#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kq8 n ILE 2 N 0.00-11.56 0.00 2.02 5.41 -1.26 -4.96 119.36 109.01 2kq8 n ILE 2 Ca 0.00 2.46 0.00 0.00 1.00 0.00 0.00 62.75 66.21 2kq8 n ILE 2 Cb 0.00 -6.02 0.00 0.00 -0.71 0.00 0.00 39.64 32.91 2kq8 n ILE 2 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2kq8 n GLY 3 N 1.48 0.07 2.93 7.39 0.00 -1.24 -4.67 105.19 111.15 2kq8 n GLY 3 Ca -0.29 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.48 2kq8 n GLY 3 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2kq8 s ASP 4 N 0.00 1.85 -0.19 1.61 -4.77 -1.26 -5.01 116.67 108.90 2kq8 s ASP 4 Ca 0.00 -0.26 0.17 0.00 -3.30 0.00 0.00 52.55 49.16 2kq8 s ASP 4 Cb 0.00 -0.75 0.46 0.00 -1.09 0.00 0.00 42.92 41.54 2kq8 s ASP 4 CO 0.00 -0.07 1.17 -1.22 0.70 0.00 0.00 175.17 175.74 2kq8 n TYR 5 N 4.52 1.06 -0.39 2.11 4.02 -1.26 -5.08 117.16 122.15 2kq8 n TYR 5 Ca -0.17 -1.63 0.00 0.00 -0.01 0.00 0.00 57.90 56.10 2kq8 n TYR 5 Cb 0.51 -0.24 0.00 0.00 -0.02 0.00 0.00 39.34 39.58 2kq8 n TYR 5 CO 0.00 0.00 0.00 0.98 -1.01 0.00 0.00 176.86 176.83 2kq8 n TYR 6 N -0.47 -1.07 -2.96 -0.72 9.36 -1.26 -4.84 117.16 115.20 2kq8 n TYR 6 Ca 0.19 0.57 -0.41 0.00 3.32 0.00 0.00 57.90 61.57 2kq8 n TYR 6 Cb 0.91 -1.49 -0.05 0.00 -0.63 0.00 0.00 39.34 38.08 2kq8 n TYR 6 CO 0.00 0.00 0.00 -1.50 0.22 0.00 0.00 176.86 175.58 2kq8 s ILE 7 N -3.07 4.92 0.20 2.97 2.07 -1.26 -4.68 121.20 122.35 2kq8 s ILE 7 Ca 0.00 1.48 0.00 0.00 -1.41 0.00 0.00 60.65 60.72 2kq8 s ILE 7 Cb 0.00 -4.07 0.00 0.00 0.13 0.00 0.00 42.46 38.52 2kq8 s ILE 7 CO 0.00 0.05 0.00 -3.20 -1.91 0.00 0.00 174.94 169.88 2kq8 n ASN 8 N 5.23 -4.23 -2.95 4.50 5.15 -1.26 -4.98 115.26 116.72 2kq8 n ASN 8 Ca 0.03 0.38 -0.05 0.00 -0.60 0.00 0.00 54.58 54.33 2kq8 n ASN 8 Cb 0.49 -2.21 0.01 0.00 -0.53 0.00 0.00 39.78 37.54 2kq8 n ASN 8 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2kq8 n ALA 9 N -2.17 -2.79 -3.20 5.20 0.00 -1.26 -3.94 120.51 112.35 2kq8 n ALA 9 Ca -0.01 0.67 -0.14 0.00 0.00 0.00 0.00 53.44 53.96 2kq8 n ALA 9 Cb 0.33 -2.80 0.07 0.00 0.00 0.00 0.00 19.45 17.05 2kq8 n ALA 9 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2kq8 n SER 10 N -0.94 -2.29 -3.12 0.00 7.64 -1.26 -5.04 113.62 108.61 2kq8 n SER 10 Ca 0.07 -0.51 0.00 0.00 1.01 