USER MOD reduce.3.24.130724 H: found=0, std=0, add=887, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 887 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 95 LYS NZ :NH3+ -157:sc= 1.92 (180deg=0.575) USER MOD Set 1.2: A 97 THR OG1 : rot 180:sc= 0.854 USER MOD Set 2.1: A 6 ASN : amide:sc= 0.539 K(o=0.11,f=-0.48) USER MOD Set 2.2: A 84 SER OG : rot -70:sc= -0.432 USER MOD Set 3.1: A 3 MET CE :methyl -179:sc= -0.343 (180deg=-0.324) USER MOD Set 3.2: A 70 GLN : amide:sc= 0.822 K(o=0.48,f=-7.2!) USER MOD Set 4.1: A 26 SER OG : rot 98:sc= 2.3 USER MOD Set 4.2: A 75 TYR OH : rot -179:sc= 1.21 USER MOD Set 5.1: A 10 TYR OH : rot 6:sc= 1.27 USER MOD Set 5.2: A 12 ASN : amide:sc= 0.706 K(o=4.4,f=1.1!) USER MOD Set 5.3: A 51 GLN : amide:sc= 0.882 K(o=4.4,f=-2.4!) USER MOD Set 5.4: A 88 SER OG : rot -60:sc= 1.53 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 179:sc= 1.42 (180deg=1.41) USER MOD Single : A 7 GLN : amide:sc= 1.04 K(o=1,f=0) USER MOD Single : A 8 THR OG1 : rot 180:sc=-0.00493 USER MOD Single : A 13 ASN : amide:sc= 0.827 K(o=0.83,f=-0.53) USER MOD Single : A 15 ASN : amide:sc= 1.07 K(o=1.1,f=-7.3!) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot -112:sc= 0 USER MOD Single : A 33 GLN : amide:sc= 0.893 K(o=0.89,f=-0.25) USER MOD Single : A 36 GLN : amide:sc= 0.512 K(o=0.51,f=-0.22) USER MOD Single : A 44 LYS NZ :NH3+ 173:sc= 1.52 (180deg=1.46) USER MOD Single : A 45 THR OG1 : rot 70:sc= 0.0159 USER MOD Single : A 47 LYS NZ :NH3+ 160:sc= 1.2 (180deg=0.9) USER MOD Single : A 48 MET CE :methyl -161:sc= -0.103 (180deg=-0.438) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 63 SER OG : rot 85:sc= 1.25 USER MOD Single : A 64 ASN : amide:sc= 1.12 K(o=1.1,f=-0.054) USER MOD Single : A 68 THR OG1 : rot 67:sc= 1.22 USER MOD Single : A 69 MET CE :methyl 167:sc= -1.28 (180deg=-2.17) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 MET CE :methyl 157:sc= -0.398 (180deg=-1.66) USER MOD Single : A 80 GLN : amide:sc= 0 X(o=0,f=-0.22) USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 SER OG : rot 105:sc= 1.29 USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 LYS NZ :NH3+ -156:sc= 1.24 (180deg=1.15) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00552) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 5.212 -16.286 6.196 1.00 0.00 N ATOM 2 CA MET A 1 5.058 -15.264 5.135 1.00 0.00 C ATOM 3 C MET A 1 6.105 -15.535 4.060 1.00 0.00 C ATOM 4 O MET A 1 7.303 -15.335 4.285 1.00 0.00 O ATOM 5 CB MET A 1 5.169 -13.819 5.667 1.00 0.00 C ATOM 6 CG MET A 1 3.940 -13.349 6.462 1.00 0.00 C ATOM 7 SD MET A 1 3.670 -14.138 8.077 1.00 0.00 S ATOM 8 CE MET A 1 2.182 -13.244 8.604 1.00 0.00 C ATOM 0 H1 MET A 1 4.518 -16.111 6.950 1.00 0.00 H new ATOM 0 H2 MET A 1 5.054 -17.232 5.793 1.00 0.00 H new ATOM 0 H3 MET A 1 6.173 -16.234 6.591 1.00 0.00 H new ATOM 0 HA MET A 1 4.053 -15.344 4.720 1.00 0.00 H new ATOM 0 HB2 MET A 1 6.051 -13.744 6.303 1.00 0.00 H new ATOM 0 HB3 MET A 1 5.324 -13.144 4.825 1.00 0.00 H new ATOM 0 HG2 MET A 1 4.025 -12.273 6.617 1.00 0.00 H new ATOM 0 HG3 MET A 1 3.054 -13.514 5.849 1.00 0.00 H new ATOM 0 HE1 MET A 1 1.871 -13.602 9.585 1.00 0.00 H new ATOM 0 HE2 MET A 1 2.399 -12.177 8.659 1.00 0.00 H new ATOM 0 HE3 MET A 1 1.381 -13.415 7.885 1.00 0.00 H new ATOM 20 N GLU A 2 5.683 -16.046 2.901 1.00 0.00 N ATOM 21 CA GLU A 2 6.563 -16.530 1.846 1.00 0.00 C ATOM 22 C GLU A 2 5.799 -16.580 0.519 1.00 0.00 C ATOM 23 O GLU A 2 4.565 -16.564 0.510 1.00 0.00 O ATOM 24 CB GLU A 2 7.147 -17.914 2.220 1.00 0.00 C ATOM 25 CG GLU A 2 6.148 -19.084 2.332 1.00 0.00 C ATOM 26 CD GLU A 2 5.103 -18.943 3.458 1.00 0.00 C ATOM 27 OE1 GLU A 2 5.469 -18.630 4.615 1.00 0.00 O ATOM 28 OE2 GLU A 2 3.899 -19.168 3.198 1.00 0.00 O ATOM 0 H GLU A 2 4.694 -16.135 2.669 1.00 0.00 H new ATOM 0 HA GLU A 2 7.401 -15.843 1.731 1.00 0.00 H new ATOM 0 HB2 GLU A 2 7.897 -18.178 1.475 1.00 0.00 H new ATOM 0 HB3 GLU A 2 7.665 -17.817 3.174 1.00 0.00 H new ATOM 0 HG2 GLU A 2 5.624 -19.187 1.382 1.00 0.00 H new ATOM 0 HG3 GLU A 2 6.708 -20.006 2.489 1.00 0.00 H new ATOM 35 N MET A 3 6.544 -16.676 -0.585 1.00 0.00 N ATOM 36 CA MET A 3 6.032 -16.805 -1.946 1.00 0.00 C ATOM 37 C MET A 3 6.617 -18.102 -2.519 1.00 0.00 C ATOM 38 O MET A 3 7.710 -18.518 -2.122 1.00 0.00 O ATOM 39 CB MET A 3 6.442 -15.578 -2.786 1.00 0.00 C ATOM 40 CG MET A 3 5.550 -14.334 -2.612 1.00 0.00 C ATOM 41 SD MET A 3 5.369 -13.583 -0.961 1.00 0.00 S ATOM 42 CE MET A 3 7.081 -13.179 -0.522 1.00 0.00 C ATOM 0 H MET A 3 7.563 -16.665 -0.550 1.00 0.00 H new ATOM 0 HA MET A 3 4.943 -16.847 -1.961 1.00 0.00 H new ATOM 0 HB2 MET A 3 7.467 -15.309 -2.530 1.00 0.00 H new ATOM 0 HB3 MET A 3 6.440 -15.862 -3.838 1.00 0.00 H new ATOM 0 HG2 MET A 3 5.931 -13.563 -3.282 1.00 0.00 H new ATOM 0 HG3 MET A 3 4.552 -14.596 -2.963 1.00 0.00 H new ATOM 0 HE1 MET A 3 7.106 -12.732 0.472 1.00 0.00 H new ATOM 0 HE2 MET A 3 7.682 -14.088 -0.526 1.00 0.00 H new ATOM 0 HE3 MET A 3 7.486 -12.474 -1.248 1.00 0.00 H new ATOM 52 N LEU A 4 5.876 -18.760 -3.417 1.00 0.00 N ATOM 53 CA LEU A 4 6.202 -20.109 -3.886 1.00 0.00 C ATOM 54 C LEU A 4 7.554 -20.135 -4.619 1.00 0.00 C ATOM 55 O LEU A 4 7.781 -19.269 -5.469 1.00 0.00 O ATOM 56 CB LEU A 4 5.110 -20.648 -4.833 1.00 0.00 C ATOM 57 CG LEU A 4 3.688 -20.733 -4.243 1.00 0.00 C ATOM 58 CD1 LEU A 4 2.730 -21.300 -5.295 1.00 0.00 C ATOM 59 CD2 LEU A 4 3.625 -21.593 -2.975 1.00 0.00 C ATOM 0 H LEU A 4 5.033 -18.371 -3.839 1.00 0.00 H new ATOM 0 HA LEU A 4 6.261 -20.745 -3.003 1.00 0.00 H new ATOM 0 HB2 LEU A 4 5.078 -20.012 -5.718 1.00 0.00 H new ATOM 0 HB3 LEU A 4 5.404 -21.643 -5.166 1.00 0.00 H new ATOM 0 HG LEU A 4 3.393 -19.722 -3.963 1.00 0.00 H new ATOM 0 HD11 LEU A 4 1.725 -21.360 -4.877 1.00 0.00 H new ATOM 0 HD12 LEU A 4 2.722 -20.648 -6.169 1.00 0.00 H new ATOM 0 HD13 LEU A 4 3.061 -22.296 -5.589 1.00 0.00 H new ATOM 0 HD21 LEU A 4 2.601 -21.618 -2.603 1.00 0.00 H new ATOM 0 HD22 LEU A 4 3.952 -22.607 -3.206 1.00 0.00 H new ATOM 0 HD23 LEU A 4 4.278 -21.166 -2.213 1.00 0.00 H new ATOM 71 N PRO A 5 8.435 -21.119 -4.347 1.00 0.00 N ATOM 72 CA PRO A 5 9.639 -21.356 -5.136 1.00 0.00 C ATOM 73 C PRO A 5 9.321 -21.532 -6.622 1.00 0.00 C ATOM 74 O PRO A 5 8.373 -22.226 -7.001 1.00 0.00 O ATOM 75 CB PRO A 5 10.281 -22.621 -4.560 1.00 0.00 C ATOM 76 CG PRO A 5 9.776 -22.652 -3.123 1.00 0.00 C ATOM 77 CD PRO A 5 8.374 -22.060 -3.238 1.00 0.00 C ATOM 0 HA PRO A 5 10.313 -20.501 -5.076 1.00 0.00 H new ATOM 0 HB2 PRO A 5 9.979 -23.511 -5.111 1.00 0.00 H new ATOM 0 HB3 PRO A 5 11.369 -22.574 -4.602 1.00 0.00 H new ATOM 0 HG2 PRO A 5 9.754 -23.666 -2.725 1.00 0.00 H new ATOM 0 HG3 PRO A 5 10.410 -22.063 -2.460 1.00 0.00 H new ATOM 0 HD2 PRO A 5 7.634 -22.838 -3.425 1.00 0.00 H new ATOM 0 HD3 PRO A 5 8.083 -21.559 -2.315 1.00 0.00 H new ATOM 85 N ASN A 6 10.166 -20.937 -7.459 1.00 0.00 N ATOM 86 CA ASN A 6 10.236 -21.100 -8.906 1.00 0.00 C ATOM 87 C ASN A 6 11.657 -20.677 -9.279 1.00 0.00 C ATOM 88 O ASN A 6 12.244 -19.880 -8.552 1.00 0.00 O ATOM 89 CB ASN A 6 9.211 -20.191 -9.604 1.00 0.00 C ATOM 90 CG ASN A 6 9.300 -20.319 -11.121 1.00 0.00 C ATOM 91 OD1 ASN A 6 9.194 -21.413 -11.664 1.00 0.00 O ATOM 92 ND2 ASN A 6 9.540 -19.233 -11.834 1.00 0.00 N ATOM 0 H ASN A 6 10.870 -20.282 -7.118 1.00 0.00 H new ATOM 0 HA ASN A 6 10.012 -22.122 -9.213 1.00 0.00 H new ATOM 0 HB2 ASN A 6 8.206 -20.452 -9.273 1.00 0.00 H new ATOM 0 HB3 ASN A 6 9.383 -19.155 -9.314 1.00 0.00 H new ATOM 0 HD21 ASN A 6 9.639 -19.300 -12.847 1.00 0.00 H new ATOM 0 HD22 ASN A 6 9.626 -18.328 -11.371 1.00 0.00 H new ATOM 99 N GLN A 7 12.236 -21.163 -10.380 1.00 0.00 N ATOM 100 CA GLN A 7 13.628 -20.829 -10.714 1.00 0.00 C ATOM 101 C GLN A 7 13.793 -19.361 -11.160 1.00 0.00 C ATOM 102 O GLN A 7 14.913 -18.899 -11.378 1.00 0.00 O ATOM 103 CB GLN A 7 14.168 -21.810 -11.773 1.00 0.00 C ATOM 104 CG GLN A 7 15.667 -22.077 -11.562 1.00 0.00 C ATOM 105 CD GLN A 7 16.327 -22.733 -12.778 1.00 0.00 C ATOM 106 OE1 GLN A 7 15.843 -23.725 -13.320 1.00 0.00 O ATOM 107 NE2 GLN A 7 17.445 -22.195 -13.234 1.00 0.00 N ATOM 0 H GLN A 7 11.773 -21.780 -11.048 1.00 0.00 H new ATOM 0 HA GLN A 7 14.222 -20.935 -9.806 1.00 0.00 H new ATOM 0 HB2 GLN A 7 13.617 -22.749 -11.719 1.00 0.00 H new ATOM 0 HB3 GLN A 7 14.005 -21.401 -12.770 1.00 0.00 H new ATOM 0 HG2 GLN A 7 16.172 -21.136 -11.343 1.00 0.00 H new ATOM 0 HG3 GLN A 7 15.798 -22.720 -10.691 1.00 0.00 H new ATOM 0 HE21 GLN A 7 17.838 -21.372 -12.777 1.00 0.00 H new ATOM 0 HE22 GLN A 7 17.914 -22.603 -14.043 1.00 0.00 H new ATOM 116 N THR A 8 12.691 -18.626 -11.299 1.00 0.00 N ATOM 117 CA THR A 8 12.627 -17.264 -11.800 1.00 0.00 C ATOM 118 C THR A 8 11.624 -16.510 -10.919 1.00 0.00 C ATOM 119 O THR A 8 10.699 -17.127 -10.371 1.00 0.00 O ATOM 120 CB THR A 8 12.196 -17.310 -13.285 1.00 0.00 C ATOM 121 OG1 THR A 8 12.948 -18.277 -14.000 1.00 0.00 O ATOM 122 CG2 THR A 8 12.346 -15.978 -14.028 1.00 0.00 C ATOM 0 H THR A 8 11.771 -18.990 -11.050 1.00 0.00 H new ATOM 0 HA THR A 8 13.587 -16.750 -11.756 1.00 0.00 H new ATOM 0 HB THR A 8 11.136 -17.564 -13.251 1.00 0.00 H new ATOM 0 HG1 THR A 8 12.658 -18.290 -14.936 1.00 0.00 H new ATOM 0 HG21 THR A 8 12.022 -16.099 -15.062 1.00 0.00 H new ATOM 0 HG22 THR A 8 11.733 -15.219 -13.542 1.00 0.00 H new ATOM 0 HG23 THR A 8 13.390 -15.667 -14.009 1.00 0.00 H new ATOM 130 N ILE A 9 11.777 -15.191 -10.791 1.00 0.00 N ATOM 131 CA ILE A 9 10.844 -14.334 -10.060 1.00 0.00 C ATOM 132 C ILE A 9 10.452 -13.151 -10.959 1.00 0.00 C ATOM 133 O ILE A 9 11.000 -12.976 -12.051 1.00 0.00 O ATOM 134 CB ILE A 9 11.399 -13.938 -8.661 1.00 0.00 C ATOM 135 CG1 ILE A 9 12.354 -12.731 -8.742 1.00 0.00 C ATOM 136 CG2 ILE A 9 12.028 -15.154 -7.948 1.00 0.00 C ATOM 137 CD1 ILE A 9 13.172 -12.444 -7.476 1.00 0.00 C ATOM 0 H ILE A 9 12.562 -14.682 -11.197 1.00 0.00 H new ATOM 0 HA ILE A 9 9.928 -14.877 -9.830 1.00 0.00 H new ATOM 0 HB ILE A 9 10.559 -13.613 -8.047 1.00 0.00 H new ATOM 0 HG12 ILE A 9 13.045 -12.892 -9.570 1.00 0.00 H new ATOM 0 HG13 ILE A 9 11.769 -11.844 -8.983 1.00 0.00 H new ATOM 0 HG21 ILE A 9 12.407 -14.848 -6.973 1.00 0.00 H new ATOM 0 HG22 ILE A 9 11.273 -15.929 -7.817 1.00 0.00 H new ATOM 0 HG23 ILE A 9 12.848 -15.545 -8.550 1.00 0.00 H new ATOM 0 HD11 ILE A 9 13.809 -11.576 -7.643 1.00 0.00 H new ATOM 0 HD12 ILE A 9 12.497 -12.244 -6.644 1.00 0.00 H new ATOM 0 HD13 ILE A 9 13.792 -13.309 -7.240 1.00 0.00 H new ATOM 149 N TYR A 10 9.497 -12.356 -10.493 1.00 0.00 N ATOM 150 CA TYR A 10 8.788 -11.299 -11.197 1.00 0.00 C ATOM 151 C TYR A 10 8.777 -10.107 -10.257 1.00 0.00 C ATOM 152 O TYR A 10 8.178 -10.166 -9.184 1.00 0.00 O ATOM 153 CB TYR A 10 7.386 -11.828 -11.503 1.00 0.00 C ATOM 154 CG TYR A 10 6.295 -10.820 -11.805 1.00 0.00 C ATOM 155 CD1 TYR A 10 6.417 -9.898 -12.862 1.00 0.00 C ATOM 156 CD2 TYR A 10 5.110 -10.871 -11.049 1.00 0.00 C ATOM 157 CE1 TYR A 10 5.338 -9.055 -13.184 1.00 0.00 C ATOM 158 CE2 TYR A 10 4.038 -10.020 -11.349 1.00 0.00 C ATOM 159 CZ TYR A 10 4.139 -9.126 -12.433 1.00 0.00 C ATOM 160 OH TYR A 10 3.072 -8.337 -12.727 1.00 0.00 O ATOM 0 H TYR A 10 9.172 -12.443 -9.530 1.00 0.00 H new ATOM 0 HA TYR A 10 9.244 -10.999 -12.140 1.00 0.00 H new ATOM 0 HB2 TYR A 10 7.462 -12.503 -12.356 1.00 0.00 H new ATOM 0 HB3 TYR A 10 7.062 -12.426 -10.651 1.00 0.00 H new ATOM 0 HD1 TYR A 10 7.337 -9.838 -13.424 1.00 0.00 H new ATOM 0 HD2 TYR A 10 5.026 -11.571 -10.231 1.00 0.00 H new ATOM 0 HE1 TYR A 10 5.423 -8.355 -14.002 1.00 0.00 H new ATOM 0 HE2 TYR A 10 3.139 -10.049 -10.752 1.00 0.00 H new ATOM 0 HH TYR A 10 3.254 -7.833 -13.547 1.00 0.00 H new ATOM 170 N ILE A 11 9.504 -9.065 -10.641 1.00 0.00 N ATOM 171 CA ILE A 11 9.677 -7.821 -9.908 1.00 0.00 C ATOM 172 C ILE A 11 8.735 -6.823 -10.570 1.00 0.00 C ATOM 173 O ILE A 11 8.588 -6.811 -11.794 1.00 0.00 O ATOM 174 CB ILE A 11 11.163 -7.391 -9.994 1.00 0.00 C ATOM 175 CG1 ILE A 11 12.040 -8.390 -9.200 1.00 0.00 C ATOM 176 CG2 ILE A 11 11.398 -5.943 -9.510 1.00 0.00 C ATOM 177 CD1 ILE A 11 13.536 -8.324 -9.532 1.00 0.00 C ATOM 0 H ILE A 11 10.017 -9.068 -11.523 1.00 0.00 H new ATOM 0 HA ILE A 11 9.440 -7.903 -8.847 1.00 0.00 H new ATOM 0 HB ILE A 11 11.450 -7.408 -11.045 1.00 0.00 H new ATOM 0 HG12 ILE A 11 11.908 -8.203 -8.134 1.00 0.00 H new ATOM 0 HG13 ILE A 11 11.682 -9.401 -9.392 1.00 0.00 H new ATOM 0 HG21 ILE A 11 12.457 -5.699 -9.594 1.00 0.00 H new ATOM 0 HG22 ILE A 11 10.817 -5.255 -10.125 1.00 0.00 H new ATOM 0 HG23 ILE A 11 11.086 -5.852 -8.470 1.00 0.00 H new ATOM 0 HD11 ILE A 11 14.075 -9.057 -8.931 1.00 0.00 H new ATOM 0 HD12 ILE A 11 13.684 -8.543 -10.589 1.00 0.00 H new ATOM 0 HD13 ILE A 11 13.914 -7.326 -9.312 1.00 0.00 H new