#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fk2 s ILE 2 N 0.00 2.30 0.27 0.00 -1.09 -1.26 -5.06 121.20 116.36 1fk2 s ILE 2 Ca 0.00 -0.86 0.09 0.00 -2.23 0.00 0.00 60.65 57.65 1fk2 s ILE 2 Cb 0.00 -1.98 -0.04 0.00 -1.58 0.00 0.00 42.46 38.86 1fk2 s ILE 2 CO 0.00 0.52 0.01 -0.94 -1.23 0.00 0.00 174.94 173.30 1fk2 s SER 3 N 1.25 4.61 0.37 3.58 1.04 -1.26 -4.72 113.70 118.57 1fk2 s SER 3 Ca 0.03 -0.62 0.15 0.00 0.48 0.00 0.00 55.95 55.99 1fk2 s SER 3 Cb -0.14 -0.88 0.74 0.00 0.10 0.00 0.00 66.02 65.84 1fk2 s SER 3 CO -0.10 -0.00 1.81 0.00 0.98 0.00 0.00 173.24 175.93 1fk2 h GLY 5 N 1.34 0.99 0.77 0.00 0.00 -1.98 0.22 103.07 104.41 1fk2 h GLY 5 Ca -0.00 -0.63 -0.00 0.00 0.00 0.00 0.00 47.33 46.69 1fk2 h GLY 5 CO 0.05 0.59 0.00 -1.61 0.00 0.00 0.00 176.54 175.57 1fk2 h GLN 6 N 0.87 0.01 -0.32 4.80 4.15 -1.87 -1.02 115.11 121.72 1fk2 h GLN 6 Ca 0.18 -0.00 0.03 0.00 0.77 0.00 0.00 58.65 59.62 1fk2 h GLN 6 Cb 0.40 -0.00 -0.03 0.00 0.21 0.00 0.00 27.48 28.06 1fk2 h GLN 6 CO 0.01 0.24 0.14 0.28 -1.93 0.00 0.00 178.83 177.57 1fk2 h VAL 7 N -0.22 0.96 -0.74 2.39 2.07 -1.13 -2.07 116.25 117.51 1fk2 h VAL 7 Ca 0.00 -0.10 0.06 0.00 0.82 0.00 0.00 66.70 67.48 1fk2 h VAL 7 Cb 0.23 0.63 -0.06 0.00 -1.52 0.00 0.00 31.29 30.58 1fk2 h VAL 7 CO 0.00 0.06 0.43 0.00 0.02 0.00 0.00 177.57 178.08 1fk2 h ALA 8 N 1.18 1.01 -0.26 1.67 0.00 -0.40 -1.98 119.26 120.47 1fk2 h ALA 8 Ca 0.14 0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.93 1fk2 h ALA 8 Cb 0.07 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1fk2 h ALA 8 CO -0.11 0.13 -0.36 0.77 0.00 0.00 0.00 179.25 179.68 1fk2 h SER 9 N 0.79 0.61 -0.53 0.00 0.02 -0.95 -1.61 113.55 111.88 1fk2 h SER 9 Ca 0.33 -0.25 -0.12 0.00 -0.84 0.00 0.00 61.79 60.91 1fk2 h SER 9 Cb 0.20 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 62.55 1fk2 h SER 9 CO -0.18 0.91 -0.15 0.00 -1.14 0.00 0.00 176.83 176.27 1fk2 h ALA 10 N 1.12 0.73 -0.04 3.77 0.00 -0.95 -3.24 119.26 120.65 1fk2 h ALA 10 Ca 0.05 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.59 1fk2 h ALA 10 Cb 0.85 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1fk2 h ALA 10 CO 0.07 0.67 0.00 0.44 0.00 0.00 0.00 179.25 180.43 1fk2 n ILE 11 N -4.13 0.02 -0.27 0.00 -5.35 -0.78 -4.16 119.36 104.67 1fk2 n ILE 11 Ca 0.01 -0.43 0.09 0.00 -0.27 0.00 0.00 62.75 62.15 1fk2 n ILE 11 Cb 0.43 1.15 0.23 0.00 -1.74 0.00 0.00 39.64 39.71 1fk2 n ILE 11 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1fk2 h ALA 12 N 4.58 1.11 0.00 -1.28 0.00 -1.32 0.64 119.26 122.99 1fk2 h ALA 12 Ca 0.00 0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.09 1fk2 h ALA 12 Cb 0.83 0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.87 1fk2 h ALA 12 CO 0.00 -0.37 0.00 -1.35 0.00 0.00 0.00 179.25 177.53 1fk2 h PRO 13 N 0.28 0.00 0.00 