0.00 0.00 58.87 59.44 2kq8 n SER 10 Cb 0.48 -4.33 0.00 0.00 -1.01 0.00 0.00 64.21 59.35 2kq8 n SER 10 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2kq8 n ALA 11 N -3.66 0.00 -0.36 -0.43 0.00 -1.25 -4.67 120.51 110.14 2kq8 n ALA 11 Ca -0.22 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.22 2kq8 n ALA 11 Cb 0.63 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.08 2kq8 n ALA 11 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 2kq8 n LEU 12 N 0.00 4.00 0.13 0.00 -0.00 -1.26 -4.36 117.00 115.51 2kq8 n LEU 12 Ca 0.00 -1.80 -0.13 0.00 -0.00 0.00 0.00 56.01 54.08 2kq8 n LEU 12 Cb 0.00 -0.84 -0.08 0.00 -0.00 0.00 0.00 43.42 42.50 2kq8 n LEU 12 CO 0.00 0.75 0.50 0.78 -0.00 0.00 0.00 177.39 179.43 2kq8 h ASN 13 N 1.73 -0.31 0.00 1.45 4.21 -1.87 -3.37 115.58 117.41 2kq8 h ASN 13 Ca 0.00 -0.21 -0.01 0.00 1.21 0.00 0.00 56.30 57.29 2kq8 h ASN 13 Cb 0.75 0.08 -0.02 0.00 -1.12 0.00 0.00 38.32 38.01 2kq8 h ASN 13 CO 0.00 0.10 -0.29 0.52 -1.29 0.00 0.00 177.43 176.46 2kq8 n VAL 14 N -5.08 1.06 -0.31 2.81 0.31 -1.26 -4.17 118.33 111.68 2kq8 n VAL 14 Ca -0.09 -1.37 0.09 0.00 -0.01 0.00 0.00 64.34 62.96 2kq8 n VAL 14 Cb 0.26 0.13 0.31 0.00 -0.91 0.00 0.00 33.84 33.62 2kq8 n VAL 14 CO 0.00 0.00 0.00 0.03 -1.32 0.00 0.00 176.83 175.54 2kq8 h ARG 15 N 0.13 0.83 -2.01 5.55 2.47 -1.71 -3.37 114.38 116.27 2kq8 h ARG 15 Ca -0.01 -0.05 -0.31 0.00 -1.26 0.00 0.00 59.98 58.35 2kq8 h ARG 15 Cb 1.21 -0.19 -0.03 0.00 -1.65 0.00 0.00 29.97 29.31 2kq8 h ARG 15 CO 0.01 0.55 -0.38 0.43 0.56 0.00 0.00 179.97 181.13 2kq8 n SER 16 N -4.58 -4.69 -4.73 7.04 7.64 -1.23 -3.05 113.62 110.01 2kq8 n SER 16 Ca 0.18 0.04 -0.41 0.00 1.01 0.00 0.00 58.87 59.68 2kq8 n SER 16 Cb 0.39 -3.79 -0.03 0.00 -1.01 0.00 0.00 64.21 59.78 2kq8 n SER 16 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2kq8 s GLY 17 N -2.37 2.36 0.31 0.23 0.00 -0.25 -3.56 107.32 104.03 2kq8 s GLY 17 Ca 0.00 1.14 0.09 0.00 0.00 0.00 0.00 44.72 45.95 2kq8 s GLY 17 CO 0.00 2.15 1.72 0.83 0.00 0.00 0.00 173.10 177.80 2kq8 h GLU 18 N 5.55 0.13 0.00 2.90 5.08 -1.82 0.56 114.58 126.99 2kq8 h GLU 18 Ca -0.44 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 57.85 2kq8 h GLU 18 Cb 1.21 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.46 2kq8 