#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 3.29 -0.14 0.66 0.08 -0.19 -4.90 117.98 116.77 2kmk s PHE 2 Ca 0.00 0.41 -0.04 0.00 0.12 0.00 0.00 56.93 57.42 2kmk s PHE 2 Cb 0.00 -2.49 -0.03 0.00 -0.57 0.00 0.00 43.02 39.93 2kmk s PHE 2 CO 0.00 -0.11 -0.00 0.34 -0.10 0.00 0.00 175.22 175.34 2kmk s ASP 3 N 1.40 5.11 0.16 1.36 2.15 -1.26 -0.12 116.67 125.47 2kmk s ASP 3 Ca 0.14 0.01 -0.31 0.00 0.43 0.00 0.00 52.55 52.82 2kmk s ASP 3 Cb -0.15 -1.71 -0.09 0.00 -0.30 0.00 0.00 42.92 40.67 2kmk s ASP 3 CO 0.09 0.24 1.47 0.00 -0.17 0.00 0.00 175.17 176.80 2kmk n LYS 5 N 3.64 2.03 0.00 0.00 4.01 -1.26 -3.88 118.16 122.70 2kmk n LYS 5 Ca 0.11 -2.35 0.00 0.00 -0.51 0.00 0.00 58.31 55.56 2kmk n LYS 5 Cb 0.40 -1.92 0.00 0.00 -0.51 0.00 0.00 35.03 33.00 2kmk n LYS 5 CO 0.00 0.00 0.00 -0.89 -1.11 0.00 0.00 177.40 175.40 2kmk n ILE 6 N -0.68 0.00 -0.08 -0.18 2.08 -1.26 -4.94 119.36 114.30 2kmk n ILE 6 Ca 0.46 0.00 -0.16 0.00 0.56 0.00 0.00 62.75 63.61 2kmk n ILE 6 Cb 1.24 -0.62 -0.12 0.00 -0.75 0.00 0.00 39.64 39.39 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 1.54 0.70 3.37 0.00 0.00 -1.25 -5.12 105.19 104.44 2kmk n GLY 8 Ca -0.19 -0.16 -0.19 0.00 0.00 0.00 0.00 46.02 45.48 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 1.42 0.25 1.61 1.02 -1.26 -4.95 119.74 117.83 2kmk s LYS 9 Ca 0.00 -1.70 0.09 0.00 0.02 0.00 0.00 55.97 54.38 2kmk s LYS 9 Cb 0.00 -0.94 -0.04 0.00 -0.52 0.00 0.00 37.83 36.33 2kmk s LYS 9 CO 0.00 0.01 -0.01 0.45 -0.92 0.00 0.00 175.35 174.89 2kmk s SER 10 N -3.36 4.56 -0.03 2.83 0.15 -1.26 -0.85 113.70 115.72 2kmk s SER 10 Ca 0.27 -0.61 -0.01 0.00 0.70 0.00 0.00 55.95 56.30 2kmk s SER 10 Cb 0.04 -0.86 0.03 0.00 -1.71 0.00 0.00 66.02 63.52 2kmk s SER 10 CO 0.09 0.02 0.03 -0.36 1.20 0.00 0.00 173.24 174.22 2kmk s PHE 11 N -2.22 0.15 0.24 3.44 0.08 0.83 -4.96 117.98 115.54 2kmk s PHE 11 Ca 0.31 0.13 0.30 0.00 0.12 0.00 0.00 56.93 57.78 2kmk s PHE 11 Cb -0.07 -0.41 1.36 0.00 -0.57 0.00 0.00 43.02 43.33 2kmk s PHE 11 CO 0.19 -0.16 2.00 0.87 -0.10 0.00 0.00 175.22 178.03 2kmk h LYS 12 N 7.81 0.00 -5.77 0.44 1.57 -1.96 -0.49 116.57 118.17 2kmk h LYS 12 Ca -0.30 0.00 -0.69 0.00 -1.87 0.00 0.00 60.65 57.79 2kmk h LYS 12 Cb 1.12 0.00 -0.31 0.00 0.08 0.00 0.00 32.23 33.12 2kmk h LYS 12 CO 0.34 0.10 -0.87 1.03 -0.57 0.00 0.00 179.45 179.47 2kmk s ARG 13 N -3.84 2.76 0.44 3.15 1.81 -1.26 -4.76 118.95 117.25 2kmk s ARG 13 Ca -0.01 -0.88 0.13 0.00 -1.72 0.00 0.00 55.73 53.25 