#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kc5 n THR 2 N 0.00 -3.62 -1.05 2.03 -1.04 -1.26 -4.87 114.28 104.47 2kc5 n THR 2 Ca 0.00 -0.17 -0.16 0.00 -2.04 0.00 0.00 64.05 61.68 2kc5 n THR 2 Cb 0.00 -3.95 -0.05 0.00 -1.82 0.00 0.00 70.33 64.51 2kc5 n THR 2 CO 0.00 0.00 0.00 1.21 -0.64 0.00 0.00 175.07 175.64 2kc5 n GLU 3 N -4.67 1.91 -3.99 -2.82 2.13 -1.26 -4.86 120.64 107.09 2kc5 n GLU 3 Ca -0.08 -1.44 -0.08 0.00 0.66 0.00 0.00 57.16 56.22 2kc5 n GLU 3 Cb 0.59 -1.78 -0.09 0.00 0.27 0.00 0.00 31.44 30.43 2kc5 n GLU 3 CO 0.00 0.00 0.00 -1.21 -0.41 0.00 0.00 177.13 175.51 2kc5 s GLU 4 N -0.85 0.69 -0.10 5.31 2.02 -1.26 -1.18 118.70 123.33 2kc5 s GLU 4 Ca 0.43 -1.07 0.02 0.00 0.02 0.00 0.00 54.97 54.37 2kc5 s GLU 4 Cb 0.27 0.26 0.02 0.00 0.10 0.00 0.00 34.13 34.77 2kc5 s GLU 4 CO -0.07 -0.17 -0.14 0.42 0.02 0.00 0.00 175.26 175.31 2kc5 s ILE 5 N -3.76 1.39 0.45 -1.63 -1.09 0.37 -4.48 121.20 112.45 2kc5 s ILE 5 Ca 0.05 -0.58 -0.21 0.00 -2.23 0.00 0.00 60.65 57.68 2kc5 s ILE 5 Cb 0.06 -1.28 -0.10 0.00 -1.58 0.00 0.00 42.46 39.56 2kc5 s ILE 5 CO -0.10 0.42 0.98 0.00 -1.23 0.00 0.00 174.94 175.01 2kc5 s ALA 6 N 0.99 2.99 0.76 9.38 0.00 -1.26 -1.08 121.76 133.54 2kc5 s ALA 6 Ca -0.07 0.45 -0.13 0.00 0.00 0.00 0.00 51.96 52.21 2kc5 s ALA 6 Cb -0.15 -3.18 0.06 0.00 0.00 0.00 0.00 23.12 19.85 2kc5 s ALA 6 CO -0.01 -0.02 1.15 0.20 0.00 0.00 0.00 175.76 177.07 2kc5 s GLY 7 N -2.16 2.03 0.11 0.00 0.00 0.28 -4.90 107.32 102.68 2kc5 s GLY 7 Ca 0.63 0.62 0.07 0.00 0.00 0.00 0.00 44.72 46.05 2kc5 s GLY 7 CO 0.16 1.01 -0.09 -1.36 0.00 0.00 0.00 173.10 172.81 2kc5 s PHE 8 N -2.39 2.74 0.04 1.90 0.40 -0.45 -4.50 117.98 115.74 2kc5 s PHE 8 Ca 0.68 -0.16 0.10 0.00 -0.60 0.00 0.00 56.93 56.95 2kc5 s PHE 8 Cb -0.23 -1.42 -0.17 0.00 0.51 0.00 0.00 43.02 41.70 2kc5 s PHE 8 CO 0.49 0.44 1.17 1.96 0.70 0.00 0.00 175.22 179.98 2kc5 h GLN 9 N 3.51 0.00 0.00 0.44 7.50 -1.87 -2.34 115.11 122.34 2kc5 h GLN 9 Ca -0.49 0.00 -0.05 0.00 0.50 0.00 0.00 58.65 58.61 2kc5 h GLN 9 Cb 1.17 0.00 -0.00 0.00 0.05 0.00 0.00 27.48 28.70 2kc5 h GLN 9 CO 0.53 0.81 0.18 0.25 -1.50 0.00 0.00 178.83 179.09 2kc5 n THR 10 N -3.26 0.00 -1.71 -0.54 -2.24 -1.26 -4.87 114.28 100.41 2kc5 n THR 10 Ca -0.03 -0.87 -0.40 0.00 -2.27 0.00 0.00 64.05 60.48 2kc5 n THR 10 Cb 0.93 0.80 0.02 0.00 -2.10 0.00 0.00 70.33 69.98 2kc5 n THR 10 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2kc5 n SER 11 N -1.46 2.47 -3.05 3.42 7.64 -1.26 -4.86 113.62 116.51 2kc5 n SER 11 Ca -0.06 1.05 -0.23 0.00 1.01 0.00 0.00 58.87 60.63 2kc5 n SER 11 Cb 0.47 -1.52 -0.03 0.00 -1.01 0.00 0.00 64.21 62.12 2kc5 n SER 11 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 2kc5 n PRO 12 N -0.35 2.32 -0.08 1.43 -0.04 -1.26 -4.76 135.00 132.26 2kc5 n PRO 12 Ca 0.08 -1.50 -0.07 0.00 -0.04 0.00 0.00 63.50 61.97 2kc5 n PRO 12 Cb 0.42 -2.43 -0.01 0.00 -0.04 0.00 0.00 33.50 31.44 2kc5 n PRO 12 CO 0.00 0.00 0.00 -0.22 -0.04 0.00 0.00 175.50 175.24 2kc5 h LYS 13 N 5.68 -0.19 -0.58 0.54 3.64 -1.95 0.33 116.57 124.03 2kc5 h LYS 13 Ca 0.52 0.01 -0.06 0.00 -1.27 0.00 0.00 60.65 59.86 2kc5 h LYS 13 Cb 0.32 0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.16 2kc5 h LYS 13 CO 1.35 -0.13 0.13 0.00 -2.27 0.00 0.00 179.45 178.53 2kc5 h ALA 14 N 0.93 0.76 -0.36 5.00 0.00 -1.94 -1.05 119.26 122.60 2kc5 h ALA 14 Ca 0.16 -0.23 -0.17 0.00 0.00 0.00 0.00 54.91 54.68 2kc5 h ALA 14 Cb 0.46 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 2kc5 h ALA 14 CO -0.44 0.48 -0.42 1.96 0.00 0.00 0.00 179.25 180.82 2kc5 h GLN 15 N 0.83 0.92 -0.76 0.00 4.20 -1.76 -0.16 115.11 118.38 2kc5 h GLN 15 Ca 0.18 -0.50 -0.04 0.00 0.06 0.00 0.00 58.65 58.35 2kc5 h GLN 15 Cb 0.37 0.03 -0.03 0.00 0.30 0.00 0.00 27.48 28.14 2kc5 h GLN 15 CO 0.00 1.16 0.32 0.28 -0.67 0.00 0.00 178.83 179.92 2kc5 h VAL 16 N 0.74 1.25 0.22 -0.54 2.07 -0.85 -0.14 116.25 119.00 2kc5 h VAL 16 Ca 0.05 -0.77 -0.01 0.00 0.82 0.00 0.00 66.70 66.79 2kc5 h VAL 16 Cb 1.02 0.34 0.00 0.00 -1.52 0.00 0.00 31.29 31.14 2kc5 h VAL 16 CO 0.10 0.31 -0.10 -0.61 0.02 0.00 0.00 177.57 177.29 2kc5 h GLN 17 N 1.08 -0.28 -0.75 1.57 4.15 -0.72 -0.62 115.11 119.54 2kc5 h GLN 17 Ca 0.25 0.02 -0.05 0.00 0.77 0.00 0.00 58.65 59.65 2kc5 h GLN 17 Cb 0.18 0.06 -0.03 0.00 0.21 0.00 0.00 27.48 27.90 2kc5 h GLN 17 CO -0.02 -0.09 0.29 0.00 -1.93 0.00 0.00 178.83 177.08 2kc5 h ALA 18 N 0.34 1.10 0.04 3.38 0.00 -0.96 0.69 119.26 123.85 2kc5 h ALA 18 Ca -0.03 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.69 2kc5 h ALA 18 Cb 0.32 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.81 2kc5 h ALA 18 CO 0.05 0.64 -0.02 0.00 0.00 0.00 0.00 179.25 179.92 2kc5 h ALA 19 N 1.22 -0.05 0.00 0.00 0.00 -0.87 -1.85 119.26 117.72 2kc5 h ALA 19 Ca 0.25 -0.04 -0.12 0.00 0.00 0.00 0.00 54.91 54.99 2kc5 h ALA 19 Cb 0.22 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 2kc5 h ALA 19 CO -0.02 -0.49 -0.58 0.74 0.00 0.00 0.00 179.25 178.89 2kc5 h PHE 20 N -0.12 0.00 -0.53 0.00 0.04 -0.84 0.49 116.94 115.99 2kc5 h PHE 20 Ca -0.01 0.00 0.01 0.00 2.80 0.00 0.00 57.97 60.77 2kc5 h PHE 20 Cb 0.10 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.23 2kc5 h PHE 20 CO -0.05 0.58 0.35 1.49 -0.60 0.00 0.00 178.31 180.08 2kc5 h GLU 21 N 0.00 0.69 0.05 1.51 4.22 -0.73 0.35 114.58 120.68 2kc5 h GLU 21 Ca -0.01 -0.04 -0.00 0.00 0.08 0.00 