USER MOD reduce.3.24.130724 H: found=0, std=0, add=1025, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 1020 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 28 CYS SG : rot 75:sc= 0.881 USER MOD Set 1.2: A 90 THR OG1 : rot 161:sc= 0.995 USER MOD Set 2.1: A 14 MET CE :methyl -161:sc= -0.593 (180deg=-1.09) USER MOD Set 2.2: A 84 MET CE :methyl -165:sc= -0.311 (180deg=-0.0422) USER MOD Set 3.1: A 6 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 123 ASN : amide:sc= -0.0704 K(o=-0.07,f=-1.4!) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0.0588 USER MOD Single : A 3 HIS : no HE2:sc= -0.0208 K(o=-0.021,f=-0.52) USER MOD Single : A 4 MET CE :methyl 169:sc= 0 (180deg=-0.091) USER MOD Single : A 8 SER OG : rot 47:sc= 0.059 USER MOD Single : A 10 ASN : amide:sc= -0.0119 K(o=-0.012,f=-2.8!) USER MOD Single : A 17 HIS : no HE2:sc= -1.12 K(o=-1.1,f=-3.3!) USER MOD Single : A 21 THR OG1 : rot -89:sc= 1.16 USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 29 MET CE :methyl -163:sc= -0.27 (180deg=-0.586) USER MOD Single : A 35 MET CE :methyl -158:sc= -0.153 (180deg=-0.428) USER MOD Single : A 37 THR OG1 : rot -150:sc= -0.126 USER MOD Single : A 39 GLN : amide:sc= -0.0474 X(o=-0.047,f=-0.38) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 TYR OH : rot 93:sc= 1.02 USER MOD Single : A 43 LYS NZ :NH3+ 179:sc= 0.92 (180deg=0.92) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 GLN : amide:sc= -0.201 K(o=-0.2,f=-2.2) USER MOD Single : A 54 TYR OH : rot 180:sc= 0.00393 USER MOD Single : A 61 TYR OH : rot 180:sc= -0.0677 USER MOD Single : A 62 THR OG1 : rot -141:sc= 1.27 USER MOD Single : A 63 SER OG : rot 180:sc= 0.0797 USER MOD Single : A 64 LYS NZ :NH3+ -176:sc= 1.22 (180deg=1.15) USER MOD Single : A 69 SER OG : rot 180:sc= -0.129 USER MOD Single : A 72 THR OG1 : rot 82:sc= 0.457 USER MOD Single : A 73 LYS NZ :NH3+ -166:sc= 1.18 (180deg=1.07) USER MOD Single : A 75 ASN : amide:sc= 0.843 K(o=0.84,f=-5.4!) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 78 ASN : amide:sc= -0.0926 K(o=-0.093,f=-0.85) USER MOD Single : A 83 THR OG1 : rot 99:sc= 1.26 USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 HIS :FLIP no HD1:sc= -0.845 F(o=-2.4,f=-0.84) USER MOD Single : A 94 ASN : amide:sc= -0.179 X(o=-0.18,f=0) USER MOD Single : A 101 CYS SG : rot 167:sc= 1.32 USER MOD Single : A 102 MET CE :methyl 174:sc= 0 (180deg=-0.0457) USER MOD Single : A 104 SER OG : rot 80:sc= 0.00111 USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 SER OG : rot 110:sc= 0.464 USER MOD Single : A 114 SER OG : rot 180:sc= 0.0857 USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 120 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 THR OG1 : rot 180:sc= -0.0494 USER MOD Single : A 122 TYR OH : rot 120:sc= 0.685 USER MOD Single : A 125 TYR OH : rot 180:sc= 0 USER MOD Single : A 127 THR OG1 : rot 180:sc= 0 USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 7.476 -19.610 5.128 1.00 24.43 N ATOM 2 CA GLY A 1 7.829 -19.327 6.519 1.00 4.21 C ATOM 3 C GLY A 1 7.072 -18.126 7.054 1.00 34.10 C ATOM 4 O GLY A 1 5.888 -18.245 7.368 1.00 33.42 O ATOM 0 H1 GLY A 1 8.012 -20.437 4.795 1.00 24.43 H new ATOM 0 H2 GLY A 1 6.457 -19.808 5.062 1.00 24.43 H new ATOM 0 H3 GLY A 1 7.707 -18.786 4.537 1.00 24.43 H new ATOM 0 HA2 GLY A 1 7.611 -20.199 7.135 1.00 4.21 H new ATOM 0 HA3 GLY A 1 8.901 -19.145 6.593 1.00 4.21 H new ATOM 8 N SER A 2 7.749 -16.991 7.230 1.00 23.04 N ATOM 9 CA SER A 2 7.181 -15.761 7.767 1.00 53.41 C ATOM 10 C SER A 2 6.188 -15.117 6.783 1.00 2.42 C ATOM 11 O SER A 2 6.081 -15.512 5.619 1.00 72.05 O ATOM 12 CB SER A 2 8.329 -14.819 8.173 1.00 31.44 C ATOM 13 OG SER A 2 9.452 -14.929 7.307 1.00 72.02 O ATOM 0 H SER A 2 8.738 -16.903 6.995 1.00 23.04 H new ATOM 0 HA SER A 2 6.594 -15.984 8.658 1.00 53.41 H new ATOM 0 HB2 SER A 2 7.970 -13.790 8.169 1.00 31.44 H new ATOM 0 HB3 SER A 2 8.637 -15.045 9.194 1.00 31.44 H new ATOM 0 HG SER A 2 10.154 -14.312 7.602 1.00 72.02 H new ATOM 19 N HIS A 3 5.451 -14.118 7.269 1.00 33.41 N ATOM 20 CA HIS A 3 4.303 -13.475 6.633 1.00 71.13 C ATOM 21 C HIS A 3 4.393 -11.940 6.690 1.00 62.44 C ATOM 22 O HIS A 3 3.367 -11.245 6.674 1.00 42.13 O ATOM 23 CB HIS A 3 3.007 -13.991 7.270 1.00 14.41 C ATOM 24 CG HIS A 3 2.878 -13.709 8.746 1.00 73.42 C ATOM 25 ND1 HIS A 3 2.719 -12.482 9.357 1.00 51.05 N ATOM 26 CD2 HIS A 3 2.958 -14.656 9.723 1.00 53.14 C ATOM 27 CE1 HIS A 3 2.708 -12.683 10.684 1.00 20.33 C ATOM 28 NE2 HIS A 3 2.879 -13.992 10.958 1.00 63.04 N ATOM 0 H HIS A 3 5.655 -13.709 8.181 1.00 33.41 H new ATOM 0 HA HIS A 3 4.304 -13.739 5.575 1.00 71.13 H new ATOM 0 HB2 HIS A 3 2.159 -13.542 6.752 1.00 14.41 H new ATOM 0 HB3 HIS A 3 2.943 -15.068 7.112 1.00 14.41 H new ATOM 0 HD1 HIS A 3 2.626 -11.583 8.885 1.00 51.05 H new ATOM 0 HD2 HIS A 3 3.063 -15.721 9.575 1.00 53.14 H new ATOM 0 HE1 HIS A 3 2.581 -11.908 11.425 1.00 20.33 H new ATOM 36 N MET A 4 5.602 -11.391 6.847 1.00 31.11 N ATOM 37 CA MET A 4 5.809 -9.951 6.907 1.00 40.13 C ATOM 38 C MET A 4 7.050 -9.524 6.125 1.00 0.21 C ATOM 39 O MET A 4 7.786 -10.364 5.593 1.00 33.52 O ATOM 40 CB MET A 4 5.765 -9.444 8.357 1.00 41.12 C ATOM 41 CG MET A 4 6.988 -9.873 9.175 1.00 12.33 C ATOM 42 SD MET A 4 8.439 -8.793 9.061 1.00 34.25 S ATOM 43 CE MET A 4 7.856 -7.368 10.019 1.00 24.23 C ATOM 0 H MET A 4 6.459 -11.936 6.935 1.00 31.11 H new ATOM 0 HA MET A 4 4.978 -9.459 6.401 1.00 40.13 H new ATOM 0 HB2 MET A 4 5.699 -8.356 8.355 1.00 41.12 H new ATOM 0 HB3 MET A 4 4.862 -9.817 8.840 1.00 41.12 H new ATOM 0 HG2 MET A 4 6.693 -9.943 10.222 1.00 12.33 H new ATOM 0 HG3 MET A 4 7.279 -10.874 8.858 1.00 12.33 H new ATOM 0 HE1 MET A 4 8.691 -6.695 10.214 1.00 24.23 H new ATOM 0 HE2 MET A 4 7.088 -6.840 9.454 1.00 24.23 H new ATOM 0 HE3 MET A 4 7.439 -7.712 10.965 1.00 24.23 H new ATOM 53 N GLY A 5 7.271 -8.211 6.054 1.00 14.10 N ATOM 54 CA GLY A 5 8.247 -7.627 5.164 1.00 4.23 C ATOM 55 C GLY A 5 7.832 -7.871 3.724 1.00 63.04 C ATOM 56 O GLY A 5 6.643 -7.844 3.412 1.00 70.23 O ATOM 0 H GLY A 5 6.769 -7.527 6.620 1.00 14.10 H new ATOM 0 HA2 GLY A 5 8.332 -6.557 5.352 1.00 4.23 H new ATOM 0 HA3 GLY A 5 9.229 -8.062 5.349 1.00 4.23 H new ATOM 60 N THR A 6 8.789 -7.921 2.810 1.00 1.44 N ATOM 61 CA THR A 6 8.517 -7.869 1.377 1.00 21.01 C ATOM 62 C THR A 6 8.196 -9.279 0.879 1.00 24.31 C ATOM 63 O THR A 6 8.613 -10.272 1.482 1.00 32.12 O ATOM 64 CB THR A 6 9.778 -7.319 0.691 1.00 13.03 C ATOM 65 OG1 THR A 6 10.322 -6.244 1.451 1.00 13.44 O ATOM 66 CG2 THR A 6 9.567 -6.833 -0.754 1.00 35.22 C ATOM 0 H THR A 6 9.780 -7.999 3.039 1.00 1.44 H new ATOM 0 HA THR A 6 7.665 -7.228 1.152 1.00 21.01 H new ATOM 0 HB THR A 6 10.462 -8.166 0.642 1.00 13.03 H new ATOM 0 HG1 THR A 6 11.126 -5.903 1.006 1.00 13.44 H new ATOM 0 HG21 THR A 6 10.511 -6.463 -1.155 1.00 35.22 H new ATOM 0 HG22 THR A 6 9.211 -7.661 -1.368 1.00 35.22 H new ATOM 0 HG23 THR A 6 8.829 -6.031 -0.764 1.00 35.22 H new ATOM 74 N VAL A 7 7.472 -9.358 -0.233 1.00 50.02 N ATOM 75 CA VAL A 7 7.128 -10.561 -0.979 1.00 14.33 C ATOM 76 C VAL A 7 6.870 -10.153 -2.444 1.00 74.41 C ATOM 77 O VAL A 7 7.095 -8.995 -2.806 1.00 70.41 O ATOM 78 CB VAL A 7 5.905 -11.258 -0.359 1.00 74.03 C ATOM 79 CG1 VAL A 7 6.096 -11.838 1.047 1.00 2.34 C ATOM 80 CG2 VAL A 7 4.679 -10.330 -0.331 1.00 34.21 C ATOM 0 H VAL A 7 7.083 -8.521 -0.667 1.00 50.02 H new ATOM 0 HA VAL A 7 7.947 -11.279 -0.940 1.00 14.33 H new ATOM 0 HB VAL A 7 5.752 -12.107 -1.025 1.00 74.03 H new ATOM 0 HG11 VAL A 7 5.167 -12.303 1.378 1.00 2.34 H new ATOM 0 HG12 VAL A 7 6.889 -12.585 1.028 1.00 2.34 H new ATOM 0 HG13 VAL A 7 6.367 -11.039 1.737 1.00 2.34 H new ATOM 0 HG21 VAL A 7 3.834 -10.856 0.114 1.00 34.21 H new ATOM 0 HG22 VAL A 7 4.907 -9.444 0.261 1.00 34.21 H new ATOM 0 HG23 VAL A 7 4.426 -10.031 -1.348 1.00 34.21 H new ATOM 90 N SER A 8 6.384 -11.061 -3.298 1.00 0.12 N ATOM 91 CA SER A 8 5.935 -10.746 -4.649 1.00 24.45 C ATOM 92 C SER A 8 4.528 -11.310 -4.813 1.00 21.23 C ATOM 93 O SER A 8 4.320 -12.387 -5.383 1.00 42.55 O ATOM 94 CB SER A 8 6.943 -11.237 -5.701 1.00 4.44 C ATOM 95 OG SER A 8 7.282 -12.607 -5.548 1.00 22.11 O ATOM 0 H SER A 8 6.292 -12.049 -3.061 1.00 0.12 H new ATOM 0 HA SER A 8 5.887 -9.669 -4.809 1.00 24.45 H new ATOM 0 HB2 SER A 8 6.526 -11.081 -6.696 1.00 4.44 H new ATOM 0 HB3 SER A 8 7.849 -10.635 -5.637 1.00 4.44 H new ATOM 0 HG SER A 8 6.465 -13.134 -5.426 1.00 22.11 H new ATOM 101 N TRP A 9 3.538 -10.625 -4.250 1.00 21.41 N ATOM 102 CA TRP A 9 2.147 -10.931 -4.541 1.00 12.35 C ATOM 103 C TRP A 9 1.724 -10.201 -5.809 1.00 21.15 C ATOM 104 O TRP A 9 2.450 -9.363 -6.347 1.00 5.02 O ATOM 105 CB TRP A 9 1.279 -10.581 -3.326 1.00 45.11 C ATOM 106 CG TRP A 9 1.576 -11.394 -2.101 1.00 41.31 C ATOM 107 CD1 TRP A 9 2.188 -12.603 -2.070 1.00 72.32 C ATOM 108 CD2 TRP A 9 1.323 -11.046 -0.709 1.00 62.04 C ATOM 109 NE1 TRP A 9 2.314 -13.031 -0.766 1.00 41.10 N ATOM 110 CE2 TRP A 9 1.804 -12.105 0.114 1.00 21.03 C ATOM 111 CE3 TRP A 9 0.789 -9.915 -0.058 1.00 43.24 C ATOM 112 CZ2 TRP A 9 1.780 -12.031 1.512 1.00 73.54 C ATOM 113 CZ3 TRP A 9 0.760 -9.834 1.346 1.00 11.11 C ATOM 114 CH2 TRP A 9 1.259 -10.888 2.132 1.00 52.24 C ATOM 0 H TRP A 9 3.675 -9.857 -3.592 1.00 21.41 H new ATOM 0 HA TRP A 9 2.016 -11.997 -4.727 1.00 12.35 H new ATOM 0 HB2 TRP A 9 1.415 -9.526 -3.089 1.00 45.11 H new ATOM 0 HB3 TRP A 9 0.231 -10.716 -3.592 1.00 45.11 H new ATOM 0 HD1 TRP A 9 2.526 -13.150 -2.938 1.00 72.32 H new ATOM 0 HE1 TRP A 9 2.731 -13.920 -0.489 1.00 41.10 H new ATOM 0 HE3 TRP A 9 0.396 -9.099 -0.646 1.00 43.24 H new ATOM 0 HZ2 TRP A 9 2.160 -12.848 2.107 1.00 73.54 H new ATOM 0 HZ3 TRP A 9 0.351 -8.956 1.824 1.00 11.11 H new ATOM 0 HH2 TRP A 9 1.241 -10.816 3.209 1.00 52.24 H new ATOM 125 N ASN A 10 0.546 -10.570 -6.298 1.00 3.44 N ATOM 126 CA ASN A 10 -0.185 -9.851 -7.322 1.00 1.31 C ATOM 127 C ASN A 10 -1.095 -8.828 -6.647 1.00 25.32 C ATOM 128 O ASN A 10 -1.360 -8.945 -5.449 1.00 40.44 O ATOM 129 CB ASN A 10 -1.051 -10.856 -8.094 1.00 45.53 C ATOM 130 CG ASN A 10 -1.136 -10.468 -9.549 1.00 30.31 C ATOM 131 OD1 ASN A 10 -1.721 -9.447 -9.893 1.00 63.04 O ATOM 132 ND2 ASN A 10 -0.527 -11.264 -10.397 1.00 72.33 N ATOM 0 H ASN A 10 0.061 -11.408 -5.978 1.00 3.44 H new ATOM 0 HA ASN A 10 0.503 -9.346 -8.000 1.00 1.31 H new ATOM 0 HB2 ASN A 10 -0.628 -11.856 -8.002 1.00 45.53 H new ATOM 0 HB3 ASN A 10 -2.051 -10.892 -7.662 1.00 45.53 H new ATOM 0 HD21 ASN A 10 -0.527 -11.044 -11.393 1.00 72.33 H new ATOM 0 HD22 ASN A 10 -0.054 -12.102 -10.060 1.00 72.33 H new ATOM 139 N LEU A 11 -1.700 -7.943 -7.438 1.00 24.13 N ATOM 140 CA LEU A 11 -2.867 -7.154 -7.056 1.00 21.51 C ATOM 141 C LEU A 11 -3.915 -8.044 -6.397 1.00 24.14 C ATOM 142 O LEU A 11 -4.331 -7.773 -5.271 1.00 62.30 O ATOM 143 CB LEU A 11 -3.389 -6.430 -8.308 1.00 73.41 C ATOM 144 CG LEU A 11 -4.794 -5.803 -8.224 1.00 40.53 C ATOM 145 CD1 LEU A 11 -4.971 -4.864 -7.030 1.00 53.20 C ATOM 146 CD2 LEU A 11 -5.042 -5.022 -9.523 1.00 32.43 C ATOM 0 H LEU A 11 -1.382 -7.751 -8.388 1.00 24.13 H new ATOM 0 HA LEU A 11 -2.605 -6.400 -6.313 1.00 21.51 H new ATOM 0 HB2 LEU A 11 -2.681 -5.641 -8.562 1.00 73.41 H new ATOM 0 HB3 LEU A 11 -3.385 -7.140 -9.135 1.00 73.41 H new ATOM 0 HG LEU A 11 -5.512 -6.612 -8.089 1.00 40.53 H new ATOM 0 HD11 LEU A 11 -5.983 -4.458 -7.033 1.00 53.20 H new ATOM 0 HD12 LEU A 11 -4.804 -5.416 -6.105 1.00 53.20 H new ATOM 0 HD13 LEU A 11 -4.253 -4.047 -7.100 1.00 53.20 H new ATOM 0 HD21 LEU A 11 -6.032 -4.567 -9.490 1.00 32.43 H new ATOM 0 HD22 LEU A 11 -4.287 -4.243 -9.629 1.00 32.43 H new ATOM 0 HD23 LEU A 11 -4.983 -5.702 -10.373 1.00 32.43 H new ATOM 158 N ARG A 12 -4.330 -9.112 -7.082 1.00 31.43 N ATOM 159 CA ARG A 12 -5.311 -10.030 -6.521 1.00 41.30 C ATOM 160 C ARG A 12 -4.804 -10.699 -5.259 1.00 3.13 C ATOM 161 O ARG A 12 -5.515 -10.708 -4.263 1.00 54.24 O ATOM 162 CB ARG A 12 -5.747 -11.084 -7.550 1.00 1.50 C ATOM 163 CG ARG A 12 -7.141 -10.716 -8.064 1.00 72.53 C ATOM 164 CD ARG A 12 -7.633 -11.722 -9.103 1.00 44.52 C ATOM 165 NE ARG A 12 -8.128 -12.957 -8.479 1.00 21.33 N ATOM 166 CZ ARG A 12 -8.284 -14.125 -9.104 1.00 41.22 C ATOM 167 NH1 ARG A 12 -7.995 -14.234 -10.394 1.00 73.44 N ATOM 168 NH2 ARG A 12 -8.788 -15.169 -8.457 1.00 30.33 N ATOM 0 H ARG A 12 -4.003 -9.357 -8.017 1.00 31.43 H new ATOM 0 HA ARG A 12 -6.182 -9.432 -6.253 1.00 41.30 H new ATOM 0 HB2 ARG A 12 -5.037 -11.123 -8.376 1.00 1.50 H new ATOM 0 HB3 ARG A 12 -5.761 -12.074 -7.095 1.00 1.50 H new ATOM 0 HG2 ARG A 12 -7.841 -10.680 -7.229 1.00 72.53 H new ATOM 0 HG3 ARG A 12 -7.117 -9.719 -8.503 1.00 72.53 H new ATOM 0 HD2 ARG A 12 -8.428 -11.271 -9.697 1.00 44.52 H new ATOM 0 HD3 ARG A 12 -6.821 -11.962 -9.789 1.00 44.52 H new ATOM 0 HE ARG A 12 -8.372 -12.918 -7.489 1.00 21.33 H new ATOM 0 HH11 ARG A 12 -7.653 -13.424 -10.910 1.00 73.44 H new ATOM 0 HH12 ARG A 12 -8.115 -15.128 -10.870 1.00 73.44 H new ATOM 0 HH21 ARG A 12 -9.058 -15.080 -7.477 1.00 30.33 H new ATOM 0 HH22 ARG A 12 -8.905 -16.060 -8.940 1.00 30.33 H new ATOM 182 N GLU A 13 -3.611 -11.286 -5.306 1.00 31.02 N ATOM 183 CA GLU A 13 -3.132 -12.121 -4.214 1.00 1.41 C ATOM 184 C GLU A 13 -2.941 -11.287 -2.940 1.00 45.01 C ATOM 185 O GLU A 13 -3.149 -11.816 -1.849 1.00 32.33 O ATOM 186 CB GLU A 13 -1.837 -12.846 -4.623 1.00 1.53 C ATOM 187 CG GLU A 13 -1.930 -13.681 -5.913 1.00 62.44 C ATOM 188 CD GLU A 13 -2.960 -14.808 -5.816 1.00 43.12 C ATOM 189 OE1 GLU A 13 -4.175 -14.522 -5.893 1.00 65.02 O ATOM 190 OE2 GLU A 13 -2.569 -15.985 -5.643 1.00 20.15 O ATOM 0 H GLU A 13 -2.961 -11.198 -6.087 1.00 31.02 H new ATOM 0 HA GLU A 13 -3.881 -12.882 -3.995 1.00 1.41 H new ATOM 0 HB2 GLU A 13 -1.048 -12.104 -4.746 1.00 1.53 H new ATOM 0 HB3 GLU A 13 -1.534 -13.501 -3.807 1.00 1.53 H new ATOM 0 HG2 GLU A 13 -2.190 -13.027 -6.746 1.00 62.44 H new ATOM 0 HG3 GLU A 13 -0.952 -14.107 -6.136 1.00 62.44 H new ATOM 197 N MET A 14 -2.582 -10.001 -3.068 1.00 12.23 N ATOM 198 CA MET A 14 -2.454 -9.070 -1.964 1.00 0.41 C ATOM 199 C MET A 14 -3.830 -8.650 -1.441 1.00 23.30 C ATOM 200 O MET A 14 -4.020 -8.632 -0.225 1.00 15.52 O ATOM 201 CB MET A 14 -1.628 -7.856 -2.423 1.00 64.24 C ATOM 202 CG MET A 14 -1.326 -6.948 -1.232 1.00 33.34 C ATOM 203 SD MET A 14 0.257 -6.061 -1.334 1.00 53.20 S ATOM 204 CE MET A 14 -0.159 -4.802 -2.531 1.00 41.02 C ATOM 0 H MET A 14 -2.369 -9.579 -3.972 1.00 12.23 H new ATOM 0 HA MET A 14 -1.936 -9.555 -1.137 1.00 0.41 H new ATOM 0 HB2 MET A 14 -0.697 -8.191 -2.880 1.00 64.24 H new ATOM 0 HB3 MET A 14 -2.175 -7.301 -3.185 1.00 64.24 H new ATOM 0 HG2 MET A 14 -2.130 -6.218 -1.136 1.00 33.34 H new ATOM 0 HG3 MET A 