#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 3.23 -0.09 7.33 0.08 0.69 -4.93 117.98 124.29 2kmk s PHE 2 Ca 0.00 0.02 -0.02 0.00 0.12 0.00 0.00 56.93 57.05 2kmk s PHE 2 Cb 0.00 -2.22 -0.03 0.00 -0.57 0.00 0.00 43.02 40.20 2kmk s PHE 2 CO 0.00 -0.03 0.01 0.34 -0.10 0.00 0.00 175.22 175.44 2kmk s ASP 3 N 1.05 5.27 0.08 1.36 -1.08 -1.26 0.42 116.67 122.51 2kmk s ASP 3 Ca 0.06 0.15 -0.31 0.00 -0.52 0.00 0.00 52.55 51.93 2kmk s ASP 3 Cb -0.14 -1.51 -0.06 0.00 -1.46 0.00 0.00 42.92 39.75 2kmk s ASP 3 CO 0.04 0.37 1.26 0.00 0.52 0.00 0.00 175.17 177.36 2kmk n LYS 5 N 3.86 3.05 0.06 0.00 5.02 -1.26 -4.16 118.16 124.73 2kmk n LYS 5 Ca 0.09 -2.03 0.00 0.00 -2.02 0.00 0.00 58.31 54.36 2kmk n LYS 5 Cb 0.45 -1.94 0.00 0.00 -0.02 0.00 0.00 35.03 33.52 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 0.13 0.83 -0.10 -0.18 2.08 -1.26 -4.97 119.36 115.89 2kmk n ILE 6 Ca 0.24 0.28 -0.14 0.00 0.56 0.00 0.00 62.75 63.69 2kmk n ILE 6 Cb 0.99 -1.37 -0.10 0.00 -0.75 0.00 0.00 39.64 38.40 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 2.42 0.17 3.90 0.00 0.00 -1.26 -5.14 105.19 105.27 2kmk n GLY 8 Ca -0.36 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.46 2kmk n GLY 8 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2kmk s LYS 9 N 0.00 2.91 0.28 1.61 1.02 -1.26 -4.88 119.74 119.41 2kmk s LYS 9 Ca 0.00 -1.15 0.11 0.00 0.02 0.00 0.00 55.97 54.95 2kmk s LYS 9 Cb 0.00 -2.61 -0.05 0.00 -0.52 0.00 0.00 37.83 34.65 2kmk s LYS 9 CO 0.00 0.15 -0.12 0.45 -0.92 0.00 0.00 175.35 174.90 2kmk s SER 10 N -4.02 3.95 -0.02 2.83 0.15 -1.26 0.00 113.70 115.32 2kmk s SER 10 Ca 0.41 -0.89 -0.00 0.00 0.70 0.00 0.00 55.95 56.16 2kmk s SER 10 Cb -0.07 -0.51 0.03 0.00 -1.71 0.00 0.00 66.02 63.76 2kmk s SER 10 CO 0.28 0.02 0.04 -0.36 1.20 0.00 0.00 173.24 174.42 2kmk s PHE 11 N -2.44 0.03 0.08 3.44 0.40 0.17 -4.96 117.98 114.70 2kmk s PHE 11 Ca 0.31 0.16 0.24 0.00 -0.60 0.00 0.00 56.93 57.04 2kmk s PHE 11 Cb -0.05 -0.29 0.84 0.00 0.51 0.00 0.00 43.02 44.03 2kmk s PHE 11 CO 0.17 -0.11 1.79 0.87 0.70 0.00 0.00 175.22 178.64 2kmk h LYS 12 N 7.54 0.00 -4.96 0.44 1.57 -1.95 0.20 116.57 119.40 2kmk h LYS 12 Ca -0.39 0.00 -0.67 0.00 -1.87 0.00 0.00 60.65 57.72 2kmk h LYS 12 Cb 1.12 0.00 -0.35 0.00 0.08 0.00 0.00 32.23 33.08 2kmk h LYS 12 CO 0.41 0.23 -0.82 1.03 -0.57 0.00 0.00 179.45 179.73 2kmk s ARG 13 N -3.57 2.69 0.45 3.15 3.00 -1.26 -4.70 118.95 118.71 2kmk s ARG 13 Ca 0.01 -1.05 0.23 0.00 0.00 0.00 0.00 55.73 