USER MOD reduce.3.24.130724 H: found=0, std=0, add=1562, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 1555 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 110 SER OG : rot 170:sc= -0.194 USER MOD Set 1.2: A 120 LYS NZ :NH3+ 144:sc= 1.25 (180deg=1.06) USER MOD Set 1.3: A 159 HIS : no HE2:sc= 0.445 K(o=1.5,f=-3.8!) USER MOD Set 2.1: A 105 SER OG : rot 180:sc= -0.164 USER MOD Set 2.2: A 108 THR OG1 : rot 84:sc= 0.977 USER MOD Set 3.1: A 74 TYR OH : rot -146:sc= 1.08 USER MOD Set 3.2: A 103 GLN : amide:sc= 1.07 K(o=1.7,f=-0.29) USER MOD Set 3.3: A 104 HIS : no HD1:sc= -0.429 X(o=1.7,f=1.6) USER MOD Set 4.1: A 45 ASN : amide:sc= -0.0855 X(o=1.9,f=1.6) USER MOD Set 4.2: A 49 ASN : amide:sc= 2 K(o=1.9,f=-5!) USER MOD Set 5.1: A 22 MET CE :methyl 165:sc= -0.518 (180deg=-1.18) USER MOD Set 5.2: A 26 THR OG1 : rot 82:sc= 0.0325 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 MET CE :methyl 141:sc= -0.162 (180deg=-0.767) USER MOD Single : A 3 ASN : amide:sc= -0.0732 X(o=-0.073,f=0) USER MOD Single : A 4 THR OG1 : rot -37:sc= 0.422 USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 ASN : amide:sc= -1.2 X(o=-1.2,f=-1.7) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 18 SER OG : rot 171:sc= 0.291 USER MOD Single : A 21 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 SER OG : rot 170:sc= 0.013 USER MOD Single : A 42 SER OG : rot -160:sc= -0.13 USER MOD Single : A 52 SER OG : rot 74:sc= 1.34 USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 SER OG : rot -138:sc= 1.29 USER MOD Single : A 59 HIS : no HE2:sc= 0.34 K(o=0.34,f=-2.6!) USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 77 THR OG1 : rot 67:sc= 0.878 USER MOD Single : A 82 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.081) USER MOD Single : A 83 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0885) USER MOD Single : A 90 GLN : amide:sc= 0.46 K(o=0.46,f=-6!) USER MOD Single : A 91 TYR OH : rot 43:sc= 1.25 USER MOD Single : A 92 GLN : amide:sc= -0.227 X(o=-0.23,f=0) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 ASN : amide:sc= -0.113 K(o=-0.11,f=-11!) USER MOD Single : A 98 GLN : amide:sc= -5.29 K(o=-5.3,f=-8.8!) USER MOD Single : A 100 TYR OH : rot 177:sc= 1.01 USER MOD Single : A 101 MET CE :methyl 151:sc= -1.46 (180deg=-2.86!) USER MOD Single : A 102 HIS : no HE2:sc= -0.655 K(o=-0.66,f=-2.3) USER MOD Single : A 107 HIS :FLIP no HD1:sc= -0.202 F(o=-0.84,f=-0.2) USER MOD Single : A 111 TYR OH : rot -30:sc= 0 USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 114 SER OG : rot -119:sc= 0.036 USER MOD Single : A 118 MET CE :methyl -140:sc= -0.638 (180deg=-5.3!) USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 121 TYR OH : rot -118:sc= 1.1 USER MOD Single : A 125 CYS SG : rot -97:sc= 0.86 USER MOD Single : A 126 THR OG1 : rot 180:sc= -0.206 USER MOD Single : A 133 ASN : amide:sc= 0.613 K(o=0.61,f=-9!) USER MOD Single : A 141 TYR OH : rot 180:sc= 0 USER MOD Single : A 144 TYR OH : rot 30:sc= 0 USER MOD Single : A 151 ASN : amide:sc= 1.68 K(o=1.7,f=-0.021) USER MOD Single : A 153 GLN : amide:sc= 0 X(o=0,f=-0.0029) USER MOD Single : A 157 THR OG1 : rot 120:sc= 0.166 USER MOD Single : A 163 ASN : amide:sc= 0 K(o=0,f=-0.71) USER MOD Single : A 167 MET CE :methyl 179:sc= -0.0396 (180deg=-0.0408) USER MOD Single : A 170 TYR OH : rot -163:sc= 0.592 USER MOD Single : A 171 GLN : amide:sc= -0.0347 K(o=-0.035,f=-0.71) USER MOD Single : A 172 THR OG1 : rot 85:sc= 0.334 USER MOD Single : A 175 SER OG : rot 180:sc= 0.112 USER MOD Single : A 176 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 177 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 178 ASN : amide:sc= 0.0452 X(o=0.045,f=-0.38) USER MOD Single : A 180 GLN : amide:sc= -0.177 K(o=-0.18,f=-1.1) USER MOD Single : A 182 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 184 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 185 ASN : amide:sc= 0 X(o=0,f=-0.016) USER MOD Single : A 189 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 190 ASN : amide:sc= 0.219 K(o=0.22,f=-2.5!) USER MOD Single : A 191 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -14.435 -16.574 -6.324 1.00 21.54 N ATOM 2 CA GLY A 1 -14.234 -17.420 -5.142 1.00 5.10 C ATOM 3 C GLY A 1 -12.830 -17.284 -4.597 1.00 61.31 C ATOM 4 O GLY A 1 -11.869 -17.374 -5.362 1.00 73.45 O ATOM 0 H1 GLY A 1 -15.408 -16.691 -6.673 1.00 21.54 H new ATOM 0 H2 GLY A 1 -14.276 -15.578 -6.069 1.00 21.54 H new ATOM 0 H3 GLY A 1 -13.764 -16.853 -7.068 1.00 21.54 H new ATOM 0 HA2 GLY A 1 -14.953 -17.146 -4.370 1.00 5.10 H new ATOM 0 HA3 GLY A 1 -14.426 -18.461 -5.401 1.00 5.10 H new ATOM 8 N MET A 2 -12.672 -17.123 -3.279 1.00 34.44 N ATOM 9 CA MET A 2 -11.376 -17.326 -2.642 1.00 1.00 C ATOM 10 C MET A 2 -11.195 -18.828 -2.485 1.00 10.15 C ATOM 11 O MET A 2 -11.572 -19.384 -1.451 1.00 4.34 O ATOM 12 CB MET A 2 -11.267 -16.570 -1.307 1.00 2.33 C ATOM 13 CG MET A 2 -10.013 -16.933 -0.486 1.00 32.53 C ATOM 14 SD MET A 2 -8.447 -17.158 -1.388 1.00 73.23 S ATOM 15 CE MET A 2 -8.095 -18.917 -1.067 1.00 74.11 C ATOM 0 H MET A 2 -13.421 -16.855 -2.641 1.00 34.44 H new ATOM 0 HA MET A 2 -10.574 -16.916 -3.256 1.00 1.00 H new ATOM 0 HB2 MET A 2 -11.261 -15.498 -1.507 1.00 2.33 H new ATOM 0 HB3 MET A 2 -12.154 -16.778 -0.709 1.00 2.33 H new ATOM 0 HG2 MET A 2 -9.862 -16.152 0.259 1.00 32.53 H new ATOM 0 HG3 MET A 2 -10.223 -17.855 0.057 1.00 32.53 H new ATOM 0 HE1 MET A 2 -7.685 -19.376 -1.967 1.00 74.11 H new ATOM 0 HE2 MET A 2 -7.373 -19.001 -0.255 1.00 74.11 H new ATOM 0 HE3 MET A 2 -9.017 -19.427 -0.787 1.00 74.11 H new ATOM 25 N ASN A 3 -10.634 -19.488 -3.505 1.00 54.21 N ATOM 26 CA ASN A 3 -10.354 -20.914 -3.421 1.00 21.21 C ATOM 27 C ASN A 3 -8.967 -21.240 -3.937 1.00 22.54 C ATOM 28 O ASN A 3 -8.085 -21.607 -3.166 1.00 2.21 O ATOM 29 CB ASN A 3 -11.393 -21.782 -4.131 1.00 41.20 C ATOM 30 CG ASN A 3 -12.809 -21.597 -3.617 1.00 74.44 C ATOM 31 OD1 ASN A 3 -13.316 -22.402 -2.845 1.00 32.24 O ATOM 32 ND2 ASN A 3 -13.480 -20.568 -4.089 1.00 11.42 N ATOM 0 H ASN A 3 -10.369 -19.055 -4.390 1.00 54.21 H new ATOM 0 HA ASN A 3 -10.407 -21.156 -2.360 1.00 21.21 H new ATOM 0 HB2 ASN A 3 -11.372 -21.556 -5.197 1.00 41.20 H new ATOM 0 HB3 ASN A 3 -11.112 -22.829 -4.022 1.00 41.20 H new ATOM 0 HD21 ASN A 3 -14.451 -20.423 -3.813 1.00 11.42 H new ATOM 0 HD22 ASN A 3 -13.029 -19.916 -4.730 1.00 11.42 H new ATOM 39 N THR A 4 -8.760 -21.121 -5.242 1.00 41.24 N ATOM 40 CA THR A 4 -7.559 -21.573 -5.930 1.00 70.43 C ATOM 41 C THR A 4 -6.708 -20.360 -6.295 1.00 3.43 C ATOM 42 O THR A 4 -6.045 -20.308 -7.333 1.00 24.25 O ATOM 43 CB THR A 4 -7.987 -22.487 -7.093 1.00 44.43 C ATOM 44 OG1 THR A 4 -6.880 -22.967 -7.832 1.00 12.14 O ATOM 45 CG2 THR A 4 -8.965 -21.817 -8.061 1.00 24.53 C ATOM 0 H THR A 4 -9.443 -20.695 -5.868 1.00 41.24 H new ATOM 0 HA THR A 4 -6.907 -22.185 -5.306 1.00 70.43 H new ATOM 0 HB THR A 4 -8.495 -23.322 -6.611 1.00 44.43 H new ATOM 0 HG1 THR A 4 -6.202 -22.263 -7.900 1.00 12.14 H new ATOM 0 HG21 THR A 4 -9.226 -22.515 -8.856 1.00 24.53 H new ATOM 0 HG22 THR A 4 -9.867 -21.526 -7.523 1.00 24.53 H new ATOM 0 HG23 THR A 4 -8.499 -20.932 -8.494 1.00 24.53 H new ATOM 53 N VAL A 5 -6.736 -19.361 -5.420 1.00 14.13 N ATOM 54 CA VAL A 5 -6.088 -18.087 -5.631 1.00 31.42 C ATOM 55 C VAL A 5 -4.604 -18.309 -5.391 1.00 52.44 C ATOM 56 O VAL A 5 -4.098 -18.284 -4.274 1.00 52.31 O ATOM 57 CB VAL A 5 -6.691 -17.028 -4.702 1.00 53.23 C ATOM 58 CG1 VAL A 5 -6.070 -15.652 -4.938 1.00 71.41 C ATOM 59 CG2 VAL A 5 -8.217 -16.882 -4.815 1.00 34.31 C ATOM 0 H VAL A 5 -7.223 -19.423 -4.526 1.00 14.13 H new ATOM 0 HA VAL A 5 -6.238 -17.712 -6.644 1.00 31.42 H new ATOM 0 HB VAL A 5 -6.460 -17.393 -3.701 1.00 53.23 H new ATOM 0 HG11 VAL A 5 -6.523 -14.928 -4.261 1.00 71.41 H new ATOM 0 HG12 VAL A 5 -4.997 -15.700 -4.753 1.00 71.41 H new ATOM 0 HG13 VAL A 5 -6.247 -15.345 -5.969 1.00 71.41 H new ATOM 0 HG21 VAL A 5 -8.561 -16.112 -4.124 1.00 34.31 H new ATOM 0 HG22 VAL A 5 -8.481 -16.599 -5.834 1.00 34.31 H new ATOM 0 HG23 VAL A 5 -8.693 -17.831 -4.567 1.00 34.31 H new ATOM 69 N LYS A 6 -3.888 -18.551 -6.475 1.00 24.55 N ATOM 70 CA LYS A 6 -2.465 -18.861 -6.441 1.00 33.13 C ATOM 71 C LYS A 6 -1.680 -17.891 -7.321 1.00 71.50 C ATOM 72 O LYS A 6 -0.511 -18.127 -7.630 1.00 12.05 O ATOM 73 CB LYS A 6 -2.307 -20.334 -6.834 1.00 10.31 C ATOM 74 CG LYS A 6 -2.713 -21.302 -5.701 1.00 61.21 C ATOM 75 CD LYS A 6 -1.514 -21.869 -4.922 1.00 64.43 C ATOM 76 CE LYS A 6 -0.896 -20.838 -3.970 1.00 64.40 C ATOM 77 NZ LYS A 6 0.458 -21.233 -3.537 1.00 51.12 N ATOM 0 H LYS A 6 -4.281 -18.538 -7.416 1.00 24.55 H new ATOM 0 HA LYS A 6 -2.046 -18.729 -5.443 1.00 33.13 H new ATOM 0 HB2 LYS A 6 -2.915 -20.538 -7.715 1.00 10.31 H new ATOM 0 HB3 LYS A 6 -1.270 -20.522 -7.112 1.00 10.31 H new ATOM 0 HG2 LYS A 6 -3.374 -20.781 -5.008 1.00 61.21 H new ATOM 0 HG3 LYS A 6 -3.284 -22.128 -6.126 1.00 61.21 H new ATOM 0 HD2 LYS A 6 -1.834 -22.741 -4.351 1.00 64.43 H new ATOM 0 HD3 LYS A 6 -0.755 -22.210 -5.626 1.00 64.43 H new ATOM 0 HE2 LYS A 6 -0.851 -19.868 -4.465 1.00 64.40 H new ATOM 0 HE3 LYS A 6 -1.537 -20.720 -3.096 1.00 64.40 H new ATOM 0 HZ1 LYS A 6 0.842 -20.511 -2.895 1.00 51.12 H new ATOM 0 HZ2 LYS A 6 0.412 -22.147 -3.042 1.00 51.12 H new ATOM 0 HZ3 LYS A 6 1.077 -21.321 -4.368 1.00 51.12 H new ATOM 91 N ASN A 7 -2.327 -16.815 -7.763 1.00 12.32 N ATOM 92 CA ASN A 7 -1.819 -15.871 -8.751 1.00 65.14 C ATOM 93 C ASN A 7 -2.678 -14.620 -8.755 1.00 51.24 C ATOM 94 O ASN A 7 -3.784 -14.617 -8.234 1.00 34.21 O ATOM 95 CB ASN A 7 -1.872 -16.472 -10.162 1.00 70.11 C ATOM 96 CG ASN A 7 -3.245 -17.038 -10.502 1.00 61.23 C ATOM 97 OD1 ASN A 7 -3.622 -18.099 -10.023 1.00 13.13 O ATOM 98 ND2 ASN A 7 -4.054 -16.341 -11.275 1.00 2.15 N ATOM 0 H ASN A 7 -3.258 -16.568 -7.427 1.00 12.32 H new ATOM 0 HA ASN A 7 -0.788 -15.638 -8.485 1.00 65.14 H new ATOM 0 HB2 ASN A 7 -1.608 -15.705 -10.890 1.00 70.11 H new ATOM 0 HB3 ASN A 7 -1.126 -17.262 -10.246 1.00 70.11 H new ATOM 0 HD21 ASN A 7 -4.993 -16.686 -11.473 1.00 2.15 H new ATOM 0 HD22 ASN A 7 -3.741 -15.456 -11.675 1.00 2.15 H new ATOM 105 N LYS A 8 -2.191 -13.573 -9.416 1.00 71.10 N ATOM 106 CA LYS A 8 -2.798 -12.251 -9.522 1.00 32.43 C ATOM 107 C LYS A 8 -4.239 -12.289 -10.024 1.00 31.11 C ATOM 108 O LYS A 8 -5.102 -11.666 -9.415 1.00 74.55 O ATOM 109 CB LYS A 8 -1.917 -11.471 -10.503 1.00 3.14 C ATOM 110 CG LYS A 8 -2.383 -10.053 -10.868 1.00 54.43 C ATOM 111 CD LYS A 8 -1.506 -9.467 -11.985 1.00 2.34 C ATOM 112 CE LYS A 8 -2.102 -8.152 -12.499 1.00 42.11 C ATOM 113 NZ LYS A 8 -1.335 -7.596 -13.630 1.00 10.22 N ATOM 0 H LYS A 8 -1.308 -13.630 -9.923 1.00 71.10 H new ATOM 0 HA LYS A 8 -2.850 -11.787 -8.537 1.00 32.43 H new ATOM 0 HB2 LYS A 8 -0.915 -11.402 -10.080 1.00 3.14 H new ATOM 0 HB3 LYS A 8 -1.836 -12.050 -11.423 1.00 3.14 H new ATOM 0 HG2 LYS A 8 -3.424 -10.078 -11.191 1.00 54.43 H new ATOM 0 HG3 LYS A 8 -2.337 -9.411 -9.988 1.00 54.43 H new ATOM 0 HD2 LYS A 8 -0.497 -9.294 -11.611 1.00 2.34 H new ATOM 0 HD3 LYS A 8 -1.424 -10.181 -12.804 1.00 2.34 H new ATOM 0 HE2 LYS A 8 -3.133 -8.320 -12.809 1.00 42.11 H new ATOM 0 HE3 LYS A 8 -2.127 -7.425 -11.687 1.00 42.11 H new ATOM 0 HZ1 LYS A 8 -1.775 -6.707 -13.944 1.00 10.22 H new ATOM 0 HZ2 LYS A 8 -0.357 -7.411 -13.329 1.00 10.22 H new ATOM 0 HZ3 LYS A 8 -1.332 -8.277 -14.416 1.00 10.22 H new ATOM 127 N GLN A 9 -4.486 -12.945 -11.159 1.00 11.43 N ATOM 128 CA GLN A 9 -5.755 -12.894 -11.887 1.00 22.31 C ATOM 129 C GLN A 9 -6.910 -13.344 -10.992 1.00 52.33 C ATOM 130 O GLN A 9 -7.958 -12.705 -10.949 1.00 41.34 O ATOM 131 CB GLN A 9 -5.628 -13.784 -13.135 1.00 41.02 C ATOM 132 CG GLN A 9 -6.398 -13.306 -14.371 1.00 62.23 C ATOM 133 CD GLN A 9 -5.451 -13.229 -15.565 1.00 41.15 C ATOM 134 OE1 GLN A 9 -5.022 -14.239 -16.114 1.00 52.24 O ATOM 135 NE2 GLN A 9 -4.995 -12.038 -15.918 1.00 1.42 N ATOM 0 H GLN A 9 -3.792 -13.542 -11.609 1.00 11.43 H new ATOM 0 HA GLN A 9 -5.974 -11.871 -12.193 1.00 22.31 H new ATOM 0 HB2 GLN A 9 -4.573 -13.865 -13.395 1.00 41.02 H new ATOM 0 HB3 GLN A 9 -5.971 -14.787 -12.881 1.00 41.02 H new ATOM 0 HG2 GLN A 9 -7.218 -13.990 -14.588 1.00 62.23 H new ATOM 0 HG3 GLN A 9 -6.840 -12.328 -14.181 1.00 62.23 H new ATOM 0 HE21 GLN A 9 -5.352 -11.199 -15.461 1.00 1.42 H new ATOM 0 HE22 GLN A 9 -4.286 -11.959 -16.647 1.00 1.42 H new ATOM 144 N GLU A 10 -6.666 -14.399 -10.215 1.00 30.34 N ATOM 145 CA GLU A 10 -7.591 -14.955 -9.240 1.00 74.51 C ATOM 146 C GLU A 10 -8.011 -13.900 -8.202 1.00 30.11 C ATOM 147 O GLU A 10 -9.147 -13.888 -7.741 1.00 11.02 O ATOM 148 CB GLU A 10 -6.885 -16.142 -8.564 1.00 33.23 C ATOM 149 CG GLU A 10 -6.682 -17.408 -9.407 1.00 33.45 C ATOM 150 CD GLU A 10 -7.863 -18.373 -9.506 1.00 52.33 C ATOM 151 OE1 GLU A 10 -8.901 -18.161 -8.845 1.00 22.14 O ATOM 152 OE2 GLU A 10 -7.746 -19.332 -10.312 1.00 64.11 O ATOM 0 H GLU A 10 -5.782 -14.907 -10.253 1.00 30.34 H new ATOM 0 HA GLU A 10 -8.505 -15.284 -9.734 1.00 74.51 H new ATOM 0 HB2 GLU A 10 -5.907 -15.803 -8.222 1.00 33.23 H new ATOM 0 HB3 GLU A 10 -7.456 -16.415 -7.677 1.00 33.23 H new ATOM 0 HG2 GLU A 10 -6.409 -17.102 -10.417 1.00 33.45 H new ATOM 0 HG3 GLU A 10 -5.832 -17.954 -8.999 1.00 33.45 H new ATOM 159 N ILE A 11 -7.102 -13.002 -7.832 1.00 2.43 N ATOM 160 CA ILE A 11 -7.314 -11.961 -6.823 1.00 65.35 C ATOM 161 C ILE A 11 -7.992 -10.734 -7.444 1.00 71.32 C ATOM 162 O ILE A 11 -8.800 -10.072 -6.794 1.00 63.33 O ATOM 163 CB ILE A 11 -5.975 -11.507 -6.199 1.00 70.15 C ATOM 164 CG1 ILE A 11 -5.004 -12.647 -5.843 1.00 2.13 C ATOM 165 CG2 ILE A 11 -6.244 -10.653 -4.949 1.00 44.35 C ATOM 166 CD1 ILE A 11 -3.568 -12.183 -5.624 1.00 13.31 C ATOM 0 H ILE A 11 -6.166 -12.976 -8.238 1.00 2.43 H new ATOM 0 HA ILE A 11 -7.951 -12.391 -6.050 1.00 65.35 H new ATOM 0 HB ILE A 11 -5.477 -10.926 -6.976 1.00 70.15 H new ATOM 0 HG12 ILE A 11 -5.357 -13.145 -4.940 1.00 2.13 H new ATOM 0 HG13 ILE A 11 -5.019 -13.388 -6.642 1.00 2.13 H new ATOM 0 HG21 ILE A 11 -5.296 -10.336 -4.514 1.00 44.35 H new ATOM 0 HG22 ILE A 11 -6.827 -9.775 -5.227 1.00 44.35 H new ATOM 0 HG23 ILE A 11 -6.800 -11.242 -4.219 1.00 44.35 H new ATOM 0 HD11 ILE A 11 -2.942 -13.041 -5.377 1.00 13.31 H new ATOM 0 HD12 ILE A 11 -3.195 -11.712 -6.533 1.00 13.31 H new ATOM 0 HD13 ILE A 11 -3.539 -11.465 -4.805 1.00 13.31 H new ATOM 178 N LEU A 12 -7.650 -10.384 -8.685 1.00 1.32 N ATOM 179 CA LEU A 12 -8.221 -9.219 -9.362 1.00 33.43 C ATOM 180 C LEU A 12 -9.737 -9.384 -9.536 1.00 25.20 C ATOM 181 O LEU A 12 -10.472 -8.398 -9.495 1.00 30.24 O ATOM 182 CB LEU A 12 -7.524 -9.019 -10.721 1.00 1.41 C ATOM 183 CG LEU A 12 -6.443 -7.921 -10.747 1.00 33.31 C ATOM 184 CD1 LEU A 12 -5.402 -7.990 -9.623 1.00 10.32 C ATOM 185 CD2 LEU A 12 -5.694 -8.002 -12.081 1.00 50.12 C ATOM 0 H LEU A 12 -6.972 -10.898 -9.247 1.00 1.32 H new ATOM 0 HA LEU A 12 -8.055 -8.332 -8.751 1.00 33.43 H new ATOM 0 HB2 LEU A 12 -7.068 -9.963 -11.020 1.00 1.41 H new ATOM 0 HB3 LEU A 12 -8.281 -8.780 -11.468 1.00 1.41 H new ATOM 0 HG LEU A 12 -6.982 -6.984 -10.607 1.00 33.31 H new ATOM 0 HD11 LEU A 12 -4.690 -7.173 -9.736 1.00 10.32 H new ATOM 0 HD12 LEU A 12 -5.902 -7.905 -8.658 1.00 10.32 H new ATOM 0 HD13 LEU A 12 -4.873 -8.942 -9.675 1.00 10.32 H new ATOM 0 HD21 LEU A 12 -4.925 -7.230 -12.114 1.00 50.12 H new ATOM 0 HD22 LEU A 12 -5.228 -8.983 -12.178 1.00 50.12 H new ATOM 0 HD23 LEU A 12 -6.395 -7.851 -12.902 1.00 50.12 H new ATOM 197 N GLU A 13 -10.227 -10.622 -9.648 1.00 41.32 N ATOM 198 CA GLU A 13 -11.646 -10.923 -9.572 1.00 50.15 C ATOM 199 C GLU A 13 -12.205 -10.514 -8.203 1.00 25.40 C ATOM 200 O GLU A 13 -13.234 -9.844 -8.140 1.00 54.13 O ATOM 201 CB GLU A 13 -11.859 -12.417 -9.859 1.00 74.52 C ATOM 202 CG GLU A 13 -11.584 -12.756 -11.321 1.00 25.14 C ATOM 203 CD GLU A 13 -11.681 -14.241 -11.686 1.00 63.54 C ATOM 204 OE1 GLU A 13 -12.227 -15.079 -10.921 1.00 73.52 O ATOM 205 OE2 GLU A 13 -11.229 -14.558 -12.815 1.00 32.50 O ATOM 0 H GLU A 13 -9.641 -11.444 -9.795 1.00 41.32 H new ATOM 0 HA GLU A 13 -12.191 -10.350 -10.322 1.00 50.15 H new ATOM 0 HB2 GLU A 13 -11.203 -13.008 -9.219 1.00 74.52 H new ATOM 0 HB3 GLU A 13 -12.883 -12.693 -9.608 1.00 74.52 H new ATOM 0 HG2 GLU A 13 -12.287 -12.201 -11.942 1.00 25.14 H new ATOM 0 HG3 GLU A 13 -10.585 -12.402 -11.576 1.00 25.14 H new ATOM 212 N ALA A 14 -11.505 -10.851 -7.111 1.00 22.41 N ATOM 213 CA ALA A 14 -11.974 -10.646 -5.743 1.00 72.12 C ATOM 214 C ALA A 14 -12.133 -9.161 -5.429 1.00 30.34 C ATOM 215 O ALA A 14 -13.034 -8.767 -4.696 1.00 65.42 O ATOM 216 CB ALA A 14 -10.982 -11.263 -4.753 1.00 1.20 C ATOM 0 H ALA A 14 -10.581 -11.281 -7.160 1.00 22.41 H new ATOM 0 HA ALA A 14 -12.946 -11.129 -5.648 1.00 72.12 H new ATOM 0 HB1 ALA A 14 -11.339 -11.106 -3.735 1.00 1.20 H new ATOM 0 HB2 ALA A 14 -10.893 -12.332 -4.946 1.00 1.20 H new ATOM 0 HB3 ALA A 14 -10.007 -10.791 -4.873 1.00 1.20 H new ATOM 222 N PHE A 15 -11.246 -8.334 -5.980 1.00 12.11 N ATOM 223 CA PHE A 15 -11.324 -6.889 -5.873 1.00 70.41 C ATOM 224 C PHE A 15 -12.694 -6.399 -6.331 1.00 52.13 C ATOM 225 O PHE A 15 -13.408 -5.748 -5.571 1.00 33.20 O ATOM 226 CB PHE A 15 -10.195 -6.272 -6.708 1.00 72.54 C ATOM 227 CG PHE A 15 -10.394 -4.805 -7.005 1.00 44.44 C ATOM 228 CD1 PHE A 15 -10.200 -3.856 -5.991 1.00 5.42 C ATOM 229 CD2 PHE A 15 -10.868 -4.402 -8.270 1.00 12.11 C ATOM 230 CE1 PHE A 15 -10.493 -2.507 -6.238 1.00 33.52 C ATOM 231 CE2 PHE A 15 -11.165 -3.052 -8.517 1.00 53.44 C ATOM 232 CZ PHE A 15 -10.972 -2.106 -7.498 1.00 72.45 C ATOM 0 H PHE A 15 -10.444 -8.659 -6.520 1.00 12.11 H new ATOM 0 HA PHE A 15 -11.202 -6.581 -4.835 1.00 70.41 H new ATOM 0 HB2 PHE A 15 -9.251 -6.402 -6.179 1.00 72.54 H new ATOM 0 HB3 PHE A 15 -10.111 -6.816 -7.649 1.00 72.54 H new ATOM 0 HD1 PHE A 15 -9.827 -4.162 -5.025 1.00 5.42 H new ATOM 0 HD2 PHE A 15 -11.003 -5.134 -9.052 1.00 12.11 H new ATOM 0 HE1 PHE A 15 -10.350 -1.774 -5.458 1.00 33.52 H new ATOM 0 HE2 PHE A 15 -11.539 -2.744 -9.482 1.00 53.44 H new ATOM 0 HZ PHE A 15 -11.192 -1.065 -7.683 1.00 72.45 H new ATOM 242 N ARG A 16 -13.044 -6.675 -7.588 1.00 71.24 N ATOM 243 CA ARG A 16 -14.269 -6.148 -8.185 1.00 13.03 C ATOM 244 C ARG A 16 -15.505 -6.817 -7.582 1.00 22.44 C ATOM 245 O ARG A 16 -16.584 -6.234 -7.614 1.00 30.34 O ATOM 246 CB ARG A 16 -14.213 -6.331 -9.699 1.00 4.44 C ATOM 247 CG ARG A 16 -15.263 -5.489 -10.456 1.00 53.33 C ATOM 248 CD ARG A 16 -14.605 -4.834 -11.677 1.00 33.10 C ATOM 249 NE ARG A 16 -15.557 -4.423 -12.727 1.00 64.41 N ATOM 250 CZ ARG A 16 -16.009 -5.171 -13.742 1.00 72.12 C ATOM 251 NH1 ARG A 16 -15.728 -6.474 -13.809 1.00 72.15 N ATOM 252 NH2 ARG A 16 -16.748 -4.614 -14.694 1.00 24.54 N ATOM 0 H ARG A 16 -12.493 -7.263 -8.213 1.00 71.24 H new ATOM 0 HA ARG A 16 -14.347 -5.083 -7.966 1.00 13.03 H new ATOM 0 HB2 ARG A 16 -13.218 -6.062 -10.054 1.00 4.44 H new ATOM 0 HB3 ARG A 16 -14.363 -7.384 -9.936 1.00 4.44 H new ATOM 0 HG2 ARG A 16 -16.093 -6.121 -10.771 1.00 53.33 H new ATOM 0 HG3 ARG A 16 -15.676 -4.725 -9.798 1.00 53.33 H new ATOM 0 HD2 ARG A 16 -14.044 -3.959 -11.348 1.00 33.10 H new ATOM 0 HD3 ARG A 16 -13.886 -5.531 -12.107 1.00 33.10 H new ATOM 0 HE ARG A 16 -15.908 -3.467 -12.674 1.00 64.41 H new ATOM 0 HH11 ARG A 16 -15.163 -6.912 -13.082 1.00 72.15 H new ATOM 0 HH12 ARG A 16 -16.079 -7.032 -14.588 1.00 72.15 H new ATOM 0 HH21 ARG A 16 -16.970 -3.619 -14.651 1.00 24.54 H new ATOM 0 HH22 ARG A 16 -17.094 -5.181 -15.468 1.00 24.54 H new ATOM 266 N GLU A 17 -15.361 -8.022 -7.030 1.00 64.23 N ATOM 267 CA GLU A 17 -16.408 -8.735 -6.307 1.00 71.54 C ATOM 268 C GLU A 17 -16.810 -8.035 -5.002 1.00 42.15 C ATOM 269 O GLU A 17 -17.779 -8.467 -4.370 1.00 74.45 O ATOM 270 CB GLU A 17 -15.927 -10.159 -6.003 1.00 33.14 C ATOM 271 CG GLU A 17 -16.105 -11.100 -7.198 1.00 22.23 C ATOM 272 CD GLU A 17 -17.524 -11.666 -7.252 1.00 10.23 C ATOM 273 OE1 GLU A 17 -17.842 -12.529 -6.405 1.00 41.34 O ATOM 274 OE2 GLU A 17 -18.307 -11.221 -8.126 1.00 14.33 O ATOM 0 H GLU A 17 -14.485 -8.542 -7.076 1.00 64.23 H new ATOM 0 HA GLU A 17 -17.293 -8.754 -6.943 1.00 71.54 H new ATOM 0 HB2 GLU A 17 -14.875 -10.132 -5.718 1.00 33.14 H new ATOM 0 HB3 GLU A 17 -16.478 -10.552 -5.149 1.00 33.14 H new ATOM 0 HG2 GLU A 17 -15.890 -10.563 -8.122 1.00 22.23 H new ATOM 0 HG3 GLU A 17 -15.387 -11.918 -7.130 1.00 22.23 H new ATOM 281 N SER A 18 -16.110 -6.981 -4.567 1.00 31.10 N ATOM 282 CA SER A 18 -16.542 -6.160 -3.448 1.00 2.23 C ATOM 283 C SER A 18 -16.848 -4.746 -3.940 1.00 12.34 C ATOM 284 O SER A 18 -16.048 -4.148 -4.664 1.00 71.25 O ATOM 285 CB SER A 18 -15.476 -6.171 -2.362 1.00 44.12 C ATOM 286 OG SER A 18 -15.859 -5.343 -1.271 1.00 33.21 O ATOM 0 H SER A 18 -15.230 -6.680 -4.985 1.00 31.10 H new ATOM 0 HA SER A 18 -17.456 -6.565 -3.014 1.00 2.23 H new ATOM 0 HB2 SER A 18 -15.317 -7.191 -2.012 1.00 44.12 H new ATOM 0 HB3 SER A 18 -14.528 -5.824 -2.773 1.00 44.12 H new ATOM 0 HG SER A 18 -15.233 -5.471 -0.528 1.00 33.21 H new ATOM 292 N PRO A 19 -18.003 -4.195 -3.532 1.00 12.11 N ATOM 293 CA PRO A 19 -18.396 -2.841 -3.840 1.00 1.20 C ATOM 294 C PRO A 19 -17.458 -1.869 -3.133 1.00 10.13 C ATOM 295 O PRO A 19 -16.939 -0.978 -3.790 1.00 42.15 O ATOM 296 CB PRO A 19 -19.849 -2.715 -3.372 1.00 41.34 C ATOM 297 CG PRO A 19 -19.990 -3.768 -2.275 1.00 44.24 C ATOM 298 CD PRO A 19 -18.961 -4.815 -2.639 1.00 34.23 C ATOM 0 HA PRO A 19 -18.330 -2.605 -4.902 1.00 1.20 H new ATOM 0 HB2 PRO A 19 -20.058 -1.715 -2.992 1.00 41.34 H new ATOM 0 HB3 PRO A 19 -20.547 -2.898 -4.189 1.00 41.34 H new ATOM 0 HG2 PRO A 19 -19.798 -3.345 -1.289 1.00 44.24 H new ATOM 0 HG3 PRO A 19 -20.996 -4.188 -2.251 1.00 44.24 H new ATOM 0 HD2 PRO A 19 -18.464 -5.190 -1.745 1.00 34.23 H new ATOM 0 HD3 PRO A 19 -19.437 -5.669 -3.121 1.00 34.23 H new ATOM 306 N ASP A 20 -17.217 -2.033 -1.826 1.00 51.32 N ATOM 307 CA ASP A 20 -16.458 -1.052 -1.045 1.00 70.11 C ATOM 308 C ASP A 20 -15.007 -1.039 -1.498 1.00 32.43 C ATOM 309 O ASP A 20 -14.430 0.027 -1.696 1.00 73.41 O ATOM 310 CB ASP A 20 -16.550 -1.302 0.469 1.00 3.41 C ATOM 311 CG ASP A 20 -17.705 -0.485 1.053 1.00 24.23 C ATOM 312 OD1 ASP A 20 -17.501 0.721 1.348 1.00 34.51 O ATOM 313 OD2 ASP A 20 -18.826 -1.035 1.097 1.00 51.45 O ATOM 0 H ASP A 20 -17.538 -2.838 -1.288 1.00 51.32 H new ATOM 0 HA ASP A 20 -16.905 -0.075 -1.228 1.00 70.11 H new ATOM 0 HB2 ASP A 20 -16.706 -2.363 0.664 1.00 3.41 H new ATOM 0 HB3 ASP A 20 -15.613 -1.024 0.952 1.00 3.41 H new ATOM 318 N MET A 21 -14.424 -2.216 -1.738 1.00 41.23 N ATOM 319 CA MET A 21 -13.041 -2.348 -2.176 1.00 3.00 C ATOM 320 C MET A 21 -12.804 -1.536 -3.446 1.00 5.00 C ATOM 321 O MET A 21 -11.770 -0.875 -3.582 1.00 72.55 O ATOM 322 CB MET A 21 -12.725 -3.831 -2.428 1.00 50.44 C ATOM 323 CG MET A 21 -11.237 -4.152 -2.298 1.00 41.05 C ATOM 324 SD MET A 21 -10.688 -4.147 -0.572 1.00 23.11 S ATOM 325 CE MET A 21 -9.552 -2.749 -0.612 1.00 42.43 C ATOM 0 H MET A 21 -14.906 -3.109 -1.632 1.00 41.23 H new ATOM 0 HA MET A 21 -12.382 -1.965 -1.397 1.00 3.00 H new ATOM 0 HB2 MET A 21 -13.286 -4.442 -1.721 1.00 50.44 H new ATOM 0 HB3 MET A 21 -13.065 -4.105 -3.427 1.00 50.44 H new ATOM 0 HG2 MET A 21 -11.037 -5.129 -2.739 1.00 41.05 H new ATOM 0 HG3 MET A 21 -10.658 -3.422 -2.864 1.00 41.05 H new ATOM 0 HE1 MET A 21 -9.120 -2.603 0.378 1.00 42.43 H new ATOM 0 HE2 MET A 21 -8.756 -2.947 -1.330 1.00 42.43 H new ATOM 0 HE3 MET A 21 -10.092 -1.850 -0.908 1.00 42.43 H new ATOM 335 N MET A 22 -13.762 -1.577 -4.375 1.00 64.45 N ATOM 336 CA MET A 22 -13.633 -0.903 -5.652 1.00 33.52 C ATOM 337 C MET A 22 -14.129 0.548 -5.567 1.00 73.43 C ATOM 338 O MET A 22 -13.536 1.417 -6.207 1.00 2.40 O ATOM 339 CB MET A 22 -14.181 -1.826 -6.757 1.00 65.34 C ATOM 340 CG MET A 22 -15.683 -1.810 -7.040 1.00 11.22 C ATOM 341 SD MET A 22 -16.319 -0.309 -7.839 1.00 10.23 S ATOM 342 CE MET A 22 -15.121 -0.128 -9.192 1.00 34.11 C ATOM 0 H MET A 22 -14.642 -2.078 -4.256 1.00 64.45 H new ATOM 0 HA MET A 22 -12.596 -0.742 -5.948 1.00 33.52 H new ATOM 0 HB2 MET A 22 -13.666 -1.575 -7.684 1.00 65.34 H new ATOM 0 HB3 MET A 22 -13.902 -2.849 -6.504 1.00 65.34 H new ATOM 0 HG2 MET A 22 -15.924 -2.665 -7.671 1.00 11.22 H new ATOM 0 HG3 MET A 22 -16.213 -1.950 -6.098 1.00 11.22 H new ATOM 0 HE1 MET A 22 -15.508 0.575 -9.929 1.00 34.11 H new ATOM 0 HE2 MET A 22 -14.177 0.246 -8.795 1.00 34.11 H new ATOM 0 HE3 MET A 22 -14.958 -1.096 -9.665 1.00 34.11 H new ATOM 352 N ALA A 23 -15.082 0.854 -4.675 1.00 54.14 N ATOM 353 CA ALA A 23 -15.520 2.207 -4.339 1.00 22.54 C ATOM 354 C ALA A 23 -14.342 3.034 -3.845 1.00 41.02 C ATOM 355 O ALA A 23 -14.138 4.135 -4.350 1.00 22.53 O ATOM 356 CB ALA A 23 -16.616 2.206 -3.264 1.00 52.14 C ATOM 0 H ALA A 23 -15.584 0.137 -4.151 1.00 54.14 H new ATOM 0 HA ALA A 23 -15.932 2.645 -5.248 1.00 22.54 H new ATOM 0 HB1 ALA A 23 -16.912 3.232 -3.045 1.00 52.14 H new ATOM 0 HB2 ALA A 23 -17.480 1.649 -3.626 1.00 52.14 H new ATOM 0 HB3 ALA A 23 -16.235 1.737 -2.357 1.00 52.14 H new ATOM 362 N ILE A 24 -13.541 2.501 -2.915 1.00 71.25 N ATOM 363 CA ILE A 24 -12.317 3.124 -2.412 1.00 73.52 C ATOM 364 C ILE A 24 -11.480 3.614 -3.598 1.00 50.15 C ATOM 365 O ILE A 24 -11.053 4.769 -3.666 1.00 43.33 O ATOM 366 CB ILE A 24 -11.554 2.118 -1.507 1.00 30.21 C ATOM 367 CG1 ILE A 24 -12.285 1.900 -0.164 1.00 3.42 C ATOM 368 CG2 ILE A 24 -10.127 2.601 -1.209 1.00 4.32 C ATOM 369 CD1 ILE A 24 -11.795 0.687 0.637 1.00 72.41 C ATOM 0 H ILE A 24 -13.734 1.598 -2.481 1.00 71.25 H new ATOM 0 HA ILE A 24 -12.548 3.992 -1.795 1.00 73.52 H new ATOM 0 HB ILE A 24 -11.514 1.178 -2.058 1.00 30.21 H new ATOM 0 HG12 ILE A 24 -12.169 2.795 0.448 1.00 3.42 H new ATOM 0 HG13 ILE A 24 -13.351 1.784 -0.360 1.00 3.42 H new ATOM 0 HG21 ILE A 24 -9.622 1.874 -0.574 1.00 4.32 H new ATOM 0 HG22 ILE A 24 -9.577 2.710 -2.144 1.00 4.32 H new ATOM 0 HG23 ILE A 24 -10.168 3.563 -0.698 1.00 4.32 H new ATOM 0 HD11 ILE A 24 -12.363 0.610 1.564 1.00 72.41 H new ATOM 0 HD12 ILE A 24 -11.937 -0.219 0.048 1.00 72.41 H new ATOM 0 HD13 ILE A 24 -10.737 0.807 0.868 1.00 72.41 H new ATOM 381 N LEU A 25 -11.272 2.726 -4.568 1.00 44.42 N ATOM 382 CA LEU A 25 -10.430 2.966 -5.731 1.00 43.45 C ATOM 383 C LEU A 25 -11.012 4.014 -6.689 1.00 23.40 C ATOM 384 O LEU A 25 -10.258 4.735 -7.347 1.00 51.11 O ATOM 385 CB LEU A 25 -10.170 1.632 -6.439 1.00 61.15 C ATOM 386 CG LEU A 25 -8.701 1.471 -6.866 1.00 23.30 C ATOM 387 CD1 LEU A 25 -7.772 1.399 -5.648 1.00 52.25 C ATOM 388 CD2 LEU A 25 -8.580 0.129 -7.593 1.00 65.11 C ATOM 0 H LEU A 25 -11.696 1.798 -4.564 1.00 44.42 H new ATOM 0 HA LEU A 25 -9.486 3.388 -5.387 1.00 43.45 H new ATOM 0 HB2 LEU A 25 -10.445 0.812 -5.775 1.00 61.15 H new ATOM 0 HB3 LEU A 25 -10.811 1.559 -7.318 1.00 61.15 H new ATOM 0 HG LEU A 25 -8.420 2.322 -7.486 1.00 23.30 H new ATOM 0 HD11 LEU A 25 -6.741 1.285 -5.983 1.00 52.25 H new ATOM 0 HD12 LEU A 25 -7.865 2.315 -5.065 1.00 52.25 H new ATOM 0 HD13 LEU A 25 -8.049 0.545 -5.029 1.00 52.25 H new ATOM 0 HD21 LEU A 25 -7.548 -0.020 -7.912 1.00 65.11 H new ATOM 0 HD22 LEU A 25 -8.872 -0.677 -6.920 1.00 65.11 H new ATOM 0 HD23 LEU A 25 -9.233 0.128 -8.466 1.00 65.11 H new ATOM 400 N THR A 26 -12.334 4.122 -6.745 1.00 65.32 N ATOM 401 CA THR A 26 -13.065 5.145 -7.472 1.00 44.11 C ATOM 402 C THR A 26 -13.036 6.493 -6.731 1.00 63.21 C ATOM 403 O THR A 26 -12.979 7.535 -7.379 1.00 42.32 O ATOM 404 CB THR A 26 -14.483 4.590 -7.703 1.00 12.34 C ATOM 405 OG1 THR A 26 -14.369 3.474 -8.561 1.00 54.22 O ATOM 406 CG2 THR A 26 -15.457 5.589 -8.314 1.00 53.35 C ATOM 0 H THR A 26 -12.950 3.468 -6.262 1.00 65.32 H new ATOM 0 HA THR A 26 -12.604 5.363 -8.435 1.00 44.11 H new ATOM 0 HB THR A 26 -14.894 4.333 -6.727 1.00 12.34 H new ATOM 0 HG1 THR A 26 -14.124 2.683 -8.038 1.00 54.22 H new ATOM 0 HG21 THR A 26 -16.431 5.116 -8.442 1.00 53.35 H new ATOM 0 HG22 THR A 26 -15.556 6.451 -7.654 1.00 53.35 H new ATOM 0 HG23 THR A 26 -15.082 5.916 -9.284 1.00 53.35 H new ATOM 414 N ILE A 27 -13.038 6.522 -5.396 1.00 72.53 N ATOM 415 CA ILE A 27 -12.957 7.765 -4.632 1.00 35.44 C ATOM 416 C ILE A 27 -11.564 8.352 -4.822 1.00 15.02 C ATOM 417 O ILE A 27 -11.449 9.491 -5.259 1.00 32.12 O ATOM 418 CB ILE A 27 -13.325 7.530 -3.155 1.00 23.12 C ATOM 419 CG1 ILE A 27 -14.794 7.076 -3.018 1.00 44.21 C ATOM 420 CG2 ILE A 27 -13.110 8.795 -2.305 1.00 13.12 C ATOM 421 CD1 ILE A 27 -15.018 6.321 -1.708 1.00 2.30 C ATOM 0 H ILE A 27 -13.096 5.684 -4.817 1.00 72.53 H new ATOM 0 HA ILE A 27 -13.684 8.490 -4.997 1.00 35.44 H new ATOM 0 HB ILE A 27 -12.664 6.745 -2.788 1.00 23.12 H new ATOM 0 HG12 ILE A 27 -15.451 7.945 -3.057 1.00 44.21 H new ATOM 0 HG13 ILE A 27 -15.060 6.437 -3.860 1.00 44.21 H new ATOM 0 HG21 ILE A 27 -13.381 8.588 -1.270 1.00 13.12 H new ATOM 0 HG22 ILE A 27 -12.062 9.092 -2.354 1.00 13.12 H new ATOM 0 HG23 ILE A 27 -13.734 9.602 -2.689 1.00 13.12 H new ATOM 0 HD11 ILE A 27 -16.061 6.014 -1.639 1.00 2.30 H new ATOM 0 HD12 ILE A 27 -14.378 5.439 -1.682 1.00 2.30 H new ATOM 0 HD13 ILE A 27 -14.775 6.971 -0.867 1.00 2.30 H new ATOM 433 N ILE A 28 -10.504 7.578 -4.563 1.00 14.03 N ATOM 434 CA ILE A 28 -9.131 8.083 -4.601 1.00 34.24 C ATOM 435 C ILE A 28 -8.815 8.718 -5.962 1.00 12.00 C ATOM 436 O ILE A 28 -8.229 9.797 -6.044 1.00 54.23 O ATOM 437 CB ILE A 28 -8.161 6.966 -4.154 1.00 34.42 C ATOM 438 CG1 ILE A 28 -6.804 7.448 -3.631 1.00 71.31 C ATOM 439 CG2 ILE A 28 -8.021 5.797 -5.136 1.00 75.22 C ATOM 440 CD1 ILE A 28 -5.843 8.000 -4.678 1.00 44.12 C ATOM 0 H ILE A 28 -10.575 6.589 -4.323 1.00 14.03 H new ATOM 0 HA ILE A 28 -9.001 8.898 -3.889 1.00 34.24 H new ATOM 0 HB ILE A 28 -8.677 6.560 -3.284 1.00 34.42 H new ATOM 0 HG12 ILE A 28 -6.979 8.221 -2.883 1.00 71.31 H new ATOM 0 HG13 ILE A 28 -6.317 6.617 -3.122 1.00 71.31 H new ATOM 0 HG21 ILE A 28 -7.320 5.066 -4.734 1.00 75.22 H new ATOM 0 HG22 ILE A 28 -8.993 5.326 -5.282 1.00 75.22 H new ATOM 0 HG23 ILE A 28 -7.650 6.167 -6.092 1.00 75.22 H new ATOM 0 HD11 ILE A 28 -4.917 8.310 -4.194 1.00 44.12 H new ATOM 0 HD12 ILE A 28 -5.626 7.228 -5.416 1.00 44.12 H new ATOM 0 HD13 ILE A 28 -6.298 8.857 -5.174 1.00 44.12 H new ATOM 452 N ARG A 29 -9.247 8.088 -7.057 1.00 62.51 N ATOM 453 CA ARG A 29 -8.999 8.643 -8.387 1.00 3.41 C ATOM 454 C ARG A 29 -9.738 9.976 -8.607 1.00 3.42 C ATOM 455 O ARG A 29 -9.238 10.836 -9.328 1.00 51.02 O ATOM 456 CB ARG A 29 -9.266 7.592 -9.466 1.00 22.50 C ATOM 457 CG ARG A 29 -10.684 7.631 -10.020 1.00 43.21 C ATOM 458 CD ARG A 29 -10.943 6.335 -10.763 1.00 44.05 C ATOM 459 NE ARG A 29 -12.185 6.441 -11.535 1.00 35.54 N ATOM 460 CZ ARG A 29 -12.311 6.246 -12.853 1.00 52.05 C ATOM 461 NH1 ARG A 29 -11.298 5.833 -13.608 1.00 71.32 N ATOM 462 NH2 ARG A 29 -13.489 6.502 -13.393 1.00 54.43 N ATOM 0 H ARG A 29 -9.762 7.208 -7.050 1.00 62.51 H new ATOM 0 HA ARG A 29 -7.943 8.901 -8.466 1.00 3.41 H new ATOM 0 HB2 ARG A 29 -8.561 7.737 -10.285 1.00 22.50 H new ATOM 0 HB3 ARG A 29 -9.074 6.602 -9.052 1.00 22.50 H new ATOM 0 HG2 ARG A 29 -11.404 7.755 -9.211 1.00 43.21 H new ATOM 0 HG3 ARG A 29 -10.807 8.483 -10.689 1.00 43.21 H new ATOM 0 HD2 ARG A 29 -10.109 6.115 -11.429 1.00 44.05 H new ATOM 0 HD3 ARG A 29 -11.014 5.508 -10.056 1.00 44.05 H new ATOM 0 HE ARG A 29 -13.031 6.686 -11.020 1.00 35.54 H new ATOM 0 HH11 ARG A 29 -10.387 5.654 -13.186 1.00 71.32 H new ATOM 0 HH12 ARG A 29 -11.432 5.695 -14.610 1.00 71.32 H new ATOM 0 HH21 ARG A 29 -14.256 6.834 -12.809 1.00 54.43 H new ATOM 0 HH22 ARG A 29 -13.631 6.368 -14.394 1.00 54.43 H new ATOM 476 N ASP A 30 -10.908 10.170 -7.993 1.00 71.31 N ATOM 477 CA ASP A 30 -11.775 11.345 -8.168 1.00 3.04 C ATOM 478 C ASP A 30 -11.220 12.594 -7.480 1.00 22.13 C ATOM 479 O ASP A 30 -11.689 13.704 -7.721 1.00 71.15 O ATOM 480 CB ASP A 30 -13.154 11.045 -7.570 1.00 55.41 C ATOM 481 CG ASP A 30 -14.251 11.976 -8.100 1.00 23.32 C ATOM 482 OD1 ASP A 30 -14.828 11.660 -9.164 1.00 72.21 O ATOM 483 OD2 ASP A 30 -14.587 12.986 -7.438 1.00 24.51 O ATOM 0 H ASP A 30 -11.294 9.491 -7.337 1.00 71.31 H new ATOM 0 HA ASP A 30 -11.834 11.544 -9.238 1.00 3.04 H new ATOM 0 HB2 ASP A 30 -13.423 10.012 -7.791 1.00 55.41 H new ATOM 0 HB3 ASP A 30 -13.101 11.135 -6.485 1.00 55.41 H new ATOM 488 N LEU A 31 -10.210 12.439 -6.614 1.00 74.52 N ATOM 489 CA LEU A 31 -9.704 13.495 -5.732 1.00 43.43 C ATOM 490 C LEU A 31 -9.083 14.655 -6.505 1.00 3.32 C ATOM 491 O LEU A 31 -8.838 15.726 -5.943 1.00 21.10 O ATOM 492 CB LEU A 31 -8.650 12.925 -4.768 1.00 43.13 C ATOM 493 CG LEU A 31 -9.170 11.861 -3.793 1.00 12.40 C ATOM 494 CD1 LEU A 31 -8.006 11.199 -3.045 1.00 34.11 C ATOM 495 CD2 LEU A 31 -10.164 12.452 -2.797 1.00 64.32 C ATOM 0 H LEU A 31 -9.712 11.556 -6.506 1.00 74.52 H new ATOM 0 HA LEU A 31 -10.563 13.875 -5.179 1.00 43.43 H new ATOM 0 HB2 LEU A 31 -7.839 12.493 -5.355 1.00 43.13 H new ATOM 0 HB3 LEU A 31 -8.224 13.747 -4.192 1.00 43.13 H new ATOM 0 HG LEU A 31 -9.690 11.105 -4.381 1.00 12.40 H new ATOM 0 HD11 LEU A 31 -8.395 10.447 -2.358 1.00 34.11 H new ATOM 0 HD12 LEU A 31 -7.336 10.724 -3.762 1.00 34.11 H new ATOM 0 HD13 LEU A 31 -7.458 11.955 -2.483 1.00 34.11 H new ATOM 0 HD21 LEU A 31 -10.511 11.670 -2.122 1.00 64.32 H new ATOM 0 HD22 LEU A 31 -9.677 13.239 -2.221 1.00 64.32 H new ATOM 0 HD23 LEU A 31 -11.014 12.870 -3.336 1.00 64.32 H new ATOM 507 N GLY A 32 -8.806 14.445 -7.788 1.00 55.43 N ATOM 508 CA GLY A 32 -8.292 15.452 -8.687 1.00 21.53 C ATOM 509 C GLY A 32 -6.772 15.452 -8.769 1.00 71.32 C ATOM 510 O GLY A 32 -6.256 16.017 -9.738 1.00 43.03 O ATOM 0 H GLY A 32 -8.940 13.539 -8.237 1.00 55.43 H new ATOM 0 HA2 GLY A 32 -8.705 15.288 -9.682 1.00 21.53 H new ATOM 0 HA3 GLY A 32 -8.633 16.434 -8.358 1.00 21.53 H new ATOM 514 N LEU A 33 -6.045 14.838 -7.815 1.00 44.01 N ATOM 515 CA LEU A 33 -4.602 14.781 -7.936 1.00 31.43 C ATOM 516 C LEU A 33 -4.164 13.922 -9.113 1.00 55.11 C ATOM 517 O LEU A 33 -4.932 13.107 -9.644 1.00 21.12 O ATOM 518 CB LEU A 33 -4.005 14.216 -6.649 1.00 12.30 C ATOM 519 CG LEU A 33 -4.424 14.898 -5.343 1.00 54.21 C ATOM 520 CD1 LEU A 33 -4.451 16.433 -5.350 1.00 0.30 C ATOM 521 CD2 LEU A 33 -5.671 14.348 -4.682 1.00 32.44 C ATOM 0 H LEU A 33 -6.431 14.392 -6.983 1.00 44.01 H new ATOM 0 HA LEU A 33 -4.243 15.795 -8.109 1.00 31.43 H new ATOM 0 HB2 LEU A 33 -4.272 13.161 -6.584 1.00 12.30 H new ATOM 0 HB3 LEU A 33 -2.919 14.266 -6.726 1.00 12.30 H new ATOM 0 HG LEU A 33 -3.579 14.613 -4.716 1.00 54.21 H new ATOM 0 HD11 LEU A 33 -4.762 16.796 -4.371 1.00 0.30 H new ATOM 0 HD12 LEU A 33 -3.455 16.813 -5.578 1.00 0.30 H new ATOM 0 HD13 LEU A 33 -5.154 16.781 -6.106 1.00 0.30 H new ATOM 0 HD21 LEU A 33 -5.873 14.905 -3.767 1.00 32.44 H new ATOM 0 HD22 LEU A 33 -6.517 14.447 -5.362 1.00 32.44 H new ATOM 0 HD23 LEU A 33 -5.521 13.296 -4.441 1.00 32.44 H new ATOM 533 N LYS A 34 -2.896 14.082 -9.482 1.00 44.15 N ATOM 534 CA LYS A 34 -2.227 13.231 -10.456 1.00 71.42 C ATOM 535 C LYS A 34 -1.298 12.252 -9.741 1.00 14.11 C ATOM 536 O LYS A 34 -0.931 12.460 -8.583 1.00 3.04 O ATOM 537 CB LYS A 34 -1.557 14.082 -11.538 1.00 23.13 C ATOM 538 CG LYS A 34 -0.332 14.859 -11.045 1.00 62.15 C ATOM 539 CD LYS A 34 -0.458 16.385 -11.079 1.00 11.12 C ATOM 540 CE LYS A 34 -0.887 17.022 -12.399 1.00 64.44 C ATOM 541 NZ LYS A 34 -1.118 18.475 -12.239 1.00 22.41 N ATOM 0 H LYS A 34 -2.298 14.818 -9.106 1.00 44.15 H new ATOM 0 HA LYS A 34 -2.952 12.614 -10.988 1.00 71.42 H new ATOM 0 HB2 LYS A 34 -1.257 13.435 -12.362 1.00 23.13 H new ATOM 0 HB3 LYS A 34 -2.287 14.787 -11.936 1.00 23.13 H new ATOM 0 HG2 LYS A 34 -0.118 14.553 -10.021 1.00 62.15 H new ATOM 0 HG3 LYS A 34 0.527 14.570 -11.650 1.00 62.15 H new ATOM 0 HD2 LYS A 34 -1.174 16.682 -10.313 1.00 11.12 H new ATOM 0 HD3 LYS A 34 0.505 16.810 -10.797 1.00 11.12 H new ATOM 0 HE2 LYS A 34 -0.119 16.854 -13.154 1.00 64.44 H new ATOM 0 HE3 LYS A 34 -1.798 16.543 -12.758 1.00 64.44 H new ATOM 0 HZ1 LYS A 34 -1.408 18.883 -13.151 1.00 22.41 H new ATOM 0 HZ2 LYS A 34 -1.867 18.632 -11.535 1.00 22.41 H new ATOM 0 HZ3 LYS A 34 -0.241 18.933 -11.919 1.00 22.41 H new ATOM 555 N ASP A 35 -0.929 11.178 -10.441 1.00 22.34 N ATOM 556 CA ASP A 35 -0.071 10.076 -9.983 1.00 34.11 C ATOM 557 C ASP A 35 -0.508 9.466 -8.638 1.00 72.32 C ATOM 558 O ASP A 35 0.264 8.753 -7.987 1.00 43.32 O ATOM 559 CB ASP A 35 1.415 10.492 -10.043 1.00 34.10 C ATOM 560 CG ASP A 35 2.034 10.069 -11.373 1.00 51.43 C ATOM 561 OD1 ASP A 35 1.749 10.723 -12.397 1.00 21.42 O ATOM 562 OD2 ASP A 35 2.777 9.058 -11.422 1.00 24.14 O ATOM 0 H ASP A 35 -1.239 11.043 -11.403 1.00 22.34 H new ATOM 0 HA ASP A 35 -0.197 9.247 -10.679 1.00 34.11 H new ATOM 0 HB2 ASP A 35 1.502 11.572 -9.921 1.00 34.10 H new ATOM 0 HB3 ASP A 35 1.961 10.033 -9.219 1.00 34.10 H new ATOM 567 N SER A 36 -1.746 9.727 -8.204 1.00 61.32 N ATOM 568 CA SER A 36 -2.262 9.279 -6.929 1.00 12.33 C ATOM 569 C SER A 36 -2.868 7.890 -7.060 1.00 14.43 C ATOM 570 O SER A 36 -3.603 7.619 -8.019 1.00 13.42 O ATOM 571 CB SER A 36 -3.293 10.276 -6.398 1.00 23.33 C ATOM 572 OG SER A 36 -4.269 10.598 -7.378 1.00 24.34 O ATOM 0 H SER A 36 -2.421 10.266 -8.747 1.00 61.32 H new ATOM 0 HA SER A 36 -1.439 9.223 -6.216 1.00 12.33 H new ATOM 0 HB2 SER A 36 -3.784 9.858 -5.520 1.00 23.33 H new ATOM 0 HB3 SER A 36 -2.787 11.186 -6.077 1.00 23.33 H new ATOM 0 HG SER A 36 -4.996 11.105 -6.961 1.00 24.34 H new ATOM 578 N TRP A 37 -2.597 7.011 -6.096 1.00 22.51 N ATOM 579 CA TRP A 37 -3.218 5.700 -6.012 1.00 3.41 C ATOM 580 C TRP A 37 -3.001 5.078 -4.636 1.00 23.50 C ATOM 581 O TRP A 37 -2.376 5.678 -3.761 1.00 21.33 O ATOM 582 CB TRP A 37 -2.749 4.782 -7.150 1.00 4.01 C ATOM 583 CG TRP A 37 -1.310 4.421 -7.345 1.00 10.02 C ATOM 584 CD1 TRP A 37 -0.195 5.130 -7.053 1.00 33.12 C ATOM 585 CD2 TRP A 37 -0.847 3.221 -8.010 1.00 70.11 C ATOM 586 NE1 TRP A 37 0.919 4.429 -7.482 1.00 51.12 N ATOM 587 CE2 TRP A 37 0.567 3.241 -8.096 1.00 22.12 C ATOM 588 CE3 TRP A 37 -1.514 2.120 -8.567 1.00 31.54 C ATOM 589 CZ2 TRP A 37 1.271 2.196 -8.718 1.00 73.23 C ATOM 590 CZ3 TRP A 37 -0.833 1.064 -9.177 1.00 1.01 C ATOM 591 CH2 TRP A 37 0.558 1.119 -9.276 1.00 70.15 C ATOM 0 H TRP A 37 -1.932 7.196 -5.345 1.00 22.51 H new ATOM 0 HA TRP A 37 -4.293 5.827 -6.139 1.00 3.41 H new ATOM 0 HB2 TRP A 37 -3.295 3.845 -7.041 1.00 4.01 H new ATOM 0 HB3 TRP A 37 -3.085 5.240 -8.080 1.00 4.01 H new ATOM 0 HD1 TRP A 37 -0.177 6.092 -6.562 1.00 33.12 H new ATOM 0 HE1 TRP A 37 1.880 4.749 -7.360 1.00 51.12 H new ATOM 0 HE3 TRP A 37 -2.593 2.088 -8.523 1.00 31.54 H new ATOM 0 HZ2 TRP A 37 2.350 2.219 -8.767 1.00 73.23 H new ATOM 0 HZ3 TRP A 37 -1.376 0.216 -9.567 1.00 1.01 H new ATOM 0 HH2 TRP A 37 1.091 0.329 -9.785 1.00 70.15 H new ATOM 602 N LEU A 38 -3.552 3.878 -4.430 1.00 1.13 N ATOM 603 CA LEU A 38 -3.216 3.087 -3.256 1.00 44.34 C ATOM 604 C LEU A 38 -1.869 2.460 -3.495 1.00 63.51 C ATOM 605 O LEU A 38 -1.531 2.035 -4.607 1.00 24.21 O ATOM 606 CB LEU A 38 -4.197 1.940 -2.993 1.00 11.40 C ATOM 607 CG LEU A 38 -5.559 2.446 -2.549 1.00 54.05 C ATOM 608 CD1 LEU A 38 -6.599 1.321 -2.544 1.00 30.32 C ATOM 609 CD2 LEU A 38 -5.659 3.281 -1.282 1.00 53.24 C ATOM 0 H LEU A 38 -4.226 3.441 -5.058 1.00 1.13 H new ATOM 0 HA LEU A 38 -3.242 3.759 -2.398 1.00 44.34 H new ATOM 0 HB2 LEU A 38 -4.309 1.344 -3.899 1.00 11.40 H new ATOM 0 HB3 LEU A 38 -3.788 1.281 -2.227 1.00 11.40 H new ATOM 0 HG LEU A 38 -5.775 3.183 -3.323 1.00 54.05 H new ATOM 0 HD11 LEU A 38 -7.562 1.717 -2.222 1.00 30.32 H new ATOM 0 HD12 LEU A 38 -6.694 0.909 -3.549 1.00 30.32 H new ATOM 0 HD13 LEU A 38 -6.282 0.535 -1.858 1.00 30.32 H new ATOM 0 HD21 LEU A 38 -6.699 3.559 -1.111 1.00 53.24 H new ATOM 0 HD22 LEU A 38 -5.294 2.701 -0.434 1.00 53.24 H new ATOM 0 HD23 LEU A 38 -5.056 4.182 -1.392 1.00 53.24 H new ATOM 621 N ALA A 39 -1.177 2.304 -2.384 1.00 10.24 N ATOM 622 CA ALA A 39 0.008 1.456 -2.301 1.00 62.45 C ATOM 623 C ALA A 39 0.437 1.177 -0.883 1.00 1.03 C ATOM 624 O ALA A 39 0.562 2.111 -0.103 1.00 11.14 O ATOM 625 CB ALA A 39 1.218 2.081 -3.000 1.00 70.33 C ATOM 0 H ALA A 39 -1.418 2.762 -1.505 1.00 10.24 H new ATOM 0 HA ALA A 39 -0.295 0.531 -2.792 1.00 62.45 H new ATOM 0 HB1 ALA A 39 2.075 1.413 -2.911 1.00 70.33 H new ATOM 0 HB2 ALA A 39 0.988 2.238 -4.054 1.00 70.33 H new ATOM 0 HB3 ALA A 39 1.454 3.037 -2.533 1.00 70.33 H new ATOM 631 N ALA A 40 0.828 -0.071 -0.623 1.00 2.10 N ATOM 632 CA ALA A 40 1.123 -0.641 0.688 1.00 51.44 C ATOM 633 C ALA A 40 -0.119 -0.761 1.554 1.00 61.25 C ATOM 634 O ALA A 40 -0.829 0.217 1.756 1.00 61.51 O ATOM 635 CB ALA A 40 2.194 0.123 1.452 1.00 32.52 C ATOM 0 H ALA A 40 0.955 -0.752 -1.371 1.00 2.10 H new ATOM 0 HA ALA A 40 1.510 -1.637 0.475 1.00 51.44 H new ATOM 0 HB1 ALA A 40 2.363 -0.355 2.417 1.00 32.52 H new ATOM 0 HB2 ALA A 40 3.121 0.121 0.879 1.00 32.52 H new ATOM 0 HB3 ALA A 40 1.866 1.151 1.609 1.00 32.52 H new ATOM 641 N GLY A 41 -0.349 -1.961 2.084 1.00 3.11 N ATOM 642 CA GLY A 41 -1.371 -2.239 3.092 1.00 71.31 C ATOM 643 C GLY A 41 -2.784 -2.234 2.540 1.00 3.12 C ATOM 644 O GLY A 41 -3.445 -3.262 2.549 1.00 30.30 O ATOM 0 H GLY A 41 0.184 -2.789 1.817 1.00 3.11 H new ATOM 0 HA2 GLY A 41 -1.170 -3.210 3.544 1.00 71.31 H new ATOM 0 HA3 GLY A 41 -1.297 -1.497 3.887 1.00 71.31 H new ATOM 648 N SER A 42 -3.183 -1.108 1.965 1.00 53.23 N ATOM 649 CA SER A 42 -4.406 -0.872 1.221 1.00 24.13 C ATOM 650 C SER A 42 -4.659 -2.043 0.274 1.00 65.13 C ATOM 651 O SER A 42 -5.628 -2.787 0.407 1.00 70.12 O ATOM 652 CB SER A 42 -4.230 0.423 0.398 1.00 61.32 C ATOM 653 OG SER A 42 -2.886 0.604 -0.057 1.00 65.54 O ATOM 0 H SER A 42 -2.608 -0.267 2.013 1.00 53.23 H new ATOM 0 HA SER A 42 -5.250 -0.775 1.904 1.00 24.13 H new ATOM 0 HB2 SER A 42 -4.901 0.398 -0.461 1.00 61.32 H new ATOM 0 HB3 SER A 42 -4.523 1.279 1.006 1.00 61.32 H new ATOM 0 HG SER A 42 -2.742 1.546 -0.284 1.00 65.54 H new ATOM 659 N VAL A 43 -3.746 -2.230 -0.683 1.00 13.03 N ATOM 660 CA VAL A 43 -4.008 -3.165 -1.766 1.00 34.44 C ATOM 661 C VAL A 43 -3.839 -4.555 -1.093 1.00 52.02 C ATOM 662 O VAL A 43 -4.586 -5.498 -1.306 1.00 64.45 O ATOM 663 CB VAL A 43 -2.986 -2.992 -2.884 1.00 42.33 C ATOM 664 CG1 VAL A 43 -2.786 -1.542 -3.326 1.00 2.01 C ATOM 665 CG2 VAL A 43 -1.892 -4.014 -3.169 1.00 71.21 C ATOM 0 H VAL A 43 -2.843 -1.757 -0.726 1.00 13.03 H new ATOM 0 HA VAL A 43 -4.989 -3.023 -2.220 1.00 34.44 H new ATOM 0 HB VAL A 43 -3.536 -3.498 -3.677 1.00 42.33 H new ATOM 0 HG11 VAL A 43 -2.044 -1.504 -4.124 1.00 2.01 H new ATOM 0 HG12 VAL A 43 -3.731 -1.139 -3.690 1.00 2.01 H new ATOM 0 HG13 VAL A 43 -2.440 -0.948 -2.480 1.00 2.01 H new ATOM 0 HG21 VAL A 43 -1.287 -3.675 -4.010 1.00 71.21 H new ATOM 0 HG22 VAL A 43 -1.259 -4.125 -2.288 1.00 71.21 H new ATOM 0 HG23 VAL A 43 -2.346 -4.974 -3.413 1.00 71.21 H new ATOM 675 N ARG A 44 -2.795 -4.680 -0.264 1.00 3.14 N ATOM 676 CA ARG A 44 -2.404 -5.905 0.441 1.00 21.53 C ATOM 677 C ARG A 44 -3.587 -6.509 1.199 1.00 11.43 C ATOM 678 O ARG A 44 -3.689 -7.728 1.243 1.00 74.54 O ATOM 679 CB ARG A 44 -1.208 -5.643 1.381 1.00 1.22 C ATOM 680 CG ARG A 44 -0.575 -6.935 1.940 1.00 53.01 C ATOM 681 CD ARG A 44 0.859 -6.791 2.496 1.00 61.11 C ATOM 682 NE ARG A 44 1.094 -5.612 3.351 1.00 41.25 N ATOM 683 CZ ARG A 44 2.295 -5.257 3.840 1.00 51.31 C ATOM 684 NH1 ARG A 44 3.301 -6.123 3.934 1.00 71.41 N ATOM 685 NH2 ARG A 44 2.510 -4.008 4.212 1.00 3.03 N ATOM 0 H ARG A 44 -2.174 -3.897 -0.058 1.00 3.14 H new ATOM 0 HA ARG A 44 -2.087 -6.634 -0.305 1.00 21.53 H new ATOM 0 HB2 ARG A 44 -0.448 -5.078 0.841 1.00 1.22 H new ATOM 0 HB3 ARG A 44 -1.538 -5.020 2.212 1.00 1.22 H new ATOM 0 HG2 ARG A 44 -1.216 -7.318 2.734 1.00 53.01 H new ATOM 0 HG3 ARG A 44 -0.565 -7.685 1.149 1.00 53.01 H new ATOM 0 HD2 ARG A 44 1.099 -7.687 3.069 1.00 61.11 H new ATOM 0 HD3 ARG A 44 1.553 -6.753 1.657 1.00 61.11 H new ATOM 0 HE ARG A 44 0.292 -5.027 3.587 1.00 41.25 H new ATOM 0 HH11 ARG A 44 3.173 -7.088 3.630 1.00 71.41 H new ATOM 0 HH12 ARG A 44 4.200 -5.821 4.310 1.00 71.41 H new ATOM 0 HH21 ARG A 44 1.766 -3.316 4.128 1.00 3.03 H new ATOM 0 HH22 ARG A 44 3.420 -3.736 4.583 1.00 3.03 H new ATOM 699 N ASN A 45 -4.479 -5.698 1.771 1.00 42.24 N ATOM 700 CA ASN A 45 -5.620 -6.132 2.568 1.00 42.11 C ATOM 701 C ASN A 45 -6.485 -7.118 1.787 1.00 33.14 C ATOM 702 O ASN A 45 -6.724 -8.230 2.262 1.00 10.42 O ATOM 703 CB ASN A 45 -6.437 -4.913 3.021 1.00 32.50 C ATOM 704 CG ASN A 45 -7.559 -5.331 3.961 1.00 1.31 C ATOM 705 OD1 ASN A 45 -7.309 -5.874 5.029 1.00 3.10 O ATOM 706 ND2 ASN A 45 -8.805 -5.088 3.611 1.00 2.02 N ATOM 0 H ASN A 45 -4.421 -4.683 1.687 1.00 42.24 H new ATOM 0 HA ASN A 45 -5.253 -6.649 3.454 1.00 42.11 H new ATOM 0 HB2 ASN A 45 -5.784 -4.198 3.522 1.00 32.50 H new ATOM 0 HB3 ASN A 45 -6.855 -4.407 2.151 1.00 32.50 H new ATOM 0 HD21 ASN A 45 -9.570 -5.353 4.232 1.00 2.02 H new ATOM 0 HD22 ASN A 45 -9.005 -4.635 2.719 1.00 2.02 H new ATOM 713 N PHE A 46 -6.882 -6.762 0.559 1.00 34.10 N ATOM 714 CA PHE A 46 -7.751 -7.592 -0.279 1.00 74.24 C ATOM 715 C PHE A 46 -7.063 -8.871 -0.785 1.00 31.11 C ATOM 716 O PHE A 46 -7.703 -9.662 -1.469 1.00 21.41 O ATOM 717 CB PHE A 46 -8.398 -6.755 -1.407 1.00 4.24 C ATOM 718 CG PHE A 46 -7.622 -6.580 -2.702 1.00 11.20 C ATOM 719 CD1 PHE A 46 -7.691 -7.519 -3.754 1.00 12.40 C ATOM 720 CD2 PHE A 46 -6.846 -5.428 -2.874 1.00 1.24 C ATOM 721 CE1 PHE A 46 -6.941 -7.336 -4.935 1.00 53.22 C ATOM 722 CE2 PHE A 46 -6.007 -5.312 -3.985 1.00 42.41 C ATOM 723 CZ PHE A 46 -6.016 -6.273 -5.001 1.00 54.01 C ATOM 0 H PHE A 46 -6.607 -5.884 0.118 1.00 34.10 H new ATOM 0 HA PHE A 46 -8.562 -7.952 0.355 1.00 74.24 H new ATOM 0 HB2 PHE A 46 -9.358 -7.210 -1.652 1.00 4.24 H new ATOM 0 HB3 PHE A 46 -8.609 -5.763 -1.008 1.00 4.24 H new ATOM 0 HD1 PHE A 46 -8.325 -8.387 -3.654 1.00 12.40 H new ATOM 0 HD2 PHE A 46 -6.896 -4.629 -2.149 1.00 1.24 H new ATOM 0 HE1 PHE A 46 -7.073 -8.000 -5.776 1.00 53.22 H new ATOM 0 HE2 PHE A 46 -5.340 -4.466 -4.061 1.00 42.41 H new ATOM 0 HZ PHE A 46 -5.323 -6.202 -5.826 1.00 54.01 H new ATOM 733 N ILE A 47 -5.790 -9.111 -0.441 1.00 31.11 N ATOM 734 CA ILE A 47 -5.010 -10.271 -0.868 1.00 3.22 C ATOM 735 C ILE A 47 -4.613 -11.097 0.360 1.00 25.44 C ATOM 736 O ILE A 47 -4.861 -12.295 0.419 1.00 34.20 O ATOM 737 CB ILE A 47 -3.756 -9.797 -1.638 1.00 30.32 C ATOM 