h GLU 18 CO 0.79 0.55 0.00 0.41 -1.00 0.00 0.00 179.01 179.76 2kq8 n GLY 19 N -0.18 2.34 0.49 -3.84 0.00 -1.26 -4.77 105.19 97.97 2kq8 n GLY 19 Ca -0.02 -0.24 0.11 0.00 0.00 0.00 0.00 46.02 45.88 2kq8 n GLY 19 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2kq8 n THR 20 N 0.00 0.00 -2.45 2.61 -2.24 -1.26 -4.80 114.28 106.14 2kq8 n THR 20 Ca 0.00 -0.26 -0.38 0.00 -2.27 0.00 0.00 64.05 61.14 2kq8 n THR 20 Cb 0.00 1.23 -0.03 0.00 -2.10 0.00 0.00 70.33 69.44 2kq8 n THR 20 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2kq8 s ASN 21 N -2.48 6.27 0.00 3.42 4.22 -1.26 -3.60 114.94 121.51 2kq8 s ASN 21 Ca 0.19 -1.61 0.20 0.00 -2.14 0.00 0.00 52.86 49.50 2kq8 s ASN 21 Cb 0.18 -2.57 0.57 0.00 1.28 0.00 0.00 41.25 40.71 2kq8 s ASN 21 CO 0.57 -1.73 1.46 -1.22 -2.04 0.00 0.00 177.10 174.14 2kq8 n TYR 22 N 9.95 0.40 1.46 1.54 4.01 -1.26 -3.47 117.16 129.79 2kq8 n TYR 22 Ca 0.39 -0.20 0.14 0.00 -0.16 0.00 0.00 57.90 58.07 2kq8 n TYR 22 Cb 0.49 0.00 0.50 0.00 -0.31 0.00 0.00 39.34 40.02 2kq8 n TYR 22 CO 0.00 0.00 0.00 -2.13 -0.46 0.00 0.00 176.86 174.27 2kq8 n ARG 23 N 0.86 1.59 -0.30 -0.72 0.63 -1.26 -3.97 116.66 113.49 2kq8 n ARG 23 Ca 0.17 -0.94 0.07 0.00 -0.92 0.00 0.00 57.85 56.24 2kq8 n ARG 23 Cb 0.44 -1.48 0.22 0.00 0.45 0.00 0.00 32.46 32.10 2kq8 n ARG 23 CO 0.00 0.00 0.00 0.97 -2.51 0.00 0.00 177.63 176.09 2kq8 h ILE 24 N 2.29 0.74 0.00 5.15 -0.00 -1.79 -3.42 117.51 120.48 2kq8 h ILE 24 Ca 0.00 -0.22 0.00 0.00 -0.00 0.00 0.00 64.86 64.64 2kq8 h ILE 24 Cb 0.51 0.04 0.00 0.00 -0.00 0.00 0.00 36.82 37.37 2kq8 h ILE 24 CO 0.00 0.12 0.00 -0.38 -0.00 0.00 0.00 178.15 177.89 2kq8 n ILE 25 N -4.85 0.00 0.00 2.19 5.41 -1.17 -5.08 119.36 115.85 2kq8 n ILE 25 Ca 0.17 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.92 2kq8 n ILE 25 Cb 0.43 -0.19 0.00 0.00 -0.71 0.00 0.00 39.64 39.17 2kq8 n ILE 25 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2kq8 n GLY 26 N 2.12 3.24 3.40 7.39 0.00 -1.17 -5.01 105.19 115.16 2kq8 n GLY 26 Ca 0.00 -1.72 -0.45 0.00 0.00 0.00 0.00 46.02 43.85 2kq8 n GLY 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kq8 s ALA 27 N -2.00 3.48 -0.58 4.61 0.00 -1.26 -3.21 121.76 122.80 2kq8 s ALA 27 Ca 0.00 -2.58 0.04 0.00 0.00 0.00 0.00 51.96 49.42 2kq8 s ALA 27 