#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 2.83 0.07 1.12 2.01 -1.26 -5.05 115.64 115.36 2kc5 s THR 2 Ca 0.00 0.81 -0.14 0.00 0.31 0.00 0.00 61.69 62.67 2kc5 s THR 2 Cb 0.00 -3.51 0.02 0.00 0.01 0.00 0.00 72.50 69.02 2kc5 s THR 2 CO 0.00 0.18 0.33 -1.83 -0.69 0.00 0.00 174.62 172.61 2kc5 s GLU 3 N -1.84 0.90 -0.48 4.92 -1.05 -1.26 -4.96 118.70 114.94 2kc5 s GLU 3 Ca 0.50 -0.59 -0.18 0.00 -0.15 0.00 0.00 54.97 54.55 2kc5 s GLU 3 Cb -0.38 0.39 0.03 0.00 -0.44 0.00 0.00 34.13 33.73 2kc5 s GLU 3 CO 0.50 -0.31 0.50 0.39 0.95 0.00 0.00 175.26 177.29 2kc5 n GLU 4 N 0.26 -1.38 -2.27 -4.83 4.71 -1.26 -4.82 120.64 111.06 2kc5 n GLU 4 Ca -0.17 0.88 -0.42 0.00 -0.01 0.00 0.00 57.16 57.44 2kc5 n GLU 4 Cb 0.61 -1.62 -0.03 0.00 -1.01 0.00 0.00 31.44 29.39 2kc5 n GLU 4 CO 0.00 0.00 0.00 0.42 0.09 0.00 0.00 177.13 177.64 2kc5 s ILE 5 N -1.83 3.62 0.12 -3.67 1.01 0.01 -4.56 121.20 115.90 2kc5 s ILE 5 Ca 0.17 1.14 -0.31 0.00 0.00 0.00 0.00 60.65 61.66 2kc5 s ILE 5 Cb -0.02 -3.73 -0.08 0.00 0.01 0.00 0.00 42.46 38.64 2kc5 s ILE 5 CO 0.69 0.08 1.43 0.00 0.00 0.00 0.00 174.94 177.14 2kc5 s ALA 6 N 1.28 3.63 0.12 9.38 0.00 -1.26 -0.38 121.76 134.53 2kc5 s ALA 6 Ca 0.62 1.17 -0.15 0.00 0.00 0.00 0.00 51.96 53.60 2kc5 s ALA 6 Cb -0.33 -3.56 -0.07 0.00 0.00 0.00 0.00 23.12 19.16 2kc5 s ALA 6 CO 0.29 -0.66 0.54 0.20 0.00 0.00 0.00 175.76 176.13 2kc5 s GLY 7 N 1.15 2.51 0.45 0.00 0.00 0.07 -4.93 107.32 106.58 2kc5 s GLY 7 Ca 0.66 -0.10 0.06 0.00 0.00 0.00 0.00 44.72 45.33 2kc5 s GLY 7 CO 0.30 0.22 0.13 -1.36 0.00 0.00 0.00 173.10 172.39 2kc5 s PHE 8 N -1.35 2.28 -0.87 1.90 0.08 -1.23 -2.84 117.98 115.94 2kc5 s PHE 8 Ca 0.35 -0.73 0.20 0.00 0.12 0.00 0.00 56.93 56.86 2kc5 s PHE 8 Cb -0.16 -1.83 0.82 0.00 -0.57 0.00 0.00 43.02 41.27 2kc5 s PHE 8 CO 0.19 0.17 1.62 1.04 -0.10 0.00 0.00 175.22 178.13 2kc5 n GLN 9 N -1.25 0.06 -3.81 0.44 3.00 -1.26 -2.48 117.38 112.07 2kc5 n GLN 9 Ca -0.06 0.24 -0.10 0.00 -0.01 0.00 0.00 57.00 57.07 2kc5 n GLN 9 Cb 0.66 -1.60 -0.07 0.00 0.00 0.00 0.00 30.24 29.23 2kc5 n GLN 9 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.06 178.01 2kc5 s THR 10 N -3.07 0.11 0.84 5.09 -4.23 -1.26 -4.93 115.64 108.18 2kc5 s THR 10 Ca 0.08 -0.94 -0.12 0.00 -1.18 0.00 0.00 61.69 59.53 2kc5 s THR 10 Cb 0.11 -1.13 0.10 0.00 1.34 0.00 0.00 72.50 72.93 2kc5 s THR 10 CO 0.36 -0.52 1.15 -0.44 -0.54 0.00 0.00 174.62 174.64 2kc5 s SER 11 N -2.48 3.57 -0.66 3.99 0.01 -1.26 -4.89 113.70 111.97 2kc5 s SER 11 Ca 0.00 2.17 -0.06 0.00 1.31 0.00 0.00 55.95 59.37 2kc5 s SER 11 Cb 0.02 -2.57 -0.13 0.00 0.21 0.00 0.00 66.02 63.55 2kc5 s SER 11 CO -0.08 -2.67 2.69 -0.81 0.41 0.00 0.00 173.24 172.78 2kc5 n PRO 12 N -3.67 2.23 -0.17 12.44 -0.04 -1.26 -4.75 135.00 139.78 2kc5 n PRO 12 Ca 0.12 -1.32 -0.02 0.00 -0.04 0.00 0.00 63.50 62.24 2kc5 n PRO 12 Cb 0.52 -2.27 0.05 0.00 -0.04 0.00 0.00 33.50 31.76 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 4.77 0.04 -0.42 0.54 3.64 -1.99 0.23 116.57 123.38 2kc5 h LYS 13 Ca 0.43 -0.00 -0.10 0.00 -1.27 0.00 0.00 60.65 59.71 2kc5 h LYS 13 Cb 0.66 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.46 2kc5 h LYS 13 CO 0.99 0.02 -0.11 0.00 -2.27 0.00 0.00 179.45 178.08 2kc5 h ALA 14 N 1.51 0.58 -0.32 5.00 0.00 -1.98 -0.68 119.26 123.37 2kc5 h ALA 14 Ca 0.26 -0.33 -0.17 0.00 0.00 0.00 0.00 54.91 54.67 2kc5 h ALA 14 Cb 0.40 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 2kc5 h ALA 14 CO -0.51 0.47 -0.47 1.96 0.00 0.00 0.00 179.25 180.70 2kc5 h GLN 15 N 0.64 0.86 -0.34 0.00 4.20 -1.74 0.93 115.11 119.64 2kc5 h GLN 15 Ca 0.10 -0.50 0.02 0.00 0.06 0.00 0.00 58.65 58.34 2kc5 h GLN 15 Cb 0.65 0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.45 2kc5 h GLN 15 CO 0.04 1.13 0.19 0.28 -0.67 0.00 0.00 178.83 179.81 2kc5 h VAL 16 N 0.68 1.02 0.09 -0.54 2.07 -0.91 -0.90 116.25 117.75 2kc5 h VAL 16 Ca 0.04 -0.13 -0.00 0.00 0.82 0.00 0.00 66.70 67.42 2kc5 h VAL 16 Cb 1.06 0.60 0.00 0.00 -1.52 0.00 0.00 31.29 31.43 2kc5 h VAL 16 CO 0.11 0.07 -0.04 -0.61 0.02 0.00 0.00 177.57 177.12 2kc5 h GLN 17 N 0.39 -0.11 -0.57 1.57 4.15 -0.66 -1.22 115.11 118.65 2kc5 h GLN 17 Ca 0.14 0.01 -0.08 0.00 0.77 0.00 0.00 58.65 59.49 2kc5 h GLN 17 Cb 0.02 0.03 -0.02 0.00 0.21 0.00 0.00 27.48 27.71 2kc5 h GLN 17 CO -0.07 0.03 0.04 0.00 -1.93 0.00 0.00 178.83 176.89 2kc5 h ALA 18 N 0.67 0.99 -0.05 3.38 0.00 -0.72 0.14 119.26 123.67 2kc5 h ALA 18 Ca -0.01 -0.28 -0.00 0.00 0.00 0.00 0.00 54.91 54.62 2kc5 h ALA 18 Cb 0.19 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 2kc5 h ALA 18 CO 0.02 0.62 0.02 0.00 0.00 0.00 0.00 179.25 179.92 2kc5 h ALA 19 N 1.15 0.07 0.00 0.00 0.00 -1.09 -2.21 119.26 117.18 2kc5 h ALA 19 Ca 0.17 -0.08 -0.06 0.00 0.00 0.00 0.00 54.91 54.94 2kc5 h ALA 19 Cb 0.47 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 2kc5 h ALA 19 CO 0.02 -0.36 -0.28 0.74 0.00 0.00 0.00 179.25 179.37 2kc5 h PHE 20 N -0.06 0.00 -0.47 0.00 0.04 -0.84 -1.12 116.94 114.49 2kc5 h PHE 20 Ca 0.02 0.00 -0.10 0.00 2.80 0.00 0.00 57.97 60.69 2kc5 h PHE 20 Cb 0.15 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.28 2kc5 h PHE 20 CO -0.02 0.28 -0.10 1.49 -0.60 0.00 0.00 178.31 179.35 2kc5 h GLU 21 N 0.00 0.85 -0.13 1.51 4.81 -0.51 0.11 114.58 121.22 2kc5 h GLU 21 Ca -0.00 -0.29 -0.19 0.00 -0.13 