#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2v47 n VAL 3 N 0.00 0.00 0.88 5.15 0.31 -1.26 -4.66 118.33 118.75 2v47 n VAL 3 Ca 0.00 0.00 0.04 0.00 -0.01 0.00 0.00 64.34 64.37 2v47 n VAL 3 Cb 0.00 -0.25 0.14 0.00 -0.91 0.00 0.00 33.84 32.82 2v47 n VAL 3 CO 0.00 0.00 0.00 2.29 -1.32 0.00 0.00 176.83 177.80 2v47 n LYS 4 N -2.00 1.88 -1.73 5.55 2.85 -1.26 -4.95 118.16 118.50 2v47 n LYS 4 Ca 0.00 -1.10 -0.38 0.00 -1.05 0.00 0.00 58.31 55.78 2v47 n LYS 4 Cb 0.00 -1.36 0.05 0.00 -0.65 0.00 0.00 35.03 33.07 2v47 n LYS 4 CO 0.00 0.00 0.00 -1.33 -0.05 0.00 0.00 177.40 176.02 2v47 n MET 5 N 0.34 1.53 0.00 -1.58 2.81 -1.26 -5.01 117.12 113.94 2v47 n MET 5 Ca 0.10 0.57 0.00 0.00 -1.81 0.00 0.00 57.70 56.56 2v47 n MET 5 Cb 0.33 -2.53 0.00 0.00 -0.71 0.00 0.00 33.22 30.32 2v47 n MET 5 CO 0.00 0.00 0.00 -2.39 1.51 0.00 0.00 175.97 175.09 2v47 n HIS 6 N -1.22 0.00 0.00 2.03 1.44 -1.26 -5.13 115.22 111.07 2v47 n HIS 6 Ca 0.12 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.83 2v47 n HIS 6 Cb 0.45 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.56 2v47 n HIS 6 CO 0.00 0.00 0.00 1.33 -2.81 0.00 0.00 176.34 174.86 2v47 n VAL 7 N 0.00 0.00 -0.22 0.61 0.24 -1.26 -5.05 118.33 112.64 2v47 n VAL 7 Ca 0.00 0.00 -0.22 0.00 -2.04 0.00 0.00 64.34 62.08 2v47 n VAL 7 Cb 0.00 0.00 0.21 0.00 -1.47 0.00 0.00 33.84 32.58 2v47 n VAL 7 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 2v47 n LYS 8 N 0.00 -3.65 0.00 7.34 4.01 -1.26 -5.11 118.16 119.49 2v47 n LYS 8 Ca 0.00 -1.05 0.00 0.00 -0.51 0.00 0.00 58.31 56.75 2v47 n LYS 8 Cb 0.00 -1.46 0.00 0.00 -0.51 0.00 0.00 35.03 33.06 2v47 n LYS 8 CO 0.00 0.00 0.00 0.36 -1.11 0.00 0.00 177.40 176.65 2v47 n LYS 9 N -4.26 0.00 -1.77 1.97 2.85 -1.26 -5.01 118.16 110.68 2v47 n LYS 9 Ca 0.10 0.00 -0.22 0.00 -1.05 0.00 0.00 58.31 57.14 2v47 n LYS 9 Cb 0.43 0.00 -0.06 0.00 -0.65 0.00 0.00 35.03 34.76 2v47 n LYS 9 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 177.40 177.55 2v47 s GLY 10 N 0.00 -0.37 0.00 2.58 0.00 -1.26 -4.39 107.32 103.88 2v47 s GLY 10 Ca 0.00 -0.94 0.00 0.00 0.00 0.00 0.00 44.72 43.78 2v47 s GLY 10 CO 0.00 3.91 0.00 2.09 0.00 0.00 0.00 173.10 179.10 2v47 n ASP 11 N 16.35 0.06 -4.67 1.64 5.68 -1.26 -4.94 116.55 129.40 2v47 n ASP 11 Ca 0.41 0.00 -0.42 0.00 -0.50 0.00 0.00 54.79 54.28 2v47 n ASP 11 Cb 0.46 0.00 -0.03 0.00 -1.14 0.00 0.00 41.12 40.42 2v47 n ASP 11 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 2v47 s THR 12 N -0.84 4.76 0.14 2.12 2.01 -1.26 -2.13 115.64 120.44 2v47 s THR 12 Ca 0.00 1.95 0.04 0.00 0.31 0.00 0.00 61.69 63.99 2v47 s THR 12 Cb 0.00 -4.27 -0.04 0.00 0.01 0.00 0.00 72.50 68.19 2v47 s THR 12 CO 0.00 -0.07 -0.09 -0.69 -0.69 0.00 0.00 174.62 173.09 2v47 s VAL 13 N 2.53 1.05 0.26 3.82 1.01 -0.54 -4.52 120.40 124.02 2v47 s VAL 13 Ca 0.44 -2.03 0.07 0.00 0.00 0.00 0.00 61.98 60.46 2v47 s VAL 13 Cb -0.17 -1.85 -0.05 0.00 0.00 0.00 0.00 36.38 34.31 2v47 s VAL 13 CO 0.12 -0.74 -0.08 -0.22 0.00 0.00 0.00 175.10 174.17 2v47 s LEU 14 N -3.15 2.50 0.00 3.92 2.96 0.43 -0.30 118.68 125.05 2v47 s LEU 14 Ca 0.17 -1.15 0.02 0.00 -0.22 0.00 0.00 54.13 52.95 2v47 s LEU 14 Cb 0.03 -0.66 0.02 0.00 0.50 0.00 0.00 46.19 46.08 2v47 s LEU 14 CO 0.00 -0.29 0.14 0.52 -1.32 0.00 0.00 176.35 175.40 