USER MOD reduce.3.24.130724 H: found=0, std=0, add=973, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 974 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 38 LYS NZ :NH3+ -120:sc= -1.24 (180deg=1.03) USER MOD Set 1.2: A 109 TYR OH : rot 180:sc= 0 USER MOD Set 1.3: A 117 GLN : amide:sc= -1.82 K(o=-3.1,f=0.73!) USER MOD Set 2.1: A 86 HIS : no HD1:sc= -3.85! C(o=-4.6!,f=-11!) USER MOD Set 2.2: A 90 GLN : amide:sc= -0.731 K(o=-4.6,f=-7.1!) USER MOD Set 3.1: A 41 SER OG : rot 180:sc= 0.408 USER MOD Set 3.2: A 53 LYS NZ :NH3+ -164:sc= -1.18! (180deg=-3.27!) USER MOD Single : A 14 SER OG : rot 27:sc= 0.13 USER MOD Single : A 16 ASN : amide:sc= -0.124 K(o=-0.12,f=-1.2) USER MOD Single : A 18 ASN : amide:sc= -0.239 K(o=-0.24,f=-5.1!) USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot -51:sc= 0.429 USER MOD Single : A 29 ASN : amide:sc= 1.39 K(o=1.4,f=-4.2!) USER MOD Single : A 30 GLN : amide:sc= -3.46! C(o=-3.5!,f=-4.3!) USER MOD Single : A 33 LYS NZ :NH3+ -133:sc= -0.362 (180deg=-2.76!) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 45 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 GLN : amide:sc= -1.11 K(o=-1.1,f=-0.078) USER MOD Single : A 52 SER OG : rot 85:sc= 1.25 USER MOD Single : A 60 THR OG1 : rot -27:sc= 0.126 USER MOD Single : A 68 LYS NZ :NH3+ -170:sc=-2.48e-05 (180deg=-0.117) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 HIS : no HD1:sc= -0.0628 X(o=-0.063,f=0) USER MOD Single : A 83 SER OG : rot -46:sc= 0.0984 USER MOD Single : A 84 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 97 ASN : amide:sc= 0 X(o=0,f=-0.48) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 HIS : no HE2:sc= 0.9 K(o=0.9,f=-4.8!) USER MOD Single : A 106 THR OG1 : rot -150:sc= 0.00241 USER MOD Single : A 108 CYS SG : rot 9:sc= -0.307 USER MOD Single : A 114 ASN : amide:sc= -0.928 K(o=-0.93,f=-3.2!) USER MOD Single : A 116 TYR OH : rot -62:sc= 0.585 USER MOD Single : A 121 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 CYS SG : rot -32:sc= 0.205 USER MOD Single : A 128 ASN : amide:sc= -0.544! X(o=-0.54!,f=-0.38) USER MOD Single : A 129 MET CE :methyl -172:sc= 0 (180deg=-0.0877) USER MOD Single : A 133 LYS NZ :NH3+ 145:sc= 2.33 (180deg=0.959) USER MOD Single : A 134 SER OG : rot -53:sc= 0.121 USER MOD Single : A 138 THR OG1 : rot 116:sc= 0.908 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 14 3.036 32.983 17.801 1.00 0.00 N ATOM 2 CA SER A 14 3.930 31.915 17.311 1.00 0.00 C ATOM 3 C SER A 14 3.374 30.547 17.686 1.00 0.00 C ATOM 4 O SER A 14 3.872 29.889 18.604 1.00 0.00 O ATOM 5 CB SER A 14 5.324 32.097 17.910 1.00 0.00 C ATOM 6 OG SER A 14 5.832 33.395 17.638 1.00 0.00 O ATOM 0 HA SER A 14 3.995 31.977 16.225 1.00 0.00 H new ATOM 0 HB2 SER A 14 5.284 31.937 18.987 1.00 0.00 H new ATOM 0 HB3 SER A 14 6.000 31.346 17.501 1.00 0.00 H new ATOM 0 HG SER A 14 5.086 34.020 17.518 1.00 0.00 H new ATOM 12 N LEU A 15 2.338 30.117 16.979 1.00 0.00 N ATOM 13 CA LEU A 15 1.697 28.845 17.269 1.00 0.00 C ATOM 14 C LEU A 15 1.758 27.919 16.060 1.00 0.00 C ATOM 15 O LEU A 15 1.020 28.091 15.089 1.00 0.00 O ATOM 16 CB LEU A 15 0.243 29.067 17.692 1.00 0.00 C ATOM 17 CG LEU A 15 0.056 29.911 18.956 1.00 0.00 C ATOM 18 CD1 LEU A 15 -1.420 30.118 19.246 1.00 0.00 C ATOM 19 CD2 LEU A 15 0.737 29.256 20.146 1.00 0.00 C ATOM 0 H LEU A 15 1.925 30.631 16.201 1.00 0.00 H new ATOM 0 HA LEU A 15 2.235 28.372 18.091 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -0.289 29.548 16.871 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -0.226 28.096 17.850 1.00 0.00 H new ATOM 0 HG LEU A 15 0.518 30.883 18.785 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -1.533 30.720 20.148 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -1.887 30.632 18.406 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -1.901 29.151 19.393 1.00 0.00 H new ATOM 0 HD21 LEU A 15 0.592 29.872 21.033 1.00 0.00 H new ATOM 0 HD22 LEU A 15 0.305 28.270 20.315 1.00 0.00 H new ATOM 0 HD23 LEU A 15 1.804 29.156 19.945 1.00 0.00 H new ATOM 31 N ASN A 16 2.639 26.934 16.128 1.00 0.00 N ATOM 32 CA ASN A 16 2.781 25.961 15.054 1.00 0.00 C ATOM 33 C ASN A 16 1.885 24.767 15.347 1.00 0.00 C ATOM 34 O ASN A 16 2.358 23.650 15.584 1.00 0.00 O ATOM 35 CB ASN A 16 4.242 25.524 14.904 1.00 0.00 C ATOM 36 CG ASN A 16 5.137 26.654 14.434 1.00 0.00 C ATOM 37 OD1 ASN A 16 4.690 27.570 13.745 1.00 0.00 O ATOM 38 ND2 ASN A 16 6.408 26.601 14.797 1.00 0.00 N ATOM 0 H ASN A 16 3.268 26.786 16.917 1.00 0.00 H new ATOM 0 HA ASN A 16 2.479 26.416 14.111 1.00 0.00 H new ATOM 0 HB2 ASN A 16 4.606 25.149 15.860 1.00 0.00 H new ATOM 0 HB3 ASN A 16 4.301 24.698 14.195 1.00 0.00 H new ATOM 0 HD21 ASN A 16 7.053 27.335 14.505 1.00 0.00 H new ATOM 0 HD22 ASN A 16 6.743 25.826 15.369 1.00 0.00 H new ATOM 45 N GLU A 17 0.584 25.027 15.331 1.00 0.00 N ATOM 46 CA GLU A 17 -0.407 24.064 15.784 1.00 0.00 C ATOM 47 C GLU A 17 -0.808 23.086 14.681 1.00 0.00 C ATOM 48 O GLU A 17 -0.623 21.878 14.819 1.00 0.00 O ATOM 49 CB GLU A 17 -1.641 24.805 16.302 1.00 0.00 C ATOM 50 CG GLU A 17 -2.626 23.906 17.025 1.00 0.00 C ATOM 51 CD GLU A 17 -1.968 23.147 18.156 1.00 0.00 C ATOM 52 OE1 GLU A 17 -1.733 23.748 19.224 1.00 0.00 O ATOM 53 OE2 GLU A 17 -1.667 21.948 17.973 1.00 0.00 O ATOM 0 H GLU A 17 0.189 25.909 15.005 1.00 0.00 H new ATOM 0 HA GLU A 17 0.041 23.479 16.587 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -1.322 25.599 16.978 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -2.146 25.284 15.463 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -3.445 24.507 17.419 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -3.060 23.200 16.318 1.00 0.00 H new ATOM 60 N ASN A 18 -1.359 23.607 13.592 1.00 0.00 N ATOM 61 CA ASN A 18 -1.898 22.759 12.528 1.00 0.00 C ATOM 62 C ASN A 18 -0.798 22.204 11.624 1.00 0.00 C ATOM 63 O ASN A 18 0.359 22.092 12.033 1.00 0.00 O ATOM 64 CB ASN A 18 -2.944 23.518 11.699 1.00 0.00 C ATOM 65 CG ASN A 18 -2.434 24.829 11.117 1.00 0.00 C ATOM 66 OD1 ASN A 18 -1.240 25.001 10.874 1.00 0.00 O ATOM 67 ND2 ASN A 18 -3.345 25.757 10.875 1.00 0.00 N ATOM 0 H ASN A 18 -1.446 24.609 13.419 1.00 0.00 H new ATOM 0 HA ASN A 18 -2.384 21.911 13.011 1.00 0.00 H new ATOM 0 HB2 ASN A 18 -3.283 22.877 10.885 1.00 0.00 H new ATOM 0 HB3 ASN A 18 -3.812 23.723 12.326 1.00 0.00 H new ATOM 0 HD21 ASN A 18 -3.067 26.652 10.473 1.00 0.00 H new ATOM 0 HD22 ASN A 18 -4.326 25.577 11.090 1.00 0.00 H new ATOM 74 N SER A 19 -1.157 21.852 10.391 1.00 0.00 N ATOM 75 CA SER A 19 -0.217 21.239 9.455 1.00 0.00 C ATOM 76 C SER A 19 0.799 22.250 8.903 1.00 0.00 C ATOM 77 O SER A 19 1.381 22.032 7.841 1.00 0.00 O ATOM 78 CB SER A 19 -0.978 20.592 8.296 1.00 0.00 C ATOM 79 OG SER A 19 -2.038 19.775 8.768 1.00 0.00 O ATOM 0 H SER A 19 -2.097 21.982 10.016 1.00 0.00 H new ATOM 0 HA SER A 19 0.338 20.480 10.007 1.00 0.00 H new ATOM 0 HB2 SER A 19 -1.377 21.367 7.642 1.00 0.00 H new ATOM 0 HB3 SER A 19 -0.292 19.992 7.698 1.00 0.00 H new ATOM 0 HG SER A 19 -2.508 19.376 8.006 1.00 0.00 H new ATOM 85 N GLU A 20 1.006 23.355 9.611 1.00 0.00 N ATOM 86 CA GLU A 20 2.015 24.330 9.220 1.00 0.00 C ATOM 87 C GLU A 20 2.889 24.704 10.411 1.00 0.00 C ATOM 88 O GLU A 20 2.606 25.665 11.130 1.00 0.00 O ATOM 89 CB GLU A 20 1.383 25.589 8.629 1.00 0.00 C ATOM 90 CG GLU A 20 2.411 26.564 8.079 1.00 0.00 C ATOM 91 CD GLU A 20 1.811 27.900 7.705 1.00 0.00 C ATOM 92 OE1 GLU A 20 1.764 28.792 8.574 1.00 0.00 O ATOM 93 OE2 GLU A 20 1.400 28.070 6.541 1.00 0.00 O ATOM 0 H GLU A 20 0.489 23.597 10.457 1.00 0.00 H new ATOM 0 HA GLU A 20 2.633 23.866 8.451 1.00 0.00 H new ATOM 0 HB2 GLU A 20 0.696 25.305 7.832 1.00 0.00 H new ATOM 0 HB3 GLU A 20 0.791 26.087 9.397 1.00 0.00 H new ATOM 0 HG2 GLU A 20 3.193 26.718 8.822 1.00 0.00 H new ATOM 0 HG3 GLU A 20 2.887 26.126 7.201 1.00 0.00 H new ATOM 100 N GLY A 21 3.942 23.931 10.618 1.00 0.00 N ATOM 101 CA GLY A 21 4.902 24.238 11.659 1.00 0.00 C ATOM 102 C GLY A 21 6.262 24.550 11.079 1.00 0.00 C ATOM 103 O GLY A 21 7.196 24.886 11.801 1.00 0.00 O ATOM 0 H GLY A 21 4.151 23.090 10.080 1.00 0.00 H new ATOM 0 HA2 GLY A 21 4.549 25.089 12.242 1.00 0.00 H new ATOM 0 HA3 GLY A 21 4.982 23.393 12.344 1.00 0.00 H new ATOM 107 N THR A 22 6.360 24.449 9.759 1.00 0.00 N ATOM 108 CA THR A 22 7.614 24.658 9.058 1.00 0.00 C ATOM 109 C THR A 22 7.351 24.752 7.551 1.00 0.00 C ATOM 110 O THR A 22 8.009 24.104 6.736 1.00 0.00 O ATOM 111 CB THR A 22 8.608 23.510 9.382 1.00 0.00 C ATOM 112 OG1 THR A 22 9.857 23.710 8.710 1.00 0.00 O ATOM 113 CG2 THR A 22 8.029 22.149 9.001 1.00 0.00 C ATOM 0 H THR A 22 5.574 24.221 9.150 1.00 0.00 H new ATOM 0 HA THR A 22 8.064 25.594 9.390 1.00 0.00 H new ATOM 0 HB THR A 22 8.779 23.524 10.458 1.00 0.00 H new ATOM 0 HG1 THR A 22 9.694 23.874 7.758 1.00 0.00 H new ATOM 0 HG21 THR A 22 8.750 21.367 9.241 1.00 0.00 H new ATOM 0 HG22 THR A 22 7.108 21.977 9.558 1.00 0.00 H new ATOM 0 HG23 THR A 22 7.816 22.131 7.932 1.00 0.00 H new ATOM 121 N GLY A 23 6.375 25.577 7.185 1.00 0.00 N ATOM 122 CA GLY A 23 5.913 25.614 5.810 1.00 0.00 C ATOM 123 C GLY A 23 4.792 24.620 5.613 1.00 0.00 C ATOM 124 O GLY A 23 3.663 24.988 5.287 1.00 0.00 O ATOM 0 H GLY A 23 5.896 26.220 7.816 1.00 0.00 H new ATOM 0 HA2 GLY A 23 5.568 26.617 5.561 1.00 0.00 H new ATOM 0 HA3 GLY A 23 6.737 25.383 5.135 1.00 0.00 H new ATOM 128 N VAL A 24 5.112 23.354 5.819 1.00 0.00 N ATOM 129 CA VAL A 24 4.109 22.318 5.932 1.00 0.00 C ATOM 130 C VAL A 24 4.279 21.670 7.308 1.00 0.00 C ATOM 131 O VAL A 24 4.513 22.368 8.299 1.00 0.00 O ATOM 132 CB VAL A 24 4.232 21.261 4.800 1.00 0.00 C ATOM 133 CG1 VAL A 24 3.001 20.361 4.749 1.00 0.00 C ATOM 134 CG2 VAL A 24 4.418 21.942 3.458 1.00 0.00 C ATOM 0 H VAL A 24 6.071 23.020 5.912 1.00 0.00 H new ATOM 0 HA VAL A 24 3.115 22.754 5.828 1.00 0.00 H new ATOM 0 HB VAL A 24 5.104 20.644 5.017 1.00 0.00 H new ATOM 0 HG11 VAL A 24 3.116 19.632 3.947 1.00 0.00 H new ATOM 0 HG12 VAL A 24 2.891 19.840 5.700 1.00 0.00 H new ATOM 0 HG13 VAL A 24 2.114 20.967 4.563 1.00 0.00 H new ATOM 0 HG21 VAL A 24 4.503 21.188 2.676 1.00 0.00 H new ATOM 0 HG22 VAL A 24 3.560 22.583 3.253 1.00 0.00 H new ATOM 0 HG23 VAL A 24 5.325 22.546 3.479 1.00 0.00 H new ATOM 144 N ALA A 25 4.197 20.358 7.368 1.00 0.00 N ATOM 145 CA ALA A 25 4.415 19.628 8.602 1.00 0.00 C ATOM 146 C ALA A 25 5.024 18.278 8.285 1.00 0.00 C ATOM 147 O ALA A 25 6.231 18.086 8.433 1.00 0.00 O ATOM 148 CB ALA A 25 3.117 19.470 9.382 1.00 0.00 C ATOM 0 H ALA A 25 3.978 19.767 6.566 1.00 0.00 H new ATOM 0 HA ALA A 25 5.104 20.192 9.231 1.00 0.00 H new ATOM 0 HB1 ALA A 25 3.310 18.919 10.302 1.00 0.00 H new ATOM 0 HB2 ALA A 25 2.717 20.454 9.626 1.00 0.00 H new ATOM 0 HB3 ALA A 25 2.393 18.924 8.777 1.00 0.00 H new ATOM 154 N LEU A 26 4.197 17.355 7.817 1.00 0.00 N ATOM 155 CA LEU A 26 4.683 16.039 7.437 1.00 0.00 C ATOM 156 C LEU A 26 4.705 15.892 5.911 1.00 0.00 C ATOM 157 O LEU A 26 5.439 15.066 5.373 1.00 0.00 O ATOM 158 CB LEU A 26 3.864 14.925 8.142 1.00 0.00 C ATOM 159 CG LEU A 26 2.444 14.595 7.624 1.00 0.00 C ATOM 160 CD1 LEU A 26 1.617 15.850 7.363 1.00 0.00 C ATOM 161 CD2 LEU A 26 2.503 13.701 6.393 1.00 0.00 C ATOM 0 H LEU A 26 3.194 17.492 7.692 1.00 0.00 H new ATOM 0 HA LEU A 26 5.713 15.927 7.777 1.00 0.00 H new ATOM 0 HB2 LEU A 26 4.451 14.008 8.099 1.00 0.00 H new ATOM 0 HB3 LEU A 26 3.775 15.197 9.194 1.00 0.00 H new ATOM 0 HG LEU A 26 1.935 14.044 8.415 1.00 0.00 H new ATOM 0 HD11 LEU A 26 0.629 15.566 7.001 1.00 0.00 H new ATOM 0 HD12 LEU A 26 1.515 16.418 8.288 1.00 0.00 H new ATOM 0 HD13 LEU A 26 2.115 16.465 6.613 1.00 0.00 H new ATOM 0 HD21 LEU A 26 1.491 13.485 6.051 1.00 0.00 H new ATOM 0 HD22 LEU A 26 3.053 14.209 5.601 1.00 0.00 H new ATOM 0 HD23 LEU A 26 3.007 12.768 6.645 1.00 0.00 H new ATOM 173 N GLY A 27 3.908 16.706 5.219 1.00 0.00 N ATOM 174 CA GLY A 27 3.932 16.699 3.766 1.00 0.00 C ATOM 175 C GLY A 27 2.551 16.811 3.139 1.00 0.00 C ATOM 176 O GLY A 27 1.729 15.910 3.281 1.00 0.00 O ATOM 0 H GLY A 27 3.251 17.365 5.636 1.00 0.00 H new ATOM 0 HA2 GLY A 27 4.550 17.526 3.416 1.00 0.00 H new ATOM 0 HA3 GLY A 27 4.406 15.779 3.422 1.00 0.00 H new ATOM 180 N ARG A 28 2.286 17.945 2.487 1.00 0.00 N ATOM 181 CA ARG A 28 1.072 18.138 1.706 1.00 0.00 C ATOM 182 C ARG A 28 0.896 17.087 0.618 1.00 0.00 C ATOM 183 O ARG A 28 0.043 16.202 0.716 1.00 0.00 O ATOM 184 CB ARG A 28 1.124 19.509 1.052 1.00 0.00 C ATOM 185 CG ARG A 28 0.989 20.634 2.037 1.00 0.00 C ATOM 186 CD ARG A 28 -0.481 20.970 2.209 1.00 0.00 C ATOM 187 NE ARG A 28 -0.744 21.913 3.291 1.00 0.00 N ATOM 188 CZ ARG A 28 -1.965 22.360 3.596 1.00 0.00 C ATOM 189 NH1 ARG A 28 -3.017 21.967 2.888 1.00 0.00 N ATOM 190 NH2 ARG A 28 -2.134 23.205 4.598 1.00 0.00 N ATOM 0 H ARG A 28 2.909 18.752 2.488 1.00 0.00 H new ATOM 0 HA ARG A 28 0.227 18.049 2.389 1.00 0.00 H new ATOM 0 HB2 ARG A 28 2.067 19.614 0.516 1.00 0.00 H new ATOM 0 HB3 ARG A 28 0.327 19.583 0.312 1.00 0.00 H new ATOM 0 HG2 ARG A 28 1.424 20.349 2.995 1.00 0.00 H new ATOM 0 HG3 ARG A 28 1.536 21.509 1.686 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -0.861 21.386 1.276 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -1.035 20.051 2.397 1.00 0.00 H new ATOM 0 HE ARG A 28 0.046 22.248 3.843 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -2.894 21.321 2.108 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -3.948 22.311 3.124 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -1.330 23.518 5.142 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -3.068 23.544 4.827 1.00 0.00 H new ATOM 204 N ASN A 29 1.701 17.210 -0.423 1.00 0.00 N ATOM 205 CA ASN A 29 1.556 16.391 -1.608 1.00 0.00 C ATOM 206 C ASN A 29 2.544 15.237 -1.592 1.00 0.00 C ATOM 207 O ASN A 29 3.544 15.270 -0.880 1.00 0.00 O ATOM 208 CB ASN A 29 1.693 17.239 -2.878 1.00 0.00 C ATOM 209 CG ASN A 29 3.055 17.891 -3.050 1.00 0.00 C ATOM 210 OD1 ASN A 29 3.765 18.169 -2.080 1.00 0.00 O ATOM 211 ND2 ASN A 29 3.404 18.180 -4.293 1.00 0.00 N ATOM 0 H ASN A 29 2.470 17.879 -0.468 1.00 0.00 H new ATOM 0 HA ASN A 29 0.554 15.962 -1.609 1.00 0.00 H new ATOM 0 HB2 ASN A 29 1.492 16.609 -3.745 1.00 0.00 H new ATOM 0 HB3 ASN A 29 0.930 18.017 -2.866 1.00 0.00 H new ATOM 0 HD21 ASN A 29 4.290 18.650 -4.478 1.00 0.00 H new ATOM 0 HD22 ASN A 29 2.787 17.932 -5.067 1.00 0.00 H new ATOM 218 N GLN A 30 2.232 14.216 -2.376 1.00 0.00 N ATOM 219 CA GLN A 30 2.867 12.911 -2.266 1.00 0.00 C ATOM 220 C GLN A 30 4.195 12.817 -3.032 1.00 0.00 C ATOM 221 O GLN A 30 4.223 12.805 -4.264 1.00 0.00 O ATOM 222 CB GLN A 30 1.888 11.809 -2.728 1.00 0.00 C ATOM 223 CG GLN A 30 1.435 11.889 -4.187 1.00 0.00 C ATOM 224 CD GLN A 30 0.702 13.174 -4.537 1.00 0.00 C ATOM 