM 2003 CE3 TRP A 130 -1.023 -5.579 -0.077 1.00 0.00 C ATOM 2004 CZ2 TRP A 130 -0.765 -2.906 -0.958 1.00 0.00 C ATOM 2005 CZ3 TRP A 130 -0.820 -4.538 0.815 1.00 0.00 C ATOM 2006 CH2 TRP A 130 -0.693 -3.214 0.365 1.00 0.00 C ATOM 0 H TRP A 130 -1.776 -9.950 -2.385 1.00 0.00 H new ATOM 0 HA TRP A 130 -2.552 -7.576 -0.904 1.00 0.00 H new ATOM 0 HB2 TRP A 130 -0.551 -8.010 -2.518 1.00 0.00 H new ATOM 0 HB3 TRP A 130 -1.729 -7.752 -3.789 1.00 0.00 H new ATOM 0 HD1 TRP A 130 -1.391 -5.454 -4.704 1.00 0.00 H new ATOM 0 HE1 TRP A 130 -1.020 -3.094 -3.783 1.00 0.00 H new ATOM 0 HE3 TRP A 130 -1.120 -6.596 0.274 1.00 0.00 H new ATOM 0 HZ2 TRP A 130 -0.669 -1.887 -1.303 1.00 0.00 H new ATOM 0 HZ3 TRP A 130 -0.759 -4.748 1.873 1.00 0.00 H new ATOM 0 HH2 TRP A 130 -0.535 -2.424 1.084 1.00 0.00 H new ATOM 2017 N THR A 131 -4.522 -8.835 -3.153 1.00 0.00 N ATOM 2018 CA THR A 131 -5.920 -8.734 -3.516 1.00 0.00 C ATOM 2019 C THR A 131 -6.781 -9.076 -2.327 1.00 0.00 C ATOM 2020 O THR A 131 -7.848 -8.520 -2.152 1.00 0.00 O ATOM 2021 CB THR A 131 -6.324 -9.621 -4.690 1.00 0.00 C ATOM 2022 OG1 THR A 131 -5.540 -10.822 -4.689 1.00 0.00 O ATOM 2023 CG2 THR A 131 -6.157 -8.881 -6.008 1.00 0.00 C ATOM 0 H THR A 131 -4.050 -9.687 -3.457 1.00 0.00 H new ATOM 0 HA THR A 131 -6.072 -7.702 -3.833 1.00 0.00 H new ATOM 0 HB THR A 131 -7.376 -9.884 -4.580 1.00 0.00 H new ATOM 0 HG1 THR A 131 -4.667 -10.643 -5.096 1.00 0.00 H new ATOM 0 HG21 THR A 131 -6.451 -9.533 -6.831 1.00 0.00 H new ATOM 0 HG22 THR A 131 -6.786 -7.991 -6.008 1.00 0.00 H new ATOM 0 HG23 THR A 131 -5.114 -8.588 -6.131 1.00 0.00 H new ATOM 2031 N GLY A 132 -6.332 -9.993 -1.502 1.00 0.00 N ATOM 2032 CA GLY A 132 -7.023 -10.184 -0.255 1.00 0.00 C ATOM 2033 C GLY A 132 -7.131 -8.869 0.485 1.00 0.00 C ATOM 2034 O GLY A 132 -8.224 -8.384 0.777 1.00 0.00 O ATOM 0 H GLY A 132 -5.524 -10.595 -1.663 1.00 0.00 H new ATOM 0 HA2 GLY A 132 -8.018 -10.589 -0.440 1.00 0.00 H new ATOM 0 HA3 GLY A 132 -6.491 -10.912 0.357 1.00 0.00 H new ATOM 2038 N ILE A 133 -5.990 -8.246 0.695 1.00 0.00 N ATOM 2039 CA ILE A 133 -5.928 -7.001 1.428 1.00 0.00 C ATOM 2040 C ILE A 133 -6.531 -5.824 0.649 1.00 0.00 C ATOM 2041 O ILE A 133 -7.434 -5.158 1.131 1.00 0.00 O ATOM 2042 CB ILE A 133 -4.458 -6.696 1.759 1.00 0.00 C ATOM 2043 CG1 ILE A 133 -3.955 -7.630 2.865 1.00 0.00 C ATOM 2044 CG2 ILE A 133 -4.274 -5.245 2.146 1.00 0.00 C ATOM 2045 CD1 ILE A 133 -2.486 -7.458 3.187 1.00 0.00 C ATOM 0 H ILE A 133 -5.087 -8.586 0.365 1.00 0.00 H new ATOM 0 HA ILE A 133 -6.519 -7.119 2.336 1.00 0.00 H new ATOM 0 HB ILE A 133 -3.863 -6.874 0.863 1.00 0.00 H new ATOM 0 HG12 ILE A 133 -4.539 -7.455 3.769 1.00 0.00 H new ATOM 0 HG13 ILE A 133 -4.133 -8.663 2.565 1.00 0.00 H new ATOM 0 HG21 ILE A 133 -3.224 -5.060 2.374 1.00 0.00 