ATOM 189 N ASN A 12 8.106 -5.977 -9.765 1.00 0.00 N ATOM 190 CA ASN A 12 7.096 -5.020 -10.179 1.00 0.00 C ATOM 191 C ASN A 12 7.200 -3.769 -9.308 1.00 0.00 C ATOM 192 O ASN A 12 8.010 -3.721 -8.377 1.00 0.00 O ATOM 193 CB ASN A 12 5.707 -5.667 -10.066 1.00 0.00 C ATOM 194 CG ASN A 12 4.822 -5.180 -11.199 1.00 0.00 C ATOM 195 OD1 ASN A 12 4.231 -4.109 -11.132 1.00 0.00 O ATOM 196 ND2 ASN A 12 4.775 -5.941 -12.277 1.00 0.00 N ATOM 0 H ASN A 12 8.296 -5.940 -8.764 1.00 0.00 H new ATOM 0 HA ASN A 12 7.253 -4.728 -11.217 1.00 0.00 H new ATOM 0 HB2 ASN A 12 5.797 -6.753 -10.103 1.00 0.00 H new ATOM 0 HB3 ASN A 12 5.256 -5.417 -9.106 1.00 0.00 H new ATOM 0 HD21 ASN A 12 4.234 -5.643 -13.089 1.00 0.00 H new ATOM 0 HD22 ASN A 12 5.280 -6.827 -12.298 1.00 0.00 H new ATOM 203 N ASN A 13 6.366 -2.764 -9.597 1.00 0.00 N ATOM 204 CA ASN A 13 6.444 -1.412 -9.029 1.00 0.00 C ATOM 205 C ASN A 13 7.835 -0.785 -9.233 1.00 0.00 C ATOM 206 O ASN A 13 8.293 0.029 -8.431 1.00 0.00 O ATOM 207 CB ASN A 13 5.979 -1.419 -7.561 1.00 0.00 C ATOM 208 CG ASN A 13 5.685 -0.015 -7.039 1.00 0.00 C ATOM 209 OD1 ASN A 13 4.979 0.762 -7.676 1.00 0.00 O ATOM 210 ND2 ASN A 13 6.175 0.330 -5.860 1.00 0.00 N ATOM 0 H ASN A 13 5.593 -2.872 -10.254 1.00 0.00 H new ATOM 0 HA ASN A 13 5.757 -0.763 -9.573 1.00 0.00 H new ATOM 0 HB2 ASN A 13 5.083 -2.033 -7.469 1.00 0.00 H new ATOM 0 HB3 ASN A 13 6.747 -1.881 -6.941 1.00 0.00 H new ATOM 0 HD21 ASN A 13 5.968 1.250 -5.471 1.00 0.00 H new ATOM 0 HD22 ASN A 13 6.760 -0.324 -5.340 1.00 0.00 H new ATOM 217 N LEU A 14 8.533 -1.199 -10.297 1.00 0.00 N ATOM 218 CA LEU A 14 9.856 -0.710 -10.672 1.00 0.00 C ATOM 219 C LEU A 14 9.661 0.705 -11.226 1.00 0.00 C ATOM 220 O LEU A 14 8.775 0.903 -12.062 1.00 0.00 O ATOM 221 CB LEU A 14 10.436 -1.680 -11.728 1.00 0.00 C ATOM 222 CG LEU A 14 11.951 -1.937 -11.666 1.00 0.00 C ATOM 223 CD1 LEU A 14 12.319 -2.915 -12.789 1.00 0.00 C ATOM 224 CD2 LEU A 14 12.779 -0.655 -11.817 1.00 0.00 C ATOM 0 H LEU A 14 8.177 -1.907 -10.939 1.00 0.00 H new ATOM 0 HA LEU A 14 10.555 -0.669 -9.837 1.00 0.00 H new ATOM 0 HB2 LEU A 14 9.923 -2.637 -11.630 1.00 0.00 H new ATOM 0 HB3 LEU A 14 10.196 -1.290 -12.717 1.00 0.00 H new ATOM 0 HG LEU A 14 12.183 -2.349 -10.684 1.00 0.00 H new ATOM 0 HD11 LEU A 14 13.391 -3.112 -12.764 1.00 0.00 H new ATOM 0 HD12 LEU A 14 11.775 -3.849 -12.650 1.00 0.00 H new ATOM 0 HD13 LEU A 14 12.053 -2.480 -13.752 1.00 0.00 H new ATOM 0 HD21 LEU A 14 13.840 -0.899 -11.765 1.00 0.00 H new ATOM 0 HD22 LEU A 14 12.560 -0.191 -12.779 1.00 0.00 H new ATOM 0 HD23 LEU A 14 12.526 0.038 -11.014 1.00 0.00 H new ATOM 236 N ASN A 15 10.441 1.697 -10.772 1.00 0.00 N ATOM 237 CA ASN A 15 10.352 3.041 -11.346 1.00 0.00 C ATOM 238 C ASN A 15 10.852 2.970 -12.789 1.00 0.00 C ATOM 239 O ASN A 15 11.992 2.576 -13.037 1.00 0.00 O ATOM 240 CB ASN A 15 11.127 4.095 -10.534 1.00 0.00 C ATOM 241 CG ASN A 15 10.889 5.500 -11.103 1.00 0.00 C ATOM 242 OD1 ASN A 15 11.088 5.751 -12.284 1.00 0.00 O ATOM 243 ND2 ASN A 15 10.437 6.454 -10.312 1.00 0.00 N ATOM 0 H ASN A 15 11.127 1.595 -10.024 1.00 0.00 H new ATOM 0 HA ASN A 15 9.312 3.367 -11.317 1.00 0.00 H new ATOM 0 HB2 ASN A 15 10.812 4.061 -9.491 1.00 0.00 H new ATOM 0 HB3 ASN A 15 12.192 3.865 -10.553 1.00 0.00 H new ATOM 0 HD21 ASN A 15 10.258 7.386 -10.687 1.00 0.00 H new ATOM 0 HD22 ASN A 15 10.266 6.260 -9.325 1.00 0.00 H new ATOM 250 N GLU A 16 9.995 3.357 -13.734 1.00 0.00 N ATOM 251 CA GLU A 16 10.238 3.228 -15.165 1.00 0.00 C ATOM 252 C GLU A 16 11.501 3.944 -15.671 1.00 0.00 C ATOM 253 O GLU A 16 11.984 3.629 -16.763 1.00 0.00 O ATOM 254 CB GLU A 16 8.981 3.664 -15.938 1.00 0.00 C ATOM 255 CG GLU A 16 8.724 5.180 -15.982 1.00 0.00 C ATOM 256 CD GLU A 16 7.517 5.514 -16.878 1.00 0.00 C ATOM 257 OE1 GLU A 16 7.659 5.510 -18.124 1.00 0.00 O ATOM 258 OE2 GLU A 16 6.420 5.798 -16.343 1.00 0.00 O ATOM 0 H GLU A 16 9.092 3.779 -13.517 1.00 0.00 H new ATOM 0 HA GLU A 16 10.442 2.174 -15.354 1.00 0.00 H new ATOM 0 HB2 GLU A 16 9.059 3.296 -16.961 1.00 0.00 H new ATOM 0 HB3 GLU A 16 8.114 3.179 -15.490 1.00 0.00 H new ATOM 0 HG2 GLU A 16 8.545 5.551 -14.973 1.00 0.00 H new ATOM 0 HG3 GLU A 16 9.611 5.691 -16.356 1.00 0.00 H new ATOM 265 N LYS A 17 12.051 4.905 -14.916 1.00 0.00 N ATOM 266 CA LYS A 17 13.242 5.639 -15.335 1.00 0.00 C ATOM 267 C LYS A 17 14.464 4.730 -15.458 1.00 0.00 C ATOM 268 O LYS A 17 15.279 4.949 -16.354 1.00 0.00 O ATOM 269 CB LYS A 17 13.499 6.848 -14.424 1.00 0.00 C ATOM 270 CG LYS A 17 14.169 6.526 -13.078 1.00 0.00 C ATOM 271 CD LYS A 17 14.178 7.787 -12.214 1.00 0.00 C ATOM 272 CE LYS A 17 14.881 7.528 -10.874 1.00 0.00 C ATOM 273 NZ LYS A 17 14.973 8.756 -10.044 1.00 0.00 N ATOM 0 H LYS A 17 11.684 5.190 -14.008 1.00 0.00 H new ATOM 0 HA LYS A 17 13.052 6.027 -16.336 1.00 0.00 H new ATOM 0 HB2 LYS A 17 14.125 7.560 -14.961 1.00 0.00 H new ATOM 0 HB3 LYS A 17 12.548 7.343 -14.228 1.00 0.00 H new ATOM 0 HG2 LYS A 17 13.630 5.726 -12.571 1.00 0.00 H new ATOM 0 HG3 LYS A 17 15.187 6.172 -13.239 1.00 0.00 H new ATOM 0 HD2 LYS A 17 14.684 8.593 -12.745 1.00 0.00 H new ATOM 0 HD3 LYS A 17 13.155 8.117 -12.035 1.00 0.00 H new ATOM 0 HE2 LYS A 17 14.339 6.759 -10.324 1.00 0.00 H new ATOM 0 HE3 LYS A 17 15.883 7.141 -11.060 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 15.454 8.535 -9.149 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 15.512 9.482 -10.557 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 14.017 9.112 -9.844 1.00 0.00 H new ATOM 287 N ILE A 18 14.578 3.715 -14.597 1.00 0.00 N ATOM 288 CA ILE A 18 15.759 2.860 -14.493 1.00 0.00 C ATOM 289 C ILE A 18 16.001 2.196 -15.857 1.00 0.00 C ATOM 290 O ILE A 18 15.091 1.589 -16.427 1.00 0.00 O ATOM 291 CB ILE A 18 15.573 1.844 -13.338 1.00 0.00 C ATOM 292 CG1 ILE A 18 15.262 2.506 -11.971 1.00 0.00 C ATOM 293 CG2 ILE A 18 16.804 0.934 -13.192 1.00 0.00 C ATOM 294 CD1 ILE A 18 16.332 3.465 -11.429 1.00 0.00 C ATOM 0 H ILE A 18 13.838 3.462 -13.942 1.00 0.00 H new ATOM 0 HA ILE A 18 16.648 3.440 -14.246 1.00 0.00 H new ATOM 0 HB ILE A 18 14.703 1.250 -13.618 1.00 0.00 H new ATOM 0 HG12 ILE A 18 14.323 3.053 -12.060 1.00 0.00 H new ATOM 0 HG13 ILE A 18 15.103 1.717 -11.236 1.00 0.00 H new ATOM 0 HG21 ILE A 18 16.643 0.232 -12.374 1.00 0.00 H new ATOM 0 HG22 ILE A 18 16.960 0.381 -14.118 1.00 0.00 H new ATOM 0 HG23 ILE A 18 17.683 1.542 -12.980 1.00 0.00 H new ATOM 0 HD11 ILE A 18 16.007 3.868 -10.470 1.00 0.00 H new ATOM 0 HD12 ILE A 18 17.270 2.926 -11.298 1.00 0.00 H new ATOM 0 HD13 ILE A 18 16.479 4.283 -12.135 1.00 0.00 H new ATOM 306 N LYS A 19 17.207 2.352 -16.410 1.00 0.00 N ATOM 307 CA LYS A 19 17.585 1.740 -17.685 1.00 0.00 C ATOM 308 C LYS A 19 17.808 0.239 -17.490 1.00 0.00 C ATOM 309 O LYS A 19 18.084 -0.204 -16.376 1.00 0.00 O ATOM 310 CB LYS A 19 18.823 2.469 -18.245 1.00 0.00 C ATOM 311 CG LYS A 19 18.981 2.294 -19.764 1.00 0.00 C ATOM 312 CD LYS A 19 20.120 3.165 -20.312 1.00 0.00 C ATOM 313 CE LYS A 19 20.170 3.041 -21.841 1.00 0.00 C ATOM 314 NZ LYS A 19 21.236 3.883 -22.441 1.00 0.00 N ATOM 0 H LYS A 19 17.949 2.907 -15.985 1.00 0.00 H new ATOM 0 HA LYS A 19 16.787 1.844 -18.420 1.00 0.00 H new ATOM 0 HB2 LYS A 19 18.750 3.531 -18.012 1.00 0.00 H new ATOM 0 HB3 LYS A 19 19.716 2.094 -17.746 1.00 0.00 H new ATOM 0 HG2 LYS A 19 19.179 1.247 -19.993 1.00 0.00 H new ATOM 0 HG3 LYS A 19 18.048 2.558 -20.261 1.00 0.00 H new ATOM 0 HD2 LYS A 19 19.966 4.205 -20.026 1.00 0.00 H new ATOM 0 HD3 LYS A 19 21.071 2.853 -19.880 1.00 0.00 H new ATOM 0 HE2 LYS A 19 20.337 1.999 -22.113 1.00 0.00 H new ATOM 0 HE3 LYS A 19 19.205 3.329 -22.258 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 21.231 3.766 -23.474 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 21.064 4.881 -22.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 22.161 3.593 -22.065 1.00 0.00 H new ATOM 328 N LYS A 20 17.762 -0.546 -18.570 1.00 0.00 N ATOM 329 CA LYS A 20 18.017 -1.990 -18.525 1.00 0.00 C ATOM 330 C LYS A 20 19.389 -2.276 -17.926 1.00 0.00 C ATOM 331 O LYS A 20 19.523 -3.166 -17.094 1.00 0.00 O ATOM 332 CB LYS A 20 17.926 -2.572 -19.946 1.00 0.00 C ATOM 333 CG LYS A 20 17.966 -4.109 -19.938 1.00 0.00 C ATOM 334 CD LYS A 20 17.861 -4.650 -21.372 1.00 0.00 C ATOM 335 CE LYS A 20 17.898 -6.186 -21.374 1.00 0.00 C ATOM 336 NZ LYS A 20 17.727 -6.748 -22.739 1.00 0.00 N ATOM 0 H LYS A 20 17.546 -0.197 -19.504 1.00 0.00 H new ATOM 0 HA LYS A 20 17.265 -2.461 -17.892 1.00 0.00 H new ATOM 0 HB2 LYS A 20 17.003 -2.235 -20.418 1.00 0.00 H new ATOM 0 HB3 LYS A 20 18.750 -2.190 -20.548 1.00 0.00 H new ATOM 0 HG2 LYS A 20 18.892 -4.454 -19.479 1.00 0.00 H new ATOM 0 HG3 LYS A 20 17.147 -4.498 -19.334 1.00 0.00 H new ATOM 0 HD2 LYS A 20 16.935 -4.302 -21.831 1.00 0.00 H new ATOM 0 HD3 LYS A 20 18.681 -4.260 -21.975 1.00 0.00 H new ATOM 0 HE2 LYS A 20 18.847 -6.526 -20.959 1.00 0.00 H new ATOM 0 HE3 LYS A 20 17.111 -6.568 -20.724 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 17.758 -7.787 -22.693 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 16.810 -6.446 -23.126 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 18.493 -6.405 -23.354 1.00 0.00 H new ATOM 350 N GLU A 21 20.400 -1.518 -18.345 1.00 0.00 N ATOM 351 CA GLU A 21 21.761 -1.666 -17.852 1.00 0.00 C ATOM 352 C GLU A 21 21.803 -1.410 -16.345 1.00 0.00 C ATOM 353 O GLU A 21 22.384 -2.201 -15.604 1.00 0.00 O ATOM 354 CB GLU A 21 22.650 -0.703 -18.650 1.00 0.00 C ATOM 355 CG GLU A 21 24.087 -0.626 -18.117 1.00 0.00 C ATOM 356 CD GLU A 21 24.996 0.184 -19.057 1.00 0.00 C ATOM 357 OE1 GLU A 21 25.101 1.422 -18.896 1.00 0.00 O ATOM 358 OE2 GLU A 21 25.633 -0.409 -19.957 1.00 0.00 O ATOM 0 H GLU A 21 20.294 -0.780 -19.041 1.00 0.00 H new ATOM 0 HA GLU A 21 22.133 -2.681 -17.995 1.00 0.00 H new ATOM 0 HB2 GLU A 21 22.672 -1.019 -19.693 1.00 0.00 H new ATOM 0 HB3 GLU A 21 22.207 0.293 -18.628 1.00 0.00 H new ATOM 0 HG2 GLU A 21 24.085 -0.168 -17.128 1.00 0.00 H new ATOM 0 HG3 GLU A 21 24.487 -1.633 -18.001 1.00 0.00 H new ATOM 365 N GLU A 22 21.147 -0.344 -15.883 1.00 0.00 N ATOM 366 CA GLU A 22 21.118 0.017 -14.471 1.00 0.00 C ATOM 367 C GLU A 22 20.410 -1.072 -13.664 1.00 0.00 C ATOM 368 O GLU A 22 20.898 -1.465 -12.606 1.00 0.00 O ATOM 369 CB GLU A 22 20.416 1.366 -14.277 1.00 0.00 C ATOM 370 CG GLU A 22 21.163 2.531 -14.940 1.00 0.00 C ATOM 371 CD GLU A 22 20.409 3.860 -14.752 1.00 0.00 C ATOM 372 OE1 GLU A 22 19.212 3.938 -15.111 1.00 0.00 O ATOM 373 OE2 GLU A 22 21.017 4.838 -14.256 1.00 0.00 O ATOM 0 H GLU A 22 20.621 0.292 -16.482 1.00 0.00 H new ATOM 0 HA GLU A 22 22.144 0.108 -14.113 1.00 0.00 H new ATOM 0 HB2 GLU A 22 19.408 1.307 -14.688 1.00 0.00 H new ATOM 0 HB3 GLU A 22 20.315 1.567 -13.210 1.00 0.00 H new ATOM 0 HG2 GLU A 22 22.163 2.614 -14.513 1.00 0.00 H new ATOM 0 HG3 GLU A 22 21.286 2.328 -16.004 1.00 0.00 H new ATOM 380 N LEU A 23 19.292 -1.594 -14.179 1.00 0.00 N ATOM 381 CA LEU A 23 18.555 -2.706 -13.596 1.00 0.00 C ATOM 382 C LEU A 23 19.479 -3.915 -13.468 1.00 0.00 C ATOM 383 O LEU A 23 19.649 -4.417 -12.358 1.00 0.00 O ATOM 384 CB LEU A 23 17.286 -2.958 -14.446 1.00 0.00 C ATOM 385 CG LEU A 23 16.399 -4.180 -14.133 1.00 0.00 C ATOM 386 CD1 LEU A 23 16.977 -5.517 -14.607 1.00 0.00 C ATOM 387 CD2 LEU A 23 16.053 -4.262 -12.648 1.00 0.00 C ATOM 0 H LEU A 23 18.868 -1.241 -15.037 1.00 0.00 H new ATOM 0 HA LEU A 23 18.214 -2.483 -12.585 1.00 0.00 H new ATOM 0 HB2 LEU A 23 16.659 -2.070 -14.370 1.00 0.00 H new ATOM 0 HB3 LEU A 23 17.599 -3.039 -15.487 1.00 0.00 H new ATOM 0 HG LEU A 23 15.489 -4.012 -14.710 1.00 0.00 H new ATOM 0 HD11 LEU A 23 16.291 -6.323 -14.347 1.00 0.00 H new ATOM 0 HD12 LEU A 23 17.114 -5.491 -15.688 1.00 0.00 H new ATOM 0 HD13 LEU A 23 17.939 -5.689 -14.124 1.00 0.00 H new ATOM 0 HD21 LEU A 23 15.427 -5.136 -12.468 1.00 0.00 H new ATOM 0 HD22 LEU A 23 16.970 -4.346 -12.065 1.00 0.00 H new ATOM 0 HD23 LEU A 23 15.514 -3.362 -12.350 1.00 0.00 H new ATOM 399 N LYS A 24 20.124 -4.354 -14.556 1.00 0.00 N ATOM 400 CA LYS A 24 21.003 -5.524 -14.522 1.00 0.00 C ATOM 401 C LYS A 24 22.116 -5.332 -13.500 1.00 0.00 C ATOM 402 O LYS A 24 22.312 -6.199 -12.647 1.00 0.00 O ATOM 403 CB LYS A 24 21.598 -5.819 -15.910 1.00 0.00 C ATOM 404 CG LYS A 24 20.573 -6.433 -16.879 1.00 0.00 C ATOM 405 CD LYS A 24 21.224 -6.984 -18.159 1.00 0.00 C ATOM 406 CE LYS A 24 21.959 -5.902 -18.968 1.00 0.00 C ATOM 407 NZ LYS A 24 22.629 -6.460 -20.173 1.00 0.00 N ATOM 0 H LYS A 24 20.051 -3.913 -15.473 1.00 0.00 H new ATOM 0 HA LYS A 24 20.399 -6.381 -14.225 1.00 0.00 H new ATOM 0 HB2 LYS A 24 21.987 -4.895 -16.337 1.00 0.00 H new ATOM 0 HB3 LYS A 24 22.442 -6.500 -15.801 1.00 0.00 H new ATOM 0 HG2 LYS