USER MOD reduce.3.24.130724 H: found=0, std=0, add=1286, rem=0, adj=53 USER MOD reduce.3.24.130724 removed 1286 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 143 ASN : amide:sc=-0.00848 X(o=-1.1,f=-1.1) USER MOD Set 1.2: A 147 ASN : amide:sc= -1.06 X(o=-1.1,f=-1.3!) USER MOD Set 2.1: A 17 SER OG : rot 77:sc= 1.2 USER MOD Set 2.2: A 115 LYS NZ :NH3+ -166:sc= 0.665 (180deg=-0.226) USER MOD Set 3.1: A 104 HIS : +bothHN:sc= 0.73 K(o=0.24,f=-5) USER MOD Set 3.2: A 123 THR OG1 : rot 160:sc= -0.486 USER MOD Set 4.1: A 66 MET CE :methyl 159:sc= -0.0771 (180deg=-0.446) USER MOD Set 4.2: A 68 SER OG : rot 26:sc= 0.119 USER MOD Set 5.1: A 47 TYR OH : rot 74:sc= 0.629 USER MOD Set 5.2: A 69 TYR OH : rot 166:sc= 0.00896 USER MOD Set 6.1: A 28 THR OG1 : rot -76:sc= -1.36! USER MOD Set 6.2: A 29 LYS NZ :NH3+ -175:sc= 0.682 (180deg=0.664) USER MOD Set 7.1: A 15 THR OG1 : rot -77:sc= 0.394 USER MOD Set 7.2: A 117 THR OG1 : rot 180:sc= 0.368 USER MOD Set 8.1: A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 8.2: A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 9.1: A 7 LYS NZ :NH3+ -170:sc= 0.624 (180deg=0) USER MOD Set 9.2: A 128 SER OG : rot 140:sc= 0.556 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ 146:sc= 0.461 (180deg=0.11) USER MOD Single : A 8 ASN : amide:sc=-0.00614 X(o=-0.0061,f=0) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 ASN : amide:sc= -0.126 K(o=-0.13,f=-2.6!) USER MOD Single : A 22 LYS NZ :NH3+ -125:sc= 1.22 (180deg=-0.585) USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 GLN : amide:sc= 0.253 X(o=0.25,f=-0.0038) USER MOD Single : A 38 HIS : no HD1:sc= 0.112 K(o=0.13,f=-1.3) USER MOD Single : A 40 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 50 ASN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : A 52 THR OG1 : rot 180:sc= -0.105 USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 SER OG : rot 106:sc= 0.417 USER MOD Single : A 59 TYR OH : rot -126:sc= 0.011 USER MOD Single : A 62 GLN : amide:sc= -0.465 X(o=-0.47,f=-0.31) USER MOD Single : A 65 GLN : amide:sc= 0 K(o=0,f=-0.71) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 TYR OH : rot 79:sc= 0.798 USER MOD Single : A 76 GLN :FLIP amide:sc= -0.148 F(o=-2.1!,f=-0.15) USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 THR OG1 : rot -37:sc= 0.693 USER MOD Single : A 92 SER OG : rot 89:sc= 0.032 USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 LYS NZ :NH3+ -150:sc= 0.00384 (180deg=-0.529) USER MOD Single : A 98 THR OG1 : rot -16:sc= 0.779 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 100 MET CE :methyl -162:sc= -0.144 (180deg=-0.596) USER MOD Single : A 103 MET CE :methyl 173:sc= -0.239 (180deg=-0.384) USER MOD Single : A 106 THR OG1 : rot -18:sc= 0.0844 USER MOD Single : A 108 ASN : amide:sc= -0.173 X(o=-0.17,f=-0.28!) USER MOD Single : A 113 LYS NZ :NH3+ 171:sc= 0.146 (180deg=0.127) USER MOD Single : A 116 THR OG1 : rot 66:sc= 1.01 USER MOD Single : A 119 THR OG1 : rot 180:sc= -0.132 USER MOD Single : A 120 SER OG : rot 40:sc= -1.26! USER MOD Single : A 121 THR OG1 : rot 180:sc= 0 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 126 THR OG1 : rot 180:sc= 0.166 USER MOD Single : A 131 GLN : amide:sc= -0.43 K(o=-0.43,f=-1.4) USER MOD Single : A 132 GLN : amide:sc= 0 X(o=0,f=-0.18) USER MOD Single : A 136 MET CE :methyl 163:sc= -0.0935 (180deg=-0.492) USER MOD Single : A 140 THR OG1 : rot 180:sc= 0 USER MOD Single : A 142 MET CE :methyl -118:sc= -2.16 (180deg=-2.34) USER MOD Single : A 144 SER OG : rot 180:sc= 0 USER MOD Single : A 145 THR OG1 : rot 80:sc= 0.773 USER MOD Single : A 148 GLN : amide:sc= -0.301 X(o=-0.3,f=-0.18) USER MOD Single : A 151 LYS NZ :NH3+ -172:sc= 0.349 (180deg=0.298) USER MOD Single : A 154 ASN :FLIP amide:sc= -0.73 F(o=-2.1!,f=-0.73) USER MOD Single : A 155 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 156 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 159 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 160 HIS : no HD1:sc=-0.00659 X(o=-0.0066,f=0) USER MOD Single : A 161 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 162 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 163 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 164 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -2.445 -20.203 -3.029 1.00 15.44 N ATOM 2 CA MET A 1 -2.042 -18.971 -2.300 1.00 33.43 C ATOM 3 C MET A 1 -0.546 -19.036 -1.874 1.00 32.22 C ATOM 4 O MET A 1 -0.186 -19.651 -0.867 1.00 1.44 O ATOM 5 CB MET A 1 -2.992 -18.720 -1.083 1.00 52.10 C ATOM 6 CG MET A 1 -3.109 -19.888 -0.090 1.00 44.05 C ATOM 7 SD MET A 1 -4.103 -19.475 1.361 1.00 4.31 S ATOM 8 CE MET A 1 -3.876 -20.940 2.376 1.00 22.02 C ATOM 0 H1 MET A 1 -3.446 -20.133 -3.301 1.00 15.44 H new ATOM 0 H2 MET A 1 -1.861 -20.308 -3.883 1.00 15.44 H new ATOM 0 H3 MET A 1 -2.310 -21.030 -2.413 1.00 15.44 H new ATOM 0 HA MET A 1 -2.141 -18.120 -2.974 1.00 33.43 H new ATOM 0 HB2 MET A 1 -2.641 -17.840 -0.544 1.00 52.10 H new ATOM 0 HB3 MET A 1 -3.987 -18.486 -1.462 1.00 52.10 H new ATOM 0 HG2 MET A 1 -3.552 -20.746 -0.596 1.00 44.05 H new ATOM 0 HG3 MET A 1 -2.111 -20.187 0.232 1.00 44.05 H new ATOM 0 HE1 MET A 1 -4.433 -20.828 3.306 1.00 22.02 H new ATOM 0 HE2 MET A 1 -4.240 -21.815 1.838 1.00 22.02 H new ATOM 0 HE3 MET A 1 -2.817 -21.067 2.600 1.00 22.02 H new ATOM 20 N THR A 2 0.327 -18.423 -2.688 1.00 34.41 N ATOM 21 CA THR A 2 1.786 -18.347 -2.417 1.00 63.13 C ATOM 22 C THR A 2 2.437 -17.296 -3.335 1.00 64.51 C ATOM 23 O THR A 2 2.118 -17.218 -4.529 1.00 14.35 O ATOM 24 CB THR A 2 2.524 -19.730 -2.575 1.00 75.13 C ATOM 25 OG1 THR A 2 3.933 -19.569 -2.333 1.00 51.03 O ATOM 26 CG2 THR A 2 2.310 -20.370 -3.959 1.00 13.51 C ATOM 0 H THR A 2 0.049 -17.963 -3.555 1.00 34.41 H new ATOM 0 HA THR A 2 1.894 -18.054 -1.373 1.00 63.13 H new ATOM 0 HB THR A 2 2.088 -20.403 -1.836 1.00 75.13 H new ATOM 0 HG1 THR A 2 4.383 -20.434 -2.432 1.00 51.03 H new ATOM 0 HG21 THR A 2 2.843 -21.320 -4.007 1.00 13.51 H new ATOM 0 HG22 THR A 2 1.246 -20.542 -4.120 1.00 13.51 H new ATOM 0 HG23 THR A 2 2.690 -19.702 -4.732 1.00 13.51 H new ATOM 34 N ILE A 3 3.332 -16.467 -2.764 1.00 23.44 N ATOM 35 CA ILE A 3 3.997 -15.365 -3.498 1.00 72.23 C ATOM 36 C ILE A 3 5.542 -15.462 -3.403 1.00 72.11 C ATOM 37 O ILE A 3 6.080 -16.182 -2.551 1.00 71.41 O ATOM 38 CB ILE A 3 3.459 -13.963 -2.995 1.00 21.43 C ATOM 39 CG1 ILE A 3 3.751 -13.709 -1.464 1.00 41.34 C ATOM 40 CG2 ILE A 3 1.948 -13.820 -3.310 1.00 74.53 C ATOM 41 CD1 ILE A 3 4.990 -12.879 -1.176 1.00 3.41 C ATOM 0 H ILE A 3 3.615 -16.539 -1.787 1.00 23.44 H new ATOM 0 HA ILE A 3 3.746 -15.460 -4.554 1.00 72.23 H new ATOM 0 HB ILE A 3 4.006 -13.194 -3.541 1.00 21.43 H new ATOM 0 HG12 ILE A 3 2.888 -13.211 -1.023 1.00 41.34 H new ATOM 0 HG13 ILE A 3 3.853 -14.672 -0.964 1.00 41.34 H new ATOM 0 HG21 ILE A 3 1.593 -12.851 -2.958 1.00 74.53 H new ATOM 0 HG22 ILE A 3 1.792 -13.895 -4.386 1.00 74.53 H new ATOM 0 HG23 ILE A 3 1.395 -14.613 -2.807 1.00 74.53 H new ATOM 0 HD11 ILE A 3 5.106 -12.760 -0.099 1.00 3.41 H new ATOM 0 HD12 ILE A 3 5.868 -13.382 -1.582 1.00 3.41 H new ATOM 0 HD13 ILE A 3 4.887 -11.898 -1.641 1.00 3.41 H new ATOM 53 N GLU A 4 6.244 -14.710 -4.271 1.00 35.14 N ATOM 54 CA GLU A 4 7.707 -14.859 -4.483 1.00 31.45 C ATOM 55 C GLU A 4 8.519 -13.839 -3.650 1.00 22.00 C ATOM 56 O GLU A 4 8.114 -12.691 -3.505 1.00 60.03 O ATOM 57 CB GLU A 4 8.017 -14.695 -5.994 1.00 73.15 C ATOM 58 CG GLU A 4 9.476 -14.988 -6.411 1.00 12.42 C ATOM 59 CD GLU A 4 9.713 -14.797 -7.922 1.00 25.44 C ATOM 60 OE1 GLU A 4 9.221 -15.629 -8.721 1.00 61.52 O ATOM 61 OE2 GLU A 4 10.367 -13.811 -8.325 1.00 20.34 O ATOM 0 H GLU A 4 5.820 -13.982 -4.846 1.00 35.14 H new ATOM 0 HA GLU A 4 8.005 -15.852 -4.147 1.00 31.45 H new ATOM 0 HB2 GLU A 4 7.357 -15.356 -6.556 1.00 73.15 H new ATOM 0 HB3 GLU A 4 7.772 -13.675 -6.288 1.00 73.15 H new ATOM 0 HG2 GLU A 4 10.147 -14.332 -5.856 1.00 12.42 H new ATOM 0 HG3 GLU A 4 9.730 -16.011 -6.134 1.00 12.42 H new ATOM 68 N LYS A 5 9.650 -14.299 -3.068 1.00 30.51 N ATOM 69 CA LYS A 5 10.592 -13.449 -2.292 1.00 75.31 C ATOM 70 C LYS A 5 12.050 -13.741 -2.741 1.00 53.52 C ATOM 71 O LYS A 5 12.447 -14.904 -2.857 1.00 41.20 O ATOM 72 CB LYS A 5 10.485 -13.703 -0.757 1.00 71.14 C ATOM 73 CG LYS A 5 9.101 -13.461 -0.087 1.00 12.33 C ATOM 74 CD LYS A 5 8.076 -14.601 -0.294 1.00 1.13 C ATOM 75 CE LYS A 5 8.563 -15.973 0.204 1.00 21.44 C ATOM 76 NZ LYS A 5 7.526 -17.016 0.002 1.00 42.43 N ATOM 0 H LYS A 5 9.940 -15.276 -3.122 1.00 30.51 H new ATOM 0 HA LYS A 5 10.325 -12.410 -2.487 1.00 75.31 H new ATOM 0 HB2 LYS A 5 10.776 -14.736 -0.565 1.00 71.14 H new ATOM 0 HB3 LYS A 5 11.217 -13.067 -0.258 1.00 71.14 H new ATOM 0 HG2 LYS A 5 9.251 -13.315 0.983 1.00 12.33 H new ATOM 0 HG3 LYS A 5 8.679 -12.536 -0.479 1.00 12.33 H new ATOM 0 HD2 LYS A 5 7.152 -14.344 0.224 1.00 1.13 H new ATOM 0 HD3 LYS A 5 7.837 -14.674 -1.355 1.00 1.13 H new ATOM 0 HE2 LYS A 5 9.473 -16.253 -0.327 1.00 21.44 H new ATOM 0 HE3 LYS A 5 8.818 -15.910 1.262 1.00 21.44 H new ATOM 0 HZ1 LYS A 5 7.984 -17.923 -0.217 1.00 42.43 H new ATOM 0 HZ2 LYS A 5 6.959 -17.115 0.869 1.00 42.43 H new ATOM 0 HZ3 LYS A 5 6.907 -16.742 -0.787 1.00 42.43 H new ATOM 90 N LYS A 6 12.844 -12.677 -2.970 1.00 33.01 N ATOM 91 CA LYS A 6 14.251 -12.772 -3.434 1.00 64.01 C ATOM 92 C LYS A 6 15.145 -11.755 -2.666 1.00 2.22 C ATOM 93 O LYS A 6 15.359 -10.632 -3.141 1.00 3.11 O ATOM 94 CB LYS A 6 14.363 -12.514 -4.974 1.00 11.52 C ATOM 95 CG LYS A 6 13.414 -13.352 -5.873 1.00 23.14 C ATOM 96 CD LYS A 6 13.744 -13.232 -7.381 1.00 43.35 C ATOM 97 CE LYS A 6 13.713 -11.783 -7.884 1.00 70.13 C ATOM 98 NZ LYS A 6 14.020 -11.696 -9.332 1.00 33.40 N ATOM 0 H LYS A 6 12.528 -11.716 -2.838 1.00 33.01 H new ATOM 0 HA LYS A 6 14.598 -13.785 -3.230 1.00 64.01 H new ATOM 0 HB2 LYS A 6 14.170 -11.458 -5.161 1.00 11.52 H new ATOM 0 HB3 LYS A 6 15.390 -12.710 -5.282 1.00 11.52 H new ATOM 0 HG2 LYS A 6 13.473 -14.399 -5.576 1.00 23.14 H new ATOM 0 HG3 LYS A 6 12.386 -13.030 -5.705 1.00 23.14 H new ATOM 0 HD2 LYS A 6 14.731 -13.655 -7.567 1.00 43.35 H new ATOM 0 HD3 LYS A 6 13.030 -13.825 -7.953 1.00 43.35 H new ATOM 0 HE2 LYS A 6 12.729 -11.353 -7.695 1.00 70.13 H new ATOM 0 HE3 LYS A 6 14.434 -11.188 -7.323 1.00 70.13 H new ATOM 0 HZ1 LYS A 6 13.989 -10.701 -9.634 1.00 33.40 H new ATOM 0 HZ2 LYS A 6 14.969 -12.083 -9.510 1.00 33.40 H new ATOM 0 HZ3 LYS A 6 13.317 -12.243 -9.869 1.00 33.40 H new ATOM 112 N LYS A 7 15.612 -12.160 -1.460 1.00 41.33 N ATOM 113 CA LYS A 7 16.567 -11.390 -0.606 1.00 73.42 C ATOM 114 C LYS A 7 16.030 -10.003 -0.150 1.00 12.34 C ATOM 115 O LYS A 7 15.662 -9.827 1.017 1.00 13.31 O ATOM 116 CB LYS A 7 17.961 -11.256 -1.298 1.00 53.34 C ATOM 117 CG LYS A 7 18.783 -12.573 -1.454 1.00 74.43 C ATOM 118 CD LYS A 7 19.525 -13.022 -0.155 1.00 3.02 C ATOM 119 CE LYS A 7 18.628 -13.707 0.905 1.00 43.01 C ATOM 120 NZ LYS A 7 19.379 -14.035 2.142 1.00 14.24 N ATOM 0 H LYS A 7 15.334 -13.047 -1.040 1.00 41.33 H new ATOM 0 HA LYS A 7 16.683 -11.975 0.306 1.00 73.42 H new ATOM 0 HB2 LYS A 7 17.812 -10.826 -2.288 1.00 53.34 H new ATOM 0 HB3 LYS A 7 18.559 -10.544 -0.729 1.00 53.34 H new ATOM 0 HG2 LYS A 7 18.112 -13.372 -1.770 1.00 74.43 H new ATOM 0 HG3 LYS A 7 19.516 -12.439 -2.250 1.00 74.43 H new ATOM 0 HD2 LYS A 7 20.326 -13.708 -0.430 1.00 3.02 H new ATOM 0 HD3 LYS A 7 19.995 -12.149 0.298 1.00 3.02 H new ATOM 0 HE2 LYS A 7 17.793 -13.051 1.151 1.00 43.01 H new ATOM 0 HE3 LYS A 7 18.204 -14.619 0.486 1.00 43.01 H new ATOM 0 HZ1 LYS A 7 18.793 -14.639 2.754 1.00 14.24 H new ATOM 0 HZ2 LYS A 7 20.254 -14.539 1.894 1.00 14.24 H new ATOM 0 HZ3 LYS A 7 19.617 -13.157 2.647 1.00 14.24 H new ATOM 134 N ASN A 8 16.023 -9.019 -1.067 1.00 33.02 N ATOM 135 CA ASN A 8 15.552 -7.636 -0.799 1.00 41.55 C ATOM 136 C ASN A 8 14.429 -7.226 -1.793 1.00 32.10 C ATOM 137 O ASN A 8 14.309 -6.063 -2.172 1.00 54.42 O ATOM 138 CB ASN A 8 16.761 -6.669 -0.859 1.00 62.45 C ATOM 139 CG ASN A 8 17.429 -6.621 -2.235 1.00 61.25 C ATOM 140 OD1 ASN A 8 18.277 -7.448 -2.558 1.00 73.45 O ATOM 141 ND2 ASN A 8 17.068 -5.647 -3.048 1.00 25.34 N ATOM 0 H ASN A 8 16.346 -9.156 -2.025 1.00 33.02 H new ATOM 0 HA ASN A 8 15.116 -7.586 0.199 1.00 41.55 H new ATOM 0 HB2 ASN A 8 16.430 -5.667 -0.588 1.00 62.45 H new ATOM 0 HB3 ASN A 8 17.498 -6.973 -0.115 1.00 62.45 H new ATOM 0 HD21 ASN A 8 17.496 -5.568 -3.970 1.00 25.34 H new ATOM 0 HD22 ASN A 8 16.361 -4.973 -2.754 1.00 25.34 H new ATOM 148 N LYS A 9 13.604 -8.202 -2.197 1.00 70.42 N ATOM 149 CA LYS A 9 12.462 -7.974 -3.119 1.00 74.11 C ATOM 150 C LYS A 9 11.319 -8.980 -2.847 1.00 3.01 C ATOM 151 O LYS A 9 11.529 -10.178 -2.923 1.00 13.23 O ATOM 152 CB LYS A 9 12.969 -8.101 -4.582 1.00 60.40 C ATOM 153 CG LYS A 9 11.889 -7.959 -5.685 1.00 12.12 C ATOM 154 CD LYS A 9 12.489 -8.188 -7.092 1.00 25.40 C ATOM 155 CE LYS A 9 11.447 -8.205 -8.209 1.00 40.10 C ATOM 156 NZ LYS A 9 12.055 -8.356 -9.556 1.00 32.33 N ATOM 0 H LYS A 9 13.702 -9.173 -1.900 1.00 70.42 H new ATOM 0 HA LYS A 9 12.060 -6.974 -2.955 1.00 74.11 H new ATOM 0 HB2 LYS A 9 13.734 -7.342 -4.749 1.00 60.40 H new ATOM 0 HB3 LYS A 9 13.453 -9.071 -4.696 1.00 60.40 H new ATOM 0 HG2 LYS A 9 11.088 -8.677 -5.508 1.00 12.12 H new ATOM 0 HG3 LYS A 9 11.443 -6.966 -5.635 1.00 12.12 H new ATOM 0 HD2 LYS A 9 13.217 -7.404 -7.299 1.00 25.40 H new ATOM 0 HD3 LYS A 9 13.030 -9.135 -7.097 1.00 25.40 H new ATOM 0 HE2 LYS A 9 10.748 -9.023 -8.036 1.00 40.10 H new ATOM 0 HE3 LYS A 9 10.870 -7.281 -8.177 1.00 40.10 H new ATOM 0 HZ1 LYS A 9 11.305 -8.362 -10.277 1.00 32.33 H new ATOM 0 HZ2 LYS A 9 12.702 -7.562 -9.736 1.00 32.33 H new ATOM 0 HZ3 LYS A 9 12.584 -9.250 -9.600 1.00 32.33 H new ATOM 170 N ILE A 10 10.108 -8.488 -2.551 1.00 33.30 N ATOM 171 CA ILE A 10 8.907 -9.332 -2.361 1.00 31.23 C ATOM 172 C ILE A 10 7.867 -9.030 -3.463 1.00 52.12 C ATOM 173 O ILE A 10 7.323 -7.921 -3.556 1.00 22.23 O ATOM 174 CB ILE A 10 8.282 -9.138 -0.923 1.00 13.43 C ATOM 175 CG1 ILE A 10 9.267 -9.663 0.176 1.00 11.21 C ATOM 176 CG2 ILE A 10 6.894 -9.819 -0.795 1.00 15.32 C ATOM 177 CD1 ILE A 10 8.765 -9.563 1.612 1.00 64.30 C ATOM 0 H ILE A 10 9.927 -7.491 -2.435 1.00 33.30 H new ATOM 0 HA ILE A 10 9.209 -10.376 -2.442 1.00 31.23 H new ATOM 0 HB ILE A 10 8.127 -8.070 -0.773 1.00 13.43 H new ATOM 0 HG12 ILE A 10 9.498 -10.707 -0.037 1.00 11.21 H new ATOM 0 HG13 ILE A 10 10.201 -9.107 0.097 1.00 11.21 H new ATOM 0 HG21 ILE A 10 6.502 -9.660 0.210 1.00 15.32 H new ATOM 0 HG22 ILE A 10 6.208 -9.388 -1.524 1.00 15.32 H new ATOM 0 HG23 ILE A 10 6.995 -10.888 -0.980 1.00 15.32 H new ATOM 0 HD11 ILE A 10 9.524 -9.953 2.291 1.00 64.30 H new ATOM 0 HD12 ILE A 10 8.563 -8.520 1.855 1.00 64.30 H new ATOM 0 HD13 ILE A 10 7.849 -10.144 1.719 1.00 64.30 H new ATOM 189 N ILE A 11 7.643 -10.035 -4.318 1.00 1.13 N ATOM 190 CA ILE A 11 6.648 -10.005 -5.394 1.00 22.10 C ATOM 191 C ILE A 11 5.323 -10.595 -4.852 1.00 3.23 C ATOM 192 O ILE A 11 5.210 -11.813 -4.677 1.00 12.05 O ATOM 193 CB ILE A 11 7.125 -10.843 -6.657 1.00 60.24 C ATOM 194 CG1 ILE A 11 8.570 -10.444 -7.133 1.00 34.01 C ATOM 195 CG2 ILE A 11 6.111 -10.713 -7.824 1.00 75.05 C ATOM 196 CD1 ILE A 11 9.726 -11.031 -6.321 1.00 75.31 C ATOM 0 H ILE A 11 8.162 -10.912 -4.279 1.00 1.13 H new ATOM 0 HA ILE A 11 6.511 -8.973 -5.716 1.00 22.10 H new ATOM 0 HB ILE A 11 7.167 -11.886 -6.343 1.00 60.24 H new ATOM 0 HG12 ILE A 11 8.688 -10.752 -8.172 1.00 34.01 H new ATOM 0 HG13 ILE A 11 8.652 -9.357 -7.112 1.00 34.01 H new ATOM 0 HG21 ILE A 11 6.461 -11.296 -8.676 1.00 75.05 H new ATOM 0 HG22 ILE A 11 5.138 -11.086 -7.504 1.00 75.05 H new ATOM 0 HG23 ILE A 11 6.021 -9.666 -8.113 1.00 75.05 H new ATOM 0 HD11 ILE A 11 10.674 -10.690 -6.738 1.00 75.31 H new ATOM 0 HD12 ILE A 11 9.646 -10.703 -5.285 1.00 75.31 H new ATOM 0 HD13 ILE A 11 9.683 -12.119 -6.361 1.00 75.31 H new ATOM 208 N PHE A 12 4.337 -9.729 -4.583 1.00 54.44 N ATOM 209 CA PHE A 12 3.017 -10.125 -4.034 1.00 71.22 C ATOM 210 C PHE A 12 1.932 -10.071 -5.129 1.00 75.33 C ATOM 211 O PHE A 12 2.019 -9.259 -6.032 1.00 64.52 O ATOM 212 CB PHE A 12 2.623 -9.186 -2.857 1.00 53.21 C ATOM 213 CG PHE A 12 1.450 -9.701 -2.023 1.00 61.23 C ATOM 214 CD1 PHE A 12 1.627 -10.759 -1.135 1.00 3.34 C ATOM 215 CD2 PHE A 12 0.173 -9.157 -2.145 1.00 51.52 C ATOM 216 CE1 PHE A 12 0.574 -11.253 -0.396 1.00 11.45 C ATOM 217 CE2 PHE A 12 -0.878 -9.659 -1.408 1.00 44.42 C ATOM 218 CZ PHE A 12 -0.677 -10.704 -0.536 1.00 44.54 C ATOM 0 H PHE A 12 4.426 -8.725 -4.739 1.00 54.44 H new ATOM 0 HA PHE A 12 3.093 -11.149 -3.668 1.00 71.22 H new ATOM 0 HB2 PHE A 12 3.487 -9.051 -2.207 1.00 53.21 H new ATOM 0 HB3 PHE A 12 2.369 -8.204 -3.257 1.00 53.21 H new ATOM 0 HD1 PHE A 12 2.607 -11.200 -1.024 1.00 3.34 H new ATOM 0 HD2 PHE A 12 0.005 -8.334 -2.824 1.00 51.52 H new ATOM 0 HE1 PHE A 12 0.732 -12.070 0.292 1.00 11.45 H new ATOM 0 HE2 PHE A 12 -1.863 -9.230 -1.515 1.00 44.42 H new ATOM 0 HZ PHE A 12 -1.504 -11.093 0.039 1.00 44.54 H new ATOM 228 N THR A 13 0.909 -10.941 -5.035 1.00 72.33 N ATOM 229 CA THR A 13 -0.271 -10.917 -5.945 1.00 30.44 C ATOM 230 C THR A 13 -1.573 -11.193 -5.157 1.00 34.20 C ATOM 231 O THR A 13 -1.561 -11.931 -4.163 1.00 24.32 O ATOM 232 CB THR A 13 -0.127 -11.935 -7.132 1.00 34.14 C ATOM 233 OG1 THR A 13 -1.266 -11.842 -8.012 1.00 23.13 O ATOM 234 CG2 THR A 13 0.029 -13.396 -6.655 1.00 2.43 C ATOM 0 H THR A 13 0.869 -11.680 -4.333 1.00 72.33 H new ATOM 0 HA THR A 13 -0.320 -9.917 -6.377 1.00 30.44 H new ATOM 0 HB THR A 13 0.785 -11.663 -7.663 1.00 34.14 H new ATOM 0 HG1 THR A 13 -1.163 -12.480 -8.749 1.00 23.13 H new ATOM 0 HG21 THR A 13 0.124 -14.053 -7.520 1.00 2.43 H new ATOM 0 HG22 THR A 13 0.920 -13.483 -6.034 1.00 2.43 H new ATOM 0 HG23 THR A 13 -0.847 -13.685 -6.075 1.00 2.43 H new ATOM 242 N ARG A 14 -2.693 -10.582 -5.600 1.00 30.22 N ATOM 243 CA ARG A 14 -4.005 -10.709 -4.921 1.00 4.23 C ATOM 244 C ARG A 14 -5.144 -10.334 -5.905 1.00 50.33 C ATOM 245 O ARG A 14 -5.073 -9.306 -6.592 1.00 54.42 O ATOM 246 CB ARG A 14 -4.024 -9.806 -3.640 1.00 64.02 C ATOM 247 CG ARG A 14 -4.969 -10.244 -2.477 1.00 21.45 C ATOM 248 CD ARG A 14 -6.466 -9.992 -2.736 1.00 3.21 C ATOM 249 NE ARG A 14 -7.303 -10.319 -1.560 1.00 73.22 N ATOM 250 CZ ARG A 14 -8.620 -10.372 -1.565 1.00 31.13 C ATOM 251 NH1 ARG A 14 -9.283 -10.161 -2.649 1.00 62.14 N ATOM 252 NH2 ARG A 14 -9.263 -10.650 -0.480 1.00 1.22 N ATOM 0 H ARG A 14 -2.716 -9.991 -6.431 1.00 30.22 H new ATOM 0 HA ARG A 14 -4.163 -11.741 -4.607 1.00 4.23 H new ATOM 0 HB2 ARG A 14 -3.008 -9.752 -3.249 1.00 64.02 H new ATOM 0 HB3 ARG A 14 -4.304 -8.796 -3.941 1.00 64.02 H new ATOM 0 HG2 ARG A 14 -4.821 -11.307 -2.287 1.00 21.45 H new ATOM 0 HG3 ARG A 14 -4.677 -9.714 -1.570 1.00 21.45 H new ATOM 0 HD2 ARG A 14 -6.615 -8.946 -3.005 1.00 3.21 H new ATOM 0 HD3 ARG A 14 -6.791 -10.590 -3.588 1.00 3.21 H new ATOM 0 HE ARG A 14 -6.826 -10.518 -0.681 1.00 73.22 H new ATOM 0 HH11 ARG A 14 -8.789 -9.950 -3.516 1.00 62.14 H new ATOM 0 