USER MOD reduce.3.24.130724 H: found=0, std=0, add=1210, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1204 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 152 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 154 SER OG : rot 180:sc= -1.27 USER MOD Set 2.1: A 20 LYS NZ :NH3+ 148:sc= 0.305 (180deg=-2.21!) USER MOD Set 2.2: A 96 HIS : no HE2:sc= 1.43 K(o=1.3,f=-15!) USER MOD Set 2.3: A 123 ASN : amide:sc= -0.434 K(o=1.3,f=-5.5!) USER MOD Set 3.1: A 37 THR OG1 : rot -63:sc= 0.582 USER MOD Set 3.2: A 54 THR OG1 : rot 180:sc= -0.896 USER MOD Set 4.1: A 22 MET CE :methyl 176:sc= -0.796 (180deg=-0.796) USER MOD Set 4.2: A 55 MET CE :methyl 169:sc= -0.632 (180deg=-1.27) USER MOD Single : A 1 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 1 HIS N :NH3+ 163:sc= 0.00536 (180deg=0) USER MOD Single : A 2 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 6 SER OG : rot -117:sc= 0.11! USER MOD Single : A 11 GLN : amide:sc= -0.0895 X(o=-0.09,f=0) USER MOD Single : A 14 SER OG : rot -93:sc= -0.262! USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 TYR OH : rot 180:sc= 0 USER MOD Single : A 23 THR OG1 : rot 180:sc= -0.339 USER MOD Single : A 31 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 32 ASN :FLIP amide:sc= 0 F(o=-0.55,f=0) USER MOD Single : A 35 SER OG : rot -165:sc= -3.28! USER MOD Single : A 39 MET CE :methyl -118:sc= -0.391 (180deg=-1.62!) USER MOD Single : A 40 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot 157:sc= -2.6! USER MOD Single : A 43 THR OG1 : rot 150:sc= -0.102 USER MOD Single : A 48 ASN :FLIP amide:sc= -0.649 F(o=-1.5!,f=-0.65) USER MOD Single : A 52 LYS NZ :NH3+ -172:sc= -4.24! (180deg=-4.59!) USER MOD Single : A 58 SER OG : rot 132:sc= 0.859 USER MOD Single : A 62 GLN :FLIP amide:sc= -4.91! C(o=-8.5!,f=-4.9!) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 LYS NZ :NH3+ 161:sc= -0.0181 (180deg=-0.548) USER MOD Single : A 71 THR OG1 : rot -73:sc= 0.377 USER MOD Single : A 76 LYS NZ :NH3+ -162:sc= 0.0504 (180deg=0.00701) USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ -168:sc= -0.61 (180deg=-0.964) USER MOD Single : A 84 HIS : no HD1:sc= -1.59 K(o=-1.6,f=-2.9!) USER MOD Single : A 87 TYR OH : rot 165:sc= -0.513 USER MOD Single : A 91 SER OG : rot -67:sc= 0.93 USER MOD Single : A 92 HIS : no HD1:sc= -5.86! C(o=-5.9!,f=-8.1!) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 100 TYR OH : rot 164:sc= -1.47! USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 106 HIS : no HE2:sc= -4.31! C(o=-4.3!,f=-6.4!) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 132 LYS NZ :NH3+ 164:sc= 0 (180deg=-0.235) USER MOD Single : A 140 SER OG : rot 180:sc= 0.0271 USER MOD Single : A 141 THR OG1 : rot -42:sc= 0.529 USER MOD Single : A 143 SER OG : rot 170:sc= -0.511 USER MOD Single : A 149 GLN : amide:sc= -5.14! C(o=-5.1!,f=-8.3!) USER MOD Single : A 150 SER OG : rot -107:sc= 1.21 USER MOD Single : A 157 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N HIS A 1 -10.426 -23.152 -7.127 1.00 0.00 N ATOM 2 CA HIS A 1 -10.455 -22.104 -8.186 1.00 0.00 C ATOM 3 C HIS A 1 -10.893 -20.778 -7.574 1.00 0.00 C ATOM 4 O HIS A 1 -11.682 -20.751 -6.629 1.00 0.00 O ATOM 5 CB HIS A 1 -11.433 -22.519 -9.287 1.00 0.00 C ATOM 6 CG HIS A 1 -10.737 -22.473 -10.619 1.00 0.00 C ATOM 7 ND1 HIS A 1 -10.432 -21.279 -11.252 1.00 0.00 N ATOM 8 CD2 HIS A 1 -10.283 -23.467 -11.451 1.00 0.00 C ATOM 9 CE1 HIS A 1 -9.819 -21.580 -12.412 1.00 0.00 C ATOM 10 NE2 HIS A 1 -9.702 -22.900 -12.583 1.00 0.00 N ATOM 0 H1 HIS A 1 -10.414 -24.093 -7.570 1.00 0.00 H new ATOM 0 H2 HIS A 1 -9.573 -23.033 -6.544 1.00 0.00 H new ATOM 0 H3 HIS A 1 -11.271 -23.063 -6.527 1.00 0.00 H new ATOM 0 HA HIS A 1 -9.460 -21.989 -8.616 1.00 0.00 H new ATOM 0 HB2 HIS A 1 -11.808 -23.524 -9.095 1.00 0.00 H new ATOM 0 HB3 HIS A 1 -12.296 -21.853 -9.292 1.00 0.00 H new ATOM 0 HD2 HIS A 1 -10.364 -24.526 -11.257 1.00 0.00 H new ATOM 0 HE1 HIS A 1 -9.465 -20.844 -13.119 1.00 0.00 H new ATOM 0 HE2 HIS A 1 -9.278 -23.388 -13.372 1.00 0.00 H new ATOM 20 N HIS A 2 -10.375 -19.680 -8.116 1.00 0.00 N ATOM 21 CA HIS A 2 -10.722 -18.357 -7.614 1.00 0.00 C ATOM 22 C HIS A 2 -10.507 -18.283 -6.105 1.00 0.00 C ATOM 23 O HIS A 2 -11.457 -18.387 -5.330 1.00 0.00 O ATOM 24 CB HIS A 2 -12.182 -18.039 -7.939 1.00 0.00 C ATOM 25 CG HIS A 2 -12.297 -17.625 -9.380 1.00 0.00 C ATOM 26 ND1 HIS A 2 -12.643 -18.519 -10.381 1.00 0.00 N ATOM 27 CD2 HIS A 2 -12.114 -16.417 -10.004 1.00 0.00 C ATOM 28 CE1 HIS A 2 -12.658 -17.841 -11.542 1.00 0.00 C ATOM 29 NE2 HIS A 2 -12.342 -16.554 -11.370 1.00 0.00 N ATOM 0 H HIS A 2 -9.719 -19.680 -8.897 1.00 0.00 H new ATOM 0 HA HIS A 2 -10.076 -17.625 -8.099 1.00 0.00 H new ATOM 0 HB2 HIS A 2 -12.806 -18.912 -7.750 1.00 0.00 H new ATOM 0 HB3 HIS A 2 -12.545 -17.241 -7.290 1.00 0.00 H new ATOM 0 HD2 HIS A 2 -11.835 -15.498 -9.510 1.00 0.00 H new ATOM 0 HE1 HIS A 2 -12.897 -18.283 -12.498 1.00 0.00 H new ATOM 0 HE2 HIS A 2 -12.281 -15.829 -12.085 1.00 0.00 H new ATOM 37 N LEU A 3 -9.252 -18.103 -5.700 1.00 0.00 N ATOM 38 CA LEU A 3 -8.915 -18.017 -4.283 1.00 0.00 C ATOM 39 C LEU A 3 -8.329 -16.646 -3.954 1.00 0.00 C ATOM 40 O LEU A 3 -7.112 -16.465 -3.957 1.00 0.00 O ATOM 41 CB LEU A 3 -7.901 -19.104 -3.921 1.00 0.00 C ATOM 42 CG LEU A 3 -6.803 -19.152 -4.985 1.00 0.00 C ATOM 43 CD1 LEU A 3 -5.450 -19.383 -4.312 1.00 0.00 C ATOM 44 CD2 LEU A 3 -7.088 -20.298 -5.959 1.00 0.00 C ATOM 0 H LEU A 3 -8.455 -18.014 -6.331 1.00 0.00 H new ATOM 0 HA LEU A 3 -9.827 -18.161 -3.703 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -7.466 -18.899 -2.943 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -8.398 -20.072 -3.852 1.00 0.00 H new ATOM 0 HG LEU A 3 -6.782 -18.207 -5.528 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -4.668 -19.417 -5.070 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -5.246 -18.569 -3.616 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -5.470 -20.328 -3.769 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -6.306 -20.333 -6.718 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -7.108 -21.242 -5.414 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -8.053 -20.136 -6.439 1.00 0.00 H new ATOM 56 N LEU A 4 -9.202 -15.684 -3.672 1.00 0.00 N ATOM 57 CA LEU A 4 -8.770 -14.327 -3.345 1.00 0.00 C ATOM 58 C LEU A 4 -8.134 -14.279 -1.953 1.00 0.00 C ATOM 59 O LEU A 4 -7.996 -13.202 -1.379 1.00 0.00 O ATOM 60 CB LEU A 4 -9.988 -13.394 -3.391 1.00 0.00 C ATOM 61 CG LEU A 4 -9.664 -12.118 -4.173 1.00 0.00 C ATOM 62 CD1 LEU A 4 -10.940 -11.294 -4.344 1.00 0.00 C ATOM 63 CD2 LEU A 4 -8.633 -11.289 -3.402 1.00 0.00 C ATOM 0 H LEU A 4 -10.213 -15.818 -3.663 1.00 0.00 H new ATOM 0 HA LEU A 4 -8.023 -14.006 -4.071 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -10.829 -13.908 -3.857 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -10.294 -13.137 -2.377 1.00 0.00 H new ATOM 0 HG LEU A 4 -9.260 -12.385 -5.150 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -10.714 -10.384 -4.900 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -11.680 -11.879 -4.890 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -11.337 -11.030 -3.364 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -8.404 -10.382 -3.961 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -9.038 -11.022 -2.426 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -7.722 -11.873 -3.270 1.00 0.00 H new ATOM 75 N ALA A 5 -7.762 -15.464 -1.444 1.00 0.00 N ATOM 76 CA ALA A 5 -7.132 -15.638 -0.120 1.00 0.00 C ATOM 77 C ALA A 5 -7.911 -16.660 0.692 1.00 0.00 C ATOM 78 O ALA A 5 -9.104 -16.486 0.950 1.00 0.00 O ATOM 79 CB ALA A 5 -7.051 -14.341 0.693 1.00 0.00 C ATOM 0 H ALA A 5 -7.891 -16.343 -1.946 1.00 0.00 H new ATOM 0 HA ALA A 5 -6.113 -15.973 -0.313 1.00 0.00 H new ATOM 0 HB1 ALA A 5 -6.577 -14.543 1.654 1.00 0.00 H new ATOM 0 HB2 ALA A 5 -6.462 -13.605 0.146 1.00 0.00 H new ATOM 0 HB3 ALA A 5 -8.056 -13.952 0.858 1.00 0.00 H new ATOM 85 N SER A 6 -7.235 -17.724 1.093 1.00 0.00 N ATOM 86 CA SER A 6 -7.871 -18.773 1.875 1.00 0.00 C ATOM 87 C SER A 6 -8.257 -18.255 3.260 1.00 0.00 C ATOM 88 O SER A 6 -7.429 -17.700 3.981 1.00 0.00 O ATOM 89 CB SER A 6 -6.913 -19.951 2.016 1.00 0.00 C ATOM 90 OG SER A 6 -6.945 -20.429 3.352 1.00 0.00 O ATOM 0 H SER A 6 -6.248 -17.885 0.891 1.00 0.00 H new ATOM 0 HA SER A 6 -8.777 -19.094 1.361 1.00 0.00 H new ATOM 0 HB2 SER A 6 -7.195 -20.747 1.327 1.00 0.00 H new ATOM 0 HB3 SER A 6 -5.901 -19.644 1.752 1.00 0.00 H new ATOM 0 HG SER A 6 -6.061 -20.319 3.760 1.00 0.00 H new ATOM 96 N ASP A 7 -9.521 -18.440 3.623 1.00 0.00 N ATOM 97 CA ASP A 7 -10.007 -17.987 4.922 1.00 0.00 C ATOM 98 C ASP A 7 -9.131 -18.539 6.043 1.00 0.00 C ATOM 99 O ASP A 7 -8.527 -17.782 6.803 1.00 0.00 O ATOM 100 CB ASP A 7 -11.452 -18.442 5.128 1.00 0.00 C ATOM 101 CG ASP A 7 -11.706 -19.738 4.364 1.00 0.00 C ATOM 102 OD1 ASP A 7 -11.883 -19.667 3.160 1.00 0.00 O ATOM 103 OD2 ASP A 7 -11.718 -20.782 4.996 1.00 0.00 O ATOM 0 H ASP A 7 -10.224 -18.897 3.042 1.00 0.00 H new ATOM 0 HA ASP A 7 -9.964 -16.898 4.946 1.00 0.00 H new ATOM 0 HB2 ASP A 7 -11.647 -18.592 6.190 1.00 0.00 H new ATOM 0 HB3 ASP A 7 -12.138 -17.668 4.785 1.00 0.00 H new ATOM 108 N GLU A 8 -9.068 -19.864 6.140 1.00 0.00 N ATOM 109 CA GLU A 8 -8.265 -20.509 7.173 1.00 0.00 C ATOM 110 C GLU A 8 -6.889 -19.857 7.276 1.00 0.00 C ATOM 111 O GLU A 8 -6.504 -19.364 8.336 1.00 0.00 O ATOM 112 CB GLU A 8 -8.103 -21.997 6.854 1.00 0.00 C ATOM 113 CG GLU A 8 -9.168 -22.799 7.606 1.00 0.00 C ATOM 114 CD GLU A 8 -10.547 -22.199 7.355 1.00 0.00 C ATOM 115 OE1 GLU A 8 -10.941 -21.331 8.116 1.00 0.00 O ATOM 116 OE2 GLU A 8 -11.190 -22.616 6.405 1.00 0.00 O ATOM 0 H GLU A 8 -9.560 -20.508 5.520 1.00 0.00 H new ATOM 0 HA GLU A 8 -8.779 -20.393 8.127 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -8.198 -22.162 5.781 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -7.107 -22.335 7.141 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -9.150 -23.839 7.279 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -8.950 -22.796 8.674 1.00 0.00 H new ATOM 123 N GLU A 9 -6.152 -19.860 6.169 1.00 0.00 N ATOM 124 CA GLU A 9 -4.819 -19.267 6.146 1.00 0.00 C ATOM 125 C GLU A 9 -4.483 -18.767 4.744 1.00 0.00 C ATOM 126 O GLU A 9 -5.334 -18.769 3.859 1.00 0.00 O ATOM 127 CB GLU A 9 -3.775 -20.300 6.580 1.00 0.00 C ATOM 128 CG GLU A 9 -3.902 -20.573 8.081 1.00 0.00 C ATOM 129 CD GLU A 9 -2.732 -21.429 8.554 1.00 0.00 C ATOM 130 OE1 GLU A 9 -1.851 -21.688 7.752 1.00 0.00 O ATOM 131 OE2 GLU A 9 -2.736 -21.816 9.711 1.00 0.00 O ATOM 0 H GLU A 9 -6.453 -20.264 5.282 1.00 0.00 H new ATOM 0 HA GLU A 9 -4.806 -18.425 6.838 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -3.912 -21.225 6.021 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -2.774 -19.935 6.352 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -3.921 -19.632 8.630 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -4.843 -21.082 8.289 1.00 0.00 H new ATOM 138 N ILE A 10 -3.236 -18.348 4.551 1.00 0.00 N ATOM 139 CA ILE A 10 -2.792 -17.857 3.251 1.00 0.00 C ATOM 140 C ILE A 10 -1.512 -18.569 2.829 1.00 0.00 C ATOM 141 O ILE A 10 -0.527 -17.928 2.463 1.00 0.00 O ATOM 142 CB ILE A 10 -2.539 -16.350 3.314 1.00 0.00 C ATOM 143 CG1 ILE A 10 -3.616 -15.680 4.171 1.00 0.00 C ATOM 144 CG2 ILE A 10 -2.586 -15.771 1.901 1.00 0.00 C ATOM 145 CD1 ILE A 10 -3.466 -14.158 4.080 1.00 0.00 C ATOM 0 H ILE A 10 -2.518 -18.339 5.275 1.00 0.00 H new ATOM 0 HA ILE A 10 -3.574 -18.060 2.519 1.00 0.00 H new ATOM 0 HB ILE A 10 -1.560 -16.166 3.756 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -4.607 -15.980 3.829 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -3.525 -16.004 5.208 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -2.406 -14.697 1.942 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -1.819 -16.244 1.288 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -3.567 -15.958 1.463 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -4.232 -13.680 4.690 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -2.480 -13.867 4.443 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -3.579 -13.843 3.043 1.00 0.00 H new ATOM 157 N GLN A 11 -1.532 -19.898 2.889 1.00 0.00 N ATOM 158 CA GLN A 11 -0.364 -20.688 2.517 1.00 0.00 C ATOM 159 C GLN A 11 0.813 -20.355 3.427 1.00 0.00 C ATOM 160 O GLN A 11 1.168 -21.138 4.309 1.00 0.00 O ATOM 161 CB GLN A 11 0.017 -20.412 1.061 1.00 0.00 C ATOM 162 CG GLN A 11 -1.244 -20.410 0.192 1.00 0.00 C ATOM 163 CD GLN A 11 -0.997 -21.199 -1.089 1.00 0.00 C ATOM 164 OE1 GLN A 11 -1.831 -22.010 -1.489 1.00 0.00 O ATOM 165 NE2 GLN A 11 0.107 -21.008 -1.759 1.00 0.00 N ATOM 0 H GLN A 11 -2.338 -20.446 3.189 1.00 0.00 H new ATOM 0 HA GLN A 11 -0.611 -21.744 2.629 1.00 0.00 H new ATOM 0 HB2 GLN A 11 0.526 -19.451 0.983 1.00 0.00 H new ATOM 0 HB3 GLN A 11 0.714 -21.171 0.707 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -2.076 -20.848 0.743 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -1.526 -19.386 -0.051 1.00 0.00 H new ATOM 0 HE21 GLN A 11 0.796 -20.335 -1.425 1.00 0.00 H new ATOM 0 HE22 GLN A 11 0.280 -21.532 -2.617 1.00 0.00 H new ATOM 174 N ASP A 12 1.404 -19.184 3.212 1.00 0.00 N ATOM 175 CA ASP A 12 2.535 -18.740 4.020 1.00 0.00 C ATOM 176 C ASP A 12 2.144 -17.515 4.837 1.00 0.00 C ATOM 177 O ASP A 12 1.455 -17.627 5.851 1.00 0.00 O ATOM 178 CB ASP A 12 3.720 -18.395 3.116 1.00 0.00 C ATOM 179 CG ASP A 12 3.232 -17.646 1.882 1.00 0.00 C ATOM 180 OD1 ASP A 12 2.683 -18.288 1.001 1.00 0.00 O ATOM 181 OD2 ASP A 12 3.413 -16.440 1.834 1.00 0.00 O ATOM 0 H ASP A 12 1.119 -18.526 2.486 1.00 0.00 H new ATOM 0 HA ASP A 12 2.821 -19.546 4.696 1.00 0.00 H new ATOM 0 HB2 ASP A 12 4.439 -17.784 3.662 1.00 0.00 H new ATOM 0 HB3 ASP A 12 4.238 -19.306 2.817 1.00 0.00 H new ATOM 186 N VAL A 13 2.582 -16.343 4.383 1.00 0.00 N ATOM 187 CA VAL A 13 2.267 -15.097 5.070 1.00 0.00 C ATOM 188 C VAL A 13 2.522 -15.214 6.570 1.00 0.00 C ATOM 189 O VAL A 13 1.724 -15.791 7.308 1.00 0.00 O ATOM 190 CB VAL A 13 0.805 -14.725 4.823 1.00 0.00 C ATOM 191 CG1 VAL A 13 0.479 -13.425 5.559 1.00 0.00 C ATOM 192 CG2 VAL A 13 0.577 -14.531 3.321 1.00 0.00 C ATOM 0 H VAL A 13 3.154 -16.232 3.546 1.00 0.00 H new ATOM 0 HA VAL A 13 2.917 -14.317 4.673 1.00 0.00 H new ATOM 0 HB VAL A 13 0.159 -15.522 5.190 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -0.563 -13.159 5.383 1.00 0.00 H new ATOM 0 HG12 VAL A 13 0.644 -13.561 6.628 1.00 0.00 H new ATOM 0 HG13 VAL A 13 1.124 -12.627 5.191 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -0.465 -14.266 3.142 1.00 0.00 H new ATOM 0 HG22 VAL A 13 1.223 -13.733 2.955 1.00 0.00 H new ATOM 0 HG23 VAL A 13 0.811 -15.457 2.795 1.00 0.00 H new ATOM 202 N SER A 14 3.646 -14.660 7.004 1.00 0.00 N ATOM 203 CA SER A 14 4.025 -14.691 8.411 1.00 0.00 C ATOM 204 C SER A 14 5.508 -14.370 8.555 1.00 0.00 C ATOM 205 O SER A 14 6.351 -15.268 8.562 1.00 0.00 O ATOM 206 CB SER A 14 3.738 -16.068 9.009 1.00 0.00 C ATOM 207 OG SER A 14 3.751 -17.044 7.975 1.00 0.00 O ATOM 0 H SER A 14 4.314 -14.182 6.399 1.00 0.00 H new ATOM 0 HA SER A 14 3.439 -13.944 8.946 1.00 0.00 H new ATOM 0 HB2 SER A 14 4.486 -16.312 9.764 1.00 0.00 H new ATOM 0 HB3 SER A 14 2.769 -16.065 9.509 1.00 0.00 H new ATOM 0 HG SER A 14 2.842 -17.169 7.632 1.00 0.00 H new ATOM 213 N GLY A 15 5.822 -13.082 8.663 1.00 0.00 N ATOM 214 CA GLY A 15 7.208 -12.656 8.802 1.00 0.00 C ATOM 215 C GLY A 15 7.431 -11.293 8.153 1.00 0.00 C ATOM 216 O GLY A 15 6.492 -10.513 7.982 1.00 0.00 O ATOM 0 H GLY A 15 5.141 -12.322 8.657 1.00 0.00 H new ATOM 0 HA2 GLY A 15 7.473 -12.607 9.858 1.00 0.00 H new ATOM 0 HA3 GLY A 15 7.866 -13.393 8.342 1.00 0.00 H new ATOM 220 N THR A 16 8.681 -11.010 7.803 1.00 0.00 N ATOM 221 CA THR A 16 9.025 -9.736 7.185 1.00 0.00 C ATOM 222 C THR A 16 8.978 -9.825 5.664 1.00 0.00 C ATOM 223 O THR A 16 9.169 -10.893 5.083 1.00 0.00 O ATOM 224 CB THR A 16 10.423 -9.297 7.625 1.00 0.00 C ATOM 225 OG1 THR A 16 10.447 -9.143 9.038 1.00 0.00 O ATOM 226 CG2 THR A 16 10.774 -7.965 6.957 1.00 0.00 C ATOM 0 H THR A 16 9.470 -11.643 7.936 1.00 0.00 H new ATOM 0 HA THR A 16 8.289 -9.001 7.511 1.00 0.00 H new ATOM 0 HB THR A 16 11.152 -10.052 7.330 1.00 0.00 H new ATOM 0 HG1 THR A 16 11.343 -8.863 9.321 1.00 0.00 H new ATOM 0 HG21 THR A 16 11.770 -7.652 7.270 1.00 0.00 H new ATOM 0 HG22 THR A 16 10.755 -8.085 5.874 1.00 0.00 H new ATOM 0 HG23 THR A 16 10.047 -7.208 7.251 1.00 0.00 H new ATOM 234 N TRP A 17 8.728 -8.684 5.031 1.00 0.00 N ATOM 235 CA TRP A 17 8.659 -8.611 3.578 1.00 0.00 C ATOM 236 C TRP A 17 9.270 -7.299 3.098 1.00 0.00 C ATOM 237 O TRP A 17 9.737 -6.493 3.904 1.00 0.00 O ATOM 238 CB TRP A 17 7.202 -8.678 3.114 1.00 0.00 C ATOM 239 CG TRP A 17 6.652 -10.054 3.324 1.00 0.00 C ATOM 240 CD1 TRP A 17 6.315 -10.587 4.522 1.00 0.00 C ATOM 241 CD2 TRP A 17 6.352 -11.071 2.325 1.00 0.00 C ATOM 242 NE1 TRP A 17 5.837 -11.871 4.320 1.00 0.00 N ATOM 243 CE2 TRP A 17 5.840 -12.213 2.981 1.00 0.00 C ATOM 244 CE3 TRP A 17 6.479 -11.110 0.926 1.00 0.00 C ATOM 245 CZ2 TRP A 17 5.463 -13.355 2.274 1.00 0.00 C ATOM 246 CZ3 TRP A 17 6.101 -12.256 0.209 1.00 0.00 C ATOM 247 CH2 TRP A 17 5.593 -13.378 0.882 1.00 0.00 C ATOM 0 H TRP A 17 8.569 -7.795 5.504 1.00 0.00 H new ATOM 0 HA TRP A 17 9.212 -9.453 3.161 1.00 0.00 H new ATOM 0 HB2 TRP A 17 6.604 -7.952 3.665 1.00 0.00 H new ATOM 0 HB3 TRP A 17 7.136 -8.410 2.060 1.00 0.00 H new ATOM 0 HD1 TRP A 17 6.404 -10.092 5.478 1.00 0.00 H new ATOM 0 HE1 TRP A 17 5.521 -12.489 5.068 1.00 0.00 H new ATOM 0 HE3 TRP A 17 6.870 -10.252 0.399 1.00 0.00 H new ATOM 0 HZ2 TRP A 17 5.073 -14.215 2.798 1.00 0.00 H new ATOM 0 HZ3 TRP A 17 6.202 -12.274 -0.866 1.00 0.00 H new ATOM 0 HH2 TRP A 17 5.303 -14.257 0.326 1.00 0.00 H new ATOM 258 N TYR A 18 9.244 -7.078 1.786 1.00 0.00 N ATOM 259 CA TYR A 18 9.773 -5.849 1.220 1.00 0.00 C ATOM 260 C TYR A 18 8.772 -5.305 0.217 1.00 