#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 0.80 -0.05 12.58 -4.23 -1.26 -5.04 115.64 118.45 2jws s THR 2 Ca 0.00 -0.67 0.01 0.00 -1.18 0.00 0.00 61.69 59.85 2jws s THR 2 Cb 0.00 -0.72 -0.03 0.00 1.34 0.00 0.00 72.50 73.09 2jws s THR 2 CO 0.00 0.06 -0.04 0.00 -0.54 0.00 0.00 174.62 174.10 2jws n TYR 3 N 2.36 0.00 -2.90 3.99 4.11 -1.26 -5.08 117.16 118.39 2jws n TYR 3 Ca -0.16 0.00 -0.04 0.00 -0.00 0.00 0.00 57.90 57.69 2jws n TYR 3 Cb 0.56 -0.19 0.02 0.00 -0.00 0.00 0.00 39.34 39.73 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 -2.59 -1.41 0.09 -3.48 0.00 -1.26 -4.98 118.16 104.53 2jws n LYS 4 Ca -0.08 1.15 0.00 0.00 0.00 0.00 0.00 58.31 59.38 2jws n LYS 4 Cb 0.60 -5.20 0.00 0.00 0.00 0.00 0.00 35.03 30.43 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 -2.12 -0.10 -4.39 3.14 4.32 -1.26 -5.11 117.00 111.48 2jws n LEU 5 Ca -0.02 0.30 -0.32 0.00 -0.02 0.00 0.00 56.01 55.95 2jws n LEU 5 Cb 0.54 0.25 -0.14 0.00 -1.62 0.00 0.00 43.42 42.44 2jws n LEU 5 CO 0.47 -0.67 -0.51 -0.63 -1.22 0.00 0.00 177.39 174.83 2jws s ILE 6 N -2.00 2.54 0.03 -0.08 1.01 -1.26 -5.05 121.20 116.39 2jws s ILE 6 Ca 0.00 -0.95 0.00 0.00 0.00 0.00 0.00 60.65 59.70 2jws s ILE 6 Cb 0.00 -1.95 0.00 0.00 0.01 0.00 0.00 42.46 40.52 2jws s ILE 6 CO 0.00 0.56 0.00 0.18 0.00 0.00 0.00 174.94 175.68 2jws n LEU 7 N 2.31 0.00 0.00 2.97 4.77 -1.26 -4.92 117.00 120.87 2jws n LEU 7 Ca -0.17 0.13 0.00 0.00 -0.03 0.00 0.00 56.01 55.94 2jws n LEU 7 Cb 0.52 -0.35 0.00 0.00 -2.33 0.00 0.00 43.42 41.25 2jws n LEU 7 CO 0.24 -1.09 0.00 -3.20 -1.33 0.00 0.00 177.39 172.02 2jws n ASN 8 N -1.79 0.00 -0.01 -1.43 5.15 -1.26 -5.01 115.26 110.91 2jws n ASN 8 Ca 0.00 0.00 -0.16 0.00 -0.60 0.00 0.00 54.58 53.82 2jws n ASN 8 Cb 0.05 0.00 -0.12 0.00 -0.53 0.00 0.00 39.78 39.19 2jws n ASN 8 CO 0.00 0.00 0.00 0.25 1.40 0.00 0.00 177.26 178.91 2jws h LEU 9 N 0.00 0.33 -1.23 1.20 6.46 -1.91 -0.32 115.31 119.84 2jws h LEU 9 Ca 0.00 -0.79 0.17 0.00 -0.12 0.00 0.00 57.88 57.13 2jws h LEU 9 Cb 0.00 -0.10 -0.08 0.00 -0.73 0.00 0.00 40.66 39.75 2jws h LEU 9 CO 0.00 1.08 0.60 0.11 -0.62 0.00 0.00 178.44 179.61 2jws h LYS 10 N -0.38 0.67 0.00 1.25 1.57 -1.97 0.50 116.57 118.20 2jws h LYS 10 Ca -0.05 -0.04 -0.25 0.00 -1.87 0.00 0.00 60.65 58.44 2jws h LYS 10 Cb 1.15 -0.15 -0.04 0.00 0.08 0.00 0.00 32.23 33.27 2jws h LYS 10 CO 0.08 0.44 -1.46 0.37 -0.57 0.00 0.00 179.45 178.31 2jws h GLN 11 