#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 3.60 -1.25 1.12 -4.23 -1.26 -4.95 115.64 108.67 2kc5 s THR 2 Ca 0.00 0.90 0.04 0.00 -1.18 0.00 0.00 61.69 61.45 2kc5 s THR 2 Cb 0.00 -3.36 0.17 0.00 1.34 0.00 0.00 72.50 70.65 2kc5 s THR 2 CO 0.00 -0.31 0.90 -1.84 -0.54 0.00 0.00 174.62 172.83 2kc5 n GLU 3 N -1.49 1.68 -3.94 3.99 0.28 -1.26 -4.74 120.64 115.17 2kc5 n GLU 3 Ca 0.10 -0.65 -0.08 0.00 -0.16 0.00 0.00 57.16 56.36 2kc5 n GLU 3 Cb 0.52 -1.48 -0.08 0.00 1.43 0.00 0.00 31.44 31.83 2kc5 n GLU 3 CO 0.00 0.00 0.00 -1.21 -0.16 0.00 0.00 177.13 175.76 2kc5 s GLU 4 N -1.53 0.75 -0.10 3.44 2.02 -1.26 -1.37 118.70 120.66 2kc5 s GLU 4 Ca 0.12 -1.02 0.03 0.00 0.02 0.00 0.00 54.97 54.11 2kc5 s GLU 4 Cb 0.08 0.29 0.01 0.00 0.10 0.00 0.00 34.13 34.61 2kc5 s GLU 4 CO 0.05 -0.21 -0.19 0.42 0.02 0.00 0.00 175.26 175.36 2kc5 s ILE 5 N -3.76 1.67 0.32 -1.63 -1.09 0.33 -4.58 121.20 112.47 2kc5 s ILE 5 Ca 0.05 -0.78 -0.27 0.00 -2.23 0.00 0.00 60.65 57.41 2kc5 s ILE 5 Cb 0.05 -1.48 -0.09 0.00 -1.58 0.00 0.00 42.46 39.36 2kc5 s ILE 5 CO -0.10 0.47 1.05 0.00 -1.23 0.00 0.00 174.94 175.14 2kc5 s ALA 6 N 0.61 3.27 0.64 9.38 0.00 -1.26 -1.22 121.76 133.18 2kc5 s ALA 6 Ca -0.14 0.77 -0.17 0.00 0.00 0.00 0.00 51.96 52.42 2kc5 s ALA 6 Cb -0.16 -3.28 -0.01 0.00 0.00 0.00 0.00 23.12 19.66 2kc5 s ALA 6 CO 0.04 -0.11 1.20 0.20 0.00 0.00 0.00 175.76 177.09 2kc5 s GLY 7 N -1.21 2.57 0.15 0.00 0.00 0.30 -4.90 107.32 104.24 2kc5 s GLY 7 Ca 0.49 0.94 0.04 0.00 0.00 0.00 0.00 44.72 46.18 2kc5 s GLY 7 CO 0.34 1.33 0.21 -1.36 0.00 0.00 0.00 173.10 173.62 2kc5 s PHE 8 N -1.77 3.31 -0.30 1.90 0.08 -0.44 -4.49 117.98 116.27 2kc5 s PHE 8 Ca 0.76 0.05 0.21 0.00 0.12 0.00 0.00 56.93 58.07 2kc5 s PHE 8 Cb -0.29 -1.59 0.13 0.00 -0.57 0.00 0.00 43.02 40.70 2kc5 s PHE 8 CO 0.38 0.52 1.30 1.96 -0.10 0.00 0.00 175.22 179.28 2kc5 h GLN 9 N 2.32 0.00 0.00 0.44 1.08 -1.87 -2.90 115.11 114.18 2kc5 h GLN 9 Ca -0.48 0.00 -0.04 0.00 -1.45 0.00 0.00 58.65 56.68 2kc5 h GLN 9 Cb 1.20 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 28.63 2kc5 h GLN 9 CO 0.66 0.09 0.15 0.25 -0.95 0.00 0.00 178.83 179.02 2kc5 n THR 10 N -2.94 0.00 -1.72 -0.54 -2.24 -1.26 -4.86 114.28 100.72 2kc5 n THR 10 Ca 0.01 -0.75 -0.39 0.00 -2.27 0.00 0.00 64.05 60.65 2kc5 n THR 10 Cb 0.59 0.68 0.03 0.00 -2.10 0.00 0.00 70.33 69.53 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 -1.42 2.52 -3.13 3.42 7.64 -1.26 -4.86 113.62 116.53 2kc5 n SER 11 Ca -0.05 1.01 -0.25 0.00 1.01 0.00 0.00 58.87 60.59 2kc5 n SER 11 Cb 0.40 -1.54 -0.03 0.00 -1.01 0.00 0.00 64.21 62.03 2kc5 n SER 11 CO 0.00 0.00 0.00 -2.65 -3.01 0.00 0.00 175.04 169.38 2kc5 n PRO 12 N -0.63 2.43 -0.11 1.43 -0.02 -1.26 -4.76 135.00 132.08 2kc5 n PRO 12 Ca 0.09 -1.58 -0.06 0.00 -2.02 0.00 0.00 63.50 59.94 2kc5 n PRO 12 Cb 0.43 -2.49 0.01 0.00 -0.02 0.00 0.00 33.50 31.43 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 5.81 -0.11 -0.58 -0.52 3.64 -1.96 0.14 116.57 122.99 2kc5 h LYS 13 Ca 0.56 0.01 -0.09 0.00 -1.27 0.00 0.00 60.65 59.86 2kc5 h LYS 13 Cb 0.25 0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.08 2kc5 h LYS 13 CO 1.44 -0.08 0.03 0.00 -2.27 0.00 0.00 179.45 178.58 2kc5 h ALA 14 N 1.16 0.77 -0.20 5.00 0.00 -1.96 -0.96 119.26 123.08 2kc5 h ALA 14 Ca 0.19 -0.29 -0.07 0.00 0.00 0.00 0.00 54.91 54.74 2kc5 h ALA 14 Cb 0.41 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 2kc5 h ALA 14 CO -0.46 0.58 -0.16 1.96 0.00 0.00 0.00 179.25 181.18 2kc5 h GLN 15 N 0.89 0.45 -0.62 0.00 4.20 -1.60 -0.08 115.11 118.35 2kc5 h GLN 15 Ca 0.17 -0.22 -0.02 0.00 0.06 0.00 0.00 58.65 58.63 2kc5 h GLN 15 Cb 0.51 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.26 2kc5 h GLN 15 CO 0.02 0.78 0.31 0.28 -0.67 0.00 0.00 178.83 179.56 2kc5 h VAL 16 N 0.13 1.21 0.38 -0.54 2.07 -0.77 -0.92 116.25 117.81 2kc5 h VAL 16 Ca 0.04 -0.57 -0.02 0.00 0.82 0.00 0.00 66.70 66.97 2kc5 h VAL 16 Cb 0.68 0.46 0.00 0.00 -1.52 0.00 0.00 31.29 30.91 2kc5 h VAL 16 CO 0.04 0.24 -0.20 -0.61 0.02 0.00 0.00 177.57 177.06 2kc5 h GLN 17 N 0.84 -0.52 -0.67 1.57 4.15 -0.91 -1.11 115.11 118.46 2kc5 h GLN 17 Ca 0.21 0.04 -0.08 0.00 0.77 0.00 0.00 58.65 59.59 2kc5 h GLN 17 Cb 0.09 0.12 -0.03 0.00 0.21 0.00 0.00 27.48 27.88 2kc5 h GLN 17 CO -0.03 -0.35 0.12 0.00 -1.93 0.00 0.00 178.83 176.64 2kc5 h ALA 18 N 0.07 0.94 -0.23 3.38 0.00 -0.88 0.88 119.26 123.42 2kc5 h ALA 18 Ca -0.05 -0.27 -0.04 0.00 0.00 0.00 0.00 54.91 54.56 2kc5 h ALA 18 Cb 0.42 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 2kc5 h ALA 18 CO 0.07 0.66 0.01 0.00 0.00 0.00 0.00 179.25 179.99 2kc5 h ALA 19 N 1.09 0.31 0.00 0.00 0.00 -1.09 -2.22 119.26 117.35 2kc5 h ALA 19 Ca 0.21 -0.21 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 2kc5 h ALA 19 Cb 0.43 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 2kc5 h ALA 19 CO 0.01 0.03 -0.39 0.74 0.00 0.00 0.00 179.25 179.64 2kc5 h PHE 20 N 0.18 0.00 -0.75 0.00 0.04 -1.00 -1.86 116.94 113.55 2kc5 h PHE 20 Ca 0.07 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.82 2kc5 h PHE 20 Cb 0.39 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 38.51 2kc5 h PHE 20 CO 0.03 0.39 0.39 1.49 -0.60 0.00 0.00 178.31 180.01 2kc5 h GLU 21 N 0.00 1.05 -0.11 1.51 4.81 -0.60 0.98 114.58 122.21 2kc5 h GLU 21 Ca -0.00 -0.13 -0.19 0.00 -0.13 0.00 0.00 59.36 58.91 2kc5 h GLU 21 Cb 0.84 -0.20 0.01 0.00 0.63 0.00 0.00 28.75 30.03 2kc5 h GLU 21 CO 0.05 0.78 -0.68 1.49 -0.73 0.00 0.00 179.01 179.92 2kc5 h GLU 22 N 1.05 0.66 -0.57 1.92 4.57 -0.78 -1.96 114.58 119.47 2kc5 h GLU 22 Ca 0.26 -0.56 -0.01 0.00 -1.18 0.00 0.00 59.36 57.88 2kc5 h GLU 22 Cb 0.06 0.12 -0.03 0.00 -0.16 0.00 0.00 28.75 28.74 2kc5 h GLU 22 CO -0.04 1.17 0.33 0.82 -1.18 0.00 0.00 179.01 180.11 2kc5 h ILE 23 N 0.32 1.18 0.00 2.32 2.04 -1.25 -1.75 117.51 120.37 2kc5 h ILE 23 Ca -0.05 -0.43 -0.03 0.00 1.00 0.00 0.00 64.86 65.34 2kc5 h ILE 23 Cb 1.32 0.43 -0.00 0.00 -0.74 0.00 0.00 36.82 37.83 2kc5 h ILE 23 CO 0.14 0.19 -0.16 0.00 0.00 0.00 0.00 178.15 178.32 2kc5 h ALA 24 N 1.15 1.47 0.19 1.87 0.00 -0.66 0.87 119.26 124.15 2kc5 h ALA 24 Ca 0.20 -0.14 -0.26 0.00 0.00 0.00 0.00 54.91 54.71 2kc5 h ALA 24 Cb 0.02 -0.03 0.03 0.00 0.00 0.00 0.00 17.79 17.81 2kc5 h ALA 24 CO -0.03 0.20 -1.13 -0.09 0.00 0.00 0.00 179.25 178.19 2kc5 h ARG 25 N 0.00 0.43 0.00 0.00 2.43 -0.80 -3.29 114.38 113.15 2kc5 h ARG 25 Ca -0.00 -0.72 -0.10 0.00 -0.81 0.00 0.00 59.98 58.36 2kc5 h ARG 25 Cb 0.34 0.26 -0.01 0.00 -0.42 0.00 0.00 29.97 30.14 2kc5 h ARG 25 CO 0.02 1.34 -0.46 0.00 -1.51 0.00 0.00 179.97 179.36 2kc5 h ARG 26 N -0.11 0.00 -6.15 0.20 3.08 -1.12 -0.86 114.38 109.43 2kc5 h ARG 26 Ca -0.19 0.00 -0.52 0.00 0.07 0.00 0.00 59.98 59.33 2kc5 h ARG 26 Cb 1.89 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 31.89 2kc5 h ARG 26 CO 0.21 0.46 1.26 -1.12 -1.07 0.00 0.00 179.97 179.71 2kc5 s SER 27 N -6.44 5.63 0.00 7.04 0.01 0.28 -4.51 113.70 115.71 2kc5 s SER 27 Ca 0.02 0.35 0.00 0.00 1.31 0.00 0.00 55.95 57.64 2kc5 s SER 27 Cb 0.09 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.78 2kc5 s SER 27 CO 0.72 -2.09 0.00 0.23 0.41 0.00 0.00 173.24 172.51 2kc5 n MET 28 N 9.00 0.00 0.21 12.44 2.81 -1.26 -4.62 117.12 135.70 2kc5 n MET 28 Ca 0.17 0.00 -0.12 0.00 -1.81 0.00 0.00 57.70 55.94 2kc5 n MET 28 Cb 0.50 -1.01 -0.07 0.00 -0.71 0.00 0.00 33.22 31.93 2kc5 n MET 28 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 2kc5 h HIS 29 N 0.00 -0.53 -6.19 2.03 3.86 -1.79 -3.47 115.15 109.06 2kc5 h HIS 29 Ca 0.00 -0.01 -0.47 0.00 -1.16 0.00 0.00 60.37 58.73 2kc5 h HIS 29 Cb 0.00 0.18 -0.14 0.00 1.06 0.00 0.00 27.41 28.51 2kc5 h HIS 29 CO 0.00 -0.22 -0.71 -3.47 0.86 0.00 0.00 177.93 174.40 2kc5 n ASP 30 N -5.19 -3.67 0.00 2.45 2.03 -0.33 -4.69 116.55 107.14 2kc5 n ASP 30 Ca -0.09 -0.73 0.00 0.00 0.52 0.00 0.00 54.79 54.49 2kc5 n ASP 30 Cb 0.29 -3.01 0.00 0.00 -0.72 0.00 0.00 41.12 37.68 2kc5 n ASP 30 CO 0.00 0.00 0.00 -0.11 -1.92 0.00 0.00 177.20 175.17 2kc5 n LEU 31 N -4.16 0.00 -0.50 -2.67 7.94 -1.26 -4.95 117.00 111.39 2kc5 n LEU 31 Ca 0.04 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.94 2kc5 n LEU 31 Cb 0.51 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.46 2kc5 n LEU 31 CO 0.71 0.00 0.20 -1.54 -1.11 0.00 0.00 177.39 175.65 2kc5 n SER 32 N -0.29 0.80 0.17 1.96 3.41 -1.26 -2.68 113.62 115.74 2kc5 n SER 32 Ca 0.00 -1.59 0.06 0.00 -0.26 0.00 0.00 58.87 57.08 2kc5 n SER 32 Cb 0.00 -0.40 0.14 0.00 -0.26 0.00 0.00 64.21 63.70 2kc5 n SER 32 CO 0.00 0.00 0.00 2.19 -0.16 0.00 0.00 175.04 177.07 2kc5 h PHE 33 N 0.21 0.00 0.12 7.33 -5.15 -1.93 -3.31 116.94 114.21 2kc5 h PHE 33 Ca 0.00 0.00 -0.01 0.00 -0.20 0.00 0.00 57.97 57.76 2kc5 h PHE 33 Cb 0.40 0.00 0.00 0.00 0.22 0.00 0.00 35.95 36.57 2kc5 h PHE 33 CO 0.00 0.37 -0.06 -0.07 -2.00 0.00 0.00 178.31 176.55 2kc5 h LEU 34 N 0.00 -0.13 -7.00 2.10 3.38 -1.95 -3.47 115.31 108.23 2kc5 h LEU 34 Ca -0.00 -0.33 -0.04 0.00 0.09 0.00 0.00 57.88 57.60 2kc5 h LEU 34 Cb 1.19 0.03 -0.18 0.00 0.09 0.00 0.00 40.66 41.79 2kc5 h LEU 34 CO 0.05 0.28 0.22 -1.38 0.09 0.00 0.00 178.44 177.70 2kc5 s HIS 35 N -4.45 -0.61 0.52 1.13 -3.43 -1.25 -5.16 115.29 102.04 2kc5 s HIS 35 Ca -0.15 0.92 -0.22 0.00 -0.80 0.00 0.00 55.06 54.81 2kc5 s HIS 35 Cb 0.02 0.44 -0.06 0.00 -1.43 0.00 0.00 32.58 31.56 2kc5 s HIS 35 CO 0.61 -0.64 1.29 -1.25 -2.00 0.00 0.00 174.74 172.76 2kc5 s PRO 36 N -1.73 3.35 0.08 -0.38 0.04 -1.25 -4.32 135.00 130.80 2kc5 s PRO 36 Ca -0.08 2.08 -0.19 0.00 0.04 0.00 0.00 61.00 62.85 2kc5 s PRO 36 Cb -0.00 -2.31 -0.09 0.00 0.04 0.00 0.00 34.50 32.13 2kc5 s PRO 36 CO 0.05 -0.98 1.52 0.66 0.04 0.00 0.00 177.00 178.29 2kc5 h SER 37 N 1.66 0.37 -3.20 6.66 4.64 -1.96 -3.43 113.55 118.29 2kc5 h SER 37 Ca -0.50 -0.30 -0.20 0.00 -0.47 0.00 0.00 61.79 60.31 2kc5 h SER 37 Cb 1.28 -0.10 -0.31 0.00 -0.31 0.00 0.00 62.40 62.97 2kc5 h SER 37 CO 0.58 0.58 -0.50 -0.32 -0.87 0.00 0.00 176.83 176.30 2kc5 s MET 38 N -5.02 0.18 0.17 4.77 -2.45 -1.26 -5.10 119.30 110.59 2kc5 s MET 38 Ca -0.14 0.60 -0.33 0.00 -1.25 0.00 0.00 55.69 54.56 2kc5 s MET 38 Cb 0.07 -0.10 -0.14 0.00 1.25 0.00 0.00 34.83 35.91 2kc5 s MET 38 CO 0.73 -0.20 1.48 -2.30 1.05 0.00 0.00 175.02 175.78 2kc5 n PRO 39 N 4.58 1.95 -2.44 4.11 -0.02 -1.26 -4.44 135.00 137.50 2kc5 n PRO 39 Ca -0.19 0.70 -0.40 0.00 -2.02 0.00 0.00 63.50 61.59 2kc5 n PRO 39 Cb 0.52 -2.41 -0.04 0.00 -0.02 0.00 0.00 33.50 31.55 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 0.53 3.44 0.03 -1.45 1.01 -1.26 -4.79 120.40 117.92 2kc5 s VAL 40 Ca 0.76 1.42 -0.04 0.00 0.00 0.00 0.00 61.98 64.12 2kc5 s VAL 40 