225 OE1 GLN A 30 1.311 14.145 -4.978 1.00 0.00 O ATOM 226 NE2 GLN A 30 -0.601 13.197 -4.324 1.00 0.00 N ATOM 0 H GLN A 30 1.527 14.270 -3.111 1.00 0.00 H new ATOM 0 HA GLN A 30 3.114 12.764 -1.215 1.00 0.00 H new ATOM 0 HB2 GLN A 30 2.360 10.840 -2.566 1.00 0.00 H new ATOM 0 HB3 GLN A 30 1.004 11.844 -2.091 1.00 0.00 H new ATOM 0 HG2 GLN A 30 2.307 11.793 -4.833 1.00 0.00 H new ATOM 0 HG3 GLN A 30 0.784 11.041 -4.402 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -1.072 12.370 -3.957 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -1.136 14.041 -4.527 1.00 0.00 H new ATOM 235 N PRO A 31 5.312 12.732 -2.281 1.00 0.00 N ATOM 236 CA PRO A 31 6.659 12.515 -2.830 1.00 0.00 C ATOM 237 C PRO A 31 6.852 11.098 -3.377 1.00 0.00 C ATOM 238 O PRO A 31 5.879 10.397 -3.658 1.00 0.00 O ATOM 239 CB PRO A 31 7.597 12.752 -1.634 1.00 0.00 C ATOM 240 CG PRO A 31 6.749 13.360 -0.568 1.00 0.00 C ATOM 241 CD PRO A 31 5.355 12.873 -0.817 1.00 0.00 C ATOM 0 HA PRO A 31 6.850 13.178 -3.674 1.00 0.00 H new ATOM 0 HB2 PRO A 31 8.042 11.817 -1.294 1.00 0.00 H new ATOM 0 HB3 PRO A 31 8.418 13.415 -1.906 1.00 0.00 H new ATOM 0 HG2 PRO A 31 7.095 13.062 0.422 1.00 0.00 H new ATOM 0 HG3 PRO A 31 6.794 14.448 -0.607 1.00 0.00 H new ATOM 0 HD2 PRO A 31 5.162 11.925 -0.314 1.00 0.00 H new ATOM 0 HD3 PRO A 31 4.609 13.582 -0.457 1.00 0.00 H new ATOM 249 N LEU A 32 8.116 10.712 -3.561 1.00 0.00 N ATOM 250 CA LEU A 32 8.490 9.399 -4.104 1.00 0.00 C ATOM 251 C LEU A 32 7.636 8.257 -3.539 1.00 0.00 C ATOM 252 O LEU A 32 7.347 8.204 -2.343 1.00 0.00 O ATOM 253 CB LEU A 32 9.972 9.101 -3.825 1.00 0.00 C ATOM 254 CG LEU A 32 10.994 9.975 -4.569 1.00 0.00 C ATOM 255 CD1 LEU A 32 11.043 11.384 -3.993 1.00 0.00 C ATOM 256 CD2 LEU A 32 12.373 9.334 -4.515 1.00 0.00 C ATOM 0 H LEU A 32 8.916 11.303 -3.337 1.00 0.00 H new ATOM 0 HA LEU A 32 8.312 9.451 -5.178 1.00 0.00 H new ATOM 0 HB2 LEU A 32 10.147 9.207 -2.754 1.00 0.00 H new ATOM 0 HB3 LEU A 32 10.165 8.058 -4.078 1.00 0.00 H new ATOM 0 HG LEU A 32 10.677 10.050 -5.609 1.00 0.00 H new ATOM 0 HD11 LEU A 32 11.776 11.976 -4.542 1.00 0.00 H new ATOM 0 HD12 LEU A 32 10.061 11.848 -4.083 1.00 0.00 H new ATOM 0 HD13 LEU A 32 11.328 11.338 -2.942 1.00 0.00 H new ATOM 0 HD21 LEU A 32 13.088 9.963 -5.046 1.00 0.00 H new ATOM 0 HD22 LEU A 32 12.685 9.228 -3.476 1.00 0.00 H new ATOM 0 HD23 LEU A 32 12.336 8.351 -4.985 1.00 0.00 H new ATOM 268 N LYS A 33 7.266 7.328 -4.414 1.00 0.00 N ATOM 269 CA LYS A 33 6.383 6.227 -4.047 1.00 0.00 C ATOM 270 C LYS A 33 7.188 5.038 -3.550 1.00 0.00 C ATOM 271 O LYS A 33 7.366 4.054 -4.267 1.00 0.00 O ATOM 272 CB LYS A 33 5.525 5.790 -5.241 1.00 0.00 C ATOM 273 CG LYS A 33 4.421 6.762 -5.628 1.00 0.00 C ATOM 274 CD LYS A 33 4.960 8.030 -6.261 1.00 0.00 C ATOM 275 CE LYS A 33 3.926 9.140 -6.228 1.00 0.00 C ATOM 276 NZ LYS A 33 3.653 9.608 -4.843 1.00 0.00 N ATOM 0 H LYS A 33 7.566 7.316 -5.389 1.00 0.00 H new ATOM 0 HA LYS A 33 5.730 6.581 -3.250 1.00 0.00 H new ATOM 0 HB2 LYS A 33 6.176 5.641 -6.102 1.00 0.00 H new ATOM 0 HB3 LYS A 33 5.075 4.824 -5.012 1.00 0.00 H new ATOM 0 HG2 LYS A 33 3.739 6.274 -6.324 1.00 0.00 H new ATOM 0 HG3 LYS A 33 3.841 7.020 -4.742 1.00 0.00 H new ATOM 0 HD2 LYS A 33 5.858 8.350 -5.733 1.00 0.00 H new ATOM 0 HD3 LYS A 33 5.250 7.830 -7.292 1.00 0.00 H new ATOM 0 HE2 LYS A 33 4.275 9.978 -6.831 1.00 0.00 H new ATOM 0 HE3 LYS A 33 3.000 8.786 -6.680 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 2.626 9.672 -4.694 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 4.060 8.935 -4.163 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 4.082 10.545 -4.702 1.00 0.00 H new ATOM 290 N LYS A 34 7.706 5.148 -2.338 1.00 0.00 N ATOM 291 CA LYS A 34 8.457 4.058 -1.735 1.00 0.00 C ATOM 292 C LYS A 34 7.592 3.251 -0.770 1.00 0.00 C ATOM 293 O LYS A 34 7.957 2.145 -0.376 1.00 0.00 O ATOM 294 CB LYS A 34 9.692 4.599 -1.019 1.00 0.00 C ATOM 295 CG LYS A 34 10.760 5.107 -1.975 1.00 0.00 C ATOM 296 CD LYS A 34 11.216 4.006 -2.922 1.00 0.00 C ATOM 297 CE LYS A 34 12.205 4.525 -3.954 1.00 0.00 C ATOM 298 NZ LYS A 34 12.615 3.464 -4.915 1.00 0.00 N ATOM 0 H LYS A 34 7.621 5.979 -1.753 1.00 0.00 H new ATOM 0 HA LYS A 34 8.776 3.389 -2.534 1.00 0.00 H new ATOM 0 HB2 LYS A 34 9.393 5.409 -0.354 1.00 0.00 H new ATOM 0 HB3 LYS A 34 10.116 3.813 -0.394 1.00 0.00 H new ATOM 0 HG2 LYS A 34 10.369 5.946 -2.550 1.00 0.00 H new ATOM 0 HG3 LYS A 34 11.613 5.479 -1.408 1.00 0.00 H new ATOM 0 HD2 LYS A 34 11.677 3.201 -2.349 1.00 0.00 H new ATOM 0 HD3 LYS A 34 10.350 3.581 -3.430 1.00 0.00 H new ATOM 0 HE2 LYS A 34 11.757 5.356 -4.500 1.00 0.00 H new ATOM 0 HE3 LYS A 34 13.087 4.916 -3.447 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 13.289 3.859 -5.601 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 13.065 2.682 -4.398 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 11.777 3.109 -5.418 1.00 0.00 H new ATOM 312 N GLU A 35 6.454 3.811 -0.385 1.00 0.00 N ATOM 313 CA GLU A 35 5.566 3.138 0.552 1.00 0.00 C ATOM 314 C GLU A 35 4.775 2.027 -0.143 1.00 0.00 C ATOM 315 O GLU A 35 4.577 2.042 -1.358 1.00 0.00 O ATOM 316 CB GLU A 35 4.624 4.137 1.237 1.00 0.00 C ATOM 317 CG GLU A 35 3.884 3.540 2.428 1.00 0.00 C ATOM 318 CD GLU A 35 3.307 4.583 3.361 1.00 0.00 C ATOM 319 OE1 GLU A 35 4.096 5.286 4.025 1.00 0.00 O ATOM 320 OE2 GLU A 35 2.071 4.677 3.470 1.00 0.00 O ATOM 0 H GLU A 35 6.126 4.722 -0.704 1.00 0.00 H new ATOM 0 HA GLU A 35 6.183 2.679 1.324 1.00 0.00 H new ATOM 0 HB2 GLU A 35 5.200 5.001 1.570 1.00 0.00 H new ATOM 0 HB3 GLU A 35 3.897 4.500 0.510 1.00 0.00 H new ATOM 0 HG2 GLU A 35 3.078 2.903 2.064 1.00 0.00 H new ATOM 0 HG3 GLU A 35 4.567 2.901 2.987 1.00 0.00 H new ATOM 327 N LYS A 36 4.330 1.081 0.666 1.00 0.00 N ATOM 328 CA LYS A 36 3.697 -0.149 0.199 1.00 0.00 C ATOM 329 C LYS A 36 2.175 -0.012 0.186 1.00 0.00 C ATOM 330 O LYS A 36 1.625 0.845 0.878 1.00 0.00 O ATOM 331 CB LYS A 36 4.101 -1.285 1.144 1.00 0.00 C ATOM 332 CG LYS A 36 3.723 -1.012 2.594 1.00 0.00 C ATOM 333 CD LYS A 36 4.420 -1.949 3.557 1.00 0.00 C ATOM 334 CE LYS A 36 4.026 -1.628 4.986 1.00 0.00 C ATOM 335 NZ LYS A 36 5.205 -1.609 5.893 1.00 0.00 N ATOM 0 H LYS A 36 4.397 1.143 1.682 1.00 0.00 H new ATOM 0 HA LYS A 36 4.025 -0.358 -0.819 1.00 0.00 H new ATOM 0 HB2 LYS A 36 3.625 -2.209 0.817 1.00 0.00 H new ATOM 0 HB3 LYS A 36 5.178 -1.441 1.078 1.00 0.00 H new ATOM 0 HG2 LYS A 36 3.977 0.018 2.845 1.00 0.00 H new ATOM 0 HG3 LYS A 36 2.644 -1.112 2.711 1.00 0.00 H new ATOM 0 HD2 LYS A 36 4.158 -2.981 3.324 1.00 0.00 H new ATOM 0 HD3 LYS A 36 5.500 -1.861 3.442 1.00 0.00 H new ATOM 0 HE2 LYS A 36 3.528 -0.659 5.017 1.00 0.00 H new ATOM 0 HE3 LYS A 36 3.307 -2.367 5.340 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 4.895 -1.386 6.860 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 5.666 -2.541 5.883 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 5.880 -0.886 5.570 1.00 0.00 H new ATOM 349 N PRO A 37 1.472 -0.858 -0.596 1.00 0.00 N ATOM 350 CA PRO A 37 0.009 -0.883 -0.594 1.00 0.00 C ATOM 351 C PRO A 37 -0.534 -1.426 0.724 1.00 0.00 C ATOM 352 O PRO A 37 0.050 -2.334 1.324 1.00 0.00 O ATOM 353 CB PRO A 37 -0.362 -1.809 -1.757 1.00 0.00 C ATOM 354 CG PRO A 37 0.905 -2.033 -2.521 1.00 0.00 C ATOM 355 CD PRO A 37 2.027 -1.842 -1.538 1.00 0.00 C ATOM 0 HA PRO A 37 -0.416 0.115 -0.704 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -0.770 -2.751 -1.391 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -1.125 -1.356 -2.390 1.00 0.00 H new ATOM 0 HG2 PRO A 37 0.929 -3.035 -2.949 1.00 0.00 H new ATOM 0 HG3 PRO A 37 0.989 -1.330 -3.350 1.00 0.00 H new ATOM 0 HD2 PRO A 37 2.291 -2.775 -1.040 1.00 0.00 H new ATOM 0 HD3 PRO A 37 2.931 -1.473 -2.023 1.00 0.00 H new ATOM 363 N LYS A 38 -1.657 -0.885 1.160 1.00 0.00 N ATOM 364 CA LYS A 38 -2.175 -1.171 2.487 1.00 0.00 C ATOM 365 C LYS A 38 -3.454 -1.999 2.416 1.00 0.00 C ATOM 366 O LYS A 38 -4.251 -1.806 1.498 1.00 0.00 O ATOM 367 CB LYS A 38 -2.434 0.146 3.210 1.00 0.00 C ATOM 368 CG LYS A 38 -2.864 -0.007 4.656 1.00 0.00 C ATOM 369 CD LYS A 38 -3.105 1.352 5.280 1.00 0.00 C ATOM 370 CE LYS A 38 -4.193 2.113 4.543 1.00 0.00 C ATOM 371 NZ LYS A 38 -4.171 3.554 4.882 1.00 0.00 N ATOM 0 H LYS A 38 -2.230 -0.243 0.613 1.00 0.00 H new ATOM 0 HA LYS A 38 -1.438 -1.757 3.036 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -1.527 0.750 3.175 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -3.205 0.697 2.671 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -3.773 -0.606 4.711 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -2.096 -0.541 5.216 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -3.388 1.229 6.325 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -2.181 1.930 5.266 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -4.061 1.989 3.468 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -5.167 1.693 4.795 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -5.082 3.825 5.305 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -3.405 3.739 5.561 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -4.011 4.111 4.019 1.00 0.00 H new ATOM 385 N TRP A 39 -3.611 -2.895 3.413 1.00 0.00 N ATOM 386 CA TRP A 39 -4.753 -3.829 3.571 1.00 0.00 C ATOM 387 C TRP A 39 -4.233 -5.231 3.921 1.00 0.00 C ATOM 388 O TRP A 39 -5.003 -6.125 4.273 1.00 0.00 O ATOM 389 CB TRP A 39 -5.641 -3.942 2.315 1.00 0.00 C ATOM 390 CG TRP A 39 -5.202 -5.021 1.365 1.00 0.00 C ATOM 391 CD1 TRP A 39 -4.026 -5.078 0.669 1.00 0.00 C ATOM 392 CD2 TRP A 39 -5.931 -6.203 1.013 1.00 0.00 C ATOM 393 NE1 TRP A 39 -3.986 -6.220 -0.089 1.00 0.00 N ATOM 394 CE2 TRP A 39 -5.142 -6.925 0.104 1.00 0.00 C ATOM 395 CE3 TRP A 39 -7.177 -6.719 1.379 1.00 0.00 C ATOM 396 CZ2 TRP A 39 -5.551 -8.134 -0.447 1.00 0.00 C ATOM 397 CZ3 TRP A 39 -7.584 -7.924 0.834 1.00 0.00 C ATOM 398 CH2 TRP A 39 -6.774 -8.619 -0.073 1.00 0.00 C ATOM 0 H TRP A 39 -2.922 -2.994 4.159 1.00 0.00 H new ATOM 0 HA TRP A 39 -5.368 -3.417 4.371 1.00 0.00 H new ATOM 0 HB2 TRP A 39 -6.669 -4.136 2.623 1.00 0.00 H new ATOM 0 HB3 TRP A 39 -5.640 -2.986 1.792 1.00 0.00 H new ATOM 0 HD1 TRP A 39 -3.245 -4.334 0.710 1.00 0.00 H new ATOM 0 HE1 TRP A 39 -3.217 -6.499 -0.699 1.00 0.00 H new ATOM 0 HE3 TRP A 39 -7.810 -6.187 2.074 1.00 0.00 H new ATOM 0 HZ2 TRP A 39 -4.926 -8.671 -1.145 1.00 0.00 H new ATOM 0 HZ3 TRP A 39 -8.543 -8.336 1.113 1.00 0.00 H new ATOM 0 HH2 TRP A 39 -7.121 -9.555 -0.485 1.00 0.00 H new ATOM 409 N LYS A 40 -2.920 -5.421 3.835 1.00 0.00 N ATOM 410 CA LYS A 40 -2.337 -6.745 3.954 1.00 0.00 C ATOM 411 C LYS A 40 -1.490 -6.867 5.210 1.00 0.00 C ATOM 412 O LYS A 40 -1.190 -5.879 5.879 1.00 0.00 O ATOM 413 CB LYS A 40 -1.508 -7.066 2.703 1.00 0.00 C ATOM 414 CG LYS A 40 -0.381 -6.081 2.412 1.00 0.00 C ATOM 415 CD LYS A 40 0.870 -6.388 3.226 1.00 0.00 C ATOM 416 CE LYS A 40 2.023 -5.470 2.853 1.00 0.00 C ATOM 417 NZ LYS A 40 3.293 -5.856 3.534 1.00 0.00 N ATOM 0 H LYS A 40 -2.243 -4.673 3.683 1.00 0.00 H new ATOM 0 HA LYS A 40 -3.147 -7.470 4.036 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -1.081 -8.063 2.813 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -2.175 -7.099 1.841 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -0.139 -6.111 1.350 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -0.718 -5.068 2.634 1.00 0.00 H new ATOM 0 HD2 LYS A 40 0.649 -6.281 4.288 1.00 0.00 H new ATOM 0 HD3 LYS A 40 1.164 -7.425 3.065 1.00 0.00 H new ATOM 0 HE2 LYS A 40 2.170 -5.494 1.773 1.00 0.00 H new ATOM 0 HE3 LYS A 40 1.768 -4.444 3.117 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 4.051 -5.203 3.250 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 3.163 -5.808 4.565 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 3.552 -6.826 3.262 1.00 0.00 H new ATOM 431 N SER A 41 -1.114 -8.096 5.512 1.00 0.00 N ATOM 432 CA SER A 41 -0.372 -8.409 6.715 1.00 0.00 C ATOM 433 C SER A 41 1.119 -8.221 6.479 1.00 0.00 C ATOM 434 O SER A 41 1.655 -8.664 5.461 1.00 0.00 O ATOM 435 CB SER A 41 -0.665 -9.856 7.103 1.00 0.00 C ATOM 436 OG SER A 41 -2.064 -10.080 7.201 1.00 0.00 O ATOM 0 H SER A 41 -1.316 -8.906 4.927 1.00 0.00 H new ATOM 0 HA SER A 41 -0.675 -7.740 7.520 1.00 0.00 H new ATOM 0 HB2 SER A 41 -0.236 -10.530 6.362 1.00 0.00 H new ATOM 0 HB3 SER A 41 -0.188 -10.085 8.056 1.00 0.00 H new ATOM 0 HG SER A 41 -2.229 -11.014 7.449 1.00 0.00 H new ATOM 442 N ASP A 42 1.777 -7.545 7.412 1.00 0.00 N ATOM 443 CA ASP A 42 3.227 -7.381 7.364 1.00 0.00 C ATOM 444 C ASP A 42 3.894 -8.726 7.604 1.00 0.00 C ATOM 445 O ASP A 42 5.005 -8.983 7.142 1.00 0.00 O ATOM 446 CB ASP A 42 3.704 -6.372 8.413 1.00 0.00 C ATOM 447 CG ASP A 42 3.725 -6.941 9.821 1.00 0.00 C ATOM 448 OD1 ASP A 42 2.639 -7.172 10.390 1.00 0.00 O ATOM 449 OD2 ASP A 42 4.827 -7.151 10.369 1.00 0.00 O ATOM 0 H ASP A 42 1.330 -7.100 8.213 1.00 0.00 H new ATOM 0 HA ASP A 42 3.500 -7.001 6.380 1.00 0.00 H new ATOM 0 HB2 ASP A 42 4.705 -6.030 8.151 1.00 0.00 H new ATOM 0 HB3 ASP A 42 3.053 -5.498 8.390 1.00 0.00 H new ATOM 454 N TYR A 43 3.191 -9.572 8.339 1.00 0.00 N ATOM 455 CA TYR A 43 3.621 -10.933 8.596 1.00 0.00 C ATOM 456 C TYR A 43 2.403 -11.850 8.564 1.00 0.00 C ATOM 457 O TYR A 43 1.789 -12.122 9.597 1.00 0.00 O ATOM 458 CB TYR A 43 4.328 -11.027 9.950 1.00 0.00 C ATOM 459 CG TYR A 43 4.998 -12.356 10.197 1.00 0.00 C ATOM 460 CD1 TYR A 43 6.302 -12.579 9.780 1.00 0.00 C ATOM 461 CD2 TYR A 43 4.331 -13.386 10.848 1.00 0.00 C ATOM 462 CE1 TYR A 43 6.921 -13.789 10.001 1.00 0.00 C ATOM 463 CE2 TYR A 43 4.945 -14.600 11.076 1.00 0.00 C ATOM 464 CZ TYR A 43 6.239 -14.797 10.648 1.00 0.00 C ATOM 465 OH TYR A 43 6.862 -16.001 10.876 1.00 0.00 O ATOM 0 H TYR A 43 2.301 -9.331 8.776 1.00 0.00 H new ATOM 0 HA TYR A 43 4.330 -11.242 7.828 1.00 0.00 H new ATOM 0 HB2 TYR A 43 5.076 -10.236 10.014 1.00 0.00 H new ATOM 0 HB3 TYR A 43 3.602 -10.844 10.742 1.00 0.00 H new ATOM 0 HD1 TYR A 43 6.840 -11.791 9.274 1.00 0.00 H new ATOM 0 HD2 TYR A 43 3.315 -13.234 11.181 1.00 0.00 H new ATOM 0 HE1 TYR A 43 7.936 -13.947 9.669 1.00 0.00 H new ATOM 0 HE2 TYR A 43 4.415 -15.390 11.586 1.00 0.00 H new ATOM 0 HH TYR A 43 6.247 -16.604 11.343 1.00 0.00 H new ATOM 475 N PRO A 44 2.009 -12.293 7.363 1.00 0.00 N ATOM 476 CA PRO A 44 0.843 -13.160 7.180 1.00 0.00 C ATOM 477 C PRO A 44 1.074 -14.548 7.760 1.00 0.00 C ATOM 478 O PRO A 44 2.191 -15.069 7.725 1.00 0.00 O ATOM 479 CB PRO A 44 0.672 -13.230 5.654 1.00 0.00 C ATOM 480 CG PRO A 44 1.537 -12.142 5.108 1.00 0.00 C ATOM 481 CD PRO A 44 2.662 -11.987 6.084 1.00 0.00 C ATOM 0 HA PRO A 44 -0.038 -12.775 7.693 1.00 0.00 H new ATOM 0 HB2 PRO A 44 0.975 -14.204 5.269 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -0.370 -13.084 5.368 1.00 0.00 H new ATOM 0 HG2 PRO A 44 1.911 -12.400 4.117 1.00 0.00 H new ATOM 0 HG3 PRO A 44 0.978 -11.212 5.005 1.00 0.00 H new ATOM 0 HD2 PRO A 44 3.482 -12.673 5.872 1.00 0.00 H new ATOM 0 HD3 PRO A 44 3.077 -10.979 6.070 1.00 0.00 H new ATOM 489 N MET A 45 0.022 -15.134 8.315 1.00 0.00 N ATOM 490 CA MET A 45 0.121 -16.463 8.896 1.00 0.00 C ATOM 491 C MET A 45 -0.946 -17.395 8.331 1.00 0.00 C ATOM 492 O MET A 45 -1.182 -17.412 7.131 1.00 0.00 O ATOM 493 CB MET A 45 0.032 -16.397 10.420 1.00 0.00 C ATOM 494 CG MET A 45 1.329 -16.801 11.094 1.00 0.00 C ATOM 495 SD MET A 45 1.835 -18.478 10.659 1.00 0.00 S ATOM 496 CE MET A 45 3.505 -18.500 11.307 1.00 0.00 C ATOM 0 H MET A 45 -0.905 -14.712 8.375 1.00 0.00 H new ATOM 0 HA MET A 45 1.095 -16.872 8.628 1.00 0.00 H new ATOM 0 HB2 MET A 45 -0.231 -15.383 10.722 1.00 0.00 H new ATOM 0 HB3 MET A 45 -0.771 -17.050 10.763 1.00 0.00 H new ATOM 0 HG2 MET A 45 2.116 -16.102 10.811 1.00 0.00 H new ATOM 0 HG3 MET A 45 1.212 -16.728 12.175 1.00 0.00 H new ATOM 0 HE1 MET A 45 3.956 -19.474 11.116 1.00 0.00 H new ATOM 0 HE2 MET A 45 4.095 -17.725 10.819 1.00 0.00 H new ATOM 0 HE3 MET A 45 3.481 -18.315 12.381 1.00 0.00 H new ATOM 506 N THR A 46 -1.596 -18.158 9.197 1.00 0.00 N ATOM 507 CA THR A 46 -2.499 -19.208 8.755 1.00 0.00 C ATOM 508 C THR A 46 -3.807 -18.650 8.192 1.00 0.00 C ATOM 509 O THR A 46 -4.083 -17.451 8.315 1.00 0.00 O ATOM 510 CB THR A 46 -2.801 -20.186 9.905 1.00 0.00 C ATOM 511 OG1 THR A 46 -3.456 -19.502 10.981 1.00 0.00 O ATOM 512 CG2 THR A 46 -1.515 -20.815 10.419 1.00 0.00 C ATOM 0 H THR A 46 -1.514 -18.069 10.210 1.00 0.00 H new ATOM 0 HA THR A 46 -1.992 -19.740 7.950 1.00 0.00 H new ATOM 0 HB THR A 46 -3.456 -20.969 9.522 1.00 0.00 H new ATOM 0 HG1 THR A 46 -3.644 -20.135 11.705 1.00 0.00 H new ATOM 0 HG21 THR A 46 -1.746 -21.504 11.232 1.00 0.00 H new ATOM 0 HG22 THR A 46 -1.027 -21.359 9.610 1.00 0.00 H new ATOM 0 HG23 THR A 46 -0.848 -20.034 10.784 1.00 0.00 H new ATOM 520 N ASP A 47 -4.604 -19.517 7.579 1.00 0.00 N ATOM 521 CA ASP A 47 -5.858 -19.109 6.948 1.00 0.00 C ATOM 522 C ASP A 47 -6.767 -18.373 7.928 1.00 0.00 C ATOM 523 O ASP A 47 -7.431 -17.407 7.560 1.00 0.00 O ATOM 524 CB ASP A 47 -6.592 -20.319 6.377 1.00 0.00 C ATOM 525 CG ASP A 47 -7.788 -19.922 5.538 1.00 0.00 C ATOM 526 OD1 ASP A 47 -7.605 -19.637 4.337 1.00 0.00 O ATOM 527 OD2 ASP A 47 -8.918 -19.909 6.071 1.00 0.00 O ATOM 0 H ASP A 47 -4.404 -20.514 7.504 1.00 0.00 H new ATOM 0 HA ASP A 47 -5.604 -18.426 6.137 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -5.903 -20.905 5.769 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -6.921 -20.961 7.194 1.00 0.00 H new ATOM 532 N GLY A 48 -6.781 -18.824 9.181 1.00 0.00 N ATOM 533 CA GLY A 48 -7.574 -18.159 10.205 1.00 0.00 C ATOM 534 C GLY A 48 -7.234 -16.685 10.323 1.00 0.00 C ATOM 535 O GLY A 48 -8.113 -15.848 10.539 1.00 0.00 O ATOM 0 H GLY A 48 -6.258 -19.637 9.506 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -8.633 -18.269 9.971 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -7.408 -18.647 11.165 1.00 0.00 H new ATOM 539 N GLN A 49 -5.961 -16.358 10.158 1.00 0.00 N ATOM 540 CA GLN A 49 -5.529 -14.969 10.183 1.00 0.00 C ATOM 541 C GLN A 49 -5.912 -14.285 8.888 1.00 0.00 C ATOM 542 O GLN A 49 -6.326 -13.132 8.893 1.00 0.00 O ATOM 543 CB GLN A 49 -4.024 -14.873 10.397 1.00 0.00 C ATOM 544 CG GLN A 49 -3.581 -15.502 11.696 1.00 0.00 C ATOM 545 CD GLN A 49 -4.130 -14.787 12.918 1.00 0.00 C ATOM 546 OE1 GLN A 49 -4.362 -15.404 13.956 1.00 0.00 O ATOM 547 NE2 GLN A 49 -4.337 -13.483 12.810 1.00 0.00 N ATOM 0 H GLN A 49 -5.212 -17.033 10.006 1.00 0.00 H new ATOM 0 HA GLN A 49 -6.026 -14.470 11.014 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -3.511 -15.361 9.568 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -3.725 -13.825 10.385 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -3.901 -16.544 11.717 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -2.492 -15.502 11.741 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -4.133 -13.005 11.932 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -4.701 -12.957 13.605 1.00 0.00 H new ATOM 556 N LEU A 50 -5.776 -15.009 7.785 1.00 0.00 N ATOM 557 CA LEU A 50 -6.137 -14.489 6.474 1.00 0.00 C ATOM 558 C LEU A 50 -7.607 -14.081 6.436 1.00 0.00 C ATOM 559 O LEU A 50 -7.928 -12.951 6.083 1.00 0.00 O ATOM 560 CB LEU A 50 -5.857 -15.529 5.389 1.00 0.00 C ATOM 561 CG LEU A 50 -6.316 -15.142 3.982 1.00 0.00 C ATOM 562 CD1 LEU A 50 -5.634 -13.862 3.521 1.00 0.00 C ATOM 563 CD2 LEU A 50 -6.040 -16.273 3.007 1.00 0.00 C ATOM 0 H LEU A 50 -5.416 -15.963 7.773 1.00 0.00 H new ATOM 0 HA LEU A 50 -5.527 -13.606 6.284 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -4.785 -15.724 5.363 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -6.344 -16.463 5.669 1.00 0.00 H new ATOM 0 HG LEU A 50 -7.390 -14.961 4.011 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -5.977 -13.608 2.518 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -5.882 -13.051 4.206 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -4.554 -14.009 3.509 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -6.372 -15.983 2.010 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -4.971 -16.483 2.987 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -6.579 -17.166 3.323 1.00 0.00 H new ATOM 575 N ARG A 51 -8.485 -15.002 6.819 1.00 0.00 N ATOM 576 CA ARG A 51 -9.922 -14.752 6.805 1.00 0.00 C ATOM 577 C ARG A 51 -10.287 -13.586 7.727 1.00 0.00 C ATOM 578 O ARG A 51 -11.018 -12.674 7.325 1.00 0.00 O ATOM 579 CB ARG A 51 -10.696 -16.021 7.201 1.00 0.00 C ATOM 580 CG ARG A 51 -10.280 -16.607 8.541 1.00 0.00 C ATOM 581 CD ARG A 51 -11.051 -17.872 8.880 1.00 0.00 C ATOM 582 NE ARG A 51 -10.890 -18.920 7.872 1.00 0.00 N ATOM 583 CZ ARG A 51 -11.733 -19.942 7.716 1.00 0.00 C ATOM 584 NH1 ARG A 51 -12.779 -20.088 8.524 1.00 0.00 N ATOM 585 NH2 ARG A 51 -11.515 -20.830 6.759 1.00 0.00 N ATOM 0 H ARG A 51 -8.225 -15.933 7.145 1.00 0.00 H new ATOM 0 HA ARG A 51 -10.207 -14.478 5.789 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -11.761 -15.790 7.232 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -10.556 -16.776 6.427 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -9.213 -16.828 8.523 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -10.439 -15.866 9.324 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -10.716 -18.249 9.846 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -12.109 -17.631 8.982 1.00 0.00 H new ATOM 0 HE ARG A 51 -10.083 -18.866 7.250 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -12.943 -19.415 9.272 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -13.417 -20.873 8.395 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -10.706 -20.731 6.146 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -12.156 -21.614 6.635 1.00 0.00 H new ATOM 599 N SER A 52 -9.746 -13.598 8.944 1.00 0.00 N ATOM 600 CA SER A 52 -10.043 -12.557 9.919 1.00 0.00 C ATOM 601 C SER A 52 -9.515 -11.207 9.452 1.00 0.00 C ATOM 602 O SER A 52 -10.230 -10.203 9.491 1.00 0.00 O ATOM 603 CB SER A 52 -9.441 -12.914 11.278 1.00 0.00 C ATOM 604 OG SER A 52 -9.846 -14.211 11.691 1.00 0.00 O ATOM 0 H SER A 52 -9.102 -14.316 9.275 1.00 0.00 H new ATOM 0 HA SER A 52 -11.126 -12.486 10.019 1.00 0.00 H new ATOM 0 HB2 SER A 52 -8.353 -12.870 11.220 1.00 0.00 H new ATOM 0 HB3 SER A 52 -9.751 -12.179 12.021 1.00 0.00 H new ATOM 0 HG SER A 52 -9.247 -14.881 11.300 1.00 0.00 H new ATOM 610 N LYS A 53 -8.262 -11.188 9.006 1.00 0.00 N ATOM 611 CA LYS A 53 -7.662 -10.001 8.460 1.00 0.00 C ATOM 612 C LYS A 53 -8.492 -9.484 7.289 1.00 0.00 C ATOM 613 O LYS A 53 -8.776 -8.292 7.202 1.00 0.00 O ATOM 614 CB LYS A 53 -6.239 -10.347 8.022 1.00 0.00 C ATOM 615 CG LYS A 53 -5.409 -9.160 7.596 1.00 0.00 C ATOM 616 CD LYS A 53 -5.792 -8.689 6.212 1.00 0.00 C ATOM 617 CE LYS A 53 -5.280 -9.616 5.125 1.00 0.00 C ATOM 618 NZ LYS A 53 -3.799 -9.659 5.097 1.00 0.00 N ATOM 0 H LYS A 53 -7.645 -12.000 9.018 1.00 0.00 H new ATOM 0 HA LYS A 53 -7.628 -9.209 9.209 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -5.732 -10.852 8.844 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -6.289 -11.055 7.195 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -5.542 -8.346 8.309 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -4.353 -9.428 7.612 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -6.877 -8.617 6.143 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -5.395 -7.687 6.049 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -5.671 -10.620 5.289 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -5.653 -9.283 4.157 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -3.481 -10.071 4.197 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -3.422 -8.694 5.189 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -3.454 -10.242 5.886 1.00 0.00 H new ATOM 632 N ARG A 54 -8.885 -10.396 6.407 1.00 0.00 N ATOM 633 CA ARG A 54 -9.580 -10.040 5.177 1.00 0.00 C ATOM 634 C ARG A 54 -10.805 -9.179 5.459 1.00 0.00 C ATOM 635 O ARG A 54 -10.926 -8.083 4.920 1.00 0.00 O ATOM 636 CB ARG A 54 -9.983 -11.304 4.413 1.00 0.00 C ATOM 637 CG ARG A 54 -10.426 -11.044 2.983 1.00 0.00 C ATOM 638 CD ARG A 54 -10.682 -12.341 2.235 1.00 0.00 C ATOM 639 NE ARG A 54 -10.921 -12.115 0.811 1.00 0.00 N ATOM 640 CZ ARG A 54 -10.481 -12.919 -0.155 1.00 0.00 C ATOM 641 NH1 ARG A 54 -9.797 -14.017 0.144 1.00 0.00 N ATOM 642 NH2 ARG A 54 -10.736 -12.630 -1.424 1.00 0.00 N ATOM 0 H ARG A 54 -8.732 -11.398 6.524 1.00 0.00 H new ATOM 0 HA ARG A 54 -8.896 -9.455 4.562 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -9.140 -11.994 4.402 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -10.793 -11.798 4.950 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -11.333 -10.439 2.986 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -9.661 -10.468 2.463 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -9.826 -13.005 2.358 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -11.543 -12.847 2.671 1.00 0.00 H new ATOM 0 HE ARG A 54 -11.458 -11.291 0.541 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -9.606 -14.249 1.119 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -9.463 -14.628 -0.601 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -11.269 -11.793 -1.659 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -10.399 -13.245 -2.165 1.00 0.00 H new ATOM 656 N ASP A 55 -11.687 -9.646 6.334 1.00 0.00 N ATOM 657 CA ASP A 55 -12.919 -8.916 6.620 1.00 0.00 C ATOM 658 C ASP A 55 -12.630 -7.624 7.370 1.00 0.00 C ATOM 659 O ASP A 55 -13.104 -6.547 6.991 1.00 0.00 O ATOM 660 CB ASP A 55 -13.869 -9.765 7.450 1.00 0.00 C ATOM 661 CG ASP A 55 -14.470 -10.919 6.675 1.00 0.00 C ATOM 662 OD1 ASP A 55 -15.383 -10.679 5.855 1.00 0.00 O ATOM 663 OD2 ASP A 55 -14.043 -12.073 6.887 1.00 0.00 O ATOM 0 H ASP A 55 -11.576 -10.517 6.853 1.00 0.00 H new ATOM 0 HA ASP A 55 -13.383 -8.679 5.663 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -13.334 -10.156 8.315 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -14.672 -9.134 7.830 1.00 0.00 H new ATOM 668 N GLU A 56 -11.854 -7.756 8.437 1.00 0.00 N ATOM 669 CA GLU A 56 -11.511 -6.635 9.311 1.00 0.00 C ATOM 670 C GLU A 56 -10.898 -5.487 8.508 1.00 0.00 C ATOM 671 O GLU A 56 -11.321 -4.338 8.624 1.00 0.00 O ATOM 672 CB GLU A 56 -10.535 -7.115 10.391 1.00 0.00 C ATOM 673 CG GLU A 56 -10.548 -6.299 11.682 1.00 0.00 C ATOM 674 CD GLU A 56 -9.947 -4.920 11.527 1.00 0.00 C ATOM 675 OE1 GLU A 56 -8.711 -4.822 11.398 1.00 0.00 O ATOM 676 OE2 GLU A 56 -10.707 -3.929 11.551 1.00 0.00 O ATOM 0 H GLU A 56 -11.442 -8.644 8.724 1.00 0.00 H new ATOM 0 HA GLU A 56 -12.420 -6.263 9.784 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -10.766 -8.153 10.632 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -9.526 -7.100 9.980 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -11.576 -6.202 12.031 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -9.999 -6.842 12.452 1.00 0.00 H new ATOM 683 N PHE A 57 -9.913 -5.805 7.686 1.00 0.00 N ATOM 684 CA PHE A 57 -9.237 -4.796 6.884 1.00 0.00 C ATOM 685 C PHE A 57 -10.127 -4.282 5.764 1.00 0.00 C ATOM 686 O PHE A 57 -10.118 -3.092 5.465 1.00 0.00 O ATOM 687 CB PHE A 57 -7.947 -5.352 6.307 1.00 0.00 C ATOM 688 CG PHE A 57 -6.807 -5.348 7.290 1.00 0.00 C ATOM 689 CD1 PHE A 57 -6.865 -6.105 8.450 1.00 0.00 C ATOM 690 CD2 PHE A 57 -5.682 -4.572 7.063 1.00 0.00 C ATOM 691 CE1 PHE A 57 -5.826 -6.090 9.360 1.00 0.00 C ATOM 692 CE2 PHE A 57 -4.640 -4.551 7.971 1.00 0.00 C ATOM 693 CZ PHE A 57 -4.712 -5.312 9.121 1.00 0.00 C ATOM 0 H PHE A 57 -9.562 -6.754 7.555 1.00 0.00 H new ATOM 0 HA PHE A 57 -9.004 -3.958 7.541 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -8.120 -6.372 5.965 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -7.666 -4.766 5.432 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -7.735 -6.715 8.645 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -5.618 -3.976 6.165 1.00 0.00 H new ATOM 0 HE1 PHE A 57 -5.886 -6.687 10.258 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -3.770 -3.940 7.781 1.00 0.00 H new ATOM 0 HZ PHE A 57 -3.899 -5.298 9.831 1.00 0.00 H new ATOM 703 N TRP A 58 -10.893 -5.174 5.144 1.00 0.00 N ATOM 704 CA TRP A 58 -11.849 -4.764 4.108 1.00 0.00 C ATOM 705 C TRP A 58 -12.836 -3.730 4.625 1.00 0.00 C ATOM 706 O TRP A 58 -13.434 -2.993 3.848 1.00 0.00 O ATOM 707 CB TRP A 58 -12.616 -5.946 3.519 1.00 0.00 C ATOM 708 CG TRP A 58 -11.970 -6.506 2.294 1.00 0.00 C ATOM 709 CD1 TRP A 58 -11.768 -7.819 2.007 1.00 0.00 C ATOM 710 CD2 TRP A 58 -11.436 -5.760 1.194 1.00 0.00 C ATOM 711 NE1 TRP A 58 -11.138 -7.942 0.791 1.00 0.00 N ATOM 712 CE2 TRP A 58 -10.922 -6.688 0.273 1.00 0.00 C ATOM 713 CE3 TRP A 58 -11.342 -4.394 0.900 1.00 0.00 C ATOM 714 CZ2 TRP A 58 -10.321 -6.292 -0.923 1.00 0.00 C ATOM 715 CZ3 TRP A 58 -10.749 -4.005 -0.281 1.00 0.00 C ATOM 716 CH2 TRP A 58 -10.245 -4.948 -1.180 1.00 0.00 C ATOM 0 H TRP A 58 -10.875 -6.176 5.334 1.00 0.00 H new ATOM 0 HA TRP A 58 -11.249 -4.316 3.316 1.00 0.00 H new ATOM 0 HB2 TRP A 58 -12.698 -6.731 4.271 1.00 0.00 H new ATOM 0 HB3 TRP A 58 -13.630 -5.630 3.276 1.00 0.00 H new ATOM 0 HD1 TRP A 58 -12.059 -8.644 2.640 1.00 0.00 H new ATOM 0 HE1 TRP A 58 -10.874 -8.821 0.346 1.00 0.00 H new ATOM 0 HE3 TRP A 58 -11.728 -3.657 1.588 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 -9.930 -7.018 -1.620 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 -10.672 -2.954 -0.516 1.00 0.00 H new ATOM 0 HH2 TRP A 58 -9.786 -4.611 -2.097 1.00 0.00 H new ATOM 727 N ASP A 59 -13.030 -3.694 5.927 1.00 0.00 N ATOM 728 CA