#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kq8 s ILE 2 N 0.00 2.55 0.00 2.02 -4.36 -1.26 -2.69 121.20 117.46 2kq8 s ILE 2 Ca 0.00 0.54 0.00 0.00 -0.26 0.00 0.00 60.65 60.93 2kq8 s ILE 2 Cb 0.00 -3.34 0.00 0.00 1.25 0.00 0.00 42.46 40.37 2kq8 s ILE 2 CO 0.00 0.12 0.00 0.61 0.24 0.00 0.00 174.94 175.91 2kq8 n GLY 3 N 0.88 3.23 1.03 6.27 0.00 -1.26 -4.98 105.19 110.36 2kq8 n GLY 3 Ca 0.01 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.17 2kq8 n GLY 3 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2kq8 n ASP 4 N 0.00 -6.11 -0.11 1.61 8.00 -1.10 -4.74 116.55 114.11 2kq8 n ASP 4 Ca 0.00 0.50 -0.12 0.00 0.71 0.00 0.00 54.79 55.88 2kq8 n ASP 4 Cb 0.00 -3.16 -0.15 0.00 -0.02 0.00 0.00 41.12 37.79 2kq8 n ASP 4 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2kq8 n TYR 5 N -3.45 0.04 -3.69 1.24 4.02 -1.26 -4.83 117.16 109.23 2kq8 n TYR 5 Ca -0.00 0.01 -0.38 0.00 -0.01 0.00 0.00 57.90 57.51 2kq8 n TYR 5 Cb 0.47 -1.01 -0.11 0.00 -0.02 0.00 0.00 39.34 38.68 2kq8 n TYR 5 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 176.86 176.56 2kq8 s TYR 6 N -2.50 3.43 0.01 -0.72 1.51 -1.26 -5.05 117.35 112.76 2kq8 s TYR 6 Ca -0.17 -1.92 0.00 0.00 -1.01 0.00 0.00 57.07 53.98 2kq8 s TYR 6 Cb 0.07 -3.04 -0.00 0.00 -0.11 0.00 0.00 41.96 38.88 2kq8 s TYR 6 CO 0.77 -0.91 0.00 0.44 -1.11 0.00 0.00 175.55 174.74 2kq8 n ILE 7 N 4.78 0.00 -3.44 2.71 -0.00 -1.26 -4.79 119.36 117.36 2kq8 n ILE 7 Ca -0.07 -0.03 -0.17 0.00 -0.00 0.00 0.00 62.75 62.47 2kq8 n ILE 7 Cb 0.42 0.01 0.09 0.00 -0.00 0.00 0.00 39.64 40.16 2kq8 n ILE 7 CO 0.00 0.00 0.00 -3.20 -0.00 0.00 0.00 176.55 173.35 2kq8 n ASN 8 N -1.06 -2.37 0.00 7.28 2.85 -1.26 -4.70 115.26 116.00 2kq8 n ASN 8 Ca -0.00 -0.61 0.00 0.00 -0.11 0.00 0.00 54.58 53.86 2kq8 n ASN 8 Cb 0.01 -5.10 0.00 0.00 1.24 0.00 0.00 39.78 35.92 2kq8 n ASN 8 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2kq8 n ALA 9 N -4.19 0.00 -3.53 5.20 0.00 -1.00 -4.38 120.51 112.60 2kq8 n ALA 9 Ca -0.27 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 52.83 2kq8 n ALA 9 Cb 0.66 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.97 2kq8 n ALA 9 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2kq8 s SER 10 N -0.89 3.97 0.30 0.00 0.15 -1.26 -4.71 