USER MOD reduce.3.24.130724 H: found=0, std=0, add=1065, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1067 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 83 SER OG : rot -161:sc= 0.565 USER MOD Set 1.2: A 96 TYR OH : rot -150:sc= 1.3 USER MOD Set 1.3: A 119 TYR OH : rot 110:sc= 1.03 USER MOD Set 2.1: A 116 LYS NZ :NH3+ 155:sc= 0.529 (180deg=-0.332) USER MOD Set 2.2: A 131 SER OG : rot 12:sc= 0.594 USER MOD Set 3.1: A 8 GLN : amide:sc= 0.0698 K(o=0.83,f=-0.15) USER MOD Set 3.2: A 57 ASN : amide:sc= 0.76 K(o=0.83,f=-0.15) USER MOD Set 4.1: A 40 TYR OH : rot 78:sc= 0.0293 USER MOD Set 4.2: A 110 THR OG1 : rot 71:sc= 0.729 USER MOD Single : A 13 LYS NZ :NH3+ 178:sc= 0.965 (180deg=0.951) USER MOD Single : A 14 GLN :FLIP amide:sc= -0.173 F(o=-3.1!,f=-0.17) USER MOD Single : A 18 LYS NZ :NH3+ -104:sc= 1.19 (180deg=-0.354) USER MOD Single : A 21 ASN : amide:sc= -0.0152 X(o=-0.015,f=0) USER MOD Single : A 24 ASN : amide:sc= -0.481 K(o=-0.48,f=-3.8!) USER MOD Single : A 25 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 GLN : amide:sc= -0.846 K(o=-0.85,f=-5.3!) USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 HIS : no HD1:sc= 0.113 K(o=0.11,f=-3.3!) USER MOD Single : A 36 ASN : amide:sc= -1.25 K(o=-1.2,f=-4.7!) USER MOD Single : A 38 SER OG : rot 107:sc= 1.25 USER MOD Single : A 39 HIS : no HD1:sc= -0.112 K(o=-0.11,f=-1.6) USER MOD Single : A 42 TYR OH : rot 51:sc= 2.19 USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 THR OG1 : rot 87:sc= 0.0169 USER MOD Single : A 48 ASN : amide:sc= -0.253 K(o=-0.25,f=-1.3!) USER MOD Single : A 50 HIS : no HD1:sc=-0.00723 X(o=-0.0072,f=-0.0039) USER MOD Single : A 54 LYS NZ :NH3+ -113:sc= -0.546 (180deg=-1.73!) USER MOD Single : A 55 ASN :FLIP amide:sc= -0.0208 F(o=-1.5,f=-0.021) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 SER OG : rot -30:sc= 0.48 USER MOD Single : A 71 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.103) USER MOD Single : A 73 SER OG : rot 141:sc= 0.0426 USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 HIS : no HE2:sc= 1.11 K(o=1.1,f=-3.9!) USER MOD Single : A 81 THR OG1 : rot 78:sc= 0.711 USER MOD Single : A 82 THR OG1 : rot 99:sc= 1.19 USER MOD Single : A 84 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 85 LYS NZ :NH3+ -168:sc= 1.22 (180deg=1.13) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 92 THR OG1 : rot 180:sc= -0.343 USER MOD Single : A 94 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 99 ASN : amide:sc= 1.88 K(o=1.9,f=-0.2) USER MOD Single : A 102 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0246) USER MOD Single : A 111 ASN : amide:sc= -0.12 K(o=-0.12,f=-5!) USER MOD Single : A 113 HIS : no HE2:sc= 0.924 K(o=0.92,f=-6.3!) USER MOD Single : A 115 GLN : amide:sc= -0.301 K(o=-0.3,f=-0.85) USER MOD Single : A 118 TYR OH : rot 180:sc= 0 USER MOD Single : A 120 TYR OH : rot 180:sc= 0 USER MOD Single : A 121 THR OG1 : rot 56:sc= 0.265 USER MOD Single : A 124 ASN :FLIP amide:sc= -0.645 F(o=-2,f=-0.64) USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 129 THR OG1 : rot 140:sc= -1.08 USER MOD Single : A 133 GLN :FLIP amide:sc= -0.143 F(o=-1.9!,f=-0.14) USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 7 -4.986 14.336 -15.764 1.00 0.00 N ATOM 2 CA ASP A 7 -5.580 13.032 -15.472 1.00 0.00 C ATOM 3 C ASP A 7 -5.499 12.737 -13.982 1.00 0.00 C ATOM 4 O ASP A 7 -4.438 12.869 -13.374 1.00 0.00 O ATOM 5 CB ASP A 7 -4.897 11.914 -16.267 1.00 0.00 C ATOM 6 CG ASP A 7 -5.491 11.741 -17.650 1.00 0.00 C ATOM 7 OD1 ASP A 7 -6.543 11.082 -17.769 1.00 0.00 O ATOM 8 OD2 ASP A 7 -4.915 12.272 -18.621 1.00 0.00 O ATOM 0 HA ASP A 7 -6.627 13.069 -15.774 1.00 0.00 H new ATOM 0 HB2 ASP A 7 -3.833 12.134 -16.357 1.00 0.00 H new ATOM 0 HB3 ASP A 7 -4.984 10.977 -15.718 1.00 0.00 H new ATOM 13 N GLN A 8 -6.631 12.345 -13.401 1.00 0.00 N ATOM 14 CA GLN A 8 -6.724 12.089 -11.963 1.00 0.00 C ATOM 15 C GLN A 8 -5.710 11.026 -11.544 1.00 0.00 C ATOM 16 O GLN A 8 -5.171 11.060 -10.434 1.00 0.00 O ATOM 17 CB GLN A 8 -8.147 11.640 -11.613 1.00 0.00 C ATOM 18 CG GLN A 8 -8.478 11.721 -10.130 1.00 0.00 C ATOM 19 CD GLN A 8 -9.884 11.238 -9.820 1.00 0.00 C ATOM 20 OE1 GLN A 8 -10.410 10.347 -10.484 1.00 0.00 O ATOM 21 NE2 GLN A 8 -10.505 11.824 -8.806 1.00 0.00 N ATOM 0 H GLN A 8 -7.504 12.196 -13.908 1.00 0.00 H new ATOM 0 HA GLN A 8 -6.497 13.007 -11.422 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -8.857 12.255 -12.167 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -8.285 10.612 -11.949 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -7.760 11.124 -9.568 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -8.369 12.752 -9.793 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -10.036 12.560 -8.278 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -11.451 11.539 -8.554 1.00 0.00 H new ATOM 30 N VAL A 9 -5.440 10.102 -12.461 1.00 0.00 N ATOM 31 CA VAL A 9 -4.470 9.039 -12.235 1.00 0.00 C ATOM 32 C VAL A 9 -3.083 9.610 -11.948 1.00 0.00 C ATOM 33 O VAL A 9 -2.387 9.148 -11.046 1.00 0.00 O ATOM 34 CB VAL A 9 -4.389 8.097 -13.458 1.00 0.00 C ATOM 35 CG1 VAL A 9 -3.389 6.971 -13.224 1.00 0.00 C ATOM 36 CG2 VAL A 9 -5.759 7.530 -13.787 1.00 0.00 C ATOM 0 H VAL A 9 -5.886 10.070 -13.378 1.00 0.00 H new ATOM 0 HA VAL A 9 -4.807 8.473 -11.367 1.00 0.00 H new ATOM 0 HB VAL A 9 -4.041 8.684 -14.308 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -3.355 6.326 -14.102 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -2.400 7.394 -13.046 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -3.695 6.387 -12.356 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -5.682 6.869 -14.651 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -6.135 6.967 -12.932 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -6.445 8.346 -14.015 1.00 0.00 H new ATOM 46 N VAL A 10 -2.705 10.632 -12.704 1.00 0.00 N ATOM 47 CA VAL A 10 -1.376 11.222 -12.592 1.00 0.00 C ATOM 48 C VAL A 10 -1.145 11.805 -11.201 1.00 0.00 C ATOM 49 O VAL A 10 -0.107 11.560 -10.590 1.00 0.00 O ATOM 50 CB VAL A 10 -1.160 12.325 -13.651 1.00 0.00 C ATOM 51 CG1 VAL A 10 0.215 12.961 -13.502 1.00 0.00 C ATOM 52 CG2 VAL A 10 -1.335 11.758 -15.050 1.00 0.00 C ATOM 0 H VAL A 10 -3.302 11.072 -13.404 1.00 0.00 H new ATOM 0 HA VAL A 10 -0.658 10.421 -12.765 1.00 0.00 H new ATOM 0 HB VAL A 10 -1.910 13.100 -13.493 1.00 0.00 H new ATOM 0 HG11 VAL A 10 0.342 13.734 -14.259 1.00 0.00 H new ATOM 0 HG12 VAL A 10 0.305 13.405 -12.511 1.00 0.00 H new ATOM 0 HG13 VAL A 10 0.984 12.199 -13.629 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -1.180 12.548 -15.785 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -0.608 10.962 -15.214 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -2.343 11.357 -15.156 1.00 0.00 H new ATOM 62 N ILE A 11 -2.125 12.551 -10.700 1.00 0.00 N ATOM 63 CA ILE A 11 -1.998 13.210 -9.404 1.00 0.00 C ATOM 64 C ILE A 11 -1.800 12.190 -8.284 1.00 0.00 C ATOM 65 O ILE A 11 -0.851 12.293 -7.504 1.00 0.00 O ATOM 66 CB ILE A 11 -3.224 14.110 -9.085 1.00 0.00 C ATOM 67 CG1 ILE A 11 -3.210 15.390 -9.938 1.00 0.00 C ATOM 68 CG2 ILE A 11 -3.267 14.472 -7.603 1.00 0.00 C ATOM 69 CD1 ILE A 11 -3.553 15.185 -11.401 1.00 0.00 C ATOM 0 H ILE A 11 -3.015 12.714 -11.171 1.00 0.00 H new ATOM 0 HA ILE A 11 -1.116 13.848 -9.464 1.00 0.00 H new ATOM 0 HB ILE A 11 -4.120 13.540 -9.331 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -3.916 16.102 -9.510 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -2.221 15.843 -9.872 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -4.135 15.102 -7.407 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -3.338 13.562 -7.008 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -2.359 15.011 -7.334 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -3.517 16.142 -11.921 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -2.834 14.501 -11.851 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -4.555 14.764 -11.484 1.00 0.00 H new ATOM 81 N PHE A 12 -2.674 11.196 -8.220 1.00 0.00 N ATOM 82 CA PHE A 12 -2.594 10.192 -7.165 1.00 0.00 C ATOM 83 C PHE A 12 -1.341 9.334 -7.313 1.00 0.00 C ATOM 84 O PHE A 12 -0.666 9.035 -6.323 1.00 0.00 O ATOM 85 CB PHE A 12 -3.847 9.318 -7.155 1.00 0.00 C ATOM 86 CG PHE A 12 -5.050 10.002 -6.565 1.00 0.00 C ATOM 87 CD1 PHE A 12 -5.866 10.806 -7.343 1.00 0.00 C ATOM 88 CD2 PHE A 12 -5.362 9.835 -5.227 1.00 0.00 C ATOM 89 CE1 PHE A 12 -6.972 11.430 -6.796 1.00 0.00 C ATOM 90 CE2 PHE A 12 -6.465 10.455 -4.673 1.00 0.00 C ATOM 91 CZ PHE A 12 -7.272 11.253 -5.458 1.00 0.00 C ATOM 0 H PHE A 12 -3.441 11.062 -8.879 1.00 0.00 H new ATOM 0 HA PHE A 12 -2.531 10.715 -6.211 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -4.076 9.013 -8.176 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -3.642 8.409 -6.590 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -5.636 10.947 -8.389 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -4.734 9.211 -4.608 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -7.601 12.055 -7.413 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -6.695 10.315 -3.627 1.00 0.00 H new ATOM 0 HZ PHE A 12 -8.136 11.738 -5.028 1.00 0.00 H new ATOM 101 N LYS A 13 -1.020 8.956 -8.546 1.00 0.00 N ATOM 102 CA LYS A 13 0.173 8.163 -8.804 1.00 0.00 C ATOM 103 C LYS A 13 1.421 8.936 -8.393 1.00 0.00 C ATOM 104 O LYS A 13 2.358 8.368 -7.839 1.00 0.00 O ATOM 105 CB LYS A 13 0.263 7.770 -10.281 1.00 0.00 C ATOM 106 CG LYS A 13 1.466 6.899 -10.601 1.00 0.00 C ATOM 107 CD LYS A 13 1.559 6.576 -12.084 1.00 0.00 C ATOM 108 CE LYS A 13 2.788 5.734 -12.388 1.00 0.00 C ATOM 109 NZ LYS A 13 4.054 6.482 -12.146 1.00 0.00 N ATOM 0 H LYS A 13 -1.566 9.185 -9.376 1.00 0.00 H new ATOM 0 HA LYS A 13 0.107 7.251 -8.210 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -0.646 7.239 -10.564 1.00 0.00 H new ATOM 0 HB3 LYS A 13 0.307 8.674 -10.888 1.00 0.00 H new ATOM 0 HG2 LYS A 13 2.376 7.408 -10.283 1.00 0.00 H new ATOM 0 HG3 LYS A 13 1.404 5.972 -10.031 1.00 0.00 H new ATOM 0 HD2 LYS A 13 0.662 6.042 -12.399 1.00 0.00 H new ATOM 0 HD3 LYS A 13 1.598 7.501 -12.659 1.00 0.00 H new ATOM 0 HE2 LYS A 13 2.774 4.836 -11.770 1.00 0.00 H new ATOM 0 HE3 LYS A 13 2.754 5.406 -13.427 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 4.866 5.860 -12.333 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 4.096 7.306 -12.778 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 4.084 6.802 -11.157 1.00 0.00 H new ATOM 123 N GLN A 14 1.406 10.245 -8.644 1.00 0.00 N ATOM 124 CA GLN A 14 2.532 11.114 -8.315 1.00 0.00 C ATOM 125 C GLN A 14 2.812 11.079 -6.815 1.00 0.00 C ATOM 126 O GLN A 14 3.967 11.140 -6.385 1.00 0.00 O ATOM 127 CB GLN A 14 2.244 12.552 -8.757 1.00 0.00 C ATOM 128 CG GLN A 14 3.495 13.400 -8.934 1.00 0.00 C ATOM 129 CD GLN A 14 4.183 13.171 -10.270 1.00 0.00 C ATOM 130 OE1 GLN A 14 4.000 11.994 -10.851 1.00 0.00 O flip ATOM 131 NE2 GLN A 14 4.858 14.060 -10.789 1.00 0.00 N flip ATOM 0 H GLN A 14 0.619 10.728 -9.078 1.00 0.00 H new ATOM 0 HA GLN A 14 3.412 10.751 -8.846 1.00 0.00 H new ATOM 0 HB2 GLN A 14 1.694 12.530 -9.698 1.00 0.00 H new ATOM 0 HB3 GLN A 14 1.596 13.026 -8.020 1.00 0.00 H new ATOM 0 HG2 GLN A 14 3.229 14.453 -8.844 1.00 0.00 H new ATOM 0 HG3 GLN A 14 4.195 13.178 -8.128 1.00 0.00 H new ATOM 0 HE21 GLN A 14 4.977 14.954 -10.312 1.00 0.00 H new ATOM 0 HE22 GLN A 14 5.298 13.903 -11.696 1.00 0.00 H new ATOM 140 N ILE A 15 1.747 10.979 -6.028 1.00 0.00 N ATOM 141 CA ILE A 15 1.865 10.871 -4.579 1.00 0.00 C ATOM 142 C ILE A 15 2.657 9.618 -4.212 1.00 0.00 C ATOM 143 O ILE A 15 3.569 9.666 -3.385 1.00 0.00 O ATOM 144 CB ILE A 15 0.473 10.823 -3.903 1.00 0.00 C ATOM 145 CG1 ILE A 15 -0.332 12.074 -4.265 1.00 0.00 C ATOM 146 CG2 ILE A 15 0.610 10.694 -2.389 1.00 0.00 C ATOM 147 CD1 ILE A 15 -1.756 12.058 -3.749 1.00 0.00 C ATOM 0 H ILE A 15 0.787 10.970 -6.372 1.00 0.00 H new ATOM 0 HA ILE A 15 2.390 11.756 -4.218 1.00 0.00 H new ATOM 0 HB ILE A 15 -0.059 9.945 -4.270 1.00 0.00 H new ATOM 0 HG12 ILE A 15 0.179 12.951 -3.866 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -0.350 12.181 -5.350 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -0.381 10.662 -1.935 1.00 0.00 H new ATOM 0 HG22 ILE A 15 1.149 9.777 -2.149 1.00 0.00 H new ATOM 0 HG23 ILE A 15 1.160 11.550 -1.999 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -2.261 12.977 -4.046 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -2.285 11.202 -4.168 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -1.748 11.983 -2.662 1.00 0.00 H new ATOM 159 N PHE A 16 2.319 8.504 -4.858 1.00 0.00 N ATOM 160 CA PHE A 16 3.003 7.239 -4.614 1.00 0.00 C ATOM 161 C PHE A 16 4.425 7.262 -5.180 1.00 0.00 C ATOM 162 O PHE A 16 5.347 6.722 -4.568 1.00 0.00 O ATOM 163 CB PHE A 16 2.208 6.070 -5.203 1.00 0.00 C ATOM 164 CG PHE A 16 0.936 5.773 -4.454 1.00 0.00 C ATOM 165 CD1 PHE A 16 0.936 4.892 -3.382 1.00 0.00 C ATOM 166 CD2 PHE A 16 -0.257 6.372 -4.820 1.00 0.00 C ATOM 167 CE1 PHE A 16 -0.230 4.617 -2.694 1.00 0.00 C ATOM 168 CE2 PHE A 16 -1.425 6.099 -4.136 1.00 0.00 C ATOM 169 CZ PHE A 16 -1.413 5.219 -3.071 1.00 0.00 C ATOM 0 H PHE A 16 1.575 8.453 -5.554 1.00 0.00 H new ATOM 0 HA PHE A 16 3.072 7.100 -3.535 1.00 0.00 H new ATOM 0 HB2 PHE A 16 1.965 6.293 -6.242 1.00 0.00 H new ATOM 0 HB3 PHE A 16 2.835 5.179 -5.206 1.00 0.00 H new ATOM 0 HD1 PHE A 16 1.858 4.416 -3.082 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -0.274 7.062 -5.651 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -0.216 3.930 -1.860 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -2.348 6.574 -4.434 1.00 0.00 H new ATOM 0 HZ PHE A 16 -2.326 5.003 -2.536 1.00 0.00 H new ATOM 179 N ASP A 17 4.600 7.896 -6.336 1.00 0.00 N ATOM 180 CA ASP A 17 5.922 8.028 -6.951 1.00 0.00 C ATOM 181 C ASP A 17 6.869 8.808 -6.050 1.00 0.00 C ATOM 182 O ASP A 17 8.052 8.485 -5.942 1.00 0.00 O ATOM 183 CB ASP A 17 5.844 8.717 -8.317 1.00 0.00 C ATOM 184 CG ASP A 17 5.451 7.778 -9.438 1.00 0.00 C ATOM 185 OD1 ASP A 17 6.220 6.835 -9.726 1.00 0.00 O ATOM 186 OD2 ASP A 17 4.389 7.988 -10.055 1.00 0.00 O ATOM 0 H ASP A 17 3.844 8.327 -6.868 1.00 0.00 H new ATOM 0 HA ASP A 17 6.306 7.018 -7.090 1.00 0.00 H new ATOM 0 HB2 ASP A 17 5.122 9.532 -8.265 1.00 0.00 H new ATOM 0 HB3 ASP A 17 6.812 9.163 -8.548 1.00 0.00 H new ATOM 191 N LYS A 18 6.345 9.838 -5.408 1.00 0.00 N ATOM 192 CA LYS A 18 7.134 10.639 -4.486 1.00 0.00 C ATOM 193 C LYS A 18 7.489 9.843 -3.233 1.00 0.00 C ATOM 194 O LYS A 18 8.658 9.734 -2.868 1.00 0.00 O ATOM 195 CB LYS A 18 6.372 11.913 -4.109 1.00 0.00 C ATOM 196 CG LYS A 18 7.007 12.715 -2.981 1.00 0.00 C ATOM 197 CD LYS A 18 6.263 14.021 -2.753 1.00 0.00 C ATOM 198 CE LYS A 18 6.673 14.698 -1.453 1.00 0.00 C ATOM 199 NZ LYS A 18 8.133 14.963 -1.380 1.00 0.00 N ATOM 0 H LYS A 18 5.376 10.140 -5.508 1.00 0.00 H new ATOM 0 HA LYS A 18 8.063 10.916 -4.984 1.00 0.00 H new ATOM 0 HB2 LYS A 18 6.293 12.549 -4.991 1.00 0.00 H new ATOM 0 HB3 LYS A 18 5.357 11.642 -3.819 1.00 0.00 H new ATOM 0 HG2 LYS A 18 7.003 12.125 -2.064 1.00 0.00 H new ATOM 0 HG3 LYS A 18 8.050 12.924 -3.221 1.00 0.00 H new ATOM 0 HD2 LYS A 18 6.453 14.696 -3.588 1.00 0.00 H new ATOM 0 HD3 LYS A 18 5.190 13.828 -2.737 1.00 0.00 H new ATOM 0 HE2 LYS A 18 6.132 15.639 -1.352 1.00 0.00 H new ATOM 0 HE3 LYS A 18 6.380 14.069 -0.612 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 8.580 14.270 -0.747 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 8.548 14.883 -2.330 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 8.294 15.922 -1.012 1.00 0.00 H new ATOM 213 N VAL A 19 6.480 9.261 -2.596 1.00 0.00 N ATOM 214 CA VAL A 19 6.663 8.628 -1.294 1.00 0.00 C ATOM 215 C VAL A 19 