0.00 0.11 -1.83 -2.61 132.00 127.94 1fk2 h PRO 13 Ca 0.47 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.55 1fk2 h PRO 13 Cb 0.86 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.97 1fk2 h PRO 13 CO -0.55 0.00 -0.16 0.00 -0.21 0.00 0.00 178.00 177.07 1fk2 h ILE 15 N 0.00 0.76 -0.94 0.00 1.08 -1.50 -1.22 117.51 115.70 1fk2 h ILE 15 Ca -0.00 -0.19 0.03 0.00 -0.39 0.00 0.00 64.86 64.30 1fk2 h ILE 15 Cb 1.06 0.15 -0.05 0.00 -3.07 0.00 0.00 36.82 34.91 1fk2 h ILE 15 CO 0.02 0.10 0.61 0.77 -0.69 0.00 0.00 178.15 178.97 1fk2 h SER 16 N 0.56 1.03 -0.42 1.72 4.64 -1.80 -0.46 113.55 118.82 1fk2 h SER 16 Ca 0.40 -0.01 -0.11 0.00 -0.47 0.00 0.00 61.79 61.59 1fk2 h SER 16 Cb 0.52 -0.24 -0.01 0.00 -0.31 0.00 0.00 62.40 62.35 1fk2 h SER 16 CO -0.33 0.72 -0.18 0.22 -0.87 0.00 0.00 176.83 176.38 1fk2 h TYR 17 N 1.20 1.00 0.00 4.77 3.20 -1.53 0.27 116.97 125.89 1fk2 h TYR 17 Ca 0.37 -0.24 -0.01 0.00 3.14 0.00 0.00 58.73 61.98 1fk2 h TYR 17 Cb -0.04 -0.23 -0.00 0.00 1.54 0.00 0.00 36.73 38.00 1fk2 h TYR 17 CO -0.01 1.02 -0.06 0.00 -1.64 0.00 0.00 178.16 177.47 1fk2 h ALA 18 N 0.83 1.43 0.00 1.82 0.00 -0.47 -1.84 119.26 121.03 1fk2 h ALA 18 Ca 0.10 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1fk2 h ALA 18 Cb 0.74 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.52 1fk2 h ALA 18 CO 0.06 0.08 -0.40 0.54 0.00 0.00 0.00 179.25 179.52 1fk2 n ARG 19 N -3.79 0.05 0.00 0.00 1.74 -0.25 0.00 116.66 114.41 1fk2 n ARG 19 Ca -0.02 0.02 0.00 0.00 -0.77 0.00 0.00 57.85 57.07 1fk2 n ARG 19 Cb 0.16 -1.53 0.00 0.00 -1.02 0.00 0.00 32.46 30.06 1fk2 n ARG 19 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1fk2 n GLY 20 N 1.47 1.32 3.86 -0.13 0.00 -0.69 -4.32 105.19 106.70 1fk2 n GLY 20 Ca 0.05 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.71 1fk2 n GLY 20 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1fk2 s GLN 21 N -0.38 3.76 0.04 1.61 -0.21 0.06 -4.97 119.66 119.56 1fk2 s GLN 21 Ca 0.00 0.21 0.00 0.00 0.02 0.00 0.00 55.36 55.59 1fk2 s GLN 21 Cb 0.00 -3.16 0.00 0.00 1.00 0.00 0.00 33.01 30.85 1fk2 s GLN 21 CO 0.00 0.68 0.00 0.41 -2.12 0.00 0.00 175.29 174.26 1fk2 n GLY 22 N 1.61 -2.05 1.17 3.09 0.00 -1.26 -3.78 105.19 103.96 1fk2 n GLY 22 Ca -0.14 -1.47 0.12 0.00 0.00 0.00 0.00 46.02 44.53 1fk2 n GLY 22 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1fk2 n SER 23 N -2.59 3.49 -3.60 1.61 3.41 -1.26 -4.99 113.62 109.68 1fk2 n SER 23 Ca -0.00 -1.99 -0.00 0.00 -0.26 0.00 0.00 58.87 56.61 1fk2 n SER 23 Cb 0.05 -0.26 -0.01 0.00 -0.26 0.00 0.00 64.21 63.73 1fk2 n SER 23 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1fk2 s GLY 24 N -1.47 -0.36 0.31 5.00 0.00 -1.26 -5.13 107.32 104.40 1fk2 s GLY 24 Ca 0.39 1.21 -0.29 0.00 0.00 0.00 0.00 44.72 46.03 1fk2 s GLY 24 CO 0.32 0.33 1.23 2.56 0.00 0.00 