USER MOD reduce.3.24.130724 H: found=0, std=0, add=833, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 831 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 32 SER OG : rot -110:sc= -3.51! USER MOD Set 1.2: A 61 THR OG1 : rot 40:sc= -0.681 USER MOD Set 2.1: A 28 ASN : amide:sc= -9.12! K(o=-19!,f=-7.6) USER MOD Set 2.2: A 63 ASN : amide:sc= -10! K(o=-19!,f=-7.6) USER MOD Single : A 1 GLU N :NH3+ 144:sc= -1.55 (180deg=-4.01!) USER MOD Single : A 2 TYR OH : rot 180:sc= 0 USER MOD Single : A 3 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 7 ASN : amide:sc= -0.0046 X(o=-0.0046,f=0) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 GLN : amide:sc= -4.14! K(o=-4.1!,f=-1.2) USER MOD Single : A 15 SER OG : rot -46:sc= 0.767 USER MOD Single : A 18 TYR OH : rot -109:sc= -5.7! USER MOD Single : A 20 SER OG : rot -133:sc= -0.63 USER MOD Single : A 23 THR OG1 : rot -119:sc= -3.8! USER MOD Single : A 38 THR OG1 : rot 76:sc= -0.339 USER MOD Single : A 44 SER OG : rot 163:sc= 1.05 USER MOD Single : A 49 HIS : no HD1:sc= 0 X(o=0,f=-0.02) USER MOD Single : A 52 THR OG1 : rot 180:sc= -0.79 USER MOD Single : A 54 SER OG : rot 100:sc= -3.27! USER MOD Single : A 56 LYS NZ :NH3+ 167:sc= 0.849 (180deg=0.555) USER MOD Single : A 57 THR OG1 : rot -96:sc= -2.33! USER MOD Single : A 58 GLN : amide:sc= -0.11 K(o=-0.11,f=-0.78) USER MOD Single : A 59 SER OG : rot 120:sc= -0.558 USER MOD Single : A 62 LYS NZ :NH3+ -159:sc= -0.0657 (180deg=-0.535) USER MOD Single : A 67 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 68 CYS SG : rot 28:sc= 1.1 USER MOD Single : A 72 SER OG : rot 41:sc= 0.948 USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 HIS : no HD1:sc= -0.372 X(o=-0.37,f=-0.46) USER MOD Single : A 97 HIS : no HD1:sc= -4.19! K(o=-4.2!,f=0.36) USER MOD Single : A 98 TYR OH : rot -20:sc= 0.535 USER MOD Single : A 99 MET CE :methyl 145:sc= -0.397 (180deg=-1.84!) USER MOD Single : A 136 TYR OH : rot 99:sc= -2.63! USER MOD Single : A 137 TYR OH : rot -140:sc= -6.05! USER MOD Single : A 139 TYR OH : rot -12:sc= -3.57! USER MOD Single : A 140 SER OG : rot 180:sc= 0.36 USER MOD Single : A 144 LYS NZ :NH3+ -144:sc= -0.588 (180deg=-2.9!) USER MOD Single : A 150 SER OG : rot 180:sc= 0 USER MOD Single : A 154 SER OG : rot 180:sc= 0 USER MOD Single : B 165 SER OG : rot 180:sc=0.000619 USER MOD Single : B 166 THR OG1 : rot 180:sc=-0.00423 USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 1 -6.331 -22.454 8.556 1.00 0.00 N ATOM 2 CA GLU A 1 -5.723 -21.116 8.816 1.00 0.00 C ATOM 3 C GLU A 1 -5.763 -20.257 7.548 1.00 0.00 C ATOM 4 O GLU A 1 -6.092 -19.088 7.590 1.00 0.00 O ATOM 5 CB GLU A 1 -4.277 -21.405 9.225 1.00 0.00 C ATOM 6 CG GLU A 1 -3.668 -22.447 8.282 1.00 0.00 C ATOM 7 CD GLU A 1 -2.616 -21.780 7.394 1.00 0.00 C ATOM 8 OE1 GLU A 1 -2.624 -20.563 7.313 1.00 0.00 O ATOM 9 OE2 GLU A 1 -1.820 -22.498 6.812 1.00 0.00 O ATOM 0 H1 GLU A 1 -5.814 -23.180 9.092 1.00 0.00 H new ATOM 0 H2 GLU A 1 -7.327 -22.447 8.854 1.00 0.00 H new ATOM 0 H3 GLU A 1 -6.276 -22.669 7.540 1.00 0.00 H new ATOM 0 HA GLU A 1 -6.260 -20.565 9.588 1.00 0.00 H new ATOM 0 HB2 GLU A 1 -3.691 -20.487 9.194 1.00 0.00 H new ATOM 0 HB3 GLU A 1 -4.246 -21.769 10.252 1.00 0.00 H new ATOM 0 HG2 GLU A 1 -3.214 -23.253 8.858 1.00 0.00 H new ATOM 0 HG3 GLU A 1 -4.448 -22.895 7.666 1.00 0.00 H new ATOM 15 N TYR A 2 -5.433 -20.825 6.419 1.00 0.00 N ATOM 16 CA TYR A 2 -5.454 -20.037 5.154 1.00 0.00 C ATOM 17 C TYR A 2 -6.888 -19.615 4.819 1.00 0.00 C ATOM 18 O TYR A 2 -7.128 -18.528 4.332 1.00 0.00 O ATOM 19 CB TYR A 2 -4.912 -20.987 4.086 1.00 0.00 C ATOM 20 CG TYR A 2 -5.943 -22.046 3.783 1.00 0.00 C ATOM 21 CD1 TYR A 2 -6.935 -21.804 2.825 1.00 0.00 C ATOM 22 CD2 TYR A 2 -5.909 -23.271 4.460 1.00 0.00 C ATOM 23 CE1 TYR A 2 -7.892 -22.786 2.544 1.00 0.00 C ATOM 24 CE2 TYR A 2 -6.865 -24.254 4.179 1.00 0.00 C ATOM 25 CZ TYR A 2 -7.857 -24.011 3.220 1.00 0.00 C ATOM 26 OH TYR A 2 -8.800 -24.980 2.944 1.00 0.00 O ATOM 0 H TYR A 2 -5.150 -21.800 6.319 1.00 0.00 H new ATOM 0 HA TYR A 2 -4.862 -19.125 5.226 1.00 0.00 H new ATOM 0 HB2 TYR A 2 -4.669 -20.432 3.180 1.00 0.00 H new ATOM 0 HB3 TYR A 2 -3.989 -21.452 4.432 1.00 0.00 H new ATOM 0 HD1 TYR A 2 -6.962 -20.859 2.303 1.00 0.00 H new ATOM 0 HD2 TYR A 2 -5.145 -23.458 5.200 1.00 0.00 H new ATOM 0 HE1 TYR A 2 -8.657 -22.598 1.806 1.00 0.00 H new ATOM 0 HE2 TYR A 2 -6.838 -25.199 4.701 1.00 0.00 H new ATOM 0 HH TYR A 2 -8.631 -25.769 3.500 1.00 0.00 H new ATOM 36 N GLN A 3 -7.841 -20.467 5.074 1.00 0.00 N ATOM 37 CA GLN A 3 -9.257 -20.116 4.770 1.00 0.00 C ATOM 38 C GLN A 3 -9.746 -19.018 5.720 1.00 0.00 C ATOM 39 O GLN A 3 -10.546 -18.178 5.356 1.00 0.00 O ATOM 40 CB GLN A 3 -10.044 -21.407 4.993 1.00 0.00 C ATOM 41 CG GLN A 3 -11.462 -21.244 4.447 1.00 0.00 C ATOM 42 CD GLN A 3 -11.619 -22.077 3.173 1.00 0.00 C ATOM 43 OE1 GLN A 3 -11.255 -21.639 2.100 1.00 0.00 O ATOM 44 NE2 GLN A 3 -12.148 -23.266 3.247 1.00 0.00 N ATOM 0 H GLN A 3 -7.701 -21.392 5.480 1.00 0.00 H new ATOM 0 HA GLN A 3 -9.378 -19.736 3.756 1.00 0.00 H new ATOM 0 HB2 GLN A 3 -9.546 -22.239 4.496 1.00 0.00 H new ATOM 0 HB3 GLN A 3 -10.078 -21.645 6.056 1.00 0.00 H new ATOM 0 HG2 GLN A 3 -12.189 -21.562 5.194 1.00 0.00 H new ATOM 0 HG3 GLN A 3 -11.662 -20.194 4.234 1.00 0.00 H new ATOM 0 HE21 GLN A 3 -12.453 -23.633 4.148 1.00 0.00 H new ATOM 0 HE22 GLN A 3 -12.257 -23.829 2.404 1.00 0.00 H new ATOM 53 N LEU A 4 -9.275 -19.022 6.937 1.00 0.00 N ATOM 54 CA LEU A 4 -9.716 -17.982 7.913 1.00 0.00 C ATOM 55 C LEU A 4 -9.208 -16.600 7.491 1.00 0.00 C ATOM 56 O LEU A 4 -9.947 -15.635 7.479 1.00 0.00 O ATOM 57 CB LEU A 4 -9.085 -18.401 9.242 1.00 0.00 C ATOM 58 CG LEU A 4 -9.851 -19.592 9.821 1.00 0.00 C ATOM 59 CD1 LEU A 4 -8.865 -20.580 10.446 1.00 0.00 C ATOM 60 CD2 LEU A 4 -10.824 -19.098 10.894 1.00 0.00 C ATOM 0 H LEU A 4 -8.604 -19.700 7.299 1.00 0.00 H new ATOM 0 HA LEU A 4 -10.802 -17.911 7.976 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -8.039 -18.667 9.091 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -9.104 -17.567 9.944 1.00 0.00 H new ATOM 0 HG LEU A 4 -10.406 -20.088 9.025 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -9.412 -21.428 10.858 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -8.170 -20.932 9.684 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -8.309 -20.085 11.242 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -11.371 -19.946 11.308 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -10.267 -18.602 11.689 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -11.528 -18.394 10.450 1.00 0.00 H new ATOM 72 N VAL A 5 -7.954 -16.497 7.148 1.00 0.00 N ATOM 73 CA VAL A 5 -7.400 -15.175 6.732 1.00 0.00 C ATOM 74 C VAL A 5 -7.928 -14.785 5.347 1.00 0.00 C ATOM 75 O VAL A 5 -8.199 -13.632 5.079 1.00 0.00 O ATOM 76 CB VAL A 5 -5.884 -15.368 6.696 1.00 0.00 C ATOM 77 CG1 VAL A 5 -5.383 -15.735 8.093 1.00 0.00 C ATOM 78 CG2 VAL A 5 -5.534 -16.493 5.720 1.00 0.00 C ATOM 0 H VAL A 5 -7.288 -17.270 7.137 1.00 0.00 H new ATOM 0 HA VAL A 5 -7.691 -14.377 7.415 1.00 0.00 H new ATOM 0 HB VAL A 5 -5.410 -14.442 6.370 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -4.302 -15.873 8.067 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -5.630 -14.935 8.790 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -5.859 -16.660 8.419 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -4.453 -16.630 5.695 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -6.009 -17.418 6.046 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -5.890 -16.234 4.723 1.00 0.00 H new ATOM 88 N VAL A 6 -8.070 -15.735 4.464 1.00 0.00 N ATOM 89 CA VAL A 6 -8.574 -15.415 3.098 1.00 0.00 C ATOM 90 C VAL A 6 -9.955 -14.758 3.180 1.00 0.00 C ATOM 91 O VAL A 6 -10.301 -13.918 2.373 1.00 0.00 O ATOM 92 CB VAL A 6 -8.663 -16.764 2.382 1.00 0.00 C ATOM 93 CG1 VAL A 6 -9.531 -16.622 1.129 1.00 0.00 C ATOM 94 CG2 VAL A 6 -7.259 -17.218 1.977 1.00 0.00 C ATOM 0 H VAL A 6 -7.859 -16.719 4.629 1.00 0.00 H new ATOM 0 HA VAL A 6 -7.923 -14.716 2.573 1.00 0.00 H new ATOM 0 HB VAL A 6 -9.107 -17.501 3.051 1.00 0.00 H new ATOM 0 HG11 VAL A 6 -9.594 -17.583 0.619 1.00 0.00 H new ATOM 0 HG12 VAL A 6 -10.531 -16.296 1.414 1.00 0.00 H new ATOM 0 HG13 VAL A 6 -9.086 -15.885 0.460 1.00 0.00 H new ATOM 0 HG21 VAL A 6 -7.320 -18.179 1.467 1.00 0.00 H new ATOM 0 HG22 VAL A 6 -6.817 -16.480 1.308 1.00 0.00 H new ATOM 0 HG23 VAL A 6 -6.638 -17.319 2.867 1.00 0.00 H new ATOM 104 N ASN A 7 -10.748 -15.132 4.147 1.00 0.00 N ATOM 105 CA ASN A 7 -12.103 -14.523 4.275 1.00 0.00 C ATOM 106 C ASN A 7 -11.984 -13.010 4.480 1.00 0.00 C ATOM 107 O ASN A 7 -12.680 -12.232 3.859 1.00 0.00 O ATOM 108 CB ASN A 7 -12.720 -15.184 5.507 1.00 0.00 C ATOM 109 CG ASN A 7 -14.220 -15.382 5.284 1.00 0.00 C ATOM 110 OD1 ASN A 7 -15.031 -14.771 5.949 1.00 0.00 O ATOM 111 ND2 ASN A 7 -14.625 -16.219 4.368 1.00 0.00 N ATOM 0 H ASN A 7 -10.517 -15.831 4.853 1.00 0.00 H new ATOM 0 HA ASN A 7 -12.711 -14.676 3.384 1.00 0.00 H new ATOM 0 HB2 ASN A 7 -12.240 -16.144 5.696 1.00 0.00 H new ATOM 0 HB3 ASN A 7 -12.551 -14.564 6.388 1.00 0.00 H new ATOM 0 HD21 ASN A 7 -15.623 -16.360 4.211 1.00 0.00 H new ATOM 0 HD22 ASN A 7 -13.943 -16.732 3.809 1.00 0.00 H new ATOM 118 N ALA A 8 -11.104 -12.591 5.346 1.00 0.00 N ATOM 119 CA ALA A 8 -10.934 -11.129 5.595 1.00 0.00 C ATOM 120 C ALA A 8 -10.363 -10.445 4.354 1.00 0.00 C ATOM 121 O ALA A 8 -10.798 -9.381 3.962 1.00 0.00 O ATOM 122 CB ALA A 8 -9.936 -11.046 6.744 1.00 0.00 C ATOM 0 H ALA A 8 -10.494 -13.197 5.894 1.00 0.00 H new ATOM 0 HA ALA A 8 -11.878 -10.636 5.828 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -9.753 -10.001 6.992 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -10.341 -11.561 7.615 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -8.999 -11.518 6.447 1.00 0.00 H new ATOM 128 N VAL A 9 -9.392 -11.052 3.732 1.00 0.00 N ATOM 129 CA VAL A 9 -8.792 -10.442 2.513 1.00 0.00 C ATOM 130 C VAL A 9 -9.883 -10.208 1.474 1.00 0.00 C ATOM 131 O VAL A 9 -9.901 -9.206 0.787 1.00 0.00 O ATOM 132 CB VAL A 9 -7.779 -11.470 2.009 1.00 0.00 C ATOM 133 CG1 VAL A 9 -7.093 -10.937 0.750 1.00 0.00 C ATOM 134 CG2 VAL A 9 -6.727 -11.721 3.092 1.00 0.00 C ATOM 0 H VAL A 9 -8.988 -11.945 4.015 1.00 0.00 H new ATOM 0 HA VAL A 9 -8.320 -9.480 2.713 1.00 0.00 H new ATOM 0 HB VAL A 9 -8.294 -12.402 1.776 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -6.371 -11.670 0.391 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -7.840 -10.755 -0.022 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -6.578 -10.005 0.983 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -6.004 -12.454 2.734 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -6.213 -10.788 3.324 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -7.213 -12.100 3.991 1.00 0.00 H new ATOM 144 N ARG A 10 -10.796 -11.129 1.356 1.00 0.00 N ATOM 145 CA ARG A 10 -11.894 -10.964 0.361 1.00 0.00 C ATOM 146 C ARG A 10 -12.622 -9.640 0.605 1.00 0.00 C ATOM 147 O ARG A 10 -12.842 -8.864 -0.304 1.00 0.00 O ATOM 148 CB ARG A 10 -12.833 -12.148 0.606 1.00 0.00 C ATOM 149 CG ARG A 10 -14.206 -11.846 0.003 1.00 0.00 C ATOM 150 CD ARG A 10 -15.016 -13.140 -0.100 1.00 0.00 C ATOM 151 NE ARG A 10 -16.008 -12.886 -1.182 1.00 0.00 N ATOM 152 CZ ARG A 10 -17.073 -13.635 -1.282 1.00 0.00 C ATOM 153 NH1 ARG A 10 -17.272 -14.607 -0.435 1.00 0.00 N ATOM 154 NH2 ARG A 10 -17.941 -13.410 -2.231 1.00 0.00 N ATOM 0 H ARG A 10 -10.831 -11.989 1.904 1.00 0.00 H new ATOM 0 HA ARG A 10 -11.527 -10.944 -0.665 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -12.419 -13.052 0.159 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -12.927 -12.335 1.676 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -14.735 -11.122 0.622 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -14.091 -11.398 -0.984 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -14.376 -13.989 -0.342 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -15.511 -13.373 0.843 1.00 0.00 H new ATOM 0 HE ARG A 10 -15.855 -12.126 -1.845 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -16.595 -14.783 0.307 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -18.105 -15.191 -0.515 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -17.787 -12.650 -2.893 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -18.773 -13.994 -2.310 1.00 0.00 H new ATOM 168 N LYS A 11 -12.994 -9.372 1.826 1.00 0.00 N ATOM 169 CA LYS A 11 -13.701 -8.094 2.126 1.00 0.00 C ATOM 170 C LYS A 11 -12.699 -6.937 2.192 1.00 0.00 C ATOM 171 O LYS A 11 -13.006 -5.816 1.838 1.00 0.00 O ATOM 172 CB LYS A 11 -14.358 -8.314 3.489 1.00 0.00 C ATOM 173 CG LYS A 11 -15.689 -7.562 3.540 1.00 0.00 C ATOM 174 CD LYS A 11 -16.714 -8.386 4.323 1.00 0.00 C ATOM 175 CE LYS A 11 -17.121 -9.611 3.501 1.00 0.00 C ATOM 176 NZ LYS A 11 -17.649 -10.583 4.497 1.00 0.00 N ATOM 0 H LYS A 11 -12.839 -9.982 2.629 1.00 0.00 H new ATOM 0 HA LYS A 11 -14.432 -7.837 1.359 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -14.522 -9.378 3.658 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -13.699 -7.963 4.283 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -15.551 -6.590 4.013 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -16.052 -7.376 2.529 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -16.291 -8.700 5.277 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -17.590 -7.778 4.547 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -17.878 -9.355 2.759 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -16.270 -10.024 2.959 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -17.949 -11.451 4.009 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -16.905 -10.813 5.186 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -18.462 -10.165 4.992 1.00 0.00 H new ATOM 190 N LEU A 12 -11.502 -7.200 2.643 1.00 0.00 N ATOM 191 CA LEU A 12 -10.482 -6.114 2.732 1.00 0.00 C ATOM 192 C LEU A 12 -10.042 -5.684 1.331 1.00 0.00 C ATOM 193 O LEU A 12 -9.923 -4.509 1.041 1.00 0.00 O ATOM 194 CB LEU A 12 -9.308 -6.733 3.492 1.00 0.00 C ATOM 195 CG LEU A 12 -9.149 -6.037 4.844 1.00 0.00 C ATOM 196 CD1 LEU A 12 -8.541 -7.013 5.854 1.00 0.00 C ATOM 197 CD2 LEU A 12 -8.224 -4.827 4.687 1.00 0.00 C ATOM 0 H LEU A 12 -11.186 -8.119 2.954 1.00 0.00 H new ATOM 0 HA LEU A 12 -10.870 -5.226 3.231 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -9.478 -7.800 3.638 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -8.392 -6.633 2.910 1.00 0.00 H new ATOM 0 HG LEU A 12 -10.125 -5.708 5.200 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -8.428 -6.516 6.818 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -9.197 -7.876 5.966 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -7.565 -7.343 5.499 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -8.109 -4.329 5.650 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -7.248 -5.159 4.331 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -8.655 -4.131 3.968 1.00 0.00 H new ATOM 209 N GLN A 13 -9.800 -6.624 0.460 1.00 0.00 N ATOM 210 CA GLN A 13 -9.367 -6.266 -0.922 1.00 0.00 C ATOM 211 C GLN A 13 -10.493 -5.530 -1.653 1.00 0.00 C ATOM 212 O GLN A 13 -10.254 -4.653 -2.459 1.00 0.00 O ATOM 213 CB GLN A 13 -9.070 -7.604 -1.602 1.00 0.00 C ATOM 214 CG GLN A 13 -10.381 -8.346 -1.865 1.00 0.00 C ATOM 215 CD GLN A 13 -10.082 -9.696 -2.519 1.00 0.00 C ATOM 216 OE1 GLN A 13 -10.296 -9.872 -3.702 1.00 0.00 O ATOM 217 NE2 GLN A 13 -9.592 -10.665 -1.793 1.00 0.00 N ATOM 0 H GLN A 13 -9.883 -7.624 0.644 1.00 0.00 H new ATOM 0 HA GLN A 13 -8.500 -5.605 -0.927 1.00 0.00 H new ATOM 0 HB2 GLN A 13 -8.540 -7.437 -2.540 1.00 0.00 H new ATOM 0 HB3 GLN A 13 -8.419 -8.208 -0.970 1.00 0.00 H new ATOM 0 HG2 GLN A 13 -10.921 -8.495 -0.930 1.00 0.00 H new ATOM 0 HG3 GLN A 13 -11.024 -7.751 -2.513 1.00 0.00 H new ATOM 0 HE21 GLN A 13 -9.412 -10.517 -0.800 1.00 0.00 H new ATOM 0 HE22 GLN A 13 -9.389 -11.569 -2.219 1.00 0.00 H new ATOM 226 N GLU A 14 -11.719 -5.880 -1.375 1.00 0.00 N ATOM 227 CA GLU A 14 -12.861 -5.200 -2.052 1.00 0.00 C ATOM 228 C GLU A 14 -12.930 -3.730 -1.630 1.00 0.00 C ATOM 229 O GLU A 14 -13.329 -2.873 -2.392 1.00 0.00 O ATOM 230 CB GLU A 14 -14.105 -5.953 -1.579 1.00 0.00 C ATOM 231 CG GLU A 14 -14.834 -6.547 -2.785 1.00 0.00 C ATOM 232 CD GLU A 14 -15.608 -7.794 -2.350 1.00 0.00 C ATOM 233 OE1 GLU A 14 -16.112 -7.797 -1.239 1.00 0.00 O ATOM 234 OE2 GLU A 14 -15.682 -8.724 -3.135 1.00 0.00 O ATOM 0 H GLU A 14 -11.980 -6.607 -0.709 1.00 0.00 H new ATOM 0 HA GLU A 14 -12.764 -5.212 -3.138 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -13.821 -6.745 -0.886 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -14.767 -5.278 -1.037 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -15.517 -5.811 -3.209 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -14.118 -6.804 -3.566 1.00 0.00 H new ATOM 241 N SER A 15 -12.544 -3.433 -0.419 1.00 0.00 N ATOM 242 CA SER A 15 -12.588 -2.019 0.053 1.00 0.00 C ATOM 243 C SER A 15 -11.526 -1.185 -0.669 1.00 0.00 C ATOM 244 O SER A 15 -11.670 0.010 -0.838 1.00 0.00 O ATOM 245 CB SER A 15 -12.287 -2.091 1.549 1.00 0.00 C ATOM 246 OG SER A 15 -10.926 -2.459 1.736 1.00 0.00 O ATOM 0 H SER A 15 -12.200 -4.108 0.264 1.00 0.00 H new ATOM 0 HA SER A 15 -13.550 -1.548 -0.147 1.00 0.00 H new ATOM 0 HB2 SER A 15 -12.483 -1.127 2.018 1.00 0.00 H new ATOM 0 HB3 SER A 15 -12.942 -2.818 2.029 1.00 0.00 H new ATOM 0 HG SER A 15 -10.708 -3.215 1.152 1.00 0.00 H new ATOM 252 N GLY A 16 -10.459 -1.805 -1.095 1.00 0.00 N ATOM 253 CA GLY A 16 -9.390 -1.046 -1.804 1.00 0.00 C ATOM 254 C GLY A 16 -8.269 -0.707 -0.820 1.00 0.00 C ATOM 255 O GLY A 16 -7.478 0.187 -1.050 1.00 0.00 O ATOM 0 H GLY A 16 -10.282 -2.803 -0.983 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -8.996 -1.637 -2.631 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -9.801 -0.132 -2.233 1.00 0.00 H new ATOM 259 N PHE A 17 -8.192 -1.415 0.273 1.00 0.00 N ATOM 260 CA PHE A 17 -7.120 -1.134 1.271 1.00 0.00 C ATOM 261 C PHE A 17 -6.079 -2.255 1.258 1.00 0.00 C ATOM 262 O PHE A 17 -5.158 -2.270 2.049 1.00 0.00 O ATOM 263 CB PHE A 17 -7.836 -1.091 2.621 1.00 0.00 C ATOM 264 CG PHE A 17 -8.102 0.342 3.006 1.00 0.00 C ATOM 265 CD1 PHE A 17 -9.138 1.051 2.389 1.00 0.00 C ATOM 266 CD2 PHE A 17 -7.312 0.962 3.982 1.00 0.00 C ATOM 267 CE1 PHE A 17 -9.386 2.381 2.747 1.00 0.00 C ATOM 268 CE2 PHE A 17 -7.560 2.292 4.341 1.00 0.00 C ATOM 269 CZ PHE A 17 -8.597 3.001 3.724 1.00 0.00 C ATOM 0 H PHE A 17 -8.825 -2.176 0.519 1.00 0.00 H new ATOM 0 HA PHE A 17 -6.593 -0.204 1.057 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -8.774 -1.643 2.564 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -7.226 -1.576 3.383 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -9.747 0.572 1.636 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -6.512 0.414 4.457 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -10.185 2.929 2.270 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -6.951 2.771 5.094 1.00 0.00 H new ATOM 0 HZ PHE A 17 -8.789 4.027 4.001 1.00 0.00 H new ATOM 279 N TYR A 18 -6.221 -3.197 0.366 1.00 0.00 N ATOM 280 CA TYR A 18 -5.241 -4.317 0.308 1.00 0.00 C ATOM 281 C TYR A 18 -4.098 -3.975 -0.650 1.00 0.00 C ATOM 282 O TYR A 18 -4.312 -3.470 -1.735 1.00 0.00 O ATOM 283 CB TYR A 18 -6.034 -5.515 -0.211 1.00 0.00 C ATOM 284 CG TYR A 18 -5.240 -6.776 0.027 1.00 0.00 C ATOM 285 CD1 TYR A 18 -4.185 -7.110 -0.831 1.00 0.00 C ATOM 286 CD2 TYR A 18 -5.554 -7.606 1.109 1.00 0.00 C ATOM 287 CE1 TYR A 18 -3.445 -8.276 -0.608 1.00 0.00 C ATOM 288 CE2 TYR A 18 -4.813 -8.773 1.333 1.00 0.00 C ATOM 289 CZ TYR A 18 -3.759 -9.108 0.475 1.00 0.00 C ATOM 290 OH TYR A 18 -3.030 -10.258 0.696 1.00 0.00 O ATOM 0 H TYR A 18 -6.972 -3.239 -0.323 1.00 0.00 H new ATOM 0 HA TYR A 18 -4.790 -4.518 1.280 1.00 0.00 H new ATOM 0 HB2 TYR A 18 -6.997 -5.576 0.296 1.00 0.00 H new ATOM 0 HB3 TYR A 18 -6.241 -5.396 -1.275 1.00 0.00 H new ATOM 0 HD1 TYR A 18 -3.943 -6.468 -1.665 1.00 0.00 H new ATOM 0 HD2 TYR A 18 -6.367 -7.347 1.771 1.00 0.00 H new ATOM 0 HE1 TYR A 18 -2.632 -8.535 -1.270 1.00 0.00 H new ATOM 0 HE2 TYR A 18 -5.055 -9.414 2.168 1.00 0.00 H new ATOM 0 HH TYR A 18 -3.581 -11.040 0.485 1.00 0.00 H new ATOM 300 N TRP A 19 -2.885 -4.251 -0.259 1.00 0.00 N ATOM 301 CA TRP A 19 -1.726 -3.945 -1.144 1.00 0.00 C ATOM 302 C TRP A 19 -1.385 -5.159 -2.010 1.00 0.00 C ATOM 303 O TRP A 19 -1.565 -6.291 -1.607 1.00 0.00 O ATOM 304 CB TRP A 19 -0.573 -3.625 -0.194 1.00 0.00 C ATOM 305 CG TRP A 19 -0.286 -2.160 -0.239 1.00 0.00 C ATOM 306 CD1 TRP A 19 -1.016 -1.205 0.384 1.00 0.00 C ATOM 307 CD2 TRP A 19 0.790 -1.463 -0.933 1.00 0.00 C ATOM 308 NE1 TRP A 19 -0.456 0.031 0.119 1.00 0.00 N ATOM 309 CE2 TRP A 19 0.659 -0.076 -0.689 1.00 0.00 C ATOM 310 CE3 TRP A 19 1.857 -1.897 -1.741 1.00 0.00 C ATOM 311 CZ2 TRP A 19 1.554 0.849 -1.227 1.00 0.00 C ATOM 312 CZ3 TRP A 19 2.760 -0.969 -2.285 1.00 0.00 C ATOM 313 CH2 TRP A 19 2.608 0.401 -2.028 1.00 0.00 C ATOM 0 H TRP A 19 -2.646 -4.676 0.637 1.00 0.00 H new ATOM 0 HA TRP A 19 -1.935 -3.119 -1.824 1.00 0.00 H new ATOM 0 HB2 TRP A 19 -0.830 -3.926 0.822 1.00 0.00 H new ATOM 0 HB3 TRP A 19 0.315 -4.190 -0.479 1.00 0.00 H new ATOM 0 HD1 TRP A 19 -1.893 -1.380 0.989 1.00 0.00 H new ATOM 0 HE1 TRP A 19 -0.821 0.914 0.476 1.00 0.00 H new ATOM 0 HE3 TRP A 19 1.982 -2.950 -1.944 1.00 0.00 H new ATOM 0 HZ2 TRP A 19 1.433 1.903 -1.026 1.00 0.00 H new ATOM 0 HZ3 TRP A 19 3.575 -1.312 -2.904 1.00 0.00 H new ATOM 0 HH2 TRP A 19 3.305 1.110 -2.449 1.00 0.00 H new ATOM 324 N SER A 20 -0.896 -4.929 -3.197 1.00 0.00 N ATOM 325 CA SER A 20 -0.542 -6.066 -4.094 1.00 0.00 C ATOM 326 C SER A 20 0.127 -7.184 -3.295 1.00 0.00 C ATOM 327 O SER A 20 -0.528 -8.049 -2.749 1.00 0.00 O ATOM 328 CB SER A 20 0.432 -5.475 -5.112 1.00 0.00 C ATOM 329 OG SER A 20 1.237 -6.517 -5.650 1.00 0.00 O ATOM 0 H SER A 20 -0.726 -4.001 -3.586 1.00 0.00 H new ATOM 0 HA SER A 20 -1.418 -6.503 -4.573 1.00 0.00 H new ATOM 0 HB2 SER A 20 -0.117 -4.975 -5.910 1.00 0.00 H new ATOM 0 HB3 SER A 20 1.061 -4.722 -4.637 1.00 0.00 H new ATOM 0 HG SER A 20 2.177 -6.240 -5.646 1.00 0.00 H new ATOM 335 N ALA A 21 1.426 -7.173 -3.225 1.00 0.00 N ATOM 336 CA ALA A 21 2.142 -8.233 -2.463 1.00 0.00 C ATOM 337 C ALA A 21 3.653 -8.127 -2.689 1.00 0.00 C ATOM 338 O ALA A 21 4.276 -9.035 -3.202 1.00 0.00 O ATOM 339 CB ALA A 21 1.609 -9.552 -3.026 1.00 0.00 C ATOM 0 H ALA A 21 2.026 -6.474 -3.663 1.00 0.00 H new ATOM 0 HA ALA A 21 1.977 -8.148 -1.389 1.00 0.00 H new ATOM 0 HB1 ALA A 21 2.089 -10.386 -2.515 1.00 0.00 H new ATOM 0 HB2 ALA A 21 0.531 -9.604 -2.872 1.00 0.00 H new ATOM 0 HB3 ALA A 21 1.826 -9.607 -4.093 1.00 0.00 H new ATOM 345 N VAL A 22 4.248 -7.028 -2.308 1.00 0.00 N ATOM 346 CA VAL A 22 5.717 -6.874 -2.495 1.00 0.00 C ATOM 347 C VAL A 22 6.448 -7.984 -1.734 1.00 0.00 C ATOM 348 O VAL A 22 6.039 -9.127 -1.751 1.00 0.00 O ATOM 349 CB VAL A 22 6.070 -5.497 -1.916 1.00 0.00 C ATOM 350 CG1 VAL A 22 7.155 -4.864 -2.776 1.00 0.00 C ATOM 351 CG2 VAL A 22 4.841 -4.581 -1.921 1.00 0.00 C ATOM 0 H VAL A 22 3.779 -6.232 -1.876 1.00 0.00 H new ATOM 0 HA VAL A 22 6.010 -6.946 -3.542 1.00 0.00 H new ATOM 0 HB VAL A 22 6.416 -5.623 -0.890 1.00 0.00 H new ATOM 0 HG11 VAL A 22 7.413 -3.885 -2.373 1.00 0.00 H new ATOM 0 HG12 VAL A 22 8.039 -5.502 -2.774 1.00 0.00 H new ATOM 0 HG13 VAL A 22 6.791 -4.752 -3.797 1.00 0.00 H new ATOM 0 HG21 VAL A 22 5.110 -3.609 -1.507 1.00 0.00 H new ATOM 0 HG22 VAL A 22 4.486 -4.454 -2.944 1.00 0.00 H new ATOM 0 HG23 VAL A 22 4.052 -5.027 -1.316 1.00 0.00 H new ATOM 361 N THR A 23 7.519 -7.666 -1.057 1.00 0.00 N ATOM 362 CA THR A 23 8.241 -8.724 -0.298 1.00 0.00 C ATOM 363 C THR A 23 7.600 -8.893 1.080 1.00 0.00 C ATOM 364 O THR A 23 6.816 -8.072 1.511 1.00 0.00 O ATOM 365 CB THR A 23 9.681 -8.223 -0.171 1.00 0.00 C ATOM 366 OG1 THR A 23 9.919 -7.220 -1.148 1.00 0.00 O ATOM 367 CG2 THR A 23 10.648 -9.388 -0.387 1.00 0.00 C ATOM 0 H THR A 23 7.920 -6.730 -0.997 1.00 0.00 H new ATOM 0 HA THR A 23 8.202 -9.694 -0.794 1.00 0.00 H new ATOM 0 HB THR A 23 9.835 -7.805 0.824 1.00 0.00 H new ATOM 0 HG1 THR A 23 10.639 -7.510 -1.746 1.00 0.00 H new ATOM 0 HG21 THR A 23 11.674 -9.031 -0.297 1.00 0.00 H new