#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kmk s PHE 2 N 0.00 2.66 -0.12 0.66 0.40 0.21 -4.95 117.98 116.85 2kmk s PHE 2 Ca 0.00 -1.17 -0.04 0.00 -0.60 0.00 0.00 56.93 55.12 2kmk s PHE 2 Cb 0.00 -1.79 -0.04 0.00 0.51 0.00 0.00 43.02 41.70 2kmk s PHE 2 CO 0.00 -0.51 0.04 0.16 0.70 0.00 0.00 175.22 175.61 2kmk s ASP 3 N 0.64 5.53 0.05 1.36 -4.77 -1.26 0.50 116.67 118.72 2kmk s ASP 3 Ca -0.11 0.18 -0.30 0.00 -3.30 0.00 0.00 52.55 49.02 2kmk s ASP 3 Cb -0.16 -1.71 -0.05 0.00 -1.09 0.00 0.00 42.92 39.90 2kmk s ASP 3 CO 0.02 0.33 1.14 0.00 0.70 0.00 0.00 175.17 177.37 2kmk n LYS 5 N 3.85 2.26 0.00 0.00 5.02 -1.26 -3.92 118.16 124.11 2kmk n LYS 5 Ca 0.08 -2.89 0.00 0.00 -2.02 0.00 0.00 58.31 53.48 2kmk n LYS 5 Cb 0.47 -2.13 0.00 0.00 -0.02 0.00 0.00 35.03 33.35 2kmk n LYS 5 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 2kmk n ILE 6 N -0.99 0.00 -0.08 -0.18 2.08 -1.26 -4.94 119.36 113.99 2kmk n ILE 6 Ca 0.57 0.00 -0.13 0.00 0.56 0.00 0.00 62.75 63.75 2kmk n ILE 6 Cb 1.41 -0.38 -0.10 0.00 -0.75 0.00 0.00 39.64 39.82 2kmk n ILE 6 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2kmk n GLY 8 N 1.59 0.38 3.28 0.00 0.00 -1.25 -5.10 105.19 104.08 2kmk n GLY 8 Ca -0.14 -0.73 -0.15 0.00 0.00 0.00 0.00 46.02 44.99 2kmk n GLY 8 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2kmk s LYS 9 N 0.00 1.16 0.38 1.61 2.20 -1.26 -4.94 119.74 118.89 2kmk s LYS 9 Ca 0.00 -1.53 0.08 0.00 -0.36 0.00 0.00 55.97 54.16 2kmk s LYS 9 Cb 0.00 -0.66 -0.06 0.00 -1.51 0.00 0.00 37.83 35.61 2kmk s LYS 9 CO 0.00 0.03 0.10 -1.54 -0.36 0.00 0.00 175.35 173.58 2kmk s SER 10 N -3.22 4.28 -0.09 1.43 1.04 -1.26 -0.68 113.70 115.20 2kmk s SER 10 Ca 0.20 -1.07 -0.05 0.00 0.48 0.00 0.00 55.95 55.51 2kmk s SER 10 Cb 0.03 -0.50 0.04 0.00 0.10 0.00 0.00 66.02 65.69 2kmk s SER 10 CO 0.03 -0.41 0.21 -0.36 0.98 0.00 0.00 173.24 173.69 2kmk s PHE 11 N -2.58 -0.26 0.05 5.02 0.08 0.18 -4.95 117.98 115.53 2kmk s PHE 11 Ca 0.38 0.65 0.33 0.00 0.12 0.00 0.00 56.93 58.40 2kmk s PHE 11 Cb 0.03 0.01 1.33 0.00 -0.57 0.00 0.00 43.02 43.83 2kmk s PHE 11 CO 0.21 -0.19 1.96 -0.22 -0.10 0.00 0.00 175.22 176.88 2kmk h LYS 12 N 6.95 0.00 -5.58 0.44 1.63 -1.94 0.61 116.57 118.67 2kmk h LYS 12 Ca -0.38 0.00 -0.59 0.00 -0.85 0.00 0.00 60.65 58.83 2kmk h LYS 12 Cb 1.16 0.00 -0.31 0.00 -0.60 0.00 0.00 32.23 32.48 2kmk h LYS 12 CO 0.39 0.00 -0.85 1.03 -3.45 0.00 0.00 179.45 176.57 2kmk s ARG 13 N -3.64 1.82 0.45 1.90 1.81 -1.26 -4.70 118.95 115.33 2kmk s ARG 13 Ca 0.01 -0.68 0.16 