#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kc5 s THR 2 N 0.00 4.05 -0.96 1.12 -4.23 -1.26 -4.95 115.64 109.41 2kc5 s THR 2 Ca 0.00 0.67 -0.06 0.00 -1.18 0.00 0.00 61.69 61.11 2kc5 s THR 2 Cb 0.00 -3.42 -0.02 0.00 1.34 0.00 0.00 72.50 70.40 2kc5 s THR 2 CO 0.00 -0.87 2.85 -0.62 -0.54 0.00 0.00 174.62 175.44 2kc5 n GLU 3 N -3.12 3.41 -4.01 3.99 1.02 -1.26 -4.86 120.64 115.81 2kc5 n GLU 3 Ca 0.07 -2.44 -0.08 0.00 -0.02 0.00 0.00 57.16 54.69 2kc5 n GLU 3 Cb 0.54 -2.45 -0.09 0.00 -0.02 0.00 0.00 31.44 29.42 2kc5 n GLU 3 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 2kc5 s GLU 4 N -0.03 0.82 -0.04 3.49 2.02 -1.26 -1.21 118.70 122.49 2kc5 s GLU 4 Ca 0.62 -1.17 0.02 0.00 0.02 0.00 0.00 54.97 54.46 2kc5 s GLU 4 Cb 0.25 0.28 0.01 0.00 0.10 0.00 0.00 34.13 34.78 2kc5 s GLU 4 CO -0.10 -0.23 -0.08 0.42 0.02 0.00 0.00 175.26 175.29 2kc5 s ILE 5 N -3.93 0.78 0.02 -1.63 1.01 0.57 -4.48 121.20 113.53 2kc5 s ILE 5 Ca 0.11 -0.30 -0.30 0.00 0.00 0.00 0.00 60.65 60.16 2kc5 s ILE 5 Cb 0.06 -0.73 -0.05 0.00 0.01 0.00 0.00 42.46 41.75 2kc5 s ILE 5 CO -0.07 0.27 1.20 0.00 0.00 0.00 0.00 174.94 176.33 2kc5 s ALA 6 N 0.60 3.42 0.53 9.38 0.00 -1.26 -0.99 121.76 133.43 2kc5 s ALA 6 Ca -0.10 0.76 -0.22 0.00 0.00 0.00 0.00 51.96 52.40 2kc5 s ALA 6 Cb -0.13 -3.47 -0.05 0.00 0.00 0.00 0.00 23.12 19.47 2kc5 s ALA 6 CO 0.01 -0.55 1.34 0.20 0.00 0.00 0.00 175.76 176.76 2kc5 s GLY 7 N 1.23 2.88 -0.01 0.00 0.00 0.02 -4.93 107.32 106.52 2kc5 s GLY 7 Ca 0.58 1.30 -0.15 0.00 0.00 0.00 0.00 44.72 46.44 2kc5 s GLY 7 CO 0.27 1.82 0.42 -1.36 0.00 0.00 0.00 173.10 174.25 2kc5 s PHE 8 N -1.32 3.71 0.24 1.90 0.08 -0.32 -4.53 117.98 117.73 2kc5 s PHE 8 Ca 0.70 0.99 0.25 0.00 0.12 0.00 0.00 56.93 58.99 2kc5 s PHE 8 Cb -0.39 -2.33 1.10 0.00 -0.57 0.00 0.00 43.02 40.83 2kc5 s PHE 8 CO 0.47 0.59 1.91 1.96 -0.10 0.00 0.00 175.22 180.05 2kc5 h GLN 9 N 4.94 0.00 -2.81 0.44 7.50 -1.85 -2.57 115.11 120.75 2kc5 h GLN 9 Ca -0.50 0.00 0.08 0.00 0.50 0.00 0.00 58.65 58.73 2kc5 h GLN 9 Cb 1.21 0.00 -0.05 0.00 0.05 0.00 0.00 27.48 28.70 2kc5 h GLN 9 CO 0.63 0.20 0.32 -0.08 -1.50 0.00 0.00 178.83 178.40 2kc5 s THR 10 N -3.84 0.00 0.34 -0.54 -1.32 -1.26 -4.68 115.64 104.34 2kc5 s THR 10 Ca -0.01 -0.89 -0.29 0.00 -1.21 0.00 0.00 61.69 59.29 2kc5 s THR 10 Cb 0.11 -2.24 -0.11 0.00 -1.51 0.00 0.00 72.50 68.75 2kc5 s THR 10 CO 0.62 0.00 1.51 -0.44 -2.21 0.00 0.00 174.62 174.10 2kc5 s SER 11 N -2.99 6.39 0.00 8.08 0.01 -1.26 -4.90 113.70 119.03 2kc5 s SER 11 Ca 0.13 2.98 -0.02 0.00 1.31 0.00 0.00 55.95 60.35 2kc5 s SER 11 Cb -0.05 -2.65 -0.11 0.00 0.21 0.00 0.00 66.02 63.42 2kc5 s SER 11 CO 0.07 -0.86 1.83 -2.65 0.41 0.00 0.00 173.24 172.04 2kc5 n PRO 12 N 1.11 0.89 0.04 12.44 -0.02 -1.26 -4.73 135.00 143.46 2kc5 n PRO 12 Ca 0.03 -0.40 -0.13 0.00 -2.02 0.00 0.00 63.50 60.99 2kc5 n PRO 12 Cb 0.39 -1.65 -0.06 0.00 -0.02 0.00 0.00 33.50 32.15 2kc5 n PRO 12 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 2kc5 h LYS 13 N 4.16 -0.52 -0.37 -0.52 3.64 -1.96 0.14 116.57 121.15 2kc5 h LYS 13 Ca 0.08 0.04 -0.14 0.00 -1.27 0.00 0.00 60.65 59.36 2kc5 h LYS 13 Cb 0.70 0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.62 2kc5 h LYS 13 CO 0.30 -0.35 -0.31 0.00 -2.27 0.00 0.00 179.45 176.82 2kc5 h ALA 14 N 0.04 0.75 -0.44 5.00 0.00 -1.94 -1.55 119.26 121.12 2kc5 h ALA 14 Ca 0.06 -0.42 -0.00 0.00 0.00 0.00 0.00 54.91 54.55 2kc5 h ALA 14 Cb 0.64 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 2kc5 h ALA 14 CO -0.35 0.66 0.26 1.96 0.00 0.00 0.00 179.25 181.78 2kc5 h GLN 15 N 0.68 0.60 -0.53 0.00 4.20 -1.72 0.13 115.11 118.45 2kc5 h GLN 15 Ca 0.07 -0.06 -0.05 0.00 0.06 0.00 0.00 58.65 58.67 2kc5 h GLN 15 Cb 0.86 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 28.49 2kc5 h GLN 15 CO 0.08 0.45 0.13 0.28 -0.67 0.00 0.00 178.83 179.09 2kc5 h VAL 16 N 0.58 1.24 0.15 -0.54 2.07 -0.62 -1.20 116.25 117.93 2kc5 h VAL 16 Ca 0.16 -0.87 -0.01 0.00 0.82 0.00 0.00 66.70 66.80 2kc5 h VAL 16 Cb 0.01 0.79 0.00 0.00 -1.52 0.00 0.00 31.29 30.57 2kc5 h VAL 16 CO -0.03 0.32 -0.07 -0.61 0.02 0.00 0.00 177.57 177.20 2kc5 h GLN 17 N 0.75 -0.19 -0.66 1.57 4.15 -0.77 -0.92 115.11 119.04 2kc5 h GLN 17 Ca 0.17 0.01 -0.07 0.00 0.77 0.00 0.00 58.65 59.53 2kc5 h GLN 17 Cb 0.34 0.04 -0.03 0.00 0.21 0.00 0.00 27.48 28.04 2kc5 h GLN 17 CO 0.00 -0.08 0.12 0.00 -1.93 0.00 0.00 178.83 176.95 2kc5 h ALA 18 N 0.59 0.97 -0.34 3.38 0.00 -0.70 0.12 119.26 123.28 2kc5 h ALA 18 Ca -0.02 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.62 2kc5 h ALA 18 Cb 0.20 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 2kc5 h ALA 18 CO 0.03 0.65 0.18 0.00 0.00 0.00 0.00 179.25 180.12 2kc5 h ALA 19 N 1.11 0.44 0.00 0.00 0.00 -1.10 -2.07 119.26 117.64 2kc5 h ALA 19 Ca 0.20 -0.08 -0.08 0.00 0.00 0.00 0.00 54.91 54.95 2kc5 h ALA 19 Cb 0.41 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 2kc5 h ALA 19 CO 0.01 -0.02 -0.39 0.74 0.00 0.00 0.00 179.25 179.59 2kc5 h PHE 20 N 0.42 0.00 0.00 0.00 0.04 -0.70 0.91 116.94 117.62 2kc5 h PHE 20 Ca 0.12 0.00 -0.05 0.00 2.80 0.00 0.00 57.97 60.84 2kc5 h PHE 20 Cb 0.08 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.22 2kc5 h PHE 20 CO -0.02 0.39 -0.25 1.49 -0.60 0.00 0.00 178.31 179.32 2kc5 h GLU 21 N 0.00 0.00 0.06 1.51 4.22 -0.49 0.12 114.58 120.00 2kc5 h GLU 