#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 4.84 -1.47 2.02 -1.09 -1.26 -4.76 121.20 119.48 2kq8 s ILE 2 Ca 0.00 -2.10 0.12 0.00 -2.23 0.00 0.00 60.65 56.44 2kq8 s ILE 2 Cb 0.00 -4.87 0.11 0.00 -1.58 0.00 0.00 42.46 36.13 2kq8 s ILE 2 CO 0.00 -1.59 0.91 0.61 -1.23 0.00 0.00 174.94 173.64 2kq8 n GLY 3 N 4.83 -0.01 5.00 6.18 0.00 -1.26 -4.99 105.19 114.94 2kq8 n GLY 3 Ca 0.31 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.98 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 0.67 0.00 0.11 1.61 9.92 -1.26 -4.21 116.55 123.39 2kq8 n ASP 4 Ca 0.07 0.00 -0.19 0.00 -0.53 0.00 0.00 54.79 54.15 2kq8 n ASP 4 Cb 0.31 0.00 -0.13 0.00 -0.64 0.00 0.00 41.12 40.66 2kq8 n ASP 4 CO 0.00 0.00 0.00 1.88 0.13 0.00 0.00 177.20 179.21 2kq8 h TYR 5 N 0.00 0.71 -2.41 1.24 0.05 -1.97 -3.39 116.97 111.20 2kq8 h TYR 5 Ca 0.00 -0.49 -0.77 0.00 0.05 0.00 0.00 58.73 57.52 2kq8 h TYR 5 Cb 0.00 -0.04 -0.22 0.00 1.01 0.00 0.00 36.73 37.48 2kq8 h TYR 5 CO 0.00 1.36 1.23 0.66 -1.05 0.00 0.00 178.16 180.36 2kq8 n TYR 6 N -3.65 3.75 -3.60 4.88 4.02 -1.26 -4.88 117.16 116.43 2kq8 n TYR 6 Ca -0.11 -3.11 -0.05 0.00 -0.01 0.00 0.00 57.90 54.62 2kq8 n TYR 6 Cb 1.01 -1.78 -0.03 0.00 -0.02 0.00 0.00 39.34 38.52 2kq8 n TYR 6 CO 0.00 0.00 0.00 -1.50 -1.01 0.00 0.00 176.86 174.35 2kq8 s ILE 7 N -0.48 0.00 -0.86 -0.72 2.07 -1.26 -4.60 121.20 115.35 2kq8 s ILE 7 Ca 0.36 0.00 -0.17 0.00 -1.41 0.00 0.00 60.65 59.43 2kq8 s ILE 7 Cb 0.01 -1.00 0.16 0.00 0.13 0.00 0.00 42.46 41.76 2kq8 s ILE 7 CO 0.01 0.00 0.97 0.21 -1.91 0.00 0.00 174.94 174.22 2kq8 s ASN 8 N -1.57 6.63 -0.34 4.50 2.47 -1.26 -4.96 114.94 120.41 2kq8 s ASN 8 Ca 0.06 -2.20 0.02 0.00 0.42 0.00 0.00 52.86 51.16 2kq8 s ASN 8 Cb -0.01 -2.33 0.10 0.00 -1.45 0.00 0.00 41.25 37.57 2kq8 s ASN 8 CO -0.04 -0.91 0.10 0.00 -3.72 0.00 0.00 177.10 172.53 2kq8 s ALA 9 N 1.84 2.23 0.00 1.71 0.00 -1.26 -4.29 121.76 122.00 2kq8 s ALA 9 Ca 0.26 -2.18 0.00 0.00 0.00 0.00 0.00 51.96 50.04 2kq8 s ALA 9 Cb -0.08 -1.81 0.00 0.00 0.00 0.00 0.00 23.12 21.22 2kq8 s ALA 9 CO -0.08 -1.72 0.00 0.43 0.00 0.00 0.00 175.76 174.39 2kq8 n SER 10 N 4.42 0.00 0.17 0.00 7.64 -1.26 -5.08 113.62 119.50 2kq8 n SER 10 Ca 0.02 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.90 