113.70 111.26 2kq8 s SER 10 Ca 0.00 -0.43 0.00 0.00 0.70 0.00 0.00 55.95 56.22 2kq8 s SER 10 Cb 0.00 -1.65 0.00 0.00 -1.71 0.00 0.00 66.02 62.66 2kq8 s SER 10 CO 0.00 0.03 0.00 0.00 1.20 0.00 0.00 173.24 174.47 2kq8 n ALA 11 N 4.45 -1.43 -1.67 5.45 0.00 -1.26 -4.80 120.51 121.25 2kq8 n ALA 11 Ca -0.19 0.25 -0.20 0.00 0.00 0.00 0.00 53.44 53.31 2kq8 n ALA 11 Cb 0.51 -1.01 -0.08 0.00 0.00 0.00 0.00 19.45 18.88 2kq8 n ALA 11 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2kq8 n LEU 12 N -1.69 -1.51 -0.26 0.00 4.77 -1.26 -4.83 117.00 112.22 2kq8 n LEU 12 Ca 0.00 0.43 0.04 0.00 -0.03 0.00 0.00 56.01 56.45 2kq8 n LEU 12 Cb 0.17 -2.76 0.17 0.00 -2.33 0.00 0.00 43.42 38.66 2kq8 n LEU 12 CO 0.00 -0.94 1.07 0.78 -1.33 0.00 0.00 177.39 176.97 2kq8 h ASN 13 N 0.00 0.46 -1.06 -1.43 4.21 -1.83 -2.94 115.58 112.99 2kq8 h ASN 13 Ca -0.42 0.08 -0.42 0.00 1.21 0.00 0.00 56.30 56.75 2kq8 h ASN 13 Cb 1.30 0.00 -0.41 0.00 -1.12 0.00 0.00 38.32 38.10 2kq8 h ASN 13 CO 0.59 0.23 -1.05 1.33 -1.29 0.00 0.00 177.43 177.25 2kq8 n VAL 14 N -4.88 1.45 0.98 2.81 0.24 -1.26 -3.94 118.33 113.73 2kq8 n VAL 14 Ca 0.13 -3.58 -0.00 0.00 -2.04 0.00 0.00 64.34 58.85 2kq8 n VAL 14 Cb 0.34 0.15 0.00 0.00 -1.47 0.00 0.00 33.84 32.86 2kq8 n VAL 14 CO 0.00 0.00 0.00 -1.14 -2.14 0.00 0.00 176.83 173.55 2kq8 n ARG 15 N -0.26 1.02 -2.76 7.34 3.00 -1.11 -1.66 116.66 122.22 2kq8 n ARG 15 Ca 0.18 -0.03 -0.20 0.00 -0.00 0.00 0.00 57.85 57.80 2kq8 n ARG 15 Cb 0.78 -1.14 0.01 0.00 0.00 0.00 0.00 32.46 32.11 2kq8 n ARG 15 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 2kq8 n SER 16 N 0.36 -5.32 0.00 6.15 2.88 -1.25 -2.89 113.62 113.55 2kq8 n SER 16 Ca 0.00 -0.12 0.00 0.00 -1.33 0.00 0.00 58.87 57.42 2kq8 n SER 16 Cb 0.45 -4.38 0.00 0.00 -0.75 0.00 0.00 64.21 59.52 2kq8 n SER 16 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2kq8 n GLY 17 N -1.18 0.53 0.52 0.46 0.00 -1.25 -4.17 105.19 100.09 2kq8 n GLY 17 Ca -0.15 -1.31 0.04 0.00 0.00 0.00 0.00 46.02 44.60 2kq8 n GLY 17 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2kq8 n GLU 18 N 0.00 1.66 -0.66 1.61 -0.58 -1.26 -4.20 120.64 117.21 2kq8 n GLU 18 Ca 0.00 -0.87 0.00 0.00 -0.42 0.00 0.00 57.16 55.87 2kq8 n GLU 18 Cb 0.00 -1.28 0.00 0.00 -0.57 0.00 0.00 31.44 