#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2uuz h LEU 50 N 0.00 0.00 0.00 0.55 8.10 -2.05 -0.77 115.31 121.14 2uuz h LEU 50 Ca 0.00 0.00 -0.26 0.00 0.11 0.00 0.00 57.88 57.73 2uuz h LEU 50 Cb 0.00 0.00 -0.05 0.00 -0.44 0.00 0.00 40.66 40.17 2uuz h LEU 50 CO 0.00 0.00 -1.87 1.21 -4.11 0.00 0.00 178.44 173.67 2uuz n GLU 51 N -2.38 0.65 0.14 0.17 2.13 -1.26 -3.09 120.64 117.00 2uuz n GLU 51 Ca 0.01 0.14 0.00 0.00 0.66 0.00 0.00 57.16 57.97 2uuz n GLU 51 Cb 0.17 -1.69 0.13 0.00 0.27 0.00 0.00 31.44 30.32 2uuz n GLU 51 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2uuz h ALA 52 N 1.19 0.78 0.09 4.31 0.00 -1.77 -2.67 119.26 121.18 2uuz h ALA 52 Ca -0.32 -0.56 -0.29 0.00 0.00 0.00 0.00 54.91 53.74 2uuz h ALA 52 Cb 1.90 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 19.58 2uuz h ALA 52 CO 0.05 0.76 -1.52 -0.56 0.00 0.00 0.00 179.25 177.99 2uuz h GLN 53 N 0.00 0.18 -0.34 0.00 3.07 -1.31 -2.30 115.11 114.41 2uuz h GLN 53 Ca -0.01 -0.31 -0.08 0.00 0.09 0.00 0.00 58.65 58.34 2uuz h GLN 53 Cb 1.24 0.11 -0.02 0.00 0.08 0.00 0.00 27.48 28.90 2uuz h GLN 53 CO 0.08 1.01 -0.14 0.66 0.09 0.00 0.00 178.83 180.53 2uuz h SER 54 N 0.05 0.59 0.05 0.06 4.64 -1.57 0.05 113.55 117.42 2uuz h SER 54 Ca -0.23 -0.17 -0.00 0.00 -0.47 0.00 0.00 61.79 60.92 2uuz h SER 54 Cb 1.99 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 63.92 2uuz h SER 54 CO 0.14 0.75 -0.03 -0.25 -0.87 0.00 0.00 176.83 176.58 2uuz h TRP 55 N 0.55 -0.07 -0.94 4.77 7.01 -1.51 -0.01 115.95 125.76 2uuz h TRP 55 Ca 0.09 -0.00 0.04 0.00 2.11 0.00 0.00 58.89 61.14 2uuz h TRP 55 Cb 0.56 0.02 -0.06 0.00 -2.10 0.00 0.00 29.16 27.58 2uuz h TRP 55 CO 0.02 0.17 0.60 0.00 -2.79 0.00 0.00 178.44 176.44 2uuz h ALA 56 N 0.64 1.26 -0.41 2.65 0.00 -1.15 0.12 119.26 122.37 2uuz h ALA 56 Ca -0.01 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.80 2uuz h ALA 56 Cb 0.26 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 2uuz h ALA 56 CO 0.01 0.45 -0.03 0.00 0.00 0.00 0.00 179.25 179.68 2uuz h ARG 57 N 1.15 0.67 0.14 0.00 3.08 -0.84 -1.51 114.38 117.08 2uuz h ARG 57 Ca 0.38 -0.18 -0.01 0.00 0.07 0.00 0.00 59.98 60.25 2uuz h ARG 57 Cb 0.05 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.03 2uuz h ARG 57 CO -0.14 0.71 -0.07 1.25 -1.07 0.00 0.00 179.97 180.66 2uuz h HIS 58 N 0.63 -0.18 -0.32 3.04 2.76 0.50 -1.28 115.15 120.31 2uuz h HIS 58 Ca 0.12 -0.00 0.07 0.00 -2.20 0.00 0.00 60.37 58.36 2uuz h HIS 58 Cb 0.44 0.06 -0.07 0.00 1.55 0.00 0.00 27.41 29.40 2uuz h HIS 58 CO 0.02 0.18 -0.11 -0.92 -1.30 0.00 0.00 177.93 175.79 2uuz h TYR 59 N -0.56 -0.26 -0.81 5.26 -0.00 -0.72 0.34 116.97 120.22 2uuz h TYR 59 Ca -0.02 0.03 -0.02 0.00 -0.00 0.00 0.00 58.73 58.72 2uuz h TYR 59 Cb 0.43 0.17 -0.04 0.00 -0.00 0.00 0.00 36.73 37.29 2uuz h TYR 59 CO 0.04 -0.18 0.42 0.37 -0.00 0.00 0.00 178.16 178.81 2uuz h GLN 60 N -0.05 1.14 -0.04 1.82 4.15 -1.26 -0.57 115.11 120.29 2uuz h GLN 60 Ca 0.16 -0.14 -0.00 0.00 0.77 0.00 0.00 58.65 59.44 2uuz h GLN 60 Cb 0.29 -0.22 -0.00 0.00 0.21 0.00 