2kq8 n SER 10 Cb 0.41 0.24 0.00 0.00 -1.01 0.00 0.00 64.21 63.85 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 -2.23 0.65 -2.29 -0.43 0.00 -1.26 -4.96 120.51 109.99 2kq8 n ALA 11 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.01 2kq8 n ALA 11 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 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 -3.25 5.87 0.07 0.00 7.99 -1.26 -2.12 117.00 124.29 2kq8 n LEU 12 Ca 0.00 -4.15 -0.20 0.00 -0.01 0.00 0.00 56.01 51.64 2kq8 n LEU 12 Cb 0.00 -1.67 -0.15 0.00 -0.11 0.00 0.00 43.42 41.49 2kq8 n LEU 12 CO 0.00 0.71 -0.47 0.78 -1.51 0.00 0.00 177.39 176.90 2kq8 h ASN 13 N 6.74 0.53 0.06 -1.43 2.35 -1.67 -3.41 115.58 118.73 2kq8 h ASN 13 Ca 0.47 -0.78 -0.00 0.00 -0.55 0.00 0.00 56.30 55.44 2kq8 h ASN 13 Cb 0.76 -0.17 0.00 0.00 0.05 0.00 0.00 38.32 38.96 2kq8 h ASN 13 CO 1.61 1.65 -0.03 0.58 -1.65 0.00 0.00 177.43 179.59 2kq8 h VAL 14 N 0.09 0.00 -1.50 2.81 2.07 -1.45 -3.33 116.25 114.94 2kq8 h VAL 14 Ca -0.31 -0.34 -0.30 0.00 0.82 0.00 0.00 66.70 66.57 2kq8 h VAL 14 Cb 2.07 0.00 -0.11 0.00 -1.52 0.00 0.00 31.29 31.73 2kq8 h VAL 14 CO 0.17 0.00 -0.28 0.54 0.02 0.00 0.00 177.57 178.02 2kq8 n ARG 15 N -3.15 -1.38 -2.04 1.57 5.12 -0.57 -1.18 116.66 115.02 2kq8 n ARG 15 Ca -0.01 0.85 -0.19 0.00 -1.93 0.00 0.00 57.85 56.56 2kq8 n ARG 15 Cb 0.03 -5.15 -0.04 0.00 -1.16 0.00 0.00 32.46 26.14 2kq8 n ARG 15 CO 0.00 0.00 0.00 0.43 -1.93 0.00 0.00 177.63 176.13 2kq8 n SER 16 N -0.76 -5.49 0.00 0.55 7.64 -1.21 -2.96 113.62 111.38 2kq8 n SER 16 Ca -0.15 0.18 0.00 0.00 1.01 0.00 0.00 58.87 59.92 2kq8 n SER 16 Cb 0.49 -4.60 0.00 0.00 -1.01 0.00 0.00 64.21 59.09 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 -0.84 0.94 0.00 0.23 0.00 -0.33 -4.04 105.19 101.16 2kq8 n GLY 17 Ca -0.22 -1.06 0.10 0.00 0.00 0.00 0.00 46.02 44.84 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 0.29 -0.52 1.61 -0.58 -1.26 -4.66 120.64 115.51 2kq8 n GLU 18 Ca 0.00 0.09 0.00 0.00 -0.42 0.00 0.00 57.16 56.83 2kq8 n GLU 18 Cb 0.00 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.37 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 0.48 1.49 0.13 0.62 0.00 -1.16 -5.03 105.19 101.72 2kq8 n GLY 