#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 -4.38 135.00 131.03 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 -3.42 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 -1.58 -0.02 0.00 -1.16 0.00 0.00 33.47 30.58 2k3b s TRP 3 CO 0.52 0.41 0.15 0.00 -4.06 0.00 0.00 176.95 173.97 2k3b s ALA 4 N -2.49 0.36 -0.11 2.67 0.00 0.37 -0.86 121.76 121.70 2k3b s ALA 4 Ca 0.36 -1.11 0.01 0.00 0.00 0.00 0.00 51.96 51.22 2k3b s ALA 4 Cb -0.00 0.75 -0.02 0.00 0.00 0.00 0.00 23.12 23.85 2k3b s ALA 4 CO 0.21 -0.54 -0.15 0.95 0.00 0.00 0.00 175.76 176.23 2k3b s THR 5 N -3.98 2.93 0.21 0.00 -4.23 0.09 -0.75 115.64 109.92 2k3b s THR 5 Ca 0.17 -0.72 -0.30 0.00 -1.18 0.00 0.00 61.69 59.66 2k3b s THR 5 Cb 0.06 -2.20 -0.09 0.00 1.34 0.00 0.00 72.50 71.60 2k3b s THR 5 CO -0.02 0.54 1.39 0.00 -0.54 0.00 0.00 174.62 176.00 2k3b s ALA 6 N 0.08 3.60 -0.17 3.99 0.00 0.22 -1.32 121.76 128.15 2k3b s ALA 6 Ca -0.06 1.23 0.18 0.00 0.00 0.00 0.00 51.96 53.31 2k3b s ALA 6 Cb -0.15 -3.53 -0.26 0.00 0.00 0.00 0.00 23.12 19.18 2k3b s ALA 6 CO 0.05 -0.65 0.18 -1.91 0.00 0.00 0.00 175.76 173.42 2k3b n GLU 7 N 2.72 0.68 -4.03 0.00 2.13 -0.16 -1.12 120.64 120.85 2k3b n GLU 7 Ca 0.07 -0.01 -0.11 0.00 0.66 0.00 0.00 57.16 57.77 2k3b n GLU 7 Cb 0.41 -1.54 -0.11 0.00 0.27 0.00 0.00 31.44 30.47 2k3b n GLU 7 CO 0.00 0.00 0.00 0.71 -0.41 0.00 0.00 177.13 177.43 2k3b s TYR 8 N -2.65 0.50 0.23 4.31 2.02 -1.20 -4.85 117.35 115.70 2k3b s TYR 8 Ca -0.09 -0.52 -0.30 0.00 -0.37 0.00 0.00 57.07 55.79 2k3b s TYR 8 Cb 0.07 -0.31 -0.10 0.00 -0.40 0.00 0.00 41.96 41.22 2k3b s TYR 8 CO 0.84 -0.13 1.44 0.34 -1.57 0.00 0.00 175.55 176.47 2k3b s ASP 9 N -1.54 6.68 -0.11 2.29 -1.08 -1.26 -4.33 116.67 117.33 2k3b s ASP 9 Ca -0.12 2.61 0.01 0.00 -0.52 0.00 0.00 52.55 54.53 2k3b s ASP 9 Cb -0.10 -2.62 0.02 0.00 -1.46 0.00 0.00 42.92 38.76 2k3b s ASP 9 CO -0.00 -0.69 -0.13 -0.47 0.52 0.00 0.00 175.17 174.39 2k3b s TYR 10 N 0.21 1.81 -0.32 -5.34 5.04 -1.02 -4.96 117.35 112.76 2k3b s TYR 10 Ca 0.61 -0.86 -0.12 0.00 -2.44 0.00 0.00 57.07 54.26 2k3b s TYR 10 Cb -0.41 -1.35 -0.02 0.00 0.35 0.00 0.00 41.96 40.53 2k3b s TYR 10 CO 0.40 -0.48 0.21 0.34 -1.34 0.00 0.00 175.55 174.69 2k3b s ASP 11 N 1.16 5.93 0.32 4.32 2.15 -1.26 -2.04 116.67 127.25 2k3b s ASP 11 Ca -0.04 -0.39 -0.29 0.00 0.43 0.00 0.00 52.55 52.26 2k3b s ASP 11 Cb -0.14 -2.10 -0.11 0.00 -0.30 0.00 0.00 42.92 40.27 2k3b s ASP 11 CO -0.03 -0.20 1.46 0.00 -0.17 0.00 0.00 175.17 176.23 2k3b s ALA 12 N 1.70 3.61 -0.81 3.66 0.00 -1.25 -4.89 121.76 123.78 2k3b s ALA 12 Ca 0.06 1.45 0.08 0.00 