29.59 2kq8 n GLU 18 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2kq8 n GLY 19 N 0.76 0.62 0.23 0.62 0.00 -1.14 -4.99 105.19 101.29 2kq8 n GLY 19 Ca 0.08 -0.47 -0.15 0.00 0.00 0.00 0.00 46.02 45.48 2kq8 n GLY 19 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2kq8 h THR 20 N 0.00 0.63 -3.18 2.61 2.02 -1.75 -3.36 112.91 109.88 2kq8 h THR 20 Ca 0.00 -0.23 -0.75 0.00 0.77 0.00 0.00 66.41 66.21 2kq8 h THR 20 Cb 0.00 0.75 -0.26 0.00 -1.74 0.00 0.00 68.15 66.90 2kq8 h THR 20 CO 0.00 0.04 -0.29 0.21 0.37 0.00 0.00 175.52 175.86 2kq8 s ASN 21 N -4.84 6.01 0.00 4.18 3.84 -1.26 -4.90 114.94 117.97 2kq8 s ASN 21 Ca -0.15 -1.79 0.21 0.00 0.21 0.00 0.00 52.86 51.33 2kq8 s ASN 21 Cb 0.04 -2.14 0.59 0.00 -0.55 0.00 0.00 41.25 39.19 2kq8 s ASN 21 CO 0.60 -0.78 1.47 0.00 -2.79 0.00 0.00 177.10 175.60 2kq8 n TYR 22 N 5.13 0.36 -0.12 0.43 4.11 -1.26 -4.18 117.16 121.63 2kq8 n TYR 22 Ca -0.12 -0.18 -0.16 0.00 -0.00 0.00 0.00 57.90 57.44 2kq8 n TYR 22 Cb 0.41 0.00 -0.12 0.00 -0.00 0.00 0.00 39.34 39.63 2kq8 n TYR 22 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.86 177.40 2kq8 n ARG 23 N 0.79 0.66 -0.07 -3.48 1.74 -1.26 -4.79 116.66 110.25 2kq8 n ARG 23 Ca 0.17 0.12 -0.08 0.00 -0.77 0.00 0.00 57.85 57.29 2kq8 n ARG 23 Cb 0.43 -1.49 -0.06 0.00 -1.02 0.00 0.00 32.46 30.32 2kq8 n ARG 23 CO 0.00 0.00 0.00 0.97 -1.52 0.00 0.00 177.63 177.08 2kq8 h ILE 24 N 0.00 0.72 -3.98 0.55 2.10 -2.00 -3.47 117.51 111.43 2kq8 h ILE 24 Ca -0.55 -1.61 -0.52 0.00 1.08 0.00 0.00 64.86 63.27 2kq8 h ILE 24 Cb 1.91 1.43 -0.23 0.00 -1.09 0.00 0.00 36.82 38.84 2kq8 h ILE 24 CO -0.07 0.24 -0.81 -0.63 -1.08 0.00 0.00 178.15 175.80 2kq8 s ILE 25 N -1.99 1.51 0.09 2.19 1.01 -1.26 -5.10 121.20 117.65 2kq8 s ILE 25 Ca -0.12 -1.38 -0.13 0.00 0.00 0.00 0.00 60.65 59.02 2kq8 s ILE 25 Cb 0.00 -1.37 0.02 0.00 0.01 0.00 0.00 42.46 41.12 2kq8 s ILE 25 CO 0.34 -0.05 0.30 -0.83 0.00 0.00 0.00 174.94 174.70 2kq8 s GLY 26 N -1.68 -0.10 -0.78 6.18 0.00 -0.67 -3.92 107.32 106.37 2kq8 s GLY 26 Ca 0.04 -0.27 -0.26 0.00 0.00 0.00 0.00 44.72 44.24 2kq8 s GLY 26 CO 0.03 -0.49 1.55 0.00 0.00 0.00 0.00 173.10 174.19 2kq8 s ALA 27 N -3.58 2.45 -0.44 3.20 0.00 -1.25 -4.51 121.76 117.63 2kq8 s ALA 27 Ca 0.02 -1.35 0.07 0.00 0.00 