Cb 0.00 -3.76 0.15 0.00 0.00 0.00 0.00 23.12 19.51 2kq8 s ALA 27 CO 0.00 -2.63 0.36 -1.17 0.00 0.00 0.00 175.76 172.33 2kq8 s LEU 28 N 2.40 4.14 -0.87 0.00 2.96 -1.26 -4.84 118.68 121.21 2kq8 s LEU 28 Ca 0.22 -3.33 -0.22 0.00 -0.22 0.00 0.00 54.13 50.58 2kq8 s LEU 28 Cb -0.13 -1.49 0.08 0.00 0.50 0.00 0.00 46.19 45.15 2kq8 s LEU 28 CO -0.02 -0.17 1.21 -2.16 -1.32 0.00 0.00 176.35 173.90 2kq8 s PRO 29 N -0.69 3.42 0.51 0.98 0.05 -1.26 -5.00 135.00 133.01 2kq8 s PRO 29 Ca 0.21 -1.12 -0.06 0.00 0.05 0.00 0.00 61.00 60.08 2kq8 s PRO 29 Cb -0.15 -4.78 -0.04 0.00 0.05 0.00 0.00 34.50 29.58 2kq8 s PRO 29 CO -0.08 -1.98 0.84 -0.65 0.05 0.00 0.00 177.00 175.18 2kq8 s GLN 30 N 4.18 3.55 0.41 4.56 1.11 -1.26 -4.99 119.66 127.22 2kq8 s GLN 30 Ca 0.35 0.31 0.09 0.00 0.01 0.00 0.00 55.36 56.11 2kq8 s GLN 30 Cb -0.07 -2.31 0.87 0.00 -1.01 0.00 0.00 33.01 30.49 2kq8 s GLN 30 CO -0.01 -0.29 2.01 0.78 0.01 0.00 0.00 175.29 177.79 2kq8 h GLY 31 N 0.11 0.41 0.00 3.09 0.00 -1.89 -3.23 103.07 101.56 2kq8 h GLY 31 Ca -0.46 -0.19 0.00 0.00 0.00 0.00 0.00 47.33 46.68 2kq8 h GLY 31 CO 0.62 0.18 0.00 -1.06 0.00 0.00 0.00 176.54 176.28 2kq8 n GLN 32 N -4.41 0.00 -0.69 4.80 3.00 -1.26 -4.68 117.38 114.14 2kq8 n GLN 32 Ca 0.01 0.19 0.00 0.00 -0.01 0.00 0.00 57.00 57.19 2kq8 n GLN 32 Cb 0.14 -1.08 0.00 0.00 0.00 0.00 0.00 30.24 29.30 2kq8 n GLN 32 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.06 178.23 2kq8 n LYS 33 N -1.08 -1.92 0.23 -1.09 4.81 -1.22 -4.76 118.16 113.12 2kq8 n LYS 33 Ca 0.00 1.45 0.14 0.00 -0.87 0.00 0.00 58.31 59.02 2kq8 n LYS 33 Cb 0.00 -1.69 0.33 0.00 0.02 0.00 0.00 35.03 33.69 2kq8 n LYS 33 CO 0.00 0.00 0.00 -0.39 1.17 0.00 0.00 177.40 178.18 2kq8 h VAL 34 N 0.50 0.00 -1.55 3.15 -1.51 -1.92 -3.50 116.25 111.42 2kq8 h VAL 34 Ca 0.00 -0.82 0.18 0.00 -1.23 0.00 0.00 66.70 64.83 2kq8 h VAL 34 Cb 0.14 1.81 -0.06 0.00 -2.13 0.00 0.00 31.29 31.05 2kq8 h VAL 34 CO 0.00 0.00 -0.34 1.67 -1.23 0.00 0.00 177.57 177.67 2kq8 n GLN 35 N -3.03 -1.43 -4.03 5.19 7.27 -1.26 -4.90 117.38 115.20 2kq8 n GLN 35 Ca 0.03 1.01 -0.34 0.00 0.07 0.00 0.00 57.00 57.77 2kq8 n GLN 35 Cb 0.46 -1.72 -0.06 0.00 2.41 0.00 0.00 30.24 31.32 2kq8 n GLN 35 CO 0.00 0.00 0.00 0.54 0.07 0.00 0.00 177.06 177.67 2kq8 s VAL 36 N -2.13 