0.00 173.10 177.54 1fk2 s PRO 25 N -2.26 4.46 0.90 2.90 0.04 -1.26 -4.89 135.00 134.89 1fk2 s PRO 25 Ca 0.13 2.06 -0.11 0.00 0.04 0.00 0.00 61.00 63.11 1fk2 s PRO 25 Cb 0.03 -3.12 0.13 0.00 0.04 0.00 0.00 34.50 31.58 1fk2 s PRO 25 CO -0.04 -0.04 1.09 -1.54 0.04 0.00 0.00 177.00 176.50 1fk2 s SER 26 N -0.59 3.41 0.29 6.66 1.04 -1.26 -4.80 113.70 118.45 1fk2 s SER 26 Ca 0.48 1.56 -0.01 0.00 0.48 0.00 0.00 55.95 58.45 1fk2 s SER 26 Cb -0.37 -2.23 0.45 0.00 0.10 0.00 0.00 66.02 63.98 1fk2 s SER 26 CO 0.48 -2.69 1.91 0.00 0.98 0.00 0.00 173.24 173.92 1fk2 h ALA 27 N -1.58 1.44 -0.45 5.32 0.00 -1.98 -0.84 119.26 121.18 1fk2 h ALA 27 Ca -0.49 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.38 1fk2 h ALA 27 Cb 1.28 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.75 1fk2 h ALA 27 CO 0.53 0.44 0.26 0.78 0.00 0.00 0.00 179.25 181.26 1fk2 h GLY 28 N 1.12 0.65 0.95 0.00 0.00 -1.95 0.27 103.07 104.11 1fk2 h GLY 28 Ca 0.39 -0.28 -0.01 0.00 0.00 0.00 0.00 47.33 47.43 1fk2 h GLY 28 CO -0.14 0.27 0.18 0.00 0.00 0.00 0.00 176.54 176.86 1fk2 h SER 31 N 0.12 1.00 -0.32 0.00 0.87 -0.38 -1.63 113.55 113.22 1fk2 h SER 31 Ca 0.02 -0.25 -0.15 0.00 -1.23 0.00 0.00 61.79 60.18 1fk2 h SER 31 Cb 0.52 -0.27 -0.00 0.00 -0.44 0.00 0.00 62.40 62.21 1fk2 h SER 31 CO 0.04 1.02 -0.37 1.23 -0.53 0.00 0.00 176.83 178.23 1fk2 h GLY 32 N 1.02 0.89 0.90 5.77 0.00 -1.02 -1.67 103.07 108.96 1fk2 h GLY 32 Ca 0.18 -0.94 -0.01 0.00 0.00 0.00 0.00 47.33 46.56 1fk2 h GLY 32 CO 0.02 0.85 0.09 -2.08 0.00 0.00 0.00 176.54 175.41 1fk2 h VAL 33 N 0.60 1.16 -0.30 4.60 2.07 -1.18 -1.63 116.25 121.57 1fk2 h VAL 33 Ca 0.05 -0.49 -0.10 0.00 0.82 0.00 0.00 66.70 66.97 1fk2 h VAL 33 Cb 0.95 1.09 -0.01 0.00 -1.52 0.00 0.00 31.29 31.80 1fk2 h VAL 33 CO 0.09 0.16 -0.24 0.03 0.02 0.00 0.00 177.57 177.63 1fk2 h ARG 34 N 0.19 0.59 -0.42 1.57 3.08 -1.28 0.00 114.38 118.11 1fk2 h ARG 34 Ca 0.07 -0.22 0.05 0.00 0.07 0.00 0.00 59.98 59.95 1fk2 h ARG 34 Cb 0.17 -0.03 -0.05 0.00 0.08 0.00 0.00 29.97 30.14 1fk2 h ARG 34 CO -0.01 0.78 0.16 1.03 -1.07 0.00 0.00 179.97 180.86 1fk2 h SER 35 N 0.52 0.17 -0.27 7.04 0.87 -1.11 -0.45 113.55 120.32 1fk2 h SER 35 Ca 0.08 0.05 -0.03 0.00 -1.23 0.00 0.00 61.79 60.65 1fk2 h SER 35 Cb 0.69 0.03 -0.01 0.00 -0.44 0.00 0.00 62.40 62.66 1fk2 h SER 35 CO 0.05 0.13 0.04 0.25 -0.53 0.00 0.00 176.83 176.77 1fk2 h LEU 36 N 0.32 0.43 -1.25 2.23 5.85 -0.88 -1.07 115.31 120.95 1fk2 h LEU 36 Ca 0.20 -0.27 0.09 0.00 0.84 0.00 0.00 57.88 58.74 1fk2 h LEU 36 Cb 0.18 -0.12 -0.06 0.00 0.37 0.00 0.00 40.66 41.03 1fk2 h LEU 36 CO -0.19 0.59 0.56 -1.13 -0.34 0.00 0.00 178.44 177.92 1fk2 h ASN 37 N 0.26 0.76 1.53 1.25 -0.00 -0.68 -0.88 115.58 117.82 1fk2 h ASN 37 Ca 0.08 0.02 -0.08 0.00 -0.00 0.00 0.00 56.30 56.32 1fk2 h ASN 37 Cb 0.34 -0.14 -0.01 0.00 -0.00 0.00 0.00 38.32 38.51 1fk2 h ASN 37 CO 0.01 0.45 -0.48 0.78 -0.00 0.00 0.00 177.43 178.19 1fk2 h ASN 38 N 0.84 0.00 0.45 1.15 2.35 -0.65 -3.27 115.58 116.46 1fk2 h ASN 38 Ca 0.39 0.00 -0.25 0.00 -0.55 0.00 0.00 56.30 55.89 1fk2 h ASN 38 Cb 0.40 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.78 1fk2 h ASN 38 CO -0.16 0.35 -1.08 0.00 -1.65 0.00 0.00 177.43 174.89 1fk2 h ALA 39 N 1.65 0.24 -1.01 -0.83 0.00 -0.20 -3.40 119.26 115.70 1fk2 h ALA 39 Ca -0.02 -0.78 -0.49 0.00 0.00 0.00 0.00 54.91 53.62 1fk2 h ALA 39 Cb 1.28 0.00 -0.08 0.00 0.00 0.00 0.00 17.79 18.99 1fk2 h ALA 39 CO 0.04 0.87 1.20 0.00 0.00 0.00 0.00 179.25 181.36 1fk2 s ALA 40 N -3.01 2.34 -0.71 0.00 0.00 -0.43 -4.78 121.76 115.17 1fk2 s ALA 40 Ca -0.05 -1.87 0.08 0.00 0.00 0.00 0.00 51.96 50.12 1fk2 s ALA 40 Cb 0.08 -4.51 0.24 0.00 0.00 0.00 0.00 23.12 18.93 1fk2 s ALA 40 CO 0.88 -4.01 1.20 2.89 0.00 0.00 0.00 175.76 176.72 1fk2 n ARG 41 N 8.93 2.90 -4.10 0.00 1.85 -1.26 -4.77 116.66 120.21 1fk2 n ARG 41 Ca 0.33 -1.93 -0.08 0.00 -1.00 0.00 0.00 57.85 55.17 1fk2 n ARG 41 Cb 0.50 -1.21 -0.10 0.00 -1.05 0.00 0.00 32.46 30.59 1fk2 n ARG 41 CO 0.00 0.00 0.00 0.95 -0.01 0.00 0.00 177.63 178.57 1fk2 s THR 42 N -1.02 0.20 0.23 8.89 -4.23 -1.26 -5.04 115.64 113.41 1fk2 s THR 42 Ca 0.18 -1.83 -0.07 0.00 -1.18 0.00 0.00 61.69 58.79 1fk2 s THR 42 Cb 0.10 -1.62 0.18 0.00 1.34 0.00 0.00 72.50 72.49 1fk2 s THR 42 CO 0.12 -0.89 1.82 0.74 -0.54 0.00 0.00 174.62 175.87 1fk2 h THR 43 N 3.09 0.96 -0.46 3.99 2.02 -1.95 -0.40 112.91 120.16 1fk2 h THR 43 Ca -0.34 -0.26 0.02 0.00 0.77 0.00 0.00 66.41 66.59 1fk2 h THR 43 Cb 1.15 0.13 -0.03 0.00 -1.74 0.00 0.00 68.15 67.66 1fk2 h THR 43 CO 0.65 0.14 0.28 0.00 0.37 0.00 0.00 175.52 176.96 1fk2 h ALA 44 N 1.39 0.59 -0.38 6.16 0.00 -1.97 -0.60 119.26 124.45 1fk2 h ALA 44 Ca 0.34 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.25 1fk2 h ALA 44 Cb 0.24 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 1fk2 h ALA 44 CO -0.20 -0.02 0.24 -0.44 0.00 0.00 0.00 179.25 178.83 1fk2 h ASP 45 N 0.57 0.40 -0.09 0.00 3.45 -1.80 -1.59 116.42 117.35 1fk2 h ASP 45 Ca 0.18 -0.00 -0.09 0.00 0.43 0.00 0.00 57.03 57.55 1fk2 h ASP 45 Cb -0.00 -0.09 -0.01 0.00 -0.56 0.00 0.00 39.33 38.66 1fk2 h ASP 45 CO -0.07 0.29 -0.22 0.03 -1.57 0.00 0.00 179.24 177.70 1fk2 h ARG 46 N 0.49 0.51 -0.44 3.56 3.08 -0.51 0.24 114.38 121.30 1fk2 h ARG 46 Ca 0.15 -0.18 -0.15 0.00 0.07 0.00 0.00 59.98 59.87 1fk2 h ARG 46 Cb -0.03 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 29.98 1fk2 h ARG 46 CO -0.05 0.69 -0.30 0.00 -1.07 0.00 0.00 179.97 179.24 1fk2 h ARG 47 N 0.45 0.98 0.00 0.04 3.08 -0.97 0.47 114.38 118.43 1fk2 h ARG 47 Ca 0.07 -0.47 -0.00 0.00 0.07 0.00 0.00 59.98 59.65 1fk2 h ARG 47 Cb 0.63 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.67 