21 Ca -0.00 0.00 -0.12 0.00 0.08 0.00 0.00 59.36 59.32 2kc5 h GLU 21 Cb 0.94 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.19 2kc5 h GLU 21 CO 0.05 0.25 -0.56 1.49 -2.18 0.00 0.00 179.01 178.05 2kc5 h GLU 22 N 0.00 0.12 -0.43 1.92 4.81 -0.67 -3.23 114.58 117.10 2kc5 h GLU 22 Ca -0.00 -0.21 -0.12 0.00 -0.13 0.00 0.00 59.36 58.89 2kc5 h GLU 22 Cb 0.47 0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.91 2kc5 h GLU 22 CO 0.03 1.10 -0.22 0.82 -0.73 0.00 0.00 179.01 180.02 2kc5 h ILE 23 N -0.72 1.27 -0.02 2.32 2.04 -0.72 0.12 117.51 121.81 2kc5 h ILE 23 Ca -0.12 -1.35 -0.05 0.00 1.00 0.00 0.00 64.86 64.34 2kc5 h ILE 23 Cb 1.33 1.17 -0.01 0.00 -0.74 0.00 0.00 36.82 38.57 2kc5 h ILE 23 CO 0.03 0.46 -0.22 0.00 0.00 0.00 0.00 178.15 178.42 2kc5 h ALA 24 N 1.00 1.60 0.03 1.87 0.00 -0.93 -1.53 119.26 121.30 2kc5 h ALA 24 Ca 0.10 -0.21 -0.25 0.00 0.00 0.00 0.00 54.91 54.55 2kc5 h ALA 24 Cb 0.75 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.51 2kc5 h ALA 24 CO 0.06 0.30 -1.05 -0.09 0.00 0.00 0.00 179.25 178.47 2kc5 h ARG 25 N 0.04 0.51 -0.95 0.00 2.43 -1.40 -3.19 114.38 111.82 2kc5 h ARG 25 Ca 0.01 -0.60 0.12 0.00 -0.81 0.00 0.00 59.98 58.70 2kc5 h ARG 25 Cb 0.41 0.18 -0.08 0.00 -0.42 0.00 0.00 29.97 30.06 2kc5 h ARG 25 CO 0.03 1.22 0.61 -0.09 -1.51 0.00 0.00 179.97 180.23 2kc5 h ARG 26 N 0.27 0.88 0.00 0.20 9.65 -0.14 0.11 114.38 125.35 2kc5 h ARG 26 Ca -0.12 -0.05 0.00 0.00 -1.10 0.00 0.00 59.98 58.71 2kc5 h ARG 26 Cb 1.71 -0.20 0.00 0.00 -1.39 0.00 0.00 29.97 30.09 2kc5 h ARG 26 CO 0.19 0.58 0.00 0.43 2.80 0.00 0.00 179.97 183.98 2kc5 n SER 27 N -4.58 0.00 -1.26 -3.80 7.64 -0.66 -2.08 113.62 108.89 2kc5 n SER 27 Ca 0.18 0.39 -0.05 0.00 1.01 0.00 0.00 58.87 60.40 2kc5 n SER 27 Cb 0.36 -0.44 0.12 0.00 -1.01 0.00 0.00 64.21 63.25 2kc5 n SER 27 CO 0.00 0.00 0.00 0.23 -3.01 0.00 0.00 175.04 172.26 2kc5 n MET 28 N -1.44 2.21 -1.46 1.43 2.81 0.35 -5.10 117.12 115.92 2kc5 n MET 28 Ca 0.04 -3.53 -0.36 0.00 -1.81 0.00 0.00 57.70 52.03 2kc5 n MET 28 Cb 0.12 -1.74 0.08 0.00 -0.71 0.00 0.00 33.22 30.96 2kc5 n MET 28 CO 0.00 0.00 0.00 -2.39 1.51 0.00 0.00 175.97 175.09 2kc5 n HIS 29 N -0.84 0.78 0.00 2.03 -0.00 -0.88 -1.93 115.22 114.38 2kc5 n HIS 29 Ca 0.26 0.41 0.00 0.00 -0.00 0.00 0.00 57.72 58.39 2kc5 n HIS 29 Cb 0.82 -2.11 0.00 0.00 -0.00 0.00 0.00 29.99 28.71 2kc5 n HIS 29 CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 176.34 172.87 2kc5 n ASP 30 N -1.44 0.00 -1.32 4.39 2.03 -1.26 -4.57 116.55 114.38 2kc5 n ASP 30 Ca 0.13 0.00 -0.02 0.00 0.52 0.00 0.00 54.79 55.42 2kc5 n ASP 30 Cb 0.49 0.00 0.15 0.00 -0.72 0.00 0.00 41.12 41.04 2kc5 n ASP 30 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 2kc5 n LEU 31 N 0.00 3.81 0.24 -2.67 4.32 -0.81 -4.65 117.00 117.24 2kc5 n LEU 31 Ca 0.00 -1.96 0.17 0.00 -0.02 0.00 0.00 56.01 54.20 2kc5 n LEU 31 Cb 0.00 -0.61 0.88 0.00 -1.62 0.00 0.00 43.42 42.06 2kc5 n LEU 31 CO 0.00 0.55 1.00 0.28 -1.22 0.00 0.00 177.39 178.00 2kc5 h SER 32 N 1.31 0.00 0.60 -1.43 0.02 -1.74 -0.89 113.55 111.41 2kc5 h SER 32 Ca 0.12 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.07 2kc5 h SER 32 Cb 1.46 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.00 2kc5 h SER 32 CO 0.34 0.00 0.00 2.19 -1.14 0.00 0.00 176.83 178.22 2kc5 h PHE 33 N 0.00 0.00 -4.28 3.45 -5.15 -1.89 -3.45 116.94 105.62 2kc5 h PHE 33 Ca 0.00 0.00 -0.52 0.00 -0.20 0.00 0.00 57.97 57.25 2kc5 h PHE 33 Cb 0.02 0.00 0.16 0.00 0.22 0.00 0.00 35.95 36.34 2kc5 h PHE 33 CO 0.00 0.00 0.28 -0.51 -2.00 0.00 0.00 178.31 176.08 2kc5 s LEU 34 N -5.57 2.93 0.23 2.10 1.43 -0.34 -5.09 118.68 114.37 2kc5 s LEU 34 Ca 0.00 1.94 0.11 0.00 -1.03 0.00 0.00 54.13 55.16 2kc5 s LEU 34 Cb 0.10 -4.51 -0.05 0.00 0.03 0.00 0.00 46.19 41.76 2kc5 s LEU 34 CO 0.43 -2.45 -0.20 -1.38 0.23 0.00 0.00 176.35 172.98 2kc5 s HIS 35 N -2.81 2.34 0.26 0.29 -3.43 -1.26 -5.04 115.29 105.64 2kc5 s HIS 35 Ca 0.63 -0.33 -0.31 0.00 -0.80 0.00 0.00 55.06 54.26 2kc5 s HIS 35 Cb -0.19 -1.09 -0.12 0.00 -1.43 0.00 0.00 32.58 29.75 2kc5 s HIS 35 CO 0.57 0.60 1.52 -2.30 -2.00 0.00 0.00 174.74 173.13 2kc5 n PRO 36 N -0.20 2.41 0.15 -0.38 -0.02 -1.26 -4.89 135.00 130.80 2kc5 n PRO 36 Ca -0.09 0.86 0.13 0.00 -2.02 0.00 0.00 63.50 62.38 2kc5 n PRO 36 Cb 0.58 -2.59 0.50 0.00 -0.02 0.00 0.00 33.50 31.97 2kc5 n PRO 36 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 2kc5 h SER 37 N 4.66 0.00 -4.32 2.55 0.02 -1.99 -3.42 113.55 111.05 2kc5 h SER 37 Ca -0.46 0.00 -0.17 0.00 -0.84 0.00 0.00 61.79 60.32 2kc5 h SER 37 Cb 1.25 0.00 -0.24 0.00 0.14 0.00 0.00 62.40 63.55 2kc5 h SER 37 CO 0.79 0.00 -0.50 -0.32 -1.14 0.00 0.00 176.83 175.65 2kc5 s MET 38 N -3.33 0.33 0.31 3.45 -2.45 -1.26 -5.04 119.30 111.31 2kc5 s MET 38 Ca 0.05 -0.04 -0.28 0.00 -1.25 0.00 0.00 55.69 54.16 2kc5 s MET 38 Cb 0.10 0.14 -0.13 0.00 1.25 0.00 0.00 34.83 36.19 2kc5 s MET 38 CO 0.44 -0.07 1.16 -2.30 1.05 0.00 0.00 175.02 175.30 2kc5 n PRO 39 N 2.30 1.73 -3.16 4.11 -0.02 -1.26 -3.79 135.00 134.91 2kc5 n PRO 39 Ca -0.17 0.61 -0.42 0.00 -2.02 0.00 0.00 63.50 61.49 2kc5 n PRO 39 Cb 0.57 -2.09 -0.07 0.00 -0.02 0.00 0.00 33.50 31.89 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 -1.02 4.90 0.07 -1.45 1.01 -1.26 -4.03 120.40 118.63 2kc5 s VAL 40 Ca 0.58 0.19 -0.07 0.00 0.00 0.00 0.00 61.98 62.67 2kc5 