0.00 59.36 59.39 2kc5 h GLU 21 Cb 1.07 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 30.17 2kc5 h GLU 21 CO 0.08 0.46 -0.02 1.49 -2.18 0.00 0.00 179.01 178.83 2kc5 h GLU 22 N 0.71 -0.06 -0.84 1.92 4.57 -0.45 -3.24 114.58 117.20 2kc5 h GLU 22 Ca 0.20 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.37 2kc5 h GLU 22 Cb -0.08 0.01 -0.04 0.00 -0.16 0.00 0.00 28.75 28.49 2kc5 h GLU 22 CO -0.04 0.57 0.48 0.82 -1.18 0.00 0.00 179.01 179.66 2kc5 h ILE 23 N -0.89 1.24 0.00 2.32 2.04 -0.86 0.25 117.51 121.61 2kc5 h ILE 23 Ca -0.01 -0.58 -0.02 0.00 1.00 0.00 0.00 64.86 65.26 2kc5 h ILE 23 Cb 0.66 0.09 -0.00 0.00 -0.74 0.00 0.00 36.82 36.82 2kc5 h ILE 23 CO 0.01 0.26 -0.08 0.00 0.00 0.00 0.00 178.15 178.34 2kc5 h ALA 24 N 1.35 1.27 0.00 1.87 0.00 -1.04 -0.88 119.26 121.83 2kc5 h ALA 24 Ca 0.30 -0.08 -0.37 0.00 0.00 0.00 0.00 54.91 54.76 2kc5 h ALA 24 Cb 0.00 -0.01 -0.07 0.00 0.00 0.00 0.00 17.79 17.71 2kc5 h ALA 24 CO -0.05 0.10 -2.39 -2.13 0.00 0.00 0.00 179.25 174.79 2kc5 n ARG 25 N -3.57 0.69 -0.23 0.00 0.63 -0.48 -4.01 116.66 109.69 2kc5 n ARG 25 Ca -0.02 -0.00 -0.06 0.00 -0.92 0.00 0.00 57.85 56.85 2kc5 n ARG 25 Cb 0.21 -1.52 0.04 0.00 0.45 0.00 0.00 32.46 31.63 2kc5 n ARG 25 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2kc5 h ARG 26 N 0.00 0.88 -6.31 -0.14 2.47 -0.35 -3.40 114.38 107.53 2kc5 h ARG 26 Ca -0.55 -0.09 -0.54 0.00 -1.26 0.00 0.00 59.98 57.54 2kc5 h ARG 26 Cb 2.24 -0.18 0.01 0.00 -1.65 0.00 0.00 29.97 30.38 2kc5 h ARG 26 CO 0.03 0.64 1.18 -1.12 0.56 0.00 0.00 179.97 181.26 2kc5 s SER 27 N -5.91 6.51 -0.10 7.04 0.01 -0.36 -4.90 113.70 116.00 2kc5 s SER 27 Ca -0.13 2.47 -0.29 0.00 1.31 0.00 0.00 55.95 59.31 2kc5 s SER 27 Cb 0.13 -2.53 -0.05 0.00 0.21 0.00 0.00 66.02 63.78 2kc5 s SER 27 CO 0.78 -1.03 1.76 -0.32 0.41 0.00 0.00 173.24 174.84 2kc5 s MET 28 N 4.34 3.95 0.12 12.44 1.75 -1.26 -4.80 119.30 135.83 2kc5 s MET 28 Ca 0.83 2.09 -0.01 0.00 -1.25 0.00 0.00 55.69 57.34 2kc5 s MET 28 Cb -0.39 -4.07 -0.04 0.00 2.84 0.00 0.00 34.83 33.17 2kc5 s MET 28 CO 0.37 -1.13 0.05 -1.01 -0.65 0.00 0.00 175.02 172.64 2kc5 s HIS 29 N 4.90 0.77 0.36 4.11 3.76 -1.26 -5.02 115.29 122.91 2kc5 s HIS 29 Ca 0.78 -1.18 0.03 0.00 -0.15 0.00 0.00 55.06 54.55 2kc5 s HIS 29 Cb -0.32 -0.44 0.68 0.00 1.11 0.00 0.00 32.58 33.60 2kc5 s HIS 29 CO 0.32 -0.50 2.01 0.22 -0.85 0.00 0.00 174.74 175.95 2kc5 h ASP 30 N 2.91 0.66 0.55 1.40 3.58 -1.99 -1.23 116.42 122.29 2kc5 h ASP 30 Ca -0.35 -0.02 0.00 0.00 0.42 0.00 0.00 57.03 57.08 2kc5 h ASP 30 Cb 1.19 -0.17 0.00 0.00 1.72 0.00 0.00 39.33 42.07 2kc5 h ASP 30 CO 0.60 0.49 0.00 0.17 -2.88 0.00 0.00 179.24 177.62 2kc5 h LEU 31 N 0.77 0.00 -1.28 2.28 8.10 -1.96 -3.03 115.31 120.19 2kc5 h LEU 31 Ca 0.21 0.00 -0.02 0.00 0.11 0.00 0.00 57.88 58.17 2kc5 h LEU 31 Cb -0.07 0.00 -0.00 0.00 -0.44 0.00 0.00 40.66 40.15 2kc5 h LEU 31 CO -0.04 0.00 -0.11 0.28 -4.11 0.00 0.00 178.44 174.46 2kc5 h SER 32 N 0.00 0.00 0.40 0.17 0.02 -1.50 0.01 113.55 112.65 2kc5 h SER 32 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2kc5 h SER 32 Cb 0.27 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.81 2kc5 h SER 32 CO 0.00 0.11 -0.60 0.49 -1.14 0.00 0.00 176.83 175.69 2kc5 n PHE 33 N -3.25 0.00 -0.47 3.45 3.72 -1.15 -4.36 117.46 115.40 2kc5 n PHE 33 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 2kc5 n PHE 33 Cb 0.36 -0.20 0.00 0.00 -0.94 0.00 0.00 39.48 38.70 2kc5 n PHE 33 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 2kc5 n LEU 34 N -1.50 0.93 -1.16 4.37 4.77 -0.82 -5.14 117.00 118.45 2kc5 n LEU 34 Ca 0.05 -0.93 0.11 0.00 -0.03 0.00 0.00 56.01 55.21 2kc5 n LEU 34 Cb 0.33 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.36 2kc5 n LEU 34 CO 0.37 0.23 -0.48 0.00 -1.33 0.00 0.00 177.39 176.17 2kc5 n HIS 35 N -0.20 -3.15 -1.59 -1.77 1.44 -0.07 -4.91 115.22 104.97 2kc5 n HIS 35 Ca 0.00 1.73 -0.48 0.00 -2.01 0.00 0.00 57.72 56.97 2kc5 n HIS 35 Cb 0.31 -2.83 -0.04 0.00 0.12 0.00 0.00 29.99 27.55 2kc5 n HIS 35 CO 0.00 0.00 0.00 -2.30 -2.81 0.00 0.00 176.34 171.23 2kc5 n PRO 36 N -3.53 1.33 -0.15 -1.40 -0.02 -1.25 -4.71 135.00 125.27 2kc5 n PRO 36 Ca -0.06 0.47 -0.06 0.00 -2.02 0.00 0.00 63.50 61.84 2kc5 n PRO 36 Cb 0.51 -1.98 0.12 0.00 -0.02 0.00 0.00 33.50 32.13 2kc5 n PRO 36 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2kc5 h SER 37 N 3.36 0.85 -3.62 2.55 4.64 -1.91 -3.41 113.55 116.01 2kc5 h SER 37 Ca -0.43 -0.21 -0.33 0.00 -0.47 0.00 0.00 61.79 60.35 2kc5 h SER 37 Cb 1.33 -0.23 -0.32 0.00 -0.31 0.00 0.00 62.40 62.88 2kc5 h SER 37 CO 0.70 0.90 -0.75 -0.04 -0.87 0.00 0.00 176.83 176.77 2kc5 s MET 38 N -5.03 0.33 0.05 4.77 -1.94 -1.26 -5.07 119.30 111.15 2kc5 s MET 38 Ca -0.10 -0.01 -0.37 0.00 -1.71 0.00 0.00 55.69 53.50 2kc5 s MET 38 Cb 0.14 -0.43 -0.17 0.00 2.01 0.00 0.00 34.83 36.39 2kc5 s MET 38 CO 0.82 -0.06 1.33 -2.30 -0.01 0.00 0.00 175.02 174.81 2kc5 n PRO 39 N 3.72 1.01 -1.95 2.03 -0.02 -1.26 -4.46 135.00 134.07 2kc5 n PRO 39 Ca -0.22 0.37 -0.41 0.00 -2.02 0.00 0.00 63.50 61.21 2kc5 n PRO 39 Cb 0.53 -1.99 -0.02 0.00 -0.02 0.00 0.00 33.50 32.00 2kc5 n PRO 39 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2kc5 s VAL 40 N 0.61 2.45 0.04 -1.45 1.01 -1.26 -4.85 120.40 116.96 2kc5 s VAL 40 Ca 0.86 0.41 -0.04 0.00 0.00 0.00 0.00 61.98 63.21 2kc5 s VAL 40 Cb -1.00 -3.26 -0.02 0.00 0.00 0.00 0.00 