0.00 -1.72 0.00 0.00 55.73 53.50 2kmk s ARG 13 Cb 0.09 -1.62 1.09 0.00 -0.45 0.00 0.00 34.95 34.05 2kmk s ARG 13 CO 0.53 0.32 1.98 1.03 -0.68 0.00 0.00 175.30 178.48 2kmk h SER 14 N 6.04 0.31 -0.54 0.23 0.87 -1.97 0.51 113.55 119.00 2kmk h SER 14 Ca -0.34 0.01 -0.06 0.00 -1.23 0.00 0.00 61.79 60.16 2kmk h SER 14 Cb 1.16 -0.06 -0.02 0.00 -0.44 0.00 0.00 62.40 63.05 2kmk h SER 14 CO 0.48 0.18 0.08 0.77 -0.53 0.00 0.00 176.83 177.82 2kmk h SER 15 N 0.34 0.86 -0.14 6.23 4.64 -1.96 0.94 113.55 124.46 2kmk h SER 15 Ca 0.27 -0.26 -0.04 0.00 -0.47 0.00 0.00 61.79 61.29 2kmk h SER 15 Cb 0.61 -0.23 -0.01 0.00 -0.31 0.00 0.00 62.40 62.46 2kmk h SER 15 CO -0.07 0.90 -0.02 0.71 -0.87 0.00 0.00 176.83 177.49 2kmk h THR 16 N 0.78 1.17 -0.08 2.95 1.35 -1.33 0.12 112.91 117.86 2kmk h THR 16 Ca 0.16 -0.67 -0.08 0.00 -0.55 0.00 0.00 66.41 65.27 2kmk h THR 16 Cb 0.41 1.00 0.00 0.00 -1.73 0.00 0.00 68.15 67.83 2kmk h THR 16 CO 0.01 0.23 -0.25 0.25 -0.25 0.00 0.00 175.52 175.51 2kmk h LEU 17 N 0.38 0.36 -0.17 3.87 5.85 -0.47 -1.48 115.31 123.64 2kmk h LEU 17 Ca 0.08 -0.60 0.04 0.00 0.84 0.00 0.00 57.88 58.24 2kmk h LEU 17 Cb 0.28 -0.10 -0.07 0.00 0.37 0.00 0.00 40.66 41.14 2kmk h LEU 17 CO 0.01 0.90 -0.50 -1.28 -0.34 0.00 0.00 178.44 177.23 2kmk h SER 18 N -0.16 -1.59 -0.84 1.25 0.87 0.20 1.31 113.55 114.58 2kmk h SER 18 Ca -0.01 0.20 0.13 0.00 -1.23 0.00 0.00 61.79 60.89 2kmk h SER 18 Cb 0.86 0.63 -0.06 0.00 -0.44 0.00 0.00 62.40 63.40 2kmk h SER 18 CO 0.05 -0.46 0.55 0.74 -0.53 0.00 0.00 176.83 177.18 2kmk h THR 19 N -0.53 0.85 -0.14 2.23 2.02 -0.82 0.66 112.91 117.18 2kmk h THR 19 Ca 0.06 -0.22 -0.04 0.00 0.77 0.00 0.00 66.41 66.97 2kmk h THR 19 Cb 0.66 0.15 -0.00 0.00 -1.74 0.00 0.00 68.15 67.21 2kmk h THR 19 CO -0.45 0.12 -0.06 -0.74 0.37 0.00 0.00 175.52 174.76 2kmk h HIS 20 N 0.65 0.34 -0.44 3.16 6.17 0.63 -0.32 115.15 125.33 2kmk h HIS 20 Ca 0.41 -0.08 0.01 0.00 0.71 0.00 0.00 60.37 61.42 2kmk h HIS 20 Cb 0.68 -0.08 -0.02 0.00 2.52 0.00 0.00 27.41 30.51 2kmk h HIS 20 CO -0.00 0.62 0.29 -0.07 0.71 0.00 0.00 177.93 179.48 2kmk h LEU 21 N -0.04 0.50 -1.66 0.26 3.38 0.35 0.71 115.31 118.82 2kmk h LEU 21 Ca 0.03 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.96 2kmk h LEU 21 Cb 0.52 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 2kmk h LEU 21 CO 0.02 0.36 -0.06 -0.07 0.09 0.00 0.00 178.44 178.79 2kmk h LEU 22 N 0.60 0.13 -1.27 1.67 3.38 0.86 0.18 115.31 120.86 2kmk h LEU 22 Ca 0.16 -0.02 -0.04 0.00 0.09 0.00 0.00 57.88 58.08 2kmk