s VAL 40 Cb -0.64 -4.12 -0.01 0.00 0.00 0.00 0.00 36.38 31.61 2kc5 s VAL 40 CO 0.61 -0.45 0.14 -0.47 0.00 0.00 0.00 175.10 174.92 2kc5 s TYR 41 N 2.64 0.21 -0.04 5.22 5.04 -0.51 -4.95 117.35 124.97 2kc5 s TYR 41 Ca 0.21 -0.63 -0.01 0.00 -2.44 0.00 0.00 57.07 54.20 2kc5 s TYR 41 Cb -0.15 -0.12 0.03 0.00 0.35 0.00 0.00 41.96 42.07 2kc5 s TYR 41 CO 0.17 -0.49 0.04 0.08 -1.34 0.00 0.00 175.55 174.01 2kc5 s VAL 42 N -3.61 -0.01 0.32 3.14 1.01 -1.26 -0.80 120.40 119.19 2kc5 s VAL 42 Ca 0.03 0.30 -0.07 0.00 0.00 0.00 0.00 61.98 62.24 2kc5 s VAL 42 Cb 0.04 -0.18 -0.06 0.00 0.00 0.00 0.00 36.38 36.18 2kc5 s VAL 42 CO -0.09 0.16 0.63 -0.44 0.00 0.00 0.00 175.10 175.35 2kc5 s SER 43 N 1.70 6.48 0.08 3.32 0.01 0.25 -4.94 113.70 120.60 2kc5 s SER 43 Ca -0.01 0.86 0.09 0.00 1.31 0.00 0.00 55.95 58.21 2kc5 s SER 43 Cb -0.12 -2.21 -0.03 0.00 0.21 0.00 0.00 66.02 63.86 2kc5 s SER 43 CO -0.03 -0.26 -0.24 1.51 0.41 0.00 0.00 173.24 174.63 2kc5 s ASP 44 N -3.13 3.42 0.27 2.44 -4.77 -1.26 -1.72 116.67 111.92 2kc5 s ASP 44 Ca 0.46 -0.61 -0.16 0.00 -3.30 0.00 0.00 52.55 48.94 2kc5 s ASP 44 Cb -0.11 -0.36 0.01 0.00 -1.09 0.00 0.00 42.92 41.38 2kc5 s ASP 44 CO 0.30 0.22 0.60 -0.36 0.70 0.00 0.00 175.17 176.63 2kc5 s PHE 45 N -0.95 0.12 0.00 2.11 0.08 -0.16 -4.90 117.98 114.27 2kc5 s PHE 45 Ca 0.14 -0.53 0.00 0.00 0.12 0.00 0.00 56.93 56.66 2kc5 s PHE 45 Cb -0.10 0.44 0.00 0.00 -0.57 0.00 0.00 43.02 42.78 2kc5 s PHE 45 CO 0.05 -1.12 0.00 2.41 -0.10 0.00 0.00 175.22 176.46 2kc5 n THR 46 N -0.42 0.00 -2.93 0.64 -1.04 -1.25 -2.42 114.28 106.86 2kc5 n THR 46 Ca -0.03 0.00 -0.42 0.00 -2.04 0.00 0.00 64.05 61.56 2kc5 n THR 46 Cb 0.61 0.00 -0.05 0.00 -1.82 0.00 0.00 70.33 69.07 2kc5 n THR 46 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 2kc5 s LEU 47 N 0.00 4.08 -0.26 -4.42 1.43 -1.26 -0.97 118.68 117.27 2kc5 s LEU 47 Ca 0.00 0.83 0.02 0.00 -1.03 0.00 0.00 54.13 53.96 2kc5 s LEU 47 Cb 0.00 -3.12 0.06 0.00 0.03 0.00 0.00 46.19 43.17 2kc5 s LEU 47 CO 0.00 -0.56 -0.07 0.12 0.23 0.00 0.00 176.35 176.06 2kc5 s PHE 48 N 2.89 3.03 -1.47 0.29 5.36 0.92 -4.57 117.98 124.44 2kc5 s PHE 48 Ca 0.33 -2.21 -0.12 0.00 -0.96 0.00 0.00 56.93 53.97 2kc5 s PHE 48 Cb -0.15 -1.91 0.08 0.00 -0.34 0.00 0.00 43.02 40.70 2kc5 s PHE 48 CO 0.10 -0.86 0.76 0.39 -1.46 0.00 0.00 175.22 174.16 2kc5 n GLU 49 N 4.49 -4.53 -1.01 10.12 -0.58 -1.26 -1.55 120.64 126.33 2kc5 n GLU 49 Ca -0.12 0.57 -0.00 0.00 -0.42 0.00 0.00 57.16 57.19 2kc5 n GLU 49 Cb 0.43 -5.39 -0.00 0.00 -0.57 0.00 0.00 31.44 25.91 2kc5 n GLU 49 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2kc5 n GLY 50 N -1.47 0.47 3.23 0.62 0.00 -1.26 -5.01 105.19 101.77 2kc5 n GLY 50 Ca 0.01 -0.40 -0.30 0.00 0.00 0.00 0.00 46.02 45.33 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 -0.82 2.43 0.41 1.61 -0.21 -0.59 -1.59 119.66 120.89 2kc5 s GLN 51 Ca 0.00 -0.84 -0.26 0.00 0.02 0.00 0.00 55.36 54.28 2kc5 s GLN 51 Cb 0.00 -2.04 -0.09 0.00 1.00 0.00 0.00 33.01 31.88 2kc5 s GLN 51 CO 0.00 0.33 1.37 -1.58 -2.12 0.00 0.00 175.29 173.29 2kc5 s TRP 52 N -0.07 2.68 0.38 0.91 0.52 0.54 -0.05 118.94 123.85 2kc5 s TRP 52 Ca -0.05 1.32 0.02 0.00 0.02 0.00 0.00 56.10 57.41 2kc5 s TRP 52 Cb -0.14 -3.81 -0.02 0.00 -1.15 0.00 0.00 33.47 28.36 2kc5 s TRP 52 CO 0.04 -2.50 0.57 0.95 0.02 0.00 0.00 176.95 176.03 2kc5 s THR 53 N -1.21 4.44 0.22 2.01 -4.23 -0.15 -1.22 115.64 115.51 2kc5 s THR 53 Ca 0.57 -0.62 -0.22 0.00 -1.18 0.00 0.00 61.69 60.23 2kc5 s THR 53 Cb -0.41 -3.61 0.06 0.00 1.34 0.00 0.00 72.50 69.87 2kc5 s THR 53 CO 0.54 -0.37 0.91 -0.83 -0.54 0.00 0.00 174.62 174.33 2kc5 s GLY 54 N -4.14 -0.05 0.02 3.99 0.00 0.36 -0.99 107.32 106.52 2kc5 s GLY 54 Ca 0.44 -0.18 0.02 0.00 0.00 0.00 0.00 44.72 45.00 2kc5 s GLY 54 CO 0.35 0.45 -0.07 0.00 0.00 0.00 0.00 173.10 173.83 2kc5 s VAL 56 N -0.86 2.35 0.14 0.00 0.11 0.14 -0.59 120.40 121.69 2kc5 s VAL 56 Ca -0.05 -1.09 0.10 0.00 -2.93 0.00 0.00 61.98 58.00 2kc5 s VAL 56 Cb -0.07 -1.88 -0.04 0.00 -1.53 0.00 0.00 36.38 32.87 2kc5 s VAL 56 CO 0.00 0.52 -0.23 -0.51 -3.33 0.00 0.00 175.10 171.55 2kc5 s ILE 57 N -0.70 2.00 0.33 7.04 2.07 0.02 -1.03 121.20 130.92 2kc5 s ILE 57 Ca 0.11 -1.78 0.06 0.00 -1.41 0.00 0.00 60.65 57.63 2kc5 s ILE 57 Cb -0.10 -1.84 -0.03 0.00 0.13 0.00 0.00 42.46 40.62 2kc5 s ILE 57 CO 0.01 -0.09 0.31 0.42 -1.91 0.00 0.00 174.94 173.68 2kc5 s THR 58 N -1.42 0.00 -0.62 4.00 -4.23 -0.03 -1.43 115.64 111.91 2kc5 s THR 58 Ca 0.13 -1.94 0.20 0.00 -1.18 0.00 0.00 61.69 58.90 2kc5 s THR 58 Cb -0.09 -2.52 0.20 0.00 1.34 0.00 0.00 72.50 71.43 2kc5 s THR 58 CO 0.06 0.00 1.61 -0.81 -0.54 0.00 0.00 174.62 174.94 2kc5 n PRO 59 N -0.61 0.13 -0.01 3.99 -0.04 -1.25 -3.84 135.00 133.37 2kc5 n PRO 59 Ca 0.06 0.40 0.04 0.00 -0.04 0.00 0.00 63.50 63.96 2kc5 n PRO 59 Cb 0.62 -1.76 -0.07 0.00 -0.04 0.00 0.00 33.50 32.25 2kc5 n PRO 59 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 2kc5 n TRP 60 N -2.01 0.00 -3.53 0.54 4.27 -1.26 -4.24 117.44 111.21 2kc5 n TRP 60 Ca 0.02 0.00 -0.11 0.00 -3.89 0.00 0.00 57.50 53.52 2kc5 n TRP 60 Cb 0.19 -0.23 -0.03 0.00 -1.36 0.00 0.00 31.31 29.88 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 -2.58 1.22 -0.09 -2.67 0.23 -1.25 -4.57 119.30 109.60 2kc5 s MET 61 Ca -0.03 -0.60 0.00 0.00 -1.03 0.00 0.00 55.69 54.03 2kc5 s MET 61 Cb 0.05 