#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 0.06 -0.09 4.28 -4.23 -1.26 -5.05 115.64 109.35 2jws s THR 2 Ca 0.00 -0.48 0.01 0.00 -1.18 0.00 0.00 61.69 60.04 2jws s THR 2 Cb 0.00 -0.20 -0.06 0.00 1.34 0.00 0.00 72.50 73.58 2jws s THR 2 CO 0.00 -0.26 -0.07 0.00 -0.54 0.00 0.00 174.62 173.74 2jws n TYR 3 N 2.22 0.00 -3.15 3.99 4.11 -1.26 -5.07 117.16 118.00 2jws n TYR 3 Ca -0.19 0.00 -0.05 0.00 -0.00 0.00 0.00 57.90 57.67 2jws n TYR 3 Cb 0.57 -0.36 0.01 0.00 -0.00 0.00 0.00 39.34 39.57 2jws n TYR 3 CO 0.00 0.00 0.00 1.17 -0.00 0.00 0.00 176.86 178.03 2jws n LYS 4 N -2.72 -1.46 -4.39 -3.48 3.00 -1.26 -5.04 118.16 102.80 2jws n LYS 4 Ca -0.16 1.33 -0.22 0.00 -0.00 0.00 0.00 58.31 59.26 2jws n LYS 4 Cb 0.68 -5.50 -0.08 0.00 0.00 0.00 0.00 35.03 30.13 2jws n LYS 4 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 2jws s LEU 5 N -4.33 1.83 -0.94 3.14 1.02 -1.26 -5.09 118.68 113.05 2jws s LEU 5 Ca 0.08 -1.69 -0.01 0.00 0.02 0.00 0.00 54.13 52.52 2jws s LEU 5 Cb -0.01 0.22 0.28 0.00 0.02 0.00 0.00 46.19 46.70 2jws s LEU 5 CO 0.76 -0.98 1.20 -0.38 0.02 0.00 0.00 176.35 176.97 2jws n ILE 6 N -0.74 4.28 -4.25 -0.59 5.41 -1.26 -5.03 119.36 117.19 2jws n ILE 6 Ca 0.01 -5.65 -0.31 0.00 1.00 0.00 0.00 62.75 57.79 2jws n ILE 6 Cb 0.64 -2.13 -0.09 0.00 -0.71 0.00 0.00 39.64 37.35 2jws n ILE 6 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 2jws s LEU 7 N -2.54 3.39 -0.39 1.39 1.02 -1.26 -5.03 118.68 115.25 2jws s LEU 7 Ca 0.33 -0.14 0.08 0.00 0.02 0.00 0.00 54.13 54.42 2jws s LEU 7 Cb 0.06 -2.04 0.34 0.00 0.02 0.00 0.00 46.19 44.57 2jws s LEU 7 CO 0.05 0.23 1.30 -3.20 0.02 0.00 0.00 176.35 174.75 2jws n ASN 8 N 1.02 -1.85 0.08 2.29 2.85 -1.26 -4.97 115.26 113.42 2jws n ASN 8 Ca -0.13 -2.47 -0.12 0.00 -0.11 0.00 0.00 54.58 51.75 2jws n ASN 8 Cb 0.52 1.11 -0.06 0.00 1.24 0.00 0.00 39.78 42.59 2jws n ASN 8 CO 0.00 0.00 0.00 0.17 -2.11 0.00 0.00 177.26 175.32 2jws h LEU 9 N 1.99 0.39 -1.23 1.20 8.10 -1.96 -1.01 115.31 122.80 2jws h LEU 9 Ca -0.30 -0.34 0.15 0.00 0.11 0.00 0.00 57.88 57.50 2jws h LEU 9 Cb 1.27 -0.12 -0.08 0.00 -0.44 0.00 0.00 40.66 41.29 2jws h LEU 9 CO -0.07 1.17 0.59 0.11 -4.11 0.00 0.00 178.44 176.14 2jws h LYS 10 N 0.14 0.71 0.03 0.17 1.79 -1.97 0.25 116.57 117.69 2jws h LYS 10 Ca -0.08 -0.04 -0.31 0.00 -2.18 0.00 0.00 60.65 58.04 2jws h LYS 10 Cb 1.65 -0.16 -0.04 0.00 -1.58 0.00 0.00 32.23 32.10 2jws h LYS 10 CO 0.16 