#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 3.34 -0.21 0.66 0.08 -0.58 -4.97 117.98 116.31 2kmk s PHE 2 Ca 0.00 0.22 -0.03 0.00 0.12 0.00 0.00 56.93 57.25 2kmk s PHE 2 Cb 0.00 -2.16 -0.00 0.00 -0.57 0.00 0.00 43.02 40.28 2kmk s PHE 2 CO 0.00 0.19 -0.08 0.16 -0.10 0.00 0.00 175.22 175.39 2kmk s ASP 3 N 0.54 4.04 0.03 1.36 -4.77 -1.26 -0.38 116.67 116.24 2kmk s ASP 3 Ca 0.07 -0.44 -0.35 0.00 -3.30 0.00 0.00 52.55 48.52 2kmk s ASP 3 Cb -0.12 -1.68 -0.14 0.00 -1.09 0.00 0.00 42.92 39.89 2kmk s ASP 3 CO 0.00 -0.00 1.61 0.00 0.70 0.00 0.00 175.17 177.48 2kmk h LYS 5 N 6.47 0.00 0.00 0.00 6.56 -1.96 -3.01 116.57 124.63 2kmk h LYS 5 Ca -0.47 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.12 2kmk h LYS 5 Cb 1.29 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.95 2kmk h LYS 5 CO 0.88 0.00 0.00 -0.89 -2.06 0.00 0.00 179.45 177.38 2kmk n ILE 6 N -2.48 0.00 0.01 1.86 2.08 -1.26 -4.50 119.36 115.07 2kmk n ILE 6 Ca 0.03 0.47 -0.11 0.00 0.56 0.00 0.00 62.75 63.69 2kmk n ILE 6 Cb 0.49 -1.22 -0.14 0.00 -0.75 0.00 0.00 39.64 38.02 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 1.58 0.65 3.63 0.00 0.00 -1.13 -5.09 105.19 104.83 2kmk n GLY 8 Ca -0.15 -0.33 -0.24 0.00 0.00 0.00 0.00 46.02 45.29 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 -0.84 2.10 0.10 1.61 1.02 -1.25 -4.88 119.74 117.60 2kmk s LYS 9 Ca 0.00 -1.72 0.08 0.00 0.02 0.00 0.00 55.97 54.35 2kmk s LYS 9 Cb 0.00 -1.95 -0.04 0.00 -0.52 0.00 0.00 37.83 35.32 2kmk s LYS 9 CO 0.00 0.15 -0.17 -1.54 -0.92 0.00 0.00 175.35 172.87 2kmk s SER 10 N -3.72 3.96 -0.06 2.83 1.04 -1.26 -0.85 113.70 115.64 2kmk s SER 10 Ca 0.35 -0.51 0.02 0.00 0.48 0.00 0.00 55.95 56.29 2kmk s SER 10 Cb -0.01 -0.60 0.01 0.00 0.10 0.00 0.00 66.02 65.52 2kmk s SER 10 CO 0.19 0.19 -0.11 -0.36 0.98 0.00 0.00 173.24 174.13 2kmk s PHE 11 N -1.12 1.40 0.00 5.02 0.40 0.49 -4.97 117.98 119.21 2kmk s PHE 11 Ca 0.18 -0.51 0.26 0.00 -0.60 0.00 0.00 56.93 56.25 2kmk s PHE 11 Cb -0.11 -1.04 0.88 0.00 0.51 0.00 0.00 43.02 43.26 2kmk s PHE 11 CO 0.10 -0.28 1.80 0.87 0.70 0.00 0.00 175.22 178.42 2kmk h LYS 12 N 7.02 0.00 -5.42 0.44 1.57 -1.97 -1.54 116.57 116.67 2kmk h LYS 12 Ca -0.31 0.00 -0.66 0.00 -1.87 0.00 0.00 60.65 57.81 2kmk h LYS 12 Cb 1.18 0.00 -0.26 0.00 0.08 0.00 0.00 32.23 33.23 2kmk h LYS 12 CO 0.47 0.15 -0.76 1.03 -0.57 0.00 0.00 179.45 179.77 2kmk s ARG 13 N -3.52 3.32 0.46 3.15 3.00 -1.26 -4.76 118.95 119.34 2kmk s ARG 13 Ca 0.02 -0.67 