738 CG1 ILE A 47 -4.115 -9.004 -2.911 1.00 44.43 C ATOM 739 CG2 ILE A 47 -2.853 -10.989 -2.016 1.00 61.45 C ATOM 740 CD1 ILE A 47 -3.081 -7.927 -3.214 1.00 34.43 C ATOM 0 H ILE A 47 -5.262 -8.480 0.162 1.00 31.11 H new ATOM 0 HA ILE A 47 -5.608 -10.896 -1.531 1.00 3.22 H new ATOM 0 HB ILE A 47 -3.216 -9.132 -0.964 1.00 30.32 H new ATOM 0 HG12 ILE A 47 -4.187 -9.687 -3.757 1.00 44.43 H new ATOM 0 HG13 ILE A 47 -5.095 -8.543 -2.789 1.00 44.43 H new ATOM 0 HG21 ILE A 47 -1.979 -10.626 -2.557 1.00 61.45 H new ATOM 0 HG22 ILE A 47 -2.532 -11.504 -1.110 1.00 61.45 H new ATOM 0 HG23 ILE A 47 -3.409 -11.681 -2.649 1.00 61.45 H new ATOM 0 HD11 ILE A 47 -3.369 -7.390 -4.118 1.00 34.43 H new ATOM 0 HD12 ILE A 47 -3.027 -7.229 -2.379 1.00 34.43 H new ATOM 0 HD13 ILE A 47 -2.106 -8.390 -3.362 1.00 34.43 H new ATOM 752 N TRP A 48 -3.970 -10.483 1.353 1.00 64.45 N ATOM 753 CA TRP A 48 -3.515 -11.179 2.543 1.00 71.45 C ATOM 754 C TRP A 48 -4.700 -11.695 3.346 1.00 61.33 C ATOM 755 O TRP A 48 -4.646 -12.834 3.793 1.00 62.31 O ATOM 756 CB TRP A 48 -2.623 -10.270 3.397 1.00 50.11 C ATOM 757 CG TRP A 48 -1.147 -10.347 3.138 1.00 2.33 C ATOM 758 CD1 TRP A 48 -0.522 -10.893 2.073 1.00 70.55 C ATOM 759 CD2 TRP A 48 -0.082 -9.899 4.013 1.00 65.55 C ATOM 760 NE1 TRP A 48 0.848 -10.891 2.272 1.00 53.22 N ATOM 761 CE2 TRP A 48 1.179 -10.243 3.440 1.00 13.01 C ATOM 762 CE3 TRP A 48 -0.071 -9.231 5.245 1.00 14.44 C ATOM 763 CZ2 TRP A 48 2.394 -9.912 4.061 1.00 25.41 C ATOM 764 CZ3 TRP A 48 1.137 -8.850 5.841 1.00 41.12 C ATOM 765 CH2 TRP A 48 2.368 -9.163 5.248 1.00 64.23 C ATOM 0 H TRP A 48 -3.752 -9.486 1.349 1.00 64.45 H new ATOM 0 HA TRP A 48 -2.918 -12.037 2.233 1.00 71.45 H new ATOM 0 HB2 TRP A 48 -2.943 -9.239 3.246 1.00 50.11 H new ATOM 0 HB3 TRP A 48 -2.798 -10.508 4.446 1.00 50.11 H new ATOM 0 HD1 TRP A 48 -1.019 -11.276 1.194 1.00 70.55 H new ATOM 0 HE1 TRP A 48 1.524 -11.314 1.636 1.00 53.22 H new ATOM 0 HE3 TRP A 48 -1.005 -9.008 5.740 1.00 14.44 H new ATOM 0 HZ2 TRP A 48 3.333 -10.229 3.632 1.00 25.41 H new ATOM 0 HZ3 TRP A 48 1.120 -8.306 6.774 1.00 41.12 H new ATOM 0 HH2 TRP A 48 3.290 -8.830 5.701 1.00 64.23 H new ATOM 776 N ASN A 49 -5.763 -10.908 3.541 1.00 51.14 N ATOM 777 CA ASN A 49 -6.935 -11.373 4.280 1.00 4.30 C ATOM 778 C ASN A 49 -7.596 -12.513 3.523 1.00 42.05 C ATOM 779 O ASN A 49 -7.935 -13.525 4.132 1.00 54.04 O ATOM 780 CB ASN A 49 -7.970 -10.260 4.459 1.00 3.22 C ATOM 781 CG ASN A 49 -7.573 -9.170 5.442 1.00 12.11 C ATOM 782 OD1 ASN A 49 -6.402 -8.986 5.734 1.00 65.32 O ATOM 783 ND2 ASN A 49 -8.536 -8.477 6.011 1.00 63.14 N ATOM 0 H ASN A 49 -5.833 -9.950 3.198 1.00 51.14 H new ATOM 0 HA ASN A 49 -6.593 -11.700 5.262 1.00 4.30 H new ATOM 0 HB2 ASN A 49 -8.161 -9.802 3.489 1.00 3.22 H new ATOM 0 HB3 ASN A 49 -8.908 -10.705 4.792 1.00 3.22 H new ATOM 0 HD21 ASN A 49 -8.311 -7.770 6.711 1.00 63.14 H new ATOM 0 HD22 ASN A 49 -9.508 -8.647 5.752 1.00 63.14 H new ATOM 790 N LEU A 50 -7.751 -12.333 2.205 1.00 4.43 N ATOM 791 CA LEU A 50 -8.283 -13.289 1.240 1.00 43.14 C ATOM 792 C LEU A 50 -7.613 -14.642 1.505 1.00 52.03 C ATOM 793 O LEU A 50 -8.245 -15.569 2.011 1.00 44.21 O ATOM 794 CB LEU A 50 -7.988 -12.740 -0.175 1.00 70.41 C ATOM 795 CG LEU A 50 -8.772 -13.334 -1.353 1.00 73.21 C ATOM 796 CD1 LEU A 50 -10.143 -12.677 -1.427 1.00 44.34 C ATOM 797 CD2 LEU A 50 -8.037 -13.056 -2.673 1.00 11.32 C ATOM 0 H LEU A 50 -7.488 -11.454 1.760 1.00 4.43 H new ATOM 0 HA LEU A 50 -9.361 -13.428 1.328 1.00 43.14 H new ATOM 0 HB2 LEU A 50 -8.168 -11.665 -0.161 1.00 70.41 H new ATOM 0 HB3 LEU A 50 -6.926 -12.882 -0.374 1.00 70.41 H new ATOM 0 HG LEU A 50 -8.867 -14.409 -1.202 1.00 73.21 H new ATOM 0 HD11 LEU A 50 -10.703 -13.097 -2.263 1.00 44.34 H new ATOM 0 HD12 LEU A 50 -10.685 -12.860 -0.499 1.00 44.34 H new ATOM 0 HD13 LEU A 50 -10.025 -11.603 -1.572 1.00 44.34 H new ATOM 0 HD21 LEU A 50 -8.603 -13.482 -3.501 1.00 11.32 H new ATOM 0 HD22 LEU A 50 -7.940 -11.980 -2.816 1.00 11.32 H new ATOM 0 HD23 LEU A 50 -7.046 -13.508 -2.640 1.00 11.32 H new ATOM 809 N LEU A 51 -6.293 -14.699 1.294 1.00 44.33 N ATOM 810 CA LEU A 51 -5.443 -15.875 1.398 1.00 61.33 C ATOM 811 C LEU A 51 -5.161 -16.272 2.849 1.00 21.44 C ATOM 812 O LEU A 51 -4.319 -17.136 3.068 1.00 41.32 O ATOM 813 CB LEU A 51 -4.122 -15.593 0.650 1.00 4.33 C ATOM 814 CG LEU A 51 -4.284 -15.445 -0.871 1.00 31.44 C ATOM 815 CD1 LEU A 51 -3.048 -14.808 -1.496 1.00 41.20 C ATOM 816 CD2 LEU A 51 -4.543 -16.794 -1.535 1.00 13.21 C ATOM 0 H LEU A 51 -5.763 -13.868 1.030 1.00 44.33 H new ATOM 0 HA LEU A 51 -5.967 -16.717 0.947 1.00 61.33 H new ATOM 0 HB2 LEU A 51 -3.679 -14.680 1.048 1.00 4.33 H new ATOM 0 HB3 LEU A 51 -3.421 -16.403 0.853 1.00 4.33 H new ATOM 0 HG LEU A 51 -5.144 -14.797 -1.038 1.00 31.44 H new ATOM 0 HD11 LEU A 51 -3.191 -14.716 -2.573 1.00 41.20 H new ATOM 0 HD12 LEU A 51 -2.891 -13.819 -1.065 1.00 41.20 H new ATOM 0 HD13 LEU A 51 -2.177 -15.433 -1.298 1.00 41.20 H new ATOM 0 HD21 LEU A 51 -4.653 -16.655 -2.610 1.00 13.21 H new ATOM 0 HD22 LEU A 51 -3.705 -17.463 -1.339 1.00 13.21 H new ATOM 0 HD23 LEU A 51 -5.457 -17.229 -1.130 1.00 13.21 H new ATOM 828 N SER A 52 -5.828 -15.681 3.840 1.00 13.05 N ATOM 829 CA SER A 52 -5.708 -16.031 5.254 1.00 70.14 C ATOM 830 C SER A 52 -7.035 -16.508 5.831 1.00 71.43 C ATOM 831 O SER A 52 -7.124 -16.663 7.047 1.00 3.13 O ATOM 832 CB SER A 52 -5.192 -14.829 6.044 1.00 70.24 C ATOM 833 OG SER A 52 -3.878 -14.521 5.653 1.00 3.12 O ATOM 0 H SER A 52 -6.488 -14.921 3.675 1.00 13.05 H new ATOM 0 HA SER A 52 -4.998 -16.854 5.337 1.00 70.14 H new ATOM 0 HB2 SER A 52 -5.840 -13.969 5.877 1.00 70.24 H new ATOM 0 HB3 SER A 52 -5.220 -15.047 7.112 1.00 70.24 H new ATOM 0 HG SER A 52 -3.891 -14.096 4.770 1.00 3.12 H new ATOM 839 N ASP A 53 -8.066 -16.711 4.998 1.00 74.52 N ATOM 840 CA ASP A 53 -9.412 -17.099 5.443 1.00 22.14 C ATOM 841 C ASP A 53 -10.084 -15.982 6.266 1.00 10.31 C ATOM 842 O ASP A 53 -11.092 -16.211 6.932 1.00 22.21 O ATOM 843 CB ASP A 53 -9.337 -18.448 6.196 1.00 34.41 C ATOM 844 CG ASP A 53 -10.622 -19.268 6.164 1.00 43.43 C ATOM 845 OD1 ASP A 53 -11.221 -19.416 5.074 1.00 54.02 O ATOM 846 OD2 ASP A 53 -10.935 -19.911 7.189 1.00 34.43 O ATOM 0 H ASP A 53 -7.988 -16.609 3.986 1.00 74.52 H new ATOM 0 HA ASP A 53 -10.053 -17.240 4.573 1.00 22.14 H new ATOM 0 HB2 ASP A 53 -8.531 -19.044 5.767 1.00 34.41 H new ATOM 0 HB3 ASP A 53 -9.072 -18.254 7.235 1.00 34.41 H new ATOM 851 N LYS A 54 -9.525 -14.760 6.236 1.00 14.20 N ATOM 852 CA LYS A 54 -10.040 -13.585 6.944 1.00 10.41 C ATOM 853 C LYS A 54 -11.062 -12.859 6.067 1.00 42.05 C ATOM 854 O LYS A 54 -11.433 -13.361 5.006 1.00 12.01 O ATOM 855 CB LYS A 54 -8.934 -12.599 7.380 1.00 65.24 C ATOM 856 CG LYS A 54 -7.617 -13.176 7.906 1.00 74.55 C ATOM 857 CD LYS A 54 -7.187 -12.696 9.284 1.00 13.24 C ATOM 858 CE LYS A 54 -7.042 -11.179 9.403 1.00 21.40 C ATOM 859 NZ LYS A 54 -7.630 -10.716 10.681 1.00 2.40 N ATOM 0 H LYS A 54 -8.679 -14.561 5.702 1.00 14.20 H new ATOM 0 HA LYS A 54 -10.511 -13.952 7.856 1.00 10.41 H new ATOM 0 HB2 LYS A 54 -8.701 -11.961 6.527 1.00 65.24 H new ATOM 0 HB3 LYS A 54 -9.349 -11.955 8.156 1.00 65.24 H new ATOM 0 HG2 LYS A 54 -7.702 -14.262 7.931 1.00 74.55 H new ATOM 0 HG3 LYS A 54 -6.827 -12.935 7.195 1.00 74.55 H new ATOM 0 HD2 LYS A 54 -7.915 -13.039 10.019 1.00 13.24 H new ATOM 0 HD3 LYS A 54 -6.235 -13.162 9.538 1.00 13.24 H new ATOM 0 HE2 LYS A 54 -5.989 -10.901 9.355 1.00 21.40 H new ATOM 0 HE3 LYS A 54 -7.540 -10.690 8.565 1.00 21.40 H new ATOM 0 HZ1 LYS A 54 -7.528 -9.684 10.756 1.00 2.40 H new ATOM 0 HZ2 LYS A 54 -8.639 -10.968 10.710 1.00 2.40 H new ATOM 0 HZ3 LYS A 54 -7.136 -11.171 11.475 1.00 2.40 H new ATOM 873 N SER A 55 -11.405 -11.631 6.454 1.00 11.24 N ATOM 874 CA SER A 55 -12.388 -10.745 5.840 1.00 53.34 C ATOM 875 C SER A 55 -11.701 -9.633 5.037 1.00 24.50 C ATOM 876 O SER A 55 -11.329 -8.597 5.591 1.00 12.02 O ATOM 877 CB SER A 55 -13.347 -10.192 6.894 1.00 13.10 C ATOM 878 OG SER A 55 -14.368 -9.414 6.295 1.00 41.02 O ATOM 0 H SER A 55 -10.968 -11.198 7.268 1.00 11.24 H new ATOM 0 HA SER A 55 -12.983 -11.322 5.133 1.00 53.34 H new ATOM 0 HB2 SER A 55 -13.793 -11.015 7.452 1.00 13.10 H new ATOM 0 HB3 SER A 55 -12.794 -9.584 7.610 1.00 13.10 H new ATOM 0 HG SER A 55 -14.524 -8.610 6.832 1.00 41.02 H new ATOM 884 N PRO A 56 -11.377 -9.863 3.756 1.00 11.00 N ATOM 885 CA PRO A 56 -10.714 -8.883 2.901 1.00 65.25 C ATOM 886 C PRO A 56 -11.468 -7.575 2.696 1.00 63.21 C ATOM 887 O PRO A 56 -10.840 -6.601 2.292 1.00 43.44 O ATOM 888 CB PRO A 56 -10.481 -9.593 1.570 1.00 70.42 C ATOM 889 CG PRO A 56 -11.485 -10.739 1.561 1.00 14.00 C ATOM 890 CD PRO A 56 -11.666 -11.077 3.019 1.00 41.24 C ATOM 0 HA PRO A 56 -9.793 -8.562 3.388 1.00 65.25 H new ATOM 0 HB2 PRO A 56 -10.642 -8.919 0.728 1.00 70.42 H new ATOM 0 HB3 PRO A 56 -9.458 -9.962 1.492 1.00 70.42 H new ATOM 0 HG2 PRO A 56 -12.427 -10.441 1.101 1.00 14.00 H new ATOM 0 HG3 PRO A 56 -11.111 -11.593 0.997 1.00 14.00 H new ATOM 0 HD2 PRO A 56 -12.682 -11.419 3.216 1.00 41.24 H new ATOM 0 HD3 PRO A 56 -10.995 -11.882 3.318 1.00 41.24 H new ATOM 898 N PHE A 57 -12.763 -7.534 2.996 1.00 2.22 N ATOM 899 CA PHE A 57 -13.607 -6.379 2.692 1.00 65.42 C ATOM 900 C PHE A 57 -13.974 -5.555 3.902 1.00 13.24 C ATOM 901 O PHE A 57 -14.743 -4.600 3.782 1.00 62.15 O ATOM 902 CB PHE A 57 -14.765 -6.814 1.786 1.00 21.50 C ATOM 903 CG PHE A 57 -14.252 -7.538 0.555 1.00 25.11 C ATOM 904 CD1 PHE A 57 -13.240 -6.946 -0.228 1.00 61.23 C ATOM 905 CD2 PHE A 57 -14.705 -8.831 0.245 1.00 65.44 C ATOM 906 CE1 PHE A 57 -12.655 -7.655 -1.290 1.00 13.04 C ATOM 907 CE2 PHE A 57 -14.122 -9.535 -0.823 1.00 30.12 C ATOM 908 CZ PHE A 57 -13.088 -8.959 -1.575 1.00 5.12 C ATOM 0 H PHE A 57 -13.258 -8.298 3.456 1.00 2.22 H new ATOM 0 HA PHE A 57 -13.029 -5.655 2.117 1.00 65.42 H new ATOM 0 HB2 PHE A 57 -15.440 -7.466 2.341 1.00 21.50 H new ATOM 0 HB3 PHE A 57 -15.343 -5.940 1.484 1.00 21.50 H new ATOM 0 HD1 PHE A 57 -12.912 -5.940 -0.010 1.00 61.23 H new ATOM 0 HD2 PHE A 57 -15.497 -9.282 0.824 1.00 65.44 H new ATOM 0 HE1 PHE A 57 -11.876 -7.199 -1.884 1.00 13.04 H new ATOM 0 HE2 PHE A 57 -14.473 -10.527 -1.066 1.00 30.12 H new ATOM 0 HZ PHE A 57 -12.625 -9.519 -2.374 1.00 5.12 H new ATOM 918 N ASP A 58 -13.309 -5.833 5.024 1.00 22.51 N ATOM 919 CA ASP A 58 -13.293 -4.931 6.151 1.00 43.44 C ATOM 920 C ASP A 58 -12.621 -3.624 5.725 1.00 64.52 C ATOM 921 O ASP A 58 -11.390 -3.539 5.623 1.00 62.32 O ATOM 922 CB ASP A 58 -12.564 -5.516 7.370 1.00 14.11 C ATOM 923 CG ASP A 58 -13.153 -6.766 8.022 1.00 53.33 C ATOM 924 OD1 ASP A 58 -14.311 -7.167 7.746 1.00 61.53 O ATOM 925 OD2 ASP A 58 -12.416 -7.366 8.842 1.00 72.25 O ATOM 0 H ASP A 58 -12.772 -6.688 5.166 1.00 22.51 H new ATOM 0 HA ASP A 58 -14.325 -4.758 6.455 1.00 43.44 H new ATOM 0 HB2 ASP A 58 -11.541 -5.745 7.070 1.00 14.11 H new ATOM 0 HB3 ASP A 58 -12.506 -4.737 8.131 1.00 14.11 H new ATOM 930 N HIS A 59 -13.426 -2.600 5.453 1.00 2.10 N ATOM 931 CA HIS A 59 -12.977 -1.244 5.164 1.00 51.43 C ATOM 932 C HIS A 59 -12.643 -0.453 6.431 1.00 24.20 C ATOM 933 O HIS A 59 -12.250 0.703 6.342 1.00 13.11 O ATOM 934 CB HIS A 59 -13.983 -0.544 4.251 1.00 22.51 C ATOM 935 CG HIS A 59 -15.381 -0.420 4.781 1.00 63.14 C ATOM 936 ND1 HIS A 59 -15.924 0.703 5.355 1.00 11.01 N ATOM 937 CD2 HIS A 59 -16.370 -1.357 4.658 1.00 61.22 C ATOM 938 CE1 HIS A 59 -17.225 0.445 5.556 1.00 33.53 C ATOM 939 NE2 HIS A 59 -17.548 -0.801 5.162 1.00 24.12 N ATOM 0 H HIS A 59 -14.441 -2.696 5.427 1.00 2.10 H new ATOM 0 HA HIS A 59 -12.033 -1.300 4.623 1.00 51.43 H new ATOM 0 HB2 HIS A 59 -13.609 0.456 4.032 1.00 22.51 H new ATOM 0 HB3 HIS A 59 -14.021 -1.084 3.305 1.00 22.51 H new ATOM 0 HD1 HIS A 59 -15.433 1.567 5.584 1.00 11.01 H new ATOM 0 HD2 HIS A 59 -16.260 -2.349 4.245 1.00 61.22 H new ATOM 0 HE1 HIS A 59 -17.926 1.149 5.981 1.00 33.53 H new ATOM 947 N GLU A 60 -12.708 -1.062 7.611 1.00 31.10 N ATOM 948 CA GLU A 60 -12.467 -0.409 8.894 1.00 72.55 C ATOM 949 C GLU A 60 -10.977 -0.343 9.271 1.00 64.53 C ATOM 950 O GLU A 60 -10.623 -0.208 10.444 1.00 13.33 O ATOM 951 CB GLU A 60 -13.251 -1.156 9.966 1.00 12.10 C ATOM 952 CG GLU A 60 -14.761 -1.214 9.708 1.00 70.54 C ATOM 953 CD GLU A 60 -15.458 -1.555 11.021 1.00 30.31 C ATOM 954 OE1 GLU A 60 -15.437 -2.729 11.450 1.00 70.53 O ATOM 955 OE2 GLU A 60 -15.901 -0.611 11.716 1.00 74.52 O ATOM 0 H GLU A 60 -12.936 -2.052 7.704 1.00 31.10 H new ATOM 0 HA GLU A 60 -12.801 0.625 8.814 1.00 72.55 H new ATOM 0 HB2 GLU A 60 -12.866 -2.173 10.040 1.00 12.10 H new ATOM 0 HB3 GLU A 60 -13.076 -0.678 10.930 1.00 12.10 H new ATOM 0 HG2 GLU A 60 -15.118 -0.258 9.326 1.00 70.54 H new ATOM 0 HG3 GLU A 60 -14.988 -1.965 8.951 1.00 70.54 H new ATOM 962 N THR A 61 -10.081 -0.443 8.298 1.00 65.33 N ATOM 963 CA THR A 61 -8.630 -0.454 8.477 1.00 43.03 C ATOM 964 C THR A 61 -7.986 0.695 7.691 1.00 3.44 C ATOM 965 O THR A 61 -8.663 1.318 6.873 1.00 2.40 O ATOM 966 CB THR A 61 -8.108 -1.866 8.157 1.00 72.23 C ATOM 967 OG1 THR A 61 -6.883 -2.075 8.818 1.00 24.52 O ATOM 968 CG2 THR A 61 -7.964 -2.164 6.661 1.00 74.25 C ATOM 0 H THR A 61 -10.355 -0.522 7.319 1.00 65.33 H new ATOM 0 HA THR A 61 -8.344 -0.257 9.510 1.00 43.03 H new ATOM 0 HB THR A 61 -8.865 -2.562 8.519 1.00 72.23 H new ATOM 0 HG1 THR A 61 -6.551 -2.975 8.616 1.00 24.52 H new ATOM 0 HG21 THR A 61 -7.591 -3.179 6.527 1.00 74.25 H new ATOM 0 HG22 THR A 61 -8.935 -2.067 6.176 1.00 74.25 H new ATOM 0 HG23 THR A 61 -7.263 -1.458 6.215 1.00 74.25 H new ATOM 976 N ASP A 62 -6.720 1.008 7.982 1.00 64.34 N ATOM 977 CA ASP A 62 -6.004 2.151 7.415 1.00 31.14 C ATOM 978 C ASP A 62 -5.790 1.981 5.912 1.00 61.11 C ATOM 979 O ASP A 62 -5.725 0.856 5.407 1.00 65.53 O ATOM 980 CB ASP A 62 -4.658 2.380 8.119 1.00 4.22 C ATOM 981 CG ASP A 62 -3.642 1.245 7.936 1.00 42.24 C ATOM 982 OD1 ASP A 62 -3.599 0.367 8.826 1.00 22.22 O ATOM 983 OD2 ASP A 62 -2.776 1.291 7.024 1.00 14.42 O ATOM 0 H ASP A 62 -6.154 0.462 8.632 1.00 64.34 H new ATOM 0 HA ASP A 62 -6.627 3.030 7.578 1.00 31.14 H new ATOM 0 HB2 ASP A 62 -4.220 3.306 7.746 1.00 4.22 H new ATOM 0 HB3 ASP A 62 -4.839 2.520 9.185 1.00 4.22 H new ATOM 988 N ILE A 63 -5.611 3.096 5.203 1.00 31.50 N ATOM 989 CA ILE A 63 -5.613 3.204 3.753 1.00 42.01 C ATOM 990 C ILE A 63 -4.484 4.157 3.363 1.00 63.34 C ATOM 991 O ILE A 63 -4.661 5.373 3.386 1.00 40.24 O ATOM 992 CB ILE A 63 -6.997 3.706 3.269 1.00 2.40 C ATOM 993 CG1 ILE A 63 -8.197 2.956 3.869 1.00 11.20 C ATOM 994 CG2 ILE A 63 -7.093 3.700 1.738 1.00 4.24 C ATOM 995 CD1 ILE A 63 -8.363 1.510 3.393 1.00 54.12 C ATOM 0 H ILE A 63 -5.452 3.996 5.656 1.00 31.50 H new ATOM 0 HA ILE A 63 -5.444 2.238 3.278 1.00 42.01 H new ATOM 0 HB ILE A 63 -7.059 4.729 3.639 1.00 2.40 H new ATOM 0 HG12 ILE A 63 -8.100 2.956 4.955 1.00 11.20 H new ATOM 0 HG13 ILE A 63 -9.107 3.507 3.631 1.00 11.20 H new ATOM 0 HG21 ILE A 63 -8.077 4.058 1.434 1.00 4.24 H new ATOM 0 HG22 ILE A 63 -6.325 4.353 1.323 1.00 4.24 H new ATOM 0 HG23 ILE A 63 -6.946 2.685 1.368 1.00 4.24 H new ATOM 0 HD11 ILE A 63 -9.236 1.067 3.872 1.00 54.12 H new ATOM 0 HD12 ILE A 63 -8.497 1.496 2.311 1.00 54.12 H new ATOM 0 HD13 ILE A 63 -7.474 0.936 3.656 1.00 54.12 H new ATOM 1007 N ASP A 64 -3.332 3.601 2.983 1.00 51.35 N ATOM 1008 CA ASP A 64 -2.247 4.366 2.367 1.00 62.33 C ATOM 1009 C ASP A 64 -2.761 4.999 1.077 1.00 0.44 C ATOM 1010 O ASP A 64 -3.115 4.276 0.145 1.00 11.23 O ATOM 1011 CB ASP A 64 -1.081 3.452 1.982 1.00 12.12 C ATOM 1012 CG ASP A 64 -0.032 3.245 3.077 1.00 53.44 C ATOM 1013 OD1 ASP A 64 -0.352 2.651 4.130 1.00 34.22 O ATOM 1014 OD2 ASP A 64 1.124 3.725 2.949 1.00 73.54 O ATOM 0 H ASP A 64 -3.125 2.608 3.094 1.00 51.35 H new ATOM 0 HA ASP A 64 -1.911 5.115 3.085 1.00 62.33 H new ATOM 0 HB2 ASP A 64 -1.481 2.480 1.695 1.00 12.12 H new ATOM 0 HB3 ASP A 64 -0.589 3.867 1.102 1.00 12.12 H new ATOM 1019 N VAL A 65 -2.773 6.328 1.005 1.00 4.10 N ATOM 1020 CA VAL A 65 -3.117 7.093 -0.177 1.00 15.42 C ATOM 1021 C VAL A 65 -1.858 7.873 -0.523 1.00 14.14 C ATOM 1022 O VAL A 65 -1.546 8.864 0.140 1.00 20.33 O ATOM 1023 CB VAL A 65 -4.316 8.017 0.127 1.00 55.05 C ATOM 1024 CG1 VAL A 65 -4.726 8.809 -1.115 1.00 21.43 C ATOM 1025 CG2 VAL A 65 -5.571 7.260 0.551 1.00 34.40 C ATOM 0 H VAL A 65 -2.533 6.918 1.802 1.00 4.10 H new ATOM 0 HA VAL A 65 -3.425 6.469 -1.016 1.00 15.42 H new ATOM 0 HB VAL A 65 -3.968 8.657 0.938 1.00 55.05 H new ATOM 0 HG11 VAL A 65 -5.573 9.452 -0.874 1.00 21.43 H new ATOM 0 HG12 VAL A 65 -3.889 9.422 -1.449 1.00 21.43 H new ATOM 0 HG13 VAL A 65 -5.010 8.119 -1.909 1.00 21.43 H new ATOM 0 HG21 VAL A 65 -6.374 7.970 0.749 1.00 34.40 H new ATOM 0 HG22 VAL A 65 -5.874 6.582 -0.247 1.00 34.40 H new ATOM 0 HG23 VAL A 65 -5.362 6.687 1.454 1.00 34.40 H new ATOM 1035 N ILE A 66 -1.123 7.459 -1.548 1.00 11.42 N ATOM 1036 CA ILE A 66 0.059 8.171 -2.023 1.00 44.31 C ATOM 1037 C ILE A 66 -0.250 9.003 -3.269 1.00 43.25 C ATOM 1038 O ILE A 66 -1.123 8.633 -4.057 1.00 62.54 O ATOM 1039 CB ILE A 66 1.195 7.171 -2.277 1.00 14.02 C ATOM 1040 CG1 ILE A 66 0.835 6.098 -3.326 1.00 34.42 C ATOM 1041 CG2 ILE A 66 1.644 6.521 -0.957 1.00 13.32 C ATOM 1042 CD1 ILE A 66 2.069 5.361 -3.828 1.00 0.34 C ATOM 0 H ILE A 66 -1.332 6.613 -2.078 1.00 11.42 H new ATOM 0 HA ILE A 66 0.379 8.872 -1.252 1.00 44.31 H new ATOM 0 HB ILE A 66 2.026 7.739 -2.696 1.00 14.02 H new ATOM 0 HG12 ILE A 66 0.137 5.383 -2.890 1.00 34.42 H new ATOM 0 HG13 ILE A 66 0.326 6.568 -4.167 1.00 34.42 H new ATOM 0 HG21 ILE A 66 2.450 5.815 -1.155 1.00 13.32 H new ATOM 0 HG22 ILE A 66 1.998 7.293 -0.273 1.00 13.32 H new ATOM 0 HG23 ILE A 66 0.803 5.995 -0.506 1.00 13.32 H new ATOM 0 HD11 ILE A 66 1.772 4.614 -4.565 1.00 0.34 H new ATOM 0 HD12 ILE A 66 2.755 6.072 -4.288 1.00 0.34 H new ATOM 0 HD13 ILE A 66 2.564 4.868 -2.991 1.00 0.34 H new ATOM 1054 N PHE A 67 0.485 10.109 -3.444 1.00 20.33 N ATOM 1055 CA PHE A 67 0.422 11.045 -4.555 1.00 43.23 C ATOM 1056 C PHE A 67 1.768 11.772 -4.665 1.00 22.30 C ATOM 1057 O PHE A 67 2.545 11.821 -3.703 1.00 22.51 O ATOM 1058 CB PHE A 67 -0.749 12.036 -4.364 1.00 44.43 C ATOM 1059 CG PHE A 67 -0.554 13.212 -3.413 1.00 24.13 C ATOM 1060 CD1 PHE A 67 -0.160 13.011 -2.077 1.00 24.50 C ATOM 1061 CD2 PHE A 67 -0.858 14.519 -3.837 1.00 53.45 C ATOM 1062 CE1 PHE A 67 -0.109 14.077 -1.173 1.00 1.32 C ATOM 1063 CE2 PHE A 67 -0.747 15.602 -2.945 1.00 55.32 C ATOM 1064 CZ PHE A 67 -0.376 15.386 -1.608 1.00 73.44 C ATOM 0 H PHE A 67 1.188 10.386 -2.758 1.00 20.33 H new ATOM 0 HA PHE A 67 0.236 10.508 -5.485 1.00 43.23 H new ATOM 0 HB2 PHE A 67 -1.006 12.440 -5.343 1.00 44.43 H new ATOM 0 HB3 PHE A 67 -1.612 11.468 -4.017 1.00 44.43 H new ATOM 0 HD1 PHE A 67 0.107 12.019 -1.745 1.00 24.50 H new ATOM 0 HD2 PHE A 67 -1.179 14.692 -4.854 1.00 53.45 H new ATOM 0 HE1 PHE A 67 0.136 13.893 -0.137 1.00 1.32 H new ATOM 0 HE2 PHE A 67 -0.948 16.605 -3.291 1.00 55.32 H new ATOM 0 HZ PHE A 67 -0.297 16.216 -0.922 1.00 73.44 H new ATOM 1074 N PHE A 68 2.017 12.375 -5.827 1.00 71.41 N ATOM 1075 CA PHE A 68 3.176 13.195 -6.142 1.00 54.13 C ATOM 1076 C PHE A 68 2.606 14.563 -6.490 1.00 31.30 C ATOM 1077 O PHE A 68 1.918 14.690 -7.504 1.00 1.31 O ATOM 1078 CB PHE A 68 3.955 12.578 -7.320 1.00 35.14 C ATOM 1079 CG PHE A 68 4.939 13.536 -7.970 1.00 32.20 C ATOM 1080 CD1 PHE A 68 6.196 13.766 -7.384 1.00 2.12 C ATOM 1081 CD2 PHE A 68 4.567 14.259 -9.122 1.00 61.32 C ATOM 1082 CE1 PHE A 68 7.061 14.733 -7.927 1.00 61.52 C ATOM 1083 CE2 PHE A 68 5.438 15.217 -9.670 1.00 75.34 C ATOM 1084 CZ PHE A 68 6.684 15.457 -9.069 1.00 31.22 C ATOM 0 H PHE A 68 1.375 12.297 -6.616 1.00 71.41 H new ATOM 0 HA PHE A 68 3.884 13.265 -5.316 1.00 54.13 H new ATOM 0 HB2 PHE A 68 4.496 11.700 -6.966 1.00 35.14 H new ATOM 0 HB3 PHE A 68 3.246 12.234 -8.073 1.00 35.14 H new ATOM 0 HD1 PHE A 68 6.498 13.199 -6.516 1.00 2.12 H new ATOM 0 HD2 PHE A 68 3.609 14.076 -9.585 1.00 61.32 H new ATOM 0 HE1 PHE A 68 8.019 14.919 -7.464 1.00 61.52 H new ATOM 0 HE2 PHE A 68 5.149 15.768 -10.553 1.00 75.34 H new ATOM 0 HZ PHE A 68 7.351 16.197 -9.485 1.00 31.22 H new ATOM 1094 N ASP A 69 2.815 15.565 -5.632 1.00 53.01 N ATOM 1095 CA ASP A 69 2.319 16.907 -5.923 1.00 41.22 C ATOM 1096 C ASP A 69 3.242 17.988 -5.371 1.00 23.41 C ATOM 1097 O ASP A 69 3.007 18.475 -4.267 1.00 44.25 O ATOM 1098 CB ASP A 69 0.873 17.065 -5.454 1.00 22.42 C ATOM 1099 CG ASP A 69 0.174 18.271 -6.073 1.00 62.42 C ATOM 1100 OD1 ASP A 69 0.838 19.232 -6.525 1.00 1.14 O ATOM 1101 OD2 ASP A 69 -1.073 18.231 -6.153 1.00 63.21 O ATOM 0 H ASP A 69 3.315 15.474 -4.747 1.00 53.01 H new ATOM 0 HA ASP A 69 2.320 17.040 -7.005 1.00 41.22 H new ATOM 0 HB2 ASP A 69 0.316 16.162 -5.702 1.00 22.42 H new ATOM 0 HB3 ASP A 69 0.857 17.161 -4.368 1.00 22.42 H new ATOM 1106 N PRO A 70 4.322 18.339 -6.091 1.00 41.25 N ATOM 1107 CA PRO A 70 5.437 19.146 -5.585 1.00 15.12 C ATOM 1108 C PRO A 70 5.075 20.578 -5.193 1.00 20.22 C ATOM 1109 O PRO A 70 5.864 21.250 -4.526 1.00 15.23 O ATOM 1110 CB PRO A 70 6.510 19.120 -6.673 1.00 2.31 C ATOM 1111 CG PRO A 70 5.744 18.738 -7.928 1.00 2.00 C ATOM 1112 CD PRO A 70 4.619 17.861 -7.427 1.00 54.43 C ATOM 0 HA PRO A 70 5.783 18.713 -4.647 1.00 15.12 H new ATOM 0 HB2 PRO A 70 6.995 20.090 -6.780 1.00 2.31 H new ATOM 0 HB3 PRO A 70 7.293 18.396 -6.446 1.00 2.31 H new ATOM 0 HG2 PRO A 70 5.362 19.619 -8.444 1.00 2.00 H new ATOM 0 HG3 PRO A 70 6.379 18.205 -8.635 1.00 2.00 H new ATOM 0 HD2 PRO A 70 3.745 17.936 -8.074 1.00 54.43 H new ATOM 0 HD3 PRO A 70 4.916 16.812 -7.412 1.00 54.43 H new ATOM 1120 N ASP A 71 3.910 21.047 -5.620 1.00 54.01 N ATOM 1121 CA ASP A 71 3.366 22.354 -5.322 1.00 34.20 C ATOM 1122 C ASP A 71 2.524 22.328 -4.050 1.00 44.32 C ATOM 1123 O ASP A 71 2.404 23.360 -3.386 1.00 4.04 O ATOM 1124 CB ASP A 71 2.474 22.752 -6.502 1.00 12.02 C ATOM 1125 CG ASP A 71 3.177 23.733 -7.425 1.00 72.22 C ATOM 1126 OD1 ASP A 71 3.305 24.929 -7.087 1.00 53.25 O ATOM 1127 OD2 ASP A 71 3.633 23.311 -8.511 1.00 23.13 O ATOM 0 H ASP A 71 3.292 20.494 -6.213 1.00 54.01 H new ATOM 0 HA ASP A 71 4.180 23.063 -5.169 1.00 34.20 H new ATOM 0 HB2 ASP A 71 2.192 21.861 -7.063 1.00 12.02 H new ATOM 0 HB3 ASP A 71 1.552 23.199 -6.129 1.00 12.02 H new ATOM 1132 N PHE A 72 1.912 21.185 -3.732 1.00 34.33 N ATOM 1133 CA PHE A 72 0.877 21.075 -2.715 1.00 0.14 C ATOM 1134 C PHE A 72 1.517 21.170 -1.347 1.00 14.30 C ATOM 1135 O PHE A 72 2.198 20.228 -0.959 1.00 41.25 O ATOM 1136 CB PHE A 72 0.103 19.758 -2.856 1.00 2.24 C ATOM 1137 CG PHE A 72 -1.354 19.892 -2.468 1.00 14.42 C ATOM 1138 CD1 PHE A 72 -2.221 20.654 -3.274 1.00 40.31 C ATOM 1139 CD2 PHE A 72 -1.834 19.324 -1.275 1.00 33.24 C ATOM 1140 CE1 PHE A 72 -3.547 20.888 -2.873 1.00 42.04 C ATOM 1141 CE2 PHE A 72 -3.165 19.542 -0.882 1.00 55.21 C ATOM 1142 CZ PHE A 72 -4.015 20.340 -1.668 1.00 15.12 C ATOM 0 H PHE A 72 2.129 20.297 -4.185 1.00 34.33 H new ATOM 0 HA PHE A 72 0.165 21.890 -2.843 1.00 0.14 H new ATOM 0 HB2 PHE A 72 0.170 19.411 -3.887 1.00 2.24 H new ATOM 0 HB3 PHE A 72 0.572 18.997 -2.232 1.00 2.24 H new ATOM 0 HD1 PHE A 