#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kt8 n GLU 2 N 0.00 -5.34 -4.11 0.00 2.13 -1.26 -5.05 120.64 107.01 2kt8 n GLU 2 Ca 0.00 3.77 -0.11 0.00 0.66 0.00 0.00 57.16 61.48 2kt8 n GLU 2 Cb 0.00 -4.12 -0.11 0.00 0.27 0.00 0.00 31.44 27.48 2kt8 n GLU 2 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 2kt8 s LYS 3 N -0.71 0.67 -0.09 5.31 1.02 -1.10 -4.86 119.74 119.97 2kt8 s LYS 3 Ca 0.00 -1.07 0.02 0.00 0.02 0.00 0.00 55.97 54.94 2kt8 s LYS 3 Cb 0.00 -0.19 0.01 0.00 -0.52 0.00 0.00 37.83 37.14 2kt8 s LYS 3 CO 0.00 -0.00 -0.14 0.95 -0.92 0.00 0.00 175.35 175.24 2kt8 s THR 4 N -2.70 1.33 -0.14 2.17 -4.23 -1.26 0.53 115.64 111.35 2kt8 s THR 4 Ca 0.02 -0.56 -0.16 0.00 -1.18 0.00 0.00 61.69 59.82 2kt8 s THR 4 Cb -0.01 -1.23 -0.04 0.00 1.34 0.00 0.00 72.50 72.56 2kt8 s THR 4 CO -0.03 0.41 0.37 -0.83 -0.54 0.00 0.00 174.62 174.00 2kt8 s GLY 5 N 0.93 2.30 -0.26 3.99 0.00 -0.69 -1.30 107.32 112.28 2kt8 s GLY 5 Ca -0.09 -0.34 -0.17 0.00 0.00 0.00 0.00 44.72 44.13 2kt8 s GLY 5 CO 0.00 0.55 0.46 -0.42 0.00 0.00 0.00 173.10 173.69 2kt8 s ILE 6 N 0.45 5.12 0.10 0.90 1.09 -1.11 -2.58 121.20 125.17 2kt8 s ILE 6 Ca 0.21 0.76 -0.30 0.00 -1.10 0.00 0.00 60.65 60.22 2kt8 s ILE 6 Cb -0.14 -3.78 -0.06 0.00 -1.06 0.00 0.00 42.46 37.42 2kt8 s ILE 6 CO 0.07 0.13 1.10 -0.69 -0.10 0.00 0.00 174.94 175.44 2kt8 s VAL 7 N 2.13 4.15 -0.43 2.92 1.01 -1.06 -2.66 120.40 126.46 2kt8 s VAL 7 Ca 0.19 1.69 0.02 0.00 0.00 0.00 0.00 61.98 63.88 2kt8 s VAL 7 Cb -0.16 -4.08 0.15 0.00 0.00 0.00 0.00 36.38 32.29 2kt8 s VAL 7 CO 0.09 0.21 0.29 0.21 0.00 0.00 0.00 175.10 175.90 2kt8 s ASN 8 N 0.45 2.88 -0.04 3.32 2.47 -1.08 -1.22 114.94 121.71 2kt8 s ASN 8 Ca 0.52 -2.76 0.02 0.00 0.42 0.00 0.00 52.86 51.06 2kt8 s ASN 8 Cb -0.27 -0.72 0.01 0.00 -1.45 0.00 0.00 41.25 38.81 2kt8 s ASN 8 CO 0.31 -0.23 -0.10 0.68 -3.72 0.00 0.00 177.10 174.04 2kt8 s VAL 9 N 0.28 0.93 0.20 -5.21 -7.23 -1.26 -4.93 120.40 103.18 2kt8 s VAL 9 Ca 0.23 -0.40 -0.10 0.00 -1.81 0.00 0.00 61.98 59.90 2kt8 s VAL 9 Cb -0.13 -0.85 0.13 0.00 0.56 0.00 0.00 36.38 36.09 2kt8 s VAL 9 CO -0.08 0.30 1.79 0.28 -0.31 0.00 0.00 175.10 177.08 2kt8 h SER 10 N 6.67 0.95 0.00 4.85 0.02 -2.01 -3.39 113.55 120.64 2kt8 h SER 10 Ca -0.33 -0.14 0.00 0.00 -0.84 0.00 0.00 61.79 60.48 2kt8 h SER 10 Cb 1.17 -0.24 0.00 0.00 0.14 0.00 0.00 62.40 63.47 2kt8 h SER 10 CO 0.48 0.82 0.00 -1.54 -1.14 0.00 0.00 176.83 175.45 2kt8 n SER 11 N -4.41 0.00 -3.69 3.07 3.41 -1.26 -5.00 113.62 