#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 0.00 -0.07 1.20 4.39 -2.05 -0.83 114.58 117.23 2kfd h GLU 6 Ca 0.00 0.00 -0.14 0.00 0.34 0.00 0.00 59.36 59.56 2kfd h GLU 6 Cb 0.00 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 28.66 2kfd h GLU 6 CO 0.00 0.59 -0.52 0.00 -1.16 0.00 0.00 179.01 177.92 2kfd h ARG 7 N 0.00 0.47 -0.98 2.33 2.47 -2.04 -0.01 114.38 116.61 2kfd h ARG 7 Ca -0.02 -0.41 0.08 0.00 -1.26 0.00 0.00 59.98 58.36 2kfd h ARG 7 Cb 1.49 0.10 -0.07 0.00 -1.65 0.00 0.00 29.97 29.84 2kfd h ARG 7 CO 0.08 1.05 0.63 -0.09 0.56 0.00 0.00 179.97 182.20 2kfd h ARG 8 N 0.02 1.05 0.06 0.04 2.43 -1.95 0.26 114.38 116.28 2kfd h ARG 8 Ca -0.05 -0.06 -0.00 0.00 -0.81 0.00 0.00 59.98 59.06 2kfd h ARG 8 Cb 1.18 -0.24 0.00 0.00 -0.42 0.00 0.00 29.97 30.50 2kfd h ARG 8 CO 0.11 0.69 -0.03 0.82 -1.51 0.00 0.00 179.97 180.05 2kfd h ILE 9 N 1.08 1.15 -0.63 1.20 2.04 -1.09 -2.15 117.51 119.10 2kfd h ILE 9 Ca 0.44 -0.72 -0.09 0.00 1.00 0.00 0.00 64.86 65.49 2kfd h ILE 9 Cb 0.27 1.62 -0.02 0.00 -0.74 0.00 0.00 36.82 37.95 2kfd h ILE 9 CO -0.19 0.18 0.04 0.25 0.00 0.00 0.00 178.15 178.43 2kfd h LEU 10 N -0.40 1.06 -0.52 1.44 5.85 -0.44 0.73 115.31 123.03 2kfd h LEU 10 Ca -0.01 -0.29 -0.16 0.00 0.84 0.00 0.00 57.88 58.26 2kfd h LEU 10 Cb 0.36 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.09 2kfd h LEU 10 CO 0.01 1.09 -0.67 -0.33 -0.34 0.00 0.00 178.44 178.21 2kfd h GLU 11 N 1.01 0.31 -0.43 1.25 4.39 -0.59 0.30 114.58 120.82 2kfd h GLU 11 Ca 0.18 -0.24 -0.02 0.00 0.34 0.00 0.00 59.36 59.63 2kfd h GLU 11 Cb 0.52 0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 29.20 2kfd h GLU 11 CO 0.03 0.87 0.21 0.37 -1.16 0.00 0.00 179.01 179.32 2kfd h GLN 12 N 0.22 0.62 -0.51 2.33 4.15 -1.08 -2.21 115.11 118.64 2kfd h GLN 12 Ca -0.02 -0.09 -0.05 0.00 0.77 0.00 0.00 58.65 59.26 2kfd h GLN 12 Cb 1.21 -0.11 -0.02 0.00 0.21 0.00 0.00 27.48 28.77 2kfd h GLN 12 CO 0.11 0.54 0.13 -0.22 -1.93 0.00 0.00 178.83 177.45 2kfd h LYS 13 N 0.56 0.77 -0.35 1.69 1.63 -0.52 -1.88 116.57 118.46 2kfd h LYS 13 Ca 0.15 -0.15 0.04 0.00 -0.85 0.00 0.00 60.65 59.84 2kfd h LYS 13 Cb 0.12 -0.12 -0.04 0.00 -0.60 0.00 0.00 32.23 31.59 2kfd h LYS 13 CO -0.02 0.69 0.13 -0.22 -3.45 0.00 0.00 179.45 176.58 2kfd h LYS 14 N 0.74 0.27 -0.45 1.90 3.64 -0.05 0.58 116.57 123.22 2kfd h LYS 14 Ca 0.17 -0.02 -0.05 0.00 -1.27 0.00 0.00 60.65 59.48 2kfd h LYS 14 Cb 