#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1kn7 n GLU 2 N 0.00 -0.37 -0.95 2.12 0.28 -1.26 -4.85 120.64 115.62 1kn7 n GLU 2 Ca 0.00 -0.08 -0.36 0.00 -0.16 0.00 0.00 57.16 56.57 1kn7 n GLU 2 Cb 0.00 -1.62 0.06 0.00 1.43 0.00 0.00 31.44 31.31 1kn7 n GLU 2 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 177.13 177.25 1kn7 n VAL 3 N -3.45 0.00 -2.89 3.84 0.31 -1.26 -4.83 118.33 110.05 1kn7 n VAL 3 Ca 0.04 -0.38 -0.42 0.00 -0.01 0.00 0.00 64.34 63.56 1kn7 n VAL 3 Cb 0.56 -0.15 -0.04 0.00 -0.91 0.00 0.00 33.84 33.30 1kn7 n VAL 3 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1kn7 s ALA 4 N -2.09 3.46 -0.47 3.52 0.00 -1.26 -4.98 121.76 119.94 1kn7 s ALA 4 Ca 0.44 -0.48 0.03 0.00 0.00 0.00 0.00 51.96 51.94 1kn7 s ALA 4 Cb -0.16 -3.41 0.15 0.00 0.00 0.00 0.00 23.12 19.71 1kn7 s ALA 4 CO 0.78 -1.42 0.31 1.41 0.00 0.00 0.00 175.76 176.84 1kn7 s MET 5 N 3.18 1.32 0.31 0.00 0.00 -1.26 -5.10 119.30 117.75 1kn7 s MET 5 Ca 0.34 -2.21 0.06 0.00 0.00 0.00 0.00 55.69 53.88 1kn7 s MET 5 Cb -0.13 -2.18 -0.06 0.00 0.00 0.00 0.00 34.83 32.45 1kn7 s MET 5 CO 0.16 -1.25 -0.01 0.08 0.00 0.00 0.00 175.02 173.99 1kn7 s VAL 6 N 0.02 1.56 -0.74 10.11 1.01 -1.26 -5.05 120.40 126.05 1kn7 s VAL 6 Ca 0.23 -2.07 -0.26 0.00 0.00 0.00 0.00 61.98 59.88 1kn7 s VAL 6 Cb -0.13 -2.64 -0.06 0.00 0.00 0.00 0.00 36.38 33.56 1kn7 s VAL 6 CO -0.08 -0.16 2.07 -0.94 0.00 0.00 0.00 175.10 175.99 1kn7 s SER 7 N -3.50 4.84 -1.12 3.32 1.04 -1.26 -4.85 113.70 112.18 1kn7 s SER 7 Ca 0.32 0.02 -0.23 0.00 0.48 0.00 0.00 55.95 56.54 1kn7 s SER 7 Cb 0.06 -2.54 -0.08 0.00 0.10 0.00 0.00 66.02 63.56 1kn7 s SER 7 CO 0.14 -2.87 1.95 0.00 0.98 0.00 0.00 173.24 173.44 1kn7 s ALA 8 N 10.97 1.73 1.12 5.32 0.00 -1.26 -4.93 121.76 134.71 1kn7 s ALA 8 Ca 0.77 -1.99 -0.19 0.00 0.00 0.00 0.00 51.96 50.55 1kn7 s ALA 8 Cb -0.11 -4.65 0.10 0.00 0.00 0.00 0.00 23.12 18.46 1kn7 s ALA 8 CO 0.11 -5.20 -0.06 -1.91 0.00 0.00 0.00 175.76 168.70 1kn7 n GLU 9 N 8.40 -1.64 -3.70 0.00 2.13 -1.26 -4.93 120.64 119.64 1kn7 n GLU 9 Ca 0.44 -0.47 -0.34 0.00 0.66 0.00 0.00 57.16 57.45 1kn7 n GLU 9 Cb 0.47 -1.65 -0.08 0.00 0.27 0.00 0.00 31.44 30.45 1kn7 n GLU 9 CO 0.00 0.00 0.00 -1.54 -0.41 0.00 0.00 177.13 175.18 1kn7 s SER 10 N -1.81 5.73 0.37 4.31 1.04 -1.26 -5.04 113.70 117.04 1kn7 s SER 10 Ca 0.54 -3.78 0.00 0.00 0.48 0.00 0.00 55.95 53.19 1kn7 s SER 10 Cb -0.10 -1.84 0.00 0.00 0.10 0.00 