105.74 2kt8 n SER 11 Ca 0.06 0.00 -0.05 0.00 -0.26 0.00 0.00 58.87 58.62 2kt8 n SER 11 Cb 0.13 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.07 2kt8 n SER 11 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2kt8 s SER 12 N -1.00 -0.24 -0.08 4.04 0.15 -1.26 -4.57 113.70 110.74 2kt8 s SER 12 Ca 0.00 -0.31 0.05 0.00 0.70 0.00 0.00 55.95 56.39 2kt8 s SER 12 Cb 0.00 0.49 -0.01 0.00 -1.71 0.00 0.00 66.02 64.79 2kt8 s SER 12 CO 0.00 -0.87 -0.24 -0.22 1.20 0.00 0.00 173.24 173.10 2kt8 s LEU 13 N -2.83 2.09 0.27 3.45 2.96 -0.99 -4.94 118.68 118.70 2kt8 s LEU 13 Ca 0.10 -0.53 -0.07 0.00 -0.22 0.00 0.00 54.13 53.41 2kt8 s LEU 13 Cb -0.02 -1.40 -0.06 0.00 0.50 0.00 0.00 46.19 45.22 2kt8 s LEU 13 CO -0.01 0.20 0.57 0.20 -1.32 0.00 0.00 176.35 175.99 2kt8 s ASN 14 N 0.11 6.52 -0.17 3.68 0.01 -1.26 -0.74 114.94 123.08 2kt8 s ASN 14 Ca -0.12 0.82 -0.07 0.00 -0.71 0.00 0.00 52.86 52.78 2kt8 s ASN 14 Cb -0.16 -2.19 -0.04 0.00 0.41 0.00 0.00 41.25 39.27 2kt8 s ASN 14 CO 0.06 -0.16 0.07 -0.69 -1.51 0.00 0.00 177.10 174.87 2kt8 s VAL 15 N -2.00 4.85 -0.11 1.60 1.01 -0.52 -4.85 120.40 120.37 2kt8 s VAL 15 Ca 0.46 -0.02 -0.01 0.00 0.00 0.00 0.00 61.98 62.41 2kt8 s VAL 15 Cb -0.11 -3.17 -0.03 0.00 0.00 0.00 0.00 36.38 33.07 2kt8 s VAL 15 CO 0.27 0.48 -0.07 -0.13 0.00 0.00 0.00 175.10 175.65 2kt8 s ARG 16 N 0.22 3.19 0.19 2.72 0.52 -1.04 -2.90 118.95 121.86 2kt8 s ARG 16 Ca 0.04 -0.56 -0.03 0.00 -0.52 0.00 0.00 55.73 54.66 2kt8 s ARG 16 Cb -0.12 -2.72 0.12 0.00 0.52 0.00 0.00 34.95 32.75 2kt8 s ARG 16 CO 0.00 0.44 1.51 1.49 0.02 0.00 0.00 175.30 178.76 2kt8 h GLU 17 N 6.01 0.58 0.00 3.54 4.81 -1.66 0.31 114.58 128.17 2kt8 h GLU 17 Ca -0.38 -0.35 -0.29 0.00 -0.13 0.00 0.00 59.36 58.20 2kt8 h GLU 17 Cb 1.19 0.03 0.02 0.00 0.63 0.00 0.00 28.75 30.62 2kt8 h GLU 17 CO 0.57 0.96 -0.03 0.41 -0.73 0.00 0.00 179.01 180.18 2kt8 n GLY 18 N 0.21 1.87 1.25 1.92 0.00 -1.26 -4.56 105.19 104.61 2kt8 n GLY 18 Ca -0.03 -2.18 0.00 0.00 0.00 0.00 0.00 46.02 43.81 2kt8 n GLY 18 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kt8 n ALA 19 N -2.62 3.85 -1.93 4.61 0.00 -1.26 -4.57 120.51 118.60 2kt8 n ALA 19 Ca -0.08 -2.63 -0.27 0.00 0.00 0.00 0.00 53.44 50.46 2kt8 n ALA 19 Cb 0.36 -0.85 0.09 0.00 0.00 0.00 0.00 19.45 19.05 2kt8 n ALA 19 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2kt8 s SER 20 N -1.95 4.50 0.16 0.00 1.04 -1.26 -4.96 113.70 111.23 2kt8 s SER 20 Ca 0.46 0.46 -0.13 0.00 0.48 0.00 0.00 55.95 