HH12 ARG A 14 -10.302 -10.205 -2.640 1.00 62.14 H new ATOM 0 HH21 ARG A 14 -8.752 -10.829 0.384 1.00 1.22 H new ATOM 0 HH22 ARG A 14 -10.282 -10.690 -0.487 1.00 1.22 H new ATOM 266 N THR A 15 -6.193 -11.175 -5.952 1.00 15.31 N ATOM 267 CA THR A 15 -7.372 -10.976 -6.826 1.00 74.00 C ATOM 268 C THR A 15 -8.588 -10.451 -6.019 1.00 21.40 C ATOM 269 O THR A 15 -9.125 -11.162 -5.170 1.00 11.52 O ATOM 270 CB THR A 15 -7.767 -12.304 -7.563 1.00 64.32 C ATOM 271 OG1 THR A 15 -6.660 -12.758 -8.359 1.00 53.13 O ATOM 272 CG2 THR A 15 -9.007 -12.135 -8.471 1.00 12.02 C ATOM 0 H THR A 15 -6.250 -12.019 -5.382 1.00 15.31 H new ATOM 0 HA THR A 15 -7.094 -10.230 -7.570 1.00 74.00 H new ATOM 0 HB THR A 15 -8.019 -13.035 -6.795 1.00 64.32 H new ATOM 0 HG1 THR A 15 -6.601 -12.219 -9.175 1.00 53.13 H new ATOM 0 HG21 THR A 15 -9.235 -13.084 -8.956 1.00 12.02 H new ATOM 0 HG22 THR A 15 -9.859 -11.821 -7.868 1.00 12.02 H new ATOM 0 HG23 THR A 15 -8.802 -11.380 -9.230 1.00 12.02 H new ATOM 280 N PHE A 16 -9.019 -9.207 -6.311 1.00 34.31 N ATOM 281 CA PHE A 16 -10.163 -8.544 -5.640 1.00 30.31 C ATOM 282 C PHE A 16 -11.461 -8.739 -6.454 1.00 12.44 C ATOM 283 O PHE A 16 -11.439 -8.679 -7.693 1.00 52.33 O ATOM 284 CB PHE A 16 -9.892 -7.022 -5.496 1.00 44.14 C ATOM 285 CG PHE A 16 -8.581 -6.686 -4.790 1.00 64.52 C ATOM 286 CD1 PHE A 16 -8.526 -6.556 -3.403 1.00 44.23 C ATOM 287 CD2 PHE A 16 -7.399 -6.509 -5.518 1.00 33.32 C ATOM 288 CE1 PHE A 16 -7.339 -6.258 -2.771 1.00 13.45 C ATOM 289 CE2 PHE A 16 -6.212 -6.213 -4.880 1.00 41.33 C ATOM 290 CZ PHE A 16 -6.183 -6.086 -3.508 1.00 4.02 C ATOM 0 H PHE A 16 -8.580 -8.626 -7.026 1.00 34.31 H new ATOM 0 HA PHE A 16 -10.280 -8.996 -4.655 1.00 30.31 H new ATOM 0 HB2 PHE A 16 -9.884 -6.570 -6.488 1.00 44.14 H new ATOM 0 HB3 PHE A 16 -10.716 -6.568 -4.945 1.00 44.14 H new ATOM 0 HD1 PHE A 16 -9.424 -6.690 -2.818 1.00 44.23 H new ATOM 0 HD2 PHE A 16 -7.416 -6.605 -6.594 1.00 33.32 H new ATOM 0 HE1 PHE A 16 -7.312 -6.158 -1.696 1.00 13.45 H new ATOM 0 HE2 PHE A 16 -5.307 -6.081 -5.455 1.00 41.33 H new ATOM 0 HZ PHE A 16 -5.255 -5.852 -3.008 1.00 4.02 H new ATOM 300 N SER A 17 -12.588 -8.960 -5.753 1.00 14.25 N ATOM 301 CA SER A 17 -13.919 -9.020 -6.390 1.00 13.51 C ATOM 302 C SER A 17 -14.479 -7.584 -6.563 1.00 70.04 C ATOM 303 O SER A 17 -15.181 -7.075 -5.684 1.00 54.34 O ATOM 304 CB SER A 17 -14.869 -9.878 -5.510 1.00 13.41 C ATOM 305 OG SER A 17 -14.307 -11.156 -5.258 1.00 44.22 O ATOM 0 H SER A 17 -12.605 -9.100 -4.743 1.00 14.25 H new ATOM 0 HA SER A 17 -13.840 -9.480 -7.375 1.00 13.51 H new ATOM 0 HB2 SER A 17 -15.058 -9.367 -4.566 1.00 13.41 H new ATOM 0 HB3 SER A 17 -15.831 -9.991 -6.010 1.00 13.41 H new ATOM 0 HG SER A 17 -13.613 -11.078 -4.570 1.00 44.22 H new ATOM 311 N ALA A 18 -14.185 -6.968 -7.730 1.00 73.35 N ATOM 312 CA ALA A 18 -14.439 -5.527 -8.004 1.00 14.14 C ATOM 313 C ALA A 18 -13.804 -5.108 -9.358 1.00 62.00 C ATOM 314 O ALA A 18 -12.943 -5.828 -9.884 1.00 32.42 O ATOM 315 CB ALA A 18 -13.851 -4.626 -6.875 1.00 3.34 C ATOM 0 H ALA A 18 -13.761 -7.457 -8.518 1.00 73.35 H new ATOM 0 HA ALA A 18 -15.520 -5.391 -8.045 1.00 14.14 H new ATOM 0 HB1 ALA A 18 -14.052 -3.579 -7.103 1.00 3.34 H new ATOM 0 HB2 ALA A 18 -14.315 -4.886 -5.923 1.00 3.34 H new ATOM 0 HB3 ALA A 18 -12.774 -4.782 -6.808 1.00 3.34 H new ATOM 321 N PRO A 19 -14.238 -3.954 -9.968 1.00 41.23 N ATOM 322 CA PRO A 19 -13.453 -3.282 -11.036 1.00 51.30 C ATOM 323 C PRO A 19 -12.163 -2.608 -10.477 1.00 22.22 C ATOM 324 O PRO A 19 -12.140 -2.137 -9.329 1.00 13.24 O ATOM 325 CB PRO A 19 -14.442 -2.235 -11.611 1.00 22.22 C ATOM 326 CG PRO A 19 -15.404 -1.961 -10.492 1.00 42.10 C ATOM 327 CD PRO A 19 -15.547 -3.273 -9.741 1.00 24.41 C ATOM 0 HA PRO A 19 -13.092 -3.981 -11.790 1.00 51.30 H new ATOM 0 HB2 PRO A 19 -13.923 -1.327 -11.917 1.00 22.22 H new ATOM 0 HB3 PRO A 19 -14.958 -2.620 -12.491 1.00 22.22 H new ATOM 0 HG2 PRO A 19 -15.029 -1.174 -9.837 1.00 42.10 H new ATOM 0 HG3 PRO A 19 -16.366 -1.624 -10.877 1.00 42.10 H new ATOM 0 HD2 PRO A 19 -15.734 -3.109 -8.680 1.00 24.41 H new ATOM 0 HD3 PRO A 19 -16.378 -3.865 -10.124 1.00 24.41 H new ATOM 335 N ILE A 20 -11.106 -2.553 -11.315 1.00 42.02 N ATOM 336 CA ILE A 20 -9.759 -2.064 -10.906 1.00 64.14 C ATOM 337 C ILE A 20 -9.753 -0.562 -10.497 1.00 34.45 C ATOM 338 O ILE A 20 -8.889 -0.123 -9.739 1.00 75.02 O ATOM 339 CB ILE A 20 -8.698 -2.330 -12.039 1.00 1.44 C ATOM 340 CG1 ILE A 20 -7.240 -2.069 -11.521 1.00 74.02 C ATOM 341 CG2 ILE A 20 -9.016 -1.494 -13.306 1.00 31.32 C ATOM 342 CD1 ILE A 20 -6.140 -2.349 -12.523 1.00 15.53 C ATOM 0 H ILE A 20 -11.155 -2.844 -12.292 1.00 42.02 H new ATOM 0 HA ILE A 20 -9.484 -2.632 -10.018 1.00 64.14 H new ATOM 0 HB ILE A 20 -8.759 -3.382 -12.319 1.00 1.44 H new ATOM 0 HG12 ILE A 20 -7.165 -1.029 -11.204 1.00 74.02 H new ATOM 0 HG13 ILE A 20 -7.070 -2.684 -10.637 1.00 74.02 H new ATOM 0 HG21 ILE A 20 -8.268 -1.696 -14.073 1.00 31.32 H new ATOM 0 HG22 ILE A 20 -10.003 -1.764 -13.682 1.00 31.32 H new ATOM 0 HG23 ILE A 20 -9.001 -0.433 -13.055 1.00 31.32 H new ATOM 0 HD11 ILE A 20 -5.172 -2.138 -12.069 1.00 15.53 H new ATOM 0 HD12 ILE A 20 -6.179 -3.396 -12.823 1.00 15.53 H new ATOM 0 HD13 ILE A 20 -6.276 -1.715 -13.399 1.00 15.53 H new ATOM 354 N ASN A 21 -10.739 0.198 -11.001 1.00 34.45 N ATOM 355 CA ASN A 21 -10.902 1.640 -10.701 1.00 30.43 C ATOM 356 C ASN A 21 -11.060 1.900 -9.181 1.00 33.11 C ATOM 357 O ASN A 21 -10.416 2.795 -8.642 1.00 34.03 O ATOM 358 CB ASN A 21 -12.121 2.204 -11.481 1.00 25.14 C ATOM 359 CG ASN A 21 -11.949 2.159 -13.005 1.00 53.43 C ATOM 360 OD1 ASN A 21 -11.282 1.284 -13.555 1.00 31.43 O ATOM 361 ND2 ASN A 21 -12.552 3.102 -13.702 1.00 75.14 N ATOM 0 H ASN A 21 -11.452 -0.168 -11.632 1.00 34.45 H new ATOM 0 HA ASN A 21 -9.997 2.155 -11.023 1.00 30.43 H new ATOM 0 HB2 ASN A 21 -13.011 1.637 -11.207 1.00 25.14 H new ATOM 0 HB3 ASN A 21 -12.293 3.235 -11.173 1.00 25.14 H new ATOM 0 HD21 ASN A 21 -12.470 3.116 -14.719 1.00 75.14 H new ATOM 0 HD22 ASN A 21 -13.100 3.818 -13.225 1.00 75.14 H new ATOM 368 N LYS A 22 -11.888 1.070 -8.508 1.00 64.13 N ATOM 369 CA LYS A 22 -12.133 1.173 -7.039 1.00 4.22 C ATOM 370 C LYS A 22 -10.855 0.811 -6.252 1.00 60.45 C ATOM 371 O LYS A 22 -10.494 1.466 -5.268 1.00 50.44 O ATOM 372 CB LYS A 22 -13.286 0.224 -6.589 1.00 62.14 C ATOM 373 CG LYS A 22 -14.479 0.146 -7.558 1.00 54.04 C ATOM 374 CD LYS A 22 -15.696 -0.617 -6.972 1.00 0.34 C ATOM 375 CE LYS A 22 -16.289 0.060 -5.722 1.00 1.02 C ATOM 376 NZ LYS A 22 -17.551 -0.591 -5.284 1.00 63.02 N ATOM 0 H LYS A 22 -12.405 0.314 -8.957 1.00 64.13 H new ATOM 0 HA LYS A 22 -12.419 2.204 -6.829 1.00 4.22 H new ATOM 0 HB2 LYS A 22 -12.880 -0.779 -6.455 1.00 62.14 H new ATOM 0 HB3 LYS A 22 -13.649 0.554 -5.615 1.00 62.14 H new ATOM 0 HG2 LYS A 22 -14.787 1.157 -7.826 1.00 54.04 H new ATOM 0 HG3 LYS A 22 -14.160 -0.344 -8.478 1.00 54.04 H new ATOM 0 HD2 LYS A 22 -16.469 -0.697 -7.736 1.00 0.34 H new ATOM 0 HD3 LYS A 22 -15.393 -1.633 -6.718 1.00 0.34 H new ATOM 0 HE2 LYS A 22 -15.562 0.024 -4.911 1.00 1.02 H new ATOM 0 HE3 LYS A 22 -16.478 1.112 -5.935 1.00 1.02 H new ATOM 0 HZ1 LYS A 22 -18.307 0.121 -5.226 1.00 63.02 H new ATOM 0 HZ2 LYS A 22 -17.819 -1.325 -5.970 1.00 63.02 H new ATOM 0 HZ3 LYS A 22 -17.411 -1.025 -4.349 1.00 63.02 H new ATOM 390 N VAL A 23 -10.203 -0.263 -6.726 1.00 44.22 N ATOM 391 CA VAL A 23 -8.934 -0.779 -6.172 1.00 74.12 C ATOM 392 C VAL A 23 -7.846 0.320 -6.192 1.00 22.35 C ATOM 393 O VAL A 23 -7.116 0.517 -5.219 1.00 72.44 O ATOM 394 CB VAL A 23 -8.481 -2.042 -7.002 1.00 0.44 C ATOM 395 CG1 VAL A 23 -7.093 -2.575 -6.556 1.00 71.13 C ATOM 396 CG2 VAL A 23 -9.553 -3.162 -6.920 1.00 2.22 C ATOM 0 H VAL A 23 -10.546 -0.808 -7.517 1.00 44.22 H new ATOM 0 HA VAL A 23 -9.084 -1.074 -5.133 1.00 74.12 H new ATOM 0 HB VAL A 23 -8.381 -1.725 -8.040 1.00 0.44 H new ATOM 0 HG11 VAL A 23 -6.827 -3.444 -7.157 1.00 71.13 H new ATOM 0 HG12 VAL A 23 -6.343 -1.796 -6.692 1.00 71.13 H new ATOM 0 HG13 VAL A 23 -7.133 -2.860 -5.505 1.00 71.13 H new ATOM 0 HG21 VAL A 23 -9.223 -4.025 -7.499 1.00 2.22 H new ATOM 0 HG22 VAL A 23 -9.694 -3.455 -5.880 1.00 2.22 H new ATOM 0 HG23 VAL A 23 -10.496 -2.793 -7.324 1.00 2.22 H new ATOM 406 N PHE A 24 -7.809 1.057 -7.306 1.00 41.22 N ATOM 407 CA PHE A 24 -6.897 2.195 -7.519 1.00 42.20 C ATOM 408 C PHE A 24 -7.279 3.418 -6.641 1.00 32.24 C ATOM 409 O PHE A 24 -6.397 4.157 -6.184 1.00 13.13 O ATOM 410 CB PHE A 24 -6.914 2.573 -9.015 1.00 51.00 C ATOM 411 CG PHE A 24 -6.010 3.743 -9.384 1.00 60.45 C ATOM 412 CD1 PHE A 24 -4.624 3.598 -9.387 1.00 62.23 C ATOM 413 CD2 PHE A 24 -6.545 4.982 -9.750 1.00 71.22 C ATOM 414 CE1 PHE A 24 -3.808 4.652 -9.740 1.00 70.03 C ATOM 415 CE2 PHE A 24 -5.728 6.029 -10.107 1.00 31.03 C ATOM 416 CZ PHE A 24 -4.362 5.865 -10.101 1.00 32.15 C ATOM 0 H PHE A 24 -8.421 0.880 -8.102 1.00 41.22 H new ATOM 0 HA PHE A 24 -5.892 1.896 -7.221 1.00 42.20 H new ATOM 0 HB2 PHE A 24 -6.616 1.703 -9.600 1.00 51.00 H new ATOM 0 HB3 PHE A 24 -7.937 2.816 -9.303 1.00 51.00 H new ATOM 0 HD1 PHE A 24 -4.185 2.651 -9.110 1.00 62.23 H new ATOM 0 HD2 PHE A 24 -7.616 5.119 -9.752 1.00 71.22 H new ATOM 0 HE1 PHE A 24 -2.735 4.529 -9.734 1.00 70.03 H new ATOM 0 HE2 PHE A 24 -6.158 6.978 -10.392 1.00 31.03 H new ATOM 0 HZ PHE A 24 -3.720 6.688 -10.380 1.00 32.15 H new ATOM 426 N ASP A 25 -8.599 3.627 -6.425 1.00 41.15 N ATOM 427 CA ASP A 25 -9.114 4.721 -5.561 1.00 12.51 C ATOM 428 C ASP A 25 -8.671 4.563 -4.085 1.00 51.52 C ATOM 429 O ASP A 25 -8.662 5.532 -3.329 1.00 15.24 O ATOM 430 CB ASP A 25 -10.657 4.833 -5.657 1.00 14.25 C ATOM 431 CG ASP A 25 -11.172 5.300 -7.031 1.00 52.33 C ATOM 432 OD1 ASP A 25 -10.479 6.090 -7.716 1.00 61.53 O ATOM 433 OD2 ASP A 25 -12.288 4.892 -7.427 1.00 15.54 O ATOM 0 H ASP A 25 -9.332 3.050 -6.839 1.00 41.15 H new ATOM 0 HA ASP A 25 -8.676 5.646 -5.935 1.00 12.51 H new ATOM 0 HB2 ASP A 25 -11.095 3.862 -5.428 1.00 14.25 H new ATOM 0 HB3 ASP A 25 -11.008 5.529 -4.895 1.00 14.25 H new ATOM 438 N ALA A 26 -8.312 3.336 -3.688 1.00 13.23 N ATOM 439 CA ALA A 26 -7.726 3.052 -2.358 1.00 12.35 C ATOM 440 C ALA A 26 -6.306 3.650 -2.200 1.00 13.41 C ATOM 441 O ALA A 26 -5.870 3.944 -1.085 1.00 62.13 O ATOM 442 CB ALA A 26 -7.687 1.546 -2.139 1.00 24.22 C ATOM 0 H ALA A 26 -8.417 2.508 -4.274 1.00 13.23 H new ATOM 0 HA ALA A 26 -8.356 3.526 -1.606 1.00 12.35 H new ATOM 0 HB1 ALA A 26 -7.256 1.332 -1.161 1.00 24.22 H new ATOM 0 HB2 ALA A 26 -8.700 1.145 -2.185 1.00 24.22 H new ATOM 0 HB3 ALA A 26 -7.077 1.081 -2.914 1.00 24.22 H new ATOM 448 N TYR A 27 -5.591 3.797 -3.329 1.00 20.10 N ATOM 449 CA TYR A 27 -4.217 4.359 -3.362 1.00 21.41 C ATOM 450 C TYR A 27 -4.222 5.879 -3.671 1.00 44.53 C ATOM 451 O TYR A 27 -3.182 6.535 -3.567 1.00 34.02 O ATOM 452 CB TYR A 27 -3.365 3.604 -4.425 1.00 73.31 C ATOM 453 CG TYR A 27 -3.339 2.075 -4.232 1.00 45.23 C ATOM 454 CD1 TYR A 27 -2.647 1.491 -3.167 1.00 51.45 C ATOM 455 CD2 TYR A 27 -4.034 1.223 -5.095 1.00 32.35 C ATOM 456 CE1 TYR A 27 -2.640 0.119 -2.984 1.00 3.42 C ATOM 457 CE2 TYR A 27 -4.032 -0.150 -4.909 1.00 61.12 C ATOM 458 CZ TYR A 27 -3.340 -0.695 -3.851 1.00 63.04 C ATOM 459 OH TYR A 27 -3.340 -2.064 -3.661 1.00 22.05 O ATOM 0 H TYR A 27 -5.944 3.531 -4.248 1.00 20.10 H new ATOM 0 HA TYR A 27 -3.778 4.225 -2.373 1.00 21.41 H new ATOM 0 HB2 TYR A 27 -3.757 3.829 -5.417 1.00 73.31 H new ATOM 0 HB3 TYR A 27 -2.343 3.982 -4.393 1.00 73.31 H new ATOM 0 HD1 TYR A 27 -2.108 2.121 -2.475 1.00 51.45 H new ATOM 0 HD2 TYR A 27 -4.584 1.644 -5.924 1.00 32.35 H new ATOM 0 HE1 TYR A 27 -2.087 -0.314 -2.163 1.00 3.42 H new ATOM 0 HE2 TYR A 27 -4.571 -0.790 -5.591 1.00 61.12 H new ATOM 0 HH TYR A 27 -3.881 -2.491 -4.358 1.00 22.05 H new ATOM 469 N THR A 28 -5.397 6.432 -4.063 1.00 62.30 N ATOM 470 CA THR A 28 -5.522 7.854 -4.495 1.00 25.12 C ATOM 471 C THR A 28 -6.445 8.709 -3.599 1.00 32.32 C ATOM 472 O THR A 28 -6.316 9.940 -3.573 1.00 21.40 O ATOM 473 CB THR A 28 -6.024 7.959 -5.973 1.00 53.41 C ATOM 474 OG1 THR A 28 -7.141 7.094 -6.187 1.00 53.05 O ATOM 475 CG2 THR A 28 -4.916 7.632 -6.986 1.00 4.30 C ATOM 0 H THR A 28 -6.276 5.916 -4.090 1.00 62.30 H new ATOM 0 HA THR A 28 -4.513 8.256 -4.404 1.00 25.12 H new ATOM 0 HB THR A 28 -6.328 8.994 -6.132 1.00 53.41 H new ATOM 0 HG1 THR A 28 -6.829 6.168 -6.257 1.00 53.05 H new ATOM 0 HG21 THR A 28 -5.311 7.718 -7.998 1.00 4.30 H new ATOM 0 HG22 THR A 28 -4.089 8.331 -6.859 1.00 4.30 H new ATOM 0 HG23 THR A 28 -4.560 6.615 -6.821 1.00 4.30 H new ATOM 483 N LYS A 29 -7.382 8.069 -2.896 1.00 40.44 N ATOM 484 CA LYS A 29 -8.347 8.761 -2.003 1.00 3.44 C ATOM 485 C LYS A 29 -8.070 8.352 -0.539 1.00 24.22 C ATOM 486 O LYS A 29 -8.166 7.167 -0.202 1.00 22.30 O ATOM 487 CB LYS A 29 -9.827 8.430 -2.407 1.00 24.44 C ATOM 488 CG LYS A 29 -10.368 9.142 -3.680 1.00 4.32 C ATOM 489 CD LYS A 29 -9.753 8.597 -4.985 1.00 21.40 C ATOM 490 CE LYS A 29 -10.172 9.380 -6.235 1.00 33.44 C ATOM 491 NZ LYS A 29 -9.466 8.879 -7.442 1.00 65.14 N ATOM 0 H LYS A 29 -7.503 7.057 -2.922 1.00 40.44 H new ATOM 0 HA LYS A 29 -8.216 9.838 -2.105 1.00 3.44 H new ATOM 0 HB2 LYS A 29 -9.909 7.353 -2.556 1.00 24.44 H new ATOM 0 HB3 LYS A 29 -10.476 8.686 -1.570 1.00 24.44 H new ATOM 0 HG2 LYS A 29 -11.451 9.028 -3.720 1.00 4.32 H new ATOM 0 HG3 LYS A 29 -10.163 10.210 -3.607 1.00 4.32 H new ATOM 0 HD2 LYS A 29 -8.666 8.617 -4.901 1.00 21.40 H new ATOM 0 HD3 LYS A 29 -10.044 7.553 -5.106 1.00 21.40 H new ATOM 0 HE2 LYS A 29 -11.249 9.293 -6.378 1.00 33.44 H new ATOM 0 HE3 LYS A 29 -9.953 10.439 -6.095 1.00 33.44 H new ATOM 0 HZ1 LYS A 29 -9.703 9.480 -8.257 1.00 65.14 H new ATOM 0 HZ2 LYS A 29 -8.439 8.905 -7.280 1.00 65.14 H new ATOM 0 HZ3 LYS A 29 -9.761 7.901 -7.636 1.00 65.14 H new ATOM 505 N ARG A 30 -7.726 9.337 0.328 1.00 34.34 N ATOM 506 CA ARG A 30 -7.338 9.066 1.739 1.00 75.14 C ATOM 507 C ARG A 30 -8.472 8.448 2.572 1.00 73.42 C ATOM 508 O ARG A 30 -8.220 7.625 3.439 1.00 24.04 O ATOM 509 CB ARG A 30 -6.751 10.340 2.432 1.00 44.34 C ATOM 510 CG ARG A 30 -7.529 11.679 2.271 1.00 31.24 C ATOM 511 CD ARG A 30 -8.816 11.799 3.111 1.00 23.33 C ATOM 512 NE ARG A 30 -9.429 13.133 2.984 1.00 74.41 N ATOM 513 CZ ARG A 30 -10.713 13.400 3.038 1.00 54.45 C ATOM 514 NH1 ARG A 30 -11.604 12.464 3.175 1.00 4.24 N ATOM 515 NH2 ARG A 30 -11.104 14.623 2.952 1.00 73.31 N ATOM 0 H ARG A 30 -7.709 10.325 0.077 1.00 34.34 H new ATOM 0 HA ARG A 30 -6.550 8.315 1.692 1.00 75.14 H new ATOM 0 HB2 ARG A 30 -6.663 10.130 3.498 1.00 44.34 H new ATOM 0 HB3 ARG A 30 -5.741 10.492 2.052 1.00 44.34 H new ATOM 0 HG2 ARG A 30 -6.864 12.501 2.536 1.00 31.24 H new ATOM 0 HG3 ARG A 30 -7.788 11.805 1.220 1.00 31.24 H new ATOM 0 HD2 ARG A 30 -9.530 11.039 2.793 1.00 23.33 H new ATOM 0 HD3 ARG A 30 -8.586 11.603 4.158 1.00 23.33 H new ATOM 0 HE ARG A 30 -8.798 13.921 2.841 1.00 74.41 H new ATOM 0 HH11 ARG A 30 -11.313 11.489 3.244 1.00 4.24 H new ATOM 0 HH12 ARG A 30 -12.594 12.704 3.214 1.00 4.24 H new ATOM 0 HH21 ARG A 30 -10.419 15.371 2.843 1.00 73.31 H new ATOM 0 HH22 ARG A 30 -12.099 14.844 2.993 1.00 73.31 H new ATOM 529 N GLU A 31 -9.709 8.845 2.261 1.00 60.43 N ATOM 530 CA GLU A 31 -10.936 8.339 2.913 1.00 0.44 C ATOM 531 C GLU A 31 -11.128 6.815 2.712 1.00 30.24 C ATOM 532 O GLU A 31 -11.897 6.193 3.435 1.00 1.41 O ATOM 533 CB GLU A 31 -12.183 9.114 2.394 1.00 13.13 C ATOM 534 CG GLU A 31 -12.326 9.181 0.841 1.00 12.15 C ATOM 535 CD GLU A 31 -11.825 10.506 0.213 1.00 64.31 C ATOM 536 OE1 GLU A 31 -10.598 10.719 0.123 1.00 61.40 O ATOM 537 OE2 GLU A 31 -12.661 11.347 -0.174 1.00 34.22 O ATOM 0 H GLU A 31 -9.897 9.539 1.537 1.00 60.43 H new ATOM 0 HA GLU A 31 -10.824 8.509 3.984 1.00 0.44 H new ATOM 0 HB2 GLU A 31 -13.078 8.647 2.805 1.00 13.13 H new ATOM 0 HB3 GLU A 31 -12.147 10.131 2.784 1.00 13.13 H new ATOM 0 HG2 GLU A 31 -11.773 8.351 0.400 1.00 12.15 H new ATOM 0 HG3 GLU A 31 -13.374 9.041 0.578 1.00 12.15 H new ATOM 544 N LEU A 32 -10.438 6.235 1.714 1.00 31.20 N ATOM 545 CA LEU A 32 -10.425 4.776 1.480 1.00 1.24 C ATOM 546 C LEU A 32 -9.116 4.169 2.010 1.00 34.40 C ATOM 547 O LEU A 32 -9.124 3.095 2.615 1.00 13.41 O ATOM 548 CB LEU A 32 -10.570 4.485 -0.029 1.00 60.24 C ATOM 549 CG LEU A 32 -11.844 5.076 -0.708 1.00 44.11 C ATOM 550 CD1 LEU A 32 -11.839 4.786 -2.214 1.00 44.55 C ATOM 551 CD2 LEU A 32 -13.139 4.560 -0.038 1.00 20.23 C ATOM 0 H LEU A 32 -9.874 6.761 1.047 1.00 31.20 H new ATOM 0 HA LEU A 32 -11.263 4.324 2.011 1.00 1.24 H new ATOM 0 HB2 LEU A 32 -9.692 4.876 -0.543 1.00 60.24 H new ATOM 0 HB3 LEU A 32 -10.570 3.405 -0.174 1.00 60.24 H new ATOM 0 HG LEU A 32 -11.823 6.157 -0.572 1.00 44.11 H new ATOM 0 HD11 LEU A 32 -12.736 5.207 -2.668 1.00 44.55 H new ATOM 0 HD12 LEU A 32 -10.957 5.237 -2.668 1.00 44.55 H new ATOM 0 HD13 LEU A 32 -11.821 3.708 -2.377 1.00 44.55 H new ATOM 0 HD21 LEU A 32 -14.005 4.993 -0.538 1.00 20.23 H new ATOM 0 HD22 LEU A 32 -13.181 3.474 -0.116 1.00 20.23 H new ATOM 0 HD23 LEU A 32 -13.145 4.849 1.013 1.00 20.23 H new ATOM 563 N PHE A 33 -7.997 4.892 1.770 1.00 65.34 N ATOM 564 CA PHE A 33 -6.631 4.477 2.175 1.00 62.22 C ATOM 565 C PHE A 33 -6.554 4.121 3.676 1.00 40.23 C ATOM 566 O PHE A 33 -6.052 3.059 4.044 1.00 2.31 O ATOM 567 CB PHE A 33 -5.626 5.603 1.830 1.00 31.32 C ATOM 568 CG PHE A 33 -4.153 5.261 2.083 1.00 64.24 C ATOM 569 CD1 PHE A 33 -3.442 4.460 1.189 1.00 31.24 C ATOM 570 CD2 PHE A 33 -3.475 5.755 3.206 1.00 61.32 C ATOM 571 CE1 PHE A 33 -2.107 4.168 1.403 1.00 23.12 C ATOM 572 CE2 PHE A 33 -2.141 5.459 3.417 1.00 51.41 C ATOM 573 CZ PHE A 33 -1.458 4.665 2.515 1.00 33.34 C ATOM 0 H PHE A 33 -8.016 5.789 1.285 1.00 65.34 H new ATOM 0 HA PHE A 33 -6.373 3.574 1.621 1.00 62.22 H new ATOM 0 HB2 PHE A 33 -5.746 5.866 0.779 1.00 31.32 H new ATOM 0 HB3 PHE A 33 -5.882 6.488 2.412 1.00 31.32 H new ATOM 0 HD1 PHE A 33 -3.941 4.062 0.318 1.00 31.24 H new ATOM 0 HD2 PHE A 33 -4.002 6.375 3.916 1.00 61.32 H new ATOM 0 HE1 PHE A 33 -1.571 3.550 0.698 1.00 23.12 H new ATOM 0 HE2 PHE A 33 -1.633 5.848 4.287 1.00 51.41 H new ATOM 0 HZ PHE A 33 -0.416 4.433 2.680 1.00 33.34 H new ATOM 583 N GLU A 34 -7.078 5.015 4.530 1.00 22.32 N ATOM 584 CA GLU A 34 -7.087 4.793 5.992 1.00 73.45 C ATOM 585 C GLU A 34 -8.065 3.672 6.444 1.00 32.30 C ATOM 586 O GLU A 34 -7.945 3.171 7.561 1.00 32.24 O ATOM 587 CB GLU A 34 -7.316 6.132 6.769 1.00 2.21 C ATOM 588 CG GLU A 34 -8.599 6.949 6.443 1.00 73.41 C ATOM 589 CD GLU A 34 -9.919 6.402 7.012 1.00 74.03 C ATOM 590 OE1 GLU A 34 -9.930 5.919 8.169 1.00 72.44 O ATOM 591 OE2 GLU A 34 -10.953 6.487 6.324 1.00 43.41 O ATOM 0 H GLU A 34 -7.500 5.896 4.238 1.00 22.32 H new ATOM 0 HA GLU A 34 -6.094 4.426 6.252 1.00 73.45 H new ATOM 0 HB2 GLU A 34 -7.326 5.903 7.835 1.00 2.21 H new ATOM 0 HB3 GLU A 34 -6.455 6.775 6.589 1.00 2.21 H new ATOM 0 HG2 GLU A 34 -8.461 7.965 6.814 1.00 73.41 H new ATOM 0 HG3 GLU A 34 -8.696 7.016 5.359 1.00 73.41 H new ATOM 598 N GLN A 35 -9.020 3.272 5.577 1.00 25.31 N ATOM 599 CA GLN A 35 -9.983 