USER MOD reduce.3.24.130724 H: found=0, std=0, add=604, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 605 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 132 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 158 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Set 2.1: A 109 GLN : amide:sc= -0.223 K(o=-1.1,f=-3.1!) USER MOD Set 2.2: A 117 GLN : amide:sc= -0.84 K(o=-1.1,f=-3.1) USER MOD Set 3.1: A 101 SER OG : rot -136:sc= 1.01 USER MOD Set 3.2: A 103 TYR OH : rot 180:sc= 0.179 USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 95 ASN : amide:sc= -0.338 K(o=-0.34,f=-4.4!) USER MOD Single : A 96 ASN : amide:sc= -1.06 K(o=-1.1,f=-10!) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 SER OG : rot 150:sc= -0.757 USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 108 THR OG1 : rot -32:sc= 0.789 USER MOD Single : A 110 THR OG1 : rot 180:sc= -0.566 USER MOD Single : A 113 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 GLN :FLIP amide:sc=-0.00151 F(o=-1.1,f=-0.0015) USER MOD Single : A 119 SER OG : rot 86:sc= 1.15 USER MOD Single : A 125 GLN : amide:sc= -1.11 X(o=-1.1,f=-1.4) USER MOD Single : A 136 LYS NZ :NH3+ 146:sc= 1.23 (180deg=0.745) USER MOD Single : A 141 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 147 TYR OH : rot 30:sc= -0.514 USER MOD Single : A 150 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 153 SER OG : rot 44:sc= 0 USER MOD Single : A 154 THR OG1 : rot 180:sc= 0 USER MOD Single : A 157 MET CE :methyl 172:sc= -0.591 (180deg=-0.867) USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 86 12.692 -14.345 -1.850 1.00 0.00 N ATOM 2 CA ASP A 86 12.114 -13.499 -0.812 1.00 0.00 C ATOM 3 C ASP A 86 11.086 -12.595 -1.457 1.00 0.00 C ATOM 4 O ASP A 86 10.042 -12.293 -0.879 1.00 0.00 O ATOM 5 CB ASP A 86 13.193 -12.640 -0.141 1.00 0.00 C ATOM 6 CG ASP A 86 14.265 -13.460 0.544 1.00 0.00 C ATOM 7 OD1 ASP A 86 15.256 -13.832 -0.118 1.00 0.00 O ATOM 8 OD2 ASP A 86 14.127 -13.742 1.750 1.00 0.00 O ATOM 0 HA ASP A 86 11.656 -14.128 -0.049 1.00 0.00 H new ATOM 0 HB2 ASP A 86 13.658 -12.000 -0.891 1.00 0.00 H new ATOM 0 HB3 ASP A 86 12.723 -11.984 0.591 1.00 0.00 H new ATOM 13 N GLU A 87 11.418 -12.175 -2.672 1.00 0.00 N ATOM 14 CA GLU A 87 10.543 -11.372 -3.511 1.00 0.00 C ATOM 15 C GLU A 87 10.233 -10.015 -2.890 1.00 0.00 C ATOM 16 O GLU A 87 9.175 -9.808 -2.290 1.00 0.00 O ATOM 17 CB GLU A 87 9.256 -12.135 -3.855 1.00 0.00 C ATOM 18 CG GLU A 87 9.438 -13.177 -4.952 1.00 0.00 C ATOM 19 CD GLU A 87 10.537 -14.180 -4.652 1.00 0.00 C ATOM 20 OE1 GLU A 87 10.257 -15.198 -3.992 1.00 0.00 O ATOM 21 OE2 GLU A 87 11.693 -13.955 -5.078 1.00 0.00 O ATOM 0 H GLU A 87 12.316 -12.387 -3.106 1.00 0.00 H new ATOM 0 HA GLU A 87 11.080 -11.178 -4.439 1.00 0.00 H new ATOM 0 HB2 GLU A 87 8.884 -12.627 -2.956 1.00 0.00 H new ATOM 0 HB3 GLU A 87 8.493 -11.422 -4.166 1.00 0.00 H new ATOM 0 HG2 GLU A 87 8.498 -13.710 -5.096 1.00 0.00 H new ATOM 0 HG3 GLU A 87 9.664 -12.671 -5.890 1.00 0.00 H new ATOM 28 N PRO A 88 11.185 -9.080 -2.999 1.00 0.00 N ATOM 29 CA PRO A 88 10.960 -7.696 -2.632 1.00 0.00 C ATOM 30 C PRO A 88 10.257 -6.962 -3.765 1.00 0.00 C ATOM 31 O PRO A 88 10.896 -6.455 -4.690 1.00 0.00 O ATOM 32 CB PRO A 88 12.370 -7.152 -2.409 1.00 0.00 C ATOM 33 CG PRO A 88 13.252 -7.986 -3.281 1.00 0.00 C ATOM 34 CD PRO A 88 12.558 -9.307 -3.488 1.00 0.00 C ATOM 0 HA PRO A 88 10.325 -7.576 -1.754 1.00 0.00 H new ATOM 0 HB2 PRO A 88 12.433 -6.098 -2.678 1.00 0.00 H new ATOM 0 HB3 PRO A 88 12.662 -7.232 -1.362 1.00 0.00 H new ATOM 0 HG2 PRO A 88 13.428 -7.490 -4.236 1.00 0.00 H new ATOM 0 HG3 PRO A 88 14.226 -8.133 -2.814 1.00 0.00 H new ATOM 0 HD2 PRO A 88 12.563 -9.598 -4.538 1.00 0.00 H new ATOM 0 HD3 PRO A 88 13.050 -10.106 -2.934 1.00 0.00 H new ATOM 42 N LEU A 89 8.939 -6.951 -3.705 1.00 0.00 N ATOM 43 CA LEU A 89 8.127 -6.416 -4.781 1.00 0.00 C ATOM 44 C LEU A 89 8.162 -4.891 -4.763 1.00 0.00 C ATOM 45 O LEU A 89 7.697 -4.256 -3.816 1.00 0.00 O ATOM 46 CB LEU A 89 6.682 -6.915 -4.641 1.00 0.00 C ATOM 47 CG LEU A 89 5.939 -7.194 -5.950 1.00 0.00 C ATOM 48 CD1 LEU A 89 6.007 -6.001 -6.886 1.00 0.00 C ATOM 49 CD2 LEU A 89 6.489 -8.440 -6.625 1.00 0.00 C ATOM 0 H LEU A 89 8.404 -7.310 -2.914 1.00 0.00 H new ATOM 0 HA LEU A 89 8.531 -6.760 -5.733 1.00 0.00 H new ATOM 0 HB2 LEU A 89 6.690 -7.830 -4.049 1.00 0.00 H new ATOM 0 HB3 LEU A 89 6.116 -6.175 -4.076 1.00 0.00 H new ATOM 0 HG LEU A 89 4.891 -7.369 -5.708 1.00 0.00 H new ATOM 0 HD11 LEU A 89 5.470 -6.230 -7.807 1.00 0.00 H new ATOM 0 HD12 LEU A 89 5.551 -5.135 -6.406 1.00 0.00 H new ATOM 0 HD13 LEU A 89 7.049 -5.780 -7.119 1.00 0.00 H new ATOM 0 HD21 LEU A 89 5.947 -8.620 -7.553 1.00 0.00 H new ATOM 0 HD22 LEU A 89 7.547 -8.298 -6.844 1.00 0.00 H new ATOM 0 HD23 LEU A 89 6.368 -9.297 -5.962 1.00 0.00 H new ATOM 61 N SER A 90 8.733 -4.312 -5.802 1.00 0.00 N ATOM 62 CA SER A 90 8.744 -2.873 -5.950 1.00 0.00 C ATOM 63 C SER A 90 7.416 -2.417 -6.552 1.00 0.00 C ATOM 64 O SER A 90 7.215 -2.461 -7.768 1.00 0.00 O ATOM 65 CB SER A 90 9.925 -2.453 -6.830 1.00 0.00 C ATOM 66 OG SER A 90 10.058 -1.045 -6.903 1.00 0.00 O ATOM 0 H SER A 90 9.196 -4.819 -6.556 1.00 0.00 H new ATOM 0 HA SER A 90 8.863 -2.399 -4.976 1.00 0.00 H new ATOM 0 HB2 SER A 90 10.844 -2.884 -6.433 1.00 0.00 H new ATOM 0 HB3 SER A 90 9.791 -2.857 -7.833 1.00 0.00 H new ATOM 0 HG SER A 90 10.823 -0.818 -7.472 1.00 0.00 H new ATOM 72 N ILE A 91 6.496 -2.022 -5.683 1.00 0.00 N ATOM 73 CA ILE A 91 5.170 -1.612 -6.105 1.00 0.00 C ATOM 74 C ILE A 91 5.106 -0.101 -6.260 1.00 0.00 C ATOM 75 O ILE A 91 5.863 0.632 -5.622 1.00 0.00 O ATOM 76 CB ILE A 91 4.079 -2.062 -5.104 1.00 0.00 C ATOM 77 CG1 ILE A 91 4.327 -1.445 -3.720 1.00 0.00 C ATOM 78 CG2 ILE A 91 4.033 -3.582 -5.016 1.00 0.00 C ATOM 79 CD1 ILE A 91 3.215 -1.710 -2.726 1.00 0.00 C ATOM 0 H ILE A 91 6.648 -1.978 -4.675 1.00 0.00 H new ATOM 0 HA ILE A 91 4.979 -2.094 -7.064 1.00 0.00 H new ATOM 0 HB ILE A 91 3.113 -1.709 -5.465 1.00 0.00 H new ATOM 0 HG12 ILE A 91 5.261 -1.838 -3.319 1.00 0.00 H new ATOM 0 HG13 ILE A 91 4.455 -0.368 -3.830 1.00 0.00 H new ATOM 0 HG21 ILE A 91 3.261 -3.882 -4.308 1.00 0.00 H new ATOM 0 HG22 ILE A 91 3.806 -3.997 -5.998 1.00 0.00 H new ATOM 0 HG23 ILE A 91 5.000 -3.956 -4.679 1.00 0.00 H new ATOM 0 HD11 ILE A 91 3.461 -1.244 -1.772 1.00 0.00 H new ATOM 0 HD12 ILE A 91 2.282 -1.293 -3.104 1.00 0.00 H new ATOM 0 HD13 ILE A 91 3.101 -2.785 -2.586 1.00 0.00 H new ATOM 91 N LEU A 92 4.198 0.364 -7.100 1.00 0.00 N ATOM 92 CA LEU A 92 4.046 1.786 -7.325 1.00 0.00 C ATOM 93 C LEU A 92 2.776 2.285 -6.652 1.00 0.00 C ATOM 94 O LEU A 92 1.670 1.893 -7.021 1.00 0.00 O ATOM 95 CB LEU A 92 4.012 2.093 -8.822 1.00 0.00 C ATOM 96 CG LEU A 92 4.014 3.578 -9.182 1.00 0.00 C ATOM 97 CD1 LEU A 92 5.255 4.260 -8.632 1.00 0.00 C ATOM 98 CD2 LEU A 92 3.936 3.755 -10.687 1.00 0.00 C ATOM 0 H LEU A 92 3.558 -0.223 -7.635 1.00 0.00 H new ATOM 0 HA LEU A 92 4.902 2.302 -6.891 1.00 0.00 H new ATOM 0 HB2 LEU A 92 4.874 1.620 -9.293 1.00 0.00 H new ATOM 0 HB3 LEU A 92 3.122 1.633 -9.251 1.00 0.00 H new ATOM 0 HG LEU A 92 3.138 4.044 -8.730 1.00 0.00 H new ATOM 0 HD11 LEU A 92 5.238 5.317 -8.899 1.00 0.00 H new ATOM 0 HD12 LEU A 92 5.274 4.160 -7.547 1.00 0.00 H new ATOM 0 HD13 LEU A 92 6.144 3.793 -9.055 1.00 0.00 H new ATOM 0 HD21 LEU A 92 3.938 4.818 -10.929 1.00 0.00 H new ATOM 0 HD22 LEU A 92 4.795 3.275 -11.155 1.00 0.00 H new ATOM 0 HD23 LEU A 92 3.018 3.300 -11.060 1.00 0.00 H new ATOM 110 N VAL A 93 2.938 3.132 -5.651 1.00 0.00 N ATOM 111 CA VAL A 93 1.805 3.698 -4.942 1.00 0.00 C ATOM 112 C VAL A 93 1.669 5.177 -5.279 1.00 0.00 C ATOM 113 O VAL A 93 2.576 5.968 -5.035 1.00 0.00 O ATOM 114 CB VAL A 93 1.944 3.527 -3.412 1.00 0.00 C ATOM 115 CG1 VAL A 93 0.729 4.092 -2.687 1.00 0.00 C ATOM 116 CG2 VAL A 93 2.149 2.065 -3.051 1.00 0.00 C ATOM 0 H VAL A 93 3.847 3.444 -5.310 1.00 0.00 H new ATOM 0 HA VAL A 93 0.912 3.160 -5.262 1.00 0.00 H new ATOM 0 HB VAL A 93 2.822 4.087 -3.090 1.00 0.00 H new ATOM 0 HG11 VAL A 93 0.852 3.959 -1.612 1.00 0.00 H new ATOM 0 HG12 VAL A 93 0.632 5.154 -2.912 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -0.168 3.568 -3.017 1.00 0.00 H new ATOM 0 HG21 VAL A 93 2.244 1.967 -1.970 1.00 0.00 H new ATOM 0 HG22 VAL A 93 1.294 1.482 -3.394 1.00 0.00 H new ATOM 0 HG23 VAL A 93 3.056 1.696 -3.530 1.00 0.00 H new ATOM 126 N ARG A 94 0.543 5.543 -5.864 1.00 0.00 N ATOM 127 CA ARG A 94 0.303 6.925 -6.233 1.00 0.00 C ATOM 128 C ARG A 94 -0.377 7.664 -5.091 1.00 0.00 C ATOM 129 O ARG A 94 -1.345 7.172 -4.508 1.00 0.00 O ATOM 130 CB ARG A 94 -0.522 7.008 -7.519 1.00 0.00 C ATOM 131 CG ARG A 94 0.273 6.604 -8.750 1.00 0.00 C ATOM 132 CD ARG A 94 -0.537 6.728 -10.028 1.00 0.00 