Cb -0.71 -3.90 -0.02 0.00 0.00 0.00 0.00 36.38 31.75 2kc5 s VAL 40 CO 0.43 0.33 0.06 -0.47 0.00 0.00 0.00 175.10 175.44 2kc5 s TYR 41 N -1.03 0.24 -0.04 5.22 5.04 -0.85 -4.97 117.35 120.96 2kc5 s TYR 41 Ca 0.46 -0.56 -0.02 0.00 -2.44 0.00 0.00 57.07 54.51 2kc5 s TYR 41 Cb -0.33 -0.18 0.03 0.00 0.35 0.00 0.00 41.96 41.84 2kc5 s TYR 41 CO 0.41 -0.33 0.08 0.08 -1.34 0.00 0.00 175.55 174.45 2kc5 s VAL 42 N -2.51 -0.11 0.15 3.14 1.01 -1.26 -0.99 120.40 119.83 2kc5 s VAL 42 Ca -0.06 0.30 -0.16 0.00 0.00 0.00 0.00 61.98 62.06 2kc5 s VAL 42 Cb -0.02 -0.16 -0.07 0.00 0.00 0.00 0.00 36.38 36.13 2kc5 s VAL 42 CO -0.04 0.13 0.59 -0.44 0.00 0.00 0.00 175.10 175.33 2kc5 s SER 43 N 1.64 6.91 -0.05 3.32 0.01 0.20 -4.95 113.70 120.78 2kc5 s SER 43 Ca -0.03 1.18 0.06 0.00 1.31 0.00 0.00 55.95 58.48 2kc5 s SER 43 Cb -0.12 -2.33 -0.01 0.00 0.21 0.00 0.00 66.02 63.77 2kc5 s SER 43 CO -0.04 0.12 -0.25 -0.62 0.41 0.00 0.00 173.24 172.86 2kc5 s ASP 44 N -1.60 3.07 -0.24 2.44 2.15 -1.26 -1.76 116.67 119.48 2kc5 s ASP 44 Ca 0.37 -0.51 -0.27 0.00 0.43 0.00 0.00 52.55 52.58 2kc5 s ASP 44 Cb -0.16 -0.79 0.12 0.00 -0.30 0.00 0.00 42.92 41.79 2kc5 s ASP 44 CO 0.19 0.25 0.99 0.72 -0.17 0.00 0.00 175.17 177.16 2kc5 s PHE 45 N -0.21 -0.46 0.48 -5.34 -0.71 -0.30 -4.97 117.98 106.46 2kc5 s PHE 45 Ca -0.02 1.03 0.00 0.00 -1.04 0.00 0.00 56.93 56.90 2kc5 s PHE 45 Cb -0.13 0.39 0.00 0.00 -1.21 0.00 0.00 43.02 42.06 2kc5 s PHE 45 CO 0.03 -0.28 0.00 2.41 -1.34 0.00 0.00 175.22 176.04 2kc5 n THR 46 N 1.74 -0.31 -3.25 -4.49 -1.04 -1.26 -1.76 114.28 103.91 2kc5 n THR 46 Ca -0.12 0.58 -0.27 0.00 -2.04 0.00 0.00 64.05 62.21 2kc5 n THR 46 Cb 0.56 -1.01 -0.07 0.00 -1.82 0.00 0.00 70.33 68.00 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 -4.10 3.84 -4.72 -4.42 7.94 -1.26 -1.45 117.00 112.83 2kc5 n LEU 47 Ca -0.05 -5.49 -0.42 0.00 -1.11 0.00 0.00 56.01 48.93 2kc5 n LEU 47 Cb 0.64 -0.57 -0.03 0.00 0.53 0.00 0.00 43.42 43.99 2kc5 n LEU 47 CO 0.03 2.16 0.94 -0.36 -1.11 0.00 0.00 177.39 179.05 2kc5 s PHE 48 N -2.76 3.37 -1.18 1.96 0.08 0.05 -2.73 117.98 116.78 2kc5 s PHE 48 Ca 0.43 1.22 -0.02 0.00 0.12 0.00 0.00 56.93 58.68 2kc5 s PHE 48 Cb 0.20 -3.51 0.01 0.00 -0.57 0.00 0.00 43.02 39.15 2kc5 s PHE 48 CO -0.06 -1.61 0.14 0.39 -0.10 0.00 0.00 175.22 173.99 2kc5 n GLU 49 N 3.57 -2.64 -1.01 0.44 -0.58 -1.26 -0.97 120.64 118.19 2kc5 n GLU 49 Ca 0.09 0.62 -0.00 0.00 -0.42 0.00 0.00 57.16 57.44 2kc5 n GLU 49 Cb 0.45 -5.27 -0.00 0.00 -0.57 0.00 0.00 31.44 26.05 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 -0.95 0.45 3.23 0.62 0.00 -1.10 -5.03 105.19 102.41 2kc5 n GLY 50 Ca -0.12 -0.10 -0.25 0.00 0.00 0.00 0.00 46.02 45.54 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 -0.44 1.38 0.29 1.61 -1.52 -0.15 -3.68 119.66 117.15 2kc5 s GLN 51 Ca 0.00 -0.86 -0.29 0.00 -1.95 0.00 0.00 55.36 52.26 2kc5 s GLN 51 Cb 0.00 -1.44 -0.10 0.00 -0.22 0.00 0.00 33.01 31.25 2kc5 s GLN 51 CO 0.00 0.37 1.30 -1.58 -0.25 0.00 0.00 175.29 175.14 2kc5 s TRP 52 N -0.72 3.14 0.18 0.91 0.52 -0.11 -0.77 118.94 122.09 2kc5 s TRP 52 Ca 0.07 1.36 0.01 0.00 0.02 0.00 0.00 56.10 57.57 2kc5 s TRP 52 Cb -0.08 -3.64 -0.04 0.00 -1.15 0.00 0.00 33.47 28.56 2kc5 s TRP 52 CO 0.01 -1.82 0.34 0.99 0.02 0.00 0.00 176.95 176.49 2kc5 s THR 53 N -0.78 5.27 0.26 2.01 2.01 -0.53 -1.42 115.64 122.45 2kc5 s THR 53 Ca 0.51 -0.59 -0.21 0.00 0.31 0.00 0.00 61.69 61.71 2kc5 s THR 53 Cb -0.39 -3.75 0.04 0.00 0.01 0.00 0.00 72.50 68.41 2kc5 s THR 53 CO 0.48 -0.16 0.80 -0.83 -0.69 0.00 0.00 174.62 174.22 2kc5 s GLY 54 N -3.30 -0.06 0.02 4.40 0.00 0.21 -1.14 107.32 107.45 2kc5 s GLY 54 Ca 0.36 -0.26 -0.01 0.00 0.00 0.00 0.00 44.72 44.81 2kc5 s GLY 54 CO 0.29 0.00 -0.02 0.00 0.00 0.00 0.00 173.10 173.37 2kc5 s VAL 56 N -1.61 1.30 0.11 0.00 0.11 0.29 -0.62 120.40 119.97 2kc5 s VAL 56 Ca -0.14 -0.82 0.10 0.00 -2.93 0.00 0.00 61.98 58.19 2kc5 s VAL 56 Cb -0.09 -1.10 -0.04 0.00 -1.53 0.00 0.00 36.38 33.62 2kc5 s VAL 56 CO -0.01 0.27 -0.23 -0.51 -3.33 0.00 0.00 175.10 171.28 2kc5 s ILE 57 N -0.52 2.47 0.25 7.04 2.07 -0.17 -1.07 121.20 131.27 2kc5 s ILE 57 Ca 0.06 -1.60 -0.02 0.00 -1.41 0.00 0.00 60.65 57.68 2kc5 s ILE 57 Cb -0.07 -2.09 -0.03 0.00 0.13 0.00 0.00 42.46 40.40 2kc5 s ILE 57 CO 0.00 0.14 0.25 0.42 -1.91 0.00 0.00 174.94 173.84 2kc5 s THR 58 N -1.05 0.00 0.30 4.00 -4.23 0.15 -2.00 115.64 112.81 2kc5 s THR 58 Ca 0.15 -1.86 0.37 0.00 -1.18 0.00 0.00 61.69 59.17 2kc5 s THR 58 Cb -0.10 -2.47 0.39 0.00 1.34 0.00 0.00 72.50 71.66 2kc5 s THR 58 CO 0.07 0.00 2.12 1.55 -0.54 0.00 0.00 174.62 177.82 2kc5 h PRO 59 N 2.42 0.00 0.00 3.99 0.13 -1.87 -3.28 132.00 133.39 2kc5 h PRO 59 Ca -0.31 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.70 2kc5 h PRO 59 Cb 1.25 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.35 2kc5 h PRO 59 CO 0.45 0.00 -2.01 -2.67 -0.23 0.00 0.00 178.00 173.55 2kc5 n TRP 60 N -2.94 0.00 -3.67 1.56 4.27 -1.26 -4.31 117.44 111.09 2kc5 n TRP 60 Ca -0.01 0.00 -0.08 0.00 -3.89 0.00 0.00 57.50 53.52 2kc5 n TRP 60 Cb 0.16 -0.60 -0.02 0.00 -1.36 0.00 0.00 31.31 29.50 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 -3.05 1.37 -0.07 -2.67 0.23 -1.24 -4.69 119.30 109.18 2kc5 s MET 61 Ca -0.08 -0.68 0.00 0.00 -1.03 0.00 0.00 55.69 53.91 2kc5 s MET 61 Cb 0.10 0.52 