USER MOD reduce.3.24.130724 H: found=0, std=0, add=784, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 781 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 315 SER OG : rot 33:sc= 0.744 USER MOD Set 1.2: A 316 GLN : amide:sc= -0.228 K(o=0.52,f=-2.6!) USER MOD Single : A 317 THR OG1 : rot 180:sc= 0 USER MOD Single : A 323 GLN : amide:sc= -0.0483 K(o=-0.048,f=-0.95) USER MOD Single : A 325 ASN : amide:sc= -0.704 K(o=-0.7,f=-4.8!) USER MOD Single : A 327 GLN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 331 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 335 SER OG : rot 180:sc= 0 USER MOD Single : A 341 THR OG1 : rot 69:sc= 1.18 USER MOD Single : A 342 THR OG1 : rot 180:sc= 0 USER MOD Single : A 344 TYR OH : rot 180:sc= 0 USER MOD Single : A 347 ASN : amide:sc= 0.106 X(o=0.11,f=0) USER MOD Single : A 350 HIS : no HD1:sc= -0.0548 X(o=-0.055,f=-0.5) USER MOD Single : A 353 THR OG1 : rot 180:sc= 0 USER MOD Single : A 362 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 363 ASN :FLIP amide:sc= -1.06 F(o=-2.6!,f=-1.1) USER MOD Single : A 371 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 372 HIS : no HD1:sc= -5.2! C(o=-5.2!,f=-5.2!) USER MOD Single : A 373 TYR OH : rot 180:sc= 0 USER MOD Single : A 376 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 378 CYS SG : rot 101:sc= 0.584 USER MOD Single : A 379 CYS SG : rot 155:sc= -1.41 USER MOD Single : A 382 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 383 TYR OH : rot -158:sc= -0.156 USER MOD Single : A 385 THR OG1 : rot 180:sc= -1.01 USER MOD Single : A 386 HIS : no HD1:sc= -0.0988 K(o=-0.099,f=-1.6!) USER MOD Single : A 388 GLN : amide:sc= -2.07! C(o=-2.1!,f=-2.1!) USER MOD Single : A 392 CYS SG : rot -2:sc= -0.137 USER MOD Single : A 398 ASN : amide:sc= -0.0409 K(o=-0.041,f=-1.1) USER MOD Single : A 402 GLN : amide:sc= -0.378 X(o=-0.38,f=-0.52) USER MOD Single : A 405 ASN : amide:sc= -0.377 X(o=-0.38,f=-0.0013) USER MOD Single : A 408 THR OG1 : rot 167:sc= 0.421 USER MOD Single : A 412 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 314 -21.798 -5.222 10.314 1.00 64.31 N ATOM 2 CA GLY A 314 -22.973 -6.074 10.326 1.00 64.33 C ATOM 3 C GLY A 314 -23.113 -6.886 9.054 1.00 54.01 C ATOM 4 O GLY A 314 -22.737 -8.059 9.014 1.00 51.10 O ATOM 0 HA2 GLY A 314 -22.920 -6.749 11.180 1.00 64.33 H new ATOM 0 HA3 GLY A 314 -23.863 -5.459 10.461 1.00 64.33 H new ATOM 8 N SER A 315 -23.656 -6.264 8.013 1.00 45.32 N ATOM 9 CA SER A 315 -23.849 -6.939 6.735 1.00 23.45 C ATOM 10 C SER A 315 -24.014 -5.927 5.605 1.00 4.54 C ATOM 11 O SER A 315 -24.662 -4.894 5.774 1.00 43.41 O ATOM 12 CB SER A 315 -25.074 -7.854 6.798 1.00 2.24 C ATOM 13 OG SER A 315 -26.272 -7.099 6.868 1.00 12.42 O ATOM 0 H SER A 315 -23.970 -5.294 8.029 1.00 45.32 H new ATOM 0 HA SER A 315 -22.963 -7.542 6.533 1.00 23.45 H new ATOM 0 HB2 SER A 315 -25.097 -8.497 5.918 1.00 2.24 H new ATOM 0 HB3 SER A 315 -25.000 -8.506 7.668 1.00 2.24 H new ATOM 0 HG SER A 315 -26.166 -6.269 6.357 1.00 12.42 H new ATOM 19 N GLN A 316 -23.423 -6.232 4.455 1.00 11.22 N ATOM 20 CA GLN A 316 -23.504 -5.348 3.298 1.00 41.41 C ATOM 21 C GLN A 316 -22.600 -4.133 3.477 1.00 53.44 C ATOM 22 O GLN A 316 -21.583 -3.996 2.797 1.00 11.32 O ATOM 23 CB GLN A 316 -24.947 -4.897 3.073 1.00 4.22 C ATOM 24 CG GLN A 316 -25.967 -6.010 3.253 1.00 50.41 C ATOM 25 CD GLN A 316 -27.164 -5.577 4.078 1.00 15.41 C ATOM 26 OE1 GLN A 316 -27.027 -5.211 5.245 1.00 22.20 O ATOM 27 NE2 GLN A 316 -28.345 -5.617 3.472 1.00 60.02 N ATOM 0 H GLN A 316 -22.883 -7.083 4.299 1.00 11.22 H new ATOM 0 HA GLN A 316 -23.165 -5.904 2.424 1.00 41.41 H new ATOM 0 HB2 GLN A 316 -25.178 -4.088 3.766 1.00 4.22 H new ATOM 0 HB3 GLN A 316 -25.039 -4.490 2.066 1.00 4.22 H new ATOM 0 HG2 GLN A 316 -26.308 -6.347 2.274 1.00 50.41 H new ATOM 0 HG3 GLN A 316 -25.488 -6.862 3.734 1.00 50.41 H new ATOM 0 HE21 GLN A 316 -28.411 -5.928 2.503 1.00 60.02 H new ATOM 0 HE22 GLN A 316 -29.187 -5.337 3.976 1.00 60.02 H new ATOM 36 N THR A 317 -22.979 -3.250 4.397 1.00 45.40 N ATOM 37 CA THR A 317 -22.205 -2.045 4.664 1.00 53.04 C ATOM 38 C THR A 317 -20.786 -2.389 5.101 1.00 40.25 C ATOM 39 O THR A 317 -20.508 -2.519 6.293 1.00 74.33 O ATOM 40 CB THR A 317 -22.870 -1.181 5.752 1.00 43.32 C ATOM 41 OG1 THR A 317 -24.205 -0.843 5.362 1.00 55.40 O ATOM 42 CG2 THR A 317 -22.071 0.091 5.997 1.00 64.01 C ATOM 0 H THR A 317 -23.818 -3.348 4.969 1.00 45.40 H new ATOM 0 HA THR A 317 -22.168 -1.479 3.733 1.00 53.04 H new ATOM 0 HB THR A 317 -22.897 -1.758 6.676 1.00 43.32 H new ATOM 0 HG1 THR A 317 -24.621 -0.295 6.060 1.00 55.40 H new ATOM 0 HG21 THR A 317 -22.560 0.685 6.769 1.00 64.01 H new ATOM 0 HG22 THR A 317 -21.064 -0.169 6.323 1.00 64.01 H new ATOM 0 HG23 THR A 317 -22.016 0.669 5.075 1.00 64.01 H new ATOM 50 N ILE A 318 -19.892 -2.534 4.129 1.00 31.04 N ATOM 51 CA ILE A 318 -18.500 -2.862 4.414 1.00 65.44 C ATOM 52 C ILE A 318 -17.573 -1.720 4.010 1.00 13.23 C ATOM 53 O ILE A 318 -17.775 -1.077 2.981 1.00 21.01 O ATOM 54 CB ILE A 318 -18.063 -4.146 3.685 1.00 15.33 C ATOM 55 CG1 ILE A 318 -16.542 -4.301 3.749 1.00 54.42 C ATOM 56 CG2 ILE A 318 -18.538 -4.122 2.240 1.00 51.35 C ATOM 57 CD1 ILE A 318 -16.089 -5.728 3.970 1.00 23.44 C ATOM 0 H ILE A 318 -20.106 -2.430 3.137 1.00 31.04 H new ATOM 0 HA ILE A 318 -18.427 -3.023 5.490 1.00 65.44 H new ATOM 0 HB ILE A 318 -18.518 -5.002 4.182 1.00 15.33 H new ATOM 0 HG12 ILE A 318 -16.108 -3.930 2.821 1.00 54.42 H new ATOM 0 HG13 ILE A 318 -16.155 -3.676 4.554 1.00 54.42 H new ATOM 0 HG21 ILE A 318 -18.221 -5.036 1.738 1.00 51.35 H new ATOM 0 HG22 ILE A 318 -19.626 -4.052 2.216 1.00 51.35 H new ATOM 0 HG23 ILE A 318 -18.108 -3.260 1.730 1.00 51.35 H new ATOM 0 HD11 ILE A 318 -15.000 -5.763 4.005 1.00 23.44 H new ATOM 0 HD12 ILE A 318 -16.494 -6.096 4.912 1.00 23.44 H new ATOM 0 HD13 ILE A 318 -16.446 -6.354 3.152 1.00 23.44 H new ATOM 69 N GLY A 319 -16.553 -1.475 4.828 1.00 65.31 N ATOM 70 CA GLY A 319 -15.609 -0.412 4.538 1.00 22.21 C ATOM 71 C GLY A 319 -14.413 -0.900 3.745 1.00 23.23 C ATOM 72 O GLY A 319 -14.061 -0.321 2.716 1.00 0.31 O ATOM 0 H GLY A 319 -16.364 -1.994 5.686 1.00 65.31 H new ATOM 0 HA2 GLY A 319 -16.114 0.376 3.980 1.00 22.21 H new ATOM 0 HA3 GLY A 319 -15.265 0.030 5.473 1.00 22.21 H new ATOM 76 N LEU A 320 -13.783 -1.968 4.225 1.00 50.44 N ATOM 77 CA LEU A 320 -12.617 -2.532 3.554 1.00 3.11 C ATOM 78 C LEU A 320 -11.500 -1.500 3.441 1.00 12.35 C ATOM 79 O LEU A 320 -11.344 -0.826 2.423 1.00 71.12 O ATOM 80 CB LEU A 320 -13.000 -3.041 2.163 1.00 51.35 C ATOM 81 CG LEU A 320 -12.968 -4.557 1.970 1.00 34.51 C ATOM 82 CD1 LEU A 320 -13.873 -4.968 0.819 1.00 71.24 C ATOM 83 CD2 LEU A 320 -11.543 -5.035 1.728 1.00 73.31 C ATOM 0 H LEU A 320 -14.060 -2.459 5.075 1.00 50.44 H new ATOM 0 HA LEU A 320 -12.254 -3.368 4.152 1.00 3.11 H new ATOM 0 HB2 LEU A 320 -14.005 -2.687 1.933 1.00 51.35 H new ATOM 0 HB3 LEU A 320 -12.327 -2.588 1.435 1.00 51.35 H new ATOM 0 HG LEU A 320 -13.337 -5.027 2.881 1.00 34.51 H new ATOM 0 HD11 LEU A 320 -13.837 -6.051 0.697 1.00 71.24 H new ATOM 0 HD12 LEU A 320 -14.897 -4.661 1.033 1.00 71.24 H new ATOM 0 HD13 LEU A 320 -13.535 -4.488 -0.099 1.00 71.24 H new ATOM 0 HD21 LEU A 320 -11.540 -6.117 1.593 1.00 73.31 H new ATOM 0 HD22 LEU A 320 -11.146 -4.556 0.833 1.00 73.31 H new ATOM 0 HD23 LEU A 320 -10.921 -4.775 2.585 1.00 73.31 H new ATOM 95 N PRO A 321 -10.700 -1.373 4.511 1.00 70.05 N ATOM 96 CA PRO A 321 -9.583 -0.427 4.555 1.00 31.04 C ATOM 97 C PRO A 321 -8.441 -0.834 3.630 1.00 71.31 C ATOM 98 O PRO A 321 -8.212 -2.015 3.370 1.00 63.21 O ATOM 99 CB PRO A 321 -9.130 -0.480 6.017 1.00 53.25 C ATOM 100 CG PRO A 321 -9.556 -1.825 6.496 1.00 54.22 C ATOM 101 CD PRO A 321 -10.827 -2.143 5.760 1.00 42.44 C ATOM 0 HA PRO A 321 -9.879 0.568 4.221 1.00 31.04 H new ATOM 0 HB2 PRO A 321 -8.051 -0.353 6.102 1.00 53.25 H new ATOM 0 HB3 PRO A 321 -9.592 0.314 6.604 1.00 53.25 H new ATOM 0 HG2 PRO A 321 -8.789 -2.573 6.292 1.00 54.22 H new ATOM 0 HG3 PRO A 321 -9.719 -1.822 7.574 1.00 54.22 H new ATOM 0 HD2 PRO A 321 -10.922 -3.211 5.566 1.00 42.44 H new ATOM 0 HD3 PRO A 321 -11.707 -1.843 6.329 1.00 42.44 H new ATOM 109 N PRO A 322 -7.708 0.166 3.118 1.00 21.41 N ATOM 110 CA PRO A 322 -6.578 -0.064 2.212 1.00 24.52 C ATOM 111 C PRO A 322 -5.389 -0.704 2.922 1.00 44.05 C ATOM 112 O PRO A 322 -4.336 -0.913 2.320 1.00 51.23 O ATOM 113 CB PRO A 322 -6.219 1.343 1.729 1.00 51.54 C ATOM 114 CG PRO A 322 -6.697 2.249 2.811 1.00 74.51 C ATOM 115 CD PRO A 322 -7.926 1.598 3.383 1.00 42.11 C ATOM 0 HA PRO A 322 -6.833 -0.753 1.407 1.00 24.52 H new ATOM 0 HB2 PRO A 322 -5.145 1.446 1.572 1.00 51.54 H new ATOM 0 HB3 PRO A 322 -6.703 1.571 0.779 1.00 51.54 H new ATOM 0 HG2 PRO A 322 -5.932 2.380 3.577 1.00 74.51 H new ATOM 0 HG3 PRO A 322 -6.927 3.239 2.418 1.00 74.51 H new ATOM 0 HD2 PRO A 322 -8.027 1.798 4.450 1.00 42.11 H new ATOM 0 HD3 PRO A 322 -8.834 1.962 2.902 1.00 42.11 H new ATOM 123 N GLN A 323 -5.566 -1.012 4.202 1.00 51.41 N ATOM 124 CA GLN A 323 -4.506 -1.629 4.991 1.00 12.44 C ATOM 125 C GLN A 323 -4.592 -3.150 4.925 1.00 43.32 C ATOM 126 O GLN A 323 -3.753 -3.804 4.305 1.00 53.34 O ATOM 127 CB GLN A 323 -4.590 -1.165 6.447 1.00 21.03 C ATOM 128 CG GLN A 323 -4.456 0.341 6.614 1.00 11.24 C ATOM 129 CD GLN A 323 -5.705 0.976 7.194 1.00 63.33 C ATOM 130 OE1 GLN A 323 -6.503 1.574 6.473 1.00 74.24 O ATOM 131 NE2 GLN A 323 -5.880 0.849 8.504 1.00 14.45 N ATOM 0 H GLN A 323 -6.432 -0.845 4.715 1.00 51.41 H new ATOM 0 HA GLN A 323 -3.549 -1.319 4.572 1.00 12.44 H new ATOM 0 HB2 GLN A 323 -5.543 -1.486 6.867 1.00 21.03 H new ATOM 0 HB3 GLN A 323 -3.806 -1.657 7.022 1.00 21.03 H new ATOM 0 HG2 GLN A 323 -3.608 0.557 7.264 1.00 11.24 H new ATOM 0 HG3 GLN A 323 -4.239 0.792 5.646 1.00 11.24 H new ATOM 0 HE21 GLN A 323 -5.193 0.345 9.064 1.00 14.45 H new ATOM 0 HE22 GLN A 323 -6.702 1.256 8.951 1.00 14.45 H new ATOM 140 N VAL A 324 -5.612 -3.709 5.569 1.00 61.42 N ATOM 141 CA VAL A 324 -5.808 -5.154 5.583 1.00 34.21 C ATOM 142 C VAL A 324 -7.272 -5.508 5.820 1.00 64.22 C ATOM 143 O VAL A 324 -8.107 -4.629 6.027 1.00 54.35 O ATOM 144 CB VAL A 324 -4.947 -5.827 6.667 1.00 15.41 C ATOM 145 CG1 VAL A 324 -5.616 -5.712 8.029 1.00 45.13 C ATOM 146 CG2 VAL A 324 -4.687 -7.284 6.313 1.00 15.14 C ATOM 0 H VAL A 324 -6.315 -3.183 6.088 1.00 61.42 H new ATOM 0 HA VAL A 324 -5.501 -5.524 4.605 1.00 34.21 H new ATOM 0 HB VAL A 324 -3.988 -5.312 6.715 1.00 15.41 H new ATOM 0 HG11 VAL A 324 -4.993 -6.193 8.782 1.00 45.13 H new ATOM 0 HG12 VAL A 324 -5.745 -4.660 8.283 1.00 45.13 H new ATOM 0 HG13 VAL A 324 -6.590 -6.200 7.998 1.00 45.13 H new ATOM 0 HG21 VAL A 324 -4.077 -7.744 7.090 1.00 15.14 H new ATOM 0 HG22 VAL A 324 -5.636 -7.814 6.235 1.00 15.14 H new ATOM 0 HG23 VAL A 324 -4.162 -7.339 5.360 1.00 15.14 H new ATOM 156 N ASN A 325 -7.575 -6.801 5.787 1.00 3.14 N ATOM 157 CA ASN A 325 -8.940 -7.271 5.999 1.00 40.54 C ATOM 158 C ASN A 325 -9.279 -7.306 7.485 1.00 65.55 C ATOM 159 O ASN A 325 -8.744 -8.108 8.251 1.00 3.41 O ATOM 160 CB ASN A 325 -9.121 -8.664 5.390 1.00 52.54 C ATOM 161 CG ASN A 325 -10.543 -9.174 5.527 1.00 42.32 C ATOM 162 OD1 ASN A 325 -11.497 -8.396 5.527 1.00 75.14 O ATOM 163 ND2 ASN A 325 -10.690 -10.488 5.646 1.00 63.01 N ATOM 0 H ASN A 325 -6.895 -7.542 5.616 1.00 3.14 H new ATOM 0 HA ASN A 325 -9.619 -6.574 5.507 1.00 40.54 H new ATOM 0 HB2 ASN A 325 -8.848 -8.635 4.335 1.00 52.54 H new ATOM 0 HB3 ASN A 325 -8.439 -9.362 5.876 1.00 52.54 H new ATOM 0 HD21 ASN A 325 -11.622 -10.890 5.742 1.00 63.01 H new ATOM 0 HD22 