C ATOM 133 NE ARG A 94 0.302 6.540 -11.214 1.00 0.00 N ATOM 134 CZ ARG A 94 0.014 5.707 -12.215 1.00 0.00 C ATOM 135 NH1 ARG A 94 -1.089 4.972 -12.182 1.00 0.00 N ATOM 136 NH2 ARG A 94 0.831 5.610 -13.254 1.00 0.00 N ATOM 0 H ARG A 94 -0.218 4.904 -6.093 1.00 0.00 H new ATOM 0 HA ARG A 94 1.262 7.407 -6.426 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -1.396 6.363 -7.428 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -0.889 8.027 -7.646 1.00 0.00 H new ATOM 0 HG2 ARG A 94 1.163 7.228 -8.825 1.00 0.00 H new ATOM 0 HG3 ARG A 94 0.614 5.575 -8.637 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -1.338 5.988 -10.026 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -1.010 7.709 -10.067 1.00 0.00 H new ATOM 0 HE ARG A 94 1.164 7.082 -11.279 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -1.724 5.041 -11.387 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -1.302 4.337 -12.952 1.00 0.00 H new ATOM 0 HH21 ARG A 94 1.681 6.173 -13.289 1.00 0.00 H new ATOM 0 HH22 ARG A 94 0.610 4.973 -14.019 1.00 0.00 H new ATOM 150 N ASN A 95 0.144 8.847 -4.781 1.00 0.00 N ATOM 151 CA ASN A 95 -0.321 9.646 -3.644 1.00 0.00 C ATOM 152 C ASN A 95 -1.778 10.056 -3.825 1.00 0.00 C ATOM 153 O ASN A 95 -2.440 10.472 -2.878 1.00 0.00 O ATOM 154 CB ASN A 95 0.541 10.907 -3.477 1.00 0.00 C ATOM 155 CG ASN A 95 2.028 10.623 -3.311 1.00 0.00 C ATOM 156 OD1 ASN A 95 2.576 9.687 -3.892 1.00 0.00 O ATOM 157 ND2 ASN A 95 2.695 11.441 -2.517 1.00 0.00 N ATOM 0 H ASN A 95 0.901 9.282 -5.309 1.00 0.00 H new ATOM 0 HA ASN A 95 -0.233 9.027 -2.751 1.00 0.00 H new ATOM 0 HB2 ASN A 95 0.399 11.549 -4.346 1.00 0.00 H new ATOM 0 HB3 ASN A 95 0.189 11.463 -2.608 1.00 0.00 H new ATOM 0 HD21 ASN A 95 3.695 11.306 -2.370 1.00 0.00 H new ATOM 0 HD22 ASN A 95 2.210 12.207 -2.050 1.00 0.00 H new ATOM 164 N ASN A 96 -2.251 9.962 -5.059 1.00 0.00 N ATOM 165 CA ASN A 96 -3.637 10.258 -5.398 1.00 0.00 C ATOM 166 C ASN A 96 -3.905 9.802 -6.824 1.00 0.00 C ATOM 167 O ASN A 96 -4.752 8.944 -7.071 1.00 0.00 O ATOM 168 CB ASN A 96 -3.956 11.760 -5.235 1.00 0.00 C ATOM 169 CG ASN A 96 -2.908 12.682 -5.847 1.00 0.00 C ATOM 170 OD1 ASN A 96 -2.951 13.004 -7.035 1.00 0.00 O ATOM 171 ND2 ASN A 96 -1.969 13.124 -5.028 1.00 0.00 N ATOM 0 H ASN A 96 -1.683 9.677 -5.857 1.00 0.00 H new ATOM 0 HA ASN A 96 -4.289 9.719 -4.710 1.00 0.00 H new ATOM 0 HB2 ASN A 96 -4.922 11.968 -5.694 1.00 0.00 H new ATOM 0 HB3 ASN A 96 -4.052 11.988 -4.173 1.00 0.00 H new ATOM 0 HD21 ASN A 96 -1.246 13.755 -5.374 1.00 0.00 H new ATOM 0 HD22 ASN A 96 -1.968 12.834 -4.050 1.00 0.00 H new ATOM 178 N LYS A 97 -3.149 10.368 -7.751 1.00 0.00 N ATOM 179 CA LYS A 97 -3.231 10.014 -9.157 1.00 0.00 C ATOM 180 C LYS A 97 -2.064 10.633 -9.917 1.00 0.00 C ATOM 181 O LYS A 97 -1.554 10.049 -10.873 1.00 0.00 O ATOM 182 CB LYS A 97 -4.570 10.477 -9.740 1.00 0.00 C ATOM 183 CG LYS A 97 -4.834 11.970 -9.575 1.00 0.00 C ATOM 184 CD LYS A 97 -6.303 12.297 -9.757 1.00 0.00 C ATOM 185 CE LYS A 97 -6.821 11.782 -11.084 1.00 0.00 C ATOM 186 NZ LYS A 97 -8.290 11.943 -11.197 1.00 0.00 N ATOM 0 H LYS A 97 -2.458 11.090 -7.547 1.00 0.00 H new ATOM 0 HA LYS A 97 -3.172 8.930 -9.258 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -4.598 10.228 -10.801 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -5.375 9.921 -9.261 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -4.508 12.291 -8.586 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -4.243 12.528 -10.302 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -6.879 11.856 -8.943 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -6.447 13.376 -9.702 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -6.332 12.317 -11.898 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -6.561 10.729 -11.193 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -8.609 11.580 -12.118 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -8.757 11.412 -10.435 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -8.536 12.950 -11.118 1.00 0.00 H new ATOM 200 N GLY A 98 -1.636 11.814 -9.475 1.00 0.00 N ATOM 201 CA GLY A 98 -0.507 12.478 -10.093 1.00 0.00 C ATOM 202 C GLY A 98 0.826 11.895 -9.660 1.00 0.00 C ATOM 203 O GLY A 98 1.450 11.141 -10.404 1.00 0.00 O ATOM 0 H GLY A 98 -2.055 12.322 -8.696 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -0.596 12.404 -11.177 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -0.533 13.539 -9.843 1.00 0.00 H new ATOM 207 N ARG A 99 1.260 12.229 -8.448 1.00 0.00 N ATOM 208 CA ARG A 99 2.561 11.783 -7.964 1.00 0.00 C ATOM 209 C ARG A 99 2.556 10.282 -7.707 1.00 0.00 C ATOM 210 O ARG A 99 1.622 9.746 -7.110 1.00 0.00 O ATOM 211 CB ARG A 99 2.955 12.526 -6.684 1.00 0.00 C ATOM 212 CG ARG A 99 4.454 12.506 -6.432 1.00 0.00 C ATOM 213 CD ARG A 99 4.829 13.186 -5.126 1.00 0.00 C ATOM 214 NE ARG A 99 6.252 13.510 -5.086 1.00 0.00 N ATOM 215 CZ ARG A 99 7.168 12.816 -4.413 1.00 0.00 C ATOM 216 NH1 ARG A 99 6.811 11.766 -3.680 1.00 0.00 N ATOM 217 NH2 ARG A 99 8.442 13.175 -4.479 1.00 0.00 N ATOM 0 H ARG A 99 0.734 12.802 -7.788 1.00 0.00 H new ATOM 0 HA ARG A 99 3.295 12.007 -8.738 1.00 0.00 H new ATOM 0 HB2 ARG A 99 2.616 13.560 -6.750 1.00 0.00 H new ATOM 0 HB3 ARG A 99 2.442 12.075 -5.835 1.00 0.00 H new ATOM 0 HG2 ARG A 99 4.803 11.474 -6.415 1.00 0.00 H new ATOM 0 HG3 ARG A 99 4.965 13.002 -7.257 1.00 0.00 H new ATOM 0 HD2 ARG A 99 4.243 14.097 -5.007 1.00 0.00 H new ATOM 0 HD3 ARG A 99 4.579 12.534 -4.289 1.00 0.00 H new ATOM 0 HE ARG A 99 6.567 14.326 -5.611 1.00 0.00 H new ATOM 0 HH11 ARG A 99 5.831 11.488 -3.631 1.00 0.00 H new ATOM 0 HH12 ARG A 99 7.517 11.238 -3.167 1.00 0.00 H new ATOM 0 HH21 ARG A 99 8.717 13.979 -5.043 1.00 0.00 H new ATOM 0 HH22 ARG A 99 9.148 12.647 -3.966 1.00 0.00 H new ATOM 231 N SER A 100 3.598 9.614 -8.169 1.00 0.00 N ATOM 232 CA SER A 100 3.726 8.181 -8.000 1.00 0.00 C ATOM 233 C SER A 100 4.973 7.865 -7.182 1.00 0.00 C ATOM 234 O SER A 100 6.078 8.261 -7.556 1.00 0.00 O ATOM 235 CB SER A 100 3.796 7.516 -9.375 1.00 0.00 C ATOM 236 OG SER A 100 2.729 7.952 -10.207 1.00 0.00 O ATOM 0 H SER A 100 4.374 10.048 -8.669 1.00 0.00 H new ATOM 0 HA SER A 100 2.860 7.793 -7.464 1.00 0.00 H new ATOM 0 HB2 SER A 100 4.750 7.750 -9.848 1.00 0.00 H new ATOM 0 HB3 SER A 100 3.754 6.433 -9.262 1.00 0.00 H new ATOM 0 HG SER A 100 3.016 7.934 -11.144 1.00 0.00 H new ATOM 242 N SER A 101 4.794 7.181 -6.061 1.00 0.00 N ATOM 243 CA SER A 101 5.903 6.853 -5.180 1.00 0.00 C ATOM 244 C SER A 101 6.108 5.338 -5.143 1.00 0.00 C ATOM 245 O SER A 101 5.176 4.575 -4.882 1.00 0.00 O ATOM 246 CB SER A 101 5.626 7.401 -3.777 1.00 0.00 C ATOM 247 OG SER A 101 6.781 7.361 -2.959 1.00 0.00 O ATOM 0 H SER A 101 3.887 6.842 -5.740 1.00 0.00 H new ATOM 0 HA SER A 101 6.817 7.313 -5.557 1.00 0.00 H new ATOM 0 HB2 SER A 101 5.269 8.428 -3.852 1.00 0.00 H new ATOM 0 HB3 SER A 101 4.830 6.820 -3.311 1.00 0.00 H new ATOM 0 HG SER A 101 6.541 7.025 -2.070 1.00 0.00 H new ATOM 253 N THR A 102 7.326 4.904 -5.426 1.00 0.00 N ATOM 254 CA THR A 102 7.632 3.483 -5.489 1.00 0.00 C ATOM 255 C THR A 102 8.077 2.957 -4.122 1.00 0.00 C ATOM 256 O THR A 102 8.894 3.584 -3.444 1.00 0.00 O ATOM 257 CB THR A 102 8.743 3.218 -6.521 1.00 0.00 C ATOM 258 OG1 THR A 102 8.547 4.055 -7.669 1.00 0.00 O ATOM 259 CG2 THR A 102 8.741 1.763 -6.955 1.00 0.00 C ATOM 0 H THR A 102 8.120 5.516 -5.616 1.00 0.00 H new ATOM 0 HA THR A 102 6.724 2.961 -5.790 1.00 0.00 H new ATOM 0 HB THR A 102 9.703 3.444 -6.057 1.00 0.00 H new ATOM 0 HG1 THR A 102 9.257 3.885 -8.323 1.00 0.00 H new ATOM 0 HG21 THR A 102 9.534 1.600 -7.684 1.00 0.00 H new ATOM 0 HG22 THR A 102 8.908 1.124 -6.088 1.00 0.00 H new ATOM 0 HG23 THR A 102 7.779 1.519 -7.405 1.00 0.00 H new ATOM 267 N TYR A 103 7.538 1.809 -3.724 1.00 0.00 N ATOM 268 CA TYR A 103 7.882 1.204 -2.442 1.00 0.00 C ATOM 269 C TYR A 103 8.189 -0.275 -2.616 1.00 0.00 C ATOM 270 O TYR A 103 7.505 -0.973 -3.361 1.00 0.00 O ATOM 271 CB TYR A 103 6.739 1.374 -1.436 1.00 0.00 C ATOM 272 CG TYR A 103 6.421 2.815 -1.117 1.00 0.00 C ATOM 273 CD1 TYR A 103 7.249 3.561 -0.291 1.00 0.00 C ATOM 274 CD2 TYR A 103 5.297 3.432 -1.650 1.00 0.00 C ATOM 275 CE1 TYR A 103 6.967 4.883 -0.004 1.00 0.00 C ATOM 276 CE2 TYR A 103 5.008 4.753 -1.372 1.00 0.00 C ATOM 277 CZ TYR A 103 5.844 5.474 -0.547 1.00 0.00 C ATOM 278 OH TYR A 103 5.564 6.793 -0.275 1.00 0.00 O ATOM 0 H TYR A 103 6.860 1.278 -4.272 1.00 0.00 H new ATOM 0 HA TYR A 103 8.768 1.712 -2.060 1.00 0.00 H new ATOM 0 HB2 TYR A 103 5.844 0.893 -1.831 1.00 0.00 H new ATOM 0 HB3 TYR A 103 6.999 0.856 -0.513 1.00 0.00 H new ATOM 0 HD1 TYR A 103 8.129 3.101 0.135 1.00 0.00 H new ATOM 0 HD2 TYR A 103 4.637 2.869 -2.293 1.00 0.00 H new ATOM 0 HE1 TYR A 103 7.621 5.450 