57.22 2kt8 s SER 20 Cb 0.39 -0.98 0.06 0.00 0.10 0.00 0.00 66.02 65.59 2kt8 s SER 20 CO 0.07 -1.83 1.74 0.74 0.98 0.00 0.00 173.24 174.93 2kt8 h THR 21 N -0.84 1.21 -2.04 2.02 2.02 -2.00 -3.33 112.91 109.94 2kt8 h THR 21 Ca -0.44 -0.61 -0.54 0.00 0.77 0.00 0.00 66.41 65.58 2kt8 h THR 21 Cb 1.31 0.61 -0.40 0.00 -1.74 0.00 0.00 68.15 67.92 2kt8 h THR 21 CO 0.58 0.24 -1.04 -1.54 0.37 0.00 0.00 175.52 174.13 2kt8 n SER 22 N -4.55 1.13 -3.51 4.18 3.41 -1.26 -5.10 113.62 107.92 2kt8 n SER 22 Ca 0.03 -2.95 -0.24 0.00 -0.26 0.00 0.00 58.87 55.44 2kt8 n SER 22 Cb 0.14 -0.63 0.18 0.00 -0.26 0.00 0.00 64.21 63.63 2kt8 n SER 22 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2kt8 n SER 23 N 0.87 -0.45 -4.77 4.04 7.64 -1.25 -4.98 113.62 114.72 2kt8 n SER 23 Ca 0.24 -1.30 -0.41 0.00 1.01 0.00 0.00 58.87 58.41 2kt8 n SER 23 Cb 0.55 -0.84 -0.01 0.00 -1.01 0.00 0.00 64.21 62.90 2kt8 n SER 23 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 2kt8 s LYS 24 N -5.30 4.23 -0.23 1.43 1.02 -1.26 -4.84 119.74 114.78 2kt8 s LYS 24 Ca 0.61 2.40 -0.12 0.00 0.02 0.00 0.00 55.97 58.88 2kt8 s LYS 24 Cb -0.03 -3.03 -0.05 0.00 -0.52 0.00 0.00 37.83 34.21 2kt8 s LYS 24 CO 0.44 -0.38 0.23 0.08 -0.92 0.00 0.00 175.35 174.80 2kt8 s VAL 25 N -0.94 5.31 -1.67 3.17 1.01 -1.26 -1.89 120.40 124.13 2kt8 s VAL 25 Ca 0.53 0.34 0.17 0.00 0.00 0.00 0.00 61.98 63.02 2kt8 s VAL 25 Cb -0.43 -3.57 0.01 0.00 0.00 0.00 0.00 36.38 32.39 2kt8 s VAL 25 CO 0.56 0.31 0.92 2.30 0.00 0.00 0.00 175.10 179.19 2kt8 n ILE 26 N 4.32 0.00 -3.36 2.22 -5.35 -1.14 -4.98 119.36 111.07 2kt8 n ILE 26 Ca -0.13 -0.34 0.00 0.00 -0.27 0.00 0.00 62.75 62.01 2kt8 n ILE 26 Cb 0.52 1.23 0.00 0.00 -1.74 0.00 0.00 39.64 39.64 2kt8 n ILE 26 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2kt8 n GLY 27 N 1.18 -1.16 3.34 3.28 0.00 -1.26 -5.05 105.19 105.52 2kt8 n GLY 27 Ca 0.08 -0.92 -0.13 0.00 0.00 0.00 0.00 46.02 45.04 2kt8 n GLY 27 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2kt8 s SER 28 N -4.00 -0.32 0.13 1.61 0.15 -1.26 -1.44 113.70 108.56 2kt8 s SER 28 Ca 0.00 0.05 0.09 0.00 0.70 0.00 0.00 55.95 56.79 2kt8 s SER 28 Cb 0.00 0.44 -0.04 0.00 -1.71 0.00 0.00 66.02 64.71 2kt8 s SER 28 CO 0.00 -0.67 -0.22 -0.76 1.20 0.00 0.00 173.24 172.79 2kt8 s LEU 29 N -1.98 2.34 0.76 3.45 1.43 0.08 -4.90 118.68 119.87 2kt8 s LEU 29 Ca -0.05 -0.75 -0.12 0.00 -1.03 0.00 0.00 54.13 52.18 2kt8 s LEU 29 Cb -0.01 -0.96 0.05 0.00 0.03 0.00 0.00 46.19 45.30 2kt8 s LEU 29 