#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2klg s GLN 2 N 0.00 3.13 0.05 3.17 -0.21 -1.26 -4.20 119.66 120.35 2klg s GLN 2 Ca 0.00 -0.76 0.00 0.00 0.02 0.00 0.00 55.36 54.62 2klg s GLN 2 Cb 0.00 -4.02 -0.03 0.00 1.00 0.00 0.00 33.01 29.95 2klg s GLN 2 CO 0.00 -1.03 -0.04 -1.50 -2.12 0.00 0.00 175.29 170.60 2klg s ILE 3 N 2.43 0.32 -0.51 1.08 2.07 -1.26 -2.71 121.20 122.62 2klg s ILE 3 Ca 0.15 -1.52 0.03 0.00 -1.41 0.00 0.00 60.65 57.90 2klg s ILE 3 Cb -0.18 -1.12 0.13 0.00 0.13 0.00 0.00 42.46 41.42 2klg s ILE 3 CO 0.14 -0.78 0.26 -0.36 -1.91 0.00 0.00 174.94 172.29 2klg s PHE 4 N -2.94 3.32 0.36 3.50 0.40 -1.26 -4.61 117.98 116.75 2klg s PHE 4 Ca 0.00 -3.05 -0.01 0.00 -0.60 0.00 0.00 56.93 53.28 2klg s PHE 4 Cb 0.01 -2.92 -0.03 0.00 0.51 0.00 0.00 43.02 40.59 2klg s PHE 4 CO -0.05 -0.80 0.58 0.08 0.70 0.00 0.00 175.22 175.73 2klg s VAL 5 N -0.04 5.08 -0.12 -0.44 1.01 -1.26 -3.93 120.40 120.69 2klg s VAL 5 Ca 0.16 -0.35 -0.03 0.00 0.00 0.00 0.00 61.98 61.75 2klg s VAL 5 Cb -0.24 -3.86 -0.03 0.00 0.00 0.00 0.00 36.38 32.25 2klg s VAL 5 CO -0.02 -0.58 0.01 -0.75 0.00 0.00 0.00 175.10 173.75 2klg s LYS 6 N -4.33 3.36 0.00 2.72 2.20 -1.25 -4.57 119.74 117.87 2klg s LYS 6 Ca 0.41 -0.42 0.00 0.00 -0.36 0.00 0.00 55.97 55.61 2klg s LYS 6 Cb -0.10 -2.91 0.00 0.00 -1.51 0.00 0.00 37.83 33.31 2klg s LYS 6 CO 0.37 0.51 0.00 0.25 -0.36 0.00 0.00 175.35 176.12 2klg n THR 7 N 2.75 0.00 -0.29 3.43 -2.24 -1.26 -4.44 114.28 112.22 2klg n THR 7 Ca -0.18 0.00 -0.01 0.00 -2.27 0.00 0.00 64.05 61.59 2klg n THR 7 Cb 0.53 -0.97 0.18 0.00 -2.10 0.00 0.00 70.33 67.97 2klg n THR 7 CO 0.00 0.00 0.00 0.17 -0.57 0.00 0.00 175.07 174.67 2klg h LEU 8 N 0.00 1.00 0.00 3.22 8.10 -1.97 -3.38 115.31 122.28 2klg h LEU 8 Ca 0.00 -0.03 0.00 0.00 0.11 0.00 0.00 57.88 57.96 2klg h LEU 8 Cb 0.00 -0.25 0.00 0.00 -0.44 0.00 0.00 40.66 39.97 2klg h LEU 8 CO 0.00 0.73 -0.35 0.41 -4.11 0.00 0.00 178.44 175.12 2klg n THR 9 N -4.40 1.07 0.00 0.15 -1.04 -1.26 -4.92 114.28 103.89 2klg n THR 9 Ca 0.10 0.28 0.00 0.00 -2.04 0.00 0.00 64.05 62.38 2klg n THR 9 Cb 0.03 -1.78 0.00 0.00 -1.82 0.00 0.00 70.33 66.76 2klg n THR 9 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2klg n GLY 10 N 2.61 -0.01 3.88 3.41 0.00 -1.26 -5.13 105.19 108.69 2klg n GLY 10 Ca -0.05 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.68 2klg n GLY 10 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2klg s LYS 11 N 0.00 3.70 -0.41 1.61 2.36 -1.26 -4.91 119.74 120.84 2klg s LYS 11 Ca 