5.03 -0.08 1.69 0.11 -1.26 -4.33 120.40 119.43 2kq8 s VAL 36 Ca 0.00 -0.19 -0.15 0.00 -2.93 0.00 0.00 61.98 58.71 2kq8 s VAL 36 Cb 0.00 -3.27 -0.11 0.00 -1.53 0.00 0.00 36.38 31.46 2kq8 s VAL 36 CO 0.00 0.43 0.52 0.40 -3.33 0.00 0.00 175.10 173.12 2kq8 h ILE 37 N 3.38 0.64 -1.78 7.04 2.04 -1.51 -3.49 117.51 123.83 2kq8 h ILE 37 Ca -0.50 -1.27 0.21 0.00 1.00 0.00 0.00 64.86 64.30 2kq8 h ILE 37 Cb 1.19 1.16 -0.16 0.00 -0.74 0.00 0.00 36.82 38.27 2kq8 h ILE 37 CO 0.62 0.20 0.69 -0.55 0.00 0.00 0.00 178.15 179.11 2kq8 s SER 38 N -5.58 -0.20 -0.04 1.72 0.15 -1.17 -5.03 113.70 103.55 2kq8 s SER 38 Ca -0.09 -0.04 0.06 0.00 0.70 0.00 0.00 55.95 56.58 2kq8 s SER 38 Cb -0.00 0.24 -0.02 0.00 -1.71 0.00 0.00 66.02 64.53 2kq8 s SER 38 CO 0.33 -0.40 -0.20 -1.83 1.20 0.00 0.00 173.24 172.33 2kq8 s GLU 39 N -2.70 2.32 -0.17 5.44 1.03 -1.26 0.16 118.70 123.51 2kq8 s GLU 39 Ca 0.09 -0.82 -0.33 0.00 0.03 0.00 0.00 54.97 53.95 2kq8 s GLU 39 Cb -0.00 -2.21 0.14 0.00 -0.80 0.00 0.00 34.13 31.26 2kq8 s GLU 39 CO -0.06 0.58 1.15 1.21 -1.33 0.00 0.00 175.26 176.82 2kq8 s ASN 40 N -0.65 -0.19 -1.57 0.83 3.84 0.24 -4.96 114.94 112.47 2kq8 s ASN 40 Ca 0.10 0.07 0.00 0.00 0.21 0.00 0.00 52.86 53.24 2kq8 s ASN 40 Cb -0.10 0.19 0.00 0.00 -0.55 0.00 0.00 41.25 40.78 2kq8 s ASN 40 CO -0.00 -0.27 0.00 -1.20 -2.79 0.00 0.00 177.10 172.84 2kq8 n SER 41 N 0.12 -4.94 0.00 -4.21 7.64 -1.26 -2.26 113.62 108.71 2kq8 n SER 41 Ca -0.03 0.37 0.00 0.00 1.01 0.00 0.00 58.87 60.22 2kq8 n SER 41 Cb 0.59 -3.75 0.00 0.00 -1.01 0.00 0.00 64.21 60.04 2kq8 n SER 41 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2kq8 n GLY 42 N -0.95 2.72 3.40 0.23 0.00 -1.26 -5.05 105.19 104.28 2kq8 n GLY 42 Ca -0.15 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.67 2kq8 n GLY 42 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2kq8 s TRP 43 N -2.54 1.88 -0.25 1.61 0.51 -0.96 -4.21 118.94 114.98 2kq8 s TRP 43 Ca 0.00 -0.61 -0.10 0.00 -2.12 0.00 0.00 56.10 53.27 2kq8 s TRP 43 Cb 0.00 -0.97 -0.05 0.00 -0.81 0.00 0.00 33.47 31.64 2kq8 s TRP 43 CO 0.00 0.36 0.15 -1.12 -0.51 0.00 0.00 176.95 175.83 2kq8 s SER 44 N -3.40 5.90 -0.15 2.95 0.01 0.36 -0.59 113.70 118.78 2kq8 s SER 44 Ca 0.27 0.01 -0.27 0.00 1.31 0.00 0.00 55.95 57.27 2kq8 s SER 