N 0.69 0.00 -0.52 3.15 4.15 -1.99 -2.63 115.11 117.96 2jws h GLN 11 Ca 0.49 0.00 -0.05 0.00 0.77 0.00 0.00 58.65 59.87 2jws h GLN 11 Cb 0.84 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.50 2jws h GLN 11 CO -0.25 0.57 0.13 0.00 -1.93 0.00 0.00 178.83 177.34 2jws h ALA 12 N 1.09 1.25 0.12 3.38 0.00 0.56 -0.30 119.26 125.35 2jws h ALA 12 Ca -0.19 -0.20 -0.32 0.00 0.00 0.00 0.00 54.91 54.20 2jws h ALA 12 Cb 1.87 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 19.44 2jws h ALA 12 CO 0.08 0.52 -1.61 1.57 0.00 0.00 0.00 179.25 179.81 2jws h LYS 13 N 0.76 0.26 0.00 0.00 -0.00 -1.09 -2.51 116.57 114.00 2jws h LYS 13 Ca 0.17 -0.44 0.00 0.00 -0.00 0.00 0.00 60.65 60.38 2jws h LYS 13 Cb 0.28 0.16 -0.00 0.00 -0.00 0.00 0.00 32.23 32.67 2jws h LYS 13 CO -0.00 1.12 -0.01 1.05 -0.00 0.00 0.00 179.45 181.61 2jws h GLU 14 N 0.07 -0.01 -0.44 0.07 4.11 -1.28 0.81 114.58 117.90 2jws h GLU 14 Ca -0.27 0.00 -0.07 0.00 0.07 0.00 0.00 59.36 59.09 2jws h GLU 14 Cb 2.03 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 31.26 2jws h GLU 14 CO 0.15 -0.01 -0.01 1.49 0.07 0.00 0.00 179.01 180.71 2jws h GLU 15 N -0.01 0.72 -0.31 1.06 4.57 -1.19 -1.90 114.58 117.50 2jws h GLU 15 Ca 0.00 -0.19 -0.06 0.00 -1.18 0.00 0.00 59.36 57.94 2jws h GLU 15 Cb 0.02 -0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 28.50 2jws h GLU 15 CO -0.00 0.74 -0.05 0.00 -1.18 0.00 0.00 179.01 178.52 2jws h ALA 16 N 1.32 1.34 -0.43 2.92 0.00 -0.86 -0.88 119.26 122.67 2jws h ALA 16 Ca 0.13 -0.22 0.01 0.00 0.00 0.00 0.00 54.91 54.83 2jws h ALA 16 Cb 0.43 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 2jws h ALA 16 CO 0.02 0.45 0.28 0.82 0.00 0.00 0.00 179.25 180.81 2jws h ILE 17 N 0.47 1.10 -0.20 0.00 5.03 0.14 -1.05 117.51 122.99 2jws h ILE 17 Ca 0.10 -0.19 -0.07 0.00 -0.12 0.00 0.00 64.86 64.58 2jws h ILE 17 Cb 0.38 0.48 -0.01 0.00 -3.03 0.00 0.00 36.82 34.64 2jws h ILE 17 CO 0.02 0.10 -0.16 0.11 -0.68 0.00 0.00 178.15 177.54 2jws h LYS 18 N 0.57 0.34 0.07 2.37 1.57 -1.19 0.22 116.57 120.51 2jws h LYS 18 Ca 0.16 -0.10 0.02 0.00 -1.87 0.00 0.00 60.65 58.86 2jws h LYS 18 Cb -0.05 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.19 2jws h LYS 18 CO -0.04 0.51 -0.16 0.93 -0.57 0.00 0.00 179.45 180.12 2jws h GLU 19 N 0.32 -0.29 0.03 3.15 3.07 0.10 0.14 114.58 121.10 2jws h GLU 19 Ca 0.06 0.02 -0.22 0.00 -0.50 0.00 0.00 59.36 58.72 2jws h GLU 19 Cb 0.48 0.07 -0.01 