0.13 0.00 0.00 0.00 0.00 55.73 55.21 2kmk s ARG 13 Cb 0.09 -2.63 1.07 0.00 0.00 0.00 0.00 34.95 33.47 2kmk s ARG 13 CO 0.62 0.26 2.06 0.66 0.00 0.00 0.00 175.30 178.91 2kmk h SER 14 N 6.56 0.27 -0.61 0.23 4.64 -1.97 -0.90 113.55 121.77 2kmk h SER 14 Ca -0.28 -0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 60.97 2kmk h SER 14 Cb 1.21 -0.06 -0.02 0.00 -0.31 0.00 0.00 62.40 63.21 2kmk h SER 14 CO 0.56 0.18 0.14 0.77 -0.87 0.00 0.00 176.83 177.61 2kmk h SER 15 N 0.31 0.93 -0.06 4.97 4.64 -1.96 0.55 113.55 122.92 2kmk h SER 15 Ca 0.15 -0.24 -0.07 0.00 -0.47 0.00 0.00 61.79 61.16 2kmk h SER 15 Cb 0.20 -0.25 -0.01 0.00 -0.31 0.00 0.00 62.40 62.03 2kmk h SER 15 CO -0.03 0.93 -0.14 0.71 -0.87 0.00 0.00 176.83 177.42 2kmk h THR 16 N 0.89 1.22 -0.12 2.95 1.35 -1.59 -0.63 112.91 116.97 2kmk h THR 16 Ca 0.19 -0.97 -0.19 0.00 -0.55 0.00 0.00 66.41 64.89 2kmk h THR 16 Cb 0.37 1.20 -0.00 0.00 -1.73 0.00 0.00 68.15 67.99 2kmk h THR 16 CO 0.00 0.31 -0.69 0.25 -0.25 0.00 0.00 175.52 175.15 2kmk h LEU 17 N 0.36 0.62 0.77 3.87 5.85 -0.73 -2.09 115.31 123.95 2kmk h LEU 17 Ca 0.07 -0.38 -0.03 0.00 0.84 0.00 0.00 57.88 58.37 2kmk h LEU 17 Cb 0.47 -0.18 -0.00 0.00 0.37 0.00 0.00 40.66 41.32 2kmk h LEU 17 CO 0.03 1.13 -0.48 -1.28 -0.34 0.00 0.00 178.44 177.50 2kmk h SER 18 N 0.37 -1.21 -0.97 1.25 0.87 0.15 0.95 113.55 114.96 2kmk h SER 18 Ca -0.02 0.07 0.16 0.00 -1.23 0.00 0.00 61.79 60.77 2kmk h SER 18 Cb 1.27 0.36 -0.10 0.00 -0.44 0.00 0.00 62.40 63.48 2kmk h SER 18 CO 0.13 -0.73 0.58 0.74 -0.53 0.00 0.00 176.83 177.02 2kmk h THR 19 N -1.17 0.77 -0.32 2.23 2.02 -1.29 0.37 112.91 115.52 2kmk h THR 19 Ca -0.10 -0.27 -0.02 0.00 0.77 0.00 0.00 66.41 66.78 2kmk h THR 19 Cb 0.94 -0.10 -0.01 0.00 -1.74 0.00 0.00 68.15 67.23 2kmk h THR 19 CO 0.10 0.15 0.12 -0.74 0.37 0.00 0.00 175.52 175.52 2kmk h HIS 20 N 0.80 0.48 -0.28 3.16 6.17 -0.75 0.76 115.15 125.50 2kmk h HIS 20 Ca 0.53 -0.04 0.04 0.00 0.71 0.00 0.00 60.37 61.62 2kmk h HIS 20 Cb 0.73 -0.14 -0.01 0.00 2.52 0.00 0.00 27.41 30.51 2kmk h HIS 20 CO -0.02 0.47 0.19 -0.07 0.71 0.00 0.00 177.93 179.20 2kmk h LEU 21 N 0.36 0.15 -1.27 0.26 3.38 0.41 0.79 115.31 119.38 2kmk h LEU 21 Ca 0.10 -0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.03 2kmk h LEU 21 Cb 0.19 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 2kmk h LEU 21 CO -0.01 0.10 -0.22 -0.07 0.09 0.00 0.00 178.44 178.33 2kmk h LEU 22 N 0.18 0.00 -0.94 1.67 3.38 0.17 0.17 115.31 119.94 2kmk