0.02 0.00 -1.53 0.00 0.00 34.83 33.94 2kc5 s MET 61 CO 0.79 -0.62 -0.05 -1.17 -2.03 0.00 0.00 175.02 171.94 2kc5 s LEU 62 N -2.82 1.12 -0.02 0.18 0.20 -0.44 -0.67 118.68 116.23 2kc5 s LEU 62 Ca 0.08 -0.17 0.01 0.00 0.69 0.00 0.00 54.13 54.73 2kc5 s LEU 62 Cb -0.03 -0.58 0.02 0.00 -0.43 0.00 0.00 46.19 45.17 2kc5 s LEU 62 CO -0.01 -0.10 -0.01 -0.44 -0.29 0.00 0.00 176.35 175.50 2kc5 s SER 63 N 1.37 0.41 0.51 3.68 0.01 -0.23 -0.68 113.70 118.75 2kc5 s SER 63 Ca -0.03 -0.04 -0.21 0.00 1.31 0.00 0.00 55.95 56.98 2kc5 s SER 63 Cb -0.13 -0.17 -0.06 0.00 0.21 0.00 0.00 66.02 65.86 2kc5 s SER 63 CO -0.03 -0.05 1.15 0.00 0.41 0.00 0.00 173.24 174.72 2kc5 s ALA 64 N 0.66 2.82 0.03 1.44 0.00 0.42 -0.55 121.76 126.57 2kc5 s ALA 64 Ca -0.07 0.89 -0.00 0.00 0.00 0.00 0.00 51.96 52.79 2kc5 s ALA 64 Cb -0.10 -3.38 -0.02 0.00 0.00 0.00 0.00 23.12 19.62 2kc5 s ALA 64 CO -0.01 -0.75 -0.03 0.14 0.00 0.00 0.00 175.76 175.11 2kc5 s VAL 65 N -1.65 0.13 0.02 0.00 -7.23 0.13 -0.62 120.40 111.18 2kc5 s VAL 65 Ca 0.69 -1.08 0.01 0.00 -1.81 0.00 0.00 61.98 59.79 2kc5 s VAL 65 Cb -0.27 -0.50 -0.01 0.00 0.56 0.00 0.00 36.38 36.16 2kc5 s VAL 65 CO 0.31 -0.59 -0.04 -0.63 -0.31 0.00 0.00 175.10 173.84 2kc5 s ILE 66 N -1.92 0.24 0.01 -0.62 1.01 -0.02 -0.62 121.20 119.28 2kc5 s ILE 66 Ca -0.12 -0.59 0.03 0.00 0.00 0.00 0.00 60.65 59.97 2kc5 s ILE 66 Cb -0.07 -0.29 -0.01 0.00 0.01 0.00 0.00 42.46 42.10 2kc5 s ILE 66 CO -0.03 -0.23 -0.09 -0.36 0.00 0.00 0.00 174.94 174.23 2kc5 s PHE 67 N -0.83 0.84 0.03 3.97 0.08 -0.51 -0.85 117.98 120.71 2kc5 s PHE 67 Ca -0.07 -0.23 -0.38 0.00 0.12 0.00 0.00 56.93 56.36 2kc5 s PHE 67 Cb -0.06 -0.52 -0.18 0.00 -0.57 0.00 0.00 43.02 41.69 2kc5 s PHE 67 CO -0.00 -0.01 1.26 -2.30 -0.10 0.00 0.00 175.22 174.06 2kc5 n PRO 68 N 2.49 0.67 -0.84 0.24 -0.02 -1.26 -0.94 135.00 135.34 2kc5 n PRO 68 Ca -0.16 0.24 -0.30 0.00 -2.02 0.00 0.00 63.50 61.26 2kc5 n PRO 68 Cb 0.56 -1.83 0.26 0.00 -0.02 0.00 0.00 33.50 32.47 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 0.46 1.53 0.16 -1.23 0.00 -1.24 -1.33 107.32 105.66 2kc5 s GLY 69 Ca 0.88 -0.94 -0.31 0.00 0.00 0.00 0.00 44.72 44.35 2kc5 s GLY 69 CO 0.52 0.00 1.44 2.56 0.00 0.00 0.00 173.10 177.62 2kc5 s PRO 70 N -5.33 4.29 -1.08 2.90 0.04 -1.09 -2.78 135.00 131.95 2kc5 s PRO 70 Ca 0.71 2.18 -0.02 0.00 0.04 0.00 0.00 61.00 63.91 2kc5 s PRO 70 Cb -0.10 -3.20 0.02 0.00 0.04 0.00 0.00 34.50 31.26 2kc5 s PRO 70 CO 0.57 -0.46 0.12 -3.47 0.04 0.00 0.00 177.00 173.80 2kc5 n ASP 71 N 3.59 -3.85 -4.89 6.66 2.03 -1.26 -4.95 116.55 113.88 2kc5 n ASP 71 Ca 0.11 0.07 -0.29 0.00 0.52 0.00 0.00 54.79 55.20 2kc5 n ASP 71 Cb 0.41 -3.25 -0.03 0.00 -0.72 0.00 0.00 41.12 37.53 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 -5.26 3.68 -0.61 -0.67 -1.52 -1.19 -4.90 119.66 109.20 2kc5 s GLN 72 Ca 0.09 0.23 0.01 0.00 -1.95 0.00 0.00 55.36 53.74 2kc5 s GLN 72 Cb -0.05 -2.50 0.15 0.00 -0.22 0.00 0.00 33.01 30.40 2kc5 s GLN 72 CO 0.12 0.04 0.39 -0.51 -0.25 0.00 0.00 175.29 175.08 2kc5 s LEU 73 N -3.87 4.78 0.60 2.90 2.01 -1.26 -0.54 118.68 123.29 2kc5 s LEU 73 Ca 0.47 -3.13 -0.18 0.00 0.01 0.00 0.00 54.13 51.30 2kc5 s LEU 73 Cb -0.10 -1.73 -0.03 0.00 0.01 0.00 0.00 46.19 44.33 2kc5 s LEU 73 CO 0.33 -0.25 1.17 0.26 1.01 0.00 0.00 176.35 178.86 2kc5 s TRP 74 N -0.46 2.49 0.72 0.29 0.52 -0.36 -4.88 118.94 117.27 2kc5 s TRP 74 Ca 0.19 1.54 -0.11 0.00 0.02 0.00 0.00 56.10 57.73 2kc5 s TRP 74 Cb -0.20 -3.37 0.03 0.00 -1.15 0.00 0.00 33.47 28.78 2kc5 s TRP 74 CO -0.04 -1.95 1.08 -1.25 0.02 0.00 0.00 176.95 174.80 2kc5 s PRO 75 N -3.49 2.65 -0.05 4.98 0.04 -1.26 -0.51 135.00 137.36 2kc5 s PRO 75 Ca 0.74 1.09 -0.30 0.00 0.04 0.00 0.00 61.00 62.57 2kc5 s PRO 75 Cb -0.26 -1.95 -0.06 0.00 0.04 0.00 0.00 34.50 32.26 2kc5 s PRO 75 CO 0.33 -1.33 1.79 -1.17 0.04 0.00 0.00 177.00 176.67 2kc5 s LEU 76 N -5.61 4.25 0.43 -3.56 2.96 -0.47 -4.21 118.68 112.47 2kc5 s LEU 76 Ca 0.60 2.29 -0.05 0.00 -0.22 0.00 0.00 54.13 56.76 2kc5 s LEU 76 Cb -0.16 -3.53 -0.04 0.00 0.50 0.00 0.00 46.19 42.96 2kc5 s LEU 76 CO 0.54 -1.08 0.72 -0.13 -1.32 0.00 0.00 176.35 175.08 2kc5 s ARG 77 N 4.41 3.56 -0.02 1.98 1.81 -1.26 -4.94 118.95 124.49 2kc5 s ARG 77 Ca 0.80 0.11 -0.15 0.00 -1.72 0.00 0.00 55.73 54.77 2kc5 s ARG 77 Cb -0.35 -2.45 -0.05 0.00 -0.45 0.00 0.00 34.95 31.64 2kc5 s ARG 77 CO 0.34 -0.08 0.40 0.21 -0.68 0.00 0.00 175.30 175.49 2kc5 s LYS 78 N -4.46 3.98 0.47 3.54 2.36 -1.26 -5.07 119.74 119.29 2kc5 s LYS 78 Ca 0.46 0.39 -0.13 0.00 -2.55 0.00 0.00 55.97 54.14 2kc5 s LYS 78 Cb -0.10 -3.26 -0.07 0.00 -1.05 0.00 0.00 37.83 33.35 2kc5 s LYS 78 CO 0.40 0.61 0.88 0.08 1.55 0.00 0.00 175.35 178.87 2kc5 s VAL 79 N -0.79 4.67 0.00 4.02 1.01 -1.26 -3.73 120.40 124.32 2kc5 s VAL 79 Ca 0.23 0.89 0.00 0.00 0.00 0.00 0.00 61.98 63.11 2kc5 s VAL 79 Cb -0.16 -3.74 0.00 0.00 0.00 0.00 0.00 36.38 32.48 2kc5 s VAL 79 CO 0.12 -0.63 0.00 -1.20 0.00 0.00 0.00 175.10 173.39 2kc5 n SER 80 N -1.51 -5.05 -4.90 3.32 7.64 -0.00 -4.97 113.62 108.14 2kc5 n SER 80 Ca 0.04 0.00 -0.28 0.00 1.01 0.00 0.00 58.87 59.64 2kc5 n SER 80 Cb 0.54 -2.56 0.03 0.00 -1.01 0.00 0.00 64.21 61.20 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 -1.37 3.14 -0.03 1.43 0.41 -1.24 -4.81 118.70 116.22 2kc5 s GLU 81 Ca 0.00 0.28 0.02 0.00 -0.41 