19 Ca 0.10 -0.25 -0.04 0.00 0.00 0.00 0.00 46.02 45.83 2kq8 n GLY 19 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2kq8 h THR 20 N 0.00 0.00 -3.57 2.61 1.35 -1.84 -3.41 112.91 108.06 2kq8 h THR 20 Ca 0.00 -0.62 -0.76 0.00 -0.55 0.00 0.00 66.41 64.49 2kq8 h THR 20 Cb 0.25 0.00 -0.28 0.00 -1.73 0.00 0.00 68.15 66.39 2kq8 h THR 20 CO 0.00 0.00 -0.12 0.20 -0.25 0.00 0.00 175.52 175.35 2kq8 s ASN 21 N -4.71 6.20 0.00 5.36 0.01 -1.26 -4.86 114.94 115.69 2kq8 s ASN 21 Ca -0.04 -2.46 0.26 0.00 -0.71 0.00 0.00 52.86 49.92 2kq8 s ASN 21 Cb 0.00 -2.11 0.73 0.00 0.41 0.00 0.00 41.25 40.29 2kq8 s ASN 21 CO 0.11 -0.60 1.56 0.00 -1.51 0.00 0.00 177.10 176.66 2kq8 n TYR 22 N 4.23 0.00 0.13 2.20 0.18 -1.26 -3.87 117.16 118.77 2kq8 n TYR 22 Ca 0.05 0.00 0.04 0.00 1.88 0.00 0.00 57.90 59.87 2kq8 n TYR 22 Cb 0.43 -0.02 0.02 0.00 -0.38 0.00 0.00 39.34 39.39 2kq8 n TYR 22 CO 0.00 0.00 0.00 0.07 -2.08 0.00 0.00 176.86 174.85 2kq8 h ARG 23 N 2.72 0.00 0.00 -3.48 0.11 -1.95 -3.39 114.38 108.39 2kq8 h ARG 23 Ca 0.00 0.00 -0.14 0.00 0.10 0.00 0.00 59.98 59.94 2kq8 h ARG 23 Cb 0.63 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 31.69 2kq8 h ARG 23 CO 0.00 0.35 -1.13 1.51 0.10 0.00 0.00 179.97 180.79 2kq8 n ILE 24 N -3.09 1.48 -4.61 0.08 3.06 -1.25 -4.97 119.36 110.06 2kq8 n ILE 24 Ca -0.00 0.04 -0.22 0.00 -2.50 0.00 0.00 62.75 60.06 2kq8 n ILE 24 Cb 0.71 -2.20 -0.15 0.00 0.54 0.00 0.00 39.64 38.54 2kq8 n ILE 24 CO 0.00 0.00 0.00 -0.63 -2.50 0.00 0.00 176.55 173.42 2kq8 s ILE 25 N -2.43 1.07 0.00 9.51 1.01 -1.25 -5.05 121.20 124.06 2kq8 s ILE 25 Ca -0.25 -0.56 0.00 0.00 0.00 0.00 0.00 60.65 59.84 2kq8 s ILE 25 Cb 0.06 -0.90 0.00 0.00 0.01 0.00 0.00 42.46 41.62 2kq8 s ILE 25 CO 0.41 0.31 0.00 0.61 0.00 0.00 0.00 174.94 176.27 2kq8 n GLY 26 N 2.89 -0.45 0.00 6.18 0.00 -1.26 -3.35 105.19 109.20 2kq8 n GLY 26 Ca -0.15 0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.94 2kq8 n GLY 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kq8 n ALA 27 N -2.26 0.00 -3.02 4.61 0.00 -1.26 -1.51 120.51 117.07 2kq8 n ALA 27 Ca 0.00 0.00 -0.45 0.00 0.00 0.00 0.00 53.44 52.99 2kq8 n ALA 27 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 2kq8 n ALA 27 