0.00 -0.84 0.00 0.00 28.75 28.45 2jws h GLU 19 CO 0.03 -0.19 -0.98 1.25 -1.40 0.00 0.00 179.01 177.72 2jws h LEU 20 N -0.30 0.25 -1.59 1.33 5.85 -1.27 0.13 115.31 119.70 2jws h LEU 20 Ca 0.03 -0.22 -0.03 0.00 0.84 0.00 0.00 57.88 58.50 2jws h LEU 20 Cb 0.33 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.27 2jws h LEU 20 CO -0.11 1.08 -0.07 0.58 -0.34 0.00 0.00 178.44 179.59 2jws h VAL 21 N 0.08 1.12 0.08 1.05 2.07 -0.71 1.18 116.25 121.12 2jws h VAL 21 Ca -0.06 -0.52 -0.35 0.00 0.82 0.00 0.00 66.70 66.59 2jws h VAL 21 Cb 1.65 1.12 -0.03 0.00 -1.52 0.00 0.00 31.29 32.51 2jws h VAL 21 CO 0.15 0.16 -1.94 -0.67 0.02 0.00 0.00 177.57 175.29 2jws n ASP 22 N -4.36 1.73 0.12 0.57 2.03 0.46 -3.97 116.55 113.12 2jws n ASP 22 Ca -0.01 0.25 0.13 0.00 0.52 0.00 0.00 54.79 55.68 2jws n ASP 22 Cb 0.20 -0.59 0.43 0.00 -0.72 0.00 0.00 41.12 40.45 2jws n ASP 22 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2jws n ALA 23 N -2.88 2.10 -2.78 -1.67 0.00 0.03 -5.00 120.51 110.30 2jws n ALA 23 Ca -0.28 0.01 -0.03 0.00 0.00 0.00 0.00 53.44 53.14 2jws n ALA 23 Cb 1.05 -1.45 -0.02 0.00 0.00 0.00 0.00 19.45 19.03 2jws n ALA 23 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jws n GLY 24 N 0.92 -2.63 0.00 0.00 0.00 0.40 -5.02 105.19 98.87 2jws n GLY 24 Ca 0.05 0.83 0.00 0.00 0.00 0.00 0.00 46.02 46.89 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 2.13 0.00 -1.51 -0.61 -5.35 -1.25 -5.06 119.36 107.71 2jws n ILE 25 Ca -0.19 0.00 -0.31 0.00 -0.27 0.00 0.00 62.75 61.98 2jws n ILE 25 Cb 0.30 0.00 -0.16 0.00 -1.74 0.00 0.00 39.64 38.03 2jws n ILE 25 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2jws n ALA 26 N -3.00 0.67 0.08 -1.28 0.00 -1.26 -4.71 120.51 111.00 2jws n ALA 26 Ca 0.00 -0.63 0.21 0.00 0.00 0.00 0.00 53.44 53.01 2jws n ALA 26 Cb 0.00 -2.48 0.74 0.00 0.00 0.00 0.00 19.45 17.71 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 12.33 0.00 -0.85 0.00 4.11 -1.98 -0.78 114.58 127.41 2jws h GLU 27 Ca -0.03 0.00 0.22 0.00 0.07 0.00 0.00 59.36 59.62 2jws h GLU 27 Cb 1.21 0.00 -0.13 0.00 0.50 0.00 0.00 28.75 30.33 2jws h GLU 27 CO 1.43 0.00 0.21 -0.22 0.07 0.00 0.00 179.01 180.51 2jws h LYS 28 N 0.00 0.21 -0.17 1.06 1.63 -2.01 1.22 116.57 118.52 2jws h LYS 28 Ca 0.21 -0.01 -0.02 0.00 -0.85 0.00 0.00 60.65 59.98 2jws h LYS 28 Cb 1.14 -0.05 -0.01 0.00 -0.60 0.00 0.00 32.23 32.71 2jws h LYS 28 CO -0.00 0.14 0.03 1.88 -3.45 0.00 0.00 