0.00 0.00 0.00 51.96 53.55 2k3b s ALA 12 Cb -0.17 -3.58 0.15 0.00 0.00 0.00 0.00 23.12 19.52 2k3b s ALA 12 CO 0.10 -0.88 1.00 0.00 0.00 0.00 0.00 175.76 175.97 2k3b n ALA 13 N 1.38 2.28 -2.17 0.00 0.00 -1.26 -4.99 120.51 115.76 2k3b n ALA 13 Ca 0.04 -0.87 -0.09 0.00 0.00 0.00 0.00 53.44 52.52 2k3b n ALA 13 Cb 0.40 -0.29 -0.10 0.00 0.00 0.00 0.00 19.45 19.45 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 -0.85 0.75 0.34 0.00 2.02 -1.26 -5.05 118.70 114.64 2k3b s GLU 14 Ca 0.13 -1.28 0.05 0.00 0.02 0.00 0.00 54.97 53.90 2k3b s GLU 14 Cb 0.08 -0.06 0.62 0.00 0.10 0.00 0.00 34.13 34.86 2k3b s GLU 14 CO 0.11 -0.05 1.86 -0.44 0.02 0.00 0.00 175.26 176.76 2k3b h ASP 15 N 3.08 0.43 -0.19 -0.19 3.32 -2.03 -2.59 116.42 118.26 2k3b h ASP 15 Ca -0.35 -0.09 0.00 0.00 0.02 0.00 0.00 57.03 56.61 2k3b h ASP 15 Cb 1.16 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 40.60 2k3b h ASP 15 CO 0.64 0.54 0.00 0.59 -1.72 0.00 0.00 179.24 179.30 2k3b n ASN 16 N -4.26 1.55 -4.81 6.45 3.02 -1.26 -4.88 115.26 111.06 2k3b n ASN 16 Ca 0.01 -1.75 -0.36 0.00 -0.03 0.00 0.00 54.58 52.45 2k3b n ASN 16 Cb 0.27 -0.12 -0.07 0.00 -0.61 0.00 0.00 39.78 39.25 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 -1.76 3.63 0.32 3.52 2.02 -0.98 -0.41 118.70 125.04 2k3b s GLU 17 Ca 0.30 -0.18 -0.27 0.00 0.02 0.00 0.00 54.97 54.83 2k3b s GLU 17 Cb 0.16 -3.22 -0.09 0.00 0.10 0.00 0.00 34.13 31.07 2k3b s GLU 17 CO 0.23 0.62 1.04 -0.51 0.02 0.00 0.00 175.26 176.67 2k3b s LEU 18 N -0.59 4.41 -0.14 1.80 1.43 -0.88 -4.72 118.68 119.99 2k3b s LEU 18 Ca 0.12 2.09 -0.03 0.00 -1.03 0.00 0.00 54.13 55.29 2k3b s LEU 18 Cb -0.12 -3.85 -0.03 0.00 0.03 0.00 0.00 46.19 42.22 2k3b s LEU 18 CO 0.02 -0.20 -0.06 -0.89 0.23 0.00 0.00 176.35 175.46 2k3b s THR 19 N -1.38 3.74 0.25 5.49 2.01 -1.26 -3.92 115.64 120.57 2k3b s THR 19 Ca 0.49 -0.42 -0.17 0.00 0.31 0.00 0.00 61.69 61.90 2k3b s THR 19 Cb -0.26 -2.62 0.01 0.00 0.01 0.00 0.00 72.50 69.64 2k3b s THR 19 CO 0.33 0.51 0.58 0.72 -0.69 0.00 0.00 174.62 176.08 2k3b s PHE 20 N 0.21 0.07 0.29 4.92 -0.12 -0.87 -4.97 117.98 117.51 2k3b s PHE 20 Ca -0.03 -0.47 0.11 0.00 -0.05 0.00 0.00 56.93 56.49 2k3b s PHE 20 Cb -0.14 0.43 -0.05 0.00 -0.63 0.00 0.00 43.02 42.63 2k3b s PHE 20 CO 0.03 -1.08 -0.18 0.14 -0.05 0.00 0.00 175.22 174.08 2k3b s VAL 21 N -3.96 2.40 0.20 -2.49 -7.23 -1.26 -2.43 120.40 105.63 2k3b s VAL 21 Ca 0.16 -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 -0.63 0.86 -0.11 4.82 2.13 -1.26 -1.31 120.64 125.14 2k3b n GLU 22 Ca -0.05 0.30 0.00 0.00 0.66 0.00 0.00 57.16 58.07 