A 24 20.037 -7.237 -16.374 1.00 0.00 H new ATOM 0 HG3 LYS A 24 19.835 -5.677 -17.148 1.00 0.00 H new ATOM 0 HD2 LYS A 24 21.928 -7.773 -17.893 1.00 0.00 H new ATOM 0 HD3 LYS A 24 20.456 -7.440 -18.784 1.00 0.00 H new ATOM 0 HE2 LYS A 24 21.249 -5.133 -19.272 1.00 0.00 H new ATOM 0 HE3 LYS A 24 22.701 -5.417 -18.333 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 23.111 -5.696 -20.687 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 23.326 -7.175 -19.883 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 21.919 -6.900 -20.793 1.00 0.00 H new ATOM 421 N LYS A 25 22.820 -4.196 -13.550 1.00 0.00 N ATOM 422 CA LYS A 25 23.900 -3.906 -12.612 1.00 0.00 C ATOM 423 C LYS A 25 23.380 -3.937 -11.180 1.00 0.00 C ATOM 424 O LYS A 25 24.044 -4.512 -10.322 1.00 0.00 O ATOM 425 CB LYS A 25 24.552 -2.549 -12.935 1.00 0.00 C ATOM 426 CG LYS A 25 25.399 -2.545 -14.222 1.00 0.00 C ATOM 427 CD LYS A 25 26.693 -3.372 -14.151 1.00 0.00 C ATOM 428 CE LYS A 25 27.685 -2.824 -13.113 1.00 0.00 C ATOM 429 NZ LYS A 25 28.969 -3.569 -13.113 1.00 0.00 N ATOM 0 H LYS A 25 22.656 -3.460 -14.237 1.00 0.00 H new ATOM 0 HA LYS A 25 24.665 -4.676 -12.714 1.00 0.00 H new ATOM 0 HB2 LYS A 25 23.770 -1.795 -13.026 1.00 0.00 H new ATOM 0 HB3 LYS A 25 25.183 -2.253 -12.097 1.00 0.00 H new ATOM 0 HG2 LYS A 25 24.788 -2.923 -15.042 1.00 0.00 H new ATOM 0 HG3 LYS A 25 25.657 -1.514 -14.466 1.00 0.00 H new ATOM 0 HD2 LYS A 25 26.447 -4.405 -13.904 1.00 0.00 H new ATOM 0 HD3 LYS A 25 27.168 -3.383 -15.132 1.00 0.00 H new ATOM 0 HE2 LYS A 25 27.878 -1.771 -13.319 1.00 0.00 H new ATOM 0 HE3 LYS A 25 27.236 -2.878 -12.121 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 29.606 -3.164 -12.397 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 28.790 -4.569 -12.891 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 29.412 -3.497 -14.051 1.00 0.00 H new ATOM 443 N SER A 26 22.200 -3.376 -10.917 1.00 0.00 N ATOM 444 CA SER A 26 21.620 -3.372 -9.583 1.00 0.00 C ATOM 445 C SER A 26 21.332 -4.789 -9.100 1.00 0.00 C ATOM 446 O SER A 26 21.682 -5.134 -7.971 1.00 0.00 O ATOM 447 CB SER A 26 20.362 -2.504 -9.549 1.00 0.00 C ATOM 448 OG SER A 26 20.650 -1.190 -9.990 1.00 0.00 O ATOM 0 H SER A 26 21.625 -2.915 -11.622 1.00 0.00 H new ATOM 0 HA SER A 26 22.348 -2.939 -8.897 1.00 0.00 H new ATOM 0 HB2 SER A 26 19.592 -2.945 -10.182 1.00 0.00 H new ATOM 0 HB3 SER A 26 19.962 -2.474 -8.535 1.00 0.00 H new ATOM 0 HG SER A 26 20.406 -1.101 -10.935 1.00 0.00 H new ATOM 454 N LEU A 27 20.750 -5.642 -9.939 1.00 0.00 N ATOM 455 CA LEU A 27 20.432 -6.997 -9.504 1.00 0.00 C ATOM 456 C LEU A 27 21.726 -7.764 -9.201 1.00 0.00 C ATOM 457 O LEU A 27 21.815 -8.434 -8.173 1.00 0.00 O ATOM 458 CB LEU A 27 19.596 -7.777 -10.521 1.00 0.00 C ATOM 459 CG LEU A 27 18.268 -7.190 -11.028 1.00 0.00 C ATOM 460 CD1 LEU A 27 17.418 -8.314 -11.624 1.00 0.00 C ATOM 461 CD2 LEU A 27 17.433 -6.498 -9.952 1.00 0.00 C ATOM 0 H LEU A 27 20.494 -5.426 -10.902 1.00 0.00 H new ATOM 0 HA LEU A 27 19.826 -6.902 -8.603 1.00 0.00 H new ATOM 0 HB2 LEU A 27 20.227 -7.955 -11.392 1.00 0.00 H new ATOM 0 HB3 LEU A 27 19.375 -8.750 -10.083 1.00 0.00 H new ATOM 0 HG LEU A 27 18.540 -6.433 -11.763 1.00 0.00 H new ATOM 0 HD11 LEU A 27 16.475 -7.904 -11.985 1.00 0.00 H new ATOM 0 HD12 LEU A 27 17.955 -8.775 -12.453 1.00 0.00 H new ATOM 0 HD13 LEU A 27 17.218 -9.064 -10.859 1.00 0.00 H new ATOM 0 HD21 LEU A 27 16.515 -6.113 -10.395 1.00 0.00 H new ATOM 0 HD22 LEU A 27 17.185 -7.213 -9.168 1.00 0.00 H new ATOM 0 HD23 LEU A 27 18.002 -5.673 -9.524 1.00 0.00 H new ATOM 473 N TYR A 28 22.753 -7.641 -10.047 1.00 0.00 N ATOM 474 CA TYR A 28 24.046 -8.261 -9.761 1.00 0.00 C ATOM 475 C TYR A 28 24.697 -7.668 -8.503 1.00 0.00 C ATOM 476 O TYR A 28 25.418 -8.379 -7.802 1.00 0.00 O ATOM 477 CB TYR A 28 24.983 -8.154 -10.973 1.00 0.00 C ATOM 478 CG TYR A 28 24.588 -9.009 -12.168 1.00 0.00 C ATOM 479 CD1 TYR A 28 24.423 -10.403 -12.023 1.00 0.00 C ATOM 480 CD2 TYR A 28 24.433 -8.422 -13.440 1.00 0.00 C ATOM 481 CE1 TYR A 28 24.087 -11.200 -13.130 1.00 0.00 C ATOM 482 CE2 TYR A 28 24.099 -9.213 -14.553 1.00 0.00 C ATOM 483 CZ TYR A 28 23.918 -10.607 -14.403 1.00 0.00 C ATOM 484 OH TYR A 28 23.594 -11.363 -15.491 1.00 0.00 O ATOM 0 H TYR A 28 22.714 -7.124 -10.925 1.00 0.00 H new ATOM 0 HA TYR A 28 23.866 -9.318 -9.562 1.00 0.00 H new ATOM 0 HB2 TYR A 28 25.026 -7.112 -11.289 1.00 0.00 H new ATOM 0 HB3 TYR A 28 25.989 -8.434 -10.661 1.00 0.00 H new ATOM 0 HD1 TYR A 28 24.556 -10.861 -11.054 1.00 0.00 H new ATOM 0 HD2 TYR A 28 24.572 -7.358 -13.560 1.00 0.00 H new ATOM 0 HE1 TYR A 28 23.958 -12.265 -13.009 1.00 0.00 H new ATOM 0 HE2 TYR A 28 23.981 -8.755 -15.524 1.00 0.00 H new ATOM 0 HH TYR A 28 23.518 -10.786 -16.279 1.00 0.00 H new ATOM 494 N ALA A 29 24.451 -6.390 -8.193 1.00 0.00 N ATOM 495 CA ALA A 29 25.013 -5.740 -7.017 1.00 0.00 C ATOM 496 C ALA A 29 24.382 -6.257 -5.721 1.00 0.00 C ATOM 497 O ALA A 29 25.120 -6.475 -4.757 1.00 0.00 O ATOM 498 CB ALA A 29 24.856 -4.217 -7.113 1.00 0.00 C ATOM 0 H ALA A 29 23.855 -5.782 -8.755 1.00 0.00 H new ATOM 0 HA ALA A 29 26.074 -5.986 -6.989 1.00 0.00 H new ATOM 0 HB1 ALA A 29 25.282 -3.751 -6.225 1.00 0.00 H new ATOM 0 HB2 ALA A 29 25.376 -3.853 -7.999 1.00 0.00 H new ATOM 0 HB3 ALA A 29 23.798 -3.964 -7.183 1.00 0.00 H new ATOM 504 N ILE A 30 23.057 -6.470 -5.681 1.00 0.00 N ATOM 505 CA ILE A 30 22.344 -6.753 -4.427 1.00 0.00 C ATOM 506 C ILE A 30 21.509 -8.039 -4.447 1.00 0.00 C ATOM 507 O ILE A 30 21.603 -8.804 -3.491 1.00 0.00 O ATOM 508 CB ILE A 30 21.527 -5.530 -3.936 1.00 0.00 C ATOM 509 CG1 ILE A 30 20.767 -4.776 -5.049 1.00 0.00 C ATOM 510 CG2 ILE A 30 22.462 -4.566 -3.179 1.00 0.00 C ATOM 511 CD1 ILE A 30 19.785 -3.713 -4.544 1.00 0.00 C ATOM 0 H ILE A 30 22.457 -6.451 -6.506 1.00 0.00 H new ATOM 0 HA ILE A 30 23.127 -6.943 -3.693 1.00 0.00 H new ATOM 0 HB ILE A 30 20.753 -5.922 -3.276 1.00 0.00 H new ATOM 0 HG12 ILE A 30 21.493 -4.298 -5.707 1.00 0.00 H new ATOM 0 HG13 ILE A 30 20.219 -5.500 -5.652 1.00 0.00 H new ATOM 0 HG21 ILE A 30 21.892 -3.704 -2.832 1.00 0.00 H new ATOM 0 HG22 ILE A 30 22.900 -5.080 -2.323 1.00 0.00 H new ATOM 0 HG23 ILE A 30 23.256 -4.231 -3.846 1.00 0.00 H new ATOM 0 HD11 ILE A 30 19.297 -3.235 -5.394 1.00 0.00 H new ATOM 0 HD12 ILE A 30 19.033 -4.184 -3.911 1.00 0.00 H new ATOM 0 HD13 ILE A 30 20.326 -2.963 -3.967 1.00 0.00 H new ATOM 523 N PHE A 31 20.756 -8.351 -5.504 1.00 0.00 N ATOM 524 CA PHE A 31 19.989 -9.606 -5.549 1.00 0.00 C ATOM 525 C PHE A 31 20.927 -10.817 -5.505 1.00 0.00 C ATOM 526 O PHE A 31 20.670 -11.756 -4.750 1.00 0.00 O ATOM 527 CB PHE A 31 19.066 -9.683 -6.777 1.00 0.00 C ATOM 528 CG PHE A 31 17.728 -8.995 -6.611 1.00 0.00 C ATOM 529 CD1 PHE A 31 17.665 -7.600 -6.440 1.00 0.00 C ATOM 530 CD2 PHE A 31 16.537 -9.749 -6.631 1.00 0.00 C ATOM 531 CE1 PHE A 31 16.424 -6.968 -6.282 1.00 0.00 C ATOM 532 CE2 PHE A 31 15.295 -9.112 -6.471 1.00 0.00 C ATOM 533 CZ PHE A 31 15.237 -7.720 -6.302 1.00 0.00 C ATOM 0 H PHE A 31 20.659 -7.763 -6.332 1.00 0.00 H new ATOM 0 HA PHE A 31 19.351 -9.621 -4.665 1.00 0.00 H new ATOM 0 HB2 PHE A 31 19.582 -9.242 -7.630 1.00 0.00 H new ATOM 0 HB3 PHE A 31 18.892 -10.732 -7.018 1.00 0.00 H new ATOM 0 HD1 PHE A 31 18.573 -7.016 -6.430 1.00 0.00 H new ATOM 0 HD2 PHE A 31 16.579 -10.819 -6.770 1.00 0.00 H new ATOM 0 HE1 PHE A 31 16.380 -5.898 -6.144 1.00 0.00 H new ATOM 0 HE2 PHE A 31 14.385 -9.694 -6.478 1.00 0.00 H new ATOM 0 HZ PHE A 31 14.282 -7.228 -6.188 1.00 0.00 H new ATOM 543 N SER A 32 22.052 -10.775 -6.231 1.00 0.00 N ATOM 544 CA SER A 32 23.031 -11.867 -6.221 1.00 0.00 C ATOM 545 C SER A 32 23.666 -12.110 -4.842 1.00 0.00 C ATOM 546 O SER A 32 24.243 -13.176 -4.629 1.00 0.00 O ATOM 547 CB SER A 32 24.100 -11.648 -7.293 1.00 0.00 C ATOM 548 OG SER A 32 23.512 -11.751 -8.577 1.00 0.00 O ATOM 0 H SER A 32 22.306 -9.993 -6.834 1.00 0.00 H new ATOM 0 HA SER A 32 22.478 -12.776 -6.457 1.00 0.00 H new ATOM 0 HB2 SER A 32 24.558 -10.667 -7.169 1.00 0.00 H new ATOM 0 HB3 SER A 32 24.894 -12.387 -7.185 1.00 0.00 H new ATOM 0 HG SER A 32 23.853 -12.550 -9.030 1.00 0.00 H new ATOM 554 N GLN A 33 23.539 -11.175 -3.890 1.00 0.00 N ATOM 555 CA GLN A 33 24.011 -11.380 -2.519 1.00 0.00 C ATOM 556 C GLN A 33 23.115 -12.371 -1.758 1.00 0.00 C ATOM 557 O GLN A 33 23.551 -12.913 -0.739 1.00 0.00 O ATOM 558 CB GLN A 33 24.077 -10.051 -1.743 1.00 0.00 C ATOM 559 CG GLN A 33 24.840 -8.915 -2.448 1.00 0.00 C ATOM 560 CD GLN A 33 26.325 -9.181 -2.708 1.00 0.00 C ATOM 561 OE1 GLN A 33 26.960 -10.046 -2.107 1.00 0.00 O ATOM 562 NE2 GLN A 33 26.915 -8.425 -3.619 1.00 0.00 N ATOM 0 H GLN A 33 23.110 -10.264 -4.049 1.00 0.00 H new ATOM 0 HA GLN A 33 25.015 -11.797 -2.592 1.00 0.00 H new ATOM 0 HB2 GLN A 33 23.060 -9.714 -1.544 1.00 0.00 H new ATOM 0 HB3 GLN A 33 24.546 -10.236 -0.777 1.00 0.00 H new ATOM 0 HG2 GLN A 33 24.353 -8.711 -3.402 1.00 0.00 H new ATOM 0 HG3 GLN A 33 24.751 -8.012 -1.845 1.00 0.00 H new ATOM 0 HE21 GLN A 33 26.380 -7.710 -4.112 1.00 0.00 H new ATOM 0 HE22 GLN A 33 27.905 -8.557 -3.828 1.00 0.00 H new ATOM 571 N PHE A 34 21.887 -12.622 -2.234 1.00 0.00 N ATOM 572 CA PHE A 34 20.875 -13.401 -1.519 1.00 0.00 C ATOM 573 C PHE A 34 20.329 -14.553 -2.356 1.00 0.00 C ATOM 574 O PHE A 34 19.858 -15.540 -1.792 1.00 0.00 O ATOM 575 CB PHE A 34 19.740 -12.472 -1.057 1.00 0.00 C ATOM 576 CG PHE A 34 20.201 -11.228 -0.318 1.00 0.00 C ATOM 577 CD1 PHE A 34 20.856 -11.342 0.924 1.00 0.00 C ATOM 578 CD2 PHE A 34 19.996 -9.953 -0.881 1.00 0.00 C ATOM 579 CE1 PHE A 34 21.303 -10.190 1.597 1.00 0.00 C ATOM 580 CE2 PHE A 34 20.441 -8.801 -0.207 1.00 0.00 C ATOM 581 CZ PHE A 34 21.095 -8.919 1.031 1.00 0.00 C ATOM 0 H PHE A 34 21.567 -12.283 -3.141 1.00 0.00 H new ATOM 0 HA PHE A 34 21.353 -13.851 -0.649 1.00 0.00 H new ATOM 0 HB2 PHE A 34 19.161 -12.167 -1.928 1.00 0.00 H new ATOM 0 HB3 PHE A 34 19.068 -13.035 -0.409 1.00 0.00 H new ATOM 0 HD1 PHE A 34 21.016 -12.317 1.361 1.00 0.00 H new ATOM 0 HD2 PHE A 34 19.495 -9.860 -1.833 1.00 0.00 H new ATOM 0 HE1 PHE A 34 21.806 -10.282 2.548 1.00 0.00 H new ATOM 0 HE2 PHE A 34 20.280 -7.825 -0.641 1.00 0.00 H new ATOM 0 HZ PHE A 34 21.438 -8.035 1.548 1.00 0.00 H new ATOM 591 N GLY A 35 20.441 -14.477 -3.677 1.00 0.00 N ATOM 592 CA GLY A 35 20.165 -15.578 -4.572 1.00 0.00 C ATOM 593 C GLY A 35 20.983 -15.318 -5.815 1.00 0.00 C ATOM 594 O GLY A 35 20.720 -14.350 -6.522 1.00 0.00 O ATOM 0 H GLY A 35 20.733 -13.627 -4.159 1.00 0.00 H new ATOM 0 HA2 GLY A 35 20.439 -16.530 -4.116 1.00 0.00 H new ATOM 0 HA3 GLY A 35 19.102 -15.632 -4.808 1.00 0.00 H new ATOM 598 N GLN A 36 22.019 -16.126 -6.045 1.00 0.00 N ATOM 599 CA GLN A 36 22.868 -15.968 -7.219 1.00 0.00 C ATOM 600 C GLN A 36 22.026 -16.085 -8.497 1.00 0.00 C ATOM 601 O GLN A 36 21.393 -17.111 -8.769 1.00 0.00 O ATOM 602 CB GLN A 36 24.049 -16.951 -7.188 1.00 0.00 C ATOM 603 CG GLN A 36 24.990 -16.792 -8.396 1.00 0.00 C ATOM 604 CD GLN A 36 25.467 -15.351 -8.613 1.00 0.00 C ATOM 605 OE1 GLN A 36 26.179 -14.786 -7.788 1.00 0.00 O ATOM 606 NE2 GLN A 36 25.056 -14.715 -9.701 1.00 0.00 N ATOM 0 H GLN A 36 22.288 -16.896 -5.432 1.00 0.00 H new ATOM 0 HA GLN A 36 23.307 -14.970 -7.211 1.00 0.00 H new ATOM 0 HB2 GLN A 36 24.616 -16.801 -6.269 1.00 0.00 H new ATOM 0 HB3 GLN A 36 23.666 -17.971 -7.163 1.00 0.00 H new ATOM 0 HG2 GLN A 36 25.858 -17.437 -8.258 1.00 0.00 H new ATOM 0 HG3 GLN A 36 24.477 -17.136 -9.294 1.00 0.00 H new ATOM 0 HE21 GLN A 36 24.465 -15.195 -10.380 1.00 0.00 H new ATOM 0 HE22 GLN A 36 25.331 -13.746 -9.860 1.00 0.00 H new ATOM 615 N ILE A 37 22.036 -15.004 -9.272 1.00 0.00 N ATOM 616 CA ILE A 37 21.365 -14.863 -10.553 1.00 0.00 C ATOM 617 C ILE A 37 22.009 -15.804 -11.577 1.00 0.00 C ATOM 618 O ILE A 37 23.195 -16.136 -11.475 1.00 0.00 O ATOM 619 CB ILE A 37 21.451 -13.372 -10.958 1.00 0.00 C ATOM 620 CG1 ILE A 37 20.626 -12.545 -9.944 1.00 0.00 C ATOM 621 CG2 ILE A 37 20.988 -13.095 -12.400 1.00 0.00 C ATOM 622 CD1 ILE A 37 20.683 -11.042 -10.188 1.00 0.00 C ATOM 0 H ILE A 37 22.541 -14.159 -9.005 1.00 0.00 H new ATOM 0 HA ILE A 37 20.314 -15.146 -10.499 1.00 0.00 H new ATOM 0 HB ILE A 37 22.500 -13.078 -10.935 1.00 0.00 H new ATOM 0 HG12 ILE A 37 19.587 -12.871 -9.983 1.00 0.00 H new ATOM 0 HG13 ILE A 37 20.988 -12.755 -8.938 1.00 0.00 H new ATOM 0 HG21 ILE A 37 21.076 -12.030 -12.612 1.00 0.00 H new ATOM 0 HG22 ILE A 37 21.611 -13.657 -13.096 1.00 0.00 H new ATOM 0 HG23 ILE A 37 19.948 -13.402 -12.514 1.00 0.00 H new ATOM 0 HD11 ILE A 37 20.081 -10.529 -9.438 1.00 0.00 H new ATOM 0 HD12 ILE A 37 21.716 -10.701 -10.120 1.00 0.00 H new ATOM 0 HD13 ILE A 37 20.293 -10.820 -11.181 1.00 0.00 H new