ASP A 59 -13.843 -2.657 6.541 1.00 0.00 C ATOM 729 C ASP A 59 -13.195 -1.277 6.389 1.00 0.00 C ATOM 730 O ASP A 59 -13.880 -0.279 6.168 1.00 0.00 O ATOM 731 CB ASP A 59 -14.043 -2.968 8.020 1.00 0.00 C ATOM 732 CG ASP A 59 -14.627 -1.803 8.796 1.00 0.00 C ATOM 733 OD1 ASP A 59 -15.865 -1.649 8.804 1.00 0.00 O ATOM 734 OD2 ASP A 59 -13.849 -1.040 9.405 1.00 0.00 O ATOM 0 H ASP A 59 -12.637 -4.369 6.583 1.00 0.00 H new ATOM 0 HA ASP A 59 -14.807 -2.638 6.033 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -14.702 -3.830 8.119 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -13.086 -3.247 8.460 1.00 0.00 H new ATOM 739 N THR A 60 -11.872 -1.234 6.487 1.00 0.00 N ATOM 740 CA THR A 60 -11.153 0.030 6.589 1.00 0.00 C ATOM 741 C THR A 60 -10.383 0.384 5.306 1.00 0.00 C ATOM 742 O THR A 60 -10.066 1.551 5.068 1.00 0.00 O ATOM 743 CB THR A 60 -10.179 -0.029 7.780 1.00 0.00 C ATOM 744 OG1 THR A 60 -10.830 -0.659 8.893 1.00 0.00 O ATOM 745 CG2 THR A 60 -9.715 1.362 8.190 1.00 0.00 C ATOM 0 H THR A 60 -11.275 -2.061 6.498 1.00 0.00 H new ATOM 0 HA THR A 60 -11.896 0.813 6.741 1.00 0.00 H new ATOM 0 HB THR A 60 -9.304 -0.603 7.476 1.00 0.00 H new ATOM 0 HG1 THR A 60 -11.798 -0.524 8.825 1.00 0.00 H new ATOM 0 HG21 THR A 60 -9.029 1.283 9.033 1.00 0.00 H new ATOM 0 HG22 THR A 60 -9.206 1.838 7.352 1.00 0.00 H new ATOM 0 HG23 THR A 60 -10.577 1.963 8.479 1.00 0.00 H new ATOM 753 N ALA A 61 -10.078 -0.622 4.485 1.00 0.00 N ATOM 754 CA ALA A 61 -9.333 -0.409 3.241 1.00 0.00 C ATOM 755 C ALA A 61 -10.056 0.535 2.265 1.00 0.00 C ATOM 756 O ALA A 61 -9.516 1.576 1.912 1.00 0.00 O ATOM 757 CB ALA A 61 -9.018 -1.738 2.567 1.00 0.00 C ATOM 0 H ALA A 61 -10.335 -1.594 4.658 1.00 0.00 H new ATOM 0 HA ALA A 61 -8.399 0.080 3.517 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -8.465 -1.557 1.646 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -8.416 -2.352 3.237 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -9.948 -2.258 2.336 1.00 0.00 H new ATOM 763 N PRO A 62 -11.288 0.210 1.823 1.00 0.00 N ATOM 764 CA PRO A 62 -11.985 1.004 0.806 1.00 0.00 C ATOM 765 C PRO A 62 -12.608 2.280 1.370 1.00 0.00 C ATOM 766 O PRO A 62 -13.120 3.114 0.618 1.00 0.00 O ATOM 767 CB PRO A 62 -13.054 0.043 0.300 1.00 0.00 C ATOM 768 CG PRO A 62 -13.390 -0.787 1.486 1.00 0.00 C ATOM 769 CD PRO A 62 -12.111 -0.934 2.267 1.00 0.00 C ATOM 0 HA PRO A 62 -11.310 1.363 0.029 1.00 0.00 H new ATOM 0 HB2 PRO A 62 -13.928 0.579 -0.071 1.00 0.00 H new ATOM 0 HB3 PRO A 62 -12.682 -0.569 -0.522 1.00 0.00 H new ATOM 0 HG2 PRO A 62 -14.163 -0.310 2.089 1.00 0.00 H new ATOM 0 HG3 PRO A 62 -13.777 -1.760 1.184 1.00 0.00 H new ATOM 0 HD2 PRO A 62 -12.293 -0.902 3.341 1.00 0.00 H new ATOM 0 HD3 PRO A 62 -11.621 -1.884 2.055 1.00 0.00 H new ATOM 777 N ALA A 63 -12.578 2.401 2.698 1.00 0.00 N ATOM 778 CA ALA A 63 -13.109 3.569 3.401 1.00 0.00 C ATOM 779 C ALA A 63 -14.629 3.653 3.262 1.00 0.00 C ATOM 780 O ALA A 63 -15.300 2.628 3.142 1.00 0.00 O ATOM 781 CB ALA A 63 -12.433 4.848 2.917 1.00 0.00 C ATOM 0 H ALA A 63 -12.185 1.692 3.316 1.00 0.00 H new ATOM 0 HA ALA A 63 -12.884 3.456 4.462 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -12.844 5.703 3.454 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -11.361 4.785 3.102 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -12.610 4.971 1.849 1.00 0.00 H new ATOM 787 N PHE A 64 -15.165 4.864 3.297 1.00 0.00 N ATOM 788 CA PHE A 64 -16.609 5.060 3.250 1.00 0.00 C ATOM 789 C PHE A 64 -17.086 5.157 1.804 1.00 0.00 C ATOM 790 O PHE A 64 -18.093 4.555 1.425 1.00 0.00 O ATOM 791 CB PHE A 64 -16.987 6.344 3.992 1.00 0.00 C ATOM 792 CG PHE A 64 -16.193 6.584 5.244 1.00 0.00 C ATOM 793 CD1 PHE A 64 -16.518 5.940 6.424 1.00 0.00 C ATOM 794 CD2 PHE A 64 -15.117 7.460 5.237 1.00 0.00 C ATOM 795 CE1 PHE A 64 -15.788 6.161 7.574 1.00 0.00 C ATOM 796 CE2 PHE A 64 -14.382 7.685 6.383 1.00 0.00 C ATOM 797 CZ PHE A 64 -14.717 7.035 7.554 1.00 0.00 C ATOM 0 H PHE A 64 -14.623 5.726 3.358 1.00 0.00 H new ATOM 0 HA PHE A 64 -17.088 4.206 3.729 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -16.852 7.192 3.321 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -18.046 6.305 4.248 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -17.353 5.256 6.446 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -14.852 7.972 4.324 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -16.053 5.652 8.489 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -13.546 8.368 6.364 1.00 0.00 H new ATOM 0 HZ PHE A 64 -14.144 7.209 8.453 1.00 0.00 H new ATOM 807 N GLU A 65 -16.333 5.905 1.008 1.00 0.00 N ATOM 808 CA GLU A 65 -16.652 6.140 -0.391 1.00 0.00 C ATOM 809 C GLU A 65 -15.575 7.018 -1.005 1.00 0.00 C ATOM 810 O GLU A 65 -14.589 7.357 -0.345 1.00 0.00 O ATOM 811 CB GLU A 65 -18.009 6.839 -0.539 1.00 0.00 C ATOM 812 CG GLU A 65 -18.024 8.276 -0.029 1.00 0.00 C ATOM 813 CD GLU A 65 -19.265 9.039 -0.444 1.00 0.00 C ATOM 814 OE1 GLU A 65 -19.306 9.540 -1.590 1.00 0.00 O ATOM 815 OE2 GLU A 65 -20.194 9.165 0.384 1.00 0.00 O ATOM 0 H GLU A 65 -15.479 6.368 1.318 1.00 0.00 H new ATOM 0 HA GLU A 65 -16.700 5.177 -0.900 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -18.296 6.834 -1.591 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -18.763 6.265 -0.000 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -17.955 8.270 1.059 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -17.142 8.797 -0.402 1.00 0.00 H new ATOM 822 N GLY A 66 -15.768 7.391 -2.255 1.00 0.00 N ATOM 823 CA GLY A 66 -14.866 8.306 -2.905 1.00 0.00 C ATOM 824 C GLY A 66 -15.486 8.905 -4.142 1.00 0.00 C ATOM 825 O GLY A 66 -16.694 8.776 -4.367 1.00 0.00 O ATOM 0 H GLY A 66 -16.543 7.072 -2.836 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -14.591 9.102 -2.212 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -13.947 7.785 -3.173 1.00 0.00 H new ATOM 829 N ARG A 67 -14.673 9.570 -4.938 1.00 0.00 N ATOM 830 CA ARG A 67 -15.124 10.090 -6.211 1.00 0.00 C ATOM 831 C ARG A 67 -14.615 9.190 -7.328 1.00 0.00 C ATOM 832 O ARG A 67 -13.410 9.036 -7.511 1.00 0.00 O ATOM 833 CB ARG A 67 -14.649 11.528 -6.403 1.00 0.00 C ATOM 834 CG ARG A 67 -15.187 12.457 -5.334 1.00 0.00 C ATOM 835 CD ARG A 67 -16.700 12.561 -5.389 1.00 0.00 C ATOM 836 NE ARG A 67 -17.252 13.186 -4.187 1.00 0.00 N ATOM 837 CZ ARG A 67 -17.799 12.509 -3.174 1.00 0.00 C ATOM 838 NH1 ARG A 67 -17.868 11.182 -3.213 1.00 0.00 N ATOM 839 NH2 ARG A 67 -18.286 13.165 -2.129 1.00 0.00 N ATOM 0 H ARG A 67 -13.694 9.763 -4.724 1.00 0.00 H new ATOM 0 HA ARG A 67 -16.214 10.100 -6.234 1.00 0.00 H new ATOM 0 HB2 ARG A 67 -13.559 11.554 -6.389 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -14.964 11.885 -7.384 1.00 0.00 H new ATOM 0 HG2 ARG A 67 -14.883 12.096 -4.352 1.00 0.00 H new ATOM 0 HG3 ARG A 67 -14.750 13.447 -5.459 1.00 0.00 H new ATOM 0 HD2 ARG A 67 -16.992 13.140 -6.265 1.00 0.00 H new ATOM 0 HD3 ARG A 67 -17.127 11.565 -5.508 1.00 0.00 H new ATOM 0 HE ARG A 67 -17.217 14.203 -4.118 1.00 0.00 H new ATOM 0 HH11 ARG A 67 -17.502 10.676 -4.019 1.00 0.00 H new ATOM 0 HH12 ARG A 67 -18.287 10.670 -2.437 1.00 0.00 H new ATOM 0 HH21 ARG A 67 -18.242 14.184 -2.101 1.00 0.00 H new ATOM 0 HH22 ARG A 67 -18.704 12.651 -1.354 1.00 0.00 H new ATOM 853 N LYS A 68 -15.530 8.567 -8.049 1.00 0.00 N ATOM 854 CA LYS A 68 -15.154 7.642 -9.111 1.00 0.00 C ATOM 855 C LYS A 68 -14.716 8.398 -10.356 1.00 0.00 C ATOM 856 O LYS A 68 -14.085 7.832 -11.246 1.00 0.00 O ATOM 857 CB LYS A 68 -16.272 6.630 -9.436 1.00 0.00 C ATOM 858 CG LYS A 68 -17.680 7.087 -9.081 1.00 0.00 C ATOM 859 CD LYS A 68 -18.069 8.351 -9.819 1.00 0.00 C ATOM 860 CE LYS A 68 -19.377 8.921 -9.296 1.00 0.00 C ATOM 861 NZ LYS A 68 -20.481 7.928 -9.360 1.00 0.00 N ATOM 0 H LYS A 68 -16.536 8.682 -7.922 1.00 0.00 H new ATOM 0 HA LYS A 68 -14.307 7.062 -8.744 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -16.238 6.404 -10.502 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -16.064 5.700 -8.907 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -18.389 6.295 -9.320 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -17.745 7.260 -8.007 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -17.279 9.094 -9.712 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -18.164 8.137 -10.884 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -19.243 9.249 -8.265 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -19.647 9.802 -9.878 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -21.385 8.400 -9.157 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -20.516 7.508 -10.311 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -20.316 7.179 -8.657 1.00 0.00 H new ATOM 875 N GLU A 69 -15.049 9.680 -10.401 1.00 0.00 N ATOM 876 CA GLU A 69 -14.622 10.551 -11.482 1.00 0.00 C ATOM 877 C GLU A 69 -13.096 10.619 -11.535 1.00 0.00 C ATOM 878 O GLU A 69 -12.494 10.570 -12.607 1.00 0.00 O ATOM 879 CB GLU A 69 -15.208 11.959 -11.298 1.00 0.00 C ATOM 880 CG GLU A 69 -16.729 11.988 -11.170 1.00 0.00 C ATOM 881 CD GLU A 69 -17.224 11.904 -9.732 1.00 0.00 C ATOM 882 OE1 GLU A 69 -16.740 11.040 -8.973 1.00 0.00 O ATOM 883 OE2 GLU A 69 -18.121 12.693 -9.363 1.00 0.00 O ATOM 0 H GLU A 69 -15.620 10.142 -9.693 1.00 0.00 H new ATOM 0 HA GLU A 69 -14.988 10.141 -12.423 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -14.770 12.410 -10.407 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -14.913 12.577 -12.146 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -17.105 12.906 -11.621 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -17.149 11.158 -11.738 1.00 0.00 H new ATOM 890 N ILE A 70 -12.473 10.716 -10.367 1.00 0.00 N ATOM 891 CA ILE A 70 -11.021 10.774 -10.279 1.00 0.00 C ATOM 892 C ILE A 70 -10.402 9.372 -10.329 1.00 0.00 C ATOM 893 O ILE A 70 -9.218 9.224 -10.624 1.00 0.00 O ATOM 894 CB ILE A 70 -10.526 11.527 -9.023 1.00 0.00 C ATOM 895 CG1 ILE A 70 -9.008 11.716 -9.128 1.00 0.00 C ATOM 896 CG2 ILE A 70 -10.904 10.796 -7.741 1.00 0.00 C ATOM 897 CD1 ILE A 70 -8.286 11.760 -7.805 1.00 0.00 C ATOM 0 H ILE A 70 -12.952 10.756 -9.467 1.00 0.00 H new ATOM 0 HA ILE A 70 -10.690 11.339 -11.150 1.00 0.00 H new ATOM 0 HB ILE A 70 -11.013 12.501 -8.977 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -8.595 10.903 -9.725 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -8.807 12.642 -9.667 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -10.538 11.357 -6.881 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -11.988 10.705 -7.680 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -10.456 9.802 -7.743 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -7.218 11.896 -7.977 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -8.666 12.591 -7.210 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -8.451 10.825 -7.269 1.00 0.00 H new ATOM 909 N TRP A 71 -11.210 8.353 -10.032 1.00 0.00 N ATOM 910 CA TRP A 71 -10.737 6.963 -9.960 1.00 0.00 C ATOM 911 C TRP A 71 -9.866 6.596 -11.157 1.00 0.00 C ATOM 912 O TRP A 71 -8.844 5.926 -11.011 1.00 0.00 O ATOM 913 CB TRP A 71 -11.926 6.002 -9.929 1.00 0.00 C ATOM 914 CG TRP A 71 -11.930 5.048 -8.772 1.00 0.00 C ATOM 915 CD1 TRP A 71 -12.977 4.807 -7.934 1.00 0.00 C ATOM 916 CD2 TRP A 71 -10.855 4.201 -8.324 1.00 0.00 C ATOM 917 NE1 TRP A 71 -12.626 3.872 -6.993 1.00 0.00 N ATOM 918 CE2 TRP A 71 -11.330 3.488 -7.207 1.00 0.00 C ATOM 919 CE3 TRP A 71 -9.539 3.978 -8.751 1.00 0.00 C ATOM 920 CZ2 TRP A 71 -10.541 2.572 -6.513 1.00 0.00 C ATOM 921 CZ3 TRP A 71 -8.759 3.064 -8.059 1.00 0.00 C ATOM 922 CH2 TRP A 71 -9.264 2.375 -6.953 1.00 0.00 C ATOM 0 H TRP A 71 -12.205 8.463 -9.835 1.00 0.00 H new ATOM 0 HA TRP A 71 -10.145 6.877 -9.049 1.00 0.00 H new ATOM 0 HB2 TRP A 71 -12.847 6.585 -9.905 1.00 0.00 H new ATOM 0 HB3 TRP A 71 -11.936 5.428 -10.856 1.00 0.00 H new ATOM 0 HD1 TRP A 71 -13.944 5.283 -8.001 1.00 0.00 H new ATOM 0 HE1 TRP A 71 -13.233 3.520 -6.253 1.00 0.00 H new ATOM 0 HE3 TRP A 71 -9.140 4.508 -9.603 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 -10.926 2.037 -5.658 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 -7.744 2.881 -8.380 1.00 0.00 H new ATOM 0 HH2 TRP A 71 -8.630 1.671 -6.435 1.00 0.00 H new ATOM 933 N ASP A 72 -10.276 7.040 -12.336 1.00 0.00 N ATOM 934 CA ASP A 72 -9.557 6.742 -13.572 1.00 0.00 C ATOM 935 C ASP A 72 -8.128 7.265 -13.532 1.00 0.00 C ATOM 936 O ASP A 72 -7.223 6.662 -14.107 1.00 0.00 O ATOM 937 CB ASP A 72 -10.282 7.342 -14.768 1.00 0.00 C ATOM 938 CG ASP A 72 -11.582 6.630 -15.064 1.00 0.00 C ATOM 939 OD1 ASP A 72 -11.558 5.616 -15.793 1.00 0.00 O ATOM 940 OD2 ASP A 72 -12.633 7.068 -14.562 1.00 0.00 O ATOM 0 H ASP A 72 -11.110 7.613 -12.466 1.00 0.00 H new ATOM 0 HA ASP A 72 -9.523 5.657 -13.672 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -10.482 8.396 -14.578 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -9.636 7.294 -15.644 1.00 0.00 H new ATOM 945 N ALA A 73 -7.924 8.378 -12.846 1.00 0.00 N ATOM 946 CA ALA A 73 -6.600 8.954 -12.716 1.00 0.00 C ATOM 947 C ALA A 73 -5.761 8.115 -11.764 1.00 0.00 C ATOM 948 O ALA A 73 -4.565 7.935 -11.965 1.00 0.00 O ATOM 949 CB ALA A 73 -6.693 10.393 -12.223 1.00 0.00 C ATOM 0 H ALA A 73 -8.661 8.899 -12.371 1.00 0.00 H new ATOM 0 HA ALA A 73 -6.119 8.959 -13.694 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -5.691 10.811 -12.131 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -7.269 10.985 -12.934 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -7.186 10.413 -11.251 1.00 0.00 H new ATOM 955 N LEU A 74 -6.415 7.571 -10.746 1.00 0.00 N ATOM 956 CA LEU A 74 -5.730 6.773 -9.740 1.00 0.00 C ATOM 957 C LEU A 74 -5.190 5.489 -10.352 1.00 0.00 C ATOM 958 O LEU A 74 -4.019 5.142 -10.182 1.00 0.00 O ATOM 959 CB LEU A 74 -6.674 6.443 -8.584 1.00 0.00 C ATOM 960 CG LEU A 74 -7.406 7.645 -7.990 1.00 0.00 C ATOM 961 CD1 LEU A 74 -8.166 7.245 -6.740 1.00 0.00 C ATOM 962 CD2 LEU A 74 -6.426 8.766 -7.699 1.00 0.00 C ATOM 0 H LEU A 74 -7.419 7.668 -10.596 1.00 0.00 H new ATOM 0 HA LEU A 74 -4.894 7.356 -9.355 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -7.413 5.721 -8.932 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -6.102 5.957 -7.794 1.00 0.00 H new ATOM 0 HG LEU A 74 -8.131 8.007 -8.719 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -8.680 8.115 -6.333 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -8.897 6.475 -6.989 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -7.468 6.856 -5.999 1.00 0.00 H new ATOM 0 HD21 LEU A 74 -6.961 9.616 -7.276 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -5.677 8.419 -6.988 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -5.935 9.070 -8.624 1.00 0.00 H new ATOM 974 