#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 -3.84 -2.48 3.17 2.08 -1.26 -4.94 119.36 112.09 2kq8 n ILE 2 Ca 0.00 -0.39 -0.03 0.00 0.56 0.00 0.00 62.75 62.89 2kq8 n ILE 2 Cb 0.00 -4.14 0.07 0.00 -0.75 0.00 0.00 39.64 34.82 2kq8 n ILE 2 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 2kq8 n GLY 3 N -1.14 1.23 2.70 7.39 0.00 -1.26 -5.03 105.19 109.07 2kq8 n GLY 3 Ca -0.13 -0.11 -0.33 0.00 0.00 0.00 0.00 46.02 45.45 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 -0.99 6.07 -4.60 1.61 9.92 -1.26 -4.98 116.55 122.32 2kq8 n ASP 4 Ca -0.16 -3.78 -0.43 0.00 -0.53 0.00 0.00 54.79 49.89 2kq8 n ASP 4 Cb 0.77 -0.76 -0.02 0.00 -0.64 0.00 0.00 41.12 40.47 2kq8 n ASP 4 CO 0.00 0.00 0.00 -0.72 0.13 0.00 0.00 177.20 176.61 2kq8 s TYR 5 N -3.80 2.32 -0.64 1.24 1.13 -1.26 -4.95 117.35 111.38 2kq8 s TYR 5 Ca 0.50 0.65 -0.09 0.00 -1.41 0.00 0.00 57.07 56.72 2kq8 s TYR 5 Cb 0.41 -4.30 0.17 0.00 -1.10 0.00 0.00 41.96 37.14 2kq8 s TYR 5 CO -0.30 -2.07 0.52 0.71 -2.51 0.00 0.00 175.55 171.90 2kq8 s TYR 6 N 5.72 3.53 -0.24 -3.49 1.51 -1.26 -4.83 117.35 118.28 2kq8 s TYR 6 Ca 0.62 -2.20 0.28 0.00 -1.01 0.00 0.00 57.07 54.76 2kq8 s TYR 6 Cb -0.14 -3.51 0.87 0.00 -0.11 0.00 0.00 41.96 39.08 2kq8 s TYR 6 CO 0.32 -0.94 1.79 0.97 -1.11 0.00 0.00 175.55 176.58 2kq8 h ILE 7 N 5.38 0.00 -0.38 2.71 2.10 -1.93 -2.98 117.51 122.42 2kq8 h ILE 7 Ca -0.04 -0.68 -0.11 0.00 1.08 0.00 0.00 64.86 65.11 2kq8 h ILE 7 Cb 1.02 1.66 -0.07 0.00 -1.09 0.00 0.00 36.82 38.34 2kq8 h ILE 7 CO 0.78 0.00 0.14 -0.46 -1.08 0.00 0.00 178.15 177.53 2kq8 n ASN 8 N -2.95 3.38 -0.41 2.19 6.94 -1.26 -4.27 115.26 118.88 2kq8 n ASN 8 Ca 0.03 -2.61 0.00 0.00 -0.02 0.00 0.00 54.58 51.98 2kq8 n ASN 8 Cb 0.40 -0.63 0.00 0.00 -2.36 0.00 0.00 39.78 37.19 2kq8 n ASN 8 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2kq8 n ALA 9 N 0.04 0.00 -1.29 -2.53 0.00 -1.12 -5.04 120.51 110.57 2kq8 n ALA 9 Ca 0.21 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.60 2kq8 n ALA 9 Cb 0.88 0.00 0.22 0.00 0.00 0.00 0.00 19.45 20.55 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 -0.46 3.14 0.05 0.00 7.64 -1.26 -4.74 113.62 117.98 2kq8 n SER 10 Ca 0.00 -3.55 0.00 0.00 1.01 0.00 0.00 58.87 