14 -1.332 -7.550 -0.323 1.00 33.34 H new ATOM 0 HE1 MET A 14 0.755 -4.391 -2.959 1.00 41.02 H new ATOM 0 HE2 MET A 14 -0.766 -5.240 -3.323 1.00 41.02 H new ATOM 0 HE3 MET A 14 -0.720 -4.006 -2.042 1.00 41.02 H new ATOM 214 N LEU A 15 -4.781 -8.329 -2.331 1.00 52.51 N ATOM 215 CA LEU A 15 -6.151 -7.992 -1.937 1.00 53.14 C ATOM 216 C LEU A 15 -6.733 -9.149 -1.129 1.00 3.35 C ATOM 217 O LEU A 15 -7.267 -8.941 -0.045 1.00 2.32 O ATOM 218 CB LEU A 15 -7.029 -7.721 -3.178 1.00 54.24 C ATOM 219 CG LEU A 15 -8.375 -7.055 -2.815 1.00 33.25 C ATOM 220 CD1 LEU A 15 -8.188 -5.543 -2.673 1.00 4.12 C ATOM 221 CD2 LEU A 15 -9.438 -7.289 -3.895 1.00 45.31 C ATOM 0 H LEU A 15 -4.620 -8.297 -3.338 1.00 52.51 H new ATOM 0 HA LEU A 15 -6.135 -7.086 -1.331 1.00 53.14 H new ATOM 0 HB2 LEU A 15 -6.485 -7.079 -3.871 1.00 54.24 H new ATOM 0 HB3 LEU A 15 -7.220 -8.661 -3.696 1.00 54.24 H new ATOM 0 HG LEU A 15 -8.707 -7.503 -1.878 1.00 33.25 H new ATOM 0 HD11 LEU A 15 -9.141 -5.081 -2.417 1.00 4.12 H new ATOM 0 HD12 LEU A 15 -7.463 -5.338 -1.886 1.00 4.12 H new ATOM 0 HD13 LEU A 15 -7.827 -5.131 -3.615 1.00 4.12 H new ATOM 0 HD21 LEU A 15 -10.369 -6.804 -3.600 1.00 45.31 H new ATOM 0 HD22 LEU A 15 -9.094 -6.870 -4.841 1.00 45.31 H new ATOM 0 HD23 LEU A 15 -9.608 -8.359 -4.013 1.00 45.31 H new ATOM 233 N ALA A 16 -6.605 -10.366 -1.656 1.00 44.22 N ATOM 234 CA ALA A 16 -7.108 -11.585 -1.058 1.00 72.22 C ATOM 235 C ALA A 16 -6.437 -11.856 0.292 1.00 30.43 C ATOM 236 O ALA A 16 -7.137 -12.186 1.251 1.00 60.52 O ATOM 237 CB ALA A 16 -6.880 -12.730 -2.052 1.00 2.52 C ATOM 0 H ALA A 16 -6.129 -10.527 -2.544 1.00 44.22 H new ATOM 0 HA ALA A 16 -8.174 -11.492 -0.853 1.00 72.22 H new ATOM 0 HB1 ALA A 16 -7.251 -13.662 -1.625 1.00 2.52 H new ATOM 0 HB2 ALA A 16 -7.413 -12.518 -2.979 1.00 2.52 H new ATOM 0 HB3 ALA A 16 -5.814 -12.825 -2.259 1.00 2.52 H new ATOM 243 N HIS A 17 -5.112 -11.681 0.398 1.00 44.22 N ATOM 244 CA HIS A 17 -4.397 -11.839 1.659 1.00 3.44 C ATOM 245 C HIS A 17 -4.980 -10.905 2.713 1.00 72.22 C ATOM 246 O HIS A 17 -5.205 -11.308 3.850 1.00 32.44 O ATOM 247 CB HIS A 17 -2.895 -11.556 1.483 1.00 30.10 C ATOM 248 CG HIS A 17 -2.122 -11.561 2.782 1.00 73.11 C ATOM 249 ND1 HIS A 17 -1.743 -12.676 3.489 1.00 74.50 N ATOM 250 CD2 HIS A 17 -1.697 -10.464 3.483 1.00 45.13 C ATOM 251 CE1 HIS A 17 -1.088 -12.261 4.587 1.00 70.42 C ATOM 252 NE2 HIS A 17 -1.030 -10.916 4.629 1.00 60.03 N ATOM 0 H HIS A 17 -4.514 -11.427 -0.388 1.00 44.22 H new ATOM 0 HA HIS A 17 -4.515 -12.872 1.987 1.00 3.44 H new ATOM 0 HB2 HIS A 17 -2.469 -12.303 0.814 1.00 30.10 H new ATOM 0 HB3 HIS A 17 -2.771 -10.587 1.000 1.00 30.10 H new ATOM 0 HD1 HIS A 17 -1.926 -13.645 3.228 1.00 74.50 H new ATOM 0 HD2 HIS A 17 -1.849 -9.432 3.202 1.00 45.13 H new ATOM 0 HE1 HIS A 17 -0.666 -12.917 5.334 1.00 70.42 H new ATOM 260 N ALA A 18 -5.182 -9.640 2.363 1.00 45.53 N ATOM 261 CA ALA A 18 -5.604 -8.617 3.300 1.00 70.32 C ATOM 262 C ALA A 18 -7.096 -8.739 3.624 1.00 13.22 C ATOM 263 O ALA A 18 -7.488 -8.381 4.729 1.00 60.10 O ATOM 264 CB ALA A 18 -5.251 -7.270 2.678 1.00 2.15 C ATOM 0 H ALA A 18 -5.055 -9.297 1.411 1.00 45.53 H new ATOM 0 HA ALA A 18 -5.092 -8.728 4.256 1.00 70.32 H new ATOM 0 HB1 ALA A 18 -5.552 -6.468 3.352 1.00 2.15 H new ATOM 0 HB2 ALA A 18 -4.175 -7.218 2.510 1.00 2.15 H new ATOM 0 HB3 ALA A 18 -5.773 -7.160 1.727 1.00 2.15 H new ATOM 270 N GLU A 19 -7.930 -9.245 2.709 1.00 13.22 N ATOM 271 CA GLU A 19 -9.329 -9.572 2.988 1.00 12.43 C ATOM 272 C GLU A 19 -9.400 -10.699 4.017 1.00 25.21 C ATOM 273 O GLU A 19 -10.287 -10.695 4.880 1.00 25.20 O ATOM 274 CB GLU A 19 -10.063 -10.016 1.698 1.00 2.11 C ATOM 275 CG GLU A 19 -10.873 -8.869 1.088 1.00 42.41 C ATOM 276 CD GLU A 19 -11.982 -9.324 0.141 1.00 62.34 C ATOM 277 OE1 GLU A 19 -13.034 -9.781 0.639 1.00 33.42 O ATOM 278 OE2 GLU A 19 -11.875 -9.114 -1.092 1.00 33.21 O ATOM 0 H GLU A 19 -7.649 -9.440 1.748 1.00 13.22 H new ATOM 0 HA GLU A 19 -9.815 -8.678 3.378 1.00 12.43 H new ATOM 0 HB2 GLU A 19 -9.336 -10.376 0.970 1.00 2.11 H new ATOM 0 HB3 GLU A 19 -10.727 -10.850 1.925 1.00 2.11 H new ATOM 0 HG2 GLU A 19 -11.315 -8.282 1.893 1.00 42.41 H new ATOM 0 HG3 GLU A 19 -10.196 -8.208 0.547 1.00 42.41 H new ATOM 285 N GLU A 20 -8.492 -11.674 3.908 1.00 33.30 N ATOM 286 CA GLU A 20 -8.414 -12.821 4.798 1.00 11.13 C ATOM 287 C GLU A 20 -7.899 -12.387 6.168 1.00 32.54 C ATOM 288 O GLU A 20 -8.477 -12.727 7.203 1.00 30.41 O ATOM 289 CB GLU A 20 -7.491 -13.884 4.177 1.00 23.02 C ATOM 290 CG GLU A 20 -7.612 -15.245 4.871 1.00 64.31 C ATOM 291 CD GLU A 20 -8.972 -15.901 4.608 1.00 12.34 C ATOM 292 OE1 GLU A 20 -9.391 -16.005 3.431 1.00 72.23 O ATOM 293 OE2 GLU A 20 -9.676 -16.228 5.595 1.00 51.21 O ATOM 0 H GLU A 20 -7.778 -11.681 3.180 1.00 33.30 H new ATOM 0 HA GLU A 20 -9.407 -13.251 4.931 1.00 11.13 H new ATOM 0 HB2 GLU A 20 -7.732 -13.996 3.120 1.00 23.02 H new ATOM 0 HB3 GLU A 20 -6.458 -13.541 4.234 1.00 23.02 H new ATOM 0 HG2 GLU A 20 -6.817 -15.903 4.520 1.00 64.31 H new ATOM 0 HG3 GLU A 20 -7.471 -15.119 5.944 1.00 64.31 H new ATOM 300 N THR A 21 -6.795 -11.652 6.180 1.00 24.12 N ATOM 301 CA THR A 21 -6.118 -11.161 7.364 1.00 44.05 C ATOM 302 C THR A 21 -6.755 -9.847 7.821 1.00 43.14 C ATOM 303 O THR A 21 -7.899 -9.541 7.488 1.00 43.32 O ATOM 304 CB THR A 21 -4.602 -11.114 7.108 1.00 53.00 C ATOM 305 OG1 THR A 21 -4.270 -10.213 6.083 1.00 51.11 O ATOM 306 CG2 THR A 21 -4.054 -12.500 6.765 1.00 70.45 C ATOM 0 H THR A 21 -6.327 -11.370 5.319 1.00 24.12 H new ATOM 0 HA THR A 21 -6.244 -11.840 8.208 1.00 44.05 H new ATOM 0 HB THR A 21 -4.143 -10.767 8.034 1.00 53.00 H new ATOM 0 HG1 THR A 21 -4.290 -10.677 5.220 1.00 51.11 H new ATOM 0 HG21 THR A 21 -2.980 -12.434 6.590 1.00 70.45 H new ATOM 0 HG22 THR A 21 -4.245 -13.182 7.594 1.00 70.45 H new ATOM 0 HG23 THR A 21 -4.546 -12.874 5.867 1.00 70.45 H new ATOM 314 N ARG A 22 -6.069 -9.103 8.688 1.00 53.53 N ATOM 315 CA ARG A 22 -6.521 -7.817 9.203 1.00 25.14 C ATOM 316 C ARG A 22 -5.350 -6.845 9.074 1.00 35.44 C ATOM 317 O ARG A 22 -4.720 -6.477 10.074 1.00 30.40 O ATOM 318 CB ARG A 22 -7.072 -7.952 10.641 1.00 72.53 C ATOM 319 CG ARG A 22 -8.059 -9.107 10.893 1.00 34.34 C ATOM 320 CD ARG A 22 -9.345 -9.091 10.047 1.00 54.42 C ATOM 321 NE ARG A 22 -10.579 -8.882 10.833 1.00 30.34 N ATOM 322 CZ ARG A 22 -11.827 -8.840 10.336 1.00 41.12 C ATOM 323 NH1 ARG A 22 -12.062 -9.129 9.059 1.00 64.00 N ATOM 324 NH2 ARG A 22 -12.847 -8.511 11.123 1.00 11.20 N ATOM 0 H ARG A 22 -5.162 -9.387 9.059 1.00 53.53 H new ATOM 0 HA ARG A 22 -7.362 -7.428 8.629 1.00 25.14 H new ATOM 0 HB2 ARG A 22 -6.228 -8.070 11.320 1.00 72.53 H new ATOM 0 HB3 ARG A 22 -7.566 -7.017 10.906 1.00 72.53 H new ATOM 0 HG2 ARG A 22 -7.540 -10.048 10.712 1.00 34.34 H new ATOM 0 HG3 ARG A 22 -8.340 -9.095 11.946 1.00 34.34 H new ATOM 0 HD2 ARG A 22 -9.265 -8.303 9.298 1.00 54.42 H new ATOM 0 HD3 ARG A 22 -9.425 -10.035 9.508 1.00 54.42 H new ATOM 0 HE ARG A 22 -10.474 -8.759 11.840 1.00 30.34 H new ATOM 0 HH11 ARG A 22 -11.290 -9.386 8.444 1.00 64.00 H new ATOM 0 HH12 ARG A 22 -13.014 -9.093 8.695 1.00 64.00 H new ATOM 0 HH21 ARG A 22 -12.683 -8.290 12.105 1.00 11.20 H new ATOM 0 HH22 ARG A 22 -13.794 -8.479 10.745 1.00 11.20 H new ATOM 338 N LYS A 23 -5.023 -6.477 7.835 1.00 33.15 N ATOM 339 CA LYS A 23 -3.946 -5.545 7.500 1.00 63.45 C ATOM 340 C LYS A 23 -4.539 -4.413 6.665 1.00 4.24 C ATOM 341 O LYS A 23 -5.024 -4.681 5.570 1.00 52.41 O ATOM 342 CB LYS A 23 -2.850 -6.270 6.704 1.00 44.12 C ATOM 343 CG LYS A 23 -2.063 -7.288 7.548 1.00 71.11 C ATOM 344 CD LYS A 23 -1.363 -8.276 6.608 1.00 10.43 C ATOM 345 CE LYS A 23 -0.575 -9.310 7.412 1.00 65.12 C ATOM 346 NZ LYS A 23 0.885 -9.113 7.313 1.00 11.12 N ATOM 0 H LYS A 23 -5.514 -6.829 7.013 1.00 33.15 H new ATOM 0 HA LYS A 23 -3.499 -5.145 8.410 1.00 63.45 H new ATOM 0 HB2 LYS A 23 -3.304 -6.784 5.857 1.00 44.12 H new ATOM 0 HB3 LYS A 23 -2.158 -5.533 6.296 1.00 44.12 H new ATOM 0 HG2 LYS A 23 -1.329 -6.775 8.170 1.00 71.11 H new ATOM 0 HG3 LYS A 23 -2.735 -7.820 8.221 1.00 71.11 H new ATOM 0 HD2 LYS A 23 -2.101 -8.778 5.983 1.00 10.43 H new ATOM 0 HD3 LYS A 23 -0.692 -7.738 5.939 1.00 10.43 H new ATOM 0 HE2 LYS A 23 -0.875 -9.257 8.459 1.00 65.12 H new ATOM 0 HE3 LYS A 23 -0.828 -10.310 7.058 1.00 65.12 H new ATOM 0 HZ1 LYS A 23 1.372 -9.839 7.876 1.00 11.12 H new ATOM 0 HZ2 LYS A 23 1.179 -9.190 6.318 1.00 11.12 H new ATOM 0 HZ3 LYS A 23 1.133 -8.170 7.675 1.00 11.12 H new ATOM 360 N LEU A 24 -4.533 -3.175 7.166 1.00 61.21 N ATOM 361 CA LEU A 24 -4.942 -1.989 6.410 1.00 75.10 C ATOM 362 C LEU A 24 -4.171 -1.937 5.090 1.00 13.42 C ATOM 363 O LEU A 24 -2.937 -1.958 5.062 1.00 13.23 O ATOM 364 CB LEU A 24 -4.789 -0.711 7.271 1.00 14.34 C ATOM 365 CG LEU A 24 -4.232 0.564 6.612 1.00 41.24 C ATOM 366 CD1 LEU A 24 -5.141 1.160 5.555 1.00 64.24 C ATOM 367 CD2 LEU A 24 -3.982 1.683 7.632 1.00 53.30 C ATOM 0 H LEU A 24 -4.240 -2.966 8.120 1.00 61.21 H new ATOM 0 HA LEU A 24 -6.001 -2.049 6.159 1.00 75.10 H new ATOM 0 HB2 LEU A 24 -5.770 -0.469 7.681 1.00 14.34 H new ATOM 0 HB3 LEU A 24 -4.143 -0.956 8.114 1.00 14.34 H new ATOM 0 HG LEU A 24 -3.305 0.222 6.153 1.00 41.24 H new ATOM 0 HD11 LEU A 24 -4.678 2.055 5.139 1.00 64.24 H new ATOM 0 HD12 LEU A 24 -5.301 0.431 4.760 1.00 64.24 H new ATOM 0 HD13 LEU A 24 -6.098 1.423 6.005 1.00 64.24 H new ATOM 0 HD21 LEU A 24 -3.590 2.561 7.120 1.00 53.30 H new ATOM 0 HD22 LEU A 24 -4.918 1.940 8.127 1.00 53.30 H new ATOM 0 HD23 LEU A 24 -3.260 1.344 8.375 1.00 53.30 H new ATOM 379 N MET A 25 -4.918 -1.813 3.999 1.00 51.24 N ATOM 380 CA MET A 25 -4.427 -1.729 2.640 1.00 35.23 C ATOM 381 C MET A 25 -4.546 -0.288 2.110 1.00 53.12 C ATOM 382 O MET A 25 -5.595 0.055 1.568 1.00 62.41 O ATOM 383 CB MET A 25 -5.151 -2.804 1.817 1.00 13.35 C ATOM 384 CG MET A 25 -4.634 -2.919 0.386 1.00 24.10 C ATOM 385 SD MET A 25 -5.233 -4.395 -0.474 1.00 43.12 S ATOM 386 CE MET A 25 -4.753 -3.991 -2.167 1.00 41.43 C ATOM 0 H MET A 25 -5.936 -1.766 4.048 1.00 51.24 H new ATOM 0 HA MET A 25 -3.360 -1.942 2.569 1.00 35.23 H new ATOM 0 HB2 MET A 25 -5.041 -3.768 2.314 1.00 13.35 H new ATOM 0 HB3 MET A 25 -6.217 -2.577 1.794 1.00 13.35 H new ATOM 0 HG2 MET A 25 -4.934 -2.033 -0.174 1.00 24.10 H new ATOM 0 HG3 MET A 25 -3.544 -2.932 0.401 1.00 24.10 H new ATOM 0 HE1 MET A 25 -5.050 -4.801 -2.833 1.00 41.43 H new ATOM 0 HE2 MET A 25 -5.246 -3.069 -2.475 1.00 41.43 H new ATOM 0 HE3 MET A 25 -3.672 -3.858 -2.217 1.00 41.43 H new ATOM 396 N PRO A 26 -3.571 0.620 2.325 1.00 44.41 N ATOM 397 CA PRO A 26 -3.592 1.947 1.685 1.00 44.21 C ATOM 398 C PRO A 26 -3.460 1.828 0.140 1.00 32.04 C ATOM 399 O PRO A 26 -2.790 0.895 -0.327 1.00 34.22 O ATOM 400 CB PRO A 26 -2.423 2.712 2.322 1.00 1.52 C ATOM 401 CG PRO A 26 -1.469 1.635 2.813 1.00 14.42 C ATOM 402 CD PRO A 26 -2.361 0.442 3.124 1.00 42.32 C ATOM 0 HA PRO A 26 -4.534 2.471 1.843 1.00 44.21 H new ATOM 0 HB2 PRO A 26 -1.939 3.368 1.598 1.00 1.52 H new ATOM 0 HB3 PRO A 26 -2.764 3.341 3.144 1.00 1.52 H new ATOM 0 HG2 PRO A 26 -0.727 1.387 2.054 1.00 14.42 H new ATOM 0 HG3 PRO A 26 -0.923 1.963 3.698 1.00 14.42 H new ATOM 0 HD2 PRO A 26 -1.862 -0.494 2.872 1.00 42.32 H new ATOM 0 HD3 PRO A 26 -2.599 0.400 4.187 1.00 42.32 H new ATOM 410 N ILE A 27 -4.051 2.751 -0.643 1.00 74.41 N ATOM 411 CA ILE A 27 -3.949 2.888 -2.114 1.00 70.42 C ATOM 412 C ILE A 27 -4.027 4.390 -2.451 1.00 4.30 C ATOM 413 O ILE A 27 -4.868 5.083 -1.881 1.00 73.01 O ATOM 414 CB ILE A 27 -5.121 2.165 -2.840 1.00 52.13 C ATOM 415 CG1 ILE A 27 -5.210 0.648 -2.562 1.00 54.43 C ATOM 416 CG2 ILE A 27 -5.064 2.344 -4.371 1.00 23.11 C ATOM 417 CD1 ILE A 27 -6.333 0.331 -1.582 1.00 42.23 C ATOM 0 H ILE A 27 -4.653 3.470 -0.241 1.00 74.41 H new ATOM 0 HA ILE A 27 -3.012 2.440 -2.445 1.00 70.42 H new ATOM 0 HB ILE A 27 -6.004 2.649 -2.423 1.00 52.13 H new ATOM 0 HG12 ILE A 27 -5.379 0.114 -3.497 1.00 54.43 H new ATOM 0 HG13 ILE A 27 -4.261 0.293 -2.159 1.00 54.43 H new ATOM 0 HG21 ILE A 27 -5.903 1.821 -4.830 1.00 23.11 H new ATOM 0 HG22 ILE A 27 -5.120 3.405 -4.616 1.00 23.11 H new ATOM 0 HG23 ILE A 27 -4.129 1.933 -4.751 1.00 23.11 H new ATOM 0 HD11 ILE A 27 -6.370 -0.744 -1.407 1.00 42.23 H new ATOM 0 HD12 ILE A 27 -6.149 0.846 -0.639 1.00 42.23 H new ATOM 0 HD13 ILE A 27 -7.284 0.664 -1.998 1.00 42.23 H new ATOM 429 N CYS A 28 -3.242 4.896 -3.411 1.00 45.12 N ATOM 430 CA CYS A 28 -3.331 6.296 -3.828 1.00 34.32 C ATOM 431 C CYS A 28 -4.533 6.491 -4.756 1.00 23.14 C ATOM 432 O CYS A 28 -4.767 5.676 -5.652 1.00 11.51 O ATOM 433 CB CYS A 28 -2.038 6.711 -4.544 1.00 5.21 C ATOM 434 SG CYS A 28 -2.088 8.490 -4.918 1.00 24.31 S ATOM 0 H CYS A 28 -2.538 4.354 -3.912 1.00 45.12 H new ATOM 0 HA CYS A 28 -3.463 6.922 -2.946 1.00 34.32 H new ATOM 0 HB2 CYS A 28 -1.175 6.486 -3.917 1.00 5.21 H new ATOM 0 HB3 CYS A 28 -1.921 6.139 -5.465 1.00 5.21 H new ATOM 0 HG CYS A 28 -1.879 9.168 -3.829 1.00 24.31 H new ATOM 440 N MET A 29 -5.227 7.624 -4.620 1.00 50.41 N ATOM 441 CA MET A 29 -6.388 7.982 -5.427 1.00 1.32 C ATOM 442 C MET A 29 -6.085 8.074 -6.932 1.00 1.45 C ATOM 443 O MET A 29 -7.017 7.999 -7.737 1.00 32.34 O ATOM 444 CB MET A 29 -6.954 9.316 -4.904 1.00 64.22 C ATOM 445 CG MET A 29 -8.376 9.566 -5.406 1.00 42.40 C ATOM 446 SD MET A 29 -9.212 10.969 -4.627 1.00 12.25 S ATOM 447 CE MET A 29 -9.340 10.369 -2.923 1.00 72.11 C ATOM 0 H MET A 29 -4.988 8.333 -3.927 1.00 50.41 H new ATOM 0 HA MET A 29 -7.123 7.183 -5.326 1.00 1.32 H new ATOM 0 HB2 MET A 29 -6.949 9.310 -3.814 1.00 64.22 H new ATOM 0 HB3 MET A 29 -6.308 10.134 -5.221 1.00 64.22 H new ATOM 0 HG2 MET A 29 -8.344 9.731 -6.483 1.00 42.40 H new ATOM 0 HG3 MET A 29 -8.970 8.667 -5.239 1.00 42.40 H new ATOM 0 HE1 MET A 29 -10.081 10.959 -2.384 1.00 72.11 H new ATOM 0 HE2 MET A 29 -9.644 9.322 -2.928 1.00 72.11 H new ATOM 0 HE3 MET A 29 -8.372 10.464 -2.430 1.00 72.11 H new ATOM 457 N ASP A 30 -4.820 8.255 -7.333 1.00 52.32 N ATOM 458 CA ASP A 30 -4.476 8.399 -8.755 1.00 72.05 C ATOM 459 C ASP A 30 -4.261 7.051 -9.434 1.00 23.00 C ATOM 460 O ASP A 30 -4.334 6.952 -10.659 1.00 34.34 O ATOM 461 CB ASP A 30 -3.269 9.331 -8.958 1.00 64.43 C ATOM 462 CG ASP A 30 -3.109 9.745 -10.431 1.00 0.34 C ATOM 463 OD1 ASP A 30 -4.095 10.270 -11.002 1.00 31.33 O ATOM 464 OD2 ASP A 30 -2.005 9.622 -11.014 1.00 3.22 O ATOM 0 H ASP A 30 -4.023 8.305 -6.699 1.00 52.32 H new ATOM 0 HA ASP A 30 -5.334 8.866 -9.239 1.00 72.05 H new ATOM 0 HB2 ASP A 30 -3.389 10.222 -8.341 1.00 64.43 H new ATOM 0 HB3 ASP A 30 -2.362 8.830 -8.621 1.00 64.43 H new ATOM 469 N VAL A 31 -4.052 5.977 -8.675 1.00 3.44 N ATOM 470 CA VAL A 31 -3.625 4.722 -9.266 