CO -0.02 0.07 1.13 -0.55 0.23 0.00 0.00 176.35 177.20 2kt8 s SER 30 N -2.15 4.93 0.81 2.29 0.15 -1.26 -2.34 113.70 116.13 2kt8 s SER 30 Ca 0.11 1.03 -0.11 0.00 0.70 0.00 0.00 55.95 57.67 2kt8 s SER 30 Cb -0.09 -1.71 0.08 0.00 -1.71 0.00 0.00 66.02 62.60 2kt8 s SER 30 CO 0.06 -1.66 1.14 -0.83 1.20 0.00 0.00 173.24 173.14 2kt8 s GLY 31 N -4.36 1.84 -1.53 9.45 0.00 -1.26 -3.17 107.32 108.29 2kt8 s GLY 31 Ca 0.60 0.53 -0.03 0.00 0.00 0.00 0.00 44.72 45.82 2kt8 s GLY 31 CO 0.51 0.91 0.33 0.70 0.00 0.00 0.00 173.10 175.55 2kt8 n ASN 32 N -3.57 -5.46 -4.71 1.64 3.02 -0.36 -4.95 115.26 100.87 2kt8 n ASN 32 Ca 0.11 -0.15 -0.37 0.00 -0.03 0.00 0.00 54.58 54.14 2kt8 n ASN 32 Cb 0.52 -4.49 -0.07 0.00 -0.61 0.00 0.00 39.78 35.14 2kt8 n ASN 32 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2kt8 s THR 33 N -3.03 5.25 0.03 3.41 2.01 -1.19 -4.82 115.64 117.30 2kt8 s THR 33 Ca 0.18 0.70 -0.27 0.00 0.31 0.00 0.00 61.69 62.61 2kt8 s THR 33 Cb -0.09 -3.71 -0.05 0.00 0.01 0.00 0.00 72.50 68.67 2kt8 s THR 33 CO 0.23 0.34 0.85 -0.75 -0.69 0.00 0.00 174.62 174.59 2kt8 s LYS 34 N 0.69 4.55 -0.04 4.92 2.20 -1.26 -2.57 119.74 128.22 2kt8 s LYS 34 Ca 0.20 1.20 0.04 0.00 -0.36 0.00 0.00 55.97 57.05 2kt8 s LYS 34 Cb -0.14 -3.40 0.00 0.00 -1.51 0.00 0.00 37.83 32.78 2kt8 s LYS 34 CO 0.07 0.16 -0.15 0.14 -0.36 0.00 0.00 175.35 175.20 2kt8 s VAL 35 N 0.33 1.30 0.00 4.02 -7.23 -1.07 -5.00 120.40 112.75 2kt8 s VAL 35 Ca 0.43 -0.63 -0.30 0.00 -1.81 0.00 0.00 61.98 59.67 2kt8 s VAL 35 Cb -0.21 -1.13 -0.03 0.00 0.56 0.00 0.00 36.38 35.57 2kt8 s VAL 35 CO 0.25 0.38 1.04 -0.89 -0.31 0.00 0.00 175.10 175.57 2kt8 s THR 36 N 0.16 4.65 -0.20 5.32 2.01 -1.26 -1.71 115.64 124.61 2kt8 s THR 36 Ca -0.06 1.90 -0.06 0.00 0.31 0.00 0.00 61.69 63.79 2kt8 s THR 36 Cb -0.12 -4.22 -0.03 0.00 0.01 0.00 0.00 72.50 68.14 2kt8 s THR 36 CO 0.02 0.13 0.03 -0.63 -0.69 0.00 0.00 174.62 173.48 2kt8 s ILE 37 N 1.18 4.26 -0.13 1.82 1.01 0.19 -2.57 121.20 126.95 2kt8 s ILE 37 Ca 0.53 -0.21 0.01 0.00 0.00 0.00 0.00 60.65 60.99 2kt8 s ILE 37 Cb -0.23 -2.93 0.04 0.00 0.01 0.00 0.00 42.46 39.35 2kt8 s ILE 37 CO 0.27 0.43 0.96 1.33 0.00 0.00 0.00 174.94 177.93 2kt8 n VAL 38 N 4.07 0.85 -3.79 2.92 0.24 -1.13 -2.71 118.33 118.77 2kt8 n VAL 38 Ca -0.17 -0.92 0.00 0.00 -2.04 0.00 0.00 64.34 61.21 2kt8 n VAL 38 Cb 0.52 0.58 0.00 0.00 -1.47 0.00 0.00 33.84 33.47 2kt8 n VAL 38 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 2kt8 s GLY 39 N -0.87 -0.20 