1fk2 h ARG 47 CO 0.04 1.13 -0.00 0.00 -1.07 0.00 0.00 179.97 180.08 1fk2 h ALA 48 N 0.82 -0.01 -0.89 0.04 0.00 -1.14 -1.33 119.26 116.75 1fk2 h ALA 48 Ca 0.09 -0.12 0.02 0.00 0.00 0.00 0.00 54.91 54.89 1fk2 h ALA 48 Cb 0.89 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.64 1fk2 h ALA 48 CO 0.08 -0.38 0.59 0.00 0.00 0.00 0.00 179.25 179.54 1fk2 h ALA 49 N 0.74 1.40 -0.37 0.00 0.00 -0.89 -1.66 119.26 118.48 1fk2 h ALA 49 Ca -0.00 -0.05 0.03 0.00 0.00 0.00 0.00 54.91 54.89 1fk2 h ALA 49 Cb 0.25 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 1fk2 h ALA 49 CO 0.00 0.54 0.17 0.00 0.00 0.00 0.00 179.25 179.96 1fk2 h ASN 51 N 0.36 0.64 -0.73 0.00 2.35 -0.94 0.91 115.58 118.16 1fk2 h ASN 51 Ca 0.16 -0.21 -0.02 0.00 -0.55 0.00 0.00 56.30 55.69 1fk2 h ASN 51 Cb 0.09 -0.17 -0.03 0.00 0.05 0.00 0.00 38.32 38.25 1fk2 h ASN 51 CO -0.12 0.67 0.39 0.00 -1.65 0.00 0.00 177.43 176.72 1fk2 h LEU 53 N 1.01 0.78 -0.65 0.00 3.38 -0.45 -0.70 115.31 118.69 1fk2 h LEU 53 Ca 0.26 -0.30 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 1fk2 h LEU 53 Cb 0.05 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.55 1fk2 h LEU 53 CO -0.04 1.01 0.35 0.50 0.09 0.00 0.00 178.44 180.35 1fk2 h LYS 54 N 0.65 0.91 -0.38 1.13 3.64 -0.67 -0.58 116.57 121.27 1fk2 h LYS 54 Ca 0.08 -0.11 -0.09 0.00 -1.27 0.00 0.00 60.65 59.26 1fk2 h LYS 54 Cb 0.80 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 32.43 1fk2 h LYS 54 CO 0.07 0.69 -0.14 -0.97 -2.27 0.00 0.00 179.45 176.83 1fk2 h ASN 55 N 0.88 0.67 -0.42 4.20 -0.73 -1.09 -2.43 115.58 116.66 1fk2 h ASN 55 Ca 0.23 -0.20 -0.15 0.00 1.87 0.00 0.00 56.30 58.04 1fk2 h ASN 55 Cb 0.06 -0.18 -0.01 0.00 0.27 0.00 0.00 38.32 38.46 1fk2 h ASN 55 CO -0.03 0.83 -0.33 0.00 -0.37 0.00 0.00 177.43 177.52 1fk2 h ALA 56 N 1.23 0.61 -0.44 1.57 0.00 -0.86 -3.05 119.26 118.33 1fk2 h ALA 56 Ca 0.10 -0.44 -0.10 0.00 0.00 0.00 0.00 54.91 54.48 1fk2 h ALA 56 Cb 0.59 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 1fk2 h ALA 56 CO 0.04 0.68 -0.12 0.00 0.00 0.00 0.00 179.25 179.84 1fk2 h ALA 57 N 0.81 0.96 0.00 0.00 0.00 -0.92 -3.00 119.26 117.11 1fk2 h ALA 57 Ca 0.08 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1fk2 h ALA 57 Cb 0.92 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.54 1fk2 h ALA 57 CO 0.09 0.61 0.00 0.00 0.00 0.00 0.00 179.25 179.95 1fk2 n ALA 58 N -2.49 1.85 -0.50 0.00 0.00 -0.93 -3.40 120.51 115.04 1fk2 n ALA 58 Ca 0.01 0.04 0.07 0.00 0.00 0.00 0.00 53.44 53.56 1fk2 n ALA 58 Cb 0.38 -1.40 0.21 0.00 0.00 0.00 0.00 19.45 18.64 1fk2 n ALA 58 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1fk2 n GLY 59 N 0.41 3.21 3.52 0.00 0.00 -1.13 -4.92 105.19 106.28 1fk2 n GLY 59 Ca 0.03 -0.65 -0.42 0.00 0.00 0.00 0.00 46.02 44.98 1fk2 n GLY 59 