#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 -1.79 12.58 -2.24 -1.26 -5.01 114.28 116.56 2jws n THR 2 Ca 0.00 0.00 -0.19 0.00 -2.27 0.00 0.00 64.05 61.59 2jws n THR 2 Cb 0.00 0.00 -0.06 0.00 -2.10 0.00 0.00 70.33 68.17 2jws n THR 2 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 2jws n TYR 3 N -3.04 -0.40 0.00 4.78 4.01 -1.26 -4.43 117.16 116.82 2jws n TYR 3 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 2jws n TYR 3 Cb 0.00 -3.33 0.00 0.00 -0.31 0.00 0.00 39.34 35.70 2jws n TYR 3 CO 0.00 0.00 0.00 1.17 -0.46 0.00 0.00 176.86 177.57 2jws n LYS 4 N -2.43 0.00 -1.41 -0.72 4.81 -1.26 -5.17 118.16 111.97 2jws n LYS 4 Ca -0.20 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.24 2jws n LYS 4 Cb 0.63 -0.01 0.00 0.00 0.02 0.00 0.00 35.03 35.67 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 -1.97 -2.00 0.00 3.14 4.32 -1.26 -5.05 117.00 114.19 2jws n LEU 5 Ca 0.00 2.70 0.00 0.00 -0.02 0.00 0.00 56.01 58.69 2jws n LEU 5 Cb 0.00 -2.58 0.00 0.00 -1.62 0.00 0.00 43.42 39.22 2jws n LEU 5 CO 0.00 0.19 0.00 0.00 -1.22 0.00 0.00 177.39 176.36 2jws n ILE 6 N -1.19 0.00 0.00 -0.08 0.13 -1.26 -5.00 119.36 111.95 2jws n ILE 6 Ca 0.00 0.00 0.00 0.00 -1.10 0.00 0.00 62.75 61.65 2jws n ILE 6 Cb 0.08 0.00 0.00 0.00 -0.84 0.00 0.00 39.64 38.88 2jws n ILE 6 CO 0.00 0.00 0.00 0.18 2.80 0.00 0.00 176.55 179.53 2jws n LEU 7 N -0.95 0.00 -0.28 9.51 7.99 -1.26 -3.40 117.00 128.62 2jws n LEU 7 Ca 0.00 0.00 -0.00 0.00 -0.01 0.00 0.00 56.01 56.00 2jws n LEU 7 Cb 0.00 -0.04 0.00 0.00 -0.11 0.00 0.00 43.42 43.27 2jws n LEU 7 CO 0.00 0.00 -0.00 -3.20 -1.51 0.00 0.00 177.39 172.68 2jws n ASN 8 N 0.00 -1.54 -0.07 -1.43 2.85 -1.26 -4.87 115.26 108.94 2jws n ASN 8 Ca 0.00 -0.00 -0.19 0.00 -0.11 0.00 0.00 54.58 54.28 2jws n ASN 8 Cb 0.00 -0.55 -0.13 0.00 1.24 0.00 0.00 39.78 40.35 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 -0.01 0.08 -1.47 1.20 7.12 -1.86 -1.73 115.31 118.63 2jws h LEU 9 Ca -0.01 -0.77 0.08 0.00 0.13 0.00 0.00 57.88 57.32 2jws h LEU 9 Cb 1.00 -0.03 -0.04 0.00 -0.53 0.00 0.00 40.66 41.06 2jws h LEU 9 CO 0.01 1.33 0.45 0.11 -0.13 0.00 0.00 178.44 180.20 2jws h LYS 10 N -0.86 0.59 0.13 1.25 1.57 -1.94 -1.07 116.57 116.24 2jws h LYS 10 Ca -0.20 -0.04 -0.34 0.00 -1.87 0.00 0.00 60.65 58.20 2jws h LYS 10 Cb 1.28 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 33.45 2jws h LYS 10 CO -0.07 0.39 -1.78 0.37 -0.57 0.00 0.00 179.45 177.78 