1.00 31.25 C ATOM 471 C VAL A 31 -4.861 3.925 -9.689 1.00 64.44 C ATOM 472 O VAL A 31 -5.329 3.031 -8.978 1.00 34.30 O ATOM 473 CB VAL A 31 -2.647 4.001 -8.315 1.00 21.14 C ATOM 474 CG1 VAL A 31 -2.154 2.676 -8.900 1.00 64.42 C ATOM 475 CG2 VAL A 31 -1.406 4.872 -8.055 1.00 10.04 C ATOM 0 H VAL A 31 -4.171 5.955 -7.662 1.00 3.44 H new ATOM 0 HA VAL A 31 -3.052 4.873 -10.181 1.00 31.25 H new ATOM 0 HB VAL A 31 -3.197 3.815 -7.393 1.00 21.14 H new ATOM 0 HG11 VAL A 31 -1.468 2.201 -8.198 1.00 64.42 H new ATOM 0 HG12 VAL A 31 -3.004 2.018 -9.077 1.00 64.42 H new ATOM 0 HG13 VAL A 31 -1.638 2.864 -9.842 1.00 64.42 H new ATOM 0 HG21 VAL A 31 -0.728 4.347 -7.382 1.00 10.04 H new ATOM 0 HG22 VAL A 31 -0.898 5.073 -8.998 1.00 10.04 H new ATOM 0 HG23 VAL A 31 -1.712 5.814 -7.600 1.00 10.04 H new ATOM 485 N ARG A 32 -5.400 4.242 -10.874 1.00 32.12 N ATOM 486 CA ARG A 32 -6.556 3.540 -11.430 1.00 74.43 C ATOM 487 C ARG A 32 -6.292 2.047 -11.572 1.00 52.23 C ATOM 488 O ARG A 32 -7.217 1.273 -11.350 1.00 5.20 O ATOM 489 CB ARG A 32 -6.997 4.090 -12.794 1.00 75.01 C ATOM 490 CG ARG A 32 -7.205 5.603 -12.910 1.00 24.13 C ATOM 491 CD ARG A 32 -8.065 6.247 -11.811 1.00 44.03 C ATOM 492 NE ARG A 32 -8.373 7.655 -12.127 1.00 63.40 N ATOM 493 CZ ARG A 32 -7.486 8.658 -12.230 1.00 35.11 C ATOM 494 NH1 ARG A 32 -6.219 8.513 -11.869 1.00 41.34 N ATOM 495 NH2 ARG A 32 -7.864 9.843 -12.673 1.00 65.13 N ATOM 0 H ARG A 32 -5.046 4.990 -11.470 1.00 32.12 H new ATOM 0 HA ARG A 32 -7.361 3.709 -10.715 1.00 74.43 H new ATOM 0 HB2 ARG A 32 -6.252 3.795 -13.533 1.00 75.01 H new ATOM 0 HB3 ARG A 32 -7.931 3.600 -13.069 1.00 75.01 H new ATOM 0 HG2 ARG A 32 -6.228 6.086 -12.910 1.00 24.13 H new ATOM 0 HG3 ARG A 32 -7.665 5.814 -13.875 1.00 24.13 H new ATOM 0 HD2 ARG A 32 -8.993 5.686 -11.697 1.00 44.03 H new ATOM 0 HD3 ARG A 32 -7.540 6.193 -10.857 1.00 44.03 H new ATOM 0 HE ARG A 32 -9.354 7.889 -12.282 1.00 63.40 H new ATOM 0 HH11 ARG A 32 -5.893 7.620 -11.500 1.00 41.34 H new ATOM 0 HH12 ARG A 32 -5.570 9.295 -11.960 1.00 41.34 H new ATOM 0 HH21 ARG A 32 -8.836 10.002 -12.940 1.00 65.13 H new ATOM 0 HH22 ARG A 32 -7.184 10.600 -12.748 1.00 65.13 H new ATOM 509 N ALA A 33 -5.057 1.630 -11.863 1.00 24.54 N ATOM 510 CA ALA A 33 -4.709 0.223 -12.042 1.00 44.13 C ATOM 511 C ALA A 33 -5.079 -0.647 -10.840 1.00 63.41 C ATOM 512 O ALA A 33 -5.302 -1.853 -10.985 1.00 43.33 O ATOM 513 CB ALA A 33 -3.206 0.108 -12.302 1.00 5.22 C ATOM 0 H ALA A 33 -4.268 2.265 -11.981 1.00 24.54 H new ATOM 0 HA ALA A 33 -5.286 -0.144 -12.891 1.00 44.13 H new ATOM 0 HB1 ALA A 33 -2.939 -0.940 -12.437 1.00 5.22 H new ATOM 0 HB2 ALA A 33 -2.949 0.666 -13.202 1.00 5.22 H new ATOM 0 HB3 ALA A 33 -2.658 0.516 -11.453 1.00 5.22 H new ATOM 519 N ILE A 34 -5.150 -0.035 -9.661 1.00 33.05 N ATOM 520 CA ILE A 34 -5.425 -0.671 -8.388 1.00 15.12 C ATOM 521 C ILE A 34 -6.837 -0.250 -7.979 1.00 73.21 C ATOM 522 O ILE A 34 -7.697 -1.107 -7.780 1.00 43.32 O ATOM 523 CB ILE A 34 -4.310 -0.260 -7.399 1.00 44.44 C ATOM 524 CG1 ILE A 34 -2.891 -0.602 -7.923 1.00 51.44 C ATOM 525 CG2 ILE A 34 -4.521 -0.844 -5.999 1.00 1.50 C ATOM 526 CD1 ILE A 34 -2.606 -2.066 -8.269 1.00 14.43 C ATOM 0 H ILE A 34 -5.009 0.971 -9.570 1.00 33.05 H new ATOM 0 HA ILE A 34 -5.411 -1.760 -8.420 1.00 15.12 H new ATOM 0 HB ILE A 34 -4.380 0.825 -7.320 1.00 44.44 H new ATOM 0 HG12 ILE A 34 -2.707 -0.002 -8.814 1.00 51.44 H new ATOM 0 HG13 ILE A 34 -2.168 -0.286 -7.171 1.00 51.44 H new ATOM 0 HG21 ILE A 34 -3.710 -0.524 -5.345 1.00 1.50 H new ATOM 0 HG22 ILE A 34 -5.471 -0.492 -5.597 1.00 1.50 H new ATOM 0 HG23 ILE A 34 -4.533 -1.932 -6.057 1.00 1.50 H new ATOM 0 HD11 ILE A 34 -1.579 -2.163 -8.622 1.00 14.43 H new ATOM 0 HD12 ILE A 34 -2.744 -2.683 -7.381 1.00 14.43 H new ATOM 0 HD13 ILE A 34 -3.291 -2.395 -9.050 1.00 14.43 H new ATOM 538 N MET A 35 -7.111 1.059 -7.936 1.00 74.41 N ATOM 539 CA MET A 35 -8.397 1.636 -7.559 1.00 43.22 C ATOM 540 C MET A 35 -9.572 1.044 -8.349 1.00 71.10 C ATOM 541 O MET A 35 -10.646 0.841 -7.773 1.00 55.33 O ATOM 542 CB MET A 35 -8.306 3.163 -7.702 1.00 12.34 C ATOM 543 CG MET A 35 -9.654 3.848 -7.467 1.00 32.54 C ATOM 544 SD MET A 35 -9.594 5.500 -6.735 1.00 54.14 S ATOM 545 CE MET A 35 -9.022 5.052 -5.074 1.00 23.12 C ATOM 0 H MET A 35 -6.415 1.767 -8.172 1.00 74.41 H new ATOM 0 HA MET A 35 -8.607 1.381 -6.520 1.00 43.22 H new ATOM 0 HB2 MET A 35 -7.575 3.550 -6.991 1.00 12.34 H new ATOM 0 HB3 MET A 35 -7.943 3.412 -8.699 1.00 12.34 H new ATOM 0 HG2 MET A 35 -10.175 3.915 -8.422 1.00 32.54 H new ATOM 0 HG3 MET A 35 -10.255 3.209 -6.820 1.00 32.54 H new ATOM 0 HE1 MET A 35 -9.288 5.842 -4.372 1.00 23.12 H new ATOM 0 HE2 MET A 35 -9.494 4.119 -4.766 1.00 23.12 H new ATOM 0 HE3 MET A 35 -7.940 4.925 -5.084 1.00 23.12 H new ATOM 555 N ALA A 36 -9.385 0.721 -9.632 1.00 31.41 N ATOM 556 CA ALA A 36 -10.408 0.068 -10.431 1.00 64.44 C ATOM 557 C ALA A 36 -10.825 -1.249 -9.784 1.00 21.41 C ATOM 558 O ALA A 36 -12.016 -1.502 -9.659 1.00 55.44 O ATOM 559 CB ALA A 36 -9.920 -0.167 -11.864 1.00 64.41 C ATOM 0 H ALA A 36 -8.520 0.907 -10.139 1.00 31.41 H new ATOM 0 HA ALA A 36 -11.276 0.725 -10.476 1.00 64.44 H new ATOM 0 HB1 ALA A 36 -10.705 -0.657 -12.440 1.00 64.41 H new ATOM 0 HB2 ALA A 36 -9.674 0.789 -12.326 1.00 64.41 H new ATOM 0 HB3 ALA A 36 -9.033 -0.801 -11.847 1.00 64.41 H new ATOM 565 N THR A 37 -9.884 -2.083 -9.333 1.00 52.21 N ATOM 566 CA THR A 37 -10.206 -3.377 -8.742 1.00 73.02 C ATOM 567 C THR A 37 -11.074 -3.198 -7.506 1.00 12.23 C ATOM 568 O THR A 37 -11.994 -4.003 -7.316 1.00 64.32 O ATOM 569 CB THR A 37 -8.923 -4.183 -8.478 1.00 24.02 C ATOM 570 OG1 THR A 37 -8.472 -4.605 -9.751 1.00 62.42 O ATOM 571 CG2 THR A 37 -9.123 -5.414 -7.578 1.00 33.34 C ATOM 0 H THR A 37 -8.885 -1.879 -9.368 1.00 52.21 H new ATOM 0 HA THR A 37 -10.796 -3.963 -9.447 1.00 73.02 H new ATOM 0 HB THR A 37 -8.213 -3.551 -7.944 1.00 24.02 H new ATOM 0 HG1 THR A 37 -7.995 -5.457 -9.663 1.00 62.42 H new ATOM 0 HG21 THR A 37 -8.170 -5.925 -7.443 1.00 33.34 H new ATOM 0 HG22 THR A 37 -9.505 -5.097 -6.608 1.00 33.34 H new ATOM 0 HG23 THR A 37 -9.836 -6.094 -8.045 1.00 33.34 H new ATOM 579 N ILE A 38 -10.852 -2.135 -6.719 1.00 51.55 N ATOM 580 CA ILE A 38 -11.767 -1.813 -5.645 1.00 25.13 C ATOM 581 C ILE A 38 -13.149 -1.540 -6.245 1.00 4.54 C ATOM 582 O ILE A 38 -14.076 -2.274 -5.940 1.00 34.41 O ATOM 583 CB ILE A 38 -11.219 -0.688 -4.740 1.00 74.25 C ATOM 584 CG1 ILE A 38 -9.994 -1.176 -3.932 1.00 71.41 C ATOM 585 CG2 ILE A 38 -12.289 -0.176 -3.761 1.00 51.03 C ATOM 586 CD1 ILE A 38 -8.691 -0.523 -4.382 1.00 3.31 C ATOM 0 H ILE A 38 -10.058 -1.501 -6.813 1.00 51.55 H new ATOM 0 HA ILE A 38 -11.872 -2.660 -4.967 1.00 25.13 H new ATOM 0 HB ILE A 38 -10.922 0.129 -5.398 1.00 74.25 H new ATOM 0 HG12 ILE A 38 -10.154 -0.965 -2.875 1.00 71.41 H new ATOM 0 HG13 ILE A 38 -9.906 -2.258 -4.032 1.00 71.41 H new ATOM 0 HG21 ILE A 38 -11.866 0.615 -3.141 1.00 51.03 H new ATOM 0 HG22 ILE A 38 -13.137 0.217 -4.322 1.00 51.03 H new ATOM 0 HG23 ILE A 38 -12.623 -0.996 -3.125 1.00 51.03 H new ATOM 0 HD11 ILE A 38 -7.866 -0.904 -3.780 1.00 3.31 H new ATOM 0 HD12 ILE A 38 -8.511 -0.755 -5.432 1.00 3.31 H new ATOM 0 HD13 ILE A 38 -8.763 0.557 -4.257 1.00 3.31 H new ATOM 598 N GLN A 39 -13.297 -0.544 -7.118 1.00 51.12 N ATOM 599 CA GLN A 39 -14.602 -0.102 -7.625 1.00 74.14 C ATOM 600 C GLN A 39 -15.332 -1.146 -8.490 1.00 20.51 C ATOM 601 O GLN A 39 -16.542 -1.043 -8.730 1.00 51.54 O ATOM 602 CB GLN A 39 -14.406 1.195 -8.415 1.00 11.43 C ATOM 603 CG GLN A 39 -13.949 2.351 -7.517 1.00 40.44 C ATOM 604 CD GLN A 39 -13.726 3.636 -8.307 1.00 5.52 C ATOM 605 OE1 GLN A 39 -14.388 3.915 -9.305 1.00 64.43 O ATOM 606 NE2 GLN A 39 -12.810 4.476 -7.859 1.00 12.20 N ATOM 0 H GLN A 39 -12.511 -0.016 -7.498 1.00 51.12 H new ATOM 0 HA GLN A 39 -15.244 0.054 -6.758 1.00 74.14 H new ATOM 0 HB2 GLN A 39 -13.668 1.033 -9.201 1.00 11.43 H new ATOM 0 HB3 GLN A 39 -15.341 1.465 -8.906 1.00 11.43 H new ATOM 0 HG2 GLN A 39 -14.697 2.526 -6.744 1.00 40.44 H new ATOM 0 HG3 GLN A 39 -13.025 2.073 -7.010 1.00 40.44 H new ATOM 0 HE21 GLN A 39 -12.263 4.240 -7.031 1.00 12.20 H new ATOM 0 HE22 GLN A 39 -12.649 5.360 -8.341 1.00 12.20 H new ATOM 615 N ARG A 40 -14.616 -2.146 -9.001 1.00 44.25 N ATOM 616 CA ARG A 40 -15.196 -3.320 -9.629 1.00 44.11 C ATOM 617 C ARG A 40 -15.794 -4.215 -8.547 1.00 4.51 C ATOM 618 O ARG A 40 -16.999 -4.448 -8.563 1.00 54.24 O ATOM 619 CB ARG A 40 -14.149 -4.066 -10.475 1.00 54.00 C ATOM 620 CG ARG A 40 -13.713 -3.314 -11.748 1.00 50.00 C ATOM 621 CD ARG A 40 -13.353 -4.261 -12.899 1.00 33.12 C ATOM 622 NE ARG A 40 -14.552 -4.670 -13.643 1.00 31.24 N ATOM 623 CZ ARG A 40 -14.566 -5.312 -14.814 1.00 53.24 C ATOM 624 NH1 ARG A 40 -13.447 -5.740 -15.389 1.00 52.14 N ATOM 625 NH2 ARG A 40 -15.714 -5.508 -15.450 1.00 42.40 N ATOM 0 H ARG A 40 -13.596 -2.158 -8.987 1.00 44.25 H new ATOM 0 HA ARG A 40 -15.990 -3.017 -10.312 1.00 44.11 H new ATOM 0 HB2 ARG A 40 -13.270 -4.256 -9.860 1.00 54.00 H new ATOM 0 HB3 ARG A 40 -14.554 -5.037 -10.761 1.00 54.00 H new ATOM 0 HG2 ARG A 40 -14.517 -2.650 -12.067 1.00 50.00 H new ATOM 0 HG3 ARG A 40 -12.853 -2.685 -11.517 1.00 50.00 H new ATOM 0 HD2 ARG A 40 -12.653 -3.768 -13.574 1.00 33.12 H new ATOM 0 HD3 ARG A 40 -12.848 -5.143 -12.504 1.00 33.12 H new ATOM 0 HE ARG A 40 -15.456 -4.443 -13.228 1.00 31.24 H new ATOM 0 HH11 ARG A 40 -12.547 -5.581 -14.935 1.00 52.14 H new ATOM 0 HH12 ARG A 40 -13.488 -6.228 -16.284 1.00 52.14 H new ATOM 0 HH21 ARG A 40 -16.586 -5.168 -15.045 1.00 42.40 H new ATOM 0 HH22 ARG A 40 -15.724 -5.998 -16.344 1.00 42.40 H new ATOM 639 N LYS A 41 -14.966 -4.725 -7.633 1.00 25.24 N ATOM 640 CA LYS A 41 -15.349 -5.758 -6.670 1.00 74.23 C ATOM 641 C LYS A 41 -16.304 -5.201 -5.611 1.00 11.01 C ATOM 642 O LYS A 41 -17.290 -5.849 -5.270 1.00 24.31 O ATOM 643 CB LYS A 41 -14.050 -6.332 -6.072 1.00 21.13 C ATOM 644 CG LYS A 41 -14.176 -7.609 -5.223 1.00 25.02 C ATOM 645 CD LYS A 41 -14.814 -7.391 -3.843 1.00 43.43 C ATOM 646 CE LYS A 41 -14.225 -8.307 -2.762 1.00 71.23 C ATOM 647 NZ LYS A 41 -14.656 -9.714 -2.856 1.00 73.11 N ATOM 0 H LYS A 41 -13.995 -4.427 -7.540 1.00 25.24 H new ATOM 0 HA LYS A 41 -15.903 -6.561 -7.156 1.00 74.23 H new ATOM 0 HB2 LYS A 41 -13.361 -6.537 -6.892 1.00 21.13 H new ATOM 0 HB3 LYS A 41 -13.591 -5.559 -5.455 1.00 21.13 H new ATOM 0 HG2 LYS A 41 -14.769 -8.340 -5.773 1.00 25.02 H new ATOM 0 HG3 LYS A 41 -13.184 -8.040 -5.088 1.00 25.02 H new ATOM 0 HD2 LYS A 41 -14.677 -6.351 -3.545 1.00 43.43 H new ATOM 0 HD3 LYS A 41 -15.888 -7.564 -3.913 1.00 43.43 H new ATOM 0 HE2 LYS A 41 -13.137 -8.268 -2.823 1.00 71.23 H new ATOM 0 HE3 LYS A 41 -14.504 -7.919 -1.782 1.00 71.23 H new ATOM 0 HZ1 LYS A 41 -14.215 -10.264 -2.092 1.00 73.11 H new ATOM 0 HZ2 LYS A 41 -15.691 -9.767 -2.767 1.00 73.11 H new ATOM 0 HZ3 LYS A 41 -14.367 -10.105 -3.775 1.00 73.11 H new ATOM 661 N TYR A 42 -16.012 -4.027 -5.061 1.00 54.22 N ATOM 662 CA TYR A 42 -16.721 -3.376 -3.966 1.00 42.22 C ATOM 663 C TYR A 42 -17.525 -2.202 -4.537 1.00 2.40 C ATOM 664 O TYR A 42 -16.928 -1.271 -5.082 1.00 73.34 O ATOM 665 CB TYR A 42 -15.689 -2.846 -2.956 1.00 34.11 C ATOM 666 CG TYR A 42 -14.728 -3.867 -2.371 1.00 33.50 C ATOM 667 CD1 TYR A 42 -15.073 -4.733 -1.313 1.00 31.02 C ATOM 668 CD2 TYR A 42 -13.431 -3.910 -2.897 1.00 62.53 C ATOM 669 CE1 TYR A 42 -14.115 -5.625 -0.789 1.00 44.00 C ATOM 670 CE2 TYR A 42 -12.468 -4.789 -2.388 1.00 71.00 C ATOM 671 CZ TYR A 42 -12.805 -5.651 -1.327 1.00 31.15 C ATOM 672 OH TYR A 42 -11.842 -6.451 -0.806 1.00 63.14 O ATOM 0 H TYR A 42 -15.223 -3.470 -5.389 1.00 54.22 H new ATOM 0 HA TYR A 42 -17.391 -4.079 -3.471 1.00 42.22 H new ATOM 0 HB2 TYR A 42 -15.104 -2.066 -3.443 1.00 34.11 H new ATOM 0 HB3 TYR A 42 -16.227 -2.374 -2.134 1.00 34.11 H new ATOM 0 HD1 TYR A 42 -16.072 -4.713 -0.904 1.00 31.02 H new ATOM 0 HD2 TYR A 42 -13.168 -3.252 -3.712 1.00 62.53 H new ATOM 0 HE1 TYR A 42 -14.380 -6.288 0.022 1.00 44.00 H new ATOM 0 HE2 TYR A 42 -11.473 -4.806 -2.807 1.00 71.00 H new ATOM 0 HH TYR A 42 -11.827 -7.303 -1.290 1.00 63.14 H new ATOM 682 N LYS A 43 -18.862 -2.212 -4.437 1.00 73.35 N ATOM 683 CA LYS A 43 -19.666 -1.070 -4.904 1.00 25.23 C ATOM 684 C LYS A 43 -19.950 -0.069 -3.782 1.00 22.12 C ATOM 685 O LYS A 43 -19.850 1.134 -4.014 1.00 13.42 O ATOM 686 CB LYS A 43 -20.978 -1.517 -5.569 1.00 70.51 C ATOM 687 CG LYS A 43 -20.881 -2.717 -6.525 1.00 3.01 C ATOM 688 CD LYS A 43 -19.753 -2.711 -7.569 1.00 2.03 C ATOM 689 CE LYS A 43 -20.104 -1.710 -8.656 1.00 4.12 C ATOM 690 NZ LYS A 43 -19.158 -1.750 -9.786 1.00 74.43 N ATOM 0 H LYS A 43 -19.403 -2.982 -4.045 1.00 73.35 H new ATOM 0 HA LYS A 43 -19.063 -0.566 -5.659 1.00 25.23 H new ATOM 0 HB2 LYS A 43 -21.694 -1.761 -4.784 1.00 70.51 H new ATOM 0 HB3 LYS A 43 -21.387 -0.671 -6.121 1.00 70.51 H new ATOM 0 HG2 LYS A 43 -20.774 -3.618 -5.922 1.00 3.01 H new ATOM 0 HG3 LYS A 43 -21.829 -2.800 -7.056 1.00 3.01 H new ATOM 0 HD2 LYS A 43 -18.806 -2.444 -7.101 1.00 2.03 H new ATOM 0 HD3 LYS A 43 -19.628 -3.706 -7.997 1.00 2.03 H new ATOM 0 HE2 LYS A 43 -21.111 -1.913 -9.021 1.00 4.12 H new ATOM 0 HE3 LYS A 43 -20.116 -0.706 -8.231 1.00 4.12 H new ATOM 0 HZ1 LYS A 43 -19.450 -1.061 -10.508 1.00 74.43 H new ATOM 0 HZ2 LYS A 43 -18.203 -1.513 -9.448 1.00 74.43 H new ATOM 0 HZ3 LYS A 43 -19.152 -2.704 -10.200 1.00 74.43 H new ATOM 704 N GLY A 44 -20.287 -0.549 -2.578 1.00 1.41 N ATOM 705 CA GLY A 44 -20.799 0.288 -1.490 1.00 12.15 C ATOM 706 C GLY A 44 -19.759 1.215 -0.856 1.00 22.13 C ATOM 707 O GLY A 44 -20.118 2.136 -0.124 1.00 72.53 O ATOM 0 H GLY A 44 -20.211 -1.536 -2.332 1.00 1.41 H new ATOM 0 HA2 GLY A 44 -21.622 0.893 -1.871 1.00 12.15 H new ATOM 0 HA3 GLY A 44 -21.211 -0.358 -0.715 1.00 12.15 H new ATOM 711 N ILE A 45 -18.476 1.034 -1.159 1.00 73.32 N ATOM 712 CA ILE A 45 -17.403 1.937 -0.760 1.00 34.21 C ATOM 713 C ILE A 45 -17.632 3.343 -1.342 1.00 64.31 C ATOM 714 O ILE A 45 -18.167 3.491 -2.445 1.00 21.24 O ATOM 715 CB ILE A 45 -16.057 1.285 -1.154 1.00 13.50 C ATOM 716 CG1 ILE A 45 -14.831 2.163 -0.824 1.00 33.41 C ATOM 717 CG2 ILE A 45 -16.027 0.740 -2.597 1.00 22.12 C ATOM 718 CD1 ILE A 45 -14.354 3.067 -1.963 1.00 33.22 C ATOM 0 H ILE A 45 -18.147 0.236 -1.702 1.00 73.32 H new ATOM 0 HA ILE A 45 -17.386 2.088 0.319 1.00 34.21 H new ATOM 0 HB ILE A 45 -15.979 0.408 -0.511 1.00 13.50 H new ATOM 0 HG12 ILE A 45 -15.071 2.786 0.037 1.00 33.41 H new ATOM 0 HG13 ILE A 45 -14.008 1.513 -0.528 1.00 33.41 H new ATOM 0 HG21 ILE A 45 -15.051 0.298 -2.799 1.00 22.12 H new ATOM 0 HG22 ILE A 45 -16.800 -0.019 -2.715 1.00 22.12 H new