0.47 -1.76 0.37 -1.08 0.00 0.00 179.45 177.60 2jws h GLN 11 N 0.73 0.07 -0.84 3.15 4.15 -1.97 -2.66 115.11 117.74 2jws h GLN 11 Ca 0.48 -0.13 0.01 0.00 0.77 0.00 0.00 58.65 59.78 2jws h GLN 11 Cb 0.74 0.05 -0.04 0.00 0.21 0.00 0.00 27.48 28.44 2jws h GLN 11 CO -0.24 0.70 0.56 0.00 -1.93 0.00 0.00 178.83 177.92 2jws h ALA 12 N 0.76 1.41 0.10 3.38 0.00 0.01 0.20 119.26 125.11 2jws h ALA 12 Ca -0.31 -0.06 -0.31 0.00 0.00 0.00 0.00 54.91 54.23 2jws h ALA 12 Cb 2.02 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 19.46 2jws h ALA 12 CO 0.09 0.54 -1.58 1.57 0.00 0.00 0.00 179.25 179.87 2jws h LYS 13 N 1.13 0.21 0.04 0.00 -0.00 -0.69 -2.58 116.57 114.68 2jws h LYS 13 Ca 0.31 -0.35 -0.00 0.00 -0.00 0.00 0.00 60.65 60.61 2jws h LYS 13 Cb -0.12 0.13 0.00 0.00 -0.00 0.00 0.00 32.23 32.25 2jws h LYS 13 CO -0.07 1.04 -0.02 0.93 -0.00 0.00 0.00 179.45 181.33 2jws h GLU 14 N 0.06 -0.06 -0.33 0.07 4.39 -1.09 1.08 114.58 118.70 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 0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 30.65 2jws h GLU 14 CO 0.14 -0.02 -0.03 1.49 -1.16 0.00 0.00 179.01 179.43 2jws h GLU 15 N -0.08 0.52 -0.35 2.33 4.81 -0.75 -1.96 114.58 119.10 2jws h GLU 15 Ca -0.01 -0.12 -0.10 0.00 -0.13 0.00 0.00 59.36 59.00 2jws h GLU 15 Cb 0.07 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.36 2jws h GLU 15 CO 0.01 0.57 -0.21 0.00 -0.73 0.00 0.00 179.01 178.66 2jws h ALA 16 N 1.47 0.99 -0.37 2.92 0.00 -0.88 -1.26 119.26 122.14 2jws h ALA 16 Ca 0.10 -0.35 0.01 0.00 0.00 0.00 0.00 54.91 54.67 2jws h ALA 16 Cb 0.38 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 2jws h ALA 16 CO 0.02 0.60 0.24 0.97 0.00 0.00 0.00 179.25 181.07 2jws h ILE 17 N 0.59 1.09 0.02 0.00 6.09 0.20 0.16 117.51 125.64 2jws h ILE 17 Ca 0.09 -0.17 -0.21 0.00 -1.37 0.00 0.00 64.86 63.20 2jws h ILE 17 Cb 0.67 0.56 -0.01 0.00 0.47 0.00 0.00 36.82 38.51 2jws h ILE 17 CO 0.05 0.09 -0.93 0.11 -3.07 0.00 0.00 178.15 174.40 2jws h LYS 18 N 0.48 0.22 0.19 2.19 1.57 -1.21 -1.97 116.57 118.04 2jws h LYS 18 Ca 0.14 -0.26 -0.00 0.00 -1.87 0.00 0.00 60.65 58.66 2jws h LYS 18 Cb -0.04 0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.34 2jws h LYS 18 CO -0.03 1.00 -0.13 0.93 -0.57 0.00 0.00 179.45 180.65 2jws h GLU 19 N 0.11 -0.31 -0.17 3.15 3.07 0.16 0.23 114.58 120.83 2jws h GLU 19 Ca -0.06 0.02 -0.16 0.00 -0.50 0.00 0.00 59.36 58.66 2jws h GLU 19 Cb 