#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2sob n THR 2 N 0.00 0.65 -1.45 0.00 5.66 -1.26 -4.94 114.28 112.94 2sob n THR 2 Ca 0.00 -2.10 -0.35 0.00 -3.05 0.00 0.00 64.05 58.55 2sob n THR 2 Cb 0.00 1.09 0.07 0.00 -1.55 0.00 0.00 70.33 69.94 2sob n THR 2 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 175.07 170.82 2sob n SER 3 N -0.88 7.60 0.00 1.09 7.64 -1.26 -4.37 113.62 123.44 2sob n SER 3 Ca -0.03 -3.76 0.00 0.00 1.01 0.00 0.00 58.87 56.09 2sob n SER 3 Cb 0.84 -1.01 0.00 0.00 -1.01 0.00 0.00 64.21 63.03 2sob n SER 3 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 2sob n THR 4 N -0.74 0.00 -3.49 0.44 -2.24 -1.26 -5.05 114.28 101.93 2sob n THR 4 Ca 0.59 0.00 -0.40 0.00 -2.27 0.00 0.00 64.05 61.97 2sob n THR 4 Cb 0.56 -0.40 -0.10 0.00 -2.10 0.00 0.00 70.33 68.28 2sob n THR 4 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2sob s LYS 5 N -1.84 3.62 0.18 -0.78 -0.14 -1.26 -4.64 119.74 114.88 2sob s LYS 5 Ca 0.00 -0.48 0.00 0.00 -1.36 0.00 0.00 55.97 54.13 2sob s LYS 5 Cb 0.00 -3.77 0.00 0.00 -1.68 0.00 0.00 37.83 32.38 2sob s LYS 5 CO 0.00 -0.42 0.00 0.36 -0.76 0.00 0.00 175.35 174.53 2sob n LYS 6 N 5.20 0.00 0.00 1.68 0.00 -1.26 -5.03 118.16 118.75 2sob n LYS 6 Ca -0.11 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.20 2sob n LYS 6 Cb 0.50 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.53 2sob n LYS 6 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.40 177.29 2sob n LEU 7 N -3.02 0.00 -4.80 -5.58 7.94 -1.26 -4.79 117.00 105.48 2sob n LEU 7 Ca 0.00 0.00 -0.38 0.00 -1.11 0.00 0.00 56.01 54.52 2sob n LEU 7 Cb 0.00 0.00 -0.06 0.00 0.53 0.00 0.00 43.42 43.89 2sob n LEU 7 CO 0.00 0.00 0.40 -1.00 -1.11 0.00 0.00 177.39 175.68 2sob s HIS 8 N 0.00 3.76 0.22 1.96 3.76 -1.26 -4.66 115.29 119.07 2sob s HIS 8 Ca 0.00 1.42 -0.06 0.00 -0.15 0.00 0.00 55.06 56.27 2sob s HIS 8 Cb 0.00 -2.63 -0.06 0.00 1.11 0.00 0.00 32.58 31.01 2sob s HIS 8 CO 0.00 0.45 0.49 -1.59 -0.85 0.00 0.00 174.74 173.24 2sob s LYS 9 N -1.56 3.68 -0.30 1.40 -2.85 -1.26 -2.27 119.74 116.59 2sob s LYS 9 Ca 0.38 0.04 -0.12 0.00 -1.00 0.00 0.00 55.97 55.27 2sob s LYS 9 Cb -0.19 -2.72 0.14 0.00 -2.06 0.00 0.00 37.83 33.00 2sob s LYS 9 CO 0.22 0.33 0.77 -2.00 0.10 0.00 0.00 175.35 174.77 2sob s GLU 10 N -3.04 0.48 0.22 1.78 -6.30 -1.18 -4.81 118.70 105.85 2sob s GLU 10 Ca 0.44 1.21 -0.30 0.00 -2.50 0.00 0.00 54.97 53.82 2sob s GLU 10 Cb -0.11 0.72 -0.16 0.00 0.00 0.00 0.00 34.13 34.58 2sob s GLU 10 CO 0.25 -0.17 0.88 -2.30 0.02 0.00 0.00 175.26 173.95 2sob n PRO 11 N 5.26 0.80 0.00 4.30 -0.02 -1.04 -1.57 135.00 142.74 2sob n PRO 11 Ca -0.11 0.28 0.00 0.00 -2.02 0.00 0.00 63.50 61.65 2sob n PRO 11 Cb 0.50 -1.57 0.00 0.00 -0.02 0.00 0.00 33.50 32.42 2sob n PRO 11 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2sob n ALA 12 N 0.48 0.00 -3.61 3.55 0.00 0.97 -4.52 120.51 117.38 2sob n ALA 12 Ca 0.14 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.37 2sob n ALA 12 Cb 0.27 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.56 2sob n ALA 12 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 2sob s THR 13 N 0.93 -0.19 -0.06 0.00 -1.32 -1.14 -4.33 115.64 109.52 2sob s THR 13 Ca 0.00 0.11 -0.31 0.00 -1.21 0.00 0.00 61.69 60.28 2sob s THR 13 Cb 0.00 -0.44 -0.09 0.00 -1.51 0.00 0.00 72.50 70.46 2sob s THR 13 CO 0.00 -0.05 2.01 0.00 -2.21 0.00 0.00 174.62 174.37 2sob n LEU 14 N 5.31 3.71 -1.76 9.08 -0.00 -1.26 -3.40 117.00 128.68 2sob n LEU 14 Ca -0.05 0.76 -0.19 0.00 -0.00 0.00 0.00 56.01 56.54 2sob n LEU 14 Cb 0.50 -1.48 0.12 0.00 -0.00 0.00 0.00 43.42 42.56 2sob n LEU 14 CO 0.07 -0.08 0.76 -0.38 -0.00 0.00 0.00 177.39 177.77 2sob n ILE 15 N 5.95 2.85 -0.24 1.47 5.41 0.12 -5.01 119.36 129.91 2sob n ILE 15 Ca 0.24 -3.17 0.00 0.00 1.00 0.00 0.00 62.75 60.82 2sob n ILE 15 Cb 0.38 -0.76 0.00 0.00 -0.71 0.00 0.00 39.64 38.55 2sob n ILE 15 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 176.55 177.72 2sob n LYS 16 N -0.96 -0.67 -3.31 0.38 0.00 -1.25 -4.54 118.16 107.80 2sob n LYS 16 Ca 0.45 0.49 -0.39 0.00 0.00 0.00 0.00 58.31 58.87 2sob n LYS 16 Cb 0.98 -0.54 -0.07 0.00 0.00 0.00 0.00 35.03 35.39 2sob n LYS 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2sob s ALA 17 N -1.45 3.55 -0.01 3.14 0.00 -1.26 -2.10 121.76 123.63 2sob s ALA 17 Ca 0.00 -0.46 -0.22 0.00 0.00 0.00 0.00 51.96 51.29 2sob s ALA 17 Cb 0.00 -2.73 -0.12 0.00 0.00 0.00 0.00 23.12 20.26 2sob s ALA 17 CO 0.00 -0.38 0.92 0.82 0.00 0.00 0.00 175.76 177.11 2sob h ILE 18 N 5.08 0.08 -1.31 0.00 5.03 -1.62 -3.48 117.51 121.29 2sob h ILE 18 Ca -0.35 -0.47 0.00 0.00 -0.12 0.00 0.00 64.86 63.93 2sob h ILE 18 Cb 1.16 0.12 0.00 0.00 -3.03 0.00 0.00 36.82 35.06 2sob h ILE 18 CO 0.73 0.01 0.00 0.47 -0.68 0.00 0.00 178.15 178.68 2sob n ASP 19 N -5.27 0.54 0.00 1.72 8.00 -0.55 -5.01 116.55 115.98 2sob n ASP 19 Ca -0.10 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.40 2sob n ASP 19 Cb 0.30 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.40 2sob n ASP 19 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2sob n GLY 20 N 2.65 -2.80 0.21 0.44 0.00 -1.26 -3.90 105.19 100.52 2sob n GLY 20 Ca 0.00 0.02 0.13 0.00 0.00 0.00 0.00 46.02 46.18 2sob n GLY 20 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2sob h ASP 21 N 0.00 0.00 -3.23 1.61 5.19 -1.91 -3.43 116.42 114.64 2sob h ASP 21 Ca 0.00 0.00 -0.56 0.00 -0.62 0.00 0.00 57.03 55.85 2sob h ASP 21 Cb 0.00 0.00 -0.06 0.00 0.18 0.00 0.00 39.33 39.45 2sob h ASP 21 CO 0.00 0.00 1.07 -0.89 -3.12 0.00 0.00 179.24 176.30 2sob s THR 22 N -3.30 3.90 -0.01 0.35 2.01 -1.25 -3.63 115.64 113.71 2sob s THR 22 Ca 0.06 0.90 0.01 0.00 0.31 0.00 0.00 61.69 62.96 2sob s THR 22 Cb 0.07 -4.28 0.01 0.00 0.01 0.00 0.00 72.50 68.30 2sob s THR 22 CO 0.62 -0.86 -0.02 0.68 -0.69 0.00 0.00 174.62 174.35 2sob s VAL 23 N 5.50 0.21 -0.23 3.82 -7.23 0.14 -1.48 120.40 121.12 2sob s VAL 23 Ca 0.59 -0.07 -0.23 0.00 -1.81 0.00 0.00 61.98 60.46 2sob s VAL 23 Cb -0.12 -0.22 -0.01 0.00 0.56 0.00 0.00 36.38 36.59 2sob s VAL 23 CO 0.31 0.09 0.76 -0.75 -0.31 0.00 0.00 175.10 175.20 2sob s LYS 24 N 0.22 4.18 -0.02 4.82 2.20 -0.89 -0.39 119.74 129.86 2sob s LYS 24 Ca -0.02 0.83 -0.17 0.00 -0.36 0.00 0.00 55.97 56.25 2sob s LYS 24 Cb -0.04 -3.63 0.03 0.00 -1.51 0.00 0.00 37.83 32.67 2sob s LYS 24 CO -0.01 -0.44 0.36 -0.51 -0.36 0.00 0.00 175.35 174.39 2sob s LEU 25 N 2.58 0.66 -0.26 5.43 1.43 0.17 -0.71 118.68 127.98 2sob s LEU 25 Ca 0.33 0.17 -0.04 0.00 -1.03 0.00 0.00 54.13 53.56 2sob s LEU 25 Cb -0.16 1.43 0.02 0.00 0.03 0.00 0.00 46.19 47.51 2sob s LEU 25 CO 0.09 -0.47 -0.01 -0.04 0.23 0.00 0.00 176.35 176.15 2sob s MET 26 N -1.31 2.99 -0.25 1.70 -1.94 -1.22 -1.79 119.30 117.48 2sob s MET 26 Ca -0.13 -0.90 -0.00 0.00 -1.71 0.00 0.00 55.69 52.95 2sob s MET 26 Cb -0.05 -3.14 0.19 0.00 2.01 0.00 0.00 34.83 33.85 2sob s MET 26 CO 0.05 -0.40 1.90 