ASN A 325 -9.871 -11.095 5.641 1.00 63.01 H new ATOM 170 N PRO A 326 -10.190 -6.416 7.905 1.00 50.44 N ATOM 171 CA PRO A 326 -10.623 -6.326 9.303 1.00 63.34 C ATOM 172 C PRO A 326 -11.457 -7.528 9.731 1.00 44.12 C ATOM 173 O PRO A 326 -11.684 -7.743 10.921 1.00 5.32 O ATOM 174 CB PRO A 326 -11.470 -5.051 9.330 1.00 1.04 C ATOM 175 CG PRO A 326 -11.959 -4.891 7.932 1.00 14.45 C ATOM 176 CD PRO A 326 -10.870 -5.430 7.048 1.00 4.53 C ATOM 0 HA PRO A 326 -9.778 -6.308 9.991 1.00 63.34 H new ATOM 0 HB2 PRO A 326 -12.299 -5.142 10.031 1.00 1.04 H new ATOM 0 HB3 PRO A 326 -10.880 -4.190 9.644 1.00 1.04 H new ATOM 0 HG2 PRO A 326 -12.891 -5.436 7.780 1.00 14.45 H new ATOM 0 HG3 PRO A 326 -12.162 -3.844 7.707 1.00 14.45 H new ATOM 0 HD2 PRO A 326 -11.275 -5.892 6.148 1.00 4.53 H new ATOM 0 HD3 PRO A 326 -10.190 -4.643 6.724 1.00 4.53 H new ATOM 184 N GLN A 327 -11.907 -8.308 8.754 1.00 30.43 N ATOM 185 CA GLN A 327 -12.716 -9.489 9.031 1.00 73.21 C ATOM 186 C GLN A 327 -11.878 -10.580 9.690 1.00 64.44 C ATOM 187 O GLN A 327 -12.021 -10.852 10.882 1.00 53.04 O ATOM 188 CB GLN A 327 -13.342 -10.019 7.740 1.00 61.42 C ATOM 189 CG GLN A 327 -14.780 -10.482 7.907 1.00 74.50 C ATOM 190 CD GLN A 327 -15.530 -10.545 6.591 1.00 63.10 C ATOM 191 OE1 GLN A 327 -14.956 -10.875 5.552 1.00 41.44 O ATOM 192 NE2 GLN A 327 -16.818 -10.230 6.627 1.00 15.11 N ATOM 0 H GLN A 327 -11.725 -8.144 7.764 1.00 30.43 H new ATOM 0 HA GLN A 327 -13.511 -9.201 9.719 1.00 73.21 H new ATOM 0 HB2 GLN A 327 -13.307 -9.237 6.981 1.00 61.42 H new ATOM 0 HB3 GLN A 327 -12.742 -10.850 7.370 1.00 61.42 H new ATOM 0 HG2 GLN A 327 -14.789 -11.467 8.373 1.00 74.50 H new ATOM 0 HG3 GLN A 327 -15.299 -9.804 8.585 1.00 74.50 H new ATOM 0 HE21 GLN A 327 -17.253 -9.962 7.510 1.00 15.11 H new ATOM 0 HE22 GLN A 327 -17.373 -10.256 5.772 1.00 15.11 H new ATOM 201 N ALA A 328 -11.004 -11.202 8.906 1.00 53.13 N ATOM 202 CA ALA A 328 -10.142 -12.262 9.412 1.00 23.15 C ATOM 203 C ALA A 328 -9.300 -11.771 10.586 1.00 71.13 C ATOM 204 O ALA A 328 -8.867 -12.560 11.426 1.00 15.31 O ATOM 205 CB ALA A 328 -9.245 -12.791 8.302 1.00 24.32 C ATOM 0 H ALA A 328 -10.874 -10.990 7.917 1.00 53.13 H new ATOM 0 HA ALA A 328 -10.777 -13.073 9.767 1.00 23.15 H new ATOM 0 HB1 ALA A 328 -8.607 -13.582 8.696 1.00 24.32 H new ATOM 0 HB2 ALA A 328 -9.861 -13.189 7.495 1.00 24.32 H new ATOM 0 HB3 ALA A 328 -8.624 -11.981 7.919 1.00 24.32 H new ATOM 211 N VAL A 329 -9.071 -10.463 10.638 1.00 53.52 N ATOM 212 CA VAL A 329 -8.281 -9.866 11.708 1.00 71.42 C ATOM 213 C VAL A 329 -9.090 -9.767 12.997 1.00 3.11 C ATOM 214 O VAL A 329 -8.535 -9.823 14.095 1.00 54.13 O ATOM 215 CB VAL A 329 -7.779 -8.464 11.321 1.00 55.24 C ATOM 216 CG1 VAL A 329 -7.323 -7.700 12.554 1.00 62.43 C ATOM 217 CG2 VAL A 329 -6.655 -8.564 10.300 1.00 3.31 C ATOM 0 H VAL A 329 -9.422 -9.796 9.951 1.00 53.52 H new ATOM 0 HA VAL A 329 -7.423 -10.518 11.869 1.00 71.42 H new ATOM 0 HB VAL A 329 -8.604 -7.914 10.868 1.00 55.24 H new ATOM 0 HG11 VAL A 329 -6.972 -6.711 12.260 1.00 62.43 H new ATOM 0 HG12 VAL A 329 -8.158 -7.597 13.248 1.00 62.43 H new ATOM 0 HG13 VAL A 329 -6.513 -8.243 13.040 1.00 62.43 H new ATOM 0 HG21 VAL A 329 -6.312 -7.563 10.037 1.00 3.31 H new ATOM 0 HG22 VAL A 329 -5.827 -9.132 10.725 1.00 3.31 H new ATOM 0 HG23 VAL A 329 -7.020 -9.069 9.405 1.00 3.31 H new ATOM 227 N ASP A 330 -10.402 -9.619 12.855 1.00 12.43 N ATOM 228 CA ASP A 330 -11.288 -9.512 14.009 1.00 51.12 C ATOM 229 C ASP A 330 -11.097 -10.697 14.952 1.00 50.31 C ATOM 230 O ASP A 330 -11.146 -10.545 16.173 1.00 5.11 O ATOM 231 CB ASP A 330 -12.747 -9.437 13.554 1.00 34.42 C ATOM 232 CG ASP A 330 -13.716 -9.409 14.719 1.00 73.32 C ATOM 233 OD1 ASP A 330 -13.460 -8.660 15.685 1.00 10.35 O ATOM 234 OD2 ASP A 330 -14.730 -10.136 14.665 1.00 31.23 O ATOM 0 H ASP A 330 -10.876 -9.570 11.953 1.00 12.43 H new ATOM 0 HA ASP A 330 -11.036 -8.598 14.546 1.00 51.12 H new ATOM 0 HB2 ASP A 330 -12.889 -8.544 12.945 1.00 34.42 H new ATOM 0 HB3 ASP A 330 -12.971 -10.294 12.919 1.00 34.42 H new ATOM 239 N HIS A 331 -10.881 -11.876 14.377 1.00 52.24 N ATOM 240 CA HIS A 331 -10.684 -13.086 15.166 1.00 12.02 C ATOM 241 C HIS A 331 -9.431 -12.973 16.030 1.00 13.24 C ATOM 242 O HIS A 331 -9.370 -13.530 17.127 1.00 74.33 O ATOM 243 CB HIS A 331 -10.577 -14.306 14.250 1.00 30.13 C ATOM 244 CG HIS A 331 -9.679 -15.379 14.784 1.00 14.32 C ATOM 245 ND1 HIS A 331 -10.067 -16.265 15.767 1.00 10.13 N ATOM 246 CD2 HIS A 331 -8.406 -15.707 14.465 1.00 40.51 C ATOM 247 CE1 HIS A 331 -9.070 -17.091 16.030 1.00 24.52 C ATOM 248 NE2 HIS A 331 -8.051 -16.774 15.253 1.00 64.32 N ATOM 0 H HIS A 331 -10.838 -12.019 13.368 1.00 52.24 H new ATOM 0 HA HIS A 331 -11.547 -13.207 15.821 1.00 12.02 H new ATOM 0 HB2 HIS A 331 -11.573 -14.721 14.094 1.00 30.13 H new ATOM 0 HB3 HIS A 331 -10.208 -13.987 13.275 1.00 30.13 H new ATOM 0 HD2 HIS A 331 -7.785 -15.220 13.728 1.00 40.51 H new ATOM 0 HE1 HIS A 331 -9.086 -17.890 16.757 1.00 24.52 H new ATOM 0 HE2 HIS A 331 -7.147 -17.245 15.240 1.00 64.32 H new ATOM 256 N ILE A 332 -8.436 -12.251 15.528 1.00 53.50 N ATOM 257 CA ILE A 332 -7.185 -12.065 16.254 1.00 14.13 C ATOM 258 C ILE A 332 -7.407 -11.271 17.536 1.00 33.05 C ATOM 259 O ILE A 332 -6.846 -11.594 18.584 1.00 53.45 O ATOM 260 CB ILE A 332 -6.134 -11.343 15.390 1.00 72.30 C ATOM 261 CG1 ILE A 332 -5.562 -12.296 14.340 1.00 44.42 C ATOM 262 CG2 ILE A 332 -5.024 -10.782 16.266 1.00 75.20 C ATOM 263 CD1 ILE A 332 -4.730 -13.413 14.929 1.00 41.01 C ATOM 0 H ILE A 332 -8.471 -11.785 14.621 1.00 53.50 H new ATOM 0 HA ILE A 332 -6.815 -13.059 16.505 1.00 14.13 H new ATOM 0 HB ILE A 332 -6.617 -10.514 14.874 1.00 72.30 H new ATOM 0 HG12 ILE A 332 -6.383 -12.728 13.767 1.00 44.42 H new ATOM 0 HG13 ILE A 332 -4.950 -11.728 13.640 1.00 44.42 H new ATOM 0 HG21 ILE A 332 -4.289 -10.275 15.641 1.00 75.20 H new ATOM 0 HG22 ILE A 332 -5.446 -10.073 16.978 1.00 75.20 H new ATOM 0 HG23 ILE A 332 -4.541 -11.596 16.807 1.00 75.20 H new ATOM 0 HD11 ILE A 332 -4.356 -14.050 14.127 1.00 41.01 H new ATOM 0 HD12 ILE A 332 -3.889 -12.990 15.478 1.00 41.01 H new ATOM 0 HD13 ILE A 332 -5.344 -14.006 15.607 1.00 41.01 H new ATOM 275 N ILE A 333 -8.230 -10.231 17.447 1.00 41.05 N ATOM 276 CA ILE A 333 -8.528 -9.391 18.601 1.00 75.03 C ATOM 277 C ILE A 333 -8.986 -10.232 19.787 1.00 72.41 C ATOM 278 O ILE A 333 -8.491 -10.070 20.903 1.00 12.02 O ATOM 279 CB ILE A 333 -9.614 -8.350 18.273 1.00 22.44 C ATOM 280 CG1 ILE A 333 -9.051 -7.265 17.354 1.00 60.12 C ATOM 281 CG2 ILE A 333 -10.162 -7.736 19.553 1.00 61.34 C ATOM 282 CD1 ILE A 333 -10.105 -6.577 16.515 1.00 54.02 C ATOM 0 H ILE A 333 -8.702 -9.950 16.588 1.00 41.05 H new ATOM 0 HA ILE A 333 -7.606 -8.871 18.862 1.00 75.03 H new ATOM 0 HB ILE A 333 -10.431 -8.850 17.754 1.00 22.44 H new ATOM 0 HG12 ILE A 333 -8.536 -6.519 17.959 1.00 60.12 H new ATOM 0 HG13 ILE A 333 -8.306 -7.710 16.694 1.00 60.12 H new ATOM 0 HG21 ILE A 333 -10.929 -7.002 19.305 1.00 61.34 H new ATOM 0 HG22 ILE A 333 -10.596 -8.519 20.175 1.00 61.34 H new ATOM 0 HG23 ILE A 333 -9.354 -7.247 20.097 1.00 61.34 H new ATOM 0 HD11 ILE A 333 -9.634 -5.820 15.888 1.00 54.02 H new ATOM 0 HD12 ILE A 333 -10.604 -7.312 15.883 1.00 54.02 H new ATOM 0 HD13 ILE A 333 -10.837 -6.103 17.168 1.00 54.02 H new ATOM 294 N ARG A 334 -9.934 -11.131 19.539 1.00 22.40 N ATOM 295 CA ARG A 334 -10.458 -11.997 20.588 1.00 21.42 C ATOM 296 C ARG A 334 -9.367 -12.913 21.132 1.00 4.45 C ATOM 297 O ARG A 334 -9.575 -13.630 22.111 1.00 64.21 O ATOM 298 CB ARG A 334 -11.622 -12.834 20.052 1.00 65.54 C ATOM 299 CG ARG A 334 -11.188 -13.955 19.123 1.00 63.14 C ATOM 300 CD ARG A 334 -11.872 -15.267 19.476 1.00 74.23 C ATOM 301 NE ARG A 334 -10.994 -16.415 19.270 1.00 43.13 N ATOM 302 CZ ARG A 334 -11.422 -17.672 19.236 1.00 14.15 C ATOM 303 NH1 ARG A 334 -12.711 -17.941 19.393 1.00 10.41 N ATOM 304 NH2 ARG A 334 -10.562 -18.663 19.044 1.00 55.31 N ATOM 0 H ARG A 334 -10.354 -11.278 18.621 1.00 22.40 H new ATOM 0 HA ARG A 334 -10.817 -11.366 21.401 1.00 21.42 H new ATOM 0 HB2 ARG A 334 -12.169 -13.261 20.893 1.00 65.54 H new ATOM 0 HB3 ARG A 334 -12.314 -12.181 19.521 1.00 65.54 H new ATOM 0 HG2 ARG A 334 -11.422 -13.687 18.093 1.00 63.14 H new ATOM 0 HG3 ARG A 334 -10.107 -14.080 19.182 1.00 63.14 H new ATOM 0 HD2 ARG A 334 -12.194 -15.239 20.517 1.00 74.23 H new ATOM 0 HD3 ARG A 334 -12.769 -15.383 18.868 1.00 74.23 H new ATOM 0 HE ARG A 334 -9.997 -16.242 19.145 1.00 43.13 H new ATOM 0 HH11 ARG A 334 -13.376 -17.182 19.540 1.00 10.41 H new ATOM 0 HH12 ARG A 334 -13.037 -18.907 19.366 1.00 10.41 H new ATOM 0 HH21 ARG A 334 -9.570 -18.461 18.922 1.00 55.31 H new ATOM 0 HH22 ARG A 334 -10.893 -19.628 19.018 1.00 55.31 H new ATOM 318 N SER A 335 -8.203 -12.885 20.491 1.00 42.04 N ATOM 319 CA SER A 335 -7.079 -13.716 20.907 1.00 41.41 C ATOM 320 C SER A 335 -6.318 -13.064 22.057 1.00 12.14 C ATOM 321 O SER A 335 -5.763 -13.748 22.917 1.00 11.34 O ATOM 322 CB SER A 335 -6.135 -13.963 19.729 1.00 75.52 C ATOM 323 OG SER A 335 -5.371 -15.141 19.926 1.00 21.41 O ATOM 0 H SER A 335 -8.013 -12.295 19.681 1.00 42.04 H new ATOM 0 HA SER A 335 -7.474 -14.672 21.252 1.00 41.41 H new ATOM 0 HB2 SER A 335 -6.712 -14.050 18.808 1.00 75.52 H new ATOM 0 HB3 SER A 335 -5.468 -13.109 19.608 1.00 75.52 H new ATOM 0 HG SER A 335 -4.777 -15.278 19.159 1.00 21.41 H new ATOM 329 N ALA A 336 -6.297 -11.735 22.065 1.00 41.41 N ATOM 330 CA ALA A 336 -5.605 -10.988 23.109 1.00 11.42 C ATOM 331 C ALA A 336 -6.582 -10.143 23.917 1.00 52.43 C ATOM 332 O ALA A 336 -7.646 -9.751 23.438 1.00 70.44 O ATOM 333 CB ALA A 336 -4.522 -10.110 22.500 1.00 22.25 C ATOM 0 H ALA A 336 -6.751 -11.154 21.361 1.00 41.41 H new ATOM 0 HA ALA A 336 -5.138 -11.704 23.786 1.00 11.42 H new ATOM 0 HB1 ALA A 336 -4.014 -9.558 23.291 1.00 22.25 H new ATOM 0 HB2 ALA A 336 -3.801 -10.735 21.972 1.00 22.25 H new ATOM 0 HB3 ALA A 336 -4.974 -9.407 21.800 1.00 22.25 H new ATOM 339 N PRO A 337 -6.216 -9.854 25.175 1.00 1.45 N ATOM 340 CA PRO A 337 -7.048 -9.052 26.078 1.00 14.31 C ATOM 341 C PRO A 337 -7.114 -7.588 25.657 1.00 73.22 C ATOM 342 O PRO A 337 -6.255 -7.086 24.930 1.00 44.44 O ATOM 343 CB PRO A 337 -6.340 -9.189 27.428 1.00 61.14 C ATOM 344 CG PRO A 337 -4.921 -9.485 27.084 1.00 2.15 C ATOM 345 CD PRO A 337 -4.962 -10.289 25.813 1.00 63.42 C ATOM 0 HA PRO A 337 -8.084 -9.392 26.088 1.00 14.31 H new ATOM 0 HB2 PRO A 337 -6.423 -8.273 28.013 1.00 61.14 H new ATOM 0 HB3 PRO A 337 -6.778 -9.989 28.025 1.00 61.14 H new ATOM 0 HG2 PRO A 337 -4.353 -8.565 26.946 1.00 2.15 H new ATOM 0 HG3 PRO A 337 -4.434 -10.043 27.883 1.00 2.15 H new ATOM 0 HD2 PRO A 337 -4.098 -10.086 25.181 1.00 63.42 H new ATOM 0 HD3 PRO A 337 -4.964 -11.360 26.015 1.00 63.42 H new ATOM 353 N PRO A 338 -8.155 -6.884 26.123 1.00 40.30 N ATOM 354 CA PRO A 338 -8.357 -5.466 25.809 1.00 32.22 C ATOM 355 C PRO A 338 -7.323 -4.570 26.483 1.00 15.13 C ATOM 356 O PRO A 338 -7.262 -3.369 26.219 1.00 40.11 O ATOM 357 CB PRO A 338 -9.755 -5.176 26.359 1.00 62.53 C ATOM 358 CG PRO A 338 -9.955 -6.184 27.437 1.00 41.51 C ATOM 359 CD PRO A 338 -9.216 -7.416 26.994 1.00 12.25 C ATOM 0 HA PRO A 338 -8.254 -5.266 24.742 1.00 32.22 H new ATOM 0 HB2 PRO A 338 -9.824 -4.160 26.749 1.00 62.53 H new ATOM 0 HB3 PRO A 338 -10.514 -5.271 25.582 1.00 62.53 H new ATOM 0 HG2 PRO A 338 -9.570 -5.819 28.389 1.00 41.51 H new ATOM 0 HG3 PRO A 338 -11.014 -6.395 27.582 1.00 41.51 H new ATOM 0 HD2 PRO A 338 -8.803 -7.963 27.841 1.00 12.25 H new ATOM 0 HD3 PRO A 338 -9.869 -8.105 26.457 1.00 12.25 H new