44 Cb 0.01 -2.07 -0.01 0.00 0.21 0.00 0.00 66.02 64.15 2kq8 s SER 44 CO 0.10 0.01 0.91 -0.75 0.41 0.00 0.00 173.24 173.92 2kq8 s LYS 45 N 1.38 4.34 0.08 12.44 2.20 0.12 -2.10 119.74 138.21 2kq8 s LYS 45 Ca 0.07 1.17 0.07 0.00 -0.36 0.00 0.00 55.97 56.93 2kq8 s LYS 45 Cb -0.15 -3.56 -0.03 0.00 -1.51 0.00 0.00 37.83 32.58 2kq8 s LYS 45 CO 0.07 -0.34 -0.19 0.96 -0.36 0.00 0.00 175.35 175.49 2kq8 s ILE 46 N 2.14 1.57 -0.30 5.43 -4.36 0.28 -1.19 121.20 124.77 2kq8 s ILE 46 Ca 0.42 -1.39 -0.06 0.00 -0.26 0.00 0.00 60.65 59.36 2kq8 s ILE 46 Cb -0.17 -1.42 0.02 0.00 1.25 0.00 0.00 42.46 42.14 2kq8 s ILE 46 CO 0.14 -0.02 0.07 0.21 0.24 0.00 0.00 174.94 175.58 2kq8 s ASN 47 N -1.66 5.09 -0.88 4.36 3.84 -1.26 -0.10 114.94 124.32 2kq8 s ASN 47 Ca 0.05 -0.86 -0.09 0.00 0.21 0.00 0.00 52.86 52.18 2kq8 s ASN 47 Cb -0.10 -1.85 0.23 0.00 -0.55 0.00 0.00 41.25 38.98 2kq8 s ASN 47 CO 0.03 -0.22 0.81 -0.47 -2.79 0.00 0.00 177.10 174.46 2kq8 s TYR 48 N 1.45 3.87 -1.15 0.43 5.04 0.93 -4.63 117.35 123.29 2kq8 s TYR 48 Ca 0.01 -2.50 -0.00 0.00 -2.44 0.00 0.00 57.07 52.14 2kq8 s TYR 48 Cb -0.18 -3.62 -0.00 0.00 0.35 0.00 0.00 41.96 38.52 2kq8 s TYR 48 CO 0.02 -0.91 0.96 -1.71 -1.34 0.00 0.00 175.55 172.56 2kq8 n ASN 49 N 3.24 -2.05 0.00 4.32 5.15 -1.26 -2.89 115.26 121.77 2kq8 n ASN 49 Ca 0.17 -0.59 0.00 0.00 -0.60 0.00 0.00 54.58 53.56 2kq8 n ASN 49 Cb 0.41 -4.93 0.00 0.00 -0.53 0.00 0.00 39.78 34.74 2kq8 n ASN 49 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2kq8 n GLY 50 N -1.12 2.75 3.82 8.20 0.00 -1.26 -5.04 105.19 112.53 2kq8 n GLY 50 Ca -0.28 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.42 2kq8 n GLY 50 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2kq8 s GLN 51 N -0.78 3.12 -0.14 1.61 -2.07 -1.14 -5.09 119.66 115.17 2kq8 s GLN 51 Ca 0.00 -0.51 -0.16 0.00 -1.82 0.00 0.00 55.36 52.87 2kq8 s GLN 51 Cb 0.00 -2.88 -0.04 0.00 -1.09 0.00 0.00 33.01 28.99 2kq8 s GLN 51 CO 0.00 0.62 0.40 0.99 -1.32 0.00 0.00 175.29 175.99 2kq8 s THR 52 N -1.31 5.23 0.27 3.63 2.01 -1.26 -0.05 115.64 124.17 2kq8 s THR 52 Ca 0.27 0.78 0.02 0.00 0.31 0.00 0.00 61.69 63.07 2kq8 s THR 52 Cb -0.12 -3.74 -0.05 0.00 0.01 0.00 0.00 72.50 68.60 2kq8 s THR 52 CO 0.19 0.34 0.10 -0.83 -0.69 0.00 0.00 174.62 173.73 2kq8 