2.48 -0.01 0.00 0.00 175.02 179.04 2sob n TYR 27 N 4.76 1.28 -3.44 -0.03 0.18 -1.26 -2.88 117.16 115.77 2sob n TYR 27 Ca -0.16 -1.67 -0.21 0.00 1.88 0.00 0.00 57.90 57.74 2sob n TYR 27 Cb 0.48 -0.82 0.06 0.00 -0.38 0.00 0.00 39.34 38.68 2sob n TYR 27 CO 0.00 0.00 0.00 1.63 -2.08 0.00 0.00 176.86 176.41 2sob n LYS 28 N 0.41 -2.43 0.00 -3.48 4.01 -1.26 -4.66 118.16 110.75 2sob n LYS 28 Ca 0.25 0.71 0.00 0.00 -0.51 0.00 0.00 58.31 58.76 2sob n LYS 28 Cb 0.64 -5.23 0.00 0.00 -0.51 0.00 0.00 35.03 29.92 2sob n LYS 28 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2sob n GLY 29 N -1.40 0.22 3.17 0.72 0.00 -1.26 -5.09 105.19 101.55 2sob n GLY 29 Ca -0.11 0.00 0.03 0.00 0.00 0.00 0.00 46.02 45.93 2sob n GLY 29 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2sob s GLN 30 N 0.00 0.66 -0.62 1.61 0.74 -1.26 -5.10 119.66 115.70 2sob s GLN 30 Ca 0.00 0.15 -0.26 0.00 0.05 0.00 0.00 55.36 55.30 2sob s GLN 30 Cb 0.00 0.17 -0.05 0.00 1.10 0.00 0.00 33.01 34.23 2sob s GLN 30 CO 0.00 -1.08 2.11 -1.25 -0.55 0.00 0.00 175.29 174.52 2sob s PRO 31 N 2.36 2.34 0.35 1.67 0.04 -1.26 -4.07 135.00 136.43 2sob s PRO 31 Ca 0.13 0.77 0.03 0.00 0.04 0.00 0.00 61.00 61.98 2sob s PRO 31 Cb -0.07 -4.57 -0.01 0.00 0.04 0.00 0.00 34.50 29.89 2sob s PRO 31 CO -0.17 -3.15 0.39 -1.33 0.04 0.00 0.00 177.00 172.78 2sob n MET 32 N 9.06 0.56 -4.62 4.56 2.81 -0.74 -4.93 117.12 123.82 2sob n MET 32 Ca 0.31 -3.12 -0.34 0.00 -1.81 0.00 0.00 57.70 52.74 2sob n MET 32 Cb 0.52 2.75 -0.11 0.00 -0.71 0.00 0.00 33.22 35.67 2sob n MET 32 CO 0.00 0.00 0.00 -0.08 1.51 0.00 0.00 175.97 177.40 2sob s THR 33 N -3.11 3.69 0.34 2.03 -1.32 -1.26 0.45 115.64 116.46 2sob s THR 33 Ca 0.35 -0.48 0.01 0.00 -1.21 0.00 0.00 61.69 60.36 2sob s THR 33 Cb 0.01 -2.51 -0.01 0.00 -1.51 0.00 0.00 72.50 68.47 2sob s THR 33 CO 0.25 0.59 0.41 0.72 -2.21 0.00 0.00 174.62 174.38 2sob s PHE 34 N -0.71 1.32 0.17 9.09 -0.71 0.47 -4.79 117.98 122.83 2sob s PHE 34 Ca 0.11 -1.44 0.03 0.00 -1.04 0.00 0.00 56.93 54.59 2sob s PHE 34 Cb -0.11 -0.31 -0.01 0.00 -1.21 0.00 0.00 43.02 41.38 2sob s PHE 34 CO 0.02 -1.05 0.17 0.54 -1.34 0.00 0.00 175.22 173.55 2sob n ARG 35 N -0.59 0.25 0.20 1.99 1.74 -1.24 -0.69 116.66 118.32 2sob n ARG 35 Ca 0.03 -1.65 -0.17 0.00 -0.77 0.00 0.00 57.85 55.30 2sob n ARG 35 Cb 0.62 1.40 -0.09 0.00 -1.02 0.00 0.00 32.46 33.37 2sob n ARG 35 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 2sob h LEU 36 N 0.00 -1.36 -5.29 0.55 5.85 -1.75 -2.22 115.31 111.08 2sob h LEU 36 Ca -0.12 0.13 -0.23 0.00 0.84 0.00 0.00 57.88 58.49 2sob h LEU 36 Cb 0.61 0.48 -0.34 0.00 0.37 0.00 0.00 40.66 41.78 2sob h LEU 36 CO 0.18 -0.59 -0.93 0.00 -0.34 0.00 0.00 178.44 176.77 2sob n LEU 37 N -5.52 0.82 -1.82 2.25 -0.00 -1.26 -1.63 117.00 109.85 2sob n LEU 37 Ca -0.10 -3.13 -0.09 0.00 -0.00 0.00 0.00 56.01 52.69 2sob n LEU 37 Cb 0.42 0.38 0.03 0.00 -0.00 0.00 0.00 43.42 44.26 2sob n LEU 37 CO 0.23 1.24 0.09 -0.11 -0.00 0.00 0.00 177.39 178.84 2sob n LEU 38 N -0.76 -2.63 -4.50 1.47 0.00 -1.25 -4.81 117.00 104.51 2sob n LEU 38 Ca 0.02 -0.23 -0.29 0.00 0.00 0.00 0.00 56.01 55.51 2sob n LEU 38 Cb 0.82 -1.55 -0.19 0.00 0.00 0.00 0.00 43.42 42.50 2sob n LEU 38 CO 0.03 0.25 2.11 0.52 0.00 0.00 0.00 177.39 180.30 2sob n VAL 39 N -3.28 -0.00 -2.73 1.96 0.31 -1.26 -4.66 118.33 108.66 2sob n VAL 39 Ca -0.02 -0.33 -0.08 0.00 -0.01 0.00 0.00 64.34 63.90 2sob n VAL 39 Cb 0.53 -0.28 0.08 0.00 -0.91 0.00 