#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 3.63 -0.76 2.03 -4.23 -1.26 -4.95 115.64 110.11 2kc5 s THR 2 Ca 0.00 0.66 -0.05 0.00 -1.18 0.00 0.00 61.69 61.12 2kc5 s THR 2 Cb 0.00 -3.23 0.01 0.00 1.34 0.00 0.00 72.50 70.62 2kc5 s THR 2 CO 0.00 -0.56 2.82 -0.62 -0.54 0.00 0.00 174.62 175.72 2kc5 n GLU 3 N -2.66 3.13 -3.74 3.99 1.02 -1.26 -4.85 120.64 116.28 2kc5 n GLU 3 Ca 0.09 -2.44 -0.10 0.00 -0.02 0.00 0.00 57.16 54.68 2kc5 n GLU 3 Cb 0.53 -2.33 -0.06 0.00 -0.02 0.00 0.00 31.44 29.55 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 -0.70 0.91 -0.06 3.49 2.02 -1.26 -0.81 118.70 122.29 2kc5 s GLU 4 Ca 0.60 -0.68 0.04 0.00 0.02 0.00 0.00 54.97 54.95 2kc5 s GLU 4 Cb 0.29 0.39 0.00 0.00 0.10 0.00 0.00 34.13 34.91 2kc5 s GLU 4 CO -0.13 -0.32 -0.18 0.42 0.02 0.00 0.00 175.26 175.07 2kc5 s ILE 5 N -3.30 1.57 0.17 -1.63 -1.09 0.37 -4.72 121.20 112.57 2kc5 s ILE 5 Ca 0.00 -0.77 -0.15 0.00 -2.23 0.00 0.00 60.65 57.50 2kc5 s ILE 5 Cb 0.02 -1.36 0.02 0.00 -1.58 0.00 0.00 42.46 39.55 2kc5 s ILE 5 CO -0.08 0.45 0.44 0.00 -1.23 0.00 0.00 174.94 174.52 2kc5 s ALA 6 N 0.21 -0.69 0.00 9.38 0.00 -1.26 -1.21 121.76 128.19 2kc5 s ALA 6 Ca -0.09 -0.37 0.00 0.00 0.00 0.00 0.00 51.96 51.50 2kc5 s ALA 6 Cb -0.14 0.82 0.00 0.00 0.00 0.00 0.00 23.12 23.80 2kc5 s ALA 6 CO 0.04 -0.73 0.00 0.41 0.00 0.00 0.00 175.76 175.48 2kc5 n GLY 7 N -0.28 0.62 0.10 0.00 0.00 -1.26 -4.73 105.19 99.63 2kc5 n GLY 7 Ca -0.10 -1.73 -0.02 0.00 0.00 0.00 0.00 46.02 44.16 2kc5 n GLY 7 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 173.32 173.59 2kc5 h PHE 8 N 0.00 0.00 -0.67 1.61 -5.15 -1.94 0.80 116.94 111.59 2kc5 h PHE 8 Ca 0.00 0.00 -0.26 0.00 -0.20 0.00 0.00 57.97 57.51 2kc5 h PHE 8 Cb 0.00 0.00 -0.10 0.00 0.22 0.00 0.00 35.95 36.07 2kc5 h PHE 8 CO 0.00 0.73 -0.23 1.04 -2.00 0.00 0.00 178.31 177.84 2kc5 n GLN 9 N -3.13 -1.64 -1.59 6.09 6.02 -1.26 -3.38 117.38 118.49 2kc5 n GLN 9 Ca -0.05 0.91 -0.41 0.00 -0.01 0.00 0.00 57.00 57.45 2kc5 n GLN 9 Cb 0.87 -5.29 0.02 0.00 1.02 0.00 0.00 30.24 26.86 2kc5 n GLN 9 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 2kc5 n THR 10 N -2.16 2.58 -1.64 5.09 -2.24 -1.26 -4.55 114.28 110.11 2kc5 n THR 10 Ca -0.13 -0.50 -0.54 0.00 -2.27 0.00 0.00 64.05 60.61 2kc5 n THR 10 Cb 0.59 -1.06 -0.06 0.00 -2.10 0.00 0.00 70.33 67.69 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 0.36 1.93 -2.50 3.42 7.64 -1.26 -4.84 113.62 118.37 2kc5 n SER 11 Ca 0.10 1.10 -0.14 0.00 1.01 0.00 0.00 58.87 60.95 2kc5 n SER 11 Cb 0.41 -1.17 -0.08 0.00 -1.01 0.00 0.00 64.21 62.36 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 3.62 1.71 -0.22 1.43 -0.02 -1.26 -4.76 135.00 135.50 2kc5 n PRO 12 Ca 0.21 -0.98 0.02 0.00 -2.02 0.00 0.00 63.50 60.73 2kc5 n PRO 12 Cb 0.17 -2.06 0.10 0.00 -0.02 0.00 0.00 33.50 31.69 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 4.63 0.06 -0.52 -0.52 3.64 -1.96 0.16 116.57 122.06 2kc5 h LYS 13 Ca 0.28 -0.00 -0.09 0.00 -1.27 0.00 0.00 60.65 59.56 2kc5 h LYS 13 Cb 0.75 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.54 2kc5 h LYS 13 CO 0.71 0.04 -0.04 0.00 -2.27 0.00 0.00 179.45 177.89 2kc5 h ALA 14 N 1.63 0.70 -0.22 5.00 0.00 -1.96 -0.84 119.26 123.58 2kc5 h ALA 14 Ca 0.34 -0.31 -0.19 0.00 0.00 0.00 0.00 54.91 54.75 2kc5 h ALA 14 Cb 0.56 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.16 2kc5 h ALA 14 CO -0.62 0.56 -0.61 1.96 0.00 0.00 0.00 179.25 180.54 2kc5 h GLN 15 N 0.81 0.76 -0.53 0.00 4.20 -1.50 -0.17 115.11 118.68 2kc5 h GLN 15 Ca 0.14 -0.52 -0.01 0.00 0.06 0.00 0.00 58.65 58.32 2kc5 h GLN 15 Cb 0.58 0.07 -0.02 0.00 0.30 0.00 0.00 27.48 28.41 2kc5 h GLN 15 CO 0.03 1.14 0.29 0.28 -0.67 0.00 0.00 178.83 179.90 2kc5 h VAL 16 N 0.57 1.18 0.38 -0.54 2.07 -0.70 -0.71 116.25 118.49 2kc5 h VAL 16 Ca -0.00 -0.46 -0.02 0.00 0.82 0.00 0.00 66.70 67.04 2kc5 h VAL 16 Cb 1.21 0.52 0.00 0.00 -1.52 0.00 0.00 31.29 31.50 2kc5 h VAL 16 CO 0.13 0.19 -0.18 -0.61 0.02 0.00 0.00 177.57 177.12 2kc5 h GLN 17 N 0.71 -0.49 -0.82 1.57 4.15 -0.82 -0.63 115.11 118.79 2kc5 h GLN 17 Ca 0.19 0.03 -0.04 0.00 0.77 0.00 0.00 58.65 59.60 2kc5 h GLN 17 Cb 0.05 0.11 -0.04 0.00 0.21 0.00 0.00 27.48 27.82 2kc5 h GLN 17 CO -0.03 -0.31 0.35 0.00 -1.93 0.00 0.00 178.83 176.91 2kc5 h ALA 18 N 0.11 1.06 -0.26 3.38 0.00 -0.93 0.68 119.26 123.29 2kc5 h ALA 18 Ca -0.05 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 2kc5 h ALA 18 Cb 0.40 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 2kc5 h ALA 18 CO 0.08 0.66 0.12 0.00 0.00 0.00 0.00 179.25 180.12 2kc5 h ALA 19 N 1.19 0.34 0.00 0.00 0.00 -1.02 -2.29 119.26 117.48 2kc5 h ALA 19 Ca 0.28 -0.10 -0.05 0.00 0.00 0.00 0.00 54.91 55.04 2kc5 h ALA 19 Cb 0.18 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 2kc5 h ALA 19 CO -0.03 -0.09 -0.23 0.74 0.00 0.00 0.00 179.25 179.65 2kc5 h PHE 20 N 