0.00 0.00 59.36 58.75 2kc5 h GLU 21 Cb 0.56 -0.07 0.01 0.00 0.63 0.00 0.00 28.75 29.88 2kc5 h GLU 21 CO 0.04 0.91 -0.65 1.49 -0.73 0.00 0.00 179.01 180.06 2kc5 h GLU 22 N 0.76 0.68 -0.40 1.92 4.57 -0.75 -1.77 114.58 119.58 2kc5 h GLU 22 Ca 0.13 -0.55 -0.00 0.00 -1.18 0.00 0.00 59.36 57.76 2kc5 h GLU 22 Cb 0.60 0.11 -0.02 0.00 -0.16 0.00 0.00 28.75 29.29 2kc5 h GLU 22 CO 0.04 1.17 0.25 0.82 -1.18 0.00 0.00 179.01 180.10 2kc5 h ILE 23 N 0.35 1.12 -0.16 2.32 2.04 -1.15 -2.37 117.51 119.68 2kc5 h ILE 23 Ca -0.04 -0.27 -0.02 0.00 1.00 0.00 0.00 64.86 65.52 2kc5 h ILE 23 Cb 1.29 0.58 -0.01 0.00 -0.74 0.00 0.00 36.82 37.94 2kc5 h ILE 23 CO 0.14 0.12 -0.01 0.00 0.00 0.00 0.00 178.15 178.40 2kc5 h ALA 24 N 1.12 1.69 -0.55 1.87 0.00 -0.67 -0.39 119.26 122.33 2kc5 h ALA 24 Ca 0.15 -0.11 -0.09 0.00 0.00 0.00 0.00 54.91 54.86 2kc5 h ALA 24 Cb -0.01 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 2kc5 h ALA 24 CO -0.03 0.24 -0.00 -0.09 0.00 0.00 0.00 179.25 179.37 2kc5 h ARG 25 N 0.23 0.94 0.00 0.00 2.43 -0.81 -3.02 114.38 114.14 2kc5 h ARG 25 Ca 0.05 -0.28 0.00 0.00 -0.81 0.00 0.00 59.98 58.95 2kc5 h ARG 25 Cb 0.18 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 29.63 2kc5 h ARG 25 CO 0.00 0.93 -0.42 0.54 -1.51 0.00 0.00 179.97 179.51 2kc5 n ARG 26 N -4.19 0.20 -0.27 0.20 1.74 -0.52 -3.95 116.66 109.87 2kc5 n ARG 26 Ca 0.03 0.09 -0.04 0.00 -0.77 0.00 0.00 57.85 57.15 2kc5 n ARG 26 Cb 0.33 -1.65 0.07 0.00 -1.02 0.00 0.00 32.46 30.18 2kc5 n ARG 26 CO 0.00 0.00 0.00 0.77 -1.52 0.00 0.00 177.63 176.88 2kc5 h SER 27 N 0.00 0.83 -6.69 0.55 0.02 -0.98 -3.47 113.55 103.81 2kc5 h SER 27 Ca 0.00 -0.02 -0.54 0.00 -0.84 0.00 0.00 61.79 60.39 2kc5 h SER 27 Cb 0.67 -0.20 -0.07 0.00 0.14 0.00 0.00 62.40 62.94 2kc5 h SER 27 CO 0.00 0.60 -0.94 0.23 -1.14 0.00 0.00 176.83 175.58 2kc5 n MET 28 N -4.59 -1.93 0.28 3.45 2.81 -1.25 -4.85 117.12 111.04 2kc5 n MET 28 Ca 0.07 0.28 0.15 0.00 -1.81 0.00 0.00 57.70 56.39 2kc5 n MET 28 Cb 0.03 -3.93 0.80 0.00 -0.71 0.00 0.00 33.22 29.41 2kc5 n MET 28 CO 0.00 0.00 0.00 1.12 1.51 0.00 0.00 175.97 178.60 2kc5 h HIS 29 N -1.95 0.00 -4.39 2.03 2.07 -1.91 -3.38 115.15 107.63 2kc5 h HIS 29 Ca -0.66 0.00 -0.69 0.00 -2.85 0.00 0.00 60.37 56.17 2kc5 h HIS 29 Cb 1.38 0.00 -0.31 0.00 2.57 0.00 0.00 27.41 31.06 2kc5 h HIS 29 CO 0.46 0.08 -0.89 0.34 -3.07 0.00 0.00 177.93 174.85 2kc5 s ASP 30 N -5.89 3.04 0.00 3.10 2.15 -1.26 -5.04 116.67 112.76 2kc5 s ASP 30 Ca -0.02 -0.48 0.25 0.00 0.43 0.00 0.00 52.55 52.72 2kc5 s ASP 30 Cb 0.12 -0.52 1.48 0.00 -0.30 0.00 0.00 42.92 43.70 2kc5 s ASP 30 CO 0.55 0.29 1.84 0.18 -0.17 0.00 0.00 175.17 177.86 2kc5 n LEU 31 N 2.63 0.00 -0.29 -1.34 4.77 -1.26 -1.45 117.00 120.06 2kc5 n LEU 31 Ca -0.17 0.00 0.08 0.00 -0.03 0.00 0.00 56.01 55.89 2kc5 n LEU 31 Cb 0.51 -0.00 0.13 0.00 -2.33 0.00 0.00 43.42 41.73 2kc5 n LEU 31 CO 0.24 -0.00 0.46 -1.20 -1.33 0.00 0.00 177.39 175.56 2kc5 n SER 32 N -1.00 1.83 -0.25 -1.43 7.64 -1.26 -4.85 113.62 114.30 2kc5 n SER 32 Ca 0.19 -3.04 -0.04 0.00 1.01 0.00 0.00 58.87 56.99 2kc5 n SER 32 Cb 0.09 -0.41 0.07 0.00 -1.01 0.00 0.00 64.21 62.95 2kc5 n SER 32 CO 0.00 0.00 0.00 0.15 -3.01 0.00 0.00 175.04 172.18 2kc5 h PHE 33 N 0.23 0.83 0.00 1.43 3.57 -1.62 -3.46 116.94 117.92 2kc5 h PHE 33 Ca -0.01 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.51 2kc5 h PHE 33 Cb 1.10 -0.27 0.00 0.00 2.79 0.00 0.00 35.95 39.56 2kc5 h PHE 33 CO 0.16 0.48 0.00 1.28 -2.23 0.00 0.00 178.31 178.01 2kc5 n LEU 34 N -4.66 0.00 -4.76 0.59 4.77 -1.26 -4.64 117.00 107.05 2kc5 n LEU 34 Ca 0.07 0.00 -0.40 0.00 -0.03 0.00 0.00 56.01 55.65 2kc5 n LEU 34 Cb 0.08 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.12 2kc5 n LEU 34 CO 0.33 0.00 0.78 -2.28 -1.33 0.00 0.00 177.39 174.90 2kc5 s HIS 35 N 0.00 3.58 -0.80 -1.77 5.04 -1.26 -4.74 115.29 115.35 2kc5 s HIS 35 Ca 0.00 1.71 -0.20 0.00 -1.54 0.00 0.00 55.06 55.02 2kc5 s HIS 35 Cb 0.00 -3.27 -0.14 0.00 0.04 0.00 0.00 32.58 29.21 2kc5 s HIS 35 CO 0.00 -0.52 1.95 -0.35 -2.34 0.00 0.00 174.74 173.48 2kc5 n PRO 36 N 1.15 1.58 0.26 2.88 -0.04 -1.26 -4.60 135.00 134.96 2kc5 n PRO 36 Ca -0.01 -1.83 0.14 0.00 -0.04 0.00 0.00 63.50 61.77 2kc5 n PRO 36 Cb 0.45 -2.89 0.60 0.00 -0.04 0.00 0.00 33.50 31.62 2kc5 n PRO 36 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 2kc5 h SER 37 N 7.71 0.00 -3.37 3.54 0.02 -1.92 -3.42 113.55 116.12 2kc5 h SER 37 Ca 0.43 0.00 -0.56 0.00 -0.84 0.00 0.00 61.79 60.82 2kc5 h SER 37 Cb 0.62 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 63.12 2kc5 h SER 37 CO 1.92 0.08 0.20 -0.32 -1.14 0.00 0.00 176.83 177.58 2kc5 s MET 38 N -3.67 4.45 0.12 3.45 -2.45 -1.26 -4.97 119.30 114.96 2kc5 s MET 38 Ca 0.01 1.04 -0.35 0.00 -1.25 0.00 0.00 55.69 55.14 2kc5 s MET 38 Cb 0.09 -3.47 -0.15 0.00 1.25 0.00 0.00 34.83 32.56 2kc5 s MET 38 CO 0.58 -0.02 1.53 -2.30 1.05 0.00 0.00 175.02 175.86 2kc5 n PRO 39 N 4.02 1.84 -3.58 4.11 -0.02 -1.26 -4.62 135.00 135.48 2kc5 n PRO 39 Ca 0.01 0.66 -0.40 0.00 -2.02 0.00 0.00 63.50 61.76 2kc5 n PRO 39 Cb 0.51 -2.40 -0.09 0.00 -0.02 0.00 0.00 33.50 31.50 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 1.03 4.18 0.10 -1.45 1.01 -1.26 -4.16 120.40 119.85 2kc5 s VAL 40 Ca 0.82 -1.62 0.04 0.00 0.00 0.00 0.00 61.98 61.21 2kc5 s VAL 40 Cb -0.77 -3.67 -0.04 0.00 0.00 0.00 0.00 36.38 31.90 2kc5 s VAL 40 CO 0.42 -0.65 -0.10 -0.47 0.00 0.00 0.00 175.10 174.29 2kc5 s TYR 41 N 1.38 1.11 -0.08 5.22 5.04 -0.48 -4.93 117.35 124.61 2kc5 s TYR 41 Ca 0.05 -0.66 -0.01 0.00 -2.44 0.00 0.00 57.07 54.00 2kc5 s TYR 41 Cb -0.25 -0.60 0.03 0.00 0.35 0.00 0.00 41.96 41.49 2kc5 s TYR 41 CO 0.00 0.02 -0.01 0.08 -1.34 0.00 0.00 175.55 174.30 2kc5 s VAL 42 N -2.51 0.50 0.10 3.14 1.01 -1.26 -0.98 120.40 120.40 2kc5 s VAL 42 Ca 0.07 0.05 -0.14 0.00 0.00 0.00 0.00 61.98 61.96 2kc5 s VAL 42 Cb -0.02 -0.63 -0.06 0.00 0.00 0.00 0.00 36.38 35.67 2kc5 s VAL 42 CO 0.00 0.28 0.49 -0.44 0.00 0.00 0.00 175.10 175.43 2kc5 s SER 43 N 1.92 6.79 0.07 3.32 0.01 0.17 -4.96 113.70 121.02 2kc5 s SER 43 Ca 0.05 1.00 0.08 0.00 1.31 0.00 0.00 55.95 58.39 2kc5 s SER 43 Cb -0.12 -2.26 -0.03 0.00 0.21 0.00 0.00 66.02 63.82 2kc5 s SER 43 CO -0.06 0.17 -0.22 1.51 0.41 0.00 0.00 173.24 175.05 2kc5 s ASP 44 N -1.59 2.67 0.27 2.44 -4.77 -1.26 -1.04 116.67 113.39 2kc5 s ASP 44 Ca 0.34 -0.60 -0.08 0.00 -3.30 0.00 0.00 52.55 48.91 2kc5 s ASP 44 Cb -0.15 -0.20 -0.01 0.00 -1.09 0.00 0.00 42.92 41.47 2kc5 s ASP 44 CO 0.18 0.15 0.43 -0.36 0.70 0.00 0.00 175.17 176.27 2kc5 s PHE 45 N -0.93 0.68 0.00 2.11 0.40 0.14 -4.92 117.98 115.46 2kc5 s PHE 45 Ca 0.08 -0.99 0.00 0.00 -0.60 0.00 0.00 56.93 55.42 2kc5 s PHE 45 Cb -0.09 0.01 0.00 0.00 0.51 0.00 0.00 43.02 43.45 2kc5 s PHE 45 CO 0.03 -1.00 0.00 2.41 0.70 0.00 0.00 175.22 177.36 2kc5 n THR 46 N -0.42 0.00 -1.75 0.64 -1.04 -1.26 -2.28 114.28 108.16 2kc5 n THR 46 Ca -0.00 0.00 -0.42 0.00 -2.04 0.00 0.00 64.05 61.58 2kc5 n THR 46 Cb 0.62 0.00 -0.01 0.00 -1.82 0.00 0.00 70.33 69.13 2kc5 n THR 46 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 2kc5 n LEU 47 N 0.00 6.34 -4.66 -4.42 7.94 -1.26 -0.98 117.00 119.96 2kc5 n LEU 47 Ca 0.00 -3.97 -0.43 0.00 -1.11 0.00 0.00 56.01 50.50 2kc5 n LEU 47 Cb 0.00 -1.61 -0.02 0.00 0.53 0.00 0.00 43.42 42.31 2kc5 n LEU 47 CO 0.00 0.82 1.26 0.12 -1.11 0.00 0.00 177.39 178.49 2kc5 s PHE 48 N 3.59 2.30 -1.36 1.96 5.36 0.45 -3.18 117.98 127.09 2kc5 s PHE 48 Ca 0.49 0.50 -0.10 0.00 -0.96 0.00 0.00 56.93 56.86 2kc5 s PHE 48 Cb 0.13 -3.77 0.07 0.00 -0.34 0.00 0.00 43.02 39.12 2kc5 s PHE 48 CO -0.05 -3.05 0.57 0.39 -1.46 0.00 0.00 175.22 171.62 2kc5 n GLU 49 N 6.95 -3.74 -0.81 10.12 -0.58 -1.26 -1.33 120.64 129.99 2kc5 n GLU 49 Ca 0.16 0.52 0.00 0.00 -0.42 0.00 0.00 57.16 57.42 2kc5 n GLU 49 Cb 0.44 -5.27 0.00 0.00 -0.57 0.00 0.00 31.44 26.04 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 -1.27 0.59 2.97 0.62 0.00 -1.19 -5.05 105.19 101.86 2kc5 n GLY 50 Ca -0.01 -0.07 -0.12 0.00 0.00 0.00 0.00 46.02 45.81 2kc5 n GLY 50 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2kc5 s GLN 51 N -0.31 0.15 0.33 1.61 -2.07 -0.45 -3.27 119.66 115.66 2kc5 s GLN 51 Ca 0.00 -0.01 -0.29 0.00 -1.82 0.00 0.00 55.36 53.24 2kc5 s GLN 51 Cb 0.00 0.07 -0.10 0.00 -1.09 0.00 0.00 33.01 31.88 2kc5 s GLN 51 CO 0.00 -0.02 1.30 -1.58 -1.32 0.00 0.00 175.29 173.66 2kc5 s TRP 52 N -0.24 3.05 0.48 9.60 0.52 0.53 -0.41 118.94 132.46 2kc5 s TRP 52 Ca -0.03 1.42 -0.03 0.00 0.02 0.00 0.00 56.10 57.48 2kc5 s TRP 52 Cb -0.02 -3.67 -0.02 0.00 -1.15 0.00 0.00 33.47 28.61 2kc5 s TRP 52 CO 0.00 -1.82 0.75 0.95 0.02 0.00 0.00 176.95 176.84 2kc5 s THR 53 N -1.15 4.43 0.03 2.01 -4.23 -0.15 -1.05 115.64 115.52 2kc5 s THR 53 Ca 0.49 -0.12 -0.29 0.00 -1.18 0.00 0.00 61.69 60.59 2kc5 s THR 53 Cb -0.39 -3.67 0.10 0.00 1.34 0.00 0.00 72.50 69.87 2kc5 s THR 53 CO 0.52 -0.59 1.10 -0.83 -0.54 0.00 0.00 174.62 174.29 2kc5 s GLY 54 N -4.17 -0.34 0.00 3.99 0.00 0.09 -0.69 107.32 106.21 2kc5 s GLY 54 Ca 0.48 0.64 -0.03 0.00 0.00 0.00 0.00 44.72 45.81 2kc5 s GLY 54 CO 0.42 0.16 0.04 0.00 0.00 0.00 0.00 173.10 173.71 2kc5 s VAL 56 N -1.03 2.05 0.09 0.00 0.11 0.16 -0.66 120.40 121.12 2kc5 s VAL 56 Ca -0.11 -1.21 0.09 0.00 -2.93 0.00 0.00 61.98 57.82 2kc5 s VAL 56 Cb -0.07 -1.72 -0.03 0.00 -1.53 0.00 0.00 36.38 33.03 2kc5 s VAL 56 CO -0.00 0.48 -0.23 -0.51 -3.33 0.00 0.00 175.10 171.50 2kc5 s ILE 57 N -0.69 1.90 0.28 7.04 2.07 -0.15 -1.18 121.20 130.48 2kc5 s ILE 57 Ca 0.10 -1.53 0.02 0.00 -1.41 0.00 0.00 60.65 57.84 2kc5 s ILE 57 Cb -0.10 -1.69 -0.03 0.00 0.13 0.00 0.00 42.46 40.77 2kc5 s ILE 57 CO 0.00 0.07 0.26 0.42 -1.91 0.00 0.00 174.94 173.79 2kc5 s THR 58 N -1.03 0.00 0.36 4.00 -4.23 0.05 -1.38 115.64 113.41 2kc5 s THR 58 Ca 0.09 -1.92 0.35 0.00 -1.18 0.00 0.00 61.69 59.03 2kc5 s THR 58 Cb -0.10 -2.50 0.37 0.00 1.34 0.00 0.00 72.50 71.61 2kc5 s THR 58 CO 0.04 0.00 2.12 -0.65 -0.54 0.00 0.00 174.62 175.59 2kc5 h PRO 59 N 2.30 0.00 0.00 3.99 0.11 -1.82 -3.24 132.00 133.34 2kc5 h PRO 59 Ca -0.29 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.75 2kc5 h PRO 59 Cb 1.24 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.34 2kc5 h PRO 59 CO 0.42 0.05 -1.88 -2.67 -0.21 0.00 0.00 178.00 173.71 2kc5 n TRP 60 N -3.27 0.20 -3.82 0.65 4.27 -1.26 -0.85 117.44 113.36 2kc5 n TRP 60 Ca -0.01 0.06 -0.08 0.00 -3.89 0.00 0.00 57.50 53.58 2kc5 n TRP 60 Cb 0.22 -0.68 0.02 0.00 -1.36 0.00 0.00 31.31 29.51 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 -3.31 2.03 -0.07 -2.67 0.23 -1.22 -2.26 119.30 112.03 2kc5 s MET 61 Ca -0.07 -1.29 -0.03 0.00 -1.03 0.00 0.00 55.69 53.27 