56.33 2kq8 n SER 10 Cb 0.00 -0.65 0.00 0.00 -1.01 0.00 0.00 64.21 62.55 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 -0.92 2.50 -0.78 -0.43 0.00 -1.26 -4.93 120.51 114.69 2kq8 n ALA 11 Ca 0.35 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.72 2kq8 n ALA 11 Cb 1.12 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 20.49 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 -2.79 5.38 0.10 0.00 4.32 -1.25 -4.00 117.00 118.75 2kq8 n LEU 12 Ca 0.00 -2.85 -0.05 0.00 -0.02 0.00 0.00 56.01 53.09 2kq8 n LEU 12 Cb 0.00 -1.26 0.05 0.00 -1.62 0.00 0.00 43.42 40.59 2kq8 n LEU 12 CO 0.00 1.36 0.35 0.78 -1.22 0.00 0.00 177.39 178.66 2kq8 h ASN 13 N 2.00 0.09 -0.76 -1.43 4.21 -1.77 -3.12 115.58 114.81 2kq8 h ASN 13 Ca 0.11 -0.07 -0.40 0.00 1.21 0.00 0.00 56.30 57.15 2kq8 h ASN 13 Cb 1.23 -0.03 -0.23 0.00 -1.12 0.00 0.00 38.32 38.17 2kq8 h ASN 13 CO 0.16 0.82 0.51 1.33 -1.29 0.00 0.00 177.43 178.97 2kq8 n VAL 14 N -3.67 2.72 -0.92 2.81 0.24 -1.23 -4.38 118.33 113.91 2kq8 n VAL 14 Ca -0.02 -1.53 -0.10 0.00 -2.04 0.00 0.00 64.34 60.65 2kq8 n VAL 14 Cb 0.74 -0.66 -0.13 0.00 -1.47 0.00 0.00 33.84 32.32 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 -0.71 1.81 -0.80 7.34 3.00 -0.77 -2.90 116.66 123.63 2kq8 n ARG 15 Ca 0.46 -0.85 0.00 0.00 -0.00 0.00 0.00 57.85 57.45 2kq8 n ARG 15 Cb 1.32 -1.80 0.00 0.00 0.00 0.00 0.00 32.46 31.98 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 2.22 -2.59 -1.61 6.15 2.88 -1.25 -3.57 113.62 115.84 2kq8 n SER 16 Ca 0.34 0.00 -0.01 0.00 -1.33 0.00 0.00 58.87 57.88 2kq8 n SER 16 Cb 0.82 -2.37 0.00 0.00 -0.75 0.00 0.00 64.21 61.91 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 -0.98 -0.90 0.67 0.46 0.00 -1.25 -4.27 105.19 98.92 2kq8 n GLY 17 Ca 0.00 -0.01 0.09 0.00 0.00 0.00 0.00 46.02 46.10 2kq8 n GLY 17 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2kq8 n GLU 18 N -0.44 -1.39 -1.22 1.61 2.13 -1.23 -4.30 120.64 115.79 2kq8 n GLU 18 Ca 0.01 0.97 -0.35 0.00 0.66 0.00 0.00 57.16 58.45 2kq8 n GLU 18 Cb 0.04 -1.68 -0.04 0.00 0.27 0.00 0.00 31.44 30.03 2kq8 n GLU 18 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2kq8 n GLY 19 N -2.84 4.01 0.10 8.31 0.00 -1.26 -4.20 105.19 109.31 