#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 0.40 -0.38 1.20 -0.00 -2.04 0.82 114.58 114.58 2kfd h GLU 6 Ca 0.00 -0.06 -0.02 0.00 -0.00 0.00 0.00 59.36 59.28 2kfd h GLU 6 Cb 0.00 -0.07 -0.02 0.00 -0.00 0.00 0.00 28.75 28.66 2kfd h GLU 6 CO 0.00 0.39 0.15 0.00 -0.00 0.00 0.00 179.01 179.55 2kfd h ARG 7 N 0.39 0.57 -0.49 1.06 2.47 -2.05 0.63 114.38 116.95 2kfd h ARG 7 Ca 0.09 -0.11 0.05 0.00 -1.26 0.00 0.00 59.98 58.76 2kfd h ARG 7 Cb 0.20 -0.09 -0.05 0.00 -1.65 0.00 0.00 29.97 28.38 2kfd h ARG 7 CO 0.00 0.55 0.23 -0.09 0.56 0.00 0.00 179.97 181.22 2kfd h ARG 8 N 0.46 0.44 -0.19 0.04 2.43 -1.74 -0.85 114.38 114.97 2kfd h ARG 8 Ca 0.12 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.26 2kfd h ARG 8 Cb 0.20 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 29.64 2kfd h ARG 8 CO -0.01 0.29 0.09 0.82 -1.51 0.00 0.00 179.97 179.65 2kfd h ILE 9 N 0.45 1.13 -0.06 1.20 2.04 -0.43 -2.06 117.51 119.78 2kfd h ILE 9 Ca 0.22 -0.38 -0.00 0.00 1.00 0.00 0.00 64.86 65.69 2kfd h ILE 9 Cb 0.16 1.04 -0.00 0.00 -0.74 0.00 0.00 36.82 37.27 2kfd h ILE 9 CO -0.17 0.13 0.03 0.25 0.00 0.00 0.00 178.15 178.38 2kfd h LEU 10 N 0.18 0.08 -0.61 1.44 6.46 0.53 -0.12 115.31 123.28 2kfd h LEU 10 Ca 0.07 -0.12 -0.03 0.00 -0.12 0.00 0.00 57.88 57.67 2kfd h LEU 10 Cb 0.12 -0.02 -0.03 0.00 -0.73 0.00 0.00 40.66 40.00 2kfd h LEU 10 CO -0.01 0.18 0.25 -0.33 -0.62 0.00 0.00 178.44 177.90 2kfd h GLU 11 N -0.02 0.91 -0.29 1.25 4.39 -1.19 0.71 114.58 120.34 2kfd h GLU 11 Ca 0.02 -0.16 0.05 0.00 0.34 0.00 0.00 59.36 59.61 2kfd h GLU 11 Cb 0.12 -0.15 -0.04 0.00 -0.10 0.00 0.00 28.75 28.57 2kfd h GLU 11 CO -0.00 0.77 0.01 0.37 -1.16 0.00 0.00 179.01 179.00 2kfd h GLN 12 N 0.85 0.10 0.00 2.33 4.15 -1.16 -2.24 115.11 119.13 2kfd h GLN 12 Ca 0.20 -0.01 -0.08 0.00 0.77 0.00 0.00 58.65 59.54 2kfd h GLN 12 Cb 0.20 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 27.86 2kfd h GLN 12 CO -0.02 0.07 -0.38 0.87 -1.93 0.00 0.00 178.83 177.44 2kfd h LYS 13 N 0.10 0.00 -0.28 1.69 1.79 -0.62 -2.51 116.57 116.74 2kfd h LYS 13 Ca 0.14 0.00 0.06 0.00 -2.18 0.00 0.00 60.65 58.67 2kfd h LYS 13 Cb 0.18 0.00 -0.06 0.00 -1.58 0.00 0.00 32.23 30.77 2kfd h LYS 13 CO -0.22 0.38 -0.11 -0.22 -1.08 0.00 0.00 179.45 178.20 2kfd h LYS 14 N 0.00 -0.05 -0.34 3.15 3.64 0.10 1.00 116.57 124.07 2kfd h LYS 14 Ca -0.00 0.00 -0.06 0.00 -1.27 0.00 0.00 60.65 59.32 2kfd h LYS 