ATOM 0 HG22 THR A 23 10.464 -10.157 0.363 1.00 0.00 H new ATOM 0 HG23 THR A 23 10.496 -9.807 -1.382 1.00 0.00 H new ATOM 375 N GLY A 24 7.919 -9.951 1.770 1.00 0.00 N ATOM 376 CA GLY A 24 7.318 -10.171 3.116 1.00 0.00 C ATOM 377 C GLY A 24 7.237 -8.844 3.874 1.00 0.00 C ATOM 378 O GLY A 24 6.215 -8.187 3.889 1.00 0.00 O ATOM 0 H GLY A 24 8.570 -10.673 1.461 1.00 0.00 H new ATOM 0 HA2 GLY A 24 6.322 -10.602 3.013 1.00 0.00 H new ATOM 0 HA3 GLY A 24 7.918 -10.885 3.679 1.00 0.00 H new ATOM 382 N GLY A 25 8.305 -8.454 4.508 1.00 0.00 N ATOM 383 CA GLY A 25 8.301 -7.178 5.280 1.00 0.00 C ATOM 384 C GLY A 25 8.473 -5.982 4.340 1.00 0.00 C ATOM 385 O GLY A 25 8.003 -4.897 4.615 1.00 0.00 O ATOM 0 H GLY A 25 9.187 -8.966 4.526 1.00 0.00 H new ATOM 0 HA2 GLY A 25 7.366 -7.083 5.832 1.00 0.00 H new ATOM 0 HA3 GLY A 25 9.105 -7.189 6.016 1.00 0.00 H new ATOM 389 N GLU A 26 9.162 -6.158 3.245 1.00 0.00 N ATOM 390 CA GLU A 26 9.379 -5.007 2.320 1.00 0.00 C ATOM 391 C GLU A 26 8.043 -4.429 1.863 1.00 0.00 C ATOM 392 O GLU A 26 7.906 -3.235 1.688 1.00 0.00 O ATOM 393 CB GLU A 26 10.148 -5.585 1.133 1.00 0.00 C ATOM 394 CG GLU A 26 10.981 -4.482 0.479 1.00 0.00 C ATOM 395 CD GLU A 26 11.713 -5.048 -0.740 1.00 0.00 C ATOM 396 OE1 GLU A 26 11.073 -5.218 -1.764 1.00 0.00 O ATOM 397 OE2 GLU A 26 12.900 -5.303 -0.628 1.00 0.00 O ATOM 0 H GLU A 26 9.581 -7.041 2.952 1.00 0.00 H new ATOM 0 HA GLU A 26 9.924 -4.195 2.801 1.00 0.00 H new ATOM 0 HB2 GLU A 26 10.796 -6.396 1.466 1.00 0.00 H new ATOM 0 HB3 GLU A 26 9.453 -6.009 0.408 1.00 0.00 H new ATOM 0 HG2 GLU A 26 10.337 -3.656 0.178 1.00 0.00 H new ATOM 0 HG3 GLU A 26 11.700 -4.082 1.194 1.00 0.00 H new ATOM 404 N ALA A 27 7.049 -5.249 1.687 1.00 0.00 N ATOM 405 CA ALA A 27 5.729 -4.707 1.267 1.00 0.00 C ATOM 406 C ALA A 27 5.157 -3.854 2.400 1.00 0.00 C ATOM 407 O ALA A 27 4.727 -2.736 2.198 1.00 0.00 O ATOM 408 CB ALA A 27 4.850 -5.934 1.019 1.00 0.00 C ATOM 0 H ALA A 27 7.090 -6.260 1.814 1.00 0.00 H new ATOM 0 HA ALA A 27 5.792 -4.079 0.378 1.00 0.00 H new ATOM 0 HB1 ALA A 27 3.857 -5.613 0.705 1.00 0.00 H new ATOM 0 HB2 ALA A 27 5.296 -6.549 0.238 1.00 0.00 H new ATOM 0 HB3 ALA A 27 4.769 -6.516 1.937 1.00 0.00 H new ATOM 414 N ASN A 28 5.161 -4.377 3.597 1.00 0.00 N ATOM 415 CA ASN A 28 4.629 -3.605 4.757 1.00 0.00 C ATOM 416 C ASN A 28 5.549 -2.424 5.091 1.00 0.00 C ATOM 417 O ASN A 28 5.100 -1.333 5.372 1.00 0.00 O ATOM 418 CB ASN A 28 4.596 -4.604 5.912 1.00 0.00 C ATOM 419 CG ASN A 28 3.893 -5.885 5.457 1.00 0.00 C ATOM 420 OD1 ASN A 28 2.684 -5.915 5.329 1.00 0.00 O ATOM 421 ND2 ASN A 28 4.601 -6.951 5.207 1.00 0.00 N ATOM 0 H ASN A 28 5.511 -5.308 3.822 1.00 0.00 H new ATOM 0 HA ASN A 28 3.646 -3.182 4.551 1.00 0.00 H new ATOM 0 HB2 ASN A 28 5.610 -4.830 6.241 1.00 0.00 H new ATOM 0 HB3 ASN A 28 4.073 -4.173 6.765 1.00 0.00 H new ATOM 0 HD21 ASN A 28 4.141 -7.809 4.904 1.00 0.00 H new ATOM 0 HD22 ASN A 28 5.615 -6.926 5.314 1.00 0.00 H new ATOM 428 N LEU A 29 6.834 -2.649 5.083 1.00 0.00 N ATOM 429 CA LEU A 29 7.803 -1.561 5.418 1.00 0.00 C ATOM 430 C LEU A 29 7.858 -0.493 4.319 1.00 0.00 C ATOM 431 O LEU A 29 8.107 0.666 4.587 1.00 0.00 O ATOM 432 CB LEU A 29 9.154 -2.262 5.557 1.00 0.00 C ATOM 433 CG LEU A 29 9.502 -2.414 7.040 1.00 0.00 C ATOM 434 CD1 LEU A 29 8.248 -2.807 7.829 1.00 0.00 C ATOM 435 CD2 LEU A 29 10.566 -3.501 7.204 1.00 0.00 C ATOM 0 H LEU A 29 7.260 -3.548 4.857 1.00 0.00 H new ATOM 0 HA LEU A 29 7.512 -1.036 6.328 1.00 0.00 H new ATOM 0 HB2 LEU A 29 9.118 -3.241 5.079 1.00 0.00 H new ATOM 0 HB3 LEU A 29 9.928 -1.687 5.048 1.00 0.00 H new ATOM 0 HG LEU A 29 9.884 -1.466 7.419 1.00 0.00 H new ATOM 0 HD11 LEU A 29 8.501 -2.914 8.884 1.00 0.00 H new ATOM 0 HD12 LEU A 29 7.489 -2.033 7.714 1.00 0.00 H new ATOM 0 HD13 LEU A 29 7.862 -3.753 7.451 1.00 0.00 H new ATOM 0 HD21 LEU A 29 10.815 -3.610 8.260 1.00 0.00 H new ATOM 0 HD22 LEU A 29 10.182 -4.447 6.822 1.00 0.00 H new ATOM 0 HD23 LEU A 29 11.461 -3.221 6.647 1.00 0.00 H new ATOM 447 N LEU A 30 7.654 -0.866 3.086 1.00 0.00 N ATOM 448 CA LEU A 30 7.730 0.142 1.987 1.00 0.00 C ATOM 449 C LEU A 30 6.785 1.313 2.272 1.00 0.00 C ATOM 450 O LEU A 30 7.135 2.459 2.070 1.00 0.00 O ATOM 451 CB LEU A 30 7.304 -0.621 0.726 1.00 0.00 C ATOM 452 CG LEU A 30 6.256 0.183 -0.048 1.00 0.00 C ATOM 453 CD1 LEU A 30 6.875 1.492 -0.541 1.00 0.00 C ATOM 454 CD2 LEU A 30 5.772 -0.636 -1.247 1.00 0.00 C ATOM 0 H LEU A 30 7.439 -1.819 2.791 1.00 0.00 H new ATOM 0 HA LEU A 30 8.726 0.572 1.881 1.00 0.00 H new ATOM 0 HB2 LEU A 30 8.172 -0.806 0.093 1.00 0.00 H new ATOM 0 HB3 LEU A 30 6.897 -1.594 1.001 1.00 0.00 H new ATOM 0 HG LEU A 30 5.413 0.406 0.606 1.00 0.00 H new ATOM 0 HD11 LEU A 30 6.128 2.063 -1.092 1.00 0.00 H new ATOM 0 HD12 LEU A 30 7.221 2.075 0.313 1.00 0.00 H new ATOM 0 HD13 LEU A 30 7.718 1.272 -1.196 1.00 0.00 H new ATOM 0 HD21 LEU A 30 5.026 -0.066 -1.800 1.00 0.00 H new ATOM 0 HD22 LEU A 30 6.616 -0.858 -1.900 1.00 0.00 H new ATOM 0 HD23 LEU A 30 5.329 -1.568 -0.896 1.00 0.00 H new ATOM 466 N LEU A 31 5.605 1.051 2.758 1.00 0.00 N ATOM 467 CA LEU A 31 4.681 2.178 3.063 1.00 0.00 C ATOM 468 C LEU A 31 5.326 3.078 4.120 1.00 0.00 C ATOM 469 O LEU A 31 5.171 4.283 4.112 1.00 0.00 O ATOM 470 CB LEU A 31 3.411 1.527 3.609 1.00 0.00 C ATOM 471 CG LEU A 31 3.709 0.888 4.966 1.00 0.00 C ATOM 472 CD1 LEU A 31 3.569 1.938 6.068 1.00 0.00 C ATOM 473 CD2 LEU A 31 2.723 -0.254 5.220 1.00 0.00 C ATOM 0 H LEU A 31 5.243 0.118 2.955 1.00 0.00 H new ATOM 0 HA LEU A 31 4.463 2.794 2.191 1.00 0.00 H new ATOM 0 HB2 LEU A 31 2.622 2.273 3.711 1.00 0.00 H new ATOM 0 HB3 LEU A 31 3.048 0.772 2.912 1.00 0.00 H new ATOM 0 HG LEU A 31 4.726 0.496 4.966 1.00 0.00 H new ATOM 0 HD11 LEU A 31 3.782 1.481 7.035 1.00 0.00 H new ATOM 0 HD12 LEU A 31 4.273 2.751 5.888 1.00 0.00 H new ATOM 0 HD13 LEU A 31 2.553 2.332 6.068 1.00 0.00 H new ATOM 0 HD21 LEU A 31 2.935 -0.710 6.187 1.00 0.00 H new ATOM 0 HD22 LEU A 31 1.705 0.137 5.218 1.00 0.00 H new ATOM 0 HD23 LEU A 31 2.825 -1.004 4.436 1.00 0.00 H new ATOM 485 N SER A 32 6.060 2.492 5.027 1.00 0.00 N ATOM 486 CA SER A 32 6.735 3.294 6.086 1.00 0.00 C ATOM 487 C SER A 32 7.866 4.126 5.477 1.00 0.00 C ATOM 488 O SER A 32 8.164 5.213 5.930 1.00 0.00 O ATOM 489 CB SER A 32 7.296 2.261 7.063 1.00 0.00 C ATOM 490 OG SER A 32 8.627 2.619 7.410 1.00 0.00 O ATOM 0 H SER A 32 6.222 1.486 5.080 1.00 0.00 H new ATOM 0 HA SER A 32 6.055 3.992 6.575 1.00 0.00 H new ATOM 0 HB2 SER A 32 6.675 2.214 7.957 1.00 0.00 H new ATOM 0 HB3 SER A 32 7.280 1.269 6.611 1.00 0.00 H new ATOM 0 HG SER A 32 9.253 1.979 7.011 1.00 0.00 H new ATOM 496 N ALA A 33 8.508 3.617 4.458 1.00 0.00 N ATOM 497 CA ALA A 33 9.629 4.376 3.832 1.00 0.00 C ATOM 498 C ALA A 33 9.087 5.441 2.875 1.00 0.00 C ATOM 499 O ALA A 33 9.761 6.400 2.557 1.00 0.00 O ATOM 500 CB ALA A 33 10.435 3.327 3.066 1.00 0.00 C ATOM 0 H ALA A 33 8.305 2.712 4.034 1.00 0.00 H new ATOM 0 HA ALA A 33 10.235 4.899 4.572 1.00 0.00 H new ATOM 0 HB1 ALA A 33 11.282 3.806 2.575 1.00 0.00 H new ATOM 0 HB2 ALA A 33 10.799 2.570 3.760 1.00 0.00 H new ATOM 0 HB3 ALA A 33 9.799 2.856 2.316 1.00 0.00 H new ATOM 506 N GLU A 34 7.873 5.290 2.421 1.00 0.00 N ATOM 507 CA GLU A 34 7.302 6.311 1.494 1.00 0.00 C ATOM 508 C GLU A 34 6.115 7.026 2.161 1.00 0.00 C ATOM 509 O GLU A 34 6.256 8.144 2.618 1.00 0.00 O ATOM 510 CB GLU A 34 6.867 5.536 0.249 1.00 0.00 C ATOM 511 CG GLU A 34 8.003 5.538 -0.776 1.00 0.00 C ATOM 512 CD GLU A 34 7.425 5.747 -2.178 1.00 0.00 C ATOM 513 OE1 GLU A 34 6.903 4.793 -2.729 1.00 0.00 O ATOM 514 OE2 GLU A 34 7.514 6.859 -2.674 1.00 0.00 O ATOM 0 H GLU A 34 7.255 4.511 2.649 1.00 0.00 H new ATOM 0 HA GLU A 34 8.023 7.087 1.236 1.00 0.00 H new ATOM 0 HB2 GLU A 34 6.607 4.512 0.517 1.00 0.00 H new ATOM 0 HB3 GLU A 34 5.974 5.989 -0.181 1.00 0.00 H new ATOM 0 HG2 GLU A 34 8.716 6.329 -0.543 1.00 0.00 H new ATOM 0 HG3 GLU A 34 8.548 4.595 -0.733 1.00 0.00 H new ATOM 521 N PRO A 35 4.983 6.365 2.211 1.00 0.00 N ATOM 522 CA PRO A 35 3.787 6.974 2.848 1.00 0.00 C ATOM 523 C PRO A 35 3.956 6.999 4.370 1.00 0.00 C ATOM 524 O PRO A 35 3.241 6.335 5.096 1.00 0.00 O ATOM 525 CB PRO A 35 2.650 6.038 2.448 1.00 0.00 C ATOM 526 CG PRO A 35 3.310 4.723 2.185 1.00 0.00 C ATOM 527 CD PRO A 35 4.702 5.020 1.691 1.00 0.00 C ATOM 0 HA PRO A 35 3.613 8.004 2.538 1.00 0.00 H new ATOM 0 HB2 PRO A 35 1.908 5.956 3.242 1.00 0.00 H new ATOM 0 HB3 PRO A 35 2.130 6.403 1.562 1.00 0.00 H new ATOM 0 HG2 PRO A 35 3.343 4.120 3.092 1.00 0.00 H new ATOM 0 HG3 PRO A 35 2.751 4.152 1.443 1.00 0.00 H new ATOM 0 HD2 PRO A 35 5.422 4.290 2.062 1.00 0.00 H new ATOM 0 HD3 PRO A 35 4.754 4.994 0.603 1.00 0.00 H new ATOM 535 N ALA A 36 4.902 7.753 4.860 1.00 0.00 N ATOM 536 CA ALA A 36 5.122 7.815 6.335 1.00 0.00 C ATOM 537 C ALA A 36 3.803 8.081 7.066 1.00 0.00 C ATOM 538 O ALA A 36 2.981 8.859 6.624 1.00 0.00 O ATOM 539 CB ALA A 36 6.091 8.979 6.541 1.00 0.00 C ATOM 0 H ALA A 36 5.533 8.329 4.303 1.00 0.00 H new ATOM 0 HA ALA A 36 5.515 6.878 6.729 1.00 0.00 H new ATOM 0 HB1 ALA A 36 6.304 9.091 7.604 1.00 0.00 H new ATOM 0 HB2 ALA A 36 7.018 8.780 6.004 1.00 0.00 H new ATOM 0 HB3 ALA A 36 5.642 9.897 6.162 1.00 0.00 H new ATOM 545 N GLY A 37 3.599 7.441 8.187 1.00 0.00 N ATOM 546 CA GLY A 37 2.338 7.658 8.953 1.00 0.00 C ATOM 547 C GLY A 37 1.207 6.836 8.332 1.00 0.00 C ATOM 548 O GLY A 37 0.095 6.829 8.820 1.00 0.00 O ATOM 0 H GLY A 37 4.251 6.778 8.605 1.00 0.00 H new ATOM 0 HA2 GLY A 37 2.480 7.370 9.995 1.00 0.00 H new ATOM 0 HA3 GLY A 37 2.076 8.716 8.948 1.00 0.00 H new ATOM 552 N THR A 38 1.479 6.147 7.258 1.00 0.00 N ATOM 553 CA THR A 38 0.413 5.330 6.606 1.00 0.00 C ATOM 554 C THR A 38 0.617 3.844 6.911 1.00 0.00 C ATOM 555 O THR A 38 1.729 3.373 7.033 1.00 0.00 O ATOM 556 CB THR A 38 0.574 5.593 5.108 1.00 0.00 C ATOM 557 OG1 THR A 38 0.863 6.970 4.900 1.00 0.00 O ATOM 558 CG2 THR A 38 -0.721 5.226 4.382 1.00 0.00 C ATOM 0 H THR A 38 2.391 6.113 6.803 1.00 0.00 H new ATOM 0 HA THR A 38 -0.582 5.593 6.965 1.00 0.00 H new ATOM 0 HB THR A 38 1.391 4.986 4.717 1.00 0.00 H new ATOM 0 HG1 THR A 38 1.797 7.148 5.137 1.00 0.00 H new ATOM 0 HG21 THR A 38 -0.605 5.414 3.315 1.00 0.00 H new ATOM 0 HG22 THR A 38 -0.942 4.171 4.543 1.00 0.00 H new ATOM 0 HG23 THR A 38 -1.540 5.832 4.770 1.00 0.00 H new ATOM 566 N PHE A 39 -0.451 3.103 7.034 1.00 0.00 N ATOM 567 CA PHE A 39 -0.320 1.646 7.328 1.00 0.00 C ATOM 568 C PHE A 39 -1.044 0.828 6.254 1.00 0.00 C ATOM 569 O PHE A 39 -2.122 1.178 5.817 1.00 0.00 O ATOM 570 CB PHE A 39 -0.987 1.454 8.690 1.00 0.00 C ATOM 571 CG PHE A 39 -2.467 1.730 8.571 1.00 0.00 C ATOM 572 CD1 PHE A 39 -3.332 0.723 8.127 1.00 0.00 C ATOM 573 CD2 PHE A 39 -2.972 2.991 8.905 1.00 0.00 C ATOM 574 CE1 PHE A 39 -4.704 0.978 8.017 1.00 0.00 C ATOM 575 CE2 PHE A 39 -4.345 3.246 8.795 1.00 0.00 C ATOM 576 CZ PHE A 39 -5.210 2.239 8.352 1.00 0.00 C ATOM 0 H PHE A 39 -1.408 3.443 6.944 1.00 0.00 H new ATOM 0 HA PHE A 39 0.719 1.316 7.335 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -0.824 0.437 9.046 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -0.539 2.124 9.424 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -2.941 -0.250 7.869 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -2.304 3.767 9.247 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -5.372 0.202 7.674 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -4.736 4.219 9.052 1.00 0.00 H new ATOM 0 HZ PHE A 39 -6.269 2.435 8.269 1.00 0.00 H new ATOM 586 N LEU A 40 -0.460 -0.258 5.822 1.00 0.00 N ATOM 587 CA LEU A 40 -1.118 -1.090 4.772 1.00 0.00 C ATOM 588 C LEU A 40 -0.907 -2.580 5.054 1.00 0.00 C ATOM 589 O LEU A 40 0.002 -2.966 5.763 1.00 0.00 O ATOM 590 CB LEU A 40 -0.433 -0.686 3.461 1.00 0.00 C ATOM 591 CG LEU A 40 0.761 -1.610 3.192 1.00 0.00 C ATOM 592 CD1 LEU A 40 0.269 -2.923 2.582 1.00 0.00 C ATOM 593 CD2 LEU A 40 1.723 -0.932 2.216 1.00 0.00 C ATOM 0 H LEU A 40 0.442 -0.604 6.150 1.00 0.00 H new ATOM 0 HA LEU A 40 -2.196 -0.930 4.738 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -1.143 -0.745 2.636 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -0.097 