ATOM 367 N ARG A 339 -6.512 -5.161 27.354 1.00 63.12 N ATOM 368 CA ARG A 339 -5.482 -4.416 28.067 1.00 52.02 C ATOM 369 C ARG A 339 -4.109 -4.654 27.443 1.00 20.12 C ATOM 370 O ARG A 339 -3.150 -4.990 28.138 1.00 0.21 O ATOM 371 CB ARG A 339 -5.460 -4.818 29.543 1.00 72.43 C ATOM 372 CG ARG A 339 -5.168 -6.293 29.768 1.00 65.20 C ATOM 373 CD ARG A 339 -4.171 -6.497 30.899 1.00 54.13 C ATOM 374 NE ARG A 339 -4.707 -6.062 32.185 1.00 54.44 N ATOM 375 CZ ARG A 339 -3.959 -5.872 33.267 1.00 24.10 C ATOM 376 NH1 ARG A 339 -2.649 -6.077 33.215 1.00 50.52 N ATOM 377 NH2 ARG A 339 -4.519 -5.475 34.401 1.00 4.34 N ATOM 0 H ARG A 339 -6.548 -6.154 27.583 1.00 63.12 H new ATOM 0 HA ARG A 339 -5.718 -3.355 27.991 1.00 52.02 H new ATOM 0 HB2 ARG A 339 -4.707 -4.224 30.061 1.00 72.43 H new ATOM 0 HB3 ARG A 339 -6.423 -4.574 29.992 1.00 72.43 H new ATOM 0 HG2 ARG A 339 -6.095 -6.817 30.000 1.00 65.20 H new ATOM 0 HG3 ARG A 339 -4.774 -6.731 28.851 1.00 65.20 H new ATOM 0 HD2 ARG A 339 -3.899 -7.551 30.957 1.00 54.13 H new ATOM 0 HD3 ARG A 339 -3.257 -5.944 30.681 1.00 54.13 H new ATOM 0 HE ARG A 339 -5.711 -5.895 32.257 1.00 54.44 H new ATOM 0 HH11 ARG A 339 -2.215 -6.381 32.344 1.00 50.52 H new ATOM 0 HH12 ARG A 339 -2.077 -5.931 34.046 1.00 50.52 H new ATOM 0 HH21 ARG A 339 -5.525 -5.315 34.444 1.00 4.34 H new ATOM 0 HH22 ARG A 339 -3.943 -5.330 35.230 1.00 4.34 H new ATOM 391 N VAL A 340 -4.023 -4.478 26.129 1.00 64.01 N ATOM 392 CA VAL A 340 -2.770 -4.673 25.411 1.00 43.20 C ATOM 393 C VAL A 340 -2.918 -4.311 23.938 1.00 41.42 C ATOM 394 O VAL A 340 -3.828 -4.784 23.258 1.00 10.14 O ATOM 395 CB VAL A 340 -2.279 -6.129 25.524 1.00 60.40 C ATOM 396 CG1 VAL A 340 -3.162 -7.056 24.703 1.00 72.34 C ATOM 397 CG2 VAL A 340 -0.826 -6.236 25.085 1.00 2.15 C ATOM 0 H VAL A 340 -4.808 -4.200 25.539 1.00 64.01 H new ATOM 0 HA VAL A 340 -2.035 -4.013 25.872 1.00 43.20 H new ATOM 0 HB VAL A 340 -2.343 -6.436 26.568 1.00 60.40 H new ATOM 0 HG11 VAL A 340 -2.800 -8.080 24.795 1.00 72.34 H new ATOM 0 HG12 VAL A 340 -4.187 -7.000 25.068 1.00 72.34 H new ATOM 0 HG13 VAL A 340 -3.133 -6.754 23.656 1.00 72.34 H new ATOM 0 HG21 VAL A 340 -0.495 -7.271 25.171 1.00 2.15 H new ATOM 0 HG22 VAL A 340 -0.734 -5.911 24.049 1.00 2.15 H new ATOM 0 HG23 VAL A 340 -0.206 -5.603 25.720 1.00 2.15 H new ATOM 407 N THR A 341 -2.014 -3.467 23.448 1.00 3.21 N ATOM 408 CA THR A 341 -2.043 -3.040 22.055 1.00 24.14 C ATOM 409 C THR A 341 -0.644 -3.037 21.450 1.00 73.22 C ATOM 410 O THR A 341 -0.093 -1.982 21.137 1.00 60.14 O ATOM 411 CB THR A 341 -2.655 -1.634 21.911 1.00 21.52 C ATOM 412 OG1 THR A 341 -1.731 -0.648 22.387 1.00 34.41 O ATOM 413 CG2 THR A 341 -3.960 -1.529 22.686 1.00 53.33 C ATOM 0 H THR A 341 -1.253 -3.066 23.996 1.00 3.21 H new ATOM 0 HA THR A 341 -2.665 -3.756 21.519 1.00 24.14 H new ATOM 0 HB THR A 341 -2.863 -1.458 20.856 1.00 21.52 H new ATOM 0 HG1 THR A 341 -0.962 -0.600 21.781 1.00 34.41 H new ATOM 0 HG21 THR A 341 -4.373 -0.527 22.569 1.00 53.33 H new ATOM 0 HG22 THR A 341 -4.671 -2.261 22.303 1.00 53.33 H new ATOM 0 HG23 THR A 341 -3.773 -1.723 23.742 1.00 53.33 H new ATOM 421 N THR A 342 -0.072 -4.226 21.289 1.00 42.13 N ATOM 422 CA THR A 342 1.264 -4.361 20.722 1.00 65.23 C ATOM 423 C THR A 342 1.304 -5.457 19.663 1.00 42.13 C ATOM 424 O THR A 342 0.735 -6.532 19.847 1.00 52.24 O ATOM 425 CB THR A 342 2.306 -4.678 21.811 1.00 53.12 C ATOM 426 OG1 THR A 342 2.485 -3.541 22.663 1.00 62.34 O ATOM 427 CG2 THR A 342 3.639 -5.065 21.188 1.00 62.20 C ATOM 0 H THR A 342 -0.513 -5.110 21.543 1.00 42.13 H new ATOM 0 HA THR A 342 1.510 -3.405 20.261 1.00 65.23 H new ATOM 0 HB THR A 342 1.940 -5.519 22.400 1.00 53.12 H new ATOM 0 HG1 THR A 342 3.148 -3.751 23.354 1.00 62.34 H new ATOM 0 HG21 THR A 342 4.359 -5.284 21.976 1.00 62.20 H new ATOM 0 HG22 THR A 342 3.506 -5.948 20.562 1.00 62.20 H new ATOM 0 HG23 THR A 342 4.009 -4.241 20.578 1.00 62.20 H new ATOM 435 N ALA A 343 1.980 -5.177 18.553 1.00 63.52 N ATOM 436 CA ALA A 343 2.097 -6.140 17.466 1.00 60.14 C ATOM 437 C ALA A 343 3.445 -6.852 17.506 1.00 75.20 C ATOM 438 O ALA A 343 4.494 -6.213 17.588 1.00 24.21 O ATOM 439 CB ALA A 343 1.902 -5.449 16.125 1.00 31.33 C ATOM 0 H ALA A 343 2.455 -4.290 18.384 1.00 63.52 H new ATOM 0 HA ALA A 343 1.316 -6.890 17.592 1.00 60.14 H new ATOM 0 HB1 ALA A 343 1.992 -6.181 15.322 1.00 31.33 H new ATOM 0 HB2 ALA A 343 0.912 -4.993 16.091 1.00 31.33 H new ATOM 0 HB3 ALA A 343 2.661 -4.677 15.999 1.00 31.33 H new ATOM 445 N TYR A 344 3.410 -8.179 17.447 1.00 4.34 N ATOM 446 CA TYR A 344 4.630 -8.978 17.479 1.00 2.51 C ATOM 447 C TYR A 344 4.941 -9.551 16.100 1.00 13.15 C ATOM 448 O TYR A 344 4.057 -10.066 15.415 1.00 34.23 O ATOM 449 CB TYR A 344 4.494 -10.112 18.496 1.00 72.31 C ATOM 450 CG TYR A 344 5.006 -11.442 17.992 1.00 63.50 C ATOM 451 CD1 TYR A 344 4.223 -12.244 17.171 1.00 32.30 C ATOM 452 CD2 TYR A 344 6.272 -11.899 18.337 1.00 14.40 C ATOM 453 CE1 TYR A 344 4.685 -13.461 16.708 1.00 64.02 C ATOM 454 CE2 TYR A 344 6.744 -13.113 17.878 1.00 54.14 C ATOM 455 CZ TYR A 344 5.947 -13.890 17.064 1.00 70.41 C ATOM 456 OH TYR A 344 6.413 -15.101 16.605 1.00 60.12 O ATOM 0 H TYR A 344 2.551 -8.724 17.377 1.00 4.34 H new ATOM 0 HA TYR A 344 5.453 -8.328 17.777 1.00 2.51 H new ATOM 0 HB2 TYR A 344 5.037 -9.843 19.402 1.00 72.31 H new ATOM 0 HB3 TYR A 344 3.445 -10.217 18.772 1.00 72.31 H new ATOM 0 HD1 TYR A 344 3.235 -11.910 16.890 1.00 32.30 H new ATOM 0 HD2 TYR A 344 6.898 -11.294 18.976 1.00 14.40 H new ATOM 0 HE1 TYR A 344 4.062 -14.072 16.072 1.00 64.02 H new ATOM 0 HE2 TYR A 344 7.731 -13.452 18.155 1.00 54.14 H new ATOM 0 HH TYR A 344 7.319 -15.254 16.946 1.00 60.12 H new ATOM 466 N ILE A 345 6.205 -9.459 15.700 1.00 42.21 N ATOM 467 CA ILE A 345 6.635 -9.969 14.405 1.00 70.02 C ATOM 468 C ILE A 345 7.893 -10.821 14.540 1.00 35.21 C ATOM 469 O ILE A 345 8.944 -10.333 14.953 1.00 53.43 O ATOM 470 CB ILE A 345 6.907 -8.825 13.411 1.00 72.10 C ATOM 471 CG1 ILE A 345 5.605 -8.375 12.748 1.00 53.24 C ATOM 472 CG2 ILE A 345 7.918 -9.263 12.361 1.00 20.45 C ATOM 473 CD1 ILE A 345 4.614 -7.763 13.714 1.00 2.33 C ATOM 0 H ILE A 345 6.949 -9.036 16.255 1.00 42.21 H new ATOM 0 HA ILE A 345 5.821 -10.585 14.022 1.00 70.02 H new ATOM 0 HB ILE A 345 7.324 -7.980 13.959 1.00 72.10 H new ATOM 0 HG12 ILE A 345 5.836 -7.649 11.969 1.00 53.24 H new ATOM 0 HG13 ILE A 345 5.141 -9.231 12.259 1.00 53.24 H new ATOM 0 HG21 ILE A 345 8.099 -8.443 11.666 1.00 20.45 H new ATOM 0 HG22 ILE A 345 8.853 -9.539 12.849 1.00 20.45 H new ATOM 0 HG23 ILE A 345 7.527 -10.121 11.815 1.00 20.45 H new ATOM 0 HD11 ILE A 345 3.715 -7.467 13.174 1.00 2.33 H new ATOM 0 HD12 ILE A 345 4.354 -8.494 14.480 1.00 2.33 H new ATOM 0 HD13 ILE A 345 5.059 -6.887 14.185 1.00 2.33 H new ATOM 485 N GLY A 346 7.778 -12.097 14.185 1.00 62.23 N ATOM 486 CA GLY A 346 8.914 -12.997 14.272 1.00 21.54 C ATOM 487 C GLY A 346 9.489 -13.337 12.912 1.00 52.24 C ATOM 488 O GLY A 346 8.829 -13.159 11.890 1.00 62.14 O ATOM 0 H GLY A 346 6.919 -12.524 13.839 1.00 62.23 H new ATOM 0 HA2 GLY A 346 9.689 -12.540 14.887 1.00 21.54 H new ATOM 0 HA3 GLY A 346 8.609 -13.915 14.774 1.00 21.54 H new ATOM 492 N ASN A 347 10.724 -13.828 12.899 1.00 33.14 N ATOM 493 CA ASN A 347 11.389 -14.192 11.654 1.00 74.34 C ATOM 494 C ASN A 347 11.937 -12.956 10.947 1.00 30.31 C ATOM 495 O ASN A 347 11.713 -12.761 9.752 1.00 71.13 O ATOM 496 CB ASN A 347 10.418 -14.933 10.731 1.00 42.22 C ATOM 497 CG ASN A 347 11.094 -16.051 9.961 1.00 64.43 C ATOM 498 OD1 ASN A 347 10.936 -17.228 10.287 1.00 14.33 O ATOM 499 ND2 ASN A 347 11.850 -15.688 8.932 1.00 23.32 N ATOM 0 H ASN A 347 11.284 -13.983 13.737 1.00 33.14 H new ATOM 0 HA ASN A 347 12.224 -14.849 11.896 1.00 74.34 H new ATOM 0 HB2 ASN A 347 9.601 -15.345 11.323 1.00 42.22 H new ATOM 0 HB3 ASN A 347 9.977 -14.226 10.028 1.00 42.22 H new ATOM 0 HD21 ASN A 347 12.328 -16.397 8.376 1.00 23.32 H new ATOM 0 HD22 ASN A 347 11.953 -14.701 8.698 1.00 23.32 H new ATOM 506 N ILE A 348 12.656 -12.124 11.694 1.00 11.20 N ATOM 507 CA ILE A 348 13.236 -10.908 11.139 1.00 71.22 C ATOM 508 C ILE A 348 14.734 -11.071 10.904 1.00 31.25 C ATOM 509 O ILE A 348 15.459 -11.629 11.728 1.00 54.34 O ATOM 510 CB ILE A 348 13.001 -9.699 12.064 1.00 34.31 C ATOM 511 CG1 ILE A 348 11.506 -9.514 12.328 1.00 42.50 C ATOM 512 CG2 ILE A 348 13.596 -8.440 11.451 1.00 70.25 C ATOM 513 CD1 ILE A 348 11.206 -8.560 13.463 1.00 32.35 C ATOM 0 H ILE A 348 12.850 -12.270 12.685 1.00 11.20 H new ATOM 0 HA ILE A 348 12.739 -10.728 10.186 1.00 71.22 H new ATOM 0 HB ILE A 348 13.498 -9.886 13.016 1.00 34.31 H new ATOM 0 HG12 ILE A 348 11.028 -9.147 11.420 1.00 42.50 H new ATOM 0 HG13 ILE A 348 11.062 -10.484 12.553 1.00 42.50 H new ATOM 0 HG21 ILE A 348 13.422 -7.594 12.116 1.00 70.25 H new ATOM 0 HG22 ILE A 348 14.668 -8.576 11.310 1.00 70.25 H new ATOM 0 HG23 ILE A 348 13.125 -8.247 10.487 1.00 70.25 H new ATOM 0 HD11 ILE A 348 10.127 -8.477 13.593 1.00 32.35 H new ATOM 0 HD12 ILE A 348 11.655 -8.936 14.382 1.00 32.35 H new ATOM 0 HD13 ILE A 348 11.620 -7.578 13.232 1.00 32.35 H new ATOM 525 N PRO A 349 15.210 -10.573 9.755 1.00 73.53 N ATOM 526 CA PRO A 349 16.627 -10.649 9.385 1.00 10.31 C ATOM 527 C PRO A 349 17.501 -9.748 10.252 1.00 25.14 C ATOM 528 O PRO A 349 17.001 -8.867 10.951 1.00 34.20 O ATOM 529 CB PRO A 349 16.641 -10.169 7.932 1.00 62.15 C ATOM 530 CG PRO A 349 15.436 -9.303 7.807 1.00 44.33 C ATOM 531 CD PRO A 349 14.404 -9.895 8.725 1.00 50.11 C ATOM 0 HA PRO A 349 17.030 -11.653 9.520 1.00 10.31 H new ATOM 0 HB2 PRO A 349 17.552 -9.614 7.707 1.00 62.15 H new ATOM 0 HB3 PRO A 349 16.599 -11.008 7.238 1.00 62.15 H new ATOM 0 HG2 PRO A 349 15.664 -8.275 8.087 1.00 44.33 H new ATOM 0 HG3 PRO A 349 15.076 -9.281 6.778 1.00 44.33 H new ATOM 0 HD2 PRO A 349 13.763 -9.127 9.158 1.00 50.11 H new ATOM 0 HD3 PRO A 349 13.753 -10.594 8.200 1.00 50.11 H new ATOM 539 N HIS A 350 18.810 -9.976 10.201 1.00 53.11 N ATOM 540 CA HIS A 350 19.754 -9.184 10.982 1.00 5.43 C ATOM 541 C HIS A 350 19.957 -7.807 10.355 1.00 43.12 C ATOM 542 O HIS A 350 20.456 -6.887 11.002 1.00 21.30 O ATOM 543 CB HIS A 350 21.095 -9.910 11.090 1.00 41.44 C ATOM 544 CG HIS A 350 22.011 -9.653 9.933 1.00 70.32 C ATOM 545 ND1 HIS A 350 22.926 -8.622 9.912 1.00 41.21 N ATOM 546 CD2 HIS A 350 22.149 -10.301 8.753 1.00 35.33 C ATOM 547 CE1 HIS A 350 23.588 -8.646 8.769 1.00 13.35 C ATOM 548 NE2 HIS A 350 23.136 -9.656 8.047 1.00 51.01 N ATOM 0 H HIS A 350 19.241 -10.702 9.628 1.00 53.11 H new ATOM 0 HA HIS A 350 19.339 -9.052 11.981 1.00 5.43 H new ATOM 0 HB2 HIS A 350 21.591 -9.604 12.011 1.00 41.44 H new ATOM 0 HB3 HIS A 350 20.913 -10.982 11.168 1.00 41.44 H new ATOM 0 HD2 HIS A 350 21.588 -11.164 8.427 1.00 35.33 H new ATOM 0 HE1 HIS A 350 24.366 -7.957 8.475 1.00 13.35 H new ATOM 0 HE2 HIS A 350 23.466 -9.915 7.117 1.00 51.01 H new ATOM 556 N PHE A 351 19.568 -7.676 9.091 1.00 54.45 N ATOM 557 CA PHE A 351 19.709 -6.413 8.375 1.00 43.33 C ATOM 558 C PHE A 351 18.390 -5.646 8.360 1.00 61.03 C ATOM 559 O PHE A 351 18.151 -4.817 7.483 1.00 23.42 O ATOM 560 CB PHE A 351 20.182 -6.664 6.942 1.00 51.13 C ATOM 561 CG PHE A 351 19.112 -7.221 6.046 1.00 53.02 C ATOM 562 CD1 PHE A 351 18.816 -8.574 6.059 1.00 41.23 C ATOM 563 CD2 PHE A 351 18.403 -6.391 5.194 1.00 33.10 C ATOM 564 CE1 PHE A 351 17.834 -9.090 5.235 1.00 30.25 C ATOM 565 CE2 PHE A 351 17.418 -6.901 4.368 1.00 54.23 C ATOM 566 CZ PHE A 351 17.133 -8.252 4.390 1.00 23.33 C ATOM 0 H PHE A 351 19.153 -8.428 8.542 1.00 54.45 H new ATOM 0 HA PHE A 351 20.454 -5.811 