0.00 66.02 64.18 1kn7 s SER 10 CO 0.64 -0.15 0.00 -1.20 0.98 0.00 0.00 173.24 173.51 1kn7 n SER 11 N 2.21 -6.77 -0.15 7.02 7.64 -1.26 -4.16 113.62 118.15 1kn7 n SER 11 Ca 0.21 0.76 -0.04 0.00 1.01 0.00 0.00 58.87 60.82 1kn7 n SER 11 Cb 0.36 -3.94 0.03 0.00 -1.01 0.00 0.00 64.21 59.65 1kn7 n SER 11 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 1kn7 h GLY 12 N -1.28 0.32 -5.94 0.23 0.00 -2.05 -3.46 103.07 90.89 1kn7 h GLY 12 Ca -0.06 0.16 -0.23 0.00 0.00 0.00 0.00 47.33 47.21 1kn7 h GLY 12 CO 0.03 -0.18 -0.53 0.00 0.00 0.00 0.00 176.54 175.87 1kn7 n ASN 14 N -2.24 3.88 -2.81 0.00 3.02 -1.26 -4.94 115.26 110.91 1kn7 n ASN 14 Ca -0.12 -2.81 -0.00 0.00 -0.03 0.00 0.00 54.58 51.62 1kn7 n ASN 14 Cb 0.58 -0.67 -0.00 0.00 -0.61 0.00 0.00 39.78 39.08 1kn7 n ASN 14 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1kn7 n SER 15 N -0.01 -7.25 -2.15 6.41 7.64 -1.26 -4.83 113.62 112.17 1kn7 n SER 15 Ca 0.28 1.24 -0.22 0.00 1.01 0.00 0.00 58.87 61.17 1kn7 n SER 15 Cb 1.05 -4.59 0.01 0.00 -1.01 0.00 0.00 64.21 59.68 1kn7 n SER 15 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1kn7 n HIS 16 N 0.92 1.78 -1.27 1.43 1.44 -1.26 -4.95 115.22 113.31 1kn7 n HIS 16 Ca -0.03 -2.09 -0.31 0.00 -2.01 0.00 0.00 57.72 53.28 1kn7 n HIS 16 Cb 0.14 -1.15 -0.14 0.00 0.12 0.00 0.00 29.99 28.96 1kn7 n HIS 16 CO 0.00 0.00 0.00 -1.33 -2.81 0.00 0.00 176.34 172.20 1kn7 n MET 17 N 0.35 0.00 -2.46 -1.40 2.81 -1.26 -4.80 117.12 110.36 1kn7 n MET 17 Ca 0.40 0.00 -0.42 0.00 -1.81 0.00 0.00 57.70 55.87 1kn7 n MET 17 Cb 0.57 -1.18 -0.03 0.00 -0.71 0.00 0.00 33.22 31.87 1kn7 n MET 17 CO 0.00 0.00 0.00 -1.25 1.51 0.00 0.00 175.97 176.23 1kn7 s PRO 18 N 7.25 4.45 -1.10 0.03 0.04 -1.26 -4.89 135.00 139.52 1kn7 s PRO 18 Ca 1.14 1.72 -0.26 0.00 0.04 0.00 0.00 61.00 63.64 1kn7 s PRO 18 Cb -0.99 -3.37 -0.22 0.00 0.04 0.00 0.00 34.50 29.96 1kn7 s PRO 18 CO 0.43 -0.24 2.10 -0.47 0.04 0.00 0.00 177.00 178.87 1kn7 s TYR 19 N 1.10 1.27 0.00 0.56 5.04 -1.26 -4.04 117.35 120.02 1kn7 s TYR 19 Ca 0.58 2.19 0.00 0.00 -2.44 0.00 0.00 57.07 57.39 1kn7 s TYR 19 Cb -0.28 -3.37 0.00 0.00 0.35 0.00 0.00 41.96 38.66 1kn7 s TYR 19 CO 0.29 -0.69 0.00 0.41 -1.34 0.00 0.00 175.55 174.22 1kn7 n GLY 20 N 6.11 0.80 0.22 8.97 0.00 -1.26 -4.94 105.19 115.09 1kn7 n GLY 20 Ca 0.42 0.33 0.13 0.00 0.00 0.00 0.00 46.02 46.89 1kn7 n GLY 20 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 