#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jt4 n ALA 2 N 0.00 -0.30 -3.54 3.17 0.00 -1.26 -4.96 120.51 113.62 2jt4 n ALA 2 Ca 0.00 0.22 -0.37 0.00 0.00 0.00 0.00 53.44 53.29 2jt4 n ALA 2 Cb 0.00 -1.70 -0.12 0.00 0.00 0.00 0.00 19.45 17.63 2jt4 n ALA 2 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2jt4 s SER 3 N -2.69 5.23 0.00 0.00 0.15 -1.26 -4.49 113.70 110.64 2jt4 s SER 3 Ca 0.00 -1.54 0.00 0.00 0.70 0.00 0.00 55.95 55.11 2jt4 s SER 3 Cb 0.00 -1.83 0.00 0.00 -1.71 0.00 0.00 66.02 62.48 2jt4 s SER 3 CO 0.00 -0.42 0.00 0.29 1.20 0.00 0.00 173.24 174.31 2jt4 n LYS 4 N 4.70 -0.88 -3.55 5.44 5.02 -1.26 -5.00 118.16 122.64 2jt4 n LYS 4 Ca -0.09 0.22 -0.23 0.00 -2.02 0.00 0.00 58.31 56.19 2jt4 n LYS 4 Cb 0.43 -3.89 -0.01 0.00 -0.02 0.00 0.00 35.03 31.54 2jt4 n LYS 4 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 2jt4 s SER 5 N -2.01 6.31 0.35 4.39 1.04 -1.26 -5.12 113.70 117.40 2jt4 s SER 5 Ca 0.00 0.35 0.09 0.00 0.48 0.00 0.00 55.95 56.87 2jt4 s SER 5 Cb 0.00 -1.99 -0.07 0.00 0.10 0.00 0.00 66.02 64.06 2jt4 s SER 5 CO 0.00 -0.22 -0.07 -0.54 0.98 0.00 0.00 173.24 173.39 2jt4 s LYS 6 N -4.17 1.82 0.59 4.02 1.02 -1.26 -4.95 119.74 116.80 2jt4 s LYS 6 Ca 0.38 -1.96 -0.10 0.00 0.02 0.00 0.00 55.97 54.32 2jt4 s LYS 6 Cb -0.10 -1.61 -0.04 0.00 -0.52 0.00 0.00 37.83 35.56 2jt4 s LYS 6 CO 0.34 0.08 0.98 0.15 -0.92 0.00 0.00 175.35 175.97 2jt4 s LYS 7 N -3.65 3.59 -0.10 1.68 -0.14 -0.80 -4.87 119.74 115.46 2jt4 s LYS 7 Ca 0.33 0.63 0.01 0.00 -1.36 0.00 0.00 55.97 55.58 2jt4 s LYS 7 Cb 0.04 -2.15 0.02 0.00 -1.68 0.00 0.00 37.83 34.07 2jt4 s LYS 7 CO 0.16 -0.48 -0.10 1.03 -0.76 0.00 0.00 175.35 175.20 2jt4 s ARG 8 N -5.06 1.62 0.20 1.68 0.52 -1.26 -0.82 118.95 115.82 2jt4 s ARG 8 Ca 0.53 -0.33 -0.11 0.00 -0.52 0.00 0.00 55.73 55.31 2jt4 s ARG 8 Cb -0.11 -1.54 -0.00 0.00 0.52 0.00 0.00 34.95 33.82 2jt4 s ARG 8 CO 0.52 -0.15 0.37 0.20 0.02 0.00 0.00 175.30 176.25 2jt4 s GLY 9 N 1.30 0.49 -0.11 -3.53 0.00 -0.40 -0.87 107.32 104.20 2jt4 s GLY 9 Ca -0.03 -0.85 0.03 0.00 0.00 0.00 0.00 44.72 43.87 2jt4 s GLY 9 CO -0.04 -0.73 -0.22 -0.42 0.00 0.00 0.00 173.10 171.70 2jt4 s ILE 10 N -3.99 2.28 -0.13 0.90 1.01 0.98 -1.39 121.20 120.86 2jt4 s ILE 10 Ca 0.19 -0.94 -0.29 0.00 0.00 0.00 0.00 60.65 59.61 2jt4 s ILE 10 Cb 0.02 -1.89 -0.02 0.00 0.01 0.00 0.00 42.46 40.58 2jt4 s ILE 10 CO 0.04 0.55 1.23 0.54 0.00 0.00 0.00 174.94 177.30 2jt4 s VAL 11 N 0.36 4.29 0.14 2.92 0.11 -1.03 -0.40 120.40 126.78 2jt4 s VAL 11 Ca -0.17 1.58 0.04 0.00 -2.93 0.00 0.00 61.98 60.50 2jt4 s VAL 11 Cb -0.17 -4.02 -0.19 0.00 -1.53 0.00 0.00 36.38 30.47 2jt4 s VAL 11 CO 0.08 -0.09 1.31 1.56 -3.33 0.00 0.00 175.10 174.63 2jt4 h GLN 12 N 7.94 0.10 0.00 1.54 1.08 -0.85 -1.85 115.11 123.07 2jt4 h GLN 12 Ca -0.29 -0.14 -0.46 0.00 -1.45 0.00 0.00 58.65 56.32 2jt4 h GLN 12 Cb 1.12 0.05 -0.05 0.00 -0.05 0.00 0.00 27.48 28.55 2jt4 h GLN 12 CO 0.94 0.99 -0.24 0.66 -0.95 0.00 0.00 178.83 180.23 2jt4 n TYR 13 N -3.50 -0.46 -3.53 2.96 4.02 -1.26 -4.61 117.16 110.77 2jt4 n TYR 13 Ca -0.03 -1.82 -0.22 0.00 -0.01 0.00 0.00 57.90 55.82 2jt4 n TYR 13 Cb 0.89 -0.33 -0.01 0.00 -0.02 0.00 0.00 39.34 39.87 2jt4 n TYR 13 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 2jt4 s ASP 14 N -3.42 6.23 -0.27 7.72 1.01 -1.26 -2.43 116.67 124.24 2jt4 s ASP 14 Ca 0.19 0.26 -0.00 0.00 0.71 0.00 0.00 52.55 53.71 2jt4 s ASP 14 Cb -0.02 -1.86 0.14 0.00 1.01 0.00 0.00 42.92 42.19 2jt4 s ASP 14 CO 0.12 -0.28 0.34 0.12 0.21 0.00 0.00 175.17 175.68 2jt4 s PHE 15 N -2.23 -0.68 -0.45 4.23 5.36 0.51 -4.91 117.98 119.82 2jt4 s PHE 15 Ca 0.39 0.18 -0.27 0.00 -0.96 0.00 0.00 56.93 56.28 2jt4 s PHE 15 Cb -0.09 -0.28 0.03 0.00 -0.34 0.00 0.00 43.02 42.33 2jt4 s PHE 15 CO 0.34 -0.88 0.99 -1.64 -1.46 0.00 0.00 175.22 172.56 2jt4 s MET 16 N 2.45 3.65 0.27 10.12 -1.94 -1.26 -1.39 119.30 131.20 2jt4 s MET 16 Ca 0.10 0.37 -0.11 0.00 -1.71 0.00 0.00 55.69 54.34 2jt4 s MET 16 Cb -0.14 -3.89 -0.07 0.00 2.01 0.00 0.00 34.83 32.73 2jt4 s MET 16 CO -0.27 -1.21 0.62 0.00 -0.01 0.00 0.00 175.02 174.14 2jt4 s ALA 17 N 3.89 3.48 0.00 3.03 0.00 -1.26 -4.97 121.76 125.93 2jt4 s ALA 17 Ca 0.40 -0.20 0.00 0.00 0.00 0.00 0.00 51.96 52.16 2jt4 s ALA 17 Cb -0.10 -2.54 0.00 0.00 0.00 0.00 0.00 23.12 20.48 2jt4 s ALA 17 CO 0.26 0.40 0.00 -1.91 0.00 0.00 0.00 175.76 174.51 2jt4 n GLU 18 N -0.35 3.05 -3.25 0.00 2.13 -1.26 -4.84 120.64 116.11 2jt4 n GLU 18 Ca 0.01 0.00 -0.31 0.00 0.66 0.00 0.00 57.16 57.53 2jt4 n GLU 18 Cb 0.53 -0.73 -0.04 0.00 0.27 0.00 0.00 31.44 31.46 2jt4 n GLU 18 CO 0.00 0.00 0.00 -1.12 -0.41 0.00 0.00 177.13 175.60 