14 Cb 1.14 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.96 2kfd h LYS 14 CO 0.05 -0.04 -0.02 1.25 -2.27 0.00 0.00 179.45 178.42 2kfd h HIS 15 N -0.06 0.67 0.00 1.91 2.76 -1.35 -2.44 115.15 116.64 2kfd h HIS 15 Ca 0.14 -0.13 -0.03 0.00 -2.20 0.00 0.00 60.37 58.16 2kfd h HIS 15 Cb 0.27 -0.17 -0.00 0.00 1.55 0.00 0.00 27.41 29.06 2kfd h HIS 15 CO -0.31 0.74 -0.12 1.88 -1.30 0.00 0.00 177.93 178.83 2kfd h TYR 16 N 0.41 0.00 0.00 5.26 0.05 -0.97 0.23 116.97 121.94 2kfd h TYR 16 Ca 0.09 0.00 -0.20 0.00 0.05 0.00 0.00 58.73 58.67 2kfd h TYR 16 Cb 0.49 0.00 -0.03 0.00 1.01 0.00 0.00 36.73 38.20 2kfd h TYR 16 CO 0.04 0.12 -0.99 0.35 -1.05 0.00 0.00 178.16 176.63 2kfd h PHE 17 N 0.00 0.00 -0.01 4.88 3.57 0.11 0.30 116.94 125.79 2kfd h PHE 17 Ca -0.00 0.00 -0.15 0.00 3.53 0.00 0.00 57.97 61.35 2kfd h PHE 17 Cb 0.72 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.45 2kfd h PHE 17 CO 0.00 0.94 -0.69 2.35 -2.23 0.00 0.00 178.31 178.68 2kfd h TRP 18 N 0.00 0.08 -0.07 0.41 -0.00 -0.92 0.73 115.95 116.18 2kfd h TRP 18 Ca -0.03 -0.04 -0.13 0.00 -0.00 0.00 0.00 58.89 58.69 2kfd h TRP 18 Cb 1.74 -0.01 -0.01 0.00 -0.00 0.00 0.00 29.16 30.88 2kfd h TRP 18 CO 0.00 0.73 -0.56 1.25 -0.00 0.00 0.00 178.44 179.87 2kfd h LEU 19 N 0.04 0.23 0.05 0.65 6.46 -0.29 0.23 115.31 122.68 2kfd h LEU 19 Ca -0.01 -0.12 -0.11 0.00 -0.12 0.00 0.00 57.88 57.52 2kfd h LEU 19 Cb 1.23 -0.07 0.01 0.00 -0.73 0.00 0.00 40.66 41.10 2kfd h LEU 19 CO 0.09 0.74 -0.46 0.25 -0.62 0.00 0.00 178.44 178.44 2kfd h LEU 20 N 0.16 0.32 -0.33 2.25 7.12 -0.17 -2.06 115.31 122.60 2kfd h LEU 20 Ca -0.00 -0.89 -0.20 0.00 0.13 0.00 0.00 57.88 56.92 2kfd h LEU 20 Cb 1.03 -0.10 0.00 0.00 -0.53 0.00 0.00 40.66 41.06 2kfd h LEU 20 CO 0.08 1.17 -0.74 0.25 -0.13 0.00 0.00 178.44 179.08 2kfd h LEU 21 N -0.50 0.64 -0.18 2.25 7.12 0.57 -0.88 115.31 124.35 2kfd h LEU 21 Ca -0.07 -0.42 -0.21 0.00 0.13 0.00 0.00 57.88 57.31 2kfd h LEU 21 Cb 1.29 -0.19 -0.01 0.00 -0.53 0.00 0.00 40.66 41.22 2kfd h LEU 21 CO 0.09 1.18 -0.95 -0.61 -0.13 0.00 0.00 178.44 178.02 2kfd h GLN 22 N 0.37 0.14 -0.38 1.25 4.15 -0.68 0.59 115.11 120.55 2kfd h GLN 22 Ca -0.04 -0.18 0.04 0.00 0.77 0.00 0.00 58.65 59.24 2kfd h GLN 22 Cb 1.33 0.06 -0.04 0.00 0.21 0.00 0.00 27.48 29.04 2kfd h GLN 22 CO 0.14 0.98 0.14 -0.09 -1.93 0.00 0.00 178.83 178.07 2kfd h ARG 23 N 0.07 0.30 0.02 1.69 1.12 -1.20 -3.14 114.38 