h LEU 22 Cb -0.07 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 2kmk h LEU 22 CO -0.04 0.22 0.09 0.40 0.09 0.00 0.00 178.44 179.20 2kmk h ILE 23 N 0.14 1.18 0.00 1.22 2.04 0.22 1.44 117.51 123.76 2kmk h ILE 23 Ca 0.03 -0.66 0.00 0.00 1.00 0.00 0.00 64.86 65.24 2kmk h ILE 23 Cb 0.20 0.78 0.00 0.00 -0.74 0.00 0.00 36.82 37.06 2kmk h ILE 23 CO 0.01 0.24 -0.40 1.41 0.00 0.00 0.00 178.15 179.41 2kmk n HIS 24 N -4.32 0.62 0.55 1.37 8.25 0.19 -3.59 115.22 118.30 2kmk n HIS 24 Ca 0.02 0.18 0.07 0.00 -0.26 0.00 0.00 57.72 57.73 2kmk n HIS 24 Cb 0.20 -0.72 0.06 0.00 1.12 0.00 0.00 29.99 30.65 2kmk n HIS 24 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 2kmk n SER 25 N -2.10 2.16 -3.32 0.41 3.41 0.38 -4.98 113.62 109.59 2kmk n SER 25 Ca 0.04 -1.58 -0.13 0.00 -0.26 0.00 0.00 58.87 56.94 2kmk n SER 25 Cb 0.43 -0.01 -0.03 0.00 -0.26 0.00 0.00 64.21 64.34 2kmk n SER 25 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2kmk n ASP 26 N 0.77 0.08 -0.06 4.04 8.00 0.48 -4.74 116.55 125.12 2kmk n ASP 26 Ca 0.08 -0.51 -0.12 0.00 0.71 0.00 0.00 54.79 54.96 2kmk n ASP 26 Cb 0.34 -0.63 -0.06 0.00 -0.02 0.00 0.00 41.12 40.76 2kmk n ASP 26 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2kmk h THR 27 N 0.04 1.26 -6.75 -3.53 1.03 -1.92 -3.47 112.91 99.57 2kmk h THR 27 Ca -0.26 -0.89 -0.47 0.00 -0.01 0.00 0.00 66.41 64.77 2kmk h THR 27 Cb 0.55 1.51 -0.01 0.00 -1.07 0.00 0.00 68.15 69.13 2kmk h THR 27 CO 0.27 0.27 -0.93 0.54 -0.01 0.00 0.00 175.52 175.65 2kmk n ARG 28 N -4.71 -0.90 -0.26 0.00 3.00 -1.26 -4.79 116.66 107.74 2kmk n ARG 28 Ca -0.05 0.36 -0.04 0.00 -0.01 0.00 0.00 57.85 58.11 2kmk n ARG 28 Cb 0.23 -1.94 0.03 0.00 0.00 0.00 0.00 32.46 30.78 2kmk n ARG 28 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.63 177.28 2kmk n PRO 29 N -3.29 1.20 -3.39 5.56 -0.04 -1.14 -4.39 135.00 129.51 2kmk n PRO 29 Ca -0.21 -0.47 -0.26 0.00 -0.04 0.00 0.00 63.50 62.52 2kmk n PRO 29 Cb 0.56 -1.18 -0.09 0.00 -0.04 0.00 0.00 33.50 32.74 2kmk n PRO 29 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2kmk n TYR 30 N 0.39 0.07 -1.03 0.54 4.02 -0.28 -4.98 117.16 115.89 2kmk n TYR 30 Ca 0.09 -3.56 -0.31 0.00 -0.01 0.00 0.00 57.90 54.11 2kmk n TYR 30 Cb 0.66 -0.09 0.12 0.00 -0.02 0.00 0.00 39.34 40.01 2kmk n TYR 30 CO 0.00 0.00 0.00 -2.14 -1.01 0.00 0.00 176.86 173.71 2kmk s PRO 31 N -0.69 1.68 0.10 -0.72 0.02 -1.26 -0.32 135.00 133.81 2kmk s PRO 31 Ca 0.33 1.29 -0.26 0.00 0.02 0.00 0.00 61.00 62.39 2kmk s PRO 31 Cb 0.08 -1.82 -0.06 0.00 0.02 