h LEU 22 Ca 0.12 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.99 2kmk h LEU 22 Cb 0.26 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 2kmk h LEU 22 CO -0.02 0.22 -0.35 0.40 0.09 0.00 0.00 178.44 178.78 2kmk h ILE 23 N 0.00 1.29 0.21 1.22 2.04 0.26 1.13 117.51 123.66 2kmk h ILE 23 Ca -0.00 -1.42 -0.32 0.00 1.00 0.00 0.00 64.86 64.12 2kmk h ILE 23 Cb 0.67 1.56 0.02 0.00 -0.74 0.00 0.00 36.82 38.34 2kmk h ILE 23 CO 0.03 0.43 -1.44 0.45 0.00 0.00 0.00 178.15 177.62 2kmk h HIS 24 N 0.28 0.80 -0.00 1.37 3.86 -1.00 -3.19 115.15 117.27 2kmk h HIS 24 Ca 0.03 -0.59 0.00 0.00 -1.16 0.00 0.00 60.37 58.66 2kmk h HIS 24 Cb 0.76 -0.03 0.00 0.00 1.06 0.00 0.00 27.41 29.20 2kmk h HIS 24 CO 0.02 1.49 -0.09 0.43 0.86 0.00 0.00 177.93 180.64 2kmk n SER 25 N -3.64 0.54 -3.94 2.45 7.64 -0.03 -4.92 113.62 111.72 2kmk n SER 25 Ca -0.15 -0.74 -0.27 0.00 1.01 0.00 0.00 58.87 58.72 2kmk n SER 25 Cb 1.08 -0.05 -0.02 0.00 -1.01 0.00 0.00 64.21 64.21 2kmk n SER 25 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2kmk n ASP 26 N -0.82 -0.86 -4.73 6.43 8.00 0.38 -4.92 116.55 120.03 2kmk n ASP 26 Ca 0.16 -1.03 -0.38 0.00 0.71 0.00 0.00 54.79 54.25 2kmk n ASP 26 Cb 0.27 -3.00 -0.06 0.00 -0.02 0.00 0.00 41.12 38.31 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 -3.92 5.16 -0.43 -3.53 2.01 -0.85 -5.01 115.64 109.08 2kmk s THR 27 Ca 0.06 0.98 0.06 0.00 0.31 0.00 0.00 61.69 63.10 2kmk s THR 27 Cb -0.03 -3.83 0.20 0.00 0.01 0.00 0.00 72.50 68.86 2kmk s THR 27 CO 0.89 0.34 0.50 0.54 -0.69 0.00 0.00 174.62 176.20 2kmk n ARG 28 N 3.55 0.45 0.00 4.92 1.74 -1.26 -4.38 116.66 121.68 2kmk n ARG 28 Ca -0.07 -2.88 0.00 0.00 -0.77 0.00 0.00 57.85 54.13 2kmk n ARG 28 Cb 0.52 -1.48 0.00 0.00 -1.02 0.00 0.00 32.46 30.47 2kmk n ARG 28 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 2kmk n PRO 29 N 2.31 0.67 -3.77 5.56 -0.04 -1.20 -4.31 135.00 134.22 2kmk n PRO 29 Ca 0.24 0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 63.37 2kmk n PRO 29 Cb 0.52 -1.01 -0.09 0.00 -0.04 0.00 0.00 33.50 32.88 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 -1.98 3.68 -0.08 0.54 2.02 -0.89 -5.00 117.35 115.66 2kmk s TYR 30 Ca 0.00 -3.14 -0.30 0.00 -0.37 0.00 0.00 57.07 53.26 2kmk s TYR 30 Cb 0.00 -3.00 -0.02 0.00 -0.40 0.00 0.00 41.96 38.54 2kmk s TYR 30 CO 0.00 -0.67 1.05 -1.25 -1.57 0.00 0.00 175.55 173.12 2kmk s PRO 31 N -1.23 4.42 0.36 -1.71 0.04 -1.26 -0.84 135.00 134.78 2kmk s PRO 31 Ca 0.25 1.47 -0.25 