#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jws n THR 2 N 0.00 0.00 -2.47 4.28 -2.24 -1.26 -5.01 114.28 107.57 2jws n THR 2 Ca 0.00 0.00 -0.04 0.00 -2.27 0.00 0.00 64.05 61.74 2jws n THR 2 Cb 0.00 0.00 -0.00 0.00 -2.10 0.00 0.00 70.33 68.23 2jws n THR 2 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2jws n TYR 3 N -2.65 -1.78 -2.77 4.78 0.18 -1.26 -4.80 117.16 108.86 2jws n TYR 3 Ca 0.00 0.00 -0.05 0.00 1.88 0.00 0.00 57.90 59.73 2jws n TYR 3 Cb 0.00 -1.63 0.01 0.00 -0.38 0.00 0.00 39.34 37.34 2jws n TYR 3 CO 0.00 0.00 0.00 1.17 -2.08 0.00 0.00 176.86 175.95 2jws n LYS 4 N -2.60 0.56 -3.56 -3.48 0.00 -1.26 -5.15 118.16 102.67 2jws n LYS 4 Ca -0.05 -2.03 -0.13 0.00 0.00 0.00 0.00 58.31 56.10 2jws n LYS 4 Cb 0.54 -1.47 -0.04 0.00 0.00 0.00 0.00 35.03 34.06 2jws n LYS 4 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 2jws n LEU 5 N 2.78 0.00 -4.53 3.14 4.77 -1.26 -5.17 117.00 116.73 2jws n LEU 5 Ca 0.17 -2.32 -0.31 0.00 -0.03 0.00 0.00 56.01 53.53 2jws n LEU 5 Cb 0.57 1.75 -0.11 0.00 -2.33 0.00 0.00 43.42 43.29 2jws n LEU 5 CO -0.01 -0.48 -0.44 0.27 -1.33 0.00 0.00 177.39 175.40 2jws s ILE 6 N -2.84 3.18 -0.15 -0.08 -4.36 -1.26 -5.06 121.20 110.62 2jws s ILE 6 Ca 0.26 -1.14 -0.12 0.00 -0.26 0.00 0.00 60.65 59.40 2jws s ILE 6 Cb 0.00 -2.41 -0.05 0.00 1.25 0.00 0.00 42.46 41.25 2jws s ILE 6 CO 0.18 0.26 -0.17 0.18 0.24 0.00 0.00 174.94 175.64 2jws n LEU 7 N 1.24 1.83 -2.46 0.37 7.99 -1.26 -4.95 117.00 119.76 2jws n LEU 7 Ca -0.15 0.57 -0.03 0.00 -0.01 0.00 0.00 56.01 56.39 2jws n LEU 7 Cb 0.52 -0.86 -0.02 0.00 -0.11 0.00 0.00 43.42 42.96 2jws n LEU 7 CO 0.30 -0.36 0.57 -3.20 -1.51 0.00 0.00 177.39 173.18 2jws n ASN 8 N -4.57 -0.92 0.07 -1.43 2.85 -1.26 -5.03 115.26 104.97 2jws n ASN 8 Ca -0.11 -1.51 -0.21 0.00 -0.11 0.00 0.00 54.58 52.64 2jws n ASN 8 Cb 0.35 0.83 -0.14 0.00 1.24 0.00 0.00 39.78 42.05 2jws n ASN 8 CO 0.00 0.00 0.00 0.25 -2.11 0.00 0.00 177.26 175.40 2jws h LEU 9 N 0.92 0.60 -1.34 1.20 6.46 -1.92 -0.74 115.31 120.48 2jws h LEU 9 Ca -0.50 -0.90 0.13 0.00 -0.12 0.00 0.00 57.88 56.50 2jws h LEU 9 Cb 1.20 -0.19 -0.06 0.00 -0.73 0.00 0.00 40.66 40.87 2jws h LEU 9 CO -0.18 1.45 0.55 0.11 -0.62 0.00 0.00 178.44 179.76 2jws h LYS 10 N -0.16 0.64 0.04 1.25 6.56 -1.97 0.44 116.57 123.38 2jws h LYS 10 Ca -0.16 -0.04 -0.29 0.00 -1.06 0.00 0.00 60.65 59.10 2jws h LYS 10 Cb 1.72 -0.15 -0.03 0.00 -0.57 0.00 0.00 32.23 33.21 2jws h LYS 10 CO 0.18 