0.00 27.48 27.76 2uuz h GLN 60 CO -0.36 0.85 0.02 0.37 -1.93 0.00 0.00 178.83 177.79 2uuz h GLN 61 N 1.14 0.06 -0.58 1.69 4.15 -0.16 -1.93 115.11 119.47 2uuz h GLN 61 Ca 0.28 -0.01 -0.03 0.00 0.77 0.00 0.00 58.65 59.66 2uuz h GLN 61 Cb 0.06 -0.01 -0.03 0.00 0.21 0.00 0.00 27.48 27.71 2uuz h GLN 61 CO -0.04 0.09 0.22 -0.07 -1.93 0.00 0.00 178.83 177.10 2uuz h LEU 62 N 0.01 0.78 -0.85 -2.39 4.07 -0.62 -2.14 115.31 114.16 2uuz h LEU 62 Ca 0.01 -0.10 -0.11 0.00 0.08 0.00 0.00 57.88 57.76 2uuz h LEU 62 Cb 0.05 -0.20 -0.02 0.00 1.08 0.00 0.00 40.66 41.57 2uuz h LEU 62 CO -0.00 0.71 -0.51 0.00 -1.08 0.00 0.00 178.44 177.55 2uuz h ALA 63 N 1.41 1.00 -0.19 1.53 0.00 -0.97 -2.06 119.26 119.97 2uuz h ALA 63 Ca 0.20 -0.47 -0.10 0.00 0.00 0.00 0.00 54.91 54.54 2uuz h ALA 63 Cb 0.18 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 2uuz h ALA 63 CO -0.02 0.64 -0.26 -0.09 0.00 0.00 0.00 179.25 179.52 2uuz h ARG 64 N 0.00 0.51 -0.55 0.00 2.43 -0.90 -1.54 114.38 114.34 2uuz h ARG 64 Ca -0.01 -0.30 -0.07 0.00 -0.81 0.00 0.00 59.98 58.80 2uuz h ARG 64 Cb 1.00 0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.56 2uuz h ARG 64 CO 0.07 0.89 0.08 0.93 -1.51 0.00 0.00 179.97 180.43 2uuz h GLU 65 N 0.17 0.91 -0.12 0.20 5.08 -1.31 -0.08 114.58 119.45 2uuz h GLU 65 Ca 0.02 -0.25 0.00 0.00 -1.00 0.00 0.00 59.36 58.13 2uuz h GLU 65 Cb 0.83 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.97 2uuz h GLU 65 CO 0.06 0.89 0.08 1.49 -1.00 0.00 0.00 179.01 180.52 2uuz h GLU 66 N 0.80 0.15 -0.54 2.33 4.81 -1.36 0.34 114.58 121.11 2uuz h GLU 66 Ca 0.17 -0.01 0.08 0.00 -0.13 0.00 0.00 59.36 59.47 2uuz h GLU 66 Cb 0.42 -0.03 -0.07 0.00 0.63 0.00 0.00 28.75 29.70 2uuz h GLU 66 CO 0.01 0.10 0.18 -0.22 -0.73 0.00 0.00 179.01 178.35 2uuz h LYS 67 N 0.16 0.34 0.22 1.92 3.64 -0.92 -0.53 116.57 121.40 2uuz h LYS 67 Ca 0.04 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.39 2uuz h LYS 67 Cb -0.02 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 31.73 2uuz h LYS 67 CO -0.01 0.22 -0.11 0.93 -2.27 0.00 0.00 179.45 178.22 2uuz h GLU 68 N 0.35 -0.29 -0.71 1.90 5.08 -0.27 0.23 114.58 120.86 2uuz h GLU 68 Ca 0.27 0.02 0.07 0.00 -1.00 0.00 0.00 59.36 58.72 2uuz h GLU 68 Cb 0.32 0.07 -0.04 0.00 0.50 0.00 0.00 28.75 29.59 2uuz h GLU 68 CO -0.29 -0.13 0.47 0.00 -1.00 0.00 0.00 179.01 178.06 2uuz h ALA 69 N 0.38 1.75 0.00 3.43 0.00 -0.01 0.45 119.26 125.26 2uuz h ALA 69 Ca -0.03 -0.02 -0.21 0.00 0.00 0.00 0.00 54.91 54.65 2uuz h ALA 69 Cb 0.29 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 2uuz h ALA 69 CO 0.05 0.13 -0.91 0.93 0.00 0.00 0.00 179.25 179.45 2uuz h GLU 70 N 0.71 0.28 -0.40 0.00 5.08 -0.91 -2.38 114.58 116.96 2uuz h GLU 70 Ca 0.31 -0.31 -0.14 0.00 -1.00 0.00 0.00 59.36 58.23 2uuz h GLU 70 Cb 0.31 0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.64 2uuz h GLU 70 CO -0.10 1.02 -0.29 1.25 -1.00 0.00 0.00 179.01 179.89 2uuz h LEU 71 N 0.16 0.90 -1.75 1.33 5.85 0.52 -2.62 115.31 119.70 2uuz h LEU 71 Ca -0.06 -0.37 -0.03 0.00 0.84 0.00 0.00 57.88 