#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k3b s PRO 2 N 0.00 1.29 0.35 0.00 0.04 -1.26 -4.38 135.00 131.04 2k3b s PRO 2 Ca 0.00 0.15 0.09 0.00 0.04 0.00 0.00 61.00 61.28 2k3b s PRO 2 Cb 0.00 -1.87 -0.05 0.00 0.04 0.00 0.00 34.50 32.62 2k3b s PRO 2 CO 0.00 -2.07 0.07 1.67 0.04 0.00 0.00 177.00 176.71 2k3b s TRP 3 N -3.43 2.61 0.13 0.56 1.48 -1.26 -1.62 118.94 117.41 2k3b s TRP 3 Ca 0.64 -0.43 -0.05 0.00 -1.06 0.00 0.00 56.10 55.20 2k3b s TRP 3 Cb -0.12 -1.59 -0.02 0.00 -1.16 0.00 0.00 33.47 30.58 2k3b s TRP 3 CO 0.52 0.40 0.15 0.00 -4.06 0.00 0.00 176.95 173.96 2k3b s ALA 4 N -2.50 0.37 0.29 2.67 0.00 0.37 -0.86 121.76 122.10 2k3b s ALA 4 Ca 0.36 -1.12 0.07 0.00 0.00 0.00 0.00 51.96 51.27 2k3b s ALA 4 Cb -0.00 0.76 -0.03 0.00 0.00 0.00 0.00 23.12 23.85 2k3b s ALA 4 CO 0.21 -0.54 0.29 0.95 0.00 0.00 0.00 175.76 176.67 2k3b s THR 5 N -3.98 4.28 -0.44 0.00 -4.23 -0.07 -0.74 115.64 110.46 2k3b s THR 5 Ca 0.17 -1.26 -0.20 0.00 -1.18 0.00 0.00 61.69 59.22 2k3b s THR 5 Cb 0.06 -3.42 0.03 0.00 1.34 0.00 0.00 72.50 70.50 2k3b s THR 5 CO -0.02 -0.27 0.61 0.00 -0.54 0.00 0.00 174.62 174.40 2k3b s ALA 6 N -2.16 3.36 0.09 3.99 0.00 0.19 -2.20 121.76 125.03 2k3b s ALA 6 Ca 0.37 -1.29 -0.15 0.00 0.00 0.00 0.00 51.96 50.89 2k3b s ALA 6 Cb -0.08 -3.26 -0.11 0.00 0.00 0.00 0.00 23.12 19.67 2k3b s ALA 6 CO 0.27 -1.77 1.38 0.93 0.00 0.00 0.00 175.76 176.57 2k3b h GLU 7 N 8.86 0.70 -4.40 0.00 5.08 -0.87 0.12 114.58 124.06 2k3b h GLU 7 Ca -0.26 -0.42 -0.20 0.00 -1.00 0.00 0.00 59.36 57.49 2k3b h GLU 7 Cb 1.10 0.04 -0.17 0.00 0.50 0.00 0.00 28.75 30.21 2k3b h GLU 7 CO 0.88 1.04 -0.70 0.71 -1.00 0.00 0.00 179.01 179.94 2k3b s TYR 8 N -4.17 0.63 0.21 4.33 1.51 -1.11 -4.83 117.35 113.92 2k3b s TYR 8 Ca -0.12 -0.79 -0.30 0.00 -1.01 0.00 0.00 57.07 54.84 2k3b s TYR 8 Cb 0.08 -0.40 -0.09 0.00 -0.11 0.00 0.00 41.96 41.44 2k3b s TYR 8 CO 0.84 -0.20 1.41 0.34 -1.11 0.00 0.00 175.55 176.83 2k3b s ASP 9 N -2.39 6.74 -0.10 2.29 -1.08 -1.26 -4.25 116.67 116.62 2k3b s ASP 9 Ca 0.00 2.53 0.01 0.00 -0.52 0.00 0.00 52.55 54.58 2k3b s ASP 9 Cb -0.00 -2.61 0.02 0.00 -1.46 0.00 0.00 42.92 38.86 2k3b s ASP 9 CO -0.04 -0.66 -0.12 -0.47 0.52 0.00 0.00 175.17 