#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 1.79 0.00 1.12 -4.36 -1.26 -4.96 121.20 113.53 2kq8 s ILE 2 Ca 0.00 -2.10 0.00 0.00 -0.26 0.00 0.00 60.65 58.29 2kq8 s ILE 2 Cb 0.00 -1.96 0.00 0.00 1.25 0.00 0.00 42.46 41.75 2kq8 s ILE 2 CO 0.00 -0.48 0.00 0.61 0.24 0.00 0.00 174.94 175.31 2kq8 n GLY 3 N -0.11 0.00 3.44 6.27 0.00 -1.26 -5.08 105.19 108.45 2kq8 n GLY 3 Ca -0.10 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.48 2kq8 n GLY 3 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2kq8 s ASP 4 N 0.00 6.66 -1.20 1.61 1.11 -1.26 -4.90 116.67 118.69 2kq8 s ASP 4 Ca 0.00 -2.15 -0.04 0.00 0.18 0.00 0.00 52.55 50.55 2kq8 s ASP 4 Cb 0.00 -2.38 0.21 0.00 1.07 0.00 0.00 42.92 41.82 2kq8 s ASP 4 CO 0.00 -1.00 2.12 -1.22 1.18 0.00 0.00 175.17 176.25 2kq8 n TYR 5 N 6.21 2.67 -0.10 4.23 4.02 -1.26 -4.80 117.16 128.12 2kq8 n TYR 5 Ca 0.23 -2.71 -0.04 0.00 -0.01 0.00 0.00 57.90 55.37 2kq8 n TYR 5 Cb 0.49 -1.57 0.01 0.00 -0.02 0.00 0.00 39.34 38.25 2kq8 n TYR 5 CO 0.00 0.00 0.00 2.48 -1.01 0.00 0.00 176.86 178.33 2kq8 n TYR 6 N 1.07 0.39 -0.45 -0.72 4.11 -1.26 -4.90 117.16 115.39 2kq8 n TYR 6 Ca 0.54 -1.03 0.00 0.00 -0.00 0.00 0.00 57.90 57.41 2kq8 n TYR 6 Cb 0.26 -0.51 0.00 0.00 -0.00 0.00 0.00 39.34 39.09 2kq8 n TYR 6 CO 0.00 0.00 0.00 -0.89 -0.00 0.00 0.00 176.86 175.97 2kq8 n ILE 7 N 0.86 -1.23 0.00 -3.48 2.08 -1.26 -4.80 119.36 111.53 2kq8 n ILE 7 Ca 0.08 0.50 0.00 0.00 0.56 0.00 0.00 62.75 63.88 2kq8 n ILE 7 Cb 0.57 -0.77 0.00 0.00 -0.75 0.00 0.00 39.64 38.68 2kq8 n ILE 7 CO 0.00 0.00 0.00 0.59 0.56 0.00 0.00 176.55 177.70 2kq8 n ASN 8 N -1.58 0.00 0.00 4.38 3.02 -1.26 -4.67 115.26 115.15 2kq8 n ASN 8 Ca 0.00 0.00 0.06 0.00 -0.03 0.00 0.00 54.58 54.61 2kq8 n ASN 8 Cb 0.10 0.00 0.38 0.00 -0.61 0.00 0.00 39.78 39.65 2kq8 n ASN 8 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2kq8 n ALA 9 N 0.00 2.06 0.10 5.41 0.00 -1.26 -2.14 120.51 124.67 2kq8 n ALA 9 Ca 0.00 -0.08 -0.04 0.00 0.00 0.00 0.00 53.44 53.32 2kq8 n ALA 9 Cb 0.00 -1.21 0.11 0.00 0.00 0.00 0.00 19.45 18.36 2kq8 n ALA 9 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 2kq8 h SER 10 N 0.00 0.18 0.00 0.00 0.02 -1.90 -3.47 113.55 108.38 2kq8 h SER 10 Ca 0.00 -0.11 0.00 