2kmk s ARG 13 Cb 0.11 -2.24 1.02 0.00 -0.45 0.00 0.00 34.95 33.39 2kmk s ARG 13 CO 0.57 0.31 2.01 1.03 -0.68 0.00 0.00 175.30 178.54 2kmk h SER 14 N 6.28 0.35 -0.55 0.23 0.87 -1.96 -0.75 113.55 118.04 2kmk h SER 14 Ca -0.28 0.00 -0.10 0.00 -1.23 0.00 0.00 61.79 60.18 2kmk h SER 14 Cb 1.20 -0.07 -0.02 0.00 -0.44 0.00 0.00 62.40 63.06 2kmk h SER 14 CO 0.48 0.23 -0.04 -1.28 -0.53 0.00 0.00 176.83 175.68 2kmk h SER 15 N 0.40 1.00 -0.21 6.23 0.87 -1.96 0.75 113.55 120.64 2kmk h SER 15 Ca 0.23 -0.30 -0.05 0.00 -1.23 0.00 0.00 61.79 60.44 2kmk h SER 15 Cb 0.38 -0.27 -0.02 0.00 -0.44 0.00 0.00 62.40 62.05 2kmk h SER 15 CO -0.06 1.08 -0.02 0.71 -0.53 0.00 0.00 176.83 178.01 2kmk h THR 16 N 0.92 1.20 -0.22 2.23 1.35 -1.55 -0.26 112.91 116.57 2kmk h THR 16 Ca 0.16 -0.81 -0.12 0.00 -0.55 0.00 0.00 66.41 65.09 2kmk h THR 16 Cb 0.59 0.98 -0.00 0.00 -1.73 0.00 0.00 68.15 67.99 2kmk h THR 16 CO 0.04 0.28 -0.31 0.25 -0.25 0.00 0.00 175.52 175.52 2kmk h LEU 17 N 0.49 0.66 0.00 3.87 5.85 -0.66 -1.69 115.31 123.82 2kmk h LEU 17 Ca 0.10 -0.51 0.02 0.00 0.84 0.00 0.00 57.88 58.33 2kmk h LEU 17 Cb 0.35 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 41.15 2kmk h LEU 17 CO 0.01 1.04 -0.40 -1.28 -0.34 0.00 0.00 178.44 177.47 2kmk h SER 18 N 0.29 -1.23 -0.86 1.25 0.87 0.20 1.23 113.55 115.30 2kmk h SER 18 Ca 0.02 0.14 0.14 0.00 -1.23 0.00 0.00 61.79 60.86 2kmk h SER 18 Cb 0.89 0.47 -0.07 0.00 -0.44 0.00 0.00 62.40 63.25 2kmk h SER 18 CO 0.07 -0.39 0.56 0.74 -0.53 0.00 0.00 176.83 177.28 2kmk h THR 19 N -0.50 0.83 -0.24 2.23 2.02 -1.14 0.18 112.91 116.29 2kmk h THR 19 Ca 0.01 -0.22 -0.03 0.00 0.77 0.00 0.00 66.41 66.94 2kmk h THR 19 Cb 0.54 0.14 -0.01 0.00 -1.74 0.00 0.00 68.15 67.07 2kmk h THR 19 CO -0.27 0.12 0.03 -0.74 0.37 0.00 0.00 175.52 175.03 2kmk h HIS 20 N 0.64 0.43 0.00 3.16 6.17 0.09 -0.39 115.15 125.25 2kmk h HIS 20 Ca 0.43 -0.06 -0.01 0.00 0.71 0.00 0.00 60.37 61.44 2kmk h HIS 20 Cb 0.74 -0.12 -0.00 0.00 2.52 0.00 0.00 27.41 30.55 2kmk h HIS 20 CO -0.00 0.54 -0.03 -0.07 0.71 0.00 0.00 177.93 179.07 2kmk h LEU 21 N 0.20 0.00 -1.13 0.26 3.38 0.36 0.63 115.31 119.01 2kmk h LEU 21 Ca 0.07 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.96 2kmk h LEU 21 Cb 0.35 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 2kmk h LEU 21 CO 0.01 0.03 -0.37 -0.07 0.09 0.00 0.00 178.44 178.13 2kmk h LEU 22 N 0.00 0.00 -0.67 1.67 3.38 0.60 0.49 115.31 120.78 2kmk h LEU 22 Ca -0.00 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.89 