0.00 0.00 34.50 32.71 2kmk s PRO 31 CO -0.16 -2.09 0.80 0.00 -0.33 0.00 0.00 177.00 175.23 2kmk h GLN 33 N 5.16 0.00 0.00 0.00 5.75 -1.91 -3.31 115.11 120.81 2kmk h GLN 33 Ca -0.45 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.05 2kmk h GLN 33 Cb 1.21 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.76 2kmk h GLN 33 CO 0.69 0.00 0.00 0.66 -2.65 0.00 0.00 178.83 177.53 2kmk n TYR 34 N -2.61 0.00 0.29 3.99 4.02 -1.26 -4.85 117.16 116.74 2kmk n TYR 34 Ca 0.05 0.00 0.12 0.00 -0.01 0.00 0.00 57.90 58.06 2kmk n TYR 34 Cb 0.46 0.00 0.17 0.00 -0.02 0.00 0.00 39.34 39.94 2kmk n TYR 34 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2kmk n GLY 36 N 1.17 2.13 1.07 0.00 0.00 -1.25 -5.02 105.19 103.29 2kmk n GLY 36 Ca 0.03 -0.54 -0.13 0.00 0.00 0.00 0.00 46.02 45.39 2kmk n GLY 36 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2kmk n LYS 37 N 0.00 0.00 -5.05 1.61 5.02 -1.26 -3.11 118.16 115.37 2kmk n LYS 37 Ca 0.00 0.00 -0.32 0.00 -2.02 0.00 0.00 58.31 55.97 2kmk n LYS 37 Cb 0.00 -0.33 -0.15 0.00 -0.02 0.00 0.00 35.03 34.53 2kmk n LYS 37 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2kmk s ARG 38 N -0.33 2.63 0.44 1.97 1.81 -1.26 0.12 118.95 124.32 2kmk s ARG 38 Ca 0.19 -0.80 0.03 0.00 -1.72 0.00 0.00 55.73 53.43 2kmk s ARG 38 Cb -0.17 -2.31 -0.03 0.00 -0.45 0.00 0.00 34.95 31.99 2kmk s ARG 38 CO 0.21 0.46 0.06 -0.06 -0.68 0.00 0.00 175.30 175.30 2kmk s PHE 39 N -0.33 1.90 -0.03 -0.53 0.08 0.56 -4.94 117.98 114.68 2kmk s PHE 39 Ca 0.02 -1.07 0.07 0.00 0.12 0.00 0.00 56.93 56.07 2kmk s PHE 39 Cb -0.13 -1.41 -0.11 0.00 -0.57 0.00 0.00 43.02 40.81 2kmk s PHE 39 CO 0.02 0.01 0.17 1.58 -0.10 0.00 0.00 175.22 176.90 2kmk n HIS 40 N -1.04 0.00 -4.93 0.36 -0.00 -1.26 -1.12 115.22 107.23 2kmk n HIS 40 Ca -0.11 0.00 -0.31 0.00 -0.00 0.00 0.00 57.72 57.30 2kmk n HIS 40 Cb 0.66 -0.16 -0.17 0.00 -0.00 0.00 0.00 29.99 30.33 2kmk n HIS 40 CO 0.00 0.00 0.00 -0.65 -0.00 0.00 0.00 176.34 175.69 2kmk s GLN 41 N -2.45 2.75 0.00 1.57 -0.21 -1.26 -4.70 119.66 115.36 2kmk s GLN 41 Ca -0.02 -0.77 0.00 0.00 0.02 0.00 0.00 55.36 54.59 2kmk s GLN 41 Cb 0.05 -2.15 0.00 0.00 1.00 0.00 0.00 33.01 31.91 2kmk s GLN 41 CO 0.30 0.09 0.95 1.17 -2.12 0.00 0.00 175.29 175.68 2kmk n LYS 42 N 3.76 0.00 -0.48 2.91 3.00 -1.26 0.73 118.16 126.81 2kmk n LYS 42 Ca -0.20 0.90 0.43 0.00 -0.00 0.00 0.00 58.31 59.44 2kmk n LYS 42 Cb 0.52 -1.45 0.75 0.00 0.00 0.00 0.00 35.03 34.86 2kmk n LYS 42 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 2kmk h SER 