0.27 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.01 2kfd h LYS 14 CO -0.00 0.18 0.08 1.25 -2.27 0.00 0.00 179.45 178.69 2kfd h HIS 15 N 0.28 0.78 0.00 1.91 2.76 -1.05 -1.98 115.15 117.85 2kfd h HIS 15 Ca 0.16 -0.10 -0.02 0.00 -2.20 0.00 0.00 60.37 58.20 2kfd h HIS 15 Cb 0.13 -0.22 -0.00 0.00 1.55 0.00 0.00 27.41 28.87 2kfd h HIS 15 CO -0.14 0.73 -0.09 -0.92 -1.30 0.00 0.00 177.93 176.22 2kfd h TYR 16 N 0.61 0.00 0.00 5.26 3.20 -0.87 0.26 116.97 125.42 2kfd h TYR 16 Ca 0.14 0.00 -0.13 0.00 3.14 0.00 0.00 58.73 61.88 2kfd h TYR 16 Cb 0.37 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 38.62 2kfd h TYR 16 CO 0.02 0.09 -0.61 0.35 -1.64 0.00 0.00 178.16 176.37 2kfd h PHE 17 N 0.00 0.00 0.02 -3.82 3.57 0.39 0.63 116.94 117.73 2kfd h PHE 17 Ca -0.00 0.00 -0.22 0.00 3.53 0.00 0.00 57.97 61.28 2kfd h PHE 17 Cb 0.80 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.54 2kfd h PHE 17 CO 0.00 0.61 -0.96 2.35 -2.23 0.00 0.00 178.31 178.09 2kfd h TRP 18 N 0.00 0.49 -0.07 0.41 -0.00 -0.54 0.68 115.95 116.92 2kfd h TRP 18 Ca -0.01 -0.28 -0.13 0.00 -0.00 0.00 0.00 58.89 58.47 2kfd h TRP 18 Cb 1.24 -0.05 -0.01 0.00 -0.00 0.00 0.00 29.16 30.34 2kfd h TRP 18 CO 0.00 1.11 -0.55 1.25 -0.00 0.00 0.00 178.44 180.25 2kfd h LEU 19 N 0.17 0.24 0.03 0.65 6.46 -0.31 0.68 115.31 123.24 2kfd h LEU 19 Ca -0.07 -0.13 -0.00 0.00 -0.12 0.00 0.00 57.88 57.56 2kfd h LEU 19 Cb 1.60 -0.07 0.00 0.00 -0.73 0.00 0.00 40.66 41.46 2kfd h LEU 19 CO 0.16 0.75 -0.01 0.25 -0.62 0.00 0.00 178.44 178.96 2kfd h LEU 20 N 0.17 -0.03 -0.86 2.25 7.12 0.46 -0.51 115.31 123.91 2kfd h LEU 20 Ca 0.00 -0.46 -0.12 0.00 0.13 0.00 0.00 57.88 57.43 2kfd h LEU 20 Cb 1.03 0.01 -0.01 0.00 -0.53 0.00 0.00 40.66 41.15 2kfd h LEU 20 CO 0.08 0.45 -0.49 0.25 -0.13 0.00 0.00 178.44 178.60 2kfd h LEU 21 N -0.53 0.20 0.11 2.25 7.12 0.62 -2.00 115.31 123.09 2kfd h LEU 21 Ca -0.00 -0.10 -0.27 0.00 0.13 0.00 0.00 57.88 57.64 2kfd h LEU 21 Cb 0.49 -0.06 0.03 0.00 -0.53 0.00 0.00 40.66 40.59 2kfd h LEU 21 CO 0.01 0.66 -1.13 -0.61 -0.13 0.00 0.00 178.44 177.24 2kfd h GLN 22 N 0.15 0.57 -0.50 1.25 4.15 0.31 0.21 115.11 121.25 2kfd h GLN 22 Ca 0.01 -0.76 0.10 0.00 0.77 0.00 0.00 58.65 58.76 2kfd h GLN 22 Cb 0.93 0.25 -0.10 0.00 0.21 0.00 0.00 27.48 28.77 2kfd h GLN 22 CO 0.07 1.34 -0.17 -0.09 -1.93 0.00 0.00 178.83 178.06 2kfd h ARG 23 N 0.17 -0.05 0.07 1.69 2.43 -0.92 -2.91 114.38 