2kq8 n GLY 19 Ca -0.00 -1.40 -0.13 0.00 0.00 0.00 0.00 46.02 44.49 2kq8 n GLY 19 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2kq8 n THR 20 N 3.55 1.58 -3.69 2.61 5.66 -1.26 -4.96 114.28 117.77 2kq8 n THR 20 Ca 0.72 -0.76 -0.14 0.00 -3.05 0.00 0.00 64.05 60.82 2kq8 n THR 20 Cb 0.28 -1.09 -0.08 0.00 -1.55 0.00 0.00 70.33 67.88 2kq8 n THR 20 CO 0.00 0.00 0.00 0.21 -3.05 0.00 0.00 175.07 172.23 2kq8 s ASN 21 N -6.20 -0.43 0.00 1.09 3.84 -1.26 -5.07 114.94 106.92 2kq8 s ASN 21 Ca -0.13 0.62 0.00 0.00 0.21 0.00 0.00 52.86 53.56 2kq8 s ASN 21 Cb 0.07 0.67 0.00 0.00 -0.55 0.00 0.00 41.25 41.45 2kq8 s ASN 21 CO 0.79 -0.34 0.82 -1.22 -2.79 0.00 0.00 177.10 174.35 2kq8 n TYR 22 N 1.95 0.00 -0.02 0.43 4.01 -1.26 -4.50 117.16 117.77 2kq8 n TYR 22 Ca -0.17 -0.33 -0.02 0.00 -0.16 0.00 0.00 57.90 57.22 2kq8 n TYR 22 Cb 0.56 -0.03 -0.02 0.00 -0.31 0.00 0.00 39.34 39.54 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 -0.33 2.52 0.31 -0.72 0.63 -1.26 -4.78 116.66 113.03 2kq8 n ARG 23 Ca 0.00 0.01 -0.17 0.00 -0.92 0.00 0.00 57.85 56.77 2kq8 n ARG 23 Cb 0.20 -1.09 -0.09 0.00 0.45 0.00 0.00 32.46 31.93 2kq8 n ARG 23 CO 0.00 0.00 0.00 0.82 -2.51 0.00 0.00 177.63 175.94 2kq8 h ILE 24 N 0.00 0.43 -3.29 5.15 2.04 -1.98 -3.45 117.51 116.41 2kq8 h ILE 24 Ca -0.09 -0.11 -0.38 0.00 1.00 0.00 0.00 64.86 65.28 2kq8 h ILE 24 Cb 1.19 0.47 -0.15 0.00 -0.74 0.00 0.00 36.82 37.59 2kq8 h ILE 24 CO -0.00 0.02 -0.73 -0.63 0.00 0.00 0.00 178.15 176.81 2kq8 s ILE 25 N -5.77 1.36 0.00 -0.67 1.01 -1.26 -5.08 121.20 110.78 2kq8 s ILE 25 Ca -0.17 -2.02 0.00 0.00 0.00 0.00 0.00 60.65 58.46 2kq8 s ILE 25 Cb 0.03 -1.83 0.00 0.00 0.01 0.00 0.00 42.46 40.68 2kq8 s ILE 25 CO 0.60 -0.63 0.00 0.61 0.00 0.00 0.00 174.94 175.52 2kq8 n GLY 26 N -0.08 2.00 2.74 6.18 0.00 -1.14 -4.26 105.19 110.63 2kq8 n GLY 26 Ca -0.11 -0.22 -0.18 0.00 0.00 0.00 0.00 46.02 45.52 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 -0.35 -0.48 4.61 0.00 -1.26 -1.85 121.76 120.43 2kq8 s ALA 27 Ca 0.00 -0.82 0.06 0.00 0.00 0.00 0.00 51.96 51.20 2kq8 s ALA 27 Cb 0.00 -1.94 0.18 0.00 0.00 0.00 0.00 23.12 21.37 2kq8 s ALA 27 CO 0.00 -1.99 0.61 -1.17 0.00 0.00 0.00 175.76 173.20 2kq8 s LEU 28 N 