0.00 0.04 0.00 0.00 61.00 62.51 2kmk s PRO 31 Cb -0.08 -3.53 -0.13 0.00 0.04 0.00 0.00 34.50 30.80 2kmk s PRO 31 CO -0.13 -0.31 0.80 0.00 0.04 0.00 0.00 177.00 177.40 2kmk n GLN 33 N 0.57 0.10 0.00 0.00 -0.06 -1.26 -3.95 117.38 112.77 2kmk n GLN 33 Ca 0.11 0.06 0.00 0.00 -2.00 0.00 0.00 57.00 55.17 2kmk n GLN 33 Cb 0.36 -1.60 0.00 0.00 -4.06 0.00 0.00 30.24 24.94 2kmk n GLN 33 CO 0.00 0.00 0.00 0.66 -0.20 0.00 0.00 177.06 177.52 2kmk n TYR 34 N -1.76 0.00 0.11 3.69 4.01 -1.26 -4.86 117.16 117.09 2kmk n TYR 34 Ca 0.06 0.00 -0.01 0.00 -0.16 0.00 0.00 57.90 57.78 2kmk n TYR 34 Cb 0.37 0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.39 2kmk n TYR 34 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2kmk n GLY 36 N 1.18 0.70 3.57 0.00 0.00 -1.25 -5.02 105.19 104.35 2kmk n GLY 36 Ca 0.01 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.67 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 -1.51 0.44 -5.11 1.61 5.02 -1.26 -4.15 118.16 113.20 2kmk n LYS 37 Ca 0.00 0.20 -0.32 0.00 -2.02 0.00 0.00 58.31 56.17 2kmk n LYS 37 Cb 0.00 -2.09 -0.15 0.00 -0.02 0.00 0.00 35.03 32.77 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 -3.15 2.39 0.28 1.97 0.52 -1.26 0.50 118.95 120.21 2kmk s ARG 38 Ca 0.71 -0.82 0.12 0.00 -0.52 0.00 0.00 55.73 55.22 2kmk s ARG 38 Cb -0.35 -2.22 -0.05 0.00 0.52 0.00 0.00 34.95 32.85 2kmk s ARG 38 CO 0.53 0.55 -0.19 -0.06 0.02 0.00 0.00 175.30 176.15 2kmk s PHE 39 N -0.56 2.29 -1.46 -0.53 0.40 -0.02 -4.96 117.98 113.13 2kmk s PHE 39 Ca 0.08 -0.35 0.22 0.00 -0.60 0.00 0.00 56.93 56.27 2kmk s PHE 39 Cb -0.11 -1.03 -0.12 0.00 0.51 0.00 0.00 43.02 42.27 2kmk s PHE 39 CO 0.01 0.70 0.99 -2.39 0.70 0.00 0.00 175.22 175.22 2kmk n HIS 40 N -0.63 0.00 -3.83 0.36 1.44 -1.26 -2.09 115.22 109.21 2kmk n HIS 40 Ca -0.05 0.00 -0.29 0.00 -2.01 0.00 0.00 57.72 55.37 2kmk n HIS 40 Cb 0.60 -0.00 -0.16 0.00 0.12 0.00 0.00 29.99 30.55 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 -2.77 1.09 0.00 -1.40 -0.21 -1.26 -4.84 119.66 110.28 2kmk s GLN 41 Ca 0.13 -0.73 0.00 0.00 0.02 0.00 0.00 55.36 54.77 2kmk s GLN 41 Cb 0.17 -2.33 0.00 0.00 1.00 0.00 0.00 33.01 31.85 2kmk s GLN 41 CO 0.74 -0.65 0.18 1.17 -2.12 0.00 0.00 175.29 174.61 2kmk n LYS 42 N 4.86 0.00 -0.62 2.91 4.81 -1.26 0.19 118.16 129.05 2kmk n LYS 42 Ca -0.10 0.18 0.47 0.00 -0.87 0.00 0.00 58.31 58.00 2kmk n LYS 42 Cb 0.45 -0.43 0.73 0.00 0.02 0.00 0.00 35.03 35.80 2kmk n LYS 42 CO 0.00 0.00 0.00 0.43 1.17 0.00 