#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dls s SER 2 N 0.00 5.70 -0.20 1.61 0.01 -1.26 -5.12 113.70 114.44 2dls s SER 2 Ca 0.00 -0.16 -0.07 0.00 1.31 0.00 0.00 55.95 57.03 2dls s SER 2 Cb 0.00 -1.01 0.09 0.00 0.21 0.00 0.00 66.02 65.31 2dls s SER 2 CO 0.00 -0.73 0.43 -0.44 0.41 0.00 0.00 173.24 172.91 2dls s SER 3 N -4.29 -0.29 -0.19 2.44 0.01 -1.26 -5.04 113.70 105.07 2dls s SER 3 Ca 0.51 1.02 -0.06 0.00 1.31 0.00 0.00 55.95 58.73 2dls s SER 3 Cb -0.10 1.38 -0.22 0.00 0.21 0.00 0.00 66.02 67.29 2dls s SER 3 CO 0.34 -0.23 3.48 0.61 0.41 0.00 0.00 173.24 177.86 2dls n GLY 4 N 5.38 3.25 0.35 3.44 0.00 -1.26 -4.61 105.19 111.74 2dls n GLY 4 Ca -0.09 -1.30 -0.14 0.00 0.00 0.00 0.00 46.02 44.49 2dls n GLY 4 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2dls h SER 5 N 3.18 -0.90 -3.52 1.61 0.87 -2.05 -3.38 113.55 109.35 2dls h SER 5 Ca 0.27 0.09 -0.61 0.00 -1.23 0.00 0.00 61.79 60.31 2dls h SER 5 Cb 1.33 0.33 -0.11 0.00 -0.44 0.00 0.00 62.40 63.50 2dls h SER 5 CO 0.43 -0.43 0.35 -0.44 -0.53 0.00 0.00 176.83 176.21 2dls s SER 6 N -4.71 6.55 0.00 6.23 0.01 -1.26 -4.96 113.70 115.57 2dls s SER 6 Ca -0.16 0.38 0.00 0.00 1.31 0.00 0.00 55.95 57.48 2dls s SER 6 Cb 0.07 -2.39 0.00 0.00 0.21 0.00 0.00 66.02 63.91 2dls s SER 6 CO 0.64 -0.70 0.00 0.61 0.41 0.00 0.00 173.24 174.20 2dls n GLY 7 N 4.49 -1.63 3.17 3.44 0.00 -1.26 -5.04 105.19 108.36 2dls n GLY 7 Ca 0.03 -1.08 -0.32 0.00 0.00 0.00 0.00 46.02 44.65 2dls n GLY 7 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2dls s VAL 8 N -2.41 2.00 0.27 1.61 1.01 -1.26 -5.06 120.40 116.57 2dls s VAL 8 Ca 0.00 -0.95 0.03 0.00 0.00 0.00 0.00 61.98 61.06 2dls s VAL 8 Cb 0.00 -1.77 -0.03 0.00 0.00 0.00 0.00 36.38 34.58 2dls s VAL 8 CO 0.00 0.54 0.42 0.00 0.00 0.00 0.00 175.10 176.06 2dls s GLN 9 N 0.76 3.46 0.01 2.72 -2.07 -1.26 -2.37 119.66 120.91 2dls s GLN 9 Ca -0.09 -0.60 0.02 0.00 -1.82 0.00 0.00 55.36 52.87 2dls s GLN 9 Cb -0.16 -2.82 -0.01 0.00 -1.09 0.00 0.00 33.01 28.93 2dls s GLN 9 CO -0.00 0.34 -0.07 0.50 -1.32 0.00 0.00 175.29 174.74 2dls s ARG 10 N -4.03 0.56 -0.15 9.60 3.52 -0.11 -4.97 118.95 123.37 2dls s ARG 10 Ca 0.36 -0.40 -0.15 0.00 -0.13 0.00 0.00 55.73 55.41 2dls s ARG 10 Cb -0.09 -0.50 -0.04 0.00 -1.56 0.00 0.00 34.95 32.75 2dls s ARG 10 CO 0.31 0.13 0.35 0.00 -0.81 0.00 0.00 175.30 175.28 2dls s VAL 12 N 0.55 0.03 -0.05 0.00 0.11 -0.72 -5.02 120.40 115.29 2dls s VAL 12 Ca 0.19 -0.26 0.06 0.00 -2.93 0.00 0.00 61.98 59.04 2dls s VAL 12 Cb -0.14 -0.16 -0.01 0.00 -1.53 0.00 0.00 36.38 34.55 2dls s VAL 12 CO 0.06 -0.14 -0.22 -0.63 -3.33 0.00 0.00 175.10 170.83 2dls s ILE 13 N -0.42 1.85 -0.23 7.04 1.01 -1.26 -0.71 121.20 128.47 2dls s ILE 13 Ca -0.05 -0.95 -0.06 0.00 0.00 0.00 0.00 60.65 59.59 2dls s ILE 13 Cb -0.03 -1.57 -0.02 0.00 0.01 0.00 0.00 42.46 40.85 2dls s ILE 13 CO 0.00 0.52 0.02 -0.63 0.00 0.00 0.00 174.94 174.85 2dls s ILE 14 N -0.10 3.96 -0.16 2.92 1.01 -1.18 -4.88 121.20 122.77 2dls s ILE 14 Ca -0.03 -0.30 -0.06 0.00 0.00 0.00 0.00 60.65 60.26 2dls s ILE 14 Cb -0.13 -2.82 -0.04 0.00 0.01 0.00 0.00 42.46 39.48 2dls s ILE 14 CO 0.03 0.39 0.04 0.00 0.00 0.00 0.00 174.94 175.39 2dls s GLN 15 N 1.42 3.77 -0.33 2.79 -2.07 -1.26 -3.44 119.66 120.54 2dls s GLN 15 Ca 0.05 -0.37 -0.42 0.00 -1.82 0.00 0.00 55.36 52.80 2dls s GLN 15 Cb -0.15 -3.10 -0.16 0.00 -1.09 0.00 0.00 33.01 28.51 2dls s GLN 15 CO 0.01 0.35 1.73 1.63 -1.32 0.00 0.00 175.29 177.69 2dls n LYS 16 N 3.27 0.91 0.00 9.60 5.02 -1.26 -4.81 118.16 130.89 2dls n LYS 16 Ca -0.17 0.33 0.00 0.00 -2.02 0.00 0.00 58.31 56.45 2dls n LYS 16 Cb 0.53 -1.98 0.00 0.00 -0.02 0.00 0.00 35.03 33.55 2dls n LYS 16 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2dls n ASP 17 N 5.20 1.25 -2.72 4.39 8.00 -1.26 -4.79 116.55 126.62 2dls n ASP 17 Ca 0.28 0.00 -0.37 0.00 0.71 0.00 0.00 54.79 55.41 2dls n ASP 17 Cb 0.09 0.00 0.04 0.00 -0.02 0.00 0.00 41.12 41.23 2dls n ASP 17 CO 0.00 0.00 0.00 1.67 -0.39 0.00 0.00 177.20 178.48 2dls n GLN 18 N -2.75 2.67 -3.54 -1.24 7.27 -1.26 -4.81 117.38 113.71 2dls n GLN 18 Ca 0.00 -3.29 -0.20 0.00 0.07 0.00 0.00 57.00 53.58 2dls n GLN 18 Cb 0.45 -2.24 0.07 0.00 2.41 0.00 0.00 30.24 30.93 2dls n GLN 18 CO 0.00 0.00 0.00 0.72 0.07 0.00 0.00 177.06 177.85 2dls n HIS 19 N -0.46 -2.25 0.00 3.69 8.25 -1.26 -4.86 115.22 118.34 2dls n HIS 19 Ca 0.55 0.93 0.00 0.00 -0.26 0.00 0.00 57.72 58.94 2dls n HIS 19 Cb 0.37 -4.87 0.00 0.00 1.12 0.00 0.00 29.99 26.61 2dls n HIS 19 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2dls n GLY 20 N -1.40 3.64 3.61 -1.41 0.00 -1.26 -5.08 105.19 103.29 2dls n GLY 20 Ca -0.23 -1.71 -0.39 0.00 0.00 0.00 0.00 46.02 43.69 2dls n GLY 20 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2dls n PHE 21 N -1.24 0.91 -1.88 1.61 3.72 -1.26 -4.51 117.46 114.81 2dls n PHE 21 Ca 0.00 0.46 -0.10 0.00 -0.05 0.00 0.00 57.45 57.76 2dls n PHE 21 Cb 0.00 -2.16 0.10 0.00 -0.94 0.00 0.00 39.48 36.48 2dls n PHE 21 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2dls n GLY 22 N 1.26 5.59 3.07 1.37 0.00 -1.26 -5.02 105.19 110.19 2dls n GLY 22 Ca 0.12 -2.00 -0.18 0.00 0.00 0.00 0.00 46.02 43.96 2dls n GLY 22 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2dls s PHE 23 N -3.36 0.95 0.31 1.61 -0.71 -1.26 -1.26 117.98 114.26 2dls s PHE 23 Ca 0.44 -0.28 0.10 0.00 -1.04 0.00 0.00 56.93 56.16 2dls s PHE 23 Cb 0.39 -0.58 -0.06 0.00 -1.21 0.00 0.00 43.02 41.56 2dls s PHE 23 CO -0.01 -0.00 -0.10 0.95 -1.34 0.00 0.00 175.22 174.71 2dls s THR 24 N -0.62 2.53 0.03 -4.49 -4.23 -1.16 -5.02 115.64 102.67 2dls s THR 24 Ca 0.01 -2.19 -0.04 0.00 -1.18 0.00 0.00 61.69 58.28 2dls s THR 24 Cb -0.06 -2.58 -0.01 0.00 1.34 0.00 0.00 72.50 71.18 2dls s THR 24 CO 0.00 -0.28 0.06 0.68 -0.54 0.00 0.00 174.62 174.54 2dls s VAL 25 N -2.53 0.13 -0.04 2.29 -7.23 -1.26 -0.90 120.40 110.86 2dls s VAL 25 Ca 0.32 -1.03 -0.09 0.00 -1.81 0.00 0.00 61.98 59.36 2dls s VAL 25 Cb -0.01 -0.71 0.02 0.00 0.56 0.00 0.00 36.38 