#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 -0.09 1.20 -0.00 -2.05 0.21 114.58 114.75 2kfd h GLU 6 Ca 0.00 -0.05 -0.08 0.00 -0.00 0.00 0.00 59.36 59.23 2kfd h GLU 6 Cb 0.00 -0.20 -0.01 0.00 -0.00 0.00 0.00 28.75 28.54 2kfd h GLU 6 CO 0.00 0.60 -0.31 0.00 -0.00 0.00 0.00 179.01 179.30 2kfd h ARG 7 N 0.93 0.18 -0.16 1.06 2.47 -2.05 0.22 114.38 117.02 2kfd h ARG 7 Ca 0.38 -0.06 -0.13 0.00 -1.26 0.00 0.00 59.98 58.90 2kfd h ARG 7 Cb 0.21 -0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 28.51 2kfd h ARG 7 CO -0.19 0.47 -0.47 -0.09 0.56 0.00 0.00 179.97 180.26 2kfd h ARG 8 N 0.16 0.40 -0.31 0.04 2.43 -1.59 -2.30 114.38 113.21 2kfd h ARG 8 Ca 0.02 -0.22 -0.18 0.00 -0.81 0.00 0.00 59.98 58.79 2kfd h ARG 8 Cb 0.63 0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 30.19 2kfd h ARG 8 CO 0.05 0.79 -0.52 0.82 -1.51 0.00 0.00 179.97 179.59 2kfd h ILE 9 N 0.32 1.27 -0.66 1.20 2.04 0.47 0.16 117.51 122.31 2kfd h ILE 9 Ca 0.02 -1.70 -0.04 0.00 1.00 0.00 0.00 64.86 64.14 2kfd h ILE 9 Cb 0.95 1.59 -0.03 0.00 -0.74 0.00 0.00 36.82 38.59 2kfd h ILE 9 CO 0.08 0.56 0.24 0.25 0.00 0.00 0.00 178.15 179.28 2kfd h LEU 10 N 0.69 0.93 -0.78 1.44 5.85 -0.57 0.46 115.31 123.33 2kfd h LEU 10 Ca 0.02 -0.19 -0.13 0.00 0.84 0.00 0.00 57.88 58.43 2kfd h LEU 10 Cb 1.13 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.90 2kfd h LEU 10 CO 0.12 0.86 -0.55 -0.33 -0.34 0.00 0.00 178.44 178.20 2kfd h GLU 11 N 0.94 0.16 -0.27 1.25 4.39 -1.35 0.13 114.58 119.83 2kfd h GLU 11 Ca 0.22 -0.10 -0.05 0.00 0.34 0.00 0.00 59.36 59.77 2kfd h GLU 11 Cb 0.24 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.89 2kfd h GLU 11 CO -0.01 0.67 -0.02 0.37 -1.16 0.00 0.00 179.01 178.85 2kfd h GLN 12 N 0.12 0.49 -0.42 2.33 4.15 -0.12 -0.73 115.11 120.94 2kfd h GLN 12 Ca -0.00 -0.17 0.02 0.00 0.77 0.00 0.00 58.65 59.27 2kfd h GLN 12 Cb 1.01 -0.04 -0.03 0.00 0.21 0.00 0.00 27.48 28.64 2kfd h GLN 12 CO 0.08 0.67 0.25 0.87 -1.93 0.00 0.00 178.83 178.77 2kfd h LYS 13 N 0.26 0.48 -0.52 1.69 1.57 0.05 -0.91 116.57 119.19 2kfd h LYS 13 Ca 0.07 -0.03 0.10 0.00 -1.87 0.00 0.00 60.65 58.93 2kfd h LYS 13 Cb 0.47 -0.11 -0.10 0.00 0.08 0.00 0.00 32.23 32.56 2kfd h LYS 13 CO 0.02 0.32 -0.21 -0.22 -0.57 0.00 0.00 179.45 178.79 2kfd h LYS 14 N 0.50 -0.09 0.02 3.15 3.64 -0.45 0.35 116.57 123.69 2kfd h LYS 14 Ca 0.17 0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.55 