0.00 177.40 179.00 2kmk n SER 43 N -0.56 0.01 0.02 3.14 7.64 -1.26 0.33 113.62 122.94 2kmk n SER 43 Ca 0.00 0.91 -0.11 0.00 1.01 0.00 0.00 58.87 60.68 2kmk n SER 43 Cb 0.00 -0.45 0.03 0.00 -1.01 0.00 0.00 64.21 62.77 2kmk n SER 43 CO 0.00 0.00 0.00 -0.78 -3.01 0.00 0.00 175.04 171.25 2kmk h ASP 44 N 0.00 0.61 -0.08 6.43 3.58 0.17 -0.43 116.42 126.71 2kmk h ASP 44 Ca 0.84 -0.37 -0.05 0.00 0.42 0.00 0.00 57.03 57.87 2kmk h ASP 44 Cb 3.33 -0.18 0.00 0.00 1.72 0.00 0.00 39.33 44.20 2kmk h ASP 44 CO -0.04 1.10 -0.15 -0.03 -2.88 0.00 0.00 179.24 177.24 2kmk h MET 45 N 0.39 0.24 -1.00 0.28 4.05 0.63 -2.09 114.93 117.42 2kmk h MET 45 Ca -0.01 -0.15 0.21 0.00 -0.28 0.00 0.00 59.70 59.46 2kmk h MET 45 Cb 1.21 0.02 -0.10 0.00 -0.80 0.00 0.00 31.60 31.93 2kmk h MET 45 CO 0.12 0.74 0.62 -0.22 0.23 0.00 0.00 176.91 178.39 2kmk h LYS 46 N -0.23 0.64 -0.36 0.39 1.63 -0.74 3.35 116.57 121.24 2kmk h LYS 46 Ca 0.00 -0.04 -0.06 0.00 -0.85 0.00 0.00 60.65 59.71 2kmk h LYS 46 Cb 0.73 -0.14 -0.02 0.00 -0.60 0.00 0.00 32.23 32.20 2kmk h LYS 46 CO 0.03 0.42 -0.01 0.87 -3.45 0.00 0.00 179.45 177.31 2kmk h LYS 47 N 0.65 0.58 0.34 1.90 1.57 -0.82 0.25 116.57 121.04 2kmk h LYS 47 Ca 0.58 -0.13 -0.02 0.00 -1.87 0.00 0.00 60.65 59.21 2kmk h LYS 47 Cb 1.06 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 33.29 2kmk h LYS 47 CO -0.37 0.61 -0.16 1.25 -0.57 0.00 0.00 179.45 180.21 2kmk h HIS 48 N 0.55 -0.42 -1.52 -1.35 2.76 0.65 -1.84 115.15 113.98 2kmk h HIS 48 Ca 0.11 -0.01 0.47 0.00 -2.20 0.00 0.00 60.37 58.74 2kmk h HIS 48 Cb 0.37 0.14 -0.10 0.00 1.55 0.00 0.00 27.41 29.37 2kmk h HIS 48 CO 0.01 -0.26 1.04 1.79 -1.30 0.00 0.00 177.93 179.21 2kmk h THR 49 N -0.57 0.12 0.00 6.26 1.35 0.70 2.88 112.91 123.65 2kmk h THR 49 Ca -0.05 -0.02 -0.09 0.00 -0.55 0.00 0.00 66.41 65.70 2kmk h THR 49 Cb 0.35 0.07 -0.01 0.00 -1.73 0.00 0.00 68.15 66.82 2kmk h THR 49 CO 0.08 0.01 -0.45 -0.26 -0.25 0.00 0.00 175.52 174.65 2kmk h PHE 50 N 0.05 0.00 0.00 4.73 -1.00 -0.08 -1.74 116.94 118.91 2kmk h PHE 50 Ca 0.83 0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.61 2kmk h PHE 50 Cb 2.93 0.00 0.00 0.00 3.61 0.00 0.00 35.95 42.49 2kmk h PHE 50 CO -0.00 0.45 0.00 -0.84 -1.61 0.00 0.00 178.31 176.30 2kmk h ILE 51 N 0.00 0.00 0.00 -0.55 3.07 0.60 0.23 117.51 120.87 2kmk h ILE 51 Ca -0.00 -0.56 -0.29 0.00 1.55 0.00 0.00 64.86 65.55 2kmk h ILE 51 Cb 0.93 1.50 -0.05 0.00 -0.27 0.00 0.00 36.82 38.93 2kmk h ILE 51 CO 0.06 0.00 -1.66 