8.896 1.00 43.33 H new ATOM 0 HB2 PHE A 351 20.548 -5.728 6.519 1.00 51.13 H new ATOM 0 HB3 PHE A 351 21.024 -7.355 6.962 1.00 51.13 H new ATOM 0 HD1 PHE A 351 19.359 -9.233 6.720 1.00 41.23 H new ATOM 0 HD2 PHE A 351 18.622 -5.334 5.174 1.00 33.10 H new ATOM 0 HE1 PHE A 351 17.615 -10.147 5.252 1.00 30.25 H new ATOM 0 HE2 PHE A 351 16.873 -6.244 3.707 1.00 54.23 H new ATOM 0 HZ PHE A 351 16.363 -8.653 3.747 1.00 23.33 H new ATOM 576 N ALA A 352 17.536 -5.930 9.338 1.00 41.44 N ATOM 577 CA ALA A 352 16.242 -5.268 9.440 1.00 33.11 C ATOM 578 C ALA A 352 16.218 -4.282 10.603 1.00 13.43 C ATOM 579 O ALA A 352 15.925 -4.655 11.740 1.00 10.00 O ATOM 580 CB ALA A 352 15.132 -6.297 9.593 1.00 1.11 C ATOM 0 H ALA A 352 17.718 -6.615 10.072 1.00 41.44 H new ATOM 0 HA ALA A 352 16.077 -4.707 8.520 1.00 33.11 H new ATOM 0 HB1 ALA A 352 14.171 -5.787 9.668 1.00 1.11 H new ATOM 0 HB2 ALA A 352 15.126 -6.957 8.726 1.00 1.11 H new ATOM 0 HB3 ALA A 352 15.302 -6.885 10.495 1.00 1.11 H new ATOM 586 N THR A 353 16.531 -3.023 10.314 1.00 11.34 N ATOM 587 CA THR A 353 16.547 -1.986 11.337 1.00 22.41 C ATOM 588 C THR A 353 15.188 -1.305 11.452 1.00 44.10 C ATOM 589 O THR A 353 14.286 -1.564 10.657 1.00 2.35 O ATOM 590 CB THR A 353 17.619 -0.919 11.039 1.00 15.44 C ATOM 591 OG1 THR A 353 17.418 -0.377 9.729 1.00 4.31 O ATOM 592 CG2 THR A 353 19.016 -1.513 11.140 1.00 72.34 C ATOM 0 H THR A 353 16.777 -2.697 9.379 1.00 11.34 H new ATOM 0 HA THR A 353 16.785 -2.477 12.280 1.00 22.41 H new ATOM 0 HB THR A 353 17.526 -0.124 11.779 1.00 15.44 H new ATOM 0 HG1 THR A 353 18.102 0.301 9.547 1.00 4.31 H new ATOM 0 HG21 THR A 353 19.756 -0.742 10.926 1.00 72.34 H new ATOM 0 HG22 THR A 353 19.175 -1.899 12.147 1.00 72.34 H new ATOM 0 HG23 THR A 353 19.119 -2.325 10.420 1.00 72.34 H new ATOM 600 N GLU A 354 15.050 -0.434 12.446 1.00 54.41 N ATOM 601 CA GLU A 354 13.799 0.284 12.665 1.00 32.45 C ATOM 602 C GLU A 354 13.523 1.255 11.520 1.00 1.42 C ATOM 603 O GLU A 354 12.370 1.541 11.200 1.00 40.33 O ATOM 604 CB GLU A 354 13.846 1.043 13.992 1.00 33.33 C ATOM 605 CG GLU A 354 14.929 0.552 14.937 1.00 11.13 C ATOM 606 CD GLU A 354 16.270 1.214 14.682 1.00 12.52 C ATOM 607 OE1 GLU A 354 16.309 2.459 14.604 1.00 43.12 O ATOM 608 OE2 GLU A 354 17.278 0.487 14.561 1.00 73.51 O ATOM 0 H GLU A 354 15.788 -0.208 13.112 1.00 54.41 H new ATOM 0 HA GLU A 354 12.991 -0.447 12.702 1.00 32.45 H new ATOM 0 HB2 GLU A 354 14.005 2.102 13.789 1.00 33.33 H new ATOM 0 HB3 GLU A 354 12.878 0.955 14.485 1.00 33.33 H new ATOM 0 HG2 GLU A 354 14.623 0.744 15.965 1.00 11.13 H new ATOM 0 HG3 GLU A 354 15.035 -0.528 14.832 1.00 11.13 H new ATOM 615 N ALA A 355 14.589 1.758 10.908 1.00 32.22 N ATOM 616 CA ALA A 355 14.463 2.695 9.799 1.00 54.04 C ATOM 617 C ALA A 355 13.612 2.108 8.678 1.00 63.43 C ATOM 618 O ALA A 355 12.996 2.840 7.905 1.00 74.32 O ATOM 619 CB ALA A 355 15.837 3.081 9.274 1.00 23.53 C ATOM 0 H ALA A 355 15.551 1.532 11.162 1.00 32.22 H new ATOM 0 HA ALA A 355 13.963 3.590 10.168 1.00 54.04 H new ATOM 0 HB1 ALA A 355 15.727 3.781 8.446 1.00 23.53 H new ATOM 0 HB2 ALA A 355 16.413 3.550 10.072 1.00 23.53 H new ATOM 0 HB3 ALA A 355 16.358 2.189 8.927 1.00 23.53 H new ATOM 625 N ASP A 356 13.584 0.782 8.596 1.00 50.22 N ATOM 626 CA ASP A 356 12.808 0.096 7.570 1.00 11.21 C ATOM 627 C ASP A 356 11.633 -0.655 8.188 1.00 34.02 C ATOM 628 O ASP A 356 10.720 -1.088 7.485 1.00 32.05 O ATOM 629 CB ASP A 356 13.698 -0.874 6.792 1.00 63.31 C ATOM 630 CG ASP A 356 13.965 -0.406 5.375 1.00 14.15 C ATOM 631 OD1 ASP A 356 14.293 0.786 5.197 1.00 71.35 O ATOM 632 OD2 ASP A 356 13.847 -1.230 4.445 1.00 41.42 O ATOM 0 H ASP A 356 14.090 0.161 9.228 1.00 50.22 H new ATOM 0 HA ASP A 356 12.415 0.846 6.884 1.00 11.21 H new ATOM 0 HB2 ASP A 356 14.646 -0.993 7.317 1.00 63.31 H new ATOM 0 HB3 ASP A 356 13.224 -1.855 6.764 1.00 63.31 H new ATOM 637 N LEU A 357 11.663 -0.808 9.507 1.00 22.44 N ATOM 638 CA LEU A 357 10.601 -1.509 10.221 1.00 23.34 C ATOM 639 C LEU A 357 9.610 -0.522 10.827 1.00 42.24 C ATOM 640 O LEU A 357 8.405 -0.608 10.583 1.00 0.05 O ATOM 641 CB LEU A 357 11.195 -2.392 11.320 1.00 51.35 C ATOM 642 CG LEU A 357 11.408 -3.862 10.958 1.00 3.30 C ATOM 643 CD1 LEU A 357 12.701 -4.037 10.176 1.00 32.12 C ATOM 644 CD2 LEU A 357 11.421 -4.724 12.212 1.00 23.41 C ATOM 0 H LEU A 357 12.411 -0.456 10.104 1.00 22.44 H new ATOM 0 HA LEU A 357 10.069 -2.137 9.506 1.00 23.34 H new ATOM 0 HB2 LEU A 357 12.154 -1.970 11.619 1.00 51.35 H new ATOM 0 HB3 LEU A 357 10.540 -2.344 12.190 1.00 51.35 H new ATOM 0 HG LEU A 357 10.579 -4.185 10.328 1.00 3.30 H new ATOM 0 HD11 LEU A 357 12.836 -5.090 9.927 1.00 32.12 H new ATOM 0 HD12 LEU A 357 12.654 -3.450 9.259 1.00 32.12 H new ATOM 0 HD13 LEU A 357 13.541 -3.697 10.781 1.00 32.12 H new ATOM 0 HD21 LEU A 357 11.574 -5.767 11.935 1.00 23.41 H new ATOM 0 HD22 LEU A 357 12.230 -4.401 12.867 1.00 23.41 H new ATOM 0 HD23 LEU A 357 10.469 -4.623 12.733 1.00 23.41 H new ATOM 656 N ILE A 358 10.123 0.417 11.615 1.00 50.43 N ATOM 657 CA ILE A 358 9.282 1.423 12.253 1.00 3.43 C ATOM 658 C ILE A 358 8.205 1.925 11.298 1.00 4.25 C ATOM 659 O ILE A 358 7.017 1.943 11.616 1.00 30.41 O ATOM 660 CB ILE A 358 10.114 2.621 12.747 1.00 42.34 C ATOM 661 CG1 ILE A 358 10.964 2.218 13.953 1.00 70.44 C ATOM 662 CG2 ILE A 358 9.204 3.788 13.098 1.00 10.02 C ATOM 663 CD1 ILE A 358 10.447 2.766 15.266 1.00 22.43 C ATOM 0 H ILE A 358 11.117 0.502 11.827 1.00 50.43 H new ATOM 0 HA ILE A 358 8.809 0.942 13.109 1.00 3.43 H new ATOM 0 HB ILE A 358 10.783 2.935 11.946 1.00 42.34 H new ATOM 0 HG12 ILE A 358 11.003 1.130 14.013 1.00 70.44 H new ATOM 0 HG13 ILE A 358 11.986 2.566 13.800 1.00 70.44 H new ATOM 0 HG21 ILE A 358 9.806 4.627 13.446 1.00 10.02 H new ATOM 0 HG22 ILE A 358 8.639 4.088 12.215 1.00 10.02 H new ATOM 0 HG23 ILE A 358 8.513 3.487 13.885 1.00 10.02 H new ATOM 0 HD11 ILE A 358 11.098 2.441 16.078 1.00 22.43 H new ATOM 0 HD12 ILE A 358 10.434 3.855 15.226 1.00 22.43 H new ATOM 0 HD13 ILE A 358 9.436 2.397 15.442 1.00 22.43 H new ATOM 675 N PRO A 359 8.629 2.340 10.094 1.00 70.32 N ATOM 676 CA PRO A 359 7.716 2.849 9.066 1.00 61.50 C ATOM 677 C PRO A 359 6.830 1.752 8.484 1.00 13.22 C ATOM 678 O PRO A 359 5.675 1.994 8.131 1.00 40.43 O ATOM 679 CB PRO A 359 8.660 3.399 7.994 1.00 61.24 C ATOM 680 CG PRO A 359 9.924 2.632 8.173 1.00 52.22 C ATOM 681 CD PRO A 359 10.031 2.347 9.646 1.00 62.15 C ATOM 0 HA PRO A 359 7.025 3.591 9.466 1.00 61.50 H new ATOM 0 HB2 PRO A 359 8.249 3.257 6.994 1.00 61.24 H new ATOM 0 HB3 PRO A 359 8.825 4.469 8.122 1.00 61.24 H new ATOM 0 HG2 PRO A 359 9.904 1.707 7.597 1.00 52.22 H new ATOM 0 HG3 PRO A 359 10.782 3.206 7.823 1.00 52.22 H new ATOM 0 HD2 PRO A 359 10.518 1.391 9.836 1.00 62.15 H new ATOM 0 HD3 PRO A 359 10.614 3.110 10.162 1.00 62.15 H new ATOM 689 N LEU A 360 7.378 0.546 8.385 1.00 51.15 N ATOM 690 CA LEU A 360 6.638 -0.589 7.846 1.00 34.31 C ATOM 691 C LEU A 360 5.406 -0.889 8.694 1.00 24.01 C ATOM 692 O LEU A 360 4.440 -1.483 8.216 1.00 55.33 O ATOM 693 CB LEU A 360 7.538 -1.824 7.778 1.00 33.24 C ATOM 694 CG LEU A 360 6.829 -3.177 7.877 1.00 4.11 C ATOM 695 CD1 LEU A 360 6.279 -3.391 9.278 1.00 2.24 C ATOM 696 CD2 LEU A 360 5.716 -3.271 6.844 1.00 63.20 C ATOM 0 H LEU A 360 8.333 0.329 8.671 1.00 51.15 H new ATOM 0 HA LEU A 360 6.309 -0.331 6.839 1.00 34.31 H new ATOM 0 HB2 LEU A 360 8.092 -1.794 6.840 1.00 33.24 H new ATOM 0 HB3 LEU A 360 8.270 -1.760 8.583 1.00 33.24 H new ATOM 0 HG LEU A 360 7.556 -3.963 7.672 1.00 4.11 H new ATOM 0 HD11 LEU A 360 5.779 -4.358 9.329 1.00 2.24 H new ATOM 0 HD12 LEU A 360 7.097 -3.368 9.998 1.00 2.24 H new ATOM 0 HD13 LEU A 360 5.566 -2.601 9.514 1.00 2.24 H new ATOM 0 HD21 LEU A 360 5.222 -4.239 6.928 1.00 63.20 H new ATOM 0 HD22 LEU A 360 4.990 -2.477 7.018 1.00 63.20 H new ATOM 0 HD23 LEU A 360 6.137 -3.164 5.844 1.00 63.20 H new ATOM 708 N PHE A 361 5.447 -0.470 9.955 1.00 50.54 N ATOM 709 CA PHE A 361 4.333 -0.692 10.870 1.00 62.32 C ATOM 710 C PHE A 361 3.520 0.585 11.058 1.00 13.41 C ATOM 711 O PHE A 361 2.303 0.538 11.233 1.00 62.54 O ATOM 712 CB PHE A 361 4.849 -1.186 12.224 1.00 20.53 C ATOM 713 CG PHE A 361 5.621 -2.470 12.139 1.00 64.41 C ATOM 714 CD1 PHE A 361 4.969 -3.674 11.924 1.00 73.33 C ATOM 715 CD2 PHE A 361 7.000 -2.475 12.274 1.00 42.33 C ATOM 716 CE1 PHE A 361 5.677 -4.858 11.845 1.00 3.14 C ATOM 717 CE2 PHE A 361 7.715 -3.656 12.195 1.00 11.31 C ATOM 718 CZ PHE A 361 7.052 -4.849 11.982 1.00 14.14 C ATOM 0 H PHE A 361 6.239 0.025 10.366 1.00 50.54 H new ATOM 0 HA PHE A 361 3.685 -1.453 10.436 1.00 62.32 H new ATOM 0 HB2 PHE A 361 5.485 -0.418 12.664 1.00 20.53 H new ATOM 0 HB3 PHE A 361 4.003 -1.324 12.898 1.00 20.53 H new ATOM 0 HD1 PHE A 361 3.894 -3.687 11.817 1.00 73.33 H new ATOM 0 HD2 PHE A 361 7.523 -1.545 12.443 1.00 42.33 H new ATOM 0 HE1 PHE A 361 5.156 -5.789 11.676 1.00 3.14 H new ATOM 0 HE2 PHE A 361 8.790 -3.646 12.300 1.00 11.31 H new ATOM 0 HZ PHE A 361 7.607 -5.773 11.923 1.00 14.14 H new ATOM 728 N GLN A 362 4.204 1.725 11.020 1.00 32.13 N ATOM 729 CA GLN A 362 3.545 3.015 11.187 1.00 35.24 C ATOM 730 C GLN A 362 2.472 3.222 10.123 1.00 13.00 C ATOM 731 O GLN A 362 1.452 3.861 10.373 1.00 65.52 O ATOM 732 CB GLN A 362 4.571 4.147 11.121 1.00 61.13 C ATOM 733 CG GLN A 362 4.661 4.964 12.400 1.00 4.43 C ATOM 734 CD GLN A 362 4.848 6.445 12.135 1.00 42.12 C ATOM 735 OE1 GLN A 362 3.879 7.203 12.067 1.00 60.30 O ATOM 736 NE2 GLN A 362 6.098 6.866 11.983 1.00 41.53 N ATOM 0 H GLN A 362 5.212 1.781 10.875 1.00 32.13 H new ATOM 0 HA GLN A 362 3.065 3.025 12.166 1.00 35.24 H new ATOM 0 HB2 GLN A 362 5.551 3.725 10.900 1.00 61.13 H new ATOM 0 HB3 GLN A 362 4.316 4.810 10.294 1.00 61.13 H new ATOM 0 HG2 GLN A 362 3.754 4.815 12.986 1.00 4.43 H new ATOM 0 HG3 GLN A 362 5.493 4.599 13.002 1.00 4.43 H new ATOM 0 HE21 GLN A 362 6.871 6.203 12.047 1.00 41.53 H new ATOM 0 HE22 GLN A 362 6.286 7.852 11.802 1.00 41.53 H new ATOM 745 N ASN A 363 2.712 2.676 8.935 1.00 61.03 N ATOM 746 CA ASN A 363 1.767 2.801 7.832 1.00 40.11 C ATOM 747 C ASN A 363 0.411 2.208 8.206 1.00 1.24 C ATOM 748 O ASN A 363 -0.578 2.396 7.498 1.00 70.13 O ATOM 749 CB ASN A 363 2.313 2.103 6.583 1.00 41.02 C ATOM 750 CG ASN A 363 2.034 0.613 6.585 1.00 11.21 C ATOM 751 OD1 ASN A 363 2.494 -0.074 7.624 1.00 43.21 O flip ATOM 752 ND2 ASN A 363 1.411 0.086 5.662 1.00 72.31 N flip ATOM 0 H ASN A 363 3.553 2.143 8.712 1.00 61.03 H new ATOM 0 HA ASN A 363 1.634 3.862 7.620 1.00 40.11 H new ATOM 0 HB2 ASN A 363 1.868 2.552 5.695 1.00 41.02 H new ATOM 0 HB3 ASN A 363 3.388 2.268 6.519 1.00 41.02 H new ATOM 0 HD21 ASN A 363 1.076 0.653 4.883 1.00 72.31 H new ATOM 0 HD22 ASN A 363 1.230 -0.918 5.677 1.00 72.31 H new ATOM 759 N PHE A 364 0.374 1.492 9.326 1.00 13.01 N ATOM 760 CA PHE A 364 -0.859 0.872 9.795 1.00 1.33 C ATOM 761 C PHE A 364 -1.733 1.886 10.527 1.00 73.03 C ATOM 762 O PHE A 364 -2.867 2.150 10.126 1.00 11.31 O ATOM 763 CB PHE A 364 -0.543 -0.306 10.719 1.00 73.33 C ATOM 764 CG PHE A 364 0.028 -1.495 10.000 1.00 53.05 C ATOM 765 CD1 PHE A 364 -0.637 -2.053 8.920 1.00 4.31 C ATOM 766 CD2 PHE A 364 1.228 -2.055 10.405 1.00 53.14 C ATOM 767 CE1 PHE A 364 -0.115 -3.147 8.255 1.00 4.31 C ATOM 768 CE2 PHE A 364 1.756 -3.149 9.744 1.00 13.23 C ATOM 769 CZ PHE A 364 1.083 -3.696 8.669 1.00 61.14 C ATOM 0 H PHE A 364 1.183 1.327 9.925 1.00 13.01 H new ATOM 0 HA PHE A 364 -1.406 0.507 8.926 1.00 1.33 H new ATOM 0 HB2 PHE A 364 0.163 0.021 11.482 1.00 73.33 H new ATOM 0 HB3 PHE A 364 -1.454 -0.607 11.236 1.00 73.33 H new ATOM 0 HD1 PHE