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 -0.28 -4.95 115.26 114.35 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 39.43 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 -0.42 -4.60 116.67 120.87 2k3b s ASP 24 Ca 0.00 2.39 -0.11 0.00 0.71 0.00 0.00 52.55 55.54 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 -1.23 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 -0.61 119.74 127.72 2k3b s LYS 25 Ca 0.69 0.13 0.01 0.00 0.02 0.00 0.00 55.97 56.83 2k3b s LYS 25 Cb -0.31 -3.22 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 2.46 0.35 2.17 1.09 0.07 -1.51 121.20 124.86 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 0.84 2.57 -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 -1.16 -4.71 4.36 3.02 -1.17 -1.50 115.26 113.09 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 3.21 -0.20 2.41 1.01 -0.64 -4.54 121.20 118.67 2k3b s ILE 29 Ca 0.04 0.82 -0.03 0.00 0.00 0.00 0.00 60.65 61.49 2k3b s ILE 29 Cb -0.01 -3.53 -0.01 0.00 0.01 0.00 0.00 42.46 38.92 2k3b s ILE 29 CO 0.85 0.05 -0.07 -1.61 0.00 0.00 0.00 174.94 174.16 2k3b s GLU 30 N 1.45 3.35 -1.20 2.79 2.02 0.23 -4.31 118.70 123.03 2k3b s GLU 30 Ca 0.66 -0.65 -0.18 0.00 0.02 0.00 0.00 54.97 54.83 2k3b s GLU 30 Cb -0.38 -2.91 -0.03 0.00 0.10 0.00 0.00 34.13 30.92 2k3b s GLU 30 CO 0.30 -0.13 2.04 1.19 0.02 0.00 0.00 175.26 178.69 2k3b n PHE 31 N 4.56 3.11 -0.12 1.61 3.72 -1.26 -1.36 117.46 127.71 2k3b n PHE 31 Ca -0.18 -2.47 -0.11 0.00 -0.05 0.00 0.00 57.45 54.64 2k3b n PHE 31 Cb 0.51 -2.31 -0.02 0.00 -0.94 0.00 0.00 39.48 36.72 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 4.54 1.27 -4.38 -4.37 2.07 -1.91 -3.46 116.25 110.02 2k3b h VAL 32 Ca 0.48 -1.08 -0.18 0.00 0.82 0.00 0.00 66.70 66.74 2k3b h VAL 32 Cb 0.71 1.26 -0.15 0.00 -1.52 0.00 0.00 31.29 31.58 2k3b h VAL 32 CO 1.80 0.35 -0.65 -0.62 0.02 0.00 0.00 177.57 178.47 2k3b s ASP 33 N -6.22 0.37 0.30 0.57 2.15 -0.66 -5.05 116.67 108.13 2k3b s ASP 33 Ca -0.13 -1.18 0.02 0.00 0.43 0.00 0.00 52.55 51.69 2k3b s ASP 33 Cb 0.09 0.28 0.47 0.00 -0.30 0.00 0.00 42.92 43.46 2k3b s ASP 33 CO 0.79 -0.70 1.81 0.44 -0.17 0.00 0.00 175.17 177.33 2k3b h ASP 34 N 2.90 0.59 0.09 -0.34 3.32 -2.01 -3.31 116.42 117.68 2k3b h ASP 34 Ca -0.35 -0.14 -0.36 0.00 0.02 0.00 0.00 57.03 56.20 2k3b h ASP 34 Cb 1.19 -0.16 -0.06 0.00 0.22 0.00 0.00 39.33 40.52 2k3b h ASP 34 CO 0.60 0.69 -2.26 -0.67 -1.72 0.00 0.00 179.24 175.88 2k3b n ASP 35 N -4.23 0.85 -4.40 6.45 2.03 -1.26 -4.87 116.55 111.12 2k3b n ASP 35 Ca 0.02 0.05 -0.33 0.00 0.52 0.00 0.00 54.79 55.05 2k3b n ASP 