0.45 -1.05 0.00 0.00 178.15 175.95 2kmk h HIS 52 N 0.00 0.01 0.00 0.16 3.86 -1.01 -3.32 115.15 114.86 2kmk h HIS 52 Ca 0.00 -0.01 -0.06 0.00 -1.16 0.00 0.00 60.37 59.14 2kmk h HIS 52 Cb 0.66 -0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.12 2kmk h HIS 52 CO 0.00 1.02 -0.27 1.79 0.86 0.00 0.00 177.93 181.33 2kmk h THR 53 N 0.00 0.51 0.00 2.45 1.35 -1.12 -3.47 112.91 112.64 2kmk h THR 53 Ca -0.27 -1.52 0.00 0.00 -0.55 0.00 0.00 66.41 64.08 2kmk h THR 53 Cb 2.00 2.09 0.00 0.00 -1.73 0.00 0.00 68.15 70.51 2kmk h THR 53 CO 0.08 0.27 0.00 0.61 -0.25 0.00 0.00 175.52 176.23 2kmk n GLY 54 N 0.84 0.81 3.69 5.82 0.00 -0.33 -5.03 105.19 110.99 2kmk n GLY 54 Ca 0.02 -0.54 -0.40 0.00 0.00 0.00 0.00 46.02 45.10 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 -1.43 4.37 -0.44 1.61 2.02 0.67 -4.99 118.70 120.51 2kmk s GLU 55 Ca 0.00 0.93 0.05 0.00 0.02 0.00 0.00 54.97 55.97 2kmk s GLU 55 Cb 0.00 -3.51 0.18 0.00 0.10 0.00 0.00 34.13 30.90 2kmk s GLU 55 CO 0.00 -0.11 0.38 1.63 0.02 0.00 0.00 175.26 177.18 2kmk n LYS 56 N 4.42 0.43 0.09 1.61 5.02 -1.26 -4.55 118.16 123.92 2kmk n LYS 56 Ca 0.01 -3.33 0.09 0.00 -2.02 0.00 0.00 58.31 53.07 2kmk n LYS 56 Cb 0.50 -1.69 0.41 0.00 -0.02 0.00 0.00 35.03 34.23 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 2.58 0.12 -3.19 1.97 -0.02 -1.24 -4.27 135.00 130.95 2kmk n PRO 57 Ca 0.28 0.42 -0.46 0.00 -2.02 0.00 0.00 63.50 61.72 2kmk n PRO 57 Cb 0.47 -1.75 -0.03 0.00 -0.02 0.00 0.00 33.50 32.17 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 -3.24 3.48 -0.24 6.00 3.76 -0.80 -4.97 115.29 119.28 2kmk s HIS 58 Ca 0.03 -1.69 -0.17 0.00 -0.15 0.00 0.00 55.06 53.08 2kmk s HIS 58 Cb 0.08 -3.98 -0.03 0.00 1.11 0.00 0.00 32.58 29.76 2kmk s HIS 58 CO 0.29 -1.17 0.48 0.15 -0.85 0.00 0.00 174.74 173.63 2kmk s LYS 59 N 1.21 4.11 -0.10 1.40 1.02 -1.26 -0.03 119.74 126.09 2kmk s LYS 59 Ca 0.21 0.29 -0.30 0.00 0.02 0.00 0.00 55.97 56.19 2kmk s LYS 59 Cb -0.11 -3.61 -0.03 0.00 -0.52 0.00 0.00 37.83 33.57 2kmk s LYS 59 CO -0.07 -0.23 1.35 0.00 -0.92 0.00 0.00 175.35 175.48 2kmk n GLN 61 N 6.29 1.35 -0.07 0.00 1.13 -1.26 -2.25 117.38 122.57 2kmk n GLN 61 Ca 0.14 -0.54 -0.06 0.00 -1.94 0.00 0.00 57.00 54.60 2kmk n GLN 61 Cb 0.44 -1.20 -0.02 0.00 0.11 0.00 0.00 30.24 29.58 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 1.43 0.32 5.09 0.31 -1.26 -4.75 118.33 119.35 2kmk n VAL 62 Ca 0.09 0.20 0.05 0.00 -0.01 0.00 0.00 64.34 64.66 2kmk n VAL 62 Cb 0.15 -2.37 -0.06 0.00 -0.91 0.00 0.00 33.84 30.65 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 1.41 0.91 3.92 0.00 0.00 -0.95 -5.09 105.19 105.39 2kmk n GLY 64 Ca 0.01 -0.05 -0.26 0.00 0.00 0.00 0.00 46.02 45.72 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 -0.71 2.65 0.03 1.61 2.20 -1.26 -4.85 119.74 119.41 2kmk s LYS 65 Ca 0.00 -0.12 0.04 0.00 -0.36 0.00 0.00 55.97 55.53 2kmk s LYS 65 Cb 0.00 -2.24 -0.02 0.00 -1.51 0.00 0.00 37.83 34.06 2kmk s LYS 65 CO 0.00 -0.89 -0.11 0.00 -0.36 0.00 0.00 175.35 173.99 2kmk s ALA 66 N -3.07 0.89 0.06 3.13 0.00 -1.26 -1.37 121.76 120.13 2kmk s ALA 66 Ca 0.56 -0.66 0.06 0.00 0.00 0.00 0.00 51.96 51.92 2kmk s ALA 66 Cb -0.11 -0.13 -0.03 0.00 0.00 0.00 0.00 23.12 22.85 2kmk s ALA 66 CO 0.45 0.16 -0.16 -0.06 0.00 0.00 0.00 175.76 176.14 2kmk s PHE 67 N -0.74 1.41 0.14 0.00 0.08 0.96 -4.98 117.98 114.85 2kmk s PHE 67 Ca -0.00 -0.39 -0.06 0.00 0.12 0.00 0.00 56.93 56.60 2kmk s PHE 67 Cb -0.07 -0.82 -0.06 0.00 -0.57 0.00 0.00 43.02 41.51 2kmk s PHE 67 CO 0.01 0.07 1.35 0.77 -0.10 0.00 0.00 175.22 177.32 2kmk h SER 68 N 4.67 0.64 -4.15 1.36 0.02 -1.85 -2.14 113.55 112.10 2kmk h SER 68 Ca -0.41 -0.45 -0.69 0.00 -0.84 0.00 0.00 61.79 59.40 2kmk h SER 68 Cb 1.18 -0.19 -0.24 0.00 0.14 0.00 0.00 62.40 63.28 2kmk h SER 68 CO 0.42 1.23 -0.81 -1.10 -1.14 0.00 0.00 176.83 175.43 2kmk s GLN 69 N -3.53 2.27 0.24 3.45 -0.21 -1.26 -4.71 119.66 115.90 2kmk s GLN 69 Ca -0.07 -0.84 -0.07 0.00 0.02 0.00 0.00 55.36 54.40 2kmk s GLN 69 Cb 0.09 -2.24 0.25 0.00 1.00 0.00 0.00 33.01 32.11 2kmk s GLN 69 CO 0.87 0.58 1.91 0.66 -2.12 0.00 0.00 175.29 177.19 2kmk h SER 70 N 5.12 1.05 -0.93 5.90 4.64 -1.96 -1.59 113.55 125.78 2kmk h SER 70 Ca -0.46 -0.02 0.23 0.00 -0.47 0.00 0.00 61.79 61.06 2kmk h SER 70 Cb 1.15 -0.25 -0.12 0.00 -0.31 0.00 0.00 62.40 62.86 2kmk h SER 70 CO 0.49 0.75 0.45 -1.28 -0.87 0.00 0.00 176.83 176.36 2kmk h SER 71 N 1.23 0.43 0.83 4.97 0.87 -1.98 1.65 113.55 121.56 2kmk h SER 71 Ca 0.35 0.15 -0.17 0.00 -1.23 0.00 0.00 61.79 60.89 2kmk h SER 71 Cb -0.10 0.10 -0.02 0.00 -0.44 0.00 0.00 62.40 61.94 2kmk h SER 71 CO -0.09 0.03 -0.79 0.78 -0.53 0.00 0.00 176.83 176.23 2kmk h ASN 72 N 0.45 0.00 0.28 6.23 4.21 -1.73 -2.07 115.58 122.94 2kmk h ASN 72 Ca 0.58 0.00 -0.01 0.00 1.21 0.00 0.00 56.30 58.08 2kmk h ASN 72 Cb 1.11 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.31 2kmk h ASN 72 CO -0.51 0.79 -0.13 0.25 -1.29 0.00 0.00 177.43 176.53 2kmk h LEU 