0.43 -1.57 1.96 -2.06 0.00 0.00 179.45 178.39 2jws h GLN 11 N 0.66 0.08 -0.74 3.15 1.08 -1.98 -2.63 115.11 114.74 2jws h GLN 11 Ca 0.42 -0.14 0.02 0.00 -1.45 0.00 0.00 58.65 57.50 2jws h GLN 11 Cb 0.68 0.05 -0.04 0.00 -0.05 0.00 0.00 27.48 28.13 2jws h GLN 11 CO -0.18 0.80 0.49 0.00 -0.95 0.00 0.00 178.83 178.99 2jws h ALA 12 N 0.79 1.50 0.13 3.87 0.00 0.27 0.12 119.26 125.93 2jws h ALA 12 Ca -0.24 -0.05 -0.32 0.00 0.00 0.00 0.00 54.91 54.30 2jws h ALA 12 Cb 1.97 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 19.47 2jws h ALA 12 CO 0.11 0.45 -1.61 1.57 0.00 0.00 0.00 179.25 179.77 2jws h LYS 13 N 0.97 0.27 -0.04 0.00 -0.00 -1.09 -2.62 116.57 114.07 2jws h LYS 13 Ca 0.28 -0.47 0.01 0.00 -0.00 0.00 0.00 60.65 60.48 2jws h LYS 13 Cb -0.07 0.17 -0.01 0.00 -0.00 0.00 0.00 32.23 32.32 2jws h LYS 13 CO -0.07 1.14 -0.04 0.93 -0.00 0.00 0.00 179.45 181.41 2jws h GLU 14 N 0.07 -0.05 -0.36 0.07 4.39 -1.07 0.61 114.58 118.24 2jws h GLU 14 Ca -0.28 0.00 -0.04 0.00 0.34 0.00 0.00 59.36 59.38 2jws h GLU 14 Cb 2.04 0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 30.68 2jws h GLU 14 CO 0.16 -0.03 0.05 1.49 -1.16 0.00 0.00 179.01 179.52 2jws h GLU 15 N -0.05 0.55 -0.50 2.33 4.81 -0.91 -1.34 114.58 119.48 2jws h GLU 15 Ca 0.03 -0.10 -0.05 0.00 -0.13 0.00 0.00 59.36 59.11 2jws h GLU 15 Cb 0.10 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.36 2jws h GLU 15 CO -0.07 0.54 0.12 0.00 -0.73 0.00 0.00 179.01 178.86 2jws h ALA 16 N 1.53 1.27 -0.19 2.92 0.00 -0.73 -1.25 119.26 122.81 2jws h ALA 16 Ca 0.12 -0.19 0.03 0.00 0.00 0.00 0.00 54.91 54.86 2jws h ALA 16 Cb 0.27 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 2jws h ALA 16 CO 0.00 0.51 0.03 0.82 0.00 0.00 0.00 179.25 180.61 2jws h ILE 17 N 0.74 0.91 -0.29 0.00 1.08 0.13 -0.26 117.51 119.82 2jws h ILE 17 Ca 0.16 -0.03 -0.01 0.00 -0.39 0.00 0.00 64.86 64.59 2jws h ILE 17 Cb 0.28 0.80 -0.02 0.00 -3.07 0.00 0.00 36.82 34.81 2jws h ILE 17 CO -0.00 0.02 0.12 0.11 -0.69 0.00 0.00 178.15 177.71 2jws h LYS 18 N 0.10 0.40 0.19 2.37 1.79 -1.24 0.39 116.57 120.57 2jws h LYS 18 Ca 0.08 -0.04 -0.00 0.00 -2.18 0.00 0.00 60.65 58.51 2jws h LYS 18 Cb 0.08 -0.08 -0.01 0.00 -1.58 0.00 0.00 32.23 30.65 2jws h LYS 18 CO -0.12 0.33 -0.13 0.93 -1.08 0.00 0.00 179.45 179.38 2jws h GLU 19 N 0.41 -0.31 0.00 3.15 3.07 0.10 0.29 114.58 121.29 2jws h GLU 19 Ca 0.10 0.02 -0.17 0.00 -0.50 0.00 0.00 59.36 58.82 2jws h GLU 19 Cb 0.08 