#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 1.08 -0.78 1.20 4.11 -2.04 0.19 114.58 118.33 2kfd h GLU 6 Ca 0.00 -0.27 0.04 0.00 0.07 0.00 0.00 59.36 59.20 2kfd h GLU 6 Cb 0.00 -0.14 -0.05 0.00 0.50 0.00 0.00 28.75 29.06 2kfd h GLU 6 CO 0.00 0.97 0.50 0.00 0.07 0.00 0.00 179.01 180.54 2kfd h ARG 7 N 1.02 0.93 -0.36 1.06 2.47 -2.05 0.32 114.38 117.76 2kfd h ARG 7 Ca 0.21 -0.06 -0.08 0.00 -1.26 0.00 0.00 59.98 58.80 2kfd h ARG 7 Cb 0.40 -0.21 -0.01 0.00 -1.65 0.00 0.00 29.97 28.49 2kfd h ARG 7 CO 0.01 0.61 -0.07 -0.09 0.56 0.00 0.00 179.97 180.99 2kfd h ARG 8 N 0.95 0.68 0.06 0.04 2.43 -1.83 -2.48 114.38 114.23 2kfd h ARG 8 Ca 0.32 -0.25 0.01 0.00 -0.81 0.00 0.00 59.98 59.24 2kfd h ARG 8 Cb 0.04 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.54 2kfd h ARG 8 CO -0.12 0.83 -0.09 0.82 -1.51 0.00 0.00 179.97 179.90 2kfd h ILE 9 N 0.48 0.79 -0.11 1.20 2.04 -0.29 -2.33 117.51 119.29 2kfd h ILE 9 Ca 0.09 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.97 2kfd h ILE 9 Cb 0.57 0.79 -0.01 0.00 -0.74 0.00 0.00 36.82 37.43 2kfd h ILE 9 CO 0.03 0.00 0.02 0.25 0.00 0.00 0.00 178.15 178.46 2kfd h LEU 10 N -0.18 0.01 -0.56 1.44 5.85 -0.29 0.10 115.31 121.68 2kfd h LEU 10 Ca 0.01 0.02 -0.16 0.00 0.84 0.00 0.00 57.88 58.59 2kfd h LEU 10 Cb 0.19 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.23 2kfd h LEU 10 CO -0.05 0.03 -0.65 -0.33 -0.34 0.00 0.00 178.44 177.10 2kfd h GLU 11 N 0.07 0.29 0.05 1.25 4.39 -1.49 0.52 114.58 119.66 2kfd h GLU 11 Ca 0.05 -0.21 -0.00 0.00 0.34 0.00 0.00 59.36 59.53 2kfd h GLU 11 Cb 0.04 0.04 0.00 0.00 -0.10 0.00 0.00 28.75 28.73 2kfd h GLU 11 CO -0.06 0.84 -0.02 0.37 -1.16 0.00 0.00 179.01 178.97 2kfd h GLN 12 N 0.21 -0.07 -0.12 2.33 4.15 -1.08 -2.43 115.11 118.10 2kfd h GLN 12 Ca -0.01 0.00 -0.12 0.00 0.77 0.00 0.00 58.65 59.30 2kfd h GLN 12 Cb 1.18 0.02 -0.01 0.00 0.21 0.00 0.00 27.48 28.87 2kfd h GLN 12 CO 0.10 -0.03 -0.43 0.87 -1.93 0.00 0.00 178.83 177.41 2kfd h LYS 13 N -0.09 0.29 -0.45 1.69 1.79 -0.58 -2.52 116.57 116.70 2kfd h LYS 13 Ca -0.01 -0.15 0.09 0.00 -2.18 0.00 0.00 60.65 58.41 2kfd h LYS 13 Cb 0.07 0.00 -0.09 0.00 -1.58 0.00 0.00 32.23 30.63 2kfd h LYS 13 CO 0.01 0.67 -0.14 -0.22 -1.08 0.00 0.00 179.45 178.69 2kfd h LYS 14 N 0.24 -0.04 -0.18 3.15 3.64 0.29 1.21 116.57 124.89 2kfd h LYS 14 Ca 0.02 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.38 2kfd