2jt4 s SER 19 N -1.05 6.57 0.44 4.31 0.01 -1.26 -4.98 113.70 117.73 2jt4 s SER 19 Ca 0.00 0.94 0.24 0.00 1.31 0.00 0.00 55.95 58.44 2jt4 s SER 19 Cb 0.00 -2.24 0.83 0.00 0.21 0.00 0.00 66.02 64.83 2jt4 s SER 19 CO 0.00 -0.19 1.78 1.56 0.41 0.00 0.00 173.24 176.81 2jt4 h GLN 20 N 2.01 0.00 0.00 12.44 1.08 -2.03 -2.54 115.11 126.07 2jt4 h GLN 20 Ca -0.47 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.73 2jt4 h GLN 20 Cb 1.18 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.61 2jt4 h GLN 20 CO 0.67 0.20 -0.05 -0.25 -0.95 0.00 0.00 178.83 178.45 2jt4 n ASP 21 N -3.29 0.75 -4.48 1.46 9.92 -1.26 -4.84 116.55 114.80 2jt4 n ASP 21 Ca 0.01 0.53 -0.26 0.00 -0.53 0.00 0.00 54.79 54.54 2jt4 n ASP 21 Cb 0.46 -0.70 0.14 0.00 -0.64 0.00 0.00 41.12 40.37 2jt4 n ASP 21 CO 0.00 0.00 0.00 -1.61 0.13 0.00 0.00 177.20 175.72 2jt4 s GLU 22 N -3.10 1.31 -0.13 -1.24 2.02 -0.96 -1.24 118.70 115.36 2jt4 s GLU 22 Ca 0.11 -0.76 -0.03 0.00 0.02 0.00 0.00 54.97 54.31 2jt4 s GLU 22 Cb 0.13 -2.12 0.05 0.00 0.10 0.00 0.00 34.13 32.28 2jt4 s GLU 22 CO 0.60 -1.82 0.03 -1.17 0.02 0.00 0.00 175.26 172.93 2jt4 s LEU 23 N -5.45 0.75 -0.54 1.80 2.96 -1.10 -4.41 118.68 112.69 2jt4 s LEU 23 Ca 0.69 -0.44 -0.27 0.00 -0.22 0.00 0.00 54.13 53.89 2jt4 s LEU 23 Cb -0.05 -0.45 -0.01 0.00 0.50 0.00 0.00 46.19 46.18 2jt4 s LEU 23 CO 0.48 -0.27 1.75 -0.89 -1.32 0.00 0.00 176.35 176.10 2jt4 s THR 24 N 1.97 3.47 0.22 3.68 2.01 -1.26 -4.58 115.64 121.16 2jt4 s THR 24 Ca 0.02 0.37 0.11 0.00 0.31 0.00 0.00 61.69 62.50 2jt4 s THR 24 Cb -0.15 -3.98 -0.05 0.00 0.01 0.00 0.00 72.50 68.34 2jt4 s THR 24 CO -0.07 -0.85 -0.17 0.27 -0.69 0.00 0.00 174.62 173.11 2jt4 s ILE 25 N 7.94 2.71 0.20 1.82 -4.36 -0.49 -4.94 121.20 124.09 2jt4 s ILE 25 Ca 0.67 -2.04 0.11 0.00 -0.26 0.00 0.00 60.65 59.13 2jt4 s ILE 25 Cb -0.14 -2.37 -0.04 0.00 1.25 0.00 0.00 42.46 41.16 2jt4 s ILE 25 CO 0.24 -0.23 -0.22 -0.54 0.24 0.00 0.00 174.94 174.44 2jt4 s LYS 26 N -3.06 1.58 -0.05 0.37 1.02 -1.26 -0.37 119.74 117.97 2jt4 s LYS 26 Ca 0.26 -1.52 -0.30 0.00 0.02 0.00 0.00 55.97 54.43 2jt4 s LYS 26 Cb -0.07 -1.87 -0.08 0.00 -0.52 0.00 0.00 37.83 35.29 2jt4 s LYS 26 CO 0.14 0.40 2.06 -1.13 -0.92 0.00 0.00 175.35 175.89 2jt4 n SER 27 N 0.17 3.84 0.00 2.83 3.41 -1.02 -1.30 113.62 121.55 2jt4 n SER 27 