0.07 -0.02 0.00 -0.84 0.00 0.00 28.75 28.03 2jws h GLU 19 CO -0.01 -0.20 -0.79 1.25 -1.40 0.00 0.00 179.01 177.85 2jws h LEU 20 N -0.32 0.00 -1.16 1.33 5.85 -0.88 0.86 115.31 120.99 2jws h LEU 20 Ca -0.01 0.00 -0.08 0.00 0.84 0.00 0.00 57.88 58.62 2jws h LEU 20 Cb 0.28 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.29 2jws h LEU 20 CO 0.00 0.79 -0.35 0.58 -0.34 0.00 0.00 178.44 179.13 2jws h VAL 21 N 0.00 1.27 0.05 1.05 2.07 0.06 1.42 116.25 122.17 2jws h VAL 21 Ca -0.01 -1.30 -0.32 0.00 0.82 0.00 0.00 66.70 65.90 2jws h VAL 21 Cb 1.42 1.61 -0.04 0.00 -1.52 0.00 0.00 31.29 32.77 2jws h VAL 21 CO 0.10 0.38 -1.82 -0.67 0.02 0.00 0.00 177.57 175.58 2jws n ASP 22 N -4.10 1.35 0.08 0.57 -0.08 0.99 -3.99 116.55 111.38 2jws n ASP 22 Ca -0.02 0.34 0.12 0.00 -1.51 0.00 0.00 54.79 53.73 2jws n ASP 22 Cb 0.41 -0.37 0.27 0.00 2.34 0.00 0.00 41.12 43.77 2jws n ASP 22 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2jws h ALA 23 N 0.64 0.77 -6.42 -1.67 0.00 -0.68 -3.49 119.26 108.41 2jws h ALA 23 Ca -0.34 0.00 -0.15 0.00 0.00 0.00 0.00 54.91 54.42 2jws h ALA 23 Cb 2.02 0.00 0.01 0.00 0.00 0.00 0.00 17.79 19.82 2jws h ALA 23 CO 0.08 0.00 -1.08 0.41 0.00 0.00 0.00 179.25 178.66 2jws n GLY 24 N 1.32 0.01 3.64 0.00 0.00 0.49 -5.01 105.19 105.63 2jws n GLY 24 Ca 0.04 0.45 -0.06 0.00 0.00 0.00 0.00 46.02 46.46 2jws n GLY 24 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2jws s ILE 25 N -1.19 0.00 -0.11 -0.61 -5.25 -1.25 -5.07 121.20 107.72 2jws s ILE 25 Ca 0.15 0.00 -0.10 0.00 -0.99 0.00 0.00 60.65 59.71 2jws s ILE 25 Cb -0.02 -1.00 0.02 0.00 2.95 0.00 0.00 42.46 44.41 2jws s ILE 25 CO 0.34 0.00 0.17 0.00 -1.79 0.00 0.00 174.94 173.66 2jws n ALA 26 N 2.16 -1.86 0.26 2.27 0.00 -1.26 -4.80 120.51 117.28 2jws n ALA 26 Ca -0.12 0.08 0.09 0.00 0.00 0.00 0.00 53.44 53.49 2jws n ALA 26 Cb 0.56 -0.83 0.66 0.00 0.00 0.00 0.00 19.45 19.84 2jws n ALA 26 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2jws h GLU 27 N 2.61 0.00 -0.83 0.00 5.08 -1.97 -2.43 114.58 117.04 2jws h GLU 27 Ca -0.15 0.00 0.21 0.00 -1.00 0.00 0.00 59.36 58.42 2jws h GLU 27 Cb 0.90 0.00 -0.14 0.00 0.50 0.00 0.00 28.75 30.01 2jws h GLU 27 CO 0.06 0.07 0.14 -0.22 -1.00 0.00 0.00 179.01 178.06 2jws h LYS 28 N 0.00 0.17 -0.00 2.33 1.63 -2.01 1.02 116.57 119.70 2jws h LYS 28 Ca -0.00 -0.01 -0.06 0.00 -0.85 0.00 0.00 60.65 59.73 2jws h LYS 28 Cb 0.14 -0.04 -0.01 0.00 -0.60 0.00 0.00 32.23 31.72 2jws h LYS 