#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 0.70 -0.39 1.20 -0.00 -2.04 0.24 114.58 114.29 2kfd h GLU 6 Ca 0.00 -0.04 0.02 0.00 -0.00 0.00 0.00 59.36 59.33 2kfd h GLU 6 Cb 0.00 -0.16 -0.03 0.00 -0.00 0.00 0.00 28.75 28.57 2kfd h GLU 6 CO 0.00 0.46 0.23 0.00 -0.00 0.00 0.00 179.01 179.70 2kfd h ARG 7 N 0.72 0.45 -0.60 1.06 2.47 -2.05 0.44 114.38 116.87 2kfd h ARG 7 Ca 0.51 -0.03 -0.10 0.00 -1.26 0.00 0.00 59.98 59.10 2kfd h ARG 7 Cb 0.72 -0.10 -0.02 0.00 -1.65 0.00 0.00 29.97 28.91 2kfd h ARG 7 CO -0.36 0.29 -0.03 -0.09 0.56 0.00 0.00 179.97 180.35 2kfd h ARG 8 N 0.46 1.07 -0.33 0.04 2.43 -1.67 -1.31 114.38 115.08 2kfd h ARG 8 Ca 0.15 -0.35 0.04 0.00 -0.81 0.00 0.00 59.98 59.01 2kfd h ARG 8 Cb 0.01 -0.09 -0.04 0.00 -0.42 0.00 0.00 29.97 29.43 2kfd h ARG 8 CO -0.07 1.06 0.09 0.82 -1.51 0.00 0.00 179.97 180.35 2kfd h ILE 9 N 0.97 0.87 -0.05 1.20 2.04 -0.10 -2.49 117.51 119.95 2kfd h ILE 9 Ca 0.17 -0.07 -0.13 0.00 1.00 0.00 0.00 64.86 65.82 2kfd h ILE 9 Cb 0.59 0.64 -0.01 0.00 -0.74 0.00 0.00 36.82 37.30 2kfd h ILE 9 CO 0.04 0.04 -0.57 0.25 0.00 0.00 0.00 178.15 177.90 2kfd h LEU 10 N 0.21 0.19 -0.15 1.44 7.12 0.30 0.27 115.31 124.69 2kfd h LEU 10 Ca 0.15 -0.10 -0.23 0.00 0.13 0.00 0.00 57.88 57.82 2kfd h LEU 10 Cb 0.15 -0.05 0.01 0.00 -0.53 0.00 0.00 40.66 40.23 2kfd h LEU 10 CO -0.18 0.72 -0.94 1.05 -0.13 0.00 0.00 178.44 178.96 2kfd h GLU 11 N 0.13 0.52 -0.51 1.25 4.11 -1.20 0.59 114.58 119.47 2kfd h GLU 11 Ca -0.00 -0.54 -0.03 0.00 0.07 0.00 0.00 59.36 58.86 2kfd h GLU 11 Cb 1.04 0.15 -0.02 0.00 0.50 0.00 0.00 28.75 30.42 2kfd h GLU 11 CO 0.08 1.17 0.18 1.96 0.07 0.00 0.00 179.01 182.48 2kfd h GLN 12 N 0.31 0.77 -0.33 1.06 1.08 -0.97 -0.45 115.11 116.58 2kfd h GLN 12 Ca -0.09 -0.15 -0.04 0.00 -1.45 0.00 0.00 58.65 56.92 2kfd h GLN 12 Cb 1.57 -0.12 -0.01 0.00 -0.05 0.00 0.00 27.48 28.87 2kfd h GLN 12 CO 0.17 0.70 0.05 0.87 -0.95 0.00 0.00 178.83 179.67 2kfd h LYS 13 N 0.68 0.56 -0.33 1.46 1.79 -0.42 0.15 116.57 120.45 2kfd h LYS 13 Ca 0.17 -0.15 0.07 0.00 -2.18 0.00 0.00 60.65 58.55 2kfd h LYS 13 Cb 0.23 -0.06 -0.07 0.00 -1.58 0.00 0.00 32.23 30.75 2kfd h LYS 13 CO -0.01 0.65 -0.12 -0.22 -1.08 0.00 0.00 179.45 178.66 2kfd h LYS 14 N 0.39 -0.05 -0.08 3.15 3.64 0.42 0.41 116.57 124.44 2kfd h LYS 14 Ca 0.10 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.45 2kfd h LYS 14 Cb 0.36 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 32.19 2kfd h LYS 