0.29 0.00 -0.18 0.00 0.04 -0.63 -0.18 116.94 116.28 2kc5 h PHE 20 Ca 0.09 0.00 -0.09 0.00 2.80 0.00 0.00 57.97 60.77 2kc5 h PHE 20 Cb 0.14 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.27 2kc5 h PHE 20 CO -0.02 0.23 -0.27 1.49 -0.60 0.00 0.00 178.31 179.14 2kc5 h GLU 21 N 0.00 0.34 0.04 1.51 4.81 -0.46 0.98 114.58 121.80 2kc5 h GLU 21 Ca -0.00 -0.12 -0.12 0.00 -0.13 0.00 0.00 59.36 58.99 2kc5 h GLU 21 Cb 0.61 -0.02 0.01 0.00 0.63 0.00 0.00 28.75 29.98 2kc5 h GLU 21 CO 0.03 0.59 -0.49 1.49 -0.73 0.00 0.00 179.01 179.89 2kc5 h GLU 22 N 0.30 0.26 -0.96 1.92 4.57 -0.78 -2.95 114.58 116.94 2kc5 h GLU 22 Ca 0.04 -0.34 0.00 0.00 -1.18 0.00 0.00 59.36 57.89 2kc5 h GLU 22 Cb 0.64 0.11 -0.05 0.00 -0.16 0.00 0.00 28.75 29.29 2kc5 h GLU 22 CO 0.05 1.08 0.61 0.82 -1.18 0.00 0.00 179.01 180.38 2kc5 h ILE 23 N -0.41 1.25 -0.36 2.32 2.04 -0.97 0.18 117.51 121.57 2kc5 h ILE 23 Ca -0.07 -0.51 -0.04 0.00 1.00 0.00 0.00 64.86 65.24 2kc5 h ILE 23 Cb 1.29 -0.13 -0.02 0.00 -0.74 0.00 0.00 36.82 37.22 2kc5 h ILE 23 CO 0.09 0.26 0.06 0.00 0.00 0.00 0.00 178.15 178.56 2kc5 h ALA 24 N 1.36 1.44 -0.18 1.87 0.00 -0.87 0.65 119.26 123.53 2kc5 h ALA 24 Ca 0.35 -0.16 -0.13 0.00 0.00 0.00 0.00 54.91 54.96 2kc5 h ALA 24 Cb -0.11 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.53 2kc5 h ALA 24 CO -0.07 0.41 -0.41 -0.09 0.00 0.00 0.00 179.25 179.09 2kc5 h ARG 25 N 0.53 0.59 -0.87 0.00 2.43 -0.98 -0.92 114.38 115.15 2kc5 h ARG 25 Ca 0.12 -0.40 0.03 0.00 -0.81 0.00 0.00 59.98 58.92 2kc5 h ARG 25 Cb 0.24 0.06 -0.05 0.00 -0.42 0.00 0.00 29.97 29.80 2kc5 h ARG 25 CO 0.00 1.01 0.57 0.00 -1.51 0.00 0.00 179.97 180.04 2kc5 h ARG 26 N 0.26 1.07 -0.11 0.20 -0.00 -0.59 -2.49 114.38 112.72 2kc5 h ARG 26 Ca 0.00 -0.06 -0.03 0.00 -0.50 0.00 0.00 59.98 59.39 2kc5 h ARG 26 Cb 1.01 -0.24 -0.00 0.00 0.00 0.00 0.00 29.97 30.74 2kc5 h ARG 26 CO 0.09 0.71 -0.03 0.77 0.00 0.00 0.00 179.97 181.51 2kc5 h SER 27 N 1.11 0.22 -0.87 7.04 0.02 -0.82 -3.28 113.55 116.96 2kc5 h SER 27 Ca 0.35 -0.38 -0.47 0.00 -0.84 0.00 0.00 61.79 60.45 2kc5 h SER 27 Cb -0.01 -0.06 -0.18 0.00 0.14 0.00 0.00 62.40 62.29 2kc5 h SER 27 CO -0.11 0.54 0.52 0.23 -1.14 0.00 0.00 176.83 176.87 2kc5 n MET 28 N -4.75 2.21 0.00 3.45 2.81 -0.36 -4.69 117.12 115.80 2kc5 n MET 28 Ca -0.06 -2.23 0.08 0.00 -1.81 0.00 0.00 57.70 53.68 2kc5 n MET 28 Cb 0.25 -1.95 0.45 0.00 -0.71 0.00 0.00 33.22 31.26 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 0.30 0.00 0.28 2.03 -0.00 -0.96 -1.91 115.22 114.96 2kc5 n HIS 29 Ca 0.43 0.00 0.13 0.00 -0.00 0.00 0.00 57.72 58.28 2kc5 n HIS 29 Cb 0.56 -0.17 0.81 0.00 -0.00 0.00 0.00 29.99 31.19 2kc5 n HIS 29 CO 0.00 0.00 0.00 0.22 -0.00 0.00 0.00 176.34 176.56 2kc5 h ASP 30 N 0.00 0.00 -0.07 4.39 3.58 -1.88 -0.64 116.42 121.81 2kc5 h ASP 30 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2kc5 h ASP 30 Cb 0.09 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.14 2kc5 h ASP 30 CO 0.00 0.04 0.00 0.18 -2.88 0.00 0.00 179.24 176.58 2kc5 n LEU 31 N -3.91 0.38 0.00 2.28 7.99 -0.80 -5.02 117.00 117.92 2kc5 n LEU 31 Ca -0.03 -0.19 0.00 0.00 -0.01 0.00 0.00 56.01 55.79 2kc5 n LEU 31 Cb 0.13 -0.05 0.00 0.00 -0.11 0.00 0.00 43.42 43.39 2kc5 n LEU 31 CO 0.29 0.09 0.00 -1.20 -1.51 0.00 0.00 177.39 175.07 2kc5 n SER 32 N -0.32 0.00 -0.04 -1.43 7.64 -0.25 -2.42 113.62 116.80 2kc5 n SER 32 Ca 0.04 0.00 0.15 0.00 1.01 0.00 0.00 58.87 60.07 2kc5 n SER 32 Cb 0.07 0.00 0.84 0.00 -1.01 0.00 0.00 64.21 64.11 2kc5 n SER 32 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 2kc5 n PHE 33 N 14.00 0.00 -1.94 1.43 3.72 -1.26 -4.75 117.46 128.66 2kc5 n PHE 33 Ca 0.00 0.00 -0.38 0.00 -0.05 0.00 0.00 57.45 57.02 2kc5 n PHE 33 Cb 0.00 -0.10 0.03 0.00 -0.94 0.00 0.00 39.48 38.47 2kc5 n PHE 33 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 2kc5 s LEU 34 N -2.21 3.87 0.79 4.37 1.43 -1.01 -5.01 118.68 120.90 2kc5 s LEU 34 Ca 0.40 2.59 -0.11 0.00 -1.03 0.00 0.00 54.13 55.98 2kc5 s LEU 34 Cb 0.21 -4.31 0.07 0.00 0.03 0.00 0.00 46.19 42.19 2kc5 s LEU 34 CO 0.40 -1.40 1.09 -1.38 0.23 0.00 0.00 176.35 175.29 2kc5 s HIS 35 N -1.41 2.57 0.59 0.29 -3.43 -1.26 -4.88 115.29 107.76 2kc5 s HIS 35 Ca 0.70 1.50 -0.20 0.00 -0.80 0.00 0.00 55.06 56.27 2kc5 s HIS 35 Cb -0.36 -3.06 -0.04 0.00 -1.43 0.00 0.00 32.58 27.69 2kc5 s HIS 35 CO 0.42 -1.86 1.22 -2.30 -2.00 0.00 0.00 174.74 170.22 2kc5 n PRO 36 N -3.56 1.29 0.25 -0.38 -0.02 -1.26 -4.89 135.00 126.43 2kc5 n PRO 36 Ca 0.09 0.49 0.11 0.00 -2.02 0.00 0.00 63.50 62.16 2kc5 n PRO 36 Cb 0.53 -2.43 0.67 0.00 -0.02 0.00 0.00 33.50 32.25 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 0.91 0.00 -3.79 2.55 0.02 -1.98 -3.39 113.55 107.86 2kc5 h SER 37 Ca -0.50 0.00 -0.33 0.00 -0.84 0.00 0.00 61.79 60.12 2kc5 h SER 37 Cb 1.33 0.00 -0.30 0.00 0.14 0.00 0.00 62.40 63.58 2kc5 h SER 37 