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1fk2 s VAL 60 N -1.72 3.92 0.17 1.61 1.01 -1.22 -5.01 120.40 119.16 1fk2 s VAL 60 Ca 0.32 0.04 -0.31 0.00 0.00 0.00 0.00 61.98 62.03 1fk2 s VAL 60 Cb 0.22 -4.87 -0.09 0.00 0.00 0.00 0.00 36.38 31.63 1fk2 s VAL 60 CO 0.14 -1.76 1.48 -0.94 0.00 0.00 0.00 175.10 174.02 1fk2 s SER 61 N 3.85 6.68 0.00 3.32 1.04 -1.26 -1.03 113.70 126.30 1fk2 s SER 61 Ca 0.33 2.54 0.00 0.00 0.48 0.00 0.00 55.95 59.29 1fk2 s SER 61 Cb -0.09 -2.60 0.00 0.00 0.10 0.00 0.00 66.02 63.43 1fk2 s SER 61 CO 0.11 -0.74 0.00 0.61 0.98 0.00 0.00 173.24 174.20 1fk2 n GLY 62 N 3.30 0.42 3.60 7.32 0.00 -1.26 -4.88 105.19 113.68 1fk2 n GLY 62 Ca 0.11 -1.02 -0.55 0.00 0.00 0.00 0.00 46.02 44.56 1fk2 n GLY 62 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1fk2 n LEU 63 N 0.00 1.44 -4.24 0.99 7.94 -0.20 -4.45 117.00 118.48 1fk2 n LEU 63 Ca 0.00 1.12 -0.43 0.00 -1.11 0.00 0.00 56.01 55.60 1fk2 n LEU 63 Cb 0.02 -1.13 -0.07 0.00 0.53 0.00 0.00 43.42 42.77 1fk2 n LEU 63 CO 0.00 -1.11 0.05 0.21 -1.11 0.00 0.00 177.39 175.43 1fk2 s ASN 64 N 0.90 5.88 0.27 1.96 2.47 0.10 -4.96 114.94 121.56 1fk2 s ASN 64 Ca 0.88 -1.93 -0.00 0.00 0.42 0.00 0.00 52.86 52.22 1fk2 s ASN 64 Cb -1.04 -2.07 0.52 0.00 -1.45 0.00 0.00 41.25 37.20 1fk2 s ASN 64 CO 0.52 -0.73 1.81 0.00 -3.72 0.00 0.00 177.10 174.98 1fk2 h ALA 65 N 8.52 1.38 -0.06 1.71 0.00 -1.92 -1.52 119.26 127.36 1fk2 h ALA 65 Ca -0.22 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.73 1fk2 h ALA 65 Cb 1.08 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.73 1fk2 h ALA 65 CO 0.91 0.10 0.03 0.78 0.00 0.00 0.00 179.25 181.07 1fk2 h GLY 66 N 0.83 0.08 0.98 0.00 0.00 -1.94 -2.05 103.07 100.97 1fk2 h GLY 66 Ca 0.47 -0.04 -0.00 0.00 0.00 0.00 0.00 47.33 47.76 1fk2 h GLY 66 CO -0.29 0.03 0.12 3.43 0.00 0.00 0.00 176.54 179.84 1fk2 h ASN 67 N 0.04 0.24 -0.45 0.19 4.21 -1.70 -2.93 115.58 115.17 1fk2 h ASN 67 Ca 0.02 -0.04 0.05 0.00 1.21 0.00 0.00 56.30 57.55 1fk2 h ASN 67 Cb 0.04 -0.06 -0.05 0.00 -1.12 0.00 0.00 38.32 37.13 1fk2 h ASN 67 CO -0.00 0.21 0.17 0.00 -1.29 0.00 0.00 177.43 176.51 1fk2 h ALA 68 N 1.04 0.55 0.00 -0.83 0.00 -1.03 -2.42 119.26 116.57 1fk2 h ALA 68 Ca 0.07 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.00 1fk2 h ALA 68 Cb 0.01 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 1fk2 h ALA 68 CO -0.01 -0.21 -0.14 0.00 0.00 0.00 0.00 179.25 178.88 1fk2 h ALA 69 N 1.29 1.24 0.00 0.00 0.00 -1.32 -2.79 119.26 117.68 1fk2 h ALA 69 Ca 0.21 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1fk2 h ALA 69 Cb 0.19 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1fk2 h ALA 69 CO -0.20 0.18 -0.31 -1.13 0.00 0.00 0.00 179.25 177.79 1fk2 n SER 70 N -3.60 0.37 -0.15 0.00 3.41 -0.92 -4.35 113.62 108.37 1fk2 n SER 70 Ca -0.01 0.11 -0.02 0.00 -0.26 