#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kfd h GLU 6 N 0.00 0.90 -0.71 1.20 -0.00 -2.04 0.10 114.58 114.02 2kfd h GLU 6 Ca 0.00 -0.42 -0.04 0.00 -0.00 0.00 0.00 59.36 58.89 2kfd h GLU 6 Cb 0.00 -0.01 -0.03 0.00 -0.00 0.00 0.00 28.75 28.71 2kfd h GLU 6 CO 0.00 1.07 0.27 0.00 -0.00 0.00 0.00 179.01 180.35 2kfd h ARG 7 N 0.75 1.06 -0.27 1.06 2.47 -2.05 0.29 114.38 117.70 2kfd h ARG 7 Ca 0.08 -0.19 -0.08 0.00 -1.26 0.00 0.00 59.98 58.53 2kfd h ARG 7 Cb 0.88 -0.17 -0.01 0.00 -1.65 0.00 0.00 29.97 29.02 2kfd h ARG 7 CO 0.08 0.87 -0.15 -0.09 0.56 0.00 0.00 179.97 181.25 2kfd h ARG 8 N 1.04 0.57 -0.06 0.04 2.43 -1.90 -2.01 114.38 114.49 2kfd h ARG 8 Ca 0.24 -0.26 0.02 0.00 -0.81 0.00 0.00 59.98 59.17 2kfd h ARG 8 Cb 0.22 -0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.73 2kfd h ARG 8 CO -0.02 0.83 -0.08 0.82 -1.51 0.00 0.00 179.97 180.01 2kfd h ILE 9 N 0.31 0.77 0.07 1.20 2.04 -0.54 -2.26 117.51 119.10 2kfd h ILE 9 Ca 0.06 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.91 2kfd h ILE 9 Cb 0.67 0.77 0.00 0.00 -0.74 0.00 0.00 36.82 37.52 2kfd h ILE 9 CO 0.04 0.00 -0.03 0.25 0.00 0.00 0.00 178.15 178.41 2kfd h LEU 10 N -0.11 -0.08 0.00 1.44 5.85 -0.34 -2.32 115.31 119.74 2kfd h LEU 10 Ca 0.06 -0.21 -0.12 0.00 0.84 0.00 0.00 57.88 58.44 2kfd h LEU 10 Cb 0.19 0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.23 2kfd h LEU 10 CO -0.13 0.17 -0.57 -0.33 -0.34 0.00 0.00 178.44 177.24 2kfd h GLU 11 N -0.33 0.00 -0.12 1.25 5.08 -1.44 0.20 114.58 119.22 2kfd h GLU 11 Ca -0.01 0.00 0.01 0.00 -1.00 0.00 0.00 59.36 58.36 2kfd h GLU 11 Cb 0.29 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.53 2kfd h GLU 11 CO 0.02 0.55 0.04 0.37 -1.00 0.00 0.00 179.01 178.98 2kfd h GLN 12 N 0.00 0.09 -0.05 2.33 4.15 -1.37 -2.31 115.11 117.96 2kfd h GLN 12 Ca -0.01 -0.01 -0.18 0.00 0.77 0.00 0.00 58.65 59.23 2kfd h GLN 12 Cb 1.43 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 29.09 2kfd h GLN 12 CO 0.07 0.06 -0.73 0.87 -1.93 0.00 0.00 178.83 177.17 2kfd h LYS 13 N 0.10 0.29 -0.43 1.69 1.79 -1.21 -2.52 116.57 116.28 2kfd h LYS 13 Ca 0.05 -0.24 0.08 0.00 -2.18 0.00 0.00 60.65 58.36 2kfd h LYS 13 Cb 0.03 0.05 -0.08 0.00 -1.58 0.00 0.00 32.23 30.65 2kfd h LYS 13 CO -0.05 0.90 -0.10 -0.22 -1.08 0.00 0.00 179.45 178.90 2kfd h LYS 14 N 0.19 0.01 0.08 3.15 3.64 -0.46 0.83 116.57 124.01 2kfd h LYS 14 Ca -0.03 -0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.35 2kfd h LYS 14 Cb 1.30 