s GLY 53 N 0.62 1.81 0.08 4.40 0.00 0.86 -4.77 107.32 110.32 2kq8 s GLY 53 Ca 0.22 -1.85 0.04 0.00 0.00 0.00 0.00 44.72 43.13 2kq8 s GLY 53 CO 0.08 -1.61 -0.12 -0.19 0.00 0.00 0.00 173.10 171.25 2kq8 s TYR 54 N -3.70 1.12 0.03 1.90 2.02 0.19 -0.56 117.35 118.34 2kq8 s TYR 54 Ca 0.37 -0.51 -0.06 0.00 -0.37 0.00 0.00 57.07 56.51 2kq8 s TYR 54 Cb 0.07 -0.63 -0.01 0.00 -0.40 0.00 0.00 41.96 41.00 2kq8 s TYR 54 CO 0.14 0.03 0.10 0.96 -1.57 0.00 0.00 175.55 175.21 2kq8 s ILE 55 N -1.58 0.12 0.02 2.71 -5.25 -0.89 -1.09 121.20 115.24 2kq8 s ILE 55 Ca -0.01 -0.96 -0.30 0.00 -0.99 0.00 0.00 60.65 58.39 2kq8 s ILE 55 Cb -0.08 -0.71 -0.05 0.00 2.95 0.00 0.00 42.46 44.57 2kq8 s ILE 55 CO 0.02 -0.53 1.20 -0.83 -1.79 0.00 0.00 174.94 173.01 2kq8 s GLY 56 N -1.85 2.32 0.00 6.27 0.00 -1.26 -0.49 107.32 112.30 2kq8 s GLY 56 Ca -0.09 0.77 0.06 0.00 0.00 0.00 0.00 44.72 45.47 2kq8 s GLY 56 CO -0.02 2.10 1.01 2.41 0.00 0.00 0.00 173.10 178.60 2kq8 n THR 57 N 4.16 0.71 0.03 0.90 -1.04 -1.26 -1.55 114.28 116.23 2kq8 n THR 57 Ca 0.10 0.18 -0.04 0.00 -2.04 0.00 0.00 64.05 62.24 2kq8 n THR 57 Cb 0.46 -1.07 0.17 0.00 -1.82 0.00 0.00 70.33 68.07 2kq8 n THR 57 CO 0.00 0.00 0.00 0.03 -0.64 0.00 0.00 175.07 174.46 2kq8 h ARG 58 N 0.00 0.43 -4.17 -2.82 3.08 -1.91 -3.41 114.38 105.58 2kq8 h ARG 58 Ca 0.00 -0.20 -0.52 0.00 0.07 0.00 0.00 59.98 59.33 2kq8 h ARG 58 Cb 0.05 -0.01 -0.37 0.00 0.08 0.00 0.00 29.97 29.72 2kq8 h ARG 58 CO 0.00 0.74 -0.80 0.71 -1.07 0.00 0.00 179.97 179.55 2kq8 s TYR 59 N -4.29 1.43 -0.22 3.04 1.51 -0.60 -5.11 117.35 113.11 2kq8 s TYR 59 Ca -0.06 -0.73 -0.12 0.00 -1.01 0.00 0.00 57.07 55.15 2kq8 s TYR 59 Cb 0.13 -1.20 0.07 0.00 -0.11 0.00 0.00 41.96 40.85 2kq8 s TYR 59 CO 0.80 -0.51 0.54 -1.17 -1.11 0.00 0.00 175.55 174.10 2kq8 s LEU 60 N 1.73 -0.51 -0.24 -1.29 0.20 -1.26 -4.19 118.68 113.12 2kq8 s LEU 60 Ca 0.05 1.19 -0.22 0.00 0.69 0.00 0.00 54.13 55.83 2kq8 s LEU 60 Cb -0.13 1.84 -0.01 0.00 -0.43 0.00 0.00 46.19 47.46 2kq8 s LEU 60 CO -0.08 -0.22 0.72 -0.55 -0.29 0.00 0.00 176.35 175.93 2kq8 s SER 61 N 1.54 6.71 0.36 3.68 0.15 -1.26 -5.05 113.70 119.83 2kq8 s SER 61 Ca -0.10 0.88 0.00 0.00 0.70 0.00 0.00 55.95 57.43 2kq8 s SER 61 Cb -0.07 -2.38 0.00 0.00 -1.71 0.00 0.00 66.02 61.86 2kq8 s SER 