0.08 7.63 0.00 -1.25 -5.05 107.32 107.67 2kt8 s GLY 39 Ca 0.03 0.21 0.02 0.00 0.00 0.00 0.00 44.72 44.99 2kt8 s GLY 39 CO 0.02 2.08 -0.08 -1.83 0.00 0.00 0.00 173.10 173.29 2kt8 s GLU 40 N -2.38 0.73 0.04 2.90 -1.05 -1.26 -2.34 118.70 115.33 2kt8 s GLU 40 Ca 0.20 -1.10 0.00 0.00 -0.15 0.00 0.00 54.97 53.92 2kt8 s GLU 40 Cb 0.01 -0.30 -0.03 0.00 -0.44 0.00 0.00 34.13 33.37 2kt8 s GLU 40 CO -0.00 0.03 -0.04 -1.21 0.95 0.00 0.00 175.26 174.98 2kt8 s GLU 41 N -2.85 0.48 -0.33 -4.83 0.41 0.90 -4.74 118.70 107.74 2kt8 s GLU 41 Ca 0.03 -0.87 -0.28 0.00 -0.41 0.00 0.00 54.97 53.44 2kt8 s GLU 41 Cb -0.02 0.03 -0.04 0.00 -1.78 0.00 0.00 34.13 32.33 2kt8 s GLU 41 CO -0.02 -0.04 2.03 0.20 -0.49 0.00 0.00 175.26 176.93 2kt8 s GLY 42 N -2.03 0.50 0.00 -1.39 0.00 -1.26 -1.32 107.32 101.83 2kt8 s GLY 42 Ca -0.06 0.35 0.00 0.00 0.00 0.00 0.00 44.72 45.01 2kt8 s GLY 42 CO -0.04 3.58 0.00 0.00 0.00 0.00 0.00 173.10 176.64 2kt8 n ALA 43 N 11.64 0.00 -2.74 3.20 0.00 -1.26 -4.99 120.51 126.37 2kt8 n ALA 43 Ca 0.27 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.61 2kt8 n ALA 43 Cb 0.47 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.86 2kt8 n ALA 43 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 2kt8 s PHE 44 N -3.15 0.01 0.08 0.00 0.40 -0.43 -2.57 117.98 112.33 2kt8 s PHE 44 Ca 0.00 -0.39 0.09 0.00 -0.60 0.00 0.00 56.93 56.04 2kt8 s PHE 44 Cb 0.00 0.06 -0.04 0.00 0.51 0.00 0.00 43.02 43.55 2kt8 s PHE 44 CO 0.00 -0.59 -0.23 0.71 0.70 0.00 0.00 175.22 175.81 2kt8 s TYR 45 N -3.74 2.42 -0.29 0.36 2.02 -0.24 -0.07 117.35 117.81 2kt8 s TYR 45 Ca 0.03 -0.33 -0.19 0.00 -0.37 0.00 0.00 57.07 56.21 2kt8 s TYR 45 Cb 0.03 -1.36 -0.02 0.00 -0.40 0.00 0.00 41.96 40.22 2kt8 s TYR 45 CO -0.11 0.28 0.57 0.21 -1.57 0.00 0.00 175.55 174.93 2kt8 s LYS 46 N -1.73 3.93 0.13 -0.62 2.36 -0.99 -2.79 119.74 120.03 2kt8 s LYS 46 Ca 0.14 0.24 0.07 0.00 -2.55 0.00 0.00 55.97 53.88 2kt8 s LYS 46 Cb -0.10 -3.71 -0.04 0.00 -1.05 0.00 0.00 37.83 32.93 2kt8 s LYS 46 CO 0.06 -0.49 -0.18 0.96 1.55 0.00 0.00 175.35 177.25 2kt8 s ILE 47 N 2.46 1.61 -0.28 5.43 -4.36 -0.73 -2.85 121.20 122.47 2kt8 s ILE 47 Ca 0.23 -1.71 -0.24 0.00 -0.26 0.00 0.00 60.65 58.67 2kt8 s ILE 47 Cb -0.15 -1.62 -0.00 0.00 1.25 0.00 0.00 42.46 41.93 2kt8 s ILE 47 CO 0.11 -0.26 0.80 -0.70 0.24 0.00 0.00 174.94 175.13 2kt8 s GLU 48 N -2.42 4.04 -0.21 0.37 2.12 -1.06 -2.14 118.70 119.41 2kt8 s GLU 48 Ca 0.10 0.71 -0.04 0.00 0.36 0.00 0.00 54.97 56.10 2kt8 s