#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ked h PRO 2 N 0.00 0.92 -5.62 -1.58 0.13 -2.02 -3.36 132.00 120.47 2ked h PRO 2 Ca 0.00 -0.06 -0.64 0.00 -0.87 0.00 0.00 66.00 64.44 2ked h PRO 2 Cb 0.00 -0.21 -0.14 0.00 0.13 0.00 0.00 31.00 30.78 2ked h PRO 2 CO 0.00 0.61 0.31 0.08 -0.23 0.00 0.00 178.00 178.76 2ked s VAL 3 N -6.14 4.67 -0.54 1.56 1.01 -1.26 -4.89 120.40 114.81 2ked s VAL 3 Ca -0.13 0.22 0.07 0.00 0.00 0.00 0.00 61.98 62.13 2ked s VAL 3 Cb 0.14 -4.33 0.43 0.00 0.00 0.00 0.00 36.38 32.62 2ked s VAL 3 CO 0.77 -0.78 1.22 -1.20 0.00 0.00 0.00 175.10 175.11 2ked n SER 4 N 6.69 3.52 -4.50 3.32 7.64 -1.26 -4.74 113.62 124.29 2ked n SER 4 Ca 0.00 -2.56 -0.41 0.00 1.01 0.00 0.00 58.87 56.92 2ked n SER 4 Cb 0.48 -0.61 -0.10 0.00 -1.01 0.00 0.00 64.21 62.96 2ked n SER 4 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2ked s LEU 5 N -1.52 4.71 0.27 -3.43 1.43 -1.26 -4.96 118.68 113.93 2ked s LEU 5 Ca 0.29 -0.59 0.00 0.00 -1.03 0.00 0.00 54.13 52.80 2ked s LEU 5 Cb 0.23 -2.14 0.00 0.00 0.03 0.00 0.00 46.19 44.31 2ked s LEU 5 CO 0.08 -0.31 0.00 -1.20 0.23 0.00 0.00 176.35 175.15 2ked n SER 6 N 5.12 -5.27 -4.19 2.29 7.64 -1.26 -4.98 113.62 112.97 2ked n SER 6 Ca -0.12 0.56 -0.21 0.00 1.01 0.00 0.00 58.87 60.11 2ked n SER 6 Cb 0.49 -2.80 -0.13 0.00 -1.01 0.00 0.00 64.21 60.76 2ked n SER 6 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 2ked s TYR 7 N -2.52 1.38 0.28 1.43 2.02 -1.26 -5.06 117.35 113.63 2ked s TYR 7 Ca 0.00 -0.40 -0.01 0.00 -0.37 0.00 0.00 57.07 56.30 2ked s TYR 7 Cb 0.00 -0.80 -0.04 0.00 -0.40 0.00 0.00 41.96 40.72 2ked s TYR 7 CO 0.00 0.07 0.49 -0.98 -1.57 0.00 0.00 175.55 173.56 2ked s ARG 8 N -1.43 3.52 0.03 -0.62 1.70 -1.26 -5.10 118.95 115.79 2ked s ARG 8 Ca 0.02 -0.29 0.06 0.00 -0.47 0.00 0.00 55.73 55.05 2ked s ARG 8 Cb -0.09 -2.73 -0.02 0.00 -0.57 0.00 0.00 34.95 31.54 2ked s ARG 8 CO 0.02 0.26 -0.18 0.00 -1.08 0.00 0.00 175.30 174.31 2ked h PRO 10 N 5.02 0.00 -5.21 0.00 0.11 -1.99 -3.40 132.00 126.53 2ked h PRO 10 Ca -0.40 0.00 -0.46 0.00 0.11 0.00 0.00 66.00 65.24 2ked h PRO 10 Cb 1.16 0.00 -0.28 0.00 0.11 0.00 0.00 31.00 31.99 2ked h PRO 10 CO 0.45 0.00 -0.80 0.00 -0.21 0.00 0.00 178.00 177.43 2ked n ARG 12 N 2.61 0.46 -4.25 0.00 1.74 -1.26 -5.04 116.66 110.92 2ked n ARG 12 Ca -0.15 0.11 -0.14 0.00 -0.77 0.00 0.00 57.85 56.90 2ked n ARG 12 Cb 0.55 -1.36 -0.10 0.00 -1.02 0.00 0.00 32.46 30.53 2ked n ARG 12 CO 0.00 0.00 0.00 -0.59 -1.52 0.00 0.00 177.63 175.52 2ked s PHE 13 N -2.37 1.25 0.04 -1.55 -0.12 -1.26 -5.15 117.98 108.82 2ked s PHE 13 Ca -0.25 -0.78 0.05 0.00 -0.05 0.00 0.00 56.93 55.90 2ked s PHE 13 Cb 0.07 -0.64 -0.02 0.00 -0.63 0.00 0.00 43.02 41.79 2ked s PHE 13 CO 0.42 0.06 -0.16 -0.06 -0.05 0.00 0.00 175.22 175.43 2ked s PHE 14 N -3.36 1.36 -0.17 3.49 0.08 -1.26 -4.34 117.98 113.78 2ked s PHE 14 Ca 0.17 -0.36 -0.23 0.00 0.12 0.00 0.00 56.93 56.63 2ked s PHE 14 Cb 0.03 -0.80 -0.02 0.00 -0.57 0.00 0.00 43.02 41.66 2ked s PHE 14 CO 0.00 0.05 0.74 -1.21 -0.10 0.00 0.00 175.22 174.71 2ked s GLU 15 N -1.17 4.27 0.00 0.44 0.41 0.20 -4.77 118.70 118.08 2ked s GLU 15 Ca 0.03 0.85 0.24 0.00 -0.41 0.00 0.00 54.97 55.67 2ked s GLU 15 Cb -0.08 -3.57 0.17 0.00 -1.78 0.00 0.00 34.13 28.88 2ked s GLU 15 CO 0.01 -0.26 1.23 0.43 -0.49 0.00 0.00 175.26 176.19 2ked n SER 16 N 5.04 2.60 -2.03 -0.19 7.64 -1.26 -3.42 113.62 122.00 2ked n SER 16 Ca 0.02 -1.81 -0.11 0.00 1.01 0.00 0.00 58.87 57.98 2ked n SER 16 Cb 0.49 0.15 0.27 0.00 -1.01 0.00 0.00 64.21 64.12 2ked n SER 16 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 2ked n HIS 17 N 0.84 2.58 -3.20 1.43 8.25 -1.26 -4.98 115.22 118.88 2ked n HIS 17 Ca 0.13 -1.39 -0.39 0.00 -0.26 0.00 0.00 57.72 55.81 2ked n HIS 17 Cb 0.54 -0.75 -0.06 0.00 1.12 0.00 0.00 29.99 30.84 2ked n HIS 17 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 2ked s VAL 18 N -3.09 4.76 -0.11 1.59 1.01 -1.26 -5.06 120.40 118.24 2ked s VAL 18 Ca 0.55 1.30 -0.03 0.00 0.00 0.00 0.00 61.98 63.81 2ked s VAL 18 Cb 0.45 -3.95 -0.03 0.00 0.00 0.00 0.00 36.38 32.85 2ked s VAL 18 CO 0.12 0.49 -0.00 0.00 0.00 0.00 0.00 175.10 175.71 2ked s ALA 19 N -0.71 3.24 0.40 5.51 0.00 -1.26 -5.01 121.76 123.93 2ked s ALA 19 Ca 0.31 -0.80 0.13 0.00 0.00 0.00 0.00 51.96 51.60 2ked s ALA 19 Cb -0.19 -1.54 0.84 0.00 0.00 0.00 0.00 23.12 22.23 2ked s ALA 19 CO 0.19 0.48 1.89 -0.09 0.00 0.00 0.00 175.76 178.23 2ked h ARG 20 N 5.61 0.00 0.00 0.00 9.65 -1.97 -1.03 114.38 126.63 2ked h ARG 20 Ca -0.46 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.42 2ked h ARG 20 Cb 1.19 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.77 2ked h ARG 20 CO 0.58 0.30 0.00 0.00 2.80 0.00 0.00 179.97 183.64 2ked n ALA 21 N -2.48 2.23 0.39 2.80 0.00 -1.26 -3.10 120.51 119.10 2ked n ALA 21 Ca -0.02 -0.10 0.05 0.00 0.00 0.00 0.00 53.44 53.36 2ked n ALA 21 Cb 0.34 -1.42 0.04 0.00 0.00 0.00 0.00 19.45 18.41 2ked n