USER MOD reduce.3.24.130724 H: found=0, std=0, add=812, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 807 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 18 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 79 TYR OH : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc=-0.00412 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 11 SER OG : rot -58:sc= 1.14 USER MOD Single : A 13 SER OG : rot -61:sc= 0.179 USER MOD Single : A 14 THR OG1 : rot -59:sc= 0.346 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 21 HIS : no HD1:sc=-0.00657 X(o=-0.0066,f=0) USER MOD Single : A 27 LYS NZ :NH3+ 161:sc= -0.0188 (180deg=-0.236) USER MOD Single : A 28 ASN : amide:sc= -0.13 X(o=-0.13,f=0) USER MOD Single : A 30 THR OG1 : rot 180:sc= 0.00907 USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 35 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 37 SER OG : rot 100:sc= 0.846 USER MOD Single : A 38 TYR OH : rot 180:sc= 0 USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 TYR OH : rot 180:sc= -0.14 USER MOD Single : A 46 HIS : no HD1:sc= -4.02! C(o=-4!,f=-9.9!) USER MOD Single : A 49 LYS NZ :NH3+ -163:sc= 0.968 (180deg=0.782) USER MOD Single : A 50 ASN : amide:sc= 0.711 K(o=0.71,f=0) USER MOD Single : A 53 ASN : amide:sc= -1.99! C(o=-2!,f=-0.99!) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 ASN : amide:sc= -6.62! C(o=-6.6!,f=-4.4!) USER MOD Single : A 65 ASN : amide:sc= -9.94! C(o=-9.9!,f=-9.6!) USER MOD Single : A 67 HIS : no HE2:sc= -4.21! C(o=-4.2!,f=-3.7!) USER MOD Single : A 71 THR OG1 : rot -57:sc= -1.31 USER MOD Single : A 74 THR OG1 : rot 180:sc= 0.00695 USER MOD Single : A 75 LYS NZ :NH3+ 124:sc= -0.165 (180deg=-0.777) USER MOD Single : A 77 ASN : amide:sc= -0.237 K(o=-0.24,f=-1.3!) USER MOD Single : A 81 LYS NZ :NH3+ 155:sc= -0.135 (180deg=-0.623) USER MOD Single : A 82 TYR OH : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 92 GLN : amide:sc= -0.174 X(o=-0.17,f=-0.17) USER MOD Single : A 97 ASN : amide:sc= -0.429 X(o=-0.43,f=-0.22) USER MOD Single : A 99 ASN : amide:sc= 0.0383 X(o=0.038,f=0) USER MOD Single : A 100 THR OG1 : rot -14:sc= 0.577! USER MOD Single : A 101 TYR OH : rot 180:sc= 0 USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 41:sc= 0.786 USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 16.398 23.419 -18.003 1.00 0.00 N ATOM 2 CA GLY A 1 16.063 22.177 -18.675 1.00 0.00 C ATOM 3 C GLY A 1 15.959 21.008 -17.716 1.00 0.00 C ATOM 4 O GLY A 1 14.889 20.739 -17.170 1.00 0.00 O ATOM 0 H1 GLY A 1 16.457 24.187 -18.702 1.00 0.00 H new ATOM 0 H2 GLY A 1 15.663 23.644 -17.303 1.00 0.00 H new ATOM 0 H3 GLY A 1 17.315 23.317 -17.522 1.00 0.00 H new ATOM 0 HA2 GLY A 1 15.116 22.296 -19.201 1.00 0.00 H new ATOM 0 HA3 GLY A 1 16.821 21.959 -19.428 1.00 0.00 H new ATOM 8 N SER A 2 17.072 20.311 -17.511 1.00 0.00 N ATOM 9 CA SER A 2 17.099 19.161 -16.615 1.00 0.00 C ATOM 10 C SER A 2 15.799 18.368 -16.709 1.00 0.00 C ATOM 11 O SER A 2 15.254 17.925 -15.698 1.00 0.00 O ATOM 12 CB SER A 2 17.328 19.617 -15.172 1.00 0.00 C ATOM 13 OG SER A 2 16.240 20.394 -14.704 1.00 0.00 O ATOM 0 H SER A 2 17.967 20.523 -17.953 1.00 0.00 H new ATOM 0 HA SER A 2 17.922 18.514 -16.919 1.00 0.00 H new ATOM 0 HB2 SER A 2 17.461 18.747 -14.529 1.00 0.00 H new ATOM 0 HB3 SER A 2 18.247 20.200 -15.113 1.00 0.00 H new ATOM 0 HG SER A 2 16.410 20.672 -13.780 1.00 0.00 H new ATOM 19 N SER A 3 15.308 18.193 -17.932 1.00 0.00 N ATOM 20 CA SER A 3 14.070 17.456 -18.160 1.00 0.00 C ATOM 21 C SER A 3 14.243 15.981 -17.811 1.00 0.00 C ATOM 22 O SER A 3 13.521 15.441 -16.974 1.00 0.00 O ATOM 23 CB SER A 3 13.628 17.599 -19.617 1.00 0.00 C ATOM 24 OG SER A 3 12.415 16.904 -19.853 1.00 0.00 O ATOM 0 H SER A 3 15.748 18.551 -18.780 1.00 0.00 H new ATOM 0 HA SER A 3 13.301 17.876 -17.512 1.00 0.00 H new ATOM 0 HB2 SER A 3 13.499 18.654 -19.859 1.00 0.00 H new ATOM 0 HB3 SER A 3 14.406 17.213 -20.276 1.00 0.00 H new ATOM 0 HG SER A 3 12.153 17.012 -20.791 1.00 0.00 H new ATOM 30 N GLY A 4 15.207 15.335 -18.459 1.00 0.00 N ATOM 31 CA GLY A 4 15.458 13.929 -18.205 1.00 0.00 C ATOM 32 C GLY A 4 14.363 13.035 -18.753 1.00 0.00 C ATOM 33 O GLY A 4 13.193 13.192 -18.405 1.00 0.00 O ATOM 0 H GLY A 4 15.819 15.760 -19.156 1.00 0.00 H new ATOM 0 HA2 GLY A 4 16.411 13.647 -18.653 1.00 0.00 H new ATOM 0 HA3 GLY A 4 15.550 13.768 -17.131 1.00 0.00 H new ATOM 37 N SER A 5 14.743 12.097 -19.614 1.00 0.00 N ATOM 38 CA SER A 5 13.783 11.178 -20.216 1.00 0.00 C ATOM 39 C SER A 5 14.322 9.751 -20.213 1.00 0.00 C ATOM 40 O SER A 5 15.529 9.531 -20.321 1.00 0.00 O ATOM 41 CB SER A 5 13.460 11.611 -21.647 1.00 0.00 C ATOM 42 OG SER A 5 12.837 12.884 -21.667 1.00 0.00 O ATOM 0 H SER A 5 15.708 11.953 -19.911 1.00 0.00 H new ATOM 0 HA SER A 5 12.870 11.204 -19.621 1.00 0.00 H new ATOM 0 HB2 SER A 5 14.376 11.642 -22.236 1.00 0.00 H new ATOM 0 HB3 SER A 5 12.805 10.875 -22.114 1.00 0.00 H new ATOM 0 HG SER A 5 12.642 13.138 -22.593 1.00 0.00 H new ATOM 48 N SER A 6 13.418 8.784 -20.089 1.00 0.00 N ATOM 49 CA SER A 6 13.802 7.377 -20.069 1.00 0.00 C ATOM 50 C SER A 6 13.657 6.754 -21.454 1.00 0.00 C ATOM 51 O SER A 6 12.962 7.288 -22.317 1.00 0.00 O ATOM 52 CB SER A 6 12.947 6.609 -19.059 1.00 0.00 C ATOM 53 OG SER A 6 13.463 6.744 -17.746 1.00 0.00 O ATOM 0 H SER A 6 12.415 8.949 -20.001 1.00 0.00 H new ATOM 0 HA SER A 6 14.849 7.315 -19.771 1.00 0.00 H new ATOM 0 HB2 SER A 6 11.922 6.979 -19.090 1.00 0.00 H new ATOM 0 HB3 SER A 6 12.914 5.555 -19.333 1.00 0.00 H new ATOM 0 HG SER A 6 12.898 6.246 -17.120 1.00 0.00 H new ATOM 59 N GLY A 7 14.320 5.620 -21.658 1.00 0.00 N ATOM 60 CA GLY A 7 14.252 4.942 -22.940 1.00 0.00 C ATOM 61 C GLY A 7 13.971 3.459 -22.797 1.00 0.00 C ATOM 62 O GLY A 7 13.074 2.925 -23.450 1.00 0.00 O ATOM 0 H GLY A 7 14.903 5.159 -20.959 1.00 0.00 H new ATOM 0 HA2 GLY A 7 13.472 5.399 -23.549 1.00 0.00 H new ATOM 0 HA3 GLY A 7 15.194 5.081 -23.471 1.00 0.00 H new ATOM 66 N ARG A 8 14.740 2.792 -21.943 1.00 0.00 N ATOM 67 CA ARG A 8 14.571 1.361 -21.719 1.00 0.00 C ATOM 68 C ARG A 8 13.174 1.056 -21.185 1.00 0.00 C ATOM 69 O ARG A 8 12.475 1.948 -20.705 1.00 0.00 O ATOM 70 CB ARG A 8 15.627 0.848 -20.740 1.00 0.00 C ATOM 71 CG ARG A 8 17.055 1.103 -21.195 1.00 0.00 C ATOM 72 CD ARG A 8 18.052 0.295 -20.379 1.00 0.00 C ATOM 73 NE ARG A 8 19.388 0.319 -20.968 1.00 0.00 N ATOM 74 CZ ARG A 8 20.493 0.009 -20.299 1.00 0.00 C ATOM 75 NH1 ARG A 8 20.421 -0.347 -19.024 1.00 0.00 N ATOM 76 NH2 ARG A 8 21.672 0.055 -20.904 1.00 0.00 N ATOM 0 H ARG A 8 15.486 3.219 -21.395 1.00 0.00 H new ATOM 0 HA ARG A 8 14.695 0.852 -22.675 1.00 0.00 H new ATOM 0 HB2 ARG A 8 15.473 1.323 -19.771 1.00 0.00 H new ATOM 0 HB3 ARG A 8 15.486 -0.223 -20.596 1.00 0.00 H new ATOM 0 HG2 ARG A 8 17.153 0.846 -22.250 1.00 0.00 H new ATOM 0 HG3 ARG A 8 17.283 2.165 -21.103 1.00 0.00 H new ATOM 0 HD2 ARG A 8 18.096 0.691 -19.365 1.00 0.00 H new ATOM 0 HD3 ARG A 8 17.707 -0.736 -20.304 1.00 0.00 H new ATOM 0 HE ARG A 8 19.478 0.589 -21.948 1.00 0.00 H new ATOM 0 HH11 ARG A 8 19.516 -0.383 -18.555 1.00 0.00 H new ATOM 0 HH12 ARG A 8 21.271 -0.585 -18.512 1.00 0.00 H new ATOM 0 HH21 ARG A 8 21.732 0.329 -21.885 1.00 0.00 H new ATOM 0 HH22 ARG A 8 22.519 -0.183 -20.389 1.00 0.00 H new ATOM 90 N GLN A 9 12.776 -0.209 -21.272 1.00 0.00 N ATOM 91 CA GLN A 9 11.464 -0.631 -20.797 1.00 0.00 C ATOM 92 C GLN A 9 11.367 -2.152 -20.742 1.00 0.00 C ATOM 93 O GLN A 9 11.890 -2.848 -21.612 1.00 0.00 O ATOM 94 CB GLN A 9 10.366 -0.071 -21.704 1.00 0.00 C ATOM 95 CG GLN A 9 10.489 -0.515 -23.153 1.00 0.00 C ATOM 96 CD GLN A 9 9.264 -0.168 -23.976 1.00 0.00 C ATOM 97 OE1 GLN A 9 8.420 -1.023 -24.244 1.00 0.00 O ATOM 98 NE2 GLN A 9 9.161 1.092 -24.382 1.00 0.00 N ATOM 0 H GLN A 9 13.343 -0.959 -21.667 1.00 0.00 H new ATOM 0 HA GLN A 9 11.328 -0.240 -19.789 1.00 0.00 H new ATOM 0 HB2 GLN A 9 9.395 -0.381 -21.319 1.00 0.00 H new ATOM 0 HB3 GLN A 9 10.392 1.018 -21.663 1.00 0.00 H new ATOM 0 HG2 GLN A 9 11.366 -0.047 -23.599 1.00 0.00 H new ATOM 0 HG3 GLN A 9 10.651 -1.592 -23.186 1.00 0.00 H new ATOM 0 HE21 GLN A 9 9.885 1.768 -24.137 1.00 0.00 H new ATOM 0 HE22 GLN A 9 8.358 1.384 -24.939 1.00 0.00 H new ATOM 107 N ARG A 10 10.697 -2.660 -19.713 1.00 0.00 N ATOM 108 CA ARG A 10 10.534 -4.099 -19.544 1.00 0.00 C ATOM 109 C ARG A 10 9.950 -4.732 -20.803 1.00 0.00 C ATOM 110 O ARG A 10 9.375 -4.044 -21.647 1.00 0.00 O ATOM 111 CB ARG A 10 9.630 -4.394 -18.346 1.00 0.00 C ATOM 112 CG ARG A 10 9.948 -5.708 -17.651 1.00 0.00 C ATOM 113 CD ARG A 10 8.988 -5.978 -16.503 1.00 0.00 C ATOM 114 NE ARG A 10 9.597 -6.803 -15.463 1.00 0.00 N ATOM 115 CZ ARG A 10 10.504 -6.351 -14.604 1.00 0.00 C ATOM 116 NH1 ARG A 10 10.904 -5.089 -14.660 1.00 0.00 N ATOM 117 NH2 ARG A 10 11.012 -7.164 -13.686 1.00 0.00 N ATOM 0 H ARG A 10 10.259 -2.097 -18.984 1.00 0.00 H new ATOM 0 HA ARG A 10 11.518 -4.532 -19.364 1.00 0.00 H new ATOM 0 HB2 ARG A 10 9.719 -3.581 -17.626 1.00 0.00 H new ATOM 0 HB3 ARG A 10 8.593 -4.411 -18.680 1.00 0.00 H new ATOM 0 HG2 ARG A 10 9.894 -6.524 -18.371 1.00 0.00 H new ATOM 0 HG3 ARG A 10 10.970 -5.683 -17.274 1.00 0.00 H new ATOM 0 HD2 ARG A 10 8.664 -5.031 -16.071 1.00 0.00 H new ATOM 0 HD3 ARG A 10 8.097 -6.476 -16.885 1.00 0.00 H new ATOM 0 HE ARG A 10 9.310 -7.779 -15.392 1.00 0.00 H new ATOM 0 HH11 ARG A 10 10.515 -4.462 -15.364 1.00 0.00 H new ATOM 0 HH12 ARG A 10 11.601 -4.745 -13.999 1.00 0.00 H new ATOM 0 HH21 ARG A 10 10.706 -8.136 -13.640 1.00 0.00 H new ATOM 0 HH22 ARG A 10 11.708 -6.817 -13.027 1.00 0.00 H new ATOM 131 N SER A 11 10.102 -6.047 -20.924 1.00 0.00 N ATOM 132 CA SER A 11 9.594 -6.772 -22.082 1.00 0.00 C ATOM 133 C SER A 11 8.485 -7.738 -21.675 1.00 0.00 C ATOM 134 O SER A 11 8.264 -8.759 -22.327 1.00 0.00 O ATOM 135 CB SER A 11 10.727 -7.539 -22.768 1.00 0.00 C ATOM 136 OG SER A 11 10.247 -8.266 -23.885 1.00 0.00 O ATOM 0 H SER A 11 10.573 -6.632 -20.234 1.00 0.00 H new ATOM 0 HA SER A 11 9.181 -6.045 -22.782 1.00 0.00 H new ATOM 0 HB2 SER A 11 11.500 -6.841 -23.089 1.00 0.00 H new ATOM 0 HB3 SER A 11 11.190 -8.223 -22.057 1.00 0.00 H new ATOM 0 HG SER A 11 9.541 -8.881 -23.596 1.00 0.00 H new ATOM 142 N LEU A 12 7.790 -7.408 -20.592 1.00 0.00 N ATOM 143 CA LEU A 12 6.703 -8.244 -20.096 1.00 0.00 C ATOM 144 C LEU A 12 5.497 -7.396 -19.707 1.00 0.00 C ATOM 145 O LEU A 12 5.568 -6.167 -19.691 1.00 0.00 O ATOM 146 CB LEU A 12 7.173 -9.064 -18.893 1.00 0.00 C ATOM 147 CG LEU A 12 8.180 -10.176 -19.190 1.00 0.00 C ATOM 148 CD1 LEU A 12 9.591 -9.612 -19.266 1.00 0.00 C ATOM 149 CD2 LEU A 12 8.097 -11.268 -18.134 1.00 0.00 C ATOM 0 H LEU A 12 7.960 -6.567 -20.041 1.00 0.00 H new ATOM 0 HA LEU A 12 6.404 -8.921 -20.896 1.00 0.00 H new ATOM 0 HB2 LEU A 12 7.617 -8.384 -18.166 1.00 0.00 H new ATOM 0 HB3 LEU A 12 6.299 -9.510 -18.419 1.00 0.00 H new ATOM 0 HG LEU A 12 7.933 -10.614 -20.157 1.00 0.00 H new ATOM 0 HD11 LEU A 12 10.294 -10.418 -19.478 1.00 0.00 H new ATOM 0 HD12 LEU A 12 9.643 -8.867 -20.060 1.00 0.00 H new ATOM 0 HD13 LEU A 12 9.849 -9.147 -18.315 1.00 0.00 H new ATOM 0 HD21 LEU A 12 8.821 -12.050 -18.362 1.00 0.00 H new ATOM 0 HD22 LEU A 12 8.317 -10.844 -17.154 1.00 0.00 H new ATOM 0 HD23 LEU A 12 7.093 -11.693 -18.128 1.00 0.00 H new ATOM 161 N SER A 13 4.389 -8.060 -19.393 1.00 0.00 N ATOM 162 CA SER A 13 3.166 -7.367 -19.006 1.00 0.00 C ATOM 163 C SER A 13 2.653 -7.879 -17.663 1.00 0.00 C ATOM 164 O SER A 13 1.521 -8.352 -17.556 1.00 0.00 O ATOM 165 CB SER A 13 2.090 -7.550 -20.078 1.00 0.00 C ATOM 166 OG SER A 13 0.949 -6.758 -19.795 1.00 0.00 O ATOM 0 H SER A 13 4.313 -9.077 -19.399 1.00 0.00 H new ATOM 0 HA SER A 13 3.395 -6.306 -18.908 1.00 0.00 H new ATOM 0 HB2 SER A 13 2.493 -7.277 -21.053 1.00 0.00 H new ATOM 0 HB3 SER A 13 1.803 -8.600 -20.134 1.00 0.00 H new ATOM 0 HG SER A 13 0.565 -7.033 -18.937 1.00 0.00 H new ATOM 172 N THR A 14 3.496 -7.782 -16.639 1.00 0.00 N ATOM 173 CA THR A 14 3.130 -8.235 -15.303 1.00 0.00 C ATOM 174 C THR A 14 2.577 -7.088 -14.465 1.00 0.00 C ATOM 175 O THR A 14 3.098 -6.782 -13.393 1.00 0.00 O ATOM 176 CB THR A 14 4.336 -8.856 -14.571 1.00 0.00 C ATOM 177 OG1 THR A 14 3.924 -9.373 -13.301 1.00 0.00 O ATOM 178 CG2 THR A 14 5.436 -7.825 -14.371 1.00 0.00 C ATOM 0 H THR A 14 4.437 -7.394 -16.710 1.00 0.00 H new ATOM 0 HA THR A 14 2.358 -8.995 -15.427 1.00 0.00 H new ATOM 0 HB THR A 14 4.727 -9.668 -15.184 1.00 0.00 H new ATOM 0 HG1 THR A 14 3.545 -8.649 -12.760 1.00 0.00 H new ATOM 0 HG21 THR A 14 6.277 -8.286 -13.852 1.00 0.00 H new ATOM 0 HG22 THR A 14 5.767 -7.454 -15.341 1.00 0.00 H new ATOM 0 HG23 THR A 14 5.053 -6.996 -13.776 1.00 0.00 H new ATOM 186 N SER A 15 1.517 -6.457 -14.961 1.00 0.00 N ATOM 187 CA SER A 15 0.895 -5.341 -14.259 1.00 0.00 C ATOM 188 C SER A 15 -0.179 -5.837 -13.294 1.00 0.00 C ATOM 189 O SER A 15 -1.362 -5.874 -13.630 1.00 0.00 O ATOM 190 CB SER A 15 0.283 -4.359 -15.259 1.00 0.00 C ATOM 191 OG SER A 15 0.233 -3.048 -14.723 1.00 0.00 O ATOM 0 H SER A 15 1.072 -6.700 -15.846 1.00 0.00 H new ATOM 0 HA SER A 15 1.667 -4.829 -13.685 1.00 0.00 H new ATOM 0 HB2 SER A 15 0.870 -4.357 -16.177 1.00 0.00 H new ATOM 0 HB3 SER A 15 -0.723 -4.685 -15.524 1.00 0.00 H new ATOM 0 HG SER A 15 -0.161 -2.440 -15.383 1.00 0.00 H new ATOM 197 N GLY A 16 0.245 -6.218 -12.092 1.00 0.00 N ATOM 198 CA GLY A 16 -0.691 -6.707 -11.097 1.00 0.00 C ATOM 199 C GLY A 16 0.004 -7.240 -9.860 1.00 0.00 C ATOM 200 O GLY A 16 0.087 -8.452 -9.663 1.00 0.00 O ATOM 0 H GLY A 16 1.219 -6.197 -11.790 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -1.367 -5.901 -10.811 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -1.303 -7.496 -11.535 1.00 0.00 H new ATOM 204 N GLU A 17 0.505 -6.334 -9.027 1.00 0.00 N ATOM 205 CA GLU A 17 1.199 -6.722 -7.805 1.00 0.00 C ATOM 206 C GLU A 17 0.400 -6.310 -6.571 1.00 0.00 C ATOM 207 O GLU A 17 -0.724 -5.822 -6.682 1.00 0.00 O ATOM 208 CB GLU A 17 2.591 -6.089 -7.759 1.00 0.00 C ATOM 209 CG GLU A 17 3.537 -6.621 -8.823 1.00 0.00 C ATOM 210 CD GLU A 17 3.233 -8.056 -9.208 1.00 0.00 C ATOM 211 OE1 GLU A 17 3.622 -8.968 -8.449 1.00 0.00 O ATOM 212 OE2 GLU A 17 2.608 -8.267 -10.268 1.00 0.00 O ATOM 0 H GLU A 17 0.443 -5.327 -9.176 1.00 0.00 H new ATOM 0 HA GLU A 17 1.301 -7.807 -7.805 1.00 0.00 H new ATOM 0 HB2 GLU A 17 2.494 -5.010 -7.878 1.00 0.00 H new ATOM 0 HB3 GLU A 17 3.028 -6.264 -6.776 1.00 0.00 H new ATOM 0 HG2 GLU A 17 3.473 -5.990 -9.709 1.00 0.00 H new ATOM 0 HG3 GLU A 17 4.562 -6.556 -8.458 1.00 0.00 H new ATOM 219 N SER A 18 0.990 -6.511 -5.397 1.00 0.00 N ATOM 220 CA SER A 18 0.332 -6.165 -4.143 1.00 0.00 C ATOM 221 C SER A 18 1.094 -5.060 -3.417 1.00 0.00 C ATOM 222 O SER A 18 2.064 -4.511 -3.941 1.00 0.00 O ATOM 223 CB SER A 18 0.221 -7.398 -3.244 1.00 0.00 C ATOM 224 OG SER A 18 -0.547 -8.414 -3.865 1.00 0.00 O ATOM 0 H SER A 18 1.922 -6.911 -5.288 1.00 0.00 H new ATOM 0 HA SER A 18 -0.669 -5.801 -4.375 1.00 0.00 H new ATOM 0 HB2 SER A 18 1.217 -7.778 -3.018 1.00 0.00 H new ATOM 0 HB3 SER A 18 -0.237 -7.120 -2.295 1.00 0.00 H new ATOM 0 HG SER A 18 -0.602 -9.192 -3.271 1.00 0.00 H new ATOM 230 N LEU A 19 0.648 -4.739 -2.207 1.00 0.00 N ATOM 231 CA LEU A 19 1.287 -3.699 -1.408 1.00 0.00 C ATOM 232 C LEU A 19 2.803 -3.741 -1.571 1.00 0.00 C ATOM 233 O LEU A 19 3.480 -2.720 -1.443 1.00 0.00 O ATOM 234 CB LEU A 19 0.917 -3.863 0.067 1.00 0.00 C ATOM 235 CG LEU A 19 -0.558 -4.137 0.363 1.00 0.00 C ATOM 236 CD1 LEU A 19 -0.793 -4.241 1.862 1.00 0.00 C ATOM 237 CD2 LEU A 19 -1.434 -3.049 -0.242 1.00 0.00 C ATOM 0 H LEU A 19 -0.153 -5.184 -1.758 1.00 0.00 H new ATOM 0 HA LEU A 19 0.929 -2.732 -1.761 1.00 0.00 H new ATOM 0 HB2 LEU A 19 1.508 -4.681 0.480 1.00 0.00 H new ATOM 0 HB3 LEU A 19 1.211 -2.957 0.597 1.00 0.00 H new ATOM 0 HG LEU A 19 -0.829 -5.090 -0.092 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -1.848 -4.436 2.052 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -0.194 -5.056 2.268 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -0.505 -3.305 2.341 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -2.480 -3.260 -0.022 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -1.161 -2.083 0.184 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -1.289 -3.023 -1.322 1.00 0.00 H new ATOM 249 N TYR A 20 3.330 -4.927 -1.856 1.00 0.00 N ATOM 250 CA TYR A 20 4.766 -5.102 -2.036 1.00 0.00 C ATOM 251 C TYR A 20 5.306 -4.130 -3.080 1.00 0.00 C ATOM 252 O TYR A 20 6.287 -3.425 -2.841 1.00 0.00 O ATOM 253 CB TYR A 20 5.077 -6.540 -2.453 1.00 0.00 C ATOM 254 CG TYR A 20 4.263 -7.576 -1.711 1.00 0.00 C ATOM 255 CD1 TYR A 20 4.381 -7.726 -0.335 1.00 0.00 C ATOM 256 CD2 TYR A 20 3.374 -8.403 -2.386 1.00 0.00 C ATOM 257 CE1 TYR A 20 3.639 -8.671 0.347 1.00 0.00 C ATOM 258 CE2 TYR A 20 2.627 -9.350 -1.712 1.00 0.00 C ATOM 259 CZ TYR A 20 2.763 -9.480 -0.346 1.00 0.00 C ATOM 260 OH TYR A 20 2.022 -10.422 0.330 1.00 0.00 O ATOM 0 H TYR A 20 2.784 -5.781 -1.967 1.00 0.00 H new ATOM 0 HA TYR A 20 5.254 -4.893 -1.084 1.00 0.00 H new ATOM 0 HB2 TYR A 20 4.896 -6.646 -3.523 1.00 0.00 H new ATOM 0 HB3 TYR A 20 6.136 -6.736 -2.288 1.00 0.00 H new ATOM 0 HD1 TYR A 20 5.065 -7.093 0.211 1.00 0.00 H new ATOM 0 HD2 TYR A 20 3.265 -8.304 -3.456 1.00 0.00 H new ATOM 0 HE1 TYR A 20 3.744 -8.776 1.417 1.00 0.00 H new ATOM 0 HE2 TYR A 20 1.940 -9.985 -2.252 1.00 0.00 H new ATOM 0 HH TYR A 20 1.454 -10.908 -0.304 1.00 0.00 H new ATOM 270 N HIS A 21 4.658 -4.097 -4.240 1.00 0.00 N ATOM 271 CA HIS A 21 5.071 -3.210 -5.322 1.00 0.00 C ATOM 272 C HIS A 21 4.723 -1.760 -5.000 1.00 0.00 C ATOM 273 O HIS A 21 5.566 -0.870 -5.106 1.00 0.00 O ATOM 274 CB HIS A 21 4.405 -3.627 -6.634 1.00 0.00 C ATOM 275 CG HIS A 21 5.235 -3.335 -7.846 1.00 0.00 C ATOM 276 ND1 HIS A 21 4.818 -2.498 -8.860 1.00 0.00 N ATOM 277 CD2 HIS A 21 6.465 -3.772 -8.203 1.00 0.00 C ATOM 278 CE1 HIS A 21 5.755 -2.435 -9.789 1.00 0.00 C ATOM 279 NE2 HIS A 21 6.766 -3.199 -9.414 1.00 0.00 N ATOM 0 H HIS A 21 3.845 -4.674 -4.455 1.00 0.00 H new ATOM 0 HA HIS A 21 6.153 -3.290 -5.430 1.00 0.00 H new ATOM 0 HB2 HIS A 21 4.190 -4.695 -6.600 1.00 0.00 H new ATOM 0 HB3 HIS A 21 3.449 -3.112 -6.726 1.00 0.00 H new ATOM 0 HD2 HIS A 21 7.093 -4.446 -7.640 1.00 0.00 H new ATOM 0 HE1 HIS A 21 5.704 -1.857 -10.700 1.00 0.00 H new ATOM 0 HE2 HIS A 21 7.629 -3.340 -9.939 1.00 0.00 H new ATOM 287 N VAL A 22 3.474 -1.530 -4.606 1.00 0.00 N ATOM 288 CA VAL A 22 3.014 -0.188 -4.268 1.00 0.00 C ATOM 289 C VAL A 22 4.102 0.601 -3.549 1.00 0.00 C ATOM 290 O VAL A 22 4.152 1.829 -3.634 1.00 0.00 O ATOM 291 CB VAL A 22 1.756 -0.234 -3.380 1.00 0.00 C ATOM 292 CG1 VAL A 22 1.358 1.169 -2.946 1.00 0.00 C ATOM 293 CG2 VAL A 22 0.612 -0.919 -4.112 1.00 0.00 C ATOM 0 H VAL A 22 2.763 -2.255 -4.513 1.00 0.00 H new ATOM 0 HA VAL A 22 2.770 0.309 -5.207 1.00 0.00 H new ATOM 0 HB VAL A 22 1.984 -0.815 -2.486 1.00 0.00 H new ATOM 0 HG11 VAL A 22 0.468 1.117 -2.320 1.00 0.00 H new ATOM 0 HG12 VAL A 22 2.174 1.620 -2.381 1.00 0.00 H new ATOM 0 HG13 VAL A 22 1.147 1.776 -3.826 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -0.268 -0.943 -3.470 1.00 0.00 H new ATOM 0 HG22 VAL A 22 0.382 -0.368 -5.024 1.00 0.00 H new ATOM 0 HG23 VAL A 22 0.902 -1.938 -4.368 1.00 0.00 H new ATOM 303 N LEU A 23 4.973 -0.111 -2.843 1.00 0.00 N ATOM 304 CA LEU A 23 6.062 0.522 -2.108 1.00 0.00 C ATOM 305 C LEU A 23 7.381 0.381 -2.862 1.00 0.00 C ATOM 306 O LEU A 23 8.114 1.353 -3.038 1.00 0.00 O ATOM 307 CB LEU A 23 6.190 -0.094 -0.714 1.00 0.00 C ATOM 308 CG LEU A 23 4.880 -0.319 0.043 1.00 0.00 C ATOM 309 CD1 LEU A 23 5.107 -1.221 1.245 1.00 0.00 C ATOM 310 CD2 LEU A 23 4.280 1.010 0.477 1.00 0.00 C ATOM 0 H LEU A 23 4.946 -1.128 -2.764 1.00 0.00 H new ATOM 0 HA LEU A 23 5.832 1.583 -2.009 1.00 0.00 H new ATOM 0 HB2 LEU A 23 6.702 -1.052 -0.807 1.00 0.00 H new ATOM 0 HB3 LEU A 23 6.829 0.551 -0.111 1.00 0.00 H new ATOM 0 HG LEU A 23 4.175 -0.811 -0.627 1.00 0.00 H new ATOM 0 HD11 LEU A 23 4.164 -1.370 1.771 1.00 0.00 H new ATOM 0 HD12 LEU A 23 5.491 -2.184 0.910 1.00 0.00 H new ATOM 0 HD13 LEU A 23 5.828 -0.757 1.917 1.00 0.00 H new ATOM 0 HD21 LEU A 23 3.349 0.831 1.014 1.00 0.00 H new ATOM 0 HD22 LEU A 23 4.981 1.530 1.130 1.00 0.00 H new ATOM 0 HD23 LEU A 23 4.080 1.623 -0.402 1.00 0.00 H new ATOM 322 N GLY A 24 7.676 -0.838 -3.306 1.00 0.00 N ATOM 323 CA GLY A 24 8.905 -1.084 -4.037 1.00 0.00 C ATOM 324 C GLY A 24 9.698 -2.242 -3.465 1.00 0.00 C ATOM 325 O GLY A 24 10.919 -2.160 -3.326 1.00 0.00 O ATOM 0 H GLY A 24 7.085 -1.659 -3.172 1.00 0.00 H new ATOM 0 HA2 GLY A 24 8.668 -1.290 -5.081 1.00 0.00 H new ATOM 0 HA3 GLY A 24 9.520 -0.184 -4.022 1.00 0.00 H new ATOM 329 N LEU A 25 9.003 -3.324 -3.131 1.00 0.00 N ATOM 330 CA LEU A 25 9.650 -4.505 -2.568 1.00 0.00 C ATOM 331 C LEU A 25 9.182 -5.772 -3.277 1.00 0.00 C ATOM 332 O LEU A 25 8.429 -5.709 -4.249 1.00 0.00 O ATOM 333 CB LEU A 25 9.357 -4.607 -1.070 1.00 0.00 C ATOM 334 CG LEU A 25 9.806 -3.420 -0.217 1.00 0.00 C ATOM 335 CD1 LEU A 25 9.218 -3.517 1.183 1.00 0.00 C ATOM 336 CD2 LEU A 25 11.325 -3.352 -0.155 1.00 0.00 C ATOM 0 H LEU A 25 7.992 -3.408 -3.240 1.00 0.00 H new ATOM 0 HA LEU A 25 10.725 -4.404 -2.715 1.00 0.00 H new ATOM 0 HB2 LEU A 25 8.283 -4.738 -0.938 1.00 0.00 H new ATOM 0 HB3 LEU A 25 9.837 -5.507 -0.686 1.00 0.00 H new ATOM 0 HG LEU A 25 9.440 -2.504 -0.681 1.00 0.00 H new ATOM 0 HD11 LEU A 25 9.548 -2.664 1.776 1.00 0.00 H new ATOM 0 HD12 LEU A 25 8.130 -3.517 1.121 1.00 0.00 H new ATOM 0 HD13 LEU A 25 9.554 -4.440 1.656 1.00 0.00 H new ATOM 0 HD21 LEU A 25 11.626 -2.501 0.456 1.00 0.00 H new ATOM 0 HD22 LEU A 25 11.713 -4.271 0.285 1.00 0.00 H new ATOM 0 HD23 LEU A 25 11.725 -3.235 -1.162 1.00 0.00 H new ATOM 348 N ASP A 26 9.630 -6.920 -2.782 1.00 0.00 N ATOM 349 CA ASP A 26 9.254 -8.203 -3.366 1.00 0.00 C ATOM 350 C ASP A 26 8.195 -8.897 -2.516 1.00 0.00 C ATOM 351 O ASP A 26 7.895 -8.465 -1.403 1.00 0.00 O ATOM 352 CB ASP A 26 10.483 -9.103 -3.507 1.00 0.00 C ATOM 353 CG ASP A 26 10.135 -10.479 -4.040 1.00 0.00 C ATOM 354 OD1 ASP A 26 9.918 -10.604 -5.263 1.00 0.00 O ATOM 355 OD2 ASP A 26 10.078 -11.431 -3.233 1.00 0.00 O ATOM 0 H ASP A 26 10.254 -6.989 -1.978 1.00 0.00 H new ATOM 0 HA ASP A 26 8.835 -8.016 -4.355 1.00 0.00 H new ATOM 0 HB2 ASP A 26 11.202 -8.629 -4.175 1.00 0.00 H new ATOM 0 HB3 ASP A 26 10.969 -9.205 -2.536 1.00 0.00 H new ATOM 360 N LYS A 27 7.630 -9.975 -3.048 1.00 0.00 N ATOM 361 CA LYS A 27 6.604 -10.731 -2.340 1.00 0.00 C ATOM 362 C LYS A 27 7.161 -11.332 -1.053 1.00 0.00 C ATOM 363 O LYS A 27 6.413 -11.647 -0.130 1.00 0.00 O ATOM 364 CB LYS A 27 6.049 -11.841 -3.235 1.00 0.00 C ATOM 365 CG LYS A 27 5.655 -11.364 -4.623 1.00 0.00 C ATOM 366 CD LYS A 27 4.210 -10.898 -4.663 1.00 0.00 C ATOM 367 CE LYS A 27 3.603 -11.082 -6.046 1.00 0.00 C ATOM 368 NZ LYS A 27 3.378 -12.518 -6.366 1.00 0.00 N ATOM 0 H LYS A 27 7.866 -10.345 -3.969 1.00 0.00 H new ATOM 0 HA LYS A 27 5.798 -10.045 -2.081 1.00 0.00 H new ATOM 0 HB2 LYS A 27 6.797 -12.628 -3.329 1.00 0.00 H new ATOM 0 HB3 LYS A 27 5.179 -12.285 -2.752 1.00 0.00 H new ATOM 0 HG2 LYS A 27 6.310 -10.548 -4.928 1.00 0.00 H new ATOM 0 HG3 LYS A 27 5.798 -12.172 -5.341 1.00 0.00 H new ATOM 0 HD2 LYS A 27 3.626 -11.456 -3.931 1.00 0.00 H new ATOM 0 HD3 LYS A 27 4.157 -9.847 -4.378 1.00 0.00 H new ATOM 0 HE2 LYS A 27 2.656 -10.545 -6.101 1.00 0.00 H new ATOM 0 HE3 LYS A 27 4.263 -10.642 -6.794 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 2.691 -12.597 -7.142 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 4.277 -12.955 -6.654 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 3.009 -13.007 -5.526 1.00 0.00 H new ATOM 382 N ASN A 28 8.480 -11.486 -1.001 1.00 0.00 N ATOM 383 CA ASN A 28 9.138 -12.048 0.173 1.00 0.00 C ATOM 384 C ASN A 28 9.752 -10.947 1.032 1.00 0.00 C ATOM 385 O ASN A 28 10.575 -11.214 1.907 1.00 0.00 O ATOM 386 CB ASN A 28 10.220 -13.043 -0.250 1.00 0.00 C ATOM 387 CG ASN A 28 9.659 -14.427 -0.517 1.00 0.00 C ATOM 388 OD1 ASN A 28 10.028 -15.397 0.145 1.00 0.00 O ATOM 389 ND2 ASN A 28 8.764 -14.524 -1.493 1.00 0.00 N ATOM 0 H ASN A 28 9.114 -11.230 -1.758 1.00 0.00 H new ATOM 0 HA ASN A 28 8.386 -12.569 0.765 1.00 0.00 H new ATOM 0 HB2 ASN A 28 10.717 -12.676 -1.148 1.00 