A 364 -1.575 -1.628 8.594 1.00 4.31 H new ATOM 0 HD2 PHE A 364 1.757 -1.633 11.246 1.00 53.14 H new ATOM 0 HE1 PHE A 364 -0.643 -3.571 7.414 1.00 4.31 H new ATOM 0 HE2 PHE A 364 2.694 -3.575 10.068 1.00 13.23 H new ATOM 0 HZ PHE A 364 1.493 -4.552 8.153 1.00 61.14 H new ATOM 779 N GLY A 365 -1.198 2.452 11.605 1.00 3.51 N ATOM 780 CA GLY A 365 -1.942 3.430 12.377 1.00 11.44 C ATOM 781 C GLY A 365 -1.042 4.462 13.027 1.00 4.31 C ATOM 782 O GLY A 365 -0.841 5.550 12.487 1.00 32.11 O ATOM 0 H GLY A 365 -0.262 2.250 11.957 1.00 3.51 H new ATOM 0 HA2 GLY A 365 -2.657 3.934 11.727 1.00 11.44 H new ATOM 0 HA3 GLY A 365 -2.518 2.918 13.148 1.00 11.44 H new ATOM 786 N PHE A 366 -0.499 4.121 14.191 1.00 23.34 N ATOM 787 CA PHE A 366 0.381 5.028 14.918 1.00 63.33 C ATOM 788 C PHE A 366 1.364 4.250 15.788 1.00 74.52 C ATOM 789 O PHE A 366 1.022 3.211 16.354 1.00 62.03 O ATOM 790 CB PHE A 366 -0.438 5.984 15.786 1.00 25.11 C ATOM 791 CG PHE A 366 0.364 7.123 16.346 1.00 25.55 C ATOM 792 CD1 PHE A 366 1.165 7.896 15.521 1.00 61.10 C ATOM 793 CD2 PHE A 366 0.318 7.422 17.699 1.00 13.52 C ATOM 794 CE1 PHE A 366 1.905 8.944 16.034 1.00 42.23 C ATOM 795 CE2 PHE A 366 1.056 8.469 18.218 1.00 42.32 C ATOM 796 CZ PHE A 366 1.850 9.232 17.384 1.00 3.24 C ATOM 0 H PHE A 366 -0.653 3.224 14.651 1.00 23.34 H new ATOM 0 HA PHE A 366 0.947 5.607 14.188 1.00 63.33 H new ATOM 0 HB2 PHE A 366 -1.260 6.386 15.193 1.00 25.11 H new ATOM 0 HB3 PHE A 366 -0.882 5.424 16.609 1.00 25.11 H new ATOM 0 HD1 PHE A 366 1.211 7.677 14.465 1.00 61.10 H new ATOM 0 HD2 PHE A 366 -0.302 6.830 18.355 1.00 13.52 H new ATOM 0 HE1 PHE A 366 2.526 9.538 15.380 1.00 42.23 H new ATOM 0 HE2 PHE A 366 1.012 8.690 19.274 1.00 42.32 H new ATOM 0 HZ PHE A 366 2.426 10.052 17.786 1.00 3.24 H new ATOM 806 N ILE A 367 2.588 4.759 15.890 1.00 44.53 N ATOM 807 CA ILE A 367 3.620 4.113 16.690 1.00 23.13 C ATOM 808 C ILE A 367 4.132 5.045 17.783 1.00 52.44 C ATOM 809 O ILE A 367 4.824 6.026 17.504 1.00 74.31 O ATOM 810 CB ILE A 367 4.807 3.661 15.819 1.00 74.43 C ATOM 811 CG1 ILE A 367 4.339 2.658 14.762 1.00 41.31 C ATOM 812 CG2 ILE A 367 5.899 3.054 16.687 1.00 75.02 C ATOM 813 CD1 ILE A 367 5.459 2.131 13.892 1.00 20.21 C ATOM 0 H ILE A 367 2.888 5.617 15.428 1.00 44.53 H new ATOM 0 HA ILE A 367 3.162 3.237 17.148 1.00 23.13 H new ATOM 0 HB ILE A 367 5.218 4.532 15.309 1.00 74.43 H new ATOM 0 HG12 ILE A 367 3.851 1.820 15.259 1.00 41.31 H new ATOM 0 HG13 ILE A 367 3.590 3.133 14.128 1.00 41.31 H new ATOM 0 HG21 ILE A 367 6.731 2.739 16.057 1.00 75.02 H new ATOM 0 HG22 ILE A 367 6.248 3.796 17.405 1.00 75.02 H new ATOM 0 HG23 ILE A 367 5.502 2.191 17.221 1.00 75.02 H new ATOM 0 HD11 ILE A 367 5.055 1.426 13.166 1.00 20.21 H new ATOM 0 HD12 ILE A 367 5.933 2.960 13.367 1.00 20.21 H new ATOM 0 HD13 ILE A 367 6.197 1.627 14.515 1.00 20.21 H new ATOM 825 N LEU A 368 3.789 4.734 19.027 1.00 35.13 N ATOM 826 CA LEU A 368 4.216 5.542 20.165 1.00 12.12 C ATOM 827 C LEU A 368 5.525 5.017 20.746 1.00 62.13 C ATOM 828 O LEU A 368 6.217 5.722 21.480 1.00 74.24 O ATOM 829 CB LEU A 368 3.133 5.552 21.244 1.00 24.14 C ATOM 830 CG LEU A 368 1.687 5.538 20.744 1.00 3.24 C ATOM 831 CD1 LEU A 368 1.065 4.166 20.947 1.00 41.50 C ATOM 832 CD2 LEU A 368 0.868 6.607 21.454 1.00 64.12 C ATOM 0 H LEU A 368 3.216 3.927 19.275 1.00 35.13 H new ATOM 0 HA LEU A 368 4.379 6.561 19.814 1.00 12.12 H new ATOM 0 HB2 LEU A 368 3.282 4.685 21.888 1.00 24.14 H new ATOM 0 HB3 LEU A 368 3.274 6.438 21.864 1.00 24.14 H new ATOM 0 HG LEU A 368 1.689 5.758 19.677 1.00 3.24 H new ATOM 0 HD11 LEU A 368 0.037 4.176 20.585 1.00 41.50 H new ATOM 0 HD12 LEU A 368 1.637 3.422 20.394 1.00 41.50 H new ATOM 0 HD13 LEU A 368 1.074 3.916 22.008 1.00 41.50 H new ATOM 0 HD21 LEU A 368 -0.158 6.583 21.086 1.00 64.12 H new ATOM 0 HD22 LEU A 368 0.874 6.417 22.527 1.00 64.12 H new ATOM 0 HD23 LEU A 368 1.301 7.588 21.257 1.00 64.12 H new ATOM 844 N ASP A 369 5.859 3.776 20.409 1.00 72.34 N ATOM 845 CA ASP A 369 7.088 3.157 20.895 1.00 42.30 C ATOM 846 C ASP A 369 7.340 1.827 20.194 1.00 2.44 C ATOM 847 O ASP A 369 6.514 0.914 20.255 1.00 72.12 O ATOM 848 CB ASP A 369 7.013 2.946 22.408 1.00 12.23 C ATOM 849 CG ASP A 369 8.119 3.670 23.149 1.00 4.24 C ATOM 850 OD1 ASP A 369 8.086 4.917 23.194 1.00 23.41 O ATOM 851 OD2 ASP A 369 9.019 2.989 23.684 1.00 25.21 O ATOM 0 H ASP A 369 5.297 3.179 19.802 1.00 72.34 H new ATOM 0 HA ASP A 369 7.918 3.827 20.671 1.00 42.30 H new ATOM 0 HB2 ASP A 369 6.047 3.294 22.773 1.00 12.23 H new ATOM 0 HB3 ASP A 369 7.071 1.880 22.626 1.00 12.23 H new ATOM 856 N PHE A 370 8.484 1.722 19.526 1.00 43.30 N ATOM 857 CA PHE A 370 8.844 0.504 18.812 1.00 3.33 C ATOM 858 C PHE A 370 10.054 -0.167 19.454 1.00 22.15 C ATOM 859 O PHE A 370 10.971 0.503 19.929 1.00 61.11 O ATOM 860 CB PHE A 370 9.140 0.817 17.343 1.00 63.45 C ATOM 861 CG PHE A 370 9.572 -0.383 16.550 1.00 2.14 C ATOM 862 CD1 PHE A 370 8.790 -1.526 16.514 1.00 41.31 C ATOM 863 CD2 PHE A 370 10.762 -0.368 15.839 1.00 23.24 C ATOM 864 CE1 PHE A 370 9.186 -2.631 15.786 1.00 30.45 C ATOM 865 CE2 PHE A 370 11.163 -1.471 15.108 1.00 41.31 C ATOM 866 CZ PHE A 370 10.373 -2.603 15.081 1.00 42.23 C ATOM 0 H PHE A 370 9.178 2.467 19.465 1.00 43.30 H new ATOM 0 HA PHE A 370 7.999 -0.182 18.868 1.00 3.33 H new ATOM 0 HB2 PHE A 370 8.248 1.244 16.884 1.00 63.45 H new ATOM 0 HB3 PHE A 370 9.920 1.577 17.292 1.00 63.45 H new ATOM 0 HD1 PHE A 370 7.860 -1.553 17.062 1.00 41.31 H new ATOM 0 HD2 PHE A 370 11.383 0.515 15.856 1.00 23.24 H new ATOM 0 HE1 PHE A 370 8.568 -3.516 15.768 1.00 30.45 H new ATOM 0 HE2 PHE A 370 12.093 -1.447 14.559 1.00 41.31 H new ATOM 0 HZ PHE A 370 10.683 -3.465 14.509 1.00 42.23 H new ATOM 876 N LYS A 371 10.050 -1.496 19.466 1.00 1.32 N ATOM 877 CA LYS A 371 11.146 -2.260 20.049 1.00 10.10 C ATOM 878 C LYS A 371 11.609 -3.360 19.100 1.00 64.11 C ATOM 879 O LYS A 371 10.977 -4.412 18.997 1.00 12.01 O ATOM 880 CB LYS A 371 10.715 -2.871 21.384 1.00 10.34 C ATOM 881 CG LYS A 371 11.598 -2.468 22.553 1.00 75.45 C ATOM 882 CD LYS A 371 11.366 -1.020 22.952 1.00 21.41 C ATOM 883 CE LYS A 371 12.553 -0.143 22.584 1.00 75.02 C ATOM 884 NZ LYS A 371 12.842 0.869 23.637 1.00 70.31 N ATOM 0 H LYS A 371 9.299 -2.066 19.078 1.00 1.32 H new ATOM 0 HA LYS A 371 11.979 -1.579 20.220 1.00 10.10 H new ATOM 0 HB2 LYS A 371 9.688 -2.572 21.596 1.00 10.34 H new ATOM 0 HB3 LYS A 371 10.719 -3.957 21.295 1.00 10.34 H new ATOM 0 HG2 LYS A 371 11.396 -3.118 23.404 1.00 75.45 H new ATOM 0 HG3 LYS A 371 12.645 -2.610 22.285 1.00 75.45 H new ATOM 0 HD2 LYS A 371 10.469 -0.645 22.459 1.00 21.41 H new ATOM 0 HD3 LYS A 371 11.188 -0.961 24.026 1.00 21.41 H new ATOM 0 HE2 LYS A 371 13.433 -0.768 22.430 1.00 75.02 H new ATOM 0 HE3 LYS A 371 12.352 0.363 21.640 1.00 75.02 H new ATOM 0 HZ1 LYS A 371 13.657 1.447 23.349 1.00 70.31 H new ATOM 0 HZ2 LYS A 371 12.012 1.482 23.767 1.00 70.31 H new ATOM 0 HZ3 LYS A 371 13.059 0.386 24.532 1.00 70.31 H new ATOM 898 N HIS A 372 12.717 -3.111 18.408 1.00 1.11 N ATOM 899 CA HIS A 372 13.265 -4.083 17.468 1.00 63.43 C ATOM 900 C HIS A 372 14.333 -4.941 18.137 1.00 13.31 C ATOM 901 O HIS A 372 15.391 -4.444 18.524 1.00 4.42 O ATOM 902 CB HIS A 372 13.855 -3.369 16.251 1.00 24.30 C ATOM 903 CG HIS A 372 14.738 -4.242 15.415 1.00 33.22 C ATOM 904 ND1 HIS A 372 16.076 -3.980 15.207 1.00 32.41 N ATOM 905 CD2 HIS A 372 14.469 -5.381 14.734 1.00 52.12 C ATOM 906 CE1 HIS A 372 16.591 -4.919 14.432 1.00 4.15 C ATOM 907 NE2 HIS A 372 15.637 -5.781 14.132 1.00 4.54 N ATOM 0 H HIS A 372 13.252 -2.246 18.480 1.00 1.11 H new ATOM 0 HA HIS A 372 12.454 -4.734 17.140 1.00 63.43 H new ATOM 0 HB2 HIS A 372 13.041 -2.990 15.632 1.00 24.30 H new ATOM 0 HB3 HIS A 372 14.427 -2.505 16.589 1.00 24.30 H new ATOM 0 HD2 HIS A 372 13.514 -5.882 14.675 1.00 52.12 H new ATOM 0 HE1 HIS A 372 17.618 -4.972 14.101 1.00 4.15 H new ATOM 0 HE2 HIS A 372 15.749 -6.610 13.548 1.00 4.54 H new ATOM 915 N TYR A 373 14.051 -6.233 18.268 1.00 13.52 N ATOM 916 CA TYR A 373 14.987 -7.161 18.893 1.00 64.53 C ATOM 917 C TYR A 373 15.621 -8.078 17.851 1.00 13.11 C ATOM 918 O TYR A 373 15.175 -9.203 17.624 1.00 63.33 O ATOM 919 CB TYR A 373 14.275 -7.995 19.959 1.00 51.12 C ATOM 920 CG TYR A 373 14.067 -7.260 21.263 1.00 42.53 C ATOM 921 CD1 TYR A 373 13.079 -6.291 21.387 1.00 21.10 C ATOM 922 CD2 TYR A 373 14.855 -7.538 22.373 1.00 24.01 C ATOM 923 CE1 TYR A 373 12.885 -5.617 22.577 1.00 34.15 C ATOM 924 CE2 TYR A 373 14.668 -6.869 23.567 1.00 33.32 C ATOM 925 CZ TYR A 373 13.682 -5.910 23.665 1.00 10.45 C ATOM 926 OH TYR A 373 13.491 -5.240 24.852 1.00 71.14 O ATOM 0 H TYR A 373 13.182 -6.661 17.950 1.00 13.52 H new ATOM 0 HA TYR A 373 15.777 -6.578 19.366 1.00 64.53 H new ATOM 0 HB2 TYR A 373 13.307 -8.313 19.573 1.00 51.12 H new ATOM 0 HB3 TYR A 373 14.855 -8.898 20.149 1.00 51.12 H new ATOM 0 HD1 TYR A 373 12.452 -6.061 20.538 1.00 21.10 H new ATOM 0 HD2 TYR A 373 15.627 -8.290 22.301 1.00 24.01 H new ATOM 0 HE1 TYR A 373 12.114 -4.865 22.656 1.00 34.15 H new ATOM 0 HE2 TYR A 373 15.291 -7.096 24.420 1.00 33.32 H new ATOM 0 HH TYR A 373 14.133 -5.565 25.518 1.00 71.14 H new ATOM 936 N PRO A 374 16.688 -7.587 17.204 1.00 42.31 N ATOM 937 CA PRO A 374 17.408 -8.345 16.177 1.00 22.13 C ATOM 938 C PRO A 374 18.182 -9.523 16.761 1.00 15.51 C ATOM 939 O PRO A 374 18.395 -10.531 16.088 1.00 5.21 O ATOM 940 CB PRO A 374 18.371 -7.314 15.584 1.00 25.04 C ATOM 941 CG PRO A 374 18.574 -6.316 16.671 1.00 42.43 C ATOM 942 CD PRO A 374 17.274 -6.254 17.424 1.00 10.23 C ATOM 0 HA PRO A 374 16.730 -8.785 15.446 1.00 22.13 H new ATOM 0 HB2 PRO A 374 19.313 -7.776 15.290 1.00 25.04 H new ATOM 0 HB3 PRO A 374 17.952 -6.848 14.692 1.00 25.04 H new ATOM 0 HG2 PRO A 374 19.391 -6.615 17.327 1.00 42.43 H new ATOM 0 HG3 PRO A 374 18.835 -5.340 16.261 1.00 42.43 H new ATOM 0 HD2 PRO A 374 17.433 -6.055 18.484 1.00 10.23 H new ATOM 0 HD3 PRO A 374 16.627 -5.463 17.044 1.00 10.23 H new ATOM 950 N GLU A 375 18.598 -9.387 18.016 1.00 72.12 N ATOM 951 CA GLU A 375 19.348 -10.441 18.689 1.00 22.24 C ATOM 952 C GLU A 375 18.504 -11.704 18.832 1.00 5.00 C ATOM 953 O GLU A 375 19.031 -12.798 19.035 1.00 43.35 O ATOM 954 CB GLU A 375 19.811 -9.965 20.068 1.00 10.41 C ATOM 955 CG GLU A 375 18.679 -9.482 20.958 1.00 45.54 C ATOM 956 CD GLU A 375 19.076 -8.293 21.811 1.00 63.13 C ATOM 957 OE1 GLU A 375 19.731 -8.504 22.854 1.00 22.13 O ATOM 958 OE2 GLU A 375 18.730 -7.153 21.439 1.00 12.00 O ATOM 0 H GLU A 375 18.429 -8.559 18.587 1.00 72.12 H new ATOM 0 HA GLU A 375 20.221 -10.676 18.080 1.00 22.24 H new ATOM 0 HB2 GLU A 375 20.332 -10.781 20.568 1.00 10.41 H new ATOM 0 HB3 GLU A 375 20.532 -9.157 19.941 1.00 10.41 H new ATOM 0 HG2 GLU A 375 17.825 -9.211 20.338 1.00 45.54 H new ATOM 0 HG3 GLU A 375 18.357 -10.298 21.605 1.00 45.54 H new ATOM 965 N LYS A 376 17.189 -11.544 18.725 1.00 14.11 N ATOM 966 CA LYS A 376 16.269 -12.670 18.840 1.00 32.20 C ATOM 967 C LYS A 376 15.472 -12.856 17.554 1.00 53.33 C ATOM 968 O LYS A 376 14.953 -13.938 17.285 1.00 42.31 O ATOM 969 CB LYS A 376 15.315 -12.456 20.018 1.00 34.14 C ATOM 970 CG LYS A 376 16.023 -12.277 21.350 1.00 5.04 C ATOM 971 CD LYS A 376 15.380 -13.114 22.442 1.00 15.21 C ATOM 972 CE LYS A 376 15.950 -14.523 22.473 1.00 3.34 C ATOM 973 NZ LYS A 376 16.483 -14.877 23.817 1.00 3.44 N ATOM 0 H LYS A 376 16.736 -10.645 18.559 1.00 14.11 H new ATOM 0 HA LYS A 376 16.857 -13.571 19.015 1.00 32.20 H new ATOM 0 HB2 LYS A 376 14.700 -11.577 19.822 1.00 34.14 H new ATOM 0 HB3 LYS A 376 14.639 -13.309 20.087 1.00 34.14 H