0.00 C ATOM 261 O TYR A 18 7.942 -6.053 -0.285 1.00 0.00 O ATOM 262 CB TYR A 18 11.116 -6.111 0.536 1.00 0.00 C ATOM 263 CG TYR A 18 12.118 -6.589 1.559 1.00 0.00 C ATOM 264 CD1 TYR A 18 11.995 -7.867 2.116 1.00 0.00 C ATOM 265 CD2 TYR A 18 13.171 -5.754 1.952 1.00 0.00 C ATOM 266 CE1 TYR A 18 12.924 -8.311 3.064 1.00 0.00 C ATOM 267 CE2 TYR A 18 14.101 -6.198 2.900 1.00 0.00 C ATOM 268 CZ TYR A 18 13.977 -7.475 3.456 1.00 0.00 C ATOM 269 OH TYR A 18 14.893 -7.912 4.392 1.00 0.00 O ATOM 0 H TYR A 18 8.864 -7.732 1.102 1.00 0.00 H new ATOM 0 HA TYR A 18 9.934 -5.120 2.014 1.00 0.00 H new ATOM 0 HB2 TYR A 18 10.997 -6.858 -0.249 1.00 0.00 H new ATOM 0 HB3 TYR A 18 11.476 -5.200 0.057 1.00 0.00 H new ATOM 0 HD1 TYR A 18 11.182 -8.511 1.814 1.00 0.00 H new ATOM 0 HD2 TYR A 18 13.266 -4.767 1.524 1.00 0.00 H new ATOM 0 HE1 TYR A 18 12.829 -9.298 3.493 1.00 0.00 H new ATOM 0 HE2 TYR A 18 14.914 -5.554 3.202 1.00 0.00 H new ATOM 0 HH TYR A 18 15.559 -7.211 4.550 1.00 0.00 H new ATOM 279 N LEU A 19 8.862 -4.015 -0.084 1.00 0.00 N ATOM 280 CA LEU A 19 7.963 -3.392 -1.042 1.00 0.00 C ATOM 281 C LEU A 19 8.743 -3.098 -2.317 1.00 0.00 C ATOM 282 O LEU A 19 9.788 -2.452 -2.280 1.00 0.00 O ATOM 283 CB LEU A 19 7.400 -2.101 -0.446 1.00 0.00 C ATOM 284 CG LEU A 19 5.931 -1.927 -0.841 1.00 0.00 C ATOM 285 CD1 LEU A 19 5.038 -2.704 0.128 1.00 0.00 C ATOM 286 CD2 LEU A 19 5.565 -0.445 -0.778 1.00 0.00 C ATOM 0 H LEU A 19 9.550 -3.381 0.323 1.00 0.00 H new ATOM 0 HA LEU A 19 7.131 -4.057 -1.273 1.00 0.00 H new ATOM 0 HB2 LEU A 19 7.491 -2.124 0.640 1.00 0.00 H new ATOM 0 HB3 LEU A 19 7.981 -1.248 -0.796 1.00 0.00 H new ATOM 0 HG LEU A 19 5.783 -2.305 -1.853 1.00 0.00 H new ATOM 0 HD11 LEU A 19 3.994 -2.577 -0.158 1.00 0.00 H new ATOM 0 HD12 LEU A 19 5.297 -3.762 0.093 1.00 0.00 H new ATOM 0 HD13 LEU A 19 5.186 -2.328 1.140 1.00 0.00 H new ATOM 0 HD21 LEU A 19 4.520 -0.316 -1.059 1.00 0.00 H new ATOM 0 HD22 LEU A 19 5.717 -0.076 0.236 1.00 0.00 H new ATOM 0 HD23 LEU A 19 6.197 0.115 -1.467 1.00 0.00 H new ATOM 298 N LYS A 20 8.245 -3.607 -3.434 1.00 0.00 N ATOM 299 CA LYS A 20 8.922 -3.428 -4.713 1.00 0.00 C ATOM 300 C LYS A 20 8.210 -2.393 -5.572 1.00 0.00 C ATOM 301 O LYS A 20 8.703 -2.011 -6.632 1.00 0.00 O ATOM 302 CB LYS A 20 8.973 -4.757 -5.463 1.00 0.00 C ATOM 303 CG LYS A 20 9.192 -5.915 -4.474 1.00 0.00 C ATOM 304 CD LYS A 20 9.131 -7.248 -5.229 1.00 0.00 C ATOM 305 CE LYS A 20 10.480 -7.553 -5.885 1.00 0.00 C ATOM 306 NZ LYS A 20 10.252 -8.083 -7.260 1.00 0.00 N ATOM 0 H LYS A 20 7.380 -4.145 -3.483 1.00 0.00 H new ATOM 0 HA LYS A 20 9.934 -3.076 -4.512 1.00 0.00 H new ATOM 0 HB2 LYS A 20 8.044 -4.909 -6.013 1.00 0.00 H new ATOM 0 HB3 LYS A 20 9.778 -4.738 -6.197 1.00 0.00 H new ATOM 0 HG2 LYS A 20 10.158 -5.808 -3.980 1.00 0.00 H new ATOM 0 HG3 LYS A 20 8.431 -5.891 -3.694 1.00 0.00 H new ATOM 0 HD2 LYS A 20 8.864 -8.051 -4.541 1.00 0.00 H new ATOM 0 HD3 LYS A 20 8.351 -7.207 -5.989 1.00 0.00 H new ATOM 0 HE2 LYS A 20 11.089 -6.650 -5.928 1.00 0.00 H new ATOM 0 HE3 LYS A 20 11.031 -8.281 -5.289 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 11.037 -7.795 -7.878 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 10.200 -9.121 -7.228 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 9.359 -7.703 -7.635 1.00 0.00 H new ATOM 320 N ALA A 21 7.043 -1.962 -5.127 1.00 0.00 N ATOM 321 CA ALA A 21 6.280 -0.981 -5.883 1.00 0.00 C ATOM 322 C ALA A 21 5.124 -0.447 -5.064 1.00 0.00 C ATOM 323 O ALA A 21 4.459 -1.193 -4.346 1.00 0.00 O ATOM 324 CB ALA A 21 5.754 -1.608 -7.173 1.00 0.00 C ATOM 0 H ALA A 21 6.606 -2.270 -4.258 1.00 0.00 H new ATOM 0 HA ALA A 21 6.942 -0.150 -6.128 1.00 0.00 H new ATOM 0 HB1 ALA A 21 5.184 -0.866 -7.732 1.00 0.00 H new ATOM 0 HB2 ALA A 21 6.592 -1.953 -7.778 1.00 0.00 H new ATOM 0 HB3 ALA A 21 5.110 -2.453 -6.930 1.00 0.00 H new ATOM 330 N MET A 22 4.892 0.854 -5.176 1.00 0.00 N ATOM 331 CA MET A 22 3.811 1.491 -4.442 1.00 0.00 C ATOM 332 C MET A 22 3.053 2.462 -5.332 1.00 0.00 C ATOM 333 O MET A 22 3.554 3.540 -5.666 1.00 0.00 O ATOM 334 CB MET A 22 4.361 2.229 -3.218 1.00 0.00 C ATOM 335 CG MET A 22 3.328 3.243 -2.713 1.00 0.00 C ATOM 336 SD MET A 22 3.539 3.483 -0.931 1.00 0.00 S ATOM 337 CE MET A 22 2.778 5.122 -0.824 1.00 0.00 C ATOM 0 H MET A 22 5.436 1.485 -5.765 1.00 0.00 H new ATOM 0 HA MET A 22 3.123 0.713 -4.110 1.00 0.00 H new ATOM 0 HB2 MET A 22 4.599 1.516 -2.429 1.00 0.00 H new ATOM 0 HB3 MET A 22 5.289 2.740 -3.477 1.00 0.00 H new ATOM 0 HG2 MET A 22 3.449 4.192 -3.235 1.00 0.00 H new ATOM 0 HG3 MET A 22 2.320 2.888 -2.926 1.00 0.00 H new ATOM 0 HE1 MET A 22 2.738 5.437 0.219 1.00 0.00 H new ATOM 0 HE2 MET A 22 3.370 5.836 -1.396 1.00 0.00 H new ATOM 0 HE3 MET A 22 1.767 5.081 -1.230 1.00 0.00 H new ATOM 347 N THR A 23 1.841 2.056 -5.700 1.00 0.00 N ATOM 348 CA THR A 23 0.970 2.866 -6.544 1.00 0.00 C ATOM 349 C THR A 23 0.312 3.954 -5.715 1.00 0.00 C ATOM 350 O THR A 23 -0.262 3.679 -4.661 1.00 0.00 O ATOM 351 CB THR A 23 -0.087 1.972 -7.197 1.00 0.00 C ATOM 352 OG1 THR A 23 0.420 1.460 -8.423 1.00 0.00 O ATOM 353 CG2 THR A 23 -1.355 2.768 -7.465 1.00 0.00 C ATOM 0 H THR A 23 1.437 1.161 -5.423 1.00 0.00 H new ATOM 0 HA THR A 23 1.561 3.340 -7.327 1.00 0.00 H new ATOM 0 HB THR A 23 -0.322 1.148 -6.523 1.00 0.00 H new ATOM 0 HG1 THR A 23 -0.255 0.886 -8.842 1.00 0.00 H new ATOM 0 HG21 THR A 23 -2.099 2.121 -7.930 1.00 0.00 H new ATOM 0 HG22 THR A 23 -1.747 3.155 -6.525 1.00 0.00 H new ATOM 0 HG23 THR A 23 -1.129 3.599 -8.133 1.00 0.00 H new ATOM 361 N VAL A 24 0.410 5.197 -6.189 1.00 0.00 N ATOM 362 CA VAL A 24 -0.182 6.314 -5.448 1.00 0.00 C ATOM 363 C VAL A 24 -0.932 7.282 -6.354 1.00 0.00 C ATOM 364 O VAL A 24 -0.317 8.040 -7.098 1.00 0.00 O ATOM 365 CB VAL A 24 0.909 7.070 -4.689 1.00 0.00 C ATOM 366 CG1 VAL A 24 0.295 7.763 -3.471 1.00 0.00 C ATOM 367 CG2 VAL A 24 1.973 6.079 -4.221 1.00 0.00 C ATOM 0 H VAL A 24 0.879 5.453 -7.058 1.00 0.00 H new ATOM 0 HA VAL A 24 -0.904 5.889 -4.750 1.00 0.00 H new ATOM 0 HB VAL A 24 1.361 7.815 -5.344 1.00 0.00 H new ATOM 0 HG11 VAL A 24 1.072 8.302 -2.929 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -0.472 8.465 -3.800 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -0.153 7.017 -2.815 1.00 0.00 H new ATOM 0 HG21 VAL A 24 2.754 6.613 -3.679 1.00 0.00 H new ATOM 0 HG22 VAL A 24 1.517 5.338 -3.564 1.00 0.00 H new ATOM 0 HG23 VAL A 24 2.409 5.578 -5.085 1.00 0.00 H new ATOM 377 N ASP A 25 -2.266 7.248 -6.251 1.00 0.00 N ATOM 378 CA ASP A 25 -3.153 8.125 -7.028 1.00 0.00 C ATOM 379 C ASP A 25 -2.478 8.673 -8.281 1.00 0.00 C ATOM 380 O ASP A 25 -2.687 8.162 -9.375 1.00 0.00 O ATOM 381 CB ASP A 25 -3.616 9.294 -6.154 1.00 0.00 C ATOM 382 CG ASP A 25 -4.866 8.898 -5.376 1.00 0.00 C ATOM 383 OD1 ASP A 25 -4.759 8.028 -4.528 1.00 0.00 O ATOM 384 OD2 ASP A 25 -5.910 9.474 -5.636 1.00 0.00 O ATOM 0 H ASP A 25 -2.762 6.612 -5.627 1.00 0.00 H new ATOM 0 HA ASP A 25 -4.004 7.523 -7.346 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -2.823 9.579 -5.463 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -3.825 10.164 -6.776 1.00 0.00 H new ATOM 389 N ARG A 26 -1.680 9.722 -8.103 1.00 0.00 N ATOM 390 CA ARG A 26 -0.970 10.355 -9.215 1.00 0.00 C ATOM 391 C ARG A 26 -0.210 11.582 -8.720 1.00 0.00 C ATOM 392 O ARG A 26 0.858 11.912 -9.235 1.00 0.00 O ATOM 393 CB ARG A 26 -1.946 10.779 -10.323 1.00 0.00 C ATOM 394 CG ARG A 26 -3.149 11.505 -9.715 1.00 0.00 C ATOM 395 CD ARG A 26 -4.433 10.757 -10.075 1.00 0.00 C ATOM 396 NE ARG A 26 -5.580 11.373 -9.419 1.00 0.00 N ATOM 397 CZ ARG A 26 -6.757 10.757 -9.369 1.00 0.00 C ATOM 398 NH1 ARG A 26 -7.769 11.329 -8.777 1.00 0.00 N ATOM 399 NH2 ARG A 26 -6.900 9.577 -9.912 1.00 0.00 N ATOM 0 H ARG A 26 -1.507 10.155 -7.196 1.00 0.00 H new ATOM 0 HA ARG A 26 -0.270 9.626 -9.623 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -1.439 11.431 -11.035 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -2.282 9.903 -10.877 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -3.042 11.564 -8.632 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -3.195 12.528 -10.087 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -4.576 10.766 -11.156 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -4.350 9.713 -9.773 1.00 0.00 H new ATOM 0 HE ARG A 26 -5.478 12.293 -8.991 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -7.658 12.250 -8.352 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -8.672 10.856 -8.739 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -6.109 9.129 -10.374 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -7.803 9.104 -9.874 1.00 0.00 H new ATOM 413 N GLU A 27 -0.767 12.250 -7.712 1.00 0.00 N ATOM 414 CA GLU A 27 -0.131 13.433 -7.147 1.00 0.00 C ATOM 415 C GLU A 27 -0.160 13.374 -5.623 1.00 0.00 C ATOM 416 O GLU A 27 0.867 13.139 -4.984 1.00 0.00 O ATOM 417 CB GLU A 27 -0.858 14.693 -7.625 1.00 0.00 C ATOM 418 CG GLU A 27 -0.005 15.926 -7.318 1.00 0.00 C ATOM 419 CD GLU A 27 -0.902 17.138 -7.094 1.00 0.00 C ATOM 420 OE1 GLU A 27 -2.033 17.105 -7.553 1.00 0.00 O ATOM 421 OE2 GLU A 27 -0.447 18.081 -6.470 1.00 0.00 O ATOM 0 H GLU A 27 -1.651 11.993 -7.274 1.00 0.00 H new ATOM 0 HA GLU A 27 0.906 13.464 -7.481 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -1.051 14.629 -8.696 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -1.826 14.776 -7.131 1.00 0.00 H new ATOM 0 HG2 GLU A 27 0.604 15.746 -6.432 1.00 0.00 H new ATOM 0 HG3 GLU A 27 0.681 16.118 -8.143 1.00 0.00 H new ATOM 428 N PHE A 28 -1.335 13.604 -5.041 1.00 0.00 N ATOM 429 CA PHE A 28 -1.485 13.590 -3.586 1.00 0.00 C ATOM 430 C PHE A 28 -0.743 14.786 -2.970 1.00 0.00 C ATOM 431 O PHE A 28 0.301 15.185 -3.478 1.00 0.00 O ATOM 432 CB PHE A 28 -0.933 12.282 -3.000 1.00 0.00 C ATOM 433 CG PHE A 28 -2.012 11.594 -2.195 1.00 0.00 C ATOM 434 CD1 PHE A 28 -3.174 11.142 -2.832 1.00 0.00 C ATOM 435 CD2 PHE A 28 -1.849 11.403 -0.817 1.00 0.00 C ATOM 436 CE1 PHE A 28 -4.173 10.499 -2.091 1.00 0.00 C ATOM 437 CE2 PHE A 28 -2.849 10.760 -0.077 1.00 0.00 C ATOM 438 CZ PHE A 28 -4.010 10.310 -0.713 1.00 0.00 C ATOM 0 H PHE A 28 -2.195 13.802 -5.552 1.00 0.00 H new ATOM 0 HA PHE A 28 -2.546 13.661 -3.348 1.00 0.00 H new ATOM 0 HB2 PHE A 28 -0.590 11.628 -3.802 1.00 0.00 H new ATOM 0 HB3 PHE A 28 -0.070 12.490 -2.368 1.00 0.00 H new ATOM 0 HD1 PHE A 28 -3.300 11.289 -3.895 1.00 0.00 H new ATOM 0 HD2 PHE A 28 -0.953 11.751 -0.326 1.00 0.00 H new ATOM 0 HE1 PHE A 28 -5.069 10.149 -2.582 1.00 0.00 H new ATOM 0 HE2 PHE A 28 -2.723 10.612 0.985 1.00 0.00 H new ATOM 0 HZ PHE A 28 -4.782 9.816 -0.141 1.00 0.00 H new ATOM 448 N PRO A 29 -1.262 15.365 -1.902 1.00 0.00 N ATOM 449 CA PRO A 29 -0.643 16.541 -1.216 1.00 0.00 C ATOM 450 C PRO A 29 0.891 16.580 -1.300 1.00 0.00 C ATOM 451 O PRO A 29 1.451 16.840 -2.364 1.00 0.00 O ATOM 452 CB PRO A 29 -1.142 16.364 0.219 1.00 0.00 C ATOM 453 CG PRO A 29 -2.521 15.821 0.062 1.00 0.00 C ATOM 454 CD PRO A 29 -2.510 14.970 -1.214 1.00 0.00 C ATOM 0 HA PRO A 29 -0.922 17.489 -1.675 1.00 0.00 H new ATOM 0 HB2 PRO A 29 -0.506 15.680 0.780 1.00 0.00 H new ATOM 0 HB3 PRO A 29 -1.146 17.311 0.759 1.00 0.00 H new ATOM 0 HG2 PRO A 29 -2.802 15.220 0.927 1.00 0.00 H new ATOM 0 HG3 PRO A 29 -3.249 16.628 -0.016 1.00 0.00 H new ATOM 0 HD2 PRO A 29 -2.517 13.905 -0.983 1.00 0.00 H new ATOM 0 HD3 PRO A 29 -3.386 15.168 -1.832 1.00 0.00 H new ATOM 462 N GLU A 30 1.563 16.340 -0.174 1.00 0.00 N ATOM 463 CA GLU A 30 3.023 16.363 -0.138 1.00 0.00 C ATOM 464 C GLU A 30 3.565 14.999 0.268 1.00 0.00 C ATOM 465 O GLU A 30 4.717 14.876 0.680 1.00 0.00 O ATOM 466 CB GLU A 30 3.500 17.419 0.860 1.00 0.00 C ATOM 467 CG GLU A 30 4.531 18.329 0.189 1.00 0.00 C ATOM 468 CD GLU A 30 5.184 19.232 1.229 1.00 0.00 C ATOM 469 OE1 GLU A 30 5.973 18.729 2.011 1.00 0.00 O ATOM 470 OE2 GLU A 30 4.887 20.416 1.227 1.00 0.00 O ATOM 0 H GLU A 30 1.121 16.129 0.721 1.00 0.00 H new ATOM 0 HA GLU A 30 3.392 16.609 -1.134 1.00 0.00 H new ATOM 0 HB2 GLU A 30 2.654 18.009 1.213 1.00 0.00 H new ATOM 0 HB3 GLU A 30 3.939 16.937 1.733 1.00 0.00 H new ATOM 0 HG2 GLU A 30 5.290 17.726 -0.310 1.00 0.00 H new ATOM 0 HG3 GLU A 30 4.049 18.934 -0.579 1.00 0.00 H new ATOM 477 N MET A 31 2.725 13.977 0.147 1.00 0.00 N ATOM 478 CA MET A 31 3.130 12.625 0.505 1.00 0.00 C ATOM 479 C MET A 31 4.009 12.026 -0.586 1.00 0.00 C ATOM 480 O MET A 31 3.527 11.290 -1.447 1.00 0.00 O ATOM 481 CB MET A 31 1.897 11.743 0.706 1.00 0.00 C ATOM 482 CG MET A 31 0.972 12.384 1.744 1.00 0.00 C ATOM 483 SD MET A 31 -0.293 11.189 2.242 1.00 0.00 S ATOM 484 CE MET A 31 0.510 10.624 3.760 1.00 0.00 C ATOM 0 H MET A 31 1.767 14.059 -0.194 1.00 0.00 H new ATOM 0 HA MET A 31 3.698 12.671 1.434 1.00 0.00 H new ATOM 0 HB2 MET A 31 1.369 11.618 -0.239 1.00 0.00 H new ATOM 0 HB3 MET A 31 2.198 10.749 1.037 1.00 0.00 H new ATOM 0 HG2 MET A 31 1.548 12.704 2.612 1.00 0.00 H new ATOM 0 HG3 MET A 31 0.502 13.275 1.328 1.00 0.00 H new ATOM 0 HE1 MET A 31 -0.111 9.868 4.240 1.00 0.00 H new ATOM 0 HE2 MET A 31 1.483 10.196 3.519 1.00 0.00 H new ATOM 0 HE3 MET A 31 0.643 11.468 4.437 1.00 0.00 H new ATOM 494 N ASN A 32 5.297 12.348 -0.543 1.00 0.00 N ATOM 495 CA ASN A 32 6.238 11.837 -1.533 1.00 0.00 C ATOM 496 C ASN A 32 7.141 10.786 -0.912 1.00 0.00 C ATOM 497 O ASN A 32 8.248 11.089 -0.470 1.00 0.00 O ATOM 498 CB ASN A 32 7.094 12.979 -2.078 1.00 0.00 C ATOM 499 CG ASN A 32 6.200 14.101 -2.589 1.00 0.00 C ATOM 500 OD1 ASN A 32 5.056 13.811 -3.144 1.00 0.00 O flip ATOM 501 ND2 ASN A 32 6.553 15.276 -2.478 1.00 0.00 N flip ATOM 0 H ASN A 32 5.712 12.957 0.162 1.00 0.00 H new ATOM 0 HA ASN A 32 5.671 11.385 -2.347 1.00 0.00 H new ATOM 0 HB2 ASN A 32 7.753 13.356 -1.296 1.00 0.00 H new ATOM 0 HB3 ASN A 32 7.731 12.615 -2.884 1.00 0.00 H new ATOM 0 HD21 ASN A 32 7.448 15.501 -2.044 1.00 0.00 H new ATOM 0 HD22 ASN A 32 5.950 16.024 -2.820 1.00 0.00 H new ATOM 508 N LEU A 33 6.669 9.547 -0.881 1.00 0.00 N ATOM 509 CA LEU A 33 7.448 8.462 -0.310 1.00 0.00 C ATOM 510 C LEU A 33 8.864 8.472 -0.870 1.00 0.00 C ATOM 511 O LEU A 33 9.071 8.244 -2.060 1.00 0.00 O ATOM 512 CB LEU A 33 6.776 7.128 -0.637 1.00 0.00 C ATOM 513 CG LEU A 33 7.016 6.114 0.485 1.00 0.00 C ATOM 514 CD1 LEU A 33 6.126 4.894 0.255 1.00 0.00 C ATOM 515 CD2 LEU A 33 8.484 5.681 0.495 1.00 0.00 C ATOM 0 H LEU A 33 5.756 9.271 -1.243 1.00 0.00 H new ATOM 0 HA LEU A 33 7.499 8.594 0.771 1.00 0.00 H new ATOM 0 HB2 LEU A 33 5.705 7.278 -0.776 1.00 0.00 H new ATOM 0 HB3 LEU A 33 7.167 6.738 -1.577 1.00 0.00 H new ATOM 0 HG LEU A 33 6.776 6.573 1.444 1.00 0.00 H new ATOM 0 HD11 LEU A 33 6.292 4.168 1.051 1.00 0.00 H new ATOM 0 HD12 LEU A 33 5.080 5.201 0.256 1.00 0.00 H new ATOM 0 HD13 LEU A 33 6.370 4.442 -0.706 1.00 0.00 H new ATOM 0 HD21 LEU A 33 8.645 4.960 1.296 1.00 0.00 H new ATOM 0 HD22 LEU A 33 8.735 5.223 -0.462 1.00 0.00 H new ATOM 0 HD23 LEU A 33 9.119 6.552 0.657 1.00 0.00 H new ATOM 527 N GLU A 34 9.830 8.740 -0.008 1.00 0.00 N ATOM 528 CA GLU A 34 11.223 8.779 -0.436 1.00 0.00 C ATOM 529 C GLU A 34 11.882 7.412 -0.268 1.00 0.00 C ATOM 530 O GLU A 34 12.740 7.028 -1.061 1.00 0.00 O ATOM 531 CB GLU A 34 11.988 9.823 0.373 1.00 0.00 C ATOM 532 CG GLU A 34 11.884 11.178 -0.327 1.00 0.00 C ATOM 533 CD GLU A 34 12.512 12.261 0.543 1.00 0.00 C ATOM 534 OE1 GLU A 34 13.459 11.951 1.248 1.00 0.00 O ATOM 535 OE2 GLU A 34 12.035 13.382 0.494 1.00 0.00 O ATOM 0 H GLU A 34 9.681 8.932 0.983 1.00 0.00 H new ATOM 0 HA GLU A 34 11.249 9.048 -1.492 1.00 0.00 H new ATOM 0 HB2 GLU A 34 11.580 9.889 1.382 1.00 0.00 H new ATOM 0 HB3 GLU A 34 13.033 9.530 0.471 1.00 0.00 H new ATOM 0 HG2 GLU A 34 12.388 11.138 -1.293 1.00 0.00 H new ATOM 0 HG3 GLU A 34 10.839 11.417 -0.522 1.00 0.00 H new ATOM 542 N SER A 35 11.473 6.680 0.764 1.00 0.00 N ATOM 543 CA SER A 35 12.036 5.359 1.014 1.00 0.00 C ATOM 544 C SER A 35 11.127 4.576 1.947 1.00 0.00 C ATOM 545 O SER A 35 10.285 5.157 2.632 1.00 0.00 O ATOM 546 CB SER A 35 13.426 5.486 1.633 1.00 0.00 C ATOM 547 OG SER A 35 13.564 6.773 2.219 1.00 0.00 O ATOM 0 H SER A 35 10.762 6.975 1.433 1.00 0.00 H new ATOM 0 HA SER A 35 12.119 4.828 0.065 1.00 0.00 H new ATOM 0 HB2 SER A 35 13.573 4.713 2.387 1.00 0.00 H new ATOM 0 HB3 SER A 35 14.191 5.337 0.871 1.00 0.00 H new ATOM 0 HG SER A 35 14.510 6.949 2.403 1.00 0.00 H new ATOM 553 N VAL A 36 11.296 3.258 1.967 1.00 0.00 N ATOM 554 CA VAL A 36 10.474 2.418 2.818 1.00 0.00 C ATOM 555 C VAL A 36 11.319 1.373 3.527 1.00 0.00 C ATOM 556 O VAL A 36 12.388 0.991 3.052 1.00 0.00 O ATOM 557 CB VAL A 36 9.380 1.751 1.985 1.00 0.00 C ATOM 558 CG1 VAL A 36 9.936 0.518 1.275 1.00 0.00 C ATOM 559 CG2 VAL A 36 8.230 1.339 2.904 1.00 0.00 C ATOM 0 H VAL A 36 11.987 2.757 1.409 1.00 0.00 H new ATOM 0 HA VAL A 36 10.008 3.043 3.580 1.00 0.00 H new ATOM 0 HB VAL A 36 9.020 2.455 1.235 1.00 0.00 H new ATOM 0 HG11 VAL A 36 9.147 0.051 0.685 1.00 0.00 H new ATOM 0 HG12 VAL A 36 10.754 0.814 0.618 1.00 0.00 H new ATOM 0 HG13 VAL A 36 10.304 -0.193 2.015 1.00 0.00 H new ATOM 0 HG21 VAL A 36 7.446 0.862 2.315 1.00 0.00 H new ATOM 0 HG22 VAL A 36 8.597 0.638 3.654 1.00 0.00 H new ATOM 0 HG23 VAL A 36 7.826 2.222 3.399 1.00 0.00 H new ATOM 569 N THR A 37 10.825 0.915 4.671 1.00 0.00 N ATOM 570 CA THR A 37 11.530 -0.090 5.452 1.00 0.00 C ATOM 571 C THR A 37 10.833 -1.445 5.328 1.00 0.00 C ATOM 572 O THR A 37 9.616 -1.493 5.155 1.00 0.00 O ATOM 573 CB THR A 37 11.528 0.324 6.924 1.00 0.00 C ATOM 574 OG1 THR A 37 10.200 0.253 7.421 1.00 0.00 O ATOM 575 CG2 THR A 37 12.054 1.751 7.063 1.00 0.00 C ATOM 0 H THR A 37 9.941 1.223 5.076 1.00 0.00 H new ATOM 0 HA THR A 37 12.551 -0.171 5.078 1.00 0.00 H new ATOM 0 HB THR A 37 12.172 -0.346 7.494 1.00 0.00 H new ATOM 0 HG1 THR A 37 9.635 0.892 6.938 1.00 0.00 H new ATOM 0 HG21 THR A 37 12.050 2.040 8.114 1.00 0.00 H new ATOM 0 HG22 THR A 37 13.072 1.803 6.676 1.00 0.00 H new ATOM 0 HG23 THR A 37 11.416 2.431 6.498 1.00 0.00 H new ATOM 583 N PRO