113.23 2kfd h ARG 23 Ca -0.05 -0.02 -0.00 0.00 -1.11 0.00 0.00 59.98 58.80 2kfd h ARG 23 Cb 1.62 -0.07 0.00 0.00 -0.01 0.00 0.00 29.97 31.51 2kfd h ARG 23 CO 0.14 0.20 -0.01 1.15 -3.11 0.00 0.00 179.97 178.34 2kfd h THR 24 N 0.31 0.00 -3.25 0.20 2.02 -1.10 -3.42 112.91 107.68 2kfd h THR 24 Ca 0.17 -0.22 -0.75 0.00 0.77 0.00 0.00 66.41 66.38 2kfd h THR 24 Cb 0.14 0.00 -0.23 0.00 -1.74 0.00 0.00 68.15 66.33 2kfd h THR 24 CO -0.17 0.00 0.20 -0.31 0.37 0.00 0.00 175.52 175.61 2kfd s TYR 25 N -1.33 3.40 0.00 3.16 2.02 0.21 -4.31 117.35 120.51 2kfd s TYR 25 Ca -0.00 -1.56 0.00 0.00 -0.37 0.00 0.00 57.07 55.14 2kfd s TYR 25 Cb 0.00 -3.95 0.00 0.00 -0.40 0.00 0.00 41.96 37.61 2kfd s TYR 25 CO 0.01 -1.16 0.00 2.41 -1.57 0.00 0.00 175.55 175.24 2kfd n THR 26 N 4.79 0.00 0.04 -0.71 -1.04 -0.60 -4.10 114.28 112.67 2kfd n THR 26 Ca 0.07 0.00 -0.10 0.00 -2.04 0.00 0.00 64.05 61.98 2kfd n THR 26 Cb 0.45 -1.30 -0.13 0.00 -1.82 0.00 0.00 70.33 67.54 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 0.08 0.00 -2.82 2.10 -1.86 -3.36 116.57 110.71 2kfd h LYS 27 Ca 0.00 -0.13 0.00 0.00 -2.00 0.00 0.00 60.65 58.52 2kfd h LYS 27 Cb 0.00 0.05 0.00 0.00 -0.90 0.00 0.00 32.23 31.38 2kfd h LYS 27 CO 0.00 0.92 -0.30 -2.37 -2.00 0.00 0.00 179.45 175.70 2kfd n THR 28 N -3.31 0.00 0.22 0.07 5.66 -1.26 -4.73 114.28 110.93 2kfd n THR 28 Ca -0.08 0.00 -0.16 0.00 -3.05 0.00 0.00 64.05 60.75 2kfd n THR 28 Cb 1.00 -0.25 -0.09 0.00 -1.55 0.00 0.00 70.33 69.43 2kfd n THR 28 CO 0.00 0.00 0.00 1.23 -3.05 0.00 0.00 175.07 173.25 2kfd h GLY 29 N 0.00 -1.21 -6.73 1.09 0.00 -1.94 -3.40 103.07 90.89 2kfd h GLY 29 Ca 0.00 0.59 -0.57 0.00 0.00 0.00 0.00 47.33 47.35 2kfd h GLY 29 CO 0.00 -0.34 -0.81 0.54 0.00 0.00 0.00 176.54 175.93 2kfd s LYS 30 N -5.55 1.81 0.08 4.80 -0.14 -1.26 -4.89 119.74 114.59 2kfd s LYS 30 Ca -0.16 -0.50 -0.33 0.00 -1.36 0.00 0.00 55.97 53.62 2kfd s LYS 30 Cb 0.04 -1.98 -0.12 0.00 -1.68 0.00 0.00 37.83 34.10 2kfd s LYS 30 CO 0.54 -0.33 1.77 -2.30 -0.76 0.00 0.00 175.35 174.28 2kfd n PRO 31 N 4.84 2.44 -1.68 -1.68 -0.02 -1.26 -1.55 135.00 136.08 2kfd n PRO 31 Ca -0.14 0.89 -0.48 0.00 -2.02 0.00 0.00 63.50 61.75 2kfd n PRO 31 Cb 0.49 -2.73 -0.05 0.00 -0.02 0.00 0.00 33.50 31.19 2kfd n PRO 31 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 2kfd n LYS 32 N 5.25 2.14 -1.58 -0.52 4.81 -1.26 -4.84 118.16 122.16 2kfd n LYS 32 Ca 