ATOM 0 HG23 ILE A 45 -16.208 1.555 -3.298 1.00 22.12 H new ATOM 0 HD11 ILE A 45 -13.489 3.643 -1.633 1.00 33.22 H new ATOM 0 HD12 ILE A 45 -14.076 2.455 -2.821 1.00 33.22 H new ATOM 0 HD13 ILE A 45 -15.156 3.748 -2.247 1.00 33.22 H new ATOM 730 N LYS A 46 -17.196 4.378 -0.620 1.00 64.12 N ATOM 731 CA LYS A 46 -17.193 5.773 -1.053 1.00 52.25 C ATOM 732 C LYS A 46 -15.737 6.195 -1.178 1.00 63.43 C ATOM 733 O LYS A 46 -14.977 5.995 -0.229 1.00 55.14 O ATOM 734 CB LYS A 46 -17.967 6.607 -0.016 1.00 0.23 C ATOM 735 CG LYS A 46 -17.991 8.120 -0.296 1.00 14.05 C ATOM 736 CD LYS A 46 -16.893 8.924 0.428 1.00 62.41 C ATOM 737 CE LYS A 46 -17.156 9.058 1.932 1.00 61.42 C ATOM 738 NZ LYS A 46 -17.619 10.398 2.345 1.00 32.14 N ATOM 0 H LYS A 46 -16.820 4.260 0.321 1.00 64.12 H new ATOM 0 HA LYS A 46 -17.683 5.920 -2.015 1.00 52.25 H new ATOM 0 HB2 LYS A 46 -18.994 6.243 0.029 1.00 0.23 H new ATOM 0 HB3 LYS A 46 -17.526 6.440 0.967 1.00 0.23 H new ATOM 0 HG2 LYS A 46 -17.891 8.279 -1.370 1.00 14.05 H new ATOM 0 HG3 LYS A 46 -18.964 8.515 -0.004 1.00 14.05 H new ATOM 0 HD2 LYS A 46 -15.930 8.438 0.273 1.00 62.41 H new ATOM 0 HD3 LYS A 46 -16.823 9.918 -0.015 1.00 62.41 H new ATOM 0 HE2 LYS A 46 -17.902 8.320 2.227 1.00 61.42 H new ATOM 0 HE3 LYS A 46 -16.240 8.819 2.473 1.00 61.42 H new ATOM 0 HZ1 LYS A 46 -17.775 10.410 3.373 1.00 32.14 H new ATOM 0 HZ2 LYS A 46 -16.899 11.106 2.096 1.00 32.14 H new ATOM 0 HZ3 LYS A 46 -18.510 10.623 1.857 1.00 32.14 H new ATOM 752 N ILE A 47 -15.348 6.759 -2.323 1.00 13.21 N ATOM 753 CA ILE A 47 -14.016 7.325 -2.500 1.00 1.10 C ATOM 754 C ILE A 47 -13.994 8.638 -1.718 1.00 3.20 C ATOM 755 O ILE A 47 -14.896 9.464 -1.881 1.00 60.01 O ATOM 756 CB ILE A 47 -13.673 7.529 -3.998 1.00 4.03 C ATOM 757 CG1 ILE A 47 -13.907 6.274 -4.871 1.00 24.30 C ATOM 758 CG2 ILE A 47 -12.225 8.024 -4.166 1.00 43.31 C ATOM 759 CD1 ILE A 47 -13.013 5.078 -4.521 1.00 14.44 C ATOM 0 H ILE A 47 -15.945 6.834 -3.146 1.00 13.21 H new ATOM 0 HA ILE A 47 -13.251 6.645 -2.124 1.00 1.10 H new ATOM 0 HB ILE A 47 -14.368 8.289 -4.356 1.00 4.03 H new ATOM 0 HG12 ILE A 47 -14.950 5.971 -4.777 1.00 24.30 H new ATOM 0 HG13 ILE A 47 -13.745 6.539 -5.916 1.00 24.30 H new ATOM 0 HG21 ILE A 47 -12.008 8.160 -5.225 1.00 43.31 H new ATOM 0 HG22 ILE A 47 -12.103 8.974 -3.646 1.00 43.31 H new ATOM 0 HG23 ILE A 47 -11.538 7.289 -3.746 1.00 43.31 H new ATOM 0 HD11 ILE A 47 -13.246 4.244 -5.183 1.00 14.44 H new ATOM 0 HD12 ILE A 47 -11.967 5.358 -4.644 1.00 14.44 H new ATOM 0 HD13 ILE A 47 -13.190 4.781 -3.487 1.00 14.44 H new ATOM 771 N GLN A 48 -12.992 8.805 -0.865 1.00 13.04 N ATOM 772 CA GLN A 48 -12.616 10.046 -0.205 1.00 31.21 C ATOM 773 C GLN A 48 -11.102 10.000 -0.013 1.00 32.23 C ATOM 774 O GLN A 48 -10.468 9.041 -0.436 1.00 30.42 O ATOM 775 CB GLN A 48 -13.376 10.220 1.120 1.00 1.10 C ATOM 776 CG GLN A 48 -13.302 8.998 2.058 1.00 73.21 C ATOM 777 CD GLN A 48 -13.264 9.396 3.531 1.00 73.43 C ATOM 778 OE1 GLN A 48 -12.498 8.861 4.314 1.00 24.43 O ATOM 779 NE2 GLN A 48 -14.046 10.369 3.959 1.00 41.23 N ATOM 0 H GLN A 48 -12.384 8.030 -0.600 1.00 13.04 H new ATOM 0 HA GLN A 48 -12.885 10.914 -0.807 1.00 31.21 H new ATOM 0 HB2 GLN A 48 -12.977 11.089 1.643 1.00 1.10 H new ATOM 0 HB3 GLN A 48 -14.422 10.432 0.900 1.00 1.10 H new ATOM 0 HG2 GLN A 48 -14.164 8.355 1.881 1.00 73.21 H new ATOM 0 HG3 GLN A 48 -12.413 8.414 1.819 1.00 73.21 H new ATOM 0 HE21 GLN A 48 -14.692 10.825 3.314 1.00 41.23 H new ATOM 0 HE22 GLN A 48 -14.005 10.665 4.934 1.00 41.23 H new ATOM 788 N GLU A 49 -10.502 10.998 0.628 1.00 31.41 N ATOM 789 CA GLU A 49 -9.054 11.062 0.834 1.00 5.35 C ATOM 790 C GLU A 49 -8.698 10.551 2.241 1.00 52.21 C ATOM 791 O GLU A 49 -7.809 11.098 2.904 1.00 30.41 O ATOM 792 CB GLU A 49 -8.529 12.479 0.523 1.00 21.32 C ATOM 793 CG GLU A 49 -9.252 13.558 1.330 1.00 32.52 C ATOM 794 CD GLU A 49 -8.553 14.914 1.436 1.00 53.02 C ATOM 795 OE1 GLU A 49 -7.803 15.326 0.518 1.00 34.32 O ATOM 796 OE2 GLU A 49 -8.803 15.609 2.454 1.00 43.12 O ATOM 0 H GLU A 49 -11.007 11.791 1.023 1.00 31.41 H new ATOM 0 HA GLU A 49 -8.544 10.399 0.135 1.00 5.35 H new ATOM 0 HB2 GLU A 49 -7.461 12.523 0.737 1.00 21.32 H new ATOM 0 HB3 GLU A 49 -8.649 12.683 -0.541 1.00 21.32 H new ATOM 0 HG2 GLU A 49 -10.235 13.715 0.886 1.00 32.52 H new ATOM 0 HG3 GLU A 49 -9.415 13.178 2.339 1.00 32.52 H new ATOM 803 N GLY A 50 -9.452 9.557 2.719 1.00 73.35 N ATOM 804 CA GLY A 50 -9.419 9.040 4.073 1.00 60.03 C ATOM 805 C GLY A 50 -9.636 7.529 4.111 1.00 21.10 C ATOM 806 O GLY A 50 -9.759 6.861 3.078 1.00 21.51 O ATOM 0 H GLY A 50 -10.134 9.072 2.135 1.00 73.35 H new ATOM 0 HA2 GLY A 50 -8.459 9.281 4.530 1.00 60.03 H new ATOM 0 HA3 GLY A 50 -10.188 9.532 4.668 1.00 60.03 H new ATOM 810 N ILE A 51 -9.632 6.992 5.333 1.00 2.23 N ATOM 811 CA ILE A 51 -9.905 5.596 5.635 1.00 32.13 C ATOM 812 C ILE A 51 -11.369 5.314 5.319 1.00 51.33 C ATOM 813 O ILE A 51 -12.250 6.127 5.605 1.00 43.54 O ATOM 814 CB ILE A 51 -9.614 5.314 7.126 1.00 12.53 C ATOM 815 CG1 ILE A 51 -8.161 5.691 7.513 1.00 43.14 C ATOM 816 CG2 ILE A 51 -9.992 3.873 7.528 1.00 44.43 C ATOM 817 CD1 ILE A 51 -7.179 4.546 7.752 1.00 55.21 C ATOM 0 H ILE A 51 -9.430 7.543 6.167 1.00 2.23 H new ATOM 0 HA ILE A 51 -9.266 4.949 5.034 1.00 32.13 H new ATOM 0 HB ILE A 51 -10.262 5.967 7.711 1.00 12.53 H new ATOM 0 HG12 ILE A 51 -7.755 6.324 6.724 1.00 43.14 H new ATOM 0 HG13 ILE A 51 -8.200 6.296 8.419 1.00 43.14 H new ATOM 0 HG21 ILE A 51 -9.770 3.720 8.584 1.00 44.43 H new ATOM 0 HG22 ILE A 51 -11.056 3.714 7.354 1.00 44.43 H new ATOM 0 HG23 ILE A 51 -9.417 3.166 6.930 1.00 44.43 H new ATOM 0 HD11 ILE A 51 -6.203 4.953 8.015 1.00 55.21 H new ATOM 0 HD12 ILE A 51 -7.542 3.919 8.567 1.00 55.21 H new ATOM 0 HD13 ILE A 51 -7.091 3.947 6.845 1.00 55.21 H new ATOM 829 N VAL A 52 -11.636 4.109 4.840 1.00 42.32 N ATOM 830 CA VAL A 52 -12.960 3.555 4.701 1.00 11.12 C ATOM 831 C VAL A 52 -12.951 2.220 5.439 1.00 5.33 C ATOM 832 O VAL A 52 -11.934 1.528 5.509 1.00 52.21 O ATOM 833 CB VAL A 52 -13.325 3.484 3.196 1.00 53.13 C ATOM 834 CG1 VAL A 52 -13.025 4.810 2.466 1.00 41.15 C ATOM 835 CG2 VAL A 52 -12.617 2.344 2.460 1.00 41.14 C ATOM 0 H VAL A 52 -10.904 3.471 4.528 1.00 42.32 H new ATOM 0 HA VAL A 52 -13.745 4.167 5.146 1.00 11.12 H new ATOM 0 HB VAL A 52 -14.398 3.291 3.176 1.00 53.13 H new ATOM 0 HG11 VAL A 52 -13.296 4.716 1.414 1.00 41.15 H new ATOM 0 HG12 VAL A 52 -13.605 5.614 2.919 1.00 41.15 H new ATOM 0 HG13 VAL A 52 -11.962 5.038 2.548 1.00 41.15 H new ATOM 0 HG21 VAL A 52 -12.914 2.348 1.411 1.00 41.14 H new ATOM 0 HG22 VAL A 52 -11.538 2.479 2.532 1.00 41.14 H new ATOM 0 HG23 VAL A 52 -12.894 1.392 2.912 1.00 41.14 H new ATOM 845 N ASP A 53 -14.090 1.826 5.979 1.00 53.52 N ATOM 846 CA ASP A 53 -14.364 0.465 6.402 1.00 71.42 C ATOM 847 C ASP A 53 -15.354 -0.127 5.410 1.00 74.53 C ATOM 848 O ASP A 53 -16.574 -0.010 5.570 1.00 23.00 O ATOM 849 CB ASP A 53 -14.854 0.431 7.847 1.00 45.51 C ATOM 850 CG ASP A 53 -15.605 -0.863 8.164 1.00 73.21 C ATOM 851 OD1 ASP A 53 -15.212 -1.942 7.654 1.00 74.35 O ATOM 852 OD2 ASP A 53 -16.629 -0.752 8.876 1.00 15.23 O ATOM 0 H ASP A 53 -14.871 2.462 6.140 1.00 53.52 H new ATOM 0 HA ASP A 53 -13.459 -0.143 6.398 1.00 71.42 H new ATOM 0 HB2 ASP A 53 -14.003 0.532 8.521 1.00 45.51 H new ATOM 0 HB3 ASP A 53 -15.508 1.284 8.029 1.00 45.51 H new ATOM 857 N TYR A 54 -14.809 -0.708 4.345 1.00 73.31 N ATOM 858 CA TYR A 54 -15.545 -1.480 3.367 1.00 3.33 C ATOM 859 C TYR A 54 -14.529 -2.383 2.669 1.00 65.11 C ATOM 860 O TYR A 54 -13.787 -1.922 1.801 1.00 43.01 O ATOM 861 CB TYR A 54 -16.275 -0.540 2.391 1.00 64.31 C ATOM 862 CG TYR A 54 -17.370 -1.231 1.605 1.00 62.12 C ATOM 863 CD1 TYR A 54 -17.057 -2.007 0.474 1.00 63.12 C ATOM 864 CD2 TYR A 54 -18.709 -1.111 2.021 1.00 13.43 C ATOM 865 CE1 TYR A 54 -18.079 -2.654 -0.240 1.00 51.41 C ATOM 866 CE2 TYR A 54 -19.734 -1.751 1.306 1.00 61.31 C ATOM 867 CZ TYR A 54 -19.420 -2.516 0.165 1.00 61.42 C ATOM 868 OH TYR A 54 -20.386 -3.114 -0.578 1.00 41.20 O ATOM 0 H TYR A 54 -13.812 -0.649 4.139 1.00 73.31 H new ATOM 0 HA TYR A 54 -16.320 -2.093 3.827 1.00 3.33 H new ATOM 0 HB2 TYR A 54 -16.706 0.290 2.950 1.00 64.31 H new ATOM 0 HB3 TYR A 54 -15.551 -0.114 1.696 1.00 64.31 H new ATOM 0 HD1 TYR A 54 -16.030 -2.105 0.155 1.00 63.12 H new ATOM 0 HD2 TYR A 54 -18.949 -0.524 2.895 1.00 13.43 H new ATOM 0 HE1 TYR A 54 -17.835 -3.258 -1.101 1.00 51.41 H new ATOM 0 HE2 TYR A 54 -20.760 -1.657 1.630 1.00 61.31 H new ATOM 0 HH TYR A 54 -21.263 -2.935 -0.179 1.00 41.20 H new ATOM 878 N GLY A 55 -14.435 -3.652 3.059 1.00 22.13 N ATOM 879 CA GLY A 55 -13.537 -4.620 2.451 1.00 71.40 C ATOM 880 C GLY A 55 -12.307 -4.807 3.324 1.00 34.53 C ATOM 881 O GLY A 55 -12.286 -5.688 4.184 1.00 21.12 O ATOM 0 H GLY A 55 -14.992 -4.039 3.820 1.00 22.13 H new ATOM 0 HA2 GLY A 55 -14.050 -5.573 2.322 1.00 71.40 H new ATOM 0 HA3 GLY A 55 -13.241 -4.280 1.459 1.00 71.40 H new ATOM 885 N VAL A 56 -11.295 -3.970 3.117 1.00 65.14 N ATOM 886 CA VAL A 56 -9.954 -4.149 3.681 1.00 72.35 C ATOM 887 C VAL A 56 -9.493 -2.859 4.354 1.00 44.13 C ATOM 888 O VAL A 56 -8.379 -2.372 4.147 1.00 3.53 O ATOM 889 CB VAL A 56 -8.971 -4.635 2.606 1.00 61.10 C ATOM 890 CG1 VAL A 56 -7.671 -5.099 3.248 1.00 22.41 C ATOM 891 CG2 VAL A 56 -9.503 -5.798 1.760 1.00 14.13 C ATOM 0 H VAL A 56 -11.382 -3.132 2.542 1.00 65.14 H new ATOM 0 HA VAL A 56 -9.986 -4.924 4.447 1.00 72.35 H new ATOM 0 HB VAL A 56 -8.818 -3.777 1.951 1.00 61.10 H new ATOM 0 HG11 VAL A 56 -6.984 -5.441 2.473 1.00 22.41 H new ATOM 0 HG12 VAL A 56 -7.219 -4.271 3.794 1.00 22.41 H new ATOM 0 HG13 VAL A 56 -7.877 -5.918 3.937 1.00 22.41 H new ATOM 0 HG21 VAL A 56 -8.753 -6.085 1.023 1.00 14.13 H new ATOM 0 HG22 VAL A 56 -9.721 -6.648 2.406 1.00 14.13 H new ATOM 0 HG23 VAL A 56 -10.414 -5.489 1.248 1.00 14.13 H new ATOM 901 N ARG A 57 -10.384 -2.260 5.143 1.00 60.45 N ATOM 902 CA ARG A 57 -10.096 -1.058 5.911 1.00 22.01 C ATOM 903 C ARG A 57 -9.339 0.017 5.111 1.00 61.20 C ATOM 904 O ARG A 57 -8.421 0.636 5.651 1.00 55.03 O ATOM 905 CB ARG A 57 -9.428 -1.424 7.251 1.00 52.43 C ATOM 906 CG ARG A 57 -10.293 -2.397 8.074 1.00 44.24 C ATOM 907 CD ARG A 57 -10.007 -2.308 9.575 1.00 0.02 C ATOM 908 NE ARG A 57 -10.519 -1.049 10.137 1.00 4.14 N ATOM 909 CZ ARG A 57 -10.699 -0.778 11.432 1.00 4.31 C ATOM 910 NH1 ARG A 57 -10.418 -1.669 12.374 1.00 64.11 N ATOM 911 NH2 ARG A 57 -11.211 0.391 11.787 1.00 60.32 N ATOM 0 H ARG A 57 -11.337 -2.603 5.266 1.00 60.45 H new ATOM 0 HA ARG A 57 -11.048 -0.580 6.144 1.00 22.01 H new ATOM 0 HB2 ARG A 57 -8.454 -1.875 7.060 1.00 52.43 H new ATOM 0 HB3 ARG A 57 -9.251 -0.517 7.829 1.00 52.43 H new ATOM 0 HG2 ARG A 57 -11.347 -2.182 7.895 1.00 44.24 H new ATOM 0 HG3 ARG A 57 -10.113 -3.416 7.733 1.00 44.24 H new ATOM 0 HD2 ARG A 57 -10.468 -3.153 10.087 1.00 0.02 H new ATOM 0 HD3 ARG A 57 -8.933 -2.377 9.749 1.00 0.02 H new ATOM 0 HE ARG A 57 -10.760 -0.312 9.474 1.00 4.14 H new ATOM 0 HH11 ARG A 57 -10.055 -2.587 12.116 1.00 64.11 H new ATOM 0 HH12 ARG A 57 -10.565 -1.436 13.356 1.00 64.11 H new ATOM 0 HH21 ARG A 57 -11.464 1.075 11.074 1.00 60.32 H new ATOM 0 HH22 ARG A 57 -11.352 0.607 12.774 1.00 60.32 H new ATOM 925 N PHE A 58 -9.652 0.146 3.812 1.00 74.34 N ATOM 926 CA PHE A 58 -8.742 0.746 2.842 1.00 12.25 C ATOM 927 C PHE A 58 -8.485 2.196 3.223 1.00 60.42 C ATOM 928 O PHE A 58 -9.357 2.853 3.787 1.00 61.52 O ATOM 929 CB PHE A 58 -9.299 0.691 1.409 1.00 4.41 C ATOM 930 CG PHE A 58 -9.562 -0.683 0.829 1.00 35.00 C ATOM 931 CD1 PHE A 58 -8.492 -1.439 0.325 1.00 55.25 C ATOM 932 CD2 PHE A 58 -10.875 -1.177 0.711 1.00 30.15 C ATOM 933 CE1 PHE A 58 -8.722 -2.666 -0.317 1.00 42.33 C ATOM 934 CE2 PHE A 58 -11.105 -2.423 0.097 1.00 74.52 C ATOM 935 CZ PHE A 58 -10.030 -3.164 -0.414 1.00 71.42 C ATOM 0 H PHE A 58 -10.539 -0.163 3.413 1.00 74.34 H new ATOM 0 HA PHE A 58 -7.816 0.172 2.860 1.00 12.25 H new ATOM 0 HB2 PHE A 58 -10.232 1.253 1.386 1.00 4.41 H new ATOM 0 HB3 PHE A 58 -8.599 1.208 0.753 1.00 4.41 H new ATOM 0 HD1 PHE A 58 -7.482 -1.073 0.432 1.00 55.25 H new ATOM 0 HD2 PHE A 58 -11.705 -0.601 1.091 1.00 30.15 H new ATOM 0 HE1 PHE A 58 -7.896 -3.224 -0.734 1.00 42.33 H new ATOM 0 HE2 PHE A 58 -12.111 -2.809 0.020 1.00 74.52 H new ATOM 0 HZ PHE A 58 -10.209 -4.120 -0.883 1.00 71.42 H new ATOM 945 N PHE A 59 -7.327 2.727 2.847 1.00 74.13 N ATOM 946 CA PHE A 59 -6.971 4.107 3.123 1.00 32.52 C ATOM 947 C PHE A 59 -6.610 4.755 1.810 1.00 23.01 C ATOM 948 O PHE A 59 -5.547 4.488 1.246 1.00 11.00 O ATOM 949 CB PHE A 59 -5.854 4.154 4.159 1.00 51.31 C ATOM 950 CG PHE A 59 -5.484 5.486 4.771 1.00 0.44 C ATOM 951 CD1 PHE A 59 -6.244 6.654 4.576 1.00 22.33 C ATOM 952 CD2 PHE A 59 -4.388 5.509 5.647 1.00 63.40 C ATOM 953 CE1 PHE A 59 -5.922 7.827 5.274 1.00 20.53 C ATOM 954 CE2 PHE A 59 -4.083 6.676 6.371 1.00 2.12 C ATOM 955 CZ PHE A 59 -4.868 7.827 6.195 1.00 4.31 C ATOM 0 H PHE A 59 -6.609 2.208 2.341 1.00 74.13 H new ATOM 0 HA PHE A 59 -7.800 4.666 3.558 1.00 32.52 H new ATOM 0 HB2 PHE A 59 -6.129 3.482 4.972 1.00 51.31 H new ATOM 0 HB3 PHE A 59 -4.957 3.743 3.696 1.00 51.31 H new ATOM 0 HD1 PHE A 59 -7.076 6.647 3.888 1.00 22.33 H new ATOM 0 HD2 PHE A 59 -3.776 4.627 5.766 1.00 63.40 H new ATOM 0 HE1 PHE A 59 -6.488 8.731 5.101 1.00 20.53 H new ATOM 0 HE2 PHE A 59 -3.250 6.687 7.058 1.00 2.12 H new ATOM 0 HZ PHE A 59 -4.658 8.715 6.772 1.00 4.31 H new ATOM 965 N PHE A 60 -7.543 5.546 1.305 1.00 12.42 N ATOM 966 CA PHE A 60 -7.310 6.379 0.153 1.00 72.40 C ATOM 967 C PHE A 60 -6.717 7.691 0.628 1.00 64.43 C ATOM 968 O PHE A 60 -6.931 8.116 1.762 1.00 70.30 O ATOM 969 CB PHE A 60 -8.635 6.588 -0.565 1.00 13.33 C ATOM 970 CG PHE A 60 -9.291 5.287 -0.956 1.00 53.15 C ATOM 971 CD1 PHE A 60 -8.619 4.401 -1.816 1.00 42.34 C ATOM 972 CD2 PHE A 60 -10.504 4.915 -0.349 1.00 44.13 C ATOM 973 CE1 PHE A 60 -9.161 3.125 -2.053 1.00 64.54 C ATOM 974 CE2 PHE A 60 -11.033 3.637 -0.576 1.00 74.43 C ATOM 975 CZ PHE A 60 -10.359 2.737 -1.423 1.00 74.23 C ATOM 0 H PHE A 60 -8.485 5.623 1.690 1.00 12.42 H new ATOM 0 HA PHE A 60 -6.612 5.917 -0.545 1.00 72.40 H new ATOM 0 HB2 PHE A 60 -9.309 7.152 0.080 1.00 13.33 H new ATOM 0 HB3 PHE A 60 -8.470 7.191 -1.458 1.00 13.33 H new ATOM 0 HD1 PHE A 60 -7.695 4.697 -2.290 1.00 42.34 H new ATOM 0 HD2 PHE A 60 -11.026 5.612 0.290 1.00 44.13 H new ATOM 0 HE1 PHE A 60 -8.657 2.441 -2.720 1.00 64.54 H new ATOM 0 HE2 PHE A 60 -11.957 3.343 -0.101 1.00 74.43 H new ATOM 0 HZ PHE A 60 -10.761 1.749 -1.590 1.00 74.23 H new ATOM 985 N TYR A 61 -5.993 8.348 -0.262 1.00 64.42 N ATOM 986 CA TYR A 61 -5.355 9.625 -0.001 