0.00 0.00 54.97 54.86 2kc5 s GLU 81 Cb 0.00 -2.19 -0.03 0.00 -1.78 0.00 0.00 34.13 30.12 2kc5 s GLU 81 CO 0.00 -0.67 -0.07 0.15 -0.49 0.00 0.00 175.26 174.18 2kc5 s LYS 82 N -5.07 2.63 -0.13 1.61 1.02 -1.26 -0.38 119.74 118.17 2kc5 s LYS 82 Ca 0.54 -0.65 -0.00 0.00 0.02 0.00 0.00 55.97 55.88 2kc5 s LYS 82 Cb -0.11 -2.53 -0.02 0.00 -0.52 0.00 0.00 37.83 34.66 2kc5 s LYS 82 CO 0.48 0.63 -0.12 0.42 -0.92 0.00 0.00 175.35 175.84 2kc5 s ILE 83 N -0.90 3.16 -0.15 2.17 -1.09 0.20 -4.95 121.20 119.65 2kc5 s ILE 83 Ca 0.15 -0.63 -0.29 0.00 -2.23 0.00 0.00 60.65 57.64 2kc5 s ILE 83 Cb -0.11 -2.33 -0.01 0.00 -1.58 0.00 0.00 42.46 38.44 2kc5 s ILE 83 CO 0.04 0.53 1.06 -0.83 -1.23 0.00 0.00 174.94 174.51 2kc5 s GLY 84 N 0.24 2.04 0.18 6.18 0.00 -1.26 -0.91 107.32 113.80 2kc5 s GLY 84 Ca -0.08 0.34 0.07 0.00 0.00 0.00 0.00 44.72 45.05 2kc5 s GLY 84 CO 0.05 2.09 0.03 1.08 0.00 0.00 0.00 173.10 176.35 2kc5 s LEU 85 N 2.57 3.40 -0.06 0.66 2.01 -0.28 -4.97 118.68 122.01 2kc5 s LEU 85 Ca 0.48 -0.37 0.03 0.00 0.01 0.00 0.00 54.13 54.29 2kc5 s LEU 85 Cb -0.18 -2.03 0.01 0.00 0.01 0.00 0.00 46.19 43.99 2kc5 s LEU 85 CO 0.14 0.07 -0.15 -1.58 1.01 0.00 0.00 176.35 175.84 2kc5 s GLN 86 N -3.06 1.91 0.21 1.70 2.00 -1.26 -1.46 119.66 119.70 2kc5 s GLN 86 Ca 0.29 -0.54 -0.17 0.00 -2.00 0.00 0.00 55.36 52.93 2kc5 s GLN 86 Cb -0.09 -1.57 0.02 0.00 0.80 0.00 0.00 33.01 32.17 2kc5 s GLN 86 CO 0.20 0.12 0.54 -0.48 -0.50 0.00 0.00 175.29 175.16 2kc5 s LEU 87 N 0.41 0.07 0.63 3.68 2.34 -1.20 -4.77 118.68 119.85 2kc5 s LEU 87 Ca -0.12 -0.57 0.35 0.00 0.06 0.00 0.00 54.13 53.85 2kc5 s LEU 87 Cb -0.15 2.16 1.96 0.00 -0.56 0.00 0.00 46.19 49.59 2kc5 s LEU 87 CO 0.04 -1.10 2.19 -0.65 -1.06 0.00 0.00 176.35 175.76 2kc5 h PRO 88 N 2.18 0.00 -0.47 1.48 0.11 -1.81 0.34 132.00 133.83 2kc5 h PRO 88 Ca -0.27 0.00 0.05 0.00 0.11 0.00 0.00 66.00 65.89 2kc5 h PRO 88 Cb 1.26 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.34 2kc5 h PRO 88 CO 0.35 0.00 0.31 -0.92 -0.21 0.00 0.00 178.00 177.53 2kc5 h TYR 89 N 0.00 0.43 0.00 0.65 3.20 -1.84 -3.48 116.97 115.94 2kc5 h TYR 89 Ca 0.03 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.91 2kc5 h TYR 89 Cb 0.28 -0.14 0.00 0.00 1.54 0.00 0.00 36.73 38.41 2kc5 h TYR 89 CO 0.00 0.24 0.00 0.41 -1.64 0.00 0.00 178.16 177.17 2kc5 n GLY 90 N -1.50 1.47 3.71 1.82 0.00 0.11 -5.05 105.19 105.74 2kc5 n GLY 90 Ca 0.06 -1.94 -0.42 0.00 0.00 0.00 0.00 46.02 43.72 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 -1.21 3.11 -0.11 2.61 2.01 -1.26 -3.27 115.64 117.52 2kc5 s THR 91 Ca 0.00 0.72 -0.06 0.00 0.31 0.00 0.00 61.69 62.66 2kc5 s THR 91 Cb 0.00 -3.46 0.05 0.00 0.01 0.00 0.00 72.50 69.09 2kc5 s THR 91 CO 0.00 0.03 0.27 -0.32 -0.69 0.00 0.00 174.62 173.92 2kc5 s MET 92 N 1.66 0.24 0.25 4.92 0.00 -0.53 -5.03 119.30 120.81 2kc5 s MET 92 Ca 0.68 0.56 -0.27 0.00 0.00 0.00 0.00 55.69 56.66 2kc5 s MET 92 Cb -0.39 -0.09 -0.09 0.00 0.00 0.00 0.00 34.83 34.27 2kc5 s MET 92 CO 0.30 -0.15 0.89 0.95 0.00 0.00 0.00 175.02 177.01 2kc5 s THR 93 N 1.20 4.21 -0.09 10.11 -4.23 -1.26 -1.12 115.64 124.46 2kc5 s THR 93 Ca -0.09 1.87 0.01 0.00 -1.18 0.00 0.00 61.69 62.31 2kc5 s THR 93 Cb -0.09 -4.16 -0.02 0.00 1.34 0.00 0.00 72.50 69.57 2kc5 s THR 93 CO -0.09 0.37 -0.12 -0.36 -0.54 0.00 0.00 174.62 173.89 2kc5 s PHE 94 N -1.34 2.80 0.31 3.99 0.40 -0.09 -4.84 117.98 119.22 2kc5 s PHE 94 Ca 0.43 -0.30 -0.26 0.00 -0.60 0.00 0.00 56.93 56.20 2kc5 s PHE 94 Cb -0.22 -1.74 -0.10 0.00 0.51 0.00 0.00 43.02 41.47 2kc5 s PHE 94 CO 0.27 0.06 0.93 0.99 0.70 0.00 0.00 175.22 178.18 2kc5 s THR 95 N -0.30 4.21 -0.05 0.64 2.01 0.42 -0.62 115.64 121.94 2kc5 s THR 95 Ca 0.03 1.84 -0.30 0.00 0.31 0.00 0.00 61.69 63.57 2kc5 s THR 95 Cb -0.13 -4.04 -0.03 0.00 0.01 0.00 0.00 72.50 68.31 2kc5 s THR 95 CO 0.03 0.19 1.17 -0.69 -0.69 0.00 0.00 174.62 174.62 2kc5 s VAL 96 N -1.56 4.33 0.19 3.82 1.01 0.49 -0.81 120.40 127.88 2kc5 s VAL 96 Ca 0.49 1.65 0.07 0.00 0.00 0.00 0.00 61.98 64.19 2kc5 s VAL 96 Cb -0.19 -4.06 -0.04 0.00 0.00 0.00 0.00 36.38 32.08 2kc5 s VAL 96 CO 0.25 0.01 0.06 -0.83 0.00 0.00 0.00 175.10 174.59 2kc5 s GLY 97 N 1.38 1.67 -0.07 4.51 0.00 0.34 -0.82 107.32 114.33 2kc5 s GLY 97 Ca 0.55 -1.36 -0.00 0.00 0.00 0.00 0.00 44.72 43.90 2kc5 s GLY 97 CO 0.22 -1.39 -0.03 1.85 0.00 0.00 0.00 173.10 173.75 2kc5 s GLU 98 N -3.19 0.86 -0.00 2.90 2.12 -1.26 -1.53 118.70 118.60 2kc5 s GLU 98 Ca 0.30 -0.04 -0.02 0.00 0.36 0.00 0.00 54.97 55.57 2kc5 s GLU 98 Cb -0.09 -1.05 -0.00 0.00 0.26 0.00 0.00 34.13 33.25 2kc5 s GLU 98 CO 0.21 -0.22 0.03 -1.17 -0.54 0.00 0.00 175.26 173.57 2kc5 s LEU 99 N 1.56 1.93 0.18 2.70 2.96 -0.82 -4.99 118.68 122.19 2kc5 s LEU 99 Ca -0.01 -0.12 -0.33 0.00 -0.22 0.00 0.00 54.13 53.45 2kc5 s LEU 99 Cb -0.13 0.19 -0.14 0.00 0.50 0.00 0.00 46.19 46.61 2kc5 s LEU 99 CO -0.04 -0.14 1.49 -0.67 -1.32 0.00 0.00 176.35 175.67 2kc5 n ASP 100 N 2.44 2.80 0.00 3.68 2.03 -1.26 -0.68 116.55 125.56 2kc5 n ASP 100 Ca -0.17 1.11 0.00 0.00 0.52 0.00 0.00 54.79 56.25 2kc5 n ASP 100 Cb 0.58 -1.40 0.00 0.00 -0.72 0.00 0.00 41.12 39.58 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 2.91 1.00 0.00 0.27 0.00 -1.26 -4.73 105.19 103.38 2kc5 n GLY 101 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 