0.641 1.00 0.00 H new ATOM 0 HE2 TYR A 103 4.132 5.219 -1.799 1.00 0.00 H new ATOM 0 HH TYR A 103 4.739 7.054 -0.735 1.00 0.00 H new ATOM 288 N GLU A 104 9.212 -0.751 -1.924 1.00 0.00 N ATOM 289 CA GLU A 104 9.602 -2.152 -2.008 1.00 0.00 C ATOM 290 C GLU A 104 9.060 -2.936 -0.819 1.00 0.00 C ATOM 291 O GLU A 104 9.536 -2.788 0.308 1.00 0.00 O ATOM 292 CB GLU A 104 11.120 -2.281 -2.083 1.00 0.00 C ATOM 293 CG GLU A 104 11.706 -1.691 -3.351 1.00 0.00 C ATOM 294 CD GLU A 104 13.217 -1.687 -3.347 1.00 0.00 C ATOM 295 OE1 GLU A 104 13.821 -2.759 -3.561 1.00 0.00 O ATOM 296 OE2 GLU A 104 13.812 -0.609 -3.139 1.00 0.00 O ATOM 0 H GLU A 104 9.788 -0.189 -1.298 1.00 0.00 H new ATOM 0 HA GLU A 104 9.173 -2.571 -2.918 1.00 0.00 H new ATOM 0 HB2 GLU A 104 11.564 -1.785 -1.220 1.00 0.00 H new ATOM 0 HB3 GLU A 104 11.393 -3.334 -2.020 1.00 0.00 H new ATOM 0 HG2 GLU A 104 11.350 -2.260 -4.210 1.00 0.00 H new ATOM 0 HG3 GLU A 104 11.344 -0.670 -3.473 1.00 0.00 H new ATOM 303 N VAL A 105 8.058 -3.758 -1.075 1.00 0.00 N ATOM 304 CA VAL A 105 7.424 -4.541 -0.027 1.00 0.00 C ATOM 305 C VAL A 105 7.429 -6.018 -0.401 1.00 0.00 C ATOM 306 O VAL A 105 7.362 -6.366 -1.575 1.00 0.00 O ATOM 307 CB VAL A 105 5.970 -4.070 0.224 1.00 0.00 C ATOM 308 CG1 VAL A 105 5.942 -2.587 0.571 1.00 0.00 C ATOM 309 CG2 VAL A 105 5.093 -4.351 -0.987 1.00 0.00 C ATOM 0 H VAL A 105 7.663 -3.902 -2.005 1.00 0.00 H new ATOM 0 HA VAL A 105 7.994 -4.396 0.891 1.00 0.00 H new ATOM 0 HB VAL A 105 5.572 -4.631 1.069 1.00 0.00 H new ATOM 0 HG11 VAL A 105 4.913 -2.273 0.744 1.00 0.00 H new ATOM 0 HG12 VAL A 105 6.531 -2.413 1.472 1.00 0.00 H new ATOM 0 HG13 VAL A 105 6.363 -2.012 -0.254 1.00 0.00 H new ATOM 0 HG21 VAL A 105 4.077 -4.012 -0.787 1.00 0.00 H new ATOM 0 HG22 VAL A 105 5.489 -3.821 -1.854 1.00 0.00 H new ATOM 0 HG23 VAL A 105 5.085 -5.422 -1.189 1.00 0.00 H new ATOM 319 N ARG A 106 7.527 -6.887 0.584 1.00 0.00 N ATOM 320 CA ARG A 106 7.547 -8.312 0.310 1.00 0.00 C ATOM 321 C ARG A 106 6.145 -8.893 0.406 1.00 0.00 C ATOM 322 O ARG A 106 5.272 -8.332 1.066 1.00 0.00 O ATOM 323 CB ARG A 106 8.510 -9.029 1.253 1.00 0.00 C ATOM 324 CG ARG A 106 9.942 -8.573 1.060 1.00 0.00 C ATOM 325 CD ARG A 106 10.913 -9.309 1.959 1.00 0.00 C ATOM 326 NE ARG A 106 12.276 -8.815 1.773 1.00 0.00 N ATOM 327 CZ ARG A 106 13.374 -9.469 2.147 1.00 0.00 C ATOM 328 NH1 ARG A 106 13.283 -10.635 2.776 1.00 0.00 N ATOM 329 NH2 ARG A 106 14.566 -8.947 1.896 1.00 0.00 N ATOM 0 H ARG A 106 7.593 -6.638 1.571 1.00 0.00 H new ATOM 0 HA ARG A 106 7.904 -8.464 -0.708 1.00 0.00 H new ATOM 0 HB2 ARG A 106 8.208 -8.848 2.285 1.00 0.00 H new ATOM 0 HB3 ARG A 106 8.447 -10.104 1.086 1.00 0.00 H new ATOM 0 HG2 ARG A 106 10.230 -8.723 0.020 1.00 0.00 H new ATOM 0 HG3 ARG A 106 10.009 -7.503 1.258 1.00 0.00 H new ATOM 0 HD2 ARG A 106 10.616 -9.184 3.000 1.00 0.00 H new ATOM 0 HD3 ARG A 106 10.877 -10.377 1.743 1.00 0.00 H new ATOM 0 HE ARG A 106 12.394 -7.906 1.326 1.00 0.00 H new ATOM 0 HH11 ARG A 106 12.367 -11.036 2.976 1.00 0.00 H new ATOM 0 HH12 ARG A 106 14.129 -11.129 3.059 1.00 0.00 H new ATOM 0 HH21 ARG A 106 14.639 -8.049 1.419 1.00 0.00 H new ATOM 0 HH22 ARG A 106 15.410 -9.444 2.180 1.00 0.00 H new ATOM 343 N LEU A 107 5.937 -10.019 -0.261 1.00 0.00 N ATOM 344 CA LEU A 107 4.619 -10.644 -0.349 1.00 0.00 C ATOM 345 C LEU A 107 4.126 -11.134 1.011 1.00 0.00 C ATOM 346 O LEU A 107 2.947 -11.443 1.175 1.00 0.00 O ATOM 347 CB LEU A 107 4.640 -11.814 -1.346 1.00 0.00 C ATOM 348 CG LEU A 107 4.670 -11.427 -2.834 1.00 0.00 C ATOM 349 CD1 LEU A 107 5.983 -10.758 -3.220 1.00 0.00 C ATOM 350 CD2 LEU A 107 4.422 -12.648 -3.705 1.00 0.00 C ATOM 0 H LEU A 107 6.671 -10.526 -0.755 1.00 0.00 H new ATOM 0 HA LEU A 107 3.927 -9.880 -0.702 1.00 0.00 H new ATOM 0 HB2 LEU A 107 5.512 -12.432 -1.133 1.00 0.00 H new ATOM 0 HB3 LEU A 107 3.760 -12.433 -1.169 1.00 0.00 H new ATOM 0 HG LEU A 107 3.872 -10.704 -3.000 1.00 0.00 H new ATOM 0 HD11 LEU A 107 5.963 -10.501 -4.279 1.00 0.00 H new ATOM 0 HD12 LEU A 107 6.117 -9.852 -2.629 1.00 0.00 H new ATOM 0 HD13 LEU A 107 6.810 -11.442 -3.029 1.00 0.00 H new ATOM 0 HD21 LEU A 107 4.446 -12.357 -4.755 1.00 0.00 H new ATOM 0 HD22 LEU A 107 5.196 -13.392 -3.517 1.00 0.00 H new ATOM 0 HD23 LEU A 107 3.446 -13.071 -3.469 1.00 0.00 H new ATOM 362 N THR A 108 5.026 -11.187 1.981 1.00 0.00 N ATOM 363 CA THR A 108 4.689 -11.662 3.314 1.00 0.00 C ATOM 364 C THR A 108 4.187 -10.521 4.202 1.00 0.00 C ATOM 365 O THR A 108 3.913 -10.717 5.388 1.00 0.00 O ATOM 366 CB THR A 108 5.909 -12.344 3.978 1.00 0.00 C ATOM 367 OG1 THR A 108 5.558 -12.855 5.269 1.00 0.00 O ATOM 368 CG2 THR A 108 7.077 -11.373 4.115 1.00 0.00 C ATOM 0 H THR A 108 6.000 -10.905 1.869 1.00 0.00 H new ATOM 0 HA THR A 108 3.888 -12.393 3.206 1.00 0.00 H new ATOM 0 HB THR A 108 6.215 -13.169 3.335 1.00 0.00 H new ATOM 0 HG1 THR A 108 4.881 -12.276 5.677 1.00 0.00 H new ATOM 0 HG21 THR A 108 7.919 -11.881 4.585 1.00 0.00 H new ATOM 0 HG22 THR A 108 7.372 -11.018 3.128 1.00 0.00 H new ATOM 0 HG23 THR A 108 6.775 -10.525 4.730 1.00 0.00 H new ATOM 376 N GLN A 109 4.061 -9.331 3.633 1.00 0.00 N ATOM 377 CA GLN A 109 3.589 -8.184 4.392 1.00 0.00 C ATOM 378 C GLN A 109 2.084 -8.020 4.253 1.00 0.00 C ATOM 379 O GLN A 109 1.500 -8.345 3.216 1.00 0.00 O ATOM 380 CB GLN A 109 4.283 -6.900 3.939 1.00 0.00 C ATOM 381 CG GLN A 109 5.790 -6.926 4.106 1.00 0.00 C ATOM 382 CD GLN A 109 6.455 -5.633 3.673 1.00 0.00 C ATOM 383 OE1 GLN A 109 7.587 -5.640 3.197 1.00 0.00 O ATOM 384 NE2 GLN A 109 5.760 -4.512 3.835 1.00 0.00 N ATOM 0 H GLN A 109 4.277 -9.136 2.656 1.00 0.00 H new ATOM 0 HA GLN A 109 3.832 -8.367 5.439 1.00 0.00 H new ATOM 0 HB2 GLN A 109 4.046 -6.721 2.890 1.00 0.00 H new ATOM 0 HB3 GLN A 109 3.879 -6.061 4.505 1.00 0.00 H new ATOM 0 HG2 GLN A 109 6.031 -7.120 5.151 1.00 0.00 H new ATOM 0 HG3 GLN A 109 6.201 -7.752 3.525 1.00 0.00 H new ATOM 0 HE21 GLN A 109 4.822 -4.547 4.234 1.00 0.00 H new ATOM 0 HE22 GLN A 109 6.165 -3.617 3.560 1.00 0.00 H new ATOM 393 N THR A 110 1.466 -7.510 5.303 1.00 0.00 N ATOM 394 CA THR A 110 0.045 -7.216 5.298 1.00 0.00 C ATOM 395 C THR A 110 -0.199 -5.832 4.703 1.00 0.00 C ATOM 396 O THR A 110 0.715 -5.001 4.653 1.00 0.00 O ATOM 397 CB THR A 110 -0.514 -7.253 6.729 1.00 0.00 C ATOM 398 OG1 THR A 110 0.237 -6.351 7.557 1.00 0.00 O ATOM 399 CG2 THR A 110 -0.451 -8.663 7.306 1.00 0.00 C ATOM 0 H THR A 110 1.934 -7.288 6.182 1.00 0.00 H new ATOM 0 HA THR A 110 -0.460 -7.970 4.694 1.00 0.00 H new ATOM 0 HB THR A 110 -1.559 -6.946 6.702 1.00 0.00 H new ATOM 0 HG1 THR A 110 -0.119 -6.372 8.470 1.00 0.00 H new ATOM 0 HG21 THR A 110 -0.853 -8.660 8.319 1.00 0.00 H new ATOM 0 HG22 THR A 110 -1.040 -9.337 6.684 1.00 0.00 H new ATOM 0 HG23 THR A 110 0.585 -9.001 7.328 1.00 0.00 H new ATOM 407 N VAL A 111 -1.426 -5.579 4.252 1.00 0.00 N ATOM 408 CA VAL A 111 -1.790 -4.259 3.746 1.00 0.00 C ATOM 409 C VAL A 111 -1.655 -3.219 4.861 1.00 0.00 C ATOM 410 O VAL A 111 -1.277 -2.071 4.621 1.00 0.00 O ATOM 411 CB VAL A 111 -3.232 -4.241 3.187 1.00 0.00 C ATOM 412 CG1 VAL A 111 -3.579 -2.874 2.620 1.00 0.00 C ATOM 413 CG2 VAL A 111 -3.410 -5.318 2.127 1.00 0.00 C ATOM 0 H VAL A 111 -2.180 -6.266 4.227 1.00 0.00 H new ATOM 0 HA VAL A 111 -1.110 -4.015 2.930 1.00 0.00 H new ATOM 0 HB VAL A 111 -3.915 -4.450 4.011 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -4.598 -2.888 2.234 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -3.500 -2.123 3.406 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -2.888 -2.629 1.813 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -4.431 -5.289 1.746 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -2.712 -5.142 1.308 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -3.214 -6.296 2.566 1.00 0.00 H new ATOM 423 N ALA A 112 -1.930 -3.648 6.092 1.00 0.00 N ATOM 424 CA ALA A 112 -1.808 -2.783 7.257 1.00 0.00 C ATOM 425 C ALA A 112 -0.360 -2.367 7.473 1.00 0.00 C ATOM 426 O ALA A 112 -0.084 -1.253 7.917 1.00 0.00 O ATOM 427 CB ALA A 112 -2.334 -3.485 8.496 1.00 0.00 C ATOM 0 H ALA A 112 -2.240 -4.596 6.305 1.00 0.00 H new ATOM 0 HA ALA A 112 -2.404 -1.888 7.076 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -2.235 -2.825 9.358 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -3.384 -3.739 8.352 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -1.761 -4.396 8.669 1.00 0.00 H new ATOM 433 N HIS A 113 0.565 -3.266 7.153 1.00 0.00 N ATOM 434 CA HIS A 113 1.982 -2.986 7.322 1.00 0.00 C ATOM 435 C HIS A 113 2.419 -1.904 6.342 1.00 0.00 C ATOM 436 O HIS A 113 3.169 -0.999 6.701 1.00 0.00 O ATOM 437 CB HIS A 113 2.816 -4.254 7.129 1.00 0.00 C ATOM 438 CG HIS A 113 3.949 -4.368 8.098 1.00 0.00 C ATOM 439 ND1 HIS A 113 3.860 -5.085 9.272 1.00 