43 N 0.00 0.00 -0.08 3.14 4.64 -1.97 0.98 113.55 120.26 2kmk h SER 43 Ca 0.00 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.28 2kmk h SER 43 Cb 0.00 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2kmk h SER 43 CO 0.00 0.00 -0.11 0.44 -0.87 0.00 0.00 176.83 176.29 2kmk h ASP 44 N 0.00 0.24 -0.15 4.97 5.19 -0.10 -0.33 116.42 126.23 2kmk h ASP 44 Ca 0.73 -0.52 -0.01 0.00 -0.62 0.00 0.00 57.03 56.60 2kmk h ASP 44 Cb 3.04 -0.07 -0.01 0.00 0.18 0.00 0.00 39.33 42.48 2kmk h ASP 44 CO -0.01 0.72 0.05 -0.03 -3.12 0.00 0.00 179.24 176.85 2kmk h MET 45 N -0.23 0.23 -0.96 3.56 1.85 0.21 -0.51 114.93 119.09 2kmk h MET 45 Ca 0.01 -0.05 0.22 0.00 -0.61 0.00 0.00 59.70 59.27 2kmk h MET 45 Cb 0.66 -0.03 -0.08 0.00 0.43 0.00 0.00 31.60 32.58 2kmk h MET 45 CO 0.03 0.36 0.62 0.87 -0.40 0.00 0.00 176.91 178.39 2kmk h LYS 46 N 0.07 0.44 -0.21 0.39 1.57 -0.55 2.12 116.57 120.39 2kmk h LYS 46 Ca 0.05 -0.03 -0.11 0.00 -1.87 0.00 0.00 60.65 58.69 2kmk h LYS 46 Cb 0.22 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.42 2kmk h LYS 46 CO -0.00 0.29 -0.34 0.87 -0.57 0.00 0.00 179.45 179.70 2kmk h LYS 47 N 0.46 0.45 0.25 3.15 1.57 -0.14 0.26 116.57 122.57 2kmk h LYS 47 Ca 0.52 -0.20 -0.01 0.00 -1.87 0.00 0.00 60.65 59.09 2kmk h LYS 47 Cb 1.23 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.53 2kmk h LYS 47 CO -0.23 0.74 -0.12 1.25 -0.57 0.00 0.00 179.45 180.51 2kmk h HIS 48 N 0.39 -0.32 -1.47 -1.35 2.76 0.45 -1.94 115.15 113.67 2kmk h HIS 48 Ca 0.04 -0.01 0.45 0.00 -2.20 0.00 0.00 60.37 58.66 2kmk h HIS 48 Cb 0.79 0.10 -0.10 0.00 1.55 0.00 0.00 27.41 29.75 2kmk h HIS 48 CO 0.02 -0.20 1.00 1.79 -1.30 0.00 0.00 177.93 179.25 2kmk h THR 49 N -0.64 0.15 0.00 6.26 1.35 0.10 5.14 112.91 125.26 2kmk h THR 49 Ca -0.03 -0.02 -0.08 0.00 -0.55 0.00 0.00 66.41 65.72 2kmk h THR 49 Cb 0.26 0.07 -0.01 0.00 -1.73 0.00 0.00 68.15 66.74 2kmk h THR 49 CO 0.06 0.01 -0.38 -0.26 -0.25 0.00 0.00 175.52 174.70 2kmk h PHE 50 N 0.07 0.00 0.00 4.73 -1.00 -0.25 -0.85 116.94 119.63 2kmk h PHE 50 Ca 0.81 0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.59 2kmk h PHE 50 Cb 2.81 0.00 0.00 0.00 3.61 0.00 0.00 35.95 42.37 2kmk h PHE 50 CO -0.00 0.38 0.00 -0.84 -1.61 0.00 0.00 178.31 176.24 2kmk h ILE 51 N 0.00 0.00 0.02 -0.55 3.07 1.11 0.38 117.51 121.54 2kmk h ILE 51 Ca -0.00 -0.61 -0.30 0.00 1.55 0.00 0.00 64.86 65.50 2kmk h ILE 51 Cb 0.77 1.58 -0.04 0.00 -0.27 0.00 0.00 36.82 38.86 2kmk h ILE 51 CO 0.05 0.00 -1.73 0.45 -1.05 0.00 0.00 178.15 175.87 2kmk h