58.27 2uuz h LEU 71 Cb 1.55 -0.25 -0.00 0.00 0.37 0.00 0.00 40.66 42.32 2uuz h LEU 71 CO 0.15 1.13 -0.12 0.00 -0.34 0.00 0.00 178.44 179.25 2uuz h ALA 72 N 0.93 1.17 0.01 1.25 0.00 -0.08 -2.37 119.26 120.16 2uuz h ALA 72 Ca 0.08 -0.11 -0.20 0.00 0.00 0.00 0.00 54.91 54.68 2uuz h ALA 72 Cb 0.85 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.59 2uuz h ALA 72 CO 0.07 0.15 -0.95 -0.44 0.00 0.00 0.00 179.25 178.09 2uuz h ASP 73 N 0.00 0.03 0.19 0.00 3.32 -1.06 -2.60 116.42 116.31 2uuz h ASP 73 Ca -0.00 -0.03 -0.01 0.00 0.02 0.00 0.00 57.03 57.01 2uuz h ASP 73 Cb 0.43 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 39.97 2uuz h ASP 73 CO 0.02 0.96 -0.09 0.44 -1.72 0.00 0.00 179.24 178.84 2uuz h ASP 74 N 0.01 -0.22 -0.55 6.45 3.45 -1.22 -3.30 116.42 121.03 2uuz h ASP 74 Ca -0.02 -0.31 0.02 0.00 0.43 0.00 0.00 57.03 57.15 2uuz h ASP 74 Cb 1.67 0.06 -0.03 0.00 -0.56 0.00 0.00 39.33 40.47 2uuz h ASP 74 CO 0.13 0.28 0.36 0.24 -1.57 0.00 0.00 179.24 178.68 2uuz h MET 75 N -0.81 0.68 -0.53 3.56 2.86 -1.54 -2.55 114.93 116.59 2uuz h MET 75 Ca -0.03 -0.04 0.08 0.00 -2.06 0.00 0.00 59.70 57.65 2uuz h MET 75 Cb 0.52 -0.15 -0.03 0.00 0.06 0.00 0.00 31.60 31.99 2uuz h MET 75 CO 0.04 0.45 0.36 1.49 1.06 0.00 0.00 176.91 180.31 2uuz h GLU 76 N 0.70 0.40 0.00 1.72 4.81 -1.54 0.27 114.58 120.94 2uuz h GLU 76 Ca 0.21 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.42 2uuz h GLU 76 Cb -0.01 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.28 2uuz h GLU 76 CO -0.05 0.26 0.00 0.87 -0.73 0.00 0.00 179.01 179.36 2uuz h LYS 77 N 0.41 0.00 0.00 1.92 1.79 -1.56 -2.79 116.57 116.34 2uuz h LYS 77 Ca 0.24 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.71 2uuz h LYS 77 Cb 0.42 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.07 2uuz h LYS 77 CO -0.06 0.00 -0.05 0.78 -1.08 0.00 0.00 179.45 179.04 2uuz h GLY 78 N 3.15 0.00 -6.67 3.86 0.00 -0.52 -3.39 103.07 99.50 2uuz h GLY 78 Ca 0.00 0.00 -0.60 0.00 0.00 0.00 0.00 47.33 46.73 2uuz h GLY 78 CO 0.00 0.00 -0.80 -0.26 0.00 0.00 0.00 176.54 175.48 2uuz s ILE 79 N -3.12 1.44 0.67 2.60 -4.36 -1.05 -5.11 121.20 112.27 2uuz s ILE 79 Ca 0.10 -3.36 -0.13 0.00 -0.26 0.00 0.00 60.65 57.01 2uuz s ILE 79 Cb 0.11 -1.96 -0.00 0.00 1.25 0.00 0.00 42.46 41.86 2uuz s ILE 79 CO 0.62 -1.14 1.07 -2.16 0.24 0.00 0.00 174.94 173.56 2uuz s PRO 80 N -0.60 2.96 0.46 0.37 0.04 -1.26 -4.95 135.00 132.02 2uuz s PRO 80 Ca 0.29 1.09 0.15 0.00 0.04 0.00 0.00 61.00 62.58 2uuz s PRO 80 Cb 0.00 -1.99 1.11 0.00 0.04 0.00 0.00 34.50 33.66 2uuz s PRO 80 CO -0.19 -1.09 2.02 1.96 0.04 0.00 0.00 177.00 179.74 2uuz h GLN 81 N -0.35 0.29 -0.06 4.56 4.20 -1.97 -2.48 115.11 119.30 2uuz h GLN 81 Ca -0.45 -0.02 0.02 0.00 0.06 0.00 0.00 58.65 58.26 2uuz h GLN 81 Cb 1.22 -0.07 -0.00 0.00 0.30 0.00 0.00 27.48 28.93 2uuz h GLN 81 CO 0.56 0.19 0.11 1.12 -0.67 0.00 0.00 178.83 180.14 2uuz h HIS 82 N 0.30 0.00 -0.17 2.96 2.07 -1.99 0.48 115.15 118.80 2uuz h HIS 82 Ca 0.22 0.00 -0.14 0.00 -2.85 0.00 0.00 60.37 57.60 2uuz h HIS 82 Cb 