28 CO 0.01 0.11 -0.28 1.88 -3.45 0.00 0.00 179.45 177.72 2jws h TYR 29 N 0.17 0.01 0.00 1.91 -1.99 -1.75 -0.61 116.97 114.71 2jws h TYR 29 Ca 0.49 -0.00 -0.01 0.00 2.00 0.00 0.00 58.73 61.21 2jws h TYR 29 Cb 0.94 -0.00 -0.00 0.00 2.00 0.00 0.00 36.73 39.67 2jws h TYR 29 CO -0.33 0.28 -0.06 0.97 -0.00 0.00 0.00 178.16 179.03 2jws h ILE 30 N 0.01 0.66 0.02 -2.88 2.10 0.98 -1.57 117.51 116.83 2jws h ILE 30 Ca -0.00 -0.23 -0.26 0.00 1.08 0.00 0.00 64.86 65.46 2jws h ILE 30 Cb 0.49 1.14 0.01 0.00 -1.09 0.00 0.00 36.82 37.38 2jws h ILE 30 CO 0.04 0.05 -1.04 0.50 -1.08 0.00 0.00 178.15 176.62 2jws h LYS 31 N 0.00 0.56 -0.38 2.19 1.63 -0.60 0.66 116.57 120.63 2jws h LYS 31 Ca -0.00 -0.63 0.01 0.00 -0.85 0.00 0.00 60.65 59.18 2jws h LYS 31 Cb 0.13 0.19 -0.02 0.00 -0.60 0.00 0.00 32.23 31.93 2jws h LYS 31 CO 0.01 1.24 0.25 -0.07 -3.45 0.00 0.00 179.45 177.43 2jws h LEU 32 N 0.30 0.41 0.02 5.20 3.38 -1.13 0.22 115.31 123.72 2jws h LEU 32 Ca -0.12 -0.01 -0.26 0.00 0.09 0.00 0.00 57.88 57.58 2jws h LEU 32 Cb 1.69 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 42.31 2jws h LEU 32 CO 0.19 0.29 -1.41 2.30 0.09 0.00 0.00 178.44 179.90 2jws n ILE 33 N -4.48 1.58 0.13 1.22 -5.35 -1.09 -3.00 119.36 108.37 2jws n ILE 33 Ca 0.03 -0.14 0.17 0.00 -0.27 0.00 0.00 62.75 62.54 2jws n ILE 33 Cb 0.09 -1.99 0.74 0.00 -1.74 0.00 0.00 39.64 36.73 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 -0.42 2.13 0.00 -1.28 0.00 0.45 0.18 119.26 120.33 2jws h ALA 34 Ca -0.37 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.53 2jws h ALA 34 Cb 1.43 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.24 2jws h ALA 34 CO -0.17 -0.41 -0.90 -1.71 0.00 0.00 0.00 179.25 176.07 2jws n ASN 35 N -4.15 0.66 -0.27 0.00 5.15 0.77 -5.03 115.26 112.39 2jws n ASN 35 Ca 0.04 -0.01 0.00 0.00 -0.60 0.00 0.00 54.58 54.02 2jws n ASN 35 Cb 0.41 0.54 0.00 0.00 -0.53 0.00 0.00 39.78 40.20 2jws n ASN 35 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2jws n ALA 36 N -1.89 0.00 0.00 5.20 0.00 0.63 -4.99 120.51 119.47 2jws n ALA 36 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.46 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 1.17 0.00 0.00 0.00 177.50 178.67 2jws n LYS 37 N -0.55 0.00 -3.81 0.00 4.81 -1.26 -4.83 118.16 112.52 2jws n LYS 37 Ca 0.00 0.00 -0.30 0.00 -0.87 0.00 0.00 58.31 57.14 2jws n LYS 37 Cb 0.00 0.00 -0.15 0.00 0.02 0.00 0.00 35.03 34.90 2jws n LYS 37 CO 0.00 0.00 0.00 