173.32 173.42 1kn7 h TYR 21 N 0.00 0.00 -0.37 1.61 -0.00 -2.01 0.12 116.97 116.32 1kn7 h TYR 21 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 58.73 58.68 1kn7 h TYR 21 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 36.73 36.71 1kn7 h TYR 21 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 178.16 178.16 1kn7 h ALA 22 N 1.70 1.31 -0.31 0.10 0.00 -1.92 0.02 119.26 120.16 1kn7 h ALA 22 Ca 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1kn7 h ALA 22 Cb 0.24 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1kn7 h ALA 22 CO 0.00 0.47 0.00 0.00 0.00 0.00 0.00 179.25 179.72 1kn7 n ALA 23 N -2.48 2.72 1.41 0.00 0.00 0.40 -3.58 120.51 118.99 1kn7 n ALA 23 Ca 0.02 -0.70 0.14 0.00 0.00 0.00 0.00 53.44 52.89 1kn7 n ALA 23 Cb 0.26 -1.01 0.48 0.00 0.00 0.00 0.00 19.45 19.17 1kn7 n ALA 23 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 1kn7 n GLN 24 N 0.41 1.37 0.33 0.00 -0.06 -0.01 -3.83 117.38 115.59 1kn7 n GLN 24 Ca 0.12 -0.79 0.22 0.00 -2.00 0.00 0.00 57.00 54.54 1kn7 n GLN 24 Cb 0.44 -1.48 1.15 0.00 -4.06 0.00 0.00 30.24 26.29 1kn7 n GLN 24 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1kn7 h ALA 25 N 4.11 1.05 -0.03 1.69 0.00 -1.70 0.94 119.26 125.32 1kn7 h ALA 25 Ca 0.00 -0.00 -0.14 0.00 0.00 0.00 0.00 54.91 54.77 1kn7 h ALA 25 Cb 0.50 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 1kn7 h ALA 25 CO 0.00 0.00 -0.61 -0.09 0.00 0.00 0.00 179.25 178.55 1kn7 h ARG 26 N 0.00 0.11 -0.04 0.00 1.12 -1.89 -2.81 114.38 110.87 1kn7 h ARG 26 Ca -0.00 -0.08 -0.11 0.00 -1.11 0.00 0.00 59.98 58.68 1kn7 h ARG 26 Cb 0.04 0.01 -0.01 0.00 -0.01 0.00 0.00 29.97 30.00 1kn7 h ARG 26 CO 0.00 0.69 -0.49 0.00 -3.11 0.00 0.00 179.97 177.06 1kn7 h ALA 27 N 1.30 1.12 -0.08 2.80 0.00 -1.08 -2.50 119.26 120.81 1kn7 h ALA 27 Ca -0.01 -0.45 -0.02 0.00 0.00 0.00 0.00 54.91 54.43 1kn7 h ALA 27 Cb 1.09 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.79 1kn7 h ALA 27 CO 0.09 0.63 -0.04 -0.09 0.00 0.00 0.00 179.25 179.83 1kn7 h ARG 28 N 0.08 0.12 0.00 0.00 2.43 -1.39 1.53 114.38 117.14 1kn7 h ARG 28 Ca 0.00 -0.02 -0.11 0.00 -0.81 0.00 0.00 59.98 59.04 1kn7 h ARG 28 Cb 0.89 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.40 1kn7 h ARG 28 CO 0.07 0.17 -0.60 1.49 -1.51 0.00 0.00 179.97 179.59 1kn7 h GLU 29 N 0.12 0.00 0.00 0.20 4.81 -1.46 -3.19 114.58 115.05 1kn7 h GLU 29 Ca 0.03 0.00 -0.26 0.00 -0.13 0.00 0.00 