2kfd h LYS 14 Cb 0.01 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 31.85 2kfd h LYS 14 CO -0.08 -0.06 -0.01 1.25 -2.27 0.00 0.00 179.45 178.29 2kfd h HIS 15 N -0.09 -0.03 0.00 1.91 2.76 -0.84 -1.90 115.15 116.96 2kfd h HIS 15 Ca 0.24 -0.00 -0.04 0.00 -2.20 0.00 0.00 60.37 58.38 2kfd h HIS 15 Cb 0.47 0.01 -0.01 0.00 1.55 0.00 0.00 27.41 29.43 2kfd h HIS 15 CO -0.50 0.43 -0.17 -0.92 -1.30 0.00 0.00 177.93 175.46 2kfd h TYR 16 N -0.49 0.00 0.00 5.26 3.20 -0.85 0.43 116.97 124.52 2kfd h TYR 16 Ca -0.00 0.00 -0.17 0.00 3.14 0.00 0.00 58.73 61.69 2kfd h TYR 16 Cb 0.47 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 38.71 2kfd h TYR 16 CO 0.08 0.17 -0.83 0.35 -1.64 0.00 0.00 178.16 176.30 2kfd h PHE 17 N 0.00 0.00 0.00 -3.82 3.57 -0.30 0.25 116.94 116.64 2kfd h PHE 17 Ca -0.00 0.00 -0.17 0.00 3.53 0.00 0.00 57.97 61.33 2kfd h PHE 17 Cb 0.65 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.36 2kfd h PHE 17 CO 0.00 0.82 -0.80 2.35 -2.23 0.00 0.00 178.31 178.45 2kfd h TRP 18 N 0.00 0.00 -0.29 0.41 -0.00 -0.37 1.00 115.95 116.69 2kfd h TRP 18 Ca -0.01 0.00 -0.15 0.00 -0.00 0.00 0.00 58.89 58.73 2kfd h TRP 18 Cb 1.63 0.00 -0.01 0.00 -0.00 0.00 0.00 29.16 30.79 2kfd h TRP 18 CO 0.00 0.80 -0.41 1.25 -0.00 0.00 0.00 178.44 180.08 2kfd h LEU 19 N 0.00 0.77 0.05 0.65 6.46 -0.01 0.18 115.31 123.41 2kfd h LEU 19 Ca -0.01 -0.35 -0.00 0.00 -0.12 0.00 0.00 57.88 57.40 2kfd h LEU 19 Cb 1.47 -0.22 0.00 0.00 -0.73 0.00 0.00 40.66 41.18 2kfd h LEU 19 CO 0.10 1.08 -0.03 0.25 -0.62 0.00 0.00 178.44 179.23 2kfd h LEU 20 N 0.59 -0.06 -0.73 2.25 7.12 -0.28 -1.76 115.31 122.43 2kfd h LEU 20 Ca 0.05 -0.44 -0.13 0.00 0.13 0.00 0.00 57.88 57.49 2kfd h LEU 20 Cb 0.96 0.02 -0.01 0.00 -0.53 0.00 0.00 40.66 41.09 2kfd h LEU 20 CO 0.09 0.42 -0.54 0.25 -0.13 0.00 0.00 178.44 178.53 2kfd h LEU 21 N -0.56 0.29 0.13 2.25 7.12 0.11 -0.88 115.31 123.77 2kfd h LEU 21 Ca -0.01 -0.15 -0.28 0.00 0.13 0.00 0.00 57.88 57.57 2kfd h LEU 21 Cb 0.49 -0.08 0.01 0.00 -0.53 0.00 0.00 40.66 40.55 2kfd h LEU 21 CO 0.01 0.77 -1.27 -0.61 -0.13 0.00 0.00 178.44 177.21 2kfd h GLN 22 N 0.20 0.34 -0.83 1.25 4.15 -0.74 0.59 115.11 120.07 2kfd h GLN 22 Ca 0.00 -0.56 0.05 0.00 0.77 0.00 0.00 58.65 58.90 2kfd h GLN 22 Cb 1.02 0.21 -0.05 0.00 0.21 0.00 0.00 27.48 28.86 2kfd h GLN 22 CO 0.08 1.26 0.52 -0.09 -1.93 0.00 0.00 178.83 178.68 2kfd h ARG 