36.23 2dls s VAL 25 CO 0.17 -0.57 0.22 -0.55 -0.31 0.00 0.00 175.10 174.06 2dls s SER 26 N -1.89 -0.14 0.00 4.85 0.15 -0.68 -4.77 113.70 111.21 2dls s SER 26 Ca -0.08 0.15 0.00 0.00 0.70 0.00 0.00 55.95 56.72 2dls s SER 26 Cb -0.04 0.35 0.00 0.00 -1.71 0.00 0.00 66.02 64.62 2dls s SER 26 CO -0.03 -0.26 0.00 0.61 1.20 0.00 0.00 173.24 174.76 2dls n GLY 27 N 2.06 3.70 0.14 9.45 0.00 -1.26 -2.43 105.19 116.85 2dls n GLY 27 Ca -0.18 -0.82 -0.18 0.00 0.00 0.00 0.00 46.02 44.84 2dls n GLY 27 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 2dls h ASP 28 N 0.00 0.52 0.00 1.61 2.03 -1.97 -3.35 116.42 115.27 2dls h ASP 28 Ca 0.00 -0.80 -0.15 0.00 -0.73 0.00 0.00 57.03 55.35 2dls h ASP 28 Cb 0.00 -0.16 -0.02 0.00 -0.83 0.00 0.00 39.33 38.32 2dls h ASP 28 CO 0.00 1.26 -1.26 -1.14 -1.03 0.00 0.00 179.24 177.07 2dls n ARG 29 N -4.19 0.53 -3.60 4.15 0.63 -1.26 -3.57 116.66 109.35 2dls n ARG 29 Ca -0.11 0.38 -0.40 0.00 -0.92 0.00 0.00 57.85 56.79 2dls n ARG 29 Cb 0.71 -1.57 -0.10 0.00 0.45 0.00 0.00 32.46 31.94 2dls n ARG 29 CO 0.00 0.00 0.00 0.42 -2.51 0.00 0.00 177.63 175.54 2dls s ILE 30 N -2.54 4.40 0.05 5.15 -1.09 -1.26 -3.61 121.20 122.31 2dls s ILE 30 Ca -0.27 -1.15 -0.30 0.00 -2.23 0.00 0.00 60.65 56.70 2dls s ILE 30 Cb 0.06 -3.58 -0.05 0.00 -1.58 0.00 0.00 42.46 37.31 2dls s ILE 30 CO 0.41 -0.38 1.08 -0.69 -1.23 0.00 0.00 174.94 174.13 2dls s VAL 31 N 1.49 4.39 0.00 2.92 1.01 -1.26 -4.34 120.40 124.61 2dls s VAL 31 Ca 0.02 1.77 -0.03 0.00 0.00 0.00 0.00 61.98 63.74 2dls s VAL 31 Cb -0.21 -4.14 -0.01 0.00 0.00 0.00 0.00 36.38 32.02 2dls s VAL 31 CO 0.04 0.17 0.05 -0.76 0.00 0.00 0.00 175.10 174.61 2dls s LEU 32 N 0.77 1.88 -0.35 3.92 1.43 -1.02 -3.70 118.68 121.61 2dls s LEU 32 Ca 0.54 -0.25 -0.28 0.00 -1.03 0.00 0.00 54.13 53.11 2dls s LEU 32 Cb -0.25 0.34 -0.03 0.00 0.03 0.00 0.00 46.19 46.27 2dls s LEU 32 CO 0.29 -0.26 2.00 -0.69 0.23 0.00 0.00 176.35 177.92 2dls s VAL 33 N -1.09 3.28 0.09 -1.59 1.01 -1.14 -1.69 120.40 119.26 2dls s VAL 33 Ca -0.12 0.26 -0.21 0.00 0.00 0.00 0.00 61.98 61.91 2dls s VAL 33 Cb -0.07 -3.43 -0.10 0.00 0.00 0.00 0.00 36.38 32.78 2dls s VAL 33 CO 0.00 -0.31 1.66 -0.61 0.00 0.00 0.00 175.10 175.84 2dls h GLN 34 N 14.53 0.23 -3.32 2.72 4.15 -1.32 -3.24 115.11 128.87 2dls h GLN 34 Ca -0.34 -0.03 -0.01 0.00 0.77 0.00 0.00 58.65 59.04 2dls h GLN 34 Cb 1.20 -0.04 -0.06 0.00 0.21 0.00 0.00 27.48 28.78 2dls h GLN 34 CO 1.05 0.28 0.07 0.45 -1.93 0.00 0.00 178.83 178.75 2dls s SER 35 N -5.50 -0.11 -0.03 -0.69 0.15 -1.24 -4.93 113.70 101.35 2dls s SER 35 Ca -0.13 -0.83 -0.01 0.00 0.70 0.00 0.00 55.95 55.67 2dls s SER 35 Cb 0.07 0.68 0.03 0.00 -1.71 0.00 0.00 66.02 65.09 2dls s SER 35 CO 0.70 -1.29 0.05 -0.69 1.20 0.00 0.00 173.24 173.20 2dls s VAL 36 N -3.77 -0.08 0.25 4.45 1.01 -1.26 -2.98 120.40 118.02 2dls s VAL 36 Ca 0.17 0.35 -0.30 0.00 0.00 0.00 0.00 61.98 62.20 2dls s VAL 36 Cb -0.03 -0.14 -0.14 0.00 0.00 0.00 0.00 36.38 36.07 2dls s VAL 36 CO 0.09 0.15 