174.40 2k3b s TYR 10 N 0.31 1.70 -0.28 -5.34 5.04 -0.85 -4.94 117.35 113.00 2k3b s TYR 10 Ca 0.60 -0.79 -0.09 0.00 -2.44 0.00 0.00 57.07 54.35 2k3b s TYR 10 Cb -0.40 -1.29 -0.03 0.00 0.35 0.00 0.00 41.96 40.60 2k3b s TYR 10 CO 0.39 -0.45 0.14 -0.51 -1.34 0.00 0.00 175.55 173.77 2k3b s ASP 11 N 1.17 5.59 0.30 4.32 1.01 -1.26 -1.24 116.67 126.56 2k3b s ASP 11 Ca -0.04 -0.22 -0.29 0.00 0.71 0.00 0.00 52.55 52.71 2k3b s ASP 11 Cb -0.14 -2.02 -0.11 0.00 1.01 0.00 0.00 42.92 41.66 2k3b s ASP 11 CO -0.03 -0.09 1.51 0.00 0.21 0.00 0.00 175.17 176.77 2k3b s ALA 12 N 1.67 3.66 -1.17 5.23 0.00 -1.23 -4.89 121.76 125.04 2k3b s ALA 12 Ca 0.06 1.48 0.11 0.00 0.00 0.00 0.00 51.96 53.62 2k3b s ALA 12 Cb -0.16 -3.60 0.23 0.00 0.00 0.00 0.00 23.12 19.59 2k3b s ALA 12 CO 0.07 -0.91 1.11 0.00 0.00 0.00 0.00 175.76 176.03 2k3b n ALA 13 N 1.75 2.30 -2.11 0.00 0.00 -1.26 -4.98 120.51 116.22 2k3b n ALA 13 Ca 0.06 -0.93 -0.07 0.00 0.00 0.00 0.00 53.44 52.50 2k3b n ALA 13 Cb 0.39 -0.43 -0.10 0.00 0.00 0.00 0.00 19.45 19.31 2k3b n ALA 13 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2k3b s GLU 14 N -0.99 0.62 0.36 0.00 2.02 -1.26 -5.05 118.70 114.40 2k3b s GLU 14 Ca 0.20 -1.21 0.06 0.00 0.02 0.00 0.00 54.97 54.04 2k3b s GLU 14 Cb 0.11 0.22 0.69 0.00 0.10 0.00 0.00 34.13 35.25 2k3b s GLU 14 CO 0.16 -0.12 1.92 -0.44 0.02 0.00 0.00 175.26 176.80 2k3b h ASP 15 N 3.14 0.43 -0.20 -0.19 3.32 -2.03 -2.42 116.42 118.46 2k3b h ASP 15 Ca -0.34 -0.07 0.00 0.00 0.02 0.00 0.00 57.03 56.64 2k3b h ASP 15 Cb 1.14 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 40.58 2k3b h ASP 15 CO 0.65 0.48 0.00 0.59 -1.72 0.00 0.00 179.24 179.25 2k3b n ASN 16 N -4.31 1.48 -4.78 6.45 3.02 -1.26 -4.88 115.26 110.97 2k3b n ASN 16 Ca 0.01 -1.80 -0.36 0.00 -0.03 0.00 0.00 54.58 52.40 2k3b n ASN 16 Cb 0.22 -0.13 -0.08 0.00 -0.61 0.00 0.00 39.78 39.18 2k3b n ASN 16 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2k3b s GLU 17 N -1.73 3.26 0.35 3.52 2.02 -0.91 -0.10 118.70 125.11 2k3b s GLU 17 Ca 0.27 -0.26 -0.25 0.00 0.02 0.00 0.00 54.97 54.74 2k3b s GLU 17 Cb 0.14 -3.01 -0.10 0.00 0.10 0.00 0.00 34.13 31.26 2k3b s GLU 17 CO 0.21 0.72 0.99 -0.51 0.02 0.00 0.00 175.26 176.69 2k3b