0.95 1.17 0.00 0.00 177.40 179.52 2jws s THR 38 N 0.00 1.18 0.39 3.15 -4.23 -1.26 -4.99 115.64 109.88 2jws s THR 38 Ca 0.00 -1.50 0.23 0.00 -1.18 0.00 0.00 61.69 59.24 2jws s THR 38 Cb 0.00 -1.83 0.41 0.00 1.34 0.00 0.00 72.50 72.42 2jws s THR 38 CO 0.00 -0.57 1.63 1.62 -0.54 0.00 0.00 174.62 176.75 2jws h VAL 39 N 6.53 0.14 -0.19 2.29 3.04 -1.96 1.26 116.25 127.37 2jws h VAL 39 Ca -0.12 -0.05 -0.08 0.00 -1.01 0.00 0.00 66.70 65.44 2jws h VAL 39 Cb 1.03 0.00 -0.00 0.00 -2.01 0.00 0.00 31.29 30.31 2jws h VAL 39 CO 0.47 0.02 -0.20 -0.33 -1.01 0.00 0.00 177.57 176.52 2jws h GLU 40 N 0.13 0.47 -0.37 4.17 4.39 -1.97 -2.88 114.58 118.52 2jws h GLU 40 Ca 0.80 -0.25 -0.03 0.00 0.34 0.00 0.00 59.36 60.22 2jws h GLU 40 Cb 2.23 0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 30.87 2jws h GLU 40 CO -0.56 0.83 0.13 0.78 -1.16 0.00 0.00 179.01 179.03 2jws h GLY 41 N 0.14 0.62 -0.18 -3.84 0.00 0.85 -0.32 103.07 100.34 2jws h GLY 41 Ca 0.03 -0.35 0.23 0.00 0.00 0.00 0.00 47.33 47.23 2jws h GLY 41 CO 0.05 0.33 0.46 -2.08 0.00 0.00 0.00 176.54 175.30 2jws h VAL 42 N 0.46 0.50 0.00 4.60 2.07 0.07 1.67 116.25 125.61 2jws h VAL 42 Ca 0.12 -0.16 -0.14 0.00 0.82 0.00 0.00 66.70 67.34 2jws h VAL 42 Cb 0.23 -0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 29.98 2jws h VAL 42 CO -0.01 0.08 -0.68 -0.25 0.02 0.00 0.00 177.57 176.74 2jws h TRP 43 N 0.46 0.00 0.03 1.57 7.01 -1.23 -2.77 115.95 121.02 2jws h TRP 43 Ca 0.59 0.00 -0.06 0.00 2.11 0.00 0.00 58.89 61.53 2jws h TRP 43 Cb 1.11 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 28.17 2jws h TRP 43 CO -0.09 0.68 -0.27 1.15 -2.79 0.00 0.00 178.44 177.11 2jws h THR 44 N 0.00 1.67 -0.55 2.65 2.02 0.20 -2.63 112.91 116.27 2jws h THR 44 Ca -0.01 -2.38 0.04 0.00 0.77 0.00 0.00 66.41 64.84 2jws h THR 44 Cb 1.39 3.27 -0.03 0.00 -1.74 0.00 0.00 68.15 71.04 2jws h THR 44 CO 0.09 0.61 0.37 -0.07 0.37 0.00 0.00 175.52 176.89 2jws h LEU 45 N -0.87 0.52 0.58 2.58 -0.00 0.20 0.51 115.31 118.84 2jws h LEU 45 Ca -0.06 -0.00 -0.03 0.00 -0.00 0.00 0.00 57.88 57.79 2jws h LEU 45 Cb 1.16 -0.12 0.01 0.00 -0.00 0.00 0.00 40.66 41.70 2jws h LEU 45 CO 0.02 0.36 -0.28 0.50 -0.00 0.00 0.00 178.44 179.03 2jws h LYS 46 N 0.61 -0.75 -0.24 1.13 3.64 -1.58 0.76 116.57 120.13 2jws h LYS 46 Ca 0.23 0.05 0.04 0.00 -1.27 0.00 0.00 60.65 59.70 2jws h LYS 46 Cb 0.14 0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 32.12 2jws h LYS 46 CO -0.06 -0.50 