0.00 0.00 58.87 58.69 1fk2 n SER 70 Cb 0.27 -0.09 0.06 0.00 -0.26 0.00 0.00 64.21 64.19 1fk2 n SER 70 CO 0.00 0.00 0.00 0.40 -0.16 0.00 0.00 175.04 175.28 1fk2 h ILE 71 N 0.00 0.65 -0.33 -1.33 2.04 -1.38 -0.89 117.51 116.27 1fk2 h ILE 71 Ca 0.00 -0.05 0.00 0.00 1.00 0.00 0.00 64.86 65.81 1fk2 h ILE 71 Cb 0.55 0.49 -0.02 0.00 -0.74 0.00 0.00 36.82 37.10 1fk2 h ILE 71 CO 0.00 0.03 0.22 -0.65 0.00 0.00 0.00 178.15 177.75 1fk2 h PRO 72 N 0.15 0.44 -0.01 2.37 0.11 -1.82 -1.47 132.00 131.77 1fk2 h PRO 72 Ca 0.25 -0.03 0.01 0.00 0.11 0.00 0.00 66.00 66.34 1fk2 h PRO 72 Cb 0.36 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 31.36 1fk2 h PRO 72 CO -0.38 0.29 -0.04 0.77 -0.21 0.00 0.00 178.00 178.43 1fk2 h SER 73 N 0.45 -0.13 -0.03 -2.05 0.02 -1.65 0.27 113.55 110.43 1fk2 h SER 73 Ca 0.12 0.02 -0.03 0.00 -0.84 0.00 0.00 61.79 61.07 1fk2 h SER 73 Cb -0.05 0.06 -0.01 0.00 0.14 0.00 0.00 62.40 62.54 1fk2 h SER 73 CO -0.03 -0.07 -0.05 0.11 -1.14 0.00 0.00 176.83 175.66 1fk2 h LYS 74 N -0.07 0.21 -0.21 3.45 1.57 -1.08 -2.02 116.57 118.42 1fk2 h LYS 74 Ca 0.02 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1fk2 h LYS 74 Cb 0.10 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.38 1fk2 h LYS 74 CO -0.06 0.27 0.00 0.00 -0.57 0.00 0.00 179.45 179.10 1fk2 n GLY 76 N 1.11 -0.24 3.64 0.00 0.00 -0.76 -4.95 105.19 103.99 1fk2 n GLY 76 Ca 0.15 -0.23 -0.32 0.00 0.00 0.00 0.00 46.02 45.61 1fk2 n GLY 76 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1fk2 s VAL 77 N -2.79 3.90 -0.23 1.61 1.01 0.02 -5.01 120.40 118.91 1fk2 s VAL 77 Ca 0.03 -0.69 -0.01 0.00 0.00 0.00 0.00 61.98 61.31 1fk2 s VAL 77 Cb -0.01 -2.72 0.02 0.00 0.00 0.00 0.00 36.38 33.67 1fk2 s VAL 77 CO 0.04 0.39 -0.10 -0.44 0.00 0.00 0.00 175.10 174.99 1fk2 s SER 78 N -1.48 4.02 0.09 3.32 0.01 -1.26 -3.88 113.70 114.51 1fk2 s SER 78 Ca 0.18 -0.77 0.10 0.00 1.31 0.00 0.00 55.95 56.77 1fk2 s SER 78 Cb -0.11 -1.62 -0.03 0.00 0.21 0.00 0.00 66.02 64.46 1fk2 s SER 78 CO 0.09 -0.08 -0.26 0.27 0.41 0.00 0.00 173.24 173.67 1fk2 s ILE 79 N 1.33 2.24 -2.00 1.44 -4.36 -1.26 -5.05 121.20 113.54 1fk2 s ILE 79 Ca 0.02 -1.56 0.14 0.00 -0.26 0.00 0.00 60.65 58.99 1fk2 s ILE 79 Cb -0.15 -1.94 0.39 0.00 1.25 0.00 0.00 42.46 42.01 1fk2 s ILE 79 CO -0.06 0.23 1.49 -0.81 0.24 0.00 0.00 174.94 176.02 1fk2 n PRO 80 N 1.33 0.94 -4.05 0.37 -0.04 -1.26 -4.84 135.00 127.46 1fk2 n PRO 80 Ca -0.17 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.19 1fk2 n PRO 80 Cb 0.52 -1.23 -0.09 0.00 -0.04 0.00 0.00 33.50 32.67 1fk2 n PRO 80 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 1fk2 s TYR 81 N -2.00 0.61 -0.22 0.54 1.13 -1.26 -5.14 117.35 111.00 1fk2 s TYR 81 Ca 0.21 -1.00 -0.10 0.00 -1.41 0.00 0.00 57.07 54.77 1fk2 s TYR 81 Cb 0.09 -0.28 -0.05 0.00 -1.10 0.00 0.00 