0.00 0.00 51.96 50.69 2kq8 s ALA 27 Cb 0.03 -4.36 0.23 0.00 0.00 0.00 0.00 23.12 19.02 2kq8 s ALA 27 CO -0.10 -3.70 0.67 -0.11 0.00 0.00 0.00 175.76 172.52 2kq8 n LEU 28 N 10.76 -1.48 -4.56 0.00 7.94 -1.26 -4.89 117.00 123.52 2kq8 n LEU 28 Ca 0.18 -3.94 -0.31 0.00 -1.11 0.00 0.00 56.01 50.83 2kq8 n LEU 28 Cb 0.50 0.72 -0.04 0.00 0.53 0.00 0.00 43.42 45.13 2kq8 n LEU 28 CO 0.69 2.01 1.38 -2.84 -1.11 0.00 0.00 177.39 177.52 2kq8 s PRO 29 N -0.10 2.83 -1.08 1.96 0.02 -1.26 -4.85 135.00 132.52 2kq8 s PRO 29 Ca 0.33 -0.47 -0.02 0.00 0.02 0.00 0.00 61.00 60.86 2kq8 s PRO 29 Cb 0.16 -5.10 0.27 0.00 0.02 0.00 0.00 34.50 29.84 2kq8 s PRO 29 CO -0.17 -3.04 2.01 0.00 -0.33 0.00 0.00 177.00 175.47 2kq8 n GLN 30 N 8.88 4.99 0.00 5.54 10.64 -1.26 -4.86 117.38 141.31 2kq8 n GLN 30 Ca 0.37 -4.23 0.00 0.00 -1.83 0.00 0.00 57.00 51.31 2kq8 n GLN 30 Cb 0.48 -2.49 0.00 0.00 -0.86 0.00 0.00 30.24 27.37 2kq8 n GLN 30 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2kq8 n GLY 31 N 0.37 2.33 3.75 2.61 0.00 -1.26 -4.85 105.19 108.14 2kq8 n GLY 31 Ca 0.51 0.03 -0.41 0.00 0.00 0.00 0.00 46.02 46.15 2kq8 n GLY 31 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2kq8 s GLN 32 N 0.00 4.54 0.00 1.61 -0.21 -1.26 -4.96 119.66 119.38 2kq8 s GLN 32 Ca 0.00 1.86 0.00 0.00 0.02 0.00 0.00 55.36 57.24 2kq8 s GLN 32 Cb 0.00 -3.22 0.00 0.00 1.00 0.00 0.00 33.01 30.79 2kq8 s GLN 32 CO 0.00 0.02 0.00 1.63 -2.12 0.00 0.00 175.29 174.82 2kq8 n LYS 33 N 1.96 0.00 0.00 2.91 5.02 -1.26 -4.78 118.16 122.01 2kq8 n LYS 33 Ca 0.02 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.31 2kq8 n LYS 33 Cb 0.45 -0.04 0.00 0.00 -0.02 0.00 0.00 35.03 35.42 2kq8 n LYS 33 CO 0.00 0.00 0.00 1.55 -0.52 0.00 0.00 177.40 178.43 2kq8 n VAL 34 N -1.67 0.00 -0.81 -0.18 3.14 -1.26 -5.02 118.33 112.54 2kq8 n VAL 34 Ca 0.00 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.38 2kq8 n VAL 34 Cb 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 32.78 2kq8 n VAL 34 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2kq8 n GLN 35 N 0.00 -2.06 -2.72 1.45 3.00 -1.26 -4.83 117.38 110.97 2kq8 n GLN 35 Ca 0.00 1.55 -0.43 0.00 -0.01 0.00 0.00 57.00 58.11 2kq8 n GLN 35 Cb 0.00 -1.62 -0.03 0.00 0.00 0.00 0.00 30.24 28.59 2kq8 n GLN 35 