1.72 -0.62 -0.99 0.00 1.98 -1.26 -4.89 118.68 114.62 2kq8 s LEU 28 Ca 0.14 -2.08 -0.23 0.00 -2.89 0.00 0.00 54.13 49.07 2kq8 s LEU 28 Cb -0.15 1.22 0.00 0.00 0.66 0.00 0.00 46.19 47.92 2kq8 s LEU 28 CO -0.13 -0.09 1.70 -2.84 -1.89 0.00 0.00 176.35 173.09 2kq8 s PRO 29 N 0.68 3.12 -0.03 0.98 0.02 -1.26 -4.57 135.00 133.95 2kq8 s PRO 29 Ca 0.30 -0.81 -0.02 0.00 0.02 0.00 0.00 61.00 60.49 2kq8 s PRO 29 Cb 0.01 -5.24 -0.02 0.00 0.02 0.00 0.00 34.50 29.27 2kq8 s PRO 29 CO -0.09 -2.78 -0.04 0.94 -0.33 0.00 0.00 177.00 174.69 2kq8 n GLN 30 N 8.82 0.07 -1.13 5.54 7.27 -1.26 -4.74 117.38 131.95 2kq8 n GLN 30 Ca 0.37 0.03 -0.05 0.00 0.07 0.00 0.00 57.00 57.43 2kq8 n GLN 30 Cb 0.49 -0.65 -0.02 0.00 2.41 0.00 0.00 30.24 32.47 2kq8 n GLN 30 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2kq8 n GLY 31 N 2.82 0.72 0.04 1.69 0.00 -1.26 -4.23 105.19 104.98 2kq8 n GLY 31 Ca -0.07 -0.54 -0.00 0.00 0.00 0.00 0.00 46.02 45.41 2kq8 n GLY 31 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2kq8 h GLN 32 N 0.20 0.00 -0.03 1.61 4.20 -1.97 -3.38 115.11 115.74 2kq8 h GLN 32 Ca -0.09 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.62 2kq8 h GLN 32 Cb 0.39 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.17 2kq8 h GLN 32 CO 0.14 0.00 0.00 1.63 -0.67 0.00 0.00 178.83 179.93 2kq8 n LYS 33 N -4.14 2.15 -3.07 1.46 4.01 -1.26 -4.72 118.16 112.58 2kq8 n LYS 33 Ca -0.01 -1.86 -0.45 0.00 -0.51 0.00 0.00 58.31 55.49 2kq8 n LYS 33 Cb 0.02 -1.43 -0.03 0.00 -0.51 0.00 0.00 35.03 33.08 2kq8 n LYS 33 CO 0.00 0.00 0.00 0.08 -1.11 0.00 0.00 177.40 176.37 2kq8 s VAL 34 N -1.88 4.97 -0.04 -0.18 1.01 -1.24 -4.14 120.40 118.90 2kq8 s VAL 34 Ca 0.27 -1.67 0.03 0.00 0.00 0.00 0.00 61.98 60.60 2kq8 s VAL 34 Cb 0.19 -4.64 -0.03 0.00 0.00 0.00 0.00 36.38 31.90 2kq8 s VAL 34 CO 0.28 -1.31 -0.11 0.00 0.00 0.00 0.00 175.10 173.96 2kq8 s GLN 35 N 2.04 2.54 -0.12 2.72 -2.07 -1.10 -4.49 119.66 119.19 2kq8 s GLN 35 Ca 0.24 -0.68 -0.25 0.00 -1.82 0.00 0.00 55.36 52.85 2kq8 s GLN 35 Cb -0.10 -2.44 -0.02 0.00 -1.09 0.00 0.00 33.01 29.35 2kq8 s GLN 35 CO -0.06 0.62 0.81 0.14 -1.32 0.00 0.00 175.29 175.49 2kq8 s VAL 36 N -0.82 4.93 -0.23 3.63 -7.23 -1.26 -1.63 120.40 117.79 2kq8 