54.93 2kmk s ARG 13 Cb 0.10 -2.76 1.24 0.00 0.00 0.00 0.00 34.95 33.52 2kmk s ARG 13 CO 0.64 -0.37 1.83 1.03 0.00 0.00 0.00 175.30 178.43 2kmk h SER 14 N 7.89 0.28 -1.01 0.23 0.87 -1.95 0.23 113.55 120.09 2kmk h SER 14 Ca -0.34 0.04 0.09 0.00 -1.23 0.00 0.00 61.79 60.35 2kmk h SER 14 Cb 1.10 -0.01 -0.07 0.00 -0.44 0.00 0.00 62.40 62.98 2kmk h SER 14 CO 0.56 0.08 0.64 0.77 -0.53 0.00 0.00 176.83 178.36 2kmk h SER 15 N 0.26 1.00 0.46 6.23 4.64 -1.96 1.56 113.55 125.74 2kmk h SER 15 Ca 0.51 0.02 -0.15 0.00 -0.47 0.00 0.00 61.79 61.70 2kmk h SER 15 Cb 1.53 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 63.42 2kmk h SER 15 CO -0.16 0.60 -0.64 0.74 -0.87 0.00 0.00 176.83 176.50 2kmk h THR 16 N 1.11 1.42 -0.10 2.95 2.02 -0.98 -2.38 112.91 116.94 2kmk h THR 16 Ca 0.46 -2.11 -0.11 0.00 0.77 0.00 0.00 66.41 65.42 2kmk h THR 16 Cb 0.29 2.10 0.00 0.00 -1.74 0.00 0.00 68.15 68.81 2kmk h THR 16 CO -0.21 0.62 -0.35 0.25 0.37 0.00 0.00 175.52 176.19 2kmk h LEU 17 N 0.12 0.49 -0.69 2.58 5.85 -0.16 -1.52 115.31 121.97 2kmk h LEU 17 Ca -0.01 -0.62 0.12 0.00 0.84 0.00 0.00 57.88 58.21 2kmk h LEU 17 Cb 1.16 -0.14 -0.13 0.00 0.37 0.00 0.00 40.66 41.92 2kmk h LEU 17 CO 0.10 1.02 -0.34 0.28 -0.34 0.00 0.00 178.44 179.15 2kmk h SER 18 N -0.02 -1.21 -0.88 1.25 0.02 0.23 1.67 113.55 114.61 2kmk h SER 18 Ca -0.02 0.25 0.02 0.00 -0.84 0.00 0.00 61.79 61.20 2kmk h SER 18 Cb 0.98 0.62 -0.05 0.00 0.14 0.00 0.00 62.40 64.10 2kmk h SER 18 CO 0.07 -0.30 0.58 0.74 -1.14 0.00 0.00 176.83 176.78 2kmk h THR 19 N -0.12 1.20 -0.46 -2.27 2.02 -1.36 0.47 112.91 112.39 2kmk h THR 19 Ca 0.26 -0.40 -0.04 0.00 0.77 0.00 0.00 66.41 67.00 2kmk h THR 19 Cb 0.56 -0.07 -0.02 0.00 -1.74 0.00 0.00 68.15 66.88 2kmk h THR 19 CO -0.76 0.21 0.12 -0.74 0.37 0.00 0.00 175.52 174.72 2kmk h HIS 20 N 1.17 0.70 -0.15 3.16 6.17 0.18 0.13 115.15 126.50 2kmk h HIS 20 Ca 0.33 -0.05 -0.14 0.00 0.71 0.00 0.00 60.37 61.21 2kmk h HIS 20 Cb -0.10 -0.21 -0.01 0.00 2.52 0.00 0.00 27.41 29.61 2kmk h HIS 20 CO -0.01 0.60 -0.51 -0.07 0.71 0.00 0.00 177.93 178.64 2kmk h LEU 21 N 0.67 0.47 -2.08 0.26 3.38 0.38 -0.39 115.31 118.00 2kmk h LEU 21 Ca 0.15 -0.24 -0.01 0.00 0.09 0.00 0.00 57.88 57.88 2kmk h LEU 21 Cb 0.24 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.86 2kmk h LEU 21 CO -0.00 0.90 -0.04 -0.07 0.09 0.00 0.00 178.44 179.32 2kmk h LEU 22 N 0.34 0.00 -0.06 1.67 3.38 0.20 -0.06 115.31 120.78 2kmk h LEU 22 Ca 0.01 0.00 -0.22 0.00 0.09 0.00 0.00 57.88 