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.12 2kfd h LYS 14 CO 0.12 0.00 -0.04 1.25 -2.27 0.00 0.00 179.45 178.51 2kfd h HIS 15 N 0.01 -0.10 0.00 1.91 2.76 -1.37 -2.31 115.15 116.05 2kfd h HIS 15 Ca 0.20 -0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.37 2kfd h HIS 15 Cb 0.31 0.03 0.00 0.00 1.55 0.00 0.00 27.41 29.31 2kfd h HIS 15 CO -0.37 0.25 0.00 -0.92 -1.30 0.00 0.00 177.93 175.59 2kfd h TYR 16 N -0.47 0.00 0.00 5.26 3.20 -1.07 0.15 116.97 124.05 2kfd h TYR 16 Ca -0.01 0.00 -0.20 0.00 3.14 0.00 0.00 58.73 61.66 2kfd h TYR 16 Cb 0.40 0.00 -0.03 0.00 1.54 0.00 0.00 36.73 38.64 2kfd h TYR 16 CO 0.04 0.00 -0.94 0.35 -1.64 0.00 0.00 178.16 175.98 2kfd h PHE 17 N 0.00 0.00 -0.00 -3.82 3.57 0.75 0.30 116.94 117.74 2kfd h PHE 17 Ca 0.00 0.00 -0.19 0.00 3.53 0.00 0.00 57.97 61.31 2kfd h PHE 17 Cb 0.43 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.16 2kfd h PHE 17 CO 0.00 0.94 -0.85 2.35 -2.23 0.00 0.00 178.31 178.51 2kfd h TRP 18 N 0.00 0.31 -0.14 0.41 -0.00 -0.58 0.86 115.95 116.80 2kfd h TRP 18 Ca -0.01 -0.17 -0.14 0.00 -0.00 0.00 0.00 58.89 58.58 2kfd h TRP 18 Cb 1.68 -0.04 -0.01 0.00 -0.00 0.00 0.00 29.16 30.79 2kfd h TRP 18 CO 0.00 0.97 -0.50 1.25 -0.00 0.00 0.00 178.44 180.15 2kfd h LEU 19 N 0.12 0.43 0.08 0.65 6.46 -0.65 0.41 115.31 122.80 2kfd h LEU 19 Ca -0.04 -0.21 -0.00 0.00 -0.12 0.00 0.00 57.88 57.50 2kfd h LEU 19 Cb 1.47 -0.12 0.00 0.00 -0.73 0.00 0.00 40.66 41.28 2kfd h LEU 19 CO 0.13 0.86 -0.04 0.25 -0.62 0.00 0.00 178.44 179.02 2kfd h LEU 20 N 0.31 -0.09 -0.67 2.25 7.12 -0.15 -2.10 115.31 121.97 2kfd h LEU 20 Ca 0.01 -0.39 -0.14 0.00 0.13 0.00 0.00 57.88 57.49 2kfd h LEU 20 Cb 1.00 0.02 -0.01 0.00 -0.53 0.00 0.00 40.66 41.14 2kfd h LEU 20 CO 0.09 0.37 -0.50 0.25 -0.13 0.00 0.00 178.44 178.51 2kfd h LEU 21 N -0.58 0.45 -0.02 2.25 7.12 0.96 -1.59 115.31 123.90 2kfd h LEU 21 Ca -0.01 -0.22 -0.26 0.00 0.13 0.00 0.00 57.88 57.51 2kfd h LEU 21 Cb 0.48 -0.13 0.02 0.00 -0.53 0.00 0.00 40.66 40.50 2kfd h LEU 21 CO 0.02 0.88 -1.07 -0.61 -0.13 0.00 0.00 178.44 177.52 2kfd h GLN 22 N 0.33 0.60 -0.60 1.25 4.15 -0.29 0.31 115.11 120.84 2kfd h GLN 22 Ca 0.01 -0.68 0.02 0.00 0.77 0.00 0.00 58.65 58.77 2kfd h GLN 22 Cb 1.00 0.20 -0.03 0.00 0.21 0.00 0.00 27.48 28.86 2kfd h GLN 22 CO 0.09 1.28 0.40 -0.09 -1.93 0.00 0.00 178.83 178.58 2kfd h ARG 23 N 0.32 0.74 0.00 1.69 1.12 -1.19 -3.06 114.38 113.99 2kfd h ARG 23 Ca -0.13 -0.04 0.00 0.00 -1.11 0.00 0.00 59.98 58.70 2kfd h