0.00 0.50 -0.12 0.00 -2.55 0.00 0.00 55.97 53.80 2klg s LYS 11 Cb 0.00 -2.30 0.04 0.00 -1.05 0.00 0.00 37.83 34.52 2klg s LYS 11 CO 0.00 -0.20 0.27 -0.08 1.55 0.00 0.00 175.35 176.88 2klg s THR 12 N -2.65 4.79 0.34 3.43 -1.32 -1.26 -4.34 115.64 114.63 2klg s THR 12 Ca 0.52 -0.94 0.05 0.00 -1.21 0.00 0.00 61.69 60.11 2klg s THR 12 Cb -0.10 -3.75 -0.07 0.00 -1.51 0.00 0.00 72.50 67.07 2klg s THR 12 CO 0.39 -0.36 0.02 0.27 -2.21 0.00 0.00 174.62 172.73 2klg s ILE 13 N 1.58 1.54 0.23 5.08 -4.36 -1.26 -5.09 121.20 118.92 2klg s ILE 13 Ca 0.03 -2.03 0.07 0.00 -0.26 0.00 0.00 60.65 58.46 2klg s ILE 13 Cb -0.21 -2.79 -0.04 0.00 1.25 0.00 0.00 42.46 40.68 2klg s ILE 13 CO 0.07 -0.06 0.18 -0.89 0.24 0.00 0.00 174.94 174.47 2klg s THR 14 N -3.05 4.43 -0.11 8.37 2.01 -1.26 -4.27 115.64 121.75 2klg s THR 14 Ca 0.35 -1.35 -0.03 0.00 0.31 0.00 0.00 61.69 60.97 2klg s THR 14 Cb 0.08 -3.36 0.04 0.00 0.01 0.00 0.00 72.50 69.27 2klg s THR 14 CO 0.16 -0.30 0.05 -0.22 -0.69 0.00 0.00 174.62 173.62 2klg s LEU 15 N -3.69 0.45 0.07 4.42 1.98 -1.26 -5.03 118.68 115.63 2klg s LEU 15 Ca 0.32 -0.29 0.01 0.00 -2.89 0.00 0.00 54.13 51.28 2klg s LEU 15 Cb -0.08 -0.30 -0.04 0.00 0.66 0.00 0.00 46.19 46.42 2klg s LEU 15 CO 0.24 -0.27 0.19 -1.61 -1.89 0.00 0.00 176.35 173.01 2klg s GLU 16 N 2.07 3.33 0.01 1.98 2.02 -1.26 -3.69 118.70 123.17 2klg s GLU 16 Ca 0.03 -0.49 -0.00 0.00 0.02 0.00 0.00 54.97 54.53 2klg s GLU 16 Cb -0.14 -2.98 -0.01 0.00 0.10 0.00 0.00 34.13 31.10 2klg s GLU 16 CO -0.06 0.60 -0.02 0.08 0.02 0.00 0.00 175.26 175.88 2klg s VAL 17 N -1.49 0.07 0.33 2.63 1.01 -1.26 -4.97 120.40 116.72 2klg s VAL 17 Ca 0.34 -0.62 0.08 0.00 0.00 0.00 0.00 61.98 61.78 2klg s VAL 17 Cb -0.13 -0.18 -0.03 0.00 0.00 0.00 0.00 36.38 36.04 2klg s VAL 17 CO 0.27 -0.34 0.26 -1.61 0.00 0.00 0.00 175.10 173.68 2klg s GLU 18 N -0.99 2.68 0.09 2.72 8.01 -1.26 -5.00 118.70 124.95 2klg s GLU 18 Ca -0.11 -1.32 -0.30 0.00 0.01 0.00 0.00 54.97 53.26 2klg s GLU 18 Cb -0.07 -2.43 -0.13 0.00 -4.31 0.00 0.00 34.13 27.19 2klg s GLU 18 CO -0.01 0.12 1.63 -1.35 0.01 0.00 0.00 175.26 175.67 2klg h PRO 19 N 1.32 -0.61 -0.30 0.39 0.11 -2.04 -2.67 132.00 128.20 2klg h PRO 19 Ca -0.45 0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.70 2klg h PRO 19 Cb 1.25 0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.50 2klg h PRO 19 CO 0.59 -0.41 0.00 0.43 -0.21 0.00 0.00 178.00 178.40 2klg n SER 20 N -5.41 1.83 -4.65 -2.05 7.64 -1.26 -4.88 113.62 104.83 2klg n SER 20 Ca -0.09 -1.92 -0.43 0.00 1.01 0.00 0.00 58.87 57.44 2klg n SER 20 Cb 0.32 -0.20 -0.02 0.00 -1.01 0.00 0.00 64.21 63.30 2klg n SER 20 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2klg s ASP 21 N -1.16 6.82 0.63 6.43 2.15 -1.01 -5.02 116.67 125.51 2klg s ASP 21 Ca 0.26 1.54 -0.07 0.00 0.43 0.00 0.00 52.55 54.71 2klg s ASP 21 Cb 0.14 -2.54 0.02 0.00 -0.30 0.00 0.00 42.92 40.24 2klg s ASP 21 CO 0.19 -0.89 0.95 0.42 -0.17 0.00 0.00 175.17 175.67 2klg s THR 22 N 3.88 3.37 0.26 1.71 -4.23 -1.26 -4.33 115.64 115.03 2klg s THR 22 Ca 0.56 0.03 -0.04 0.00 -1.18 0.00 0.00 61.69 61.06 2klg s THR 22 Cb -0.20 -3.37 0.26 0.00 1.34 0.00 0.00 72.50 70.52 2klg s THR 22 CO 0.18 -0.41 1.90 -0.29 -0.54 0.00 0.00 174.62 175.47 2klg h ILE 23 N -0.33 1.15 -0.87 2.99 6.09 -0.52 -1.91 117.51 124.11 2klg h ILE 23 Ca -0.45 -0.42 0.02 0.00 -1.37 0.00 0.00 64.86 62.64 2klg h ILE 23 Cb 1.27 -0.19 -0.05 0.00 0.47 0.00 0.00 36.82 38.32 2klg h ILE 23 CO 0.61 0.22 0.58 -0.08 -3.07 0.00 0.00 178.15 176.41 2klg h GLU 24 N 1.23 1.10 0.00 2.19 4.22 -1.77 -1.09 114.58 120.46 2klg h GLU 24 Ca 0.40 -0.07 -0.01 0.00 0.08 0.00 0.00 59.36 59.76 2klg h GLU 24 Cb 0.04 -0.25 -0.00 0.00 0.50 0.00 0.00 28.75 29.04 2klg h GLU 24 CO -0.14 0.73 -0.05 -0.91 -2.18 0.00 0.00 179.01 176.46 2klg h ASN 25 N 1.13 0.00 -0.74 1.04 4.21 -1.72 -2.47 115.58 117.03 2klg h ASN 25 Ca 0.33 0.00 -0.05 0.00 1.21 0.00 0.00 56.30 57.79 2klg h ASN 25 Cb -0.05 0.00 -0.03 0.00 -1.12 0.00 0.00 38.32 37.12 2klg h ASN 25 CO -0.09 0.05 0.26 0.58 -1.29 0.00 0.00 177.43 176.95 2klg h VAL 26 N 0.00 1.26 -0.78 2.81 2.07 -1.12 -2.60 116.25 117.88 2klg h VAL 26 Ca -0.00 -0.86 0.07 0.00 0.82 0.00 0.00 66.70 66.73 2klg h VAL 26 Cb 0.18 0.40 -0.05 0.00 -1.52 0.00 0.00 31.29 30.30 2klg h VAL 26 CO 0.01 0.34 0.51 0.50 0.02 0.00 0.00 177.57 178.95 2klg h LYS 27 N 1.09 0.80 -0.24 1.57 3.64 -1.52 0.45 116.57 122.36 2klg h LYS 27 Ca 0.24 -0.05 -0.07 0.00 -1.27 0.00 0.00 60.65 59.51 2klg h LYS 27 Cb 0.26 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 31.89 2klg h LYS 27 CO -0.01 0.53 -0.11 0.00 -2.27 0.00 0.00 179.45 177.59 2klg h ALA 28 N 1.58 0.34 -0.11 5.00 0.00 -1.58 -1.82 119.26 122.67 2klg h ALA 28 Ca 0.34 -0.30 -0.24 0.00 0.00 0.00 0.00 54.91 54.71 2klg h ALA 28 Cb 0.27 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 17.99 2klg h ALA 28 CO -0.12 0.19 -0.85 1.57 0.00 0.00 0.00 179.25 180.04 2klg h LYS 29 N 0.23 0.77 -0.49 0.00 2.10 -1.24 -3.25 116.57 114.69 2klg h LYS 29 Ca 0.05 -0.68 -0.07 0.00 -2.00 0.00 0.00 