A 38 11.553 -2.539 5.435 1.00 0.00 N ATOM 584 CA PRO A 38 10.945 -3.893 5.361 1.00 0.00 C ATOM 585 C PRO A 38 9.599 -3.926 6.077 1.00 0.00 C ATOM 586 O PRO A 38 9.464 -3.389 7.177 1.00 0.00 O ATOM 587 CB PRO A 38 11.970 -4.770 6.071 1.00 0.00 C ATOM 588 CG PRO A 38 13.287 -4.113 5.820 1.00 0.00 C ATOM 589 CD PRO A 38 13.013 -2.617 5.630 1.00 0.00 C ATOM 0 HA PRO A 38 10.739 -4.218 4.341 1.00 0.00 H new ATOM 0 HB2 PRO A 38 11.760 -4.836 7.139 1.00 0.00 H new ATOM 0 HB3 PRO A 38 11.956 -5.787 5.680 1.00 0.00 H new ATOM 0 HG2 PRO A 38 13.966 -4.277 6.657 1.00 0.00 H new ATOM 0 HG3 PRO A 38 13.765 -4.533 4.935 1.00 0.00 H new ATOM 0 HD2 PRO A 38 13.330 -2.040 6.499 1.00 0.00 H new ATOM 0 HD3 PRO A 38 13.552 -2.219 4.770 1.00 0.00 H new ATOM 597 N MET A 39 8.602 -4.530 5.447 1.00 0.00 N ATOM 598 CA MET A 39 7.279 -4.587 6.038 1.00 0.00 C ATOM 599 C MET A 39 7.129 -5.832 6.891 1.00 0.00 C ATOM 600 O MET A 39 7.587 -6.912 6.517 1.00 0.00 O ATOM 601 CB MET A 39 6.219 -4.581 4.936 1.00 0.00 C ATOM 602 CG MET A 39 4.842 -4.824 5.551 1.00 0.00 C ATOM 603 SD MET A 39 3.611 -3.789 4.717 1.00 0.00 S ATOM 604 CE MET A 39 3.676 -4.592 3.097 1.00 0.00 C ATOM 0 H MET A 39 8.685 -4.982 4.536 1.00 0.00 H new ATOM 0 HA MET A 39 7.144 -3.712 6.674 1.00 0.00 H new ATOM 0 HB2 MET A 39 6.231 -3.626 4.411 1.00 0.00 H new ATOM 0 HB3 MET A 39 6.441 -5.353 4.199 1.00 0.00 H new ATOM 0 HG2 MET A 39 4.571 -5.876 5.457 1.00 0.00 H new ATOM 0 HG3 MET A 39 4.863 -4.594 6.616 1.00 0.00 H new ATOM 0 HE1 MET A 39 4.011 -3.874 2.348 1.00 0.00 H new ATOM 0 HE2 MET A 39 4.372 -5.430 3.134 1.00 0.00 H new ATOM 0 HE3 MET A 39 2.684 -4.956 2.831 1.00 0.00 H new ATOM 614 N THR A 40 6.484 -5.670 8.037 1.00 0.00 N ATOM 615 CA THR A 40 6.273 -6.784 8.944 1.00 0.00 C ATOM 616 C THR A 40 4.816 -7.232 8.917 1.00 0.00 C ATOM 617 O THR A 40 3.937 -6.556 9.449 1.00 0.00 O ATOM 618 CB THR A 40 6.663 -6.382 10.367 1.00 0.00 C ATOM 619 OG1 THR A 40 7.874 -5.638 10.331 1.00 0.00 O ATOM 620 CG2 THR A 40 6.858 -7.635 11.222 1.00 0.00 C ATOM 0 H THR A 40 6.100 -4.781 8.358 1.00 0.00 H new ATOM 0 HA THR A 40 6.900 -7.615 8.619 1.00 0.00 H new ATOM 0 HB THR A 40 5.871 -5.771 10.801 1.00 0.00 H new ATOM 0 HG1 THR A 40 8.125 -5.378 11.242 1.00 0.00 H new ATOM 0 HG21 THR A 40 7.136 -7.345 12.235 1.00 0.00 H new ATOM 0 HG22 THR A 40 5.929 -8.205 11.250 1.00 0.00 H new ATOM 0 HG23 THR A 40 7.648 -8.250 10.791 1.00 0.00 H new ATOM 628 N LEU A 41 4.569 -8.377 8.289 1.00 0.00 N ATOM 629 CA LEU A 41 3.219 -8.912 8.190 1.00 0.00 C ATOM 630 C LEU A 41 3.039 -10.078 9.151 1.00 0.00 C ATOM 631 O LEU A 41 3.517 -11.185 8.897 1.00 0.00 O ATOM 632 CB LEU A 41 2.964 -9.373 6.758 1.00 0.00 C ATOM 633 CG LEU A 41 2.764 -8.147 5.867 1.00 0.00 C ATOM 634 CD1 LEU A 41 3.710 -8.220 4.677 1.00 0.00 C ATOM 635 CD2 LEU A 41 1.320 -8.112 5.382 1.00 0.00 C ATOM 0 H LEU A 41 5.285 -8.950 7.843 1.00 0.00 H new ATOM 0 HA LEU A 41 2.505 -8.133 8.456 1.00 0.00 H new ATOM 0 HB2 LEU A 41 3.805 -9.966 6.398 1.00 0.00 H new ATOM 0 HB3 LEU A 41 2.083 -10.013 6.720 1.00 0.00 H new ATOM 0 HG LEU A 41 2.978 -7.241 6.434 1.00 0.00 H new ATOM 0 HD11 LEU A 41 3.566 -7.345 4.043 1.00 0.00 H new ATOM 0 HD12 LEU A 41 4.740 -8.245 5.032 1.00 0.00 H new ATOM 0 HD13 LEU A 41 3.503 -9.123 4.102 1.00 0.00 H new ATOM 0 HD21 LEU A 41 1.171 -7.240 4.746 1.00 0.00 H new ATOM 0 HD22 LEU A 41 1.105 -9.017 4.813 1.00 0.00 H new ATOM 0 HD23 LEU A 41 0.649 -8.055 6.239 1.00 0.00 H new ATOM 647 N THR A 42 2.348 -9.824 10.255 1.00 0.00 N ATOM 648 CA THR A 42 2.114 -10.859 11.240 1.00 0.00 C ATOM 649 C THR A 42 0.761 -11.490 10.992 1.00 0.00 C ATOM 650 O THR A 42 -0.246 -10.799 10.861 1.00 0.00 O ATOM 651 CB THR A 42 2.172 -10.284 12.658 1.00 0.00 C ATOM 652 OG1 THR A 42 0.855 -10.188 13.183 1.00 0.00 O ATOM 653 CG2 THR A 42 2.818 -8.898 12.625 1.00 0.00 C ATOM 0 H THR A 42 1.945 -8.916 10.485 1.00 0.00 H new ATOM 0 HA THR A 42 2.894 -11.615 11.148 1.00 0.00 H new ATOM 0 HB THR A 42 2.767 -10.941 13.293 1.00 0.00 H new ATOM 0 HG1 THR A 42 0.893 -10.183 14.162 1.00 0.00 H new ATOM 0 HG21 THR A 42 2.858 -8.491 13.635 1.00 0.00 H new ATOM 0 HG22 THR A 42 3.829 -8.977 12.225 1.00 0.00 H new ATOM 0 HG23 THR A 42 2.228 -8.237 11.991 1.00 0.00 H new ATOM 661 N THR A 43 0.743 -12.806 10.947 1.00 0.00 N ATOM 662 CA THR A 43 -0.502 -13.514 10.728 1.00 0.00 C ATOM 663 C THR A 43 -1.122 -13.864 12.069 1.00 0.00 C ATOM 664 O THR A 43 -0.598 -14.701 12.805 1.00 0.00 O ATOM 665 CB THR A 43 -0.263 -14.779 9.902 1.00 0.00 C ATOM 666 OG1 THR A 43 0.367 -14.428 8.675 1.00 0.00 O ATOM 667 CG2 THR A 43 -1.605 -15.453 9.617 1.00 0.00 C ATOM 0 H THR A 43 1.564 -13.401 11.057 1.00 0.00 H new ATOM 0 HA THR A 43 -1.186 -12.873 10.171 1.00 0.00 H new ATOM 0 HB THR A 43 0.379 -15.466 10.454 1.00 0.00 H new ATOM 0 HG1 THR A 43 0.932 -15.170 8.374 1.00 0.00 H new ATOM 0 HG21 THR A 43 -1.441 -16.356 9.028 1.00 0.00 H new ATOM 0 HG22 THR A 43 -2.087 -15.716 10.558 1.00 0.00 H new ATOM 0 HG23 THR A 43 -2.245 -14.768 9.061 1.00 0.00 H new ATOM 675 N LEU A 44 -2.231 -13.212 12.391 1.00 0.00 N ATOM 676 CA LEU A 44 -2.897 -13.457 13.657 1.00 0.00 C ATOM 677 C LEU A 44 -3.772 -14.698 13.570 1.00 0.00 C ATOM 678 O LEU A 44 -4.629 -14.809 12.686 1.00 0.00 O ATOM 679 CB LEU A 44 -3.727 -12.238 14.057 1.00 0.00 C ATOM 680 CG LEU A 44 -2.936 -10.967 13.728 1.00 0.00 C ATOM 681 CD1 LEU A 44 -3.688 -9.732 14.225 1.00 0.00 C ATOM 682 CD2 LEU A 44 -1.566 -11.036 14.408 1.00 0.00 C ATOM 0 H LEU A 44 -2.683 -12.516 11.798 1.00 0.00 H new ATOM 0 HA LEU A 44 -2.141 -13.630 14.423 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -4.678 -12.238 13.524 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -3.958 -12.273 15.122 1.00 0.00 H new ATOM 0 HG LEU A 44 -2.812 -10.894 12.648 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -3.115 -8.836 13.985 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -4.663 -9.680 13.740 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -3.823 -9.798 15.305 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -0.999 -10.134 14.177 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -1.699 -11.115 15.487 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -1.023 -11.909 14.045 1.00 0.00 H new ATOM 694 N GLU A 45 -3.523 -15.621 14.500 1.00 0.00 N ATOM 695 CA GLU A 45 -4.244 -16.889 14.561 1.00 0.00 C ATOM 696 C GLU A 45 -4.319 -17.523 13.179 1.00 0.00 C ATOM 697 O GLU A 45 -3.520 -18.396 12.840 1.00 0.00 O ATOM 698 CB GLU A 45 -5.658 -16.661 15.099 1.00 0.00 C ATOM 699 CG GLU A 45 -5.581 -16.202 16.555 1.00 0.00 C ATOM 700 CD GLU A 45 -6.972 -15.838 17.063 1.00 0.00 C ATOM 701 OE1 GLU A 45 -7.862 -16.660 16.929 1.00 0.00 O ATOM 702 OE2 GLU A 45 -7.126 -14.742 17.577 1.00 0.00 O ATOM 0 H GLU A 45 -2.818 -15.510 15.229 1.00 0.00 H new ATOM 0 HA GLU A 45 -3.707 -17.562 15.230 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -6.171 -15.911 14.497 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -6.239 -17.580 15.027 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -5.155 -16.993 17.172 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -4.918 -15.341 16.639 1.00 0.00 H new ATOM 709 N GLY A 46 -5.270 -17.071 12.385 1.00 0.00 N ATOM 710 CA GLY A 46 -5.438 -17.586 11.037 1.00 0.00 C ATOM 711 C GLY A 46 -6.560 -16.842 10.339 1.00 0.00 C ATOM 712 O GLY A 46 -7.070 -17.289 9.311 1.00 0.00 O ATOM 0 H GLY A 46 -5.939 -16.348 12.649 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -4.510 -17.473 10.476 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -5.662 -18.652 11.070 1.00 0.00 H new ATOM 716 N GLY A 47 -6.952 -15.712 10.921 1.00 0.00 N ATOM 717 CA GLY A 47 -8.036 -14.919 10.362 1.00 0.00 C ATOM 718 C GLY A 47 -7.660 -13.448 10.209 1.00 0.00 C ATOM 719 O GLY A 47 -8.091 -12.805 9.254 1.00 0.00 O ATOM 0 H GLY A 47 -6.538 -15.330 11.771 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -8.314 -15.323 9.389 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -8.913 -15.002 11.004 1.00 0.00 H new ATOM 723 N ASN A 48 -6.863 -12.911 11.139 1.00 0.00 N ATOM 724 CA ASN A 48 -6.477 -11.498 11.053 1.00 0.00 C ATOM 725 C ASN A 48 -4.994 -11.342 10.770 1.00 0.00 C ATOM 726 O ASN A 48 -4.172 -12.144 11.215 1.00 0.00 O ATOM 727 CB ASN A 48 -6.825 -10.761 12.346 1.00 0.00 C ATOM 728 CG ASN A 48 -7.553 -11.695 13.304 1.00 0.00 C ATOM 729 OD1 ASN A 48 -8.647 -12.292 12.916 1.00 0.00 O flip ATOM 730 ND2 ASN A 48 -7.115 -11.888 14.438 1.00 0.00 N flip ATOM 0 H ASN A 48 -6.481 -13.416 11.939 1.00 0.00 H new ATOM 0 HA ASN A 48 -7.037 -11.062 10.226 1.00 0.00 H new ATOM 0 HB2 ASN A 48 -5.916 -10.384 12.814 1.00 0.00 H new ATOM 0 HB3 ASN A 48 -7.451 -9.897 12.123 1.00 0.00 H new ATOM 0 HD21 ASN A 48 -6.260 -11.421 14.741 1.00 0.00 H new ATOM 0 HD22 ASN A 48 -7.607 -12.515 15.075 1.00 0.00 H new ATOM 737 N LEU A 49 -4.670 -10.307 10.006 1.00 0.00 N ATOM 738 CA LEU A 49 -3.282 -10.036 9.633 1.00 0.00 C ATOM 739 C LEU A 49 -2.864 -8.640 10.091 1.00 0.00 C ATOM 740 O LEU A 49 -3.612 -7.683 9.918 1.00 0.00 O ATOM 741 CB LEU A 49 -3.150 -10.124 8.109 1.00 0.00 C ATOM 742 CG LEU A 49 -2.077 -11.148 7.717 1.00 0.00 C ATOM 743 CD1 LEU A 49 -2.106 -11.381 6.201 1.00 0.00 C ATOM 744 CD2 LEU A 49 -0.699 -10.615 8.108 1.00 0.00 C ATOM 0 H LEU A 49 -5.346 -9.641 9.632 1.00 0.00 H new ATOM 0 HA LEU A 49 -2.637 -10.771 10.114 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -4.107 -10.407 7.672 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -2.892 -9.146 7.704 1.00 0.00 H new ATOM 0 HG LEU A 49 -2.276 -12.086 8.235 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -1.341 -12.109 5.930 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -3.086 -11.758 5.910 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -1.911 -10.441 5.685 1.00 0.00 H new ATOM 0 HD21 LEU A 49 0.064 -11.342 7.830 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -0.512 -9.675 7.589 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -0.666 -10.448 9.185 1.00 0.00 H new ATOM 756 N GLU A 50 -1.662 -8.522 10.657 1.00 0.00 N ATOM 757 CA GLU A 50 -1.163 -7.230 11.107 1.00 0.00 C ATOM 758 C GLU A 50 0.027 -6.831 10.257 1.00 0.00 C ATOM 759 O GLU A 50 0.996 -7.582 10.152 1.00 0.00 O ATOM 760 CB GLU A 50 -0.757 -7.296 12.579 1.00 0.00 C ATOM 761 CG GLU A 50 -0.158 -5.953 13.003 1.00 0.00 C ATOM 762 CD GLU A 50 -0.438 -5.703 14.480 1.00 0.00 C ATOM 763 OE1 GLU A 50 -1.602 -5.622 14.836 1.00 0.00 O ATOM 764 OE2 GLU A 50 0.515 -5.596 15.234 1.00 0.00 O ATOM 0 H GLU A 50 -1.023 -9.302 10.812 1.00 0.00 H new ATOM 0 HA GLU A 50 -1.953 -6.486 11.003 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -1.624 -7.531 13.196 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -0.031 -8.095 12.732 1.00 0.00 H new ATOM 0 HG2 GLU A 50 0.917 -5.951 12.822 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -0.584 -5.149 12.402 1.00 0.00 H new ATOM 771 N ALA A 51 -0.058 -5.662 9.631 1.00 0.00 N ATOM 772 CA ALA A 51 1.022 -5.196 8.774 1.00 0.00 C ATOM 773 C ALA A 51 1.646 -3.926 9.320 1.00 0.00 C ATOM 774 O ALA A 51 0.961 -2.927 9.531 1.00 0.00 O ATOM 775 CB ALA A 51 0.496 -4.966 7.360 1.00 0.00 C ATOM 0 H ALA A 51 -0.854 -5.028 9.700 1.00 0.00 H new ATOM 0 HA ALA A 51 1.797 -5.962 8.748 1.00 0.00 H new ATOM 0 HB1 ALA A 51 1.308 -4.617 6.722 1.00 0.00 H new ATOM 0 HB2 ALA A 51 0.098 -5.900 6.963 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -0.295 -4.216 7.383 1.00 0.00 H new ATOM 781 N LYS A 52 2.954 -3.989 9.560 1.00 0.00 N ATOM 782 CA LYS A 52 3.673 -2.842 10.102 1.00 0.00 C ATOM 783 C LYS A 52 4.903 -2.523 9.271 1.00 0.00 C ATOM 784 O LYS A 52 5.789 -3.361 9.099 1.00 0.00 O ATOM 785 CB LYS A 52 4.090 -3.112 11.550 1.00 0.00 C ATOM 786 CG LYS A 52 3.385 -4.373 12.063 1.00 0.00 C ATOM 787 CD LYS A 52 3.726 -4.597 13.542 1.00 0.00 C ATOM 788 CE LYS A 52 5.008 -5.427 13.656 1.00 0.00 C ATOM 789 NZ LYS A 52 4.726 -6.835 13.256 1.00 0.00 N ATOM 0 H LYS A 52 3.531 -4.813 9.390 1.00 0.00 H new ATOM 0 HA LYS A 52 3.001 -1.984 10.071 1.00 0.00 H new ATOM 0 HB2 LYS A 52 5.171 -3.238 11.610 1.00 0.00 H new ATOM 0 HB3 LYS A 52 3.833 -2.259 12.178 1.00 0.00 H new ATOM 0 HG2 LYS A 52 2.307 -4.272 11.941 1.00 0.00 H new ATOM 0 HG3 LYS A 52 3.693 -5.237 11.475 1.00 0.00 H new ATOM 0 HD2 LYS A 52 3.856 -3.638 14.044 1.00 0.00 H new ATOM 0 HD3 LYS A 52 2.904 -5.110 14.041 1.00 0.00 H new ATOM 0 HE2 LYS A 52 5.785 -5.005 13.018 1.00 0.00 H new ATOM 0 HE3 LYS A 52 5.384 -5.397 14.679 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 5.556 -7.427 13.461 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 3.907 -7.190 13.790 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 4.518 -6.872 12.238 1.00 0.00 H new ATOM 803 N VAL A 53 4.946 -1.304 8.746 1.00 0.00 N ATOM 804 CA VAL A 53 6.057 -0.877 7.927 1.00 0.00 C ATOM 805 C VAL A 53 6.322 0.597 8.170 1.00 0.00 C ATOM 806 O VAL A 53 5.395 1.366 8.420 1.00 0.00 O ATOM 807 CB VAL A 53 5.728 -1.105 6.451 1.00 0.00 C ATOM 808 CG1 VAL A 53 4.529 -0.240 6.057 1.00 0.00 C ATOM 809 CG2 VAL A 53 6.936 -0.726 5.588 1.00 0.00 C ATOM 0 H VAL A 53 4.221 -0.599 8.877 1.00 0.00 H new ATOM 0 HA VAL A 53 6.944 -1.454 8.188 1.00 0.00 H new ATOM 0 HB VAL A 53 5.488 -2.156 6.293 1.00 0.00 H new ATOM 0 HG11 VAL A 53 4.294 -0.402 5.005 1.00 0.00 H new ATOM 0 HG12 VAL A 53 3.668 -0.512 6.667 1.00 0.00 H new ATOM 0 HG13 VAL A 53 4.770 0.811 6.217 1.00 0.00 H new ATOM 0 HG21 VAL A 53 6.698 -0.890 4.537 1.00 0.00 H new ATOM 0 HG22 VAL A 53 7.180 0.325 5.745 1.00 0.00 H new ATOM 0 HG23 VAL A 53 7.790 -1.343 5.867 1.00 0.00 H new ATOM 819 N THR A 54 7.582 0.984 8.093 1.00 0.00 N ATOM 820 CA THR A 54 7.954 2.368 8.300 1.00 0.00 C ATOM 821 C THR A 54 8.294 2.998 6.972 1.00 0.00 C ATOM 822 O THR A 54 9.027 2.412 6.174 1.00 0.00 O ATOM 823 CB THR A 54 9.157 2.466 9.239 1.00 0.00 C ATOM 824 OG1 THR A 54 8.965 1.598 10.348 1.00 0.00 O ATOM 825 CG2 THR A 54 9.317 3.906 9.736 1.00 0.00 C ATOM 0 H THR A 54 8.362 0.360 7.889 1.00 0.00 H new ATOM 0 HA THR A 54 7.115 2.895 8.755 1.00 0.00 H new ATOM 0 HB THR A 54 10.057 2.174 8.698 1.00 0.00 H new ATOM 0 HG1 THR A 54 9.736 1.660 10.949 1.00 0.00 H new ATOM 0 HG21 THR A 54 10.176 3.967 10.404 1.00 0.00 H new ATOM 0 HG22 THR A 54 9.471 4.570 8.885 1.00 0.00 H new ATOM 0 HG23 THR A 54 8.418 4.208 10.273 1.00 0.00 H new ATOM 833 N MET A 55 7.746 4.179 6.729 1.00 0.00 N ATOM 834 CA MET A 55 7.999 4.860 5.470 1.00 0.00 C ATOM 835 C MET A 55 8.644 6.207 5.684 1.00 0.00 C ATOM 836 O MET A 55 8.414 6.882 6.688 1.00 0.00 O ATOM 837 CB MET A 55 6.702 5.045 4.680 1.00 0.00 C ATOM 838 CG MET A 55 5.507 4.582 5.517 1.00 0.00 C ATOM 839 SD MET A 55 3.926 5.087 4.756 1.00 0.00 S ATOM 840 CE MET A 55 4.355 5.000 3.000 1.00 0.00 C ATOM 0 H MET A 55 7.134 4.678 7.375 1.00 0.00 H new ATOM 0 HA MET A 55 8.685 4.231 4.903 1.00 0.00 H new ATOM 0 HB2 MET A 55 6.580 6.093 4.406 1.00 0.00 H new ATOM 0 HB3 MET A 55 6.748 4.476 3.751 1.00 0.00 H new ATOM 0 HG2 MET A 55 5.532 3.497 5.621 1.00 0.00 H new ATOM 0 HG3 MET A 55 5.580 5.001 6.521 1.00 0.00 H new ATOM 0 HE1 MET A 55 3.450 5.088 2.399 1.00 0.00 H new ATOM 0 HE2 MET A 55 5.036 5.814 2.751 1.00 0.00 H new ATOM 0 HE3 MET A 55 4.838 4.046 2.790 1.00 0.00 H new ATOM 850 N LEU A 56 9.415 6.607 4.690 1.00 0.00 N ATOM 851 CA LEU A 56 10.061 7.900 4.713 1.00 0.00 C ATOM 852 C LEU A 56 9.259 8.829 3.821 1.00 0.00 C ATOM 853 O LEU A 56 9.529 8.953 2.627 1.00 0.00 O ATOM 854 CB LEU A 56 11.508 7.801 4.215 1.00 0.00 C ATOM 855 CG LEU A 56 12.184 9.178 4.292 1.00 0.00 C ATOM 856 CD1 LEU A 56 12.235 9.655 5.744 1.00 0.00 C ATOM 857 CD2 LEU A 56 13.611 9.075 3.749 1.00 0.00 C ATOM 0 H LEU A 56 9.608 6.052 3.856 1.00 0.00 H new ATOM 0 HA LEU A 56 10.096 8.281 5.734 1.00 0.00 H new ATOM 0 HB2 LEU A 56 12.061 7.081 4.818 1.00 0.00 H new ATOM 0 HB3 LEU A 56 11.524 7.435 3.188 1.00 0.00 H new ATOM 0 HG LEU A 56 11.610 9.889 3.698 1.00 0.00 H new ATOM 0 HD11 LEU A 56 12.716 10.632 5.789 1.00 0.00 H new ATOM 0 HD12 LEU A 56 11.221 9.731 6.138 1.00 0.00 H new ATOM 0 HD13 LEU A 56 12.804 8.943 6.341 1.00 0.00 H new ATOM 0 HD21 LEU A 56 14.092 10.052 3.803 1.00 0.00 H new ATOM 0 HD22 LEU A 56 14.176 8.359 4.345 1.00 0.00 H new ATOM 0 HD23 LEU A 56 13.582 8.741 2.712 1.00 0.00 H new ATOM 869 N ILE A 57 8.252 9.455 4.407 1.00 0.00 N ATOM 870 CA ILE A 57 7.387 10.343 3.663 1.00 0.00 C ATOM 871 C ILE A 57 7.966 11.746 3.638 1.00 0.00 C ATOM 872 O ILE A 57 8.085 12.403 4.671 1.00 0.00 O ATOM 873 CB ILE A 57 5.996 10.355 4.292 1.00 0.00 C ATOM 874 CG1 ILE A 57 5.332 8.994 4.055 1.00 0.00 C ATOM 875 CG2 ILE A 57 5.157 11.461 3.659 1.00 0.00 C ATOM 876 CD1 ILE A 57 4.550 8.995 2.735 1.00 0.00 C ATOM 0 H ILE A 57 8.017 9.362 5.395 1.00 0.00 H new ATOM 0 HA ILE A 57 7.310 9.984 2.637 1.00 0.00 H new ATOM 0 HB ILE A 57 6.075 10.541 5.363 1.00 0.00 H new ATOM 0 HG12 ILE A 57 6.091 8.212 4.033 1.00 0.00 H new ATOM 0 HG13 ILE A 57 4.660 8.763 4.881 1.00 0.00 H new ATOM 0 HG21 ILE A 57 4.164 11.468 4.109 1.00 0.00 H new ATOM 0 HG22 ILE A 57 5.638 12.424 3.827 1.00 0.00 H new ATOM 0 HG23 ILE A 57 5.068 11.282 2.587 1.00 0.00 H new ATOM 0 HD11 ILE A 57 4.087 8.020 2.586 1.00 0.00 H new ATOM 0 HD12 ILE A 57 3.777 9.763 2.771 1.00 0.00 H new ATOM 0 HD13 ILE A 57 5.230 9.203 1.909 1.00 0.00 H new ATOM 888 N SER A 58 8.305 12.198 2.445 1.00 0.00 N ATOM 889 CA SER A 58 8.864 13.531 2.269 1.00 0.00 C ATOM 890 C SER A 58 9.882 13.848 3.362 1.00 0.00 C ATOM 891 O SER A 58 9.814 14.902 3.993 1.00 0.00 O ATOM 892 CB SER A 58 7.744 14.571 2.298 1.00 0.00 C ATOM 893 OG SER A 58 7.020 14.516 1.077 1.00 0.00 O ATOM 0 H SER A 58 8.204 11.664 1.582 1.00 0.00 H new ATOM 0 HA SER A 58 9.371 13.562 1.305 1.00 0.00 H new ATOM 0 HB2 SER A 58 7.077 14.380 3.139 1.00 0.00 H new ATOM 0 HB3 SER A 58 8.161 15.568 2.442 1.00 0.00 H new ATOM 0 HG SER A 58 6.059 14.489 1.267 1.00 0.00 H new ATOM 899 N GLY A 59 10.841 12.948 3.566 1.00 0.00 N ATOM 900 CA GLY A 59 11.881 13.171 4.570 1.00 0.00 