ARG 23 Cb 1.72 -0.17 0.00 0.00 -0.01 0.00 0.00 29.97 31.52 2kfd h ARG 23 CO 0.20 0.49 -0.06 1.15 -3.11 0.00 0.00 179.97 178.65 2kfd h THR 24 N 0.76 0.00 -3.58 0.20 2.02 -1.23 -3.42 112.91 107.67 2kfd h THR 24 Ca 0.23 -0.74 -0.78 0.00 0.77 0.00 0.00 66.41 65.90 2kfd h THR 24 Cb -0.01 0.00 -0.26 0.00 -1.74 0.00 0.00 68.15 66.15 2kfd h THR 24 CO -0.06 0.00 -0.02 -0.31 0.37 0.00 0.00 175.52 175.50 2kfd s TYR 25 N -1.48 3.59 0.00 3.16 2.02 0.11 -4.33 117.35 120.41 2kfd s TYR 25 Ca -0.02 -1.79 0.00 0.00 -0.37 0.00 0.00 57.07 54.89 2kfd s TYR 25 Cb 0.00 -3.79 0.00 0.00 -0.40 0.00 0.00 41.96 37.77 2kfd s TYR 25 CO 0.02 -1.00 0.00 2.41 -1.57 0.00 0.00 175.55 175.42 2kfd n THR 26 N 4.37 0.00 0.10 -0.71 -1.04 -0.46 -4.34 114.28 112.20 2kfd n THR 26 Ca 0.05 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.06 2kfd n THR 26 Cb 0.44 -1.53 -0.02 0.00 -1.82 0.00 0.00 70.33 67.39 2kfd n THR 26 CO 0.00 0.00 0.00 0.07 -0.64 0.00 0.00 175.07 174.50 2kfd h LYS 27 N 0.00 0.00 0.00 -2.82 2.10 -1.86 -3.39 116.57 110.59 2kfd h LYS 27 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2kfd h LYS 27 Cb 0.00 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.33 2kfd h LYS 27 CO 0.00 0.51 0.00 -2.37 -2.00 0.00 0.00 179.45 175.59 2kfd n THR 28 N -3.15 0.00 0.00 0.07 5.66 -1.26 -4.81 114.28 110.79 2kfd n THR 28 Ca -0.02 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.98 2kfd n THR 28 Cb 0.79 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.57 2kfd n THR 28 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2kfd n GLY 29 N 1.01 -2.80 3.27 1.09 0.00 -1.26 -4.52 105.19 101.98 2kfd n GLY 29 Ca 0.00 0.26 -0.33 0.00 0.00 0.00 0.00 46.02 45.95 2kfd n GLY 29 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2kfd s LYS 30 N -2.77 3.24 0.14 1.61 -0.14 -1.26 -4.90 119.74 115.66 2kfd s LYS 30 Ca 0.00 -0.73 -0.30 0.00 -1.36 0.00 0.00 55.97 53.58 2kfd s LYS 30 Cb 0.00 -2.68 -0.07 0.00 -1.68 0.00 0.00 37.83 33.40 2kfd s LYS 30 CO 0.00 -0.02 1.20 -1.25 -0.76 0.00 0.00 175.35 174.52 2kfd s PRO 31 N 0.91 4.47 -0.04 -1.68 0.04 -1.26 -1.35 135.00 136.09 2kfd s PRO 31 Ca -0.03 1.83 -0.29 0.00 0.04 0.00 0.00 61.00 62.55 2kfd s PRO 31 Cb -0.15 -3.28 -0.08 0.00 0.04 0.00 0.00 34.50 31.03 2kfd s PRO 31 CO -0.01 -0.15 2.02 0.21 0.04 0.00 0.00 177.00 179.11 2kfd s LYS 32 N 0.29 3.85 0.19 4.56 2.20 -1.26 -4.86 119.74 124.71 2kfd s LYS 32 Ca 0.55 2.41 -0.15 0.00 -0.36 0.00 0.00 55.97 58.42 2kfd s LYS 32 Cb -0.31 -4.21 -0.10 