#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jws s THR 2 N 0.00 4.50 -0.59 4.28 -4.23 -1.26 -4.68 115.64 113.66 2jws s THR 2 Ca 0.00 -2.38 -0.06 0.00 -1.18 0.00 0.00 61.69 58.07 2jws s THR 2 Cb 0.00 -3.89 0.06 0.00 1.34 0.00 0.00 72.50 70.01 2jws s THR 2 CO 0.00 -0.89 0.17 0.00 -0.54 0.00 0.00 174.62 173.36 2jws n TYR 3 N 4.16 -1.76 -3.10 3.99 4.19 -1.26 -4.81 117.16 118.57 2jws n TYR 3 Ca 0.04 0.19 -0.17 0.00 3.31 0.00 0.00 57.90 61.26 2jws n TYR 3 Cb 0.42 -1.46 -0.05 0.00 0.49 0.00 0.00 39.34 38.74 2jws n TYR 3 CO 0.00 0.00 0.00 1.17 0.91 0.00 0.00 176.86 178.94 2jws n LYS 4 N -2.96 0.40 -3.06 2.98 4.81 -1.26 -5.02 118.16 114.05 2jws n LYS 4 Ca 0.02 -2.67 -0.19 0.00 -0.87 0.00 0.00 58.31 54.60 2jws n LYS 4 Cb 0.50 -1.54 -0.03 0.00 0.02 0.00 0.00 35.03 33.98 2jws n LYS 4 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 2jws n LEU 5 N 2.67 -0.64 -3.65 3.14 4.77 -1.26 -3.31 117.00 118.72 2jws n LEU 5 Ca 0.23 -4.33 -0.03 0.00 -0.03 0.00 0.00 56.01 51.85 2jws n LEU 5 Cb 0.52 0.71 -0.07 0.00 -2.33 0.00 0.00 43.42 42.26 2jws n LEU 5 CO 0.05 2.08 1.15 -0.51 -1.33 0.00 0.00 177.39 178.83 2jws s ILE 6 N -0.78 0.00 -0.28 -0.08 2.07 -1.26 -5.08 121.20 115.79 2jws s ILE 6 Ca 0.34 0.00 -0.23 0.00 -1.41 0.00 0.00 60.65 59.35 2jws s ILE 6 Cb 0.21 -1.00 0.12 0.00 0.13 0.00 0.00 42.46 41.92 2jws s ILE 6 CO -0.14 0.00 0.98 -0.76 -1.91 0.00 0.00 174.94 173.11 2jws s LEU 7 N -0.14 -0.51 0.00 8.50 1.43 -1.26 -5.04 118.68 121.67 2jws s LEU 7 Ca 0.07 0.93 0.00 0.00 -1.03 0.00 0.00 54.13 54.11 2jws s LEU 7 Cb -0.04 1.92 0.00 0.00 0.03 0.00 0.00 46.19 48.10 2jws s LEU 7 CO -0.14 -0.16 0.00 0.59 0.23 0.00 0.00 176.35 176.87 2jws n ASN 8 N 2.65 0.00 -0.04 2.29 3.02 -1.26 -5.00 115.26 116.92 2jws n ASN 8 Ca -0.14 0.00 -0.09 0.00 -0.03 0.00 0.00 54.58 54.32 2jws n ASN 8 Cb 0.56 0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.71 2jws n ASN 8 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 2jws h LEU 9 N 0.00 0.01 -1.33 3.41 5.85 -1.96 1.24 115.31 122.54 2jws h LEU 9 Ca 0.00 0.03 0.07 0.00 0.84 0.00 0.00 57.88 58.82 2jws h LEU 9 Cb 0.00 0.04 -0.05 0.00 0.37 0.00 0.00 40.66 41.02 2jws h LEU 9 CO 0.00 0.04 0.50 0.11 -0.34 0.00 0.00 178.44 178.75 2jws h LYS 10 N 0.12 0.79 0.18 1.25 1.57 -1.97 -1.60 116.57 116.90 2jws h LYS 10 Ca 0.09 -0.05 -0.34 0.00 -1.87 0.00 0.00 60.65 58.48 2jws h LYS 10 Cb 0.08 -0.18 0.01 0.00 0.08 0.00 0.00 32.23 32.22 2jws h LYS 10 CO -0.12 0.52 -1.71 0.37 -0.57 0.00 0.00 179.45 177.94 