114.87 2kfd h ARG 23 Ca -0.17 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.00 2kfd h ARG 23 Cb 1.82 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 31.38 2kfd h ARG 23 CO 0.22 -0.03 -0.03 1.15 -1.51 0.00 0.00 179.97 179.76 2kfd h THR 24 N -0.05 0.00 -3.72 0.20 2.02 -1.41 -3.41 112.91 106.54 2kfd h THR 24 Ca 0.24 -0.86 -0.77 0.00 0.77 0.00 0.00 66.41 65.79 2kfd h THR 24 Cb 0.42 0.00 -0.28 0.00 -1.74 0.00 0.00 68.15 66.55 2kfd h THR 24 CO -0.54 0.00 -0.02 -0.31 0.37 0.00 0.00 175.52 175.02 2kfd s TYR 25 N -1.81 3.66 0.00 3.16 2.02 0.74 -3.68 117.35 121.44 2kfd s TYR 25 Ca -0.01 -2.09 0.00 0.00 -0.37 0.00 0.00 57.07 54.59 2kfd s TYR 25 Cb 0.00 -3.69 0.00 0.00 -0.40 0.00 0.00 41.96 37.87 2kfd s TYR 25 CO 0.04 -0.96 0.00 2.41 -1.57 0.00 0.00 175.55 175.47 2kfd n THR 26 N 3.97 0.00 0.07 -0.71 -1.04 -0.12 -4.18 114.28 112.27 2kfd n THR 26 Ca 0.11 0.00 0.09 0.00 -2.04 0.00 0.00 64.05 62.20 2kfd n THR 26 Cb 0.45 0.00 -0.13 0.00 -1.82 0.00 0.00 70.33 68.82 2kfd n THR 26 CO 0.00 0.00 0.00 2.29 -0.64 0.00 0.00 175.07 176.72 2kfd n LYS 27 N 0.00 0.61 0.00 -2.82 2.85 -1.26 -3.99 118.16 113.55 2kfd n LYS 27 Ca 0.00 -0.15 0.00 0.00 -1.05 0.00 0.00 58.31 57.11 2kfd n LYS 27 Cb 0.00 -1.41 0.00 0.00 -0.65 0.00 0.00 35.03 32.97 2kfd n LYS 27 CO 0.00 0.00 0.00 -2.37 -0.05 0.00 0.00 177.40 174.98 2kfd n THR 28 N -2.04 0.00 0.00 0.58 5.66 -1.26 -4.90 114.28 112.32 2kfd n THR 28 Ca -0.03 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.97 2kfd n THR 28 Cb 0.44 -0.28 0.00 0.00 -1.55 0.00 0.00 70.33 68.94 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 1.65 -0.51 3.69 1.09 0.00 -1.26 -4.82 105.19 105.04 2kfd n GLY 29 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 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 0.00 4.21 0.35 1.61 -0.14 -1.24 -4.87 119.74 119.66 2kfd s LYS 30 Ca 0.00 0.20 -0.29 0.00 -1.36 0.00 0.00 55.97 54.52 2kfd s LYS 30 Cb 0.00 -3.50 -0.11 0.00 -1.68 0.00 0.00 37.83 32.54 2kfd s LYS 30 CO 0.00 0.05 1.52 -0.35 -0.76 0.00 0.00 175.35 175.81 2kfd n PRO 31 N 4.15 2.68 -1.99 -1.68 -0.04 -1.26 -0.94 135.00 135.92 2kfd n PRO 31 Ca -0.09 0.94 -0.43 0.00 -0.04 0.00 0.00 63.50 63.88 2kfd n PRO 31 Cb 0.51 -2.69 -0.03 0.00 -0.04 0.00 0.00 33.50 31.26 2kfd n PRO 31 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 2kfd s LYS 32 N -1.64 3.36 0.18 0.54 2.20 -1.26 -4.84 119.74 118.29 2kfd s LYS 32 