1.24 -1.14 0.00 0.00 0.00 175.10 175.45 2dls n ARG 37 N 4.93 1.70 -2.05 2.72 3.00 -0.39 -4.83 116.66 121.75 2dls n ARG 37 Ca -0.11 0.60 -0.32 0.00 -0.00 0.00 0.00 57.85 58.02 2dls n ARG 37 Cb 0.50 -2.14 -0.04 0.00 0.00 0.00 0.00 32.46 30.77 2dls n ARG 37 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.63 176.38 2dls s PRO 38 N -0.89 2.59 0.00 -0.14 0.04 -1.26 -2.92 135.00 132.41 2dls s PRO 38 Ca 0.65 0.10 0.00 0.00 0.04 0.00 0.00 61.00 61.79 2dls s PRO 38 Cb -0.69 -4.77 0.00 0.00 0.04 0.00 0.00 34.50 29.08 2dls s PRO 38 CO 0.55 -3.09 0.00 0.41 0.04 0.00 0.00 177.00 174.90 2dls n GLY 39 N 6.35 0.86 0.00 0.56 0.00 -1.26 -5.07 105.19 106.63 2dls n GLY 39 Ca 0.31 -0.69 0.00 0.00 0.00 0.00 0.00 46.02 45.65 2dls n GLY 39 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dls n GLY 40 N -0.58 1.98 0.11 -0.02 0.00 -1.15 -4.90 105.19 100.64 2dls n GLY 40 Ca 0.00 -1.91 -0.17 0.00 0.00 0.00 0.00 46.02 43.94 2dls n GLY 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dls h ALA 41 N -0.96 0.02 0.69 4.61 0.00 -1.89 -3.04 119.26 118.69 2dls h ALA 41 Ca 0.00 -0.56 -0.03 0.00 0.00 0.00 0.00 54.91 54.32 2dls h ALA 41 Cb 0.00 0.04 0.01 0.00 0.00 0.00 0.00 17.79 17.84 2dls h ALA 41 CO 0.00 0.25 -0.33 0.00 0.00 0.00 0.00 179.25 179.17 2dls h ALA 42 N 0.22 -0.92 -0.60 0.00 0.00 -1.91 -2.33 119.26 113.73 2dls h ALA 42 Ca -0.07 -0.22 0.12 0.00 0.00 0.00 0.00 54.91 54.74 2dls h ALA 42 Cb 1.27 0.36 -0.12 0.00 0.00 0.00 0.00 17.79 19.30 2dls h ALA 42 CO 0.10 -0.92 -0.25 1.98 0.00 0.00 0.00 179.25 180.15 2dls h MET 43 N -1.12 -0.09 -0.63 0.00 -1.53 -1.73 0.80 114.93 110.63 2dls h MET 43 Ca -0.09 0.01 0.10 0.00 -3.44 0.00 0.00 59.70 56.27 2dls h MET 43 Cb 0.74 0.02 -0.07 0.00 -0.55 0.00 0.00 31.60 31.74 2dls h MET 43 CO 0.15 -0.06 0.25 0.87 0.14 0.00 0.00 176.91 178.26 2dls h LYS 44 N -0.10 0.42 -0.01 0.39 1.57 -1.53 0.74 116.57 118.05 2dls h LYS 44 Ca 0.27 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 59.02 2dls h LYS 44 Cb 0.52 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.73 2dls h LYS 44 CO -0.66 0.28 0.01 0.00 -0.57 0.00 0.00 179.45 178.50 2dls h ALA 45 N 1.43 1.94 0.00 3.86 0.00 -0.30 -3.46 119.26 122.74 2dls h ALA 45 Ca 0.32 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.23 2dls h ALA 45 Cb 0.40 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.19 2dls h ALA 45 CO -0.31 -0.01 0.00 0.41 0.00 0.00 0.00 179.25 179.33 2dls n GLY 46 N -1.51 1.12 3.41 0.00 0.00 0.25 -4.93 105.19 103.53 2dls n GLY 46 Ca -0.03 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.64 2dls n GLY 46 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2dls s VAL 47 N -2.00 3.81 0.50 1.61 1.01 -1.04 -5.01 120.40 119.27 2dls s VAL 47 Ca 0.00 -0.35 0.03 0.00 0.00 0.00 0.00 61.98 61.65 2dls s VAL 47 Cb 0.00 -2.73 -0.02 0.00 0.00 0.00 0.00 36.38 33.63 2dls s VAL 47 CO 0.00 0.42 0.07 -0.54 0.00 0.00 0.00 175.10 175.05 2dls s LYS 48 N 1.19 2.17 0.41 2.72 -0.14 -1.26 -4.22 119.74 120.61 2dls s LYS 