2jws h GLN 11 N 0.61 0.28 -0.84 3.15 5.75 -1.97 -2.59 115.11 119.50 2jws h GLN 11 Ca 0.31 -0.48 0.09 0.00 -0.15 0.00 0.00 58.65 58.42 2jws h GLN 11 Cb 0.40 0.18 -0.06 0.00 1.07 0.00 0.00 27.48 29.08 2jws h GLN 11 CO -0.10 1.16 0.55 0.00 -2.65 0.00 0.00 178.83 177.79 2jws h ALA 12 N 0.27 1.67 0.10 3.38 0.00 -0.82 0.19 119.26 124.06 2jws h ALA 12 Ca -0.34 -0.01 -0.31 0.00 0.00 0.00 0.00 54.91 54.25 2jws h ALA 12 Cb 2.05 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 19.63 2jws h ALA 12 CO 0.14 0.16 -1.57 1.57 0.00 0.00 0.00 179.25 179.55 2jws h LYS 13 N 0.83 0.22 0.01 0.00 -0.00 -1.34 -2.61 116.57 113.68 2jws h LYS 13 Ca 0.38 -0.37 0.00 0.00 -0.00 0.00 0.00 60.65 60.66 2jws h LYS 13 Cb 0.38 0.14 -0.00 0.00 -0.00 0.00 0.00 32.23 32.75 2jws h LYS 13 CO -0.15 1.06 -0.03 0.93 -0.00 0.00 0.00 179.45 181.26 2jws h GLU 14 N 0.06 -0.06 -0.53 0.07 4.39 -0.95 0.85 114.58 118.42 2jws h GLU 14 Ca -0.25 0.00 -0.05 0.00 0.34 0.00 0.00 59.36 59.40 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 0.15 -0.04 0.12 1.49 -1.16 0.00 0.00 179.01 179.57 2jws h GLU 15 N -0.06 0.81 -0.37 2.33 4.57 -0.79 -1.67 114.58 119.39 2jws h GLU 15 Ca 0.01 -0.17 -0.05 0.00 -1.18 0.00 0.00 59.36 57.97 2jws h GLU 15 Cb 0.06 -0.12 -0.02 0.00 -0.16 0.00 0.00 28.75 28.51 2jws h GLU 15 CO -0.02 0.73 0.00 0.00 -1.18 0.00 0.00 179.01 178.55 2jws h ALA 16 N 1.35 1.31 -0.31 2.92 0.00 -0.89 -1.46 119.26 122.18 2jws h ALA 16 Ca 0.17 -0.21 0.02 0.00 0.00 0.00 0.00 54.91 54.89 2jws h ALA 16 Cb 0.30 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 2jws h ALA 16 CO -0.00 0.47 0.16 0.82 0.00 0.00 0.00 179.25 180.70 2jws h ILE 17 N 0.56 0.99 -0.25 0.00 5.03 0.17 -0.56 117.51 123.44 2jws h ILE 17 Ca 0.12 -0.11 -0.04 0.00 -0.12 0.00 0.00 64.86 64.71 2jws h ILE 17 Cb 0.35 0.64 -0.01 0.00 -3.03 0.00 0.00 36.82 34.77 2jws h ILE 17 CO 0.01 0.06 -0.00 0.11 -0.68 0.00 0.00 178.15 177.65 2jws h LYS 18 N 0.33 0.38 0.11 2.37 1.79 -1.22 0.17 116.57 120.50 2jws h LYS 18 Ca 0.13 -0.07 0.01 0.00 -2.18 0.00 0.00 60.65 58.54 2jws h LYS 18 Cb 0.04 -0.06 -0.02 0.00 -1.58 0.00 0.00 32.23 30.61 2jws h LYS 18 CO -0.09 0.41 -0.15 0.93 -1.08 0.00 0.00 179.45 179.48 2jws h GLU 19 N 0.37 -0.29 0.00 3.15 3.07 -0.07 0.15 114.58 120.96 2jws h GLU 19 Ca 0.08 0.02 -0.18 0.00 -0.50 0.00 0.00 59.36 58.79 2jws h GLU 19 Cb 0.25 0.07 -0.02 0.00 -0.84 0.00 0.00 28.75 28.21 2jws h GLU 19 CO 0.01 -0.19 -0.82 1.25 -1.40 0.00 0.00 