2v47 n VAL 15 N -0.54 0.00 0.00 1.68 0.31 -1.08 0.36 118.33 119.06 2v47 n VAL 15 Ca -0.06 -0.67 0.00 0.00 -0.01 0.00 0.00 64.34 63.60 2v47 n VAL 15 Cb 0.63 -0.41 0.00 0.00 -0.91 0.00 0.00 33.84 33.14 2v47 n VAL 15 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2v47 n ALA 16 N -2.66 0.00 -1.20 3.52 0.00 0.44 -3.88 120.51 116.73 2v47 n ALA 16 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.39 2v47 n ALA 16 Cb 0.19 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.64 2v47 n ALA 16 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2v47 n SER 17 N 0.00 0.00 0.00 0.00 3.41 -1.25 -4.82 113.62 110.96 2v47 n SER 17 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2v47 n SER 17 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 2v47 n SER 17 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2v47 n GLY 18 N 5.00 0.63 0.00 5.00 0.00 -1.26 -4.15 105.19 110.41 2v47 n GLY 18 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.01 2v47 n GLY 18 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2v47 n LYS 19 N 0.00 0.00 -0.29 1.61 4.81 -1.26 0.01 118.16 123.04 2v47 n LYS 19 Ca 0.00 0.18 0.00 0.00 -0.87 0.00 0.00 58.31 57.62 2v47 n LYS 19 Cb 0.00 -1.56 0.00 0.00 0.02 0.00 0.00 35.03 33.49 2v47 n LYS 19 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 2v47 n TYR 20 N -1.11 0.00 -1.48 5.64 4.02 -1.26 -4.98 117.16 117.99 2v47 n TYR 20 Ca 0.00 -0.03 -0.43 0.00 -0.01 0.00 0.00 57.90 57.42 2v47 n TYR 20 Cb 0.06 -0.03 -0.10 0.00 -0.02 0.00 0.00 39.34 39.24 2v47 n TYR 20 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 176.86 177.02 2v47 n LYS 21 N -0.05 0.43 -0.44 -0.72 3.00 0.10 -4.05 118.16 116.42 2v47 n LYS 21 Ca 0.00 0.04 0.00 0.00 -0.00 0.00 0.00 58.31 58.36 2v47 n LYS 21 Cb 0.61 -2.14 0.00 0.00 0.00 0.00 0.00 35.03 33.51 2v47 n LYS 21 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2v47 n GLY 22 N 6.48 -2.52 0.00 3.14 0.00 -1.25 -4.79 105.19 106.25 2v47 n GLY 22 Ca 0.54 -0.84 0.00 0.00 0.00 0.00 0.00 46.02 45.71 2v47 n GLY 22 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2v47 n ARG 23 N 0.64 0.00 -3.23 1.61 1.74 -1.26 -4.86 116.66 111.30 2v47 n ARG 23 Ca 0.00 0.00 -0.39 0.00 -0.77 0.00 0.00 57.85 56.69 2v47 n ARG 23 Cb 0.00 0.00 -0.06 0.00 -1.02 0.00 0.00 32.46 31.38 2v47 n ARG 23 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2v47 s VAL 24 N -1.89 4.92 0.02 1.55 1.01 -1.26 -2.63 120.40 122.12 2v47 s VAL 24 Ca 0.00 1.21 0.02 0.00 0.00 0.00 0.00 61.98 63.21 2v47 s VAL 24 Cb 0.00 -3.91 -0.02 0.00 0.00 0.00 0.00 36.38 32.45 2v47 s VAL 24 CO 0.00 0.43 -0.08 -0.83 0.00 0.00 0.00 175.10 174.62 2v47 s GLY 25 N -0.23 0.45 0.00 4.51 0.00 0.59 -4.95 107.32 107.69 2v47 s GLY 25 Ca 0.30 -0.55 0.00 0.00 0.00 0.00 0.00 44.72 44.47 2v47 s GLY 25 CO 0.17 -0.55 0.00 1.17 0.00 0.00 0.00 173.10 173.88 2v47 n LYS 26 N 2.16 0.49 -1.62 2.90 4.81 -1.26 -1.47 118.16 124.17 2v47 n LYS 26 Ca -0.18 0.00 -0.40 0.00 -0.87 0.00 0.00 58.31 56.86 2v47 n LYS 26 Cb 0.56 0.00 0.03 0.00 0.02 0.00 0.00 35.03 35.64 2v47 n LYS 26 CO 0.00 0.00 0.00 0.28 1.17 0.00 0.00 177.40 178.85 2v47 n VAL 27 N -1.02 2.87 -0.48 3.15 0.31 -0.91 -4.26 118.33 117.99 2v47 n VAL 27 Ca 0.00 -0.50 0.09 0.00 -0.01 0.00 0.00 64.34 63.92 2v47 n VAL 27 Cb 0.00 -1.22 