N LYS A 75 -6.050 4.806 -11.088 1.00 0.00 N ATOM 975 CA LYS A 75 -5.683 3.566 -11.759 1.00 0.00 C ATOM 976 C LYS A 75 -4.694 3.834 -12.897 1.00 0.00 C ATOM 977 O LYS A 75 -3.880 2.976 -13.232 1.00 0.00 O ATOM 978 CB LYS A 75 -6.944 2.876 -12.283 1.00 0.00 C ATOM 979 CG LYS A 75 -7.863 3.824 -13.023 1.00 0.00 C ATOM 980 CD LYS A 75 -9.209 3.197 -13.350 1.00 0.00 C ATOM 981 CE LYS A 75 -9.998 2.845 -12.105 1.00 0.00 C ATOM 982 NZ LYS A 75 -11.293 2.190 -12.435 1.00 0.00 N ATOM 0 H LYS A 75 -7.018 5.091 -11.238 1.00 0.00 H new ATOM 0 HA LYS A 75 -5.190 2.908 -11.043 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -6.658 2.061 -12.948 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -7.484 2.431 -11.447 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -8.020 4.718 -12.419 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -7.381 4.144 -13.947 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -9.790 3.887 -13.962 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -9.053 2.297 -13.945 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -9.406 2.181 -11.475 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -10.186 3.749 -11.526 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -11.802 1.965 -11.556 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -11.869 2.833 -13.015 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -11.114 1.313 -12.965 1.00 0.00 H new ATOM 996 N ALA A 76 -4.762 5.032 -13.474 1.00 0.00 N ATOM 997 CA ALA A 76 -3.827 5.430 -14.524 1.00 0.00 C ATOM 998 C ALA A 76 -2.451 5.713 -13.939 1.00 0.00 C ATOM 999 O ALA A 76 -1.429 5.413 -14.554 1.00 0.00 O ATOM 1000 CB ALA A 76 -4.341 6.653 -15.266 1.00 0.00 C ATOM 0 H ALA A 76 -5.453 5.742 -13.233 1.00 0.00 H new ATOM 0 HA ALA A 76 -3.742 4.605 -15.231 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -3.630 6.932 -16.043 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -5.305 6.424 -15.721 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -4.458 7.481 -14.566 1.00 0.00 H new ATOM 1006 N ALA A 77 -2.427 6.295 -12.749 1.00 0.00 N ATOM 1007 CA ALA A 77 -1.174 6.552 -12.066 1.00 0.00 C ATOM 1008 C ALA A 77 -0.533 5.254 -11.631 1.00 0.00 C ATOM 1009 O ALA A 77 0.656 5.042 -11.846 1.00 0.00 O ATOM 1010 CB ALA A 77 -1.385 7.457 -10.872 1.00 0.00 C ATOM 0 H ALA A 77 -3.258 6.596 -12.241 1.00 0.00 H new ATOM 0 HA ALA A 77 -0.506 7.057 -12.764 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -0.430 7.635 -10.377 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -1.803 8.407 -11.205 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -2.074 6.982 -10.173 1.00 0.00 H new ATOM 1016 N ALA A 78 -1.327 4.394 -11.006 1.00 0.00 N ATOM 1017 CA ALA A 78 -0.892 3.046 -10.685 1.00 0.00 C ATOM 1018 C ALA A 78 -0.355 2.340 -11.925 1.00 0.00 C ATOM 1019 O ALA A 78 0.580 1.559 -11.835 1.00 0.00 O ATOM 1020 CB ALA A 78 -2.036 2.249 -10.082 1.00 0.00 C ATOM 0 H ALA A 78 -2.279 4.610 -10.711 1.00 0.00 H new ATOM 0 HA ALA A 78 -0.087 3.114 -9.953 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -1.693 1.241 -9.847 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -2.379 2.737 -9.170 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -2.858 2.196 -10.796 1.00 0.00 H new ATOM 1026 N HIS A 79 -0.942 2.635 -13.082 1.00 0.00 N ATOM 1027 CA HIS A 79 -0.491 2.043 -14.337 1.00 0.00 C ATOM 1028 C HIS A 79 0.931 2.500 -14.646 1.00 0.00 C ATOM 1029 O HIS A 79 1.816 1.685 -14.900 1.00 0.00 O ATOM 1030 CB HIS A 79 -1.432 2.428 -15.486 1.00 0.00 C ATOM 1031 CG HIS A 79 -1.049 1.849 -16.820 1.00 0.00 C ATOM 1032 ND1 HIS A 79 -1.611 0.703 -17.336 1.00 0.00 N ATOM 1033 CD2 HIS A 79 -0.159 2.275 -17.750 1.00 0.00 C ATOM 1034 CE1 HIS A 79 -1.086 0.451 -18.520 1.00 0.00 C ATOM 1035 NE2 HIS A 79 -0.204 1.391 -18.796 1.00 0.00 N ATOM 0 H HIS A 79 -1.728 3.278 -13.176 1.00 0.00 H new ATOM 0 HA HIS A 79 -0.502 0.958 -14.233 1.00 0.00 H new ATOM 0 HB2 HIS A 79 -2.442 2.102 -15.238 1.00 0.00 H new ATOM 0 HB3 HIS A 79 -1.460 3.514 -15.569 1.00 0.00 H new ATOM 0 HD2 HIS A 79 0.470 3.150 -17.679 1.00 0.00 H new ATOM 0 HE1 HIS A 79 -1.337 -0.385 -19.156 1.00 0.00 H new ATOM 0 HE2 HIS A 79 0.353 1.451 -19.648 1.00 0.00 H new ATOM 1044 N ALA A 80 1.134 3.812 -14.613 1.00 0.00 N ATOM 1045 CA ALA A 80 2.435 4.398 -14.883 1.00 0.00 C ATOM 1046 C ALA A 80 3.455 3.978 -13.836 1.00 0.00 C ATOM 1047 O ALA A 80 4.505 3.437 -14.172 1.00 0.00 O ATOM 1048 CB ALA A 80 2.324 5.907 -14.930 1.00 0.00 C ATOM 0 H ALA A 80 0.405 4.493 -14.400 1.00 0.00 H new ATOM 0 HA ALA A 80 2.778 4.034 -15.851 1.00 0.00 H new ATOM 0 HB1 ALA A 80 3.304 6.338 -15.133 1.00 0.00 H new ATOM 0 HB2 ALA A 80 1.630 6.196 -15.719 1.00 0.00 H new ATOM 0 HB3 ALA A 80 1.957 6.275 -13.972 1.00 0.00 H new ATOM 1054 N PHE A 81 3.139 4.233 -12.571 1.00 0.00 N ATOM 1055 CA PHE A 81 4.012 3.867 -11.457 1.00 0.00 C ATOM 1056 C PHE A 81 4.405 2.382 -11.509 1.00 0.00 C ATOM 1057 O PHE A 81 5.527 2.017 -11.148 1.00 0.00 O ATOM 1058 CB PHE A 81 3.346 4.222 -10.116 1.00 0.00 C ATOM 1059 CG PHE A 81 4.034 3.626 -8.919 1.00 0.00 C ATOM 1060 CD1 PHE A 81 5.353 3.937 -8.636 1.00 0.00 C ATOM 1061 CD2 PHE A 81 3.363 2.751 -8.084 1.00 0.00 C ATOM 1062 CE1 PHE A 81 5.994 3.379 -7.546 1.00 0.00 C ATOM 1063 CE2 PHE A 81 3.996 2.191 -6.989 1.00 0.00 C ATOM 1064 CZ PHE A 81 5.313 2.503 -6.721 1.00 0.00 C ATOM 0 H PHE A 81 2.276 4.697 -12.288 1.00 0.00 H new ATOM 0 HA PHE A 81 4.933 4.444 -11.547 1.00 0.00 H new ATOM 0 HB2 PHE A 81 3.324 5.306 -10.008 1.00 0.00 H new ATOM 0 HB3 PHE A 81 2.310 3.882 -10.134 1.00 0.00 H new ATOM 0 HD1 PHE A 81 5.888 4.624 -9.275 1.00 0.00 H new ATOM 0 HD2 PHE A 81 2.332 2.502 -8.289 1.00 0.00 H new ATOM 0 HE1 PHE A 81 7.025 3.627 -7.339 1.00 0.00 H new ATOM 0 HE2 PHE A 81 3.460 1.510 -6.344 1.00 0.00 H new ATOM 0 HZ PHE A 81 5.811 2.064 -5.869 1.00 0.00 H new ATOM 1074 N GLU A 82 3.490 1.532 -11.967 1.00 0.00 N ATOM 1075 CA GLU A 82 3.787 0.109 -12.138 1.00 0.00 C ATOM 1076 C GLU A 82 4.784 -0.118 -13.262 1.00 0.00 C ATOM 1077 O GLU A 82 5.586 -1.049 -13.219 1.00 0.00 O ATOM 1078 CB GLU A 82 2.518 -0.683 -12.421 1.00 0.00 C ATOM 1079 CG GLU A 82 1.825 -1.168 -11.162 1.00 0.00 C ATOM 1080 CD GLU A 82 2.704 -2.101 -10.354 1.00 0.00 C ATOM 1081 OE1 GLU A 82 2.690 -3.321 -10.627 1.00 0.00 O ATOM 1082 OE2 GLU A 82 3.426 -1.619 -9.457 1.00 0.00 O ATOM 0 H GLU A 82 2.540 1.800 -12.226 1.00 0.00 H new ATOM 0 HA GLU A 82 4.226 -0.241 -11.204 1.00 0.00 H new ATOM 0 HB2 GLU A 82 1.828 -0.061 -12.991 1.00 0.00 H new ATOM 0 HB3 GLU A 82 2.764 -1.541 -13.046 1.00 0.00 H new ATOM 0 HG2 GLU A 82 1.546 -0.311 -10.549 1.00 0.00 H new ATOM 0 HG3 GLU A 82 0.902 -1.682 -11.431 1.00 0.00 H new ATOM 1089 N SER A 83 4.734 0.737 -14.269 1.00 0.00 N ATOM 1090 CA SER A 83 5.662 0.661 -15.381 1.00 0.00 C ATOM 1091 C SER A 83 6.947 1.413 -15.029 1.00 0.00 C ATOM 1092 O SER A 83 7.757 1.733 -15.900 1.00 0.00 O ATOM 1093 CB SER A 83 5.010 1.246 -16.637 1.00 0.00 C ATOM 1094 OG SER A 83 5.699 0.860 -17.816 1.00 0.00 O ATOM 0 H SER A 83 4.056 1.496 -14.338 1.00 0.00 H new ATOM 0 HA SER A 83 5.916 -0.380 -15.580 1.00 0.00 H new ATOM 0 HB2 SER A 83 3.973 0.914 -16.697 1.00 0.00 H new ATOM 0 HB3 SER A 83 4.993 2.333 -16.565 1.00 0.00 H new ATOM 0 HG SER A 83 6.663 0.984 -17.687 1.00 0.00 H new ATOM 1100 N ASN A 84 7.107 1.689 -13.729 1.00 0.00 N ATOM 1101 CA ASN A 84 8.264 2.407 -13.183 1.00 0.00 C ATOM 1102 C ASN A 84 8.208 3.891 -13.512 1.00 0.00 C ATOM 1103 O ASN A 84 9.143 4.639 -13.212 1.00 0.00 O ATOM 1104 CB ASN A 84 9.588 1.810 -13.664 1.00 0.00 C ATOM 1105 CG ASN A 84 9.969 0.548 -12.912 1.00 0.00 C ATOM 1106 OD1 ASN A 84 10.618 0.610 -11.872 1.00 0.00 O ATOM 1107 ND2 ASN A 84 9.589 -0.605 -13.440 1.00 0.00 N ATOM 0 H ASN A 84 6.428 1.416 -13.018 1.00 0.00 H new ATOM 0 HA ASN A 84 8.216 2.292 -12.100 1.00 0.00 H new ATOM 0 HB2 ASN A 84 9.515 1.586 -14.728 1.00 0.00 H new ATOM 0 HB3 ASN A 84 10.379 2.550 -13.547 1.00 0.00 H new ATOM 0 HD21 ASN A 84 9.835 -1.482 -12.981 1.00 0.00 H new ATOM 0 HD22 ASN A 84 9.050 -0.616 -14.306 1.00 0.00 H new ATOM 1114 N ASP A 85 7.112 4.312 -14.122 1.00 0.00 N ATOM 1115 CA ASP A 85 6.889 5.721 -14.424 1.00 0.00 C ATOM 1116 C ASP A 85 6.463 6.476 -13.172 1.00 0.00 C ATOM 1117 O ASP A 85 5.278 6.689 -12.913 1.00 0.00 O ATOM 1118 CB ASP A 85 5.844 5.882 -15.529 1.00 0.00 C ATOM 1119 CG ASP A 85 6.454 5.814 -16.915 1.00 0.00 C ATOM 1120 OD1 ASP A 85 6.903 6.862 -17.422 1.00 0.00 O ATOM 1121 OD2 ASP A 85 6.490 4.718 -17.511 1.00 0.00 O ATOM 0 H ASP A 85 6.357 3.695 -14.420 1.00 0.00 H new ATOM 0 HA ASP A 85 7.828 6.144 -14.780 1.00 0.00 H new ATOM 0 HB2 ASP A 85 5.089 5.102 -15.428 1.00 0.00 H new ATOM 0 HB3 ASP A 85 5.333 6.837 -15.406 1.00 0.00 H new ATOM 1126 N HIS A 86 7.459 6.888 -12.412 1.00 0.00 N ATOM 1127 CA HIS A 86 7.260 7.633 -11.182 1.00 0.00 C ATOM 1128 C HIS A 86 6.760 9.045 -11.493 1.00 0.00 C ATOM 1129 O HIS A 86 5.877 9.573 -10.807 1.00 0.00 O ATOM 1130 CB HIS A 86 8.589 7.667 -10.414 1.00 0.00 C ATOM 1131 CG HIS A 86 8.637 8.618 -9.261 1.00 0.00 C ATOM 1132 ND1 HIS A 86 9.568 9.625 -9.180 1.00 0.00 N ATOM 1133 CD2 HIS A 86 7.885 8.710 -8.142 1.00 0.00 C ATOM 1134 CE1 HIS A 86 9.392 10.294 -8.061 1.00 0.00 C ATOM 1135 NE2 HIS A 86 8.373 9.765 -7.408 1.00 0.00 N ATOM 0 H HIS A 86 8.439 6.714 -12.633 1.00 0.00 H new ATOM 0 HA HIS A 86 6.503 7.149 -10.565 1.00 0.00 H new ATOM 0 HB2 HIS A 86 8.802 6.664 -10.045 1.00 0.00 H new ATOM 0 HB3 HIS A 86 9.386 7.926 -11.111 1.00 0.00 H new ATOM 0 HD2 HIS A 86 7.055 8.073 -7.874 1.00 0.00 H new ATOM 0 HE1 HIS A 86 9.983 11.136 -7.731 1.00 0.00 H new ATOM 0 HE2 HIS A 86 8.009 10.085 -6.510 1.00 0.00 H new ATOM 1144 N GLU A 87 7.320 9.628 -12.547 1.00 0.00 N ATOM 1145 CA GLU A 87 6.993 10.989 -12.962 1.00 0.00 C ATOM 1146 C GLU A 87 5.508 11.126 -13.306 1.00 0.00 C ATOM 1147 O GLU A 87 4.853 12.082 -12.892 1.00 0.00 O ATOM 1148 CB GLU A 87 7.864 11.381 -14.163 1.00 0.00 C ATOM 1149 CG GLU A 87 7.702 10.459 -15.363 1.00 0.00 C ATOM 1150 CD GLU A 87 8.833 10.582 -16.359 1.00 0.00 C ATOM 1151 OE1 GLU A 87 8.803 11.512 -17.191 1.00 0.00 O ATOM 1152 OE2 GLU A 87 9.759 9.741 -16.316 1.00 0.00 O ATOM 0 H GLU A 87 8.014 9.171 -13.139 1.00 0.00 H new ATOM 0 HA GLU A 87 7.198 11.664 -12.131 1.00 0.00 H new ATOM 0 HB2 GLU A 87 7.617 12.400 -14.463 1.00 0.00 H new ATOM 0 HB3 GLU A 87 8.910 11.384 -13.857 1.00 0.00 H new ATOM 0 HG2 GLU A 87 7.641 9.427 -15.016 1.00 0.00 H new ATOM 0 HG3 GLU A 87 6.759 10.684 -15.862 1.00 0.00 H new ATOM 1159 N LEU A 88 4.985 10.149 -14.038 1.00 0.00 N ATOM 1160 CA LEU A 88 3.601 10.176 -14.485 1.00 0.00 C ATOM 1161 C LEU A 88 2.632 10.134 -13.317 1.00 0.00 C ATOM 1162 O LEU A 88 1.745 10.974 -13.214 1.00 0.00 O ATOM 1163 CB LEU A 88 3.320 9.012 -15.429 1.00 0.00 C ATOM 1164 CG LEU A 88 3.658 9.268 -16.898 1.00 0.00 C ATOM 1165 CD1 LEU A 88 3.221 8.089 -17.745 1.00 0.00 C ATOM 1166 CD2 LEU A 88 2.996 10.551 -17.388 1.00 0.00 C ATOM 0 H LEU A 88 5.505 9.323 -14.335 1.00 0.00 H new ATOM 0 HA LEU A 88 3.451 11.116 -15.016 1.00 0.00 H new ATOM 0 HB2 LEU A 88 3.886 8.145 -15.089 1.00 0.00 H new ATOM 0 HB3 LEU A 88 2.264 8.753 -15.356 1.00 0.00 H new ATOM 0 HG LEU A 88 4.738 9.387 -16.990 1.00 0.00 H new ATOM 0 HD11 LEU A 88 3.466 8.281 -18.790 1.00 0.00 H new ATOM 0 HD12 LEU A 88 3.738 7.189 -17.410 1.00 0.00 H new ATOM 0 HD13 LEU A 88 2.145 7.948 -17.645 1.00 0.00 H new ATOM 0 HD21 LEU A 88 3.250 10.714 -18.435 1.00 0.00 H new ATOM 0 HD22 LEU A 88 1.914 10.464 -17.286 1.00 0.00 H new ATOM 0 HD23 LEU A 88 3.350 11.393 -16.794 1.00 0.00 H new ATOM 1178 N ALA A 89 2.818 9.166 -12.428 1.00 0.00 N ATOM 1179 CA ALA A 89 1.894 8.967 -11.321 1.00 0.00 C ATOM 1180 C ALA A 89 1.823 10.196 -10.421 1.00 0.00 C ATOM 1181 O ALA A 89 0.745 10.566 -9.962 1.00 0.00 O ATOM 1182 CB ALA A 89 2.270 7.721 -10.526 1.00 0.00 C ATOM 0 H ALA A 89 3.598 8.509 -12.453 1.00 0.00 H new ATOM 0 HA ALA A 89 0.899 8.817 -11.739 1.00 0.00 H new ATOM 0 HB1 ALA A 89 1.568 7.589 -9.703 1.00 0.00 H new ATOM 0 HB2 ALA A 89 2.233 6.848 -11.178 1.00 0.00 H new ATOM 0 HB3 ALA A 89 3.278 7.834 -10.128 1.00 0.00 H new ATOM 1188 N GLN A 90 2.958 10.838 -10.180 1.00 0.00 N ATOM 1189 CA GLN A 90 2.964 12.063 -9.388 1.00 0.00 C ATOM 1190 C GLN A 90 2.213 13.175 -10.110 1.00 0.00 C ATOM 1191 O GLN A 90 1.402 13.872 -9.507 1.00 0.00 O ATOM 1192 CB GLN A 90 4.390 12.515 -9.076 1.00 0.00 C ATOM 1193 CG GLN A 90 5.185 11.473 -8.318 1.00 0.00 C ATOM 1194 CD GLN A 90 6.276 12.062 -7.446 1.00 0.00 C ATOM 1195 OE1 GLN A 90 6.603 11.499 -6.404 1.00 0.00 O ATOM 1196 NE2 GLN A 90 6.865 13.167 -7.867 1.00 0.00 N ATOM 0 H GLN A 90 3.874 10.538 -10.515 1.00 0.00 H new ATOM 0 HA GLN A 90 2.459 11.848 -8.447 1.00 0.00 H new ATOM 0 HB2 GLN A 90 4.904 12.750 -10.008 1.00 0.00 H new ATOM 0 HB3 GLN A 90 4.355 13.434 -8.491 1.00 0.00 H new ATOM 0 HG2 GLN A 90 4.506 10.892 -7.694 1.00 0.00 H new ATOM 0 HG3 GLN A 90 5.634 10.781 -9.030 1.00 0.00 H new ATOM 0 HE21 GLN A 90 6.565 13.605 -8.738 1.00 0.00 H new ATOM 0 HE22 GLN A 90 7.620 13.582 -7.321 1.00 0.00 H new ATOM 1205 N ALA A 91 2.457 13.302 -11.409 1.00 0.00 N ATOM 1206 CA ALA A 91 1.843 14.355 -12.209 1.00 0.00 C ATOM 1207 C ALA A 91 0.345 14.123 -12.361 1.00 0.00 C ATOM 1208 O ALA A 91 -0.411 15.048 -12.656 1.00 0.00 O ATOM 1209 CB ALA A 91 2.508 14.436 -13.572 1.00 0.00 C ATOM 0 H ALA A 91 3.079 12.686 -11.933 1.00 0.00 H new ATOM 0 HA ALA A 91 1.987 15.303 -11.691 1.00 0.00 H new ATOM 0 HB1 ALA A 91 2.040 15.226 -14.159 1.00 0.00 H new ATOM 0 HB2 ALA A 91 3.568 14.656 -13.447 1.00 0.00 H new ATOM 0 HB3 ALA A 91 2.394 13.484 -14.090 1.00 0.00 H new ATOM 1215 N ILE A 92 -0.079 12.885 -12.167 1.00 0.00 N ATOM 1216 CA ILE A 92 -1.488 12.549 -12.259 1.00 0.00 C ATOM 1217 C ILE A 92 -2.229 12.874 -10.958 1.00 0.00 C ATOM 1218 O ILE A 92 -3.151 13.690 -10.956 1.00 0.00 O ATOM 1219 CB ILE A 92 -1.672 11.063 -12.620 1.00 0.00 C ATOM 1220 CG1 ILE A 92 -1.208 10.809 -14.058 1.00 0.00 C ATOM 1221 CG2 ILE A 92 -3.116 10.641 -12.439 1.00 0.00 C ATOM 1222 CD1 ILE A 92 -1.361 9.373 -14.501 1.00 0.00 C ATOM 0 H ILE A 92 0.532 12.099 -11.945 1.00 0.00 H new ATOM 0 HA ILE A 92 -1.918 13.159 -13.053 1.00 0.00 H new ATOM 0 HB ILE A 92 -1.060 10.463 -11.946 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -1.776 11.450 -14.732 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -0.161 11.098 -14.149 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -3.223 9.588 -12.700 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -3.411 10.789 -11.400 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -3.755 11.242 -13.087 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -1.012 9.270 -15.529 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -0.771 