0.00 H new ATOM 0 HB3 ASN A 28 10.978 -13.105 0.531 1.00 0.00 H new ATOM 0 HD21 ASN A 28 8.353 -15.430 -1.720 1.00 0.00 H new ATOM 0 HD22 ASN A 28 8.487 -13.693 -2.016 1.00 0.00 H new ATOM 396 N ALA A 29 9.345 -9.708 0.776 1.00 0.00 N ATOM 397 CA ALA A 29 9.853 -8.566 1.527 1.00 0.00 C ATOM 398 C ALA A 29 9.655 -8.764 3.026 1.00 0.00 C ATOM 399 O ALA A 29 8.578 -9.157 3.475 1.00 0.00 O ATOM 400 CB ALA A 29 9.172 -7.286 1.067 1.00 0.00 C ATOM 0 H ALA A 29 8.665 -9.469 0.054 1.00 0.00 H new ATOM 0 HA ALA A 29 10.923 -8.483 1.336 1.00 0.00 H new ATOM 0 HB1 ALA A 29 9.561 -6.442 1.636 1.00 0.00 H new ATOM 0 HB2 ALA A 29 9.369 -7.130 0.006 1.00 0.00 H new ATOM 0 HB3 ALA A 29 8.097 -7.368 1.228 1.00 0.00 H new ATOM 406 N THR A 30 10.702 -8.488 3.798 1.00 0.00 N ATOM 407 CA THR A 30 10.644 -8.637 5.247 1.00 0.00 C ATOM 408 C THR A 30 10.033 -7.405 5.902 1.00 0.00 C ATOM 409 O THR A 30 10.333 -6.273 5.520 1.00 0.00 O ATOM 410 CB THR A 30 12.043 -8.881 5.843 1.00 0.00 C ATOM 411 OG1 THR A 30 12.974 -7.931 5.313 1.00 0.00 O ATOM 412 CG2 THR A 30 12.523 -10.292 5.539 1.00 0.00 C ATOM 0 H THR A 30 11.600 -8.160 3.444 1.00 0.00 H new ATOM 0 HA THR A 30 10.014 -9.503 5.451 1.00 0.00 H new ATOM 0 HB THR A 30 11.978 -8.762 6.924 1.00 0.00 H new ATOM 0 HG1 THR A 30 13.861 -8.092 5.698 1.00 0.00 H new ATOM 0 HG21 THR A 30 13.513 -10.440 5.970 1.00 0.00 H new ATOM 0 HG22 THR A 30 11.828 -11.013 5.969 1.00 0.00 H new ATOM 0 HG23 THR A 30 12.572 -10.435 4.460 1.00 0.00 H new ATOM 420 N SER A 31 9.174 -7.630 6.891 1.00 0.00 N ATOM 421 CA SER A 31 8.517 -6.537 7.598 1.00 0.00 C ATOM 422 C SER A 31 9.465 -5.354 7.768 1.00 0.00 C ATOM 423 O SER A 31 9.078 -4.201 7.572 1.00 0.00 O ATOM 424 CB SER A 31 8.022 -7.010 8.966 1.00 0.00 C ATOM 425 OG SER A 31 9.050 -7.680 9.676 1.00 0.00 O ATOM 0 H SER A 31 8.917 -8.560 7.221 1.00 0.00 H new ATOM 0 HA SER A 31 7.663 -6.214 7.003 1.00 0.00 H new ATOM 0 HB2 SER A 31 7.673 -6.155 9.545 1.00 0.00 H new ATOM 0 HB3 SER A 31 7.170 -7.677 8.837 1.00 0.00 H new ATOM 0 HG SER A 31 8.709 -7.971 10.548 1.00 0.00 H new ATOM 431 N ASP A 32 10.708 -5.647 8.135 1.00 0.00 N ATOM 432 CA ASP A 32 11.713 -4.609 8.331 1.00 0.00 C ATOM 433 C ASP A 32 11.935 -3.818 7.046 1.00 0.00 C ATOM 434 O ASP A 32 12.007 -2.589 7.067 1.00 0.00 O ATOM 435 CB ASP A 32 13.031 -5.227 8.798 1.00 0.00 C ATOM 436 CG ASP A 32 13.890 -4.245 9.570 1.00 0.00 C ATOM 437 OD1 ASP A 32 14.352 -3.257 8.962 1.00 0.00 O ATOM 438 OD2 ASP A 32 14.102 -4.465 10.781 1.00 0.00 O ATOM 0 H ASP A 32 11.044 -6.595 8.303 1.00 0.00 H new ATOM 0 HA ASP A 32 11.349 -3.926 9.099 1.00 0.00 H new ATOM 0 HB2 ASP A 32 12.821 -6.093 9.426 1.00 0.00 H new ATOM 0 HB3 ASP A 32 13.586 -5.588 7.932 1.00 0.00 H new ATOM 443 N ASP A 33 12.043 -4.530 5.930 1.00 0.00 N ATOM 444 CA ASP A 33 12.257 -3.894 4.635 1.00 0.00 C ATOM 445 C ASP A 33 11.062 -3.027 4.251 1.00 0.00 C ATOM 446 O ASP A 33 11.186 -2.106 3.443 1.00 0.00 O ATOM 447 CB ASP A 33 12.501 -4.952 3.558 1.00 0.00 C ATOM 448 CG ASP A 33 13.967 -5.312 3.421 1.00 0.00 C ATOM 449 OD1 ASP A 33 14.820 -4.436 3.680 1.00 0.00 O ATOM 450 OD2 ASP A 33 14.263 -6.469 3.057 1.00 0.00 O ATOM 0 H ASP A 33 11.986 -5.548 5.896 1.00 0.00 H new ATOM 0 HA ASP A 33 13.137 -3.255 4.713 1.00 0.00 H new ATOM 0 HB2 ASP A 33 11.931 -5.849 3.799 1.00 0.00 H new ATOM 0 HB3 ASP A 33 12.129 -4.585 2.601 1.00 0.00 H new ATOM 455 N ILE A 34 9.907 -3.327 4.836 1.00 0.00 N ATOM 456 CA ILE A 34 8.691 -2.575 4.555 1.00 0.00 C ATOM 457 C ILE A 34 8.622 -1.307 5.399 1.00 0.00 C ATOM 458 O ILE A 34 8.155 -0.265 4.938 1.00 0.00 O ATOM 459 CB ILE A 34 7.432 -3.422 4.817 1.00 0.00 C ATOM 460 CG1 ILE A 34 7.403 -4.634 3.884 1.00 0.00 C ATOM 461 CG2 ILE A 34 6.179 -2.577 4.636 1.00 0.00 C ATOM 462 CD1 ILE A 34 6.449 -5.719 4.332 1.00 0.00 C ATOM 0 H ILE A 34 9.788 -4.086 5.507 1.00 0.00 H new ATOM 0 HA ILE A 34 8.724 -2.305 3.500 1.00 0.00 H new ATOM 0 HB ILE A 34 7.460 -3.780 5.846 1.00 0.00 H new ATOM 0 HG12 ILE A 34 7.122 -4.305 2.883 1.00 0.00 H new ATOM 0 HG13 ILE A 34 8.407 -5.051 3.813 1.00 0.00 H new ATOM 0 HG21 ILE A 34 5.297 -3.189 4.824 1.00 0.00 H new ATOM 0 HG22 ILE A 34 6.198 -1.743 5.337 1.00 0.00 H new ATOM 0 HG23 ILE A 34 6.143 -2.193 3.616 1.00 0.00 H new ATOM 0 HD11 ILE A 34 6.481 -6.547 3.623 1.00 0.00 H new ATOM 0 HD12 ILE A 34 6.741 -6.075 5.320 1.00 0.00 H new ATOM 0 HD13 ILE A 34 5.436 -5.318 4.376 1.00 0.00 H new ATOM 474 N LYS A 35 9.092 -1.402 6.639 1.00 0.00 N ATOM 475 CA LYS A 35 9.087 -0.262 7.549 1.00 0.00 C ATOM 476 C LYS A 35 10.102 0.789 7.110 1.00 0.00 C ATOM 477 O LYS A 35 9.816 1.986 7.122 1.00 0.00 O ATOM 478 CB LYS A 35 9.397 -0.722 8.975 1.00 0.00 C ATOM 479 CG LYS A 35 8.160 -1.088 9.778 1.00 0.00 C ATOM 480 CD LYS A 35 8.513 -1.932 10.991 1.00 0.00 C ATOM 481 CE LYS A 35 8.494 -3.417 10.662 1.00 0.00 C ATOM 482 NZ LYS A 35 9.264 -4.215 11.655 1.00 0.00 N ATOM 0 H LYS A 35 9.481 -2.257 7.037 1.00 0.00 H new ATOM 0 HA LYS A 35 8.094 0.186 7.526 1.00 0.00 H new ATOM 0 HB2 LYS A 35 10.061 -1.585 8.933 1.00 0.00 H new ATOM 0 HB3 LYS A 35 9.936 0.070 9.494 1.00 0.00 H new ATOM 0 HG2 LYS A 35 7.653 -0.179 10.101 1.00 0.00 H new ATOM 0 HG3 LYS A 35 7.462 -1.634 9.144 1.00 0.00 H new ATOM 0 HD2 LYS A 35 9.501 -1.652 11.355 1.00 0.00 H new ATOM 0 HD3 LYS A 35 7.807 -1.728 11.796 1.00 0.00 H new ATOM 0 HE2 LYS A 35 7.463 -3.770 10.634 1.00 0.00 H new ATOM 0 HE3 LYS A 35 8.912 -3.574 9.668 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 9.227 -5.221 11.395 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 10.254 -3.896 11.664 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 8.850 -4.086 12.600 1.00 0.00 H new ATOM 496 N LYS A 36 11.288 0.333 6.722 1.00 0.00 N ATOM 497 CA LYS A 36 12.345 1.233 6.276 1.00 0.00 C ATOM 498 C LYS A 36 11.980 1.885 4.946 1.00 0.00 C ATOM 499 O LYS A 36 12.275 3.058 4.718 1.00 0.00 O ATOM 500 CB LYS A 36 13.666 0.472 6.138 1.00 0.00 C ATOM 501 CG LYS A 36 13.686 -0.505 4.975 1.00 0.00 C ATOM 502 CD LYS A 36 15.083 -1.050 4.729 1.00 0.00 C ATOM 503 CE LYS A 36 15.482 -2.062 5.792 1.00 0.00 C ATOM 504 NZ LYS A 36 16.935 -2.383 5.736 1.00 0.00 N ATOM 0 H LYS A 36 11.541 -0.655 6.707 1.00 0.00 H new ATOM 0 HA LYS A 36 12.460 2.017 7.025 1.00 0.00 H new ATOM 0 HB2 LYS A 36 14.477 1.189 6.013 1.00 0.00 H new ATOM 0 HB3 LYS A 36 13.861 -0.072 7.062 1.00 0.00 H new ATOM 0 HG2 LYS A 36 13.003 -1.330 5.180 1.00 0.00 H new ATOM 0 HG3 LYS A 36 13.325 -0.008 4.075 1.00 0.00 H new ATOM 0 HD2 LYS A 36 15.124 -1.518 3.746 1.00 0.00 H new ATOM 0 HD3 LYS A 36 15.799 -0.228 4.721 1.00 0.00 H new ATOM 0 HE2 LYS A 36 15.235 -1.669 6.778 1.00 0.00 H new ATOM 0 HE3 LYS A 36 14.903 -2.976 5.659 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 17.166 -3.076 6.476 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 17.167 -2.782 4.804 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 17.488 -1.516 5.889 1.00 0.00 H new ATOM 518 N SER A 37 11.337 1.117 4.073 1.00 0.00 N ATOM 519 CA SER A 37 10.933 1.620 2.765 1.00 0.00 C ATOM 520 C SER A 37 9.886 2.720 2.905 1.00 0.00 C ATOM 521 O SER A 37 10.007 3.788 2.304 1.00 0.00 O ATOM 522 CB SER A 37 10.382 0.481 1.905 1.00 0.00 C ATOM 523 OG SER A 37 11.420 -0.383 1.475 1.00 0.00 O ATOM 0 H SER A 37 11.084 0.144 4.247 1.00 0.00 H new ATOM 0 HA SER A 37 11.813 2.041 2.278 1.00 0.00 H new ATOM 0 HB2 SER A 37 9.646 -0.086 2.475 1.00 0.00 H new ATOM 0 HB3 SER A 37 9.865 0.893 1.038 1.00 0.00 H new ATOM 0 HG SER A 37 11.442 -1.178 2.048 1.00 0.00 H new ATOM 529 N TYR A 38 8.858 2.451 3.702 1.00 0.00 N ATOM 530 CA TYR A 38 7.787 3.416 3.920 1.00 0.00 C ATOM 531 C TYR A 38 8.353 4.807 4.190 1.00 0.00 C ATOM 532 O TYR A 38 7.815 5.810 3.722 1.00 0.00 O ATOM 533 CB TYR A 38 6.906 2.976 5.090 1.00 0.00 C ATOM 534 CG TYR A 38 6.200 4.121 5.781 1.00 0.00 C ATOM 535 CD1 TYR A 38 5.270 4.899 5.103 1.00 0.00 C ATOM 536 CD2 TYR A 38 6.464 4.425 7.111 1.00 0.00 C ATOM 537 CE1 TYR A 38 4.623 5.947 5.730 1.00 0.00 C ATOM 538 CE2 TYR A 38 5.821 5.470 7.746 1.00 0.00 C ATOM 539 CZ TYR A 38 4.902 6.228 7.051 1.00 0.00 C ATOM 540 OH TYR A 38 4.260 7.270 7.680 1.00 0.00 O ATOM 0 H TYR A 38 8.744 1.573 4.208 1.00 0.00 H new ATOM 0 HA TYR A 38 7.182 3.459 3.014 1.00 0.00 H new ATOM 0 HB2 TYR A 38 6.162 2.267 4.727 1.00 0.00 H new ATOM 0 HB3 TYR A 38 7.521 2.447 5.818 1.00 0.00 H new ATOM 0 HD1 TYR A 38 5.049 4.681 4.069 1.00 0.00 H new ATOM 0 HD2 TYR A 38 7.184 3.834 7.658 1.00 0.00 H new ATOM 0 HE1 TYR A 38 3.903 6.543 5.188 1.00 0.00 H new ATOM 0 HE2 TYR A 38 6.037 5.692 8.781 1.00 0.00 H new ATOM 0 HH TYR A 38 4.569 7.333 8.608 1.00 0.00 H new ATOM 550 N ARG A 39 9.444 4.857 4.948 1.00 0.00 N ATOM 551 CA ARG A 39 10.084 6.124 5.282 1.00 0.00 C ATOM 552 C ARG A 39 10.423 6.911 4.019 1.00 0.00 C ATOM 553 O ARG A 39 9.869 7.983 3.775 1.00 0.00 O ATOM 554 CB ARG A 39 11.354 5.878 6.098 1.00 0.00 C ATOM 555 CG ARG A 39 11.084 5.499 7.545 1.00 0.00 C ATOM 556 CD ARG A 39 12.361 5.505 8.371 1.00 0.00 C ATOM 557 NE ARG A 39 12.801 6.860 8.688 1.00 0.00 N ATOM 558 CZ ARG A 39 13.871 7.132 9.427 1.00 0.00 C ATOM 559 NH1 ARG A 39 14.606 6.146 9.922 1.00 0.00 N ATOM 560 NH2 ARG A 39 14.208 8.392 9.672 1.00 0.00 N ATOM 0 H ARG A 39 9.903 4.036 5.342 1.00 0.00 H new ATOM 0 HA ARG A 39 9.385 6.710 5.878 1.00 0.00 H new ATOM 0 HB2 ARG A 39 11.932 5.084 5.625 1.00 0.00 H new ATOM 0 HB3 ARG A 39 11.970 6.777 6.076 1.00 0.00 H new ATOM 0 HG2 ARG A 39 10.367 6.197 7.977 1.00 0.00 H new ATOM 0 HG3 ARG A 39 10.629 4.509 7.584 1.00 0.00 H new ATOM 0 HD2 ARG A 39 12.197 4.951 9.296 1.00 0.00 H new ATOM 0 HD3 ARG A 39 13.149 4.987 7.824 1.00 0.00 H new ATOM 0 HE ARG A 39 12.257 7.641 8.322 1.00 0.00 H new ATOM 0 HH11 ARG A 39 14.350 5.176 9.736 1.00 0.00 H new ATOM 0 HH12 ARG A 39 15.427 6.357 10.489 1.00 0.00 H new ATOM 0 HH21 ARG A 39 13.645 9.153 9.293 1.00 0.00 H new ATOM 0 HH22 ARG A 39 15.030 8.599 10.240 1.00 0.00 H new ATOM 574 N LYS A 40 11.337 6.372 3.219 1.00 0.00 N ATOM 575 CA LYS A 40 11.750 7.022 1.981 1.00 0.00 C ATOM 576 C LYS A 40 10.541 7.361 1.115 1.00 0.00 C ATOM 577 O LYS A 40 10.475 8.436 0.517 1.00 0.00 O ATOM 578 CB LYS A 40 12.711 6.120 1.204 1.00 0.00 C ATOM 579 CG LYS A 40 12.207 4.697 1.035 1.00 0.00 C ATOM 580 CD LYS A 40 13.133 3.878 0.151 1.00 0.00 C ATOM 581 CE LYS A 40 14.265 3.255 0.954 1.00 0.00 C ATOM 582 NZ LYS A 40 14.933 2.153 0.209 1.00 0.00 N ATOM 0 H LYS A 40 11.806 5.486 3.406 1.00 0.00 H new ATOM 0 HA LYS A 40 12.261 7.950 2.239 1.00 0.00 H new ATOM 0 HB2 LYS A 40 12.887 6.553 0.220 1.00 0.00 H new ATOM 0 HB3 LYS A 40 13.671 6.098 1.719 1.00 0.00 H new ATOM 0 HG2 LYS A 40 12.121 4.222 2.012 1.00 0.00 H new ATOM 0 HG3 LYS A 40 11.208 4.713 0.600 1.00 0.00 H new ATOM 0 HD2 LYS A 40 12.563 3.093 -0.346 1.00 0.00 H new ATOM 0 HD3 LYS A 40 13.548 4.514 -0.631 1.00 0.00 H new ATOM 0 HE2 LYS A 40 14.999 4.022 1.203 1.00 0.00 H new ATOM 0 HE3 LYS A 40 13.873 2.871 1.896 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 15.698 1.755 0.790 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 14.239 1.409 -0.006 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 15.329 2.524 -0.678 1.00 0.00 H new ATOM 596 N LEU A 41 9.587 6.440 1.053 1.00 0.00 N ATOM 597 CA LEU A 41 8.378 6.642 0.261 1.00 0.00 C ATOM 598 C LEU A 41 7.488 7.709 0.889 1.00 0.00 C ATOM 599 O LEU A 41 6.554 8.203 0.257 1.00 0.00 O ATOM 600 CB LEU A 41 7.605 5.329 0.130 1.00 0.00 C ATOM 601 CG LEU A 41 8.396 4.134 -0.403 1.00 0.00 C ATOM 602 CD1 LEU A 41 7.616 2.844 -0.201 1.00 0.00 C ATOM 603 CD2 LEU A 41 8.732 4.331 -1.874 1.00 0.00 C ATOM 0 H LEU A 41 9.626 5.545 1.541 1.00 0.00 H new ATOM 0 HA LEU A 41 8.676 6.981 -0.731 1.00 0.00 H new ATOM 0 HB2 LEU A 41 7.205 5.067 1.110 1.00 0.00 H new ATOM 0 HB3 LEU A 41 6.752 5.497 -0.528 1.00 0.00 H new ATOM 0 HG LEU A 41 9.329 4.062 0.156 1.00 0.00 H new ATOM 0 HD11 LEU A 41 8.195 2.005 -0.586 1.00 0.00 H new ATOM 0 HD12 LEU A 41 7.426 2.696 0.862 1.00 0.00 H new ATOM 0 HD13 LEU A 41 6.667 2.905 -0.734 1.00 0.00 H new ATOM 0 HD21 LEU A 41 9.295 3.471 -2.237 1.00 0.00 H new ATOM 0 HD22 LEU A 41 7.810 4.430 -2.448 1.00 0.00 H new ATOM 0 HD23 LEU A 41 9.332 5.234 -1.993 1.00 0.00 H new ATOM 615 N ALA A 42 7.785 8.062 2.135 1.00 0.00 N ATOM 616 CA ALA A 42 7.014 9.074 2.847 1.00 0.00 C ATOM 617 C ALA A 42 7.659 10.450 2.713 1.00 0.00 C ATOM 618 O ALA A 42 6.991 11.476 2.851 1.00 0.00 O ATOM 619 CB ALA A 42 6.873 8.695 4.314 1.00 0.00 C ATOM 0 H ALA A 42 8.554 7.662 2.673 1.00 0.00 H new ATOM 0 HA ALA A 42 6.022 9.122 2.399 1.00 0.00 H new ATOM 0 HB1 ALA A 42 6.295 9.459 4.833 1.00 0.00 H new ATOM 0 HB2 ALA A 42 6.361 7.736 4.394 1.00 0.00 H new ATOM 0 HB3 ALA A 42 7.862 8.618 4.766 1.00 0.00 H new ATOM 625 N LEU A 43 8.960 10.465 2.446 1.00 0.00 N ATOM 626 CA LEU A 43 9.696 11.715 2.295 1.00 0.00 C ATOM 627 C LEU A 43 9.553 12.263 0.879 1.00 0.00 C ATOM 628 O LEU A 43 9.673 13.467 0.652 1.00 0.00 O ATOM 629 CB LEU A 43 11.175 11.503 2.625 1.00 0.00 C ATOM 630 CG LEU A 43 11.529 11.447 4.111 1.00 0.00 C ATOM 631 CD1 LEU A 43 11.251 10.062 4.674 1.00 0.00 C ATOM 632 CD2 LEU A 43 12.987 11.829 4.326 1.00 0.00 C ATOM 0 H LEU A 43 9.527 9.625 2.330 1.00 0.00 H new ATOM 0 HA LEU A 43 9.276 12.441 2.991 1.00 0.00 H new ATOM 0 HB2 LEU A 43 11.501 10.573 2.159 1.00 0.00 H new ATOM 0 HB3 LEU A 43 11.748 12.308 2.165 1.00 0.00 H new ATOM 0 HG LEU A 43 10.903 12.165 4.642 1.00 0.00 H new ATOM 0 HD11 LEU A 43 11.509 10.041 5.733 1.00 0.00 H new ATOM 0 HD12 LEU A 43 10.194 9.826 4.553 1.00 0.00 H new ATOM 0 HD13 LEU A 43 11.851 9.325 4.140 1.00 0.00 H new ATOM 0 HD21 LEU A 43 13.222 11.784 5.389 1.00 0.00 H new ATOM 0 HD22 LEU A 43 13.629 11.135 3.783 1.00 0.00 H new ATOM 0 HD23 LEU A 43 13.156 12.842 3.960 1.00 0.00 H new ATOM 644 N LYS A 44 9.293 11.372 -0.072 1.00 0.00 N ATOM 645 CA LYS A 44 9.129 11.765 -1.466 1.00 0.00 C ATOM 646 C LYS A 44 7.674 12.110 -1.767 1.00 0.00 C ATOM 647 O LYS A 44 7.388 12.922 -2.647 1.00 0.00 O ATOM 648 CB LYS A 44 9.600 10.642 -2.393 1.00 0.00 C ATOM 649 CG LYS A 44 8.634 9.472 -2.470 1.00 0.00 C ATOM 650 CD LYS A 44 9.295 8.241 -3.066 1.00 0.00 C ATOM 651 CE LYS A 44 9.504 8.390 -4.565 1.00 0.00 C ATOM 652 NZ LYS A 44 10.673 7.601 -5.043 1.00 0.00 N ATOM 0 H LYS A 44 9.191 10.371 0.098 1.00 0.00 H new ATOM 0 HA LYS A 44 9.738 12.652 -1.641 1.00 0.00 H new ATOM 0 HB2 LYS A 44 9.748 11.047 -3.394 1.00 0.00 H new ATOM 0 HB3 LYS A 44 10.569 10.280 -2.049 1.00 0.00 H new ATOM 0 HG2 LYS A 44 8.263 9.239 -1.472 1.00 0.00 H new ATOM 0 HG3 LYS A 44 7.771 9.751 -3.074 1.00 0.00 H new ATOM 0 HD2 LYS A 44 10.255 8.071 -2.579 1.00 0.00 H new ATOM 0 HD3 LYS A 44 8.678 7.364 -2.869 1.00 0.00 H new ATOM 0 HE2 LYS A 44 8.607 8.064 -5.091 1.00 0.00 H new ATOM 0 HE3 LYS A 44 9.652 9.442 -4.808 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 10.782 7.729 -6.069 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 11.534 7.929 -4.560 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 10.521 6.594 -4.834 1.00 0.00 H new ATOM 666 N TYR A 45 6.759 11.491 -1.029 1.00 0.00 N ATOM 667 CA TYR A 45 5.334 11.732 -1.218 1.00 0.00 C ATOM 668 C TYR A 45 4.716 12.351 0.032 1.00 0.00 C ATOM 669 O TYR A 45 3.540 12.139 0.328 1.00 0.00 O ATOM 670 CB TYR A 45 4.615 10.427 -1.562 1.00 0.00 C ATOM 671 CG TYR A 45 5.123 9.771 -2.827 1.00 0.00 C ATOM 672 CD1 TYR A 45 5.025 10.415 -4.054 1.00 0.00 C ATOM 673 CD2 TYR A 45 5.701 8.508 -2.794 1.00 0.00 C ATOM 674 CE1 TYR A 45 5.487 9.820 -5.212 1.00 0.00 C ATOM 675 CE2 TYR A 45 6.166 7.906 -3.947 1.00 0.00 C ATOM 676 CZ TYR A 45 6.057 8.566 -5.153 1.00 0.00 C ATOM 677 OH TYR A 45 6.519 7.970 -6.304 1.00 0.00 O ATOM 0 H TYR A 45 6.979 10.819 -0.294 1.00 0.00 H new ATOM 0 HA TYR A 45 5.217 12.432 -2.045 1.00 0.00 H new ATOM 0 HB2 TYR A 45 4.727 9.730 -0.731 1.00 0.00 H new ATOM 0 HB3 TYR A 45 3.549 10.627 -1.669 1.00 0.00 H new ATOM 0 HD1 TYR A 45 4.580 11.398 -4.103 1.00 0.00 H new ATOM 0 HD2 TYR A 45 5.788 7.988 -1.851 1.00 0.00 H new ATOM 0 HE1 TYR A 45 5.402 10.334 -6.158 1.00 0.00 H new ATOM 0 HE2 TYR A 45 6.613 6.924 -3.904 1.00 0.00 H new ATOM 0 HH TYR A 45 6.892 7.090 -6.089 1.00 0.00 H new ATOM 687 N HIS A 46 5.518 13.120 0.762 1.00 0.00 N ATOM 688 CA HIS A 46 5.052 13.772 1.980 1.00 0.00 C ATOM 689 C HIS A 46 4.045 14.872 1.656 1.00 0.00 C ATOM 690 O HIS A 46 4.191 15.613 0.683 1.00 0.00 O ATOM 691 CB HIS A 46 6.233 14.358 2.755 1.00 0.00 C ATOM 692 CG HIS A 46 6.015 14.399 4.237 1.00 0.00 C ATOM 693 ND1 HIS A 46 5.403 15.455 4.878 1.00 0.00 N ATOM 694 CD2 HIS A 46 6.332 13.506 5.203 1.00 0.00 C ATOM 695 CE1 HIS A 46 5.353 15.210 6.175 1.00 0.00 C ATOM 696 NE2 HIS A 46 5.910 14.034 6.399 1.00 0.00 N ATOM 0 H HIS A 46 6.494 13.307 0.531 1.00 0.00 H new ATOM 0 HA HIS A 46 4.559 13.022 2.598 1.00 0.00 H new ATOM 0 HB2 HIS A 46 7.125 13.768 2.543 1.00 0.00 H new ATOM 0 HB3 HIS A 46 6.427 15.369 2.396 1.00 0.00 H new ATOM 0 HD2 HIS A 46 6.825 12.556 5.060 1.00 0.00 H new ATOM 0 HE1 HIS A 46 4.929 15.861 6.925 1.00 0.00 H new ATOM 0 HE2 HIS A 46 6.011 13.590 7.312 1.00 0.00 H new ATOM 704 N PRO A 47 2.999 14.983 2.488 1.00 0.00 N ATOM 705 CA PRO A 47 1.949 15.989 2.310 1.00 0.00 C ATOM 706 C PRO A 47 2.446 17.403 2.591 1.00 0.00 C ATOM 707 O PRO A 47 1.975 18.368 1.990 1.00 0.00 O ATOM 708 CB PRO A 47 0.889 15.581 3.337 1.00 0.00 C ATOM 709 CG PRO A 47 1.643 14.837 4.385 1.00 0.00 C ATOM 710 CD PRO A 47 2.762 14.133 3.668 1.00 0.00 C ATOM 0 HA PRO A 47 1.581 16.016 1.284 1.00 0.00 H new ATOM 0 HB2 PRO A 47 0.386 16.453 3.755 1.00 0.00 H new ATOM 0 HB3 PRO A 47 0.119 14.956 2.884 1.00 0.00 H new ATOM 0 HG2 PRO A 47 2.032 15.517 5.143 1.00 0.00 H new ATOM 0 HG3 PRO A 47 0.998 14.123 4.898 1.00 0.00 H new ATOM 0 HD2 PRO A 47 3.652 14.054 4.292 1.00 0.00 H new ATOM 0 HD3 PRO A 47 2.482 13.119 3.383 1.00 0.00 H new ATOM 718 N ASP A 48 3.401 17.517 3.508 1.00 0.00 N ATOM 719 CA ASP A 48 3.964 18.814 3.867 1.00 0.00 C ATOM 720 C ASP A 48 4.845 19.354 2.745 1.00 0.00 C ATOM 721 O ASP A 48 5.012 20.565 2.600 1.00 0.00 O ATOM 722 CB ASP A 48 4.775 18.701 5.160 1.00 0.00 C ATOM 723 CG ASP A 48 5.837 19.777 5.272 1.00 0.00 C ATOM 724 OD1 ASP A 48 5.508 20.889 5.736 1.00 0.00 O ATOM 725 OD2 ASP A 48 6.997 19.506 4.898 1.00 0.00 O ATOM 0 H ASP A 48 3.801 16.728 4.016 1.00 0.00 H new ATOM 0 HA ASP A 48 3.140 19.510 4.023 1.00 0.00 H new ATOM 0 HB2 ASP A 48 4.102 18.768 6.015 1.00 0.00 H new ATOM 0 HB3 ASP A 48 5.249 17.720 5.204 1.00 0.00 H new ATOM 730 N LYS A 49 5.409 18.447 1.954 1.00 0.00 N ATOM 731 CA LYS A 49 6.273 18.831 0.844 1.00 0.00 C ATOM 732 C LYS A 49 5.450 19.314 -0.345 1.00 0.00 C ATOM 733 O LYS A 49 5.755 20.343 -0.946 1.00 0.00 O ATOM 734 CB LYS A 49 7.152 17.650 0.424 1.00 0.00 C ATOM 735 CG LYS A 49 7.937 17.038 1.570 1.00 0.00 C ATOM 736 CD LYS A 49 9.273 17.735 1.765 1.00 0.00 C ATOM 737 CE LYS A 49 10.284 17.308 0.712 1.00 0.00 C ATOM 738 NZ LYS A 49 10.904 15.994 1.038 1.00 0.00 N ATOM 0 H LYS A 49 5.283 17.441 2.061 1.00 0.00 H new ATOM 0 HA LYS A 49 6.910 19.650 1.178 1.00 0.00 H new ATOM 0 HB2 LYS A 49 6.523 16.882 -0.025 1.00 0.00 H new ATOM 0 HB3 LYS A 49 7.849 17.982 -0.346 1.00 0.00 H new ATOM 0 HG2 LYS A 49 7.354 17.104 2.488 1.00 0.00 H new ATOM 0 HG3 LYS A 49 8.103 15.979 1.374 1.00 0.00 H new ATOM 0 HD2 LYS A 49 9.131 18.815 1.718 1.00 0.00 H new ATOM 0 HD3 LYS A 49 9.662 17.507 2.758 1.00 0.00 H new ATOM 0 HE2 LYS A 49 9.793 17.247 -0.259 1.00 0.00 H new ATOM 0 HE3 LYS A 49 11.063 18.066 0.628 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 11.771 15.871 0.477 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 11.139 15.963 2.051 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 10.235 15.230 0.814 1.00 0.00 H new ATOM 752 N ASN A 50 4.403 18.566 -0.678 1.00 0.00 N ATOM 753 CA ASN A 50 3.535 18.919 -1.795 1.00 0.00 C ATOM 754 C ASN A 50 2.247 19.570 -1.298 1.00 0.00 C ATOM 755 O ASN A 50 1.491 18.992 -0.517 1.00 0.00 O ATOM 756 CB ASN A 50 3.204 17.677 -2.624 1.00 0.00 C ATOM 757 CG ASN A 50 4.441 16.875 -2.983 1.00 0.00 C ATOM 758 OD1 ASN A 50 5.017 17.049 -4.057 1.00 0.00 O ATOM 759 ND2 ASN A 50 4.854 15.992 -2.082 1.00 0.00 N ATOM 0 H ASN A 50 4.135 17.711 -0.190 1.00 0.00 H new ATOM 0 HA ASN A 50 4.066 19.635 -2.422 1.00 0.00 H new ATOM 0 HB2 ASN A 50 2.513 17.045 -2.066 1.00 0.00 H new ATOM 0 HB3 ASN A 50 2.692 17.979 -3.538 1.00 0.00 H new ATOM 0 HD21 ASN A 50 5.681 15.424 -2.267 1.00 0.00 H new ATOM 0 HD22 ASN A 50 4.345 15.882 -1.205 1.00 0.00 H new ATOM 766 N PRO A 51 1.990 20.802 -1.762 1.00 0.00 N ATOM 767 CA PRO A 51 0.793 21.558 -1.379 1.00 0.00 C ATOM 768 C PRO A 51 -0.481 20.963 -1.969 1.00 0.00 C ATOM 769 O PRO A 51 -0.718 21.050 -3.174 1.00 0.00 O ATOM 770 CB PRO A 51 1.053 22.950 -1.960 1.00 0.00 C ATOM 771 CG PRO A 51 1.987 22.718 -3.098 1.00 0.00 C ATOM 772 CD PRO A 51 2.846 21.552 -2.696 1.00 0.00 C ATOM 0 HA PRO A 51 0.635 21.554 -0.301 1.00 0.00 H new ATOM 0 HB2 PRO A 51 0.128 23.418 -2.296 1.00 0.00 H new ATOM 0 HB3 PRO A 51 1.493 23.614 -1.216 1.00 0.00 H new ATOM 0 HG2 PRO A 51 1.439 22.501 -4.015 1.00 0.00 H new ATOM 0 HG3 PRO A 51 2.594 23.602 -3.291 1.00 0.00 H new ATOM 0 HD2 PRO A 51 3.129 20.946 -3.557 1.00 0.00 H new ATOM 0 HD3 PRO A 51 3.770 21.879 -2.219 1.00 0.00 H new ATOM 780 N ASP A 52 -1.298 20.361 -1.112 1.00 0.00 N ATOM 781 CA ASP A 52 -2.550 19.753 -1.548 1.00 0.00 C ATOM 782 C ASP A 52 -2.408 19.159 -2.946 1.00 0.00 C ATOM 783 O ASP A 52 -3.246 19.389 -3.817 1.00 0.00 O ATOM 784 CB ASP A 52 -3.677 20.788 -1.532 1.00 0.00 C ATOM 785 CG ASP A 52 -3.933 21.344 -0.145 1.00 0.00 C ATOM 786 OD1 ASP A 52 -4.507 20.614 0.689 1.00 0.00 O ATOM 787 OD2 ASP A 52 -3.560 22.509 0.105 1.00 0.00 O ATOM 0 H ASP A 52 -1.116 20.281 -0.112 1.00 0.00 H new ATOM 0 HA ASP A 52 -2.796 18.949 -0.854 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -3.425 21.606 -2.207 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -4.591 20.331 -1.912 1.00 0.00 H new ATOM 792 N ASN A 53 -1.340 18.396 -3.153 1.00 0.00 N ATOM 793 CA ASN A 53 -1.087 17.770 -4.446 1.00 0.00 C ATOM 794 C ASN A 53 -1.919 16.501 -4.609 1.00 0.00 C ATOM 795 O ASN A 53 -1.889 15.598 -3.773 1.00 0.00 O ATOM 796 CB ASN A 53 0.400 17.441 -4.595 1.00 0.00 C ATOM 797 CG ASN A 53 1.174 18.556 -5.272 1.00 0.00 C ATOM 798 OD1 ASN A 53 0.985 19.733 -4.965 1.00 0.00 O ATOM 799 ND2 ASN A 53 2.051 18.188 -6.199 1.00 0.00 N ATOM 0 H ASN A 53 -0.636 18.196 -2.443 1.00 0.00 H new ATOM 0 HA ASN A 53 -1.376 18.475 -5.225 1.00 0.00 H new ATOM 0 HB2 ASN A 53 0.828 17.251 -3.611 1.00 0.00 H new ATOM 0 HB3 ASN A 53 0.510 16.523 -5.173 1.00 0.00 H new ATOM 0 HD21 ASN A 53 2.601 18.893 -6.689 1.00 0.00 H new ATOM 0 HD22 ASN A 53 2.174 17.200 -6.421 1.00 0.00 H new ATOM 806 N PRO A 54 -2.679 16.430 -5.711 1.00 0.00 N ATOM 807 CA PRO A 54 -3.533 15.276 -6.011 1.00 0.00 C ATOM 808 C PRO A 54 -2.724 14.034 -6.369 1.00 0.00 C ATOM 809 O PRO A 54 -3.132 12.911 -6.075 1.00 0.00 O ATOM 810 CB PRO A 54 -4.354 15.746 -7.214 1.00 0.00 C ATOM 811 CG PRO A 54 -3.512 16.789 -7.864 1.00 0.00 C ATOM 812 CD PRO A 54 -2.764 17.469 -6.751 1.00 0.00 C ATOM 0 HA PRO A 54 -4.138 14.982 -5.153 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -4.562 14.923 -7.897 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -5.316 16.152 -6.902 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -2.823 16.343 -8.582 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -4.128 17.502 -8.413 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -1.776 17.797 -7.073 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -3.292 18.353 -6.393 1.00 0.00 H new ATOM 820 N GLU A 55 -1.576 14.245 -7.006 1.00 0.00 N ATOM 821 CA GLU A 55 -0.711 13.141 -7.405 1.00 0.00 C ATOM 822 C GLU A 55 0.116 12.643 -6.223 1.00 0.00 C ATOM 823 O GLU A 55 0.281 11.439 -6.030 1.00 0.00 O ATOM 824 CB GLU A 55 0.215 13.574 -8.543 1.00 0.00 C ATOM 825 CG GLU A 55 1.178 14.684 -8.155 1.00 0.00 C ATOM 826 CD GLU A 55 2.199 14.975 -9.237 1.00 0.00 C ATOM 827 OE1 GLU A 55 1.889 15.773 -10.146 1.00 0.00 O ATOM 828 OE2 GLU A 55 3.309 14.405 -9.174 1.00 0.00 O ATOM 0 H GLU A 55 -1.224 15.169 -7.256 1.00 0.00 H new ATOM 0 HA GLU A 55 -1.344 12.325 -7.753 1.00 0.00 H new ATOM 0 HB2 GLU A 55 0.787 