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.06 177.14 2kq8 s VAL 36 N -1.13 4.28 -0.08 5.09 1.01 -1.26 -4.81 120.40 123.51 2kq8 s VAL 36 Ca 0.00 0.80 -0.27 0.00 0.00 0.00 0.00 61.98 62.51 2kq8 s VAL 36 Cb 0.00 -4.57 -0.23 0.00 0.00 0.00 0.00 36.38 31.58 2kq8 s VAL 36 CO 0.00 -1.05 1.01 0.40 0.00 0.00 0.00 175.10 175.46 2kq8 h ILE 37 N 6.13 1.60 -2.74 2.22 2.04 -1.90 -3.48 117.51 121.38 2kq8 h ILE 37 Ca -0.24 -1.81 -0.09 0.00 1.00 0.00 0.00 64.86 63.71 2kq8 h ILE 37 Cb 1.07 2.81 -0.19 0.00 -0.74 0.00 0.00 36.82 39.76 2kq8 h ILE 37 CO 1.10 0.48 -0.11 -0.44 0.00 0.00 0.00 178.15 179.18 2kq8 s SER 38 N -6.04 -0.34 -0.16 1.72 0.01 -1.21 -5.06 113.70 102.63 2kq8 s SER 38 Ca -0.17 0.25 0.01 0.00 1.31 0.00 0.00 55.95 57.34 2kq8 s SER 38 Cb -0.00 0.40 0.00 0.00 0.21 0.00 0.00 66.02 66.63 2kq8 s SER 38 CO 0.69 -0.54 -0.17 -1.61 0.41 0.00 0.00 173.24 172.03 2kq8 s GLU 39 N -1.52 3.14 -0.08 12.44 8.01 -1.26 -0.82 118.70 138.61 2kq8 s GLU 39 Ca -0.11 -0.78 -0.08 0.00 0.01 0.00 0.00 54.97 54.01 2kq8 s GLU 39 Cb -0.03 -2.60 0.02 0.00 -4.31 0.00 0.00 34.13 27.22 2kq8 s GLU 39 CO 0.05 -0.05 0.23 1.21 0.01 0.00 0.00 175.26 176.70 2kq8 s ASN 40 N 0.96 -0.22 0.00 -0.19 3.84 -1.13 -4.95 114.94 113.24 2kq8 s ASN 40 Ca -0.03 0.42 0.00 0.00 0.21 0.00 0.00 52.86 53.46 2kq8 s ASN 40 Cb -0.15 0.45 0.00 0.00 -0.55 0.00 0.00 41.25 41.00 2kq8 s ASN 40 CO -0.03 -0.10 0.00 -0.24 -2.79 0.00 0.00 177.10 173.94 2kq8 n SER 41 N 2.84 0.00 0.01 -4.21 2.88 -1.26 -3.51 113.62 110.37 2kq8 n SER 41 Ca -0.13 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.41 2kq8 n SER 41 Cb 0.58 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.04 2kq8 n SER 41 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2kq8 n GLY 42 N 0.00 -0.40 3.91 0.46 0.00 -1.26 -5.14 105.19 102.76 2kq8 n GLY 42 Ca 0.00 0.12 -0.27 0.00 0.00 0.00 0.00 46.02 45.87 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 -2.00 3.55 0.05 1.61 0.51 -1.23 -3.91 118.94 117.53 2kq8 s TRP 43 Ca 0.00 0.78 -0.16 0.00 -2.12 0.00 0.00 56.10 54.60 2kq8 s TRP 43 Cb 0.00 -2.29 -0.06 0.00 -0.81 0.00 0.00 33.47 30.30 2kq8 s TRP 43 CO 0.00 -0.27 0.49 -1.12 -0.51 0.00 0.00 176.95 175.54 2kq8 s SER 44 N -4.11 6.91 -0.17 2.95 0.01 0.21 -2.86 113.70 116.64 