CO 0.54 0.15 -0.75 -0.04 -1.14 0.00 0.00 176.83 175.58 2kc5 s MET 38 N -4.22 0.42 0.12 3.45 -1.94 -1.26 -5.10 119.30 110.77 2kc5 s MET 38 Ca -0.03 -0.13 -0.35 0.00 -1.71 0.00 0.00 55.69 53.47 2kc5 s MET 38 Cb 0.13 -0.43 -0.16 0.00 2.01 0.00 0.00 34.83 36.38 2kc5 s MET 38 CO 0.61 0.05 1.36 -2.30 -0.01 0.00 0.00 175.02 174.73 2kc5 n PRO 39 N 3.23 1.37 -1.82 2.03 -0.02 -1.26 -4.68 135.00 133.85 2kc5 n PRO 39 Ca -0.16 0.49 -0.34 0.00 -2.02 0.00 0.00 63.50 61.47 2kc5 n PRO 39 Cb 0.57 -2.14 0.05 0.00 -0.02 0.00 0.00 33.50 31.95 2kc5 n PRO 39 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 2kc5 s VAL 40 N 0.43 2.88 0.04 -1.45 -7.23 -1.26 -4.90 120.40 108.91 2kc5 s VAL 40 Ca 0.81 0.46 -0.01 0.00 -1.81 0.00 0.00 61.98 61.43 2kc5 s VAL 40 Cb -0.87 -3.05 -0.03 0.00 0.56 0.00 0.00 36.38 32.99 2kc5 s VAL 40 CO 0.46 -0.20 -0.01 -0.47 -0.31 0.00 0.00 175.10 174.57 2kc5 s TYR 41 N -2.00 0.38 -0.12 2.82 5.04 -0.49 -5.00 117.35 117.98 2kc5 s TYR 41 Ca 0.72 -0.79 -0.04 0.00 -2.44 0.00 0.00 57.07 54.52 2kc5 s TYR 41 Cb -0.25 -0.28 0.05 0.00 0.35 0.00 0.00 41.96 41.83 2kc5 s TYR 41 CO 0.38 -0.31 0.07 0.08 -1.34 0.00 0.00 175.55 174.44 2kc5 s VAL 42 N -2.82 -0.05 0.29 3.14 1.01 -1.26 -0.95 120.40 119.76 2kc5 s VAL 42 Ca -0.03 0.06 -0.28 0.00 0.00 0.00 0.00 61.98 61.73 2kc5 s VAL 42 Cb -0.00 -0.43 -0.09 0.00 0.00 0.00 0.00 36.38 35.86 2kc5 s VAL 42 CO -0.06 -0.08 0.97 -0.44 0.00 0.00 0.00 175.10 175.50 2kc5 s SER 43 N 2.13 7.42 -0.05 3.32 0.01 0.10 -4.94 113.70 121.70 2kc5 s SER 43 Ca 0.03 1.96 0.04 0.00 1.31 0.00 0.00 55.95 59.29 2kc5 s SER 43 Cb -0.14 -2.60 -0.00 0.00 0.21 0.00 0.00 66.02 63.48 2kc5 s SER 43 CO -0.06 -0.01 -0.18 -0.62 0.41 0.00 0.00 173.24 172.78 2kc5 s ASP 44 N -1.32 2.26 -0.23 2.44 2.15 -1.26 -1.55 116.67 119.15 2kc5 s ASP 44 Ca 0.46 -0.37 -0.27 0.00 0.43 0.00 0.00 52.55 52.80 2kc5 s ASP 44 Cb -0.24 -0.67 0.10 0.00 -0.30 0.00 0.00 42.92 41.81 2kc5 s ASP 44 CO 0.30 0.15 0.90 0.72 -0.17 0.00 0.00 175.17 177.08 2kc5 s PHE 45 N 0.07 -0.56 0.41 -5.34 -0.71 -0.19 -4.97 117.98 106.68 2kc5 s PHE 45 Ca -0.05 1.27 0.00 0.00 -1.04 0.00 0.00 56.93 57.11 2kc5 s PHE 45 Cb -0.12 0.36 0.00 0.00 -1.21 0.00 0.00 43.02 42.05 2kc5 s PHE 45 CO 0.03 -0.33 0.00 2.41 -1.34 0.00 0.00 175.22 175.99 2kc5 n THR 46 N 1.94 -0.27 -3.88 -4.49 -1.04 -1.26 -1.85 114.28 103.44 2kc5 n THR 46 Ca -0.13 0.50 -0.36 0.00 -2.04 0.00 0.00 64.05 62.02 2kc5 n THR 46 Cb 0.56 -0.86 -0.13 0.00 -1.82 0.00 0.00 70.33 68.07 2kc5 n THR 46 CO 0.00 0.00 0.00 -0.22 -0.64 0.00 0.00 175.07 174.21 2kc5 s LEU 47 N -6.36 3.94 -0.03 -4.42 2.96 -1.26 -1.96 118.68 111.56 2kc5 s LEU 47 Ca 0.00 -1.21 0.03 0.00 -0.22 0.00 0.00 54.13 52.73 2kc5 s LEU 47 Cb 0.00 -1.74 0.00 0.00 0.50 0.00 0.00 46.19 44.95 2kc5 s LEU 47 CO 0.00 -0.27 -0.10 0.12 -1.32 0.00 0.00 176.35 174.78 2kc5 s PHE 48 N 1.29 1.07 -1.56 5.38 5.36 0.47 -4.59 117.98 125.41 2kc5 s PHE 48 Ca -0.04 -0.28 0.00 0.00 -0.96 0.00 0.00 56.93 55.65 2kc5 s PHE 48 Cb -0.19 -0.76 0.00 0.00 -0.34 0.00 0.00 43.02 41.73 2kc5 s PHE 48 CO -0.00 -0.11 0.00 0.39 -1.46 0.00 0.00 175.22 174.04 2kc5 n GLU 49 N 3.27 -1.67 -0.91 10.12 -0.58 -1.26 -0.77 120.64 128.84 2kc5 n GLU 49 Ca -0.18 0.88 0.00 0.00 -0.42 0.00 0.00 57.16 57.43 2kc5 n GLU 49 Cb 0.54 -5.34 0.00 0.00 -0.57 0.00 0.00 31.44 26.07 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 -0.61 0.58 3.55 0.62 0.00 -1.26 -5.02 105.19 103.05 2kc5 n GLY 50 Ca -0.18 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.58 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 -0.40 1.98 0.23 1.61 -1.52 0.05 -3.92 119.66 117.68 2kc5 s GLN 51 Ca 0.00 -1.33 -0.30 0.00 -1.95 0.00 0.00 55.36 51.78 2kc5 s GLN 51 Cb 0.00 -2.10 -0.09 0.00 -0.22 0.00 0.00 33.01 30.60 2kc5 s GLN 51 CO 0.00 0.42 1.11 -1.58 -0.25 0.00 0.00 175.29 174.99 2kc5 s TRP 52 N -1.76 3.57 0.18 0.91 0.52 -0.20 -0.40 118.94 121.76 2kc5 s TRP 52 Ca 0.25 1.62 0.05 0.00 0.02 0.00 0.00 56.10 58.04 2kc5 s TRP 52 Cb -0.08 -3.30 -0.04 0.00 -1.15 0.00 0.00 33.47 28.90 2kc5 s TRP 52 CO 0.15 -0.66 0.20 0.99 0.02 0.00 0.00 176.95 177.65 2kc5 s THR 53 N -0.64 4.76 0.18 2.01 2.01 -0.77 -1.40 115.64 121.78 2kc5 s THR 53 Ca 0.48 -1.01 -0.24 0.00 0.31 0.00 0.00 61.69 61.22 2kc5 s THR 53 Cb -0.31 -3.47 0.06 0.00 0.01 0.00 0.00 72.50 68.80 2kc5 s THR 53 CO 0.38 -0.15 0.95 -0.83 -0.69 0.00 0.00 174.62 174.28 2kc5 s GLY 54 N -3.30 -0.15 0.02 4.40 0.00 0.40 -1.03 107.32 107.67 2kc5 s GLY 54 Ca 0.32 -0.01 -0.09 0.00 0.00 0.00 0.00 44.72 44.95 2kc5 s GLY 54 CO 0.25 0.30 0.17 0.00 0.00 0.00 0.00 173.10 173.83 2kc5 s VAL 56 N -1.99 1.53 0.09 0.00 0.11 0.33 -0.72 120.40 119.75 2kc5 s VAL 56 Ca -0.10 -1.12 0.07 0.00 -2.93 0.00 0.00 61.98 57.90 2kc5 s VAL 56 Cb -0.04 -1.34 -0.03 0.00 -1.53 0.00 0.00 36.38 33.44 2kc5 s VAL 56 CO -0.01 0.18 -0.17 -0.51 -3.33 0.00 0.00 175.10 171.26 2kc5 