2kmk h LEU 22 Cb 0.07 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.80 2kmk h LEU 22 CO 0.00 0.37 0.08 0.40 0.09 0.00 0.00 178.44 179.39 2kmk h ILE 23 N 0.00 1.27 -0.05 1.22 2.04 0.18 1.07 117.51 123.25 2kmk h ILE 23 Ca -0.00 -1.07 -0.06 0.00 1.00 0.00 0.00 64.86 64.72 2kmk h ILE 23 Cb 0.79 0.66 0.00 0.00 -0.74 0.00 0.00 36.82 37.53 2kmk h ILE 23 CO 0.05 0.40 -0.20 0.45 0.00 0.00 0.00 178.15 178.84 2kmk h HIS 24 N 1.04 0.29 0.00 1.37 3.86 -1.14 -2.97 115.15 117.60 2kmk h HIS 24 Ca 0.20 -0.13 0.00 0.00 -1.16 0.00 0.00 60.37 59.28 2kmk h HIS 24 Cb 0.47 -0.05 0.00 0.00 1.06 0.00 0.00 27.41 28.90 2kmk h HIS 24 CO 0.04 0.84 0.00 -1.13 0.86 0.00 0.00 177.93 178.53 2kmk n SER 25 N -4.55 0.00 -3.82 2.45 3.41 0.11 -4.90 113.62 106.32 2kmk n SER 25 Ca -0.08 -0.30 -0.33 0.00 -0.26 0.00 0.00 58.87 57.89 2kmk n SER 25 Cb 0.44 -0.17 0.02 0.00 -0.26 0.00 0.00 64.21 64.24 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 -1.17 -4.93 -4.46 4.04 8.00 0.37 -4.90 116.55 113.50 2kmk n ASP 26 Ca 0.13 -1.05 -0.41 0.00 0.71 0.00 0.00 54.79 54.17 2kmk n ASP 26 Cb 0.13 -2.39 -0.11 0.00 -0.02 0.00 0.00 41.12 38.73 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 -3.32 5.07 -0.58 -3.53 2.01 -0.91 -4.99 115.64 109.39 2kmk s THR 27 Ca 0.32 -0.57 0.06 0.00 0.31 0.00 0.00 61.69 61.81 2kmk s THR 27 Cb -0.15 -3.75 0.23 0.00 0.01 0.00 0.00 72.50 68.84 2kmk s THR 27 CO 0.91 -0.19 0.64 0.54 -0.69 0.00 0.00 174.62 175.82 2kmk n ARG 28 N 5.10 1.86 0.00 4.92 5.12 -1.26 -4.41 116.66 127.99 2kmk n ARG 28 Ca -0.12 -4.21 0.00 0.00 -1.93 0.00 0.00 57.85 51.59 2kmk n ARG 28 Cb 0.48 -1.98 0.00 0.00 -1.16 0.00 0.00 32.46 29.80 2kmk n ARG 28 CO 0.00 0.00 0.00 -0.35 -1.93 0.00 0.00 177.63 175.35 2kmk n PRO 29 N 1.25 0.70 -3.85 5.56 -0.04 -1.21 -4.40 135.00 133.00 2kmk n PRO 29 Ca 0.26 0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 63.41 2kmk n PRO 29 Cb 0.43 -1.07 -0.12 0.00 -0.04 0.00 0.00 33.50 32.70 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 -1.79 3.38 -0.03 0.54 2.02 -0.79 -5.00 117.35 115.69 2kmk s TYR 30 Ca 0.00 -3.09 -0.25 0.00 -0.37 0.00 0.00 57.07 53.36 2kmk s TYR 30 Cb 0.00 -2.93 -0.04 0.00 -0.40 0.00 0.00 41.96 38.59 2kmk s TYR 30 CO 0.00 -0.72 0.77 -1.25 -1.57 0.00 0.00 175.55 172.77 2kmk s PRO 31 N -0.59 4.47 0.32 -1.71 0.04 -1.26 -0.46 135.00 135.81 2kmk s PRO 31 Ca 0.20 1.02 -0.27 0.00 0.04 0.00 0.00 61.00 61.98 2kmk s PRO 31 Cb -0.18 -3.43 -0.13 0.00 0.04 0.00 