ALA 21 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2ked n ASN 22 N -1.41 1.75 -4.65 0.00 5.15 -0.42 -4.90 115.26 110.78 2ked n ASN 22 Ca 0.09 -1.38 -0.40 0.00 -0.60 0.00 0.00 54.58 52.29 2ked n ASN 22 Cb 0.26 0.03 -0.06 0.00 -0.53 0.00 0.00 39.78 39.47 2ked n ASN 22 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 2ked s VAL 23 N -0.81 5.04 -0.02 3.44 0.11 -1.00 0.63 120.40 127.78 2ked s VAL 23 Ca 0.11 1.07 -0.03 0.00 -2.93 0.00 0.00 61.98 60.20 2ked s VAL 23 Cb 0.08 -3.90 -0.27 0.00 -1.53 0.00 0.00 36.38 30.76 2ked s VAL 23 CO 0.12 0.10 0.76 0.07 -3.33 0.00 0.00 175.10 172.83 2ked h LYS 24 N 7.65 0.24 -2.24 1.54 2.10 -1.00 -3.45 116.57 121.41 2ked h LYS 24 Ca -0.30 -0.41 -0.00 0.00 -2.00 0.00 0.00 60.65 57.93 2ked h LYS 24 Cb 1.14 0.15 -0.23 0.00 -0.90 0.00 0.00 32.23 32.39 2ked h LYS 24 CO 0.76 1.08 -0.24 -1.58 -2.00 0.00 0.00 179.45 177.47 2ked s HIS 25 N -2.60 -1.09 -0.15 0.07 5.04 -1.22 -5.02 115.29 110.33 2ked s HIS 25 Ca -0.11 1.96 -0.03 0.00 -1.54 0.00 0.00 55.06 55.34 2ked s HIS 25 Cb 0.07 0.57 -0.02 0.00 0.04 0.00 0.00 32.58 33.24 2ked s HIS 25 CO 0.84 -0.58 -0.06 -1.17 -2.34 0.00 0.00 174.74 171.43 2ked s LEU 26 N 2.73 3.09 -0.21 8.88 2.96 -1.26 -1.89 118.68 132.97 2ked s LEU 26 Ca -0.04 -0.19 -0.04 0.00 -0.22 0.00 0.00 54.13 53.63 2ked s LEU 26 Cb -0.12 -1.73 0.08 0.00 0.50 0.00 0.00 46.19 44.92 2ked s LEU 26 CO -0.16 0.16 0.13 -0.75 -1.32 0.00 0.00 176.35 174.41 2ked s LYS 27 N 0.38 0.12 -0.11 1.98 2.36 0.13 -5.01 119.74 119.60 2ked s LYS 27 Ca -0.06 -0.15 -0.18 0.00 -2.55 0.00 0.00 55.97 53.03 2ked s LYS 27 Cb -0.15 -1.54 -0.04 0.00 -1.05 0.00 0.00 37.83 35.05 2ked s LYS 27 CO 0.04 -0.76 0.48 0.42 1.55 0.00 0.00 175.35 177.08 2ked s ILE 28 N 2.17 5.17 -0.30 5.43 1.01 -1.26 0.00 121.20 133.42 2ked s ILE 28 Ca 0.05 0.97 -0.01 0.00 0.00 0.00 0.00 60.65 61.65 2ked s ILE 28 Cb -0.16 -3.82 0.05 0.00 0.01 0.00 0.00 42.46 38.54 2ked s ILE 28 CO -0.17 0.34 -0.01 -0.22 0.00 0.00 0.00 174.94 174.88 2ked s LEU 29 N 0.54 3.84 -0.17 2.97 2.96 0.26 -4.93 118.68 124.15 2ked s LEU 29 Ca 0.26 -1.27 -0.20 0.00 -0.22 0.00 0.00 54.13 52.70 2ked s LEU 29 Cb -0.15 -1.70 -0.03 0.00 0.50 0.00 0.00 46.19 44.81 2ked s LEU 29 CO 0.11 -0.25 0.58 0.54 -1.32 0.00 0.00 176.35 176.01 2ked s ASN 30 N 1.24 6.68 -0.11 3.68 4.22 -1.26 -0.86 114.94 128.53 2ked s ASN 30 Ca -0.05 0.82 0.02 0.00 -2.14 0.00 0.00 52.86 51.51 2ked s ASN 30 Cb -0.20 -2.33 0.01 0.00 1.28 0.00 0.00 41.25 