57.76 2kmk h LEU 22 Cb 1.02 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.78 2kmk h LEU 22 CO 0.09 0.04 -0.84 0.40 0.09 0.00 0.00 178.44 178.22 2kmk h ILE 23 N 0.00 1.31 0.00 1.22 2.04 0.91 0.94 117.51 123.93 2kmk h ILE 23 Ca -0.00 -2.09 -0.13 0.00 1.00 0.00 0.00 64.86 63.64 2kmk h ILE 23 Cb 0.30 2.27 -0.02 0.00 -0.74 0.00 0.00 36.82 38.63 2kmk h ILE 23 CO 0.01 0.64 -0.62 0.45 0.00 0.00 0.00 178.15 178.63 2kmk h HIS 24 N 0.34 0.00 0.00 1.37 3.86 -1.09 -3.12 115.15 116.51 2kmk h HIS 24 Ca -0.09 0.00 -0.15 0.00 -1.16 0.00 0.00 60.37 58.97 2kmk h HIS 24 Cb 1.49 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 29.94 2kmk h HIS 24 CO 0.11 0.62 -1.14 1.03 0.86 0.00 0.00 177.93 179.40 2kmk h SER 25 N 0.00 0.00 -4.81 2.45 0.87 -1.01 -3.48 113.55 107.57 2kmk h SER 25 Ca -0.01 0.00 -0.25 0.00 -1.23 0.00 0.00 61.79 60.31 2kmk h SER 25 Cb 1.28 0.00 0.13 0.00 -0.44 0.00 0.00 62.40 63.37 2kmk h SER 25 CO 0.08 0.57 -0.60 0.47 -0.53 0.00 0.00 176.83 176.83 2kmk n ASP 26 N -3.00 -2.35 -4.69 6.23 8.00 0.32 -4.99 116.55 116.07 2kmk n ASP 26 Ca -0.06 -0.48 -0.36 0.00 0.71 0.00 0.00 54.79 54.59 2kmk n ASP 26 Cb 0.82 -4.06 -0.08 0.00 -0.02 0.00 0.00 41.12 37.77 2kmk n ASP 26 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2kmk s THR 27 N -3.28 5.33 -0.46 -3.53 2.01 -0.96 -5.03 115.64 109.72 2kmk s THR 27 Ca 0.03 0.35 0.04 0.00 0.31 0.00 0.00 61.69 62.42 2kmk s THR 27 Cb -0.00 -3.56 0.17 0.00 0.01 0.00 0.00 72.50 69.12 2kmk s THR 27 CO 0.56 0.36 0.37 -0.13 -0.69 0.00 0.00 174.62 175.09 2kmk s ARG 28 N 0.79 1.19 0.00 4.92 3.00 -1.26 -4.45 118.95 123.14 2kmk s ARG 28 Ca 0.11 -2.34 0.00 0.00 0.00 0.00 0.00 55.73 53.51 2kmk s ARG 28 Cb -0.13 -1.78 0.00 0.00 0.00 0.00 0.00 34.95 33.04 2kmk s ARG 28 CO 0.03 -1.37 0.48 -0.35 0.00 0.00 0.00 175.30 174.09 2kmk n PRO 29 N 2.68 0.78 -3.81 3.54 -0.04 -1.15 -4.30 135.00 132.70 2kmk n PRO 29 Ca 0.28 0.00 -0.28 0.00 -0.04 0.00 0.00 63.50 63.46 2kmk n PRO 29 Cb 0.46 -1.31 -0.12 0.00 -0.04 0.00 0.00 33.50 32.49 2kmk n PRO 29 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 2kmk s TYR 30 N -1.21 2.97 0.39 0.54 2.02 -0.68 -4.97 117.35 116.40 2kmk s TYR 30 Ca 0.00 -3.06 -0.23 0.00 -0.37 0.00 0.00 57.07 53.40 2kmk s TYR 30 Cb 0.00 -2.36 -0.10 0.00 -0.40 0.00 0.00 41.96 39.09 2kmk s TYR 30 CO 0.00 -0.64 0.96 -1.25 -1.57 0.00 0.00 175.55 173.05 2kmk s PRO 31 N -0.86 4.34 0.24 -1.71 0.05 -1.26 0.31 135.00 136.12 2kmk s PRO 31 Ca 0.24 1.24 -0.30 0.00 0.05 0.00 0.00 