new ATOM 0 HG2 LYS A 376 17.071 -12.557 21.246 1.00 5.04 H new ATOM 0 HG3 LYS A 376 16.001 -11.225 21.636 1.00 5.04 H new ATOM 0 HD2 LYS A 376 15.537 -12.636 23.409 1.00 15.21 H new ATOM 0 HD3 LYS A 376 14.303 -13.160 22.280 1.00 15.21 H new ATOM 0 HE2 LYS A 376 15.174 -15.235 22.191 1.00 3.34 H new ATOM 0 HE3 LYS A 376 16.745 -14.609 21.733 1.00 3.34 H new ATOM 0 HZ1 LYS A 376 16.862 -15.845 23.796 1.00 3.44 H new ATOM 0 HZ2 LYS A 376 17.241 -14.214 24.076 1.00 3.44 H new ATOM 0 HZ3 LYS A 376 15.718 -14.820 24.520 1.00 3.44 H new ATOM 987 N GLY A 377 15.379 -11.792 16.760 1.00 64.42 N ATOM 988 CA GLY A 377 14.645 -11.860 15.511 1.00 42.14 C ATOM 989 C GLY A 377 13.171 -11.556 15.688 1.00 14.14 C ATOM 990 O GLY A 377 12.320 -12.181 15.052 1.00 4.23 O ATOM 0 H GLY A 377 15.799 -10.885 16.961 1.00 64.42 H new ATOM 0 HA2 GLY A 377 15.076 -11.154 14.801 1.00 42.14 H new ATOM 0 HA3 GLY A 377 14.759 -12.855 15.080 1.00 42.14 H new ATOM 994 N CYS A 378 12.866 -10.597 16.554 1.00 71.32 N ATOM 995 CA CYS A 378 11.483 -10.212 16.815 1.00 71.14 C ATOM 996 C CYS A 378 11.382 -8.724 17.131 1.00 42.30 C ATOM 997 O CYS A 378 12.340 -8.115 17.610 1.00 23.21 O ATOM 998 CB CYS A 378 10.915 -11.031 17.976 1.00 73.31 C ATOM 999 SG CYS A 378 11.607 -10.603 19.590 1.00 23.33 S ATOM 0 H CYS A 378 13.558 -10.071 17.088 1.00 71.32 H new ATOM 0 HA CYS A 378 10.900 -10.414 15.916 1.00 71.14 H new ATOM 0 HB2 CYS A 378 9.834 -10.894 18.008 1.00 73.31 H new ATOM 0 HB3 CYS A 378 11.097 -12.088 17.784 1.00 73.31 H new ATOM 0 HG CYS A 378 10.774 -9.837 20.230 1.00 23.33 H new ATOM 1005 N CYS A 379 10.219 -8.144 16.858 1.00 1.22 N ATOM 1006 CA CYS A 379 9.994 -6.725 17.110 1.00 75.01 C ATOM 1007 C CYS A 379 8.601 -6.489 17.683 1.00 1.04 C ATOM 1008 O CYS A 379 7.669 -7.248 17.412 1.00 40.11 O ATOM 1009 CB CYS A 379 10.171 -5.922 15.820 1.00 22.02 C ATOM 1010 SG CYS A 379 8.729 -5.949 14.730 1.00 42.00 S ATOM 0 H CYS A 379 9.417 -8.634 16.462 1.00 1.22 H new ATOM 0 HA CYS A 379 10.729 -6.390 17.841 1.00 75.01 H new ATOM 0 HB2 CYS A 379 10.399 -4.888 16.077 1.00 22.02 H new ATOM 0 HB3 CYS A 379 11.031 -6.313 15.277 1.00 22.02 H new ATOM 0 HG CYS A 379 8.730 -4.885 13.983 1.00 42.00 H new ATOM 1016 N PHE A 380 8.466 -5.434 18.480 1.00 63.31 N ATOM 1017 CA PHE A 380 7.186 -5.099 19.095 1.00 41.24 C ATOM 1018 C PHE A 380 6.855 -3.623 18.893 1.00 24.13 C ATOM 1019 O PHE A 380 7.625 -2.745 19.282 1.00 14.30 O ATOM 1020 CB PHE A 380 7.212 -5.428 20.588 1.00 54.14 C ATOM 1021 CG PHE A 380 7.655 -6.831 20.886 1.00 24.20 C ATOM 1022 CD1 PHE A 380 8.997 -7.127 21.059 1.00 23.32 C ATOM 1023 CD2 PHE A 380 6.728 -7.856 20.993 1.00 33.03 C ATOM 1024 CE1 PHE A 380 9.406 -8.419 21.332 1.00 11.51 C ATOM 1025 CE2 PHE A 380 7.131 -9.150 21.266 1.00 73.43 C ATOM 1026 CZ PHE A 380 8.472 -9.431 21.437 1.00 64.45 C ATOM 0 H PHE A 380 9.227 -4.796 18.715 1.00 63.31 H new ATOM 0 HA PHE A 380 6.412 -5.696 18.612 1.00 41.24 H new ATOM 0 HB2 PHE A 380 7.879 -4.730 21.094 1.00 54.14 H new ATOM 0 HB3 PHE A 380 6.216 -5.274 21.003 1.00 54.14 H new ATOM 0 HD1 PHE A 380 9.732 -6.340 20.980 1.00 23.32 H new ATOM 0 HD2 PHE A 380 5.678 -7.641 20.861 1.00 33.03 H new ATOM 0 HE1 PHE A 380 10.456 -8.637 21.463 1.00 11.51 H new ATOM 0 HE2 PHE A 380 6.398 -9.940 21.345 1.00 73.43 H new ATOM 0 HZ PHE A 380 8.790 -10.440 21.652 1.00 64.45 H new ATOM 1036 N ILE A 381 5.705 -3.359 18.281 1.00 1.20 N ATOM 1037 CA ILE A 381 5.272 -1.991 18.027 1.00 22.51 C ATOM 1038 C ILE A 381 4.016 -1.656 18.825 1.00 25.35 C ATOM 1039 O ILE A 381 3.012 -2.364 18.750 1.00 42.42 O ATOM 1040 CB ILE A 381 4.995 -1.756 16.531 1.00 71.12 C ATOM 1041 CG1 ILE A 381 5.984 -2.550 15.676 1.00 12.44 C ATOM 1042 CG2 ILE A 381 5.075 -0.273 16.203 1.00 73.10 C ATOM 1043 CD1 ILE A 381 5.334 -3.643 14.857 1.00 45.50 C ATOM 0 H ILE A 381 5.057 -4.075 17.952 1.00 1.20 H new ATOM 0 HA ILE A 381 6.086 -1.338 18.343 1.00 22.51 H new ATOM 0 HB ILE A 381 3.987 -2.104 16.305 1.00 71.12 H new ATOM 0 HG12 ILE A 381 6.503 -1.865 15.006 1.00 12.44 H new ATOM 0 HG13 ILE A 381 6.738 -2.994 16.326 1.00 12.44 H new ATOM 0 HG21 ILE A 381 4.877 -0.124 15.142 1.00 73.10 H new ATOM 0 HG22 ILE A 381 4.334 0.270 16.790 1.00 73.10 H new ATOM 0 HG23 ILE A 381 6.071 0.099 16.442 1.00 73.10 H new ATOM 0 HD11 ILE A 381 6.095 -4.164 14.276 1.00 45.50 H new ATOM 0 HD12 ILE A 381 4.838 -4.350 15.522 1.00 45.50 H new ATOM 0 HD13 ILE A 381 4.600 -3.204 14.182 1.00 45.50 H new ATOM 1055 N LYS A 382 4.078 -0.568 19.587 1.00 23.02 N ATOM 1056 CA LYS A 382 2.946 -0.136 20.396 1.00 3.34 C ATOM 1057 C LYS A 382 2.055 0.826 19.615 1.00 31.52 C ATOM 1058 O LYS A 382 2.543 1.756 18.973 1.00 14.04 O ATOM 1059 CB LYS A 382 3.438 0.537 21.679 1.00 42.00 C ATOM 1060 CG LYS A 382 3.261 -0.321 22.922 1.00 32.32 C ATOM 1061 CD LYS A 382 3.603 0.451 24.185 1.00 74.34 C ATOM 1062 CE LYS A 382 2.758 -0.008 25.363 1.00 5.32 C ATOM 1063 NZ LYS A 382 3.181 -1.346 25.861 1.00 3.00 N ATOM 0 H LYS A 382 4.901 0.030 19.660 1.00 23.02 H new ATOM 0 HA LYS A 382 2.360 -1.017 20.656 1.00 3.34 H new ATOM 0 HB2 LYS A 382 4.493 0.787 21.567 1.00 42.00 H new ATOM 0 HB3 LYS A 382 2.901 1.476 21.816 1.00 42.00 H new ATOM 0 HG2 LYS A 382 2.231 -0.674 22.978 1.00 32.32 H new ATOM 0 HG3 LYS A 382 3.897 -1.203 22.850 1.00 32.32 H new ATOM 0 HD2 LYS A 382 4.659 0.318 24.419 1.00 74.34 H new ATOM 0 HD3 LYS A 382 3.446 1.516 24.016 1.00 74.34 H new ATOM 0 HE2 LYS A 382 2.834 0.721 26.170 1.00 5.32 H new ATOM 0 HE3 LYS A 382 1.710 -0.046 25.065 1.00 5.32 H new ATOM 0 HZ1 LYS A 382 2.581 -1.623 26.664 1.00 3.00 H new ATOM 0 HZ2 LYS A 382 3.085 -2.047 25.098 1.00 3.00 H new ATOM 0 HZ3 LYS A 382 4.173 -1.304 26.169 1.00 3.00 H new ATOM 1077 N TYR A 383 0.748 0.596 19.675 1.00 4.22 N ATOM 1078 CA TYR A 383 -0.210 1.441 18.974 1.00 2.44 C ATOM 1079 C TYR A 383 -1.127 2.160 19.958 1.00 60.34 C ATOM 1080 O TYR A 383 -0.989 2.013 21.173 1.00 52.05 O ATOM 1081 CB TYR A 383 -1.043 0.604 18.002 1.00 70.34 C ATOM 1082 CG TYR A 383 -0.275 0.146 16.783 1.00 10.53 C ATOM 1083 CD1 TYR A 383 0.628 -0.907 16.862 1.00 35.41 C ATOM 1084 CD2 TYR A 383 -0.449 0.768 15.553 1.00 13.23 C ATOM 1085 CE1 TYR A 383 1.333 -1.329 15.752 1.00 64.33 C ATOM 1086 CE2 TYR A 383 0.251 0.352 14.436 1.00 61.30 C ATOM 1087 CZ TYR A 383 1.141 -0.697 14.541 1.00 33.31 C ATOM 1088 OH TYR A 383 1.841 -1.112 13.433 1.00 61.24 O ATOM 0 H TYR A 383 0.328 -0.169 20.202 1.00 4.22 H new ATOM 0 HA TYR A 383 0.348 2.191 18.413 1.00 2.44 H new ATOM 0 HB2 TYR A 383 -1.429 -0.270 18.527 1.00 70.34 H new ATOM 0 HB3 TYR A 383 -1.905 1.188 17.679 1.00 70.34 H new ATOM 0 HD1 TYR A 383 0.781 -1.404 17.808 1.00 35.41 H new ATOM 0 HD2 TYR A 383 -1.143 1.591 15.468 1.00 13.23 H new ATOM 0 HE1 TYR A 383 2.031 -2.149 15.832 1.00 64.33 H new ATOM 0 HE2 TYR A 383 0.102 0.845 13.487 1.00 61.30 H new ATOM 0 HH TYR A 383 1.872 -0.386 12.775 1.00 61.24 H new ATOM 1098 N ASP A 384 -2.062 2.937 19.426 1.00 64.40 N ATOM 1099 CA ASP A 384 -3.005 3.679 20.256 1.00 11.54 C ATOM 1100 C ASP A 384 -4.141 2.777 20.726 1.00 30.01 C ATOM 1101 O ASP A 384 -4.510 2.783 21.901 1.00 53.05 O ATOM 1102 CB ASP A 384 -3.569 4.873 19.484 1.00 71.21 C ATOM 1103 CG ASP A 384 -3.239 6.197 20.143 1.00 2.13 C ATOM 1104 OD1 ASP A 384 -2.307 6.230 20.974 1.00 53.33 O ATOM 1105 OD2 ASP A 384 -3.912 7.200 19.829 1.00 61.42 O ATOM 0 H ASP A 384 -2.188 3.070 18.423 1.00 64.40 H new ATOM 0 HA ASP A 384 -2.470 4.045 21.132 1.00 11.54 H new ATOM 0 HB2 ASP A 384 -3.171 4.866 18.469 1.00 71.21 H new ATOM 0 HB3 ASP A 384 -4.651 4.771 19.403 1.00 71.21 H new ATOM 1110 N THR A 385 -4.697 2.003 19.799 1.00 74.42 N ATOM 1111 CA THR A 385 -5.793 1.097 20.117 1.00 23.12 C ATOM 1112 C THR A 385 -5.376 -0.358 19.938 1.00 74.24 C ATOM 1113 O THR A 385 -4.301 -0.645 19.408 1.00 53.22 O ATOM 1114 CB THR A 385 -7.026 1.377 19.237 1.00 71.21 C ATOM 1115 OG1 THR A 385 -6.721 1.106 17.865 1.00 0.03 O ATOM 1116 CG2 THR A 385 -7.479 2.822 19.385 1.00 23.01 C ATOM 0 H THR A 385 -4.406 1.986 18.822 1.00 74.42 H new ATOM 0 HA THR A 385 -6.053 1.271 21.161 1.00 23.12 H new ATOM 0 HB THR A 385 -7.834 0.723 19.565 1.00 71.21 H new ATOM 0 HG1 THR A 385 -7.511 1.285 17.313 1.00 0.03 H new ATOM 0 HG21 THR A 385 -8.351 2.996 18.754 1.00 23.01 H new ATOM 0 HG22 THR A 385 -7.739 3.017 20.425 1.00 23.01 H new ATOM 0 HG23 THR A 385 -6.672 3.489 19.081 1.00 23.01 H new ATOM 1124 N HIS A 386 -6.230 -1.274 20.382 1.00 65.21 N ATOM 1125 CA HIS A 386 -5.949 -2.701 20.269 1.00 41.35 C ATOM 1126 C HIS A 386 -6.385 -3.234 18.907 1.00 34.03 C ATOM 1127 O HIS A 386 -5.657 -3.991 18.266 1.00 64.22 O ATOM 1128 CB HIS A 386 -6.659 -3.472 21.382 1.00 32.12 C ATOM 1129 CG HIS A 386 -8.112 -3.133 21.513 1.00 31.32 C ATOM 1130 ND1 HIS A 386 -8.570 -2.043 22.224 1.00 71.01 N ATOM 1131 CD2 HIS A 386 -9.212 -3.748 21.018 1.00 71.24 C ATOM 1132 CE1 HIS A 386 -9.889 -2.003 22.161 1.00 44.52 C ATOM 1133 NE2 HIS A 386 -10.303 -3.026 21.435 1.00 14.21 N ATOM 0 H HIS A 386 -7.123 -1.054 20.824 1.00 65.21 H new ATOM 0 HA HIS A 386 -4.873 -2.843 20.368 1.00 41.35 H new ATOM 0 HB2 HIS A 386 -6.559 -4.541 21.193 1.00 32.12 H new ATOM 0 HB3 HIS A 386 -6.160 -3.268 22.329 1.00 32.12 H new ATOM 0 HD2 HIS A 386 -9.228 -4.640 20.409 1.00 71.24 H new ATOM 0 HE1 HIS A 386 -10.521 -1.260 22.624 1.00 44.52 H new ATOM 0 HE2 HIS A 386 -11.276 -3.244 21.219 1.00 14.21 H new ATOM 1141 N GLU A 387 -7.577 -2.834 18.474 1.00 24.43 N ATOM 1142 CA GLU A 387 -8.109 -3.274 17.190 1.00 22.21 C ATOM 1143 C GLU A 387 -7.157 -2.911 16.054 1.00 45.34 C ATOM 1144 O GLU A 387 -7.057 -3.632 15.061 1.00 11.42 O ATOM 1145 CB GLU A 387 -9.483 -2.648 16.940 1.00 4.24 C ATOM 1146 CG GLU A 387 -9.534 -1.158 17.236 1.00 4.32 C ATOM 1147 CD GLU A 387 -10.867 -0.536 16.869 1.00 52.21 C ATOM 1148 OE1 GLU A 387 -11.270 -0.648 15.692 1.00 22.50 O ATOM 1149 OE2 GLU A 387 -11.508 0.062 17.758 1.00 24.45 O ATOM 0 H GLU A 387 -8.191 -2.207 18.993 1.00 24.43 H new ATOM 0 HA GLU A 387 -8.213 -4.359 17.221 1.00 22.21 H new ATOM 0 HB2 GLU A 387 -9.765 -2.814 15.900 1.00 4.24 H new ATOM 0 HB3 GLU A 387 -10.223 -3.158 17.556 1.00 4.24 H new ATOM 0 HG2 GLU A 387 -9.341 -0.995 18.296 1.00 4.32 H new ATOM 0 HG3 GLU A 387 -8.739 -0.655 16.686 1.00 4.32 H new ATOM 1156 N GLN A 388 -6.463 -1.788 16.207 1.00 75.42 N ATOM 1157 CA GLN A 388 -5.521 -1.328 15.194 1.00 53.12 C ATOM 1158 C GLN A 388 -4.318 -2.263 15.105 1.00 12.15 C ATOM 1159 O GLN A 388 -3.742 -2.448 14.034 1.00 25.24 O ATOM 1160 CB GLN A 388 -5.054 0.094 15.509 1.00 41.14 C ATOM 1161 CG GLN A 388 -4.388 0.790 14.332 1.00 75.22 C ATOM 1162 CD GLN A 388 -4.432 2.301 14.448 1.00 23.20 C ATOM 1163 OE1 GLN A 388 -5.026 2.982 13.611 1.00 64.05 O ATOM 1164 NE2 GLN A 388 -3.802 2.834 15.487 1.00 4.32 N ATOM 0 H GLN A 388 -6.535 -1.180 17.023 1.00 75.42 H new ATOM 0 HA GLN A 388 -6.032 -1.330 14.231 1.00 53.12 H new ATOM 0 HB2 GLN A 388 -5.910 0.685 15.833 1.00 41.14 H new ATOM 0 HB3 GLN A 388 -4.355 0.061 16.344 1.00 41.14 H new ATOM 0 HG2 GLN A 388 -3.350 0.465 14.262 1.00 75.22 H new ATOM 0 HG3 GLN A 388 -4.880 0.486 13.408 1.00 75.22 H new ATOM 0 HE21 GLN A 388 -3.323 2.232 16.156 1.00 4.32 H new ATOM 0 HE22 GLN A 388 -3.797 3.846 15.616 1.00 4.32 H new ATOM 1173 N ALA A 389 -3.944 -2.846 16.239 1.00 65.12 N ATOM 1174 CA ALA A 389 -2.810 -3.762 16.288 1.00 14.12 C ATOM 1175 C ALA A 389 -3.103 -5.041 15.511 1.00 22.02 C ATOM 1176 O ALA A 389 -2.232 -5.576 14.827 1.00 10.54 O ATOM 1177 CB ALA A 389 -2.458 -4.088 17.732 1.00 32.41 C ATOM 0 H ALA A 389 -4.409 -2.701 17.135 1.00 65.12 H new ATOM 0 HA ALA A 389 -1.957 -3.271 