0.00 -1.51 0.00 0.00 37.83 31.69 2kfd s LYS 32 CO 0.33 -1.28 0.19 -2.30 -0.36 0.00 0.00 175.35 171.93 2kfd n PRO 33 N 7.87 0.00 0.04 4.03 -0.02 -1.26 -4.87 135.00 140.79 2kfd n PRO 33 Ca 0.23 0.00 0.13 0.00 -2.02 0.00 0.00 63.50 61.84 2kfd n PRO 33 Cb 0.42 -0.62 0.46 0.00 -0.02 0.00 0.00 33.50 33.74 2kfd n PRO 33 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 2kfd n SER 34 N 1.34 0.40 -3.73 2.55 7.64 -1.26 -4.82 113.62 115.75 2kfd n SER 34 Ca 0.09 0.39 -0.14 0.00 1.01 0.00 0.00 58.87 60.23 2kfd n SER 34 Cb 0.20 -0.43 -0.09 0.00 -1.01 0.00 0.00 64.21 62.88 2kfd n SER 34 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2kfd s THR 35 N -3.05 0.02 -0.18 0.44 2.01 -1.26 -5.05 115.64 108.57 2kfd s THR 35 Ca 0.12 -0.17 0.29 0.00 0.31 0.00 0.00 61.69 62.24 2kfd s THR 35 Cb 0.16 -0.62 0.33 0.00 0.01 0.00 0.00 72.50 72.38 2kfd s THR 35 CO 0.59 -0.09 1.85 -0.25 -0.69 0.00 0.00 174.62 176.04 2kfd h TRP 36 N 4.74 0.00 0.13 4.92 2.91 -1.94 -3.08 115.95 123.62 2kfd h TRP 36 Ca -0.28 0.00 -0.01 0.00 1.13 0.00 0.00 58.89 59.74 2kfd h TRP 36 Cb 1.18 0.00 0.00 0.00 -0.51 0.00 0.00 29.16 29.83 2kfd h TRP 36 CO 0.44 0.00 -0.06 0.22 -1.03 0.00 0.00 178.44 178.01 2kfd h ASP 37 N 0.00 -0.15 0.73 2.65 3.58 -1.99 0.28 116.42 121.53 2kfd h ASP 37 Ca 0.00 -0.05 -0.08 0.00 0.42 0.00 0.00 57.03 57.32 2kfd h ASP 37 Cb 0.49 0.04 -0.01 0.00 1.72 0.00 0.00 39.33 41.57 2kfd h ASP 37 CO 0.00 -0.05 -0.40 0.17 -2.88 0.00 0.00 179.24 176.08 2kfd h LEU 38 N -0.23 0.00 0.13 2.28 -0.00 -1.99 -2.23 115.31 113.27 2kfd h LEU 38 Ca -0.02 0.00 -0.01 0.00 -0.00 0.00 0.00 57.88 57.86 2kfd h LEU 38 Cb 0.18 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.85 2kfd h LEU 38 CO 0.03 0.40 -0.06 0.00 -0.00 0.00 0.00 178.44 178.81 2kfd h ALA 39 N 1.60 -0.18 -0.25 0.17 0.00 -1.36 -2.57 119.26 116.67 2kfd h ALA 39 Ca -0.00 -0.23 -0.06 0.00 0.00 0.00 0.00 54.91 54.62 2kfd h ALA 39 Cb 0.87 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.72 2kfd h ALA 39 CO 0.05 -0.34 -0.10 0.66 0.00 0.00 0.00 179.25 179.53 2kfd h SER 40 N -0.70 0.38 -0.55 0.00 4.64 -0.44 0.78 113.55 117.66 2kfd h SER 40 Ca -0.02 -0.08 -0.05 0.00 -0.47 0.00 0.00 61.79 61.17 2kfd h SER 40 Cb 0.52 -0.10 -0.02 0.00 -0.31 0.00 0.00 62.40 62.48 2kfd h SER 40 CO 0.03 0.52 0.16 0.50 -0.87 0.00 0.00 176.83 177.18 2kfd h LYS 41 N 0.38 0.86 0.00 4.77 3.64 -1.40 -1.02 116.57 123.80 2kfd h LYS 41 Ca 0.08 -0.19 0.00 0.00 -1.27 0.00 0.00 60.65 59.27 2kfd h LYS 41 Cb 0.41 