61.00 62.24 2kmk s PRO 31 Cb -0.09 -2.45 -0.09 0.00 0.05 0.00 0.00 34.50 31.93 2kmk s PRO 31 CO -0.13 0.06 1.20 0.00 0.05 0.00 0.00 177.00 178.19 2kmk h GLN 33 N 4.51 0.00 0.00 0.00 -0.00 -1.95 -3.38 115.11 114.30 2kmk h GLN 33 Ca -0.46 0.00 -0.02 0.00 -0.00 0.00 0.00 58.65 58.17 2kmk h GLN 33 Cb 1.22 0.00 -0.00 0.00 -0.00 0.00 0.00 27.48 28.69 2kmk h GLN 33 CO 0.71 0.00 -0.88 0.66 -0.00 0.00 0.00 178.83 179.32 2kmk n TYR 34 N -2.37 0.00 0.13 0.06 4.02 -1.26 -4.91 117.16 112.82 2kmk n TYR 34 Ca 0.05 0.00 0.11 0.00 -0.01 0.00 0.00 57.90 58.04 2kmk n TYR 34 Cb 0.45 -0.04 -0.16 0.00 -0.02 0.00 0.00 39.34 39.57 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 1.32 1.38 3.38 0.00 0.00 -1.26 -5.07 105.19 104.94 2kmk n GLY 36 Ca -0.03 -0.28 -0.33 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 -0.37 -4.17 1.61 5.02 -1.26 -4.27 118.16 114.72 2kmk n LYS 37 Ca 0.00 -0.07 -0.16 0.00 -2.02 0.00 0.00 58.31 56.06 2kmk n LYS 37 Cb 0.00 -1.80 -0.11 0.00 -0.02 0.00 0.00 35.03 33.10 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 -3.53 0.83 0.14 1.97 3.00 -1.26 0.18 118.95 120.28 2kmk s ARG 38 Ca 0.56 -1.07 0.02 0.00 0.00 0.00 0.00 55.73 55.24 2kmk s ARG 38 Cb -0.20 -0.66 -0.04 0.00 0.00 0.00 0.00 34.95 34.04 2kmk s ARG 38 CO 0.68 0.13 -0.03 -0.06 0.00 0.00 0.00 175.30 176.01 2kmk s PHE 39 N -1.91 1.08 -0.84 -0.53 0.40 0.15 -4.94 117.98 111.39 2kmk s PHE 39 Ca 0.02 -0.96 0.23 0.00 -0.60 0.00 0.00 56.93 55.63 2kmk s PHE 39 Cb -0.06 -0.61 0.13 0.00 0.51 0.00 0.00 43.02 42.99 2kmk s PHE 39 CO 0.01 -0.16 1.13 -2.39 0.70 0.00 0.00 175.22 174.50 2kmk n HIS 40 N -0.15 0.11 -3.83 0.36 1.44 -1.26 -1.68 115.22 110.20 2kmk n HIS 40 Ca -0.09 0.03 -0.26 0.00 -2.01 0.00 0.00 57.72 55.39 2kmk n HIS 40 Cb 0.62 -0.27 -0.17 0.00 0.12 0.00 0.00 29.99 30.30 2kmk n HIS 40 CO 0.00 0.00 0.00 -0.65 -2.81 0.00 0.00 176.34 172.88 2kmk s GLN 41 N -3.08 1.09 0.00 -1.40 -0.21 -1.26 -4.82 119.66 109.98 2kmk s GLN 41 Ca 0.07 -0.29 0.00 0.00 0.02 0.00 0.00 55.36 55.16 2kmk s GLN 41 Cb 0.16 -1.69 0.00 0.00 1.00 0.00 0.00 33.01 32.48 2kmk s GLN 41 CO 0.78 -0.41 0.57 1.17 -2.12 0.00 0.00 175.29 175.28 2kmk n LYS 42 N 4.99 0.00 -0.44 2.91 4.81 -1.26 0.80 118.16 129.96 2kmk n LYS 42 Ca -0.10 0.57 0.36 0.00 -0.87 0.00 0.00 58.31 58.27 2kmk n LYS 42 Cb 0.49 -0.92 0.66 0.00 0.02 0.00 0.00 35.03 35.27 2kmk n LYS 42 CO 0.00 0.00 0.00 0.77 1.17 0.00 0.00 177.40 179.34 2kmk h SER 43 N 0.00 0.22 -0.44 3.14 0.02 -1.96 2.10 113.55 116.62 