0.54 0.02 0.00 -1.53 0.00 0.00 34.83 33.92 2kc5 s MET 61 CO 0.37 -0.52 -0.07 -1.17 -2.03 0.00 0.00 175.02 171.60 2kc5 s LEU 62 N -2.78 1.21 -0.04 0.18 0.20 -0.34 -0.85 118.68 116.26 2kc5 s LEU 62 Ca 0.03 -0.25 0.01 0.00 0.69 0.00 0.00 54.13 54.61 2kc5 s LEU 62 Cb -0.00 -0.74 0.02 0.00 -0.43 0.00 0.00 46.19 45.04 2kc5 s LEU 62 CO -0.11 -0.09 -0.05 -0.44 -0.29 0.00 0.00 176.35 175.36 2kc5 s SER 63 N 1.44 0.90 0.42 3.68 0.01 -0.20 -0.82 113.70 119.13 2kc5 s SER 63 Ca -0.01 -0.13 -0.24 0.00 1.31 0.00 0.00 55.95 56.88 2kc5 s SER 63 Cb -0.13 -0.38 -0.08 0.00 0.21 0.00 0.00 66.02 65.63 2kc5 s SER 63 CO -0.04 -0.02 1.15 0.00 0.41 0.00 0.00 173.24 174.73 2kc5 s ALA 64 N 0.68 3.07 0.03 1.44 0.00 0.07 -0.69 121.76 126.37 2kc5 s ALA 64 Ca -0.09 0.91 0.02 0.00 0.00 0.00 0.00 51.96 52.80 2kc5 s ALA 64 Cb -0.12 -3.36 -0.02 0.00 0.00 0.00 0.00 23.12 19.61 2kc5 s ALA 64 CO 0.00 -0.52 -0.08 0.14 0.00 0.00 0.00 175.76 175.30 2kc5 s VAL 65 N -1.51 0.55 -0.00 0.00 -7.23 -0.01 -0.85 120.40 111.35 2kc5 s VAL 65 Ca 0.60 -0.91 0.00 0.00 -1.81 0.00 0.00 61.98 59.86 2kc5 s VAL 65 Cb -0.28 -0.58 0.00 0.00 0.56 0.00 0.00 36.38 36.08 2kc5 s VAL 65 CO 0.35 -0.26 -0.00 -0.63 -0.31 0.00 0.00 175.10 174.25 2kc5 s ILE 66 N -1.10 0.02 -0.01 -0.62 1.01 0.36 -0.49 121.20 120.37 2kc5 s ILE 66 Ca -0.07 0.01 0.03 0.00 0.00 0.00 0.00 60.65 60.62 2kc5 s ILE 66 Cb -0.08 -0.04 -0.01 0.00 0.01 0.00 0.00 42.46 42.34 2kc5 s ILE 66 CO 0.00 0.02 -0.11 -0.36 0.00 0.00 0.00 174.94 174.49 2kc5 s PHE 67 N 0.11 1.06 0.13 3.97 0.08 -0.35 -1.11 117.98 121.88 2kc5 s PHE 67 Ca -0.01 -0.22 -0.35 0.00 0.12 0.00 0.00 56.93 56.47 2kc5 s PHE 67 Cb -0.02 -0.70 -0.15 0.00 -0.57 0.00 0.00 43.02 41.58 2kc5 s PHE 67 CO -0.00 -0.04 1.47 -2.30 -0.10 0.00 0.00 175.22 174.25 2kc5 n PRO 68 N 2.90 1.73 0.00 0.24 -0.02 -1.26 -0.34 135.00 138.25 2kc5 n PRO 68 Ca -0.15 0.62 0.00 0.00 -2.02 0.00 0.00 63.50 61.96 2kc5 n PRO 68 Cb 0.56 -2.34 0.00 0.00 -0.02 0.00 0.00 33.50 31.70 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 3.02 -1.06 3.75 -1.23 0.00 -0.62 -1.18 105.19 107.87 2kc5 n GLY 69 Ca 0.17 -1.65 -0.30 0.00 0.00 0.00 0.00 46.02 44.25 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 -2.05 1.65 -1.33 1.61 0.02 -0.97 -1.85 135.00 132.08 2kc5 s PRO 70 Ca 0.00 0.79 -0.18 0.00 0.02 0.00 0.00 61.00 61.63 2kc5 s PRO 70 Cb 0.00 -1.86 0.02 0.00 0.02 0.00 0.00 34.50 32.68 2kc5 s PRO 70 CO 0.00 -1.96 0.46 -3.47 -0.33 0.00 0.00 177.00 171.70 2kc5 n ASP 71 N -3.69 -2.27 -3.70 2.53 2.03 -1.26 -4.90 116.55 105.30 2kc5 n ASP 71 Ca 0.07 -1.22 -0.14 0.00 0.52 0.00 0.00 54.79 54.02 2kc5 n ASP 71 Cb 0.55 -2.05 -0.08 0.00 -0.72 0.00 0.00 41.12 38.83 2kc5 n ASP 71 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2kc5 s GLN 72 N -7.13 0.75 -0.55 -0.67 -2.07 -1.26 -5.03 119.66 103.69 2kc5 s GLN 72 Ca 0.28 0.03 -0.05 0.00 -1.82 0.00 0.00 55.36 53.81 2kc5 s GLN 72 Cb -0.14 0.34 0.14 0.00 -1.09 0.00 0.00 33.01 32.26 2kc5 s GLN 72 CO 0.96 -0.20 0.38 -0.51 -1.32 0.00 0.00 175.29 174.59 2kc5 s LEU 73 N -1.08 5.44 0.50 2.60 1.02 -1.26 -0.80 118.68 125.10 2kc5 s LEU 73 Ca -0.11 -2.43 -0.20 0.00 0.02 0.00 0.00 54.13 51.41 2kc5 s LEU 73 Cb -0.04 -1.90 -0.08 0.00 0.02 0.00 0.00 46.19 44.19 2kc5 s LEU 73 CO 0.05 -0.49 1.03 0.86 0.02 0.00 0.00 176.35 177.82 2kc5 s TRP 74 N 0.57 3.02 0.47 0.29 -0.00 -0.16 -4.85 118.94 118.27 2kc5 s TRP 74 Ca 0.12 1.57 -0.23 0.00 -0.00 0.00 0.00 56.10 57.56 2kc5 s TRP 74 Cb -0.21 -3.04 -0.07 0.00 -0.00 0.00 0.00 33.47 30.15 2kc5 s TRP 74 CO -0.04 -0.81 1.23 -2.14 -0.00 0.00 0.00 176.95 175.19 2kc5 s PRO 75 N -3.36 3.64 0.08 5.86 0.02 -1.26 -0.32 135.00 139.67 2kc5 s PRO 75 Ca 0.66 1.95 -0.31 0.00 0.02 0.00 0.00 61.00 63.32 2kc5 s PRO 75 Cb -0.16 -2.43 -0.08 0.00 0.02 0.00 0.00 34.50 31.86 2kc5 s PRO 75 CO 0.22 -0.70 1.53 -1.17 -0.33 0.00 0.00 177.00 176.56 2kc5 s LEU 76 N -3.05 4.36 0.30 -5.54 2.96 -0.35 -4.51 118.68 112.85 2kc5 s LEU 76 Ca 0.64 2.41 0.04 0.00 -0.22 0.00 0.00 54.13 57.00 2kc5 s LEU 76 Cb -0.33 -3.57 -0.02 0.00 0.50 0.00 0.00 46.19 42.76 2kc5 s LEU 76 CO 0.40 -0.80 0.45 -0.13 -1.32 0.00 0.00 176.35 174.95 2kc5 s ARG 77 N 1.99 3.33 -0.06 1.98 1.81 -1.26 -4.86 118.95 121.88 2kc5 s ARG 77 Ca 0.69 -0.73 -0.12 0.00 -1.72 0.00 0.00 55.73 53.85 2kc5 s ARG 77 Cb -0.38 -2.80 -0.05 0.00 -0.45 0.00 0.00 34.95 31.26 2kc5 s ARG 77 CO 0.30 0.22 0.30 0.21 -0.68 0.00 0.00 175.30 175.66 2kc5 s LYS 78 N -4.14 3.76 0.46 3.54 2.36 -1.26 -5.08 119.74 119.39 2kc5 s LYS 78 Ca 0.39 0.18 -0.14 0.00 -2.55 0.00 0.00 55.97 53.85 2kc5 s LYS 78 Cb -0.09 -3.23 -0.07 0.00 -1.05 0.00 0.00 37.83 33.39 2kc5 s LYS 78 CO 0.32 0.69 0.89 0.08 1.55 0.00 0.00 175.35 178.87 2kc5 s VAL 79 N -0.93 4.63 0.00 4.02 1.01 -1.26 -3.67 120.40 124.20 2kc5 s VAL 79 Ca 0.20 0.98 0.00 0.00 0.00 0.00 0.00 61.98 63.16 2kc5 s VAL 79 Cb -0.15 -3.72 0.00 0.00 0.00 0.00 0.00 36.38 32.52 2kc5 s VAL 79 CO 0.09 -0.60 0.00 -1.20 0.00 0.00 0.00 175.10 173.39 2kc5 n SER 80 N -1.41 -4.56 -4.87 3.32 7.64 0.13 -4.98 113.62 108.89 2kc5 n SER 80 Ca 0.05 0.00 -0.31 0.00 1.01 0.00 0.00 58.87 59.62 2kc5 n SER 80 Cb 0.54 -2.50 0.02 0.00 -1.01 0.00 0.00 64.21 61.26 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 -1.32 3.47 -0.02 1.43 0.41 -1.24 -4.81 118.70 116.62 2kc5 s GLU 81 Ca 0.00 0.71 0.04 0.00 -0.41 0.00 0.00 54.97 