7.525 7.362 -1.373 1.00 0.00 C ATOM 216 O VAL A 19 8.136 6.971 -0.383 1.00 0.00 O ATOM 217 CB VAL A 19 5.308 8.294 -0.625 1.00 0.00 C ATOM 218 CG1 VAL A 19 4.595 7.163 -1.349 1.00 0.00 C ATOM 219 CG2 VAL A 19 5.503 7.958 0.848 1.00 0.00 C ATOM 0 H VAL A 19 5.528 9.214 -2.958 1.00 0.00 H new ATOM 0 HA VAL A 19 7.190 9.358 -0.680 1.00 0.00 H new ATOM 0 HB VAL A 19 4.676 9.179 -0.694 1.00 0.00 H new ATOM 0 HG11 VAL A 19 3.647 6.954 -0.853 1.00 0.00 H new ATOM 0 HG12 VAL A 19 4.407 7.454 -2.383 1.00 0.00 H new ATOM 0 HG13 VAL A 19 5.219 6.269 -1.331 1.00 0.00 H new ATOM 0 HG21 VAL A 19 4.538 7.726 1.299 1.00 0.00 H new ATOM 0 HG22 VAL A 19 6.163 7.096 0.940 1.00 0.00 H new ATOM 0 HG23 VAL A 19 5.947 8.811 1.360 1.00 0.00 H new ATOM 229 N ARG A 20 7.603 6.738 -2.546 1.00 0.00 N ATOM 230 CA ARG A 20 8.341 5.483 -2.673 1.00 0.00 C ATOM 231 C ARG A 20 9.848 5.693 -2.581 1.00 0.00 C ATOM 232 O ARG A 20 10.592 4.744 -2.323 1.00 0.00 O ATOM 233 CB ARG A 20 7.985 4.735 -3.967 1.00 0.00 C ATOM 234 CG ARG A 20 8.239 5.512 -5.247 1.00 0.00 C ATOM 235 CD ARG A 20 8.023 4.637 -6.474 1.00 0.00 C ATOM 236 NE ARG A 20 7.974 5.409 -7.718 1.00 0.00 N ATOM 237 CZ ARG A 20 8.977 5.505 -8.591 1.00 0.00 C ATOM 238 NH1 ARG A 20 10.148 4.928 -8.343 1.00 0.00 N ATOM 239 NH2 ARG A 20 8.797 6.180 -9.719 1.00 0.00 N ATOM 0 H ARG A 20 7.173 7.073 -3.408 1.00 0.00 H new ATOM 0 HA ARG A 20 8.035 4.864 -1.829 1.00 0.00 H new ATOM 0 HB2 ARG A 20 8.557 3.808 -4.003 1.00 0.00 H new ATOM 0 HB3 ARG A 20 6.931 4.458 -3.931 1.00 0.00 H new ATOM 0 HG2 ARG A 20 7.574 6.374 -5.290 1.00 0.00 H new ATOM 0 HG3 ARG A 20 9.259 5.896 -5.246 1.00 0.00 H new ATOM 0 HD2 ARG A 20 8.827 3.903 -6.538 1.00 0.00 H new ATOM 0 HD3 ARG A 20 7.092 4.081 -6.359 1.00 0.00 H new ATOM 0 HE ARG A 20 7.111 5.909 -7.932 1.00 0.00 H new ATOM 0 HH11 ARG A 20 10.286 4.405 -7.478 1.00 0.00 H new ATOM 0 HH12 ARG A 20 10.909 5.008 -9.018 1.00 0.00 H new ATOM 0 HH21 ARG A 20 7.897 6.620 -9.912 1.00 0.00 H new ATOM 0 HH22 ARG A 20 9.558 6.259 -10.393 1.00 0.00 H new ATOM 253 N ASN A 21 10.301 6.923 -2.786 1.00 0.00 N ATOM 254 CA ASN A 21 11.723 7.228 -2.659 1.00 0.00 C ATOM 255 C ASN A 21 11.958 8.286 -1.591 1.00 0.00 C ATOM 256 O ASN A 21 12.856 8.161 -0.762 1.00 0.00 O ATOM 257 CB ASN A 21 12.307 7.709 -3.991 1.00 0.00 C ATOM 258 CG ASN A 21 13.806 7.941 -3.912 1.00 0.00 C ATOM 259 OD1 ASN A 21 14.597 7.020 -4.114 1.00 0.00 O ATOM 260 ND2 ASN A 21 14.210 9.173 -3.647 1.00 0.00 N ATOM 0 H ASN A 21 9.714 7.718 -3.038 1.00 0.00 H new ATOM 0 HA ASN A 21 12.227 6.307 -2.366 1.00 0.00 H new ATOM 0 HB2 ASN A 21 12.096 6.971 -4.765 1.00 0.00 H new ATOM 0 HB3 ASN A 21 11.813 8.634 -4.289 1.00 0.00 H new ATOM 0 HD21 ASN A 21 15.207 9.385 -3.605 1.00 0.00 H new ATOM 0 HD22 ASN A 21 13.525 9.911 -3.485 1.00 0.00 H new ATOM 267 N ASP A 22 11.132 9.324 -1.616 1.00 0.00 N ATOM 268 CA ASP A 22 11.282 10.455 -0.706 1.00 0.00 C ATOM 269 C ASP A 22 10.911 10.054 0.719 1.00 0.00 C ATOM 270 O ASP A 22 11.499 10.540 1.687 1.00 0.00 O ATOM 271 CB ASP A 22 10.420 11.617 -1.197 1.00 0.00 C ATOM 272 CG ASP A 22 10.462 12.828 -0.291 1.00 0.00 C ATOM 273 OD1 ASP A 22 11.555 13.393 -0.086 1.00 0.00 O ATOM 274 OD2 ASP A 22 9.391 13.234 0.194 1.00 0.00 O ATOM 0 H ASP A 22 10.346 9.407 -2.261 1.00 0.00 H new ATOM 0 HA ASP A 22 12.325 10.773 -0.693 1.00 0.00 H new ATOM 0 HB2 ASP A 22 10.751 11.908 -2.194 1.00 0.00 H new ATOM 0 HB3 ASP A 22 9.388 11.279 -1.290 1.00 0.00 H new ATOM 279 N LEU A 23 9.925 9.164 0.828 1.00 0.00 N ATOM 280 CA LEU A 23 9.528 8.562 2.105 1.00 0.00 C ATOM 281 C LEU A 23 8.982 9.587 3.100 1.00 0.00 C ATOM 282 O LEU A 23 8.938 9.325 4.302 1.00 0.00 O ATOM 283 CB LEU A 23 10.704 7.803 2.733 1.00 0.00 C ATOM 284 CG LEU A 23 11.173 6.566 1.963 1.00 0.00 C ATOM 285 CD1 LEU A 23 12.373 5.935 2.649 1.00 0.00 C ATOM 286 CD2 LEU A 23 10.047 5.553 1.837 1.00 0.00 C ATOM 0 H LEU A 23 9.376 8.838 0.032 1.00 0.00 H new ATOM 0 HA LEU A 23 8.720 7.866 1.880 1.00 0.00 H new ATOM 0 HB2 LEU A 23 11.545 8.489 2.833 1.00 0.00 H new ATOM 0 HB3 LEU A 23 10.421 7.497 3.740 1.00 0.00 H new ATOM 0 HG LEU A 23 11.469 6.880 0.962 1.00 0.00 H new ATOM 0 HD11 LEU A 23 12.693 5.057 2.088 1.00 0.00 H new ATOM 0 HD12 LEU A 23 13.189 6.656 2.691 1.00 0.00 H new ATOM 0 HD13 LEU A 23 12.099 5.638 3.661 1.00 0.00 H new ATOM 0 HD21 LEU A 23 10.401 4.682 1.286 1.00 0.00 H new ATOM 0 HD22 LEU A 23 9.721 5.246 2.831 1.00 0.00 H new ATOM 0 HD23 LEU A 23 9.210 6.004 1.303 1.00 0.00 H new ATOM 298 N ASN A 24 8.549 10.743 2.614 1.00 0.00 N ATOM 299 CA ASN A 24 7.933 11.728 3.494 1.00 0.00 C ATOM 300 C ASN A 24 6.485 11.344 3.776 1.00 0.00 C ATOM 301 O ASN A 24 5.564 11.761 3.069 1.00 0.00 O ATOM 302 CB ASN A 24 8.014 13.142 2.909 1.00 0.00 C ATOM 303 CG ASN A 24 7.403 14.186 3.828 1.00 0.00 C ATOM 304 OD1 ASN A 24 7.312 13.989 5.037 1.00 0.00 O ATOM 305 ND2 ASN A 24 6.999 15.316 3.265 1.00 0.00 N ATOM 0 H ASN A 24 8.611 11.019 1.634 1.00 0.00 H new ATOM 0 HA ASN A 24 8.489 11.734 4.432 1.00 0.00 H new ATOM 0 HB2 ASN A 24 9.057 13.395 2.720 1.00 0.00 H new ATOM 0 HB3 ASN A 24 7.501 13.164 1.947 1.00 0.00 H new ATOM 0 HD21 ASN A 24 6.597 16.057 3.840 1.00 0.00 H new ATOM 0 HD22 ASN A 24 7.090 15.445 2.257 1.00 0.00 H new ATOM 312 N TYR A 25 6.299 10.522 4.804 1.00 0.00 N ATOM 313 CA TYR A 25 4.977 10.031 5.167 1.00 0.00 C ATOM 314 C TYR A 25 4.130 11.130 5.796 1.00 0.00 C ATOM 315 O TYR A 25 2.909 11.009 5.866 1.00 0.00 O ATOM 316 CB TYR A 25 5.088 8.832 6.115 1.00 0.00 C ATOM 317 CG TYR A 25 5.652 7.589 5.462 1.00 0.00 C ATOM 318 CD1 TYR A 25 4.898 6.864 4.546 1.00 0.00 C ATOM 319 CD2 TYR A 25 6.931 7.136 5.763 1.00 0.00 C ATOM 320 CE1 TYR A 25 5.403 5.726 3.949 1.00 0.00 C ATOM 321 CE2 TYR A 25 7.443 5.998 5.168 1.00 0.00 C ATOM 322 CZ TYR A 25 6.675 5.297 4.262 1.00 0.00 C ATOM 323 OH TYR A 25 7.181 4.166 3.665 1.00 0.00 O ATOM 0 H TYR A 25 7.052 10.181 5.402 1.00 0.00 H new ATOM 0 HA TYR A 25 4.481 9.708 4.252 1.00 0.00 H new ATOM 0 HB2 TYR A 25 5.720 9.106 6.960 1.00 0.00 H new ATOM 0 HB3 TYR A 25 4.100 8.605 6.516 1.00 0.00 H new ATOM 0 HD1 TYR A 25 3.901 7.196 4.297 1.00 0.00 H new ATOM 0 HD2 TYR A 25 7.535 7.682 6.473 1.00 0.00 H new ATOM 0 HE1 TYR A 25 4.804 5.174 3.240 1.00 0.00 H new ATOM 0 HE2 TYR A 25 8.439 5.660 5.411 1.00 0.00 H new ATOM 0 HH TYR A 25 8.089 4.001 3.993 1.00 0.00 H new ATOM 333 N GLN A 26 4.781 12.205 6.235 1.00 0.00 N ATOM 334 CA GLN A 26 4.072 13.347 6.808 1.00 0.00 C ATOM 335 C GLN A 26 3.102 13.923 5.782 1.00 0.00 C ATOM 336 O GLN A 26 1.951 14.224 6.092 1.00 0.00 O ATOM 337 CB GLN A 26 5.061 14.436 7.247 1.00 0.00 C ATOM 338 CG GLN A 26 6.107 13.970 8.252 1.00 0.00 C ATOM 339 CD GLN A 26 5.534 13.660 9.624 1.00 0.00 C ATOM 340 OE1 GLN A 26 4.385 13.234 9.762 1.00 0.00 O ATOM 341 NE2 GLN A 26 6.331 13.891 10.653 1.00 0.00 N ATOM 0 H GLN A 26 5.795 12.309 6.205 1.00 0.00 H new ATOM 0 HA GLN A 26 3.518 13.004 7.682 1.00 0.00 H new ATOM 0 HB2 GLN A 26 5.570 14.824 6.365 1.00 0.00 H new ATOM 0 HB3 GLN A 26 4.501 15.264 7.682 1.00 0.00 H new ATOM 0 HG2 GLN A 26 6.601 13.079 7.864 1.00 0.00 H new ATOM 0 HG3 GLN A 26 6.872 14.740 8.352 1.00 0.00 H new ATOM 0 HE21 GLN A 26 7.275 14.244 10.498 1.00 0.00 H new ATOM 0 HE22 GLN A 26 6.002 13.717 11.602 1.00 0.00 H new ATOM 350 N TRP A 27 3.579 14.059 4.554 1.00 0.00 N ATOM 351 CA TRP A 27 2.761 14.559 3.460 1.00 0.00 C ATOM 352 C TRP A 27 1.869 13.445 2.918 1.00 0.00 C ATOM 353 O TRP A 27 0.716 13.680 2.563 1.00 0.00 O ATOM 354 CB TRP A 27 3.660 15.115 2.352 1.00 0.00 C ATOM 355 CG TRP A 27 2.911 15.685 1.181 1.00 0.00 C ATOM 356 CD1 TRP A 27 2.272 16.891 1.121 1.00 0.00 C ATOM 357 CD2 TRP A 27 2.734 15.073 -0.103 1.00 0.00 C ATOM 358 NE1 TRP A 27 1.706 17.063 -0.120 1.00 0.00 N ATOM 359 CE2 TRP A 27 1.976 15.961 -0.888 1.00 0.00 C ATOM 360 CE3 TRP A 27 3.141 13.858 -0.663 1.00 0.00 C ATOM 361 CZ2 TRP A 27 1.621 15.676 -2.205 1.00 0.00 C ATOM 362 CZ3 TRP A 27 2.787 13.576 -1.968 1.00 0.00 C ATOM 363 CH2 TRP A 27 2.033 14.480 -2.726 1.00 0.00 C ATOM 0 H TRP A 27 4.536 13.828 4.289 1.00 0.00 H new ATOM 0 HA TRP A 27 2.122 15.362 3.829 1.00 0.00 H new ATOM 0 HB2 TRP A 27 4.299 15.891 2.773 1.00 0.00 H new ATOM 0 HB3 TRP A 27 4.316 14.320 1.998 1.00 0.00 H new ATOM 0 HD1 TRP A 27 2.219 17.605 1.930 1.00 0.00 H new ATOM 0 HE1 TRP A 27 1.172 17.878 -0.420 1.00 0.00 H new ATOM 0 HE3 TRP A 27 3.721 13.153 -0.086 1.00 0.00 H new ATOM 0 HZ2 TRP A 27 1.042 16.373 -2.793 1.00 0.00 H new ATOM 0 HZ3 TRP A 27 3.097 12.641 -2.412 1.00 0.00 H new ATOM 0 HH2 TRP A 27 1.771 14.228 -3.743 1.00 0.00 H new ATOM 374 N PHE A 28 2.413 12.231 2.885 1.00 0.00 N ATOM 375 CA PHE A 28 1.704 11.071 2.355 1.00 0.00 C ATOM 376 C PHE A 28 0.392 10.831 3.102 1.00 0.00 C ATOM 377 O PHE A 28 -0.681 10.826 2.498 1.00 0.00 O ATOM 378 CB PHE A 28 2.600 9.827 2.440 1.00 0.00 C ATOM 379 CG PHE A 28 1.982 8.581 1.871 1.00 0.00 C ATOM 380 CD1 PHE A 28 1.593 8.523 0.541 1.00 0.00 C ATOM 381 CD2 PHE A 28 1.808 7.460 2.666 1.00 0.00 C ATOM 382 CE1 PHE A 28 1.037 7.371 0.019 1.00 0.00 C ATOM 383 CE2 PHE A 28 1.253 6.305 2.149 1.00 0.00 C ATOM 384 CZ PHE A 28 0.868 6.261 0.822 1.00 0.00 C ATOM 0 H PHE A 28 3.353 12.025 3.223 1.00 0.00 H new ATOM 0 HA PHE A 28 1.461 11.269 1.311 1.00 0.00 H new ATOM 0 HB2 PHE A 28 3.533 10.029 1.914 1.00 0.00 H new ATOM 0 HB3 PHE A 28 2.855 9.648 3.484 1.00 0.00 H new ATOM 0 HD1 PHE A 28 1.726 9.387 -0.093 1.00 0.00 H new ATOM 0 HD2 PHE A 28 2.110 7.489 3.703 1.00 0.00 H new ATOM 0 HE1 PHE A 28 0.735 7.339 -1.017 1.00 0.00 H new ATOM 0 HE2 PHE A 28 1.120 5.439 2.780 1.00 0.00 H new ATOM 0 HZ PHE A 28 0.436 5.359 0.414 1.00 0.00 H new ATOM 394 N TYR A 29 0.474 10.660 4.417 1.00 0.00 N ATOM 395 CA TYR A 29 -0.712 10.381 5.218 1.00 0.00 C ATOM 396 C TYR A 29 -1.606 11.610 5.326 1.00 0.00 C ATOM 397 O TYR A 29 -2.820 11.489 5.498 1.00 0.00 O ATOM 398 CB TYR A 29 -0.326 9.878 6.609 1.00 0.00 C ATOM 399 CG TYR A 29 0.232 8.472 6.603 1.00 0.00 C ATOM 400 CD1 TYR A 29 -0.595 7.386 6.349 1.00 0.00 C ATOM 401 CD2 TYR A 29 1.576 8.230 6.840 1.00 0.00 C ATOM 402 CE1 TYR A 29 -0.098 6.098 6.334 1.00 0.00 C ATOM 403 CE2 TYR A 29 2.082 6.943 6.822 1.00 0.00 C ATOM 404 CZ TYR A 29 1.241 5.882 6.570 1.00 0.00 C ATOM 405 OH TYR A 29 1.741 4.599 6.548 1.00 0.00 O ATOM 0 H TYR A 29 1.343 10.709 4.948 1.00 0.00 H new ATOM 0 HA TYR A 29 -1.274 9.596 4.712 1.00 0.00 H new ATOM 0 HB2 TYR A 29 0.413 10.553 7.040 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -1.203 9.911 7.256 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -1.645 7.552 6.160 1.00 0.00 H new ATOM 0 HD2 TYR A 29 2.238 9.059 7.042 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -0.756 5.264 6.138 1.00 0.00 H new ATOM 0 HE2 TYR A 29 3.132 6.771 7.005 1.00 0.00 H new ATOM 0 HH TYR A 29 2.703 4.620 6.732 1.00 0.00 H new ATOM 415 N SER A 30 -1.006 12.788 5.211 1.00 0.00 N ATOM 416 CA SER A 30 -1.761 14.030 5.231 1.00 0.00 C ATOM 417 C SER A 30 -2.708 14.084 4.036 1.00 0.00 C ATOM 418 O SER A 30 -3.898 14.365 4.184 1.00 0.00 O ATOM 419 CB SER A 30 -0.810 15.231 5.212 1.00 0.00 C ATOM 420 OG SER A 30 -1.517 16.460 5.273 1.00 0.00 O ATOM 0 H SER A 30 0.001 12.907 5.103 1.00 0.00 H new ATOM 0 HA SER A 30 -2.349 14.070 6.148 1.00 0.00 H new ATOM 0 HB2 SER A 30 -0.122 15.164 6.055 1.00 0.00 H new ATOM 0 HB3 SER A 30 -0.206 15.203 4.305 1.00 0.00 H new ATOM 0 HG SER A 30 -0.880 17.205 5.261 1.00 0.00 H new ATOM 426 N GLU A 31 -2.185 13.781 2.852 1.00 0.00 N ATOM 427 CA GLU A 31 -2.997 13.792 1.645 1.00 0.00 C ATOM 428 C GLU A 31 -3.982 12.636 1.643 1.00 0.00 C ATOM 429 O GLU A 31 -5.106 12.781 1.173 1.00 0.00 O ATOM 430 CB GLU A 31 -2.125 13.738 0.390 1.00 0.00 C ATOM 431 CG GLU A 31 -1.260 14.966 0.210 1.00 0.00 C ATOM 432 CD GLU A 31 -2.049 16.252 0.340 1.00 0.00 C ATOM 433 OE1 GLU A 31 -2.978 16.476 -0.468 1.00 0.00 O ATOM 434 OE2 GLU A 31 -1.738 17.052 1.247 1.00 0.00 O ATOM 0 H GLU A 31 -1.208 13.527 2.705 1.00 0.00 H new ATOM 0 HA GLU A 31 -3.556 14.728 1.636 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -1.486 12.856 0.437 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -2.765 13.622 -0.484 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -0.461 14.956 0.952 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -0.785 14.932 -0.770 1.00 0.00 H new ATOM 441 N LEU A 32 -3.568 11.492 2.170 1.00 0.00 N ATOM 442 CA LEU A 32 -4.468 10.351 2.275 1.00 0.00 C ATOM 443 C LEU A 32 -5.693 10.718 3.101 1.00 0.00 C ATOM 444 O LEU A 32 -6.816 10.435 2.714 1.00 0.00 O ATOM 445 CB LEU A 32 -3.774 9.141 2.902 1.00 0.00 C ATOM 446 CG LEU A 32 -2.665 8.506 2.061 1.00 0.00 C ATOM 447 CD1 LEU A 32 -2.078 7.307 2.789 1.00 0.00 C ATOM 448 CD2 LEU A 32 -3.186 8.097 0.688 1.00 0.00 C ATOM 0 H LEU A 32 -2.627 11.329 2.528 1.00 0.00 H new ATOM 0 HA LEU A 32 -4.774 10.083 1.264 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -3.351 9.443 3.860 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -4.527 8.381 3.112 1.00 0.00 H new ATOM 0 HG LEU A 32 -1.879 9.247 1.913 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -1.290 6.863 2.181 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -1.662 7.629 3.744 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -2.861 6.569 2.964 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -2.377 7.648 0.111 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -3.993 7.373 0.806 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -3.561 8.976 0.164 1.00 0.00 H new ATOM 460 N LYS A 33 -5.465 11.392 4.217 1.00 0.00 N ATOM 461 CA LYS A 33 -6.542 11.753 5.129 1.00 0.00 C ATOM 462 C LYS A 33 -7.410 12.873 4.536 1.00 0.00 C ATOM 463 O LYS A 33 -8.560 13.058 4.933 1.00 0.00 O ATOM 464 CB LYS A 33 -5.940 12.174 6.478 1.00 0.00 C ATOM 465 CG LYS A 33 -6.884 12.043 7.668 1.00 0.00 C ATOM 466 CD LYS A 33 -7.758 13.271 7.862 1.00 0.00 C ATOM 467 CE LYS A 33 -6.926 14.517 8.127 1.00 0.00 C ATOM 468 NZ LYS A 33 -7.775 15.682 8.489 1.00 0.00 N ATOM 0 H LYS A 33 -4.540 11.702 4.515 1.00 0.00 H new ATOM 0 HA LYS A 33 -7.189 10.889 5.282 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -5.052 11.570 6.668 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -5.611 13.211 6.405 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -7.519 11.169 7.528 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -6.300 11.871 8.572 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -8.372 13.425 6.974 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -8.440 13.104 8.696 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -6.220 14.318 8.933 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -6.339 14.757 7.241 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -7.171 16.511 8.662 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -8.432 15.888 7.710 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -8.317 15.463 9.349 1.00 0.00 H new ATOM 482 N ARG A 34 -6.859 13.617 3.584 1.00 0.00 N ATOM 483 CA ARG A 34 -7.585 14.734 2.989 1.00 0.00 C ATOM 484 C ARG A 34 -8.184 14.379 1.625 1.00 0.00 C ATOM 485 O ARG A 34 -8.890 15.189 1.027 1.00 0.00 O ATOM 486 CB ARG A 34 -6.679 15.963 2.866 1.00 0.00 C ATOM 487 CG ARG A 34 -6.180 16.472 4.210 1.00 0.00 C ATOM 488 CD ARG A 34 -5.658 17.896 4.124 1.00 0.00 C ATOM 489 NE ARG A 34 -4.429 18.003 3.341 1.00 0.00 N ATOM 490 CZ ARG A 34 -3.718 19.125 3.241 1.00 0.00 C ATOM 491 NH1 ARG A 34 -4.117 20.227 3.863 1.00 0.00 N ATOM 492 NH2 ARG A 34 -2.607 19.152 2.522 1.00 0.00 N ATOM 0 H ARG A 34 -5.921 13.470 3.210 1.00 0.00 H new ATOM 0 HA ARG A 34 -8.414 14.966 3.658 1.00 0.00 H new ATOM 0 HB2 ARG A 34 -5.824 15.715 2.237 1.00 0.00 H new ATOM 0 HB3 ARG A 34 -7.225 16.761 2.362 1.00 0.00 H new ATOM 0 HG2 ARG A 34 -6.990 16.427 4.938 