s LEU 18 N -0.90 4.25 -0.13 1.80 1.43 -0.29 -4.69 118.68 120.15 2k3b s LEU 18 Ca 0.14 1.92 -0.01 0.00 -1.03 0.00 0.00 54.13 55.15 2k3b s LEU 18 Cb -0.12 -4.09 -0.02 0.00 0.03 0.00 0.00 46.19 41.99 2k3b s LEU 18 CO 0.03 -0.24 -0.11 -0.89 0.23 0.00 0.00 176.35 175.38 2k3b s THR 19 N -1.65 3.26 0.26 5.49 2.01 -1.26 -3.52 115.64 120.23 2k3b s THR 19 Ca 0.53 -0.59 -0.17 0.00 0.31 0.00 0.00 61.69 61.77 2k3b s THR 19 Cb -0.20 -2.38 0.01 0.00 0.01 0.00 0.00 72.50 69.94 2k3b s THR 19 CO 0.25 0.52 0.60 0.72 -0.69 0.00 0.00 174.62 176.02 2k3b s PHE 20 N 0.31 0.04 0.29 4.92 -0.12 -0.37 -4.95 117.98 118.09 2k3b s PHE 20 Ca -0.09 -0.44 0.11 0.00 -0.05 0.00 0.00 56.93 56.47 2k3b s PHE 20 Cb -0.15 0.46 -0.05 0.00 -0.63 0.00 0.00 43.02 42.65 2k3b s PHE 20 CO 0.05 -1.10 -0.18 0.14 -0.05 0.00 0.00 175.22 174.08 2k3b s VAL 21 N -3.95 2.40 0.20 -2.49 -7.23 -1.26 -2.00 120.40 106.07 2k3b s VAL 21 Ca 0.15 -2.37 -0.31 0.00 -1.81 0.00 0.00 61.98 57.65 2k3b s VAL 21 Cb -0.03 -2.34 -0.16 0.00 0.56 0.00 0.00 36.38 34.41 2k3b s VAL 21 CO 0.07 -0.38 0.97 1.21 -0.31 0.00 0.00 175.10 176.66 2k3b n GLU 22 N -0.64 0.87 -0.11 4.82 2.13 -1.26 -1.31 120.64 125.15 2k3b n GLU 22 Ca -0.05 0.31 0.00 0.00 0.66 0.00 0.00 57.16 58.08 2k3b n GLU 22 Cb 0.61 -1.66 0.00 0.00 0.27 0.00 0.00 31.44 30.66 2k3b n GLU 22 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 2k3b n ASN 23 N 1.75 0.00 -4.76 4.31 3.02 0.41 -4.90 115.26 115.09 2k3b n ASN 23 Ca 0.15 0.00 -0.37 0.00 -0.03 0.00 0.00 54.58 54.33 2k3b n ASN 23 Cb 0.25 0.00 0.01 0.00 -0.61 0.00 0.00 39.78 39.44 2k3b n ASN 23 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 2k3b s ASP 24 N -3.86 5.73 -0.07 6.41 1.01 -0.43 -4.48 116.67 120.99 2k3b s ASP 24 Ca 0.00 2.40 -0.11 0.00 0.71 0.00 0.00 52.55 55.55 2k3b s ASP 24 Cb 0.00 -2.61 -0.05 0.00 1.01 0.00 0.00 42.92 41.28 2k3b s ASP 24 CO 0.00 -1.22 0.27 -0.54 0.21 0.00 0.00 175.17 173.89 2k3b s LYS 25 N -2.95 3.70 -0.15 8.23 1.02 -1.26 -0.63 119.74 127.69 2k3b s LYS 25 Ca 0.69 0.13 0.01 0.00 0.02 0.00 0.00 55.97 56.82 2k3b s LYS 25 Cb -0.31 -3.21 0.00 0.00 -0.52 0.00 0.00 37.83 33.79 2k3b s LYS 25 CO 0.36 0.71 -0.17 0.42 -0.92 0.00 0.00 175.35 175.75 2k3b s ILE 26 N -0.98 2.47 0.35 2.17 1.09 0.08 -1.50 121.20 124.87 2k3b s ILE 26 Ca 0.19 -0.84 0.09 0.00 -1.10 0.00 0.00 60.65 58.99 2k3b s ILE 26 Cb -0.14 -2.03 -0.05 0.00 -1.06 0.00 0.00 42.46 39.18 2k3b s ILE 26 CO 0.08 0.52 0.04 0.27 -0.10 0.00 0.00 174.94 175.76 2k3b s ILE 27 N 0.85 2.58 -1.33 2.92 -4.36 0.15 -0.48 121.20 121.52 2k3b s ILE 27 Ca -0.05 -1.92 -0.02 0.00 -0.26 0.00 0.00 60.65 58.40 2k3b s ILE 27 Cb -0.15 -2.85 -0.00 0.00 1.25 0.00 0.00 42.46 40.71 2k3b s ILE 27 CO -0.01 -0.16 0.58 0.59 0.24 0.00 0.00 174.94 176.18 2k3b n ASN 28 N -1.01 -1.18 -4.72 4.36 3.02 -1.17 -1.69 115.26 112.87 2k3b n ASN 28 Ca -0.04 -0.92 -0.42 0.00 -0.03 0.00 0.00 54.58 53.17 2k3b n ASN 28 Cb 0.63 -3.56 -0.03 0.00 -0.61 0.00 0.00 39.78 36.21 2k3b n ASN 28 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2k3b s ILE 29 N -3.78 3.48 -0.11 2.41 1.01 -0.64 -4.56 121.20 119.00 2k3b s ILE 29 Ca 0.05 1.10 -0.00 0.00 0.00 0.00 0.00 60.65 61.80 2k3b s ILE 29 Cb -0.02 -3.71 -0.02 0.00 0.01 0.00 0.00 42.46 38.73 2k3b s ILE 29 CO 0.85 0.11 -0.10 -1.61 0.00 0.00 0.00 174.94 174.18 2k3b s GLU 30 N 0.75 3.23 -1.40 2.79 2.02 0.03 -4.23 118.70 121.90 2k3b s GLU 30 Ca 0.61 -0.63 -0.14 0.00 0.02 0.00 0.00 54.97 54.82 2k3b s GLU 30 Cb -0.35 -2.65 0.00 0.00 0.10 0.00 0.00 34.13 31.24 2k3b s GLU 30 CO 0.32 0.34 2.28 1.19 0.02 0.00 0.00 175.26 179.41 2k3b n PHE 31 N 3.16 3.20 -0.13 1.61 3.72 -1.26 -2.48 117.46 125.29 2k3b n PHE 31 Ca -0.18 -2.85 -0.11 0.00 -0.05 0.00 0.00 57.45 54.26 2k3b n PHE 31 Cb 0.53 -2.45 -0.02 0.00 -0.94 0.00 0.00 39.48 36.60 2k3b n PHE 31 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 176.76 176.99 2k3b h VAL 32 N 3.93 1.26 -4.10 -4.37 2.07 -1.91 -3.46 116.25 109.67 2k3b h VAL 32 Ca 0.59 -1.04 -0.12 0.00 0.82 0.00 0.00 66.70 66.95 2k3b h VAL 32 Cb 0.59 1.21 -0.14 0.00 -1.52 0.00 0.00 31.29 31.43 2k3b h VAL 32 CO 1.88 0.34 -0.52 -0.62 0.02 0.00 0.00 177.57 178.67 2k3b s ASP 33 N -6.19 0.27 0.36 0.57 2.15 -0.51 -5.04 116.67 108.28 2k3b s ASP 33 Ca -0.13 -0.92 0.07 0.00 0.43 0.00 0.00 52.55 52.00 2k3b s ASP 33 Cb 0.09 0.30 0.67 0.00 -0.30 0.00 0.00 42.92 43.69 2k3b s ASP 33 CO 0.79 -0.71 1.87 -2.24 -0.17 0.00 0.00 175.17 174.71 2k3b h ASP 34 N 