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.11 2kfd h LYS 41 CO 0.02 0.79 -0.14 1.49 -2.27 0.00 0.00 179.45 179.34 2kfd h GLU 42 N 0.77 0.00 0.00 1.90 4.57 -1.18 -3.30 114.58 117.34 2kfd h GLU 42 Ca 0.18 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.36 2kfd h GLU 42 Cb 0.29 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.88 2kfd h GLU 42 CO -0.00 0.00 -0.63 -0.11 -1.18 0.00 0.00 179.01 177.09 2kfd n LEU 43 N -2.31 0.61 0.31 1.64 -0.00 0.24 -4.40 117.00 113.09 2kfd n LEU 43 Ca 0.05 0.12 0.19 0.00 -0.00 0.00 0.00 56.01 56.37 2kfd n LEU 43 Cb 0.44 -0.20 1.04 0.00 -0.00 0.00 0.00 43.42 44.70 2kfd n LEU 43 CO 0.32 0.02 1.13 1.23 -0.00 0.00 0.00 177.39 180.09 2kfd h GLY 44 N 4.69 0.00 1.81 -3.96 0.00 -1.30 -0.60 103.07 103.71 2kfd h GLY 44 Ca 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 47.33 47.15 2kfd h GLY 44 CO 0.00 0.00 -0.82 -2.09 0.00 0.00 0.00 176.54 173.63 2kfd h GLU 45 N 0.00 0.18 -6.25 4.80 4.81 -1.87 -3.41 114.58 112.84 2kfd h GLU 45 Ca -0.00 -0.18 -0.59 0.00 -0.13 0.00 0.00 59.36 58.46 2kfd h GLU 45 Cb 0.10 0.05 -0.10 0.00 0.63 0.00 0.00 28.75 29.43 2kfd h GLU 45 CO 0.00 0.90 0.65 -1.12 -0.73 0.00 0.00 179.01 178.71 2kfd s SER 46 N -6.91 6.52 0.00 1.04 0.01 -0.23 -4.90 113.70 109.23 2kfd s SER 46 Ca -0.03 0.16 0.07 0.00 1.31 0.00 0.00 55.95 57.46 2kfd s SER 46 Cb 0.11 -2.47 0.40 0.00 0.21 0.00 0.00 66.02 64.26 2kfd s SER 46 CO 0.82 -1.10 0.96 0.00 0.41 0.00 0.00 173.24 174.34 2kfd n LEU 47 N 7.31 0.00 0.16 2.44 -0.00 -1.26 -1.96 117.00 123.68 2kfd n LEU 47 Ca 0.07 0.00 0.13 0.00 -0.00 0.00 0.00 56.01 56.21 2kfd n LEU 47 Cb 0.49 0.00 0.30 0.00 -0.00 0.00 0.00 43.42 44.21 2kfd n LEU 47 CO 0.65 0.00 0.85 -0.08 -0.00 0.00 0.00 177.39 178.82 2kfd h GLU 48 N 0.00 0.00 0.00 1.47 4.57 -1.90 -0.57 114.58 118.15 2kfd h GLU 48 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 2kfd h GLU 48 Cb 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.59 2kfd h GLU 48 CO 0.00 0.00 -0.40 0.98 -1.18 0.00 0.00 179.01 178.41 2kfd n TYR 49 N -2.63 0.45 1.10 0.92 9.36 -0.83 -2.40 117.16 123.13 2kfd n TYR 49 Ca 0.05 0.13 0.12 0.00 3.32 0.00 0.00 57.90 61.52 2kfd n TYR 49 Cb 0.47 -0.61 0.28 0.00 -0.63 0.00 0.00 39.34 38.85 2kfd n TYR 49 CO 0.00 0.00 0.00 1.17 0.22 0.00 0.00 176.86 178.25 2kfd n LYS 50 N -1.94 0.37 -0.03 2.98 4.81 -0.53 -3.74 118.16 120.09 2kfd n LYS 50 Ca 0.05 -0.23 0.11 0.00 -0.87 0.00 0.00 58.31 57.37 2kfd n LYS 50 Cb 0.40 -1.50 0.56 0.00 0.02 0.00 0.00 