60.65 57.96 2klg h LYS 29 Cb 0.61 0.16 -0.02 0.00 -0.90 0.00 0.00 32.23 32.08 2klg h LYS 29 CO 0.03 1.28 0.03 0.97 -2.00 0.00 0.00 179.45 179.76 2klg h ILE 30 N 0.50 1.24 0.00 0.07 -0.00 -0.16 -2.41 117.51 116.75 2klg h ILE 30 Ca -0.07 -0.95 -0.01 0.00 -0.00 0.00 0.00 64.86 63.83 2klg h ILE 30 Cb 1.49 0.83 -0.00 0.00 -0.00 0.00 0.00 36.82 39.14 2klg h ILE 30 CO 0.17 0.34 -0.02 0.06 -0.00 0.00 0.00 178.15 178.70 2klg h GLN 31 N 0.74 0.00 0.00 2.19 3.07 -1.36 -2.69 115.11 117.06 2klg h GLN 31 Ca 0.15 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.89 2klg h GLN 31 Cb 0.41 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.97 2klg h GLN 31 CO 0.01 0.02 0.00 -0.40 0.09 0.00 0.00 178.83 178.56 2klg n ASP 32 N -3.20 0.52 -0.02 0.06 5.75 -0.91 -0.83 116.55 117.93 2klg n ASP 32 Ca -0.01 0.72 -0.17 0.00 -0.01 0.00 0.00 54.79 55.32 2klg n ASP 32 Cb 0.19 -0.80 -0.09 0.00 -1.03 0.00 0.00 41.12 39.40 2klg n ASP 32 CO 0.00 0.00 0.00 0.11 -0.11 0.00 0.00 177.20 177.20 2klg h LYS 33 N 0.00 0.58 0.00 0.11 1.57 -1.67 -3.44 116.57 113.72 2klg h LYS 33 Ca 0.00 -0.50 0.00 0.00 -1.87 0.00 0.00 60.65 58.28 2klg h LYS 33 Cb 0.05 0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.47 2klg h LYS 33 CO 0.00 1.12 0.00 -0.85 -0.57 0.00 0.00 179.45 179.15 2klg n GLU 34 N -4.15 0.00 0.00 3.15 0.28 -1.00 -5.11 120.64 113.82 2klg n GLU 34 Ca -0.08 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.92 2klg n GLU 34 Cb 0.66 -0.23 0.00 0.00 1.43 0.00 0.00 31.44 33.30 2klg n GLU 34 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2klg n GLY 35 N 0.87 0.74 3.60 -1.84 0.00 -0.01 -5.06 105.19 103.49 2klg n GLY 35 Ca 0.00 -0.74 -0.43 0.00 0.00 0.00 0.00 46.02 44.85 2klg n GLY 35 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2klg s ILE 36 N -1.26 4.04 0.20 -0.61 2.07 -1.26 -4.93 121.20 119.45 2klg s ILE 36 Ca 0.00 1.04 -0.10 0.00 -1.41 0.00 0.00 60.65 60.19 2klg s ILE 36 Cb 0.00 -4.45 0.13 0.00 0.13 0.00 0.00 42.46 38.26 2klg s ILE 36 CO 0.00 -0.96 1.77 -0.65 -1.91 0.00 0.00 174.94 173.19 2klg h PRO 37 N 9.95 1.06 -6.21 3.50 0.11 -2.00 -3.43 132.00 134.99 2klg h PRO 37 Ca -0.25 -0.18 -0.57 0.00 0.11 0.00 0.00 66.00 65.11 2klg h PRO 37 Cb 1.08 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 32.00 2klg h PRO 37 CO 1.12 0.86 1.28 -1.25 -0.21 0.00 0.00 178.00 179.80 2klg s PRO 38 N -5.60 3.64 0.00 1.05 0.04 -1.26 -4.86 135.00 128.01 2klg s PRO 38 Ca -0.13 1.99 0.15 0.00 0.04 0.00 0.00 61.00 63.06 2klg s PRO 38 Cb 0.14 -4.18 0.87 0.00 0.04 