s ILE 57 N -0.77 1.42 0.30 7.04 2.07 -0.12 -1.05 121.20 130.08 2kc5 s ILE 57 Ca 0.06 -1.45 0.04 0.00 -1.41 0.00 0.00 60.65 57.90 2kc5 s ILE 57 Cb -0.08 -1.34 -0.03 0.00 0.13 0.00 0.00 42.46 41.13 2kc5 s ILE 57 CO 0.01 -0.15 0.21 0.42 -1.91 0.00 0.00 174.94 173.52 2kc5 s THR 58 N -1.27 0.10 0.51 4.00 -4.23 0.25 -1.39 115.64 113.61 2kc5 s THR 58 Ca 0.03 -2.00 0.16 0.00 -1.18 0.00 0.00 61.69 58.70 2kc5 s THR 58 Cb -0.10 -2.49 0.28 0.00 1.34 0.00 0.00 72.50 71.53 2kc5 s THR 58 CO 0.03 0.00 2.13 -0.65 -0.54 0.00 0.00 174.62 175.59 2kc5 h PRO 59 N 2.25 0.05 0.00 3.99 0.11 -1.90 -3.24 132.00 133.26 2kc5 h PRO 59 Ca -0.30 -0.00 -0.17 0.00 0.11 0.00 0.00 66.00 65.63 2kc5 h PRO 59 Cb 1.24 -0.01 -0.03 0.00 0.11 0.00 0.00 31.00 32.31 2kc5 h PRO 59 CO 0.45 0.04 -1.59 -2.67 -0.21 0.00 0.00 178.00 174.01 2kc5 n TRP 60 N -4.52 0.76 -3.94 0.65 4.27 -1.26 -1.84 117.44 111.56 2kc5 n TRP 60 Ca -0.01 0.25 -0.08 0.00 -3.89 0.00 0.00 57.50 53.77 2kc5 n TRP 60 Cb 0.13 -1.01 -0.04 0.00 -1.36 0.00 0.00 31.31 29.03 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 -2.94 1.68 -0.03 -2.67 0.23 -1.23 -4.10 119.30 110.24 2kc5 s MET 61 Ca -0.04 -1.16 0.00 0.00 -1.03 0.00 0.00 55.69 53.46 2kc5 s MET 61 Cb 0.09 0.54 0.03 0.00 -1.53 0.00 0.00 34.83 33.95 2kc5 s MET 61 CO 0.82 -0.74 0.01 -1.17 -2.03 0.00 0.00 175.02 171.92 2kc5 s LEU 62 N -2.98 1.03 -0.01 0.18 0.20 0.14 -0.58 118.68 116.66 2kc5 s LEU 62 Ca 0.17 -0.01 -0.01 0.00 0.69 0.00 0.00 54.13 54.98 2kc5 s LEU 62 Cb -0.03 -0.20 0.01 0.00 -0.43 0.00 0.00 46.19 45.54 2kc5 s LEU 62 CO 0.08 -0.12 0.03 -0.44 -0.29 0.00 0.00 176.35 175.61 2kc5 s SER 63 N 1.18 -0.02 0.47 3.68 0.01 -0.22 -0.87 113.70 117.94 2kc5 s SER 63 Ca -0.08 0.05 -0.23 0.00 1.31 0.00 0.00 55.95 57.01 2kc5 s SER 63 Cb -0.13 0.04 -0.07 0.00 0.21 0.00 0.00 66.02 66.06 2kc5 s SER 63 CO -0.02 -0.02 1.17 0.00 0.41 0.00 0.00 173.24 174.77 2kc5 s ALA 64 N 0.15 2.96 0.01 1.44 0.00 0.51 -0.51 121.76 126.32 2kc5 s ALA 64 Ca -0.01 0.93 0.01 0.00 0.00 0.00 0.00 51.96 52.89 2kc5 s ALA 64 Cb -0.02 -3.38 -0.01 0.00 0.00 0.00 0.00 23.12 19.71 2kc5 s ALA 64 CO -0.00 -0.67 -0.03 0.14 0.00 0.00 0.00 175.76 175.20 2kc5 s VAL 65 N -1.55 0.17 0.01 0.00 -7.23 -0.52 -1.27 120.40 110.01 2kc5 s VAL 65 Ca 0.64 -0.50 0.01 0.00 -1.81 0.00 0.00 61.98 60.32 2kc5 s VAL 65 Cb -0.28 -0.23 -0.01 0.00 0.56 0.00 0.00 36.38 36.42 2kc5 s VAL 65 CO 0.34 -0.21 -0.03 -0.63 -0.31 0.00 0.00 175.10 174.26 2kc5 s ILE 66 N -0.71 0.22 0.05 -0.62 1.01 0.54 -0.45 121.20 121.23 2kc5 s ILE 66 Ca -0.07 -0.45 0.06 0.00 0.00 0.00 0.00 60.65 60.19 2kc5 s ILE 66 Cb -0.05 -0.25 -0.02 0.00 0.01 0.00 0.00 42.46 42.14 2kc5 s ILE 66 CO -0.00 -0.16 -0.16 -0.36 0.00 0.00 0.00 174.94 174.26 2kc5 s PHE 67 N -0.61 1.42 0.17 3.97 0.40 -0.49 -0.76 117.98 122.08 2kc5 s PHE 67 Ca -0.05 -0.37 -0.33 0.00 -0.60 0.00 0.00 56.93 55.58 2kc5 s PHE 67 Cb -0.05 -0.84 -0.16 0.00 0.51 0.00 0.00 43.02 42.49 2kc5 s PHE 67 CO -0.00 0.07 1.12 -2.30 0.70 0.00 0.00 175.22 174.81 2kc5 n PRO 68 N 1.77 1.05 -1.59 0.24 -0.02 -1.26 -1.04 135.00 134.16 2kc5 n PRO 68 Ca -0.18 0.38 -0.29 0.00 -2.02 0.00 0.00 63.50 61.38 2kc5 n PRO 68 Cb 0.54 -1.85 0.16 0.00 -0.02 0.00 0.00 33.50 32.34 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 -0.07 1.63 0.54 -1.23 0.00 -1.25 -4.42 107.32 102.52 2kc5 s GLY 69 Ca 0.73 -0.80 -0.20 0.00 0.00 0.00 0.00 44.72 44.46 2kc5 s GLY 69 CO 0.53 -0.13 1.13 2.56 0.00 0.00 0.00 173.10 177.19 2kc5 s PRO 70 N -5.49 3.37 -1.60 2.90 0.04 -1.22 -3.94 135.00 129.06 2kc5 s PRO 70 Ca 0.68 1.62 -0.15 0.00 0.04 0.00 0.00 61.00 63.18 2kc5 s PRO 70 Cb -0.11 -2.02 0.11 0.00 0.04 0.00 0.00 34.50 32.53 2kc5 s PRO 70 CO 0.53 -0.84 0.90 -3.47 0.04 0.00 0.00 177.00 174.16 2kc5 n ASP 71 N -1.28 -4.12 -4.04 6.66 2.03 0.27 -4.97 116.55 111.11 2kc5 n ASP 71 Ca 0.12 -0.87 -0.25 0.00 0.52 0.00 0.00 54.79 54.31 2kc5 n ASP 71 Cb 0.51 -3.44 -0.16 0.00 -0.72 0.00 0.00 41.12 37.30 2kc5 n ASP 71 CO 0.00 0.00 0.00 -1.10 -1.92 0.00 0.00 177.20 174.18 2kc5 s GLN 72 N -6.73 1.71 -1.06 -0.67 -0.21 -1.25 -5.03 119.66 106.42 2kc5 s GLN 72 Ca 0.67 -0.45 -0.12 0.00 0.02 0.00 0.00 55.36 55.48 2kc5 s GLN 72 Cb -0.35 -1.42 0.23 0.00 1.00 0.00 0.00 33.01 32.46 2kc5 s GLN 72 CO 0.87 0.07 1.11 -0.51 -2.12 0.00 0.00 175.29 174.71 2kc5 s LEU 73 N 0.53 6.03 0.35 2.90 1.02 -1.26 -4.33 118.68 123.92 2kc5 s LEU 73 Ca -0.13 -3.13 -0.28 0.00 0.02 0.00 0.00 54.13 50.61 2kc5 s LEU 73 Cb -0.15 -2.27 -0.10 0.00 0.02 0.00 0.00 46.19 43.69 2kc5 s LEU 73 CO 0.04 -0.52 1.32 0.26 0.02 0.00 0.00 176.35 177.46 2kc5 s TRP 74 N 0.03 2.98 0.86 0.29 0.52 -0.35 -4.87 118.94 118.41 2kc5 s TRP 74 Ca 0.31 1.40 -0.11 0.00 0.02 0.00 0.00 56.10 57.72 2kc5 s TRP 74 Cb -0.08 -3.70 0.11 0.00 -1.15 0.00 0.00 33.47 28.65 2kc5 s TRP 74 CO -0.07 -1.96 1.10 -2.14 0.02 0.00 0.00 176.95 173.90 2kc5 s PRO 75 N -1.88 1.52 -0.41 4.98 0.02 -1.26 -0.48 135.00 137.49 2kc5 s PRO 75 Ca 0.50 1.17 -0.28 0.00 0.02 0.00 0.00 61.00 62.42 2kc5 s PRO 75 Cb -0.40 -1.81 -0.02 0.00 0.02 0.00 0.00 34.50 32.28 2kc5 s PRO 75 CO 0.53 -2.16 1.89 -1.17 -0.33 0.00 0.00 177.00 175.76 2kc5 s LEU 76 N -6.24 3.44 0.61 -5.54 2.96 0.01 -4.45 118.68 109.46 2kc5 s LEU 76 Ca 0.64 1.06 -0.15 0.00 -0.22 0.00 0.00 54.13 55.46 2kc5 s LEU 76 Cb -0.19 -3.17 -0.03 0.00 0.50 0.00 0.00 46.19 43.30 2kc5 s LEU 76 CO 0.57 -2.00 1.06 -0.13 -1.32 0.00 0.00 176.35 174.54 2kc5 s ARG 77 N 6.28 3.23 0.21 1.98 3.00 -1.26 -4.95 118.95 127.43 2kc5 s ARG 77 Ca 0.79 1.21 -0.12 0.00 0.00 0.00 0.00 55.73 57.61 2kc5 s ARG 77 Cb -0.20 -2.02 -0.07 0.00 0.00 0.00 0.00 34.95 32.66 2kc5 s ARG 77 CO 0.30 -0.89 0.58 0.21 0.00 0.00 0.00 175.30 175.50 2kc5 s LYS 78 N -4.15 3.90 0.34 3.54 2.47 -1.26 -5.08 119.74 119.50 2kc5 s LYS 78 Ca 0.64 0.41 -0.07 0.00 -1.56 0.00 0.00 55.97 55.39 2kc5 s LYS 78 Cb -0.16 -2.72 -0.06 0.00 -1.46 0.00 0.00 37.83 33.43 2kc5 s LYS 78 CO 0.39 0.35 0.64 0.08 0.16 0.00 0.00 175.35 176.97 2kc5 s VAL 79 N -1.71 4.93 -0.48 4.02 1.01 -1.26 -3.95 120.40 122.96 2kc5 s VAL 79 Ca 0.45 0.28 0.00 0.00 0.00 0.00 0.00 61.98 62.71 2kc5 s VAL 79 Cb -0.12 -3.73 0.00 0.00 0.00 0.00 0.00 36.38 32.52 2kc5 s VAL 79 CO 0.20 -0.40 0.00 -1.20 0.00 0.00 0.00 175.10 173.70 2kc5 n SER 80 N -1.08 -5.15 -4.89 3.32 7.64 0.01 -4.97 113.62 108.50 2kc5 n SER 80 Ca -0.00 0.11 -0.28 0.00 1.01 0.00 0.00 58.87 59.71 2kc5 n SER 80 Cb 0.54 -3.04 -0.01 0.00 -1.01 0.00 0.00 64.21 60.69 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 -2.02 3.60 -0.01 1.43 0.41 -1.25 -4.82 118.70 116.03 2kc5 s GLU 81 Ca 0.00 0.34 0.03 0.00 -0.41 0.00 0.00 54.97 54.93 2kc5 s GLU 81 Cb 0.00 -2.33 -0.03 0.00 -1.78 0.00 0.00 34.13 29.98 2kc5 s GLU 81 CO 0.00 -0.23 -0.08 0.15 -0.49 0.00 0.00 175.26 174.62 2kc5 s LYS 82 N -4.63 2.56 -0.15 1.61 1.02 -1.26 -0.41 119.74 118.48 2kc5 s LYS 82 Ca 0.49 -0.70 -0.01 0.00 0.02 0.00 0.00 55.97 55.78 2kc5 s LYS 82 Cb -0.10 -2.50 -0.01 0.00 -0.52 0.00 0.00 37.83 34.70 2kc5 s LYS 82 CO 0.44 0.61 -0.12 0.42 -0.92 0.00 0.00 175.35 175.78 2kc5 s ILE 83 N -0.94 3.04 -0.19 2.17 1.09 -0.12 -4.96 121.20 121.30 2kc5 s ILE 83 Ca 0.16 -0.65 -0.29 0.00 -1.10 0.00 0.00 60.65 58.76 2kc5 s ILE 83 Cb -0.11 -2.30 -0.00 0.00 -1.06 0.00 0.00 42.46 38.99 2kc5 s ILE 83 CO 0.06 0.51 1.10 -0.83 -0.10 0.00 0.00 174.94 175.68 2kc5 s GLY 84 N 0.58 1.80 -0.13 6.18 0.00 -1.26 -0.99 107.32 113.50 2kc5 s GLY 84 Ca -0.07 0.31 -0.03 0.00 0.00 0.00 0.00 44.72 44.93 2kc5 s GLY 84 CO 0.03 2.23 -0.04 1.08 0.00 0.00 0.00 173.10 176.40 2kc5 s LEU 85 N 3.05 3.24 -0.13 0.66 1.43 -0.57 -4.98 118.68 121.38 2kc5 s LEU 85 Ca 0.48 -0.09 -0.24 0.00 -1.03 0.00 0.00 54.13 53.25 2kc5 s LEU 85 Cb -0.18 -1.76 -0.02 0.00 0.03 0.00 0.00 46.19 44.26 2kc5 s LEU 85 CO 0.11 0.22 0.75 -1.58 0.23 0.00 0.00 176.35 176.08 2kc5 s GLN 86 N 0.05 4.34 0.05 1.70 -0.44 -1.26 -1.39 119.66 122.70 2kc5 s GLN 86 Ca -0.00 0.90 0.03 0.00 -2.50 0.00 0.00 55.36 53.79 2kc5 s GLN 86 Cb -0.13 -3.53 -0.02 0.00 -1.64 0.00 0.00 33.01 27.68 2kc5 s GLN 86 CO 0.03 -0.17 -0.10 -0.51 0.50 0.00 0.00 175.29 175.04 2kc5 s LEU 87 N 1.60 2.23 0.60 3.68 1.43 -1.25 -4.84 118.68 122.14 2kc5 s LEU 87 Ca 0.36 -0.52 0.31 0.00 -1.03 0.00 0.00 54.13 53.26 2kc5 s LEU 87 Cb -0.17 -0.34 1.86 0.00 0.03 0.00 0.00 46.19 47.57 2kc5 s LEU 87 CO 0.14 -0.11 2.23 -0.65 0.23 0.00 0.00 176.35 178.19 2kc5 h PRO 88 N 4.63 0.00 -0.19 1.29 0.11 -1.87 0.45 132.00 136.42 2kc5 h PRO 88 Ca -0.37 0.00 0.05 0.00 0.11 0.00 0.00 66.00 65.80 2kc5 h PRO 88 Cb 1.19 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.30 2kc5 h PRO 88 CO 0.42 0.00 0.14 -0.92 -0.21 0.00 0.00 178.00 177.43 2kc5 h TYR 89 N 0.00 0.00 0.00 0.65 3.20 -1.80 -3.48 116.97 115.54 2kc5 h TYR 89 Ca 0.02 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.89 2kc5 h TYR 89 Cb 0.12 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.39 2kc5 h TYR 89 CO 0.00 0.00 0.00 0.41 -1.64 0.00 0.00 178.16 176.93 2kc5 n GLY 90 N -1.56 4.39 3.72 1.82 0.00 0.15 -5.08 105.19 108.63 2kc5 n GLY 90 Ca 0.02 -1.22 -0.42 0.00 0.00 0.00 0.00 46.02 44.39 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 2.21 -0.11 2.61 2.01 -1.25 -3.76 115.64 116.14 2kc5 s THR 91 Ca 0.00 0.15 -0.09 0.00 0.31 0.00 0.00 61.69 62.07 2kc5 s THR 91 Cb 0.00 -3.10 0.03 0.00 0.01 0.00 0.00 72.50 69.45 2kc5 s THR 91 CO 0.00 0.01 0.28 -0.32 -0.69 0.00 0.00 174.62 173.90 2kc5 s MET 92 N 1.02 0.30 0.21 4.92 0.00 -0.48 -4.96 119.30 120.31 2kc5 s MET 92 Ca 0.72 0.45 -0.29 0.00 0.00 0.00 0.00 55.69 56.58 2kc5 s MET 92 Cb -0.48 0.08 -0.09 0.00 0.00 0.00 0.00 34.83 34.35 2kc5 s MET 92 CO 0.33 -0.08 0.90 0.95 0.00 0.00 0.00 175.02 177.12 2kc5 s THR 93 N 0.50 4.17 -0.08 10.11 -4.23 -1.26 -1.51 115.64 123.33 2kc5 s THR 93 Ca -0.03 1.98 0.01 0.00 -1.18 0.00 0.00 61.69 62.48 2kc5 s THR 93 Cb -0.04 -4.28 -0.02 0.00 1.34 0.00 0.00 72.50 69.49 2kc5 s THR 93 CO -0.03 0.50 -0.11 -0.36 -0.54 0.00 0.00 174.62 174.08 2kc5 s PHE 94 N -1.13 2.81 0.05 3.99 0.40 -0.16 -4.83 117.98 119.12 2kc5 s PHE 94 Ca 0.40 -0.24 -0.16 0.00 -0.60 0.00 0.00 56.93 56.33 2kc5 s PHE 94 Cb -0.25 -1.73 -0.06 0.00 0.51 0.00 0.00 43.02 41.49 2kc5 s PHE 94 CO 0.30 0.11 0.47 0.99 0.70 0.00 0.00 175.22 177.79 2kc5 s THR 95 N -0.40 4.93 0.06 0.64 2.01 0.15 -0.94 115.64 122.10 2kc5 s THR 95 Ca 0.05 0.92 -0.31 0.00 0.31 0.00 0.00 61.69 62.66 2kc5 s THR 95 Cb -0.12 -3.77 -0.06 0.00 0.01 0.00 0.00 72.50 68.56 2kc5 s THR 95 CO 0.02 0.51 1.27 -0.69 -0.69 0.00 0.00 174.62 175.04 2kc5 s VAL 96 N -1.16 3.83 0.26 3.82 1.01 0.45 -0.74 120.40 127.87 2kc5 s VAL 96 Ca 0.28 1.30 0.10 0.00 0.00 0.00 0.00 61.98 63.65 2kc5 s VAL 96 Cb -0.17 -3.83 -0.04 0.00 0.00 0.00 0.00 36.38 32.33 2kc5 s VAL 96 CO 0.16 0.08 -0.05 -0.83 0.00 0.00 0.00 175.10 174.47 2kc5 s GLY 97 N 1.18 1.70 -0.32 4.51 0.00 0.23 -0.81 107.32 113.82 2kc5 s GLY 97 Ca 0.61 -1.68 0.01 0.00 0.00 0.00 0.00 44.72 43.65 2kc5 s GLY 97 CO 0.29 -1.75 0.08 1.85 0.00 0.00 0.00 173.10 173.56 2kc5 s GLU 98 N -3.59 1.01 -0.18 2.90 2.12 -1.26 -1.70 118.70 118.00 2kc5 s GLU 98 Ca 0.31 -1.36 -0.29 0.00 0.36 0.00 0.00 54.97 53.99 2kc5 s GLU 98 Cb -0.06 -2.44 -0.00 0.00 0.26 0.00 0.00 34.13 31.88 2kc5 s GLU 98 CO 0.19 -0.96 1.07 -1.17 -0.54 0.00 0.00 175.26 173.85 2kc5 s LEU 99 N 1.35 4.16 0.20 2.70 2.96 -0.49 -4.96 118.68 124.61 2kc5 s LEU 99 Ca 0.10 1.49 -0.32 0.00 -0.22 0.00 0.00 54.13 55.18 2kc5 s LEU 99 Cb -0.18 -3.55 -0.12 0.00 0.50 0.00 0.00 46.19 42.85 2kc5 s LEU 99 CO -0.18 -0.62 1.69 -0.62 -1.32 0.00 0.00 176.35 175.30 2kc5 s ASP 100 N 1.29 6.42 0.00 3.68 2.15 -1.26 -1.18 116.67 127.77 2kc5 s ASP 100 Ca 0.47 2.81 0.00 0.00 0.43 0.00 0.00 52.55 56.27 2kc5 s ASP 100 Cb -0.17 -2.60 0.00 0.00 -0.30 0.00 0.00 42.92 39.85 2kc5 s ASP 100 CO 0.11 -0.94 0.00 0.61 -0.17 0.00 0.00 175.17 174.78 2kc5 n GLY 101 N 3.93 0.49 0.00 2.66 0.00 -1.26 -4.90 105.19 106.11 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 -2.40 0.00 -3.98 1.61 0.31 -0.32 -5.13 118.33 108.41 2kc5 n VAL 102 Ca 0.00 0.00 -0.11 0.00 -0.01 0.00 0.00 64.34 64.22 2kc5 n VAL 102 Cb 0.09 0.00 -0.03 0.00 -0.91 0.00 0.00 33.84 32.99 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 1.00 0.23 0.39 4.52 0.01 -1.16 -4.93 113.70 113.76 2kc5 s SER 103 Ca 0.00 -1.12 -0.24 0.00 1.31 0.00 0.00 55.95 55.90 2kc5 s SER 103 Cb 0.00 0.68 -0.09 0.00 0.21 0.00 0.00 66.02 66.82 2kc5 s SER 103 CO 0.00 -1.32 1.04 -1.10 0.41 0.00 0.00 173.24 172.27 2kc5 s GLN 104 N -3.36 4.20 0.23 12.44 -0.21 -1.26 -1.39 119.66 130.31 2kc5 s GLN 104 Ca 0.23 1.51 -0.18 0.00 0.02 0.00 0.00 55.36 56.94 2kc5 s GLN 104 Cb -0.02 -2.57 0.02 0.00 1.00 0.00 0.00 33.01 31.44 2kc5 s GLN 104 CO 0.13 -0.11 0.58 1.52 -2.12 0.00 0.00 175.29 175.29 2kc5 s TYR 105 N -1.65 -0.03 -0.08 0.91 1.13 -0.69 -4.82 117.35 112.12 2kc5 s TYR 105 Ca 0.57 -0.35 0.00 0.00 -1.41 0.00 0.00 57.07 55.88 2kc5 s TYR 105 Cb -0.22 0.44 -0.03 0.00 -1.10 0.00 0.00 41.96 41.06 2kc5 s TYR 105 CO 0.28 -1.03 -0.07 -0.51 -2.51 0.00 0.00 175.55 171.70 2kc5 s LEU 106 N -2.92 3.15 0.05 -3.49 1.02 0.06 -0.60 118.68 115.94 2kc5 s LEU 106 Ca 0.13 -0.06 0.02 0.00 0.02 0.00 0.00 54.13 54.24 2kc5 s LEU 106 Cb -0.02 -1.70 -0.03 0.00 0.02 0.00 0.00 46.19 44.46 2kc5 s LEU 106 CO 0.03 0.32 -0.07 -0.44 0.02 0.00 0.00 176.35 176.21 2kc5 s SER 107 N -0.56 0.78 -0.09 2.29 0.01 0.08 -0.34 113.70 115.87 2kc5 s SER 107 Ca 0.08 -0.64 -0.04 0.00 1.31 0.00 0.00 55.95 56.67 2kc5 s SER 107 Cb -0.12 0.06 0.05 0.00 0.21 0.00 0.00 66.02 66.23 2kc5 s SER 107 CO 0.02 -0.28 0.20 0.00 0.41 0.00 0.00 173.24 173.58 2kc5 s SER 109 N 1.88 6.13 -0.03 0.00 0.01 -1.26 -0.36 113.70 120.07 2kc5 s SER 109 Ca -0.02 2.65 -0.01 0.00 1.31 0.00 0.00 55.95 59.88 2kc5 s SER 109 Cb -0.12 -2.64 -0.02 0.00 0.21 0.00 0.00 66.02 63.46 2kc5 s SER 109 CO -0.07 -0.97 -0.04 0.18 0.41 0.00 0.00 173.24 172.75 2kc5 n LEU 110 N -0.10 0.81 -3.65 2.44 4.77 -0.05 -4.81 117.00 116.41 2kc5 n LEU 110 Ca 0.05 0.03 -0.09 0.00 -0.03 0.00 0.00 56.01 55.96 2kc5 n LEU 110 Cb 0.44 -0.10 -0.02 0.00 -2.33 0.00 0.00 43.42 41.41 2kc5 n LEU 110 CO 0.55 0.17 0.44 0.00 -1.33 0.00 0.00 177.39 177.22 2kc5 s MET 111 N -2.06 1.54 -0.43 3.23 0.23 -0.90 -5.01 119.30 115.91 2kc5 s MET 111 Ca -0.04 -0.74 0.04 0.00 -1.03 0.00 0.00 55.69 53.91 2kc5 s MET 111 Cb 0.02 0.60 0.11 0.00 -1.53 0.00 0.00 34.83 34.03 2kc5 s MET 111 CO 0.06 -0.69 0.16 -1.12 -2.03 0.00 0.00 175.02 171.39 2kc5 s SER 112 N -2.84 4.61 0.00 -1.18 0.01 -1.26 -0.68 113.70 112.36 2kc5 s SER 112 Ca 0.06 -2.54 0.00 0.00 1.31 0.00 0.00 55.95 54.78 2kc5 s SER 112 Cb -0.04 -1.65 0.00 0.00 0.21 0.00 0.00 66.02 64.55 2kc5 s