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 -4.99 1.61 0.31 -0.43 -4.81 118.33 108.01 2kc5 n VAL 102 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 2kc5 n VAL 102 Cb 0.00 -0.73 0.00 0.00 -0.91 0.00 0.00 33.84 32.20 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 -1.81 0.00 -4.75 4.52 7.64 0.14 -4.73 113.62 114.62 2kc5 n SER 103 Ca 0.00 0.00 -0.40 0.00 1.01 0.00 0.00 58.87 59.48 2kc5 n SER 103 Cb 0.40 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.55 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 0.00 4.58 0.34 1.43 -0.21 -1.26 -1.95 119.66 122.59 2kc5 s GLN 104 Ca 0.00 1.19 -0.14 0.00 0.02 0.00 0.00 55.36 56.42 2kc5 s GLN 104 Cb 0.00 -3.33 0.03 0.00 1.00 0.00 0.00 33.01 30.71 2kc5 s GLN 104 CO 0.00 0.38 0.68 1.52 -2.12 0.00 0.00 175.29 175.75 2kc5 s TYR 105 N -0.46 0.25 0.07 0.91 1.13 -0.58 -4.80 117.35 113.86 2kc5 s TYR 105 Ca 0.39 -0.76 0.08 0.00 -1.41 0.00 0.00 57.07 55.37 2kc5 s TYR 105 Cb -0.22 0.57 -0.04 0.00 -1.10 0.00 0.00 41.96 41.17 2kc5 s TYR 105 CO 0.26 -1.35 -0.19 -0.51 -2.51 0.00 0.00 175.55 171.25 2kc5 s LEU 106 N -3.06 2.61 0.03 -3.49 1.02 -0.03 -0.51 118.68 115.25 2kc5 s LEU 106 Ca 0.18 -0.50 -0.05 0.00 0.02 0.00 0.00 54.13 53.78 2kc5 s LEU 106 Cb -0.04 -1.51 -0.01 0.00 0.02 0.00 0.00 46.19 44.66 2kc5 s LEU 106 CO 0.12 0.22 0.10 -0.94 0.02 0.00 0.00 176.35 175.87 2kc5 s SER 107 N -1.71 0.14 -0.13 2.29 1.04 0.01 -0.84 113.70 114.50 2kc5 s SER 107 Ca 0.16 -0.44 -0.05 0.00 0.48 0.00 0.00 55.95 56.09 2kc5 s SER 107 Cb -0.10 0.21 0.06 0.00 0.10 0.00 0.00 66.02 66.29 2kc5 s SER 107 CO 0.07 -0.45 0.27 0.00 0.98 0.00 0.00 173.24 174.11 2kc5 s SER 109 N 2.21 7.14 -0.04 0.00 0.01 -1.26 -0.44 113.70 121.32 2kc5 s SER 109 Ca -0.01 2.28 -0.03 0.00 1.31 0.00 0.00 55.95 59.51 2kc5 s SER 109 Cb -0.12 -2.62 -0.01 0.00 0.21 0.00 0.00 66.02 63.49 2kc5 s SER 109 CO -0.09 -0.29 -0.05 -0.07 0.41 0.00 0.00 173.24 173.15 2kc5 h LEU 110 N 4.48 0.00 -7.79 2.44 -0.00 -1.27 -3.47 115.31 109.70 2kc5 h LEU 110 Ca -0.46 0.00 0.17 0.00 -0.00 0.00 0.00 57.88 57.60 2kc5 h LEU 110 Cb 1.21 0.00 -0.06 0.00 -0.00 0.00 0.00 40.66 41.82 2kc5 h LEU 110 CO 0.70 0.24 0.55 0.00 -0.00 0.00 0.00 178.44 179.93 2kc5 s MET 111 N -1.38 1.24 -0.22 1.13 0.23 -1.21 -5.04 119.30 114.05 2kc5 s MET 111 Ca -0.04 -0.75 -0.24 0.00 -1.03 0.00 0.00 55.69 53.63 2kc5 s MET 111 Cb 0.01 0.38 -0.01 0.00 -1.53 0.00 0.00 34.83 33.67 2kc5 s MET 111 CO 0.06 -0.57 0.80 -1.12 -2.03 0.00 0.00 175.02 172.16 2kc5 s SER 112 N -3.18 6.84 0.00 -1.18 0.01 -1.26 -1.32 113.70 113.61 2kc5 s SER 112 Ca 0.17 1.04 0.20 0.00 1.31 0.00 0.00 55.95 58.67 2kc5 s SER 112 Cb -0.02 -2.43 0.75 0.00 0.21 0.00 0.00 66.02 64.54 2kc5 s SER 112 CO 0.04 -0.46 1.54 -0.81 0.41 0.00 0.00 173.24 173.96 2kc5 n PRO 113 N 5.70 1.66 -2.00 12.44 -0.04 -1.26 -4.94 135.00 146.55 2kc5 n PRO 113 Ca 0.04 -0.99 -0.43 0.00 -0.04 0.00 0.00 63.50 62.09 2kc5 n PRO 113 Cb 0.48 -1.37 -0.03 0.00 -0.04 0.00 0.00 33.50 32.54 2kc5 n PRO 113 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2kc5 s LEU 114 N -1.53 4.13 0.07 1.53 2.96 -1.26 -4.98 118.68 119.61 2kc5 s LEU 114 Ca 0.31 2.03 -0.06 0.00 -0.22 0.00 0.00 54.13 56.19 2kc5 s LEU 114 Cb 0.16 -3.53 -0.02 0.00 0.50 0.00 0.00 46.19 43.31 2kc5 s LEU 114 CO 0.25 -1.10 0.10 -0.44 -1.32 0.00 0.00 176.35 173.84 2kc5 s SER 115 N 3.98 0.25 0.07 3.68 0.01 -1.26 -5.08 113.70 115.36 2kc5 s SER 115 Ca 0.75 -0.76 0.09 0.00 1.31 0.00 0.00 55.95 57.34 2kc5 s SER 115 Cb -0.31 0.28 -0.21 0.00 0.21 0.00 0.00 66.02 65.99 2kc5 s SER 115 CO 0.30 -0.66 1.10 0.45 0.41 0.00 0.00 173.24 174.84 2kc5 h HIS 116 N 2.97 0.00 -0.33 2.43 -0.00 -2.05 -3.35 115.15 114.82 2kc5 h HIS 116 Ca -0.34 0.00 -0.69 0.00 -0.00 0.00 0.00 60.37 59.34 2kc5 h HIS 116 Cb 1.18 0.00 -0.01 0.00 -0.00 0.00 0.00 27.41 28.57 2kc5 h HIS 116 CO 0.47 0.99 3.45 0.43 -0.00 0.00 0.00 177.93 183.27 2kc5 n SER 117 N -3.26 8.52 -3.85 2.45 7.64 -1.26 -4.86 113.62 119.00 2kc5 n SER 117 Ca -0.05 -2.74 -0.12 0.00 1.01 0.00 0.00 58.87 56.97 2kc5 n SER 117 Cb 0.97 -1.50 -0.14 0.00 -1.01 0.00 0.00 64.21 62.52 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 1.24 0.00 0.19 1.43 0.00 -1.26 -5.07 119.30 115.83 2kc5 s MET 118 Ca 0.65 0.04 -0.06 0.00 0.00 0.00 0.00 55.69 56.32 2kc5 s MET 118 Cb 0.18 -0.03 -0.02 0.00 0.00 0.00 0.00 34.83 34.96 2kc5 s MET 118 CO -0.07 -0.02 0.25 -1.12 0.00 0.00 0.00 175.02 174.06 2kc5 s SER 119 N 0.15 0.08 0.57 1.11 0.01 -1.26 -5.03 113.70 109.32 2kc5 s SER 119 Ca -0.01 -1.10 0.26 0.00 1.31 0.00 0.00 55.95 56.41 2kc5 s SER 119 Cb -0.02 0.44 1.55 0.00 0.21 0.00 0.00 66.02 68.20 2kc5 s SER 119 CO -0.00 -0.92 2.10 0.40 0.41 0.00 0.00 173.24 175.23 2kc5 h ILE 120 N 2.54 0.61 -0.57 1.44 5.03 -1.99 0.46 117.51 125.04 2kc5 h ILE 120 Ca -0.32 0.00 -0.05 0.00 -0.12 0.00 0.00 64.86 64.37 2kc5 h ILE 120 Cb 1.24 0.86 -0.02 0.00 -3.03 0.00 0.00 36.82 35.86 2kc5 h ILE 120 CO 0.48 0.00 0.15 -0.33 -0.68 0.00 0.00 178.15 177.77 2kc5 h GLU 121 N 0.00 0.90 0.00 2.37 5.08 -1.99 -0.64 114.58 120.29 2kc5 h GLU 121 Ca 0.10 -0.21 -0.08 0.00 -1.00 0.00 0.00 59.36 58.17 2kc5 h GLU 121 Cb 0.48 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.60 2kc5 h GLU 121 CO -0.00 0.83 -0.37 0.93 -1.00 0.00 0.00 179.01 179.40 2kc5 h GLU 122 N 0.80 0.00 0.46 2.33 4.39 -1.35 0.11 114.58 121.32 2kc5 h