1.00 0.00 H new ATOM 0 HG3 ARG A 34 -5.388 15.817 4.574 1.00 0.00 H new ATOM 0 HD2 ARG A 34 -6.423 18.532 3.679 1.00 0.00 H new ATOM 0 HD3 ARG A 34 -5.476 18.273 5.131 1.00 0.00 H new ATOM 0 HE ARG A 34 -4.098 17.175 2.845 1.00 0.00 H new ATOM 0 HH11 ARG A 34 -4.971 20.217 4.420 1.00 0.00 H new ATOM 0 HH12 ARG A 34 -3.570 21.084 3.784 1.00 0.00 H new ATOM 0 HH21 ARG A 34 -2.291 18.310 2.040 1.00 0.00 H new ATOM 0 HH22 ARG A 34 -2.067 20.014 2.450 1.00 0.00 H new ATOM 506 N HIS A 35 -7.902 13.180 1.128 1.00 0.00 N ATOM 507 CA HIS A 35 -8.440 12.753 -0.164 1.00 0.00 C ATOM 508 C HIS A 35 -9.064 11.365 -0.059 1.00 0.00 C ATOM 509 O HIS A 35 -10.244 11.168 -0.362 1.00 0.00 O ATOM 510 CB HIS A 35 -7.354 12.750 -1.249 1.00 0.00 C ATOM 511 CG HIS A 35 -6.687 14.076 -1.459 1.00 0.00 C ATOM 512 ND1 HIS A 35 -7.352 15.198 -1.903 1.00 0.00 N ATOM 513 CD2 HIS A 35 -5.404 14.457 -1.264 1.00 0.00 C ATOM 514 CE1 HIS A 35 -6.503 16.210 -1.973 1.00 0.00 C ATOM 515 NE2 HIS A 35 -5.314 15.785 -1.588 1.00 0.00 N ATOM 0 H HIS A 35 -7.311 12.491 1.592 1.00 0.00 H new ATOM 0 HA HIS A 35 -9.210 13.470 -0.447 1.00 0.00 H new ATOM 0 HB2 HIS A 35 -6.596 12.013 -0.985 1.00 0.00 H new ATOM 0 HB3 HIS A 35 -7.799 12.427 -2.190 1.00 0.00 H new ATOM 0 HD2 HIS A 35 -4.597 13.829 -0.916 1.00 0.00 H new ATOM 0 HE1 HIS A 35 -6.742 17.214 -2.291 1.00 0.00 H new ATOM 0 HE2 HIS A 35 -4.468 16.352 -1.540 1.00 0.00 H new ATOM 524 N ASN A 36 -8.261 10.405 0.377 1.00 0.00 N ATOM 525 CA ASN A 36 -8.702 9.024 0.512 1.00 0.00 C ATOM 526 C ASN A 36 -9.425 8.837 1.840 1.00 0.00 C ATOM 527 O ASN A 36 -8.849 8.369 2.820 1.00 0.00 O ATOM 528 CB ASN A 36 -7.503 8.076 0.424 1.00 0.00 C ATOM 529 CG ASN A 36 -7.888 6.616 0.556 1.00 0.00 C ATOM 530 OD1 ASN A 36 -8.965 6.202 0.135 1.00 0.00 O ATOM 531 ND2 ASN A 36 -7.009 5.822 1.152 1.00 0.00 N ATOM 0 H ASN A 36 -7.289 10.560 0.646 1.00 0.00 H new ATOM 0 HA ASN A 36 -9.391 8.791 -0.300 1.00 0.00 H new ATOM 0 HB2 ASN A 36 -6.997 8.227 -0.530 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -6.789 8.329 1.207 1.00 0.00 H new ATOM 0 HD21 ASN A 36 -7.217 4.831 1.274 1.00 0.00 H new ATOM 0 HD22 ASN A 36 -6.124 6.202 1.489 1.00 0.00 H new ATOM 538 N VAL A 37 -10.684 9.236 1.869 1.00 0.00 N ATOM 539 CA VAL A 37 -11.473 9.178 3.091 1.00 0.00 C ATOM 540 C VAL A 37 -11.887 7.742 3.401 1.00 0.00 C ATOM 541 O VAL A 37 -12.127 7.386 4.555 1.00 0.00 O ATOM 542 CB VAL A 37 -12.727 10.074 2.985 1.00 0.00 C ATOM 543 CG1 VAL A 37 -13.511 10.091 4.292 1.00 0.00 C ATOM 544 CG2 VAL A 37 -12.342 11.489 2.580 1.00 0.00 C ATOM 0 H VAL A 37 -11.184 9.605 1.060 1.00 0.00 H new ATOM 0 HA VAL A 37 -10.849 9.548 3.904 1.00 0.00 H new ATOM 0 HB VAL A 37 -13.371 9.652 2.213 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -14.387 10.731 4.183 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -13.830 9.078 4.538 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -12.878 10.476 5.091 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -13.239 12.104 2.511 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -11.669 11.911 3.327 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -11.842 11.467 1.612 1.00 0.00 H new ATOM 554 N SER A 38 -11.957 6.915 2.371 1.00 0.00 N ATOM 555 CA SER A 38 -12.363 5.535 2.549 1.00 0.00 C ATOM 556 C SER A 38 -11.150 4.605 2.656 1.00 0.00 C ATOM 557 O SER A 38 -10.722 4.258 3.759 1.00 0.00 O ATOM 558 CB SER A 38 -13.280 5.110 1.405 1.00 0.00 C ATOM 559 OG SER A 38 -14.429 5.934 1.343 1.00 0.00 O ATOM 0 H SER A 38 -11.739 7.175 1.409 1.00 0.00 H new ATOM 0 HA SER A 38 -12.913 5.457 3.487 1.00 0.00 H new ATOM 0 HB2 SER A 38 -12.738 5.164 0.461 1.00 0.00 H new ATOM 0 HB3 SER A 38 -13.580 4.071 1.542 1.00 0.00 H new ATOM 0 HG SER A 38 -14.356 6.540 0.576 1.00 0.00 H new ATOM 565 N HIS A 39 -10.587 4.220 1.509 1.00 0.00 N ATOM 566 CA HIS A 39 -9.490 3.253 1.472 1.00 0.00 C ATOM 567 C HIS A 39 -9.041 3.004 0.037 1.00 0.00 C ATOM 568 O HIS A 39 -9.823 3.173 -0.897 1.00 0.00 O ATOM 569 CB HIS A 39 -9.917 1.923 2.113 1.00 0.00 C ATOM 570 CG HIS A 39 -10.996 1.190 1.371 1.00 0.00 C ATOM 571 ND1 HIS A 39 -12.291 1.648 1.277 1.00 0.00 N ATOM 572 CD2 HIS A 39 -10.963 0.027 0.680 1.00 0.00 C ATOM 573 CE1 HIS A 39 -13.004 0.800 0.563 1.00 0.00 C ATOM 574 NE2 HIS A 39 -12.224 -0.194 0.187 1.00 0.00 N ATOM 0 H HIS A 39 -10.874 4.564 0.593 1.00 0.00 H new ATOM 0 HA HIS A 39 -8.658 3.670 2.039 1.00 0.00 H new ATOM 0 HB2 HIS A 39 -9.044 1.275 2.191 1.00 0.00 H new ATOM 0 HB3 HIS A 39 -10.261 2.118 3.129 1.00 0.00 H new ATOM 0 HD2 HIS A 39 -10.102 -0.610 0.542 1.00 0.00 H new ATOM 0 HE1 HIS A 39 -14.053 0.902 0.326 1.00 0.00 H new ATOM 0 HE2 HIS A 39 -12.510 -0.994 -0.377 1.00 0.00 H new ATOM 583 N TYR A 40 -7.795 2.584 -0.134 1.00 0.00 N ATOM 584 CA TYR A 40 -7.286 2.261 -1.459 1.00 0.00 C ATOM 585 C TYR A 40 -6.777 0.827 -1.485 1.00 0.00 C ATOM 586 O TYR A 40 -6.246 0.331 -0.490 1.00 0.00 O ATOM 587 CB TYR A 40 -6.178 3.238 -1.888 1.00 0.00 C ATOM 588 CG TYR A 40 -4.877 3.110 -1.119 1.00 0.00 C ATOM 589 CD1 TYR A 40 -4.679 3.796 0.072 1.00 0.00 C ATOM 590 CD2 TYR A 40 -3.843 2.310 -1.596 1.00 0.00 C ATOM 591 CE1 TYR A 40 -3.490 3.686 0.767 1.00 0.00 C ATOM 592 CE2 TYR A 40 -2.652 2.195 -0.906 1.00 0.00 C ATOM 593 CZ TYR A 40 -2.480 2.885 0.273 1.00 0.00 C ATOM 594 OH TYR A 40 -1.299 2.770 0.968 1.00 0.00 O ATOM 0 H TYR A 40 -7.122 2.460 0.623 1.00 0.00 H new ATOM 0 HA TYR A 40 -8.104 2.360 -2.172 1.00 0.00 H new ATOM 0 HB2 TYR A 40 -5.972 3.088 -2.948 1.00 0.00 H new ATOM 0 HB3 TYR A 40 -6.550 4.257 -1.777 1.00 0.00 H new ATOM 0 HD1 TYR A 40 -5.466 4.425 0.461 1.00 0.00 H new ATOM 0 HD2 TYR A 40 -3.974 1.770 -2.522 1.00 0.00 H new ATOM 0 HE1 TYR A 40 -3.351 4.224 1.693 1.00 0.00 H new ATOM 0 HE2 TYR A 40 -1.861 1.568 -1.289 1.00 0.00 H new ATOM 0 HH TYR A 40 -1.421 2.153 1.720 1.00 0.00 H new ATOM 604 N ILE A 41 -6.968 0.161 -2.613 1.00 0.00 N ATOM 605 CA ILE A 41 -6.523 -1.216 -2.772 1.00 0.00 C ATOM 606 C ILE A 41 -5.384 -1.292 -3.781 1.00 0.00 C ATOM 607 O ILE A 41 -5.554 -0.970 -4.957 1.00 0.00 O ATOM 608 CB ILE A 41 -7.663 -2.163 -3.226 1.00 0.00 C ATOM 609 CG1 ILE A 41 -8.872 -2.086 -2.285 1.00 0.00 C ATOM 610 CG2 ILE A 41 -7.155 -3.594 -3.302 1.00 0.00 C ATOM 611 CD1 ILE A 41 -9.823 -0.948 -2.595 1.00 0.00 C ATOM 0 H ILE A 41 -7.429 0.552 -3.434 1.00 0.00 H new ATOM 0 HA ILE A 41 -6.183 -1.547 -1.791 1.00 0.00 H new ATOM 0 HB ILE A 41 -7.988 -1.840 -4.215 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -9.419 -3.027 -2.336 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -8.516 -1.979 -1.260 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -7.964 -4.251 -3.622 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -6.336 -3.652 -4.019 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -6.800 -3.907 -2.320 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -10.651 -0.962 -1.886 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -9.293 0.001 -2.515 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -10.211 -1.063 -3.607 1.00 0.00 H new ATOM 623 N TYR A 42 -4.229 -1.710 -3.304 1.00 0.00 N ATOM 624 CA TYR A 42 -3.041 -1.841 -4.128 1.00 0.00 C ATOM 625 C TYR A 42 -2.844 -3.305 -4.525 1.00 0.00 C ATOM 626 O TYR A 42 -2.600 -4.156 -3.671 1.00 0.00 O ATOM 627 CB TYR A 42 -1.825 -1.336 -3.337 1.00 0.00 C ATOM 628 CG TYR A 42 -0.559 -1.151 -4.149 1.00 0.00 C ATOM 629 CD1 TYR A 42 0.034 -2.216 -4.816 1.00 0.00 C ATOM 630 CD2 TYR A 42 0.047 0.094 -4.232 1.00 0.00 C ATOM 631 CE1 TYR A 42 1.190 -2.044 -5.546 1.00 0.00 C ATOM 632 CE2 TYR A 42 1.206 0.273 -4.962 1.00 0.00 C ATOM 633 CZ TYR A 42 1.771 -0.801 -5.617 1.00 0.00 C ATOM 634 OH TYR A 42 2.922 -0.630 -6.347 1.00 0.00 O ATOM 0 H TYR A 42 -4.086 -1.970 -2.328 1.00 0.00 H new ATOM 0 HA TYR A 42 -3.154 -1.248 -5.035 1.00 0.00 H new ATOM 0 HB2 TYR A 42 -2.083 -0.384 -2.874 1.00 0.00 H new ATOM 0 HB3 TYR A 42 -1.620 -2.038 -2.529 1.00 0.00 H new ATOM 0 HD1 TYR A 42 -0.419 -3.195 -4.761 1.00 0.00 H new ATOM 0 HD2 TYR A 42 -0.394 0.936 -3.718 1.00 0.00 H new ATOM 0 HE1 TYR A 42 1.637 -2.882 -6.060 1.00 0.00 H new ATOM 0 HE2 TYR A 42 1.667 1.248 -5.019 1.00 0.00 H new ATOM 0 HH TYR A 42 2.798 -1.003 -7.245 1.00 0.00 H new ATOM 644 N TYR A 43 -2.966 -3.602 -5.809 1.00 0.00 N ATOM 645 CA TYR A 43 -2.726 -4.954 -6.292 1.00 0.00 C ATOM 646 C TYR A 43 -1.289 -5.101 -6.766 1.00 0.00 C ATOM 647 O TYR A 43 -0.908 -4.557 -7.805 1.00 0.00 O ATOM 648 CB TYR A 43 -3.684 -5.308 -7.433 1.00 0.00 C ATOM 649 CG TYR A 43 -5.146 -5.310 -7.033 1.00 0.00 C ATOM 650 CD1 TYR A 43 -5.704 -6.396 -6.368 1.00 0.00 C ATOM 651 CD2 TYR A 43 -5.970 -4.229 -7.328 1.00 0.00 C ATOM 652 CE1 TYR A 43 -7.040 -6.403 -6.008 1.00 0.00 C ATOM 653 CE2 TYR A 43 -7.304 -4.229 -6.971 1.00 0.00 C ATOM 654 CZ TYR A 43 -7.835 -5.317 -6.311 1.00 0.00 C ATOM 655 OH TYR A 43 -9.163 -5.319 -5.954 1.00 0.00 O ATOM 0 H TYR A 43 -3.228 -2.931 -6.531 1.00 0.00 H new ATOM 0 HA TYR A 43 -2.903 -5.640 -5.464 1.00 0.00 H new ATOM 0 HB2 TYR A 43 -3.542 -4.597 -8.247 1.00 0.00 H new ATOM 0 HB3 TYR A 43 -3.423 -6.293 -7.821 1.00 0.00 H new ATOM 0 HD1 TYR A 43 -5.085 -7.248 -6.129 1.00 0.00 H new ATOM 0 HD2 TYR A 43 -5.559 -3.375 -7.845 1.00 0.00 H new ATOM 0 HE1 TYR A 43 -7.458 -7.255 -5.492 1.00 0.00 H new ATOM 0 HE2 TYR A 43 -7.929 -3.380 -7.208 1.00 0.00 H new ATOM 0 HH TYR A 43 -9.580 -4.479 -6.240 1.00 0.00 H new ATOM 665 N LEU A 44 -0.488 -5.823 -5.997 1.00 0.00 N ATOM 666 CA LEU A 44 0.903 -6.052 -6.357 1.00 0.00 C ATOM 667 C LEU A 44 0.980 -7.038 -7.519 1.00 0.00 C ATOM 668 O LEU A 44 0.013 -7.748 -7.794 1.00 0.00 O ATOM 669 CB LEU A 44 1.717 -6.569 -5.160 1.00 0.00 C ATOM 670 CG LEU A 44 1.938 -5.570 -4.015 1.00 0.00 C ATOM 671 CD1 LEU A 44 0.726 -5.504 -3.097 1.00 0.00 C ATOM 672 CD2 LEU A 44 3.190 -5.928 -3.227 1.00 0.00 C ATOM 0 H LEU A 44 -0.777 -6.260 -5.121 1.00 0.00 H new ATOM 0 HA LEU A 44 1.337 -5.100 -6.662 1.00 0.00 H new ATOM 0 HB2 LEU A 44 1.215 -7.448 -4.757 1.00 0.00 H new ATOM 0 HB3 LEU A 44 2.691 -6.897 -5.523 1.00 0.00 H new ATOM 0 HG LEU A 44 2.076 -4.582 -4.455 1.00 0.00 H new ATOM 0 HD11 LEU A 44 0.914 -4.788 -2.297 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -0.147 -5.188 -3.669 1.00 0.00 H new ATOM 0 HD13 LEU A 44 0.541 -6.488 -2.667 1.00 0.00 H new ATOM 0 HD21 LEU A 44 3.330 -5.209 -2.420 1.00 0.00 H new ATOM 0 HD22 LEU A 44 3.082 -6.928 -2.807 1.00 0.00 H new ATOM 0 HD23 LEU A 44 4.056 -5.904 -3.889 1.00 0.00 H new ATOM 684 N ALA A 45 2.119 -7.050 -8.218 1.00 0.00 N ATOM 685 CA ALA A 45 2.318 -7.908 -9.398 1.00 0.00 C ATOM 686 C ALA A 45 1.359 -7.520 -10.518 1.00 0.00 C ATOM 687 O ALA A 45 1.197 -8.243 -11.502 1.00 0.00 O ATOM 688 CB ALA A 45 2.154 -9.382 -9.045 1.00 0.00 C ATOM 0 H ALA A 45 2.926 -6.471 -7.987 1.00 0.00 H new ATOM 0 HA ALA A 45 3.339 -7.756 -9.748 1.00 0.00 H new ATOM 0 HB1 ALA A 45 2.307 -9.989 -9.937 1.00 0.00 H new ATOM 0 HB2 ALA A 45 2.888 -9.659 -8.288 1.00 0.00 H new ATOM 0 HB3 ALA A 45 1.150 -9.554 -8.657 1.00 0.00 H new ATOM 694 N THR A 46 0.729 -6.369 -10.352 1.00 0.00 N ATOM 695 CA THR A 46 -0.225 -5.862 -11.319 1.00 0.00 C ATOM 696 C THR A 46 -0.137 -4.336 -11.380 1.00 0.00 C ATOM 697 O THR A 46 -0.349 -3.734 -12.433 1.00 0.00 O ATOM 698 CB THR A 46 -1.662 -6.286 -10.955 1.00 0.00 C ATOM 699 OG1 THR A 46 -1.668 -7.638 -10.458 1.00 0.00 O ATOM 700 CG2 THR A 46 -2.576 -6.196 -12.169 1.00 0.00 C ATOM 0 H THR A 46 0.865 -5.762 -9.544 1.00 0.00 H new ATOM 0 HA THR A 46 0.020 -6.283 -12.294 1.00 0.00 H new ATOM 0 HB THR A 46 -2.029 -5.609 -10.184 1.00 0.00 H new ATOM 0 HG1 THR A 46 -1.492 -7.633 -9.494 1.00 0.00 H new ATOM 0 HG21 THR A 46 -3.585 -6.500 -11.888 1.00 0.00 H new ATOM 0 HG22 THR A 46 -2.595 -5.169 -12.535 1.00 0.00 H new ATOM 0 HG23 THR A 46 -2.204 -6.854 -12.954 1.00 0.00 H new ATOM 708 N GLU A 47 0.163 -3.729 -10.225 1.00 0.00 N ATOM 709 CA GLU A 47 0.408 -2.290 -10.114 1.00 0.00 C ATOM 710 C GLU A 47 -0.880 -1.493 -10.272 1.00 0.00 C ATOM 711 O GLU A 47 -0.850 -0.292 -10.541 1.00 0.00 O ATOM 712 CB GLU A 47 1.463 -1.831 -11.129 1.00 0.00 C ATOM 713 CG GLU A 47 2.832 -2.456 -10.904 1.00 0.00 C ATOM 714 CD GLU A 47 3.480 -2.011 -9.604 1.00 0.00 C ATOM 715 OE1 GLU A 47 2.859 -2.180 -8.531 1.00 0.00 O ATOM 716 OE2 GLU A 47 4.621 -1.502 -9.649 1.00 0.00 O ATOM 0 H GLU A 47 0.242 -4.227 -9.338 1.00 0.00 H new ATOM 0 HA GLU A 47 0.795 -2.099 -9.113 1.00 0.00 H new ATOM 0 HB2 GLU A 47 1.120 -2.077 -12.134 1.00 0.00 H new ATOM 0 HB3 GLU A 47 1.555 -0.746 -11.080 1.00 0.00 H new ATOM 0 HG2 GLU A 47 2.734 -3.542 -10.902 1.00 0.00 H new ATOM 0 HG3 GLU A 47 3.485 -2.196 -11.737 1.00 0.00 H new ATOM 723 N ASN A 48 -2.007 -2.164 -10.074 1.00 0.00 N ATOM 724 CA ASN A 48 -3.305 -1.507 -10.116 1.00 0.00 C ATOM 725 C ASN A 48 -3.698 -1.026 -8.730 1.00 0.00 C ATOM 726 O ASN A 48 -3.928 -1.829 -7.826 1.00 0.00 O ATOM 727 CB ASN A 48 -4.385 -2.447 -10.664 1.00 0.00 C ATOM 728 CG ASN A 48 -4.310 -2.618 -12.171 1.00 0.00 C ATOM 729 OD1 ASN A 48 -3.883 -1.718 -12.889 1.00 0.00 O ATOM 730 ND2 ASN A 48 -4.746 -3.768 -12.657 1.00 0.00 N ATOM 0 H ASN A 48 -2.048 -3.165 -9.882 1.00 0.00 H new ATOM 0 HA ASN A 48 -3.223 -0.650 -10.785 1.00 0.00 H new ATOM 0 HB2 ASN A 48 -4.287 -3.422 -10.187 1.00 0.00 H new ATOM 0 HB3 ASN A 48 -5.368 -2.059 -10.396 1.00 0.00 H new ATOM 0 HD21 ASN A 48 -4.735 -3.933 -13.663 1.00 0.00 H new ATOM 0 HD22 ASN A 48 -5.093 -4.490 -12.025 1.00 0.00 H new ATOM 737 N VAL A 49 -3.762 0.281 -8.564 1.00 0.00 N ATOM 738 CA VAL A 49 -4.110 0.871 -7.281 1.00 0.00 C ATOM 739 C VAL A 49 -5.482 1.529 -7.366 1.00 0.00 C ATOM 740 O VAL A 49 -5.666 2.498 -8.089 1.00 0.00 O ATOM 741 CB VAL A 49 -3.070 1.922 -6.836 1.00 0.00 C ATOM 742 CG1 VAL A 49 -3.281 2.310 -5.380 1.00 0.00 C ATOM 743 CG2 VAL A 49 -1.653 1.411 -7.062 1.00 0.00 C ATOM 0 H VAL A 49 -3.577 0.959 -9.303 1.00 0.00 H new ATOM 0 HA VAL A 49 -4.124 0.069 -6.543 1.00 0.00 H new ATOM 0 HB VAL A 49 -3.208 2.815 -7.446 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -2.537 3.051 -5.089 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -4.279 2.730 -5.256 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -3.179 1.427 -4.750 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -0.938 2.168 -6.741 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -1.499 0.499 -6.485 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -1.507 1.200 -8.121 1.00 0.00 H new ATOM 753 N HIS A 50 -6.448 0.989 -6.642 1.00 0.00 N ATOM 754 CA HIS A 50 -7.807 1.519 -6.677 1.00 0.00 C ATOM 755 C HIS A 50 -8.108 2.324 -5.421 1.00 0.00 C ATOM 756 O HIS A 50 -8.349 1.760 -4.356 1.00 0.00 O ATOM 757 CB HIS A 50 -8.833 0.389 -6.843 1.00 0.00 C ATOM 758 CG HIS A 50 -8.882 -0.182 -8.229 1.00 0.00 C ATOM 759 ND1 HIS A 50 -10.060 -0.395 -8.916 1.00 0.00 N ATOM 760 CD2 HIS A 50 -7.891 -0.589 -9.057 1.00 0.00 C ATOM 761 CE1 HIS A 50 -9.789 -0.900 -10.105 1.00 0.00 C ATOM 762 NE2 HIS A 50 -8.480 -1.030 -10.218 1.00 0.00 N ATOM 0 H HIS A 50 -6.321 0.187 -6.024 1.00 0.00 H new ATOM 0 HA HIS A 50 -7.883 2.182 -7.539 1.00 0.00 H new ATOM 0 HB2 HIS A 50 -8.598 -0.409 -6.139 1.00 0.00 H new ATOM 0 HB3 HIS A 50 -9.821 0.766 -6.580 1.00 0.00 H new ATOM 0 HD2 HIS A 50 -6.832 -0.571 -8.844 1.00 0.00 H new ATOM 0 HE1 HIS A 50 -10.516 -1.163 -10.859 1.00 0.00 H new ATOM 0 HE2 HIS A 50 -7.987 -1.397 -11.032 1.00 0.00 H new ATOM 771 N ILE A 51 -8.076 3.643 -5.553 1.00 0.00 N ATOM 772 CA ILE A 51 -8.350 4.538 -4.434 1.00 0.00 C ATOM 773 C ILE A 51 -9.827 4.900 -4.401 1.00 0.00 C ATOM 774 O ILE A 51 -10.343 5.522 -5.327 1.00 0.00 O ATOM 775 CB ILE A 51 -7.520 5.852 -4.508 1.00 0.00 C ATOM 776 CG1 ILE A 51 -6.013 5.573 -4.475 1.00 0.00 C ATOM 777 CG2 ILE A 51 -7.896 6.787 -3.365 1.00 0.00 C ATOM 778 CD1 ILE