GLU 48 Cb -0.07 -3.70 -0.01 0.00 0.26 0.00 0.00 34.13 30.61 2kt8 s GLU 48 CO 0.05 -0.62 -0.04 -0.47 -0.54 0.00 0.00 175.26 173.63 2kt8 s TYR 49 N 2.92 2.96 0.00 5.30 5.04 -0.91 -4.77 117.35 127.88 2kt8 s TYR 49 Ca 0.33 -0.83 0.00 0.00 -2.44 0.00 0.00 57.07 54.13 2kt8 s TYR 49 Cb -0.14 -2.08 0.00 0.00 0.35 0.00 0.00 41.96 40.09 2kt8 s TYR 49 CO 0.11 -0.47 0.00 1.17 -1.34 0.00 0.00 175.55 175.02 2kt8 n LYS 50 N 4.59 0.00 0.00 4.97 4.81 -1.26 -0.50 118.16 130.77 2kt8 n LYS 50 Ca -0.18 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.26 2kt8 n LYS 50 Cb 0.51 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.56 2kt8 n LYS 50 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2kt8 n GLY 51 N 0.00 0.00 3.94 3.14 0.00 -1.26 -5.08 105.19 105.93 2kt8 n GLY 51 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 2kt8 n GLY 51 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2kt8 s SER 52 N -1.24 5.90 -0.40 1.61 0.01 0.35 -5.03 113.70 114.89 2kt8 s SER 52 Ca 0.00 0.47 -0.26 0.00 1.31 0.00 0.00 55.95 57.47 2kt8 s SER 52 Cb 0.00 -1.72 0.02 0.00 0.21 0.00 0.00 66.02 64.53 2kt8 s SER 52 CO 0.00 -0.71 0.97 -1.00 0.41 0.00 0.00 173.24 172.91 2kt8 s HIS 53 N -2.64 3.02 -0.06 2.43 3.76 -1.26 -2.15 115.29 118.39 2kt8 s HIS 53 Ca 0.48 0.73 -0.07 0.00 -0.15 0.00 0.00 55.06 56.05 2kt8 s HIS 53 Cb -0.10 -3.82 -0.04 0.00 1.11 0.00 0.00 32.58 29.73 2kt8 s HIS 53 CO 0.40 -0.93 0.21 0.20 -0.85 0.00 0.00 174.74 173.76 2kt8 s GLY 54 N 2.01 2.22 -0.02 -2.22 0.00 -0.91 -4.73 107.32 103.67 2kt8 s GLY 54 Ca 0.40 -0.59 0.08 0.00 0.00 0.00 0.00 44.72 44.60 2kt8 s GLY 54 CO 0.22 -0.36 -0.25 -0.19 0.00 0.00 0.00 173.10 172.52 2kt8 s TYR 55 N -1.14 2.25 -0.02 1.90 1.51 0.10 -1.78 117.35 120.17 2kt8 s TYR 55 Ca 0.21 -0.45 0.03 0.00 -1.01 0.00 0.00 57.07 55.84 2kt8 s TYR 55 Cb -0.13 -1.45 -0.00 0.00 -0.11 0.00 0.00 41.96 40.27 2kt8 s TYR 55 CO 0.10 -0.06 -0.09 0.14 -1.11 0.00 0.00 175.55 174.53 2kt8 s VAL 56 N -0.54 0.75 0.47 0.71 -7.23 -1.12 -2.49 120.40 110.95 2kt8 s VAL 56 Ca 0.08 -0.37 -0.24 0.00 -1.81 0.00 0.00 61.98 59.63 2kt8 s VAL 56 Cb -0.10 -0.65 -0.07 0.00 0.56 0.00 0.00 36.38 36.11 2kt8 s VAL 56 CO -0.01 0.23 1.39 0.00 -0.31 0.00 0.00 175.10 176.40 2kt8 s ALA 57 N -0.00 3.14 -0.70 1.32 0.00 -1.26 -1.08 121.76 123.17 2kt8 s ALA 57 Ca 0.00 1.39 0.16 0.00 0.00 0.00 0.00 51.96 53.52 2kt8 s ALA 57 Cb -0.06 -3.57 0.72 0.00 0.00 0.00 0.00 23.12 20.21 2kt8 s ALA 57 CO 0.00 -1.18 1.50 0.36 0.00 0.00 0.00 175.76 