0.29 0.00 -0.91 0.00 0.00 33.84 32.00 2v47 n VAL 27 CO 0.00 0.00 0.00 2.29 -1.32 0.00 0.00 176.83 177.80 2v47 n LYS 28 N -0.26 3.18 -2.77 5.55 -0.00 -1.26 -3.86 118.16 118.73 2v47 n LYS 28 Ca 0.10 -2.62 -0.13 0.00 -0.00 0.00 0.00 58.31 55.66 2v47 n LYS 28 Cb 0.42 -1.65 0.01 0.00 -0.00 0.00 0.00 35.03 33.82 2v47 n LYS 28 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 2v47 n GLU 29 N 0.95 -0.75 -1.44 -1.58 4.71 -1.26 -1.29 120.64 119.98 2v47 n GLU 29 Ca 0.21 0.82 -0.42 0.00 -0.01 0.00 0.00 57.16 57.76 2v47 n GLU 29 Cb 0.70 -1.10 0.00 0.00 -1.01 0.00 0.00 31.44 30.04 2v47 n GLU 29 CO 0.00 0.00 0.00 0.28 0.09 0.00 0.00 177.13 177.50 2v47 n VAL 30 N 0.60 1.67 0.00 2.62 0.31 -1.26 -4.39 118.33 117.88 2v47 n VAL 30 Ca -0.03 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.80 2v47 n VAL 30 Cb 0.46 -0.48 0.00 0.00 -0.91 0.00 0.00 33.84 32.91 2v47 n VAL 30 CO 0.00 0.00 0.00 -0.11 -1.32 0.00 0.00 176.83 175.40 2v47 n LEU 31 N 1.42 0.12 -0.00 7.52 -0.00 0.11 -4.95 117.00 121.23 2v47 n LEU 31 Ca 0.12 0.21 0.07 0.00 -0.00 0.00 0.00 56.01 56.40 2v47 n LEU 31 Cb 0.39 0.00 -0.08 0.00 -0.00 0.00 0.00 43.42 43.73 2v47 n LEU 31 CO 0.55 0.00 -0.05 -0.81 -0.00 0.00 0.00 177.39 177.08 2v47 n PRO 32 N -0.23 2.36 0.00 1.96 -0.04 -1.26 -4.88 135.00 132.90 2v47 n PRO 32 Ca 0.00 -0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 2v47 n PRO 32 Cb 0.00 -1.16 0.00 0.00 -0.04 0.00 0.00 33.50 32.30 2v47 n PRO 32 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 2v47 n LYS 33 N -1.35 0.00 0.28 0.54 4.81 -1.26 0.85 118.16 122.03 2v47 n LYS 33 Ca 0.02 0.94 0.18 0.00 -0.87 0.00 0.00 58.31 58.59 2v47 n LYS 33 Cb 0.22 -1.45 0.88 0.00 0.02 0.00 0.00 35.03 34.70 2v47 n LYS 33 CO 0.00 0.00 0.00 0.87 1.17 0.00 0.00 177.40 179.44 2v47 h LYS 34 N 0.00 0.00 -1.88 1.64 1.57 -2.00 -3.46 116.57 112.44 2v47 h LYS 34 Ca 0.00 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.75 2v47 h LYS 34 Cb 0.00 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.32 2v47 h LYS 34 CO 0.00 0.00 -0.06 0.98 -0.57 0.00 0.00 179.45 179.80 2v47 n TYR 35 N -2.91 -0.19 -4.60 -1.35 9.36 0.25 -5.00 117.16 112.71 2v47 n TYR 35 Ca -0.01 0.08 -0.29 0.00 3.32 0.00 0.00 57.90 61.00 2v47 n TYR 35 Cb 0.17 -1.83 -0.08 0.00 -0.63 0.00 0.00 39.34 36.98 2v47 n TYR 35 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2v47 s ALA 36 N -3.03 3.38 0.00 2.98 0.00 -1.26 -2.44 121.76 121.40 2v47 s ALA 36 Ca 0.02 -0.84 0.00 0.00 0.00 0.00 0.00 51.96 51.14 2v47 s ALA 36 Cb -0.01 0.54 0.00 0.00 0.00 0.00 0.00 23.12 23.65 2v47 s ALA 36 CO 0.06 -0.25 0.00 1.33 0.00 0.00 0.00 175.76 176.90 2v47 n VAL 37 N -1.06 0.00 0.00 0.00 0.24 0.73 0.06 118.33 118.31 2v47 n VAL 37 Ca -0.11 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.19 2v47 n VAL 37 Cb 0.65 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 33.02 2v47 n VAL 37 CO 0.00 0.00 0.00 -0.38 -2.14 0.00 0.00 176.83 174.31 2v47 n ILE 38 N 0.00 0.00 0.00 1.34 5.41 0.30 -4.25 119.36 122.16 2v47 n ILE 38 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.75 2v47 n ILE 38 Cb 0.00 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 38.93 2v47 n ILE 38 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 176.55 177.07 2v47 n VAL 39 N 0.00 0.00 -1.28 1.39 0.31 -1.20 -3.75 118.33 113.80 2v47 n VAL 39 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 2v47 n VAL 39 Cb 0.00 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 32.93 2v47 n VAL 39 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2v47 n GLU 40 N 0.79 0.00 0.00 5.55 -0.58 -1.26 -4.45 120.64 120.70 2v47 n GLU 40 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 2v47 n GLU 40 Cb 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 30.87 2v47 n GLU 40 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2v47 n GLY 41 N 0.00 1.21 3.69 0.62 0.00 -1.25 -4.92 105.19 104.54 2v47 n GLY 41 Ca 0.00 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.58 2v47 n GLY 41 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2v47 n VAL 42 N 0.00 0.13 -1.73 1.61 0.31 -1.26 -4.88 118.33 112.51 2v47 n VAL 42 Ca 0.00 -0.02 0.00 0.00 -0.01 0.00 0.00 64.34 64.31 2v47 n VAL 42 Cb 0.00 -1.83 0.00 0.00 -0.91 0.00 0.00 33.84 31.10 2v47 n VAL 42 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 2v47 n ASN 43 N 4.36 0.00 -0.90 4.52 4.13 -1.26 0.15 115.26 126.25 2v47 n ASN 43 Ca 0.17 -1.60 -0.08 0.00 1.68 0.00 0.00 54.58 54.75 2v47 n ASN 43 Cb 0.32 -0.12 0.01 0.00 -1.54 0.00 0.00 39.78 38.45 2v47 n ASN 43 CO 0.00 0.00 0.00 -0.38 0.28 0.00 0.00 177.26 177.16 2v47 n ILE 44 N 0.00 0.00 -4.99 2.41 5.41 -1.26 -3.99 119.36 116.94 2v47 n ILE 44 Ca 0.00 -0.11 -0.32 0.00 1.00 0.00 0.00 62.75 63.31 2v47 n ILE 44 Cb 0.62 0.00 -0.15 0.00 -0.71 0.00 0.00 39.64 39.40 2v47 n ILE 44 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 2v47 s VAL 45 N -0.45 2.67 0.00 1.39 1.01 -1.26 -4.39 120.40 119.37 2v47 s VAL 45 Ca 0.10 -0.83 0.00 0.00 0.00 0.00 0.00 61.98 61.25 2v47 s VAL 45 Cb -0.05 -2.06 0.00 0.00 0.00 0.00 0.00 36.38 34.27 2v47 s VAL 45 CO 0.18 0.56 0.00 2.29 0.00 0.00 0.00 175.10 178.13 2v47 n LYS 46 N 3.07 2.70 -2.94 2.72 2.85 -1.26 -5.09 118.16 120.21 2v47 n LYS 46 Ca -0.18 0.00 -0.25 0.00 -1.05 0.00 0.00 58.31 56.84 2v47 n LYS 46 Cb 0.52 0.00 -0.03 0.00 -0.65 0.00 0.00 35.03 34.87 2v47 n LYS 46 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 2v47 n LYS 47 N -0.13 2.72 -1.66 -1.58 4.01 -1.26 -4.83 118.16 115.42 2v47 n LYS 47 Ca 0.00 -4.47 -0.48 0.00 -0.51 0.00 0.00 58.31 52.85 2v47 n LYS 47 Cb 0.00 -2.10 -0.05 0.00 -0.51 0.00 0.00 35.03 32.37 2v47 n LYS 47 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2v47 n ALA 48 N -0.15 0.84 0.00 7.82 0.00 -1.15 -4.85 120.51 123.02 2v47 n ALA 48 Ca 0.30 0.42 0.00 0.00 0.00 0.00 0.00 53.44 54.16 2v47 n ALA 48 Cb 0.48 -2.33 0.00 0.00 0.00 0.00 0.00 19.45 17.60 2v47 n ALA 48 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2v47 n VAL 49 N 3.68 0.00 0.00 0.00 0.31 -1.26 -3.14 118.33 117.92 2v47 n VAL 49 Ca 0.19 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.52 2v47 n VAL 49 Cb 0.27 -0.43 0.00 0.00 -0.91 0.00 0.00 33.84 32.77 2v47 n VAL 49 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 2v47 n ARG 50 N -1.20 0.00 -0.12 5.55 1.74 -1.26 -3.93 116.66 117.45 2v47 n ARG 50 Ca 0.00 0.00 -0.10 0.00 -0.77 0.00 0.00 57.85 56.98 2v47 n ARG 50 Cb 0.22 0.00 0.03 0.00 -1.02 0.00 0.00 32.46 31.69 2v47 n ARG 50 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 2v47 h VAL 51 N 0.00 1.27 -1.44 1.55 2.07 -2.03 -3.37 116.25 114.31 2v47 h VAL 51 Ca 0.00 -1.43 -0.46 0.00 0.82 0.00 0.00 66.70 65.63 2v47 h VAL 51 Cb 0.00 1.24 -0.31 0.00 -1.52 0.00 0.00 31.29 30.70 2v47 h VAL 51 CO 0.00 0.48 -0.91 -1.54 0.02 0.00 0.00 177.57 175.62 2v47 n SER 52 N -4.09 -0.84 -4.56 0.57 3.41 -1.26 -5.11 113.62 101.74 2v47 n SER 52 Ca -0.01 -2.85 -0.20 0.00 -0.26 0.00 0.00 58.87 55.55 2v47 n SER 52 Cb 0.48 0.12 -0.06 0.00 -0.26 0.00 0.00 64.21 64.49 2v47 n SER 52 CO 0.00 0.00 0.00 -2.65 -0.16 0.00 0.00 175.04 172.23 2v47 n PRO 53 N 1.62 0.71 -2.20 4.33 -0.02 -1.26 -4.98 135.00 133.19 2v47 n PRO 53 Ca 0.18 -0.58 -0.36 0.00 -2.02 0.00 0.00 63.50 60.72 2v47 n PRO 53 Cb 0.56 -3.62 0.00 0.00 -0.02 0.00 0.00 33.50 30.42 2v47 n PRO 53 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 2v47 s LYS 54 N 8.73 3.41 0.14 -0.52 2.20 -1.26 -4.51 119.74 127.93 2v47 s LYS 54 Ca 0.95 1.72 0.00 0.00 -0.36 0.00 0.00 55.97 58.27 2v47 s LYS 54 Cb -0.15 -2.12 0.00 0.00 -1.51 0.00 0.00 37.83 34.05 2v47 s LYS 54 CO 0.14 -0.83 0.00 2.48 -0.36 0.00 0.00 175.35 176.78 2v47 n TYR 55 N -1.10 -2.38 0.00 4.03 0.18 -1.26 -4.87 117.16 111.76 2v47 n TYR 55 Ca 0.11 1.35 0.00 0.00 1.88 0.00 0.00 57.90 61.23 2v47 n TYR 55 Cb 0.50 -2.02 0.00 0.00 -0.38 0.00 0.00 39.34 37.43 2v47 n TYR 55 CO 0.00 0.00 0.00 -2.30 -2.08 0.00 0.00 176.86 172.48 2v47 n PRO 56 N 1.18 0.00 -1.43 -3.48 -0.02 -1.26 -4.72 135.00 125.26 2v47 n PRO 56 Ca 0.00 0.00 -0.29 0.00 -2.02 0.00 0.00 63.50 61.19 2v47 n PRO 56 Cb 0.00 0.00 0.17 0.00 -0.02 0.00 0.00 33.50 33.65 2v47 n PRO 56 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 2v47 s GLN 57 N 0.00 0.51 0.00 -0.52 -0.21 -1.26 -4.85 119.66 113.33 2v47 s GLN 57 Ca 0.00 0.18 0.00 0.00 0.02 0.00 0.00 55.36 55.56 2v47 s GLN 57 Cb 0.00 -1.78 0.00 0.00 1.00 0.00 0.00 33.01 32.23 2v47 s GLN 57 CO 0.00 -2.60 0.00 0.41 -2.12 0.00 0.00 175.29 170.98 2v47 n GLY 58 N -1.96 -0.13 3.51 3.09 0.00 -1.25 -5.02 105.19 103.44 2v47 n GLY 58 Ca 0.08 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.95 2v47 n GLY 58 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2v47 s GLY 59 N -1.26 -0.50 0.00 -0.02 0.00 -1.19 -5.02 107.32 99.33 2v47 s GLY 59 Ca 0.00 1.49 0.00 0.00 0.00 0.00 0.00 44.72 46.21 2v47 s GLY 59 CO 0.00 1.20 0.00 0.33 0.00 0.00 0.00 173.10 174.63 2v47 n PHE 60 N 1.84 0.00 0.24 1.90 -0.00 -1.26 -2.95 117.46 117.24 2v47 n PHE 60 Ca -0.17 0.00 0.12 0.00 -0.00 0.00 0.00 57.45 57.41 2v47 n PHE 60 Cb 0.56 0.00 0.54 0.00 -0.00 0.00 0.00 39.48 40.58 2v47 n PHE 60 CO 0.00 0.00 0.00 0.82 -0.00 0.00 0.00 176.76 177.58 2v47 h ILE 61 N 0.00 0.36 -1.54 -2.13 2.04 -1.97 -3.44 117.51 110.83 2v47 h ILE 61 Ca 0.00 -0.90 0.18 0.00 1.00 0.00 0.00 64.86 65.14 2v47 h ILE 61 Cb 0.01 1.67 -0.05 0.00 -0.74 0.00 0.00 36.82 37.71 2v47 h ILE 61 CO 0.00 0.14 -0.24 -0.62 0.00 0.00 0.00 178.15 177.43 2v47 n GLU 62 N -3.30 -1.33 -2.96 2.37 4.71 -1.26 -4.85 120.64 114.03 2v47 n GLU 62 Ca 0.00 0.88 -0.08 0.00 -0.01 0.00 0.00 57.16 57.95 2v47 n GLU 62 Cb 0.38 -1.63 -0.03 0.00 -1.01 0.00 0.00 31.44 29.15 2v47 n GLU 62 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 2v47 n LYS 63 N -2.49 0.19 -0.88 3.49 5.02 -1.26 -5.08 118.16 117.16 2v47 n LYS 63 Ca 0.00 -1.45 -0.37 0.00 -2.02 0.00 0.00 58.31 54.48 2v47 n LYS 63 Cb 