0.00 -0.84 0.00 0.00 61.79 60.84 2kq8 h SER 10 Cb 0.00 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 62.49 2kq8 h SER 10 CO 0.00 0.78 0.00 0.00 -1.14 0.00 0.00 176.83 176.47 2kq8 n ALA 11 N -2.45 0.00 0.58 3.77 0.00 -0.91 -4.63 120.51 116.87 2kq8 n ALA 11 Ca -0.02 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.41 2kq8 n ALA 11 Cb 0.65 0.00 0.07 0.00 0.00 0.00 0.00 19.45 20.17 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 0.00 2.52 -0.13 0.00 4.77 -1.26 -3.68 117.00 119.22 2kq8 n LEU 12 Ca 0.00 -1.28 0.01 0.00 -0.03 0.00 0.00 56.01 54.71 2kq8 n LEU 12 Cb 0.00 -0.55 0.03 0.00 -2.33 0.00 0.00 43.42 40.57 2kq8 n LEU 12 CO 0.00 0.41 0.45 -3.20 -1.33 0.00 0.00 177.39 173.72 2kq8 n ASN 13 N 0.14 1.88 -2.09 -1.43 5.15 -1.26 -4.61 115.26 113.03 2kq8 n ASN 13 Ca 0.08 -1.71 -0.15 0.00 -0.60 0.00 0.00 54.58 52.20 2kq8 n ASN 13 Cb 0.54 -0.03 -0.13 0.00 -0.53 0.00 0.00 39.78 39.62 2kq8 n ASN 13 CO 0.00 0.00 0.00 0.52 1.40 0.00 0.00 177.26 179.18 2kq8 n VAL 14 N -0.14 3.02 -3.91 3.44 0.31 -1.24 -4.51 118.33 115.30 2kq8 n VAL 14 Ca 0.02 -1.82 -0.29 0.00 -0.01 0.00 0.00 64.34 62.25 2kq8 n VAL 14 Cb 0.22 -1.86 -0.13 0.00 -0.91 0.00 0.00 33.84 31.16 2kq8 n VAL 14 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2kq8 s ARG 15 N 0.21 2.31 -1.91 5.55 1.70 -1.26 -2.07 118.95 123.47 2kq8 s ARG 15 Ca 0.61 -3.12 0.00 0.00 -0.47 0.00 0.00 55.73 52.74 2kq8 s ARG 15 Cb 0.32 -3.38 0.00 0.00 -0.57 0.00 0.00 34.95 31.32 2kq8 s ARG 15 CO -0.06 -1.23 0.00 0.43 -1.08 0.00 0.00 175.30 173.36 2kq8 n SER 16 N 2.32 -5.59 0.00 -2.89 7.64 -1.26 -2.98 113.62 110.85 2kq8 n SER 16 Ca 0.15 0.21 0.00 0.00 1.01 0.00 0.00 58.87 60.24 2kq8 n SER 16 Cb 0.34 -4.78 0.00 0.00 -1.01 0.00 0.00 64.21 58.76 2kq8 n SER 16 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2kq8 n GLY 17 N -0.74 0.29 0.27 0.23 0.00 -1.26 -4.01 105.19 99.98 2kq8 n GLY 17 Ca -0.22 -1.84 0.11 0.00 0.00 0.00 0.00 46.02 44.07 2kq8 n GLY 17 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2kq8 h GLU 18 N 0.00 0.00 0.00 1.61 4.39 -1.82 -3.43 114.58 115.34 2kq8 h GLU 18 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2kq8 h GLU 18 Cb 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 2kq8 