A 51 -5.439 5.112 -5.795 1.00 0.00 C ATOM 0 H ILE A 51 -7.862 4.120 -6.429 1.00 0.00 H new ATOM 0 HA ILE A 51 -8.065 4.002 -3.529 1.00 0.00 H new ATOM 0 HB ILE A 51 -7.755 6.331 -5.458 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -5.494 6.479 -4.163 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -5.812 4.814 -3.719 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -7.305 7.701 -3.433 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -8.956 7.034 -3.431 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -7.696 6.296 -2.413 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -4.369 4.937 -5.685 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -5.928 4.188 -6.102 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -5.605 5.879 -6.552 1.00 0.00 H new ATOM 790 N VAL A 52 -10.512 4.499 -3.344 1.00 0.00 N ATOM 791 CA VAL A 52 -11.906 4.861 -3.176 1.00 0.00 C ATOM 792 C VAL A 52 -12.003 6.115 -2.322 1.00 0.00 C ATOM 793 O VAL A 52 -11.678 6.093 -1.133 1.00 0.00 O ATOM 794 CB VAL A 52 -12.724 3.726 -2.526 1.00 0.00 C ATOM 795 CG1 VAL A 52 -14.201 4.091 -2.478 1.00 0.00 C ATOM 796 CG2 VAL A 52 -12.518 2.418 -3.272 1.00 0.00 C ATOM 0 H VAL A 52 -10.127 3.926 -2.594 1.00 0.00 H new ATOM 0 HA VAL A 52 -12.325 5.044 -4.165 1.00 0.00 H new ATOM 0 HB VAL A 52 -12.370 3.593 -1.504 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -14.762 3.278 -2.016 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -14.332 5.001 -1.892 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -14.568 4.256 -3.491 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -13.104 1.632 -2.796 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -12.840 2.535 -4.307 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -11.462 2.148 -3.249 1.00 0.00 H new ATOM 806 N LEU A 53 -12.432 7.210 -2.936 1.00 0.00 N ATOM 807 CA LEU A 53 -12.518 8.493 -2.251 1.00 0.00 C ATOM 808 C LEU A 53 -13.669 8.512 -1.247 1.00 0.00 C ATOM 809 O LEU A 53 -14.202 7.468 -0.875 1.00 0.00 O ATOM 810 CB LEU A 53 -12.697 9.618 -3.271 1.00 0.00 C ATOM 811 CG LEU A 53 -11.576 9.750 -4.303 1.00 0.00 C ATOM 812 CD1 LEU A 53 -11.863 10.909 -5.243 1.00 0.00 C ATOM 813 CD2 LEU A 53 -10.234 9.939 -3.616 1.00 0.00 C ATOM 0 H LEU A 53 -12.727 7.235 -3.912 1.00 0.00 H new ATOM 0 HA LEU A 53 -11.589 8.645 -1.702 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -13.638 9.461 -3.799 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -12.787 10.562 -2.734 1.00 0.00 H new ATOM 0 HG LEU A 53 -11.532 8.831 -4.887 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -11.058 10.993 -5.973 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -12.806 10.733 -5.761 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -11.931 11.834 -4.670 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -9.450 10.031 -4.368 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -10.261 10.843 -3.008 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -10.027 9.079 -2.979 1.00 0.00 H new ATOM 825 N LYS A 54 -14.031 9.713 -0.810 1.00 0.00 N ATOM 826 CA LYS A 54 -15.114 9.910 0.148 1.00 0.00 C ATOM 827 C LYS A 54 -16.413 9.279 -0.358 1.00 0.00 C ATOM 828 O LYS A 54 -16.789 8.182 0.046 1.00 0.00 O ATOM 829 CB LYS A 54 -15.314 11.410 0.369 1.00 0.00 C ATOM 830 CG LYS A 54 -16.351 11.760 1.417 1.00 0.00 C ATOM 831 CD LYS A 54 -16.934 13.154 1.202 1.00 0.00 C ATOM 832 CE LYS A 54 -15.860 14.206 0.928 1.00 0.00 C ATOM 833 NZ LYS A 54 -15.554 14.348 -0.528 1.00 0.00 N ATOM 0 H LYS A 54 -13.582 10.578 -1.110 1.00 0.00 H new ATOM 0 HA LYS A 54 -14.849 9.426 1.088 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -14.360 11.852 0.658 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -15.603 11.868 -0.577 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -17.154 11.023 1.392 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -15.899 11.705 2.407 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -17.632 13.126 0.365 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -17.505 13.445 2.084 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -16.189 15.167 1.322 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -14.949 13.938 1.463 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -14.585 14.018 -0.713 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -16.225 13.778 -1.081 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -15.638 15.347 -0.805 1.00 0.00 H new ATOM 847 N ASN A 55 -17.076 9.990 -1.258 1.00 0.00 N ATOM 848 CA ASN A 55 -18.302 9.522 -1.898 1.00 0.00 C ATOM 849 C ASN A 55 -18.251 9.947 -3.351 1.00 0.00 C ATOM 850 O ASN A 55 -19.256 9.939 -4.061 1.00 0.00 O ATOM 851 CB ASN A 55 -19.557 10.127 -1.242 1.00 0.00 C ATOM 852 CG ASN A 55 -19.875 9.581 0.142 1.00 0.00 C ATOM 853 OD1 ASN A 55 -19.531 8.329 0.396 1.00 0.00 O flip ATOM 854 ND2 ASN A 55 -20.445 10.285 0.978 1.00 0.00 N flip ATOM 0 H ASN A 55 -16.778 10.915 -1.569 1.00 0.00 H new ATOM 0 HA ASN A 55 -18.366 8.439 -1.795 1.00 0.00 H new ATOM 0 HB2 ASN A 55 -19.429 11.207 -1.171 1.00 0.00 H new ATOM 0 HB3 ASN A 55 -20.413 9.950 -1.893 1.00 0.00 H new ATOM 0 HD21 ASN A 55 -20.696 11.247 0.749 1.00 0.00 H new ATOM 0 HD22 ASN A 55 -20.665 9.906 1.899 1.00 0.00 H new ATOM 861 N ASP A 56 -17.051 10.316 -3.767 1.00 0.00 N ATOM 862 CA ASP A 56 -16.833 10.966 -5.049 1.00 0.00 C ATOM 863 C ASP A 56 -16.694 9.940 -6.168 1.00 0.00 C ATOM 864 O ASP A 56 -17.635 9.714 -6.929 1.00 0.00 O ATOM 865 CB ASP A 56 -15.579 11.851 -4.963 1.00 0.00 C ATOM 866 CG ASP A 56 -15.630 12.815 -3.787 1.00 0.00 C ATOM 867 OD1 ASP A 56 -15.359 12.383 -2.635 1.00 0.00 O ATOM 868 OD2 ASP A 56 -15.945 14.004 -3.997 1.00 0.00 O ATOM 0 H ASP A 56 -16.199 10.173 -3.225 1.00 0.00 H new ATOM 0 HA ASP A 56 -17.698 11.588 -5.282 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -14.696 11.218 -4.873 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -15.472 12.416 -5.889 1.00 0.00 H new ATOM 873 N ASN A 57 -15.531 9.308 -6.262 1.00 0.00 N ATOM 874 CA ASN A 57 -15.296 8.305 -7.297 1.00 0.00 C ATOM 875 C ASN A 57 -14.141 7.392 -6.913 1.00 0.00 C ATOM 876 O ASN A 57 -13.479 7.609 -5.895 1.00 0.00 O ATOM 877 CB ASN A 57 -15.009 8.978 -8.651 1.00 0.00 C ATOM 878 CG ASN A 57 -13.619 9.602 -8.743 1.00 0.00 C ATOM 879 OD1 ASN A 57 -13.392 10.727 -8.296 1.00 0.00 O ATOM 880 ND2 ASN A 57 -12.681 8.881 -9.344 1.00 0.00 N ATOM 0 H ASN A 57 -14.739 9.469 -5.639 1.00 0.00 H new ATOM 0 HA ASN A 57 -16.199 7.702 -7.391 1.00 0.00 H new ATOM 0 HB2 ASN A 57 -15.119 8.239 -9.445 1.00 0.00 H new ATOM 0 HB3 ASN A 57 -15.757 9.751 -8.829 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -11.738 9.255 -9.447 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -12.903 7.952 -9.703 1.00 0.00 H new ATOM 887 N THR A 58 -13.918 6.361 -7.716 1.00 0.00 N ATOM 888 CA THR A 58 -12.794 5.465 -7.512 1.00 0.00 C ATOM 889 C THR A 58 -11.681 5.790 -8.500 1.00 0.00 C ATOM 890 O THR A 58 -11.918 5.871 -9.705 1.00 0.00 O ATOM 891 CB THR A 58 -13.214 3.993 -7.686 1.00 0.00 C ATOM 892 OG1 THR A 58 -14.396 3.732 -6.918 1.00 0.00 O ATOM 893 CG2 THR A 58 -12.099 3.054 -7.242 1.00 0.00 C ATOM 0 H THR A 58 -14.504 6.126 -8.517 1.00 0.00 H new ATOM 0 HA THR A 58 -12.436 5.606 -6.492 1.00 0.00 H new ATOM 0 HB THR A 58 -13.416 3.816 -8.742 1.00 0.00 H new ATOM 0 HG1 THR A 58 -14.661 2.795 -7.033 1.00 0.00 H new ATOM 0 HG21 THR A 58 -12.419 2.021 -7.374 1.00 0.00 H new ATOM 0 HG22 THR A 58 -11.208 3.237 -7.843 1.00 0.00 H new ATOM 0 HG23 THR A 58 -11.871 3.231 -6.191 1.00 0.00 H new ATOM 901 N VAL A 59 -10.481 5.996 -7.985 1.00 0.00 N ATOM 902 CA VAL A 59 -9.338 6.317 -8.821 1.00 0.00 C ATOM 903 C VAL A 59 -8.487 5.074 -9.045 1.00 0.00 C ATOM 904 O VAL A 59 -7.945 4.510 -8.097 1.00 0.00 O ATOM 905 CB VAL A 59 -8.458 7.409 -8.179 1.00 0.00 C ATOM 906 CG1 VAL A 59 -7.428 7.921 -9.172 1.00 0.00 C ATOM 907 CG2 VAL A 59 -9.313 8.550 -7.652 1.00 0.00 C ATOM 0 H VAL A 59 -10.273 5.946 -6.988 1.00 0.00 H new ATOM 0 HA VAL A 59 -9.723 6.687 -9.771 1.00 0.00 H new ATOM 0 HB VAL A 59 -7.927 6.966 -7.336 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -6.818 8.690 -8.699 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -6.790 7.097 -9.492 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -7.937 8.343 -10.039 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -8.671 9.308 -7.204 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -9.877 8.991 -8.474 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -10.005 8.169 -6.900 1.00 0.00 H new ATOM 917 N LEU A 60 -8.383 4.638 -10.289 1.00 0.00 N ATOM 918 CA LEU A 60 -7.586 3.464 -10.606 1.00 0.00 C ATOM 919 C LEU A 60 -6.244 3.869 -11.206 1.00 0.00 C ATOM 920 O LEU A 60 -6.174 4.423 -12.302 1.00 0.00 O ATOM 921 CB LEU A 60 -8.337 2.504 -11.545 1.00 0.00 C ATOM 922 CG LEU A 60 -8.734 3.057 -12.922 1.00 0.00 C ATOM 923 CD1 LEU A 60 -9.016 1.912 -13.884 1.00 0.00 C ATOM 924 CD2 LEU A 60 -9.958 3.958 -12.815 1.00 0.00 C ATOM 0 H LEU A 60 -8.837 5.075 -11.091 1.00 0.00 H new ATOM 0 HA LEU A 60 -7.401 2.931 -9.673 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -7.715 1.622 -11.699 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -9.243 2.171 -11.038 1.00 0.00 H new ATOM 0 HG LEU A 60 -7.903 3.650 -13.303 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -9.297 2.315 -14.857 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -8.122 1.297 -13.990 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -9.832 1.302 -13.495 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -10.219 4.337 -13.803 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -10.795 3.388 -12.412 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -9.737 4.795 -12.153 1.00 0.00 H new ATOM 936 N LEU A 61 -5.185 3.611 -10.459 1.00 0.00 N ATOM 937 CA LEU A 61 -3.838 3.921 -10.904 1.00 0.00 C ATOM 938 C LEU A 61 -3.178 2.678 -11.471 1.00 0.00 C ATOM 939 O LEU A 61 -3.476 1.563 -11.043 1.00 0.00 O ATOM 940 CB LEU A 61 -2.980 4.427 -9.741 1.00 0.00 C ATOM 941 CG LEU A 61 -3.591 5.524 -8.868 1.00 0.00 C ATOM 942 CD1 LEU A 61 -2.609 5.939 -7.789 1.00 0.00 C ATOM 943 CD2 LEU A 61 -3.999 6.717 -9.707 1.00 0.00 C ATOM 0 H LEU A 61 -5.233 3.184 -9.534 1.00 0.00 H new ATOM 0 HA LEU A 61 -3.913 4.695 -11.667 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -2.737 3.578 -9.102 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -2.040 4.799 -10.148 1.00 0.00 H new ATOM 0 HG LEU A 61 -4.487 5.127 -8.391 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -3.054 6.721 -7.173 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -2.369 5.078 -7.165 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -1.698 6.317 -8.252 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -4.431 7.484 -9.064 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -3.123 7.121 -10.215 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -4.737 6.406 -10.447 1.00 0.00 H new ATOM 955 N LYS A 62 -2.283 2.871 -12.426 1.00 0.00 N ATOM 956 CA LYS A 62 -1.441 1.791 -12.898 1.00 0.00 C ATOM 957 C LYS A 62 0.025 2.199 -12.777 1.00 0.00 C ATOM 958 O LYS A 62 0.436 3.237 -13.303 1.00 0.00 O ATOM 959 CB LYS A 62 -1.779 1.394 -14.344 1.00 0.00 C ATOM 960 CG LYS A 62 -1.557 2.493 -15.374 1.00 0.00 C ATOM 961 CD LYS A 62 -1.585 1.936 -16.786 1.00 0.00 C ATOM 962 CE LYS A 62 -1.235 3.002 -17.808 1.00 0.00 C ATOM 963 NZ LYS A 62 -1.131 2.444 -19.181 1.00 0.00 N ATOM 0 H LYS A 62 -2.123 3.766 -12.888 1.00 0.00 H new ATOM 0 HA LYS A 62 -1.626 0.915 -12.276 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -1.175 0.529 -14.620 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -2.822 1.081 -14.386 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -2.327 3.257 -15.266 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -0.598 2.979 -15.191 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -0.881 1.108 -16.866 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -2.575 1.535 -17.001 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -1.994 3.784 -17.791 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -0.289 3.470 -17.534 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -0.891 3.205 -19.848 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -0.389 1.716 -19.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -2.041 2.020 -19.453 1.00 0.00 H new ATOM 1039 N ILE A 67 5.782 -6.238 -12.975 1.00 0.00 N ATOM 1040 CA ILE A 67 6.520 -6.245 -11.708 1.00 0.00 C ATOM 1041 C ILE A 67 6.070 -7.428 -10.837 1.00 0.00 C ATOM 1042 O ILE A 67 5.453 -7.261 -9.779 1.00 0.00 O ATOM 1043 CB ILE A 67 6.389 -4.910 -10.913 1.00 0.00 C ATOM 1044 CG1 ILE A 67 6.833 -3.710 -11.762 1.00 0.00 C ATOM 1045 CG2 ILE A 67 7.218 -4.959 -9.632 1.00 0.00 C ATOM 1046 CD1 ILE A 67 5.779 -3.206 -12.726 1.00 0.00 C ATOM 0 HA ILE A 67 7.574 -6.354 -11.963 1.00 0.00 H new ATOM 0 HB ILE A 67 5.337 -4.787 -10.656 1.00 0.00 H new ATOM 0 HG12 ILE A 67 7.120 -2.895 -11.097 1.00 0.00 H new ATOM 0 HG13 ILE A 67 7.722 -3.989 -12.327 1.00 0.00 H new ATOM 0 HG21 ILE A 67 7.112 -4.017 -9.094 1.00 0.00 H new ATOM 0 HG22 ILE A 67 6.868 -5.778 -9.003 1.00 0.00 H new ATOM 0 HG23 ILE A 67 8.267 -5.117 -9.883 1.00 0.00 H new ATOM 0 HD11 ILE A 67 6.174 -2.358 -13.286 1.00 0.00 H new ATOM 0 HD12 ILE A 67 5.508 -4.003 -13.418 1.00 0.00 H new ATOM 0 HD13 ILE A 67 4.896 -2.893 -12.169 1.00 0.00 H new ATOM 1058 N VAL A 68 6.346 -8.634 -11.312 1.00 0.00 N ATOM 1059 CA VAL A 68 5.971 -9.836 -10.589 1.00 0.00 C ATOM 1060 C VAL A 68 6.960 -10.114 -9.451 1.00 0.00 C ATOM 1061 O VAL A 68 7.927 -10.862 -9.591 1.00 0.00 O ATOM 1062 CB VAL A 68 5.831 -11.060 -11.535 1.00 0.00 C ATOM 1063 CG1 VAL A 68 7.110 -11.312 -12.326 1.00 0.00 C ATOM 1064 CG2 VAL A 68 5.411 -12.302 -10.757 1.00 0.00 C ATOM 0 H VAL A 68 6.828 -8.804 -12.195 1.00 0.00 H new ATOM 0 HA VAL A 68 4.989 -9.665 -10.148 1.00 0.00 H new ATOM 0 HB VAL A 68 5.047 -10.830 -12.256 1.00 0.00 H new ATOM 0 HG11 VAL A 68 6.972 -12.176 -12.976 1.00 0.00 H new ATOM 0 HG12 VAL A 68 7.342 -10.436 -12.932 1.00 0.00 H new ATOM 0 HG13 VAL A 68 7.932 -11.504 -11.637 1.00 0.00 H new ATOM 0 HG21 VAL A 68 5.319 -13.146 -11.441 1.00 0.00 H new ATOM 0 HG22 VAL A 68 6.162 -12.528 -10.000 1.00 0.00 H new ATOM 0 HG23 VAL A 68 4.451 -12.121 -10.273 1.00 0.00 H new ATOM 1074 N SER A 69 6.735 -9.445 -8.334 1.00 0.00 N ATOM 1075 CA SER A 69 7.561 -9.631 -7.157 1.00 0.00 C ATOM 1076 C SER A 69 6.806 -10.455 -6.122 1.00 0.00 C ATOM 1077 O SER A 69 7.327 -10.763 -5.050 1.00 0.00 O ATOM 1078 CB SER A 69 7.960 -8.270 -6.575 1.00 0.00 C ATOM 1079 OG SER A 69 8.826 -8.414 -5.463 1.00 0.00 O ATOM 0 H SER A 69 5.983 -8.765 -8.219 1.00 0.00 H new ATOM 0 HA SER A 69 8.469 -10.167 -7.436 1.00 0.00 H new ATOM 0 HB2 SER A 69 8.450 -7.674 -7.345 1.00 0.00 H new ATOM 0 HB3 SER A 69 7.065 -7.726 -6.272 1.00 0.00 H new ATOM 0 HG SER A 69 8.633 -9.258 -5.005 1.00 0.00 H new ATOM 1085 N VAL A 70 5.569 -10.809 -6.460 1.00 0.00 N ATOM 1086 CA VAL A 70 4.715 -11.559 -5.555 1.00 0.00 C ATOM 1087 C VAL A 70 4.976 -13.050 -5.681 1.00 0.00 C ATOM 1088 O VAL A 70 4.992 -13.600 -6.782 1.00 0.00 O ATOM 1089 CB VAL A 70 3.213 -11.281 -5.810 1.00 0.00 C ATOM 1090 CG1 VAL A 70 2.336 -12.114 -4.879 1.00 0.00 C ATOM 1091 CG2 VAL A 70 2.910 -9.801 -5.640 1.00 0.00 C ATOM 0 H VAL A 70 5.138 -10.586 -7.357 1.00 0.00 H new ATOM 0 HA VAL A 70 4.959 -11.228 -4.546 1.00 0.00 H new ATOM 0 HB VAL A 70 2.986 -11.569 -6.837 1.00 0.00 H new ATOM 0 HG11 VAL A 70 1.286 -11.899 -5.079 1.00 0.00 H new ATOM 0 HG12 VAL A 70 2.529 -13.173 -5.049 1.00 0.00 H new ATOM 0 HG13 VAL A 70 2.566 -11.865 -3.843 1.00 0.00 H new ATOM 0 HG21 VAL A 70 1.850 -9.623 -5.823 1.00 0.00 H new ATOM 0 HG22 VAL A 70 3.160 -9.493 -4.625 1.00 0.00 H new ATOM 0 HG23 