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2kq8 s LEU 28 N 0.00 5.44 0.00 0.00 0.20 -0.90 -3.65 118.68 119.77 2kq8 s LEU 28 Ca 0.00 -2.18 0.12 0.00 0.69 0.00 0.00 54.13 52.76 2kq8 s LEU 28 Cb 0.00 -2.36 0.61 0.00 -0.43 0.00 0.00 46.19 44.01 2kq8 s LEU 28 CO 0.00 -0.96 1.41 -0.81 -0.29 0.00 0.00 176.35 175.70 2kq8 n PRO 29 N 5.97 1.18 0.00 0.98 -0.04 -1.26 -4.92 135.00 136.91 2kq8 n PRO 29 Ca 0.21 -0.28 0.00 0.00 -0.04 0.00 0.00 63.50 63.40 2kq8 n PRO 29 Cb 0.49 -1.21 0.00 0.00 -0.04 0.00 0.00 33.50 32.74 2kq8 n PRO 29 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 2kq8 n GLN 30 N -0.41 0.00 0.00 0.54 1.13 -1.26 -4.30 117.38 113.08 2kq8 n GLN 30 Ca 0.09 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.15 2kq8 n GLN 30 Cb 0.10 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.45 2kq8 n GLN 30 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2kq8 n GLY 31 N 0.00 0.50 0.08 1.08 0.00 -1.26 -4.93 105.19 100.66 2kq8 n GLY 31 Ca 0.00 -0.33 -0.13 0.00 0.00 0.00 0.00 46.02 45.56 2kq8 n GLY 31 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 2kq8 h GLN 32 N 0.00 -0.10 0.00 1.61 3.07 -2.01 -3.36 115.11 114.32 2kq8 h GLN 32 Ca 0.00 0.01 0.00 0.00 0.09 0.00 0.00 58.65 58.75 2kq8 h GLN 32 Cb 0.00 0.02 0.00 0.00 0.08 0.00 0.00 27.48 27.58 2kq8 h GLN 32 CO 0.00 0.10 -0.46 1.63 0.09 0.00 0.00 178.83 180.19 2kq8 n LYS 33 N -5.05 0.00 -3.88 0.06 5.02 -1.26 -5.07 118.16 107.99 2kq8 n LYS 33 Ca -0.08 -0.96 -0.27 0.00 -2.02 0.00 0.00 58.31 54.97 2kq8 n LYS 33 Cb 0.15 -0.50 -0.17 0.00 -0.02 0.00 0.00 35.03 34.49 2kq8 n LYS 33 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2kq8 s VAL 34 N -0.00 1.00 0.00 -0.18 1.01 -1.26 -4.84 120.40 116.13 2kq8 s VAL 34 Ca 0.00 -0.49 0.00 0.00 0.00 0.00 0.00 61.98 61.49 2kq8 s VAL 34 Cb 0.00 -1.16 0.00 0.00 0.00 0.00 0.00 36.38 35.22 2kq8 s VAL 34 CO 0.00 0.17 0.00 0.00 0.00 0.00 0.00 175.10 175.27 2kq8 n GLN 35 N 4.92 0.00 -3.58 2.72 0.00 -1.26 -4.17 117.38 116.00 2kq8 n GLN 35 Ca -0.11 0.00 -0.18 0.00 0.00 0.00 0.00 57.00 56.71 2kq8 n GLN 35 Cb 0.48 0.00 -0.14 0.00 0.00 0.00 0.00 30.24 30.58 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 0.00 -0.30 -0.21 -0.39 1.01 -1.26 -5.03 120.40 114.21 2kq8 s VAL 36 Ca 