48 Ca 0.03 -2.28 -0.23 0.00 -1.36 0.00 0.00 55.97 52.12 2dls s LYS 48 Cb -0.15 -1.65 -0.09 0.00 -1.68 0.00 0.00 37.83 34.27 2dls s LYS 48 CO 0.01 -0.34 1.03 -1.21 -0.76 0.00 0.00 175.35 174.08 2dls s GLU 49 N -3.91 4.15 0.00 1.68 2.02 -1.26 -3.44 118.70 117.94 2dls s GLU 49 Ca 0.15 1.45 0.00 0.00 0.02 0.00 0.00 54.97 56.59 2dls s GLU 49 Cb 0.02 -2.47 0.00 0.00 0.10 0.00 0.00 34.13 31.78 2dls s GLU 49 CO 0.08 -0.14 0.00 0.41 0.02 0.00 0.00 175.26 175.63 2dls n GLY 50 N 0.20 1.04 3.67 -1.39 0.00 -1.22 -5.00 105.19 102.49 2dls n GLY 50 Ca 0.05 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.65 2dls n GLY 50 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2dls s ASP 51 N -2.96 6.97 -0.13 1.61 1.11 -1.22 -4.85 116.67 117.18 2dls s ASP 51 Ca 0.00 1.72 -0.17 0.00 0.18 0.00 0.00 52.55 54.28 2dls s ASP 51 Cb 0.00 -2.54 -0.04 0.00 1.07 0.00 0.00 42.92 41.40 2dls s ASP 51 CO 0.00 -0.73 0.41 -0.60 1.18 0.00 0.00 175.17 175.43 2dls s ARG 52 N 3.23 4.31 -0.03 8.23 3.52 -1.26 -2.89 118.95 134.05 2dls s ARG 52 Ca 0.55 0.32 -0.21 0.00 -0.13 0.00 0.00 55.73 56.26 2dls s ARG 52 Cb -0.22 -3.43 -0.05 0.00 -1.56 0.00 0.00 34.95 29.69 2dls s ARG 52 CO 0.16 0.19 0.59 0.42 -0.81 0.00 0.00 175.30 175.86 2dls s ILE 53 N 0.55 4.97 -0.16 4.11 1.01 -1.24 -3.48 121.20 126.95 2dls s ILE 53 Ca 0.22 1.23 -0.12 0.00 0.00 0.00 0.00 60.65 61.99 2dls s ILE 53 Cb -0.14 -3.93 -0.07 0.00 0.01 0.00 0.00 42.46 38.33 2dls s ILE 53 CO 0.08 0.38 -0.26 -0.38 0.00 0.00 0.00 174.94 174.76 2dls n ILE 54 N 3.01 1.25 -4.71 2.92 5.41 -0.98 -4.83 119.36 121.44 2dls n ILE 54 Ca -0.06 -0.07 -0.27 0.00 1.00 0.00 0.00 62.75 63.35 2dls n ILE 54 Cb 0.51 -1.94 -0.14 0.00 -0.71 0.00 0.00 39.64 37.36 2dls n ILE 54 CO 0.00 0.00 0.00 -0.75 0.00 0.00 0.00 176.55 175.80 2dls s LYS 55 N -2.50 1.51 -0.07 0.38 2.20 -1.26 -2.76 119.74 117.23 2dls s LYS 55 Ca -0.25 -1.01 -0.01 0.00 -0.36 0.00 0.00 55.97 54.34 2dls s LYS 55 Cb 0.07 -1.66 0.03 0.00 -1.51 0.00 0.00 37.83 34.76 2dls s LYS 55 CO 0.34 0.42 -0.02 0.08 -0.36 0.00 0.00 175.35 175.82 2dls s VAL 56 N -0.82 0.50 -1.49 4.02 1.01 0.66 -2.20 120.40 122.08 2dls s VAL 56 Ca 0.09 0.02 -0.01 0.00 0.00 0.00 0.00 61.98 62.09 2dls s VAL 56 Cb -0.09 -0.62 0.00 0.00 0.00 0.00 0.00 36.38 35.68 2dls s VAL 56 CO 0.02 0.27 0.20 -3.20 0.00 0.00 0.00 175.10 172.39 2dls n ASN 57 N 4.94 0.33 -1.62 3.32 2.85 -0.84 0.66 115.26 124.91 2dls n ASN 57 Ca -0.11 -1.16 -0.14 0.00 -0.11 0.00 0.00 54.58 53.07 2dls n ASN 57 Cb 0.50 -2.24 -0.00 0.00 1.24 0.00 0.00 39.78 39.28 2dls n ASN 57 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2dls n GLY 58 N -2.29 -0.17 2.97 8.20 0.00 -1.26 -5.01 105.19 107.62 2dls n GLY 58 Ca -0.31 -0.30 -0.28 0.00 0.00 0.00 0.00 46.02 45.13 2dls n GLY 58 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2dls s THR 59 N -2.72 1.24 -1.07 2.61 2.01 0.21 -5.07 115.64 112.86 2dls s THR 59 Ca 0.03 -0.44 -0.22 0.00 0.31 0.00 0.00 61.69 61.37 2dls s THR 59 Cb -0.01 -1.20 0.04 0.00 0.01 