VAL A 70 3.502 -9.224 -6.350 1.00 0.00 H new ATOM 1101 N LYS A 71 5.194 -13.689 -4.550 1.00 0.00 N ATOM 1102 CA LYS A 71 5.386 -15.122 -4.508 1.00 0.00 C ATOM 1103 C LYS A 71 4.180 -15.750 -3.824 1.00 0.00 C ATOM 1104 O LYS A 71 3.576 -15.125 -2.950 1.00 0.00 O ATOM 1105 CB LYS A 71 6.673 -15.456 -3.744 1.00 0.00 C ATOM 1106 CG LYS A 71 7.308 -16.777 -4.152 1.00 0.00 C ATOM 1107 CD LYS A 71 7.765 -16.739 -5.604 1.00 0.00 C ATOM 1108 CE LYS A 71 8.490 -18.013 -6.011 1.00 0.00 C ATOM 1109 NZ LYS A 71 7.629 -19.214 -5.873 1.00 0.00 N ATOM 0 H LYS A 71 5.243 -13.232 -3.639 1.00 0.00 H new ATOM 0 HA LYS A 71 5.480 -15.519 -5.519 1.00 0.00 H new ATOM 0 HB2 LYS A 71 7.395 -14.654 -3.900 1.00 0.00 H new ATOM 0 HB3 LYS A 71 6.453 -15.484 -2.677 1.00 0.00 H new ATOM 0 HG2 LYS A 71 8.159 -16.990 -3.505 1.00 0.00 H new ATOM 0 HG3 LYS A 71 6.591 -17.587 -4.014 1.00 0.00 H new ATOM 0 HD2 LYS A 71 6.901 -16.592 -6.252 1.00 0.00 H new ATOM 0 HD3 LYS A 71 8.424 -15.884 -5.754 1.00 0.00 H new ATOM 0 HE2 LYS A 71 8.825 -17.925 -7.044 1.00 0.00 H new ATOM 0 HE3 LYS A 71 9.382 -18.134 -5.396 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 8.119 -20.040 -6.271 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 7.427 -19.383 -4.867 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 6.736 -19.062 -6.385 1.00 0.00 H new ATOM 1123 N PHE A 72 3.804 -16.956 -4.230 1.00 0.00 N ATOM 1124 CA PHE A 72 2.668 -17.630 -3.615 1.00 0.00 C ATOM 1125 C PHE A 72 3.010 -18.084 -2.200 1.00 0.00 C ATOM 1126 O PHE A 72 3.425 -19.222 -1.979 1.00 0.00 O ATOM 1127 CB PHE A 72 2.202 -18.816 -4.462 1.00 0.00 C ATOM 1128 CG PHE A 72 0.861 -18.602 -5.098 1.00 0.00 C ATOM 1129 CD1 PHE A 72 -0.300 -18.952 -4.428 1.00 0.00 C ATOM 1130 CD2 PHE A 72 0.759 -18.048 -6.364 1.00 0.00 C ATOM 1131 CE1 PHE A 72 -1.539 -18.754 -5.008 1.00 0.00 C ATOM 1132 CE2 PHE A 72 -0.477 -17.848 -6.950 1.00 0.00 C ATOM 1133 CZ PHE A 72 -1.627 -18.202 -6.270 1.00 0.00 C ATOM 0 H PHE A 72 4.263 -17.482 -4.974 1.00 0.00 H new ATOM 0 HA PHE A 72 1.848 -16.914 -3.559 1.00 0.00 H new ATOM 0 HB2 PHE A 72 2.939 -19.008 -5.241 1.00 0.00 H new ATOM 0 HB3 PHE A 72 2.161 -19.707 -3.835 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -0.236 -19.385 -3.441 1.00 0.00 H new ATOM 0 HD2 PHE A 72 1.655 -17.769 -6.899 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -2.436 -19.031 -4.475 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -0.544 -17.416 -7.938 1.00 0.00 H new ATOM 0 HZ PHE A 72 -2.594 -18.047 -6.726 1.00 0.00 H new ATOM 1143 N SER A 73 2.864 -17.163 -1.259 1.00 0.00 N ATOM 1144 CA SER A 73 3.134 -17.430 0.142 1.00 0.00 C ATOM 1145 C SER A 73 2.009 -16.856 0.998 1.00 0.00 C ATOM 1146 O SER A 73 1.224 -16.027 0.529 1.00 0.00 O ATOM 1147 CB SER A 73 4.470 -16.801 0.553 1.00 0.00 C ATOM 1148 OG SER A 73 5.497 -17.104 -0.378 1.00 0.00 O ATOM 0 H SER A 73 2.555 -16.209 -1.448 1.00 0.00 H new ATOM 0 HA SER A 73 3.191 -18.508 0.293 1.00 0.00 H new ATOM 0 HB2 SER A 73 4.355 -15.720 0.631 1.00 0.00 H new ATOM 0 HB3 SER A 73 4.755 -17.163 1.541 1.00 0.00 H new ATOM 0 HG SER A 73 6.069 -16.318 -0.501 1.00 0.00 H new ATOM 1154 N LYS A 74 1.921 -17.304 2.241 1.00 0.00 N ATOM 1155 CA LYS A 74 0.928 -16.793 3.171 1.00 0.00 C ATOM 1156 C LYS A 74 1.575 -16.566 4.533 1.00 0.00 C ATOM 1157 O LYS A 74 1.117 -17.083 5.556 1.00 0.00 O ATOM 1158 CB LYS A 74 -0.241 -17.781 3.288 1.00 0.00 C ATOM 1159 CG LYS A 74 -0.959 -18.031 1.968 1.00 0.00 C ATOM 1160 CD LYS A 74 -1.998 -19.133 2.085 1.00 0.00 C ATOM 1161 CE LYS A 74 -3.114 -18.759 3.043 1.00 0.00 C ATOM 1162 NZ LYS A 74 -4.145 -19.824 3.132 1.00 0.00 N ATOM 0 H LYS A 74 2.529 -18.024 2.630 1.00 0.00 H new ATOM 0 HA LYS A 74 0.540 -15.844 2.801 1.00 0.00 H new ATOM 0 HB2 LYS A 74 0.132 -18.729 3.675 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -0.957 -17.400 4.016 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -1.442 -17.111 1.638 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -0.230 -18.300 1.204 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -2.419 -19.341 1.101 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -1.518 -20.050 2.427 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -2.697 -18.574 4.033 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -3.579 -17.830 2.714 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -4.890 -19.531 3.796 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -4.561 -19.983 2.192 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -3.706 -20.704 3.470 1.00 0.00 H new ATOM 1176 N ASP A 75 2.642 -15.778 4.540 1.00 0.00 N ATOM 1177 CA ASP A 75 3.460 -15.620 5.735 1.00 0.00 C ATOM 1178 C ASP A 75 3.283 -14.243 6.364 1.00 0.00 C ATOM 1179 O ASP A 75 3.828 -13.248 5.883 1.00 0.00 O ATOM 1180 CB ASP A 75 4.938 -15.868 5.404 1.00 0.00 C ATOM 1181 CG ASP A 75 5.817 -15.857 6.637 1.00 0.00 C ATOM 1182 OD1 ASP A 75 5.444 -16.496 7.640 1.00 0.00 O ATOM 1183 OD2 ASP A 75 6.896 -15.225 6.607 1.00 0.00 O ATOM 0 H ASP A 75 2.961 -15.240 3.734 1.00 0.00 H new ATOM 0 HA ASP A 75 3.127 -16.360 6.463 1.00 0.00 H new ATOM 0 HB2 ASP A 75 5.038 -16.829 4.899 1.00 0.00 H new ATOM 0 HB3 ASP A 75 5.284 -15.104 4.708 1.00 0.00 H new ATOM 1188 N ARG A 76 2.508 -14.200 7.442 1.00 0.00 N ATOM 1189 CA ARG A 76 2.315 -12.982 8.221 1.00 0.00 C ATOM 1190 C ARG A 76 3.620 -12.572 8.900 1.00 0.00 C ATOM 1191 O ARG A 76 3.894 -11.384 9.091 1.00 0.00 O ATOM 1192 CB ARG A 76 1.218 -13.212 9.267 1.00 0.00 C ATOM 1193 CG ARG A 76 1.331 -12.327 10.494 1.00 0.00 C ATOM 1194 CD ARG A 76 0.283 -12.685 11.531 1.00 0.00 C ATOM 1195 NE ARG A 76 0.606 -12.132 12.846 1.00 0.00 N ATOM 1196 CZ ARG A 76 1.023 -12.866 13.878 1.00 0.00 C ATOM 1197 NH1 ARG A 76 1.159 -14.183 13.748 1.00 0.00 N ATOM 1198 NH2 ARG A 76 1.304 -12.287 15.037 1.00 0.00 N ATOM 0 H ARG A 76 1.997 -15.007 7.800 1.00 0.00 H new ATOM 0 HA ARG A 76 2.010 -12.176 7.554 1.00 0.00 H new ATOM 0 HB2 ARG A 76 0.247 -13.045 8.801 1.00 0.00 H new ATOM 0 HB3 ARG A 76 1.245 -14.255 9.582 1.00 0.00 H new ATOM 0 HG2 ARG A 76 2.325 -12.430 10.929 1.00 0.00 H new ATOM 0 HG3 ARG A 76 1.216 -11.283 10.204 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -0.689 -12.311 11.209 1.00 0.00 H new ATOM 0 HD3 ARG A 76 0.200 -13.769 11.604 1.00 0.00 H new ATOM 0 HE ARG A 76 0.506 -11.126 12.981 1.00 0.00 H new ATOM 0 HH11 ARG A 76 0.944 -14.632 12.858 1.00 0.00 H new ATOM 0 HH12 ARG A 76 1.478 -14.743 14.538 1.00 0.00 H new ATOM 0 HH21 ARG A 76 1.201 -11.278 15.141 1.00 0.00 H new ATOM 0 HH22 ARG A 76 1.623 -12.851 15.825 1.00 0.00 H new ATOM 1212 N HIS A 77 4.409 -13.577 9.257 1.00 0.00 N ATOM 1213 CA HIS A 77 5.705 -13.386 9.897 1.00 0.00 C ATOM 1214 C HIS A 77 6.580 -12.394 9.121 1.00 0.00 C ATOM 1215 O HIS A 77 7.057 -11.411 9.688 1.00 0.00 O ATOM 1216 CB HIS A 77 6.383 -14.761 10.049 1.00 0.00 C ATOM 1217 CG HIS A 77 7.879 -14.766 9.962 1.00 0.00 C ATOM 1218 ND1 HIS A 77 8.550 -15.045 8.792 1.00 0.00 N ATOM 1219 CD2 HIS A 77 8.832 -14.557 10.898 1.00 0.00 C ATOM 1220 CE1 HIS A 77 9.849 -15.008 9.012 1.00 0.00 C ATOM 1221 NE2 HIS A 77 10.051 -14.713 10.284 1.00 0.00 N ATOM 0 H HIS A 77 4.166 -14.556 9.109 1.00 0.00 H new ATOM 0 HA HIS A 77 5.563 -12.947 10.884 1.00 0.00 H new ATOM 0 HB2 HIS A 77 6.093 -15.183 11.011 1.00 0.00 H new ATOM 0 HB3 HIS A 77 5.991 -15.425 9.278 1.00 0.00 H new ATOM 0 HD1 HIS A 77 8.110 -15.249 7.895 1.00 0.00 H new ATOM 0 HD2 HIS A 77 8.666 -14.313 11.937 1.00 0.00 H new ATOM 0 HE1 HIS A 77 10.619 -15.188 8.276 1.00 0.00 H new ATOM 1230 N LEU A 78 6.773 -12.641 7.827 1.00 0.00 N ATOM 1231 CA LEU A 78 7.619 -11.778 7.008 1.00 0.00 C ATOM 1232 C LEU A 78 7.026 -10.374 6.903 1.00 0.00 C ATOM 1233 O LEU A 78 7.759 -9.387 6.885 1.00 0.00 O ATOM 1234 CB LEU A 78 7.809 -12.375 5.608 1.00 0.00 C ATOM 1235 CG LEU A 78 8.794 -11.626 4.704 1.00 0.00 C ATOM 1236 CD1 LEU A 78 10.174 -11.578 5.341 1.00 0.00 C ATOM 1237 CD2 LEU A 78 8.864 -12.289 3.336 1.00 0.00 C ATOM 0 H LEU A 78 6.358 -13.427 7.326 1.00 0.00 H new ATOM 0 HA LEU A 78 8.593 -11.707 7.493 1.00 0.00 H new ATOM 0 HB2 LEU A 78 8.150 -13.405 5.714 1.00 0.00 H new ATOM 0 HB3 LEU A 78 6.839 -12.409 5.111 1.00 0.00 H new ATOM 0 HG LEU A 78 8.438 -10.603 4.578 1.00 0.00 H new ATOM 0 HD11 LEU A 78 10.859 -11.042 4.684 1.00 0.00 H new ATOM 0 HD12 LEU A 78 10.114 -11.064 6.300 1.00 0.00 H new ATOM 0 HD13 LEU A 78 10.539 -12.593 5.496 1.00 0.00 H new ATOM 0 HD21 LEU A 78 9.567 -11.746 2.704 1.00 0.00 H new ATOM 0 HD22 LEU A 78 9.198 -13.320 3.448 1.00 0.00 H new ATOM 0 HD23 LEU A 78 7.877 -12.276 2.874 1.00 0.00 H new ATOM 1249 N ILE A 79 5.700 -10.298 6.846 1.00 0.00 N ATOM 1250 CA ILE A 79 4.997 -9.017 6.783 1.00 0.00 C ATOM 1251 C ILE A 79 5.358 -8.150 7.987 1.00 0.00 C ATOM 1252 O ILE A 79 5.832 -7.023 7.838 1.00 0.00 O ATOM 1253 CB ILE A 79 3.467 -9.219 6.755 1.00 0.00 C ATOM 1254 CG1 ILE A 79 3.064 -10.108 5.574 1.00 0.00 C ATOM 1255 CG2 ILE A 79 2.750 -7.875 6.678 1.00 0.00 C ATOM 1256 CD1 ILE A 79 1.585 -10.432 5.536 1.00 0.00 C ATOM 0 H ILE A 79 5.086 -11.112 6.842 1.00 0.00 H new ATOM 0 HA ILE A 79 5.307 -8.521 5.863 1.00 0.00 H new ATOM 0 HB ILE A 79 3.170 -9.716 7.679 1.00 0.00 H new ATOM 0 HG12 ILE A 79 3.343 -9.611 4.645 1.00 0.00 H new ATOM 0 HG13 ILE A 79 3.630 -11.038 5.620 1.00 0.00 H new ATOM 0 HG21 ILE A 79 1.672 -8.038 6.659 1.00 0.00 H new ATOM 0 HG22 ILE A 79 3.011 -7.273 7.549 1.00 0.00 H new ATOM 0 HG23 ILE A 79 3.054 -7.352 5.771 1.00 0.00 H new ATOM 0 HD11 ILE A 79 1.373 -11.064 4.674 1.00 0.00 H new ATOM 0 HD12 ILE A 79 1.304 -10.957 6.449 1.00 0.00 H new ATOM 0 HD13 ILE A 79 1.012 -9.508 5.458 1.00 0.00 H new ATOM 1268 N GLU A 80 5.153 -8.704 9.178 1.00 0.00 N ATOM 1269 CA GLU A 80 5.398 -7.980 10.420 1.00 0.00 C ATOM 1270 C GLU A 80 6.872 -7.617 10.567 1.00 0.00 C ATOM 1271 O GLU A 80 7.208 -6.475 10.889 1.00 0.00 O ATOM 1272 CB GLU A 80 4.934 -8.821 11.607 1.00 0.00 C ATOM 1273 CG GLU A 80 5.159 -8.158 12.954 1.00 0.00 C ATOM 1274 CD GLU A 80 4.655 -9.002 14.100 1.00 0.00 C ATOM 1275 OE1 GLU A 80 5.144 -10.141 14.260 1.00 0.00 O ATOM 1276 OE2 GLU A 80 3.773 -8.530 14.847 1.00 0.00 O ATOM 0 H GLU A 80 4.816 -9.658 9.309 1.00 0.00 H new ATOM 0 HA GLU A 80 4.830 -7.050 10.395 1.00 0.00 H new ATOM 0 HB2 GLU A 80 3.872 -9.039 11.493 1.00 0.00 H new ATOM 0 HB3 GLU A 80 5.459 -9.776 11.591 1.00 0.00 H new ATOM 0 HG2 GLU A 80 6.223 -7.965 13.088 1.00 0.00 H new ATOM 0 HG3 GLU A 80 4.656 -7.191 12.969 1.00 0.00 H new ATOM 1283 N THR A 81 7.749 -8.580 10.312 1.00 0.00 N ATOM 1284 CA THR A 81 9.184 -8.357 10.413 1.00 0.00 C ATOM 1285 C THR A 81 9.630 -7.234 9.470 1.00 0.00 C ATOM 1286 O THR A 81 10.481 -6.411 9.819 1.00 0.00 O ATOM 1287 CB THR A 81 9.963 -9.656 10.111 1.00 0.00 C ATOM 1288 OG1 THR A 81 9.530 -10.697 11.000 1.00 0.00 O ATOM 1289 CG2 THR A 81 11.461 -9.453 10.270 1.00 0.00 C ATOM 0 H THR A 81 7.489 -9.526 10.033 1.00 0.00 H new ATOM 0 HA THR A 81 9.405 -8.053 11.436 1.00 0.00 H new ATOM 0 HB THR A 81 9.761 -9.937 9.077 1.00 0.00 H new ATOM 0 HG1 THR A 81 8.674 -11.058 10.688 1.00 0.00 H new ATOM 0 HG21 THR A 81 11.980 -10.386 10.050 1.00 0.00 H new ATOM 0 HG22 THR A 81 11.798 -8.679 9.581 1.00 0.00 H new ATOM 0 HG23 THR A 81 11.680 -9.148 11.293 1.00 0.00 H new ATOM 1297 N THR A 82 9.029 -7.181 8.288 1.00 0.00 N ATOM 1298 CA THR A 82 9.351 -6.143 7.320 1.00 0.00 C ATOM 1299 C THR A 82 8.796 -4.784 7.758 1.00 0.00 C ATOM 1300 O THR A 82 9.463 -3.758 7.604 1.00 0.00 O ATOM 1301 CB THR A 82 8.821 -6.512 5.921 1.00 0.00 C ATOM 1302 OG1 THR A 82 9.380 -7.771 5.524 1.00 0.00 O ATOM 1303 CG2 THR A 82 9.177 -5.449 4.891 1.00 0.00 C ATOM 0 H THR A 82 8.318 -7.843 7.978 1.00 0.00 H new ATOM 0 HA THR A 82 10.437 -6.066 7.270 1.00 0.00 H new ATOM 0 HB THR A 82 7.734 -6.579 5.972 1.00 0.00 H new ATOM 0 HG1 THR A 82 8.729 -8.485 5.690 1.00 0.00 H new ATOM 0 HG21 THR A 82 8.788 -5.742 3.916 1.00 0.00 H new ATOM 0 HG22 THR A 82 8.738 -4.496 5.185 1.00 0.00 H new ATOM 0 HG23 THR A 82 10.261 -5.347 4.833 1.00 0.00 H new ATOM 1311 N SER A 83 7.592 -4.782 8.327 1.00 0.00 N ATOM 1312 CA SER A 83 6.996 -3.554 8.847 1.00 0.00 C ATOM 1313 C SER A 83 7.861 -2.994 9.971 1.00 0.00 C ATOM 1314 O SER A 83 8.098 -1.788 10.050 1.00 0.00 O ATOM 1315 CB SER A 83 5.567 -3.813 9.342 1.00 0.00 C ATOM 1316 OG SER A 83 4.901 -2.597 9.651 1.00 0.00 O ATOM 0 H SER A 83 7.012 -5.614 8.439 1.00 0.00 H new ATOM 0 HA SER A 83 6.946 -2.820 8.043 1.00 0.00 H new ATOM 0 HB2 SER A 83 5.007 -4.353 8.578 1.00 0.00 H new ATOM 0 HB3 SER A 83 5.596 -4.450 10.226 1.00 0.00 H new ATOM 0 HG SER A 83 4.134 -2.783 10.231 1.00 0.00 H new ATOM 1322 N ASN A 84 8.370 -3.889 10.811 1.00 0.00 N ATOM 1323 CA ASN A 84 9.228 -3.501 11.923 1.00 0.00 C ATOM 1324 C ASN A 84 10.536 -2.898 11.420 1.00 0.00 C ATOM 1325 O ASN A 84 11.095 -2.005 12.051 1.00 0.00 O ATOM 1326 CB ASN A 84 9.508 -4.705 12.828 1.00 0.00 C ATOM 1327 CG ASN A 84 10.359 -4.349 14.034 1.00 0.00 C ATOM 1328 OD1 ASN A 84 9.847 -3.890 15.056 1.00 0.00 O ATOM 1329 ND2 ASN A 84 11.658 -4.583 13.939 1.00 0.00 N ATOM 0 H ASN A 84 8.202 -4.893 10.741 1.00 0.00 H new ATOM 0 HA ASN A 84 8.706 -2.741 12.504 1.00 0.00 H new ATOM 0 HB2 ASN A 84 8.562 -5.126 13.168 1.00 0.00 H new ATOM 0 HB3 ASN A 84 10.012 -5.479 12.249 1.00 0.00 H new ATOM 0 HD21 ASN A 84 12.271 -4.383 14.729 1.00 0.00 H new ATOM 0 HD22 ASN A 84 12.046 -4.964 13.076 1.00 0.00 H new ATOM 1336 N LYS A 85 11.016 -3.377 10.271 1.00 0.00 N ATOM 1337 CA LYS A 85 12.245 -2.851 9.679 1.00 0.00 C ATOM 1338 C LYS A 85 12.050 -1.397 9.262 1.00 0.00 C ATOM 1339 O LYS A 85 12.895 -0.539 9.533 1.00 0.00 O ATOM 1340 CB LYS A 85 12.667 -3.674 8.456 1.00 0.00 C ATOM 1341 CG LYS A 85 14.036 -3.285 7.916 1.00 0.00 C ATOM 1342 CD LYS A 85 14.234 -3.712 6.468 1.00 0.00 C ATOM 1343 CE LYS A 85 14.094 -5.210 6.280 1.00 0.00 C ATOM 1344 NZ LYS A 85 14.420 -5.616 4.888 1.00 0.00 N ATOM 0 H LYS A 85 10.575 -4.124 9.735 1.00 0.00 H new ATOM 0 HA LYS A 85 13.030 -2.915 10.433 1.00 0.00 H new ATOM 0 HB2 LYS A 85 12.675 -4.731 8.722 1.00 0.00 H new ATOM 0 HB3 LYS A 85 11.924 -3.550 7.668 1.00 0.00 H new ATOM 0 HG2 LYS A 85 14.160 -2.205 7.993 1.00 0.00 H new ATOM 0 HG3 LYS A 85 14.810 -3.740 8.535 1.00 0.00 H new ATOM 0 HD2 LYS A 85 13.506 -3.200 5.839 1.00 0.00 H new ATOM 0 HD3 LYS A 85 15.222 -3.398 6.132 1.00 0.00 H new ATOM 0 HE2 LYS A 85 14.754 -5.728 6.976 1.00 0.00 H new ATOM 0 HE3 LYS A 85 13.075 -5.514 6.520 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 14.123 -6.601 4.735 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 13.920 -4.996 4.219 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 15.445 -5.536 4.734 1.00 0.00 H new ATOM 1358 N LEU A 86 10.928 -1.137 8.602 1.00 0.00 N ATOM 1359 CA LEU A 86 10.578 0.209 8.161 1.00 0.00 C ATOM 1360 C LEU A 86 10.294 1.097 9.367 1.00 0.00 C ATOM 1361 O LEU A 86 10.673 2.267 9.403 1.00 0.00 O ATOM 1362 CB LEU A 86 9.351 0.154 7.246 1.00 0.00 C ATOM 1363 CG LEU A 86 8.851 1.506 6.730 1.00 0.00 C ATOM 1364 CD1 LEU A 86 9.900 2.161 5.848 1.00 0.00 C ATOM 1365 CD2 LEU A 86 7.542 1.335 5.969 1.00 0.00 C ATOM 0 H LEU A 86 10.238 -1.848 8.358 1.00 0.00 H new ATOM 0 HA LEU A 86 11.416 0.630 7.605 1.00 0.00 H new ATOM 0 HB2 LEU A 86 9.587 -0.477 6.389 1.00 0.00 H new ATOM 0 HB3 LEU A 86 8.538 -0.332 7.786 1.00 0.00 H new ATOM 0 HG LEU A 86 8.669 2.156 7.586 1.00 0.00 H new ATOM 0 HD11 LEU A 86 9.527 3.121 5.491 1.00 0.00 H new ATOM 0 HD12 LEU A 86 10.813 2.318 6.423 1.00 0.00 H new ATOM 0 HD13 LEU A 86 10.114 1.515 4.997 1.00 0.00 H new ATOM 0 HD21 LEU A 86 7.201 2.306 5.609 1.00 0.00 H new ATOM 0 HD22 LEU A 86 7.699 0.668 5.121 1.00 0.00 H new ATOM 0 HD23 LEU A 86 6.789 0.908 6.632 1.00 0.00 H new ATOM 1377 N LYS A 87 9.633 0.517 