GLU 122 Ca 0.18 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.87 2kc5 h GLU 122 Cb 0.32 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.95 2kc5 h GLU 122 CO -0.00 0.37 -0.47 0.78 -1.16 0.00 0.00 179.01 178.52 2kc5 h GLY 123 N 1.21 -1.23 0.76 -3.84 0.00 -0.36 0.39 103.07 100.00 2kc5 h GLY 123 Ca -0.00 0.57 -0.00 0.00 0.00 0.00 0.00 47.33 47.90 2kc5 h GLY 123 CO 0.05 -0.36 0.00 1.46 0.00 0.00 0.00 176.54 177.69 2kc5 h GLN 124 N -0.93 0.04 -0.52 4.80 4.20 -0.97 -2.69 115.11 119.04 2kc5 h GLN 124 Ca -0.06 -0.01 0.03 0.00 0.06 0.00 0.00 58.65 58.67 2kc5 h GLN 124 Cb 0.81 -0.01 -0.04 0.00 0.30 0.00 0.00 27.48 28.54 2kc5 h GLN 124 CO -0.06 0.28 0.29 -0.09 -0.67 0.00 0.00 178.83 178.58 2kc5 h ARG 125 N -0.20 0.56 0.00 1.46 2.43 -0.79 -1.80 114.38 116.03 2kc5 h ARG 125 Ca 0.01 -0.03 -0.12 0.00 -0.81 0.00 0.00 59.98 59.03 2kc5 h ARG 125 Cb 0.26 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 29.67 2kc5 h ARG 125 CO 0.00 0.37 -0.57 1.25 -1.51 0.00 0.00 179.97 179.51 2kc5 h LEU 126 N 0.58 0.00 -0.28 3.80 5.85 -0.91 0.22 115.31 124.56 2kc5 h LEU 126 Ca 0.22 0.00 -0.11 0.00 0.84 0.00 0.00 57.88 58.83 2kc5 h LEU 126 Cb 0.07 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.10 2kc5 h LEU 126 CO -0.12 0.57 -0.26 0.74 -0.34 0.00 0.00 178.44 179.02 2kc5 h THR 127 N 0.00 1.30 -0.40 1.05 2.02 -1.19 0.78 112.91 116.48 2kc5 h THR 127 Ca -0.01 -1.42 -0.12 0.00 0.77 0.00 0.00 66.41 65.63 2kc5 h THR 127 Cb 1.42 1.58 -0.01 0.00 -1.74 0.00 0.00 68.15 69.40 2kc5 h THR 127 CO 0.07 0.45 -0.21 -0.78 0.37 0.00 0.00 175.52 175.43 2kc5 h ASP 128 N 0.42 0.87 0.32 4.18 3.58 -1.24 -1.77 116.42 122.79 2kc5 h ASP 128 Ca 0.05 -0.41 -0.06 0.00 0.42 0.00 0.00 57.03 57.02 2kc5 h ASP 128 Cb 0.82 -0.24 -0.01 0.00 1.72 0.00 0.00 39.33 41.62 2kc5 h ASP 128 CO 0.07 1.09 -0.30 -0.78 -2.88 0.00 0.00 179.24 176.44 2kc5 h ASP 129 N 0.65 0.00 -0.27 2.28 3.58 -0.56 0.46 116.42 122.56 2kc5 h ASP 129 Ca 0.09 0.00 -0.10 0.00 0.42 0.00 0.00 57.03 57.43 2kc5 h ASP 129 Cb 0.77 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.82 2kc5 h ASP 129 CO 0.06 0.30 -0.24 0.00 -2.88 0.00 0.00 179.24 176.48 2kc5 h ALA 131 N 0.70 -0.27 -0.12 0.00 0.00 -0.95 -2.26 119.26 116.35 2kc5 h ALA 131 Ca 0.05 -0.02 0.05 0.00 0.00 0.00 0.00 54.91 54.99 2kc5 h ALA 131 Cb 0.80 0.30 -0.06 0.00 0.00 0.00 0.00 17.79 18.82 2kc5 h ALA 131 CO 0.06 -0.69 -0.26 -0.09 0.00 0.00 0.00 179.25 178.27 2kc5 h ARG 132 N -0.33 -0.32 -0.53 0.00 9.65 -0.80 -0.15 114.38 121.90 2kc5 h ARG 132 Ca 0.04 0.02 0.11 0.00 -1.10 0.00 0.00 59.98 59.04 2kc5 h ARG 132 Cb 0.37 0.07 -0.10 0.00 -1.39 0.00 0.00 29.97 28.92 2kc5 h ARG 132 CO -0.13 -0.21 -0.14 1.98 2.80 0.00 0.00 179.97 184.27 2kc5 h MET 133 N -0.33 -0.01 0.00 0.20 4.05 -0.66 0.77 114.93 118.94 2kc5 h MET 133 Ca 0.10 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.52 2kc5 h MET 133 Cb 0.48 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.28 2kc5 h MET 133 CO -0.31 -0.01 -0.21 -0.84 0.23 0.00 0.00 176.91 175.77 2kc5 h ILE 134 N -0.01 0.00 -0.06 1.77 3.07 -0.88 -2.81 117.51 118.58 2kc5 h ILE 134 Ca 0.25 -0.99 -0.16 0.00 1.55 0.00 0.00 64.86 65.51 2kc5 h ILE 134 Cb 0.40 1.89 -0.01 0.00 -0.27 0.00 0.00 36.82 38.82 2kc5 h ILE 134 CO -0.55 0.00 -0.67 -0.07 -1.05 0.00 0.00 178.15 175.81 2kc5 h LEU 135 N 0.00 0.31 2.50 0.16 3.38 -0.46 -3.15 115.31 118.05 2kc5 h LEU 135 Ca 0.00 -0.19 -0.32 0.00 0.09 0.00 0.00 57.88 57.45 2kc5 h LEU 135 Cb 1.00 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 41.62 2kc5 h LEU 135 CO 0.00 0.89 -0.39 -1.20 0.09 0.00 0.00 178.44 177.82 2kc5 n SER 136 N -3.83 -4.70 -4.83 -0.43 7.64 0.21 -4.60 113.62 103.08 2kc5 n SER 136 Ca -0.03 0.15 -0.34 0.00 1.01 0.00 0.00 58.87 59.65 2kc5 n SER 136 Cb 0.66 -3.99 -0.06 0.00 -1.01 0.00 0.00 64.21 59.81 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 -5.55 4.21 0.76 -3.43 1.43 -1.26 -5.05 118.68 109.79 2kc5 s LEU 137 Ca 0.00 1.36 -0.14 0.00 -1.03 0.00 0.00 54.13 54.32 2kc5 s LEU 137 Cb 0.00 -3.82 0.06 0.00 0.03 0.00 0.00 46.19 42.46 2kc5 s LEU 137 CO 0.00 -0.08 1.19 -2.16 0.23 0.00 0.00 176.35 175.52 2kc5 s PRO 138 N -2.45 1.97 0.36 1.29 0.04 -1.26 -4.93 135.00 130.01 2kc5 s PRO 138 Ca 0.48 1.67 -0.28 0.00 0.04 0.00 0.00 61.00 62.91 2kc5 s PRO 138 Cb -0.14 -1.82 -0.11 0.00 0.04 0.00 0.00 34.50 32.47 2kc5 s PRO 138 CO 0.19 -1.95 1.50 0.54 0.04 0.00 0.00 177.00 177.32 2kc5 s VAL 139 N -2.17 2.09 0.44 -0.36 0.11 -1.26 -4.96 120.40 114.28 2kc5 s VAL 139 Ca 0.72 0.09 -0.23 0.00 -2.93 0.00 0.00 61.98 59.63 2kc5 s VAL 139 Cb -0.27 -3.05 -0.08 0.00 -1.53 0.00 0.00 36.38 31.44 2kc5 s VAL 139 CO 0.48 0.02 1.07 -0.89 -3.33 0.00 0.00 175.10 172.45 2kc5 s THR 140 N -0.92 3.59 -0.39 5.04 2.01 -1.26 -5.04 115.64 118.67 2kc5 s THR 140 Ca 0.54 1.15 -0.08 0.00 0.31 0.00 0.00 61.69 63.62 2kc5 s THR 140 Cb -0.46 -3.56 0.07 0.00 0.01 0.00 0.00 72.50 68.56 2kc5 s THR 140 CO 0.60 -0.06 0.21 0.21 -0.69 0.00 0.00 174.62 174.88 2kc5 s ASN 141 N -1.63 5.50 -0.06 3.53 2.47 -1.26 -5.00 114.94 118.48 2kc5 s ASN 141 Ca 0.62 -1.45 0.00 0.00 0.42 0.00 0.00 52.86 52.45 2kc5 s ASN 141 Cb -0.22 -1.93 0.06 0.00 -1.45 0.00 0.00 41.25 37.70 2kc5 s ASN 141 CO 0.27 -0.47 1.60 -0.81 -3.72 0.00 0.00 177.10 173.97 2kc5 n PRO 142 N 4.85 1.16 -3.71 0.43 -0.04 -1.26 -4.70 135.00 