72 -1.864 21.062 -4.208 1.00 40.31 H new ATOM 0 HD2 PHE A 72 -1.181 18.721 -0.662 1.00 33.24 H new ATOM 0 HE1 PHE A 72 -4.203 21.486 -3.488 1.00 42.04 H new ATOM 0 HE2 PHE A 72 -3.537 19.095 0.028 1.00 55.21 H new ATOM 0 HZ PHE A 72 -5.028 20.531 -1.345 1.00 15.12 H new ATOM 1152 N SER A 73 1.329 22.287 -0.644 1.00 35.13 N ATOM 1153 CA SER A 73 1.979 22.501 0.643 1.00 75.12 C ATOM 1154 C SER A 73 1.740 21.349 1.609 1.00 42.31 C ATOM 1155 O SER A 73 0.754 20.611 1.556 1.00 63.31 O ATOM 1156 CB SER A 73 1.563 23.832 1.268 1.00 55.31 C ATOM 1157 OG SER A 73 2.380 24.865 0.769 1.00 51.41 O ATOM 0 H SER A 73 0.731 23.056 -0.947 1.00 35.13 H new ATOM 0 HA SER A 73 3.050 22.541 0.446 1.00 75.12 H new ATOM 0 HB2 SER A 73 0.517 24.040 1.042 1.00 55.31 H new ATOM 0 HB3 SER A 73 1.650 23.778 2.353 1.00 55.31 H new ATOM 0 HG SER A 73 2.110 25.718 1.170 1.00 51.41 H new ATOM 1163 N TYR A 74 2.678 21.244 2.542 1.00 74.25 N ATOM 1164 CA TYR A 74 2.671 20.239 3.575 1.00 54.33 C ATOM 1165 C TYR A 74 1.360 20.359 4.339 1.00 20.14 C ATOM 1166 O TYR A 74 0.603 19.402 4.406 1.00 51.12 O ATOM 1167 CB TYR A 74 3.899 20.439 4.464 1.00 1.00 C ATOM 1168 CG TYR A 74 4.138 19.320 5.445 1.00 31.43 C ATOM 1169 CD1 TYR A 74 3.445 19.288 6.668 1.00 40.24 C ATOM 1170 CD2 TYR A 74 5.066 18.313 5.132 1.00 35.42 C ATOM 1171 CE1 TYR A 74 3.743 18.296 7.620 1.00 11.33 C ATOM 1172 CE2 TYR A 74 5.341 17.302 6.065 1.00 13.31 C ATOM 1173 CZ TYR A 74 4.711 17.311 7.330 1.00 21.32 C ATOM 1174 OH TYR A 74 5.050 16.388 8.270 1.00 11.33 O ATOM 0 H TYR A 74 3.479 21.874 2.595 1.00 74.25 H new ATOM 0 HA TYR A 74 2.730 19.230 3.167 1.00 54.33 H new ATOM 0 HB2 TYR A 74 4.779 20.546 3.830 1.00 1.00 H new ATOM 0 HB3 TYR A 74 3.787 21.373 5.015 1.00 1.00 H new ATOM 0 HD1 TYR A 74 2.684 20.025 6.877 1.00 40.24 H new ATOM 0 HD2 TYR A 74 5.567 18.317 4.175 1.00 35.42 H new ATOM 0 HE1 TYR A 74 3.232 18.288 8.571 1.00 11.33 H new ATOM 0 HE2 TYR A 74 6.036 16.514 5.816 1.00 13.31 H new ATOM 0 HH TYR A 74 5.999 16.160 8.178 1.00 11.33 H new ATOM 1184 N GLU A 75 1.051 21.550 4.858 1.00 71.34 N ATOM 1185 CA GLU A 75 -0.142 21.757 5.666 1.00 42.14 C ATOM 1186 C GLU A 75 -1.408 21.514 4.842 1.00 63.55 C ATOM 1187 O GLU A 75 -2.330 20.875 5.333 1.00 13.32 O ATOM 1188 CB GLU A 75 -0.107 23.154 6.278 1.00 34.41 C ATOM 1189 CG GLU A 75 0.530 23.102 7.673 1.00 44.15 C ATOM 1190 CD GLU A 75 -0.395 22.603 8.790 1.00 44.03 C ATOM 1191 OE1 GLU A 75 -1.385 23.305 9.100 1.00 35.32 O ATOM 1192 OE2 GLU A 75 -0.077 21.578 9.439 1.00 72.52 O ATOM 0 H GLU A 75 1.618 22.388 4.729 1.00 71.34 H new ATOM 0 HA GLU A 75 -0.160 21.034 6.481 1.00 42.14 H new ATOM 0 HB2 GLU A 75 0.460 23.827 5.635 1.00 34.41 H new ATOM 0 HB3 GLU A 75 -1.118 23.555 6.346 1.00 34.41 H new ATOM 0 HG2 GLU A 75 1.407 22.455 7.632 1.00 44.15 H new ATOM 0 HG3 GLU A 75 0.882 24.100 7.932 1.00 44.15 H new ATOM 1199 N GLU A 76 -1.442 21.948 3.578 1.00 4.33 N ATOM 1200 CA GLU A 76 -2.565 21.675 2.680 1.00 32.50 C ATOM 1201 C GLU A 76 -2.798 20.175 2.569 1.00 43.41 C ATOM 1202 O GLU A 76 -3.945 19.741 2.556 1.00 24.42 O ATOM 1203 CB GLU A 76 -2.279 22.220 1.281 1.00 23.41 C ATOM 1204 CG GLU A 76 -2.348 23.738 1.208 1.00 13.41 C ATOM 1205 CD GLU A 76 -3.711 24.284 0.764 1.00 41.33 C ATOM 1206 OE1 GLU A 76 -4.774 23.657 0.999 1.00 60.22 O ATOM 1207 OE2 GLU A 76 -3.731 25.405 0.202 1.00 72.34 O ATOM 0 H GLU A 76 -0.695 22.496 3.152 1.00 4.33 H new ATOM 0 HA GLU A 76 -3.448 22.163 3.093 1.00 32.50 H new ATOM 0 HB2 GLU A 76 -1.289 21.891 0.965 1.00 23.41 H new ATOM 0 HB3 GLU A 76 -2.996 21.795 0.578 1.00 23.41 H new ATOM 0 HG2 GLU A 76 -2.106 24.149 2.188 1.00 13.41 H new ATOM 0 HG3 GLU A 76 -1.584 24.093 0.516 1.00 13.41 H new ATOM 1214 N THR A 77 -1.723 19.387 2.519 1.00 2.40 N ATOM 1215 CA THR A 77 -1.826 17.932 2.493 1.00 44.15 C ATOM 1216 C THR A 77 -2.605 17.434 3.724 1.00 74.33 C ATOM 1217 O THR A 77 -3.583 16.696 3.572 1.00 60.54 O ATOM 1218 CB THR A 77 -0.434 17.284 2.349 1.00 20.13 C ATOM 1219 OG1 THR A 77 0.279 17.821 1.246 1.00 31.34 O ATOM 1220 CG2 THR A 77 -0.550 15.778 2.116 1.00 63.22 C ATOM 0 H THR A 77 -0.766 19.738 2.496 1.00 2.40 H new ATOM 0 HA THR A 77 -2.393 17.624 1.614 1.00 44.15 H new ATOM 0 HB THR A 77 0.095 17.492 3.279 1.00 20.13 H new ATOM 0 HG1 THR A 77 0.493 18.761 1.421 1.00 31.34 H new ATOM 0 HG21 THR A 77 0.446 15.347 2.018 1.00 63.22 H new ATOM 0 HG22 THR A 77 -1.063 15.318 2.960 1.00 63.22 H new ATOM 0 HG23 THR A 77 -1.116 15.594 1.203 1.00 63.22 H new ATOM 1228 N LEU A 78 -2.227 17.851 4.940 1.00 60.53 N ATOM 1229 CA LEU A 78 -2.906 17.392 6.158 1.00 71.33 C ATOM 1230 C LEU A 78 -4.356 17.875 6.206 1.00 75.52 C ATOM 1231 O LEU A 78 -5.213 17.203 6.790 1.00 42.13 O ATOM 1232 CB LEU A 78 -2.188 17.872 7.435 1.00 33.33 C ATOM 1233 CG LEU A 78 -0.806 17.267 7.770 1.00 54.13 C ATOM 1234 CD1 LEU A 78 -0.439 15.997 6.990 1.00 44.11 C ATOM 1235 CD2 LEU A 78 0.277 18.308 7.558 1.00 74.22 C ATOM 0 H LEU A 78 -1.459 18.502 5.106 1.00 60.53 H new ATOM 0 HA LEU A 78 -2.883 16.303 6.123 1.00 71.33 H new ATOM 0 HB2 LEU A 78 -2.069 18.953 7.363 1.00 33.33 H new ATOM 0 HB3 LEU A 78 -2.849 17.680 8.280 1.00 33.33 H new ATOM 0 HG LEU A 78 -0.877 16.965 8.815 1.00 54.13 H new ATOM 0 HD11 LEU A 78 0.548 15.653 7.298 1.00 44.11 H new ATOM 0 HD12 LEU A 78 -1.175 15.219 7.195 1.00 44.11 H new ATOM 0 HD13 LEU A 78 -0.430 16.216 5.922 1.00 44.11 H new ATOM 0 HD21 LEU A 78 1.249 17.876 7.796 1.00 74.22 H new ATOM 0 HD22 LEU A 78 0.270 18.634 6.518 1.00 74.22 H new ATOM 0 HD23 LEU A 78 0.092 19.163 8.208 1.00 74.22 H new ATOM 1247 N LEU A 79 -4.634 19.047 5.637 1.00 55.32 N ATOM 1248 CA LEU A 79 -5.957 19.653 5.650 1.00 15.24 C ATOM 1249 C LEU A 79 -6.891 18.971 4.653 1.00 35.33 C ATOM 1250 O LEU A 79 -8.033 18.661 4.989 1.00 22.30 O ATOM 1251 CB LEU A 79 -5.827 21.163 5.390 1.00 35.10 C ATOM 1252 CG LEU A 79 -5.668 21.990 6.683 1.00 34.31 C ATOM 1253 CD1 LEU A 79 -4.622 21.458 7.668 1.00 72.11 C ATOM 1254 CD2 LEU A 79 -5.270 23.421 6.335 1.00 44.01 C ATOM 0 H LEU A 79 -3.935 19.607 5.149 1.00 55.32 H new ATOM 0 HA LEU A 79 -6.408 19.512 6.632 1.00 15.24 H new ATOM 0 HB2 LEU A 79 -4.967 21.341 4.744 1.00 35.10 H new ATOM 0 HB3 LEU A 79 -6.708 21.510 4.851 1.00 35.10 H new ATOM 0 HG LEU A 79 -6.640 21.927 7.172 1.00 34.31 H new ATOM 0 HD11 LEU A 79 -4.584 22.106 8.544 1.00 72.11 H new ATOM 0 HD12 LEU A 79 -4.892 20.448 7.975 1.00 72.11 H new ATOM 0 HD13 LEU A 79 -3.644 21.441 7.187 1.00 72.11 H new ATOM 0 HD21 LEU A 79 -5.159 24.001 7.251 1.00 44.01 H new ATOM 0 HD22 LEU A 79 -4.324 23.414 5.793 1.00 44.01 H new ATOM 0 HD23 LEU A 79 -6.042 23.872 5.712 1.00 44.01 H new ATOM 1266 N LEU A 80 -6.406 18.704 3.445 1.00 44.11 N ATOM 1267 CA LEU A 80 -7.092 17.935 2.419 1.00 1.01 C ATOM 1268 C LEU A 80 -7.378 16.519 2.922 1.00 75.12 C ATOM 1269 O LEU A 80 -8.440 15.970 2.624 1.00 13.34 O ATOM 1270 CB LEU A 80 -6.221 17.967 1.153 1.00 64.32 C ATOM 1271 CG LEU A 80 -6.643 17.042 0.002 1.00 41.34 C ATOM 1272 CD1 LEU A 80 -8.127 17.064 -0.341 1.00 64.32 C ATOM 1273 CD2 LEU A 80 -5.849 17.411 -1.254 1.00 2.30 C ATOM 0 H LEU A 80 -5.488 19.031 3.144 1.00 44.11 H new ATOM 0 HA LEU A 80 -8.064 18.365 2.178 1.00 1.01 H new ATOM 0 HB2 LEU A 80 -6.203 18.990 0.778 1.00 64.32 H new ATOM 0 HB3 LEU A 80 -5.199 17.713 1.436 1.00 64.32 H new ATOM 0 HG LEU A 80 -6.430 16.032 0.351 1.00 41.34 H new ATOM 0 HD11 LEU A 80 -8.320 16.378 -1.165 1.00 64.32 H new ATOM 0 HD12 LEU A 80 -8.706 16.757 0.530 1.00 64.32 H new ATOM 0 HD13 LEU A 80 -8.418 18.073 -0.633 1.00 64.32 H new ATOM 0 HD21 LEU A 80 -6.144 16.758 -2.076 1.00 2.30 H new ATOM 0 HD22 LEU A 80 -6.054 18.447 -1.523 1.00 2.30 H new ATOM 0 HD23 LEU A 80 -4.783 17.291 -1.059 1.00 2.30 H new ATOM 1285 N GLU A 81 -6.484 15.936 3.722 1.00 21.44 N ATOM 1286 CA GLU A 81 -6.767 14.666 4.377 1.00 42.04 C ATOM 1287 C GLU A 81 -7.947 14.811 5.336 1.00 15.33 C ATOM 1288 O GLU A 81 -8.924 14.074 5.224 1.00 31.23 O ATOM 1289 CB GLU A 81 -5.516 14.123 5.078 1.00 42.43 C ATOM 1290 CG GLU A 81 -5.700 12.706 5.647 1.00 3.12 C ATOM 1291 CD GLU A 81 -6.449 11.751 4.708 1.00 23.10 C ATOM 1292 OE1 GLU A 81 -7.691 11.735 4.758 1.00 14.21 O ATOM 1293 OE2 GLU A 81 -5.795 11.055 3.911 1.00 55.35 O ATOM 0 H GLU A 81 -5.563 16.324 3.929 1.00 21.44 H new ATOM 0 HA GLU A 81 -7.050 13.935 3.619 1.00 42.04 H new ATOM 0 HB2 GLU A 81 -4.686 14.118 4.371 1.00 42.43 H new ATOM 0 HB3 GLU A 81 -5.240 14.799 5.888 1.00 42.43 H new ATOM 0 HG2 GLU A 81 -4.720 12.285 5.871 1.00 3.12 H new ATOM 0 HG3 GLU A 81 -6.242 12.772 6.590 1.00 3.12 H new ATOM 1300 N LYS A 82 -7.945 15.795 6.247 1.00 14.04 N ATOM 1301 CA LYS A 82 -9.013 15.844 7.247 1.00 2.22 C ATOM 1302 C LYS A 82 -10.393 15.864 6.562 1.00 35.31 C ATOM 1303 O LYS A 82 -11.328 15.226 7.044 1.00 43.43 O ATOM 1304 CB LYS A 82 -8.791 17.041 8.192 1.00 42.25 C ATOM 1305 CG LYS A 82 -9.581 18.311 7.820 1.00 53.11 C ATOM 1306 CD LYS A 82 -8.922 19.611 8.255 1.00 4.04 C ATOM 1307 CE LYS A 82 -9.923 20.777 8.287 1.00 61.55 C ATOM 1308 NZ LYS A 82 -10.711 20.909 7.032 1.00 32.52 N ATOM 0 H LYS A 82 -7.247 16.536 6.311 1.00 14.04 H new ATOM 0 HA LYS A 82 -8.987 14.943 7.860 1.00 2.22 H new ATOM 0 HB2 LYS A 82 -9.065 16.743 9.204 1.00 42.25 H new ATOM 0 HB3 LYS A 82 -7.728 17.282 8.207 1.00 42.25 H new ATOM 0 HG2 LYS A 82 -9.722 18.333 6.739 1.00 53.11 H new ATOM 0 HG3 LYS A 82 -10.572 18.252 8.269 1.00 53.11 H new ATOM 0 HD2 LYS A 82 -8.483 19.482 9.244 1.00 4.04 H new ATOM 0 HD3 LYS A 82 -8.107 19.851 7.573 1.00 4.04 H new ATOM 0 HE2 LYS A 82 -10.607 20.637 9.124 1.00 61.55 H new ATOM 0 HE3 LYS A 82 -9.383 21.706 8.468 1.00 61.55 H new ATOM 0 HZ1 LYS A 82 -11.254 21.796 7.054 1.00 32.52 H new ATOM 0 HZ2 LYS A 82 -10.066 20.918 6.216 1.00 32.52 H new ATOM 0 HZ3 LYS A 82 -11.365 20.105 6.947 1.00 32.52 H new ATOM 1322 N LYS A 83 -10.488 16.546 5.413 1.00 61.24 N ATOM 1323 CA LYS A 83 -11.659 16.724 4.568 1.00 73.22 C ATOM 1324 C LYS A 83 -12.090 15.393 3.967 1.00 44.24 C ATOM 1325 O LYS A 83 -13.281 15.111 3.876 1.00 74.22 O ATOM 1326 CB LYS A 83 -11.280 17.778 3.513 1.00 44.22 C ATOM 1327 CG LYS A 83 -12.323 18.036 2.413 1.00 12.42 C ATOM 1328 CD LYS A 83 -11.758 17.879 0.996 1.00 52.04 C ATOM 1329 CE LYS A 83 -11.396 16.416 0.719 1.00 73.13 C ATOM 1330 NZ LYS A 83 -11.307 16.132 -0.731 1.00 31.51 N ATOM 0 H LYS A 83 -9.675 17.025 5.025 1.00 61.24 H new ATOM 0 HA LYS A 83 -12.524 17.075 5.131 1.00 73.22 H new ATOM 0 HB2 LYS A 83 -11.080 18.720 4.024 1.00 44.22 H new ATOM 0 HB3 LYS A 83 -10.349 17.469 3.038 1.00 44.22 H new ATOM 0 HG2 LYS A 83 -13.157 17.346 2.543 1.00 12.42 H new ATOM 0 HG3 LYS A 83 -12.722 19.044 2.529 1.00 12.42 H new ATOM 0 HD2 LYS A 83 -12.491 18.222 0.266 1.00 52.04 H new ATOM 0 HD3 LYS A 83 -10.874 18.506 0.879 1.00 52.04 H new ATOM 0 HE2 LYS A 83 -10.443 16.182 1.193 1.00 73.13 H new ATOM 0 HE3 LYS A 83 -12.145 15.765 1.171 1.00 73.13 H new ATOM 0 HZ1 LYS A 83 -10.930 15.173 -0.875 1.00 31.51 H new ATOM 0 HZ2 LYS A 83 -12.254 16.199 -1.157 1.00 31.51 H new ATOM 0 HZ3 LYS A 83 -10.675 16.824 -1.182 1.00 31.51 H new ATOM 1344 N LEU A 84 -11.143 14.559 3.552 1.00 42.05 N ATOM 1345 CA LEU A 84 -11.417 13.214 3.074 1.00 74.33 C ATOM 1346 C LEU A 84 -12.101 12.406 4.176 1.00 61.54 C ATOM 1347 O LEU A 84 -13.182 11.854 3.962 1.00 2.32 O ATOM 1348 CB LEU A 84 -10.097 12.556 2.629 1.00 73.52 C ATOM 1349 CG LEU A 84 -10.053 12.260 1.130 1.00 54.25 C ATOM 1350 CD1 LEU A 84 -8.610 11.928 0.743 1.00 52.11 C ATOM 1351 CD2 LEU A 84 -10.993 11.101 0.784 1.00 33.34 C ATOM 0 H LEU A 84 -10.153 14.803 3.539 1.00 42.05 H new ATOM 0 HA LEU A 84 -12.090 13.248 2.217 1.00 74.33 H new ATOM 0 HB2 LEU A 84 -9.265 13.211 2.889 1.00 73.52 H new ATOM 0 HB3 LEU A 84 -9.956 11.627 3.182 1.00 73.52 H new ATOM 0 HG LEU A 84 -10.389 13.132 0.569 1.00 54.25 H new ATOM 0 HD11 LEU A 84 -8.560 11.714 -0.325 1.00 52.11 H new ATOM 0 HD12 LEU A 84 -7.967 12.777 0.973 1.00 52.11 H new ATOM 0 HD13 LEU A 84 -8.274 11.056 1.304 1.00 52.11 H new ATOM 0 HD21 LEU A 84 -10.949 10.904 -0.287 1.00 33.34 H new ATOM 0 HD22 LEU A 84 -10.687 10.209 1.330 1.00 33.34 H new ATOM 0 HD23 LEU A 84 -12.013 11.364 1.063 1.00 33.34 H new ATOM 1363 N ARG A 85 -11.494 12.346 5.364 1.00 23.10 N ATOM 1364 CA ARG A 85 -12.023 11.561 6.485 1.00 43.35 C ATOM 1365 C ARG A 85 -13.265 12.177 7.121 1.00 34.52 C ATOM 1366 O ARG A 85 -13.926 11.491 7.896 1.00 51.05 O ATOM 1367 CB ARG A 85 -10.943 11.383 7.558 1.00 20.13 C ATOM 1368 CG ARG A 85 -9.738 10.565 7.072 1.00 55.22 C ATOM 1369 CD ARG A 85 -8.437 11.145 7.614 1.00 22.31 C ATOM 1370 NE ARG A 85 -8.219 10.873 9.045 1.00 43.25 N ATOM 1371 CZ ARG A 85 -7.006 10.846 9.609 1.00 13.33 C ATOM 1372 NH1 ARG A 85 -5.901 10.810 8.870 1.00 20.51 N ATOM 1373 NH2 ARG A 85 -6.902 10.875 10.928 1.00 15.14 N ATOM 0 H ARG A 85 -10.626 12.837 5.577 1.00 23.10 H new ATOM 0 HA ARG A 85 -12.317 10.596 6.071 1.00 43.35 H new ATOM 0 HB2 ARG A 85 -10.600 12.364 7.885 1.00 20.13 H new ATOM 0 HB3 ARG A 85 -11.381 10.892 8.427 1.00 20.13 H new ATOM 0 HG2 ARG A 85 -9.842 9.529 7.395 1.00 55.22 H new ATOM 0 HG3 ARG A 85 -9.713 10.559 5.982 1.00 55.22 H new ATOM 0 HD2 ARG A 85 -7.602 10.737 7.044 1.00 22.31 H new ATOM 0 HD3 ARG A 85 -8.435 12.223 7.454 1.00 22.31 H new ATOM 0 HE ARG A 85 -9.032 10.697 9.635 1.00 43.25 H new ATOM 0 HH11 ARG A 85 -5.968 10.803 7.852 1.00 20.51 H new ATOM 0 HH12 ARG A 85 -4.986 10.790 9.321 1.00 20.51 H new ATOM 0 HH21 ARG A 85 -7.742 10.918 11.505 1.00 15.14 H new ATOM 0 HH22 ARG A 85 -5.982 10.855 11.368 1.00 15.14 H new ATOM 1387 N GLU A 86 -13.591 13.445 6.876 1.00 71.54 N ATOM 1388 CA GLU A 86 -14.862 14.010 7.284 1.00 60.14 C ATOM 1389 C GLU A 86 -15.961 13.531 6.345 1.00 75.54 C ATOM 1390 O GLU A 86 -17.070 13.240 6.787 1.00 20.30 O ATOM 1391 CB GLU A 86 -14.785 15.540 7.227 1.00 40.32 C ATOM 1392 CG GLU A 86 -14.149 16.143 8.482 1.00 12.02 C ATOM 1393 CD GLU A 86 -14.758 17.493 8.827 1.00 13.44 C ATOM 1394 OE1 GLU A 86 -15.764 17.500 9.579 1.00 24.13 O ATOM 1395 OE2 GLU A 86 -14.172 18.536 8.470 1.00 22.11 O ATOM 0 H GLU A 86 -12.980 14.102 6.391 1.00 71.54 H new ATOM 0 HA GLU A 86 -15.086 13.690 8.302 1.00 60.14 H new ATOM 0 HB2 GLU A 86 -14.208 15.839 6.352 1.00 40.32 H new ATOM 0 HB3 GLU A 86 -15.789 15.946 7.101 1.00 40.32 H new ATOM 0 HG2 GLU A 86 -14.280 15.459 9.321 1.00 12.02 H new ATOM 0 HG3 GLU A 86 -13.076 16.256 8.328 1.00 12.02 H new ATOM 1402 N ASP A 87 -15.671 13.502 5.047 1.00 74.45 N ATOM 1403 CA ASP A 87 -16.679 13.391 3.998 1.00 62.33 C ATOM 1404 C ASP A 87 -16.977 11.941 3.626 1.00 13.14 C ATOM 1405 O ASP A 87 -18.079 11.624 3.177 1.00 41.35 O ATOM 1406 CB ASP A 87 -16.128 14.110 2.775 1.00 61.43 C ATOM 1407 CG ASP A 87 -17.179 14.500 1.749 1.00 71.14 C ATOM 1408 OD1 ASP A 87 -18.313 14.872 2.128 1.00 42.13 O ATOM 1409 OD2 ASP A 87 -16.793 14.596 0.563 1.00 74.24 O ATOM 0 H ASP A 87 -14.717 13.556 4.690 1.00 74.45 H new ATOM 0 HA ASP A 87 -17.612 13.828 4.355 1.00 62.33 H new ATOM 0 HB2 ASP A 87 -15.606 15.009 3.102 1.00 61.43 H new ATOM 0 HB3 ASP A 87 -15.389 13.469 2.294 1.00 61.43 H new ATOM 1414 N PHE A 88 -16.002 11.055 3.839 1.00 34.31 N ATOM 1415 CA PHE A 88 -16.148 9.611 3.730 1.00 21.11 C ATOM 1416 C PHE A 88 -15.558 8.997 5.005 1.00 42.44 C ATOM 1417 O PHE A 88 -14.496 8.371 4.956 1.00 61.33 O ATOM 1418 CB PHE A 88 -15.507 9.086 2.435 1.00 63.23 C ATOM 1419 CG PHE A 88 -15.965 9.804 1.181 1.00 15.14 C ATOM 1420 CD1 PHE A 88 -15.310 10.983 0.778 1.00 23.40 C ATOM 1421 CD2 PHE A 88 -17.068 9.328 0.445 1.00 55.34 C ATOM 1422 CE1 PHE A 88 -15.743 11.674 -0.362 1.00 40.44 C ATOM 1423 CE2 PHE A 88 -17.500 10.020 -0.703 1.00 52.31 C ATOM 1424 CZ PHE A 88 -16.830 11.189 -1.106 1.00 40.05 C ATOM 0 H PHE A 88 -15.058 11.338 4.101 1.00 34.31 H new ATOM 0 HA PHE A 88 -17.196 9.320 3.655 1.00 21.11 H new ATOM 0 HB2 PHE A 88 -14.424 9.175 2.517 1.00 63.23 H new ATOM 0 HB3 PHE A 88 -15.733 8.024 2.335 1.00 63.23 H new ATOM 0 HD1 PHE A 88 -14.472 11.356 1.348 1.00 23.40 H new ATOM 0 HD2 PHE A 88 -17.582 8.432 0.761 1.00 55.34 H new ATOM 0 HE1 PHE A 88 -15.240 12.580 -0.668 1.00 40.44 H new ATOM 0 HE2 PHE A 88 -18.342 9.654 -1.272 1.00 52.31 H new ATOM 0 HZ PHE A 88 -17.153 11.716 -1.992 1.00 40.05 H new ATOM 1434 N PRO A 89 -16.209 9.206 6.164 1.00 24.53 N ATOM 1435 CA PRO A 89 -15.712 8.775 7.461 1.00 44.31 C ATOM 1436 C PRO A 89 -15.819 7.263 7.658 1.00 60.52 C ATOM 1437 O PRO A 89 -15.330 6.767 8.674 1.00 51.03 O ATOM 1438 CB PRO A 89 -16.563 9.526 8.489 1.00 55.14 C ATOM 1439 CG PRO A 89 -17.905 9.640 7.779 1.00 11.21 C ATOM 1440 CD PRO A 89 -17.495 9.864 6.327 1.00 21.22 C ATOM 0 HA PRO A 89 -14.650 8.997 7.562 1.00 44.31 H new ATOM 0 HB2 PRO A 89 -16.645 8.978 9.427 1.00 55.14 H new ATOM 0 HB3 PRO A 89 -16.144 10.504 8.727 1.00 55.14 H new ATOM 0 HG2 PRO A 89 -18.504 8.737 7.896 1.00 11.21 H new ATOM 0 HG3 PRO A 89 -18.499 10.469 8.165 1.00 11.21 H new ATOM 0 HD2 PRO A 89 -18.235 9.447 5.644 1.00 21.22 H new ATOM 0 HD3 PRO A 89 -17.419 10.928 6.103 1.00 21.22 H new ATOM 1448 N GLN A 90 -16.437 6.514 6.738 1.00 44.03 N ATOM 1449 CA GLN A 90 -16.416 5.053 6.742 1.00 21.23 C ATOM 1450 C GLN A 90 -15.034 4.474 6.389 1.00 74.52 C ATOM 1451 O GLN A 90 -14.905 3.252 6.297 1.00 31.30 O ATOM 1452 CB GLN A 90 -17.518 4.496 5.832 1.00 3.33 C ATOM 1453 CG GLN A 90 -17.268 4.675 4.330 1.00 40.23 C ATOM 1454 CD GLN A 90 -17.986 5.874 3.723 1.00 34.23 C ATOM 1455 OE1 GLN A 90 -17.852 6.999 4.203 1.00 4.02 O ATOM 1456 NE2 GLN A 90 -18.760 5.684 2.671 1.00 62.44 N ATOM 0 H GLN A 90 -16.970 6.912 5.964 1.00 44.03 H new ATOM 0 HA GLN A 90 -16.620 4.731 7.763 1.00 21.23 H new ATOM 0 HB2 GLN A 90 -17.639 3.433 6.041 1.00 3.33 H new ATOM 0 HB3 GLN A 90 -18.460 4.980 6.089 1.00 3.33 H new ATOM 0 HG2 GLN A 90 -16.197 4.781 4.160 1.00 40.23 H new ATOM 0 HG3 GLN A 90 -17.585 3.772 3.809 1.00 40.23 H new ATOM 0 HE21 GLN A 90 -18.866 4.749 2.278 1.00 62.44 H new ATOM 0 HE22 GLN A 90 -19.252 6.473 2.251 1.00 62.44 H new ATOM 1465 N TYR A 91 -14.037 5.327 6.121 1.00 22.33 N ATOM 1466 CA TYR A 91 -12.709 4.927 5.685 1.00 3.10 C ATOM 1467 C TYR A 91 -11.621 5.700 6.449 1.00 53.32 C ATOM 1468 O TYR A 91 -11.891 6.759 7.030 1.00 24.50 O ATOM 1469 CB TYR A 91 -12.576 5.233 4.190 1.00 34.31 C ATOM 1470 CG TYR A 91 -13.585 4.591 3.248 1.00 44.35 C ATOM 1471 CD1 TYR A 91 -13.827 3.206 3.280 1.00 65.13 C ATOM 1472 CD2 TYR A 91 -14.276 5.390 2.318 1.00 31.41 C ATOM 1473 CE1 TYR A 91 -14.760 2.621 2.399 1.00 1.40 C ATOM 1474 CE2 TYR A 91 -15.182 4.810 1.414 1.00 53.12 C ATOM 1475 CZ TYR A 91 -15.435 3.425 1.454 1.00 4.22 C ATOM 1476 OH TYR A 91 -16.343 2.902 0.586 1.00 22.14 O ATOM 0 H TYR A 91 -14.143 6.338 6.206 1.00 22.33 H new ATOM 0 HA TYR A 91 -12.579 3.863 5.880 1.00 3.10 H new ATOM 0 HB2 TYR A 91 -12.636 6.314 4.061 1.00 34.31 H new ATOM 0 HB3 TYR A 91 -11.579 4.929 3.872 1.00 34.31 H new ATOM 0 HD1 TYR A 91 -13.294 2.585 3.985 1.00 65.13 H new ATOM 0 HD2 TYR A 91 -14.109 6.457 2.299 1.00 31.41 H new ATOM 0 HE1 TYR A 91 -14.958 1.560 2.447 1.00 1.40 H new ATOM 0 HE2 TYR A 91 -15.686 5.428 0.686 1.00 53.12 H new ATOM 0 HH TYR A 91 -16.921 2.268 1.060 1.00 22.14 H new ATOM 1486 N GLN A 92 -10.376 5.224 6.378 1.00 64.33 N ATOM 1487 CA GLN A 92 -9.204 5.710 7.104 1.00 20.51 C ATOM 1488 C GLN A 92 -8.078 6.077 6.132 1.00 14.21 C ATOM 1489 O GLN A 92 -7.039 5.422 6.085 1.00 64.54 O ATOM 1490 CB GLN A 92 -8.734 4.640 8.101 1.00 14.30 C ATOM 1491 CG GLN A 92 -9.772 4.233 9.139 1.00 40.04 C ATOM 1492 CD GLN A 92 -9.138 3.611 10.371 1.00 23.33 C ATOM 1493 OE1 GLN A 92 -8.724 4.296 11.307 1.00 62.45 O ATOM 1494 NE2 GLN A 92 -9.038 2.302 10.391 1.00 72.14 N ATOM 0 H GLN A 92 -10.146 4.437 5.771 1.00 64.33 H new ATOM 0 HA GLN A 92 -9.477 6.611 7.654 1.00 20.51 H new ATOM 0 HB2 GLN A 92 -8.431 3.753 7.544 1.00 14.30 H new ATOM 0 HB3 GLN A 92 -7.849 5.010 8.619 1.00 14.30 H new ATOM 0 HG2 GLN A 92 -10.352 5.108 9.433 1.00 40.04 H new ATOM 0 HG3 GLN A 92 -10.470 3.523 8.694 1.00 40.04 H new ATOM 0 HE21 GLN A 92 -9.387 1.752 9.606 1.00 72.14 H new ATOM 0 HE22 GLN A 92 -8.612 1.835 11.191 1.00 72.14 H new ATOM 1503 N TRP A 93 -8.315 7.112 5.336 1.00 51.43 N ATOM 1504 CA TRP A 93 -7.379 7.667 4.369 1.00 33.12 C ATOM 1505 C TRP A 93 -6.138 8.263 5.064 1.00 72.12 C ATOM 1506 O TRP A 93 -6.246 8.858 6.145 1.00 51.15 O ATOM 1507 CB TRP A 93 -8.147 8.733 3.591 1.00 14.20 C ATOM 1508 CG TRP A 93 -9.504 8.357 3.067 1.00 0.41 C ATOM 1509 CD1 TRP A 93 -10.682 8.753 3.601 1.00 31.21 C ATOM 1510 CD2 TRP A 93 -9.849 7.575 1.890 1.00 40.34 C ATOM 1511 NE1 TRP A 93 -11.724 8.323 2.807 1.00 24.33 N ATOM 1512 CE2 TRP A 93 -11.262 7.621 1.711 1.00 55.45 C ATOM 1513 CE3 TRP A 93 -9.106 6.841 0.946 1.00 1.30 C ATOM 1514 CZ2 TRP A 93 -11.886 7.022 0.607 1.00 72.43 C ATOM 1515 CZ3 TRP A 93 -9.715 6.249 -0.172 1.00 2.14 C ATOM 1516 CH2 TRP A 93 -11.105 6.339 -0.339 1.00 42.13 C ATOM 0 H TRP A 93 -9.206 7.609 5.348 1.00 51.43 H new ATOM 0 HA TRP A 93 -7.003 6.892 3.702 1.00 33.12 H new ATOM 0 HB2 TRP A 93 -8.264 9.604 4.236 1.00 14.20 H new ATOM 0 HB3 TRP A 93 -7.532 9.043 2.746 1.00 14.20 H new ATOM 0 HD1 TRP A 93 -10.790 9.321 4.513 1.00 31.21 H new ATOM 0 HE1 TRP A 93 -12.709 8.500 3.004 1.00 24.33 H new ATOM 0 HE3 TRP A 93 -8.041 6.731 1.085 1.00 1.30 H new ATOM 0 HZ2 TRP A 93 -12.957 7.086 0.486 1.00 72.43 H new ATOM 0 HZ3 TRP A 93 -9.115 5.726 -0.902 1.00 2.14 H new ATOM 0 HH2 TRP A 93 -11.575 5.882 -1.197 1.00 42.13 H new ATOM 1527 N GLU A 94 -4.967 8.106 4.433 1.00 1.10 N ATOM 1528 CA GLU A 94 -3.666 8.535 4.939 1.00 31.14 C ATOM 1529 C GLU A 94 -2.855 9.212 3.817 1.00 43.21 C ATOM 1530 O GLU A 94 -1.985 8.580 3.205 1.00 12.01 O ATOM 1531 CB GLU A 94 -2.911 7.319 5.505 1.00 52.21 C ATOM 1532 CG GLU A 94 -3.578 6.634 6.701 1.00 53.03 C ATOM 1533 CD GLU A 94 -3.125 7.259 8.029 1.00 43.03 C ATOM 1534 OE1 GLU A 94 -3.453 8.432 8.331 1.00 74.11 O ATOM 1535 OE2 GLU A 94 -2.319 6.644 8.769 1.00 74.21 O ATOM 0 H GLU A 94 -4.903 7.658 3.519 1.00 1.10 H new ATOM 0 HA GLU A 94 -3.808 9.263 5.738 1.00 31.14 H new ATOM 0 HB2 GLU A 94 -2.789 6.585 4.709 1.00 52.21 H new ATOM 0 HB3 GLU A 94 -1.912 7.638 5.801 1.00 52.21 H new ATOM 0 HG2 GLU A 94 -4.661 6.714 6.610 1.00 53.03 H new ATOM 0 HG3 GLU A 94 -3.335 5.571 6.696 1.00 53.03 H new ATOM 1542 N LEU A 95 -3.155 10.484 3.526 1.00 40.14 N ATOM 1543 CA LEU A 95 -2.694 11.265 2.374 1.00 13.33 C ATOM 1544 C LEU A 95 -1.198 11.588 2.393 1.00 31.20 C ATOM 1545 O LEU A 95 -0.749 12.681 2.736 1.00 3.31 O ATOM 1546 CB LEU A 95 -3.533 12.549 2.230 1.00 40.25 C ATOM 1547 CG LEU A 95 -3.452 13.225 0.857 1.00 22.20 C ATOM 1548 CD1 LEU A 95 -4.040 12.354 -0.260 1.00 14.00 C ATOM 1549 CD2 LEU A 95 -4.266 14.518 0.895 1.00 1.44 C ATOM 0 H LEU A 95 -3.768 11.031 4.131 1.00 40.14 H new ATOM 0 HA LEU A 95 -2.841 10.630 1.500 1.00 13.33 H new ATOM 0 HB2 LEU A 95 -4.576 12.309 2.439 1.00 40.25 H new ATOM 0 HB3 LEU A 95 -3.211 13.262 2.989 1.00 40.25 H new ATOM 0 HG LEU A 95 -2.397 13.402 0.647 1.00 22.20 H new ATOM 0 HD11 LEU A 95 -3.958 12.879 -1.212 1.00 14.00 H new ATOM 0 HD12 LEU A 95 -3.491 11.414 -0.315 1.00 14.00 H new ATOM 0 HD13 LEU A 95 -5.089 12.149 -0.048 1.00 14.00 H new ATOM 0 HD21 LEU A 95 -4.216 15.008 -0.077 1.00 1.44 H new ATOM 0 HD22 LEU A 95 -5.305 14.287 1.132 1.00 1.44 H new ATOM 0 HD23 LEU A 95 -3.859 15.182 1.658 1.00 1.44 H new ATOM 1561 N LYS A 96 -0.403 10.637 1.934 1.00 15.22 N ATOM 1562 CA LYS A 96 1.036 10.630 2.087 1.00 35.10 C ATOM 1563 C LYS A 96 1.700 11.241 0.857 1.00 13.04 C ATOM 1564 O LYS A 96 1.764 10.604 -0.191 1.00 44.25 O ATOM 1565 CB LYS A 96 1.447 9.175 2.342 1.00 2.34 C ATOM 1566 CG LYS A 96 2.622 9.066 3.308 1.00 23.10 C ATOM 1567 CD LYS A 96 3.941 9.626 2.795 1.00 1.40 C ATOM 1568 CE LYS A 96 4.309 9.132 1.394 1.00 60.54 C ATOM 1569 NZ LYS A 96 4.393 7.663 1.277 1.00 22.40 N ATOM 0 H LYS A 96 -0.756 9.824 1.429 1.00 15.22 H new ATOM 0 HA LYS A 96 1.364 11.242 2.927 1.00 35.10 H new ATOM 0 HB2 LYS A 96 0.596 8.625 2.744 1.00 2.34 H new ATOM 0 HB3 LYS A 96 1.713 8.704 1.396 1.00 2.34 H new ATOM 0 HG2 LYS A 96 2.361 9.584 4.231 1.00 23.10 H new ATOM 0 HG3 LYS A 96 2.766 8.016 3.561 1.00 23.10 H new ATOM 0 HD2 LYS A 96 3.885 10.715 2.785 1.00 1.40 H new ATOM 0 HD3 LYS A 96 4.737 9.354 3.488 1.00 1.40 H new ATOM 0 HE2 LYS A 96 3.569 9.501 0.684 1.00 60.54 H new ATOM 0 HE3 LYS A 96 5.268 9.564 1.108 1.00 60.54 H new ATOM 0 HZ1 LYS A 96 4.646 7.406 0.301 1.00 22.40 H new ATOM 0 HZ2 LYS A 96 5.119 7.304 1.929 1.00 22.40 H new ATOM 0 HZ3 LYS A 96 3.473 7.242 1.518 1.00 22.40 H new ATOM 1583 N ASN A 97 2.261 12.441 0.975 1.00 64.12 N ATOM 1584 CA ASN A 97 3.075 13.056 -0.084 1.00 54.41 C ATOM 1585 C ASN A 97 4.493 12.444 -0.041 1.00 61.34 C ATOM 1586 O ASN A 97 5.073 12.322 1.038 1.00 2.04 O ATOM 1587 CB ASN A 97 3.084 14.585 0.116 1.00 3.30 C ATOM 1588 CG ASN A 97 3.951 15.304 -0.906 1.00 22.41 C ATOM 1589 OD1 ASN A 97 5.162 15.159 -0.831 1.00 43.21 O ATOM 1590 ND2 ASN A 97 3.414 16.059 -1.859 1.00 33.42 N ATOM 0 H ASN A 97 2.167 13.021 1.809 1.00 64.12 H new ATOM 0 HA ASN A 97 2.659 12.857 -1.071 1.00 54.41 H new ATOM 0 HB2 ASN A 97 2.063 14.962 0.051 1.00 3.30 H new ATOM 0 HB3 ASN A 97 3.445 14.814 1.119 1.00 3.30 H new ATOM 0 HD21 ASN A 97 4.014 16.526 -2.539 1.00 33.42 H new ATOM 0 HD22 ASN A 97 2.402 16.172 -1.910 1.00 33.42 H new ATOM 1597 N GLN A 98 5.052 11.987 -1.172 1.00 44.15 N ATOM 1598 CA GLN A 98 6.430 11.437 -1.286 1.00 43.02 C ATOM 1599 C GLN A 98 7.495 12.480 -1.660 1.00 15.13 C ATOM 1600 O GLN A 98 8.679 12.191 -1.508 1.00 11.41 O ATOM 1601 CB GLN A 98 6.514 10.235 -2.259 1.00 11.22 C ATOM 1602 CG GLN A 98 5.431 10.147 -3.348 1.00 31.30 C ATOM 1603 CD GLN A 98 4.276 9.263 -2.941 1.00 64.33 C ATOM 1604 OE1 GLN A 98 3.836 8.464 -3.748 1.00 31.44 O ATOM 1605 NE2 GLN A 98 3.811 9.318 -1.702 1.00 54.24 N ATOM 0 H GLN A 98 4.553 11.986 -2.061 1.00 44.15 H new ATOM 0 HA GLN A 98 6.657 11.092 -0.277 1.00 43.02 H new ATOM 0 HB2 GLN A 98 7.487 10.262 -2.749 1.00 11.22 H new ATOM 0 HB3 GLN A 98 6.479 9.318 -1.670 1.00 11.22 H new ATOM 0 HG2 GLN A 98 5.059 11.148 -3.568 1.00 31.30 H new ATOM 0 HG3 GLN A 98 5.874 9.762 -4.267 1.00 31.30 H new ATOM 0 HE21 GLN A 98 4.195 9.995 -1.043 1.00 54.24 H new ATOM 0 HE22 GLN A 98 3.069 8.683 -1.407 1.00 54.24 H new ATOM 1614 N VAL A 99 7.119 13.675 -2.110 1.00 71.34 N ATOM 1615 CA VAL A 99 8.055 14.754 -2.413 1.00 71.11 C ATOM 1616 C VAL A 99 8.743 15.178 -1.103 1.00 35.22 C ATOM 1617 O VAL A 99 9.970 15.145 -1.003 1.00 32.14 O ATOM 1618 CB VAL A 99 7.297 15.901 -3.127 1.00 73.15 C ATOM 1619 CG1 VAL A 99 8.215 17.060 -3.503 1.00 74.33 C ATOM 1620 CG2 VAL A 99 6.607 15.415 -4.418 1.00 4.42 C ATOM 0 H VAL A 99 6.144 13.924 -2.276 1.00 71.34 H new ATOM 0 HA VAL A 99 8.840 14.436 -3.099 1.00 71.11 H new ATOM 0 HB VAL A 99 6.553 16.243 -2.407 1.00 73.15 H new ATOM 0 HG11 VAL A 99 7.635 17.837 -4.000 1.00 74.33 H new ATOM 0 HG12 VAL A 99 8.672 17.469 -2.602 1.00 74.33 H new ATOM 0 HG13 VAL A 99 8.995 16.703 -4.176 1.00 74.33 H new ATOM 0 HG21 VAL A 99 6.087 16.249 -4.889 1.00 4.42 H new ATOM 0 HG22 VAL A 99 7.356 15.021 -5.105 1.00 4.42 H new ATOM 0 HG23 VAL A 99 5.890 14.631 -4.174 1.00 4.42 H new ATOM 1630 N TYR A 100 7.962 15.487 -0.061 1.00 51.44 N ATOM 1631 CA TYR A 100 8.449 15.923 1.250 1.00 32.14 C ATOM 1632 C TYR A 100 9.058 14.788 2.089 1.00 35.33 C ATOM 1633 O TYR A 100 9.185 14.910 3.314 1.00 24.01 O ATOM 1634 CB TYR A 100 7.316 16.613 2.029 1.00 60.21 C ATOM 1635 CG TYR A 100 6.676 17.780 1.312 1.00 61.55 C ATOM 1636 CD1 TYR A 100 7.474 18.808 0.780 1.00 60.55 C ATOM 1637 CD2 TYR A 100 5.287 17.794 1.113 1.00 13.44 C ATOM 1638 CE1 TYR A 100 6.893 19.826 0.010 1.00 74.54 C ATOM 1639 CE2 TYR A 100 4.698 18.810 0.349 1.00 73.42 C ATOM 1640 CZ TYR A 100 5.499 19.844 -0.195 1.00 0.34 C ATOM 1641 OH TYR A 100 4.957 20.761 -1.034 1.00 35.34 O ATOM 0 H TYR A 100 6.944 15.439 -0.110 1.00 51.44 H new ATOM 0 HA TYR A 100 9.258 16.629 1.061 1.00 32.14 H new ATOM 0 HB2 TYR A 100 6.546 15.875 2.253 1.00 60.21 H new ATOM 0 HB3 TYR A 100 7.710 16.962 2.983 1.00 60.21 H new ATOM 0 HD1 TYR A 100 8.538 18.814 0.965 1.00 60.55 H new ATOM 0 HD2 TYR A 100 4.672 17.021 1.549 1.00 13.44 H new ATOM 0 HE1 TYR A 100 7.513 20.595 -0.425 1.00 74.54 H new ATOM 0 HE2 TYR A 100 3.632 18.805 0.175 1.00 73.42 H new ATOM 0 HH TYR A 100 3.991 20.610 -1.104 1.00 35.34 H new ATOM 1651 N MET A 101 9.384 13.638 1.494 1.00 71.34 N ATOM 1652 CA MET A 101 9.820 12.455 2.222 1.00 12.23 C ATOM 1653 C MET A 101 11.301 12.584 2.609 1.00 20.12 C ATOM 1654 O MET A 101 12.184 11.904 2.083 1.00 3.34 O ATOM 1655 CB MET A 101 9.502 11.215 1.375 1.00 2.44 C ATOM 1656 CG MET A 101 9.765 9.900 2.104 1.00 60.35 C ATOM 1657 SD MET A 101 8.840 9.621 3.626 1.00 34.21 S ATOM 1658 CE MET A 101 7.270 9.158 2.853 1.00 23.24 C ATOM 0 H MET A 101 9.351 13.506 0.483 1.00 71.34 H new ATOM 0 HA MET A 101 9.281 12.351 3.164 1.00 12.23 H new ATOM 0 HB2 MET A 101 8.456 11.250 1.071 1.00 2.44 H new ATOM 0 HB3 MET A 101 10.100 11.243 0.464 1.00 2.44 H new ATOM 0 HG2 MET A 101 9.547 9.081 1.418 1.00 60.35 H new ATOM 0 HG3 MET A 101 10.828 9.847 2.337 1.00 60.35 H new ATOM 0 HE1 MET A 101 6.729 8.476 3.509 1.00 23.24 H new ATOM 0 HE2 MET A 101 6.670 10.052 2.684 1.00 23.24 H new ATOM 0 HE3 MET A 101 7.465 8.667 1.900 1.00 23.24 H new ATOM 1668 N HIS A 102 11.579 13.482 3.547 1.00 71.43 N ATOM 1669 CA HIS A 102 12.897 13.848 4.046 1.00 44.44 C ATOM 1670 C HIS A 102 12.774 14.160 5.546 1.00 1.30 C ATOM 1671 O HIS A 102 13.211 15.208 6.017 1.00 24.34 O ATOM 1672 CB HIS A 102 13.430 15.017 3.195 1.00 32.32 C ATOM 1673 CG HIS A 102 12.497 16.197 3.074 1.00 11.50 C ATOM 1674 ND1 HIS A 102 12.191 17.080 4.082 1.00 74.03 N ATOM 1675 CD2 HIS A 102 11.827 16.600 1.951 1.00 54.12 C ATOM 1676 CE1 HIS A 102 11.360 18.005 3.570 1.00 63.31 C ATOM 1677 NE2 HIS A 102 11.111 17.756 2.273 1.00 34.12 N ATOM 0 H HIS A 102 10.838 14.009 4.010 1.00 71.43 H new ATOM 0 HA HIS A 102 13.624 13.041 3.954 1.00 44.44 H new ATOM 0 HB2 HIS A 102 14.371 15.360 3.625 1.00 32.32 H new ATOM 0 HB3 HIS A 102 13.653 14.646 2.195 1.00 32.32 H new ATOM 0 HD1 HIS A 102 12.532 17.041 5.043 1.00 74.03 H new ATOM 0 HD2 HIS A 102 11.848 16.112 0.988 1.00 54.12 H new ATOM 0 HE1 HIS A 102 10.949 18.835 4.125 1.00 63.31 H new ATOM 1685 N GLN A 103 12.053 13.295 6.270 1.00 63.34 N ATOM 1686 CA GLN A 103 11.695 13.476 7.674 1.00 33.03 C ATOM 1687 C GLN A 103 11.270 12.126 8.279 1.00 63.11 C ATOM 1688 O GLN A 103 11.926 11.607 9.180 1.00 63.44 O ATOM 1689 CB GLN A 103 10.633 14.594 7.820 1.00 64.41 C ATOM 1690 CG GLN A 103 9.371 14.418 6.981 1.00 73.34 C ATOM 1691 CD GLN A 103 8.583 15.709 6.782 1.00 32.12 C ATOM 1692 OE1 GLN A 103 7.720 16.058 7.579 1.00 42.42 O ATOM 1693 NE2 GLN A 103 8.791 16.388 5.663 1.00 51.45 N ATOM 0 H GLN A 103 11.694 12.424 5.879 1.00 63.34 H new ATOM 0 HA GLN A 103 12.559 13.813 8.246 1.00 33.03 H new ATOM 0 HB2 GLN A 103 10.344 14.661 8.869 1.00 64.41 H new ATOM 0 HB3 GLN A 103 11.094 15.545 7.555 1.00 64.41 H new ATOM 0 HG2 GLN A 103 9.647 14.017 6.006 1.00 73.34 H new ATOM 0 HG3 GLN A 103 8.727 13.680 7.459 1.00 73.34 H new ATOM 0 HE21 GLN A 103 9.513 16.085 5.009 1.00 51.45 H new ATOM 0 HE22 GLN A 103 8.229 17.214 5.455 1.00 51.45 H new ATOM 1702 N HIS A 104 10.220 11.499 7.736 1.00 32.40 N ATOM 1703 CA HIS A 104 9.630 10.258 8.252 1.00 1.34 C ATOM 1704 C HIS A 104 10.517 9.016 8.054 1.00 20.24 C ATOM 1705 O HIS A 104 10.083 7.892 8.326 1.00 3.23 O ATOM 1706 CB HIS A 104 8.274 10.007 7.586 1.00 35.13 C ATOM 1707 CG HIS A 104 7.384 11.215 7.492 1.00 52.44 C ATOM 1708 ND1 HIS A 104 6.901 11.973 8.534 1.00 44.51 N ATOM 1709 CD2 HIS A 104 6.969 11.789 6.326 1.00 13.42 C ATOM 1710 CE1 HIS A 104 6.182 12.978 8.002 1.00 2.40 C ATOM 1711 NE2 HIS A 104 6.231 12.928 6.655 1.00 13.22 N ATOM 0 H HIS A 104 9.745 11.850 6.904 1.00 32.40 H new ATOM 0 HA HIS A 104 9.521 10.405 9.326 1.00 1.34 H new ATOM 0 HB2 HIS A 104 8.445 9.620 6.581 1.00 35.13 H new ATOM 0 HB3 HIS A 104 7.750 9.230 8.142 1.00 35.13 H new ATOM 0 HD2 HIS A 104 7.174 11.428 5.329 1.00 13.42 H new ATOM 0 HE1 HIS A 104 5.642 13.719 8.572 1.00 2.40 H new ATOM 0 HE2 HIS A 104 5.811 13.592 6.004 1.00 13.22 H new ATOM 1719 N SER A 105 11.716 9.179 7.501 1.00 64.41 N ATOM 1720 CA SER A 105 12.660 8.115 7.217 1.00 20.14 C ATOM 1721 C SER A 105 14.060 8.757 7.199 1.00 75.45 C ATOM 1722 O SER A 105 14.164 9.963 6.941 1.00 51.51 O ATOM 1723 CB SER A 105 12.254 7.474 5.875 1.00 41.51 C ATOM 1724 OG SER A 105 13.294 6.833 5.185 1.00 42.55 O ATOM 0 H SER A 105 12.066 10.098 7.229 1.00 64.41 H new ATOM 0 HA SER A 105 12.666 7.319 7.961 1.00 20.14 H new ATOM 0 HB2 SER A 105 11.461 6.750 6.061 1.00 41.51 H new ATOM 0 HB3 SER A 105 11.835 8.248 5.232 1.00 41.51 H new ATOM 0 HG SER A 105 12.948 6.455 4.349 1.00 42.55 H new ATOM 1730 N PRO A 106 15.123 7.977 7.470 1.00 73.45 N ATOM 1731 CA PRO A 106 16.520 8.392 7.389 1.00 61.15 C ATOM 1732 C PRO A 106 16.979 8.493 5.938 1.00 4.40 C ATOM 1733 O PRO A 106 16.145 8.585 5.041 1.00 41.11 O ATOM 1734 CB PRO A 106 17.279 7.353 8.231 1.00 22.12 C ATOM 1735 CG PRO A 106 16.500 6.073 7.952 1.00 13.21 C ATOM 1736 CD PRO A 106 15.060 6.574 7.860 1.00 14.34 C ATOM 0 HA PRO A 106 16.702 9.393 7.779 1.00 61.15 H new ATOM 0 HB2 PRO A 106 18.322 7.268 7.927 1.00 22.12 H new ATOM 0 HB3 PRO A 106 17.275 7.608 9.291 1.00 22.12 H new ATOM 0 HG2 PRO A 106 16.823 5.595 7.027 1.00 13.21 H new ATOM 0 HG3 PRO A 106 16.624 5.341 8.750 1.00 13.21 H new ATOM 0 HD2 PRO A 106 14.496 5.995 7.129 1.00 14.34 H new ATOM 0 HD3 PRO A 106 14.550 6.462 8.817 1.00 14.34 H new ATOM 1744 N HIS A 107 18.296 8.550 5.714 1.00 3.34 N ATOM 1745 CA HIS A 107 19.006 8.693 4.449 1.00 51.22 C ATOM 1746 C HIS A 107 18.426 7.760 3.378 1.00 34.01 C ATOM 1747 O HIS A 107 18.883 6.631 3.191 1.00 71.02 O ATOM 1748 CB HIS A 107 20.533 8.518 4.625 1.00 14.43 C ATOM 1749 CG HIS A 107 21.105 9.037 5.922 1.00 31.32 C ATOM 1750 ND1 HIS A 107 21.198 8.351 7.107 1.00 21.13 N flip ATOM 1751 CD2 HIS A 107 21.682 10.272 6.106 1.00 31.22 C flip ATOM 1752 CE1 HIS A 107 21.815 9.200 8.027 1.00 52.55 C flip ATOM 1753 NE2 HIS A 107 22.135 10.326 7.369 1.00 4.41 N flip ATOM 0 H HIS A 107 18.951 8.491 6.494 1.00 3.34 H new ATOM 0 HA HIS A 107 18.854 9.713 4.096 1.00 51.22 H new ATOM 0 HB2 HIS A 107 20.771 7.457 4.543 1.00 14.43 H new ATOM 0 HB3 HIS A 107 21.036 9.022 3.800 1.00 14.43 H new ATOM 0 HD2 HIS A 107 21.757 11.057 5.368 1.00 31.22 H new ATOM 0 HE1 HIS A 107 22.000 8.991 9.070 1.00 52.55 H new ATOM 0 HE2 HIS A 107 22.649 11.110 7.771 1.00 4.41 H new ATOM 1761 N THR A 108 17.374 8.225 2.715 1.00 4.42 N ATOM 1762 CA THR A 108 16.575 7.445 1.764 1.00 24.32 C ATOM 1763 C THR A 108 16.181 8.238 0.505 1.00 24.42 C ATOM 1764 O THR A 108 15.345 7.799 -0.284 1.00 54.42 O ATOM 1765 CB THR A 108 15.379 6.816 2.525 1.00 1.33 C ATOM 1766 OG1 THR A 108 15.794 6.229 3.742 1.00 74.03 O ATOM 1767 CG2 THR A 108 14.593 5.698 1.832 1.00 40.42 C ATOM 0 H THR A 108 17.040 9.182 2.824 1.00 4.42 H new ATOM 0 HA THR A 108 17.183 6.636 1.359 1.00 24.32 H new ATOM 0 HB THR A 108 14.730 7.686 2.621 1.00 1.33 H new ATOM 0 HG1 THR A 108 15.833 6.916 4.440 1.00 74.03 H new ATOM 0 HG21 THR A 108 13.789 5.359 2.486 1.00 40.42 H new ATOM 0 HG22 THR A 108 14.169 6.074 0.901 1.00 40.42 H new ATOM 0 HG23 THR A 108 15.261 4.864 1.616 1.00 40.42 H new ATOM 1775 N ALA A 109 16.826 9.369 0.253 1.00 40.53 N ATOM 1776 CA ALA A 109 16.598 10.167 -0.950 1.00 14.44 C ATOM 1777 C ALA A 109 17.107 9.419 -2.168 1.00 3.10 C ATOM 1778 O ALA A 109 18.273 9.023 -2.206 1.00 51.42 O ATOM 1779 CB ALA A 109 17.293 11.513 -0.871 1.00 55.25 C ATOM 0 H ALA A 109 17.527 9.763 0.880 1.00 40.53 H new ATOM 0 HA ALA A 109 15.525 10.338 -1.032 1.00 14.44 H new ATOM 0 HB1 ALA A 109 17.100 12.076 -1.784 1.00 55.25 H new ATOM 0 HB2 ALA A 109 16.913 12.069 -0.014 1.00 55.25 H new ATOM 0 HB3 ALA A 109 18.367 11.362 -0.758 1.00 55.25 H new ATOM 1785 N SER A 110 16.217 9.196 -3.127 1.00 61.25 N ATOM 1786 CA SER A 110 16.435 8.380 -4.317 1.00 11.33 C ATOM 1787 C SER A 110 15.185 8.369 -5.205 1.00 33.12 C ATOM 1788 O SER A 110 15.275 8.096 -6.401 1.00 40.33 O ATOM 1789 CB SER A 110 16.756 6.959 -3.849 1.00 24.44 C ATOM 1790 OG SER A 110 17.067 6.061 -4.893 1.00 51.13 O ATOM 0 H SER A 110 15.280 9.597 -3.096 1.00 61.25 H new ATOM 0 HA SER A 110 17.255 8.789 -4.906 1.00 11.33 H new ATOM 0 HB2 SER A 110 17.597 6.998 -3.156 1.00 24.44 H new ATOM 0 HB3 SER A 110 15.903 6.570 -3.293 1.00 24.44 H new ATOM 0 HG SER A 110 17.415 5.227 -4.514 1.00 51.13 H new ATOM 1796 N TYR A 111 14.018 8.649 -4.616 1.00 24.32 N ATOM 1797 CA TYR A 111 12.719 8.721 -5.277 1.00 73.32 C ATOM 1798 C TYR A 111 12.128 10.113 -5.178 1.00 23.04 C ATOM 1799 O TYR A 111 12.638 10.998 -4.484 1.00 43.45 O ATOM 1800 CB TYR A 111 11.694 7.731 -4.738 1.00 0.11 C ATOM 1801 CG TYR A 111 11.622 7.732 -3.249 1.00 54.54 C ATOM 1802 CD1 TYR A 111 12.585 6.972 -2.602 1.00 61.21 C ATOM 1803 CD2 TYR A 111 10.690 8.504 -2.534 1.00 2.12 C ATOM 1804 CE1 TYR A 111 12.596 6.911 -1.206 1.00 0.44 C ATOM 1805 CE2 TYR A 111 10.696 8.448 -1.132 1.00 40.25 C ATOM 1806 CZ TYR A 111 11.648 7.645 -0.460 1.00 73.24 C ATOM 1807 OH TYR A 111 11.673 7.588 0.898 1.00 13.24 O ATOM 0 H TYR A 111 13.955 8.840 -3.616 1.00 24.32 H new ATOM 0 HA TYR A 111 12.924 8.460 -6.315 1.00 73.32 H new ATOM 0 HB2 TYR A 111 10.712 7.973 -5.145 1.00 0.11 H new ATOM 0 HB3 TYR A 111 11.945 6.729 -5.085 1.00 0.11 H new ATOM 0 HD1 TYR A 111 13.323 6.430 -3.175 1.00 61.21 H new ATOM 0 HD2 TYR A 111 9.981 9.130 -3.055 1.00 2.12 H new ATOM 0 HE1 TYR A 111 13.329 6.303 -0.698 1.00 0.44 H new ATOM 0 HE2 TYR A 111 9.974 9.018 -0.566 1.00 40.25 H new ATOM 0 HH TYR A 111 12.016 6.715 1.183 1.00 13.24 H new ATOM 1817 N THR A 112 10.971 10.238 -5.814 1.00 0.04 N ATOM 1818 CA THR A 112 10.102 11.387 -5.746 1.00 20.31 C ATOM 1819 C THR A 112 8.695 10.928 -6.172 1.00 22.54 C ATOM 1820 O THR A 112 7.716 11.223 -5.488 1.00 61.42 O ATOM 1821 CB THR A 112 10.758 12.492 -6.599 1.00 73.45 C ATOM 1822 OG1 THR A 112 10.017 13.684 -6.550 1.00 32.41 O ATOM 1823 CG2 THR A 112 11.012 12.065 -8.048 1.00 2.12 C ATOM 0 H THR A 112 10.603 9.502 -6.417 1.00 0.04 H new ATOM 0 HA THR A 112 9.973 11.816 -4.752 1.00 20.31 H new ATOM 0 HB THR A 112 11.736 12.674 -6.154 1.00 73.45 H new ATOM 0 HG1 THR A 112 10.458 14.366 -7.099 1.00 32.41 H new ATOM 0 HG21 THR A 112 11.475 12.887 -8.594 1.00 2.12 H new ATOM 0 HG22 THR A 112 11.676 11.201 -8.062 1.00 2.12 H new ATOM 0 HG23 THR A 112 10.066 11.802 -8.521 1.00 2.12 H new ATOM 1831 N SER A 113 8.588 10.127 -7.240 1.00 60.53 N ATOM 1832 CA SER A 113 7.323 9.675 -7.806 1.00 2.24 C ATOM 1833 C SER A 113 6.778 8.463 -7.052 1.00 64.11 C ATOM 1834 O SER A 113 7.540 7.726 -6.419 1.00 41.04 O ATOM 1835 CB SER A 113 7.550 9.280 -9.268 1.00 22.33 C ATOM 1836 OG SER A 113 8.365 10.226 -9.929 1.00 52.34 O ATOM 0 H SER A 113 9.401 9.770 -7.742 1.00 60.53 H new ATOM 0 HA SER A 113 6.600 10.487 -7.726 1.00 2.24 H new ATOM 0 HB2 SER A 113 8.018 8.297 -9.314 1.00 22.33 H new ATOM 0 HB3 SER A 113 6.591 9.201 -9.780 1.00 22.33 H new ATOM 0 HG SER A 113 8.497 9.951 -10.860 1.00 52.34 H new ATOM 1842 N SER A 114 5.482 8.205 -7.216 1.00 34.41 N ATOM 1843 CA SER A 114 4.732 7.153 -6.555 1.00 31.32 C ATOM 1844 C SER A 114 5.353 5.772 -6.763 1.00 60.43 C ATOM 1845 O SER A 114 5.622 5.068 -5.791 1.00 2.41 O ATOM 1846 CB SER A 114 3.265 7.241 -7.012 1.00 32.41 C ATOM 1847 OG SER A 114 2.865 8.588 -7.218 1.00 51.42 O ATOM 0 H SER A 114 4.902 8.756 -7.848 1.00 34.41 H new ATOM 0 HA SER A 114 4.769 7.301 -5.476 1.00 31.32 H new ATOM 0 HB2 SER A 114 3.136 6.677 -7.935 1.00 32.41 H new ATOM 0 HB3 SER A 114 2.621 6.779 -6.263 1.00 32.41 H new ATOM 0 HG SER A 114 2.125 8.806 -6.613 1.00 51.42 H new ATOM 1853 N ARG A 115 5.600 5.362 -8.015 1.00 24.14 N ATOM 1854 CA ARG A 115 6.225 4.071 -8.285 1.00 64.25 C ATOM 1855 C ARG A 115 7.673 4.020 -7.805 1.00 65.12 C ATOM 1856 O ARG A 115 8.057 2.987 -7.262 1.00 34.32 O ATOM 1857 CB ARG A 115 6.095 3.699 -9.773 1.00 22.54 C ATOM 1858 CG ARG A 115 4.857 2.841 -10.081 1.00 1.10 C ATOM 1859 CD ARG A 115 3.791 3.498 -10.958 1.00 65.55 C ATOM 1860 NE ARG A 115 4.185 3.589 -12.375 1.00 71.54 N ATOM 1861 CZ ARG A 115 4.238 4.669 -13.163 1.00 14.33 C ATOM 1862 NH1 ARG A 115 3.934 5.881 -12.708 1.00 50.33 N ATOM 1863 NH2 ARG A 115 4.595 4.524 -14.431 1.00 31.30 N ATOM 0 H ARG A 115 5.376 5.906 -8.848 1.00 24.14 H new ATOM 0 HA ARG A 115 5.687 3.319 -7.708 1.00 64.25 H new ATOM 0 HB2 ARG A 115 6.052 4.613 -10.366 1.00 22.54 H new ATOM 0 HB3 ARG A 115 6.989 3.159 -10.085 1.00 22.54 H new ATOM 0 HG2 ARG A 115 5.187 1.924 -10.569 1.00 1.10 H new ATOM 0 HG3 ARG A 115 4.395 2.552 -9.137 1.00 1.10 H new ATOM 0 HD2 ARG A 115 2.864 2.930 -10.880 1.00 65.55 H new ATOM 0 HD3 ARG A 115 3.584 4.499 -10.580 1.00 65.55 H new ATOM 0 HE ARG A 115 4.454 2.709 -12.815 1.00 71.54 H new ATOM 0 HH11 ARG A 115 3.652 6.005 -11.736 1.00 50.33 H new ATOM 0 HH12 ARG A 115 3.983 6.687 -13.331 1.00 50.33 H new ATOM 0 HH21 ARG A 115 4.825 3.599 -14.794 1.00 31.30 H new ATOM 0 HH22 ARG A 115 4.640 5.338 -15.044 1.00 31.30 H new ATOM 1877 N ASP A 116 8.474 5.081 -7.953 1.00 21.22 N ATOM 1878 CA ASP A 116 9.878 5.054 -7.506 1.00 42.23 C ATOM 1879 C ASP A 116 9.932 4.787 -6.002 1.00 1.10 C ATOM 1880 O ASP A 116 10.565 3.830 -5.546 1.00 13.23 O ATOM 1881 CB ASP A 116 10.644 6.324 -7.900 1.00 35.14 C ATOM 1882 CG ASP A 116 12.171 6.125 -7.835 1.00 20.04 C ATOM 1883 OD1 ASP A 116 12.678 5.313 -7.027 1.00 52.54 O ATOM 1884 OD2 ASP A 116 12.877 6.791 -8.623 1.00 74.32 O ATOM 0 H ASP A 116 8.181 5.963 -8.374 1.00 21.22 H new ATOM 0 HA ASP A 116 10.386 4.239 -8.021 1.00 42.23 H new ATOM 0 HB2 ASP A 116 10.360 6.619 -8.910 1.00 35.14 H new ATOM 0 HB3 ASP A 116 10.357 7.140 -7.237 1.00 35.14 H new ATOM 1889 N ALA A 117 9.165 5.581 -5.246 1.00 2.13 N ATOM 1890 CA ALA A 117 9.026 5.462 -3.800 1.00 12.20 C ATOM 1891 C ALA A 117 8.554 4.072 -3.361 1.00 41.34 C ATOM 1892 O ALA A 117 8.951 3.608 -2.296 1.00 22.40 O ATOM 1893 CB ALA A 117 8.059 6.545 -3.308 1.00 75.24 C ATOM 0 H ALA A 117 8.611 6.342 -5.639 1.00 2.13 H new ATOM 0 HA ALA A 117 10.010 5.601 -3.351 1.00 12.20 H new ATOM 0 HB1 ALA A 117 7.946 6.468 -2.227 1.00 75.24 H new ATOM 0 HB2 ALA A 117 8.454 7.528 -3.562 1.00 75.24 H new ATOM 0 HB3 ALA A 117 7.088 6.410 -3.785 1.00 75.24 H new ATOM 1899 N MET A 118 7.754 3.385 -4.178 1.00 73.42 N ATOM 1900 CA MET A 118 7.178 2.088 -3.856 1.00 70.22 C ATOM 1901 C MET A 118 8.254 1.025 -3.633 1.00 41.12 C ATOM 1902 O MET A 118 8.110 0.171 -2.762 1.00 30.23 O ATOM 1903 CB MET A 118 6.233 1.701 -4.997 1.00 30.34 C ATOM 1904 CG MET A 118 5.131 0.749 -4.542 1.00 50.12 C ATOM 1905 SD MET A 118 3.764 0.583 -5.716 1.00 10.21 S ATOM 1906 CE MET A 118 3.270 2.313 -5.907 1.00 43.34 C ATOM 0 H MET A 118 7.486 3.726 -5.101 1.00 73.42 H new ATOM 0 HA MET A 118 6.627 2.153 -2.918 1.00 70.22 H new ATOM 0 HB2 MET A 118 5.782 2.602 -5.413 1.00 30.34 H new ATOM 0 HB3 MET A 118 6.806 1.233 -5.797 1.00 30.34 H new ATOM 0 HG2 MET A 118 5.566 -0.235 -4.366 1.00 50.12 H new ATOM 0 HG3 MET A 118 4.736 1.098 -3.588 1.00 50.12 H new ATOM 0 HE1 MET A 118 2.183 2.379 -5.947 1.00 43.34 H new ATOM 0 HE2 MET A 118 3.638 2.892 -5.060 1.00 43.34 H new ATOM 0 HE3 MET A 118 3.692 2.712 -6.830 1.00 43.34 H new ATOM 1916 N SER A 119 9.357 1.100 -4.378 1.00 73.31 N ATOM 1917 CA SER A 119 10.502 0.204 -4.222 1.00 51.34 C ATOM 1918 C SER A 119 11.452 0.639 -3.095 1.00 24.23 C ATOM 1919 O SER A 119 12.475 -0.009 -2.856 1.00 42.55 O ATOM 1920 CB SER A 119 11.233 0.121 -5.560 1.00 22.41 C ATOM 1921 OG SER A 119 10.360 -0.392 -6.551 1.00 2.43 O ATOM 0 H SER A 119 9.482 1.793 -5.116 1.00 73.31 H new ATOM 0 HA SER A 119 10.135 -0.780 -3.930 1.00 51.34 H new ATOM 0 HB2 SER A 119 11.590 1.109 -5.852 1.00 22.41 H new ATOM 0 HB3 SER A 119 12.110 -0.520 -5.467 1.00 22.41 H new ATOM 0 HG SER A 119 10.832 -0.442 -7.408 1.00 2.43 H new ATOM 1927 N LYS A 120 11.143 1.729 -2.388 1.00 33.11 N ATOM 1928 CA LYS A 120 11.839 2.177 -1.185 1.00 41.55 C ATOM 1929 C LYS A 120 10.907 2.062 0.035 1.00 34.00 C ATOM 1930 O LYS A 120 11.156 2.676 1.077 1.00 3.40 O ATOM 1931 CB LYS A 120 12.397 3.594 -1.394 1.00 71.01 C ATOM 1932 CG LYS A 120 13.699 3.636 -2.216 1.00 74.32 C ATOM 1933 CD LYS A 120 13.542 3.574 -3.742 1.00 41.24 C ATOM 1934 CE LYS A 120 14.894 3.961 -4.355 1.00 52.25 C ATOM 1935 NZ LYS A 120 14.852 4.114 -5.823 1.00 45.53 N ATOM 0 H LYS A 120 10.373 2.344 -2.649 1.00 33.11 H new ATOM 0 HA LYS A 120 12.696 1.533 -0.986 1.00 41.55 H new ATOM 0 HB2 LYS A 120 11.643 4.201 -1.895 1.00 71.01 H new ATOM 0 HB3 LYS A 120 12.578 4.050 -0.421 1.00 71.01 H new ATOM 0 HG2 LYS A 120 14.233 4.552 -1.964 1.00 74.32 H new ATOM 0 HG3 LYS A 120 14.329 2.803 -1.903 1.00 74.32 H new ATOM 0 HD2 LYS A 120 13.249 2.573 -4.058 1.00 41.24 H new ATOM 0 HD3 LYS A 120 12.759 4.255 -4.076 1.00 41.24 H new ATOM 0 HE2 LYS A 120 15.232 4.897 -3.909 1.00 52.25 H new ATOM 0 HE3 LYS A 120 15.632 3.201 -4.098 1.00 52.25 H new ATOM 0 HZ1 LYS A 120 15.482 4.890 -6.109 1.00 45.53 H new ATOM 0 HZ2 LYS A 120 15.164 3.230 -6.273 1.00 45.53 H new ATOM 0 HZ3 LYS A 120 13.880 4.330 -6.122 1.00 45.53 H new ATOM 1949 N TYR A 121 9.831 1.274 -0.055 1.00 51.41 N ATOM 1950 CA TYR A 121 9.092 0.824 1.116 1.00 65.34 C ATOM 1951 C TYR A 121 9.991 -0.073 1.993 1.00 64.43 C ATOM 1952 O TYR A 121 11.042 -0.544 1.541 1.00 33.22 O ATOM 1953 CB TYR A 121 7.807 0.096 0.670 1.00 62.34 C ATOM 1954 CG TYR A 121 6.581 0.978 0.499 1.00 3.30 C ATOM 1955 CD1 TYR A 121 6.180 1.827 1.548 1.00 23.10 C ATOM 1956 CD2 TYR A 121 5.757 0.852 -0.638 1.00 12.24 C ATOM 1957 CE1 TYR A 121 4.999 2.576 1.444 1.00 32.14 C ATOM 1958 CE2 TYR A 121 4.581 1.613 -0.754 1.00 12.00 C ATOM 1959 CZ TYR A 121 4.201 2.494 0.282 1.00 62.55 C ATOM 1960 OH TYR A 121 3.064 3.232 0.188 1.00 63.23 O ATOM 0 H TYR A 121 9.454 0.935 -0.940 1.00 51.41 H new ATOM 0 HA TYR A 121 8.796 1.681 1.721 1.00 65.34 H new ATOM 0 HB2 TYR A 121 8.005 -0.408 -0.276 1.00 62.34 H new ATOM 0 HB3 TYR A 121 7.577 -0.679 1.401 1.00 62.34 H new ATOM 0 HD1 TYR A 121 6.786 