1.00 42.42 C ATOM 987 C TYR A 61 -5.121 10.308 -1.333 1.00 43.34 C ATOM 988 O TYR A 61 -5.004 9.660 -2.379 1.00 74.14 O ATOM 989 CB TYR A 61 -4.027 9.433 0.744 1.00 62.41 C ATOM 990 CG TYR A 61 -3.169 8.304 0.215 1.00 44.00 C ATOM 991 CD1 TYR A 61 -2.223 8.526 -0.805 1.00 35.44 C ATOM 992 CD2 TYR A 61 -3.349 7.013 0.735 1.00 10.02 C ATOM 993 CE1 TYR A 61 -1.414 7.470 -1.261 1.00 30.40 C ATOM 994 CE2 TYR A 61 -2.596 5.947 0.235 1.00 23.15 C ATOM 995 CZ TYR A 61 -1.609 6.168 -0.743 1.00 43.04 C ATOM 996 OH TYR A 61 -0.878 5.113 -1.188 1.00 62.23 O ATOM 0 H TYR A 61 -5.829 8.000 -1.207 1.00 64.42 H new ATOM 0 HA TYR A 61 -5.996 10.238 0.633 1.00 42.42 H new ATOM 0 HB2 TYR A 61 -3.458 10.361 0.691 1.00 62.41 H new ATOM 0 HB3 TYR A 61 -4.239 9.249 1.797 1.00 62.41 H new ATOM 0 HD1 TYR A 61 -2.119 9.510 -1.238 1.00 35.44 H new ATOM 0 HD2 TYR A 61 -4.069 6.843 1.522 1.00 10.02 H new ATOM 0 HE1 TYR A 61 -0.649 7.652 -2.002 1.00 30.40 H new ATOM 0 HE2 TYR A 61 -2.773 4.947 0.602 1.00 23.15 H new ATOM 0 HH TYR A 61 -1.153 4.301 -0.714 1.00 62.23 H new ATOM 1006 N THR A 62 -5.082 11.629 -1.277 1.00 35.24 N ATOM 1007 CA THR A 62 -4.940 12.503 -2.414 1.00 50.33 C ATOM 1008 C THR A 62 -3.467 12.566 -2.806 1.00 34.15 C ATOM 1009 O THR A 62 -2.590 12.734 -1.952 1.00 0.34 O ATOM 1010 CB THR A 62 -5.580 13.861 -2.041 1.00 24.24 C ATOM 1011 OG1 THR A 62 -5.616 14.098 -0.629 1.00 40.24 O ATOM 1012 CG2 THR A 62 -7.018 13.812 -2.547 1.00 24.34 C ATOM 0 H THR A 62 -5.152 12.137 -0.395 1.00 35.24 H new ATOM 0 HA THR A 62 -5.461 12.144 -3.302 1.00 50.33 H new ATOM 0 HB THR A 62 -4.985 14.660 -2.484 1.00 24.24 H new ATOM 0 HG1 THR A 62 -6.458 14.540 -0.393 1.00 40.24 H new ATOM 0 HG21 THR A 62 -7.520 14.750 -2.309 1.00 24.34 H new ATOM 0 HG22 THR A 62 -7.019 13.663 -3.627 1.00 24.34 H new ATOM 0 HG23 THR A 62 -7.545 12.987 -2.067 1.00 24.34 H new ATOM 1020 N SER A 63 -3.191 12.433 -4.105 1.00 3.21 N ATOM 1021 CA SER A 63 -1.847 12.475 -4.669 1.00 21.15 C ATOM 1022 C SER A 63 -1.118 13.800 -4.388 1.00 0.22 C ATOM 1023 O SER A 63 0.114 13.838 -4.470 1.00 31.15 O ATOM 1024 CB SER A 63 -1.930 12.172 -6.165 1.00 64.13 C ATOM 1025 OG SER A 63 -3.081 12.751 -6.757 1.00 31.22 O ATOM 0 H SER A 63 -3.916 12.290 -4.808 1.00 3.21 H new ATOM 0 HA SER A 63 -1.243 11.712 -4.177 1.00 21.15 H new ATOM 0 HB2 SER A 63 -1.037 12.550 -6.662 1.00 64.13 H new ATOM 0 HB3 SER A 63 -1.947 11.093 -6.317 1.00 64.13 H new ATOM 0 HG SER A 63 -3.099 12.538 -7.713 1.00 31.22 H new ATOM 1031 N LYS A 64 -1.859 14.845 -3.989 1.00 14.33 N ATOM 1032 CA LYS A 64 -1.358 16.090 -3.408 1.00 53.22 C ATOM 1033 C LYS A 64 -0.344 15.841 -2.301 1.00 12.21 C ATOM 1034 O LYS A 64 0.654 16.558 -2.225 1.00 44.15 O ATOM 1035 CB LYS A 64 -2.534 16.991 -2.966 1.00 24.32 C ATOM 1036 CG LYS A 64 -3.110 16.781 -1.556 1.00 14.42 C ATOM 1037 CD LYS A 64 -2.230 17.391 -0.447 1.00 13.14 C ATOM 1038 CE LYS A 64 -2.921 18.452 0.387 1.00 63.42 C ATOM 1039 NZ LYS A 64 -3.936 17.880 1.293 1.00 74.21 N ATOM 0 H LYS A 64 -2.876 14.839 -4.069 1.00 14.33 H new ATOM 0 HA LYS A 64 -0.811 16.631 -4.180 1.00 53.22 H new ATOM 0 HB2 LYS A 64 -2.208 18.028 -3.043 1.00 24.32 H new ATOM 0 HB3 LYS A 64 -3.345 16.858 -3.682 1.00 24.32 H new ATOM 0 HG2 LYS A 64 -4.105 17.223 -1.507 1.00 14.42 H new ATOM 0 HG3 LYS A 64 -3.227 15.713 -1.373 1.00 14.42 H new ATOM 0 HD2 LYS A 64 -1.891 16.592 0.212 1.00 13.14 H new ATOM 0 HD3 LYS A 64 -1.341 17.827 -0.903 1.00 13.14 H new ATOM 0 HE2 LYS A 64 -2.177 18.992 0.973 1.00 63.42 H new ATOM 0 HE3 LYS A 64 -3.395 19.178 -0.273 1.00 63.42 H new ATOM 0 HZ1 LYS A 64 -4.428 18.648 1.792 1.00 74.21 H new ATOM 0 HZ2 LYS A 64 -4.624 17.330 0.740 1.00 74.21 H new ATOM 0 HZ3 LYS A 64 -3.472 17.258 1.986 1.00 74.21 H new ATOM 1053 N GLU A 65 -0.648 14.913 -1.389 1.00 23.31 N ATOM 1054 CA GLU A 65 0.115 14.863 -0.145 1.00 2.20 C ATOM 1055 C GLU A 65 1.449 14.153 -0.409 1.00 42.11 C ATOM 1056 O GLU A 65 1.459 13.197 -1.191 1.00 75.03 O ATOM 1057 CB GLU A 65 -0.750 14.204 0.953 1.00 30.52 C ATOM 1058 CG GLU A 65 -0.571 14.871 2.332 1.00 21.14 C ATOM 1059 CD GLU A 65 -1.888 15.063 3.095 1.00 43.24 C ATOM 1060 OE1 GLU A 65 -2.498 16.149 2.947 1.00 3.42 O ATOM 1061 OE2 GLU A 65 -2.281 14.186 3.901 1.00 1.50 O ATOM 0 H GLU A 65 -1.386 14.215 -1.483 1.00 23.31 H new ATOM 0 HA GLU A 65 0.363 15.860 0.220 1.00 2.20 H new ATOM 0 HB2 GLU A 65 -1.799 14.255 0.663 1.00 30.52 H new ATOM 0 HB3 GLU A 65 -0.491 13.148 1.028 1.00 30.52 H new ATOM 0 HG2 GLU A 65 0.104 14.264 2.935 1.00 21.14 H new ATOM 0 HG3 GLU A 65 -0.093 15.841 2.198 1.00 21.14 H new ATOM 1068 N PRO A 66 2.571 14.547 0.220 1.00 41.32 N ATOM 1069 CA PRO A 66 3.829 13.831 0.040 1.00 55.44 C ATOM 1070 C PRO A 66 3.710 12.447 0.668 1.00 70.45 C ATOM 1071 O PRO A 66 3.023 12.249 1.677 1.00 45.22 O ATOM 1072 CB PRO A 66 4.905 14.697 0.702 1.00 51.13 C ATOM 1073 CG PRO A 66 4.148 15.581 1.686 1.00 52.13 C ATOM 1074 CD PRO A 66 2.748 15.707 1.085 1.00 33.13 C ATOM 0 HA PRO A 66 4.087 13.670 -1.007 1.00 55.44 H new ATOM 0 HB2 PRO A 66 5.647 14.083 1.213 1.00 51.13 H new ATOM 0 HB3 PRO A 66 5.440 15.295 -0.036 1.00 51.13 H new ATOM 0 HG2 PRO A 66 4.115 15.133 2.679 1.00 52.13 H new ATOM 0 HG3 PRO A 66 4.624 16.556 1.792 1.00 52.13 H new ATOM 0 HD2 PRO A 66 1.989 15.729 1.867 1.00 33.13 H new ATOM 0 HD3 PRO A 66 2.649 16.633 0.519 1.00 33.13 H new ATOM 1082 N VAL A 67 4.449 11.501 0.093 1.00 21.12 N ATOM 1083 CA VAL A 67 4.583 10.139 0.583 1.00 34.21 C ATOM 1084 C VAL A 67 4.988 10.229 2.056 1.00 4.55 C ATOM 1085 O VAL A 67 4.356 9.616 2.913 1.00 14.21 O ATOM 1086 CB VAL A 67 5.613 9.374 -0.283 1.00 30.44 C ATOM 1087 CG1 VAL A 67 5.737 7.904 0.143 1.00 43.22 C ATOM 1088 CG2 VAL A 67 5.289 9.390 -1.789 1.00 52.41 C ATOM 0 H VAL A 67 4.988 11.672 -0.756 1.00 21.12 H new ATOM 0 HA VAL A 67 3.650 9.580 0.509 1.00 34.21 H new ATOM 0 HB VAL A 67 6.549 9.907 -0.117 1.00 30.44 H new ATOM 0 HG11 VAL A 67 6.470 7.402 -0.489 1.00 43.22 H new ATOM 0 HG12 VAL A 67 6.059 7.853 1.183 1.00 43.22 H new ATOM 0 HG13 VAL A 67 4.770 7.412 0.038 1.00 43.22 H new ATOM 0 HG21 VAL A 67 6.054 8.835 -2.332 1.00 52.41 H new ATOM 0 HG22 VAL A 67 4.317 8.927 -1.957 1.00 52.41 H new ATOM 0 HG23 VAL A 67 5.267 10.420 -2.145 1.00 52.41 H new ATOM 1098 N ALA A 68 5.975 11.078 2.365 1.00 33.34 N ATOM 1099 CA ALA A 68 6.512 11.272 3.702 1.00 60.01 C ATOM 1100 C ALA A 68 5.468 11.696 4.748 1.00 13.30 C ATOM 1101 O ALA A 68 5.637 11.386 5.935 1.00 42.30 O ATOM 1102 CB ALA A 68 7.636 12.302 3.614 1.00 23.33 C ATOM 0 H ALA A 68 6.431 11.663 1.665 1.00 33.34 H new ATOM 0 HA ALA A 68 6.881 10.308 4.052 1.00 60.01 H new ATOM 0 HB1 ALA A 68 8.057 12.467 4.606 1.00 23.33 H new ATOM 0 HB2 ALA A 68 8.415 11.935 2.945 1.00 23.33 H new ATOM 0 HB3 ALA A 68 7.240 13.241 3.228 1.00 23.33 H new ATOM 1108 N SER A 69 4.404 12.404 4.360 1.00 75.33 N ATOM 1109 CA SER A 69 3.316 12.693 5.287 1.00 63.45 C ATOM 1110 C SER A 69 2.479 11.438 5.534 1.00 11.52 C ATOM 1111 O SER A 69 2.143 11.163 6.687 1.00 21.31 O ATOM 1112 CB SER A 69 2.448 13.836 4.767 1.00 22.22 C ATOM 1113 OG SER A 69 3.135 15.060 4.929 1.00 21.11 O ATOM 0 H SER A 69 4.276 12.782 3.421 1.00 75.33 H new ATOM 0 HA SER A 69 3.748 13.008 6.237 1.00 63.45 H new ATOM 0 HB2 SER A 69 2.210 13.677 3.715 1.00 22.22 H new ATOM 0 HB3 SER A 69 1.502 13.863 5.307 1.00 22.22 H new ATOM 0 HG SER A 69 2.579 15.794 4.594 1.00 21.11 H new ATOM 1119 N ILE A 70 2.160 10.658 4.496 1.00 23.32 N ATOM 1120 CA ILE A 70 1.359 9.442 4.637 1.00 70.31 C ATOM 1121 C ILE A 70 2.059 8.468 5.589 1.00 64.12 C ATOM 1122 O ILE A 70 1.399 7.913 6.472 1.00 51.54 O ATOM 1123 CB ILE A 70 1.040 8.811 3.269 1.00 62.52 C ATOM 1124 CG1 ILE A 70 0.163 9.782 2.448 1.00 3.41 C ATOM 1125 CG2 ILE A 70 0.307 7.464 3.450 1.00 15.41 C ATOM 1126 CD1 ILE A 70 0.292 9.553 0.948 1.00 4.01 C ATOM 0 H ILE A 70 2.450 10.853 3.538 1.00 23.32 H new ATOM 0 HA ILE A 70 0.395 9.701 5.076 1.00 70.31 H new ATOM 0 HB ILE A 70 1.974 8.625 2.739 1.00 62.52 H new ATOM 0 HG12 ILE A 70 -0.880 9.663 2.743 1.00 3.41 H new ATOM 0 HG13 ILE A 70 0.445 10.809 2.682 1.00 3.41 H new ATOM 0 HG21 ILE A 70 0.090 7.034 2.472 1.00 15.41 H new ATOM 0 HG22 ILE A 70 0.939 6.779 4.016 1.00 15.41 H new ATOM 0 HG23 ILE A 70 -0.626 7.627 3.990 1.00 15.41 H new ATOM 0 HD11 ILE A 70 -0.344 10.260 0.416 1.00 4.01 H new ATOM 0 HD12 ILE A 70 1.329 9.699 0.646 1.00 4.01 H new ATOM 0 HD13 ILE A 70 -0.017 8.536 0.707 1.00 4.01 H new ATOM 1138 N ILE A 71 3.388 8.327 5.482 1.00 23.22 N ATOM 1139 CA ILE A 71 4.172 7.504 6.404 1.00 63.20 C ATOM 1140 C ILE A 71 3.810 7.891 7.850 1.00 4.11 C ATOM 1141 O ILE A 71 3.612 7.037 8.712 1.00 41.21 O ATOM 1142 CB ILE A 71 5.692 7.660 6.129 1.00 15.30 C ATOM 1143 CG1 ILE A 71 6.093 7.292 4.681 1.00 51.44 C ATOM 1144 CG2 ILE A 71 6.489 6.739 7.057 1.00 31.30 C ATOM 1145 CD1 ILE A 71 7.588 7.477 4.385 1.00 55.42 C ATOM 0 H ILE A 71 3.944 8.779 4.756 1.00 23.22 H new ATOM 0 HA ILE A 71 3.932 6.452 6.252 1.00 63.20 H new ATOM 0 HB ILE A 71 5.915 8.713 6.300 1.00 15.30 H new ATOM 0 HG12 ILE A 71 5.821 6.254 4.491 1.00 51.44 H new ATOM 0 HG13 ILE A 71 5.517 7.904 3.988 1.00 51.44 H new ATOM 0 HG21 ILE A 71 7.554 6.855 6.857 1.00 31.30 H new ATOM 0 HG22 ILE A 71 6.284 7.002 8.095 1.00 31.30 H new ATOM 0 HG23 ILE A 71 6.197 5.704 6.880 1.00 31.30 H new ATOM 0 HD11 ILE A 71 7.791 7.199 3.351 1.00 55.42 H new ATOM 0 HD12 ILE A 71 7.863 8.520 4.541 1.00 55.42 H new ATOM 0 HD13 ILE A 71 8.172 6.844 5.053 1.00 55.42 H new ATOM 1157 N THR A 72 3.684 9.189 8.122 1.00 61.45 N ATOM 1158 CA THR A 72 3.462 9.712 9.457 1.00 30.33 C ATOM 1159 C THR A 72 2.031 9.454 9.956 1.00 32.25 C ATOM 1160 O THR A 72 1.841 9.227 11.153 1.00 3.32 O ATOM 1161 CB THR A 72 3.836 11.204 9.477 1.00 33.12 C ATOM 1162 OG1 THR A 72 5.053 11.424 8.769 1.00 5.13 O ATOM 1163 CG2 THR A 72 4.071 11.669 10.913 1.00 24.20 C ATOM 0 H THR A 72 3.735 9.913 7.405 1.00 61.45 H new ATOM 0 HA THR A 72 4.106 9.181 10.158 1.00 30.33 H new ATOM 0 HB THR A 72 3.015 11.753 9.015 1.00 33.12 H new ATOM 0 HG1 THR A 72 4.868 11.475 7.808 1.00 5.13 H new ATOM 0 HG21 THR A 72 4.335 12.727 10.914 1.00 24.20 H new ATOM 0 HG22 THR A 72 3.162 11.521 11.497 1.00 24.20 H new ATOM 0 HG23 THR A 72 4.884 11.092 11.354 1.00 24.20 H new ATOM 1171 N LYS A 73 0.992 9.466 9.109 1.00 20.34 N ATOM 1172 CA LYS A 73 -0.342 9.078 9.565 1.00 2.45 C ATOM 1173 C LYS A 73 -0.392 7.582 9.859 1.00 61.33 C ATOM 1174 O LYS A 73 -0.974 7.181 10.866 1.00 14.45 O ATOM 1175 CB LYS A 73 -1.461 9.553 8.625 1.00 22.41 C ATOM 1176 CG LYS A 73 -1.186 9.600 7.122 1.00 70.12 C ATOM 1177 CD LYS A 73 -2.401 10.162 6.368 1.00 42.10 C ATOM 1178 CE LYS A 73 -2.135 11.540 5.767 1.00 65.45 C ATOM 1179 NZ LYS A 73 -3.394 12.290 5.570 1.00 34.14 N ATOM 0 H LYS A 73 1.050 9.734 8.127 1.00 20.34 H new ATOM 0 HA LYS A 73 -0.536 9.599 10.502 1.00 2.45 H new ATOM 0 HB2 LYS A 73 -2.323 8.905 8.783 1.00 22.41 H new ATOM 0 HB3 LYS A 73 -1.754 10.555 8.939 1.00 22.41 H new ATOM 0 HG2 LYS A 73 -0.311 10.220 6.926 1.00 70.12 H new ATOM 0 HG3 LYS A 73 -0.956 8.599 6.757 1.00 70.12 H new ATOM 0 HD2 LYS A 73 -2.681 9.471 5.573 1.00 42.10 H new ATOM 0 HD3 LYS A 73 -3.249 10.225 7.050 1.00 42.10 H new ATOM 0 HE2 LYS A 73 -1.472 12.104 6.423 1.00 65.45 H new ATOM 0 HE3 LYS A 73 -1.621 11.430 4.812 1.00 65.45 H new ATOM 0 HZ1 LYS A 73 -3.218 13.109 4.953 1.00 34.14 H new ATOM 0 HZ2 LYS A 73 -4.102 11.670 5.128 1.00 34.14 H new ATOM 0 HZ3 LYS A 73 -3.749 12.620 6.490 1.00 34.14 H new ATOM 1193 N LEU A 74 0.255 6.753 9.043 1.00 11.10 N ATOM 1194 CA LEU A 74 0.368 5.330 9.305 1.00 35.40 C ATOM 1195 C LEU A 74 1.119 5.043 10.594 1.00 73.04 C ATOM 1196 O LEU A 74 0.702 4.163 11.337 1.00 25.30 O ATOM 1197 CB LEU A 74 1.097 4.660 8.155 1.00 24.15 C ATOM 1198 CG LEU A 74 0.160 4.067 7.117 1.00 4.12 C ATOM 1199 CD1 LEU A 74 -0.818 5.043 6.477 1.00 14.33 C ATOM 1200 CD2 LEU A 74 1.039 3.472 6.034 1.00 54.21 C ATOM 0 H LEU A 74 0.714 7.054 8.183 1.00 11.10 H new ATOM 0 HA LEU A 74 -0.643 4.935 9.406 1.00 35.40 H new ATOM 0 HB2 LEU A 74 1.749 5.389 7.673 1.00 24.15 H new ATOM 0 HB3 LEU A 74 1.738 3.871 8.550 1.00 24.15 H new ATOM 0 HG LEU A 74 -0.470 3.340 7.630 1.00 4.12 H new ATOM 0 HD11 LEU A 74 -1.438 4.515 5.753 1.00 14.33 H new ATOM 0 HD12 LEU A 74 -1.453 5.480 7.248 1.00 14.33 H new ATOM 0 HD13 LEU A 74 -0.264 5.834 5.972 1.00 14.33 H new ATOM 0 HD21 LEU A 74 0.413 3.030 5.259 1.00 54.21 H new ATOM 0 HD22 LEU A 74 1.659 4.255 5.597 1.00 54.21 H new ATOM 0 HD23 LEU A 74 1.678 2.702 6.466 1.00 54.21 H new ATOM 1212 N ASN A 75 2.197 5.771 10.877 1.00 24.32 N ATOM 1213 CA ASN A 75 2.969 5.586 12.103 1.00 43.23 C ATOM 1214 C ASN A 75 2.093 5.771 13.343 1.00 52.33 C ATOM 1215 O ASN A 75 2.348 5.115 14.351 1.00 60.33 O ATOM 1216 CB ASN A 75 4.108 6.606 12.192 1.00 51.31 C ATOM 1217 CG ASN A 75 5.327 6.354 11.319 1.00 12.33 C ATOM 1218 OD1 ASN A 75 5.488 5.321 10.682 1.00 11.53 O ATOM 1219 ND2 ASN A 75 6.251 7.300 11.315 1.00 51.02 N ATOM 0 H ASN A 75 2.559 6.503 10.265 1.00 24.32 H new ATOM 0 HA ASN A 75 3.366 4.571 12.070 1.00 43.23 H new ATOM 0 HB2 ASN A 75 3.706 7.587 11.938 1.00 51.31 H new ATOM 0 HB3 ASN A 75 4.438 6.656 13.230 1.00 51.31 H new ATOM 0 HD21 ASN A 75 7.109 7.173 10.777 1.00 51.02 H new ATOM 0 HD22 ASN A 75 6.106 8.157 11.849 1.00 51.02 H new ATOM 1226 N SER A 76 1.106 6.675 13.277 1.00 24.44 N ATOM 1227 CA SER A 76 0.143 6.918 14.331 1.00 42.23 C ATOM 1228 C SER A 76 -0.797 5.706 14.454 1.00 34.44 C ATOM 1229 O SER A 76 -1.013 5.240 15.571 1.00 25.34 O ATOM 1230 CB SER A 76 -0.615 8.207 13.989 1.00 74.34 C ATOM 1231 OG SER A 76 -0.206 9.332 14.750 1.00 33.42 O ATOM 0 H SER A 76 0.961 7.269 12.460 1.00 24.44 H new ATOM 0 HA SER A 76 0.631 7.046 15.297 1.00 42.23 H new ATOM 0 HB2 SER A 76 -0.478 8.427 12.930 1.00 74.34 H new ATOM 0 HB3 SER A 76 -1.681 8.043 14.145 1.00 74.34 H new ATOM 0 HG SER A 76 -0.727 10.117 14.480 1.00 33.42 H new ATOM 1237 N LEU A 77 -1.331 5.195 13.330 1.00 61.31 N ATOM 1238 CA LEU A 77 -2.241 4.038 13.295 1.00 42.21 C ATOM 1239 C LEU A 77 -1.568 2.787 13.854 1.00 13.34 C ATOM 1240 O LEU A 77 -2.200 2.020 14.577 1.00 34.11 O ATOM 1241 CB LEU A 77 -2.705 3.725 11.860 1.00 14.45 C ATOM 1242 CG LEU A 77 -3.592 4.792 11.201 1.00 23.13 C ATOM 1243 CD1 LEU A 77 -3.779 4.450 9.721 1.00 32.24 C ATOM 1244 CD2 LEU A 77 -4.965 4.890 11.870 1.00 43.34 C ATOM 0 H LEU A 77 -1.139 5.581 12.406 1.00 61.31 H new ATOM 0 HA LEU A 77 -3.100 4.307 13.909 1.00 42.21 H new ATOM 0 HB2 LEU A 77 -1.823 3.576 11.237 1.00 14.45 H new ATOM 0 HB3 LEU A 77 -3.251 2.781 11.872 1.00 14.45 H new ATOM 0 HG LEU A 77 -3.094 5.755 11.315 1.00 23.13 