0.349 3.520 1.00 0.00 H new ATOM 0 HG LEU A 40 1.275 -1.814 4.131 1.00 0.00 H new ATOM 0 HD11 LEU A 40 1.120 -3.577 2.392 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -0.417 -3.411 3.274 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -0.247 -2.718 1.644 1.00 0.00 H new ATOM 0 HD21 LEU A 40 2.571 -1.589 2.025 1.00 0.00 H new ATOM 0 HD22 LEU A 40 1.206 -0.726 1.279 1.00 0.00 H new ATOM 0 HD23 LEU A 40 2.079 0.004 2.647 1.00 0.00 H new ATOM 605 N ILE A 41 -1.735 -3.419 4.494 1.00 0.00 N ATOM 606 CA ILE A 41 -1.578 -4.885 4.717 1.00 0.00 C ATOM 607 C ILE A 41 -1.229 -5.580 3.397 1.00 0.00 C ATOM 608 O ILE A 41 -1.873 -5.374 2.388 1.00 0.00 O ATOM 609 CB ILE A 41 -2.939 -5.356 5.236 1.00 0.00 C ATOM 610 CG1 ILE A 41 -2.746 -6.597 6.108 1.00 0.00 C ATOM 611 CG2 ILE A 41 -3.855 -5.702 4.059 1.00 0.00 C ATOM 612 CD1 ILE A 41 -3.728 -6.558 7.280 1.00 0.00 C ATOM 0 H ILE A 41 -2.514 -3.153 3.891 1.00 0.00 H new ATOM 0 HA ILE A 41 -0.777 -5.117 5.419 1.00 0.00 H new ATOM 0 HB ILE A 41 -3.395 -4.559 5.823 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -2.906 -7.498 5.516 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -1.722 -6.637 6.479 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -4.821 -6.036 4.436 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -3.995 -4.819 3.435 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -3.402 -6.497 3.467 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -3.589 -7.443 7.901 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -3.547 -5.664 7.877 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -4.749 -6.539 6.899 1.00 0.00 H new ATOM 624 N ARG A 42 -0.214 -6.401 3.395 1.00 0.00 N ATOM 625 CA ARG A 42 0.168 -7.105 2.136 1.00 0.00 C ATOM 626 C ARG A 42 -0.092 -8.610 2.276 1.00 0.00 C ATOM 627 O ARG A 42 -0.206 -9.130 3.367 1.00 0.00 O ATOM 628 CB ARG A 42 1.664 -6.823 1.963 1.00 0.00 C ATOM 629 CG ARG A 42 2.485 -7.859 2.738 1.00 0.00 C ATOM 630 CD ARG A 42 3.011 -8.920 1.769 1.00 0.00 C ATOM 631 NE ARG A 42 3.530 -10.014 2.638 1.00 0.00 N ATOM 632 CZ ARG A 42 4.210 -10.998 2.113 1.00 0.00 C ATOM 633 NH1 ARG A 42 4.436 -11.024 0.828 1.00 0.00 N ATOM 634 NH2 ARG A 42 4.663 -11.957 2.874 1.00 0.00 N ATOM 0 H ARG A 42 0.366 -6.615 4.207 1.00 0.00 H new ATOM 0 HA ARG A 42 -0.408 -6.764 1.276 1.00 0.00 H new ATOM 0 HB2 ARG A 42 1.929 -6.854 0.906 1.00 0.00 H new ATOM 0 HB3 ARG A 42 1.897 -5.820 2.321 1.00 0.00 H new ATOM 0 HG2 ARG A 42 3.316 -7.372 3.248 1.00 0.00 H new ATOM 0 HG3 ARG A 42 1.869 -8.326 3.506 1.00 0.00 H new ATOM 0 HD2 ARG A 42 2.220 -9.280 1.111 1.00 0.00 H new ATOM 0 HD3 ARG A 42 3.797 -8.516 1.131 1.00 0.00 H new ATOM 0 HE ARG A 42 3.354 -9.994 3.643 1.00 0.00 H new ATOM 0 HH11 ARG A 42 4.082 -10.275 0.233 1.00 0.00 H new ATOM 0 HH12 ARG A 42 4.967 -11.793 0.419 1.00 0.00 H new ATOM 0 HH21 ARG A 42 4.486 -11.938 3.878 1.00 0.00 H new ATOM 0 HH22 ARG A 42 5.194 -12.725 2.464 1.00 0.00 H new ATOM 648 N ASP A 43 -0.188 -9.312 1.180 1.00 0.00 N ATOM 649 CA ASP A 43 -0.442 -10.780 1.256 1.00 0.00 C ATOM 650 C ASP A 43 0.824 -11.511 1.709 1.00 0.00 C ATOM 651 O ASP A 43 1.880 -11.359 1.130 1.00 0.00 O ATOM 652 CB ASP A 43 -0.816 -11.193 -0.169 1.00 0.00 C ATOM 653 CG ASP A 43 -1.629 -12.488 -0.127 1.00 0.00 C ATOM 654 OD1 ASP A 43 -2.577 -12.545 0.637 1.00 0.00 O ATOM 655 OD2 ASP A 43 -1.287 -13.402 -0.860 1.00 0.00 O ATOM 0 H ASP A 43 -0.102 -8.934 0.237 1.00 0.00 H new ATOM 0 HA ASP A 43 -1.227 -11.026 1.971 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -1.394 -10.403 -0.648 1.00 0.00 H new ATOM 0 HB3 ASP A 43 0.085 -11.336 -0.766 1.00 0.00 H new ATOM 660 N SER A 44 0.726 -12.305 2.740 1.00 0.00 N ATOM 661 CA SER A 44 1.924 -13.045 3.227 1.00 0.00 C ATOM 662 C SER A 44 2.502 -13.908 2.103 1.00 0.00 C ATOM 663 O SER A 44 3.378 -13.489 1.373 1.00 0.00 O ATOM 664 CB SER A 44 1.411 -13.924 4.367 1.00 0.00 C ATOM 665 OG SER A 44 2.371 -14.934 4.650 1.00 0.00 O ATOM 0 H SER A 44 -0.132 -12.473 3.266 1.00 0.00 H new ATOM 0 HA SER A 44 2.719 -12.375 3.556 1.00 0.00 H new ATOM 0 HB2 SER A 44 1.230 -13.319 5.255 1.00 0.00 H new ATOM 0 HB3 SER A 44 0.459 -14.378 4.092 1.00 0.00 H new ATOM 0 HG SER A 44 2.185 -15.325 5.529 1.00 0.00 H new ATOM 735 N HIS A 49 -1.710 -18.600 2.306 1.00 0.00 N ATOM 736 CA HIS A 49 -1.139 -18.259 3.640 1.00 0.00 C ATOM 737 C HIS A 49 -2.020 -17.223 4.346 1.00 0.00 C ATOM 738 O HIS A 49 -2.970 -17.561 5.023 1.00 0.00 O ATOM 739 CB HIS A 49 0.243 -17.678 3.342 1.00 0.00 C ATOM 740 CG HIS A 49 1.272 -18.774 3.404 1.00 0.00 C ATOM 741 ND1 HIS A 49 2.156 -18.898 4.464 1.00 0.00 N ATOM 742 CD2 HIS A 49 1.568 -19.803 2.545 1.00 0.00 C ATOM 743 CE1 HIS A 49 2.936 -19.967 4.218 1.00 0.00 C ATOM 744 NE2 HIS A 49 2.620 -20.555 3.061 1.00 0.00 N ATOM 0 HA HIS A 49 -1.083 -19.126 4.299 1.00 0.00 H new ATOM 0 HB2 HIS A 49 0.249 -17.214 2.356 1.00 0.00 H new ATOM 0 HB3 HIS A 49 0.484 -16.897 4.063 1.00 0.00 H new ATOM 0 HD2 HIS A 49 1.062 -19.999 1.611 1.00 0.00 H new ATOM 0 HE1 HIS A 49 3.722 -20.308 4.876 1.00 0.00 H new ATOM 0 HE2 HIS A 49 3.056 -21.378 2.645 1.00 0.00 H new ATOM 752 N PHE A 50 -1.710 -15.964 4.195 1.00 0.00 N ATOM 753 CA PHE A 50 -2.530 -14.907 4.858 1.00 0.00 C ATOM 754 C PHE A 50 -1.999 -13.520 4.484 1.00 0.00 C ATOM 755 O PHE A 50 -1.323 -13.354 3.489 1.00 0.00 O ATOM 756 CB PHE A 50 -2.364 -15.159 6.357 1.00 0.00 C ATOM 757 CG PHE A 50 -0.901 -15.072 6.724 1.00 0.00 C ATOM 758 CD1 PHE A 50 -0.069 -16.184 6.550 1.00 0.00 C ATOM 759 CD2 PHE A 50 -0.380 -13.880 7.240 1.00 0.00 C ATOM 760 CE1 PHE A 50 1.287 -16.103 6.890 1.00 0.00 C ATOM 761 CE2 PHE A 50 0.976 -13.799 7.581 1.00 0.00 C ATOM 762 CZ PHE A 50 1.809 -14.910 7.406 1.00 0.00 C ATOM 0 H PHE A 50 -0.925 -15.621 3.642 1.00 0.00 H new ATOM 0 HA PHE A 50 -3.576 -14.941 4.554 1.00 0.00 H new ATOM 0 HB2 PHE A 50 -2.937 -14.426 6.925 1.00 0.00 H new ATOM 0 HB3 PHE A 50 -2.757 -16.142 6.617 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -0.473 -17.104 6.154 1.00 0.00 H new ATOM 0 HD2 PHE A 50 -1.023 -13.023 7.375 1.00 0.00 H new ATOM 0 HE1 PHE A 50 1.930 -16.960 6.754 1.00 0.00 H new ATOM 0 HE2 PHE A 50 1.379 -12.879 7.979 1.00 0.00 H new ATOM 0 HZ PHE A 50 2.855 -14.847 7.669 1.00 0.00 H new ATOM 772 N PHE A 51 -2.298 -12.523 5.273 1.00 0.00 N ATOM 773 CA PHE A 51 -1.804 -11.151 4.954 1.00 0.00 C ATOM 774 C PHE A 51 -1.208 -10.495 6.203 1.00 0.00 C ATOM 775 O PHE A 51 -1.625 -10.757 7.314 1.00 0.00 O ATOM 776 CB PHE A 51 -3.033 -10.382 4.471 1.00 0.00 C ATOM 777 CG PHE A 51 -4.150 -10.515 5.479 1.00 0.00 C ATOM 778 CD1 PHE A 51 -4.259 -9.595 6.528 1.00 0.00 C ATOM 779 CD2 PHE A 51 -5.081 -11.554 5.360 1.00 0.00 C ATOM 780 CE1 PHE A 51 -5.299 -9.714 7.458 1.00 0.00 C ATOM 781 CE2 PHE A 51 -6.121 -11.672 6.289 1.00 0.00 C ATOM 782 CZ PHE A 51 -6.230 -10.751 7.337 1.00 0.00 C ATOM 0 H PHE A 51 -2.860 -12.598 6.121 1.00 0.00 H new ATOM 0 HA PHE A 51 -1.016 -11.164 4.201 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -2.783 -9.331 4.329 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -3.356 -10.766 3.504 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -3.541 -8.793 6.620 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -4.997 -12.265 4.551 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -5.382 -9.005 8.269 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -6.839 -12.473 6.197 1.00 0.00 H new ATOM 0 HZ PHE A 51 -7.034 -10.841 8.053 1.00 0.00 H new ATOM 792 N THR A 52 -0.234 -9.645 6.027 1.00 0.00 N ATOM 793 CA THR A 52 0.397 -8.972 7.199 1.00 0.00 C ATOM 794 C THR A 52 0.376 -7.452 7.010 1.00 0.00 C ATOM 795 O THR A 52 0.330 -6.957 5.902 1.00 0.00 O ATOM 796 CB THR A 52 1.834 -9.491 7.223 1.00 0.00 C ATOM 797 OG1 THR A 52 1.822 -10.910 7.298 1.00 0.00 O ATOM 798 CG2 THR A 52 2.566 -8.920 8.437 1.00 0.00 C ATOM 0 H THR A 52 0.154 -9.386 5.120 1.00 0.00 H new ATOM 0 HA THR A 52 -0.128 -9.182 8.131 1.00 0.00 H new ATOM 0 HB THR A 52 2.348 -9.179 6.314 1.00 0.00 H new ATOM 0 HG1 THR A 52 2.743 -11.245 7.312 1.00 0.00 H new ATOM 0 HG21 THR A 52 3.591 -9.292 8.452 1.00 0.00 H new ATOM 0 HG22 THR A 52 2.575 -7.832 8.377 1.00 0.00 H new ATOM 0 HG23 THR A 52 2.055 -9.229 9.349 1.00 0.00 H new ATOM 806 N LEU A 53 0.413 -6.707 8.082 1.00 0.00 N ATOM 807 CA LEU A 53 0.397 -5.221 7.951 1.00 0.00 C ATOM 808 C LEU A 53 1.404 -4.582 8.912 1.00 0.00 C ATOM 809 O LEU A 53 1.638 -5.069 10.000 1.00 0.00 O ATOM 810 CB LEU A 53 -1.024 -4.800 8.324 1.00 0.00 C ATOM 811 CG LEU A 53 -1.055 -3.288 8.544 1.00 0.00 C ATOM 812 CD1 LEU A 53 -2.106 -2.662 7.627 1.00 0.00 C ATOM 813 CD2 LEU A 53 -1.415 -2.990 9.999 1.00 0.00 C ATOM 0 H LEU A 53 0.453 -7.060 9.038 1.00 0.00 H new ATOM 0 HA LEU A 53 0.671 -4.903 6.945 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -1.719 -5.079 7.532 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -1.345 -5.318 9.228 1.00 0.00 H new ATOM 0 HG LEU A 53 -0.074 -2.870 8.318 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -2.129 -1.583 7.783 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -1.854 -2.873 6.588 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -3.085 -3.083 7.856 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -1.437 -1.911 10.155 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -2.396 -3.409 10.224 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -0.670 -3.437 10.657 1.00 0.00 H new ATOM 825 N SER A 54 1.998 -3.491 8.513 1.00 0.00 N ATOM 826 CA SER A 54 2.989 -2.809 9.395 1.00 0.00 C ATOM 827 C SER A 54 2.808 -1.290 9.322 1.00 0.00 C ATOM 828 O SER A 54 2.326 -0.760 8.340 1.00 0.00 O ATOM 829 CB SER A 54 4.354 -3.211 8.842 1.00 0.00 C ATOM 830 OG SER A 54 4.641 -2.430 7.689 1.00 0.00 O ATOM 0 H SER A 54 1.840 -3.041 7.612 1.00 0.00 H new ATOM 0 HA SER A 54 2.872 -3.092 10.441 1.00 0.00 H new ATOM 0 HB2 SER A 54 5.124 -3.061 9.598 1.00 0.00 H new ATOM 0 HB3 SER A 54 4.359 -4.271 8.588 1.00 0.00 H new ATOM 0 HG SER A 54 5.244 -1.697 7.932 1.00 0.00 H new ATOM 836 N VAL A 55 3.190 -0.586 10.354 1.00 0.00 N ATOM 837 CA VAL A 55 3.037 0.898 10.341 1.00 0.00 C ATOM 838 C VAL A 55 4.401 1.576 10.501 1.00 0.00 C ATOM 839 O VAL A 55 5.400 0.934 10.758 1.00 0.00 O ATOM 840 CB VAL A 55 2.139 1.214 11.537 1.00 0.00 C ATOM 841 CG1 VAL A 55 2.894 0.921 12.835 1.00 0.00 C ATOM 842 CG2 VAL A 55 1.745 2.692 11.500 1.00 0.00 C ATOM 0 H VAL A 55 3.600 -0.973 11.204 1.00 0.00 H new ATOM 0 HA VAL A 55 2.613 1.259 9.404 1.00 0.00 H new ATOM 0 HB VAL A 55 1.242 0.596 11.491 1.00 0.00 H new ATOM 0 HG11 VAL A 55 2.253 1.147 13.687 1.00 0.00 H new ATOM 0 HG12 VAL A 55 3.177 -0.131 12.862 1.00 0.00 H new ATOM 0 HG13 VAL A 55 3.791 1.539 12.882 1.00 0.00 H new ATOM 0 HG21 VAL A 55 1.105 2.919 12.352 1.00 0.00 H new ATOM 0 HG22 VAL A 55 2.642 3.309 11.546 1.00 0.00 H new ATOM 0 HG23 VAL A 55 1.207 2.902 10.576 1.00 0.00 H new ATOM 852 N LYS A 56 4.449 2.873 10.353 1.00 0.00 N ATOM 853 CA LYS A 56 5.746 3.597 10.495 1.00 0.00 C ATOM 854 C LYS A 56 5.634 4.674 11.578 1.00 0.00 C ATOM 855 O LYS A 56 4.641 5.367 11.678 1.00 0.00 O ATOM 856 CB LYS A 56 5.994 4.239 9.130 1.00 0.00 C ATOM 857 CG LYS A 56 7.500 4.380 8.898 1.00 0.00 C ATOM 858 CD LYS A 56 8.018 5.612 9.643 1.00 0.00 C ATOM 859 CE LYS A 56 9.502 5.814 9.325 1.00 0.00 C ATOM 860 NZ LYS A 56 9.530 6.331 7.929 1.00 0.00 N ATOM 0 H LYS A 56 3.645 3.463 10.140 1.00 0.00 H new ATOM 0 HA LYS A 56 6.559 2.932 10.788 1.00 0.00 H new ATOM 0 HB2 LYS A 56 5.550 3.629 8.343 1.00 0.00 H new ATOM 0 HB3 LYS A 56 5.515 5.217 9.084 1.00 0.00 H new ATOM 0 HG2 LYS A 56 8.018 3.487 9.247 1.00 0.00 H new ATOM 0 HG3 LYS A 56 7.707 4.473 7.832 1.00 0.00 H new ATOM 0 HD2 LYS A 56 7.449 6.494 9.349 1.00 0.00 H new ATOM 0 HD3 LYS A 56 7.879 5.486 10.717 1.00 0.00 H new ATOM 0 HE2 LYS A 56 9.961 6.520 10.017 1.00 0.00 H new ATOM 0 HE3 LYS A 56 10.055 4.879 9.411 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 10.478 6.700 7.714 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 9.300 5.561 7.269 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 8.831 7.094 7.827 1.00 0.00 H new ATOM 874 N THR A 57 6.647 4.824 12.387 1.00 0.00 