0.00 33.84 33.26 2sob n VAL 39 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 2sob n ASP 40 N 7.81 -2.48 -0.05 4.52 8.00 -1.26 -4.76 116.55 128.33 2sob n ASP 40 Ca 0.66 -3.48 -0.06 0.00 0.71 0.00 0.00 54.79 52.62 2sob n ASP 40 Cb 0.12 1.86 -0.05 0.00 -0.02 0.00 0.00 41.12 43.02 2sob n ASP 40 CO 0.00 0.00 0.00 0.74 -0.39 0.00 0.00 177.20 177.55 2sob h THR 41 N 2.88 0.69 -2.23 -3.53 2.02 -2.00 -3.43 112.91 107.31 2sob h THR 41 Ca -0.13 -1.49 -0.58 0.00 0.77 0.00 0.00 66.41 64.98 2sob h THR 41 Cb 1.08 1.29 -0.01 0.00 -1.74 0.00 0.00 68.15 68.78 2sob h THR 41 CO 0.19 0.23 1.41 -2.16 0.37 0.00 0.00 175.52 175.55 2sob s PRO 42 N -1.91 3.25 -0.02 6.66 0.04 -1.26 -4.79 135.00 136.97 2sob s PRO 42 Ca -0.08 1.87 0.20 0.00 0.04 0.00 0.00 61.00 63.04 2sob s PRO 42 Cb -0.01 -4.30 0.35 0.00 0.04 0.00 0.00 34.50 30.57 2sob s PRO 42 CO 0.28 -1.97 1.14 -0.85 0.04 0.00 0.00 177.00 175.64 2sob n GLU 43 N 8.58 0.12 -3.70 4.56 0.28 -1.26 -5.09 120.64 124.13 2sob n GLU 43 Ca 0.27 -1.87 -0.14 0.00 -0.16 0.00 0.00 57.16 55.26 2sob n GLU 43 Cb 0.45 0.02 -0.09 0.00 1.43 0.00 0.00 31.44 33.26 2sob n GLU 43 CO 0.00 0.00 0.00 0.99 -0.16 0.00 0.00 177.13 177.96 2sob s THR 44 N -0.21 0.02 -0.82 3.84 2.01 -1.26 -5.10 115.64 114.12 2sob s THR 44 Ca 0.26 -0.19 -0.26 0.00 0.31 0.00 0.00 61.69 61.82 2sob s THR 44 Cb 0.31 -0.69 0.03 0.00 0.01 0.00 0.00 72.50 72.16 2sob s THR 44 CO -0.13 -0.10 1.35 -0.75 -0.69 0.00 0.00 174.62 174.30 2sob s LYS 45 N -0.64 3.29 0.30 4.92 2.20 -1.26 -4.38 119.74 124.17 2sob s LYS 45 Ca -0.07 -0.49 0.00 0.00 -0.36 0.00 0.00 55.97 55.04 2sob s LYS 45 Cb -0.03 -4.55 0.00 0.00 -1.51 0.00 0.00 37.83 31.73 2sob s LYS 45 CO 0.04 -2.19 0.00 0.72 -0.36 0.00 0.00 175.35 173.55 2sob n HIS 46 N 9.35 -3.90 -1.79 4.03 8.25 -1.26 -5.03 115.22 124.86 2sob n HIS 46 Ca 0.13 1.02 -0.43 0.00 -0.26 0.00 0.00 57.72 58.18 2sob n HIS 46 Cb 0.50 2.72 -0.03 0.00 1.12 0.00 0.00 29.99 34.29 2sob n HIS 46 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 2sob s PRO 47 N -1.59 3.65 0.70 -0.41 0.04 -1.26 -4.72 135.00 131.40 2sob s PRO 47 Ca 0.00 2.09 0.00 0.00 0.04 0.00 0.00 61.00 63.13 2sob s PRO 47 Cb 0.00 -4.20 0.00 0.00 0.04 0.00 0.00 34.50 30.34 2sob s PRO 47 CO 0.00 -1.50 0.00 1.63 0.04 0.00 0.00 177.00 177.17 2sob n LYS 48 N 8.04 -1.88 -2.87 4.56 5.02 -1.26 -4.70 118.16 125.07 2sob n LYS 48 Ca 0.23 1.24 -0.41 0.00 -2.02 0.00 0.00 58.31 57.36 2sob n LYS 48 Cb 0.44 -2.30 -0.04 0.00 -0.02 0.00 0.00 35.03 33.11 2sob n LYS 48 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 2sob s LYS 49 N -1.53 4.54 -0.15 1.97 2.20 -1.26 -5.02 119.74 120.50 2sob s LYS 49 Ca 0.00 1.20 -0.29 0.00 -0.36 0.00 0.00 55.97 56.52 2sob s LYS 49 Cb 0.00 -3.41 -0.01 0.00 -1.51 0.00 0.00 37.83 32.91 2sob s LYS 49 CO 0.00 0.14 1.06 0.20 -0.36 0.00 0.00 175.35 176.39 2sob s GLY 50 N 0.40 2.03 0.00 5.54 0.00 -1.26 -5.01 107.32 109.02 2sob s GLY 50 Ca 0.44 0.34 0.00 0.00 0.00 0.00 0.00 44.72 45.50 2sob s GLY 50 CO 0.25 2.10 0.00 1.55 0.00 0.00 0.00 173.10 177.00 2sob n VAL 51 N 4.90 0.00 -0.57 1.40 3.14 -1.26 -5.16 118.33 120.78 2sob n VAL 51 Ca 0.11 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.49 2sob n VAL 51 Cb 0.47 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.25 2sob n VAL 51 CO 0.00 0.00 0.00 1.21 -6.46 0.00 0.00 176.83 171.58 2sob n GLU 52 N 0.00 -0.30 -1.67 1.45 0.00 -1.26 -4.89 120.64 113.96 2sob n GLU 52 Ca 0.00 0.00 -0.47 0.00 0.00 