h LYS 14 Cb 0.86 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.68 2kfd h LYS 14 CO 0.07 -0.02 0.03 1.25 -2.27 0.00 0.00 179.45 178.51 2kfd h HIS 15 N -0.04 0.31 0.00 1.91 2.76 -1.25 -2.11 115.15 116.73 2kfd h HIS 15 Ca 0.22 -0.04 0.00 0.00 -2.20 0.00 0.00 60.37 58.35 2kfd h HIS 15 Cb 0.37 -0.09 0.00 0.00 1.55 0.00 0.00 27.41 29.25 2kfd h HIS 15 CO -0.42 0.45 -0.01 0.66 -1.30 0.00 0.00 177.93 177.31 2kfd n TYR 16 N -4.77 0.31 0.10 5.26 4.01 -0.85 -0.36 117.16 120.85 2kfd n TYR 16 Ca -0.05 0.09 -0.02 0.00 -0.16 0.00 0.00 57.90 57.76 2kfd n TYR 16 Cb 0.18 -0.64 -0.05 0.00 -0.31 0.00 0.00 39.34 38.52 2kfd n TYR 16 CO 0.00 0.00 0.00 0.35 -0.46 0.00 0.00 176.86 176.75 2kfd h PHE 17 N 0.00 0.00 0.02 -0.72 3.57 0.16 0.28 116.94 120.25 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 0.58 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.30 2kfd h PHE 17 CO 0.00 0.74 -0.97 2.35 -2.23 0.00 0.00 178.31 178.20 2kfd h TRP 18 N 0.00 0.14 -0.18 0.41 -0.00 -0.63 0.70 115.95 116.39 2kfd h TRP 18 Ca -0.02 -0.09 -0.13 0.00 -0.00 0.00 0.00 58.89 58.65 2kfd h TRP 18 Cb 1.58 -0.01 -0.01 0.00 -0.00 0.00 0.00 29.16 30.72 2kfd h TRP 18 CO 0.00 0.99 -0.43 1.25 -0.00 0.00 0.00 178.44 180.26 2kfd h LEU 19 N 0.04 0.47 0.01 0.65 5.85 -0.60 0.36 115.31 122.09 2kfd h LEU 19 Ca -0.04 -0.21 -0.00 0.00 0.84 0.00 0.00 57.88 58.47 2kfd h LEU 19 Cb 1.66 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 42.56 2kfd h LEU 19 CO 0.14 0.84 -0.01 0.25 -0.34 0.00 0.00 178.44 179.32 2kfd h LEU 20 N 0.36 -0.02 -0.85 2.25 7.12 -0.29 -2.31 115.31 121.58 2kfd h LEU 20 Ca 0.03 -0.59 -0.10 0.00 0.13 0.00 0.00 57.88 57.35 2kfd h LEU 20 Cb 0.90 0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 41.02 2kfd h LEU 20 CO 0.08 0.59 -0.48 0.25 -0.13 0.00 0.00 178.44 178.74 2kfd h LEU 21 N -0.63 0.00 0.25 2.25 7.12 0.56 -0.97 115.31 123.90 2kfd h LEU 21 Ca -0.00 0.00 -0.34 0.00 0.13 0.00 0.00 57.88 57.67 2kfd h LEU 21 Cb 0.60 0.00 0.04 0.00 -0.53 0.00 0.00 40.66 40.77 2kfd h LEU 21 CO 0.00 0.48 -1.52 -0.61 -0.13 0.00 0.00 178.44 176.66 2kfd h GLN 22 N 0.00 0.52 -0.17 1.25 4.15 -0.37 0.26 115.11 120.75 2kfd h GLN 22 Ca -0.00 -0.89 -0.04 0.00 0.77 0.00 0.00 58.65 58.48 2kfd h GLN 22 Cb 0.99 0.33 -0.01 0.00 0.21 0.00 0.00 27.48 29.00 2kfd h GLN 22 CO 0.06 1.43 -0.06 -0.09 -1.93 0.00 0.00 178.83 178.24 2kfd h ARG 23 N 0.13 0.26 0.00 1.69 1.12 -1.26 -2.60 114.38 113.73 2kfd h ARG 23 Ca -0.27 -0.05 0.00 0.00 -1.11 0.00 0.00 59.98 58.55 2kfd h ARG 23 Cb 2.16 -0.04 0.00 0.00 -0.01 0.00 0.00 29.97 32.08 2kfd h ARG 23 CO 0.26 0.34 0.00 2.41 -3.11 0.00 0.00 179.97 179.88 2kfd n THR 24 N -4.32 0.00 -3.08 0.20 -1.04 -0.38 -4.64 114.28 101.02 2kfd n THR 24 Ca -0.00 0.43 -0.45 0.00 -2.04 0.00 0.00 64.05 61.99 2kfd n THR 24 Cb 0.22 -1.30 -0.03 0.00 -1.82 0.00 0.00 70.33 67.41 2kfd n THR 24 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 2kfd s TYR 25 N -0.86 3.30 0.00 -1.42 2.02 0.93 -4.21 117.35 117.11 2kfd s TYR 25 Ca 0.00 -1.52 0.00 0.00 -0.37 0.00 0.00 57.07 55.18 2kfd s TYR 25 Cb 0.00 -4.10 0.00 0.00 -0.40 0.00 0.00 41.96 37.46 2kfd s TYR 25 CO 0.00 -1.31 0.00 2.41 -1.57 0.00 0.00 175.55 175.08 2kfd n THR 26 N 5.02 0.00 -0.29 -0.71 -1.04 -0.66 -4.17 114.28 112.42 2kfd n THR 26 Ca 0.16 0.00 -0.05 0.00 -2.04 0.00 0.00 64.05 62.12 2kfd n THR 26 Cb 0.48 -1.97 0.07 0.00 -1.82 0.00 0.00 70.33 67.08 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 1.16 0.00 -2.82 1.57 -1.83 -3.41 116.57 111.24 2kfd h LYS 27 Ca 0.00 -0.18 0.00 0.00 -1.87 0.00 0.00 60.65 58.60 2kfd h LYS 27 Cb 0.00 -0.21 0.00 0.00 0.08 0.00 0.00 32.23 32.10 2kfd h LYS 27 CO 0.00 0.90 -0.08 -2.37 -0.57 0.00 0.00 179.45 177.34 2kfd n THR 28 N -4.34 0.00 0.00 -0.16 5.66 -1.26 -3.75 114.28 110.43 2kfd n THR 28 Ca 0.07 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.07 2kfd n THR 28 Cb 0.14 -0.07 0.00 0.00 -1.55 0.00 0.00 70.33 68.85 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 0.85 -2.98 3.48 1.09 0.00 -1.26 -4.40 105.19 101.96 2kfd n GLY 29 Ca 0.00 0.42 -0.34 0.00 0.00 0.00 0.00 46.02 46.10 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 -2.79 3.63 0.54 1.61 -0.14 -1.26 -4.89 119.74 116.43 2kfd s LYS 30 Ca 0.00 -0.54 -0.22 0.00 -1.36 0.00 0.00 55.97 53.85 2kfd s LYS 30 Cb 0.00 -2.90 -0.05 0.00 -1.68 0.00 0.00 37.83 33.20 2kfd s LYS 30 CO 0.00 0.21 1.38 -2.30 -0.76 0.00 0.00 175.35 173.88 2kfd n PRO 31 N 3.61 1.77 -2.84 -1.68 -0.02 -1.26 -1.66 135.00 132.91 2kfd n PRO 31 Ca -0.17 0.65 -0.43 0.00 -2.02 0.00 0.00 63.50 61.52 2kfd n PRO 31 Cb 0.52 -2.59 -0.04 0.00 -0.02 0.00 0.00 33.50 31.37 2kfd n PRO 31 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 2kfd s LYS 32 N -2.85 3.54 0.06 -0.52 2.47 -1.26 -4.79 119.74 116.39 2kfd s LYS 32 Ca 0.71 0.16 -0.06 0.00 -1.56 0.00 0.00 