#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kdm s THR 2 N 0.00 5.27 0.08 4.28 2.01 -1.26 -2.19 115.64 123.83 2kdm s THR 2 Ca 0.00 0.65 0.10 0.00 0.31 0.00 0.00 61.69 62.75 2kdm s THR 2 Cb 0.00 -3.68 -0.03 0.00 0.01 0.00 0.00 72.50 68.80 2kdm s THR 2 CO 0.00 0.38 -0.26 -0.31 -0.69 0.00 0.00 174.62 173.73 2kdm s TYR 3 N 0.49 2.26 0.09 4.92 1.51 -0.70 -4.60 117.35 121.32 2kdm s TYR 3 Ca 0.19 -0.40 0.08 0.00 -1.01 0.00 0.00 57.07 55.93 2kdm s TYR 3 Cb -0.14 -1.30 -0.03 0.00 -0.11 0.00 0.00 41.96 40.38 2kdm s TYR 3 CO 0.06 0.20 -0.20 0.15 -1.11 0.00 0.00 175.55 174.65 2kdm s LYS 4 N -1.56 1.14 -0.06 -0.62 1.02 -1.02 -2.01 119.74 116.63 2kdm s LYS 4 Ca 0.12 -1.10 0.03 0.00 0.02 0.00 0.00 55.97 55.04 2kdm s LYS 4 Cb -0.10 -1.36 0.01 0.00 -0.52 0.00 0.00 37.83 35.86 2kdm s LYS 4 CO 0.04 0.32 -0.14 -1.17 -0.92 0.00 0.00 175.35 173.48 2kdm s LEU 5 N -1.75 1.75 -0.35 3.17 2.96 0.34 0.28 118.68 125.08 2kdm s LEU 5 Ca 0.06 -0.33 -0.04 0.00 -0.22 0.00 0.00 54.13 53.60 2kdm s LEU 5 Cb -0.10 -0.89 0.06 0.00 0.50 0.00 0.00 46.19 45.76 2kdm s LEU 5 CO 0.04 0.07 0.10 -0.63 -1.32 0.00 0.00 176.35 174.61 2kdm s ILE 6 N 0.47 3.47 -0.24 6.68 1.09 -0.20 -0.71 121.20 131.76 2kdm s ILE 6 Ca -0.12 -1.42 -0.13 0.00 -1.10 0.00 0.00 60.65 57.89 2kdm s ILE 6 Cb -0.15 -3.07 -0.05 0.00 -1.06 0.00 0.00 42.46 38.14 2kdm s ILE 6 CO 0.04 -0.28 0.25 -0.76 -0.10 0.00 0.00 174.94 174.09 2kdm s LEU 7 N 1.31 4.10 -0.28 2.97 1.43 0.11 -0.79 118.68 127.53 2kdm s LEU 7 Ca -0.01 0.22 0.01 0.00 -1.03 0.00 0.00 54.13 53.32 2kdm s LEU 7 Cb -0.21 -2.25 0.08 0.00 0.03 0.00 0.00 46.19 43.84 2kdm s LEU 7 CO 0.00 -0.02 0.03 0.21 0.23 0.00 0.00 176.35 176.80 2kdm s ASN 8 N 1.23 4.06 0.69 2.29 3.04 -0.50 -0.34 114.94 125.41 2kdm s ASN 8 Ca 0.11 -1.54 0.03 0.00 0.04 0.00 0.00 52.86 51.50 2kdm s ASN 8 Cb -0.14 -1.13 0.13 0.00 -1.54 0.00 0.00 41.25 38.56 2kdm s ASN 8 CO 0.07 -0.34 0.95 -1.48 -3.04 0.00 0.00 177.10 173.26 2kdm s LEU 9 N 1.39 2.97 0.27 3.21 2.34 0.31 -0.83 118.68 128.35 2kdm s LEU 9 Ca 0.04 -0.63 -0.04 0.00 0.06 0.00 0.00 54.13 53.57 2kdm s LEU 9 Cb -0.18 -1.68 0.55 0.00 -0.56 0.00 0.00 46.19 44.32 2kdm s LEU 9 CO -0.14 -1.77 1.61 0.07 -1.06 0.00 0.00 176.35 175.06 2kdm h LYS 10 N -0.34 0.06 -1.54 1.48 -0.00 -1.94 -3.24 116.57 111.06 2kdm h LYS 10 Ca -0.33 -0.00 -0.46 0.00 -0.00 0.00 0.00 60.65 59.86 2kdm h LYS 10 Cb 1.27 -0.01 -0.34 0.00 -0.00 0.00 0.00 32.23 33.15 2kdm h LYS 10 CO 0.38 0.04 -0.99 