0.00 34.50 30.80 2kmk s PRO 31 CO -0.05 0.10 1.06 0.00 0.04 0.00 0.00 177.00 178.14 2kmk h GLN 33 N 2.03 0.00 0.00 0.00 3.07 -1.94 -3.28 115.11 114.99 2kmk h GLN 33 Ca -0.42 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.32 2kmk h GLN 33 Cb 1.33 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.89 2kmk h GLN 33 CO 0.60 0.00 0.00 0.66 0.09 0.00 0.00 178.83 180.18 2kmk n TYR 34 N -2.67 0.00 0.83 0.06 4.02 -1.26 -4.73 117.16 113.41 2kmk n TYR 34 Ca 0.05 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.94 2kmk n TYR 34 Cb 0.48 0.00 0.03 0.00 -0.02 0.00 0.00 39.34 39.83 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 0.08 0.00 3.21 0.00 0.00 -1.24 -4.93 105.19 102.32 2kmk n GLY 36 Ca 0.03 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.78 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 0.39 -2.76 -4.21 1.61 5.02 -1.26 -4.12 118.16 112.83 2kmk n LYS 37 Ca 0.00 -0.80 -0.20 0.00 -2.02 0.00 0.00 58.31 55.29 2kmk n LYS 37 Cb 0.20 -1.75 -0.16 0.00 -0.02 0.00 0.00 35.03 33.30 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 -3.97 0.83 0.31 1.97 0.52 -1.26 0.74 118.95 118.09 2kmk s ARG 38 Ca 0.54 -0.15 0.08 0.00 -0.52 0.00 0.00 55.73 55.68 2kmk s ARG 38 Cb -0.12 -0.81 -0.06 0.00 0.52 0.00 0.00 34.95 34.48 2kmk s ARG 38 CO 0.54 -0.03 -0.07 -0.06 0.02 0.00 0.00 175.30 175.70 2kmk s PHE 39 N 0.69 2.14 -0.85 -0.53 0.40 0.40 -4.97 117.98 115.26 2kmk s PHE 39 Ca -0.09 -0.63 0.14 0.00 -0.60 0.00 0.00 56.93 55.74 2kmk s PHE 39 Cb -0.13 -1.23 0.43 0.00 0.51 0.00 0.00 43.02 42.60 2kmk s PHE 39 CO 0.00 0.39 1.35 -2.39 0.70 0.00 0.00 175.22 175.28 2kmk n HIS 40 N -0.67 0.72 -3.56 0.36 1.44 -1.26 -1.89 115.22 110.36 2kmk n HIS 40 Ca -0.05 -0.60 -0.18 0.00 -2.01 0.00 0.00 57.72 54.88 2kmk n HIS 40 Cb 0.64 -0.11 -0.14 0.00 0.12 0.00 0.00 29.99 30.49 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 -1.50 0.15 0.00 -1.40 -0.21 -1.26 -4.90 119.66 110.53 2kmk s GLN 41 Ca 0.32 0.33 0.00 0.00 0.02 0.00 0.00 55.36 56.04 2kmk s GLN 41 Cb 0.20 -0.90 0.00 0.00 1.00 0.00 0.00 33.01 33.31 2kmk s GLN 41 CO 0.16 -0.54 0.80 1.17 -2.12 0.00 0.00 175.29 174.76 2kmk n LYS 42 N 5.32 0.00 -0.35 2.91 4.81 -1.26 -0.41 118.16 129.18 2kmk n LYS 42 Ca -0.05 0.80 0.28 0.00 -0.87 0.00 0.00 58.31 58.46 2kmk n LYS 42 Cb 0.50 -1.24 0.59 0.00 0.02 0.00 0.00 35.03 34.89 2kmk n LYS 42 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 2kmk h SER 43 N 0.00 0.31 -0.49 3.14 4.64 -1.97 1.05 113.55 120.23 2kmk