176.44 2kt8 n LYS 58 N -0.36 0.09 -0.06 0.00 2.85 -1.06 -2.49 118.16 117.12 2kt8 n LYS 58 Ca 0.06 0.41 -0.06 0.00 -1.05 0.00 0.00 58.31 57.67 2kt8 n LYS 58 Cb 0.43 -1.70 0.14 0.00 -0.65 0.00 0.00 35.03 33.25 2kt8 n LYS 58 CO 0.00 0.00 0.00 1.49 -0.05 0.00 0.00 177.40 178.84 2kt8 h GLU 59 N 0.00 0.69 -0.01 -1.58 4.57 -1.89 -2.88 114.58 113.48 2kt8 h GLU 59 Ca 0.00 -0.25 0.00 0.00 -1.18 0.00 0.00 59.36 57.93 2kt8 h GLU 59 Cb 0.21 -0.04 0.00 0.00 -0.16 0.00 0.00 28.75 28.75 2kt8 h GLU 59 CO 0.00 0.83 -0.39 0.66 -1.18 0.00 0.00 179.01 178.93 2kt8 n TYR 60 N -4.13 0.00 -4.42 0.92 4.01 -1.04 -4.85 117.16 107.64 2kt8 n TYR 60 Ca 0.00 0.00 -0.34 0.00 -0.16 0.00 0.00 57.90 57.41 2kt8 n TYR 60 Cb 0.40 -0.06 -0.13 0.00 -0.31 0.00 0.00 39.34 39.25 2kt8 n TYR 60 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 2kt8 s ILE 61 N -2.50 3.69 0.25 -0.72 -1.09 -1.09 -2.65 121.20 117.10 2kt8 s ILE 61 Ca 0.21 -0.43 0.01 0.00 -2.23 0.00 0.00 60.65 58.22 2kt8 s ILE 61 Cb 0.19 -2.61 -0.04 0.00 -1.58 0.00 0.00 42.46 38.42 2kt8 s ILE 61 CO 0.56 0.49 0.19 -1.59 -1.23 0.00 0.00 174.94 173.36 2kt8 s LYS 62 N 0.47 1.41 0.00 2.79 -2.85 -1.09 -4.80 119.74 115.67 2kt8 s LYS 62 Ca -0.05 -1.75 0.00 0.00 -1.00 0.00 0.00 55.97 53.17 2kt8 s LYS 62 Cb -0.15 0.30 0.00 0.00 -2.06 0.00 0.00 37.83 35.92 2kt8 s LYS 62 CO 0.03 -0.49 0.00 -3.47 0.10 0.00 0.00 175.35 171.52 2kt8 n ASP 63 N -0.72 0.00 -3.08 0.03 -0.08 -1.26 -2.75 116.55 108.69 2kt8 n ASP 63 Ca 0.04 0.00 -0.14 0.00 -1.51 0.00 0.00 54.79 53.18 2kt8 n ASP 63 Cb 0.65 0.00 0.06 0.00 2.34 0.00 0.00 41.12 44.17 2kt8 n ASP 63 CO 0.00 0.00 0.00 -0.38 0.12 0.00 0.00 177.20 176.94 2kt8 n ILE 64 N 0.00 -8.27 -3.80 5.18 5.41 -1.25 -4.99 119.36 111.64 2kt8 n ILE 64 Ca 0.00 -1.19 -0.13 0.00 1.00 0.00 0.00 62.75 62.43 2kt8 n ILE 64 Cb 0.00 -6.13 -0.14 0.00 -0.71 0.00 0.00 39.64 32.66 2kt8 n ILE 64 CO 0.00 0.00 0.00 -0.75 0.00 0.00 0.00 176.55 175.80 2kt8 s LYS 65 N -4.29 0.10 0.21 0.38 2.20 -0.42 -4.66 119.74 113.26 2kt8 s LYS 65 Ca 0.40 0.23 -0.30 0.00 -0.36 0.00 0.00 55.97 55.93 2kt8 s LYS 65 Cb -0.05 -0.05 -0.09 0.00 -1.51 0.00 0.00 37.83 36.13 2kt8 s LYS 65 CO 0.66 -0.08 1.38 0.34 -0.36 0.00 0.00 175.35 177.29 2kt8 s ASP 66 N 0.53 6.78 -0.77 1.43 -1.08 -1.26 -4.43 116.67 117.88 2kt8 s ASP 66 Ca -0.04 2.51 -0.26 0.00 -0.52 0.00 0.00 52.55 54.25 2kt8 s ASP 66 Cb -0.06 -2.61 -0.01 0.00 -1.46 0.00 0.00 42.92 38.78 2kt8 s ASP 66 CO -0.02 -0.61 1.75 -1.61 0.52 0.00 0.00 175.17 175.19 