35 Cb 0.29 0.29 -0.14 0.00 -0.72 0.00 0.00 41.12 40.84 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 -2.52 2.77 0.13 -0.67 0.52 -1.24 0.73 118.94 118.65 2k3b s TRP 36 Ca -0.17 -0.49 0.09 0.00 0.02 0.00 0.00 56.10 55.56 2k3b s TRP 36 Cb 0.07 -1.77 -0.04 0.00 -1.15 0.00 0.00 33.47 30.59 2k3b s TRP 36 CO 0.76 -0.08 -0.18 -1.58 0.02 0.00 0.00 176.95 175.90 2k3b s TRP 37 N -0.02 2.52 -0.22 -1.98 0.51 0.40 -1.66 118.94 118.48 2k3b s TRP 37 Ca -0.03 -0.27 -0.08 0.00 -2.12 0.00 0.00 56.10 53.60 2k3b s TRP 37 Cb -0.14 -1.31 -0.04 0.00 -0.81 0.00 0.00 33.47 31.17 2k3b s TRP 37 CO 0.04 0.41 0.08 -1.17 -0.51 0.00 0.00 176.95 175.80 2k3b s LEU 38 N -2.28 3.65 0.00 2.99 2.96 -0.47 -0.09 118.68 125.44 2k3b s LEU 38 Ca 0.19 -0.07 0.00 0.00 -0.22 0.00 0.00 54.13 54.03 2k3b s LEU 38 Cb -0.10 -1.96 0.00 0.00 0.50 0.00 0.00 46.19 44.63 2k3b s LEU 38 CO 0.11 0.05 0.00 0.61 -1.32 0.00 0.00 176.35 175.80 2k3b n GLY 39 N 4.36 4.09 2.87 7.98 0.00 -0.96 0.74 105.19 124.26 2k3b n GLY 39 Ca -0.16 -1.42 -0.12 0.00 0.00 0.00 0.00 46.02 44.31 2k3b n GLY 39 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2k3b s GLU 40 N -0.73 0.00 0.09 1.61 2.02 -0.56 -1.77 118.70 119.36 2k3b s GLU 40 Ca 0.00 0.01 -0.30 0.00 0.02 0.00 0.00 54.97 54.70 2k3b s GLU 40 Cb 0.00 -0.00 -0.06 0.00 0.10 0.00 0.00 34.13 34.17 2k3b s GLU 40 CO 0.00 -0.01 1.11 -0.51 0.02 0.00 0.00 175.26 175.87 2k3b s LEU 41 N 0.03 4.42 0.30 1.80 1.43 0.17 0.34 118.68 127.17 2k3b s LEU 41 Ca -0.00 1.96 0.00 0.00 -1.03 0.00 0.00 54.13 55.06 2k3b s LEU 41 Cb -0.00 -3.59 0.51 0.00 0.03 0.00 0.00 46.19 43.14 2k3b s LEU 41 CO -0.00 -0.32 1.92 -0.08 0.23 0.00 0.00 176.35 178.10 2k3b h GLU 42 N 6.15 1.02 0.00 1.70 4.81 -1.62 -1.19 114.58 125.45 2k3b h GLU 42 Ca -0.42 -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 0.76 0.67 -0.12 1.57 -0.73 0.00 0.00 179.01 181.17 2k3b h LYS 43 N 1.05 0.00 0.00 1.92 2.10 -1.91 -3.38 116.57 116.34 2k3b h LYS 43 Ca 0.38 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.03 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 -0.14 0.12 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 -1.18 -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 0.81 3.77 6.12 0.00 -0.46 -5.00 105.19 110.44 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 5.66 0.07 1.61 1.04 -1.26 -4.71 113.70 113.38 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 55.73 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 0.80 3.76 -3.33 0.00 -0.73 -4.73 105.19 102.23 2k3b n GLY 48 Ca -0.21 -1.05 -0.40 0.00 0.00 0.00 0.00 46.02 44.36 