2kc5 s MET 61 Cb 0.12 0.58 0.04 0.00 -1.53 0.00 0.00 34.83 34.04 2kc5 s MET 61 CO 0.87 -0.95 0.16 -1.17 -2.03 0.00 0.00 175.02 171.91 2kc5 s LEU 62 N -3.11 0.48 -0.03 0.18 0.20 -1.26 -0.77 118.68 114.38 2kc5 s LEU 62 Ca 0.16 0.33 0.01 0.00 0.69 0.00 0.00 54.13 55.31 2kc5 s LEU 62 Cb -0.05 0.37 0.02 0.00 -0.43 0.00 0.00 46.19 46.11 2kc5 s LEU 62 CO 0.10 -0.18 -0.01 -0.44 -0.29 0.00 0.00 176.35 175.53 2kc5 s SER 63 N 1.49 0.48 0.45 3.68 0.01 -0.33 -1.47 113.70 118.02 2kc5 s SER 63 Ca -0.06 -0.04 -0.22 0.00 1.31 0.00 0.00 55.95 56.94 2kc5 s SER 63 Cb -0.12 -0.24 -0.08 0.00 0.21 0.00 0.00 66.02 65.79 2kc5 s SER 63 CO -0.06 -0.08 1.08 0.00 0.41 0.00 0.00 173.24 174.58 2kc5 s ALA 64 N 0.91 2.95 0.05 1.44 0.00 0.25 -0.66 121.76 126.71 2kc5 s ALA 64 Ca -0.10 0.73 0.02 0.00 0.00 0.00 0.00 51.96 52.61 2kc5 s ALA 64 Cb -0.13 -3.30 -0.03 0.00 0.00 0.00 0.00 23.12 19.67 2kc5 s ALA 64 CO -0.01 -0.39 -0.08 0.14 0.00 0.00 0.00 175.76 175.42 2kc5 s VAL 65 N -1.75 0.58 -0.02 0.00 -7.23 -0.18 -0.89 120.40 110.91 2kc5 s VAL 65 Ca 0.64 -1.24 0.01 0.00 -1.81 0.00 0.00 61.98 59.58 2kc5 s VAL 65 Cb -0.22 -0.81 0.01 0.00 0.56 0.00 0.00 36.38 35.92 2kc5 s VAL 65 CO 0.26 -0.47 -0.04 -0.63 -0.31 0.00 0.00 175.10 173.91 2kc5 s ILE 66 N -1.79 0.40 0.00 -0.62 1.01 0.67 -0.73 121.20 120.13 2kc5 s ILE 66 Ca -0.06 -0.12 0.04 0.00 0.00 0.00 0.00 60.65 60.52 2kc5 s ILE 66 Cb -0.07 -0.41 -0.01 0.00 0.01 0.00 0.00 42.46 41.98 2kc5 s ILE 66 CO -0.01 0.16 -0.14 0.12 0.00 0.00 0.00 174.94 175.08 2kc5 s PHE 67 N 0.50 1.23 0.39 3.97 5.36 -0.22 -1.90 117.98 127.31 2kc5 s PHE 67 Ca -0.06 -0.26 -0.26 0.00 -0.96 0.00 0.00 56.93 55.39 2kc5 s PHE 67 Cb -0.09 -0.77 -0.11 0.00 -0.34 0.00 0.00 43.02 41.70 2kc5 s PHE 67 CO -0.00 -0.01 1.16 -2.30 -1.46 0.00 0.00 175.22 172.61 2kc5 n PRO 68 N 2.53 1.71 -1.62 10.12 -0.02 -1.26 -0.35 135.00 146.11 2kc5 n PRO 68 Ca -0.15 0.61 -0.29 0.00 -2.02 0.00 0.00 63.50 61.64 2kc5 n PRO 68 Cb 0.55 -2.20 0.16 0.00 -0.02 0.00 0.00 33.50 32.00 2kc5 n PRO 68 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 2kc5 s GLY 69 N -0.56 1.64 0.55 -1.23 0.00 -1.20 -3.65 107.32 102.86 2kc5 s GLY 69 Ca 0.60 -0.83 -0.20 0.00 0.00 0.00 0.00 44.72 44.29 2kc5 s GLY 69 CO 0.59 -0.15 1.22 2.56 0.00 0.00 0.00 173.10 177.31 2kc5 s PRO 70 N -5.53 3.23 -1.45 2.90 0.04 -1.04 -3.50 135.00 129.65 2kc5 s PRO 70 Ca 0.68 1.88 -0.08 0.00 0.04 0.00 0.00 61.00 63.52 2kc5 s PRO 70 Cb -0.10 -2.12 0.05 0.00 0.04 0.00 0.00 34.50 32.37 2kc5 s PRO 70 CO 0.53 -1.01 0.85 -3.47 0.04 0.00 0.00 177.00 173.94 2kc5 n ASP 71 N -1.18 -3.21 -4.41 6.66 2.03 -1.13 -4.91 116.55 110.40 2kc5 n ASP 71 Ca 0.11 -0.81 -0.30 0.00 0.52 0.00 0.00 54.79 54.32 2kc5 n ASP 71 Cb 0.48 -3.89 -0.13 0.00 -0.72 0.00 0.00 41.12 36.87 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 -6.39 1.66 -0.69 -0.67 -0.21 -1.23 -4.99 119.66 107.13 2kc5 s GLN 72 Ca 0.39 -1.21 0.02 0.00 0.02 0.00 0.00 55.36 54.57 2kc5 s GLN 72 Cb -0.19 -2.00 0.17 0.00 1.00 0.00 0.00 33.01 31.98 2kc5 s GLN 72 CO 0.83 0.48 0.50 -0.51 -2.12 0.00 0.00 175.29 174.47 2kc5 s LEU 73 N -1.82 4.96 -0.08 2.90 2.01 -1.26 -0.75 118.68 124.64 2kc5 s LEU 73 Ca 0.14 -3.46 -0.30 0.00 0.01 0.00 0.00 54.13 50.53 2kc5 s LEU 73 Cb -0.10 -1.74 -0.04 0.00 0.01 0.00 0.00 46.19 44.32 2kc5 s LEU 73 CO 0.06 -0.19 1.42 0.86 1.01 0.00 0.00 176.35 179.51 2kc5 s TRP 74 N -0.92 2.59 0.56 0.29 -0.00 0.49 -4.68 118.94 117.28 2kc5 s TRP 74 Ca 0.22 0.71 -0.20 0.00 -0.00 0.00 0.00 56.10 56.83 2kc5 s TRP 74 Cb -0.13 -3.67 -0.05 0.00 -0.00 0.00 0.00 33.47 29.62 2kc5 s TRP 74 CO -0.09 -2.56 1.09 -2.30 -0.00 0.00 0.00 176.95 173.09 2kc5 n PRO 75 N 6.37 1.18 -1.70 5.86 -0.02 -1.26 -0.81 135.00 144.62 2kc5 n PRO 75 Ca 0.15 0.44 -0.43 0.00 -2.02 0.00 0.00 63.50 61.63 2kc5 n PRO 75 Cb 0.44 -2.27 -0.03 0.00 -0.02 0.00 0.00 33.50 31.61 2kc5 n PRO 75 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 2kc5 n LEU 76 N -0.69 3.77 -4.72 2.45 7.94 -1.26 -4.79 117.00 119.70 2kc5 n LEU 76 Ca 0.12 1.04 -0.23 0.00 -1.11 0.00 0.00 56.01 55.83 2kc5 n LEU 76 Cb 0.45 -1.52 -0.06 0.00 0.53 0.00 0.00 43.42 42.82 2kc5 n LEU 76 CO 0.51 0.06 -0.26 -0.13 -1.11 0.00 0.00 177.39 176.46 2kc5 s ARG 77 N 1.73 2.56 0.18 1.96 1.81 -1.26 -5.00 118.95 120.92 2kc5 s ARG 77 Ca 0.79 -1.24 -0.21 0.00 -1.72 0.00 0.00 55.73 53.35 2kc5 s ARG 77 Cb -0.55 -2.34 -0.08 0.00 -0.45 0.00 0.00 34.95 31.53 2kc5 s ARG 77 CO 0.36 0.39 0.70 0.21 -0.68 0.00 0.00 175.30 176.27 2kc5 s LYS 78 N -3.67 4.30 0.36 3.54 2.47 -1.26 -5.06 119.74 120.41 2kc5 s LYS 78 Ca 0.32 0.89 -0.08 0.00 -1.56 0.00 0.00 55.97 55.53 2kc5 s LYS 78 Cb -0.07 -3.04 -0.06 0.00 -1.46 0.00 0.00 37.83 33.20 2kc5 s LYS 78 CO 0.22 0.49 0.67 0.08 0.16 0.00 0.00 175.35 176.97 2kc5 s VAL 79 N -1.36 4.90 -0.05 4.02 1.01 -1.26 -3.90 120.40 123.76 2kc5 s VAL 79 Ca 0.38 0.35 0.00 0.00 0.00 0.00 0.00 61.98 62.71 2kc5 s VAL 79 Cb -0.19 -3.74 0.00 0.00 0.00 0.00 0.00 36.38 32.46 2kc5 s VAL 79 CO 0.22 -0.44 0.00 -1.20 0.00 0.00 0.00 175.10 173.67 2kc5 n SER 80 N -1.17 -5.11 -4.84 3.32 7.64 -0.09 -4.98 113.62 108.39 2kc5 n SER 80 Ca 0.00 0.01 -0.32 0.00 1.01 0.00 0.00 58.87 59.58 2kc5 n SER 80 Cb 0.54 -2.65 -0.04 0.00 -1.01 0.00 0.00 64.21 61.05 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 -1.47 3.97 -0.04 1.43 0.41 -1.25 -4.82 