2kmk h SER 43 Ca 0.00 0.09 -0.13 0.00 -0.84 0.00 0.00 61.79 60.91 2kmk h SER 43 Cb 0.00 0.07 -0.01 0.00 0.14 0.00 0.00 62.40 62.60 2kmk h SER 43 CO 0.00 -0.08 -0.22 0.44 -1.14 0.00 0.00 176.83 175.83 2kmk h ASP 44 N 0.12 0.96 -0.10 3.07 5.19 -0.03 0.17 116.42 125.80 2kmk h ASP 44 Ca 0.76 -0.40 -0.04 0.00 -0.62 0.00 0.00 57.03 56.73 2kmk h ASP 44 Cb 2.49 -0.26 -0.00 0.00 0.18 0.00 0.00 39.33 41.73 2kmk h ASP 44 CO -0.28 1.15 -0.08 -0.03 -3.12 0.00 0.00 179.24 176.87 2kmk h MET 45 N 0.77 0.23 -0.97 3.56 1.85 0.46 -1.45 114.93 119.38 2kmk h MET 45 Ca 0.10 -0.12 0.22 0.00 -0.61 0.00 0.00 59.70 59.30 2kmk h MET 45 Cb 0.79 0.00 -0.08 0.00 0.43 0.00 0.00 31.60 32.74 2kmk h MET 45 CO 0.07 0.63 0.63 -0.22 -0.40 0.00 0.00 176.91 177.62 2kmk h LYS 46 N -0.17 0.43 -0.14 0.39 3.64 0.32 3.99 116.57 125.03 2kmk h LYS 46 Ca 0.02 -0.03 -0.10 0.00 -1.27 0.00 0.00 60.65 59.28 2kmk h LYS 46 Cb 0.59 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.30 2kmk h LYS 46 CO 0.02 0.29 -0.34 0.87 -2.27 0.00 0.00 179.45 178.02 2kmk h LYS 47 N 0.45 0.28 0.37 1.90 1.57 -0.27 0.16 116.57 121.04 2kmk h LYS 47 Ca 0.53 -0.12 -0.02 0.00 -1.87 0.00 0.00 60.65 59.17 2kmk h LYS 47 Cb 1.26 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.56 2kmk h LYS 47 CO -0.24 0.59 -0.18 1.25 -0.57 0.00 0.00 179.45 180.31 2kmk h HIS 48 N 0.25 -0.47 -1.27 -1.35 2.76 0.82 -2.32 115.15 113.57 2kmk h HIS 48 Ca 0.03 -0.01 0.45 0.00 -2.20 0.00 0.00 60.37 58.64 2kmk h HIS 48 Cb 0.72 0.15 -0.15 0.00 1.55 0.00 0.00 27.41 29.69 2kmk h HIS 48 CO 0.01 -0.29 0.79 1.79 -1.30 0.00 0.00 177.93 178.94 2kmk h THR 49 N -0.61 0.05 -0.46 6.26 1.35 0.13 2.20 112.91 121.82 2kmk h THR 49 Ca -0.05 -0.01 -0.08 0.00 -0.55 0.00 0.00 66.41 65.72 2kmk h THR 49 Cb 0.39 0.01 -0.02 0.00 -1.73 0.00 0.00 68.15 66.79 2kmk h THR 49 CO 0.08 0.01 -0.03 -0.26 -0.25 0.00 0.00 175.52 175.07 2kmk h PHE 50 N 0.04 0.84 -0.67 4.73 -1.00 -0.37 0.13 116.94 120.64 2kmk h PHE 50 Ca 0.86 -0.13 0.01 0.00 2.81 0.00 0.00 57.97 61.52 2kmk h PHE 50 Cb 2.60 -0.23 -0.03 0.00 3.61 0.00 0.00 35.95 41.90 2kmk h PHE 50 CO -0.01 0.79 0.44 -0.84 -1.61 0.00 0.00 178.31 177.09 2kmk h ILE 51 N 0.72 1.17 -0.02 -0.55 3.07 0.42 0.21 117.51 122.53 2kmk h ILE 51 Ca 0.14 -0.31 -0.17 0.00 1.55 0.00 0.00 64.86 66.07 2kmk h ILE 51 Cb 0.49 0.19 -0.01 0.00 -0.27 0.00 0.00 36.82 37.21 2kmk h ILE 51 CO 0.02 0.16 -0.75 0.45 -1.05 0.00 0.00 178.15 176.98 2kmk h HIS 52 N 0.90 0.22 -0.00 0.16 3.86 -0.82 -3.20 115.15 116.27 