s VAL 36 Ca 0.13 1.63 -0.19 0.00 -1.81 0.00 0.00 61.98 61.74 2kq8 s VAL 36 Cb -0.11 -4.13 -0.17 0.00 0.56 0.00 0.00 36.38 32.53 2kq8 s VAL 36 CO 0.02 0.11 0.04 -0.38 -0.31 0.00 0.00 175.10 174.58 2kq8 n ILE 37 N 4.36 1.54 -3.75 -0.62 5.41 -0.19 -5.00 119.36 121.10 2kq8 n ILE 37 Ca 0.03 -0.16 -0.06 0.00 1.00 0.00 0.00 62.75 63.56 2kq8 n ILE 37 Cb 0.50 -1.98 -0.02 0.00 -0.71 0.00 0.00 39.64 37.43 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 -7.06 -0.26 0.03 4.38 0.15 -1.14 -5.02 113.70 104.78 2kq8 s SER 38 Ca -0.32 -0.42 -0.00 0.00 0.70 0.00 0.00 55.95 55.91 2kq8 s SER 38 Cb 0.09 0.58 -0.02 0.00 -1.71 0.00 0.00 66.02 64.96 2kq8 s SER 38 CO 0.56 -1.06 -0.03 -1.83 1.20 0.00 0.00 173.24 172.08 2kq8 s GLU 39 N -3.56 0.39 -0.23 5.44 4.04 -1.26 0.59 118.70 124.10 2kq8 s GLU 39 Ca 0.10 -0.76 -0.13 0.00 0.04 0.00 0.00 54.97 54.23 2kq8 s GLU 39 Cb -0.03 0.12 0.07 0.00 0.02 0.00 0.00 34.13 34.32 2kq8 s GLU 39 CO 0.02 -0.06 0.56 1.21 -1.84 0.00 0.00 175.26 175.15 2kq8 s ASN 40 N -1.81 -0.75 0.00 0.83 3.84 0.12 -4.91 114.94 112.26 2kq8 s ASN 40 Ca -0.10 1.24 0.00 0.00 0.21 0.00 0.00 52.86 54.20 2kq8 s ASN 40 Cb -0.06 1.16 0.00 0.00 -0.55 0.00 0.00 41.25 41.80 2kq8 s ASN 40 CO -0.03 -0.22 0.00 -0.24 -2.79 0.00 0.00 177.10 173.82 2kq8 n SER 41 N 4.37 0.00 0.00 -4.21 2.88 -1.26 -2.05 113.62 113.35 2kq8 n SER 41 Ca -0.21 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.33 2kq8 n SER 41 Cb 0.57 -1.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.02 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 -2.00 2.08 3.90 0.46 0.00 -1.26 -5.09 105.19 103.27 2kq8 n GLY 42 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 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 -1.96 3.48 -0.03 1.61 0.52 -0.87 -1.39 118.94 120.30 2kq8 s TRP 43 Ca 0.00 0.53 0.06 0.00 0.02 0.00 0.00 56.10 56.71 2kq8 s TRP 43 Cb 0.00 -1.98 -0.02 0.00 -1.15 0.00 0.00 33.47 30.31 2kq8 s TRP 43 CO 0.00 0.43 -0.21 0.45 0.02 0.00 0.00 176.95 177.64 2kq8 s SER 44 N -2.52 3.50 -0.50 2.95 0.15 0.62 0.12 113.70 118.02 2kq8 s SER 44 Ca 0.41 -0.35 -0.27 0.00 0.70 0.00 0.00 55.95 56.44 2kq8 s SER 44 Cb -0.12 -0.57 0.03 0.00 -1.71 0.00 0.00 66.02 63.65 2kq8 s SER 44 CO 