10.355 1.00 0.00 N ATOM 1378 CA LYS A 87 9.280 1.216 11.585 1.00 0.00 C ATOM 1379 C LYS A 87 10.529 1.534 12.410 1.00 0.00 C ATOM 1380 O LYS A 87 10.517 2.432 13.253 1.00 0.00 O ATOM 1381 CB LYS A 87 8.314 0.339 12.388 1.00 0.00 C ATOM 1382 CG LYS A 87 7.589 1.047 13.521 1.00 0.00 C ATOM 1383 CD LYS A 87 6.581 0.116 14.177 1.00 0.00 C ATOM 1384 CE LYS A 87 5.704 0.842 15.185 1.00 0.00 C ATOM 1385 NZ LYS A 87 4.674 -0.058 15.765 1.00 0.00 N ATOM 0 H LYS A 87 9.324 -0.455 10.329 1.00 0.00 H new ATOM 0 HA LYS A 87 8.800 2.163 11.338 1.00 0.00 H new ATOM 0 HB2 LYS A 87 7.572 -0.076 11.706 1.00 0.00 H new ATOM 0 HB3 LYS A 87 8.870 -0.501 12.803 1.00 0.00 H new ATOM 0 HG2 LYS A 87 8.310 1.391 14.262 1.00 0.00 H new ATOM 0 HG3 LYS A 87 7.080 1.931 13.138 1.00 0.00 H new ATOM 0 HD2 LYS A 87 5.953 -0.336 13.410 1.00 0.00 H new ATOM 0 HD3 LYS A 87 7.109 -0.697 14.676 1.00 0.00 H new ATOM 0 HE2 LYS A 87 6.326 1.246 15.984 1.00 0.00 H new ATOM 0 HE3 LYS A 87 5.217 1.688 14.701 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 4.095 0.471 16.448 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 4.065 -0.424 15.005 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 5.140 -0.852 16.249 1.00 0.00 H new ATOM 1399 N SER A 88 11.600 0.800 12.146 1.00 0.00 N ATOM 1400 CA SER A 88 12.843 0.958 12.881 1.00 0.00 C ATOM 1401 C SER A 88 13.780 1.946 12.185 1.00 0.00 C ATOM 1402 O SER A 88 14.139 2.972 12.763 1.00 0.00 O ATOM 1403 CB SER A 88 13.536 -0.401 13.053 1.00 0.00 C ATOM 1404 OG SER A 88 14.761 -0.277 13.755 1.00 0.00 O ATOM 0 H SER A 88 11.631 0.083 11.421 1.00 0.00 H new ATOM 0 HA SER A 88 12.602 1.361 13.865 1.00 0.00 H new ATOM 0 HB2 SER A 88 12.875 -1.081 13.590 1.00 0.00 H new ATOM 0 HB3 SER A 88 13.720 -0.843 12.074 1.00 0.00 H new ATOM 0 HG SER A 88 15.175 -1.160 13.849 1.00 0.00 H new ATOM 1410 N ARG A 89 14.168 1.653 10.942 1.00 0.00 N ATOM 1411 CA ARG A 89 15.182 2.464 10.277 1.00 0.00 C ATOM 1412 C ARG A 89 14.571 3.467 9.303 1.00 0.00 C ATOM 1413 O ARG A 89 14.361 4.627 9.659 1.00 0.00 O ATOM 1414 CB ARG A 89 16.165 1.563 9.524 1.00 0.00 C ATOM 1415 CG ARG A 89 16.890 0.569 10.413 1.00 0.00 C ATOM 1416 CD ARG A 89 17.787 -0.351 9.599 1.00 0.00 C ATOM 1417 NE ARG A 89 18.430 -1.361 10.435 1.00 0.00 N ATOM 1418 CZ ARG A 89 18.560 -2.644 10.091 1.00 0.00 C ATOM 1419 NH1 ARG A 89 18.166 -3.061 8.894 1.00 0.00 N ATOM 1420 NH2 ARG A 89 19.118 -3.505 10.930 1.00 0.00 N ATOM 0 H ARG A 89 13.804 0.878 10.388 1.00 0.00 H new ATOM 0 HA ARG A 89 15.704 3.024 11.053 1.00 0.00 H new ATOM 0 HB2 ARG A 89 15.624 1.017 8.751 1.00 0.00 H new ATOM 0 HB3 ARG A 89 16.901 2.188 9.018 1.00 0.00 H new ATOM 0 HG2 ARG A 89 17.489 1.106 11.149 1.00 0.00 H new ATOM 0 HG3 ARG A 89 16.163 -0.025 10.966 1.00 0.00 H new ATOM 0 HD2 ARG A 89 17.197 -0.842 8.825 1.00 0.00 H new ATOM 0 HD3 ARG A 89 18.550 0.240 9.092 1.00 0.00 H new ATOM 0 HE ARG A 89 18.803 -1.068 11.338 1.00 0.00 H new ATOM 0 HH11 ARG A 89 17.761 -2.400 8.231 1.00 0.00 H new ATOM 0 HH12 ARG A 89 18.268 -4.043 8.637 1.00 0.00 H new ATOM 0 HH21 ARG A 89 19.449 -3.188 11.841 1.00 0.00 H new ATOM 0 HH22 ARG A 89 19.216 -4.485 10.665 1.00 0.00 H new ATOM 1434 N GLU A 90 14.235 2.994 8.095 1.00 0.00 N ATOM 1435 CA GLU A 90 13.716 3.854 7.019 1.00 0.00 C ATOM 1436 C GLU A 90 13.631 3.093 5.697 1.00 0.00 C ATOM 1437 O GLU A 90 12.620 3.175 5.005 1.00 0.00 O ATOM 1438 CB GLU A 90 14.562 5.139 6.845 1.00 0.00 C ATOM 1439 CG GLU A 90 16.075 4.959 6.979 1.00 0.00 C ATOM 1440 CD GLU A 90 16.761 4.478 5.716 1.00 0.00 C ATOM 1441 OE1 GLU A 90 16.828 5.251 4.739 1.00 0.00 O ATOM 1442 OE2 GLU A 90 17.262 3.331 5.702 1.00 0.00 O ATOM 0 H GLU A 90 14.314 2.011 7.836 1.00 0.00 H new ATOM 0 HA GLU A 90 12.711 4.155 7.313 1.00 0.00 H new ATOM 0 HB2 GLU A 90 14.350 5.561 5.863 1.00 0.00 H new ATOM 0 HB3 GLU A 90 14.235 5.871 7.584 1.00 0.00 H new ATOM 0 HG2 GLU A 90 16.517 5.909 7.279 1.00 0.00 H new ATOM 0 HG3 GLU A 90 16.275 4.248 7.780 1.00 0.00 H new ATOM 1449 N ILE A 91 14.698 2.353 5.374 1.00 0.00 N ATOM 1450 CA ILE A 91 14.817 1.592 4.121 1.00 0.00 C ATOM 1451 C ILE A 91 14.200 2.328 2.926 1.00 0.00 C ATOM 1452 O ILE A 91 14.596 3.452 2.616 1.00 0.00 O ATOM 1453 CB ILE A 91 14.249 0.149 4.233 1.00 0.00 C ATOM 1454 CG1 ILE A 91 12.822 0.133 4.799 1.00 0.00 C ATOM 1455 CG2 ILE A 91 15.172 -0.695 5.097 1.00 0.00 C ATOM 1456 CD1 ILE A 91 12.165 -1.230 4.753 1.00 0.00 C ATOM 0 H ILE A 91 15.513 2.264 5.981 1.00 0.00 H new ATOM 0 HA ILE A 91 15.888 1.504 3.939 1.00 0.00 H new ATOM 0 HB ILE A 91 14.199 -0.272 3.229 1.00 0.00 H new ATOM 0 HG12 ILE A 91 12.846 0.480 5.832 1.00 0.00 H new ATOM 0 HG13 ILE A 91 12.210 0.841 4.239 1.00 0.00 H new ATOM 0 HG21 ILE A 91 14.773 -1.706 5.175 1.00 0.00 H new ATOM 0 HG22 ILE A 91 16.163 -0.730 4.645 1.00 0.00 H new ATOM 0 HG23 ILE A 91 15.242 -0.255 6.092 1.00 0.00 H new ATOM 0 HD11 ILE A 91 11.160 -1.164 5.169 1.00 0.00 H new ATOM 0 HD12 ILE A 91 12.108 -1.572 3.720 1.00 0.00 H new ATOM 0 HD13 ILE A 91 12.754 -1.938 5.337 1.00 0.00 H new ATOM 1468 N THR A 92 13.251 1.694 2.255 1.00 0.00 N ATOM 1469 CA THR A 92 12.541 2.306 1.146 1.00 0.00 C ATOM 1470 C THR A 92 11.186 1.645 0.969 1.00 0.00 C ATOM 1471 O THR A 92 11.000 0.488 1.357 1.00 0.00 O ATOM 1472 CB THR A 92 13.330 2.203 -0.175 1.00 0.00 C ATOM 1473 OG1 THR A 92 14.297 1.150 -0.087 1.00 0.00 O ATOM 1474 CG2 THR A 92 14.013 3.520 -0.517 1.00 0.00 C ATOM 0 H THR A 92 12.952 0.741 2.465 1.00 0.00 H new ATOM 0 HA THR A 92 12.418 3.362 1.386 1.00 0.00 H new ATOM 0 HB THR A 92 12.624 1.976 -0.974 1.00 0.00 H new ATOM 0 HG1 THR A 92 14.793 1.090 -0.930 1.00 0.00 H new ATOM 0 HG21 THR A 92 14.560 3.414 -1.454 1.00 0.00 H new ATOM 0 HG22 THR A 92 13.262 4.303 -0.623 1.00 0.00 H new ATOM 0 HG23 THR A 92 14.706 3.788 0.280 1.00 0.00 H new ATOM 1482 N PHE A 93 10.247 2.374 0.378 1.00 0.00 N ATOM 1483 CA PHE A 93 8.906 1.856 0.134 1.00 0.00 C ATOM 1484 C PHE A 93 8.968 0.651 -0.805 1.00 0.00 C ATOM 1485 O PHE A 93 8.195 -0.295 -0.672 1.00 0.00 O ATOM 1486 CB PHE A 93 8.023 2.953 -0.472 1.00 0.00 C ATOM 1487 CG PHE A 93 6.582 2.561 -0.654 1.00 0.00 C ATOM 1488 CD1 PHE A 93 5.681 2.689 0.391 1.00 0.00 C ATOM 1489 CD2 PHE A 93 6.130 2.075 -1.871 1.00 0.00 C ATOM 1490 CE1 PHE A 93 4.356 2.338 0.224 1.00 0.00 C ATOM 1491 CE2 PHE A 93 4.805 1.722 -2.041 1.00 0.00 C ATOM 1492 CZ PHE A 93 3.916 1.853 -0.993 1.00 0.00 C ATOM 0 H PHE A 93 10.391 3.331 0.057 1.00 0.00 H new ATOM 0 HA PHE A 93 8.473 1.538 1.082 1.00 0.00 H new ATOM 0 HB2 PHE A 93 8.069 3.834 0.168 1.00 0.00 H new ATOM 0 HB3 PHE A 93 8.434 3.240 -1.440 1.00 0.00 H new ATOM 0 HD1 PHE A 93 6.018 3.067 1.345 1.00 0.00 H new ATOM 0 HD2 PHE A 93 6.821 1.971 -2.695 1.00 0.00 H new ATOM 0 HE1 PHE A 93 3.663 2.443 1.045 1.00 0.00 H new ATOM 0 HE2 PHE A 93 4.465 1.344 -2.994 1.00 0.00 H new ATOM 0 HZ PHE A 93 2.880 1.577 -1.124 1.00 0.00 H new ATOM 1502 N GLN A 94 9.905 0.696 -1.744 1.00 0.00 N ATOM 1503 CA GLN A 94 10.078 -0.385 -2.708 1.00 0.00 C ATOM 1504 C GLN A 94 10.600 -1.643 -2.016 1.00 0.00 C ATOM 1505 O GLN A 94 10.157 -2.755 -2.312 1.00 0.00 O ATOM 1506 CB GLN A 94 11.034 0.045 -3.820 1.00 0.00 C ATOM 1507 CG GLN A 94 11.118 -0.939 -4.973 1.00 0.00 C ATOM 1508 CD GLN A 94 12.062 -0.471 -6.057 1.00 0.00 C ATOM 1509 OE1 GLN A 94 11.660 0.224 -6.991 1.00 0.00 O ATOM 1510 NE2 GLN A 94 13.323 -0.852 -5.941 1.00 0.00 N ATOM 0 H GLN A 94 10.558 1.471 -1.859 1.00 0.00 H new ATOM 0 HA GLN A 94 9.108 -0.613 -3.150 1.00 0.00 H new ATOM 0 HB2 GLN A 94 10.716 1.014 -4.205 1.00 0.00 H new ATOM 0 HB3 GLN A 94 12.030 0.181 -3.398 1.00 0.00 H new ATOM 0 HG2 GLN A 94 11.450 -1.907 -4.598 1.00 0.00 H new ATOM 0 HG3 GLN A 94 10.124 -1.085 -5.397 1.00 0.00 H new ATOM 0 HE21 GLN A 94 13.611 -1.428 -5.150 1.00 0.00 H new ATOM 0 HE22 GLN A 94 14.008 -0.570 -6.643 1.00 0.00 H new ATOM 1519 N GLU A 95 11.535 -1.452 -1.088 1.00 0.00 N ATOM 1520 CA GLU A 95 12.072 -2.546 -0.282 1.00 0.00 C ATOM 1521 C GLU A 95 10.940 -3.157 0.537 1.00 0.00 C ATOM 1522 O GLU A 95 10.731 -4.370 0.539 1.00 0.00 O ATOM 1523 CB GLU A 95 13.170 -2.010 0.649 1.00 0.00 C ATOM 1524 CG GLU A 95 14.324 -2.971 0.908 1.00 0.00 C ATOM 1525 CD GLU A 95 13.931 -4.205 1.693 1.00 0.00 C ATOM 1526 OE1 GLU A 95 13.533 -4.078 2.871 1.00 0.00 O ATOM 1527 OE2 GLU A 95 14.056 -5.320 1.146 1.00 0.00 O ATOM 0 H GLU A 95 11.940 -0.540 -0.874 1.00 0.00 H new ATOM 0 HA GLU A 95 12.504 -3.309 -0.929 1.00 0.00 H new ATOM 0 HB2 GLU A 95 13.572 -1.092 0.221 1.00 0.00 H new ATOM 0 HB3 GLU A 95 12.717 -1.745 1.604 1.00 0.00 H new ATOM 0 HG2 GLU A 95 14.748 -3.280 -0.047 1.00 0.00 H new ATOM 0 HG3 GLU A 95 15.109 -2.443 1.449 1.00 0.00 H new ATOM 1534 N TYR A 96 10.191 -2.283 1.199 1.00 0.00 N ATOM 1535 CA TYR A 96 9.042 -2.679 1.999 1.00 0.00 C ATOM 1536 C TYR A 96 8.036 -3.467 1.157 1.00 0.00 C ATOM 1537 O TYR A 96 7.561 -4.528 1.566 1.00 0.00 O ATOM 1538 CB TYR A 96 8.383 -1.429 2.594 1.00 0.00 C ATOM 1539 CG TYR A 96 7.226 -1.719 3.518 1.00 0.00 C ATOM 1540 CD1 TYR A 96 7.415 -2.443 4.683 1.00 0.00 C ATOM 1541 CD2 TYR A 96 5.949 -1.257 3.231 1.00 0.00 C ATOM 1542 CE1 TYR A 96 6.367 -2.702 5.539 1.00 0.00 C ATOM 1543 CE2 TYR A 96 4.892 -1.512 4.083 1.00 0.00 C ATOM 1544 CZ TYR A 96 5.107 -2.237 5.236 1.00 0.00 C ATOM 1545 OH TYR A 96 4.064 -2.486 6.096 1.00 0.00 O ATOM 0 H TYR A 96 10.365 -1.278 1.195 1.00 0.00 H new ATOM 0 HA TYR A 96 9.379 -3.328 2.807 1.00 0.00 H new ATOM 0 HB2 TYR A 96 9.136 -0.860 3.140 1.00 0.00 H new ATOM 0 HB3 TYR A 96 8.033 -0.794 1.780 1.00 0.00 H new ATOM 0 HD1 TYR A 96 8.401 -2.811 4.925 1.00 0.00 H new ATOM 0 HD2 TYR A 96 5.779 -0.690 2.328 1.00 0.00 H new ATOM 0 HE1 TYR A 96 6.533 -3.267 6.444 1.00 0.00 H new ATOM 0 HE2 TYR A 96 3.904 -1.146 3.848 1.00 0.00 H new ATOM 0 HH TYR A 96 3.228 -2.544 5.588 1.00 0.00 H new ATOM 1555 N ARG A 97 7.744 -2.946 -0.029 1.00 0.00 N ATOM 1556 CA ARG A 97 6.766 -3.554 -0.927 1.00 0.00 C ATOM 1557 C ARG A 97 7.244 -4.916 -1.432 1.00 0.00 C ATOM 1558 O ARG A 97 6.456 -5.853 -1.555 1.00 0.00 O ATOM 1559 CB ARG A 97 6.505 -2.617 -2.115 1.00 0.00 C ATOM 1560 CG ARG A 97 5.385 -3.079 -3.036 1.00 0.00 C ATOM 1561 CD ARG A 97 5.286 -2.212 -4.286 1.00 0.00 C ATOM 1562 NE ARG A 97 6.422 -2.413 -5.194 1.00 0.00 N ATOM 1563 CZ ARG A 97 6.377 -2.180 -6.511 1.00 0.00 C ATOM 1564 NH1 ARG A 97 5.282 -1.676 -7.061 1.00 0.00 N ATOM 1565 NH2 ARG A 97 7.435 -2.433 -7.275 1.00 0.00 N ATOM 0 H ARG A 97 8.174 -2.096 -0.395 1.00 0.00 H new ATOM 0 HA ARG A 97 5.842 -3.709 -0.370 1.00 0.00 H new ATOM 0 HB2 ARG A 97 6.262 -1.625 -1.735 1.00 0.00 H new ATOM 0 HB3 ARG A 97 7.422 -2.520 -2.696 1.00 0.00 H new ATOM 0 HG2 ARG A 97 5.557 -4.116 -3.325 1.00 0.00 H new ATOM 0 HG3 ARG A 97 4.437 -3.051 -2.498 1.00 0.00 H new ATOM 0 HD2 ARG A 97 4.359 -2.440 -4.811 1.00 0.00 H new ATOM 0 HD3 ARG A 97 5.237 -1.163 -3.995 1.00 0.00 H new ATOM 0 HE ARG A 97 7.299 -2.751 -4.797 1.00 0.00 H new ATOM 0 HH11 ARG A 97 4.471 -1.465 -6.480 1.00 0.00 H new ATOM 0 HH12 ARG A 97 5.251 -1.499 -8.065 1.00 0.00 H new ATOM 0 HH21 ARG A 97 8.287 -2.807 -6.858 1.00 0.00 H new ATOM 0 HH22 ARG A 97 7.394 -2.253 -8.278 1.00 0.00 H new ATOM 1579 N ARG A 98 8.538 -5.015 -1.719 1.00 0.00 N ATOM 1580 CA ARG A 98 9.118 -6.244 -2.251 1.00 0.00 C ATOM 1581 C ARG A 98 8.951 -7.408 -1.276 1.00 0.00 C ATOM 1582 O ARG A 98 8.537 -8.500 -1.666 1.00 0.00 O ATOM 1583 CB ARG A 98 10.602 -6.035 -2.581 1.00 0.00 C ATOM 1584 CG ARG A 98 11.304 -7.297 -3.056 1.00 0.00 C ATOM 1585 CD ARG A 98 12.741 -7.030 -3.481 1.00 0.00 C ATOM 1586 NE ARG A 98 12.827 -6.207 -4.689 1.00 0.00 N ATOM 1587 CZ ARG A 98 12.938 -6.705 -5.924 1.00 0.00 C ATOM 1588 NH1 ARG A 98 12.960 -8.023 -6.117 1.00 0.00 N ATOM 1589 NH2 ARG A 98 13.050 -5.883 -6.964 1.00 0.00 N ATOM 0 H ARG A 98 9.207 -4.256 -1.592 1.00 0.00 H new ATOM 0 HA ARG A 98 8.583 -6.495 -3.167 1.00 0.00 H new ATOM 0 HB2 ARG A 98 10.690 -5.269 -3.351 1.00 0.00 H new ATOM 0 HB3 ARG A 98 11.113 -5.657 -1.695 1.00 0.00 H new ATOM 0 HG2 ARG A 98 11.295 -8.038 -2.257 1.00 0.00 H new ATOM 0 HG3 ARG A 98 10.753 -7.724 -3.894 1.00 0.00 H new ATOM 0 HD2 ARG A 98 13.270 -6.532 -2.668 1.00 0.00 H new ATOM 0 HD3 ARG A 98 13.247 -7.980 -3.656 1.00 0.00 H new ATOM 0 HE ARG A 98 12.801 -5.193 -4.581 1.00 0.00 H new ATOM 0 HH11 ARG A 98 12.892 -8.656 -5.320 1.00 0.00 H new ATOM 0 HH12 ARG A 98 13.045 -8.399 -7.061 1.00 0.00 H new ATOM 0 HH21 ARG A 98 13.051 -4.873 -6.818 1.00 0.00 H new ATOM 0 HH22 ARG A 98 13.135 -6.262 -7.907 1.00 0.00 H new ATOM 1603 N ASN A 99 9.250 -7.167 -0.005 1.00 0.00 N ATOM 1604 CA ASN A 99 9.148 -8.213 1.011 1.00 0.00 C ATOM 1605 C ASN A 99 7.701 -8.621 1.229 1.00 0.00 C ATOM 1606 O ASN A 99 7.404 -9.793 1.447 1.00 0.00 O ATOM 1607 CB ASN A 99 9.759 -7.763 2.336 1.00 0.00 C ATOM 1608 CG ASN A 99 11.267 -7.638 2.277 1.00 0.00 C ATOM 1609 OD1 ASN A 99 11.996 -8.591 2.549 1.00 0.00 O ATOM 1610 ND2 ASN A 99 11.745 -6.454 1.941 1.00 0.00 N ATOM 0 H ASN A 99 9.563 -6.263 0.347 1.00 0.00 H new ATOM 0 HA ASN A 99 9.708 -9.073 0.644 1.00 0.00 H new ATOM 0 HB2 ASN A 99 9.331 -6.802 2.620 1.00 0.00 H new ATOM 0 HB3 ASN A 99 9.489 -8.475 3.116 1.00 0.00 H new ATOM 0 HD21 ASN A 99 12.753 -6.304 1.900 1.00 0.00 H new ATOM 0 HD22 ASN A 99 11.106 -5.689 1.723 1.00 0.00 H new ATOM 1617 N LEU A 100 6.797 -7.646 1.162 1.00 0.00 N ATOM 1618 CA LEU A 100 5.370 -7.919 1.277 1.00 0.00 C ATOM 1619 C LEU A 100 4.927 -8.875 0.180 1.00 0.00 C ATOM 1620 O LEU A 100 4.271 -9.883 0.443 1.00 0.00 O ATOM 1621 CB LEU A 100 4.570 -6.620 1.190 1.00 0.00 C ATOM 1622 CG LEU A 100 4.671 -5.717 2.416 1.00 0.00 C ATOM 1623 CD1 LEU A 100 4.039 -4.371 2.136 1.00 0.00 C ATOM 1624 CD2 LEU A 100 3.992 -6.371 3.604 1.00 0.00 C ATOM 0 H LEU A 100 7.029 -6.662 1.029 1.00 0.00 H new ATOM 0 HA LEU A 100 5.184 -8.381 2.246 1.00 0.00 H new ATOM 0 HB2 LEU A 100 4.907 -6.061 0.317 1.00 0.00 H new ATOM 0 HB3 LEU A 100 3.521 -6.867 1.025 1.00 0.00 H new ATOM 0 HG LEU A 100 5.725 -5.566 2.648 1.00 0.00 H new ATOM 0 HD11 LEU A 100 4.120 -3.740 3.021 1.00 0.00 H new ATOM 0 HD12 LEU A 100 4.553 -3.894 1.302 1.00 0.00 H new ATOM 0 HD13 LEU A 100 2.988 -4.508 1.883 1.00 0.00 H new ATOM 0 HD21 LEU A 100 4.070 -5.718 4.473 1.00 0.00 H new ATOM 0 HD22 LEU A 100 2.941 -6.543 3.373 1.00 0.00 H new ATOM 0 HD23 LEU A 100 4.476 -7.323 3.821 1.00 0.00 H new ATOM 1636 N ALA A 101 5.315 -8.559 -1.043 1.00 0.00 N ATOM 1637 CA ALA A 101 4.981 -9.381 -2.192 1.00 0.00 C ATOM 1638 C ALA A 101 5.569 -10.782 -2.049 1.00 0.00 C ATOM 1639 O ALA A 101 4.938 -11.775 -2.411 1.00 0.00 O ATOM 1640 CB ALA A 101 5.481 -8.710 -3.457 1.00 0.00 C ATOM 0 H ALA A 101 5.867 -7.731 -1.267 1.00 0.00 H new ATOM 0 HA ALA A 101 3.898 -9.485 -2.251 1.00 0.00 H new ATOM 0 HB1 ALA A 101 5.230 -9.327 -4.320 1.00 0.00 H new ATOM 0 HB2 ALA A 101 5.010 -7.733 -3.561 1.00 0.00 H new ATOM 0 HB3 ALA A 101 6.563 -8.587 -3.401 1.00 0.00 H new ATOM 1646 N LYS A 102 6.772 -10.856 -1.495 1.00 0.00 N ATOM 1647 CA LYS A 102 7.449 -12.129 -1.284 1.00 0.00 C ATOM 1648 C LYS A 102 6.752 -12.939 -0.188 1.00 0.00 C ATOM 1649 O LYS A 102 6.799 -14.173 -0.176 1.00 0.00 O ATOM 1650 CB LYS A 102 8.910 -11.874 -0.909 1.00 0.00 C ATOM 1651 CG LYS A 102 9.782 -13.114 -0.954 1.00 0.00 C ATOM 1652 CD LYS A 102 11.216 -12.790 -0.568 1.00 0.00 C ATOM 1653 CE LYS A 102 12.148 -13.968 -0.803 1.00 0.00 C ATOM 1654 NZ LYS A 102 11.768 -15.160 -0.003 1.00 0.00 N ATOM 0 H LYS A 102 7.302 -10.043 -1.182 1.00 0.00 H new ATOM 0 HA LYS A 102 7.409 -12.707 -2.207 1.00 0.00 H new ATOM 0 HB2 LYS A 102 9.323 -11.126 -1.586 1.00 0.00 H new ATOM 0 HB3 LYS A 102 8.949 -11.451 0.095 1.00 0.00 H new ATOM 0 HG2 LYS A 102 9.382 -13.868 -0.277 1.00 0.00 H new ATOM 0 HG3 LYS A 102 9.760 -13.542 -1.956 