14 CO 0.01 -0.04 -0.07 1.25 -2.27 0.00 0.00 179.45 178.34 2kfd h HIS 15 N -0.05 0.23 0.00 1.91 2.76 -0.97 -2.23 115.15 116.79 2kfd h HIS 15 Ca 0.17 -0.06 -0.03 0.00 -2.20 0.00 0.00 60.37 58.25 2kfd h HIS 15 Cb 0.31 -0.05 -0.00 0.00 1.55 0.00 0.00 27.41 29.21 2kfd h HIS 15 CO -0.34 0.60 -0.13 -0.92 -1.30 0.00 0.00 177.93 175.84 2kfd h TYR 16 N -0.21 0.00 0.00 5.26 3.20 -0.77 0.35 116.97 124.79 2kfd h TYR 16 Ca 0.02 0.00 -0.16 0.00 3.14 0.00 0.00 58.73 61.72 2kfd h TYR 16 Cb 0.56 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 38.81 2kfd h TYR 16 CO 0.08 0.13 -0.77 0.35 -1.64 0.00 0.00 178.16 176.31 2kfd h PHE 17 N 0.00 0.00 0.01 -3.82 3.57 -0.16 0.69 116.94 117.23 2kfd h PHE 17 Ca -0.00 0.00 -0.21 0.00 3.53 0.00 0.00 57.97 61.29 2kfd h PHE 17 Cb 0.76 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.49 2kfd h PHE 17 CO 0.00 0.77 -0.92 2.35 -2.23 0.00 0.00 178.31 178.29 2kfd h TRP 18 N 0.00 0.30 -0.05 0.41 -0.00 -0.72 0.73 115.95 116.62 2kfd h TRP 18 Ca -0.01 -0.17 -0.15 0.00 -0.00 0.00 0.00 58.89 58.56 2kfd h TRP 18 Cb 1.46 -0.03 -0.01 0.00 -0.00 0.00 0.00 29.16 30.58 2kfd h TRP 18 CO 0.00 1.01 -0.65 1.25 -0.00 0.00 0.00 178.44 180.05 2kfd h LEU 19 N 0.10 0.25 0.06 0.65 6.46 -0.14 0.41 115.31 123.10 2kfd h LEU 19 Ca -0.05 -0.16 -0.00 0.00 -0.12 0.00 0.00 57.88 57.55 2kfd h LEU 19 Cb 1.56 -0.07 0.00 0.00 -0.73 0.00 0.00 40.66 41.42 2kfd h LEU 19 CO 0.14 0.83 -0.03 0.25 -0.62 0.00 0.00 178.44 179.02 2kfd h LEU 20 N 0.16 -0.06 -0.94 2.25 7.12 0.58 -0.79 115.31 123.63 2kfd h LEU 20 Ca -0.01 -0.50 -0.11 0.00 0.13 0.00 0.00 57.88 57.39 2kfd h LEU 20 Cb 1.17 0.02 -0.01 0.00 -0.53 0.00 0.00 40.66 41.30 2kfd h LEU 20 CO 0.10 0.49 -0.41 0.25 -0.13 0.00 0.00 178.44 178.75 2kfd h LEU 21 N -0.65 0.25 0.17 2.25 7.12 0.56 -1.22 115.31 123.80 2kfd h LEU 21 Ca -0.01 -0.11 -0.30 0.00 0.13 0.00 0.00 57.88 57.60 2kfd h LEU 21 Cb 0.56 -0.07 0.02 0.00 -0.53 0.00 0.00 40.66 40.64 2kfd h LEU 21 CO 0.01 0.64 -1.33 -0.61 -0.13 0.00 0.00 178.44 177.02 2kfd h GLN 22 N 0.21 0.37 -0.54 1.25 4.15 -0.26 0.66 115.11 120.95 2kfd h GLN 22 Ca 0.02 -0.64 0.05 0.00 0.77 0.00 0.00 58.65 58.85 2kfd h GLN 22 Cb 0.81 0.24 -0.05 0.00 0.21 0.00 0.00 27.48 28.69 2kfd h GLN 22 CO 0.06 1.30 0.27 -0.09 -1.93 0.00 0.00 178.83 178.44 2kfd h ARG 23 N 0.10 0.49 0.10 1.69 2.43 -0.89 -1.77 114.38 116.55 2kfd h ARG 23 Ca -0.18 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 58.96 2kfd h ARG 23 Cb 2.04 