2.87 0.34 0.05 -0.34 2.03 -2.00 -3.31 116.42 116.06 2k3b h ASP 34 Ca -0.34 -0.07 -0.38 0.00 -0.73 0.00 0.00 57.03 55.51 2k3b h ASP 34 Cb 1.18 -0.09 -0.05 0.00 -0.83 0.00 0.00 39.33 39.54 2k3b h ASP 34 CO 0.59 0.49 -2.30 -0.67 -1.03 0.00 0.00 179.24 176.31 2k3b n ASP 35 N -4.25 1.97 -4.38 4.15 2.03 -1.26 -4.92 116.55 109.88 2k3b n ASP 35 Ca 0.00 -0.01 -0.31 0.00 0.52 0.00 0.00 54.79 54.99 2k3b n ASP 35 Cb 0.28 -0.52 -0.15 0.00 -0.72 0.00 0.00 41.12 40.01 2k3b n ASP 35 CO 0.00 0.00 0.00 0.26 -1.92 0.00 0.00 177.20 175.54 2k3b s TRP 36 N -2.53 2.47 0.15 -0.67 0.52 -1.25 0.36 118.94 117.99 2k3b s TRP 36 Ca -0.30 -0.33 0.08 0.00 0.02 0.00 0.00 56.10 55.57 2k3b s TRP 36 Cb 0.08 -1.52 -0.04 0.00 -1.15 0.00 0.00 33.47 30.84 2k3b s TRP 36 CO 0.67 0.09 -0.17 -1.58 0.02 0.00 0.00 176.95 175.98 2k3b s TRP 37 N -0.72 1.67 -0.20 -1.98 0.51 0.05 -1.42 118.94 116.84 2k3b s TRP 37 Ca 0.11 -0.50 -0.11 0.00 -2.12 0.00 0.00 56.10 53.49 2k3b s TRP 37 Cb -0.10 -0.85 -0.05 0.00 -0.81 0.00 0.00 33.47 31.66 2k3b s TRP 37 CO 0.01 0.26 0.16 -1.17 -0.51 0.00 0.00 176.95 175.70 2k3b s LEU 38 N -2.57 4.19 0.00 2.99 2.96 -1.03 -0.24 118.68 124.98 2k3b s LEU 38 Ca 0.13 0.24 0.00 0.00 -0.22 0.00 0.00 54.13 54.28 2k3b s LEU 38 Cb -0.05 -2.14 0.00 0.00 0.50 0.00 0.00 46.19 44.50 2k3b s LEU 38 CO 0.05 0.14 0.00 0.61 -1.32 0.00 0.00 176.35 175.83 2k3b n GLY 39 N 3.68 4.40 2.93 7.98 0.00 -0.81 -0.79 105.19 122.57 2k3b n GLY 39 Ca -0.15 -1.33 -0.12 0.00 0.00 0.00 0.00 46.02 44.41 2k3b n GLY 39 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2k3b s GLU 40 N 0.24 0.07 0.10 1.61 2.12 -0.68 -1.64 118.70 120.52 2k3b s GLU 40 Ca 0.00 0.12 -0.30 0.00 0.36 0.00 0.00 54.97 55.15 2k3b s GLU 40 Cb 0.00 0.00 -0.06 0.00 0.26 0.00 0.00 34.13 34.33 2k3b s GLU 40 CO 0.00 -0.03 1.14 -0.51 -0.54 0.00 0.00 175.26 175.31 2k3b s LEU 41 N 0.20 4.42 0.30 2.70 1.43 0.17 0.30 118.68 128.20 2k3b s LEU 41 Ca -0.01 2.01 0.00 0.00 -1.03 0.00 0.00 54.13 55.10 2k3b s LEU 41 Cb -0.02 -3.59 0.52 0.00 0.03 0.00 0.00 46.19 43.13 2k3b s LEU 41 CO -0.01 -0.35 1.92 -0.08 0.23 0.00 0.00 176.35 178.06 2k3b h GLU 42 N 6.14 1.01 0.00 1.70 4.81 -1.62 -1.19 114.58 125.43 2k3b h GLU 42 Ca -0.43 -0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 58.72 2k3b h GLU 42 Cb 1.21 -0.23 -0.00 0.00 0.63 0.00 0.00 28.75 30.36 2k3b h GLU 42 CO 0.77 0.67 -0.11 1.57 -0.73 0.00 0.00 179.01 181.17 2k3b h LYS 43 N 1.04 0.00 0.00 1.92 2.10 -1.91 -3.38 116.57 116.33 2k3b h LYS 43 Ca 0.37 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.02 2k3b h LYS 43 Cb 0.15 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.48 2k3b h LYS 43 CO -0.13 0.11 0.00 -0.40 -2.00 0.00 0.00 179.45 177.03 2k3b n ASP 44 N -3.18 0.00 0.00 7.07 5.68 -1.19 -5.03 116.55 119.90 2k3b n ASP 44 Ca 0.02 -0.93 0.00 0.00 -0.50 0.00 0.00 54.79 53.38 2k3b n ASP 44 Cb 0.46 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.44 2k3b n ASP 44 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2k3b n GLY 45 N 0.00 0.82 3.77 6.12 0.00 -0.46 -5.00 105.19 110.45 2k3b n GLY 45 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 2k3b n GLY 45 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2k3b s SER 46 N -2.74 5.65 0.07 1.61 1.04 -1.26 -4.71 113.70 113.37 2k3b s SER 46 Ca 0.00 2.13 0.05 0.00 0.48 0.00 0.00 55.95 58.62 2k3b s SER 46 Cb 0.00 -2.57 -0.03 0.00 0.10 0.00 0.00 66.02 63.52 2k3b s SER 46 CO 0.00 -1.26 -0.15 -0.54 0.98 0.00 0.00 173.24 172.27 2k3b s LYS 47 N -3.42 0.84 0.00 4.02 1.02 -1.26 -0.66 119.74 120.28 2k3b s LYS 47 Ca 0.71 -0.97 0.00 0.00 0.02 0.00 0.00 55.97 55.74 2k3b s LYS 47 Cb -0.23 -0.87 0.00 0.00 -0.52 0.00 0.00 37.83 36.21 2k3b s LYS 47 CO 0.29 0.19 0.00 0.41 -0.92 0.00 0.00 175.35 175.32 2k3b n GLY 48 N 1.27 0.21 3.76 -3.33 0.00 -0.65 -4.76 105.19 101.68 2k3b n GLY 48 Ca -0.21 -1.12 -0.40 0.00 0.00 0.00 0.00 46.02 44.28 2k3b n GLY 48 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2k3b s LEU 49 N 0.00 4.51 0.02 0.99 1.43 0.86 -1.93 118.68 124.56 2k3b s LEU 49 Ca 0.00 2.36 0.00 0.00 -1.03 0.00 0.00 54.13 55.46 2k3b s LEU 49 Cb 0.00 -3.63 -0.02 0.00 0.03 0.00 0.00 46.19 42.57 2k3b s LEU 49 CO 0.00 -0.25 -0.03 0.72 0.23 0.00 0.00 176.35 177.02 2k3b s PHE 50 N -1.04 0.26 0.07 0.29 -0.12 0.67 -1.14 117.98 116.97 2k3b s PHE 50 Ca 0.46 -0.50 -0.28 0.00 -0.05 0.00 0.00 56.93 56.57 2k3b s PHE 50 Cb -0.34 -0.19 -0.05 0.00 -0.63 0.00 0.00 43.02 41.81 