8.727 -13.851 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -2.410 9.084 -14.443 1.00 0.00 H new ATOM 1234 N ILE A 93 -1.819 12.236 -9.863 1.00 0.00 N ATOM 1235 CA ILE A 93 -2.417 12.472 -8.548 1.00 0.00 C ATOM 1236 C ILE A 93 -2.370 13.953 -8.176 1.00 0.00 C ATOM 1237 O ILE A 93 -3.400 14.564 -7.884 1.00 0.00 O ATOM 1238 CB ILE A 93 -1.697 11.645 -7.454 1.00 0.00 C ATOM 1239 CG1 ILE A 93 -1.477 10.202 -7.915 1.00 0.00 C ATOM 1240 CG2 ILE A 93 -2.501 11.653 -6.170 1.00 0.00 C ATOM 1241 CD1 ILE A 93 -2.696 9.576 -8.543 1.00 0.00 C ATOM 0 H ILE A 93 -1.068 11.545 -9.860 1.00 0.00 H new ATOM 0 HA ILE A 93 -3.459 12.156 -8.607 1.00 0.00 H new ATOM 0 HB ILE A 93 -0.726 12.105 -7.272 1.00 0.00 H new ATOM 0 HG12 ILE A 93 -0.657 10.180 -8.633 1.00 0.00 H new ATOM 0 HG13 ILE A 93 -1.169 9.599 -7.060 1.00 0.00 H new ATOM 0 HG21 ILE A 93 -1.981 11.067 -5.412 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -2.617 12.679 -5.820 1.00 0.00 H new ATOM 0 HG23 ILE A 93 -3.484 11.219 -6.353 1.00 0.00 H new ATOM 0 HD11 ILE A 93 -2.466 8.554 -8.845 1.00 0.00 H new ATOM 0 HD12 ILE A 93 -3.513 9.566 -7.821 1.00 0.00 H new ATOM 0 HD13 ILE A 93 -2.993 10.155 -9.418 1.00 0.00 H new ATOM 1253 N ASP A 94 -1.176 14.529 -8.221 1.00 0.00 N ATOM 1254 CA ASP A 94 -0.982 15.936 -7.888 1.00 0.00 C ATOM 1255 C ASP A 94 -1.673 16.821 -8.915 1.00 0.00 C ATOM 1256 O ASP A 94 -2.212 17.879 -8.582 1.00 0.00 O ATOM 1257 CB ASP A 94 0.521 16.241 -7.848 1.00 0.00 C ATOM 1258 CG ASP A 94 0.865 17.585 -7.235 1.00 0.00 C ATOM 1259 OD1 ASP A 94 0.531 18.626 -7.836 1.00 0.00 O ATOM 1260 OD2 ASP A 94 1.518 17.599 -6.170 1.00 0.00 O ATOM 0 H ASP A 94 -0.321 14.040 -8.487 1.00 0.00 H new ATOM 0 HA ASP A 94 -1.419 16.141 -6.911 1.00 0.00 H new ATOM 0 HB2 ASP A 94 1.025 15.457 -7.283 1.00 0.00 H new ATOM 0 HB3 ASP A 94 0.915 16.206 -8.864 1.00 0.00 H new ATOM 1265 N GLY A 95 -1.700 16.355 -10.161 1.00 0.00 N ATOM 1266 CA GLY A 95 -2.305 17.126 -11.227 1.00 0.00 C ATOM 1267 C GLY A 95 -3.812 17.202 -11.095 1.00 0.00 C ATOM 1268 O GLY A 95 -4.462 18.023 -11.747 1.00 0.00 O ATOM 0 H GLY A 95 -1.313 15.456 -10.449 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -1.891 18.134 -11.224 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -2.048 16.679 -12.187 1.00 0.00 H new ATOM 1272 N ALA A 96 -4.371 16.344 -10.248 1.00 0.00 N ATOM 1273 CA ALA A 96 -5.805 16.331 -10.020 1.00 0.00 C ATOM 1274 C ALA A 96 -6.159 17.149 -8.788 1.00 0.00 C ATOM 1275 O ALA A 96 -7.319 17.185 -8.381 1.00 0.00 O ATOM 1276 CB ALA A 96 -6.307 14.903 -9.869 1.00 0.00 C ATOM 0 H ALA A 96 -3.851 15.651 -9.710 1.00 0.00 H new ATOM 0 HA ALA A 96 -6.293 16.781 -10.884 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -7.384 14.912 -9.699 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -6.088 14.342 -10.778 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -5.810 14.430 -9.022 1.00 0.00 H new ATOM 1282 N ASN A 97 -5.139 17.786 -8.189 1.00 0.00 N ATOM 1283 CA ASN A 97 -5.307 18.611 -6.980 1.00 0.00 C ATOM 1284 C ASN A 97 -5.476 17.712 -5.769 1.00 0.00 C ATOM 1285 O ASN A 97 -5.771 18.172 -4.665 1.00 0.00 O ATOM 1286 CB ASN A 97 -6.505 19.567 -7.088 1.00 0.00 C ATOM 1287 CG ASN A 97 -6.374 20.566 -8.219 1.00 0.00 C ATOM 1288 OD1 ASN A 97 -5.276 21.016 -8.549 1.00 0.00 O ATOM 1289 ND2 ASN A 97 -7.496 20.918 -8.826 1.00 0.00 N ATOM 0 H ASN A 97 -4.178 17.744 -8.528 1.00 0.00 H new ATOM 0 HA ASN A 97 -4.411 19.222 -6.873 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -7.415 18.984 -7.231 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -6.617 20.106 -6.147 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -7.471 21.585 -9.597 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -8.386 20.522 -8.523 1.00 0.00 H new ATOM 1296 N ILE A 98 -5.285 16.426 -5.997 1.00 0.00 N ATOM 1297 CA ILE A 98 -5.394 15.424 -4.958 1.00 0.00 C ATOM 1298 C ILE A 98 -4.040 15.222 -4.291 1.00 0.00 C ATOM 1299 O ILE A 98 -3.005 15.199 -4.961 1.00 0.00 O ATOM 1300 CB ILE A 98 -5.932 14.089 -5.540 1.00 0.00 C ATOM 1301 CG1 ILE A 98 -7.454 14.010 -5.394 1.00 0.00 C ATOM 1302 CG2 ILE A 98 -5.264 12.883 -4.901 1.00 0.00 C ATOM 1303 CD1 ILE A 98 -8.210 14.948 -6.309 1.00 0.00 C ATOM 0 H ILE A 98 -5.049 16.047 -6.914 1.00 0.00 H new ATOM 0 HA ILE A 98 -6.104 15.769 -4.206 1.00 0.00 H new ATOM 0 HB ILE A 98 -5.684 14.072 -6.601 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -7.775 12.988 -5.593 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -7.722 14.233 -4.361 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -5.669 11.970 -5.336 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -4.190 12.925 -5.080 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -5.454 12.888 -3.828 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -9.281 14.832 -6.145 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -7.920 15.977 -6.096 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -7.974 14.712 -7.347 1.00 0.00 H new ATOM 1315 N THR A 99 -4.039 15.073 -2.978 1.00 0.00 N ATOM 1316 CA THR A 99 -2.791 14.947 -2.254 1.00 0.00 C ATOM 1317 C THR A 99 -2.752 13.679 -1.425 1.00 0.00 C ATOM 1318 O THR A 99 -3.779 13.046 -1.178 1.00 0.00 O ATOM 1319 CB THR A 99 -2.535 16.141 -1.327 1.00 0.00 C ATOM 1320 OG1 THR A 99 -3.704 16.425 -0.547 1.00 0.00 O ATOM 1321 CG2 THR A 99 -2.119 17.378 -2.106 1.00 0.00 C ATOM 0 H THR A 99 -4.878 15.037 -2.399 1.00 0.00 H new ATOM 0 HA THR A 99 -2.011 14.913 -3.014 1.00 0.00 H new ATOM 0 HB THR A 99 -1.714 15.871 -0.663 1.00 0.00 H new ATOM 0 HG1 THR A 99 -3.527 17.188 0.042 1.00 0.00 H new ATOM 0 HG21 THR A 99 -1.947 18.203 -1.414 1.00 0.00 H new ATOM 0 HG22 THR A 99 -1.202 17.169 -2.658 1.00 0.00 H new ATOM 0 HG23 THR A 99 -2.909 17.650 -2.806 1.00 0.00 H new ATOM 1329 N LEU A 100 -1.551 13.303 -1.024 1.00 0.00 N ATOM 1330 CA LEU A 100 -1.361 12.153 -0.169 1.00 0.00 C ATOM 1331 C LEU A 100 -0.123 12.364 0.700 1.00 0.00 C ATOM 1332 O LEU A 100 1.000 12.336 0.203 1.00 0.00 O ATOM 1333 CB LEU A 100 -1.254 10.884 -1.018 1.00 0.00 C ATOM 1334 CG LEU A 100 -1.547 9.582 -0.289 1.00 0.00 C ATOM 1335 CD1 LEU A 100 -0.422 9.214 0.648 1.00 0.00 C ATOM 1336 CD2 LEU A 100 -2.851 9.715 0.466 1.00 0.00 C ATOM 0 H LEU A 100 -0.689 13.784 -1.281 1.00 0.00 H new ATOM 0 HA LEU A 100 -2.219 12.033 0.492 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -1.941 10.972 -1.859 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -0.248 10.829 -1.433 1.00 0.00 H new ATOM 0 HG LEU A 100 -1.634 8.780 -1.022 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -0.661 8.279 1.154 1.00 0.00 H new ATOM 0 HD12 LEU A 100 0.500 9.093 0.080 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -0.291 10.004 1.388 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -3.065 8.783 0.990 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -2.772 10.528 1.188 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -3.657 9.930 -0.235 1.00 0.00 H new ATOM 1348 N PRO A 101 -0.320 12.569 2.009 1.00 0.00 N ATOM 1349 CA PRO A 101 0.760 12.938 2.938 1.00 0.00 C ATOM 1350 C PRO A 101 1.831 11.851 3.100 1.00 0.00 C ATOM 1351 O PRO A 101 2.971 12.141 3.456 1.00 0.00 O ATOM 1352 CB PRO A 101 0.022 13.168 4.262 1.00 0.00 C ATOM 1353 CG PRO A 101 -1.236 12.384 4.141 1.00 0.00 C ATOM 1354 CD PRO A 101 -1.619 12.464 2.693 1.00 0.00 C ATOM 0 HA PRO A 101 1.314 13.804 2.576 1.00 0.00 H new ATOM 0 HB2 PRO A 101 0.618 12.830 5.110 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -0.186 14.226 4.420 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -1.085 11.350 4.451 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -2.019 12.797 4.778 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -2.173 11.581 2.373 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -2.252 13.328 2.491 1.00 0.00 H new ATOM 1362 N HIS A 102 1.460 10.602 2.832 1.00 0.00 N ATOM 1363 CA HIS A 102 2.389 9.473 2.957 1.00 0.00 C ATOM 1364 C HIS A 102 3.366 9.427 1.785 1.00 0.00 C ATOM 1365 O HIS A 102 4.412 8.787 1.863 1.00 0.00 O ATOM 1366 CB HIS A 102 1.642 8.139 3.016 1.00 0.00 C ATOM 1367 CG HIS A 102 0.946 7.852 4.310 1.00 0.00 C ATOM 1368 ND1 HIS A 102 0.996 6.620 4.913 1.00 0.00 N ATOM 1369 CD2 HIS A 102 0.157 8.621 5.099 1.00 0.00 C ATOM 1370 CE1 HIS A 102 0.276 6.637 6.015 1.00 0.00 C ATOM 1371 NE2 HIS A 102 -0.246 7.841 6.156 1.00 0.00 N ATOM 0 H HIS A 102 0.522 10.342 2.526 1.00 0.00 H new ATOM 0 HA HIS A 102 2.938 9.624 3.886 1.00 0.00 H new ATOM 0 HB2 HIS A 102 0.905 8.119 2.214 1.00 0.00 H new ATOM 0 HB3 HIS A 102 2.351 7.335 2.818 1.00 0.00 H new ATOM 0 HD1 HIS A 102 1.512 5.814 4.561 1.00 0.00 H new ATOM 0 HD2 HIS A 102 -0.106 9.655 4.929 1.00 0.00 H new ATOM 0 HE1 HIS A 102 0.136 5.806 6.690 1.00 0.00 H new ATOM 1380 N GLY A 103 3.016 10.104 0.698 1.00 0.00 N ATOM 1381 CA GLY A 103 3.835 10.054 -0.498 1.00 0.00 C ATOM 1382 C GLY A 103 3.594 8.804 -1.320 1.00 0.00 C ATOM 1383 O GLY A 103 4.318 8.524 -2.272 1.00 0.00 O ATOM 0 H GLY A 103 2.181 10.686 0.623 1.00 0.00 H new ATOM 0 HA2 GLY A 103 3.630 10.932 -1.111 1.00 0.00 H new ATOM 0 HA3 GLY A 103 4.887 10.101 -0.215 1.00 0.00 H new ATOM 1387 N ALA A 104 2.545 8.076 -0.991 1.00 0.00 N ATOM 1388 CA ALA A 104 2.298 6.789 -1.615 1.00 0.00 C ATOM 1389 C ALA A 104 1.380 6.919 -2.818 1.00 0.00 C ATOM 1390 O ALA A 104 0.581 7.848 -2.914 1.00 0.00 O ATOM 1391 CB ALA A 104 1.709 5.820 -0.599 1.00 0.00 C ATOM 0 H ALA A 104 1.851 8.352 -0.297 1.00 0.00 H new ATOM 0 HA ALA A 104 3.252 6.399 -1.970 1.00 0.00 H new ATOM 0 HB1 ALA A 104 1.527 4.857 -1.077 1.00 0.00 H new ATOM 0 HB2 ALA A 104 2.408 5.689 0.227 1.00 0.00 H new ATOM 0 HB3 ALA A 104 0.769 6.219 -0.218 1.00 0.00 H new ATOM 1397 N LEU A 105 1.552 5.992 -3.753 1.00 0.00 N ATOM 1398 CA LEU A 105 0.691 5.888 -4.923 1.00 0.00 C ATOM 1399 C LEU A 105 -0.529 5.067 -4.543 1.00 0.00 C ATOM 1400 O LEU A 105 -1.599 5.189 -5.129 1.00 0.00 O ATOM 1401 CB LEU A 105 1.466 5.218 -6.075 1.00 0.00 C ATOM 1402 CG LEU A 105 0.807 5.267 -7.460 1.00 0.00 C ATOM 1403 CD1 LEU A 105 -0.198 4.139 -7.630 1.00 0.00 C ATOM 1404 CD2 LEU A 105 0.133 6.608 -7.669 1.00 0.00 C ATOM 0 H LEU A 105 2.293 5.292 -3.721 1.00 0.00 H new ATOM 0 HA LEU A 105 0.373 6.876 -5.258 1.00 0.00 H new ATOM 0 HB2 LEU A 105 2.446 5.689 -6.146 1.00 0.00 H new ATOM 0 HB3 LEU A 105 1.632 4.173 -5.813 1.00 0.00 H new ATOM 0 HG LEU A 105 1.586 5.139 -8.212 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -0.649 4.199 -8.621 1.00 0.00 H new ATOM 0 HD12 LEU A 105 0.309 3.180 -7.520 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -0.976 4.227 -6.872 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -0.331 6.632 -8.655 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -0.630 6.755 -6.905 1.00 0.00 H new ATOM 0 HD23 LEU A 105 0.875 7.403 -7.598 1.00 0.00 H new ATOM 1416 N THR A 106 -0.350 4.259 -3.514 1.00 0.00 N ATOM 1417 CA THR A 106 -1.362 3.319 -3.081 1.00 0.00 C ATOM 1418 C THR A 106 -2.318 3.950 -2.076 1.00 0.00 C ATOM 1419 O THR A 106 -3.017 3.253 -1.350 1.00 0.00 O ATOM 1420 CB THR A 106 -0.696 2.090 -2.460 1.00 0.00 C ATOM 1421 OG1 THR A 106 0.176 2.499 -1.399 1.00 0.00 O ATOM 1422 CG2 THR A 106 0.113 1.353 -3.506 1.00 0.00 C ATOM 0 H THR A 106 0.503 4.238 -2.956 1.00 0.00 H new ATOM 0 HA THR A 106 -1.941 3.022 -3.956 1.00 0.00 H new ATOM 0 HB THR A 106 -1.471 1.430 -2.069 1.00 0.00 H new ATOM 0 HG1 THR A 106 0.919 1.864 -1.323 1.00 0.00 H new ATOM 0 HG21 THR A 106 0.583 0.480 -3.054 1.00 0.00 H new ATOM 0 HG22 THR A 106 -0.544 1.033 -4.315 1.00 0.00 H new ATOM 0 HG23 THR A 106 0.883 2.015 -3.903 1.00 0.00 H new ATOM 1430 N GLU A 107 -2.323 5.270 -2.034 1.00 0.00 N ATOM 1431 CA GLU A 107 -3.254 6.026 -1.210 1.00 0.00 C ATOM 1432 C GLU A 107 -3.508 7.356 -1.890 1.00 0.00 C ATOM 1433 O GLU A 107 -2.593 7.918 -2.500 1.00 0.00 O ATOM 1434 CB GLU A 107 -2.699 6.276 0.202 1.00 0.00 C ATOM 1435 CG GLU A 107 -2.399 5.023 1.006 1.00 0.00 C ATOM 1436 CD GLU A 107 -1.971 5.344 2.425 1.00 0.00 C ATOM 1437 OE1 GLU A 107 -1.149 6.263 2.610 1.00 0.00 O ATOM 1438 OE2 GLU A 107 -2.444 4.665 3.363 1.00 0.00 O ATOM 0 H GLU A 107 -1.680 5.852 -2.571 1.00 0.00 H new ATOM 0 HA GLU A 107 -4.174 5.451 -1.103 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -1.784 6.863 0.118 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -3.416 6.882 0.756 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -3.284 4.388 1.030 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -1.612 4.455 0.510 1.00 0.00 H new ATOM 1445 N CYS A 108 -4.734 7.851 -1.815 1.00 0.00 N ATOM 1446 CA CYS A 108 -5.051 9.161 -2.371 1.00 0.00 C ATOM 1447 C CYS A 108 -6.207 9.814 -1.634 1.00 0.00 C ATOM 1448 O CYS A 108 -7.195 9.157 -1.297 1.00 0.00 O ATOM 1449 CB CYS A 108 -5.387 9.070 -3.865 1.00 0.00 C ATOM 1450 SG CYS A 108 -4.020 8.520 -4.914 1.00 0.00 S ATOM 0 H CYS A 108 -5.521 7.371 -1.379 1.00 0.00 H new ATOM 0 HA CYS A 108 -4.161 9.777 -2.246 1.00 0.00 H new ATOM 0 HB2 CYS A 108 -6.225 8.385 -3.994 1.00 0.00 H new ATOM 0 HB3 CYS A 108 -5.720 10.049 -4.209 1.00 0.00 H new ATOM 0 HG CYS A 108 -3.036 8.114 -4.167 1.00 0.00 H new ATOM 1456 N TYR A 109 -6.086 11.116 -1.401 1.00 0.00 N ATOM 1457 CA TYR A 109 -7.144 11.872 -0.754 1.00 0.00 C ATOM 1458 C TYR A 109 -7.635 12.954 -1.690 1.00 0.00 C ATOM 1459 O TYR A 109 -6.868 13.816 -2.141 1.00 0.00 O ATOM 1460 CB TYR A 109 -6.664 12.502 0.563 1.00 0.00 C ATOM 1461 CG TYR A 109 -6.166 11.499 1.576 1.00 0.00 C ATOM 1462 CD1 TYR A 109 -6.632 10.196 1.572 1.00 0.00 C ATOM 1463 CD2 TYR A 109 -5.227 11.856 2.533 1.00 0.00 C ATOM 1464 CE1 TYR A 109 -6.180 9.272 2.485 1.00 0.00 C ATOM 1465 CE2 TYR A 109 -4.766 10.937 3.456 1.00 0.00 C ATOM 1466 CZ TYR A 109 -5.246 9.644 3.430 1.00 0.00 C ATOM 1467 OH TYR A 109 -4.786 8.724 4.347 1.00 0.00 O ATOM 0 H TYR A 109 -5.265 11.667 -1.652 1.00 0.00 H new ATOM 0 HA TYR A 109 -7.957 11.185 -0.519 1.00 0.00 H new ATOM 0 HB2 TYR A 109 -5.865 13.211 0.345 1.00 0.00 H new ATOM 0 HB3 TYR A 109 -7.484 13.071 1.002 1.00 0.00 H new ATOM 0 HD1 TYR A 109 -7.365 9.899 0.837 1.00 0.00 H new ATOM 0 HD2 TYR A 109 -4.851 12.868 2.557 1.00 0.00 H new ATOM 0 HE1 TYR A 109 -6.555 8.259 2.462 1.00 0.00 H new ATOM 0 HE2 TYR A 109 -4.034 11.229 4.194 1.00 0.00 H new ATOM 0 HH TYR A 109 -4.132 9.151 4.939 1.00 0.00 H new ATOM 1477 N ASP A 110 -8.923 12.888 -1.965 1.00 0.00 N ATOM 1478 CA ASP A 110 -9.580 13.812 -2.868 1.00 0.00 C ATOM 1479 C ASP A 110 -9.947 15.085 -2.131 1.00 0.00 C ATOM 1480 O ASP A 110 -10.302 15.045 -0.950 1.00 0.00 O ATOM 1481 CB ASP A 110 -10.822 13.150 -3.468 1.00 0.00 C ATOM 1482 CG ASP A 110 -11.793 14.149 -4.051 1.00 0.00 C ATOM 1483 OD1 ASP A 110 -11.646 14.516 -5.230 1.00 0.00 O ATOM 