SER 112 CO -0.03 -0.32 0.13 -0.81 0.41 0.00 0.00 173.24 172.62 2kc5 n PRO 113 N 3.76 0.00 -3.68 12.44 -0.04 -1.26 -4.93 135.00 141.29 2kc5 n PRO 113 Ca 0.04 0.44 -0.27 0.00 -0.04 0.00 0.00 63.50 63.67 2kc5 n PRO 113 Cb 0.38 -1.00 -0.02 0.00 -0.04 0.00 0.00 33.50 32.81 2kc5 n PRO 113 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 2kc5 n LEU 114 N -1.81 -1.27 -4.79 1.53 7.94 -0.77 -4.93 117.00 112.90 2kc5 n LEU 114 Ca 0.00 -0.59 -0.35 0.00 -1.11 0.00 0.00 56.01 53.96 2kc5 n LEU 114 Cb 0.00 -1.89 -0.04 0.00 0.53 0.00 0.00 43.42 42.02 2kc5 n LEU 114 CO 0.00 0.16 0.72 -0.44 -1.11 0.00 0.00 177.39 176.72 2kc5 s SER 115 N -2.86 6.52 0.37 1.96 0.01 -1.26 -4.97 113.70 113.47 2kc5 s SER 115 Ca 0.52 1.96 0.20 0.00 1.31 0.00 0.00 55.95 59.93 2kc5 s SER 115 Cb -0.28 -2.57 0.35 0.00 0.21 0.00 0.00 66.02 63.73 2kc5 s SER 115 CO 0.63 -0.66 1.58 0.45 0.41 0.00 0.00 173.24 175.66 2kc5 h HIS 116 N 1.92 0.00 0.00 2.43 -0.00 -2.01 -2.94 115.15 114.54 2kc5 h HIS 116 Ca -0.49 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 59.88 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 0.57 0.28 0.00 0.43 -0.00 0.00 0.00 177.93 179.22 2kc5 n SER 117 N -3.21 0.00 -4.77 2.45 7.64 -1.26 -4.88 113.62 109.59 2kc5 n SER 117 Ca 0.02 -0.86 -0.40 0.00 1.01 0.00 0.00 58.87 58.64 2kc5 n SER 117 Cb 0.60 -0.01 0.01 0.00 -1.01 0.00 0.00 64.21 63.81 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 -2.01 3.81 0.05 1.43 0.00 -1.11 -5.02 119.30 116.44 2kc5 s MET 118 Ca 0.42 2.45 -0.05 0.00 0.00 0.00 0.00 55.69 58.52 2kc5 s MET 118 Cb 0.19 -2.74 -0.02 0.00 0.00 0.00 0.00 34.83 32.26 2kc5 s MET 118 CO 0.33 -0.73 0.08 -1.12 0.00 0.00 0.00 175.02 173.57 2kc5 s SER 119 N -0.42 0.26 0.54 1.11 0.01 -1.26 -5.03 113.70 108.92 2kc5 s SER 119 Ca 0.59 -0.71 0.28 0.00 1.31 0.00 0.00 55.95 57.42 2kc5 s SER 119 Cb -0.44 0.24 1.55 0.00 0.21 0.00 0.00 66.02 67.58 2kc5 s SER 119 CO 0.58 -0.59 2.12 0.40 0.41 0.00 0.00 173.24 176.16 2kc5 h ILE 120 N 3.31 0.55 -0.42 1.44 5.03 -1.96 -0.18 117.51 125.28 2kc5 h ILE 120 Ca -0.33 -0.40 -0.10 0.00 -0.12 0.00 0.00 64.86 63.90 2kc5 h ILE 120 Cb 1.18 1.26 -0.02 0.00 -3.03 0.00 0.00 36.82 36.21 2kc5 h ILE 120 CO 0.56 0.09 -0.16 -0.33 -0.68 0.00 0.00 178.15 177.63 2kc5 h GLU 121 N 0.00 0.79 -0.07 2.37 5.08 -1.99 -1.89 114.58 118.87 2kc5 h GLU 121 Ca -0.00 -0.28 -0.11 0.00 -1.00 0.00 0.00 59.36 57.96 2kc5 h GLU 121 Cb 0.25 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.44 2kc5 h GLU 121 CO 0.01 0.89 -0.47 0.93 -1.00 0.00 0.00 179.01 179.38 2kc5 h GLU 122 N 0.70 0.16 -0.93 2.33 4.39 -1.49 0.92 114.58 120.66 2kc5 h GLU 122 Ca 0.11 -0.09 0.18 0.00 0.34 0.00 0.00 59.36 59.91 2kc5 h GLU 122 Cb 0.65 0.00 -0.08 0.00 -0.10 0.00 0.00 28.75 29.23 2kc5 h GLU 122 CO 0.05 0.60 0.60 0.78 -1.16 0.00 0.00 179.01 179.88 2kc5 h GLY 123 N 1.34 1.21 0.00 -3.84 0.00 -0.39 0.10 103.07 101.50 2kc5 h GLY 123 Ca 0.01 -0.27 -0.08 0.00 0.00 0.00 0.00 47.33 46.99 2kc5 h GLY 123 CO 0.07 0.01 -0.50 1.46 0.00 0.00 0.00 176.54 177.57 2kc5 h GLN 124 N 0.59 0.00 -0.56 4.80 4.20 -0.84 -3.37 115.11 119.92 2kc5 h GLN 124 Ca 0.50 0.00 -0.08 0.00 0.06 0.00 0.00 58.65 59.12 2kc5 h GLN 124 Cb 0.98 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.74 2kc5 h GLN 124 CO -0.24 0.76 0.01 -0.09 -0.67 0.00 0.00 178.83 178.61 2kc5 h ARG 125 N -1.00 0.94 0.02 1.46 2.43 -0.52 -2.41 114.38 115.31 2kc5 h ARG 125 Ca -0.12 -0.27 -0.21 0.00 -0.81 0.00 0.00 59.98 58.56 2kc5 h ARG 125 Cb 0.93 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 30.35 2kc5 h ARG 125 CO -0.08 0.92 -0.98 1.25 -1.51 0.00 0.00 179.97 179.58 2kc5 h LEU 126 N 0.87 0.11 -0.40 3.80 6.46 -1.04 0.36 115.31 125.47 2kc5 h LEU 126 Ca 0.16 -0.11 -0.09 0.00 -0.12 0.00 0.00 57.88 57.73 2kc5 h LEU 126 Cb 0.49 -0.03 -0.01 0.00 -0.73 0.00 0.00 40.66 40.38 2kc5 h LEU 126 CO 0.02 1.02 -0.10 0.74 -0.62 0.00 0.00 178.44 179.51 2kc5 h THR 127 N 0.03 1.27 -0.51 1.05 2.02 -1.68 0.19 112.91 115.29 2kc5 h THR 127 Ca -0.04 -1.19 -0.09 0.00 0.77 0.00 0.00 66.41 65.86 2kc5 h THR 127 Cb 1.69 1.22 -0.02 0.00 -1.74 0.00 0.00 68.15 69.30 2kc5 h THR 127 CO 0.14 0.40 -0.05 -0.78 0.37 0.00 0.00 175.52 175.60 2kc5 h ASP 128 N 0.59 0.93 0.55 4.18 3.58 -1.37 -0.24 116.42 124.65 2kc5 h ASP 128 Ca 0.10 -0.33 -0.13 0.00 0.42 0.00 0.00 57.03 57.09 2kc5 h ASP 128 Cb 0.62 -0.25 -0.02 0.00 1.72 0.00 0.00 39.33 41.41 2kc5 h ASP 128 CO 0.04 1.04 -0.60 -0.78 -2.88 0.00 0.00 179.24 176.06 2kc5 h ASP 129 N 0.80 0.05 -0.29 2.28 3.58 -0.76 -0.54 116.42 121.54 2kc5 h ASP 129 Ca 0.14 -0.03 -0.11 0.00 0.42 0.00 0.00 57.03 57.45 2kc5 h ASP 129 Cb 0.59 -0.02 -0.01 0.00 1.72 0.00 0.00 39.33 41.62 2kc5 h ASP 129 CO 0.04 0.64 -0.23 0.00 -2.88 0.00 0.00 179.24 176.80 2kc5 h ALA 131 N 0.72 0.22 -0.34 0.00 0.00 -0.76 -1.23 119.26 117.87 2kc5 h ALA 131 Ca 0.05 0.11 -0.10 0.00 0.00 0.00 