H new ATOM 0 HG22 ILE A 133 -4.584 -4.606 1.319 1.00 0.00 H new ATOM 0 HG23 ILE A 133 -4.881 -5.023 3.024 1.00 0.00 H new ATOM 0 HD11 ILE A 133 -2.203 -8.152 3.978 1.00 0.00 H new ATOM 0 HD12 ILE A 133 -1.892 -7.662 2.296 1.00 0.00 H new ATOM 0 HD13 ILE A 133 -2.303 -6.436 3.519 1.00 0.00 H new ATOM 2057 N VAL A 134 -6.068 -5.579 -0.563 1.00 0.00 N ATOM 2058 CA VAL A 134 -6.551 -4.439 -1.323 1.00 0.00 C ATOM 2059 C VAL A 134 -7.851 -4.738 -2.048 1.00 0.00 C ATOM 2060 O VAL A 134 -8.791 -3.964 -1.987 1.00 0.00 O ATOM 2061 CB VAL A 134 -5.498 -3.959 -2.325 1.00 0.00 C ATOM 2062 CG1 VAL A 134 -5.939 -2.669 -2.963 1.00 0.00 C ATOM 2063 CG2 VAL A 134 -4.184 -3.752 -1.632 1.00 0.00 C ATOM 0 H VAL A 134 -5.366 -6.146 -1.039 1.00 0.00 H new ATOM 0 HA VAL A 134 -6.746 -3.646 -0.601 1.00 0.00 H new ATOM 0 HB VAL A 134 -5.381 -4.719 -3.098 1.00 0.00 H new ATOM 0 HG11 VAL A 134 -5.182 -2.337 -3.674 1.00 0.00 H new ATOM 0 HG12 VAL A 134 -6.883 -2.825 -3.485 1.00 0.00 H new ATOM 0 HG13 VAL A 134 -6.072 -1.909 -2.193 1.00 0.00 H new ATOM 0 HG21 VAL A 134 -3.442 -3.411 -2.354 1.00 0.00 H new ATOM 0 HG22 VAL A 134 -4.300 -3.003 -0.849 1.00 0.00 H new ATOM 0 HG23 VAL A 134 -3.854 -4.692 -1.189 1.00 0.00 H new ATOM 2073 N ASN A 135 -7.951 -5.888 -2.679 1.00 0.00 N ATOM 2074 CA ASN A 135 -9.134 -6.154 -3.475 1.00 0.00 C ATOM 2075 C ASN A 135 -10.298 -6.413 -2.544 1.00 0.00 C ATOM 2076 O ASN A 135 -11.400 -5.906 -2.751 1.00 0.00 O ATOM 2077 CB ASN A 135 -8.903 -7.340 -4.431 1.00 0.00 C ATOM 2078 CG ASN A 135 -10.054 -7.615 -5.393 1.00 0.00 C ATOM 2079 OD1 ASN A 135 -11.230 -7.491 -5.051 1.00 0.00 O ATOM 2080 ND2 ASN A 135 -9.717 -7.986 -6.618 1.00 0.00 N ATOM 0 H ASN A 135 -7.254 -6.633 -2.661 1.00 0.00 H new ATOM 0 HA ASN A 135 -9.358 -5.287 -4.097 1.00 0.00 H new ATOM 0 HB2 ASN A 135 -8.000 -7.151 -5.011 1.00 0.00 H new ATOM 0 HB3 ASN A 135 -8.720 -8.237 -3.839 1.00 0.00 H new ATOM 0 HD21 ASN A 135 -10.441 -8.178 -7.310 1.00 0.00 H new ATOM 0 HD22 ASN A 135 -8.733 -8.080 -6.870 1.00 0.00 H new ATOM 2087 N GLU A 136 -10.052 -7.130 -1.464 1.00 0.00 N ATOM 2088 CA GLU A 136 -11.139 -7.466 -0.601 1.00 0.00 C ATOM 2089 C GLU A 136 -11.265 -6.475 0.565 1.00 0.00 C ATOM 2090 O GLU A 136 -12.348 -5.951 0.809 1.00 0.00 O ATOM 2091 CB GLU A 136 -10.951 -8.919 -0.150 1.00 0.00 C ATOM 2092 CG GLU A 136 -11.397 -9.198 1.274 1.00 0.00 C ATOM 2093 CD GLU A 136 -11.320 -10.663 1.641 1.00 0.00 C ATOM 2094 OE1 GLU A 136 -12.244 -11.418 1.274 1.00 0.00 O ATOM 2095 OE2 GLU A 136 -10.344 -11.067 2.311 1.00 0.00 O ATOM 0 H GLU A 136 -9.136 -7.476 -1.179 1.00 0.00 H new ATOM 0 HA GLU A 136 -12.087 -7.387 -1.132 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -11.505 -9.571 -0.825 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -9.898 -9.183 -0.246 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -10.777 -8.624 1.962 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -12.422 -8.850 1.403 1.00 0.00 H new ATOM 2102 N ARG A 137 -10.155 -6.134 1.217 1.00 0.00 N ATOM 2103 CA ARG A 137 -10.201 -5.236 2.375 1.00 0.00 C ATOM 2104 C ARG A 137 -10.229 -3.766 1.996 1.00 0.00 C ATOM 2105 O ARG A 137 -10.801 -2.978 2.714 1.00 0.00 O ATOM 2106 CB ARG A 137 -9.096 -5.531 3.386 1.00 0.00 C ATOM 2107 CG ARG A 137 -8.731 -4.358 4.313 1.00 0.00 C ATOM 2108 CD ARG A 137 -9.892 -3.924 5.211 1.00 0.00 C ATOM 2109 NE ARG A 137 -10.284 -4.961 6.168 1.00 0.00 N ATOM 2110 CZ ARG A 137 -11.404 -4.914 6.900 1.00 0.00 C ATOM 2111 NH1 ARG A 137 -12.240 -3.884 6.783 1.00 0.00 N ATOM 2112 NH2 ARG A 137 -11.682 -5.901 7.745 1.00 0.00 N ATOM 0 H ARG A 137 -9.221 -6.460 0.969 1.00 0.00 H new ATOM 0 HA ARG A 137 -11.153 -5.446 2.862 1.00 0.00 H new ATOM 0 HB2 ARG A 137 -9.403 -6.378 4.000 1.00 0.00 H new ATOM 0 HB3 ARG A 137 -8.201 -5.838 2.844 1.00 0.00 H new ATOM 0 HG2 ARG A 137 -7.884 -4.644 4.936 1.00 0.00 H new ATOM 0 HG3 ARG A 137 -8.410 -3.510 3.708 1.00 0.00 H new ATOM 0 HD2 ARG A 137 -9.609 -3.022 5.754 1.00 0.00 H new ATOM 0 HD3 ARG A 137 -10.750 -3.666 4.590 1.00 0.00 H new ATOM 0 HE ARG A 137 -9.668 -5.766 6.284 1.00 0.00 H new ATOM 0 HH11 ARG A 137 -12.028 -3.127 6.134 1.00 0.00 H new ATOM 0 HH12 ARG A 137 -13.092 -3.853 7.343 1.00 0.00 H new ATOM 0 HH21 ARG A 137 -11.043 -6.691 7.834 1.00 0.00 H new ATOM 0 HH22 ARG A 137 -12.534 -5.869 8.304 1.00 0.00 H new ATOM 2126 N LEU A 138 -9.615 -3.361 0.907 1.00 0.00 N ATOM 2127 CA LEU A 138 -9.694 -1.961 0.546 1.00 0.00 C ATOM 2128 C LEU A 138 -11.133 -1.648 0.239 1.00 0.00 C ATOM 2129 O LEU A 138 -11.647 -0.620 0.656 1.00 0.00 O ATOM 2130 CB LEU A 138 -8.773 -1.632 -0.618 1.00 0.00 C ATOM 2131 CG LEU A 138 -8.672 -0.170 -1.004 1.00 0.00 C ATOM 2132 CD1 LEU A 138 -8.388 0.709 0.190 1.00 0.00 C ATOM 2133 CD2 LEU A 138 -7.577 -0.006 -2.014 1.00 0.00 C ATOM 0 H LEU A 138 -9.075 -3.953 0.276 1.00 0.00 H new ATOM 0 HA LEU A 138 -9.354 -1.338 1.373 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -7.773 -1.991 -0.375 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -9.110 -2.193 -1.490 1.00 0.00 H new ATOM 0 HG LEU A 138 -9.631 0.137 -1.422 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -8.323 1.749 -0.131 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -9.192 0.603 0.919 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -7.444 0.410 0.645 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -7.498 1.044 -2.297 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -6.632 -0.338 -1.584 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -7.804 -0.604 -2.897 1.00 0.00 H new ATOM 2145 N ARG A 139 -11.802 -2.575 -0.443 1.00 0.00 N ATOM 2146 CA ARG A 139 -13.239 -2.468 -0.621 1.00 0.00 C ATOM 2147 C ARG A 139 -13.926 -2.620 0.728 1.00 0.00 C ATOM 2148 O ARG A 139 -14.984 -2.057 0.954 1.00 0.00 O ATOM 2149 CB ARG A 139 -13.752 -3.504 -1.635 1.00 0.00 C ATOM 2150 CG ARG A 139 -15.097 -3.153 -2.279 1.00 0.00 C ATOM 2151 CD ARG A 139 -16.275 -3.434 -1.356 1.00 0.00 C ATOM 2152 NE ARG A 139 -16.379 -4.854 -1.008 1.00 0.00 N ATOM 2153 CZ ARG A 139 -17.537 -5.489 -0.798 1.00 0.00 C ATOM 2154 NH1 ARG A 139 -18.692 -4.845 -0.933 1.00 0.00 N ATOM 2155 NH2 ARG A 139 -17.538 -6.777 -0.472 1.00 0.00 N ATOM 0 H ARG A 139 -11.376 -3.395 -0.874 1.00 0.00 H new ATOM 0 HA ARG A 139 -13.476 -1.485 -1.027 1.00 0.00 H new ATOM 0 HB2 ARG A 139 -13.007 -3.623 -2.422 1.00 0.00 H new ATOM 0 HB3 ARG A 139 -13.844 -4.468 -1.135 1.00 0.00 H new ATOM 0 HG2 ARG A 139 -15.100 -2.099 -2.556 1.00 0.00 H new ATOM 0 HG3 ARG A 139 -15.216 -3.725 -3.199 1.00 0.00 H new ATOM 0 HD2 ARG A 139 -16.169 -2.845 -0.445 1.00 0.00 H new ATOM 0 HD3 ARG A 139 -17.198 -3.111 -1.839 1.00 0.00 H new ATOM 0 HE ARG A 139 -15.516 -5.390 -0.921 1.00 0.00 H new ATOM 0 HH11 ARG A 139 -18.699 -3.860 -1.198 1.00 0.00 H new ATOM 0 HH12 ARG A 139 -19.571 -5.336 -0.771 1.00 0.00 H new ATOM 0 HH21 ARG A 139 -16.656 -7.281 -0.382 1.00 0.00 H new ATOM 0 HH22 ARG A 139 -18.421 -7.262 -0.312 1.00 0.00 H new ATOM 2169 N LYS A 140 -13.328 -3.382 1.633 1.00 0.00 N ATOM 2170 CA LYS A 140 -13.878 -3.520 2.959 1.00 0.00 C ATOM 2171 C LYS A 140 -13.785 -2.234 3.783 1.00 0.00 C ATOM 2172 O LYS A 140 -14.748 -1.812 4.391 1.00 0.00 O ATOM 2173 CB LYS A 140 -13.176 -4.641 3.711 1.00 0.00 C ATOM 2174 CG LYS A 140 -14.002 -5.900 3.846 1.00 0.00 C ATOM 2175 CD LYS A 140 -13.291 -7.084 3.257 1.00 0.00 C ATOM 2176 CE LYS A 140 -12.047 -7.439 4.049 1.00 0.00 C ATOM 2177 NZ LYS A 140 -12.381 -8.026 5.377 1.00 0.00 N ATOM 0 H LYS A 140 -12.469 -3.907 1.468 1.00 0.00 H new ATOM 0 HA LYS A 140 -14.935 -3.753 2.827 1.00 0.00 H new ATOM 0 HB2 LYS A 140 -12.245 -4.882 3.198 1.00 0.00 H new ATOM 0 HB3 LYS A 140 -12.908 -4.286 4.706 1.00 0.00 H new ATOM 0 HG2 LYS A 140 -14.214 -6.087 4.899 1.00 0.00 H new ATOM 0 HG3 LYS A 140 -14.961 -5.764 3.347 1.00 0.00 H new ATOM 0 HD2 LYS A 140 -13.965 -7.940 3.235 1.00 0.00 H new ATOM 0 HD3 LYS A 140 -13.016 -6.868 2.225 1.00 0.00 H new ATOM 0 HE2 LYS A 140 -11.445 -8.148 3.480 1.00 0.00 H new ATOM 0 HE3 LYS A 140 -11.439 -6.545 4.190 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 -11.511 -8.363 5.836 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 -12.829 -7.302 5.974 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 -13.036 -8.823 5.249 1.00 0.00 H new ATOM 2191 N ALA A 141 -12.647 -1.598 3.772 1.00 0.00 N ATOM 2192 CA ALA A 141 -12.426 -0.431 4.597 1.00 0.00 