1484 OD2 ASP A 110 -12.705 14.567 -3.316 1.00 0.00 O ATOM 0 H ASP A 110 -9.547 12.187 -1.565 1.00 0.00 H new ATOM 0 HA ASP A 110 -8.900 14.073 -3.679 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -10.516 12.451 -4.246 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -11.326 12.567 -2.697 1.00 0.00 H new ATOM 1489 N GLU A 111 -9.868 16.198 -2.856 1.00 0.00 N ATOM 1490 CA GLU A 111 -9.962 17.541 -2.283 1.00 0.00 C ATOM 1491 C GLU A 111 -11.258 17.749 -1.508 1.00 0.00 C ATOM 1492 O GLU A 111 -11.309 18.564 -0.584 1.00 0.00 O ATOM 1493 CB GLU A 111 -9.868 18.593 -3.392 1.00 0.00 C ATOM 1494 CG GLU A 111 -11.131 18.710 -4.235 1.00 0.00 C ATOM 1495 CD GLU A 111 -10.982 19.706 -5.365 1.00 0.00 C ATOM 1496 OE1 GLU A 111 -10.035 19.578 -6.166 1.00 0.00 O ATOM 1497 OE2 GLU A 111 -11.797 20.647 -5.439 1.00 0.00 O ATOM 0 H GLU A 111 -9.736 16.195 -3.867 1.00 0.00 H new ATOM 0 HA GLU A 111 -9.131 17.649 -1.586 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -9.650 19.562 -2.943 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -9.029 18.348 -4.043 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -11.381 17.732 -4.647 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -11.963 19.010 -3.598 1.00 0.00 H new ATOM 1504 N LEU A 112 -12.296 17.020 -1.894 1.00 0.00 N ATOM 1505 CA LEU A 112 -13.605 17.155 -1.275 1.00 0.00 C ATOM 1506 C LEU A 112 -13.625 16.465 0.086 1.00 0.00 C ATOM 1507 O LEU A 112 -14.550 16.650 0.876 1.00 0.00 O ATOM 1508 CB LEU A 112 -14.669 16.553 -2.192 1.00 0.00 C ATOM 1509 CG LEU A 112 -14.592 17.013 -3.653 1.00 0.00 C ATOM 1510 CD1 LEU A 112 -15.528 16.188 -4.521 1.00 0.00 C ATOM 1511 CD2 LEU A 112 -14.923 18.492 -3.765 1.00 0.00 C ATOM 0 H LEU A 112 -12.255 16.324 -2.639 1.00 0.00 H new ATOM 0 HA LEU A 112 -13.820 18.213 -1.124 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -14.582 15.467 -2.162 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -15.653 16.805 -1.798 1.00 0.00 H new ATOM 0 HG LEU A 112 -13.573 16.863 -4.008 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -15.460 16.528 -5.554 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -15.244 15.137 -4.466 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -16.552 16.306 -4.166 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -14.863 18.800 -4.809 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -15.932 18.668 -3.392 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -14.212 19.070 -3.175 1.00 0.00 H new ATOM 1523 N GLY A 113 -12.592 15.681 0.357 1.00 0.00 N ATOM 1524 CA GLY A 113 -12.503 14.973 1.617 1.00 0.00 C ATOM 1525 C GLY A 113 -12.695 13.482 1.451 1.00 0.00 C ATOM 1526 O GLY A 113 -13.197 12.809 2.350 1.00 0.00 O ATOM 0 H GLY A 113 -11.809 15.522 -0.278 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -11.530 15.164 2.071 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -13.256 15.360 2.303 1.00 0.00 H new ATOM 1530 N ASN A 114 -12.304 12.959 0.298 1.00 0.00 N ATOM 1531 CA ASN A 114 -12.459 11.535 0.025 1.00 0.00 C ATOM 1532 C ASN A 114 -11.157 10.790 0.269 1.00 0.00 C ATOM 1533 O ASN A 114 -10.079 11.381 0.237 1.00 0.00 O ATOM 1534 CB ASN A 114 -12.942 11.297 -1.404 1.00 0.00 C ATOM 1535 CG ASN A 114 -14.363 11.789 -1.611 1.00 0.00 C ATOM 1536 OD1 ASN A 114 -15.322 11.070 -1.334 1.00 0.00 O ATOM 1537 ND2 ASN A 114 -14.515 13.004 -2.111 1.00 0.00 N ATOM 0 H ASN A 114 -11.880 13.494 -0.460 1.00 0.00 H new ATOM 0 HA ASN A 114 -13.213 11.149 0.711 1.00 0.00 H new ATOM 0 HB2 ASN A 114 -12.277 11.806 -2.101 1.00 0.00 H new ATOM 0 HB3 ASN A 114 -12.890 10.232 -1.632 1.00 0.00 H new ATOM 0 HD21 ASN A 114 -15.451 13.373 -2.279 1.00 0.00 H new ATOM 0 HD22 ASN A 114 -13.696 13.572 -2.329 1.00 0.00 H new ATOM 1544 N ARG A 115 -11.265 9.491 0.499 1.00 0.00 N ATOM 1545 CA ARG A 115 -10.112 8.682 0.863 1.00 0.00 C ATOM 1546 C ARG A 115 -10.086 7.382 0.068 1.00 0.00 C ATOM 1547 O ARG A 115 -11.040 6.608 0.097 1.00 0.00 O ATOM 1548 CB ARG A 115 -10.161 8.384 2.364 1.00 0.00 C ATOM 1549 CG ARG A 115 -9.073 7.450 2.857 1.00 0.00 C ATOM 1550 CD ARG A 115 -9.298 7.064 4.309 1.00 0.00 C ATOM 1551 NE ARG A 115 -9.551 8.232 5.150 1.00 0.00 N ATOM 1552 CZ ARG A 115 -8.887 8.506 6.270 1.00 0.00 C ATOM 1553 NH1 ARG A 115 -7.900 7.715 6.675 1.00 0.00 N ATOM 1554 NH2 ARG A 115 -9.216 9.578 6.976 1.00 0.00 N ATOM 0 H ARG A 115 -12.142 8.973 0.440 1.00 0.00 H new ATOM 0 HA ARG A 115 -9.203 9.235 0.628 1.00 0.00 H new ATOM 0 HB2 ARG A 115 -10.090 9.324 2.910 1.00 0.00 H new ATOM 0 HB3 ARG A 115 -11.131 7.949 2.603 1.00 0.00 H new ATOM 0 HG2 ARG A 115 -9.052 6.553 2.238 1.00 0.00 H new ATOM 0 HG3 ARG A 115 -8.101 7.932 2.752 1.00 0.00 H new ATOM 0 HD2 ARG A 115 -10.143 6.379 4.376 1.00 0.00 H new ATOM 0 HD3 ARG A 115 -8.424 6.530 4.682 1.00 0.00 H new ATOM 0 HE ARG A 115 -10.284 8.879 4.860 1.00 0.00 H new ATOM 0 HH11 ARG A 115 -7.648 6.893 6.127 1.00 0.00 H new ATOM 0 HH12 ARG A 115 -7.394 7.930 7.534 1.00 0.00 H new ATOM 0 HH21 ARG A 115 -9.972 10.185 6.659 1.00 0.00 H new ATOM 0 HH22 ARG A 115 -8.713 9.796 7.836 1.00 0.00 H new ATOM 1568 N TYR A 116 -8.996 7.163 -0.652 1.00 0.00 N ATOM 1569 CA TYR A 116 -8.794 5.924 -1.391 1.00 0.00 C ATOM 1570 C TYR A 116 -7.531 5.228 -0.920 1.00 0.00 C ATOM 1571 O TYR A 116 -6.447 5.809 -0.948 1.00 0.00 O ATOM 1572 CB TYR A 116 -8.697 6.187 -2.892 1.00 0.00 C ATOM 1573 CG TYR A 116 -10.028 6.387 -3.569 1.00 0.00 C ATOM 1574 CD1 TYR A 116 -10.898 5.321 -3.738 1.00 0.00 C ATOM 1575 CD2 TYR A 116 -10.408 7.631 -4.056 1.00 0.00 C ATOM 1576 CE1 TYR A 116 -12.110 5.486 -4.370 1.00 0.00 C ATOM 1577 CE2 TYR A 116 -11.618 7.800 -4.697 1.00 0.00 C ATOM 1578 CZ TYR A 116 -12.463 6.724 -4.850 1.00 0.00 C ATOM 1579 OH TYR A 116 -13.659 6.884 -5.501 1.00 0.00 O ATOM 0 H TYR A 116 -8.232 7.833 -0.741 1.00 0.00 H new ATOM 0 HA TYR A 116 -9.655 5.283 -1.203 1.00 0.00 H new ATOM 0 HB2 TYR A 116 -8.082 7.072 -3.056 1.00 0.00 H new ATOM 0 HB3 TYR A 116 -8.184 5.350 -3.364 1.00 0.00 H new ATOM 0 HD1 TYR A 116 -10.621 4.345 -3.368 1.00 0.00 H new ATOM 0 HD2 TYR A 116 -9.748 8.477 -3.931 1.00 0.00 H new ATOM 0 HE1 TYR A 116 -12.780 4.647 -4.488 1.00 0.00 H new ATOM 0 HE2 TYR A 116 -11.901 8.771 -5.077 1.00 0.00 H new ATOM 0 HH TYR A 116 -13.666 6.335 -6.313 1.00 0.00 H new ATOM 1589 N GLN A 117 -7.671 3.976 -0.513 1.00 0.00 N ATOM 1590 CA GLN A 117 -6.553 3.210 0.013 1.00 0.00 C ATOM 1591 C GLN A 117 -6.395 1.954 -0.838 1.00 0.00 C ATOM 1592 O GLN A 117 -7.324 1.160 -0.963 1.00 0.00 O ATOM 1593 CB GLN A 117 -6.812 2.851 1.484 1.00 0.00 C ATOM 1594 CG GLN A 117 -7.523 3.960 2.254 1.00 0.00 C ATOM 1595 CD GLN A 117 -6.619 5.120 2.633 1.00 0.00 C ATOM 1596 OE1 GLN A 117 -6.351 6.009 1.833 1.00 0.00 O ATOM 1597 NE2 GLN A 117 -6.226 5.170 3.892 1.00 0.00 N ATOM 0 H GLN A 117 -8.554 3.466 -0.537 1.00 0.00 H new ATOM 0 HA GLN A 117 -5.634 3.794 -0.029 1.00 0.00 H new ATOM 0 HB2 GLN A 117 -7.412 1.942 1.530 1.00 0.00 H new ATOM 0 HB3 GLN A 117 -5.862 2.630 1.971 1.00 0.00 H new ATOM 0 HG2 GLN A 117 -8.348 4.337 1.650 1.00 0.00 H new ATOM 0 HG3 GLN A 117 -7.958 3.539 3.161 1.00 0.00 H new ATOM 0 HE21 GLN A 117 -6.466 4.413 4.532 1.00 0.00 H new ATOM 0 HE22 GLN A 117 -5.682 5.966 4.225 1.00 0.00 H new ATOM 1606 N LEU A 118 -5.224 1.793 -1.434 1.00 0.00 N ATOM 1607 CA LEU A 118 -5.033 0.804 -2.485 1.00 0.00 C ATOM 1608 C LEU A 118 -4.395 -0.484 -1.962 1.00 0.00 C ATOM 1609 O LEU A 118 -3.306 -0.465 -1.387 1.00 0.00 O ATOM 1610 CB LEU A 118 -4.179 1.404 -3.609 1.00 0.00 C ATOM 1611 CG LEU A 118 -4.146 0.617 -4.921 1.00 0.00 C ATOM 1612 CD1 LEU A 118 -5.526 0.598 -5.557 1.00 0.00 C ATOM 1613 CD2 LEU A 118 -3.127 1.227 -5.874 1.00 0.00 C ATOM 0 H LEU A 118 -4.390 2.335 -1.208 1.00 0.00 H new ATOM 0 HA LEU A 118 -6.017 0.537 -2.871 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -4.546 2.408 -3.820 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -3.157 1.508 -3.245 1.00 0.00 H new ATOM 0 HG LEU A 118 -3.850 -0.410 -4.708 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -5.489 0.035 -6.490 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -6.234 0.126 -4.876 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -5.846 1.620 -5.762 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -3.113 0.658 -6.804 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -3.400 2.261 -6.085 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -2.138 1.199 -5.416 1.00 0.00 H new ATOM 1625 N PRO A 119 -5.090 -1.618 -2.158 1.00 0.00 N ATOM 1626 CA PRO A 119 -4.612 -2.953 -1.767 1.00 0.00 C ATOM 1627 C PRO A 119 -3.520 -3.500 -2.695 1.00 0.00 C ATOM 1628 O PRO A 119 -3.410 -3.108 -3.858 1.00 0.00 O ATOM 1629 CB PRO A 119 -5.876 -3.827 -1.866 1.00 0.00 C ATOM 1630 CG PRO A 119 -7.012 -2.876 -2.048 1.00 0.00 C ATOM 1631 CD PRO A 119 -6.431 -1.687 -2.743 1.00 0.00 C ATOM 0 HA PRO A 119 -4.153 -2.935 -0.778 1.00 0.00 H new ATOM 0 HB2 PRO A 119 -5.808 -4.520 -2.704 1.00 0.00 H new ATOM 0 HB3 PRO A 119 -6.008 -4.427 -0.966 1.00 0.00 H new ATOM 0 HG2 PRO A 119 -7.809 -3.326 -2.640 1.00 0.00 H new ATOM 0 HG3 PRO A 119 -7.447 -2.596 -1.088 1.00 0.00 H new ATOM 0 HD2 PRO A 119 -6.398 -1.822 -3.824 1.00 0.00 H new ATOM 0 HD3 PRO A 119 -7.007 -0.781 -2.552 1.00 0.00 H new ATOM 1639 N VAL A 120 -2.731 -4.440 -2.165 1.00 0.00 N ATOM 1640 CA VAL A 120 -1.578 -5.008 -2.879 1.00 0.00 C ATOM 1641 C VAL A 120 -1.987 -5.943 -4.013 1.00 0.00 C ATOM 1642 O VAL A 120 -1.148 -6.333 -4.819 1.00 0.00 O ATOM 1643 CB VAL A 120 -0.648 -5.808 -1.939 1.00 0.00 C ATOM 1644 CG1 VAL A 120 -0.174 -4.950 -0.790 1.00 0.00 C ATOM 1645 CG2 VAL A 120 -1.334 -7.063 -1.425 1.00 0.00 C ATOM 0 H VAL A 120 -2.871 -4.829 -1.232 1.00 0.00 H new ATOM 0 HA VAL A 120 -1.054 -4.143 -3.286 1.00 0.00 H new ATOM 0 HB VAL A 120 0.223 -6.114 -2.518 1.00 0.00 H new ATOM 0 HG11 VAL A 120 0.479 -5.536 -0.143 1.00 0.00 H new ATOM 0 HG12 VAL A 120 0.375 -4.092 -1.179 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -1.034 -4.601 -0.218 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -0.655 -7.605 -0.766 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -2.232 -6.786 -0.873 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -1.607 -7.699 -2.267 1.00 0.00 H new ATOM 1655 N TYR A 121 -3.274 -6.283 -4.078 1.00 0.00 N ATOM 1656 CA TYR A 121 -3.765 -7.328 -4.983 1.00 0.00 C ATOM 1657 C TYR A 121 -3.399 -7.055 -6.447 1.00 0.00 C ATOM 1658 O TYR A 121 -3.320 -7.977 -7.256 1.00 0.00 O ATOM 1659 CB TYR A 121 -5.290 -7.473 -4.853 1.00 0.00 C ATOM 1660 CG TYR A 121 -6.071 -6.373 -5.535 1.00 0.00 C ATOM 1661 CD1 TYR A 121 -6.015 -5.071 -5.068 1.00 0.00 C ATOM 1662 CD2 TYR A 121 -6.855 -6.635 -6.655 1.00 0.00 C ATOM 1663 CE1 TYR A 121 -6.712 -4.060 -5.690 1.00 0.00 C ATOM 1664 CE2 TYR A 121 -7.559 -5.629 -7.283 1.00 0.00 C ATOM 1665 CZ TYR A 121 -7.482 -4.341 -6.798 1.00 0.00 C ATOM 1666 OH TYR A 121 -8.179 -3.330 -7.421 1.00 0.00 O ATOM 0 H TYR A 121 -4.002 -5.848 -3.511 1.00 0.00 H new ATOM 0 HA TYR A 121 -3.277 -8.257 -4.688 1.00 0.00 H new ATOM 0 HB2 TYR A 121 -5.591 -8.433 -5.273 1.00 0.00 H new ATOM 0 HB3 TYR A 121 -5.554 -7.491 -3.796 1.00 0.00 H new ATOM 0 HD1 TYR A 121 -5.414 -4.844 -4.200 1.00 0.00 H new ATOM 0 HD2 TYR A 121 -6.913 -7.643 -7.039 1.00 0.00 H new ATOM 0 HE1 TYR A 121 -6.656 -3.050 -5.311 1.00 0.00 H new ATOM 0 HE2 TYR A 121 -8.166 -5.849 -8.149 1.00 0.00 H new ATOM 0 HH TYR A 121 -8.671 -3.695 -8.186 1.00 0.00 H new ATOM 1676 N CYS A 122 -3.172 -5.793 -6.780 1.00 0.00 N ATOM 1677 CA CYS A 122 -2.897 -5.413 -8.157 1.00 0.00 C ATOM 1678 C CYS A 122 -1.463 -4.903 -8.312 1.00 0.00 C ATOM 1679 O CYS A 122 -1.055 -4.490 -9.400 1.00 0.00 O ATOM 1680 CB CYS A 122 -3.905 -4.342 -8.598 1.00 0.00 C ATOM 1681 SG CYS A 122 -3.722 -3.793 -10.312 1.00 0.00 S ATOM 0 H CYS A 122 -3.173 -5.017 -6.118 1.00 0.00 H new ATOM 0 HA CYS A 122 -3.002 -6.291 -8.794 1.00 0.00 H new ATOM 0 HB2 CYS A 122 -4.913 -4.733 -8.462 1.00 0.00 H new ATOM 0 HB3 CYS A 122 -3.807 -3.478 -7.941 1.00 0.00 H new ATOM 0 HG CYS A 122 -2.468 -3.838 -10.651 1.00 0.00 H new ATOM 1687 N LEU A 123 -0.690 -4.950 -7.233 1.00 0.00 N ATOM 1688 CA LEU A 123 0.648 -4.378 -7.246 1.00 0.00 C ATOM 1689 C LEU A 123 1.703 -5.393 -6.820 1.00 0.00 C ATOM 1690 O LEU A 123 2.673 -5.632 -7.536 1.00 0.00 O ATOM 1691 CB LEU A 123 0.679 -3.166 -6.322 1.00 0.00 C ATOM 1692 CG LEU A 123 -0.315 -2.066 -6.692 1.00 0.00 C ATOM 1693 CD1 LEU A 123 -0.572 -1.171 -5.501 1.00 0.00 C ATOM 1694 CD2 LEU A 123 0.200 -1.250 -7.868 1.00 0.00 C ATOM 0 H LEU A 123 -0.965 -5.374 -6.347 1.00 0.00 H new ATOM 0 HA LEU A 123 0.884 -4.077 -8.267 1.00 0.00 H new ATOM 0 HB2 LEU A 123 0.475 -3.496 -5.303 1.00 0.00 H new ATOM 0 HB3 LEU A 123 1.685 -2.747 -6.326 1.00 0.00 H new ATOM 0 HG LEU A 123 -1.254 -2.534 -6.987 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -1.282 -0.392 -5.778 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -0.984 -1.763 -4.683 1.00 0.00 H new ATOM 0 HD13 LEU A 123 0.364 -0.713 -5.182 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -0.523 -0.472 -8.115 1.00 0.00 H new ATOM 0 HD22 LEU A 123 1.152 -0.790 -7.603 1.00 0.00 H new ATOM 0 HD23 LEU A 123 0.340 -1.902 -8.730 1.00 0.00 H new ATOM 1706 N ALA A 124 1.507 -6.003 -5.662 1.00 0.00 N ATOM 1707 CA ALA A 124 2.488 -6.929 -5.126 1.00 0.00 C ATOM 1708 C ALA A 124 1.809 -8.175 -4.574 1.00 0.00 C ATOM 1709 O ALA A 124 1.107 -8.113 -3.566 1.00 0.00 O ATOM 1710 CB ALA A 124 3.310 -6.244 -4.044 1.00 0.00 C ATOM 0 H ALA A 124 0.681 -5.874 -5.078 1.00 0.00 H new ATOM 0 HA ALA A 124 3.154 -7.238 -5.932 1.00 0.00 H new ATOM 0 HB1 ALA A 124 4.044 -6.945 -3.646 1.00 0.00 H new ATOM 0 HB2 ALA A 124 3.824 -5.382 -4.469 1.00 0.00 H new ATOM 0 HB3 ALA A 124 2.651 -5.914 -3.241 1.00 0.00 H new ATOM 1716 N PRO A 125 2.012 -9.325 -5.233 1.00 0.00 N ATOM 1717 CA PRO A 125 1.422 -10.596 -4.826 1.00 0.00 C ATOM 1718 C PRO A 125 2.266 -11.510 -3.886 1.00 0.00 C ATOM 1719 O PRO A 125 1.837 -12.637 -3.642 1.00 0.00 O ATOM 1720 CB PRO A 125 1.200 -11.309 -6.169 1.00 0.00 C ATOM 1721 CG PRO A 125 1.996 -10.553 -7.198 1.00 0.00 C ATOM 1722 CD PRO A 125 2.764 -9.477 -6.478 1.00 0.00 C ATOM 0 HA PRO A 125 0.538 -10.398 -4.219 1.00 0.00 H new ATOM 0 HB2 PRO A 125 1.526 -12.348 -6.114 1.00 0.00 H new ATOM 0 HB3 PRO A 125 0.142 -11.321 -6.430 1.00 0.00 H new ATOM 0 HG2 PRO A 125 2.677 -11.223 -7.724 1.00 0.00 H new ATOM 0 HG3 PRO A 125 1.336 -10.116 -7.948 1.00 0.00 H new ATOM 0 HD2 PRO A 125 3.797 -9.771 -6.294 1.00 0.00 H new ATOM 0 HD3 PRO A 125 2.794 -8.549 -7.049 1.00 0.00 H new ATOM 1730 N PRO A 126 3.455 -11.113 -3.332 1.00 0.00 N ATOM 1731 CA PRO A 126 4.156 -11.971 -2.364 1.00 0.00 C ATOM 1732 C PRO A 126 3.295 -12.260 -1.135 1.00 0.00 C ATOM 1733 O PRO A 