0.47 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.44 2uuz h HIS 82 CO -0.00 0.00 -0.49 -0.07 -3.07 0.00 0.00 177.93 174.30 2uuz h LEU 83 N 0.00 0.49 -0.39 6.12 3.38 -1.82 -0.78 115.31 122.31 2uuz h LEU 83 Ca 0.03 -0.24 -0.18 0.00 0.09 0.00 0.00 57.88 57.58 2uuz h LEU 83 Cb 0.25 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 2uuz h LEU 83 CO -0.00 0.90 -0.81 -0.26 0.09 0.00 0.00 178.44 178.36 2uuz h PHE 84 N 0.36 0.13 -0.36 1.13 0.04 -0.24 -1.15 116.94 116.85 2uuz h PHE 84 Ca 0.02 -0.07 -0.09 0.00 2.80 0.00 0.00 57.97 60.63 2uuz h PHE 84 Cb 0.99 -0.02 -0.01 0.00 2.20 0.00 0.00 35.95 39.11 2uuz h PHE 84 CO 0.03 0.86 -0.11 1.49 -0.60 0.00 0.00 178.31 179.98 2uuz h GLU 85 N 0.05 0.71 -0.73 1.51 4.81 -0.99 -1.61 114.58 118.34 2uuz h GLU 85 Ca -0.02 -0.28 -0.04 0.00 -0.13 0.00 0.00 59.36 58.89 2uuz h GLU 85 Cb 1.41 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 30.72 2uuz h GLU 85 CO 0.11 0.87 0.31 0.77 -0.73 0.00 0.00 179.01 180.35 2uuz h SER 86 N 0.50 0.98 -0.42 1.04 0.02 -1.02 0.12 113.55 114.78 2uuz h SER 86 Ca 0.09 -0.16 0.06 0.00 -0.84 0.00 0.00 61.79 60.94 2uuz h SER 86 Cb 0.62 -0.25 -0.05 0.00 0.14 0.00 0.00 62.40 62.86 2uuz h SER 86 CO 0.04 0.87 0.13 0.25 -1.14 0.00 0.00 176.83 176.98 2uuz h LEU 87 N 1.03 0.11 -0.89 5.07 5.85 -0.96 0.30 115.31 125.83 2uuz h LEU 87 Ca 0.24 0.05 -0.10 0.00 0.84 0.00 0.00 57.88 58.92 2uuz h LEU 87 Cb 0.18 0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.24 2uuz h LEU 87 CO -0.02 0.10 -0.23 0.00 -0.34 0.00 0.00 178.44 177.95 2uuz h ILE 89 N 0.50 1.12 0.00 0.00 2.04 0.28 -0.42 117.51 121.04 2uuz h ILE 89 Ca 0.07 -0.36 -0.03 0.00 1.00 0.00 0.00 64.86 65.55 2uuz h ILE 89 Cb 0.67 1.33 -0.00 0.00 -0.74 0.00 0.00 36.82 38.07 2uuz h ILE 89 CO 0.05 0.10 -0.12 0.44 0.00 0.00 0.00 178.15 178.61 2uuz h ASP 90 N -0.11 0.00 0.00 1.72 3.45 -0.23 -3.38 116.42 117.86 2uuz h ASP 90 Ca 0.01 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.47 2uuz h ASP 90 Cb 0.15 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.92 2uuz h ASP 90 CO -0.00 0.12 -0.80 1.41 -1.57 0.00 0.00 179.24 178.41 2uuz n HIS 91 N -3.49 0.00 0.10 4.55 8.25 -0.35 -4.80 115.22 119.48 2uuz n HIS 91 Ca -0.01 0.00 0.10 0.00 -0.26 0.00 0.00 57.72 57.54 2uuz n HIS 91 Cb 0.28 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.38 2uuz n HIS 91 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 2uuz h LEU 92 N 0.00 0.00 -0.64 2.41 3.38 -1.26 -3.38 115.31 115.82 2uuz h LEU 92 Ca 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 2uuz h LEU 92 Cb 0.01 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.73 2uuz h LEU 92 CO 0.00 0.10 0.38 1.56 0.09 0.00 0.00 178.44 180.57 2uuz h GLN 93 N 0.00 0.87 0.00 1.13 4.20 -1.69 -0.81 115.11 118.81 2uuz h GLN 93 Ca -0.03 -0.08 0.00 0.00 0.06 0.00 0.00 58.65 58.60 2uuz h GLN 93 Cb 1.10 -0.18 0.00 0.00 0.30 0.00 0.00 27.48 28.69 2uuz h GLN 93 CO 0.01 0.63 0.00 2.89 -0.67 0.00 0.00 178.83 181.69 2uuz n ARG 94 N -4.58 0.24 -0.08 1.46 1.85 -1.26 -1.36 116.66 112.93 2uuz n ARG 