h GLU 18 CO 0.00 0.04 0.00 0.41 -1.16 0.00 0.00 179.01 178.30 2kq8 n GLY 19 N -1.25 -1.00 0.06 -3.84 0.00 -1.23 -4.94 105.19 92.98 2kq8 n GLY 19 Ca -0.03 0.22 -0.03 0.00 0.00 0.00 0.00 46.02 46.19 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 0.00 -3.30 2.61 2.02 -1.67 -3.47 112.91 109.11 2kq8 h THR 20 Ca 0.00 -0.84 -0.61 0.00 0.77 0.00 0.00 66.41 65.73 2kq8 h THR 20 Cb 0.00 0.00 -0.34 0.00 -1.74 0.00 0.00 68.15 66.07 2kq8 h THR 20 CO 0.00 0.00 -0.85 0.20 0.37 0.00 0.00 175.52 175.24 2kq8 s ASN 21 N -5.33 2.56 0.00 4.18 0.02 -1.26 -5.02 114.94 110.10 2kq8 s ASN 21 Ca -0.09 -0.46 0.22 0.00 -1.02 0.00 0.00 52.86 51.50 2kq8 s ASN 21 Cb 0.01 -1.17 0.52 0.00 0.02 0.00 0.00 41.25 40.64 2kq8 s ASN 21 CO 0.14 0.06 1.45 -1.22 0.02 0.00 0.00 177.10 177.55 2kq8 n TYR 22 N 3.96 0.58 -0.06 2.20 4.01 -1.26 -4.18 117.16 122.40 2kq8 n TYR 22 Ca -0.20 -0.29 -0.12 0.00 -0.16 0.00 0.00 57.90 57.13 2kq8 n TYR 22 Cb 0.52 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 39.51 2kq8 n TYR 22 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 2kq8 n ARG 23 N 1.30 0.35 -0.30 -0.72 1.74 -1.26 -4.72 116.66 113.05 2kq8 n ARG 23 Ca 0.20 0.15 -0.04 0.00 -0.77 0.00 0.00 57.85 57.38 2kq8 n ARG 23 Cb 0.55 -1.09 0.08 0.00 -1.02 0.00 0.00 32.46 30.98 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 -0.61 1.21 -3.99 0.55 2.10 -2.01 -3.44 117.51 111.32 2kq8 h ILE 24 Ca -0.23 -0.38 -0.26 0.00 1.08 0.00 0.00 64.86 65.07 2kq8 h ILE 24 Cb 1.02 0.00 -0.15 0.00 -1.09 0.00 0.00 36.82 36.61 2kq8 h ILE 24 CO -0.14 0.20 -0.65 -0.63 -1.08 0.00 0.00 178.15 175.85 2kq8 s ILE 25 N -6.13 0.48 -0.03 2.19 1.01 -1.26 -4.96 121.20 112.50 2kq8 s ILE 25 Ca -0.13 -1.96 0.00 0.00 0.00 0.00 0.00 60.65 58.56 2kq8 s ILE 25 Cb 0.16 -2.13 0.00 0.00 0.01 0.00 0.00 42.46 40.50 2kq8 s ILE 25 CO 0.79 -0.44 0.00 0.61 0.00 0.00 0.00 174.94 175.90 2kq8 n GLY 26 N -0.21 -0.99 3.55 6.18 0.00 -0.88 -4.47 105.19 108.37 2kq8 n GLY 26 Ca -0.06 -0.73 -0.41 0.00 0.00 0.00 0.00 46.02 44.82 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 -1.00 2.79 -0.37 4.61 0.00 -1.26 -4.29 121.76 122.24 2kq8 s ALA 27 Ca 0.00 -2.16 -0.04 0.00 0.00 0.00 0.00 51.96 49.76 2kq8 s ALA 27 Cb 0.00 -4.43 0.23 0.00 0.00 