ATOM 634 N LEU A 38 21.221 -16.166 -12.591 1.00 0.00 N ATOM 635 CA LEU A 38 21.612 -16.905 -13.776 1.00 0.00 C ATOM 636 C LEU A 38 21.286 -16.090 -15.039 1.00 0.00 C ATOM 637 O LEU A 38 22.089 -16.115 -15.970 1.00 0.00 O ATOM 638 CB LEU A 38 20.880 -18.258 -13.765 1.00 0.00 C ATOM 639 CG LEU A 38 21.177 -19.166 -14.972 1.00 0.00 C ATOM 640 CD1 LEU A 38 22.661 -19.536 -15.071 1.00 0.00 C ATOM 641 CD2 LEU A 38 20.345 -20.446 -14.844 1.00 0.00 C ATOM 0 H LEU A 38 20.228 -15.931 -12.599 1.00 0.00 H new ATOM 0 HA LEU A 38 22.687 -17.085 -13.779 1.00 0.00 H new ATOM 0 HB2 LEU A 38 21.147 -18.792 -12.853 1.00 0.00 H new ATOM 0 HB3 LEU A 38 19.807 -18.073 -13.723 1.00 0.00 H new ATOM 0 HG LEU A 38 20.915 -18.617 -15.877 1.00 0.00 H new ATOM 0 HD11 LEU A 38 22.819 -20.177 -15.938 1.00 0.00 H new ATOM 0 HD12 LEU A 38 23.256 -18.629 -15.177 1.00 0.00 H new ATOM 0 HD13 LEU A 38 22.965 -20.066 -14.168 1.00 0.00 H new ATOM 0 HD21 LEU A 38 20.547 -21.098 -15.694 1.00 0.00 H new ATOM 0 HD22 LEU A 38 20.610 -20.961 -13.921 1.00 0.00 H new ATOM 0 HD23 LEU A 38 19.285 -20.191 -14.826 1.00 0.00 H new ATOM 653 N ASP A 39 20.175 -15.334 -15.081 1.00 0.00 N ATOM 654 CA ASP A 39 19.850 -14.432 -16.204 1.00 0.00 C ATOM 655 C ASP A 39 18.855 -13.347 -15.765 1.00 0.00 C ATOM 656 O ASP A 39 18.203 -13.513 -14.739 1.00 0.00 O ATOM 657 CB ASP A 39 19.287 -15.236 -17.393 1.00 0.00 C ATOM 658 CG ASP A 39 19.050 -14.369 -18.642 1.00 0.00 C ATOM 659 OD1 ASP A 39 19.847 -13.440 -18.902 1.00 0.00 O ATOM 660 OD2 ASP A 39 18.080 -14.639 -19.385 1.00 0.00 O ATOM 0 H ASP A 39 19.476 -15.330 -14.338 1.00 0.00 H new ATOM 0 HA ASP A 39 20.768 -13.939 -16.523 1.00 0.00 H new ATOM 0 HB2 ASP A 39 19.979 -16.041 -17.641 1.00 0.00 H new ATOM 0 HB3 ASP A 39 18.348 -15.703 -17.097 1.00 0.00 H new ATOM 665 N ILE A 40 18.709 -12.245 -16.509 1.00 0.00 N ATOM 666 CA ILE A 40 17.882 -11.083 -16.167 1.00 0.00 C ATOM 667 C ILE A 40 17.168 -10.624 -17.448 1.00 0.00 C ATOM 668 O ILE A 40 17.762 -10.652 -18.530 1.00 0.00 O ATOM 669 CB ILE A 40 18.752 -9.934 -15.582 1.00 0.00 C ATOM 670 CG1 ILE A 40 19.658 -10.386 -14.411 1.00 0.00 C ATOM 671 CG2 ILE A 40 17.840 -8.768 -15.143 1.00 0.00 C ATOM 672 CD1 ILE A 40 20.641 -9.321 -13.905 1.00 0.00 C ATOM 0 H ILE A 40 19.185 -12.134 -17.404 1.00 0.00 H new ATOM 0 HA ILE A 40 17.153 -11.354 -15.403 1.00 0.00 H new ATOM 0 HB ILE A 40 19.425 -9.606 -16.374 1.00 0.00 H new ATOM 0 HG12 ILE A 40 19.025 -10.698 -13.581 1.00 0.00 H new ATOM 0 HG13 ILE A 40 20.225 -11.262 -14.727 1.00 0.00 H new ATOM 0 HG21 ILE A 40 18.450 -7.963 -14.733 1.00 0.00 H new ATOM 0 HG22 ILE A 40 17.282 -8.398 -16.004 1.00 0.00 H new ATOM 0 HG23 ILE A 40 17.143 -9.118 -14.382 1.00 0.00 H new ATOM 0 HD11 ILE A 40 21.231 -9.731 -13.085 1.00 0.00 H new ATOM 0 HD12 ILE A 40 21.305 -9.023 -14.717 1.00 0.00 H new ATOM 0 HD13 ILE A 40 20.086 -8.451 -13.553 1.00 0.00 H new ATOM 684 N VAL A 41 15.918 -10.162 -17.327 1.00 0.00 N ATOM 685 CA VAL A 41 15.083 -9.692 -18.427 1.00 0.00 C ATOM 686 C VAL A 41 14.311 -8.451 -17.950 1.00 0.00 C ATOM 687 O VAL A 41 13.440 -8.542 -17.084 1.00 0.00 O ATOM 688 CB VAL A 41 14.132 -10.823 -18.895 1.00 0.00 C ATOM 689 CG1 VAL A 41 13.291 -10.380 -20.104 1.00 0.00 C ATOM 690 CG2 VAL A 41 14.870 -12.117 -19.283 1.00 0.00 C ATOM 0 H VAL A 41 15.447 -10.105 -16.424 1.00 0.00 H new ATOM 0 HA VAL A 41 15.695 -9.416 -19.286 1.00 0.00 H new ATOM 0 HB VAL A 41 13.494 -11.030 -18.035 1.00 0.00 H new ATOM 0 HG11 VAL A 41 12.634 -11.195 -20.409 1.00 0.00 H new ATOM 0 HG12 VAL A 41 12.690 -9.512 -19.831 1.00 0.00 H new ATOM 0 HG13 VAL A 41 13.952 -10.118 -20.930 1.00 0.00 H new ATOM 0 HG21 VAL A 41 14.146 -12.867 -19.601 1.00 0.00 H new ATOM 0 HG22 VAL A 41 15.561 -11.911 -20.100 1.00 0.00 H new ATOM 0 HG23 VAL A 41 15.426 -12.491 -18.423 1.00 0.00 H new ATOM 700 N ALA A 42 14.619 -7.290 -18.526 1.00 0.00 N ATOM 701 CA ALA A 42 13.884 -6.037 -18.394 1.00 0.00 C ATOM 702 C ALA A 42 13.992 -5.336 -19.752 1.00 0.00 C ATOM 703 O ALA A 42 14.930 -5.618 -20.504 1.00 0.00 O ATOM 704 CB ALA A 42 14.483 -5.183 -17.273 1.00 0.00 C ATOM 0 H ALA A 42 15.435 -7.195 -19.131 1.00 0.00 H new ATOM 0 HA ALA A 42 12.840 -6.206 -18.129 1.00 0.00 H new ATOM 0 HB1 ALA A 42 13.924 -4.251 -17.187 1.00 0.00 H new ATOM 0 HB2 ALA A 42 14.427 -5.728 -16.331 1.00 0.00 H new ATOM 0 HB3 ALA A 42 15.525 -4.961 -17.502 1.00 0.00 H new ATOM 710 N LEU A 43 13.052 -4.453 -20.094 1.00 0.00 N ATOM 711 CA LEU A 43 12.999 -3.815 -21.411 1.00 0.00 C ATOM 712 C LEU A 43 12.154 -2.543 -21.313 1.00 0.00 C ATOM 713 O LEU A 43 11.198 -2.504 -20.543 1.00 0.00 O ATOM 714 CB LEU A 43 12.395 -4.821 -22.413 1.00 0.00 C ATOM 715 CG LEU A 43 12.396 -4.388 -23.890 1.00 0.00 C ATOM 716 CD1 LEU A 43 13.810 -4.120 -24.420 1.00 0.00 C ATOM 717 CD2 LEU A 43 11.755 -5.505 -24.720 1.00 0.00 C ATOM 0 H LEU A 43 12.305 -4.160 -19.465 1.00 0.00 H new ATOM 0 HA LEU A 43 13.994 -3.534 -21.755 1.00 0.00 H new ATOM 0 HB2 LEU A 43 12.943 -5.759 -22.330 1.00 0.00 H new ATOM 0 HB3 LEU A 43 11.366 -5.026 -22.116 1.00 0.00 H new ATOM 0 HG LEU A 43 11.835 -3.457 -23.971 1.00 0.00 H new ATOM 0 HD11 LEU A 43 13.755 -3.818 -25.466 1.00 0.00 H new ATOM 0 HD12 LEU A 43 14.273 -3.324 -23.836 1.00 0.00 H new ATOM 0 HD13 LEU A 43 14.408 -5.027 -24.335 1.00 0.00 H new ATOM 0 HD21 LEU A 43 11.746 -5.218 -25.771 1.00 0.00 H new ATOM 0 HD22 LEU A 43 12.330 -6.423 -24.600 1.00 0.00 H new ATOM 0 HD23 LEU A 43 10.733 -5.670 -24.380 1.00 0.00 H new ATOM 729 N LYS A 44 12.496 -1.501 -22.082 1.00 0.00 N ATOM 730 CA LYS A 44 11.832 -0.193 -22.003 1.00 0.00 C ATOM 731 C LYS A 44 10.451 -0.155 -22.667 1.00 0.00 C ATOM 732 O LYS A 44 9.753 0.855 -22.524 1.00 0.00 O ATOM 733 CB LYS A 44 12.752 0.893 -22.602 1.00 0.00 C ATOM 734 CG LYS A 44 13.856 1.370 -21.641 1.00 0.00 C ATOM 735 CD LYS A 44 13.313 2.314 -20.552 1.00 0.00 C ATOM 736 CE LYS A 44 14.447 2.865 -19.680 1.00 0.00 C ATOM 737 NZ LYS A 44 13.973 3.921 -18.749 1.00 0.00 N ATOM 0 H LYS A 44 13.241 -1.541 -22.777 1.00 0.00 H new ATOM 0 HA LYS A 44 11.655 0.003 -20.946 1.00 0.00 H new ATOM 0 HB2 LYS A 44 13.215 0.504 -23.509 1.00 0.00 H new ATOM 0 HB3 LYS A 44 12.145 1.749 -22.896 1.00 0.00 H new ATOM 0 HG2 LYS A 44 14.323 0.505 -21.170 1.00 0.00 H new ATOM 0 HG3 LYS A 44 14.633 1.882 -22.209 1.00 0.00 H new ATOM 0 HD2 LYS A 44 12.775 3.140 -21.018 1.00 0.00 H new ATOM 0 HD3 LYS A 44 12.597 1.779 -19.927 1.00 0.00 H new ATOM 0 HE2 LYS A 44 14.892 2.051 -19.108 1.00 0.00 H new ATOM 0 HE3 LYS A 44 15.231 3.271 -20.319 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 14.742 4.181 -18.099 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 13.681 4.758 -19.293 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 13.164 3.564 -18.202 1.00 0.00 H new ATOM 751 N THR A 45 10.043 -1.194 -23.395 1.00 0.00 N ATOM 752 CA THR A 45 8.706 -1.289 -23.970 1.00 0.00 C ATOM 753 C THR A 45 7.669 -1.216 -22.842 1.00 0.00 C ATOM 754 O THR A 45 7.927 -1.727 -21.753 1.00 0.00 O ATOM 755 CB THR A 45 8.603 -2.607 -24.758 1.00 0.00 C ATOM 756 OG1 THR A 45 9.116 -3.684 -23.995 1.00 0.00 O ATOM 757 CG2 THR A 45 9.407 -2.561 -26.059 1.00 0.00 C ATOM 0 H THR A 45 10.636 -1.997 -23.602 1.00 0.00 H new ATOM 0 HA THR A 45 8.513 -0.464 -24.655 1.00 0.00 H new ATOM 0 HB THR A 45 7.545 -2.747 -24.980 1.00 0.00 H new ATOM 0 HG1 THR A 45 8.512 -3.871 -23.246 1.00 0.00 H new ATOM 0 HG21 THR A 45 9.306 -3.511 -26.583 1.00 0.00 H new ATOM 0 HG22 THR A 45 9.031 -1.757 -26.691 1.00 0.00 H new ATOM 0 HG23 THR A 45 10.458 -2.382 -25.831 1.00 0.00 H new ATOM 765 N LEU A 46 6.485 -0.642 -23.087 1.00 0.00 N ATOM 766 CA LEU A 46 5.440 -0.446 -22.069 1.00 0.00 C ATOM 767 C LEU A 46 5.147 -1.733 -21.288 1.00 0.00 C ATOM 768 O LEU A 46 5.043 -1.699 -20.063 1.00 0.00 O ATOM 769 CB LEU A 46 4.186 0.124 -22.764 1.00 0.00 C ATOM 770 CG LEU A 46 2.946 0.448 -21.897 1.00 0.00 C ATOM 771 CD1 LEU A 46 2.081 -0.774 -21.561 1.00 0.00 C ATOM 772 CD2 LEU A 46 3.295 1.217 -20.619 1.00 0.00 C ATOM 0 H LEU A 46 6.220 -0.295 -24.009 1.00 0.00 H new ATOM 0 HA LEU A 46 5.787 0.267 -21.321 1.00 0.00 H new ATOM 0 HB2 LEU A 46 4.479 1.039 -23.279 1.00 0.00 H new ATOM 0 HB3 LEU A 46 3.879 -0.588 -23.530 1.00 0.00 H new ATOM 0 HG LEU A 46 2.345 1.098 -22.533 1.00 0.00 H new ATOM 0 HD11 LEU A 46 1.233 -0.463 -20.951 1.00 0.00 H new ATOM 0 HD12 LEU A 46 1.718 -1.227 -22.483 1.00 0.00 H new ATOM 0 HD13 LEU A 46 2.677 -1.501 -21.009 1.00 0.00 H new ATOM 0 HD21 LEU A 46 2.385 1.415 -20.053 1.00 0.00 H new ATOM 0 HD22 LEU A 46 3.978 0.623 -20.012 1.00 0.00 H new ATOM 0 HD23 LEU A 46 3.772 2.162 -20.881 1.00 0.00 H new ATOM 784 N LYS A 47 5.100 -2.877 -21.981 1.00 0.00 N ATOM 785 CA LYS A 47 4.877 -4.199 -21.383 1.00 0.00 C ATOM 786 C LYS A 47 5.879 -4.584 -20.282 1.00 0.00 C ATOM 787 O LYS A 47 5.580 -5.489 -19.502 1.00 0.00 O ATOM 788 CB LYS A 47 4.858 -5.275 -22.490 1.00 0.00 C ATOM 789 CG LYS A 47 6.160 -5.317 -23.316 1.00 0.00 C ATOM 790 CD LYS A 47 6.183 -6.485 -24.307 1.00 0.00 C ATOM 791 CE LYS A 47 7.481 -6.453 -25.131 1.00 0.00 C ATOM 792 NZ LYS A 47 7.608 -7.637 -26.018 1.00 0.00 N ATOM 0 H LYS A 47 5.218 -2.910 -22.994 1.00 0.00 H new ATOM 0 HA LYS A 47 3.910 -4.142 -20.884 1.00 0.00 H new ATOM 0 HB2 LYS A 47 4.691 -6.252 -22.036 1.00 0.00 H new ATOM 0 HB3 LYS A 47 4.017 -5.086 -23.158 1.00 0.00 H new ATOM 0 HG2 LYS A 47 6.273 -4.379 -23.860 1.00 0.00 H new ATOM 0 HG3 LYS A 47 7.013 -5.399 -22.642 1.00 0.00 H new ATOM 0 HD2 LYS A 47 6.108 -7.430 -23.769 1.00 0.00 H new ATOM 0 HD3 LYS A 47 5.320 -6.426 -24.971 1.00 0.00 H new ATOM 0 HE2 LYS A 47 7.505 -5.545 -25.733 1.00 0.00 H new ATOM 0 HE3 LYS A 47 8.337 -6.412 -24.457 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 8.286 -7.429 -26.779 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 7.947 -8.450 -25.465 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 6.681 -7.862 -26.432 1.00 0.00 H new ATOM 806 N MET A 48 7.056 -3.952 -20.227 1.00 0.00 N ATOM 807 CA MET A 48 8.167 -4.331 -19.357 1.00 0.00 C ATOM 808 C MET A 48 8.805 -3.134 -18.642 1.00 0.00 C ATOM 809 O MET A 48 9.653 -3.340 -17.777 1.00 0.00 O ATOM 810 CB MET A 48 9.213 -5.112 -20.169 1.00 0.00 C ATOM 811 CG MET A 48 8.820 -6.583 -20.350 1.00 0.00 C ATOM 812 SD MET A 48 8.609 -7.554 -18.829 1.00 0.00 S ATOM 813 CE MET A 48 10.243 -7.389 -18.067 1.00 0.00 C ATOM 0 H MET A 48 7.265 -3.138 -20.805 1.00 0.00 H new ATOM 0 HA MET A 48 7.764 -4.968 -18.570 1.00 0.00 H new ATOM 0 HB2 MET A 48 9.334 -4.646 -21.147 1.00 0.00 H new ATOM 0 HB3 MET A 48 10.179 -5.054 -19.667 1.00 0.00 H new ATOM 0 HG2 MET A 48 7.887 -6.621 -20.912 1.00 0.00 H new ATOM 0 HG3 MET A 48 9.581 -7.067 -20.962 1.00 0.00 H new ATOM 0 HE1 MET A 48 10.381 -8.178 -17.328 1.00 0.00 H new ATOM 0 HE2 MET A 48 11.012 -7.472 -18.835 1.00 0.00 H new ATOM 0 HE3 MET A 48 10.320 -6.417 -17.579 1.00 0.00 H new ATOM 823 N ARG A 49 8.415 -1.890 -18.944 1.00 0.00 N ATOM 824 CA ARG A 49 9.110 -0.708 -18.436 1.00 0.00 C ATOM 825 C ARG A 49 9.064 -0.591 -16.906 1.00 0.00 C ATOM 826 O ARG A 49 9.966 0.013 -16.329 1.00 0.00 O ATOM 827 CB ARG A 49 8.543 0.552 -19.113 1.00 0.00 C ATOM 828 CG ARG A 49 9.590 1.675 -19.181 1.00 0.00 C ATOM 829 CD ARG A 49 8.969 3.005 -19.611 1.00 0.00 C ATOM 830 NE ARG A 49 8.562 3.013 -21.022 1.00 0.00 N ATOM 831 CZ ARG A 49 7.774 3.940 -21.578 1.00 0.00 C ATOM 832 NH1 ARG A 49 7.286 4.946 -20.853 1.00 0.00 N ATOM 833 NH2 ARG A 49 7.481 3.848 -22.872 1.00 0.00 N ATOM 0 H ARG A 49 7.616 -1.678 -19.542 1.00 0.00 H new ATOM 0 HA ARG A 49 10.165 -0.813 -18.689 1.00 0.00 H new ATOM 0 HB2 ARG A 49 8.207 0.305 -20.120 1.00 0.00 H new ATOM 0 HB3 ARG A 49 7.670 0.900 -18.562 1.00 0.00 H new ATOM 0 HG2 ARG A 49 10.061 1.792 -18.205 1.00 0.00 H new ATOM 0 HG3 ARG A 49 10.376 1.397 -19.883 1.00 0.00 H new ATOM 0 HD2 ARG A 49 8.101 3.214 -18.986 1.00 0.00 H new ATOM 0 HD3 ARG A 49 9.686 3.808 -19.440 1.00 0.00 H new ATOM 0 HE ARG A 49 8.904 2.260 -21.619 1.00 0.00 H new ATOM 0 HH11 ARG A 49 7.512 5.016 -19.861 1.00 0.00 H new ATOM 0 HH12 ARG A 49 6.686 5.646 -21.290 1.00 0.00 H new ATOM 0 HH21 ARG A 49 7.856 3.078 -23.426 1.00 0.00 H new ATOM 0 HH22 ARG A 49 6.881 4.547 -23.310 1.00 0.00 H new ATOM 847 N GLY A 50 8.046 -1.147 -16.244 1.00 0.00 N ATOM 848 CA GLY A 50 7.817 -1.014 -14.806 1.00 0.00 C ATOM 849 C GLY A 50 7.945 -2.348 -14.068 1.00 0.00 C ATOM 850 O GLY A 50 7.476 -2.470 -12.932 1.00 0.00 O ATOM 0 H GLY A 50 7.339 -1.718 -16.708 1.00 0.00 H new ATOM 0 HA2 GLY A 50 8.532 -0.303 -14.392 1.00 0.00 H new ATOM 0 HA3 GLY A 50 6.822 -0.602 -14.636 1.00 0.00 H new ATOM 854 N GLN A 51 8.556 -3.355 -14.697 1.00 0.00 N ATOM 855 CA GLN A 51 8.710 -4.696 -14.158 1.00 