94 Ca 0.05 0.10 0.04 0.00 -1.00 0.00 0.00 57.85 57.04 2uuz n ARG 94 Cb 0.06 -1.50 0.08 0.00 -1.05 0.00 0.00 32.46 30.05 2uuz n ARG 94 CO 0.00 0.00 0.00 0.72 -0.01 0.00 0.00 177.63 178.34 2uuz n HIS 95 N -1.15 0.21 0.00 2.89 8.25 -0.35 -4.98 115.22 120.08 2uuz n HIS 95 Ca 0.06 -0.28 0.00 0.00 -0.26 0.00 0.00 57.72 57.24 2uuz n HIS 95 Cb 0.06 -0.02 0.00 0.00 1.12 0.00 0.00 29.99 31.15 2uuz n HIS 95 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2uuz n GLY 96 N 0.38 0.92 3.58 -1.41 0.00 -0.46 -5.09 105.19 103.11 2uuz n GLY 96 Ca 0.07 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.70 2uuz n GLY 96 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2uuz s ALA 97 N -2.00 3.53 0.78 4.61 0.00 -0.94 -5.00 121.76 122.73 2uuz s ALA 97 Ca 0.00 -1.02 -0.11 0.00 0.00 0.00 0.00 51.96 50.84 2uuz s ALA 97 Cb 0.00 -2.74 0.06 0.00 0.00 0.00 0.00 23.12 20.44 2uuz s ALA 97 CO 0.00 -0.84 1.09 -1.54 0.00 0.00 0.00 175.76 174.47 2uuz s SER 98 N 1.70 4.50 0.29 0.00 1.04 -1.26 -3.56 113.70 116.40 2uuz s SER 98 Ca 0.13 1.68 -0.03 0.00 0.48 0.00 0.00 55.95 58.21 2uuz s SER 98 Cb -0.16 -2.41 0.40 0.00 0.10 0.00 0.00 66.02 63.94 2uuz s SER 98 CO 0.11 -2.02 1.96 0.50 0.98 0.00 0.00 173.24 174.77 2uuz h LYS 99 N -1.12 1.15 -0.95 4.02 3.64 -1.97 -2.14 116.57 119.20 2uuz h LYS 99 Ca -0.45 -0.07 0.02 0.00 -1.27 0.00 0.00 60.65 58.88 2uuz h LYS 99 Cb 1.24 -0.26 -0.05 0.00 -0.41 0.00 0.00 32.23 32.75 2uuz h LYS 99 CO 0.54 0.76 0.63 0.87 -2.27 0.00 0.00 179.45 179.97 2uuz h LYS 100 N 1.18 1.22 -0.56 1.90 1.57 -1.98 0.18 116.57 120.08 2uuz h LYS 100 Ca 0.32 -0.07 -0.05 0.00 -1.87 0.00 0.00 60.65 58.98 2uuz h LYS 100 Cb -0.13 -0.28 -0.02 0.00 0.08 0.00 0.00 32.23 31.88 2uuz h LYS 100 CO -0.07 0.81 0.17 0.66 -0.57 0.00 0.00 179.45 180.45 2uuz h SER 101 N 1.26 0.82 -0.53 0.86 4.64 -1.75 0.27 113.55 119.12 2uuz h SER 101 Ca 0.36 -0.21 -0.08 0.00 -0.47 0.00 0.00 61.79 61.39 2uuz h SER 101 Cb -0.10 -0.21 -0.02 0.00 -0.31 0.00 0.00 62.40 61.75 2uuz h SER 101 CO -0.09 0.81 0.04 0.40 -0.87 0.00 0.00 176.83 177.12 2uuz h ILE 102 N 0.79 1.26 -0.38 0.95 2.04 -1.19 -1.91 117.51 119.07 2uuz h ILE 102 Ca 0.18 -1.04 -0.07 0.00 1.00 0.00 0.00 64.86 64.93 2uuz h ILE 102 Cb 0.28 0.89 -0.02 0.00 -0.74 0.00 0.00 36.82 37.23 2uuz h ILE 102 CO -0.01 0.37 -0.07 0.74 0.00 0.00 0.00 178.15 179.19 2uuz h THR 103 N 0.79 1.24 -0.33 -0.27 2.02 -0.34 -0.28 112.91 115.75 2uuz h THR 103 Ca 0.16 -1.01 -0.05 0.00 0.77 0.00 0.00 66.41 66.27 2uuz h THR 103 Cb 0.48 1.02 -0.01 0.00 -1.74 0.00 0.00 68.15 67.90 2uuz h THR 103 CO 0.02 0.34 0.02 -0.09 0.37 0.00 0.00 175.52 176.18 2uuz h ARG 104 N 0.59 0.57 0.05 6.66 2.43 -0.13 -0.22 114.38 124.32 2uuz h ARG 104 Ca 0.11 -0.17 -0.00 0.00 -0.81 0.00 0.00 59.98 59.11 2uuz h ARG 104 Cb 0.48 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 29.97 2uuz h ARG 104 CO 0.03 0.68 -0.02 0.00 -1.51 0.00 0.00 179.97 179.15 2uuz h ALA 105 N 0.86 -0.06 0.03 2.80 0.00 -1.05 0.57 119.26 122.41 2uuz h ALA 105 Ca 0.09 -0.17 -0.26 0.00 0.00 0.00 0.00 54.91 54.58 