23 N 0.10 0.95 0.03 1.69 1.12 -1.07 -2.34 114.38 114.87 2kfd h ARG 23 Ca -0.16 -0.06 -0.00 0.00 -1.11 0.00 0.00 59.98 58.66 2kfd h ARG 23 Cb 1.98 -0.21 0.00 0.00 -0.01 0.00 0.00 29.97 31.73 2kfd h ARG 23 CO 0.22 0.63 -0.01 1.15 -3.11 0.00 0.00 179.97 178.84 2kfd h THR 24 N 0.98 0.40 -3.55 0.20 2.02 -1.18 -3.42 112.91 108.35 2kfd h THR 24 Ca 0.34 -1.25 -0.71 0.00 0.77 0.00 0.00 66.41 65.56 2kfd h THR 24 Cb 0.09 0.74 -0.34 0.00 -1.74 0.00 0.00 68.15 66.90 2kfd h THR 24 CO -0.14 0.13 -0.33 -0.31 0.37 0.00 0.00 175.52 175.24 2kfd s TYR 25 N -1.86 3.48 0.00 3.16 2.02 0.21 -4.09 117.35 120.26 2kfd s TYR 25 Ca -0.05 -2.52 0.00 0.00 -0.37 0.00 0.00 57.07 54.14 2kfd s TYR 25 Cb -0.01 -3.31 0.00 0.00 -0.40 0.00 0.00 41.96 38.25 2kfd s TYR 25 CO 0.17 -0.89 0.00 2.41 -1.57 0.00 0.00 175.55 175.67 2kfd n THR 26 N 3.80 0.00 0.04 -0.71 -1.04 -0.71 -3.99 114.28 111.67 2kfd n THR 26 Ca 0.06 0.00 -0.07 0.00 -2.04 0.00 0.00 64.05 62.00 2kfd n THR 26 Cb 0.40 -1.06 -0.12 0.00 -1.82 0.00 0.00 70.33 67.72 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 -3.39 116.57 110.60 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 0.84 -0.24 -2.37 -2.00 0.00 0.00 179.45 175.67 2kfd n THR 28 N -3.26 0.00 0.00 0.07 5.66 -1.26 -4.80 114.28 110.69 2kfd n THR 28 Ca -0.05 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.95 2kfd n THR 28 Cb 0.97 -0.20 0.00 0.00 -1.55 0.00 0.00 70.33 69.54 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 1.06 -2.04 3.72 1.09 0.00 -1.26 -4.47 105.19 103.28 2kfd n GLY 29 Ca 0.00 0.20 -0.35 0.00 0.00 0.00 0.00 46.02 45.87 2kfd n GLY 29 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2kfd s LYS 30 N -0.43 4.18 0.60 1.61 2.47 -1.26 -4.89 119.74 122.02 2kfd s LYS 30 Ca 0.00 -0.22 -0.19 0.00 -1.56 0.00 0.00 55.97 53.99 2kfd s LYS 30 Cb 0.00 -3.43 -0.03 0.00 -1.46 0.00 0.00 37.83 32.91 2kfd s LYS 30 CO 0.00 0.27 1.30 -2.14 0.16 0.00 0.00 175.35 174.95 2kfd s PRO 31 N 0.44 2.81 -0.52 4.03 0.02 -1.26 -1.74 135.00 138.78 2kfd s PRO 31 Ca 0.08 2.09 -0.28 0.00 0.02 0.00 0.00 61.00 62.91 2kfd s PRO 31 Cb -0.11 -2.00 0.02 0.00 0.02 0.00 0.00 34.50 32.43 2kfd s PRO 31 CO -0.01 -1.40 1.28 0.21 -0.33 0.00 0.00 177.00 176.75 2kfd s LYS 32 N -3.20 3.51 0.18 5.54 2.47 -1.26 -4.84 119.74 122.15 2kfd s LYS 32 Ca 0.78 0.50 -0.12 0.00 -1.56 0.00 0.00 55.97 55.58 2kfd s LYS 32 Cb -0.38 -4.02 -0.08 0.00 -1.46 0.00 0.00 