0.00 0.00 57.16 56.69 2sob n GLU 52 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 31.44 31.40 2sob n GLU 52 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.13 178.30 2sob n LYS 53 N -1.06 2.13 -3.78 5.31 4.81 -1.26 -4.97 118.16 119.34 2sob n LYS 53 Ca 0.00 0.77 -0.27 0.00 -0.87 0.00 0.00 58.31 57.94 2sob n LYS 53 Cb 0.00 -2.56 -0.16 0.00 0.02 0.00 0.00 35.03 32.33 2sob n LYS 53 CO 0.00 0.00 0.00 -0.47 1.17 0.00 0.00 177.40 178.10 2sob s TYR 54 N 1.84 1.24 0.57 5.64 6.14 -1.26 -5.13 117.35 126.38 2sob s TYR 54 Ca 0.83 -0.91 -0.12 0.00 0.64 0.00 0.00 57.07 57.51 2sob s TYR 54 Cb -0.69 -1.10 -0.05 0.00 0.42 0.00 0.00 41.96 40.53 2sob s TYR 54 CO 0.42 -0.60 0.98 0.20 0.64 0.00 0.00 175.55 177.20 2sob s GLY 55 N 1.79 1.78 0.00 8.97 0.00 -1.26 -5.02 107.32 113.57 2sob s GLY 55 Ca -0.01 -0.05 0.00 0.00 0.00 0.00 0.00 44.72 44.67 2sob s GLY 55 CO -0.07 0.21 0.00 -1.55 0.00 0.00 0.00 173.10 171.69 2sob n PRO 56 N -2.29 0.52 0.05 2.90 -0.04 -1.26 -4.98 135.00 129.91 2sob n PRO 56 Ca 0.06 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.52 2sob n PRO 56 Cb 0.54 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.00 2sob n PRO 56 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 2sob n GLU 57 N -0.35 0.00 0.10 0.54 0.28 -1.26 -4.37 120.64 115.58 2sob n GLU 57 Ca 0.00 0.00 -0.22 0.00 -0.16 0.00 0.00 57.16 56.78 2sob n GLU 57 Cb 0.00 -0.35 -0.14 0.00 1.43 0.00 0.00 31.44 32.38 2sob n GLU 57 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2sob h ALA 58 N 0.00 -0.08 -0.02 -1.84 0.00 -2.01 -3.23 119.26 112.08 2sob h ALA 58 Ca 0.00 -0.77 -0.12 0.00 0.00 0.00 0.00 54.91 54.02 2sob h ALA 58 Cb 0.00 0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 2sob h ALA 58 CO 0.00 0.59 -0.58 0.77 0.00 0.00 0.00 179.25 180.03 2sob h SER 59 N 0.05 0.06 -0.83 0.00 0.02 -2.00 -3.06 113.55 107.79 2sob h SER 59 Ca -0.19 -0.03 0.04 0.00 -0.84 0.00 0.00 61.79 60.76 2sob h SER 59 Cb 1.90 -0.02 -0.05 0.00 0.14 0.00 0.00 62.40 64.37 2sob h SER 59 CO 0.22 0.62 0.53 0.00 -1.14 0.00 0.00 176.83 177.07 2sob h ALA 60 N 1.38 1.10 0.00 3.77 0.00 -1.76 0.21 119.26 123.96 2sob h ALA 60 Ca -0.00 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 2sob h ALA 60 Cb 1.03 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 2sob h ALA 60 CO 0.08 0.35 -0.22 0.74 0.00 0.00 0.00 179.25 180.20 2sob h PHE 61 N 1.03 0.00 0.14 0.00 -1.00 -1.55 -2.14 116.94 113.41 2sob h PHE 61 Ca 0.33 0.00 -0.29 0.00 2.81 0.00 0.00 57.97 60.82 2sob h PHE 61 Cb 0.02 0.00 0.01 0.00 3.61 0.00 0.00 35.95 39.59 2sob h PHE 61 CO -0.03 0.22 -1.35 1.15 -1.61 0.00 0.00 178.31 176.70 2sob h THR 62 N 0.00 1.39 0.00 -1.55 2.02 -1.02 -3.26 112.91 110.48 2sob h THR 62 Ca -0.00 -2.95 0.00 0.00 0.77 0.00 0.00 66.41 64.22 2sob h THR 62 Cb 0.53 2.91 0.00 0.00 -1.74 0.00 0.00 68.15 69.85 2sob h THR 62 CO 0.03 0.87 0.00 0.29 0.37 0.00 0.00 175.52 177.07 2sob n LYS 63 N -3.54 0.23 0.20 6.66 4.76 0.55 -2.99 118.16 124.03 2sob n LYS 63 Ca -0.11 0.02 0.10 0.00 -2.87 0.00 0.00 58.31 55.45 2sob n LYS 63 Cb 1.04 -1.50 0.13 0.00 -1.84 0.00 0.00 35.03 32.86 2sob n LYS 63 CO 0.00 0.00 0.00 1.57 -1.37 0.00 0.00 177.40 177.60 2sob h LYS 64 N 0.00 0.00 -0.22 1.97 5.09 -1.44 -3.17 116.57 118.79 2sob h LYS 64 Ca 0.00 0.00 0.06 0.00 0.09 0.00 0.00 60.65 60.80 2sob h LYS 64 Cb 0.35 0.00 -0.01 0.00 0.10 0.00 0.00 32.23 32.67 2sob h LYS 64 CO 0.00 0.10 0.26 0.00 -2.09 0.00 0.00 179.45 177.72 