55.97 55.21 2kfd s LYS 32 Cb -0.42 -3.92 -0.04 0.00 -1.46 0.00 0.00 37.83 32.00 2kfd s LYS 32 CO 0.50 -1.18 0.09 -2.30 0.16 0.00 0.00 175.35 172.62 2kfd n PRO 33 N 7.06 0.00 0.08 4.03 -0.02 -1.26 -4.86 135.00 140.03 2kfd n PRO 33 Ca 0.06 0.00 0.13 0.00 -2.02 0.00 0.00 63.50 61.66 2kfd n PRO 33 Cb 0.48 -0.23 0.46 0.00 -0.02 0.00 0.00 33.50 34.19 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 0.49 0.57 -3.69 2.55 7.64 -1.26 -4.81 113.62 115.10 2kfd n SER 34 Ca 0.04 0.57 -0.14 0.00 1.01 0.00 0.00 58.87 60.34 2kfd n SER 34 Cb 0.07 -0.71 -0.08 0.00 -1.01 0.00 0.00 64.21 62.47 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 -3.10 0.02 -0.64 0.44 2.01 -1.26 -5.04 115.64 108.07 2kfd s THR 35 Ca 0.11 -0.17 0.20 0.00 0.31 0.00 0.00 61.69 62.13 2kfd s THR 35 Cb 0.13 -0.72 0.20 0.00 0.01 0.00 0.00 72.50 72.12 2kfd s THR 35 CO 0.54 -0.09 1.61 1.87 -0.69 0.00 0.00 174.62 177.86 2kfd n TRP 36 N 1.86 0.53 0.14 4.92 -0.00 -1.26 -2.97 117.44 120.66 2kfd n TRP 36 Ca -0.17 0.21 -0.14 0.00 -0.00 0.00 0.00 57.50 57.40 2kfd n TRP 36 Cb 0.56 -0.84 -0.08 0.00 -0.00 0.00 0.00 31.31 30.95 2kfd n TRP 36 CO 0.00 0.00 0.00 0.22 -0.00 0.00 0.00 177.69 177.91 2kfd h ASP 37 N 0.00 -0.29 0.31 5.87 1.82 -1.99 0.15 116.42 122.29 2kfd h ASP 37 Ca 0.00 -0.16 -0.08 0.00 -0.39 0.00 0.00 57.03 56.40 2kfd h ASP 37 Cb 0.30 0.07 -0.01 0.00 0.68 0.00 0.00 39.33 40.37 2kfd h ASP 37 CO 0.00 0.00 -0.37 0.17 -1.61 0.00 0.00 179.24 177.44 2kfd h LEU 38 N -0.59 0.08 0.18 2.28 -0.00 -1.99 -2.59 115.31 112.67 2kfd h LEU 38 Ca -0.03 -0.03 -0.01 0.00 -0.00 0.00 0.00 57.88 57.81 2kfd h LEU 38 Cb 0.43 -0.02 0.00 0.00 -0.00 0.00 0.00 40.66 41.07 2kfd h LEU 38 CO 0.06 0.44 -0.09 0.00 -0.00 0.00 0.00 178.44 178.86 2kfd h ALA 39 N 1.56 -0.24 -0.02 0.17 0.00 -1.40 -2.68 119.26 116.65 2kfd h ALA 39 Ca 0.01 -0.16 -0.07 0.00 0.00 0.00 0.00 54.91 54.68 2kfd h ALA 39 Cb 0.68 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 2kfd h ALA 39 CO 0.05 -0.49 -0.34 0.66 0.00 0.00 0.00 179.25 179.13 2kfd h SER 40 N -0.52 0.04 0.00 0.00 4.64 -0.66 0.47 113.55 117.53 2kfd h SER 40 Ca -0.02 -0.01 -0.00 0.00 -0.47 0.00 0.00 61.79 61.28 2kfd h SER 40 Cb 0.40 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.47 2kfd h SER 40 CO 0.04 0.38 -0.00 0.50 -0.87 0.00 0.00 176.83 176.88 2kfd h LYS 41 N 0.04 -0.00 0.01 4.77 3.64 -1.31 -0.73 116.57 122.98 2kfd h LYS 41 Ca 0.00 