118.70 116.93 2kc5 s GLU 81 Ca 0.00 0.91 0.00 0.00 -0.41 0.00 0.00 54.97 55.47 2kc5 s GLU 81 Cb 0.00 -2.18 -0.03 0.00 -1.78 0.00 0.00 34.13 30.13 2kc5 s GLU 81 CO 0.00 -0.20 -0.00 0.15 -0.49 0.00 0.00 175.26 174.72 2kc5 s LYS 82 N -3.89 2.85 -0.15 1.61 1.02 -1.26 -0.36 119.74 119.56 2kc5 s LYS 82 Ca 0.58 -0.54 0.01 0.00 0.02 0.00 0.00 55.97 56.05 2kc5 s LYS 82 Cb -0.10 -2.70 0.01 0.00 -0.52 0.00 0.00 37.83 34.51 2kc5 s LYS 82 CO 0.28 0.65 -0.19 0.42 -0.92 0.00 0.00 175.35 175.60 2kc5 s ILE 83 N -1.00 2.31 -0.18 2.17 -1.09 -0.01 -4.96 121.20 118.45 2kc5 s ILE 83 Ca 0.17 -0.89 -0.29 0.00 -2.23 0.00 0.00 60.65 57.41 2kc5 s ILE 83 Cb -0.11 -1.96 -0.00 0.00 -1.58 0.00 0.00 42.46 38.81 2kc5 s ILE 83 CO 0.07 0.53 1.13 -0.83 -1.23 0.00 0.00 174.94 174.61 2kc5 s GLY 84 N 0.91 1.77 -0.21 6.18 0.00 -1.26 -1.00 107.32 113.72 2kc5 s GLY 84 Ca -0.04 0.33 -0.06 0.00 0.00 0.00 0.00 44.72 44.95 2kc5 s GLY 84 CO -0.03 2.28 0.04 1.08 0.00 0.00 0.00 173.10 176.46 2kc5 s LEU 85 N 3.11 3.45 -1.25 0.66 1.43 -0.36 -4.97 118.68 120.75 2kc5 s LEU 85 Ca 0.49 -0.13 -0.15 0.00 -1.03 0.00 0.00 54.13 53.31 2kc5 s LEU 85 Cb -0.18 -1.89 0.13 0.00 0.03 0.00 0.00 46.19 44.28 2kc5 s LEU 85 CO 0.11 0.06 1.58 1.67 0.23 0.00 0.00 176.35 180.01 2kc5 n GLN 86 N 4.25 3.30 -2.53 1.70 0.00 -1.26 -1.34 117.38 121.51 2kc5 n GLN 86 Ca -0.17 -3.60 -0.37 0.00 -0.00 0.00 0.00 57.00 52.87 2kc5 n GLN 86 Cb 0.52 -3.21 -0.04 0.00 0.00 0.00 0.00 30.24 27.51 2kc5 n GLN 86 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 2kc5 s LEU 87 N 2.51 4.14 0.58 1.69 1.43 -1.25 -4.92 118.68 122.86 2kc5 s LEU 87 Ca 0.47 2.06 0.28 0.00 -1.03 0.00 0.00 54.13 55.91 2kc5 s LEU 87 Cb 0.01 -4.18 1.76 0.00 0.03 0.00 0.00 46.19 43.81 2kc5 s LEU 87 CO 0.03 -0.51 2.24 -0.65 0.23 0.00 0.00 176.35 177.69 2kc5 h PRO 88 N 2.49 0.00 -0.48 1.29 0.11 -1.94 -0.20 132.00 133.27 2kc5 h PRO 88 Ca -0.48 0.00 0.13 0.00 0.11 0.00 0.00 66.00 65.76 2kc5 h PRO 88 Cb 1.22 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.31 2kc5 h PRO 88 CO 0.62 0.01 0.34 -0.92 -0.21 0.00 0.00 178.00 177.84 2kc5 h TYR 89 N 0.00 0.04 0.00 0.65 3.20 -1.86 -3.47 116.97 115.53 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 0.02 -0.01 0.00 0.00 1.54 0.00 0.00 36.73 38.28 2kc5 h TYR 89 CO 0.00 0.02 0.00 0.41 -1.64 0.00 0.00 178.16 176.95 2kc5 n GLY 90 N -1.62 4.68 3.73 1.82 0.00 -0.09 -5.09 105.19 108.62 2kc5 n GLY 90 Ca 0.08 -1.12 -0.42 0.00 0.00 0.00 0.00 46.02 44.56 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 -1.32 2.20 -0.02 2.61 2.01 -1.25 -3.78 115.64 116.09 2kc5 s THR 91 Ca 0.00 0.15 -0.00 0.00 0.31 0.00 0.00 61.69 62.15 2kc5 s THR 91 Cb 0.00 -3.10 0.03 0.00 0.01 0.00 0.00 72.50 69.44 2kc5 s THR 91 CO 0.00 0.01 0.04 -0.32 -0.69 0.00 0.00 174.62 173.66 2kc5 s MET 92 N 0.76 -0.03 0.06 4.92 0.00 -0.45 -4.94 119.30 119.62 2kc5 s MET 92 Ca 0.71 0.20 -0.30 0.00 0.00 0.00 0.00 55.69 56.30 2kc5 s MET 92 Cb -0.48 -0.25 -0.05 0.00 0.00 0.00 0.00 34.83 34.06 2kc5 s MET 92 CO 0.35 -0.17 0.96 0.95 0.00 0.00 0.00 175.02 177.11 2kc5 s THR 93 N 1.09 4.67 -0.13 10.11 -4.23 -1.26 -1.23 115.64 124.66 2kc5 s THR 93 Ca -0.09 2.04 -0.04 0.00 -1.18 0.00 0.00 61.69 62.42 2kc5 s THR 93 Cb -0.13 -4.31 -0.03 0.00 1.34 0.00 0.00 72.50 69.37 2kc5 s THR 93 CO -0.03 0.25 0.01 -0.36 -0.54 0.00 0.00 174.62 173.96 2kc5 s PHE 94 N 0.42 3.17 0.06 3.99 0.40 -0.17 -4.86 117.98 121.00 2kc5 s PHE 94 Ca 0.49 0.07 -0.21 0.00 -0.60 0.00 0.00 56.93 56.67 2kc5 s PHE 94 Cb -0.22 -1.91 -0.06 0.00 0.51 0.00 0.00 43.02 41.34 2kc5 s PHE 94 CO 0.29 0.29 0.63 0.99 0.70 0.00 0.00 175.22 178.11 2kc5 s THR 95 N -0.29 4.74 -0.04 0.64 2.01 0.54 -0.83 115.64 122.41 2kc5 s THR 95 Ca 0.07 1.34 -0.30 0.00 0.31 0.00 0.00 61.69 63.11 2kc5 s THR 95 Cb -0.12 -3.97 -0.05 0.00 0.01 0.00 0.00 72.50 68.37 2kc5 s THR 95 CO 0.02 0.49 1.52 -0.69 -0.69 0.00 0.00 174.62 175.27 2kc5 s VAL 96 N -0.72 3.65 0.20 3.82 1.01 0.51 -0.63 120.40 128.25 2kc5 s VAL 96 Ca 0.32 0.91 0.06 0.00 0.00 0.00 0.00 61.98 63.27 2kc5 s VAL 96 Cb -0.20 -3.59 -0.04 0.00 0.00 0.00 0.00 36.38 32.56 2kc5 s VAL 96 CO 0.20 -0.05 0.12 -0.83 0.00 0.00 0.00 175.10 174.54 2kc5 s GLY 97 N 2.61 1.61 -0.41 4.51 0.00 -0.10 -0.91 107.32 114.63 2kc5 s GLY 97 Ca 0.68 -1.35 0.03 0.00 0.00 0.00 0.00 44.72 44.08 2kc5 s GLY 97 CO 0.27 -1.37 0.15 1.85 0.00 0.00 0.00 173.10 173.99 2kc5 s GLU 98 N -3.38 1.54 -0.24 2.90 2.12 -1.26 -1.63 118.70 118.75 2kc5 s GLU 98 Ca 0.31 -2.06 -0.29 0.00 0.36 0.00 0.00 54.97 53.29 2kc5 s GLU 98 Cb -0.09 -3.01 -0.01 0.00 0.26 0.00 0.00 34.13 31.27 2kc5 s GLU 98 CO 0.23 -1.03 1.44 -1.17 -0.54 0.00 0.00 175.26 174.19 2kc5 s LEU 99 N 0.51 3.95 0.23 2.70 0.20 -0.47 -4.94 118.68 120.86 2kc5 s LEU 99 Ca 0.14 1.49 -0.31 0.00 0.69 0.00 0.00 54.13 56.13 2kc5 s LEU 99 Cb -0.22 -3.54 -0.12 0.00 -0.43 0.00 0.00 46.19 41.89 2kc5 s LEU 99 CO -0.06 -1.11 1.67 -0.62 -0.29 0.00 0.00 176.35 175.95 2kc5 s ASP 100 N 3.31 6.38 0.00 3.68 2.15 -1.26 -1.35 116.67 129.58 2kc5 s ASP 100 Ca 0.63 2.89 0.00 0.00 0.43 0.00 0.00 52.55 56.50 2kc5 s ASP 100 Cb -0.21 -2.61 0.00 0.00 -0.30 0.00 0.00 42.92 39.79 2kc5 s ASP 100 CO 0.25 -0.95 0.00 0.61 -0.17 0.00 0.00 175.17 174.91 2kc5 n GLY 101 N 3.38 0.67 0.00 2.66 0.00 -1.26 -4.87 105.19 105.76 2kc5 n GLY 101 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 