2jws h GLN 11 N 0.81 0.37 -0.91 3.15 4.15 -1.82 -2.46 115.11 118.40 2jws h GLN 11 Ca 0.33 -0.64 0.12 0.00 0.77 0.00 0.00 58.65 59.24 2jws h GLN 11 Cb 0.26 0.24 -0.07 0.00 0.21 0.00 0.00 27.48 28.11 2jws h GLN 11 CO -0.11 1.28 0.59 0.00 -1.93 0.00 0.00 178.83 178.66 2jws h ALA 12 N 0.19 1.71 0.11 3.38 0.00 0.19 0.30 119.26 125.14 2jws h ALA 12 Ca -0.33 0.01 -0.31 0.00 0.00 0.00 0.00 54.91 54.29 2jws h ALA 12 Cb 2.09 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 19.70 2jws h ALA 12 CO 0.18 0.07 -1.57 1.57 0.00 0.00 0.00 179.25 179.49 2jws h LYS 13 N 0.81 0.23 0.05 0.00 -0.00 -1.42 -2.61 116.57 113.64 2jws h LYS 13 Ca 0.45 -0.40 -0.00 0.00 -0.00 0.00 0.00 60.65 60.70 2jws h LYS 13 Cb 0.58 0.15 0.00 0.00 -0.00 0.00 0.00 32.23 32.96 2jws h LYS 13 CO -0.21 1.08 -0.03 0.93 -0.00 0.00 0.00 179.45 181.23 2jws h GLU 14 N 0.06 -0.07 -0.13 0.07 4.39 -0.82 0.44 114.58 118.53 2jws h GLU 14 Ca -0.26 0.00 -0.06 0.00 0.34 0.00 0.00 59.36 59.39 2jws h GLU 14 Cb 2.01 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 30.67 2jws h GLU 14 CO 0.15 -0.04 -0.17 1.49 -1.16 0.00 0.00 179.01 179.28 2jws h GLU 15 N -0.07 0.21 -0.54 2.33 4.81 -0.58 -1.75 114.58 118.98 2jws h GLU 15 Ca -0.01 -0.05 -0.07 0.00 -0.13 0.00 0.00 59.36 59.10 2jws h GLU 15 Cb 0.06 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.39 2jws h GLU 15 CO 0.01 0.38 0.05 0.00 -0.73 0.00 0.00 179.01 178.72 2jws h ALA 16 N 1.63 1.07 -0.43 2.92 0.00 -0.82 -0.40 119.26 123.22 2jws h ALA 16 Ca 0.04 -0.26 0.03 0.00 0.00 0.00 0.00 54.91 54.72 2jws h ALA 16 Cb 0.42 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.97 2jws h ALA 16 CO 0.03 0.59 0.23 0.82 0.00 0.00 0.00 179.25 180.92 2jws h ILE 17 N 0.83 0.99 -0.19 0.00 1.08 0.74 0.13 117.51 121.09 2jws h ILE 17 Ca 0.16 -0.16 -0.03 0.00 -0.39 0.00 0.00 64.86 64.45 2jws h ILE 17 Cb 0.43 0.49 -0.01 0.00 -3.07 0.00 0.00 36.82 34.66 2jws h ILE 17 CO 0.01 0.08 -0.02 0.07 -0.69 0.00 0.00 178.15 177.61 2jws h LYS 18 N 0.46 0.27 0.20 2.37 2.10 -1.20 0.35 116.57 121.11 2jws h LYS 18 Ca 0.18 -0.04 -0.01 0.00 -2.00 0.00 0.00 60.65 58.78 2jws h LYS 18 Cb 0.07 -0.05 0.00 0.00 -0.90 0.00 0.00 32.23 31.36 2jws h LYS 18 CO -0.12 0.32 -0.10 0.93 -2.00 0.00 0.00 179.45 178.48 2jws h GLU 19 N 0.27 -0.26 -0.13 0.07 3.07 0.86 -0.64 114.58 117.82 2jws h GLU 19 Ca 0.06 0.02 -0.14 0.00 -0.50 0.00 0.00 59.36 58.80 2jws h GLU 19 Cb 0.22 0.06 -0.01 0.00 -0.84 0.00 0.00 28.75 28.18 2jws h GLU 19 CO 0.01 -0.04 -0.53 1.25 -1.40 