0.00 N ATOM 440 CD2 HIS A 113 5.198 -3.852 8.069 1.00 0.00 C ATOM 441 CE1 HIS A 113 5.003 -5.002 9.922 1.00 0.00 C ATOM 442 NE2 HIS A 113 5.835 -4.261 9.214 1.00 0.00 N ATOM 0 H HIS A 113 0.358 -4.191 6.777 1.00 0.00 H new ATOM 0 HA HIS A 113 2.146 -2.629 8.339 1.00 0.00 H new ATOM 0 HB2 HIS A 113 2.169 -5.125 7.232 1.00 0.00 H new ATOM 0 HB3 HIS A 113 3.212 -4.269 6.114 1.00 0.00 H new ATOM 0 HD2 HIS A 113 5.617 -3.233 7.290 1.00 0.00 H new ATOM 0 HE1 HIS A 113 5.222 -5.463 10.874 1.00 0.00 H new ATOM 0 HE2 HIS A 113 6.794 -4.030 9.475 1.00 0.00 H new ATOM 451 N LEU A 114 1.932 -2.000 5.106 1.00 0.00 N ATOM 452 CA LEU A 114 2.164 -0.963 4.106 1.00 0.00 C ATOM 453 C LEU A 114 1.547 0.349 4.561 1.00 0.00 C ATOM 454 O LEU A 114 2.174 1.407 4.479 1.00 0.00 O ATOM 455 CB LEU A 114 1.565 -1.368 2.757 1.00 0.00 C ATOM 456 CG LEU A 114 1.692 -0.319 1.645 1.00 0.00 C ATOM 457 CD1 LEU A 114 3.150 -0.092 1.281 1.00 0.00 C ATOM 458 CD2 LEU A 114 0.895 -0.738 0.419 1.00 0.00 C ATOM 0 H LEU A 114 1.374 -2.787 4.774 1.00 0.00 H new ATOM 0 HA LEU A 114 3.240 -0.837 3.990 1.00 0.00 H new ATOM 0 HB2 LEU A 114 2.048 -2.287 2.424 1.00 0.00 H new ATOM 0 HB3 LEU A 114 0.509 -1.596 2.900 1.00 0.00 H new ATOM 0 HG LEU A 114 1.283 0.620 2.017 1.00 0.00 H new ATOM 0 HD11 LEU A 114 3.216 0.656 0.491 1.00 0.00 H new ATOM 0 HD12 LEU A 114 3.694 0.259 2.158 1.00 0.00 H new ATOM 0 HD13 LEU A 114 3.588 -1.027 0.933 1.00 0.00 H new ATOM 0 HD21 LEU A 114 0.998 0.019 -0.358 1.00 0.00 H new ATOM 0 HD22 LEU A 114 1.271 -1.692 0.049 1.00 0.00 H new ATOM 0 HD23 LEU A 114 -0.156 -0.842 0.687 1.00 0.00 H new ATOM 470 N LYS A 115 0.311 0.264 5.046 1.00 0.00 N ATOM 471 CA LYS A 115 -0.403 1.427 5.565 1.00 0.00 C ATOM 472 C LYS A 115 0.405 2.123 6.656 1.00 0.00 C ATOM 473 O LYS A 115 0.420 3.345 6.731 1.00 0.00 O ATOM 474 CB LYS A 115 -1.772 1.006 6.110 1.00 0.00 C ATOM 475 CG LYS A 115 -2.480 2.092 6.908 1.00 0.00 C ATOM 476 CD LYS A 115 -3.815 1.602 7.436 1.00 0.00 C ATOM 477 CE LYS A 115 -4.374 2.534 8.498 1.00 0.00 C ATOM 478 NZ LYS A 115 -5.672 2.045 9.033 1.00 0.00 N ATOM 0 H LYS A 115 -0.220 -0.606 5.090 1.00 0.00 H new ATOM 0 HA LYS A 115 -0.547 2.131 4.746 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -2.408 0.709 5.276 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -1.645 0.128 6.743 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -1.849 2.405 7.740 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -2.634 2.968 6.278 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -4.525 1.521 6.613 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -3.696 0.603 7.854 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -3.657 2.628 9.313 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -4.507 3.530 8.075 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -6.022 2.707 9.755 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -6.364 1.979 8.259 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -5.540 1.106 9.460 1.00 0.00 H new ATOM 492 N GLN A 116 1.085 1.342 7.486 1.00 0.00 N ATOM 493 CA GLN A 116 1.901 1.892 8.562 1.00 0.00 C ATOM 494 C GLN A 116 3.121 2.623 8.004 1.00 0.00 C ATOM 495 O GLN A 116 3.547 3.642 8.547 1.00 0.00 O ATOM 496 CB GLN A 116 2.333 0.785 9.527 1.00 0.00 C ATOM 497 CG GLN A 116 3.074 1.305 10.747 1.00 0.00 C ATOM 498 CD GLN A 116 3.422 0.219 11.742 1.00 0.00 C ATOM 499 OE1 GLN A 116 2.595 -0.811 11.815 1.00 0.00 O flip ATOM 500 NE2 GLN A 116 4.430 0.308 12.443 1.00 0.00 N flip ATOM 0 H GLN A 116 1.088 0.323 7.435 1.00 0.00 H new ATOM 0 HA GLN A 116 1.296 2.614 9.111 1.00 0.00 H new ATOM 0 HB2 GLN A 116 1.451 0.234 9.854 1.00 0.00 H new ATOM 0 HB3 GLN A 116 2.972 0.079 8.996 1.00 0.00 H new ATOM 0 HG2 GLN A 116 3.990 1.800 10.424 1.00 0.00 H new ATOM 0 HG3 GLN A 116 2.462 2.059 11.242 1.00 0.00 H new ATOM 0 HE21 GLN A 116 5.042 1.119 12.356 1.00 0.00 H new ATOM 0 HE22 GLN A 116 4.653 -0.430 13.111 1.00 0.00 H new ATOM 509 N GLN A 117 3.673 2.109 6.911 1.00 0.00 N ATOM 510 CA GLN A 117 4.786 2.775 6.242 1.00 0.00 C ATOM 511 C GLN A 117 4.301 4.099 5.648 1.00 0.00 C ATOM 512 O GLN A 117 4.938 5.149 5.803 1.00 0.00 O ATOM 513 CB GLN A 117 5.370 1.880 5.141 1.00 0.00 C ATOM 514 CG GLN A 117 5.762 0.493 5.628 1.00 0.00 C ATOM 515 CD GLN A 117 6.397 -0.370 4.546 1.00 0.00 C ATOM 516 OE1 GLN A 117 6.244 -1.593 4.544 1.00 0.00 O ATOM 517 NE2 GLN A 117 7.129 0.254 3.631 1.00 0.00 N ATOM 0 H GLN A 117 3.371 1.240 6.471 1.00 0.00 H new ATOM 0 HA GLN A 117 5.573 2.971 6.971 1.00 0.00 H new ATOM 0 HB2 GLN A 117 4.639 1.781 4.339 1.00 0.00 H new ATOM 0 HB3 GLN A 117 6.247 2.368 4.715 1.00 0.00 H new ATOM 0 HG2 GLN A 117 6.459 0.592 6.460 1.00 0.00 H new ATOM 0 HG3 GLN A 117 4.876 -0.013 6.013 1.00 0.00 H new ATOM 0 HE21 GLN A 117 7.232 1.268 3.665 1.00 0.00 H new ATOM 0 HE22 GLN A 117 7.588 -0.281 2.894 1.00 0.00 H new ATOM 526 N VAL A 118 3.150 4.046 4.992 1.00 0.00 N ATOM 527 CA VAL A 118 2.510 5.248 4.487 1.00 0.00 C ATOM 528 C VAL A 118 2.180 6.181 5.651 1.00 0.00 C ATOM 529 O VAL A 118 2.312 7.394 5.538 1.00 0.00 O ATOM 530 CB VAL A 118 1.224 4.927 3.695 1.00 0.00 C ATOM 531 CG1 VAL A 118 0.600 6.196 3.135 1.00 0.00 C ATOM 532 CG2 VAL A 118 1.520 3.943 2.570 1.00 0.00 C ATOM 0 H VAL A 118 2.642 3.183 4.798 1.00 0.00 H new ATOM 0 HA VAL A 118 3.206 5.734 3.804 1.00 0.00 H new ATOM 0 HB VAL A 118 0.511 4.469 4.381 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -0.304 5.943 2.581 1.00 0.00 H new ATOM 0 HG12 VAL A 118 0.348 6.869 3.954 1.00 0.00 H new ATOM 0 HG13 VAL A 118 1.309 6.686 2.468 1.00 0.00 H new ATOM 0 HG21 VAL A 118 0.602 3.729 2.023 1.00 0.00 H new ATOM 0 HG22 VAL A 118 2.254 4.377 1.891 1.00 0.00 H new ATOM 0 HG23 VAL A 118 1.916 3.019 2.990 1.00 0.00 H new ATOM 542 N SER A 119 1.788 5.592 6.778 1.00 0.00 N ATOM 543 CA SER A 119 1.520 6.341 7.998 1.00 0.00 C ATOM 544 C SER A 119 2.805 6.961 8.556 1.00 0.00 C ATOM 545 O SER A 119 2.762 7.866 9.391 1.00 0.00 O ATOM 546 CB SER A 119 0.858 5.440 9.048 1.00 0.00 C ATOM 547 OG SER A 119 -0.437 5.038 8.631 1.00 0.00 O ATOM 0 H SER A 119 1.648 4.586 6.869 1.00 0.00 H new ATOM 0 HA SER A 119 0.833 7.151 7.753 1.00 0.00 H new ATOM 0 HB2 SER A 119 1.478 4.560 9.220 1.00 0.00 H new ATOM 0 HB3 SER A 119 0.789 5.972 9.997 1.00 0.00 H new ATOM 0 HG SER A 119 -0.366 4.237 8.071 1.00 0.00 H new ATOM 553 N GLY A 120 3.943 6.467 8.091 1.00 0.00 N ATOM 554 CA GLY A 120 5.213 7.059 8.453 1.00 0.00 C ATOM 555 C GLY A 120 5.480 8.329 7.673 1.00 0.00 C ATOM 556 O GLY A 120 6.064 9.278 8.192 1.00 0.00 O ATOM 0 H GLY A 120 4.009 5.663 7.467 1.00 0.00 H new ATOM 0 HA2 GLY A 120 5.221 7.279 9.521 1.00 0.00 H new ATOM 0 HA3 GLY A 120 6.014 6.343 8.269 1.00 0.00 H new ATOM 560 N LEU A 121 5.053 8.346 6.415 1.00 0.00 N ATOM 561 CA LEU A 121 5.215 9.536 5.574 1.00 0.00 C ATOM 562 C LEU A 121 3.955 10.411 5.558 1.00 0.00 C ATOM 563 O LEU A 121 3.927 11.487 6.152 1.00 0.00 O ATOM 564 CB LEU A 121 5.589 9.149 4.135 1.00 0.00 C ATOM 565 CG LEU A 121 7.023 8.641 3.931 1.00 0.00 C ATOM 566 CD1 LEU A 121 7.211 7.256 4.526 1.00 0.00 C ATOM 567 CD2 LEU A 121 7.377 8.634 2.451 1.00 0.00 C ATOM 0 H LEU A 121 4.596 7.559 5.954 1.00 0.00 H new ATOM 0 HA LEU A 121 6.026 10.117 6.014 1.00 0.00 H new ATOM 0 HB2 LEU A 121 4.898 8.377 3.795 1.00 0.00 H new ATOM 0 HB3 LEU A 121 5.437 10.017 3.494 1.00 0.00 H new ATOM 0 HG LEU A 121 7.695 9.322 4.452 1.00 0.00 H new ATOM 0 HD11 LEU A 121 8.237 6.927 4.364 1.00 0.00 H new ATOM 0 HD12 LEU A 121 7.005 7.289 5.596 1.00 0.00 H new ATOM 0 HD13 LEU A 121 6.526 6.558 4.046 1.00 0.00 H new ATOM 0 HD21 LEU A 121 8.397 8.271 2.323 1.00 0.00 H new ATOM 0 HD22 LEU A 121 6.689 7.980 1.915 1.00 0.00 H new ATOM 0 HD23 LEU A 121 7.299 9.646 2.053 1.00 0.00 H new ATOM 579 N GLU A 122 2.915 9.926 4.894 1.00 0.00 N ATOM 580 CA GLU A 122 1.682 10.688 4.668 1.00 0.00 C ATOM 581 C GLU A 122 0.642 10.388 5.751 1.00 0.00 C ATOM 582 O GLU A 122 -0.521 10.762 5.617 1.00 0.00 O ATOM 583 CB GLU A 122 1.091 10.359 3.297 1.00 0.00 C ATOM 584 CG GLU A 122 2.091 10.431 2.149 1.00 0.00 C ATOM 585 CD GLU A 122 2.689 11.814 1.969 1.00 0.00 C ATOM 586 OE1 GLU A 122 1.945 12.750 1.606 1.00 0.00 O ATOM 587 OE2 GLU A 122 3.911 11.970 2.167 1.00 0.00 O ATOM 0 H GLU A 122 2.897 8.989 4.493 1.00 0.00 H new ATOM 0 HA GLU A 122 1.938 11.747 4.708 1.00 0.00 H new ATOM 0 HB2 GLU A 122 0.664 9.356 3.329 1.00 0.00 H new ATOM 0 HB3 GLU A 122 0.271 11.048 3.093 1.00 0.00 H new ATOM 0 HG2 GLU A 122 2.893 9.715 2.328 1.00 0.00 H new ATOM 0 HG3 GLU A 122 1.597 10.132 1.225 1.00 0.00 H new ATOM 594 N GLY A 123 1.086 9.662 6.777 1.00 0.00 N ATOM 595 CA GLY A 123 0.233 9.091 7.831 1.00 0.00 C ATOM 596 C GLY A 123 -0.749 10.017 8.540 1.00 0.00 C ATOM 597 O GLY A 123 -1.319 9.616 9.555 