0.25 0.33 1.03 -0.54 1.20 0.00 0.00 173.24 175.52 2kq8 s LYS 45 N -0.69 3.55 0.21 5.44 -0.14 0.20 -2.59 119.74 125.71 2kq8 s LYS 45 Ca 0.11 0.23 0.05 0.00 -1.36 0.00 0.00 55.97 54.99 2kq8 s LYS 45 Cb -0.10 -3.96 -0.05 0.00 -1.68 0.00 0.00 37.83 32.04 2kq8 s LYS 45 CO -0.00 -1.39 -0.06 0.96 -0.76 0.00 0.00 175.35 174.11 2kq8 s ILE 46 N 4.19 1.23 -0.36 2.17 -0.00 -1.18 -1.03 121.20 126.23 2kq8 s ILE 46 Ca 0.40 -2.07 -0.12 0.00 -0.00 0.00 0.00 60.65 58.85 2kq8 s ILE 46 Cb -0.09 -2.18 0.00 0.00 -0.00 0.00 0.00 42.46 40.19 2kq8 s ILE 46 CO 0.27 -0.48 0.23 0.21 -0.00 0.00 0.00 174.94 175.18 2kq8 s ASN 47 N -3.28 5.92 -0.53 4.36 2.47 -0.65 -2.86 114.94 120.37 2kq8 s ASN 47 Ca 0.24 -0.66 -0.10 0.00 0.42 0.00 0.00 52.86 52.76 2kq8 s ASN 47 Cb 0.04 -2.10 0.13 0.00 -1.45 0.00 0.00 41.25 37.87 2kq8 s ASN 47 CO 0.06 -0.31 0.42 -0.47 -3.72 0.00 0.00 177.10 173.08 2kq8 s TYR 48 N 1.66 3.43 -1.46 0.43 5.04 0.13 -2.72 117.35 123.87 2kq8 s TYR 48 Ca 0.05 -1.87 -0.06 0.00 -2.44 0.00 0.00 57.07 52.75 2kq8 s TYR 48 Cb -0.18 -3.55 0.03 0.00 0.35 0.00 0.00 41.96 38.60 2kq8 s TYR 48 CO 0.09 -0.99 0.50 -1.71 -1.34 0.00 0.00 175.55 172.11 2kq8 n ASN 49 N 4.74 -5.27 0.00 4.32 5.15 -1.26 -1.51 115.26 121.45 2kq8 n ASN 49 Ca -0.05 -0.27 0.00 0.00 -0.60 0.00 0.00 54.58 53.65 2kq8 n ASN 49 Cb 0.41 -4.29 0.00 0.00 -0.53 0.00 0.00 39.78 35.37 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 -1.35 0.74 3.35 8.20 0.00 -1.26 -5.07 105.19 109.80 2kq8 n GLY 50 Ca -0.09 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.70 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 -0.72 1.33 0.09 1.61 -2.07 -0.57 -5.14 119.66 114.20 2kq8 s GLN 51 Ca 0.00 -1.46 -0.16 0.00 -1.82 0.00 0.00 55.36 51.92 2kq8 s GLN 51 Cb 0.00 -1.41 -0.07 0.00 -1.09 0.00 0.00 33.01 30.45 2kq8 s GLN 51 CO 0.00 0.28 0.53 0.99 -1.32 0.00 0.00 175.29 175.77 2kq8 s THR 52 N -2.10 4.84 0.00 3.63 2.01 -1.26 0.21 115.64 122.98 2kq8 s THR 52 Ca 0.18 0.98 0.00 0.00 0.31 0.00 0.00 61.69 63.15 2kq8 s THR 52 Cb -0.06 -3.79 0.00 0.00 0.01 0.00 0.00 72.50 68.66 2kq8 s THR 52 CO 0.08 0.43 0.00 0.61 -0.69 0.00 0.00 174.62 175.04 2kq8 n GLY 53 N 1.34 1.83 3.16 4.40 0.00 -1.13 -4.92 105.19 109.87 2kq8 n GLY 53 Ca -0.09 -0.95 -0.20 0.00 0.00 0.00 0.00 46.02 44.78 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 -7.39 1.27 0.24 1.61 1.51 -1.26 -3.08 117.35 110.25 2kq8 s TYR 54 Ca 0.00 -0.38 -0.04 0.00 -1.01 0.00 0.00 57.07 55.64 2kq8 s TYR 54 Cb 0.00 -0.74 -0.02 0.00 -0.11 0.00 0.00 41.96 41.08 2kq8 s TYR 54 CO 0.00 0.05 0.28 0.96 -1.11 0.00 0.00 175.55 175.73 2kq8 s ILE 55 N -0.95 0.00 -0.45 2.71 -5.25 -1.07 -3.75 121.20 112.44 2kq8 s ILE 55 Ca 0.01 -1.78 -0.24 0.00 -0.99 0.00 0.00 60.65 57.65 2kq8 s ILE 55 Cb -0.08 -2.43 0.03 0.00 2.95 0.00 0.00 42.46 42.92 2kq8 s ILE 55 CO 0.02 0.00 0.82 -0.83 -1.79 0.00 0.00 174.94 173.16 2kq8 s GLY 56 N -3.15 1.56 0.55 6.27 0.00 -1.26 -0.27 107.32 111.03 2kq8 s GLY 56 Ca 0.33 -0.96 0.30 0.00 0.00 0.00 0.00 44.72 44.40 2kq8 s GLY 56 CO 0.13 1.85 2.14 -0.84 0.00 0.00 0.00 173.10 176.38 2kq8 h THR 57 N 6.01 0.45 -0.32 0.90 2.02 -1.54 -3.03 112.91 117.40 2kq8 h THR 57 Ca -0.25 -0.37 -0.08 0.00 0.77 0.00 0.00 66.41 66.48 2kq8 h THR 57 Cb 1.08 1.25 -0.01 0.00 -1.74 0.00 0.00 68.15 68.74 2kq8 h THR 57 CO 0.98 0.07 -0.11 0.03 0.37 0.00 0.00 175.52 176.87 2kq8 h ARG 58 N 0.00 0.63 -4.77 6.66 3.08 -1.91 -3.41 114.38 114.66 2kq8 h ARG 58 Ca -0.00 -0.26 -0.63 0.00 0.07 0.00 0.00 59.98 59.16 2kq8 h ARG 58 Cb 0.25 -0.03 -0.36 0.00 0.08 0.00 0.00 29.97 29.91 2kq8 h ARG 58 CO 0.01 0.83 -0.83 0.71 -1.07 0.00 0.00 179.97 179.62 2kq8 s TYR 59 N -4.71 2.50 0.03 3.04 1.51 -1.15 -5.10 117.35 113.49 2kq8 s TYR 59 Ca -0.13 -1.54 -0.21 0.00 -1.01 0.00 0.00 57.07 54.18 2kq8 s TYR 59 Cb 0.09 -1.73 0.05 0.00 -0.11 0.00 0.00 41.96 40.25 2kq8 s TYR 59 CO 0.79 -0.75 0.48 -0.51 -1.11 0.00 0.00 175.55 174.46 2kq8 s LEU 60 N 1.37 0.11 -0.23 -1.29 1.43 -1.26 -4.73 118.68 114.08 2kq8 s LEU 60 Ca 0.02 0.16 -0.05 0.00 -1.03 0.00 0.00 54.13 53.23 2kq8 s LEU 60 Cb -0.14 1.96 -0.02 0.00 0.03 0.00 0.00 46.19 48.02 2kq8 s LEU 60 CO -0.10 -0.67 0.01 -0.44 0.23 0.00 0.00 176.35 175.38 2kq8 s SER 61 N -1.84 4.69 0.60 2.29 0.01 -1.26 -5.08 113.70 113.10 2kq8 s SER 61 Ca -0.07 -0.29 0.10 0.00 1.31 0.00 0.00 55.95 57.00 2kq8 s SER 61 Cb -0.01 -1.82 0.10 0.00 0.21 0.00 0.00 66.02 64.49 2kq8 s SER 61 CO -0.00 -0.01 0.81 -0.75 0.41 0.00 0.00 173.24 