C ATOM 901 C GLY A 59 11.394 12.836 5.974 1.00 0.00 C ATOM 902 O GLY A 59 12.185 12.761 6.913 1.00 0.00 O ATOM 0 H GLY A 59 10.921 12.068 3.057 1.00 0.00 H new ATOM 0 HA2 GLY A 59 12.752 12.561 4.332 1.00 0.00 H new ATOM 0 HA3 GLY A 59 12.202 14.212 4.536 1.00 0.00 H new ATOM 906 N ARG A 60 10.092 12.635 6.109 1.00 0.00 N ATOM 907 CA ARG A 60 9.513 12.306 7.406 1.00 0.00 C ATOM 908 C ARG A 60 9.372 10.796 7.561 1.00 0.00 C ATOM 909 O ARG A 60 8.798 10.124 6.704 1.00 0.00 O ATOM 910 CB ARG A 60 8.141 12.968 7.547 1.00 0.00 C ATOM 911 CG ARG A 60 8.231 14.428 7.098 1.00 0.00 C ATOM 912 CD ARG A 60 6.884 15.117 7.318 1.00 0.00 C ATOM 913 NE ARG A 60 6.418 14.891 8.682 1.00 0.00 N ATOM 914 CZ ARG A 60 7.033 15.446 9.721 1.00 0.00 C ATOM 915 NH1 ARG A 60 6.592 15.230 10.930 1.00 0.00 N ATOM 916 NH2 ARG A 60 8.077 16.205 9.534 1.00 0.00 N ATOM 0 H ARG A 60 9.420 12.693 5.344 1.00 0.00 H new ATOM 0 HA ARG A 60 10.177 12.678 8.186 1.00 0.00 H new ATOM 0 HB2 ARG A 60 7.405 12.436 6.945 1.00 0.00 H new ATOM 0 HB3 ARG A 60 7.804 12.915 8.582 1.00 0.00 H new ATOM 0 HG2 ARG A 60 9.010 14.944 7.659 1.00 0.00 H new ATOM 0 HG3 ARG A 60 8.509 14.479 6.045 1.00 0.00 H new ATOM 0 HD2 ARG A 60 6.980 16.187 7.131 1.00 0.00 H new ATOM 0 HD3 ARG A 60 6.151 14.734 6.608 1.00 0.00 H new ATOM 0 HE ARG A 60 5.605 14.296 8.841 1.00 0.00 H new ATOM 0 HH11 ARG A 60 5.776 14.636 11.077 1.00 0.00 H new ATOM 0 HH12 ARG A 60 7.063 15.655 11.728 1.00 0.00 H new ATOM 0 HH21 ARG A 60 8.423 16.373 8.589 1.00 0.00 H new ATOM 0 HH22 ARG A 60 8.548 16.630 10.333 1.00 0.00 H new ATOM 930 N CYS A 61 9.891 10.271 8.665 1.00 0.00 N ATOM 931 CA CYS A 61 9.810 8.841 8.932 1.00 0.00 C ATOM 932 C CYS A 61 8.553 8.540 9.733 1.00 0.00 C ATOM 933 O CYS A 61 8.446 8.935 10.894 1.00 0.00 O ATOM 934 CB CYS A 61 11.043 8.380 9.711 1.00 0.00 C ATOM 935 SG CYS A 61 12.488 9.322 9.160 1.00 0.00 S ATOM 0 H CYS A 61 10.370 10.811 9.386 1.00 0.00 H new ATOM 0 HA CYS A 61 9.771 8.305 7.984 1.00 0.00 H new ATOM 0 HB2 CYS A 61 10.887 8.525 10.780 1.00 0.00 H new ATOM 0 HB3 CYS A 61 11.208 7.314 9.554 1.00 0.00 H new ATOM 940 N GLN A 62 7.602 7.850 9.104 1.00 0.00 N ATOM 941 CA GLN A 62 6.348 7.520 9.784 1.00 0.00 C ATOM 942 C GLN A 62 6.106 6.015 9.841 1.00 0.00 C ATOM 943 O GLN A 62 6.148 5.319 8.827 1.00 0.00 O ATOM 944 CB GLN A 62 5.172 8.212 9.094 1.00 0.00 C ATOM 945 CG GLN A 62 5.242 7.982 7.587 1.00 0.00 C ATOM 946 CD GLN A 62 3.855 7.627 7.067 1.00 0.00 C ATOM 947 OE1 GLN A 62 3.450 6.391 7.124 1.00 0.00 O flip ATOM 948 NE2 GLN A 62 3.119 8.500 6.607 1.00 0.00 N flip ATOM 0 H GLN A 62 7.672 7.514 8.144 1.00 0.00 H new ATOM 0 HA GLN A 62 6.431 7.880 10.809 1.00 0.00 H new ATOM 0 HB2 GLN A 62 4.231 7.825 9.486 1.00 0.00 H new ATOM 0 HB3 GLN A 62 5.192 9.281 9.308 1.00 0.00 H new ATOM 0 HG2 GLN A 62 5.612 8.877 7.088 1.00 0.00 H new ATOM 0 HG3 GLN A 62 5.944 7.179 7.362 1.00 0.00 H new ATOM 0 HE21 GLN A 62 3.440 9.467 6.564 1.00 0.00 H new ATOM 0 HE22 GLN A 62 2.188 8.256 6.269 1.00 0.00 H new ATOM 957 N GLU A 63 5.848 5.537 11.056 1.00 0.00 N ATOM 958 CA GLU A 63 5.587 4.123 11.298 1.00 0.00 C ATOM 959 C GLU A 63 4.126 3.797 11.041 1.00 0.00 C ATOM 960 O GLU A 63 3.232 4.358 11.674 1.00 0.00 O ATOM 961 CB GLU A 63 5.935 3.775 12.747 1.00 0.00 C ATOM 962 CG GLU A 63 7.136 2.826 12.773 1.00 0.00 C ATOM 963 CD GLU A 63 6.754 1.482 12.166 1.00 0.00 C ATOM 964 OE1 GLU A 63 5.674 1.393 11.604 1.00 0.00 O ATOM 965 OE2 GLU A 63 7.545 0.559 12.272 1.00 0.00 O ATOM 0 H GLU A 63 5.814 6.116 11.895 1.00 0.00 H new ATOM 0 HA GLU A 63 6.205 3.536 10.618 1.00 0.00 H new ATOM 0 HB2 GLU A 63 6.164 4.683 13.305 1.00 0.00 H new ATOM 0 HB3 GLU A 63 5.079 3.308 13.235 1.00 0.00 H new ATOM 0 HG2 GLU A 63 7.966 3.262 12.217 1.00 0.00 H new ATOM 0 HG3 GLU A 63 7.477 2.687 13.799 1.00 0.00 H new ATOM 972 N VAL A 64 3.892 2.867 10.128 1.00 0.00 N ATOM 973 CA VAL A 64 2.529 2.448 9.812 1.00 0.00 C ATOM 974 C VAL A 64 2.235 1.101 10.468 1.00 0.00 C ATOM 975 O VAL A 64 3.127 0.265 10.602 1.00 0.00 O ATOM 976 CB VAL A 64 2.360 2.334 8.299 1.00 0.00 C ATOM 977 CG1 VAL A 64 0.880 2.476 7.937 1.00 0.00 C ATOM 978 CG2 VAL A 64 3.159 3.448 7.625 1.00 0.00 C ATOM 0 H VAL A 64 4.619 2.390 9.595 1.00 0.00 H new ATOM 0 HA VAL A 64 1.830 3.192 10.195 1.00 0.00 H new ATOM 0 HB VAL A 64 2.721 1.363 7.960 1.00 0.00 H new ATOM 0 HG11 VAL A 64 0.760 2.395 6.857 1.00 0.00 H new ATOM 0 HG12 VAL A 64 0.309 1.687 8.426 1.00 0.00 H new ATOM 0 HG13 VAL A 64 0.516 3.448 8.270 1.00 0.00 H new ATOM 0 HG21 VAL A 64 3.044 3.375 6.544 1.00 0.00 H new ATOM 0 HG22 VAL A 64 2.791 4.416 7.964 1.00 0.00 H new ATOM 0 HG23 VAL A 64 4.213 3.349 7.886 1.00 0.00 H new ATOM 988 N LYS A 65 0.986 0.899 10.888 1.00 0.00 N ATOM 989 CA LYS A 65 0.596 -0.349 11.540 1.00 0.00 C ATOM 990 C LYS A 65 -0.903 -0.580 11.374 1.00 0.00 C ATOM 991 O LYS A 65 -1.711 -0.022 12.115 1.00 0.00 O ATOM 992 CB LYS A 65 0.974 -0.290 13.026 1.00 0.00 C ATOM 993 CG LYS A 65 0.480 -1.550 13.758 1.00 0.00 C ATOM 994 CD LYS A 65 -0.626 -1.195 14.762 1.00 0.00 C ATOM 995 CE LYS A 65 -1.465 -2.438 15.043 1.00 0.00 C ATOM 996 NZ LYS A 65 -2.407 -2.163 16.164 1.00 0.00 N ATOM 0 H LYS A 65 0.232 1.579 10.789 1.00 0.00 H new ATOM 0 HA LYS A 65 1.123 -1.182 11.075 1.00 0.00 H new ATOM 0 HB2 LYS A 65 2.056 -0.203 13.129 1.00 0.00 H new ATOM 0 HB3 LYS A 65 0.538 0.598 13.483 1.00 0.00 H new ATOM 0 HG2 LYS A 65 0.103 -2.273 13.034 1.00 0.00 H new ATOM 0 HG3 LYS A 65 1.312 -2.024 14.278 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -0.188 -0.821 15.687 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -1.255 -0.400 14.362 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -2.021 -2.724 14.150 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -0.817 -3.277 15.297 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -2.978 -3.011 16.354 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -1.868 -1.911 17.017 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -3.034 -1.375 15.905 1.00 0.00 H new ATOM 1010 N ALA A 66 -1.262 -1.386 10.375 1.00 0.00 N ATOM 1011 CA ALA A 66 -2.657 -1.662 10.097 1.00 0.00 C ATOM 1012 C ALA A 66 -2.992 -3.102 10.424 1.00 0.00 C ATOM 1013 O ALA A 66 -2.113 -3.963 10.479 1.00 0.00 O ATOM 1014 CB ALA A 66 -2.957 -1.389 8.622 1.00 0.00 C ATOM 0 H ALA A 66 -0.604 -1.854 9.752 1.00 0.00 H new ATOM 0 HA ALA A 66 -3.268 -1.010 10.721 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -4.007 -1.598 8.420 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -2.745 -0.344 8.395 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -2.333 -2.030 7.999 1.00 0.00 H new ATOM 1020 N VAL A 67 -4.272 -3.346 10.632 1.00 0.00 N ATOM 1021 CA VAL A 67 -4.748 -4.678 10.945 1.00 0.00 C ATOM 1022 C VAL A 67 -5.809 -5.094 9.944 1.00 0.00 C ATOM 1023 O VAL A 67 -6.812 -4.409 9.754 1.00 0.00 O ATOM 1024 CB VAL A 67 -5.321 -4.731 12.361 1.00 0.00 C ATOM 1025 CG1 VAL A 67 -5.374 -6.188 12.822 1.00 0.00 C ATOM 1026 CG2 VAL A 67 -4.422 -3.933 13.307 1.00 0.00 C ATOM 0 H VAL A 67 -5.003 -2.635 10.589 1.00 0.00 H new ATOM 0 HA VAL A 67 -3.906 -5.367 10.888 1.00 0.00 H new ATOM 0 HB VAL A 67 -6.323 -4.303 12.368 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -5.782 -6.236 13.832 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -6.010 -6.760 12.147 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -4.368 -6.608 12.817 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -4.831 -3.971 14.317 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -3.420 -4.362 13.305 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -4.373 -2.896 12.974 1.00 0.00 H new ATOM 1036 N LEU A 68 -5.568 -6.221 9.305 1.00 0.00 N ATOM 1037 CA LEU A 68 -6.487 -6.743 8.312 1.00 0.00 C ATOM 1038 C LEU A 68 -7.497 -7.662 8.973 1.00 0.00 C ATOM 1039 O LEU A 68 -7.291 -8.874 9.031 1.00 0.00 O ATOM 1040 CB LEU A 68 -5.704 -7.532 7.267 1.00 0.00 C ATOM 1041 CG LEU A 68 -4.585 -6.661 6.693 1.00 0.00 C ATOM 1042 CD1 LEU A 68 -3.815 -7.458 5.644 1.00 0.00 C ATOM 1043 CD2 LEU A 68 -5.193 -5.422 6.036 1.00 0.00 C ATOM 0 H LEU A 68 -4.739 -6.796 9.456 1.00 0.00 H new ATOM 0 HA LEU A 68 -7.011 -5.913 7.838 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -5.283 -8.431 7.717 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -6.371 -7.857 6.468 1.00 0.00 H new ATOM 0 HG LEU A 68 -3.911 -6.358 7.494 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -3.016 -6.841 5.232 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -3.385 -8.347 6.106 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -4.493 -7.756 4.844 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -4.397 -4.800 5.626 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -5.864 -5.728 5.233 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -5.752 -4.853 6.779 1.00 0.00 H new ATOM 1055 N GLU A 69 -8.585 -7.095 9.474 1.00 0.00 N ATOM 1056 CA GLU A 69 -9.600 -7.906 10.121 1.00 0.00 C ATOM 1057 C GLU A 69 -10.405 -8.655 9.072 1.00 0.00 C ATOM 1058 O GLU A 69 -10.896 -8.058 8.114 1.00 0.00 O ATOM 1059 CB GLU A 69 -10.528 -7.017 10.950 1.00 0.00 C ATOM 1060 CG GLU A 69 -9.738 -6.379 12.094 1.00 0.00 C ATOM 1061 CD GLU A 69 -9.490 -7.406 13.193 1.00 0.00 C ATOM 1062 OE1 GLU A 69 -10.445 -8.034 13.615 1.00 0.00 O ATOM 1063 OE2 GLU A 69 -8.347 -7.547 13.597 1.00 0.00 O ATOM 0 H GLU A 69 -8.784 -6.095 9.445 1.00 0.00 H new ATOM 0 HA GLU A 69 -9.114 -8.625 10.781 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -10.965 -6.242 10.320 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -11.353 -7.607 11.349 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -8.788 -5.996 11.722 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -10.288 -5.529 12.497 1.00 0.00 H new ATOM 1070 N LYS A 70 -10.535 -9.963 9.259 1.00 0.00 N ATOM 1071 CA LYS A 70 -11.288 -10.793 8.319 1.00 0.00 C ATOM 1072 C LYS A 70 -12.762 -10.405 8.288 1.00 0.00 C ATOM 1073 O LYS A 70 -13.375 -10.167 9.329 1.00 0.00 O ATOM 1074 CB LYS A 70 -11.186 -12.264 8.721 1.00 0.00 C ATOM 1075 CG LYS A 70 -10.993 -13.127 7.472 1.00 0.00 C ATOM 1076 CD LYS A 70 -10.930 -14.602 7.872 1.00 0.00 C ATOM 1077 CE LYS A 70 -12.339 -15.199 7.850 1.00 0.00 C ATOM 1078 NZ LYS A 70 -12.752 -15.442 6.438 1.00 0.00 N ATOM 0 H LYS A 70 -10.133 -10.472 10.046 1.00 0.00 H new ATOM 0 HA LYS A 70 -10.858 -10.636 7.330 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -10.350 -12.407 9.406 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -12.088 -12.570 9.250 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -11.814 -12.964 6.774 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -10.076 -12.840 6.957 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -10.282 -15.148 7.187 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -10.497 -14.701 8.867 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -12.359 -16.133 8.412 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -13.041 -14.520 8.334 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -13.538 -16.122 6.418 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -13.058 -14.546 6.007 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -11.948 -15.827 5.902 1.00 0.00 H new ATOM 1092 N THR A 71 -13.327 -10.364 7.084 1.00 0.00 N ATOM 1093 CA THR A 71 -14.736 -10.028 6.914 1.00 0.00 C ATOM 1094 C THR A 71 -15.504 -11.260 6.445 1.00 0.00 C ATOM 1095 O THR A 71 -14.936 -12.347 6.327 1.00 0.00 O ATOM 1096 CB THR A 71 -14.896 -8.914 5.879 1.00 0.00 C ATOM 1097 OG1 THR A 71 -14.444 -9.381 4.618 1.00 0.00 O ATOM 1098 CG2 THR A 71 -14.076 -7.692 6.299 1.00 0.00 C ATOM 0 H THR A 71 -12.831 -10.559 6.214 1.00 0.00 H new ATOM 0 HA THR A 71 -15.131 -9.687 7.871 1.00 0.00 H new ATOM 0 HB THR A 71 -15.946 -8.630 5.811 1.00 0.00 H new ATOM 0 HG1 THR A 71 -13.465 -9.431 4.619 1.00 0.00 H new ATOM 0 HG21 THR A 71 -14.194 -6.902 5.557 1.00 0.00 H new ATOM 0 HG22 THR A 71 -14.425 -7.335 7.268 1.00 0.00 H new ATOM 0 HG23 THR A 71 -13.024 -7.967 6.371 1.00 0.00 H new ATOM 1106 N ASP A 72 -16.791 -11.088 6.177 1.00 0.00 N ATOM 1107 CA ASP A 72 -17.617 -12.200 5.720 1.00 0.00 C ATOM 1108 C ASP A 72 -17.303 -12.549 4.267 1.00 0.00 C ATOM 1109 O ASP A 72 -18.027 -13.321 3.638 1.00 0.00 O ATOM 1110 CB ASP A 72 -19.097 -11.836 5.850 1.00 0.00 C ATOM 1111 CG ASP A 72 -19.470 -11.683 7.320 1.00 0.00 C ATOM 1112 OD1 ASP A 72 -18.649 -11.181 8.070 1.00 0.00 O ATOM 1113 OD2 ASP A 72 -20.572 -12.070 7.676 1.00 0.00 O ATOM 0 H ASP A 72 -17.283 -10.199 6.266 1.00 0.00 H new ATOM 0 HA ASP A 72 -17.397 -13.068 6.342 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -19.300 -10.907 5.317 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -19.712 -12.609 5.389 1.00 0.00 H new ATOM 1118 N GLU A 73 -16.223 -11.977 3.737 1.00 0.00 N ATOM 1119 CA GLU A 73 -15.831 -12.238 2.354 1.00 0.00 C ATOM 1120 C GLU A 73 -14.309 -12.446 2.257 1.00 0.00 C ATOM 1121 O GLU A 73 -13.551 -11.481 2.331 1.00 0.00 O ATOM 1122 CB GLU A 73 -16.235 -11.054 1.469 1.00 0.00 C ATOM 1123 CG GLU A 73 -17.318 -10.230 2.170 1.00 0.00 C ATOM 1124 CD GLU A 73 -17.832 -9.144 1.232 1.00 0.00 C ATOM 1125 OE1 GLU A 73 -17.534 -9.216 0.051 1.00 0.00 O ATOM 1126 OE2 GLU A 73 -18.518 -8.254 1.708 1.00 0.00 O ATOM 0 H GLU A 73 -15.609 -11.336 4.239 1.00 0.00 H new ATOM 0 HA GLU A 73 -16.337 -13.142 2.015 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -15.366 -10.429 1.262 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -16.604 -11.415 0.509 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -18.140 -10.878 2.475 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -16.914 -9.779 3.076 1.00 0.00 H new ATOM 1133 N PRO A 74 -13.835 -13.665 2.100 1.00 0.00 N ATOM 1134 CA PRO A 74 -12.367 -13.938 2.002 1.00 0.00 C ATOM 1135 C PRO A 74 -11.656 -13.008 1.018 1.00 0.00 C ATOM 1136 O PRO A 74 -12.161 -12.729 -0.070 1.00 0.00 O ATOM 1137 CB PRO A 74 -12.297 -15.389 1.527 1.00 0.00 C ATOM 1138 CG PRO A 74 -13.567 -16.016 1.989 1.00 0.00 C ATOM 1139 CD PRO A 74 -14.622 -14.910 2.002 1.00 0.00 C ATOM 0 HA PRO A 74 -11.863 -13.768 2.954 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -12.203 -15.444 0.442 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -11.431 -15.899 1.948 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -13.864 -16.826 1.323 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -13.447 -16.448 2.982 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -15.230 -14.928 1.097 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -15.303 -15.019 2.846 1.00 0.00 H new ATOM 1147 N GLY A 75 -10.473 -12.538 1.414 1.00 0.00 N ATOM 1148 CA GLY A 75 -9.684 -11.645 0.565 1.00 0.00 C ATOM 1149 C GLY A 75 -10.118 -10.198 0.738 1.00 0.00 C ATOM 1150 O GLY A 75 -9.599 -9.302 0.077 1.00 0.00 O ATOM 0 H GLY A 75 -10.042 -12.759 2.312 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -8.627 -11.743 0.813 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -9.795 -11.939 -0.479 1.00 0.00 H new ATOM 1154 N LYS A 76 -11.049 -9.985 1.648 1.00 0.00 N ATOM 1155 CA LYS A 76 -11.545 -8.649 1.936 1.00 0.00 C ATOM 1156 C LYS A 76 -11.405 -8.382 3.423 1.00 0.00 C ATOM 1157 O LYS A 76 -12.160 -8.928 4.226 1.00 0.00 O ATOM 1158 CB LYS A 76 -13.017 -8.538 1.526 1.00 0.00 C ATOM 1159 CG LYS A 76 -13.491 -7.089 1.661 1.00 0.00 C ATOM 1160 CD LYS A 76 -14.836 -7.066 2.390 1.00 0.00 C ATOM 1161 CE LYS A 76 -15.400 -5.647 2.379 1.00 0.00 C ATOM 1162 NZ LYS A 76 -16.803 -5.666 2.880 1.00 0.00 N ATOM 0 H LYS A 76 -11.480 -10.723 2.204 1.00 0.00 H new ATOM 0 HA LYS A 76 -10.968 -7.915 1.373 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -13.143 -8.876 0.497 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -13.627 -9.189 2.152 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -12.755 -6.503 2.212 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -13.590 -6.633 0.676 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -15.534 -7.750 1.907 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -14.711 -7.411 3.417 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -14.788 -4.996 3.004 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -15.369 -5.240 1.368 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -17.285 -4.789 2.596 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -17.305 -6.483 2.477 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -16.800 -5.739 3.917 1.00 0.00 H new ATOM 1176 N TYR A 77 -10.441 -7.542 3.786 1.00 0.00 N ATOM 1177 CA TYR A 77 -10.228 -7.221 5.192 1.00 0.00 C ATOM 1178 C TYR A 77 -10.533 -5.762 5.450 1.00 0.00 C ATOM 1179 O TYR A 77 -10.647 -4.973 4.518 1.00 0.00 O ATOM 1180 CB TYR A 77 -8.779 -7.497 5.590 1.00 0.00 C ATOM 1181 CG TYR A 77 -8.396 -8.914 5.238 1.00 0.00 C ATOM 1182 CD1 TYR A 77 -8.065 -9.245 3.920 1.00 0.00 C ATOM 1183 CD2 TYR A 77 -8.351 -9.893 6.237 1.00 0.00 C ATOM 1184 CE1 TYR A 77 -7.690 -10.555 3.600 1.00 0.00 C ATOM 1185 CE2 TYR A 77 -7.980 -11.203 5.917 1.00 0.00 C ATOM 1186 CZ TYR A 77 -7.648 -11.534 4.599 1.00 0.00 C ATOM 1187 OH TYR A 77 -7.278 -12.826 4.284 1.00 0.00 O ATOM 0 H TYR A 77 -9.805 -7.078 3.138 1.00 0.00 H new ATOM 0 HA TYR A 77 -10.895 -7.847 5.784 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -8.116 -6.797 5.081 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -8.652 -7.335 6.660 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -8.099 -8.490 3.149 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -8.603 -9.637 7.256 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -7.433 -10.810 2.582 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -7.950 -11.959 6.688 1.00 0.00 H new ATOM 0 HH TYR A 77 -7.300 -13.379 5.093 1.00 0.00 H new ATOM 1197 N THR A 78 -10.647 -5.407 6.725 1.00 0.00 N ATOM 1198 CA THR A 78 -10.919 -4.025 7.097 1.00 0.00 C ATOM 1199 C THR A 78 -9.981 -3.579 8.203 1.00 0.00 C ATOM 1200 O THR A 78 -9.459 -4.403 8.955 1.00 0.00 O ATOM 1201 CB THR A 78 -12.361 -3.861 7.574 1.00 0.00 C ATOM 1202 