1.00 0.00 O ATOM 0 H GLY A 123 2.075 9.446 6.906 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -0.338 8.273 7.391 1.00 0.00 H new ATOM 0 HA3 GLY A 123 0.885 8.654 8.587 1.00 0.00 H new ATOM 601 N VAL A 124 -0.901 11.245 8.069 1.00 0.00 N ATOM 602 CA VAL A 124 -1.853 12.203 8.633 1.00 0.00 C ATOM 603 C VAL A 124 -3.282 11.644 8.680 1.00 0.00 C ATOM 604 O VAL A 124 -4.081 11.911 7.783 1.00 0.00 O ATOM 605 CB VAL A 124 -1.872 13.502 7.803 1.00 0.00 C ATOM 606 CG1 VAL A 124 -2.740 14.556 8.471 1.00 0.00 C ATOM 607 CG2 VAL A 124 -0.455 14.007 7.567 1.00 0.00 C ATOM 0 H VAL A 124 -0.367 11.612 7.281 1.00 0.00 H new ATOM 0 HA VAL A 124 -1.519 12.404 9.651 1.00 0.00 H new ATOM 0 HB VAL A 124 -2.312 13.286 6.829 1.00 0.00 H new ATOM 0 HG11 VAL A 124 -2.739 15.464 7.868 1.00 0.00 H new ATOM 0 HG12 VAL A 124 -3.760 14.183 8.563 1.00 0.00 H new ATOM 0 HG13 VAL A 124 -2.345 14.778 9.462 1.00 0.00 H new ATOM 0 HG21 VAL A 124 -0.489 14.924 6.979 1.00 0.00 H new ATOM 0 HG22 VAL A 124 0.024 14.207 8.525 1.00 0.00 H new ATOM 0 HG23 VAL A 124 0.115 13.251 7.027 1.00 0.00 H new ATOM 617 N GLN A 125 -3.571 10.866 9.724 1.00 0.00 N ATOM 618 CA GLN A 125 -4.899 10.292 9.985 1.00 0.00 C ATOM 619 C GLN A 125 -5.427 9.479 8.796 1.00 0.00 C ATOM 620 O GLN A 125 -5.761 10.025 7.745 1.00 0.00 O ATOM 621 CB GLN A 125 -5.884 11.394 10.390 1.00 0.00 C ATOM 622 CG GLN A 125 -6.749 11.013 11.583 1.00 0.00 C ATOM 623 CD GLN A 125 -8.014 10.276 11.188 1.00 0.00 C ATOM 624 OE1 GLN A 125 -8.012 9.060 11.004 1.00 0.00 O ATOM 625 NE2 GLN A 125 -9.115 11.005 11.095 1.00 0.00 N ATOM 0 H GLN A 125 -2.878 10.610 10.427 1.00 0.00 H new ATOM 0 HA GLN A 125 -4.798 9.593 10.815 1.00 0.00 H new ATOM 0 HB2 GLN A 125 -5.328 12.301 10.627 1.00 0.00 H new ATOM 0 HB3 GLN A 125 -6.528 11.627 9.542 1.00 0.00 H new ATOM 0 HG2 GLN A 125 -6.168 10.388 12.261 1.00 0.00 H new ATOM 0 HG3 GLN A 125 -7.018 11.915 12.133 1.00 0.00 H new ATOM 0 HE21 GLN A 125 -9.075 12.012 11.255 1.00 0.00 H new ATOM 0 HE22 GLN A 125 -10.003 10.560 10.863 1.00 0.00 H new ATOM 634 N ASP A 126 -5.551 8.166 8.990 1.00 0.00 N ATOM 635 CA ASP A 126 -5.915 7.241 7.908 1.00 0.00 C ATOM 636 C ASP A 126 -7.258 7.588 7.268 1.00 0.00 C ATOM 637 O ASP A 126 -7.597 7.065 6.209 1.00 0.00 O ATOM 638 CB ASP A 126 -5.962 5.799 8.420 1.00 0.00 C ATOM 639 CG ASP A 126 -7.230 5.485 9.193 1.00 0.00 C ATOM 640 OD1 ASP A 126 -7.273 5.746 10.411 1.00 0.00 O ATOM 641 OD2 ASP A 126 -8.189 4.958 8.585 1.00 0.00 O ATOM 0 H ASP A 126 -5.404 7.713 9.892 1.00 0.00 H new ATOM 0 HA ASP A 126 -5.142 7.341 7.146 1.00 0.00 H new ATOM 0 HB2 ASP A 126 -5.880 5.116 7.574 1.00 0.00 H new ATOM 0 HB3 ASP A 126 -5.099 5.618 9.060 1.00 0.00 H new ATOM 646 N ASP A 127 -8.019 8.462 7.908 1.00 0.00 N ATOM 647 CA ASP A 127 -9.307 8.881 7.375 1.00 0.00 C ATOM 648 C ASP A 127 -9.112 9.802 6.175 1.00 0.00 C ATOM 649 O ASP A 127 -9.945 9.840 5.266 1.00 0.00 O ATOM 650 CB ASP A 127 -10.125 9.582 8.459 1.00 0.00 C ATOM 651 CG ASP A 127 -11.479 10.054 7.971 1.00 0.00 C ATOM 652 OD1 ASP A 127 -12.162 9.291 7.256 1.00 0.00 O ATOM 653 OD2 ASP A 127 -11.877 11.183 8.324 1.00 0.00 O ATOM 0 H ASP A 127 -7.768 8.895 8.797 1.00 0.00 H new ATOM 0 HA ASP A 127 -9.852 7.997 7.045 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -10.265 8.900 9.298 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -9.563 10.437 8.834 1.00 0.00 H new ATOM 658 N LEU A 128 -8.004 10.537 6.166 1.00 0.00 N ATOM 659 CA LEU A 128 -7.701 11.437 5.066 1.00 0.00 C ATOM 660 C LEU A 128 -7.112 10.673 3.884 1.00 0.00 C ATOM 661 O LEU A 128 -7.441 10.950 2.731 1.00 0.00 O ATOM 662 CB LEU A 128 -6.742 12.532 5.539 1.00 0.00 C ATOM 663 CG LEU A 128 -7.285 13.415 6.665 1.00 0.00 C ATOM 664 CD1 LEU A 128 -6.198 14.337 7.186 1.00 0.00 C ATOM 665 CD2 LEU A 128 -8.481 14.220 6.180 1.00 0.00 C ATOM 0 H LEU A 128 -7.304 10.525 6.908 1.00 0.00 H new ATOM 0 HA LEU A 128 -8.627 11.903 4.730 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -5.817 12.065 5.876 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -6.488 13.166 4.689 1.00 0.00 H new ATOM 0 HG LEU A 128 -7.612 12.772 7.482 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -6.600 14.958 7.986 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -5.370 13.742 7.570 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -5.842 14.974 6.376 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -8.855 14.842 6.993 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -8.179 14.855 5.347 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -9.268 13.541 5.852 1.00 0.00 H new ATOM 677 N PHE A 129 -6.256 9.696 4.166 1.00 0.00 N ATOM 678 CA PHE A 129 -5.660 8.900 3.105 1.00 0.00 C ATOM 679 C PHE A 129 -6.215 7.475 3.115 1.00 0.00 C ATOM 680 O PHE A 129 -5.888 6.655 3.972 1.00 0.00 O ATOM 681 CB PHE A 129 -4.120 8.919 3.175 1.00 0.00 C ATOM 682 CG PHE A 129 -3.501 8.172 4.333 1.00 0.00 C ATOM 683 CD1 PHE A 129 -3.490 8.711 5.609 1.00 0.00 C ATOM 684 CD2 PHE A 129 -2.918 6.926 4.131 1.00 0.00 C ATOM 685 CE1 PHE A 129 -2.914 8.021 6.662 1.00 0.00 C ATOM 686 CE2 PHE A 129 -2.340 6.236 5.182 1.00 0.00 C ATOM 687 CZ PHE A 129 -2.340 6.782 6.446 1.00 0.00 C ATOM 0 H PHE A 129 -5.964 9.440 5.109 1.00 0.00 H new ATOM 0 HA PHE A 129 -5.935 9.353 2.153 1.00 0.00 H new ATOM 0 HB2 PHE A 129 -3.729 8.501 2.248 1.00 0.00 H new ATOM 0 HB3 PHE A 129 -3.791 9.957 3.220 1.00 0.00 H new ATOM 0 HD1 PHE A 129 -3.935 9.679 5.784 1.00 0.00 H new ATOM 0 HD2 PHE A 129 -2.916 6.492 3.142 1.00 0.00 H new ATOM 0 HE1 PHE A 129 -2.913 8.451 7.653 1.00 0.00 H new ATOM 0 HE2 PHE A 129 -1.889 5.270 5.011 1.00 0.00 H new ATOM 0 HZ PHE A 129 -1.892 6.243 7.268 1.00 0.00 H new ATOM 697 N TRP A 130 -7.083 7.202 2.161 1.00 0.00 N ATOM 698 CA TRP A 130 -7.700 5.895 2.022 1.00 0.00 C ATOM 699 C TRP A 130 -7.347 5.305 0.660 1.00 0.00 C ATOM 700 O TRP A 130 -7.780 5.798 -0.374 1.00 0.00 O ATOM 701 CB TRP A 130 -9.219 6.031 2.230 1.00 0.00 C ATOM 702 CG TRP A 130 -10.059 5.068 1.449 1.00 0.00 C ATOM 703 CD1 TRP A 130 -10.084 3.709 1.556 1.00 0.00 C ATOM 704 CD2 TRP A 130 -11.013 5.412 0.437 1.00 0.00 C ATOM 705 NE1 TRP A 130 -10.994 3.186 0.667 1.00 0.00 N ATOM 706 CE2 TRP A 130 -11.575 4.213 -0.031 1.00 0.00 C ATOM 707 CE3 TRP A 130 -11.442 6.621 -0.115 1.00 0.00 C ATOM 708 CZ2 TRP A 130 -12.547 4.188 -1.031 1.00 0.00 C ATOM 709 CZ3 TRP A 130 -12.405 6.596 -1.108 1.00 0.00 C ATOM 710 CH2 TRP A 130 -12.949 5.388 -1.556 1.00 0.00 C ATOM 0 H TRP A 130 -7.381 7.879 1.459 1.00 0.00 H new ATOM 0 HA TRP A 130 -7.322 5.207 2.778 1.00 0.00 H new ATOM 0 HB2 TRP A 130 -9.437 5.902 3.290 1.00 0.00 H new ATOM 0 HB3 TRP A 130 -9.516 7.046 1.965 1.00 0.00 H new ATOM 0 HD1 TRP A 130 -9.479 3.129 2.238 1.00 0.00 H new ATOM 0 HE1 TRP A 130 -11.203 2.195 0.547 1.00 0.00 H new ATOM 0 HE3 TRP A 130 -11.029 7.559 0.227 1.00 0.00 H new ATOM 0 HZ2 TRP A 130 -12.968 3.256 -1.379 1.00 0.00 H new ATOM 0 HZ3 TRP A 130 -12.742 7.525 -1.544 1.00 0.00 H new ATOM 0 HH2 TRP A 130 -13.701 5.401 -2.331 1.00 0.00 H new ATOM 721 N LEU A 131 -6.537 4.259 0.661 1.00 0.00 N ATOM 722 CA LEU A 131 -6.009 3.721 -0.583 1.00 0.00 C ATOM 723 C LEU A 131 -6.891 2.605 -1.136 1.00 0.00 C ATOM 724 O LEU A 131 -7.586 1.916 -0.390 1.00 0.00 O ATOM 725 CB LEU A 131 -4.560 3.240 -0.389 1.00 0.00 C ATOM 726 CG LEU A 131 -4.327 2.202 0.720 1.00 0.00 C ATOM 727 CD1 LEU A 131 -4.604 0.794 0.218 1.00 0.00 C ATOM 728 CD2 LEU A 131 -2.906 2.304 1.252 1.00 0.00 C ATOM 0 H LEU A 131 -6.232 3.768 1.502 1.00 0.00 H new ATOM 0 HA LEU A 131 -6.010 4.524 -1.320 1.00 0.00 H new ATOM 0 HB2 LEU A 131 -4.211 2.817 -1.331 1.00 0.00 H new ATOM 0 HB3 LEU A 131 -3.937 4.109 -0.180 1.00 0.00 H new ATOM 0 HG LEU A 131 -5.022 2.414 1.532 1.00 0.00 H new ATOM 0 HD11 LEU A 131 -4.431 0.080 1.023 1.00 0.00 H new ATOM 0 HD12 LEU A 131 -5.640 0.723 -0.114 1.00 0.00 H new ATOM 0 HD13 LEU A 131 -3.940 0.568 -0.616 1.00 0.00 H new ATOM 0 HD21 LEU A 131 -2.757 1.562 2.037 1.00 0.00 H new ATOM 0 HD22 LEU A 131 -2.200 2.122 0.442 1.00 0.00 H new ATOM 0 HD23 LEU A 131 -2.741 3.301 1.659 1.00 0.00 H new ATOM 740 N THR A 132 -6.859 2.451 -2.450 1.00 0.00 N ATOM 741 CA THR A 132 -7.612 1.414 -3.132 1.00 0.00 C ATOM 742 C THR A 132 -6.782 0.824 -4.269 1.00 0.00 C ATOM 743 O THR A 132 -5.868 1.474 -4.785 1.00 0.00 O ATOM 744 CB THR A 132 -8.936 1.967 -3.705 1.00 0.00 C ATOM 745 OG1 THR A 132 -8.700 3.211 -4.375 1.00 0.00 O ATOM 746 CG2 THR A 132 -9.974 2.161 -2.611 1.00 0.00 C ATOM 0 H THR A 132 -6.309 3.043 -3.073 1.00 0.00 H new ATOM 0 HA THR A 132 -7.844 0.639 -2.402 1.00 0.00 H new ATOM 0 HB THR A 132 -9.323 1.238 -4.417 1.00 0.00 H new ATOM 0 HG1 THR A 132 -9.544 3.553 -4.736 1.00 0.00 H new ATOM 0 HG21 THR A 132 -10.894 2.551 -3.047 1.00 0.00 H new