37.83 31.89 2kfd s LYS 32 CO 0.42 -1.67 0.09 -2.30 0.16 0.00 0.00 175.35 172.05 2kfd n PRO 33 N 8.31 0.00 0.00 4.03 -0.02 -1.26 -4.87 135.00 141.19 2kfd n PRO 33 Ca 0.12 0.00 0.14 0.00 -2.02 0.00 0.00 63.50 61.74 2kfd n PRO 33 Cb 0.49 -0.51 0.54 0.00 -0.02 0.00 0.00 33.50 34.00 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 1.16 1.07 -3.67 2.55 7.64 -1.26 -4.79 113.62 116.32 2kfd n SER 34 Ca 0.06 -1.15 -0.13 0.00 1.01 0.00 0.00 58.87 58.67 2kfd n SER 34 Cb 0.19 0.03 -0.08 0.00 -1.01 0.00 0.00 64.21 63.33 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 -2.21 -0.00 0.22 0.44 2.01 -1.26 -5.02 115.64 109.82 2kfd s THR 35 Ca 0.34 0.01 0.36 0.00 0.31 0.00 0.00 61.69 62.70 2kfd s THR 35 Cb 0.20 -0.82 0.40 0.00 0.01 0.00 0.00 72.50 72.30 2kfd s THR 35 CO 0.41 0.00 2.07 -0.25 -0.69 0.00 0.00 174.62 176.16 2kfd h TRP 36 N 5.44 0.00 0.38 4.92 2.91 -1.92 -3.00 115.95 124.69 2kfd h TRP 36 Ca -0.29 0.00 -0.01 0.00 1.13 0.00 0.00 58.89 59.73 2kfd h TRP 36 Cb 1.17 0.00 -0.02 0.00 -0.51 0.00 0.00 29.16 29.81 2kfd h TRP 36 CO 0.36 0.00 -0.31 -0.44 -1.03 0.00 0.00 178.44 177.02 2kfd h ASP 37 N 0.00 -0.83 0.36 2.65 3.32 -1.99 0.35 116.42 120.29 2kfd h ASP 37 Ca 0.00 0.06 -0.11 0.00 0.02 0.00 0.00 57.03 57.01 2kfd h ASP 37 Cb 0.37 0.27 -0.01 0.00 0.22 0.00 0.00 39.33 40.17 2kfd h ASP 37 CO 0.00 -0.46 -0.46 0.17 -1.72 0.00 0.00 179.24 176.77 2kfd h LEU 38 N -0.70 0.13 0.09 1.55 -0.00 -1.97 -2.81 115.31 111.60 2kfd h LEU 38 Ca -0.03 -0.06 -0.00 0.00 -0.00 0.00 0.00 57.88 57.79 2kfd h LEU 38 Cb 0.61 -0.04 0.00 0.00 -0.00 0.00 0.00 40.66 41.24 2kfd h LEU 38 CO -0.02 0.57 -0.04 0.00 -0.00 0.00 0.00 178.44 178.95 2kfd h ALA 39 N 1.43 -0.12 -0.64 0.17 0.00 -1.34 -2.54 119.26 116.22 2kfd h ALA 39 Ca 0.00 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 2kfd h ALA 39 Cb 0.85 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.66 2kfd h ALA 39 CO 0.07 -0.41 0.34 0.66 0.00 0.00 0.00 179.25 179.90 2kfd h SER 40 N -0.45 0.81 0.11 0.00 4.64 -0.23 0.69 113.55 119.11 2kfd h SER 40 Ca -0.01 -0.11 -0.10 0.00 -0.47 0.00 0.00 61.79 61.10 2kfd h SER 40 Cb 0.38 -0.21 -0.01 0.00 -0.31 0.00 0.00 62.40 62.25 2kfd h SER 40 CO 0.02 0.69 -0.33 0.07 -0.87 0.00 0.00 176.83 176.40 2kfd h LYS 41 N 0.87 0.33 0.00 4.77 2.10 -1.51 0.57 116.57 123.70 2kfd h LYS 41 Ca 0.22 -0.14 -0.06 0.00 -2.00 0.00 0.00 60.65 58.67 2kfd h LYS 41 Cb 0.07 -0.01 -0.01 0.00 -0.90 0.00 0.00 32.23 31.38 2kfd h LYS 41 CO -0.03 0.63 -0.51 1.49 -2.00 0.00 0.00 179.45 179.03 2kfd h GLU 42 N 0.29 0.00 0.00 0.07 4.57 -1.00 -3.29 114.58 115.22 2kfd h GLU 42 Ca 0.04 0.00 -0.19 0.00 -1.18 0.00 0.00 59.36 58.03 2kfd h GLU 42 Cb 0.73 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.30 2kfd h GLU 42 CO 0.06 0.23 -0.86 1.25 -1.18 0.00 0.00 179.01 178.50 2kfd h LEU 43 N 0.00 0.15 -8.43 1.64 7.12 0.11 -3.42 115.31 112.48 2kfd h LEU 43 Ca -0.02 -0.12 -0.27 0.00 0.13 0.00 0.00 57.88 57.59 2kfd h LEU 43 Cb 1.22 -0.05 -0.01 0.00 -0.53 0.00 0.00 40.66 41.29 2kfd h LEU 43 CO 0.03 0.93 0.85 -0.83 -0.13 0.00 0.00 178.44 179.30 2kfd s GLY 44 N -4.55 -0.39 0.00 3.75 0.00 0.13 -1.68 107.32 104.57 2kfd s GLY 44 Ca -0.02 -0.63 0.00 0.00 0.00 0.00 0.00 44.72 44.07 2kfd s GLY 44 CO 0.81 3.97 0.00 -2.21 0.00 0.00 0.00 173.10 175.67 2kfd n GLU 45 N 8.94 0.00 -3.69 2.90 4.07 -1.26 -5.03 120.64 126.57 2kfd n GLU 45 Ca 0.39 0.00 -0.36 0.00 -0.06 0.00 0.00 57.16 57.12 2kfd n GLU 45 Cb 0.49 0.00 -0.07 0.00 -0.06 0.00 0.00 31.44 31.80 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 6.40 0.00 4.31 0.01 -0.68 -4.99 113.70 118.75 2kfd s SER 46 Ca 0.00 0.46 0.28 0.00 1.31 0.00 0.00 55.95 58.01 2kfd s SER 46 Cb 0.00 -2.13 1.43 0.00 0.21 0.00 0.00 66.02 65.53 2kfd s SER 46 CO 0.00 0.24 1.97 0.18 0.41 0.00 0.00 173.24 176.04 2kfd n LEU 47 N 2.89 0.00 0.14 2.44 7.99 -1.26 -2.86 117.00 126.34 2kfd n LEU 47 Ca -0.16 0.28 0.13 0.00 -0.01 0.00 0.00 56.01 56.25 2kfd n LEU 47 Cb 0.53 -0.28 0.30 0.00 -0.11 0.00 0.00 43.42 43.86 2kfd n LEU 47 CO 0.36 -0.02 0.82 -0.08 -1.51 0.00 0.00 177.39 176.96 2kfd h GLU 48 N 0.00 0.00 0.00 3.23 4.57 -1.94 0.18 114.58 120.62 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 0.26 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.85 2kfd h GLU 48 CO 0.00 0.00 -0.47 0.98 -1.18 0.00 0.00 179.01 178.34 2kfd n TYR 49 N -2.56 0.60 1.04 0.92 9.36 -1.13 -2.17 117.16 123.21 2kfd n TYR 49 Ca 0.05 0.17 0.12 0.00 3.32 0.00 0.00 57.90 61.57 2kfd n TYR 49 Cb 0.47 -0.69 0.33 0.00 -0.63 0.00 0.00 39.34 38.82 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 -2.10 0.10 0.00 2.98 4.81 -0.25 -3.35 118.16 120.36 2kfd n LYS 50 Ca 0.04 -0.05 0.15 0.00 -0.87 0.00 0.00 58.31 57.58 2kfd n LYS 50 Cb 0.43 -1.50 0.77 0.00 0.02 0.00 0.00 35.03 34.75 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 -1.40 2.58 -1.43 3.14 0.00 0.48 -3.40 120.51 120.47 2kfd n ALA 51 Ca 0.07 -0.18 0.07 0.00 0.00 0.00 0.00 53.44 53.40 2kfd n ALA 51 Cb 0.33 -1.46 0.13 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 -1.14 2.05 -1.45 0.00 4.77 -1.21 -4.75 117.00 115.27 2kfd n LEU 52 Ca 0.16 -2.97 0.00 0.00 -0.03 0.00 0.00 56.01 53.17 2kfd n LEU 52 Cb 0.22 -0.37 0.00 0.00 -2.33 0.00 0.00 43.42 40.94 2kfd n LEU 52 CO 0.22 0.83 0.87 0.61 -1.33 0.00 0.00 177.39 178.59 2kfd n GLY 53 N -1.03 2.30 0.00 -0.72 0.00 -1.22 -2.29 105.19 102.23 2kfd n GLY 53 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 2kfd n GLY 53 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2kfd n ASP 54 N 1.38 0.00 -2.57 1.61 5.75 -1.26 -4.89 116.55 116.57 2kfd n ASP 54 Ca 0.00 0.00 -0.24 0.00 -0.01 0.00 0.00 54.79 54.54 2kfd n ASP 54 Cb 0.47 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.56 2kfd n ASP 54 CO 0.00 0.00 0.00 1.21 -0.11 0.00 0.00 177.20 178.30 2kfd n GLU 55 N -0.24 2.97 -0.16 0.11 4.07 -0.97 -4.91 120.64 121.51 2kfd n GLU 55 Ca 0.00 -4.30 -0.05 0.00 -0.06 0.00 0.00 57.16 52.75 2kfd n GLU 55 Cb 0.00 -2.06 0.04 0.00 -0.06 0.00 0.00 31.44 29.36 2kfd n GLU 55 CO 0.00 0.00 0.00 0.22 -0.06 0.00 0.00 177.13 177.29 2kfd h ASP 56 N 2.70 0.39 0.42 4.31 3.58 -1.85 0.15 116.42 126.11 2kfd h ASP 56 Ca 0.21 0.02 -0.10 0.00 0.42 0.00 0.00 57.03 57.58 2kfd h ASP 56 Cb 0.93 -0.05 -0.01 0.00 1.72 0.00 0.00 39.33 41.91 2kfd h ASP 56 CO 0.78 0.27 -0.47 -0.55 -2.88 0.00 0.00 179.24 176.39 2kfd h ASN 57 N 0.51 0.07 0.30 2.28 -0.00 -1.91 0.29 115.58 117.12 2kfd h ASN 57 Ca 0.21 -0.03 -0.01 0.00 -0.00 0.00 0.00 56.30 56.46 2kfd h ASN 57 Cb 0.10 -0.02 0.00 0.00 -0.00 0.00 0.00 38.32 38.40 2kfd h ASN 57 CO -0.14 0.53 -0.14 0.40 -0.00 0.00 0.00 177.43 178.08 2kfd h ILE 58 N 0.06 0.73 -0.06 6.14 5.03 -1.82 -2.18 117.51 125.41 2kfd h ILE 58 Ca 0.00 -0.26 0.03 0.00 -0.12 0.00 0.00 64.86 64.51 2kfd h ILE 58 Cb 0.85 0.88 -0.03 0.00 -3.03 0.00 0.00 36.82 35.49 2kfd h ILE 58 CO 0.06 0.06 -0.13 -0.09 -0.68 0.00 0.00 178.15 177.37 2kfd h ARG 59 N -0.54 -0.18 -0.87 2.37 2.43 0.12 0.36 114.38 118.08 2kfd h ARG 59 Ca -0.04 0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.14 2kfd h ARG 59 Cb 0.40 0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 29.95 2kfd h ARG 59 CO 0.07 -0.12 0.53 0.07 -1.51 0.00 0.00 179.97 179.01 2kfd h ARG 60 N -0.18 1.17 0.05 