OG1 THR A 78 -12.839 -5.095 8.084 1.00 0.00 O ATOM 1203 CG2 THR A 78 -13.229 -3.412 6.405 1.00 0.00 C ATOM 0 H THR A 78 -10.556 -6.051 7.511 1.00 0.00 H new ATOM 0 HA THR A 78 -10.762 -3.408 6.212 1.00 0.00 H new ATOM 0 HB THR A 78 -12.402 -3.111 8.364 1.00 0.00 H new ATOM 0 HG1 THR A 78 -13.763 -4.986 8.391 1.00 0.00 H new ATOM 0 HG21 THR A 78 -14.259 -3.294 6.741 1.00 0.00 H new ATOM 0 HG22 THR A 78 -12.860 -2.460 6.023 1.00 0.00 H new ATOM 0 HG23 THR A 78 -13.189 -4.161 5.614 1.00 0.00 H new ATOM 1211 N ALA A 79 -9.776 -2.274 8.310 1.00 0.00 N ATOM 1212 CA ALA A 79 -8.900 -1.754 9.348 1.00 0.00 C ATOM 1213 C ALA A 79 -9.699 -1.375 10.595 1.00 0.00 C ATOM 1214 O ALA A 79 -9.735 -0.209 10.988 1.00 0.00 O ATOM 1215 CB ALA A 79 -8.146 -0.530 8.832 1.00 0.00 C ATOM 0 H ALA A 79 -10.195 -1.569 7.704 1.00 0.00 H new ATOM 0 HA ALA A 79 -8.187 -2.535 9.614 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -7.493 -0.148 9.616 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -7.547 -0.810 7.965 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -8.859 0.243 8.545 1.00 0.00 H new ATOM 1221 N ASP A 80 -10.326 -2.370 11.219 1.00 0.00 N ATOM 1222 CA ASP A 80 -11.112 -2.141 12.430 1.00 0.00 C ATOM 1223 C ASP A 80 -11.983 -0.893 12.315 1.00 0.00 C ATOM 1224 O ASP A 80 -12.012 -0.070 13.230 1.00 0.00 O ATOM 1225 CB ASP A 80 -10.180 -2.000 13.633 1.00 0.00 C ATOM 1226 CG ASP A 80 -9.536 -3.346 13.954 1.00 0.00 C ATOM 1227 OD1 ASP A 80 -10.225 -4.195 14.495 1.00 0.00 O ATOM 1228 OD2 ASP A 80 -8.365 -3.506 13.656 1.00 0.00 O ATOM 0 H ASP A 80 -10.305 -3.341 10.907 1.00 0.00 H new ATOM 0 HA ASP A 80 -11.770 -3.000 12.563 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -9.409 -1.260 13.421 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -10.739 -1.640 14.497 1.00 0.00 H new ATOM 1233 N GLY A 81 -12.691 -0.748 11.198 1.00 0.00 N ATOM 1234 CA GLY A 81 -13.543 0.412 11.008 1.00 0.00 C ATOM 1235 C GLY A 81 -12.706 1.593 10.566 1.00 0.00 C ATOM 1236 O GLY A 81 -13.008 2.743 10.886 1.00 0.00 O ATOM 0 H GLY A 81 -12.690 -1.411 10.423 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -14.307 0.196 10.261 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -14.063 0.649 11.936 1.00 0.00 H new ATOM 1240 N GLY A 82 -11.652 1.296 9.820 1.00 0.00 N ATOM 1241 CA GLY A 82 -10.771 2.342 9.324 1.00 0.00 C ATOM 1242 C GLY A 82 -11.135 2.668 7.892 1.00 0.00 C ATOM 1243 O GLY A 82 -10.270 2.988 7.078 1.00 0.00 O ATOM 0 H GLY A 82 -11.388 0.349 9.547 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -10.860 3.233 9.945 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -9.733 2.016 9.382 1.00 0.00 H new ATOM 1247 N LYS A 83 -12.439 2.604 7.615 1.00 0.00 N ATOM 1248 CA LYS A 83 -12.969 2.906 6.285 1.00 0.00 C ATOM 1249 C LYS A 83 -11.990 2.472 5.194 1.00 0.00 C ATOM 1250 O LYS A 83 -11.983 3.020 4.090 1.00 0.00 O ATOM 1251 CB LYS A 83 -13.276 4.408 6.165 1.00 0.00 C ATOM 1252 CG LYS A 83 -12.345 5.220 7.074 1.00 0.00 C ATOM 1253 CD LYS A 83 -12.671 6.707 6.942 1.00 0.00 C ATOM 1254 CE LYS A 83 -13.418 7.180 8.192 1.00 0.00 C ATOM 1255 NZ LYS A 83 -14.554 6.257 8.473 1.00 0.00 N ATOM 0 H LYS A 83 -13.150 2.344 8.299 1.00 0.00 H new ATOM 0 HA LYS A 83 -13.894 2.346 6.150 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -13.154 4.729 5.130 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -14.315 4.596 6.437 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -12.463 4.902 8.110 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -11.305 5.039 6.801 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -11.753 7.281 6.815 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -13.280 6.879 6.055 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -12.740 7.209 9.045 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -13.788 8.195 8.045 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -15.178 6.682 9.189 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -15.092 6.093 7.598 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -14.186 5.352 8.828 1.00 0.00 H new ATOM 1269 N HIS A 84 -11.164 1.483 5.517 1.00 0.00 N ATOM 1270 CA HIS A 84 -10.183 0.972 4.587 1.00 0.00 C ATOM 1271 C HIS A 84 -10.408 -0.507 4.380 1.00 0.00 C ATOM 1272 O HIS A 84 -10.406 -1.281 5.336 1.00 0.00 O ATOM 1273 CB HIS A 84 -8.769 1.211 5.121 1.00 0.00 C ATOM 1274 CG HIS A 84 -8.333 2.612 4.791 1.00 0.00 C ATOM 1275 ND1 HIS A 84 -8.739 3.255 3.634 1.00 0.00 N ATOM 1276 CD2 HIS A 84 -7.527 3.503 5.452 1.00 0.00 C ATOM 1277 CE1 HIS A 84 -8.181 4.479 3.633 1.00 0.00 C ATOM 1278 NE2 HIS A 84 -7.432 4.683 4.720 1.00 0.00 N ATOM 0 H HIS A 84 -11.161 1.020 6.426 1.00 0.00 H new ATOM 0 HA HIS A 84 -10.290 1.494 3.636 1.00 0.00 H new ATOM 0 HB2 HIS A 84 -8.746 1.057 6.200 1.00 0.00 H new ATOM 0 HB3 HIS A 84 -8.078 0.492 4.682 1.00 0.00 H new ATOM 0 HD2 HIS A 84 -7.040 3.317 6.398 1.00 0.00 H new ATOM 0 HE1 HIS A 84 -8.322 5.208 2.849 1.00 0.00 H new ATOM 0 HE2 HIS A 84 -6.905 5.522 4.961 1.00 0.00 H new ATOM 1286 N VAL A 85 -10.586 -0.890 3.127 1.00 0.00 N ATOM 1287 CA VAL A 85 -10.799 -2.288 2.798 1.00 0.00 C ATOM 1288 C VAL A 85 -9.602 -2.826 2.034 1.00 0.00 C ATOM 1289 O VAL A 85 -9.405 -2.505 0.863 1.00 0.00 O ATOM 1290 CB VAL A 85 -12.050 -2.460 1.950 1.00 0.00 C ATOM 1291 CG1 VAL A 85 -12.467 -3.931 1.961 1.00 0.00 C ATOM 1292 CG2 VAL A 85 -13.180 -1.598 2.520 1.00 0.00 C ATOM 0 H VAL A 85 -10.587 -0.258 2.327 1.00 0.00 H new ATOM 0 HA VAL A 85 -10.925 -2.841 3.729 1.00 0.00 H new ATOM 0 HB VAL A 85 -11.844 -2.147 0.926 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -13.363 -4.060 1.354 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -11.661 -4.541 1.552 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -12.674 -4.243 2.985 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -14.075 -1.723 1.911 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -13.392 -1.906 3.544 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -12.878 -0.551 2.511 1.00 0.00 H new ATOM 1302 N ALA A 86 -8.788 -3.615 2.714 1.00 0.00 N ATOM 1303 CA ALA A 86 -7.593 -4.151 2.101 1.00 0.00 C ATOM 1304 C ALA A 86 -7.813 -5.539 1.538 1.00 0.00 C ATOM 1305 O ALA A 86 -8.502 -6.367 2.133 1.00 0.00 O ATOM 1306 CB ALA A 86 -6.453 -4.181 3.113 1.00 0.00 C ATOM 0 H ALA A 86 -8.934 -3.895 3.684 1.00 0.00 H new ATOM 0 HA ALA A 86 -7.333 -3.495 1.271 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -5.558 -4.586 2.641 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -6.251 -3.169 3.464 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -6.733 -4.809 3.958 1.00 0.00 H new ATOM 1312 N TYR A 87 -7.190 -5.780 0.392 1.00 0.00 N ATOM 1313 CA TYR A 87 -7.277 -7.069 -0.260 1.00 0.00 C ATOM 1314 C TYR A 87 -5.877 -7.627 -0.462 1.00 0.00 C ATOM 1315 O TYR A 87 -4.971 -6.914 -0.900 1.00 0.00 O ATOM 1316 CB TYR A 87 -7.961 -6.958 -1.623 1.00 0.00 C ATOM 1317 CG TYR A 87 -9.385 -6.492 -1.467 1.00 0.00 C ATOM 1318 CD1 TYR A 87 -9.650 -5.162 -1.120 1.00 0.00 C ATOM 1319 CD2 TYR A 87 -10.440 -7.383 -1.694 1.00 0.00 C ATOM 1320 CE1 TYR A 87 -10.972 -4.722 -0.997 1.00 0.00 C ATOM 1321 CE2 TYR A 87 -11.764 -6.942 -1.567 1.00 0.00 C ATOM 1322 CZ TYR A 87 -12.029 -5.610 -1.221 1.00 0.00 C ATOM 1323 OH TYR A 87 -13.332 -5.172 -1.105 1.00 0.00 O ATOM 0 H TYR A 87 -6.619 -5.094 -0.102 1.00 0.00 H new ATOM 0 HA TYR A 87 -7.868 -7.729 0.375 1.00 0.00 H new ATOM 0 HB2 TYR A 87 -7.412 -6.260 -2.255 1.00 0.00 H new ATOM 0 HB3 TYR A 87 -7.942 -7.925 -2.125 1.00 0.00 H new ATOM 0 HD1 TYR A 87 -8.834 -4.476 -0.947 1.00 0.00 H new ATOM 0 HD2 TYR A 87 -10.234 -8.408 -1.966 1.00 0.00 H new ATOM 0 HE1 TYR A 87 -11.177 -3.696 -0.729 1.00 0.00 H new ATOM 0 HE2 TYR A 87 -12.580 -7.629 -1.736 1.00 0.00 H new ATOM 0 HH TYR A 87 -13.935 -5.825 -1.518 1.00 0.00 H new ATOM 1333 N ILE A 88 -5.713 -8.899 -0.142 1.00 0.00 N ATOM 1334 CA ILE A 88 -4.419 -9.557 -0.291 1.00 0.00 C ATOM 1335 C ILE A 88 -4.482 -10.600 -1.391 1.00 0.00 C ATOM 1336 O ILE A 88 -5.243 -11.564 -1.298 1.00 0.00 O ATOM 1337 CB ILE A 88 -4.010 -10.223 1.019 1.00 0.00 C ATOM 1338 CG1 ILE A 88 -4.532 -9.398 2.191 1.00 0.00 C ATOM 1339 CG2 ILE A 88 -2.483 -10.304 1.099 1.00 0.00 C ATOM 1340 CD1 ILE A 88 -4.006 -9.997 3.490 1.00 0.00 C ATOM 0 H ILE A 88 -6.454 -9.498 0.222 1.00 0.00 H new ATOM 0 HA ILE A 88 -3.679 -8.802 -0.556 1.00 0.00 H new ATOM 0 HB ILE A 88 -4.430 -11.228 1.060 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -4.209 -8.361 2.096 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -5.622 -9.393 2.192 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -2.192 -10.780 2.036 1.00 0.00 H new ATOM 0 HG22 ILE A 88 -2.105 -10.890 0.261 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -2.063 -9.299 1.057 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -4.374 -9.414 4.335 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -4.351 -11.027 3.582 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -2.916 -9.979 3.484 1.00 0.00 H new ATOM 1352 N ILE A 89 -3.678 -10.401 -2.430 1.00 0.00 N ATOM 1353 CA ILE A 89 -3.648 -11.328 -3.546 1.00 0.00 C ATOM 1354 C ILE A 89 -2.257 -11.932 -3.700 1.00 0.00 C ATOM 1355 O ILE A 89 -1.255 -11.311 -3.344 1.00 0.00 O ATOM 1356 CB ILE A 89 -4.024 -10.615 -4.849 1.00 0.00 C ATOM 1357 CG1 ILE A 89 -4.582 -9.214 -4.552 1.00 0.00 C ATOM 1358 CG2 ILE A 89 -5.071 -11.439 -5.608 1.00 0.00 C ATOM 1359 CD1 ILE A 89 -5.850 -9.314 -3.710 1.00 0.00 C ATOM 0 H ILE A 89 -3.042 -9.608 -2.519 1.00 0.00 H new ATOM 0 HA ILE A 89 -4.370 -12.119 -3.342 1.00 0.00 H new ATOM 0 HB ILE A 89 -3.129 -10.513 -5.463 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -3.834 -8.622 -4.025 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -4.798 -8.696 -5.486 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -5.335 -10.928 -6.534 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -4.662 -12.422 -5.840 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -5.962 -11.554 -4.990 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -6.233 -8.314 -3.508 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -6.602 -9.888 -4.252 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -5.623 -9.812 -2.768 1.00 0.00 H new ATOM 1371 N ARG A 90 -2.205 -13.131 -4.258 1.00 0.00 N ATOM 1372 CA ARG A 90 -0.935 -13.806 -4.485 1.00 0.00 C ATOM 1373 C ARG A 90 -0.482 -13.575 -5.922 1.00 0.00 C ATOM 1374 O ARG A 90 -1.008 -14.188 -6.850 1.00 0.00 O ATOM 1375 CB ARG A 90 -1.066 -15.312 -4.226 1.00 0.00 C ATOM 1376 CG ARG A 90 -2.374 -15.611 -3.482 1.00 0.00 C ATOM 1377 CD ARG A 90 -3.570 -15.555 -4.444 1.00 0.00 C ATOM 1378 NE ARG A 90 -3.185 -14.984 -5.731 1.00 0.00 N ATOM 1379 CZ ARG A 90 -3.968 -15.105 -6.797 1.00 0.00 C ATOM 1380 NH1 ARG A 90 -3.602 -14.586 -7.937 1.00 0.00 N ATOM 1381 NH2 ARG A 90 -5.103 -15.742 -6.705 1.00 0.00 N ATOM 0 H ARG A 90 -3.025 -13.657 -4.562 1.00 0.00 H new ATOM 0 HA ARG A 90 -0.197 -13.396 -3.795 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -1.045 -15.854 -5.171 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -0.217 -15.662 -3.639 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -2.318 -16.597 -3.020 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -2.514 -14.889 -2.677 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -3.968 -16.559 -4.593 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -4.368 -14.958 -4.002 1.00 0.00 H new ATOM 0 HE ARG A 90 -2.300 -14.484 -5.813 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -2.715 -14.088 -8.009 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -4.203 -14.679 -8.756 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -5.390 -16.147 -5.814 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -5.704 -15.834 -7.524 1.00 0.00 H new ATOM 1395 N SER A 91 0.490 -12.686 -6.099 1.00 0.00 N ATOM 1396 CA SER A 91 1.000 -12.383 -7.429 1.00 0.00 C ATOM 1397 C SER A 91 1.134 -13.654 -8.255 1.00 0.00 C ATOM 1398 O SER A 91 1.115 -14.762 -7.720 1.00 0.00 O ATOM 1399 CB SER A 91 2.363 -11.700 -7.322 1.00 0.00 C ATOM 1400 OG SER A 91 3.365 -12.565 -7.839 1.00 0.00 O ATOM 0 H SER A 91 0.937 -12.167 -5.343 1.00 0.00 H new ATOM 0 HA SER A 91 0.294 -11.715 -7.923 1.00 0.00 H new ATOM 0 HB2 SER A 91 2.356 -10.761 -7.876 1.00 0.00 H new ATOM 0 HB3 SER A 91 2.579 -11.455 -6.282 1.00 0.00 H new ATOM 0 HG SER A 91 3.452 -13.349 -7.258 1.00 0.00 H new ATOM 1406 N HIS A 92 1.278 -13.482 -9.561 1.00 0.00 N ATOM 1407 CA HIS A 92 1.425 -14.620 -10.456 1.00 0.00 C ATOM 1408 C HIS A 92 2.811 -15.229 -10.298 1.00 0.00 C ATOM 1409 O HIS A 92 3.117 -16.268 -10.881 1.00 0.00 O ATOM 1410 CB HIS A 92 1.217 -14.179 -11.905 1.00 0.00 C ATOM 1411 CG HIS A 92 -0.225 -13.800 -12.111 1.00 0.00 C ATOM 1412 ND1 HIS A 92 -1.053 -13.447 -11.057 1.00 0.00 N ATOM 1413 CD2 HIS A 92 -0.998 -13.715 -13.242 1.00 0.00 C ATOM 1414 CE1 HIS A 92 -2.265 -13.167 -11.572 1.00 0.00 C ATOM 1415 NE2 HIS A 92 -2.286 -13.314 -12.898 1.00 0.00 N ATOM 0 H HIS A 92 1.296 -12.572 -10.022 1.00 0.00 H new ATOM 0 HA HIS A 92 0.674 -15.368 -10.201 1.00 0.00 H new ATOM 0 HB2 HIS A 92 1.863 -13.332 -12.135 1.00 0.00 H new ATOM 0 HB3 HIS A 92 1.493 -14.985 -12.585 1.00 0.00 H new ATOM 0 HD2 HIS A 92 -0.659 -13.927 -14.245 1.00 0.00 H new ATOM 0 HE1 HIS A 92 -3.117 -12.861 -10.983 1.00 0.00 H new ATOM 0 HE2 HIS A 92 -3.076 -13.165 -13.525 1.00 0.00 H new ATOM 1423 N VAL A 93 3.645 -14.568 -9.498 1.00 0.00 N ATOM 1424 CA VAL A 93 5.003 -15.038 -9.255 1.00 0.00 C ATOM 1425 C VAL A 93 5.153 -15.501 -7.810 1.00 0.00 C ATOM 1426 O VAL A 93 4.369 -15.119 -6.941 1.00 0.00 O ATOM 1427 CB VAL A 93 6.003 -13.917 -9.543 1.00 0.00 C ATOM 1428 CG1 VAL A 93 7.426 -14.420 -9.293 1.00 0.00 C ATOM 1429 CG2 VAL A 93 5.867 -13.476 -11.003 1.00 0.00 C ATOM 0 H VAL A 93 3.403 -13.707 -9.009 1.00 0.00 H new ATOM 0 HA VAL A 93 5.204 -15.879 -9.918 1.00 0.00 H new ATOM 0 HB VAL A 93 5.798 -13.072 -8.886 1.00 0.00 H new ATOM 0 HG11 VAL A 93 8.136 -13.619 -9.499 1.00 0.00 H new ATOM 0 HG12 VAL A 93 7.524 -14.733 -8.254 1.00 0.00 H new ATOM 0 HG13 VAL A 93 7.633 -15.266 -9.948 1.00 0.00 H new ATOM 0 HG21 VAL A 93 6.579 -12.677 -11.210 1.00 0.00 H new ATOM 0 HG22 VAL A 93 6.071 -14.322 -11.659 1.00 0.00 H new ATOM 0 HG23 VAL A 93 4.854 -13.114 -11.181 1.00 0.00 H new ATOM 1439 N LYS A 94 6.161 -16.327 -7.560 1.00 0.00 N ATOM 1440 CA LYS A 94 6.402 -16.838 -6.216 1.00 0.00 C ATOM 1441 C LYS A 94 7.102 -15.791 -5.357 1.00 0.00 C ATOM 1442 O LYS A 94 7.844 -14.950 -5.864 1.00 0.00 O ATOM 1443 CB LYS A 94 7.260 -18.103 -6.285 1.00 0.00 C ATOM 1444 CG LYS A 94 6.952 -19.000 -5.083 1.00 0.00 C ATOM 1445 CD LYS A 94 5.807 -19.951 -5.435 1.00 0.00 C ATOM 1446 CE LYS A 94 5.415 -20.760 -4.198 1.00 0.00 C ATOM 1447 NZ LYS A 94 4.158 -21.511 -4.474 1.00 0.00 N ATOM 0 H LYS A 94 6.821 -16.656 -8.265 1.00 0.00 H new ATOM 0 HA LYS A 94 5.440 -17.075 -5.762 1.00 0.00 H new ATOM 0 HB2 LYS A 94 7.060 -18.640 -7.212 1.00 0.00 H new ATOM 0 HB3 LYS A 94 8.317 -17.837 -6.292 1.00 0.00 H new ATOM 0 HG2 LYS A 94 7.839 -19.569 -4.804 1.00 0.00 H new ATOM 0 HG3 LYS A 94 6.680 -18.390 -4.221 1.00 0.00 H new ATOM 0 HD2 LYS A 94 4.949 -19.385 -5.799 1.00 0.00 H new ATOM 0 HD3 LYS A 94 6.111 -20.621 -6.239 1.00 0.00 H new ATOM 0 HE2 LYS A 94 6.215 -21.452 -3.935 1.00 0.00 H new ATOM 0 HE3 LYS A 94 5.275 -20.096 -3.345 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 3.891 -22.061 -3.633 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 3.397 -20.841 -4.705 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 4.308 -22.155 -5.276 1.00 0.00 H new ATOM 1461 N ASP A 95 6.866 -15.855 -4.051 1.00 0.00 N ATOM 1462 CA ASP A 95 7.481 -14.913 -3.121 1.00 0.00 C ATOM 1463 C ASP A 95 7.025 -13.486 -3.410 1.00 0.00 C ATOM 1464 O ASP A 95 7.722 -12.527 -3.080 1.00 0.00 O ATOM 1465 CB ASP A 95 9.005 -14.993 -3.233 1.00 0.00 C ATOM 1466 CG ASP A 95 9.420 -16.379 -3.713 1.00 0.00 C ATOM 1467 OD1 ASP A 95 8.703 -17.324 -3.425 1.00 0.00 O ATOM 1468 OD2 ASP A 95 10.448 -16.478 -4.362 1.00 0.00 O ATOM 0 H ASP A 95 6.256 -16.546 -3.613 1.00 0.00 H new ATOM 0 HA ASP A 95 7.171 -15.180 -2.111 1.00 0.00 H new ATOM 0 HB2 ASP A 95 9.367 -14.235 -3.927 1.00 0.00 H new ATOM 0 HB3 ASP A 95 9.461 -14.783 -2.265 1.00 0.00 H new ATOM 1473 N HIS A 96 5.853 -13.352 -4.025 1.00 0.00 N ATOM 1474 CA HIS A 96 5.319 -12.032 -4.349 1.00 0.00 C ATOM 1475 C HIS A 96 3.833 -11.954 -4.014 1.00 0.00 C ATOM 1476 O HIS A 96 3.086 -12.907 -4.234 1.00 0.00 O ATOM 1477 CB HIS A 96 5.522 -11.740 -5.838 1.00 0.00 C ATOM 1478 CG HIS A 96 6.963 -11.389 -6.090 1.00 0.00 C ATOM 1479 ND1 HIS A 96 7.931 -12.355 -6.307 1.00 0.00 N ATOM 1480 CD2 HIS A 96 7.615 -10.183 -6.162 1.00 0.00 C ATOM 1481 CE1 HIS A 96 9.103 -11.722 -6.497 1.00 0.00 C ATOM 1482 NE2 HIS A 96 8.967 -10.396 -6.418 1.00 0.00 N ATOM 0 H HIS A 96 5.260 -14.133 -4.307 1.00 0.00 H new ATOM 0 HA HIS A 96 5.852 -11.290 -3.754 1.00 0.00 H new ATOM 0 HB2 HIS A 96 5.240 -12.610 -6.432 1.00 0.00 H new ATOM 0 HB3 HIS A 96 4.877 -10.918 -6.149 1.00 0.00 H new ATOM 0 HD1 HIS A 96 7.782 -13.364 -6.320 1.00 0.00 H new ATOM 0 HD2 HIS A 96 7.150 -9.216 -6.039 1.00 0.00 H new ATOM 0 HE1 HIS A 96 10.039 -12.225 -6.690 1.00 0.00 H new ATOM 1490 N TYR A 97 3.411 -10.809 -3.484 1.00 0.00 N ATOM 1491 CA TYR A 97 2.009 -10.615 -3.128 1.00 0.00 C ATOM 1492 C TYR A 97 1.545 -9.210 -3.476 1.00 0.00 C ATOM 1493 O TYR A 97 2.262 -8.233 -3.257 1.00 0.00 O ATOM 1494 CB TYR A 97 1.803 -10.861 -1.635 1.00 0.00 C ATOM 1495 CG TYR A 97 1.406 -12.296 -1.427 1.00 0.00 C ATOM 1496 CD1 TYR A 97 2.380 -13.293 -1.482 1.00 0.00 C ATOM 1497 CD2 TYR A 97 0.070 -12.630 -1.179 1.00 0.00 C ATOM 1498 CE1 TYR A 97 2.021 -14.633 -1.290 1.00 0.00 C ATOM 1499 CE2 TYR A 97 -0.292 -13.966 -0.989 1.00 0.00 C ATOM 1500 CZ TYR A 97 0.684 -14.970 -1.043 1.00 0.00 C ATOM 1501 OH TYR A 97 0.329 -16.290 -0.853 1.00 0.00 O ATOM 0 H TYR A 97 4.014 -10.008 -3.293 1.00 0.00 H new ATOM 0 HA TYR A 97 1.418 -11.330 -3.701 1.00 0.00 H new ATOM 0 HB2 TYR A 97 2.719 -10.640 -1.087 1.00 0.00 H new ATOM 0 HB3 TYR A 97 1.031 -10.196 -1.247 1.00 0.00 H new ATOM 0 HD1 TYR A 97 3.410 -13.032 -1.673 1.00 0.00 H new ATOM 0 HD2 TYR A 97 -0.681 -11.855 -1.134 1.00 0.00 H new ATOM 0 HE1 TYR A 97 2.774 -15.406 -1.332 1.00 0.00 H new ATOM 0 HE2 TYR A 97 -1.323 -14.225 -0.801 1.00 0.00 H new ATOM 0 HH TYR A 97 -0.636 -16.349 -0.692 1.00 0.00 H new ATOM 1511 N ILE A 98 0.334 -9.117 -4.009 1.00 0.00 N ATOM 1512 CA ILE A 98 -0.232 -7.840 -4.376 1.00 0.00 C ATOM 1513 C ILE A 98 -1.089 -7.355 -3.235 1.00 0.00 C ATOM 1514 O ILE A 98 -1.951 -8.089 -2.753 1.00 0.00 O ATOM 1515 CB ILE A 98 -1.097 -7.985 -5.628 1.00 0.00 C ATOM 1516 CG1 ILE A 98 -0.353 -8.823 -6.671 1.00 0.00 C ATOM 1517 CG2 ILE A 98 -1.423 -6.602 -6.200 1.00 0.00 C ATOM 1518 CD1 ILE A 98 1.049 -8.255 -6.887 1.00 0.00 C ATOM 0 H ILE A 98 -0.271 -9.917 -4.194 1.00 0.00 H new ATOM 0 HA ILE A 98 0.569 -7.131 -4.583 1.00 0.00 H new ATOM 0 HB ILE A 98 -2.029 -8.485 -5.366 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -0.288 -9.859 -6.339 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -0.904 -8.823 -7.611 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -2.040 -6.713 -7.092 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -1.964 -6.019 -5.455 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -0.497 -6.089 -6.461 1.00 0.00 H new ATOM 0 HD11 ILE A 98 1.574 -8.855 -7.630 1.00 0.00 H new ATOM 0 HD12 ILE A 98 0.974 -7.226 -7.238 1.00 0.00 H new ATOM 0 HD13 ILE A 98 1.600 -8.278 -5.947 1.00 0.00 H new ATOM 1530 N PHE A 99 -0.867 -6.128 -2.811 1.00 0.00 N ATOM 1531 CA PHE A 99 -1.646 -5.562 -1.732 1.00 0.00 C ATOM 1532 C PHE A 99 -2.451 -4.398 -2.280 1.00 0.00 C ATOM 1533 O PHE A 99 -1.908 -3.528 -2.961 1.00 0.00 O ATOM 1534 CB PHE A 99 -0.716 -5.088 -0.617 1.00 0.00 C ATOM 1535 CG PHE A 99 -1.532 -4.689 0.582 1.00 0.00 C ATOM 1536 CD1 PHE A 99 -1.618 -5.544 1.685 1.00 0.00 C ATOM 1537 CD2 PHE A 99 -2.203 -3.461 0.589 1.00 0.00 C ATOM 1538 CE1 PHE A 99 -2.373 -5.172 2.802 1.00 0.00 C ATOM 1539 CE2 PHE A 99 -2.960 -3.087 1.703 1.00 0.00 C ATOM 1540 CZ PHE A 99 -3.045 -3.942 2.811 1.00 0.00 C ATOM 0 H PHE A 99 -0.156 -5.506 -3.196 1.00 0.00 H new ATOM 0 HA PHE A 99 -2.321 -6.312 -1.320 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -0.019 -5.882 -0.348 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -0.119 -4.243 -0.961 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -1.101 -6.492 1.674 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -2.136 -2.803 -0.265 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -2.438 -5.831 3.655 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -3.479 -2.140 1.710 1.00 0.00 H new ATOM 0 HZ PHE A 99 -3.629 -3.653 3.672 1.00 0.00 H new ATOM 1550 N TYR A 100 -3.744 -4.398 -2.006 1.00 0.00 N ATOM 1551 CA TYR A 100 -4.618 -3.347 -2.507 1.00 0.00 C ATOM 1552 C TYR A 100 -5.496 -2.820 -1.384 1.00 0.00 C ATOM 1553 O TYR A 100 -5.798 -3.544 -0.442 1.00 0.00 O ATOM 1554 CB TYR A 100 -5.477 -3.931 -3.626 1.00 0.00 C ATOM 1555 CG TYR A 100 -6.457 -2.905 -4.127 1.00 0.00 C ATOM 1556 CD1 TYR A 100 -5.986 -1.757 -4.756 1.00 0.00 C ATOM 1557 CD2 TYR A 100 -7.834 -3.114 -3.984 1.00 0.00 C ATOM 1558 CE1 TYR A 100 -6.884 -0.806 -5.249 1.00 0.00 C ATOM 1559 CE2 TYR A 100 -8.737 -2.162 -4.471 1.00 0.00 C ATOM 1560 CZ TYR A 100 -8.261 -1.008 -5.107 1.00 0.00 C ATOM 1561 OH TYR A 100 -9.148 -0.071 -5.594 1.00 0.00 O ATOM 0 H TYR A 100 -4.212 -5.109 -1.443 1.00 0.00 H new ATOM 0 HA TYR A 100 -4.026 -2.516 -2.891 1.00 0.00 H new ATOM 0 HB2 TYR A 100 -4.840 -4.265 -4.445 1.00 0.00 H new ATOM 0 HB3 TYR A 100 -6.013 -4.807 -3.262 1.00 0.00 H new ATOM 0 HD1 TYR A 100 -4.923 -1.600 -4.864 1.00 0.00 H new ATOM 0 HD2 TYR A 100 -8.198 -4.008 -3.499 1.00 0.00 H new ATOM 0 HE1 TYR A 100 -6.515 0.083 -5.739 1.00 0.00 H new ATOM 0 HE2 TYR A 100 -9.800 -2.317 -4.357 1.00 0.00 H new ATOM 0 HH TYR A 100 -10.043 -0.466 -5.649 1.00 0.00 H new ATOM 1571 N SER A 101 -5.904 -1.557 -1.483 1.00 0.00 N ATOM 1572 CA SER A 101 -6.749 -0.974 -0.450 1.00 0.00 C ATOM 1573 C SER A 101 -7.624 0.136 -1.001 1.00 0.00 C ATOM 1574 O SER A 101 -7.218 0.867 -1.894 1.00 0.00 O ATOM 1575 CB SER A 101 -5.883 -0.429 0.687 1.00 0.00 C ATOM 1576 OG SER A 101 -6.056 0.979 0.775 1.00 0.00 O ATOM 0 H SER A 101 -5.668 -0.930 -2.252 1.00 0.00 H new ATOM 0 HA SER A 101 -7.401 -1.762 -0.073 1.00 0.00 H new ATOM 0 HB2 SER A 101 -6.161 -0.901 1.630 1.00 0.00 H new ATOM 0 HB3 SER A 101 -4.835 -0.668 0.508 1.00 0.00 H new ATOM 0 HG SER A 101 -5.504 1.332 1.504 1.00 0.00 H new ATOM 1582 N GLU A 102 -8.835 0.238 -0.458 1.00 0.00 N ATOM 1583 CA GLU A 102 -9.786 1.263 -0.885 1.00 0.00 C ATOM 1584 C GLU A 102 -10.329 2.008 0.324 1.00 0.00 C ATOM 1585 O GLU A 102 -10.606 1.412 1.361 1.00 0.00 O ATOM 1586 CB GLU A 102 -10.957 0.623 -1.635 1.00 0.00 C ATOM 1587 CG GLU A 102 -10.425 -0.284 -2.740 1.00 0.00 C ATOM 1588 CD GLU A 102 -11.412 -0.322 -3.902 1.00 0.00 C ATOM 1589 OE1 GLU A 102 -12.280 -1.178 -3.887 1.00 0.00 O ATOM 1590 OE2 GLU A 102 -11.290 0.512 -4.785 1.00 0.00 O ATOM 0 H GLU A 102 -9.182 -0.376 0.279 1.00 0.00 H new ATOM 0 HA GLU A 102 -9.265 1.958 -1.544 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -11.573 0.048 -0.944 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -11.595 1.397 -2.062 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -9.457 0.079 -3.086 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -10.268 -1.290 -2.352 1.00 0.00 H new ATOM 1597 N GLY A 103 -10.488 3.311 0.170 1.00 0.00 N ATOM 1598 CA GLY A 103 -11.007 4.146 1.242 1.00 0.00 C ATOM 1599 C GLY A 103 -11.291 5.550 0.733 1.00 0.00 C ATOM 1600 O GLY A 103 -11.652 5.735 -0.429 1.00 0.00 O ATOM 0 H GLY A 103 -10.265 3.815 -0.688 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -11.920 3.707 1.644 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -10.287 4.188 2.059 1.00 0.00 H new ATOM 1604 N GLU A 104 -11.127 6.533 1.606 1.00 0.00 N ATOM 1605 CA GLU A 104 -11.372 7.919 1.233 1.00 0.00 C ATOM 1606 C GLU A 104 -10.561 8.862 2.111 1.00 0.00 C ATOM 1607 O GLU A 104 -10.297 8.566 3.276 1.00 0.00 O ATOM 1608 CB GLU A 104 -12.858 8.244 1.364 1.00 0.00 C ATOM 1609 CG GLU A 104 -13.264 8.099 2.821 1.00 0.00 C ATOM 1610 CD GLU A 104 -14.771 7.894 2.932 1.00 0.00 C ATOM 1611 OE1 GLU A 104 -15.488 8.473 2.133 1.00 0.00 O ATOM 1612 OE2 GLU A 104 -15.186 7.161 3.815 1.00 0.00 O ATOM 0 H GLU A 104 -10.827 6.399 2.572 1.00 0.00 H new ATOM 0 HA GLU A 104 -11.065 8.054 0.196 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -13.055 9.258 1.017 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -13.448 7.573 0.739 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -12.741 7.254 3.269 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -12.969 8.988 3.378 1.00 0.00 H new ATOM 1619 N LEU A 105 -10.175 9.997 1.540 1.00 0.00 N ATOM 1620 CA LEU A 105 -9.399 10.989 2.273 1.00 0.00 C ATOM 1621 C LEU A 105 -10.066 12.350 2.161 1.00 0.00 C ATOM 1622 O LEU A 105 -9.938 13.039 1.150 1.00 0.00 O ATOM 1623 CB LEU A 105 -7.973 11.065 1.722 1.00 0.00 C ATOM 1624 CG LEU A 105 -6.998 11.364 2.863 1.00 0.00 C ATOM 1625 CD1 LEU A 105 -6.642 10.066 3.591 1.00 0.00 C ATOM 1626 CD2 LEU A 105 -5.724 11.994 2.294 1.00 0.00 C ATOM 0 H LEU A 105 -10.386 10.252 0.575 1.00 0.00 H new ATOM 0 HA LEU A 105 -9.355 10.693 3.321 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -7.708 10.124 1.240 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -7.907 11.842 0.961 1.00 0.00 H new ATOM 0 HG LEU A 105 -7.466 12.055 3.564 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -5.948 10.283 4.403 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -7.548 9.617 3.999 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -6.177 9.372 2.891 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -5.029 12.207 3.106 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -5.259 11.303 1.591 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -5.975 12.921 1.779 1.00 0.00 H new ATOM 1638 N HIS A 106 -10.785 12.724 3.211 1.00 0.00 N ATOM 1639 CA HIS A 106 -11.484 14.000 3.241 1.00 0.00 C ATOM 1640 C HIS A 106 -12.718 13.962 2.352 1.00 0.00 C ATOM 1641 O HIS A 106 -13.076 14.965 1.734 1.00 0.00 O ATOM 1642 CB HIS A 106 -10.558 15.134 2.789 1.00 0.00 C ATOM 1643 CG HIS A 106 -9.151 14.846 3.233 1.00 0.00 C ATOM 1644 ND1 HIS A 106 -8.825 14.638 4.563 1.00 0.00 N ATOM 1645 CD2 HIS A 106 -7.974 14.732 2.535 1.00 0.00 C ATOM 1646 CE1 HIS A 106 -7.500 14.413 4.625 1.00 0.00 C ATOM 1647 NE2 HIS A 106 -6.932 14.459 3.417 1.00 0.00 N ATOM 0 H HIS A 106 -10.899 12.161 4.054 1.00 0.00 H new ATOM 0 HA HIS A 106 -11.796 14.185 4.269 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -10.594 15.235 1.704 1.00 0.00 H new ATOM 0 HB3 HIS A 106 -10.896 16.082 3.209 1.00 0.00 H new ATOM 0 HD1 HIS A 106 -9.472 14.653 5.352 1.00 0.00 H new ATOM 0 HD2 HIS A 106 -7.872 14.838 1.465 1.00 0.00 H new ATOM 0 HE1 HIS A 106 -6.961 14.219 5.541 1.00 0.00 H new ATOM 1655 N GLY A 107 -13.383 12.811 2.304 1.00 0.00 N ATOM 1656 CA GLY A 107 -14.587 12.685 1.498 1.00 0.00 C ATOM 1657 C GLY A 107 -14.239 12.499 0.032 1.00 0.00 C ATOM 1658 O GLY A 107 -15.064 12.745 -0.849 1.00 0.00 O ATOM 0 H GLY A 107 -13.112 11.966 2.806 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -15.176 11.837 1.847 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -15.206 13.574 1.619 1.00 0.00 H new ATOM 1662 N LYS A 108 -13.016 12.047 -0.218 1.00 0.00 N ATOM 1663 CA LYS A 108 -12.557 11.808 -1.576 1.00 0.00 C ATOM 1664 C LYS A 108 -12.056 10.361 -1.681 1.00 0.00 C ATOM 1665 O LYS A 108 -11.117 10.007 -0.975 1.00 0.00 O ATOM 1666 CB LYS A 108 -11.415 12.771 -1.906 1.00 0.00 C ATOM 1667 CG LYS A 108 -10.867 12.452 -3.292 1.00 0.00 C ATOM 1668 CD LYS A 108 -9.497 11.782 -3.159 1.00 0.00 C ATOM 1669 CE LYS A 108 -8.986 11.379 -4.546 1.00 0.00 C ATOM 1670 NZ LYS A 108 -7.771 12.174 -4.878 1.00 0.00 N ATOM 0 H LYS A 108 -12.326 11.839 0.504 1.00 0.00 H new ATOM 0 HA LYS A 108 -13.375 11.969 -2.278 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -11.772 13.800 -1.872 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -10.624 12.683 -1.161 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -11.555 11.795 -3.824 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -10.781 13.366 -3.880 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -8.792 12.464 -2.684 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -9.571 10.903 -2.518 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -8.753 10.314 -4.564 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -9.760 11.549 -5.294 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -7.424 11.901 -5.819 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -8.008 13.187 -4.877 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -7.032 11.990 -4.170 1.00 0.00 H new ATOM 1684 N PRO A 109 -12.646 9.505 -2.500 1.00 0.00 N ATOM 1685 CA PRO A 109 -12.196 8.083 -2.582 1.00 0.00 C ATOM 1686 C PRO A 109 -10.723 7.956 -2.953 1.00 0.00 C ATOM 1687 O PRO A 109 -10.234 8.652 -3.842 1.00 0.00 O ATOM 1688 CB PRO A 109 -13.088 7.439 -3.647 1.00 0.00 C ATOM 1689 CG PRO A 109 -13.805 8.549 -4.340 1.00 0.00 C ATOM 1690 CD PRO A 109 -13.763 9.774 -3.427 1.00 0.00 C ATOM 0 HA PRO A 109 -12.286 7.592 -1.613 1.00 0.00 H new ATOM 0 HB2 PRO A 109 -12.491 6.864 -4.355 1.00 0.00 H new ATOM 0 HB3 PRO A 109 -13.796 6.747 -3.191 1.00 0.00 H new ATOM 0 HG2 PRO A 109 -13.333 8.770 -5.297 1.00 0.00 H new ATOM 0 HG3 PRO A 109 -14.836 8.265 -4.551 1.00 0.00 H new ATOM 0 HD2 PRO A 109 -13.595 10.688 -3.997 1.00 0.00 H new ATOM 0 HD3 PRO A 109 -14.703 9.901 -2.890 1.00 0.00 H new ATOM 1698 N VAL A 110 -10.021 7.053 -2.270 1.00 0.00 N ATOM 1699 CA VAL A 110 -8.602 6.841 -2.547 1.00 0.00 C ATOM 1700 C VAL A 110 -8.222 5.384 -2.307 1.00 0.00 C ATOM 1701 O VAL A 110 -8.707 4.752 -1.368 1.00 0.00 O ATOM 1702 CB VAL A 110 -7.736 7.752 -1.668 1.00 0.00 C ATOM 1703 CG1 VAL A 110 -8.369 7.902 -0.287 1.00 0.00 C ATOM 1704 CG2 VAL A 110 -6.341 7.145 -1.508 1.00 0.00 C ATOM 0 H VAL A 110 -10.405 6.464 -1.531 1.00 0.00 H new ATOM 0 HA VAL A 110 -8.423 7.087 -3.594 1.00 0.00 H new ATOM 0 HB VAL A 110 -7.662 8.729 -2.145 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -7.747 8.551 0.330 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -9.362 8.340 -0.388 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -8.451 6.922 0.184 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -5.730 7.796 -0.883 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -6.423 6.164 -1.039 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -5.875 7.041 -2.488 1.00 0.00 H new ATOM 1714 N ARG A 111 -7.346 4.864 -3.163 1.00 0.00 N ATOM 1715 CA ARG A 111 -6.897 3.484 -3.042 1.00 0.00 C ATOM 1716 C ARG A 111 -5.371 3.411 -3.131 1.00 0.00 C ATOM 1717 O ARG A 111 -4.684 4.385 -2.821 1.00 0.00 O ATOM 1718 CB ARG A 111 -7.541 2.634 -4.144 1.00 0.00 C ATOM 1719 CG ARG A 111 -7.254 3.254 -5.517 1.00 0.00 C ATOM 1720 CD ARG A 111 -8.462 4.074 -5.971 1.00 0.00 C ATOM 1721 NE ARG A 111 -8.075 4.994 -7.035 1.00 0.00 N ATOM 1722 CZ ARG A 111 -8.950 5.841 -7.564 1.00 0.00 C ATOM 1723 NH1 ARG A 111 -8.578 6.654 -8.513 1.00 0.00 N ATOM 1724 NH2 ARG A 111 -10.183 5.856 -7.136 1.00 0.00 N ATOM 0 H ARG A 111 -6.936 5.376 -3.944 1.00 0.00 H new ATOM 0 HA ARG A 111 -7.201 3.094 -2.071 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -7.150 1.617 -4.106 1.00 0.00 H new ATOM 0 HB3 ARG A 111 -8.617 2.569 -3.983 1.00 0.00 H new ATOM 0 HG2 ARG A 111 -6.370 3.889 -5.463 1.00 0.00 H new ATOM 0 HG3 ARG A 111 -7.040 2.470 -6.244 1.00 0.00 H new ATOM 0 HD2 ARG A 111 -9.250 3.409 -6.324 1.00 0.00 H new ATOM 0 HD3 ARG A 111 -8.870 4.632 -5.128 1.00 0.00 H new ATOM 0 HE ARG A 111 -7.115 4.986 -7.379 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -7.615 6.639 -8.849 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -9.250 7.305 -8.920 1.00 0.00 H new ATOM 0 HH21 ARG A 111 -10.474 5.217 -6.396 1.00 0.00 H new ATOM 0 HH22 ARG A 111 -10.856 6.506 -7.542 1.00 0.00 H new ATOM 1738 N GLY A 112 -4.842 2.267 -3.555 1.00 0.00 N ATOM 1739 CA GLY A 112 -3.399 2.114 -3.675 1.00 0.00 C ATOM 1740 C GLY A 112 -3.002 0.653 -3.796 1.00 0.00 C ATOM 1741 O GLY A 112 -3.482 -0.195 -3.045 1.00 0.00 O ATOM 0 H GLY A 112 -5.384 1.444 -3.818 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -3.045 2.662 -4.549 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -2.912 2.554 -2.805 1.00 0.00 H new ATOM 1745 N VAL A 113 -2.116 0.371 -4.746 1.00 0.00 N ATOM 1746 CA VAL A 113 -1.648 -0.987 -4.961 1.00 0.00 C ATOM 1747 C VAL A 113 -0.178 -1.088 -4.589 1.00 0.00 C ATOM 1748 O VAL A 113 0.625 -0.255 -5.007 1.00 0.00 O ATOM 1749 CB VAL A 113 -1.789 -1.390 -6.433 1.00 0.00 C ATOM 1750 CG1 VAL A 113 -1.901 -2.909 -6.518 1.00 0.00 C ATOM 1751 CG2 VAL A 113 -3.031 -0.753 -7.066 1.00 0.00 C ATOM 0 H VAL A 113 -1.711 1.064 -5.375 1.00 0.00 H new ATOM 0 HA VAL A 113 -2.252 -1.649 -4.341 1.00 0.00 H new ATOM 0 HB VAL A 113 -0.912 -1.039 -6.977 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -2.002 -3.209 -7.561 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -1.006 -3.364 -6.095 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -2.776 -3.241 -5.959 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -3.104 -1.057 -8.110 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -3.921 -1.081 -6.529 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -2.952 0.333 -7.009 1.00 0.00 H new ATOM 1761 N LYS A 114 0.184 -2.104 -3.817 1.00 0.00 N ATOM 1762 CA LYS A 114 1.574 -2.276 -3.430 1.00 0.00 C ATOM 1763 C LYS A 114 2.066 -3.688 -3.739 1.00 0.00 C ATOM 1764 O LYS A 114 1.411 -4.673 -3.397 1.00 0.00 O ATOM 1765 CB LYS A 114 1.712 -1.998 -1.944 1.00 0.00 C ATOM 1766 CG LYS A 114 0.444 -1.300 -1.466 1.00 0.00 C ATOM 1767 CD LYS A 114 0.636 -0.835 -0.034 1.00 0.00 C ATOM 1768 CE LYS A 114 -0.540 0.052 0.370 1.00 0.00 C ATOM 1769 NZ LYS A 114 -0.070 1.458 0.524 1.00 0.00 N ATOM 0 H LYS A 114 -0.455 -2.810 -3.452 1.00 0.00 H new ATOM 0 HA LYS A 114 2.184 -1.577 -4.002 1.00 0.00 H new ATOM 0 HB2 LYS A 114 1.862 -2.928 -1.396 1.00 0.00 H new ATOM 0 HB3 LYS A 114 2.584 -1.372 -1.755 1.00 0.00 H new ATOM 0 HG2 LYS A 114 0.219 -0.449 -2.109 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -0.405 -1.981 -1.529 1.00 0.00 H new ATOM 0 HD2 LYS A 114 0.705 -1.694 0.633 1.00 0.00 H new ATOM 0 HD3 LYS A 114 1.571 -0.283 0.059 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -1.325 -0.000 -0.384 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -0.973 -0.303 1.305 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -0.870 2.063 0.799 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 0.665 1.500 1.259 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 0.323 1.793 -0.378 1.00 0.00 H new ATOM 1783 N LEU A 115 3.237 -3.777 -4.365 1.00 0.00 N ATOM 1784 CA LEU A 115 3.831 -5.068 -4.693 1.00 0.00 C ATOM 1785 C LEU A 115 4.861 -5.400 -3.636 1.00 0.00 C ATOM 1786 O LEU A 115 5.801 -4.633 -3.426 1.00 0.00 O ATOM 1787 CB LEU A 115 4.510 -5.014 -6.072 1.00 0.00 C ATOM 1788 CG LEU A 115 5.383 -6.262 -6.299 1.00 0.00 C ATOM 1789 CD1 LEU A 115 4.542 -7.520 -6.101 1.00 0.00 C ATOM 1790 CD2 LEU A 115 5.930 -6.250 -7.732 1.00 0.00 C ATOM 0 H LEU A 115 3.792 -2.971 -4.654 1.00 0.00 H new ATOM 0 HA LEU A 115 3.053 -5.831 -4.722 1.00 0.00 H new ATOM 0 HB2 LEU A 115 3.753 -4.947 -6.853 1.00 0.00 H new ATOM 0 HB3 LEU A 115 5.124 -4.116 -6.145 1.00 0.00 H new ATOM 0 HG LEU A 115 6.208 -6.255 -5.587 1.00 0.00 H new ATOM 0 HD11 LEU A 115 5.162 -8.402 -6.262 1.00 0.00 H new ATOM 0 HD12 LEU A 115 4.145 -7.536 -5.086 1.00 0.00 H new ATOM 0 HD13 LEU A 115 3.717 -7.522 -6.813 1.00 0.00 H new ATOM 0 HD21 LEU A 115 6.548 -7.133 -7.893 1.00 0.00 H new ATOM 0 HD22 LEU A 115 5.100 -6.254 -8.438 1.00 0.00 H new ATOM 