0.00 0.00 34.50 31.37 2klg s PRO 38 CO 0.82 -1.50 1.37 -0.40 0.04 0.00 0.00 177.00 177.32 2klg n ASP 39 N 9.36 0.00 -0.74 6.66 5.68 -1.26 -2.84 116.55 133.41 2klg n ASP 39 Ca 0.23 -0.30 0.06 0.00 -0.50 0.00 0.00 54.79 54.27 2klg n ASP 39 Cb 0.44 -0.09 0.17 0.00 -1.14 0.00 0.00 41.12 40.50 2klg n ASP 39 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2klg n GLN 40 N -1.09 1.98 -2.94 0.11 3.00 -1.26 -4.76 117.38 112.42 2klg n GLN 40 Ca 0.10 -1.38 -0.44 0.00 -0.01 0.00 0.00 57.00 55.28 2klg n GLN 40 Cb 0.07 -1.35 -0.04 0.00 0.00 0.00 0.00 30.24 28.93 2klg n GLN 40 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.06 175.92 2klg s GLN 41 N -1.54 3.24 0.29 -1.09 -0.44 -1.13 -4.96 119.66 114.03 2klg s GLN 41 Ca 0.25 -1.22 0.04 0.00 -2.50 0.00 0.00 55.36 51.94 2klg s GLN 41 Cb 0.14 -4.43 -0.02 0.00 -1.64 0.00 0.00 33.01 27.06 2klg s GLN 41 CO 0.16 -1.74 0.15 0.54 0.50 0.00 0.00 175.29 174.90 2klg n ARG 42 N 7.05 0.54 -3.85 1.67 3.00 -1.26 -5.01 116.66 118.80 2klg n ARG 42 Ca 0.03 -2.63 -0.35 0.00 -0.01 0.00 0.00 57.85 54.89 2klg n ARG 42 Cb 0.46 1.68 -0.05 0.00 0.00 0.00 0.00 32.46 34.54 2klg n ARG 42 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.63 176.46 2klg s LEU 43 N 0.00 4.38 -0.59 0.55 2.96 -1.26 -2.88 118.68 121.83 2klg s LEU 43 Ca 0.21 0.46 -0.09 0.00 -0.22 0.00 0.00 54.13 54.49 2klg s LEU 43 Cb 0.01 -2.46 0.15 0.00 0.50 0.00 0.00 46.19 44.40 2klg s LEU 43 CO 0.15 0.31 0.48 -0.63 -1.32 0.00 0.00 176.35 175.33 2klg s ILE 44 N -1.22 4.48 -0.17 6.68 -1.09 -0.45 -4.81 121.20 124.62 2klg s ILE 44 Ca 0.23 -2.20 -0.07 0.00 -2.23 0.00 0.00 60.65 56.38 2klg s ILE 44 Cb -0.13 -3.89 0.08 0.00 -1.58 0.00 0.00 42.46 36.94 2klg s ILE 44 CO 0.13 -0.87 0.38 0.12 -1.23 0.00 0.00 174.94 173.48 2klg s PHE 45 N 0.76 -0.66 -1.55 3.97 2.19 -1.26 -4.58 117.98 116.85 2klg s PHE 45 Ca 0.11 1.34 -0.04 0.00 0.33 0.00 0.00 56.93 58.67 2klg s PHE 45 Cb -0.21 0.23 0.01 0.00 -1.31 0.00 0.00 43.02 41.74 2klg s PHE 45 CO -0.03 -0.41 0.38 0.00 1.83 0.00 0.00 175.22 176.99 2klg n ALA 46 N 5.01 -0.88 -3.55 11.12 0.00 -1.26 -2.12 120.51 128.83 2klg n ALA 46 Ca -0.13 0.22 -0.25 0.00 0.00 0.00 0.00 53.44 53.28 2klg n ALA 46 Cb 0.51 -3.13 -0.02 0.00 0.00 0.00 0.00 19.45 16.81 2klg n ALA 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2klg n GLY 47 N -1.29 -0.47 3.42 0.00 0.00 -1.26 -4.92 105.19 100.67 2klg n GLY 47 Ca -0.14 0.08 -0.34 0.00 0.00 0.00 0.00 46.02 45.61 2klg n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2klg s LYS 48 N -6.20 3.55 0.25 1.61 3.01 -0.90 -5.11 119.74 115.95 2klg s LYS 48 Ca 0.46 -0.57 -0.12 0.00 -1.01 0.00 0.00 55.97 54.74 2klg s LYS 48 Cb -0.25 -2.95 -0.08 0.00 -1.01 0.00 0.00 37.83 33.54 2klg s LYS 48 CO 0.57 0.07 0.61 -0.65 0.51 0.00 0.00 175.35 176.46 2klg s GLN 49 N 0.81 3.89 -0.00 1.68 -0.21 -1.26 -4.53 119.66 120.05 2klg s GLN 49 Ca -0.01 0.43 0.00 0.00 0.02 0.00 0.00 55.36 55.81 2klg s GLN 49 Cb -0.15 -2.62 0.01 0.00 1.00 0.00 0.00 33.01 31.26 2klg s GLN 49 CO 0.02 0.29 0.86 1.47 -2.12 0.00 0.00 175.29 175.80 2klg n LEU 50 N -0.09 0.39 0.07 2.90 -0.00 -1.26 -3.83 117.00 115.18 2klg n LEU 50 Ca 0.01 -0.20 -0.21 0.00 -0.00 0.00 0.00 56.01 55.61 2klg n LEU 50 Cb 0.53 -0.16 -0.14 0.00 -0.00 0.00 0.00 43.42 43.64 2klg n LEU 50 CO 0.44 0.09 0.01 1.05 -0.00 0.00 0.00 177.39 178.98 2klg h GLU 51 N 0.08 0.45 -6.12 1.47 4.11 -1.95 -3.37 114.58 109.24 2klg h GLU 51 Ca 0.00 -0.65 -0.73 0.00 0.07 0.00 0.00 59.36 58.05 2klg h GLU 51 Cb 0.18 0.22 0.01 0.00 0.50 0.00 0.00 28.75 29.66 2klg h GLU 51 CO 0.00 1.28 0.99 -0.25 0.07 0.00 0.00 179.01 181.11 2klg n ASP 52 N -4.00 2.33 -2.24 3.06 8.00 -1.25 -4.75 116.55 117.70 2klg n ASP 52 Ca -0.14 0.98 -0.05 0.00 0.71 0.00 0.00 54.79 56.29 2klg n ASP 52 Cb 0.88 -1.15 -0.07 0.00 -0.02 0.00 0.00 41.12 40.76 2klg n ASP 52 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2klg n GLY 53 N 4.62 1.85 1.04 0.44 0.00 -1.26 -4.58 105.19 107.30 2klg n GLY 53 Ca 0.29 -0.50 -0.07 0.00 0.00 0.00 0.00 46.02 45.75 2klg n GLY 53 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2klg n ARG 54 N 2.71 1.18 -3.74 1.61 3.00 -1.26 -4.90 116.66 115.26 2klg n ARG 54 Ca 0.18 -0.91 -0.36 0.00 -0.00 0.00 0.00 57.85 56.75 2klg n ARG 54 Cb 0.40 0.06 -0.07 0.00 0.00 0.00 0.00 32.46 32.85 2klg n ARG 54 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.63 177.55 2klg s THR 55 N -0.56 5.41 0.44 5.15 -1.32 -1.26 0.21 115.64 123.70 2klg s THR 55 Ca 0.10 0.29 0.20 0.00 -1.21 0.00 0.00 61.69 61.07 2klg s THR 55 Cb -0.01 -3.48 0.40 0.00 -1.51 0.00 0.00 72.50 67.89 2klg s THR 55 CO 0.07 0.51 1.86 0.17 -2.21 0.00 0.00 174.62 175.01 2klg h LEU 56 N 5.94 0.35 -1.39 9.08 8.10 -1.86 0.11 115.31 135.64 2klg h LEU 56 Ca -0.47 0.04 -0.01 0.00 0.11 0.00 0.00 57.88 57.55 2klg h LEU 56 Cb 1.19 -0.02 -0.02 0.00 -0.44 0.00 0.00 40.66 41.36 2klg h LEU 56 CO 0.69 0.13 0.25 -1.28 -4.11 0.00 0.00 178.44 174.11 2klg h SER 57 N 0.34 0.58 -0.70 0.17 0.87 -1.89 -2.29 113.55 110.64 2klg h SER 57 Ca 0.47 -0.04 0.17 0.00 -1.23 0.00 0.00 61.79 61.15 