1.58 0.07 -0.01 0.00 -0.84 0.00 0.00 28.75 29.55 2jws h GLU 19 CO 0.14 -0.20 -0.57 1.25 -1.40 0.00 0.00 179.01 178.23 2jws h LEU 20 N -0.32 0.58 -1.65 1.33 5.85 -1.31 0.28 115.31 120.07 2jws h LEU 20 Ca -0.01 -0.32 -0.03 0.00 0.84 0.00 0.00 57.88 58.37 2jws h LEU 20 Cb 0.28 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.13 2jws h LEU 20 CO 0.01 1.02 -0.05 0.58 -0.34 0.00 0.00 178.44 179.66 2jws h VAL 21 N 0.39 1.11 0.08 1.05 2.07 -1.14 1.02 116.25 120.83 2jws h VAL 21 Ca 0.00 -0.44 -0.32 0.00 0.82 0.00 0.00 66.70 66.76 2jws h VAL 21 Cb 1.11 1.08 -0.03 0.00 -1.52 0.00 0.00 31.29 31.93 2jws h VAL 21 CO 0.10 0.14 -1.76 0.44 0.02 0.00 0.00 177.57 176.51 2jws h ASP 22 N 0.16 0.26 1.30 0.57 3.32 -0.74 -3.32 116.42 117.97 2jws h ASP 22 Ca 0.04 -0.50 0.00 0.00 0.02 0.00 0.00 57.03 56.58 2jws h ASP 22 Cb 0.19 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 39.66 2jws h ASP 22 CO 0.01 1.44 0.00 0.00 -1.72 0.00 0.00 179.24 178.97 2jws h ALA 23 N 0.52 1.00 -6.37 3.45 0.00 0.07 -3.49 119.26 114.44 2jws h ALA 23 Ca -0.32 0.00 -0.16 0.00 0.00 0.00 0.00 54.91 54.43 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 0.11 0.00 -1.07 0.41 0.00 0.00 0.00 179.25 178.69 2jws n GLY 24 N 0.92 0.08 0.45 0.00 0.00 0.35 -5.00 105.19 102.00 2jws n GLY 24 Ca 0.04 0.47 -0.01 0.00 0.00 0.00 0.00 46.02 46.52 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 0.68 0.00 -0.66 -0.61 -6.64 -1.25 -5.08 119.36 105.81 2jws n ILE 25 Ca -0.04 -0.10 -0.14 0.00 -1.77 0.00 0.00 62.75 60.70 2jws n ILE 25 Cb 0.57 0.11 -0.08 0.00 -1.44 0.00 0.00 39.64 38.79 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 -2.72 0.29 0.27 -1.28 0.00 -1.26 -4.70 120.51 111.11 2jws n ALA 26 Ca -0.02 -0.22 0.15 0.00 0.00 0.00 0.00 53.44 53.35 2jws n ALA 26 Cb 0.07 -1.02 0.88 0.00 0.00 0.00 0.00 19.45 19.38 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 5.08 0.00 -0.86 0.00 4.81 -1.98 -2.51 114.58 119.12 2jws h GLU 27 Ca -0.01 0.00 0.22 0.00 -0.13 0.00 0.00 59.36 59.44 2jws h GLU 27 Cb 0.54 0.00 -0.15 0.00 0.63 0.00 0.00 28.75 29.77 2jws h GLU 27 CO 0.65 0.00 0.06 -0.22 -0.73 0.00 0.00 179.01 178.78 2jws h LYS 28 N 0.00 0.09 -0.11 1.92 1.63 -2.01 1.42 116.57 119.51 2jws h LYS 28 Ca 0.03 -0.01 -0.03 0.00 -0.85 0.00 0.00 60.65 59.80 2jws h LYS 28 Cb 0.16 -0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 31.76 2jws h LYS 28 CO -0.00 0.06 -0.05 1.88 -3.45 0.00 0.00 179.45 