55.31 2kc5 s GLU 81 Cb 0.00 -2.07 -0.03 0.00 -1.78 0.00 0.00 34.13 30.25 2kc5 s GLU 81 CO 0.00 -0.66 -0.11 0.15 -0.49 0.00 0.00 175.26 174.15 2kc5 s LYS 82 N -5.20 2.48 -0.18 1.61 1.02 -1.26 -0.41 119.74 117.79 2kc5 s LYS 82 Ca 0.56 -0.73 0.00 0.00 0.02 0.00 0.00 55.97 55.81 2kc5 s LYS 82 Cb -0.11 -2.41 0.01 0.00 -0.52 0.00 0.00 37.83 34.80 2kc5 s LYS 82 CO 0.54 0.61 -0.17 0.42 -0.92 0.00 0.00 175.35 175.82 2kc5 s ILE 83 N -0.87 2.35 -0.05 2.17 -1.09 0.08 -4.96 121.20 118.83 2kc5 s ILE 83 Ca 0.14 -0.85 -0.30 0.00 -2.23 0.00 0.00 60.65 57.41 2kc5 s ILE 83 Cb -0.11 -2.00 -0.03 0.00 -1.58 0.00 0.00 42.46 38.74 2kc5 s ILE 83 CO 0.04 0.52 1.20 -0.83 -1.23 0.00 0.00 174.94 174.64 2kc5 s GLY 84 N 1.22 2.11 0.01 6.18 0.00 -1.26 -0.80 107.32 114.77 2kc5 s GLY 84 Ca 0.03 0.62 0.08 0.00 0.00 0.00 0.00 44.72 45.45 2kc5 s GLY 84 CO -0.09 2.21 -0.26 1.08 0.00 0.00 0.00 173.10 176.05 2kc5 s LEU 85 N 2.19 2.10 -0.14 0.66 1.43 -0.53 -4.97 118.68 119.43 2kc5 s LEU 85 Ca 0.56 -0.51 -0.19 0.00 -1.03 0.00 0.00 54.13 52.96 2kc5 s LEU 85 Cb -0.25 -1.28 -0.04 0.00 0.03 0.00 0.00 46.19 44.65 2kc5 s LEU 85 CO 0.22 0.29 0.51 -1.58 0.23 0.00 0.00 176.35 176.02 2kc5 s GLN 86 N -0.86 4.31 0.14 1.70 -0.44 -1.26 -1.34 119.66 121.90 2kc5 s GLN 86 Ca 0.10 0.49 0.02 0.00 -2.50 0.00 0.00 55.36 53.47 2kc5 s GLN 86 Cb -0.10 -3.47 -0.04 0.00 -1.64 0.00 0.00 33.01 27.76 2kc5 s GLN 86 CO 0.00 0.06 -0.04 -0.51 0.50 0.00 0.00 175.29 175.31 2kc5 s LEU 87 N 0.93 2.33 0.64 3.68 1.02 -1.22 -4.97 118.68 121.09 2kc5 s LEU 87 Ca 0.27 -1.08 0.39 0.00 0.02 0.00 0.00 54.13 53.73 2kc5 s LEU 87 Cb -0.15 -0.08 2.20 0.00 0.02 0.00 0.00 46.19 48.18 2kc5 s LEU 87 CO 0.11 -0.50 2.33 -0.65 0.02 0.00 0.00 176.35 177.65 2kc5 h PRO 88 N 2.83 0.00 0.00 1.29 0.11 -1.92 -0.40 132.00 133.91 2kc5 h PRO 88 Ca -0.36 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.75 2kc5 h PRO 88 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2kc5 h PRO 88 CO 0.64 0.00 0.00 0.98 -0.21 0.00 0.00 178.00 179.41 2kc5 n TYR 89 N -3.35 0.00 0.00 0.65 9.36 -1.26 -4.99 117.16 117.56 2kc5 n TYR 89 Ca -0.03 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.19 2kc5 n TYR 89 Cb 0.08 -0.21 0.00 0.00 -0.63 0.00 0.00 39.34 38.58 2kc5 n TYR 89 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 2kc5 n GLY 90 N 0.32 2.16 3.73 2.98 0.00 -0.16 -5.00 105.19 109.23 2kc5 n GLY 90 Ca 0.11 -1.93 -0.42 0.00 0.00 0.00 0.00 46.02 43.78 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 -2.81 3.20 0.01 2.61 2.01 -1.26 -3.39 115.64 116.01 2kc5 s THR 91 Ca 0.00 0.91 0.00 0.00 0.31 0.00 0.00 61.69 62.91 2kc5 s THR 91 Cb 0.00 -3.58 -0.01 0.00 0.01 0.00 0.00 72.50 68.92 2kc5 s THR 91 CO 0.00 0.10 -0.01 -0.04 -0.69 0.00 0.00 174.62 173.98 2kc5 s MET 92 N 0.55 0.13 0.02 4.92 1.00 -0.45 -4.96 119.30 120.51 2kc5 s MET 92 Ca 0.61 -0.25 -0.27 0.00 0.00 0.00 0.00 55.69 55.78 2kc5 s MET 92 Cb -0.37 0.03 -0.04 0.00 0.00 0.00 0.00 34.83 34.45 2kc5 s MET 92 CO 0.34 -0.02 0.86 0.95 0.00 0.00 0.00 175.02 177.15 2kc5 s THR 93 N -0.59 4.79 -0.17 2.05 -4.23 -1.26 -1.45 115.64 114.78 2kc5 s THR 93 Ca -0.06 1.82 -0.08 0.00 -1.18 0.00 0.00 61.69 62.19 2kc5 s THR 93 Cb -0.04 -4.21 -0.04 0.00 1.34 0.00 0.00 72.50 69.55 2kc5 s THR 93 CO -0.00 0.27 0.09 -0.36 -0.54 0.00 0.00 174.62 174.08 2kc5 s PHE 94 N 0.45 3.36 0.21 3.99 0.40 0.02 -4.83 117.98 121.57 2kc5 s PHE 94 Ca 0.44 0.25 -0.24 0.00 -0.60 0.00 0.00 56.93 56.78 2kc5 s PHE 94 Cb -0.21 -2.05 -0.08 0.00 0.51 0.00 0.00 43.02 41.19 2kc5 s PHE 94 CO 0.25 0.33 0.79 0.99 0.70 0.00 0.00 175.22 178.28 2kc5 s THR 95 N 0.00 4.41 -0.05 0.64 2.01 0.39 -0.74 115.64 122.29 2kc5 s THR 95 Ca 0.08 1.59 -0.30 0.00 0.31 0.00 0.00 61.69 63.36 2kc5 s THR 95 Cb -0.12 -4.03 -0.04 0.00 0.01 0.00 0.00 72.50 68.33 2kc5 s THR 95 CO 0.00 0.36 1.24 -0.69 -0.69 0.00 0.00 174.62 174.84 2kc5 s VAL 96 N -1.35 4.16 0.29 3.82 1.01 0.45 -0.86 120.40 127.92 2kc5 s VAL 96 Ca 0.40 1.49 0.09 0.00 0.00 0.00 0.00 61.98 63.97 2kc5 s VAL 96 Cb -0.20 -3.96 -0.04 0.00 0.00 0.00 0.00 36.38 32.18 2kc5 s VAL 96 CO 0.24 -0.01 0.05 -0.83 0.00 0.00 0.00 175.10 174.55 2kc5 s GLY 97 N 1.59 1.71 -0.37 4.51 0.00 0.21 -0.69 107.32 114.28 2kc5 s GLY 97 Ca 0.57 -1.68 0.01 0.00 0.00 0.00 0.00 44.72 43.62 2kc5 s GLY 97 CO 0.22 -1.71 0.18 1.85 0.00 0.00 0.00 173.10 173.64 2kc5 s GLU 98 N -3.74 0.92 0.15 2.90 2.12 -1.26 -1.41 118.70 118.38 2kc5 s GLU 98 Ca 0.33 -1.51 -0.30 0.00 0.36 0.00 0.00 54.97 53.85 2kc5 s GLU 98 Cb -0.05 -2.00 -0.07 0.00 0.26 0.00 0.00 34.13 32.27 2kc5 s GLU 98 CO 0.21 -1.10 1.04 -1.17 -0.54 0.00 0.00 175.26 173.69 2kc5 s LEU 99 N 0.98 4.49 0.05 2.70 2.96 -1.02 -4.92 118.68 123.92 2kc5 s LEU 99 Ca 0.15 1.95 -0.32 0.00 -0.22 0.00 0.00 54.13 55.69 2kc5 s LEU 99 Cb -0.21 -3.60 -0.11 0.00 0.50 0.00 0.00 46.19 42.77 2kc5 s LEU 99 CO -0.10 -0.15 1.86 -0.67 -1.32 0.00 0.00 176.35 175.97 2kc5 n ASP 100 N 2.58 3.84 0.00 3.68 2.03 -1.26 -1.06 116.55 126.35 2kc5 n ASP 100 Ca 0.03 0.97 0.00 0.00 0.52 0.00 0.00 54.79 56.31 2kc5 n ASP 100 Cb 0.47 -1.49 0.00 0.00 -0.72 0.00 0.00 41.12 39.39 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 4.27 1.13 0.00 0.27 0.00 -1.26 -4.92 105.19 104.69 2kc5 n GLY 101 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 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 -2.00 0.00 -4.08 