0.00 0.09 -0.17 0.00 0.00 0.00 0.00 61.98 61.91 2kq8 s VAL 36 Cb 0.00 -0.51 -0.08 0.00 0.00 0.00 0.00 36.38 35.79 2kq8 s VAL 36 CO 0.00 -0.05 -0.35 -0.38 0.00 0.00 0.00 175.10 174.32 2kq8 n ILE 37 N 5.32 1.51 -3.55 2.22 5.41 -1.26 -5.08 119.36 123.93 2kq8 n ILE 37 Ca -0.05 -0.03 -0.10 0.00 1.00 0.00 0.00 62.75 63.56 2kq8 n ILE 37 Cb 0.50 -2.20 -0.04 0.00 -0.71 0.00 0.00 39.64 37.19 2kq8 n ILE 37 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 176.55 176.00 2kq8 s SER 38 N -6.44 -0.39 0.11 4.38 0.15 -1.25 -5.05 113.70 105.21 2kq8 s SER 38 Ca -0.32 0.30 0.09 0.00 0.70 0.00 0.00 55.95 56.72 2kq8 s SER 38 Cb 0.08 0.35 -0.04 0.00 -1.71 0.00 0.00 66.02 64.69 2kq8 s SER 38 CO 0.45 -0.45 -0.21 -1.83 1.20 0.00 0.00 173.24 172.40 2kq8 s GLU 39 N -1.76 1.70 -0.28 5.44 -1.05 -1.26 0.04 118.70 121.53 2kq8 s GLU 39 Ca -0.00 -1.21 -0.17 0.00 -0.15 0.00 0.00 54.97 53.44 2kq8 s GLU 39 Cb -0.01 -2.06 0.08 0.00 -0.44 0.00 0.00 34.13 31.71 2kq8 s GLU 39 CO -0.01 0.48 0.70 1.21 0.95 0.00 0.00 175.26 178.59 2kq8 s ASN 40 N -2.04 -0.93 -0.83 0.83 3.84 0.16 -4.93 114.94 111.04 2kq8 s ASN 40 Ca 0.16 1.50 0.00 0.00 0.21 0.00 0.00 52.86 54.73 2kq8 s ASN 40 Cb -0.10 1.39 0.00 0.00 -0.55 0.00 0.00 41.25 41.99 2kq8 s ASN 40 CO 0.08 -0.24 0.00 -0.24 -2.79 0.00 0.00 177.10 173.92 2kq8 n SER 41 N 4.21 -3.57 0.00 -4.21 2.88 -1.26 -2.99 113.62 108.68 2kq8 n SER 41 Ca -0.20 0.11 0.00 0.00 -1.33 0.00 0.00 58.87 57.46 2kq8 n SER 41 Cb 0.59 -2.30 0.00 0.00 -0.75 0.00 0.00 64.21 61.75 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 -1.51 3.33 3.44 0.46 0.00 -1.26 -5.04 105.19 104.60 2kq8 n GLY 42 Ca -0.09 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.65 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 -2.90 2.36 -0.10 1.61 0.51 -1.16 -3.86 118.94 115.40 2kq8 s TRP 43 Ca 0.00 -0.34 -0.11 0.00 -2.12 0.00 0.00 56.10 53.53 2kq8 s TRP 43 Cb 0.00 -1.20 -0.05 0.00 -0.81 0.00 0.00 33.47 31.41 2kq8 s TRP 43 CO 0.00 0.45 0.26 -1.12 -0.51 0.00 0.00 176.95 176.03 2kq8 s SER 44 N -2.47 6.52 -0.18 2.95 0.01 0.22 0.38 113.70 121.13 2kq8 s SER 44 Ca 0.19 0.62 -0.11 0.00 1.31 0.00 0.00 55.95 57.96 2kq8 s SER 44 Cb -0.09 -2.15 -0.05 0.00 0.21 0.00 0.00 66.02 63.94 2kq8 s SER 44 CO 