0.94 -0.00 0.00 0.00 179.45 179.83 2kdm n GLN 11 N -5.42 0.82 0.00 0.07 7.27 -1.26 -5.10 117.38 113.76 2kdm n GLN 11 Ca 0.17 -2.94 0.00 0.00 0.07 0.00 0.00 57.00 54.31 2kdm n GLN 11 Cb 0.58 -1.37 0.00 0.00 2.41 0.00 0.00 30.24 31.86 2kdm n GLN 11 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2kdm n ALA 12 N 1.05 0.00 -3.72 1.69 0.00 -1.23 -5.16 120.51 113.15 2kdm n ALA 12 Ca 0.19 0.00 -0.18 0.00 0.00 0.00 0.00 53.44 53.45 2kdm n ALA 12 Cb 0.59 0.00 -0.17 0.00 0.00 0.00 0.00 19.45 19.87 2kdm n ALA 12 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 2kdm s LYS 13 N -2.00 0.05 -0.05 0.00 -2.85 -1.26 -0.53 119.74 113.10 2kdm s LYS 13 Ca 0.00 0.25 0.05 0.00 -1.00 0.00 0.00 55.97 55.27 2kdm s LYS 13 Cb 0.00 -0.47 -0.01 0.00 -2.06 0.00 0.00 37.83 35.30 2kdm s LYS 13 CO 0.00 -0.25 -0.20 -1.21 0.10 0.00 0.00 175.35 173.79 2kdm s GLU 14 N 1.65 2.05 -0.25 1.78 2.02 0.54 -4.98 118.70 121.50 2kdm s GLU 14 Ca -0.01 -0.72 -0.04 0.00 0.02 0.00 0.00 54.97 54.22 2kdm s GLU 14 Cb -0.13 -1.77 0.01 0.00 0.10 0.00 0.00 34.13 32.34 2kdm s GLU 14 CO -0.03 0.30 -0.01 -1.21 0.02 0.00 0.00 175.26 174.33 2kdm s GLU 15 N -0.05 3.14 -0.15 1.61 2.02 -1.26 0.08 118.70 124.08 2kdm s GLU 15 Ca -0.03 -0.79 -0.03 0.00 0.02 0.00 0.00 54.97 54.13 2kdm s GLU 15 Cb -0.12 -3.11 -0.03 0.00 0.10 0.00 0.00 34.13 30.97 2kdm s GLU 15 CO 0.03 -0.33 -0.05 0.00 0.02 0.00 0.00 175.26 174.93 2kdm s ALA 16 N 1.44 2.97 0.03 5.21 0.00 0.12 -4.95 121.76 126.58 2kdm s ALA 16 Ca 0.03 -0.82 0.00 0.00 0.00 0.00 0.00 51.96 51.17 2kdm s ALA 16 Cb -0.16 -1.52 -0.03 0.00 0.00 0.00 0.00 23.12 21.42 2kdm s ALA 16 CO -0.02 0.24 -0.04 0.96 0.00 0.00 0.00 175.76 176.90 2kdm s ILE 17 N 0.30 0.24 -0.13 0.00 -0.00 -1.26 0.12 121.20 120.47 2kdm s ILE 17 Ca -0.04 -1.17 -0.30 0.00 -0.00 0.00 0.00 60.65 59.13 2kdm s ILE 17 Cb -0.14 -0.65 0.12 0.00 -0.00 0.00 0.00 42.46 41.79 2kdm s ILE 17 CO 0.03 -0.60 0.99 -0.75 -0.00 0.00 0.00 174.94 174.61 2kdm s LYS 18 N -2.10 0.62 -0.08 0.37 2.47 -0.85 -5.03 119.74 115.15 2kdm s LYS 18 Ca -0.09 0.03 0.01 0.00 -1.56 0.00 0.00 55.97 54.37 2kdm s LYS 18 Cb -0.06 0.29 -0.03 0.00 -1.46 0.00 0.00 37.83 36.58 2kdm s LYS 18 CO -0.03 -0.22 -0.11 -2.00 0.16 0.00 0.00 175.35 173.16 2kdm s GLU 19 N -1.63 2.82 0.30 4.03 -6.30 -1.26 -1.72 118.70 114.94 2kdm s GLU 19 Ca 0.00 -0.63 0.05 0.00 -2.50 0.00 0.00 54.97 51.90 2kdm s GLU 19 Cb -0.01 -2.53 -0.03 0.00 0.00 0.00 0.00 34.13 31.56 2kdm s GLU 19 CO -0.01 0.54 0.24 0.00 0.02 0.00 0.00 175.26 176.05 2kdm s ALA 20 N -0.50 1.72 0.09 6.30 0.00 -0.93 -5.00 121.76 123.45 2kdm s ALA 20 Ca 0.07 -1.98 -0.20 0.00 0.00 0.00 0.00 51.96 49.86 2kdm s ALA 20 Cb -0.12 1.45 -0.08 0.00 0.00 0.00 0.00 23.12 24.36 2kdm s ALA 20 CO 0.02 -0.64 1.60 -0.39 0.00 0.00 0.00 175.76 176.35 2kdm h VAL 21 N 2.24 1.19 0.00 0.00 -1.51 -2.00 -1.27 116.25 114.91 2kdm h VAL 21 Ca -0.28 -0.61 0.00 0.00 -1.23 0.00 0.00 66.70 64.58 2kdm h VAL 21 Cb 1.24 1.19 0.00 0.00 -2.13 0.00 0.00 31.29 31.58 2kdm h VAL 21 CO 0.41 0.19 0.00 0.47 -1.23 0.00 0.00 177.57 177.41 2kdm n ASP 22 N -4.78 0.00 0.00 4.19 8.00 -1.26 -3.18 116.55 119.52 2kdm n ASP 22 Ca -0.04 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.46 2kdm n ASP 22 Cb 0.15 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.25 2kdm n ASP 22 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2kdm n ALA 23 N -1.72 0.00 -0.39 2.24 0.00 -1.26 -3.11 120.51 116.26 2kdm n ALA 23 Ca 0.00 0.00 0.39 0.00 0.00 0.00 0.00 53.44 53.83 2kdm n ALA 23 Cb 0.00 0.00 0.75 0.00 0.00 0.00 0.00 19.45 20.20 2kdm n ALA 23 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2kdm h GLY 24 N 0.00 0.00 1.80 0.00 0.00 -1.99 1.19 103.07 104.07 2kdm h GLY 24 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 47.33 47.18 2kdm h GLY 24 CO 0.00 0.00 -0.62 -0.84 0.00 0.00 0.00 176.54 175.08 2kdm h THR 25 N 0.00 1.40 -0.07 4.70 2.02 -1.99 -2.67 112.91 116.31 2kdm h THR 25 Ca 0.63 -2.04 -0.22 0.00 0.77 0.00 0.00 66.41 65.56 2kdm h THR 25 Cb 2.61 2.05 0.00 0.00 -1.74 0.00 0.00 68.15 71.07 2kdm h THR 25 CO -0.01 0.60 -0.84 0.00 0.37 0.00 0.00 175.52 175.64 2kdm h ALA 26 N 1.20 0.40 -1.59 6.16 0.00 0.11 -2.60 119.26 122.94 2kdm h ALA 26 Ca -0.01 -0.65 0.00 0.00 0.00 0.00 0.00 54.91 54.26 2kdm h ALA 26 Cb 1.13 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.90 2kdm h ALA 26 CO 0.09 0.75 0.00 -1.91 0.00 0.00 0.00 179.25 178.18 2kdm n GLU 27 N -3.84 0.00 -0.35 0.00 2.13 -0.72 0.70 120.64 118.55 2kdm n GLU 27 Ca -0.07 0.23 0.37 0.00 0.66 0.00 0.00 57.16 58.36 2kdm n GLU 27 Cb 0.78 -1.12 0.76 0.00 0.27 0.00 0.00 31.44 32.13 2kdm n GLU 27 CO 0.00 0.00 0.00 1.57 -0.41 0.00 0.00 177.13 178.29 2kdm h LYS 28 N 0.00 0.00 0.04 5.31 2.10 -1.64 0.71 116.57 123.09 2kdm h LYS 28 Ca 0.00 -0.00 -0.10 0.00 -2.00 0.00 0.00 60.65 58.55 2kdm h LYS 28 Cb 0.00 -0.00 0.01 0.00 -0.90 0.00 0.00 32.23 31.34 2kdm h LYS 28 CO 0.00 0.00 -0.40 -0.92 -2.00 