36.38 32.10 2kc5 s VAL 40 CO 0.49 0.08 0.05 -0.47 0.00 0.00 0.00 175.10 175.25 2kc5 s TYR 41 N -0.44 0.29 -0.02 5.22 5.04 -0.60 -4.96 117.35 121.89 2kc5 s TYR 41 Ca 0.57 -0.67 -0.00 0.00 -2.44 0.00 0.00 57.07 54.52 2kc5 s TYR 41 Cb -0.43 -0.21 0.03 0.00 0.35 0.00 0.00 41.96 41.70 2kc5 s TYR 41 CO 0.50 -0.36 0.04 0.08 -1.34 0.00 0.00 175.55 174.46 2kc5 s VAL 42 N -2.93 -0.07 0.09 3.14 1.01 -1.26 -0.85 120.40 119.53 2kc5 s VAL 42 Ca -0.02 0.27 0.01 0.00 0.00 0.00 0.00 61.98 62.23 2kc5 s VAL 42 Cb 0.01 -0.10 -0.04 0.00 0.00 0.00 0.00 36.38 36.25 2kc5 s VAL 42 CO -0.06 0.11 0.22 -0.44 0.00 0.00 0.00 175.10 174.93 2kc5 s SER 43 N 1.32 6.27 0.02 3.32 0.01 0.05 -4.97 113.70 119.73 2kc5 s SER 43 Ca -0.06 0.21 0.07 0.00 1.31 0.00 0.00 55.95 57.48 2kc5 s SER 43 Cb -0.13 -1.90 -0.02 0.00 0.21 0.00 0.00 66.02 64.18 2kc5 s SER 43 CO -0.03 0.13 -0.21 -0.62 0.41 0.00 0.00 173.24 172.92 2kc5 s ASP 44 N -2.74 2.53 0.22 2.44 2.15 -1.26 -1.29 116.67 118.73 2kc5 s ASP 44 Ca 0.34 -0.48 -0.06 0.00 0.43 0.00 0.00 52.55 52.78 2kc5 s ASP 44 Cb -0.12 -0.24 -0.02 0.00 -0.30 0.00 0.00 42.92 42.24 2kc5 s ASP 44 CO 0.28 0.20 0.29 -0.36 -0.17 0.00 0.00 175.17 175.41 2kc5 s PHE 45 N -0.70 0.81 1.13 -5.34 0.08 0.42 -4.93 117.98 109.46 2kc5 s PHE 45 Ca 0.08 -1.09 -0.17 0.00 0.12 0.00 0.00 56.93 55.87 2kc5 s PHE 45 Cb -0.09 -0.22 0.15 0.00 -0.57 0.00 0.00 43.02 42.29 2kc5 s PHE 45 CO 0.01 -0.80 0.28 -2.37 -0.10 0.00 0.00 175.22 172.24 2kc5 n THR 46 N -0.33 0.00 -2.55 0.64 5.66 -1.26 -2.61 114.28 113.83 2kc5 n THR 46 Ca 0.00 -0.34 -0.42 0.00 -3.05 0.00 0.00 64.05 60.24 2kc5 n THR 46 Cb 0.64 -0.71 -0.03 0.00 -1.55 0.00 0.00 70.33 68.69 2kc5 n THR 46 CO 0.00 0.00 0.00 -0.22 -3.05 0.00 0.00 175.07 171.80 2kc5 s LEU 47 N -2.87 4.24 0.00 1.09 2.96 -1.26 -1.78 118.68 121.06 2kc5 s LEU 47 Ca 0.59 1.67 0.00 0.00 -0.22 0.00 0.00 54.13 56.18 2kc5 s LEU 47 Cb -0.16 -3.55 0.00 0.00 0.50 0.00 0.00 46.19 42.98 2kc5 s LEU 47 CO 0.66 -0.56 0.00 0.33 -1.32 0.00 0.00 176.35 175.46 2kc5 n PHE 48 N 5.35 0.00 -1.63 5.38 7.35 0.96 -4.89 117.46 129.98 2kc5 n PHE 48 Ca 0.11 0.00 -0.42 0.00 -0.76 0.00 0.00 57.45 56.37 2kc5 n PHE 48 Cb 0.47 0.00 -0.02 0.00 0.35 0.00 0.00 39.48 40.28 2kc5 n PHE 48 CO 0.00 0.00 0.00 0.39 -0.76 0.00 0.00 176.76 176.39 2kc5 n GLU 49 N 0.00 2.49 -1.22 -4.13 1.02 -1.26 -4.25 120.64 113.29 2kc5 n GLU 49 Ca 0.00 -2.43 -0.08 0.00 -0.02 0.00 0.00 57.16 54.63 2kc5 n GLU 49 Cb 0.00 -3.21 -0.03 0.00 -0.02 0.00 0.00 31.44 28.18 2kc5 n GLU 49 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2kc5 n GLY 50 N 4.32 0.87 3.02 0.62 0.00 -1.26 -4.96 105.19 107.80 2kc5 n GLY 50 Ca 0.51 -0.22 -0.12 0.00 0.00 0.00 0.00 46.02 46.20 2kc5 n GLY 50 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2kc5 s GLN 51 N -2.33 0.24 0.60 1.61 -0.21 -1.26 -1.43 119.66 116.87 2kc5 s GLN 51 Ca 0.00 -0.04 -0.16 0.00 0.02 0.00 0.00 55.36 55.17 2kc5 s GLN 51 Cb 0.00 0.10 -0.03 0.00 1.00 0.00 0.00 33.01 34.08 2kc5 s GLN 51 CO 0.00 -0.04 1.08 -1.58 -2.12 0.00 0.00 175.29 172.63 2kc5 s TRP 52 N -0.43 2.82 0.21 0.91 0.52 0.48 -0.03 118.94 123.42 2kc5 s TRP 52 Ca -0.05 1.53 0.05 0.00 0.02 0.00 0.00 56.10 57.65 2kc5 s TRP 52 Cb -0.03 -3.10 -0.03 0.00 -1.15 0.00 0.00 33.47 29.15 2kc5 s TRP 52 CO 0.00 -1.35 0.29 0.95 0.02 0.00 0.00 176.95 176.87 2kc5 s THR 53 N -2.29 5.07 0.17 2.01 -4.23 -0.73 -2.22 115.64 113.41 2kc5 s THR 53 Ca 0.66 -1.00 -0.24 0.00 -1.18 0.00 0.00 61.69 59.93 2kc5 s THR 53 Cb -0.19 -3.70 0.06 0.00 1.34 0.00 0.00 72.50 70.01 2kc5 s THR 53 CO 0.36 -0.26 0.88 -0.83 -0.54 0.00 0.00 174.62 174.23 2kc5 s GLY 54 N -3.71 -0.24 0.01 3.99 0.00 0.22 -0.43 107.32 107.16 2kc5 s GLY 54 Ca 0.34 0.12 -0.01 0.00 0.00 0.00 0.00 44.72 45.17 2kc5 s GLY 54 CO 0.28 0.02 -0.00 0.00 0.00 0.00 0.00 173.10 173.39 2kc5 s VAL 56 N -0.74 2.62 0.09 0.00 0.11 -0.00 -0.77 120.40 121.71 2kc5 s VAL 56 Ca -0.08 -1.18 0.05 0.00 -2.93 0.00 0.00 61.98 57.84 2kc5 s VAL 56 Cb -0.05 -2.07 -0.03 0.00 -1.53 0.00 0.00 36.38 32.70 2kc5 s VAL 56 CO -0.00 0.38 -0.13 -0.51 -3.33 0.00 0.00 175.10 171.51 2kc5 s ILE 57 N -0.86 1.10 0.34 7.04 2.07 -0.03 -0.96 121.20 129.90 2kc5 s ILE 57 Ca 0.13 -1.51 0.02 0.00 -1.41 0.00 0.00 60.65 57.88 2kc5 s ILE 57 Cb -0.10 -1.26 -0.01 0.00 0.13 0.00 0.00 42.46 41.21 2kc5 s ILE 57 CO 0.04 -0.38 0.39 0.42 -1.91 0.00 0.00 174.94 173.49 2kc5 s THR 58 N -1.85 0.00 -2.00 4.00 -4.23 -0.25 -1.55 115.64 109.75 2kc5 s THR 58 Ca 0.03 -1.77 0.06 0.00 -1.18 0.00 0.00 61.69 58.82 2kc5 s THR 58 Cb -0.07 -2.58 0.16 0.00 1.34 0.00 0.00 72.50 71.35 2kc5 s THR 58 CO 0.02 0.00 0.77 -2.65 -0.54 0.00 0.00 174.62 172.22 2kc5 n PRO 59 N -0.59 0.19 0.00 3.99 -0.02 -1.26 -3.76 135.00 133.55 2kc5 n PRO 59 Ca 0.04 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.52 2kc5 n PRO 59 Cb 0.62 -1.45 0.00 0.00 -0.02 0.00 0.00 33.50 32.65 2kc5 n PRO 59 CO 0.00 0.00 0.00 -2.67 1.98 0.00 0.00 175.50 174.81 2kc5 n TRP 60 N -0.95 0.00 -3.78 6.00 4.27 -1.19 -4.04 117.44 117.76 2kc5 n TRP 60 Ca 0.04 0.00 -0.10 0.00 -3.89 0.00 0.00 57.50 53.56 2kc5 n TRP 60 Cb 0.02 0.00 -0.04 0.00 -1.36 0.00 0.00 31.31 29.92 2kc5 n TRP 60 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 2kc5 s MET 61 N -0.14 1.31 -0.11 -2.67 0.23 -1.25 -4.36 119.30 112.32 2kc5 s MET 61 Ca 0.00 -0.92 -0.02 0.00 -1.03 0.00 0.00 55.69 53.72 2kc5 s MET 61 Cb 0.00 0.49 0.04 0.00 -1.53 0.00 0.00 34.83 33.83 2kc5 s MET 61 CO 0.00 -0.54 0.03 -1.17 -2.03 0.00 0.00 175.02 171.31 2kc5 s LEU 62 N -2.89 0.63 -0.06 0.18 2.96 0.10 -1.09 118.68 118.50 2kc5 s LEU 62 Ca 0.10 -0.29 -0.01 0.00 -0.22 0.00 0.00 54.13 53.72 2kc5 s LEU 62 Cb 0.00 -0.41 0.03 0.00 0.50 0.00 0.00 46.19 46.31 2kc5 s LEU 62 CO -0.03 -0.25 0.00 -0.44 -1.32 0.00 0.00 176.35 174.32 2kc5 s SER 63 N 2.00 1.29 0.48 3.68 0.01 -0.14 -1.21 113.70 119.81 2kc5 s SER 63 Ca 0.03 -0.06 -0.23 0.00 1.31 0.00 0.00 55.95 57.00 2kc5 s SER 63 Cb -0.14 -0.37 -0.07 0.00 0.21 0.00 0.00 66.02 65.65 2kc5 s SER 63 CO -0.06 -0.17 1.25 0.00 0.41 0.00 0.00 173.24 174.67 2kc5 s ALA 64 N 1.74 2.96 0.01 1.44 0.00 -0.24 -0.82 121.76 126.85 2kc5 s ALA 64 Ca 0.01 1.11 0.00 0.00 0.00 0.00 0.00 51.96 53.09 2kc5 s ALA 64 Cb -0.13 -3.46 -0.01 0.00 0.00 0.00 0.00 23.12 19.52 2kc5 s ALA 64 CO -0.04 -0.93 -0.03 0.14 0.00 0.00 0.00 175.76 174.91 2kc5 s VAL 65 N -1.42 0.13 -0.03 0.00 -7.23 -0.06 -0.86 120.40 110.93 2kc5 s VAL 65 Ca 0.65 -0.63 -0.03 0.00 -1.81 0.00 0.00 61.98 60.17 2kc5 s VAL 65 Cb -0.34 -0.22 0.01 0.00 0.56 0.00 0.00 36.38 36.39 2kc5 s VAL 65 CO 0.41 -0.32 0.08 -0.63 -0.31 0.00 0.00 175.10 174.33 2kc5 s ILE 66 N -0.97 0.01 0.01 -0.62 1.01 0.37 -0.61 121.20 120.41 2kc5 s ILE 66 Ca -0.10 -0.08 0.01 0.00 0.00 0.00 0.00 60.65 60.49 2kc5 s ILE 66 Cb -0.07 -0.14 -0.01 0.00 0.01 0.00 0.00 42.46 42.25 2kc5 s ILE 66 CO -0.01 -0.04 -0.05 -0.36 0.00 0.00 0.00 174.94 174.48 2kc5 s PHE 67 N -0.10 0.44 0.28 3.97 0.08 -0.94 -1.12 117.98 120.59 2kc5 s PHE 67 Ca -0.01 -0.26 -0.29 0.00 0.12 0.00 0.00 56.93 56.48 2kc5 s PHE 67 Cb -0.01 -0.28 -0.14 0.00 -0.57 0.00 0.00 43.02 42.02 2kc5 s PHE 67 CO 0.00 -0.05 1.20 -2.30 -0.10 0.00 0.00 175.22 173.97 2kc5 n PRO 68 N 2.33 1.70 -0.98 0.24 -0.02 -1.26 -0.39 135.00 136.63 2kc5 n PRO 68 Ca -0.17 0.60 -0.27 0.00 -2.02 0.00 0.00 63.50 61.64 2kc5 n PRO 68 Cb 0.57 -2.12 0.22 0.00 -0.02 0.00 0.00 33.50 32.16 2kc5 n PRO 68 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2kc5 n GLY 69 N 1.44 -2.66 3.77 -1.23 0.00 -0.52 -1.33 105.19 104.65 2kc5 n GLY 69 Ca 0.09 -1.50 -0.40 0.00 0.00 0.00 0.00 46.02 44.21 2kc5 n GLY 69 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2kc5 s PRO 70 N -5.25 4.15 -1.24 1.61 0.02 -0.88 -2.49 135.00 130.93 2kc5 s PRO 70 Ca 0.64 2.33 0.00 0.00 0.02 0.00 0.00 61.00 63.99 2kc5 s PRO 70 Cb -0.06 -2.95 0.00 0.00 0.02 0.00 0.00 34.50 31.51 2kc5 s PRO 70 CO 0.49 -0.40 0.00 -3.47 -0.33 0.00 0.00 177.00 173.28 2kc5 n ASP 71 N 0.49 -3.98 -4.87 2.53 2.03 -1.26 -4.89 116.55 106.59 2kc5 n ASP 71 Ca 0.01 0.22 -0.31 0.00 0.52 0.00 0.00 54.79 55.23 2kc5 n ASP 71 Cb 0.41 -3.47 -0.04 0.00 -0.72 0.00 0.00 41.12 37.30 2kc5 n ASP 71 CO 0.00 0.00 0.00 -1.10 -1.92 0.00 0.00 177.20 174.18 2kc5 s GLN 72 N -4.44 3.83 -0.68 -0.67 -1.52 -1.23 -4.86 119.66 110.09 2kc5 s GLN 72 Ca 0.00 0.47 0.03 0.00 -1.95 0.00 0.00 55.36 53.91 2kc5 s GLN 72 Cb 0.00 -2.45 0.17 0.00 -0.22 0.00 0.00 33.01 30.51 2kc5 s GLN 72 CO 0.00 0.07 0.48 -0.51 -0.25 0.00 0.00 175.29 175.08 2kc5 s LEU 73 N -3.49 4.86 0.64 2.90 2.01 -1.26 -0.55 118.68 123.80 2kc5 s LEU 73 Ca 0.51 -3.53 -0.17 0.00 0.01 0.00 0.00 54.13 50.95 2kc5 s LEU 73 Cb -0.10 -1.71 -0.01 0.00 0.01 0.00 0.00 46.19 44.38 2kc5 s LEU 73 CO 0.26 -0.16 1.16 0.26 1.01 0.00 0.00 176.35 178.88 2kc5 s TRP 74 N -1.02 2.43 0.73 0.29 0.52 -0.24 -4.87 118.94 116.77 2kc5 s TRP 74 Ca 0.23 1.56 -0.11 0.00 0.02 0.00 0.00 56.10 57.79 2kc5 s TRP 74 Cb -0.12 -3.34 0.03 0.00 -1.15 0.00 0.00 33.47 28.90 2kc5 s TRP 74 CO -0.11 -2.02 1.08 -1.25 0.02 0.00 0.00 176.95 174.67 2kc5 s PRO 75 N -3.75 2.58 -0.12 4.98 0.04 -1.26 -0.48 135.00 136.99 2kc5 s PRO 75 Ca 0.72 1.13 -0.29 0.00 0.04 0.00 0.00 61.00 62.60 2kc5 s PRO 75 Cb -0.25 -1.94 -0.05 0.00 0.04 0.00 0.00 34.50 32.30 2kc5 s PRO 75 CO 0.38 -1.39 1.72 -1.17 0.04 0.00 0.00 177.00 176.58 2kc5 s LEU 76 N -5.61 4.10 0.41 -3.56 2.96 -0.33 -4.17 118.68 112.49 2kc5 s LEU 76 Ca 0.61 2.01 -0.11 0.00 -0.22 0.00 0.00 54.13 56.43 2kc5 s LEU 76 Cb -0.17 -3.53 -0.06 0.00 0.50 0.00 0.00 46.19 42.93 2kc5 s LEU 76 CO 0.53 -1.15 0.78 -0.13 -1.32 0.00 0.00 176.35 175.06 2kc5 s ARG 77 N 4.51 3.79 0.21 1.98 1.81 -1.26 -4.91 118.95 125.08 2kc5 s ARG 77 Ca 0.76 0.50 -0.23 0.00 -1.72 0.00 0.00 55.73 55.04 2kc5 s ARG 77 Cb -0.31 -2.37 -0.08 0.00 -0.45 0.00 0.00 34.95 31.73 2kc5 s ARG 77 CO 0.31 -0.05 0.78 0.21 -0.68 0.00 0.00 175.30 175.86 2kc5 s LYS 78 N -3.87 4.45 0.34 3.54 2.47 -1.26 -5.05 119.74 120.36 2kc5 s LYS 78 Ca 0.52 1.07 -0.08 0.00 -1.56 0.00 0.00 55.97 55.92 2kc5 s LYS 78 Cb -0.10 -3.05 -0.06 0.00 -1.46 0.00 0.00 37.83 33.16 2kc5 s LYS 78 CO 0.31 0.46 0.66 0.08 0.16 0.00 0.00 175.35 177.03 2kc5 s VAL 79 N -1.36 4.90 0.00 4.02 1.01 -1.26 -3.86 120.40 123.86 2kc5 s VAL 79 Ca 0.40 0.35 0.00 0.00 0.00 0.00 0.00 61.98 62.73 2kc5 s VAL 79 Cb -0.20 -3.73 0.00 0.00 0.00 0.00 0.00 36.38 32.45 2kc5 s VAL 79 CO 0.24 -0.41 0.00 -1.20 0.00 0.00 0.00 175.10 173.73 2kc5 n SER 80 N -1.09 -4.38 -4.86 3.32 7.64 0.18 -4.99 113.62 109.44 2kc5 n SER 80 Ca 0.00 0.00 -0.31 0.00 1.01 0.00 0.00 58.87 59.58 2kc5 n SER 80 Cb 0.54 -2.47 0.03 0.00 -1.01 0.00 0.00 64.21 61.31 2kc5 n SER 80 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 2kc5 s GLU 81 N -1.29 3.17 -0.00 1.43 0.41 -1.25 -4.81 118.70 116.36 2kc5 s GLU 81 Ca 0.00 0.70 