0.09 0.30 0.18 -0.75 0.41 0.00 0.00 173.24 173.47 2kq8 s LYS 45 N -0.62 4.14 0.24 12.44 2.36 0.11 -0.68 119.74 137.73 2kq8 s LYS 45 Ca 0.18 -0.11 -0.05 0.00 -2.55 0.00 0.00 55.97 53.43 2kq8 s LYS 45 Cb -0.14 -3.40 -0.02 0.00 -1.05 0.00 0.00 37.83 33.22 2kq8 s LYS 45 CO 0.06 0.33 0.29 0.96 1.55 0.00 0.00 175.35 178.55 2kq8 s ILE 46 N 0.26 0.00 -0.28 5.43 -4.36 -0.15 -3.84 121.20 118.25 2kq8 s ILE 46 Ca 0.11 -1.75 -0.03 0.00 -0.26 0.00 0.00 60.65 58.72 2kq8 s ILE 46 Cb -0.12 -2.41 0.03 0.00 1.25 0.00 0.00 42.46 41.21 2kq8 s ILE 46 CO 0.00 0.00 -0.00 0.21 0.24 0.00 0.00 174.94 175.39 2kq8 s ASN 47 N -3.13 4.71 -0.37 4.36 3.84 -1.26 -0.58 114.94 122.51 2kq8 s ASN 47 Ca 0.32 -0.93 -0.06 0.00 0.21 0.00 0.00 52.86 52.40 2kq8 s ASN 47 Cb 0.03 -1.74 0.06 0.00 -0.55 0.00 0.00 41.25 39.06 2kq8 s ASN 47 CO 0.12 -0.18 0.15 -0.47 -2.79 0.00 0.00 177.10 173.93 2kq8 s TYR 48 N 1.36 3.33 -1.36 0.43 5.04 0.12 -4.58 117.35 121.69 2kq8 s TYR 48 Ca -0.01 -1.68 -0.03 0.00 -2.44 0.00 0.00 57.07 52.91 2kq8 s TYR 48 Cb -0.18 -2.60 0.00 0.00 0.35 0.00 0.00 41.96 39.54 2kq8 s TYR 48 CO -0.02 -0.81 0.45 -1.71 -1.34 0.00 0.00 175.55 172.12 2kq8 n ASN 49 N 4.78 -5.44 0.00 4.32 4.05 -1.26 -2.13 115.26 119.58 2kq8 n ASN 49 Ca -0.10 -0.21 0.00 0.00 0.45 0.00 0.00 54.58 54.72 2kq8 n ASN 49 Cb 0.43 -4.31 0.00 0.00 1.23 0.00 0.00 39.78 37.13 2kq8 n ASN 49 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 2kq8 n GLY 50 N -1.36 0.81 3.44 8.20 0.00 -1.26 -5.05 105.19 109.97 2kq8 n GLY 50 Ca -0.11 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.66 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 -0.66 1.59 -0.03 1.61 -2.07 -0.90 -5.10 119.66 114.10 2kq8 s GLN 51 Ca 0.00 -1.65 -0.30 0.00 -1.82 0.00 0.00 55.36 51.58 2kq8 s GLN 51 Cb 0.00 -1.76 -0.04 0.00 -1.09 0.00 0.00 33.01 30.12 2kq8 s GLN 51 CO 0.00 0.35 1.30 0.99 -1.32 0.00 0.00 175.29 176.61 2kq8 s THR 52 N -2.18 3.97 0.20 3.63 2.01 -1.26 0.15 115.64 122.16 2kq8 s THR 52 Ca 0.26 1.33 0.02 0.00 0.31 0.00 0.00 61.69 63.60 2kq8 s THR 52 Cb -0.06 -3.86 -0.05 0.00 0.01 0.00 0.00 72.50 68.55 2kq8 s THR 52 CO 0.12 -0.00 0.03 -0.83 -0.69 0.00 0.00 174.62 173.25 2kq8 s GLY 53 N 1.67 1.38 0.05 4.40 0.00 0.25 -4.84 107.32 110.22 2kq8 