73 N 0.00 -0.31 -0.64 1.61 5.85 0.14 0.18 115.31 122.14 2kmk h LEU 73 Ca -0.01 -0.22 0.12 0.00 0.84 0.00 0.00 57.88 58.62 2kmk h LEU 73 Cb 1.42 0.08 -0.12 0.00 0.37 0.00 0.00 40.66 42.41 2kmk h LEU 73 CO 0.10 0.15 -0.26 0.40 -0.34 0.00 0.00 178.44 178.49 2kmk h ILE 74 N -0.89 0.23 -0.38 4.05 2.04 0.19 1.54 117.51 124.30 2kmk h ILE 74 Ca -0.04 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.82 2kmk h ILE 74 Cb 0.51 0.23 -0.02 0.00 -0.74 0.00 0.00 36.82 36.80 2kmk h ILE 74 CO 0.06 0.00 0.21 0.74 0.00 0.00 0.00 178.15 179.16 2kmk h THR 75 N -0.09 1.14 -0.58 -0.27 2.02 -1.34 0.33 112.91 114.12 2kmk h THR 75 Ca 0.28 -0.36 -0.07 0.00 0.77 0.00 0.00 66.41 67.03 2kmk h THR 75 Cb 0.53 0.69 -0.03 0.00 -1.74 0.00 0.00 68.15 67.61 2kmk h THR 75 CO -0.70 0.15 0.10 -0.74 0.37 0.00 0.00 175.52 174.70 2kmk h HIS 76 N 0.49 0.97 -0.08 3.16 -0.00 0.18 -1.37 115.15 118.50 2kmk h HIS 76 Ca 0.13 -0.12 -0.11 0.00 -0.00 0.00 0.00 60.37 60.28 2kmk h HIS 76 Cb 0.05 -0.28 -0.01 0.00 -0.00 0.00 0.00 27.41 27.17 2kmk h HIS 76 CO -0.03 0.83 -0.45 1.03 -0.00 0.00 0.00 177.93 179.31 2kmk h SER 77 N 0.88 0.20 -0.69 3.26 0.87 0.25 -2.10 113.55 116.22 2kmk h SER 77 Ca 0.18 -0.09 -0.05 0.00 -1.23 0.00 0.00 61.79 60.61 2kmk h SER 77 Cb 0.38 -0.06 -0.03 0.00 -0.44 0.00 0.00 62.40 62.25 2kmk h SER 77 CO 0.01 0.63 0.25 0.03 -0.53 0.00 0.00 176.83 177.22 2kmk h ARG 78 N 0.15 1.07 -0.58 2.24 2.47 0.69 0.97 114.38 121.38 2kmk h ARG 78 Ca 0.01 -0.20 0.00 0.00 -1.26 0.00 0.00 59.98 58.53 2kmk h ARG 78 Cb 0.86 -0.17 -0.03 0.00 -1.65 0.00 0.00 29.97 28.99 2kmk h ARG 78 CO 0.07 0.89 0.37 0.87 0.56 0.00 0.00 179.97 182.73 2kmk h LYS 79 N 1.04 0.78 -0.53 0.04 1.57 -0.65 2.26 116.57 121.08 2kmk h LYS 79 Ca 0.23 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.94 2kmk h LYS 79 Cb 0.24 -0.17 -0.03 0.00 0.08 0.00 0.00 32.23 32.35 2kmk h LYS 79 CO -0.01 0.54 0.28 0.45 -0.57 0.00 0.00 179.45 180.13 2kmk h HIS 80 N 0.79 0.72 -0.69 -1.35 3.86 -0.94 0.44 115.15 117.97 2kmk h HIS 80 Ca 0.21 -0.01 -0.20 0.00 -1.16 0.00 0.00 60.37 59.21 2kmk h HIS 80 Cb -0.06 -0.23 -0.12 0.00 1.06 0.00 0.00 27.41 28.06 2kmk h HIS 80 CO -0.03 0.51 0.25 2.41 0.86 0.00 0.00 177.93 181.94 2kmk n THR 81 N -4.39 2.74 -0.10 2.45 -1.04 0.41 -5.12 114.28 109.24 2kmk n THR 81 Ca 0.05 -1.48 0.00 0.00 -2.04 0.00 0.00 64.05 60.57 2kmk n THR 81 Cb 0.11 -0.39 0.00 0.00 -1.82 0.00 0.00 70.33 68.23 2kmk n THR 81 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04