0.00 0.00 23.12 18.92 2kq8 s ALA 27 CO 0.00 -3.49 1.08 1.47 0.00 0.00 0.00 175.76 174.82 2kq8 n LEU 28 N 8.72 -1.73 -4.47 0.00 -0.00 -1.26 -4.98 117.00 113.28 2kq8 n LEU 28 Ca 0.27 -1.47 -0.44 0.00 -0.00 0.00 0.00 56.01 54.37 2kq8 n LEU 28 Cb 0.50 0.59 -0.01 0.00 -0.00 0.00 0.00 43.42 44.50 2kq8 n LEU 28 CO 0.65 1.39 1.25 -2.16 -0.00 0.00 0.00 177.39 178.53 2kq8 s PRO 29 N 0.77 3.82 -0.04 1.47 0.04 -1.26 -4.92 135.00 134.87 2kq8 s PRO 29 Ca 0.25 -2.04 -0.29 0.00 0.04 0.00 0.00 61.00 58.96 2kq8 s PRO 29 Cb 0.14 -5.06 0.10 0.00 0.04 0.00 0.00 34.50 29.72 2kq8 s PRO 29 CO -0.10 -1.84 0.84 -1.14 0.04 0.00 0.00 177.00 174.80 2kq8 s GLN 30 N 2.56 0.86 0.00 4.56 0.74 -1.26 -4.22 119.66 122.90 2kq8 s GLN 30 Ca 0.39 -0.09 0.00 0.00 0.05 0.00 0.00 55.36 55.71 2kq8 s GLN 30 Cb -0.03 0.40 0.00 0.00 1.10 0.00 0.00 33.01 34.48 2kq8 s GLN 30 CO -0.05 -0.33 0.00 0.41 -0.55 0.00 0.00 175.29 174.77 2kq8 n GLY 31 N 0.24 -1.02 0.79 2.59 0.00 -1.26 -4.48 105.19 102.05 2kq8 n GLY 31 Ca -0.12 -1.65 0.09 0.00 0.00 0.00 0.00 46.02 44.34 2kq8 n GLY 31 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2kq8 n GLN 32 N -1.11 2.01 0.17 1.61 1.13 -1.26 -4.01 117.38 115.93 2kq8 n GLN 32 Ca 0.00 -1.55 0.13 0.00 -1.94 0.00 0.00 57.00 53.64 2kq8 n GLN 32 Cb 0.00 -1.39 0.58 0.00 0.11 0.00 0.00 30.24 29.54 2kq8 n GLN 32 CO 0.00 0.00 0.00 1.57 -1.44 0.00 0.00 177.06 177.19 2kq8 h LYS 33 N 2.78 0.00 -2.92 -1.09 2.10 -1.92 -3.41 116.57 112.11 2kq8 h LYS 33 Ca 0.00 0.00 -0.21 0.00 -2.00 0.00 0.00 60.65 58.44 2kq8 h LYS 33 Cb 0.62 0.00 -0.32 0.00 -0.90 0.00 0.00 32.23 31.64 2kq8 h LYS 33 CO 0.00 0.00 -0.52 0.54 -2.00 0.00 0.00 179.45 177.47 2kq8 s VAL 34 N -3.47 -0.29 -0.05 0.07 0.11 -1.25 0.47 120.40 115.99 2kq8 s VAL 34 Ca 0.02 0.24 0.02 0.00 -2.93 0.00 0.00 61.98 59.33 2kq8 s VAL 34 Cb 0.09 -0.42 0.01 0.00 -1.53 0.00 0.00 36.38 34.53 2kq8 s VAL 34 CO 0.36 0.10 -0.10 -1.58 -3.33 0.00 0.00 175.10 170.55 2kq8 s GLN 35 N 2.05 1.31 -0.03 1.54 0.74 -1.23 -4.91 119.66 119.12 2kq8 s GLN 35 Ca -0.02 -0.34 -0.30 0.00 0.05 0.00 0.00 55.36 54.75 2kq8 s GLN 35 Cb -0.11 -1.15 -0.04 0.00 1.10 0.00 0.00 33.01 32.81 2kq8 s GLN 35 CO -0.08 0.05 1.16 0.54 -0.55 0.00 0.00 175.29 176.41 2kq8 s VAL 36 N 