2kq8 s SER 44 Ca 0.47 1.09 -0.06 0.00 1.31 0.00 0.00 55.95 58.76 2kq8 s SER 44 Cb -0.10 -2.30 -0.04 0.00 0.21 0.00 0.00 66.02 63.79 2kq8 s SER 44 CO 0.44 0.27 0.03 -0.75 0.41 0.00 0.00 173.24 173.65 2kq8 s LYS 45 N -1.23 3.88 0.22 12.44 2.36 0.00 -1.08 119.74 136.33 2kq8 s LYS 45 Ca 0.28 -0.40 -0.03 0.00 -2.55 0.00 0.00 55.97 53.27 2kq8 s LYS 45 Cb -0.18 -3.12 -0.03 0.00 -1.05 0.00 0.00 37.83 33.46 2kq8 s LYS 45 CO 0.17 0.26 0.23 0.96 1.55 0.00 0.00 175.35 178.52 2kq8 s ILE 46 N 0.37 0.00 -0.29 5.43 -0.00 -0.55 -3.29 121.20 122.87 2kq8 s ILE 46 Ca 0.01 -1.85 -0.06 0.00 -0.00 0.00 0.00 60.65 58.74 2kq8 s ILE 46 Cb -0.13 -2.44 0.01 0.00 -0.00 0.00 0.00 42.46 39.90 2kq8 s ILE 46 CO 0.01 0.00 0.07 0.21 -0.00 0.00 0.00 174.94 175.23 2kq8 s ASN 47 N -3.14 5.06 -0.39 4.36 3.84 -1.26 -0.46 114.94 122.94 2kq8 s ASN 47 Ca 0.35 -0.70 -0.03 0.00 0.21 0.00 0.00 52.86 52.70 2kq8 s ASN 47 Cb 0.05 -1.86 0.10 0.00 -0.55 0.00 0.00 41.25 38.98 2kq8 s ASN 47 CO 0.13 -0.18 0.18 -0.47 -2.79 0.00 0.00 177.10 173.96 2kq8 s TYR 48 N 1.49 3.56 -1.13 0.43 5.04 0.12 -4.64 117.35 122.22 2kq8 s TYR 48 Ca 0.03 -2.36 -0.06 0.00 -2.44 0.00 0.00 57.07 52.23 2kq8 s TYR 48 Cb -0.17 -3.08 0.01 0.00 0.35 0.00 0.00 41.96 39.06 2kq8 s TYR 48 CO 0.02 -0.95 0.98 -1.71 -1.34 0.00 0.00 175.55 172.55 2kq8 n ASN 49 N 4.59 -5.08 0.00 4.32 5.15 -1.26 -2.64 115.26 120.34 2kq8 n ASN 49 Ca -0.03 -0.47 0.00 0.00 -0.60 0.00 0.00 54.58 53.48 2kq8 n ASN 49 Cb 0.42 -4.37 0.00 0.00 -0.53 0.00 0.00 39.78 35.30 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 -1.67 2.91 3.58 8.20 0.00 -1.26 -5.03 105.19 111.93 2kq8 n GLY 50 Ca -0.04 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.67 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 -0.67 2.41 -0.06 1.61 -2.07 -1.08 -5.07 119.66 114.72 2kq8 s GLN 51 Ca 0.00 -0.82 -0.30 0.00 -1.82 0.00 0.00 55.36 52.42 2kq8 s GLN 51 Cb 0.00 -2.43 -0.04 0.00 -1.09 0.00 0.00 33.01 29.45 2kq8 s GLN 51 CO 0.00 0.57 1.35 0.99 -1.32 0.00 0.00 175.29 176.88 2kq8 s THR 52 N -1.05 3.97 0.32 3.63 2.01 -1.26 0.10 115.64 123.36 2kq8 s THR 52 Ca 0.18 1.28 0.05 0.00 0.31 0.00 0.00 61.69 63.51 2kq8 s THR 52 Cb -0.11 -3.82 -0.06 0.00 0.01 0.00 0.00 72.50 68.51 2kq8 s THR 52 CO 0.09 -0.04 0.02 -0.83 -0.69 