131.73 2kc5 n PRO 142 Ca -0.10 -0.34 -0.13 0.00 -0.04 0.00 0.00 63.50 62.89 2kc5 n PRO 142 Cb 0.43 -1.13 -0.09 0.00 -0.04 0.00 0.00 33.50 32.67 2kc5 n PRO 142 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 2kc5 s ASP 143 N 1.22 -0.49 -0.01 3.54 2.15 -1.26 -5.18 116.67 116.64 2kc5 s ASP 143 Ca 0.07 0.92 -0.06 0.00 0.43 0.00 0.00 52.55 53.91 2kc5 s ASP 143 Cb 0.05 0.94 0.00 0.00 -0.30 0.00 0.00 42.92 43.61 2kc5 s ASP 143 CO 0.00 -0.19 0.11 -0.69 -0.17 0.00 0.00 175.17 174.24 2kc5 s VAL 144 N 0.15 0.07 0.81 1.11 1.01 -1.26 -5.16 120.40 117.13 2kc5 s VAL 144 Ca -0.01 -0.57 -0.15 0.00 0.00 0.00 0.00 61.98 61.26 2kc5 s VAL 144 Cb -0.03 -0.36 -0.00 0.00 0.00 0.00 0.00 36.38 35.99 2kc5 s VAL 144 CO 0.01 -0.31 0.56 -2.65 0.00 0.00 0.00 175.10 172.71 2kc5 n PRO 145 N 1.82 0.09 -1.91 2.72 -0.02 -1.26 -4.94 135.00 131.50 2kc5 n PRO 145 Ca -0.21 0.08 -0.41 0.00 -2.02 0.00 0.00 63.50 60.94 2kc5 n PRO 145 Cb 0.56 -1.91 -0.01 0.00 -0.02 0.00 0.00 33.50 32.12 2kc5 n PRO 145 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 2kc5 s HIS 146 N -2.10 2.78 0.43 6.00 -3.43 -1.26 -4.97 115.29 112.74 2kc5 s HIS 146 Ca 0.63 1.17 -0.23 0.00 -0.80 0.00 0.00 55.06 55.84 2kc5 s HIS 146 Cb -0.29 -3.92 -0.09 0.00 -1.43 0.00 0.00 32.58 26.85 2kc5 s HIS 146 CO 0.60 -2.73 1.02 0.00 -2.00 0.00 0.00 174.74 171.64 2kc5 s ALA 147 N -0.87 3.02 0.71 -1.38 0.00 -1.26 -5.05 121.76 116.93 2kc5 s ALA 147 Ca 0.54 0.62 -0.11 0.00 0.00 0.00 0.00 51.96 53.00 2kc5 s ALA 147 Cb -0.44 -3.24 0.02 0.00 0.00 0.00 0.00 23.12 19.45 2kc5 s ALA 147 CO 0.56 -0.17 1.07 0.20 0.00 0.00 0.00 175.76 177.42 2kc5 s GLY 148 N -1.79 1.67 -0.09 0.00 0.00 -1.26 -5.10 107.32 100.75 2kc5 s GLY 148 Ca 0.61 0.10 -0.10 0.00 0.00 0.00 0.00 44.72 45.33 2kc5 s GLY 148 CO 0.23 0.42 0.27 -1.60 0.00 0.00 0.00 173.10 172.42 2kc5 s ARG 149 N -5.03 0.35 0.34 2.90 6.06 -1.26 -5.15 118.95 117.16 2kc5 s ARG 149 Ca 0.59 0.30 -0.27 0.00 -2.50 0.00 0.00 55.73 53.85 2kc5 s ARG 149 Cb -0.14 0.17 -0.09 0.00 0.06 0.00 0.00 34.95 34.94 2kc5 s ARG 149 CO 0.55 -0.05 1.13 1.03 -2.50 0.00 0.00 175.30 175.46 2kc5 s ARG 150 N -0.03 4.36 -0.07 5.12 0.52 -1.26 -4.95 118.95 122.64 2kc5 s ARG 150 Ca -0.02 1.81 0.11 0.00 -0.52 0.00 0.00 55.73 57.11 2kc5 s ARG 150 Cb -0.02 -2.92 0.19 0.00 0.52 0.00 0.00 34.95 32.72 2kc5 s ARG 150 CO 0.01 -0.05 1.09 0.00 0.02 0.00 0.00 175.30 176.37 2kc5 n ALA 151 N 0.61 2.27 -1.91 2.13 0.00 -1.26 -5.10 120.51 117.24 2kc5 n ALA 151 Ca 0.02 -1.95 -0.31 0.00 0.00 0.00 0.00 53.44 51.20 2kc5 n ALA 151 Cb 0.46 -0.46 0.01 0.00 0.00 0.00 0.00 19.45 19.46 2kc5 n ALA 151 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.50 177.02 2kc5 s LEU 152 N -1.41 3.25 0.05 0.00 0.05 -1.26 -5.11 118.68 114.25 2kc5 s LEU 152 Ca 0.19 1.35 -0.06 0.00 0.05 0.00 0.00 54.13 55.66 2kc5 s LEU 152 Cb 0.18 -4.37 -0.01 0.00 -2.05 0.00 0.00 46.19 39.93 2kc5 s LEU 152 CO -0.01 -0.87 0.11 -1.48 -0.55 0.00 0.00 176.35 173.55 2kc5 s LEU 153 N -5.14 1.77 0.08 1.48 2.34 -1.26 -5.14 118.68 112.81 2kc5 s LEU 153 Ca 0.54 -0.64 -0.31 0.00 0.06 0.00 0.00 54.13 53.79 2kc5 s LEU 153 Cb -0.11 0.69 -0.06 0.00 -0.56 0.00 0.00 46.19 46.15 2kc5 s LEU 153 CO 0.53 -0.59 1.28 -0.36 -1.06 0.00 0.00 176.35 176.14 2kc5 s PHE 154 N -3.20 3.34 0.28 3.48 0.08 -1.26 -5.00 117.98 115.70 2kc5 s PHE 154 Ca 0.00 1.15 -0.29 0.00 0.12 0.00 0.00 56.93 57.91 2kc5 s PHE 154 Cb 0.02 -3.53 -0.10 0.00 -0.57 0.00 0.00 43.02 38.85 2kc5 s PHE 154 CO -0.07 -1.74 1.24 0.20 -0.10 0.00 0.00 175.22 174.75 2kc5 s GLY 155 N 1.11 2.90 0.31 4.36 0.00 -1.26 -5.04 107.32 109.70 2kc5 s GLY 155 Ca 0.61 1.10 -0.15 0.00 0.00 0.00 0.00 44.72 46.28 2kc5 s GLY 155 CO 0.29 1.81 0.71 0.50 0.00 0.00 0.00 173.10 176.42 2kc5 s ARG 156 N -1.28 3.99 -0.07 2.90 3.00 -1.26 -5.01 118.95 121.23 2kc5 s ARG 156 Ca 0.49 0.63 0.10 0.00 0.00 0.00 0.00 55.73 56.95 2kc5 s ARG 156 Cb -0.36 -2.47 0.15 0.00 0.00 0.00 0.00 34.95 32.26 2kc5 s ARG 156 CO 0.45 0.18 1.05 2.89 0.00 0.00 0.00 175.30 179.88 2kc5 n ARG 157 N -0.30 0.81 -1.42 3.54 1.85 -1.26 -5.14 116.66 114.74 2kc5 n ARG 157 Ca 0.03 -1.80 0.19 0.00 -1.00 0.00 0.00 57.85 55.27 2kc5 n ARG 157 Cb 0.53 -1.03 -0.05 0.00 -1.05 0.00 0.00 32.46 30.86 2kc5 n ARG 157 CO 0.00 0.00 0.00 0.43 -0.01 0.00 0.00 177.63 178.05 2kc5 n SER 158 N -0.75 -8.44 0.00 2.89 7.64 -1.26 -5.10 113.62 108.60 2kc5 n SER 158 Ca 0.08 0.58 0.00 0.00 1.01 0.00 0.00 58.87 60.54 2kc5 n SER 158 Cb 0.64 -4.33 0.00 0.00 -1.01 0.00 0.00 64.21 59.51 2kc5 n SER 158 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2kc5 n GLY 159 N -4.18 0.93 0.22 0.23 0.00 -1.26 -4.94 105.19 96.18 2kc5 n GLY 159 Ca 0.01 0.33 0.04 0.00 0.00 0.00 0.00 46.02 46.39 2kc5 n GLY 159 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2kc5 h GLU 160 N 0.00 0.06 -5.77 1.61 5.08 -2.10 -3.38 114.58 110.08 2kc5 h GLU 160 Ca 0.00 -0.01 -0.59 0.00 -1.00 0.00 0.00 59.36 57.75 2kc5 h GLU 160 Cb 0.00 -0.01 -0.08 0.00 0.50 0.00 0.00 28.75 29.17 2kc5 h GLU 160 CO 0.00 0.27 -0.21 1.21 -1.00 0.00 0.00 179.01 179.29 2kc5 s ASN 161 N -6.96 6.66 0.00 1.42 2.47 -1.26 -5.34 114.94 111.94 2kc5 s ASN 161 Ca -0.04 0.79 0.00 0.00 0.42 0.00 0.00 52.86 54.03 2kc5 s ASN 161 Cb 0.15 -2.25 0.00 0.00 -1.45 0.00 0.00 41.25 37.71 2kc5 s ASN 161 CO 0.71 0.14 0.00 0.00 -3.72 0.00 0.00 177.10 174.23