61 CO -0.16 -0.41 0.00 1.17 1.20 0.00 0.00 173.24 175.03 2kq8 n LYS 62 N 5.71 0.49 0.13 5.44 4.81 -1.26 -4.93 118.16 128.54 2kq8 n LYS 62 Ca 0.02 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.46 2kq8 n LYS 62 Cb 0.48 0.00 0.30 0.00 0.02 0.00 0.00 35.03 35.84 2kq8 n LYS 62 CO 0.00 0.00 0.00 1.37 1.17 0.00 0.00 177.40 179.94 2kq8 h LEU 63 N 0.00 0.16 -3.37 3.14 8.10 -1.94 -3.48 115.31 117.92 2kq8 h LEU 63 Ca 0.00 -0.05 -0.40 0.00 0.11 0.00 0.00 57.88 57.54 2kq8 h LEU 63 Cb 0.00 -0.04 0.02 0.00 -0.44 0.00 0.00 40.66 40.20 2kq8 h LEU 63 CO 0.00 0.49 -0.84 -0.62 -4.11 0.00 0.00 178.44 173.36 2kq8 n GLU 64 N -4.10 -1.21 -2.86 0.17 -0.58 -1.26 -4.16 120.64 106.64 2kq8 n GLU 64 Ca -0.01 0.70 -0.01 0.00 -0.42 0.00 0.00 57.16 57.41 2kq8 n GLU 64 Cb 0.41 -3.49 -0.01 0.00 -0.57 0.00 0.00 31.44 27.78 2kq8 n GLU 64 CO 0.00 0.00 0.00 1.58 -0.48 0.00 0.00 177.13 178.23 2kq8 n HIS 65 N -3.31 -2.67 -4.37 -0.32 -0.00 -1.26 -4.87 115.22 98.43 2kq8 n HIS 65 Ca -0.16 1.27 -0.25 0.00 -0.00 0.00 0.00 57.72 58.58 2kq8 n HIS 65 Cb 0.61 -2.94 -0.09 0.00 -0.00 0.00 0.00 29.99 27.57 2kq8 n HIS 65 CO 0.00 0.00 0.00 -3.38 -0.00 0.00 0.00 176.34 172.96 2kq8 s HIS 66 N -1.21 2.53 0.15 1.57 -3.43 -1.26 -4.90 115.29 108.74 2kq8 s HIS 66 Ca -0.04 -0.44 -0.30 0.00 -0.80 0.00 0.00 55.06 53.48 2kq8 s HIS 66 Cb 0.00 -1.47 -0.07 0.00 -1.43 0.00 0.00 32.58 29.62 2kq8 s HIS 66 CO 0.51 0.50 1.02 -1.58 -2.00 0.00 0.00 174.74 173.19 2kq8 s HIS 67 N -2.53 3.73 -0.48 0.38 2.46 -1.26 -5.01 115.29 112.58 2kq8 s HIS 67 Ca 0.34 1.72 -0.17 0.00 0.47 0.00 0.00 55.06 57.42 2kq8 s HIS 67 Cb 0.00 -3.15 0.06 0.00 -0.13 0.00 0.00 32.58 29.36 2kq8 s HIS 67 CO 0.19 -0.14 0.49 -1.58 -2.47 0.00 0.00 174.74 171.23 2kq8 s HIS 68 N -0.20 3.15 -0.38 3.88 2.46 -1.26 -5.03 115.29 117.91 2kq8 s HIS 68 Ca 0.48 -0.66 -0.24 0.00 0.47 0.00 0.00 55.06 55.10 2kq8 s HIS 68 Cb -0.26 -3.25 0.01 0.00 -0.13 0.00 0.00 32.58 28.95 2kq8 s HIS 68 CO 0.32 -0.87 0.85 -1.58 -2.47 0.00 0.00 174.74 170.99 2kq8 s HIS 69 N 2.14 3.08 0.00 3.88 2.46 -1.26 -5.35 115.29 120.24 2kq8 s HIS 69 Ca 0.10 0.62 0.00 0.00 0.47 0.00 0.00 55.06 56.25 2kq8 s HIS 69 Cb -0.21 -3.55 0.00 0.00 -0.13 0.00 0.00 32.58 28.69 2kq8 s HIS 69 CO 0.10 -0.81 0.41 1.58 -2.47 0.00 0.00 174.74 173.55