0.00 0.00 179.01 178.30 2jws h LEU 20 N -0.45 0.40 -1.51 1.33 5.85 -0.60 0.16 115.31 120.49 2jws h LEU 20 Ca -0.03 -0.21 -0.04 0.00 0.84 0.00 0.00 57.88 58.44 2jws h LEU 20 Cb 0.35 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.25 2jws h LEU 20 CO 0.05 0.85 -0.14 0.58 -0.34 0.00 0.00 178.44 179.44 2jws h VAL 21 N 0.28 1.15 0.13 1.05 2.07 -0.21 0.92 116.25 121.65 2jws h VAL 21 Ca 0.01 -0.70 -0.34 0.00 0.82 0.00 0.00 66.70 66.49 2jws h VAL 21 Cb 1.02 1.25 -0.01 0.00 -1.52 0.00 0.00 31.29 32.04 2jws h VAL 21 CO 0.09 0.21 -1.77 0.44 0.02 0.00 0.00 177.57 176.56 2jws h ASP 22 N 0.13 0.44 1.35 0.57 3.32 -0.83 -3.32 116.42 118.08 2jws h ASP 22 Ca 0.03 -0.75 0.00 0.00 0.02 0.00 0.00 57.03 56.33 2jws h ASP 22 Cb 0.34 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 39.75 2jws h ASP 22 CO 0.02 1.65 0.00 0.00 -1.72 0.00 0.00 179.24 179.19 2jws h ALA 23 N 0.29 1.00 -6.35 3.45 0.00 -0.37 -3.49 119.26 113.79 2jws h ALA 23 Ca -0.34 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.57 2jws h ALA 23 Cb 2.05 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.84 2jws h ALA 23 CO 0.14 0.00 -0.97 0.41 0.00 0.00 0.00 179.25 178.82 2jws n GLY 24 N 0.97 -0.04 0.00 0.00 0.00 0.32 -5.01 105.19 101.43 2jws n GLY 24 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 2jws n GLY 24 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2jws n ILE 25 N 1.32 0.00 -1.02 -0.61 -6.64 -1.25 -5.08 119.36 106.07 2jws n ILE 25 Ca -0.00 0.00 -0.23 0.00 -1.77 0.00 0.00 62.75 60.75 2jws n ILE 25 Cb 0.48 0.00 -0.12 0.00 -1.44 0.00 0.00 39.64 38.56 2jws n ILE 25 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 2jws n ALA 26 N -3.00 0.44 0.19 -1.28 0.00 -1.26 -4.70 120.51 110.89 2jws n ALA 26 Ca 0.00 -0.34 0.18 0.00 0.00 0.00 0.00 53.44 53.27 2jws n ALA 26 Cb 0.00 -1.59 0.81 0.00 0.00 0.00 0.00 19.45 18.68 2jws n ALA 26 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 2jws h GLU 27 N 7.91 0.00 -0.84 0.00 4.22 -1.97 -2.13 114.58 121.76 2jws h GLU 27 Ca -0.01 0.00 0.21 0.00 0.08 0.00 0.00 59.36 59.64 2jws h GLU 27 Cb 0.84 0.00 -0.14 0.00 0.50 0.00 0.00 28.75 29.95 2jws h GLU 27 CO 1.02 0.00 0.11 -0.22 -2.18 0.00 0.00 179.01 177.74 2jws h LYS 28 N 0.00 0.13 -0.03 1.92 1.63 -2.01 1.16 116.57 119.37 2jws h LYS 28 Ca 0.10 -0.01 -0.05 0.00 -0.85 0.00 0.00 60.65 59.85 2jws h LYS 28 Cb 0.58 -0.03 -0.01 0.00 -0.60 0.00 0.00 32.23 32.17 2jws h LYS 28 CO -0.00 0.09 -0.20 1.88 -3.45 0.00 0.00 179.45 177.76 2jws h TYR 29 N 0.14 