173.69 2kq8 s LYS 62 N 1.45 2.23 -0.06 12.44 2.20 -1.26 -4.54 119.74 132.20 2kq8 s LYS 62 Ca 0.05 -1.72 0.10 0.00 -0.36 0.00 0.00 55.97 54.04 2kq8 s LYS 62 Cb -0.15 -2.61 0.39 0.00 -1.51 0.00 0.00 37.83 33.96 2kq8 s LYS 62 CO 0.00 -0.94 1.23 1.47 -0.36 0.00 0.00 175.35 176.76 2kq8 n LEU 63 N -2.28 2.80 -0.04 5.43 -0.00 -1.26 -3.78 117.00 117.86 2kq8 n LEU 63 Ca 0.16 -1.41 0.14 0.00 -0.00 0.00 0.00 56.01 54.90 2kq8 n LEU 63 Cb 0.62 -0.42 0.68 0.00 -0.00 0.00 0.00 43.42 44.29 2kq8 n LEU 63 CO 0.40 0.49 0.94 -1.84 -0.00 0.00 0.00 177.39 177.38 2kq8 n GLU 64 N 0.51 0.48 -4.27 1.47 -0.00 -1.26 -4.76 120.64 112.80 2kq8 n GLU 64 Ca 0.14 -0.08 -0.24 0.00 -0.00 0.00 0.00 57.16 56.98 2kq8 n GLU 64 Cb 0.54 -1.50 -0.08 0.00 -0.00 0.00 0.00 31.44 30.40 2kq8 n GLU 64 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.13 176.12 2kq8 s HIS 65 N -2.58 2.62 0.31 -1.84 3.76 -1.25 -5.10 115.29 111.21 2kq8 s HIS 65 Ca 0.27 -0.35 -0.30 0.00 -0.15 0.00 0.00 55.06 54.53 2kq8 s HIS 65 Cb 0.20 -1.41 -0.11 0.00 1.11 0.00 0.00 32.58 32.37 2kq8 s HIS 65 CO 0.48 0.50 1.55 -1.01 -0.85 0.00 0.00 174.74 175.41 2kq8 s HIS 66 N -2.44 2.75 -0.78 1.40 3.76 -1.26 -4.87 115.29 113.85 2kq8 s HIS 66 Ca 0.34 0.89 -0.26 0.00 -0.15 0.00 0.00 55.06 55.88 2kq8 s HIS 66 Cb -0.03 -4.03 0.03 0.00 1.11 0.00 0.00 32.58 29.66 2kq8 s HIS 66 CO 0.20 -3.35 1.36 -1.01 -0.85 0.00 0.00 174.74 171.09 2kq8 s HIS 67 N -0.25 2.27 -0.66 1.40 0.09 -1.26 -4.95 115.29 111.93 2kq8 s HIS 67 Ca 0.60 -0.12 -0.27 0.00 -0.00 0.00 0.00 55.06 55.27 2kq8 s HIS 67 Cb -0.47 -4.60 0.03 0.00 -0.00 0.00 0.00 32.58 27.55 2kq8 s HIS 67 CO 0.51 -2.07 1.23 -1.58 -0.00 0.00 0.00 174.74 172.83 2kq8 s HIS 68 N 5.90 2.45 0.28 1.40 5.04 -1.26 -5.01 115.29 124.08 2kq8 s HIS 68 Ca 0.39 0.16 -0.05 0.00 -1.54 0.00 0.00 55.06 54.02 2kq8 s HIS 68 Cb -0.07 -4.56 -0.05 0.00 0.04 0.00 0.00 32.58 27.94 2kq8 s HIS 68 CO 0.11 -1.83 0.55 -3.38 -2.34 0.00 0.00 174.74 167.85 2kq8 s HIS 69 N 5.31 3.47 0.00 3.88 -3.43 -1.26 -4.96 115.29 118.30 2kq8 s HIS 69 Ca 0.38 0.66 0.00 0.00 -0.80 0.00 0.00 55.06 55.30 2kq8 s HIS 69 Cb -0.08 -2.11 0.00 0.00 -1.43 0.00 0.00 32.58 28.96 2kq8 s HIS 69 CO 0.20 0.19 0.15 1.58 -2.00 0.00 0.00 174.74 174.85