N ATOM 875 CA THR A 57 6.596 5.858 13.460 1.00 0.00 C ATOM 876 C THR A 57 8.009 6.344 13.794 1.00 0.00 C ATOM 877 O THR A 57 8.969 5.988 13.140 1.00 0.00 O ATOM 878 CB THR A 57 5.973 5.151 14.664 1.00 0.00 C ATOM 879 OG1 THR A 57 5.308 3.974 14.226 1.00 0.00 O ATOM 880 CG2 THR A 57 4.970 6.085 15.343 1.00 0.00 C ATOM 0 H THR A 57 7.507 4.276 12.352 1.00 0.00 H new ATOM 0 HA THR A 57 6.021 6.735 13.161 1.00 0.00 H new ATOM 0 HB THR A 57 6.755 4.884 15.375 1.00 0.00 H new ATOM 0 HG1 THR A 57 4.355 4.164 14.100 1.00 0.00 H new ATOM 0 HG21 THR A 57 4.526 5.580 16.201 1.00 0.00 H new ATOM 0 HG22 THR A 57 5.482 6.987 15.677 1.00 0.00 H new ATOM 0 HG23 THR A 57 4.186 6.354 14.635 1.00 0.00 H new ATOM 888 N GLN A 58 8.144 7.155 14.808 1.00 0.00 N ATOM 889 CA GLN A 58 9.495 7.663 15.183 1.00 0.00 C ATOM 890 C GLN A 58 10.178 6.689 16.147 1.00 0.00 C ATOM 891 O GLN A 58 11.046 7.062 16.910 1.00 0.00 O ATOM 892 CB GLN A 58 9.238 9.005 15.869 1.00 0.00 C ATOM 893 CG GLN A 58 8.194 9.795 15.076 1.00 0.00 C ATOM 894 CD GLN A 58 8.705 11.215 14.832 1.00 0.00 C ATOM 895 OE1 GLN A 58 9.374 11.786 15.671 1.00 0.00 O ATOM 896 NE2 GLN A 58 8.416 11.817 13.710 1.00 0.00 N ATOM 0 H GLN A 58 7.378 7.488 15.393 1.00 0.00 H new ATOM 0 HA GLN A 58 10.151 7.766 14.319 1.00 0.00 H new ATOM 0 HB2 GLN A 58 8.889 8.843 16.889 1.00 0.00 H new ATOM 0 HB3 GLN A 58 10.165 9.574 15.936 1.00 0.00 H new ATOM 0 HG2 GLN A 58 7.994 9.301 14.125 1.00 0.00 H new ATOM 0 HG3 GLN A 58 7.252 9.825 15.624 1.00 0.00 H new ATOM 0 HE21 GLN A 58 7.855 11.339 13.005 1.00 0.00 H new ATOM 0 HE22 GLN A 58 8.752 12.765 13.539 1.00 0.00 H new ATOM 905 N SER A 59 9.790 5.443 16.119 1.00 0.00 N ATOM 906 CA SER A 59 10.417 4.447 17.035 1.00 0.00 C ATOM 907 C SER A 59 10.929 3.244 16.237 1.00 0.00 C ATOM 908 O SER A 59 11.517 2.332 16.781 1.00 0.00 O ATOM 909 CB SER A 59 9.297 4.024 17.984 1.00 0.00 C ATOM 910 OG SER A 59 8.061 4.022 17.280 1.00 0.00 O ATOM 0 H SER A 59 9.067 5.072 15.503 1.00 0.00 H new ATOM 0 HA SER A 59 11.272 4.859 17.571 1.00 0.00 H new ATOM 0 HB2 SER A 59 9.501 3.032 18.387 1.00 0.00 H new ATOM 0 HB3 SER A 59 9.245 4.708 18.831 1.00 0.00 H new ATOM 0 HG SER A 59 7.676 3.121 17.297 1.00 0.00 H new ATOM 916 N GLY A 60 10.707 3.237 14.951 1.00 0.00 N ATOM 917 CA GLY A 60 11.180 2.095 14.120 1.00 0.00 C ATOM 918 C GLY A 60 9.989 1.466 13.394 1.00 0.00 C ATOM 919 O GLY A 60 8.919 1.318 13.950 1.00 0.00 O ATOM 0 H GLY A 60 10.219 3.973 14.440 1.00 0.00 H new ATOM 0 HA2 GLY A 60 11.920 2.439 13.397 1.00 0.00 H new ATOM 0 HA3 GLY A 60 11.670 1.352 14.749 1.00 0.00 H new ATOM 923 N THR A 61 10.167 1.096 12.155 1.00 0.00 N ATOM 924 CA THR A 61 9.044 0.477 11.394 1.00 0.00 C ATOM 925 C THR A 61 9.134 -1.050 11.462 1.00 0.00 C ATOM 926 O THR A 61 10.006 -1.658 10.872 1.00 0.00 O ATOM 927 CB THR A 61 9.227 0.963 9.955 1.00 0.00 C ATOM 928 OG1 THR A 61 8.103 0.569 9.180 1.00 0.00 O ATOM 929 CG2 THR A 61 10.499 0.352 9.365 1.00 0.00 C ATOM 0 H THR A 61 11.040 1.195 11.637 1.00 0.00 H new ATOM 0 HA THR A 61 8.070 0.754 11.797 1.00 0.00 H new ATOM 0 HB THR A 61 9.313 2.050 9.945 1.00 0.00 H new ATOM 0 HG1 THR A 61 7.286 0.680 9.709 1.00 0.00 H new ATOM 0 HG21 THR A 61 10.628 0.699 8.340 1.00 0.00 H new ATOM 0 HG22 THR A 61 11.359 0.656 9.962 1.00 0.00 H new ATOM 0 HG23 THR A 61 10.418 -0.735 9.372 1.00 0.00 H new ATOM 937 N LYS A 62 8.237 -1.676 12.173 1.00 0.00 N ATOM 938 CA LYS A 62 8.269 -3.164 12.274 1.00 0.00 C ATOM 939 C LYS A 62 7.077 -3.766 11.527 1.00 0.00 C ATOM 940 O LYS A 62 6.061 -3.127 11.347 1.00 0.00 O ATOM 941 CB LYS A 62 8.174 -3.462 13.771 1.00 0.00 C ATOM 942 CG LYS A 62 9.558 -3.325 14.408 1.00 0.00 C ATOM 943 CD LYS A 62 10.008 -4.683 14.949 1.00 0.00 C ATOM 944 CE LYS A 62 10.891 -5.380 13.912 1.00 0.00 C ATOM 945 NZ LYS A 62 11.712 -6.347 14.693 1.00 0.00 N ATOM 0 H LYS A 62 7.483 -1.222 12.689 1.00 0.00 H new ATOM 0 HA LYS A 62 9.169 -3.591 11.832 1.00 0.00 H new ATOM 0 HB2 LYS A 62 7.474 -2.774 14.246 1.00 0.00 H new ATOM 0 HB3 LYS A 62 7.788 -4.469 13.928 1.00 0.00 H new ATOM 0 HG2 LYS A 62 10.274 -2.960 13.672 1.00 0.00 H new ATOM 0 HG3 LYS A 62 9.528 -2.592 15.214 1.00 0.00 H new ATOM 0 HD2 LYS A 62 10.558 -4.551 15.880 1.00 0.00 H new ATOM 0 HD3 LYS A 62 9.140 -5.301 15.177 1.00 0.00 H new ATOM 0 HE2 LYS A 62 10.289 -5.890 13.160 1.00 0.00 H new ATOM 0 HE3 LYS A 62 11.521 -4.664 13.384 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 12.562 -6.599 14.149 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 11.994 -5.914 15.595 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 11.154 -7.204 14.880 1.00 0.00 H new ATOM 959 N ASN A 63 7.195 -4.990 11.089 1.00 0.00 N ATOM 960 CA ASN A 63 6.068 -5.632 10.350 1.00 0.00 C ATOM 961 C ASN A 63 5.461 -6.759 11.188 1.00 0.00 C ATOM 962 O ASN A 63 6.159 -7.624 11.680 1.00 0.00 O ATOM 963 CB ASN A 63 6.704 -6.188 9.075 1.00 0.00 C ATOM 964 CG ASN A 63 5.787 -7.244 8.456 1.00 0.00 C ATOM 965 OD1 ASN A 63 6.068 -8.424 8.521 1.00 0.00 O ATOM 966 ND2 ASN A 63 4.694 -6.867 7.851 1.00 0.00 N ATOM 0 H ASN A 63 8.022 -5.574 11.210 1.00 0.00 H new ATOM 0 HA ASN A 63 5.261 -4.933 10.132 1.00 0.00 H new ATOM 0 HB2 ASN A 63 6.877 -5.381 8.363 1.00 0.00 H new ATOM 0 HB3 ASN A 63 7.676 -6.626 9.304 1.00 0.00 H new ATOM 0 HD21 ASN A 63 4.076 -7.563 7.433 1.00 0.00 H new ATOM 0 HD22 ASN A 63 4.457 -5.876 7.796 1.00 0.00 H new ATOM 973 N LEU A 64 4.166 -6.754 11.364 1.00 0.00 N ATOM 974 CA LEU A 64 3.523 -7.825 12.182 1.00 0.00 C ATOM 975 C LEU A 64 2.338 -8.434 11.425 1.00 0.00 C ATOM 976 O LEU A 64 1.716 -7.790 10.605 1.00 0.00 O ATOM 977 CB LEU A 64 3.053 -7.118 13.452 1.00 0.00 C ATOM 978 CG LEU A 64 4.196 -6.269 14.015 1.00 0.00 C ATOM 979 CD1 LEU A 64 3.789 -4.795 14.015 1.00 0.00 C ATOM 980 CD2 LEU A 64 4.505 -6.712 15.445 1.00 0.00 C ATOM 0 H LEU A 64 3.528 -6.058 10.979 1.00 0.00 H new ATOM 0 HA LEU A 64 4.205 -8.646 12.403 1.00 0.00 H new ATOM 0 HB2 LEU A 64 2.191 -6.488 13.233 1.00 0.00 H new ATOM 0 HB3 LEU A 64 2.732 -7.851 14.192 1.00 0.00 H new ATOM 0 HG LEU A 64 5.082 -6.400 13.394 1.00 0.00 H new ATOM 0 HD11 LEU A 64 4.604 -4.193 14.416 1.00 0.00 H new ATOM 0 HD12 LEU A 64 3.571 -4.478 12.995 1.00 0.00 H new ATOM 0 HD13 LEU A 64 2.901 -4.663 14.634 1.00 0.00 H new ATOM 0 HD21 LEU A 64 5.319 -6.107 15.845 1.00 0.00 H new ATOM 0 HD22 LEU A 64 3.618 -6.583 16.065 1.00 0.00 H new ATOM 0 HD23 LEU A 64 4.799 -7.762 15.445 1.00 0.00 H new ATOM 992 N ARG A 65 2.026 -9.676 11.691 1.00 0.00 N ATOM 993 CA ARG A 65 0.886 -10.327 10.980 1.00 0.00 C ATOM 994 C ARG A 65 -0.166 -10.821 11.978 1.00 0.00 C ATOM 995 O ARG A 65 -0.400 -10.213 13.004 1.00 0.00 O ATOM 996 CB ARG A 65 1.510 -11.509 10.235 1.00 0.00 C ATOM 997 CG ARG A 65 1.883 -12.605 11.237 1.00 0.00 C ATOM 998 CD ARG A 65 2.886 -13.565 10.592 1.00 0.00 C ATOM 999 NE ARG A 65 2.098 -14.788 10.278 1.00 0.00 N ATOM 1000 CZ ARG A 65 2.709 -15.919 10.049 1.00 0.00 C ATOM 1001 NH1 ARG A 65 4.012 -15.979 10.095 1.00 0.00 N ATOM 1002 NH2 ARG A 65 2.016 -16.990 9.775 1.00 0.00 N ATOM 0 H ARG A 65 2.510 -10.266 12.368 1.00 0.00 H new ATOM 0 HA ARG A 65 0.378 -9.636 10.308 1.00 0.00 H new ATOM 0 HB2 ARG A 65 0.808 -11.899 9.498 1.00 0.00 H new ATOM 0 HB3 ARG A 65 2.396 -11.183 9.690 1.00 0.00 H new ATOM 0 HG2 ARG A 65 2.314 -12.161 12.135 1.00 0.00 H new ATOM 0 HG3 ARG A 65 0.990 -13.149 11.547 1.00 0.00 H new ATOM 0 HD2 ARG A 65 3.322 -13.134 9.691 1.00 0.00 H new ATOM 0 HD3 ARG A 65 3.710 -13.789 11.269 1.00 0.00 H new ATOM 0 HE ARG A 65 1.080 -14.743 10.242 1.00 0.00 H new ATOM 0 HH11 ARG A 65 4.554 -15.142 10.310 1.00 0.00 H new ATOM 0 HH12 ARG A 65 4.488 -16.863 9.916 1.00 0.00 H new ATOM 0 HH21 ARG A 65 0.998 -16.943 9.740 1.00 0.00 H new ATOM 0 HH22 ARG A 65 2.493 -17.874 9.596 1.00 0.00 H new ATOM 1016 N ILE A 66 -0.805 -11.920 11.678 1.00 0.00 N ATOM 1017 CA ILE A 66 -1.849 -12.460 12.597 1.00 0.00 C ATOM 1018 C ILE A 66 -1.429 -13.834 13.132 1.00 0.00 C ATOM 1019 O ILE A 66 -0.747 -14.588 12.467 1.00 0.00 O ATOM 1020 CB ILE A 66 -3.106 -12.583 11.734 1.00 0.00 C ATOM 1021 CG1 ILE A 66 -4.121 -13.494 12.432 1.00 0.00 C ATOM 1022 CG2 ILE A 66 -2.740 -13.182 10.376 1.00 0.00 C ATOM 1023 CD1 ILE A 66 -4.741 -12.754 13.618 1.00 0.00 C ATOM 0 H ILE A 66 -0.648 -12.469 10.833 1.00 0.00 H new ATOM 0 HA ILE A 66 -2.008 -11.819 13.464 1.00 0.00 H new ATOM 0 HB ILE A 66 -3.541 -11.594 11.591 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -4.899 -13.794 11.730 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -3.632 -14.406 12.774 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -3.637 -13.269 9.763 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -2.019 -12.535 9.875 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -2.302 -14.170 10.520 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -5.463 -13.402 14.114 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -3.958 -12.476 14.323 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -5.245 -11.855 13.263 1.00 0.00 H new ATOM 1035 N GLN A 67 -1.836 -14.162 14.327 1.00 0.00 N ATOM 1036 CA GLN A 67 -1.468 -15.486 14.905 1.00 0.00 C ATOM 1037 C GLN A 67 -2.710 -16.377 15.006 1.00 0.00 C ATOM 1038 O GLN A 67 -3.702 -16.008 15.602 1.00 0.00 O ATOM 1039 CB GLN A 67 -0.918 -15.172 16.297 1.00 0.00 C ATOM 1040 CG GLN A 67 -0.876 -16.455 17.131 1.00 0.00 C ATOM 1041 CD GLN A 67 0.453 -16.530 17.883 1.00 0.00 C ATOM 1042 OE1 GLN A 67 1.378 -17.186 17.443 1.00 0.00 O ATOM 1043 NE2 GLN A 67 0.590 -15.882 19.008 1.00 0.00 N ATOM 0 H GLN A 67 -2.408 -13.570 14.929 1.00 0.00 H new ATOM 0 HA GLN A 67 -0.741 -16.019 14.292 1.00 0.00 H new ATOM 0 HB2 GLN A 67 0.082 -14.745 16.217 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -1.544 -14.427 16.788 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -1.707 -16.470 17.836 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -0.990 -17.325 16.485 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -0.185 -15.332 19.377 1.00 0.00 H new ATOM 0 HE22 GLN A 67 1.472 -15.926 19.518 1.00 0.00 H new ATOM 1052 N CYS A 68 -2.664 -17.546 14.428 1.00 0.00 N ATOM 1053 CA CYS A 68 -3.845 -18.455 14.491 1.00 0.00 C ATOM 1054 C CYS A 68 -3.784 -19.320 15.753 1.00 0.00 C ATOM 1055 O CYS A 68 -2.800 -19.981 16.018 1.00 0.00 O ATOM 1056 CB CYS A 68 -3.741 -19.326 13.239 1.00 0.00 C ATOM 1057 SG CYS A 68 -2.217 -20.299 13.306 1.00 0.00 S ATOM 0 H CYS A 68 -1.861 -17.911 13.915 1.00 0.00 H new ATOM 0 HA CYS A 68 -4.786 -17.906 14.530 1.00 0.00 H new ATOM 0 HB2 CYS A 68 -4.605 -19.987 13.170 1.00 0.00 H new ATOM 0 HB3 CYS A 68 -3.747 -18.701 12.346 1.00 0.00 H new ATOM 0 HG CYS A 68 -1.888 -20.505 14.547 1.00 0.00 H new ATOM 1063 N GLU A 69 -4.831 -19.319 16.533 1.00 0.00 N ATOM 1064 CA GLU A 69 -4.834 -20.141 17.777 1.00 0.00 C ATOM 1065 C GLU A 69 -6.068 -21.048 17.808 1.00 0.00 C ATOM 1066 O GLU A 69 -7.164 -20.608 18.091 1.00 0.00 O ATOM 1067 CB GLU A 69 -4.884 -19.127 18.920 1.00 0.00 C ATOM 1068 CG GLU A 69 -3.470 -18.890 19.453 1.00 0.00 C ATOM 1069 CD GLU A 69 -3.537 -18.537 20.940 1.00 0.00 C ATOM 1070 OE1 GLU A 69 -4.466 -18.984 21.593 1.00 0.00 O ATOM 1071 OE2 GLU A 69 -2.659 -17.826 21.401 1.00 0.00 O ATOM 0 H GLU A 69 -5.683 -18.785 16.363 1.00 0.00 H new ATOM 0 HA GLU A 69 -3.961 -20.790 17.846 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -5.314 -18.189 18.570 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -5.528 -19.494 19.719 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -2.861 -19.782 19.307 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -2.991 -18.083 18.898 1.00 0.00 H new ATOM 1078 N GLY A 70 -5.897 -22.308 17.518 1.00 0.00 N ATOM 1079 CA GLY A 70 -7.061 -23.239 17.531 1.00 0.00 C ATOM 1080 C GLY A 70 -8.142 -22.717 16.584 1.00 0.00 C ATOM 1081 O GLY A 70 -8.049 -22.858 15.380 1.00 0.00 O ATOM 0 H GLY A 70 -5.003 -22.733 17.273 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -6.746 -24.237 17.225 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -7.459 -23.326 18.542 1.00 0.00 H new ATOM 1085 N GLY A 71 -9.170 -22.114 17.117 1.00 0.00 N ATOM 1086 CA GLY A 71 -10.257 -21.583 16.246 1.00 