0.00 0.00 72.50 71.34 2dls s THR 59 CO 0.04 0.40 1.56 -0.32 -0.69 0.00 0.00 174.62 175.61 2dls s MET 60 N 1.47 3.55 -0.41 4.92 1.75 -1.26 -0.25 119.30 129.07 2dls s MET 60 Ca 0.02 -1.22 -0.01 0.00 -1.25 0.00 0.00 55.69 53.23 2dls s MET 60 Cb -0.13 -5.37 0.29 0.00 2.84 0.00 0.00 34.83 32.46 2dls s MET 60 CO -0.07 -2.36 1.99 1.33 -0.65 0.00 0.00 175.02 175.26 2dls n VAL 61 N 6.90 2.98 -2.59 10.11 0.24 -1.11 -4.93 118.33 129.92 2dls n VAL 61 Ca 0.37 -1.96 -0.43 0.00 -2.04 0.00 0.00 64.34 60.28 2dls n VAL 61 Cb 0.50 -1.24 -0.02 0.00 -1.47 0.00 0.00 33.84 31.61 2dls n VAL 61 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 2dls s THR 62 N -2.95 4.39 -0.73 3.34 -4.23 -1.24 -3.59 115.64 110.63 2dls s THR 62 Ca 0.40 1.57 -0.02 0.00 -1.18 0.00 0.00 61.69 62.46 2dls s THR 62 Cb 0.32 -4.41 0.00 0.00 1.34 0.00 0.00 72.50 69.75 2dls s THR 62 CO -0.00 -0.58 0.62 -3.20 -0.54 0.00 0.00 174.62 170.92 2dls n ASN 63 N 7.18 -2.91 -3.86 3.99 5.15 -1.26 -5.05 115.26 118.51 2dls n ASN 63 Ca 0.12 -0.34 -0.21 0.00 -0.60 0.00 0.00 54.58 53.55 2dls n ASN 63 Cb 0.47 -3.16 -0.04 0.00 -0.53 0.00 0.00 39.78 36.53 2dls n ASN 63 CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 2dls n SER 64 N -1.84 2.79 -4.86 1.20 7.64 -1.24 -5.00 113.62 112.31 2dls n SER 64 Ca -0.11 -2.47 -0.32 0.00 1.01 0.00 0.00 58.87 56.98 2dls n SER 64 Cb 0.58 0.18 -0.06 0.00 -1.01 0.00 0.00 64.21 63.90 2dls n SER 64 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2dls s SER 65 N -2.98 6.70 0.07 6.43 1.04 -1.23 -4.03 113.70 119.70 2dls s SER 65 Ca 0.05 1.11 -0.35 0.00 0.48 0.00 0.00 55.95 57.24 2dls s SER 65 Cb -0.00 -2.30 -0.18 0.00 0.10 0.00 0.00 66.02 63.63 2dls s SER 65 CO 0.03 -0.14 1.59 -0.74 0.98 0.00 0.00 173.24 174.96 2dls h HIS 66 N 2.41 -1.14 -0.89 5.02 2.76 -1.69 -2.71 115.15 118.91 2dls h HIS 66 Ca -0.47 -0.01 0.16 0.00 -2.20 0.00 0.00 60.37 57.84 2dls h HIS 66 Cb 1.17 0.40 -0.16 0.00 1.55 0.00 0.00 27.41 30.38 2dls h HIS 66 CO 0.62 -0.65 -0.28 -0.11 -1.30 0.00 0.00 177.93 176.21 2dls n LEU 67 N -5.57 -0.44 -0.24 0.26 7.94 -1.26 0.14 117.00 117.83 2dls n LEU 67 Ca -0.14 1.54 -0.01 0.00 -1.11 0.00 0.00 56.01 56.29 2dls n LEU 67 Cb 0.45 -0.41 0.11 0.00 0.53 0.00 0.00 43.42 44.10 2dls n LEU 67 CO 0.35 -1.43 1.08 -0.33 -1.11 0.00 0.00 177.39 175.96 2dls h GLU 68 N 0.00 0.65 0.20 1.96 4.39 -1.93 -2.66 114.58 117.19 2dls h GLU 68 Ca 0.37 -0.04 0.01 0.00 0.34 0.00 0.00 59.36 60.04 2dls h GLU 68 Cb 0.59 -0.15 -0.03 0.00 -0.10 0.00 0.00 28.75 29.07 2dls h GLU 68 CO -0.90 0.43 -0.27 0.28 -1.16 0.00 0.00 179.01 177.39 2dls h VAL 69 N 0.67 0.42 -0.38 3.13 2.07 0.15 -3.05 116.25 119.27 2dls h VAL 69 Ca 0.31 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.88 2dls h VAL 69 Cb 0.23 0.42 -0.07 0.00 -1.52 0.00 0.00 31.29 30.35 2dls h VAL 69 CO -0.21 0.00 -0.51 0.58 0.02 0.00 0.00 177.57 177.45 2dls h VAL 70 N -0.53 0.00 -0.74 2.57 2.07 -0.95 0.94 116.25 119.62 2dls h VAL 70 Ca 0.01 0.00 0.31 0.00 0.82 0.00 0.00 66.70 