2uuz h ALA 105 Cb 0.42 0.02 0.02 0.00 0.00 0.00 0.00 17.79 18.25 2uuz h ALA 105 CO 0.01 -0.37 -1.06 0.74 0.00 0.00 0.00 179.25 178.58 2uuz h PHE 106 N -0.39 0.87 0.00 0.00 -1.00 -1.08 -3.06 116.94 112.28 2uuz h PHE 106 Ca -0.01 -0.49 -0.29 0.00 2.81 0.00 0.00 57.97 59.99 2uuz h PHE 106 Cb 0.35 -0.09 -0.05 0.00 3.61 0.00 0.00 35.95 39.77 2uuz h PHE 106 CO 0.04 1.33 -2.01 -0.25 -1.61 0.00 0.00 178.31 175.80 2uuz n ASP 107 N -3.79 0.39 -0.07 2.17 8.00 -0.10 -4.78 116.55 118.36 2uuz n ASP 107 Ca -0.10 0.18 -0.11 0.00 0.71 0.00 0.00 54.79 55.47 2uuz n ASP 107 Cb 0.89 0.64 -0.06 0.00 -0.02 0.00 0.00 41.12 42.57 2uuz n ASP 107 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 2uuz n ASP 108 N -2.82 2.51 -4.63 -2.24 10.43 -0.81 -4.96 116.55 114.02 2uuz n ASP 108 Ca -0.23 -0.02 -0.43 0.00 2.57 0.00 0.00 54.79 56.69 2uuz n ASP 108 Cb 1.04 -0.27 -0.02 0.00 1.84 0.00 0.00 41.12 43.70 2uuz n ASP 108 CO 0.00 0.00 0.00 -0.62 -1.07 0.00 0.00 177.20 175.51 2uuz s ASP 109 N -5.58 6.44 0.06 -2.24 3.68 0.19 -4.92 116.67 114.30 2uuz s ASP 109 Ca -0.19 1.54 -0.21 0.00 2.13 0.00 0.00 52.55 55.82 2uuz s ASP 109 Cb 0.06 -2.53 -0.12 0.00 -1.45 0.00 0.00 42.92 38.87 2uuz s ASP 109 CO 0.31 -1.22 1.49 0.58 0.13 0.00 0.00 175.17 176.46 2uuz h VAL 110 N 6.10 1.25 0.04 1.11 2.07 -1.90 -2.84 116.25 122.09 2uuz h VAL 110 Ca -0.32 -0.84 -0.00 0.00 0.82 0.00 0.00 66.70 66.36 2uuz h VAL 110 Cb 1.14 1.50 0.00 0.00 -1.52 0.00 0.00 31.29 32.42 2uuz h VAL 110 CO 1.01 0.25 -0.02 -0.08 0.02 0.00 0.00 177.57 178.75 2uuz h GLU 111 N 0.01 -0.05 -0.84 1.57 4.81 -1.94 -2.44 114.58 115.70 2uuz h GLU 111 Ca 0.04 0.00 0.21 0.00 -0.13 0.00 0.00 59.36 59.48 2uuz h GLU 111 Cb 0.37 0.01 -0.13 0.00 0.63 0.00 0.00 28.75 29.64 2uuz h GLU 111 CO 0.01 0.23 0.24 0.35 -0.73 0.00 0.00 179.01 179.10 2uuz h PHE 112 N -0.33 0.36 -0.01 0.92 3.57 -1.87 0.74 116.94 120.33 2uuz h PHE 112 Ca -0.01 0.05 -0.06 0.00 3.53 0.00 0.00 57.97 61.48 2uuz h PHE 112 Cb 0.30 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 39.01 2uuz h PHE 112 CO 0.02 -0.15 -0.28 1.96 -2.23 0.00 0.00 178.31 177.63 2uuz h GLN 113 N 0.26 0.02 0.19 1.11 4.20 -1.32 0.15 115.11 119.71 2uuz h GLN 113 Ca 0.51 -0.01 -0.25 0.00 0.06 0.00 0.00 58.65 58.96 2uuz h GLN 113 Cb 0.96 -0.00 0.03 0.00 0.30 0.00 0.00 27.48 28.77 2uuz h GLN 113 CO -0.59 0.30 -1.10 0.93 -0.67 0.00 0.00 178.83 177.70 2uuz h GLU 114 N 0.02 0.40 0.00 1.46 5.08 0.66 -1.46 114.58 120.74 2uuz h GLU 114 Ca 0.00 -0.68 0.00 0.00 -1.00 0.00 0.00 59.36 57.68 2uuz h GLU 114 Cb 0.51 0.25 0.00 0.00 0.50 0.00 0.00 28.75 30.01 2uuz h GLU 114 CO 0.04 1.33 0.00 0.00 -1.00 0.00 0.00 179.01 179.37 2uuz h ARG 115 N -0.16 0.00 0.08 2.33 3.08 0.27 0.05 114.38 120.03 2uuz h ARG 115 Ca -0.19 0.00 -0.11 0.00 0.07 0.00 0.00 59.98 59.75 2uuz h ARG 115 Cb 1.86 0.00 0.01 0.00 0.08 0.00 0.00 29.97 31.92 2uuz h ARG 115 CO 0.20 0.00 -0.47 1.98 -1.07 0.00 0.00 179.97 180.61 2uuz h MET 116 N 0.00 0.18 -0.40 0.04 4.05 -0.95 -2.57 114.93 115.27 2uuz h MET 116 Ca 0.00 -0.30 -0.05 0.00 -0.28 0.00 