0.00 0.00 179.45 176.13 2kdm h TYR 29 N 0.00 0.32 -0.77 0.07 5.03 -1.45 -2.64 116.97 117.53 2kdm h TYR 29 Ca 0.59 -0.21 -0.03 0.00 2.58 0.00 0.00 58.73 61.67 2kdm h TYR 29 Cb 2.39 -0.02 -0.04 0.00 1.55 0.00 0.00 36.73 40.61 2kdm h TYR 29 CO -0.00 1.09 0.36 0.74 -1.32 0.00 0.00 178.16 179.03 2kdm h PHE 30 N -0.53 1.12 -0.69 -3.82 0.04 0.35 -2.01 116.94 111.39 2kdm h PHE 30 Ca -0.06 -0.06 0.00 0.00 2.80 0.00 0.00 57.97 60.65 2kdm h PHE 30 Cb 1.23 -0.35 -0.03 0.00 2.20 0.00 0.00 35.95 39.00 2kdm h PHE 30 CO 0.20 0.83 0.43 -0.22 -0.60 0.00 0.00 178.31 178.96 2kdm h LYS 31 N 1.09 0.93 -0.69 1.51 3.64 0.18 0.61 116.57 123.85 2kdm h LYS 31 Ca 0.26 -0.07 -0.07 0.00 -1.27 0.00 0.00 60.65 59.51 2kdm h LYS 31 Cb 0.14 -0.20 -0.03 0.00 -0.41 0.00 0.00 32.23 31.73 2kdm h LYS 31 CO -0.03 0.64 0.17 -0.07 -2.27 0.00 0.00 179.45 177.89 2kdm h LEU 32 N 0.95 1.03 -0.18 5.20 3.38 -0.98 -0.83 115.31 123.88 2kdm h LEU 32 Ca 0.25 -0.21 -0.22 0.00 0.09 0.00 0.00 57.88 57.79 2kdm h LEU 32 Cb -0.07 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.41 2kdm h LEU 32 CO -0.05 0.99 -0.95 -0.29 0.09 0.00 0.00 178.44 178.22 2kdm h ILE 33 N 1.04 1.46 0.81 1.22 6.09 -1.05 -2.66 117.51 124.42 2kdm h ILE 33 Ca 0.22 -2.61 -0.04 0.00 -1.37 0.00 0.00 64.86 61.06 2kdm h ILE 33 Cb 0.35 2.51 0.01 0.00 0.47 0.00 0.00 36.82 40.16 2kdm h ILE 33 CO 0.00 0.77 -0.39 0.00 -3.07 0.00 0.00 178.15 175.46 2kdm h ALA 34 N 0.82 -1.09 -0.65 0.18 0.00 -0.66 0.34 119.26 118.20 2kdm h ALA 34 Ca -0.07 -0.24 0.12 0.00 0.00 0.00 0.00 54.91 54.71 2kdm h ALA 34 Cb 1.60 0.42 -0.04 0.00 0.00 0.00 0.00 17.79 19.77 2kdm h ALA 34 CO 0.16 -1.03 0.43 -0.91 0.00 0.00 0.00 179.25 177.90 2kdm h ASN 35 N -1.24 0.37 -0.29 0.00 -0.26 -1.26 0.31 115.58 113.20 2kdm h ASN 35 Ca -0.11 0.01 0.00 0.00 -0.56 0.00 0.00 56.30 55.64 2kdm h ASN 35 Cb 0.84 -0.06 0.00 0.00 -1.06 0.00 0.00 38.32 38.04 2kdm h ASN 35 CO 0.18 0.21 0.00 0.00 -1.06 0.00 0.00 177.43 176.76 2kdm n ALA 36 N -2.52 2.47 -0.11 -0.83 0.00 -1.00 -4.07 120.51 114.45 2kdm n ALA 36 Ca 0.11 -0.68 -0.15 0.00 0.00 0.00 0.00 53.44 52.73 2kdm n ALA 36 Cb 0.43 -1.01 -0.12 0.00 0.00 0.00 0.00 19.45 18.74 2kdm n ALA 36 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2kdm n LYS 37 N 0.67 0.69 0.00 0.00 4.76 0.12 -4.99 118.16 119.41 2kdm n LYS 37 Ca 0.16 0.10 0.00 0.00 -2.87 0.00 0.00 58.31 55.70 2kdm n LYS 37 Cb 0.39 -1.48 0.00 0.00 -1.84 0.00 0.00 35.03 32.10 2kdm n LYS 37 CO 0.00 0.00 