0.04 0.00 -0.41 0.00 0.00 54.97 55.31 2kc5 s GLU 81 Cb 0.00 -2.04 -0.03 0.00 -1.78 0.00 0.00 34.13 30.28 2kc5 s GLU 81 CO 0.00 -0.86 -0.12 0.15 -0.49 0.00 0.00 175.26 173.93 2kc5 s LYS 82 N -5.20 2.39 -0.14 1.61 1.02 -1.26 -0.37 119.74 117.78 2kc5 s LYS 82 Ca 0.57 -0.79 0.02 0.00 0.02 0.00 0.00 55.97 55.78 2kc5 s LYS 82 Cb -0.12 -2.37 0.00 0.00 -0.52 0.00 0.00 37.83 34.83 2kc5 s LYS 82 CO 0.54 0.59 -0.19 0.42 -0.92 0.00 0.00 175.35 175.78 2kc5 s ILE 83 N -0.90 2.34 -0.08 2.17 -1.09 -0.05 -4.96 121.20 118.63 2kc5 s ILE 83 Ca 0.15 -0.89 -0.30 0.00 -2.23 0.00 0.00 60.65 57.38 2kc5 s ILE 83 Cb -0.11 -1.95 -0.03 0.00 -1.58 0.00 0.00 42.46 38.79 2kc5 s ILE 83 CO 0.05 0.54 1.22 -0.83 -1.23 0.00 0.00 174.94 174.69 2kc5 s GLY 84 N 0.72 1.97 0.02 6.18 0.00 -1.26 -0.98 107.32 113.97 2kc5 s GLY 84 Ca -0.08 0.58 0.07 0.00 0.00 0.00 0.00 44.72 45.29 2kc5 s GLY 84 CO 0.01 2.30 -0.18 1.08 0.00 0.00 0.00 173.10 176.30 2kc5 s LEU 85 N 2.57 2.57 -0.18 0.66 1.43 -0.42 -4.97 118.68 120.35 2kc5 s LEU 85 Ca 0.56 -0.40 -0.14 0.00 -1.03 0.00 0.00 54.13 53.12 2kc5 s LEU 85 Cb -0.24 -1.50 -0.04 0.00 0.03 0.00 0.00 46.19 44.43 2kc5 s LEU 85 CO 0.20 0.28 0.31 -1.58 0.23 0.00 0.00 176.35 175.78 2kc5 s GLN 86 N -1.25 4.21 0.05 1.70 -0.44 -1.26 -1.40 119.66 121.27 2kc5 s GLN 86 Ca 0.14 0.08 0.00 0.00 -2.50 0.00 0.00 55.36 53.08 2kc5 s GLN 86 Cb -0.10 -3.47 -0.03 0.00 -1.64 0.00 0.00 33.01 27.76 2kc5 s GLN 86 CO 0.04 0.13 -0.04 -0.51 0.50 0.00 0.00 175.29 175.41 2kc5 s LEU 87 N 0.79 2.38 0.61 3.68 1.02 -1.24 -4.92 118.68 121.00 2kc5 s LEU 87 Ca 0.16 -0.77 0.39 0.00 0.02 0.00 0.00 54.13 53.93 2kc5 s LEU 87 Cb -0.14 0.06 1.99 0.00 0.02 0.00 0.00 46.19 48.12 2kc5 s LEU 87 CO 0.05 -0.41 2.23 -0.65 0.02 0.00 0.00 176.35 177.58 2kc5 h PRO 88 N 3.81 0.00 -0.10 1.29 0.11 -1.89 -0.08 132.00 135.14 2kc5 h PRO 88 Ca -0.34 0.00 0.03 0.00 0.11 0.00 0.00 66.00 65.80 2kc5 h PRO 88 Cb 1.18 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.28 2kc5 h PRO 88 CO 0.54 0.02 0.08 -0.92 -0.21 0.00 0.00 178.00 177.50 2kc5 h TYR 89 N 0.00 0.00 0.00 0.65 3.20 -1.79 -3.49 116.97 115.54 2kc5 h TYR 89 Ca -0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 2kc5 h TYR 89 Cb 0.18 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.45 2kc5 h TYR 89 CO 0.00 0.00 0.00 0.41 -1.64 0.00 0.00 178.16 176.93 2kc5 n GLY 90 N -1.52 3.86 3.72 1.82 0.00 -0.04 -5.07 105.19 107.97 2kc5 n GLY 90 Ca -0.01 -1.66 -0.42 0.00 0.00 0.00 0.00 46.02 43.94 2kc5 n GLY 90 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2kc5 s THR 91 N -2.32 2.60 -0.00 2.61 2.01 -1.25 -3.61 115.64 115.67 2kc5 s THR 91 Ca 0.00 0.44 -0.02 0.00 0.31 0.00 0.00 61.69 62.43 2kc5 s THR 91 Cb 0.00 -3.28 -0.00 0.00 0.01 0.00 0.00 72.50 69.22 2kc5 s THR 91 CO 0.00 0.04 0.03 -0.04 -0.69 0.00 0.00 174.62 173.97 2kc5 s MET 92 N 0.78 0.18 0.11 4.92 1.00 -0.49 -4.97 119.30 120.83 2kc5 s MET 92 Ca 0.68 -0.19 -0.29 0.00 0.00 0.00 0.00 55.69 55.89 2kc5 s MET 92 Cb -0.44 0.07 -0.06 0.00 0.00 0.00 0.00 34.83 34.40 2kc5 s MET 92 CO 0.34 -0.03 0.92 0.95 0.00 0.00 0.00 175.02 177.20 2kc5 s THR 93 N -0.58 4.51 -0.09 2.05 -4.23 -1.26 -1.30 115.64 114.74 2kc5 s THR 93 Ca -0.06 1.98 -0.01 0.00 -1.18 0.00 0.00 61.69 62.42 2kc5 s THR 93 Cb -0.04 -4.28 -0.03 0.00 1.34 0.00 0.00 72.50 69.49 2kc5 s THR 93 CO -0.00 0.34 -0.03 -0.36 -0.54 0.00 0.00 174.62 174.03 2kc5 s PHE 94 N -0.13 3.05 0.11 3.99 0.40 -0.15 -4.91 117.98 120.35 2kc5 s PHE 94 Ca 0.45 0.06 -0.21 0.00 -0.60 0.00 0.00 56.93 56.63 2kc5 s PHE 94 Cb -0.23 -1.78 -0.07 0.00 0.51 0.00 0.00 43.02 41.45 2kc5 s PHE 94 CO 0.29 0.35 0.63 0.99 0.70 0.00 0.00 175.22 178.18 2kc5 s THR 95 N -0.68 4.64 0.00 0.64 2.01 0.08 -0.87 115.64 121.46 2kc5 s THR 95 Ca 0.11 1.32 -0.30 0.00 0.31 0.00 0.00 61.69 63.13 2kc5 s THR 95 Cb -0.12 -3.95 -0.05 0.00 0.01 0.00 0.00 72.50 68.40 2kc5 s THR 95 CO 0.02 0.50 1.27 -0.69 -0.69 0.00 0.00 174.62 175.03 2kc5 s VAL 96 N -1.18 3.97 0.32 3.82 1.01 0.50 -0.82 120.40 128.01 2kc5 s VAL 96 Ca 0.32 1.36 0.10 0.00 0.00 0.00 0.00 61.98 63.76 2kc5 s VAL 96 Cb -0.20 -3.87 -0.06 0.00 0.00 0.00 0.00 36.38 32.25 2kc5 s VAL 96 CO 0.21 0.03 -0.11 -0.83 0.00 0.00 0.00 175.10 174.40 2kc5 s GLY 97 N 1.47 2.06 -0.41 4.51 0.00 0.01 -0.65 107.32 114.30 2kc5 s GLY 97 Ca 0.60 -1.99 0.02 0.00 0.00 0.00 0.00 44.72 43.35 2kc5 s GLY 97 CO 0.26 -1.99 0.18 1.85 0.00 0.00 0.00 173.10 173.40 2kc5 s GLU 98 N -3.59 1.37 -0.06 2.90 2.12 -1.26 -1.54 118.70 118.64 2kc5 s GLU 98 Ca 0.32 -1.94 -0.30 0.00 0.36 0.00 0.00 54.97 53.41 2kc5 s GLU 98 Cb -0.01 -2.66 -0.03 0.00 0.26 0.00 0.00 34.13 31.69 2kc5 s GLU 98 CO 0.16 -1.07 1.21 -1.17 -0.54 0.00 0.00 175.26 173.85 2kc5 s LEU 99 N 0.56 4.27 0.26 2.70 2.96 -0.64 -4.95 118.68 123.83 2kc5 s LEU 99 Ca 0.15 1.81 -0.31 0.00 -0.22 0.00 0.00 54.13 55.56 2kc5 s LEU 99 Cb -0.22 -3.56 -0.12 0.00 0.50 0.00 0.00 46.19 42.79 2kc5 s LEU 99 CO -0.06 -0.60 1.66 -0.67 -1.32 0.00 0.00 176.35 175.36 2kc5 n ASP 100 N 5.29 3.98 0.00 3.68 2.03 -1.26 -1.37 116.55 128.90 2kc5 n ASP 100 Ca 0.11 1.11 0.00 0.00 0.52 0.00 0.00 54.79 56.53 2kc5 n ASP 100 Cb 0.46 -1.59 0.00 0.00 -0.72 0.00 0.00 41.12 39.27 2kc5 n ASP 100 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2kc5 n GLY 101 N 2.99 0.62 0.00 0.27 0.00 -1.26 -4.79 105.19 103.02 2kc5 n GLY 101 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 