ATOM 0 HG22 THR A 132 -10.178 1.205 -2.129 1.00 0.00 H new ATOM 0 HG23 THR A 132 -9.596 2.866 -1.871 1.00 0.00 H new ATOM 754 N PHE A 133 -7.077 -0.414 -4.639 1.00 0.00 N ATOM 755 CA PHE A 133 -6.421 -1.039 -5.780 1.00 0.00 C ATOM 756 C PHE A 133 -7.447 -1.542 -6.787 1.00 0.00 C ATOM 757 O PHE A 133 -7.552 -1.017 -7.891 1.00 0.00 O ATOM 758 CB PHE A 133 -5.489 -2.179 -5.340 1.00 0.00 C ATOM 759 CG PHE A 133 -5.133 -3.105 -6.470 1.00 0.00 C ATOM 760 CD1 PHE A 133 -4.526 -2.625 -7.623 1.00 0.00 C ATOM 761 CD2 PHE A 133 -5.446 -4.449 -6.393 1.00 0.00 C ATOM 762 CE1 PHE A 133 -4.253 -3.474 -8.677 1.00 0.00 C ATOM 763 CE2 PHE A 133 -5.164 -5.303 -7.439 1.00 0.00 C ATOM 764 CZ PHE A 133 -4.572 -4.813 -8.583 1.00 0.00 C ATOM 0 H PHE A 133 -7.763 -1.004 -4.168 1.00 0.00 H new ATOM 0 HA PHE A 133 -5.809 -0.278 -6.263 1.00 0.00 H new ATOM 0 HB2 PHE A 133 -4.576 -1.756 -4.921 1.00 0.00 H new ATOM 0 HB3 PHE A 133 -5.970 -2.750 -4.545 1.00 0.00 H new ATOM 0 HD1 PHE A 133 -4.265 -1.579 -7.696 1.00 0.00 H new ATOM 0 HD2 PHE A 133 -5.918 -4.836 -5.502 1.00 0.00 H new ATOM 0 HE1 PHE A 133 -3.790 -3.090 -9.574 1.00 0.00 H new ATOM 0 HE2 PHE A 133 -5.406 -6.353 -7.362 1.00 0.00 H new ATOM 0 HZ PHE A 133 -4.358 -5.478 -9.407 1.00 0.00 H new ATOM 774 N GLU A 134 -8.212 -2.550 -6.393 1.00 0.00 N ATOM 775 CA GLU A 134 -9.221 -3.139 -7.274 1.00 0.00 C ATOM 776 C GLU A 134 -10.462 -2.254 -7.334 1.00 0.00 C ATOM 777 O GLU A 134 -11.460 -2.603 -7.959 1.00 0.00 O ATOM 778 CB GLU A 134 -9.654 -4.512 -6.765 1.00 0.00 C ATOM 779 CG GLU A 134 -8.533 -5.516 -6.612 1.00 0.00 C ATOM 780 CD GLU A 134 -9.036 -6.845 -6.093 1.00 0.00 C ATOM 781 OE1 GLU A 134 -9.364 -6.930 -4.893 1.00 0.00 O ATOM 782 OE2 GLU A 134 -9.139 -7.798 -6.890 1.00 0.00 O ATOM 0 H GLU A 134 -8.156 -2.980 -5.470 1.00 0.00 H new ATOM 0 HA GLU A 134 -8.771 -3.231 -8.263 1.00 0.00 H new ATOM 0 HB2 GLU A 134 -10.145 -4.387 -5.800 1.00 0.00 H new ATOM 0 HB3 GLU A 134 -10.397 -4.920 -7.450 1.00 0.00 H new ATOM 0 HG2 GLU A 134 -8.043 -5.664 -7.575 1.00 0.00 H new ATOM 0 HG3 GLU A 134 -7.781 -5.120 -5.929 1.00 0.00 H new ATOM 789 N GLY A 135 -10.389 -1.114 -6.667 1.00 0.00 N ATOM 790 CA GLY A 135 -11.568 -0.311 -6.430 1.00 0.00 C ATOM 791 C GLY A 135 -11.995 -0.443 -4.986 1.00 0.00 C ATOM 792 O GLY A 135 -12.647 0.436 -4.426 1.00 0.00 O ATOM 0 H GLY A 135 -9.527 -0.728 -6.283 1.00 0.00 H new ATOM 0 HA2 GLY A 135 -11.361 0.733 -6.664 1.00 0.00 H new ATOM 0 HA3 GLY A 135 -12.376 -0.631 -7.088 1.00 0.00 H new ATOM 796 N LYS A 136 -11.598 -1.559 -4.386 1.00 0.00 N ATOM 797 CA LYS A 136 -11.846 -1.819 -2.977 1.00 0.00 C ATOM 798 C LYS A 136 -10.649 -1.352 -2.153 1.00 0.00 C ATOM 799 O LYS A 136 -9.543 -1.228 -2.686 1.00 0.00 O ATOM 800 CB LYS A 136 -12.071 -3.316 -2.735 1.00 0.00 C ATOM 801 CG LYS A 136 -13.204 -3.925 -3.542 1.00 0.00 C ATOM 802 CD LYS A 136 -13.510 -5.342 -3.069 1.00 0.00 C ATOM 803 CE LYS A 136 -12.293 -6.253 -3.173 1.00 0.00 C ATOM 804 NZ LYS A 136 -12.014 -6.660 -4.575 1.00 0.00 N ATOM 0 H LYS A 136 -11.096 -2.307 -4.864 1.00 0.00 H new ATOM 0 HA LYS A 136 -12.741 -1.274 -2.676 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -11.150 -3.850 -2.967 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -12.272 -3.473 -1.675 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -14.096 -3.306 -3.448 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -12.936 -3.940 -4.598 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -13.854 -5.313 -2.035 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -14.324 -5.755 -3.664 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -11.422 -5.740 -2.765 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -12.454 -7.142 -2.564 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -10.987 -6.751 -4.712 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -12.471 -7.574 -4.769 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -12.388 -5.941 -5.226 1.00 0.00 H new ATOM 818 N PRO A 137 -10.851 -1.091 -0.849 1.00 0.00 N ATOM 819 CA PRO A 137 -9.776 -0.675 0.061 1.00 0.00 C ATOM 820 C PRO A 137 -8.888 -1.847 0.473 1.00 0.00 C ATOM 821 O PRO A 137 -7.919 -1.670 1.213 1.00 0.00 O ATOM 822 CB PRO A 137 -10.519 -0.121 1.287 1.00 0.00 C ATOM 823 CG PRO A 137 -11.977 -0.148 0.942 1.00 0.00 C ATOM 824 CD PRO A 137 -12.136 -1.168 -0.148 1.00 0.00 C ATOM 0 HA PRO A 137 -9.111 0.049 -0.409 1.00 0.00 H new ATOM 0 HB2 PRO A 137 -10.317 -0.727 2.171 1.00 0.00 H new ATOM 0 HB3 PRO A 137 -10.192 0.894 1.514 1.00 0.00 H new ATOM 0 HG2 PRO A 137 -12.577 -0.413 1.812 1.00 0.00 H new ATOM 0 HG3 PRO A 137 -12.315 0.833 0.608 1.00 0.00 H new ATOM 0 HD2 PRO A 137 -12.320 -2.165 0.253 1.00 0.00 H new ATOM 0 HD3 PRO A 137 -12.972 -0.931 -0.806 1.00 0.00 H new ATOM 832 N LEU A 138 -9.251 -3.039 -0.005 1.00 0.00 N ATOM 833 CA LEU A 138 -8.509 -4.273 0.265 1.00 0.00 C ATOM 834 C LEU A 138 -8.681 -4.690 1.726 1.00 0.00 C ATOM 835 O LEU A 138 -9.510 -4.127 2.446 1.00 0.00 O ATOM 836 CB LEU A 138 -7.021 -4.117 -0.083 1.00 0.00 C ATOM 837 CG LEU A 138 -6.732 -3.625 -1.506 1.00 0.00 C ATOM 838 CD1 LEU A 138 -5.232 -3.538 -1.749 1.00 0.00 C ATOM 839 CD2 LEU A 138 -7.393 -4.532 -2.534 1.00 0.00 C ATOM 0 H LEU A 138 -10.073 -3.176 -0.594 1.00 0.00 H new ATOM 0 HA LEU A 138 -8.918 -5.058 -0.372 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -6.570 -3.420 0.624 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -6.528 -5.079 0.059 1.00 0.00 H new ATOM 0 HG LEU A 138 -7.154 -2.626 -1.614 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -5.048 -3.187 -2.764 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -4.788 -2.841 -1.038 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -4.785 -4.523 -1.619 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -7.175 -4.165 -3.537 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -7.007 -5.546 -2.427 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -8.471 -4.536 -2.375 1.00 0.00 H new ATOM 851 N GLU A 139 -7.921 -5.687 2.157 1.00 0.00 N ATOM 852 CA GLU A 139 -8.007 -6.168 3.527 1.00 0.00 C ATOM 853 C GLU A 139 -6.617 -6.479 4.062 1.00 0.00 C ATOM 854 O GLU A 139 -5.822 -7.138 3.395 1.00 0.00 O ATOM 855 CB GLU A 139 -8.899 -7.407 3.599 1.00 0.00 C ATOM 856 CG GLU A 139 -9.137 -7.908 5.011 1.00 0.00 C ATOM 857 CD GLU A 139 -10.199 -8.980 5.075 1.00 0.00 C ATOM 858 OE1 GLU A 139 -11.395 -8.631 5.074 1.00 0.00 O ATOM 859 OE2 GLU A 139 -9.846 -10.174 5.134 1.00 0.00 O ATOM 0 H GLU A 139 -7.239 -6.177 1.578 1.00 0.00 H new ATOM 0 HA GLU A 139 -8.450 -5.388 4.146 1.00 0.00 H new ATOM 0 HB2 GLU A 139 -9.860 -7.179 3.137 1.00 0.00 H new ATOM 0 HB3 GLU A 139 -8.445 -8.205 3.012 1.00 0.00 H new ATOM 0 HG2 GLU A 139 -8.204 -8.301 5.415 1.00 0.00 H new ATOM 0 HG3 GLU A 139 -9.432 -7.071 5.645 1.00 0.00 H new ATOM 866 N ASP A 140 -6.333 -6.005 5.272 1.00 0.00 N ATOM 867 CA ASP A 140 -4.998 -6.127 5.852 1.00 0.00 C ATOM 868 C ASP A 140 -4.674 -7.567 6.225 1.00 0.00 C ATOM 869 O ASP A 140 -3.507 -7.929 6.347 1.00 0.00 O ATOM 870 CB ASP A 140 -4.853 -5.224 7.078 1.00 0.00 C ATOM 871 CG ASP A 140 -5.652 -5.700 8.276 1.00 0.00 C ATOM 872 OD1 ASP A 140 -6.839 -5.329 8.384 1.00 0.00 O ATOM 873 OD2 ASP A 140 -5.091 -6.431 9.120 1.00 0.00 O ATOM 0 H ASP A 140 -7.010 -5.532 5.871 1.00 0.00 H new ATOM 0 HA ASP A 140 -4.287 -5.808 5.090 1.00 0.00 H new ATOM 0 HB2 ASP A 140 -3.800 -5.165 7.354 1.00 0.00 H new ATOM 0 HB3 ASP A 140 -5.171 -4.215 6.816 1.00 0.00 H new ATOM 878 N GLN A 141 -5.705 -8.381 6.399 1.00 0.00 N ATOM 879 CA GLN A 141 -5.522 -9.795 6.710 1.00 0.00 C ATOM 880 C GLN A 141 -4.853 -10.526 5.547 1.00 0.00 C ATOM 881 O GLN A 141 -4.111 -11.490 5.745 1.00 0.00 O ATOM 882 CB GLN A 141 -6.874 -10.439 7.038 1.00 0.00 C ATOM 883 CG GLN A 141 -6.854 -11.960 6.995 1.00 0.00 C ATOM 884 CD GLN A 141 -8.175 -12.588 7.394 1.00 0.00 C ATOM 885 OE1 GLN A 141 -8.379 -12.944 8.554 1.00 0.00 O ATOM 886 NE2 GLN A 141 -9.084 -12.706 6.442 1.00 0.00 N ATOM 0 H GLN A 141 -6.680 -8.088 6.330 1.00 0.00 H new ATOM 0 HA GLN A 141 -4.870 -9.876 7.580 1.00 0.00 H new ATOM 0 HB2 GLN A 141 -7.189 -10.117 8.031 1.00 0.00 H new ATOM 0 HB3 GLN A 141 -7.621 -10.074 6.333 1.00 0.00 H new ATOM 0 HG2 GLN A 141 -6.595 -12.285 5.987 1.00 0.00 H new ATOM 0 HG3 GLN A 141 -6.071 -12.325 7.659 1.00 0.00 H new ATOM 0 HE21 GLN A 141 -8.872 -12.398 5.493 1.00 0.00 H new ATOM 0 HE22 GLN A 141 -9.998 -13.106 6.656 1.00 0.00 H new ATOM 895 N LEU A 142 -5.106 -10.052 4.338 1.00 0.00 N ATOM 896 CA LEU A 142 -4.599 -10.705 3.143 1.00 0.00 C ATOM 897 C LEU A 142 -3.203 -10.195 2.803 1.00 0.00 C ATOM 898 O LEU A 142 -2.898 -9.017 3.002 1.00 0.00 O ATOM 899 CB LEU A 142 -5.558 -10.471 1.975 1.00 0.00 C ATOM 900 CG LEU A 142 -7.003 -10.906 2.237 1.00 0.00 C