0.00 0.25 -1.37 0.00 0.00 177.40 176.28 2kdm n THR 38 N -3.06 0.00 -1.96 -0.18 -2.24 -0.89 -5.06 114.28 100.89 2kdm n THR 38 Ca -0.39 0.00 -0.03 0.00 -2.27 0.00 0.00 64.05 61.36 2kdm n THR 38 Cb 0.99 0.00 0.01 0.00 -2.10 0.00 0.00 70.33 69.24 2kdm n THR 38 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 2kdm n VAL 39 N -0.61 -3.32 -3.15 2.28 0.31 -1.16 -5.01 118.33 107.67 2kdm n VAL 39 Ca 0.00 -0.27 0.04 0.00 -0.01 0.00 0.00 64.34 64.11 2kdm n VAL 39 Cb 0.00 -4.12 -0.04 0.00 -0.91 0.00 0.00 33.84 28.77 2kdm n VAL 39 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 2kdm s GLU 40 N -3.25 0.00 0.00 5.55 0.41 -1.26 -5.08 118.70 115.06 2kdm s GLU 40 Ca 0.08 0.00 0.00 0.00 -0.41 0.00 0.00 54.97 54.65 2kdm s GLU 40 Cb -0.01 0.00 0.00 0.00 -1.78 0.00 0.00 34.13 32.34 2kdm s GLU 40 CO 0.20 -0.00 0.00 0.41 -0.49 0.00 0.00 175.26 175.38 2kdm n GLY 41 N 4.66 0.11 3.33 -1.39 0.00 -1.26 -4.14 105.19 106.50 2kdm n GLY 41 Ca -0.07 -1.17 -0.39 0.00 0.00 0.00 0.00 46.02 44.40 2kdm n GLY 41 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2kdm s VAL 42 N -2.00 4.16 -0.22 1.61 -7.23 0.38 -4.68 120.40 112.42 2kdm s VAL 42 Ca 0.00 -0.92 -0.29 0.00 -1.81 0.00 0.00 61.98 58.96 2kdm s VAL 42 Cb 0.00 -3.30 -0.04 0.00 0.56 0.00 0.00 36.38 33.61 2kdm s VAL 42 CO 0.00 -0.15 1.79 0.26 -0.31 0.00 0.00 175.10 176.69 2kdm s TRP 43 N 1.49 1.79 0.18 2.82 0.52 -1.24 -2.58 118.94 121.92 2kdm s TRP 43 Ca 0.01 0.45 0.02 0.00 0.02 0.00 0.00 56.10 56.60 2kdm s TRP 43 Cb -0.19 -4.04 -0.05 0.00 -1.15 0.00 0.00 33.47 28.05 2kdm s TRP 43 CO 0.04 -3.43 -0.00 0.95 0.02 0.00 0.00 176.95 174.54 2kdm s THR 44 N 6.00 0.75 -0.00 2.01 -4.23 0.31 -4.94 115.64 115.55 2kdm s THR 44 Ca 0.80 -1.99 -0.05 0.00 -1.18 0.00 0.00 61.69 59.27 2kdm s THR 44 Cb -0.28 -2.16 -0.00 0.00 1.34 0.00 0.00 72.50 71.40 2kdm s THR 44 CO 0.33 -0.45 0.09 -0.47 -0.54 0.00 0.00 174.62 173.58 2kdm s TYR 45 N -3.61 0.07 -0.11 3.99 6.14 -1.26 0.14 117.35 122.71 2kdm s TYR 45 Ca 0.25 -0.16 0.01 0.00 0.64 0.00 0.00 57.07 57.81 2kdm s TYR 45 Cb 0.06 -0.07 -0.01 0.00 0.42 0.00 0.00 41.96 42.36 2kdm s TYR 45 CO 0.05 -0.23 -0.16 0.21 0.64 0.00 0.00 175.55 176.06 2kdm s LYS 46 N -1.18 3.17 -0.23 4.97 2.20 0.32 -4.96 119.74 124.03 2kdm s LYS 46 Ca -0.13 -0.73 -0.21 0.00 -0.36 0.00 0.00 55.97 54.54 2kdm s LYS 46 Cb -0.07 -2.52 -0.02 0.00 -1.51 0.00 0.00 37.83 33.71 2kdm s LYS 46 CO 0.01 0.27 0.66 0.34 -0.36 0.00 0.00 175.35 176.27 2kdm s ASP 