0.00 -0.22 0.00 -1.27 0.00 0.00 60.65 59.16 2kfd h LYS 41 Cb 0.62 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.41 2kfd h LYS 41 CO 0.05 0.08 -1.10 1.49 -2.27 0.00 0.00 179.45 177.70 2kfd h GLU 42 N -0.09 0.02 -0.60 1.90 4.81 -1.23 -3.30 114.58 116.09 2kfd h GLU 42 Ca -0.00 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.18 2kfd h GLU 42 Cb 0.09 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.45 2kfd h GLU 42 CO 0.00 0.96 0.33 1.25 -0.73 0.00 0.00 179.01 180.82 2kfd h LEU 43 N 0.01 0.75 -8.44 1.64 7.12 0.02 -3.41 115.31 112.99 2kfd h LEU 43 Ca -0.05 -0.09 -0.23 0.00 0.13 0.00 0.00 57.88 57.63 2kfd h LEU 43 Cb 1.81 -0.19 -0.00 0.00 -0.53 0.00 0.00 40.66 41.75 2kfd h LEU 43 CO 0.13 0.63 0.76 -0.83 -0.13 0.00 0.00 178.44 179.00 2kfd s GLY 44 N -2.94 -0.53 0.00 3.75 0.00 -0.29 -1.80 107.32 105.50 2kfd s GLY 44 Ca -0.13 -0.55 0.00 0.00 0.00 0.00 0.00 44.72 44.04 2kfd s GLY 44 CO 0.77 4.08 0.00 -2.21 0.00 0.00 0.00 173.10 175.75 2kfd n GLU 45 N 8.92 0.00 -2.80 2.90 4.07 -1.26 -5.03 120.64 127.44 2kfd n GLU 45 Ca 0.41 0.00 -0.42 0.00 -0.06 0.00 0.00 57.16 57.08 2kfd n GLU 45 Cb 0.48 0.00 -0.03 0.00 -0.06 0.00 0.00 31.44 31.83 2kfd n GLU 45 CO 0.00 0.00 0.00 -1.12 -0.06 0.00 0.00 177.13 175.95 2kfd s SER 46 N 0.00 6.83 0.00 4.31 0.01 -0.75 -4.93 113.70 119.17 2kfd s SER 46 Ca 0.00 0.92 0.16 0.00 1.31 0.00 0.00 55.95 58.34 2kfd s SER 46 Cb 0.00 -2.47 0.81 0.00 0.21 0.00 0.00 66.02 64.57 2kfd s SER 46 CO 0.00 -0.71 1.44 0.00 0.41 0.00 0.00 173.24 174.38 2kfd n LEU 47 N 6.44 0.00 0.15 2.44 -0.00 -1.26 -1.30 117.00 123.47 2kfd n LEU 47 Ca 0.08 0.26 0.13 0.00 -0.00 0.00 0.00 56.01 56.48 2kfd n LEU 47 Cb 0.47 -0.26 0.35 0.00 -0.00 0.00 0.00 43.42 43.98 2kfd n LEU 47 CO 0.53 -0.13 0.87 -0.08 -0.00 0.00 0.00 177.39 178.58 2kfd h GLU 48 N 0.00 0.00 0.00 1.47 4.57 -1.94 0.12 114.58 118.80 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 -0.22 -0.92 -1.18 0.00 0.00 179.01 176.69 2kfd h TYR 49 N 0.00 0.00 -0.00 0.92 3.20 -1.55 -2.86 116.97 116.68 2kfd h TYR 49 Ca 0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 2kfd h TYR 49 Cb 0.79 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.06 2kfd h TYR 49 CO 0.00 0.00 -0.51 1.17 -1.64 0.00 0.00 178.16 177.18 2kfd n LYS 50 N -3.00 0.07 0.00 1.82 4.81 -0.48 -3.45 118.16 117.93 2kfd n LYS 50 Ca 0.03 -0.04 0.13 0.00 -0.87 0.00 0.00 58.31 57.56 2kfd n LYS 50 