0.30 1.20 0.08 0.00 -0.02 0.00 0.00 35.03 36.60 2v47 n LYS 63 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2v47 n GLU 64 N -0.28 -0.60 -3.72 1.97 4.71 -1.26 -4.22 120.64 117.24 2v47 n GLU 64 Ca 0.03 -0.17 -0.28 0.00 -0.01 0.00 0.00 57.16 56.73 2v47 n GLU 64 Cb 0.26 -1.25 -0.16 0.00 -1.01 0.00 0.00 31.44 29.28 2v47 n GLU 64 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2v47 s ALA 65 N -2.08 1.05 0.00 0.62 0.00 0.39 -4.70 121.76 117.04 2v47 s ALA 65 Ca 0.43 -0.85 0.00 0.00 0.00 0.00 0.00 51.96 51.54 2v47 s ALA 65 Cb 0.03 -1.25 0.00 0.00 0.00 0.00 0.00 23.12 21.90 2v47 s ALA 65 CO 0.66 -1.27 0.00 -2.30 0.00 0.00 0.00 175.76 172.85 2v47 n PRO 66 N 5.03 0.00 -2.03 0.00 -0.02 -1.26 -4.62 135.00 132.10 2v47 n PRO 66 Ca -0.08 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.40 2v47 n PRO 66 Cb 0.46 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.94 2v47 n PRO 66 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 2v47 n LEU 67 N -0.44 -5.00 -4.42 2.45 7.94 -1.26 -0.54 117.00 115.73 2v47 n LEU 67 Ca 0.00 2.90 -0.36 0.00 -1.11 0.00 0.00 56.01 57.45 2v47 n LEU 67 Cb 0.00 -2.90 0.07 0.00 0.53 0.00 0.00 43.42 41.13 2v47 n LEU 67 CO 0.00 -1.64 -0.08 1.57 -1.11 0.00 0.00 177.39 176.13 2v47 n HIS 68 N 1.90 -1.29 -2.06 1.96 -0.00 -1.26 0.26 115.22 114.73 2v47 n HIS 68 Ca 0.00 0.31 -0.36 0.00 -0.00 0.00 0.00 57.72 57.67 2v47 n HIS 68 Cb 0.00 -1.85 0.03 0.00 -0.00 0.00 0.00 29.99 28.17 2v47 n HIS 68 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2v47 n ALA 69 N -2.57 6.10 0.00 1.57 0.00 -1.02 -4.06 120.51 120.53 2v47 n ALA 69 Ca 0.09 -4.15 0.00 0.00 0.00 0.00 0.00 53.44 49.37 2v47 n ALA 69 Cb 0.51 -1.57 0.00 0.00 0.00 0.00 0.00 19.45 18.39 2v47 n ALA 69 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2v47 n SER 70 N -0.54 2.08 -0.47 0.00 2.88 -1.26 -4.71 113.62 111.59 2v47 n SER 70 Ca 0.50 0.00 0.11 0.00 -1.33 0.00 0.00 58.87 58.15 2v47 n SER 70 Cb 0.37 0.27 0.41 0.00 -0.75 0.00 0.00 64.21 64.51 2v47 n SER 70 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 2v47 n LYS 71 N -0.98 1.63 -3.81 -1.46 5.02 -1.26 -4.87 118.16 112.43 2v47 n LYS 71 Ca 0.00 -0.94 -0.32 0.00 -2.02 0.00 0.00 58.31 55.03 2v47 n LYS 71 Cb 0.15 -1.39 -0.05 0.00 -0.02 0.00 0.00 35.03 33.72 2v47 n LYS 71 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 2v47 s VAL 72 N -1.83 5.30 0.05 -0.18 -7.23 -1.26 -0.42 120.40 114.83 2v47 s VAL 72 Ca 0.32 -0.11 0.05 0.00 -1.81 0.00 0.00 61.98 60.42 2v47 s VAL 72 Cb 0.17 -3.61 -0.02 0.00 0.56 0.00 0.00 36.38 33.48 2v47 s VAL 72 CO 0.26 0.17 -0.13 -0.13 -0.31 0.00 0.00 175.10 174.96 2v47 s ARG 73 N -2.34 0.85 0.00 4.82 0.52 0.16 -4.89 118.95 118.05 2v47 s ARG 73 Ca 0.35 -0.80 0.00 0.00 -0.52 0.00 0.00 55.73 54.75 2v47 s ARG 73 Cb -0.13 -0.83 0.00 0.00 0.52 0.00 0.00 34.95 34.51 2v47 s ARG 73 CO 0.24 0.20 0.00 -0.35 0.02 0.00 0.00 175.30 175.40 2v47 n PRO 74 N 1.69 0.00 0.00 3.54 -0.04 -1.26 0.16 135.00 139.09 2v47 n PRO 74 Ca -0.19 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.27 2v47 n PRO 74 Cb 0.55 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.01 2v47 n PRO 74 CO 0.00 0.00 0.00 1.51 -0.04 0.00 0.00 175.50 176.97 2v47 n ILE 75 N 0.00 0.00 -2.01 0.52 0.00 -0.80 -3.57 119.36 113.50 2v47 n ILE 75 