2.183 5.900 1.00 25.03 C ATOM 600 C GLN A 35 -9.376 0.763 5.728 1.00 73.23 C ATOM 601 O GLN A 35 -9.820 -0.180 6.400 1.00 51.34 O ATOM 602 CB GLN A 35 -11.286 2.313 5.058 1.00 10.20 C ATOM 603 CG GLN A 35 -12.164 3.524 5.437 1.00 61.23 C ATOM 604 CD GLN A 35 -13.560 3.504 4.804 1.00 62.11 C ATOM 605 OE1 GLN A 35 -14.510 2.978 5.376 1.00 64.32 O ATOM 606 NE2 GLN A 35 -13.690 4.043 3.609 1.00 4.11 N ATOM 0 H GLN A 35 -9.149 3.681 4.651 1.00 25.31 H new ATOM 0 HA GLN A 35 -10.227 2.303 6.956 1.00 25.03 H new ATOM 0 HB2 GLN A 35 -11.019 2.388 4.004 1.00 10.20 H new ATOM 0 HB3 GLN A 35 -11.873 1.402 5.174 1.00 10.20 H new ATOM 0 HG2 GLN A 35 -12.268 3.559 6.521 1.00 61.23 H new ATOM 0 HG3 GLN A 35 -11.653 4.439 5.136 1.00 61.23 H new ATOM 0 HE21 GLN A 35 -12.886 4.474 3.154 1.00 4.11 H new ATOM 0 HE22 GLN A 35 -14.595 4.029 3.139 1.00 4.11 H new ATOM 615 N TRP A 36 -8.381 0.598 4.829 1.00 52.41 N ATOM 616 CA TRP A 36 -7.714 -0.719 4.610 1.00 65.15 C ATOM 617 C TRP A 36 -6.268 -0.730 5.191 1.00 21.21 C ATOM 618 O TRP A 36 -5.922 -1.621 5.975 1.00 74.20 O ATOM 619 CB TRP A 36 -7.737 -1.117 3.096 1.00 4.23 C ATOM 620 CG TRP A 36 -6.854 -0.286 2.180 1.00 31.40 C ATOM 621 CD1 TRP A 36 -7.139 0.919 1.614 1.00 43.03 C ATOM 622 CD2 TRP A 36 -5.534 -0.624 1.730 1.00 11.23 C ATOM 623 NE1 TRP A 36 -6.069 1.368 0.883 1.00 23.31 N ATOM 624 CE2 TRP A 36 -5.073 0.439 0.939 1.00 31.41 C ATOM 625 CE3 TRP A 36 -4.695 -1.717 1.944 1.00 43.14 C ATOM 626 CZ2 TRP A 36 -3.812 0.439 0.359 1.00 41.22 C ATOM 627 CZ3 TRP A 36 -3.442 -1.719 1.374 1.00 62.41 C ATOM 628 CH2 TRP A 36 -3.010 -0.649 0.592 1.00 70.11 C ATOM 0 H TRP A 36 -8.019 1.351 4.243 1.00 52.41 H new ATOM 0 HA TRP A 36 -8.281 -1.474 5.154 1.00 65.15 H new ATOM 0 HB2 TRP A 36 -7.437 -2.161 3.010 1.00 4.23 H new ATOM 0 HB3 TRP A 36 -8.764 -1.050 2.738 1.00 4.23 H new ATOM 0 HD1 TRP A 36 -8.075 1.446 1.725 1.00 43.03 H new ATOM 0 HE1 TRP A 36 -6.026 2.254 0.379 1.00 23.31 H new ATOM 0 HE3 TRP A 36 -5.023 -2.550 2.548 1.00 43.14 H new ATOM 0 HZ2 TRP A 36 -3.475 1.264 -0.252 1.00 41.22 H new ATOM 0 HZ3 TRP A 36 -2.785 -2.561 1.535 1.00 62.41 H new ATOM 0 HH2 TRP A 36 -2.021 -0.677 0.160 1.00 70.11 H new ATOM 639 N PHE A 37 -5.446 0.281 4.822 1.00 62.32 N ATOM 640 CA PHE A 37 -3.997 0.331 5.157 1.00 73.22 C ATOM 641 C PHE A 37 -3.773 0.705 6.648 1.00 25.33 C ATOM 642 O PHE A 37 -3.597 1.873 6.983 1.00 3.31 O ATOM 643 CB PHE A 37 -3.266 1.333 4.208 1.00 44.05 C ATOM 644 CG PHE A 37 -1.734 1.345 4.333 1.00 41.42 C ATOM 645 CD1 PHE A 37 -0.953 0.414 3.645 1.00 53.04 C ATOM 646 CD2 PHE A 37 -1.077 2.285 5.135 1.00 14.02 C ATOM 647 CE1 PHE A 37 0.428 0.422 3.757 1.00 4.53 C ATOM 648 CE2 PHE A 37 0.302 2.290 5.245 1.00 31.33 C ATOM 649 CZ PHE A 37 1.054 1.362 4.556 1.00 72.35 C ATOM 0 H PHE A 37 -5.766 1.086 4.284 1.00 62.32 H new ATOM 0 HA PHE A 37 -3.574 -0.662 5.008 1.00 73.22 H new ATOM 0 HB2 PHE A 37 -3.530 1.093 3.178 1.00 44.05 H new ATOM 0 HB3 PHE A 37 -3.640 2.337 4.407 1.00 44.05 H new ATOM 0 HD1 PHE A 37 -1.432 -0.322 3.017 1.00 53.04 H new ATOM 0 HD2 PHE A 37 -1.656 3.018 5.677 1.00 14.02 H new ATOM 0 HE1 PHE A 37 1.017 -0.307 3.220 1.00 4.53 H new ATOM 0 HE2 PHE A 37 0.790 3.022 5.871 1.00 31.33 H new ATOM 0 HZ PHE A 37 2.131 1.369 4.640 1.00 72.35 H new ATOM 659 N HIS A 38 -3.825 -0.305 7.533 1.00 30.11 N ATOM 660 CA HIS A 38 -3.581 -0.143 8.990 1.00 75.02 C ATOM 661 C HIS A 38 -3.372 -1.525 9.658 1.00 23.23 C ATOM 662 O HIS A 38 -3.932 -2.524 9.187 1.00 1.54 O ATOM 663 CB HIS A 38 -4.746 0.632 9.686 1.00 1.25 C ATOM 664 CG HIS A 38 -6.109 0.029 9.497 1.00 61.32 C ATOM 665 ND1 HIS A 38 -6.604 -0.989 10.286 1.00 42.01 N ATOM 666 CD2 HIS A 38 -7.083 0.317 8.609 1.00 62.41 C ATOM 667 CE1 HIS A 38 -7.819 -1.301 9.886 1.00 11.25 C ATOM 668 NE2 HIS A 38 -8.134 -0.522 8.872 1.00 65.52 N ATOM 0 H HIS A 38 -4.038 -1.265 7.263 1.00 30.11 H new ATOM 0 HA HIS A 38 -2.674 0.449 9.112 1.00 75.02 H new ATOM 0 HB2 HIS A 38 -4.536 0.692 10.754 1.00 1.25 H new ATOM 0 HB3 HIS A 38 -4.761 1.654 9.306 1.00 1.25 H new ATOM 0 HD2 HIS A 38 -7.042 1.069 7.835 1.00 62.41 H new ATOM 0 HE1 HIS A 38 -8.450 -2.065 10.316 1.00 11.25 H new ATOM 0 HE2 HIS A 38 -9.018 -0.540 8.364 1.00 65.52 H new ATOM 677 N PRO A 39 -2.574 -1.606 10.779 1.00 42.00 N ATOM 678 CA PRO A 39 -2.340 -2.889 11.499 1.00 12.30 C ATOM 679 C PRO A 39 -3.586 -3.401 12.279 1.00 3.03 C ATOM 680 O PRO A 39 -4.627 -2.726 12.352 1.00 71.35 O ATOM 681 CB PRO A 39 -1.161 -2.545 12.446 1.00 74.22 C ATOM 682 CG PRO A 39 -1.310 -1.079 12.709 1.00 60.14 C ATOM 683 CD PRO A 39 -1.827 -0.480 11.417 1.00 42.34 C ATOM 0 HA PRO A 39 -2.125 -3.710 10.815 1.00 12.30 H new ATOM 0 HB2 PRO A 39 -1.212 -3.122 13.370 1.00 74.22 H new ATOM 0 HB3 PRO A 39 -0.200 -2.770 11.983 1.00 74.22 H new ATOM 0 HG2 PRO A 39 -2.004 -0.897 13.530 1.00 60.14 H new ATOM 0 HG3 PRO A 39 -0.357 -0.633 12.993 1.00 60.14 H new ATOM 0 HD2 PRO A 39 -2.476 0.376 11.604 1.00 42.34 H new ATOM 0 HD3 PRO A 39 -1.012 -0.130 10.783 1.00 42.34 H new ATOM 691 N GLN A 40 -3.449 -4.605 12.863 1.00 2.30 N ATOM 692 CA GLN A 40 -4.552 -5.318 13.546 1.00 22.03 C ATOM 693 C GLN A 40 -4.927 -4.635 14.889 1.00 62.43 C ATOM 694 O GLN A 40 -4.046 -4.350 15.712 1.00 21.11 O ATOM 695 CB GLN A 40 -4.138 -6.796 13.772 1.00 44.12 C ATOM 696 CG GLN A 40 -3.766 -7.556 12.476 1.00 62.13 C ATOM 697 CD GLN A 40 -3.215 -8.963 12.728 1.00 24.50 C ATOM 698 OE1 GLN A 40 -2.014 -9.159 12.883 1.00 71.21 O ATOM 699 NE2 GLN A 40 -4.085 -9.953 12.769 1.00 44.22 N ATOM 0 H GLN A 40 -2.567 -5.116 12.876 1.00 2.30 H new ATOM 0 HA GLN A 40 -5.439 -5.282 12.914 1.00 22.03 H new ATOM 0 HB2 GLN A 40 -3.287 -6.823 14.453 1.00 44.12 H new ATOM 0 HB3 GLN A 40 -4.957 -7.320 14.265 1.00 44.12 H new ATOM 0 HG2 GLN A 40 -4.649 -7.629 11.841 1.00 62.13 H new ATOM 0 HG3 GLN A 40 -3.024 -6.977 11.925 1.00 62.13 H new ATOM 0 HE21 GLN A 40 -5.079 -9.764 12.637 1.00 44.22 H new ATOM 0 HE22 GLN A 40 -3.764 -10.907 12.933 1.00 44.22 H new ATOM 708 N ASP A 41 -6.245 -4.369 15.074 1.00 63.45 N ATOM 709 CA ASP A 41 -6.812 -3.694 16.278 1.00 40.50 C ATOM 710 C ASP A 41 -6.306 -2.229 16.439 1.00 11.33 C ATOM 711 O ASP A 41 -6.360 -1.656 17.536 1.00 20.55 O ATOM 712 CB ASP A 41 -6.542 -4.532 17.563 1.00 41.21 C ATOM 713 CG ASP A 41 -7.127 -5.948 17.477 1.00 23.21 C ATOM 714 OD1 ASP A 41 -8.312 -6.140 17.830 1.00 54.11 O ATOM 715 OD2 ASP A 41 -6.418 -6.876 17.027 1.00 64.53 O ATOM 0 H ASP A 41 -6.955 -4.619 14.386 1.00 63.45 H new ATOM 0 HA ASP A 41 -7.890 -3.632 16.129 1.00 40.50 H new ATOM 0 HB2 ASP A 41 -5.467 -4.596 17.731 1.00 41.21 H new ATOM 0 HB3 ASP A 41 -6.969 -4.018 18.424 1.00 41.21 H new ATOM 720 N ALA A 42 -5.856 -1.615 15.324 1.00 21.03 N ATOM 721 CA ALA A 42 -5.342 -0.223 15.311 1.00 74.43 C ATOM 722 C ALA A 42 -5.759 0.532 14.023 1.00 60.13 C ATOM 723 O ALA A 42 -6.084 -0.076 13.000 1.00 53.32 O ATOM 724 CB ALA A 42 -3.813 -0.223 15.476 1.00 25.01 C ATOM 0 H ALA A 42 -5.837 -2.066 14.409 1.00 21.03 H new ATOM 0 HA ALA A 42 -5.788 0.308 16.152 1.00 74.43 H new ATOM 0 HB1 ALA A 42 -3.446 0.803 15.465 1.00 25.01 H new ATOM 0 HB2 ALA A 42 -3.549 -0.693 16.424 1.00 25.01 H new ATOM 0 HB3 ALA A 42 -3.359 -0.780 14.656 1.00 25.01 H new ATOM 730 N SER A 43 -5.730 1.868 14.106 1.00 45.41 N ATOM 731 CA SER A 43 -6.147 2.794 13.023 1.00 45.01 C ATOM 732 C SER A 43 -4.929 3.553 12.433 1.00 10.20 C ATOM 733 O SER A 43 -3.776 3.259 12.770 1.00 52.23 O ATOM 734 CB SER A 43 -7.202 3.787 13.578 1.00 62.41 C ATOM 735 OG SER A 43 -8.344 3.097 14.069 1.00 0.14 O ATOM 0 H SER A 43 -5.410 2.355 14.943 1.00 45.41 H new ATOM 0 HA SER A 43 -6.589 2.215 12.213 1.00 45.01 H new ATOM 0 HB2 SER A 43 -6.761 4.382 14.378 1.00 62.41 H new ATOM 0 HB3 SER A 43 -7.502 4.481 12.793 1.00 62.41 H new ATOM 0 HG SER A 43 -8.994 3.744 14.415 1.00 0.14 H new ATOM 741 N VAL A 44 -5.198 4.488 11.503 1.00 21.23 N ATOM 742 CA VAL A 44 -4.164 5.343 10.874 1.00 33.33 C ATOM 743 C VAL A 44 -4.737 6.761 10.575 1.00 4.33 C ATOM 744 O VAL A 44 -5.768 6.904 9.910 1.00 44.43 O ATOM 745 CB VAL A 44 -3.596 4.661 9.565 1.00 33.23 C ATOM 746 CG1 VAL A 44 -4.735 4.247 8.611 1.00 42.34 C ATOM 747 CG2 VAL A 44 -2.556 5.553 8.831 1.00 23.33 C ATOM 0 H VAL A 44 -6.141 4.675 11.163 1.00 21.23 H new ATOM 0 HA VAL A 44 -3.335 5.458 11.572 1.00 33.33 H new ATOM 0 HB VAL A 44 -3.072 3.761 9.886 1.00 33.23 H new ATOM 0 HG11 VAL A 44 -4.313 3.781 7.721 1.00 42.34 H new ATOM 0 HG12 VAL A 44 -5.392 3.538 9.115 1.00 42.34 H new ATOM 0 HG13 VAL A 44 -5.307 5.129 8.323 1.00 42.34 H new ATOM 0 HG21 VAL A 44 -2.199 5.037 7.940 1.00 23.33 H new ATOM 0 HG22 VAL A 44 -3.023 6.494 8.542 1.00 23.33 H new ATOM 0 HG23 VAL A 44 -1.716 5.754 9.495 1.00 23.33 H new ATOM 757 N THR A 45 -4.079 7.800 11.120 1.00 15.11 N ATOM 758 CA THR A 45 -4.434 9.220 10.876 1.00 44.12 C ATOM 759 C THR A 45 -3.680 9.773 9.645 1.00 54.40 C ATOM 760 O THR A 45 -2.464 9.960 9.699 1.00 73.03 O ATOM 761 CB THR A 45 -4.087 10.113 12.119 1.00 63.21 C ATOM 762 OG1 THR A 45 -4.711 9.574 13.292 1.00 23.13 O ATOM 763 CG2 THR A 45 -4.526 11.590 11.936 1.00 21.34 C ATOM 0 H THR A 45 -3.282 7.683 11.746 1.00 15.11 H new ATOM 0 HA THR A 45 -5.508 9.254 10.695 1.00 44.12 H new ATOM 0 HB THR A 45 -3.002 10.105 12.225 1.00 63.21 H new ATOM 0 HG1 THR A 45 -4.491 10.133 14.066 1.00 23.13 H new ATOM 0 HG21 THR A 45 -4.261 12.161 12.826 1.00 21.34 H new ATOM 0 HG22 THR A 45 -4.021 12.015 11.068 1.00 21.34 H new ATOM 0 HG23 THR A 45 -5.605 11.633 11.785 1.00 21.34 H new ATOM 771 N VAL A 46 -4.401 10.030 8.541 1.00 52.15 N ATOM 772 CA VAL A 46 -3.829 10.697 7.350 1.00 4.44 C ATOM 773 C VAL A 46 -4.008 12.232 7.471 1.00 24.35 C ATOM 774 O VAL A 46 -5.130 12.743 7.403 1.00 3.00 O ATOM 775 CB VAL A 46 -4.477 10.177 6.010 1.00 30.40 C ATOM 776 CG1 VAL A 46 -3.799 10.827 4.771 1.00 24.03 C ATOM 777 CG2 VAL A 46 -4.427 8.625 5.925 1.00 15.30 C ATOM 0 H VAL A 46 -5.387 9.786 8.445 1.00 52.15 H new ATOM 0 HA VAL A 46 -2.767 10.453 7.312 1.00 4.44 H new ATOM 0 HB VAL A 46 -5.525 10.475 6.012 1.00 30.40 H new ATOM 0 HG11 VAL A 46 -4.266 10.450 3.861 1.00 24.03 H new ATOM 0 HG12 VAL A 46 -3.917 11.910 4.818 1.00 24.03 H new ATOM 0 HG13 VAL A 46 -2.738 10.578 4.764 1.00 24.03 H new ATOM 0 HG21 VAL A 46 -4.881 8.297 4.990 1.00 15.30 H new ATOM 0 HG22 VAL A 46 -3.390 8.292 5.961 1.00 15.30 H new ATOM 0 HG23 VAL A 46 -4.975 8.197 6.764 1.00 15.30 H new ATOM 787 N TYR A 47 -2.890 12.947 7.672 1.00 44.02 N ATOM 788 CA TYR A 47 -2.871 14.423 7.820 1.00 73.10 C ATOM 789 C TYR A 47 -3.041 15.123 6.452 1.00 53.43 C ATOM 790 O TYR A 47 -3.800 16.095 6.320 1.00 54.31 O ATOM 791 CB TYR A 47 -1.538 14.868 8.477 1.00 61.52 C ATOM 792 CG TYR A 47 -1.345 14.364 9.916 1.00 21.33 C ATOM 793 CD1 TYR A 47 -0.967 13.044 10.179 1.00 12.50 C ATOM 794 CD2 TYR A 47 -1.547 15.209 11.011 1.00 12.31 C ATOM 795 CE1 TYR A 47 -0.806 12.591 11.474 1.00 14.33 C ATOM 796 CE2 TYR A 47 -1.382 14.758 12.306 1.00 13.03 C ATOM 797 CZ TYR A 47 -1.013 13.452 12.533 1.00 52.35 C ATOM 798 OH TYR A 47 -0.857 13.002 13.831 1.00 44.10 O ATOM 0 H TYR A 47 -1.965 12.521 7.738 1.00 44.02 H new ATOM 0 HA TYR A 47 -3.707 14.713 8.457 1.00 73.10 H new ATOM 0 HB2 TYR A 47 -0.708 14.513 7.865 1.00 61.52 H new ATOM 0 HB3 TYR A 47 -1.491 15.957 8.476 1.00 61.52 H new ATOM 0 HD1 TYR A 47 -0.798 12.366 9.355 1.00 12.50 H new ATOM 0 HD2 TYR A 47 -1.838 16.235 10.841 1.00 12.31 H new ATOM 0 HE1 TYR A 47 -0.519 11.566 11.657 1.00 14.33 H new ATOM 0 HE2 TYR A 47 -1.542 15.428 13.138 1.00 13.03 H new ATOM 0 HH TYR A 47 0.097 12.901 14.030 1.00 44.10 H new ATOM 808 N ASP A 48 -2.324 14.601 5.446 1.00 52.10 N ATOM 809 CA ASP A 48 -2.268 15.175 4.090 1.00 50.12 C ATOM 810 C ASP A 48 -2.037 14.053 3.047 1.00 55.01 C ATOM 811 O ASP A 48 -1.412 13.038 3.360 1.00 4.43 O ATOM 812 CB ASP A 48 -1.140 16.240 4.031 1.00 53.22 C ATOM 813 CG ASP A 48 -1.065 16.963 2.683 1.00 73.14 C ATOM 814 OD1 ASP A 48 -2.095 17.521 2.246 1.00 51.44 O ATOM 815 OD2 ASP A 48 0.008 16.967 2.046 1.00 40.41 O ATOM 0 H ASP A 48 -1.759 13.758 5.551 1.00 52.10 H new ATOM 0 HA ASP A 48 -3.216 15.659 3.854 1.00 50.12 H new ATOM 0 HB2 ASP A 48 -1.300 16.973 4.821 1.00 53.22 H new ATOM 0 HB3 ASP A 48 -0.183 15.758 4.232 1.00 53.22 H new ATOM 820 N PHE A 49 -2.527 14.251 1.804 1.00 12.25 N ATOM 821 CA PHE A 49 -2.522 13.186 0.771 1.00 23.24 C ATOM 822 C PHE A 49 -2.569 13.791 -0.658 1.00 74.31 C ATOM 823 O PHE A 49 -3.463 14.578 -0.972 1.00 70.54 O ATOM 824 CB PHE A 49 -3.743 12.250 1.014 1.00 44.52 C ATOM 825 CG PHE A 49 -3.652 10.844 0.405 1.00 11.01 C ATOM 826 CD1 PHE A 49 -3.838 10.627 -0.958 1.00 24.04 C ATOM 827 CD2 PHE A 49 -3.421 9.729 1.216 1.00 24.11 C ATOM 828 CE1 PHE A 49 -3.787 9.351 -1.482 1.00 3.54 C ATOM 829 CE2 PHE A 49 -3.382 8.460 0.686 1.00 15.33 C ATOM 830 CZ PHE A 49 -3.563 8.269 -0.662 1.00 11.44 C ATOM 0 H PHE A 49 -2.930 15.134 1.490 1.00 12.25 H new ATOM 0 HA PHE A 49 -1.598 12.613 0.848 1.00 23.24 H new ATOM 0 HB2 PHE A 49 -3.888 12.149 2.090 1.00 44.52 H new ATOM 0 HB3 PHE A 49 -4.633 12.738 0.617 1.00 44.52 H new ATOM 0 HD1 PHE A 49 -4.024 11.466 -1.612 1.00 24.04 H new ATOM 0 HD2 PHE A 49 -3.271 9.866 2.277 1.00 24.11 H new ATOM 0 HE1 PHE A 49 -3.924 9.201 -2.543 1.00 3.54 H new ATOM 0 HE2 PHE A 49 -3.209 7.612 1.332 1.00 15.33 H new ATOM 0 HZ PHE A 49 -3.530 7.273 -1.077 1.00 11.44 H new ATOM 840 N ASN A 50 -1.613 13.385 -1.509 1.00 74.24 N ATOM 841 CA ASN A 50 -1.548 13.776 -2.936 1.00 1.21 C ATOM 842 C ASN A 50 -0.967 12.600 -3.757 1.00 55.12 C ATOM 843 O ASN A 50 0.243 12.338 -3.716 1.00 4.44 O ATOM 844 CB ASN A 50 -0.676 15.054 -3.117 1.00 61.22 C ATOM 845 CG ASN A 50 -0.633 15.571 -4.559 1.00 11.44 C ATOM 846 OD1 ASN A 50 -1.605 15.477 -5.298 1.00 34.31 O ATOM 847 ND2 ASN A 50 0.496 16.101 -4.981 1.00 50.24 N ATOM 0 H ASN A 50 -0.851 12.768 -1.227 1.00 74.24 H new ATOM 0 HA ASN A 50 -2.552 14.005 -3.293 1.00 1.21 H new ATOM 0 HB2 ASN A 50 -1.062 15.841 -2.469 1.00 61.22 H new ATOM 0 HB3 ASN A 50 0.340 14.839 -2.787 1.00 61.22 H new ATOM 0 HD21 ASN A 50 0.572 16.442 -5.939 1.00 50.24 H new ATOM 0 HD22 ASN A 50 1.294 16.170 -4.350 1.00 50.24 H new ATOM 854 N ALA A 51 -1.838 11.888 -4.489 1.00 42.23 N ATOM 855 CA ALA A 51 -1.443 10.705 -5.277 1.00 65.43 C ATOM 856 C ALA A 51 -1.336 11.034 -6.782 1.00 5.34 C ATOM 857 O ALA A 51 -2.317 10.958 -7.537 1.00 50.50 O ATOM 858 CB ALA A 51 -2.415 9.560 -5.020 1.00 71.40 C ATOM 0 H ALA A 51 -2.831 12.113 -4.553 1.00 42.23 H new ATOM 0 HA ALA A 51 -0.450 10.392 -4.954 1.00 65.43 H new ATOM 0 HB1 ALA A 51 -2.116 8.691 -5.606 1.00 71.40 H new ATOM 0 HB2 ALA A 51 -2.405 9.305 -3.960 1.00 71.40 H new ATOM 0 HB3 ALA A 51 -3.421 9.864 -5.310 1.00 71.40 H new ATOM 864 N THR A 52 -0.125 11.422 -7.189 1.00 32.21 N ATOM 865 CA THR A 52 0.214 11.739 -8.593 1.00 42.41 C ATOM 866 C THR A 52 1.736 11.601 -8.806 1.00 50.24 C ATOM 867 O THR A 52 2.485 11.496 -7.836 1.00 3.02 O ATOM 868 CB THR A 52 -0.259 13.183 -8.997 1.00 2.10 C ATOM 869 OG1 THR A 52 0.075 13.452 -10.372 1.00 4.10 O ATOM 870 CG2 THR A 52 0.349 14.274 -8.087 1.00 41.22 C ATOM 0 H THR A 52 0.663 11.529 -6.550 1.00 32.21 H new ATOM 0 HA THR A 52 -0.312 11.030 -9.232 1.00 42.41 H new ATOM 0 HB THR A 52 -1.341 13.213 -8.870 1.00 2.10 H new ATOM 0 HG1 THR A 52 -0.226 14.353 -10.612 1.00 4.10 H new ATOM 0 HG21 THR A 52 -0.007 15.254 -8.406 1.00 41.22 H new ATOM 0 HG22 THR A 52 0.048 14.096 -7.055 1.00 41.22 H new ATOM 0 HG23 THR A 52 1.436 14.243 -8.158 1.00 41.22 H new ATOM 878 N LYS A 53 2.187 11.579 -10.070 1.00 60.21 N ATOM 879 CA LYS A 53 3.633 11.554 -10.399 1.00 44.23 C ATOM 880 C LYS A 53 4.330 12.855 -9.888 1.00 25.41 C ATOM 881 O LYS A 53 4.071 13.961 -10.381 1.00 23.32 O ATOM 882 CB LYS A 53 3.904 11.298 -11.927 1.00 1.14 C ATOM 883 CG LYS A 53 3.213 12.246 -12.947 1.00 25.34 C ATOM 884 CD LYS A 53 1.724 11.899 -13.196 1.00 73.02 C ATOM 885 CE LYS A 53 1.034 12.884 -14.153 1.00 20.55 C ATOM 886 NZ LYS A 53 -0.415 12.594 -14.294 1.00 31.22 N ATOM 0 H LYS A 53 1.575 11.578 -10.886 1.00 60.21 H new ATOM 0 HA LYS A 53 4.074 10.705 -9.877 1.00 44.23 H new ATOM 0 HB2 LYS A 53 4.980 11.354 -12.092 1.00 1.14 H new ATOM 0 HB3 LYS A 53 3.599 10.277 -12.156 1.00 1.14 H new ATOM 0 HG2 LYS A 53 3.284 13.272 -12.585 1.00 25.34 H new ATOM 0 HG3 LYS A 53 3.752 12.204 -13.894 1.00 25.34 H new ATOM 0 HD2 LYS A 53 1.654 10.892 -13.607 1.00 73.02 H new ATOM 0 HD3 LYS A 53 1.193 11.893 -12.244 1.00 73.02 H new ATOM 0 HE2 LYS A 53 1.167 13.901 -13.785 1.00 20.55 H new ATOM 0 HE3 LYS A 53 1.511 12.834 -15.132 1.00 20.55 H new ATOM 0 HZ1 LYS A 53 -0.844 13.280 -14.947 1.00 31.22 H new ATOM 0 HZ2 LYS A 53 -0.542 11.632 -14.669 1.00 31.22 H new ATOM 0 HZ3 LYS A 53 -0.876 12.666 -13.364 1.00 31.22 H new ATOM 900 N GLY A 54 5.198 12.696 -8.866 1.00 2.22 N ATOM 901 CA GLY A 54 5.781 13.834 -8.128 1.00 24.32 C ATOM 902 C GLY A 54 4.931 14.281 -6.922 1.00 15.14 C ATOM 903 O GLY A 54 5.034 15.430 -6.470 1.00 34.13 O ATOM 0 H GLY A 54 5.511 11.784 -8.533 1.00 2.22 H new ATOM 0 HA2 GLY A 54 6.777 13.560 -7.780 1.00 24.32 H new ATOM 0 HA3 GLY A 54 5.902 14.676 -8.810 1.00 24.32 H new ATOM 907 N GLY A 55 4.091 13.360 -6.400 1.00 24.03 N ATOM 908 CA GLY A 55 3.188 13.639 -5.263 1.00 40.10 C ATOM 909 C GLY A 55 3.719 13.136 -3.909 1.00 43.11 C ATOM 910 O GLY A 55 4.827 12.597 -3.834 1.00 65.23 O ATOM 0 H GLY A 55 4.020 12.406 -6.754 1.00 24.03 H new ATOM 0 HA2 GLY A 55 3.020 14.714 -5.200 1.00 40.10 H new ATOM 0 HA3 GLY A 55 2.220 13.176 -5.458 1.00 40.10 H new ATOM 914 N SER A 56 2.907 13.298 -2.840 1.00 14.31 N ATOM 915 CA SER A 56 3.297 12.930 -1.449 1.00 71.10 C ATOM 916 C SER A 56 2.060 12.758 -0.533 1.00 71.21 C ATOM 917 O SER A 56 1.047 13.425 -0.723 1.00 70.40 O ATOM 918 CB SER A 56 4.240 14.007 -0.851 1.00 55.10 C ATOM 919 OG SER A 56 4.569 13.727 0.502 1.00 24.04 O ATOM 0 H SER A 56 1.966 13.685 -2.910 1.00 14.31 H new ATOM 0 HA SER A 56 3.818 11.974 -1.499 1.00 71.10 H new ATOM 0 HB2 SER A 56 5.153 14.060 -1.444 1.00 55.10 H new ATOM 0 HB3 SER A 56 3.762 14.984 -0.914 1.00 55.10 H new ATOM 0 HG SER A 56 5.491 13.398 0.553 1.00 24.04 H new ATOM 925 N ALA A 57 2.165 11.878 0.485 1.00 4.32 N ATOM 926 CA ALA A 57 1.071 11.621 1.456 1.00 24.51 C ATOM 927 C ALA A 57 1.617 11.480 2.894 1.00 32.52 C ATOM 928 O ALA A 57 2.254 10.480 3.221 1.00 32.13 O ATOM 929 CB ALA A 57 0.277 10.365 1.055 1.00 61.11 C ATOM 0 H ALA A 57 3.005 11.326 0.660 1.00 4.32 H new ATOM 0 HA ALA A 57 0.400 12.480 1.437 1.00 24.51 H new ATOM 0 HB1 ALA A 57 -0.520 10.192 1.778 1.00 61.11 H new ATOM 0 HB2 ALA A 57 -0.156 10.509 0.065 1.00 61.11 H new ATOM 0 HB3 ALA A 57 0.944 9.503 1.038 1.00 61.11 H new ATOM 935 N PHE A 58 1.348 12.483 3.750 1.00 75.53 N ATOM 936 CA PHE A 58 1.784 12.488 5.166 1.00 55.24 C ATOM 937 C PHE A 58 0.695 11.851 6.059 1.00 63.55 C ATOM 938 O PHE A 58 -0.422 12.364 6.160 1.00 51.31 O ATOM 939 CB PHE A 58 2.106 13.944 5.623 1.00 13.11 C ATOM 940 CG PHE A 58 2.517 14.113 7.099 1.00 42.22 C ATOM 941 CD1 PHE A 58 3.356 13.192 7.736 1.00 