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 31.48 2kfd h ARG 23 CO 0.23 0.33 -0.05 1.15 -1.51 0.00 0.00 179.97 180.12 2kfd h THR 24 N 0.51 0.00 -3.64 0.20 2.02 -1.25 -3.42 112.91 107.34 2kfd h THR 24 Ca 0.24 -0.28 -0.76 0.00 0.77 0.00 0.00 66.41 66.38 2kfd h THR 24 Cb 0.17 0.00 -0.29 0.00 -1.74 0.00 0.00 68.15 66.29 2kfd h THR 24 CO -0.18 0.00 -0.10 -0.31 0.37 0.00 0.00 175.52 175.31 2kfd s TYR 25 N -1.98 3.60 0.00 3.16 2.02 0.23 -3.67 117.35 120.70 2kfd s TYR 25 Ca -0.02 -2.11 0.00 0.00 -0.37 0.00 0.00 57.07 54.57 2kfd s TYR 25 Cb 0.00 -3.62 0.00 0.00 -0.40 0.00 0.00 41.96 37.94 2kfd s TYR 25 CO 0.06 -0.95 0.00 2.41 -1.57 0.00 0.00 175.55 175.50 2kfd n THR 26 N 4.04 0.00 0.12 -0.71 -1.04 -0.67 -3.89 114.28 112.13 2kfd n THR 26 Ca 0.08 0.00 -0.00 0.00 -2.04 0.00 0.00 64.05 62.08 2kfd n THR 26 Cb 0.43 -1.40 0.06 0.00 -1.82 0.00 0.00 70.33 67.60 2kfd n THR 26 CO 0.00 0.00 0.00 0.11 -0.64 0.00 0.00 175.07 174.54 2kfd h LYS 27 N 0.00 0.00 0.00 -2.82 1.57 -1.83 -3.39 116.57 110.10 2kfd h LYS 27 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2kfd h LYS 27 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 2kfd h LYS 27 CO 0.00 0.65 0.00 -2.37 -0.57 0.00 0.00 179.45 177.16 2kfd n THR 28 N -3.39 0.00 0.00 -0.16 5.66 -1.26 -4.85 114.28 110.28 2kfd n THR 28 Ca 0.01 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.01 2kfd n THR 28 Cb 0.74 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.52 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 0.65 -2.05 3.80 1.09 0.00 -1.26 -4.61 105.19 102.81 2kfd n GLY 29 Ca 0.00 0.20 -0.36 0.00 0.00 0.00 0.00 46.02 45.86 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 -0.43 3.25 0.50 1.61 -0.14 -1.24 -4.87 119.74 118.43 2kfd s LYS 30 Ca 0.00 -0.25 -0.23 0.00 -1.36 0.00 0.00 55.97 54.13 2kfd s LYS 30 Cb 0.00 -3.02 -0.06 0.00 -1.68 0.00 0.00 37.83 33.07 2kfd s LYS 30 CO 0.00 0.74 1.33 -2.14 -0.76 0.00 0.00 175.35 174.53 2kfd s PRO 31 N -1.02 3.40 -0.51 -1.68 0.02 -1.26 -1.66 135.00 132.28 2kfd s PRO 31 Ca 0.15 2.18 -0.28 0.00 0.02 0.00 0.00 61.00 63.07 2kfd s PRO 31 Cb -0.12 -2.39 0.01 0.00 0.02 0.00 0.00 34.50 32.03 2kfd s PRO 31 CO 0.04 -0.97 1.39 0.21 -0.33 0.00 0.00 177.00 177.34 2kfd s LYS 32 N -2.74 3.42 0.03 5.54 2.20 -1.26 -4.81 119.74 122.12 2kfd s LYS 32 Ca 0.67 0.62 -0.03 0.00 -0.36 0.00 0.00 55.97 56.87 2kfd s LYS 32 Cb -0.39 -4.08 -0.02 0.00 -1.51 0.00 0.00 37.83 31.84 2kfd s LYS 32 CO 0.47 -1.78 0.04 -2.30 -0.36 0.00 0.00 175.35 171.43 2kfd n PRO 33 N 8.41 0.00 0.08 4.03 -0.02 -1.26 -4.90 135.00 141.34 2kfd n PRO 33 Ca 0.14 0.00 -0.11 0.00 -2.02 0.00 0.00 63.50 61.50 2kfd n PRO 33 Cb 0.49 -0.11 -0.06 0.00 -0.02 0.00 0.00 33.50 33.80 2kfd n PRO 33 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 2kfd h SER 34 N 0.09 0.34 -4.27 2.55 0.02 -2.02 -3.45 113.55 106.82 2kfd h SER 34 Ca -0.04 -0.30 -0.34 0.00 -0.84 0.00 0.00 61.79 60.28 2kfd h SER 34 Cb 0.16 -0.11 -0.26 0.00 0.14 0.00 0.00 62.40 62.34 2kfd h SER 34 CO 0.06 1.14 -0.76 -0.89 -1.14 0.00 0.00 176.83 175.24 2kfd s THR 35 N -3.05 0.61 -0.05 -2.27 2.01 -1.26 -5.04 115.64 106.59 2kfd s THR 35 Ca -0.03 -0.65 0.31 0.00 0.31 0.00 0.00 61.69 61.63 2kfd s THR 35 Cb 0.09 -0.58 0.35 0.00 0.01 0.00 0.00 72.50 72.37 2kfd s THR 35 CO 0.85 -0.05 1.92 -0.25 -0.69 0.00 0.00 174.62 176.40 2kfd h TRP 36 N 5.34 0.00 0.18 4.92 2.91 -1.95 -3.14 115.95 124.21 2kfd h TRP 36 Ca -0.32 0.00 -0.00 0.00 1.13 0.00 0.00 58.89 59.69 2kfd h TRP 36 Cb 1.19 0.00 -0.01 0.00 -0.51 0.00 0.00 29.16 29.84 2kfd h TRP 36 CO 0.50 0.00 -0.12 0.22 -1.03 0.00 0.00 178.44 178.01 2kfd h ASP 37 N 0.00 -0.31 0.34 2.65 3.58 -1.99 0.12 116.42 120.82 2kfd h ASP 37 Ca 0.00 0.02 -0.08 0.00 0.42 0.00 0.00 57.03 57.40 2kfd h ASP 37 Cb 0.40 0.10 -0.01 0.00 1.72 0.00 0.00 39.33 41.54 2kfd h ASP 37 CO 0.00 -0.19 -0.35 0.17 -2.88 0.00 0.00 179.24 175.98 2kfd h LEU 38 N -0.30 0.02 0.18 2.28 -0.00 -1.99 -2.28 115.31 113.22 2kfd h LEU 38 Ca -0.01 -0.01 -0.01 0.00 -0.00 0.00 0.00 57.88 57.85 2kfd h LEU 38 Cb 0.26 -0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.91 2kfd h LEU 38 CO 0.01 0.37 -0.09 0.00 -0.00 0.00 0.00 178.44 178.73 2kfd h ALA 39 N 1.63 -0.24 0.00 0.17 0.00 -1.42 -2.62 119.26 116.78 2kfd h ALA 39 Ca -0.00 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.70 2kfd h ALA 39 Cb 0.63 0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.51 2kfd h ALA 39 CO 0.05 -0.47 -0.16 0.66 0.00 0.00 0.00 179.25 179.32 2kfd h SER 40 N -0.57 0.00 0.13 0.00 4.64 -0.71 0.17 113.55 117.21 2kfd h SER 40 Ca -0.02 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.29 2kfd h SER 40 Cb 0.43 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.52 2kfd h SER 40 CO 0.04 0.16 -0.06 0.50 -0.87 0.00 0.00 176.83 176.60 2kfd h LYS 41 N 0.00 -0.17 0.00 4.77 1.63 -1.15 -1.94 116.57 119.71 2kfd h LYS 41 Ca -0.00 0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.81 