179.01 177.85 2jws h LEU 20 N -0.30 0.06 -1.61 1.33 5.85 -1.07 -0.11 115.31 119.45 2jws h LEU 20 Ca 0.01 -0.05 -0.03 0.00 0.84 0.00 0.00 57.88 58.66 2jws h LEU 20 Cb 0.30 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.31 2jws h LEU 20 CO -0.06 0.85 -0.07 0.58 -0.34 0.00 0.00 178.44 179.40 2jws h VAL 21 N 0.02 1.12 0.17 1.05 2.07 -0.32 1.23 116.25 121.60 2jws h VAL 21 Ca -0.02 -0.51 -0.36 0.00 0.82 0.00 0.00 66.70 66.64 2jws h VAL 21 Cb 1.44 1.12 0.00 0.00 -1.52 0.00 0.00 31.29 32.33 2jws h VAL 21 CO 0.11 0.16 -1.83 0.44 0.02 0.00 0.00 177.57 176.47 2jws h ASP 22 N 0.15 0.56 1.05 0.57 5.19 -0.56 -3.31 116.42 120.08 2jws h ASP 22 Ca 0.03 -0.94 0.00 0.00 -0.62 0.00 0.00 57.03 55.51 2jws h ASP 22 Cb 0.23 -0.18 0.00 0.00 0.18 0.00 0.00 39.33 39.56 2jws h ASP 22 CO 0.01 1.81 0.00 0.00 -3.12 0.00 0.00 179.24 177.94 2jws h ALA 23 N 0.11 1.00 -6.40 3.45 0.00 -0.61 -3.48 119.26 113.33 2jws h ALA 23 Ca -0.37 0.00 -0.35 0.00 0.00 0.00 0.00 54.91 54.19 2jws h ALA 23 Cb 2.08 0.00 0.01 0.00 0.00 0.00 0.00 17.79 19.88 2jws h ALA 23 CO 0.15 0.00 -1.06 0.41 0.00 0.00 0.00 179.25 178.75 2jws n GLY 24 N 0.51 -0.35 0.58 0.00 0.00 0.42 -5.01 105.19 101.34 2jws n GLY 24 Ca 0.03 1.05 -0.03 0.00 0.00 0.00 0.00 46.02 47.07 2jws n GLY 24 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2jws n ILE 25 N -0.73 0.00 -1.51 -0.61 -0.00 -1.24 -5.06 119.36 110.21 2jws n ILE 25 Ca -0.10 -0.41 -0.35 0.00 -0.00 0.00 0.00 62.75 61.88 2jws n ILE 25 Cb 0.65 0.21 -0.14 0.00 -0.00 0.00 0.00 39.64 40.37 2jws n ILE 25 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 2jws n ALA 26 N -2.59 0.53 -0.07 -1.39 0.00 -1.26 -4.71 120.51 111.03 2jws n ALA 26 Ca -0.02 -0.56 0.24 0.00 0.00 0.00 0.00 53.44 53.11 2jws n ALA 26 Cb 0.11 -2.51 0.58 0.00 0.00 0.00 0.00 19.45 17.62 2jws n ALA 26 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 2jws h GLU 27 N 13.20 0.00 -0.95 0.00 4.11 -1.97 -1.13 114.58 127.85 2jws h GLU 27 Ca -0.06 0.00 0.24 0.00 0.07 0.00 0.00 59.36 59.60 2jws h GLU 27 Cb 1.25 0.00 -0.18 0.00 0.50 0.00 0.00 28.75 30.33 2jws h GLU 27 CO 1.37 0.00 -0.05 0.87 0.07 0.00 0.00 179.01 181.28 2jws h LYS 28 N 0.00 0.02 -0.29 1.06 6.56 -2.01 1.86 116.57 123.76 2jws h LYS 28 Ca 0.35 -0.00 0.02 0.00 -1.06 0.00 0.00 60.65 59.96 2jws h LYS 28 Cb 2.09 -0.00 -0.02 0.00 -0.57 0.00 0.00 32.23 33.73 2jws h LYS 28 CO -0.00 0.01 0.20 1.88 -2.06 0.00 0.00 179.45 179.48 2jws h TYR 29 N 0.02 0.30 