0.00 C ATOM 1087 C GLY A 71 -10.410 -20.080 16.478 1.00 0.00 C ATOM 1088 O GLY A 71 -11.501 -19.545 16.452 1.00 0.00 O ATOM 0 H GLY A 71 -9.304 -21.966 18.117 1.00 0.00 H new ATOM 0 HA2 GLY A 71 -10.026 -21.778 15.199 1.00 0.00 H new ATOM 0 HA3 GLY A 71 -11.195 -22.093 16.466 1.00 0.00 H new ATOM 1092 N SER A 72 -9.324 -19.391 16.705 1.00 0.00 N ATOM 1093 CA SER A 72 -9.408 -17.921 16.939 1.00 0.00 C ATOM 1094 C SER A 72 -8.209 -17.215 16.301 1.00 0.00 C ATOM 1095 O SER A 72 -7.195 -17.823 16.020 1.00 0.00 O ATOM 1096 CB SER A 72 -9.383 -17.755 18.458 1.00 0.00 C ATOM 1097 OG SER A 72 -8.720 -18.869 19.041 1.00 0.00 O ATOM 0 H SER A 72 -8.383 -19.783 16.738 1.00 0.00 H new ATOM 0 HA SER A 72 -10.305 -17.485 16.499 1.00 0.00 H new ATOM 0 HB2 SER A 72 -8.871 -16.831 18.726 1.00 0.00 H new ATOM 0 HB3 SER A 72 -10.400 -17.679 18.844 1.00 0.00 H new ATOM 0 HG SER A 72 -7.936 -19.103 18.501 1.00 0.00 H new ATOM 1103 N PHE A 73 -8.319 -15.936 16.070 1.00 0.00 N ATOM 1104 CA PHE A 73 -7.186 -15.190 15.448 1.00 0.00 C ATOM 1105 C PHE A 73 -6.927 -13.892 16.218 1.00 0.00 C ATOM 1106 O PHE A 73 -7.844 -13.201 16.611 1.00 0.00 O ATOM 1107 CB PHE A 73 -7.654 -14.885 14.026 1.00 0.00 C ATOM 1108 CG PHE A 73 -6.830 -15.678 13.040 1.00 0.00 C ATOM 1109 CD1 PHE A 73 -5.452 -15.824 13.237 1.00 0.00 C ATOM 1110 CD2 PHE A 73 -7.444 -16.264 11.928 1.00 0.00 C ATOM 1111 CE1 PHE A 73 -4.688 -16.558 12.322 1.00 0.00 C ATOM 1112 CE2 PHE A 73 -6.681 -16.999 11.012 1.00 0.00 C ATOM 1113 CZ PHE A 73 -5.303 -17.146 11.210 1.00 0.00 C ATOM 0 H PHE A 73 -9.143 -15.374 16.284 1.00 0.00 H new ATOM 0 HA PHE A 73 -6.256 -15.758 15.460 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -8.709 -15.136 13.918 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -7.557 -13.819 13.821 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -4.978 -15.370 14.095 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -8.507 -16.150 11.776 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -3.625 -16.671 12.474 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -7.155 -17.452 10.154 1.00 0.00 H new ATOM 0 HZ PHE A 73 -4.714 -17.713 10.505 1.00 0.00 H new ATOM 1123 N SER A 74 -5.685 -13.554 16.437 1.00 0.00 N ATOM 1124 CA SER A 74 -5.375 -12.301 17.182 1.00 0.00 C ATOM 1125 C SER A 74 -3.980 -11.793 16.807 1.00 0.00 C ATOM 1126 O SER A 74 -3.099 -12.560 16.478 1.00 0.00 O ATOM 1127 CB SER A 74 -5.424 -12.696 18.658 1.00 0.00 C ATOM 1128 OG SER A 74 -5.716 -11.547 19.442 1.00 0.00 O ATOM 0 H SER A 74 -4.873 -14.091 16.133 1.00 0.00 H new ATOM 0 HA SER A 74 -6.076 -11.499 16.951 1.00 0.00 H new ATOM 0 HB2 SER A 74 -6.184 -13.461 18.817 1.00 0.00 H new ATOM 0 HB3 SER A 74 -4.470 -13.126 18.963 1.00 0.00 H new ATOM 0 HG SER A 74 -5.750 -11.797 20.389 1.00 0.00 H new ATOM 1134 N LEU A 75 -3.774 -10.505 16.857 1.00 0.00 N ATOM 1135 CA LEU A 75 -2.434 -9.952 16.506 1.00 0.00 C ATOM 1136 C LEU A 75 -1.476 -10.105 17.691 1.00 0.00 C ATOM 1137 O LEU A 75 -0.811 -9.169 18.089 1.00 0.00 O ATOM 1138 CB LEU A 75 -2.680 -8.474 16.202 1.00 0.00 C ATOM 1139 CG LEU A 75 -2.202 -8.157 14.784 1.00 0.00 C ATOM 1140 CD1 LEU A 75 -2.730 -6.786 14.360 1.00 0.00 C ATOM 1141 CD2 LEU A 75 -0.672 -8.143 14.753 1.00 0.00 C ATOM 0 H LEU A 75 -4.474 -9.813 17.125 1.00 0.00 H new ATOM 0 HA LEU A 75 -1.981 -10.470 15.660 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -3.741 -8.244 16.299 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -2.151 -7.851 16.923 1.00 0.00 H new ATOM 0 HG LEU A 75 -2.575 -8.918 14.098 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -2.389 -6.561 13.349 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -3.820 -6.793 14.382 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -2.358 -6.025 15.046 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -0.331 -7.917 13.743 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -0.301 -7.382 15.440 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -0.293 -9.120 15.054 1.00 0.00 H new ATOM 1384 N VAL A 91 -9.057 -14.144 11.149 1.00 0.00 N ATOM 1385 CA VAL A 91 -7.998 -13.102 10.994 1.00 0.00 C ATOM 1386 C VAL A 91 -8.578 -11.705 11.226 1.00 0.00 C ATOM 1387 O VAL A 91 -7.872 -10.780 11.571 1.00 0.00 O ATOM 1388 CB VAL A 91 -7.500 -13.250 9.556 1.00 0.00 C ATOM 1389 CG1 VAL A 91 -8.486 -12.581 8.599 1.00 0.00 C ATOM 1390 CG2 VAL A 91 -6.130 -12.583 9.425 1.00 0.00 C ATOM 0 HA VAL A 91 -7.193 -13.227 11.718 1.00 0.00 H new ATOM 0 HB VAL A 91 -7.418 -14.308 9.307 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -8.129 -12.688 7.575 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -9.463 -13.055 8.694 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -8.571 -11.522 8.845 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -5.771 -12.686 8.401 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -6.215 -11.525 9.675 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -5.426 -13.061 10.106 1.00 0.00 H new ATOM 1400 N LEU A 92 -9.853 -11.541 11.027 1.00 0.00 N ATOM 1401 CA LEU A 92 -10.470 -10.198 11.221 1.00 0.00 C ATOM 1402 C LEU A 92 -10.167 -9.679 12.629 1.00 0.00 C ATOM 1403 O LEU A 92 -9.999 -8.495 12.837 1.00 0.00 O ATOM 1404 CB LEU A 92 -11.972 -10.421 11.044 1.00 0.00 C ATOM 1405 CG LEU A 92 -12.547 -9.345 10.122 1.00 0.00 C ATOM 1406 CD1 LEU A 92 -14.069 -9.301 10.277 1.00 0.00 C ATOM 1407 CD2 LEU A 92 -11.961 -7.981 10.496 1.00 0.00 C ATOM 0 H LEU A 92 -10.497 -12.277 10.738 1.00 0.00 H new ATOM 0 HA LEU A 92 -10.083 -9.460 10.518 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -12.156 -11.410 10.624 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -12.471 -10.388 12.013 1.00 0.00 H new ATOM 0 HG LEU A 92 -12.290 -9.580 9.089 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -14.480 -8.534 9.620 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -14.490 -10.270 10.011 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -14.323 -9.067 11.311 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -12.372 -7.216 9.838 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -12.216 -7.746 11.529 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -10.877 -8.009 10.388 1.00 0.00 H new ATOM 1419 N LYS A 93 -10.096 -10.548 13.597 1.00 0.00 N ATOM 1420 CA LYS A 93 -9.804 -10.089 14.986 1.00 0.00 C ATOM 1421 C LYS A 93 -8.474 -9.329 15.023 1.00 0.00 C ATOM 1422 O LYS A 93 -8.290 -8.419 15.808 1.00 0.00 O ATOM 1423 CB LYS A 93 -9.702 -11.371 15.814 1.00 0.00 C ATOM 1424 CG LYS A 93 -9.080 -11.054 17.177 1.00 0.00 C ATOM 1425 CD LYS A 93 -9.869 -9.933 17.859 1.00 0.00 C ATOM 1426 CE LYS A 93 -8.901 -8.862 18.365 1.00 0.00 C ATOM 1427 NZ LYS A 93 -8.876 -9.033 19.844 1.00 0.00 N ATOM 0 H LYS A 93 -10.227 -11.554 13.489 1.00 0.00 H new ATOM 0 HA LYS A 93 -10.571 -9.414 15.366 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -10.691 -11.809 15.947 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -9.095 -12.108 15.288 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -9.082 -11.946 17.804 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -8.040 -10.754 17.051 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -10.579 -9.495 17.157 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -10.449 -10.335 18.689 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -7.908 -8.993 17.936 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -9.238 -7.863 18.089 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -8.232 -8.332 20.264 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -9.834 -8.896 20.226 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -8.544 -9.991 20.077 1.00 0.00 H new ATOM 1441 N LEU A 94 -7.547 -9.693 14.182 1.00 0.00 N ATOM 1442 CA LEU A 94 -6.231 -8.989 14.169 1.00 0.00 C ATOM 1443 C LEU A 94 -6.429 -7.500 13.864 1.00 0.00 C ATOM 1444 O LEU A 94 -5.724 -6.654 14.377 1.00 0.00 O ATOM 1445 CB LEU A 94 -5.424 -9.674 13.059 1.00 0.00 C ATOM 1446 CG LEU A 94 -4.581 -8.639 12.309 1.00 0.00 C ATOM 1447 CD1 LEU A 94 -3.298 -9.297 11.796 1.00 0.00 C ATOM 1448 CD2 LEU A 94 -5.383 -8.094 11.125 1.00 0.00 C ATOM 0 H LEU A 94 -7.642 -10.448 13.502 1.00 0.00 H new ATOM 0 HA LEU A 94 -5.721 -9.045 15.131 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -4.778 -10.440 13.488 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -6.098 -10.177 12.366 1.00 0.00 H new ATOM 0 HG LEU A 94 -4.324 -7.822 12.983 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -2.699 -8.559 11.262 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -2.727 -9.687 12.639 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -3.553 -10.114 11.121 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -4.785 -7.357 10.589 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -5.639 -8.912 10.452 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -6.297 -7.624 11.490 1.00 0.00 H new ATOM 1460 N VAL A 95 -7.377 -7.173 13.028 1.00 0.00 N ATOM 1461 CA VAL A 95 -7.606 -5.737 12.690 1.00 0.00 C ATOM 1462 C VAL A 95 -7.837 -4.921 13.965 1.00 0.00 C ATOM 1463 O VAL A 95 -7.401 -3.793 14.077 1.00 0.00 O ATOM 1464 CB VAL A 95 -8.851 -5.717 11.799 1.00 0.00 C ATOM 1465 CG1 VAL A 95 -8.773 -6.855 10.778 1.00 0.00 C ATOM 1466 CG2 VAL A 95 -10.106 -5.891 12.660 1.00 0.00 C ATOM 0 H VAL A 95 -8.001 -7.834 12.566 1.00 0.00 H new ATOM 0 HA VAL A 95 -6.747 -5.296 12.184 1.00 0.00 H new ATOM 0 HB VAL A 95 -8.900 -4.762 11.275 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -9.661 -6.838 10.146 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -7.884 -6.729 10.160 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -8.718 -7.810 11.301 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -10.990 -5.876 12.022 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -10.056 -6.843 13.188 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -10.167 -5.078 13.383 1.00 0.00 H new ATOM 1476 N HIS A 96 -8.518 -5.480 14.928 1.00 0.00 N ATOM 1477 CA HIS A 96 -8.769 -4.730 16.192 1.00 0.00 C ATOM 1478 C HIS A 96 -7.446 -4.228 16.775 1.00 0.00 C ATOM 1479 O HIS A 96 -7.376 -3.162 17.354 1.00 0.00 O ATOM 1480 CB HIS A 96 -9.423 -5.743 17.131 1.00 0.00 C ATOM 1481 CG HIS A 96 -10.852 -5.345 17.379 1.00 0.00 C ATOM 1482 ND1 HIS A 96 -11.592 -4.629 16.451 1.00 0.00 N ATOM 1483 CD2 HIS A 96 -11.691 -5.555 18.445 1.00 0.00 C ATOM 1484 CE1 HIS A 96 -12.818 -4.435 16.971 1.00 0.00 C ATOM 1485 NE2 HIS A 96 -12.932 -4.979 18.186 1.00 0.00 N ATOM 0 H HIS A 96 -8.911 -6.421 14.895 1.00 0.00 H new ATOM 0 HA HIS A 96 -9.401 -3.855 16.038 1.00 0.00 H new ATOM 0 HB2 HIS A 96 -9.383 -6.740 16.693 1.00 0.00 H new ATOM 0 HB3 HIS A 96 -8.877 -5.787 18.074 1.00 0.00 H new ATOM 0 HD2 HIS A 96 -11.428 -6.086 19.348 1.00 0.00 H new ATOM 0 HE1 HIS A 96 -13.613 -3.904 16.468 1.00 0.00 H new ATOM 0 HE2 HIS A 96 -13.752 -4.974 18.793 1.00 0.00 H new ATOM 1493 N HIS A 97 -6.394 -4.985 16.622 1.00 0.00 N ATOM 1494 CA HIS A 97 -5.075 -4.546 17.165 1.00 0.00 C ATOM 1495 C HIS A 97 -4.451 -3.498 16.240 1.00 0.00 C ATOM 1496 O HIS A 97 -3.816 -2.565 16.685 1.00 0.00 O ATOM 1497 CB HIS A 97 -4.213 -5.811 17.199 1.00 0.00 C ATOM 1498 CG HIS A 97 -3.576 -5.948 18.555 1.00 0.00 C ATOM 1499 ND1 HIS A 97 -4.290 -6.365 19.668 1.00 0.00 N ATOM 1500 CD2 HIS A 97 -2.292 -5.730 18.995 1.00 0.00 C ATOM 1501 CE1 HIS A 97 -3.441 -6.384 20.711 1.00 0.00 C ATOM 1502 NE2 HIS A 97 -2.210 -6.007 20.356 1.00 0.00 N ATOM 0 H HIS A 97 -6.390 -5.887 16.146 1.00 0.00 H new ATOM 0 HA HIS A 97 -5.166 -4.092 18.152 1.00 0.00 H new ATOM 0 HB2 HIS A 97 -4.825 -6.687 16.983 1.00 0.00 H new ATOM 0 HB3 HIS A 97 -3.444 -5.761 16.428 1.00 0.00 H new ATOM 0 HD2 HIS A 97 -1.472 -5.395 18.378 1.00 0.00 H new ATOM 0 HE1 HIS A 97 -3.721 -6.670 21.714 1.00 0.00 H new ATOM 0 HE2 HIS A 97 -1.387 -5.937 20.954 1.00 0.00 H new ATOM 1510 N TYR A 98 -4.624 -3.646 14.955 1.00 0.00 N ATOM 1511 CA TYR A 98 -4.034 -2.659 14.005 1.00 0.00 C ATOM 1512 C TYR A 98 -4.654 -1.276 14.222 1.00 0.00 C ATOM 1513 O TYR A 98 -4.080 -0.266 13.867 1.00 0.00 O ATOM 1514 CB TYR A 98 -4.386 -3.188 12.614 1.00 0.00 C ATOM 1515 CG TYR A 98 -3.367 -4.219 12.188 1.00 0.00 C ATOM 1516 CD1 TYR