2kmk h HIS 52 Ca 0.25 -0.11 0.00 0.00 -1.16 0.00 0.00 60.37 59.35 2kmk h HIS 52 Cb -0.09 -0.03 0.00 0.00 1.06 0.00 0.00 27.41 28.35 2kmk h HIS 52 CO -0.00 0.85 -0.24 0.25 0.86 0.00 0.00 177.93 179.65 2kmk n THR 53 N -3.73 0.00 -1.07 2.45 -2.24 -0.08 -4.90 114.28 104.71 2kmk n THR 53 Ca -0.03 -0.02 -0.02 0.00 -2.27 0.00 0.00 64.05 61.71 2kmk n THR 53 Cb 0.72 -0.06 -0.01 0.00 -2.10 0.00 0.00 70.33 68.88 2kmk n THR 53 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2kmk n GLY 54 N 1.45 0.54 3.59 3.38 0.00 0.59 -4.95 105.19 109.80 2kmk n GLY 54 Ca 0.08 -0.29 -0.42 0.00 0.00 0.00 0.00 46.02 45.39 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 -1.33 3.45 -0.80 1.61 2.02 -0.97 -4.93 118.70 117.75 2kmk s GLU 55 Ca 0.00 0.70 0.02 0.00 0.02 0.00 0.00 54.97 55.71 2kmk s GLU 55 Cb 0.00 -4.07 0.20 0.00 0.10 0.00 0.00 34.13 30.36 2kmk s GLU 55 CO 0.00 -1.73 0.65 1.63 0.02 0.00 0.00 175.26 175.83 2kmk n LYS 56 N 8.33 2.26 0.08 1.61 4.76 -1.26 -4.56 118.16 129.38 2kmk n LYS 56 Ca 0.15 -4.50 0.12 0.00 -2.87 0.00 0.00 58.31 51.21 2kmk n LYS 56 Cb 0.49 -2.35 0.46 0.00 -1.84 0.00 0.00 35.03 31.78 2kmk n LYS 56 CO 0.00 0.00 0.00 -0.35 -1.37 0.00 0.00 177.40 175.68 2kmk n PRO 57 N 2.07 0.16 -2.98 1.97 -0.04 -1.24 -4.42 135.00 130.51 2kmk n PRO 57 Ca 0.21 0.26 -0.44 0.00 -0.04 0.00 0.00 63.50 63.49 2kmk n PRO 57 Cb 0.36 -1.74 -0.01 0.00 -0.04 0.00 0.00 33.50 32.08 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 -3.15 3.51 0.26 0.54 3.76 -0.73 -4.91 115.29 114.58 2kmk s HIS 58 Ca 0.08 -2.05 -0.30 0.00 -0.15 0.00 0.00 55.06 52.64 2kmk s HIS 58 Cb 0.12 -4.26 -0.09 0.00 1.11 0.00 0.00 32.58 29.46 2kmk s HIS 58 CO 0.47 -1.37 1.02 0.15 -0.85 0.00 0.00 174.74 174.16 2kmk s LYS 59 N 1.50 4.75 -0.32 1.40 1.02 -1.26 0.60 119.74 127.43 2kmk s LYS 59 Ca 0.39 1.64 -0.11 0.00 0.02 0.00 0.00 55.97 57.92 2kmk s LYS 59 Cb -0.04 -3.23 -0.01 0.00 -0.52 0.00 0.00 37.83 34.03 2kmk s LYS 59 CO -0.02 0.37 0.18 0.00 -0.92 0.00 0.00 175.35 174.96 2kmk n GLN 61 N 5.02 1.67 -0.07 0.00 6.02 -1.26 -1.27 117.38 127.49 2kmk n GLN 61 Ca -0.13 -0.74 -0.18 0.00 -0.01 0.00 0.00 57.00 55.93 2kmk n GLN 61 Cb 0.49 -1.37 -0.13 0.00 1.02 0.00 0.00 30.24 30.25 2kmk n GLN 61 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 2kmk n VAL 62 N 0.10 1.61 -0.11 5.09 0.31 -1.26 -4.66 118.33 119.41 2kmk n VAL 62 Ca 0.07 -0.63 0.00 0.00 -0.01 0.00 0.00 64.34 63.76 2kmk n VAL 62 Cb 0.30 -1.48 0.00 0.00 -0.91 0.00 0.00 33.84 31.75 