2kt8 s GLU 67 N -0.10 2.80 -0.08 4.34 2.02 -1.26 -4.94 118.70 121.48 2kt8 s GLU 67 Ca 0.59 -0.01 0.04 0.00 0.02 0.00 0.00 54.97 55.61 2kt8 s GLU 67 Cb -0.39 -4.69 -0.00 0.00 0.10 0.00 0.00 34.13 29.15 2kt8 s GLU 67 CO 0.39 -2.79 -0.22 0.14 0.02 0.00 0.00 175.26 172.81 2kt8 s VAL 68 N 8.40 1.85 0.31 2.63 -7.23 -1.26 -5.12 120.40 119.98 2kt8 s VAL 68 Ca 0.61 -0.91 -0.27 0.00 -1.81 0.00 0.00 61.98 59.59 2kt8 s VAL 68 Cb -0.09 -1.60 -0.09 0.00 0.56 0.00 0.00 36.38 35.16 2kt8 s VAL 68 CO 0.09 0.51 0.99 -0.76 -0.31 0.00 0.00 175.10 175.62 2kt8 s LEU 69 N 0.28 4.42 -0.28 1.32 2.01 -1.26 -5.04 118.68 120.13 2kt8 s LEU 69 Ca -0.14 1.97 -0.02 0.00 0.01 0.00 0.00 54.13 55.95 2kt8 s LEU 69 Cb -0.16 -3.87 0.17 0.00 0.01 0.00 0.00 46.19 42.33 2kt8 s LEU 69 CO 0.07 -0.09 0.53 -0.70 1.01 0.00 0.00 176.35 177.17 2kt8 s GLU 70 N -1.79 0.50 0.00 1.70 2.12 -1.26 -5.08 118.70 114.88 2kt8 s GLU 70 Ca 0.48 0.88 0.00 0.00 0.36 0.00 0.00 54.97 56.69 2kt8 s GLU 70 Cb -0.23 0.24 0.00 0.00 0.26 0.00 0.00 34.13 34.40 2kt8 s GLU 70 CO 0.29 -0.60 0.16 0.72 -0.54 0.00 0.00 175.26 175.29 2kt8 n HIS 71 N 5.41 0.00 -2.85 5.30 8.25 -1.26 -4.80 115.22 125.27 2kt8 n HIS 71 Ca -0.02 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.03 2kt8 n HIS 71 Cb 0.51 -0.32 -0.04 0.00 1.12 0.00 0.00 29.99 31.25 2kt8 n HIS 71 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 2kt8 s HIS 72 N -0.97 3.71 0.19 4.41 3.76 -1.26 -4.95 115.29 120.18 2kt8 s HIS 72 Ca 0.00 1.59 -0.08 0.00 -0.15 0.00 0.00 55.06 56.42 2kt8 s HIS 72 Cb 0.00 -2.96 0.10 0.00 1.11 0.00 0.00 32.58 30.83 2kt8 s HIS 72 CO 0.00 0.15 1.61 0.45 -0.85 0.00 0.00 174.74 176.10 2kt8 h HIS 73 N 6.10 1.06 0.00 1.40 -0.00 -1.87 -3.48 115.15 118.37 2kt8 h HIS 73 Ca -0.42 -0.23 0.00 0.00 -0.00 0.00 0.00 60.37 59.72 2kt8 h HIS 73 Cb 1.21 -0.26 0.00 0.00 -0.00 0.00 0.00 27.41 28.36 2kt8 h HIS 73 CO 0.66 1.02 0.00 0.72 -0.00 0.00 0.00 177.93 180.32 2kt8 n HIS 74 N -4.13 0.00 -0.18 2.45 8.25 -1.26 -5.01 115.22 115.34 2kt8 n HIS 74 Ca 0.01 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.39 2kt8 n HIS 74 Cb 0.41 0.00 0.05 0.00 1.12 0.00 0.00 29.99 31.57 2kt8 n HIS 74 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2kt8 h HIS 75 N 0.00 1.10 0.00 4.41 3.86 -2.05 -3.53 115.15 118.94 2kt8 h HIS 75 Ca 0.00 -0.20 0.00 0.00 -1.16 0.00 0.00 60.37 59.01 2kt8 h HIS 75 Cb 0.00 -0.28 0.00 0.00 1.06 0.00 0.00 27.41 28.19 2kt8 h HIS 75 CO 0.00 1.00 0.00 0.72 0.86 0.00 0.00 177.93 180.51