2sob h MET 65 N 0.00 0.00 0.00 0.07 -0.00 -1.69 0.54 114.93 113.85 2sob h MET 65 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.70 2sob h MET 65 Cb 1.08 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.68 2sob h MET 65 CO 0.01 0.00 -0.22 1.25 -0.00 0.00 0.00 176.91 177.96 2sob h LEU 66 N 0.00 0.00 0.00 -0.10 6.46 -1.78 -0.22 115.31 119.67 2sob h LEU 66 Ca 0.11 -0.01 -0.19 0.00 -0.12 0.00 0.00 57.88 57.66 2sob h LEU 66 Cb 0.62 0.00 -0.03 0.00 -0.73 0.00 0.00 40.66 40.52 2sob h LEU 66 CO -0.00 0.01 -0.94 -0.33 -0.62 0.00 0.00 178.44 176.55 2sob h GLU 67 N 0.00 0.00 -0.03 1.25 4.39 -0.08 -3.32 114.58 116.80 2sob h GLU 67 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2sob h GLU 67 Cb 0.94 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.59 2sob h GLU 67 CO 0.00 0.85 0.00 0.27 -1.16 0.00 0.00 179.01 178.97 2sob n ASN 68 N -3.30 2.42 -4.74 1.42 0.23 -1.00 -5.01 115.26 105.29 2sob n ASN 68 Ca -0.01 -2.80 -0.41 0.00 -0.53 0.00 0.00 54.58 50.84 2sob n ASN 68 Cb 0.90 -0.33 -0.05 0.00 -2.08 0.00 0.00 39.78 38.22 2sob n ASN 68 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2sob s ALA 69 N -2.38 3.29 -0.17 -2.53 0.00 -0.10 -4.98 121.76 114.89 2sob s ALA 69 Ca 0.25 0.51 -0.13 0.00 0.00 0.00 0.00 51.96 52.60 2sob s ALA 69 Cb 0.22 -3.20 -0.07 0.00 0.00 0.00 0.00 23.12 20.06 2sob s ALA 69 CO 0.03 0.03 -0.28 1.17 0.00 0.00 0.00 175.76 176.71 2sob n LYS 70 N 2.61 0.44 -3.17 0.00 4.81 -1.26 -4.61 118.16 116.98 2sob n LYS 70 Ca 0.01 0.18 -0.45 0.00 -0.87 0.00 0.00 58.31 57.18 2sob n LYS 70 Cb 0.49 -1.25 -0.03 0.00 0.02 0.00 0.00 35.03 34.25 2sob n LYS 70 CO 0.00 0.00 0.00 0.15 1.17 0.00 0.00 177.40 178.72 2sob s LYS 71 N -2.56 3.32 -0.76 1.64 -0.14 -1.26 -4.74 119.74 115.24 2sob s LYS 71 Ca -0.27 -1.81 -0.23 0.00 -1.36 0.00 0.00 55.97 52.30 2sob s LYS 71 Cb 0.07 -4.44 0.07 0.00 -1.68 0.00 0.00 37.83 31.85 2sob s LYS 71 CO 0.36 -1.48 1.10 0.42 -0.76 0.00 0.00 175.35 174.99 2sob s ILE 72 N 1.75 4.24 -1.45 2.17 1.09 -1.26 -3.78 121.20 123.95 2sob s ILE 72 Ca 0.16 -0.46 -0.14 0.00 -1.10 0.00 0.00 60.65 59.12 2sob s ILE 72 Cb -0.17 -4.78 0.01 0.00 -1.06 0.00 0.00 42.46 36.45 2sob s ILE 72 CO -0.02 -1.59 2.34 -0.62 -0.10 0.00 0.00 174.94 174.95 2sob n GLU 73 N 7.95 2.92 -1.45 2.79 4.71 -1.23 -0.02 120.64 136.32 2sob n GLU 73 Ca 0.06 -2.48 -0.48 0.00 -0.01 0.00 0.00 57.16 54.25 2sob n GLU 73 Cb 0.47 -3.17 -0.08 0.00 -1.01 0.00 0.00 31.44 27.65 2sob n GLU 73 CO 0.00 0.00 0.00 0.28 0.09 0.00 0.00 177.13 177.50 2sob n VAL 74 N 4.87 0.10 -2.21 2.62 0.31 -0.61 -3.94 118.33 119.46 2sob n VAL 74 Ca 0.57 -0.27 -0.43 0.00 -0.01 0.00 0.00 64.34 64.20 2sob n VAL 74 Cb 0.36 -1.51 0.00 0.00 -0.91 0.00 0.00 33.84 31.78 2sob n VAL 74 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 2sob n GLU 75 N 8.30 3.26 -0.30 5.55 2.13 -0.12 -3.12 120.64 136.34 2sob n GLU 75 Ca 0.46 -3.19 0.06 0.00 0.66 0.00 0.00 57.16 55.15 2sob n GLU 75 Cb 0.22 -3.14 0.09 0.00 0.27 0.00 0.00 31.44 28.87 2sob n GLU 75 CO 0.00 0.00 0.00 1.97 -0.41 0.00 0.00 177.13 178.69 2sob n PHE 76 N 5.44 0.00 -1.10 4.31 -1.74 -0.96 -2.83 117.46 120.58 2sob n PHE 76 Ca 0.45 -0.63 0.00 0.00 -0.56 0.00 0.00 57.45 56.71 2sob n PHE 76 Cb 0.39 -0.12 0.00 0.00 1.52 0.00 0.00 39.48 41.28 2sob n PHE 76 CO 0.00 0.00 0.00 -0.40 -0.56 0.00 0.00 176.76 175.80 2sob n ASP 77 N -0.82 -0.41 -0.34 5.98 5.68 -1.10 -2.80 116.55 122.74 2sob n ASP 77 Ca 0.10 0.00 0.01 0.00 -0.50 0.00 