Ca -0.12 0.67 0.00 0.00 -0.26 0.00 0.00 58.87 59.16 2jt4 n SER 27 Cb 0.56 -1.53 0.00 0.00 -0.26 0.00 0.00 64.21 62.98 2jt4 n SER 27 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2jt4 n GLY 28 N 4.97 0.75 3.73 5.00 0.00 -0.69 -4.98 105.19 113.97 2jt4 n GLY 28 Ca 0.24 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.84 2jt4 n GLY 28 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2jt4 s ASP 29 N -1.51 7.01 -0.14 1.61 1.01 -0.42 -4.90 116.67 119.34 2jt4 s ASP 29 Ca 0.00 2.23 -0.23 0.00 0.71 0.00 0.00 52.55 55.26 2jt4 s ASP 29 Cb 0.00 -2.60 -0.03 0.00 1.01 0.00 0.00 42.92 41.31 2jt4 s ASP 29 CO 0.00 -0.46 0.73 -0.75 0.21 0.00 0.00 175.17 174.90 2jt4 s LYS 30 N 0.26 4.32 0.07 8.23 2.47 -1.26 -2.48 119.74 131.35 2jt4 s LYS 30 Ca 0.56 0.87 0.04 0.00 -1.56 0.00 0.00 55.97 55.88 2jt4 s LYS 30 Cb -0.33 -3.53 -0.03 0.00 -1.46 0.00 0.00 37.83 32.48 2jt4 s LYS 30 CO 0.34 -0.17 -0.11 0.14 0.16 0.00 0.00 175.35 175.72 2jt4 s VAL 31 N 1.61 0.85 -0.15 4.02 -7.23 -0.48 -1.76 120.40 117.26 2jt4 s VAL 31 Ca 0.36 -1.30 -0.07 0.00 -1.81 0.00 0.00 61.98 59.15 2jt4 s VAL 31 Cb -0.17 -0.96 -0.04 0.00 0.56 0.00 0.00 36.38 35.77 2jt4 s VAL 31 CO 0.14 -0.37 0.11 -0.31 -0.31 0.00 0.00 175.10 174.36 2jt4 s TYR 32 N -1.60 3.46 -0.34 2.82 2.02 0.11 -1.28 117.35 122.53 2jt4 s TYR 32 Ca -0.03 0.38 -0.17 0.00 -0.37 0.00 0.00 57.07 56.87 2jt4 s TYR 32 Cb -0.08 -2.01 -0.01 0.00 -0.40 0.00 0.00 41.96 39.46 2jt4 s TYR 32 CO 0.01 0.50 0.47 0.42 -1.57 0.00 0.00 175.55 175.38 2jt4 s ILE 33 N -0.42 5.06 -0.05 2.71 1.01 -0.00 0.39 121.20 129.89 2jt4 s ILE 33 Ca 0.11 0.28 -0.25 0.00 0.00 0.00 0.00 60.65 60.79 2jt4 s ILE 33 Cb -0.12 -3.92 -0.23 0.00 0.01 0.00 0.00 42.46 38.21 2jt4 s ILE 33 CO 0.02 -0.17 1.06 -0.07 0.00 0.00 0.00 174.94 175.78 2jt4 h LEU 34 N 8.98 0.17 -7.32 2.97 3.38 -0.28 -2.13 115.31 121.08 2jt4 h LEU 34 Ca -0.28 -0.73 -0.30 0.00 0.09 0.00 0.00 57.88 56.65 2jt4 h LEU 34 Cb 1.13 -0.05 -0.36 0.00 0.09 0.00 0.00 40.66 41.47 2jt4 h LEU 34 CO 0.75 0.88 -0.66 -0.62 0.09 0.00 0.00 178.44 178.88 2jt4 s ASP 35 N -6.18 0.62 -0.02 -0.43 2.15 -1.22 -4.89 116.67 106.70 2jt4 s ASP 35 Ca -0.16 0.25 0.03 0.00 0.43 0.00 0.00 52.55 53.10 2jt4 s ASP 35 Cb 0.01 0.15 0.05 0.00 -0.30 0.00 0.00 42.92 42.82 2jt4 s ASP 35 CO 0.72 -0.22 0.90 -0.90 -0.17 0.00 