0.51 4.31 -0.15 1.34 0.11 -1.26 -3.47 120.40 121.78 2kq8 s VAL 36 Ca -0.10 1.64 -0.12 0.00 -2.93 0.00 0.00 61.98 60.46 2kq8 s VAL 36 Cb -0.13 -4.05 -0.09 0.00 -1.53 0.00 0.00 36.38 30.58 2kq8 s VAL 36 CO 0.02 0.04 0.03 0.40 -3.33 0.00 0.00 175.10 172.26 2kq8 h ILE 37 N 4.90 0.38 -1.08 7.04 2.04 -1.69 -3.50 117.51 125.60 2kq8 h ILE 37 Ca -0.36 -1.41 0.32 0.00 1.00 0.00 0.00 64.86 64.41 2kq8 h ILE 37 Cb 1.18 0.85 -0.21 0.00 -0.74 0.00 0.00 36.82 37.90 2kq8 h ILE 37 CO 0.85 0.13 0.97 -0.55 0.00 0.00 0.00 178.15 179.55 2kq8 s SER 38 N -6.03 -0.02 0.24 1.72 0.15 -1.21 -5.03 113.70 103.52 2kq8 s SER 38 Ca -0.16 0.00 -0.20 0.00 0.70 0.00 0.00 55.95 56.29 2kq8 s SER 38 Cb 0.02 0.02 -0.08 0.00 -1.71 0.00 0.00 66.02 64.27 2kq8 s SER 38 CO 0.31 -0.04 0.74 -1.61 1.20 0.00 0.00 173.24 173.85 2kq8 s GLU 39 N -2.00 4.26 -0.18 5.44 8.01 -1.26 -0.13 118.70 132.83 2kq8 s GLU 39 Ca 0.11 0.89 -0.04 0.00 0.01 0.00 0.00 54.97 55.94 2kq8 s GLU 39 Cb -0.01 -2.83 0.09 0.00 -4.31 0.00 0.00 34.13 27.07 2kq8 s GLU 39 CO -0.03 0.36 0.26 1.21 0.01 0.00 0.00 175.26 177.07 2kq8 s ASN 40 N -1.70 0.86 -0.97 -0.19 3.84 0.13 -4.85 114.94 112.05 2kq8 s ASN 40 Ca 0.44 0.12 -0.06 0.00 0.21 0.00 0.00 52.86 53.57 2kq8 s ASN 40 Cb -0.16 0.60 -0.04 0.00 -0.55 0.00 0.00 41.25 41.10 2kq8 s ASN 40 CO 0.21 -0.29 0.83 -0.24 -2.79 0.00 0.00 177.10 174.82 2kq8 n SER 41 N 5.34 -6.71 0.00 -4.21 2.88 -1.26 -3.44 113.62 106.22 2kq8 n SER 41 Ca -0.05 -0.60 0.00 0.00 -1.33 0.00 0.00 58.87 56.89 2kq8 n SER 41 Cb 0.50 -4.86 0.00 0.00 -0.75 0.00 0.00 64.21 59.09 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 -1.45 2.05 3.92 0.46 0.00 -1.26 -4.94 105.19 103.98 2kq8 n GLY 42 Ca -0.06 -0.30 -0.26 0.00 0.00 0.00 0.00 46.02 45.40 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 0.00 3.53 -0.05 1.61 0.52 -1.22 -3.57 118.94 119.75 2kq8 s TRP 43 Ca 0.00 0.58 -0.02 0.00 0.02 0.00 0.00 56.10 56.68 2kq8 s TRP 43 Cb 0.00 -2.09 -0.04 0.00 -1.15 0.00 0.00 33.47 30.20 2kq8 s TRP 43 CO 0.00 -0.05 0.05 0.45 0.02 0.00 0.00 176.95 177.42 2kq8 s SER 44 N -4.00 5.53 -0.12 2.95 0.15 0.46 0.18 113.70 118.84 2kq8 s SER 44 Ca 0.44 0.17 -0.22 0.00 0.70 0.00 0.00 55.95 57.04 2kq8 s SER 44 Cb -0.10 -1.59 -0.03 0.00 -1.71 0.00 0.00 66.02 62.59 2kq8 s SER 44 CO 0.39 0.33 0.66 -0.54 1.20 0.00 0.00 173.24 175.29 2kq8 s LYS 45 N -1.28 4.34 0.13 5.44 1.02 0.82 -2.38 119.74 127.83 2kq8 s LYS 45 Ca 0.18 0.75 -0.04 0.00 0.02 0.00 0.00 55.97 56.87 2kq8 s LYS 45 Cb -0.12 -3.50 -0.03 0.00 -0.52 0.00 0.00 37.83 33.67 2kq8 s LYS 45 CO 0.07 -0.06 0.14 0.96 -0.92 0.00 0.00 175.35 175.54 2kq8 s ILE 46 N 1.25 0.11 -0.24 2.17 -4.36 -0.93 -1.60 121.20 117.60 2kq8 s ILE 46 Ca 0.33 -1.65 -0.03 0.00 -0.26 0.00 0.00 60.65 59.04 2kq8 s ILE 46 Cb -0.17 -1.85 0.01 0.00 1.25 0.00 0.00 42.46 41.71 2kq8 s ILE 46 CO 0.14 -0.49 -0.04 0.21 0.24 0.00 0.00 174.94 175.00 2kq8 s ASN 47 N -2.99 4.38 -0.39 4.36 3.84 -1.23 -0.50 114.94 122.42 2kq8 s ASN 47 Ca 0.18 -0.64 -0.06 0.00 0.21 0.00 0.00 52.86 52.55 2kq8 s ASN 47 Cb 0.06 -1.72 0.08 0.00 -0.55 0.00 0.00 41.25 39.12 2kq8 s ASN 47 CO -0.01 -0.09 0.18 -0.47 -2.79 0.00 0.00 177.10 173.92 2kq8 s TYR 48 N 1.42 3.38 -1.39 0.43 5.04 0.16 -3.52 117.35 122.86 2kq8 s TYR 48 Ca 0.03 -1.82 -0.04 0.00 -2.44 0.00 0.00 57.07 52.80 2kq8 s TYR 48 Cb -0.16 -2.80 0.00 0.00 0.35 0.00 0.00 41.96 39.36 2kq8 s TYR 48 CO -0.03 -0.86 0.56 -1.71 -1.34 0.00 0.00 175.55 172.17 2kq8 n ASN 49 N 4.76 -5.68 0.00 4.32 5.15 0.18 -1.94 115.26 122.04 2kq8 n ASN 49 Ca -0.09 -0.26 0.00 0.00 -0.60 0.00 0.00 54.58 53.63 2kq8 n ASN 49 Cb 0.43 -4.50 0.00 0.00 -0.53 0.00 0.00 39.78 35.17 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 -1.46 2.71 3.58 8.20 0.00 -1.26 -5.03 105.19 111.93 2kq8 n GLY 50 Ca -0.10 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.58 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 -0.75 3.43 0.08 1.61 -2.07 -0.82 -5.08 119.66 116.06 2kq8 s GLN 51 Ca 0.00 -0.47 -0.31 0.00 -1.82 0.00 0.00 55.36 52.77 2kq8 s GLN 51 Cb 0.00 -2.88 -0.06 0.00 -1.09 0.00 0.00 33.01 28.97 2kq8 s GLN 51 CO 0.00 0.42 1.20 0.99 -1.32 0.00 0.00 175.29 176.58 2kq8 s THR 52 N -0.11 3.95 0.07 3.63 2.01 -1.26 0.38 115.64 124.32 2kq8 s THR 52 Ca 0.03 1.44 0.02 0.00 0.31 0.00 0.00 61.69 63.49 2kq8 s THR 52 Cb -0.13 -3.92 -0.01 0.00 0.01 0.00 0.00 72.50 68.46 2kq8 s THR 52 CO 0.02 0.13 0.06 0.61 -0.69 0.00 0.00 174.62 174.76 2kq8 n GLY 53 N 3.06 3.78 3.01 4.40 0.00 0.34 -4.86 