0.00 C ATOM 856 C GLN A 51 10.021 -5.306 -14.666 1.00 0.00 C ATOM 857 O GLN A 51 10.715 -4.719 -15.496 1.00 0.00 O ATOM 858 CB GLN A 51 7.472 -5.562 -14.493 1.00 0.00 C ATOM 859 CG GLN A 51 7.032 -5.611 -15.966 1.00 0.00 C ATOM 860 CD GLN A 51 6.061 -4.480 -16.326 1.00 0.00 C ATOM 861 OE1 GLN A 51 6.449 -3.446 -16.861 1.00 0.00 O ATOM 862 NE2 GLN A 51 4.782 -4.627 -16.023 1.00 0.00 N ATOM 0 H GLN A 51 8.968 -3.250 -15.624 1.00 0.00 H new ATOM 0 HA GLN A 51 8.770 -4.655 -13.070 1.00 0.00 H new ATOM 0 HB2 GLN A 51 7.673 -6.582 -14.166 1.00 0.00 H new ATOM 0 HB3 GLN A 51 6.633 -5.197 -13.901 1.00 0.00 H new ATOM 0 HG2 GLN A 51 7.911 -5.548 -16.607 1.00 0.00 H new ATOM 0 HG3 GLN A 51 6.558 -6.571 -16.169 1.00 0.00 H new ATOM 0 HE21 GLN A 51 4.459 -5.486 -15.578 1.00 0.00 H new ATOM 0 HE22 GLN A 51 4.119 -3.881 -16.234 1.00 0.00 H new ATOM 871 N ALA A 52 10.376 -6.483 -14.162 1.00 0.00 N ATOM 872 CA ALA A 52 11.523 -7.259 -14.599 1.00 0.00 C ATOM 873 C ALA A 52 11.273 -8.715 -14.220 1.00 0.00 C ATOM 874 O ALA A 52 10.502 -9.004 -13.303 1.00 0.00 O ATOM 875 CB ALA A 52 12.810 -6.752 -13.925 1.00 0.00 C ATOM 0 H ALA A 52 9.853 -6.935 -13.412 1.00 0.00 H new ATOM 0 HA ALA A 52 11.651 -7.160 -15.677 1.00 0.00 H new ATOM 0 HB1 ALA A 52 13.658 -7.347 -14.266 1.00 0.00 H new ATOM 0 HB2 ALA A 52 12.971 -5.707 -14.188 1.00 0.00 H new ATOM 0 HB3 ALA A 52 12.714 -6.843 -12.843 1.00 0.00 H new ATOM 881 N PHE A 53 11.971 -9.618 -14.892 1.00 0.00 N ATOM 882 CA PHE A 53 12.047 -11.025 -14.537 1.00 0.00 C ATOM 883 C PHE A 53 13.528 -11.343 -14.368 1.00 0.00 C ATOM 884 O PHE A 53 14.378 -10.753 -15.040 1.00 0.00 O ATOM 885 CB PHE A 53 11.396 -11.910 -15.609 1.00 0.00 C ATOM 886 CG PHE A 53 9.907 -11.683 -15.812 1.00 0.00 C ATOM 887 CD1 PHE A 53 8.975 -12.293 -14.949 1.00 0.00 C ATOM 888 CD2 PHE A 53 9.448 -10.879 -16.874 1.00 0.00 C ATOM 889 CE1 PHE A 53 7.597 -12.095 -15.147 1.00 0.00 C ATOM 890 CE2 PHE A 53 8.069 -10.676 -17.060 1.00 0.00 C ATOM 891 CZ PHE A 53 7.143 -11.275 -16.191 1.00 0.00 C ATOM 0 H PHE A 53 12.515 -9.384 -15.723 1.00 0.00 H new ATOM 0 HA PHE A 53 11.499 -11.228 -13.617 1.00 0.00 H new ATOM 0 HB2 PHE A 53 11.907 -11.741 -16.557 1.00 0.00 H new ATOM 0 HB3 PHE A 53 11.556 -12.955 -15.342 1.00 0.00 H new ATOM 0 HD1 PHE A 53 9.319 -12.913 -14.135 1.00 0.00 H new ATOM 0 HD2 PHE A 53 10.156 -10.418 -17.546 1.00 0.00 H new ATOM 0 HE1 PHE A 53 6.885 -12.576 -14.493 1.00 0.00 H new ATOM 0 HE2 PHE A 53 7.721 -10.057 -17.874 1.00 0.00 H new ATOM 0 HZ PHE A 53 6.085 -11.105 -16.326 1.00 0.00 H new ATOM 901 N VAL A 54 13.860 -12.264 -13.474 1.00 0.00 N ATOM 902 CA VAL A 54 15.242 -12.648 -13.220 1.00 0.00 C ATOM 903 C VAL A 54 15.227 -14.114 -12.814 1.00 0.00 C ATOM 904 O VAL A 54 14.387 -14.546 -12.021 1.00 0.00 O ATOM 905 CB VAL A 54 15.923 -11.676 -12.227 1.00 0.00 C ATOM 906 CG1 VAL A 54 15.057 -11.304 -11.014 1.00 0.00 C ATOM 907 CG2 VAL A 54 17.268 -12.192 -11.707 1.00 0.00 C ATOM 0 H VAL A 54 13.179 -12.766 -12.904 1.00 0.00 H new ATOM 0 HA VAL A 54 15.869 -12.561 -14.108 1.00 0.00 H new ATOM 0 HB VAL A 54 16.078 -10.782 -12.830 1.00 0.00 H new ATOM 0 HG11 VAL A 54 15.609 -10.620 -10.369 1.00 0.00 H new ATOM 0 HG12 VAL A 54 14.141 -10.822 -11.355 1.00 0.00 H new ATOM 0 HG13 VAL A 54 14.806 -12.206 -10.456 1.00 0.00 H new ATOM 0 HG21 VAL A 54 17.694 -11.465 -11.016 1.00 0.00 H new ATOM 0 HG22 VAL A 54 17.119 -13.140 -11.190 1.00 0.00 H new ATOM 0 HG23 VAL A 54 17.950 -12.339 -12.545 1.00 0.00 H new ATOM 917 N ILE A 55 16.114 -14.868 -13.453 1.00 0.00 N ATOM 918 CA ILE A 55 16.260 -16.305 -13.396 1.00 0.00 C ATOM 919 C ILE A 55 17.477 -16.520 -12.499 1.00 0.00 C ATOM 920 O ILE A 55 18.474 -15.802 -12.635 1.00 0.00 O ATOM 921 CB ILE A 55 16.490 -16.879 -14.821 1.00 0.00 C ATOM 922 CG1 ILE A 55 15.419 -16.566 -15.906 1.00 0.00 C ATOM 923 CG2 ILE A 55 16.622 -18.411 -14.743 1.00 0.00 C ATOM 924 CD1 ILE A 55 15.295 -15.106 -16.372 1.00 0.00 C ATOM 0 H ILE A 55 16.804 -14.447 -14.075 1.00 0.00 H new ATOM 0 HA ILE A 55 15.376 -16.812 -13.009 1.00 0.00 H new ATOM 0 HB ILE A 55 17.395 -16.367 -15.148 1.00 0.00 H new ATOM 0 HG12 ILE A 55 15.633 -17.182 -16.779 1.00 0.00 H new ATOM 0 HG13 ILE A 55 14.448 -16.882 -15.523 1.00 0.00 H new ATOM 0 HG21 ILE A 55 16.783 -18.814 -15.743 1.00 0.00 H new ATOM 0 HG22 ILE A 55 17.467 -18.671 -14.106 1.00 0.00 H new ATOM 0 HG23 ILE A 55 15.709 -18.834 -14.325 1.00 0.00 H new ATOM 0 HD11 ILE A 55 14.513 -15.030 -17.128 1.00 0.00 H new ATOM 0 HD12 ILE A 55 15.040 -14.473 -15.522 1.00 0.00 H new ATOM 0 HD13 ILE A 55 16.243 -14.778 -16.797 1.00 0.00 H new ATOM 936 N PHE A 56 17.429 -17.520 -11.624 1.00 0.00 N ATOM 937 CA PHE A 56 18.477 -17.829 -10.659 1.00 0.00 C ATOM 938 C PHE A 56 18.946 -19.264 -10.874 1.00 0.00 C ATOM 939 O PHE A 56 18.387 -19.999 -11.693 1.00 0.00 O ATOM 940 CB PHE A 56 17.964 -17.618 -9.226 1.00 0.00 C ATOM 941 CG PHE A 56 17.437 -16.222 -8.942 1.00 0.00 C ATOM 942 CD1 PHE A 56 16.130 -15.859 -9.313 1.00 0.00 C ATOM 943 CD2 PHE A 56 18.264 -15.271 -8.317 1.00 0.00 C ATOM 944 CE1 PHE A 56 15.669 -14.555 -9.069 1.00 0.00 C ATOM 945 CE2 PHE A 56 17.795 -13.973 -8.056 1.00 0.00 C ATOM 946 CZ PHE A 56 16.495 -13.612 -8.437 1.00 0.00 C ATOM 0 H PHE A 56 16.634 -18.157 -11.566 1.00 0.00 H new ATOM 0 HA PHE A 56 19.323 -17.157 -10.806 1.00 0.00 H new ATOM 0 HB2 PHE A 56 17.171 -18.339 -9.028 1.00 0.00 H new ATOM 0 HB3 PHE A 56 18.773 -17.835 -8.529 1.00 0.00 H new ATOM 0 HD1 PHE A 56 15.481 -16.582 -9.785 1.00 0.00 H new ATOM 0 HD2 PHE A 56 19.271 -15.542 -8.035 1.00 0.00 H new ATOM 0 HE1 PHE A 56 14.670 -14.275 -9.370 1.00 0.00 H new ATOM 0 HE2 PHE A 56 18.434 -13.255 -7.563 1.00 0.00 H new ATOM 0 HZ PHE A 56 16.131 -12.613 -8.245 1.00 0.00 H new ATOM 956 N LYS A 57 19.988 -19.677 -10.154 1.00 0.00 N ATOM 957 CA LYS A 57 20.547 -21.018 -10.318 1.00 0.00 C ATOM 958 C LYS A 57 19.666 -22.102 -9.700 1.00 0.00 C ATOM 959 O LYS A 57 19.766 -23.256 -10.117 1.00 0.00 O ATOM 960 CB LYS A 57 21.969 -21.070 -9.743 1.00 0.00 C ATOM 961 CG LYS A 57 22.873 -20.136 -10.564 1.00 0.00 C ATOM 962 CD LYS A 57 24.356 -20.258 -10.214 1.00 0.00 C ATOM 963 CE LYS A 57 25.117 -19.304 -11.144 1.00 0.00 C ATOM 964 NZ LYS A 57 26.589 -19.387 -10.964 1.00 0.00 N ATOM 0 H LYS A 57 20.461 -19.105 -9.454 1.00 0.00 H new ATOM 0 HA LYS A 57 20.586 -21.226 -11.387 1.00 0.00 H new ATOM 0 HB2 LYS A 57 21.964 -20.765 -8.696 1.00 0.00 H new ATOM 0 HB3 LYS A 57 22.352 -22.090 -9.776 1.00 0.00 H new ATOM 0 HG2 LYS A 57 22.739 -20.353 -11.624 1.00 0.00 H new ATOM 0 HG3 LYS A 57 22.555 -19.105 -10.407 1.00 0.00 H new ATOM 0 HD2 LYS A 57 24.528 -19.997 -9.170 1.00 0.00 H new ATOM 0 HD3 LYS A 57 24.701 -21.283 -10.348 1.00 0.00 H new ATOM 0 HE2 LYS A 57 24.867 -19.535 -12.179 1.00 0.00 H new ATOM 0 HE3 LYS A 57 24.789 -18.281 -10.958 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 27.056 -18.724 -11.615 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 26.833 -19.140 -9.984 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 26.910 -20.355 -11.168 1.00 0.00 H new ATOM 978 N GLU A 58 18.819 -21.769 -8.723 1.00 0.00 N ATOM 979 CA GLU A 58 18.039 -22.748 -7.979 1.00 0.00 C ATOM 980 C GLU A 58 16.802 -22.063 -7.394 1.00 0.00 C ATOM 981 O GLU A 58 16.825 -20.862 -7.107 1.00 0.00 O ATOM 982 CB GLU A 58 18.947 -23.344 -6.885 1.00 0.00 C ATOM 983 CG GLU A 58 18.323 -24.453 -6.034 1.00 0.00 C ATOM 984 CD GLU A 58 17.809 -25.634 -6.877 1.00 0.00 C ATOM 985 OE1 GLU A 58 16.703 -25.518 -7.448 1.00 0.00 O ATOM 986 OE2 GLU A 58 18.498 -26.676 -6.959 1.00 0.00 O ATOM 0 H GLU A 58 18.658 -20.806 -8.428 1.00 0.00 H new ATOM 0 HA GLU A 58 17.690 -23.557 -8.620 1.00 0.00 H new ATOM 0 HB2 GLU A 58 19.846 -23.738 -7.360 1.00 0.00 H new ATOM 0 HB3 GLU A 58 19.264 -22.538 -6.223 1.00 0.00 H new ATOM 0 HG2 GLU A 58 19.062 -24.817 -5.320 1.00 0.00 H new ATOM 0 HG3 GLU A 58 17.497 -24.039 -5.455 1.00 0.00 H new ATOM 993 N ILE A 59 15.724 -22.828 -7.201 1.00 0.00 N ATOM 994 CA ILE A 59 14.440 -22.317 -6.724 1.00 0.00 C ATOM 995 C ILE A 59 14.545 -21.754 -5.301 1.00 0.00 C ATOM 996 O ILE A 59 13.854 -20.791 -4.969 1.00 0.00 O ATOM 997 CB ILE A 59 13.337 -23.400 -6.850 1.00 0.00 C ATOM 998 CG1 ILE A 59 13.477 -24.540 -5.811 1.00 0.00 C ATOM 999 CG2 ILE A 59 13.289 -23.960 -8.284 1.00 0.00 C ATOM 1000 CD1 ILE A 59 12.424 -25.648 -5.940 1.00 0.00 C ATOM 0 H ILE A 59 15.721 -23.833 -7.375 1.00 0.00 H new ATOM 0 HA ILE A 59 14.151 -21.482 -7.362 1.00 0.00 H new ATOM 0 HB ILE A 59 12.390 -22.907 -6.630 1.00 0.00 H new ATOM 0 HG12 ILE A 59 14.468 -24.984 -5.908 1.00 0.00 H new ATOM 0 HG13 ILE A 59 13.416 -24.112 -4.810 1.00 0.00 H new ATOM 0 HG21 ILE A 59 12.509 -24.718 -8.353 1.00 0.00 H new ATOM 0 HG22 ILE A 59 13.072 -23.152 -8.983 1.00 0.00 H new ATOM 0 HG23 ILE A 59 14.252 -24.406 -8.533 1.00 0.00 H new ATOM 0 HD11 ILE A 59 12.596 -26.405 -5.174 1.00 0.00 H new ATOM 0 HD12 ILE A 59 11.429 -25.221 -5.811 1.00 0.00 H new ATOM 0 HD13 ILE A 59 12.497 -26.106 -6.926 1.00 0.00 H new ATOM 1012 N GLY A 60 15.423 -22.309 -4.458 1.00 0.00 N ATOM 1013 CA GLY A 60 15.629 -21.812 -3.103 1.00 0.00 C ATOM 1014 C GLY A 60 16.350 -20.467 -3.122 1.00 0.00 C ATOM 1015 O GLY A 60 16.025 -19.578 -2.335 1.00 0.00 O ATOM 0 H GLY A 60 16.005 -23.111 -4.699 1.00 0.00 H new ATOM 0 HA2 GLY A 60 14.668 -21.707 -2.599 1.00 0.00 H new ATOM 0 HA3 GLY A 60 16.212 -22.534 -2.531 1.00 0.00 H new ATOM 1019 N SER A 61 17.277 -20.283 -4.064 1.00 0.00 N ATOM 1020 CA SER A 61 18.009 -19.035 -4.232 1.00 0.00 C ATOM 1021 C SER A 61 17.048 -17.955 -4.727 1.00 0.00 C ATOM 1022 O SER A 61 17.025 -16.855 -4.174 1.00 0.00 O ATOM 1023 CB SER A 61 19.164 -19.246 -5.221 1.00 0.00 C ATOM 1024 OG SER A 61 19.955 -20.360 -4.842 1.00 0.00 O ATOM 0 H SER A 61 17.540 -21.005 -4.735 1.00 0.00 H new ATOM 0 HA SER A 61 18.432 -18.714 -3.280 1.00 0.00 H new ATOM 0 HB2 SER A 61 18.766 -19.401 -6.224 1.00 0.00 H new ATOM 0 HB3 SER A 61 19.784 -18.350 -5.259 1.00 0.00 H new ATOM 0 HG SER A 61 20.684 -20.478 -5.486 1.00 0.00 H new ATOM 1030 N ALA A 62 16.205 -18.295 -5.707 1.00 0.00 N ATOM 1031 CA ALA A 62 15.146 -17.424 -6.187 1.00 0.00 C ATOM 1032 C ALA A 62 14.227 -17.012 -5.036 1.00 0.00 C ATOM 1033 O ALA A 62 13.950 -15.827 -4.872 1.00 0.00 O ATOM 1034 CB ALA A 62 14.356 -18.162 -7.268 1.00 0.00 C ATOM 0 H ALA A 62 16.245 -19.193 -6.189 1.00 0.00 H new ATOM 0 HA ALA A 62 15.580 -16.516 -6.607 1.00 0.00 H new ATOM 0 HB1 ALA A 62 13.557 -17.519 -7.638 1.00 0.00 H new ATOM 0 HB2 ALA A 62 15.022 -18.423 -8.091 1.00 0.00 H new ATOM 0 HB3 ALA A 62 13.925 -19.071 -6.847 1.00 0.00 H new ATOM 1040 N SER A 63 13.794 -17.969 -4.209 1.00 0.00 N ATOM 1041 CA SER A 63 12.914 -17.703 -3.075 1.00 0.00 C ATOM 1042 C SER A 63 13.566 -16.759 -2.069 1.00 0.00 C ATOM 1043 O SER A 63 12.917 -15.837 -1.568 1.00 0.00 O ATOM 1044 CB SER A 63 12.531 -19.016 -2.382 1.00 0.00 C ATOM 1045 OG SER A 63 11.956 -19.924 -3.298 1.00 0.00 O ATOM 0 H SER A 63 14.047 -18.952 -4.311 1.00 0.00 H new ATOM 0 HA SER A 63 12.016 -17.220 -3.460 1.00 0.00 H new ATOM 0 HB2 SER A 63 13.416 -19.463 -1.928 1.00 0.00 H new ATOM 0 HB3 SER A 63 11.827 -18.813 -1.575 1.00 0.00 H new ATOM 0 HG SER A 63 12.666 -20.423 -3.754 1.00 0.00 H new ATOM 1051 N ASN A 64 14.850 -16.969 -1.774 1.00 0.00 N ATOM 1052 CA ASN A 64 15.550 -16.165 -0.783 1.00 0.00 C ATOM 1053 C ASN A 64 15.776 -14.745 -1.292 1.00 0.00 C ATOM 1054 O ASN A 64 15.575 -13.794 -0.538 1.00 0.00 O ATOM 1055 CB ASN A 64 16.870 -16.822 -0.369 1.00 0.00 C ATOM 1056 CG ASN A 64 17.453 -16.111 0.850 1.00 0.00 C ATOM 1057 OD1 ASN A 64 16.813 -16.021 1.895 1.00 0.00 O ATOM 1058 ND2 ASN A 64 18.671 -15.608 0.760 1.00 0.00 N ATOM 0 H ASN A 64 15.423 -17.691 -2.210 1.00 0.00 H new ATOM 0 HA ASN A 64 14.919 -16.105 0.104 1.00 0.00 H new ATOM 0 HB2 ASN A 64 16.705 -17.875 -0.140 1.00 0.00 H new ATOM 0 HB3 ASN A 64 17.579 -16.783 -1.196 1.00 0.00 H new ATOM 0 HD21 ASN A 64 19.090 -15.139 1.563 1.00 0.00 H new ATOM 0 HD22 ASN A 64 19.193 -15.689 -0.113 1.00 0.00 H new ATOM 1065 N ALA A 65 16.124 -14.589 -2.574 1.00 0.00 N ATOM 1066 CA ALA A 65 16.197 -13.296 -3.239 1.00 0.00 C ATOM 1067 C ALA A 65 14.842 -12.592 -3.141 1.00 0.00 C ATOM 1068 O ALA A 65 14.773 -11.464 -2.661 1.00 0.00 O ATOM 1069 CB ALA A 65 16.613 -13.476 -4.707 1.00 0.00 C ATOM 0 H ALA A 65 16.365 -15.372 -3.182 1.00 0.00 H new ATOM 0 HA ALA A 65 16.949 -12.679 -2.747 1.00 0.00 H new ATOM 0 HB1 ALA A 65 16.664 -12.502 -5.193 1.00 0.00 H new ATOM 0 HB2 ALA A 65 17.591 -13.955 -4.752 1.00 0.00 H new ATOM 0 HB3 ALA A 65 15.880 -14.099 -5.219 1.00 0.00 H new ATOM 1075 N LEU A 66 13.768 -13.283 -3.538 1.00 0.00 N ATOM 1076 CA LEU A 66 12.403 -12.767 -3.539 1.00 0.00 C ATOM 1077 C LEU A 66 12.060 -12.226 -2.155 1.00 0.00 C ATOM 1078 O LEU A 66 11.755 -11.044 -2.022 1.00 0.00 O ATOM 1079 CB LEU A 66 11.447 -13.891 -3.992 1.00 0.00 C ATOM 1080 CG LEU A 66 10.033 -13.478 -4.433 1.00 0.00 C ATOM 1081 CD1 LEU A 66 9.311 -14.720 -4.971 1.00 0.00 C ATOM 1082 CD2 LEU A 66 9.189 -12.863 -3.316 1.00 0.00 C ATOM 0 H LEU A 66 13.831 -14.243 -3.876 1.00 0.00 H new ATOM 0 HA LEU A 66 12.299 -11.938 -4.240 1.00 0.00 H new ATOM 0 HB2 LEU A 66 11.918 -14.421 -4.820 1.00 0.00 H new ATOM 0 HB3 LEU A 66 11.350 -14.603 -3.172 1.00 0.00 H new ATOM 0 HG LEU A 66 10.151 -12.706 -5.194 1.00 0.00 H new ATOM 0 HD11 LEU A 66 8.305 -14.447 -5.289 1.00 0.00 H new ATOM 0 HD12 LEU A 66 9.863 -15.123 -5.820 1.00 0.00 H new ATOM 0 HD13 LEU A 66 9.251 -15.474 -4.187 1.00 0.00 H new ATOM 0 HD21 LEU A 66 8.206 -12.598 -3.706 1.00 0.00 H new ATOM 0 HD22 LEU A 66 9.076 -13.584 -2.506 1.00 0.00 H new ATOM 0 HD23 LEU A 66 9.682 -11.968 -2.938 1.00 0.00 H new ATOM 1094 N ARG A 67 12.145 -13.057 -1.113 1.00 0.00 N ATOM 1095 CA ARG A 67 11.705 -12.651 0.220 1.00 0.00 C ATOM 1096 C ARG A 67 12.595 -11.557 0.800 1.00 0.00 C ATOM 1097 O ARG A 67 12.068 -10.643 1.432 1.00 0.00 O ATOM 1098 CB ARG A 67 11.653 -13.859 1.166 1.00 0.00 C ATOM 1099 CG ARG A 67 10.483 -14.789 0.811 1.00 0.00 C ATOM 1100 CD ARG A 67 10.428 -16.016 1.731 1.00 0.00 C ATOM 1101 NE ARG A 67 9.941 -15.675 3.083 1.00 0.00 N ATOM 1102 CZ ARG A 67 10.653 -15.586 4.212 1.00 0.00 C ATOM 1103 NH1 ARG A 67 11.968 -15.789 4.223 1.00 0.00 N ATOM 1104 NH2 ARG A 67 10.011 -15.283 5.333 1.00 0.00 N ATOM 0 H ARG A 67 12.512 -14.007 -1.167 1.00 0.00 H new ATOM 0 HA ARG A 67 10.700 -12.241 0.120 1.00 0.00 H new ATOM 0 HB2 ARG A 67 12.591 -14.411 1.108 1.00 0.00 H new ATOM 0 HB3 ARG A 67 11.549 -13.515 2.195 1.00 0.00 H new ATOM 0 HG2 ARG A 67 9.546 -14.238 0.885 1.00 0.00 H new ATOM 0 HG3 ARG A 67 10.580 -15.116 -0.224 1.00 0.00 H new ATOM 0 HD2 ARG A 67 9.776 -16.770 1.291 1.00 0.00 H new ATOM 0 HD3 ARG A 67 11.422 -16.458 1.805 1.00 0.00 H new ATOM 0 HE ARG A 67 8.942 -15.485 3.166 1.00 0.00 H new ATOM 0 HH11 ARG A 67 12.456 -16.018 3.357 1.00 0.00 H new ATOM 0 HH12 ARG A 67 12.488 -15.715 5.097 1.00 0.00 H new ATOM 0 HH21 ARG A 67 9.003 -15.126 5.317 1.00 0.00 H new ATOM 0 HH22 ARG A 67 10.525 -15.208 6.211 1.00 0.00 H new ATOM 1118 N THR A 68 13.913 -11.611 0.589 1.00 0.00 N ATOM 1119 CA THR A 68 14.812 -10.593 1.129 1.00 0.00 C ATOM 1120 C THR A 68 14.531 -9.235 0.469 1.00 0.00 C ATOM 1121 O THR A 68 14.563 -8.204 1.145 1.00 0.00 O ATOM 1122 CB THR A 68 16.281 -11.026 0.960 1.00 0.00 C ATOM 1123 OG1 THR A 68 16.473 -12.320 1.496 1.00 0.00 O ATOM 1124 CG2 THR A 68 17.244 -10.082 1.689 1.00 0.00 C ATOM 0 H THR A 68 14.377 -12.344 0.052 1.00 0.00 H new ATOM 0 HA THR A 68 14.629 -10.483 2.198 1.00 0.00 H new ATOM 0 HB THR A 68 16.491 -11.006 -0.109 1.00 0.00 H new ATOM 0 HG1 THR A 68 15.983 -12.974 0.955 1.00 0.00 H new ATOM 0 HG21 THR A 68 18.269 -10.424 1.544 1.00 0.00 H new ATOM 0 HG22 THR A 68 17.138 -9.074 1.289 1.00 0.00 H new ATOM 0 HG23 THR A 68 17.011 -10.076 2.754 1.00 0.00 H new ATOM 1132 N MET A 69 14.218 -9.223 -0.830 1.00 0.00 N ATOM 1133 CA MET A 69 14.063 -7.995 -1.602 1.00 0.00 C ATOM 1134 C MET A 69 12.604 -7.517 -1.648 1.00 0.00 C ATOM 1135 O MET A 69 12.337 -6.413 -2.120 1.00 0.00 O ATOM 1136 CB MET A 69 14.658 -8.201 -3.005 1.00 0.00 C ATOM 1137 CG MET A 69 16.157 -8.560 -2.966 1.00 0.00 C ATOM 1138 SD MET A 69 17.233 -7.407 -2.064 1.00 0.00 S ATOM 1139 CE MET A 69 17.063 -5.917 -3.081 1.00 0.00 C ATOM 0 H MET A 69 14.065 -10.072 -1.375 1.00 0.00 H new ATOM 0 HA MET A 69 14.612 -7.195 -1.105 1.00 0.00 H new ATOM 0 HB2 MET A 69 14.111 -8.994 -3.515 1.00 0.00 H new ATOM 0 HB3 MET A 69 14.521 -7.292 -3.591 1.00 0.00 H new ATOM 0 HG2 MET A 69 16.261 -9.548 -2.518 1.00 0.00 H new ATOM 0 HG3 MET A 69 16.518 -8.635 -3.992 1.00 0.00 H new ATOM 0 HE1 MET A 69 17.471 -5.061 -2.543 1.00 0.00 H new ATOM 0 HE2 MET A 69 17.607 -6.051 -4.016 1.00 0.00 H new ATOM 0 HE3 MET A 69 16.009 -5.742 -3.296 1.00 0.00 H new ATOM 1149 N GLN A 70 11.653 -8.305 -1.143 1.00 0.00 N ATOM 1150 CA GLN A 70 10.252 -7.924 -1.033 1.00 0.00 C ATOM 1151 C GLN A 70 10.144 -6.634 -0.209 1.00 0.00 C ATOM 1152 O GLN A 70 10.612 -6.582 0.931 1.00 0.00 O ATOM 1153 CB GLN A 70 9.478 -9.104 -0.405 1.00 0.00 C ATOM 1154 CG GLN A 70 7.951 -8.964 -0.337 1.00 0.00 C ATOM 1155 CD GLN A 70 7.297 -8.995 -1.720 1.00 0.00 C ATOM 1156 OE1 GLN A 70 7.509 -8.112 -2.545 1.00 0.00 O ATOM 1157 NE2 GLN A 70 6.505 -10.011 -2.016 1.00 0.00 N ATOM 0 H GLN A 70 11.844 -9.244 -0.793 1.00 0.00 H new ATOM 0 HA GLN A 70 9.813 -7.716 -2.009 1.00 0.00 H new ATOM 0 HB2 GLN A 70 9.713 -10.006 -0.971 1.00 0.00 H new ATOM 0 HB3 GLN A 70 9.852 -9.257 0.607 1.00 0.00 H new ATOM 0 HG2 GLN A 70 7.542 -9.770 0.273 1.00 0.00 H new ATOM 0 HG3 GLN A 70 7.697 -8.028 0.160 1.00 0.00 H new ATOM 0 HE21 GLN A 70 6.333 -10.742 -1.325 1.00 0.00 H new ATOM 0 HE22 GLN A 70 6.066 -10.064 -2.935 1.00 0.00 H new ATOM 1166 N GLY A 71 9.547 -5.589 -0.788 1.00 0.00 N ATOM 1167 CA GLY A 71 9.376 -4.291 -0.146 1.00 0.00 C ATOM 1168 C GLY A 71 10.661 -3.457 -0.065 1.00 0.00 C ATOM 1169 O GLY A 71 10.627 -2.375 0.523 1.00 0.00 O ATOM 0 H GLY A 71 9.164 -5.626 -1.732 1.00 0.00 H new ATOM 0 HA2 GLY A 71 8.622 -3.724 -0.692 1.00 0.00 H new ATOM 0 HA3 GLY A 71 8.991 -4.444 0.862 1.00 0.00 H new ATOM 1173 N PHE A 72 11.787 -3.924 -0.619 1.00 0.00 N ATOM 1174 CA PHE A 72 13.058 -3.196 -0.564 1.00 0.00 C ATOM 1175 C PHE A 72 12.934 -1.882 -1.349 1.00 0.00 C ATOM 1176 O PHE A 72 12.448 -1.925 -2.477 1.00 0.00 O ATOM 1177 CB PHE A 72 14.168 -4.067 -1.164 1.00 0.00 C ATOM 1178 CG PHE A 72 15.542 -3.427 -1.157 1.00 0.00 C ATOM 1179 CD1 PHE A 72 16.352 -3.502 -0.007 1.00 0.00 C ATOM 1180 CD2 PHE A 72 16.017 -2.768 -2.306 1.00 0.00 C ATOM 1181 CE1 PHE A 72 17.633 -2.920 -0.009 1.00 0.00 C ATOM 1182 CE2 PHE A 72 17.298 -2.187 -2.307 1.00 0.00 C ATOM 1183 CZ PHE A 72 18.106 -2.262 -1.159 1.00 0.00 C ATOM 0 H PHE A 72 11.841 -4.813 -1.116 1.00 0.00 H new ATOM 0 HA PHE A 72 13.305 -2.965 0.472 1.00 0.00 H new ATOM 0 HB2 PHE A 72 14.215 -5.005 -0.611 1.00 0.00 H new ATOM 0 HB3 PHE A 72 13.902 -4.316 -2.191 1.00 0.00 H new ATOM 0 HD1 PHE A 72 15.990 -4.006 0.877 1.00 0.00 H new ATOM 0 HD2 PHE A 72 15.397 -2.708 -3.188 1.00 0.00 H new ATOM 0 HE1 PHE A 72 18.254 -2.978 0.873 1.00 0.00 H new ATOM 0 HE2 PHE A 72 17.661 -1.683 -3.190 1.00 0.00 H new ATOM 0 HZ PHE A 72 19.089 -1.815 -1.160 1.00 0.00 H new ATOM 1193 N PRO A 73 13.366 -0.720 -0.829 1.00 0.00 N ATOM 1194 CA PRO A 73 13.394 0.519 -1.596 1.00 0.00 C ATOM 1195 C PRO A 73 14.531 0.458 -2.627 1.00 0.00 C ATOM 1196 O PRO A 73 15.695 0.664 -2.282 1.00 0.00 O ATOM 1197 CB PRO A 73 13.566 1.629 -0.557 1.00 0.00 C ATOM 1198 CG PRO A 73 14.326 0.950 0.585 1.00 0.00 C ATOM 1199 CD PRO A 73 13.848 -0.502 0.527 1.00 0.00 C ATOM 0 HA PRO A 73 12.489 0.698 -2.176 1.00 0.00 H new ATOM 0 HB2 PRO A 73 14.125 2.473 -0.962 1.00 0.00 H new ATOM 0 HB3 PRO A 73 12.603 2.015 -0.222 1.00 0.00 H new ATOM 0 HG2 PRO A 73 15.405 1.022 0.446 1.00 0.00 H new ATOM 0 HG3 PRO A 73 14.097 1.409 1.547 1.00 0.00 H new ATOM 0 HD2 PRO A 73 14.660 -1.188 0.766 1.00 0.00 H new ATOM 0 HD3 PRO A 73 13.056 -0.680 1.254 1.00 0.00 H new ATOM 1207 N PHE A 74 14.203 0.140 -3.886 1.00 0.00 N ATOM 1208 CA PHE A 74 15.196 -0.108 -4.931 1.00 0.00 C ATOM 1209 C PHE A 74 16.035 1.144 -5.178 1.00 0.00 C ATOM 1210 O PHE A 74 17.259 1.102 -5.047 1.00 0.00 O ATOM 1211 CB PHE A 74 14.492 -0.575 -6.212 1.00 0.00 C ATOM 1212 CG PHE A 74 15.382 -1.152 -7.300 1.00 0.00 C ATOM 1213 CD1 PHE A 74 16.313 -2.170 -7.002 1.00 0.00 C ATOM 1214 CD2 PHE A 74 15.206 -0.746 -8.637 1.00 0.00 C ATOM 1215 CE1 PHE A 74 17.051 -2.781 -8.031 1.00 0.00 C ATOM 1216 CE2 PHE A 74 15.948 -1.356 -9.664 1.00 0.00 C ATOM 1217 CZ PHE A 74 16.860 -2.379 -9.365 1.00 0.00 C ATOM 0 H PHE A 74 13.239 0.048 -4.206 1.00 0.00 H new ATOM 0 HA PHE A 74 15.874 -0.897 -4.606 1.00 0.00 H new ATOM 0 HB2 PHE A 74 13.753 -1.328 -5.940 1.00 0.00 H new ATOM 0 HB3 PHE A 74 13.946 0.271 -6.630 1.00 0.00 H new ATOM 0 HD1 PHE A 74 16.459 -2.481 -5.978 1.00 0.00 H new ATOM 0 HD2 PHE A 74 14.499 0.036 -8.874 1.00 0.00 H new ATOM 0 HE1 PHE A 74 17.764 -3.558 -7.797 1.00 0.00 H new ATOM 0 HE2 PHE A 74 15.815 -1.036 -10.687 1.00 0.00 H new ATOM 0 HZ PHE A 74 17.415 -2.857 -10.158 1.00 0.00 H new ATOM 1227 N TYR A 75 15.351 2.258 -5.463 1.00 0.00 N ATOM 1228 CA TYR A 75 15.924 3.596 -5.527 1.00 0.00 C ATOM 1229 C TYR A 75 14.837 4.600 -5.170 1.00 0.00 C ATOM 1230 O TYR A 75 14.916 5.259 -4.132 1.00 0.00 O ATOM 1231 CB TYR A 75 16.511 3.905 -6.923 1.00 0.00 C ATOM 1232 CG TYR A 75 17.743 3.110 -7.315 1.00 0.00 C ATOM 1233 CD1 TYR A 75 19.003 3.465 -6.794 1.00 0.00 C ATOM 1234 CD2 TYR A 75 17.634 2.015 -8.196 1.00 0.00 C ATOM 1235 CE1 TYR A 75 20.147 2.723 -7.138 1.00 0.00 C ATOM 1236 CE2 TYR A 75 18.772 1.265 -8.542 1.00 0.00 C ATOM 1237 CZ TYR A 75 20.036 1.615 -8.009 1.00 0.00 C ATOM 1238 OH TYR A 75 21.149 0.899 -8.326 1.00 0.00 O ATOM 0 H TYR A 75 14.350 2.246 -5.661 1.00 0.00 H new ATOM 0 HA TYR A 75 16.749 3.663 -4.818 1.00 0.00 H new ATOM 0 HB2 TYR A 75 15.736 3.728 -7.669 1.00 0.00 H new ATOM 0 HB3 TYR A 75 16.758 4.966 -6.965 1.00 0.00 H new ATOM 0 HD1 TYR A 75 19.091 4.310 -6.128 1.00 0.00 H new ATOM 0 HD2 TYR A 75 16.671 1.751 -8.608 1.00 0.00 H new ATOM 0 HE1 TYR A 75 21.111 3.000 -6.737 1.00 0.00 H new ATOM 0 HE2 TYR A 75 18.682 0.424 -9.213 1.00 0.00 H new ATOM 0 HH TYR A 75 20.909 0.179 -8.946 1.00 0.00 H new ATOM 1248 N ASP A 76 13.795 4.663 -5.998 1.00 0.00 N ATOM 1249 CA ASP A 76 12.697 5.608 -5.844 1.00 0.00 C ATOM 1250 C ASP A 76 11.440 4.943 -5.281 1.00 0.00 C ATOM 1251 O ASP A 76 10.607 5.627 -4.685 1.00 0.00 O ATOM 1252 CB ASP A 76 12.398 6.273 -7.190 1.00 0.00 C ATOM 1253 CG ASP A 76 11.235 7.271 -7.077 1.00 0.00 C ATOM 1254 OD1 ASP A 76 11.426 8.371 -6.509 1.00 0.00 O ATOM 1255 OD2 ASP A 76 10.145 6.968 -7.610 1.00 0.00 O ATOM 0 H ASP A 76 13.691 4.049 -6.806 1.00 0.00 H new ATOM 0 HA ASP A 76 13.005 6.366 -5.124 1.00 0.00 H new ATOM 0 HB2 ASP A 76 13.289 6.789 -7.548 1.00 0.00 H new ATOM 0 HB3 ASP A 76 12.154 5.509 -7.928 1.00 0.00 H new ATOM 1260 N LYS A 77 11.306 3.613 -5.422 1.00 0.00 N ATOM 1261 CA LYS A 77 10.093 2.890 -5.048 1.00 0.00 C ATOM 1262 C LYS A 77 10.402 1.590 -4.306 1.00 0.00 C ATOM 1263 O LYS A 77 11.449 0.987 -4.562 1.00 0.00 O ATOM 1264 CB LYS A 77 9.260 2.558 -6.302 1.00 0.00 C ATOM 1265 CG LYS A 77 8.658 3.791 -6.989 1.00 0.00 C ATOM 1266 CD LYS A 77 7.694 3.378 -8.110 1.00 0.00 C ATOM 1267 CE LYS A 77 7.031 4.619 -8.724 1.00 0.00 C ATOM 1268 NZ LYS A 77 5.960 4.266 -9.692 1.00 0.00 N ATOM 0 H LYS A 77 12.041 3.014 -5.800 1.00 0.00 H new ATOM 0 HA LYS A 77 9.530 3.543 -4.380 1.00 0.00 H new ATOM 0 HB2 LYS A 77 9.890 2.027 -7.016 1.00 0.00 H new ATOM 0 HB3 LYS A 77 8.454 1.879 -6.022 1.00 0.00 H new ATOM 0 HG2 LYS A 77 8.129 4.399 -6.255 1.00 0.00 H new ATOM 0 HG3 LYS A 77 9.456 4.409 -7.400 1.00 0.00 H new ATOM 0 HD2 LYS A 77 8.235 2.827 -8.880 1.00 0.00 H new ATOM 0 HD3 LYS A 77 6.931 2.707 -7.715 1.00 0.00 H new ATOM 0 HE2 LYS A 77 6.610 5.234 -7.929 1.00 0.00 H new ATOM 0 HE3 LYS A 77 7.788 5.221 -9.227 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 5.542 5.136 -10.080 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 6.364 3.701 -10.466 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 5.223 3.714 -9.208 1.00 0.00 H new ATOM 1282 N PRO A 78 9.498 1.131 -3.419 1.00 0.00 N ATOM 1283 CA PRO A 78 9.581 -0.191 -2.824 1.00 0.00 C ATOM 1284 C PRO A 78 9.254 -1.238 -3.892 1.00 0.00 C ATOM 1285 O PRO A 78 8.238 -1.138 -4.587 1.00 0.00 O ATOM 1286 CB PRO A 78 8.570 -0.197 -1.675 1.00 0.00 C ATOM 1287 CG PRO A 78 7.512 0.811 -2.121 1.00 0.00 C ATOM 1288 CD PRO A 78 8.312 1.831 -2.933 1.00 0.00 C ATOM 0 HA PRO A 78 10.574 -0.428 -2.444 1.00 0.00 H new ATOM 0 HB2 PRO A 78 8.141 -1.188 -1.524 1.00 0.00 H new ATOM 0 HB3 PRO A 78 9.032 0.098 -0.733 1.00 0.00 H new ATOM 0 HG2 PRO A 78 6.736 0.339 -2.723 1.00 0.00 H new ATOM 0 HG3 PRO A 78 7.016 1.276 -1.269 1.00 0.00 H new ATOM 0 HD2 PRO A 78 7.721 2.216 -3.764 1.00 0.00 H new ATOM 0 HD3 PRO A 78 8.591 2.686 -2.317 1.00 0.00 H new ATOM 1296 N MET A 79 10.112 -2.245 -4.022 1.00 0.00 N ATOM 1297 CA MET A 79 9.912 -3.368 -4.925 1.00 0.00 C ATOM 1298 C MET A 79 8.708 -4.175 -4.454 1.00 0.00 C ATOM 1299 O MET A 79 8.490 -4.333 -3.252 1.00 0.00 O ATOM 1300 CB MET A 79 11.164 -4.258 -4.945 1.00 0.00 C ATOM 1301 CG MET A 79 12.383 -3.462 -5.408 1.00 0.00 C ATOM 1302 SD MET A 79 13.949 -4.365 -5.459 1.00 0.00 