C ATOM 2193 C ALA A 141 -13.211 0.746 4.058 1.00 0.00 C ATOM 2194 O ALA A 141 -13.617 1.635 4.805 1.00 0.00 O ATOM 2195 CB ALA A 141 -10.948 -0.122 4.675 1.00 0.00 C ATOM 0 H ALA A 141 -11.848 -1.867 3.197 1.00 0.00 H new ATOM 0 HA ALA A 141 -12.780 -0.633 5.608 1.00 0.00 H new ATOM 0 HB1 ALA A 141 -10.793 0.758 5.299 1.00 0.00 H new ATOM 0 HB2 ALA A 141 -10.421 -0.972 5.109 1.00 0.00 H new ATOM 0 HB3 ALA A 141 -10.563 0.070 3.673 1.00 0.00 H new ATOM 2201 N VAL A 142 -13.433 0.741 2.753 1.00 0.00 N ATOM 2202 CA VAL A 142 -14.237 1.756 2.135 1.00 0.00 C ATOM 2203 C VAL A 142 -15.703 1.352 2.213 1.00 0.00 C ATOM 2204 O VAL A 142 -16.588 2.203 2.165 1.00 0.00 O ATOM 2205 CB VAL A 142 -13.819 2.022 0.672 1.00 0.00 C ATOM 2206 CG1 VAL A 142 -12.372 2.480 0.616 1.00 0.00 C ATOM 2207 CG2 VAL A 142 -14.020 0.811 -0.228 1.00 0.00 C ATOM 0 H VAL A 142 -13.063 0.041 2.110 1.00 0.00 H new ATOM 0 HA VAL A 142 -14.083 2.689 2.677 1.00 0.00 H new ATOM 0 HB VAL A 142 -14.470 2.811 0.294 1.00 0.00 H new ATOM 0 HG11 VAL A 142 -12.089 2.664 -0.420 1.00 0.00 H new ATOM 0 HG12 VAL A 142 -12.258 3.398 1.192 1.00 0.00 H new ATOM 0 HG13 VAL A 142 -11.729 1.706 1.036 1.00 0.00 H new ATOM 0 HG21 VAL A 142 -13.709 1.057 -1.244 1.00 0.00 H new ATOM 0 HG22 VAL A 142 -13.422 -0.021 0.143 1.00 0.00 H new ATOM 0 HG23 VAL A 142 -15.073 0.529 -0.229 1.00 0.00 H new ATOM 2217 N GLU A 143 -15.954 0.048 2.384 1.00 0.00 N ATOM 2218 CA GLU A 143 -17.330 -0.460 2.422 1.00 0.00 C ATOM 2219 C GLU A 143 -17.529 -1.680 3.325 1.00 0.00 C ATOM 2220 O GLU A 143 -18.354 -1.643 4.235 1.00 0.00 O ATOM 2221 CB GLU A 143 -17.796 -0.806 1.017 1.00 0.00 C ATOM 2222 CG GLU A 143 -18.227 0.403 0.225 1.00 0.00 C ATOM 2223 CD GLU A 143 -19.553 0.962 0.698 1.00 0.00 C ATOM 2224 OE1 GLU A 143 -19.565 1.796 1.630 1.00 0.00 O ATOM 2225 OE2 GLU A 143 -20.599 0.562 0.145 1.00 0.00 O ATOM 0 H GLU A 143 -15.234 -0.665 2.497 1.00 0.00 H new ATOM 0 HA GLU A 143 -17.926 0.346 2.850 1.00 0.00 H new ATOM 0 HB2 GLU A 143 -16.989 -1.312 0.487 1.00 0.00 H new ATOM 0 HB3 GLU A 143 -18.627 -1.509 1.078 1.00 0.00 H new ATOM 0 HG2 GLU A 143 -17.462 1.176 0.302 1.00 0.00 H new ATOM 0 HG3 GLU A 143 -18.304 0.135 -0.829 1.00 0.00 H new ATOM 2232 N GLU A 144 -16.762 -2.740 3.063 1.00 0.00 N ATOM 2233 CA GLU A 144 -16.958 -4.075 3.672 1.00 0.00 C ATOM 2234 C GLU A 144 -18.438 -4.472 3.723 1.00 0.00 C ATOM 2235 O GLU A 144 -19.237 -4.059 2.878 1.00 0.00 O ATOM 2236 CB GLU A 144 -16.307 -4.178 5.072 1.00 0.00 C ATOM 2237 CG GLU A 144 -16.841 -3.247 6.149 1.00 0.00 C ATOM 2238 CD GLU A 144 -16.115 -3.428 7.470 1.00 0.00 C ATOM 2239 OE1 GLU A 144 -14.899 -3.741 7.455 1.00 0.00 O ATOM 2240 OE2 GLU A 144 -16.756 -3.285 8.530 1.00 0.00 O ATOM 0 H GLU A 144 -15.975 -2.704 2.415 1.00 0.00 H new ATOM 0 