1.13 C ATOM 942 CD2 PHE A 58 2.076 15.210 7.842 1.00 20.42 C ATOM 943 CE1 PHE A 58 3.733 13.361 9.054 1.00 12.13 C ATOM 944 CE2 PHE A 58 2.452 15.375 9.163 1.00 30.14 C ATOM 945 CZ PHE A 58 3.279 14.451 9.767 1.00 74.20 C ATOM 0 H PHE A 58 0.822 13.315 3.483 1.00 75.53 H new ATOM 0 HA PHE A 58 2.693 11.894 5.263 1.00 55.24 H new ATOM 0 HB2 PHE A 58 2.909 14.331 4.996 1.00 13.11 H new ATOM 0 HB3 PHE A 58 1.229 14.564 5.437 1.00 13.11 H new ATOM 0 HD1 PHE A 58 3.715 12.334 7.187 1.00 1.13 H new ATOM 0 HD2 PHE A 58 1.431 15.941 7.378 1.00 20.42 H new ATOM 0 HE1 PHE A 58 4.383 12.640 9.526 1.00 12.13 H new ATOM 0 HE2 PHE A 58 2.098 16.228 9.722 1.00 30.14 H new ATOM 0 HZ PHE A 58 3.571 14.581 10.799 1.00 74.20 H new ATOM 955 N TYR A 59 1.041 10.728 6.705 1.00 2.23 N ATOM 956 CA TYR A 59 0.137 10.008 7.624 1.00 22.21 C ATOM 957 C TYR A 59 0.888 9.534 8.893 1.00 14.22 C ATOM 958 O TYR A 59 2.076 9.826 9.074 1.00 72.53 O ATOM 959 CB TYR A 59 -0.558 8.823 6.878 1.00 40.42 C ATOM 960 CG TYR A 59 0.380 7.743 6.294 1.00 71.23 C ATOM 961 CD1 TYR A 59 0.937 7.871 5.011 1.00 23.24 C ATOM 962 CD2 TYR A 59 0.686 6.582 7.015 1.00 13.33 C ATOM 963 CE1 TYR A 59 1.768 6.893 4.484 1.00 31.42 C ATOM 964 CE2 TYR A 59 1.511 5.603 6.488 1.00 22.34 C ATOM 965 CZ TYR A 59 2.045 5.760 5.224 1.00 55.40 C ATOM 966 OH TYR A 59 2.862 4.775 4.702 1.00 43.23 O ATOM 0 H TYR A 59 1.957 10.290 6.607 1.00 2.23 H new ATOM 0 HA TYR A 59 -0.641 10.695 7.958 1.00 22.21 H new ATOM 0 HB2 TYR A 59 -1.248 8.340 7.570 1.00 40.42 H new ATOM 0 HB3 TYR A 59 -1.157 9.234 6.065 1.00 40.42 H new ATOM 0 HD1 TYR A 59 0.714 8.749 4.423 1.00 23.24 H new ATOM 0 HD2 TYR A 59 0.270 6.448 8.002 1.00 13.33 H new ATOM 0 HE1 TYR A 59 2.196 7.017 3.500 1.00 31.42 H new ATOM 0 HE2 TYR A 59 1.737 4.718 7.064 1.00 22.34 H new ATOM 0 HH TYR A 59 2.398 3.912 4.738 1.00 43.23 H new ATOM 976 N ALA A 60 0.163 8.832 9.781 1.00 43.24 N ATOM 977 CA ALA A 60 0.711 8.270 11.033 1.00 34.32 C ATOM 978 C ALA A 60 -0.160 7.095 11.513 1.00 22.10 C ATOM 979 O ALA A 60 -1.381 7.167 11.445 1.00 22.35 O ATOM 980 CB ALA A 60 0.799 9.347 12.131 1.00 54.32 C ATOM 0 H ALA A 60 -0.829 8.636 9.651 1.00 43.24 H new ATOM 0 HA ALA A 60 1.719 7.908 10.830 1.00 34.32 H new ATOM 0 HB1 ALA A 60 1.205 8.906 13.041 1.00 54.32 H new ATOM 0 HB2 ALA A 60 1.450 10.155 11.797 1.00 54.32 H new ATOM 0 HB3 ALA A 60 -0.196 9.743 12.333 1.00 54.32 H new ATOM 986 N ILE A 61 0.476 6.030 12.010 1.00 30.21 N ATOM 987 CA ILE A 61 -0.214 4.841 12.540 1.00 64.33 C ATOM 988 C ILE A 61 -0.779 5.145 13.949 1.00 74.33 C ATOM 989 O ILE A 61 -0.026 5.271 14.923 1.00 63.12 O ATOM 990 CB ILE A 61 0.768 3.603 12.582 1.00 52.41 C ATOM 991 CG1 ILE A 61 1.290 3.259 11.146 1.00 54.43 C ATOM 992 CG2 ILE A 61 0.123 2.362 13.261 1.00 40.21 C ATOM 993 CD1 ILE A 61 0.211 2.871 10.138 1.00 64.14 C ATOM 0 H ILE A 61 1.493 5.964 12.058 1.00 30.21 H new ATOM 0 HA ILE A 61 -1.044 4.589 11.879 1.00 64.33 H new ATOM 0 HB ILE A 61 1.621 3.888 13.197 1.00 52.41 H new ATOM 0 HG12 ILE A 61 1.834 4.120 10.758 1.00 54.43 H new ATOM 0 HG13 ILE A 61 2.004 2.439 11.223 1.00 54.43 H new ATOM 0 HG21 ILE A 61 0.836 1.538 13.266 1.00 40.21 H new ATOM 0 HG22 ILE A 61 -0.152 2.610 14.286 1.00 40.21 H new ATOM 0 HG23 ILE A 61 -0.769 2.067 12.708 1.00 40.21 H new ATOM 0 HD11 ILE A 61 0.674 2.652 9.176 1.00 64.14 H new ATOM 0 HD12 ILE A 61 -0.320 1.988 10.495 1.00 64.14 H new ATOM 0 HD13 ILE A 61 -0.493 3.695 10.023 1.00 64.14 H new ATOM 1005 N GLN A 62 -2.112 5.300 14.024 1.00 52.45 N ATOM 1006 CA GLN A 62 -2.824 5.639 15.268 1.00 24.33 C ATOM 1007 C GLN A 62 -3.219 4.339 16.014 1.00 1.13 C ATOM 1008 O GLN A 62 -4.214 3.694 15.688 1.00 24.24 O ATOM 1009 CB GLN A 62 -4.084 6.519 14.937 1.00 5.45 C ATOM 1010 CG GLN A 62 -4.424 7.574 16.017 1.00 51.15 C ATOM 1011 CD GLN A 62 -4.739 6.978 17.395 1.00 52.13 C ATOM 1012 OE1 GLN A 62 -5.404 5.953 17.522 1.00 40.22 O ATOM 1013 NE2 GLN A 62 -4.229 7.590 18.434 1.00 43.01 N ATOM 0 H GLN A 62 -2.729 5.193 13.219 1.00 52.45 H new ATOM 0 HA GLN A 62 -2.172 6.219 15.921 1.00 24.33 H new ATOM 0 HB2 GLN A 62 -3.918 7.028 13.988 1.00 5.45 H new ATOM 0 HB3 GLN A 62 -4.945 5.864 14.801 1.00 5.45 H new ATOM 0 HG2 GLN A 62 -3.585 8.263 16.114 1.00 51.15 H new ATOM 0 HG3 GLN A 62 -5.280 8.159 15.682 1.00 51.15 H new ATOM 0 HE21 GLN A 62 -3.680 8.440 18.306 1.00 43.01 H new ATOM 0 HE22 GLN A 62 -4.381 7.217 19.371 1.00 43.01 H new ATOM 1022 N ALA A 63 -2.419 3.969 17.008 1.00 1.32 N ATOM 1023 CA ALA A 63 -2.727 2.871 17.944 1.00 12.34 C ATOM 1024 C ALA A 63 -3.201 3.460 19.299 1.00 72.04 C ATOM 1025 O ALA A 63 -2.853 4.608 19.616 1.00 52.21 O ATOM 1026 CB ALA A 63 -1.480 1.976 18.111 1.00 61.31 C ATOM 0 H ALA A 63 -1.525 4.423 17.197 1.00 1.32 H new ATOM 0 HA ALA A 63 -3.534 2.253 17.550 1.00 12.34 H new ATOM 0 HB1 ALA A 63 -1.705 1.164 18.802 1.00 61.31 H new ATOM 0 HB2 ALA A 63 -1.198 1.561 17.143 1.00 61.31 H new ATOM 0 HB3 ALA A 63 -0.656 2.570 18.505 1.00 61.31 H new ATOM 1032 N PRO A 64 -3.991 2.690 20.138 1.00 54.20 N ATOM 1033 CA PRO A 64 -4.439 3.166 21.488 1.00 4.21 C ATOM 1034 C PRO A 64 -3.265 3.501 22.467 1.00 1.22 C ATOM 1035 O PRO A 64 -3.477 4.130 23.511 1.00 72.04 O ATOM 1036 CB PRO A 64 -5.314 1.983 22.013 1.00 32.24 C ATOM 1037 CG PRO A 64 -4.882 0.793 21.204 1.00 53.35 C ATOM 1038 CD PRO A 64 -4.547 1.336 19.836 1.00 53.51 C ATOM 0 HA PRO A 64 -4.976 4.112 21.420 1.00 4.21 H new ATOM 0 HB2 PRO A 64 -5.154 1.816 23.078 1.00 32.24 H new ATOM 0 HB3 PRO A 64 -6.376 2.187 21.879 1.00 32.24 H new ATOM 0 HG2 PRO A 64 -4.018 0.305 21.655 1.00 53.35 H new ATOM 0 HG3 PRO A 64 -5.676 0.048 21.147 1.00 53.35 H new ATOM 0 HD2 PRO A 64 -3.821 0.708 19.319 1.00 53.51 H new ATOM 0 HD3 PRO A 64 -5.429 1.395 19.198 1.00 53.51 H new ATOM 1046 N GLN A 65 -2.038 3.074 22.111 1.00 41.34 N ATOM 1047 CA GLN A 65 -0.805 3.377 22.870 1.00 41.53 C ATOM 1048 C GLN A 65 0.159 4.275 22.041 1.00 2.14 C ATOM 1049 O GLN A 65 0.501 5.383 22.459 1.00 10.41 O ATOM 1050 CB GLN A 65 -0.109 2.048 23.267 1.00 24.13 C ATOM 1051 CG GLN A 65 1.220 2.198 24.047 1.00 41.21 C ATOM 1052 CD GLN A 65 1.928 0.861 24.299 1.00 21.33 C ATOM 1053 OE1 GLN A 65 1.812 -0.071 23.508 1.00 33.24 O ATOM 1054 NE2 GLN A 65 2.681 0.765 25.376 1.00 30.45 N ATOM 0 H GLN A 65 -1.871 2.504 21.282 1.00 41.34 H new ATOM 0 HA GLN A 65 -1.072 3.929 23.771 1.00 41.53 H new ATOM 0 HB2 GLN A 65 -0.801 1.463 23.872 1.00 24.13 H new ATOM 0 HB3 GLN A 65 0.085 1.475 22.360 1.00 24.13 H new ATOM 0 HG2 GLN A 65 1.888 2.856 23.491 1.00 41.21 H new ATOM 0 HG3 GLN A 65 1.020 2.681 25.003 1.00 41.21 H new ATOM 0 HE21 GLN A 65 2.759 1.555 26.016 1.00 30.45 H new ATOM 0 HE22 GLN A 65 3.186 -0.100 25.570 1.00 30.45 H new ATOM 1063 N MET A 66 0.589 3.778 20.863 1.00 74.42 N ATOM 1064 CA MET A 66 1.651 4.422 20.034 1.00 42.35 C ATOM 1065 C MET A 66 1.066 5.214 18.831 1.00 21.14 C ATOM 1066 O MET A 66 0.141 4.749 18.176 1.00 75.23 O ATOM 1067 CB MET A 66 2.604 3.317 19.498 1.00 42.22 C ATOM 1068 CG MET A 66 3.836 3.827 18.725 1.00 72.53 C ATOM 1069 SD MET A 66 4.659 2.521 17.784 1.00 61.23 S ATOM 1070 CE MET A 66 3.444 2.165 16.506 1.00 14.24 C ATOM 0 H MET A 66 0.216 2.922 20.453 1.00 74.42 H new ATOM 0 HA MET A 66 2.184 5.132 20.667 1.00 42.35 H new ATOM 0 HB2 MET A 66 2.947 2.717 20.340 1.00 42.22 H new ATOM 0 HB3 MET A 66 2.035 2.655 18.846 1.00 42.22 H new ATOM 0 HG2 MET A 66 3.530 4.621 18.045 1.00 72.53 H new ATOM 0 HG3 MET A 66 4.545 4.265 19.428 1.00 72.53 H new ATOM 0 HE1 MET A 66 3.935 1.679 15.663 1.00 14.24 H new ATOM 0 HE2 MET A 66 2.675 1.505 16.908 1.00 14.24 H new ATOM 0 HE3 MET A 66 2.985 3.095 16.171 1.00 14.24 H new ATOM 1080 N ILE A 67 1.628 6.410 18.539 1.00 60.14 N ATOM 1081 CA ILE A 67 1.333 7.166 17.286 1.00 65.50 C ATOM 1082 C ILE A 67 2.667 7.447 16.550 1.00 11.34 C ATOM 1083 O ILE A 67 3.460 8.288 16.992 1.00 45.04 O ATOM 1084 CB ILE A 67 0.574 8.526 17.574 1.00 51.10 C ATOM 1085 CG1 ILE A 67 -0.716 8.274 18.429 1.00 4.22 C ATOM 1086 CG2 ILE A 67 0.227 9.263 16.246 1.00 45.41 C ATOM 1087 CD1 ILE A 67 -1.443 9.533 18.881 1.00 22.31 C ATOM 0 H ILE A 67 2.293 6.879 19.154 1.00 60.14 H new ATOM 0 HA ILE A 67 0.674 6.559 16.665 1.00 65.50 H new ATOM 0 HB ILE A 67 1.240 9.169 18.149 1.00 51.10 H new ATOM 0 HG12 ILE A 67 -1.406 7.663 17.847 1.00 4.22 H new ATOM 0 HG13 ILE A 67 -0.442 7.694 19.310 1.00 4.22 H new ATOM 0 HG21 ILE A 67 -0.294 10.194 16.472 1.00 45.41 H new ATOM 0 HG22 ILE A 67 1.145 9.484 15.702 1.00 45.41 H new ATOM 0 HG23 ILE A 67 -0.414 8.628 15.634 1.00 45.41 H new ATOM 0 HD11 ILE A 67 -2.321 9.256 19.465 1.00 22.31 H new ATOM 0 HD12 ILE A 67 -0.775 10.138 19.494 1.00 22.31 H new ATOM 0 HD13 ILE A 67 -1.754 10.107 18.008 1.00 22.31 H new ATOM 1099 N SER A 68 2.913 6.737 15.429 1.00 2.13 N ATOM 1100 CA SER A 68 4.216 6.793 14.700 1.00 63.42 C ATOM 1101 C SER A 68 4.029 7.293 13.251 1.00 64.11 C ATOM 1102 O SER A 68 3.205 6.771 12.511 1.00 54.24 O ATOM 1103 CB SER A 68 4.896 5.403 14.709 1.00 11.05 C ATOM 1104 OG SER A 68 4.098 4.421 14.056 1.00 45.21 O ATOM 0 H SER A 68 2.229 6.113 15.001 1.00 2.13 H new ATOM 0 HA SER A 68 4.860 7.505 15.217 1.00 63.42 H new ATOM 0 HB2 SER A 68 5.866 5.470 14.217 1.00 11.05 H new ATOM 0 HB3 SER A 68 5.081 5.095 15.738 1.00 11.05 H new ATOM 0 HG SER A 68 3.512 4.857 13.403 1.00 45.21 H new ATOM 1110 N TYR A 69 4.839 8.283 12.845 1.00 35.41 N ATOM 1111 CA TYR A 69 4.623 9.072 11.603 1.00 22.14 C ATOM 1112 C TYR A 69 5.401 8.505 10.393 1.00 42.04 C ATOM 1113 O TYR A 69 6.569 8.136 10.517 1.00 43.14 O ATOM 1114 CB TYR A 69 5.021 10.551 11.870 1.00 13.02 C ATOM 1115 CG TYR A 69 4.139 11.239 12.930 1.00 43.32 C ATOM 1116 CD1 TYR A 69 4.205 10.870 14.279 1.00 65.03 C ATOM 1117 CD2 TYR A 69 3.216 12.224 12.579 1.00 41.50 C ATOM 1118 CE1 TYR A 69 3.393 11.458 15.226 1.00 63.40 C ATOM 1119 CE2 TYR A 69 2.399 12.812 13.522 1.00 24.11 C ATOM 1120 CZ TYR A 69 2.486 12.426 14.843 1.00 21.11 C ATOM 1121 OH TYR A 69 1.649 13.004 15.778 1.00 12.54 O ATOM 0 H TYR A 69 5.669 8.567 13.366 1.00 35.41 H new ATOM 0 HA TYR A 69 3.567 9.009 11.341 1.00 22.14 H new ATOM 0 HB2 TYR A 69 6.061 10.587 12.194 1.00 13.02 H new ATOM 0 HB3 TYR A 69 4.958 11.111 10.937 1.00 13.02 H new ATOM 0 HD1 TYR A 69 4.907 10.108 14.585 1.00 65.03 H new ATOM 0 HD2 TYR A 69 3.139 12.533 11.547 1.00 41.50 H new ATOM 0 HE1 TYR A 69 3.466 11.163 16.262 1.00 63.40 H new ATOM 0 HE2 TYR A 69 1.692 13.573 13.226 1.00 24.11 H new ATOM 0 HH TYR A 69 1.243 13.811 15.399 1.00 12.54 H new ATOM 1131 N THR A 70 4.748 8.495 9.209 1.00 2.14 N ATOM 1132 CA THR A 70 5.316 7.936 7.952 1.00 34.32 C ATOM 1133 C THR A 70 4.733 8.681 6.716 1.00 52.42 C ATOM 1134 O THR A 70 3.545 8.994 6.683 1.00 50.32 O ATOM 1135 CB THR A 70 5.013 6.395 7.818 1.00 13.51 C ATOM 1136 OG1 THR A 70 5.345 5.710 9.038 1.00 45.41 O ATOM 1137 CG2 THR A 70 5.794 5.750 6.658 1.00 31.33 C ATOM 0 H THR A 70 3.808 8.875 9.094 1.00 2.14 H new ATOM 0 HA THR A 70 6.396 8.077 7.991 1.00 34.32 H new ATOM 0 HB THR A 70 3.947 6.300 7.612 1.00 13.51 H new ATOM 0 HG1 THR A 70 5.150 4.755 8.940 1.00 45.41 H new ATOM 0 HG21 THR A 70 5.554 4.688 6.604 1.00 31.33 H new ATOM 0 HG22 THR A 70 5.518 6.233 5.721 1.00 31.33 H new ATOM 0 HG23 THR A 70 6.864 5.872 6.827 1.00 31.33 H new ATOM 1145 N ILE A 71 5.580 8.970 5.709 1.00 72.34 N ATOM 1146 CA ILE A 71 5.173 9.657 4.449 1.00 22.25 C ATOM 1147 C ILE A 71 5.446 8.754 3.216 1.00 45.42 C ATOM 1148 O ILE A 71 6.492 8.123 3.133 1.00 45.15 O ATOM 1149 CB ILE A 71 5.959 11.016 4.264 1.00 73.21 C ATOM 1150 CG1 ILE A 71 5.816 11.915 5.531 1.00 14.31 C ATOM 1151 CG2 ILE A 71 5.487 11.768 2.989 1.00 43.31 C ATOM 1152 CD1 ILE A 71 6.561 13.239 5.477 1.00 22.13 C ATOM 0 H ILE A 71 6.572 8.736 5.738 1.00 72.34 H new ATOM 0 HA ILE A 71 4.105 9.863 4.524 1.00 22.25 H new ATOM 0 HB ILE A 71 7.015 10.779 4.136 1.00 73.21 H new ATOM 0 HG12 ILE A 71 4.758 12.119 5.694 1.00 14.31 H new ATOM 0 HG13 ILE A 71 6.169 11.354 6.396 1.00 14.31 H new ATOM 0 HG21 ILE A 71 6.045 12.699 2.888 1.00 43.31 H new ATOM 0 HG22 ILE A 71 5.661 11.143 2.113 1.00 43.31 H new ATOM 0 HG23 ILE A 71 4.423 11.990 3.070 1.00 43.31 H new ATOM 0 HD11 ILE A 71 6.397 13.787 6.405 1.00 22.13 H new ATOM 0 HD12 ILE A 71 7.627 13.052 5.350 1.00 22.13 H new ATOM 0 HD13 ILE A 71 6.194 13.829 4.637 1.00 22.13 H new ATOM 1164 N ALA A 72 4.500 8.701 2.260 1.00 52.13 N ATOM 1165 CA ALA A 72 4.714 8.026 0.958 1.00 54.12 C ATOM 1166 C ALA A 72 4.859 9.070 -0.180 1.00 73.11 C ATOM 1167 O ALA A 72 3.920 9.815 -0.461 1.00 33.00 O ATOM 1168 CB ALA A 72 3.545 7.063 0.680 1.00 12.44 C ATOM 0 H ALA A 72 3.575 9.118 2.362 1.00 52.13 H new ATOM 0 HA ALA A 72 5.639 7.451 0.999 1.00 54.12 H new ATOM 0 HB1 ALA A 72 3.702 6.567 -0.278 1.00 12.44 H new ATOM 0 HB2 ALA A 72 3.493 6.316 1.472 1.00 12.44 H new ATOM 0 HB3 ALA A 72 2.611 7.624 0.649 1.00 12.44 H new ATOM 1174 N GLU A 73 6.042 9.120 -0.824 1.00 21.11 N ATOM 1175 CA GLU A 73 6.286 9.972 -2.010 1.00 70.11 C ATOM 1176 C GLU A 73 5.852 9.235 -3.297 1.00 31.20 C ATOM 1177 O GLU A 73 6.501 8.273 -3.706 1.00 2.00 O ATOM 1178 CB GLU A 73 7.801 10.320 -2.111 1.00 12.42 C ATOM 1179 CG GLU A 73 8.403 11.048 -0.891 1.00 41.34 C ATOM 1180 CD GLU A 73 7.849 12.466 -0.656 1.00 13.10 C ATOM 1181 OE1 GLU A 73 7.862 13.287 -1.603 1.00 63.35 O ATOM 1182 OE2 GLU A 73 7.446 12.782 0.483 1.00 22.12 O ATOM 0 H GLU A 73 6.855 8.573 -0.539 1.00 21.11 H new ATOM 0 HA GLU A 73 5.704 10.887 -1.903 1.00 70.11 H new ATOM 0 HB2 GLU A 73 8.357 9.396 -2.271 1.00 12.42 H new ATOM 0 HB3 GLU A 73 7.954 10.941 -2.994 1.00 12.42 H new ATOM 0 HG2 GLU A 73 8.221 10.448 0.001 1.00 41.34 H new ATOM 0 HG3 GLU A 73 9.484 11.110 -1.018 1.00 41.34 H new ATOM 1189 N TYR A 74 4.794 9.718 -3.959 1.00 52.03 N ATOM 1190 CA TYR A 74 4.281 9.095 -5.201 1.00 53.44 C ATOM 1191 C TYR A 74 5.166 9.500 -6.401 1.00 72.24 C ATOM 1192 O TYR A 74 5.061 10.612 -6.916 1.00 31.43 O ATOM 1193 CB TYR A 74 2.788 9.468 -5.420 1.00 73.50 C ATOM 1194 CG TYR A 74 1.839 8.850 -4.376 1.00 31.15 C ATOM 1195 CD1 TYR A 74 1.737 9.387 -3.090 1.00 64.52 C ATOM 1196 CD2 TYR A 74 1.063 7.716 -4.667 1.00 74.45 C ATOM 1197 CE1 TYR A 74 0.907 8.822 -2.142 1.00 34.03 C ATOM 1198 CE2 TYR A 74 0.227 7.155 -3.716 1.00 60.33 C ATOM 1199 CZ TYR A 74 0.156 7.708 -2.456 1.00 53.51 C ATOM 1200 OH TYR A 74 -0.670 7.149 -1.503 1.00 32.44 O ATOM 0 H TYR A 74 4.270 10.541 -3.660 1.00 52.03 H new ATOM 0 HA TYR A 74 4.330 8.010 -5.108 1.00 53.44 H new ATOM 0 HB2 TYR A 74 2.686 10.553 -5.395 1.00 73.50 H new ATOM 0 HB3 TYR A 74 2.483 9.142 -6.414 1.00 73.50 H new ATOM 0 HD1 TYR A 74 2.318 10.260 -2.833 1.00 64.52 H new ATOM 0 HD2 TYR A 74 1.119 7.273 -5.651 1.00 74.45 H new ATOM 0 HE1 TYR A 74 0.846 9.253 -1.153 1.00 34.03 H new ATOM 0 HE2 TYR A 74 -0.367 6.287 -3.961 1.00 60.33 H new ATOM 0 HH TYR A 74 -1.492 7.677 -1.432 1.00 32.44 H new ATOM 1210 N LEU A 75 6.066 8.582 -6.806 1.00 31.33 N ATOM 1211 CA LEU A 75 7.072 8.829 -7.863 1.00 75.22 C ATOM 1212 C LEU A 75 6.374 8.876 -9.250 1.00 65.33 C ATOM 1213 O LEU A 75 6.477 9.870 -9.980 1.00 41.25 O ATOM 1214 CB LEU A 75 8.183 7.721 -7.789 1.00 35.41 C ATOM 1215 CG LEU A 75 9.601 8.051 -8.398 1.00 30.13 C ATOM 1216 CD1 LEU A 75 10.623 6.939 -8.056 1.00 51.34 C ATOM 1217 CD2 LEU A 75 9.564 8.286 -9.929 1.00 60.10 C ATOM 0 H LEU A 75 6.117 7.644 -6.409 1.00 31.33 H new ATOM 0 HA LEU A 75 7.556 9.794 -7.712 1.00 75.22 H new ATOM 0 HB2 LEU A 75 8.323 7.458 -6.740 1.00 35.41 H new ATOM 0 HB3 LEU A 75 7.802 6.832 -8.292 1.00 35.41 H new ATOM 0 HG LEU A 75 9.918 8.987 -7.938 1.00 30.13 H new ATOM 0 HD11 LEU A 75 11.592 7.190 -8.487 1.00 51.34 H new ATOM 0 HD12 LEU A 75 10.719 6.853 -6.974 1.00 51.34 H new ATOM 0 HD13 LEU A 75 10.279 5.990 -8.466 1.00 51.34 H new ATOM 0 HD21 LEU A 75 10.569 8.508 -10.287 1.00 60.10 H new ATOM 0 HD22 LEU A 75 9.192 7.390 -10.426 1.00 60.10 H new ATOM 0 HD23 LEU A 75 8.905 9.125 -10.152 1.00 60.10 H new ATOM 1229 N GLN A 76 5.656 7.791 -9.588 1.00 5.12 N ATOM 1230 CA GLN A 76 4.920 7.671 -10.868 1.00 62.05 C ATOM 1231 C GLN A 76 3.521 7.053 -10.651 1.00 51.11 C ATOM 1232 O GLN A 76 3.373 6.034 -9.988 1.00 64.24 O ATOM 1233 CB GLN A 76 5.736 6.820 -11.885 1.00 22.40 C ATOM 1234 CG GLN A 76 5.016 6.498 -13.223 1.00 74.23 C ATOM 1235 CD GLN A 76 4.572 7.728 -14.030 1.00 1.25 C ATOM 1236 OE1 GLN A 76 3.513 7.581 -14.803 1.00 44.11 O flip ATOM 1237 NE2 GLN A 76 5.181 8.792 -13.977 1.00 31.41 N flip ATOM 0 H GLN A 76 5.567 6.972 -8.986 1.00 5.12 H new ATOM 0 HA GLN A 76 4.787 8.673 -11.275 1.00 62.05 H new ATOM 0 HB2 GLN A 76 6.663 7.347 -12.110 1.00 22.40 H new ATOM 0 HB3 GLN A 76 6.011 5.880 -11.406 1.00 22.40 H new ATOM 0 HG2 GLN A 76 5.682 5.896 -13.842 1.00 74.23 H new ATOM 0 HG3 GLN A 76 4.140 5.886 -13.009 1.00 74.23 H new ATOM 0 HE21 GLN A 76 5.997 8.883 -13.372 1.00 31.41 H new ATOM 0 HE22 GLN A 76 4.871 9.586 -14.538 1.00 31.41 H new ATOM 1246 N VAL A 77 2.494 7.703 -11.216 1.00 52.43 N ATOM 1247 CA VAL A 77 1.117 7.171 -11.275 1.00 62.34 C ATOM 1248 C VAL A 77 0.679 7.116 -12.760 1.00 41.31 C ATOM 1249 O VAL A 77 0.578 8.157 -13.421 1.00 21.43 O ATOM 1250 CB VAL A 77 0.131 8.049 -10.406 1.00 73.12 C ATOM 1251 CG1 VAL A 77 -1.339 7.607 -10.583 1.00 14.22 C ATOM 1252 CG2 VAL A 77 0.535 8.013 -8.903 1.00 0.51 C ATOM 0 H VAL A 77 2.592 8.621 -11.650 1.00 52.43 H new ATOM 0 HA VAL A 77 1.088 6.166 -10.854 1.00 62.34 H new ATOM 0 HB VAL A 77 0.212 9.076 -10.763 1.00 73.12 H new ATOM 0 HG11 VAL A 77 -1.984 8.235 -9.969 1.00 14.22 H new ATOM 0 HG12 VAL A 77 -1.625 7.706 -11.630 1.00 14.22 H new ATOM 0 HG13 VAL A 77 -1.446 6.567 -10.275 1.00 14.22 H new ATOM 0 HG21 VAL A 77 -0.158 8.624 -8.325 1.00 0.51 H new ATOM 0 HG22 VAL A 77 0.500 6.985 -8.541 1.00 0.51 H new ATOM 0 HG23 VAL A 77 1.546 8.404 -8.789 1.00 0.51 H new ATOM 1262 N ASP A 78 0.475 5.894 -13.287 1.00 43.32 N ATOM 1263 CA ASP A 78 0.138 5.654 -14.713 1.00 74.20 C ATOM 1264 C ASP A 78 -1.228 4.931 -14.839 1.00 44.33 C ATOM 1265 O ASP A 78 -1.303 3.712 -14.615 1.00 20.42 O ATOM 1266 CB ASP A 78 1.268 4.811 -15.368 1.00 40.03 C ATOM 1267 CG ASP A 78 1.049 4.558 -16.872 1.00 21.13 C ATOM 1268 OD1 ASP A 78 1.281 5.489 -17.674 1.00 33.23 O ATOM 1269 OD2 ASP A 78 0.648 3.433 -17.262 1.00 24.10 O ATOM 0 H ASP A 78 0.538 5.037 -12.737 1.00 43.32 H new ATOM 0 HA ASP A 78 0.056 6.610 -15.230 1.00 74.20 H new ATOM 0 HB2 ASP A 78 2.220 5.322 -15.228 1.00 40.03 H new ATOM 0 HB3 ASP A 78 1.342 3.853 -14.853 1.00 40.03 H new ATOM 1274 N ALA A 79 -2.301 5.703 -15.172 1.00 42.41 N ATOM 1275 CA ALA A 79 -3.687 5.172 -15.346 1.00 41.52 C ATOM 1276 C ALA A 79 -4.263 4.542 -14.022 1.00 31.42 C ATOM 1277 O ALA A 79 -3.575 4.557 -12.995 1.00 11.13 O ATOM 1278 CB ALA A 79 -3.701 4.178 -16.537 1.00 75.43 C ATOM 0 H ALA A 79 -2.231 6.709 -15.327 1.00 42.41 H new ATOM 0 HA ALA A 79 -4.356 6.001 -15.575 1.00 41.52 H new ATOM 0 HB1 ALA A 79 -4.709 3.785 -16.671 1.00 75.43 H new ATOM 0 HB2 ALA A 79 -3.388 4.694 -17.445 1.00 75.43 H new ATOM 0 HB3 ALA A 79 -3.015 3.356 -16.333 1.00 75.43 H new ATOM 1284 N PRO A 80 -5.543 4.001 -13.986 1.00 3.40 N ATOM 1285 CA PRO A 80 -6.005 3.122 -12.863 1.00 25.23 C ATOM 1286 C PRO A 80 -5.284 1.742 -12.743 1.00 64.55 C ATOM 1287 O PRO A 80 -5.718 0.892 -11.961 1.00 42.42 O ATOM 1288 CB PRO A 80 -7.522 2.917 -13.154 1.00 70.15 C ATOM 1289 CG PRO A 80 -7.891 4.058 -14.056 1.00 1.22 C ATOM 1290 CD PRO A 80 -6.668 4.309 -14.912 1.00 4.13 C ATOM 0 HA PRO A 80 -5.779 3.598 -11.909 1.00 25.23 H new ATOM 0 HB2 PRO A 80 -7.707 1.956 -13.634 1.00 70.15 H new ATOM 0 HB3 PRO A 80 -8.108 2.933 -12.235 1.00 70.15 H new ATOM 0 HG2 PRO A 80 -8.756 3.808 -14.671 1.00 1.22 H new ATOM 0 HG3 PRO A 80 -8.155 4.945 -13.479 1.00 1.22 H new ATOM 0 HD2 PRO A 80 -6.653 3.667 -15.793 1.00 4.13 H new ATOM 0 HD3 PRO A 80 -6.628 5.339 -15.267 1.00 4.13 H new ATOM 1298 N TYR A 81 -4.184 1.535 -13.495 1.00 72.14 N ATOM 1299 CA TYR A 81 -3.580 0.201 -13.718 1.00 22.31 C ATOM 1300 C TYR A 81 -2.169 0.056 -13.089 1.00 72.32 C ATOM 1301 O TYR A 81 -1.810 -1.034 -12.620 1.00 52.33 O ATOM 1302 CB TYR A 81 -3.544 -0.069 -15.247 1.00 43.33 C ATOM 1303 CG TYR A 81 -4.949 -0.156 -15.877 1.00 45.12 C ATOM 1304 CD1 TYR A 81 -5.618 0.989 -16.310 1.00 74.50 C ATOM 1305 CD2 TYR A 81 -5.618 -1.379 -15.996 1.00 40.11 C ATOM 1306 CE1 TYR A 81 -6.891 0.920 -16.842 1.00 73.21 C ATOM 1307 CE2 TYR A 81 -6.893 -1.448 -16.522 1.00 21.22 C ATOM 1308 CZ TYR A 81 -7.524 -0.295 -16.943 1.00 72.11 C ATOM 1309 OH TYR A 81 -8.800 -0.361 -17.465 1.00 3.14 O ATOM 0 H TYR A 81 -3.686 2.290 -13.967 1.00 72.14 H new ATOM 0 HA TYR A 81 -4.197 -0.543 -13.214 1.00 22.31 H new ATOM 0 HB2 TYR A 81 -2.981 0.725 -15.737 1.00 43.33 H new ATOM 0 HB3 TYR A 81 -3.010 -1.001 -15.433 1.00 43.33 H new ATOM 0 HD1 TYR A 81 -5.131 1.949 -16.228 1.00 74.50 H new ATOM 0 HD2 TYR A 81 -5.129 -2.285 -15.671 1.00 40.11 H new ATOM 0 HE1 TYR A 81 -7.387 1.819 -17.178 1.00 73.21 H new ATOM 0 HE2 TYR A 81 -7.395 -2.401 -16.604 1.00 21.22 H new ATOM 0 HH TYR A 81 -9.104 -1.293 -17.468 1.00 3.14 H new ATOM 1319 N TYR A 82 -1.366 1.141 -13.084 1.00 1.05 N ATOM 1320 CA TYR A 82 0.018 1.110 -12.534 1.00 21.45 C ATOM 1321 C TYR A 82 0.232 2.214 -11.472 1.00 41.54 C ATOM 1322 O TYR A 82 -0.045 3.392 -11.715 1.00 65.14 O ATOM 1323 CB TYR A 82 1.062 1.255 -13.673 1.00 71.20 C ATOM 1324 CG TYR A 82 2.527 1.050 -13.217 1.00 74.24 C ATOM 1325 CD1 TYR A 82 3.031 -0.235 -12.998 1.00 32.05 C ATOM 1326 CD2 TYR A 82 3.393 2.131 -12.999 1.00 21.32 C ATOM 1327 CE1 TYR A 82 4.336 -0.437 -12.586 1.00 20.53 C ATOM 1328 CE2 TYR A 82 4.701 1.931 -12.583 1.00 61.12 C ATOM 1329 CZ TYR A 82 5.165 0.646 -12.382 1.00 52.42 C ATOM 1330 OH TYR A 82 6.469 0.439 -11.986 1.00 61.14 O ATOM 0 H TYR A 82 -1.646 2.050 -13.452 1.00 1.05 H new ATOM 0 HA TYR A 82 0.156 0.144 -12.048 1.00 21.45 H new ATOM 0 HB2 TYR A 82 0.832 0.533 -14.456 1.00 71.20 H new ATOM 0 HB3 TYR A 82 0.966 2.246 -14.116 1.00 71.20 H new ATOM 0 HD1 TYR A 82 2.388 -1.089 -13.154 1.00 32.05 H new ATOM 0 HD2 TYR A 82 3.035 3.138 -13.158 1.00 21.32 H new ATOM 0 HE1 TYR A 82 4.704 -1.439 -12.425 1.00 20.53 H new ATOM 0 HE2 TYR A 82 5.353 2.776 -12.417 1.00 61.12 H new ATOM 0 HH TYR A 82 6.922 1.302 -11.886 1.00 61.14 H new ATOM 1340 N ILE A 83 0.737 1.806 -10.294 1.00 61.31 N ATOM 1341 CA ILE A 83 1.097 2.713 -9.184 1.00 74.32 C ATOM 1342 C ILE A 83 2.601 2.530 -8.850 1.00 64.41 C ATOM 1343 O ILE A 83 3.113 1.408 -8.887 1.00 64.21 O ATOM 1344 CB ILE A 83 0.257 2.430 -7.865 1.00 70.20 C ATOM 1345 CG1 ILE A 83 -1.296 2.371 -8.122 1.00 25.44 C ATOM 1346 CG2 ILE A 83 0.591 3.472 -6.762 1.00 22.33 C ATOM 1347 CD1 ILE A 83 -1.820 1.043 -8.671 1.00 71.44 C ATOM 0 H ILE A 83 0.910 0.824 -10.081 1.00 61.31 H new ATOM 0 HA ILE A 83 0.877 3.729 -9.513 1.00 74.32 H new ATOM 0 HB ILE A 83 0.553 1.440 -7.519 1.00 70.20 H new ATOM 0 HG12 ILE A 83 -1.811 2.586 -7.185 1.00 25.44 H new ATOM 0 HG13 ILE A 83 -1.562 3.164 -8.821 1.00 25.44 H new ATOM 0 HG21 ILE A 83 0.004 3.258 -5.869 1.00 22.33 H new ATOM 0 HG22 ILE A 83 1.652 3.418 -6.520 1.00 22.33 H new ATOM 0 HG23 ILE A 83 0.351 4.473 -7.122 1.00 22.33 H new ATOM 0 HD11 ILE A 83 -2.899 1.108 -8.812 1.00 71.44 H new ATOM 0 HD12 ILE A 83 -1.341 0.830 -9.627 1.00 71.44 H new ATOM 0 HD13 ILE A 83 -1.594 0.243 -7.966 1.00 71.44 H new ATOM 1359 N GLU A 84 3.296 3.630 -8.532 1.00 72.24 N ATOM 1360 CA GLU A 84 4.675 3.599 -7.993 1.00 51.10 C ATOM 1361 C GLU A 84 4.841 4.689 -6.912 1.00 21.11 C ATOM 1362 O GLU A 84 4.554 5.869 -7.164 1.00 63.43 O ATOM 1363 CB GLU A 84 5.729 3.801 -9.123 1.00 55.21 C ATOM 1364 CG GLU A 84 7.192 3.900 -8.625 1.00 65.52 C ATOM 1365 CD GLU A 84 8.209 4.090 -9.763 1.00 34.42 C ATOM 1366 OE1 GLU A 84 8.297 5.205 -10.303 1.00 14.30 O ATOM 1367 OE2 GLU A 84 8.922 3.124 -10.125 1.00 5.24 O ATOM 0 H GLU A 84 2.922 4.573 -8.639 1.00 72.24 H new ATOM 0 HA GLU A 84 4.844 2.619 -7.548 1.00 51.10 H new ATOM 0 HB2 GLU A 84 5.653 2.972 -9.826 1.00 55.21 H new ATOM 0 HB3 GLU A 84 5.484 4.709 -9.674 1.00 55.21 H new ATOM 0 HG2 GLU A 84 7.276 4.734 -7.929 1.00 65.52 H new ATOM 0 HG3 GLU A 84 7.442 2.995 -8.071 1.00 65.52 H new ATOM 1374 N TYR A 85 5.311 4.291 -5.714 1.00 50.32 N ATOM 1375 CA TYR A 85 5.628 5.231 -4.621 1.00 14.23 C ATOM 1376 C TYR A 85 6.837 4.748 -3.786 1.00 1.13 C ATOM 1377 O TYR A 85 7.279 3.594 -3.887 1.00 55.40 O ATOM 1378 CB TYR A 85 4.382 5.493 -3.716 1.00 33.24 C ATOM 1379 CG TYR A 85 3.838 4.275 -2.941 1.00 32.40 C ATOM 1380 CD1 TYR A 85 2.892 3.411 -3.510 1.00 14.12 C ATOM 1381 CD2 TYR A 85 4.265 3.993 -1.637 1.00 15.53 C ATOM 1382 CE1 TYR A 85 2.400 2.325 -2.807 1.00 14.33 C ATOM 1383 CE2 TYR A 85 3.776 2.906 -0.936 1.00 33.12 C ATOM 1384 CZ TYR A 85 2.845 2.075 -1.524 1.00 63.04 C ATOM 1385 OH TYR A 85 2.355 0.982 -0.831 1.00 1.22 O ATOM 0 H TYR A 85 5.481 3.314 -5.477 1.00 50.32 H new ATOM 0 HA TYR A 85 5.908 6.179 -5.080 1.00 14.23 H new ATOM 0 HB2 TYR A 85 4.638 6.271 -2.997 1.00 33.24 H new ATOM 0 HB3 TYR A 85 3.581 5.888 -4.341 1.00 33.24 H new ATOM 0 HD1 TYR A 85 2.541 3.596 -4.514 1.00 14.12 H new ATOM 0 HD2 TYR A 85 4.993 4.639 -1.169 1.00 15.53 H new ATOM 0 HE1 TYR A 85 1.668 1.673 -3.262 1.00 14.33 H new ATOM 0 HE2 TYR A 85 4.122 2.708 0.068 1.00 33.12 H new ATOM 0 HH TYR A 85 2.768 0.945 0.057 1.00 1.22 H new ATOM 1395 N LEU A 86 7.352 5.662 -2.956 1.00 64.10 N ATOM 1396 CA LEU A 86 8.493 5.439 -2.061 1.00 22.32 C ATOM 1397 C LEU A 86 8.032 5.683 -0.616 1.00 21.44 C ATOM 1398 O LEU A 86 7.535 6.763 -0.308 1.00 52.44 O ATOM 1399 CB LEU A 86 9.629 6.436 -2.418 1.00 25.53 C ATOM 1400 CG LEU A 86 10.180 6.384 -3.878 1.00 72.11 C ATOM 1401 CD1 LEU A 86 11.120 7.576 -4.154 1.00 21.32 C ATOM 1402 CD2 LEU A 86 10.889 5.041 -4.167 1.00 32.31 C ATOM 0 H LEU A 86 6.974 6.607 -2.887 1.00 64.10 H new ATOM 0 HA LEU A 86 8.864 4.420 -2.169 1.00 22.32 H new ATOM 0 HB2 LEU A 86 9.266 7.446 -2.228 1.00 25.53 H new ATOM 0 HB3 LEU A 86 10.460 6.262 -1.735 1.00 25.53 H new ATOM 0 HG LEU A 86 9.329 6.459 -4.555 1.00 72.11 H new ATOM 0 HD11 LEU A 86 11.491 7.518 -5.177 1.00 21.32 H new ATOM 0 HD12 LEU A 86 10.573 8.509 -4.019 1.00 21.32 H new ATOM 0 HD13 LEU A 86 11.961 7.544 -3.461 1.00 21.32 H new ATOM 0 HD21 LEU A 86 11.260 5.039 -5.192 1.00 32.31 H new ATOM 0 HD22 LEU A 86 11.724 4.915 -3.478 1.00 32.31 H new ATOM 0 HD23 LEU A 86 10.183 4.221 -4.035 1.00 32.31 H new ATOM 1414 N ASP A 87 8.209 4.705 0.265 1.00 25.01 N ATOM 1415 CA ASP A 87 7.833 4.831 1.672 1.00 3.11 C ATOM 1416 C ASP A 87 9.034 5.400 2.458 1.00 11.41 C ATOM 1417 O ASP A 87 10.043 4.723 2.648 1.00 63.11 O ATOM 1418 CB ASP A 87 7.393 3.449 2.229 1.00 53.14 C ATOM 1419 CG ASP A 87 6.861 3.538 3.669 1.00 61.34 C ATOM 1420 OD1 ASP A 87 5.673 3.883 3.845 1.00 30.33 O ATOM 1421 OD2 ASP A 87 7.635 3.283 4.626 1.00 44.33 O ATOM 0 H ASP A 87 8.617 3.801 0.026 1.00 25.01 H new ATOM 0 HA ASP A 87 6.989 5.513 1.779 1.00 3.11 H new ATOM 0 HB2 ASP A 87 6.620 3.030 1.585 1.00 53.14 H new ATOM 0 HB3 ASP A 87 8.239 2.763 2.199 1.00 53.14 H new ATOM 1426 N TYR A 88 8.929 6.673 2.842 1.00 12.22 N ATOM 1427 CA TYR A 88 9.884 7.345 3.738 1.00 35.24 C ATOM 1428 C TYR A 88 9.312 7.367 5.162 1.00 22.43 C ATOM 1429 O TYR A 88 8.200 7.842 5.365 1.00 40.24 O ATOM 1430 CB TYR A 88 10.149 8.808 3.266 1.00 34.31 C ATOM 1431 CG TYR A 88 11.063 8.933 2.038 1.00 25.45 C ATOM 1432 CD1 TYR A 88 10.597 8.658 0.751 1.00 43.25 C ATOM 1433 CD2 TYR A 88 12.395 9.342 2.174 1.00 40.22 C ATOM 1434 CE1 TYR A 88 11.426 8.779 -0.348 1.00 51.42 C ATOM 1435 CE2 TYR A 88 13.222 9.464 1.077 1.00 24.20 C ATOM 1436 CZ TYR A 88 12.733 9.186 -0.181 1.00 63.41 C ATOM 1437 OH TYR A 88 13.557 9.308 -1.281 1.00 71.43 O ATOM 0 H TYR A 88 8.168 7.280 2.537 1.00 12.22 H new ATOM 0 HA TYR A 88 10.826 6.797 3.720 1.00 35.24 H new ATOM 0 HB2 TYR A 88 9.193 9.281 3.040 1.00 34.31 H new ATOM 0 HB3 TYR A 88 10.593 9.366 4.090 1.00 34.31 H new ATOM 0 HD1 TYR A 88 9.572 8.346 0.612 1.00 43.25 H new ATOM 0 HD2 TYR A 88 12.782 9.566 3.157 1.00 40.22 H new ATOM 0 HE1 TYR A 88 11.051 8.555 -1.336 1.00 51.42 H new ATOM 0 HE2 TYR A 88 14.248 9.776 1.203 1.00 24.20 H new ATOM 0 HH TYR A 88 14.445 9.605 -0.993 1.00 71.43 H new ATOM 1447 N PHE A 89 10.057 6.843 6.143 1.00 4.22 N ATOM 1448 CA PHE A 89 9.731 7.061 7.566 1.00 14.02 C ATOM 1449 C PHE A 89 9.830 8.574 7.880 1.00 21.13 C ATOM 1450 O PHE A 89 10.775 9.236 7.432 1.00 71.10 O ATOM 1451 CB PHE A 89 10.689 6.247 8.470 1.00 11.43 C ATOM 1452 CG PHE A 89 10.419 6.384 9.969 1.00 11.22 C ATOM 1453 CD1 PHE A 89 9.150 6.136 10.493 1.00 64.15 C ATOM 1454 CD2 PHE A 89 11.420 6.794 10.844 1.00 23.13 C ATOM 1455 CE1 PHE A 89 8.898 6.289 11.842 1.00 25.12 C ATOM 1456 CE2 PHE A 89 11.166 6.953 12.192 1.00 2.00 C ATOM 1457 CZ PHE A 89 9.905 6.700 12.689 1.00 50.00 C ATOM 0 H PHE A 89 10.885 6.268 5.984 1.00 4.22 H new ATOM 0 HA PHE A 89 8.715 6.720 7.765 1.00 14.02 H new ATOM 0 HB2 PHE A 89 10.619 5.194 8.196 1.00 11.43 H new ATOM 0 HB3 PHE A 89 11.713 6.562 8.268 1.00 11.43 H new ATOM 0 HD1 PHE A 89 8.354 5.820 9.835 1.00 64.15 H new ATOM 0 HD2 PHE A 89 12.411 6.991 10.463 1.00 23.13 H new ATOM 0 HE1 PHE A 89 7.912 6.087 12.234 1.00 25.12 H new ATOM 0 HE2 PHE A 89 11.954 7.275 12.856 1.00 2.00 H new ATOM 0 HZ PHE A 89 9.706 6.824 13.743 1.00 50.00 H new ATOM 1467 N ALA A 90 8.842 9.118 8.605 1.00 1.04 N ATOM 1468 CA ALA A 90 8.806 10.557 8.934 1.00 10.01 C ATOM 1469 C ALA A 90 9.441 10.839 10.311 1.00 73.13 C ATOM 1470 O ALA A 90 9.349 10.029 11.240 1.00 50.14 O ATOM 1471 CB ALA A 90 7.369 11.094 8.880 1.00 73.51 C ATOM 0 H ALA A 90 8.055 8.586 8.977 1.00 1.04 H new ATOM 0 HA ALA A 90 9.398 11.080 8.183 1.00 10.01 H new ATOM 0 HB1 ALA A 90 7.368 12.156 9.126 1.00 73.51 H new ATOM 0 HB2 ALA A 90 6.965 10.953 7.877 1.00 73.51 H new ATOM 0 HB3 ALA A 90 6.752 10.555 9.598 1.00 73.51 H new ATOM 1477 N THR A 91 10.070 12.020 10.424 1.00 12.31 N ATOM 1478 CA THR A 91 10.713 12.502 11.676 1.00 31.32 C ATOM 1479 C THR A 91 9.698 13.215 12.625 1.00 53.01 C ATOM 1480 O THR A 91 10.091 13.859 13.606 1.00 24.13 O ATOM 1481 CB THR A 91 11.902 13.459 11.320 1.00 41.21 C ATOM 1482 OG1 THR A 91 12.621 13.848 12.503 1.00 32.30 O ATOM 1483 CG2 THR A 91 11.428 14.712 10.560 1.00 24.11 C ATOM 0 H THR A 91 10.152 12.678 9.649 1.00 12.31 H new ATOM 0 HA THR A 91 11.091 11.633 12.215 1.00 31.32 H new ATOM 0 HB THR A 91 12.570 12.901 10.664 1.00 41.21 H new ATOM 0 HG1 THR A 91 11.990 13.974 13.242 1.00 32.30 H new ATOM 0 HG21 THR A 91 12.285 15.346 10.334 1.00 24.11 H new ATOM 0 HG22 THR A 91 10.943 14.412 9.631 1.00 24.11 H new ATOM 0 HG23 THR A 91 10.720 15.265 11.177 1.00 24.11 H new ATOM 1491 N SER A 92 8.388 13.114 12.279 1.00 52.24 N ATOM 1492 CA SER A 92 7.233 13.672 13.055 1.00 4.22 C ATOM 1493 C SER A 92 7.048 15.204 12.858 1.00 41.15 C ATOM 1494 O SER A 92 5.936 15.720 13.001 1.00 25.33 O ATOM 1495 CB SER A 92 7.291 13.306 14.570 1.00 30.32 C ATOM 1496 OG SER A 92 6.168 13.811 15.285 1.00 11.42 O ATOM 0 H SER A 92 8.091 12.631 11.431 1.00 52.24 H new ATOM 0 HA SER A 92 6.351 13.188 12.636 1.00 4.22 H new ATOM 0 HB2 SER A 92 7.333 12.222 14.680 1.00 30.32 H new ATOM 0 HB3 SER A 92 8.207 13.706 15.005 1.00 30.32 H new ATOM 0 HG SER A 92 5.443 13.152 15.264 1.00 11.42 H new ATOM 1502 N LYS A 93 8.139 15.917 12.502 1.00 72.52 N ATOM 1503 CA LYS A 93 8.122 17.375 12.195 1.00 32.33 C ATOM 1504 C LYS A 93 7.215 17.725 10.980 1.00 31.04 C ATOM 1505 O LYS A 93 6.826 18.881 10.798 1.00 52.32 O ATOM 1506 CB LYS A 93 9.569 17.840 11.885 1.00 20.53 C ATOM 1507 CG LYS A 93 10.636 17.612 12.997 1.00 1.15 C ATOM 1508 CD LYS A 93 10.546 18.584 14.214 1.00 50.14 C ATOM 1509 CE LYS A 93 9.521 18.170 15.291 1.00 62.41 C ATOM 1510 NZ LYS A 93 9.592 19.060 16.475 1.00 20.15 N ATOM 0 H LYS A 93 9.066 15.499 12.417 1.00 72.52 H new ATOM 0 HA LYS A 93 7.715 17.886 13.067 1.00 32.33 H new ATOM 0 HB2 LYS A 93 9.904 17.328 10.983 1.00 20.53 H new ATOM 0 HB3 LYS A 93 9.541 18.905 11.655 1.00 20.53 H new ATOM 0 HG2 LYS A 93 10.544 16.589 13.362 1.00 1.15 H new ATOM 0 HG3 LYS A 93 11.627 17.704 12.552 1.00 1.15 H new ATOM 0 HD2 LYS A 93 11.530 18.658 14.677 1.00 50.14 H new ATOM 0 HD3 LYS A 93 10.289 19.579 13.850 1.00 50.14 H new ATOM 0 HE2 LYS A 93 8.516 18.201 14.870 1.00 62.41 H new ATOM 0 HE3 LYS A 93 9.707 17.140 15.596 1.00 62.41 H new ATOM 0 HZ1 LYS A 93 8.891 18.756 17.181 1.00 20.15 H new ATOM 0 HZ2 LYS A 93 10.544 19.011 16.890 1.00 20.15 H new ATOM 0 HZ3 LYS A 93 9.390 20.039 16.186 1.00 20.15 H new ATOM 1524 N GLY A 94 6.904 16.704 10.158 1.00 12.13 N ATOM 1525 CA GLY A 94 6.170 16.874 8.898 1.00 34.13 C ATOM 1526 C GLY A 94 7.024 16.516 7.680 1.00 23.10 C ATOM 1527 O GLY A 94 6.546 16.576 6.542 1.00 33.25 O ATOM 0 H GLY A 94 7.158 15.736 10.354 1.00 12.13 H new ATOM 0 HA2 GLY A 94 5.278 16.247 8.911 1.00 34.13 H new ATOM 0 HA3 GLY A 94 5.833 17.907 8.812 1.00 34.13 H new ATOM 1531 N GLU A 95 8.305 16.136 7.921 1.00 72.55 N ATOM 1532 CA GLU A 95 9.261 15.758 6.848 1.00 74.12 C ATOM 1533 C GLU A 95 9.776 14.313 7.027 1.00 12.44 C ATOM 1534 O GLU A 95 9.397 13.610 7.966 1.00 10.03 O ATOM 1535 CB GLU A 95 10.481 16.724 6.799 1.00 5.23 C ATOM 1536 CG GLU A 95 10.144 18.221 6.933 1.00 20.11 C ATOM 1537 CD GLU A 95 11.325 19.123 6.553 1.00 23.05 C ATOM 1538 OE1 GLU A 95 11.592 19.266 5.339 1.00 22.02 O ATOM 1539 OE2 GLU A 95 12.016 19.653 7.447 1.00 60.43 O ATOM 0 H GLU A 95 8.702 16.083 8.859 1.00 72.55 H new ATOM 0 HA GLU A 95 8.710 15.829 5.910 1.00 74.12 H new ATOM 0 HB2 GLU A 95 11.171 16.451 7.598 1.00 5.23 H new ATOM 0 HB3 GLU A 95 11.007 16.570 5.857 1.00 5.23 H new ATOM 0 HG2 GLU A 95 9.291 18.457 6.297 1.00 20.11 H new ATOM 0 HG3 GLU A 95 9.844 18.433 7.959 1.00 20.11 H new ATOM 1546 N LYS A 96 10.639 13.910 6.086 1.00 55.43 N ATOM 1547 CA LYS A 96 11.379 12.625 6.087 1.00 60.51 C ATOM 1548 C LYS A 96 12.368 12.496 7.291 1.00 11.24 C ATOM 1549 O LYS A 96 12.771 13.499 7.882 1.00 24.50 O ATOM 1550 CB LYS A 96 12.137 12.492 4.728 1.00 73.51 C ATOM 1551 CG LYS A 96 13.468 13.300 4.579 1.00 52.01 C ATOM 1552 CD LYS A 96 13.322 14.848 4.657 1.00 1.13 C ATOM 1553 CE LYS A 96 12.501 15.450 3.501 1.00 3.44 C ATOM 1554 NZ LYS A 96 12.479 16.940 3.547 1.00 32.34 N ATOM 0 H LYS A 96 10.854 14.484 5.271 1.00 55.43 H new ATOM 0 HA LYS A 96 10.661 11.814 6.204 1.00 60.51 H new ATOM 0 HB2 LYS A 96 12.360 11.438 4.566 1.00 73.51 H new ATOM 0 HB3 LYS A 96 11.461 12.801 3.931 1.00 73.51 H new ATOM 0 HG2 LYS A 96 14.158 12.977 5.359 1.00 52.01 H new ATOM 0 HG3 LYS A 96 13.924 13.043 3.623 1.00 52.01 H new ATOM 0 HD2 LYS A 96 12.850 15.113 5.603 1.00 1.13 H new ATOM 0 HD3 LYS A 96 14.315 15.298 4.659 1.00 1.13 H new ATOM 0 HE2 LYS A 96 12.921 15.123 2.550 1.00 3.44 H new ATOM 0 HE3 LYS A 96 11.480 15.071 3.546 1.00 3.44 H new ATOM 0 HZ1 LYS A 96 11.588 17.287 3.138 1.00 32.34 H new ATOM 0 HZ2 LYS A 96 12.554 17.258 4.534 1.00 32.34 H new ATOM 0 HZ3 LYS A 96 13.280 17.316 3.000 1.00 32.34 H new ATOM 1568 N ASP A 97 12.764 11.251 7.625 1.00 4.41 N ATOM 1569 CA ASP A 97 13.659 10.961 8.782 1.00 41.23 C ATOM 1570 C ASP A 97 15.114 10.632 8.328 1.00 72.44 C ATOM 1571 O ASP A 97 16.078 10.963 9.023 1.00 30.41 O ATOM 1572 CB ASP A 97 13.068 9.777 9.592 1.00 3.35 C ATOM 1573 CG ASP A 97 13.742 9.561 10.959 1.00 72.31 C ATOM 1574 OD1 ASP A 97 13.558 10.403 11.863 1.00 74.22 O ATOM 1575 OD2 ASP A 97 14.446 8.548 11.137 1.00 32.01 O ATOM 0 H ASP A 97 12.479 10.418 7.109 1.00 4.41 H new ATOM 0 HA ASP A 97 13.714 11.853 9.406 1.00 41.23 H new ATOM 0 HB2 ASP A 97 12.003 9.950 9.746 1.00 3.35 H new ATOM 0 HB3 ASP A 97 13.161 8.864 9.003 1.00 3.35 H new ATOM 1580 N THR A 98 15.226 9.917 7.179 1.00 64.41 N ATOM 1581 CA THR A 98 16.512 9.497 6.518 1.00 11.44 C ATOM 1582 C THR A 98 17.413 8.550 7.363 1.00 24.02 C ATOM 1583 O THR A 98 18.560 8.292 6.981 1.00 3.14 O ATOM 1584 CB THR A 98 17.389 10.693 5.960 1.00 62.35 C ATOM 1585 OG1 THR A 98 17.849 11.548 7.024 1.00 12.44 O ATOM 1586 CG2 THR A 98 16.630 11.519 4.908 1.00 45.20 C ATOM 0 H THR A 98 14.405 9.602 6.663 1.00 64.41 H new ATOM 0 HA THR A 98 16.137 8.924 5.670 1.00 11.44 H new ATOM 0 HB THR A 98 18.256 10.245 5.475 1.00 62.35 H new ATOM 0 HG1 THR A 98 17.330 11.368 7.836 1.00 12.44 H new ATOM 0 HG21 THR A 98 17.267 12.328 4.552 1.00 45.20 H new ATOM 0 HG22 THR A 98 16.356 10.878 4.070 1.00 45.20 H new ATOM 0 HG23 THR A 98 15.728 11.937 5.355 1.00 45.20 H new ATOM 1594 N SER A 99 16.900 8.000 8.483 1.00 55.23 N ATOM 1595 CA SER A 99 17.586 6.876 9.192 1.00 60.53 C ATOM 1596 C SER A 99 17.392 5.545 8.417 1.00 33.42 C ATOM 1597 O SER A 99 18.135 4.580 8.614 1.00 1.44 O ATOM 1598 CB SER A 99 17.068 6.735 10.639 1.00 1.20 C ATOM 1599 OG SER A 99 17.722 5.682 11.345 1.00 13.53 O ATOM 0 H SER A 99 16.028 8.303 8.918 1.00 55.23 H new ATOM 0 HA SER A 99 18.651 7.104 9.233 1.00 60.53 H new ATOM 0 HB2 SER A 99 17.219 7.675 11.170 1.00 1.20 H new ATOM 0 HB3 SER A 99 15.994 6.547 10.622 1.00 1.20 H new ATOM 0 HG SER A 99 17.366 5.628 12.256 1.00 13.53 H new ATOM 1605 N MET A 100 16.373 5.514 7.540 1.00 2.13 N ATOM 1606 CA MET A 100 16.108 4.387 6.621 1.00 52.52 C ATOM 1607 C MET A 100 15.729 4.928 5.207 1.00 73.32 C ATOM 1608 O MET A 100 15.092 5.992 5.109 1.00 1.15 O ATOM 1609 CB MET A 100 14.991 3.472 7.204 1.00 1.32 C ATOM 1610 CG MET A 100 13.612 4.124 7.377 1.00 60.43 C ATOM 1611 SD MET A 100 12.389 2.999 8.098 1.00 54.34 S ATOM 1612 CE MET A 100 12.415 1.619 6.942 1.00 12.12 C ATOM 0 H MET A 100 15.702 6.277 7.446 1.00 2.13 H new ATOM 0 HA MET A 100 17.010 3.784 6.517 1.00 52.52 H new ATOM 0 HB2 MET A 100 14.882 2.605 6.553 1.00 1.32 H new ATOM 0 HB3 MET A 100 15.321 3.102 8.175 1.00 1.32 H new ATOM 0 HG2 MET A 100 13.709 5.004 8.013 1.00 60.43 H new ATOM 0 HG3 MET A 100 13.254 4.469 6.407 1.00 60.43 H new ATOM 0 HE1 MET A 100 11.514 1.020 7.070 1.00 12.12 H new ATOM 0 HE2 MET A 100 12.455 2.000 5.922 1.00 12.12 H new ATOM 0 HE3 MET A 100 13.292 1.001 7.133 1.00 12.12 H new ATOM 1622 N PRO A 101 16.141 4.226 4.086 1.00 14.43 N ATOM 1623 CA PRO A 101 15.855 4.676 2.682 