2klg h SER 57 Cb 1.26 -0.15 -0.04 0.00 -0.44 0.00 0.00 62.40 63.04 2klg h SER 57 CO -0.16 0.49 0.48 0.44 -0.53 0.00 0.00 176.83 177.55 2klg h ASP 58 N 0.66 0.19 -0.60 6.23 3.32 -1.17 0.20 116.42 125.25 2klg h ASP 58 Ca 0.17 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.23 2klg h ASP 58 Cb 0.04 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 39.57 2klg h ASP 58 CO -0.03 0.09 0.00 -1.22 -1.72 0.00 0.00 179.24 176.37 2klg n TYR 59 N -4.42 1.39 -1.80 4.55 4.02 -0.88 -4.92 117.16 115.10 2klg n TYR 59 Ca 0.13 -0.55 -0.19 0.00 -0.01 0.00 0.00 57.90 57.28 2klg n TYR 59 Cb 0.63 -0.24 -0.06 0.00 -0.02 0.00 0.00 39.34 39.65 2klg n TYR 59 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 2klg n ASN 60 N 1.02 -5.24 -3.57 7.72 5.15 0.69 -4.87 115.26 116.15 2klg n ASN 60 Ca 0.24 0.35 -0.41 0.00 -0.60 0.00 0.00 54.58 54.16 2klg n ASN 60 Cb 0.83 -4.58 -0.00 0.00 -0.53 0.00 0.00 39.78 35.50 2klg n ASN 60 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2klg n ILE 61 N -2.73 5.02 -3.14 -1.44 0.13 -1.10 -4.95 119.36 111.15 2klg n ILE 61 Ca -0.20 -4.33 -0.21 0.00 -1.10 0.00 0.00 62.75 56.90 2klg n ILE 61 Cb 0.65 -2.15 0.06 0.00 -0.84 0.00 0.00 39.64 37.36 2klg n ILE 61 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 2klg s GLN 62 N -0.77 2.24 1.01 9.51 -2.07 -1.26 -4.73 119.66 123.59 2klg s GLN 62 Ca 0.51 -1.74 -0.13 0.00 -1.82 0.00 0.00 55.36 52.18 2klg s GLN 62 Cb 0.16 -2.57 0.20 0.00 -1.09 0.00 0.00 33.01 29.71 2klg s GLN 62 CO -0.07 -0.91 0.45 0.36 -1.32 0.00 0.00 175.29 173.80 2klg n LYS 63 N -2.24 -1.60 0.00 9.60 2.85 -1.26 -3.12 118.16 122.39 2klg n LYS 63 Ca 0.15 -0.76 0.00 0.00 -1.05 0.00 0.00 58.31 56.65 2klg n LYS 63 Cb 0.62 -1.47 0.00 0.00 -0.65 0.00 0.00 35.03 33.53 2klg n LYS 63 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 2klg n GLU 64 N -1.60 0.00 -0.76 -1.58 -0.58 -1.10 -4.90 120.64 110.12 2klg n GLU 64 Ca 0.07 0.00 -0.29 0.00 -0.42 0.00 0.00 57.16 56.52 2klg n GLU 64 Cb 0.31 -0.27 0.24 0.00 -0.57 0.00 0.00 31.44 31.15 2klg n GLU 64 CO 0.00 0.00 0.00 -1.12 -0.48 0.00 0.00 177.13 175.53 2klg s SER 65 N 0.00 0.98 -0.31 1.62 0.01 -1.18 -4.97 113.70 109.85 2klg s SER 65 Ca 0.00 1.16 -0.15 0.00 1.31 0.00 0.00 55.95 58.27 2klg s SER 65 Cb 0.00 -1.77 -0.03 0.00 0.21 0.00 0.00 66.02 64.43 2klg s SER 65 CO 0.00 -4.15 0.35 0.42 0.41 0.00 0.00 173.24 170.27 2klg s THR 66 N -2.65 5.19 -0.26 1.44 -4.23 -1.26 -4.63 115.64 109.24 2klg s THR 66 Ca 0.68 0.27 -0.06 0.00 -1.18 0.00 0.00 61.69 61.40 2klg s THR 66 