Ca 0.56 1.47 -0.12 0.00 -0.36 0.00 0.00 55.97 57.52 2kfd s LYS 32 Cb -0.48 -4.19 -0.09 0.00 -1.51 0.00 0.00 37.83 31.56 2kfd s LYS 32 CO 0.59 -1.82 0.11 -2.30 -0.36 0.00 0.00 175.35 171.57 2kfd n PRO 33 N 8.40 0.00 0.10 4.03 -0.02 -1.26 -4.88 135.00 141.36 2kfd n PRO 33 Ca 0.23 0.00 0.12 0.00 -2.02 0.00 0.00 63.50 61.83 2kfd n PRO 33 Cb 0.46 -0.53 0.28 0.00 -0.02 0.00 0.00 33.50 33.70 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 0.28 0.00 -4.17 2.55 0.02 -2.01 -3.45 113.55 106.76 2kfd h SER 34 Ca -0.18 -0.08 -0.15 0.00 -0.84 0.00 0.00 61.79 60.53 2kfd h SER 34 Cb 0.77 0.00 -0.24 0.00 0.14 0.00 0.00 62.40 63.07 2kfd h SER 34 CO 0.27 0.04 -0.39 -0.89 -1.14 0.00 0.00 176.83 174.72 2kfd s THR 35 N -3.14 0.02 -0.99 -2.27 2.01 -1.26 -5.03 115.64 104.98 2kfd s THR 35 Ca 0.08 -0.17 0.14 0.00 0.31 0.00 0.00 61.69 62.05 2kfd s THR 35 Cb 0.12 -0.43 0.12 0.00 0.01 0.00 0.00 72.50 72.32 2kfd s THR 35 CO 0.66 -0.09 1.45 1.87 -0.69 0.00 0.00 174.62 177.81 2kfd n TRP 36 N 2.46 0.01 0.09 4.92 -0.00 -1.26 -3.02 117.44 120.64 2kfd n TRP 36 Ca -0.16 0.00 -0.13 0.00 -0.00 0.00 0.00 57.50 57.22 2kfd n TRP 36 Cb 0.57 -0.51 -0.08 0.00 -0.00 0.00 0.00 31.31 31.29 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 -0.20 0.33 5.87 3.58 -1.98 0.23 116.42 124.25 2kfd h ASP 37 Ca 0.00 -0.25 -0.09 0.00 0.42 0.00 0.00 57.03 57.11 2kfd h ASP 37 Cb 0.24 0.05 -0.01 0.00 1.72 0.00 0.00 39.33 41.33 2kfd h ASP 37 CO 0.00 0.15 -0.40 0.17 -2.88 0.00 0.00 179.24 176.28 2kfd h LEU 38 N -0.59 0.10 0.16 2.28 -0.00 -1.98 -2.12 115.31 113.16 2kfd h LEU 38 Ca -0.02 -0.04 -0.01 0.00 -0.00 0.00 0.00 57.88 57.81 2kfd h LEU 38 Cb 0.44 -0.03 0.00 0.00 -0.00 0.00 0.00 40.66 41.07 2kfd h LEU 38 CO 0.04 0.50 -0.08 0.00 -0.00 0.00 0.00 178.44 178.90 2kfd h ALA 39 N 1.51 -0.21 0.00 0.17 0.00 -1.43 -2.74 119.26 116.55 2kfd h ALA 39 Ca 0.01 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 2kfd h ALA 39 Cb 0.75 0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.62 2kfd h ALA 39 CO 0.06 -0.47 -0.12 0.66 0.00 0.00 0.00 179.25 179.38 2kfd h SER 40 N -0.52 0.00 0.22 0.00 4.64 -0.45 0.30 113.55 117.74 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 0.40 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.50 2kfd h SER 40 CO 0.04 0.12 -0.11 0.50 -0.87 0.00 0.00 176.83 176.51 2kfd h LYS 41 N 0.00 -0.29 0.00 4.77 3.64 -1.16 -0.98 116.57 122.55 2kfd h LYS 41 