0.00 -1.35 0.05 -1.57 0.29 116.97 114.71 2jws h TYR 29 Ca 0.54 0.01 -0.02 0.00 0.05 0.00 0.00 58.73 59.31 2jws h TYR 29 Cb 1.02 -0.10 -0.00 0.00 1.01 0.00 0.00 36.73 38.66 2jws h TYR 29 CO -0.55 0.18 -0.07 0.82 -1.05 0.00 0.00 178.16 177.48 2jws h ILE 30 N 0.32 0.72 -0.06 -2.88 2.04 0.27 -1.44 117.51 116.47 2jws h ILE 30 Ca 0.12 -0.29 -0.20 0.00 1.00 0.00 0.00 64.86 65.48 2jws h ILE 30 Cb 0.08 1.17 0.00 0.00 -0.74 0.00 0.00 36.82 37.34 2jws h ILE 30 CO -0.03 0.07 -0.81 0.50 0.00 0.00 0.00 178.15 177.89 2jws h LYS 31 N 0.00 0.47 -0.36 2.37 3.64 -0.09 1.28 116.57 123.88 2jws h LYS 31 Ca -0.00 -0.42 -0.02 0.00 -1.27 0.00 0.00 60.65 58.94 2jws h LYS 31 Cb 0.17 0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.07 2jws h LYS 31 CO 0.01 1.06 0.16 -0.07 -2.27 0.00 0.00 179.45 178.34 2jws h LEU 32 N 0.30 0.45 0.06 5.20 3.38 -1.07 0.29 115.31 123.92 2jws h LEU 32 Ca -0.05 -0.04 -0.33 0.00 0.09 0.00 0.00 57.88 57.55 2jws h LEU 32 Cb 1.42 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 42.02 2jws h LEU 32 CO 0.14 0.41 -1.82 2.30 0.09 0.00 0.00 178.44 179.56 2jws n ILE 33 N -4.40 1.64 0.19 1.22 -5.35 -1.10 -3.94 119.36 107.62 2jws n ILE 33 Ca 0.02 -0.39 0.06 0.00 -0.27 0.00 0.00 62.75 62.18 2jws n ILE 33 Cb 0.13 -1.84 0.55 0.00 -1.74 0.00 0.00 39.64 36.74 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 -0.25 1.84 -0.00 -1.28 0.00 0.17 0.15 119.26 119.90 2jws h ALA 34 Ca -0.44 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.42 2jws h ALA 34 Cb 1.71 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.45 2jws h ALA 34 CO -0.09 0.13 -0.02 -1.71 0.00 0.00 0.00 179.25 177.56 2jws n ASN 35 N -4.46 0.19 0.00 0.00 5.15 0.10 -4.98 115.26 111.25 2jws n ASN 35 Ca -0.02 -0.63 0.00 0.00 -0.60 0.00 0.00 54.58 53.33 2jws n ASN 35 Cb 0.13 -0.12 0.00 0.00 -0.53 0.00 0.00 39.78 39.26 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 -1.02 0.00 -0.39 5.20 0.00 0.04 -4.83 120.51 119.50 2jws n ALA 36 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.62 2jws n ALA 36 Cb 0.21 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.66 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 14.00 0.00 -2.75 0.00 4.76 -1.26 -4.80 118.16 128.10 2jws n LYS 37 Ca 0.00 0.00 -0.08 0.00 -2.87 0.00 0.00 58.31 55.36 2jws n LYS 37 Cb 0.00 -2.37 0.04 0.00 -1.84 0.00 0.00 35.03 30.86 2jws n LYS 37 CO 0.00 0.00 0.00 0.25 -1.37 0.00 0.00 177.40 176.28 2jws n THR 38 N -2.00 -0.00 -0.34 -0.18 -2.24 -1.26 -5.03 114.28 103.23 2jws n THR 38 Ca 0.00 -1.44 0.05 0.00 -2.27 0.00 0.00 64.05 60.38 2jws n THR 38 Cb 0.00 1.41 0.12 0.00 -2.10 0.00 0.00 70.33 69.76 2jws n THR 38 CO 0.00 0.00 0.00 0.55 -0.57 0.00 0.00 175.07 175.05 2jws n VAL 39 N 1.83 -0.41 -0.23 2.28 3.14 -1.26 0.13 118.33 123.81 2jws n VAL 39 Ca 0.10 2.15 -0.06 0.00 -2.96 0.00 0.00 64.34 63.57 2jws n VAL 39 Cb 0.62 -2.95 0.04 0.00 -1.06 0.00 0.00 33.84 30.49 2jws n VAL 39 CO 0.00 0.00 0.00 -0.33 -6.46 0.00 0.00 176.83 170.04 2jws h GLU 40 N 0.00 0.87 -0.25 1.45 4.39 -1.94 -2.68 114.58 116.41 2jws h GLU 40 Ca 0.43 -0.08 -0.05 0.00 0.34 0.00 0.00 59.36 60.00 2jws h GLU 40 Cb 0.66 -0.18 -0.01 0.00 -0.10 0.00 0.00 28.75 29.13 2jws h GLU 40 CO -0.96 0.63 -0.03 0.78 -1.16 0.00 0.00 179.01 178.27 2jws h GLY 41 N 0.86 0.50 -0.43 -3.84 0.00 0.60 -1.76 103.07 98.99 2jws h GLY 41 Ca 0.23 -0.39 0.31 0.00 0.00 0.00 0.00 47.33 47.47 2jws h GLY 41 CO -0.04 0.36 0.61 -2.08 0.00 0.00 0.00 176.54 175.38 2jws h VAL 42 N 0.21 0.37 0.03 4.60 2.07 0.13 2.13 116.25 125.80 2jws h VAL 42 Ca 0.07 -0.13 -0.22 0.00 0.82 0.00 0.00 66.70 67.24 2jws h VAL 42 Cb 0.48 -0.04 -0.02 0.00 -1.52 0.00 0.00 31.29 30.19 2jws h VAL 42 CO 0.02 0.07 -1.00 -0.25 0.02 0.00 0.00 177.57 176.43 2jws h TRP 43 N 0.38 0.21 0.01 1.57 2.91 -1.28 -2.74 115.95 117.01 2jws h TRP 43 Ca 0.70 -0.14 -0.00 0.00 1.13 0.00 0.00 58.89 60.59 2jws h TRP 43 Cb 1.61 -0.02 0.00 0.00 -0.51 0.00 0.00 29.16 30.24 2jws h TRP 43 CO -0.01 1.04 -0.01 1.15 -1.03 0.00 0.00 178.44 179.58 2jws h THR 44 N 0.05 1.54 -0.62 2.65 2.02 0.19 -2.66 112.91 116.08 2jws h THR 44 Ca -0.05 -1.97 0.08 0.00 0.77 0.00 0.00 66.41 65.25 2jws h THR 44 Cb 1.69 2.82 -0.04 0.00 -1.74 0.00 0.00 68.15 70.88 2jws h THR 44 CO 0.15 0.49 0.42 -0.07 0.37 0.00 0.00 175.52 176.87 2jws h LEU 45 N -0.90 0.46 0.54 2.58 3.38 0.28 0.44 115.31 122.09 2jws h LEU 45 Ca -0.00 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.95 2jws h LEU 45 Cb 0.81 -0.09 0.01 0.00 0.09 0.00 0.00 40.66 41.47 2jws h LEU 45 CO 0.00 0.29 -0.26 0.50 0.09 0.00 0.00 178.44 179.06 2jws h LYS 46 N 0.52 -0.69 0.00 1.13 3.64 -1.55 0.93 116.57 120.55 2jws h LYS 46 Ca 0.28 0.05 -0.02 0.00 -1.27 0.00 0.00 60.65 59.69 2jws h LYS 46 Cb 0.42 0.16 -0.00 0.00 -0.41 0.00 0.00 32.23 32.40 2jws h LYS 46 CO -0.09 -0.40 -0.10 0.38 -2.27 0.00 0.00 179.45 176.97 2jws h ASP 47 N -1.10 0.00 0.00 4.20 3.04 -1.12 -1.74 116.42 