59.36 59.00 1kn7 h GLU 29 Cb 0.16 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.49 1kn7 h GLU 29 CO 0.01 0.49 -1.63 0.54 -0.73 0.00 0.00 179.01 177.69 1kn7 n ARG 30 N -3.19 0.63 0.27 1.92 5.12 -0.33 -3.82 116.66 117.25 1kn7 n ARG 30 Ca 0.01 0.28 0.14 0.00 -1.93 0.00 0.00 57.85 56.35 1kn7 n ARG 30 Cb 0.75 -1.80 0.72 0.00 -1.16 0.00 0.00 32.46 30.97 1kn7 n ARG 30 CO 0.00 0.00 0.00 1.49 -1.93 0.00 0.00 177.63 177.19 1kn7 h GLU 31 N 0.00 0.00 -0.05 5.56 4.81 0.21 -2.14 114.58 122.97 1kn7 h GLU 31 Ca -0.25 0.00 0.01 0.00 -0.13 0.00 0.00 59.36 58.99 1kn7 h GLU 31 Cb 1.90 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 31.27 1kn7 h GLU 31 CO 0.07 0.11 0.04 -0.09 -0.73 0.00 0.00 179.01 178.40 1kn7 h ARG 32 N 0.00 0.00 0.00 1.92 9.65 -1.65 0.26 114.38 124.56 1kn7 h ARG 32 Ca -0.00 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 1kn7 h ARG 32 Cb 0.42 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.00 1kn7 h ARG 32 CO 0.01 0.00 -0.67 -0.11 2.80 0.00 0.00 179.97 182.00 1kn7 n LEU 33 N -4.42 0.63 -0.13 3.80 0.00 -0.81 -3.46 117.00 112.61 1kn7 n LEU 33 Ca -0.02 0.13 0.09 0.00 0.00 0.00 0.00 56.01 56.22 1kn7 n LEU 33 Cb 0.14 -0.18 0.47 0.00 0.00 0.00 0.00 43.42 43.85 1kn7 n LEU 33 CO 0.33 0.00 0.81 0.00 0.00 0.00 0.00 177.39 178.53 1kn7 n ALA 34 N -1.75 2.58 0.80 1.96 0.00 0.92 -2.79 120.51 122.22 1kn7 n ALA 34 Ca 0.04 -0.20 0.12 0.00 0.00 0.00 0.00 53.44 53.39 1kn7 n ALA 34 Cb 0.42 -1.23 0.18 0.00 0.00 0.00 0.00 19.45 18.81 1kn7 n ALA 34 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.50 175.11 1kn7 n HIS 35 N -0.51 0.21 0.11 0.00 1.44 -1.12 -3.64 115.22 111.70 1kn7 n HIS 35 Ca 0.13 0.06 0.12 0.00 -2.01 0.00 0.00 57.72 56.02 1kn7 n HIS 35 Cb 0.12 -0.39 0.00 0.00 0.12 0.00 0.00 29.99 29.84 1kn7 n HIS 35 CO 0.00 0.00 0.00 0.43 -2.81 0.00 0.00 176.34 173.96 1kn7 n SER 36 N -1.76 0.85 -0.79 4.39 7.64 -1.12 -3.63 113.62 119.21 1kn7 n SER 36 Ca 0.04 0.33 0.06 0.00 1.01 0.00 0.00 58.87 60.31 1kn7 n SER 36 Cb 0.38 0.44 0.17 0.00 -1.01 0.00 0.00 64.21 64.20 1kn7 n SER 36 CO 0.00 0.00 0.00 -1.14 -3.01 0.00 0.00 175.04 170.89 1kn7 n ARG 37 N -2.68 2.08 -0.06 1.43 0.63 -1.24 -3.99 116.66 112.84 1kn7 n ARG 37 Ca 0.00 -1.40 -0.14 0.00 -0.92 0.00 0.00 57.85 55.40 1kn7 n ARG 37 Cb 0.55 -1.41 -0.12 0.00 0.45 0.00 0.00 32.46 31.93 1kn7 n ARG 37 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1kn7 h ALA 38 N 3.56 -0.00 