1.61 0.31 -0.23 -0.51 118.33 113.44 2kc5 n VAL 102 Ca 0.00 0.00 -0.13 0.00 -0.01 0.00 0.00 64.34 64.20 2kc5 n VAL 102 Cb 0.00 0.00 -0.05 0.00 -0.91 0.00 0.00 33.84 32.88 2kc5 n VAL 102 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 2kc5 s SER 103 N -0.87 0.53 0.34 4.52 0.01 -1.24 -4.82 113.70 112.18 2kc5 s SER 103 Ca 0.00 -1.31 -0.27 0.00 1.31 0.00 0.00 55.95 55.68 2kc5 s SER 103 Cb 0.00 0.61 -0.09 0.00 0.21 0.00 0.00 66.02 66.75 2kc5 s SER 103 CO 0.00 -1.20 1.13 -1.10 0.41 0.00 0.00 173.24 172.48 2kc5 s GLN 104 N -3.46 4.35 0.28 12.44 -0.21 -1.26 -2.44 119.66 129.35 2kc5 s GLN 104 Ca 0.29 1.81 -0.13 0.00 0.02 0.00 0.00 55.36 57.35 2kc5 s GLN 104 Cb 0.00 -2.90 0.01 0.00 1.00 0.00 0.00 33.01 31.12 2kc5 s GLN 104 CO 0.16 -0.05 0.55 1.52 -2.12 0.00 0.00 175.29 175.34 2kc5 s TYR 105 N -1.32 0.33 -0.03 0.91 1.13 -0.50 -4.87 117.35 113.00 2kc5 s TYR 105 Ca 0.51 -0.72 0.03 0.00 -1.41 0.00 0.00 57.07 55.47 2kc5 s TYR 105 Cb -0.31 0.30 -0.03 0.00 -1.10 0.00 0.00 41.96 40.83 2kc5 s TYR 105 CO 0.39 -1.11 -0.08 -0.51 -2.51 0.00 0.00 175.55 171.73 2kc5 s LEU 106 N -3.03 3.08 0.03 -3.49 1.02 -0.26 -0.62 118.68 115.41 2kc5 s LEU 106 Ca 0.21 -0.12 -0.03 0.00 0.02 0.00 0.00 54.13 54.21 2kc5 s LEU 106 Cb -0.02 -1.72 -0.02 0.00 0.02 0.00 0.00 46.19 44.46 2kc5 s LEU 106 CO 0.10 0.32 0.03 -0.94 0.02 0.00 0.00 176.35 175.89 2kc5 s SER 107 N -1.08 0.25 -0.14 2.29 1.04 -0.04 -0.49 113.70 115.53 2kc5 s SER 107 Ca 0.14 -0.59 -0.04 0.00 0.48 0.00 0.00 55.95 55.94 2kc5 s SER 107 Cb -0.11 0.18 0.07 0.00 0.10 0.00 0.00 66.02 66.25 2kc5 s SER 107 CO 0.04 -0.45 0.18 0.00 0.98 0.00 0.00 173.24 174.00 2kc5 s SER 109 N 2.30 7.15 0.00 0.00 0.01 -1.26 -0.75 113.70 121.15 2kc5 s SER 109 Ca 0.04 2.17 0.00 0.00 1.31 0.00 0.00 55.95 59.48 2kc5 s SER 109 Cb -0.14 -2.60 0.00 0.00 0.21 0.00 0.00 66.02 63.49 2kc5 s SER 109 CO -0.09 -0.32 0.00 0.18 0.41 0.00 0.00 173.24 173.42 2kc5 n LEU 110 N 2.49 1.21 -3.85 2.44 4.77 -0.00 -4.94 117.00 119.12 2kc5 n LEU 110 Ca 0.04 0.00 -0.07 0.00 -0.03 0.00 0.00 56.01 55.95 2kc5 n LEU 110 Cb 0.45 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.52 2kc5 n LEU 110 CO 0.55 0.20 0.45 0.00 -1.33 0.00 0.00 177.39 177.27 2kc5 s MET 111 N -1.80 1.76 -0.28 3.23 0.23 -1.17 -5.02 119.30 116.25 2kc5 s MET 111 Ca 0.00 -0.98 -0.11 0.00 -1.03 0.00 0.00 55.69 53.57 2kc5 s MET 111 Cb 0.00 0.60 -0.05 0.00 -1.53 0.00 0.00 34.83 33.85 2kc5 s MET 111 CO 0.00 -0.80 0.18 -1.12 -2.03 0.00 0.00 175.02 171.25 2kc5 s SER 112 N -2.92 5.99 0.00 -1.18 0.01 -1.26 -1.20 113.70 113.14 2kc5 s SER 112 Ca 0.11 -0.01 0.00 0.00 1.31 0.00 0.00 55.95 57.36 2kc5 s SER 112 Cb -0.06 -2.11 0.00 0.00 0.21 0.00 0.00 66.02 64.06 2kc5 s SER 112 CO 0.06 -0.05 0.00 -2.65 0.41 0.00 0.00 173.24 171.02 2kc5 n PRO 113 N 5.03 1.54 -3.42 12.44 -0.02 -1.26 -4.72 135.00 144.59 2kc5 n PRO 113 Ca -0.14 0.00 -0.20 0.00 -2.02 0.00 0.00 63.50 61.14 2kc5 n PRO 113 Cb 0.52 0.00 0.07 0.00 -0.02 0.00 0.00 33.50 34.07 2kc5 n PRO 113 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 2kc5 n LEU 114 N 0.00 -3.26 -4.80 2.45 -0.00 -1.26 -4.90 117.00 105.23 2kc5 n LEU 114 Ca 0.00 -0.47 -0.32 0.00 -0.00 0.00 0.00 56.01 55.22 2kc5 n LEU 114 Cb 0.00 -2.68 0.04 0.00 -0.00 0.00 0.00 43.42 40.79 2kc5 n LEU 114 CO 0.00 0.54 0.71 -0.44 -0.00 0.00 0.00 177.39 178.20 2kc5 s SER 115 N -3.37 5.32 0.46 1.96 0.01 -1.26 -4.96 113.70 111.86 2kc5 s SER 115 Ca 0.45 1.77 0.17 0.00 1.31 0.00 0.00 55.95 59.64 2kc5 s SER 115 Cb -0.20 -2.52 1.08 0.00 0.21 0.00 0.00 66.02 64.59 2kc5 s SER 115 CO 0.62 -1.48 2.00 0.45 0.41 0.00 0.00 173.24 175.25 2kc5 h HIS 116 N -0.32 0.00 -0.01 2.43 -0.00 -2.01 -1.42 115.15 113.81 2kc5 h HIS 116 Ca -0.45 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 59.92 2kc5 h HIS 116 Cb 1.22 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 28.63 2kc5 h HIS 116 CO 0.59 0.18 -0.00 0.43 -0.00 0.00 0.00 177.93 179.13 2kc5 n SER 117 N -4.19 1.38 -4.80 2.45 7.64 -1.26 -4.97 113.62 109.86 2kc5 n SER 117 Ca -0.02 -1.46 -0.32 0.00 1.01 0.00 0.00 58.87 58.08 2kc5 n SER 117 Cb 0.25 0.00 0.03 0.00 -1.01 0.00 0.00 64.21 63.48 2kc5 n SER 117 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 2kc5 s MET 118 N -2.00 3.08 0.35 1.43 1.00 -0.54 -4.94 119.30 117.68 2kc5 s MET 118 Ca 0.39 1.16 -0.14 0.00 0.00 0.00 0.00 55.69 57.10 2kc5 s MET 118 Cb 0.21 -2.00 0.03 0.00 0.00 0.00 0.00 34.83 33.07 2kc5 s MET 118 CO 0.34 -1.00 0.69 -1.54 0.00 0.00 0.00 175.02 173.51 2kc5 s SER 119 N -3.06 0.14 0.29 3.03 1.04 -1.26 -4.98 113.70 108.90 2kc5 s SER 119 Ca 0.62 -1.12 0.03 0.00 0.48 0.00 0.00 55.95 55.97 2kc5 s SER 119 Cb -0.16 0.78 0.61 0.00 0.10 0.00 0.00 66.02 67.35 2kc5 s SER 119 CO 0.43 -1.52 1.83 0.40 0.98 0.00 0.00 173.24 175.36 2kc5 h ILE 120 N 2.04 0.87 -0.17 -1.02 5.03 -1.97 0.95 117.51 123.23 2kc5 h ILE 120 Ca -0.29 -0.32 -0.12 0.00 -0.12 0.00 0.00 64.86 64.01 2kc5 h ILE 120 Cb 1.25 -0.14 0.00 0.00 -3.03 0.00 0.00 36.82 34.90 2kc5 h ILE 120 CO 0.37 0.17 -0.38 -0.33 -0.68 0.00 0.00 178.15 177.30 2kc5 h GLU 121 N 0.93 0.56 0.00 2.37 5.08 -1.99 -2.49 114.58 119.03 2kc5 h GLU 121 Ca 0.51 -0.37 -0.06 0.00 -1.00 0.00 0.00 59.36 58.44 2kc5 h GLU 121 Cb 0.60 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.89 2kc5 h GLU 121 CO -0.29 0.99 -0.29 0.93 -1.00 0.00 0.00 179.01 179.35 2kc5 