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 -2.23 0.00 -3.81 1.61 0.31 -0.46 -5.10 118.33 108.66 2kc5 n VAL 102 Ca 0.00 0.00 -0.05 0.00 -0.01 0.00 0.00 64.34 64.28 2kc5 n VAL 102 Cb 0.03 0.00 -0.01 0.00 -0.91 0.00 0.00 33.84 32.95 2kc5 n VAL 102 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 2kc5 s SER 103 N 1.00 -0.17 0.39 4.52 1.04 -1.02 -4.97 113.70 114.49 2kc5 s SER 103 Ca 0.00 -0.57 -0.25 0.00 0.48 0.00 0.00 55.95 55.61 2kc5 s SER 103 Cb 0.00 0.60 -0.09 0.00 0.10 0.00 0.00 66.02 66.63 2kc5 s SER 103 CO 0.00 -1.13 1.09 -1.10 0.98 0.00 0.00 173.24 173.08 2kc5 s GLN 104 N -3.29 4.17 0.38 4.02 -0.21 -1.26 -1.37 119.66 122.11 2kc5 s GLN 104 Ca 0.13 1.65 -0.16 0.00 0.02 0.00 0.00 55.36 57.01 2kc5 s GLN 104 Cb -0.03 -2.66 0.06 0.00 1.00 0.00 0.00 33.01 31.38 2kc5 s GLN 104 CO 0.05 -0.17 0.81 1.52 -2.12 0.00 0.00 175.29 175.39 2kc5 s TYR 105 N -1.52 0.14 -0.09 0.91 1.13 -0.65 -4.94 117.35 112.34 2kc5 s TYR 105 Ca 0.56 -0.83 -0.01 0.00 -1.41 0.00 0.00 57.07 55.39 2kc5 s TYR 105 Cb -0.26 0.85 -0.03 0.00 -1.10 0.00 0.00 41.96 41.42 2kc5 s TYR 105 CO 0.33 -1.56 -0.04 -0.51 -2.51 0.00 0.00 175.55 171.25 2kc5 s LEU 106 N -3.11 3.29 0.05 -3.49 1.43 -0.80 -0.93 118.68 115.13 2kc5 s LEU 106 Ca 0.16 0.00 -0.02 0.00 -1.03 0.00 0.00 54.13 53.25 2kc5 s LEU 106 Cb -0.05 -1.74 -0.03 0.00 0.03 0.00 0.00 46.19 44.40 2kc5 s LEU 106 CO 0.11 0.33 -0.01 -0.44 0.23 0.00 0.00 176.35 176.57 2kc5 s SER 107 N -0.58 0.41 -0.20 2.29 0.01 0.20 -0.24 113.70 115.59 2kc5 s SER 107 Ca 0.09 -0.88 -0.04 0.00 1.31 0.00 0.00 55.95 56.43 2kc5 s SER 107 Cb -0.12 0.20 0.09 0.00 0.21 0.00 0.00 66.02 66.39 2kc5 s SER 107 CO 0.02 -0.56 0.18 0.00 0.41 0.00 0.00 173.24 173.29 2kc5 s SER 109 N 2.26 7.09 0.00 0.00 0.01 -1.26 -0.58 113.70 121.22 2kc5 s SER 109 Ca 0.06 1.43 0.00 0.00 1.31 0.00 0.00 55.95 58.75 2kc5 s SER 109 Cb -0.16 -2.42 0.00 0.00 0.21 0.00 0.00 66.02 63.65 2kc5 s SER 109 CO -0.14 0.06 0.00 0.00 0.41 0.00 0.00 173.24 173.58 2kc5 n LEU 110 N 0.87 0.00 -4.26 2.44 -0.00 -0.54 -4.98 117.00 110.52 2kc5 n LEU 110 Ca -0.03 0.00 -0.25 0.00 -0.00 0.00 0.00 56.01 55.73 2kc5 n LEU 110 Cb 0.51 0.00 -0.13 0.00 -0.00 0.00 0.00 43.42 43.79 2kc5 n LEU 110 CO 0.43 0.00 -0.52 -0.32 -0.00 0.00 0.00 177.39 176.99 2kc5 s MET 111 N 0.00 1.26 0.52 1.47 1.75 -1.17 -4.95 119.30 118.18 2kc5 s MET 111 Ca 0.00 -1.03 -0.00 0.00 -1.25 0.00 0.00 55.69 53.40 2kc5 s MET 111 Cb 0.00 -1.44 0.02 0.00 2.84 0.00 0.00 34.83 36.25 2kc5 s MET 111 CO 0.00 0.35 0.75 -1.12 -0.65 0.00 0.00 175.02 174.36 2kc5 s SER 112 N -1.50 5.54 0.78 1.11 0.01 -1.26 -4.02 113.70 114.37 2kc5 s SER 112 Ca 0.07 0.23 -0.13 0.00 1.31 0.00 0.00 55.95 57.43 2kc5 s SER 112 Cb -0.09 -1.28 0.07 0.00 0.21 0.00 0.00 66.02 64.92 2kc5 s SER 112 CO 0.03 -0.95 1.17 -2.84 0.41 0.00 0.00 173.24 171.06 2kc5 s PRO 113 N -4.72 1.90 -0.82 12.44 0.02 -0.96 -4.35 135.00 138.52 2kc5 s PRO 113 Ca 0.53 1.62 -0.02 0.00 0.02 0.00 0.00 61.00 63.15 2kc5 s PRO 113 Cb -0.10 -1.82 -0.00 0.00 0.02 0.00 0.00 34.50 32.60 2kc5 s PRO 113 CO 0.39 -1.99 0.66 -0.11 -0.33 0.00 0.00 177.00 175.63 2kc5 n LEU 114 N -3.18 -4.14 -4.68 -5.54 7.94 -0.03 -4.95 117.00 102.42 2kc5 n LEU 114 Ca 0.12 -0.58 -0.37 0.00 -1.11 0.00 0.00 56.01 54.08 2kc5 n LEU 114 Cb 0.51 -2.44 0.07 0.00 0.53 0.00 0.00 43.42 42.09 2kc5 n LEU 114 CO 0.49 -0.28 0.75 -1.20 -1.11 0.00 0.00 177.39 176.04 2kc5 n SER 115 N -2.25 1.47 -4.79 1.96 7.64 -1.26 -4.99 113.62 111.39 2kc5 n SER 115 Ca -0.16 0.79 -0.35 0.00 1.01 0.00 0.00 58.87 60.16 2kc5 n SER 115 Cb 0.60 -1.49 -0.06 0.00 -1.01 0.00 0.00 64.21 62.25 2kc5 n SER 115 CO 0.00 0.00 0.00 -2.28 -3.01 0.00 0.00 175.04 169.75 2kc5 s HIS 116 N -1.49 3.47 -1.50 1.43 2.46 -1.26 -3.67 115.29 114.72 2kc5 s HIS 116 Ca 0.80 1.69 0.00 0.00 0.47 0.00 0.00 55.06 58.02 2kc5 s HIS 116 Cb -0.38 -2.94 0.00 0.00 -0.13 0.00 0.00 32.58 29.13 2kc5 s HIS 116 CO 0.43 -0.08 0.00 0.43 -2.47 0.00 0.00 174.74 173.05 2kc5 n SER 117 N -0.00 -4.72 -4.77 9.88 7.64 -1.26 -4.94 113.62 115.45 2kc5 n SER 117 Ca 0.04 0.18 -0.40 0.00 1.01 0.00 0.00 58.87 59.70 2kc5 n SER 117 Cb 0.51 -4.05 -0.02 0.00 -1.01 0.00 0.00 64.21 59.65 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 -4.58 4.30 0.35 1.43 0.00 -1.24 -4.82 119.30 114.74 2kc5 s MET 118 Ca 0.00 2.11 -0.17 0.00 0.00 0.00 0.00 55.69 57.63 2kc5 s MET 118 Cb 0.00 -2.99 0.06 0.00 0.00 0.00 0.00 34.83 31.90 2kc5 s MET 118 CO 0.00 -0.19 0.84 -1.54 0.00 0.00 0.00 175.02 174.12 2kc5 s SER 119 N -0.65 0.01 0.50 1.11 1.04 -1.26 -4.98 113.70 109.46 2kc5 s SER 119 Ca 0.50 -1.06 0.19 0.00 0.48 0.00 0.00 55.95 56.06 2kc5 s SER 119 Cb -0.37 0.79 1.26 0.00 0.10 0.00 0.00 66.02 67.79 2kc5 s SER 119 CO 0.49 -1.57 2.08 0.40 0.98 0.00 0.00 173.24 175.62 2kc5 h ILE 120 N 2.00 0.93 -0.05 -1.02 5.03 -1.96 0.88 117.51 123.31 2kc5 h ILE 120 Ca -0.31 -0.36 -0.01 0.00 -0.12 0.00 0.00 64.86 64.05 2kc5 h ILE 120 Cb 1.24 1.20 -0.00 0.00 -3.03 0.00 0.00 36.82 36.23 2kc5 h ILE 120 CO 0.40 0.10 -0.02 -0.33 -0.68 0.00 0.00 178.15 177.62 2kc5 h GLU 121 N 0.00 0.10 -0.59 2.37 5.08 -1.95 -2.26 114.58 117.32 2kc5 h GLU 121 Ca -0.00 -0.04 -0.09 0.00 -1.00 0.00 0.00 59.36 58.22 2kc5 h GLU 121 Cb 0.19 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.42 2kc5 h GLU 121 CO 0.01 0.47 0.01 0.93 -1.00 0.00 0.00 179.01 179.44 2kc5 h GLU 122 N -0.27 1.03 -0.05 2.33 4.39 -1.80 0.17 114.58 120.38 2kc5 h GLU 122 Ca 0.01 -0.31 0.01 0.00 0.34 0.00 0.00 59.36 59.41 2kc5 h GLU 122 Cb 0.44 -0.10 -0.00 0.00 -0.10 0.00 0.00 28.75 28.99 2kc5 h GLU 122 CO 0.01 1.00 0.05 0.78 -1.16 0.00 0.00 179.01 179.69 2kc5 h GLY 123 N 1.00 0.00 0.00 -3.84 0.00 -0.76 -0.41 103.07 99.06 2kc5 h GLY 123 Ca 0.17 0.00 -0.29 0.00 0.00 0.00 0.00 47.33 47.21 2kc5 h GLY 123 CO 0.03 0.00 -1.79 -1.06 0.00 0.00 0.00 176.54 173.72 2kc5 n GLN 124 N -3.83 0.56 -0.20 4.80 6.02 -0.86 -4.51 117.38 119.37 2kc5 n GLN 124 Ca -0.02 0.36 -0.09 0.00 -0.01 0.00 0.00 57.00 57.25 2kc5 n GLN 124 Cb 0.15 -1.57 0.02 0.00 1.02 0.00 0.00 30.24 29.85 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 0.93 -0.01 -1.09 3.08 -0.49 -2.81 114.38 113.00 2kc5 h ARG 125 Ca -0.44 -0.25 -0.22 0.00 0.07 0.00 0.00 59.98 59.13 2kc5 h ARG 125 Cb 1.34 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 31.29 2kc5 h ARG 125 CO -0.27 0.90 -0.92 -0.07 -1.07 0.00 0.00 179.97 178.53 2kc5 h LEU 126 N 0.83 0.53 -0.43 3.04 -0.00 -1.29 0.59 115.31 118.58 2kc5 h LEU 126 Ca 0.17 -0.42 -0.00 0.00 -0.00 0.00 0.00 57.88 57.63 2kc5 h LEU 126 Cb 0.42 -0.16 -0.02 0.00 -0.00 0.00 0.00 40.66 40.89 2kc5 h LEU 126 CO 0.01 1.21 0.27 0.74 -0.00 0.00 0.00 178.44 180.67 2kc5 h THR 127 N 0.24 1.13 -0.09 0.22 2.02 -1.71 0.20 112.91 114.91 2kc5 h THR 127 Ca -0.08 -0.28 -0.02 0.00 0.77 0.00 0.00 66.41 66.81 2kc5 h THR 127 Cb 1.56 0.54 -0.00 0.00 -1.74 0.00 0.00 68.15 68.51 2kc5 h THR 127 CO 0.16 0.13 -0.01 -0.78 0.37 0.00 0.00 175.52 175.39 2kc5 h ASP 128 N 0.57 0.17 -0.62 4.18 3.58 -1.36 -2.22 116.42 120.72 2kc5 h ASP 128 Ca 0.16 -0.33 -0.07 0.00 0.42 0.00 0.00 57.03 57.21 2kc5 h ASP 128 Cb -0.02 -0.04 -0.03 0.00 1.72 0.00 0.00 39.33 40.96 2kc5 h ASP 128 CO -0.03 0.46 0.13 -0.78 -2.88 0.00 0.00 179.24 176.13 2kc5 h ASP 129 N -0.13 0.97 0.89 2.28 3.58 -0.80 0.65 116.42 123.86 2kc5 h ASP 129 Ca 0.03 -0.21 -0.05 0.00 0.42 0.00 0.00 57.03 57.22 2kc5 h ASP 129 Cb 0.38 -0.26 -0.01 0.00 1.72 0.00 0.00 39.33 41.16 2kc5 h ASP 129 CO 0.01 0.96 -0.23 0.00 -2.88 0.00 0.00 179.24 177.09 2kc5 h ALA 131 N 1.77 -0.03 -0.85 0.00 0.00 -1.00 -3.33 119.26 115.81 2kc5 h ALA 131 Ca -0.00 -0.57 0.09 0.00 0.00 0.00 0.00 54.91 54.42 2kc5 h ALA 131 Cb 0.74 0.04 -0.07 0.00 0.00 0.00 0.00 17.79 18.50 2kc5 h ALA 131 CO 0.03 0.18 0.51 -0.09 0.00 0.00 0.00 179.25 179.87 2kc5 h ARG 132 N -0.62 0.84 -0.24 0.00 2.43 -0.38 0.13 114.38 116.55 2kc5 h ARG 132 Ca -0.06 -0.05 0.05 0.00 -0.81 0.00 0.00 59.98 59.10 2kc5 h ARG 132 Cb 1.26 -0.19 -0.05 0.00 -0.42 0.00 0.00 29.97 30.58 2kc5 h ARG 132 CO 0.07 0.56 -0.07 0.00 -1.51 0.00 0.00 179.97 179.03 2kc5 h MET 133 N 0.87 -0.01 0.00 0.20 -0.00 -1.20 -2.35 114.93 112.44 2kc5 h MET 133 Ca 0.40 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 60.10 2kc5 h MET 133 Cb 0.31 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.92 2kc5 h MET 133 CO -0.23 -0.01 0.00 -0.84 -0.00 0.00 0.00 176.91 175.84 2kc5 h ILE 134 N -0.01 0.00 0.00 -0.10 3.07 -1.35 -1.60 117.51 117.52 2kc5 h ILE 134 Ca 0.12 -0.77 0.00 0.00 1.55 0.00 0.00 64.86 65.75 2kc5 h ILE 134 Cb 0.18 1.77 0.00 0.00 -0.27 0.00 0.00 36.82 38.51 2kc5 h ILE 134 CO -0.25 0.00 0.00 -0.11 -1.05 0.00 0.00 178.15 176.74 2kc5 n LEU 135 N -3.06 0.00 -1.82 0.16 7.94 0.35 -4.75 117.00 115.82 2kc5 n LEU 135 Ca 0.03 0.17 -0.18 0.00 -1.11 0.00 0.00 56.01 54.92 2kc5 n LEU 135 Cb 0.43 -0.17 -0.03 0.00 0.53 0.00 0.00 43.42 44.18 2kc5 n LEU 135 CO 0.31 -0.13 -0.21 -1.20 -1.11 0.00 0.00 177.39 175.05 2kc5 n SER 136 N -1.17 -5.15 -4.94 1.96 7.64 -0.60 -4.99 113.62 106.36 2kc5 n SER 136 Ca 0.05 0.12 -0.25 0.00 1.01 0.00 0.00 58.87 59.80 2kc5 n SER 136 Cb 0.05 -4.23 -0.02 0.00 -1.01 0.00 0.00 64.21 59.00 2kc5 n SER 136 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2kc5 s LEU 137 N -4.76 4.19 0.80 -3.43 1.02 -1.08 -4.84 118.68 110.58 2kc5 s LEU 137 Ca 0.00 0.34 -0.14 0.00 0.02 0.00 0.00 54.13 54.35 2kc5 s LEU 137 Cb 0.00 -3.14 0.02 0.00 0.02 0.00 0.00 46.19 43.09 2kc5 s LEU 137 CO 0.00 -0.12 0.80 -2.65 0.02 0.00 0.00 176.35 174.40 2kc5 n PRO 138 N -1.15 0.17 -1.17 1.29 -0.02 -1.26 -4.27 135.00 128.59 2kc5 n PRO 138 Ca -0.06 0.12 -0.30 0.00 -2.02 0.00 0.00 63.50 61.24 2kc5 n PRO 138 Cb 0.55 -2.10 0.14 0.00 -0.02 0.00 0.00 33.50 32.07 2kc5 n PRO 138 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 2kc5 s VAL 139 N -2.06 2.62 0.22 -1.45 -7.23 -1.26 -4.69 120.40 106.54 2kc5 s VAL 139 Ca 0.68 0.20 -0.32 0.00 -1.81 0.00 0.00 61.98 60.73 2kc5 s VAL 139 Cb -0.30 -2.66 -0.13 0.00 0.56 0.00 0.00 36.38 33.84 2kc5 s VAL 139 CO 0.56 -0.26 1.49 0.41 -0.31 0.00 0.00 175.10 176.99 2kc5 n THR 140 N -3.92 0.63 -3.18 5.32 -1.04 -1.26 -4.99 114.28 105.84 2kc5 n THR 140 Ca 0.07 -0.16 -0.40 0.00 -2.04 0.00 0.00 64.05 61.52 2kc5 n THR 140 Cb 0.55 -1.55 -0.06 0.00 -1.82 0.00 0.00 70.33 67.44 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 0.53 6.59 0.70 8.00 2.47 -1.26 -5.05 114.94 126.91 2kc5 s ASN 141 Ca 0.71 0.71 -0.13 0.00 0.42 0.00 0.00 52.86 54.57 2kc5 s ASN 141 Cb -0.64 -2.32 0.02 0.00 -1.45 0.00 0.00 41.25 36.86 2kc5 s ASN 141 CO 0.45 -0.26 1.10 -2.16 -3.72 0.00 0.00 177.10 172.52 2kc5 s PRO 142 N 1.97 2.58 0.12 0.43 0.04 -1.26 -4.99 135.00 