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62.75 62.75 2v47 n ILE 75 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39.64 39.64 2v47 n ILE 75 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2v47 n PRO 77 N 0.00 0.05 0.00 0.00 -0.02 -1.26 -4.21 135.00 129.56 2v47 n PRO 77 Ca 0.00 -1.27 0.00 0.00 -2.02 0.00 0.00 63.50 60.21 2v47 n PRO 77 Cb 0.00 -3.13 0.00 0.00 -0.02 0.00 0.00 33.50 30.35 2v47 n PRO 77 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2v47 n ALA 78 N 14.70 0.00 -3.46 3.55 0.00 -1.26 -5.10 120.51 128.94 2v47 n ALA 78 Ca 0.37 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.69 2v47 n ALA 78 Cb 0.45 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.91 2v47 n ALA 78 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2v47 h GLY 80 N 0.22 -1.14 -2.47 0.00 0.00 -1.89 -3.20 103.07 94.58 2v47 h GLY 80 Ca -0.15 0.52 0.00 0.00 0.00 0.00 0.00 47.33 47.70 2v47 h GLY 80 CO 0.23 -0.39 -0.60 1.17 0.00 0.00 0.00 176.54 176.94 2v47 n LYS 81 N -3.14 -3.08 -0.73 4.80 4.81 -1.26 -1.90 118.16 117.66 2v47 n LYS 81 Ca -0.02 2.27 -0.33 0.00 -0.87 0.00 0.00 58.31 59.36 2v47 n LYS 81 Cb 0.10 -2.54 0.15 0.00 0.02 0.00 0.00 35.03 32.76 2v47 n LYS 81 CO 0.00 0.00 0.00 -2.30 1.17 0.00 0.00 177.40 176.27 2v47 n PRO 82 N -0.64 -1.11 -4.08 1.64 -0.02 -1.26 -4.68 135.00 124.85 2v47 n PRO 82 Ca 0.00 -0.30 -0.23 0.00 -2.02 0.00 0.00 63.50 60.95 2v47 n PRO 82 Cb 0.00 -1.71 -0.06 0.00 -0.02 0.00 0.00 33.50 31.70 2v47 n PRO 82 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 2v47 s THR 83 N -2.27 2.92 0.00 3.45 2.01 -1.26 -2.50 115.64 117.99 2v47 s THR 83 Ca 0.55 -1.68 0.00 0.00 0.31 0.00 0.00 61.69 60.87 2v47 s THR 83 Cb -0.14 -2.98 0.00 0.00 0.01 0.00 0.00 72.50 69.39 2v47 s THR 83 CO 0.67 -0.15 0.00 0.54 -0.69 0.00 0.00 174.62 174.99 2v47 n ARG 84 N -1.17 0.00 -3.62 4.92 1.74 -1.22 -4.88 116.66 112.43 2v47 n ARG 84 Ca -0.03 0.00 -0.11 0.00 -0.77 0.00 0.00 57.85 56.94 2v47 n ARG 84 Cb 0.62 0.00 -0.05 0.00 -1.02 0.00 0.00 32.46 32.01 2v47 n ARG 84 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2v47 s VAL 85 N -2.91 0.06 0.00 1.55 1.01 -1.26 -2.90 120.40 115.95 2v47 s VAL 85 Ca 0.00 -0.48 0.00 0.00 0.00 0.00 0.00 61.98 61.50 2v47 s VAL 85 Cb 0.00 -1.10 0.00 0.00 0.00 0.00 0.00 36.38 35.28 2v47 s VAL 85 CO 0.00 -0.27 0.00 -1.14 0.00 0.00 0.00 175.10 173.69 2v47 n ARG 86 N -0.05 0.00 0.00 2.72 0.63 -1.24 -4.92 116.66 113.80 2v47 n ARG 86 Ca -0.17 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.76 2v47 n ARG 86 Cb 0.63 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.54 2v47 n ARG 86 CO 0.00 0.00 0.00 0.36 -2.51 0.00 0.00 177.63 175.48 2v47 n LYS 87 N 0.00 0.00 -0.73 -0.14 2.85 -1.25 -4.77 118.16 114.12 2v47 n LYS 87 Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 2v47 n LYS 87 Cb 0.00 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.38 2v47 n LYS 87 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 2v47 n LYS 88 N -1.69 -0.10 -2.10 -1.58 4.01 -1.26 1.00 118.16 116.43 2v47 n LYS 88 Ca 0.00 0.02 -0.00 0.00 -0.51 0.00 0.00 58.31 57.82 2v47 n LYS 88 Cb 0.00 -3.71 0.00 0.00 -0.51 0.00 0.00 35.03 30.81 2v47 n LYS 88 CO 0.00 0.00 0.00 0.34 -1.11 0.00 0.00 177.40 176.63 2v47 n PHE 89 N -2.03 -0.02 0.00 2.13 7.35 -1.26 -4.69 117.46 118.94 2v47 n PHE 89 Ca 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.69 2v47 n PHE 89 Cb 0.02 -1.05 0.00 0.00 0.35 0.00 0.00 39.48 38.80 2v47 n PHE 89 CO 0.00 0.00 0.00 1.47 -0.76 0.00 0.00 176.76 177.47 2v47 n LEU 90 N -0.15 0.00 0.00 -2.13 -0.00 -0.98 -5.16 117.00 108.59 2v47 n LEU 90 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.01 2v47 n LEU 90 Cb 0.50 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.92 2v47 n LEU 90 CO 0.01 0.00 0.00 -0.62 -0.00 0.00 0.00 177.39 176.78 2v47 n GLU 91 N 0.00 3.29 -3.35 1.47 -0.58 0.28 -5.11 120.64 116.65 2v47 n GLU 91 Ca 0.00 0.00 0.02 0.00 -0.42 0.00 0.00 57.16 56.76 2v47 n GLU 91 Cb 0.00 0.00 -0.03 0.00 -0.57 0.00 0.00 31.44 30.84 2v47 n GLU 91 CO 0.00 0.00 0.00 -0.80 -0.48 0.00 0.00 177.13 175.85 2v47 s ASN 92 N 1.00 -0.63 -0.13 1.62 -0.87 -1.23 -3.94 114.94 110.77 2v47 s ASN 92 Ca 0.00 0.73 -0.06 0.00 -1.57 0.00 0.00 52.86 51.96 2v47 s ASN 92 Cb 0.00 1.66 0.06 0.00 -0.02 0.00 0.00 41.25 42.95 2v47 s ASN 92 CO 0.00 -0.12 0.30 -0.83 -2.57 0.00 0.00 177.10 173.88 2v47 s GLY 93 N 2.58 -0.19 0.72 0.66 0.00 -1.26 -4.95 107.32 104.89 2v47 s GLY 93 Ca -0.01 1.12 -0.16 0.00 0.00 0.00 0.00 44.72 45.67 2v47 s GLY 93 CO -0.17 1.63 0.41 0.58 0.00 0.00 0.00 173.10 175.55 2v47 n LYS 94 N 4.65 0.25 -3.61 2.90 2.85 -1.25 -3.73 118.16 120.22 2v47 n LYS 94 Ca -0.18 0.12 -0.11 0.00 -1.05 0.00 0.00 58.31 57.08 2v47 n LYS 94 Cb 0.52 -1.72 -0.11 0.00 -0.65 0.00 0.00 35.03 33.07 2v47 n LYS 94 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 177.40 177.50 2v47 s LYS 95 N -2.59 0.24 0.95 -1.58 1.02 -1.14 -3.37 119.74 113.26 2v47 s LYS 95 Ca 0.63 0.78 -0.16 0.00 0.02 0.00 0.00 55.97 57.25 2v47 s LYS 95 Cb -0.35 -0.05 0.05 0.00 -0.52 0.00 0.00 37.83 36.96 2v47 s LYS 95 CO 0.60 -0.35 -0.23 0.44 -0.92 0.00 0.00 175.35 174.89 2v47 n ILE 96 N 5.36 0.00 -2.32 2.17 -5.35 -1.23 -3.39 119.36 114.61 2v47 n ILE 96 Ca -0.07 -0.08 -0.40 0.00 -0.27 0.00 0.00 62.75 61.93 2v47 n ILE 96 Cb 0.50 -0.32 -0.03 0.00 -1.74 0.00 0.00 39.64 38.04 2v47 n ILE 96 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2v47 s ARG 97 N -2.89 3.05 -0.66 6.28 1.70 -1.04 -3.50 118.95 121.89 2v47 s ARG 97 Ca 0.35 0.31 -0.01 0.00 -0.47 0.00 0.00 55.73 55.91 2v47 s ARG 97 Cb -0.02 -4.23 -0.01 0.00 -0.57 0.00 0.00 34.95 30.12 2v47 s ARG 97 CO 0.43 -2.26 0.55 0.28 -1.08 0.00 0.00 175.30 173.22 2v47 n VAL 98 N 6.83 -3.92 0.00 4.99 0.31 -1.26 -4.98 118.33 120.30 2v47 n VAL 98 Ca 0.12 -0.40 0.00 0.00 -0.01 0.00 0.00 64.34 64.05 2v47 n VAL 98 Cb 0.50 -4.17 0.00 0.00 -0.91 0.00 0.00 33.84 29.26 2v47 n VAL 98 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2v47 s ALA 100 N -1.00 -2.38 0.00 0.00 0.00 -1.26 -4.81 121.76 112.30 2v47 s ALA 100 Ca 0.00 1.40 0.00 0.00 0.00 0.00 0.00 51.96 53.36 2v47 s ALA 100 Cb 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 23.12 23.06 2v47 s ALA 100 CO 0.00 -0.83 0.00 1.17 0.00 0.00 0.00 175.76 176.10 2v47 n LYS 101 N -0.28 0.00 0.00 0.00 4.81 -1.22 -3.95 118.16 117.52 2v47 n LYS 101 Ca -0.03 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.41 2v47 n LYS 101 Cb 0.60 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.65 2v47 n LYS 101 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57