1.902 2.439 1.00 23.10 H new ATOM 0 HD2 TYR A 121 6.031 0.166 -1.426 1.00 12.24 H new ATOM 0 HE1 TYR A 121 4.698 3.219 2.258 1.00 32.14 H new ATOM 0 HE2 TYR A 121 3.967 1.524 -1.638 1.00 12.00 H new ATOM 0 HH TYR A 121 2.292 2.634 0.106 1.00 63.23 H new ATOM 1970 N PRO A 122 9.604 -0.331 3.256 1.00 74.41 N ATOM 1971 CA PRO A 122 10.386 -1.136 4.189 1.00 74.22 C ATOM 1972 C PRO A 122 10.328 -2.640 3.907 1.00 1.10 C ATOM 1973 O PRO A 122 11.196 -3.346 4.419 1.00 72.11 O ATOM 1974 CB PRO A 122 9.855 -0.789 5.580 1.00 31.12 C ATOM 1975 CG PRO A 122 8.405 -0.429 5.304 1.00 42.15 C ATOM 1976 CD PRO A 122 8.459 0.247 3.938 1.00 22.02 C ATOM 0 HA PRO A 122 11.446 -0.902 4.090 1.00 74.22 H new ATOM 0 HB2 PRO A 122 9.939 -1.631 6.267 1.00 31.12 H new ATOM 0 HB3 PRO A 122 10.401 0.042 6.026 1.00 31.12 H new ATOM 0 HG2 PRO A 122 7.768 -1.313 5.289 1.00 42.15 H new ATOM 0 HG3 PRO A 122 8.005 0.239 6.067 1.00 42.15 H new ATOM 0 HD2 PRO A 122 7.541 0.071 3.378 1.00 22.02 H new ATOM 0 HD3 PRO A 122 8.568 1.327 4.040 1.00 22.02 H new ATOM 1984 N GLU A 123 9.403 -3.146 3.081 1.00 21.12 N ATOM 1985 CA GLU A 123 9.309 -4.584 2.799 1.00 25.24 C ATOM 1986 C GLU A 123 9.060 -4.843 1.316 1.00 33.33 C ATOM 1987 O GLU A 123 8.473 -4.009 0.624 1.00 71.44 O ATOM 1988 CB GLU A 123 8.142 -5.228 3.564 1.00 23.34 C ATOM 1989 CG GLU A 123 8.203 -5.151 5.096 1.00 65.32 C ATOM 1990 CD GLU A 123 6.825 -5.063 5.764 1.00 14.41 C ATOM 1991 OE1 GLU A 123 5.817 -5.443 5.116 1.00 22.32 O ATOM 1992 OE2 GLU A 123 6.790 -4.539 6.908 1.00 31.14 O ATOM 0 H GLU A 123 8.708 -2.579 2.595 1.00 21.12 H new ATOM 0 HA GLU A 123 10.260 -5.016 3.111 1.00 25.24 H new ATOM 0 HB2 GLU A 123 7.216 -4.756 3.235 1.00 23.34 H new ATOM 0 HB3 GLU A 123 8.084 -6.278 3.277 1.00 23.34 H new ATOM 0 HG2 GLU A 123 8.725 -6.030 5.475 1.00 65.32 H new ATOM 0 HG3 GLU A 123 8.793 -4.281 5.384 1.00 65.32 H new ATOM 1999 N ARG A 124 9.388 -6.066 0.889 1.00 22.03 N ATOM 2000 CA ARG A 124 9.031 -6.658 -0.395 1.00 13.22 C ATOM 2001 C ARG A 124 7.519 -6.693 -0.569 1.00 10.13 C ATOM 2002 O ARG A 124 7.008 -5.968 -1.411 1.00 33.34 O ATOM 2003 CB ARG A 124 9.692 -8.044 -0.551 1.00 23.34 C ATOM 2004 CG ARG A 124 11.235 -7.955 -0.547 1.00 43.14 C ATOM 2005 CD ARG A 124 11.944 -9.050 -1.361 1.00 12.22 C ATOM 2006 NE ARG A 124 12.206 -8.613 -2.743 1.00 62.34 N ATOM 2007 CZ ARG A 124 12.822 -9.321 -3.700 1.00 14.42 C ATOM 2008 NH1 ARG A 124 13.041 -10.625 -3.554 1.00 14.41 N ATOM 2009 NH2 ARG A 124 13.209 -8.721 -4.821 1.00 23.45 N ATOM 0 H ARG A 124 9.940 -6.701 1.465 1.00 22.03 H new ATOM 0 HA ARG A 124 9.419 -6.034 -1.200 1.00 13.22 H new ATOM 0 HB2 ARG A 124 9.365 -8.695 0.260 1.00 23.34 H new ATOM 0 HB3 ARG A 124 9.358 -8.502 -1.482 1.00 23.34 H new ATOM 0 HG2 ARG A 124 11.530 -6.982 -0.939 1.00 43.14 H new ATOM 0 HG3 ARG A 124 11.585 -8.003 0.484 1.00 43.14 H new ATOM 0 HD2 ARG A 124 12.885 -9.313 -0.877 1.00 12.22 H new ATOM 0 HD3 ARG A 124 11.330 -9.950 -1.374 1.00 12.22 H new ATOM 0 HE ARG A 124 11.887 -7.678 -2.997 1.00 62.34 H new ATOM 0 HH11 ARG A 124 12.739 -11.101 -2.704 1.00 14.41 H new ATOM 0 HH12 ARG A 124 13.511 -11.149 -4.292 1.00 14.41 H new ATOM 0 HH21 ARG A 124 13.037 -7.724 -4.951 1.00 23.45 H new ATOM 0 HH22 ARG A 124 13.678 -9.257 -5.551 1.00 23.45 H new ATOM 2023 N CYS A 125 6.781 -7.434 0.262 1.00 61.12 N ATOM 2024 CA CYS A 125 5.326 -7.498 0.124 1.00 33.40 C ATOM 2025 C CYS A 125 4.630 -6.145 0.372 1.00 32.11 C ATOM 2026 O CYS A 125 3.460 -5.993 0.014 1.00 31.34 O ATOM 2027 CB CYS A 125 4.755 -8.595 1.033 1.00 72.31 C ATOM 2028 SG CYS A 125 5.305 -8.361 2.747 1.00 10.40 S ATOM 0 H CYS A 125 7.162 -7.991 1.027 1.00 61.12 H new ATOM 0 HA CYS A 125 5.116 -7.751 -0.915 1.00 33.40 H new ATOM 0 HB2 CYS A 125 3.666 -8.579 0.990 1.00 72.31 H new ATOM 0 HB3 CYS A 125 5.074 -9.574 0.674 1.00 72.31 H new ATOM 0 HG CYS A 125 6.336 -9.118 2.979 1.00 10.40 H new ATOM 2034 N THR A 126 5.294 -5.148 0.973 1.00 72.51 N ATOM 2035 CA THR A 126 4.760 -3.789 1.037 1.00 72.34 C ATOM 2036 C THR A 126 4.809 -3.117 -0.359 1.00 25.42 C ATOM 2037 O THR A 126 3.931 -2.312 -0.670 1.00 50.41 O ATOM 2038 CB THR A 126 5.488 -2.987 2.137 1.00 32.22 C ATOM 2039 OG1 THR A 126 5.167 -3.478 3.423 1.00 14.02 O ATOM 2040 CG2 THR A 126 5.007 -1.552 2.262 1.00 53.45 C ATOM 0 H THR A 126 6.203 -5.262 1.421 1.00 72.51 H new ATOM 0 HA THR A 126 3.707 -3.817 1.318 1.00 72.34 H new ATOM 0 HB THR A 126 6.536 -3.068 1.848 1.00 32.22 H new ATOM 0 HG1 THR A 126 5.642 -2.954 4.101 1.00 14.02 H new ATOM 0 HG21 THR A 126 5.563 -1.050 3.054 1.00 53.45 H new ATOM 0 HG22 THR A 126 5.169 -1.031 1.319 1.00 53.45 H new ATOM 0 HG23 THR A 126 3.944 -1.544 2.503 1.00 53.45 H new ATOM 2048 N ALA A 127 5.786 -3.448 -1.213 1.00 33.52 N ATOM 2049 CA ALA A 127 6.133 -2.759 -2.455 1.00 24.50 C ATOM 2050 C ALA A 127 5.198 -3.091 -3.624 1.00 41.22 C ATOM 2051 O ALA A 127 5.625 -3.695 -4.613 1.00 52.25 O ATOM 2052 CB ALA A 127 7.602 -3.076 -2.789 1.00 63.23 C ATOM 0 H ALA A 127 6.389 -4.253 -1.042 1.00 33.52 H new ATOM 0 HA ALA A 127 6.005 -1.688 -2.299 1.00 24.50 H new ATOM 0 HB1 ALA A 127 7.882 -2.571 -3.714 1.00 63.23 H new ATOM 0 HB2 ALA A 127 8.242 -2.730 -1.978 1.00 63.23 H new ATOM 0 HB3 ALA A 127 7.723 -4.152 -2.912 1.00 63.23 H new ATOM 2058 N VAL A 128 3.942 -2.649 -3.525 1.00 11.10 N ATOM 2059 CA VAL A 128 2.930 -2.847 -4.560 1.00 13.40 C ATOM 2060 C VAL A 128 1.830 -1.778 -4.463 1.00 50.02 C ATOM 2061 O VAL A 128 1.552 -1.255 -3.375 1.00 61.45 O ATOM 2062 CB VAL A 128 2.397 -4.297 -4.475 1.00 50.35 C ATOM 2063 CG1 VAL A 128 1.866 -4.660 -3.086 1.00 61.25 C ATOM 2064 CG2 VAL A 128 1.313 -4.628 -5.517 1.00 41.14 C ATOM 0 H VAL A 128 3.597 -2.137 -2.713 1.00 11.10 H new ATOM 0 HA VAL A 128 3.370 -2.720 -5.549 1.00 13.40 H new ATOM 0 HB VAL A 128 3.277 -4.901 -4.694 1.00 50.35 H new ATOM 0 HG11 VAL A 128 1.507 -5.689 -3.091 1.00 61.25 H new ATOM 0 HG12 VAL A 128 2.666 -4.559 -2.353 1.00 61.25 H new ATOM 0 HG13 VAL A 128 1.046 -3.991 -2.824 1.00 61.25 H new ATOM 0 HG21 VAL A 128 0.992 -5.662 -5.392 1.00 41.14 H new ATOM 0 HG22 VAL A 128 0.460 -3.964 -5.378 1.00 41.14 H new ATOM 0 HG23 VAL A 128 1.719 -4.493 -6.520 1.00 41.14 H new ATOM 2074 N GLY A 129 1.196 -1.473 -5.603 1.00 3.20 N ATOM 2075 CA GLY A 129 0.113 -0.508 -5.759 1.00 43.23 C ATOM 2076 C GLY A 129 -1.000 -1.086 -6.629 1.00 44.14 C ATOM 2077 O GLY A 129 -0.772 -2.063 -7.350 1.00 50.22 O ATOM 0 H GLY A 129 1.443 -1.920 -6.486 1.00 3.20 H new ATOM 0 HA2 GLY A 129 -0.285 -0.239 -4.781 1.00 43.23 H new ATOM 0 HA3 GLY A 129 0.496 0.407 -6.210 1.00 43.23 H new ATOM 2081 N LEU A 130 -2.200 -0.501 -6.544 1.00 14.20 N ATOM 2082 CA LEU A 130 -3.401 -0.881 -7.279 1.00 64.54 C ATOM 2083 C LEU A 130 -4.199 0.402 -7.552 1.00 65.43 C ATOM 2084 O LEU A 130 -4.377 1.206 -6.633 1.00 50.33 O ATOM 2085 CB LEU A 130 -4.238 -1.937 -6.501 1.00 43.44 C ATOM 2086 CG LEU A 130 -5.499 -2.334 -7.310 1.00 2.14 C ATOM 2087 CD1 LEU A 130 -5.210 -3.455 -8.314 1.00 65.22 C ATOM 2088 CD2 LEU A 130 -6.632 -2.745 -6.377 1.00 65.54 C ATOM 0 H LEU A 130 -2.363 0.293 -5.925 1.00 14.20 H new ATOM 0 HA LEU A 130 -3.134 -1.358 -8.222 1.00 64.54 H new ATOM 0 HB2 LEU A 130 -3.630 -2.821 -6.307 1.00 43.44 H new ATOM 0 HB3 LEU A 130 -4.532 -1.534 -5.532 1.00 43.44 H new ATOM 0 HG LEU A 130 -5.805 -1.454 -7.876 1.00 2.14 H new ATOM 0 HD11 LEU A 130 -6.122 -3.700 -8.858 1.00 65.22 H new ATOM 0 HD12 LEU A 130 -4.445 -3.125 -9.017 1.00 65.22 H new ATOM 0 HD13 LEU A 130 -4.857 -4.338 -7.782 1.00 65.22 H new ATOM 0 HD21 LEU A 130 -7.507 -3.020 -6.966 1.00 65.54 H new ATOM 0 HD22 LEU A 130 -6.317 -3.598 -5.776 1.00 65.54 H new ATOM 0 HD23 LEU A 130 -6.883 -1.912 -5.721 1.00 65.54 H new ATOM 2100 N ARG A 131 -4.690 0.628 -8.782 1.00 53.11 N ATOM 2101 CA ARG A 131 -5.778 1.590 -9.020 1.00 71.21 C ATOM 2102 C ARG A 131 -6.671 1.139 -10.177 1.00 24.31 C ATOM 2103 O ARG A 131 -6.327 0.199 -10.890 1.00 52.32 O ATOM 2104 CB ARG A 131 -5.305 3.038 -9.243 1.00 12.32 C ATOM 2105 CG ARG A 131 -6.290 4.011 -8.550 1.00 71.54 C ATOM 2106 CD ARG A 131 -6.093 5.475 -8.902 1.00 13.14 C ATOM 2107 NE ARG A 131 -6.133 5.688 -10.353 1.00 32.30 N ATOM 2108 CZ ARG A 131 -5.466 6.557 -11.119 1.00 31.42 C ATOM 2109 NH1 ARG A 131 -4.691 7.511 -10.619 1.00 11.34 N ATOM 2110 NH2 ARG A 131 -5.608 6.419 -12.430 1.00 73.34 N ATOM 0 H ARG A 131 -4.352 0.160 -9.623 1.00 53.11 H new ATOM 0 HA ARG A 131 -6.356 1.600 -8.096 1.00 71.21 H new ATOM 0 HB2 ARG A 131 -4.301 3.171 -8.840 1.00 12.32 H new ATOM 0 HB3 ARG A 131 -5.252 3.255 -10.310 1.00 12.32 H new ATOM 0 HG2 ARG A 131 -7.308 3.723 -8.812 1.00 71.54 H new ATOM 0 HG3 ARG A 131 -6.194 3.895 -7.470 1.00 71.54 H new ATOM 0 HD2 ARG A 131 -6.869 6.073 -8.424 1.00 13.14 H new ATOM 0 HD3 ARG A 131 -5.137 5.820 -8.509 1.00 13.14 H new ATOM 0 HE ARG A 131 -6.772 5.075 -10.858 1.00 32.30 H new ATOM 0 HH11 ARG A 131 -4.584 7.604 -9.609 1.00 11.34 H new ATOM 0 HH12 ARG A 131 -4.202 8.151 -11.245 1.00 11.34 H new ATOM 0 HH21 ARG A 131 -6.202 5.679 -12.804 1.00 73.34 H new ATOM 0 HH22 ARG A 131 -5.123 7.053 -13.065 1.00 73.34 H new ATOM 2124 N LEU A 132 -7.794 1.838 -10.364 1.00 70.31 N ATOM 2125 CA LEU A 132 -8.520 1.878 -11.626 1.00 3.41 C ATOM 2126 C LEU A 132 -7.802 2.841 -12.539 1.00 42.42 C ATOM 2127 O LEU A 132 -7.180 3.800 -12.077 1.00 41.35 O ATOM 2128 CB LEU A 132 -9.946 2.421 -11.444 1.00 22.32 C ATOM 2129 CG LEU A 132 -10.866 1.621 -10.514 1.00 3.33 C ATOM 2130 CD1 LEU A 132 -12.277 2.188 -10.650 1.00 44.25 C ATOM 2131 CD2 LEU A 132 -10.907 0.120 -10.802 1.00 30.43 C ATOM 0 H LEU A 132 -8.226 2.398 -9.629 1.00 70.31 H new ATOM 0 HA LEU A 132 -8.569 0.865 -12.025 1.00 3.41 H new ATOM 0 HB2 LEU A 132 -9.878 3.440 -11.063 1.00 22.32 H new ATOM 0 HB3 LEU A 132 -10.418 2.478 -12.425 1.00 22.32 H new ATOM 0 HG LEU A 132 -10.465 1.722 -9.505 1.00 3.33 H new ATOM 0 HD11 LEU A 132 -12.955 1.637 -9.998 1.00 44.25 H new ATOM 0 HD12 LEU A 132 -12.275 3.240 -10.365 1.00 44.25 H new ATOM 0 HD13 LEU A 132 -12.610 2.092 -11.684 1.00 44.25 H new ATOM 0 HD21 LEU A 132 -11.581 -0.367 -10.098 1.00 30.43 H new ATOM 0 HD22 LEU A 132 -11.262 -0.046 -11.819 1.00 30.43 H new ATOM 0 HD23 LEU A 132 -9.906 -0.299 -10.695 1.00 30.43 H new ATOM 2143 N ASN A 133 -8.008 2.654 -13.831 1.00 12.41 N ATOM 2144 CA ASN A 133 -7.576 3.568 -14.870 1.00 21.21 C ATOM 2145 C ASN A 133 -8.789 4.064 -15.649 1.00 71.23 C ATOM 2146 O ASN A 133 -9.936 3.911 -15.219 1.00 45.02 O ATOM 2147 CB ASN A 133 -6.514 2.892 -15.750 1.00 52.12 C ATOM 2148 CG ASN A 133 -7.003 1.642 -16.474 1.00 13.40 C ATOM 2149 OD1 ASN A 133 -8.200 1.399 -16.590 1.00 61.32 O ATOM 2150 ND2 ASN A 133 -6.080 0.837 -16.961 1.00 25.12 N ATOM 0 H ASN A 133 -8.496 1.836 -14.196 1.00 12.41 H new ATOM 0 HA ASN A 133 -7.101 4.448 -14.436 1.00 21.21 H new ATOM 0 HB2 ASN A 133 -6.160 3.611 -16.489 1.00 52.12 H new ATOM 0 HB3 ASN A 133 -5.659 2.627 -15.128 1.00 52.12 H new ATOM 0 HD21 ASN A 133 -6.353 -0.015 -17.450 1.00 25.12 H new ATOM 0 HD22 ASN A 133 -5.092 1.066 -16.849 1.00 25.12 H new ATOM 2157 N GLU A 134 -8.529 4.659 -16.807 1.00 11.03 N ATOM 2158 CA GLU A 134 -9.528 5.193 -17.726 1.00 42.42 C ATOM 2159 C GLU A 134 -10.530 4.133 -18.205 1.00 14.00 C ATOM 2160 O GLU A 134 -11.619 4.482 -18.669 1.00 5.24 O ATOM 2161 CB GLU A 134 -8.795 5.830 -18.916 1.00 31.11 C ATOM 2162 CG GLU A 134 -8.106 7.131 -18.486 1.00 24.11 C ATOM 2163 CD GLU A 134 -7.355 7.789 -19.642 1.00 12.33 C ATOM 2164 OE1 GLU A 134 -8.017 8.271 -20.593 1.00 11.13 O ATOM 2165 OE2 GLU A 134 -6.108 7.881 -19.516 1.00 60.42 O ATOM 0 H GLU A 134 -7.576 4.788 -17.146 1.00 11.03 H new ATOM 0 HA GLU A 134 -10.120 5.939 -17.195 1.00 42.42 H new ATOM 0 HB2 GLU A 134 -8.056 5.133 -19.311 1.00 31.11 H new ATOM 0 HB3 GLU A 134 -9.502 6.034 -19.720 1.00 31.11 H new ATOM 0 HG2 GLU A 134 -8.851 7.824 -18.096 1.00 24.11 H new ATOM 0 HG3 GLU A 134 -7.410 6.921 -17.674 1.00 24.11 H new ATOM 2172 N GLU A 135 -10.208 2.852 -18.054 1.00 52.45 N ATOM 2173 CA GLU A 135 -10.990 1.717 -18.516 1.00 33.54 C ATOM 2174 C GLU A 135 -11.620 0.967 -17.333 1.00 53.02 C ATOM 2175 O GLU A 135 -12.290 -0.051 -17.514 1.00 50.42 O ATOM 2176 CB GLU A 135 -10.093 0.825 -19.377 1.00 74.35 C ATOM 2177 CG GLU A 135 -9.579 1.591 -20.609 1.00 13.43 C ATOM 2178 CD GLU A 135 -8.690 0.701 -21.463 1.00 52.33 C ATOM 2179 OE1 GLU A 135 -9.207 -0.290 -22.028 1.00 63.54 O ATOM 2180 OE2 GLU A 135 -7.472 0.957 -21.527 1.00 63.14 O ATOM 0 H GLU A 135 -9.350 2.566 -17.582 1.00 52.45 H new ATOM 0 HA GLU A 135 -11.824 2.056 -19.130 1.00 33.54 H new ATOM 0 HB2 GLU A 135 -9.249 0.471 -18.785 1.00 74.35 H new ATOM 0 HB3 GLU A 135 -10.649 -0.056 -19.697 1.00 74.35 H new ATOM 0 HG2 GLU A 135 -10.423 1.946 -21.201 1.00 13.43 H new ATOM 0 HG3 GLU A 135 -9.021 2.471 -20.289 1.00 13.43 H new ATOM 2187 N LEU A 136 -11.448 1.499 -16.116 1.00 64.51 N ATOM 2188 CA LEU A 136 -11.816 0.902 -14.835 1.00 73.14 C ATOM 2189 C LEU A 136 -11.174 -0.473 -14.641 1.00 71.34 C ATOM 2190 O LEU A 136 -11.729 -1.324 -13.941 1.00 32.30 O ATOM 2191 CB LEU A 136 -13.337 0.882 -14.605 1.00 13.00 C ATOM 2192 CG LEU A 136 -14.106 2.152 -15.007 1.00 61.21 C ATOM 2193 CD1 LEU A 136 -15.575 2.029 -14.598 1.00 71.35 C ATOM 2194 CD2 LEU A 136 -13.547 3.432 -14.381 1.00 54.02 C ATOM 0 H LEU A 136 -11.020 2.417 -15.997 1.00 64.51 H new ATOM 0 HA LEU A 136 -11.407 1.551 -14.060 1.00 73.14 H new ATOM 0 HB2 LEU A 136 -13.755 0.040 -15.157 1.00 13.00 H new ATOM 0 HB3 LEU A 136 -13.520 0.692 -13.547 1.00 13.00 H new ATOM 0 HG LEU A 136 -13.996 2.233 -16.088 1.00 61.21 H new ATOM 0 HD11 LEU A 136 -16.110 2.933 -14.887 1.00 71.35 H new ATOM 0 HD12 LEU A 136 -16.021 1.168 -15.097 1.00 71.35 H new ATOM 0 HD13 LEU A 136 -15.642 1.897 -13.518 1.00 71.35 H new ATOM 0 HD21 LEU A 136 -14.139 4.286 -14.709 1.00 54.02 H new ATOM 0 HD22 LEU A 136 -13.592 3.355 -13.295 1.00 54.02 H new ATOM 0 HD23 LEU A 136 -12.511 3.567 -14.693 1.00 54.02 H new ATOM 2206 N ASP A 137 -10.028 -0.689 -15.283 1.00 3.34 N ATOM 2207 CA ASP A 137 -9.263 -1.920 -15.214 1.00 71.14 C ATOM 2208 C ASP A 137 -8.429 -1.954 -13.943 1.00 61.15 C ATOM 2209 O ASP A 137 -8.590 -1.109 -13.065 1.00 41.24 O ATOM 2210 CB ASP A 137 -8.373 -2.022 -16.454 1.00 73.32 C ATOM 2211 CG ASP A 137 -8.321 -3.469 -16.939 1.00 70.23 C ATOM 2212 OD1 ASP A 137 -9.369 -3.949 -17.426 1.00 34.30 O ATOM 2213 OD2 ASP A 137 -7.256 -4.111 -16.785 1.00 43.12 O ATOM 0 H ASP A 137 -9.597 0.014 -15.883 1.00 3.34 H new ATOM 0 HA ASP A 137 -9.941 -2.773 -15.189 1.00 71.14 H new ATOM 0 HB2 ASP A 137 -8.760 -1.378 -17.244 1.00 73.32 H new ATOM 0 HB3 ASP A 137 -7.368 -1.671 -16.221 1.00 73.32 H new ATOM 2218 N PHE A 138 -7.525 -2.919 -13.833 1.00 4.02 N ATOM 2219 CA PHE A 138 -6.736 -3.157 -12.642 1.00 53.42 C ATOM 2220 C PHE A 138 -5.291 -2.798 -12.967 1.00 25.51 C ATOM 2221 O PHE A 138 -4.529 -3.612 -13.498 1.00 44.42 O ATOM 2222 CB PHE A 138 -6.936 -4.602 -12.179 1.00 32.41 C ATOM 2223 CG PHE A 138 -8.359 -5.119 -12.339 1.00 44.43 C ATOM 2224 CD1 PHE A 138 -9.416 -4.535 -11.616 1.00 54.14 C ATOM 2225 CD2 PHE A 138 -8.638 -6.118 -13.292 1.00 50.02 C ATOM 2226 CE1 PHE A 138 -10.740 -4.956 -11.844 1.00 53.02 C ATOM 2227 CE2 PHE A 138 -9.955 -6.555 -13.499 1.00 33.32 C ATOM 2228 CZ PHE A 138 -11.009 -5.972 -12.778 1.00 25.40 C ATOM 0 H PHE A 138 -7.319 -3.571 -14.590 1.00 4.02 H new ATOM 0 HA PHE A 138 -7.048 -2.534 -11.803 1.00 53.42 H new ATOM 0 HB2 PHE A 138 -6.262 -5.248 -12.741 1.00 32.41 H new ATOM 0 HB3 PHE A 138 -6.650 -4.678 -11.130 1.00 32.41 H new ATOM 0 HD1 PHE A 138 -9.212 -3.765 -10.887 1.00 54.14 H new ATOM 0 HD2 PHE A 138 -7.833 -6.550 -13.867 1.00 50.02 H new ATOM 0 HE1 PHE A 138 -11.552 -4.497 -11.300 1.00 53.02 H new ATOM 0 HE2 PHE A 138 -10.158 -7.340 -14.213 1.00 33.32 H new ATOM 0 HZ PHE A 138 -12.024 -6.303 -12.940 1.00 25.40 H new ATOM 2238 N GLU A 139 -4.917 -1.550 -12.706 1.00 13.11 N ATOM 2239 CA GLU A 139 -3.525 -1.130 -12.762 1.00 61.35 C ATOM 2240 C GLU A 139 -2.817 -1.734 -11.552 1.00 43.01 C ATOM 2241 O GLU A 139 -3.353 -1.642 -10.450 1.00 22.30 O ATOM 2242 CB GLU A 139 -3.433 0.406 -12.738 1.00 50.04 C ATOM 2243 CG GLU A 139 -1.978 0.883 -12.827 1.00 5.42 C ATOM 2244 CD GLU A 139 -1.325 0.373 -14.108 1.00 1.23 C ATOM 2245 OE1 GLU A 139 -1.446 1.021 -15.167 1.00 5.12 O ATOM 2246 OE2 GLU A 139 -0.670 -0.689 -14.053 1.00 24.21 O ATOM 0 H GLU A 139 -5.567 -0.806 -12.451 1.00 13.11 H new ATOM 0 HA GLU A 139 -3.054 -1.471 -13.684 1.00 61.35 H new ATOM 0 HB2 GLU A 139 -4.004 0.819 -13.570 1.00 50.04 H new ATOM 0 HB3 GLU A 139 -3.886 0.784 -11.822 1.00 50.04 H new ATOM 0 HG2 GLU A 139 -1.944 1.972 -12.804 1.00 5.42 H new ATOM 0 HG3 GLU A 139 -1.419 0.528 -11.961 1.00 5.42 H new ATOM 2253 N LEU A 140 -1.625 -2.307 -11.736 1.00 14.00 N ATOM 2254 CA LEU A 140 -0.816 -2.953 -10.708 1.00 2.02 C ATOM 2255 C LEU A 140 0.637 -2.484 -10.890 1.00 2.21 C ATOM 2256 O LEU A 140 0.994 -1.935 -11.939 1.00 64.52 O ATOM 2257 CB LEU A 140 -0.930 -4.476 -10.876 1.00 30.32 C ATOM 2258 CG LEU A 140 -0.412 -5.264 -9.649 1.00 2.42 C ATOM 2259 CD1 LEU A 140 -1.557 -5.733 -8.751 1.00 21.54 C ATOM 2260 CD2 LEU A 140 0.431 -6.445 -10.112 1.00 74.54 C ATOM 0 H LEU A 140 -1.179 -2.332 -12.653 1.00 14.00 H new ATOM 0 HA LEU A 140 -1.156 -2.691 -9.706 1.00 2.02 H new ATOM 0 HB2 LEU A 140 -1.973 -4.738 -11.055 1.00 30.32 H new ATOM 0 HB3 LEU A 140 -0.369 -4.781 -11.759 1.00 30.32 H new ATOM 0 HG LEU A 140 0.208 -4.594 -9.053 1.00 2.42 H new ATOM 0 HD11 LEU A 140 -1.151 -6.282 -7.901 1.00 21.54 H new ATOM 0 HD12 LEU A 140 -2.115 -4.868 -8.392 1.00 21.54 H new ATOM 0 HD13 LEU A 140 -2.222 -6.383 -9.319 1.00 21.54 H new ATOM 0 HD21 LEU A 140 0.793 -6.996 -9.244 1.00 74.54 H new ATOM 0 HD22 LEU A 140 -0.176 -7.104 -10.733 1.00 74.54 H new ATOM 0 HD23 LEU A 140 1.280 -6.081 -10.691 1.00 74.54 H new ATOM 2272 N TYR A 141 1.517 -2.694 -9.913 1.00 32.12 N ATOM 2273 CA TYR A 141 2.955 -2.509 -10.082 1.00 34.23 C ATOM 2274 C TYR A 141 3.683 -3.378 -9.069 1.00 41.45 C ATOM 2275 O TYR A 141 3.425 -3.240 -7.877 1.00 24.30 O ATOM 2276 CB TYR A 141 3.299 -1.030 -9.906 1.00 24.22 C ATOM 2277 CG TYR A 141 4.755 -0.684 -10.063 1.00 63.23 C ATOM 2278 CD1 TYR A 141 5.340 -0.684 -11.345 1.00 34.54 C ATOM 2279 CD2 TYR A 141 5.485 -0.245 -8.945 1.00 4.30 C ATOM 2280 CE1 TYR A 141 6.679 -0.293 -11.498 1.00 12.13 C ATOM 2281 CE2 TYR A 141 6.804 0.206 -9.095 1.00 13.41 C ATOM 2282 CZ TYR A 141 7.416 0.134 -10.370 1.00 3.14 C ATOM 2283 OH TYR A 141 8.712 0.503 -10.514 1.00 41.14 O ATOM 0 H TYR A 141 1.250 -2.999 -8.977 1.00 32.12 H new ATOM 0 HA TYR A 141 3.268 -2.809 -11.082 1.00 34.23 H new ATOM 0 HB2 TYR A 141 2.725 -0.452 -10.631 1.00 24.22 H new ATOM 0 HB3 TYR A 141 2.972 -0.714 -8.915 1.00 24.22 H new ATOM 0 HD1 TYR A 141 4.761 -0.984 -12.206 1.00 34.54 H new ATOM 0 HD2 TYR A 141 5.028 -0.255 -7.966 1.00 4.30 H new ATOM 0 HE1 TYR A 141 7.144 -0.318 -12.472 1.00 12.13 H new ATOM 0 HE2 TYR A 141 7.346 0.603 -8.249 1.00 13.41 H new ATOM 0 HH TYR A 141 9.074 0.771 -9.644 1.00 41.14 H new ATOM 2293 N VAL A 142 4.546 -4.278 -9.547 1.00 73.11 N ATOM 2294 CA VAL A 142 5.316 -5.222 -8.737 1.00 50.31 C ATOM 2295 C VAL A 142 6.709 -5.395 -9.361 1.00 50.21 C ATOM 2296 O VAL A 142 6.987 -6.412 -10.006 1.00 53.42 O ATOM 2297 CB VAL A 142 4.555 -6.554 -8.536 1.00 71.22 C ATOM 2298 CG1 VAL A 142 3.402 -6.372 -7.549 1.00 70.34 C ATOM 2299 CG2 VAL A 142 3.980 -7.163 -9.824 1.00 2.01 C ATOM 0 H VAL A 142 4.734 -4.372 -10.545 1.00 73.11 H new ATOM 0 HA VAL A 142 5.451 -4.824 -7.731 1.00 50.31 H new ATOM 0 HB VAL A 142 5.308 -7.244 -8.155 1.00 71.22 H new ATOM 0 HG11 VAL A 142 2.879 -7.320 -7.421 1.00 70.34 H new ATOM 0 HG12 VAL A 142 3.795 -6.042 -6.587 1.00 70.34 H new ATOM 0 HG13 VAL A 142 2.708 -5.624 -7.934 1.00 70.34 H new ATOM 0 HG21 VAL A 142 3.464 -8.094 -9.588 1.00 2.01 H new ATOM 0 HG22 VAL A 142 3.277 -6.463 -10.275 1.00 2.01 H new ATOM 0 HG23 VAL A 142 4.790 -7.365 -10.524 1.00 2.01 H new ATOM 2309 N PRO A 143 7.615 -4.412 -9.215 1.00 42.34 N ATOM 2310 CA PRO A 143 8.930 -4.451 -9.842 1.00 52.11 C ATOM 2311 C PRO A 143 9.839 -5.554 -9.303 1.00 13.41 C ATOM 2312 O PRO A 143 10.881 -5.804 -9.915 1.00 41.34 O ATOM 2313 CB PRO A 143 9.544 -3.068 -9.613 1.00 52.31 C ATOM 2314 CG PRO A 143 8.847 -2.583 -8.355 1.00 12.13 C ATOM 2315 CD PRO A 143 7.443 -3.160 -8.503 1.00 11.24 C ATOM 0 HA PRO A 143 8.823 -4.688 -10.901 1.00 52.11 H new ATOM 0 HB2 PRO A 143 10.624 -3.124 -9.479 1.00 52.31 H new ATOM 0 HB3 PRO A 143 9.362 -2.402 -10.456 1.00 52.31 H new ATOM 0 HG2 PRO A 143 9.341 -2.946 -7.454 1.00 12.13 H new ATOM 0 HG3 PRO A 143 8.833 -1.495 -8.294 1.00 12.13 H new ATOM 0 HD2 PRO A 143 6.980 -3.322 -7.530 1.00 11.24 H new ATOM 0 HD3 PRO A 143 6.795 -2.480 -9.055 1.00 11.24 H new ATOM 2323 N TYR A 144 9.454 -6.208 -8.208 1.00 53.14 N ATOM 2324 CA TYR A 144 10.206 -7.272 -7.574 1.00 11.04 C ATOM 2325 C TYR A 144 9.445 -8.598 -7.588 1.00 52.42 C ATOM 2326 O TYR A 144 10.022 -9.608 -7.190 1.00 33.32 O ATOM 2327 CB TYR A 144 10.469 -6.846 -6.137 1.00 23.34 C ATOM 2328 CG TYR A 144 11.385 -5.654 -5.944 1.00 70.02 C ATOM 2329 CD1 TYR A 144 12.727 -5.716 -6.357 1.00 72.21 C ATOM 2330 CD2 TYR A 144 10.911 -4.510 -5.279 1.00 5.41 C ATOM 2331 CE1 TYR A 144 13.596 -4.643 -6.097 1.00 32.12 C ATOM 2332 CE2 TYR A 144 11.776 -3.437 -5.011 1.00 34.24 C ATOM 2333 CZ TYR A 144 13.127 -3.492 -5.425 1.00 22.00 C ATOM 2334 OH TYR A 144 13.990 -2.477 -5.136 1.00 13.24 O ATOM 0 H TYR A 144 8.579 -5.999 -7.727 1.00 53.14 H new ATOM 0 HA TYR A 144 11.135 -7.434 -8.122 1.00 11.04 H new ATOM 0 HB2 TYR A 144 9.512 -6.621 -5.667 1.00 23.34 H new ATOM 0 HB3 TYR A 144 10.895 -7.695 -5.602 1.00 23.34 H new ATOM 0 HD1 TYR A 144 13.091 -6.591 -6.876 1.00 72.21 H new ATOM 0 HD2 TYR A 144 9.877 -4.456 -4.973 1.00 5.41 H new ATOM 0 HE1 TYR A 144 14.627 -4.698 -6.412 1.00 32.12 H new ATOM 0 HE2 TYR A 144 11.408 -2.567 -4.487 1.00 34.24 H new ATOM 0 HH TYR A 144 14.697 -2.446 -5.814 1.00 13.24 H new ATOM 2344 N GLY A 145 8.191 -8.628 -8.051 1.00 44.42 N ATOM 2345 CA GLY A 145 7.422 -9.852 -8.197 1.00 33.22 C ATOM 2346 C GLY A 145 6.315 -9.996 -7.170 1.00 13.15 C ATOM 2347 O GLY A 145 6.150 -9.169 -6.278 1.00 31.43 O ATOM 0 H GLY A 145 7.683 -7.791 -8.336 1.00 44.42 H new ATOM 0 HA2 GLY A 145 6.987 -9.881 -9.196 1.00 33.22 H new ATOM 0 HA3 GLY A 145 8.094 -10.706 -8.117 1.00 33.22 H new ATOM 2351 N LEU A 146 5.511 -11.041 -7.352 1.00 73.24 N ATOM 2352 CA LEU A 146 4.271 -11.267 -6.614 1.00 51.13 C ATOM 2353 C LEU A 146 4.415 -12.323 -5.541 1.00 4.04 C ATOM 2354 O LEU A 146 3.639 -12.302 -4.589 1.00 3.31 O ATOM 2355 CB LEU A 146 3.172 -11.730 -7.583 1.00 65.23 C ATOM 2356 CG LEU A 146 2.519 -10.570 -8.340 1.00 25.45 C ATOM 2357 CD1 LEU A 146 1.687 -11.131 -9.492 1.00 34.52 C ATOM 2358 CD2 LEU A 146 1.600 -9.764 -7.420 1.00 1.23 C ATOM 0 H LEU A 146 5.709 -11.773 -8.034 1.00 73.24 H new ATOM 0 HA LEU A 146 4.015 -10.321 -6.137 1.00 51.13 H new ATOM 0 HB2 LEU A 146 3.599 -12.431 -8.300 1.00 65.23 H new ATOM 0 HB3 LEU A 146 2.407 -12.270 -7.026 1.00 65.23 H new ATOM 0 HG LEU A 146 3.306 -9.915 -8.714 1.00 25.45 H new ATOM 0 HD11 LEU A 146 1.219 -10.311 -10.036 1.00 34.52 H new ATOM 0 HD12 LEU A 146 2.333 -11.692 -10.167 1.00 34.52 H new ATOM 0 HD13 LEU A 146 0.915 -11.791 -9.096 1.00 34.52 H new ATOM 0 HD21 LEU A 146 1.149 -8.946 -7.982 1.00 1.23 H new ATOM 0 HD22 LEU A 146 0.816 -10.413 -7.030 1.00 1.23 H new ATOM 0 HD23 LEU A 146 2.180 -9.358 -6.591 1.00 1.23 H new ATOM 2370 N GLU A 147 5.358 -13.258 -5.694 1.00 71.44 N ATOM 2371 CA GLU A 147 5.420 -14.449 -4.856 1.00 54.10 C ATOM 2372 C GLU A 147 5.488 -14.077 -3.374 1.00 51.40 C ATOM 2373 O GLU A 147 4.845 -14.730 -2.559 1.00 51.13 O ATOM 2374 CB GLU A 147 6.597 -15.322 -5.295 1.00 70.50 C ATOM 2375 CG GLU A 147 6.178 -16.495 -6.193 1.00 65.30 C ATOM 2376 CD GLU A 147 6.267 -17.837 -5.464 1.00 50.13 C ATOM 2377 OE1 GLU A 147 7.373 -18.395 -5.276 1.00 51.41 O ATOM 2378 OE2 GLU A 147 5.202 -18.347 -5.053 1.00 45.22 O ATOM 0 H GLU A 147 6.093 -13.207 -6.399 1.00 71.44 H new ATOM 0 HA GLU A 147 4.506 -15.029 -4.983 1.00 54.10 H new ATOM 0 HB2 GLU A 147 7.320 -14.705 -5.828 1.00 70.50 H new ATOM 0 HB3 GLU A 147 7.102 -15.712 -4.411 1.00 70.50 H new ATOM 0 HG2 GLU A 147 5.157 -16.338 -6.540 1.00 65.30 H new ATOM 0 HG3 GLU A 147 6.815 -16.520 -7.077 1.00 65.30 H new ATOM 2385 N ASP A 148 6.167 -12.984 -3.028 1.00 3.33 N ATOM 2386 CA ASP A 148 6.283 -12.503 -1.653 1.00 54.00 C ATOM 2387 C ASP A 148 4.964 -12.109 -1.002 1.00 33.53 C ATOM 2388 O ASP A 148 4.881 -12.137 0.227 1.00 64.52 O ATOM 2389 CB ASP A 148 7.282 -11.352 -1.557 1.00 42.40 C ATOM 2390 CG ASP A 148 7.043 -10.166 -2.493 1.00 42.00 C ATOM 2391 OD1 ASP A 148 5.929 -9.610 -2.518 1.00 51.20 O ATOM 2392 OD2 ASP A 148 8.006 -9.804 -3.215 1.00 13.34 O ATOM 0 H ASP A 148 6.659 -12.400 -3.705 1.00 3.33 H new ATOM 0 HA ASP A 148 6.649 -13.360 -1.088 1.00 54.00 H new ATOM 0 HB2 ASP A 148 7.282 -10.983 -0.531 1.00 42.40 H new ATOM 0 HB3 ASP A 148 8.279 -11.747 -1.753 1.00 42.40 H new ATOM 2397 N ILE A 149 3.916 -11.809 -1.768 1.00 2.03 N ATOM 2398 CA ILE A 149 2.603 -11.594 -1.190 1.00 71.11 C ATOM 2399 C ILE A 149 2.006 -12.970 -0.911 1.00 12.33 C ATOM 2400 O ILE A 149 1.658 -13.228 0.240 1.00 63.44 O ATOM 2401 CB ILE A 149 1.684 -10.713 -2.069 1.00 2.12 C ATOM 2402 CG1 ILE A 149 2.401 -9.457 -2.608 1.00 52.11 C ATOM 2403 CG2 ILE A 149 0.467 -10.307 -1.218 1.00 3.11 C ATOM 2404 CD1 ILE A 149 1.513 -8.575 -3.496 1.00 74.12 C ATOM 0 H ILE A 149 3.956 -11.711 -2.783 1.00 2.03 H new ATOM 0 HA ILE A 149 2.698 -11.026 -0.264 1.00 71.11 H new ATOM 0 HB ILE A 149 1.380 -11.289 -2.943 1.00 2.12 H new ATOM 0 HG12 ILE A 149 2.760 -8.865 -1.766 1.00 52.11 H new ATOM 0 HG13 ILE A 149 3.277 -9.766 -3.178 1.00 52.11 H new ATOM 0 HG21 ILE A 149 -0.201 -9.683 -1.812 1.00 3.11 H new ATOM 0 HG22 ILE A 149 -0.065 -11.201 -0.893 1.00 3.11 H new ATOM 0 HG23 ILE A 149 0.804 -9.748 -0.345 1.00 3.11 H new ATOM 0 HD11 ILE A 149 2.084 -7.712 -3.838 1.00 74.12 H new ATOM 0 HD12 ILE A 149 1.174 -9.150 -4.358 1.00 74.12 H new ATOM 0 HD13 ILE A 149 0.649 -8.236 -2.924 1.00 74.12 H new ATOM 2416 N LEU A 150 1.914 -13.847 -1.924 1.00 22.42 N ATOM 2417 CA LEU A 150 1.275 -15.170 -1.815 1.00 24.41 C ATOM 2418 C LEU A 150 1.907 -15.987 -0.682 1.00 34.35 C ATOM 2419 O LEU A 150 1.216 -16.614 0.116 1.00 42.41 O ATOM 2420 CB LEU A 150 1.402 -15.980 -3.131 1.00 41.21 C ATOM 2421 CG LEU A 150 0.668 -15.491 -4.399 1.00 73.43 C ATOM 2422 CD1 LEU A 150 -0.694 -14.876 -4.090 1.00 3.03 C ATOM 2423 CD2 LEU A 150 1.441 -14.454 -5.218 1.00 34.13 C ATOM 0 H LEU A 150 2.286 -13.655 -2.854 1.00 22.42 H new ATOM 0 HA LEU A 150 0.220 -14.991 -1.606 1.00 24.41 H new ATOM 0 HB2 LEU A 150 2.463 -16.046 -3.373 1.00 41.21 H new ATOM 0 HB3 LEU A 150 1.058 -16.994 -2.925 1.00 41.21 H new ATOM 0 HG LEU A 150 0.563 -16.405 -4.984 1.00 73.43 H new ATOM 0 HD11 LEU A 150 -1.165 -14.550 -5.017 1.00 3.03 H new ATOM 0 HD12 LEU A 150 -1.327 -15.619 -3.604 1.00 3.03 H new ATOM 0 HD13 LEU A 150 -0.565 -14.020 -3.428 1.00 3.03 H new ATOM 0 HD21 LEU A 150 0.853 -14.167 -6.089 1.00 34.13 H new ATOM 0 HD22 LEU A 150 1.633 -13.574 -4.603 1.00 34.13 H new ATOM 0 HD23 LEU A 150 2.389 -14.882 -5.545 1.00 34.13 H new ATOM 2435 N ASN A 151 3.235 -15.944 -0.586 1.00 42.21 N ATOM 2436 CA ASN A 151 4.037 -16.669 0.395 1.00 53.41 C ATOM 2437 C ASN A 151 4.061 -15.955 1.752 1.00 11.11 C ATOM 2438 O ASN A 151 4.705 -16.468 2.665 1.00 25.35 O ATOM 2439 CB ASN A 151 5.475 -16.841 -0.125 1.00 63.33 C ATOM 2440 CG ASN A 151 5.589 -17.873 -1.231 1.00 50.01 C ATOM 2441 OD1 ASN A 151 6.072 -18.982 -1.015 1.00 12.45 O ATOM 2442 ND2 ASN A 151 5.240 -17.483 -2.440 1.00 23.35 N ATOM 0 H ASN A 151 3.804 -15.379 -1.217 1.00 42.21 H new ATOM 0 HA ASN A 151 3.576 -17.646 0.539 1.00 53.41 H new ATOM 0 HB2 ASN A 151 5.839 -15.882 -0.493 1.00 63.33 H new ATOM 0 HB3 ASN A 151 6.122 -17.131 0.703 1.00 63.33 H new ATOM 0 HD21 ASN A 151 5.368 -18.109 -3.235 1.00 23.35 H new ATOM 0 HD22 ASN A 151 4.842 -16.555 -2.581 1.00 23.35 H new ATOM 2449 N PHE A 152 3.390 -14.805 1.897 1.00 12.31 N ATOM 2450 CA PHE A 152 3.322 -13.956 3.081 1.00 45.44 C ATOM 2451 C PHE A 152 4.726 -13.660 3.621 1.00 34.41 C ATOM 2452 O PHE A 152 5.042 -13.992 4.761 1.00 1.05 O ATOM 2453 CB PHE A 152 2.373 -14.574 4.125 1.00 62.21 C ATOM 2454 CG PHE A 152 0.896 -14.541 3.793 1.00 52.12 C ATOM 2455 CD1 PHE A 152 0.332 -15.542 2.986 1.00 63.44 C ATOM 2456 CD2 PHE A 152 0.066 -13.555 4.359 1.00 54.42 C ATOM 2457 CE1 PHE A 152 -1.052 -15.577 2.751 1.00 61.40 C ATOM 2458 CE2 PHE A 152 -1.318 -13.586 4.121 1.00 22.53 C ATOM 2459 CZ PHE A 152 -1.873 -14.598 3.324 1.00 62.44 C ATOM 0 H PHE A 152 2.841 -14.420 1.128 1.00 12.31 H new ATOM 0 HA PHE A 152 2.898 -12.988 2.814 1.00 45.44 H new ATOM 0 HB2 PHE A 152 2.665 -15.612 4.281 1.00 62.21 H new ATOM 0 HB3 PHE A 152 2.522 -14.056 5.072 1.00 62.21 H new ATOM 0 HD1 PHE A 152 0.969 -16.292 2.542 1.00 63.44 H new ATOM 0 HD2 PHE A 152 0.492 -12.777 4.975 1.00 54.42 H new ATOM 0 HE1 PHE A 152 -1.480 -16.353 2.133 1.00 61.40 H new ATOM 0 HE2 PHE A 152 -1.956 -12.829 4.553 1.00 22.53 H new ATOM 0 HZ PHE A 152 -2.939 -14.622 3.151 1.00 62.44 H new ATOM 2469 N GLN A 153 5.590 -13.046 2.809 1.00 63.23 N ATOM 2470 CA GLN A 153 6.999 -12.878 3.140 1.00 2.35 C ATOM 2471 C GLN A 153 7.298 -11.437 3.538 1.00 21.33 C ATOM 2472 O GLN A 153 7.522 -10.575 2.683 1.00 50.41 O ATOM 2473 CB GLN A 153 7.887 -13.304 1.970 1.00 73.44 C ATOM 2474 CG GLN A 153 7.689 -14.776 1.614 1.00 73.10 C ATOM 2475 CD GLN A 153 9.005 -15.461 1.278 1.00 52.21 C ATOM 2476 OE1 GLN A 153 9.349 -15.617 0.113 1.00 32.44 O ATOM 2477 NE2 GLN A 153 9.760 -15.851 2.287 1.00 44.31 N ATOM 0 H GLN A 153 5.328 -12.653 1.905 1.00 63.23 H new ATOM 0 HA GLN A 153 7.221 -13.521 3.992 1.00 2.35 H new ATOM 0 HB2 GLN A 153 7.663 -12.686 1.100 1.00 73.44 H new ATOM 0 HB3 GLN A 153 8.932 -13.129 2.225 1.00 73.44 H new ATOM 0 HG2 GLN A 153 7.215 -15.291 2.450 1.00 73.10 H new ATOM 0 HG3 GLN A 153 7.011 -14.856 0.764 1.00 73.10 H new ATOM 0 HE21 GLN A 153 9.444 -15.706 3.246 1.00 44.31 H new ATOM 0 HE22 GLN A 153 10.660 -16.297 2.108 1.00 44.31 H new ATOM 2486 N VAL A 154 7.335 -11.172 4.839 1.00 41.20 N ATOM 2487 CA VAL A 154 7.913 -9.946 5.378 1.00 74.34 C ATOM 2488 C VAL A 154 9.422 -10.121 5.251 1.00 12.55 C ATOM 2489 O VAL A 154 10.037 -10.908 5.974 1.00 71.42 O ATOM 2490 CB VAL A 154 7.424 -9.702 6.819 1.00 42.42 C ATOM 2491 CG1 VAL A 154 8.147 -8.564 7.535 1.00 72.01 C ATOM 2492 CG2 VAL A 154 5.931 -9.368 6.808 1.00 61.43 C ATOM 0 H VAL A 154 6.965 -11.802 5.551 1.00 41.20 H new ATOM 0 HA VAL A 154 7.603 -9.052 4.837 1.00 74.34 H new ATOM 0 HB VAL A 154 7.636 -10.624 7.361 1.00 42.42 H new ATOM 0 HG11 VAL A 154 7.746 -8.455 8.543 1.00 72.01 H new ATOM 0 HG12 VAL A 154 9.212 -8.788 7.590 1.00 72.01 H new ATOM 0 HG13 VAL A 154 7.999 -7.635 6.984 1.00 72.01 H new ATOM 0 HG21 VAL A 154 5.589 -9.196 7.829 1.00 61.43 H new ATOM 0 HG22 VAL A 154 5.763 -8.470 6.213 1.00 61.43 H new ATOM 0 HG23 VAL A 154 5.375 -10.199 6.374 1.00 61.43 H new ATOM 2502 N ARG A 155 10.016 -9.453 4.269 1.00 74.12 N ATOM 2503 CA ARG A 155 11.455 -9.362 4.078 1.00 63.40 C ATOM 2504 C ARG A 155 11.764 -7.954 3.581 1.00 71.42 C ATOM 2505 O ARG A 155 10.912 -7.383 2.892 1.00 73.24 O ATOM 2506 CB ARG A 155 11.965 -10.450 3.121 1.00 61.32 C ATOM 2507 CG ARG A 155 11.107 -10.773 1.889 1.00 24.22 C ATOM 2508 CD ARG A 155 11.890 -11.811 1.089 1.00 71.14 C ATOM 2509 NE ARG A 155 11.212 -12.292 -0.129 1.00 44.23 N ATOM 2510 CZ ARG A 155 11.548 -13.423 -0.774 1.00 11.55 C ATOM 2511 NH1 ARG A 155 12.498 -14.221 -0.304 1.00 63.21 N ATOM 2512 NH2 ARG A 155 10.939 -13.724 -1.912 1.00 31.34 N ATOM 0 H ARG A 155 9.489 -8.943 3.560 1.00 74.12 H new ATOM 0 HA ARG A 155 11.978 -9.537 5.018 1.00 63.40 H new ATOM 0 HB2 ARG A 155 12.955 -10.154 2.773 1.00 61.32 H new ATOM 0 HB3 ARG A 155 12.090 -11.369 3.693 1.00 61.32 H new ATOM 0 HG2 ARG A 155 10.132 -11.162 2.184 1.00 24.22 H new ATOM 0 HG3 ARG A 155 10.926 -9.878 1.294 1.00 24.22 H new ATOM 0 HD2 ARG A 155 12.852 -11.382 0.807 1.00 71.14 H new ATOM 0 HD3 ARG A 155 12.098 -12.665 1.734 1.00 71.14 H new ATOM 0 HE ARG A 155 10.444 -11.735 -0.504 1.00 44.23 H new ATOM 0 HH11 ARG A 155 12.986 -13.980 0.559 1.00 63.21 H new ATOM 0 HH12 ARG A 155 12.741 -15.075 -0.806 1.00 63.21 H new ATOM 0 HH21 ARG A 155 10.225 -13.101 -2.289 1.00 31.34 H new ATOM 0 HH22 ARG A 155 11.185 -14.579 -2.411 1.00 31.34 H new ATOM 2526 N PRO A 156 12.943 -7.389 3.883 1.00 54.50 N ATOM 2527 CA PRO A 156 13.331 -6.094 3.357 1.00 42.32 C ATOM 2528 C PRO A 156 13.561 -6.230 1.854 1.00 52.21 C ATOM 2529 O PRO A 156 14.042 -7.256 1.362 1.00 10.11 O ATOM 2530 CB PRO A 156 14.590 -5.676 4.112 1.00 21.04 C ATOM 2531 CG PRO A 156 15.192 -6.993 4.584 1.00 23.03 C ATOM 2532 CD PRO A 156 14.035 -7.992 4.624 1.00 3.21 C ATOM 0 HA PRO A 156 12.566 -5.329 3.494 1.00 42.32 H new ATOM 0 HB2 PRO A 156 15.279 -5.131 3.467 1.00 21.04 H new ATOM 0 HB3 PRO A 156 14.353 -5.022 4.951 1.00 21.04 H new ATOM 0 HG2 PRO A 156 15.976 -7.330 3.905 1.00 23.03 H new ATOM 0 HG3 PRO A 156 15.648 -6.884 5.568 1.00 23.03 H new ATOM 0 HD2 PRO A 156 14.328 -8.943 4.178 1.00 3.21 H new ATOM 0 HD3 PRO A 156 13.738 -8.200 5.652 1.00 3.21 H new ATOM 2540 N THR A 157 13.205 -5.181 1.133 1.00 74.23 N ATOM 2541 CA THR A 157 13.580 -4.929 -0.245 1.00 10.42 C ATOM 2542 C THR A 157 15.084 -4.617 -0.327 1.00 33.31 C ATOM 2543 O THR A 157 15.696 -4.216 0.670 1.00 41.31 O ATOM 2544 CB THR A 157 12.702 -3.785 -0.809 1.00 22.41 C ATOM 2545 OG1 THR A 157 11.831 -3.199 0.150 1.00 43.14 O ATOM 2546 CG2 THR A 157 11.771 -4.287 -1.904 1.00 72.32 C ATOM 0 H THR A 157 12.614 -4.443 1.516 1.00 74.23 H new ATOM 0 HA THR A 157 13.405 -5.813 -0.858 1.00 10.42 H new ATOM 0 HB THR A 157 13.431 -3.057 -1.164 1.00 22.41 H new ATOM 0 HG1 THR A 157 12.037 -2.245 0.239 1.00 43.14 H new ATOM 0 HG21 THR A 157 11.169 -3.459 -2.278 1.00 72.32 H new ATOM 0 HG22 THR A 157 12.361 -4.704 -2.720 1.00 72.32 H new ATOM 0 HG23 THR A 157 11.115 -5.058 -1.499 1.00 72.32 H new ATOM 2554 N PRO A 158 15.710 -4.773 -1.506 1.00 25.12 N ATOM 2555 CA PRO A 158 17.151 -4.630 -1.630 1.00 62.22 C ATOM 2556 C PRO A 158 17.598 -3.176 -1.452 1.00 1.35 C ATOM 2557 O PRO A 158 18.764 -2.967 -1.117 1.00 54.54 O ATOM 2558 CB PRO A 158 17.498 -5.197 -3.009 1.00 52.42 C ATOM 2559 CG PRO A 158 16.234 -4.940 -3.820 1.00 41.42 C ATOM 2560 CD PRO A 158 15.110 -5.071 -2.798 1.00 1.52 C ATOM 0 HA PRO A 158 17.682 -5.169 -0.845 1.00 62.22 H new ATOM 0 HB2 PRO A 158 18.364 -4.697 -3.444 1.00 52.42 H new ATOM 0 HB3 PRO A 158 17.735 -6.260 -2.959 1.00 52.42 H new ATOM 0 HG2 PRO A 158 16.246 -3.950 -4.276 1.00 41.42 H new ATOM 0 HG3 PRO A 158 16.125 -5.662 -4.629 1.00 41.42 H new ATOM 0 HD2 PRO A 158 14.297 -4.379 -3.020 1.00 1.52 H new ATOM 0 HD3 PRO A 158 14.686 -6.075 -2.810 1.00 1.52 H new ATOM 2568 N HIS A 159 16.702 -2.187 -1.594 1.00 3.41 N ATOM 2569 CA HIS A 159 16.999 -0.784 -1.370 1.00 71.22 C ATOM 2570 C HIS A 159 17.048 -0.422 0.124 1.00 14.11 C ATOM 2571 O HIS A 159 17.272 0.746 0.430 1.00 4.52 O ATOM 2572 CB HIS A 159 15.985 0.082 -2.147 1.00 34.02 C ATOM 2573 CG HIS A 159 16.440 0.523 -3.519 1.00 23.30 C ATOM 2574 ND1 HIS A 159 17.676 1.048 -3.834 1.00 43.31 N ATOM 2575 CD2 HIS A 159 15.652 0.628 -4.633 1.00 64.44 C ATOM 2576 CE1 HIS A 159 17.633 1.470 -5.106 1.00 21.22 C ATOM 2577 NE2 HIS A 159 16.414 1.244 -5.637 1.00 63.31 N ATOM 0 H HIS A 159 15.735 -2.355 -1.873 1.00 3.41 H new ATOM 0 HA HIS A 159 18.000 -0.579 -1.748 1.00 71.22 H new ATOM 0 HB2 HIS A 159 15.056 -0.479 -2.252 1.00 34.02 H new ATOM 0 HB3 HIS A 159 15.757 0.968 -1.554 1.00 34.02 H new ATOM 0 HD1 HIS A 159 18.481 1.105 -3.210 1.00 43.31 H new ATOM 0 HD2 HIS A 159 14.628 0.296 -4.723 1.00 64.44 H new ATOM 0 HE1 HIS A 159 18.459 1.927 -5.632 1.00 21.22 H new ATOM 2585 N PHE A 160 16.845 -1.352 1.070 1.00 13.11 N ATOM 2586 CA PHE A 160 17.049 -1.056 2.493 1.00 71.45 C ATOM 2587 C PHE A 160 18.496 -1.295 2.897 1.00 5.24 C ATOM 2588 O PHE A 160 19.142 -0.346 3.327 1.00 54.31 O ATOM 2589 CB PHE A 160 16.014 -1.767 3.383 1.00 64.05 C ATOM 2590 CG PHE A 160 14.924 -0.809 3.842 1.00 44.51 C ATOM 2591 CD1 PHE A 160 14.287 0.027 2.905 1.00 25.44 C ATOM 2592 CD2 PHE A 160 14.580 -0.692 5.200 1.00 33.40 C ATOM 2593 CE1 PHE A 160 13.333 0.970 3.313 1.00 43.24 C ATOM 2594 CE2 PHE A 160 13.607 0.238 5.607 1.00 41.54 C ATOM 2595 CZ PHE A 160 12.983 1.072 4.665 1.00 10.42 C ATOM 0 H PHE A 160 16.542 -2.307 0.876 1.00 13.11 H new ATOM 0 HA PHE A 160 16.868 0.006 2.656 1.00 71.45 H new ATOM 0 HB2 PHE A 160 15.565 -2.594 2.832 1.00 64.05 H new ATOM 0 HB3 PHE A 160 16.513 -2.196 4.252 1.00 64.05 H new ATOM 0 HD1 PHE A 160 14.537 -0.059 1.858 1.00 25.44 H new ATOM 0 HD2 PHE A 160 15.065 -1.319 5.934 1.00 33.40 H new ATOM 0 HE1 PHE A 160 12.868 1.618 2.585 1.00 43.24 H new ATOM 0 HE2 PHE A 160 13.338 0.311 6.650 1.00 41.54 H new ATOM 0 HZ PHE A 160 12.238 1.787 4.981 1.00 10.42 H new ATOM 2605 N LEU A 161 19.012 -2.511 2.687 1.00 3.15 N ATOM 2606 CA LEU A 161 20.275 -3.060 3.220 1.00 63.34 C ATOM 2607 C LEU A 161 21.525 -2.291 2.770 1.00 1.35 C ATOM 2608 O LEU A 161 22.649 -2.592 3.168 1.00 45.23 O ATOM 2609 CB LEU A 161 20.398 -4.524 2.765 1.00 64.22 C ATOM 2610 CG LEU A 161 19.330 -5.444 3.397 1.00 30.01 C ATOM 2611 CD1 LEU A 161 18.532 -6.160 2.304 1.00 73.23 C ATOM 2612 CD2 LEU A 161 19.977 -6.470 4.325 1.00 63.13 C ATOM 0 H LEU A 161 18.528 -3.190 2.099 1.00 3.15 H new ATOM 0 HA LEU A 161 20.230 -2.970 4.305 1.00 63.34 H new ATOM 0 HB2 LEU A 161 20.313 -4.570 1.679 1.00 64.22 H new ATOM 0 HB3 LEU A 161 21.389 -4.897 3.023 1.00 64.22 H new ATOM 0 HG LEU A 161 18.653 -4.824 3.985 1.00 30.01 H new ATOM 0 HD11 LEU A 161 17.783 -6.805 2.764 1.00 73.23 H new ATOM 0 HD12 LEU A 161 18.037 -5.422 1.672 1.00 73.23 H new ATOM 0 HD13 LEU A 161 19.207 -6.763 1.697 1.00 73.23 H new ATOM 0 HD21 LEU A 161 19.205 -7.106 4.758 1.00 63.13 H new ATOM 0 HD22 LEU A 161 20.677 -7.083 3.758 1.00 63.13 H new ATOM 0 HD23 LEU A 161 20.511 -5.953 5.122 1.00 63.13 H new ATOM 2624 N GLU A 162 21.337 -1.330 1.882 1.00 45.22 N ATOM 2625 CA GLU A 162 22.336 -0.404 1.371 1.00 22.31 C ATOM 2626 C GLU A 162 22.652 0.728 2.366 1.00 42.52 C ATOM 2627 O GLU A 162 23.556 1.525 2.104 1.00 54.11 O ATOM 2628 CB GLU A 162 21.819 0.207 0.061 1.00 42.42 C ATOM 2629 CG GLU A 162 21.000 -0.741 -0.818 1.00 3.43 C ATOM 2630 CD GLU A 162 20.719 -0.134 -2.193 1.00 50.55 C ATOM 2631 OE1 GLU A 162 19.955 0.856 -2.254 1.00 25.21 O ATOM 2632 OE2 GLU A 162 21.279 -0.606 -3.211 1.00 13.13 O ATOM 0 H GLU A 162 20.419 -1.164 1.470 1.00 45.22 H new ATOM 0 HA GLU A 162 23.257 -0.963 1.209 1.00 22.31 H new ATOM 0 HB2 GLU A 162 21.206 1.076 0.300 1.00 42.42 H new ATOM 0 HB3 GLU A 162 22.671 0.567 -0.515 1.00 42.42 H new ATOM 0 HG2 GLU A 162 21.537 -1.682 -0.938 1.00 3.43 H new ATOM 0 HG3 GLU A 162 20.057 -0.973 -0.323 1.00 3.43 H new ATOM 2639 N ASN A 163 21.893 0.857 3.455 1.00 23.14 N ATOM 2640 CA ASN A 163 22.109 1.808 4.554 1.00 53.55 C ATOM 2641 C ASN A 163 21.727 1.108 5.857 1.00 43.54 C ATOM 2642 O ASN A 163 20.633 0.553 5.950 1.00 13.23 O ATOM 2643 CB ASN A 163 21.212 3.056 4.410 1.00 63.05 C ATOM 2644 CG ASN A 163 21.912 4.337 3.972 1.00 60.43 C ATOM 2645 OD1 ASN A 163 21.735 4.812 2.855 1.00 52.54 O ATOM 2646 ND2 ASN A 163 22.656 4.990 4.849 1.00 4.51 N ATOM 0 H ASN A 163 21.070 0.274 3.605 1.00 23.14 H new ATOM 0 HA ASN A 163 23.152 2.125 4.542 1.00 53.55 H new ATOM 0 HB2 ASN A 163 20.425 2.832 3.690 1.00 63.05 H new ATOM 0 HB3 ASN A 163 20.725 3.241 5.367 1.00 63.05 H new ATOM 0 HD21 ASN A 163 23.079 5.883 4.595 1.00 4.51 H new ATOM 0 HD22 ASN A 163 22.807 4.601 5.780 1.00 4.51 H new ATOM 2653 N GLU A 164 22.569 1.206 6.881 1.00 22.20 N ATOM 2654 CA GLU A 164 22.328 0.568 8.176 1.00 43.21 C ATOM 2655 C GLU A 164 21.189 1.276 8.910 1.00 50.32 C ATOM 2656 O GLU A 164 20.349 0.636 9.542 1.00 70.14 O ATOM 2657 CB GLU A 164 23.607 0.588 9.027 1.00 33.04 C ATOM 2658 CG GLU A 164 24.821 0.102 8.225 1.00 21.24 C ATOM 2659 CD GLU A 164 25.981 -0.344 9.109 1.00 13.54 C ATOM 2660 OE1 GLU A 164 26.458 0.484 9.913 1.00 1.13 O ATOM 2661 OE2 GLU A 164 26.428 -1.499 8.891 1.00 3.11 O ATOM 0 H GLU A 164 23.442 1.732 6.838 1.00 22.20 H new ATOM 0 HA GLU A 164 22.041 -0.470 8.006 1.00 43.21 H new ATOM 0 HB2 GLU A 164 23.789 1.600 9.389 1.00 33.04 H new ATOM 0 HB3 GLU A 164 23.472 -0.044 9.904 1.00 33.04 H new ATOM 0 HG2 GLU A 164 24.519 -0.728 7.586 1.00 21.24 H new ATOM 0 HG3 GLU A 164 25.160 0.903 7.568 1.00 21.24 H new ATOM 2668 N ASP A 165 21.110 2.598 8.751 1.00 31.12 N ATOM 2669 CA ASP A 165 20.080 3.447 9.331 1.00 55.31 C ATOM 2670 C ASP A 165 18.720 3.089 8.740 1.00 33.02 C ATOM 2671 O ASP A 165 17.693 3.211 9.411 1.00 2.11 O ATOM 2672 CB ASP A 165 20.388 4.918 9.027 1.00 35.12 C ATOM 2673 CG ASP A 165 21.573 5.459 9.817 1.00 23.31 C ATOM 2674 OD1 ASP A 165 22.707 5.020 9.524 1.00 24.00 O ATOM 2675 OD2 ASP A 165 21.369 6.365 10.656 1.00 43.15 O ATOM 0 H ASP A 165 21.787 3.121 8.195 1.00 31.12 H new ATOM 0 HA ASP A 165 20.061 3.292 10.410 1.00 55.31 H new ATOM 0 HB2 ASP A 165 20.590 5.028 7.961 1.00 35.12 H new ATOM 0 HB3 ASP A 165 19.507 5.520 9.248 1.00 35.12 H new ATOM 2680 N ARG A 166 18.679 2.610 7.489 1.00 13.32 N ATOM 2681 CA ARG A 166 17.425 2.105 6.947 1.00 72.01 C ATOM 2682 C ARG A 166 17.048 0.773 7.571 1.00 51.21 C ATOM 2683 O ARG A 166 15.855 0.538 7.765 1.00 50.23 O ATOM 2684 CB ARG A 166 17.437 1.937 5.426 1.00 62.23 C ATOM 2685 CG ARG A 166 17.550 3.263 4.678 1.00 61.03 C ATOM 2686 CD ARG A 166 17.264 3.042 3.194 1.00 14.44 C ATOM 2687 NE ARG A 166 18.008 3.989 2.346 1.00 15.52 N ATOM 2688 CZ ARG A 166 18.907 3.668 1.407 1.00 32.14 C ATOM 2689 NH1 ARG A 166 19.324 2.419 1.260 1.00 4.42 N ATOM 2690 NH2 ARG A 166 19.415 4.579 0.596 1.00 53.21 N ATOM 0 H ARG A 166 19.477 2.564 6.855 1.00 13.32 H new ATOM 0 HA ARG A 166 16.687 2.867 7.198 1.00 72.01 H new ATOM 0 HB2 ARG A 166 18.272 1.295 5.144 1.00 62.23 H new ATOM 0 HB3 ARG A 166 16.525 1.428 5.115 1.00 62.23 H new ATOM 0 HG2 ARG A 166 16.846 3.986 5.090 1.00 61.03 H new ATOM 0 HG3 ARG A 166 18.548 3.681 4.808 1.00 61.03 H new ATOM 0 HD2 ARG A 166 17.532 2.021 2.920 1.00 14.44 H new ATOM 0 HD3 ARG A 166 16.195 3.151 3.010 1.00 14.44 H new ATOM 0 HE ARG A 166 17.821 4.982 2.487 1.00 15.52 H new ATOM 0 HH11 ARG A 166 18.960 1.685 1.867 1.00 4.42 H new ATOM 0 HH12 ARG A 166 20.009 2.192 0.540 1.00 4.42 H new ATOM 0 HH21 ARG A 166 19.124 5.553 0.677 1.00 53.21 H new ATOM 0 HH22 ARG A 166 20.099 4.308 -0.111 1.00 53.21 H new ATOM 2704 N MET A 167 18.023 -0.095 7.846 1.00 42.51 N ATOM 2705 CA MET A 167 17.751 -1.396 8.436 1.00 1.44 C ATOM 2706 C MET A 167 17.152 -1.188 9.818 1.00 34.44 C ATOM 2707 O MET A 167 16.169 -1.848 10.140 1.00 71.33 O ATOM 2708 CB MET A 167 19.016 -2.261 8.500 1.00 41.42 C ATOM 2709 CG MET A 167 19.357 -2.888 7.145 1.00 3.32 C ATOM 2710 SD MET A 167 19.064 -4.677 7.055 1.00 41.50 S ATOM 2711 CE MET A 167 17.284 -4.767 7.353 1.00 34.41 C ATOM 0 H MET A 167 19.011 0.086 7.667 1.00 42.51 H new ATOM 0 HA MET A 167 17.040 -1.934 7.809 1.00 1.44 H new ATOM 0 HB2 MET A 167 19.854 -1.651 8.838 1.00 41.42 H new ATOM 0 HB3 MET A 167 18.878 -3.050 9.239 1.00 41.42 H new ATOM 0 HG2 MET A 167 18.768 -2.396 6.371 1.00 3.32 H new ATOM 0 HG3 MET A 167 20.405 -2.692 6.920 1.00 3.32 H new ATOM 0 HE1 MET A 167 16.960 -5.807 7.309 1.00 34.41 H new ATOM 0 HE2 MET A 167 17.059 -4.358 8.338 1.00 34.41 H new ATOM 0 HE3 MET A 167 16.758 -4.190 6.592 1.00 34.41 H new ATOM 2721 N GLU A 168 17.673 -0.226 10.581 1.00 61.05 N ATOM 2722 CA GLU A 168 17.129 0.198 11.861 1.00 70.04 C ATOM 2723 C GLU A 168 15.642 0.506 11.747 1.00 33.44 C ATOM 2724 O GLU A 168 14.849 -0.078 12.479 1.00 64.23 O ATOM 2725 CB GLU A 168 17.854 1.453 12.333 1.00 3.14 C ATOM 2726 CG GLU A 168 19.242 1.173 12.907 1.00 24.41 C ATOM 2727 CD GLU A 168 19.201 1.235 14.439 1.00 1.43 C ATOM 2728 OE1 GLU A 168 18.698 2.239 15.004 1.00 42.25 O ATOM 2729 OE2 GLU A 168 19.544 0.220 15.086 1.00 44.32 O ATOM 0 H GLU A 168 18.510 0.292 10.313 1.00 61.05 H new ATOM 0 HA GLU A 168 17.269 -0.614 12.575 1.00 70.04 H new ATOM 0 HB2 GLU A 168 17.948 2.145 11.497 1.00 3.14 H new ATOM 0 HB3 GLU A 168 17.249 1.950 13.091 1.00 3.14 H new ATOM 0 HG2 GLU A 168 19.586 0.190 12.584 1.00 24.41 H new ATOM 0 HG3 GLU A 168 19.956 1.902 12.525 1.00 24.41 H new ATOM 2736 N LEU A 169 15.244 1.393 10.828 1.00 33.11 N ATOM 2737 CA LEU A 169 13.837 1.760 10.669 1.00 30.41 C ATOM 2738 C LEU A 169 12.982 0.518 10.466 1.00 31.04 C ATOM 2739 O LEU A 169 11.925 0.399 11.082 1.00 30.14 O ATOM 2740 CB LEU A 169 13.669 2.724 9.491 1.00 73.33 C ATOM 2741 CG LEU A 169 12.196 3.114 9.220 1.00 31.11 C ATOM 2742 CD1 LEU A 169 12.177 4.511 8.599 1.00 32.03 C ATOM 2743 CD2 LEU A 169 11.457 2.200 8.228 1.00 33.33 C ATOM 0 H LEU A 169 15.877 1.868 10.185 1.00 33.11 H new ATOM 0 HA LEU A 169 13.505 2.261 11.578 1.00 30.41 H new ATOM 0 HB2 LEU A 169 14.246 3.628 9.686 1.00 73.33 H new ATOM 0 HB3 LEU A 169 14.087 2.266 8.594 1.00 73.33 H new ATOM 0 HG LEU A 169 11.691 3.040 10.183 1.00 31.11 H new ATOM 0 HD11 LEU A 169 11.147 4.806 8.399 1.00 32.03 H new ATOM 0 HD12 LEU A 169 12.631 5.222 9.289 1.00 32.03 H new ATOM 0 HD13 LEU A 169 12.739 4.502 7.665 1.00 32.03 H new ATOM 0 HD21 LEU A 169 10.433 2.552 8.102 1.00 33.33 H new ATOM 0 HD22 LEU A 169 11.968 2.219 7.265 1.00 33.33 H new ATOM 0 HD23 LEU A 169 11.445 1.180 8.612 1.00 33.33 H new ATOM 2755 N TYR A 170 13.417 -0.378 9.576 1.00 31.04 N ATOM 2756 CA TYR A 170 12.681 -1.602 9.302 1.00 14.31 C ATOM 2757 C TYR A 170 12.562 -2.430 10.582 1.00 2.53 C ATOM 2758 O TYR A 170 11.470 -2.880 10.891 1.00 52.32 O ATOM 2759 CB TYR A 170 13.333 -2.388 8.158 1.00 22.11 C ATOM 2760 CG TYR A 170 12.806 -3.789 7.894 1.00 3.30 C ATOM 2761 CD1 TYR A 170 11.442 -4.020 7.637 1.00 34.10 C ATOM 2762 CD2 TYR A 170 13.707 -4.865 7.844 1.00 64.44 C ATOM 2763 CE1 TYR A 170 10.991 -5.314 7.314 1.00 3.33 C ATOM 2764 CE2 TYR A 170 13.268 -6.153 7.497 1.00 24.01 C ATOM 2765 CZ TYR A 170 11.905 -6.387 