0.00 175.17 175.51 2jt4 n ASP 36 N 5.03 1.40 -0.05 -0.34 5.75 -1.26 -1.90 116.55 125.19 2jt4 n ASP 36 Ca -0.10 -1.94 -0.10 0.00 -0.01 0.00 0.00 54.79 52.64 2jt4 n ASP 36 Cb 0.50 -0.09 -0.03 0.00 -1.03 0.00 0.00 41.12 40.47 2jt4 n ASP 36 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 2jt4 n LYS 37 N -0.50 0.29 -0.03 0.11 5.02 -1.26 -4.62 118.16 117.17 2jt4 n LYS 37 Ca 0.03 0.12 -0.14 0.00 -2.02 0.00 0.00 58.31 56.30 2jt4 n LYS 37 Cb 0.41 -1.00 -0.11 0.00 -0.02 0.00 0.00 35.03 34.32 2jt4 n LYS 37 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 2jt4 h LYS 38 N -0.52 0.12 -4.74 1.97 1.57 -1.90 -3.39 116.57 109.68 2jt4 h LYS 38 Ca -0.18 -0.11 -0.70 0.00 -1.87 0.00 0.00 60.65 57.79 2jt4 h LYS 38 Cb 0.91 0.02 -0.19 0.00 0.08 0.00 0.00 32.23 33.05 2jt4 h LYS 38 CO -0.11 0.80 0.04 -1.12 -0.57 0.00 0.00 179.45 178.49 2jt4 s SER 39 N -6.11 6.20 -0.10 0.86 0.01 -1.26 -4.87 113.70 108.42 2jt4 s SER 39 Ca -0.16 -1.24 0.19 0.00 1.31 0.00 0.00 55.95 56.05 2jt4 s SER 39 Cb 0.01 -2.29 -0.27 0.00 0.21 0.00 0.00 66.02 63.68 2jt4 s SER 39 CO 0.72 -0.99 0.33 1.17 0.41 0.00 0.00 173.24 174.88 2jt4 n LYS 40 N 6.15 0.67 0.06 12.44 4.81 -1.26 -4.31 118.16 136.72 2jt4 n LYS 40 Ca -0.09 -0.05 -0.23 0.00 -0.87 0.00 0.00 58.31 57.07 2jt4 n LYS 40 Cb 0.44 -1.56 -0.15 0.00 0.02 0.00 0.00 35.03 33.78 2jt4 n LYS 40 CO 0.00 0.00 0.00 -0.44 1.17 0.00 0.00 177.40 178.13 2jt4 h ASP 41 N 0.00 0.57 -3.18 3.14 5.19 -1.95 -3.43 116.42 116.76 2jt4 h ASP 41 Ca -0.28 -0.92 -0.60 0.00 -0.62 0.00 0.00 57.03 54.61 2jt4 h ASP 41 Cb 1.67 -0.18 -0.35 0.00 0.18 0.00 0.00 39.33 40.64 2jt4 h ASP 41 CO 0.02 1.72 -0.84 0.26 -3.12 0.00 0.00 179.24 177.28 2jt4 s TRP 42 N -2.54 2.11 0.01 4.55 0.52 -1.26 -1.88 118.94 120.44 2jt4 s TRP 42 Ca -0.16 -1.10 -0.10 0.00 0.02 0.00 0.00 56.10 54.75 2jt4 s TRP 42 Cb 0.05 -1.53 -0.05 0.00 -1.15 0.00 0.00 33.47 30.78 2jt4 s TRP 42 CO 0.84 -0.59 0.33 -1.58 0.02 0.00 0.00 176.95 175.97 2jt4 s TRP 43 N 1.26 3.63 -0.62 -1.98 0.52 0.12 -4.61 118.94 117.27 2jt4 s TRP 43 Ca -0.00 0.77 -0.24 0.00 0.02 0.00 0.00 56.10 56.65 2jt4 s TRP 43 Cb -0.14 -2.13 0.05 0.00 -1.15 0.00 0.00 33.47 30.10 2jt4 s TRP 43 CO -0.07 0.62 1.00 -1.64 0.02 0.00 0.00 176.95 176.88 2jt4 s MET 44 N -1.46 3.23 -0.00 4.98 -1.94 -0.80 -1.36 119.30 121.95 2jt4 s MET 