40.02 2ked s ASN 30 CO -0.01 -0.19 -0.18 -0.89 -2.04 0.00 0.00 177.10 173.79 2ked s THR 31 N 1.52 1.69 0.56 0.54 2.01 0.36 -4.97 115.64 117.36 2ked s THR 31 Ca 0.28 -0.77 0.39 0.00 0.31 0.00 0.00 61.69 61.90 2ked s THR 31 Cb -0.16 -1.52 0.58 0.00 0.01 0.00 0.00 72.50 71.42 2ked s THR 31 CO 0.11 0.48 1.70 -0.65 -0.69 0.00 0.00 174.62 175.57 2ked h PRO 32 N 7.27 0.00 0.00 4.92 0.11 -1.97 0.13 132.00 142.46 2ked h PRO 32 Ca -0.30 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.81 2ked h PRO 32 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2ked h PRO 32 CO 0.50 0.00 0.00 0.09 -0.21 0.00 0.00 178.00 178.38 2ked n ASN 33 N -3.98 0.82 -0.13 -2.05 3.02 -1.26 -4.61 115.26 107.07 2ked n ASN 33 Ca 0.30 -1.22 0.01 0.00 -0.03 0.00 0.00 54.58 53.64 2ked n ASN 33 Cb 1.46 0.00 0.02 0.00 -0.61 0.00 0.00 39.78 40.64 2ked n ASN 33 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2ked n ALA 35 N -0.26 0.00 -2.78 0.00 0.00 0.38 -4.52 120.51 113.34 2ked n ALA 35 Ca 0.02 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.03 2ked n ALA 35 Cb 0.52 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.93 2ked n ALA 35 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2ked s LEU 36 N 0.00 4.10 -0.23 0.00 2.96 -1.26 -0.48 118.68 123.77 2ked s LEU 36 Ca 0.00 -0.96 -0.11 0.00 -0.22 0.00 0.00 54.13 52.84 2ked s LEU 36 Cb 0.00 -2.46 -0.05 0.00 0.50 0.00 0.00 46.19 44.18 2ked s LEU 36 CO 0.00 -1.51 0.18 -1.10 -1.32 0.00 0.00 176.35 172.59 2ked s GLN 37 N 4.40 4.11 -0.16 1.98 -0.21 -0.04 -4.70 119.66 125.05 2ked s GLN 37 Ca 0.27 -0.21 -0.08 0.00 0.02 0.00 0.00 55.36 55.36 2ked s GLN 37 Cb -0.13 -3.51 -0.04 0.00 1.00 0.00 0.00 33.01 30.32 2ked s GLN 37 CO 0.09 0.10 0.13 0.42 -2.12 0.00 0.00 175.29 173.91 2ked s ILE 38 N 0.93 5.40 -0.12 1.08 1.01 -1.21 0.92 121.20 129.20 2ked s ILE 38 Ca 0.09 0.18 0.03 0.00 0.00 0.00 0.00 60.65 60.95 2ked s ILE 38 Cb -0.13 -3.40 0.01 0.00 0.01 0.00 0.00 42.46 38.94 2ked s ILE 38 CO 0.04 0.53 -0.22 -0.69 0.00 0.00 0.00 174.94 174.59 2ked s VAL 39 N -0.35 2.03 -0.00 2.92 1.01 0.10 -0.12 120.40 125.99 2ked s VAL 39 Ca 0.11 -0.98 -0.07 0.00 0.00 0.00 0.00 61.98 61.04 2ked s VAL 39 Cb -0.12 -1.78 0.00 0.00 0.00 0.00 0.00 36.38 34.49 2ked s VAL 39 CO 0.01 0.55 0.14 0.00 0.00 0.00 0.00 175.10 175.80 2ked s ALA 40 N 0.63 -0.34 -0.00 5.51 0.00 0.68 0.19 121.76 128.43 2ked s ALA 40 Ca -0.12 -0.07 0.01 0.00 0.00 0.00 0.00 51.96 51.78 2ked s ALA 40 Cb -0.16 0.07 -0.04 0.00 0.00 0.00 0.00 23.12 22.99 2ked s ALA 40 CO 0.02 -0.20 0.03 1.03 0.00 0.00 0.00 175.76 176.65 2ked s ARG 41 N -1.24 2.89 0.38 0.00 0.52 -0.79 -0.02 118.95 120.69 2ked s ARG 41 Ca -0.13 -0.56 -0.07 0.00 -0.52 0.00 0.00 55.73 54.45 2ked s ARG 41 Cb -0.07 -2.74 -0.05 0.00 0.52 0.00 0.00 34.95 32.61 2ked s ARG 41 CO 0.01 0.63 0.69 -0.51 0.02 0.00 0.00 175.30 176.15 2ked s LEU 42 N -1.63 3.87 -0.16 2.53 1.43 -0.45 -0.44 118.68 123.82 2ked s LEU 42 Ca 0.21 0.90 -0.21 0.00 -1.03 0.00 0.00 54.13 54.00 2ked s LEU 42 Cb -0.12 -3.78 -0.18 0.00 0.03 0.00 0.00 46.19 42.14 2ked s LEU 42 CO 0.12 -0.37 0.37 0.11 0.23 0.00 0.00 176.35 176.80 2ked h LYS 43 N 1.11 0.00 0.20 1.70 1.57 -0.12 -2.33 116.57 118.69 2ked h LYS 43 Ca -0.47 0.00 -0.31 0.00 -1.87 0.00 0.00 60.65 57.99 2ked h LYS 43 Cb 1.19 0.00 0.03 0.00 0.08 0.00 0.00 32.23 33.53 2ked h LYS 43 CO 0.64 0.80 -1.37 -0.97 -0.57 0.00 0.00 179.45 177.97 2ked h ASN 44 N -1.00 0.76 0.51 0.86 -0.73 -1.93 -3.32 115.58 110.73 2ked h ASN 44 Ca -0.15 -0.78 -0.06 0.00 1.87 0.00 0.00 56.30 57.18 2ked h ASN 44 Cb 0.98 -0.24 -0.01 0.00 0.27 0.00 0.00 38.32 39.31 2ked h ASN 44 CO -0.09 1.60 -1.55 -3.20 -0.37 0.00 0.00 177.43 173.83 2ked n ASN 45 N -3.69 0.49 0.00 1.15 5.15 -1.26 -4.96 115.26 112.13 2ked n ASN 45 Ca -0.14 0.20 0.00 0.00 -0.60 0.00 0.00 54.58 54.03 2ked n ASN 45 Cb 1.06 0.98 0.00 0.00 -0.53 0.00 0.00 39.78 41.29 2ked n ASN 45 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 2ked n ASN 46 N -2.58 0.00 -4.79 1.20 5.15 -0.88 -4.93 115.26 108.44 2ked n ASN 46 Ca -0.06 0.00 -0.34 0.00 -0.60 0.00 0.00 54.58 53.58 2ked n ASN 46 Cb 0.66 -1.25 -0.02 0.00 -0.53 0.00 0.00 39.78 38.65 2ked n ASN 46 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 2ked s ARG 47 N -0.23 3.57 -0.29 1.20 0.52 -1.26 -4.34 118.95 118.12 2ked s ARG 47 Ca 0.00 1.47 -0.17 0.00 -0.52 0.00 0.00 55.73 56.51 2ked s ARG 47 Cb 0.00 -2.05 -0.02 0.00 0.52 0.00 0.00 34.95 33.39 2ked s ARG 47 CO 0.00 -0.64 0.45 -1.14 0.02 0.00 0.00 175.30 173.99 2ked s GLN 48 N -3.30 3.92 0.13 3.54 0.74 -1.26 -1.34 119.66 122.09 2ked s GLN 48 Ca 0.70 0.06 0.04 0.00 0.05 0.00 0.00 55.36 56.21 2ked s GLN 48 Cb -0.20 -3.70 -0.04 0.00 1.10 0.00 0.00 33.01 30.17 2ked s GLN 48 CO 0.24 -0.40 -0.11 0.14 -0.55 0.00 0.00 175.29 174.61 2ked s VAL 49 N 2.22 1.14 0.13 1.34 -7.23 0.97 -4.96 120.40 114.01 2ked s VAL 49 Ca 0.18 -1.93 -0.09 0.00 -1.81 0.00 0.00 61.98 58.32 2ked s VAL 49 Cb -0.16 -1.71 -0.06 0.00 0.56 0.00 0.00 36.38 35.01 2ked s VAL 49 CO 0.11 -0.67 0.44 0.00 -0.31 0.00 0.00 175.10 174.67 2ked s ILE 51 N -1.54 2.80 -0.13 0.00 1.01 0.83 0.62 121.20 124.80 2ked s ILE 51 Ca 0.38 -0.90 -0.29 0.00 0.00 0.00 0.00 60.65 59.83 2ked s ILE 51 Cb -0.13 -2.10 -0.01 0.00 0.01 0.00 0.00 42.46 40.23 2ked s ILE 51 CO 0.20 0.53 1.11 -0.62 0.00 0.00 0.00 174.94 176.16 2ked s ASP 52 N -0.87 7.11 0.00 3.58 -1.08 -1.22 -3.31 116.67 120.89 2ked s ASP 52 Ca 0.12 1.61 0.03 0.00 -0.52 0.00 0.00 52.55 53.79 2ked s ASP 52 Cb -0.10 -2.55 0.20 0.00 -1.46 0.00 0.00 42.92 39.01 2ked s ASP 52 CO 0.01 -0.58 0.77 -0.81 0.52 0.00 0.00 175.17 175.09 2ked n PRO 53 N 5.57 0.61 0.00 4.34 -0.04 -1.26 -2.21 135.00 142.00 2ked n PRO 53 Ca 0.11 0.00 0.05 0.00 -0.04 0.00 0.00 63.50 63.62 2ked n PRO 53 Cb 0.47 -1.09 -0.01 0.00 -0.04 0.00 0.00 33.50 32.83 2ked n PRO 53 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2ked n LYS 54 N -0.59 2.22 -1.64 0.54 4.76 -1.26 -4.74 118.16 117.44 2ked n LYS 54 Ca 0.03 -0.56 -0.42 0.00 -2.87 0.00 0.00 58.31 54.49 2ked n LYS 54 Cb 0.01 -1.09 0.00 0.00 -1.84 0.00 0.00 35.03 32.12 2ked n LYS 54 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 2ked n LEU 55 N -0.35 2.90 -0.15 -0.35 4.77 -0.94 -4.79 117.00 118.09 2ked n LEU 55 Ca 0.04 1.12 -0.09 0.00 -0.03 0.00 0.00 56.01 57.06 2ked n LEU 55 Cb 0.21 -1.40 0.00 0.00 -2.33 0.00 0.00 43.42 39.91 2ked n LEU 55 CO 0.14 -1.08 0.94 0.50 -1.33 0.00 0.00 177.39 176.56 2ked h LYS 56 N 1.98 0.66 0.00 3.23 3.64 -1.94 0.20 116.57 124.34 2ked h LYS 56 Ca -0.44 -0.12 -0.05 0.00 -1.27 0.00 0.00 60.65 58.77 2ked h LYS 56 Cb 1.32 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 33.02 2ked h LYS 56 CO 0.60 0.61 -0.23 0.11 -2.27 0.00 0.00 179.45 178.26 2ked h TRP 57 N 0.58 0.00 -0.10 1.91 5.08 -1.95 -0.74 115.95 120.72 2ked h TRP 57 Ca 0.15 0.00 -0.17 0.00 1.08 0.00 0.00 58.89 59.95 2ked h TRP 57 Cb 0.19 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.34 2ked h TRP 57 CO 0.00 0.23 -0.65 0.82 -1.28 0.00 0.00 178.44 177.56 2ked h ILE 58 N 0.00 1.37 -0.17 0.12 1.08 -1.62 -0.27 117.51 118.02 2ked h ILE 58 Ca -0.00 -2.02 -0.09 0.00 -0.39 0.00 0.00 64.86 62.36 2ked h ILE 58 Cb 0.66 2.01 -0.01 0.00 -3.07 0.00 0.00 36.82 36.40 2ked h ILE 58 CO 0.03 0.61 -0.28 1.56 -0.69 0.00 0.00 178.15 179.38 2ked h GLN 59 N 0.28 0.32 -0.20 2.37 1.08 0.45 0.24 115.11 119.64 2ked h GLN 59 Ca -0.02 -0.12 -0.02 0.00 -1.45 0.00 