H new ATOM 0 HD11 LEU A 77 -4.408 5.205 9.250 1.00 32.24 H new ATOM 0 HD12 LEU A 77 -2.808 4.427 9.227 1.00 32.24 H new ATOM 0 HD13 LEU A 77 -4.255 3.473 9.631 1.00 32.24 H new ATOM 0 HD21 LEU A 77 -5.559 5.657 11.372 1.00 43.34 H new ATOM 0 HD22 LEU A 77 -5.476 3.930 11.795 1.00 43.34 H new ATOM 0 HD23 LEU A 77 -4.840 5.153 12.920 1.00 43.34 H new ATOM 1256 N ASN A 78 -0.292 2.593 13.514 1.00 10.22 N ATOM 1257 CA ASN A 78 0.632 1.624 14.102 1.00 34.41 C ATOM 1258 C ASN A 78 0.280 0.155 13.813 1.00 42.23 C ATOM 1259 O ASN A 78 0.885 -0.748 14.389 1.00 41.04 O ATOM 1260 CB ASN A 78 0.782 1.941 15.603 1.00 70.50 C ATOM 1261 CG ASN A 78 2.054 1.359 16.192 1.00 64.40 C ATOM 1262 OD1 ASN A 78 3.116 1.403 15.572 1.00 31.33 O ATOM 1263 ND2 ASN A 78 2.017 0.922 17.437 1.00 73.23 N ATOM 0 H ASN A 78 0.149 3.142 12.776 1.00 10.22 H new ATOM 0 HA ASN A 78 1.601 1.734 13.615 1.00 34.41 H new ATOM 0 HB2 ASN A 78 0.780 3.022 15.745 1.00 70.50 H new ATOM 0 HB3 ASN A 78 -0.079 1.547 16.143 1.00 70.50 H new ATOM 0 HD21 ASN A 78 2.875 0.616 17.896 1.00 73.23 H new ATOM 0 HD22 ASN A 78 1.130 0.890 17.940 1.00 73.23 H new ATOM 1270 N GLU A 79 -0.669 -0.100 12.911 1.00 54.33 N ATOM 1271 CA GLU A 79 -1.051 -1.438 12.458 1.00 54.42 C ATOM 1272 C GLU A 79 -0.064 -1.994 11.417 1.00 24.30 C ATOM 1273 O GLU A 79 0.682 -1.229 10.809 1.00 2.25 O ATOM 1274 CB GLU A 79 -2.455 -1.355 11.835 1.00 30.21 C ATOM 1275 CG GLU A 79 -3.564 -1.445 12.882 1.00 12.02 C ATOM 1276 CD GLU A 79 -3.802 -2.867 13.403 1.00 55.21 C ATOM 1277 OE1 GLU A 79 -2.924 -3.482 14.048 1.00 53.42 O ATOM 1278 OE2 GLU A 79 -4.938 -3.374 13.255 1.00 12.14 O ATOM 0 H GLU A 79 -1.209 0.640 12.463 1.00 54.33 H new ATOM 0 HA GLU A 79 -1.040 -2.112 13.315 1.00 54.42 H new ATOM 0 HB2 GLU A 79 -2.551 -0.417 11.287 1.00 30.21 H new ATOM 0 HB3 GLU A 79 -2.576 -2.161 11.111 1.00 30.21 H new ATOM 0 HG2 GLU A 79 -3.313 -0.797 13.722 1.00 12.02 H new ATOM 0 HG3 GLU A 79 -4.490 -1.065 12.451 1.00 12.02 H new ATOM 1285 N PRO A 80 -0.078 -3.311 11.149 1.00 2.14 N ATOM 1286 CA PRO A 80 0.620 -3.920 10.029 1.00 54.14 C ATOM 1287 C PRO A 80 -0.119 -3.582 8.731 1.00 64.23 C ATOM 1288 O PRO A 80 -1.215 -4.092 8.494 1.00 33.14 O ATOM 1289 CB PRO A 80 0.613 -5.425 10.323 1.00 5.32 C ATOM 1290 CG PRO A 80 -0.625 -5.634 11.175 1.00 34.04 C ATOM 1291 CD PRO A 80 -0.820 -4.312 11.892 1.00 13.24 C ATOM 0 HA PRO A 80 1.641 -3.559 9.908 1.00 54.14 H new ATOM 0 HB2 PRO A 80 0.567 -6.010 9.404 1.00 5.32 H new ATOM 0 HB3 PRO A 80 1.516 -5.731 10.851 1.00 5.32 H new ATOM 0 HG2 PRO A 80 -1.491 -5.885 10.562 1.00 34.04 H new ATOM 0 HG3 PRO A 80 -0.487 -6.452 11.882 1.00 34.04 H new ATOM 0 HD2 PRO A 80 -1.877 -4.052 11.939 1.00 13.24 H new ATOM 0 HD3 PRO A 80 -0.461 -4.374 12.919 1.00 13.24 H new ATOM 1299 N LEU A 81 0.450 -2.719 7.888 1.00 52.15 N ATOM 1300 CA LEU A 81 -0.175 -2.353 6.620 1.00 0.34 C ATOM 1301 C LEU A 81 0.230 -3.333 5.527 1.00 25.01 C ATOM 1302 O LEU A 81 1.126 -4.162 5.711 1.00 41.52 O ATOM 1303 CB LEU A 81 0.187 -0.930 6.161 1.00 21.32 C ATOM 1304 CG LEU A 81 0.142 0.195 7.198 1.00 61.04 C ATOM 1305 CD1 LEU A 81 -0.982 0.096 8.223 1.00 53.30 C ATOM 1306 CD2 LEU A 81 1.497 0.374 7.870 1.00 62.24 C ATOM 0 H LEU A 81 1.344 -2.261 8.063 1.00 52.15 H new ATOM 0 HA LEU A 81 -1.251 -2.389 6.791 1.00 0.34 H new ATOM 0 HB2 LEU A 81 1.194 -0.960 5.745 1.00 21.32 H new ATOM 0 HB3 LEU A 81 -0.486 -0.661 5.347 1.00 21.32 H new ATOM 0 HG LEU A 81 -0.097 1.091 6.625 1.00 61.04 H new ATOM 0 HD11 LEU A 81 -0.923 0.940 8.910 1.00 53.30 H new ATOM 0 HD12 LEU A 81 -1.944 0.111 7.711 1.00 53.30 H new ATOM 0 HD13 LEU A 81 -0.883 -0.834 8.782 1.00 53.30 H new ATOM 0 HD21 LEU A 81 1.437 1.179 8.602 1.00 62.24 H new ATOM 0 HD22 LEU A 81 1.780 -0.552 8.372 1.00 62.24 H new ATOM 0 HD23 LEU A 81 2.246 0.622 7.118 1.00 62.24 H new ATOM 1318 N VAL A 82 -0.366 -3.191 4.349 1.00 42.04 N ATOM 1319 CA VAL A 82 -0.060 -4.011 3.188 1.00 14.34 C ATOM 1320 C VAL A 82 -0.275 -3.168 1.922 1.00 22.44 C ATOM 1321 O VAL A 82 -1.394 -2.747 1.642 1.00 41.35 O ATOM 1322 CB VAL A 82 -0.871 -5.322 3.297 1.00 43.45 C ATOM 1323 CG1 VAL A 82 -2.391 -5.155 3.227 1.00 72.31 C ATOM 1324 CG2 VAL A 82 -0.413 -6.349 2.264 1.00 32.35 C ATOM 0 H VAL A 82 -1.087 -2.491 4.173 1.00 42.04 H new ATOM 0 HA VAL A 82 0.982 -4.326 3.135 1.00 14.34 H new ATOM 0 HB VAL A 82 -0.658 -5.683 4.303 1.00 43.45 H new ATOM 0 HG11 VAL A 82 -2.869 -6.131 3.312 1.00 72.31 H new ATOM 0 HG12 VAL A 82 -2.725 -4.515 4.044 1.00 72.31 H new ATOM 0 HG13 VAL A 82 -2.664 -4.700 2.275 1.00 72.31 H new ATOM 0 HG21 VAL A 82 -1.004 -7.259 2.369 1.00 32.35 H new ATOM 0 HG22 VAL A 82 -0.548 -5.942 1.262 1.00 32.35 H new ATOM 0 HG23 VAL A 82 0.640 -6.580 2.423 1.00 32.35 H new ATOM 1334 N THR A 83 0.780 -2.798 1.189 1.00 10.01 N ATOM 1335 CA THR A 83 0.630 -1.962 -0.009 1.00 23.44 C ATOM 1336 C THR A 83 1.860 -2.087 -0.899 1.00 13.45 C ATOM 1337 O THR A 83 2.971 -2.194 -0.408 1.00 64.45 O ATOM 1338 CB THR A 83 0.363 -0.497 0.405 1.00 63.52 C ATOM 1339 OG1 THR A 83 -0.128 0.310 -0.644 1.00 33.13 O ATOM 1340 CG2 THR A 83 1.585 0.214 0.993 1.00 73.25 C ATOM 0 H THR A 83 1.742 -3.062 1.401 1.00 10.01 H new ATOM 0 HA THR A 83 -0.226 -2.306 -0.589 1.00 23.44 H new ATOM 0 HB THR A 83 -0.402 -0.605 1.174 1.00 63.52 H new ATOM 0 HG1 THR A 83 -1.102 0.390 -0.567 1.00 33.13 H new ATOM 0 HG21 THR A 83 1.318 1.237 1.259 1.00 73.25 H new ATOM 0 HG22 THR A 83 1.921 -0.317 1.884 1.00 73.25 H new ATOM 0 HG23 THR A 83 2.387 0.229 0.255 1.00 73.25 H new ATOM 1348 N MET A 84 1.695 -2.037 -2.213 1.00 4.15 N ATOM 1349 CA MET A 84 2.785 -1.933 -3.193 1.00 61.13 C ATOM 1350 C MET A 84 3.429 -0.524 -3.101 1.00 62.45 C ATOM 1351 O MET A 84 2.827 0.363 -2.483 1.00 13.42 O ATOM 1352 CB MET A 84 2.175 -2.273 -4.557 1.00 61.54 C ATOM 1353 CG MET A 84 1.197 -1.205 -5.000 1.00 12.25 C ATOM 1354 SD MET A 84 -0.172 -1.818 -5.994 1.00 1.13 S ATOM 1355 CE MET A 84 -1.404 -2.021 -4.679 1.00 24.20 C ATOM 0 H MET A 84 0.773 -2.068 -2.648 1.00 4.15 H new ATOM 0 HA MET A 84 3.604 -2.628 -3.008 1.00 61.13 H new ATOM 0 HB2 MET A 84 2.968 -2.374 -5.298 1.00 61.54 H new ATOM 0 HB3 MET A 84 1.666 -3.235 -4.501 1.00 61.54 H new ATOM 0 HG2 MET A 84 0.795 -0.708 -4.117 1.00 12.25 H new ATOM 0 HG3 MET A 84 1.736 -0.450 -5.572 1.00 12.25 H new ATOM 0 HE1 MET A 84 -2.227 -2.636 -5.043 1.00 24.20 H new ATOM 0 HE2 MET A 84 -0.942 -2.505 -3.819 1.00 24.20 H new ATOM 0 HE3 MET A 84 -1.785 -1.044 -4.383 1.00 24.20 H new ATOM 1365 N PRO A 85 4.623 -0.278 -3.683 1.00 31.45 N ATOM 1366 CA PRO A 85 5.385 0.933 -3.398 1.00 45.24 C ATOM 1367 C PRO A 85 4.623 2.188 -3.825 1.00 62.01 C ATOM 1368 O PRO A 85 4.346 2.389 -5.008 1.00 23.33 O ATOM 1369 CB PRO A 85 6.727 0.779 -4.110 1.00 4.10 C ATOM 1370 CG PRO A 85 6.456 -0.253 -5.199 1.00 73.11 C ATOM 1371 CD PRO A 85 5.374 -1.145 -4.588 1.00 62.04 C ATOM 0 HA PRO A 85 5.546 1.058 -2.327 1.00 45.24 H new ATOM 0 HB2 PRO A 85 7.064 1.725 -4.533 1.00 4.10 H new ATOM 0 HB3 PRO A 85 7.505 0.441 -3.425 1.00 4.10 H new ATOM 0 HG2 PRO A 85 6.114 0.217 -6.121 1.00 73.11 H new ATOM 0 HG3 PRO A 85 7.353 -0.822 -5.445 1.00 73.11 H new ATOM 0 HD2 PRO A 85 4.727 -1.563 -5.359 1.00 62.04 H new ATOM 0 HD3 PRO A 85 5.814 -1.986 -4.052 1.00 62.04 H new ATOM 1379 N ILE A 86 4.251 3.002 -2.837 1.00 71.02 N ATOM 1380 CA ILE A 86 3.444 4.202 -3.003 1.00 11.44 C ATOM 1381 C ILE A 86 4.268 5.179 -3.839 1.00 30.33 C ATOM 1382 O ILE A 86 3.917 5.529 -4.965 1.00 43.42 O ATOM 1383 CB ILE A 86 3.091 4.786 -1.612 1.00 71.34 C ATOM 1384 CG1 ILE A 86 2.437 3.746 -0.678 1.00 4.10 C ATOM 1385 CG2 ILE A 86 2.196 6.029 -1.745 1.00 53.41 C ATOM 1386 CD1 ILE A 86 2.688 4.114 0.779 1.00 42.35 C ATOM 0 H ILE A 86 4.515 2.834 -1.866 1.00 71.02 H new ATOM 0 HA ILE A 86 2.501 3.993 -3.509 1.00 11.44 H new ATOM 0 HB ILE A 86 4.035 5.080 -1.152 1.00 71.34 H new ATOM 0 HG12 ILE A 86 1.365 3.699 -0.869 1.00 4.10 H new ATOM 0 HG13 ILE A 86 2.842 2.755 -0.885 1.00 4.10 H new ATOM 0 HG21 ILE A 86 1.964 6.418 -0.754 1.00 53.41 H new ATOM 0 HG22 ILE A 86 2.718 6.793 -2.322 1.00 53.41 H new ATOM 0 HG23 ILE A 86 1.271 5.759 -2.254 1.00 53.41 H new ATOM 0 HD11 ILE A 86 2.221 3.372 1.427 1.00 42.35 H new ATOM 0 HD12 ILE A 86 3.761 4.138 0.969 1.00 42.35 H new ATOM 0 HD13 ILE A 86 2.261 5.096 0.985 1.00 42.35 H new ATOM 1398 N GLY A 87 5.400 5.604 -3.285 1.00 53.51 N ATOM 1399 CA GLY A 87 6.355 6.446 -3.952 1.00 24.22 C ATOM 1400 C GLY A 87 7.086 5.593 -4.976 1.00 54.03 C ATOM 1401 O GLY A 87 8.182 5.122 -4.713 1.00 14.42 O ATOM 0 H GLY A 87 5.674 5.359 -2.334 1.00 53.51 H new ATOM 0 HA2 GLY A 87 5.853 7.282 -4.439 1.00 24.22 H new ATOM 0 HA3 GLY A 87 7.058 6.870 -3.235 1.00 24.22 H new ATOM 1405 N TYR A 88 6.480 5.394 -6.140 1.00 71.43 N ATOM 1406 CA TYR A 88 7.110 4.918 -7.373 1.00 73.43 C ATOM 1407 C TYR A 88 6.458 5.624 -8.568 1.00 5.03 C ATOM 1408 O TYR A 88 7.128 5.990 -9.528 1.00 71.23 O ATOM 1409 CB TYR A 88 7.017 3.386 -7.460 1.00 52.22 C ATOM 1410 CG TYR A 88 7.845 2.787 -8.586 1.00 42.31 C ATOM 1411 CD1 TYR A 88 7.310 2.736 -9.884 1.00 33.44 C ATOM 1412 CD2 TYR A 88 9.152 2.305 -8.359 1.00 3.23 C ATOM 1413 CE1 TYR A 88 8.058 2.214 -10.947 1.00 71.23 C ATOM 1414 CE2 TYR A 88 9.912 1.771 -9.419 1.00 54.03 C ATOM 1415 CZ TYR A 88 9.368 1.735 -10.725 1.00 52.42 C ATOM 1416 OH TYR A 88 10.079 1.231 -11.769 1.00 24.24 O ATOM 0 H TYR A 88 5.482 5.569 -6.259 1.00 71.43 H new ATOM 0 HA TYR A 88 8.172 5.163 -7.380 1.00 73.43 H new ATOM 0 HB2 TYR A 88 7.343 2.957 -6.513 1.00 52.22 H new ATOM 0 HB3 TYR A 88 5.974 3.101 -7.597 1.00 52.22 H new ATOM 0 HD1 TYR A 88 6.311 3.103 -10.064 1.00 33.44 H new ATOM 0 HD2 TYR A 88 9.573 2.346 -7.365 1.00 3.23 H new ATOM 0 HE1 TYR A 88 7.632 2.178 -11.939 1.00 71.23 H new ATOM 0 HE2 TYR A 88 10.906 1.391 -9.235 1.00 54.03 H new ATOM 0 HH TYR A 88 10.962 0.944 -11.455 1.00 24.24 H new ATOM 1426 N VAL A 89 5.166 5.924 -8.461 1.00 54.14 N ATOM 1427 CA VAL A 89 4.338 6.481 -9.525 1.00 74.33 C ATOM 1428 C VAL A 89 3.880 7.892 -9.161 1.00 44.20 C ATOM 1429 O VAL A 89 4.369 8.852 -9.746 1.00 13.12 O ATOM 1430 CB VAL A 89 3.219 5.525 -9.982 1.00 63.20 C ATOM 1431 CG1 VAL A 89 3.774 4.378 -10.845 1.00 30.42 C ATOM 1432 CG2 VAL A 89 2.479 4.901 -8.807 1.00 34.44 C ATOM 0 H VAL A 89 4.647 5.779 -7.595 1.00 54.14 H new ATOM 0 HA VAL A 89 4.950 6.586 -10.421 1.00 74.33 H new ATOM 0 HB VAL A 89 2.531 6.138 -10.564 1.00 63.20 H new ATOM 0 HG11 VAL A 89 2.957 3.724 -11.149 1.00 30.42 H new ATOM 0 HG12 VAL A 89 4.258 4.790 -11.730 1.00 30.42 H new ATOM 0 HG13 VAL A 89 4.501 3.807 -10.267 1.00 30.42 H new ATOM 0 HG21 VAL A 89 1.700 4.235 -9.179 1.00 34.44 H new ATOM 0 HG22 VAL A 89 3.180 4.333 -8.196 1.00 34.44 H new ATOM 0 HG23 VAL A 89 2.026 5.687 -8.203 1.00 34.44 H new ATOM 1442 N THR A 90 3.053 8.038 -8.123 1.00 71.11 N ATOM 1443 CA THR A 90 2.422 9.286 -7.681 1.00 32.04 C ATOM 1444 C THR A 90 3.426 10.368 -7.223 1.00 20.53 C ATOM 1445 O THR A 90 3.009 11.483 -6.906 1.00 73.24 O ATOM 1446 CB THR A 90 1.357 8.904 -6.624 1.00 32.24 C ATOM 1447 OG1 THR A 90 0.521 9.961 -6.207 1.00 24.44 O ATOM 1448 CG2 THR A 90 1.951 8.252 -5.375 1.00 31.22 C ATOM 0 H THR A 90 2.791 7.246 -7.536 1.00 71.11 H new ATOM 0 HA THR A 90 1.935 9.780 -8.522 1.00 32.04 H new ATOM 0 HB THR A 90 0.745 8.184 -7.167 1.00 32.24 H new ATOM 0 HG1 THR A 90 -0.287 9.594 -5.791 1.00 24.44 H new ATOM 0 HG21 THR A 90 1.151 8.010 -4.676 1.00 31.22 H new ATOM 0 HG22 THR A 90 2.476 7.339 -5.656 1.00 31.22 H new ATOM 0 HG23 THR A 90 2.650 8.942 -4.902 1.00 31.22 H new ATOM 1456 N HIS A 91 4.729 10.061 -7.184 1.00 4.31 N ATOM 1457 CA HIS A 91 5.810 11.010 -6.954 1.00 14.11 C ATOM 1458 C HIS A 91 6.965 10.857 -7.965 1.00 50.51 C ATOM 1459 O HIS A 91 7.966 11.566 -7.855 1.00 13.44 O ATOM 1460 CB HIS A 91 6.314 10.854 -5.510 1.00 72.11 C ATOM 1461 CG HIS A 91 6.628 12.154 -4.814 1.00 51.44 C ATOM 1462 ND1 HIS A 91 6.791 12.310 -3.468 1.00 61.54 N flip ATOM 1463 CD2 HIS A 91 6.859 13.381 -5.398 1.00 14.53 C flip ATOM 1464 CE1 HIS A 91 7.201 13.622 -3.225 1.00 20.23 C flip ATOM 1465 NE2 HIS A 91 7.193 14.236 -4.421 1.00 24.41 N flip ATOM 0 H HIS A 91 5.065 9.107 -7.318 1.00 4.31 H new ATOM 0 HA HIS A 91 5.415 12.015 -7.103 1.00 14.11 H new ATOM 0 HB2 HIS A 91 5.561 10.319 -4.931 1.00 72.11 H new ATOM 0 HB3 HIS A 91 7.210 10.234 -5.516 1.00 72.11 H new ATOM 0 HD2 HIS A 91 6.785 13.611 -6.450 1.00 14.53 H new ATOM 0 HE1 HIS A 91 7.469 14.055 -2.273 1.00 20.23 H new ATOM 0 HE2 HIS A 91 7.412 15.222 -4.566 1.00 24.41 H new ATOM 1473 N GLY A 92 6.857 9.946 -8.941 1.00 23.24 N ATOM 1474 CA GLY A 92 7.900 9.636 -9.914 1.00 11.42 C ATOM 1475 C GLY A 92 9.187 9.153 -9.255 1.00 25.30 C ATOM 1476 O GLY A 92 10.240 9.772 -9.437 1.00 43.44 O ATOM 0 H GLY A 92 6.013 9.390 -9.075 1.00 23.24 H new ATOM 0 HA2 GLY A 92 7.537 8.870 -10.600 1.00 11.42 H new ATOM 0 HA3 GLY A 92 8.112 10.523 -10.510 1.00 11.42 H new ATOM 1480 N PHE A 93 9.115 8.076 -8.468 1.00 21.00 N ATOM 1481 CA PHE A 93 10.300 7.538 -7.792 1.00 13.51 C ATOM 1482 C PHE A 93 10.800 6.293 -8.528 1.00 73.33 C ATOM 1483 O PHE A 93 10.054 5.664 -9.278 1.00 53.32 O ATOM 1484 CB PHE A 93 9.964 7.261 -6.330 1.00 55.23 C ATOM 1485 CG PHE A 93 9.798 8.466 -5.421 1.00 32.22 C ATOM 1486 CD1 PHE A 93 10.133 9.771 -5.829 1.00 60.24 C ATOM 1487 CD2 PHE A 93 9.272 8.271 -4.132 1.00 44.22 C ATOM 1488 CE1 PHE A 93 9.947 10.855 -4.969 1.00 33.25 C ATOM 1489 CE2 PHE A 93 9.033 9.368 -3.291 1.00 22.43 C ATOM 1490 CZ PHE A 93 9.397 10.657 -3.692 1.00 43.31 C ATOM 0 H PHE A 93 8.254 7.561 -8.283 1.00 21.00 H new ATOM 0 HA PHE A 93 11.112 8.265 -7.811 1.00 13.51 H new ATOM 0 HB2 PHE A 93 9.041 6.683 -6.298 1.00 55.23 H new ATOM 0 HB3 PHE A 93 10.750 6.630 -5.915 1.00 55.23 H new ATOM 0 HD1 PHE A 93 10.538 9.935 -6.817 1.00 60.24 H new ATOM 0 HD2 PHE A 93 9.051 7.272 -3.787 1.00 44.22 H new ATOM 0 HE1 PHE A 93 10.227 11.849 -5.287 1.00 33.25 H new ATOM 0 HE2 PHE A 93 8.566 9.216 -2.329 1.00 22.43 H new ATOM 0 HZ PHE A 93 9.256 11.494 -3.025 1.00 43.31 H new ATOM 1500 N ASN A 94 12.060 5.917 -8.297 1.00 72.33 N ATOM 1501 CA ASN A 94 12.626 4.659 -8.786 1.00 62.44 C ATOM 1502 C ASN A 94 12.558 3.610 -7.678 1.00 41.51 C ATOM 1503 O ASN A 94 12.090 3.889 -6.579 1.00 14.41 O ATOM 1504 CB ASN A 94 14.085 4.833 -9.237 1.00 54.41 C ATOM 1505 CG ASN A 94 14.310 5.856 -10.337 1.00 3.31 C ATOM 1506 OD1 ASN A 94 15.353 6.497 -10.361 1.00 20.21 O ATOM 1507 ND2 ASN A 94 13.401 6.018 -11.275 1.00 62.11 N ATOM 0 H ASN A 94 12.720 6.481 -7.762 1.00 72.33 H new ATOM 0 HA ASN A 94 12.043 4.337 -9.649 1.00 62.44 H new ATOM 0 HB2 ASN A 94 14.683 5.118 -8.372 1.00 54.41 H new ATOM 0 HB3 