0.19 0.78 -0.39 0.00 -0.87 0.00 0.00 58.31 58.02 2kfd n LYS 32 Cb 0.33 -2.59 0.04 0.00 0.02 0.00 0.00 35.03 32.82 2kfd n LYS 32 CO 0.00 0.00 0.00 -2.30 1.17 0.00 0.00 177.40 176.27 2kfd n PRO 33 N 5.27 0.97 0.22 1.64 -0.02 -1.26 -4.89 135.00 136.93 2kfd n PRO 33 Ca 0.20 0.36 0.14 0.00 -2.02 0.00 0.00 63.50 62.19 2kfd n PRO 33 Cb 0.29 -2.03 0.39 0.00 -0.02 0.00 0.00 33.50 32.13 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 0.79 0.00 -4.39 2.55 0.02 -2.01 -3.44 113.55 107.08 2kfd h SER 34 Ca -0.47 0.00 -0.10 0.00 -0.84 0.00 0.00 61.79 60.38 2kfd h SER 34 Cb 1.36 0.00 -0.22 0.00 0.14 0.00 0.00 62.40 63.68 2kfd h SER 34 CO 0.52 0.00 -0.14 -0.89 -1.14 0.00 0.00 176.83 175.18 2kfd s THR 35 N -3.36 0.02 -0.06 -2.27 2.01 -1.26 -5.04 115.64 105.68 2kfd s THR 35 Ca 0.05 -0.14 0.27 0.00 0.31 0.00 0.00 61.69 62.19 2kfd s THR 35 Cb 0.07 -0.70 0.28 0.00 0.01 0.00 0.00 72.50 72.16 2kfd s THR 35 CO 0.60 -0.07 1.83 -0.25 -0.69 0.00 0.00 174.62 176.04 2kfd h TRP 36 N 4.58 0.00 0.41 4.92 2.91 -1.93 -2.95 115.95 123.90 2kfd h TRP 36 Ca -0.28 0.00 -0.02 0.00 1.13 0.00 0.00 58.89 59.72 2kfd h TRP 36 Cb 1.17 0.00 0.00 0.00 -0.51 0.00 0.00 29.16 29.83 2kfd h TRP 36 CO 0.43 0.00 -0.20 0.22 -1.03 0.00 0.00 178.44 177.86 2kfd h ASP 37 N 0.00 -0.47 0.57 2.65 1.82 -1.98 0.25 116.42 119.26 2kfd h ASP 37 Ca 0.00 0.01 -0.10 0.00 -0.39 0.00 0.00 57.03 56.55 2kfd h ASP 37 Cb 0.11 0.12 -0.01 0.00 0.68 0.00 0.00 39.33 40.22 2kfd h ASP 37 CO 0.00 -0.33 -0.48 0.17 -1.61 0.00 0.00 179.24 176.99 2kfd h LEU 38 N -0.56 0.00 0.11 2.28 -0.00 -1.96 -2.33 115.31 112.85 2kfd h LEU 38 Ca -0.06 0.00 -0.01 0.00 -0.00 0.00 0.00 57.88 57.82 2kfd h LEU 38 Cb 0.43 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.09 2kfd h LEU 38 CO 0.09 0.48 -0.05 0.00 -0.00 0.00 0.00 178.44 178.96 2kfd h ALA 39 N 1.52 -0.15 -0.39 0.17 0.00 -1.35 -2.59 119.26 116.47 2kfd h ALA 39 Ca -0.00 -0.13 -0.14 0.00 0.00 0.00 0.00 54.91 54.63 2kfd h ALA 39 Cb 0.89 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 2kfd h ALA 39 CO 0.06 -0.46 -0.32 0.66 0.00 0.00 0.00 179.25 179.19 2kfd h SER 40 N -0.39 0.92 -0.57 0.00 4.64 -0.46 0.87 113.55 118.56 2kfd h SER 40 Ca -0.02 -0.39 0.03 0.00 -0.47 0.00 0.00 61.79 60.95 2kfd h SER 40 Cb 0.32 -0.26 -0.04 0.00 -0.31 0.00 0.00 62.40 62.11 2kfd h SER 40 CO 0.02 1.16 0.33 0.50 -0.87 0.00 0.00 176.83 177.97 2kfd h LYS 41 N 0.74 0.63 0.00 4.77 