0.00 58.65 57.05 2ked h GLN 59 Cb 1.20 -0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 28.60 2ked h GLN 59 CO 0.11 0.57 0.06 0.93 -0.95 0.00 0.00 178.83 179.55 2ked h GLU 60 N 0.28 0.32 -0.04 1.46 4.39 -0.86 0.13 114.58 120.27 2ked h GLU 60 Ca 0.04 -0.07 0.03 0.00 0.34 0.00 0.00 59.36 59.70 2ked h GLU 60 Cb 0.64 -0.04 -0.04 0.00 -0.10 0.00 0.00 28.75 29.21 2ked h GLU 60 CO 0.05 0.43 -0.17 -0.92 -1.16 0.00 0.00 179.01 177.24 2ked h TYR 61 N 0.15 -0.43 -0.05 4.33 3.20 -0.54 -1.22 116.97 122.41 2ked h TYR 61 Ca 0.06 0.02 -0.16 0.00 3.14 0.00 0.00 58.73 61.79 2ked h TYR 61 Cb 0.25 0.20 -0.01 0.00 1.54 0.00 0.00 36.73 38.70 2ked h TYR 61 CO 0.00 -0.24 -0.69 -0.07 -1.64 0.00 0.00 178.16 175.53 2ked h LEU 62 N -0.25 0.26 -0.16 2.82 3.38 -0.53 -0.38 115.31 120.45 2ked h LEU 62 Ca 0.06 -0.17 0.02 0.00 0.09 0.00 0.00 57.88 57.89 2ked h LEU 62 Cb 0.34 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 2ked h LEU 62 CO -0.18 0.87 0.00 -0.08 0.09 0.00 0.00 178.44 179.14 2ked h GLU 63 N 0.15 0.05 0.25 1.13 4.22 -0.55 0.16 114.58 120.00 2ked h GLU 63 Ca -0.02 -0.00 -0.01 0.00 0.08 0.00 0.00 59.36 59.41 2ked h GLU 63 Cb 1.23 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.45 2ked h GLU 63 CO 0.11 0.04 -0.27 -0.22 -2.18 0.00 0.00 179.01 176.48 2ked h LYS 64 N 0.06 -0.51 -0.67 1.92 1.63 -0.98 0.12 116.57 118.14 2ked h LYS 64 Ca 0.07 0.03 0.13 0.00 -0.85 0.00 0.00 60.65 60.04 2ked h LYS 64 Cb 0.09 0.12 -0.04 0.00 -0.60 0.00 0.00 32.23 31.79 2ked h LYS 64 CO -0.12 -0.34 0.46 0.00 -3.45 0.00 0.00 179.45 176.00 2ked h ALA 65 N -1.29 2.15 0.00 5.00 0.00 -1.01 0.21 119.26 124.32 2ked h ALA 65 Ca -0.03 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.77 2ked h ALA 65 Cb 0.46 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 2ked h ALA 65 CO -0.04 -0.32 -0.62 -0.07 0.00 0.00 0.00 179.25 178.20 2ked h LEU 66 N 0.35 0.00 0.00 0.00 3.38 -0.44 -3.21 115.31 115.39 2ked h LEU 66 Ca 0.32 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.22 2ked h LEU 66 Cb 0.78 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.52 2ked h LEU 66 CO -0.09 0.45 -0.74 -1.13 0.09 0.00 0.00 178.44 177.03 2ked h ASN 67 N 0.00 0.00 0.00 -0.43 -0.73 0.48 -3.50 115.58 111.39 2ked h ASN 67 Ca -0.03 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.14 2ked h ASN 67 Cb 1.37 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.96 2ked h ASN 67 CO 0.05 0.28 0.00 1.17 -0.37 0.00 0.00 177.43 178.57