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 0.35 0.56 0.96 0.00 0.00 -0.40 -5.06 105.19 101.61 2kmk n GLY 64 Ca 0.00 -0.80 -0.05 0.00 0.00 0.00 0.00 46.02 45.17 2kmk n GLY 64 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2kmk n LYS 65 N -0.90 0.68 -3.57 1.61 4.81 -1.23 -4.86 118.16 114.70 2kmk n LYS 65 Ca 0.00 -0.72 -0.13 0.00 -0.87 0.00 0.00 58.31 56.59 2kmk n LYS 65 Cb 0.47 -0.11 -0.06 0.00 0.02 0.00 0.00 35.03 35.35 2kmk n LYS 65 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2kmk s ALA 66 N -2.50 -1.88 0.05 3.14 0.00 -1.26 -1.18 121.76 118.12 2kmk s ALA 66 Ca 0.16 1.57 0.05 0.00 0.00 0.00 0.00 51.96 53.75 2kmk s ALA 66 Cb -0.01 -0.63 -0.02 0.00 0.00 0.00 0.00 23.12 22.45 2kmk s ALA 66 CO 0.10 -0.32 -0.15 -0.06 0.00 0.00 0.00 175.76 175.33 2kmk s PHE 67 N -0.87 1.33 -1.20 0.00 0.40 0.20 -4.93 117.98 112.92 2kmk s PHE 67 Ca -0.04 -0.38 0.16 0.00 -0.60 0.00 0.00 56.93 56.07 2kmk s PHE 67 Cb -0.01 -0.78 0.73 0.00 0.51 0.00 0.00 43.02 43.48 2kmk s PHE 67 CO 0.03 0.06 1.48 -1.13 0.70 0.00 0.00 175.22 176.36 2kmk n SER 68 N 1.71 0.00 -3.74 1.36 3.41 -1.26 -1.77 113.62 113.33 2kmk n SER 68 Ca -0.19 0.30 -0.13 0.00 -0.26 0.00 0.00 58.87 58.59 2kmk n SER 68 Cb 0.54 -0.40 -0.13 0.00 -0.26 0.00 0.00 64.21 63.96 2kmk n SER 68 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 2kmk s GLN 69 N -2.80 0.17 0.19 4.33 -0.21 -1.26 -4.87 119.66 115.20 2kmk s GLN 69 Ca 0.11 0.45 -0.14 0.00 0.02 0.00 0.00 55.36 55.81 2kmk s GLN 69 Cb 0.10 -0.12 0.19 0.00 1.00 0.00 0.00 33.01 34.18 2kmk s GLN 69 CO 0.27 -0.15 1.67 0.66 -2.12 0.00 0.00 175.29 175.62 2kmk h SER 70 N 7.11 -0.28 -0.89 5.90 4.64 -1.95 0.86 113.55 128.94 2kmk h SER 70 Ca -0.40 0.13 0.24 0.00 -0.47 0.00 0.00 61.79 61.29 2kmk h SER 70 Cb 1.15 0.24 -0.15 0.00 -0.31 0.00 0.00 62.40 63.34 2kmk h SER 70 CO 0.39 -0.10 0.20 -1.28 -0.87 0.00 0.00 176.83 175.17 2kmk h SER 71 N 0.08 -0.09 0.63 4.97 0.87 -1.98 3.64 113.55 121.68 2kmk h SER 71 Ca 0.25 0.21 -0.09 0.00 -1.23 0.00 0.00 61.79 60.94 2kmk h SER 71 Cb 0.39 0.30 -0.01 0.00 -0.44 0.00 0.00 62.40 62.64 2kmk h SER 71 CO -0.45 -0.20 -0.43 0.78 -0.53 0.00 0.00 176.83 176.00 2kmk h ASN 72 N 0.16 0.00 0.47 6.23 2.35 -1.30 -0.46 115.58 123.03 2kmk h ASN 72 Ca 0.56 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 56.29 2kmk h ASN 72 Cb 1.14 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.52 2kmk h ASN 72 CO -0.70 0.43 -0.22 0.25 -1.65 0.00 0.00 177.43 175.54 2kmk h LEU 73 N 0.00 -0.53 -0.51 