0 HD23 LEU A 115 6.531 -5.354 -7.884 1.00 0.00 H new ATOM 1802 N VAL A 116 4.682 -6.530 -2.966 1.00 0.00 N ATOM 1803 CA VAL A 116 5.612 -6.923 -1.926 1.00 0.00 C ATOM 1804 C VAL A 116 6.171 -8.316 -2.183 1.00 0.00 C ATOM 1805 O VAL A 116 5.459 -9.217 -2.625 1.00 0.00 O ATOM 1806 CB VAL A 116 4.927 -6.870 -0.558 1.00 0.00 C ATOM 1807 CG1 VAL A 116 3.845 -5.796 -0.568 1.00 0.00 C ATOM 1808 CG2 VAL A 116 4.270 -8.209 -0.247 1.00 0.00 C ATOM 0 H VAL A 116 3.912 -7.180 -3.123 1.00 0.00 H new ATOM 0 HA VAL A 116 6.445 -6.220 -1.934 1.00 0.00 H new ATOM 0 HB VAL A 116 5.679 -6.643 0.197 1.00 0.00 H new ATOM 0 HG11 VAL A 116 3.359 -5.760 0.407 1.00 0.00 H new ATOM 0 HG12 VAL A 116 4.296 -4.827 -0.784 1.00 0.00 H new ATOM 0 HG13 VAL A 116 3.106 -6.031 -1.334 1.00 0.00 H new ATOM 0 HG21 VAL A 116 3.786 -8.159 0.728 1.00 0.00 H new ATOM 0 HG22 VAL A 116 3.525 -8.435 -1.010 1.00 0.00 H new ATOM 0 HG23 VAL A 116 5.028 -8.992 -0.236 1.00 0.00 H new ATOM 1818 N GLY A 117 7.462 -8.475 -1.913 1.00 0.00 N ATOM 1819 CA GLY A 117 8.125 -9.756 -2.124 1.00 0.00 C ATOM 1820 C GLY A 117 9.416 -9.844 -1.317 1.00 0.00 C ATOM 1821 O GLY A 117 9.885 -8.849 -0.770 1.00 0.00 O ATOM 0 H GLY A 117 8.067 -7.738 -1.550 1.00 0.00 H new ATOM 0 HA2 GLY A 117 7.456 -10.567 -1.836 1.00 0.00 H new ATOM 0 HA3 GLY A 117 8.345 -9.885 -3.184 1.00 0.00 H new ATOM 1825 N ARG A 118 9.984 -11.042 -1.249 1.00 0.00 N ATOM 1826 CA ARG A 118 11.225 -11.254 -0.510 1.00 0.00 C ATOM 1827 C ARG A 118 12.396 -10.600 -1.234 1.00 0.00 C ATOM 1828 O ARG A 118 13.529 -10.622 -0.753 1.00 0.00 O ATOM 1829 CB ARG A 118 11.495 -12.755 -0.366 1.00 0.00 C ATOM 1830 CG ARG A 118 11.001 -13.252 0.996 1.00 0.00 C ATOM 1831 CD ARG A 118 12.088 -13.030 2.050 1.00 0.00 C ATOM 1832 NE ARG A 118 13.301 -13.756 1.685 1.00 0.00 N ATOM 1833 CZ ARG A 118 14.366 -13.766 2.480 1.00 0.00 C ATOM 1834 NH1 ARG A 118 15.439 -14.419 2.127 1.00 0.00 N ATOM 1835 NH2 ARG A 118 14.337 -13.122 3.616 1.00 0.00 N ATOM 0 H ARG A 118 9.608 -11.879 -1.694 1.00 0.00 H new ATOM 0 HA ARG A 118 11.120 -10.803 0.477 1.00 0.00 H new ATOM 0 HB2 ARG A 118 10.993 -13.301 -1.165 1.00 0.00 H new ATOM 0 HB3 ARG A 118 12.562 -12.952 -0.468 1.00 0.00 H new ATOM 0 HG2 ARG A 118 10.092 -12.722 1.280 1.00 0.00 H new ATOM 0 HG3 ARG A 118 10.748 -14.311 0.938 1.00 0.00 H new ATOM 0 HD2 ARG A 118 12.306 -11.966 2.140 1.00 0.00 H new ATOM 0 HD3 ARG A 118 11.734 -13.366 3.024 1.00 0.00 H new ATOM 0 HE ARG A 118 13.332 -14.266 0.802 1.00 0.00 H new ATOM 0 HH11 ARG A 118 15.461 -14.922 1.240 1.00 0.00 H new ATOM 0 HH12 ARG A 118 16.256 -14.426 2.738 1.00 0.00 H new ATOM 0 HH21 ARG A 118 13.498 -12.612 3.892 1.00 0.00 H new ATOM 0 HH22 ARG A 118 15.154 -13.129 4.227 1.00 0.00 H new ATOM 1849 N ASP A 119 12.111 -10.024 -2.394 1.00 0.00 N ATOM 1850 CA ASP A 119 13.143 -9.365 -3.187 1.00 0.00 C ATOM 1851 C ASP A 119 14.432 -10.180 -3.197 1.00 0.00 C ATOM 1852 O ASP A 119 15.482 -9.706 -2.760 1.00 0.00 O ATOM 1853 CB ASP A 119 13.422 -7.970 -2.628 1.00 0.00 C ATOM 1854 CG ASP A 119 13.930 -8.072 -1.195 1.00 0.00 C ATOM 1855 OD1 ASP A 119 13.112 -8.246 -0.306 1.00 0.00 O ATOM 1856 OD2 ASP A 119 15.132 -7.977 -1.006 1.00 0.00 O ATOM 0 H ASP A 119 11.178 -9.999 -2.807 1.00 0.00 H new ATOM 0 HA ASP A 119 12.780 -9.282 -4.211 1.00 0.00 H new ATOM 0 HB2 ASP A 119 14.160 -7.462 -3.248 1.00 0.00 H new ATOM 0 HB3 ASP A 119 12.513 -7.369 -2.658 1.00 0.00 H new ATOM 1861 N PRO A 120 14.376 -11.387 -3.697 1.00 0.00 N ATOM 1862 CA PRO A 120 15.563 -12.281 -3.780 1.00 0.00 C ATOM 1863 C PRO A 120 16.473 -11.898 -4.944 1.00 0.00 C ATOM 1864 O PRO A 120 17.684 -12.124 -4.904 1.00 0.00 O ATOM 1865 CB PRO A 120 14.953 -13.663 -3.999 1.00 0.00 C ATOM 1866 CG PRO A 120 13.658 -13.411 -4.702 1.00 0.00 C ATOM 1867 CD PRO A 120 13.168 -12.034 -4.238 1.00 0.00 C ATOM 0 HA PRO A 120 16.191 -12.225 -2.891 1.00 0.00 H new ATOM 0 HB2 PRO A 120 15.610 -14.293 -4.598 1.00 0.00 H new ATOM 0 HB3 PRO A 120 14.793 -14.178 -3.052 1.00 0.00 H new ATOM 0 HG2 PRO A 120 13.794 -13.430 -5.783 1.00 0.00 H new ATOM 0 HG3 PRO A 120 12.929 -14.184 -4.459 1.00 0.00 H new ATOM 0 HD2 PRO A 120 12.745 -11.462 -5.064 1.00 0.00 H new ATOM 0 HD3 PRO A 120 12.390 -12.122 -3.480 1.00 0.00 H new ATOM 1875 N LYS A 121 15.875 -11.314 -5.979 1.00 0.00 N ATOM 1876 CA LYS A 121 16.628 -10.897 -7.155 1.00 0.00 C ATOM 1877 C LYS A 121 15.732 -10.111 -8.108 1.00 0.00 C ATOM 1878 O LYS A 121 16.129 -9.791 -9.228 1.00 0.00 O ATOM 1879 CB LYS A 121 17.196 -12.122 -7.875 1.00 0.00 C ATOM 1880 CG LYS A 121 16.110 -12.753 -8.748 1.00 0.00 C ATOM 1881 CD LYS A 121 16.464 -14.214 -9.029 1.00 0.00 C ATOM 1882 CE LYS A 121 15.770 -15.113 -8.005 1.00 0.00 C ATOM 1883 NZ LYS A 121 16.149 -16.533 -8.252 1.00 0.00 N ATOM 0 H LYS A 121 14.875 -11.120 -6.026 1.00 0.00 H new ATOM 0 HA LYS A 121 17.449 -10.257 -6.832 1.00 0.00 H new ATOM 0 HB2 LYS A 121 18.048 -11.832 -8.490 1.00 0.00 H new ATOM 0 HB3 LYS A 121 17.560 -12.848 -7.148 1.00 0.00 H new ATOM 0 HG2 LYS A 121 15.144 -12.692 -8.246 1.00 0.00 H new ATOM 0 HG3 LYS A 121 16.017 -12.204 -9.685 1.00 0.00 H new ATOM 0 HD2 LYS A 121 16.154 -14.487 -10.038 1.00 0.00 H new ATOM 0 HD3 LYS A 121 17.544 -14.354 -8.979 1.00 0.00 H new ATOM 0 HE2 LYS A 121 16.056 -14.820 -6.995 1.00 0.00 H new ATOM 0 HE3 LYS A 121 14.689 -14.996 -8.077 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 15.677 -17.144 -7.556 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 15.855 -16.809 -9.211 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 17.180 -16.638 -8.162 1.00 0.00 H new ATOM 1897 N ASN A 122 14.521 -9.800 -7.651 1.00 0.00 N ATOM 1898 CA ASN A 122 13.574 -9.048 -8.467 1.00 0.00 C ATOM 1899 C ASN A 122 12.910 -9.958 -9.497 1.00 0.00 C ATOM 1900 O ASN A 122 13.540 -10.875 -10.023 1.00 0.00 O ATOM 1901 CB ASN A 122 14.295 -7.905 -9.185 1.00 0.00 C ATOM 1902 CG ASN A 122 13.357 -6.713 -9.339 1.00 0.00 C ATOM 1903 OD1 ASN A 122 12.915 -6.410 -10.447 1.00 0.00 O ATOM 1904 ND2 ASN A 122 13.027 -6.015 -8.287 1.00 0.00 N ATOM 0 H ASN A 122 14.175 -10.056 -6.726 1.00 0.00 H new ATOM 0 HA ASN A 122 12.805 -8.639 -7.811 1.00 0.00 H new ATOM 0 HB2 ASN A 122 15.180 -7.611 -8.621 1.00 0.00 H new ATOM 0 HB3 ASN A 122 14.637 -8.238 -10.165 1.00 0.00 H new ATOM 0 HD21 ASN A 122 12.401 -5.215 -8.381 1.00 0.00 H new ATOM 0 HD22 ASN A 122 13.395 -6.269 -7.370 1.00 0.00 H new ATOM 1911 N ASN A 123 11.635 -9.699 -9.780 1.00 0.00 N ATOM 1912 CA ASN A 123 10.901 -10.503 -10.749 1.00 0.00 C ATOM 1913 C ASN A 123 10.075 -9.609 -11.668 1.00 0.00 C ATOM 1914 O ASN A 123 8.903 -9.341 -11.403 1.00 0.00 O ATOM 1915 CB ASN A 123 9.982 -11.487 -10.025 1.00 0.00 C ATOM 1916 CG ASN A 123 10.716 -12.802 -9.782 1.00 0.00 C ATOM 1917 OD1 ASN A 123 10.821 -13.256 -8.643 1.00 0.00 O ATOM 1918 ND2 ASN A 123 11.234 -13.446 -10.792 1.00 0.00 N ATOM 0 H ASN A 123 11.095 -8.945 -9.355 1.00 0.00 H new ATOM 0 HA ASN A 123 11.620 -11.059 -11.352 1.00 0.00 H new ATOM 0 HB2 ASN A 123 9.656 -11.062 -9.076 1.00 0.00 H new ATOM 0 HB3 ASN A 123 9.086 -11.665 -10.619 1.00 0.00 H new ATOM 0 HD21 ASN A 123 11.726 -14.326 -10.637 1.00 0.00 H new ATOM 0 HD22 ASN A 123 11.147 -13.069 -11.736 1.00 0.00 H new ATOM 1925 N LEU A 124 10.695 -9.153 -12.750 1.00 0.00 N ATOM 1926 CA LEU A 124 10.012 -8.295 -13.707 1.00 0.00 C ATOM 1927 C LEU A 124 8.652 -8.879 -14.049 1.00 0.00 C ATOM 1928 O LEU A 124 7.733 -8.161 -14.442 1.00 0.00 O ATOM 1929 CB LEU A 124 10.847 -8.157 -14.980 1.00 0.00 C ATOM 1930 CG LEU A 124 11.061 -9.539 -15.602 1.00 0.00 C ATOM 1931 CD1 LEU A 124 10.227 -9.660 -16.878 1.00 0.00 C ATOM 1932 CD2 LEU A 124 12.542 -9.721 -15.944 1.00 0.00 C ATOM 0 H LEU A 124 11.665 -9.363 -12.985 1.00 0.00 H new ATOM 0 HA LEU A 124 9.878 -7.310 -13.261 1.00 0.00 H new ATOM 0 HB2 LEU A 124 10.342 -7.501 -15.689 1.00 0.00 H new ATOM 0 HB3 LEU A 124 11.808 -7.697 -14.749 1.00 0.00 H new ATOM 0 HG LEU A 124 10.754 -10.307 -14.892 1.00 0.00 H new ATOM 0 HD11 LEU A 124 10.380 -10.644 -17.321 1.00 0.00 H new ATOM 0 HD12 LEU A 124 9.172 -9.530 -16.637 1.00 0.00 H new ATOM 0 HD13 LEU A 124 10.534 -8.892 -17.588 1.00 0.00 H new ATOM 0 HD21 LEU A 124 12.695 -10.705 -16.387 1.00 0.00 H new ATOM 0 HD22 LEU A 124 12.849 -8.952 -16.653 1.00 0.00 H new ATOM 0 HD23 LEU A 124 13.138 -9.635 -15.036 1.00 0.00 H new ATOM 1944 N GLU A 125 8.527 -10.191 -13.883 1.00 0.00 N ATOM 1945 CA GLU A 125 7.268 -10.862 -14.164 1.00 0.00 C ATOM 1946 C GLU A 125 6.259 -10.505 -13.088 1.00 0.00 C ATOM 1947 O GLU A 125 5.066 -10.359 -13.359 1.00 0.00 O ATOM 1948 CB GLU A 125 7.477 -12.378 -14.201 1.00 0.00 C ATOM 1949 CG GLU A 125 7.853 -12.806 -15.620 1.00 0.00 C ATOM 1950 CD GLU A 125 8.486 -14.192 -15.596 1.00 0.00 C ATOM 1951 OE1 GLU A 125 7.751 -15.155 -15.445 1.00 0.00 O ATOM 1952 OE2 GLU A 125 9.696 -14.273 -15.728 1.00 0.00 O ATOM 0 H GLU A 125 9.275 -10.804 -13.559 1.00 0.00 H new ATOM 0 HA GLU A 125 6.895 -10.537 -15.135 1.00 0.00 H new ATOM 0 HB2 GLU A 125 8.263 -12.665 -13.503 1.00 0.00 H new ATOM 0 HB3 GLU A 125 6.568 -12.889 -13.884 1.00 0.00 H new ATOM 0 HG2 GLU A 125 6.966 -12.813 -16.254 1.00 0.00 H new ATOM 0 HG3 GLU A 125 8.548 -12.087 -16.053 1.00 0.00 H new ATOM 1959 N ALA A 126 6.749 -10.350 -11.865 1.00 0.00 N ATOM 1960 CA ALA A 126 5.891 -9.989 -10.758 1.00 0.00 C ATOM 1961 C ALA A 126 5.455 -8.548 -10.925 1.00 0.00 C ATOM 1962 O ALA A 126 4.303 -8.204 -10.663 1.00 0.00 O ATOM 1963 CB ALA A 126 6.632 -10.162 -9.432 1.00 0.00 C ATOM 0 H ALA A 126 7.732 -10.469 -11.621 1.00 0.00 H new ATOM 0 HA ALA A 126 5.017 -10.640 -10.749 1.00 0.00 H new ATOM 0 HB1 ALA A 126 5.973 -9.886 -8.608 1.00 0.00 H new ATOM 0 HB2 ALA A 126 6.938 -11.202 -9.319 1.00 0.00 H new ATOM 0 HB3 ALA A 126 7.514 -9.521 -9.422 1.00 0.00 H new ATOM 1969 N LEU A 127 6.382 -7.701 -11.367 1.00 0.00 N ATOM 1970 CA LEU A 127 6.059 -6.299 -11.564 1.00 0.00 C ATOM 1971 C LEU A 127 4.978 -6.153 -12.617 1.00 0.00 C ATOM 1972 O LEU A 127 4.080 -5.325 -12.484 1.00 0.00 O ATOM 1973 CB LEU A 127 7.306 -5.521 -11.985 1.00 0.00 C ATOM 1974 CG LEU A 127 7.860 -4.753 -10.786 1.00 0.00 C ATOM 1975 CD1 LEU A 127 9.280 -4.277 -11.097 1.00 0.00 C ATOM 1976 CD2 LEU A 127 6.970 -3.541 -10.493 1.00 0.00 C ATOM 0 H LEU A 127 7.343 -7.958 -11.590 1.00 0.00 H new ATOM 0 HA LEU A 127 5.692 -5.892 -10.622 1.00 0.00 H new ATOM 0 HB2 LEU A 127 8.061 -6.206 -12.371 1.00 0.00 H new ATOM 0 HB3 LEU A 127 7.061 -4.829 -12.791 1.00 0.00 H new ATOM 0 HG LEU A 127 7.877 -5.408 -9.915 1.00 0.00 H new ATOM 0 HD11 LEU A 127 9.676 -3.729 -10.242 1.00 0.00 H new ATOM 0 HD12 LEU A 127 9.916 -5.138 -11.302 1.00 0.00 H new ATOM 0 HD13 LEU A 127 9.262 -3.624 -11.970 1.00 0.00 H new ATOM 0 HD21 LEU A 127 7.368 -2.996 -9.637 1.00 0.00 H new ATOM 0 HD22 LEU A 127 6.950 -2.885 -11.364 1.00 0.00 H new ATOM 0 HD23 LEU A 127 5.958 -3.878 -10.269 1.00 0.00 H new ATOM 1988 N GLU A 128 5.056 -6.971 -13.658 1.00 0.00 N ATOM 1989 CA GLU A 128 4.055 -6.915 -14.711 1.00 0.00 C ATOM 1990 C GLU A 128 2.715 -7.368 -14.152 1.00 0.00 C ATOM 1991 O GLU A 128 1.671 -6.764 -14.419 1.00 0.00 O ATOM 1992 CB GLU A 128 4.462 -7.820 -15.875 1.00 0.00 C ATOM 1993 CG GLU A 128 3.342 -7.851 -16.917 1.00 0.00 C ATOM 1994 CD GLU A 128 2.433 -9.051 -16.669 1.00 0.00 C ATOM 1995 OE1 GLU A 128 2.748 -10.119 -17.166 1.00 0.00 O ATOM 1996 OE2 GLU A 128 1.435 -8.883 -15.988 1.00 0.00 O ATOM 0 H GLU A 128 5.788 -7.668 -13.794 1.00 0.00 H new ATOM 0 HA GLU A 128 3.974 -5.891 -15.076 1.00 0.00 H new ATOM 0 HB2 GLU A 128 5.384 -7.455 -16.328 1.00 0.00 H new ATOM 0 HB3 GLU A 128 4.663 -8.828 -15.512 1.00 0.00 H new ATOM 0 HG2 GLU A 128 2.763 -6.929 -16.868 1.00 0.00 H new ATOM 0 HG3 GLU A 128 3.767 -7.907 -17.919 1.00 0.00 H new ATOM 2003 N ASP A 129 2.756 -8.430 -13.358 1.00 0.00 N ATOM 2004 CA ASP A 129 1.542 -8.954 -12.757 1.00 0.00 C ATOM 2005 C ASP A 129 0.935 -7.912 -11.841 1.00 0.00 C ATOM 2006 O ASP A 129 -0.272 -7.673 -11.861 1.00 0.00 O ATOM 2007 CB ASP A 129 1.845 -10.229 -11.969 1.00 0.00 C ATOM 2008 CG ASP A 129 0.547 -10.950 -11.626 1.00 0.00 C ATOM 2009 OD1 ASP A 129 -0.221 -11.212 -12.537 1.00 0.00 O ATOM 2010 OD2 ASP A 129 0.338 -11.228 -10.457 1.00 0.00 O ATOM 0 H ASP A 129 3.607 -8.939 -13.119 1.00 0.00 H new ATOM 0 HA ASP A 129 0.832 -9.195 -13.549 1.00 0.00 H new ATOM 0 HB2 ASP A 129 2.491 -10.884 -12.555 1.00 0.00 H new ATOM 0 HB3 ASP A 129 2.386 -9.982 -11.055 1.00 0.00 H new ATOM 2015 N PHE A 130 1.782 -7.258 -11.068 1.00 0.00 N ATOM 2016 CA PHE A 130 1.318 -6.216 -10.183 1.00 0.00 C ATOM 2017 C PHE A 130 0.787 -5.069 -11.020 1.00 0.00 C ATOM 2018 O PHE A 130 -0.323 -4.576 -10.804 1.00 0.00 O ATOM 2019 CB PHE A 130 2.486 -5.746 -9.325 1.00 0.00 C ATOM 2020 CG PHE A 130 2.277 -4.323 -8.889 1.00 0.00 C ATOM 2021 CD1 PHE A 130 1.525 -4.057 -7.748 1.00 0.00 C ATOM 2022 CD2 PHE A 130 2.854 -3.271 -9.611 1.00 0.00 C ATOM 2023 CE1 PHE A 130 1.344 -2.746 -7.323 1.00 0.00 C ATOM 2024 CE2 PHE A 130 2.669 -1.949 -9.185 1.00 0.00 C ATOM 2025 CZ PHE A 130 1.913 -1.687 -8.037 1.00 0.00 C ATOM 0 H PHE A 130 2.787 -7.431 -11.037 1.00 0.00 H new ATOM 0 HA PHE A 130 0.524 -6.586 -9.535 1.00 0.00 H new ATOM 0 HB2 PHE A 130 2.586 -6.390 -8.451 1.00 0.00 H new ATOM 0 HB3 PHE A 130 3.415 -5.828 -9.889 1.00 0.00 H new ATOM 0 HD1 PHE A 130 1.082 -4.870 -7.192 1.00 0.00 H new ATOM 0 HD2 PHE A 130 3.440 -3.478 -10.494 1.00 0.00 H new ATOM 0 HE1 PHE A 130 0.761 -2.544 -6.437 1.00 0.00 H new ATOM 0 HE2 PHE A 130 3.109 -1.134 -9.741 1.00 0.00 H new ATOM 0 HZ PHE A 130 1.769 -0.670 -7.703 1.00 0.00 H new ATOM 2035 N GLU A 131 1.590 -4.672 -12.000 1.00 0.00 N ATOM 2036 CA GLU A 131 1.214 -3.597 -12.900 1.00 0.00 C ATOM 2037 C GLU A 131 -0.044 -3.990 -13.648 1.00 0.00 C ATOM 2038 O GLU A 131 -0.743 -3.141 -14.207 1.00 0.00 O ATOM 2039 CB GLU A 131 2.347 -3.309 -13.892 1.00 0.00 C ATOM 2040 CG GLU A 131 2.136 -1.939 -14.545 1.00 0.00 C ATOM 2041 CD GLU A 131 2.556 -0.830 -13.587 1.00 0.00 C ATOM 2042 OE1 GLU A 131 3.735 -0.750 -13.286 1.00 0.00 O ATOM 2043 OE2 GLU A 131 1.693 -0.075 -13.171 1.00 0.00 O ATOM 0 H GLU A 131 2.505 -5.081 -12.189 1.00 0.00 H new ATOM 0 HA GLU A 131 1.027 -2.693 -12.320 1.00 0.00 H new ATOM 0 HB2 GLU A 131 3.307 -3.331 -13.377 1.00 0.00 H new ATOM 0 HB3 GLU A 131 2.378 -4.085 -14.657 1.00 0.00 H new ATOM 0 HG2 GLU A 131 2.716 -1.873 -15.466 1.00 0.00 H new ATOM 0 HG3 GLU A 131 1.088 -1.816 -14.819 1.00 0.00 H new ATOM 2050 N LYS A 132 -0.378 -5.276 -13.592 1.00 0.00 N ATOM 2051 CA LYS A 132 -1.600 -5.727 -14.217 1.00 0.00 C ATOM 2052 C LYS A 132 -2.728 -5.445 -13.250 1.00 0.00 C ATOM 2053 O LYS A 132 -3.809 -5.028 -13.643 1.00 0.00 O ATOM 2054 CB LYS A 132 -1.539 -7.224 -14.547 1.00 0.00 C ATOM 2055 CG LYS A 132 -2.578 -7.563 -15.627 1.00 0.00 C ATOM 2056 CD LYS A 132 -2.193 -6.923 -16.967 1.00 0.00 C ATOM 2057 CE LYS A 132 -2.582 -7.866 -18.108 1.00 0.00 C ATOM 2058 NZ LYS A 132 -4.044 -8.144 -18.041 1.00 0.00 N ATOM 0 H LYS A 132 0.170 -6.002 -13.131 1.00 0.00 H new ATOM 0 HA LYS A 132 -1.754 -5.202 -15.160 1.00 0.00 H new ATOM 0 HB2 LYS A 132 -0.540 -7.488 -14.895 1.00 0.00 H new ATOM 0 HB3 LYS A 132 -1.730 -7.812 -13.649 1.00 0.00 H new ATOM 0 HG2 LYS A 132 -2.651 -8.644 -15.742 1.00 0.00 H new ATOM 0 HG3 LYS A 132 -3.561 -7.208 -15.318 1.00 0.00 H new ATOM 0 HD2 LYS A 132 -2.698 -5.964 -17.084 1.00 0.00 H new ATOM 0 HD3 LYS A 132 -1.122 -6.724 -16.994 1.00 0.00 H new ATOM 0 HE2 LYS A 132 -2.329 -7.417 -19.068 1.00 0.00 H new ATOM 0 HE3 LYS A 132 -2.020 -8.797 -18.034 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 -4.362 -8.550 -18.944 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 -4.234 -8.818 -17.273 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 -4.558 -7.258 -17.859 1.00 0.00 H new ATOM 2072 N ALA A 133 -2.463 -5.696 -11.973 1.00 0.00 N ATOM 2073 CA ALA A 133 -3.471 -5.466 -10.958 1.00 0.00 C ATOM 2074 C ALA A 133 -3.816 -3.988 -10.902 1.00 0.00 C ATOM 2075 O ALA A 133 -4.988 -3.607 -10.962 1.00 0.00 O ATOM 2076 CB ALA A 133 -2.975 -5.944 -9.592 1.00 0.00 C ATOM 0 H ALA A 133 -1.573 -6.053 -11.625 1.00 0.00 H new ATOM 0 HA ALA A 133 -4.366 -6.032 -11.217 1.00 0.00 H new ATOM 0 HB1 ALA A 133 -3.745 -5.763 -8.842 1.00 0.00 H new ATOM 0 HB2 ALA A 133 -2.756 -7.011 -9.637 1.00 0.00 H new ATOM 0 HB3 ALA A 133 -2.071 -5.399 -9.322 1.00 0.00 H new ATOM 2082 N ALA A 134 -2.790 -3.151 -10.826 1.00 0.00 N ATOM 2083 CA ALA A 134 -3.013 -1.725 -10.792 1.00 0.00 C ATOM 2084 C ALA A 134 -3.717 -1.320 -12.056 1.00 0.00 C ATOM 2085 O ALA A 134 -4.677 -0.555 -12.022 1.00 0.00 O ATOM 2086 CB ALA A 134 -1.689 -0.971 -10.656 1.00 0.00 C ATOM 0 H ALA A 134 -1.811 -3.436 -10.788 1.00 0.00 H new ATOM 0 HA ALA A 134 -3.627 -1.474 -9.927 1.00 0.00 H new ATOM 0 HB1 ALA A 134 -1.882 0.102 -10.633 1.00 0.00 H new ATOM 0 HB2 ALA A 134 -1.193 -1.271 -9.733 1.00 0.00 H new ATOM 0 HB3 ALA A 134 -1.048 -1.206 -11.506 1.00 0.00 H new ATOM 2092 N GLY A 135 -3.267 -1.867 -13.170 1.00 0.00 N ATOM 2093 CA GLY A 135 -3.912 -1.564 -14.423 1.00 0.00 C ATOM 2094 C GLY A 135 -5.343 -2.067 -14.371 1.00 0.00 C ATOM 2095 O GLY A 135 -6.287 -1.333 -14.657 1.00 0.00 O ATOM 0 H GLY A 135 -2.476 -2.508 -13.229 1.00 0.00 H new ATOM 0 HA2 GLY A 135 -3.896 -0.489 -14.605 1.00 0.00 H new ATOM 0 HA3 GLY A 135 -3.376 -2.035 -15.247 1.00 0.00 H new ATOM 2099 N ALA A 136 -5.486 -3.342 -14.040 1.00 0.00 N ATOM 2100 CA ALA A 136 -6.796 -3.965 -13.982 1.00 0.00 C ATOM 2101 C ALA A 136 -7.786 -3.079 -13.265 1.00 0.00 C ATOM 2102 O ALA A 136 -8.966 -3.048 -13.614 1.00 0.00 O ATOM 2103 CB ALA A 136 -6.711 -5.323 -13.286 1.00 0.00 C ATOM 0 H ALA A 136 -4.711 -3.963 -13.808 1.00 0.00 H new ATOM 0 HA ALA A 136 -7.143 -4.111 -15.005 1.00 0.00 H new ATOM 0 HB1 ALA A 136 -7.702 -5.776 -13.251 1.00 0.00 H new ATOM 0 HB2 ALA A 136 -6.033 -5.974 -13.839 1.00 0.00 H new ATOM 0 HB3 ALA A 136 -6.337 -5.189 -12.271 1.00 0.00 H new ATOM 2109 N ARG A 137 -7.310 -2.330 -12.287 1.00 0.00 N ATOM 2110 CA ARG A 