0.00 0.00 174.62 173.17 2kq8 s GLY 53 N 1.99 2.06 0.03 4.40 0.00 0.39 -4.90 107.32 111.29 2kq8 s GLY 53 Ca 0.61 -2.05 0.05 0.00 0.00 0.00 0.00 44.72 43.33 2kq8 s GLY 53 CO 0.23 -1.86 -0.15 -0.19 0.00 0.00 0.00 173.10 171.13 2kq8 s TYR 54 N -3.15 1.29 0.06 1.90 1.51 -1.26 -1.48 117.35 116.21 2kq8 s TYR 54 Ca 0.34 -0.33 0.01 0.00 -1.01 0.00 0.00 57.07 56.08 2kq8 s TYR 54 Cb 0.08 -0.78 -0.03 0.00 -0.11 0.00 0.00 41.96 41.12 2kq8 s TYR 54 CO 0.15 0.03 -0.05 0.96 -1.11 0.00 0.00 175.55 175.53 2kq8 s ILE 55 N -0.73 0.41 0.06 2.71 -4.36 -0.24 -3.77 121.20 115.27 2kq8 s ILE 55 Ca 0.03 -1.55 -0.31 0.00 -0.26 0.00 0.00 60.65 58.57 2kq8 s ILE 55 Cb -0.07 -1.17 -0.06 0.00 1.25 0.00 0.00 42.46 42.41 2kq8 s ILE 55 CO 0.01 -0.75 1.28 -0.83 0.24 0.00 0.00 174.94 174.89 2kq8 s GLY 56 N -2.44 2.19 0.17 6.27 0.00 -1.26 0.66 107.32 112.92 2kq8 s GLY 56 Ca 0.01 0.92 0.25 0.00 0.00 0.00 0.00 44.72 45.90 2kq8 s GLY 56 CO -0.05 2.20 1.77 2.41 0.00 0.00 0.00 173.10 179.43 2kq8 n THR 57 N 4.07 0.56 0.42 0.90 -1.04 -1.25 -2.71 114.28 115.23 2kq8 n THR 57 Ca 0.10 -0.09 0.12 0.00 -2.04 0.00 0.00 64.05 62.14 2kq8 n THR 57 Cb 0.45 -0.72 0.18 0.00 -1.82 0.00 0.00 70.33 68.42 2kq8 n THR 57 CO 0.00 0.00 0.00 0.08 -0.64 0.00 0.00 175.07 174.51 2kq8 h ARG 58 N 0.00 0.00 -4.36 -2.82 0.11 -1.90 -3.42 114.38 101.99 2kq8 h ARG 58 Ca 0.00 0.00 -0.58 0.00 0.10 0.00 0.00 59.98 59.50 2kq8 h ARG 58 Cb 0.58 0.00 -0.37 0.00 1.11 0.00 0.00 29.97 31.29 2kq8 h ARG 58 CO 0.00 0.00 -0.80 0.71 0.10 0.00 0.00 179.97 179.98 2kq8 s TYR 59 N -3.20 1.95 0.26 4.08 1.51 -1.10 -4.02 117.35 116.82 2kq8 s TYR 59 Ca 0.06 -1.21 0.01 0.00 -1.01 0.00 0.00 57.07 54.93 2kq8 s TYR 59 Cb 0.11 -1.44 -0.03 0.00 -0.11 0.00 0.00 41.96 40.49 2kq8 s TYR 59 CO 0.70 -0.65 0.22 -0.51 -1.11 0.00 0.00 175.55 174.20 2kq8 s LEU 60 N 1.55 1.32 -0.17 -1.29 1.43 -1.25 -4.45 118.68 115.82 2kq8 s LEU 60 Ca 0.01 -1.51 -0.04 0.00 -1.03 0.00 0.00 54.13 51.56 2kq8 s LEU 60 Cb -0.15 0.57 -0.02 0.00 0.03 0.00 0.00 46.19 46.61 2kq8 s LEU 60 CO -0.08 -0.96 -0.03 -0.55 0.23 0.00 0.00 176.35 174.96 2kq8 s SER 61 N -3.24 4.74 0.59 2.29 0.15 -1.26 -2.39 113.70 114.59 2kq8 s SER 61 Ca 0.38 -0.18 -0.13 0.00 0.70 0.00 0.00 55.95 56.73 2kq8 s SER 61 Cb 0.05 -1.79 -0.05 0.00 -1.71 