2kfd h LYS 41 Cb 0.36 0.04 0.00 0.00 -0.60 0.00 0.00 32.23 32.02 2kfd h LYS 41 CO 0.02 0.02 -0.15 1.49 -3.45 0.00 0.00 179.45 177.38 2kfd h GLU 42 N -0.32 0.00 0.00 1.90 4.81 -1.13 -3.19 114.58 116.64 2kfd h GLU 42 Ca -0.02 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.21 2kfd h GLU 42 Cb 0.26 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.64 2kfd h GLU 42 CO 0.03 0.00 -0.01 1.25 -0.73 0.00 0.00 179.01 179.55 2kfd h LEU 43 N 0.00 0.00 -2.29 1.64 7.12 -0.56 -3.35 115.31 117.87 2kfd h LEU 43 Ca 0.00 0.00 0.03 0.00 0.13 0.00 0.00 57.88 58.04 2kfd h LEU 43 Cb 0.95 0.00 -0.00 0.00 -0.53 0.00 0.00 40.66 41.08 2kfd h LEU 43 CO 0.00 0.01 0.12 1.23 -0.13 0.00 0.00 178.44 179.66 2kfd h GLY 44 N 3.21 0.00 2.00 3.75 0.00 -1.34 0.11 103.07 110.80 2kfd h GLY 44 Ca -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.33 2kfd h GLY 44 CO 0.00 0.00 -0.00 1.05 0.00 0.00 0.00 176.54 177.59 2kfd h GLU 45 N 0.00 0.00 -5.21 4.80 4.11 -1.84 -3.42 114.58 113.02 2kfd h GLU 45 Ca 0.05 0.00 -0.63 0.00 0.07 0.00 0.00 59.36 58.85 2kfd h GLU 45 Cb 0.29 0.00 -0.14 0.00 0.50 0.00 0.00 28.75 29.39 2kfd h GLU 45 CO -0.00 0.00 -0.15 -1.12 0.07 0.00 0.00 179.01 177.81 2kfd s SER 46 N -5.92 6.31 0.00 3.06 0.01 0.38 -4.95 113.70 112.59 2kfd s SER 46 Ca 0.04 0.29 0.14 0.00 1.31 0.00 0.00 55.95 57.73 2kfd s SER 46 Cb 0.07 -2.24 0.70 0.00 0.21 0.00 0.00 66.02 64.77 2kfd s SER 46 CO 0.60 -0.26 1.38 0.18 0.41 0.00 0.00 173.24 175.55 2kfd n LEU 47 N 5.45 0.00 0.22 2.44 7.99 -1.26 -2.38 117.00 129.47 2kfd n LEU 47 Ca -0.07 0.30 0.13 0.00 -0.01 0.00 0.00 56.01 56.37 2kfd n LEU 47 Cb 0.50 -0.30 0.29 0.00 -0.11 0.00 0.00 43.42 43.80 2kfd n LEU 47 CO 0.39 -0.16 0.85 -0.08 -1.51 0.00 0.00 177.39 176.88 2kfd h GLU 48 N 0.00 0.00 0.00 3.23 4.57 -1.92 0.29 114.58 120.74 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 0.14 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.73 2kfd h GLU 48 CO 0.00 0.00 -0.49 0.98 -1.18 0.00 0.00 179.01 178.32 2kfd n TYR 49 N -3.04 0.60 0.88 0.92 9.36 -1.00 -2.41 117.16 122.47 2kfd n TYR 49 Ca 0.03 0.17 0.12 0.00 3.32 0.00 0.00 57.90 61.55 2kfd n TYR 49 Cb 0.48 -0.69 0.30 0.00 -0.63 0.00 0.00 39.34 38.80 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 -2.11 0.08 0.00 2.98 4.81 -0.15 -3.34 118.16 120.44 2kfd n LYS 50 Ca 0.04 0.03 0.15 0.00 -0.87 0.00 0.00 58.31 57.66 2kfd n LYS 50 Cb 0.43 -1.56 0.74 0.00 0.02 0.00 0.00 35.03 34.67 