179.45 178.05 2jws h TYR 29 N 0.22 0.23 0.00 1.91 -1.99 -1.51 0.19 116.97 116.02 2jws h TYR 29 Ca 0.52 -0.00 -0.00 0.00 2.00 0.00 0.00 58.73 61.24 2jws h TYR 29 Cb 1.01 -0.07 -0.00 0.00 2.00 0.00 0.00 36.73 39.66 2jws h TYR 29 CO -0.27 0.21 -0.02 0.82 -0.00 0.00 0.00 178.16 178.90 2jws h ILE 30 N 0.23 0.66 -0.04 -2.88 2.04 0.14 -0.94 117.51 116.72 2jws h ILE 30 Ca 0.06 -0.08 -0.23 0.00 1.00 0.00 0.00 64.86 65.61 2jws h ILE 30 Cb 0.11 1.05 0.01 0.00 -0.74 0.00 0.00 36.82 37.24 2jws h ILE 30 CO -0.00 0.02 -0.89 0.50 0.00 0.00 0.00 178.15 177.77 2jws h LYS 31 N 0.00 0.55 -0.33 2.37 1.63 -0.30 1.01 116.57 121.50 2jws h LYS 31 Ca -0.00 -0.53 -0.00 0.00 -0.85 0.00 0.00 60.65 59.27 2jws h LYS 31 Cb 0.05 0.14 -0.02 0.00 -0.60 0.00 0.00 32.23 31.80 2jws h LYS 31 CO 0.00 1.16 0.19 -0.07 -3.45 0.00 0.00 179.45 177.28 2jws h LEU 32 N 0.33 0.39 0.04 5.20 3.38 -1.00 0.28 115.31 123.94 2jws h LEU 32 Ca -0.08 -0.02 -0.31 0.00 0.09 0.00 0.00 57.88 57.57 2jws h LEU 32 Cb 1.52 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 42.14 2jws h LEU 32 CO 0.16 0.31 -1.69 2.30 0.09 0.00 0.00 178.44 179.61 2jws n ILE 33 N -4.46 1.60 0.20 1.22 -5.35 -1.07 -3.49 119.36 108.02 2jws n ILE 33 Ca 0.02 -0.27 0.11 0.00 -0.27 0.00 0.00 62.75 62.34 2jws n ILE 33 Cb 0.09 -1.91 0.68 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 -0.37 2.07 0.00 -1.28 0.00 0.12 0.16 119.26 119.96 2jws h ALA 34 Ca -0.43 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.48 2jws h ALA 34 Cb 1.58 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.38 2jws h ALA 34 CO -0.15 -0.15 -0.33 -1.71 0.00 0.00 0.00 179.25 176.91 2jws n ASN 35 N -4.43 0.55 0.00 0.00 2.85 0.99 -5.02 115.26 110.20 2jws n ASN 35 Ca -0.00 0.23 0.00 0.00 -0.11 0.00 0.00 54.58 54.70 2jws n ASN 35 Cb 0.21 -0.18 0.00 0.00 1.24 0.00 0.00 39.78 41.05 2jws n ASN 35 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2jws n ALA 36 N -1.69 0.00 0.00 5.20 0.00 0.56 -4.89 120.51 119.69 2jws n ALA 36 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.49 2jws n ALA 36 Cb 0.40 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.85 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 -3.32 0.00 3.00 -1.26 -4.80 118.16 125.78 2jws n LYS 37 Ca 0.00 0.00 -0.23 0.00 -0.00 0.00 0.00 58.31 58.08 2jws n LYS 37 Cb 0.00 -0.06 -0.09 0.00 0.00 0.00 0.00 35.03 34.88 2jws n LYS 37 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.40 