0.00 54.79 54.39 2sob n ASP 77 Cb 0.68 0.00 0.14 0.00 -1.14 0.00 0.00 41.12 40.80 2sob n ASP 77 CO 0.00 0.00 0.00 0.50 -1.33 0.00 0.00 177.20 176.37 2sob h LYS 78 N 0.00 1.06 0.00 0.11 1.63 -1.91 -3.45 116.57 114.02 2sob h LYS 78 Ca 0.00 -0.06 0.00 0.00 -0.85 0.00 0.00 60.65 59.74 2sob h LYS 78 Cb 0.00 -0.24 0.00 0.00 -0.60 0.00 0.00 32.23 31.39 2sob h LYS 78 CO 0.00 0.70 0.00 0.41 -3.45 0.00 0.00 179.45 177.11 2sob n GLY 79 N -1.34 3.73 0.17 5.01 0.00 -1.12 -5.05 105.19 106.58 2sob n GLY 79 Ca 0.13 -0.16 -0.09 0.00 0.00 0.00 0.00 46.02 45.90 2sob n GLY 79 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2sob h GLN 80 N 0.00 -0.31 -6.09 1.61 7.50 -1.74 -3.48 115.11 112.61 2sob h GLN 80 Ca 0.00 0.02 -0.44 0.00 0.50 0.00 0.00 58.65 58.73 2sob h GLN 80 Cb 0.00 0.07 0.05 0.00 0.05 0.00 0.00 27.48 27.65 2sob h GLN 80 CO 0.00 0.01 -0.73 -2.13 -1.50 0.00 0.00 178.83 174.48 2sob n ARG 81 N -4.99 -6.63 0.00 1.46 3.00 -0.62 -4.95 116.66 103.93 2sob n ARG 81 Ca -0.07 0.71 0.00 0.00 -0.00 0.00 0.00 57.85 58.49 2sob n ARG 81 Cb 0.23 -5.67 0.00 0.00 0.00 0.00 0.00 32.46 27.03 2sob n ARG 81 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.63 180.04 2sob n THR 82 N -4.81 0.00 0.00 5.15 -1.04 -1.25 -4.72 114.28 107.60 2sob n THR 82 Ca 0.01 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.02 2sob n THR 82 Cb 0.55 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.06 2sob n THR 82 CO 0.00 0.00 0.00 -0.67 -0.64 0.00 0.00 175.07 173.76 2sob n ASP 83 N 0.00 0.00 -0.05 8.00 2.03 -1.26 0.55 116.55 125.82 2sob n ASP 83 Ca 0.00 0.00 -0.15 0.00 0.52 0.00 0.00 54.79 55.16 2sob n ASP 83 Cb 0.00 0.00 -0.13 0.00 -0.72 0.00 0.00 41.12 40.27 2sob n ASP 83 CO 0.00 0.00 0.00 0.50 -1.92 0.00 0.00 177.20 175.78 2sob h LYS 84 N 0.00 0.06 0.00 -0.67 3.11 -1.99 -3.39 116.57 113.68 2sob h LYS 84 Ca 0.00 -0.10 -0.24 0.00 -2.81 0.00 0.00 60.65 57.50 2sob h LYS 84 Cb 0.00 0.04 -0.05 0.00 -1.00 0.00 0.00 32.23 31.22 2sob h LYS 84 CO 0.00 1.04 -1.99 0.66 -2.81 0.00 0.00 179.45 176.36 2sob n TYR 85 N -4.52 0.00 -2.45 1.91 4.01 -1.23 -5.03 117.16 109.85 2sob n TYR 85 Ca -0.11 0.00 -0.05 0.00 -0.16 0.00 0.00 57.90 57.59 2sob n TYR 85 Cb 0.54 -0.69 0.02 0.00 -0.31 0.00 0.00 39.34 38.90 2sob n TYR 85 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2sob n GLY 86 N 2.03 0.29 0.00 2.72 0.00 0.19 -4.52 105.19 105.90 2sob n GLY 86 Ca -0.22 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.45 2sob n GLY 86 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2sob n ARG 87 N -1.79 3.17 -1.70 1.61 1.85 -1.26 -1.58 116.66 116.96 2sob n ARG 87 Ca -0.06 0.00 -0.34 0.00 -1.00 0.00 0.00 57.85 56.45 2sob n ARG 87 Cb 0.54 0.00 -0.04 0.00 -1.05 0.00 0.00 32.46 31.91 2sob n ARG 87 CO 0.00 0.00 0.00 0.28 -0.01 0.00 0.00 177.63 177.90 2sob n VAL 88 N 0.00 4.39 -2.29 8.89 0.31 -1.26 -3.92 118.33 124.45 2sob n VAL 88 Ca 0.00 -3.53 -0.36 0.00 -0.01 0.00 0.00 64.34 60.43 2sob n VAL 88 Cb 0.00 -1.97 -0.03 0.00 -0.91 0.00 0.00 33.84 30.93 2sob n VAL 88 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 2sob n LEU 89 N 1.69 4.09 0.00 7.52 4.77 -1.26 -4.14 117.00 129.67 2sob n LEU 89 Ca 0.58 -3.56 0.00 0.00 -0.03 0.00 0.00 56.01 53.01 2sob n LEU 89 Cb 0.39 -1.73 0.00 0.00 -2.33 0.00 0.00 43.42 39.75 2sob n LEU 89 CO 0.55 -0.77 0.00 0.00 -1.33 0.00 0.00 177.39 175.84 2sob n ALA 90 N 11.15 0.00 -3.73 -1.18 0.00 -0.65 -4.59 120.51 121.51 2sob n ALA 90 Ca 0.47 