s GLY 53 Ca 0.60 -1.67 0.04 0.00 0.00 0.00 0.00 44.72 43.68 2kq8 s GLY 53 CO 0.24 -1.55 -0.11 -0.19 0.00 0.00 0.00 173.10 171.49 2kq8 s TYR 54 N -3.69 0.97 0.20 1.90 1.51 -1.26 -0.98 117.35 116.00 2kq8 s TYR 54 Ca 0.28 -0.42 0.00 0.00 -1.01 0.00 0.00 57.07 55.92 2kq8 s TYR 54 Cb 0.07 -0.57 -0.04 0.00 -0.11 0.00 0.00 41.96 41.31 2kq8 s TYR 54 CO 0.07 -0.00 0.08 0.96 -1.11 0.00 0.00 175.55 175.55 2kq8 s ILE 55 N -1.12 0.33 0.16 2.71 -4.36 0.14 -4.24 121.20 114.82 2kq8 s ILE 55 Ca -0.04 -1.98 0.02 0.00 -0.26 0.00 0.00 60.65 58.39 2kq8 s ILE 55 Cb -0.09 -2.40 -0.04 0.00 1.25 0.00 0.00 42.46 41.18 2kq8 s ILE 55 CO 0.01 -0.16 0.31 -0.83 0.24 0.00 0.00 174.94 174.51 2kq8 s GLY 56 N -3.20 1.71 0.25 6.27 0.00 -1.26 0.73 107.32 111.83 2kq8 s GLY 56 Ca 0.33 -1.00 0.21 0.00 0.00 0.00 0.00 44.72 44.26 2kq8 s GLY 56 CO 0.09 -0.99 1.22 -0.84 0.00 0.00 0.00 173.10 172.58 2kq8 h THR 57 N 1.60 0.21 0.14 0.90 2.02 -1.94 -3.36 112.91 112.48 2kq8 h THR 57 Ca -0.48 -1.35 -0.32 0.00 0.77 0.00 0.00 66.41 65.02 2kq8 h THR 57 Cb 1.19 1.86 -0.00 0.00 -1.74 0.00 0.00 68.15 69.47 2kq8 h THR 57 CO 0.68 0.12 -1.65 0.03 0.37 0.00 0.00 175.52 175.07 2kq8 h ARG 58 N 0.00 0.29 -5.08 6.66 3.08 -1.94 -3.43 114.38 113.95 2kq8 h ARG 58 Ca -0.03 -0.49 -0.66 0.00 0.07 0.00 0.00 59.98 58.86 2kq8 h ARG 58 Cb 1.16 0.18 -0.17 0.00 0.08 0.00 0.00 29.97 31.23 2kq8 h ARG 58 CO 0.02 1.24 -0.13 0.71 -1.07 0.00 0.00 179.97 180.73 2kq8 s TYR 59 N -2.52 3.17 0.32 3.04 1.51 -1.26 -4.04 117.35 117.57 2kq8 s TYR 59 Ca -0.20 -0.05 -0.17 0.00 -1.01 0.00 0.00 57.07 55.64 2kq8 s TYR 59 Cb 0.05 -2.91 0.03 0.00 -0.11 0.00 0.00 41.96 39.03 2kq8 s TYR 59 CO 0.79 -0.60 0.72 -0.51 -1.11 0.00 0.00 175.55 174.84 2kq8 s LEU 60 N 2.28 -0.03 -0.19 -1.29 1.43 -1.25 -3.98 118.68 115.64 2kq8 s LEU 60 Ca 0.16 -0.91 0.01 0.00 -1.03 0.00 0.00 54.13 52.36 2kq8 s LEU 60 Cb -0.16 2.63 0.03 0.00 0.03 0.00 0.00 46.19 48.72 2kq8 s LEU 60 CO 0.14 -1.47 -0.16 -0.55 0.23 0.00 0.00 176.35 174.53 2kq8 s SER 61 N -3.01 3.32 0.00 2.29 0.15 -1.26 -4.39 113.70 110.81 2kq8 s SER 61 Ca 0.15 -0.78 0.00 0.00 0.70 0.00 0.00 55.95 56.01 2kq8 s SER 61 Cb -0.05 -1.42 0.00 0.00 -1.71 0.00 0.00 66.02 62.84 2kq8 s SER 61 CO 0.10 -0.06 0.00 1.17 1.20 