44 Ca 0.26 -0.47 0.02 0.00 -1.71 0.00 0.00 55.69 53.79 2jt4 s MET 44 Cb -0.14 -4.14 -0.03 0.00 2.01 0.00 0.00 34.83 32.52 2jt4 s MET 44 CO 0.14 -1.70 -0.03 0.00 -0.01 0.00 0.00 175.02 173.41 2jt4 s GLN 46 N -1.47 2.97 0.25 0.00 0.74 0.16 -0.78 119.66 121.52 2jt4 s GLN 46 Ca 0.18 -0.84 -0.30 0.00 0.05 0.00 0.00 55.36 54.45 2jt4 s GLN 46 Cb -0.11 -2.35 -0.09 0.00 1.10 0.00 0.00 33.01 31.55 2jt4 s GLN 46 CO 0.09 0.04 1.32 -0.51 -0.55 0.00 0.00 175.29 175.68 2jt4 s LEU 47 N 0.68 4.42 0.37 3.68 1.43 0.11 0.06 118.68 129.44 2jt4 s LEU 47 Ca -0.11 2.52 0.20 0.00 -1.03 0.00 0.00 54.13 55.72 2jt4 s LEU 47 Cb -0.16 -3.62 0.49 0.00 0.03 0.00 0.00 46.19 42.92 2jt4 s LEU 47 CO 0.01 -0.54 1.64 0.58 0.23 0.00 0.00 176.35 178.27 2jt4 h VAL 48 N 3.48 0.61 0.00 -1.59 2.07 -1.68 -0.80 116.25 118.34 2jt4 h VAL 48 Ca -0.46 -1.57 0.00 0.00 0.82 0.00 0.00 66.70 65.49 2jt4 h VAL 48 Cb 1.22 2.07 0.00 0.00 -1.52 0.00 0.00 31.29 33.06 2jt4 h VAL 48 CO 0.74 0.31 0.00 -0.67 0.02 0.00 0.00 177.57 177.96 2jt4 n ASP 49 N -3.28 0.00 -0.05 0.57 2.03 -1.26 -4.43 116.55 110.13 2jt4 n ASP 49 Ca 0.01 0.85 -0.02 0.00 0.52 0.00 0.00 54.79 56.15 2jt4 n ASP 49 Cb 0.57 -0.42 -0.15 0.00 -0.72 0.00 0.00 41.12 40.40 2jt4 n ASP 49 CO 0.00 0.00 0.00 -1.54 -1.92 0.00 0.00 177.20 173.74 2jt4 n SER 50 N -1.76 0.19 0.00 1.67 3.41 -1.26 -4.98 113.62 110.89 2jt4 n SER 50 Ca 0.00 0.08 0.00 0.00 -0.26 0.00 0.00 58.87 58.69 2jt4 n SER 50 Cb 0.00 1.09 0.00 0.00 -0.26 0.00 0.00 64.21 65.04 2jt4 n SER 50 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2jt4 n GLY 51 N 1.54 0.78 3.78 5.00 0.00 -0.31 -5.03 105.19 110.95 2jt4 n GLY 51 Ca -0.20 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.45 2jt4 n GLY 51 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jt4 s LYS 52 N -0.82 4.55 0.22 1.61 1.02 -1.26 -4.60 119.74 120.46 2jt4 s LYS 52 Ca 0.00 1.42 0.12 0.00 0.02 0.00 0.00 55.97 57.53 2jt4 s LYS 52 Cb 0.00 -2.84 -0.05 0.00 -0.52 0.00 0.00 37.83 34.42 2jt4 s LYS 52 CO 0.00 0.23 -0.23 -1.54 -0.92 0.00 0.00 175.35 172.89 2jt4 s SER 53 N -1.49 3.48 0.08 2.83 1.04 -1.26 0.10 113.70 118.47 2jt4 s SER 53 Ca 0.50 -0.92 -0.26 0.00 0.48 0.00 0.00 55.95 55.75 2jt4 s SER 53 Cb -0.21 -0.27 0.09 0.00 0.10 0.00 0.00 66.02 65.73 2jt4 s SER 53 CO 0.27 0.10 1.16 -0.83 0.98 0.00 0.00 173.24 