Ca -0.00 0.02 -0.05 0.00 -1.27 0.00 0.00 60.65 59.35 2kfd h LYS 41 Cb 0.47 0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.34 2kfd h LYS 41 CO 0.02 -0.02 -0.38 1.49 -2.27 0.00 0.00 179.45 178.28 2kfd h GLU 42 N -0.53 0.00 0.00 1.90 4.81 -1.20 -3.14 114.58 116.42 2kfd h GLU 42 Ca -0.03 0.00 -0.12 0.00 -0.13 0.00 0.00 59.36 59.08 2kfd h GLU 42 Cb 0.40 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.76 2kfd h GLU 42 CO 0.05 0.21 -0.57 1.25 -0.73 0.00 0.00 179.01 179.22 2kfd h LEU 43 N 0.00 0.00 -7.50 1.64 7.12 -0.42 -3.40 115.31 112.75 2kfd h LEU 43 Ca -0.01 0.00 -0.51 0.00 0.13 0.00 0.00 57.88 57.49 2kfd h LEU 43 Cb 1.18 0.00 -0.03 0.00 -0.53 0.00 0.00 40.66 41.28 2kfd h LEU 43 CO 0.03 0.57 1.74 0.61 -0.13 0.00 0.00 178.44 181.26 2kfd n GLY 44 N 0.35 1.95 0.00 3.75 0.00 -0.37 -1.31 105.19 109.56 2kfd n GLY 44 Ca -0.01 -1.05 0.00 0.00 0.00 0.00 0.00 46.02 44.96 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 7.88 0.00 -2.63 1.61 4.07 -1.26 -5.03 120.64 125.29 2kfd n GLU 45 Ca 0.47 0.00 -0.43 0.00 -0.06 0.00 0.00 57.16 57.14 2kfd n GLU 45 Cb 0.45 0.00 -0.02 0.00 -0.06 0.00 0.00 31.44 31.81 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 -0.37 6.79 0.00 4.31 0.01 -0.43 -4.90 113.70 119.11 2kfd s SER 46 Ca 0.00 0.77 0.10 0.00 1.31 0.00 0.00 55.95 58.13 2kfd s SER 46 Cb 0.00 -2.54 0.50 0.00 0.21 0.00 0.00 66.02 64.19 2kfd s SER 46 CO 0.00 -1.05 1.19 0.00 0.41 0.00 0.00 173.24 173.78 2kfd n LEU 47 N 7.31 0.00 0.16 2.44 -0.00 -1.26 -1.49 117.00 124.16 2kfd n LEU 47 Ca 0.12 0.26 0.13 0.00 -0.00 0.00 0.00 56.01 56.52 2kfd n LEU 47 Cb 0.48 -0.26 0.29 0.00 -0.00 0.00 0.00 43.42 43.93 2kfd n LEU 47 CO 0.65 -0.18 0.85 -0.08 -0.00 0.00 0.00 177.39 178.63 2kfd h GLU 48 N 0.00 0.00 0.00 1.47 4.57 -1.93 0.83 114.58 119.52 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 0.08 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.67 2kfd h GLU 48 CO 0.00 0.00 -0.43 0.98 -1.18 0.00 0.00 179.01 178.38 2kfd n TYR 49 N -2.67 0.66 0.90 0.92 9.36 -0.56 -2.33 117.16 123.45 2kfd n TYR 49 Ca 0.05 0.19 0.12 0.00 3.32 0.00 0.00 57.90 61.58 2kfd n TYR 49 Cb 0.48 -0.74 0.20 0.00 -0.63 0.00 0.00 39.34 38.65 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 -2.14 0.07 0.00 2.98 4.81 -0.61 -3.44 118.16 119.83 2kfd n LYS 50 Ca 0.04 0.01 0.14 0.00 -0.87 0.00 0.00 58.31 57.63 2kfd n LYS 50 Cb 0.43 -1.53 0.54 0.00 0.02 0.00 