15.819 1.00 14.12 H new ATOM 0 HB1 ALA A 389 -1.610 -4.773 17.754 1.00 32.41 H new ATOM 0 HB2 ALA A 389 -2.197 -3.170 18.259 1.00 32.41 H new ATOM 0 HB3 ALA A 389 -3.314 -4.555 18.219 1.00 32.41 H new ATOM 1183 N ALA A 390 -4.336 -5.526 15.624 1.00 3.20 N ATOM 1184 CA ALA A 390 -4.744 -6.742 14.931 1.00 23.23 C ATOM 1185 C ALA A 390 -4.580 -6.595 13.421 1.00 10.03 C ATOM 1186 O ALA A 390 -4.371 -7.577 12.711 1.00 54.53 O ATOM 1187 CB ALA A 390 -6.185 -7.088 15.275 1.00 63.40 C ATOM 0 H ALA A 390 -5.069 -5.096 16.188 1.00 3.20 H new ATOM 0 HA ALA A 390 -4.097 -7.554 15.264 1.00 23.23 H new ATOM 0 HB1 ALA A 390 -6.476 -7.998 14.750 1.00 63.40 H new ATOM 0 HB2 ALA A 390 -6.275 -7.244 16.350 1.00 63.40 H new ATOM 0 HB3 ALA A 390 -6.838 -6.270 14.971 1.00 63.40 H new ATOM 1193 N VAL A 391 -4.678 -5.360 12.938 1.00 45.31 N ATOM 1194 CA VAL A 391 -4.540 -5.085 11.513 1.00 42.11 C ATOM 1195 C VAL A 391 -3.159 -5.484 11.007 1.00 22.41 C ATOM 1196 O VAL A 391 -3.023 -6.040 9.916 1.00 12.04 O ATOM 1197 CB VAL A 391 -4.778 -3.594 11.204 1.00 24.21 C ATOM 1198 CG1 VAL A 391 -4.470 -3.295 9.744 1.00 60.24 C ATOM 1199 CG2 VAL A 391 -6.206 -3.200 11.548 1.00 34.00 C ATOM 0 H VAL A 391 -4.852 -4.535 13.512 1.00 45.31 H new ATOM 0 HA VAL A 391 -5.296 -5.680 11.001 1.00 42.11 H new ATOM 0 HB VAL A 391 -4.103 -3.001 11.821 1.00 24.21 H new ATOM 0 HG11 VAL A 391 -4.644 -2.238 9.545 1.00 60.24 H new ATOM 0 HG12 VAL A 391 -3.428 -3.537 9.535 1.00 60.24 H new ATOM 0 HG13 VAL A 391 -5.117 -3.896 9.105 1.00 60.24 H new ATOM 0 HG21 VAL A 391 -6.356 -2.144 11.323 1.00 34.00 H new ATOM 0 HG22 VAL A 391 -6.901 -3.799 10.959 1.00 34.00 H new ATOM 0 HG23 VAL A 391 -6.386 -3.375 12.609 1.00 34.00 H new ATOM 1209 N CYS A 392 -2.136 -5.195 11.805 1.00 71.41 N ATOM 1210 CA CYS A 392 -0.764 -5.524 11.438 1.00 73.34 C ATOM 1211 C CYS A 392 -0.481 -7.006 11.660 1.00 4.30 C ATOM 1212 O CYS A 392 0.375 -7.591 10.996 1.00 3.23 O ATOM 1213 CB CYS A 392 0.219 -4.678 12.248 1.00 1.41 C ATOM 1214 SG CYS A 392 1.888 -5.367 12.337 1.00 42.42 S ATOM 0 H CYS A 392 -2.232 -4.734 12.710 1.00 71.41 H new ATOM 0 HA CYS A 392 -0.635 -5.304 10.378 1.00 73.34 H new ATOM 0 HB2 CYS A 392 0.272 -3.682 11.809 1.00 1.41 H new ATOM 0 HB3 CYS A 392 -0.168 -4.560 13.260 1.00 1.41 H new ATOM 0 HG CYS A 392 1.919 -6.511 11.721 1.00 42.42 H new ATOM 1220 N ILE A 393 -1.205 -7.607 12.598 1.00 45.22 N ATOM 1221 CA ILE A 393 -1.032 -9.021 12.909 1.00 11.23 C ATOM 1222 C ILE A 393 -1.190 -9.881 11.659 1.00 2.15 C ATOM 1223 O ILE A 393 -0.292 -10.642 11.299 1.00 1.24 O ATOM 1224 CB ILE A 393 -2.041 -9.491 13.973 1.00 34.10 C ATOM 1225 CG1 ILE A 393 -1.416 -9.415 15.367 1.00 2.43 C ATOM 1226 CG2 ILE A 393 -2.506 -10.908 13.672 1.00 13.42 C ATOM 1227 CD1 ILE A 393 -1.341 -8.008 15.920 1.00 14.43 C ATOM 0 H ILE A 393 -1.917 -7.137 13.156 1.00 45.22 H new ATOM 0 HA ILE A 393 -0.022 -9.137 13.302 1.00 11.23 H new ATOM 0 HB ILE A 393 -2.908 -8.832 13.947 1.00 34.10 H new ATOM 0 HG12 ILE A 393 -1.996 -10.035 16.051 1.00 2.43 H new ATOM 0 HG13 ILE A 393 -0.411 -9.836 15.329 1.00 2.43 H new ATOM 0 HG21 ILE A 393 -3.219 -11.226 14.433 1.00 13.42 H new ATOM 0 HG22 ILE A 393 -2.984 -10.934 12.693 1.00 13.42 H new ATOM 0 HG23 ILE A 393 -1.648 -11.581 13.674 1.00 13.42 H new ATOM 0 HD11 ILE A 393 -0.887 -8.030 16.911 1.00 14.43 H new ATOM 0 HD12 ILE A 393 -0.736 -7.389 15.258 1.00 14.43 H new ATOM 0 HD13 ILE A 393 -2.345 -7.591 15.990 1.00 14.43 H new ATOM 1239 N VAL A 394 -2.337 -9.753 11.001 1.00 32.22 N ATOM 1240 CA VAL A 394 -2.613 -10.517 9.789 1.00 32.14 C ATOM 1241 C VAL A 394 -1.802 -9.988 8.611 1.00 31.14 C ATOM 1242 O VAL A 394 -1.204 -10.759 7.861 1.00 40.55 O ATOM 1243 CB VAL A 394 -4.109 -10.477 9.429 1.00 53.43 C ATOM 1244 CG1 VAL A 394 -4.294 -10.206 7.943 1.00 24.32 C ATOM 1245 CG2 VAL A 394 -4.789 -11.777 9.831 1.00 32.15 C ATOM 0 H VAL A 394 -3.091 -9.128 11.286 1.00 32.22 H new ATOM 0 HA VAL A 394 -2.324 -11.548 9.991 1.00 32.14 H new ATOM 0 HB VAL A 394 -4.576 -9.663 9.983 1.00 53.43 H new ATOM 0 HG11 VAL A 394 -5.358 -10.181 7.707 1.00 24.32 H new ATOM 0 HG12 VAL A 394 -3.844 -9.246 7.689 1.00 24.32 H new ATOM 0 HG13 VAL A 394 -3.813 -10.996 7.366 1.00 24.32 H new ATOM 0 HG21 VAL A 394 -5.846 -11.731 9.569 1.00 32.15 H new ATOM 0 HG22 VAL A 394 -4.321 -12.610 9.306 1.00 32.15 H new ATOM 0 HG23 VAL A 394 -4.688 -11.923 10.906 1.00 32.15 H new ATOM 1255 N ALA A 395 -1.787 -8.668 8.455 1.00 44.11 N ATOM 1256 CA ALA A 395 -1.049 -8.035 7.369 1.00 42.21 C ATOM 1257 C ALA A 395 0.403 -8.501 7.348 1.00 72.34 C ATOM 1258 O ALA A 395 1.080 -8.415 6.323 1.00 24.20 O ATOM 1259 CB ALA A 395 -1.118 -6.521 7.496 1.00 71.32 C ATOM 0 H ALA A 395 -2.278 -8.016 9.067 1.00 44.11 H new ATOM 0 HA ALA A 395 -1.512 -8.330 6.427 1.00 42.21 H new ATOM 0 HB1 ALA A 395 -0.563 -6.062 6.678 1.00 71.32 H new ATOM 0 HB2 ALA A 395 -2.159 -6.199 7.454 1.00 71.32 H new ATOM 0 HB3 ALA A 395 -0.682 -6.215 8.447 1.00 71.32 H new ATOM 1265 N LEU A 396 0.877 -8.995 8.487 1.00 61.53 N ATOM 1266 CA LEU A 396 2.250 -9.475 8.599 1.00 45.14 C ATOM 1267 C LEU A 396 2.292 -10.999 8.656 1.00 31.14 C ATOM 1268 O LEU A 396 3.327 -11.611 8.398 1.00 41.41 O ATOM 1269 CB LEU A 396 2.915 -8.888 9.847 1.00 42.35 C ATOM 1270 CG LEU A 396 3.560 -7.512 9.679 1.00 63.21 C ATOM 1271 CD1 LEU A 396 4.975 -7.649 9.139 1.00 4.42 C ATOM 1272 CD2 LEU A 396 2.719 -6.638 8.761 1.00 43.43 C ATOM 0 H LEU A 396 0.331 -9.074 9.345 1.00 61.53 H new ATOM 0 HA LEU A 396 2.797 -9.148 7.714 1.00 45.14 H new ATOM 0 HB2 LEU A 396 2.166 -8.822 10.636 1.00 42.35 H new ATOM 0 HB3 LEU A 396 3.679 -9.586 10.190 1.00 42.35 H new ATOM 0 HG LEU A 396 3.611 -7.033 10.657 1.00 63.21 H new ATOM 0 HD11 LEU A 396 5.419 -6.660 9.026 1.00 4.42 H new ATOM 0 HD12 LEU A 396 5.574 -8.238 9.834 1.00 4.42 H new ATOM 0 HD13 LEU A 396 4.948 -8.148 8.170 1.00 4.42 H new ATOM 0 HD21 LEU A 396 3.193 -5.662 8.653 1.00 43.43 H new ATOM 0 HD22 LEU A 396 2.636 -7.112 7.783 1.00 43.43 H new ATOM 0 HD23 LEU A 396 1.724 -6.513 9.189 1.00 43.43 H new ATOM 1284 N ALA A 397 1.158 -11.604 8.994 1.00 33.32 N ATOM 1285 CA ALA A 397 1.065 -13.057 9.079 1.00 73.14 C ATOM 1286 C ALA A 397 1.647 -13.719 7.835 1.00 12.01 C ATOM 1287 O ALA A 397 1.117 -13.569 6.735 1.00 21.52 O ATOM 1288 CB ALA A 397 -0.384 -13.481 9.277 1.00 74.20 C ATOM 0 H ALA A 397 0.292 -11.112 9.213 1.00 33.32 H new ATOM 0 HA ALA A 397 1.650 -13.385 9.939 1.00 73.14 H new ATOM 0 HB1 ALA A 397 -0.440 -14.568 9.339 1.00 74.20 H new ATOM 0 HB2 ALA A 397 -0.768 -13.045 10.199 1.00 74.20 H new ATOM 0 HB3 ALA A 397 -0.983 -13.134 8.435 1.00 74.20 H new ATOM 1294 N ASN A 398 2.741 -14.451 8.018 1.00 73.13 N ATOM 1295 CA ASN A 398 3.396 -15.136 6.910 1.00 34.24 C ATOM 1296 C ASN A 398 3.500 -14.222 5.691 1.00 44.55 C ATOM 1297 O ASN A 398 3.187 -14.626 4.571 1.00 25.11 O ATOM 1298 CB ASN A 398 2.629 -16.408 6.543 1.00 23.40 C ATOM 1299 CG ASN A 398 3.538 -17.495 6.004 1.00 12.31 C ATOM 1300 OD1 ASN A 398 4.700 -17.246 5.681 1.00 40.34 O ATOM 1301 ND2 ASN A 398 3.012 -18.710 5.903 1.00 54.05 N ATOM 0 H ASN A 398 3.192 -14.585 8.923 1.00 73.13 H new ATOM 0 HA ASN A 398 4.403 -15.406 7.227 1.00 34.24 H new ATOM 0 HB2 ASN A 398 2.105 -16.780 7.423 1.00 23.40 H new ATOM 0 HB3 ASN A 398 1.870 -16.169 5.797 1.00 23.40 H new ATOM 0 HD21 ASN A 398 3.576 -19.482 5.546 1.00 54.05 H new ATOM 0 HD22 ASN A 398 2.044 -18.872 6.182 1.00 54.05 H new ATOM 1308 N PHE A 399 3.942 -12.991 5.918 1.00 43.24 N ATOM 1309 CA PHE A 399 4.087 -12.019 4.840 1.00 1.35 C ATOM 1310 C PHE A 399 5.559 -11.795 4.505 1.00 52.31 C ATOM 1311 O PHE A 399 6.429 -11.814 5.375 1.00 54.12 O ATOM 1312 CB PHE A 399 3.433 -10.692 5.229 1.00 3.13 C ATOM 1313 CG PHE A 399 4.397 -9.542 5.283 1.00 73.53 C ATOM 1314 CD1 PHE A 399 5.378 -9.488 6.260 1.00 13.23 C ATOM 1315 CD2 PHE A 399 4.321 -8.513 4.358 1.00 71.54 C ATOM 1316 CE1 PHE A 399 6.267 -8.431 6.312 1.00 44.41 C ATOM 1317 CE2 PHE A 399 5.208 -7.454 4.405 1.00 22.42 C ATOM 1318 CZ PHE A 399 6.181 -7.412 5.384 1.00 4.12 C ATOM 0 H PHE A 399 4.206 -12.642 6.839 1.00 43.24 H new ATOM 0 HA PHE A 399 3.587 -12.416 3.956 1.00 1.35 H new ATOM 0 HB2 PHE A 399 2.644 -10.461 4.513 1.00 3.13 H new ATOM 0 HB3 PHE A 399 2.957 -10.803 6.203 1.00 3.13 H new ATOM 0 HD1 PHE A 399 5.449 -10.281 6.990 1.00 13.23 H new ATOM 0 HD2 PHE A 399 3.560 -8.539 3.592 1.00 71.54 H new ATOM 0 HE1 PHE A 399 7.028 -8.402 7.078 1.00 44.41 H new ATOM 0 HE2 PHE A 399 5.140 -6.660 3.676 1.00 22.42 H new ATOM 0 HZ PHE A 399 6.873 -6.584 5.424 1.00 4.12 H new ATOM 1328 N PRO A 400 5.844 -11.575 3.212 1.00 53.41 N ATOM 1329 CA PRO A 400 7.209 -11.343 2.731 1.00 71.55 C ATOM 1330 C PRO A 400 7.761 -9.995 3.182 1.00 50.52 C ATOM 1331 O PRO A 400 7.023 -9.014 3.284 1.00 2.03 O ATOM 1332 CB PRO A 400 7.058 -11.376 1.208 1.00 55.32 C ATOM 1333 CG PRO A 400 5.640 -10.995 0.959 1.00 20.11 C ATOM 1334 CD PRO A 400 4.855 -11.538 2.122 1.00 63.21 C ATOM 0 HA PRO A 400 7.910 -12.082 3.120 1.00 71.55 H new ATOM 0 HB2 PRO A 400 7.745 -10.680 0.727 1.00 55.32 H new ATOM 0 HB3 PRO A 400 7.277 -12.367 0.810 1.00 55.32 H new ATOM 0 HG2 PRO A 400 5.533 -9.913 0.888 1.00 20.11 H new ATOM 0 HG3 PRO A 400 5.283 -11.413 0.018 1.00 20.11 H new ATOM 0 HD2 PRO A 400 4.008 -10.898 2.369 1.00 63.21 H new ATOM 0 HD3 PRO A 400 4.454 -12.529 1.909 1.00 63.21 H new ATOM 1342 N PHE A 401 9.061 -9.954 3.452 1.00 2.41 N ATOM 1343 CA PHE A 401 9.711 -8.726 3.893 1.00 54.11 C ATOM 1344 C PHE A 401 11.185 -8.716 3.494 1.00 31.24 C ATOM 1345 O PHE A 401 11.983 -9.497 4.012 1.00 22.04 O ATOM 1346 CB PHE A 401 9.581 -8.570 5.410 1.00 74.01 C ATOM 1347 CG PHE A 401 10.259 -7.343 5.947 1.00 54.45 C ATOM 1348 CD1 PHE A 401 9.807 -6.079 5.603 1.00 13.43 C ATOM 1349 CD2 PHE A 401 11.349 -7.453 6.796 1.00 23.12 C ATOM 1350 CE1 PHE A 401 10.429 -4.947 6.097 1.00 54.01 C ATOM 1351 CE2 PHE A 401 11.973 -6.325 7.293 1.00 72.22 C ATOM 1352 CZ PHE A 401 11.514 -5.070 6.942 1.00 3.42 C ATOM 0 H PHE A 401 9.685 -10.757 3.373 1.00 2.41 H new ATOM 0 HA PHE A 401 9.215 -7.887 3.405 1.00 54.11 H new ATOM 0 HB2 PHE A 401 8.524 -8.536 5.674 1.00 74.01 H new ATOM 0 HB3 PHE A 401 10.003 -9.450 5.895 1.00 74.01 H new ATOM 0 HD1 PHE A 401 8.959 -5.977 4.942 1.00 13.43 H new ATOM 0 HD2 PHE A 401 11.715 -8.431 7.072 1.00 23.12 H new ATOM 0 HE1 PHE A 401 10.066 -3.968 5.822 1.00 54.01 H new ATOM 0 HE2 PHE A 401 12.820 -6.424 7.956 1.00 72.22 H new ATOM 0 HZ PHE A 401 12.003 -4.187 7.328 1.00 3.42 H new ATOM 1362 N GLN A 402 11.535 -7.829 2.568 1.00 52.24 N ATOM 1363 CA GLN A 402 12.912 -7.720 2.099 1.00 11.53 C ATOM 1364 C GLN A 402 13.460 -9.085 1.696 1.00 62.04 C ATOM 1365 O GLN A 402 14.648 -9.360 1.858 1.00 54.15 O ATOM 1366 CB GLN A 402 13.796 -7.103 3.184 1.00 63.25 C ATOM 1367 CG GLN A 402 14.070 -5.622 2.975 1.00 34.42 C ATOM 1368 CD GLN A 402 13.382 -4.750 4.008 1.00 35.05 C ATOM 1369 OE1 GLN A 402 12.263 -4.283 3.797 1.00 2.14 O ATOM 1370 NE2 GLN A 402 14.050 -4.526 5.133 1.00 54.13 N ATOM 0 H GLN A 402 10.886 -7.177 2.128 1.00 52.24 H new ATOM 0 HA GLN A 402 12.920 -7.072 1.222 1.00 11.53 H new ATOM 0 HB2 GLN A 402 13.318 -7.242 4.154 1.00 63.25 H new ATOM 0 HB3 GLN A 402 14.745 -7.639 3.216 1.00 63.25 H new ATOM 0 HG2 GLN A 402 15.145 -5.446 3.014 1.00 34.42 H new ATOM 0 HG3 GLN A 402 13.736 -5.331 1.979 1.00 34.42 H new ATOM 0 HE21 GLN A 402 14.976 -4.933 5.266 1.00 54.13 H new ATOM 0 HE22 GLN A 402 13.638 -3.947 5.864 1.00 54.13 H new ATOM 1379 N GLY A 403 12.585 -9.937 1.171 1.00 64.32 N ATOM 1380 CA GLY A 403 12.999 -11.264 0.754 1.00 40.42 C ATOM 1381 C GLY A 403 