3.64 -1.37 0.21 116.57 125.18 2kfd h LYS 41 Ca 0.08 -0.04 -0.22 0.00 -1.27 0.00 0.00 60.65 59.20 2kfd h LYS 41 Cb 0.88 -0.14 -0.03 0.00 -0.41 0.00 0.00 32.23 32.53 2kfd h LYS 41 CO 0.08 0.41 -1.13 1.49 -2.27 0.00 0.00 179.45 178.03 2kfd h GLU 42 N 0.65 0.00 -0.66 1.90 4.81 -1.38 -3.30 114.58 116.60 2kfd h GLU 42 Ca 0.24 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.45 2kfd h GLU 42 Cb 0.07 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.41 2kfd h GLU 42 CO -0.12 0.83 0.34 1.25 -0.73 0.00 0.00 179.01 180.58 2kfd h LEU 43 N 0.00 0.82 -8.39 1.64 7.12 -0.32 -3.42 115.31 112.77 2kfd h LEU 43 Ca -0.08 -0.07 -0.32 0.00 0.13 0.00 0.00 57.88 57.54 2kfd h LEU 43 Cb 1.79 -0.21 -0.02 0.00 -0.53 0.00 0.00 40.66 41.69 2kfd h LEU 43 CO 0.11 0.68 1.22 0.61 -0.13 0.00 0.00 178.44 180.93 2kfd n GLY 44 N -1.18 -0.08 0.00 3.75 0.00 0.02 -2.46 105.19 105.24 2kfd n GLY 44 Ca 0.06 0.57 0.00 0.00 0.00 0.00 0.00 46.02 46.65 2kfd n GLY 44 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2kfd n GLU 45 N 8.56 0.00 -2.39 1.61 0.00 -1.26 -5.06 120.64 122.09 2kfd n GLU 45 Ca 0.47 0.00 -0.42 0.00 0.00 0.00 0.00 57.16 57.21 2kfd n GLU 45 Cb 0.40 0.00 -0.03 0.00 0.00 0.00 0.00 31.44 31.81 2kfd n GLU 45 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.13 176.01 2kfd s SER 46 N 0.00 6.98 0.00 4.31 0.01 -1.03 -4.89 113.70 119.09 2kfd s SER 46 Ca 0.00 1.88 0.14 0.00 1.31 0.00 0.00 55.95 59.29 2kfd s SER 46 Cb 0.00 -2.56 0.76 0.00 0.21 0.00 0.00 66.02 64.43 2kfd s SER 46 CO 0.00 -0.64 1.36 0.00 0.41 0.00 0.00 173.24 174.37 2kfd n LEU 47 N 5.40 0.00 0.19 2.44 -0.00 -1.26 -2.11 117.00 121.66 2kfd n LEU 47 Ca 0.12 0.21 0.13 0.00 -0.00 0.00 0.00 56.01 56.46 2kfd n LEU 47 Cb 0.45 -0.21 0.28 0.00 -0.00 0.00 0.00 43.42 43.95 2kfd n LEU 47 CO 0.56 -0.11 0.85 -0.08 -0.00 0.00 0.00 177.39 178.61 2kfd h GLU 48 N 0.00 0.00 0.00 1.47 4.57 -1.95 0.38 114.58 119.06 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 0.10 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.69 2kfd h GLU 48 CO 0.00 0.00 -0.50 0.98 -1.18 0.00 0.00 179.01 178.31 2kfd n TYR 49 N -2.82 0.56 1.03 0.92 9.36 -0.90 -2.41 117.16 122.91 2kfd n TYR 49 Ca 0.04 0.16 0.13 0.00 3.32 0.00 0.00 57.90 61.55 2kfd n TYR 49 Cb 0.48 -0.67 0.41 0.00 -0.63 0.00 0.00 39.34 38.93 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 -2.07 0.07 0.00 2.98 4.81 -0.37 -3.04 118.16 120.54 