119.70 2jws h ASP 47 Ca -0.07 0.00 -0.00 0.00 -3.24 0.00 0.00 57.03 53.72 2jws h ASP 47 Cb 0.61 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.90 2jws h ASP 47 CO 0.12 0.10 -0.00 -0.08 -2.04 0.00 0.00 179.24 177.34 2jws h GLU 48 N 0.00 -0.00 -0.11 4.15 4.81 -0.05 -2.66 114.58 120.72 2jws h GLU 48 Ca -0.00 0.00 0.03 0.00 -0.13 0.00 0.00 59.36 59.26 2jws h GLU 48 Cb 0.21 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.58 2jws h GLU 48 CO 0.01 0.87 0.15 0.97 -0.73 0.00 0.00 179.01 180.28 2jws h ILE 49 N -1.00 0.37 0.12 2.32 6.09 0.11 0.12 117.51 125.64 2jws h ILE 49 Ca -0.00 0.00 -0.29 0.00 -1.37 0.00 0.00 64.86 63.20 2jws h ILE 49 Cb 0.87 0.87 -0.00 0.00 0.47 0.00 0.00 36.82 39.03 2jws h ILE 49 CO 0.00 0.00 -1.37 0.25 -3.07 0.00 0.00 178.15 173.96 2jws h LEU 50 N 0.00 0.40 -1.00 2.19 5.85 -1.39 -3.23 115.31 118.13 2jws h LEU 50 Ca 0.05 -0.48 0.00 0.00 0.84 0.00 0.00 57.88 58.29 2jws h LEU 50 Cb 0.35 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.25 2jws h LEU 50 CO -0.00 1.39 0.00 0.41 -0.34 0.00 0.00 178.44 179.89 2jws n THR 51 N -3.49 0.96 -0.31 1.05 -1.04 0.37 -2.49 114.28 109.33 2jws n THR 51 Ca -0.12 0.47 -0.14 0.00 -2.04 0.00 0.00 64.05 62.22 2jws n THR 51 Cb 1.03 -1.43 0.10 0.00 -1.82 0.00 0.00 70.33 68.21 2jws n THR 51 CO 0.00 0.00 0.00 2.22 -0.64 0.00 0.00 175.07 176.65 2jws n PHE 52 N -2.22 1.73 -2.68 -1.42 -1.74 -0.98 -4.29 117.46 105.87 2jws n PHE 52 Ca 0.00 -1.33 -0.05 0.00 -0.56 0.00 0.00 57.45 55.52 2jws n PHE 52 Cb 0.13 -0.67 0.07 0.00 1.52 0.00 0.00 39.48 40.53 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 -0.38 0.00 -3.53 1.97 -1.04 -1.04 -5.10 114.28 105.17 2jws n THR 53 Ca 0.34 -0.72 -0.13 0.00 -2.04 0.00 0.00 64.05 61.49 2jws n THR 53 Cb 1.11 1.09 -0.04 0.00 -1.82 0.00 0.00 70.33 70.67 2jws n THR 53 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 2jws s VAL 54 N 0.24 0.02 0.01 12.58 0.11 -1.26 -5.02 120.40 127.08 2jws s VAL 54 Ca 0.27 -0.18 -0.06 0.00 -2.93 0.00 0.00 61.98 59.07 2jws s VAL 54 Cb 0.20 -1.01 -0.04 0.00 -1.53 0.00 0.00 36.38 34.01 2jws s VAL 54 CO -0.10 -0.10 1.10 0.74 -3.33 0.00 0.00 175.10 173.40 2jws h THR 55 N 2.51 0.00 0.00 5.04 2.02 -1.97 -3.52 112.91 116.99 2jws h THR 55 Ca -0.32 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.86 2jws h THR 55 Cb 1.24 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.65 2jws h THR 55 CO 0.41 0.00 0.00 1.21 0.37 0.00 0.00 175.52 177.51