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 -1.59 2.67 -1.97 3.14 0.00 0.83 -3.70 120.51 119.89 2kfd n ALA 51 Ca 0.05 -0.26 0.03 0.00 0.00 0.00 0.00 53.44 53.26 2kfd n ALA 51 Cb 0.37 -1.39 0.13 0.00 0.00 0.00 0.00 19.45 18.55 2kfd n ALA 51 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2kfd n LEU 52 N -0.79 2.31 0.28 0.00 4.77 -1.21 -4.77 117.00 117.59 2kfd n LEU 52 Ca 0.19 -3.35 0.16 0.00 -0.03 0.00 0.00 56.01 52.99 2kfd n LEU 52 Cb 0.22 -0.30 0.93 0.00 -2.33 0.00 0.00 43.42 41.94 2kfd n LEU 52 CO 0.20 1.17 1.14 1.23 -1.33 0.00 0.00 177.39 179.80 2kfd h GLY 53 N 1.17 0.00 0.00 -0.72 0.00 -1.70 -2.95 103.07 98.87 2kfd h GLY 53 Ca -0.05 0.00 -0.23 0.00 0.00 0.00 0.00 47.33 47.05 2kfd h GLY 53 CO 0.10 0.00 -1.87 1.34 0.00 0.00 0.00 176.54 176.11 2kfd n ASP 54 N -3.73 2.61 -2.29 0.19 2.03 -1.26 -4.47 116.55 109.63 2kfd n ASP 54 Ca -0.02 -0.06 -0.16 0.00 0.52 0.00 0.00 54.79 55.07 2kfd n ASP 54 Cb 0.14 0.00 -0.13 0.00 -0.72 0.00 0.00 41.12 40.42 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 -2.83 2.12 -0.05 -0.67 4.71 -1.17 -4.60 120.64 118.15 2kfd n GLU 55 Ca -0.26 -1.13 -0.13 0.00 -0.01 0.00 0.00 57.16 55.64 2kfd n GLU 55 Cb 0.82 -2.11 -0.07 0.00 -1.01 0.00 0.00 31.44 29.07 2kfd n GLU 55 CO 0.00 0.00 0.00 0.38 0.09 0.00 0.00 177.13 177.60 2kfd h ASP 56 N 3.67 0.31 0.97 1.62 2.03 -1.74 -1.89 116.42 121.39 2kfd h ASP 56 Ca 0.30 -0.47 -0.05 0.00 -0.73 0.00 0.00 57.03 56.08 2kfd h ASP 56 Cb 1.16 -0.09 -0.01 0.00 -0.83 0.00 0.00 39.33 39.56 2kfd h ASP 56 CO 0.54 0.71 -0.25 -0.55 -1.03 0.00 0.00 179.24 178.67 2kfd h ASN 57 N -0.09 0.00 0.34 4.15 7.08 -1.88 -2.25 115.58 122.93 2kfd h ASN 57 Ca 0.02 0.00 -0.02 0.00 -3.08 0.00 0.00 56.30 53.23 2kfd h ASN 57 Cb 0.62 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.86 2kfd h ASN 57 CO 0.03 0.25 -0.16 0.40 -2.08 0.00 0.00 177.43 175.86 2kfd h ILE 58 N 0.00 0.65 -0.67 6.14 5.03 -1.86 -2.39 117.51 124.41 2kfd h ILE 58 Ca -0.00 -0.52 0.07 0.00 -0.12 0.00 0.00 64.86 64.29 2kfd h ILE 58 Cb 0.80 0.90 -0.06 0.00 -3.03 0.00 0.00 36.82 35.43 2kfd h ILE 58 CO 0.03 0.10 0.35 -0.09 -0.68 0.00 0.00 178.15 177.86 2kfd h ARG 59 N -0.76 0.61 -0.50 2.37 2.43 -1.06 0.21 114.38 117.69 2kfd h ARG 59 Ca -0.05 -0.04 -0.07 0.00 -0.81 0.00 0.00 59.98 59.02 2kfd h ARG 59 Cb 0.51 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 29.90 2kfd h ARG 59 CO 0.08 0.41 0.04 0.07 -1.51 0.00 0.00 179.97 179.06 2kfd h ARG 60 N 0.63 0.85 