0.00 0.00 173.24 175.65 2kq8 n LYS 62 N 4.62 3.87 0.02 5.44 3.00 -1.26 -5.08 118.16 128.76 2kq8 n LYS 62 Ca -0.18 0.00 -0.02 0.00 -0.00 0.00 0.00 58.31 58.11 2kq8 n LYS 62 Cb 0.48 0.00 -0.01 0.00 0.00 0.00 0.00 35.03 35.50 2kq8 n LYS 62 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.40 178.65 2kq8 h LEU 63 N 0.00 -0.11 0.00 3.14 5.85 -2.05 -3.50 115.31 118.64 2kq8 h LEU 63 Ca 0.00 0.00 0.16 0.00 0.84 0.00 0.00 57.88 58.89 2kq8 h LEU 63 Cb 0.00 0.03 -0.04 0.00 0.37 0.00 0.00 40.66 41.02 2kq8 h LEU 63 CO 0.00 0.23 -0.22 -0.62 -0.34 0.00 0.00 178.44 177.49 2kq8 n GLU 64 N -4.04 -1.21 -3.74 1.25 4.71 -1.26 -4.67 120.64 111.68 2kq8 n GLU 64 Ca -0.02 0.80 -0.30 0.00 -0.01 0.00 0.00 57.16 57.64 2kq8 n GLU 64 Cb 0.05 -1.48 -0.14 0.00 -1.01 0.00 0.00 31.44 28.86 2kq8 n GLU 64 CO 0.00 0.00 0.00 -1.58 0.09 0.00 0.00 177.13 175.64 2kq8 s HIS 65 N -1.02 2.01 -0.03 -0.32 2.46 -1.26 -5.10 115.29 112.04 2kq8 s HIS 65 Ca 0.00 -2.27 -0.00 0.00 0.47 0.00 0.00 55.06 53.25 2kq8 s HIS 65 Cb 0.00 -1.90 0.03 0.00 -0.13 0.00 0.00 32.58 30.58 2kq8 s HIS 65 CO 0.00 -0.82 0.04 -3.38 -2.47 0.00 0.00 174.74 168.11 2kq8 s HIS 66 N 0.73 0.02 -0.20 3.88 -3.43 -1.26 -5.13 115.29 109.89 2kq8 s HIS 66 Ca 0.15 0.18 -0.21 0.00 -0.80 0.00 0.00 55.06 54.38 2kq8 s HIS 66 Cb -0.22 -0.26 -0.03 0.00 -1.43 0.00 0.00 32.58 30.64 2kq8 s HIS 66 CO -0.07 -0.11 0.62 -1.58 -2.00 0.00 0.00 174.74 171.60 2kq8 s HIS 67 N 1.24 3.36 0.27 0.38 2.46 -1.26 -5.03 115.29 116.72 2kq8 s HIS 67 Ca -0.07 0.90 -0.30 0.00 0.47 0.00 0.00 55.06 56.06 2kq8 s HIS 67 Cb -0.13 -2.79 -0.11 0.00 -0.13 0.00 0.00 32.58 29.42 2kq8 s HIS 67 CO -0.03 -0.18 1.54 -1.01 -2.47 0.00 0.00 174.74 172.58 2kq8 s HIS 68 N 1.94 2.87 0.13 3.88 3.76 -1.26 -4.99 115.29 121.62 2kq8 s HIS 68 Ca 0.28 0.86 -0.18 0.00 -0.15 0.00 0.00 55.06 55.87 2kq8 s HIS 68 Cb -0.16 -3.97 -0.07 0.00 1.11 0.00 0.00 32.58 29.49 2kq8 s HIS 68 CO 0.10 -3.26 0.60 -1.01 -0.85 0.00 0.00 174.74 170.32 2kq8 s HIS 69 N 0.07 3.72 0.00 1.40 3.76 -1.26 -5.34 115.29 117.63 2kq8 s HIS 69 Ca 0.62 1.24 0.00 0.00 -0.15 0.00 0.00 55.06 56.77 2kq8 s HIS 69 Cb -0.45 -2.49 0.00 0.00 1.11 0.00 0.00 32.58 30.75 2kq8 s HIS 69 CO 0.45 0.49 0.00 1.58 -0.85 0.00 0.00 174.74 176.41