67.84 2dls h VAL 70 Cb 0.51 0.00 -0.13 0.00 -1.52 0.00 0.00 31.29 30.15 2dls h VAL 70 CO -0.10 0.00 0.40 1.17 0.02 0.00 0.00 177.57 179.06 2dls n LYS 71 N -5.13 -0.04 -0.04 1.57 4.81 -1.07 0.21 118.16 118.45 2dls n LYS 71 Ca -0.03 1.02 -0.13 0.00 -0.87 0.00 0.00 58.31 58.29 2dls n LYS 71 Cb 0.31 -1.83 -0.08 0.00 0.02 0.00 0.00 35.03 33.45 2dls n LYS 71 CO 0.00 0.00 0.00 -0.07 1.17 0.00 0.00 177.40 178.50 2dls h LEU 72 N 0.00 0.25 -0.61 3.14 3.38 -0.82 -3.17 115.31 117.48 2dls h LEU 72 Ca 0.63 -0.50 -0.01 0.00 0.09 0.00 0.00 57.88 58.09 2dls h LEU 72 Cb 1.66 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 42.31 2dls h LEU 72 CO -0.57 0.70 0.34 0.40 0.09 0.00 0.00 178.44 179.40 2dls h ILE 73 N -0.19 1.19 -0.88 1.22 2.04 0.28 -2.79 117.51 118.39 2dls h ILE 73 Ca 0.01 -0.48 -0.45 0.00 1.00 0.00 0.00 64.86 64.94 2dls h ILE 73 Cb 0.63 0.40 -0.17 0.00 -0.74 0.00 0.00 36.82 36.95 2dls h ILE 73 CO 0.03 0.21 0.40 2.29 0.00 0.00 0.00 178.15 181.08 2dls n LYS 74 N -4.57 2.23 -0.08 2.37 2.85 0.51 -4.29 118.16 117.18 2dls n LYS 74 Ca 0.04 -2.13 -0.15 0.00 -1.05 0.00 0.00 58.31 55.03 2dls n LYS 74 Cb 0.08 -1.99 -0.05 0.00 -0.65 0.00 0.00 35.03 32.42 2dls n LYS 74 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 2dls n SER 75 N 0.69 1.52 -3.10 -5.58 2.88 -1.05 -4.90 113.62 104.07 2dls n SER 75 Ca 0.44 0.25 -0.16 0.00 -1.33 0.00 0.00 58.87 58.07 2dls n SER 75 Cb 0.57 -0.60 -0.04 0.00 -0.75 0.00 0.00 64.21 63.39 2dls n SER 75 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dls n GLY 76 N 1.90 3.71 0.37 0.46 0.00 -1.26 -5.05 105.19 105.32 2dls n GLY 76 Ca -0.26 -2.14 -0.07 0.00 0.00 0.00 0.00 46.02 43.55 2dls n GLY 76 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dls h ALA 77 N 1.28 -0.20 -4.93 4.61 0.00 -1.98 -3.43 119.26 114.61 2dls h ALA 77 Ca -0.20 0.13 -0.58 0.00 0.00 0.00 0.00 54.91 54.26 2dls h ALA 77 Cb 0.70 0.88 -0.11 0.00 0.00 0.00 0.00 17.79 19.25 2dls h ALA 77 CO 0.33 -0.76 -0.43 2.48 0.00 0.00 0.00 179.25 180.87 2dls n TYR 78 N -5.42 0.91 -3.74 0.00 0.18 -1.26 -4.40 117.16 103.43 2dls n TYR 78 Ca 0.03 -2.27 -0.12 0.00 1.88 0.00 0.00 57.90 57.42 2dls n TYR 78 Cb 0.35 -0.25 -0.12 0.00 -0.38 0.00 0.00 39.34 38.94 2dls n TYR 78 CO 0.00 0.00 0.00 0.54 -2.08 0.00 0.00 176.86 175.32 2dls s VAL 79 N -2.69 -0.02 -0.10 -3.48 0.11 -1.22 -4.87 120.40 108.12 2dls s VAL 79 Ca 0.03 0.09 -0.22 0.00 -2.93 0.00 0.00 61.98 58.95 2dls s VAL 79 Cb 0.00 -0.43 -0.04 0.00 -1.53 0.00 0.00 36.38 34.39 2dls s VAL 79 CO 0.02 0.04 0.64 0.00 -3.33 0.00 0.00 175.10 172.46 2dls s ALA 80 N 0.93 3.40 -0.03 1.54 0.00 -1.26 -3.07 121.76 123.27 2dls s ALA 80 Ca -0.06 -0.00 0.05 0.00 0.00 0.00 0.00 51.96 51.94 2dls s ALA 80 Cb -0.07 -2.88 -0.01 0.00 0.00 0.00 0.00 23.12 20.16 2dls s ALA 80 CO -0.06 -0.14 -0.17 -0.51 0.00 0.00 0.00 175.76 174.87 2dls s LEU 81 N 0.92 1.95 -0.63 0.00 1.43 0.11 -1.99 118.68 120.47 2dls s LEU 81 Ca 0.33 -0.34 -0.12 0.00 -1.03 0.00 0.00 54.13 52.97 2dls s LEU 81 Cb -0.17 -0.96 0.16 0.00 0.03 0.00 0.00 46.19 45.26 2dls s LEU 81 CO 0.15 0.17 0.54 -0.89 0.23 0.00 0.00 176.35 176.56 2dls s THR 82 N -0.10 4.87 0.05 5.49 2.01 -0.93 -1.76 115.64 125.26 2dls s THR 82 Ca -0.00 -2.12 -0.19 0.00 0.31 0.00 0.00 61.69 59.68 2dls s THR 82 Cb -0.10 -4.10 -0.06 0.00 0.01 0.00 0.00 72.50 68.24 2dls s THR 82 CO 0.01 -0.90 0.55 -0.76 -0.69 0.00 0.00 174.62 172.83 2dls s LEU 83 N 0.80 4.50 -0.01 4.42 1.43 -0.82 -2.32 118.68 126.69 2dls s LEU 83 Ca 0.11 1.20 -0.03 0.00 -1.03 0.00 0.00 54.13 54.38 2dls s LEU 83 Cb -0.21 -2.85 -0.04 0.00 0.03 0.00 0.00 46.19 43.12 2dls s LEU 83 CO -0.03 0.26 0.18 -0.22 0.23 0.00 0.00 176.35 176.77 2dls s LEU 84 N -0.96 4.36 -0.37 1.79 2.96 -1.23 -0.93 118.68 124.31 2dls s LEU 84 Ca 0.28 0.34 -0.01 0.00 -0.22 0.00 0.00 54.13 54.53 2dls s LEU 84 Cb -0.19 -2.61 0.10 0.00 0.50 0.00 0.00 46.19 43.99 2dls s LEU 84 CO 0.18 0.26 0.12 -0.83 -1.32 0.00 0.00 176.35 174.76 2dls s GLY 85 N -1.94 1.93 -0.77 7.98 0.00 -1.00 -4.67 107.32 108.85 2dls s GLY 85 Ca 0.27 -2.38 -0.08 0.00 0.00 0.00 0.00 44.72 42.53 2dls s GLY 85 CO 0.19 0.93 0.65 -0.56 0.00 0.00 0.00 173.10 174.31 2dls s SER 86 N 1.46 6.09 -1.22 1.64 0.01 -1.26 -4.40 113.70 116.02 2dls s SER 86 Ca 0.06 -2.91 -0.05 0.00 1.31 0.00 0.00 55.95 54.36 2dls s SER 86 Cb -0.21 -2.04 0.01 0.00 0.21 0.00 0.00 66.02 63.99 2dls s SER 86 CO -0.05 -0.44 1.05 -0.24 0.41 0.00 0.00 173.24 173.98 2dls n SER 87 N 3.54 -4.45 -4.26 2.44 2.88 -1.26 -5.00 113.62 107.51 2dls n SER 87 Ca 0.13 -0.54 -0.33 0.00 -1.33 0.00 0.00 58.87 56.79 2dls n SER 87 Cb 0.42 -4.82 -0.15 0.00 -0.75 0.00 0.00 64.21 58.90 2dls n SER 87 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2dls s SER 88 N -3.71 3.70 0.00 -3.46 0.01 -1.26 -4.73 113.70 104.24 2dls s SER 88 Ca 0.33 -0.47 0.00 0.00 1.31 0.00 0.00 55.95 57.12 2dls s SER 88 Cb -0.14 -1.58 0.00 0.00 0.21 0.00 0.00 66.02 64.51 2dls s SER 88 CO 0.69 0.07 0.00 0.61 0.41 0.00 0.00 173.24 175.02 2dls n GLY 89 N 4.16 0.50 3.56 3.44 0.00 -1.26 -4.72 105.19 110.88 2dls n GLY 89 Ca -0.19 -2.18 -0.27 0.00 0.00 0.00 0.00 46.02 43.38 2dls n GLY 89 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dls s PRO 90 N -0.69 2.55 -1.58 1.61 0.04 -1.26 -3.87 135.00 131.80 2dls s PRO 90 Ca 0.00 -0.38 -0.11 0.00 0.04 0.00 0.00 61.00 60.55 2dls s PRO 90 Cb 0.00 -5.08 0.09 0.00 0.04 0.00 0.00 34.50 29.55 2dls s PRO 90 CO 0.00 -3.43 0.62 0.45 0.04 0.00 0.00 177.00 174.67 2dls n SER 91 N 13.99 -2.03 -2.32 6.66 2.88 -1.26 -4.85 113.62 126.69 2dls n SER 91 Ca 0.41 -1.02 -0.31 0.00 -1.33 0.00 0.00 58.87 56.62 2dls n SER 91 Cb 0.47 -2.83 0.04 0.00 -0.75 0.00 0.00 64.21 61.14 2dls n SER 91 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2dls n SER 92 N -2.79 6.30 0.00 -3.46 7.64 -1.25 -5.13 113.62 114.92 2dls n SER 92 Ca -0.09 -3.77 0.00 0.00 1.01 0.00 0.00 58.87 56.02 2dls n SER 92 Cb 0.57 -0.69 0.00 0.00 -1.01 0.00 0.00 64.21 63.08 2dls n SER 92 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64