12.711 -8.883 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -0.390 13.908 -9.386 1.00 0.00 H new ATOM 0 HG2 GLU A 55 0.613 15.591 -7.940 1.00 0.00 H new ATOM 0 HG3 GLU A 55 1.696 14.406 -7.237 1.00 0.00 H new ATOM 835 N ALA A 56 0.633 13.580 -5.434 1.00 0.00 N ATOM 836 CA ALA A 56 1.441 13.238 -4.270 1.00 0.00 C ATOM 837 C ALA A 56 0.616 12.490 -3.229 1.00 0.00 C ATOM 838 O ALA A 56 1.135 11.640 -2.506 1.00 0.00 O ATOM 839 CB ALA A 56 2.049 14.493 -3.663 1.00 0.00 C ATOM 0 H ALA A 56 0.506 14.582 -5.580 1.00 0.00 H new ATOM 0 HA ALA A 56 2.246 12.580 -4.598 1.00 0.00 H new ATOM 0 HB1 ALA A 56 2.650 14.223 -2.795 1.00 0.00 H new ATOM 0 HB2 ALA A 56 2.681 14.985 -4.402 1.00 0.00 H new ATOM 0 HB3 ALA A 56 1.253 15.171 -3.356 1.00 0.00 H new ATOM 845 N ALA A 57 -0.671 12.812 -3.158 1.00 0.00 N ATOM 846 CA ALA A 57 -1.568 12.170 -2.206 1.00 0.00 C ATOM 847 C ALA A 57 -1.946 10.766 -2.669 1.00 0.00 C ATOM 848 O ALA A 57 -1.827 9.801 -1.914 1.00 0.00 O ATOM 849 CB ALA A 57 -2.818 13.015 -2.005 1.00 0.00 C ATOM 0 H ALA A 57 -1.116 13.514 -3.749 1.00 0.00 H new ATOM 0 HA ALA A 57 -1.045 12.083 -1.254 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -3.479 12.523 -1.291 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -2.536 13.996 -1.622 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -3.335 13.132 -2.957 1.00 0.00 H new ATOM 855 N ASP A 58 -2.402 10.661 -3.912 1.00 0.00 N ATOM 856 CA ASP A 58 -2.797 9.375 -4.475 1.00 0.00 C ATOM 857 C ASP A 58 -1.792 8.289 -4.106 1.00 0.00 C ATOM 858 O ASP A 58 -2.158 7.130 -3.909 1.00 0.00 O ATOM 859 CB ASP A 58 -2.921 9.477 -5.996 1.00 0.00 C ATOM 860 CG ASP A 58 -3.711 8.328 -6.591 1.00 0.00 C ATOM 861 OD1 ASP A 58 -4.734 7.937 -5.990 1.00 0.00 O ATOM 862 OD2 ASP A 58 -3.307 7.820 -7.658 1.00 0.00 O ATOM 0 H ASP A 58 -2.507 11.451 -4.549 1.00 0.00 H new ATOM 0 HA ASP A 58 -3.767 9.105 -4.056 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -3.404 10.419 -6.256 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -1.925 9.497 -6.438 1.00 0.00 H new ATOM 867 N LYS A 59 -0.522 8.670 -4.014 1.00 0.00 N ATOM 868 CA LYS A 59 0.537 7.730 -3.668 1.00 0.00 C ATOM 869 C LYS A 59 0.587 7.497 -2.162 1.00 0.00 C ATOM 870 O LYS A 59 0.319 6.394 -1.685 1.00 0.00 O ATOM 871 CB LYS A 59 1.889 8.250 -4.160 1.00 0.00 C ATOM 872 CG LYS A 59 2.239 7.799 -5.568 1.00 0.00 C ATOM 873 CD LYS A 59 2.758 6.371 -5.583 1.00 0.00 C ATOM 874 CE LYS A 59 3.293 5.987 -6.954 1.00 0.00 C ATOM 875 NZ LYS A 59 4.289 4.884 -6.872 1.00 0.00 N ATOM 0 H LYS A 59 -0.201 9.625 -4.175 1.00 0.00 H new ATOM 0 HA LYS A 59 0.320 6.780 -4.157 1.00 0.00 H new ATOM 0 HB2 LYS A 59 1.883 9.339 -4.127 1.00 0.00 H new ATOM 0 HB3 LYS A 59 2.669 7.915 -3.476 1.00 0.00 H new ATOM 0 HG2 LYS A 59 1.357 7.873 -6.205 1.00 0.00 H new ATOM 0 HG3 LYS A 59 2.992 8.465 -5.988 1.00 0.00 H new ATOM 0 HD2 LYS A 59 3.548 6.262 -4.839 1.00 0.00 H new ATOM 0 HD3 LYS A 59 1.957 5.688 -5.300 1.00 0.00 H new ATOM 0 HE2 LYS A 59 2.465 5.682 -7.594 1.00 0.00 H new ATOM 0 HE3 LYS A 59 3.753 6.858 -7.421 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 4.629 4.652 -7.827 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 5.091 5.184 -6.282 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 3.843 4.045 -6.450 1.00 0.00 H new ATOM 889 N PHE A 60 0.930 8.543 -1.417 1.00 0.00 N ATOM 890 CA PHE A 60 1.015 8.452 0.036 1.00 0.00 C ATOM 891 C PHE A 60 -0.146 7.636 0.598 1.00 0.00 C ATOM 892 O PHE A 60 0.058 6.623 1.268 1.00 0.00 O ATOM 893 CB PHE A 60 1.018 9.850 0.656 1.00 0.00 C ATOM 894 CG PHE A 60 1.420 9.863 2.104 1.00 0.00 C ATOM 895 CD1 PHE A 60 2.663 9.392 2.495 1.00 0.00 C ATOM 896 CD2 PHE A 60 0.556 10.347 3.072 1.00 0.00 C ATOM 897 CE1 PHE A 60 3.035 9.402 3.826 1.00 0.00 C ATOM 898 CE2 PHE A 60 0.922 10.359 4.405 1.00 0.00 C ATOM 899 CZ PHE A 60 2.164 9.887 4.782 1.00 0.00 C ATOM 0 H PHE A 60 1.154 9.463 -1.796 1.00 0.00 H new ATOM 0 HA PHE A 60 1.947 7.948 0.290 1.00 0.00 H new ATOM 0 HB2 PHE A 60 1.699 10.487 0.092 1.00 0.00 H new ATOM 0 HB3 PHE A 60 0.023 10.284 0.560 1.00 0.00 H new ATOM 0 HD1 PHE A 60 3.349 9.013 1.752 1.00 0.00 H new ATOM 0 HD2 PHE A 60 -0.415 10.720 2.782 1.00 0.00 H new ATOM 0 HE1 PHE A 60 4.006 9.031 4.118 1.00 0.00 H new ATOM 0 HE2 PHE A 60 0.238 10.737 5.150 1.00 0.00 H new ATOM 0 HZ PHE A 60 2.454 9.897 5.822 1.00 0.00 H new ATOM 909 N LYS A 61 -1.365 8.086 0.322 1.00 0.00 N ATOM 910 CA LYS A 61 -2.561 7.400 0.798 1.00 0.00 C ATOM 911 C LYS A 61 -2.465 5.899 0.542 1.00 0.00 C ATOM 912 O LYS A 61 -3.002 5.096 1.303 1.00 0.00 O ATOM 913 CB LYS A 61 -3.806 7.967 0.114 1.00 0.00 C ATOM 914 CG LYS A 61 -3.934 7.566 -1.346 1.00 0.00 C ATOM 915 CD LYS A 61 -5.276 7.983 -1.923 1.00 0.00 C ATOM 916 CE LYS A 61 -6.314 6.882 -1.770 1.00 0.00 C ATOM 917 NZ LYS A 61 -7.696 7.430 -1.684 1.00 0.00 N ATOM 0 H LYS A 61 -1.551 8.924 -0.229 1.00 0.00 H new ATOM 0 HA LYS A 61 -2.640 7.563 1.873 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -4.692 7.631 0.653 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -3.785 9.055 0.183 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -3.131 8.025 -1.922 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -3.816 6.486 -1.439 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -5.625 8.886 -1.421 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -5.159 8.230 -2.978 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -6.246 6.199 -2.617 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -6.097 6.301 -0.874 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -8.374 6.648 -1.580 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -7.768 8.062 -0.861 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -7.913 7.963 -2.550 1.00 0.00 H new ATOM 931 N GLU A 62 -1.777 5.530 -0.534 1.00 0.00 N ATOM 932 CA GLU A 62 -1.612 4.125 -0.889 1.00 0.00 C ATOM 933 C GLU A 62 -0.468 3.496 -0.100 1.00 0.00 C ATOM 934 O GLU A 62 -0.542 2.333 0.300 1.00 0.00 O ATOM 935 CB GLU A 62 -1.349 3.983 -2.390 1.00 0.00 C ATOM 936 CG GLU A 62 -2.611 3.782 -3.212 1.00 0.00 C ATOM 937 CD GLU A 62 -2.350 3.043 -4.510 1.00 0.00 C ATOM 938 OE1 GLU A 62 -1.696 1.980 -4.465 1.00 0.00 O ATOM 939 OE2 GLU A 62 -2.799 3.527 -5.570 1.00 0.00 O ATOM 0 H GLU A 62 -1.326 6.183 -1.174 1.00 0.00 H new ATOM 0 HA GLU A 62 -2.535 3.602 -0.638 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -0.832 4.874 -2.746 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -0.680 3.139 -2.555 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -3.340 3.226 -2.622 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -3.054 4.753 -3.434 1.00 0.00 H new ATOM 946 N ILE A 63 0.588 4.271 0.121 1.00 0.00 N ATOM 947 CA ILE A 63 1.747 3.790 0.863 1.00 0.00 C ATOM 948 C ILE A 63 1.393 3.522 2.322 1.00 0.00 C ATOM 949 O ILE A 63 1.508 2.396 2.802 1.00 0.00 O ATOM 950 CB ILE A 63 2.910 4.797 0.805 1.00 0.00 C ATOM 951 CG1 ILE A 63 3.172 5.225 -0.641 1.00 0.00 C ATOM 952 CG2 ILE A 63 4.164 4.194 1.419 1.00 0.00 C ATOM 953 CD1 ILE A 63 4.111 6.404 -0.762 1.00 0.00 C ATOM 0 H ILE A 63 0.665 5.235 -0.203 1.00 0.00 H new ATOM 0 HA ILE A 63 2.060 2.859 0.391 1.00 0.00 H new ATOM 0 HB ILE A 63 2.635 5.680 1.382 1.00 0.00 H new ATOM 0 HG12 ILE A 63 3.589 4.381 -1.191 1.00 0.00 H new ATOM 0 HG13 ILE A 63 2.223 5.477 -1.114 1.00 0.00 H new ATOM 0 HG21 ILE A 63 4.977 4.918 1.370 1.00 0.00 H new ATOM 0 HG22 ILE A 63 3.971 3.935 2.460 1.00 0.00 H new ATOM 0 HG23 ILE A 63 4.444 3.297 0.867 1.00 0.00 H new ATOM 0 HD11 ILE A 63 4.250 6.652 -1.814 1.00 0.00 H new ATOM 0 HD12 ILE A 63 3.687 7.262 -0.240 1.00 0.00 H new ATOM 0 HD13 ILE A 63 5.074 6.149 -0.319 1.00 0.00 H new ATOM 965 N ASN A 64 0.960 4.567 3.021 1.00 0.00 N ATOM 966 CA ASN A 64 0.588 4.444 4.426 1.00 0.00 C ATOM 967 C ASN A 64 -0.191 3.156 4.672 1.00 0.00 C ATOM 968 O ASN A 64 0.185 2.343 5.515 1.00 0.00 O ATOM 969 CB ASN A 64 -0.248 5.650 4.860 1.00 0.00 C ATOM 970 CG ASN A 64 -1.734 5.425 4.659 1.00 0.00 C ATOM 971 OD1 ASN A 64 -2.411 4.863 5.520 1.00 0.00 O ATOM 972 ND2 ASN A 64 -2.250 5.865 3.517 1.00 0.00 N ATOM 0 H ASN A 64 0.858 5.507 2.638 1.00 0.00 H new ATOM 0 HA ASN A 64 1.503 4.412 5.017 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -0.054 5.864 5.911 1.00 0.00 H new ATOM 0 HB3 ASN A 64 0.064 6.528 4.294 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -3.244 5.742 3.326 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -1.652 6.325 2.831 1.00 0.00 H new ATOM 979 N ASN A 65 -1.278 2.977 3.929 1.00 0.00 N ATOM 980 CA ASN A 65 -2.111 1.787 4.066 1.00 0.00 C ATOM 981 C ASN A 65 -1.302 0.523 3.792 1.00 0.00 C ATOM 982 O ASN A 65 -1.291 -0.406 4.599 1.00 0.00 O ATOM 983 CB ASN A 65 -3.303 1.861 3.110 1.00 0.00 C ATOM 984 CG ASN A 65 -3.000 1.245 1.758 1.00 0.00 C ATOM 985 OD1 ASN A 65 -2.866 1.950 0.758 1.00 0.00 O ATOM 986 ND2 ASN A 65 -2.889 -0.078 1.723 1.00 0.00 N ATOM 0 H ASN A 65 -1.603 3.640 3.226 1.00 0.00 H new ATOM 0 HA ASN A 65 -2.479 1.747 5.091 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -4.155 1.349 3.556 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -3.592 2.903 2.975 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -2.685 -0.550 0.842 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -3.008 -0.623 2.577 1.00 0.00 H new ATOM 993 N ALA A 66 -0.627 0.496 2.648 1.00 0.00 N ATOM 994 CA ALA A 66 0.187 -0.653 2.268 1.00 0.00 C ATOM 995 C ALA A 66 1.175 -1.015 3.372 1.00 0.00 C ATOM 996 O ALA A 66 1.050 -2.059 4.013 1.00 0.00 O ATOM 997 CB ALA A 66 0.925 -0.370 0.968 1.00 0.00 C ATOM 0 H ALA A 66 -0.627 1.256 1.968 1.00 0.00 H new ATOM 0 HA ALA A 66 -0.477 -1.504 2.118 1.00 0.00 H new ATOM 0 HB1 ALA A 66 1.529 -1.236 0.696 1.00 0.00 H new ATOM 0 HB2 ALA A 66 0.203 -0.168 0.176 1.00 0.00 H new ATOM 0 HB3 ALA A 66 1.573 0.497 1.099 1.00 0.00 H new ATOM 1003 N HIS A 67 2.157 -0.146 3.588 1.00 0.00 N ATOM 1004 CA HIS A 67 3.167 -0.375 4.615 1.00 0.00 C ATOM 1005 C HIS A 67 2.524 -0.851 5.914 1.00 0.00 C ATOM 1006 O HIS A 67 3.051 -1.731 6.593 1.00 0.00 O ATOM 1007 CB HIS A 67 3.967 0.904 4.868 1.00 0.00 C ATOM 1008 CG HIS A 67 4.567 0.975 6.238 1.00 0.00 C ATOM 1009 ND1 HIS A 67 4.019 1.718 7.262 1.00 0.00 N ATOM 1010 CD2 HIS A 67 5.673 0.388 6.752 1.00 0.00 C ATOM 1011 CE1 HIS A 67 4.763 1.587 8.346 1.00 0.00 C ATOM 1012 NE2 HIS A 67 5.773 0.784 8.063 1.00 0.00 N ATOM 0 H HIS A 67 2.275 0.722 3.066 1.00 0.00 H new ATOM 0 HA HIS A 67 3.842 -1.153 4.258 1.00 0.00 H new ATOM 0 HB2 HIS A 67 4.764 0.977 4.127 1.00 0.00 H new ATOM 0 HB3 HIS A 67 3.315 1.765 4.721 1.00 0.00 H new ATOM 0 HD1 HIS A 67 3.171 2.281 7.193 1.00 0.00 H new ATOM 0 HD2 HIS A 67 6.351 -0.270 6.228 1.00 0.00 H new ATOM 0 HE1 HIS A 67 4.577 2.056 9.301 1.00 0.00 H new ATOM 1020 N ALA A 68 1.382 -0.262 6.253 1.00 0.00 N ATOM 1021 CA ALA A 68 0.666 -0.627 7.470 1.00 0.00 C ATOM 1022 C ALA A 68 0.197 -2.077 7.416 1.00 0.00 C ATOM 1023 O ALA A 68 0.524 -2.877 8.293 1.00 0.00 O ATOM 1024 CB ALA A 68 -0.518 0.305 7.685 1.00 0.00 C ATOM 0 H ALA A 68 0.933 0.470 5.702 1.00 0.00 H new ATOM 0 HA ALA A 68 1.352 -0.525 8.311 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -1.044 0.021 8.597 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -0.162 1.331 7.776 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -1.198 0.231 6.836 1.00 0.00 H new ATOM 1030 N ILE A 69 -0.572 -2.408 6.384 1.00 0.00 N ATOM 1031 CA ILE A 69 -1.085 -3.762 6.218 1.00 0.00 C ATOM 1032 C ILE A 69 0.050 -4.778 6.170 1.00 0.00 C ATOM 1033 O ILE A 69 0.022 -5.790 6.872 1.00 0.00 O ATOM 1034 CB ILE A 69 -1.928 -3.890 4.935 1.00 0.00 C ATOM 1035 CG1 ILE A 69 -3.176 -3.009 5.028 1.00 0.00 C ATOM 1036 CG2 ILE A 69 -2.316 -5.343 4.700 1.00 0.00 C ATOM 1037 CD1 ILE A 69 -3.856 -2.782 3.696 1.00 0.00 C ATOM 0 H ILE A 69 -0.853 -1.757 5.651 1.00 0.00 H new ATOM 0 HA ILE A 69 -1.717 -3.968 7.082 1.00 0.00 H new ATOM 0 HB ILE A 69 -1.329 -3.552 4.089 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -3.886 -3.470 5.715 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -2.899 -2.045 5.455 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -2.911 -5.418 3.790 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -1.415 -5.948 4.595 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -2.900 -5.705 5.546 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -4.732 -2.149 3.838 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -3.162 -2.293 3.012 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -4.164 -3.740 3.277 1.00 0.00 H new ATOM 1049 N LEU A 70 1.050 -4.501 5.340 1.00 0.00 N ATOM 1050 CA LEU A 70 2.198 -5.391 5.202 1.00 0.00 C ATOM 1051 C LEU A 70 2.966 -5.497 6.516 1.00 0.00 C ATOM 1052 O LEU A 70 3.375 -6.585 6.923 1.00 0.00 O ATOM 1053 CB LEU A 70 3.126 -4.889 4.094 1.00 0.00 C ATOM 1054 CG LEU A 70 2.580 -4.978 2.669 1.00 0.00 C ATOM 1055 CD1 LEU A 70 3.513 -4.276 1.695 1.00 0.00 C ATOM 1056 CD2 LEU A 70 2.379 -6.431 2.265 1.00 0.00 C ATOM 0 H LEU A 70 1.089 -3.668 4.753 1.00 0.00 H new ATOM 0 HA LEU A 70 1.829 -6.382 4.938 1.00 0.00 H new ATOM 0 HB2 LEU A 70 3.377 -3.849 4.301 1.00 0.00 H new ATOM 0 HB3 LEU A 70 4.056 -5.456 4.142 1.00 0.00 H new ATOM 0 HG LEU A 70 1.613 -4.476 2.639 1.00 0.00 H new ATOM 0 HD11 LEU A 70 3.108 -4.350 0.686 1.00 0.00 H new ATOM 0 HD12 LEU A 70 3.606 -3.226 1.973 1.00 0.00 H new ATOM 0 HD13 LEU A 70 4.495 -4.748 1.727 1.00 0.00 H new ATOM 0 HD21 LEU A 70 1.990 -6.475 1.248 1.00 0.00 H new ATOM 0 HD22 LEU A 70 3.333 -6.957 2.312 1.00 0.00 H new ATOM 0 HD23 LEU A 70 1.670 -6.903 2.945 1.00 0.00 H new ATOM 1068 N THR A 71 3.157 -4.360 7.177 1.00 0.00 N ATOM 1069 CA THR A 71 3.875 -4.324 8.445 1.00 0.00 C ATOM 1070 C THR A 71 2.954 -4.676 9.608 1.00 0.00 C ATOM 1071 O THR A 71 3.088 -4.133 10.705 1.00 0.00 O ATOM 1072 CB THR A 71 4.498 -2.938 8.700 1.00 0.00 C ATOM 1073 OG1 THR A 71 5.614 -3.059 9.589 1.00 0.00 O ATOM 1074 CG2 THR A 71 3.472 -1.984 9.292 1.00 0.00 C ATOM 0 H THR A 71 2.824 -3.451 6.855 1.00 0.00 H new ATOM 0 HA THR A 71 4.672 -5.065 8.378 1.00 0.00 H new ATOM 0 HB THR A 71 4.837 -2.535 7.746 1.00 0.00 H new ATOM 0 HG1 THR A 71 5.324 -3.485 10.423 1.00 0.00 H new ATOM 0 HG21 THR A 71 3.935 -1.012 9.463 1.00 0.00 H new ATOM 0 HG22 THR A 71 2.638 -1.871 8.600 1.00 0.00 H new ATOM 0 HG23 THR A 71 3.107 -2.384 10.238 1.00 0.00 H new ATOM 1082 N ASP A 72 2.020 -5.588 9.361 1.00 0.00 N ATOM 1083 CA ASP A 72 1.077 -6.014 10.389 1.00 0.00 C ATOM 1084 C ASP A 72 0.700 -7.480 10.206 1.00 0.00 C ATOM 1085 O ASP A 72 0.204 -7.877 9.152 1.00 0.00 O ATOM 1086 CB ASP A 72 -0.179 -5.142 10.352 1.00 0.00 C ATOM 1087 CG ASP A 72 -0.860 -5.049 11.704 1.00 0.00 C ATOM 1088 OD1 ASP A 72 -0.326 -4.347 12.588 1.00 0.00 O ATOM 1089 OD2 ASP A 72 -1.925 -5.677 11.877 1.00 0.00 O ATOM 0 H ASP A 72 1.896 -6.046 8.458 1.00 0.00 H new ATOM 0 HA ASP A 72 1.559 -5.900 11.360 1.00 0.00 H new ATOM 0 HB2 ASP A 72 0.087 -4.141 10.013 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -0.879 -5.550 9.623 1.00 0.00 H new ATOM 1094 N ALA A 73 0.939 -8.281 11.240 1.00 0.00 N ATOM 1095 CA ALA A 73 0.623 -9.703 11.193 1.00 0.00 C ATOM 1096 C ALA A 73 -0.815 -9.932 10.740 1.00 0.00 C ATOM 1097 O ALA A 73 -1.059 -10.481 9.665 1.00 0.00 O ATOM 1098 CB ALA A 73 0.857 -10.341 12.555 1.00 0.00 C ATOM 0 H ALA A 73 1.350 -7.969 12.120 1.00 0.00 H new ATOM 0 HA ALA A 73 1.284 -10.173 10.465 1.00 0.00 H new ATOM 0 HB1 ALA A 73 0.617 -11.403 12.505 1.00 0.00 H new ATOM 0 HB2 ALA A 73 1.902 -10.218 12.840 1.00 0.00 H new ATOM 0 HB3 ALA A 73 0.220 -9.859 13.297 1.00 0.00 H new ATOM 1104 N THR A 74 -1.766 -9.508 11.567 1.00 0.00 N ATOM 1105 CA THR A 74 -3.179 -9.668 11.252 1.00 0.00 C ATOM 1106 C THR A 74 -3.462 -9.314 9.797 1.00 0.00 C ATOM 1107 O THR A 74 -3.868 -10.166 9.006 1.00 0.00 O ATOM 1108 CB THR A 74 -4.061 -8.792 12.162 1.00 0.00 C ATOM 1109 OG1 THR A 74 -3.658 -8.945 13.528 1.00 0.00 O ATOM 1110 CG2 THR A 74 -5.528 -9.164 12.016 1.00 0.00 C ATOM 0 H THR A 74 -1.582 -9.051 12.460 1.00 0.00 H new ATOM 0 HA THR A 74 -3.423 -10.717 11.422 1.00 0.00 H new ATOM 0 HB THR A 74 -3.936 -7.752 11.860 1.00 0.00 H new ATOM 0 HG1 THR A 74 -4.222 -8.384 14.100 1.00 0.00 H new ATOM 0 HG21 THR A 74 -6.130 -8.532 12.668 1.00 0.00 H new ATOM 0 HG22 THR A 74 -5.839 -9.019 10.981 1.00 0.00 H new ATOM 0 HG23 THR A 74 -5.668 -10.209 12.293 1.00 0.00 H new ATOM 1118 N LYS A 75 -3.245 -8.050 9.447 1.00 0.00 N ATOM 1119 CA LYS A 75 -3.475 -7.582 8.086 1.00 0.00 C ATOM 1120 C LYS A 75 -2.840 -8.528 7.071 1.00 0.00 C ATOM 1121 O LYS A 75 -3.520 -9.057 6.191 1.00 0.00 O ATOM 1122 CB LYS A 75 -2.909 -6.171 7.907 1.00 0.00 C ATOM 1123 CG LYS A 75 -3.434 -5.173 8.924 1.00 0.00 C ATOM 1124 CD LYS A 75 -4.678 -4.462 8.418 1.00 0.00 C ATOM 1125 CE LYS A 75 -5.945 -5.198 8.826 1.00 0.00 C ATOM 1126 NZ LYS A 75 -6.092 -5.271 10.306 1.00 0.00 N ATOM 0 H LYS A 75 -2.910 -7.331 10.088 1.00 0.00 H new ATOM 0 HA LYS A 75 -4.551 -7.560 7.913 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -1.822 -6.213 7.978 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -3.149 -5.816 6.905 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -3.663 -5.689 9.857 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -2.660 -4.439 9.148 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -4.703 -3.446 8.812 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -4.636 -4.382 7.332 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -6.812 -4.693 8.399 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -5.928 -6.206 8.413 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -7.006 -4.861 10.585 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -6.051 -6.265 10.610 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -5.322 -4.738 10.758 1.00 0.00 H new ATOM 1140 N ARG A 76 -1.534 -8.737 7.200 1.00 0.00 N ATOM 1141 CA ARG A 76 -0.808 -9.619 6.295 1.00 0.00 C ATOM 1142 C ARG A 76 -1.563 -10.929 6.090 1.00 0.00 C ATOM 1143 O ARG A 76 -1.558 -11.496 4.999 1.00 0.00 O ATOM 1144 CB ARG A 76 0.593 -9.905 6.841 1.00 0.00 C ATOM 1145 CG ARG A 76 1.604 -8.816 6.523 1.00 0.00 C ATOM 1146 CD ARG A 76 2.193 -8.991 5.132 1.00 0.00 C ATOM 1147 NE ARG A 76 1.157 -9.130 4.112 1.00 0.00 N ATOM 1148 CZ ARG A 76 0.695 -10.301 3.689 1.00 0.00 C ATOM 1149 NH1 ARG A 76 1.174 -11.429 4.195 1.00 0.00 N ATOM 1150 NH2 ARG A 76 -0.250 -10.346 2.758 1.00 0.00 N ATOM 0 H ARG A 76 -0.957 -8.307 7.923 1.00 0.00 H new ATOM 0 HA ARG A 76 -0.719 -9.116 5.332 1.00 0.00 H new ATOM 0 HB2 ARG A 76 0.534 -10.030 7.922 1.00 0.00 H new ATOM 0 HB3 ARG A 76 0.948 -10.850 6.430 1.00 0.00 H new ATOM 0 HG2 ARG A 76 1.124 -7.840 6.596 1.00 0.00 H new ATOM 0 HG3 ARG A 76 2.404 -8.834 7.263 1.00 0.00 H new ATOM 0 HD2 ARG A 76 2.823 -8.134 4.895 1.00 0.00 H new ATOM 0 HD3 ARG A 76 2.835 -9.872 5.119 1.00 0.00 H new ATOM 0 HE ARG A 76 0.767 -8.281 3.702 1.00 0.00 H new ATOM 0 HH11 ARG A 76 1.899 -11.399 4.911 1.00 0.00 H new ATOM 0 HH12 ARG A 76 0.817 -12.327 3.868 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -0.622 -9.481 2.367 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -0.604 -11.246 2.434 1.00 0.00 H new ATOM 1164 N ASN A 77 -2.211 -11.404 7.149 1.00 0.00 N ATOM 1165 CA ASN A 77 -2.970 -12.648 7.086 1.00 0.00 C ATOM 1166 C ASN A 77 -4.313 -12.431 6.396 1.00 0.00 C ATOM 1167 O ASN A 77 -4.691 -13.186 5.500 1.00 0.00 O ATOM 1168 CB ASN A 77 -3.190 -13.207 8.493 1.00 0.00 C ATOM 1169 CG ASN A 77 -2.133 -14.221 8.885 1.00 0.00 C ATOM 1170 OD1 ASN A 77 -1.641 -14.976 8.047 1.00 0.00 O ATOM 1171 ND2 ASN A 77 -1.779 -14.242 10.165 1.00 0.00 N ATOM 0 H ASN A 77 -2.226 -10.947 8.061 1.00 0.00 H new ATOM 0 HA ASN A 77 -2.395 -13.367 6.503 1.00 0.00 H new ATOM 0 HB2 ASN A 77 -3.187 -12.387 9.211 1.00 0.00 H new ATOM 0 HB3 ASN A 77 -4.174 -13.673 8.546 1.00 0.00 H new ATOM 0 HD21 ASN A 77 -1.072 -14.903 10.488 1.00 0.00 H new ATOM 0 HD22 ASN A 77 -2.214 -13.597 10.825 1.00 0.00 H new ATOM 1178 N ILE A 78 -5.029 -11.395 6.820 1.00 0.00 N ATOM 1179 CA ILE A 78 -6.329 -11.078 6.242 1.00 0.00 C ATOM 1180 C ILE A 78 -6.228 -10.889 4.733 1.00 0.00 C ATOM 1181 O ILE A 78 -7.134 -11.263 3.987 1.00 0.00 O ATOM 1182 CB ILE A 78 -6.929 -9.806 6.869 1.00 0.00 C ATOM 1183 CG1 ILE A 78 -7.047 -9.966 8.387 1.00 0.00 C ATOM 1184 CG2 ILE A 78 -8.288 -9.503 6.256 1.00 0.00 C ATOM 1185 CD1 ILE A 78 -7.563 -8.728 9.086 1.00 0.00 C ATOM 0 H ILE A 78 -4.731 -10.761 7.561 1.00 0.00 H new ATOM 0 HA ILE A 78 -6.984 -11.922 6.457 1.00 0.00 H new ATOM 0 HB ILE A 78 -6.264 -8.968 6.661 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -7.713 -10.801 8.606 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -6.069 -10.223 8.794 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -8.699 -8.601 6.710 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -8.177 -9.351 5.182 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -8.963 -10.340 6.436 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -7.621 -8.913 10.159 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -6.886 -7.895 8.898 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -8.555 -8.482 8.706 1.00 0.00 H new ATOM 1197 N TYR A 79 -5.120 -10.306 4.288 1.00 0.00 N ATOM 1198 CA TYR A 79 -4.900 -10.066 2.867 1.00 0.00 C ATOM 1199 C TYR A 79 -4.459 -11.345 2.160 1.00 0.00 C ATOM 1200 O TYR A 79 -5.053 -11.751 1.161 1.00 0.00 O ATOM 1201 CB TYR A 79 -3.849 -8.973 2.670 1.00 0.00 C ATOM 1202 CG TYR A 79 -3.823 -8.403 1.270 1.00 0.00 C ATOM 1203 CD1 TYR A 79 -4.928 -7.742 0.748 1.00 0.00 C ATOM 1204 CD2 TYR A 79 -2.695 -8.526 0.468 1.00 0.00 C ATOM 1205 CE1 TYR A 79 -4.910 -7.220 -0.532 1.00 0.00 C ATOM 1206 CE2 TYR A 79 -2.667 -8.006 -0.811 1.00 0.00 C ATOM 1207 CZ TYR A 79 -3.777 -7.354 -1.307 1.00 0.00 C ATOM 1208 OH TYR A 79 -3.754 -6.836 -2.581 1.00 0.00 O ATOM 0 H TYR A 79 -4.360 -9.991 4.891 1.00 0.00 H new ATOM 0 HA TYR A 79 -5.843 -9.737 2.430 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -4.039 -8.166 3.378 1.00 0.00 H new ATOM 0 HB3 TYR A 79 -2.866 -9.380 2.906 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -5.816 -7.634 1.353 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -1.825 -9.037 0.852 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -5.778 -6.710 -0.923 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -1.781 -8.109 -1.420 1.00 0.00 H new ATOM 0 HH TYR A 79 -2.882 -7.015 -2.991 1.00 0.00 H new ATOM 1218 N ASP A 80 -3.415 -11.974 2.687 1.00 0.00 N ATOM 1219 CA ASP A 80 -2.894 -13.207 2.109 1.00 0.00 C ATOM 1220 C ASP A 80 -3.986 -14.269 2.021 1.00 0.00 C ATOM 1221 O ASP A 80 -4.041 -15.040 1.063 1.00 0.00 O ATOM 1222 CB ASP A 80 -1.722 -13.730 2.941 1.00 0.00 C ATOM 1223 CG ASP A 80 -0.904 -14.770 2.200 1.00 0.00 C ATOM 1224 OD1 ASP A 80 -0.443 -14.472 1.079 1.00 0.00 O ATOM 1225 OD2 ASP A 80 -0.726 -15.881 2.741 1.00 0.00 O ATOM 0 H ASP A 80 -2.913 -11.650 3.514 1.00 0.00 H new ATOM 0 HA ASP A 80 -2.544 -12.987 1.101 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -1.078 -12.896 3.220 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -2.102 -14.163 3.867 1.00 0.00 H new ATOM 1230 N LYS A 81 -4.852 -14.304 3.027 1.00 0.00 N ATOM 1231 CA LYS A 81 -5.943 -15.271 3.065 1.00 0.00 C ATOM 1232 C LYS A 81 -7.117 -14.801 2.211 1.00 0.00 C ATOM 1233 O LYS A 81 -7.523 -15.481 1.269 1.00 0.00 O ATOM 1234 CB LYS A 81 -6.404 -15.495 4.507 1.00 0.00 C ATOM 1235 CG LYS A 81 -6.956 -16.887 4.760 1.00 0.00 C ATOM 1236 CD LYS A 81 -7.613 -16.986 6.126 1.00 0.00 C ATOM 1237 CE LYS A 81 -8.244 -18.353 6.343 1.00 0.00 C ATOM 1238 NZ LYS A 81 -9.545 -18.483 5.630 1.00 0.00 N ATOM 0 H LYS A 81 -4.820 -13.673 3.828 1.00 0.00 H new ATOM 0 HA LYS A 81 -5.575 -16.213 2.658 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -5.565 -15.318 5.179 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -7.170 -14.759 4.753 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -7.682 -17.137 3.987 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -6.150 -17.617 4.689 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -6.871 -16.799 6.902 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -8.375 -16.213 6.221 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -7.561 -19.128 5.996 