0.00 59.70 59.07 2uuz h MET 116 Cb 0.44 0.11 -0.02 0.00 -0.80 0.00 0.00 31.60 31.33 2uuz h MET 116 CO 0.00 1.14 0.04 0.00 0.23 0.00 0.00 176.91 178.32 2uuz h ALA 117 N 0.06 1.32 -0.52 0.39 0.00 -0.94 -1.98 119.26 117.59 2uuz h ALA 117 Ca -0.08 -0.20 -0.12 0.00 0.00 0.00 0.00 54.91 54.51 2uuz h ALA 117 Cb 1.37 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.97 2uuz h ALA 117 CO 0.09 0.47 -0.14 0.93 0.00 0.00 0.00 179.25 180.60 2uuz h GLU 118 N 0.60 1.00 -0.21 0.00 5.08 -1.05 -2.57 114.58 117.43 2uuz h GLU 118 Ca 0.13 -0.38 -0.15 0.00 -1.00 0.00 0.00 59.36 57.96 2uuz h GLU 118 Cb 0.32 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.50 2uuz h GLU 118 CO 0.01 1.06 -0.49 1.25 -1.00 0.00 0.00 179.01 179.84 2uuz h HIS 119 N 0.88 0.68 -0.58 4.33 2.76 -1.10 -2.18 115.15 119.95 2uuz h HIS 119 Ca 0.13 -0.22 0.04 0.00 -2.20 0.00 0.00 60.37 58.12 2uuz h HIS 119 Cb 0.70 -0.14 -0.04 0.00 1.55 0.00 0.00 27.41 29.48 2uuz h HIS 119 CO 0.05 0.93 0.33 0.82 -1.30 0.00 0.00 177.93 178.76 2uuz h ILE 120 N 0.44 1.02 -0.19 6.26 2.04 -1.27 0.30 117.51 126.10 2uuz h ILE 120 Ca 0.02 -0.22 -0.00 0.00 1.00 0.00 0.00 64.86 65.66 2uuz h ILE 120 Cb 1.02 0.32 -0.01 0.00 -0.74 0.00 0.00 36.82 37.41 2uuz h ILE 120 CO 0.09 0.12 0.11 -0.09 0.00 0.00 0.00 178.15 178.38 2uuz h ARG 121 N 0.64 0.27 -0.74 2.37 9.65 -1.31 -1.31 114.38 123.95 2uuz h ARG 121 Ca 0.24 -0.03 0.05 0.00 -1.10 0.00 0.00 59.98 59.15 2uuz h ARG 121 Cb 0.08 -0.05 -0.05 0.00 -1.39 0.00 0.00 29.97 28.56 2uuz h ARG 121 CO -0.13 0.23 0.44 -0.92 2.80 0.00 0.00 179.97 182.40 2uuz h TYR 122 N 0.22 0.82 -0.43 2.20 3.20 -0.75 0.58 116.97 122.81 2uuz h TYR 122 Ca 0.07 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 61.96 2uuz h TYR 122 Cb 0.04 -0.26 -0.02 0.00 1.54 0.00 0.00 36.73 38.03 2uuz h TYR 122 CO -0.05 0.43 0.26 0.52 -1.64 0.00 0.00 178.16 177.69 2uuz h MET 123 N 0.83 0.59 -0.11 1.82 2.86 -0.59 -1.42 114.93 118.91 2uuz h MET 123 Ca 0.32 -0.05 -0.18 0.00 -2.06 0.00 0.00 59.70 57.72 2uuz h MET 123 Cb 0.12 -0.12 -0.00 0.00 0.06 0.00 0.00 31.60 31.65 2uuz h MET 123 CO -0.15 0.43 -0.69 0.28 1.06 0.00 0.00 176.91 177.84 2uuz h VAL 124 N 0.57 1.36 -0.52 -2.22 2.07 -0.90 -0.82 116.25 115.80 2uuz h VAL 124 Ca 0.16 -2.04 -0.07 0.00 0.82 0.00 0.00 66.70 65.57 2uuz h VAL 124 Cb -0.01 2.02 -0.02 0.00 -1.52 0.00 0.00 31.29 31.76 2uuz h VAL 124 CO -0.03 0.62 0.06 -0.33 0.02 0.00 0.00 177.57 177.91 2uuz h GLU 125 N 0.33 0.88 -0.26 1.57 5.08 -0.78 0.23 114.58 121.63 2uuz h GLU 125 Ca -0.02 -0.25 -0.02 0.00 -1.00 0.00 0.00 59.36 58.06 2uuz h GLU 125 Cb 1.26 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 30.40 2uuz h GLU 125 CO 0.12 0.87 0.07 1.15 -1.00 0.00 0.00 179.01 180.22 2uuz h THR 126 N 0.76 1.21 0.00 1.13 2.02 -1.18 -0.31 112.91 116.54 2uuz h THR 126 Ca 0.16 -0.68 -0.06 0.00 0.77 0.00 0.00 66.41 66.59 2uuz h THR 126 Cb 0.44 1.17 -0.01 0.00 -1.74 0.00 0.00 68.15 68.01 2uuz h THR 126 CO 0.01 0.22 -0.28 0.40 0.37 0.00 0.00 175.52 176.24 2uuz h ILE 127 N 0.24 0.85 -0.35 3.11 2.04 -1.06 -2.29 