HIS 52 N 0.00 0.08 0.00 0.16 3.86 -0.79 -3.33 115.15 115.12 2kmk h HIS 52 Ca 0.00 -0.06 -0.02 0.00 -1.16 0.00 0.00 60.37 59.14 2kmk h HIS 52 Cb 0.64 -0.00 -0.00 0.00 1.06 0.00 0.00 27.41 29.10 2kmk h HIS 52 CO 0.00 1.12 -0.53 1.79 0.86 0.00 0.00 177.93 181.17 2kmk h THR 53 N 0.01 0.10 -3.46 2.45 1.35 -1.04 -3.48 112.91 108.84 2kmk h THR 53 Ca -0.30 -1.15 -0.14 0.00 -0.55 0.00 0.00 66.41 64.27 2kmk h THR 53 Cb 2.01 1.83 0.07 0.00 -1.73 0.00 0.00 68.15 70.33 2kmk h THR 53 CO 0.08 0.05 -0.32 0.61 -0.25 0.00 0.00 175.52 175.70 2kmk n GLY 54 N 1.16 0.13 3.44 5.82 0.00 0.12 -5.00 105.19 110.86 2kmk n GLY 54 Ca 0.01 -0.24 -0.42 0.00 0.00 0.00 0.00 46.02 45.37 2kmk n GLY 54 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2kmk s GLU 55 N -4.66 2.97 -0.69 1.61 2.02 -0.50 -4.99 118.70 114.46 2kmk s GLU 55 Ca 0.02 -1.01 0.05 0.00 0.02 0.00 0.00 54.97 54.05 2kmk s GLU 55 Cb -0.01 -3.89 0.25 0.00 0.10 0.00 0.00 34.13 30.58 2kmk s GLU 55 CO 0.30 -0.71 0.81 1.63 0.02 0.00 0.00 175.26 177.31 2kmk n LYS 56 N 5.10 2.70 0.00 1.61 5.02 -1.26 -4.52 118.16 126.81 2kmk n LYS 56 Ca -0.11 -4.65 0.01 0.00 -2.02 0.00 0.00 58.31 51.53 2kmk n LYS 56 Cb 0.47 -2.29 0.03 0.00 -0.02 0.00 0.00 35.03 33.22 2kmk n LYS 56 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 2kmk n PRO 57 N 0.97 0.01 -3.38 1.97 -0.04 -1.25 -4.22 135.00 129.06 2kmk n PRO 57 Ca 0.29 0.39 -0.45 0.00 -0.04 0.00 0.00 63.50 63.69 2kmk n PRO 57 Cb 0.40 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.32 2kmk n PRO 57 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 2kmk s HIS 58 N -2.82 3.59 -0.17 0.54 3.76 -0.62 -4.97 115.29 114.60 2kmk s HIS 58 Ca 0.01 -1.91 -0.15 0.00 -0.15 0.00 0.00 55.06 52.85 2kmk s HIS 58 Cb 0.01 -3.73 -0.04 0.00 1.11 0.00 0.00 32.58 29.93 2kmk s HIS 58 CO 0.02 -0.98 0.36 0.15 -0.85 0.00 0.00 174.74 173.44 2kmk s LYS 59 N 0.54 4.24 -0.12 1.40 1.02 -1.26 0.45 119.74 126.01 2kmk s LYS 59 Ca 0.14 0.19 -0.30 0.00 0.02 0.00 0.00 55.97 56.02 2kmk s LYS 59 Cb -0.17 -3.47 -0.01 0.00 -0.52 0.00 0.00 37.83 33.66 2kmk s LYS 59 CO -0.05 0.11 1.04 0.00 -0.92 0.00 0.00 175.35 175.53 2kmk n GLN 61 N 5.22 1.57 -0.10 0.00 1.13 -1.26 -2.68 117.38 121.26 2kmk n GLN 61 Ca 0.09 -0.78 -0.12 0.00 -1.94 0.00 0.00 57.00 54.25 2kmk n GLN 61 Cb 0.48 -1.23 -0.04 0.00 0.11 0.00 0.00 30.24 29.55 2kmk n GLN 61 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 2kmk n VAL 62 N 0.13 1.50 -0.04 5.09 0.31 -1.26 -4.78 118.33 119.28 2kmk n VAL 62 Ca 0.07 0.06 -0.00 0.00 -0.01 0.00 0.00 