0.00 0.00 66.02 62.52 2kq8 s SER 61 CO 0.18 0.12 1.02 -0.54 1.20 0.00 0.00 173.24 175.22 2kq8 s LYS 62 N 0.66 3.70 0.00 5.44 -0.14 -1.26 -4.97 119.74 123.16 2kq8 s LYS 62 Ca -0.02 0.82 0.24 0.00 -1.36 0.00 0.00 55.97 55.65 2kq8 s LYS 62 Cb -0.14 -2.10 0.29 0.00 -1.68 0.00 0.00 37.83 34.20 2kq8 s LYS 62 CO 0.02 -0.49 1.27 1.47 -0.76 0.00 0.00 175.35 176.87 2kq8 n LEU 63 N -2.38 1.43 -0.49 3.17 -0.00 -1.26 -5.06 117.00 112.41 2kq8 n LEU 63 Ca 0.06 -0.49 0.00 0.00 -0.00 0.00 0.00 56.01 55.58 2kq8 n LEU 63 Cb 0.54 -0.06 0.00 0.00 -0.00 0.00 0.00 43.42 43.90 2kq8 n LEU 63 CO 0.54 0.28 -0.14 1.21 -0.00 0.00 0.00 177.39 179.28 2kq8 n GLU 64 N -0.53 -1.37 0.00 1.47 4.07 -1.26 -4.93 120.64 118.09 2kq8 n GLU 64 Ca 0.09 1.03 0.06 0.00 -0.06 0.00 0.00 57.16 58.28 2kq8 n GLU 64 Cb 0.40 -1.19 0.01 0.00 -0.06 0.00 0.00 31.44 30.60 2kq8 n GLU 64 CO 0.00 0.00 0.00 1.58 -0.06 0.00 0.00 177.13 178.65 2kq8 n HIS 65 N -1.16 0.00 -2.38 4.31 -0.00 -1.26 -4.99 115.22 109.75 2kq8 n HIS 65 Ca 0.00 0.00 -0.36 0.00 -0.00 0.00 0.00 57.72 57.36 2kq8 n HIS 65 Cb 0.03 0.00 -0.02 0.00 -0.00 0.00 0.00 29.99 30.00 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 -1.37 2.92 0.06 1.57 -3.43 -1.26 -5.05 115.29 108.73 2kq8 s HIS 66 Ca 0.11 1.57 0.02 0.00 -0.80 0.00 0.00 55.06 55.96 2kq8 s HIS 66 Cb 0.09 -3.24 -0.03 0.00 -1.43 0.00 0.00 32.58 27.98 2kq8 s HIS 66 CO 0.25 -1.20 -0.07 -1.01 -2.00 0.00 0.00 174.74 170.70 2kq8 s HIS 67 N -1.72 0.72 -0.43 0.38 3.76 -1.26 -5.12 115.29 111.62 2kq8 s HIS 67 Ca 0.66 -0.61 -0.19 0.00 -0.15 0.00 0.00 55.06 54.77 2kq8 s HIS 67 Cb -0.23 -0.43 0.02 0.00 1.11 0.00 0.00 32.58 33.05 2kq8 s HIS 67 CO 0.28 -0.10 0.55 -1.01 -0.85 0.00 0.00 174.74 173.61 2kq8 s HIS 68 N -1.95 3.11 -0.00 1.40 3.76 -1.26 -4.85 115.29 115.51 2kq8 s HIS 68 Ca -0.05 -0.19 0.11 0.00 -0.15 0.00 0.00 55.06 54.79 2kq8 s HIS 68 Cb -0.06 -3.15 -0.13 0.00 1.11 0.00 0.00 32.58 30.35 2kq8 s HIS 68 CO -0.01 -0.79 1.18 1.25 -0.85 0.00 0.00 174.74 175.52 2kq8 h HIS 69 N 8.80 0.00 0.00 1.40 6.17 -2.05 -3.58 115.15 125.90 2kq8 h HIS 69 Ca -0.26 0.00 0.00 0.00 0.71 0.00 0.00 60.37 60.82 2kq8 h HIS 69 Cb 1.10 0.00 0.00 0.00 2.52 0.00 0.00 27.41 31.03 2kq8 h HIS 69 CO 0.68 0.82 0.00 -2.39 0.71 0.00 0.00 177.93 177.76