1.00 0.00 H new ATOM 0 HD2 LYS A 102 11.562 -11.933 -1.145 1.00 0.00 H new ATOM 0 HD3 LYS A 102 11.253 -12.502 0.483 1.00 0.00 H new ATOM 0 HE2 LYS A 102 12.141 -14.227 -1.862 1.00 0.00 H new ATOM 0 HE3 LYS A 102 13.168 -13.676 -0.553 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 12.480 -15.907 -0.133 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 11.717 -14.901 1.003 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 10.840 -15.508 -0.318 1.00 0.00 H new ATOM 1668 N ALA A 103 6.097 -12.235 0.730 1.00 0.00 N ATOM 1669 CA ALA A 103 5.363 -12.872 1.817 1.00 0.00 C ATOM 1670 C ALA A 103 4.001 -13.355 1.336 1.00 0.00 C ATOM 1671 O ALA A 103 3.292 -14.067 2.051 1.00 0.00 O ATOM 1672 CB ALA A 103 5.190 -11.910 2.981 1.00 0.00 C ATOM 0 H ALA A 103 6.060 -11.216 0.742 1.00 0.00 H new ATOM 0 HA ALA A 103 5.940 -13.733 2.155 1.00 0.00 H new ATOM 0 HB1 ALA A 103 4.640 -12.404 3.782 1.00 0.00 H new ATOM 0 HB2 ALA A 103 6.169 -11.604 3.348 1.00 0.00 H new ATOM 0 HB3 ALA A 103 4.636 -11.032 2.648 1.00 0.00 H new ATOM 1678 N GLY A 104 3.642 -12.956 0.121 1.00 0.00 N ATOM 1679 CA GLY A 104 2.391 -13.386 -0.461 1.00 0.00 C ATOM 1680 C GLY A 104 1.348 -12.291 -0.477 1.00 0.00 C ATOM 1681 O GLY A 104 0.186 -12.540 -0.804 1.00 0.00 O ATOM 0 H GLY A 104 4.200 -12.340 -0.471 1.00 0.00 H new ATOM 0 HA2 GLY A 104 2.568 -13.728 -1.481 1.00 0.00 H new ATOM 0 HA3 GLY A 104 2.008 -14.239 0.100 1.00 0.00 H new ATOM 1685 N VAL A 105 1.752 -11.079 -0.126 1.00 0.00 N ATOM 1686 CA VAL A 105 0.838 -9.951 -0.123 1.00 0.00 C ATOM 1687 C VAL A 105 0.578 -9.474 -1.545 1.00 0.00 C ATOM 1688 O VAL A 105 1.408 -8.803 -2.158 1.00 0.00 O ATOM 1689 CB VAL A 105 1.364 -8.779 0.729 1.00 0.00 C ATOM 1690 CG1 VAL A 105 0.412 -7.594 0.664 1.00 0.00 C ATOM 1691 CG2 VAL A 105 1.571 -9.220 2.169 1.00 0.00 C ATOM 0 H VAL A 105 2.705 -10.854 0.160 1.00 0.00 H new ATOM 0 HA VAL A 105 -0.094 -10.297 0.324 1.00 0.00 H new ATOM 0 HB VAL A 105 2.325 -8.465 0.322 1.00 0.00 H new ATOM 0 HG11 VAL A 105 0.804 -6.779 1.273 1.00 0.00 H new ATOM 0 HG12 VAL A 105 0.315 -7.261 -0.369 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -0.566 -7.892 1.042 1.00 0.00 H new ATOM 0 HG21 VAL A 105 1.943 -8.381 2.757 1.00 0.00 H new ATOM 0 HG22 VAL A 105 0.623 -9.563 2.584 1.00 0.00 H new ATOM 0 HG23 VAL A 105 2.296 -10.034 2.200 1.00 0.00 H new ATOM 1701 N PHE A 106 -0.572 -9.862 -2.067 1.00 0.00 N ATOM 1702 CA PHE A 106 -0.990 -9.463 -3.400 1.00 0.00 C ATOM 1703 C PHE A 106 -1.958 -8.289 -3.309 1.00 0.00 C ATOM 1704 O PHE A 106 -2.061 -7.473 -4.224 1.00 0.00 O ATOM 1705 CB PHE A 106 -1.656 -10.656 -4.108 1.00 0.00 C ATOM 1706 CG PHE A 106 -2.094 -10.383 -5.523 1.00 0.00 C ATOM 1707 CD1 PHE A 106 -1.231 -10.609 -6.583 1.00 0.00 C ATOM 1708 CD2 PHE A 106 -3.368 -9.905 -5.791 1.00 0.00 C ATOM 1709 CE1 PHE A 106 -1.632 -10.362 -7.883 1.00 0.00 C ATOM 1710 CE2 PHE A 106 -3.772 -9.655 -7.087 1.00 0.00 C ATOM 1711 CZ PHE A 106 -2.903 -9.882 -8.135 1.00 0.00 C ATOM 0 H PHE A 106 -1.240 -10.460 -1.581 1.00 0.00 H new ATOM 0 HA PHE A 106 -0.120 -9.151 -3.977 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -0.959 -11.494 -4.113 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -2.524 -10.968 -3.527 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -0.235 -10.982 -6.392 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -4.053 -9.726 -4.975 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -0.952 -10.544 -8.702 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -4.767 -9.282 -7.281 1.00 0.00 H new ATOM 0 HZ PHE A 106 -3.216 -9.685 -9.150 1.00 0.00 H new ATOM 1721 N ARG A 107 -2.646 -8.198 -2.181 1.00 0.00 N ATOM 1722 CA ARG A 107 -3.703 -7.219 -2.012 1.00 0.00 C ATOM 1723 C ARG A 107 -3.403 -6.302 -0.832 1.00 0.00 C ATOM 1724 O ARG A 107 -3.650 -6.650 0.327 1.00 0.00 O ATOM 1725 CB ARG A 107 -5.033 -7.944 -1.810 1.00 0.00 C ATOM 1726 CG ARG A 107 -6.248 -7.141 -2.231 1.00 0.00 C ATOM 1727 CD ARG A 107 -7.514 -7.976 -2.127 1.00 0.00 C ATOM 1728 NE ARG A 107 -7.337 -9.300 -2.732 1.00 0.00 N ATOM 1729 CZ ARG A 107 -8.311 -9.995 -3.319 1.00 0.00 C ATOM 1730 NH1 ARG A 107 -9.522 -9.466 -3.457 1.00 0.00 N ATOM 1731 NH2 ARG A 107 -8.067 -11.215 -3.785 1.00 0.00 N ATOM 0 H ARG A 107 -2.489 -8.793 -1.368 1.00 0.00 H new ATOM 0 HA ARG A 107 -3.765 -6.599 -2.906 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -5.015 -8.877 -2.373 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -5.133 -8.209 -0.758 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -6.339 -6.255 -1.602 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -6.121 -6.792 -3.256 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -7.792 -8.088 -1.079 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -8.335 -7.456 -2.621 1.00 0.00 H new ATOM 0 HE ARG A 107 -6.407 -9.717 -2.702 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -9.709 -8.524 -3.113 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -10.264 -10.002 -3.907 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -7.135 -11.619 -3.693 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -8.812 -11.748 -4.234 1.00 0.00 H new ATOM 1745 N TRP A 108 -2.851 -5.143 -1.141 1.00 0.00 N ATOM 1746 CA TRP A 108 -2.504 -4.148 -0.142 1.00 0.00 C ATOM 1747 C TRP A 108 -3.680 -3.192 0.046 1.00 0.00 C ATOM 1748 O TRP A 108 -3.912 -2.316 -0.781 1.00 0.00 O ATOM 1749 CB TRP A 108 -1.246 -3.398 -0.613 1.00 0.00 C ATOM 1750 CG TRP A 108 -0.711 -2.345 0.318 1.00 0.00 C ATOM 1751 CD1 TRP A 108 -1.416 -1.537 1.162 1.00 0.00 C ATOM 1752 CD2 TRP A 108 0.661 -1.958 0.457 1.00 0.00 C ATOM 1753 NE1 TRP A 108 -0.568 -0.687 1.824 1.00 0.00 N ATOM 1754 CE2 TRP A 108 0.714 -0.926 1.410 1.00 0.00 C ATOM 1755 CE3 TRP A 108 1.851 -2.397 -0.128 1.00 0.00 C ATOM 1756 CZ2 TRP A 108 1.909 -0.318 1.786 1.00 0.00 C ATOM 1757 CZ3 TRP A 108 3.036 -1.793 0.244 1.00 0.00 C ATOM 1758 CH2 TRP A 108 3.057 -0.766 1.194 1.00 0.00 C ATOM 0 H TRP A 108 -2.630 -4.864 -2.097 1.00 0.00 H new ATOM 0 HA TRP A 108 -2.293 -4.620 0.818 1.00 0.00 H new ATOM 0 HB2 TRP A 108 -0.458 -4.130 -0.791 1.00 0.00 H new ATOM 0 HB3 TRP A 108 -1.467 -2.928 -1.571 1.00 0.00 H new ATOM 0 HD1 TRP A 108 -2.488 -1.563 1.290 1.00 0.00 H new ATOM 0 HE1 TRP A 108 -0.848 0.011 2.514 1.00 0.00 H new ATOM 0 HE3 TRP A 108 1.845 -3.194 -0.857 1.00 0.00 H new ATOM 0 HZ2 TRP A 108 1.928 0.477 2.517 1.00 0.00 H new ATOM 0 HZ3 TRP A 108 3.962 -2.119 -0.206 1.00 0.00 H new ATOM 0 HH2 TRP A 108 4.001 -0.317 1.466 1.00 0.00 H new ATOM 1769 N VAL A 109 -4.433 -3.369 1.117 1.00 0.00 N ATOM 1770 CA VAL A 109 -5.611 -2.548 1.354 1.00 0.00 C ATOM 1771 C VAL A 109 -5.417 -1.661 2.579 1.00 0.00 C ATOM 1772 O VAL A 109 -5.412 -2.137 3.709 1.00 0.00 O ATOM 1773 CB VAL A 109 -6.878 -3.415 1.543 1.00 0.00 C ATOM 1774 CG1 VAL A 109 -8.117 -2.542 1.639 1.00 0.00 C ATOM 1775 CG2 VAL A 109 -7.020 -4.417 0.406 1.00 0.00 C ATOM 0 H VAL A 109 -4.252 -4.071 1.835 1.00 0.00 H new ATOM 0 HA VAL A 109 -5.747 -1.921 0.473 1.00 0.00 H new ATOM 0 HB VAL A 109 -6.774 -3.968 2.477 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -8.997 -3.172 1.772 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -8.022 -1.868 2.490 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -8.223 -1.959 0.724 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -7.918 -5.016 0.559 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -7.097 -3.884 -0.541 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -6.147 -5.070 0.385 1.00 0.00 H new ATOM 1785 N THR A 110 -5.238 -0.371 2.357 1.00 0.00 N ATOM 1786 CA THR A 110 -5.073 0.562 3.459 1.00 0.00 C ATOM 1787 C THR A 110 -6.340 1.387 3.652 1.00 0.00 C ATOM 1788 O THR A 110 -6.707 2.200 2.797 1.00 0.00 O ATOM 1789 CB THR A 110 -3.873 1.499 3.237 1.00 0.00 C ATOM 1790 OG1 THR A 110 -2.693 0.719 3.004 1.00 0.00 O ATOM 1791 CG2 THR A 110 -3.654 2.408 4.439 1.00 0.00 C ATOM 0 H THR A 110 -5.203 0.053 1.430 1.00 0.00 H new ATOM 0 HA THR A 110 -4.882 -0.026 4.357 1.00 0.00 H new ATOM 0 HB THR A 110 -4.083 2.125 2.370 1.00 0.00 H new ATOM 0 HG1 THR A 110 -2.747 0.301 2.119 1.00 0.00 H new ATOM 0 HG21 THR A 110 -2.799 3.058 4.252 1.00 0.00 H new ATOM 0 HG22 THR A 110 -4.544 3.016 4.602 1.00 0.00 H new ATOM 0 HG23 THR A 110 -3.462 1.801 5.324 1.00 0.00 H new ATOM 1799 N ASN A 111 -7.010 1.161 4.773 1.00 0.00 N ATOM 1800 CA ASN A 111 -8.243 1.863 5.077 1.00 0.00 C ATOM 1801 C ASN A 111 -7.968 3.052 5.978 1.00 0.00 C ATOM 1802 O ASN A 111 -7.630 2.889 7.150 1.00 0.00 O ATOM 1803 CB ASN A 111 -9.261 0.934 5.751 1.00 0.00 C ATOM 1804 CG ASN A 111 -9.812 -0.133 4.820 1.00 0.00 C ATOM 1805 OD1 ASN A 111 -9.129 -0.606 3.915 1.00 0.00 O ATOM 1806 ND2 ASN A 111 -11.063 -0.504 5.024 1.00 0.00 N ATOM 0 H ASN A 111 -6.717 0.494 5.487 1.00 0.00 H new ATOM 0 HA ASN A 111 -8.664 2.213 4.134 1.00 0.00 H new ATOM 0 HB2 ASN A 111 -8.790 0.451 6.607 1.00 0.00 H new ATOM 0 HB3 ASN A 111 -10.087 1.531 6.137 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -11.492 -1.205 4.420 1.00 0.00 H new ATOM 0 HD22 ASN A 111 -11.600 -0.090 5.786 1.00 0.00 H new ATOM 1813 N ILE A 112 -8.102 4.246 5.422 1.00 0.00 N ATOM 1814 CA ILE A 112 -7.948 5.466 6.196 1.00 0.00 C ATOM 1815 C ILE A 112 -9.172 5.672 7.079 1.00 0.00 C ATOM 1816 O ILE A 112 -9.074 6.202 8.178 1.00 0.00 O ATOM 1817 CB ILE A 112 -7.731 6.699 5.284 1.00 0.00 C ATOM 1818 CG1 ILE A 112 -6.385 6.587 4.559 1.00 0.00 C ATOM 1819 CG2 ILE A 112 -7.797 8.000 6.081 1.00 0.00 C ATOM 1820 CD1 ILE A 112 -5.196 6.545 5.496 1.00 0.00 C ATOM 0 H ILE A 112 -8.317 4.395 4.436 1.00 0.00 H new ATOM 0 HA ILE A 112 -7.061 5.360 6.821 1.00 0.00 H new ATOM 0 HB ILE A 112 -8.534 6.719 4.547 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -6.386 5.686 3.945 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -6.274 7.434 3.882 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -7.641 8.845 5.411 1.00 0.00 H new ATOM 0 HG22 ILE A 112 -8.775 8.088 6.554 1.00 0.00 H new ATOM 0 HG23 ILE A 112 -7.022 7.997 6.848 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -4.277 6.465 4.915 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -5.170 7.457 6.092 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -5.283 5.682 6.156 1.00 0.00 H new ATOM 1832 N HIS A 113 -10.319 5.213 6.598 1.00 0.00 N ATOM 1833 CA HIS A 113 -11.563 5.317 7.353 1.00 0.00 C ATOM 1834 C HIS A 113 -11.513 4.433 8.603 1.00 0.00 C ATOM 1835 O HIS A 113 -12.207 4.692 9.584 1.00 0.00 O ATOM 1836 CB HIS A 113 -12.744 4.915 6.464 1.00 0.00 C ATOM 1837 CG HIS A 113 -14.085 5.186 7.073 1.00 0.00 C ATOM 1838 ND1 HIS A 113 -14.760 4.263 7.837 1.00 0.00 N ATOM 1839 CD2 HIS A 113 -14.879 6.281 7.023 1.00 0.00 C ATOM 1840 CE1 HIS A 113 -15.910 4.773 8.228 1.00 0.00 C ATOM 1841 NE2 HIS A 113 -16.009 5.999 7.749 1.00 0.00 N ATOM 0 H HIS A 113 -10.415 4.764 5.687 1.00 0.00 H new ATOM 0 HA HIS A 113 -11.693 6.351 7.673 1.00 0.00 H new ATOM 0 HB2 HIS A 113 -12.672 5.450 5.517 1.00 0.00 H new ATOM 0 HB3 HIS A 113 -12.668 3.852 6.236 1.00 0.00 H new ATOM 0 HD1 HIS A 113 -14.422 3.328 8.066 1.00 0.00 H new ATOM 0 HD2 HIS A 113 -14.663 7.205 6.507 1.00 0.00 H new ATOM 0 HE1 HIS A 113 -16.648 4.272 8.838 1.00 0.00 H new ATOM 1850 N GLU A 114 -10.681 3.395 8.555 1.00 0.00 N ATOM 1851 CA GLU A 114 -10.544 2.460 9.669 1.00 0.00 C ATOM 1852 C GLU A 114 -9.223 2.660 10.417 1.00 0.00 C ATOM 1853 O GLU A 114 -9.009 2.062 11.477 1.00 0.00 O ATOM 1854 CB GLU A 114 -10.619 1.011 9.169 1.00 0.00 C ATOM 1855 CG GLU A 114 -12.032 0.484 8.944 1.00 0.00 C ATOM 1856 CD GLU A 114 -12.795 1.209 7.850 1.00 0.00 C ATOM 1857 OE1 GLU A 114 -12.428 1.071 6.665 1.00 0.00 O ATOM 1858 OE2 GLU A 114 -13.781 1.906 8.169 1.00 0.00 O ATOM 0 H GLU A 114 -10.089 3.180 7.753 1.00 0.00 H new ATOM 0 HA GLU A 114 -11.367 2.658 10.355 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -10.065 0.935 8.233 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -10.117 0.366 9.890 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -11.978 -0.576 8.694 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -12.591 0.563 9.876 1.00 0.00 H new ATOM 1865 N GLN A 115 -8.348 3.504 9.862 1.00 0.00 N ATOM 1866 CA GLN A 115 -6.990 3.695 10.390 1.00 0.00 C ATOM 1867 C GLN A 115 -6.252 2.364 10.509 1.00 0.00 C ATOM 1868 O GLN A 115 -5.521 2.128 11.473 1.00 0.00 O ATOM 1869 CB GLN A 115 -7.007 4.397 11.756 1.00 0.00 C ATOM 1870 CG GLN A 115 -7.051 5.915 11.683 1.00 0.00 C ATOM 1871 CD GLN A 115 -8.374 6.450 11.178 1.00 0.00 C ATOM 1872 OE1 GLN A 115 -9.428 5.856 11.403 1.00 0.00 O ATOM 1873 NE2 GLN A 115 -8.324 7.573 10.485 1.00 0.00 N ATOM 0 H GLN A 115 -8.557 4.071 9.040 1.00 0.00 H new ATOM 0 HA GLN A 115 -6.462 4.331 9.680 1.00 0.00 H new ATOM 0 HB2 GLN A 115 -7.872 4.048 12.319 1.00 0.00 H new ATOM 0 HB3 GLN A 115 -6.120 4.098 12.315 1.00 0.00 H new ATOM 0 HG2 GLN A 115 -6.855 6.326 12.673 1.00 0.00 H new ATOM 0 HG3 GLN A 115 -6.252 6.264 11.029 1.00 0.00 H new ATOM 0 HE21 GLN A 115 -7.428 8.032 10.322 1.00 0.00 H new ATOM 0 HE22 GLN A 115 -9.181 7.981 10.113 1.00 0.00 H new ATOM 1882 N LYS A 116 -6.421 1.499 9.520 1.00 0.00 N ATOM 1883 CA LYS A 116 -5.822 0.173 9.571 1.00 0.00 C ATOM 1884 C LYS A 116 -5.315 -0.273 8.205 1.00 0.00 C ATOM 1885 O LYS A 116 -5.933 0.000 7.173 1.00 0.00 O ATOM 1886 CB LYS A 116 -6.831 -0.837 10.127 1.00 0.00 C ATOM 1887 CG LYS A 116 -7.064 -0.678 11.620 1.00 0.00 C ATOM 1888 CD LYS A 116 -8.300 -1.421 12.085 1.00 0.00 C ATOM 1889 CE LYS A 116 -8.467 -1.320 13.596 1.00 0.00 C ATOM 1890 NZ LYS A 116 -8.370 0.086 14.085 1.00 0.00 N ATOM 0 H LYS A 116 -6.964 1.689 8.678 1.00 0.00 H new ATOM 0 HA LYS A 116 -4.960 0.221 10.236 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -7.779 -0.722 9.602 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -6.475 -1.847 9.925 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -6.194 -1.046 12.164 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -7.166 0.380 11.860 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -9.181 -1.012 11.591 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -8.229 -2.469 11.793 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -9.434 -1.735 13.881 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -7.704 -1.925 14.085 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -8.886 0.177 14.984 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -7.371 0.334 14.232 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -8.786 0.728 13.380 1.00 0.00 H new ATOM 1904 N ARG A 117 -4.172 -0.944 8.215 1.00 0.00 N ATOM 1905 CA ARG A 117 -3.579 -1.488 7.007 1.00 0.00 C ATOM 1906 C ARG A 117 -3.850 -2.987 6.929 1.00 0.00 C ATOM 1907 O ARG A 117 -3.351 -3.763 7.748 1.00 0.00 O ATOM 1908 CB ARG A 117 -2.069 -1.217 6.979 1.00 0.00 C ATOM 1909 CG ARG A 117 -1.712 0.260 7.084 1.00 0.00 C ATOM 1910 CD ARG A 117 -0.247 0.520 6.757 1.00 0.00 C ATOM 1911 NE ARG A 117 0.675 -0.052 7.744 1.00 0.00 N ATOM 1912 CZ ARG A 117 1.948 -0.354 7.487 1.00 0.00 C ATOM 1913 NH1 ARG A 117 2.458 -0.126 6.284 1.00 0.00 N ATOM 1914 NH2 ARG A 117 2.713 -0.862 8.441 1.00 0.00 N ATOM 0 H ARG A 117 -3.632 -1.125 9.061 1.00 0.00 H new ATOM 0 HA ARG A 117 -4.030 -0.999 6.143 1.00 0.00 H new ATOM 0 HB2 ARG A 117 -1.596 -1.756 7.800 1.00 0.00 H new ATOM 0 HB3 ARG A 117 -1.654 -1.618 6.054 1.00 0.00 H new ATOM 0 HG2 ARG A 117 -2.342 0.834 6.405 1.00 0.00 H new ATOM 0 HG3 ARG A 117 -1.926 0.613 8.093 1.00 0.00 H new ATOM 0 HD2 ARG A 117 -0.021 0.105 5.775 1.00 0.00 H new ATOM 0 HD3 ARG A 117 -0.081 1.595 6.694 1.00 0.00 H new ATOM 0 HE ARG A 117 0.321 -0.229 8.684 1.00 0.00 H new ATOM 0 HH11 ARG A 117 1.876 0.282 5.552 1.00 0.00 H new ATOM 0 HH12 ARG A 117 3.432 -0.358 6.091 1.00 0.00 H new ATOM 0 