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -8.396 -18.517 7.410 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -9.736 -19.487 5.437 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -10.306 -18.093 6.222 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -9.503 -17.960 4.732 1.00 0.00 H new ATOM 1252 N TYR A 82 -7.656 -13.634 2.547 1.00 0.00 N ATOM 1253 CA TYR A 82 -8.783 -13.074 1.812 1.00 0.00 C ATOM 1254 C TYR A 82 -8.306 -12.078 0.759 1.00 0.00 C ATOM 1255 O TYR A 82 -8.418 -12.325 -0.441 1.00 0.00 O ATOM 1256 CB TYR A 82 -9.756 -12.389 2.773 1.00 0.00 C ATOM 1257 CG TYR A 82 -10.001 -13.170 4.045 1.00 0.00 C ATOM 1258 CD1 TYR A 82 -10.186 -14.547 4.013 1.00 0.00 C ATOM 1259 CD2 TYR A 82 -10.048 -12.531 5.278 1.00 0.00 C ATOM 1260 CE1 TYR A 82 -10.411 -15.264 5.172 1.00 0.00 C ATOM 1261 CE2 TYR A 82 -10.271 -13.240 6.442 1.00 0.00 C ATOM 1262 CZ TYR A 82 -10.452 -14.606 6.384 1.00 0.00 C ATOM 1263 OH TYR A 82 -10.675 -15.316 7.541 1.00 0.00 O ATOM 0 H TYR A 82 -7.330 -13.058 3.323 1.00 0.00 H new ATOM 0 HA TYR A 82 -9.297 -13.892 1.307 1.00 0.00 H new ATOM 0 HB2 TYR A 82 -9.366 -11.404 3.031 1.00 0.00 H new ATOM 0 HB3 TYR A 82 -10.707 -12.232 2.264 1.00 0.00 H new ATOM 0 HD1 TYR A 82 -10.153 -15.065 3.066 1.00 0.00 H new ATOM 0 HD2 TYR A 82 -9.908 -11.461 5.327 1.00 0.00 H new ATOM 0 HE1 TYR A 82 -10.554 -16.334 5.130 1.00 0.00 H new ATOM 0 HE2 TYR A 82 -10.303 -12.728 7.392 1.00 0.00 H new ATOM 0 HH TYR A 82 -10.673 -14.704 8.306 1.00 0.00 H new ATOM 1273 N GLY A 83 -7.773 -10.950 1.219 1.00 0.00 N ATOM 1274 CA GLY A 83 -7.286 -9.934 0.305 1.00 0.00 C ATOM 1275 C GLY A 83 -7.966 -8.595 0.511 1.00 0.00 C ATOM 1276 O GLY A 83 -8.087 -8.120 1.640 1.00 0.00 O ATOM 0 H GLY A 83 -7.670 -10.722 2.208 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -6.211 -9.816 0.437 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -7.446 -10.266 -0.721 1.00 0.00 H new ATOM 1280 N SER A 84 -8.409 -7.983 -0.583 1.00 0.00 N ATOM 1281 CA SER A 84 -9.075 -6.688 -0.517 1.00 0.00 C ATOM 1282 C SER A 84 -10.460 -6.821 0.109 1.00 0.00 C ATOM 1283 O SER A 84 -10.961 -5.889 0.739 1.00 0.00 O ATOM 1284 CB SER A 84 -9.191 -6.079 -1.916 1.00 0.00 C ATOM 1285 OG SER A 84 -9.476 -4.693 -1.847 1.00 0.00 O ATOM 0 H SER A 84 -8.319 -8.363 -1.525 1.00 0.00 H new ATOM 0 HA SER A 84 -8.474 -6.029 0.110 1.00 0.00 H new ATOM 0 HB2 SER A 84 -8.261 -6.235 -2.462 1.00 0.00 H new ATOM 0 HB3 SER A 84 -9.977 -6.588 -2.473 1.00 0.00 H new ATOM 0 HG SER A 84 -9.544 -4.327 -2.754 1.00 0.00 H new ATOM 1291 N LEU A 85 -11.074 -7.985 -0.070 1.00 0.00 N ATOM 1292 CA LEU A 85 -12.402 -8.242 0.476 1.00 0.00 C ATOM 1293 C LEU A 85 -12.362 -8.297 2.000 1.00 0.00 C ATOM 1294 O LEU A 85 -13.052 -7.536 2.677 1.00 0.00 O ATOM 1295 CB LEU A 85 -12.958 -9.554 -0.079 1.00 0.00 C ATOM 1296 CG LEU A 85 -14.476 -9.723 -0.008 1.00 0.00 C ATOM 1297 CD1 LEU A 85 -15.035 -9.017 1.217 1.00 0.00 C ATOM 1298 CD2 LEU A 85 -15.131 -9.193 -1.276 1.00 0.00 C ATOM 0 H LEU A 85 -10.673 -8.766 -0.589 1.00 0.00 H new ATOM 0 HA LEU A 85 -13.056 -7.423 0.177 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -12.651 -9.644 -1.121 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -12.495 -10.379 0.462 1.00 0.00 H new ATOM 0 HG LEU A 85 -14.700 -10.786 0.077 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -16.117 -9.148 1.251 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -14.590 -9.442 2.117 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -14.800 -7.954 1.163 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -16.211 -9.321 -1.208 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -14.898 -8.134 -1.391 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -14.754 -9.743 -2.138 1.00 0.00 H new ATOM 1310 N GLY A 86 -11.547 -9.203 2.534 1.00 0.00 N ATOM 1311 CA GLY A 86 -11.431 -9.339 3.974 1.00 0.00 C ATOM 1312 C GLY A 86 -11.340 -8.000 4.677 1.00 0.00 C ATOM 1313 O GLY A 86 -12.062 -7.747 5.643 1.00 0.00 O ATOM 0 H GLY A 86 -10.966 -9.845 1.995 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -12.292 -9.888 4.355 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -10.546 -9.931 4.210 1.00 0.00 H new ATOM 1317 N LEU A 87 -10.450 -7.139 4.195 1.00 0.00 N ATOM 1318 CA LEU A 87 -10.266 -5.818 4.785 1.00 0.00 C ATOM 1319 C LEU A 87 -11.546 -4.994 4.688 1.00 0.00 C ATOM 1320 O LEU A 87 -11.931 -4.313 5.638 1.00 0.00 O ATOM 1321 CB LEU A 87 -9.118 -5.083 4.090 1.00 0.00 C ATOM 1322 CG LEU A 87 -7.772 -5.807 4.069 1.00 0.00 C ATOM 1323 CD1 LEU A 87 -6.752 -5.015 3.266 1.00 0.00 C ATOM 1324 CD2 LEU A 87 -7.271 -6.043 5.486 1.00 0.00 C ATOM 0 H LEU A 87 -9.845 -7.332 3.397 1.00 0.00 H new ATOM 0 HA LEU A 87 -10.020 -5.949 5.839 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -9.414 -4.879 3.061 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -8.981 -4.119 4.580 1.00 0.00 H new ATOM 0 HG LEU A 87 -7.910 -6.775 3.588 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -5.800 -5.546 3.262 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -7.106 -4.898 2.242 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -6.617 -4.032 3.717 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -6.312 -6.559 5.451 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -7.150 -5.086 5.993 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -7.992 -6.653 6.030 1.00 0.00 H new ATOM 1336 N TYR A 88 -12.201 -5.064 3.535 1.00 0.00 N ATOM 1337 CA TYR A 88 -13.438 -4.325 3.313 1.00 0.00 C ATOM 1338 C TYR A 88 -14.469 -4.652 4.389 1.00 0.00 C ATOM 1339 O TYR A 88 -15.130 -3.762 4.924 1.00 0.00 O ATOM 1340 CB TYR A 88 -14.008 -4.646 1.931 1.00 0.00 C ATOM 1341 CG TYR A 88 -15.474 -4.305 1.786 1.00 0.00 C ATOM 1342 CD1 TYR A 88 -15.929 -3.007 1.981 1.00 0.00 C ATOM 1343 CD2 TYR A 88 -16.405 -5.282 1.453 1.00 0.00 C ATOM 1344 CE1 TYR A 88 -17.268 -2.692 1.851 1.00 0.00 C ATOM 1345 CE2 TYR A 88 -17.745 -4.976 1.319 1.00 0.00 C ATOM 1346 CZ TYR A 88 -18.172 -3.679 1.519 1.00 0.00 C ATOM 1347 OH TYR A 88 -19.506 -3.369 1.387 1.00 0.00 O ATOM 0 H TYR A 88 -11.896 -5.625 2.739 1.00 0.00 H new ATOM 0 HA TYR A 88 -13.209 -3.261 3.366 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -13.440 -4.100 1.177 1.00 0.00 H new ATOM 0 HB3 TYR A 88 -13.869 -5.708 1.728 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -15.224 -2.231 2.239 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -16.075 -6.298 1.296 1.00 0.00 H new ATOM 0 HE1 TYR A 88 -17.605 -1.678 2.009 1.00 0.00 H new ATOM 0 HE2 TYR A 88 -18.455 -5.747 1.059 1.00 0.00 H new ATOM 0 HH TYR A 88 -20.008 -4.177 1.149 1.00 0.00 H new ATOM 1357 N VAL A 89 -14.600 -5.937 4.703 1.00 0.00 N ATOM 1358 CA VAL A 89 -15.548 -6.384 5.716 1.00 0.00 C ATOM 1359 C VAL A 89 -15.052 -6.049 7.119 1.00 0.00 C ATOM 1360 O VAL A 89 -15.772 -5.447 7.915 1.00 0.00 O ATOM 1361 CB VAL A 89 -15.797 -7.901 5.621 1.00 0.00 C ATOM 1362 CG1 VAL A 89 -16.722 -8.361 6.737 1.00 0.00 C ATOM 1363 CG2 VAL A 89 -16.371 -8.262 4.259 1.00 0.00 C ATOM 0 H VAL A 89 -14.061 -6.687 4.270 1.00 0.00 H new ATOM 0 HA VAL A 89 -16.483 -5.857 5.528 1.00 0.00 H new ATOM 0 HB VAL A 89 -14.843 -8.416 5.736 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -16.886 -9.435 6.654 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -16.267 -8.137 7.702 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -17.676 -7.841 6.656 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -16.541 -9.338 4.209 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -17.316 -7.738 4.112 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -15.668 -7.969 3.479 1.00 0.00 H new ATOM 1373 N ALA A 90 -13.818 -6.443 7.414 1.00 0.00 N ATOM 1374 CA ALA A 90 -13.224 -6.182 8.719 1.00 0.00 C ATOM 1375 C ALA A 90 -13.304 -4.700 9.072 1.00 0.00 C ATOM 1376 O ALA A 90 -13.520 -4.340 10.229 1.00 0.00 O ATOM 1377 CB ALA A 90 -11.779 -6.656 8.747 1.00 0.00 C ATOM 0 H ALA A 90 -13.210 -6.944 6.767 1.00 0.00 H new ATOM 0 HA ALA A 90 -13.791 -6.738 9.466 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -11.349 -6.454 9.728 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -11.744 -7.727 8.549 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -11.208 -6.127 7.985 1.00 0.00 H new ATOM 1383 N GLU A 91 -13.127 -3.847 8.069 1.00 0.00 N ATOM 1384 CA GLU A 91 -13.178 -2.405 8.275 1.00 0.00 C ATOM 1385 C GLU A 91 -14.571 -1.967 8.718 1.00 0.00 C ATOM 1386 O GLU A 91 -14.717 -1.026 9.498 1.00 0.00 O ATOM 1387 CB GLU A 91 -12.784 -1.669 6.992 1.00 0.00 C ATOM 1388 CG GLU A 91 -12.237 -0.273 7.235 1.00 0.00 C ATOM 1389 CD GLU A 91 -11.470 0.268 6.043 1.00 0.00 C ATOM 1390 OE1 GLU A 91 -10.278 -0.076 5.898 1.00 0.00 O ATOM 1391 OE2 GLU A 91 -12.062 1.036 5.256 1.00 0.00 O ATOM 0 H GLU A 91 -12.947 -4.129 7.106 1.00 0.00 H new ATOM 0 HA GLU A 91 -12.469 -2.152 9.063 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -12.035 -2.257 6.462 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -13.655 -1.600 6.340 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -13.061 0.401 7.468 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -11.583 -0.290 8.106 1.00 0.00 H new ATOM 1398 N GLN A 92 -15.589 -2.656 8.215 1.00 0.00 N ATOM 1399 CA GLN A 92 -16.970 -2.338 8.558 1.00 0.00 C ATOM 1400 C GLN A 92 -17.344 -2.928 9.914 1.00 0.00 C ATOM 1401 O GLN A 92 -17.876 -2.233 10.779 1.00 0.00 O ATOM 1402 CB GLN A 92 -17.920 -2.864 7.480 1.00 0.00 C ATOM 1403 CG GLN A 92 -17.715 -2.216 6.120 1.00 0.00 C ATOM 1404 CD GLN A 92 -17.794 -0.703 6.177 1.00 0.00 C ATOM 1405 OE1 GLN A 92 -18.881 -0.129 6.242 1.00 0.00 O ATOM 1406 NE2 GLN A 92 -16.639 -0.049 6.152 1.00 0.00 N ATOM 0 H GLN A 92 -15.484 -3.438 7.569 1.00 0.00 H new ATOM 0 HA GLN A 92 -17.063 -1.254 8.616 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -17.786 -3.941 7.384 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -18.948 -2.698 7.801 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -16.743 -2.511 5.724 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -18.468 -2.590 5.426 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -15.761 -0.566 6.098 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -16.629 0.970 6.187 1.00 0.00 H new ATOM 1415 N PHE A 93 -17.063 -4.214 10.091 1.00 0.00 N ATOM 1416 CA PHE A 93 -17.371 -4.899 11.342 1.00 0.00 C ATOM 1417 C PHE A 93 -16.103 -5.143 12.155 1.00 0.00 C ATOM 1418 O PHE A 93 -15.917 -4.565 13.225 1.00 0.00 O ATOM 1419 CB PHE A 93 -18.074 -6.228 11.061 1.00 0.00 C ATOM 1420 CG PHE A 93 -19.173 -6.121 10.042 1.00 0.00 C ATOM 1421 CD1 PHE A 93 -18.881 -6.106 8.688 1.00 0.00 C ATOM 1422 CD2 PHE A 93 -20.498 -6.035 10.439 1.00 0.00 C ATOM 1423 CE1 PHE A 93 -19.890 -6.008 7.748 1.00 0.00 C ATOM 1424 CE2 PHE A 93 -21.511 -5.938 9.504 1.00 0.00 C ATOM 1425 CZ PHE A 93 -21.206 -5.923 8.157 1.00 0.00 C ATOM 0 H PHE A 93 -16.623 -4.804 9.385 1.00 0.00 H new ATOM 0 HA PHE A 93 -18.036 -4.260 11.923 1.00 0.00 H new ATOM 0 HB2 PHE A 93 -17.338 -6.953 10.715 1.00 0.00 H new ATOM 0 HB3 PHE A 93 -18.489 -6.614 11.992 1.00 0.00 H new ATOM 0 HD1 PHE A 93 -17.853 -6.172 8.363 1.00 0.00 H new ATOM 0 HD2 PHE A 93 -20.742 -6.044 11.491 1.00 0.00 H new ATOM 0 HE1 PHE A 93 -19.649 -5.998 6.695 1.00 0.00 H new ATOM 0 HE2 PHE A 93 -22.540 -5.874 9.826 1.00 0.00 H new ATOM 0 HZ PHE A 93 -21.996 -5.845 7.425 1.00 0.00 H new ATOM 1435 N GLY A 94 -15.233 -6.006 11.638 1.00 0.00 N ATOM 1436 CA GLY A 94 -13.994 -6.313 12.329 1.00 0.00 C ATOM 1437 C GLY A 94 -13.423 -7.658 11.924 1.00 0.00 C ATOM 1438 O GLY A 94 -14.168 -8.601 11.660 1.00 0.00 O ATOM 0 H GLY A 94 -15.364 -6.497 10.754 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -13.262 -5.533 12.120 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -14.170 -6.305 13.405 1.00 0.00 H new ATOM 1442 N GLU A 95 -12.097 -7.745 11.874 1.00 0.00 N ATOM 1443 CA GLU A 95 -11.428 -8.984 11.496 1.00 0.00 C ATOM 1444 C GLU A 95 -12.023 -10.174 12.243 1.00 0.00 C ATOM 1445 O GLU A 95 -12.238 -11.238 11.664 1.00 0.00 O ATOM 1446 CB GLU A 95 -9.928 -8.887 11.781 1.00 0.00 C ATOM 1447 CG GLU A 95 -9.605 -8.513 13.218 1.00 0.00 C ATOM 1448 CD GLU A 95 -9.471 -9.725 14.120 1.00 0.00 C ATOM 1449 OE1 GLU A 95 -8.753 -10.672 13.737 1.00 0.00 O ATOM 1450 OE2 GLU A 95 -10.085 -9.726 15.208 1.00 0.00 O ATOM 0 H GLU A 95 -11.466 -6.973 12.090 1.00 0.00 H new ATOM 0 HA GLU A 95 -11.578 -9.136 10.427 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -9.460 -9.844 11.549 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -9.487 -8.147 11.114 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -8.676 -7.943 13.241 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -10.389 -7.862 13.605 1.00 0.00 H new ATOM 1457 N GLU A 96 -12.285 -9.985 13.532 1.00 0.00 N ATOM 1458 CA GLU A 96 -12.854 -11.043 14.359 1.00 0.00 C ATOM 1459 C GLU A 96 -14.179 -11.531 13.781 1.00 0.00 C ATOM 1460 O GLU A 96 -14.467 -12.727 13.785 1.00 0.00 O ATOM 1461 CB GLU A 96 -13.061 -10.547 15.791 1.00 0.00 C ATOM 1462 CG GLU A 96 -14.052 -9.400 15.901 1.00 0.00 C ATOM 1463 CD GLU A 96 -14.260 -8.944 17.332 1.00 0.00 C ATOM 1464 OE1 GLU A 96 -13.357 -8.280 17.881 1.00 0.00 O ATOM 1465 OE2 GLU A 96 -15.328 -9.251 17.902 1.00 0.00 O ATOM 0 H GLU A 96 -12.113 -9.110 14.026 1.00 0.00 H new ATOM 0 HA GLU A 96 -12.153 -11.877 14.370 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -13.408 -11.376 16.407 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -12.102 -10.227 16.198 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -13.697 -8.560 15.304 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -15.008 -9.709 15.480 1.00 0.00 H new ATOM 1472 N ASN A 97 -14.983 -10.595 13.286 1.00 0.00 N ATOM 1473 CA ASN A 97 -16.279 -10.929 12.706 1.00 0.00 C ATOM 1474 C ASN A 97 -16.112 -11.553 11.324 1.00 0.00 C ATOM 1475 O ASN A 97 -16.969 -12.307 10.864 1.00 0.00 O ATOM 1476 CB ASN A 97 -17.156 -9.679 12.612 1.00 0.00 C ATOM 1477 CG ASN A 97 -17.467 -9.087 13.973 1.00 0.00 C ATOM 1478 OD1 ASN A 97 -17.817 -9.805 14.909 1.00 0.00 O ATOM 1479 ND2 ASN A 97 -17.341 -7.770 14.088 1.00 0.00 N ATOM 0 H ASN A 97 -14.760 -9.600 13.275 1.00 0.00 H new ATOM 0 HA ASN A 97 -16.764 -11.657 13.357 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -16.653 -8.931 12.000 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -18.088 -9.930 12.106 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -17.537 -7.315 14.979 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -17.048 -7.214 13.285 1.00 0.00 H new ATOM 1486 N VAL A 98 -15.002 -11.232 10.666 1.00 0.00 N ATOM 1487 CA VAL A 98 -14.721 -11.761 9.337 1.00 0.00 C ATOM 1488 C VAL A 98 -14.560 -13.277 9.372 1.00 0.00 C ATOM 1489 O VAL A 98 -14.901 -13.970 8.414 1.00 0.00 O ATOM 1490 CB VAL A 98 -13.446 -11.135 8.741 1.00 0.00 C ATOM 1491 CG1 VAL A 98 -13.115 -11.772 7.400 1.00 0.00 C ATOM 1492 CG2 VAL A 98 -13.609 -9.629 8.600 1.00 0.00 C ATOM 0 H VAL A 98 -14.283 -10.608 11.032 1.00 0.00 H new ATOM 0 HA VAL A 98 -15.572 -11.502 8.707 1.00 0.00 H new ATOM 0 HB VAL A 98 -12.616 -11.326 9.421 1.00 0.00 H new ATOM 0 HG11 VAL A 98 -12.211 -11.317 6.994 1.00 0.00 H new ATOM 0 HG12 VAL A 98 -12.954 -12.841 7.535 1.00 0.00 H new ATOM 0 HG13 VAL A 98 -13.943 -11.615 6.708 1.00 0.00 H new ATOM 0 HG21 VAL A 98 -12.699 -9.203 8.178 1.00 0.00 H new ATOM 0 HG22 VAL A 98 -14.450 -9.414 7.941 1.00 0.00 H new ATOM 0 HG23 VAL A 98 -13.794 -9.190 9.580 1.00 0.00 H new ATOM 1502 N ASN A 99 -14.039 -13.786 10.484 1.00 0.00 N ATOM 1503 CA ASN A 99 -13.833 -15.221 10.644 1.00 0.00 C ATOM 1504 C ASN A 99 -15.158 -15.973 10.566 1.00 0.00 C ATOM 1505 O ASN A 99 -15.344 -16.840 9.711 1.00 0.00 O ATOM 1506 CB ASN A 99 -13.147 -15.513 11.980 1.00 0.00 C ATOM 1507 CG ASN A 99 -11.636 -15.419 11.887 1.00 0.00 C ATOM 1508 OD1 ASN A 99 -10.952 -16.422 11.685 1.00 0.00 O ATOM 1509 ND2 ASN A 99 -11.109 -14.209 12.035 1.00 0.00 N ATOM 0 H ASN A 99 -13.752 -13.226 11.287 1.00 0.00 H new ATOM 0 HA ASN A 99 -13.192 -15.563 9.831 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -13.506 -14.810 12.731 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -13.426 -16.511 12.318 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -10.098 -14.083 11.983 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -11.715 -13.406 12.201 1.00 0.00 H new ATOM 1516 N THR A 100 -16.079 -15.634 11.463 1.00 0.00 N ATOM 1517 CA THR A 100 -17.387 -16.277 11.496 1.00 0.00 C ATOM 1518 C THR A 100 -18.222 -15.886 10.282 1.00 0.00 C ATOM 1519 O THR A 100 -19.281 -16.463 10.034 1.00 0.00 O ATOM 1520 CB THR A 100 -18.160 -15.911 12.777 1.00 0.00 C ATOM 1521 OG1 THR A 100 -19.491 -16.435 12.712 1.00 0.00 O ATOM 1522 CG2 THR A 100 -18.211 -14.403 12.966 1.00 0.00 C ATOM 0 H THR A 100 -15.943 -14.918 12.176 1.00 0.00 H new ATOM 0 HA THR A 100 -17.212 -17.353 11.481 1.00 0.00 H new ATOM 0 HB THR A 100 -17.639 -16.350 13.628 1.00 0.00 H new ATOM 0 HG1 THR A 100 -19.692 -16.705 11.792 1.00 0.00 H new ATOM 0 HG21 THR A 100 -18.762 -14.169 13.877 1.00 0.00 H new ATOM 0 HG22 THR A 100 -17.197 -14.012 13.045 1.00 0.00 H new ATOM 0 HG23 THR A 100 -18.711 -13.946 12.112 1.00 0.00 H new ATOM 1530 N TYR A 101 -17.740 -14.904 9.529 1.00 0.00 N ATOM 1531 CA TYR A 101 -18.444 -14.435 8.342 1.00 0.00 C ATOM 1532 C TYR A 101 -18.187 -15.359 7.156 1.00 0.00 C ATOM 1533 O TYR A 101 -19.122 -15.857 6.528 1.00 0.00 O ATOM 1534 CB TYR A 101 -18.009 -13.010 7.995 1.00 0.00 C ATOM 1535 CG TYR A 101 -18.923 -12.321 7.007 1.00 0.00 C ATOM 1536 CD1 TYR A 101 -20.110 -11.731 7.423 1.00 0.00 C ATOM 1537 CD2 TYR A 101 -18.599 -12.260 5.657 1.00 0.00 C ATOM 1538 CE1 TYR A 101 -20.949 -11.102 6.523 1.00 0.00 C ATOM 1539 CE2 TYR A 101 -19.430 -11.631 4.751 1.00 0.00 C ATOM 1540 CZ TYR A 101 -20.604 -11.054 5.188 1.00 0.00 C ATOM 1541 OH TYR A 101 -21.436 -10.427 4.289 1.00 0.00 O ATOM 0 H TYR A 101 -16.864 -14.417 9.720 1.00 0.00 H new ATOM 0 HA TYR A 101 -19.512 -14.439 8.559 1.00 0.00 H new ATOM 0 HB2 TYR A 101 -17.966 -12.419 8.910 1.00 0.00 H new ATOM 0 HB3 TYR A 101 -16.999 -13.037 7.585 1.00 0.00 H new ATOM 0 HD1 TYR A 101 -20.382 -11.765 8.468 1.00 0.00 H new ATOM 0 HD2 TYR A 101 -17.682 -12.712 5.310 1.00 0.00 H new ATOM 0 HE1 TYR A 101 -21.869 -10.651 6.863 1.00 0.00 H new ATOM 0 HE2 TYR A 101 -19.162 -11.591 3.706 1.00 0.00 H new ATOM 0 HH TYR A 101 -21.047 -10.481 3.391 1.00 0.00 H new ATOM 1551 N PHE A 102 -16.913 -15.585 6.855 1.00 0.00 N ATOM 1552 CA PHE A 102 -16.531 -16.450 5.744 1.00 0.00 C ATOM 1553 C PHE A 102 -17.066 -17.865 5.947 1.00 0.00 C ATOM 1554 O PHE A 102 -17.107 -18.665 5.013 1.00 0.00 O ATOM 1555 CB PHE A 102 -15.009 -16.484 5.597 1.00 0.00 C ATOM 1556 CG PHE A 102 -14.458 -15.340 4.795 1.00 0.00 C ATOM 1557 CD1 PHE A 102 -15.005 -14.072 4.907 1.00 0.00 C ATOM 1558 CD2 PHE A 102 -13.394 -15.532 3.929 1.00 0.00 C ATOM 1559 CE1 PHE A 102 -14.500 -13.016 4.172 1.00 0.00 C ATOM 1560 CE2 PHE A 102 -12.885 -14.480 3.191 1.00 0.00 C ATOM 1561 CZ PHE A 102 -13.439 -13.221 3.311 1.00 0.00 C ATOM 0 H PHE A 102 -16.127 -15.181 7.365 1.00 0.00 H new ATOM 0 HA PHE A 102 -16.968 -16.043 4.832 1.00 0.00 H new ATOM 0 HB2 PHE A 102 -14.556 -16.474 6.588 1.00 0.00 H new ATOM 0 HB3 PHE A 102 -14.719 -17.422 5.124 1.00 0.00 H new ATOM 0 HD1 PHE A 102 -15.836 -13.907 5.577 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -12.957 -16.515 3.829 1.00 0.00 H new ATOM 0 HE1 PHE A 102 -14.934 -12.032 4.271 1.00 0.00 H new ATOM 0 HE2 PHE A 102 -12.054 -14.643 2.521 1.00 0.00 H new ATOM 0 HZ PHE A 102 -13.044 -12.398 2.733 1.00 0.00 H new ATOM 1571 N VAL A 103 -17.475 -18.165 7.176 1.00 0.00 N ATOM 1572 CA VAL A 103 -18.007 -19.483 7.503 1.00 0.00 C ATOM 1573 C VAL A 103 -19.515 -19.426 7.725 1.00 0.00 C ATOM 1574 O VAL A 103 -20.143 -18.386 7.528 1.00 0.00 O ATOM 1575 CB VAL A 103 -17.336 -20.063 8.762 1.00 0.00 C ATOM 1576 CG1 VAL A 103 -15.836 -20.205 8.550 1.00 0.00 C ATOM 1577 CG2 VAL A 103 -17.631 -19.191 9.973 1.00 0.00 C ATOM 0 H VAL A 103 -17.448 -17.514 7.961 1.00 0.00 H new ATOM 0 HA VAL A 103 -17.791 -20.132 6.654 1.00 0.00 H new ATOM 0 HB VAL A 103 -17.748 -21.055 8.948 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -15.379 -20.616 9.450 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -15.649 -20.874 7.710 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -15.404 -19.227 8.338 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -17.149 -19.616 10.853 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -17.248 -18.185 9.799 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -18.708 -19.146 10.135 1.00 0.00 H new ATOM 1587 N SER A 104 -20.089 -20.552 8.136 1.00 0.00 N ATOM 1588 CA SER A 104 -21.524 -20.632 8.382 1.00 0.00 C ATOM 1589 C SER A 104 -21.814 -20.741 9.876 1.00 0.00 C ATOM 1590 O SER A 104 -22.518 -19.908 10.446 1.00 0.00 O ATOM 1591 CB SER A 104 -22.123 -21.832 7.646 1.00 0.00 C ATOM 1592 OG SER A 104 -22.185 -21.595 6.250 1.00 0.00 O ATOM 0 H SER A 104 -19.583 -21.421 8.306 1.00 0.00 H new ATOM 0 HA SER A 104 -21.983 -19.718 8.006 1.00 0.00 H new ATOM 0 HB2 SER A 104 -21.521 -22.720 7.841 1.00 0.00 H new ATOM 0 HB3 SER A 104 -23.123 -22.035 8.028 1.00 0.00 H new ATOM 0 HG SER A 104 -22.570 -22.377 5.802 1.00 0.00 H new ATOM 1598 N GLY A 105 -21.266 -21.777 10.505 1.00 0.00 N ATOM 1599 CA GLY A 105 -21.477 -21.977 11.927 1.00 0.00 C ATOM 1600 C GLY A 105 -20.679 -21.006 12.774 1.00 0.00 C ATOM 1601 O GLY A 105 -19.516 -20.716 12.495 1.00 0.00 O ATOM 0 H GLY A 105 -20.680 -22.481 10.055 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -22.537 -21.865 12.153 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -21.201 -22.998 12.192 1.00 0.00 H new ATOM 1605 N PRO A 106 -21.311 -20.483 13.835 1.00 0.00 N ATOM 1606 CA PRO A 106 -20.672 -19.529 14.747 1.00 0.00 C ATOM 1607 C PRO A 106 -19.581 -20.177 15.592 1.00 0.00 C ATOM 1608 O PRO A 106 -19.354 -21.384 15.510 1.00 0.00 O ATOM 1609 CB PRO A 106 -21.827 -19.058 15.634 1.00 0.00 C ATOM 1610 CG PRO A 106 -22.812 -20.175 15.598 1.00 0.00 C ATOM 1611 CD PRO A 106 -22.698 -20.784 14.228 1.00 0.00 C ATOM 0 HA PRO A 106 -20.173 -18.722 14.209 1.00 0.00 H new ATOM 0 HB2 PRO A 106 -21.490 -18.860 16.651 1.00 0.00 H new ATOM 0 HB3 PRO A 106 -22.264 -18.133 15.258 1.00 0.00 H new ATOM 0 HG2 PRO A 106 -22.595 -20.912 16.372 1.00 0.00 H new ATOM 0 HG3 PRO A 106 -23.823 -19.810 15.780 1.00 0.00 H new ATOM 0 HD2 PRO A 106 -22.886 -21.857 14.249 1.00 0.00 H new ATOM 0 HD3 PRO A 106 -23.416 -20.348 13.533 1.00 0.00 H new ATOM 1619 N SER A 107 -18.909 -19.368 16.404 1.00 0.00 N ATOM 1620 CA SER A 107 -17.838 -19.863 17.262 1.00 0.00 C ATOM 1621 C SER A 107 -18.403 -20.692 18.411 1.00 0.00 C ATOM 1622 O SER A 107 -18.863 -20.150 19.416 1.00 0.00 O ATOM 1623 CB SER A 107 -17.019 -18.695 17.816 1.00 0.00 C ATOM 1624 OG SER A 107 -17.837 -17.802 18.552 1.00 0.00 O ATOM 0 H SER A 107 -19.087 -18.367 16.486 1.00 0.00 H new ATOM 0 HA SER A 107 -17.189 -20.500 16.661 1.00 0.00 H new ATOM 0 HB2 SER A 107 -16.223 -19.076 18.456 1.00 0.00 H new ATOM 0 HB3 SER A 107 -16.540 -18.161 16.995 1.00 0.00 H new ATOM 0 HG SER A 107 -18.470 -18.313 19.099 1.00 0.00 H new ATOM 1630 N SER A 108 -18.364 -22.012 18.255 1.00 0.00 N ATOM 1631 CA SER A 108 -18.875 -22.918 19.277 1.00 0.00 C ATOM 1632 C SER A 108 -18.318 -22.558 20.650 1.00 0.00 C ATOM 1633 O SER A 108 -17.113 -22.644 20.886 1.00 0.00 O ATOM 1634 CB SER A 108 -18.516 -24.364 18.931 1.00 0.00 C ATOM 1635 OG SER A 108 -18.998 -24.716 17.646 1.00 0.00 O ATOM 0 H SER A 108 -17.984 -22.477 17.431 1.00 0.00 H new ATOM 0 HA SER A 108 -19.960 -22.818 19.307 1.00 0.00 H new ATOM 0 HB2 SER A 108 -17.434 -24.491 18.964 1.00 0.00 H new ATOM 0 HB3 SER A 108 -18.939 -25.036 19.678 1.00 0.00 H new ATOM 0 HG SER A 108 -18.754 -25.644 17.448 1.00 0.00 H new ATOM 1641 N GLY A 109 -19.204 -22.152 21.555 1.00 0.00 N ATOM 1642 CA GLY A 109 -18.783 -21.785 22.894 1.00 0.00 C ATOM 1643 C GLY A 109 -19.848 -21.011 23.645 1.00 0.00 C ATOM 1644 O GLY A 109 -20.738 -21.601 24.257 1.00 0.00 O ATOM 0 H GLY A 109 -20.206 -22.071 21.384 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -18.532 -22.687 23.452 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -17.876 -21.184 22.834 1.00 0.00 H new TER 1648 GLY A 109