0.00 35.03 34.49 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 -1.58 2.85 -2.16 3.14 0.00 0.19 -3.53 120.51 119.42 2kfd n ALA 51 Ca 0.05 -0.30 0.04 0.00 0.00 0.00 0.00 53.44 53.23 2kfd n ALA 51 Cb 0.36 -1.28 0.07 0.00 0.00 0.00 0.00 19.45 18.59 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 -0.93 1.31 -1.00 0.00 7.94 -1.19 -4.74 117.00 118.38 2kfd n LEU 52 Ca 0.13 -2.34 0.07 0.00 -1.11 0.00 0.00 56.01 52.76 2kfd n LEU 52 Cb 0.30 -0.14 0.22 0.00 0.53 0.00 0.00 43.42 44.33 2kfd n LEU 52 CO 0.25 0.68 0.67 0.61 -1.11 0.00 0.00 177.39 178.48 2kfd n GLY 53 N -0.02 1.52 0.07 -3.96 0.00 -1.22 -3.53 105.19 98.04 2kfd n GLY 53 Ca 0.09 -0.53 -0.09 0.00 0.00 0.00 0.00 46.02 45.49 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 0.75 2.92 -3.23 1.61 5.75 -1.26 -4.52 116.55 118.58 2kfd n ASP 54 Ca 0.16 -0.07 -0.37 0.00 -0.01 0.00 0.00 54.79 54.51 2kfd n ASP 54 Cb 0.51 -0.13 -0.01 0.00 -1.03 0.00 0.00 41.12 40.46 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 -2.85 4.09 -0.22 0.11 -0.58 -1.23 -4.78 120.64 115.18 2kfd n GLU 55 Ca -0.23 -3.39 -0.04 0.00 -0.42 0.00 0.00 57.16 53.08 2kfd n GLU 55 Cb 0.76 -2.46 0.06 0.00 -0.57 0.00 0.00 31.44 29.23 2kfd n GLU 55 CO 0.00 0.00 0.00 0.38 -0.48 0.00 0.00 177.13 177.03 2kfd h ASP 56 N 4.04 0.61 0.71 1.62 2.03 -1.79 0.37 116.42 124.02 2kfd h ASP 56 Ca 0.59 0.00 -0.10 0.00 -0.73 0.00 0.00 57.03 56.80 2kfd h ASP 56 Cb 0.39 -0.13 -0.01 0.00 -0.83 0.00 0.00 39.33 38.75 2kfd h ASP 56 CO 1.28 0.43 -0.46 -0.55 -1.03 0.00 0.00 179.24 178.91 2kfd h ASN 57 N 0.74 0.00 0.14 4.15 -0.00 -1.90 0.50 115.58 119.21 2kfd h ASN 57 Ca 0.25 0.00 -0.01 0.00 -0.00 0.00 0.00 56.30 56.55 2kfd h ASN 57 Cb 0.04 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 38.36 2kfd h ASN 57 CO -0.11 0.46 -0.07 0.40 -0.00 0.00 0.00 177.43 178.11 2kfd h ILE 58 N 0.00 1.02 -0.01 6.14 5.03 -1.73 -2.42 117.51 125.54 2kfd h ILE 58 Ca -0.00 -0.92 0.03 0.00 -0.12 0.00 0.00 64.86 63.85 2kfd h ILE 58 Cb 0.93 1.56 -0.05 0.00 -3.03 0.00 0.00 36.82 36.24 2kfd h ILE 58 CO 0.06 0.21 -0.28 -0.09 -0.68 0.00 0.00 178.15 177.37 2kfd h ARG 59 N -0.65 -0.40 -0.71 2.37 2.43 0.23 0.36 114.38 118.01 2kfd h ARG 59 Ca -0.02 0.03 0.12 0.00 -0.81 0.00 0.00 59.98 59.29 2kfd h ARG 59 Cb 0.49 0.09 -0.08 0.00 -0.42 0.00 0.00 29.97 30.05 2kfd h ARG 59 CO 0.03 -0.27 0.31 0.07 -1.51 0.00 0.00 179.97 178.60 2kfd h ARG 60 N -0.42 0.48 -0.21 