0.00 0.20 0.11 -1.47 -2.25 114.38 112.45 2kfd h ARG 60 Ca 0.31 -0.25 -0.26 0.00 0.10 0.00 0.00 59.98 59.89 2kfd h ARG 60 Cb 0.25 -0.09 0.02 0.00 1.11 0.00 0.00 29.97 31.26 2kfd h ARG 60 CO -0.22 0.86 -1.02 1.96 0.10 0.00 0.00 179.97 181.66 2kfd h GLN 61 N 0.71 0.61 -0.16 0.08 1.08 -0.72 -2.49 115.11 114.23 2kfd h GLN 61 Ca 0.15 -0.66 0.00 0.00 -1.45 0.00 0.00 58.65 56.69 2kfd h GLN 61 Cb 0.45 0.19 -0.01 0.00 -0.05 0.00 0.00 27.48 28.06 2kfd h GLN 61 CO 0.02 1.26 0.10 -0.84 -0.95 0.00 0.00 178.83 178.42 2kfd h ILE 62 N 0.34 1.03 -0.51 2.54 3.07 -0.66 -0.47 117.51 122.85 2kfd h ILE 62 Ca -0.12 -0.07 0.10 0.00 1.55 0.00 0.00 64.86 66.33 2kfd h ILE 62 Cb 1.66 0.81 -0.10 0.00 -0.27 0.00 0.00 36.82 38.92 2kfd h ILE 62 CO 0.19 0.04 -0.17 0.15 -1.05 0.00 0.00 178.15 177.31 2kfd h PHE 63 N 0.20 -0.39 -0.44 0.16 3.57 -1.35 0.56 116.94 119.25 2kfd h PHE 63 Ca 0.06 0.05 -0.12 0.00 3.53 0.00 0.00 57.97 61.49 2kfd h PHE 63 Cb -0.01 0.25 -0.02 0.00 2.79 0.00 0.00 35.95 38.96 2kfd h PHE 63 CO -0.07 -0.26 -0.19 1.49 -2.23 0.00 0.00 178.31 177.05 2kfd h GLU 64 N -0.05 0.85 -0.00 1.11 4.81 -1.30 -2.94 114.58 117.07 2kfd h GLU 64 Ca 0.24 -0.34 0.00 0.00 -0.13 0.00 0.00 59.36 59.14 2kfd h GLU 64 Cb 0.42 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.76 2kfd h GLU 64 CO -0.55 0.97 -0.11 -3.47 -0.73 0.00 0.00 179.01 175.12 2kfd n ASP 65 N -4.12 0.26 0.02 1.04 2.03 -0.20 -4.47 116.55 111.10 2kfd n ASP 65 Ca 0.00 -0.19 -0.10 0.00 0.52 0.00 0.00 54.79 55.02 2kfd n ASP 65 Cb 0.42 -0.18 -0.03 0.00 -0.72 0.00 0.00 41.12 40.61 2kfd n ASP 65 CO 0.00 0.00 0.00 -0.26 -1.92 0.00 0.00 177.20 175.02 2kfd h PHE 66 N 0.24 -0.48 -4.75 -0.67 0.04 0.24 -3.49 116.94 108.08 2kfd h PHE 66 Ca 0.00 0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.80 2kfd h PHE 66 Cb 0.39 0.23 -0.04 0.00 2.20 0.00 0.00 35.95 38.72 2kfd h PHE 66 CO 0.00 -0.26 -1.17 1.63 -0.60 0.00 0.00 178.31 177.91 2kfd n LYS 67 N -5.32 -4.92 -0.01 1.51 4.76 -1.26 -5.07 118.16 107.85 2kfd n LYS 67 Ca -0.04 3.62 0.00 0.00 -2.87 0.00 0.00 58.31 59.02 2kfd n LYS 67 Cb 0.24 -4.76 0.00 0.00 -1.84 0.00 0.00 35.03 28.66 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 1.76 1.55 -0.84 1.97 -0.05 -1.26 -5.15 135.00 132.98 2kfd n PRO 68 Ca -0.14 0.00 0.00 0.00 -0.05 0.00 0.00 63.50 63.31 2kfd n PRO 68 Cb 0.22 0.00 0.00 0.00 -0.05 0.00 0.00 33.50 33.67 2kfd n PRO 68 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 175.50 173.54