47 N 0.18 6.66 0.00 1.43 -1.08 -1.26 -2.76 116.67 119.84 2kdm s ASP 47 Ca -0.09 0.81 0.00 0.00 -0.52 0.00 0.00 52.55 52.75 2kdm s ASP 47 Cb -0.15 -2.36 0.00 0.00 -1.46 0.00 0.00 42.92 38.95 2kdm s ASP 47 CO 0.05 -0.35 0.00 -0.62 0.52 0.00 0.00 175.17 174.78 2kdm n GLU 48 N 5.45 0.00 -0.19 4.34 -0.58 -1.26 -4.91 120.64 123.50 2kdm n GLU 48 Ca -0.00 0.00 0.03 0.00 -0.42 0.00 0.00 57.16 56.77 2kdm n GLU 48 Cb 0.49 0.00 0.05 0.00 -0.57 0.00 0.00 31.44 31.41 2kdm n GLU 48 CO 0.00 0.00 0.00 -0.89 -0.48 0.00 0.00 177.13 175.76 2kdm n ILE 49 N 0.00 0.78 -2.85 -3.67 -0.00 -1.26 -5.06 119.36 107.30 2kdm n ILE 49 Ca 0.00 -0.90 -0.05 0.00 -0.00 0.00 0.00 62.75 61.80 2kdm n ILE 49 Cb 0.00 0.35 0.01 0.00 -0.00 0.00 0.00 39.64 39.99 2kdm n ILE 49 CO 0.00 0.00 0.00 0.29 -0.00 0.00 0.00 176.55 176.84 2kdm n LYS 50 N -0.55 -2.80 -3.76 0.38 5.02 -1.24 -4.61 118.16 110.60 2kdm n LYS 50 Ca 0.05 2.34 -0.15 0.00 -2.02 0.00 0.00 58.31 58.53 2kdm n LYS 50 Cb 0.57 -4.91 -0.16 0.00 -0.02 0.00 0.00 35.03 30.51 2kdm n LYS 50 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2kdm s THR 51 N -1.87 -0.06 0.23 -0.18 -4.23 -1.11 -2.44 115.64 105.97 2kdm s THR 51 Ca 0.10 0.24 0.07 0.00 -1.18 0.00 0.00 61.69 60.91 2kdm s THR 51 Cb -0.02 -0.09 -0.04 0.00 1.34 0.00 0.00 72.50 73.69 2kdm s THR 51 CO 0.72 0.10 0.17 -0.36 -0.54 0.00 0.00 174.62 174.70 2kdm s PHE 52 N 1.17 3.09 0.01 3.99 0.40 0.14 0.12 117.98 126.90 2kdm s PHE 52 Ca -0.08 -0.10 -0.10 0.00 -0.60 0.00 0.00 56.93 56.05 2kdm s PHE 52 Cb -0.13 -1.41 0.01 0.00 0.51 0.00 0.00 43.02 42.00 2kdm s PHE 52 CO -0.03 0.53 0.20 0.99 0.70 0.00 0.00 175.22 177.60 2kdm s THR 53 N -2.06 0.08 -0.29 0.64 2.01 0.37 -1.04 115.64 115.37 2kdm s THR 53 Ca 0.32 -0.70 -0.02 0.00 0.31 0.00 0.00 61.69 61.61 2kdm s THR 53 Cb -0.08 -0.62 0.09 0.00 0.01 0.00 0.00 72.50 71.90 2kdm s THR 53 CO 0.24 -0.38 0.09 0.54 -0.69 0.00 0.00 174.62 174.42 2kdm s VAL 54 N -1.73 0.67 -0.19 3.82 0.11 0.03 0.11 120.40 123.23 2kdm s VAL 54 Ca -0.12 -1.16 -0.08 0.00 -2.93 0.00 0.00 61.98 57.70 2kdm s VAL 54 Cb -0.05 -1.45 -0.04 0.00 -1.53 0.00 0.00 36.38 33.30 2kdm s VAL 54 CO 0.01 -0.60 0.08 -0.89 -3.33 0.00 0.00 175.10 170.36 2kdm s THR 55 N 1.73 4.87 -2.87 5.04 2.01 -1.07 -1.41 115.64 123.95 2kdm s THR 55 Ca 0.08 -0.00 0.25 0.00 0.31 0.00 0.00 61.69 62.32 2kdm s THR 55 Cb -0.17 -3.20 0.29 0.00 0.01 0.00 0.00 72.50 69.42 2kdm s THR 55 CO -0.24 0.45 1.39 1.21 -0.69 0.00 0.00 174.62 176.73