h GLU 122 N 0.21 0.00 0.51 2.33 4.39 -1.83 0.55 114.58 120.74 2kc5 h GLU 122 Ca 0.00 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.69 2kc5 h GLU 122 Cb 0.98 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.62 2kc5 h GLU 122 CO 0.08 0.29 -0.41 0.78 -1.16 0.00 0.00 179.01 178.59 2kc5 h GLY 123 N 1.08 -1.04 0.79 -3.84 0.00 -0.45 0.80 103.07 100.42 2kc5 h GLY 123 Ca -0.00 0.47 -0.01 0.00 0.00 0.00 0.00 47.33 47.79 2kc5 h GLY 123 CO 0.04 -0.35 -0.11 1.46 0.00 0.00 0.00 176.54 177.58 2kc5 h GLN 124 N -0.91 -0.28 0.00 4.80 4.20 -1.20 -2.61 115.11 119.11 2kc5 h GLN 124 Ca -0.05 0.02 -0.03 0.00 0.06 0.00 0.00 58.65 58.64 2kc5 h GLN 124 Cb 0.78 0.06 -0.00 0.00 0.30 0.00 0.00 27.48 28.62 2kc5 h GLN 124 CO -0.01 -0.04 -0.16 -0.09 -0.67 0.00 0.00 178.83 177.86 2kc5 h ARG 125 N -0.51 0.00 0.00 1.46 9.65 -0.91 -1.93 114.38 122.15 2kc5 h ARG 125 Ca -0.03 0.00 -0.26 0.00 -1.10 0.00 0.00 59.98 58.59 2kc5 h ARG 125 Cb 0.38 0.00 -0.04 0.00 -1.39 0.00 0.00 29.97 28.92 2kc5 h ARG 125 CO 0.05 0.16 -1.43 1.25 2.80 0.00 0.00 179.97 182.80 2kc5 h LEU 126 N 0.00 0.00 -0.23 3.80 5.85 -0.80 0.13 115.31 124.07 2kc5 h LEU 126 Ca -0.00 0.00 0.01 0.00 0.84 0.00 0.00 57.88 58.73 2kc5 h LEU 126 Cb 0.47 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.48 2kc5 h LEU 126 CO 0.02 0.99 0.11 0.74 -0.34 0.00 0.00 178.44 179.96 2kc5 h THR 127 N 0.00 0.99 0.11 1.05 2.02 -1.04 0.13 112.91 116.17 2kc5 h THR 127 Ca -0.18 -0.08 -0.01 0.00 0.77 0.00 0.00 66.41 66.91 2kc5 h THR 127 Cb 1.91 0.74 0.00 0.00 -1.74 0.00 0.00 68.15 69.06 2kc5 h THR 127 CO 0.10 0.04 -0.05 -0.78 0.37 0.00 0.00 175.52 175.20 2kc5 h ASP 128 N 0.24 -0.13 -0.05 4.18 3.58 -1.36 -2.23 116.42 120.65 2kc5 h ASP 128 Ca 0.09 -0.17 -0.07 0.00 0.42 0.00 0.00 57.03 57.31 2kc5 h ASP 128 Cb 0.02 0.03 -0.01 0.00 1.72 0.00 0.00 39.33 41.09 2kc5 h ASP 128 CO -0.06 0.10 -0.15 -0.78 -2.88 0.00 0.00 179.24 175.46 2kc5 h ASP 129 N -0.35 0.38 0.20 2.28 3.58 -0.69 0.14 116.42 121.96 2kc5 h ASP 129 Ca -0.02 -0.10 -0.14 0.00 0.42 0.00 0.00 57.03 57.20 2kc5 h ASP 129 Cb 0.29 -0.10 -0.01 0.00 1.72 0.00 0.00 39.33 41.23 2kc5 h ASP 129 CO 0.03 0.56 -0.53 0.00 -2.88 0.00 0.00 179.24 176.41 2kc5 h ALA 131 N 1.15 -0.23 -0.52 0.00 0.00 -0.99 -3.33 119.26 115.34 2kc5 h ALA 131 Ca 0.01 -0.20 0.08 0.00 0.00 0.00 0.00 54.91 54.81 2kc5 h ALA 131 Cb 1.03 0.09 -0.07 0.00 0.00 0.00 0.00 17.79 18.84 2kc5 h ALA 131 CO 0.09 -0.42 0.15 -0.09 0.00 0.00 0.00 179.25 178.97 2kc5 h ARG 132 N -0.63 0.29 -0.19 0.00 9.65 -0.63 -1.19 114.38 121.67 2kc5 h ARG 132 Ca -0.02 -0.02 0.06 0.00 -1.10 0.00 0.00 59.98 58.89 2kc5 h ARG 132 Cb 0.47 -0.07 -0.01 0.00 -1.39 0.00 0.00 29.97 28.97 2kc5 h ARG 132 CO 0.04 0.19 0.17 0.00 2.80 0.00 0.00 179.97 183.18 2kc5 h MET 133 N 0.30 0.00 -0.66 0.20 -0.00 -0.95 0.18 114.93 114.00 2kc5 h MET 133 Ca 0.26 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.96 2kc5 h MET 133 Cb 0.33 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.93 2kc5 h MET 133 CO -0.30 0.00 0.00 0.44 -0.00 0.00 0.00 176.91 177.05 2kc5 n ILE 134 N -4.06 0.99 -2.95 -0.10 -5.35 -0.50 -4.53 119.36 102.86 2kc5 n ILE 134 Ca 0.02 -0.99 -0.15 0.00 -0.27 0.00 0.00 62.75 61.35 2kc5 n ILE 134 Cb 0.30 0.51 -0.00 0.00 -1.74 0.00 0.00 39.64 38.71 2kc5 n ILE 134 CO 0.00 0.00 0.00 -0.11 -1.76 0.00 0.00 176.55 174.68 2kc5 n LEU 135 N 1.45 -1.53 -1.14 7.28 7.94 0.05 -4.44 117.00 126.61 2kc5 n LEU 135 Ca 0.22 -3.93 0.00 0.00 -1.11 0.00 0.00 56.01 51.19 2kc5 n LEU 135 Cb 0.59 0.75 0.00 0.00 0.53 0.00 0.00 43.42 45.29 2kc5 n LEU 135 CO 0.15 2.03 0.40 -1.20 -1.11 0.00 0.00 177.39 177.66 2kc5 n SER 136 N 1.54 2.29 -3.68 1.96 7.64 -1.22 -4.59 113.62 117.56 2kc5 n SER 136 Ca 0.14 -1.44 -0.10 0.00 1.01 0.00 0.00 58.87 58.48 2kc5 n SER 136 Cb 0.59 -0.41 -0.11 0.00 -1.01 0.00 0.00 64.21 63.27 2kc5 n SER 136 CO 0.00 0.00 0.00 -1.48 -3.01 0.00 0.00 175.04 170.55 2kc5 s LEU 137 N 0.00 -0.26 -0.01 -3.43 -0.00 -1.26 -5.17 118.68 108.55 2kc5 s LEU 137 Ca 0.00 0.89 -0.02 0.00 -0.00 0.00 0.00 54.13 55.00 2kc5 s LEU 137 Cb 0.00 1.29 -0.04 0.00 -0.00 0.00 0.00 46.19 47.44 2kc5 s LEU 137 CO 0.00 -0.21 0.16 -2.16 -0.00 0.00 0.00 176.35 174.14 2kc5 s PRO 138 N 1.83 3.34 0.09 1.48 0.04 -1.26 -4.83 135.00 135.68 2kc5 s PRO 138 Ca -0.07 -0.37 -0.16 0.00 0.04 0.00 0.00 61.00 60.45 2kc5 s PRO 138 Cb -0.10 -3.03 0.03 0.00 0.04 0.00 0.00 34.50 31.44 2kc5 s PRO 138 CO -0.12 0.67 0.38 0.54 0.04 0.00 0.00 177.00 178.50 2kc5 s VAL 139 N -1.30 0.07 0.53 -0.36 0.11 -1.26 -5.04 120.40 113.15 2kc5 s VAL 139 Ca 0.26 -0.59 -0.21 0.00 -2.93 0.00 0.00 61.98 58.51 2kc5 s VAL 139 Cb -0.12 -1.08 -0.06 0.00 -1.53 0.00 0.00 36.38 33.58 2kc5 s VAL 139 CO 0.18 -0.32 1.13 0.41 -3.33 0.00 0.00 175.10 173.16 2kc5 n THR 140 N 0.12 3.37 -4.20 5.04 -1.04 -1.26 -3.93 114.28 112.37 2kc5 n THR 140 Ca -0.17 -0.50 -0.24 0.00 -2.04 0.00 0.00 64.05 61.10 2kc5 n THR 140 Cb 0.62 -1.36 -0.17 0.00 -1.82 0.00 0.00 70.33 67.61 2kc5 n THR 140 CO 0.00 0.00 0.00 0.21 -0.64 0.00 0.00 175.07 174.64 2kc5 s ASN 141 N -0.96 1.65 0.90 8.00 3.84 -1.26 -4.77 114.94 122.33 2kc5 s ASN 141 Ca 0.70 -0.23 -0.10 0.00 0.21 0.00 0.00 52.86 53.44 2kc5 s ASN 141 Cb -0.45 -0.69 0.13 0.00 -0.55 0.00 0.00 41.25 39.69 2kc5 s ASN 141 CO 0.51 -0.05 1.13 -2.84 -2.79 0.00 0.00 177.10 173.05 2kc5 s PRO 142 N 1.15 1.19 0.01 