12.688 -12.322 1.793 1.00 22.32 C ATOM 1382 O GLY A 403 12.486 -13.490 1.457 1.00 71.31 O ATOM 0 H GLY A 403 11.596 -9.732 1.027 1.00 64.32 H new ATOM 0 HA2 GLY A 403 12.500 -11.520 -0.181 1.00 40.42 H new ATOM 0 HA3 GLY A 403 14.070 -11.260 0.553 1.00 40.42 H new ATOM 1386 N ARG A 404 12.649 -11.915 3.057 1.00 34.50 N ATOM 1387 CA ARG A 404 12.362 -12.838 4.148 1.00 3.14 C ATOM 1388 C ARG A 404 10.940 -12.643 4.666 1.00 13.34 C ATOM 1389 O ARG A 404 10.450 -11.517 4.752 1.00 15.52 O ATOM 1390 CB ARG A 404 13.364 -12.640 5.288 1.00 22.14 C ATOM 1391 CG ARG A 404 13.691 -13.921 6.040 1.00 62.41 C ATOM 1392 CD ARG A 404 15.180 -14.228 5.993 1.00 24.12 C ATOM 1393 NE ARG A 404 15.440 -15.627 5.666 1.00 32.32 N ATOM 1394 CZ ARG A 404 15.232 -16.153 4.465 1.00 52.14 C ATOM 1395 NH1 ARG A 404 14.763 -15.399 3.480 1.00 70.01 N ATOM 1396 NH2 ARG A 404 15.493 -17.435 4.245 1.00 50.31 N ATOM 0 H ARG A 404 12.813 -10.952 3.351 1.00 34.50 H new ATOM 0 HA ARG A 404 12.454 -13.854 3.765 1.00 3.14 H new ATOM 0 HB2 ARG A 404 14.285 -12.221 4.882 1.00 22.14 H new ATOM 0 HB3 ARG A 404 12.963 -11.909 5.990 1.00 22.14 H new ATOM 0 HG2 ARG A 404 13.370 -13.828 7.077 1.00 62.41 H new ATOM 0 HG3 ARG A 404 13.133 -14.751 5.607 1.00 62.41 H new ATOM 0 HD2 ARG A 404 15.659 -13.588 5.252 1.00 24.12 H new ATOM 0 HD3 ARG A 404 15.630 -13.992 6.957 1.00 24.12 H new ATOM 0 HE ARG A 404 15.802 -16.234 6.401 1.00 32.32 H new ATOM 0 HH11 ARG A 404 14.561 -14.413 3.644 1.00 70.01 H new ATOM 0 HH12 ARG A 404 14.604 -15.805 2.558 1.00 70.01 H new ATOM 0 HH21 ARG A 404 15.854 -18.019 4.999 1.00 50.31 H new ATOM 0 HH22 ARG A 404 15.332 -17.837 3.321 1.00 50.31 H new ATOM 1410 N ASN A 405 10.284 -13.746 5.011 1.00 14.00 N ATOM 1411 CA ASN A 405 8.919 -13.696 5.519 1.00 24.30 C ATOM 1412 C ASN A 405 8.907 -13.484 7.030 1.00 33.43 C ATOM 1413 O ASN A 405 9.780 -13.981 7.744 1.00 11.23 O ATOM 1414 CB ASN A 405 8.174 -14.986 5.168 1.00 12.20 C ATOM 1415 CG ASN A 405 8.214 -15.291 3.683 1.00 2.32 C ATOM 1416 OD1 ASN A 405 8.963 -16.159 3.237 1.00 42.51 O ATOM 1417 ND2 ASN A 405 7.405 -14.576 2.911 1.00 10.24 N ATOM 0 H ASN A 405 10.676 -14.685 4.948 1.00 14.00 H new ATOM 0 HA ASN A 405 8.414 -12.853 5.048 1.00 24.30 H new ATOM 0 HB2 ASN A 405 8.614 -15.818 5.719 1.00 12.20 H new ATOM 0 HB3 ASN A 405 7.136 -14.903 5.491 1.00 12.20 H new ATOM 0 HD21 ASN A 405 7.388 -14.736 1.904 1.00 10.24 H new ATOM 0 HD22 ASN A 405 6.801 -13.866 3.325 1.00 10.24 H new ATOM 1424 N LEU A 406 7.915 -12.745 7.511 1.00 11.31 N ATOM 1425 CA LEU A 406 7.789 -12.467 8.938 1.00 12.25 C ATOM 1426 C LEU A 406 6.637 -13.259 9.547 1.00 43.55 C ATOM 1427 O LEU A 406 5.950 -14.008 8.853 1.00 31.35 O ATOM 1428 CB LEU A 406 7.573 -10.971 9.169 1.00 73.12 C ATOM 1429 CG LEU A 406 8.577 -10.036 8.495 1.00 33.12 C ATOM 1430 CD1 LEU A 406 8.571 -8.671 9.165 1.00 71.30 C ATOM 1431 CD2 LEU A 406 9.974 -10.640 8.525 1.00 74.52 C ATOM 0 H LEU A 406 7.185 -12.327 6.934 1.00 11.31 H new ATOM 0 HA LEU A 406 8.714 -12.774 9.426 1.00 12.25 H new ATOM 0 HB2 LEU A 406 6.574 -10.711 8.820 1.00 73.12 H new ATOM 0 HB3 LEU A 406 7.595 -10.783 10.242 1.00 73.12 H new ATOM 0 HG LEU A 406 8.280 -9.908 7.454 1.00 33.12 H new ATOM 0 HD11 LEU A 406 9.292 -8.020 8.671 1.00 71.30 H new ATOM 0 HD12 LEU A 406 7.576 -8.233 9.090 1.00 71.30 H new ATOM 0 HD13 LEU A 406 8.841 -8.780 10.215 1.00 71.30 H new ATOM 0 HD21 LEU A 406 10.675 -9.960 8.041 1.00 74.52 H new ATOM 0 HD22 LEU A 406 10.279 -10.800 9.559 1.00 74.52 H new ATOM 0 HD23 LEU A 406 9.970 -11.593 7.997 1.00 74.52 H new ATOM 1443 N ARG A 407 6.429 -13.086 10.848 1.00 70.00 N ATOM 1444 CA ARG A 407 5.358 -13.783 11.551 1.00 73.51 C ATOM 1445 C ARG A 407 4.531 -12.809 12.385 1.00 2.50 C ATOM 1446 O ARG A 407 4.828 -11.615 12.442 1.00 73.42 O ATOM 1447 CB ARG A 407 5.939 -14.876 12.450 1.00 24.12 C ATOM 1448 CG ARG A 407 5.102 -16.145 12.482 1.00 53.54 C ATOM 1449 CD ARG A 407 5.848 -17.287 13.154 1.00 32.11 C ATOM 1450 NE ARG A 407 5.109 -18.545 13.075 1.00 14.32 N ATOM 1451 CZ ARG A 407 5.114 -19.333 12.007 1.00 23.13 C ATOM 1452 NH1 ARG A 407 5.815 -18.998 10.933 1.00 71.30 N ATOM 1453 NH2 ARG A 407 4.416 -20.462 12.011 1.00 30.24 N ATOM 0 H ARG A 407 6.988 -12.469 11.437 1.00 70.00 H new ATOM 0 HA ARG A 407 4.706 -14.241 10.807 1.00 73.51 H new ATOM 0 HB2 ARG A 407 6.944 -15.122 12.106 1.00 24.12 H new ATOM 0 HB3 ARG A 407 6.035 -14.488 13.464 1.00 24.12 H new ATOM 0 HG2 ARG A 407 4.170 -15.954 13.014 1.00 53.54 H new ATOM 0 HG3 ARG A 407 4.835 -16.432 11.465 1.00 53.54 H new ATOM 0 HD2 ARG A 407 6.824 -17.409 12.683 1.00 32.11 H new ATOM 0 HD3 ARG A 407 6.028 -17.037 14.200 1.00 32.11 H new ATOM 0 HE ARG A 407 4.559 -18.833 13.885 1.00 14.32 H new ATOM 0 HH11 ARG A 407 6.353 -18.132 10.925 1.00 71.30 H new ATOM 0 HH12 ARG A 407 5.816 -19.607 10.114 1.00 71.30 H new ATOM 0 HH21 ARG A 407 3.875 -20.724 12.835 1.00 30.24 H new ATOM 0 HH22 ARG A 407 4.420 -21.067 11.190 1.00 30.24 H new ATOM 1467 N THR A 408 3.491 -13.327 13.031 1.00 24.23 N ATOM 1468 CA THR A 408 2.619 -12.504 13.860 1.00 54.13 C ATOM 1469 C THR A 408 1.910 -13.345 14.915 1.00 51.32 C ATOM 1470 O THR A 408 1.857 -14.569 14.815 1.00 35.13 O ATOM 1471 CB THR A 408 1.565 -11.770 13.011 1.00 42.21 C ATOM 1472 OG1 THR A 408 0.958 -12.682 12.088 1.00 50.10 O ATOM 1473 CG2 THR A 408 2.193 -10.614 12.248 1.00 34.12 C ATOM 0 H THR A 408 3.232 -14.313 12.996 1.00 24.23 H new ATOM 0 HA THR A 408 3.254 -11.768 14.353 1.00 54.13 H new ATOM 0 HB THR A 408 0.804 -11.371 13.682 1.00 42.21 H new ATOM 0 HG1 THR A 408 0.152 -12.275 11.708 1.00 50.10 H new ATOM 0 HG21 THR A 408 1.429 -10.111 11.656 1.00 34.12 H new ATOM 0 HG22 THR A 408 2.629 -9.907 12.953 1.00 34.12 H new ATOM 0 HG23 THR A 408 2.972 -10.995 11.587 1.00 34.12 H new ATOM 1481 N GLY A 409 1.365 -12.678 15.929 1.00 1.41 N ATOM 1482 CA GLY A 409 0.666 -13.381 16.988 1.00 20.22 C ATOM 1483 C GLY A 409 0.605 -12.580 18.273 1.00 32.33 C ATOM 1484 O GLY A 409 0.805 -13.123 19.360 1.00 22.21 O ATOM 0 H GLY A 409 1.396 -11.664 16.035 1.00 1.41 H new ATOM 0 HA2 GLY A 409 -0.347 -13.612 16.659 1.00 20.22 H new ATOM 0 HA3 GLY A 409 1.164 -14.332 17.179 1.00 20.22 H new ATOM 1488 N TRP A 410 0.332 -11.287 18.151 1.00 25.20 N ATOM 1489 CA TRP A 410 0.248 -10.409 19.312 1.00 11.41 C ATOM 1490 C TRP A 410 1.558 -10.412 20.092 1.00 24.01 C ATOM 1491 O TRP A 410 2.261 -11.420 20.140 1.00 30.42 O ATOM 1492 CB TRP A 410 -0.903 -10.843 20.223 1.00 20.53 C ATOM 1493 CG TRP A 410 -2.252 -10.445 19.704 1.00 55.52 C ATOM 1494 CD1 TRP A 410 -3.253 -11.280 19.302 1.00 5.01 C ATOM 1495 CD2 TRP A 410 -2.745 -9.111 19.533 1.00 22.33 C ATOM 1496 NE1 TRP A 410 -4.340 -10.547 18.889 1.00 43.04 N ATOM 1497 CE2 TRP A 410 -4.054 -9.214 19.022 1.00 23.01 C ATOM 1498 CE3 TRP A 410 -2.208 -7.841 19.762 1.00 24.34 C ATOM 1499 CZ2 TRP A 410 -4.830 -8.095 18.737 1.00 53.32 C ATOM 1500 CZ3 TRP A 410 -2.981 -6.732 19.478 1.00 1.23 C ATOM 1501 CH2 TRP A 410 -4.281 -6.863 18.971 1.00 41.33 C ATOM 0 H TRP A 410 0.165 -10.822 17.259 1.00 25.20 H new ATOM 0 HA TRP A 410 0.060 -9.396 18.958 1.00 11.41 H new ATOM 0 HB2 TRP A 410 -0.873 -11.926 20.344 1.00 20.53 H new ATOM 0 HB3 TRP A 410 -0.759 -10.408 21.212 1.00 20.53 H new ATOM 0 HD1 TRP A 410 -3.199 -12.359 19.307 1.00 5.01 H new ATOM 0 HE1 TRP A 410 -5.217 -10.933 18.540 1.00 43.04 H new ATOM 0 HE3 TRP A 410 -1.208 -7.729 20.154 1.00 24.34 H new ATOM 0 HZ2 TRP A 410 -5.831 -8.195 18.345 1.00 53.32 H new ATOM 0 HZ3 TRP A 410 -2.576 -5.746 19.650 1.00 1.23 H new ATOM 0 HH2 TRP A 410 -4.860 -5.976 18.761 1.00 41.33 H new ATOM 1512 N GLY A 411 1.881 -9.276 20.703 1.00 72.43 N ATOM 1513 CA GLY A 411 3.106 -9.170 21.473 1.00 24.12 C ATOM 1514 C GLY A 411 3.380 -10.409 22.302 1.00 21.34 C ATOM 1515 O GLY A 411 2.753 -10.622 23.341 1.00 72.42 O ATOM 0 H GLY A 411 1.316 -8.427 20.678 1.00 72.43 H new ATOM 0 HA2 GLY A 411 3.943 -8.997 20.796 1.00 24.12 H new ATOM 0 HA3 GLY A 411 3.044 -8.303 22.131 1.00 24.12 H new ATOM 1519 N LYS A 412 4.317 -11.232 21.844 1.00 72.54 N ATOM 1520 CA LYS A 412 4.673 -12.457 22.548 1.00 21.32 C ATOM 1521 C LYS A 412 6.178 -12.532 22.784 1.00 62.42 C ATOM 1522 O LYS A 412 6.965 -12.483 21.841 1.00 11.10 O ATOM 1523 CB LYS A 412 4.209 -13.680 21.754 1.00 64.23 C ATOM 1524 CG LYS A 412 3.259 -14.581 22.523 1.00 15.52 C ATOM 1525 CD LYS A 412 3.898 -15.923 22.841 1.00 2.43 C ATOM 1526 CE LYS A 412 3.362 -16.502 24.141 1.00 14.41 C ATOM 1527 NZ LYS A 412 4.115 -16.003 25.324 1.00 40.02 N ATOM 0 H LYS A 412 4.845 -11.072 20.986 1.00 72.54 H new ATOM 0 HA LYS A 412 4.171 -12.448 23.516 1.00 21.32 H new ATOM 0 HB2 LYS A 412 3.718 -13.345 20.840 1.00 64.23 H new ATOM 0 HB3 LYS A 412 5.082 -14.259 21.453 1.00 64.23 H new ATOM 0 HG2 LYS A 412 2.961 -14.090 23.449 1.00 15.52 H new ATOM 0 HG3 LYS A 412 2.352 -14.738 21.939 1.00 15.52 H new ATOM 0 HD2 LYS A 412 3.707 -16.620 22.025 1.00 2.43 H new ATOM 0 HD3 LYS A 412 4.979 -15.804 22.913 1.00 2.43 H new ATOM 0 HE2 LYS A 412 2.308 -16.244 24.246 1.00 14.41 H new ATOM 0 HE3 LYS A 412 3.421 -17.590 24.105 1.00 14.41 H new ATOM 0 HZ1 LYS A 412 3.718 -16.421 26.190 1.00 40.02 H new ATOM 0 HZ2 LYS A 412 5.116 -16.271 25.237 1.00 40.02 H new ATOM 0 HZ3 LYS A 412 4.037 -14.967 25.373 1.00 40.02 H new ATOM 1541 N GLU A 413 6.568 -12.654 24.050 1.00 72.22 N ATOM 1542 CA GLU A 413 7.979 -12.736 24.408 1.00 3.12 C ATOM 1543 C GLU A 413 8.753 -13.565 23.386 1.00 72.32 C ATOM 1544 O GLU A 413 9.770 -13.122 22.853 1.00 63.12 O ATOM 1545 CB GLU A 413 8.140 -13.345 25.801 1.00 32.53 C ATOM 1546 CG GLU A 413 7.232 -14.537 26.053 1.00 72.10 C ATOM 1547 CD GLU A 413 7.220 -14.966 27.507 1.00 51.12 C ATOM 1548 OE1 GLU A 413 8.173 -14.620 28.236 1.00 40.04 O ATOM 1549 OE2 GLU A 413 6.256 -15.647 27.916 1.00 22.24 O ATOM 0 H GLU A 413 5.928 -12.698 24.843 1.00 72.22 H new ATOM 0 HA GLU A 413 8.385 -11.725 24.412 1.00 3.12 H new ATOM 0 HB2 GLU A 413 9.177 -13.654 25.936 1.00 32.53 H new ATOM 0 HB3 GLU A 413 7.936 -12.579 26.549 1.00 32.53 H new ATOM 0 HG2 GLU A 413 6.217 -14.287 25.744 1.00 72.10 H new ATOM 0 HG3 GLU A 413 7.557 -15.373 25.434 1.00 72.10 H new ATOM 1556 N ARG A 414 8.263 -14.771 23.119 1.00 42.41 N ATOM 1557 CA ARG A 414 8.907 -15.664 22.163 1.00 55.11 C ATOM 1558 C ARG A 414 7.966 -16.791 21.752 1.00 63.12 C ATOM 1559 O ARG A 414 7.316 -17.409 22.595 1.00 33.51 O ATOM 1560 CB ARG A 414 10.189 -16.246 22.762 1.00 71.13 C ATOM 1561 CG ARG A 414 10.045 -16.666 24.216 1.00 60.11 C ATOM 1562 CD ARG A 414 10.833 -15.751 25.141 1.00 13.14 C ATOM 1563 NE ARG A 414 12.058 -16.383 25.623 1.00 33.10 N ATOM 1564 CZ ARG A 414 12.964 -15.758 26.367 1.00 14.43 C ATOM 1565 NH1 ARG A 414 12.782 -14.491 26.713 1.00 70.52 N ATOM 1566 NH2 ARG A 414 14.052 -16.400 26.768 1.00 31.14 N ATOM 0 H ARG A 414 7.422 -15.152 23.551 1.00 42.41 H new ATOM 0 HA ARG A 414 9.159 -15.085 21.275 1.00 55.11 H new ATOM 0 HB2 ARG A 414 10.497 -17.109 22.172 1.00 71.13 H new ATOM 0 HB3 ARG A 414 10.985 -15.506 22.683 1.00 71.13 H new ATOM 0 HG2 ARG A 414 8.992 -16.651 24.498 1.00 60.11 H new ATOM 0 HG3 ARG A 414 10.392 -17.692 24.335 1.00 60.11 H new ATOM 0 HD2 ARG A 414 11.083 -14.831 24.613 1.00 13.14 H new ATOM 0 HD3 ARG A 414 10.211 -15.472 25.991 1.00 13.14 H new ATOM 0 HE ARG A 414 12.227 -17.358 25.375 1.00 33.10 H new ATOM 0 HH11 ARG A 414 11.945 -13.994 26.408 1.00 70.52 H new ATOM 0 HH12 ARG A 414 13.479 -14.013 27.284 1.00 70.52 H new ATOM 0 HH21 ARG A 414 14.195 -17.375 26.505 1.00 31.14 H new ATOM 0 HH22 ARG A 414 14.747 -15.919 27.339 1.00 31.14 H new TER 1580 ARG A 414