133.90 2kc5 s PRO 142 Ca 0.26 1.31 -0.31 0.00 0.04 0.00 0.00 61.00 62.30 2kc5 s PRO 142 Cb -0.16 -1.93 -0.08 0.00 0.04 0.00 0.00 34.50 32.38 2kc5 s PRO 142 CO 0.10 -1.41 1.38 0.34 0.04 0.00 0.00 177.00 177.44 2kc5 s ASP 143 N -2.88 6.84 0.06 6.66 2.15 -1.26 -4.92 116.67 123.32 2kc5 s ASP 143 Ca 0.65 2.33 0.00 0.00 0.43 0.00 0.00 52.55 55.96 2kc5 s ASP 143 Cb -0.19 -2.59 -0.04 0.00 -0.30 0.00 0.00 42.92 39.80 2kc5 s ASP 143 CO 0.47 -0.63 -0.04 0.68 -0.17 0.00 0.00 175.17 175.47 2kc5 s VAL 144 N 0.98 0.36 0.55 1.11 -7.23 -1.26 -4.99 120.40 109.92 2kc5 s VAL 144 Ca 0.63 -1.62 -0.20 0.00 -1.81 0.00 0.00 61.98 58.99 2kc5 s VAL 144 Cb -0.37 -1.26 -0.05 0.00 0.56 0.00 0.00 36.38 35.26 2kc5 s VAL 144 CO 0.31 -0.82 1.16 -2.16 -0.31 0.00 0.00 175.10 173.28 2kc5 s PRO 145 N -3.26 3.27 -1.44 4.82 0.04 -1.26 -1.45 135.00 135.72 2kc5 s PRO 145 Ca 0.03 1.71 0.00 0.00 0.04 0.00 0.00 61.00 62.78 2kc5 s PRO 145 Cb 0.03 -2.03 0.00 0.00 0.04 0.00 0.00 34.50 32.54 2kc5 s PRO 145 CO -0.06 -0.94 0.00 1.58 0.04 0.00 0.00 177.00 177.62 2kc5 n HIS 146 N -1.30 -0.77 0.00 0.56 -0.00 -1.26 -4.45 115.22 108.00 2kc5 n HIS 146 Ca 0.12 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.84 2kc5 n HIS 146 Cb 0.50 -2.96 0.00 0.00 -0.00 0.00 0.00 29.99 27.54 2kc5 n HIS 146 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2kc5 n ALA 147 N -0.67 0.05 -2.27 1.57 0.00 -1.25 -5.12 120.51 112.81 2kc5 n ALA 147 Ca -0.16 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 52.86 2kc5 n ALA 147 Cb 0.56 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.98 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 -1.16 2.13 -0.07 0.00 0.00 -0.53 -4.97 107.32 102.72 2kc5 s GLY 148 Ca 0.00 1.00 -0.27 0.00 0.00 0.00 0.00 44.72 45.45 2kc5 s GLY 148 CO 0.00 2.24 0.85 -1.60 0.00 0.00 0.00 173.10 174.60 2kc5 s ARG 149 N 1.17 4.44 0.31 2.90 3.52 -1.26 -4.78 118.95 125.26 2kc5 s ARG 149 Ca 0.62 1.14 -0.28 0.00 -0.13 0.00 0.00 55.73 57.08 2kc5 s ARG 149 Cb -0.34 -3.49 -0.09 0.00 -1.56 0.00 0.00 34.95 29.47 2kc5 s ARG 149 CO 0.30 -0.11 1.11 1.03 -0.81 0.00 0.00 175.30 176.82 2kc5 s ARG 150 N 1.32 4.49 0.00 5.12 1.81 -1.26 -4.94 118.95 125.49 2kc5 s ARG 150 Ca 0.43 1.79 0.14 0.00 -1.72 0.00 0.00 55.73 56.37 2kc5 s ARG 150 Cb -0.19 -3.03 0.23 0.00 -0.45 0.00 0.00 34.95 31.52 2kc5 s ARG 150 CO 0.20 0.08 1.07 0.00 -0.68 0.00 0.00 175.30 175.97 2kc5 n ALA 151 N 0.85 2.29 -1.90 2.13 0.00 -1.26 -5.12 120.51 117.49 2kc5 n ALA 151 Ca 0.00 -1.66 -0.33 0.00 0.00 0.00 0.00 53.44 51.46 2kc5 n ALA 151 Cb 0.46 -0.60 -0.06 0.00 0.00 0.00 0.00 19.45 19.25 2kc5 n ALA 151 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2kc5 s LEU 152 N 0.00 3.91 -0.03 0.00 2.01 -1.26 -5.09 118.68 118.22 2kc5 s LEU 152 Ca 0.18 1.56 -0.16 0.00 0.01 0.00 0.00 54.13 55.72 2kc5 s LEU 152 Cb 0.21 -4.42 0.03 0.00 0.01 0.00 0.00 46.19 42.02 2kc5 s LEU 152 CO -0.09 -0.36 0.35 -1.48 1.01 0.00 0.00 176.35 175.77 2kc5 s LEU 153 N -3.30 0.69 0.21 1.79 2.34 -1.26 -5.19 118.68 113.95 2kc5 s LEU 153 Ca 0.59 0.23 0.01 0.00 0.06 0.00 0.00 54.13 55.03 2kc5 s LEU 153 Cb -0.09 1.37 -0.05 0.00 -0.56 0.00 0.00 46.19 46.86 2kc5 s LEU 153 CO 0.17 -0.42 0.06 -0.36 -1.06 0.00 0.00 176.35 174.75 2kc5 s PHE 154 N -1.10 1.31 0.07 3.48 0.08 -1.26 -4.84 117.98 115.72 2kc5 s PHE 154 Ca -0.11 -1.14 0.00 0.00 0.12 0.00 0.00 56.93 55.79 2kc5 s PHE 154 Cb -0.04 -0.75 0.00 0.00 -0.57 0.00 0.00 43.02 41.66 2kc5 s PHE 154 CO 0.04 -0.34 0.00 0.41 -0.10 0.00 0.00 175.22 175.24 2kc5 n GLY 155 N -0.33 -1.84 3.22 4.36 0.00 -1.26 -5.06 105.19 104.28 2kc5 n GLY 155 Ca -0.03 -1.45 -0.09 0.00 0.00 0.00 0.00 46.02 44.45 2kc5 n GLY 155 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2kc5 s ARG 156 N -1.88 0.92 0.20 1.61 1.81 -1.26 -5.13 118.95 115.22 2kc5 s ARG 156 Ca 0.00 -1.17 -0.31 0.00 -1.72 0.00 0.00 55.73 52.53 2kc5 s ARG 156 Cb 0.00 0.31 -0.11 0.00 -0.45 0.00 0.00 34.95 34.70 2kc5 s ARG 156 CO 0.00 -0.29 1.61 0.50 -0.68 0.00 0.00 175.30 176.44 2kc5 s ARG 157 N -3.94 4.18 0.64 3.54 3.00 -1.26 -4.94 118.95 120.16 2kc5 s ARG 157 Ca 0.13 2.45 -0.18 0.00 -1.00 0.00 0.00 55.73 57.14 2kc5 s ARG 157 Cb 0.05 -3.11 -0.01 0.00 0.00 0.00 0.00 34.95 31.88 2kc5 s ARG 157 CO -0.05 -0.64 1.27 -1.12 0.00 0.00 0.00 175.30 174.77 2kc5 s SER 158 N 1.02 4.71 0.00 -2.12 0.01 -1.26 -4.97 113.70 111.09 2kc5 s SER 158 Ca 0.70 2.56 0.00 0.00 1.31 0.00 0.00 55.95 60.52 2kc5 s SER 158 Cb -0.46 -2.61 0.00 0.00 0.21 0.00 0.00 66.02 63.16 2kc5 s SER 158 CO 0.34 -1.93 0.00 0.61 0.41 0.00 0.00 173.24 172.67 2kc5 n GLY 159 N 0.78 2.21 0.34 3.44 0.00 -1.26 -4.98 105.19 105.72 2kc5 n GLY 159 Ca 0.15 0.25 -0.05 0.00 0.00 0.00 0.00 46.02 46.37 2kc5 n GLY 159 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2kc5 h GLU 160 N 0.00 1.14 -6.09 1.61 4.57 -2.04 -3.38 114.58 110.39 2kc5 h GLU 160 Ca 0.00 -0.21 -0.56 0.00 -1.18 0.00 0.00 59.36 57.41 2kc5 h GLU 160 Cb 0.00 -0.18 -0.05 0.00 -0.16 0.00 0.00 28.75 28.36 2kc5 h GLU 160 CO 0.00 0.94 0.05 1.21 -1.18 0.00 0.00 179.01 180.02 2kc5 s ASN 161 N -6.40 7.01 0.00 1.04 2.47 -1.26 -5.15 114.94 112.66 2kc5 s ASN 161 Ca -0.12 1.21 0.00 0.00 0.42 0.00 0.00 52.86 54.37 2kc5 s ASN 161 Cb 0.16 -2.40 0.00 0.00 -1.45 0.00 0.00 41.25 37.56 2kc5 s ASN 161 CO 0.83 0.01 0.00 0.00 -3.72 0.00 0.00 177.10 174.23