178.35 2jws s THR 38 N -2.41 0.04 0.28 3.15 -4.23 -1.26 -5.01 115.64 106.20 2jws s THR 38 Ca 0.00 -2.05 -0.05 0.00 -1.18 0.00 0.00 61.69 58.41 2jws s THR 38 Cb 0.00 -0.99 0.43 0.00 1.34 0.00 0.00 72.50 73.28 2jws s THR 38 CO 0.00 -0.95 1.57 1.62 -0.54 0.00 0.00 174.62 176.32 2jws h VAL 39 N 4.80 0.03 -0.78 2.29 3.04 -1.95 1.19 116.25 124.86 2jws h VAL 39 Ca 0.18 -0.00 -0.02 0.00 -1.01 0.00 0.00 66.70 65.85 2jws h VAL 39 Cb 0.97 0.03 -0.04 0.00 -2.01 0.00 0.00 31.29 30.24 2jws h VAL 39 CO 0.28 0.00 0.43 -0.33 -1.01 0.00 0.00 177.57 176.94 2jws h GLU 40 N 0.00 1.08 -0.14 4.17 4.39 -1.97 -2.73 114.58 119.39 2jws h GLU 40 Ca 0.51 -0.13 -0.04 0.00 0.34 0.00 0.00 59.36 60.04 2jws h GLU 40 Cb 0.88 -0.21 -0.00 0.00 -0.10 0.00 0.00 28.75 29.31 2jws h GLU 40 CO -0.97 0.80 -0.06 0.78 -1.16 0.00 0.00 179.01 178.41 2jws h GLY 41 N 1.08 0.32 -0.62 -3.84 0.00 0.59 -1.66 103.07 98.94 2jws h GLY 41 Ca 0.27 -0.28 0.31 0.00 0.00 0.00 0.00 47.33 47.63 2jws h GLY 41 CO -0.04 0.25 0.42 -2.08 0.00 0.00 0.00 176.54 175.09 2jws h VAL 42 N -0.03 0.23 0.02 4.60 2.07 0.81 2.08 116.25 126.02 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 0.51 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 30.26 2jws h VAL 42 CO 0.02 0.04 -0.96 -0.25 0.02 0.00 0.00 177.57 176.43 2jws h TRP 43 N 0.21 0.13 0.02 1.57 2.91 -1.36 -2.85 115.95 116.58 2jws h TRP 43 Ca 0.69 -0.08 -0.03 0.00 1.13 0.00 0.00 58.89 60.60 2jws h TRP 43 Cb 1.56 -0.01 0.00 0.00 -0.51 0.00 0.00 29.16 30.21 2jws h TRP 43 CO -0.13 0.99 -0.11 1.15 -1.03 0.00 0.00 178.44 179.31 2jws h THR 44 N 0.03 1.73 -0.65 2.65 2.02 0.19 -2.62 112.91 116.26 2jws h THR 44 Ca -0.03 -2.27 0.08 0.00 0.77 0.00 0.00 66.41 64.95 2jws h THR 44 Cb 1.67 3.26 -0.04 0.00 -1.74 0.00 0.00 68.15 71.30 2jws h THR 44 CO 0.14 0.60 0.43 -0.07 0.37 0.00 0.00 175.52 176.99 2jws h LEU 45 N -0.86 0.50 0.61 2.58 3.38 0.27 0.53 115.31 122.32 2jws h LEU 45 Ca -0.02 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.93 2jws h LEU 45 Cb 1.05 -0.10 0.01 0.00 0.09 0.00 0.00 40.66 41.70 2jws h LEU 45 CO 0.02 0.31 -0.29 0.50 0.09 0.00 0.00 178.44 179.07 2jws h LYS 46 N 0.57 -0.79 -0.36 1.13 3.64 -1.57 0.80 116.57 119.99 2jws h LYS 46 Ca 0.29 0.05 0.04 0.00 -1.27 0.00 0.00 60.65 59.76 2jws h LYS 46 Cb 0.41 0.18 -0.02 0.00 -0.41 0.00 0.00 32.23 32.39 2jws h LYS 46 CO -0.09 -0.52 0.24 0.22 -2.27 0.00 0.00 179.45 177.03 2jws h ASP 47 N -1.21 0.29 