174.92 2jt4 s GLY 54 N -2.93 -0.09 -0.08 7.32 0.00 0.04 -4.87 107.32 106.71 2jt4 s GLY 54 Ca 0.24 0.01 -0.19 0.00 0.00 0.00 0.00 44.72 44.77 2jt4 s GLY 54 CO 0.11 2.97 0.53 1.08 0.00 0.00 0.00 173.10 177.79 2jt4 s LEU 55 N -3.44 4.33 0.07 0.66 2.01 -0.37 -1.18 118.68 120.75 2jt4 s LEU 55 Ca 0.22 0.95 0.01 0.00 0.01 0.00 0.00 54.13 55.33 2jt4 s LEU 55 Cb -0.00 -2.79 -0.03 0.00 0.01 0.00 0.00 46.19 43.37 2jt4 s LEU 55 CO 0.01 0.03 -0.06 0.68 1.01 0.00 0.00 176.35 178.02 2jt4 s VAL 56 N 0.34 0.52 0.23 -1.59 -7.23 -0.47 -2.72 120.40 109.49 2jt4 s VAL 56 Ca 0.29 -1.58 -0.32 0.00 -1.81 0.00 0.00 61.98 58.56 2jt4 s VAL 56 Cb -0.16 -1.22 -0.13 0.00 0.56 0.00 0.00 36.38 35.43 2jt4 s VAL 56 CO 0.13 -0.72 1.52 -0.81 -0.31 0.00 0.00 175.10 174.91 2jt4 n PRO 57 N 0.56 2.28 0.05 4.82 -0.04 -1.26 0.16 135.00 141.56 2jt4 n PRO 57 Ca -0.17 0.81 -0.11 0.00 -0.04 0.00 0.00 63.50 64.00 2jt4 n PRO 57 Cb 0.59 -2.54 -0.04 0.00 -0.04 0.00 0.00 33.50 31.46 2jt4 n PRO 57 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2jt4 h ALA 58 N 4.99 -0.23 0.00 0.55 0.00 -1.64 -2.71 119.26 120.22 2jt4 h ALA 58 Ca -0.45 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.47 2jt4 h ALA 58 Cb 1.25 0.35 0.00 0.00 0.00 0.00 0.00 17.79 19.39 2jt4 h ALA 58 CO 0.82 -0.68 0.00 0.00 0.00 0.00 0.00 179.25 179.38 2jt4 n GLN 59 N -5.33 0.64 0.02 0.00 10.64 -1.26 -2.03 117.38 120.05 2jt4 n GLN 59 Ca -0.05 0.00 0.11 0.00 -1.83 0.00 0.00 57.00 55.23 2jt4 n GLN 59 Cb 0.24 -1.06 -0.04 0.00 -0.86 0.00 0.00 30.24 28.52 2jt4 n GLN 59 CO 0.00 0.00 0.00 1.19 -1.83 0.00 0.00 177.06 176.42 2jt4 n PHE 60 N -0.36 0.18 -3.78 2.61 3.01 -1.02 -4.91 117.46 113.18 2jt4 n PHE 60 Ca 0.00 0.05 -0.36 0.00 1.01 0.00 0.00 57.45 58.15 2jt4 n PHE 60 Cb 0.03 -0.38 -0.10 0.00 -0.01 0.00 0.00 39.48 39.03 2jt4 n PHE 60 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 2jt4 s ILE 61 N -3.22 5.04 -0.33 4.37 -1.09 -0.86 -0.08 121.20 125.04 2jt4 s ILE 61 Ca 0.02 0.07 -0.04 0.00 -2.23 0.00 0.00 60.65 58.47 2jt4 s ILE 61 Cb 0.15 -3.33 0.05 0.00 -1.58 0.00 0.00 42.46 37.75 2jt4 s ILE 61 CO 0.83 0.38 0.06 -0.70 -1.23 0.00 0.00 174.94 174.29 2jt4 s GLU 62 N 0.90 2.46 0.32 2.79 2.56 0.46 -4.92 118.70 123.28 2jt4 s GLU 62 Ca 0.06 -1.29 -0.29 0.00 0.00 0.00 0.00 54.97 53.45 2jt4 s GLU 62 Cb -0.13 -3.33 -0.11 0.00 2.00 0.00 0.00 34.13 32.56 2jt4 s GLU 62 CO 0.03 -0.68 1.57 -2.14 -0.56 0.00 0.00 175.26 173.48 2jt4 s PRO 63 N 1.30 4.10 0.02 4.30 0.02 -1.26 -0.01 135.00 143.47 2jt4 s PRO 63 Ca -0.03 2.60 0.12 0.00 0.02 0.00 0.00 61.00 63.72 2jt4 s PRO 63 Cb -0.20 -3.00 -0.20 0.00 0.02 0.00 0.00 34.50 31.12 2jt4 s PRO 63 CO 0.00 -0.62 0.84 -0.39 -0.33 0.00 0.00 177.00 176.50 2jt4 h VAL 64 N 3.25 0.96 -0.34 3.83 -1.51 -1.33 -3.44 116.25 117.66 2jt4 h VAL 64 Ca -0.48 -2.70 -0.08 0.00 -1.23 0.00 0.00 66.70 62.20 2jt4 h VAL 64 Cb 1.23 2.44 -0.15 0.00 -2.13 0.00 0.00 31.29 32.68 2jt4 h VAL 64 CO 0.75 0.54 -0.26 -1.14 -1.23 0.00 0.00 177.57 176.23 2jt4 n ARG 65 N -3.09 0.33 0.03 5.19 3.00 -1.26 -5.04 116.66 115.82 2jt4 n ARG 65 Ca -0.12 -1.25 -0.02 0.00 -0.00 0.00 0.00 57.85 56.47 2jt4 n ARG 65 Cb 0.98 -0.62 -0.01 0.00 0.00 0.00 0.00 32.46 32.82 2jt4 n ARG 65 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 2jt4 n ASP 66 N 2.32 1.12 -3.19 6.15 9.92 -1.26 -4.77 116.55 126.84 2jt4 n ASP 66 Ca 0.11 0.15 -0.17 0.00 -0.53 0.00 0.00 54.79 54.35 2jt4 n ASP 66 Cb 0.63 -0.36 0.01 0.00 -0.64 0.00 0.00 41.12 40.77 2jt4 n ASP 66 CO 0.00 0.00 0.00 1.17 0.13 0.00 0.00 177.20 178.50 2jt4 n LYS 67 N -3.57 -1.96 -2.49 -1.24 4.81 -1.26 -4.93 118.16 107.52 2jt4 n LYS 67 Ca -0.03 1.65 -0.35 0.00 -0.87 0.00 0.00 58.31 58.71 2jt4 n LYS 67 Cb 0.13 -4.28 -0.03 0.00 0.02 0.00 0.00 35.03 30.87 2jt4 n LYS 67 CO 0.00 0.00 0.00 0.15 1.17 0.00 0.00 177.40 178.72 2jt4 s LYS 68 N -2.94 3.77 -0.15 1.64 1.02 -1.26 -4.98 119.74 116.83 2jt4 s LYS 68 Ca 0.21 1.44 -0.11 0.00 0.02 0.00 0.00 55.97 57.53 2jt4 s LYS 68 Cb -0.04 -2.15 -0.05 0.00 -0.52 0.00 0.00 37.83 35.07 2jt4 s LYS 68 CO 0.81 -0.47 -0.14 0.72 -0.92 0.00 0.00 175.35 175.35 2jt4 n HIS 69 N -0.89 0.89 -3.81 3.18 8.25 -1.26 -5.03 115.22 116.55 2jt4 n HIS 69 Ca 0.09 0.39 -0.09 0.00 -0.26 0.00 0.00 57.72 57.84 2jt4 n HIS 69 Cb 0.52 -0.80 -0.07 0.00 1.12 0.00 0.00 29.99 30.76 2jt4 n HIS 69 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 2jt4 s THR 70 N -2.29 0.12 0.00 1.59 -4.23 -1.26 -5.32 115.64 104.25 2jt4 s THR 70 Ca -0.17 -1.02 0.00 0.00 -1.18 0.00 0.00 61.69 59.31 2jt4 s THR 70 Cb 0.03 -1.27 0.00 0.00 1.34 0.00 0.00 72.50 72.60 2jt4 s THR 70 CO 0.28 -0.57 0.39 -1.84 -0.54 0.00 0.00 174.62 172.34