2k3b s PHE 50 CO 0.43 -0.18 0.88 -1.25 -0.05 0.00 0.00 175.22 175.05 2k3b s PRO 51 N -1.38 4.60 0.26 1.99 0.04 -1.26 -0.77 135.00 138.47 2k3b s PRO 51 Ca -0.15 1.28 -0.03 0.00 0.04 0.00 0.00 61.00 62.14 2k3b s PRO 51 Cb -0.09 -3.38 0.32 0.00 0.04 0.00 0.00 34.50 31.38 2k3b s PRO 51 CO -0.01 0.22 1.80 0.77 0.04 0.00 0.00 177.00 179.82 2k3b h SER 52 N 5.74 0.87 0.08 6.66 0.02 -0.44 -2.64 113.55 123.84 2k3b h SER 52 Ca -0.43 -0.16 0.00 0.00 -0.84 0.00 0.00 61.79 60.36 2k3b h SER 52 Cb 1.21 -0.23 0.00 0.00 0.14 0.00 0.00 62.40 63.52 2k3b h SER 52 CO 0.72 0.84 0.00 -0.46 -1.14 0.00 0.00 176.83 176.79 2k3b n ASN 53 N -4.26 0.00 -0.69 3.07 6.94 -1.26 -1.49 115.26 117.56 2k3b n ASN 53 Ca 0.05 0.41 0.13 0.00 -0.02 0.00 0.00 54.58 55.15 2k3b n ASN 53 Cb 0.23 -0.43 0.32 0.00 -2.36 0.00 0.00 39.78 37.54 2k3b n ASN 53 CO 0.00 0.00 0.00 -1.22 -1.03 0.00 0.00 177.26 175.01 2k3b n TYR 54 N -1.43 0.00 -4.12 -2.53 4.02 -0.99 -4.86 117.16 107.24 2k3b n TYR 54 Ca 0.01 0.00 -0.09 0.00 -0.01 0.00 0.00 57.90 57.81 2k3b n TYR 54 Cb 0.03 -0.00 -0.10 0.00 -0.02 0.00 0.00 39.34 39.24 2k3b n TYR 54 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 176.86 175.99 2k3b s VAL 55 N -2.02 0.46 -0.07 -0.72 -7.23 -0.56 -0.15 120.40 110.11 2k3b s VAL 55 Ca 0.33 -1.79 0.02 0.00 -1.81 0.00 0.00 61.98 58.73 2k3b s VAL 55 Cb 0.20 -1.49 0.01 0.00 0.56 0.00 0.00 36.38 35.66 2k3b s VAL 55 CO 0.33 -0.88 -0.12 -0.55 -0.31 0.00 0.00 175.10 173.57 2k3b s SER 56 N -2.84 1.78 0.42 4.85 0.15 -0.94 -4.84 113.70 112.28 2k3b s SER 56 Ca 0.07 -0.30 -0.26 0.00 0.70 0.00 0.00 55.95 56.16 2k3b s SER 56 Cb 0.05 -0.82 -0.10 0.00 -1.71 0.00 0.00 66.02 63.44 2k3b s SER 56 CO -0.07 0.03 1.42 0.18 1.20 0.00 0.00 173.24 176.00 2k3b n LEU 57 N 3.86 4.75 0.00 3.45 4.77 -1.26 -0.89 117.00 131.68 2k3b n LEU 57 Ca -0.23 1.16 0.00 0.00 -0.03 0.00 0.00 56.01 56.91 2k3b n LEU 57 Cb 0.52 -1.59 0.00 0.00 -2.33 0.00 0.00 43.42 40.02 2k3b n LEU 57 CO 0.25 -0.15 0.00 0.61 -1.33 0.00 0.00 177.39 176.77 2k3b n GLY 58 N 0.58 -1.09 0.11 -0.72 0.00 -0.04 -4.77 105.19 99.27 2k3b n GLY 58 Ca 0.04 -1.19 0.16 0.00 0.00 0.00 0.00 46.02 45.02 2k3b n GLY 58 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02