S ATOM 1303 CE MET A 79 14.053 -4.623 -7.248 1.00 0.00 C ATOM 0 H MET A 79 10.981 -2.302 -3.492 1.00 0.00 H new ATOM 0 HA MET A 79 9.733 -2.997 -5.934 1.00 0.00 H new ATOM 0 HB2 MET A 79 11.344 -4.663 -3.949 1.00 0.00 H new ATOM 0 HB3 MET A 79 11.003 -5.106 -5.610 1.00 0.00 H new ATOM 0 HG2 MET A 79 12.179 -3.071 -6.405 1.00 0.00 H new ATOM 0 HG3 MET A 79 12.503 -2.603 -4.748 1.00 0.00 H new ATOM 0 HE1 MET A 79 15.093 -4.785 -7.532 1.00 0.00 H new ATOM 0 HE2 MET A 79 13.461 -5.495 -7.525 1.00 0.00 H new ATOM 0 HE3 MET A 79 13.668 -3.744 -7.765 1.00 0.00 H new ATOM 1313 N GLN A 80 7.976 -4.752 -5.401 1.00 0.00 N ATOM 1314 CA GLN A 80 6.922 -5.720 -5.139 1.00 0.00 C ATOM 1315 C GLN A 80 7.308 -6.926 -5.978 1.00 0.00 C ATOM 1316 O GLN A 80 7.656 -6.754 -7.147 1.00 0.00 O ATOM 1317 CB GLN A 80 5.555 -5.136 -5.534 1.00 0.00 C ATOM 1318 CG GLN A 80 5.156 -3.941 -4.648 1.00 0.00 C ATOM 1319 CD GLN A 80 3.810 -3.324 -5.041 1.00 0.00 C ATOM 1320 OE1 GLN A 80 2.888 -4.002 -5.493 1.00 0.00 O ATOM 1321 NE2 GLN A 80 3.659 -2.017 -4.885 1.00 0.00 N ATOM 0 H GLN A 80 8.103 -4.554 -6.393 1.00 0.00 H new ATOM 0 HA GLN A 80 6.826 -5.987 -4.087 1.00 0.00 H new ATOM 0 HB2 GLN A 80 5.584 -4.819 -6.577 1.00 0.00 H new ATOM 0 HB3 GLN A 80 4.794 -5.913 -5.458 1.00 0.00 H new ATOM 0 HG2 GLN A 80 5.110 -4.266 -3.609 1.00 0.00 H new ATOM 0 HG3 GLN A 80 5.931 -3.177 -4.709 1.00 0.00 H new ATOM 0 HE21 GLN A 80 4.424 -1.456 -4.510 1.00 0.00 H new ATOM 0 HE22 GLN A 80 2.778 -1.571 -5.140 1.00 0.00 H new ATOM 1330 N ILE A 81 7.324 -8.125 -5.397 1.00 0.00 N ATOM 1331 CA ILE A 81 7.895 -9.297 -6.051 1.00 0.00 C ATOM 1332 C ILE A 81 6.981 -10.505 -5.818 1.00 0.00 C ATOM 1333 O ILE A 81 6.346 -10.621 -4.767 1.00 0.00 O ATOM 1334 CB ILE A 81 9.352 -9.549 -5.566 1.00 0.00 C ATOM 1335 CG1 ILE A 81 10.159 -8.251 -5.292 1.00 0.00 C ATOM 1336 CG2 ILE A 81 10.098 -10.402 -6.608 1.00 0.00 C ATOM 1337 CD1 ILE A 81 11.625 -8.460 -4.901 1.00 0.00 C ATOM 0 H ILE A 81 6.945 -8.309 -4.468 1.00 0.00 H new ATOM 0 HA ILE A 81 7.956 -9.124 -7.126 1.00 0.00 H new ATOM 0 HB ILE A 81 9.272 -10.070 -4.612 1.00 0.00 H new ATOM 0 HG12 ILE A 81 10.124 -7.626 -6.185 1.00 0.00 H new ATOM 0 HG13 ILE A 81 9.663 -7.696 -4.495 1.00 0.00 H new ATOM 0 HG21 ILE A 81 11.119 -10.579 -6.270 1.00 0.00 H new ATOM 0 HG22 ILE A 81 9.586 -11.356 -6.731 1.00 0.00 H new ATOM 0 HG23 ILE A 81 10.118 -9.875 -7.562 1.00 0.00 H new ATOM 0 HD11 ILE A 81 12.098 -7.493 -4.732 1.00 0.00 H new ATOM 0 HD12 ILE A 81 11.677 -9.054 -3.988 1.00 0.00 H new ATOM 0 HD13 ILE A 81 12.145 -8.982 -5.704 1.00 0.00 H new ATOM 1349 N ALA A 82 6.934 -11.407 -6.796 1.00 0.00 N ATOM 1350 CA ALA A 82 6.258 -12.701 -6.747 1.00 0.00 C ATOM 1351 C ALA A 82 6.997 -13.663 -7.689 1.00 0.00 C ATOM 1352 O ALA A 82 8.002 -13.286 -8.294 1.00 0.00 O ATOM 1353 CB ALA A 82 4.780 -12.542 -7.132 1.00 0.00 C ATOM 0 H ALA A 82 7.392 -11.245 -7.693 1.00 0.00 H new ATOM 0 HA ALA A 82 6.279 -13.110 -5.737 1.00 0.00 H new ATOM 0 HB1 ALA A 82 4.287 -13.513 -7.092 1.00 0.00 H new ATOM 0 HB2 ALA A 82 4.294 -11.859 -6.435 1.00 0.00 H new ATOM 0 HB3 ALA A 82 4.708 -12.140 -8.143 1.00 0.00 H new ATOM 1359 N TYR A 83 6.537 -14.909 -7.804 1.00 0.00 N ATOM 1360 CA TYR A 83 7.054 -15.845 -8.801 1.00 0.00 C ATOM 1361 C TYR A 83 6.598 -15.428 -10.209 1.00 0.00 C ATOM 1362 O TYR A 83 5.625 -14.685 -10.377 1.00 0.00 O ATOM 1363 CB TYR A 83 6.640 -17.286 -8.457 1.00 0.00 C ATOM 1364 CG TYR A 83 5.179 -17.482 -8.093 1.00 0.00 C ATOM 1365 CD1 TYR A 83 4.770 -17.366 -6.749 1.00 0.00 C ATOM 1366 CD2 TYR A 83 4.230 -17.776 -9.090 1.00 0.00 C ATOM 1367 CE1 TYR A 83 3.416 -17.529 -6.403 1.00 0.00 C ATOM 1368 CE2 TYR A 83 2.876 -17.952 -8.752 1.00 0.00 C ATOM 1369 CZ TYR A 83 2.462 -17.823 -7.405 1.00 0.00 C ATOM 1370 OH TYR A 83 1.154 -17.986 -7.057 1.00 0.00 O ATOM 0 H TYR A 83 5.801 -15.295 -7.213 1.00 0.00 H new ATOM 0 HA TYR A 83 8.144 -15.815 -8.789 1.00 0.00 H new ATOM 0 HB2 TYR A 83 6.872 -17.924 -9.309 1.00 0.00 H new ATOM 0 HB3 TYR A 83 7.252 -17.631 -7.624 1.00 0.00 H new ATOM 0 HD1 TYR A 83 5.499 -17.151 -5.982 1.00 0.00 H new ATOM 0 HD2 TYR A 83 4.543 -17.867 -10.120 1.00 0.00 H new ATOM 0 HE1 TYR A 83 3.105 -17.430 -5.373 1.00 0.00 H new ATOM 0 HE2 TYR A 83 2.153 -18.185 -9.520 1.00 0.00 H new ATOM 0 HH TYR A 83 0.624 -18.182 -7.858 1.00 0.00 H new ATOM 1380 N SER A 84 7.321 -15.899 -11.225 1.00 0.00 N ATOM 1381 CA SER A 84 7.085 -15.583 -12.630 1.00 0.00 C ATOM 1382 C SER A 84 5.692 -16.010 -13.110 1.00 0.00 C ATOM 1383 O SER A 84 5.053 -16.885 -12.520 1.00 0.00 O ATOM 1384 CB SER A 84 8.205 -16.214 -13.466 1.00 0.00 C ATOM 1385 OG SER A 84 9.433 -15.907 -12.843 1.00 0.00 O ATOM 0 H SER A 84 8.110 -16.530 -11.087 1.00 0.00 H new ATOM 0 HA SER A 84 7.104 -14.500 -12.755 1.00 0.00 H new ATOM 0 HB2 SER A 84 8.070 -17.294 -13.533 1.00 0.00 H new ATOM 0 HB3 SER A 84 8.186 -15.827 -14.485 1.00 0.00 H new ATOM 0 HG SER A 84 9.622 -14.951 -12.946 1.00 0.00 H new ATOM 1391 N LYS A 85 5.242 -15.396 -14.215 1.00 0.00 N ATOM 1392 CA LYS A 85 3.945 -15.626 -14.862 1.00 0.00 C ATOM 1393 C LYS A 85 2.741 -15.328 -13.950 1.00 0.00 C ATOM 1394 O LYS A 85 1.630 -15.751 -14.271 1.00 0.00 O ATOM 1395 CB LYS A 85 3.884 -17.042 -15.481 1.00 0.00 C ATOM 1396 CG LYS A 85 5.046 -17.347 -16.445 1.00 0.00 C ATOM 1397 CD LYS A 85 4.977 -18.767 -17.026 1.00 0.00 C ATOM 1398 CE LYS A 85 5.217 -19.841 -15.951 1.00 0.00 C ATOM 1399 NZ LYS A 85 5.208 -21.213 -16.516 1.00 0.00 N ATOM 0 H LYS A 85 5.799 -14.694 -14.702 1.00 0.00 H new ATOM 0 HA LYS A 85 3.865 -14.902 -15.673 1.00 0.00 H new ATOM 0 HB2 LYS A 85 3.886 -17.780 -14.679 1.00 0.00 H new ATOM 0 HB3 LYS A 85 2.941 -17.155 -16.016 1.00 0.00 H new ATOM 0 HG2 LYS A 85 5.035 -16.624 -17.261 1.00 0.00 H new ATOM 0 HG3 LYS A 85 5.992 -17.220 -15.919 1.00 0.00 H new ATOM 0 HD2 LYS A 85 4.001 -18.924 -17.484 1.00 0.00 H new ATOM 0 HD3 LYS A 85 5.721 -18.872 -17.816 1.00 0.00 H new ATOM 0 HE2 LYS A 85 6.175 -19.657 -15.464 1.00 0.00 H new ATOM 0 HE3 LYS A 85 4.448 -19.761 -15.183 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 5.374 -21.903 -15.755 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 4.286 -21.400 -16.958 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 5.959 -21.299 -17.231 1.00 0.00 H new ATOM 1413 N SER A 86 2.919 -14.607 -12.838 1.00 0.00 N ATOM 1414 CA SER A 86 1.800 -14.223 -11.983 1.00 0.00 C ATOM 1415 C SER A 86 0.899 -13.187 -12.670 1.00 0.00 C ATOM 1416 O SER A 86 -0.325 -13.289 -12.572 1.00 0.00 O ATOM 1417 CB SER A 86 2.317 -13.670 -10.648 1.00 0.00 C ATOM 1418 OG SER A 86 2.999 -14.667 -9.911 1.00 0.00 O ATOM 0 H SER A 86 3.828 -14.280 -12.512 1.00 0.00 H new ATOM 0 HA SER A 86 1.203 -15.115 -11.794 1.00 0.00 H new ATOM 0 HB2 SER A 86 2.986 -12.830 -10.834 1.00 0.00 H new ATOM 0 HB3 SER A 86 1.481 -13.288 -10.061 1.00 0.00 H new ATOM 0 HG SER A 86 3.964 -14.503 -9.954 1.00 0.00 H new ATOM 1424 N ASP A 87 1.483 -12.193 -13.351 1.00 0.00 N ATOM 1425 CA ASP A 87 0.800 -11.009 -13.888 1.00 0.00 C ATOM 1426 C ASP A 87 1.773 -10.292 -14.851 1.00 0.00 C ATOM 1427 O ASP A 87 2.881 -10.789 -15.084 1.00 0.00 O ATOM 1428 CB ASP A 87 0.321 -10.137 -12.702 1.00 0.00 C ATOM 1429 CG ASP A 87 -0.423 -8.840 -13.066 1.00 0.00 C ATOM 1430 OD1 ASP A 87 -1.060 -8.779 -14.139 1.00 0.00 O ATOM 1431 OD2 ASP A 87 -0.422 -7.891 -12.248 1.00 0.00 O ATOM 0 H ASP A 87 2.483 -12.191 -13.551 1.00 0.00 H new ATOM 0 HA ASP A 87 -0.090 -11.260 -14.465 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -0.333 -10.742 -12.075 1.00 0.00 H new ATOM 0 HB3 ASP A 87 1.189 -9.875 -12.097 1.00 0.00 H new ATOM 1436 N SER A 88 1.362 -9.164 -15.438 1.00 0.00 N ATOM 1437 CA SER A 88 1.991 -8.411 -16.522 1.00 0.00 C ATOM 1438 C SER A 88 2.126 -9.236 -17.804 1.00 0.00 C ATOM 1439 O SER A 88 1.410 -8.963 -18.766 1.00 0.00 O ATOM 1440 CB SER A 88 3.328 -7.773 -16.107 1.00 0.00 C ATOM 1441 OG SER A 88 3.195 -6.898 -14.990 1.00 0.00 O ATOM 0 H SER A 88 0.498 -8.714 -15.136 1.00 0.00 H new ATOM 0 HA SER A 88 1.312 -7.588 -16.745 1.00 0.00 H new ATOM 0 HB2 SER A 88 4.042 -8.560 -15.864 1.00 0.00 H new ATOM 0 HB3 SER A 88 3.739 -7.219 -16.951 1.00 0.00 H new ATOM 0 HG SER A 88 2.575 -6.173 -15.214 1.00 0.00 H new ATOM 1447 N ASP A 89 2.996 -10.246 -17.835 1.00 0.00 N ATOM 1448 CA ASP A 89 3.333 -10.969 -19.063 1.00 0.00 C ATOM 1449 C ASP A 89 2.120 -11.707 -19.616 1.00 0.00 C ATOM 1450 O ASP A 89 1.830 -11.611 -20.808 1.00 0.00 O ATOM 1451 CB ASP A 89 4.478 -11.951 -18.806 1.00 0.00 C ATOM 1452 CG ASP A 89 4.765 -12.800 -20.056 1.00 0.00 C ATOM 1453 OD1 ASP A 89 5.421 -12.290 -20.990 1.00 0.00 O ATOM 1454 OD2 ASP A 89 4.369 -13.986 -20.087 1.00 0.00 O ATOM 0 H ASP A 89 3.488 -10.587 -17.009 1.00 0.00 H new ATOM 0 HA ASP A 89 3.654 -10.239 -19.806 1.00 0.00 H new ATOM 0 HB2 ASP A 89 5.376 -11.402 -18.520 1.00 0.00 H new ATOM 0 HB3 ASP A 89 4.223 -12.602 -17.970 1.00 0.00 H new ATOM 1459 N ILE A 90 1.375 -12.388 -18.741 1.00 0.00 N ATOM 1460 CA ILE A 90 0.189 -13.134 -19.156 1.00 0.00 C ATOM 1461 C ILE A 90 -0.887 -12.175 -19.674 1.00 0.00 C ATOM 1462 O ILE A 90 -1.503 -12.456 -20.701 1.00 0.00 O ATOM 1463 CB ILE A 90 -0.319 -14.087 -18.046 1.00 0.00 C ATOM 1464 CG1 ILE A 90 -0.880 -13.361 -16.801 1.00 0.00 C ATOM 1465 CG2 ILE A 90 0.805 -15.072 -17.669 1.00 0.00 C ATOM 1466 CD1 ILE A 90 -1.473 -14.299 -15.743 1.00 0.00 C ATOM 0 H ILE A 90 1.574 -12.437 -17.742 1.00 0.00 H new ATOM 0 HA ILE A 90 0.463 -13.786 -19.985 1.00 0.00 H new ATOM 0 HB ILE A 90 -1.170 -14.633 -18.454 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -0.082 -12.775 -16.345 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -1.649 -12.658 -17.120 1.00 0.00 H new ATOM 0 HG21 ILE A 90 0.452 -15.745 -16.888 1.00 0.00 H new ATOM 0 HG22 ILE A 90 1.090 -15.652 -18.547 1.00 0.00 H new ATOM 0 HG23 ILE A 90 1.669 -14.516 -17.306 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -1.844 -13.712 -14.903 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -2.294 -14.867 -16.180 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -0.703 -14.986 -15.393 1.00 0.00 H new ATOM 1478 N VAL A 91 -1.080 -11.024 -19.016 1.00 0.00 N ATOM 1479 CA VAL A 91 -2.092 -10.056 -19.427 1.00 0.00 C ATOM 1480 C VAL A 91 -1.696 -9.473 -20.786 1.00 0.00 C ATOM 1481 O VAL A 91 -2.520 -9.427 -21.701 1.00 0.00 O ATOM 1482 CB VAL A 91 -2.286 -8.978 -18.339 1.00 0.00 C ATOM 1483 CG1 VAL A 91 -3.381 -7.972 -18.726 1.00 0.00 C ATOM 1484 CG2 VAL A 91 -2.680 -9.622 -16.999 1.00 0.00 C ATOM 0 H VAL A 91 -0.544 -10.745 -18.195 1.00 0.00 H new ATOM 0 HA VAL A 91 -3.060 -10.543 -19.543 1.00 0.00 H new ATOM 0 HB VAL A 91 -1.334 -8.456 -18.243 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -3.488 -7.229 -17.936 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -3.106 -7.475 -19.656 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -4.326 -8.497 -18.861 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -2.812 -8.845 -16.246 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -3.613 -10.172 -17.120 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -1.894 -10.307 -16.680 1.00 0.00 H new ATOM 1494 N ALA A 92 -0.426 -9.090 -20.949 1.00 0.00 N ATOM 1495 CA ALA A 92 0.093 -8.563 -22.200 1.00 0.00 C ATOM 1496 C ALA A 92 -0.060 -9.587 -23.326 1.00 0.00 C ATOM 1497 O ALA A 92 -0.393 -9.204 -24.447 1.00 0.00 O ATOM 1498 CB ALA A 92 1.559 -8.150 -22.009 1.00 0.00 C ATOM 0 H ALA A 92 0.271 -9.140 -20.206 1.00 0.00 H new ATOM 0 HA ALA A 92 -0.482 -7.682 -22.487 1.00 0.00 H new ATOM 0 HB1 ALA A 92 1.951 -7.754 -22.946 1.00 0.00 H new ATOM 0 HB2 ALA A 92 1.623 -7.384 -21.236 1.00 0.00 H new ATOM 0 HB3 ALA A 92 2.145 -9.018 -21.709 1.00 0.00 H new ATOM 1504 N LYS A 93 0.158 -10.877 -23.049 1.00 0.00 N ATOM 1505 CA LYS A 93 0.013 -11.933 -24.045 1.00 0.00 C ATOM 1506 C LYS A 93 -1.441 -12.056 -24.489 1.00 0.00 C ATOM 1507 O LYS A 93 -1.700 -12.002 -25.692 1.00 0.00 O ATOM 1508 CB LYS A 93 0.570 -13.253 -23.482 1.00 0.00 C ATOM 1509 CG LYS A 93 0.587 -14.372 -24.535 1.00 0.00 C ATOM 1510 CD LYS A 93 1.208 -15.653 -23.964 1.00 0.00 C ATOM 1511 CE LYS A 93 1.216 -16.755 -25.033 1.00 0.00 C ATOM 1512 NZ LYS A 93 1.808 -18.020 -24.531 1.00 0.00 N ATOM 0 H LYS A 93 0.439 -11.214 -22.128 1.00 0.00 H new ATOM 0 HA LYS A 93 0.591 -11.681 -24.934 1.00 0.00 H new ATOM 0 HB2 LYS A 93 1.582 -13.090 -23.112 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -0.034 -13.567 -22.631 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -0.430 -14.575 -24.872 1.00 0.00 H new ATOM 0 HG3 LYS A 93 1.153 -14.047 -25.408 1.00 0.00 H new ATOM 0 HD2 LYS A 93 2.225 -15.455 -23.627 1.00 0.00 H new ATOM 0 HD3 LYS A 93 0.642 -15.984 -23.093 