35.03 34.52 2kfd n LYS 50 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2kfd n ALA 51 N -1.12 2.59 -2.53 3.14 0.00 -0.34 -3.52 120.51 118.73 2kfd n ALA 51 Ca 0.08 -0.30 0.02 0.00 0.00 0.00 0.00 53.44 53.24 2kfd n ALA 51 Cb 0.34 -1.25 0.02 0.00 0.00 0.00 0.00 19.45 18.56 2kfd n ALA 51 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2kfd n LEU 52 N -0.34 0.93 0.04 0.00 7.94 -1.25 -4.88 117.00 119.45 2kfd n LEU 52 Ca 0.17 -2.20 0.12 0.00 -1.11 0.00 0.00 56.01 52.99 2kfd n LEU 52 Cb 0.20 0.09 0.47 0.00 0.53 0.00 0.00 43.42 44.70 2kfd n LEU 52 CO 0.13 0.68 0.86 0.61 -1.11 0.00 0.00 177.39 178.56 2kfd n GLY 53 N 0.24 -1.37 0.03 -3.96 0.00 -1.23 -3.26 105.19 95.65 2kfd n GLY 53 Ca 0.04 -0.04 -0.03 0.00 0.00 0.00 0.00 46.02 45.98 2kfd n GLY 53 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2kfd n ASP 54 N -1.79 3.19 -1.83 1.61 2.03 -1.26 -4.51 116.55 113.99 2kfd n ASP 54 Ca 0.05 0.00 -0.10 0.00 0.52 0.00 0.00 54.79 55.26 2kfd n ASP 54 Cb 0.29 0.71 -0.05 0.00 -0.72 0.00 0.00 41.12 41.35 2kfd n ASP 54 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2kfd n GLU 55 N -2.25 1.60 -0.07 -0.67 4.71 -1.20 -4.65 120.64 118.12 2kfd n GLU 55 Ca -0.11 -0.85 -0.07 0.00 -0.01 0.00 0.00 57.16 56.12 2kfd n GLU 55 Cb 0.72 -1.54 -0.01 0.00 -1.01 0.00 0.00 31.44 29.60 2kfd n GLU 55 CO 0.00 0.00 0.00 -0.44 0.09 0.00 0.00 177.13 176.78 2kfd h ASP 56 N 1.91 -0.45 0.40 1.62 5.19 -1.78 -0.03 116.42 123.28 2kfd h ASP 56 Ca 0.15 0.11 -0.12 0.00 -0.62 0.00 0.00 57.03 56.55 2kfd h ASP 56 Cb 1.11 0.25 -0.01 0.00 0.18 0.00 0.00 39.33 40.85 2kfd h ASP 56 CO 0.31 -0.17 -0.53 -0.55 -3.12 0.00 0.00 179.24 175.17 2kfd h ASN 57 N -0.10 0.16 0.32 6.45 -1.07 -1.90 0.22 115.58 119.67 2kfd h ASN 57 Ca 0.14 -0.08 -0.02 0.00 0.07 0.00 0.00 56.30 56.41 2kfd h ASN 57 Cb 0.32 -0.05 0.00 0.00 -2.07 0.00 0.00 38.32 36.52 2kfd h ASN 57 CO -0.34 0.67 -0.16 0.40 0.07 0.00 0.00 177.43 178.07 2kfd h ILE 58 N 0.12 0.69 -0.17 6.14 5.03 -1.74 -2.22 117.51 125.35 2kfd h ILE 58 Ca 0.00 -0.06 0.05 0.00 -0.12 0.00 0.00 64.86 64.73 2kfd h ILE 58 Cb 0.98 0.72 -0.06 0.00 -3.03 0.00 0.00 36.82 35.44 2kfd h ILE 58 CO 0.08 0.01 -0.20 -0.09 -0.68 0.00 0.00 178.15 177.27 2kfd h ARG 59 N -0.47 -0.23 -0.33 2.37 2.43 -0.21 0.20 114.38 118.14 2kfd h ARG 59 Ca -0.04 0.02 0.07 0.00 -0.81 0.00 0.00 59.98 59.21 2kfd h ARG 59 Cb 0.36 0.05 -0.08 0.00 -0.42 0.00 0.00 29.97 29.88 2kfd h ARG 59 CO 0.07 -0.15 -0.22 0.00 -1.51 0.00 0.00 179.97 178.16 2kfd