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.84 2sob n ALA 90 Cb 0.46 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.89 2sob n ALA 90 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 2sob s TYR 91 N 1.62 -0.26 -0.09 0.00 2.02 -1.13 -3.78 117.35 115.73 2sob s TYR 91 Ca 0.00 -0.10 -0.00 0.00 -0.37 0.00 0.00 57.07 56.60 2sob s TYR 91 Cb 0.00 0.66 0.02 0.00 -0.40 0.00 0.00 41.96 42.24 2sob s TYR 91 CO 0.00 -1.04 -0.07 0.42 -1.57 0.00 0.00 175.55 173.29 2sob s ILE 92 N -3.72 0.88 -0.50 2.71 -1.09 -1.26 -0.94 121.20 117.28 2sob s ILE 92 Ca 0.09 -0.23 0.04 0.00 -2.23 0.00 0.00 60.65 58.32 2sob s ILE 92 Cb -0.04 -0.91 0.17 0.00 -1.58 0.00 0.00 42.46 40.11 2sob s ILE 92 CO 0.01 0.33 0.40 -1.22 -1.23 0.00 0.00 174.94 173.23 2sob n TYR 93 N 4.71 0.36 -3.36 3.97 4.01 -1.26 -4.77 117.16 120.82 2sob n TYR 93 Ca -0.14 -3.62 -0.44 0.00 -0.16 0.00 0.00 57.90 53.54 2sob n TYR 93 Cb 0.50 -0.02 -0.07 0.00 -0.31 0.00 0.00 39.34 39.44 2sob n TYR 93 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2sob s ALA 94 N -0.46 3.55 0.00 -0.72 0.00 -1.25 -3.52 121.76 119.36 2sob s ALA 94 Ca 0.31 -2.10 0.00 0.00 0.00 0.00 0.00 51.96 50.17 2sob s ALA 94 Cb 0.02 -3.11 0.00 0.00 0.00 0.00 0.00 23.12 20.03 2sob s ALA 94 CO -0.19 -1.77 0.00 -0.25 0.00 0.00 0.00 175.76 173.55 2sob n ASP 95 N 5.30 -5.31 -0.02 0.00 8.00 -1.25 -4.30 116.55 118.97 2sob n ASP 95 Ca -0.12 0.00 -0.05 0.00 0.71 0.00 0.00 54.79 55.33 2sob n ASP 95 Cb 0.44 -3.07 -0.02 0.00 -0.02 0.00 0.00 41.12 38.45 2sob n ASP 95 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2sob n GLY 96 N 0.35 -0.27 3.96 0.44 0.00 -1.26 -4.96 105.19 103.46 2sob n GLY 96 Ca 0.00 -0.15 -0.33 0.00 0.00 0.00 0.00 46.02 45.54 2sob n GLY 96 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2sob n LYS 97 N -3.93 -1.09 0.00 1.61 2.85 -1.26 -4.65 118.16 111.69 2sob n LYS 97 Ca -0.08 0.11 0.00 0.00 -1.05 0.00 0.00 58.31 57.29 2sob n LYS 97 Cb 0.28 -4.29 0.00 0.00 -0.65 0.00 0.00 35.03 30.36 2sob n LYS 97 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2sob n MET 98 N -3.52 0.00 0.23 -1.58 0.00 -1.26 -4.58 117.12 106.41 2sob n MET 98 Ca 0.09 0.00 0.17 0.00 0.00 0.00 0.00 57.70 57.96 2sob n MET 98 Cb 0.42 -0.87 0.86 0.00 0.00 0.00 0.00 33.22 33.63 2sob n MET 98 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 175.97 176.25 2sob h VAL 99 N 0.00 0.44 -0.85 3.17 2.07 -1.82 -0.36 116.25 118.90 2sob h VAL 99 Ca 0.00 0.00 0.20 0.00 0.82 0.00 0.00 66.70 67.72 2sob h VAL 99 Cb 0.97 0.86 -0.06 0.00 -1.52 0.00 0.00 31.29 31.54 2sob h VAL 99 CO 0.00 0.00 0.57 -0.55 0.02 0.00 0.00 177.57 177.61 2sob h ASN 100 N 0.00 0.31 0.25 0.57 -1.07 -1.88 0.70 115.58 114.46 2sob h ASN 100 Ca 0.07 0.03 -0.21 0.00 0.07 0.00 0.00 56.30 56.25 2sob h ASN 100 Cb 0.42 -0.03 0.00 0.00 -2.07 0.00 0.00 38.32 36.64 2sob h ASN 100 CO -0.00 0.13 -0.86 -0.33 0.07 0.00 0.00 177.43 176.43 2sob h GLU 101 N 0.31 0.46 -6.61 4.14 5.08 -1.37 -3.44 114.58 113.15 2sob h GLU 101 Ca 0.43 -0.44 -0.52 0.00 -1.00 0.00 0.00 59.36 57.83 2sob h GLU 101 Cb 1.19 0.11 0.05 0.00 0.50 0.00 0.00 28.75 30.61 2sob h GLU 101 CO -0.13 1.09 1.05 0.00 -1.00 0.00 0.00 179.01 180.02 2sob s ALA 102 N -3.42 3.89 0.00 3.43 0.00 0.24 -5.19 121.76 120.70 2sob s ALA 102 Ca -0.06 1.56 0.00 0.00 0.00 0.00 0.00 51.96 53.45 2sob s ALA 102 Cb 0.09 -3.72 0.00 0.00 0.00 0.00 0.00 23.12 19.49 2sob s ALA 102 CO 0.86 -1.03 0.24 1.47 0.00 0.00 0.00 175.76 177.31