0.11 5.13 0.00 -1.71 -3.04 119.26 123.31 1kn7 h ALA 38 Ca 0.00 -0.46 -0.01 0.00 0.00 0.00 0.00 54.91 54.44 1kn7 h ALA 38 Cb 0.65 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.44 1kn7 h ALA 38 CO 0.05 -0.03 -0.06 0.00 0.00 0.00 0.00 179.25 179.21 1kn7 h ALA 39 N 0.04 -0.15 -0.66 0.00 0.00 -1.81 -3.26 119.26 113.42 1kn7 h ALA 39 Ca -0.00 -0.20 0.06 0.00 0.00 0.00 0.00 54.91 54.77 1kn7 h ALA 39 Cb 0.92 0.06 -0.09 0.00 0.00 0.00 0.00 17.79 18.69 1kn7 h ALA 39 CO 0.00 -0.37 -0.45 0.00 0.00 0.00 0.00 179.25 178.43 1kn7 h ALA 40 N 0.23 -0.48 -5.04 0.00 0.00 -1.72 -3.46 119.26 108.79 1kn7 h ALA 40 Ca -0.02 0.07 -0.18 0.00 0.00 0.00 0.00 54.91 54.78 1kn7 h ALA 40 Cb 0.46 1.23 0.15 0.00 0.00 0.00 0.00 17.79 19.63 1kn7 h ALA 40 CO 0.03 -0.78 -0.63 0.00 0.00 0.00 0.00 179.25 177.87 1kn7 n ALA 41 N -3.14 -2.18 -0.09 0.00 0.00 -1.15 -4.98 120.51 108.96 1kn7 n ALA 41 Ca 0.01 0.10 -0.10 0.00 0.00 0.00 0.00 53.44 53.45 1kn7 n ALA 41 Cb 0.21 -4.48 -0.03 0.00 0.00 0.00 0.00 19.45 15.15 1kn7 n ALA 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1kn7 n ALA 42 N -2.78 0.96 0.13 0.00 0.00 -1.26 -2.87 120.51 114.69 1kn7 n ALA 42 Ca -0.05 -0.81 0.18 0.00 0.00 0.00 0.00 53.44 52.76 1kn7 n ALA 42 Cb 0.59 0.04 0.61 0.00 0.00 0.00 0.00 19.45 20.69 1kn7 n ALA 42 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1kn7 h ALA 43 N -0.97 2.05 0.01 0.00 0.00 -1.94 1.46 119.26 119.87 1kn7 h ALA 43 Ca -0.04 -0.01 -0.33 0.00 0.00 0.00 0.00 54.91 54.53 1kn7 h ALA 43 Cb 1.01 0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.77 1kn7 h ALA 43 CO -0.02 -0.82 -2.04 0.28 0.00 0.00 0.00 179.25 176.65 1kn7 n VAL 44 N -3.23 1.53 -0.40 0.00 0.31 -1.26 -3.73 118.33 111.54 1kn7 n VAL 44 Ca 0.07 -0.80 0.36 0.00 -0.01 0.00 0.00 64.34 63.95 1kn7 n VAL 44 Cb 0.78 -0.86 0.70 0.00 -0.91 0.00 0.00 33.84 33.54 1kn7 n VAL 44 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1kn7 h ALA 45 N 0.90 2.99 0.05 3.52 0.00 0.22 1.78 119.26 128.72 1kn7 h ALA 45 Ca -0.41 0.00 -0.30 0.00 0.00 0.00 0.00 54.91 54.20 1kn7 h ALA 45 Cb 2.11 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 19.97 1kn7 h ALA 45 CO 0.05 -1.42 -1.63 0.00 0.00 0.00 0.00 179.25 176.25 1kn7 h ALA 46 N 1.42 0.54 -0.31 0.00 0.00 -1.65 -3.27 119.26 115.99 1kn7 h ALA 46 Ca 0.67 -1.30 0.00 0.00 0.00 0.00 0.00 54.91 54.28 1kn7 h ALA 46 Cb 2.39 0.40 0.00 0.00 0.00 0.00 0.00 17.79 20.58 1kn7 h ALA 46 CO -0.13 1.39 0.00 0.00 0.00 0.00 0.00 179.25 180.50 1kn7 n ALA 47 N -2.63 3.07 -1.07 0.00 0.00 0.49 -4.94 120.51 115.42 1kn7 n ALA 47 Ca -0.17 -0.92 -0.47 0.00 0.00 0.00 0.00 53.44 51.88 1kn7 n ALA 47 Cb 1.04 -1.05 -0.10 0.00 0.00 0.00 0.00 19.45 19.34 1kn7 n ALA 47 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1kn7 n THR 48 N 0.38 0.00 -1.69 0.00 -1.04 0.49 -4.66 114.28 107.75 1kn7 n THR 48 Ca 0.14 0.00 -0.56 0.00 -2.04 0.00 0.00 64.05 61.59 1kn7 n THR 48 Cb 0.66 -0.41 -0.07 0.00 -1.82 0.00 0.00 70.33 68.69 1kn7 n THR 48 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1kn7 n ALA 49 N 6.65 -0.24 -1.23 2.41 0.00 -1.26 -4.78 120.51 122.06 1kn7 n ALA 49 Ca 0.47 0.40 -0.19 0.00 0.00 0.00 0.00 53.44 54.13 1kn7 n ALA 49 Cb -0.02 -2.22 -0.12 0.00 0.00 0.00 0.00 19.45 17.09 1kn7 n ALA 49 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1kn7 n ALA 50 N 4.90 6.42 -2.89 0.00 0.00 -1.26 -4.21 120.51 123.47 1kn7 n ALA 50 Ca 0.25 -2.39 -0.13 0.00 0.00 0.00 0.00 53.44 51.17 1kn7 n ALA 50 Cb 0.15 -2.24 0.00 0.00 0.00 0.00 0.00 19.45 17.37 1kn7 n ALA 50 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1kn7 n VAL 51 N 1.76 0.50 -4.14 0.00 0.31 -1.26 -5.10 118.33 110.39 1kn7 n VAL 51 Ca 0.46 -3.71 -0.30 0.00 -0.01 0.00 0.00 64.34 60.79 1kn7 n VAL 51 Cb 0.75 0.27 -0.08 0.00 -0.91 0.00 0.00 33.84 33.87 1kn7 n VAL 51 CO 0.00 0.00 0.00 -0.70 -1.32 0.00 0.00 176.83 174.81 1kn7 s GLU 52 N -2.83 2.49 -0.02 5.55 2.12 -1.26 -4.88 118.70 119.87 1kn7 s GLU 52 Ca 0.33 -0.89 -0.00 0.00 0.36 0.00 0.00 54.97 54.77 1kn7 s GLU 52 Cb 0.41 -2.50 0.00 0.00 0.26 0.00 0.00 34.13 32.31 1kn7 s GLU 52 CO -0.01 0.53 0.00 0.41 -0.54 0.00 0.00 175.26 175.65 1kn7 n GLY 53 N 0.48 -2.95 3.69 -1.50 0.00 -1.26 -4.86 105.19 98.79 1kn7 n GLY 53 Ca -0.11 -0.19 -0.65 0.00 0.00 0.00 0.00 46.02 45.07 1kn7 n GLY 53 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1kn7 n THR 54 N 0.06 0.07 -1.64 2.61 5.66 -1.26 -4.77 114.28 115.01 1kn7 n THR 54 Ca -0.00 -0.02 -0.46 0.00 -3.05 0.00 0.00 64.05 60.52 1kn7 n THR 54 Cb 0.00 -0.67 -0.03 0.00 -1.55 0.00 0.00 70.33 68.08 1kn7 n THR 54 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1kn7 n GLY 55 N 4.45 0.41 3.41 1.09 0.00 -1.26 -4.99 105.19 108.31 1kn7 n GLY 55 Ca 0.33 0.47 -0.20 0.00 0.00 0.00 0.00 46.02 46.61 1kn7 n GLY 55 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1kn7 s GLY 56 N 0.04 1.83 -0.24 -0.02 