2kfd n LYS 50 Ca 0.04 -0.03 0.15 0.00 -0.87 0.00 0.00 58.31 57.59 2kfd n LYS 50 Cb 0.43 -1.50 0.69 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 -1.44 2.60 -1.73 3.14 0.00 -0.02 -3.33 120.51 119.74 2kfd n ALA 51 Ca 0.07 -0.19 0.05 0.00 0.00 0.00 0.00 53.44 53.37 2kfd n ALA 51 Cb 0.33 -1.43 0.11 0.00 0.00 0.00 0.00 19.45 18.46 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 -1.19 1.67 0.21 0.00 4.77 -1.17 -4.71 117.00 116.58 2kfd n LEU 52 Ca 0.14 -2.65 0.15 0.00 -0.03 0.00 0.00 56.01 53.61 2kfd n LEU 52 Cb 0.26 -0.28 0.71 0.00 -2.33 0.00 0.00 43.42 41.78 2kfd n LEU 52 CO 0.24 0.77 0.94 1.23 -1.33 0.00 0.00 177.39 179.24 2kfd h GLY 53 N 0.50 0.00 0.00 -0.72 0.00 -1.61 -2.91 103.07 98.34 2kfd h GLY 53 Ca -0.05 0.00 -0.25 0.00 0.00 0.00 0.00 47.33 47.03 2kfd h GLY 53 CO 0.02 0.00 -1.66 2.09 0.00 0.00 0.00 176.54 176.99 2kfd n ASP 54 N -2.57 1.91 -3.59 0.19 5.75 -1.26 -4.52 116.55 112.46 2kfd n ASP 54 Ca -0.00 0.39 -0.41 0.00 -0.01 0.00 0.00 54.79 54.76 2kfd n ASP 54 Cb 0.15 -0.84 -0.01 0.00 -1.03 0.00 0.00 41.12 39.38 2kfd n ASP 54 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 2kfd n GLU 55 N -4.38 3.38 -0.00 0.11 -0.58 -1.11 -4.72 120.64 113.34 2kfd n GLU 55 Ca -0.35 -2.68 -0.12 0.00 -0.42 0.00 0.00 57.16 53.60 2kfd n GLU 55 Cb 0.68 -3.03 -0.07 0.00 -0.57 0.00 0.00 31.44 28.46 2kfd n GLU 55 CO 0.00 0.00 0.00 0.22 -0.48 0.00 0.00 177.13 176.87 2kfd h ASP 56 N 5.52 0.10 0.78 1.62 1.82 -1.75 -2.01 116.42 122.50 2kfd h ASP 56 Ca 0.66 -0.14 -0.08 0.00 -0.39 0.00 0.00 57.03 57.08 2kfd h ASP 56 Cb 0.49 -0.03 -0.01 0.00 0.68 0.00 0.00 39.33 40.47 2kfd h ASP 56 CO 1.79 0.21 -0.38 -0.55 -1.61 0.00 0.00 179.24 178.70 2kfd h ASN 57 N -0.02 0.00 0.10 2.28 -0.00 -1.89 -1.20 115.58 114.85 2kfd h ASN 57 Ca 0.02 0.00 -0.00 0.00 -0.00 0.00 0.00 56.30 56.32 2kfd h ASN 57 Cb 0.14 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 38.46 2kfd h ASN 57 CO -0.00 0.38 -0.05 0.40 -0.00 0.00 0.00 177.43 178.16 2kfd h ILE 58 N 0.00 1.10 -0.18 6.14 5.03 -1.93 -2.09 117.51 125.58 2kfd h ILE 58 Ca -0.00 -0.84 0.04 0.00 -0.12 0.00 0.00 64.86 63.94 2kfd h ILE 58 Cb 0.87 1.62 -0.04 0.00 -3.03 0.00 0.00 36.82 36.25 2kfd h ILE 58 CO 0.05 0.20 -0.06 -0.09 -0.68 0.00 0.00 178.15 177.57 2kfd h ARG 59 N -0.53 -0.02 -0.84 2.37 2.43 -0.53 0.14 114.38 117.40 2kfd h ARG 59 Ca -0.01 0.00 0.03 0.00 -0.81 0.00 0.00 59.98 59.18 2kfd h