0.07 4.20 3.58 -1.12 -0.36 116.42 121.87 2jws h ASP 47 Ca -0.08 -0.00 -0.00 0.00 0.42 0.00 0.00 57.03 57.36 2jws h ASP 47 Cb 0.63 -0.07 0.00 0.00 1.72 0.00 0.00 39.33 41.62 2jws h ASP 47 CO 0.14 0.20 -0.03 -0.08 -2.88 0.00 0.00 179.24 176.58 2jws h GLU 48 N 0.34 -0.09 -0.07 0.28 4.81 0.09 -2.66 114.58 117.27 2jws h GLU 48 Ca 0.15 0.01 0.02 0.00 -0.13 0.00 0.00 59.36 59.41 2jws h GLU 48 Cb 0.18 0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.57 2jws h GLU 48 CO -0.03 0.45 0.10 0.97 -0.73 0.00 0.00 179.01 179.76 2jws h ILE 49 N -0.90 0.41 0.09 2.32 6.09 0.90 0.10 117.51 126.50 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 0.59 0.92 0.00 0.00 0.47 0.00 0.00 36.82 38.80 2jws h ILE 49 CO 0.02 0.00 -1.14 0.25 -3.07 0.00 0.00 178.15 174.21 2jws h LEU 50 N 0.00 0.40 -1.52 2.19 5.85 -1.11 -3.22 115.31 117.89 2jws h LEU 50 Ca 0.03 -0.39 0.05 0.00 0.84 0.00 0.00 57.88 58.40 2jws h LEU 50 Cb 0.22 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.09 2jws h LEU 50 CO -0.00 1.27 0.38 0.74 -0.34 0.00 0.00 178.44 180.49 2jws h THR 51 N 0.10 1.03 0.00 1.05 2.02 -0.43 -2.60 112.91 114.08 2jws h THR 51 Ca -0.11 -0.21 -0.43 0.00 0.77 0.00 0.00 66.41 66.43 2jws h THR 51 Cb 1.84 0.37 0.01 0.00 -1.74 0.00 0.00 68.15 68.63 2jws h THR 51 CO 0.18 0.11 2.49 0.33 0.37 0.00 0.00 175.52 179.00 2jws n PHE 52 N -4.47 1.46 0.00 3.16 -0.00 -1.07 -3.72 117.46 112.81 2jws n PHE 52 Ca 0.07 -2.19 0.00 0.00 -0.00 0.00 0.00 57.45 55.33 2jws n PHE 52 Cb 0.19 -1.89 0.00 0.00 -0.00 0.00 0.00 39.48 37.78 2jws n PHE 52 CO 0.00 0.00 0.00 2.41 -0.00 0.00 0.00 176.76 179.17 2jws n THR 53 N 3.66 0.00 -2.03 -2.13 -1.04 -1.19 -5.03 114.28 106.51 2jws n THR 53 Ca 0.54 0.00 -0.41 0.00 -2.04 0.00 0.00 64.05 62.14 2jws n THR 53 Cb 0.28 0.00 -0.01 0.00 -1.82 0.00 0.00 70.33 68.78 2jws n THR 53 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 2jws n VAL 54 N 0.00 3.26 0.00 12.58 0.31 -0.99 -3.74 118.33 129.76 2jws n VAL 54 Ca 0.00 -3.15 0.00 0.00 -0.01 0.00 0.00 64.34 61.18 2jws n VAL 54 Cb 0.00 -2.42 0.00 0.00 -0.91 0.00 0.00 33.84 30.51 2jws n VAL 54 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 2jws n THR 55 N 6.05 0.00 0.85 2.52 -2.24 -1.26 -4.77 114.28 115.43 2jws n THR 55 Ca 0.50 0.00 0.10 0.00 -2.27 0.00 0.00 64.05 62.38 2jws n THR 55 Cb 0.43 0.00 0.08 0.00 -2.10 0.00 0.00 70.33 68.74 2jws n THR 55 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71