A 98 -2.015 -4.043 12.505 1.00 0.00 C ATOM 1517 CD2 TYR A 98 -3.777 -5.349 11.471 1.00 0.00 C ATOM 1518 CE1 TYR A 98 -1.074 -4.999 12.106 1.00 0.00 C ATOM 1519 CE2 TYR A 98 -2.835 -6.305 11.072 1.00 0.00 C ATOM 1520 CZ TYR A 98 -1.483 -6.130 11.389 1.00 0.00 C ATOM 1521 OH TYR A 98 -0.554 -7.071 10.996 1.00 0.00 O ATOM 0 H TYR A 98 -5.148 -4.407 14.522 1.00 0.00 H new ATOM 0 HA TYR A 98 -2.958 -2.550 14.142 1.00 0.00 H new ATOM 0 HB2 TYR A 98 -5.382 -3.630 12.624 1.00 0.00 H new ATOM 0 HB3 TYR A 98 -4.409 -2.367 11.897 1.00 0.00 H new ATOM 0 HD1 TYR A 98 -1.698 -3.170 13.057 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -4.820 -5.484 11.225 1.00 0.00 H new ATOM 0 HE1 TYR A 98 -0.031 -4.864 12.351 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -3.152 -7.177 10.520 1.00 0.00 H new ATOM 0 HH TYR A 98 0.340 -6.670 11.002 1.00 0.00 H new ATOM 1531 N MET A 99 -5.819 -1.222 14.802 1.00 0.00 N ATOM 1532 CA MET A 99 -6.472 0.098 15.040 1.00 0.00 C ATOM 1533 C MET A 99 -7.360 0.035 16.286 1.00 0.00 C ATOM 1534 O MET A 99 -8.237 -0.802 16.383 1.00 0.00 O ATOM 1535 CB MET A 99 -7.317 0.353 13.792 1.00 0.00 C ATOM 1536 CG MET A 99 -6.459 1.036 12.725 1.00 0.00 C ATOM 1537 SD MET A 99 -6.327 -0.041 11.276 1.00 0.00 S ATOM 1538 CE MET A 99 -8.099 -0.182 10.938 1.00 0.00 C ATOM 0 H MET A 99 -6.349 -2.033 15.122 1.00 0.00 H new ATOM 0 HA MET A 99 -5.745 0.892 15.210 1.00 0.00 H new ATOM 0 HB2 MET A 99 -7.712 -0.588 13.409 1.00 0.00 H new ATOM 0 HB3 MET A 99 -8.173 0.980 14.041 1.00 0.00 H new ATOM 0 HG2 MET A 99 -6.903 1.991 12.443 1.00 0.00 H new ATOM 0 HG3 MET A 99 -5.467 1.251 13.123 1.00 0.00 H new ATOM 0 HE1 MET A 99 -8.261 -0.233 9.861 1.00 0.00 H new ATOM 0 HE2 MET A 99 -8.488 -1.086 11.407 1.00 0.00 H new ATOM 0 HE3 MET A 99 -8.617 0.688 11.342 1.00 0.00 H new ATOM 2022 N ARG A 134 -6.800 -2.496 24.202 1.00 0.00 N ATOM 2023 CA ARG A 134 -6.620 -2.109 22.774 1.00 0.00 C ATOM 2024 C ARG A 134 -5.489 -1.087 22.643 1.00 0.00 C ATOM 2025 O ARG A 134 -5.567 0.010 23.161 1.00 0.00 O ATOM 2026 CB ARG A 134 -7.956 -1.489 22.361 1.00 0.00 C ATOM 2027 CG ARG A 134 -8.744 -2.489 21.513 1.00 0.00 C ATOM 2028 CD ARG A 134 -9.027 -3.747 22.338 1.00 0.00 C ATOM 2029 NE ARG A 134 -7.878 -4.654 22.062 1.00 0.00 N ATOM 2030 CZ ARG A 134 -7.615 -5.643 22.873 1.00 0.00 C ATOM 2031 NH1 ARG A 134 -8.358 -5.838 23.929 1.00 0.00 N ATOM 2032 NH2 ARG A 134 -6.608 -6.435 22.630 1.00 0.00 N ATOM 0 HA ARG A 134 -6.354 -2.958 22.145 1.00 0.00 H new ATOM 0 HB2 ARG A 134 -8.530 -1.215 23.246 1.00 0.00 H new ATOM 0 HB3 ARG A 134 -7.784 -0.573 21.796 1.00 0.00 H new ATOM 0 HG2 ARG A 134 -9.680 -2.041 21.180 1.00 0.00 H new ATOM 0 HG3 ARG A 134 -8.179 -2.748 20.618 1.00 0.00 H new ATOM 0 HD2 ARG A 134 -9.100 -3.514 23.400 1.00 0.00 H new ATOM 0 HD3 ARG A 134 -9.972 -4.206 22.046 1.00 0.00 H new ATOM 0 HE ARG A 134 -7.296 -4.502 21.238 1.00 0.00 H new ATOM 0 HH11 ARG A 134 -9.145 -5.218 24.121 1.00 0.00 H new ATOM 0 HH12 ARG A 134 -8.152 -6.611 24.562 1.00 0.00 H new ATOM 0 HH21 ARG A 134 -6.026 -6.282 21.807 1.00 0.00 H new ATOM 0 HH22 ARG A 134 -6.402 -7.208 23.263 1.00 0.00 H new ATOM 2046 N ALA A 135 -4.437 -1.436 21.954 1.00 0.00 N ATOM 2047 CA ALA A 135 -3.301 -0.483 21.791 1.00 0.00 C ATOM 2048 C ALA A 135 -2.246 -1.072 20.858 1.00 0.00 C ATOM 2049 O ALA A 135 -1.572 -2.021 21.202 1.00 0.00 O ATOM 2050 CB ALA A 135 -2.716 -0.311 23.196 1.00 0.00 C ATOM 0 H ALA A 135 -4.314 -2.339 21.497 1.00 0.00 H new ATOM 0 HA ALA A 135 -3.624 0.464 21.360 1.00 0.00 H new ATOM 0 HB1 ALA A 135 -1.873 0.379 23.157 1.00 0.00 H new ATOM 0 HB2 ALA A 135 -3.481 0.088 23.862 1.00 0.00 H new ATOM 0 HB3 ALA A 135 -2.377 -1.277 23.570 1.00 0.00 H new ATOM 2056 N TYR A 136 -2.076 -0.516 19.689 1.00 0.00 N ATOM 2057 CA TYR A 136 -1.034 -1.062 18.776 1.00 0.00 C ATOM 2058 C TYR A 136 0.184 -0.140 18.806 1.00 0.00 C ATOM 2059 O TYR A 136 0.094 1.028 18.492 1.00 0.00 O ATOM 2060 CB TYR A 136 -1.678 -1.040 17.387 1.00 0.00 C ATOM 2061 CG TYR A 136 -1.201 -2.223 16.573 1.00 0.00 C ATOM 2062 CD1 TYR A 136 -1.494 -3.525 16.994 1.00 0.00 C ATOM 2063 CD2 TYR A 136 -0.472 -2.017 15.393 1.00 0.00 C ATOM 2064 CE1 TYR A 136 -1.058 -4.620 16.238 1.00 0.00 C ATOM 2065 CE2 TYR A 136 -0.034 -3.113 14.637 1.00 0.00 C ATOM 2066 CZ TYR A 136 -0.329 -4.415 15.061 1.00 0.00 C ATOM 2067 OH TYR A 136 0.099 -5.497 14.320 1.00 0.00 O ATOM 0 H TYR A 136 -2.604 0.280 19.332 1.00 0.00 H new ATOM 0 HA TYR A 136 -0.705 -2.063 19.055 1.00 0.00 H new ATOM 0 HB2 TYR A 136 -2.764 -1.067 17.481 1.00 0.00 H new ATOM 0 HB3 TYR A 136 -1.425 -0.111 16.875 1.00 0.00 H new ATOM 0 HD1 TYR A 136 -2.056 -3.685 17.902 1.00 0.00 H new ATOM 0 HD2 TYR A 136 -0.248 -1.012 15.066 1.00 0.00 H new ATOM 0 HE1 TYR A 136 -1.285 -5.624 16.564 1.00 0.00 H new ATOM 0 HE2 TYR A 136 0.530 -2.954 13.730 1.00 0.00 H new ATOM 0 HH TYR A 136 -0.516 -5.645 13.571 1.00 0.00 H new ATOM 2077 N TYR A 137 1.324 -0.653 19.167 1.00 0.00 N ATOM 2078 CA TYR A 137 2.537 0.204 19.193 1.00 0.00 C ATOM 2079 C TYR A 137 3.798 -0.655 19.125 1.00 0.00 C ATOM 2080 O TYR A 137 3.759 -1.849 19.339 1.00 0.00 O ATOM 2081 CB TYR A 137 2.454 0.990 20.500 1.00 0.00 C ATOM 2082 CG TYR A 137 3.070 0.211 21.631 1.00 0.00 C ATOM 2083 CD1 TYR A 137 4.460 0.066 21.714 1.00 0.00 C ATOM 2084 CD2 TYR A 137 2.246 -0.355 22.606 1.00 0.00 C ATOM 2085 CE1 TYR A 137 5.026 -0.648 22.768 1.00 0.00 C ATOM 2086 CE2 TYR A 137 2.806 -1.072 23.663 1.00 0.00 C ATOM 2087 CZ TYR A 137 4.200 -1.222 23.747 1.00 0.00 C ATOM 2088 OH TYR A 137 4.755 -1.931 24.792 1.00 0.00 O ATOM 0 H TYR A 137 1.468 -1.624 19.444 1.00 0.00 H new ATOM 0 HA TYR A 137 2.586 0.878 18.337 1.00 0.00 H new ATOM 0 HB2 TYR A 137 2.967 1.945 20.388 1.00 0.00 H new ATOM 0 HB3 TYR A 137 1.412 1.213 20.730 1.00 0.00 H new ATOM 0 HD1 TYR A 137 5.094 0.508 20.960 1.00 0.00 H new ATOM 0 HD2 TYR A 137 1.174 -0.237 22.541 1.00 0.00 H new ATOM 0 HE1 TYR A 137 6.098 -0.760 22.832 1.00 0.00 H new ATOM 0 HE2 TYR A 137 2.169 -1.511 24.416 1.00 0.00 H new ATOM 0 HH TYR A 137 4.206 -2.721 24.979 1.00 0.00 H new ATOM 2098 N ILE A 138 4.922 -0.057 18.857 1.00 0.00 N ATOM 2099 CA ILE A 138 6.178 -0.848 18.809 1.00 0.00 C ATOM 2100 C ILE A 138 7.193 -0.264 19.787 1.00 0.00 C ATOM 2101 O ILE A 138 7.501 0.911 19.766 1.00 0.00 O ATOM 2102 CB ILE A 138 6.685 -0.749 17.372 1.00 0.00 C ATOM 2103 CG1 ILE A 138 5.788 -1.591 16.459 1.00 0.00 C ATOM 2104 CG2 ILE A 138 8.119 -1.280 17.302 1.00 0.00 C ATOM 2105 CD1 ILE A 138 5.543 -0.846 15.147 1.00 0.00 C ATOM 0 H ILE A 138 5.025 0.940 18.670 1.00 0.00 H new ATOM 0 HA ILE A 138 6.017 -1.888 19.093 1.00 0.00 H new ATOM 0 HB ILE A 138 6.664 0.292 17.048 1.00 0.00 H new ATOM 0 HG12 ILE A 138 6.258 -2.554 16.259 1.00 0.00 H new ATOM 0 HG13 ILE A 138 4.839 -1.796 16.954 1.00 0.00 H new ATOM 0 HG21 ILE A 138 8.483 -1.210 16.277 1.00 0.00 H new ATOM 0 HG22 ILE A 138 8.759 -0.687 17.955 1.00 0.00 H new ATOM 0 HG23 ILE A 138 8.138 -2.321 17.624 1.00 0.00 H new ATOM 0 HD11 ILE A 138 4.905 -1.448 14.500 1.00 0.00 H new ATOM 0 HD12 ILE A 138 5.054 0.106 15.355 1.00 0.00 H new ATOM 0 HD13 ILE A 138 6.495 -0.664 14.649 1.00 0.00 H new ATOM 2117 N TYR A 139 7.709 -1.089 20.643 1.00 0.00 N ATOM 2118 CA TYR A 139 8.714 -0.614 21.645 1.00 0.00 C ATOM 2119 C TYR A 139 10.101 -0.590 21.011 1.00 0.00 C ATOM 2120 O TYR A 139 10.710 -1.611 20.764 1.00 0.00 O ATOM 2121 CB TYR A 139 8.691 -1.625 22.803 1.00 0.00 C ATOM 2122 CG TYR A 139 8.072 -2.914 22.338 1.00 0.00 C ATOM 2123 CD1 TYR A 139 8.392 -3.419 21.075 1.00 0.00 C ATOM 2124 CD2 TYR A 139 7.160 -3.585 23.155 1.00 0.00 C ATOM 2125 CE1 TYR A 139 7.800 -4.598 20.623 1.00 0.00 C ATOM 2126 CE2 TYR A 139 6.567 -4.771 22.707 1.00 0.00 C ATOM 2127 CZ TYR A 139 6.886 -5.278 21.438 1.00 0.00 C ATOM 2128 OH TYR A 139 6.298 -6.445 20.995 1.00 0.00 O ATOM 0 H TYR A 139 7.481 -2.082 20.699 1.00 0.00 H new ATOM 0 HA TYR A 139 8.480 0.392 21.993 1.00 0.00 H new ATOM 0 HB2 TYR A 139 9.705 -1.805 23.161 1.00 0.00 H new ATOM 0 HB3 TYR A 139 8.124 -1.220 23.641 1.00 0.00 H new ATOM 0 HD1 TYR A 139 9.099 -2.896 20.448 1.00 0.00 H new ATOM 0 HD2 TYR A 139 6.913 -3.190 24.129 1.00 0.00 H new ATOM 0 HE1 TYR A 139 8.046 -4.986 19.646 1.00 0.00 H new ATOM 0 HE2 TYR A 139 5.864 -5.296 23.338 1.00 0.00 H new ATOM 0 HH TYR A 139 6.473 -6.556 20.037 1.00 0.00 H new ATOM 2138 N SER A 140 10.594 0.580 20.747 1.00 0.00 N ATOM 2139 CA SER A 140 11.942 0.708 20.123 1.00 0.00 C ATOM 2140 C SER A 140 12.925 -0.273 20.769 1.00 0.00 C ATOM 2141 O SER A 140 13.043 -1.408 20.356 1.00 0.00 O ATOM 2142 CB SER A 140 12.367 2.151 20.394 1.00 0.00 C ATOM 2143 OG SER A 140 12.309 2.402 21.791 1.00 0.00 O ATOM 0 H SER A 140 10.121 1.464 20.936 1.00 0.00 H new ATOM 0 HA SER A 140 11.926 0.480 19.057 1.00 0.00 H new ATOM 0 HB2 SER A 140 13.378 2.320 20.024 1.00 0.00 H new ATOM 0 HB3 SER A 140 11.713 2.841 19.861 1.00 0.00 H new ATOM 0 HG SER A 140 12.582 3.326 21.969 1.00 0.00 H new ATOM 2149 N GLY A 141 13.632 0.157 21.778 1.00 0.00 N ATOM 2150 CA GLY A 141 14.607 -0.753 22.444 1.00 0.00 C ATOM 2151 C GLY A 141 14.335 -0.786 23.948 1.00 0.00 C ATOM 2152 O GLY A 141 15.000 -0.127 24.724 1.00 0.00 O ATOM 0 H GLY A 141 13.577 1.097 22.170 1.00 0.00 H new ATOM 0 HA2 GLY A 141 14.525 -1.757 22.028 1.00 0.00 H new ATOM 0 HA3 GLY A 141 15.625 -0.412 22.256 1.00 0.00 H new ATOM 2156 N GLY A 142 13.365 -1.549 24.370 1.00 0.00 N ATOM 2157 CA GLY A 142 13.054 -1.625 25.824 1.00 0.00 C ATOM 2158 C GLY A 142 12.042 -0.539 26.193 1.00 0.00 C ATOM 2159 O GLY A 142 11.542 -0.496 27.299 1.00 0.00 O ATOM 0 H GLY A 142 12.774 -2.124 23.769 1.00 0.00 H new ATOM 0 HA2 GLY A 142 12.652 -2.608 26.069 1.00 0.00 H new ATOM 0 HA3 GLY A 142 13.966 -1.499 26.408 1.00 0.00 H new ATOM 2163 N GLU A 143 11.735 0.339 25.278 1.00 0.00 N ATOM 2164 CA GLU A 143 10.753 1.418 25.586 1.00 0.00 C ATOM 2165 C GLU A 143 9.489 1.242 24.741 1.00 0.00 C ATOM 2166 O GLU A 143 9.537 1.232 23.527 1.00 0.00 O ATOM 2167 CB GLU A 143 11.469 2.719 25.219 1.00 0.00 C ATOM 2168 CG GLU A 143 10.534 3.904 25.469 1.00 0.00 C ATOM 2169 CD GLU A 143 11.006 5.108 24.651 1.00 0.00 C ATOM 2170 OE1 GLU A 143 11.983 4.965 23.934 1.00 0.00 O ATOM 2171 OE2 GLU A 143 10.383 6.151 24.755 1.00 0.00 O ATOM 0 H GLU A 143 12.120 0.357 24.334 1.00 0.00 H new ATOM 0 HA GLU A 143 10.439 1.406 26.630 1.00 0.00 H new ATOM 0 HB2 GLU A 143 12.377 2.827 25.813 1.00 0.00 H new ATOM 0 HB3 GLU A 143 11.773 2.696 24.173 1.00 0.00 H new ATOM 0 HG2 GLU A 143 9.513 3.640 25.192 1.00 0.00 H new ATOM 0 HG3 GLU A 143 10.522 4.154 26.530 1.00 0.00 H new ATOM 2178 N LYS A 144 8.360 1.099 25.377 1.00 0.00 N ATOM 2179 CA LYS A 144 7.086 0.917 24.625 1.00 0.00 C ATOM 2180 C LYS A 144 6.595 2.247 24.051 1.00 0.00 C ATOM 2181 O LYS A 144 6.127 3.113 24.763 1.00 0.00 O ATOM 2182 CB LYS A 144 6.101 0.385 25.664 1.00 0.00 C ATOM 2183 CG LYS A 144 6.619 -0.942 26.224 1.00 0.00 C ATOM 2184 CD LYS A 144 5.621 -1.491 27.244 1.00 0.00 C ATOM 2185 CE LYS A 144 6.028 -1.040 28.649 1.00 0.00 C ATOM 2186 NZ LYS A 144 7.429 -1.520 28.815 1.00 0.00 N ATOM 0 H LYS A 144 8.264 1.100 26.392 1.00 0.00 H new ATOM 0 HA LYS A 144 7.203 0.243 23.777 1.00 0.00 H new ATOM 0 HB2 LYS A 144 5.979 1.109 26.469 1.00 0.00 H new ATOM 0 HB3 LYS A 144 5.120 0.243 25.211 1.00 0.00 H new ATOM 0 HG2 LYS A 144 6.760 -1.659 25.416 1.00 0.00 H new ATOM 0 HG3 LYS A 144 7.592 -0.795 26.694 1.00 0.00 H new ATOM 0 HD2 LYS A 144 4.616 -1.136 27.013 1.00 0.00 H new ATOM 0 HD3 LYS A 144 5.594 -2.579 27.193 1.00 0.00 H new ATOM 0 HE2 LYS A 144 5.967 0.044 28.749 1.00 0.00 H new ATOM 0 HE3 LYS A 144 5.371 -1.468 29.407 1.00 0.00 H new ATOM 0 HZ1 LYS A 144 7.579 -1.819 29.800 1.00 0.00 H new ATOM 0 HZ2 LYS A 144 7.598 -2.325 28.179 1.00 0.00 H new ATOM 0 HZ3 LYS A 144 8.089 -0.751 28.582 1.00 0.00 H new ATOM 2200 N ILE A 145 6.687 2.400 22.761 1.00 0.00 N ATOM 2201 CA ILE A 145 6.215 3.654 22.112 1.00 0.00 C ATOM 2202 C ILE A 145 4.877 3.380 21.418 1.00 0.00 C ATOM 2203 O ILE A 145 4.741 2.396 20.727 1.00 0.00 O ATOM 2204 CB ILE A 145 7.306 3.990 21.095 1.00 0.00 C ATOM 2205 CG1 ILE A 145 8.412 4.792 21.784 1.00 