105.19 114.91 2kq8 n GLY 53 Ca 0.08 -1.71 -0.14 0.00 0.00 0.00 0.00 46.02 44.25 2kq8 n GLY 53 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2kq8 s TYR 54 N -2.31 0.56 0.14 1.61 1.51 -1.26 -2.19 117.35 115.40 2kq8 s TYR 54 Ca 0.09 -0.29 0.02 0.00 -1.01 0.00 0.00 57.07 55.88 2kq8 s TYR 54 Cb 0.00 -0.35 -0.04 0.00 -0.11 0.00 0.00 41.96 41.46 2kq8 s TYR 54 CO 0.06 -0.05 -0.03 0.96 -1.11 0.00 0.00 175.55 175.39 2kq8 s ILE 55 N -0.74 0.68 0.31 2.71 -5.25 -1.00 -4.15 121.20 113.76 2kq8 s ILE 55 Ca -0.04 -1.96 -0.27 0.00 -0.99 0.00 0.00 60.65 57.39 2kq8 s ILE 55 Cb -0.06 -1.93 -0.10 0.00 2.95 0.00 0.00 42.46 43.33 2kq8 s ILE 55 CO 0.00 -0.65 0.95 -0.83 -1.79 0.00 0.00 174.94 172.62 2kq8 s GLY 56 N -3.11 2.86 0.00 6.27 0.00 -1.26 -0.41 107.32 111.67 2kq8 s GLY 56 Ca 0.19 0.56 0.28 0.00 0.00 0.00 0.00 44.72 45.75 2kq8 s GLY 56 CO 0.00 1.02 1.81 2.41 0.00 0.00 0.00 173.10 178.35 2kq8 n THR 57 N 0.72 0.00 0.08 0.90 -1.04 -1.23 -3.44 114.28 110.26 2kq8 n THR 57 Ca 0.01 -0.06 -0.12 0.00 -2.04 0.00 0.00 64.05 61.84 2kq8 n THR 57 Cb 0.49 -0.06 -0.05 0.00 -1.82 0.00 0.00 70.33 68.89 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 0.55 0.29 -3.64 -2.82 2.47 -1.92 -3.43 114.38 105.89 2kq8 h ARG 58 Ca 0.00 -0.35 -0.44 0.00 -1.26 0.00 0.00 59.98 57.93 2kq8 h ARG 58 Cb 0.39 0.11 -0.38 0.00 -1.65 0.00 0.00 29.97 28.43 2kq8 h ARG 58 CO 0.00 1.07 -0.76 0.71 0.56 0.00 0.00 179.97 181.54 2kq8 s TYR 59 N -3.12 0.65 0.26 3.04 1.51 -1.22 -4.59 117.35 113.88 2kq8 s TYR 59 Ca -0.04 -0.22 0.02 0.00 -1.01 0.00 0.00 57.07 55.82 2kq8 s TYR 59 Cb 0.09 -0.80 -0.03 0.00 -0.11 0.00 0.00 41.96 41.10 2kq8 s TYR 59 CO 0.85 -0.35 0.20 -0.51 -1.11 0.00 0.00 175.55 174.63 2kq8 s LEU 60 N 1.98 1.37 -0.06 -1.29 1.02 -1.26 -4.51 118.68 115.93 2kq8 s LEU 60 Ca 0.04 -1.53 -0.03 0.00 0.02 0.00 0.00 54.13 52.64 2kq8 s LEU 60 Cb -0.13 0.50 0.04 0.00 0.02 0.00 0.00 46.19 46.62 2kq8 s LEU 60 CO -0.05 -0.94 0.12 -0.44 0.02 0.00 0.00 176.35 175.05 2kq8 s SER 61 N -3.24 0.47 0.23 2.29 0.01 -1.26 -4.52 113.70 107.67 2kq8 s SER 61 Ca 0.39 0.24 -0.30 0.00 1.31 0.00 0.00 55.95 57.60 2kq8 s SER 61 Cb 0.05 0.13 -0.09 0.00 0.21 0.00 0.00 66.02 66.32 2kq8 s SER 61 CO 0.18 -0.20 1.17 -0.75 0.41 0.00 