7.225 1.00 30.04 C ATOM 2766 OH TYR A 170 11.474 -7.647 6.932 1.00 31.11 O ATOM 0 H TYR A 170 14.276 -0.273 9.036 1.00 31.04 H new ATOM 0 HA TYR A 170 11.673 -1.351 8.972 1.00 14.31 H new ATOM 0 HB2 TYR A 170 13.223 -1.807 7.242 1.00 22.11 H new ATOM 0 HB3 TYR A 170 14.401 -2.461 8.363 1.00 22.11 H new ATOM 0 HD1 TYR A 170 10.739 -3.202 7.688 1.00 34.10 H new ATOM 0 HD2 TYR A 170 14.749 -4.700 8.075 1.00 64.44 H new ATOM 0 HE1 TYR A 170 9.940 -5.487 7.133 1.00 3.33 H new ATOM 0 HE2 TYR A 170 13.976 -6.966 7.438 1.00 24.01 H new ATOM 0 HH TYR A 170 12.172 -8.294 7.166 1.00 31.11 H new ATOM 2776 N GLN A 171 13.644 -2.603 11.343 1.00 33.12 N ATOM 2777 CA GLN A 171 13.694 -3.396 12.571 1.00 4.31 C ATOM 2778 C GLN A 171 12.758 -2.822 13.639 1.00 70.41 C ATOM 2779 O GLN A 171 11.916 -3.521 14.213 1.00 41.13 O ATOM 2780 CB GLN A 171 15.134 -3.399 13.099 1.00 41.25 C ATOM 2781 CG GLN A 171 16.071 -4.146 12.145 1.00 25.41 C ATOM 2782 CD GLN A 171 16.416 -5.560 12.599 1.00 70.41 C ATOM 2783 OE1 GLN A 171 15.757 -6.169 13.441 1.00 54.54 O ATOM 2784 NE2 GLN A 171 17.436 -6.137 12.001 1.00 5.15 N ATOM 0 H GLN A 171 14.542 -2.179 11.112 1.00 33.12 H new ATOM 0 HA GLN A 171 13.368 -4.412 12.347 1.00 4.31 H new ATOM 0 HB2 GLN A 171 15.480 -2.373 13.224 1.00 41.25 H new ATOM 0 HB3 GLN A 171 15.163 -3.868 14.083 1.00 41.25 H new ATOM 0 HG2 GLN A 171 15.607 -4.194 11.160 1.00 25.41 H new ATOM 0 HG3 GLN A 171 16.993 -3.575 12.036 1.00 25.41 H new ATOM 0 HE21 GLN A 171 17.976 -5.624 11.304 1.00 5.15 H new ATOM 0 HE22 GLN A 171 17.687 -7.098 12.234 1.00 5.15 H new ATOM 2793 N THR A 172 12.914 -1.536 13.922 1.00 10.23 N ATOM 2794 CA THR A 172 12.137 -0.824 14.926 1.00 3.21 C ATOM 2795 C THR A 172 10.661 -0.728 14.496 1.00 12.32 C ATOM 2796 O THR A 172 9.765 -0.684 15.345 1.00 2.23 O ATOM 2797 CB THR A 172 12.808 0.541 15.171 1.00 54.43 C ATOM 2798 OG1 THR A 172 14.202 0.366 15.378 1.00 33.43 O ATOM 2799 CG2 THR A 172 12.256 1.250 16.409 1.00 61.42 C ATOM 0 H THR A 172 13.599 -0.946 13.449 1.00 10.23 H new ATOM 0 HA THR A 172 12.124 -1.362 15.874 1.00 3.21 H new ATOM 0 HB THR A 172 12.603 1.146 14.288 1.00 54.43 H new ATOM 0 HG1 THR A 172 14.661 0.341 14.512 1.00 33.43 H new ATOM 0 HG21 THR A 172 12.762 2.207 16.536 1.00 61.42 H new ATOM 0 HG22 THR A 172 11.186 1.419 16.285 1.00 61.42 H new ATOM 0 HG23 THR A 172 12.425 0.630 17.289 1.00 61.42 H new ATOM 2807 N ARG A 173 10.366 -0.791 13.191 1.00 24.32 N ATOM 2808 CA ARG A 173 9.011 -0.868 12.650 1.00 12.51 C ATOM 2809 C ARG A 173 8.783 -2.238 12.000 1.00 31.44 C ATOM 2810 O ARG A 173 8.134 -2.340 10.957 1.00 72.05 O ATOM 2811 CB ARG A 173 8.752 0.355 11.743 1.00 31.44 C ATOM 2812 CG ARG A 173 7.255 0.698 11.676 1.00 5.10 C ATOM 2813 CD ARG A 173 7.017 2.060 11.011 1.00 41.25 C ATOM 2814 NE ARG A 173 5.602 2.268 10.651 1.00 70.51 N ATOM 2815 CZ ARG A 173 4.561 2.506 11.463 1.00 52.03 C ATOM 2816 NH1 ARG A 173 4.705 2.609 12.779 1.00 11.10 N ATOM 2817 NH2 ARG A 173 3.353 2.623 10.932 1.00 13.43 N ATOM 0 H ARG A 173 11.085 -0.790 12.467 1.00 24.32 H new ATOM 0 HA ARG A 173 8.260 -0.808 13.438 1.00 12.51 H new ATOM 0 HB2 ARG A 173 9.307 1.214 12.121 1.00 31.44 H new ATOM 0 HB3 ARG A 173 9.125 0.151 10.739 1.00 31.44 H new ATOM 0 HG2 ARG A 173 6.728 -0.077 11.119 1.00 5.10 H new ATOM 0 HG3 ARG A 173 6.838 0.706 12.683 1.00 5.10 H new ATOM 0 HD2 ARG A 173 7.338 2.853 11.687 1.00 41.25 H new ATOM 0 HD3 ARG A 173 7.633 2.137 10.115 1.00 41.25 H new ATOM 0 HE ARG A 173 5.387 2.225 9.655 1.00 70.51 H new ATOM 0 HH11 ARG A 173 5.628 2.507 13.201 1.00 11.10 H new ATOM 0 HH12 ARG A 173 3.892 2.791 13.368 1.00 11.10 H new ATOM 0 HH21 ARG A 173 3.228 2.532 9.924 1.00 13.43 H new ATOM 0 HH22 ARG A 173 2.548 2.804 11.531 1.00 13.43 H new ATOM 2831 N LEU A 174 9.287 -3.304 12.640 1.00 24.00 N ATOM 2832 CA LEU A 174 9.021 -4.700 12.288 1.00 13.33 C ATOM 2833 C LEU A 174 8.225 -5.350 13.402 1.00 2.53 C ATOM 2834 O LEU A 174 7.194 -5.963 13.149 1.00 13.22 O ATOM 2835 CB LEU A 174 10.313 -5.530 12.105 1.00 23.20 C ATOM 2836 CG LEU A 174 10.637 -6.000 10.686 1.00 62.02 C ATOM 2837 CD1 LEU A 174 11.854 -6.934 10.770 1.00 72.30 C ATOM 2838 CD2 LEU A 174 9.459 -6.716 10.022 1.00 13.12 C ATOM 0 H LEU A 174 9.910 -3.211 13.442 1.00 24.00 H new ATOM 0 HA LEU A 174 8.478 -4.687 11.343 1.00 13.33 H new ATOM 0 HB2 LEU A 174 11.152 -4.935 12.466 1.00 23.20 H new ATOM 0 HB3 LEU A 174 10.246 -6.409 12.747 1.00 23.20 H new ATOM 0 HG LEU A 174 10.852 -5.130 10.065 1.00 62.02 H new ATOM 0 HD11 LEU A 174 12.111 -7.287 9.771 1.00 72.30 H new ATOM 0 HD12 LEU A 174 12.700 -6.392 11.192 1.00 72.30 H new ATOM 0 HD13 LEU A 174 11.615 -7.786 11.406 1.00 72.30 H new ATOM 0 HD21 LEU A 174 9.743 -7.029 9.017 1.00 13.12 H new ATOM 0 HD22 LEU A 174 9.187 -7.592 10.611 1.00 13.12 H new ATOM 0 HD23 LEU A 174 8.607 -6.038 9.964 1.00 13.12 H new ATOM 2850 N SER A 175 8.722 -5.272 14.635 1.00 14.51 N ATOM 2851 CA SER A 175 8.086 -5.916 15.772 1.00 30.41 C ATOM 2852 C SER A 175 6.740 -5.251 16.054 1.00 14.40 C ATOM 2853 O SER A 175 5.696 -5.897 16.058 1.00 53.41 O ATOM 2854 CB SER A 175 9.037 -5.906 16.980 1.00 2.32 C ATOM 2855 OG SER A 175 9.983 -4.848 16.916 1.00 4.44 O ATOM 0 H SER A 175 9.574 -4.762 14.869 1.00 14.51 H new ATOM 0 HA SER A 175 7.879 -6.963 15.550 1.00 30.41 H new ATOM 0 HB2 SER A 175 8.455 -5.814 17.897 1.00 2.32 H new ATOM 0 HB3 SER A 175 9.564 -6.859 17.032 1.00 2.32 H new ATOM 0 HG SER A 175 10.564 -4.881 17.704 1.00 4.44 H new ATOM 2861 N LYS A 176 6.724 -3.924 16.190 1.00 73.44 N ATOM 2862 CA LYS A 176 5.518 -3.152 16.482 1.00 54.14 C ATOM 2863 C LYS A 176 4.613 -2.987 15.251 1.00 71.12 C ATOM 2864 O LYS A 176 3.806 -2.059 15.226 1.00 44.24 O ATOM 2865 CB LYS A 176 5.917 -1.803 17.116 1.00 52.12 C ATOM 2866 CG LYS A 176 6.713 -1.881 18.436 1.00 53.51 C ATOM 2867 CD LYS A 176 5.991 -2.594 19.597 1.00 30.12 C ATOM 2868 CE LYS A 176 6.221 -4.115 19.597 1.00 41.25 C ATOM 2869 NZ LYS A 176 5.299 -4.842 20.495 1.00 73.12 N ATOM 0 H LYS A 176 7.561 -3.348 16.099 1.00 73.44 H new ATOM 0 HA LYS A 176 4.914 -3.705 17.202 1.00 54.14 H new ATOM 0 HB2 LYS A 176 6.509 -1.245 16.391 1.00 52.12 H new ATOM 0 HB3 LYS A 176 5.009 -1.227 17.296 1.00 52.12 H new ATOM 0 HG2 LYS A 176 7.654 -2.396 18.244 1.00 53.51 H new ATOM 0 HG3 LYS A 176 6.962 -0.868 18.752 1.00 53.51 H new ATOM 0 HD2 LYS A 176 6.337 -2.179 20.544 1.00 30.12 H new ATOM 0 HD3 LYS A 176 4.922 -2.393 19.532 1.00 30.12 H new ATOM 0 HE2 LYS A 176 6.104 -4.494 18.582 1.00 41.25 H new ATOM 0 HE3 LYS A 176 7.248 -4.321 19.897 1.00 41.25 H new ATOM 0 HZ1 LYS A 176 5.503 -5.861 20.451 1.00 73.12 H new ATOM 0 HZ2 LYS A 176 5.427 -4.505 21.470 1.00 73.12 H new ATOM 0 HZ3 LYS A 176 4.317 -4.673 20.196 1.00 73.12 H new ATOM 2883 N LYS A 177 4.739 -3.823 14.211 1.00 44.12 N ATOM 2884 CA LYS A 177 3.819 -3.799 13.073 1.00 42.22 C ATOM 2885 C LYS A 177 2.591 -4.682 13.274 1.00 3.33 C ATOM 2886 O LYS A 177 1.676 -4.588 12.454 1.00 25.33 O ATOM 2887 CB LYS A 177 4.530 -4.237 11.786 1.00 32.50 C ATOM 2888 CG LYS A 177 5.163 -3.077 11.026 1.00 32.33 C ATOM 2889 CD LYS A 177 4.105 -2.211 10.338 1.00 43.03 C ATOM 2890 CE LYS A 177 4.795 -1.363 9.272 1.00 34.44 C ATOM 2891 NZ LYS A 177 3.880 -0.376 8.664 1.00 72.35 N ATOM 0 H LYS A 177 5.474 -4.526 14.138 1.00 44.12 H new ATOM 0 HA LYS A 177 3.482 -2.766 12.990 1.00 42.22 H new ATOM 0 HB2 LYS A 177 5.302 -4.965 12.035 1.00 32.50 H new ATOM 0 HB3 LYS A 177 3.814 -4.741 11.137 1.00 32.50 H new ATOM 0 HG2 LYS A 177 5.744 -2.464 11.715 1.00 32.33 H new ATOM 0 HG3 LYS A 177 5.857 -3.465 10.281 1.00 32.33 H new ATOM 0 HD2 LYS A 177 3.337 -2.838 9.885 1.00 43.03 H new ATOM 0 HD3 LYS A 177 3.606 -1.572 11.066 1.00 43.03 H new ATOM 0 HE2 LYS A 177 5.643 -0.843 9.717 1.00 34.44 H new ATOM 0 HE3 LYS A 177 5.193 -2.014 8.494 1.00 34.44 H new ATOM 0 HZ1 LYS A 177 4.392 0.176 7.947 1.00 72.35 H new ATOM 0 HZ2 LYS A 177 3.083 -0.872 8.216 1.00 72.35 H new ATOM 0 HZ3 LYS A 177 3.520 0.263 9.401 1.00 72.35 H new ATOM 2905 N ASN A 178 2.566 -5.531 14.310 1.00 1.41 N ATOM 2906 CA ASN A 178 1.562 -6.567 14.538 1.00 33.32 C ATOM 2907 C ASN A 178 1.249 -7.412 13.286 1.00 1.13 C ATOM 2908 O ASN A 178 0.110 -7.857 13.118 1.00 10.23 O ATOM 2909 CB ASN A 178 0.319 -5.984 15.244 1.00 31.54 C ATOM 2910 CG ASN A 178 -0.475 -4.969 14.424 1.00 23.32 C ATOM 2911 OD1 ASN A 178 -0.408 -3.765 14.668 1.00 23.43 O ATOM 2912 ND2 ASN A 178 -1.228 -5.401 13.431 1.00 34.41 N ATOM 0 H ASN A 178 3.277 -5.510 15.041 1.00 1.41 H new ATOM 0 HA ASN A 178 1.994 -7.294 15.226 1.00 33.32 H new ATOM 0 HB2 ASN A 178 -0.343 -6.805 15.517 1.00 31.54 H new ATOM 0 HB3 ASN A 178 0.637 -5.509 16.172 1.00 31.54 H new ATOM 0 HD21 ASN A 178 -1.755 -4.737 12.865 1.00 34.41 H new ATOM 0 HD22 ASN A 178 -1.283 -6.399 13.230 1.00 34.41 H new ATOM 2919 N TRP A 179 2.238 -7.678 12.418 1.00 4.43 N ATOM 2920 CA TRP A 179 2.073 -8.498 11.228 1.00 54.03 C ATOM 2921 C TRP A 179 1.562 -9.882 11.593 1.00 71.44 C ATOM 2922 O TRP A 179 0.467 -10.298 11.216 1.00 72.13 O ATOM 2923 CB TRP A 179 3.408 -8.621 10.475 1.00 33.22 C ATOM 2924 CG TRP A 179 3.922 -7.421 9.762 1.00 54.02 C ATOM 2925 CD1 TRP A 179 5.177 -6.923 9.794 1.00 13.23 C ATOM 2926 CD2 TRP A 179 3.182 -6.567 8.860 1.00 53.12 C ATOM 2927 NE1 TRP A 179 5.241 -5.823 8.959 1.00 63.24 N ATOM 2928 CE2 TRP A 179 4.016 -5.512 8.418 1.00 41.43 C ATOM 2929 CE3 TRP A 179 1.868 -6.599 8.384 1.00 30.12 C ATOM 2930 CZ2 TRP A 179 3.533 -4.468 7.616 1.00 63.22 C ATOM 2931 CZ3 TRP A 179 1.351 -5.550 7.609 1.00 64.12 C ATOM 2932 CH2 TRP A 179 2.173 -4.463 7.265 1.00 33.53 C ATOM 0 H TRP A 179 3.186 -7.319 12.534 1.00 4.43 H new ATOM 0 HA TRP A 179 1.340 -8.013 10.583 1.00 54.03 H new ATOM 0 HB2 TRP A 179 4.167 -8.934 11.191 1.00 33.22 H new ATOM 0 HB3 TRP A 179 3.307 -9.425 9.746 1.00 33.22 H new ATOM 0 HD1 TRP A 179 5.996 -7.319 10.376 1.00 13.23 H new ATOM 0 HE1 TRP A 179 6.097 -5.303 8.767 1.00 63.24 H new ATOM 0 HE3 TRP A 179 1.240 -7.446 8.617 1.00 30.12 H new ATOM 0 HZ2 TRP A 179 4.193 -3.684 7.275 1.00 63.22 H new ATOM 0 HZ3 TRP A 179 0.324 -5.578 7.277 1.00 64.12 H new ATOM 0 HH2 TRP A 179 1.758 -3.622 6.730 1.00 33.53 H new ATOM 2943 N GLN A 180 2.406 -10.613 12.306 1.00 25.31 N ATOM 2944 CA GLN A 180 2.256 -12.037 12.524 1.00 64.14 C ATOM 2945 C GLN A 180 1.054 -12.358 13.422 1.00 53.02 C ATOM 2946 O GLN A 180 0.574 -13.488 13.406 1.00 54.44 O ATOM 2947 CB GLN A 180 3.607 -12.530 13.058 1.00 61.34 C ATOM 2948 CG GLN A 180 3.896 -12.109 14.502 1.00 74.32 C ATOM 2949 CD GLN A 180 3.469 -13.150 15.537 1.00 52.02 C ATOM 2950 OE1 GLN A 180 3.528 -14.353 15.306 1.00 14.01 O ATOM 2951 NE2 GLN A 180 3.069 -12.722 16.715 1.00 44.12 N ATOM 0 H GLN A 180 3.232 -10.220 12.758 1.00 25.31 H new ATOM 0 HA GLN A 180 2.020 -12.570 11.603 1.00 64.14 H new ATOM 0 HB2 GLN A 180 3.636 -13.618 12.995 1.00 61.34 H new ATOM 0 HB3 GLN A 180 4.401 -12.152 12.414 1.00 61.34 H new ATOM 0 HG2 GLN A 180 4.964 -11.918 14.610 1.00 74.32 H new ATOM 0 HG3 GLN A 180 3.382 -11.170 14.708 1.00 74.32 H new ATOM 0 HE21 GLN A 180 3.021 -11.721 16.905 1.00 44.12 H new ATOM 0 HE22 GLN A 180 2.807 -13.391 17.439 1.00 44.12 H new ATOM 2960 N GLU A 181 0.552 -11.355 14.154 1.00 4.13 N ATOM 2961 CA GLU A 181 -0.637 -11.437 14.989 1.00 31.54 C ATOM 2962 C GLU A 181 -1.938 -11.455 14.182 1.00 5.03 C ATOM 2963 O GLU A 181 -2.979 -11.845 14.712 1.00 74.54 O ATOM 2964 CB GLU A 181 -0.751 -10.181 15.856 1.00 1.04 C ATOM 2965 CG GLU A 181 0.349 -9.954 16.893 1.00 64.33 C ATOM 2966 CD GLU A 181 0.011 -8.781 17.825 1.00 1.44 C ATOM 2967 OE1 GLU A 181 -1.098 -8.201 17.712 1.00 14.04 O ATOM 2968 OE2 GLU A 181 0.831 -8.500 18.726 1.00 1.31 O ATOM 0 H GLU A 181 0.985 -10.432 14.177 1.00 4.13 H new ATOM 0 HA GLU A 181 -0.523 -12.359 15.559 1.00 31.54 H new ATOM 0 HB2 GLU A 181 -0.779 -9.314 15.196 1.00 1.04 H new ATOM 0 HB3 GLU A 181 -1.707 -10.215 16.378 1.00 1.04 H new ATOM 0 HG2 GLU A 181 0.487 -10.860 17.483 1.00 64.33 H new ATOM 0 HG3 GLU A 181 1.293 -9.757 16.386 1.00 64.33 H new ATOM 2975 N LYS A 182 -1.935 -10.888 12.973 1.00 3.12 N ATOM 2976 CA LYS A 182 -3.140 -10.667 12.181 1.00 11.14 C ATOM 2977 C LYS A 182 -3.310 -11.685 11.083 1.00 70.35 C ATOM 2978 O LYS A 182 -4.432 -11.920 10.656 1.00 71.12 O ATOM 2979 CB LYS A 182 -3.055 -9.306 11.509 1.00 42.42 C ATOM 2980 CG LYS A 182 -3.647 -8.226 12.399 1.00 50.21 C ATOM 2981 CD LYS A 182 -3.755 -6.944 11.580 1.00 11.12 C ATOM 2982 CE LYS A 182 -4.871 -7.087 10.533 1.00 3.04 C ATOM 2983 NZ LYS A 182 -5.250 -5.790 9.957 1.00 42.31 N ATOM 0 H LYS A 182 -1.083 -10.567 12.514 1.00 3.12 H new ATOM 0 HA LYS A 182 -3.982 -10.742 12.869 1.00 11.14 H new ATOM 0 HB2 LYS A 182 -2.014 -9.070 11.286 1.00 42.42 H new ATOM 0 HB3 LYS A 182 -3.587 -9.331 10.558 1.00 42.42 H new ATOM 0 HG2 LYS A 182 -4.629 -8.529 12.763 1.00 50.21 H new ATOM 0 HG3 LYS A 182 -3.017 -8.067 13.274 1.00 50.21 H new ATOM 0 HD2 LYS A 182 -3.965 -6.099 12.236 1.00 11.12 H new ATOM 0 HD3 LYS A 182 -2.806 -6.736 11.087 1.00 11.12 H new ATOM 0 HE2 LYS A 182 -4.540 -7.755 9.738 1.00 3.04 H new ATOM 0 HE3 LYS A 182 -5.744 -7.549 10.994 1.00 3.04 H new ATOM 0 HZ1 LYS A 182 -6.005 -5.929 9.256 1.00 42.31 H new ATOM 0 HZ2 LYS A 182 -5.590 -5.161 10.712 1.00 42.31 H new ATOM 0 HZ3 LYS A 182 -4.423 -5.360 9.495 1.00 42.31 H new ATOM 2997 N TRP A 183 -2.212 -12.210 10.568 1.00 25.12 N ATOM 2998 CA TRP A 183 -2.239 -13.297 9.611 1.00 10.23 C ATOM 2999 C TRP A 183 -1.270 -14.324 10.164 1.00 65.42 C ATOM 3000 O TRP A 183 -0.068 -14.066 10.274 1.00 11.23 O ATOM 3001 CB TRP A 183 -1.933 -12.780 8.201 1.00 25.32 C ATOM 3002 CG TRP A 183 -2.706 -11.571 7.760 1.00 43.14 C ATOM 3003 CD1 TRP A 183 -3.889 -11.609 7.117 1.00 32.41 C ATOM 3004 CD2 TRP A 183 -2.416 -10.148 7.956 1.00 22.24 C ATOM 3005 NE1 TRP A 183 -4.331 -10.332 6.880 1.00 21.50 N ATOM 3006 CE2 TRP A 183 -3.469 -9.390 7.372 1.00 53.13 C ATOM 3007 CE3 TRP A 183 -1.399 -9.406 8.593 1.00 70.15 C ATOM 3008 CZ2 TRP A 183 -3.505 -7.990 7.380 1.00 10.23 C ATOM 3009 CZ3 TRP A 183 -1.459 -7.999 8.674 1.00 33.14 C ATOM 3010 CH2 TRP A 183 -2.495 -7.287 8.050 1.00 32.44 C ATOM 0 H TRP A 183 -1.273 -11.891 10.805 1.00 25.12 H new ATOM 0 HA TRP A 183 -3.216 -13.765 9.491 1.00 10.23 H new ATOM 0 HB2 TRP A 183 -0.870 -12.547 8.144 1.00 25.32 H new ATOM 0 HB3 TRP A 183 -2.122 -13.586 7.491 1.00 25.32 H new ATOM 0 HD1 TRP A 183 -4.411 -12.510 6.831 1.00 32.41 H new ATOM 0 HE1 TRP A 183 -5.200 -10.111 6.394 1.00 21.50 H new ATOM 0 HE3 TRP A 183 -0.558 -9.926 9.027 1.00 70.15 H new ATOM 0 HZ2 TRP A 183 -4.300 -7.460 6.877 1.00 10.23 H new ATOM 0 HZ3 TRP A 183 -0.699 -7.463 9.223 1.00 33.14 H new ATOM 0 HH2 TRP A 183 -2.514 -6.208 8.086 1.00 32.44 H new ATOM 3021 N LYS A 184 -1.791 -15.478 10.591 1.00 10.41 N ATOM 3022 CA LYS A 184 -1.056 -16.450 11.403 1.00 14.32 C ATOM 3023 C LYS A 184 0.145 -17.015 10.667 1.00 21.51 C ATOM 3024 O LYS A 184 1.047 -17.570 11.294 1.00 64.40 O ATOM 3025 CB LYS A 184 -1.994 -17.575 11.858 1.00 61.33 C ATOM 3026 CG LYS A 184 -2.257 -18.638 10.780 1.00 74.43 C ATOM 3027 CD LYS A 184 -3.166 -19.773 11.256 1.00 51.41 C ATOM 3028 CE LYS A 184 -2.419 -20.689 12.230 1.00 43.43 C ATOM 3029 NZ LYS A 184 -3.272 -21.793 12.702 1.00 4.41 N ATOM 0 H LYS A 184 -2.746 -15.766 10.380 1.00 10.41 H new ATOM 0 HA LYS A 184 -0.675 -15.928 12.281 1.00 14.32 H new ATOM 0 HB2 LYS A 184 -1.566 -18.059 12.736 1.00 61.33 H new ATOM 0 HB3 LYS A 184 -2.945 -17.140 12.166 1.00 61.33 H new ATOM 0 HG2 LYS A 184 -2.710 -18.160 9.911 1.00 74.43 H new ATOM 0 HG3 LYS A 184 -1.305 -19.057 10.453 1.00 74.43 H new ATOM 0 HD2 LYS A 184 -4.049 -19.359 11.742 1.00 51.41 H new ATOM 0 HD3 LYS A 184 -3.515 -20.351 10.400 1.00 51.41 H new ATOM 0 HE2 LYS A 184 -1.534 -21.096 11.741 1.00 43.43 H new ATOM 0 HE3 LYS A 184 -2.072 -20.107 13.084 1.00 43.43 H new ATOM 0 HZ1 LYS A 184 -2.733 -22.392 13.359 1.00 4.41 H new ATOM 0 HZ2 LYS A 184 -4.104 -21.405 13.191 1.00 4.41 H new ATOM 0 HZ3 LYS A 184 -3.583 -22.363 11.890 1.00 4.41 H new ATOM 3043 N ASN A 185 0.124 -16.875 9.348 1.00 31.41 N ATOM 3044 CA ASN A 185 0.895 -17.639 8.387 1.00 72.34 C ATOM 3045 C ASN A 185 2.103 -16.840 7.872 1.00 61.21 C ATOM 3046 O ASN A 185 2.761 -17.270 6.925 1.00 53.04 O ATOM 3047 CB ASN A 185 -0.071 -18.084 7.266 1.00 5.44 C ATOM 3048 CG ASN A 185 0.055 -19.575 6.973 1.00 50.32 C ATOM 3049 OD1 ASN A 185 -0.260 -20.403 7.825 1.00 44.32 O ATOM 3050 ND2 ASN A 185 0.478 -19.964 5.787 1.00 34.24 N ATOM 0 H ASN A 185 -0.471 -16.180 8.897 1.00 31.41 H new ATOM 0 HA ASN A 185 1.328 -18.525 8.851 1.00 72.34 H new ATOM 0 HB2 ASN A 185 -1.096 -17.856 7.557 1.00 5.44 H new ATOM 0 HB3 ASN A 185 0.137 -17.516 6.359 1.00 5.44 H new ATOM 0 HD21 ASN A 185 0.546 -20.958 5.571 1.00 34.24 H new ATOM 0 HD22 ASN A 185 0.737 -19.271 5.085 1.00 34.24 H new ATOM 3057 N LEU A 186 2.390 -15.673 8.472 1.00 41.44 N ATOM 3058 CA LEU A 186 3.444 -14.745 8.091 1.00 2.44 C ATOM 3059 C LEU A 186 4.818 -15.381 8.217 1.00 51.41 C ATOM 3060 O LEU A 186 5.125 -16.036 9.213 1.00 2.35 O ATOM 3061 CB LEU A 186 3.410 -13.473 8.983 1.00 53.23 C ATOM 3062 CG LEU A 186 3.038 -12.164 8.260 1.00 64.14 C ATOM 3063 CD1 LEU A 186 3.797 -11.956 6.961 1.00 23.53 C ATOM 3064 CD2 LEU A 186 1.550 -12.098 7.989 1.00 73.12 C ATOM 0 H LEU A 186 1.859 -15.343 9.278 1.00 41.44 H new ATOM 0 HA LEU A 186 3.265 -14.476 7.050 1.00 2.44 H new ATOM 0 HB2 LEU A 186 2.697 -13.636 9.791 1.00 53.23 H new ATOM 0 HB3 LEU A 186 4.390 -13.347 9.443 1.00 53.23 H new ATOM 0 HG LEU A 186 3.328 -11.361 8.938 1.00 64.14 H new ATOM 0 HD11 LEU A 186 3.486 -11.016 6.505 1.00 23.53 H new ATOM 0 HD12 LEU A 186 4.867 -11.924 7.166 1.00 23.53 H new ATOM 0 HD13 LEU A 186 3.583 -12.779 6.279 1.00 23.53 H new ATOM 0 HD21 LEU A 186 1.314 -11.164 7.478 1.00 73.12 H new ATOM 0 HD22 LEU A 186 1.257 -12.939 7.361 1.00 73.12 H new ATOM 0 HD23 LEU A 186 1.006 -12.143 8.932 1.00 73.12 H new ATOM 3076 N ILE A 187 5.685 -15.071 7.267 1.00 63.30 N ATOM 3077 CA ILE A 187 7.124 -15.301 7.316 1.00 22.35 C ATOM 3078 C ILE A 187 7.797 -13.965 7.578 1.00 5.14 C ATOM 3079 O ILE A 187 7.395 -12.952 7.017 1.00 34.03 O ATOM 3080 CB ILE A 187 7.657 -15.926 6.004 1.00 61.13 C ATOM 3081 CG1 ILE A 187 6.741 -17.049 5.485 1.00 34.55 C ATOM 3082 CG2 ILE A 187 9.100 -16.412 6.195 1.00 5.51 C ATOM 3083 CD1 ILE A 187 7.294 -17.900 4.336 1.00 13.25 C ATOM 0 H ILE A 187 5.392 -14.630 6.396 1.00 63.30 H new ATOM 0 HA ILE A 187 7.348 -16.012 8.111 1.00 22.35 H new ATOM 0 HB ILE A 187 7.656 -15.151 5.238 1.00 61.13 H new ATOM 0 HG12 ILE A 187 6.505 -17.711 6.318 1.00 34.55 H new ATOM 0 HG13 ILE A 187 5.802 -16.601 5.158 1.00 34.55 H new ATOM 0 HG21 ILE A 187 9.463 -16.849 5.265 1.00 5.51 H new ATOM 0 HG22 ILE A 187 9.734 -15.570 6.471 1.00 5.51 H new ATOM 0 HG23 ILE A 187 9.130 -17.163 6.985 1.00 5.51 H new ATOM 0 HD11 ILE A 187 6.560 -18.656 4.057 1.00 13.25 H new ATOM 0 HD12 ILE A 187 7.501 -17.261 3.477 1.00 13.25 H new ATOM 0 HD13 ILE A 187 8.215 -18.388 4.655 1.00 13.25 H new ATOM 3095 N PHE A 188 8.830 -13.984 8.414 1.00 52.53 N ATOM 3096 CA PHE A 188 9.682 -12.863 8.775 1.00 5.43 C ATOM 3097 C PHE A 188 11.113 -13.208 8.394 1.00 52.33 C ATOM 3098 O PHE A 188 11.589 -14.291 8.747 1.00 12.21 O ATOM 3099 CB PHE A 188 9.621 -12.632 10.287 1.00 11.45 C ATOM 3100 CG PHE A 188 8.589 -11.627 10.742 1.00 34.15 C ATOM 3101 CD1 PHE A 188 7.240 -11.735 10.345 1.00 54.32 C ATOM 3102 CD2 PHE A 188 8.999 -10.586 11.594 1.00 52.53 C ATOM 3103 CE1 PHE A 188 6.297 -10.808 10.835 1.00 45.54 C ATOM 3104 CE2 PHE A 188 8.057 -9.678 12.097 1.00 5.14 C ATOM 3105 CZ PHE A 188 6.710 -9.801 11.729 1.00 5.35 C ATOM 0 H PHE A 188 9.111 -14.843 8.888 1.00 52.53 H new ATOM 0 HA PHE A 188 9.348 -11.964 8.257 1.00 5.43 H new ATOM 0 HB2 PHE A 188 9.418 -13.585 10.776 1.00 11.45 H new ATOM 0 HB3 PHE A 188 10.602 -12.301 10.628 1.00 11.45 H new ATOM 0 HD1 PHE A 188 6.932 -12.521 9.671 1.00 54.32 H new ATOM 0 HD2 PHE A 188 10.041 -10.486 11.861 1.00 52.53 H new ATOM 0 HE1 PHE A 188 5.264 -10.870 10.526 1.00 45.54 H new ATOM 0 HE2 PHE A 188 8.367 -8.888 12.765 1.00 5.14 H new ATOM 0 HZ PHE A 188 5.981 -9.116 12.136 1.00 5.35 H new ATOM 3115 N LYS A 189 11.798 -12.291 7.713 1.00 42.53 N ATOM 3116 CA LYS A 189 13.223 -12.400 7.388 1.00 10.31 C ATOM 3117 C LYS A 189 13.869 -11.012 7.441 1.00 62.02 C ATOM 3118 O LYS A 189 13.185 -9.978 7.396 1.00 32.13 O ATOM 3119 CB LYS A 189 13.441 -13.013 5.987 1.00 12.34 C ATOM 3120 CG LYS A 189 12.728 -14.338 5.654 1.00 74.13 C ATOM 3121 CD LYS A 189 13.502 -15.584 6.085 1.00 63.01 C ATOM 3122 CE LYS A 189 12.621 -16.828 5.909 1.00 2.42 C ATOM 3123 NZ LYS A 189 13.403 -18.073 6.023 1.00 22.33 N ATOM 0 H LYS A 189 11.371 -11.433 7.364 1.00 42.53 H new ATOM 0 HA LYS A 189 13.685 -13.059 8.123 1.00 10.31 H new ATOM 0 HB2 LYS A 189 13.132 -12.274 5.248 1.00 12.34 H new ATOM 0 HB3 LYS A 189 14.512 -13.168 5.854 1.00 12.34 H new ATOM 0 HG2 LYS A 189 11.751 -14.344 6.137 1.00 74.13 H new ATOM 0 HG3 LYS A 189 12.553 -14.385 4.579 1.00 74.13 H new ATOM 0 HD2 LYS A 189 14.410 -15.683 5.491 1.00 63.01 H new ATOM 0 HD3 LYS A 189 13.811 -15.490 7.126 1.00 63.01 H new ATOM 0 HE2 LYS A 189 11.832 -16.824 6.661 1.00 2.42 H new ATOM 0 HE3 LYS A 189 12.133 -16.793 4.935 1.00 2.42 H new ATOM 0 HZ1 LYS A 189 12.773 -18.891 5.898 1.00 22.33 H new ATOM 0 HZ2 LYS A 189 14.140 -18.088 5.289 1.00 22.33 H new ATOM 0 HZ3 LYS A 189 13.848 -18.119 6.962 1.00 22.33 H new ATOM 3137 N ASN A 190 15.199 -10.989 7.506 1.00 54.23 N ATOM 3138 CA ASN A 190 16.061 -9.804 7.505 1.00 14.31 C ATOM 3139 C ASN A 190 16.690 -9.518 6.139 1.00 23.02 C ATOM 3140 O ASN A 190 17.441 -8.560 5.997 1.00 23.34 O ATOM 3141 CB ASN A 190 17.220 -9.998 8.490 1.00 32.21 C ATOM 3142 CG ASN A 190 18.128 -11.150 8.078 1.00 53.44 C ATOM 3143 OD1 ASN A 190 17.709 -12.306 8.055 1.00 53.23 O ATOM 3144 ND2 ASN A 190 19.346 -10.864 7.660 1.00 11.13 N ATOM 0 H ASN A 190 15.740 -11.852 7.565 1.00 54.23 H new ATOM 0 HA ASN A 190 15.416 -8.970 7.783 1.00 14.31 H new ATOM 0 HB2 ASN A 190 17.803 -9.079 8.550 1.00 32.21 H new ATOM 0 HB3 ASN A 190 16.822 -10.188 9.487 1.00 32.21 H new ATOM 0 HD21 ASN A 190 19.953 -11.606 7.312 1.00 11.13 H new ATOM 0 HD22 ASN A 190 19.681 -9.901 7.685 1.00 11.13 H new ATOM 3151 N THR A 191 16.435 -10.364 5.151 1.00 31.42 N ATOM 3152 CA THR A 191 16.993 -10.375 3.810 1.00 5.53 C ATOM 3153 C THR A 191 16.147 -11.392 3.052 1.00 54.21 C ATOM 3154 O THR A 191 15.661 -12.349 3.702 1.00 14.53 O ATOM 3155 CB THR A 191 18.508 -10.673 3.882 1.00 44.44 C ATOM 3156 OG1 THR A 191 19.152 -10.469 2.640 1.00 72.30 O ATOM 3157 CG2 THR A 191 18.856 -12.042 4.465 1.00 22.05 C ATOM 0 H THR A 191 15.772 -11.128 5.282 1.00 31.42 H new ATOM 0 HA THR A 191 16.947 -9.423 3.282 1.00 5.53 H new ATOM 0 HB THR A 191 18.896 -9.943 4.592 1.00 44.44 H new ATOM 0 HG1 THR A 191 20.108 -10.667 2.731 1.00 72.30 H new ATOM 0 HG21 THR A 191 19.939 -12.167 4.478 1.00 22.05 H new ATOM 0 HG22 THR A 191 18.470 -12.113 5.482 1.00 22.05 H new ATOM 0 HG23 THR A 191 18.408 -12.823 3.851 1.00 22.05 H new TER 3165 THR A 191