2kc5 n GLY 101 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2kc5 n VAL 102 N -2.28 0.00 -3.90 1.61 0.31 -0.47 -5.01 118.33 108.59 2kc5 n VAL 102 Ca 0.00 0.00 -0.11 0.00 -0.01 0.00 0.00 64.34 64.22 2kc5 n VAL 102 Cb 0.04 0.00 -0.01 0.00 -0.91 0.00 0.00 33.84 32.96 2kc5 n VAL 102 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 2kc5 n SER 103 N 0.00 -1.49 -4.77 4.52 7.64 -1.18 -4.91 113.62 113.43 2kc5 n SER 103 Ca 0.00 -2.59 -0.39 0.00 1.01 0.00 0.00 58.87 56.90 2kc5 n SER 103 Cb 0.00 2.64 -0.01 0.00 -1.01 0.00 0.00 64.21 65.82 2kc5 n SER 103 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 2kc5 s GLN 104 N -2.50 4.05 0.23 1.43 -0.21 -1.26 -1.63 119.66 119.78 2kc5 s GLN 104 Ca 0.22 1.96 -0.12 0.00 0.02 0.00 0.00 55.36 57.44 2kc5 s GLN 104 Cb -0.02 -2.73 -0.01 0.00 1.00 0.00 0.00 33.01 31.25 2kc5 s GLN 104 CO 0.16 -0.36 0.43 1.52 -2.12 0.00 0.00 175.29 174.92 2kc5 s TYR 105 N -1.34 0.42 -0.07 0.91 1.13 -0.59 -4.93 117.35 112.89 2kc5 s TYR 105 Ca 0.56 -0.77 -0.03 0.00 -1.41 0.00 0.00 57.07 55.43 2kc5 s TYR 105 Cb -0.34 0.11 -0.04 0.00 -1.10 0.00 0.00 41.96 40.59 2kc5 s TYR 105 CO 0.43 -0.94 0.06 -0.51 -2.51 0.00 0.00 175.55 172.08 2kc5 s LEU 106 N -3.02 3.88 0.04 -3.49 1.02 -0.27 -0.81 118.68 116.02 2kc5 s LEU 106 Ca 0.23 0.22 -0.02 0.00 0.02 0.00 0.00 54.13 54.59 2kc5 s LEU 106 Cb 0.00 -2.03 -0.03 0.00 0.02 0.00 0.00 46.19 44.16 2kc5 s LEU 106 CO 0.08 0.35 0.01 -0.94 0.02 0.00 0.00 176.35 175.87 2kc5 s SER 107 N -1.20 0.32 -0.19 2.29 1.04 -0.00 -0.48 113.70 115.47 2kc5 s SER 107 Ca 0.17 -0.71 -0.04 0.00 0.48 0.00 0.00 55.95 55.85 2kc5 s SER 107 Cb -0.12 0.18 0.09 0.00 0.10 0.00 0.00 66.02 66.27 2kc5 s SER 107 CO 0.07 -0.48 0.22 0.00 0.98 0.00 0.00 173.24 174.02 2kc5 s SER 109 N 2.32 6.90 -0.00 0.00 0.01 -1.26 -1.08 113.70 120.60 2kc5 s SER 109 Ca 0.06 2.14 0.00 0.00 1.31 0.00 0.00 55.95 59.46 2kc5 s SER 109 Cb -0.15 -2.57 -0.00 0.00 0.21 0.00 0.00 66.02 63.50 2kc5 s SER 109 CO -0.12 -0.64 -0.00 0.18 0.41 0.00 0.00 173.24 173.08 2kc5 n LEU 110 N 4.60 2.94 -4.05 2.44 4.77 -0.35 -4.96 117.00 122.39 2kc5 n LEU 110 Ca 0.12 -0.00 -0.08 0.00 -0.03 0.00 0.00 56.01 56.01 2kc5 n LEU 110 Cb 0.44 -0.01 -0.09 0.00 -2.33 0.00 0.00 43.42 41.43 2kc5 n LEU 110 CO 0.58 0.50 -0.27 -0.04 -1.33 0.00 0.00 177.39 176.82 2kc5 s MET 111 N -2.01 0.76 -0.58 3.23 -1.94 -1.03 -5.03 119.30 112.71 2kc5 s MET 111 Ca -0.00 -1.22 0.06 0.00 -1.71 0.00 0.00 55.69 52.82 2kc5 s MET 111 Cb 0.00 0.25 0.28 0.00 2.01 0.00 0.00 34.83 37.38 2kc5 s MET 111 CO 0.01 -0.19 0.79 -1.13 -0.01 0.00 0.00 175.02 174.49 2kc5 n SER 112 N 0.01 3.48 -4.72 3.03 3.41 -1.26 -0.72 113.62 116.85 2kc5 n SER 112 Ca -0.12 -3.43 -0.35 0.00 -0.26 0.00 0.00 58.87 54.72 2kc5 n SER 112 Cb 0.62 -0.63 0.10 0.00 -0.26 0.00 0.00 64.21 64.04 2kc5 n SER 112 CO 0.00 0.00 0.00 -2.16 -0.16 0.00 0.00 175.04 172.72 2kc5 s PRO 113 N -2.68 2.11 0.10 4.33 0.04 -1.26 -4.83 135.00 132.81 2kc5 s PRO 113 Ca 0.42 1.87 0.05 0.00 0.04 0.00 0.00 61.00 63.39 2kc5 s PRO 113 Cb 0.21 -1.82 -0.03 0.00 0.04 0.00 0.00 34.50 32.90 2kc5 s PRO 113 CO -0.07 -1.89 -0.13 -0.51 0.04 0.00 0.00 177.00 174.44 2kc5 s LEU 114 N -5.06 2.35 -0.94 -3.56 1.43 -1.26 -3.17 118.68 108.47 2kc5 s LEU 114 Ca 0.77 -0.73 -0.06 0.00 -1.03 0.00 0.00 54.13 53.08 2kc5 s LEU 114 Cb -0.32 -0.49 -0.08 0.00 0.03 0.00 0.00 46.19 45.33 2kc5 s LEU 114 CO 0.45 -0.14 2.39 -1.20 0.23 0.00 0.00 176.35 178.09 2kc5 n SER 115 N 0.85 5.64 0.04 2.29 7.64 -1.26 -3.76 113.62 125.06 2kc5 n SER 115 Ca -0.18 -2.36 0.00 0.00 1.01 0.00 0.00 58.87 57.34 2kc5 n SER 115 Cb 0.56 -1.19 0.00 0.00 -1.01 0.00 0.00 64.21 62.57 2kc5 n SER 115 CO 0.00 0.00 0.00 1.57 -3.01 0.00 0.00 175.04 173.60 2kc5 n HIS 116 N 3.82 -0.59 -1.43 1.43 -0.00 -1.26 -4.87 115.22 112.31 2kc5 n HIS 116 Ca 0.50 0.10 -0.26 0.00 -0.00 0.00 0.00 57.72 58.07 2kc5 n HIS 116 Cb 0.23 0.43 -0.08 0.00 -0.00 0.00 0.00 29.99 30.58 2kc5 n HIS 116 CO 0.00 0.00 0.00 0.43 -0.00 0.00 0.00 176.34 176.77 2kc5 n SER 117 N -2.77 6.46 -3.55 0.26 7.64 -1.25 -4.77 113.62 115.64 2kc5 n SER 117 Ca 0.00 -3.01 -0.11 0.00 1.01 0.00 0.00 58.87 56.76 2kc5 n SER 117 Cb 0.00 -1.30 -0.02 0.00 -1.01 0.00 0.00 64.21 61.88 2kc5 n SER 117 CO 0.00 0.00 0.00 -0.32 -3.01 0.00 0.00 175.04 171.71 2kc5 s MET 118 N -0.90 1.38 0.27 1.43 0.00 -1.26 -4.89 119.30 115.33 2kc5 s MET 118 Ca 0.61 -0.62 -0.11 0.00 0.00 0.00 0.00 55.69 55.56 2kc5 s MET 118 Cb 0.34 0.58 -0.00 0.00 0.00 0.00 0.00 34.83 35.75 2kc5 s MET 118 CO -0.15 -0.61 0.48 -1.54 0.00 0.00 0.00 175.02 173.20 2kc5 s SER 119 N -2.80 0.06 0.44 1.11 1.04 -1.26 -4.96 113.70 107.34 2kc5 s SER 119 Ca 0.04 -1.04 0.21 0.00 0.48 0.00 0.00 55.95 55.64 2kc5 s SER 119 Cb -0.02 0.60 1.04 0.00 0.10 0.00 0.00 66.02 67.74 2kc5 s SER 119 CO -0.08 -1.18 1.92 0.40 0.98 0.00 0.00 173.24 175.28 2kc5 h ILE 120 N 2.24 0.83 -0.33 -1.02 5.03 -1.97 0.14 117.51 122.43 2kc5 h ILE 120 Ca -0.27 -0.97 -0.07 0.00 -0.12 0.00 0.00 64.86 63.43 2kc5 h ILE 120 Cb 1.25 1.58 -0.01 0.00 -3.03 0.00 0.00 36.82 36.61 2kc5 h ILE 120 CO 0.37 0.24 -0.05 -0.33 -0.68 0.00 0.00 178.15 177.69 2kc5 h GLU 121 N 0.00 0.61 -0.01 2.37 5.08 -1.99 -1.71 114.58 118.93 2kc5 h GLU 121 Ca -0.00 -0.22 -0.06 0.00 -1.00 0.00 0.00 59.36 58.08 2kc5 h GLU 121 Cb 0.56 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.76 2kc5 h GLU 121 CO 0.03 0.78 -0.28 0.93 -1.00 0.00 0.00 179.01 179.47 2kc5 h GLU 122 N 0.40 0.01 -0.31 2.33 4.39 -1.86 0.19 114.58 119.73 2kc5 h GLU 122 Ca 0.09 -0.00 0.09 0.00 0.34 0.00 0.00 59.36 59.87 2kc5 h GLU 122 Cb 0.53 -0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.17 2kc5 h GLU 122 CO 0.03 0.29 0.28 0.78 -1.16 0.00 0.00 179.01 179.22 2kc5 h GLY 123 N 0.84 0.00 0.00 -3.84 0.00 0.12 0.17 103.07 100.37 2kc5 h GLY 123 Ca -0.00 0.00 -0.18 0.00 0.00 0.00 0.00 47.33 47.15 2kc5 h GLY 123 CO 0.04 0.00 -1.37 -1.06 0.00 0.00 0.00 176.54 174.14 2kc5 n GLN 124 N -4.07 0.54 0.15 4.80 6.02 -0.61 -4.39 117.38 119.82 2kc5 n GLN 124 Ca 0.05 0.38 0.00 0.00 -0.01 0.00 0.00 57.00 57.42 2kc5 n GLN 124 Cb 0.44 -1.58 0.24 0.00 1.02 0.00 0.00 30.24 30.35 2kc5 n GLN 124 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2kc5 h ARG 125 N -1.00 0.00 0.00 -1.09 2.47 -0.51 -1.57 114.38 112.68 2kc5 h ARG 125 Ca -0.27 0.00 -0.23 0.00 -1.26 0.00 0.00 59.98 58.22 2kc5 h ARG 125 Cb 1.12 0.00 -0.04 0.00 -1.65 0.00 0.00 29.97 29.41 2kc5 h ARG 125 CO -0.17 0.53 -1.19 1.25 0.56 0.00 0.00 179.97 180.96 2kc5 h LEU 126 N 0.00 0.00 -0.48 3.04 5.85 -0.87 0.15 115.31 123.00 2kc5 h LEU 126 Ca -0.01 0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.67 2kc5 h LEU 126 Cb 0.96 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.97 2kc5 h LEU 126 CO 0.07 0.97 0.11 0.74 -0.34 0.00 0.00 178.44 179.99 2kc5 h THR 127 N 0.00 1.24 -0.11 1.05 2.02 -1.59 0.25 112.91 115.77 2kc5 h THR 127 Ca -0.09 -0.86 -0.01 0.00 0.77 0.00 0.00 66.41 66.22 2kc5 h THR 127 Cb 1.82 0.88 -0.00 0.00 -1.74 0.00 0.00 68.15 69.10 2kc5 h THR 127 CO 0.11 0.31 0.04 -0.78 0.37 0.00 0.00 175.52 175.56 2kc5 h ASP 128 N 0.66 0.16 0.70 4.18 3.58 -1.28 -2.50 116.42 121.92 2kc5 h ASP 128 Ca 0.15 -0.20 -0.06 0.00 0.42 0.00 0.00 57.03 57.34 2kc5 h ASP 128 Cb 0.34 -0.04 -0.01 0.00 1.72 0.00 0.00 39.33 41.34 2kc5 h ASP 128 CO 0.00 0.32 -0.28 -0.78 -2.88 0.00 0.00 179.24 175.62 2kc5 h ASP 129 N -0.00 0.00 -0.56 2.28 3.58 -0.83 -0.18 116.42 120.71 2kc5 h ASP 129 Ca 0.04 0.00 -0.05 0.00 0.42 0.00 0.00 57.03 57.44 2kc5 h ASP 129 Cb 0.22 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.24 2kc5 h ASP 129 CO -0.00 0.28 0.15 0.00 -2.88 0.00 0.00 179.24 176.79 2kc5 h ALA 131 N 1.03 0.22 -0.44 0.00 0.00 -0.91 -3.19 119.26 115.97 2kc5 h ALA 131 Ca 0.18 -0.21 0.04 0.00 0.00 0.00 0.00 54.91 54.92 2kc5 h ALA 131 Cb 0.31 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 2kc5 h ALA 131 CO -0.00 -0.05 0.19 -0.09 0.00 0.00 0.00 179.25 179.30 2kc5 h ARG 132 N 0.02 0.38 -1.23 0.00 2.43 -0.77 0.13 114.38 115.36 2kc5 h ARG 132 Ca 0.04 -0.02 0.35 0.00 -0.81 0.00 0.00 59.98 59.54 2kc5 h ARG 132 Cb 0.41 -0.09 -0.06 0.00 -0.42 0.00 0.00 29.97 29.82 2kc5 h ARG 132 CO 0.01 0.25 0.87 1.98 -1.51 0.00 0.00 179.97 181.57 2kc5 h MET 133 N 0.39 0.06 0.00 0.20 4.05 -0.81 -1.46 114.93 117.36 2kc5 h MET 133 Ca 0.20 -0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.61 2kc5 h MET 133 Cb 0.14 -0.01 0.00 0.00 -0.80 0.00 0.00 31.60 30.93 2kc5 h MET 133 CO -0.16 0.04 -1.69 0.44 0.23 0.00 0.00 176.91 175.77 2kc5 n ILE 134 N -4.26 0.00 -1.55 1.77 -5.35 -0.22 -4.24 119.36 105.51 2kc5 n ILE 134 Ca 0.27 -0.37 -0.37 0.00 -0.27 0.00 0.00 62.75 62.02 2kc5 n ILE 134 Cb 1.25 0.20 0.06 0.00 -1.74 0.00 0.00 39.64 39.41 2kc5 n ILE 134 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2kc5 n LEU 135 N -2.03 7.65 -2.40 7.28 -0.00 0.30 -4.20 117.00 123.60 2kc5 n LEU 135 Ca -0.03 -4.50 -0.16 0.00 -0.00 0.00 0.00 56.01 51.33 2kc5 n LEU 135 Cb 0.43 -1.01 -0.11 0.00 -0.00 0.00 0.00 43.42 42.73 2kc5 n LEU 135 CO 0.36 1.58 1.86 -1.54 -0.00 0.00 0.00 177.39 179.65 2kc5 n SER 136 N -0.78 5.15 -4.77 1.45 3.41 -0.65 -4.87 113.62 112.57 2kc5 n SER 136 Ca 0.60 -2.36 -0.39 0.00 -0.26 0.00 0.00 58.87 56.46 2kc5 n SER 136 Cb 0.50 -1.23 -0.00 0.00 -0.26 0.00 0.00 64.21 63.21 2kc5 n SER 136 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2kc5 s LEU 137 N 0.04 4.13 -1.06 1.04 2.01 -1.26 -4.84 118.68 118.74 2kc5 s LEU 137 Ca 0.56 2.55 -0.08 0.00 0.01 0.00 0.00 54.13 57.17 2kc5 s LEU 137 Cb 0.23 -4.03 -0.11 0.00 0.01 0.00 0.00 46.19 42.29 2kc5 s LEU 137 CO -0.01 -0.91 3.08 -0.81 1.01 0.00 0.00 176.35 178.71 2kc5 n PRO 138 N -0.13 3.24 -1.09 1.29 -0.04 -1.26 -4.85 135.00 132.17 2kc5 n PRO 138 Ca 0.05 -2.01 0.05 0.00 -0.04 0.00 0.00 63.50 61.55 2kc5 n PRO 138 Cb 0.45 -2.51 -0.03 0.00 -0.04 0.00 0.00 33.50 31.37 2kc5 n PRO 138 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2kc5 n VAL 139 N 2.90 -1.56 -1.88 0.52 0.31 -1.26 -4.90 118.33 112.47 2kc5 n VAL 139 Ca 0.65 0.91 -0.41 0.00 -0.01 0.00 0.00 64.34 65.49 2kc5 n VAL 139 Cb 0.45 -1.47 -0.00 0.00 -0.91 0.00 0.00 33.84 31.90 2kc5 n VAL 139 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 2kc5 s THR 140 N -4.62 2.22 -0.09 2.52 2.01 -1.26 -5.04 115.64 111.38 2kc5 s THR 140 Ca 0.00 0.21 -0.03 0.00 0.31 0.00 0.00 61.69 62.18 2kc5 s THR 140 Cb 0.00 -3.13 0.04 0.00 0.01 0.00 0.00 72.50 69.42 2kc5 s THR 140 CO 0.00 0.04 0.09 0.21 -0.69 0.00 0.00 174.62 174.27 2kc5 s ASN 141 N -0.34 1.47 -1.54 3.53 2.47 -1.26 -5.06 114.94 114.20 2kc5 s ASN 141 Ca 0.54 -0.11 -0.12 0.00 0.42 0.00 0.00 52.86 53.59 2kc5 s ASN 141 Cb -0.44 -0.09 -0.02 0.00 -1.45 0.00 0.00 41.25 39.25 2kc5 s ASN 141 CO 0.59 -0.28 2.58 -0.81 -3.72 0.00 0.00 177.10 175.45 2kc5 n PRO 142 N 5.30 3.28 