1.00 52.40 C ATOM 1624 C PRO A 101 14.347 4.653 2.279 1.00 73.12 C ATOM 1625 O PRO A 101 13.505 4.065 2.976 1.00 51.41 O ATOM 1626 CB PRO A 101 16.678 3.675 1.805 1.00 35.12 C ATOM 1627 CG PRO A 101 17.665 3.054 2.751 1.00 31.13 C ATOM 1628 CD PRO A 101 16.951 2.977 4.080 1.00 62.11 C ATOM 0 HA PRO A 101 16.129 5.723 2.554 1.00 52.40 H new ATOM 0 HB2 PRO A 101 16.033 2.920 1.356 1.00 35.12 H new ATOM 0 HB3 PRO A 101 17.184 4.189 0.988 1.00 35.12 H new ATOM 0 HG2 PRO A 101 17.968 2.064 2.409 1.00 31.13 H new ATOM 0 HG3 PRO A 101 18.571 3.656 2.826 1.00 31.13 H new ATOM 0 HD2 PRO A 101 16.325 2.088 4.153 1.00 62.11 H new ATOM 0 HD3 PRO A 101 17.651 2.944 4.915 1.00 62.11 H new ATOM 1636 N GLY A 102 14.038 5.302 1.130 1.00 52.21 N ATOM 1637 CA GLY A 102 12.678 5.326 0.565 1.00 11.15 C ATOM 1638 C GLY A 102 12.253 3.976 -0.029 1.00 62.33 C ATOM 1639 O GLY A 102 12.520 3.695 -1.203 1.00 74.11 O ATOM 0 H GLY A 102 14.723 5.818 0.577 1.00 52.21 H new ATOM 0 HA2 GLY A 102 11.972 5.613 1.344 1.00 11.15 H new ATOM 0 HA3 GLY A 102 12.626 6.091 -0.210 1.00 11.15 H new ATOM 1643 N MET A 103 11.600 3.153 0.811 1.00 75.04 N ATOM 1644 CA MET A 103 11.121 1.789 0.474 1.00 43.31 C ATOM 1645 C MET A 103 10.257 1.757 -0.825 1.00 21.50 C ATOM 1646 O MET A 103 9.139 2.262 -0.861 1.00 61.20 O ATOM 1647 CB MET A 103 10.334 1.229 1.693 1.00 54.31 C ATOM 1648 CG MET A 103 9.642 -0.108 1.437 1.00 15.43 C ATOM 1649 SD MET A 103 10.771 -1.330 0.750 1.00 5.30 S ATOM 1650 CE MET A 103 9.622 -2.435 -0.055 1.00 44.11 C ATOM 0 H MET A 103 11.382 3.420 1.771 1.00 75.04 H new ATOM 0 HA MET A 103 11.985 1.158 0.265 1.00 43.31 H new ATOM 0 HB2 MET A 103 11.021 1.114 2.532 1.00 54.31 H new ATOM 0 HB3 MET A 103 9.584 1.961 1.993 1.00 54.31 H new ATOM 0 HG2 MET A 103 9.224 -0.485 2.371 1.00 15.43 H new ATOM 0 HG3 MET A 103 8.808 0.041 0.751 1.00 15.43 H new ATOM 0 HE1 MET A 103 10.174 -3.177 -0.632 1.00 44.11 H new ATOM 0 HE2 MET A 103 9.015 -2.939 0.697 1.00 44.11 H new ATOM 0 HE3 MET A 103 8.975 -1.865 -0.721 1.00 44.11 H new ATOM 1660 N HIS A 104 10.787 1.132 -1.881 1.00 13.12 N ATOM 1661 CA HIS A 104 10.208 1.209 -3.242 1.00 3.01 C ATOM 1662 C HIS A 104 9.115 0.129 -3.488 1.00 62.24 C ATOM 1663 O HIS A 104 9.410 -1.065 -3.538 1.00 73.10 O ATOM 1664 CB HIS A 104 11.351 1.074 -4.277 1.00 25.52 C ATOM 1665 CG HIS A 104 10.920 1.175 -5.715 1.00 25.22 C ATOM 1666 ND1 HIS A 104 11.170 0.189 -6.642 1.00 55.22 N ATOM 1667 CD2 HIS A 104 10.288 2.166 -6.390 1.00 2.21 C ATOM 1668 CE1 HIS A 104 10.711 0.561 -7.810 1.00 21.24 C ATOM 1669 NE2 HIS A 104 10.172 1.753 -7.689 1.00 2.25 N ATOM 0 H HIS A 104 11.628 0.557 -1.825 1.00 13.12 H new ATOM 0 HA HIS A 104 9.713 2.174 -3.349 1.00 3.01 H new ATOM 0 HB2 HIS A 104 12.093 1.848 -4.080 1.00 25.52 H new ATOM 0 HB3 HIS A 104 11.845 0.114 -4.128 1.00 25.52 H new ATOM 0 HD1 HIS A 104 11.640 -0.695 -6.449 1.00 55.22 H new ATOM 0 HD2 HIS A 104 9.942 3.103 -5.980 1.00 2.21 H new ATOM 0 HE1 HIS A 104 10.766 -0.016 -8.721 1.00 21.24 H new ATOM 0 HE2 HIS A 104 9.737 2.285 -8.443 1.00 2.25 H new ATOM 1678 N ILE A 105 7.846 0.575 -3.626 1.00 42.11 N ATOM 1679 CA ILE A 105 6.709 -0.285 -4.054 1.00 45.32 C ATOM 1680 C ILE A 105 6.248 0.119 -5.476 1.00 41.43 C ATOM 1681 O ILE A 105 6.122 1.308 -5.788 1.00 51.33 O ATOM 1682 CB ILE A 105 5.461 -0.217 -3.064 1.00 74.03 C ATOM 1683 CG1 ILE A 105 5.749 -0.891 -1.689 1.00 20.02 C ATOM 1684 CG2 ILE A 105 4.205 -0.884 -3.684 1.00 45.22 C ATOM 1685 CD1 ILE A 105 6.737 -0.173 -0.791 1.00 31.15 C ATOM 0 H ILE A 105 7.577 1.542 -3.445 1.00 42.11 H new ATOM 0 HA ILE A 105 7.077 -1.311 -4.043 1.00 45.32 H new ATOM 0 HB ILE A 105 5.276 0.845 -2.902 1.00 74.03 H new ATOM 0 HG12 ILE A 105 4.806 -0.991 -1.151 1.00 20.02 H new ATOM 0 HG13 ILE A 105 6.121 -1.899 -1.872 1.00 20.02 H new ATOM 0 HG21 ILE A 105 3.374 -0.819 -2.981 1.00 45.22 H new ATOM 0 HG22 ILE A 105 3.940 -0.371 -4.608 1.00 45.22 H new ATOM 0 HG23 ILE A 105 4.418 -1.931 -3.898 1.00 45.22 H new ATOM 0 HD11 ILE A 105 6.859 -0.732 0.136 1.00 31.15 H new ATOM 0 HD12 ILE A 105 7.699 -0.096 -1.297 1.00 31.15 H new ATOM 0 HD13 ILE A 105 6.364 0.826 -0.566 1.00 31.15 H new ATOM 1697 N THR A 106 6.002 -0.895 -6.327 1.00 32.33 N ATOM 1698 CA THR A 106 5.347 -0.738 -7.645 1.00 14.41 C ATOM 1699 C THR A 106 4.233 -1.787 -7.784 1.00 33.52 C ATOM 1700 O THR A 106 4.509 -2.979 -7.795 1.00 63.14 O ATOM 1701 CB THR A 106 6.359 -0.903 -8.836 1.00 12.20 C ATOM 1702 OG1 THR A 106 7.066 -2.159 -8.745 1.00 74.13 O ATOM 1703 CG2 THR A 106 7.370 0.242 -8.878 1.00 64.23 C ATOM 0 H THR A 106 6.255 -1.861 -6.118 1.00 32.33 H new ATOM 0 HA THR A 106 4.939 0.272 -7.693 1.00 14.41 H new ATOM 0 HB THR A 106 5.772 -0.885 -9.754 1.00 12.20 H new ATOM 0 HG1 THR A 106 6.984 -2.516 -7.836 1.00 74.13 H new ATOM 0 HG21 THR A 106 8.053 0.094 -9.714 1.00 64.23 H new ATOM 0 HG22 THR A 106 6.843 1.188 -9.003 1.00 64.23 H new ATOM 0 HG23 THR A 106 7.936 0.262 -7.947 1.00 64.23 H new ATOM 1711 N LEU A 107 2.973 -1.341 -7.884 1.00 0.41 N ATOM 1712 CA LEU A 107 1.816 -2.245 -8.061 1.00 64.24 C ATOM 1713 C LEU A 107 1.362 -2.199 -9.537 1.00 71.22 C ATOM 1714 O LEU A 107 1.205 -1.115 -10.101 1.00 15.20 O ATOM 1715 CB LEU A 107 0.650 -1.861 -7.103 1.00 31.31 C ATOM 1716 CG LEU A 107 1.030 -1.559 -5.595 1.00 51.21 C ATOM 1717 CD1 LEU A 107 1.230 -0.048 -5.361 1.00 34.13 C ATOM 1718 CD2 LEU A 107 -0.021 -2.134 -4.617 1.00 14.53 C ATOM 0 H LEU A 107 2.723 -0.353 -7.846 1.00 0.41 H new ATOM 0 HA LEU A 107 2.114 -3.262 -7.808 1.00 64.24 H new ATOM 0 HB2 LEU A 107 0.153 -0.981 -7.510 1.00 31.31 H new ATOM 0 HB3 LEU A 107 -0.078 -2.672 -7.113 1.00 31.31 H new ATOM 0 HG LEU A 107 1.977 -2.060 -5.394 1.00 51.21 H new ATOM 0 HD11 LEU A 107 1.490 0.127 -4.317 1.00 34.13 H new ATOM 0 HD12 LEU A 107 2.034 0.316 -6.001 1.00 34.13 H new ATOM 0 HD13 LEU A 107 0.308 0.482 -5.599 1.00 34.13 H new ATOM 0 HD21 LEU A 107 0.273 -1.907 -3.592 1.00 14.53 H new ATOM 0 HD22 LEU A 107 -0.993 -1.686 -4.823 1.00 14.53 H new ATOM 0 HD23 LEU A 107 -0.085 -3.214 -4.746 1.00 14.53 H new ATOM 1730 N ASN A 108 1.147 -3.372 -10.153 1.00 34.14 N ATOM 1731 CA ASN A 108 0.938 -3.491 -11.615 1.00 51.02 C ATOM 1732 C ASN A 108 -0.280 -4.381 -11.953 1.00 21.40 C ATOM 1733 O ASN A 108 -0.458 -5.455 -11.378 1.00 22.42 O ATOM 1734 CB ASN A 108 2.218 -4.074 -12.269 1.00 35.45 C ATOM 1735 CG ASN A 108 2.179 -4.063 -13.804 1.00 34.32 C ATOM 1736 OD1 ASN A 108 2.563 -3.090 -14.442 1.00 72.44 O ATOM 1737 ND2 ASN A 108 1.705 -5.133 -14.411 1.00 0.53 N ATOM 0 H ASN A 108 1.112 -4.264 -9.659 1.00 34.14 H new ATOM 0 HA ASN A 108 0.734 -2.496 -12.011 1.00 51.02 H new ATOM 0 HB2 ASN A 108 3.082 -3.502 -11.931 1.00 35.45 H new ATOM 0 HB3 ASN A 108 2.359 -5.098 -11.924 1.00 35.45 H new ATOM 0 HD21 ASN A 108 1.653 -5.161 -15.429 1.00 0.53 H new ATOM 0 HD22 ASN A 108 1.390 -5.933 -13.862 1.00 0.53 H new ATOM 1744 N PHE A 109 -1.084 -3.905 -12.910 1.00 73.42 N ATOM 1745 CA PHE A 109 -2.245 -4.627 -13.487 1.00 41.43 C ATOM 1746 C PHE A 109 -1.847 -5.988 -14.133 1.00 45.41 C ATOM 1747 O PHE A 109 -0.844 -6.079 -14.840 1.00 0.41 O ATOM 1748 CB PHE A 109 -2.920 -3.710 -14.541 1.00 34.20 C ATOM 1749 CG PHE A 109 -2.051 -3.394 -15.778 1.00 21.31 C ATOM 1750 CD1 PHE A 109 -0.898 -2.607 -15.677 1.00 10.33 C ATOM 1751 CD2 PHE A 109 -2.386 -3.890 -17.035 1.00 31.53 C ATOM 1752 CE1 PHE A 109 -0.118 -2.337 -16.785 1.00 51.52 C ATOM 1753 CE2 PHE A 109 -1.605 -3.617 -18.143 1.00 45.01 C ATOM 1754 CZ PHE A 109 -0.473 -2.843 -18.017 1.00 24.50 C ATOM 0 H PHE A 109 -0.949 -2.982 -13.322 1.00 73.42 H new ATOM 0 HA PHE A 109 -2.937 -4.861 -12.678 1.00 41.43 H new ATOM 0 HB2 PHE A 109 -3.844 -4.183 -14.875 1.00 34.20 H new ATOM 0 HB3 PHE A 109 -3.198 -2.772 -14.061 1.00 34.20 H new ATOM 0 HD1 PHE A 109 -0.613 -2.204 -14.716 1.00 10.33 H new ATOM 0 HD2 PHE A 109 -3.271 -4.499 -17.147 1.00 31.53 H new ATOM 0 HE1 PHE A 109 0.770 -1.730 -16.686 1.00 51.52 H new ATOM 0 HE2 PHE A 109 -1.883 -4.012 -19.109 1.00 45.01 H new ATOM 0 HZ PHE A 109 0.137 -2.632 -18.883 1.00 24.50 H new ATOM 1764 N GLU A 110 -2.657 -7.037 -13.901 1.00 14.52 N ATOM 1765 CA GLU A 110 -2.352 -8.421 -14.363 1.00 30.30 C ATOM 1766 C GLU A 110 -3.519 -9.018 -15.182 1.00 5.21 C ATOM 1767 O GLU A 110 -3.312 -9.524 -16.295 1.00 12.15 O ATOM 1768 CB GLU A 110 -2.051 -9.329 -13.144 1.00 50.52 C ATOM 1769 CG GLU A 110 -0.837 -8.904 -12.296 1.00 53.24 C ATOM 1770 CD GLU A 110 0.508 -9.030 -13.041 1.00 32.15 C ATOM 1771 OE1 GLU A 110 0.977 -10.176 -13.240 1.00 4.22 O ATOM 1772 OE2 GLU A 110 1.110 -8.001 -13.417 1.00 54.31 O ATOM 0 H GLU A 110 -3.538 -6.960 -13.392 1.00 14.52 H new ATOM 0 HA GLU A 110 -1.477 -8.371 -15.011 1.00 30.30 H new ATOM 0 HB2 GLU A 110 -2.932 -9.353 -12.503 1.00 50.52 H new ATOM 0 HB3 GLU A 110 -1.888 -10.346 -13.500 1.00 50.52 H new ATOM 0 HG2 GLU A 110 -0.971 -7.871 -11.976 1.00 53.24 H new ATOM 0 HG3 GLU A 110 -0.802 -9.515 -11.394 1.00 53.24 H new ATOM 1779 N GLU A 111 -4.746 -8.961 -14.619 1.00 63.33 N ATOM 1780 CA GLU A 111 -5.951 -9.550 -15.253 1.00 41.42 C ATOM 1781 C GLU A 111 -7.178 -8.613 -15.097 1.00 53.31 C ATOM 1782 O GLU A 111 -7.632 -8.345 -13.979 1.00 63.53 O ATOM 1783 CB GLU A 111 -6.231 -10.964 -14.657 1.00 24.41 C ATOM 1784 CG GLU A 111 -7.408 -11.717 -15.316 1.00 21.24 C ATOM 1785 CD GLU A 111 -7.469 -13.221 -14.959 1.00 10.10 C ATOM 1786 OE1 GLU A 111 -6.677 -14.005 -15.538 1.00 63.12 O ATOM 1787 OE2 GLU A 111 -8.315 -13.624 -14.126 1.00 63.10 O ATOM 0 H GLU A 111 -4.930 -8.511 -13.722 1.00 63.33 H new ATOM 0 HA GLU A 111 -5.765 -9.661 -16.321 1.00 41.42 H new ATOM 0 HB2 GLU A 111 -5.330 -11.570 -14.753 1.00 24.41 H new ATOM 0 HB3 GLU A 111 -6.434 -10.861 -13.591 1.00 24.41 H new ATOM 0 HG2 GLU A 111 -8.343 -11.244 -15.015 1.00 21.24 H new ATOM 0 HG3 GLU A 111 -7.332 -11.613 -16.398 1.00 21.24 H new ATOM 1794 N VAL A 112 -7.686 -8.104 -16.244 1.00 13.31 N ATOM 1795 CA VAL A 112 -8.835 -7.157 -16.297 1.00 2.23 C ATOM 1796 C VAL A 112 -10.112 -7.843 -16.893 1.00 34.01 C ATOM 1797 O VAL A 112 -11.094 -7.167 -17.236 1.00 75.33 O ATOM 1798 CB VAL A 112 -8.417 -5.868 -17.130 1.00 44.51 C ATOM 1799 CG1 VAL A 112 -8.268 -6.172 -18.646 1.00 44.41 C ATOM 1800 CG2 VAL A 112 -9.366 -4.662 -16.875 1.00 35.13 C ATOM 0 H VAL A 112 -7.312 -8.337 -17.164 1.00 13.31 H new ATOM 0 HA VAL A 112 -9.091 -6.850 -15.283 1.00 2.23 H new ATOM 0 HB VAL A 112 -7.433 -5.576 -16.765 1.00 44.51 H new ATOM 0 HG11 VAL A 112 -7.982 -5.262 -19.173 1.00 44.41 H new ATOM 0 HG12 VAL A 112 -7.500 -6.932 -18.791 1.00 44.41 H new ATOM 0 HG13 VAL A 112 -9.217 -6.536 -19.039 1.00 44.41 H new ATOM 0 HG21 VAL A 112 -9.037 -3.808 -17.467 1.00 35.13 H new ATOM 0 HG22 VAL A 112 -10.382 -4.932 -17.162 1.00 35.13 H new ATOM 0 HG23 VAL A 112 -9.345 -4.400 -15.817 1.00 35.13 H new ATOM 1810 N LYS A 113 -10.097 -9.201 -16.974 1.00 24.45 N ATOM 1811 CA LYS A 113 -11.226 -10.016 -17.523 1.00 51.23 C ATOM 1812 C LYS A 113 -12.576 -9.689 -16.833 1.00 3.15 C ATOM 1813 O LYS A 113 -13.583 -9.447 -17.506 1.00 72.23 O ATOM 1814 CB LYS A 113 -10.916 -11.534 -17.397 1.00 61.01 C ATOM 1815 CG LYS A 113 -9.745 -12.022 -18.279 1.00 34.15 C ATOM 1816 CD LYS A 113 -9.375 -13.500 -18.014 1.00 21.14 C ATOM 1817 CE LYS A 113 -8.130 -13.958 -18.796 1.00 72.32 C ATOM 1818 NZ LYS A 113 -7.619 -15.257 -18.289 1.00 73.31 N ATOM 0 H LYS A 113 -9.306 -9.764 -16.662 1.00 24.45 H new ATOM 0 HA LYS A 113 -11.324 -9.755 -18.577 1.00 51.23 H new ATOM 0 HB2 LYS A 113 -10.689 -11.761 -16.355 1.00 61.01 H new ATOM 0 HB3 LYS A 113 -11.811 -12.098 -17.658 1.00 61.01 H new ATOM 0 HG2 LYS A 113 -10.011 -11.901 -19.329 1.00 34.15 H new ATOM 0 HG3 LYS A 113 -8.872 -11.395 -18.097 1.00 34.15 H new ATOM 0 HD2 LYS A 113 -9.199 -13.639 -16.947 1.00 21.14 H new ATOM 0 HD3 LYS A 113 -10.220 -14.134 -18.283 1.00 21.14 H new ATOM 0 HE2 LYS A 113 -8.376 -14.050 -19.854 1.00 72.32 H new ATOM 0 HE3 LYS A 113 -7.349 -13.202 -18.715 1.00 72.32 H new ATOM 0 HZ1 LYS A 113 -6.879 -15.612 -18.928 1.00 73.31 H new ATOM 0 HZ2 LYS A 113 -7.221 -15.126 -17.337 1.00 73.31 H new ATOM 0 HZ3 LYS A 113 -8.399 -15.944 -18.246 1.00 73.31 H new ATOM 1832 N GLY A 114 -12.571 -9.687 -15.491 1.00 31.55 N ATOM 1833 CA GLY A 114 -13.727 -9.255 -14.697 1.00 24.14 C ATOM 1834 C GLY A 114 -13.314 -8.847 -13.286 1.00 62.24 C ATOM 1835 O GLY A 114 -13.486 -7.689 -12.878 1.00 72.42 O ATOM 0 H GLY A 114 -11.771 -9.983 -14.931 1.00 31.55 H new ATOM 0 HA2 GLY A 114 -14.216 -8.416 -15.191 1.00 24.14 H new ATOM 0 HA3 GLY A 114 -14.456 -10.063 -14.645 1.00 24.14 H new ATOM 1839 N LYS A 115 -12.746 -9.814 -12.547 1.00 11.41 N ATOM 1840 CA LYS A 115 -12.197 -9.590 -11.193 1.00 72.15 C ATOM 1841 C LYS A 115 -10.778 -8.979 -11.309 1.00 53.21 C ATOM 1842 O LYS A 115 -9.980 -9.410 -12.150 1.00 0.51 O ATOM 1843 CB LYS A 115 -12.155 -10.938 -10.408 1.00 44.13 C ATOM 1844 CG LYS A 115 -13.470 -11.752 -10.469 1.00 5.15 C ATOM 1845 CD LYS A 115 -13.384 -13.116 -9.736 1.00 72.22 C ATOM 1846 CE LYS A 115 -13.404 -12.970 -8.203 1.00 63.42 C ATOM 1847 NZ LYS A 115 -14.701 -12.418 -7.725 1.00 45.23 N ATOM 0 H LYS A 115 -12.653 -10.777 -12.870 1.00 11.41 H new ATOM 0 HA LYS A 115 -12.836 -8.896 -10.647 1.00 72.15 H new ATOM 0 HB2 LYS A 115 -11.344 -11.550 -10.803 1.00 44.13 H new ATOM 0 HB3 LYS A 115 -11.918 -10.730 -9.365 1.00 44.13 H new ATOM 0 HG2 LYS A 115 -14.275 -11.162 -10.030 1.00 5.15 H new ATOM 0 HG3 LYS A 115 -13.734 -11.925 -11.512 1.00 5.15 H new ATOM 0 HD2 LYS A 115 -14.218 -13.744 -10.048 1.00 72.22 H new ATOM 0 HD3 LYS A 115 -12.470 -13.628 -10.036 1.00 72.22 H new ATOM 0 HE2 LYS A 115 -13.229 -13.942 -7.742 1.00 63.42 H new ATOM 0 HE3 LYS A 115 -12.591 -12.316 -7.888 1.00 63.42 H new ATOM 0 HZ1 LYS A 115 -14.604 -12.111 -6.736 1.00 45.23 H new ATOM 0 HZ2 LYS A 115 -14.971 -11.605 -8.315 1.00 45.23 H new ATOM 0 HZ3 LYS A 115 -15.435 -13.152 -7.790 1.00 45.23 H new ATOM 1861 N THR A 116 -10.483 -7.969 -10.479 1.00 4.22 N ATOM 1862 CA THR A 116 -9.169 -7.285 -10.472 1.00 65.23 C ATOM 1863 C THR A 116 -8.040 -8.211 -9.979 1.00 53.55 C ATOM 1864 O THR A 116 -8.220 -8.930 -9.013 1.00 10.22 O ATOM 1865 CB THR A 116 -9.214 -6.022 -9.553 1.00 33.31 C ATOM 1866 OG1 THR A 116 -10.239 -5.134 -10.006 1.00 24.33 O ATOM 1867 CG2 THR A 116 -7.871 -5.259 -9.515 1.00 1.13 C ATOM 0 H THR A 116 -11.141 -7.599 -9.793 1.00 4.22 H new ATOM 0 HA THR A 116 -8.960 -6.995 -11.502 1.00 65.23 H new ATOM 0 HB THR A 116 -9.422 -6.374 -8.543 1.00 33.31 H new ATOM 0 HG1 THR A 116 -11.115 -5.556 -9.883 1.00 24.33 H new ATOM 0 HG21 THR A 116 -7.963 -4.392 -8.861 1.00 1.13 H new ATOM 0 HG22 THR A 116 -7.089 -5.917 -9.136 1.00 1.13 H new ATOM 0 HG23 THR A 116 -7.612 -4.929 -10.521 1.00 1.13 H new ATOM 1875 N THR A 117 -6.882 -8.174 -10.651 1.00 61.25 N ATOM 1876 CA THR A 117 -5.648 -8.851 -10.188 1.00 43.03 C ATOM 1877 C THR A 117 -4.467 -7.882 -10.367 1.00 75.05 C ATOM 1878 O THR A 117 -4.175 -7.465 -11.489 1.00 13.02 O ATOM 1879 CB THR A 117 -5.371 -10.188 -10.962 1.00 4.30 C ATOM 1880 OG1 THR A 117 -6.515 -11.058 -10.869 1.00 74.43 O ATOM 1881 CG2 THR A 117 -4.132 -10.928 -10.416 1.00 2.44 C ATOM 0 H THR A 117 -6.767 -7.675 -11.533 1.00 61.25 H new ATOM 0 HA THR A 117 -5.775 -9.118 -9.139 1.00 43.03 H new ATOM 0 HB THR A 117 -5.180 -9.924 -12.002 1.00 4.30 H new ATOM 0 HG1 THR A 117 -6.334 -11.889 -11.356 1.00 74.43 H new ATOM 0 HG21 THR A 117 -3.979 -11.847 -10.981 1.00 2.44 H new ATOM 0 HG22 THR A 117 -3.254 -10.290 -10.516 1.00 2.44 H new ATOM 0 HG23 THR A 117 -4.287 -11.170 -9.365 1.00 2.44 H new ATOM 1889 N VAL A 118 -3.828 -7.487 -9.249 1.00 42.50 N ATOM 1890 CA VAL A 118 -2.704 -6.515 -9.246 1.00 43.31 C ATOM 1891 C VAL A 118 -1.506 -7.066 -8.421 1.00 72.44 C ATOM 1892 O VAL A 118 -1.632 -7.340 -7.224 1.00 0.22 O ATOM 1893 CB VAL A 118 -3.180 -5.099 -8.707 1.00 23.31 C ATOM 1894 CG1 VAL A 118 -1.993 -4.123 -8.464 1.00 45.32 C ATOM 1895 CG2 VAL A 118 -4.205 -4.448 -9.675 1.00 30.13 C ATOM 0 H VAL A 118 -4.072 -7.829 -8.320 1.00 42.50 H new ATOM 0 HA VAL A 118 -2.366 -6.377 -10.273 1.00 43.31 H new ATOM 0 HB VAL A 118 -3.660 -5.284 -7.746 1.00 23.31 H new ATOM 0 HG11 VAL A 118 -2.375 -3.170 -8.096 1.00 45.32 H new ATOM 0 HG12 VAL A 118 -1.315 -4.552 -7.726 1.00 45.32 H new ATOM 0 HG13 VAL A 118 -1.457 -3.962 -9.399 1.00 45.32 H new ATOM 0 HG21 VAL A 118 -4.514 -3.480 -9.281 1.00 30.13 H new ATOM 0 HG22 VAL A 118 -3.745 -4.312 -10.654 1.00 30.13 H new ATOM 0 HG23 VAL A 118 -5.077 -5.095 -9.771 1.00 30.13 H new ATOM 1905 N THR A 119 -0.361 -7.251 -9.106 1.00 13.42 N ATOM 1906 CA THR A 119 0.917 -7.695 -8.493 1.00 34.34 C ATOM 1907 C THR A 119 1.730 -6.502 -7.928 1.00 11.34 C ATOM 1908 O THR A 119 2.155 -5.627 -8.687 1.00 43.30 O ATOM 1909 CB THR A 119 1.802 -8.465 -9.545 1.00 3.25 C ATOM 1910 OG1 THR A 119 1.156 -9.688 -9.927 1.00 50.52 O ATOM 1911 CG2 THR A 119 3.221 -8.799 -9.034 1.00 44.12 C ATOM 0 H THR A 119 -0.291 -7.096 -10.112 1.00 13.42 H new ATOM 0 HA THR A 119 0.658 -8.361 -7.670 1.00 34.34 H new ATOM 0 HB THR A 119 1.910 -7.792 -10.395 1.00 3.25 H new ATOM 0 HG1 THR A 119 1.711 -10.160 -10.582 1.00 50.52 H new ATOM 0 HG21 THR A 119 3.772 -9.329 -9.811 1.00 44.12 H new ATOM 0 HG22 THR A 119 3.744 -7.876 -8.783 1.00 44.12 H new ATOM 0 HG23 THR A 119 3.150 -9.428 -8.147 1.00 44.12 H new ATOM 1919 N SER A 120 1.972 -6.481 -6.598 1.00 3.12 N ATOM 1920 CA SER A 120 2.853 -5.472 -5.972 1.00 43.31 C ATOM 1921 C SER A 120 4.309 -6.000 -5.877 1.00 33.13 C ATOM 1922 O SER A 120 4.627 -6.861 -5.065 1.00 0.34 O ATOM 1923 CB SER A 120 2.319 -5.080 -4.568 1.00 1.34 C ATOM 1924 OG SER A 120 2.412 -6.133 -3.632 1.00 4.14 O ATOM 0 H SER A 120 1.571 -7.149 -5.940 1.00 3.12 H new ATOM 0 HA SER A 120 2.855 -4.581 -6.599 1.00 43.31 H new ATOM 0 HB2 SER A 120 2.879 -4.221 -4.198 1.00 1.34 H new ATOM 0 HB3 SER A 120 1.278 -4.768 -4.655 1.00 1.34 H new ATOM 0 HG SER A 120 3.256 -6.614 -3.764 1.00 4.14 H new ATOM 1930 N THR A 121 5.191 -5.465 -6.726 1.00 30.14 N ATOM 1931 CA THR A 121 6.642 -5.724 -6.660 1.00 43.11 C ATOM 1932 C THR A 121 7.295 -4.708 -5.705 1.00 32.43 C ATOM 1933 O THR A 121 7.304 -3.504 -5.978 1.00 74.33 O ATOM 1934 CB THR A 121 7.298 -5.630 -8.074 1.00 35.15 C ATOM 1935 OG1 THR A 121 6.691 -6.590 -8.954 1.00 72.40 O ATOM 1936 CG2 THR A 121 8.824 -5.854 -8.032 1.00 65.20 C ATOM 0 H THR A 121 4.923 -4.837 -7.484 1.00 30.14 H new ATOM 0 HA THR A 121 6.799 -6.736 -6.287 1.00 43.11 H new ATOM 0 HB THR A 121 7.128 -4.619 -8.445 1.00 35.15 H new ATOM 0 HG1 THR A 121 7.103 -6.527 -9.841 1.00 72.40 H new ATOM 0 HG21 THR A 121 9.231 -5.778 -9.040 1.00 65.20 H new ATOM 0 HG22 THR A 121 9.285 -5.098 -7.397 1.00 65.20 H new ATOM 0 HG23 THR A 121 9.035 -6.844 -7.629 1.00 65.20 H new ATOM 1944 N SER A 122 7.850 -5.206 -4.600 1.00 52.15 N ATOM 1945 CA SER A 122 8.318 -4.361 -3.484 1.00 22.44 C ATOM 1946 C SER A 122 9.809 -4.604 -3.232 1.00 34.11 C ATOM 1947 O SER A 122 10.189 -5.623 -2.666 1.00 31.24 O ATOM 1948 CB SER A 122 7.485 -4.685 -2.218 1.00 74.01 C ATOM 1949 OG SER A 122 6.102 -4.436 -2.433 1.00 53.12 O ATOM 0 H SER A 122 7.991 -6.204 -4.446 1.00 52.15 H new ATOM 0 HA SER A 122 8.185 -3.309 -3.736 1.00 22.44 H new ATOM 0 HB2 SER A 122 7.630 -5.729 -1.942 1.00 74.01 H new ATOM 0 HB3 SER A 122 7.840 -4.082 -1.382 1.00 74.01 H new ATOM 0 HG SER A 122 5.601 -4.651 -1.619 1.00 53.12 H new ATOM 1955 N THR A 123 10.657 -3.661 -3.655 1.00 21.44 N ATOM 1956 CA THR A 123 12.123 -3.795 -3.514 1.00 51.31 C ATOM 1957 C THR A 123 12.601 -3.137 -2.203 1.00 21.52 C ATOM 1958 O THR A 123 12.694 -1.907 -2.087 1.00 63.34 O ATOM 1959 CB THR A 123 12.900 -3.217 -4.744 1.00 51.21 C ATOM 1960 OG1 THR A 123 12.509 -1.863 -4.996 1.00 45.30 O ATOM 1961 CG2 THR A 123 12.664 -4.063 -6.009 1.00 64.44 C ATOM 0 H THR A 123 10.359 -2.793 -4.100 1.00 21.44 H new ATOM 0 HA THR A 123 12.346 -4.861 -3.476 1.00 51.31 H new ATOM 0 HB THR A 123 13.962 -3.248 -4.500 1.00 51.21 H new ATOM 0 HG1 THR A 123 13.199 -1.418 -5.531 1.00 45.30 H new ATOM 0 HG21 THR A 123 13.218 -3.633 -6.843 1.00 64.44 H new ATOM 0 HG22 THR A 123 13.006 -5.083 -5.834 1.00 64.44 H new ATOM 0 HG23 THR A 123 11.600 -4.073 -6.247 1.00 64.44 H new ATOM 1969 N PHE A 124 12.850 -4.008 -1.213 1.00 44.31 N ATOM 1970 CA PHE A 124 13.344 -3.646 0.128 1.00 62.40 C ATOM 1971 C PHE A 124 14.827 -3.160 0.088 1.00 31.41 C ATOM 1972 O PHE A 124 15.575 -3.532 -0.823 1.00 24.25 O ATOM 1973 CB PHE A 124 13.166 -4.869 1.087 1.00 74.01 C ATOM 1974 CG PHE A 124 11.705 -5.181 1.448 1.00 22.11 C ATOM 1975 CD1 PHE A 124 10.828 -5.721 0.505 1.00 0.11 C ATOM 1976 CD2 PHE A 124 11.215 -4.940 2.733 1.00 25.25 C ATOM 1977 CE1 PHE A 124 9.517 -6.007 0.835 1.00 1.45 C ATOM 1978 CE2 PHE A 124 9.901 -5.229 3.060 1.00 33.11 C ATOM 1979 CZ PHE A 124 9.053 -5.758 2.110 1.00 11.22 C ATOM 0 H PHE A 124 12.710 -5.012 -1.325 1.00 44.31 H new ATOM 0 HA PHE A 124 12.758 -2.808 0.505 1.00 62.40 H new ATOM 0 HB2 PHE A 124 13.609 -5.749 0.621 1.00 74.01 H new ATOM 0 HB3 PHE A 124 13.723 -4.680 2.005 1.00 74.01 H new ATOM 0 HD1 PHE A 124 11.180 -5.918 -0.497 1.00 0.11 H new ATOM 0 HD2 PHE A 124 11.870 -4.522 3.483 1.00 25.25 H new ATOM 0 HE1 PHE A 124 8.854 -6.427 0.093 1.00 1.45 H new ATOM 0 HE2 PHE A 124 9.540 -5.040 4.060 1.00 33.11 H new ATOM 0 HZ PHE A 124 8.026 -5.977 2.364 1.00 11.22 H new ATOM 1989 N PRO A 125 15.261 -2.320 1.093 1.00 54.34 N ATOM 1990 CA PRO A 125 16.603 -1.665 1.103 1.00 43.23 C ATOM 1991 C PRO A 125 17.785 -2.617 1.482 1.00 71.03 C ATOM 1992 O PRO A 125 18.367 -2.504 2.574 1.00 51.40 O ATOM 1993 CB PRO A 125 16.407 -0.539 2.155 1.00 23.12 C ATOM 1994 CG PRO A 125 15.410 -1.104 3.127 1.00 72.33 C ATOM 1995 CD PRO A 125 14.462 -1.950 2.298 1.00 72.15 C ATOM 0 HA PRO A 125 16.895 -1.315 0.113 1.00 43.23 H new ATOM 0 HB2 PRO A 125 17.346 -0.289 2.649 1.00 23.12 H new ATOM 0 HB3 PRO A 125 16.037 0.376 1.693 1.00 23.12 H new ATOM 0 HG2 PRO A 125 15.905 -1.704 3.891 1.00 72.33 H new ATOM 0 HG3 PRO A 125 14.874 -0.309 3.645 1.00 72.33 H new ATOM 0 HD2 PRO A 125 14.134 -2.834 2.846 1.00 72.15 H new ATOM 0 HD3 PRO A 125 13.565 -1.393 2.026 1.00 72.15 H new ATOM 2003 N THR A 126 18.120 -3.538 0.537 1.00 54.04 N ATOM 2004 CA THR A 126 19.272 -4.508 0.597 1.00 65.34 C ATOM 2005 C THR A 126 19.433 -5.246 1.971 1.00 34.20 C ATOM 2006 O THR A 126 18.512 -5.233 2.796 1.00 44.20 O ATOM 2007 CB THR A 126 20.622 -3.830 0.119 1.00 22.33 C ATOM 2008 OG1 THR A 126 21.611 -4.837 -0.175 1.00 43.12 O ATOM 2009 CG2 THR A 126 21.207 -2.843 1.151 1.00 0.22 C ATOM 0 H THR A 126 17.581 -3.637 -0.323 1.00 54.04 H new ATOM 0 HA THR A 126 19.021 -5.300 -0.108 1.00 65.34 H new ATOM 0 HB THR A 126 20.373 -3.261 -0.777 1.00 22.33 H new ATOM 0 HG1 THR A 126 22.440 -4.405 -0.471 1.00 43.12 H new ATOM 0 HG21 THR A 126 22.130 -2.414 0.762 1.00 0.22 H new ATOM 0 HG22 THR A 126 20.488 -2.046 1.340 1.00 0.22 H new ATOM 0 HG23 THR A 126 21.416 -3.371 2.081 1.00 0.22 H new ATOM 2017 N GLU A 127 20.566 -5.980 2.155 1.00 65.13 N ATOM 2018 CA GLU A 127 20.964 -6.594 3.460 1.00 53.51 C ATOM 2019 C GLU A 127 19.940 -7.678 3.939 1.00 11.20 C ATOM 2020 O GLU A 127 19.824 -7.975 5.136 1.00 43.53 O ATOM 2021 CB GLU A 127 21.178 -5.462 4.521 1.00 2.21 C ATOM 2022 CG GLU A 127 21.903 -5.886 5.816 1.00 3.53 C ATOM 2023 CD GLU A 127 22.087 -4.725 6.810 1.00 63.52 C ATOM 2024 OE1 GLU A 127 21.087 -4.295 7.420 1.00 72.34 O ATOM 2025 OE2 GLU A 127 23.225 -4.233 6.977 1.00 52.34 O ATOM 0 H GLU A 127 21.231 -6.164 1.404 1.00 65.13 H new ATOM 0 HA GLU A 127 21.907 -7.125 3.326 1.00 53.51 H new ATOM 0 HB2 GLU A 127 21.746 -4.656 4.056 1.00 2.21 H new ATOM 0 HB3 GLU A 127 20.204 -5.052 4.789 1.00 2.21 H new ATOM 0 HG2 GLU A 127 21.337 -6.683 6.298 1.00 3.53 H new ATOM 0 HG3 GLU A 127 22.880 -6.297 5.561 1.00 3.53 H new ATOM 2032 N SER A 128 19.223 -8.281 2.962 1.00 74.14 N ATOM 2033 CA SER A 128 18.163 -9.295 3.200 1.00 40.45 C ATOM 2034 C SER A 128 16.983 -8.726 4.023 1.00 50.30 C ATOM 2035 O SER A 128 16.314 -9.464 4.743 1.00 14.31 O ATOM 2036 CB SER A 128 18.756 -10.579 3.854 1.00 64.01 C ATOM 2037 OG SER A 128 19.687 -11.223 2.993 1.00 30.35 O ATOM 0 H SER A 128 19.365 -8.076 1.973 1.00 74.14 H new ATOM 0 HA SER A 128 17.756 -9.573 2.228 1.00 40.45 H new ATOM 0 HB2 SER A 128 19.247 -10.317 4.791 1.00 64.01 H new ATOM 0 HB3 SER A 128 17.949 -11.269 4.099 1.00 64.01 H new ATOM 0 HG SER A 128 20.448 -11.547 3.518 1.00 30.35 H new ATOM 2043 N ALA A 129 16.700 -7.417 3.852 1.00 14.32 N ATOM 2044 CA ALA A 129 15.578 -6.721 4.534 1.00 65.02 C ATOM 2045 C ALA A 129 14.214 -7.407 4.265 1.00 23.52 C ATOM 2046 O ALA A 129 13.375 -7.534 5.166 1.00 60.04 O ATOM 2047 CB ALA A 129 15.531 -5.243 4.111 1.00 64.41 C ATOM 0 H ALA A 129 17.241 -6.809 3.237 1.00 14.32 H new ATOM 0 HA ALA A 129 15.762 -6.780 5.607 1.00 65.02 H new ATOM 0 HB1 ALA A 129 14.704 -4.745 4.618 1.00 64.41 H new ATOM 0 HB2 ALA A 129 16.468 -4.757 4.382 1.00 64.41 H new ATOM 0 HB3 ALA A 129 15.387 -5.178 3.033 1.00 64.41 H new ATOM 2053 N ALA A 130 14.023 -7.868 3.017 1.00 70.33 N ATOM 2054 CA ALA A 130 12.806 -8.607 2.601 1.00 44.42 C ATOM 2055 C ALA A 130 12.777 -10.055 3.140 1.00 54.22 C ATOM 2056 O ALA A 130 11.699 -10.616 3.343 1.00 13.34 O ATOM 2057 CB ALA A 130 12.696 -8.595 1.083 1.00 61.04 C ATOM 0 H ALA A 130 14.702 -7.742 2.266 1.00 70.33 H new ATOM 0 HA ALA A 130 11.945 -8.099 3.035 1.00 44.42 H new ATOM 0 HB1 ALA A 130 11.801 -9.138 0.779 1.00 61.04 H new ATOM 0 HB2 ALA A 130 12.633 -7.565 0.731 1.00 61.04 H new ATOM 0 HB3 ALA A 130 13.575 -9.073 0.651 1.00 61.04 H new ATOM 2063 N GLN A 131 13.966 -10.660 3.333 1.00 22.35 N ATOM 2064 CA GLN A 131 14.094 -11.956 4.046 1.00 40.20 C ATOM 2065 C GLN A 131 13.611 -11.831 5.508 1.00 13.31 C ATOM 2066 O GLN A 131 12.846 -12.669 5.982 1.00 34.32 O ATOM 2067 CB GLN A 131 15.553 -12.507 4.029 1.00 34.33 C ATOM 2068 CG GLN A 131 15.765 -13.732 4.961 1.00 41.40 C ATOM 2069 CD GLN A 131 14.976 -14.977 4.529 1.00 50.35 C ATOM 2070 OE1 GLN A 131 14.878 -15.287 3.345 1.00 41.43 O ATOM 2071 NE2 GLN A 131 14.337 -15.643 5.470 1.00 73.22 N ATOM 0 H GLN A 131 14.853 -10.276 3.007 1.00 22.35 H new ATOM 0 HA GLN A 131 13.462 -12.664 3.510 1.00 40.20 H new ATOM 0 HB2 GLN A 131 15.815 -12.787 3.009 1.00 34.33 H new ATOM 0 HB3 GLN A 131 16.237 -11.712 4.327 1.00 34.33 H new ATOM 0 HG2 GLN A 131 16.827 -13.977 4.990 1.00 41.40 H new ATOM 0 HG3 GLN A 131 15.473 -13.461 5.976 1.00 41.40 H new ATOM 0 HE21 GLN A 131 14.435 -15.366 6.447 1.00 73.22 H new ATOM 0 HE22 GLN A 131 13.745 -16.435 5.221 1.00 73.22 H new ATOM 2080 N GLN A 132 14.071 -10.782 6.218 1.00 71.40 N ATOM 2081 CA GLN A 132 13.642 -10.525 7.616 1.00 4.41 C ATOM 2082 C GLN A 132 12.112 -10.280 7.714 1.00 64.23 C ATOM 2083 O GLN A 132 11.506 -10.509 8.765 1.00 1.22 O ATOM 2084 CB GLN A 132 14.440 -9.347 8.257 1.00 24.10 C ATOM 2085 CG GLN A 132 15.832 -9.730 8.823 1.00 34.43 C ATOM 2086 CD GLN A 132 16.856 -10.149 7.763 1.00 34.21 C ATOM 2087 OE1 GLN A 132 17.609 -9.328 7.255 1.00 2.05 O ATOM 2088 NE2 GLN A 132 16.875 -11.420 7.399 1.00 4.55 N ATOM 0 H GLN A 132 14.736 -10.100 5.853 1.00 71.40 H new ATOM 0 HA GLN A 132 13.868 -11.426 8.186 1.00 4.41 H new ATOM 0 HB2 GLN A 132 14.571 -8.567 7.507 1.00 24.10 H new ATOM 0 HB3 GLN A 132 13.843 -8.919 9.062 1.00 24.10 H new ATOM 0 HG2 GLN A 132 16.230 -8.881 9.379 1.00 34.43 H new ATOM 0 HG3 GLN A 132 15.709 -10.547 9.534 1.00 34.43 H new ATOM 0 HE21 GLN A 132 16.238 -12.085 7.837 1.00 4.55 H new ATOM 0 HE22 GLN A 132 17.527 -11.735 6.680 1.00 4.55 H new ATOM 2097 N ALA A 133 11.508 -9.812 6.604 1.00 62.41 N ATOM 2098 CA ALA A 133 10.039 -9.706 6.463 1.00 61.12 C ATOM 2099 C ALA A 133 9.367 -11.111 6.378 1.00 63.51 C ATOM 2100 O ALA A 133 8.255 -11.302 6.883 1.00 11.14 O ATOM 2101 CB ALA A 133 9.690 -8.840 5.241 1.00 53.23 C ATOM 0 H ALA A 133 12.022 -9.497 5.781 1.00 62.41 H new ATOM 0 HA ALA A 133 9.642 -9.222 7.355 1.00 61.12 H new ATOM 0 HB1 ALA A 133 8.607 -8.767 5.144 1.00 53.23 H new ATOM 0 HB2 ALA A 133 10.111 -7.843 5.370 1.00 53.23 H new ATOM 0 HB3 ALA A 133 10.105 -9.296 4.342 1.00 53.23 H new ATOM 2107 N ILE A 134 10.051 -12.091 5.743 1.00 52.30 N ATOM 2108 CA ILE A 134 9.586 -13.510 5.709 1.00 63.45 C ATOM 2109 C ILE A 134 9.614 -14.113 7.140 1.00 15.53 C ATOM 2110 O ILE A 134 8.660 -14.774 7.576 1.00 43.43 O ATOM 2111 CB ILE A 134 10.477 -14.421 4.776 1.00 42.52 C ATOM 2112 CG1 ILE A 134 10.744 -13.747 3.397 1.00 43.14 C ATOM 2113 CG2 ILE A 134 9.831 -15.817 4.585 1.00 22.14 C ATOM 2114 CD1 ILE A 134 11.696 -14.522 2.490 1.00 1.11 C ATOM 0 H ILE A 134 10.927 -11.932 5.246 1.00 52.30 H new ATOM 0 HA ILE A 134 8.573 -13.493 5.308 1.00 63.45 H new ATOM 0 HB ILE A 134 11.439 -14.550 5.272 1.00 42.52 H new ATOM 0 HG12 ILE A 134 9.793 -13.617 2.880 1.00 43.14 H new ATOM 0 HG13 ILE A 134 11.153 -12.751 3.566 1.00 43.14 H new ATOM 0 HG21 ILE A 134 10.464 -16.425 3.939 1.00 22.14 H new ATOM 0 HG22 ILE A 134 9.726 -16.305 5.554 1.00 22.14 H new ATOM 0 HG23 ILE A 134 8.848 -15.704 4.128 1.00 22.14 H new ATOM 0 HD11 ILE A 134 11.825 -13.982 1.552 1.00 1.11 H new ATOM 0 HD12 ILE A 134 12.662 -14.629 2.983 1.00 1.11 H new ATOM 0 HD13 ILE A 134 11.281 -15.509 2.286 1.00 1.11 H new ATOM 2126 N ASP A 135 10.737 -13.865 7.852 1.00 34.11 N ATOM 2127 CA ASP A 135 10.914 -14.249 9.273 1.00 32.22 C ATOM 2128 C ASP A 135 9.853 -13.566 10.183 1.00 65.12 C ATOM 2129 O ASP A 135 9.418 -14.137 11.193 1.00 0.04 O ATOM 2130 CB ASP A 135 12.344 -13.883 9.754 1.00 63.33 C ATOM 2131 CG ASP A 135 13.456 -14.616 8.977 1.00 14.35 C ATOM 2132 OD1 ASP A 135 13.595 -15.845 9.142 1.00 74.15 O ATOM 2133 OD2 ASP A 135 14.198 -13.969 8.205 1.00 31.14 O ATOM 0 H ASP A 135 11.549 -13.391 7.457 1.00 34.11 H new ATOM 0 HA ASP A 135 10.776 -15.328 9.347 1.00 32.22 H new ATOM 0 HB2 ASP A 135 12.489 -12.807 9.654 1.00 63.33 H new ATOM 0 HB3 ASP A 135 12.435 -14.120 10.814 1.00 63.33 H new ATOM 2138 N MET A 136 9.448 -12.340 9.797 1.00 41.21 N ATOM 2139 CA MET A 136 8.377 -11.574 10.480 1.00 55.41 C ATOM 2140 C MET A 136 6.976 -12.191 10.202 1.00 12.44 C ATOM 2141 O MET A 136 6.078 -12.119 11.045 1.00 73.50 O ATOM 2142 CB MET A 136 8.420 -10.093 9.999 1.00 12.03 C ATOM 2143 CG MET A 136 7.505 -9.123 10.764 1.00 62.34 C ATOM 2144 SD MET A 136 7.981 -8.944 12.496 1.00 74.15 S ATOM 2145 CE MET A 136 9.621 -8.217 12.361 1.00 64.12 C ATOM 0 H MET A 136 9.853 -11.848 9.001 1.00 41.21 H new ATOM 0 HA MET A 136 8.548 -11.617 11.556 1.00 55.41 H new ATOM 0 HB2 MET A 136 9.446 -9.734 10.076 1.00 12.03 H new ATOM 0 HB3 MET A 136 8.150 -10.064 8.943 1.00 12.03 H new ATOM 0 HG2 MET A 136 7.531 -8.146 10.281 1.00 62.34 H new ATOM 0 HG3 MET A 136 6.476 -9.479 10.708 1.00 62.34 H new ATOM 0 HE1 MET A 136 9.905 -7.780 13.318 1.00 64.12 H new ATOM 0 HE2 MET A 136 10.340 -8.989 12.087 1.00 64.12 H new ATOM 0 HE3 MET A 136 9.613 -7.441 11.596 1.00 64.12 H new ATOM 2155 N GLY A 137 6.821 -12.822 9.020 1.00 72.33 N ATOM 2156 CA GLY A 137 5.533 -13.393 8.588 1.00 61.50 C ATOM 2157 C GLY A 137 4.640 -12.361 7.888 1.00 63.31 C ATOM 2158 O GLY A 137 3.457 -12.219 8.217 1.00 54.05 O ATOM 0 H GLY A 137 7.577 -12.948 8.347 1.00 72.33 H new ATOM 0 HA2 GLY A 137 5.718 -14.228 7.912 1.00 61.50 H new ATOM 0 HA3 GLY A 137 5.008 -13.795 9.455 1.00 61.50 H new ATOM 2162 N VAL A 138 5.221 -11.659 6.900 1.00 72.24 N ATOM 2163 CA VAL A 138 4.578 -10.516 6.211 1.00 42.32 C ATOM 2164 C VAL A 138 3.502 -10.953 5.172 1.00 50.10 C ATOM 2165 O VAL A 138 2.561 -10.206 4.910 1.00 4.10 O ATOM 2166 CB VAL A 138 5.679 -9.630 5.506 1.00 24.43 C ATOM 2167 CG1 VAL A 138 6.317 -10.363 4.295 1.00 32.21 C ATOM 2168 CG2 VAL A 138 5.133 -8.238 5.108 1.00 74.11 C ATOM 0 H VAL A 138 6.157 -11.867 6.551 1.00 72.24 H new ATOM 0 HA VAL A 138 4.059 -9.937 6.975 1.00 42.32 H new ATOM 0 HB VAL A 138 6.470 -9.465 6.237 1.00 24.43 H new ATOM 0 HG11 VAL A 138 7.069 -9.721 3.836 1.00 32.21 H new ATOM 0 HG12 VAL A 138 6.786 -11.287 4.635 1.00 32.21 H new ATOM 0 HG13 VAL A 138 5.544 -10.596 3.563 1.00 32.21 H new ATOM 0 HG21 VAL A 138 5.923 -7.661 4.626 1.00 74.11 H new ATOM 0 HG22 VAL A 138 4.299 -8.358 4.417 1.00 74.11 H new ATOM 0 HG23 VAL A 138 4.792 -7.712 6.000 1.00 74.11 H new ATOM 2178 N GLU A 139 3.640 -12.174 4.612 1.00 64.12 N ATOM 2179 CA GLU A 139 2.808 -12.655 3.469 1.00 64.14 C ATOM 2180 C GLU A 139 1.300 -12.723 3.820 1.00 51.31 C ATOM 2181 O GLU A 139 0.453 -12.221 3.067 1.00 74.33 O ATOM 2182 CB GLU A 139 3.328 -14.032 2.988 1.00 22.34 C ATOM 2183 CG GLU A 139 4.780 -14.000 2.468 1.00 44.43 C ATOM 2184 CD GLU A 139 5.310 -15.380 2.050 1.00 1.25 C ATOM 2185 OE1 GLU A 139 4.855 -15.916 1.012 1.00 72.42 O ATOM 2186 OE2 GLU A 139 6.187 -15.933 2.744 1.00 21.00 O ATOM 0 H GLU A 139 4.326 -12.857 4.932 1.00 64.12 H new ATOM 0 HA GLU A 139 2.903 -11.930 2.661 1.00 64.14 H new ATOM 0 HB2 GLU A 139 3.262 -14.743 3.811 1.00 22.34 H new ATOM 0 HB3 GLU A 139 2.676 -14.400 2.196 1.00 22.34 H new ATOM 0 HG2 GLU A 139 4.838 -13.324 1.615 1.00 44.43 H new ATOM 0 HG3 GLU A 139 5.427 -13.591 3.244 1.00 44.43 H new ATOM 2193 N THR A 140 0.987 -13.321 4.983 1.00 35.43 N ATOM 2194 CA THR A 140 -0.392 -13.374 5.517 1.00 42.03 C ATOM 2195 C THR A 140 -0.876 -11.965 5.932 1.00 63.42 C ATOM 2196 O THR A 140 -2.039 -11.630 5.726 1.00 43.42 O ATOM 2197 CB THR A 140 -0.501 -14.353 6.738 1.00 42.32 C ATOM 2198 OG1 THR A 140 -0.117 -15.678 6.338 1.00 64.41 O ATOM 2199 CG2 THR A 140 -1.918 -14.405 7.339 1.00 73.31 C ATOM 0 H THR A 140 1.676 -13.780 5.579 1.00 35.43 H new ATOM 0 HA THR A 140 -1.032 -13.750 4.719 1.00 42.03 H new ATOM 0 HB THR A 140 0.171 -13.970 7.506 1.00 42.32 H new ATOM 0 HG1 THR A 140 -0.186 -16.284 7.105 1.00 64.41 H new ATOM 0 HG21 THR A 140 -1.931 -15.099 8.180 1.00 73.31 H new ATOM 0 HG22 THR A 140 -2.204 -13.411 7.684 1.00 73.31 H new ATOM 0 HG23 THR A 140 -2.623 -14.742 6.579 1.00 73.31 H new ATOM 2207 N GLY A 141 0.040 -11.147 6.494 1.00 43.22 N ATOM 2208 CA GLY A 141 -0.280 -9.769 6.920 1.00 31.30 C ATOM 2209 C GLY A 141 -0.720 -8.852 5.768 1.00 44.42 C ATOM 2210 O GLY A 141 -1.680 -8.090 5.906 1.00 45.23 O ATOM 0 H GLY A 141 1.008 -11.419 6.663 1.00 43.22 H new ATOM 0 HA2 GLY A 141 -1.073 -9.804 7.667 1.00 31.30 H new ATOM 0 HA3 GLY A 141 0.595 -9.335 7.404 1.00 31.30 H new ATOM 2214 N MET A 142 -0.026 -8.960 4.618 1.00 54.13 N ATOM 2215 CA MET A 142 -0.340 -8.177 3.401 1.00 61.42 C ATOM 2216 C MET A 142 -1.683 -8.623 2.783 1.00 63.44 C ATOM 2217 O MET A 142 -2.518 -7.783 2.439 1.00 74.14 O ATOM 2218 CB MET A 142 0.809 -8.302 2.357 1.00 15.53 C ATOM 2219 CG MET A 142 2.127 -7.627 2.777 1.00 22.22 C ATOM 2220 SD MET A 142 3.422 -7.751 1.516 1.00 33.00 S ATOM 2221 CE MET A 142 3.753 -9.512 1.474 1.00 41.10 C ATOM 0 H MET A 142 0.767 -9.591 4.504 1.00 54.13 H new ATOM 0 HA MET A 142 -0.433 -7.130 3.691 1.00 61.42 H new ATOM 0 HB2 MET A 142 1.000 -9.359 2.170 1.00 15.53 H new ATOM 0 HB3 MET A 142 0.476 -7.866 1.415 1.00 15.53 H new ATOM 0 HG2 MET A 142 1.937 -6.575 2.992 1.00 22.22 H new ATOM 0 HG3 MET A 142 2.483 -8.082 3.701 1.00 22.22 H new ATOM 0 HE1 MET A 142 4.787 -9.695 1.765 1.00 41.10 H new ATOM 0 HE2 MET A 142 3.085 -10.024 2.167 1.00 41.10 H new ATOM 0 HE3 MET A 142 3.588 -9.889 0.465 1.00 41.10 H new ATOM 2231 N ASN A 143 -1.884 -9.954 2.678 1.00 32.11 N ATOM 2232 CA ASN A 143 -3.134 -10.542 2.138 1.00 44.43 C ATOM 2233 C ASN A 143 -4.344 -10.171 3.017 1.00 13.24 C ATOM 2234 O ASN A 143 -5.398 -9.823 2.499 1.00 35.13 O ATOM 2235 CB ASN A 143 -3.001 -12.082 2.016 1.00 41.41 C ATOM 2236 CG ASN A 143 -4.154 -12.713 1.226 1.00 44.15 C ATOM 2237 OD1 ASN A 143 -4.098 -12.824 0.006 1.00 62.01 O ATOM 2238 ND2 ASN A 143 -5.210 -13.120 1.906 1.00 53.53 N ATOM 0 H ASN A 143 -1.192 -10.648 2.962 1.00 32.11 H new ATOM 0 HA ASN A 143 -3.301 -10.128 1.143 1.00 44.43 H new ATOM 0 HB2 ASN A 143 -2.056 -12.324 1.529 1.00 41.41 H new ATOM 0 HB3 ASN A 143 -2.966 -12.520 3.013 1.00 41.41 H new ATOM 0 HD21 ASN A 143 -6.002 -13.537 1.417 1.00 53.53 H new ATOM 0 HD22 ASN A 143 -5.234 -13.017 2.921 1.00 53.53 H new ATOM 2245 N SER A 144 -4.144 -10.216 4.347 1.00 13.33 N ATOM 2246 CA SER A 144 -5.182 -9.894 5.361 1.00 63.03 C ATOM 2247 C SER A 144 -5.685 -8.445 5.206 1.00 53.40 C ATOM 2248 O SER A 144 -6.893 -8.189 5.184 1.00 12.54 O ATOM 2249 CB SER A 144 -4.618 -10.094 6.790 1.00 60.51 C ATOM 2250 OG SER A 144 -5.578 -9.783 7.788 1.00 32.22 O ATOM 0 H SER A 144 -3.249 -10.479 4.759 1.00 13.33 H new ATOM 0 HA SER A 144 -6.021 -10.571 5.202 1.00 63.03 H new ATOM 0 HB2 SER A 144 -4.292 -11.127 6.910 1.00 60.51 H new ATOM 0 HB3 SER A 144 -3.738 -9.464 6.924 1.00 60.51 H new ATOM 0 HG SER A 144 -5.185 -9.923 8.675 1.00 32.22 H new ATOM 2256 N THR A 145 -4.724 -7.514 5.084 1.00 13.21 N ATOM 2257 CA THR A 145 -4.991 -6.076 4.841 1.00 4.20 C ATOM 2258 C THR A 145 -5.736 -5.857 3.489 1.00 55.30 C ATOM 2259 O THR A 145 -6.582 -4.965 3.365 1.00 31.41 O ATOM 2260 CB THR A 145 -3.644 -5.267 4.873 1.00 32.33 C ATOM 2261 OG1 THR A 145 -2.970 -5.506 6.122 1.00 74.20 O ATOM 2262 CG2 THR A 145 -3.846 -3.753 4.716 1.00 45.42 C ATOM 0 H THR A 145 -3.730 -7.734 5.151 1.00 13.21 H new ATOM 0 HA THR A 145 -5.642 -5.710 5.635 1.00 4.20 H new ATOM 0 HB THR A 145 -3.052 -5.614 4.026 1.00 32.33 H new ATOM 0 HG1 THR A 145 -2.507 -6.369 6.084 1.00 74.20 H new ATOM 0 HG21 THR A 145 -2.879 -3.252 4.746 1.00 45.42 H new ATOM 0 HG22 THR A 145 -4.331 -3.548 3.762 1.00 45.42 H new ATOM 0 HG23 THR A 145 -4.472 -3.383 5.528 1.00 45.42 H new ATOM 2270 N LEU A 146 -5.422 -6.702 2.488 1.00 73.43 N ATOM 2271 CA LEU A 146 -6.104 -6.695 1.171 1.00 14.54 C ATOM 2272 C LEU A 146 -7.497 -7.389 1.200 1.00 52.40 C ATOM 2273 O LEU A 146 -8.325 -7.133 0.323 1.00 20.34 O ATOM 2274 CB LEU A 146 -5.186 -7.283 0.072 1.00 42.40 C ATOM 2275 CG LEU A 146 -3.859 -6.488 -0.194 1.00 24.14 C ATOM 2276 CD1 LEU A 146 -3.114 -7.021 -1.425 1.00 34.13 C ATOM 2277 CD2 LEU A 146 -4.109 -4.974 -0.331 1.00 45.51 C ATOM 0 H LEU A 146 -4.691 -7.409 2.565 1.00 73.43 H new ATOM 0 HA LEU A 146 -6.302 -5.652 0.924 1.00 14.54 H new ATOM 0 HB2 LEU A 146 -4.928 -8.306 0.347 1.00 42.40 H new ATOM 0 HB3 LEU A 146 -5.750 -7.336 -0.859 1.00 42.40 H new ATOM 0 HG LEU A 146 -3.227 -6.644 0.680 1.00 24.14 H new ATOM 0 HD11 LEU A 146 -2.201 -6.445 -1.576 1.00 34.13 H new ATOM 0 HD12 LEU A 146 -2.860 -8.070 -1.271 1.00 34.13 H new ATOM 0 HD13 LEU A 146 -3.751 -6.928 -2.304 1.00 34.13 H new ATOM 0 HD21 LEU A 146 -3.163 -4.464 -0.514 1.00 45.51 H new ATOM 0 HD22 LEU A 146 -4.787 -4.791 -1.165 1.00 45.51 H new ATOM 0 HD23 LEU A 146 -4.554 -4.594 0.589 1.00 45.51 H new ATOM 2289 N ASN A 147 -7.744 -8.295 2.179 1.00 0.21 N ATOM 2290 CA ASN A 147 -9.122 -8.797 2.461 1.00 62.04 C ATOM 2291 C ASN A 147 -9.991 -7.654 3.020 1.00 42.30 C ATOM 2292 O ASN A 147 -11.191 -7.570 2.739 1.00 71.20 O ATOM 2293 CB ASN A 147 -9.136 -9.982 3.468 1.00 35.21 C ATOM 2294 CG ASN A 147 -8.510 -11.266 2.917 1.00 11.15 C ATOM 2295 OD1 ASN A 147 -7.355 -11.570 3.151 1.00 33.11 O ATOM 2296 ND2 ASN A 147 -9.279 -12.034 2.167 1.00 34.51 N ATOM 0 H ASN A 147 -7.022 -8.691 2.781 1.00 0.21 H new ATOM 0 HA ASN A 147 -9.524 -9.161 1.516 1.00 62.04 H new ATOM 0 HB2 ASN A 147 -8.602 -9.686 4.371 1.00 35.21 H new ATOM 0 HB3 ASN A 147 -10.166 -10.187 3.760 1.00 35.21 H new ATOM 0 HD21 ASN A 147 -8.907 -12.898 1.773 1.00 34.51 H new ATOM 0 HD22 ASN A 147 -10.245 -11.763 1.982 1.00 34.51 H new ATOM 2303 N GLN A 148 -9.359 -6.787 3.832 1.00 50.52 N ATOM 2304 CA GLN A 148 -9.998 -5.570 4.367 1.00 55.42 C ATOM 2305 C GLN A 148 -10.270 -4.553 3.237 1.00 54.22 C ATOM 2306 O GLN A 148 -11.287 -3.861 3.256 1.00 63.05 O ATOM 2307 CB GLN A 148 -9.115 -4.931 5.477 1.00 75.20 C ATOM 2308 CG GLN A 148 -8.728 -5.896 6.624 1.00 45.31 C ATOM 2309 CD GLN A 148 -9.916 -6.563 7.338 1.00 10.01 C ATOM 2310 OE1 GLN A 148 -9.829 -7.701 7.786 1.00 40.22 O ATOM 2311 NE2 GLN A 148 -11.028 -5.865 7.471 1.00 50.41 N ATOM 0 H GLN A 148 -8.393 -6.910 4.135 1.00 50.52 H new ATOM 0 HA GLN A 148 -10.954 -5.853 4.808 1.00 55.42 H new ATOM 0 HB2 GLN A 148 -8.203 -4.545 5.021 1.00 75.20 H new ATOM 0 HB3 GLN A 148 -9.646 -4.078 5.900 1.00 75.20 H new ATOM 0 HG2 GLN A 148 -8.081 -6.675 6.221 1.00 45.31 H new ATOM 0 HG3 GLN A 148 -8.143 -5.345 7.361 1.00 45.31 H new ATOM 0 HE21 GLN A 148 -11.085 -4.919 7.093 1.00 50.41 H new ATOM 0 HE22 GLN A 148 -11.831 -6.271 7.952 1.00 50.41 H new ATOM 2320 N LEU A 149 -9.350 -4.496 2.246 1.00 5.42 N ATOM 2321 CA LEU A 149 -9.510 -3.667 1.037 1.00 74.33 C ATOM 2322 C LEU A 149 -10.692 -4.167 0.173 1.00 73.52 C ATOM 2323 O LEU A 149 -11.515 -3.373 -0.263 1.00 34.34 O ATOM 2324 CB LEU A 149 -8.181 -3.635 0.217 1.00 11.43 C ATOM 2325 CG LEU A 149 -8.206 -2.809 -1.113 1.00 43.41 C ATOM 2326 CD1 LEU A 149 -8.807 -1.415 -0.890 1.00 44.22 C ATOM 2327 CD2 LEU A 149 -6.800 -2.691 -1.752 1.00 23.13 C ATOM 0 H LEU A 149 -8.478 -5.025 2.266 1.00 5.42 H new ATOM 0 HA LEU A 149 -9.740 -2.648 1.348 1.00 74.33 H new ATOM 0 HB2 LEU A 149 -7.395 -3.232 0.855 1.00 11.43 H new ATOM 0 HB3 LEU A 149 -7.902 -4.661 -0.023 1.00 11.43 H new ATOM 0 HG LEU A 149 -8.842 -3.356 -1.809 1.00 43.41 H new ATOM 0 HD11 LEU A 149 -8.811 -0.866 -1.831 1.00 44.22 H new ATOM 0 HD12 LEU A 149 -9.829 -1.514 -0.523 1.00 44.22 H new ATOM 0 HD13 LEU A 149 -8.209 -0.874 -0.157 1.00 44.22 H new ATOM 0 HD21 LEU A 149 -6.866 -2.110 -2.672 1.00 23.13 H new ATOM 0 HD22 LEU A 149 -6.125 -2.193 -1.056 1.00 23.13 H new ATOM 0 HD23 LEU A 149 -6.418 -3.687 -1.978 1.00 23.13 H new ATOM 2339 N GLU A 150 -10.785 -5.490 -0.031 1.00 12.43 N ATOM 2340 CA GLU A 150 -11.887 -6.104 -0.815 1.00 74.22 C ATOM 2341 C GLU A 150 -13.277 -5.802 -0.177 1.00 53.13 C ATOM 2342 O GLU A 150 -14.205 -5.394 -0.872 1.00 1.44 O ATOM 2343 CB GLU A 150 -11.659 -7.632 -0.950 1.00 44.22 C ATOM 2344 CG GLU A 150 -12.722 -8.377 -1.790 1.00 24.24 C ATOM 2345 CD GLU A 150 -12.435 -9.881 -1.924 1.00 63.43 C ATOM 2346 OE1 GLU A 150 -12.361 -10.570 -0.887 1.00 51.23 O ATOM 2347 OE2 GLU A 150 -12.220 -10.372 -3.056 1.00 44.24 O ATOM 0 H GLU A 150 -10.112 -6.164 0.334 1.00 12.43 H new ATOM 0 HA GLU A 150 -11.884 -5.661 -1.811 1.00 74.22 H new ATOM 0 HB2 GLU A 150 -10.680 -7.800 -1.398 1.00 44.22 H new ATOM 0 HB3 GLU A 150 -11.633 -8.070 0.048 1.00 44.22 H new ATOM 0 HG2 GLU A 150 -13.701 -8.239 -1.332 1.00 24.24 H new ATOM 0 HG3 GLU A 150 -12.769 -7.932 -2.784 1.00 24.24 H new ATOM 2354 N LYS A 151 -13.383 -5.967 1.162 1.00 24.11 N ATOM 2355 CA LYS A 151 -14.630 -5.659 1.922 1.00 61.52 C ATOM 2356 C LYS A 151 -14.930 -4.134 1.979 1.00 53.01 C ATOM 2357 O LYS A 151 -16.090 -3.737 2.078 1.00 30.23 O ATOM 2358 CB LYS A 151 -14.558 -6.253 3.357 1.00 65.53 C ATOM 2359 CG LYS A 151 -14.503 -7.801 3.406 1.00 25.14 C ATOM 2360 CD LYS A 151 -14.680 -8.374 4.836 1.00 62.05 C ATOM 2361 CE LYS A 151 -13.554 -7.965 5.808 1.00 12.21 C ATOM 2362 NZ LYS A 151 -12.228 -8.491 5.388 1.00 31.14 N ATOM 0 H LYS A 151 -12.621 -6.312 1.745 1.00 24.11 H new ATOM 0 HA LYS A 151 -15.454 -6.128 1.384 1.00 61.52 H new ATOM 0 HB2 LYS A 151 -13.676 -5.854 3.859 1.00 65.53 H new ATOM 0 HB3 LYS A 151 -15.427 -5.914 3.922 1.00 65.53 H new ATOM 0 HG2 LYS A 151 -15.282 -8.206 2.760 1.00 25.14 H new ATOM 0 HG3 LYS A 151 -13.548 -8.137 3.003 1.00 25.14 H new ATOM 0 HD2 LYS A 151 -15.636 -8.037 5.238 1.00 62.05 H new ATOM 0 HD3 LYS A 151 -14.723 -9.462 4.780 1.00 62.05 H new ATOM 0 HE2 LYS A 151 -13.508 -6.878 5.871 1.00 12.21 H new ATOM 0 HE3 LYS A 151 -13.788 -8.332 6.807 1.00 12.21 H new ATOM 0 HZ1 LYS A 151 -11.529 -8.308 6.136 1.00 31.14 H new ATOM 0 HZ2 LYS A 151 -12.298 -9.515 5.222 1.00 31.14 H new ATOM 0 HZ3 LYS A 151 -11.929 -8.018 4.512 1.00 31.14 H new ATOM 2376 N LEU A 152 -13.870 -3.306 1.925 1.00 21.23 N ATOM 2377 CA LEU A 152 -13.975 -1.821 1.815 1.00 22.24 C ATOM 2378 C LEU A 152 -14.674 -1.405 0.490 1.00 61.11 C ATOM 2379 O LEU A 152 -15.642 -0.633 0.493 1.00 32.22 O ATOM 2380 CB LEU A 152 -12.541 -1.195 1.918 1.00 25.22 C ATOM 2381 CG LEU A 152 -12.322 0.232 1.311 1.00 21.11 C ATOM 2382 CD1 LEU A 152 -13.228 1.287 1.961 1.00 24.03 C ATOM 2383 CD2 LEU A 152 -10.842 0.649 1.394 1.00 3.41 C ATOM 0 H LEU A 152 -12.907 -3.641 1.956 1.00 21.23 H new ATOM 0 HA LEU A 152 -14.589 -1.445 2.633 1.00 22.24 H new ATOM 0 HB2 LEU A 152 -12.267 -1.156 2.972 1.00 25.22 H new ATOM 0 HB3 LEU A 152 -11.842 -1.876 1.432 1.00 25.22 H new ATOM 0 HG LEU A 152 -12.603 0.175 0.259 1.00 21.11 H new ATOM 0 HD11 LEU A 152 -13.039 2.259 1.506 1.00 24.03 H new ATOM 0 HD12 LEU A 152 -14.272 1.013 1.810 1.00 24.03 H new ATOM 0 HD13 LEU A 152 -13.018 1.339 3.029 1.00 24.03 H new ATOM 0 HD21 LEU A 152 -10.720 1.644 0.965 1.00 3.41 H new ATOM 0 HD22 LEU A 152 -10.526 0.662 2.437 1.00 3.41 H new ATOM 0 HD23 LEU A 152 -10.232 -0.063 0.839 1.00 3.41 H new ATOM 2395 N LEU A 153 -14.162 -1.935 -0.628 1.00 51.03 N ATOM 2396 CA LEU A 153 -14.649 -1.611 -1.990 1.00 14.20 C ATOM 2397 C LEU A 153 -16.059 -2.191 -2.227 1.00 74.45 C ATOM 2398 O LEU A 153 -16.902 -1.567 -2.869 1.00 34.13 O ATOM 2399 CB LEU A 153 -13.631 -2.153 -3.019 1.00 34.42 C ATOM 2400 CG LEU A 153 -12.163 -1.685 -2.773 1.00 75.42 C ATOM 2401 CD1 LEU A 153 -11.170 -2.426 -3.672 1.00 44.11 C ATOM 2402 CD2 LEU A 153 -12.024 -0.149 -2.889 1.00 63.44 C ATOM 0 H LEU A 153 -13.393 -2.605 -0.621 1.00 51.03 H new ATOM 0 HA LEU A 153 -14.733 -0.530 -2.104 1.00 14.20 H new ATOM 0 HB2 LEU A 153 -13.661 -3.242 -3.004 1.00 34.42 H new ATOM 0 HB3 LEU A 153 -13.938 -1.840 -4.017 1.00 34.42 H new ATOM 0 HG LEU A 153 -11.910 -1.947 -1.746 1.00 75.42 H new ATOM 0 HD11 LEU A 153 -10.160 -2.070 -3.469 1.00 44.11 H new ATOM 0 HD12 LEU A 153 -11.225 -3.496 -3.471 1.00 44.11 H new ATOM 0 HD13 LEU A 153 -11.417 -2.240 -4.717 1.00 44.11 H new ATOM 0 HD21 LEU A 153 -10.987 0.137 -2.711 1.00 63.44 H new ATOM 0 HD22 LEU A 153 -12.322 0.169 -3.888 1.00 63.44 H new ATOM 0 HD23 LEU A 153 -12.665 0.331 -2.150 1.00 63.44 H new ATOM 2414 N ASN A 154 -16.300 -3.388 -1.668 1.00 33.23 N ATOM 2415 CA ASN A 154 -17.627 -4.047 -1.698 1.00 43.21 C ATOM 2416 C ASN A 154 -18.564 -3.475 -0.601 1.00 2.50 C ATOM 2417 O ASN A 154 -19.743 -3.842 -0.542 1.00 33.45 O ATOM 2418 CB ASN A 154 -17.477 -5.582 -1.564 1.00 63.34 C ATOM 2419 CG ASN A 154 -16.746 -6.258 -2.738 1.00 44.23 C ATOM 2420 OD1 ASN A 154 -15.701 -5.635 -3.264 1.00 12.23 O flip ATOM 2421 ND2 ASN A 154 -17.086 -7.363 -3.142 1.00 53.53 N flip ATOM 0 H ASN A 154 -15.585 -3.930 -1.182 1.00 33.23 H new ATOM 0 HA ASN A 154 -18.088 -3.836 -2.663 1.00 43.21 H new ATOM 0 HB2 ASN A 154 -16.939 -5.802 -0.642 1.00 63.34 H new ATOM 0 HB3 ASN A 154 -18.469 -6.024 -1.467 1.00 63.34 H new ATOM 0 HD21 ASN A 154 -17.892 -7.831 -2.728 1.00 53.53 H new ATOM 0 HD22 ASN A 154 -16.563 -7.815 -3.892 1.00 53.53 H new ATOM 2428 N GLN A 155 -17.998 -2.594 0.265 1.00 12.44 N ATOM 2429 CA GLN A 155 -18.721 -1.785 1.281 1.00 34.53 C ATOM 2430 C GLN A 155 -19.339 -2.658 2.401 1.00 40.02 C ATOM 2431 O GLN A 155 -18.813 -2.707 3.519 1.00 73.22 O ATOM 2432 CB GLN A 155 -19.770 -0.850 0.607 1.00 1.22 C ATOM 2433 CG GLN A 155 -19.158 0.139 -0.415 1.00 75.32 C ATOM 2434 CD GLN A 155 -20.202 0.990 -1.143 1.00 51.51 C ATOM 2435 OE1 GLN A 155 -20.695 0.620 -2.207 1.00 43.24 O ATOM 2436 NE2 GLN A 155 -20.560 2.123 -0.572 1.00 32.53 N ATOM 0 H GLN A 155 -16.993 -2.422 0.275 1.00 12.44 H new ATOM 0 HA GLN A 155 -17.986 -1.148 1.774 1.00 34.53 H new ATOM 0 HB2 GLN A 155 -20.518 -1.462 0.103 1.00 1.22 H new ATOM 0 HB3 GLN A 155 -20.289 -0.284 1.381 1.00 1.22 H new ATOM 0 HG2 GLN A 155 -18.460 0.798 0.102 1.00 75.32 H new ATOM 0 HG3 GLN A 155 -18.581 -0.422 -1.150 1.00 75.32 H new ATOM 0 HE21 GLN A 155 -20.135 2.406 0.311 1.00 32.53 H new ATOM 0 HE22 GLN A 155 -21.262 2.717 -1.013 1.00 32.53 H new ATOM 2445 N LYS A 156 -20.444 -3.363 2.096 1.00 62.20 N ATOM 2446 CA LYS A 156 -21.111 -4.278 3.051 1.00 44.03 C ATOM 2447 C LYS A 156 -20.941 -5.754 2.607 1.00 11.12 C ATOM 2448 O LYS A 156 -21.918 -6.512 2.524 1.00 35.32 O ATOM 2449 CB LYS A 156 -22.615 -3.894 3.204 1.00 71.44 C ATOM 2450 CG LYS A 156 -22.857 -2.439 3.684 1.00 22.41 C ATOM 2451 CD LYS A 156 -24.321 -2.173 4.113 1.00 31.25 C ATOM 2452 CE LYS A 156 -24.747 -3.030 5.324 1.00 2.20 C ATOM 2453 NZ LYS A 156 -26.165 -2.813 5.704 1.00 11.14 N ATOM 0 H LYS A 156 -20.901 -3.317 1.185 1.00 62.20 H new ATOM 0 HA LYS A 156 -20.637 -4.175 4.027 1.00 44.03 H new ATOM 0 HB2 LYS A 156 -23.113 -4.035 2.245 1.00 71.44 H new ATOM 0 HB3 LYS A 156 -23.083 -4.580 3.910 1.00 71.44 H new ATOM 0 HG2 LYS A 156 -22.195 -2.225 4.523 1.00 22.41 H new ATOM 0 HG3 LYS A 156 -22.589 -1.750 2.883 1.00 22.41 H new ATOM 0 HD2 LYS A 156 -24.438 -1.118 4.360 1.00 31.25 H new ATOM 0 HD3 LYS A 156 -24.985 -2.380 3.274 1.00 31.25 H new ATOM 0 HE2 LYS A 156 -24.594 -4.084 5.091 1.00 2.20 H new ATOM 0 HE3 LYS A 156 -24.107 -2.795 6.174 1.00 2.20 H new ATOM 0 HZ1 LYS A 156 -26.401 -3.411 6.521 1.00 11.14 H new ATOM 0 HZ2 LYS A 156 -26.309 -1.814 5.953 1.00 11.14 H new ATOM 0 HZ3 LYS A 156 -26.781 -3.062 4.904 1.00 11.14 H new ATOM 2467 N LEU A 157 -19.681 -6.159 2.326 1.00 21.32 N ATOM 2468 CA LEU A 157 -19.340 -7.572 2.038 1.00 61.22 C ATOM 2469 C LEU A 157 -19.452 -8.391 3.353 1.00 22.25 C ATOM 2470 O LEU A 157 -18.510 -8.447 4.155 1.00 35.45 O ATOM 2471 CB LEU A 157 -17.921 -7.670 1.367 1.00 50.20 C ATOM 2472 CG LEU A 157 -17.518 -9.014 0.625 1.00 4.10 C ATOM 2473 CD1 LEU A 157 -16.159 -8.860 -0.094 1.00 23.11 C ATOM 2474 CD2 LEU A 157 -17.473 -10.255 1.553 1.00 53.22 C ATOM 0 H LEU A 157 -18.882 -5.526 2.293 1.00 21.32 H new ATOM 0 HA LEU A 157 -20.041 -7.997 1.320 1.00 61.22 H new ATOM 0 HB2 LEU A 157 -17.840 -6.857 0.645 1.00 50.20 H new ATOM 0 HB3 LEU A 157 -17.176 -7.484 2.141 1.00 50.20 H new ATOM 0 HG LEU A 157 -18.310 -9.191 -0.102 1.00 4.10 H new ATOM 0 HD11 LEU A 157 -15.905 -9.794 -0.595 1.00 23.11 H new ATOM 0 HD12 LEU A 157 -16.226 -8.060 -0.831 1.00 23.11 H new ATOM 0 HD13 LEU A 157 -15.387 -8.618 0.636 1.00 23.11 H new ATOM 0 HD21 LEU A 157 -17.190 -11.133 0.973 1.00 53.22 H new ATOM 0 HD22 LEU A 157 -16.741 -10.092 2.344 1.00 53.22 H new ATOM 0 HD23 LEU A 157 -18.456 -10.414 1.996 1.00 53.22 H new ATOM 2486 N GLU A 158 -20.643 -8.976 3.569 1.00 71.11 N ATOM 2487 CA GLU A 158 -20.935 -9.850 4.726 1.00 35.43 C ATOM 2488 C GLU A 158 -22.014 -10.879 4.298 1.00 12.51 C ATOM 2489 O GLU A 158 -23.097 -10.973 4.886 1.00 72.21 O ATOM 2490 CB GLU A 158 -21.373 -8.986 5.971 1.00 74.32 C ATOM 2491 CG GLU A 158 -21.123 -9.616 7.379 1.00 41.15 C ATOM 2492 CD GLU A 158 -22.017 -10.824 7.727 1.00 52.14 C ATOM 2493 OE1 GLU A 158 -23.175 -10.617 8.160 1.00 42.43 O ATOM 2494 OE2 GLU A 158 -21.582 -11.983 7.543 1.00 2.25 O ATOM 0 H GLU A 158 -21.439 -8.856 2.942 1.00 71.11 H new ATOM 0 HA GLU A 158 -20.044 -10.396 5.035 1.00 35.43 H new ATOM 0 HB2 GLU A 158 -20.848 -8.032 5.926 1.00 74.32 H new ATOM 0 HB3 GLU A 158 -22.437 -8.769 5.878 1.00 74.32 H new ATOM 0 HG2 GLU A 158 -20.080 -9.927 7.440 1.00 41.15 H new ATOM 0 HG3 GLU A 158 -21.271 -8.845 8.135 1.00 41.15 H new ATOM 2501 N HIS A 159 -21.717 -11.605 3.206 1.00 44.14 N ATOM 2502 CA HIS A 159 -22.544 -12.732 2.711 1.00 42.41 C ATOM 2503 C HIS A 159 -21.620 -13.884 2.262 1.00 2.33 C ATOM 2504 O HIS A 159 -21.175 -13.946 1.113 1.00 75.43 O ATOM 2505 CB HIS A 159 -23.516 -12.270 1.585 1.00 24.51 C ATOM 2506 CG HIS A 159 -24.646 -11.401 2.094 1.00 1.45 C ATOM 2507 ND1 HIS A 159 -24.763 -10.058 1.814 1.00 31.03 N ATOM 2508 CD2 HIS A 159 -25.692 -11.696 2.911 1.00 10.24 C ATOM 2509 CE1 HIS A 159 -25.817 -9.566 2.432 1.00 12.11 C ATOM 2510 NE2 HIS A 159 -26.399 -10.536 3.100 1.00 4.24 N ATOM 0 H HIS A 159 -20.891 -11.429 2.634 1.00 44.14 H new ATOM 0 HA HIS A 159 -23.176 -13.101 3.519 1.00 42.41 H new ATOM 0 HB2 HIS A 159 -22.953 -11.719 0.831 1.00 24.51 H new ATOM 0 HB3 HIS A 159 -23.934 -13.148 1.092 1.00 24.51 H new ATOM 0 HD2 HIS A 159 -25.923 -12.663 3.332 1.00 10.24 H new ATOM 0 HE1 HIS A 159 -26.147 -8.538 2.396 1.00 12.11 H new ATOM 0 HE2 HIS A 159 -27.241 -10.442 3.668 1.00 4.24 H new ATOM 2519 N HIS A 160 -21.324 -14.781 3.215 1.00 73.35 N ATOM 2520 CA HIS A 160 -20.287 -15.826 3.077 1.00 44.03 C ATOM 2521 C HIS A 160 -20.845 -17.110 2.409 1.00 74.45 C ATOM 2522 O HIS A 160 -21.639 -17.845 3.006 1.00 51.33 O ATOM 2523 CB HIS A 160 -19.681 -16.141 4.476 1.00 53.14 C ATOM 2524 CG HIS A 160 -19.019 -14.953 5.139 1.00 32.23 C ATOM 2525 ND1 HIS A 160 -17.652 -14.799 5.221 1.00 33.30 N ATOM 2526 CD2 HIS A 160 -19.546 -13.853 5.737 1.00 31.33 C ATOM 2527 CE1 HIS A 160 -17.371 -13.667 5.829 1.00 4.10 C ATOM 2528 NE2 HIS A 160 -18.500 -13.074 6.152 1.00 25.32 N ATOM 0 H HIS A 160 -21.802 -14.805 4.116 1.00 73.35 H new ATOM 0 HA HIS A 160 -19.502 -15.448 2.421 1.00 44.03 H new ATOM 0 HB2 HIS A 160 -20.471 -16.515 5.127 1.00 53.14 H new ATOM 0 HB3 HIS A 160 -18.948 -16.941 4.372 1.00 53.14 H new ATOM 0 HD2 HIS A 160 -20.596 -13.634 5.862 1.00 31.33 H new ATOM 0 HE1 HIS A 160 -16.380 -13.288 6.029 1.00 4.10 H new ATOM 0 HE2 HIS A 160 -18.582 -12.179 6.634 1.00 25.32 H new ATOM 2537 N HIS A 161 -20.446 -17.337 1.147 1.00 5.12 N ATOM 2538 CA HIS A 161 -20.757 -18.574 0.393 1.00 12.45 C ATOM 2539 C HIS A 161 -19.446 -19.340 0.100 1.00 61.01 C ATOM 2540 O HIS A 161 -18.486 -18.744 -0.412 1.00 25.01 O ATOM 2541 CB HIS A 161 -21.489 -18.235 -0.927 1.00 73.05 C ATOM 2542 CG HIS A 161 -22.796 -17.504 -0.734 1.00 1.12 C ATOM 2543 ND1 HIS A 161 -24.012 -18.144 -0.628 1.00 42.43 N ATOM 2544 CD2 HIS A 161 -23.071 -16.181 -0.620 1.00 62.14 C ATOM 2545 CE1 HIS A 161 -24.966 -17.255 -0.460 1.00 54.43 C ATOM 2546 NE2 HIS A 161 -24.426 -16.054 -0.456 1.00 73.21 N ATOM 0 H HIS A 161 -19.894 -16.666 0.613 1.00 5.12 H new ATOM 0 HA HIS A 161 -21.415 -19.202 0.994 1.00 12.45 H new ATOM 0 HB2 HIS A 161 -20.832 -17.626 -1.549 1.00 73.05 H new ATOM 0 HB3 HIS A 161 -21.679 -19.159 -1.473 1.00 73.05 H new ATOM 0 HD2 HIS A 161 -22.353 -15.375 -0.652 1.00 62.14 H new ATOM 0 HE1 HIS A 161 -26.017 -17.473 -0.345 1.00 54.43 H new ATOM 0 HE2 HIS A 161 -24.932 -15.175 -0.349 1.00 73.21 H new ATOM 2555 N HIS A 162 -19.436 -20.663 0.405 1.00 12.25 N ATOM 2556 CA HIS A 162 -18.228 -21.537 0.368 1.00 13.44 C ATOM 2557 C HIS A 162 -17.191 -21.073 1.431 1.00 2.00 C ATOM 2558 O HIS A 162 -16.556 -20.028 1.265 1.00 34.12 O ATOM 2559 CB HIS A 162 -17.592 -21.611 -1.055 1.00 3.23 C ATOM 2560 CG HIS A 162 -18.538 -22.092 -2.129 1.00 13.13 C ATOM 2561 ND1 HIS A 162 -18.657 -23.415 -2.502 1.00 14.33 N ATOM 2562 CD2 HIS A 162 -19.417 -21.413 -2.911 1.00 70.51 C ATOM 2563 CE1 HIS A 162 -19.560 -23.525 -3.457 1.00 74.55 C ATOM 2564 NE2 HIS A 162 -20.038 -22.328 -3.722 1.00 21.01 N ATOM 0 H HIS A 162 -20.279 -21.163 0.688 1.00 12.25 H new ATOM 0 HA HIS A 162 -18.548 -22.549 0.615 1.00 13.44 H new ATOM 0 HB2 HIS A 162 -17.222 -20.623 -1.328 1.00 3.23 H new ATOM 0 HB3 HIS A 162 -16.729 -22.276 -1.021 1.00 3.23 H new ATOM 0 HD2 HIS A 162 -19.594 -20.348 -2.897 1.00 70.51 H new ATOM 0 HE1 HIS A 162 -19.857 -24.444 -3.941 1.00 74.55 H new ATOM 0 HE2 HIS A 162 -20.754 -22.115 -4.417 1.00 21.01 H new ATOM 2573 N HIS A 163 -17.021 -21.891 2.493 1.00 72.50 N ATOM 2574 CA HIS A 163 -16.305 -21.524 3.749 1.00 55.13 C ATOM 2575 C HIS A 163 -14.891 -20.900 3.510 1.00 41.45 C ATOM 2576 O HIS A 163 -14.725 -19.683 3.643 1.00 12.02 O ATOM 2577 CB HIS A 163 -16.222 -22.789 4.660 1.00 52.44 C ATOM 2578 CG HIS A 163 -15.633 -22.566 6.035 1.00 61.33 C ATOM 2579 ND1 HIS A 163 -16.392 -22.178 7.119 1.00 34.41 N ATOM 2580 CD2 HIS A 163 -14.363 -22.694 6.504 1.00 24.20 C ATOM 2581 CE1 HIS A 163 -15.623 -22.073 8.183 1.00 74.35 C ATOM 2582 NE2 HIS A 163 -14.390 -22.378 7.841 1.00 62.44 N ATOM 0 H HIS A 163 -17.382 -22.845 2.508 1.00 72.50 H new ATOM 0 HA HIS A 163 -16.876 -20.737 4.241 1.00 55.13 H new ATOM 0 HB2 HIS A 163 -17.226 -23.198 4.776 1.00 52.44 H new ATOM 0 HB3 HIS A 163 -15.627 -23.545 4.148 1.00 52.44 H new ATOM 0 HD2 HIS A 163 -13.495 -22.989 5.932 1.00 24.20 H new ATOM 0 HE1 HIS A 163 -15.950 -21.785 9.171 1.00 74.35 H new ATOM 0 HE2 HIS A 163 -13.585 -22.380 8.467 1.00 62.44 H new ATOM 2591 N HIS A 164 -13.903 -21.753 3.158 1.00 60.03 N ATOM 2592 CA HIS A 164 -12.482 -21.354 2.930 1.00 20.34 C ATOM 2593 C HIS A 164 -11.893 -20.503 4.084 1.00 14.24 C ATOM 2594 O HIS A 164 -11.968 -20.867 5.260 1.00 31.33 O ATOM 2595 CB HIS A 164 -12.316 -20.609 1.579 1.00 2.42 C ATOM 2596 CG HIS A 164 -12.770 -21.407 0.384 1.00 42.21 C ATOM 2597 ND1 HIS A 164 -12.048 -22.461 -0.141 1.00 21.35 N ATOM 2598 CD2 HIS A 164 -13.885 -21.309 -0.377 1.00 61.12 C ATOM 2599 CE1 HIS A 164 -12.697 -22.972 -1.164 1.00 24.22 C ATOM 2600 NE2 HIS A 164 -13.813 -22.294 -1.327 1.00 13.15 N ATOM 0 H HIS A 164 -14.064 -22.751 3.021 1.00 60.03 H new ATOM 0 HA HIS A 164 -11.915 -22.284 2.898 1.00 20.34 H new ATOM 0 HB2 HIS A 164 -12.880 -19.677 1.617 1.00 2.42 H new ATOM 0 HB3 HIS A 164 -11.267 -20.342 1.449 1.00 2.42 H new ATOM 0 HD2 HIS A 164 -14.682 -20.590 -0.258 1.00 61.12 H new ATOM 0 HE1 HIS A 164 -12.370 -23.806 -1.767 1.00 24.22 H new ATOM 0 HE2 HIS A 164 -14.513 -22.473 -2.046 1.00 13.15 H new TER 2609 HIS A 164