0.20 0.11 -1.02 -2.17 114.38 111.35 2kfd h ARG 60 Ca 0.07 -0.03 -0.05 0.00 0.10 0.00 0.00 59.98 60.07 2kfd h ARG 60 Cb 0.51 -0.11 -0.01 0.00 1.11 0.00 0.00 29.97 31.47 2kfd h ARG 60 CO -0.25 0.32 -0.05 0.37 0.10 0.00 0.00 179.97 180.46 2kfd h GLN 61 N 0.49 0.40 -0.56 0.08 5.75 -0.49 -2.56 115.11 118.23 2kfd h GLN 61 Ca 0.37 -0.15 -0.01 0.00 -0.15 0.00 0.00 58.65 58.71 2kfd h GLN 61 Cb 0.49 -0.02 -0.03 0.00 1.07 0.00 0.00 27.48 28.99 2kfd h GLN 61 CO -0.34 0.65 0.32 0.82 -2.65 0.00 0.00 178.83 177.63 2kfd h ILE 62 N 0.13 1.17 -0.35 2.39 2.04 -0.25 -1.23 117.51 121.41 2kfd h ILE 62 Ca 0.05 -0.41 0.08 0.00 1.00 0.00 0.00 64.86 65.58 2kfd h ILE 62 Cb 0.50 0.44 -0.08 0.00 -0.74 0.00 0.00 36.82 36.94 2kfd h ILE 62 CO 0.02 0.18 -0.16 0.15 0.00 0.00 0.00 178.15 178.34 2kfd h PHE 63 N 0.75 -0.38 -0.53 1.37 3.57 -1.25 0.45 116.94 120.91 2kfd h PHE 63 Ca 0.20 0.04 -0.08 0.00 3.53 0.00 0.00 57.97 61.66 2kfd h PHE 63 Cb 0.01 0.22 -0.02 0.00 2.79 0.00 0.00 35.95 38.95 2kfd h PHE 63 CO -0.02 -0.23 0.02 1.49 -2.23 0.00 0.00 178.31 177.34 2kfd h GLU 64 N -0.09 0.89 0.00 1.11 4.22 -1.22 -2.57 114.58 116.92 2kfd h GLU 64 Ca 0.18 -0.25 0.00 0.00 0.08 0.00 0.00 59.36 59.37 2kfd h GLU 64 Cb 0.36 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.51 2kfd h GLU 64 CO -0.42 0.88 0.00 -3.47 -2.18 0.00 0.00 179.01 173.82 2kfd n ASP 65 N -4.21 0.21 0.27 1.04 2.03 -0.35 -4.19 116.55 111.35 2kfd n ASP 65 Ca 0.03 0.53 -0.16 0.00 0.52 0.00 0.00 54.79 55.70 2kfd n ASP 65 Cb 0.31 -0.58 -0.08 0.00 -0.72 0.00 0.00 41.12 40.04 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 0.00 -0.60 -4.61 -0.67 0.04 0.26 -3.49 116.94 107.87 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 0.20 -0.03 0.00 2.20 0.00 0.00 35.95 38.81 2kfd h PHE 66 CO 0.00 -0.37 -1.06 1.63 -0.60 0.00 0.00 178.31 177.91 2kfd n LYS 67 N -5.37 -4.74 0.00 1.51 4.76 -1.26 -5.03 118.16 108.03 2kfd n LYS 67 Ca -0.12 3.50 0.00 0.00 -2.87 0.00 0.00 58.31 58.83 2kfd n LYS 67 Cb 0.27 -4.54 0.00 0.00 -1.84 0.00 0.00 35.03 28.92 2kfd n LYS 67 CO 0.00 0.00 0.00 -2.30 -1.37 0.00 0.00 177.40 173.73 2kfd n PRO 68 N 1.69 0.91 -0.88 1.97 -0.02 -1.26 -5.16 135.00 132.24 2kfd n PRO 68 Ca -0.09 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.39 2kfd n PRO 68 Cb 0.15 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.63 2kfd n PRO 68 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57