Cb 0.53 -1.50 0.48 0.00 0.02 0.00 0.00 35.03 34.56 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 -1.43 2.93 -1.81 3.14 0.00 0.30 -3.98 120.51 119.67 2kfd n ALA 51 Ca 0.06 -0.34 0.05 0.00 0.00 0.00 0.00 53.44 53.21 2kfd n ALA 51 Cb 0.34 -1.22 0.08 0.00 0.00 0.00 0.00 19.45 18.64 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 -0.80 1.36 -0.11 0.00 7.94 -1.22 -4.82 117.00 119.35 2kfd n LEU 52 Ca 0.13 -2.34 -0.08 0.00 -1.11 0.00 0.00 56.01 52.61 2kfd n LEU 52 Cb 0.32 -0.21 0.07 0.00 0.53 0.00 0.00 43.42 44.13 2kfd n LEU 52 CO 0.25 0.65 0.72 1.23 -1.11 0.00 0.00 177.39 179.14 2kfd h GLY 53 N 0.44 0.92 0.96 -3.96 0.00 -1.69 -3.18 103.07 96.56 2kfd h GLY 53 Ca -0.06 -0.76 -0.18 0.00 0.00 0.00 0.00 47.33 46.33 2kfd h GLY 53 CO 0.02 0.70 -0.67 -1.80 0.00 0.00 0.00 176.54 174.79 2kfd h ASP 54 N 0.75 0.71 -0.66 0.19 3.58 -1.92 -3.09 116.42 115.98 2kfd h ASP 54 Ca 0.11 -0.69 -0.52 0.00 0.42 0.00 0.00 57.03 56.35 2kfd h ASP 54 Cb 0.71 -0.21 -0.10 0.00 1.72 0.00 0.00 39.33 41.44 2kfd h ASP 54 CO 0.05 1.29 1.32 -0.62 -2.88 0.00 0.00 179.24 178.41 2kfd n GLU 55 N -4.11 3.10 -0.19 0.28 -0.58 -1.20 -4.63 120.64 113.31 2kfd n GLU 55 Ca -0.09 -2.30 -0.02 0.00 -0.42 0.00 0.00 57.16 54.33 2kfd n GLU 55 Cb 0.70 -2.35 0.08 0.00 -0.57 0.00 0.00 31.44 29.29 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 3.76 0.33 0.71 1.62 1.82 -1.56 0.98 116.42 124.07 2kfd h ASP 56 Ca 0.51 0.05 -0.09 0.00 -0.39 0.00 0.00 57.03 57.10 2kfd h ASP 56 Cb 0.72 -0.01 -0.01 0.00 0.68 0.00 0.00 39.33 40.71 2kfd h ASP 56 CO 1.03 0.22 -0.44 -0.55 -1.61 0.00 0.00 179.24 177.89 2kfd h ASN 57 N 0.48 0.00 0.12 2.28 -0.00 -1.90 0.14 115.58 116.70 2kfd h ASN 57 Ca 0.26 0.00 -0.01 0.00 -0.00 0.00 0.00 56.30 56.56 2kfd h ASN 57 Cb 0.23 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 38.55 2kfd h ASN 57 CO -0.21 0.44 -0.06 0.40 -0.00 0.00 0.00 177.43 178.00 2kfd h ILE 58 N 0.00 1.04 -0.47 6.14 5.03 -1.77 -2.33 117.51 125.15 2kfd h ILE 58 Ca -0.00 -1.13 0.09 0.00 -0.12 0.00 0.00 64.86 63.70 2kfd h ILE 58 Cb 0.92 1.70 -0.09 0.00 -3.03 0.00 0.00 36.82 36.32 2kfd h ILE 58 CO 0.06 0.25 -0.14 -0.09 -0.68 0.00 0.00 178.15 177.55 2kfd h ARG 59 N -0.74 -0.02 -0.49 2.37 2.43 -0.25 0.36 114.38 118.03 2kfd h ARG 59 Ca -0.02 0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.12 2kfd h ARG 59 Cb 0.54 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.07 