0.17 0.22 -2.27 0.00 0.00 179.45 177.01 2jws h ASP 47 N -1.20 0.11 0.05 4.20 3.58 -1.22 -1.12 116.42 120.81 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 0.60 -0.03 0.00 0.00 1.72 0.00 0.00 39.33 41.63 2jws h ASP 47 CO 0.13 0.08 -0.02 -0.08 -2.88 0.00 0.00 179.24 176.47 2jws h GLU 48 N 0.13 -0.06 -0.10 0.28 4.81 0.07 -2.65 114.58 117.07 2jws h GLU 48 Ca 0.11 0.00 0.03 0.00 -0.13 0.00 0.00 59.36 59.37 2jws h GLU 48 Cb 0.26 0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.65 2jws h GLU 48 CO -0.01 0.55 0.15 0.97 -0.73 0.00 0.00 179.01 179.93 2jws h ILE 49 N -0.92 0.34 0.06 2.32 6.09 0.84 0.18 117.51 126.42 2jws h ILE 49 Ca -0.01 0.00 -0.25 0.00 -1.37 0.00 0.00 64.86 63.23 2jws h ILE 49 Cb 0.64 0.87 -0.02 0.00 0.47 0.00 0.00 36.82 38.78 2jws h ILE 49 CO 0.01 0.00 -1.22 0.25 -3.07 0.00 0.00 178.15 174.12 2jws h LEU 50 N 0.00 0.18 -2.00 2.19 5.85 -1.26 -3.25 115.31 117.02 2jws h LEU 50 Ca 0.05 -0.22 -0.02 0.00 0.84 0.00 0.00 57.88 58.53 2jws h LEU 50 Cb 0.34 -0.06 -0.00 0.00 0.37 0.00 0.00 40.66 41.31 2jws h LEU 50 CO -0.00 1.17 -0.09 0.74 -0.34 0.00 0.00 178.44 179.92 2jws h THR 51 N 0.03 0.44 -0.11 1.05 2.02 -0.26 -2.04 112.91 114.04 2jws h THR 51 Ca -0.11 -0.46 0.00 0.00 0.77 0.00 0.00 66.41 66.61 2jws h THR 51 Cb 1.89 1.32 0.00 0.00 -1.74 0.00 0.00 68.15 69.62 2jws h THR 51 CO 0.15 0.09 0.00 2.22 0.37 0.00 0.00 175.52 178.35 2jws n PHE 52 N -3.52 0.30 -2.67 3.16 -1.74 -1.03 -4.04 117.46 107.91 2jws n PHE 52 Ca -0.02 -0.11 -0.05 0.00 -0.56 0.00 0.00 57.45 56.71 2jws n PHE 52 Cb 0.22 -0.12 0.08 0.00 1.52 0.00 0.00 39.48 41.18 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 0.03 0.00 0.00 1.97 -1.04 -0.78 -5.09 114.28 109.38 2jws n THR 53 Ca 0.05 -0.72 0.00 0.00 -2.04 0.00 0.00 64.05 61.34 2jws n THR 53 Cb 0.31 1.11 0.00 0.00 -1.82 0.00 0.00 70.33 69.93 2jws n THR 53 CO 0.00 0.00 0.00 1.33 -0.64 0.00 0.00 175.07 175.76 2jws n VAL 54 N 1.46 0.00 -0.90 12.58 0.24 -1.18 -4.92 118.33 125.62 2jws n VAL 54 Ca 0.01 0.00 0.02 0.00 -2.04 0.00 0.00 64.34 62.33 2jws n VAL 54 Cb 0.70 -0.25 -0.01 0.00 -1.47 0.00 0.00 33.84 32.81 2jws n VAL 54 CO 0.00 0.00 0.00 0.41 -2.14 0.00 0.00 176.83 175.10 2jws n THR 55 N -0.87 -1.47 -0.56 3.34 -1.04 -1.26 -5.14 114.28 107.27 2jws n THR 55 Ca 0.00 0.79 0.00 0.00 -2.04 0.00 0.00 64.05 62.80 2jws n THR 55 Cb 0.00 -1.30 0.00 0.00 -1.82 0.00 0.00 70.33 67.21 2jws n THR 55 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81