0.04 0.00 1.91 -1.99 -1.75 -0.12 116.97 115.20 2jws h TYR 29 Ca 0.50 -0.00 -0.01 0.00 2.00 0.00 0.00 58.73 61.21 2jws h TYR 29 Cb 0.97 -0.01 -0.00 0.00 2.00 0.00 0.00 36.73 39.68 2jws h TYR 29 CO -0.36 0.25 -0.06 0.97 -0.00 0.00 0.00 178.16 178.95 2jws h ILE 30 N 0.04 0.68 -0.01 -2.88 2.10 0.12 -1.50 117.51 116.07 2jws h ILE 30 Ca 0.01 -0.26 -0.24 0.00 1.08 0.00 0.00 64.86 65.45 2jws h ILE 30 Cb 0.39 1.15 0.01 0.00 -1.09 0.00 0.00 36.82 37.28 2jws h ILE 30 CO 0.03 0.06 -0.97 0.50 -1.08 0.00 0.00 178.15 176.69 2jws h LYS 31 N 0.00 0.56 -0.43 2.19 3.64 -0.54 0.89 116.57 122.90 2jws h LYS 31 Ca -0.00 -0.59 0.02 0.00 -1.27 0.00 0.00 60.65 58.81 2jws h LYS 31 Cb 0.15 0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 32.11 2jws h LYS 31 CO 0.01 1.21 0.28 -0.07 -2.27 0.00 0.00 179.45 178.61 2jws h LEU 32 N 0.33 0.42 0.02 5.20 3.38 -1.12 0.30 115.31 123.84 2jws h LEU 32 Ca -0.10 -0.01 -0.27 0.00 0.09 0.00 0.00 57.88 57.59 2jws h LEU 32 Cb 1.61 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 42.22 2jws h LEU 32 CO 0.18 0.30 -1.50 2.30 0.09 0.00 0.00 178.44 179.81 2jws n ILE 33 N -4.48 1.57 0.10 1.22 -5.35 -1.09 -3.19 119.36 108.15 2jws n ILE 33 Ca 0.04 -0.16 0.17 0.00 -0.27 0.00 0.00 62.75 62.53 2jws n ILE 33 Cb 0.12 -1.97 0.71 0.00 -1.74 0.00 0.00 39.64 36.76 2jws n ILE 33 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2jws h ALA 34 N -0.44 2.23 0.00 -1.28 0.00 0.95 0.28 119.26 121.00 2jws h ALA 34 Ca -0.39 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.50 2jws h ALA 34 Cb 1.45 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.27 2jws h ALA 34 CO -0.18 -0.44 -0.69 -0.97 0.00 0.00 0.00 179.25 176.97 2jws h ASN 35 N 0.00 0.00 0.00 0.00 -0.73 -0.57 -3.50 115.58 110.79 2jws h ASN 35 Ca 0.16 -0.17 0.00 0.00 1.87 0.00 0.00 56.30 58.16 2jws h ASN 35 Cb 0.69 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.28 2jws h ASN 35 CO -0.00 0.09 0.00 0.00 -0.37 0.00 0.00 177.43 177.15 2jws n ALA 36 N -1.90 0.00 0.00 1.57 0.00 0.97 -4.90 120.51 116.26 2jws n ALA 36 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.47 2jws n ALA 36 Cb 0.46 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.91 2jws n ALA 36 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2jws n LYS 37 N 13.83 0.00 -3.27 0.00 5.02 -1.26 -4.78 118.16 127.69 2jws n LYS 37 Ca 0.00 0.00 -0.23 0.00 -2.02 0.00 0.00 58.31 56.06 2jws n LYS 37 Cb 0.00 -0.35 -0.08 0.00 -0.02 0.00 0.00 35.03 34.59 2jws n LYS 37 