Cb -0.19 -3.74 -0.00 0.00 1.34 0.00 0.00 72.50 69.91 2klg s THR 66 CO 0.60 0.05 0.04 -0.76 -0.54 0.00 0.00 174.62 174.01 2klg s LEU 67 N 2.01 3.48 -0.22 4.79 1.02 -1.25 -5.04 118.68 123.48 2klg s LEU 67 Ca 0.12 -0.52 -0.06 0.00 0.02 0.00 0.00 54.13 53.70 2klg s LEU 67 Cb -0.16 -1.84 -0.03 0.00 0.02 0.00 0.00 46.19 44.18 2klg s LEU 67 CO 0.11 -0.11 0.03 -1.00 0.02 0.00 0.00 176.35 175.40 2klg s HIS 68 N 1.51 3.08 0.31 0.29 3.76 -1.26 -3.92 115.29 119.06 2klg s HIS 68 Ca 0.04 -0.39 0.06 0.00 -0.15 0.00 0.00 55.06 54.62 2klg s HIS 68 Cb -0.16 -2.14 -0.02 0.00 1.11 0.00 0.00 32.58 31.37 2klg s HIS 68 CO 0.01 -0.24 0.40 -0.51 -0.85 0.00 0.00 174.74 173.55 2klg s LEU 69 N 1.15 3.99 0.48 0.89 2.01 -1.26 -1.34 118.68 124.60 2klg s LEU 69 Ca 0.03 -0.17 0.08 0.00 0.01 0.00 0.00 54.13 54.08 2klg s LEU 69 Cb -0.14 -2.67 0.02 0.00 0.01 0.00 0.00 46.19 43.40 2klg s LEU 69 CO 0.02 -0.30 0.50 0.68 1.01 0.00 0.00 176.35 178.26 2klg s VAL 70 N -2.14 2.38 0.52 -1.59 -7.23 -1.14 -4.91 120.40 106.29 2klg s VAL 70 Ca 0.41 -1.25 -0.18 0.00 -1.81 0.00 0.00 61.98 59.16 2klg s VAL 70 Cb -0.09 -2.63 -0.07 0.00 0.56 0.00 0.00 36.38 34.15 2klg s VAL 70 CO 0.29 0.00 1.00 -0.76 -0.31 0.00 0.00 175.10 175.33 2klg s LEU 71 N -4.31 3.67 -0.17 1.32 1.43 -1.26 -4.82 118.68 114.54 2klg s LEU 71 Ca 0.49 1.69 -0.08 0.00 -1.03 0.00 0.00 54.13 55.20 2klg s LEU 71 Cb -0.05 -4.53 -0.22 0.00 0.03 0.00 0.00 46.19 41.43 2klg s LEU 71 CO 0.30 -0.70 0.17 -2.11 0.23 0.00 0.00 176.35 174.23 2klg n ARG 72 N -1.45 0.70 -0.80 1.70 1.85 -1.26 -4.34 116.66 113.05 2klg n ARG 72 Ca 0.07 0.28 -0.08 0.00 -1.00 0.00 0.00 57.85 57.13 2klg n ARG 72 Cb 0.54 -1.66 -0.07 0.00 -1.05 0.00 0.00 32.46 30.22 2klg n ARG 72 CO 0.00 0.00 0.00 1.28 -0.01 0.00 0.00 177.63 178.90 2klg n LEU 73 N -3.63 5.49 -4.43 2.89 7.99 -1.26 -4.84 117.00 119.22 2klg n LEU 73 Ca -0.37 -2.91 -0.44 0.00 -0.01 0.00 0.00 56.01 52.29 2klg n LEU 73 Cb 0.97 -1.24 -0.04 0.00 -0.11 0.00 0.00 43.42 43.00 2klg n LEU 73 CO 0.33 1.35 0.70 -0.13 -1.51 0.00 0.00 177.39 178.13 2klg s ARG 74 N 0.09 3.18 0.00 3.23 1.81 -1.26 -4.43 118.95 121.57 2klg s ARG 74 Ca 0.33 -1.13 0.00 0.00 -1.72 0.00 0.00 55.73 53.21 2klg s ARG 74 Cb 0.17 -4.36 0.00 0.00 -0.45 0.00 0.00 34.95 30.32 2klg s ARG 74 CO -0.02 -1.74 0.00 0.41 -0.68 0.00 0.00 175.30 173.28 2klg n GLY 75 N 5.33 1.34 0.00 -3.53 0.00 -1.26 -5.16 105.19 101.91 2klg n GLY 75 Ca -0.00 -0.21 0.03 0.00 0.00 0.00 0.00 46.02 45.83 2klg n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93