h SER 43 Ca 0.00 0.08 -0.12 0.00 -0.47 0.00 0.00 61.79 61.27 2kmk h SER 43 Cb 0.00 0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 62.11 2kmk h SER 43 CO 0.00 0.02 -0.18 0.44 -0.87 0.00 0.00 176.83 176.24 2kmk h ASP 44 N 0.25 1.01 -0.17 4.97 3.32 -1.16 0.18 116.42 124.82 2kmk h ASP 44 Ca 0.64 -0.38 -0.03 0.00 0.02 0.00 0.00 57.03 57.27 2kmk h ASP 44 Cb 1.89 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 41.16 2kmk h ASP 44 CO -0.26 1.16 -0.01 -0.03 -1.72 0.00 0.00 179.24 178.38 2kmk h MET 45 N 0.85 0.31 -0.91 3.56 1.85 0.23 -0.94 114.93 119.88 2kmk h MET 45 Ca 0.12 -0.10 0.14 0.00 -0.61 0.00 0.00 59.70 59.25 2kmk h MET 45 Cb 0.76 -0.02 -0.07 0.00 0.43 0.00 0.00 31.60 32.69 2kmk h MET 45 CO 0.06 0.54 0.58 -0.22 -0.40 0.00 0.00 176.91 177.47 2kmk h LYS 46 N 0.04 0.71 0.00 0.39 1.63 0.42 1.96 116.57 121.73 2kmk h LYS 46 Ca 0.05 -0.04 -0.07 0.00 -0.85 0.00 0.00 60.65 59.73 2kmk h LYS 46 Cb 0.41 -0.16 -0.01 0.00 -0.60 0.00 0.00 32.23 31.87 2kmk h LYS 46 CO 0.01 0.47 -0.33 0.87 -3.45 0.00 0.00 179.45 177.02 2kmk h LYS 47 N 0.73 0.00 0.22 1.90 1.57 -0.19 -1.01 116.57 119.80 2kmk h LYS 47 Ca 0.46 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 59.23 2kmk h LYS 47 Cb 0.69 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.00 2kmk h LYS 47 CO -0.22 0.33 -0.11 1.25 -0.57 0.00 0.00 179.45 180.14 2kmk h HIS 48 N 0.00 -0.28 -1.60 -1.35 2.76 0.41 -1.70 115.15 113.39 2kmk h HIS 48 Ca -0.00 -0.01 0.50 0.00 -2.20 0.00 0.00 60.37 58.66 2kmk h HIS 48 Cb 0.62 0.09 -0.10 0.00 1.55 0.00 0.00 27.41 29.57 2kmk h HIS 48 CO 0.00 -0.17 1.10 0.25 -1.30 0.00 0.00 177.93 177.81 2kmk n THR 49 N -3.22 -0.12 0.04 6.26 -2.24 0.22 0.26 114.28 115.48 2kmk n THR 49 Ca -0.04 1.57 -0.16 0.00 -2.27 0.00 0.00 64.05 63.15 2kmk n THR 49 Cb 0.12 -2.59 -0.06 0.00 -2.10 0.00 0.00 70.33 65.69 2kmk n THR 49 CO 0.00 0.00 0.00 -0.26 -0.57 0.00 0.00 175.07 174.24 2kmk h PHE 50 N 0.00 0.84 -0.04 4.78 -1.00 -1.03 -0.08 116.94 120.41 2kmk h PHE 50 Ca 0.87 -0.43 0.01 0.00 2.81 0.00 0.00 57.97 61.23 2kmk h PHE 50 Cb 3.16 -0.11 -0.00 0.00 3.61 0.00 0.00 35.95 42.61 2kmk h PHE 50 CO -0.00 1.25 0.06 -0.84 -1.61 0.00 0.00 178.31 177.16 2kmk h ILE 51 N 0.35 0.39 0.00 -0.55 3.07 0.44 0.36 117.51 121.57 2kmk h ILE 51 Ca -0.09 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.32 2kmk h ILE 51 Cb 1.56 0.95 0.00 0.00 -0.27 0.00 0.00 36.82 39.06 2kmk h ILE 51 CO 0.17 0.00 0.00 1.41 -1.05 0.00 0.00 178.15 178.68 2kmk n HIS 52 N -3.65 0.00 0.00 0.16 8.25 -0.80 -4.11 115.22 115.08 2kmk n HIS 52 Ca -0.02 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.44 2kmk n HIS 52 Cb 0.14 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.25 2kmk n HIS 52 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 2kmk n THR 53 N 0.00 0.00 -0.06 1.59 -2.24 -0.11 -4.38 114.28 109.08 2kmk n THR 53 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 2kmk n THR 53 Cb 0.00 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 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 -0.43 1.08 3.69 3.38 0.00 0.12 -5.06 105.19 107.96 2kmk n GLY 54 Ca 0.00 -0.05 -0.42 0.00 0.00 0.00 0.00 46.02 45.55 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 -0.22 4.39 -0.47 1.61 2.02 -0.90 -4.98 118.70 120.14 2kmk s GLU 55 Ca 0.00 1.19 0.06 0.00 0.02 0.00 0.00 54.97 56.24 2kmk s GLU 55 Cb 0.00 -3.54 0.22 0.00 0.10 0.00 0.00 34.13 30.91 2kmk s GLU 55 CO 0.00 -0.25 0.50 1.63 0.02 0.00 0.00 175.26 177.16 2kmk n LYS 56 N 4.86 0.97 0.04 1.61 5.02 -1.26 -4.46 118.16 124.94 2kmk n LYS 56 Ca 0.06 -3.57 0.03 0.00 -2.02 0.00 0.00 58.31 52.81 2kmk n LYS 56 Cb 0.49 -1.62 0.16 0.00 -0.02 0.00 0.00 35.03 34.04 2kmk n LYS 56 CO 0.00 0.00 0.00 -2.30 -0.52 0.00 0.00 177.40 174.58 2kmk n PRO 57 N 1.79 0.03 -3.31 1.97 -0.02 -1.22 -4.20 135.00 130.04 2kmk n PRO 57 Ca 0.25 0.51 -0.47 0.00 -2.02 0.00 0.00 63.50 61.77 2kmk n PRO 57 Cb 0.48 -1.61 -0.03 0.00 -0.02 0.00 0.00 33.50 32.32 2kmk n PRO 57 CO 0.00 0.00 0.00 -1.01 1.98 0.00 0.00 175.50 176.47 2kmk s HIS 58 N -3.12 3.58 -0.22 6.00 3.76 -0.61 -4.94 115.29 119.73 2kmk s HIS 58 Ca 0.00 -1.75 -0.16 0.00 -0.15 0.00 0.00 55.06 53.00 2kmk s HIS 58 Cb 0.02 -3.83 -0.04 0.00 1.11 0.00 0.00 32.58 29.85 2kmk s HIS 58 CO 0.07 -1.02 0.43 0.15 -0.85 0.00 0.00 174.74 173.53 2kmk s LYS 59 N 0.70 4.13 -0.21 1.40 1.02 -1.26 0.34 119.74 125.86 2kmk s LYS 59 Ca 0.14 0.22 -0.29 0.00 0.02 0.00 0.00 55.97 56.06 2kmk s LYS 59 Cb -0.16 -3.58 0.00 0.00 -0.52 0.00 0.00 37.83 33.57 2kmk s LYS 59 CO -0.05 -0.15 1.02 0.00 -0.92 0.00 0.00 175.35 175.25 2kmk n GLN 61 N 6.04 1.78 -0.09 0.00 1.13 -1.26 -2.82 117.38 122.16 2kmk n GLN 61 Ca 0.11 -0.82 -0.12 0.00 -1.94 0.00 0.00 57.00 54.23 2kmk n GLN 61 Cb 0.47 -1.43 -0.05 0.00 0.11 0.00 0.00 30.24 29.34 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 0.14 1.47 -1.43 5.09 0.31 -1.26 -4.67 118.33 117.99 2kmk n VAL 62 Ca 0.07 0.08 0.07 0.00 -0.01 0.00 0.00 64.34 64.56 2kmk n VAL 62 Cb 0.34 -2.26 0.17 0.00 -0.91 0.00 0.00 33.84 31.18 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 -1.16 -0.50 3.74 0.00 0.00 -1.13 -4.99 105.19 101.15 2kmk n GLY 64 Ca 0.17 0.02 -0.28 0.00 0.00 0.00 0.00 46.02 45.93 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 -5.17 2.72 0.10 1.61 2.20 -1.23 -4.93 119.74 115.04 2kmk s LYS 65 Ca 0.06 -0.87 0.07 0.00 -0.36 0.00 0.00 55.97 54.87 2kmk s LYS 65 Cb -0.03 -2.59 -0.03 0.00 -1.51 0.00 0.00 37.83 33.67 2kmk s LYS 65 CO 0.07 0.51 -0.19 0.00 -0.36 0.00 0.00 175.35 175.38 2kmk s ALA 66 N -1.57 1.66 0.07 3.13 0.00 -1.26 0.18 121.76 123.98 2kmk s ALA 66 Ca 0.29 -1.21 0.03 0.00 0.00 0.00 0.00 51.96 51.07 2kmk s ALA 66 Cb -0.11 -0.20 -0.03 0.00 0.00 0.00 0.00 23.12 22.78 2kmk s ALA 66 CO 0.21 0.30 -0.09 -0.06 0.00 0.00 0.00 175.76 176.12 2kmk s PHE 67 N -1.28 0.90 0.03 0.00 0.08 0.15 -4.96 117.98 112.91 2kmk s PHE 67 Ca 0.05 -0.61 -0.17 0.00 0.12 0.00 0.00 56.93 56.32 2kmk s PHE 67 Cb -0.10 -0.51 -0.30 0.00 -0.57 0.00 0.00 43.02 41.54 2kmk s PHE 67 CO 0.04 -0.05 1.05 0.77 -0.10 0.00 0.00 175.22 176.93 2kmk h SER 68 N 3.91 0.79 -3.05 1.36 0.02 -1.87 -1.61 113.55 113.09 2kmk h SER 68 Ca -0.37 -0.85 -0.66 0.00 -0.84 0.00 0.00 61.79 59.07 2kmk h SER 68 Cb 1.19 -0.25 -0.09 0.00 0.14 0.00 0.00 62.40 63.39 2kmk h SER 68 CO 0.49 1.56 -0.56 -1.10 -1.14 0.00 0.00 176.83 176.08 2kmk s GLN 69 N -2.86 3.12 0.04 3.45 -0.21 -1.26 -4.75 119.66 117.19 2kmk s GLN 69 Ca -0.10 -0.44 -0.20 0.00 0.02 0.00 0.00 55.36 54.64 2kmk s GLN 69 Cb 0.04 -2.90 -0.15 0.00 1.00 0.00 0.00 33.01 31.00 2kmk s GLN 69 CO 0.91 0.66 1.32 0.66 -2.12 0.00 0.00 175.29 176.72 2kmk h SER 70 N 4.20 0.43 -0.89 5.90 4.64 -1.98 -1.23 113.55 124.62 2kmk h SER 70 Ca -0.50 -0.52 0.23 0.00 -0.47 0.00 0.00 61.79 60.54 2kmk h SER 70 Cb 1.19 -0.12 -0.13 0.00 -0.31 0.00 0.00 62.40 63.02 2kmk h SER 70 CO 0.62 0.87 0.35 0.28 -0.87 0.00 0.00 176.83 178.08 2kmk h SER 71 N 0.01 0.23 0.23 4.97 0.02 -1.97 2.81 113.55 119.85 2kmk h SER 71 Ca 0.02 0.17 -0.12 0.00 -0.84 0.00 0.00 61.79 61.02 2kmk h SER 71 Cb 0.77 0.18 -0.01 0.00 0.14 0.00 0.00 62.40 63.47 2kmk h SER 71 CO 0.05 -0.06 -0.45 -1.13 -1.14 0.00 0.00 176.83 174.09 2kmk h ASN 72 N 0.33 0.29 0.43 3.07 -0.73 -1.91 0.39 115.58 117.45 2kmk h ASN 72 Ca 0.57 -0.13 -0.02 0.00 1.87 0.00 0.00 56.30 58.58 2kmk h ASN 72 Cb 1.11 -0.08 0.00 0.00 0.27 0.00 0.00 38.32 39.62 2kmk h ASN 72 CO -0.57 0.71 -0.20 0.25 -0.37 0.00 0.00 177.43 177.24 2kmk h LEU 73 N 0.22 -0.49 -0.75 0.34 5.85 0.53 0.44 115.31 121.46 2kmk h LEU 73 Ca 0.02 -0.09 0.10 0.00 0.84 0.00 0.00 57.88 58.74 2kmk h LEU 73 Cb 0.89 0.13 -0.12 0.00 0.37 0.00 0.00 40.66 41.93 2kmk h LEU 73 CO 0.07 -0.07 -0.48 0.40 -0.34 0.00 0.00 178.44 178.02 2kmk h ILE 74 N -1.02 0.04 -0.83 4.05 2.04 0.30 1.09 117.51 123.17 2kmk h ILE 74 Ca -0.06 0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.82 2kmk h ILE 74 Cb 0.55 0.04 -0.05 0.00 -0.74 0.00 0.00 36.82 36.62 2kmk h ILE 74 CO 0.10 0.00 0.54 0.74 0.00 0.00 0.00 178.15 179.53 2kmk h THR 75 N -0.15 1.16 -0.63 -0.27 2.02 -0.93 0.63 112.91 114.75 2kmk h THR 75 Ca 0.19 -0.37 0.01 0.00 0.77 0.00 0.00 66.41 67.01 2kmk h THR 75 Cb 0.53 -0.01 -0.03 0.00 -1.74 0.00 0.00 68.15 66.91 2kmk h THR 75 CO -0.80 0.20 0.42 -0.74 0.37 0.00 0.00 175.52 174.97 2kmk h HIS 76 N 1.08 0.79 -0.31 3.16 -0.00 0.21 -1.07 115.15 119.01 2kmk h HIS 76 Ca 0.32 0.02 -0.12 0.00 -0.00 0.00 0.00 60.37 60.59 2kmk h HIS 76 Cb -0.05 -0.27 -0.01 0.00 -0.00 0.00 0.00 27.41 27.08 2kmk h HIS 76 CO -0.02 0.50 -0.29 1.03 -0.00 0.00 0.00 177.93 179.14 2kmk h SER 77 N 0.85 0.66 -0.94 3.26 0.87 0.20 -2.22 113.55 116.24 2kmk h SER 77 Ca 0.23 -0.26 0.12 0.00 -1.23 0.00 0.00 61.79 60.66 2kmk h SER 77 Cb -0.09 -0.18 -0.08 0.00 -0.44 0.00 0.00 62.40 61.61 2kmk h SER 77 CO -0.05 0.92 0.60 0.03 -0.53 0.00 0.00 176.83 177.80 2kmk h ARG 78 N 0.55 0.84 -0.42 2.24 3.08 0.14 0.60 114.38 121.42 2kmk h ARG 78 Ca 0.07 -0.05 -0.05 0.00 0.07 0.00 0.00 59.98 60.02 2kmk h ARG 78 Cb 0.78 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 30.63 2kmk h ARG 78 CO 0.06 0.56 0.08 0.87 -1.07 0.00 0.00 179.97 180.47 2kmk h LYS 79 N 0.87 0.69 -0.49 0.04 1.57 -0.67 -0.97 116.57 117.61 2kmk h LYS 79 Ca 0.46 -0.18 -0.02 0.00 -1.87 0.00 0.00 60.65 59.05 2kmk h LYS 79 Cb 0.55 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.75 2kmk h LYS 79 CO -0.22 0.72 0.25 0.45 -0.57 0.00 0.00 179.45 180.07 2kmk h HIS 80 N 0.56 0.70 0.00 -1.35 3.86 -0.44 -3.00 115.15 115.48 2kmk h HIS 80 Ca 0.13 -0.03 0.03 0.00 -1.16 0.00 0.00 60.37 59.34 2kmk h HIS 80 Cb 0.36 -0.22 -0.05 0.00 1.06 0.00 0.00 27.41 28.55 2kmk h HIS 80 CO 0.02 0.54 -0.41 1.15 0.86 0.00 0.00 177.93 180.10 2kmk h THR 81 N 0.65 0.17 0.00 2.45 2.02 0.54 -3.52 112.91 115.22 2kmk h THR 81 Ca 0.17 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.35 2kmk h THR 81 Cb 0.10 0.17 0.00 0.00 -1.74 0.00 0.00 68.15 66.68 2kmk h THR 81 CO -0.02 0.00 0.00 0.61 0.37 0.00 0.00 175.52 176.48