0.00 0.43 -0.04 -1.26 -4.68 135.00 138.03 2kc5 n PRO 142 Ca -0.05 -2.43 0.00 0.00 -0.04 0.00 0.00 63.50 60.98 2kc5 n PRO 142 Cb 0.50 -3.05 0.00 0.00 -0.04 0.00 0.00 33.50 30.91 2kc5 n PRO 142 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 2kc5 n ASP 143 N 4.84 0.00 -3.77 3.54 2.03 -1.26 -4.71 116.55 117.22 2kc5 n ASP 143 Ca 0.65 0.00 -0.13 0.00 0.52 0.00 0.00 54.79 55.83 2kc5 n ASP 143 Cb 0.31 0.00 -0.09 0.00 -0.72 0.00 0.00 41.12 40.62 2kc5 n ASP 143 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 2kc5 s VAL 144 N 0.00 0.05 1.07 5.18 0.11 -1.26 -5.17 120.40 120.38 2kc5 s VAL 144 Ca 0.00 -0.40 -0.15 0.00 -2.93 0.00 0.00 61.98 58.50 2kc5 s VAL 144 Cb 0.00 -0.57 0.13 0.00 -1.53 0.00 0.00 36.38 34.41 2kc5 s VAL 144 CO 0.00 -0.22 0.43 -2.65 -3.33 0.00 0.00 175.10 169.33 2kc5 n PRO 145 N 1.60 -1.33 -1.82 1.54 -0.02 -1.26 -4.92 135.00 128.79 2kc5 n PRO 145 Ca -0.20 -0.36 -0.42 0.00 -2.02 0.00 0.00 63.50 60.50 2kc5 n PRO 145 Cb 0.56 -1.90 -0.03 0.00 -0.02 0.00 0.00 33.50 32.11 2kc5 n PRO 145 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 2kc5 s HIS 146 N -2.35 1.95 -0.66 6.00 5.65 -1.26 -4.88 115.29 119.74 2kc5 s HIS 146 Ca 0.60 -0.01 0.06 0.00 0.25 0.00 0.00 55.06 55.96 2kc5 s HIS 146 Cb -0.18 -4.08 0.08 0.00 -1.18 0.00 0.00 32.58 27.22 2kc5 s HIS 146 CO 0.66 -4.58 0.83 0.00 -0.65 0.00 0.00 174.74 171.00 2kc5 n ALA 147 N 6.46 2.36 -1.77 1.58 0.00 -1.26 -5.04 120.51 122.84 2kc5 n ALA 147 Ca 0.18 -0.72 -0.39 0.00 0.00 0.00 0.00 53.44 52.51 2kc5 n ALA 147 Cb 0.41 -0.21 -0.01 0.00 0.00 0.00 0.00 19.45 19.63 2kc5 n ALA 147 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2kc5 s GLY 148 N -0.66 2.92 0.31 0.00 0.00 -1.26 -4.99 107.32 103.64 2kc5 s GLY 148 Ca 0.09 1.15 -0.29 0.00 0.00 0.00 0.00 44.72 45.67 2kc5 s GLY 148 CO 0.08 1.72 1.18 0.50 0.00 0.00 0.00 173.10 176.58 2kc5 s ARG 149 N -2.20 4.48 0.55 2.90 0.52 -1.26 -5.04 118.95 118.90 2kc5 s ARG 149 Ca 0.56 1.96 -0.06 0.00 -0.52 0.00 0.00 55.73 57.67 2kc5 s ARG 149 Cb -0.36 -3.10 -0.01 0.00 0.52 0.00 0.00 34.95 32.00 2kc5 s ARG 149 CO 0.46 0.01 0.86 1.03 0.02 0.00 0.00 175.30 177.69 2kc5 s ARG 150 N -1.66 3.21 0.49 3.54 3.00 -1.26 -4.99 118.95 121.29 2kc5 s ARG 150 Ca 0.47 0.13 0.14 0.00 0.00 0.00 0.00 55.73 56.47 2kc5 s ARG 150 Cb -0.35 -2.30 1.15 0.00 0.00 0.00 0.00 34.95 33.45 2kc5 s ARG 150 CO 0.45 -0.50 2.12 0.00 0.00 0.00 0.00 175.30 177.37 2kc5 h ALA 151 N -0.03 1.91 -0.33 2.13 0.00 -2.06 -1.98 119.26 118.90 2kc5 h ALA 151 Ca -0.46 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.43 2kc5 h ALA 151 Cb 1.23 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.98 2kc5 h ALA 151 CO 0.61 0.08 0.00 1.47 0.00 0.00 0.00 179.25 181.41 2kc5 n LEU 152 N -4.51 2.31 -4.24 0.00 -0.00 -1.26 -4.65 117.00 104.65 2kc5 n LEU 152 Ca -0.01 -1.16 -0.40 0.00 -0.00 0.00 0.00 56.01 54.44 2kc5 n LEU 152 Cb 0.09 -0.34 -0.10 0.00 -0.00 0.00 0.00 43.42 43.07 2kc5 n LEU 152 CO 0.34 0.46 -0.11 -0.22 -0.00 0.00 0.00 177.39 177.86 2kc5 s LEU 153 N -1.10 5.20 0.08 1.47 2.96 -0.75 -1.85 118.68 124.69 2kc5 s LEU 153 Ca 0.24 -1.61 -0.17 0.00 -0.22 0.00 0.00 54.13 52.37 2kc5 s LEU 153 Cb 0.15 -1.96 0.04 0.00 0.50 0.00 0.00 46.19 44.91 2kc5 s LEU 153 CO 0.13 -0.55 0.41 0.72 -1.32 0.00 0.00 176.35 175.75 2kc5 s PHE 154 N 1.38 -0.25 0.00 5.38 -0.71 -1.26 -4.80 117.98 117.72 2kc5 s PHE 154 Ca 0.04 0.10 0.00 0.00 -1.04 0.00 0.00 56.93 56.02 2kc5 s PHE 154 Cb -0.23 0.24 0.00 0.00 -1.21 0.00 0.00 43.02 41.82 2kc5 s PHE 154 CO 0.01 -0.63 0.00 0.41 -1.34 0.00 0.00 175.22 173.67 2kc5 n GLY 155 N 0.18 0.22 0.12 1.99 0.00 -1.26 -1.08 105.19 105.36 2kc5 n GLY 155 Ca -0.17 -0.94 -0.10 0.00 0.00 0.00 0.00 46.02 44.80 2kc5 n GLY 155 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2kc5 h ARG 156 N 0.00 -0.17 -0.02 1.61 2.43 -2.01 -3.42 114.38 112.80 2kc5 h ARG 156 Ca 0.00 0.01 -0.17 0.00 -0.81 0.00 0.00 59.98 59.01 2kc5 h ARG 156 Cb 0.00 0.04 -0.32 0.00 -0.42 0.00 0.00 29.97 29.27 2kc5 h ARG 156 CO 0.00 0.28 -0.84 -2.13 -1.51 0.00 0.00 179.97 175.77 2kc5 n ARG 157 N -4.88 0.13 -0.06 0.20 0.63 -1.26 -4.93 116.66 106.49 2kc5 n ARG 157 Ca -0.07 -1.82 -0.16 0.00 -0.92 0.00 0.00 57.85 54.88 2kc5 n ARG 157 Cb 0.26 0.04 -0.05 0.00 0.45 0.00 0.00 32.46 33.16 2kc5 n ARG 157 CO 0.00 0.00 0.00 0.77 -2.51 0.00 0.00 177.63 175.89 2kc5 h SER 158 N 0.85 0.93 -3.60 6.15 0.02 -1.74 -3.42 113.55 112.74 2kc5 h SER 158 Ca -0.31 -0.56 -0.51 0.00 -0.84 0.00 0.00 61.79 59.56 2kc5 h SER 158 Cb 1.73 -0.27 -0.03 0.00 0.14 0.00 0.00 62.40 63.97 2kc5 h SER 158 CO 0.00 1.33 0.13 -0.83 -1.14 0.00 0.00 176.83 176.32 2kc5 s GLY 159 N -3.97 2.64 -0.16 -3.77 0.00 -0.24 -4.95 107.32 96.87 2kc5 s GLY 159 Ca -0.11 0.21 0.06 0.00 0.00 0.00 0.00 44.72 44.88 2kc5 s GLY 159 CO 0.89 0.58 1.27 -1.84 0.00 0.00 0.00 173.10 173.99 2kc5 n GLU 160 N 0.74 2.66 -0.24 2.90 0.28 -0.88 -4.26 120.64 121.85 2kc5 n GLU 160 Ca -0.02 -1.67 0.11 0.00 -0.16 0.00 0.00 57.16 55.42 2kc5 n GLU 160 Cb 0.51 -1.83 0.38 0.00 1.43 0.00 0.00 31.44 31.94 2kc5 n GLU 160 CO 0.00 0.00 0.00 -0.97 -0.16 0.00 0.00 177.13 176.00 2kc5 h ASN 161 N 1.65 0.63 -0.01 -1.84 -1.24 -1.75 -3.50 115.58 109.52 2kc5 h ASN 161 Ca 0.10 0.03 0.00 0.00 0.71 0.00 0.00 56.30 57.14 2kc5 h ASN 161 Cb 1.52 -0.10 0.00 0.00 0.73 0.00 0.00 38.32 40.47 2kc5 h ASN 161 CO 0.37 0.34 0.00 0.00 -1.29 0.00 0.00 177.43 176.85