0.20 0.11 -0.62 -1.93 114.38 113.17 2kfd h ARG 60 Ca 0.07 -0.10 -0.00 0.00 0.10 0.00 0.00 59.98 60.05 2kfd h ARG 60 Cb 0.28 -0.25 0.00 0.00 1.11 0.00 0.00 29.97 31.11 2kfd h ARG 60 CO -0.17 0.81 -0.02 1.96 0.10 0.00 0.00 179.97 182.65 2kfd h GLN 61 N 1.19 -0.06 -0.76 0.08 1.08 -0.51 -2.52 115.11 113.60 2kfd h GLN 61 Ca 0.31 0.00 0.05 0.00 -1.45 0.00 0.00 58.65 57.56 2kfd h GLN 61 Cb -0.06 0.01 -0.05 0.00 -0.05 0.00 0.00 27.48 27.33 2kfd h GLN 61 CO -0.06 0.47 0.47 0.82 -0.95 0.00 0.00 178.83 179.58 2kfd h ILE 62 N -0.63 1.05 -0.26 2.54 2.04 -0.34 0.27 117.51 122.18 2kfd h ILE 62 Ca -0.01 -0.30 0.06 0.00 1.00 0.00 0.00 64.86 65.61 2kfd h ILE 62 Cb 0.56 0.09 -0.06 0.00 -0.74 0.00 0.00 36.82 36.67 2kfd h ILE 62 CO 0.01 0.16 -0.15 0.15 0.00 0.00 0.00 178.15 178.32 2kfd h PHE 63 N 0.88 -0.39 -0.37 1.37 3.57 -1.34 0.83 116.94 121.49 2kfd h PHE 63 Ca 0.32 0.03 -0.12 0.00 3.53 0.00 0.00 57.97 61.74 2kfd h PHE 63 Cb 0.11 0.21 -0.01 0.00 2.79 0.00 0.00 35.95 39.05 2kfd h PHE 63 CO -0.04 -0.23 -0.26 1.49 -2.23 0.00 0.00 178.31 177.04 2kfd h GLU 64 N -0.13 0.77 0.00 1.11 4.57 -0.96 -2.90 114.58 117.04 2kfd h GLU 64 Ca 0.14 -0.32 0.00 0.00 -1.18 0.00 0.00 59.36 58.00 2kfd h GLU 64 Cb 0.34 -0.03 0.00 0.00 -0.16 0.00 0.00 28.75 28.91 2kfd h GLU 64 CO -0.34 0.94 0.00 -0.25 -1.18 0.00 0.00 179.01 178.18 2kfd n ASP 65 N -4.10 0.00 0.23 1.04 8.00 0.91 -4.12 116.55 118.51 2kfd n ASP 65 Ca -0.00 -0.03 -0.15 0.00 0.71 0.00 0.00 54.79 55.31 2kfd n ASP 65 Cb 0.45 -0.32 -0.08 0.00 -0.02 0.00 0.00 41.12 41.15 2kfd n ASP 65 CO 0.00 0.00 0.00 -0.26 -0.39 0.00 0.00 177.20 176.55 2kfd h PHE 66 N 0.00 -0.50 -4.51 1.24 0.04 0.85 -3.49 116.94 110.57 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 0.32 0.17 -0.02 0.00 2.20 0.00 0.00 35.95 38.61 2kfd h PHE 66 CO 0.00 -0.25 -0.98 1.63 -0.60 0.00 0.00 178.31 178.11 2kfd n LYS 67 N -5.28 -4.65 0.00 1.51 4.76 -1.26 -5.04 118.16 108.20 2kfd n LYS 67 Ca -0.11 3.44 0.00 0.00 -2.87 0.00 0.00 58.31 58.77 2kfd n LYS 67 Cb 0.25 -4.40 0.00 0.00 -1.84 0.00 0.00 35.03 29.05 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 1.65 2.20 -0.83 1.97 -0.04 -1.26 -5.14 135.00 133.54 2kfd n PRO 68 Ca -0.06 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.40 2kfd n PRO 68 Cb 0.09 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.55 2kfd n PRO 68 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85