41.96 40.63 1fk2 s TYR 81 CO 0.16 -0.60 0.15 0.99 -2.51 0.00 0.00 175.55 173.74 1fk2 s THR 82 N -4.00 5.38 -0.10 -3.49 2.01 -1.26 -5.04 115.64 109.14 1fk2 s THR 82 Ca 0.19 0.19 -0.29 0.00 0.31 0.00 0.00 61.69 62.09 1fk2 s THR 82 Cb 0.06 -3.49 -0.06 0.00 0.01 0.00 0.00 72.50 69.02 1fk2 s THR 82 CO -0.00 0.38 1.89 -0.63 -0.69 0.00 0.00 174.62 175.56 1fk2 s ILE 83 N 0.80 3.28 0.06 1.82 -1.09 -1.26 -4.71 121.20 120.10 1fk2 s ILE 83 Ca 0.08 0.32 -0.26 0.00 -2.23 0.00 0.00 60.65 58.56 1fk2 s ILE 83 Cb -0.13 -3.26 0.07 0.00 -1.58 0.00 0.00 42.46 37.56 1fk2 s ILE 83 CO 0.02 -0.09 0.61 -0.55 -1.23 0.00 0.00 174.94 173.70 1fk2 s SER 84 N 5.11 -0.57 0.32 3.58 0.15 -1.26 -4.93 113.70 116.09 1fk2 s SER 84 Ca 0.84 0.29 0.23 0.00 0.70 0.00 0.00 55.95 58.02 1fk2 s SER 84 Cb -0.34 0.55 1.16 0.00 -1.71 0.00 0.00 66.02 65.68 1fk2 s SER 84 CO 0.35 -0.78 1.71 0.71 1.20 0.00 0.00 173.24 176.43 1fk2 h THR 85 N 2.55 0.00 0.00 6.45 1.35 -1.92 -2.18 112.91 119.16 1fk2 h THR 85 Ca -0.31 -0.08 0.00 0.00 -0.55 0.00 0.00 66.41 65.47 1fk2 h THR 85 Cb 1.23 0.67 0.00 0.00 -1.73 0.00 0.00 68.15 68.31 1fk2 h THR 85 CO 0.39 0.00 -0.52 -1.20 -0.25 0.00 0.00 175.52 173.94 1fk2 n SER 86 N -2.30 0.59 -4.73 5.36 7.64 -1.26 -4.90 113.62 114.02 1fk2 n SER 86 Ca -0.00 0.06 -0.42 0.00 1.01 0.00 0.00 58.87 59.52 1fk2 n SER 86 Cb 0.10 0.10 -0.03 0.00 -1.01 0.00 0.00 64.21 63.38 1fk2 n SER 86 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1fk2 s THR 87 N -3.10 2.07 -0.53 0.44 2.01 -0.82 -4.97 115.64 110.74 1fk2 s THR 87 Ca 0.08 0.06 -0.16 0.00 0.31 0.00 0.00 61.69 61.98 1fk2 s THR 87 Cb 0.15 -3.04 0.12 0.00 0.01 0.00 0.00 72.50 69.74 1fk2 s THR 87 CO 0.70 0.01 0.51 -0.62 -0.69 0.00 0.00 174.62 174.52 1fk2 s ASP 88 N 1.00 6.18 0.28 3.53 3.68 -1.26 -4.94 116.67 125.14 1fk2 s ASP 88 Ca 0.72 -1.65 0.24 0.00 2.13 0.00 0.00 52.55 53.99 1fk2 s ASP 88 Cb -0.49 -2.22 1.03 0.00 -1.45 0.00 0.00 42.92 39.80 1fk2 s ASP 88 CO 0.36 -0.85 1.72 0.00 0.13 0.00 0.00 175.17 176.53 1fk2 n SER 90 N -2.29 0.24 -0.11 0.00 3.41 -1.26 -2.83 113.62 110.78 1fk2 n SER 90 Ca 0.02 0.53 0.11 0.00 -0.26 0.00 0.00 58.87 59.26 1fk2 n SER 90 Cb 0.21 -0.59 -0.03 0.00 -0.26 0.00 0.00 64.21 63.54 1fk2 n SER 90 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 1fk2 n ARG 91 N -1.73 0.28 -1.97 4.33 0.00 -0.95 -4.93 116.66 111.69 1fk2 n ARG 91 Ca 0.06 -0.23 -0.42 0.00 -0.00 0.00 0.00 57.85 57.26 1fk2 n ARG 91 Cb 0.34 -1.50 -0.03 0.00 -0.00 0.00 0.00 32.46 31.28 1fk2 n ARG 91 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 1fk2 s VAL 92 N -2.87 3.20 0.00 8.89 1.01 -1.13 -5.12 120.40 124.38 1fk2 s VAL 92 Ca 0.11 0.58 0.00 0.00 0.00 0.00 0.00 61.98 62.68 1fk2 s VAL 92 Cb 0.17 -3.38 0.00 0.00 0.00 0.00 0.00 36.38 33.17 1fk2 s VAL 92 CO 0.77 -0.01 0.00 0.59 0.00 0.00 0.00 175.10 176.45