177.89 2jws h TYR 29 N 0.10 0.15 0.00 1.91 -1.99 -1.81 0.87 116.97 116.19 2jws h TYR 29 Ca 0.51 -0.01 -0.01 0.00 2.00 0.00 0.00 58.73 61.22 2jws h TYR 29 Cb 0.98 -0.05 -0.00 0.00 2.00 0.00 0.00 36.73 39.66 2jws h TYR 29 CO -0.42 0.22 -0.02 0.97 -0.00 0.00 0.00 178.16 178.90 2jws h ILE 30 N 0.15 0.65 0.03 -2.88 2.10 0.18 -1.22 117.51 116.52 2jws h ILE 30 Ca 0.04 -0.10 -0.25 0.00 1.08 0.00 0.00 64.86 65.63 2jws h ILE 30 Cb 0.20 1.06 0.01 0.00 -1.09 0.00 0.00 36.82 37.00 2jws h ILE 30 CO 0.01 0.02 -1.03 0.50 -1.08 0.00 0.00 178.15 176.57 2jws h LYS 31 N 0.00 0.49 -0.26 2.19 3.64 -0.43 0.70 116.57 122.90 2jws h LYS 31 Ca -0.00 -0.56 -0.01 0.00 -1.27 0.00 0.00 60.65 58.81 2jws h LYS 31 Cb 0.06 0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 32.03 2jws h LYS 31 CO 0.00 1.20 0.13 -0.07 -2.27 0.00 0.00 179.45 178.45 2jws h LEU 32 N 0.26 0.31 0.05 5.20 3.38 -1.06 0.24 115.31 123.69 2jws h LEU 32 Ca -0.11 -0.02 -0.31 0.00 0.09 0.00 0.00 57.88 57.53 2jws h LEU 32 Cb 1.69 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 42.33 2jws h LEU 32 CO 0.19 0.26 -1.73 2.30 0.09 0.00 0.00 178.44 179.55 2jws n ILE 33 N -4.46 1.63 0.25 1.22 -5.35 -1.07 -3.34 119.36 108.24 2jws n ILE 33 Ca 0.01 -0.33 0.10 0.00 -0.27 0.00 0.00 62.75 62.26 2jws n ILE 33 Cb 0.10 -1.88 0.70 0.00 -1.74 0.00 0.00 39.64 36.83 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 -0.30 1.93 0.00 -1.28 0.00 0.56 0.10 119.26 120.27 2jws h ALA 34 Ca -0.42 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.48 2jws h ALA 34 Cb 1.65 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.44 2jws h ALA 34 CO -0.11 -0.05 -0.57 -1.71 0.00 0.00 0.00 179.25 176.81 2jws n ASN 35 N -4.37 0.67 0.00 0.00 5.15 0.85 -5.03 115.26 112.53 2jws n ASN 35 Ca -0.02 0.12 0.00 0.00 -0.60 0.00 0.00 54.58 54.08 2jws n ASN 35 Cb 0.13 0.11 0.00 0.00 -0.53 0.00 0.00 39.78 39.49 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 -1.79 0.00 0.00 5.20 0.00 0.02 -4.89 120.51 119.05 2jws n ALA 36 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.48 2jws n ALA 36 Cb 0.43 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.88 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 14.00 0.00 -3.35 0.00 4.81 -1.26 -4.82 118.16 127.53 2jws n LYS 37 Ca 0.00 0.00 -0.25 0.00 -0.87 0.00 0.00 58.31 57.19 2jws n LYS 37 Cb 0.00 -0.06 -0.09 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 -2.38 0.13 0.29 3.15 -4.23 -1.26 -5.01 115.64 106.34 2jws s THR 38 Ca 0.00 -2.19 -0.02 0.00 -1.18 0.00 0.00 61.69 58.31 2jws s THR 38 Cb 0.00 -1.07 0.39 0.00 1.34 0.00 0.00 72.50 73.15 2jws s THR 38 CO 0.00 -1.04 1.59 1.62 -0.54 0.00 0.00 174.62 176.25 2jws h VAL 39 N 4.77 0.10 -0.67 2.29 3.04 -1.96 1.07 116.25 124.89 2jws h VAL 39 Ca 0.19 -0.01 0.00 0.00 -1.01 0.00 0.00 66.70 65.87 2jws h VAL 39 Cb 0.95 0.06 -0.03 0.00 -2.01 0.00 0.00 31.29 30.26 2jws h VAL 39 CO 0.30 0.01 0.44 -0.33 -1.01 0.00 0.00 177.57 176.98 2jws h GLU 40 N 0.03 0.89 -0.14 4.17 4.39 -1.98 -2.59 114.58 119.36 2jws h GLU 40 Ca 0.54 -0.06 -0.04 0.00 0.34 0.00 0.00 59.36 60.14 2jws h GLU 40 Cb 1.04 -0.20 -0.00 0.00 -0.10 0.00 0.00 28.75 29.49 2jws h GLU 40 CO -0.87 0.60 -0.09 0.78 -1.16 0.00 0.00 179.01 178.27 2jws h GLY 41 N 0.91 0.33 -0.61 -3.84 0.00 0.33 -1.97 103.07 98.21 2jws h GLY 41 Ca 0.24 -0.31 0.31 0.00 0.00 0.00 0.00 47.33 47.57 2jws h GLY 41 CO -0.05 0.28 0.42 -2.08 0.00 0.00 0.00 176.54 175.11 2jws h VAL 42 N -0.06 0.24 0.02 4.60 2.07 0.94 1.98 116.25 126.04 2jws h VAL 42 Ca 0.03 -0.07 -0.21 0.00 0.82 0.00 0.00 66.70 67.27 2jws h VAL 42 Cb 0.58 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 30.33 2jws h VAL 42 CO 0.02 0.04 -0.95 -0.25 0.02 0.00 0.00 177.57 176.46 2jws h TRP 43 N 0.22 0.17 0.09 1.57 2.91 -1.38 -2.81 115.95 116.72 2jws h TRP 43 Ca 0.69 -0.11 -0.17 0.00 1.13 0.00 0.00 58.89 60.43 2jws h TRP 43 Cb 1.56 -0.01 0.02 0.00 -0.51 0.00 0.00 29.16 30.21 2jws h TRP 43 CO -0.13 0.99 -0.72 1.15 -1.03 0.00 0.00 178.44 178.70 2jws h THR 44 N 0.05 1.49 -0.49 2.65 2.02 0.17 -2.61 112.91 116.19 2jws h THR 44 Ca -0.04 -2.38 -0.00 0.00 0.77 0.00 0.00 66.41 64.76 2jws h THR 44 Cb 1.63 3.01 -0.02 0.00 -1.74 0.00 0.00 68.15 71.02 2jws h THR 44 CO 0.14 0.68 0.29 -0.07 0.37 0.00 0.00 175.52 176.93 2jws h LEU 45 N -0.30 0.58 0.58 2.58 -0.00 0.25 0.46 115.31 119.46 2jws h LEU 45 Ca -0.12 -0.03 -0.03 0.00 -0.00 0.00 0.00 57.88 57.71 2jws h LEU 45 Cb 1.52 -0.15 0.01 0.00 -0.00 0.00 0.00 40.66 42.04 2jws h LEU 45 CO 0.14 0.45 -0.28 0.50 -0.00 0.00 0.00 178.44 179.25 2jws h LYS 46 N 0.68 -0.75 -0.05 1.13 3.64 -1.55 0.85 116.57 120.52 2jws h LYS 46 Ca 0.18 0.05 0.01 0.00 -1.27 0.00 0.00 60.65 59.62 2jws h LYS 46 Cb -0.02 0.17 -0.00 0.00 -0.41 0.00 0.00 32.23 31.97 2jws h LYS 46 CO -0.03 -0.50 0.04 -0.44 -2.27 0.00 0.00 179.45 176.25 2jws h ASP 47 N -1.17 0.00 0.04 4.20 5.19 -1.33 -1.41 116.42 121.94 2jws h ASP 47 Ca -0.08 0.00 -0.00 0.00 -0.62 0.00 0.00 57.03 56.33 2jws h ASP 47 Cb 0.59 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.10 2jws h ASP 47 CO 0.13 0.00 -0.02 -0.08 -3.12 0.00 0.00 179.24 176.15 2jws h GLU 48 N 0.00 -0.05 -0.17 3.56 4.81 -0.04 -2.65 114.58 120.04 2jws h GLU 48 Ca 0.02 0.00 0.05 0.00 -0.13 0.00 0.00 59.36 59.31 2jws h GLU 48 Cb 0.10 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.48 2jws h GLU 48 CO -0.00 0.49 0.23 0.97 -0.73 0.00 0.00 179.01 179.97 2jws h ILE 49 N -0.96 0.35 0.14 2.32 6.09 0.98 0.24 117.51 126.67 2jws h ILE 49 Ca -0.01 0.00 -0.29 0.00 -1.37 0.00 0.00 64.86 63.20 2jws h ILE 49 Cb 0.56 0.81 0.01 0.00 0.47 0.00 0.00 36.82 38.66 2jws h ILE 49 CO 0.01 0.00 -1.34 0.25 -3.07 0.00 0.00 178.15 174.00 2jws h LEU 50 N 0.00 0.46 -2.09 2.19 5.85 -1.32 -3.20 115.31 117.20 2jws h LEU 50 Ca 0.08 -0.53 0.09 0.00 0.84 0.00 0.00 57.88 58.37 2jws h LEU 50 Cb 0.54 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.41 2jws h LEU 50 CO -0.00 1.42 0.29 0.74 -0.34 0.00 0.00 178.44 180.55 2jws h THR 51 N 0.08 0.57 0.00 1.05 2.02 -0.15 0.93 112.91 117.41 2jws h THR 51 Ca -0.17 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.01 2jws h THR 51 Cb 2.01 0.78 0.00 0.00 -1.74 0.00 0.00 68.15 69.20 2jws h THR 51 CO 0.20 0.00 0.00 0.33 0.37 0.00 0.00 175.52 176.42 2jws n PHE 52 N -4.02 0.00 -2.70 3.16 7.35 -1.05 -3.48 117.46 116.72 2jws n PHE 52 Ca 0.05 0.00 -0.09 0.00 -0.76 0.00 0.00 57.45 56.65 2jws n PHE 52 Cb 0.46 0.00 0.05 0.00 0.35 0.00 0.00 39.48 40.34 2jws n PHE 52 CO 0.00 0.00 0.00 -2.37 -0.76 0.00 0.00 176.76 173.63 2jws n THR 53 N -0.91 0.66 -4.19 -2.13 5.66 0.32 -5.11 114.28 108.58 2jws n THR 53 Ca 0.18 -2.71 -0.10 0.00 -3.05 0.00 0.00 64.05 58.37 2jws n THR 53 Cb 0.08 0.72 -0.03 0.00 -1.55 0.00 0.00 70.33 69.55 2jws n THR 53 CO 0.00 0.00 0.00 1.33 -3.05 0.00 0.00 175.07 173.35 2jws n VAL 54 N -0.17 0.00 -1.90 1.08 0.24 -1.10 -4.98 118.33 111.49 2jws n VAL 54 Ca 0.07 -1.06 0.00 0.00 -2.04 0.00 0.00 64.34 61.30 2jws n VAL 54 Cb 0.82 0.44 0.00 0.00 -1.47 0.00 0.00 33.84 33.62 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 -0.36-11.36 -0.20 3.34 -1.04 -1.26 -5.08 114.28 98.32 2jws n THR 55 Ca -0.00 2.70 0.00 0.00 -2.04 0.00 0.00 64.05 64.70 2jws n THR 55 Cb 0.27 -5.15 0.00 0.00 -1.82 0.00 0.00 70.33 63.63 2jws n THR 55 CO 0.00 0.00 0.00 1.21 -0.64 0.00 0.00 175.07 175.64