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 2jws n THR 38 N -1.43 -0.99 -0.35 -0.18 -2.24 -1.26 -5.00 114.28 102.83 2jws n THR 38 Ca 0.00 -3.02 0.12 0.00 -2.27 0.00 0.00 64.05 58.88 2jws n THR 38 Cb 0.00 -1.19 0.24 0.00 -2.10 0.00 0.00 70.33 67.29 2jws n THR 38 CO 0.00 0.00 0.00 1.62 -0.57 0.00 0.00 175.07 176.12 2jws h VAL 39 N 4.55 0.01 -0.50 2.28 3.04 -1.94 1.13 116.25 124.82 2jws h VAL 39 Ca 0.22 -0.00 -0.02 0.00 -1.01 0.00 0.00 66.70 65.89 2jws h VAL 39 Cb 0.94 0.01 -0.02 0.00 -2.01 0.00 0.00 31.29 30.21 2jws h VAL 39 CO 0.31 0.00 0.22 -0.33 -1.01 0.00 0.00 177.57 176.77 2jws h GLU 40 N 0.00 0.74 -0.20 4.17 5.08 -1.99 -2.72 114.58 119.66 2jws h GLU 40 Ca 0.56 -0.12 -0.03 0.00 -1.00 0.00 0.00 59.36 58.77 2jws h GLU 40 Cb 1.07 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 30.19 2jws h GLU 40 CO -0.96 0.64 -0.01 0.78 -1.00 0.00 0.00 179.01 178.45 2jws h GLY 41 N 0.67 0.38 -0.51 -3.84 0.00 0.33 -1.71 103.07 98.40 2jws h GLY 41 Ca 0.17 -0.29 0.30 0.00 0.00 0.00 0.00 47.33 47.51 2jws h GLY 41 CO -0.02 0.27 0.46 -2.08 0.00 0.00 0.00 176.54 175.17 2jws h VAL 42 N 0.10 0.30 0.01 4.60 2.07 0.10 2.31 116.25 125.74 2jws h VAL 42 Ca 0.05 -0.10 -0.19 0.00 0.82 0.00 0.00 66.70 67.29 2jws h VAL 42 Cb 0.41 -0.01 -0.02 0.00 -1.52 0.00 0.00 31.29 30.16 2jws h VAL 42 CO 0.01 0.05 -0.88 -0.25 0.02 0.00 0.00 177.57 176.53 2jws h TRP 43 N 0.28 0.16 0.00 1.57 2.91 -1.28 -2.80 115.95 116.79 2jws h TRP 43 Ca 0.68 -0.09 -0.01 0.00 1.13 0.00 0.00 58.89 60.60 2jws h TRP 43 Cb 1.50 -0.02 -0.00 0.00 -0.51 0.00 0.00 29.16 30.14 2jws h TRP 43 CO -0.10 0.92 -0.05 1.15 -1.03 0.00 0.00 178.44 179.33 2jws h THR 44 N 0.05 1.21 -0.88 2.65 2.02 0.20 -2.61 112.91 115.56 2jws h THR 44 Ca -0.03 -1.93 0.18 0.00 0.77 0.00 0.00 66.41 65.40 2jws h THR 44 Cb 1.52 2.30 -0.07 0.00 -1.74 0.00 0.00 68.15 70.16 2jws h THR 44 CO 0.12 0.41 0.58 -0.07 0.37 0.00 0.00 175.52 176.93 2jws h LEU 45 N -1.00 0.49 0.58 2.58 -0.00 0.32 0.83 115.31 119.11 2jws h LEU 45 Ca -0.01 0.04 -0.03 0.00 -0.00 0.00 0.00 57.88 57.88 2jws h LEU 45 Cb 0.71 -0.05 0.01 0.00 -0.00 0.00 0.00 40.66 41.32 2jws h LEU 45 CO -0.01 0.22 -0.28 0.50 -0.00 0.00 0.00 178.44 178.87 2jws h LYS 46 N 0.50 -0.75 -0.34 1.13 3.64 -1.59 0.88 116.57 120.04 2jws h LYS 46 Ca 0.46 0.05 0.07 0.00 -1.27 0.00 0.00 60.65 59.95 2jws h LYS 46 Cb 0.98 0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 32.96 2jws h LYS 46 CO -0.19 -0.48 0.24 0.22 -2.27 0.00 0.00 179.45 176.97 2jws h ASP 47 N -1.18 0.16 0.04 