ARG 59 Cb 0.43 0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 29.94 2kfd h ARG 59 CO 0.02 -0.01 0.55 0.07 -1.51 0.00 0.00 179.97 179.09 2kfd h ARG 60 N -0.02 1.05 0.06 0.20 0.11 -1.35 -2.36 114.38 112.07 2kfd h ARG 60 Ca 0.09 -0.06 -0.00 0.00 0.10 0.00 0.00 59.98 60.10 2kfd h ARG 60 Cb 0.16 -0.24 0.00 0.00 1.11 0.00 0.00 29.97 31.00 2kfd h ARG 60 CO -0.20 0.69 -0.03 1.96 0.10 0.00 0.00 179.97 182.50 2kfd h GLN 61 N 1.08 -0.08 -0.07 0.08 1.08 -0.42 -1.38 115.11 115.41 2kfd h GLN 61 Ca 0.33 0.01 0.00 0.00 -1.45 0.00 0.00 58.65 57.53 2kfd h GLN 61 Cb -0.03 0.02 -0.00 0.00 -0.05 0.00 0.00 27.48 27.41 2kfd h GLN 61 CO -0.10 0.19 0.04 0.82 -0.95 0.00 0.00 178.83 178.83 2kfd h ILE 62 N -0.36 1.03 -0.40 2.54 2.04 -0.80 -1.45 117.51 120.11 2kfd h ILE 62 Ca -0.01 -0.06 0.08 0.00 1.00 0.00 0.00 64.86 65.88 2kfd h ILE 62 Cb 0.31 0.95 -0.08 0.00 -0.74 0.00 0.00 36.82 37.26 2kfd h ILE 62 CO 0.01 0.02 -0.14 0.15 0.00 0.00 0.00 178.15 178.20 2kfd h PHE 63 N 0.08 -0.33 -0.72 1.37 3.57 -1.39 0.34 116.94 119.85 2kfd h PHE 63 Ca 0.02 0.04 0.05 0.00 3.53 0.00 0.00 57.97 61.61 2kfd h PHE 63 Cb 0.00 0.21 -0.05 0.00 2.79 0.00 0.00 35.95 38.90 2kfd h PHE 63 CO -0.07 -0.22 0.43 1.49 -2.23 0.00 0.00 178.31 177.71 2kfd h GLU 64 N -0.06 0.79 -0.00 1.11 4.57 -1.01 -2.19 114.58 117.79 2kfd h GLU 64 Ca 0.20 -0.05 0.00 0.00 -1.18 0.00 0.00 59.36 58.33 2kfd h GLU 64 Cb 0.36 -0.18 0.00 0.00 -0.16 0.00 0.00 28.75 28.77 2kfd h GLU 64 CO -0.45 0.53 -0.12 -3.47 -1.18 0.00 0.00 179.01 174.32 2kfd n ASP 65 N -4.70 0.16 0.19 1.04 2.03 -0.27 -4.25 116.55 110.76 2kfd n ASP 65 Ca 0.09 0.16 -0.15 0.00 0.52 0.00 0.00 54.79 55.41 2kfd n ASP 65 Cb 0.14 -0.27 -0.07 0.00 -0.72 0.00 0.00 41.12 40.20 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 0.06 -0.75 -3.88 -0.67 0.04 0.26 -3.49 116.94 108.50 2kfd h PHE 66 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 2kfd h PHE 66 Cb 0.46 0.29 0.00 0.00 2.20 0.00 0.00 35.95 38.91 2kfd h PHE 66 CO 0.00 -0.41 -0.80 1.63 -0.60 0.00 0.00 178.31 178.13 2kfd n LYS 67 N -5.40 -4.63 0.00 1.51 4.76 -1.26 -5.03 118.16 108.10 2kfd n LYS 67 Ca -0.09 3.38 0.00 0.00 -2.87 0.00 0.00 58.31 58.73 2kfd n LYS 67 Cb 0.31 -3.66 0.00 0.00 -1.84 0.00 0.00 35.03 29.84 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 1.59 1.39 -0.44 1.97 -0.04 -1.26 -5.10 135.00 133.10 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