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 4.55 -0.06 0.99 1.43 0.45 -2.27 118.68 123.77 2k3b s LEU 49 Ca 0.00 2.19 -0.05 0.00 -1.03 0.00 0.00 54.13 55.24 2k3b s LEU 49 Cb 0.00 -3.66 0.02 0.00 0.03 0.00 0.00 46.19 42.58 2k3b s LEU 49 CO 0.00 -0.10 0.15 0.72 0.23 0.00 0.00 176.35 177.35 2k3b s PHE 50 N -1.20 -0.16 0.25 0.29 -0.71 0.87 -2.07 117.98 115.24 2k3b s PHE 50 Ca 0.45 0.40 -0.30 0.00 -1.04 0.00 0.00 56.93 56.44 2k3b s PHE 50 Cb -0.30 0.05 -0.11 0.00 -1.21 0.00 0.00 43.02 41.45 2k3b s PHE 50 CO 0.38 -0.08 1.54 -2.14 -1.34 0.00 0.00 175.22 173.58 2k3b s PRO 51 N 0.13 4.19 0.47 1.99 0.02 -1.26 -0.45 135.00 140.08 2k3b s PRO 51 Ca -0.00 2.44 0.32 0.00 0.02 0.00 0.00 61.00 63.78 2k3b s PRO 51 Cb -0.01 -3.08 1.46 0.00 0.02 0.00 0.00 34.50 32.89 2k3b s PRO 51 CO -0.00 -0.56 1.95 0.66 -0.33 0.00 0.00 177.00 178.72 2k3b h SER 52 N 5.40 0.00 0.11 2.53 4.64 -0.02 -2.76 113.55 123.46 2k3b h SER 52 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 2k3b h SER 52 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 2k3b h SER 52 CO 0.82 0.00 -0.01 -0.46 -0.87 0.00 0.00 176.83 176.31 2k3b n ASN 53 N -2.76 0.21 -0.67 4.97 6.94 -1.26 -3.45 115.26 119.23 2k3b n ASN 53 Ca 0.00 -0.89 0.13 0.00 -0.02 0.00 0.00 54.58 53.79 2k3b n ASN 53 Cb 0.20 -0.05 0.26 0.00 -2.36 0.00 0.00 39.78 37.84 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 -0.90 0.00 -4.18 -2.53 4.02 -1.04 -4.93 117.16 107.60 2k3b n TYR 54 Ca 0.21 0.00 -0.11 0.00 -0.01 0.00 0.00 57.90 57.99 2k3b n TYR 54 Cb 0.17 -0.01 -0.10 0.00 -0.02 0.00 0.00 39.34 39.38 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 -2.10 0.55 -0.06 -0.72 -7.23 -1.22 -0.99 120.40 108.62 2k3b s VAL 55 Ca 0.30 -1.93 0.02 0.00 -1.81 0.00 0.00 61.98 58.56 2k3b s VAL 55 Cb 0.20 -1.85 0.01 0.00 0.56 0.00 0.00 36.38 35.30 2k3b s VAL 55 CO 0.36 -0.71 -0.13 -0.94 -0.31 0.00 0.00 175.10 173.38 2k3b s SER 56 N -3.07 1.84 0.42 4.85 1.04 -0.44 -4.87 113.70 113.47 2k3b s SER 56 Ca 0.17 -0.31 -0.26 0.00 0.48 0.00 0.00 55.95 56.03 2k3b s SER 56 Cb 0.06 -0.82 -0.09 0.00 0.10 0.00 0.00 66.02 65.27 2k3b s SER 56 CO -0.02 0.05 1.45 -0.76 0.98 0.00 0.00 173.24 174.94 2k3b s LEU 57 N 0.59 4.19 0.00 2.42 1.43 -1.26 -0.73 118.68 125.32 2k3b s LEU 57 Ca -0.14 2.98 0.00 0.00 -1.03 0.00 0.00 54.13 55.94 2k3b s LEU 57 Cb -0.15 -3.83 0.00 0.00 0.03 0.00 0.00 46.19 42.23 2k3b s LEU 57 CO 0.04 -1.07 0.00 0.61 0.23 0.00 0.00 176.35 176.16 2k3b n GLY 58 N 0.53 -1.07 0.12 -3.19 0.00 -0.04 -4.77 105.19 96.76 2k3b n GLY 58 Ca 0.03 -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