126 3.373 -13.333 -0.536 1.00 0.00 O ATOM 1734 CB PRO A 126 5.402 -11.165 -1.969 1.00 0.00 C ATOM 1735 CG PRO A 126 5.115 -9.770 -2.397 1.00 0.00 C ATOM 1736 CD PRO A 126 4.231 -9.888 -3.601 1.00 0.00 C ATOM 0 HA PRO A 126 4.398 -12.944 -2.791 1.00 0.00 H new ATOM 0 HB2 PRO A 126 5.582 -11.218 -0.895 1.00 0.00 H new ATOM 0 HB3 PRO A 126 6.294 -11.552 -2.461 1.00 0.00 H new ATOM 0 HG2 PRO A 126 4.621 -9.211 -1.602 1.00 0.00 H new ATOM 0 HG3 PRO A 126 6.035 -9.237 -2.638 1.00 0.00 H new ATOM 0 HD2 PRO A 126 3.584 -9.018 -3.712 1.00 0.00 H new ATOM 0 HD3 PRO A 126 4.811 -9.973 -4.520 1.00 0.00 H new ATOM 1744 N ILE A 127 2.451 -11.300 -0.783 1.00 0.00 N ATOM 1745 CA ILE A 127 1.548 -11.447 0.349 1.00 0.00 C ATOM 1746 C ILE A 127 0.206 -12.014 -0.091 1.00 0.00 C ATOM 1747 O ILE A 127 -0.848 -11.589 0.381 1.00 0.00 O ATOM 1748 CB ILE A 127 1.316 -10.120 1.107 1.00 0.00 C ATOM 1749 CG1 ILE A 127 1.055 -8.945 0.141 1.00 0.00 C ATOM 1750 CG2 ILE A 127 2.495 -9.832 2.021 1.00 0.00 C ATOM 1751 CD1 ILE A 127 2.305 -8.319 -0.449 1.00 0.00 C ATOM 0 H ILE A 127 2.373 -10.406 -1.269 1.00 0.00 H new ATOM 0 HA ILE A 127 2.036 -12.142 1.032 1.00 0.00 H new ATOM 0 HB ILE A 127 0.419 -10.229 1.717 1.00 0.00 H new ATOM 0 HG12 ILE A 127 0.422 -9.296 -0.674 1.00 0.00 H new ATOM 0 HG13 ILE A 127 0.495 -8.175 0.671 1.00 0.00 H new ATOM 0 HG21 ILE A 127 2.324 -8.895 2.551 1.00 0.00 H new ATOM 0 HG22 ILE A 127 2.603 -10.643 2.742 1.00 0.00 H new ATOM 0 HG23 ILE A 127 3.405 -9.751 1.426 1.00 0.00 H new ATOM 0 HD11 ILE A 127 2.024 -7.503 -1.115 1.00 0.00 H new ATOM 0 HD12 ILE A 127 2.932 -7.932 0.354 1.00 0.00 H new ATOM 0 HD13 ILE A 127 2.858 -9.071 -1.011 1.00 0.00 H new ATOM 1763 N ASN A 128 0.259 -12.969 -1.005 1.00 0.00 N ATOM 1764 CA ASN A 128 -0.938 -13.658 -1.471 1.00 0.00 C ATOM 1765 C ASN A 128 -0.940 -15.091 -0.944 1.00 0.00 C ATOM 1766 O ASN A 128 -1.996 -15.664 -0.685 1.00 0.00 O ATOM 1767 CB ASN A 128 -1.004 -13.644 -3.007 1.00 0.00 C ATOM 1768 CG ASN A 128 -2.379 -13.978 -3.586 1.00 0.00 C ATOM 1769 OD1 ASN A 128 -2.764 -13.446 -4.627 1.00 0.00 O ATOM 1770 ND2 ASN A 128 -3.124 -14.863 -2.940 1.00 0.00 N ATOM 0 H ASN A 128 1.123 -13.288 -1.443 1.00 0.00 H new ATOM 0 HA ASN A 128 -1.819 -13.140 -1.092 1.00 0.00 H new ATOM 0 HB2 ASN A 128 -0.704 -12.658 -3.362 1.00 0.00 H new ATOM 0 HB3 ASN A 128 -0.277 -14.357 -3.396 1.00 0.00 H new ATOM 0 HD21 ASN A 128 -4.042 -15.119 -3.304 1.00 0.00 H new ATOM 0 HD22 ASN A 128 -2.780 -15.288 -2.079 1.00 0.00 H new ATOM 1777 N MET A 129 0.251 -15.660 -0.771 1.00 0.00 N ATOM 1778 CA MET A 129 0.380 -17.009 -0.242 1.00 0.00 C ATOM 1779 C MET A 129 -0.113 -17.059 1.198 1.00 0.00 C ATOM 1780 O MET A 129 -0.834 -17.979 1.590 1.00 0.00 O ATOM 1781 CB MET A 129 1.837 -17.473 -0.321 1.00 0.00 C ATOM 1782 CG MET A 129 2.057 -18.867 0.237 1.00 0.00 C ATOM 1783 SD MET A 129 1.139 -20.129 -0.668 1.00 0.00 S ATOM 1784 CE MET A 129 1.637 -21.605 0.215 1.00 0.00 C ATOM 0 H MET A 129 1.138 -15.206 -0.990 1.00 0.00 H new ATOM 0 HA MET A 129 -0.232 -17.680 -0.844 1.00 0.00 H new ATOM 0 HB2 MET A 129 2.162 -17.451 -1.361 1.00 0.00 H new ATOM 0 HB3 MET A 129 2.465 -16.768 0.224 1.00 0.00 H new ATOM 0 HG2 MET A 129 3.121 -19.104 0.205 1.00 0.00 H new ATOM 0 HG3 MET A 129 1.758 -18.886 1.285 1.00 0.00 H new ATOM 0 HE1 MET A 129 1.267 -22.486 -0.311 1.00 0.00 H new ATOM 0 HE2 MET A 129 2.725 -21.646 0.271 1.00 0.00 H new ATOM 0 HE3 MET A 129 1.222 -21.583 1.223 1.00 0.00 H new ATOM 1794 N ILE A 130 0.273 -16.037 1.966 1.00 0.00 N ATOM 1795 CA ILE A 130 -0.178 -15.842 3.350 1.00 0.00 C ATOM 1796 C ILE A 130 0.470 -16.832 4.299 1.00 0.00 C ATOM 1797 O ILE A 130 1.308 -16.469 5.122 1.00 0.00 O ATOM 1798 CB ILE A 130 -1.721 -15.957 3.499 1.00 0.00 C ATOM 1799 CG1 ILE A 130 -2.429 -15.069 2.498 1.00 0.00 C ATOM 1800 CG2 ILE A 130 -2.161 -15.592 4.899 1.00 0.00 C ATOM 1801 CD1 ILE A 130 -1.888 -13.667 2.462 1.00 0.00 C ATOM 0 H ILE A 130 0.914 -15.313 1.643 1.00 0.00 H new ATOM 0 HA ILE A 130 0.127 -14.828 3.610 1.00 0.00 H new ATOM 0 HB ILE A 130 -1.990 -16.995 3.305 1.00 0.00 H new ATOM 0 HG12 ILE A 130 -2.342 -15.511 1.505 1.00 0.00 H new ATOM 0 HG13 ILE A 130 -3.491 -15.035 2.740 1.00 0.00 H new ATOM 0 HG21 ILE A 130 -3.245 -15.681 4.975 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -1.691 -16.265 5.615 1.00 0.00 H new ATOM 0 HG23 ILE A 130 -1.865 -14.566 5.117 1.00 0.00 H new ATOM 0 HD11 ILE A 130 -2.439 -13.083 1.724 1.00 0.00 H new ATOM 0 HD12 ILE A 130 -2.000 -13.209 3.445 1.00 0.00 H new ATOM 0 HD13 ILE A 130 -0.833 -13.691 2.191 1.00 0.00 H new ATOM 1813 N GLU A 131 0.083 -18.079 4.157 1.00 0.00 N ATOM 1814 CA GLU A 131 0.459 -19.118 5.099 1.00 0.00 C ATOM 1815 C GLU A 131 1.865 -19.650 4.812 1.00 0.00 C ATOM 1816 O GLU A 131 2.586 -19.107 3.972 1.00 0.00 O ATOM 1817 CB GLU A 131 -0.570 -20.249 5.052 1.00 0.00 C ATOM 1818 CG GLU A 131 -2.000 -19.749 4.883 1.00 0.00 C ATOM 1819 CD GLU A 131 -3.000 -20.864 4.662 1.00 0.00 C ATOM 1820 OE1 GLU A 131 -3.220 -21.251 3.494 1.00 0.00 O ATOM 1821 OE2 GLU A 131 -3.579 -21.350 5.653 1.00 0.00 O ATOM 0 H GLU A 131 -0.501 -18.405 3.387 1.00 0.00 H new ATOM 0 HA GLU A 131 0.474 -18.689 6.101 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -0.326 -20.920 4.228 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -0.502 -20.833 5.970 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -2.287 -19.183 5.769 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -2.040 -19.061 4.038 1.00 0.00 H new ATOM 1828 N GLU A 132 2.247 -20.714 5.516 1.00 0.00 N ATOM 1829 CA GLU A 132 3.576 -21.299 5.365 1.00 0.00 C ATOM 1830 C GLU A 132 3.758 -21.972 4.010 1.00 0.00 C ATOM 1831 O GLU A 132 2.866 -21.939 3.163 1.00 0.00 O ATOM 1832 CB GLU A 132 3.846 -22.322 6.464 1.00 0.00 C ATOM 1833 CG GLU A 132 4.109 -21.721 7.831 1.00 0.00 C ATOM 1834 CD GLU A 132 4.698 -22.743 8.775 1.00 0.00 C ATOM 1835 OE1 GLU A 132 5.564 -23.524 8.329 1.00 0.00 O ATOM 1836 OE2 GLU A 132 4.308 -22.776 9.959 1.00 0.00 O ATOM 0 H GLU A 132 1.654 -21.188 6.197 1.00 0.00 H new ATOM 0 HA GLU A 132 4.286 -20.476 5.441 1.00 0.00 H new ATOM 0 HB2 GLU A 132 2.991 -22.994 6.535 1.00 0.00 H new ATOM 0 HB3 GLU A 132 4.705 -22.928 6.176 1.00 0.00 H new ATOM 0 HG2 GLU A 132 4.791 -20.876 7.734 1.00 0.00 H new ATOM 0 HG3 GLU A 132 3.178 -21.333 8.246 1.00 0.00 H new ATOM 1843 N LYS A 133 4.917 -22.610 3.831 1.00 0.00 N ATOM 1844 CA LYS A 133 5.268 -23.248 2.563 1.00 0.00 C ATOM 1845 C LYS A 133 4.164 -24.197 2.089 1.00 0.00 C ATOM 1846 O LYS A 133 3.777 -24.175 0.922 1.00 0.00 O ATOM 1847 CB LYS A 133 6.624 -23.986 2.669 1.00 0.00 C ATOM 1848 CG LYS A 133 6.668 -25.185 3.622 1.00 0.00 C ATOM 1849 CD LYS A 133 6.764 -24.785 5.089 1.00 0.00 C ATOM 1850 CE LYS A 133 6.707 -26.012 5.988 1.00 0.00 C ATOM 1851 NZ LYS A 133 6.797 -25.671 7.437 1.00 0.00 N ATOM 0 H LYS A 133 5.631 -22.698 4.554 1.00 0.00 H new ATOM 0 HA LYS A 133 5.369 -22.460 1.816 1.00 0.00 H new ATOM 0 HB2 LYS A 133 6.906 -24.329 1.674 1.00 0.00 H new ATOM 0 HB3 LYS A 133 7.381 -23.268 2.986 1.00 0.00 H new ATOM 0 HG2 LYS A 133 5.773 -25.790 3.475 1.00 0.00 H new ATOM 0 HG3 LYS A 133 7.522 -25.812 3.367 1.00 0.00 H new ATOM 0 HD2 LYS A 133 7.694 -24.244 5.263 1.00 0.00 H new ATOM 0 HD3 LYS A 133 5.949 -24.106 5.340 1.00 0.00 H new ATOM 0 HE2 LYS A 133 5.777 -26.550 5.803 1.00 0.00 H new ATOM 0 HE3 LYS A 133 7.522 -26.686 5.727 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 6.205 -26.327 7.985 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 7.785 -25.751 7.752 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 6.464 -24.697 7.586 1.00 0.00 H new ATOM 1865 N SER A 134 3.651 -24.998 3.015 1.00 0.00 N ATOM 1866 CA SER A 134 2.571 -25.940 2.741 1.00 0.00 C ATOM 1867 C SER A 134 2.295 -26.733 4.013 1.00 0.00 C ATOM 1868 O SER A 134 1.949 -27.911 3.982 1.00 0.00 O ATOM 1869 CB SER A 134 2.943 -26.883 1.587 1.00 0.00 C ATOM 1870 OG SER A 134 1.810 -27.586 1.106 1.00 0.00 O ATOM 0 H SER A 134 3.974 -25.013 3.982 1.00 0.00 H new ATOM 0 HA SER A 134 1.677 -25.395 2.439 1.00 0.00 H new ATOM 0 HB2 SER A 134 3.388 -26.308 0.775 1.00 0.00 H new ATOM 0 HB3 SER A 134 3.697 -27.594 1.925 1.00 0.00 H new ATOM 0 HG SER A 134 1.356 -28.026 1.855 1.00 0.00 H new ATOM 1876 N ASP A 135 2.442 -26.053 5.140 1.00 0.00 N ATOM 1877 CA ASP A 135 2.386 -26.696 6.448 1.00 0.00 C ATOM 1878 C ASP A 135 0.968 -26.646 6.979 1.00 0.00 C ATOM 1879 O ASP A 135 0.565 -27.437 7.829 1.00 0.00 O ATOM 1880 CB ASP A 135 3.323 -25.963 7.408 1.00 0.00 C ATOM 1881 CG ASP A 135 3.689 -26.773 8.636 1.00 0.00 C ATOM 1882 OD1 ASP A 135 2.826 -26.979 9.504 1.00 0.00 O ATOM 1883 OD2 ASP A 135 4.862 -27.194 8.738 1.00 0.00 O ATOM 0 H ASP A 135 2.603 -25.046 5.176 1.00 0.00 H new ATOM 0 HA ASP A 135 2.697 -27.737 6.359 1.00 0.00 H new ATOM 0 HB2 ASP A 135 4.235 -25.693 6.876 1.00 0.00 H new ATOM 0 HB3 ASP A 135 2.851 -25.033 7.724 1.00 0.00 H new ATOM 1888 N ILE A 136 0.220 -25.703 6.445 1.00 0.00 N ATOM 1889 CA ILE A 136 -1.126 -25.426 6.913 1.00 0.00 C ATOM 1890 C ILE A 136 -2.129 -26.394 6.289 1.00 0.00 C ATOM 1891 O ILE A 136 -1.881 -26.971 5.227 1.00 0.00 O ATOM 1892 CB ILE A 136 -1.531 -23.985 6.563 1.00 0.00 C ATOM 1893 CG1 ILE A 136 -0.303 -23.066 6.625 1.00 0.00 C ATOM 1894 CG2 ILE A 136 -2.614 -23.498 7.518 1.00 0.00 C ATOM 1895 CD1 ILE A 136 0.251 -22.868 8.019 1.00 0.00 C ATOM 0 H ILE A 136 0.525 -25.107 5.676 1.00 0.00 H new ATOM 0 HA ILE A 136 -1.134 -25.553 7.996 1.00 0.00 H new ATOM 0 HB ILE A 136 -1.931 -23.963 5.549 1.00 0.00 H new ATOM 0 HG12 ILE A 136 0.480 -23.480 5.990 1.00 0.00 H new ATOM 0 HG13 ILE A 136 -0.569 -22.094 6.210 1.00 0.00 H new ATOM 0 HG21 ILE A 136 -2.893 -22.476 7.261 1.00 0.00 H new ATOM 0 HG22 ILE A 136 -3.488 -24.144 7.437 1.00 0.00 H new ATOM 0 HG23 ILE A 136 -2.237 -23.525 8.540 1.00 0.00 H new ATOM 0 HD11 ILE A 136 1.116 -22.207 7.976 1.00 0.00 H new ATOM 0 HD12 ILE A 136 -0.514 -22.423 8.655 1.00 0.00 H new ATOM 0 HD13 ILE A 136 0.551 -23.831 8.432 1.00 0.00 H new ATOM 1907 N GLU A 137 -3.266 -26.550 6.955 1.00 0.00 N ATOM 1908 CA GLU A 137 -4.299 -27.494 6.542 1.00 0.00 C ATOM 1909 C GLU A 137 -5.012 -27.005 5.287 1.00 0.00 C ATOM 1910 O GLU A 137 -5.675 -27.780 4.597 1.00 0.00 O ATOM 1911 CB GLU A 137 -5.332 -27.693 7.663 1.00 0.00 C ATOM 1912 CG GLU A 137 -4.753 -28.145 9.001 1.00 0.00 C ATOM 1913 CD GLU A 137 -3.894 -27.082 9.661 1.00 0.00 C ATOM 1914 OE1 GLU A 137 -4.353 -25.925 9.757 1.00 0.00 O ATOM 1915 OE2 GLU A 137 -2.741 -27.390 10.040 1.00 0.00 O ATOM 0 H GLU A 137 -3.499 -26.025 7.798 1.00 0.00 H new ATOM 0 HA GLU A 137 -3.810 -28.444 6.328 1.00 0.00 H new ATOM 0 HB2 GLU A 137 -5.867 -26.756 7.814 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -6.065 -28.429 7.334 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -5.569 -28.414 9.672 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -4.156 -29.044 8.848 1.00 0.00 H new ATOM 1922 N THR A 138 -4.872 -25.721 4.998 1.00 0.00 N ATOM 1923 CA THR A 138 -5.542 -25.110 3.865 1.00 0.00 C ATOM 1924 C THR A 138 -4.890 -25.542 2.554 1.00 0.00 C ATOM 1925 O THR A 138 -3.758 -25.154 2.254 1.00 0.00 O ATOM 1926 CB THR A 138 -5.483 -23.578 3.971 1.00 0.00 C ATOM 1927 OG1 THR A 138 -5.450 -23.188 5.351 1.00 0.00 O ATOM 1928 CG2 THR A 138 -6.686 -22.950 3.290 1.00 0.00 C ATOM 0 H THR A 138 -4.294 -25.078 5.539 1.00 0.00 H new ATOM 0 HA THR A 138 -6.581 -25.438 3.875 1.00 0.00 H new ATOM 0 HB THR A 138 -4.578 -23.229 3.473 1.00 0.00 H new ATOM 0 HG1 THR A 138 -4.600 -22.740 5.544 1.00 0.00 H new ATOM 0 HG21 THR A 138 -6.627 -21.865 3.375 1.00 0.00 H new ATOM 0 HG22 THR A 138 -6.696 -23.231 2.237 1.00 0.00 H new ATOM 0 HG23 THR A 138 -7.600 -23.302 3.768 1.00 0.00 H new ATOM 1936 N LEU A 139 -5.599 -26.356 1.784 1.00 0.00 N ATOM 1937 CA LEU A 139 -5.078 -26.841 0.513 1.00 0.00 C ATOM 1938 C LEU A 139 -6.109 -26.670 -0.598 1.00 0.00 C ATOM 1939 O LEU A 139 -5.914 -25.882 -1.521 1.00 0.00 O ATOM 1940 CB LEU A 139 -4.664 -28.309 0.631 1.00 0.00 C ATOM 1941 CG LEU A 139 -3.845 -28.841 -0.543 1.00 0.00 C ATOM 1942 CD1 LEU A 139 -2.487 -28.160 -0.593 1.00 0.00 C ATOM 1943 CD2 LEU A 139 -3.683 -30.349 -0.441 1.00 0.00 C ATOM 0 H LEU A 139 -6.533 -26.694 2.016 1.00 0.00 H new ATOM 0 HA LEU A 139 -4.199 -26.248 0.258 1.00 0.00 H new ATOM 0 HB2 LEU A 139 -4.086 -28.436 1.546 1.00 0.00 H new ATOM 0 HB3 LEU A 139 -5.562 -28.918 0.734 1.00 0.00 H new ATOM 0 HG LEU A 139 -4.378 -28.616 -1.467 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -1.915 -28.550 -1.435 1.00 0.00 H new ATOM 0 HD12 LEU A 139 -2.623 -27.085 -0.713 1.00 0.00 H new ATOM 0 HD13 LEU A 139 -1.947 -28.356 0.334 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -3.097 -30.710 -1.286 1.00 0.00 H new ATOM 0 HD22 LEU A 139 -3.171 -30.598 0.489 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -4.665 -30.822 -0.452 1.00 0.00 H new ATOM 1955 N ASP A 140 -7.217 -27.394 -0.496 1.00 0.00 N ATOM 1956 CA ASP A 140 -8.272 -27.308 -1.496 1.00 0.00 C ATOM 1957 C ASP A 140 -9.287 -26.282 -1.049 1.00 0.00 C ATOM 1958 O ASP A 140 -9.692 -25.402 -1.809 1.00 0.00 O ATOM 1959 CB ASP A 140 -8.966 -28.664 -1.690 1.00 0.00 C ATOM 1960 CG ASP A 140 -8.024 -29.755 -2.160 1.00 0.00 C ATOM 1961 OD1 ASP A 140 -7.643 -29.746 -3.350 1.00 0.00 O ATOM 1962 OD2 ASP A 140 -7.667 -30.628 -1.338 1.00 0.00 O ATOM 0 H ASP A 140 -7.407 -28.045 0.266 1.00 0.00 H new ATOM 0 HA ASP A 140 -7.828 -27.016 -2.448 1.00 0.00 H new ATOM 0 HB2 ASP A 140 -9.424 -28.969 -0.749 1.00 0.00 H new ATOM 0 HB3 ASP A 140 -9.772 -28.552 -2.415 1.00 0.00 H new ATOM 1967 N ILE A 141 -9.672 -26.397 0.207 1.00 0.00 N ATOM 1968 CA ILE A 141 -10.633 -25.487 0.801 1.00 0.00 C ATOM 1969 C ILE A 141 -9.980 -24.640 1.884 1.00 0.00 C ATOM 1970 O ILE A 141 -9.904 -23.413 1.703 1.00 0.00 O ATOM 1971 CB ILE A 141 -11.849 -26.231 1.378 1.00 0.00 C ATOM 1972 CG1 ILE A 141 -11.409 -27.490 2.133 1.00 0.00 C ATOM 1973 CG2 ILE A 141 -12.818 -26.566 0.258 1.00 0.00 C ATOM 1974 CD1 ILE A 141 -12.560 -28.273 2.731 1.00 0.00 C ATOM 0 H ILE A 141 -9.330 -27.119 0.841 1.00 0.00 H new ATOM 0 HA ILE A 141 -10.987 -24.834 0.003 1.00 0.00 H new ATOM 0 HB ILE A 141 -12.357 -25.586 2.095 1.00 0.00 H new ATOM 0 HG12 ILE A 141 -10.856 -28.137 1.452 1.00 0.00 H new ATOM 0 HG13 ILE A 141 -10.722 -27.204 2.930 1.00 0.00 H new ATOM 0 HG21 ILE A 141 -13.679 -27.093 0.668 1.00 0.00 H new ATOM 0 HG22 ILE A 141 -13.151 -25.646 -0.223 1.00 0.00 H new ATOM 0 HG23 ILE A 141 -12.320 -27.200 -0.476 1.00 0.00 H new ATOM 0 HD11 ILE A 141 -12.173 -29.150 3.250 1.00 0.00 H new ATOM 0 HD12 ILE A 141 -13.101 -27.643 3.437 1.00 0.00 H new ATOM 0 HD13 ILE A 141 -13.236 -28.590 1.937 1.00 0.00 H new TER 1986 ILE A 141