HH21 ARG A 117 2.328 -1.022 9.372 1.00 0.00 H new ATOM 0 HH22 ARG A 117 3.687 -1.093 8.245 1.00 0.00 H new ATOM 1928 N TYR A 118 -4.658 -3.380 5.958 1.00 0.00 N ATOM 1929 CA TYR A 118 -5.027 -4.775 5.776 1.00 0.00 C ATOM 1930 C TYR A 118 -4.168 -5.411 4.691 1.00 0.00 C ATOM 1931 O TYR A 118 -4.042 -4.878 3.586 1.00 0.00 O ATOM 1932 CB TYR A 118 -6.505 -4.890 5.395 1.00 0.00 C ATOM 1933 CG TYR A 118 -7.461 -4.365 6.442 1.00 0.00 C ATOM 1934 CD1 TYR A 118 -7.943 -5.196 7.445 1.00 0.00 C ATOM 1935 CD2 TYR A 118 -7.892 -3.044 6.422 1.00 0.00 C ATOM 1936 CE1 TYR A 118 -8.827 -4.725 8.398 1.00 0.00 C ATOM 1937 CE2 TYR A 118 -8.774 -2.566 7.373 1.00 0.00 C ATOM 1938 CZ TYR A 118 -9.239 -3.412 8.358 1.00 0.00 C ATOM 1939 OH TYR A 118 -10.120 -2.945 9.309 1.00 0.00 O ATOM 0 H TYR A 118 -5.075 -2.745 5.277 1.00 0.00 H new ATOM 0 HA TYR A 118 -4.861 -5.300 6.717 1.00 0.00 H new ATOM 0 HB2 TYR A 118 -6.671 -4.348 4.464 1.00 0.00 H new ATOM 0 HB3 TYR A 118 -6.737 -5.937 5.200 1.00 0.00 H new ATOM 0 HD1 TYR A 118 -7.622 -6.227 7.481 1.00 0.00 H new ATOM 0 HD2 TYR A 118 -7.532 -2.380 5.650 1.00 0.00 H new ATOM 0 HE1 TYR A 118 -9.193 -5.385 9.171 1.00 0.00 H new ATOM 0 HE2 TYR A 118 -9.097 -1.536 7.345 1.00 0.00 H new ATOM 0 HH TYR A 118 -10.310 -1.998 9.142 1.00 0.00 H new ATOM 1949 N TYR A 119 -3.570 -6.547 5.011 1.00 0.00 N ATOM 1950 CA TYR A 119 -2.741 -7.257 4.055 1.00 0.00 C ATOM 1951 C TYR A 119 -3.369 -8.586 3.674 1.00 0.00 C ATOM 1952 O TYR A 119 -3.449 -9.509 4.490 1.00 0.00 O ATOM 1953 CB TYR A 119 -1.336 -7.465 4.621 1.00 0.00 C ATOM 1954 CG TYR A 119 -0.552 -6.179 4.738 1.00 0.00 C ATOM 1955 CD1 TYR A 119 -0.005 -5.588 3.610 1.00 0.00 C ATOM 1956 CD2 TYR A 119 -0.369 -5.552 5.965 1.00 0.00 C ATOM 1957 CE1 TYR A 119 0.704 -4.409 3.695 1.00 0.00 C ATOM 1958 CE2 TYR A 119 0.342 -4.370 6.061 1.00 0.00 C ATOM 1959 CZ TYR A 119 0.876 -3.805 4.918 1.00 0.00 C ATOM 1960 OH TYR A 119 1.578 -2.628 4.990 1.00 0.00 O ATOM 0 H TYR A 119 -3.644 -6.995 5.924 1.00 0.00 H new ATOM 0 HA TYR A 119 -2.664 -6.651 3.152 1.00 0.00 H new ATOM 0 HB2 TYR A 119 -1.411 -7.929 5.604 1.00 0.00 H new ATOM 0 HB3 TYR A 119 -0.791 -8.160 3.981 1.00 0.00 H new ATOM 0 HD1 TYR A 119 -0.137 -6.060 2.647 1.00 0.00 H new ATOM 0 HD2 TYR A 119 -0.788 -5.995 6.856 1.00 0.00 H new ATOM 0 HE1 TYR A 119 1.122 -3.962 2.805 1.00 0.00 H new ATOM 0 HE2 TYR A 119 0.479 -3.893 7.020 1.00 0.00 H new ATOM 0 HH TYR A 119 0.965 -1.894 5.203 1.00 0.00 H new ATOM 1970 N TYR A 120 -3.824 -8.671 2.433 1.00 0.00 N ATOM 1971 CA TYR A 120 -4.445 -9.883 1.923 1.00 0.00 C ATOM 1972 C TYR A 120 -3.531 -10.556 0.911 1.00 0.00 C ATOM 1973 O TYR A 120 -2.823 -9.888 0.153 1.00 0.00 O ATOM 1974 CB TYR A 120 -5.779 -9.573 1.234 1.00 0.00 C ATOM 1975 CG TYR A 120 -6.819 -8.915 2.108 1.00 0.00 C ATOM 1976 CD1 TYR A 120 -6.841 -7.537 2.275 1.00 0.00 C ATOM 1977 CD2 TYR A 120 -7.796 -9.667 2.744 1.00 0.00 C ATOM 1978 CE1 TYR A 120 -7.803 -6.928 3.054 1.00 0.00 C ATOM 1979 CE2 TYR A 120 -8.766 -9.066 3.519 1.00 0.00 C ATOM 1980 CZ TYR A 120 -8.763 -7.696 3.672 1.00 0.00 C ATOM 1981 OH TYR A 120 -9.730 -7.091 4.440 1.00 0.00 O ATOM 0 H TYR A 120 -3.774 -7.909 1.757 1.00 0.00 H new ATOM 0 HA TYR A 120 -4.621 -10.543 2.773 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -5.585 -8.926 0.378 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -6.192 -10.503 0.843 1.00 0.00 H new ATOM 0 HD1 TYR A 120 -6.092 -6.931 1.787 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -7.797 -10.741 2.630 1.00 0.00 H new ATOM 0 HE1 TYR A 120 -7.803 -5.855 3.178 1.00 0.00 H new ATOM 0 HE2 TYR A 120 -9.523 -9.665 4.003 1.00 0.00 H new ATOM 0 HH TYR A 120 -10.332 -7.773 4.805 1.00 0.00 H new ATOM 1991 N THR A 121 -3.556 -11.874 0.893 1.00 0.00 N ATOM 1992 CA THR A 121 -2.875 -12.625 -0.143 1.00 0.00 C ATOM 1993 C THR A 121 -3.783 -12.718 -1.375 1.00 0.00 C ATOM 1994 O THR A 121 -4.898 -12.189 -1.363 1.00 0.00 O ATOM 1995 CB THR A 121 -2.477 -14.037 0.361 1.00 0.00 C ATOM 1996 OG1 THR A 121 -1.770 -14.755 -0.655 1.00 0.00 O ATOM 1997 CG2 THR A 121 -3.698 -14.834 0.790 1.00 0.00 C ATOM 0 H THR A 121 -4.040 -12.447 1.584 1.00 0.00 H new ATOM 0 HA THR A 121 -1.954 -12.107 -0.413 1.00 0.00 H new ATOM 0 HB THR A 121 -1.827 -13.904 1.226 1.00 0.00 H new ATOM 0 HG1 THR A 121 -0.993 -14.233 -0.944 1.00 0.00 H new ATOM 0 HG21 THR A 121 -3.386 -15.819 1.138 1.00 0.00 H new ATOM 0 HG22 THR A 121 -4.210 -14.309 1.597 1.00 0.00 H new ATOM 0 HG23 THR A 121 -4.375 -14.946 -0.057 1.00 0.00 H new ATOM 2005 N PHE A 122 -3.321 -13.381 -2.431 1.00 0.00 N ATOM 2006 CA PHE A 122 -4.117 -13.529 -3.648 1.00 0.00 C ATOM 2007 C PHE A 122 -5.398 -14.310 -3.351 1.00 0.00 C ATOM 2008 O PHE A 122 -6.428 -14.108 -3.993 1.00 0.00 O ATOM 2009 CB PHE A 122 -3.300 -14.236 -4.738 1.00 0.00 C ATOM 2010 CG PHE A 122 -4.031 -14.372 -6.045 1.00 0.00 C ATOM 2011 CD1 PHE A 122 -4.134 -13.298 -6.912 1.00 0.00 C ATOM 2012 CD2 PHE A 122 -4.616 -15.574 -6.402 1.00 0.00 C ATOM 2013 CE1 PHE A 122 -4.810 -13.417 -8.111 1.00 0.00 C ATOM 2014 CE2 PHE A 122 -5.293 -15.700 -7.600 1.00 0.00 C ATOM 2015 CZ PHE A 122 -5.391 -14.621 -8.454 1.00 0.00 C ATOM 0 H PHE A 122 -2.403 -13.823 -2.470 1.00 0.00 H new ATOM 0 HA PHE A 122 -4.390 -12.537 -4.009 1.00 0.00 H new ATOM 0 HB2 PHE A 122 -2.376 -13.683 -4.904 1.00 0.00 H new ATOM 0 HB3 PHE A 122 -3.019 -15.228 -4.384 1.00 0.00 H new ATOM 0 HD1 PHE A 122 -3.680 -12.354 -6.648 1.00 0.00 H new ATOM 0 HD2 PHE A 122 -4.543 -16.422 -5.738 1.00 0.00 H new ATOM 0 HE1 PHE A 122 -4.884 -12.571 -8.778 1.00 0.00 H new ATOM 0 HE2 PHE A 122 -5.745 -16.643 -7.868 1.00 0.00 H new ATOM 0 HZ PHE A 122 -5.922 -14.718 -9.390 1.00 0.00 H new ATOM 2025 N ASP A 123 -5.316 -15.170 -2.344 1.00 0.00 N ATOM 2026 CA ASP A 123 -6.439 -15.999 -1.915 1.00 0.00 C ATOM 2027 C ASP A 123 -7.540 -15.157 -1.260 1.00 0.00 C ATOM 2028 O ASP A 123 -8.634 -15.653 -0.998 1.00 0.00 O ATOM 2029 CB ASP A 123 -5.926 -17.060 -0.936 1.00 0.00 C ATOM 2030 CG ASP A 123 -7.012 -18.000 -0.451 1.00 0.00 C ATOM 2031 OD1 ASP A 123 -7.382 -18.922 -1.205 1.00 0.00 O ATOM 2032 OD2 ASP A 123 -7.476 -17.839 0.695 1.00 0.00 O ATOM 0 H ASP A 123 -4.466 -15.314 -1.799 1.00 0.00 H new ATOM 0 HA ASP A 123 -6.876 -16.480 -2.790 1.00 0.00 H new ATOM 0 HB2 ASP A 123 -5.140 -17.641 -1.419 1.00 0.00 H new ATOM 0 HB3 ASP A 123 -5.473 -16.564 -0.077 1.00 0.00 H new ATOM 2037 N ASN A 124 -7.231 -13.877 -1.015 1.00 0.00 N ATOM 2038 CA ASN A 124 -8.132 -12.943 -0.320 1.00 0.00 C ATOM 2039 C ASN A 124 -8.129 -13.227 1.185 1.00 0.00 C ATOM 2040 O ASN A 124 -8.849 -12.602 1.964 1.00 0.00 O ATOM 2041 CB ASN A 124 -9.558 -12.988 -0.913 1.00 0.00 C ATOM 2042 CG ASN A 124 -10.506 -11.979 -0.285 1.00 0.00 C ATOM 2043 OD1 ASN A 124 -10.495 -10.758 -0.797 1.00 0.00 O flip ATOM 2044 ND2 ASN A 124 -11.244 -12.296 0.651 1.00 0.00 N flip ATOM 0 H ASN A 124 -6.345 -13.456 -1.294 1.00 0.00 H new ATOM 0 HA ASN A 124 -7.763 -11.929 -0.471 1.00 0.00 H new ATOM 0 HB2 ASN A 124 -9.503 -12.805 -1.986 1.00 0.00 H new ATOM 0 HB3 ASN A 124 -9.967 -13.990 -0.781 1.00 0.00 H new ATOM 0 HD21 ASN A 124 -11.223 -13.248 1.017 1.00 0.00 H new ATOM 0 HD22 ASN A 124 -11.876 -11.607 1.059 1.00 0.00 H new ATOM 2051 N SER A 125 -7.282 -14.160 1.588 1.00 0.00 N ATOM 2052 CA SER A 125 -7.083 -14.457 2.994 1.00 0.00 C ATOM 2053 C SER A 125 -6.333 -13.311 3.665 1.00 0.00 C ATOM 2054 O SER A 125 -5.243 -12.923 3.228 1.00 0.00 O ATOM 2055 CB SER A 125 -6.315 -15.777 3.152 1.00 0.00 C ATOM 2056 OG SER A 125 -6.104 -16.104 4.518 1.00 0.00 O ATOM 0 H SER A 125 -6.718 -14.727 0.955 1.00 0.00 H new ATOM 0 HA SER A 125 -8.054 -14.566 3.478 1.00 0.00 H new ATOM 0 HB2 SER A 125 -6.870 -16.580 2.667 1.00 0.00 H new ATOM 0 HB3 SER A 125 -5.354 -15.701 2.644 1.00 0.00 H new ATOM 0 HG SER A 125 -5.614 -16.951 4.580 1.00 0.00 H new ATOM 2062 N LEU A 126 -6.945 -12.750 4.693 1.00 0.00 N ATOM 2063 CA LEU A 126 -6.341 -11.673 5.456 1.00 0.00 C ATOM 2064 C LEU A 126 -5.196 -12.214 6.300 1.00 0.00 C ATOM 2065 O LEU A 126 -5.415 -12.969 7.249 1.00 0.00 O ATOM 2066 CB LEU A 126 -7.397 -11.007 6.342 1.00 0.00 C ATOM 2067 CG LEU A 126 -6.923 -9.805 7.160 1.00 0.00 C ATOM 2068 CD1 LEU A 126 -6.367 -8.717 6.251 1.00 0.00 C ATOM 2069 CD2 LEU A 126 -8.071 -9.260 7.998 1.00 0.00 C ATOM 0 H LEU A 126 -7.870 -13.027 5.021 1.00 0.00 H new ATOM 0 HA LEU A 126 -5.942 -10.925 4.770 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -8.225 -10.687 5.709 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -7.792 -11.756 7.029 1.00 0.00 H new ATOM 0 HG LEU A 126 -6.124 -10.133 7.825 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -6.036 -7.872 6.855 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -5.523 -9.112 5.686 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -7.144 -8.387 5.561 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -7.724 -8.404 8.577 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -8.884 -8.949 7.342 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -8.428 -10.036 8.675 1.00 0.00 H new ATOM 2081 N LEU A 127 -3.980 -11.840 5.939 1.00 0.00 N ATOM 2082 CA LEU A 127 -2.796 -12.359 6.604 1.00 0.00 C ATOM 2083 C LEU A 127 -2.389 -11.474 7.770 1.00 0.00 C ATOM 2084 O LEU A 127 -1.972 -11.966 8.820 1.00 0.00 O ATOM 2085 CB LEU A 127 -1.636 -12.472 5.613 1.00 0.00 C ATOM 2086 CG LEU A 127 -1.852 -13.452 4.460 1.00 0.00 C ATOM 2087 CD1 LEU A 127 -0.663 -13.420 3.512 1.00 0.00 C ATOM 2088 CD2 LEU A 127 -2.077 -14.860 4.994 1.00 0.00 C ATOM 0 H LEU A 127 -3.786 -11.178 5.188 1.00 0.00 H new ATOM 0 HA LEU A 127 -3.038 -13.349 6.990 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -1.439 -11.484 5.196 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -0.742 -12.771 6.159 1.00 0.00 H new ATOM 0 HG LEU A 127 -2.742 -13.151 3.907 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -0.830 -14.123 2.695 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -0.547 -12.414 3.108 1.00 0.00 H new ATOM 0 HD13 LEU A 127 0.241 -13.700 4.053 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -2.229 -15.545 4.160 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -1.206 -15.175 5.568 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -2.958 -14.869 5.636 1.00 0.00 H new ATOM 2100 N PHE A 128 -2.513 -10.167 7.588 1.00 0.00 N ATOM 2101 CA PHE A 128 -2.064 -9.222 8.593 1.00 0.00 C ATOM 2102 C PHE A 128 -3.025 -8.047 8.699 1.00 0.00 C ATOM 2103 O PHE A 128 -3.614 -7.619 7.703 1.00 0.00 O ATOM 2104 CB PHE A 128 -0.659 -8.727 8.243 1.00 0.00 C ATOM 2105 CG PHE A 128 0.074 -8.098 9.395 1.00 0.00 C ATOM 2106 CD1 PHE A 128 0.430 -8.859 10.492 1.00 0.00 C ATOM 2107 CD2 PHE A 128 0.411 -6.752 9.379 1.00 0.00 C ATOM 2108 CE1 PHE A 128 1.107 -8.298 11.556 1.00 0.00 C ATOM 2109 CE2 PHE A 128 1.091 -6.184 10.439 1.00 0.00 C ATOM 2110 CZ PHE A 128 1.438 -6.957 11.529 1.00 0.00 C ATOM 0 H PHE A 128 -2.920 -9.741 6.756 1.00 0.00 H new ATOM 0 HA PHE A 128 -2.038 -9.726 9.559 1.00 0.00 H new ATOM 0 HB2 PHE A 128 -0.073 -9.566 7.868 1.00 0.00 H new ATOM 0 HB3 PHE A 128 -0.732 -8.001 7.433 1.00 0.00 H new ATOM 0 HD1 PHE A 128 0.175 -9.908 10.517 1.00 0.00 H new ATOM 0 HD2 PHE A 128 0.139 -6.143 8.530 1.00 0.00 H new ATOM 0 HE1 PHE A 128 1.377 -8.906 12.407 1.00 0.00 H new ATOM 0 HE2 PHE A 128 1.351 -5.136 10.415 1.00 0.00 H new ATOM 0 HZ PHE A 128 1.968 -6.514 12.359 1.00 0.00 H new ATOM 2120 N THR A 129 -3.190 -7.540 9.911 1.00 0.00 N ATOM 2121 CA THR A 129 -4.039 -6.387 10.160 1.00 0.00 C ATOM 2122 C THR A 129 -3.363 -5.453 11.157 1.00 0.00 C ATOM 2123 O THR A 129 -3.327 -5.730 12.356 1.00 0.00 O ATOM 2124 CB THR A 129 -5.413 -6.816 10.706 1.00 0.00 C ATOM 2125 OG1 THR A 129 -6.002 -7.772 9.820 1.00 0.00 O ATOM 2126 CG2 THR A 129 -6.346 -5.625 10.863 1.00 0.00 C ATOM 0 H THR A 129 -2.741 -7.915 10.746 1.00 0.00 H new ATOM 0 HA THR A 129 -4.192 -5.868 9.214 1.00 0.00 H new ATOM 0 HB THR A 129 -5.263 -7.260 11.690 1.00 0.00 H new ATOM 0 HG1 THR A 129 -6.444 -8.473 10.343 1.00 0.00 H new ATOM 0 HG21 THR A 129 -7.307 -5.964 11.250 1.00 0.00 H new ATOM 0 HG22 THR A 129 -5.907 -4.908 11.557 1.00 0.00 H new ATOM 0 HG23 THR A 129 -6.493 -5.148 9.894 1.00 0.00 H new ATOM 2134 N GLU A 130 -2.804 -4.366 10.658 1.00 0.00 N ATOM 2135 CA GLU A 130 -2.080 -3.436 11.506 1.00 0.00 C ATOM 2136 C GLU A 130 -2.819 -2.110 11.603 1.00 0.00 C ATOM 2137 O GLU A 130 -3.146 -1.497 10.590 1.00 0.00 O ATOM 2138 CB GLU A 130 -0.676 -3.198 10.951 1.00 0.00 C ATOM 2139 CG GLU A 130 0.216 -2.412 11.893 1.00 0.00 C ATOM 2140 CD GLU A 130 1.390 -1.778 11.184 1.00 0.00 C ATOM 2141 OE1 GLU A 130 1.182 -0.739 10.529 1.00 0.00 O ATOM 2142 OE2 GLU A 130 2.518 -2.305 11.284 1.00 0.00 O ATOM 0 H GLU A 130 -2.837 -4.105 9.672 1.00 0.00 H new ATOM 0 HA GLU A 130 -2.006 -3.872 12.502 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -0.209 -4.160 10.738 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -0.753 -2.664 10.004 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -0.372 -1.635 12.381 1.00 0.00 H new ATOM 0 HG3 GLU A 130 0.584 -3.074 12.677 1.00 0.00 H new ATOM 2149 N SER A 131 -3.093 -1.673 12.820 1.00 0.00 N ATOM 2150 CA SER A 131 -3.711 -0.377 13.029 1.00 0.00 C ATOM 2151 C SER A 131 -2.618 0.684 13.085 1.00 0.00 C ATOM 2152 O SER A 131 -1.662 0.557 13.858 1.00 0.00 O ATOM 2153 CB SER A 131 -4.536 -0.377 14.324 1.00 0.00 C ATOM 2154 OG SER A 131 -5.428 0.730 14.377 1.00 0.00 O ATOM 0 H SER A 131 -2.898 -2.195 13.675 1.00 0.00 H new ATOM 0 HA SER A 131 -4.389 -0.156 12.205 1.00 0.00 H new ATOM 0 HB2 SER A 131 -5.103 -1.305 14.395 1.00 0.00 H new ATOM 0 HB3 SER A 131 -3.866 -0.346 15.183 1.00 0.00 H new ATOM 0 HG SER A 131 -5.475 1.155 13.495 1.00 0.00 H new ATOM 2160 N ILE A 132 -2.744 1.714 12.259 1.00 0.00 N ATOM 2161 CA ILE A 132 -1.726 2.751 12.193 1.00 0.00 C ATOM 2162 C ILE A 132 -1.831 3.688 13.387 1.00 0.00 C ATOM 2163 O ILE A 132 -2.553 4.689 13.361 1.00 0.00 O ATOM 2164 CB ILE A 132 -1.776 3.552 10.869 1.00 0.00 C ATOM 2165 CG1 ILE A 132 -3.211 3.966 10.524 1.00 0.00 C ATOM 2166 CG2 ILE A 132 -1.169 2.732 9.741 1.00 0.00 C ATOM 2167 CD1 ILE A 132 -3.316 4.861 9.307 1.00 0.00 C ATOM 0 H ILE A 132 -3.535 1.853 11.630 1.00 0.00 H new ATOM 0 HA ILE A 132 -0.761 2.245 12.223 1.00 0.00 H new ATOM 0 HB ILE A 132 -1.191 4.463 10.998 1.00 0.00 H new ATOM 0 HG12 ILE A 132 -3.807 3.069 10.356 1.00 0.00 H new ATOM 0 HG13 ILE A 132 -3.646 4.481 11.380 1.00 0.00 H new ATOM 0 HG21 ILE A 132 -1.209 3.303 8.814 1.00 0.00 H new ATOM 0 HG22 ILE A 132 -0.131 2.498 9.979 1.00 0.00 H new ATOM 0 HG23 ILE A 132 -1.731 1.806 9.621 1.00 0.00 H new ATOM 0 HD11 ILE A 132 -4.362 5.110 9.128 1.00 0.00 H new ATOM 0 HD12 ILE A 132 -2.749 5.776 9.478 1.00 0.00 H new ATOM 0 HD13 ILE A 132 -2.913 4.342 8.438 1.00 0.00 H new ATOM 2179 N GLN A 133 -1.108 3.332 14.446 1.00 0.00 N ATOM 2180 CA GLN A 133 -1.109 4.082 15.692 1.00 0.00 C ATOM 2181 C GLN A 133 -2.516 4.159 16.283 1.00 0.00 C ATOM 2182 O GLN A 133 -3.387 3.343 15.974 1.00 0.00 O ATOM 2183 CB GLN A 133 -0.541 5.499 15.492 1.00 0.00 C ATOM 2184 CG GLN A 133 0.942 5.542 15.135 1.00 0.00 C ATOM 2185 CD GLN A 133 1.220 5.349 13.655 1.00 0.00 C ATOM 2186 OE1 GLN A 133 0.323 5.830 12.806 1.00 0.00 O flip ATOM 2187 NE2 GLN A 133 2.249 4.793 13.276 1.00 0.00 N flip ATOM 0 H GLN A 133 -0.503 2.511 14.460 1.00 0.00 H new ATOM 0 HA GLN A 133 -0.465 3.550 16.393 1.00 0.00 H new ATOM 0 HB2 GLN A 133 -1.106 5.995 14.703 1.00 0.00 H new ATOM 0 HB3 GLN A 133 -0.699 6.072 16.406 1.00 0.00 H new ATOM 0 HG2 GLN A 133 1.355 6.500 15.451 1.00 0.00 H new ATOM 0 HG3 GLN A 133 1.465 4.768 15.698 1.00 0.00 H new ATOM 0 HE21 GLN A 133 2.917 4.435 13.959 1.00 0.00 H new ATOM 0 HE22 GLN A 133 2.435 4.690 12.278 1.00 0.00 H new