h ARG 60 N -0.24 -0.18 -0.34 0.20 3.08 -1.02 -2.67 114.38 113.22 2kfd h ARG 60 Ca 0.11 0.01 -0.11 0.00 0.07 0.00 0.00 59.98 60.07 2kfd h ARG 60 Cb 0.40 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.49 2kfd h ARG 60 CO -0.31 -0.12 -0.21 0.37 -1.07 0.00 0.00 179.97 178.64 2kfd h GLN 61 N -0.19 0.74 -0.18 0.04 5.75 -0.48 -1.24 115.11 119.55 2kfd h GLN 61 Ca 0.17 -0.34 0.02 0.00 -0.15 0.00 0.00 58.65 58.35 2kfd h GLN 61 Cb 0.44 -0.01 -0.02 0.00 1.07 0.00 0.00 27.48 28.96 2kfd h GLN 61 CO -0.44 0.95 0.05 0.82 -2.65 0.00 0.00 178.83 177.57 2kfd h ILE 62 N 0.51 0.94 -0.52 2.39 2.04 -0.65 -1.55 117.51 120.68 2kfd h ILE 62 Ca 0.07 -0.04 0.10 0.00 1.00 0.00 0.00 64.86 65.98 2kfd h ILE 62 Cb 0.76 0.80 -0.08 0.00 -0.74 0.00 0.00 36.82 37.56 2kfd h ILE 62 CO 0.06 0.02 0.06 0.15 0.00 0.00 0.00 178.15 178.45 2kfd h PHE 63 N 0.13 0.09 -0.84 1.37 3.57 -1.10 0.20 116.94 120.35 2kfd h PHE 63 Ca 0.08 0.03 0.01 0.00 3.53 0.00 0.00 57.97 61.63 2kfd h PHE 63 Cb 0.06 0.04 -0.04 0.00 2.79 0.00 0.00 35.95 38.80 2kfd h PHE 63 CO -0.13 -0.06 0.56 1.49 -2.23 0.00 0.00 178.31 177.94 2kfd h GLU 64 N 0.19 1.09 0.00 1.11 4.81 -0.88 -2.66 114.58 118.25 2kfd h GLU 64 Ca 0.26 -0.07 -0.02 0.00 -0.13 0.00 0.00 59.36 59.41 2kfd h GLU 64 Cb 0.38 -0.25 -0.00 0.00 0.63 0.00 0.00 28.75 29.51 2kfd h GLU 64 CO -0.38 0.72 -0.27 0.22 -0.73 0.00 0.00 179.01 178.58 2kfd h ASP 65 N 1.13 0.00 -0.78 1.04 3.58 -0.21 -3.40 116.42 117.78 2kfd h ASP 65 Ca 0.32 0.00 0.12 0.00 0.42 0.00 0.00 57.03 57.89 2kfd h ASP 65 Cb -0.10 0.00 -0.13 0.00 1.72 0.00 0.00 39.33 40.81 2kfd h ASP 65 CO -0.08 0.08 -0.39 -0.26 -2.88 0.00 0.00 179.24 175.72 2kfd h PHE 66 N 0.00 -1.10 -4.28 0.28 0.04 -0.28 -3.48 116.94 108.12 2kfd h PHE 66 Ca -0.01 0.09 0.00 0.00 2.80 0.00 0.00 57.97 60.86 2kfd h PHE 66 Cb 1.07 0.59 0.00 0.00 2.20 0.00 0.00 35.95 39.81 2kfd h PHE 66 CO 0.00 -0.40 -0.84 1.63 -0.60 0.00 0.00 178.31 178.11 2kfd n LYS 67 N -5.44 -4.46 0.00 1.51 4.76 -1.26 -5.06 118.16 108.22 2kfd n LYS 67 Ca 0.06 3.30 0.00 0.00 -2.87 0.00 0.00 58.31 58.81 2kfd n LYS 67 Cb 0.37 -4.08 0.00 0.00 -1.84 0.00 0.00 35.03 29.48 2kfd n LYS 67 CO 0.00 0.00 0.00 -0.35 -1.37 0.00 0.00 177.40 175.68 2kfd n PRO 68 N 1.56 2.70 -0.96 1.97 -0.04 -1.26 -5.15 135.00 133.82 2kfd n PRO 68 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 2kfd n PRO 68 Cb 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.46 2kfd n PRO 68 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55