0.00 173.24 174.05 2kq8 s LYS 62 N 1.78 4.54 0.08 12.44 2.20 -1.26 -4.84 119.74 134.67 2kq8 s LYS 62 Ca -0.02 1.87 0.13 0.00 -0.36 0.00 0.00 55.97 57.59 2kq8 s LYS 62 Cb -0.12 -3.21 0.57 0.00 -1.51 0.00 0.00 37.83 33.56 2kq8 s LYS 62 CO -0.05 0.01 1.40 1.47 -0.36 0.00 0.00 175.35 177.82 2kq8 n LEU 63 N 1.93 0.17 -2.69 5.43 -0.00 -1.26 -4.93 117.00 115.65 2kq8 n LEU 63 Ca 0.02 0.55 -0.04 0.00 -0.00 0.00 0.00 56.01 56.54 2kq8 n LEU 63 Cb 0.45 -0.55 -0.04 0.00 -0.00 0.00 0.00 43.42 43.28 2kq8 n LEU 63 CO 0.55 -0.44 -0.57 1.21 -0.00 0.00 0.00 177.39 178.14 2kq8 n GLU 64 N -1.70 -3.99 -2.60 1.47 2.13 -1.26 -4.83 120.64 109.86 2kq8 n GLU 64 Ca 0.02 3.06 -0.43 0.00 0.66 0.00 0.00 57.16 60.47 2kq8 n GLU 64 Cb 0.12 -4.50 0.00 0.00 0.27 0.00 0.00 31.44 27.33 2kq8 n GLU 64 CO 0.00 0.00 0.00 1.58 -0.41 0.00 0.00 177.13 178.30 2kq8 n HIS 65 N 1.69 3.58 -1.74 4.31 -0.00 -1.26 -5.00 115.22 116.81 2kq8 n HIS 65 Ca -0.31 -2.98 -0.41 0.00 -0.00 0.00 0.00 57.72 54.01 2kq8 n HIS 65 Cb 0.50 -1.97 0.01 0.00 -0.00 0.00 0.00 29.99 28.53 2kq8 n HIS 65 CO 0.00 0.00 0.00 -2.39 -0.00 0.00 0.00 176.34 173.95 2kq8 n HIS 66 N 4.20 2.55 -2.95 1.57 1.44 -1.26 -4.88 115.22 115.89 2kq8 n HIS 66 Ca 0.37 0.48 -0.44 0.00 -2.01 0.00 0.00 57.72 56.13 2kq8 n HIS 66 Cb 0.38 -2.45 0.00 0.00 0.12 0.00 0.00 29.99 28.04 2kq8 n HIS 66 CO 0.00 0.00 0.00 0.72 -2.81 0.00 0.00 176.34 174.25 2kq8 n HIS 67 N 0.10 4.95 -2.78 -1.40 8.25 -1.26 -4.61 115.22 118.47 2kq8 n HIS 67 Ca 0.04 -3.37 -0.02 0.00 -0.26 0.00 0.00 57.72 54.11 2kq8 n HIS 67 Cb 0.39 -2.17 0.00 0.00 1.12 0.00 0.00 29.99 29.34 2kq8 n HIS 67 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 2kq8 n HIS 68 N 5.48 -3.67 -3.64 4.41 -0.00 -1.26 -5.07 115.22 111.47 2kq8 n HIS 68 Ca 0.36 1.60 -0.15 0.00 -0.00 0.00 0.00 57.72 59.53 2kq8 n HIS 68 Cb 0.42 -3.83 -0.08 0.00 -0.00 0.00 0.00 29.99 26.51 2kq8 n HIS 68 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 176.34 174.76 2kq8 s HIS 69 N -1.76 -0.53 0.00 1.57 5.04 -1.26 -5.31 115.29 113.03 2kq8 s HIS 69 Ca 0.05 1.06 0.00 0.00 -1.54 0.00 0.00 55.06 54.63 2kq8 s HIS 69 Cb -0.01 0.26 0.00 0.00 0.04 0.00 0.00 32.58 32.87 2kq8 s HIS 69 CO 0.74 -0.44 0.36 -2.39 -2.34 0.00 0.00 174.74 170.66