ATOM 901 CD1 LEU A 142 -7.877 -10.609 1.030 1.00 0.00 C ATOM 902 CD2 LEU A 142 -7.063 -12.386 2.593 1.00 0.00 C ATOM 0 H LEU A 142 -5.661 -9.215 4.158 1.00 0.00 H new ATOM 0 HA LEU A 142 -4.530 -11.776 3.331 1.00 0.00 H new ATOM 0 HB2 LEU A 142 -5.552 -9.410 1.724 1.00 0.00 H new ATOM 0 HB3 LEU A 142 -5.184 -11.007 1.103 1.00 0.00 H new ATOM 0 HG LEU A 142 -7.384 -10.336 3.084 1.00 0.00 H new ATOM 0 HD11 LEU A 142 -8.900 -10.925 1.235 1.00 0.00 H new ATOM 0 HD12 LEU A 142 -7.862 -9.539 0.825 1.00 0.00 H new ATOM 0 HD13 LEU A 142 -7.497 -11.150 0.164 1.00 0.00 H new ATOM 0 HD21 LEU A 142 -8.098 -12.675 2.775 1.00 0.00 H new ATOM 0 HD22 LEU A 142 -6.662 -12.975 1.768 1.00 0.00 H new ATOM 0 HD23 LEU A 142 -6.472 -12.569 3.490 1.00 0.00 H new ATOM 914 N PRO A 143 -2.331 -11.085 2.302 1.00 0.00 N ATOM 915 CA PRO A 143 -0.962 -10.726 1.932 1.00 0.00 C ATOM 916 C PRO A 143 -0.931 -9.723 0.785 1.00 0.00 C ATOM 917 O PRO A 143 -1.596 -9.909 -0.236 1.00 0.00 O ATOM 918 CB PRO A 143 -0.328 -12.055 1.499 1.00 0.00 C ATOM 919 CG PRO A 143 -1.242 -13.120 2.006 1.00 0.00 C ATOM 920 CD PRO A 143 -2.611 -12.508 2.053 1.00 0.00 C ATOM 0 HA PRO A 143 -0.432 -10.248 2.756 1.00 0.00 H new ATOM 0 HB2 PRO A 143 -0.229 -12.107 0.415 1.00 0.00 H new ATOM 0 HB3 PRO A 143 0.673 -12.166 1.916 1.00 0.00 H new ATOM 0 HG2 PRO A 143 -1.227 -13.991 1.350 1.00 0.00 H new ATOM 0 HG3 PRO A 143 -0.933 -13.460 2.995 1.00 0.00 H new ATOM 0 HD2 PRO A 143 -3.151 -12.655 1.118 1.00 0.00 H new ATOM 0 HD3 PRO A 143 -3.221 -12.944 2.845 1.00 0.00 H new ATOM 928 N LEU A 144 -0.140 -8.671 0.960 1.00 0.00 N ATOM 929 CA LEU A 144 -0.018 -7.604 -0.032 1.00 0.00 C ATOM 930 C LEU A 144 0.378 -8.183 -1.388 1.00 0.00 C ATOM 931 O LEU A 144 -0.087 -7.727 -2.436 1.00 0.00 O ATOM 932 CB LEU A 144 1.031 -6.591 0.449 1.00 0.00 C ATOM 933 CG LEU A 144 0.907 -5.165 -0.100 1.00 0.00 C ATOM 934 CD1 LEU A 144 1.775 -4.224 0.716 1.00 0.00 C ATOM 935 CD2 LEU A 144 1.310 -5.096 -1.566 1.00 0.00 C ATOM 0 H LEU A 144 0.435 -8.532 1.791 1.00 0.00 H new ATOM 0 HA LEU A 144 -0.978 -7.102 -0.148 1.00 0.00 H new ATOM 0 HB2 LEU A 144 0.985 -6.543 1.537 1.00 0.00 H new ATOM 0 HB3 LEU A 144 2.018 -6.972 0.188 1.00 0.00 H new ATOM 0 HG LEU A 144 -0.138 -4.863 -0.023 1.00 0.00 H new ATOM 0 HD11 LEU A 144 1.684 -3.212 0.322 1.00 0.00 H new ATOM 0 HD12 LEU A 144 1.450 -4.239 1.756 1.00 0.00 H new ATOM 0 HD13 LEU A 144 2.815 -4.544 0.656 1.00 0.00 H new ATOM 0 HD21 LEU A 144 1.210 -4.071 -1.923 1.00 0.00 H new ATOM 0 HD22 LEU A 144 2.345 -5.419 -1.674 1.00 0.00 H new ATOM 0 HD23 LEU A 144 0.663 -5.749 -2.152 1.00 0.00 H new ATOM 947 N GLY A 145 1.206 -9.223 -1.353 1.00 0.00 N ATOM 948 CA GLY A 145 1.702 -9.840 -2.568 1.00 0.00 C ATOM 949 C GLY A 145 0.604 -10.368 -3.475 1.00 0.00 C ATOM 950 O GLY A 145 0.807 -10.497 -4.677 1.00 0.00 O ATOM 0 H GLY A 145 1.545 -9.653 -0.492 1.00 0.00 H new ATOM 0 HA2 GLY A 145 2.297 -9.111 -3.118 1.00 0.00 H new ATOM 0 HA3 GLY A 145 2.368 -10.661 -2.303 1.00 0.00 H new ATOM 954 N GLU A 146 -0.565 -10.655 -2.911 1.00 0.00 N ATOM 955 CA GLU A 146 -1.674 -11.182 -3.696 1.00 0.00 C ATOM 956 C GLU A 146 -2.164 -10.137 -4.699 1.00 0.00 C ATOM 957 O GLU A 146 -2.621 -10.472 -5.791 1.00 0.00 O ATOM 958 CB GLU A 146 -2.815 -11.619 -2.776 1.00 0.00 C ATOM 959 CG GLU A 146 -3.956 -12.313 -3.504 1.00 0.00 C ATOM 960 CD GLU A 146 -5.020 -12.844 -2.565 1.00 0.00 C ATOM 961 OE1 GLU A 146 -4.801 -13.912 -1.954 1.00 0.00 O ATOM 962 OE2 GLU A 146 -6.090 -12.211 -2.447 1.00 0.00 O ATOM 0 H GLU A 146 -0.768 -10.532 -1.919 1.00 0.00 H new ATOM 0 HA GLU A 146 -1.324 -12.052 -4.251 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -2.419 -12.291 -2.015 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -3.206 -10.744 -2.256 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -4.413 -11.613 -4.203 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -3.555 -13.137 -4.094 1.00 0.00 H new ATOM 969 N TYR A 147 -2.045 -8.869 -4.327 1.00 0.00 N ATOM 970 CA TYR A 147 -2.468 -7.776 -5.193 1.00 0.00 C ATOM 971 C TYR A 147 -1.272 -7.159 -5.910 1.00 0.00 C ATOM 972 O TYR A 147 -1.394 -6.636 -7.021 1.00 0.00 O ATOM 973 CB TYR A 147 -3.173 -6.687 -4.379 1.00 0.00 C ATOM 974 CG TYR A 147 -4.330 -7.184 -3.544 1.00 0.00 C ATOM 975 CD1 TYR A 147 -5.529 -7.560 -4.135 1.00 0.00 C ATOM 976 CD2 TYR A 147 -4.225 -7.268 -2.160 1.00 0.00 C ATOM 977 CE1 TYR A 147 -6.591 -8.005 -3.372 1.00 0.00 C ATOM 978 CE2 TYR A 147 -5.284 -7.709 -1.389 1.00 0.00 C ATOM 979 CZ TYR A 147 -6.464 -8.077 -2.001 1.00 0.00 C ATOM 980 OH TYR A 147 -7.519 -8.513 -1.239 1.00 0.00 O ATOM 0 H TYR A 147 -1.659 -8.572 -3.431 1.00 0.00 H new ATOM 0 HA TYR A 147 -3.158 -8.187 -5.930 1.00 0.00 H new ATOM 0 HB2 TYR A 147 -2.444 -6.212 -3.722 1.00 0.00 H new ATOM 0 HB3 TYR A 147 -3.536 -5.918 -5.061 1.00 0.00 H new ATOM 0 HD1 TYR A 147 -5.633 -7.504 -5.209 1.00 0.00 H new ATOM 0 HD2 TYR A 147 -3.300 -6.984 -1.679 1.00 0.00 H new ATOM 0 HE1 TYR A 147 -7.516 -8.295 -3.847 1.00 0.00 H new ATOM 0 HE2 TYR A 147 -5.188 -7.765 -0.315 1.00 0.00 H new ATOM 0 HH TYR A 147 -8.056 -9.148 -1.757 1.00 0.00 H new ATOM 990 N GLY A 148 -0.119 -7.229 -5.265 1.00 0.00 N ATOM 991 CA GLY A 148 1.059 -6.543 -5.757 1.00 0.00 C ATOM 992 C GLY A 148 2.026 -7.440 -6.504 1.00 0.00 C ATOM 993 O GLY A 148 3.108 -6.996 -6.857 1.00 0.00 O ATOM 0 H GLY A 148 0.024 -7.753 -4.402 1.00 0.00 H new ATOM 0 HA2 GLY A 148 0.747 -5.733 -6.416 1.00 0.00 H new ATOM 0 HA3 GLY A 148 1.579 -6.086 -4.915 1.00 0.00 H new ATOM 997 N LEU A 149 1.644 -8.698 -6.726 1.00 0.00 N ATOM 998 CA LEU A 149 2.509 -9.702 -7.374 1.00 0.00 C ATOM 999 C LEU A 149 3.206 -9.175 -8.640 1.00 0.00 C ATOM 1000 O LEU A 149 4.306 -9.612 -8.974 1.00 0.00 O ATOM 1001 CB LEU A 149 1.710 -10.972 -7.726 1.00 0.00 C ATOM 1002 CG LEU A 149 0.698 -10.843 -8.875 1.00 0.00 C ATOM 1003 CD1 LEU A 149 0.175 -12.215 -9.269 1.00 0.00 C ATOM 1004 CD2 LEU A 149 -0.461 -9.934 -8.487 1.00 0.00 C ATOM 0 H LEU A 149 0.726 -9.057 -6.464 1.00 0.00 H new ATOM 0 HA LEU A 149 3.284 -9.939 -6.646 1.00 0.00 H new ATOM 0 HB2 LEU A 149 2.417 -11.762 -7.980 1.00 0.00 H new ATOM 0 HB3 LEU A 149 1.175 -11.298 -6.834 1.00 0.00 H new ATOM 0 HG LEU A 149 1.210 -10.396 -9.727 1.00 0.00 H new ATOM 0 HD11 LEU A 149 -0.541 -12.111 -10.084 1.00 0.00 H new ATOM 0 HD12 LEU A 149 1.006 -12.842 -9.594 1.00 0.00 H new ATOM 0 HD13 LEU A 149 -0.315 -12.677 -8.412 1.00 0.00 H new ATOM 0 HD21 LEU A 149 -1.161 -9.862 -9.319 1.00 0.00 H new ATOM 0 HD22 LEU A 149 -0.972 -10.347 -7.618 1.00 0.00 H new ATOM 0 HD23 LEU A 149 -0.080 -8.942 -8.246 1.00 0.00 H new ATOM 1016 N LYS A 150 2.563 -8.251 -9.338 1.00 0.00 N ATOM 1017 CA LYS A 150 3.147 -7.651 -10.529 1.00 0.00 C ATOM 1018 C LYS A 150 3.972 -6.417 -10.148 1.00 0.00 C ATOM 1019 O LYS A 150 3.435 -5.460 -9.587 1.00 0.00 O ATOM 1020 CB LYS A 150 2.037 -7.267 -11.518 1.00 0.00 C ATOM 1021 CG LYS A 150 2.526 -6.568 -12.779 1.00 0.00 C ATOM 1022 CD LYS A 150 3.452 -7.449 -13.608 1.00 0.00 C ATOM 1023 CE LYS A 150 2.766 -8.723 -14.070 1.00 0.00 C ATOM 1024 NZ LYS A 150 3.603 -9.479 -15.037 1.00 0.00 N ATOM 0 H LYS A 150 1.635 -7.900 -9.100 1.00 0.00 H new ATOM 0 HA LYS A 150 3.807 -8.376 -11.005 1.00 0.00 H new ATOM 0 HB2 LYS A 150 1.496 -8.169 -11.805 1.00 0.00 H new ATOM 0 HB3 LYS A 150 1.325 -6.616 -11.010 1.00 0.00 H new ATOM 0 HG2 LYS A 150 1.669 -6.275 -13.385 1.00 0.00 H new ATOM 0 HG3 LYS A 150 3.050 -5.652 -12.504 1.00 0.00 H new ATOM 0 HD2 LYS A 150 3.802 -6.891 -14.476 1.00 0.00 H new ATOM 0 HD3 LYS A 150 4.332 -7.705 -13.018 1.00 0.00 H new ATOM 0 HE2 LYS A 150 2.549 -9.353 -13.207 1.00 0.00 H new ATOM 0 HE3 LYS A 150 1.811 -8.475 -14.532 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 3.102 -10.342 -15.330 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 3.790 -8.887 -15.872 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 4.505 -9.738 -14.588 1.00 0.00 H new ATOM 1038 N PRO A 151 5.285 -6.434 -10.455 1.00 0.00 N ATOM 1039 CA PRO A 151 6.210 -5.330 -10.138 1.00 0.00 C ATOM 1040 C PRO A 151 5.957 -4.100 -11.005 1.00 0.00 C ATOM 1041 O PRO A 151 6.834 -3.634 -11.734 1.00 0.00 O ATOM 1042 CB PRO A 151 7.591 -5.929 -10.418 1.00 0.00 C ATOM 1043 CG PRO A 151 7.349 -7.017 -11.409 1.00 0.00 C ATOM 1044 CD PRO A 151 5.968 -7.547 -11.135 1.00 0.00 C ATOM 0 HA PRO A 151 6.094 -4.976 -9.114 1.00 0.00 H new ATOM 0 HB2 PRO A 151 8.273 -5.178 -10.816 1.00 0.00 H new ATOM 0 HB3 PRO A 151 8.044 -6.319 -9.506 1.00 0.00 H new ATOM 0 HG2 PRO A 151 7.423 -6.637 -12.428 1.00 0.00 H new ATOM 0 HG3 PRO A 151 8.094 -7.806 -11.308 1.00 0.00 H new ATOM 0 HD2 PRO A 151 5.457 -7.824 -12.057 1.00 0.00 H new ATOM 0 HD3 PRO A 151 6.000 -8.438 -10.508 1.00 0.00 H new ATOM 1052 N LEU A 152 4.760 -3.563 -10.869 1.00 0.00 N ATOM 1053 CA LEU A 152 4.268 -2.481 -11.710 1.00 0.00 C ATOM 1054 C LEU A 152 2.852 -2.106 -11.274 1.00 0.00 C ATOM 1055 O LEU A 152 2.410 -0.971 -11.477 1.00 0.00 O ATOM 1056 CB LEU A 152 4.268 -2.911 -13.186 1.00 0.00 C ATOM 1057 CG LEU A 152 3.890 -1.821 -14.190 1.00 0.00 C ATOM 1058 CD1 LEU A 152 4.893 -0.681 -14.145 1.00 0.00 C ATOM 1059 CD2 LEU A 152 3.801 -2.398 -15.593 1.00 0.00 C ATOM 0 H LEU A 152 4.090 -3.868 -10.163 1.00 0.00 H new ATOM 0 HA LEU A 152 4.923 -1.616 -11.602 1.00 0.00 H new ATOM 0 HB2 LEU A 152 5.261 -3.284 -13.438 1.00 0.00 H new ATOM 0 HB3 LEU A 152 3.576 -3.745 -13.303 1.00 0.00 H new ATOM 0 HG LEU A 152 2.911 -1.427 -13.917 1.00 0.00 H new ATOM 0 HD11 LEU A 152 4.607 0.084 -14.866 1.00 0.00 H new ATOM 0 HD12 LEU A 152 4.908 -0.249 -13.144 1.00 0.00 H new ATOM 0 HD13 LEU A 152 5.885 -1.059 -14.392 1.00 0.00 H new ATOM 0 HD21 LEU A 152 3.531 -1.609 -16.295 1.00 0.00 H new ATOM 0 HD22 LEU A 152 4.766 -2.820 -15.875 1.00 0.00 H new ATOM 0 HD23 LEU A 152 3.042 -3.180 -15.617 1.00 0.00 H new ATOM 1071 N SER A 153 2.151 -3.087 -10.691 1.00 0.00 N ATOM 1072 CA SER A 153 0.826 -2.881 -10.123 1.00 0.00 C ATOM 1073 C SER A 153 0.801 -1.611 -9.274 1.00 0.00 C ATOM 1074 O SER A 153 1.676 -1.392 -8.429 1.00 0.00 O ATOM 1075 CB SER A 153 0.426 -4.099 -9.280 1.00 0.00 C ATOM 1076 OG SER A 153 -0.915 -4.003 -8.825 1.00 0.00 O ATOM 0 H SER A 153 2.493 -4.044 -10.603 1.00 0.00 H new ATOM 0 HA SER A 153 0.108 -2.763 -10.934 1.00 0.00 H new ATOM 0 HB2 SER A 153 0.546 -5.007 -9.872 1.00 0.00 H new ATOM 0 HB3 SER A 153 1.096 -4.186 -8.424 1.00 0.00 H new ATOM 0 HG SER A 153 -1.487 -3.688 -9.556 1.00 0.00 H new ATOM 1082 N THR A 154 -0.190 -0.772 -9.520 1.00 0.00 N ATOM 1083 CA THR A 154 -0.250 0.532 -8.897 1.00 0.00 C ATOM 1084 C THR A 154 -1.390 0.628 -7.890 1.00 0.00 C ATOM 1085 O THR A 154 -2.540 0.307 -8.196 1.00 0.00 O ATOM 1086 CB THR A 154 -0.415 1.624 -9.966 1.00 0.00 C ATOM 1087 OG1 THR A 154 0.619 1.484 -10.947 1.00 0.00 O ATOM 1088 CG2 THR A 154 -0.349 3.014 -9.349 1.00 0.00 C ATOM 0 H THR A 154 -0.966 -0.975 -10.150 1.00 0.00 H new ATOM 0 HA THR A 154 0.687 0.680 -8.361 1.00 0.00 H new ATOM 0 HB THR A 154 -1.393 1.506 -10.432 1.00 0.00 H new ATOM 0 HG1 THR A 154 0.516 2.178 -11.632 1.00 0.00 H new ATOM 0 HG21 THR A 154 -0.469 3.765 -10.130 1.00 0.00 H new ATOM 0 HG22 THR A 154 -1.147 3.124 -8.614 1.00 0.00 H new ATOM 0 HG23 THR A 154 0.616 3.150 -8.860 1.00 0.00 H new ATOM 1096 N VAL A 155 -1.051 1.067 -6.689 1.00 0.00 N ATOM 1097 CA VAL A 155 -2.037 1.320 -5.655 1.00 0.00 C ATOM 1098 C VAL A 155 -2.340 2.813 -5.612 1.00 0.00 C ATOM 1099 O VAL A 155 -1.433 3.635 -5.736 1.00 0.00 O ATOM 1100 CB VAL A 155 -1.540 0.851 -4.270 1.00 0.00 C ATOM 1101 CG1 VAL A 155 -2.611 1.046 -3.204 1.00 0.00 C ATOM 1102 CG2 VAL A 155 -1.098 -0.604 -4.327 1.00 0.00 C ATOM 0 H VAL A 155 -0.090 1.257 -6.406 1.00 0.00 H new ATOM 0 HA VAL A 155 -2.939 0.756 -5.894 1.00 0.00 H new ATOM 0 HB VAL A 155 -0.682 1.464 -3.996 1.00 0.00 H new ATOM 0 HG11 VAL A 155 -2.231 0.707 -2.240 1.00 0.00 H new ATOM 0 HG12 VAL A 155 -2.872 2.102 -3.140 1.00 0.00 H new ATOM 0 HG13 VAL A 155 -3.497 0.469 -3.468 1.00 0.00 H new ATOM 0 HG21 VAL A 155 -0.751 -0.918 -3.343 1.00 0.00 H new ATOM 0 HG22 VAL A 155 -1.938 -1.228 -4.631 1.00 0.00 H new ATOM 0 HG23 VAL A 155 -0.288 -0.710 -5.048 1.00 0.00 H new ATOM 1112 N PHE A 156 -3.606 3.167 -5.458 1.00 0.00 N ATOM 1113 CA PHE A 156 -4.004 4.567 -5.471 1.00 0.00 C ATOM 1114 C PHE A 156 -4.441 5.030 -4.090 1.00 0.00 C ATOM 1115 O PHE A 156 -5.416 4.526 -3.532 1.00 0.00 O ATOM 1116 CB PHE A 156 -5.136 4.796 -6.472 1.00 0.00 C ATOM 1117 CG PHE A 156 -4.741 4.520 -7.893 1.00 0.00 C ATOM 1118 CD1 PHE A 156 -4.177 5.514 -8.676 1.00 0.00 C ATOM 1119 CD2 PHE A 156 -4.930 3.264 -8.446 1.00 0.00 C ATOM 1120 CE1 PHE A 156 -3.810 5.259 -9.983 1.00 0.00 C ATOM 1121 CE2 PHE A 156 -4.565 3.004 -9.749 1.00 0.00 C ATOM 1122 CZ PHE A 156 -4.004 4.002 -10.519 1.00 0.00 C ATOM 0 H PHE A 156 -4.373 2.508 -5.323 1.00 0.00 H new ATOM 0 HA PHE A 156 -3.135 5.152 -5.773 1.00 0.00 H new ATOM 0 HB2 PHE A 156 -5.980 4.159 -6.207 1.00 0.00 H new ATOM 0 HB3 PHE A 156 -5.478 5.828 -6.392 1.00 0.00 H new ATOM 0 HD1 PHE A 156 -4.023 6.499 -8.260 1.00 0.00 H new ATOM 0 HD2 PHE A 156 -5.369 2.479 -7.848 1.00 0.00 H new ATOM 0 HE1 PHE A 156 -3.372 6.042 -10.584 1.00 0.00 H new ATOM 0 HE2 PHE A 156 -4.718 2.020 -10.167 1.00 0.00 H new ATOM 0 HZ PHE A 156 -3.717 3.800 -11.540 1.00 0.00 H new ATOM 1132 N MET A 157 -3.709 5.986 -3.539 1.00 0.00 N ATOM 1133 CA MET A 157 -4.089 6.607 -2.281 1.00 0.00 C ATOM 1134 C MET A 157 -5.160 7.656 -2.526 1.00 0.00 C ATOM 1135 O MET A 157 -4.869 8.775 -2.944 1.00 0.00 O ATOM 1136 CB MET A 157 -2.879 7.245 -1.601 1.00 0.00 C ATOM 1137 CG MET A 157 -1.948 6.249 -0.932 1.00 0.00 C ATOM 1138 SD MET A 157 -0.434 7.026 -0.330 1.00 0.00 S ATOM 1139 CE MET A 157 -1.105 8.337 0.693 1.00 0.00 C ATOM 0 H MET A 157 -2.846 6.349 -3.945 1.00 0.00 H new ATOM 0 HA MET A 157 -4.484 5.835 -1.621 1.00 0.00 H new ATOM 0 HB2 MET A 157 -2.316 7.811 -2.342 1.00 0.00 H new ATOM 0 HB3 MET A 157 -3.229 7.957 -0.854 1.00 0.00 H new ATOM 0 HG2 MET A 157 -2.466 5.773 -0.099 1.00 0.00 H new ATOM 0 HG3 MET A 157 -1.693 5.461 -1.640 1.00 0.00 H new ATOM 0 HE1 MET A 157 -0.297 8.816 1.246 1.00 0.00 H new ATOM 0 HE2 MET A 157 -1.600 9.074 0.061 1.00 0.00 H new ATOM 0 HE3 MET A 157 -1.826 7.918 1.395 1.00 0.00 H new ATOM 1149 N ASN A 158 -6.400 7.281 -2.287 1.00 0.00 N ATOM 1150 CA ASN A 158 -7.515 8.190 -2.470 1.00 0.00 C ATOM 1151 C ASN A 158 -7.629 9.135 -1.286 1.00 0.00 C ATOM 1152 O ASN A 158 -8.177 8.788 -0.238 1.00 0.00 O ATOM 1153 CB ASN A 158 -8.821 7.416 -2.670 1.00 0.00 C ATOM 1154 CG ASN A 158 -9.190 7.268 -4.134 1.00 0.00 C ATOM 1155 OD1 ASN A 158 -9.908 8.097 -4.689 1.00 0.00 O ATOM 1156 ND2 ASN A 158 -8.707 6.210 -4.767 1.00 0.00 N ATOM 0 H ASN A 158 -6.662 6.350 -1.964 1.00 0.00 H new ATOM 0 HA ASN A 158 -7.331 8.781 -3.367 1.00 0.00 H new ATOM 0 HB2 ASN A 158 -8.726 6.427 -2.221 1.00 0.00 H new ATOM 0 HB3 ASN A 158 -9.627 7.928 -2.145 1.00 0.00 H new ATOM 0 HD21 ASN A 158 -8.928 6.060 -5.752 1.00 0.00 H new ATOM 0 HD22 ASN A 158 -8.114 5.545 -4.270 1.00 0.00 H new ATOM 1163 N LEU A 159 -7.052 10.312 -1.447 1.00 0.00 N ATOM 1164 CA LEU A 159 -7.122 11.343 -0.430 1.00 0.00 C ATOM 1165 C LEU A 159 -8.527 11.927 -0.387 1.00 0.00 C ATOM 1166 O LEU A 159 -8.925 12.678 -1.283 1.00 0.00 O ATOM 1167 CB LEU A 159 -6.105 12.451 -0.718 1.00 0.00 C ATOM 1168 CG LEU A 159 -4.646 11.994 -0.824 1.00 0.00 C ATOM 1169 CD1 LEU A 159 -3.748 13.168 -1.185 1.00 0.00 C ATOM 1170 CD2 LEU A 159 -4.189 11.352 0.478 1.00 0.00 C ATOM 0 H LEU A 159 -6.526 10.578 -2.279 1.00 0.00 H new ATOM 0 HA LEU A 159 -6.886 10.898 0.537 1.00 0.00 H new ATOM 0 HB2 LEU A 159 -6.383 12.942 -1.651 1.00 0.00 H new ATOM 0 HB3 LEU A 159 -6.177 13.200 0.070 1.00 0.00 H new ATOM 0 HG LEU A 159 -4.575 11.248 -1.615 1.00 0.00 H new ATOM 0 HD11 LEU A 159 -2.715 12.827 -1.257 1.00 0.00 H new ATOM 0 HD12 LEU A 159 -4.060 13.584 -2.143 1.00 0.00 H new ATOM 0 HD13 LEU A 159 -3.825 13.935 -0.414 1.00 0.00 H new ATOM 0 HD21 LEU A 159 -3.151 11.034 0.382 1.00 0.00 H new ATOM 0 HD22 LEU A 159 -4.274 12.075 1.290 1.00 0.00 H new ATOM 0 HD23 LEU A 159 -4.815 10.486 0.696 1.00 0.00 H new ATOM 1182 N ARG A 160 -9.281 11.576 0.641 1.00 0.00 N ATOM 1183 CA ARG A 160 -10.643 12.066 0.761 1.00 0.00 C ATOM 1184 C ARG A 160 -10.625 13.513 1.220 1.00 0.00 C ATOM 1185 O ARG A 160 -10.309 13.807 2.372 1.00 0.00 O ATOM 1186 CB ARG A 160 -11.470 11.218 1.725 1.00 0.00 C ATOM 1187 CG ARG A 160 -12.929 11.633 1.744 1.00 0.00 C ATOM 1188 CD ARG A 160 -13.749 10.812 2.721 1.00 0.00 C ATOM 1189 NE ARG A 160 -13.311 10.991 4.108 1.00 0.00 N ATOM 1190 CZ ARG A 160 -13.576 12.075 4.848 1.00 0.00 C ATOM 1191 NH1 ARG A 160 -14.194 13.122 4.313 1.00 0.00 N ATOM 1192 NH2 ARG A 160 -13.204 12.119 6.118 1.00 0.00 N ATOM 0 H ARG A 160 -8.978 10.961 1.396 1.00 0.00 H new ATOM 0 HA ARG A 160 -11.113 11.996 -0.220 1.00 0.00 H new ATOM 0 HB2 ARG A 160 -11.396 10.169 1.439 1.00 0.00 H new ATOM 0 HB3 ARG A 160 -11.056 11.305 2.730 1.00 0.00 H new ATOM 0 HG2 ARG A 160 -13.001 12.688 2.010 1.00 0.00 H new ATOM 0 HG3 ARG A 160 -13.348 11.527 0.743 1.00 0.00 H new ATOM 0 HD2 ARG A 160 -14.799 11.093 2.635 1.00 0.00 H new ATOM 0 HD3 ARG A 160 -13.678 9.758 2.454 1.00 0.00 H new ATOM 0 HE ARG A 160 -12.769 10.241 4.538 1.00 0.00 H new ATOM 0 HH11 ARG A 160 -14.471 13.104 3.331 1.00 0.00 H new ATOM 0 HH12 ARG A 160 -14.392 13.944 4.884 1.00 0.00 H new ATOM 0 HH21 ARG A 160 -12.715 11.326 6.534 1.00 0.00 H new ATOM 0 HH22 ARG A 160 -13.407 12.945 6.680 1.00 0.00 H new TER 1206 ARG A 160