0.00 -1.26 -5.13 107.32 102.54 1kn7 s GLY 56 Ca 0.67 -1.91 -0.06 0.00 0.00 0.00 0.00 44.72 43.42 1kn7 s GLY 56 CO 0.53 -1.80 0.02 -1.35 0.00 0.00 0.00 173.10 170.50 1kn7 s SER 57 N -3.42 4.74 0.00 1.64 1.04 -1.26 -5.08 113.70 111.35 1kn7 s SER 57 Ca 0.31 -0.31 0.00 0.00 0.48 0.00 0.00 55.95 56.43 1kn7 s SER 57 Cb 0.05 -1.83 0.00 0.00 0.10 0.00 0.00 66.02 64.34 1kn7 s SER 57 CO 0.12 -0.03 0.00 0.61 0.98 0.00 0.00 173.24 174.92 1kn7 n GLY 58 N 4.86 6.02 0.00 7.32 0.00 -1.26 -5.12 105.19 117.01 1kn7 n GLY 58 Ca -0.17 -2.12 0.00 0.00 0.00 0.00 0.00 46.02 43.73 1kn7 n GLY 58 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1kn7 n GLY 59 N 5.00 1.43 2.78 -0.02 0.00 -1.26 -5.13 105.19 107.99 1kn7 n GLY 59 Ca 0.00 -0.19 -0.30 0.00 0.00 0.00 0.00 46.02 45.53 1kn7 n GLY 59 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1kn7 s GLY 60 N 0.00 1.41 0.64 -0.02 0.00 -1.26 -5.12 107.32 102.97 1kn7 s GLY 60 Ca 0.00 -2.10 -0.13 0.00 0.00 0.00 0.00 44.72 42.49 1kn7 s GLY 60 CO 0.00 1.47 1.05 2.56 0.00 0.00 0.00 173.10 178.19 1kn7 s PRO 61 N 1.12 3.15 0.13 2.90 0.04 -1.26 -5.07 135.00 136.02 1kn7 s PRO 61 Ca 0.12 1.06 -0.25 0.00 0.04 0.00 0.00 61.00 61.97 1kn7 s PRO 61 Cb -0.20 -2.01 0.07 0.00 0.04 0.00 0.00 34.50 32.40 1kn7 s PRO 61 CO -0.15 -0.94 0.92 -1.58 0.04 0.00 0.00 177.00 175.29 1kn7 s HIS 62 N -2.78 -0.19 -0.39 0.56 2.46 -1.26 -5.05 115.29 108.64 1kn7 s HIS 62 Ca 0.60 -0.10 -0.24 0.00 0.47 0.00 0.00 55.06 55.80 1kn7 s HIS 62 Cb -0.15 0.62 0.03 0.00 -0.13 0.00 0.00 32.58 32.96 1kn7 s HIS 62 CO 0.46 -0.81 0.53 1.58 -2.47 0.00 0.00 174.74 174.04 1kn7 n HIS 63 N -0.43 -2.87 -0.06 3.88 -0.00 -1.26 -4.97 115.22 109.52 1kn7 n HIS 63 Ca -0.07 1.19 -0.05 0.00 -0.00 0.00 0.00 57.72 58.79 1kn7 n HIS 63 Cb 0.61 -2.77 -0.02 0.00 -0.00 0.00 0.00 29.99 27.81 1kn7 n HIS 63 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92 1kn7 n HIS 64 N -0.02 0.44 -2.01 1.57 -0.00 -1.26 -5.10 115.22 108.85 1kn7 n HIS 64 Ca 0.01 0.19 0.00 0.00 0.46 0.00 0.00 57.72 58.38 1kn7 n HIS 64 Cb 0.53 -0.54 0.00 0.00 -0.12 0.00 0.00 29.99 29.86 1kn7 n HIS 64 CO 0.00 0.00 0.00 1.58 0.46 0.00 0.00 176.34 178.38 1kn7 n HIS 65 N -3.98 -3.98 -4.55 1.57 -0.00 -1.26 -5.08 115.22 97.94 1kn7 n HIS 65 Ca -0.07 2.38 -0.27 0.00 0.46 0.00 0.00 57.72 60.22 1kn7 n HIS 65 Cb 0.26 -3.47 -0.08 0.00 -0.12 0.00 0.00 29.99 26.58 1kn7 n HIS 65 CO 0.00 0.00 0.00 -1.14 0.46 0.00 0.00 