1.00 0.00 H new ATOM 0 HE2 LYS A 93 0.196 -16.941 -25.368 1.00 0.00 H new ATOM 0 HE3 LYS A 93 1.779 -16.412 -25.901 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 1.792 -18.735 -25.287 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 2.791 -17.850 -24.236 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 1.257 -18.363 -23.719 1.00 0.00 H new ATOM 1526 N ILE A 94 -2.391 -12.206 -23.557 1.00 0.00 N ATOM 1527 CA ILE A 94 -3.786 -12.445 -23.936 1.00 0.00 C ATOM 1528 C ILE A 94 -4.423 -11.198 -24.564 1.00 0.00 C ATOM 1529 O ILE A 94 -5.232 -11.326 -25.485 1.00 0.00 O ATOM 1530 CB ILE A 94 -4.623 -13.029 -22.773 1.00 0.00 C ATOM 1531 CG1 ILE A 94 -4.835 -12.027 -21.616 1.00 0.00 C ATOM 1532 CG2 ILE A 94 -3.999 -14.359 -22.302 1.00 0.00 C ATOM 1533 CD1 ILE A 94 -5.626 -12.582 -20.425 1.00 0.00 C ATOM 0 H ILE A 94 -2.222 -12.167 -22.552 1.00 0.00 H new ATOM 0 HA ILE A 94 -3.781 -13.214 -24.709 1.00 0.00 H new ATOM 0 HB ILE A 94 -5.626 -13.232 -23.148 1.00 0.00 H new ATOM 0 HG12 ILE A 94 -3.861 -11.690 -21.262 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -5.354 -11.150 -22.003 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -4.590 -14.768 -21.483 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -3.986 -15.068 -23.130 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -2.979 -14.182 -21.960 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -5.725 -11.810 -19.662 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -6.616 -12.892 -20.759 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -5.099 -13.440 -20.006 1.00 0.00 H new ATOM 1545 N LYS A 95 -4.050 -9.996 -24.106 1.00 0.00 N ATOM 1546 CA LYS A 95 -4.559 -8.746 -24.666 1.00 0.00 C ATOM 1547 C LYS A 95 -3.972 -8.513 -26.058 1.00 0.00 C ATOM 1548 O LYS A 95 -4.716 -8.189 -26.983 1.00 0.00 O ATOM 1549 CB LYS A 95 -4.246 -7.584 -23.706 1.00 0.00 C ATOM 1550 CG LYS A 95 -4.734 -6.234 -24.253 1.00 0.00 C ATOM 1551 CD LYS A 95 -4.487 -5.100 -23.246 1.00 0.00 C ATOM 1552 CE LYS A 95 -4.653 -3.700 -23.864 1.00 0.00 C ATOM 1553 NZ LYS A 95 -3.729 -3.457 -25.002 1.00 0.00 N ATOM 0 H LYS A 95 -3.389 -9.867 -23.340 1.00 0.00 H new ATOM 0 HA LYS A 95 -5.642 -8.806 -24.777 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -4.716 -7.775 -22.741 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -3.171 -7.537 -23.533 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -4.220 -6.011 -25.188 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -5.798 -6.295 -24.481 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -5.179 -5.207 -22.410 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -3.480 -5.195 -22.840 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -5.681 -3.579 -24.205 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -4.481 -2.946 -23.096 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -3.593 -2.433 -25.127 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -2.812 -3.906 -24.807 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -4.134 -3.861 -25.871 1.00 0.00 H new ATOM 1567 N GLY A 96 -2.653 -8.659 -26.203 1.00 0.00 N ATOM 1568 CA GLY A 96 -1.924 -8.407 -27.441 1.00 0.00 C ATOM 1569 C GLY A 96 -0.694 -7.534 -27.208 1.00 0.00 C ATOM 1570 O GLY A 96 0.252 -7.620 -27.988 1.00 0.00 O ATOM 0 H GLY A 96 -2.049 -8.964 -25.440 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -1.618 -9.356 -27.882 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -2.584 -7.920 -28.159 1.00 0.00 H new ATOM 1574 N THR A 97 -0.656 -6.740 -26.131 1.00 0.00 N ATOM 1575 CA THR A 97 0.423 -5.807 -25.795 1.00 0.00 C ATOM 1576 C THR A 97 1.821 -6.454 -25.782 1.00 0.00 C ATOM 1577 O THR A 97 2.822 -5.755 -25.932 1.00 0.00 O ATOM 1578 CB THR A 97 0.104 -5.159 -24.435 1.00 0.00 C ATOM 1579 OG1 THR A 97 -1.284 -4.884 -24.316 1.00 0.00 O ATOM 1580 CG2 THR A 97 0.864 -3.852 -24.202 1.00 0.00 C ATOM 0 H THR A 97 -1.408 -6.731 -25.442 1.00 0.00 H new ATOM 0 HA THR A 97 0.466 -5.053 -26.581 1.00 0.00 H new ATOM 0 HB THR A 97 0.421 -5.885 -23.686 1.00 0.00 H new ATOM 0 HG1 THR A 97 -1.463 -4.474 -23.444 1.00 0.00 H new ATOM 0 HG21 THR A 97 0.597 -3.444 -23.227 1.00 0.00 H new ATOM 0 HG22 THR A 97 1.936 -4.044 -24.233 1.00 0.00 H new ATOM 0 HG23 THR A 97 0.601 -3.135 -24.980 1.00 0.00 H new ATOM 1588 N PHE A 98 1.915 -7.782 -25.631 1.00 0.00 N ATOM 1589 CA PHE A 98 3.177 -8.512 -25.740 1.00 0.00 C ATOM 1590 C PHE A 98 3.862 -8.272 -27.095 1.00 0.00 C ATOM 1591 O PHE A 98 5.093 -8.259 -27.163 1.00 0.00 O ATOM 1592 CB PHE A 98 2.922 -10.007 -25.505 1.00 0.00 C ATOM 1593 CG PHE A 98 4.169 -10.870 -25.577 1.00 0.00 C ATOM 1594 CD1 PHE A 98 5.098 -10.850 -24.518 1.00 0.00 C ATOM 1595 CD2 PHE A 98 4.413 -11.679 -26.704 1.00 0.00 C ATOM 1596 CE1 PHE A 98 6.266 -11.630 -24.590 1.00 0.00 C ATOM 1597 CE2 PHE A 98 5.582 -12.459 -26.773 1.00 0.00 C ATOM 1598 CZ PHE A 98 6.510 -12.434 -25.718 1.00 0.00 C ATOM 0 H PHE A 98 1.113 -8.379 -25.429 1.00 0.00 H new ATOM 0 HA PHE A 98 3.859 -8.140 -24.976 1.00 0.00 H new ATOM 0 HB2 PHE A 98 2.461 -10.136 -24.526 1.00 0.00 H new ATOM 0 HB3 PHE A 98 2.205 -10.362 -26.245 1.00 0.00 H new ATOM 0 HD1 PHE A 98 4.913 -10.235 -23.650 1.00 0.00 H new ATOM 0 HD2 PHE A 98 3.702 -11.701 -27.516 1.00 0.00 H new ATOM 0 HE1 PHE A 98 6.977 -11.612 -23.777 1.00 0.00 H new ATOM 0 HE2 PHE A 98 5.766 -13.078 -27.638 1.00 0.00 H new ATOM 0 HZ PHE A 98 7.408 -13.031 -25.773 1.00 0.00 H new ATOM 1608 N LYS A 99 3.084 -8.074 -28.167 1.00 0.00 N ATOM 1609 CA LYS A 99 3.570 -8.040 -29.548 1.00 0.00 C ATOM 1610 C LYS A 99 2.813 -7.043 -30.440 1.00 0.00 C ATOM 1611 O LYS A 99 3.024 -7.035 -31.653 1.00 0.00 O ATOM 1612 CB LYS A 99 3.607 -9.480 -30.113 1.00 0.00 C ATOM 1613 CG LYS A 99 2.349 -10.355 -29.927 1.00 0.00 C ATOM 1614 CD LYS A 99 1.114 -9.885 -30.703 1.00 0.00 C ATOM 1615 CE LYS A 99 -0.020 -10.909 -30.535 1.00 0.00 C ATOM 1616 NZ LYS A 99 -1.155 -10.654 -31.453 1.00 0.00 N ATOM 0 H LYS A 99 2.077 -7.930 -28.094 1.00 0.00 H new ATOM 0 HA LYS A 99 4.588 -7.652 -29.545 1.00 0.00 H new ATOM 0 HB2 LYS A 99 3.817 -9.416 -31.181 1.00 0.00 H new ATOM 0 HB3 LYS A 99 4.448 -9.999 -29.653 1.00 0.00 H new ATOM 0 HG2 LYS A 99 2.585 -11.374 -30.232 1.00 0.00 H new ATOM 0 HG3 LYS A 99 2.102 -10.389 -28.866 1.00 0.00 H new ATOM 0 HD2 LYS A 99 0.793 -8.909 -30.339 1.00 0.00 H new ATOM 0 HD3 LYS A 99 1.358 -9.767 -31.759 1.00 0.00 H new ATOM 0 HE2 LYS A 99 0.370 -11.911 -30.714 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -0.377 -10.885 -29.505 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -2.022 -11.070 -31.057 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -1.285 -9.629 -31.568 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -0.956 -11.084 -32.379 1.00 0.00 H new ATOM 1630 N GLU A 100 1.964 -6.189 -29.868 1.00 0.00 N ATOM 1631 CA GLU A 100 1.223 -5.131 -30.556 1.00 0.00 C ATOM 1632 C GLU A 100 1.255 -3.864 -29.691 1.00 0.00 C ATOM 1633 O GLU A 100 1.601 -3.917 -28.507 1.00 0.00 O ATOM 1634 CB GLU A 100 -0.231 -5.569 -30.817 1.00 0.00 C ATOM 1635 CG GLU A 100 -0.369 -6.502 -32.025 1.00 0.00 C ATOM 1636 CD GLU A 100 -1.813 -7.003 -32.178 1.00 0.00 C ATOM 1637 OE1 GLU A 100 -2.628 -6.342 -32.864 1.00 0.00 O ATOM 1638 OE2 GLU A 100 -2.133 -8.083 -31.630 1.00 0.00 O ATOM 0 H GLU A 100 1.765 -6.217 -28.868 1.00 0.00 H new ATOM 0 HA GLU A 100 1.688 -4.928 -31.521 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -0.617 -6.072 -29.931 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -0.848 -4.685 -30.976 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -0.066 -5.976 -32.930 1.00 0.00 H new ATOM 0 HG3 GLU A 100 0.303 -7.352 -31.910 1.00 0.00 H new ATOM 1645 N ARG A 101 0.897 -2.719 -30.283 1.00 0.00 N ATOM 1646 CA ARG A 101 0.864 -1.424 -29.597 1.00 0.00 C ATOM 1647 C ARG A 101 -0.109 -1.492 -28.405 1.00 0.00 C ATOM 1648 O ARG A 101 -1.172 -2.102 -28.555 1.00 0.00 O ATOM 1649 CB ARG A 101 0.441 -0.340 -30.614 1.00 0.00 C ATOM 1650 CG ARG A 101 0.767 1.104 -30.204 1.00 0.00 C ATOM 1651 CD ARG A 101 2.271 1.410 -30.211 1.00 0.00 C ATOM 1652 NE ARG A 101 2.532 2.807 -29.820 1.00 0.00 N ATOM 1653 CZ ARG A 101 3.738 3.384 -29.735 1.00 0.00 C ATOM 1654 NH1 ARG A 101 4.843 2.694 -30.012 1.00 0.00 N ATOM 1655 NH2 ARG A 101 3.833 4.658 -29.369 1.00 0.00 N ATOM 0 H ARG A 101 0.619 -2.666 -31.263 1.00 0.00 H new ATOM 0 HA ARG A 101 1.849 -1.172 -29.204 1.00 0.00 H new ATOM 0 HB2 ARG A 101 0.927 -0.549 -31.567 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -0.633 -0.420 -30.780 1.00 0.00 H new ATOM 0 HG2 ARG A 101 0.260 1.791 -30.882 1.00 0.00 H new ATOM 0 HG3 ARG A 101 0.370 1.290 -29.206 1.00 0.00 H new ATOM 0 HD2 ARG A 101 2.785 0.736 -29.526 1.00 0.00 H new ATOM 0 HD3 ARG A 101 2.678 1.226 -31.205 1.00 0.00 H new ATOM 0 HE ARG A 101 1.723 3.386 -29.594 1.00 0.00 H new ATOM 0 HH11 ARG A 101 4.776 1.716 -30.292 1.00 0.00 H new ATOM 0 HH12 ARG A 101 5.756 3.144 -29.944 1.00 0.00 H new ATOM 0 HH21 ARG A 101 2.990 5.191 -29.155 1.00 0.00 H new ATOM 0 HH22 ARG A 101 4.749 5.103 -29.303 1.00 0.00 H new ATOM 1669 N PRO A 102 0.191 -0.857 -27.251 1.00 0.00 N ATOM 1670 CA PRO A 102 -0.723 -0.801 -26.108 1.00 0.00 C ATOM 1671 C PRO A 102 -2.134 -0.329 -26.466 1.00 0.00 C ATOM 1672 O PRO A 102 -3.112 -0.901 -25.980 1.00 0.00 O ATOM 1673 CB PRO A 102 -0.053 0.119 -25.081 1.00 0.00 C ATOM 1674 CG PRO A 102 1.433 -0.047 -25.386 1.00 0.00 C ATOM 1675 CD PRO A 102 1.464 -0.241 -26.900 1.00 0.00 C ATOM 0 HA PRO A 102 -0.883 -1.804 -25.711 1.00 0.00 H new ATOM 0 HB2 PRO A 102 -0.375 1.154 -25.196 1.00 0.00 H new ATOM 0 HB3 PRO A 102 -0.290 -0.177 -24.059 1.00 0.00 H new ATOM 0 HG2 PRO A 102 2.006 0.829 -25.081 1.00 0.00 H new ATOM 0 HG3 PRO A 102 1.857 -0.904 -24.862 1.00 0.00 H new ATOM 0 HD2 PRO A 102 1.591 0.712 -27.413 1.00 0.00 H new ATOM 0 HD3 PRO A 102 2.299 -0.876 -27.195 1.00 0.00 H new ATOM 1683 N LYS A 103 -2.243 0.672 -27.340 1.00 0.00 N ATOM 1684 CA LYS A 103 -3.489 1.117 -27.960 1.00 0.00 C ATOM 1685 C LYS A 103 -3.141 1.806 -29.279 1.00 0.00 C ATOM 1686 O LYS A 103 -2.048 2.363 -29.403 1.00 0.00 O ATOM 1687 CB LYS A 103 -4.277 2.050 -27.016 1.00 0.00 C ATOM 1688 CG LYS A 103 -3.509 3.305 -26.560 1.00 0.00 C ATOM 1689 CD LYS A 103 -4.365 4.157 -25.613 1.00 0.00 C ATOM 1690 CE LYS A 103 -3.580 5.398 -25.167 1.00 0.00 C ATOM 1691 NZ LYS A 103 -4.366 6.258 -24.247 1.00 0.00 N ATOM 0 H LYS A 103 -1.435 1.215 -27.646 1.00 0.00 H new ATOM 0 HA LYS A 103 -4.137 0.263 -28.157 1.00 0.00 H new ATOM 0 HB2 LYS A 103 -5.192 2.364 -27.518 1.00 0.00 H new ATOM 0 HB3 LYS A 103 -4.576 1.483 -26.134 1.00 0.00 H new ATOM 0 HG2 LYS A 103 -2.588 3.010 -26.058 1.00 0.00 H new ATOM 0 HG3 LYS A 103 -3.223 3.897 -27.429 1.00 0.00 H new ATOM 0 HD2 LYS A 103 -5.285 4.459 -26.114 1.00 0.00 H new ATOM 0 HD3 LYS A 103 -4.655 3.568 -24.743 1.00 0.00 H new ATOM 0 HE2 LYS A 103 -2.660 5.086 -24.673 1.00 0.00 H new ATOM 0 HE3 LYS A 103 -3.290 5.977 -26.044 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 -3.796 7.084 -23.972 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 -5.232 6.579 -24.726 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 -4.621 5.715 -23.397 1.00 0.00 H new ATOM 1705 N LYS A 104 -4.049 1.751 -30.255 1.00 0.00 N ATOM 1706 CA LYS A 104 -3.915 2.490 -31.507 1.00 0.00 C ATOM 1707 C LYS A 104 -3.799 3.977 -31.180 1.00 0.00 C ATOM 1708 O LYS A 104 -2.883 4.638 -31.709 1.00 0.00 O ATOM 1709 CB LYS A 104 -5.111 2.182 -32.427 1.00 0.00 C ATOM 1710 CG LYS A 104 -5.065 2.880 -33.798 1.00 0.00 C ATOM 1711 CD LYS A 104 -3.872 2.447 -34.665 1.00 0.00 C ATOM 1712 CE LYS A 104 -3.871 3.124 -36.045 1.00 0.00 C ATOM 1713 NZ LYS A 104 -4.979 2.667 -36.923 1.00 0.00 N ATOM 1714 OXT LYS A 104 -4.631 4.488 -30.400 1.00 0.00 O ATOM 0 H LYS A 104 -4.899 1.191 -30.197 1.00 0.00 H new ATOM 0 HA LYS A 104 -3.017 2.187 -32.045 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -5.163 1.105 -32.585 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -6.029 2.474 -31.917 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -5.990 2.670 -34.335 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -5.022 3.959 -33.647 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -2.944 2.686 -34.146 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -3.895 1.365 -34.795 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -3.943 4.204 -35.913 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -2.920 2.926 -36.539 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -4.903 3.134 -37.849 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -4.919 1.636 -37.049 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -5.891 2.910 -36.486 1.00 0.00 H new TER 1728 LYS A 104