HA GLU A 144 -16.449 -4.787 3.022 1.00 0.00 H new ATOM 0 HB2 GLU A 144 -16.419 -5.204 5.424 1.00 0.00 H new ATOM 0 HB3 GLU A 144 -15.238 -3.994 4.964 1.00 0.00 H new ATOM 0 HG2 GLU A 144 -16.739 -2.214 5.818 1.00 0.00 H new ATOM 0 HG3 GLU A 144 -17.906 -3.432 6.292 1.00 0.00 H new ATOM 2247 N LEU A 145 -18.789 -5.300 4.693 1.00 0.00 N ATOM 2248 CA LEU A 145 -20.167 -5.723 4.888 1.00 0.00 C ATOM 2249 C LEU A 145 -20.365 -6.087 6.350 1.00 0.00 C ATOM 2250 O LEU A 145 -21.290 -5.610 7.009 1.00 0.00 O ATOM 2251 CB LEU A 145 -20.492 -6.915 3.971 1.00 0.00 C ATOM 2252 CG LEU A 145 -21.971 -7.325 3.894 1.00 0.00 C ATOM 2253 CD1 LEU A 145 -22.237 -8.083 2.604 1.00 0.00 C ATOM 2254 CD2 LEU A 145 -22.372 -8.184 5.088 1.00 0.00 C ATOM 0 H LEU A 145 -18.131 -5.696 5.364 1.00 0.00 H new ATOM 0 HA LEU A 145 -20.847 -4.911 4.628 1.00 0.00 H new ATOM 0 HB2 LEU A 145 -20.149 -6.677 2.964 1.00 0.00 H new ATOM 0 HB3 LEU A 145 -19.915 -7.775 4.309 1.00 0.00 H new ATOM 0 HG LEU A 145 -22.571 -6.415 3.912 1.00 0.00 H new ATOM 0 HD11 LEU A 145 -23.288 -8.369 2.560 1.00 0.00 H new ATOM 0 HD12 LEU A 145 -21.998 -7.446 1.752 1.00 0.00 H new ATOM 0 HD13 LEU A 145 -21.616 -8.978 2.573 1.00 0.00 H new ATOM 0 HD21 LEU A 145 -23.424 -8.457 5.003 1.00 0.00 H new ATOM 0 HD22 LEU A 145 -21.763 -9.088 5.107 1.00 0.00 H new ATOM 0 HD23 LEU A 145 -22.216 -7.622 6.009 1.00 0.00 H new ATOM 2266 N GLU A 146 -19.478 -6.933 6.849 1.00 0.00 N ATOM 2267 CA GLU A 146 -19.480 -7.310 8.248 1.00 0.00 C ATOM 2268 C GLU A 146 -18.095 -7.087 8.844 1.00 0.00 C ATOM 2269 O GLU A 146 -17.079 -7.219 8.154 1.00 0.00 O ATOM 2270 CB GLU A 146 -19.907 -8.774 8.405 1.00 0.00 C ATOM 2271 CG GLU A 146 -19.972 -9.244 9.852 1.00 0.00 C ATOM 2272 CD GLU A 146 -20.886 -8.391 10.708 1.00 0.00 C ATOM 2273 OE1 GLU A 146 -22.090 -8.707 10.793 1.00 0.00 O ATOM 2274 OE2 GLU A 146 -20.399 -7.404 11.303 1.00 0.00 O ATOM 0 H GLU A 146 -18.742 -7.374 6.297 1.00 0.00 H new ATOM 0 HA GLU A 146 -20.197 -6.688 8.784 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -20.886 -8.908 7.945 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -19.208 -9.407 7.858 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -20.318 -10.277 9.878 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -18.969 -9.233 10.278 1.00 0.00 H new ATOM 2281 N HIS A 147 -18.065 -6.743 10.121 1.00 0.00 N ATOM 2282 CA HIS A 147 -16.821 -6.449 10.811 1.00 0.00 C ATOM 2283 C HIS A 147 -16.603 -7.466 11.925 1.00 0.00 C ATOM 2284 O HIS A 147 -15.511 -8.007 12.091 1.00 0.00 O ATOM 2285 CB HIS A 147 -16.869 -5.034 11.381 1.00 0.00 C ATOM 2286 CG HIS A 147 -15.528 -4.397 11.533 1.00 0.00 C ATOM 2287 ND1 HIS A 147 -14.995 -3.552 10.590 1.00 0.00 N ATOM 2288 CD2 HIS A 147 -14.616 -4.473 12.527 1.00 0.00 C ATOM 2289 CE1 HIS A 147 -13.813 -3.133 10.995 1.00 0.00 C ATOM 2290 NE2 HIS A 147 -13.556 -3.677 12.173 1.00 0.00 N ATOM 0 H HIS A 147 -18.897 -6.660 10.705 1.00 0.00 H new ATOM 0 HA HIS A 147 -15.990 -6.513 10.109 1.00 0.00 H new ATOM 0 HB2 HIS A 147 -17.484 -4.412 10.731 1.00 0.00 H new ATOM 0 HB3 HIS A 147 -17.360 -5.061 12.354 1.00 0.00 H new ATOM 0 HD1 HIS A 147 -15.444 -3.290 9.713 1.00 0.00 H new ATOM 0 HD2 HIS A 147 -14.705 -5.053 13.433 1.00 0.00 H new ATOM 0 HE1 HIS A 147 -13.164 -2.459 10.456 1.00 0.00 H new ATOM 2299 N HIS A 148 -17.659 -7.720 12.684 1.00 0.00 N ATOM 2300 CA HIS A 148 -17.655 -8.767 13.694 1.00 0.00 C ATOM 2301 C HIS A 148 -18.740 -9.777 13.358 1.00 0.00 C ATOM 2302 O HIS A 148 -19.915 -9.552 13.635 1.00 0.00 O ATOM 2303 CB HIS A 148 -17.866 -8.188 15.100 1.00 0.00 C ATOM 2304 CG HIS A 148 -16.603 -7.720 15.762 1.00 0.00 C ATOM 2305 ND1 HIS A 148 -16.166 -6.415 15.729 1.00 0.00 N ATOM 2306 CD2 HIS A 148 -15.687 -8.400 16.490 1.00 0.00 C ATOM 2307 CE1 HIS A 148 -15.037 -6.313 16.406 1.00 0.00 C ATOM 2308 NE2 HIS A 148 -14.724 -7.505 16.880 1.00 0.00 N ATOM 0 H HIS A 148 -18.539 -7.208 12.617 1.00 0.00 H new ATOM 0 HA HIS A 148 -16.683 -9.259 13.693 1.00 0.00 H new ATOM 0 HB2 HIS A 148 -18.563 -7.352 15.037 1.00 0.00 H new ATOM 0 HB3 HIS A 148 -18.334 -8.946 15.728 1.00 0.00 H new ATOM 0 HD2 HIS A 148 -15.710 -9.455 16.721 1.00 0.00 H new ATOM 0 HE1 HIS A 148 -14.466 -5.407 16.548 1.00 0.00 H new ATOM 0 HE2 HIS A 148 -13.902 -7.724 17.443 1.00 0.00 H new ATOM 2317 N HIS A 149 -18.331 -10.891 12.759 1.00 0.00 N ATOM 2318 CA HIS A 149 -19.269 -11.846 12.160 1.00 0.00 C ATOM 2319 C HIS A 149 -20.141 -12.559 13.195 1.00 0.00 C ATOM 2320 O HIS A 149 -21.057 -13.295 12.830 1.00 0.00 O ATOM 2321 CB HIS A 149 -18.518 -12.876 11.308 1.00 0.00 C ATOM 2322 CG HIS A 149 -17.944 -12.314 10.040 1.00 0.00 C ATOM 2323 ND1 HIS A 149 -18.566 -12.430 8.815 1.00 0.00 N ATOM 2324 CD2 HIS A 149 -16.797 -11.632 9.811 1.00 0.00 C ATOM 2325 CE1 HIS A 149 -17.826 -11.847 7.889 1.00 0.00 C ATOM 2326 NE2 HIS A 149 -16.751 -11.353 8.470 1.00 0.00 N ATOM 0 H HIS A 149 -17.351 -11.159 12.673 1.00 0.00 H new ATOM 0 HA HIS A 149 -19.938 -11.264 11.527 1.00 0.00 H new ATOM 0 HB2 HIS A 149 -17.711 -13.305 11.902 1.00 0.00 H new ATOM 0 HB3 HIS A 149 -19.197 -13.691 11.058 1.00 0.00 H new ATOM 0 HD2 HIS A 149 -16.056 -11.359 10.548 1.00 0.00 H new ATOM 0 HE1 HIS A 149 -18.061 -11.786 6.837 1.00 0.00 H new ATOM 0 HE2 HIS A 149 -16.004 -10.844 7.997 1.00 0.00 H new ATOM 2335 N HIS A 150 -19.862 -12.359 14.473 1.00 0.00 N ATOM 2336 CA HIS A 150 -20.691 -12.939 15.521 1.00 0.00 C ATOM 2337 C HIS A 150 -20.999 -11.932 16.618 1.00 0.00 C ATOM 2338 O HIS A 150 -22.113 -11.416 16.702 1.00 0.00 O ATOM 2339 CB HIS A 150 -20.033 -14.183 16.127 1.00 0.00 C