0.00 C ATOM 2206 CG2 ILE A 145 6.713 4.812 19.956 1.00 0.00 C ATOM 2207 CD1 ILE A 145 9.554 3.850 22.165 1.00 0.00 C ATOM 0 H ILE A 145 7.072 1.704 22.123 1.00 0.00 H new ATOM 0 HA ILE A 145 6.054 4.475 22.811 1.00 0.00 H new ATOM 0 HB ILE A 145 7.722 3.067 20.692 1.00 0.00 H new ATOM 0 HG12 ILE A 145 8.777 5.575 21.120 1.00 0.00 H new ATOM 0 HG13 ILE A 145 8.020 5.285 22.673 1.00 0.00 H new ATOM 0 HG21 ILE A 145 7.494 5.049 19.234 1.00 0.00 H new ATOM 0 HG22 ILE A 145 5.926 4.239 19.465 1.00 0.00 H new ATOM 0 HG23 ILE A 145 6.294 5.736 20.354 1.00 0.00 H new ATOM 0 HD11 ILE A 145 10.345 4.417 22.656 1.00 0.00 H new ATOM 0 HD12 ILE A 145 9.182 3.083 22.844 1.00 0.00 H new ATOM 0 HD13 ILE A 145 9.951 3.377 21.267 1.00 0.00 H new ATOM 2219 N PRO A 146 3.926 4.249 21.641 1.00 0.00 N ATOM 2220 CA PRO A 146 2.576 4.067 21.041 1.00 0.00 C ATOM 2221 C PRO A 146 2.578 4.319 19.525 1.00 0.00 C ATOM 2222 O PRO A 146 3.010 5.353 19.057 1.00 0.00 O ATOM 2223 CB PRO A 146 1.731 5.119 21.756 1.00 0.00 C ATOM 2224 CG PRO A 146 2.705 6.164 22.199 1.00 0.00 C ATOM 2225 CD PRO A 146 4.014 5.464 22.456 1.00 0.00 C ATOM 0 HA PRO A 146 2.205 3.049 21.161 1.00 0.00 H new ATOM 0 HB2 PRO A 146 0.978 5.539 21.090 1.00 0.00 H new ATOM 0 HB3 PRO A 146 1.201 4.688 22.606 1.00 0.00 H new ATOM 0 HG2 PRO A 146 2.822 6.932 21.434 1.00 0.00 H new ATOM 0 HG3 PRO A 146 2.351 6.664 23.101 1.00 0.00 H new ATOM 0 HD2 PRO A 146 4.863 6.082 22.163 1.00 0.00 H new ATOM 0 HD3 PRO A 146 4.141 5.229 23.513 1.00 0.00 H new ATOM 2233 N LEU A 147 2.057 3.387 18.759 1.00 0.00 N ATOM 2234 CA LEU A 147 1.982 3.574 17.276 1.00 0.00 C ATOM 2235 C LEU A 147 0.528 3.423 16.840 1.00 0.00 C ATOM 2236 O LEU A 147 0.015 2.328 16.739 1.00 0.00 O ATOM 2237 CB LEU A 147 2.825 2.457 16.653 1.00 0.00 C ATOM 2238 CG LEU A 147 4.307 2.808 16.741 1.00 0.00 C ATOM 2239 CD1 LEU A 147 4.668 3.116 18.189 1.00 0.00 C ATOM 2240 CD2 LEU A 147 5.139 1.623 16.254 1.00 0.00 C ATOM 0 H LEU A 147 1.680 2.503 19.100 1.00 0.00 H new ATOM 0 HA LEU A 147 2.345 4.555 16.969 1.00 0.00 H new ATOM 0 HB2 LEU A 147 2.635 1.516 17.169 1.00 0.00 H new ATOM 0 HB3 LEU A 147 2.539 2.312 15.611 1.00 0.00 H new ATOM 0 HG LEU A 147 4.513 3.679 16.119 1.00 0.00 H new ATOM 0 HD11 LEU A 147 5.727 3.367 18.255 1.00 0.00 H new ATOM 0 HD12 LEU A 147 4.073 3.958 18.541 1.00 0.00 H new ATOM 0 HD13 LEU A 147 4.463 2.243 18.809 1.00 0.00 H new ATOM 0 HD21 LEU A 147 6.198 1.872 16.316 1.00 0.00 H new ATOM 0 HD22 LEU A 147 4.934 0.753 16.878 1.00 0.00 H new ATOM 0 HD23 LEU A 147 4.880 1.397 15.220 1.00 0.00 H new ATOM 2252 N VAL A 148 -0.150 4.500 16.596 1.00 0.00 N ATOM 2253 CA VAL A 148 -1.579 4.376 16.193 1.00 0.00 C ATOM 2254 C VAL A 148 -1.737 4.482 14.676 1.00 0.00 C ATOM 2255 O VAL A 148 -1.444 5.498 14.077 1.00 0.00 O ATOM 2256 CB VAL A 148 -2.284 5.544 16.882 1.00 0.00 C ATOM 2257 CG1 VAL A 148 -3.799 5.379 16.746 1.00 0.00 C ATOM 2258 CG2 VAL A 148 -1.906 5.561 18.366 1.00 0.00 C ATOM 0 H VAL A 148 0.212 5.452 16.655 1.00 0.00 H new ATOM 0 HA VAL A 148 -1.995 3.410 16.479 1.00 0.00 H new ATOM 0 HB VAL A 148 -1.977 6.480 16.415 1.00 0.00 H new ATOM 0 HG11 VAL A 148 -4.301 6.212 17.238 1.00 0.00 H new ATOM 0 HG12 VAL A 148 -4.070 5.364 15.690 1.00 0.00 H new ATOM 0 HG13 VAL A 148 -4.106 4.443 17.213 1.00 0.00 H new ATOM 0 HG21 VAL A 148 -2.408 6.393 18.860 1.00 0.00 H new ATOM 0 HG22 VAL A 148 -2.214 4.624 18.831 1.00 0.00 H new ATOM 0 HG23 VAL A 148 -0.827 5.677 18.465 1.00 0.00 H new ATOM 2268 N LEU A 149 -2.223 3.442 14.052 1.00 0.00 N ATOM 2269 CA LEU A 149 -2.428 3.487 12.575 1.00 0.00 C ATOM 2270 C LEU A 149 -3.726 4.241 12.267 1.00 0.00 C ATOM 2271 O LEU A 149 -4.803 3.805 12.620 1.00 0.00 O ATOM 2272 CB LEU A 149 -2.543 2.025 12.144 1.00 0.00 C ATOM 2273 CG LEU A 149 -1.146 1.415 12.014 1.00 0.00 C ATOM 2274 CD1 LEU A 149 -0.554 1.191 13.406 1.00 0.00 C ATOM 2275 CD2 LEU A 149 -1.243 0.075 11.282 1.00 0.00 C ATOM 0 H LEU A 149 -2.486 2.565 14.501 1.00 0.00 H new ATOM 0 HA LEU A 149 -1.619 3.997 12.052 1.00 0.00 H new ATOM 0 HB2 LEU A 149 -3.128 1.466 12.874 1.00 0.00 H new ATOM 0 HB3 LEU A 149 -3.070 1.957 11.193 1.00 0.00 H new ATOM 0 HG LEU A 149 -0.505 2.094 11.452 1.00 0.00 H new ATOM 0 HD11 LEU A 149 0.441 0.756 13.312 1.00 0.00 H new ATOM 0 HD12 LEU A 149 -0.486 2.144 13.930 1.00 0.00 H new ATOM 0 HD13 LEU A 149 -1.195 0.512 13.969 1.00 0.00 H new ATOM 0 HD21 LEU A 149 -0.249 -0.361 11.188 1.00 0.00 H new ATOM 0 HD22 LEU A 149 -1.885 -0.602 11.846 1.00 0.00 H new ATOM 0 HD23 LEU A 149 -1.665 0.232 10.289 1.00 0.00 H new ATOM 2287 N SER A 150 -3.636 5.374 11.623 1.00 0.00 N ATOM 2288 CA SER A 150 -4.875 6.147 11.314 1.00 0.00 C ATOM 2289 C SER A 150 -4.928 6.526 9.831 1.00 0.00 C ATOM 2290 O SER A 150 -5.985 6.763 9.281 1.00 0.00 O ATOM 2291 CB SER A 150 -4.780 7.402 12.181 1.00 0.00 C ATOM 2292 OG SER A 150 -5.199 8.529 11.423 1.00 0.00 O ATOM 0 H SER A 150 -2.765 5.796 11.299 1.00 0.00 H new ATOM 0 HA SER A 150 -5.776 5.568 11.518 1.00 0.00 H new ATOM 0 HB2 SER A 150 -5.404 7.293 13.068 1.00 0.00 H new ATOM 0 HB3 SER A 150 -3.756 7.542 12.527 1.00 0.00 H new ATOM 0 HG SER A 150 -5.141 9.336 11.977 1.00 0.00 H new ATOM 2298 N ARG A 151 -3.800 6.591 9.178 1.00 0.00 N ATOM 2299 CA ARG A 151 -3.804 6.962 7.733 1.00 0.00 C ATOM 2300 C ARG A 151 -4.033 5.720 6.867 1.00 0.00 C ATOM 2301 O ARG A 151 -3.313 4.746 6.974 1.00 0.00 O ATOM 2302 CB ARG A 151 -2.417 7.551 7.472 1.00 0.00 C ATOM 2303 CG ARG A 151 -2.249 8.838 8.281 1.00 0.00 C ATOM 2304 CD ARG A 151 -2.007 10.012 7.329 1.00 0.00 C ATOM 2305 NE ARG A 151 -3.051 11.013 7.682 1.00 0.00 N ATOM 2306 CZ ARG A 151 -3.031 12.199 7.135 1.00 0.00 C ATOM 2307 NH1 ARG A 151 -2.095 12.508 6.279 1.00 0.00 N ATOM 2308 NH2 ARG A 151 -3.946 13.076 7.446 1.00 0.00 N ATOM 0 H ARG A 151 -2.881 6.405 9.579 1.00 0.00 H new ATOM 0 HA ARG A 151 -4.599 7.667 7.490 1.00 0.00 H new ATOM 0 HB2 ARG A 151 -1.647 6.831 7.749 1.00 0.00 H new ATOM 0 HB3 ARG A 151 -2.292 7.758 6.409 1.00 0.00 H new ATOM 0 HG2 ARG A 151 -3.140 9.021 8.882 1.00 0.00 H new ATOM 0 HG3 ARG A 151 -1.413 8.739 8.973 1.00 0.00 H new ATOM 0 HD2 ARG A 151 -1.006 10.424 7.456 1.00 0.00 H new ATOM 0 HD3 ARG A 151 -2.094 9.701 6.288 1.00 0.00 H new ATOM 0 HE ARG A 151 -3.782 10.773 8.351 1.00 0.00 H new ATOM 0 HH11 ARG A 151 -1.379 11.823 6.037 1.00 0.00 H new ATOM 0 HH12 ARG A 151 -2.080 13.434 5.852 1.00 0.00 H new ATOM 0 HH21 ARG A 151 -4.676 12.835 8.116 1.00 0.00 H new ATOM 0 HH22 ARG A 151 -3.931 14.002 7.019 1.00 0.00 H new ATOM 2322 N PRO A 152 -5.037 5.799 6.037 1.00 0.00 N ATOM 2323 CA PRO A 152 -5.377 4.669 5.140 1.00 0.00 C ATOM 2324 C PRO A 152 -4.372 4.575 3.988 1.00 0.00 C ATOM 2325 O PRO A 152 -4.110 5.542 3.301 1.00 0.00 O ATOM 2326 CB PRO A 152 -6.764 5.033 4.618 1.00 0.00 C ATOM 2327 CG PRO A 152 -6.844 6.522 4.726 1.00 0.00 C ATOM 2328 CD PRO A 152 -5.943 6.939 5.861 1.00 0.00 C ATOM 0 HA PRO A 152 -5.353 3.702 5.643 1.00 0.00 H new ATOM 0 HB2 PRO A 152 -6.895 4.705 3.587 1.00 0.00 H new ATOM 0 HB3 PRO A 152 -7.545 4.553 5.207 1.00 0.00 H new ATOM 0 HG2 PRO A 152 -6.530 6.992 3.794 1.00 0.00 H new ATOM 0 HG3 PRO A 152 -7.870 6.839 4.914 1.00 0.00 H new ATOM 0 HD2 PRO A 152 -5.395 7.850 5.621 1.00 0.00 H new ATOM 0 HD3 PRO A 152 -6.512 7.139 6.769 1.00 0.00 H new ATOM 2336 N LEU A 153 -3.808 3.418 3.773 1.00 0.00 N ATOM 2337 CA LEU A 153 -2.821 3.263 2.665 1.00 0.00 C ATOM 2338 C LEU A 153 -3.481 3.552 1.314 1.00 0.00 C ATOM 2339 O LEU A 153 -4.686 3.481 1.169 1.00 0.00 O ATOM 2340 CB LEU A 153 -2.337 1.807 2.750 1.00 0.00 C ATOM 2341 CG LEU A 153 -3.395 0.841 2.193 1.00 0.00 C ATOM 2342 CD1 LEU A 153 -4.769 1.157 2.788 1.00 0.00 C ATOM 2343 CD2 LEU A 153 -3.454 0.963 0.667 1.00 0.00 C ATOM 0 H LEU A 153 -3.987 2.573 4.316 1.00 0.00 H new ATOM 0 HA LEU A 153 -1.990 3.963 2.755 1.00 0.00 H new ATOM 0 HB2 LEU A 153 -1.408 1.696 2.191 1.00 0.00 H new ATOM 0 HB3 LEU A 153 -2.118 1.553 3.787 1.00 0.00 H new ATOM 0 HG LEU A 153 -3.119 -0.178 2.466 1.00 0.00 H new ATOM 0 HD11 LEU A 153 -5.508 0.465 2.384 1.00 0.00 H new ATOM 0 HD12 LEU A 153 -4.729 1.053 3.872 1.00 0.00 H new ATOM 0 HD13 LEU A 153 -5.050 2.178 2.532 1.00 0.00 H new ATOM 0 HD21 LEU A 153 -4.205 0.277 0.276 1.00 0.00 H new ATOM 0 HD22 LEU A 153 -3.718 1.984 0.394 1.00 0.00 H new ATOM 0 HD23 LEU A 153 -2.480 0.715 0.244 1.00 0.00 H new ATOM 2355 N SER A 154 -2.701 3.885 0.322 1.00 0.00 N ATOM 2356 CA SER A 154 -3.286 4.181 -1.018 1.00 0.00 C ATOM 2357 C SER A 154 -2.860 3.114 -2.030 1.00 0.00 C ATOM 2358 O SER A 154 -1.924 3.296 -2.783 1.00 0.00 O ATOM 2359 CB SER A 154 -2.714 5.544 -1.405 1.00 0.00 C ATOM 2360 OG SER A 154 -3.214 5.917 -2.682 1.00 0.00 O ATOM 0 H SER A 154 -1.686 3.965 0.380 1.00 0.00 H new ATOM 0 HA SER A 154 -4.376 4.184 -1.001 1.00 0.00 H new ATOM 0 HB2 SER A 154 -2.990 6.292 -0.661 1.00 0.00 H new ATOM 0 HB3 SER A 154 -1.625 5.502 -1.426 1.00 0.00 H new ATOM 0 HG SER A 154 -2.850 6.792 -2.933 1.00 0.00 H new ATOM 2510 N SER B 165 8.747 -8.186 15.225 1.00 0.00 N ATOM 2511 CA SER B 165 8.495 -8.245 16.693 1.00 0.00 C ATOM 2512 C SER B 165 6.989 -8.317 16.970 1.00 0.00 C ATOM 2513 O SER B 165 6.269 -9.065 16.340 1.00 0.00 O ATOM 2514 CB SER B 165 9.082 -6.947 17.246 1.00 0.00 C ATOM 2515 OG SER B 165 9.385 -7.117 18.623 1.00 0.00 O ATOM 0 HA SER B 165 8.943 -9.125 17.155 1.00 0.00 H new ATOM 0 HB2 SER B 165 9.983 -6.678 16.694 1.00 0.00 H new ATOM 0 HB3 SER B 165 8.373 -6.130 17.116 1.00 0.00 H new ATOM 0 HG SER B 165 9.763 -6.286 18.980 1.00 0.00 H new ATOM 2521 N THR B 166 6.508 -7.547 17.909 1.00 0.00 N ATOM 2522 CA THR B 166 5.049 -7.576 18.223 1.00 0.00 C ATOM 2523 C THR B 166 4.566 -6.177 18.617 1.00 0.00 C ATOM 2524 O THR B 166 5.296 -5.398 19.198 1.00 0.00 O ATOM 2525 CB THR B 166 4.919 -8.539 19.403 1.00 0.00 C ATOM 2526 OG1 THR B 166 5.231 -9.856 18.972 1.00 0.00 O ATOM 2527 CG2 THR B 166 3.487 -8.502 19.939 1.00 0.00 C ATOM 0 H THR B 166 7.061 -6.900 18.472 1.00 0.00 H new ATOM 0 HA THR B 166 4.448 -7.891 17.370 1.00 0.00 H new ATOM 0 HB THR B 166 5.608 -8.241 20.194 1.00 0.00 H new ATOM 0 HG1 THR B 166 5.150 -10.475 19.727 1.00 0.00 H new ATOM 0 HG21 THR B 166 3.396 -9.189 20.780 1.00 0.00 H new ATOM 0 HG22 THR B 166 3.248 -7.491 20.269 1.00 0.00 H new ATOM 0 HG23 THR B 166 2.796 -8.800 19.151 1.00 0.00 H new ATOM 2535 N VAL B 167 3.340 -5.852 18.307 1.00 0.00 N ATOM 2536 CA VAL B 167 2.814 -4.503 18.668 1.00 0.00 C ATOM 2537 C VAL B 167 2.227 -4.541 20.083 1.00 0.00 C ATOM 2538 O VAL B 167 1.136 -5.032 20.298 1.00 0.00 O ATOM 2539 CB VAL B 167 1.722 -4.204 17.634 1.00 0.00 C ATOM 2540 CG1 VAL B 167 1.576 -2.690 17.456 1.00 0.00 C ATOM 2541 CG2 VAL B 167 2.101 -4.828 16.292 1.00 0.00 C ATOM 0 H VAL B 167 2.681 -6.460 17.821 1.00 0.00 H new ATOM 0 HA VAL B 167 3.589 -3.737 18.661 1.00 0.00 H new ATOM 0 HB VAL B 167 0.779 -4.624 17.983 1.00 0.00 H new ATOM 0 HG11 VAL B 167 0.799 -2.483 16.720 1.00 0.00 H new ATOM 0 HG12 VAL B 167 1.303 -2.236 18.409 1.00 0.00 H new ATOM 0 HG13 VAL B 167 2.522 -2.271 17.112 1.00 0.00 H new ATOM 0 HG21 VAL B 167 1.323 -4.614 15.559 1.00 0.00 H new ATOM 0 HG22 VAL B 167 3.047 -4.409 15.950 1.00 0.00 H new ATOM 0 HG23 VAL B 167 2.203 -5.907 16.408 1.00 0.00 H new ATOM 2551 N VAL B 168 2.948 -4.035 21.048 1.00 0.00 N ATOM 2552 CA VAL B 168 2.443 -4.047 22.454 1.00 0.00 C ATOM 2553 C VAL B 168 2.495 -5.467 23.023 1.00 0.00 C ATOM 2554 O VAL B 168 1.884 -6.378 22.500 1.00 0.00 O ATOM 2555 CB VAL B 168 0.996 -3.557 22.374 1.00 0.00 C ATOM 2556 CG1 VAL B 168 0.552 -3.048 23.746 1.00 0.00 C ATOM 2557 CG2 VAL B 168 0.900 -2.420 21.356 1.00 0.00 C ATOM 0 H VAL B 168 3.868 -3.612 20.924 1.00 0.00 H new ATOM 0 HA VAL B 168 3.046 -3.417 23.108 1.00 0.00 H new ATOM 0 HB VAL B 168 0.351 -4.380 22.065 1.00 0.00 H new ATOM 0 HG11 VAL B 168 -0.479 -2.699 23.688 1.00 0.00 H new ATOM 0 HG12 VAL B 168 0.621 -3.856 24.474 1.00 0.00 H new ATOM 0 HG13 VAL B 168 1.197 -2.225 24.055 1.00 0.00 H new ATOM 0 HG21 VAL B 168 -0.131 -2.070 21.298 1.00 0.00 H new ATOM 0 HG22 VAL B 168 1.546 -1.598 21.666 1.00 0.00 H new ATOM 0 HG23 VAL B 168 1.217 -2.780 20.377 1.00 0.00 H new