117.51 120.05 2uuz h ILE 127 Ca 0.08 -1.13 -0.08 0.00 1.00 0.00 0.00 64.86 64.73 2uuz h ILE 127 Cb 0.27 1.68 -0.01 0.00 -0.74 0.00 0.00 36.82 38.03 2uuz h ILE 127 CO 0.00 0.28 -0.08 0.00 0.00 0.00 0.00 178.15 178.35 2uuz h ALA 128 N 1.72 0.49 -0.09 1.87 0.00 -0.41 -1.29 119.26 121.54 2uuz h ALA 128 Ca -0.00 -0.30 0.04 0.00 0.00 0.00 0.00 54.91 54.65 2uuz h ALA 128 Cb 0.66 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 18.28 2uuz h ALA 128 CO 0.04 0.33 -0.22 1.25 0.00 0.00 0.00 179.25 180.65 2uuz h HIS 129 N 0.47 -0.58 0.00 0.00 -0.00 -0.52 -0.92 115.15 113.60 2uuz h HIS 129 Ca 0.09 0.03 -0.06 0.00 -0.00 0.00 0.00 60.37 60.42 2uuz h HIS 129 Cb 0.59 0.27 -0.01 0.00 -0.00 0.00 0.00 27.41 28.26 2uuz h HIS 129 CO 0.05 -0.30 -0.29 0.45 -0.00 0.00 0.00 177.93 177.84 2uuz h HIS 130 N -0.30 0.00 -0.43 5.26 -0.00 -1.37 -1.66 115.15 116.65 2uuz h HIS 130 Ca 0.09 0.00 -0.11 0.00 -0.00 0.00 0.00 60.37 60.35 2uuz h HIS 130 Cb 0.43 0.00 -0.02 0.00 -0.00 0.00 0.00 27.41 27.82 2uuz h HIS 130 CO -0.30 0.29 -0.16 0.37 -0.00 0.00 0.00 177.93 178.13 2uuz h GLN 131 N 0.00 0.82 0.09 2.45 5.75 -0.33 -1.65 115.11 122.24 2uuz h GLN 131 Ca -0.00 -0.30 -0.00 0.00 -0.15 0.00 0.00 58.65 58.19 2uuz h GLN 131 Cb 0.55 -0.05 0.00 0.00 1.07 0.00 0.00 27.48 29.05 2uuz h GLN 131 CO 0.04 0.92 -0.05 0.28 -2.65 0.00 0.00 178.83 177.38 2uuz h VAL 132 N 0.73 1.10 -0.67 2.39 2.07 -0.62 -1.77 116.25 119.49 2uuz h VAL 132 Ca 0.11 -0.78 0.13 0.00 0.82 0.00 0.00 66.70 66.98 2uuz h VAL 132 Cb 0.66 1.60 -0.13 0.00 -1.52 0.00 0.00 31.29 31.91 2uuz h VAL 132 CO 0.05 0.19 -0.18 0.44 0.02 0.00 0.00 177.57 178.09 2uuz h ASP 133 N -0.49 -0.65 -0.75 0.57 3.45 -1.24 0.22 116.42 117.53 2uuz h ASP 133 Ca -0.01 0.20 0.08 0.00 0.43 0.00 0.00 57.03 57.73 2uuz h ASP 133 Cb 0.41 0.43 -0.06 0.00 -0.56 0.00 0.00 39.33 39.54 2uuz h ASP 133 CO 0.02 -0.23 0.42 0.40 -1.57 0.00 0.00 179.24 178.28 2uuz h ILE 134 N -0.01 0.94 -0.69 0.35 2.04 -1.14 -0.62 117.51 118.38 2uuz h ILE 134 Ca 0.32 -0.25 -0.03 0.00 1.00 0.00 0.00 64.86 65.89 2uuz h ILE 134 Cb 0.50 0.13 -0.03 0.00 -0.74 0.00 0.00 36.82 36.68 2uuz h ILE 134 CO -0.69 0.14 0.32 0.44 0.00 0.00 0.00 178.15 178.35 2uuz h ASP 135 N 0.74 0.92 0.00 1.72 3.32 0.23 -1.98 116.42 121.38 2uuz h ASP 135 Ca 0.35 -0.14 0.00 0.00 0.02 0.00 0.00 57.03 57.25 2uuz h ASP 135 Cb 0.27 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 39.58 2uuz h ASP 135 CO -0.21 0.81 0.00 -1.20 -1.72 0.00 0.00 179.24 176.92 2uuz n SER 136 N -4.42 0.00 -4.14 6.45 7.64 0.09 -4.76 113.62 114.48 2uuz n SER 136 Ca 0.05 -0.73 -0.22 0.00 1.01 0.00 0.00 58.87 58.99 2uuz n SER 136 Cb 0.14 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.32 2uuz n SER 136 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2uuz n GLU 137 N -0.88 0.93 0.00 1.43 1.02 -0.74 -5.05 120.64 117.35 2uuz n GLU 137 Ca 0.11 -2.73 0.00 0.00 -0.02 0.00 0.00 57.16 54.52 2uuz n GLU 137 Cb 0.05 0.46 0.00 0.00 -0.02 0.00 0.00 31.44 31.93 2uuz n GLU 137 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59