176.34 175.66 1kn7 s GLN 66 N -0.94 1.96 1.28 1.57 0.74 -1.26 -5.15 119.66 117.87 1kn7 s GLN 66 Ca 0.00 -2.20 -0.16 0.00 0.05 0.00 0.00 55.36 53.05 1kn7 s GLN 66 Cb 0.00 -0.77 0.33 0.00 1.10 0.00 0.00 33.01 33.67 1kn7 s GLN 66 CO 0.00 -0.45 0.98 0.99 -0.55 0.00 0.00 175.29 176.26 1kn7 s THR 67 N -3.16 1.75 0.94 -0.34 2.01 -1.26 -4.90 115.64 110.69 1kn7 s THR 67 Ca 0.21 0.00 -0.17 0.00 0.31 0.00 0.00 61.69 62.05 1kn7 s THR 67 Cb 0.03 -2.00 -0.13 0.00 0.01 0.00 0.00 72.50 70.41 1kn7 s THR 67 CO 0.13 0.00 -0.57 -2.11 -0.69 0.00 0.00 174.62 171.38 1kn7 n ARG 68 N -5.29 -0.03 -0.06 4.92 1.85 -1.26 -4.96 116.66 111.83 1kn7 n ARG 68 Ca 0.05 -0.00 -0.08 0.00 -1.00 0.00 0.00 57.85 56.82 1kn7 n ARG 68 Cb 0.56 -1.12 -0.03 0.00 -1.05 0.00 0.00 32.46 30.82 1kn7 n ARG 68 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1kn7 n GLY 69 N 3.13 -0.44 3.15 2.89 0.00 -1.26 -5.04 105.19 107.62 1kn7 n GLY 69 Ca 0.00 -0.26 0.05 0.00 0.00 0.00 0.00 46.02 45.82 1kn7 n GLY 69 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1kn7 s ALA 70 N -2.72 -3.61 -0.08 4.61 0.00 -1.26 -5.15 121.76 113.54 1kn7 s ALA 70 Ca -0.23 1.38 0.02 0.00 0.00 0.00 0.00 51.96 53.12 1kn7 s ALA 70 Cb 0.03 -2.65 0.02 0.00 0.00 0.00 0.00 23.12 20.52 1kn7 s ALA 70 CO 0.34 -1.79 -0.12 0.71 0.00 0.00 0.00 175.76 174.91 1kn7 s TYR 71 N 2.94 1.56 0.12 0.00 1.51 -1.26 -5.13 117.35 117.09 1kn7 s TYR 71 Ca 0.14 -0.66 -0.07 0.00 -1.01 0.00 0.00 57.07 55.47 1kn7 s TYR 71 Cb -0.06 -1.17 -0.01 0.00 -0.11 0.00 0.00 41.96 40.60 1kn7 s TYR 71 CO -0.18 -0.37 0.18 -1.54 -1.11 0.00 0.00 175.55 172.53 1kn7 s SER 72 N 0.96 0.16 0.14 2.29 1.04 -1.26 -5.18 113.70 111.85 1kn7 s SER 72 Ca -0.09 -0.84 -0.19 0.00 0.48 0.00 0.00 55.95 55.31 1kn7 s SER 72 Cb -0.15 0.35 0.05 0.00 0.10 0.00 0.00 66.02 66.37 1kn7 s SER 72 CO 0.00 -0.77 0.49 -0.55 0.98 0.00 0.00 173.24 173.39 1kn7 s SER 73 N -2.93 -0.39 -0.50 7.02 0.15 -1.26 -5.11 113.70 110.69 1kn7 s SER 73 Ca 0.12 -0.15 0.06 0.00 0.70 0.00 0.00 55.95 56.68 1kn7 s SER 73 Cb 0.05 0.53 0.23 0.00 -1.71 0.00 0.00 66.02 65.12 1kn7 s SER 73 CO -0.05 -0.90 0.85 1.57 1.20 0.00 0.00 173.24 175.91 1kn7 n HIS 74 N -0.26 -3.46 1.94 3.44 -0.00 -1.26 -5.38 115.22 110.24 1kn7 n HIS 74 Ca -0.17 -1.65 0.16 0.00 0.46 0.00 0.00 57.72 56.52 1kn7 n HIS 74 Cb 0.64 1.55 0.92 0.00 -0.12 0.00 0.00 29.99 32.98 1kn7 n HIS 74 CO 0.00 0.00 0.00 -0.25 0.46 0.00 0.00 176.34 176.55