ASN A 94 14.459 3.868 -9.580 1.00 54.41 H new ATOM 0 HD21 ASN A 94 13.562 6.683 -12.032 1.00 62.11 H new ATOM 0 HD22 ASN A 94 12.536 5.479 -11.245 1.00 62.11 H new ATOM 1514 N LEU A 95 13.066 2.406 -7.948 1.00 53.33 N ATOM 1515 CA LEU A 95 12.993 1.239 -7.068 1.00 41.15 C ATOM 1516 C LEU A 95 13.672 1.481 -5.707 1.00 33.21 C ATOM 1517 O LEU A 95 13.222 0.951 -4.693 1.00 33.02 O ATOM 1518 CB LEU A 95 13.609 0.039 -7.834 1.00 73.24 C ATOM 1519 CG LEU A 95 12.958 -1.348 -7.650 1.00 23.44 C ATOM 1520 CD1 LEU A 95 13.350 -2.055 -6.354 1.00 65.40 C ATOM 1521 CD2 LEU A 95 11.432 -1.339 -7.804 1.00 72.51 C ATOM 0 H LEU A 95 13.558 2.210 -8.819 1.00 53.33 H new ATOM 0 HA LEU A 95 11.953 1.027 -6.820 1.00 41.15 H new ATOM 0 HB2 LEU A 95 13.592 0.277 -8.897 1.00 73.24 H new ATOM 0 HB3 LEU A 95 14.656 -0.042 -7.542 1.00 73.24 H new ATOM 0 HG LEU A 95 13.373 -1.927 -8.475 1.00 23.44 H new ATOM 0 HD11 LEU A 95 12.850 -3.022 -6.302 1.00 65.40 H new ATOM 0 HD12 LEU A 95 14.430 -2.203 -6.332 1.00 65.40 H new ATOM 0 HD13 LEU A 95 13.050 -1.445 -5.502 1.00 65.40 H new ATOM 0 HD21 LEU A 95 11.046 -2.348 -7.661 1.00 72.51 H new ATOM 0 HD22 LEU A 95 10.995 -0.675 -7.059 1.00 72.51 H new ATOM 0 HD23 LEU A 95 11.169 -0.988 -8.802 1.00 72.51 H new ATOM 1533 N GLU A 96 14.729 2.296 -5.670 1.00 63.13 N ATOM 1534 CA GLU A 96 15.512 2.575 -4.465 1.00 71.54 C ATOM 1535 C GLU A 96 14.835 3.677 -3.656 1.00 53.45 C ATOM 1536 O GLU A 96 14.637 3.538 -2.454 1.00 52.53 O ATOM 1537 CB GLU A 96 16.904 2.993 -4.923 1.00 72.22 C ATOM 1538 CG GLU A 96 17.842 3.389 -3.780 1.00 11.44 C ATOM 1539 CD GLU A 96 19.280 3.593 -4.264 1.00 65.02 C ATOM 1540 OE1 GLU A 96 19.515 3.613 -5.497 1.00 24.45 O ATOM 1541 OE2 GLU A 96 20.148 3.847 -3.399 1.00 43.30 O ATOM 0 H GLU A 96 15.071 2.790 -6.494 1.00 63.13 H new ATOM 0 HA GLU A 96 15.583 1.699 -3.820 1.00 71.54 H new ATOM 0 HB2 GLU A 96 17.354 2.172 -5.481 1.00 72.22 H new ATOM 0 HB3 GLU A 96 16.812 3.833 -5.612 1.00 72.22 H new ATOM 0 HG2 GLU A 96 17.482 4.307 -3.317 1.00 11.44 H new ATOM 0 HG3 GLU A 96 17.824 2.616 -3.012 1.00 11.44 H new ATOM 1548 N GLU A 97 14.409 4.751 -4.321 1.00 74.01 N ATOM 1549 CA GLU A 97 13.600 5.813 -3.735 1.00 42.11 C ATOM 1550 C GLU A 97 12.340 5.226 -3.102 1.00 62.21 C ATOM 1551 O GLU A 97 12.026 5.513 -1.950 1.00 4.13 O ATOM 1552 CB GLU A 97 13.266 6.834 -4.828 1.00 35.32 C ATOM 1553 CG GLU A 97 14.440 7.765 -5.140 1.00 71.44 C ATOM 1554 CD GLU A 97 14.420 8.976 -4.202 1.00 12.55 C ATOM 1555 OE1 GLU A 97 14.461 8.779 -2.964 1.00 61.01 O ATOM 1556 OE2 GLU A 97 14.315 10.135 -4.657 1.00 4.31 O ATOM 0 H GLU A 97 14.624 4.908 -5.306 1.00 74.01 H new ATOM 0 HA GLU A 97 14.152 6.318 -2.942 1.00 42.11 H new ATOM 0 HB2 GLU A 97 12.974 6.307 -5.736 1.00 35.32 H new ATOM 0 HB3 GLU A 97 12.408 7.429 -4.515 1.00 35.32 H new ATOM 0 HG2 GLU A 97 15.381 7.226 -5.029 1.00 71.44 H new ATOM 0 HG3 GLU A 97 14.384 8.098 -6.176 1.00 71.44 H new ATOM 1563 N ALA A 98 11.673 4.320 -3.812 1.00 14.42 N ATOM 1564 CA ALA A 98 10.508 3.607 -3.327 1.00 1.01 C ATOM 1565 C ALA A 98 10.772 2.831 -2.040 1.00 10.32 C ATOM 1566 O ALA A 98 9.855 2.685 -1.231 1.00 1.21 O ATOM 1567 CB ALA A 98 10.028 2.646 -4.413 1.00 31.42 C ATOM 0 H ALA A 98 11.938 4.059 -4.762 1.00 14.42 H new ATOM 0 HA ALA A 98 9.745 4.350 -3.094 1.00 1.01 H new ATOM 0 HB1 ALA A 98 9.151 2.104 -4.058 1.00 31.42 H new ATOM 0 HB2 ALA A 98 9.768 3.210 -5.309 1.00 31.42 H new ATOM 0 HB3 ALA A 98 10.822 1.937 -4.648 1.00 31.42 H new ATOM 1573 N ALA A 99 11.981 2.302 -1.853 1.00 52.42 N ATOM 1574 CA ALA A 99 12.389 1.621 -0.635 1.00 52.22 C ATOM 1575 C ALA A 99 12.733 2.633 0.458 1.00 22.33 C ATOM 1576 O ALA A 99 12.325 2.449 1.605 1.00 34.02 O ATOM 1577 CB ALA A 99 13.576 0.716 -0.950 1.00 21.42 C ATOM 0 H ALA A 99 12.715 2.338 -2.561 1.00 52.42 H new ATOM 0 HA ALA A 99 11.567 1.010 -0.261 1.00 52.22 H new ATOM 0 HB1 ALA A 99 13.891 0.200 -0.043 1.00 21.42 H new ATOM 0 HB2 ALA A 99 13.285 -0.017 -1.702 1.00 21.42 H new ATOM 0 HB3 ALA A 99 14.402 1.318 -1.330 1.00 21.42 H new ATOM 1583 N ARG A 100 13.446 3.717 0.129 1.00 54.41 N ATOM 1584 CA ARG A 100 13.734 4.812 1.060 1.00 12.33 C ATOM 1585 C ARG A 100 12.425 5.355 1.646 1.00 21.13 C ATOM 1586 O ARG A 100 12.361 5.679 2.831 1.00 41.14 O ATOM 1587 CB ARG A 100 14.499 5.948 0.358 1.00 51.31 C ATOM 1588 CG ARG A 100 15.925 5.614 -0.136 1.00 62.31 C ATOM 1589 CD ARG A 100 16.347 6.598 -1.246 1.00 3.52 C ATOM 1590 NE ARG A 100 17.569 7.365 -0.950 1.00 13.40 N ATOM 1591 CZ ARG A 100 17.772 8.666 -1.204 1.00 10.14 C ATOM 1592 NH1 ARG A 100 16.845 9.433 -1.770 1.00 70.42 N ATOM 1593 NH2 ARG A 100 18.924 9.210 -0.842 1.00 62.04 N ATOM 0 H ARG A 100 13.842 3.859 -0.800 1.00 54.41 H new ATOM 0 HA ARG A 100 14.360 4.421 1.862 1.00 12.33 H new ATOM 0 HB2 ARG A 100 13.910 6.279 -0.497 1.00 51.31 H new ATOM 0 HB3 ARG A 100 14.564 6.791 1.045 1.00 51.31 H new ATOM 0 HG2 ARG A 100 16.628 5.669 0.695 1.00 62.31 H new ATOM 0 HG3 ARG A 100 15.957 4.592 -0.514 1.00 62.31 H new ATOM 0 HD2 ARG A 100 16.498 6.040 -2.170 1.00 3.52 H new ATOM 0 HD3 ARG A 100 15.529 7.296 -1.425 1.00 3.52 H new ATOM 0 HE ARG A 100 18.336 6.857 -0.509 1.00 13.40 H new ATOM 0 HH11 ARG A 100 15.941 9.035 -2.027 1.00 70.42 H new ATOM 0 HH12 ARG A 100 17.037 10.419 -1.947 1.00 70.42 H new ATOM 0 HH21 ARG A 100 19.634 8.641 -0.381 1.00 62.04 H new ATOM 0 HH22 ARG A 100 19.101 10.198 -1.025 1.00 62.04 H new ATOM 1607 N CYS A 101 11.377 5.425 0.833 1.00 41.43 N ATOM 1608 CA CYS A 101 10.041 5.871 1.187 1.00 12.52 C ATOM 1609 C CYS A 101 9.186 4.841 1.930 1.00 44.03 C ATOM 1610 O CYS A 101 8.020 5.123 2.181 1.00 74.31 O ATOM 1611 CB CYS A 101 9.351 6.292 -0.106 1.00 61.42 C ATOM 1612 SG CYS A 101 10.088 7.865 -0.608 1.00 54.43 S ATOM 0 H CYS A 101 11.445 5.155 -0.148 1.00 41.43 H new ATOM 0 HA CYS A 101 10.147 6.693 1.895 1.00 12.52 H new ATOM 0 HB2 CYS A 101 9.488 5.537 -0.880 1.00 61.42 H new ATOM 0 HB3 CYS A 101 8.277 6.400 0.047 1.00 61.42 H new ATOM 0 HG CYS A 101 9.744 8.134 -1.832 1.00 54.43 H new ATOM 1618 N MET A 102 9.711 3.665 2.267 1.00 54.52 N ATOM 1619 CA MET A 102 8.995 2.674 3.064 1.00 42.40 C ATOM 1620 C MET A 102 9.785 2.315 4.320 1.00 71.41 C ATOM 1621 O MET A 102 9.169 2.186 5.377 1.00 42.12 O ATOM 1622 CB MET A 102 8.620 1.459 2.198 1.00 31.31 C ATOM 1623 CG MET A 102 7.629 1.831 1.082 1.00 72.41 C ATOM 1624 SD MET A 102 5.984 2.413 1.586 1.00 54.23 S ATOM 1625 CE MET A 102 5.131 0.825 1.685 1.00 23.43 C ATOM 0 H MET A 102 10.649 3.372 1.993 1.00 54.52 H new ATOM 0 HA MET A 102 8.055 3.099 3.416 1.00 42.40 H new ATOM 0 HB2 MET A 102 9.522 1.037 1.756 1.00 31.31 H new ATOM 0 HB3 MET A 102 8.182 0.685 2.829 1.00 31.31 H new ATOM 0 HG2 MET A 102 8.088 2.607 0.469 1.00 72.41 H new ATOM 0 HG3 MET A 102 7.496 0.957 0.444 1.00 72.41 H new ATOM 0 HE1 MET A 102 4.129 0.975 2.086 1.00 23.43 H new ATOM 0 HE2 MET A 102 5.062 0.387 0.689 1.00 23.43 H new ATOM 0 HE3 MET A 102 5.687 0.153 2.339 1.00 23.43 H new ATOM 1635 N ARG A 103 11.122 2.229 4.251 1.00 53.13 N ATOM 1636 CA ARG A 103 11.980 1.918 5.400 1.00 65.42 C ATOM 1637 C ARG A 103 11.752 2.857 6.602 1.00 53.02 C ATOM 1638 O ARG A 103 11.925 2.452 7.748 1.00 3.12 O ATOM 1639 CB ARG A 103 13.460 1.907 4.960 1.00 32.41 C ATOM 1640 CG ARG A 103 13.981 3.302 4.588 1.00 24.41 C ATOM 1641 CD ARG A 103 15.483 3.370 4.292 1.00 62.23 C ATOM 1642 NE ARG A 103 15.931 4.774 4.156 1.00 42.11 N ATOM 1643 CZ ARG A 103 15.989 5.663 5.160 1.00 13.42 C ATOM 1644 NH1 ARG A 103 15.817 5.290 6.418 1.00 15.13 N ATOM 1645 NH2 ARG A 103 16.206 6.953 4.935 1.00 74.11 N ATOM 0 H ARG A 103 11.642 2.375 3.386 1.00 53.13 H new ATOM 0 HA ARG A 103 11.704 0.924 5.753 1.00 65.42 H new ATOM 0 HB2 ARG A 103 14.071 1.499 5.766 1.00 32.41 H new ATOM 0 HB3 ARG A 103 13.575 1.241 4.105 1.00 32.41 H new ATOM 0 HG2 ARG A 103 13.436 3.656 3.713 1.00 24.41 H new ATOM 0 HG3 ARG A 103 13.754 3.988 5.404 1.00 24.41 H new ATOM 0 HD2 ARG A 103 16.038 2.883 5.094 1.00 62.23 H new ATOM 0 HD3 ARG A 103 15.702 2.824 3.375 1.00 62.23 H new ATOM 0 HE ARG A 103 16.217 5.090 3.229 1.00 42.11 H new ATOM 0 HH11 ARG A 103 15.636 4.311 6.639 1.00 15.13 H new ATOM 0 HH12 ARG A 103 15.865 5.982 7.166 1.00 15.13 H new ATOM 0 HH21 ARG A 103 16.333 7.290 3.981 1.00 74.11 H new ATOM 0 HH22 ARG A 103 16.245 7.607 5.716 1.00 74.11 H new ATOM 1659 N SER A 104 11.386 4.124 6.365 1.00 42.34 N ATOM 1660 CA SER A 104 11.208 5.114 7.427 1.00 14.12 C ATOM 1661 C SER A 104 9.933 4.880 8.251 1.00 64.12 C ATOM 1662 O SER A 104 9.758 5.521 9.293 1.00 14.32 O ATOM 1663 CB SER A 104 11.159 6.521 6.819 1.00 44.44 C ATOM 1664 OG SER A 104 12.276 6.757 5.981 1.00 50.33 O ATOM 0 H SER A 104 11.206 4.488 5.429 1.00 42.34 H new ATOM 0 HA SER A 104 12.059 5.012 8.101 1.00 14.12 H new ATOM 0 HB2 SER A 104 10.240 6.640 6.246 1.00 44.44 H new ATOM 0 HB3 SER A 104 11.136 7.264 7.616 1.00 44.44 H new ATOM 0 HG SER A 104 12.125 6.336 5.109 1.00 50.33 H new ATOM 1670 N LEU A 105 9.027 4.015 7.784 1.00 4.45 N ATOM 1671 CA LEU A 105 7.737 3.771 8.411 1.00 21.10 C ATOM 1672 C LEU A 105 7.966 2.892 9.634 1.00 70.00 C ATOM 1673 O LEU A 105 8.613 1.850 9.546 1.00 21.45 O ATOM 1674 CB LEU A 105 6.787 3.145 7.374 1.00 63.24 C ATOM 1675 CG LEU A 105 5.307 3.528 7.580 1.00 21.01 C ATOM 1676 CD1 LEU A 105 4.566 3.609 6.244 1.00 23.22 C ATOM 1677 CD2 LEU A 105 4.545 2.590 8.479 1.00 42.42 C ATOM 0 H LEU A 105 9.179 3.457 6.943 1.00 4.45 H new ATOM 0 HA LEU A 105 7.263 4.692 8.752 1.00 21.10 H new ATOM 0 HB2 LEU A 105 7.098 3.454 6.376 1.00 63.24 H new ATOM 0 HB3 LEU A 105 6.882 2.060 7.416 1.00 63.24 H new ATOM 0 HG LEU A 105 5.344 4.502 8.068 1.00 21.01 H new ATOM 0 HD11 LEU A 105 3.525 3.881 6.421 1.00 23.22 H new ATOM 0 HD12 LEU A 105 5.036 4.363 5.613 1.00 23.22 H new ATOM 0 HD13 LEU A 105 4.608 2.641 5.745 1.00 23.22 H new ATOM 0 HD21 LEU A 105 3.514 2.931 8.571 1.00 42.42 H new ATOM 0 HD22 LEU A 105 4.559 1.587 8.053 1.00 42.42 H new ATOM 0 HD23 LEU A 105 5.010 2.572 9.465 1.00 42.42 H new ATOM 1689 N LYS A 106 7.490 3.353 10.788 1.00 3.25 N ATOM 1690 CA LYS A 106 7.628 2.668 12.067 1.00 44.35 C ATOM 1691 C LYS A 106 6.931 1.317 12.028 1.00 15.40 C ATOM 1692 O LYS A 106 7.489 0.336 12.506 1.00 31.23 O ATOM 1693 CB LYS A 106 7.015 3.527 13.186 1.00 14.45 C ATOM 1694 CG LYS A 106 7.874 4.722 13.615 1.00 34.43 C ATOM 1695 CD LYS A 106 9.197 4.230 14.212 1.00 3.35 C ATOM 1696 CE LYS A 106 9.735 5.201 15.261 1.00 43.31 C ATOM 1697 NZ LYS A 106 10.824 4.562 16.017 1.00 13.34 N ATOM 0 H LYS A 106 6.985 4.236 10.859 1.00 3.25 H new ATOM 0 HA LYS A 106 8.689 2.512 12.263 1.00 44.35 H new ATOM 0 HB2 LYS A 106 6.044 3.895 12.854 1.00 14.45 H new ATOM 0 HB3 LYS A 106 6.836 2.894 14.055 1.00 14.45 H new ATOM 0 HG2 LYS A 106 8.070 5.366 12.758 1.00 34.43 H new ATOM 0 HG3 LYS A 106 7.336 5.323 14.348 1.00 34.43 H new ATOM 0 HD2 LYS A 106 9.050 3.249 14.664 1.00 3.35 H new ATOM 0 HD3 LYS A 106 9.933 4.108 13.417 1.00 3.35 H new ATOM 0 HE2 LYS A 106 10.098 6.108 14.778 1.00 43.31 H new ATOM 0 HE3 LYS A 106 8.935 5.499 15.939 1.00 43.31 H new ATOM 0 HZ1 LYS A 106 11.188 5.226 16.730 1.00 13.34 H new ATOM 0 HZ2 LYS A 106 10.464 3.709 16.490 1.00 13.34 H new ATOM 0 HZ3 LYS A 106 11.591 4.299 15.366 1.00 13.34 H new ATOM 1711 N ALA A 107 5.706 1.305 11.517 1.00 74.24 N ATOM 1712 CA ALA A 107 4.869 0.131 11.401 1.00 41.42 C ATOM 1713 C ALA A 107 5.306 -0.741 10.213 1.00 14.12 C ATOM 1714 O ALA A 107 5.855 -0.212 9.244 1.00 20.43 O ATOM 1715 CB ALA A 107 3.435 0.626 11.226 1.00 34.14 C ATOM 0 H ALA A 107 5.257 2.148 11.160 1.00 74.24 H new ATOM 0 HA ALA A 107 4.953 -0.495 12.290 1.00 41.42 H new ATOM 0 HB1 ALA A 107 2.764 -0.228 11.134 1.00 34.14 H new ATOM 0 HB2 ALA A 107 3.147 1.222 12.092 1.00 34.14 H new ATOM 0 HB3 ALA A 107 3.369 1.238 10.327 1.00 34.14 H new ATOM 1721 N PRO A 108 5.049 -2.060 10.247 1.00 75.54 N ATOM 1722 CA PRO A 108 5.447 -2.965 9.184 1.00 23.33 C ATOM 1723 C PRO A 108 4.433 -2.946 8.033 1.00 14.31 C ATOM 1724 O PRO A 108 3.437 -3.679 8.037 1.00 41.53 O ATOM 1725 CB PRO A 108 5.576 -4.335 9.847 1.00 42.32 C ATOM 1726 CG PRO A 108 4.534 -4.282 10.964 1.00 71.35 C ATOM 1727 CD PRO A 108 4.526 -2.809 11.380 1.00 63.21 C ATOM 0 HA PRO A 108 6.391 -2.675 8.722 1.00 23.33 H new ATOM 0 HB2 PRO A 108 5.372 -5.143 9.144 1.00 42.32 H new ATOM 0 HB3 PRO A 108 6.579 -4.499 10.240 1.00 42.32 H new ATOM 0 HG2 PRO A 108 3.554 -4.605 10.613 1.00 71.35 H new ATOM 0 HG3 PRO A 108 4.805 -4.932 11.796 1.00 71.35 H new ATOM 0 HD2 PRO A 108 3.517 -2.481 11.630 1.00 63.21 H new ATOM 0 HD3 PRO A 108 5.141 -2.652 12.266 1.00 63.21 H new ATOM 1735 N ALA A 109 4.687 -2.115 7.025 1.00 4.14 N ATOM 1736 CA ALA A 109 4.035 -2.194 5.735 1.00 2.41 C ATOM 1737 C ALA A 109 4.662 -3.367 4.991 1.00 3.22 C ATOM 1738 O ALA A 109 5.832 -3.320 4.607 1.00 14.23 O ATOM 1739 CB ALA A 109 4.212 -0.897 4.944 1.00 71.34 C ATOM 0 H ALA A 109 5.366 -1.356 7.091 1.00 4.14 H new ATOM 0 HA ALA A 109 2.962 -2.340 5.860 1.00 2.41 H new ATOM 0 HB1 ALA A 109 3.711 -0.988 3.980 1.00 71.34 H new ATOM 0 HB2 ALA A 109 3.777 -0.068 5.502 1.00 71.34 H new ATOM 0 HB3 ALA A 109 5.274 -0.710 4.785 1.00 71.34 H new ATOM 1745 N VAL A 110 3.878 -4.416 4.807 1.00 34.43 N ATOM 1746 CA VAL A 110 4.149 -5.500 3.876 1.00 71.41 C ATOM 1747 C VAL A 110 4.007 -4.943 2.459 1.00 33.42 C ATOM 1748 O VAL A 110 2.893 -4.797 1.949 1.00 21.21 O ATOM 1749 CB VAL A 110 3.222 -6.691 4.178 1.00 11.24 C ATOM 1750 CG1 VAL A 110 3.195 -7.782 3.100 1.00 72.02 C ATOM 1751 CG2 VAL A 110 3.727 -7.362 5.452 1.00 74.23 C ATOM 0 H VAL A 110 3.005 -4.541 5.319 1.00 34.43 H new ATOM 0 HA VAL A 110 5.163 -5.886 3.980 1.00 71.41 H new ATOM 0 HB VAL A 110 2.216 -6.277 4.248 1.00 11.24 H new ATOM 0 HG11 VAL A 110 2.514 -8.577 3.404 1.00 72.02 H new ATOM 0 HG12 VAL A 110 2.855 -7.354 2.157 1.00 72.02 H new ATOM 0 HG13 VAL A 110 4.197 -8.192 2.972 1.00 72.02 H new ATOM 0 HG21 VAL A 110 3.089 -8.212 5.693 1.00 74.23 H new ATOM 0 HG22 VAL A 110 4.750 -7.707 5.301 1.00 74.23 H new ATOM 0 HG23 VAL A 110 3.704 -6.646 6.274 1.00 74.23 H new ATOM 1761 N VAL A 111 5.134 -4.585 1.849 1.00 14.21 N ATOM 1762 CA VAL A 111 5.224 -4.079 0.488 1.00 72.42 C ATOM 1763 C VAL A 111 5.734 -5.141 -0.473 1.00 33.12 C ATOM 1764 O VAL A 111 6.838 -5.654 -0.301 1.00 65.34 O ATOM 1765 CB VAL A 111 5.881 -2.678 0.414 1.00 71.42 C ATOM 1766 CG1 VAL A 111 7.136 -2.535 1.263 1.00 32.21 C ATOM 1767 CG2 VAL A 111 6.205 -2.227 -1.016 1.00 23.32 C ATOM 0 H VAL A 111 6.042 -4.643 2.309 1.00 14.21 H new ATOM 0 HA VAL A 111 4.219 -3.874 0.120 1.00 72.42 H new ATOM 0 HB VAL A 111 5.110 -2.027 0.826 1.00 71.42 H new ATOM 0 HG11 VAL