64.34 64.45 2kmk n VAL 62 Cb 0.22 -2.27 -0.11 0.00 -0.91 0.00 0.00 33.84 30.78 2kmk n VAL 62 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2kmk n GLY 64 N 1.97 1.25 3.96 0.00 0.00 -1.09 -5.11 105.19 106.19 2kmk n GLY 64 Ca -0.13 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.65 2kmk n GLY 64 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2kmk s LYS 65 N -0.49 1.80 0.03 1.61 2.20 -1.26 -4.80 119.74 118.84 2kmk s LYS 65 Ca 0.00 -0.74 0.01 0.00 -0.36 0.00 0.00 55.97 54.88 2kmk s LYS 65 Cb 0.00 -2.25 -0.02 0.00 -1.51 0.00 0.00 37.83 34.05 2kmk s LYS 65 CO 0.00 -1.41 -0.06 0.00 -0.36 0.00 0.00 175.35 173.52 2kmk s ALA 66 N -3.21 0.40 0.05 3.13 0.00 -1.26 -0.40 121.76 120.46 2kmk s ALA 66 Ca 0.64 -0.72 0.04 0.00 0.00 0.00 0.00 51.96 51.93 2kmk s ALA 66 Cb -0.07 0.09 -0.02 0.00 0.00 0.00 0.00 23.12 23.12 2kmk s ALA 66 CO 0.45 -0.09 -0.12 -0.06 0.00 0.00 0.00 175.76 175.94 2kmk s PHE 67 N -1.50 1.04 -0.39 0.00 0.08 0.17 -4.97 117.98 112.40 2kmk s PHE 67 Ca -0.12 -0.40 0.23 0.00 0.12 0.00 0.00 56.93 56.76 2kmk s PHE 67 Cb -0.09 -0.61 0.25 0.00 -0.57 0.00 0.00 43.02 42.00 2kmk s PHE 67 CO -0.00 0.01 1.42 0.77 -0.10 0.00 0.00 175.22 177.32 2kmk h SER 68 N 4.70 0.00 -4.22 1.36 0.02 -1.86 -1.64 113.55 111.92 2kmk h SER 68 Ca -0.38 -0.01 -0.63 0.00 -0.84 0.00 0.00 61.79 59.94 2kmk h SER 68 Cb 1.19 0.00 -0.25 0.00 0.14 0.00 0.00 62.40 63.48 2kmk h SER 68 CO 0.42 0.00 -0.86 -1.10 -1.14 0.00 0.00 176.83 174.16 2kmk s GLN 69 N -3.25 1.49 0.18 3.45 -0.21 -1.26 -4.85 119.66 115.20 2kmk s GLN 69 Ca 0.05 -1.08 -0.10 0.00 0.02 0.00 0.00 55.36 54.24 2kmk s GLN 69 Cb 0.07 -1.70 0.07 0.00 1.00 0.00 0.00 33.01 32.45 2kmk s GLN 69 CO 0.71 0.43 1.66 0.77 -2.12 0.00 0.00 175.29 176.73 2kmk h SER 70 N 4.60 0.99 -0.71 5.90 0.02 -1.98 -1.73 113.55 120.64 2kmk h SER 70 Ca -0.45 -0.27 0.15 0.00 -0.84 0.00 0.00 61.79 60.37 2kmk h SER 70 Cb 1.16 -0.26 -0.10 0.00 0.14 0.00 0.00 62.40 63.33 2kmk h SER 70 CO 0.42 1.01 0.19 -1.28 -1.14 0.00 0.00 176.83 176.04 2kmk h SER 71 N 0.93 0.06 0.58 3.07 0.87 -1.98 1.25 113.55 118.33 2kmk h SER 71 Ca 0.18 0.13 -0.15 0.00 -1.23 0.00 0.00 61.79 60.73 2kmk h SER 71 Cb 0.46 0.17 -0.02 0.00 -0.44 0.00 0.00 62.40 62.57 2kmk h SER 71 CO 0.02 0.00 -0.67 0.78 -0.53 0.00 0.00 176.83 176.43 2kmk h ASN 72 N 0.30 0.10 -0.08 6.23 4.21 -1.88 -0.98 115.58 123.48 2kmk h ASN 72 Ca 0.39 -0.06 -0.24 0.00 1.21 0.00 0.00 56.30 57.60 2kmk h ASN 72 Cb 0.64 -0.03 0.01 0.00 -1.12 0.00 0.00 38.32 37.83 2kmk h ASN 72 CO -0.47 0.74 -0.88 0.25 -1.29 0.00 0.00 177.43 175.78 2kmk h LEU 73 N 0.06 0.92 0.03 1.61 5.85 0.22 0.17 115.31 124.18 2kmk h LEU 73 Ca -0.01 -0.65 -0.00 0.00 0.84 0.00 0.00 57.88 58.05 2kmk h LEU 73 Cb 1.19 -0.28 0.00 0.00 0.37 0.00 0.00 40.66 41.95 2kmk h LEU 73 CO 0.09 1.46 -0.02 0.40 -0.34 0.00 0.00 178.44 180.03 2kmk h ILE 74 N 0.48 1.10 -0.12 4.05 2.04 0.15 0.49 117.51 125.69 2kmk h ILE 74 Ca -0.08 -0.41 0.02 0.00 1.00 0.00 0.00 64.86 65.39 2kmk h ILE 74 Cb 1.52 1.38 -0.02 0.00 -0.74 0.00 0.00 36.82 38.95 2kmk h ILE 74 CO 0.18 0.11 -0.01 0.74 0.00 0.00 0.00 178.15 179.16 2kmk h THR 75 N -0.22 0.90 -0.19 -0.27 2.02 -1.19 0.64 112.91 114.59 2kmk h THR 75 Ca -0.00 -0.01 0.02 0.00 0.77 0.00 0.00 66.41 67.18 2kmk h THR 75 Cb 0.21 0.88 -0.02 0.00 -1.74 0.00 0.00 68.15 67.47 2kmk h THR 75 CO 0.01 0.00 0.07 -0.74 0.37 0.00 0.00 175.52 175.23 2kmk h HIS 76 N 0.02 0.13 -0.16 3.16 -0.00 -0.42 -1.17 115.15 116.72 2kmk h HIS 76 Ca 0.06 0.01 -0.13 0.00 -0.00 0.00 0.00 60.37 60.30 2kmk h HIS 76 Cb 0.07 -0.03 -0.01 0.00 -0.00 0.00 0.00 27.41 27.44 2kmk h HIS 76 CO -0.15 0.07 -0.47 1.03 -0.00 0.00 0.00 177.93 178.41 2kmk h SER 77 N 0.17 0.43 -0.54 3.26 0.87 0.22 -1.82 113.55 116.15 2kmk h SER 77 Ca 0.08 -0.21 0.11 0.00 -1.23 0.00 0.00 61.79 60.55 2kmk h SER 77 Cb 0.04 -0.12 -0.03 0.00 -0.44 0.00 0.00 62.40 61.85 2kmk h SER 77 CO -0.08 0.84 0.37 0.03 -0.53 0.00 0.00 176.83 177.46 2kmk h ARG 78 N 0.32 0.22 -0.09 2.24 2.47 0.93 0.30 114.38 120.79 2kmk h ARG 78 Ca 0.02 -0.01 -0.03 0.00 -1.26 0.00 0.00 59.98 58.69 2kmk h ARG 78 Cb 0.95 -0.05 -0.00 0.00 -1.65 0.00 0.00 29.97 29.22 2kmk h ARG 78 CO 0.08 0.15 -0.07 0.87 0.56 0.00 0.00 179.97 181.56 2kmk h LYS 79 N 0.23 0.20 0.55 0.04 1.57 -0.37 0.34 116.57 119.13 2kmk h LYS 79 Ca 0.25 -0.10 -0.02 0.00 -1.87 0.00 0.00 60.65 58.92 2kmk h LYS 79 Cb 0.69 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.99 2kmk h LYS 79 CO -0.05 0.61 -0.41 0.45 -0.57 0.00 0.00 179.45 179.48 2kmk h HIS 80 N -0.20 -1.11 -0.44 -1.35 3.86 -0.39 -2.27 115.15 113.25 2kmk h HIS 80 Ca 0.02 -0.00 0.09 0.00 -1.16 0.00 0.00 60.37 59.31 2kmk h HIS 80 Cb 0.56 0.41 -0.09 0.00 1.06 0.00 0.00 27.41 29.35 2kmk h HIS 80 CO 0.08 -0.60 -0.23 1.15 0.86 0.00 0.00 177.93 179.20 2kmk h THR 81 N -0.94 0.35 0.00 2.45 2.02 -0.55 -3.52 112.91 112.73 2kmk h THR 81 Ca -0.06 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.12 2kmk h THR 81 Cb 0.79 0.35 0.00 0.00 -1.74 0.00 0.00 68.15 67.55 2kmk h THR 81 CO 0.01 0.00 0.00 0.61 0.37 0.00 0.00 175.52 176.51