1.61 5.85 0.74 0.25 115.31 122.72 2kmk h LEU 73 Ca -0.00 -0.02 0.09 0.00 0.84 0.00 0.00 57.88 58.79 2kmk h LEU 73 Cb 0.87 0.14 -0.10 0.00 0.37 0.00 0.00 40.66 41.93 2kmk h LEU 73 CO 0.06 -0.11 -0.33 0.40 -0.34 0.00 0.00 178.44 178.11 2kmk h ILE 74 N -1.14 0.19 -0.60 4.05 2.04 0.15 0.82 117.51 123.02 2kmk h ILE 74 Ca -0.06 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.78 2kmk h ILE 74 Cb 0.51 0.19 -0.03 0.00 -0.74 0.00 0.00 36.82 36.76 2kmk h ILE 74 CO 0.11 0.00 0.31 0.74 0.00 0.00 0.00 178.15 179.30 2kmk h THR 75 N -0.20 1.20 -0.47 -0.27 2.02 -1.10 0.36 112.91 114.45 2kmk h THR 75 Ca 0.20 -0.54 0.02 0.00 0.77 0.00 0.00 66.41 66.87 2kmk h THR 75 Cb 0.55 0.47 -0.03 0.00 -1.74 0.00 0.00 68.15 67.39 2kmk h THR 75 CO -0.62 0.22 0.28 -0.74 0.37 0.00 0.00 175.52 175.03 2kmk h HIS 76 N 0.81 0.53 -0.16 3.16 -0.00 0.20 -1.00 115.15 118.68 2kmk h HIS 76 Ca 0.21 0.02 -0.12 0.00 -0.00 0.00 0.00 60.37 60.48 2kmk h HIS 76 Cb 0.08 -0.17 -0.01 0.00 -0.00 0.00 0.00 27.41 27.31 2kmk h HIS 76 CO -0.01 0.31 -0.41 1.03 -0.00 0.00 0.00 177.93 178.85 2kmk h SER 77 N 0.56 0.39 -0.95 3.26 0.87 0.93 -2.03 113.55 116.58 2kmk h SER 77 Ca 0.19 -0.17 0.19 0.00 -1.23 0.00 0.00 61.79 60.77 2kmk h SER 77 Cb 0.01 -0.11 -0.11 0.00 -0.44 0.00 0.00 62.40 61.75 2kmk h SER 77 CO -0.08 0.75 0.53 0.03 -0.53 0.00 0.00 176.83 177.54 2kmk h ARG 78 N 0.31 0.65 -0.36 2.24 3.08 1.00 0.86 114.38 122.15 2kmk h ARG 78 Ca 0.03 -0.04 -0.04 0.00 0.07 0.00 0.00 59.98 60.00 2kmk h ARG 78 Cb 0.85 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 30.74 2kmk h ARG 78 CO 0.07 0.43 0.09 0.87 -1.07 0.00 0.00 179.97 180.35 2kmk h LYS 79 N 0.66 0.57 -0.45 0.04 1.57 -0.62 1.05 116.57 119.40 2kmk h LYS 79 Ca 0.55 -0.14 -0.03 0.00 -1.87 0.00 0.00 60.65 59.16 2kmk h LYS 79 Cb 0.88 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 33.09 2kmk h LYS 79 CO -0.40 0.62 0.15 0.45 -0.57 0.00 0.00 179.45 179.70 2kmk h HIS 80 N 0.43 0.65 -0.48 -1.35 3.86 0.28 -1.45 115.15 117.10 2kmk h HIS 80 Ca 0.11 -0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.29 2kmk h HIS 80 Cb 0.30 -0.20 0.00 0.00 1.06 0.00 0.00 27.41 28.57 2kmk h HIS 80 CO 0.02 0.53 0.00 0.25 0.86 0.00 0.00 177.93 179.59 2kmk n THR 81 N -4.34 2.12 0.14 2.45 -2.24 0.25 -5.11 114.28 107.54 2kmk n THR 81 Ca 0.03 -1.11 0.02 0.00 -2.27 0.00 0.00 64.05 60.72 2kmk n THR 81 Cb 0.17 -0.26 0.01 0.00 -2.10 0.00 0.00 70.33 68.16 2kmk n THR 81 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11