4.20 3.58 -0.96 0.80 116.42 123.05 2jws h ASP 47 Ca -0.08 0.00 -0.00 0.00 0.42 0.00 0.00 57.03 57.37 2jws h ASP 47 Cb 0.62 -0.03 0.00 0.00 1.72 0.00 0.00 39.33 41.63 2jws h ASP 47 CO 0.13 0.10 -0.02 -0.08 -2.88 0.00 0.00 179.24 176.49 2jws h GLU 48 N 0.18 -0.05 0.00 0.28 4.81 0.71 -2.66 114.58 117.85 2jws h GLU 48 Ca 0.16 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.39 2jws h GLU 48 Cb 0.39 0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.78 2jws h GLU 48 CO -0.02 0.60 -0.02 0.97 -0.73 0.00 0.00 179.01 179.81 2jws h ILE 49 N -0.91 0.40 0.06 2.32 6.09 0.12 -0.03 117.51 125.56 2jws h ILE 49 Ca -0.01 -0.08 -0.24 0.00 -1.37 0.00 0.00 64.86 63.17 2jws h ILE 49 Cb 0.67 1.05 -0.01 0.00 0.47 0.00 0.00 36.82 39.01 2jws h ILE 49 CO 0.01 0.01 -1.10 0.25 -3.07 0.00 0.00 178.15 174.25 2jws h LEU 50 N 0.00 0.26 -1.19 2.19 5.85 -0.90 -3.25 115.31 118.26 2jws h LEU 50 Ca -0.00 -0.26 -0.02 0.00 0.84 0.00 0.00 57.88 58.43 2jws h LEU 50 Cb 0.05 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 40.97 2jws h LEU 50 CO 0.00 1.18 0.27 0.74 -0.34 0.00 0.00 178.44 180.29 2jws h THR 51 N 0.06 1.20 0.00 1.05 2.02 -0.63 -3.25 112.91 113.35 2jws h THR 51 Ca -0.08 -0.57 -0.34 0.00 0.77 0.00 0.00 66.41 66.19 2jws h THR 51 Cb 1.83 0.46 0.01 0.00 -1.74 0.00 0.00 68.15 68.71 2jws h THR 51 CO 0.17 0.24 2.20 2.22 0.37 0.00 0.00 175.52 180.71 2jws n PHE 52 N -4.35 1.16 0.00 3.16 -1.74 -1.04 -3.50 117.46 111.16 2jws n PHE 52 Ca 0.05 -1.81 0.00 0.00 -0.56 0.00 0.00 57.45 55.13 2jws n PHE 52 Cb 0.14 -1.60 0.00 0.00 1.52 0.00 0.00 39.48 39.54 2jws n PHE 52 CO 0.00 0.00 0.00 2.41 -0.56 0.00 0.00 176.76 178.61 2jws n THR 53 N 3.92 0.00 -2.41 1.97 -1.04 -1.23 -5.06 114.28 110.43 2jws n THR 53 Ca 0.42 0.00 -0.42 0.00 -2.04 0.00 0.00 64.05 62.01 2jws n THR 53 Cb 0.20 0.00 -0.03 0.00 -1.82 0.00 0.00 70.33 68.69 2jws n THR 53 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 2jws s VAL 54 N -0.95 3.83 0.00 12.58 1.01 -1.23 -4.85 120.40 130.79 2jws s VAL 54 Ca 0.00 0.74 0.00 0.00 0.00 0.00 0.00 61.98 62.72 2jws s VAL 54 Cb 0.00 -4.43 0.00 0.00 0.00 0.00 0.00 36.38 31.95 2jws s VAL 54 CO 0.00 -1.12 0.00 0.41 0.00 0.00 0.00 175.10 174.39 2jws n THR 55 N 6.88 0.00 -0.64 3.92 -1.04 -1.26 -4.83 114.28 117.31 2jws n THR 55 Ca 0.13 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.14 2jws n THR 55 Cb 0.49 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.00 2jws n THR 55 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81