0.43 0.02 -1.26 -5.06 135.00 131.47 2kc5 s PRO 142 Ca -0.06 1.44 0.02 0.00 0.02 0.00 0.00 61.00 62.42 2kc5 s PRO 142 Cb -0.14 -1.76 -0.01 0.00 0.02 0.00 0.00 34.50 32.61 2kc5 s PRO 142 CO -0.01 -2.48 -0.07 0.34 -0.33 0.00 0.00 177.00 174.45 2kc5 s ASP 143 N -2.82 0.83 0.13 2.53 2.15 -1.26 -4.79 116.67 113.44 2kc5 s ASP 143 Ca 0.66 -0.26 0.03 0.00 0.43 0.00 0.00 52.55 53.40 2kc5 s ASP 143 Cb -0.22 -0.05 -0.04 0.00 -0.30 0.00 0.00 42.92 42.31 2kc5 s ASP 143 CO 0.58 -0.01 -0.07 0.68 -0.17 0.00 0.00 175.17 176.19 2kc5 s VAL 144 N -0.54 0.87 -0.05 1.11 -7.23 -1.26 -5.09 120.40 108.20 2kc5 s VAL 144 Ca -0.01 -1.99 -0.29 0.00 -1.81 0.00 0.00 61.98 57.88 2kc5 s VAL 144 Cb -0.05 -1.83 -0.07 0.00 0.56 0.00 0.00 36.38 34.99 2kc5 s VAL 144 CO 0.00 -0.75 1.99 -2.16 -0.31 0.00 0.00 175.10 173.87 2kc5 s PRO 145 N -3.82 3.86 0.33 4.82 0.04 -1.26 -4.86 135.00 134.10 2kc5 s PRO 145 Ca 0.16 2.36 -0.29 0.00 0.04 0.00 0.00 61.00 63.27 2kc5 s PRO 145 Cb 0.04 -4.20 -0.11 0.00 0.04 0.00 0.00 34.50 30.28 2kc5 s PRO 145 CO -0.01 -1.27 1.47 -1.58 0.04 0.00 0.00 177.00 175.64 2kc5 s HIS 146 N 5.49 2.79 0.38 0.56 2.46 -1.26 -4.97 115.29 120.74 2kc5 s HIS 146 Ca 0.89 1.10 -0.25 0.00 0.47 0.00 0.00 55.06 57.28 2kc5 s HIS 146 Cb -0.38 -3.93 -0.09 0.00 -0.13 0.00 0.00 32.58 28.04 2kc5 s HIS 146 CO 0.38 -2.86 1.02 0.00 -2.47 0.00 0.00 174.74 170.81 2kc5 s ALA 147 N -0.66 3.13 0.52 1.58 0.00 -1.26 -5.04 121.76 120.03 2kc5 s ALA 147 Ca 0.56 0.65 -0.20 0.00 0.00 0.00 0.00 51.96 52.97 2kc5 s ALA 147 Cb -0.45 -3.25 -0.07 0.00 0.00 0.00 0.00 23.12 19.36 2kc5 s ALA 147 CO 0.54 -0.09 1.11 0.20 0.00 0.00 0.00 175.76 177.52 2kc5 s GLY 148 N -1.58 2.63 0.64 0.00 0.00 -1.26 -4.82 107.32 102.92 2kc5 s GLY 148 Ca 0.55 0.79 -0.17 0.00 0.00 0.00 0.00 44.72 45.90 2kc5 s GLY 148 CO 0.26 1.15 1.17 1.09 0.00 0.00 0.00 173.10 176.78 2kc5 s ARG 149 N -3.21 2.78 0.36 2.90 1.70 -1.26 -4.99 118.95 117.23 2kc5 s ARG 149 Ca 0.71 1.67 -0.27 0.00 -0.47 0.00 0.00 55.73 57.36 2kc5 s ARG 149 Cb -0.23 -1.92 -0.09 0.00 -0.57 0.00 0.00 34.95 32.14 2kc5 s ARG 149 CO 0.26 -1.32 1.24 1.03 -1.08 0.00 0.00 175.30 175.43 2kc5 s ARG 150 N -3.66 4.23 0.06 3.89 0.52 0.33 -5.02 118.95 119.30 2kc5 s ARG 150 Ca 0.73 2.04 -0.26 0.00 -0.52 0.00 0.00 55.73 57.72 2kc5 s ARG 150 Cb -0.27 -2.91 -0.05 0.00 0.52 0.00 0.00 34.95 32.24 2kc5 s ARG 150 CO 0.37 -0.23 0.82 0.00 0.02 0.00 0.00 175.30 176.28 2kc5 s ALA 151 N -1.25 3.33 0.24 2.13 0.00 -1.26 -4.58 121.76 120.38 2kc5 s ALA 151 Ca 0.52 0.36 -0.20 0.00 0.00 0.00 0.00 51.96 52.64 2kc5 s ALA 151 Cb -0.36 -3.07 0.03 0.00 0.00 0.00 0.00 23.12 19.72 2kc5 s ALA 151 CO 0.46 0.04 0.64 -0.48 0.00 0.00 0.00 175.76 176.42 2kc5 s LEU 152 N -0.02 -0.18 -0.06 0.00 2.34 -1.26 -5.09 118.68 114.40 2kc5 s LEU 152 Ca 0.41 -0.52 -0.03 0.00 0.06 0.00 0.00 54.13 54.05 2kc5 s LEU 152 Cb -0.21 2.49 0.04 0.00 -0.56 0.00 0.00 46.19 47.95 2kc5 s LEU 152 CO 0.25 -1.21 0.12 -0.22 -1.06 0.00 0.00 176.35 174.24 2kc5 s LEU 153 N -2.89 0.35 0.08 1.48 1.98 -1.26 -5.07 118.68 113.34 2kc5 s LEU 153 Ca 0.10 0.25 -0.14 0.00 -2.89 0.00 0.00 54.13 51.45 2kc5 s LEU 153 Cb -0.04 0.20 0.02 0.00 0.66 0.00 0.00 46.19 47.03 2kc5 s LEU 153 CO 0.02 -0.20 0.32 0.12 -1.89 0.00 0.00 176.35 174.72 2kc5 s PHE 154 N 1.77 -0.09 -0.18 5.38 5.36 -1.26 -5.18 117.98 123.77 2kc5 s PHE 154 Ca -0.02 -0.14 -0.29 0.00 -0.96 0.00 0.00 56.93 55.51 2kc5 s PHE 154 Cb -0.12 0.12 0.13 0.00 -0.34 0.00 0.00 43.02 42.81 2kc5 s PHE 154 CO -0.05 -0.57 1.03 0.20 -1.46 0.00 0.00 175.22 174.37 2kc5 s GLY 155 N -2.44 -0.22 -1.19 13.12 0.00 -1.26 -5.06 107.32 110.27 2kc5 s GLY 155 Ca -0.01 2.18 -0.06 0.00 0.00 0.00 0.00 44.72 46.83 2kc5 s GLY 155 CO -0.07 1.14 2.62 0.54 0.00 0.00 0.00 173.10 177.32 2kc5 n ARG 156 N 0.88 3.98 0.18 2.90 1.74 -1.26 -4.61 116.66 120.47 2kc5 n ARG 156 Ca -0.10 -2.93 0.05 0.00 -0.77 0.00 0.00 57.85 54.11 2kc5 n ARG 156 Cb 0.58 -2.56 0.26 0.00 -1.02 0.00 0.00 32.46 29.71 2kc5 n ARG 156 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2kc5 h ARG 157 N 4.36 0.00 -6.65 5.56 2.47 -2.01 -3.41 114.38 114.71 2kc5 h ARG 157 Ca 0.67 0.00 -0.53 0.00 -1.26 0.00 0.00 59.98 58.86 2kc5 h ARG 157 Cb 0.42 0.00 0.04 0.00 -1.65 0.00 0.00 29.97 28.78 2kc5 h ARG 157 CO 1.39 0.41 0.75 -1.12 0.56 0.00 0.00 179.97 181.95 2kc5 s SER 158 N -6.42 6.74 -0.69 7.04 0.01 -1.26 -2.71 113.70 116.41 2kc5 s SER 158 Ca 0.01 2.51 0.00 0.00 1.31 0.00 0.00 55.95 59.78 2kc5 s SER 158 Cb 0.10 -2.60 0.00 0.00 0.21 0.00 0.00 66.02 63.73 2kc5 s SER 158 CO 0.70 -0.67 0.00 0.61 0.41 0.00 0.00 173.24 174.28 2kc5 n GLY 159 N 2.90 0.84 3.74 3.44 0.00 -1.26 -4.99 105.19 109.85 2kc5 n GLY 159 Ca 0.09 -0.37 -0.41 0.00 0.00 0.00 0.00 46.02 45.33 2kc5 n GLY 159 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2kc5 s GLU 160 N -2.18 4.33 0.23 1.61 2.12 -1.10 -5.00 118.70 118.71 2kc5 s GLU 160 Ca 0.00 2.15 -0.30 0.00 0.36 0.00 0.00 54.97 57.19 2kc5 s GLU 160 Cb 0.00 -3.17 -0.09 0.00 0.26 0.00 0.00 34.13 31.14 2kc5 s GLU 160 CO 0.00 -0.34 0.99 1.21 -0.54 0.00 0.00 175.26 176.58 2kc5 s ASN 161 N 0.44 7.52 0.00 -1.70 3.84 -1.26 -5.14 114.94 118.64 2kc5 s ASN 161 Ca 0.59 2.01 0.00 0.00 0.21 0.00 0.00 52.86 55.67 2kc5 s ASN 161 Cb -0.39 -2.61 0.00 0.00 -0.55 0.00 0.00 41.25 37.70 2kc5 s ASN 161 CO 0.39 0.04 0.00 0.00 -2.79 0.00 0.00 177.10 174.74