137 -8.190 -1.428 -11.580 1.00 0.00 C ATOM 2111 C ARG A 137 -8.321 -0.162 -12.404 1.00 0.00 C ATOM 2112 O ARG A 137 -9.358 0.501 -12.408 1.00 0.00 O ATOM 2113 CB ARG A 137 -7.608 -1.109 -10.199 1.00 0.00 C ATOM 2114 CG ARG A 137 -8.449 -1.772 -9.099 1.00 0.00 C ATOM 2115 CD ARG A 137 -8.258 -3.291 -9.150 1.00 0.00 C ATOM 2116 NE ARG A 137 -8.935 -3.925 -8.024 1.00 0.00 N ATOM 2117 CZ ARG A 137 -8.928 -5.246 -7.875 1.00 0.00 C ATOM 2118 NH1 ARG A 137 -9.544 -5.793 -6.864 1.00 0.00 N ATOM 2119 NH2 ARG A 137 -8.302 -5.996 -8.740 1.00 0.00 N ATOM 0 H ARG A 137 -6.340 -2.329 -11.972 1.00 0.00 H new ATOM 0 HA ARG A 137 -9.170 -1.883 -11.437 1.00 0.00 H new ATOM 0 HB2 ARG A 137 -6.578 -1.461 -10.141 1.00 0.00 H new ATOM 0 HB3 ARG A 137 -7.585 -0.030 -10.047 1.00 0.00 H new ATOM 0 HG2 ARG A 137 -8.153 -1.391 -8.122 1.00 0.00 H new ATOM 0 HG3 ARG A 137 -9.502 -1.523 -9.233 1.00 0.00 H new ATOM 0 HD2 ARG A 137 -8.653 -3.683 -10.088 1.00 0.00 H new ATOM 0 HD3 ARG A 137 -7.195 -3.532 -9.126 1.00 0.00 H new ATOM 0 HE ARG A 137 -9.422 -3.345 -7.340 1.00 0.00 H new ATOM 0 HH11 ARG A 137 -10.032 -5.207 -6.186 1.00 0.00 H new ATOM 0 HH12 ARG A 137 -9.538 -6.807 -6.751 1.00 0.00 H new ATOM 0 HH21 ARG A 137 -7.818 -5.569 -9.530 1.00 0.00 H new ATOM 0 HH22 ARG A 137 -8.296 -7.010 -8.626 1.00 0.00 H new ATOM 2133 N GLY A 138 -7.229 0.172 -13.071 1.00 0.00 N ATOM 2134 CA GLY A 138 -7.166 1.377 -13.880 1.00 0.00 C ATOM 2135 C GLY A 138 -6.216 2.355 -13.213 1.00 0.00 C ATOM 2136 O GLY A 138 -6.421 3.568 -13.230 1.00 0.00 O ATOM 0 H GLY A 138 -6.370 -0.378 -13.068 1.00 0.00 H new ATOM 0 HA2 GLY A 138 -6.821 1.140 -14.886 1.00 0.00 H new ATOM 0 HA3 GLY A 138 -8.157 1.819 -13.979 1.00 0.00 H new ATOM 2140 N LEU A 139 -5.173 1.790 -12.619 1.00 0.00 N ATOM 2141 CA LEU A 139 -4.161 2.569 -11.922 1.00 0.00 C ATOM 2142 C LEU A 139 -2.807 2.387 -12.598 1.00 0.00 C ATOM 2143 O LEU A 139 -1.771 2.324 -11.935 1.00 0.00 O ATOM 2144 CB LEU A 139 -4.054 2.102 -10.465 1.00 0.00 C ATOM 2145 CG LEU A 139 -5.418 2.182 -9.771 1.00 0.00 C ATOM 2146 CD1 LEU A 139 -5.477 1.138 -8.651 1.00 0.00 C ATOM 2147 CD2 LEU A 139 -5.600 3.576 -9.168 1.00 0.00 C ATOM 0 H LEU A 139 -5.006 0.784 -12.607 1.00 0.00 H new ATOM 0 HA LEU A 139 -4.449 3.620 -11.952 1.00 0.00 H new ATOM 0 HB2 LEU A 139 -3.683 1.078 -10.432 1.00 0.00 H new ATOM 0 HB3 LEU A 139 -3.332 2.720 -9.932 1.00 0.00 H new ATOM 0 HG LEU A 139 -6.209 1.990 -10.496 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -6.446 1.191 -8.154 1.00 0.00 H new ATOM 0 HD12 LEU A 139 -5.340 0.143 -9.074 1.00 0.00 H new ATOM 0 HD13 LEU A 139 -4.687 1.336 -7.927 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -6.570 3.635 -8.674 1.00 0.00 H new ATOM 0 HD22 LEU A 139 -4.810 3.764 -8.441 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -5.550 4.324 -9.959 1.00 0.00 H new ATOM 2159 N SER A 140 -2.821 2.286 -13.918 1.00 0.00 N ATOM 2160 CA SER A 140 -1.587 2.095 -14.672 1.00 0.00 C ATOM 2161 C SER A 140 -1.070 3.428 -15.206 1.00 0.00 C ATOM 2162 O SER A 140 -0.586 3.511 -16.335 1.00 0.00 O ATOM 2163 CB SER A 140 -1.828 1.133 -15.835 1.00 0.00 C ATOM 2164 OG SER A 140 -3.050 1.471 -16.477 1.00 0.00 O ATOM 0 H SER A 140 -3.666 2.332 -14.488 1.00 0.00 H new ATOM 0 HA SER A 140 -0.838 1.672 -14.003 1.00 0.00 H new ATOM 0 HB2 SER A 140 -1.003 1.189 -16.545 1.00 0.00 H new ATOM 0 HB3 SER A 140 -1.867 0.106 -15.471 1.00 0.00 H new ATOM 0 HG SER A 140 -3.207 0.857 -17.225 1.00 0.00 H new ATOM 2170 N THR A 141 -1.175 4.469 -14.387 1.00 0.00 N ATOM 2171 CA THR A 141 -0.716 5.795 -14.787 1.00 0.00 C ATOM 2172 C THR A 141 -0.548 6.692 -13.565 1.00 0.00 C ATOM 2173 O THR A 141 -0.270 7.885 -13.691 1.00 0.00 O ATOM 2174 CB THR A 141 -1.725 6.427 -15.748 1.00 0.00 C ATOM 2175 OG1 THR A 141 -1.168 7.608 -16.306 1.00 0.00 O ATOM 2176 CG2 THR A 141 -3.008 6.773 -14.989 1.00 0.00 C ATOM 0 H THR A 141 -1.571 4.422 -13.448 1.00 0.00 H new ATOM 0 HA THR A 141 0.248 5.692 -15.286 1.00 0.00 H new ATOM 0 HB THR A 141 -1.958 5.723 -16.547 1.00 0.00 H new ATOM 0 HG1 THR A 141 -0.707 8.115 -15.605 1.00 0.00 H new ATOM 0 HG21 THR A 141 -3.726 7.223 -15.674 1.00 0.00 H new ATOM 0 HG22 THR A 141 -3.434 5.865 -14.562 1.00 0.00 H new ATOM 0 HG23 THR A 141 -2.779 7.477 -14.189 1.00 0.00 H new ATOM 2184 N GLU A 142 -0.729 6.111 -12.385 1.00 0.00 N ATOM 2185 CA GLU A 142 -0.610 6.870 -11.141 1.00 0.00 C ATOM 2186 C GLU A 142 0.794 7.433 -10.959 1.00 0.00 C ATOM 2187 O GLU A 142 1.482 7.756 -11.927 1.00 0.00 O ATOM 2188 CB GLU A 142 -0.941 5.973 -9.946 1.00 0.00 C ATOM 2189 CG GLU A 142 -2.234 5.199 -10.205 1.00 0.00 C ATOM 2190 CD GLU A 142 -3.284 6.096 -10.853 1.00 0.00 C ATOM 2191 OE1 GLU A 142 -3.155 6.368 -12.035 1.00 0.00 O ATOM 2192 OE2 GLU A 142 -4.202 6.497 -10.158 1.00 0.00 O ATOM 0 H GLU A 142 -0.957 5.125 -12.261 1.00 0.00 H new ATOM 0 HA GLU A 142 -1.314 7.700 -11.197 1.00 0.00 H new ATOM 0 HB2 GLU A 142 -0.122 5.276 -9.768 1.00 0.00 H new ATOM 0 HB3 GLU A 142 -1.046 6.579 -9.046 1.00 0.00 H new ATOM 0 HG2 GLU A 142 -2.029 4.346 -10.852 1.00 0.00 H new ATOM 0 HG3 GLU A 142 -2.619 4.801 -9.266 1.00 0.00 H new ATOM 2199 N SER A 143 1.205 7.542 -9.699 1.00 0.00 N ATOM 2200 CA SER A 143 2.526 8.065 -9.372 1.00 0.00 C ATOM 2201 C SER A 143 3.524 6.936 -9.121 1.00 0.00 C ATOM 2202 O SER A 143 4.719 7.198 -8.994 1.00 0.00 O ATOM 2203 CB SER A 143 2.457 8.972 -8.143 1.00 0.00 C ATOM 2204 OG SER A 143 2.931 8.261 -7.007 1.00 0.00 O ATOM 0 H SER A 143 0.643 7.276 -8.890 1.00 0.00 H new ATOM 0 HA SER A 143 2.869 8.646 -10.228 1.00 0.00 H new ATOM 0 HB2 SER A 143 3.058 9.867 -8.303 1.00 0.00 H new ATOM 0 HB3 SER A 143 1.431 9.302 -7.978 1.00 0.00 H new ATOM 0 HG SER A 143 3.041 8.881 -6.256 1.00 0.00 H new ATOM 2210 N ILE A 144 3.009 5.698 -9.046 1.00 0.00 N ATOM 2211 CA ILE A 144 3.815 4.492 -8.807 1.00 0.00 C ATOM 2212 C ILE A 144 5.293 4.778 -8.737 1.00 0.00 C ATOM 2213 O ILE A 144 5.879 5.313 -9.680 1.00 0.00 O ATOM 2214 CB ILE A 144 3.544 3.466 -9.905 1.00 0.00 C ATOM 2215 CG1 ILE A 144 4.313 2.164 -9.640 1.00 0.00 C ATOM 2216 CG2 ILE A 144 4.000 4.041 -11.244 1.00 0.00 C ATOM 2217 CD1 ILE A 144 3.857 1.517 -8.333 1.00 0.00 C ATOM 0 H ILE A 144 2.013 5.506 -9.151 1.00 0.00 H new ATOM 0 HA ILE A 144 3.518 4.098 -7.835 1.00 0.00 H new ATOM 0 HB ILE A 144 2.476 3.247 -9.921 1.00 0.00 H new ATOM 0 HG12 ILE A 144 4.158 1.471 -10.467 1.00 0.00 H new ATOM 0 HG13 ILE A 144 5.382 2.371 -9.594 1.00 0.00 H new ATOM 0 HG21 ILE A 144 3.811 3.315 -12.035 1.00 0.00 H new ATOM 0 HG22 ILE A 144 3.449 4.958 -11.453 1.00 0.00 H new ATOM 0 HG23 ILE A 144 5.067 4.261 -11.201 1.00 0.00 H new ATOM 0 HD11 ILE A 144 4.417 0.596 -8.168 1.00 0.00 H new ATOM 0 HD12 ILE A 144 4.036 2.204 -7.505 1.00 0.00 H new ATOM 0 HD13 ILE A 144 2.793 1.289 -8.392 1.00 0.00 H new ATOM 2229 N LEU A 145 5.891 4.425 -7.609 1.00 0.00 N ATOM 2230 CA LEU A 145 7.306 4.673 -7.437 1.00 0.00 C ATOM 2231 C LEU A 145 8.001 3.514 -6.727 1.00 0.00 C ATOM 2232 O LEU A 145 7.363 2.706 -6.052 1.00 0.00 O ATOM 2233 CB LEU A 145 7.511 5.996 -6.671 1.00 0.00 C ATOM 2234 CG LEU A 145 7.146 5.846 -5.175 1.00 0.00 C ATOM 2235 CD1 LEU A 145 7.642 7.070 -4.410 1.00 0.00 C ATOM 2236 CD2 LEU A 145 5.622 5.733 -5.003 1.00 0.00 C ATOM 0 H LEU A 145 5.428 3.977 -6.819 1.00 0.00 H new ATOM 0 HA LEU A 145 7.762 4.758 -8.423 1.00 0.00 H new ATOM 0 HB2 LEU A 145 8.549 6.314 -6.763 1.00 0.00 H new ATOM 0 HB3 LEU A 145 6.897 6.777 -7.120 1.00 0.00 H new ATOM 0 HG LEU A 145 7.617 4.942 -4.788 1.00 0.00 H new ATOM 0 HD11 LEU A 145 7.387 6.968 -3.355 1.00 0.00 H new ATOM 0 HD12 LEU A 145 8.724 7.151 -4.515 1.00 0.00 H new ATOM 0 HD13 LEU A 145 7.170 7.966 -4.812 1.00 0.00 H new ATOM 0 HD21 LEU A 145 5.382 5.628 -3.945 1.00 0.00 H new ATOM 0 HD22 LEU A 145 5.144 6.630 -5.396 1.00 0.00 H new ATOM 0 HD23 LEU A 145 5.258 4.861 -5.546 1.00 0.00 H new ATOM 2248 N ILE A 146 9.319 3.455 -6.878 1.00 0.00 N ATOM 2249 CA ILE A 146 10.124 2.408 -6.241 1.00 0.00 C ATOM 2250 C ILE A 146 11.489 2.957 -5.790 1.00 0.00 C ATOM 2251 O ILE A 146 12.532 2.414 -6.157 1.00 0.00 O ATOM 2252 CB ILE A 146 10.365 1.235 -7.210 1.00 0.00 C ATOM 2253 CG1 ILE A 146 9.144 1.022 -8.116 1.00 0.00 C ATOM 2254 CG2 ILE A 146 10.631 -0.048 -6.408 1.00 0.00 C ATOM 2255 CD1 ILE A 146 9.099 2.087 -9.222 1.00 0.00 C ATOM 0 H ILE A 146 9.857 4.118 -7.435 1.00 0.00 H new ATOM 0 HA ILE A 146 9.566 2.059 -5.372 1.00 0.00 H new ATOM 0 HB ILE A 146 11.228 1.471 -7.832 1.00 0.00 H new ATOM 0 HG12 ILE A 146 9.184 0.028 -8.562 1.00 0.00 H new ATOM 0 HG13 ILE A 146 8.231 1.068 -7.522 1.00 0.00 H new ATOM 0 HG21 ILE A 146 10.801 -0.877 -7.094 1.00 0.00 H new ATOM 0 HG22 ILE A 146 11.512 0.091 -5.781 1.00 0.00 H new ATOM 0 HG23 ILE A 146 9.769 -0.269 -5.779 1.00 0.00 H new ATOM 0 HD11 ILE A 146 8.227 1.919 -9.854 1.00 0.00 H new ATOM 0 HD12 ILE A 146 9.035 3.077 -8.771 1.00 0.00 H new ATOM 0 HD13 ILE A 146 10.003 2.021 -9.827 1.00 0.00 H new ATOM 2267 N PRO A 147 11.510 4.012 -5.014 1.00 0.00 N ATOM 2268 CA PRO A 147 12.775 4.625 -4.527 1.00 0.00 C ATOM 2269 C PRO A 147 13.791 3.590 -4.085 1.00 0.00 C ATOM 2270 O PRO A 147 14.861 3.460 -4.675 1.00 0.00 O ATOM 2271 CB PRO A 147 12.338 5.493 -3.348 1.00 0.00 C ATOM 2272 CG PRO A 147 10.901 5.810 -3.586 1.00 0.00 C ATOM 2273 CD PRO A 147 10.336 4.733 -4.518 1.00 0.00 C ATOM 0 HA PRO A 147 13.274 5.189 -5.315 1.00 0.00 H new ATOM 0 HB2 PRO A 147 12.470 4.965 -2.404 1.00 0.00 H new ATOM 0 HB3 PRO A 147 12.935 6.403 -3.291 1.00 0.00 H new ATOM 0 HG2 PRO A 147 10.352 5.828 -2.645 1.00 0.00 H new ATOM 0 HG3 PRO A 147 10.796 6.798 -4.035 1.00 0.00 H new ATOM 0 HD2 PRO A 147 9.658 4.066 -3.986 1.00 0.00 H new ATOM 0 HD3 PRO A 147 9.769 5.176 -5.337 1.00 0.00 H new ATOM 2281 N ARG A 148 13.444 2.875 -3.034 1.00 0.00 N ATOM 2282 CA ARG A 148 14.332 1.848 -2.482 1.00 0.00 C ATOM 2283 C ARG A 148 13.734 1.214 -1.227 1.00 0.00 C ATOM 2284 O ARG A 148 12.586 1.476 -0.869 1.00 0.00 O ATOM 2285 CB ARG A 148 15.685 2.485 -2.129 1.00 0.00 C ATOM 2286 CG ARG A 148 16.792 2.035 -3.099 1.00 0.00 C ATOM 2287 CD ARG A 148 17.823 3.155 -3.228 1.00 0.00 C ATOM 2288 NE ARG A 148 18.426 3.437 -1.930 1.00 0.00 N ATOM 2289 CZ ARG A 148 19.511 4.197 -1.826 1.00 0.00 C ATOM 2290 NH1 ARG A 148 20.035 4.428 -0.653 1.00 0.00 N ATOM 2291 NH2 ARG A 148 20.051 4.716 -2.895 1.00 0.00 N ATOM 0 H ARG A 148 12.558 2.979 -2.540 1.00 0.00 H new ATOM 0 HA ARG A 148 14.462 1.068 -3.233 1.00 0.00 H new ATOM 0 HB2 ARG A 148 15.595 3.571 -2.157 1.00 0.00 H new ATOM 0 HB3 ARG A 148 15.961 2.214 -1.110 1.00 0.00 H new ATOM 0 HG2 ARG A 148 17.268 1.125 -2.732 1.00 0.00 H new ATOM 0 HG3 ARG A 148 16.366 1.801 -4.075 1.00 0.00 H new ATOM 0 HD2 ARG A 148 18.596 2.868 -3.941 1.00 0.00 H new ATOM 0 HD3 ARG A 148 17.347 4.054 -3.619 1.00 0.00 H new ATOM 0 HE ARG A 148 18.007 3.044 -1.087 1.00 0.00 H new ATOM 0 HH11 ARG A 148 19.612 4.025 0.183 1.00 0.00 H new ATOM 0 HH12 ARG A 148 20.868 5.011 -0.572 1.00 0.00 H new ATOM 0 HH21 ARG A 148 19.640 4.538 -3.812 1.00 0.00 H new ATOM 0 HH22 ARG A 148 20.884 5.299 -2.814 1.00 0.00 H new ATOM 2305 N GLN A 149 14.534 0.375 -0.565 1.00 0.00 N ATOM 2306 CA GLN A 149 14.097 -0.304 0.652 1.00 0.00 C ATOM 2307 C GLN A 149 15.040 0.010 1.811 1.00 0.00 C ATOM 2308 O GLN A 149 15.566 -0.897 2.459 1.00 0.00 O ATOM 2309 CB GLN A 149 14.064 -1.819 0.424 1.00 0.00 C ATOM 2310 CG GLN A 149 13.604 -2.122 -1.004 1.00 0.00 C ATOM 2311 CD GLN A 149 12.238 -1.493 -1.257 1.00 0.00 C ATOM 2312 OE1 GLN A 149 11.489 -1.231 -0.315 1.00 0.00 O ATOM 2313 NE2 GLN A 149 11.865 -1.236 -2.481 1.00 0.00 N ATOM 0 H GLN A 149 15.487 0.151 -0.853 1.00 0.00 H new ATOM 0 HA GLN A 149 13.097 0.051 0.901 1.00 0.00 H new ATOM 0 HB2 GLN A 149 15.054 -2.243 0.594 1.00 0.00 H new ATOM 0 HB3 GLN A 149 13.389 -2.288 1.140 1.00 0.00 H new ATOM 0 HG2 GLN A 149 14.330 -1.734 -1.719 1.00 0.00 H new ATOM 0 HG3 GLN A 149 13.551 -3.200 -1.157 1.00 0.00 H new ATOM 0 HE21 GLN A 149 12.487 -1.454 -3.260 1.00 0.00 H new ATOM 0 HE22 GLN A 149 10.952 -0.817 -2.659 1.00 0.00 H new ATOM 2322 N SER A 150 15.252 1.296 2.069 1.00 0.00 N ATOM 2323 CA SER A 150 16.135 1.712 3.155 1.00 0.00 C ATOM 2324 C SER A 150 15.754 1.004 4.448 1.00 0.00 C ATOM 2325 O SER A 150 14.783 1.376 5.104 1.00 0.00 O ATOM 2326 CB SER A 150 16.040 3.225 3.356 1.00 0.00 C ATOM 2327 OG SER A 150 17.002 3.631 4.322 1.00 0.00 O ATOM 0 H SER A 150 14.829 2.063 1.547 1.00 0.00 H new ATOM 0 HA SER A 150 17.158 1.445 2.891 1.00 0.00 H new ATOM 0 HB2 SER A 150 16.215 3.741 2.412 1.00 0.00 H new ATOM 0 HB3 SER A 150 15.038 3.498 3.687 1.00 0.00 H new ATOM 0 HG SER A 150 16.549 3.853 5.162 1.00 0.00 H new ATOM 2333 N GLU A 151 16.515 -0.027 4.802 1.00 0.00 N ATOM 2334 CA GLU A 151 16.246 -0.796 6.012 1.00 0.00 C ATOM 2335 C GLU A 151 15.768 0.101 7.152 1.00 0.00 C ATOM 2336 O GLU A 151 15.068 -0.353 8.056 1.00 0.00 O ATOM 2337 CB GLU A 151 17.511 -1.539 6.446 1.00 0.00 C ATOM 2338 CG GLU A 151 18.735 -0.666 6.169 1.00 0.00 C ATOM 2339 CD GLU A 151 19.208 -0.868 4.735 1.00 0.00 C ATOM 2340 OE1 GLU A 151 19.610 -1.974 4.415 1.00 0.00 O ATOM 2341 OE2 GLU A 151 19.160 0.086 3.977 1.00 0.00 O ATOM 0 H GLU A 151 17.322 -0.349 4.268 1.00 0.00 H new ATOM 0 HA GLU A 151 15.454 -1.509 5.784 1.00 0.00 H new ATOM 0 HB2 GLU A 151 17.457 -1.782 7.507 1.00 0.00 H new ATOM 0 HB3 GLU A 151 17.594 -2.483 5.907 1.00 0.00 H new ATOM 0 HG2 GLU A 151 18.488 0.383 6.335 1.00 0.00 H new ATOM 0 HG3 GLU A 151 19.536 -0.919 6.864 1.00 0.00 H new ATOM 2348 N THR A 152 16.151 1.372 7.107 1.00 0.00 N ATOM 2349 CA THR A 152 15.751 2.307 8.151 1.00 0.00 C ATOM 2350 C THR A 152 15.750 3.741 7.634 1.00 0.00 C ATOM 2351 O THR A 152 16.594 4.122 6.825 1.00 0.00 O ATOM 2352 CB THR A 152 16.706 2.196 9.342 1.00 0.00 C ATOM 2353 OG1 THR A 152 16.907 3.486 9.906 1.00 0.00 O ATOM 2354 CG2 THR A 152 18.046 1.628 8.874 1.00 0.00 C ATOM 0 H THR A 152 16.730 1.774 6.370 1.00 0.00 H new ATOM 0 HA THR A 152 14.739 2.051 8.464 1.00 0.00 H new ATOM 0 HB THR A 152 16.276 1.532 10.092 1.00 0.00 H new ATOM 0 HG1 THR A 152 17.517 3.418 10.670 1.00 0.00 H new ATOM 0 HG21 THR A 152 18.725 1.550 9.723 1.00 0.00 H new ATOM 0 HG22 THR A 152 17.891 0.640 8.441 1.00 0.00 H new ATOM 0 HG23 THR A 152 18.479 2.289 8.123 1.00 0.00 H new ATOM 2362 N CYS A 153 14.794 4.529 8.116 1.00 0.00 N ATOM 2363 CA CYS A 153 14.687 5.918 7.708 1.00 0.00 C ATOM 2364 C CYS A 153 15.955 6.672 8.082 1.00 0.00 C ATOM 2365 O CYS A 153 16.398 6.638 9.228 1.00 0.00 O ATOM 2366 CB CYS A 153 13.479 6.570 8.386 1.00 0.00 C ATOM 2367 SG CYS A 153 14.024 8.020 9.321 1.00 0.00 S ATOM 0 H CYS A 153 14.087 4.228 8.787 1.00 0.00 H new ATOM 0 HA CYS A 153 14.556 5.958 6.627 1.00 0.00 H new ATOM 0 HB2 CYS A 153 12.742 6.862 7.638 1.00 0.00 H new ATOM 0 HB3 CYS A 153 12.993 5.857 9.051 1.00 0.00 H new ATOM 2372 N SER A 154 16.530 7.350 7.101 1.00 0.00 N ATOM 2373 CA SER A 154 17.747 8.112 7.323 1.00 0.00 C ATOM 2374 C SER A 154 18.046 9.016 6.128 1.00 0.00 C ATOM 2375 O SER A 154 18.249 10.218 6.298 1.00 0.00 O ATOM 2376 CB SER A 154 18.928 7.171 7.577 1.00 0.00 C ATOM 2377 OG SER A 154 18.508 5.827 7.383 1.00 0.00 O ATOM 0 H SER A 154 16.174 7.388 6.146 1.00 0.00 H new ATOM 0 HA SER A 154 17.599 8.738 8.203 1.00 0.00 H new ATOM 0 HB2 SER A 154 19.749 7.409 6.901 1.00 0.00 H new ATOM 0 HB3 SER A 154 19.302 7.304 8.592 1.00 0.00 H new ATOM 0 HG SER A 154 19.262 5.222 7.544 1.00 0.00 H new ATOM 2383 N PRO A 155 18.081 8.478 4.929 1.00 0.00 N ATOM 2384 CA PRO A 155 18.364 9.288 3.713 1.00 0.00 C ATOM 2385 C PRO A 155 17.598 10.609 3.706 1.00 0.00 C ATOM 2386 O PRO A 155 16.373 10.628 3.590 1.00 0.00 O ATOM 2387 CB PRO A 155 17.920 8.382 2.567 1.00 0.00 C ATOM 2388 CG PRO A 155 18.108 6.996 3.081 1.00 0.00 C ATOM 2389 CD PRO A 155 17.860 7.055 4.589 1.00 0.00 C ATOM 0 HA PRO A 155 19.412 9.579 3.647 1.00 0.00 H new ATOM 0 HB2 PRO A 155 16.880 8.566 2.298 1.00 0.00 H new ATOM 0 HB3 PRO A 155 18.517 8.556 1.672 1.00 0.00 H new ATOM 0 HG2 PRO A 155 17.414 6.307 2.600 1.00 0.00 H new ATOM 0 HG3 PRO A 155 19.114 6.636 2.867 1.00 0.00 H new ATOM 0 HD2 PRO A 155 16.848 6.736 4.841 1.00 0.00 H new ATOM 0 HD3 PRO A 155 18.544 6.403 5.132 1.00 0.00 H new ATOM 2397 N GLY A 156 18.335 11.710 3.831 1.00 0.00 N ATOM 2398 CA GLY A 156 17.724 13.035 3.839 1.00 0.00 C ATOM 2399 C GLY A 156 18.037 13.789 2.551 1.00 0.00 C ATOM 2400 O GLY A 156 19.197 13.907 2.155 1.00 0.00 O ATOM 0 H GLY A 156 19.350 11.711 3.928 1.00 0.00 H new ATOM 0 HA2 GLY A 156 16.644 12.941 3.956 1.00 0.00 H new ATOM 0 HA3 GLY A 156 18.089 13.603 4.695 1.00 0.00 H new ATOM 2404 N SER A 157 16.995 14.298 1.900 1.00 0.00 N ATOM 2405 CA SER A 157 17.172 15.040 0.657 1.00 0.00 C ATOM 2406 C SER A 157 16.039 16.043 0.466 1.00 0.00 C ATOM 2407 O SER A 157 14.957 15.691 -0.005 1.00 0.00 O ATOM 2408 CB SER A 157 17.204 14.073 -0.528 1.00 0.00 C ATOM 2409 OG SER A 157 17.511 14.795 -1.713 1.00 0.00 O ATOM 0 H SER A 157 16.027 14.211 2.210 1.00 0.00 H new ATOM 0 HA SER A 157 18.117 15.581 0.710 1.00 0.00 H new ATOM 0 HB2 SER A 157 17.949 13.296 -0.358 1.00 0.00 H new ATOM 0 HB3 SER A 157 16.241 13.574 -0.631 1.00 0.00 H new ATOM 0 HG SER A 157 17.534 14.179 -2.475 1.00 0.00 H new ATOM 2415 N ASP A 158 16.295 17.294 0.832 1.00 0.00 N ATOM 2416 CA ASP A 158 15.289 18.342 0.697 1.00 0.00 C ATOM 2417 C ASP A 158 15.577 19.206 -0.527 1.00 0.00 C ATOM 2418 O ASP A 158 15.021 20.289 -0.608 1.00 0.00 O ATOM 2419 CB ASP A 158 15.276 19.220 1.951 1.00 0.00 C ATOM 2420 CG ASP A 158 15.661 18.390 3.171 1.00 0.00 C ATOM 2421 OD1 ASP A 158 16.788 17.928 3.218 1.00 0.00 O ATOM 2422 OD2 ASP A 158 14.820 18.230 4.042 1.00 0.00 O ATOM 2423 OXT ASP A 158 16.349 18.771 -1.366 1.00 0.00 O ATOM 0 H ASP A 158 17.184 17.606 1.222 1.00 0.00 H new ATOM 0 HA ASP A 158 14.314 17.870 0.574 1.00 0.00 H new ATOM 0 HB2 ASP A 158 15.972 20.050 1.831 1.00 0.00 H new ATOM 0 HB3 ASP A 158 14.285 19.652 2.092 1.00 0.00 H new TER 2428 ASP A 158