2kfd h ARG 59 CO 0.03 -0.02 0.16 0.07 -1.51 0.00 0.00 179.97 178.70 2kfd h ARG 60 N -0.02 0.76 -0.05 0.20 0.11 -0.84 -2.56 114.38 111.98 2kfd h ARG 60 Ca 0.23 -0.16 -0.00 0.00 0.10 0.00 0.00 59.98 60.14 2kfd h ARG 60 Cb 0.37 -0.11 -0.00 0.00 1.11 0.00 0.00 29.97 31.34 2kfd h ARG 60 CO -0.49 0.71 0.02 1.96 0.10 0.00 0.00 179.97 182.27 2kfd h GLN 61 N 0.66 0.08 -0.28 0.08 1.08 -0.62 -1.96 115.11 114.16 2kfd h GLN 61 Ca 0.16 -0.02 -0.00 0.00 -1.45 0.00 0.00 58.65 57.34 2kfd h GLN 61 Cb 0.27 -0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 27.67 2kfd h GLN 61 CO -0.01 0.22 0.17 0.82 -0.95 0.00 0.00 178.83 179.09 2kfd h ILE 62 N -0.08 1.10 -0.60 2.54 2.04 -1.04 -1.97 117.51 119.49 2kfd h ILE 62 Ca 0.02 -0.23 0.12 0.00 1.00 0.00 0.00 64.86 65.77 2kfd h ILE 62 Cb 0.17 0.75 -0.10 0.00 -0.74 0.00 0.00 36.82 36.91 2kfd h ILE 62 CO -0.00 0.10 -0.01 0.15 0.00 0.00 0.00 178.15 178.39 2kfd h PHE 63 N 0.35 -0.06 -0.68 1.37 3.57 -1.31 0.14 116.94 120.32 2kfd h PHE 63 Ca 0.10 0.05 -0.04 0.00 3.53 0.00 0.00 57.97 61.60 2kfd h PHE 63 Cb 0.01 0.12 -0.03 0.00 2.79 0.00 0.00 35.95 38.84 2kfd h PHE 63 CO -0.04 -0.17 0.26 1.49 -2.23 0.00 0.00 178.31 177.62 2kfd h GLU 64 N 0.11 1.02 -0.00 1.11 4.57 -1.06 -2.41 114.58 117.91 2kfd h GLU 64 Ca 0.31 -0.18 0.00 0.00 -1.18 0.00 0.00 59.36 58.32 2kfd h GLU 64 Cb 0.50 -0.17 0.00 0.00 -0.16 0.00 0.00 28.75 28.93 2kfd h GLU 64 CO -0.52 0.84 -0.07 -3.47 -1.18 0.00 0.00 179.01 174.60 2kfd n ASP 65 N -4.29 0.07 0.33 1.04 2.03 0.04 -4.23 116.55 111.53 2kfd n ASP 65 Ca 0.06 0.37 -0.17 0.00 0.52 0.00 0.00 54.79 55.57 2kfd n ASP 65 Cb 0.19 -0.39 -0.09 0.00 -0.72 0.00 0.00 41.12 40.11 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 0.01 -0.83 -4.06 -0.67 0.04 -0.28 -3.49 116.94 107.64 2kfd h PHE 66 Ca 0.00 -0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.76 2kfd h PHE 66 Cb 0.49 0.29 0.00 0.00 2.20 0.00 0.00 35.95 38.93 2kfd h PHE 66 CO 0.00 -0.50 -0.82 1.63 -0.60 0.00 0.00 178.31 178.02 2kfd n LYS 67 N -5.46 -4.56 0.00 1.51 4.76 -1.26 -5.04 118.16 108.11 2kfd n LYS 67 Ca -0.13 3.34 0.00 0.00 -2.87 0.00 0.00 58.31 58.66 2kfd n LYS 67 Cb 0.35 -3.84 0.00 0.00 -1.84 0.00 0.00 35.03 29.70 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 1.58 1.42 -0.39 1.97 -0.04 -1.26 -5.10 135.00 133.18 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 0.39 -0.04 0.00 0.00 175.50 175.85