A 111 7.535 -1.526 1.156 1.00 32.21 H new ATOM 0 HG12 VAL A 111 6.891 -2.719 2.309 1.00 32.21 H new ATOM 0 HG13 VAL A 111 7.883 -3.257 0.933 1.00 32.21 H new ATOM 0 HG21 VAL A 111 6.663 -1.238 -0.991 1.00 23.32 H new ATOM 0 HG22 VAL A 111 6.896 -2.935 -1.473 1.00 23.32 H new ATOM 0 HG23 VAL A 111 5.287 -2.187 -1.602 1.00 23.32 H new ATOM 1777 N SER A 112 4.881 -5.510 -1.437 1.00 11.34 N ATOM 1778 CA SER A 112 5.242 -6.356 -2.560 1.00 14.43 C ATOM 1779 C SER A 112 6.090 -5.594 -3.572 1.00 13.44 C ATOM 1780 O SER A 112 6.115 -4.363 -3.603 1.00 43.31 O ATOM 1781 CB SER A 112 3.989 -6.897 -3.269 1.00 4.11 C ATOM 1782 OG SER A 112 3.575 -8.102 -2.672 1.00 21.34 O ATOM 0 H SER A 112 3.904 -5.218 -1.450 1.00 11.34 H new ATOM 0 HA SER A 112 5.820 -7.189 -2.160 1.00 14.43 H new ATOM 0 HB2 SER A 112 3.186 -6.162 -3.216 1.00 4.11 H new ATOM 0 HB3 SER A 112 4.202 -7.060 -4.325 1.00 4.11 H new ATOM 0 HG SER A 112 2.736 -7.955 -2.187 1.00 21.34 H new ATOM 1788 N VAL A 113 6.700 -6.361 -4.471 1.00 55.21 N ATOM 1789 CA VAL A 113 7.354 -5.877 -5.678 1.00 13.31 C ATOM 1790 C VAL A 113 6.655 -6.438 -6.920 1.00 53.14 C ATOM 1791 O VAL A 113 5.646 -7.151 -6.824 1.00 75.52 O ATOM 1792 CB VAL A 113 8.844 -6.251 -5.653 1.00 51.14 C ATOM 1793 CG1 VAL A 113 9.621 -5.493 -4.566 1.00 74.12 C ATOM 1794 CG2 VAL A 113 9.038 -7.752 -5.422 1.00 41.05 C ATOM 0 H VAL A 113 6.753 -7.375 -4.373 1.00 55.21 H new ATOM 0 HA VAL A 113 7.280 -4.790 -5.718 1.00 13.31 H new ATOM 0 HB VAL A 113 9.235 -5.968 -6.630 1.00 51.14 H new ATOM 0 HG11 VAL A 113 10.668 -5.794 -4.591 1.00 74.12 H new ATOM 0 HG12 VAL A 113 9.547 -4.421 -4.747 1.00 74.12 H new ATOM 0 HG13 VAL A 113 9.200 -5.726 -3.588 1.00 74.12 H new ATOM 0 HG21 VAL A 113 10.103 -7.984 -5.410 1.00 41.05 H new ATOM 0 HG22 VAL A 113 8.594 -8.033 -4.467 1.00 41.05 H new ATOM 0 HG23 VAL A 113 8.555 -8.309 -6.225 1.00 41.05 H new ATOM 1804 N SER A 114 7.202 -6.130 -8.097 1.00 3.35 N ATOM 1805 CA SER A 114 6.630 -6.452 -9.386 1.00 20.52 C ATOM 1806 C SER A 114 7.058 -7.814 -9.964 1.00 54.23 C ATOM 1807 O SER A 114 6.413 -8.277 -10.908 1.00 71.22 O ATOM 1808 CB SER A 114 6.950 -5.295 -10.346 1.00 55.41 C ATOM 1809 OG SER A 114 8.220 -4.710 -10.087 1.00 52.20 O ATOM 0 H SER A 114 8.088 -5.631 -8.171 1.00 3.35 H new ATOM 0 HA SER A 114 5.554 -6.563 -9.253 1.00 20.52 H new ATOM 0 HB2 SER A 114 6.924 -5.661 -11.372 1.00 55.41 H new ATOM 0 HB3 SER A 114 6.177 -4.531 -10.260 1.00 55.41 H new ATOM 0 HG SER A 114 8.380 -3.981 -10.722 1.00 52.20 H new ATOM 1815 N SER A 115 8.101 -8.455 -9.422 1.00 71.11 N ATOM 1816 CA SER A 115 8.708 -9.666 -9.984 1.00 34.44 C ATOM 1817 C SER A 115 9.250 -10.570 -8.855 1.00 41.13 C ATOM 1818 O SER A 115 9.453 -10.080 -7.743 1.00 32.42 O ATOM 1819 CB SER A 115 9.846 -9.247 -10.927 1.00 62.23 C ATOM 1820 OG SER A 115 9.387 -8.373 -11.944 1.00 4.25 O ATOM 0 H SER A 115 8.554 -8.140 -8.564 1.00 71.11 H new ATOM 0 HA SER A 115 7.959 -10.233 -10.537 1.00 34.44 H new ATOM 0 HB2 SER A 115 10.633 -8.757 -10.353 1.00 62.23 H new ATOM 0 HB3 SER A 115 10.288 -10.134 -11.381 1.00 62.23 H new ATOM 0 HG SER A 115 10.136 -8.125 -12.525 1.00 4.25 H new ATOM 1826 N PRO A 116 9.495 -11.870 -9.102 1.00 62.31 N ATOM 1827 CA PRO A 116 9.876 -12.832 -8.066 1.00 23.12 C ATOM 1828 C PRO A 116 11.279 -12.604 -7.492 1.00 50.02 C ATOM 1829 O PRO A 116 11.426 -12.450 -6.282 1.00 31.35 O ATOM 1830 CB PRO A 116 9.719 -14.218 -8.698 1.00 53.41 C ATOM 1831 CG PRO A 116 9.754 -13.960 -10.200 1.00 22.25 C ATOM 1832 CD PRO A 116 9.152 -12.571 -10.330 1.00 44.33 C ATOM 0 HA PRO A 116 9.231 -12.716 -7.195 1.00 23.12 H new ATOM 0 HB2 PRO A 116 10.523 -14.887 -8.392 1.00 53.41 H new ATOM 0 HB3 PRO A 116 8.782 -14.687 -8.398 1.00 53.41 H new ATOM 0 HG2 PRO A 116 10.771 -13.996 -10.591 1.00 22.25 H new ATOM 0 HG3 PRO A 116 9.175 -14.702 -10.749 1.00 22.25 H new ATOM 0 HD2 PRO A 116 9.553 -12.052 -11.201 1.00 44.33 H new ATOM 0 HD3 PRO A 116 8.071 -12.625 -10.460 1.00 44.33 H new ATOM 1840 N ASP A 117 12.332 -12.521 -8.314 1.00 33.13 N ATOM 1841 CA ASP A 117 13.694 -12.344 -7.778 1.00 2.14 C ATOM 1842 C ASP A 117 13.849 -10.958 -7.129 1.00 62.44 C ATOM 1843 O ASP A 117 14.717 -10.737 -6.282 1.00 44.15 O ATOM 1844 CB ASP A 117 14.729 -12.533 -8.896 1.00 24.15 C ATOM 1845 CG ASP A 117 16.142 -12.705 -8.340 1.00 41.14 C ATOM 1846 OD1 ASP A 117 16.509 -13.850 -7.990 1.00 3.24 O ATOM 1847 OD2 ASP A 117 16.891 -11.705 -8.270 1.00 61.32 O ATOM 0 H ASP A 117 12.275 -12.572 -9.331 1.00 33.13 H new ATOM 0 HA ASP A 117 13.865 -13.098 -7.010 1.00 2.14 H new ATOM 0 HB2 ASP A 117 14.464 -13.406 -9.492 1.00 24.15 H new ATOM 0 HB3 ASP A 117 14.704 -11.672 -9.564 1.00 24.15 H new ATOM 1852 N ALA A 118 12.933 -10.040 -7.449 1.00 52.41 N ATOM 1853 CA ALA A 118 12.960 -8.633 -7.082 1.00 40.11 C ATOM 1854 C ALA A 118 12.646 -8.410 -5.602 1.00 54.51 C ATOM 1855 O ALA A 118 12.861 -7.305 -5.099 1.00 15.43 O ATOM 1856 CB ALA A 118 11.971 -7.876 -7.974 1.00 74.14 C ATOM 0 H ALA A 118 12.110 -10.278 -8.002 1.00 52.41 H new ATOM 0 HA ALA A 118 13.970 -8.253 -7.237 1.00 40.11 H new ATOM 0 HB1 ALA A 118 11.980 -6.818 -7.711 1.00 74.14 H new ATOM 0 HB2 ALA A 118 12.260 -7.992 -9.018 1.00 74.14 H new ATOM 0 HB3 ALA A 118 10.968 -8.278 -7.828 1.00 74.14 H new ATOM 1862 N VAL A 119 12.130 -9.424 -4.907 1.00 33.34 N ATOM 1863 CA VAL A 119 11.755 -9.348 -3.503 1.00 61.32 C ATOM 1864 C VAL A 119 12.996 -8.943 -2.708 1.00 1.22 C ATOM 1865 O VAL A 119 12.984 -7.905 -2.044 1.00 33.41 O ATOM 1866 CB VAL A 119 11.117 -10.686 -3.080 1.00 20.22 C ATOM 1867 CG1 VAL A 119 10.665 -10.698 -1.608 1.00 12.01 C ATOM 1868 CG2 VAL A 119 9.863 -10.972 -3.910 1.00 54.31 C ATOM 0 H VAL A 119 11.959 -10.341 -5.319 1.00 33.34 H new ATOM 0 HA VAL A 119 10.997 -8.590 -3.306 1.00 61.32 H new ATOM 0 HB VAL A 119 11.894 -11.435 -3.235 1.00 20.22 H new ATOM 0 HG11 VAL A 119 10.224 -11.666 -1.371 1.00 12.01 H new ATOM 0 HG12 VAL A 119 11.525 -10.523 -0.962 1.00 12.01 H new ATOM 0 HG13 VAL A 119 9.925 -9.914 -1.448 1.00 12.01 H new ATOM 0 HG21 VAL A 119 9.428 -11.921 -3.596 1.00 54.31 H new ATOM 0 HG22 VAL A 119 9.137 -10.172 -3.760 1.00 54.31 H new ATOM 0 HG23 VAL A 119 10.130 -11.027 -4.965 1.00 54.31 H new ATOM 1878 N THR A 120 14.101 -9.670 -2.847 1.00 1.44 N ATOM 1879 CA THR A 120 15.361 -9.271 -2.245 1.00 45.50 C ATOM 1880 C THR A 120 15.911 -7.974 -2.855 1.00 23.42 C ATOM 1881 O THR A 120 16.447 -7.151 -2.114 1.00 62.54 O ATOM 1882 CB THR A 120 16.329 -10.443 -2.370 1.00 21.03 C ATOM 1883 OG1 THR A 120 15.844 -11.465 -1.517 1.00 64.52 O ATOM 1884 CG2 THR A 120 17.762 -10.079 -1.994 1.00 11.51 C ATOM 0 H THR A 120 14.145 -10.542 -3.375 1.00 1.44 H new ATOM 0 HA THR A 120 15.213 -9.037 -1.191 1.00 45.50 H new ATOM 0 HB THR A 120 16.371 -10.763 -3.411 1.00 21.03 H new ATOM 0 HG1 THR A 120 16.438 -12.243 -1.567 1.00 64.52 H new ATOM 0 HG21 THR A 120 18.401 -10.955 -2.104 1.00 11.51 H new ATOM 0 HG22 THR A 120 18.120 -9.285 -2.649 1.00 11.51 H new ATOM 0 HG23 THR A 120 17.791 -9.736 -0.960 1.00 11.51 H new ATOM 1892 N THR A 121 15.775 -7.747 -4.165 1.00 55.31 N ATOM 1893 CA THR A 121 16.372 -6.586 -4.822 1.00 1.52 C ATOM 1894 C THR A 121 15.843 -5.266 -4.233 1.00 35.11 C ATOM 1895 O THR A 121 16.558 -4.268 -4.265 1.00 74.55 O ATOM 1896 CB THR A 121 16.101 -6.668 -6.335 1.00 21.22 C ATOM 1897 OG1 THR A 121 16.418 -7.955 -6.843 1.00 35.42 O ATOM 1898 CG2 THR A 121 16.831 -5.599 -7.156 1.00 3.22 C ATOM 0 H THR A 121 15.253 -8.358 -4.793 1.00 55.31 H new ATOM 0 HA THR A 121 17.448 -6.597 -4.647 1.00 1.52 H new ATOM 0 HB THR A 121 15.033 -6.478 -6.444 1.00 21.22 H new ATOM 0 HG1 THR A 121 16.235 -7.981 -7.805 1.00 35.42 H new ATOM 0 HG21 THR A 121 16.589 -5.723 -8.212 1.00 3.22 H new ATOM 0 HG22 THR A 121 16.517 -4.609 -6.826 1.00 3.22 H new ATOM 0 HG23 THR A 121 17.907 -5.704 -7.015 1.00 3.22 H new ATOM 1906 N TYR A 122 14.621 -5.233 -3.689 1.00 11.43 N ATOM 1907 CA TYR A 122 14.101 -4.054 -2.998 1.00 40.45 C ATOM 1908 C TYR A 122 14.688 -3.976 -1.580 1.00 1.23 C ATOM 1909 O TYR A 122 15.120 -2.907 -1.159 1.00 63.32 O ATOM 1910 CB TYR A 122 12.569 -4.122 -3.040 1.00 52.21 C ATOM 1911 CG TYR A 122 11.782 -2.965 -2.439 1.00 22.25 C ATOM 1912 CD1 TYR A 122 11.393 -2.976 -1.083 1.00 41.14 C ATOM 1913 CD2 TYR A 122 11.345 -1.912 -3.269 1.00 11.20 C ATOM 1914 CE1 TYR A 122 10.532 -1.982 -0.584 1.00 23.41 C ATOM 1915 CE2 TYR A 122 10.508 -0.901 -2.767 1.00 52.15 C ATOM 1916 CZ TYR A 122 10.080 -0.945 -1.424 1.00 45.33 C ATOM 1917 OH TYR A 122 9.244 0.005 -0.930 1.00 71.03 O ATOM 0 H TYR A 122 13.971 -6.018 -3.716 1.00 11.43 H new ATOM 0 HA TYR A 122 14.403 -3.128 -3.487 1.00 40.45 H new ATOM 0 HB2 TYR A 122 12.268 -4.223 -4.083 1.00 52.21 H new ATOM 0 HB3 TYR A 122 12.262 -5.035 -2.530 1.00 52.21 H new ATOM 0 HD1 TYR A 122 11.758 -3.751 -0.425 1.00 41.14 H new ATOM 0 HD2 TYR A 122 11.657 -1.882 -4.302 1.00 11.20 H new ATOM 0 HE1 TYR A 122 10.216 -2.014 0.448 1.00 23.41 H new ATOM 0 HE2 TYR A 122 10.193 -0.091 -3.409 1.00 52.15 H new ATOM 0 HH TYR A 122 9.668 0.885 -1.007 1.00 71.03 H new ATOM 1927 N ASN A 123 14.785 -5.102 -0.862 1.00 45.11 N ATOM 1928 CA ASN A 123 15.202 -5.165 0.547 1.00 63.02 C ATOM 1929 C ASN A 123 16.673 -4.779 0.686 1.00 4.32 C ATOM 1930 O ASN A 123 17.089 -4.311 1.743 1.00 61.43 O ATOM 1931 CB ASN A 123 15.055 -6.595 1.137 1.00 70.10 C ATOM 1932 CG ASN A 123 13.874 -6.792 2.085 1.00 20.33 C ATOM 1933 OD1 ASN A 123 13.348 -5.853 2.678 1.00 60.11 O ATOM 1934 ND2 ASN A 123 13.411 -8.023 2.255 1.00 61.12 N ATOM 0 H ASN A 123 14.570 -6.019 -1.254 1.00 45.11 H new ATOM 0 HA ASN A 123 14.554 -4.474 1.086 1.00 63.02 H new ATOM 0 HB2 ASN A 123 14.960 -7.302 0.313 1.00 70.10 H new ATOM 0 HB3 ASN A 123 15.972 -6.847 1.669 1.00 70.10 H new ATOM 0 HD21 ASN A 123 12.620 -8.189 2.877 1.00 61.12 H new ATOM 0 HD22 ASN A 123 13.846 -8.804 1.764 1.00 61.12 H new ATOM 1941 N GLY A 124 17.484 -4.969 -0.358 1.00 51.42 N ATOM 1942 CA GLY A 124 18.836 -4.435 -0.413 1.00 31.11 C ATOM 1943 C GLY A 124 18.828 -2.946 -0.078 1.00 24.13 C ATOM 1944 O GLY A 124 19.551 -2.514 0.816 1.00 41.14 O ATOM 0 H GLY A 124 17.216 -5.499 -1.187 1.00 51.42 H new ATOM 0 HA2 GLY A 124 19.475 -4.970 0.290 1.00 31.11 H new ATOM 0 HA3 GLY A 124 19.256 -4.589 -1.407 1.00 31.11 H new ATOM 1948 N TYR A 125 17.959 -2.165 -0.717 1.00 12.32 N ATOM 1949 CA TYR A 125 17.890 -0.735 -0.464 1.00 12.54 C ATOM 1950 C TYR A 125 17.396 -0.395 0.943 1.00 0.32 C ATOM 1951 O TYR A 125 17.669 0.712 1.416 1.00 64.43 O ATOM 1952 CB TYR A 125 16.991 -0.061 -1.497 1.00 60.30 C ATOM 1953 CG TYR A 125 17.380 -0.294 -2.940 1.00 23.43 C ATOM 1954 CD1 TYR A 125 18.658 0.073 -3.400 1.00 4.44 C ATOM 1955 CD2 TYR A 125 16.447 -0.856 -3.829 1.00 0.43 C ATOM 1956 CE1 TYR A 125 19.008 -0.120 -4.745 1.00 2.10 C ATOM 1957 CE2 TYR A 125 16.795 -1.061 -5.172 1.00 55.12 C ATOM 1958 CZ TYR A 125 18.078 -0.699 -5.632 1.00 23.14 C ATOM 1959 OH TYR A 125 18.405 -0.879 -6.937 1.00 4.33 O ATOM 0 H TYR A 125 17.294 -2.503 -1.413 1.00 12.32 H new ATOM 0 HA TYR A 125 18.909 -0.358 -0.545 1.00 12.54 H new ATOM 0 HB2 TYR A 125 15.970 -0.413 -1.351 1.00 60.30 H new ATOM 0 HB3 TYR A 125 16.988 1.012 -1.307 1.00 60.30 H new ATOM 0 HD1 TYR A 125 19.373 0.505 -2.715 1.00 4.44 H new ATOM 0 HD2 TYR A 125 15.463 -1.130 -3.478 1.00 0.43 H new ATOM 0 HE1 TYR A 125 19.985 0.174 -5.099 1.00 2.10 H new ATOM 0 HE2 TYR A 125 16.080 -1.496 -5.854 1.00 55.12 H new ATOM 0 HH TYR A 125 17.652 -1.291 -7.409 1.00 4.33 H new ATOM 1969 N LEU A 126 16.681 -1.306 1.617 1.00 41.02 N ATOM 1970 CA LEU A 126 16.316 -1.129 3.012 1.00 43.42 C ATOM 1971 C LEU A 126 17.518 -1.306 3.936 1.00 24.13 C ATOM 1972 O LEU A 126 17.571 -0.653 4.980 1.00 55.45 O ATOM 1973 CB LEU A 126 15.201 -2.100 3.443 1.00 4.24 C ATOM 1974 CG LEU A 126 13.824 -1.601 2.994 1.00 1.25 C ATOM 1975 CD1 LEU A 126 13.360 -2.087 1.639 1.00 23.20 C ATOM 1976 CD2 LEU A 126 12.754 -1.909 4.027 1.00 43.14 C ATOM 0 H LEU A 126 16.346 -2.177 1.206 1.00 41.02 H new ATOM 0 HA LEU A 126 15.946 -0.108 3.100 1.00 43.42 H new ATOM 0 HB2 LEU A 126 15.390 -3.086 3.017 1.00 4.24 H new ATOM 0 HB3 LEU A 126 15.213 -2.213 4.527 1.00 4.24 H new ATOM 0 HG LEU A 126 13.966 -0.525 2.896 1.00 1.25 H new ATOM 0 HD11 LEU A 126 12.375 -1.674 1.422 1.00 23.20 H new ATOM 0 HD12 LEU A 126 14.066 -1.763 0.875 1.00 23.20 H new ATOM 0 HD13 LEU A 126 13.304 -3.176 1.643 1.00 23.20 H new ATOM 0 HD21 LEU A 126 11.791 -1.540 3.674 1.00 43.14 H new ATOM 0 HD22 LEU A 126 12.696 -2.987 4.181 1.00 43.14 H new ATOM 0 HD23 LEU A 126 13.006 -1.421 4.969 1.00 43.14 H new ATOM 1988 N THR A 127 18.438 -2.219 3.611 1.00 43.32 N ATOM 1989 CA THR A 127 19.366 -2.766 4.596 1.00 44.24 C ATOM 1990 C THR A 127 20.572 -3.424 3.892 1.00 13.13 C ATOM 1991 O THR A 127 20.790 -4.641 3.913 1.00 72.40 O ATOM 1992 CB THR A 127 18.573 -3.638 5.605 1.00 55.32 C ATOM 1993 OG1 THR A 127 19.400 -4.135 6.639 1.00 34.43 O ATOM 1994 CG2 THR A 127 17.780 -4.796 4.979 1.00 22.34 C ATOM 0 H THR A 127 18.557 -2.594 2.670 1.00 43.32 H new ATOM 0 HA THR A 127 19.829 -1.989 5.204 1.00 44.24 H new ATOM 0 HB THR A 127 17.837 -2.949 6.019 1.00 55.32 H new ATOM 0 HG1 THR A 127 18.864 -4.678 7.254 1.00 34.43 H new ATOM 0 HG21 THR A 127 17.260 -5.347 5.763 1.00 22.34 H new ATOM 0 HG22 THR A 127 17.053 -4.398 4.271 1.00 22.34 H new ATOM 0 HG23 THR A 127 18.464 -5.466 4.458 1.00 22.34 H new ATOM 2002 N SER A 128 21.397 -2.593 3.265 1.00 31.42 N ATOM 2003 CA SER A 128 22.659 -2.929 2.631 1.00 54.51 C ATOM 2004 C SER A 128 23.633 -1.871 3.125 1.00 22.32 C ATOM 2005 O SER A 128 23.569 -0.714 2.701 1.00 22.30 O ATOM 2006 CB SER A 128 22.459 -2.918 1.111 1.00 13.01 C ATOM 2007 OG SER A 128 23.630 -3.195 0.363 1.00 13.02 O ATOM 0 H SER A 128 21.183 -1.599 3.183 1.00 31.42 H new ATOM 0 HA SER A 128 23.040 -3.921 2.875 1.00 54.51 H new ATOM 0 HB2 SER A 128 21.696 -3.652 0.852 1.00 13.01 H new ATOM 0 HB3 SER A 128 22.076 -1.941 0.815 1.00 13.01 H new ATOM 0 HG SER A 128 23.420 -3.171 -0.594 1.00 13.02 H new ATOM 2013 N SER A 129 24.447 -2.218 4.119 1.00 21.43 N ATOM 2014 CA SER A 129 25.564 -1.389 4.527 1.00 61.24 C ATOM 2015 C SER A 129 26.570 -1.423 3.392 1.00 5.54 C ATOM 2016 O SER A 129 26.689 -0.376 2.720 1.00 72.34 O ATOM 2017 CB SER A 129 26.106 -1.860 5.864 1.00 63.42 C ATOM 2018 OG SER A 129 25.074 -1.749 6.842 1.00 55.00 O ATOM 0 H SER A 129 24.347 -3.078 4.658 1.00 21.43 H new ATOM 0 HA SER A 129 25.278 -0.351 4.698 1.00 61.24 H new ATOM 0 HB2 SER A 129 26.447 -2.893 5.791 1.00 63.42 H new ATOM 0 HB3 SER A 129 26.968 -1.259 6.155 1.00 63.42 H new ATOM 0 HG SER A 129 25.412 -2.052 7.710 1.00 55.00 H new TER 2024 SER A 129