ATOM 2340 CG HIS A 150 -20.296 -15.436 15.354 1.00 0.00 C ATOM 2341 ND1 HIS A 150 -21.379 -16.247 15.597 1.00 0.00 N ATOM 2342 CD2 HIS A 150 -19.615 -16.016 14.340 1.00 0.00 C ATOM 2343 CE1 HIS A 150 -21.355 -17.271 14.770 1.00 0.00 C ATOM 2344 NE2 HIS A 150 -20.297 -17.154 13.996 1.00 0.00 N ATOM 0 H HIS A 150 -19.075 -11.804 14.809 1.00 0.00 H new ATOM 0 HA HIS A 150 -21.630 -13.232 15.052 1.00 0.00 H new ATOM 0 HB2 HIS A 150 -18.957 -14.022 16.187 1.00 0.00 H new ATOM 0 HB3 HIS A 150 -20.393 -14.313 17.148 1.00 0.00 H new ATOM 0 HD2 HIS A 150 -18.705 -15.651 13.887 1.00 0.00 H new ATOM 0 HE1 HIS A 150 -22.080 -18.071 14.733 1.00 0.00 H new ATOM 0 HE2 HIS A 150 -20.028 -17.805 13.259 1.00 0.00 H new ATOM 2353 N HIS A 151 -20.008 -11.629 17.440 1.00 0.00 N ATOM 2354 CA HIS A 151 -20.245 -10.858 18.649 1.00 0.00 C ATOM 2355 C HIS A 151 -19.098 -9.886 18.910 1.00 0.00 C ATOM 2356 O HIS A 151 -17.962 -10.133 18.505 1.00 0.00 O ATOM 2357 CB HIS A 151 -20.411 -11.828 19.827 1.00 0.00 C ATOM 2358 CG HIS A 151 -20.853 -11.194 21.111 1.00 0.00 C ATOM 2359 ND1 HIS A 151 -20.035 -11.079 22.212 1.00 0.00 N ATOM 2360 CD2 HIS A 151 -22.048 -10.669 21.474 1.00 0.00 C ATOM 2361 CE1 HIS A 151 -20.705 -10.514 23.199 1.00 0.00 C ATOM 2362 NE2 HIS A 151 -21.928 -10.254 22.777 1.00 0.00 N ATOM 0 H HIS A 151 -19.037 -11.903 17.293 1.00 0.00 H new ATOM 0 HA HIS A 151 -21.153 -10.267 18.529 1.00 0.00 H new ATOM 0 HB2 HIS A 151 -21.135 -12.593 19.549 1.00 0.00 H new ATOM 0 HB3 HIS A 151 -19.461 -12.335 19.997 1.00 0.00 H new ATOM 0 HD2 HIS A 151 -22.929 -10.592 20.855 1.00 0.00 H new ATOM 0 HE1 HIS A 151 -20.318 -10.301 24.184 1.00 0.00 H new ATOM 0 HE2 HIS A 151 -22.665 -9.816 23.330 1.00 0.00 H new ATOM 2371 N HIS A 152 -19.405 -8.778 19.572 1.00 0.00 N ATOM 2372 CA HIS A 152 -18.391 -7.807 19.956 1.00 0.00 C ATOM 2373 C HIS A 152 -18.733 -7.209 21.320 1.00 0.00 C ATOM 2374 O HIS A 152 -19.360 -6.135 21.375 1.00 0.00 O ATOM 2375 CB HIS A 152 -18.225 -6.711 18.881 1.00 0.00 C ATOM 2376 CG HIS A 152 -19.486 -5.981 18.503 1.00 0.00 C ATOM 2377 ND1 HIS A 152 -19.737 -4.679 18.870 1.00 0.00 N ATOM 2378 CD2 HIS A 152 -20.554 -6.369 17.765 1.00 0.00 C ATOM 2379 CE1 HIS A 152 -20.898 -4.298 18.379 1.00 0.00 C ATOM 2380 NE2 HIS A 152 -21.416 -5.304 17.702 1.00 0.00 N ATOM 2381 OXT HIS A 152 -18.417 -7.848 22.338 1.00 0.00 O ATOM 0 H HIS A 152 -20.353 -8.529 19.855 1.00 0.00 H new ATOM 0 HA HIS A 152 -17.432 -8.319 20.035 1.00 0.00 H new ATOM 0 HB2 HIS A 152 -17.497 -5.983 19.238 1.00 0.00 H new ATOM 0 HB3 HIS A 152 -17.806 -7.166 17.984 1.00 0.00 H new ATOM 0 HD2 HIS A 152 -20.700 -7.338 17.310 1.00 0.00 H new ATOM 0 HE1 HIS A 152 -21.350 -3.326 18.509 1.00 0.00 H new ATOM 0 HE2 HIS A 152 -22.311 -5.292 17.212 1.00 0.00 H new TER 2390 HIS A 152