0.00 54.91 54.97 2kc5 h ALA 131 Cb 0.79 0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.78 2kc5 h ALA 131 CO 0.06 -0.45 -0.18 -0.09 0.00 0.00 0.00 179.25 178.59 2kc5 h ARG 132 N 0.02 0.73 -0.31 0.00 2.43 -1.01 -1.44 114.38 114.81 2kc5 h ARG 132 Ca 0.14 -0.33 0.06 0.00 -0.81 0.00 0.00 59.98 59.05 2kc5 h ARG 132 Cb 0.21 -0.02 -0.08 0.00 -0.42 0.00 0.00 29.97 29.66 2kc5 h ARG 132 CO -0.29 0.93 -0.40 1.98 -1.51 0.00 0.00 179.97 180.68 2kc5 h MET 133 N 0.51 -0.35 0.00 0.20 4.05 -0.65 -1.07 114.93 117.62 2kc5 h MET 133 Ca 0.08 0.02 0.00 0.00 -0.28 0.00 0.00 59.70 59.52 2kc5 h MET 133 Cb 0.72 0.08 0.00 0.00 -0.80 0.00 0.00 31.60 31.60 2kc5 h MET 133 CO 0.05 -0.23 0.00 0.44 0.23 0.00 0.00 176.91 177.40 2kc5 n ILE 134 N -5.42 0.10 0.00 1.77 -5.35 -0.48 -3.45 119.36 106.53 2kc5 n ILE 134 Ca -0.01 0.02 0.00 0.00 -0.27 0.00 0.00 62.75 62.49 2kc5 n ILE 134 Cb 0.35 -0.57 0.00 0.00 -1.74 0.00 0.00 39.64 37.68 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 -1.30 1.38 -0.02 7.28 7.94 -0.55 -4.54 117.00 127.19 2kc5 n LEU 135 Ca 0.13 0.08 0.00 0.00 -1.11 0.00 0.00 56.01 55.10 2kc5 n LEU 135 Cb 0.23 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.18 2kc5 n LEU 135 CO 0.22 0.00 0.06 -1.20 -1.11 0.00 0.00 177.39 175.36 2kc5 n SER 136 N -0.31 0.00 -4.19 1.96 7.64 -0.88 -3.81 113.62 114.04 2kc5 n SER 136 Ca 0.00 -1.01 -0.33 0.00 1.01 0.00 0.00 58.87 58.55 2kc5 n SER 136 Cb 0.00 -0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.14 2kc5 n SER 136 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 2kc5 n LEU 137 N 0.00 -1.14 -4.70 -3.43 7.94 -0.47 -4.89 117.00 110.32 2kc5 n LEU 137 Ca 0.00 -1.22 -0.34 0.00 -1.11 0.00 0.00 56.01 53.34 2kc5 n LEU 137 Cb 0.50 -1.74 0.12 0.00 0.53 0.00 0.00 43.42 42.83 2kc5 n LEU 137 CO 0.00 0.52 0.79 -2.16 -1.11 0.00 0.00 177.39 175.44 2kc5 s PRO 138 N -7.20 1.80 -0.01 1.96 0.04 -1.26 -5.03 135.00 125.31 2kc5 s PRO 138 Ca 0.10 1.81 0.03 0.00 0.04 0.00 0.00 61.00 62.97 2kc5 s PRO 138 Cb -0.05 -1.79 -0.01 0.00 0.04 0.00 0.00 34.50 32.69 2kc5 s PRO 138 CO 0.97 -2.10 -0.08 0.08 0.04 0.00 0.00 177.00 175.91 2kc5 s VAL 139 N -2.02 0.64 0.21 -0.36 1.01 -1.26 -5.07 120.40 113.55 2kc5 s VAL 139 Ca 0.75 -0.36 -0.31 0.00 0.00 0.00 0.00 61.98 62.06 2kc5 s VAL 139 Cb -0.30 -0.54 -0.10 0.00 0.00 0.00 0.00 36.38 35.44 2kc5 s VAL 139 CO 0.49 0.17 1.50 -0.89 0.00 0.00 0.00 175.10 176.37 2kc5 s THR 140 N -0.21 2.64 -0.20 3.92 2.01 -1.26 -5.01 115.64 117.51 2kc5 s THR 140 Ca 0.03 0.49 -0.06 0.00 0.31 0.00 0.00 61.69 62.46 2kc5 s THR 140 Cb -0.03 -3.32 0.10 0.00 0.01 0.00 0.00 72.50 69.26 2kc5 s THR 140 CO -0.00 0.06 0.42 0.21 -0.69 0.00 0.00 174.62 174.61 2kc5 s ASN 141 N 0.75 -0.21 0.38 3.53 2.47 -1.26 -5.15 114.94 115.45 2kc5 s ASN 141 Ca 0.65 0.90 -0.28 0.00 0.42 0.00 0.00 52.86 54.55 2kc5 s ASN 141 Cb -0.43 1.33 -0.11 0.00 -1.45 0.00 0.00 41.25 40.60 2kc5 s ASN 141 CO 0.38 -0.24 1.50 -2.84 -3.72 0.00 0.00 177.10 172.17 2kc5 s PRO 142 N 2.61 4.08 -0.19 0.43 0.02 -1.26 -5.03 135.00 135.66 2kc5 s PRO 142 Ca 0.00 2.59 -0.20 0.00 0.02 0.00 0.00 61.00 63.41 2kc5 s PRO 142 Cb -0.12 -2.95 0.05 0.00 0.02 0.00 0.00 34.50 31.50 2kc5 s PRO 142 CO -0.13 -0.57 0.56 0.34 -0.33 0.00 0.00 177.00 176.87 2kc5 s ASP 143 N -0.13 -0.57 -0.14 2.53 2.15 -1.26 -5.18 116.67 114.08 2kc5 s ASP 143 Ca 0.53 1.03 -0.11 0.00 0.43 0.00 0.00 52.55 54.43 2kc5 s ASP 143 Cb -0.47 1.05 0.04 0.00 -0.30 0.00 0.00 42.92 43.24 2kc5 s ASP 143 CO 0.64 -0.24 0.35 0.54 -0.17 0.00 0.00 175.17 176.29 2kc5 s VAL 144 N 0.08 -0.01 -0.35 1.11 0.11 -1.26 -5.10 120.40 114.98 2kc5 s VAL 144 Ca -0.02 0.02 -0.38 0.00 -2.93 0.00 0.00 61.98 58.67 2kc5 s VAL 144 Cb -0.04 -0.50 -0.14 0.00 -1.53 0.00 0.00 36.38 34.17 2kc5 s VAL 144 CO 0.02 0.01 2.04 -2.65 -3.33 0.00 0.00 175.10 171.19 2kc5 n PRO 145 N 3.19 0.92 -1.92 1.54 -0.02 -1.26 -2.33 135.00 135.12 2kc5 n PRO 145 Ca -0.15 0.29 -0.10 0.00 -2.02 0.00 0.00 63.50 61.51 2kc5 n PRO 145 Cb 0.57 -2.18 -0.02 0.00 -0.02 0.00 0.00 33.50 31.84 2kc5 n PRO 145 CO 0.00 0.00 0.00 1.58 1.98 0.00 0.00 175.50 179.06 2kc5 n HIS 146 N 8.00 -1.05 -2.93 6.00 -0.00 -1.26 -1.00 115.22 122.99 2kc5 n HIS 146 Ca 0.39 0.00 -0.16 0.00 0.46 0.00 0.00 57.72 58.41 2kc5 n HIS 146 Cb 0.15 -2.37 -0.01 0.00 -0.12 0.00 0.00 29.99 27.64 2kc5 n HIS 146 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 2kc5 n ALA 147 N -1.14 -0.96 -1.88 1.57 0.00 -0.99 -4.94 120.51 112.18 2kc5 n ALA 147 Ca -0.11 0.06 -0.41 0.00 0.00 0.00 0.00 53.44 52.97 2kc5 n ALA 147 Cb 0.48 -1.88 -0.02 0.00 0.00 0.00 0.00 19.45 18.02 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 -2.36 2.52 0.03 0.00 0.00 -0.17 -5.03 107.32 102.30 2kc5 s GLY 148 Ca 0.20 1.27 0.01 0.00 0.00 0.00 0.00 44.72 46.20 2kc5 s GLY 148 CO 0.25 2.15 -0.05 0.50 0.00 0.00 0.00 173.10 175.95 2kc5 s ARG 149 N -0.68 0.41 0.16 2.90 0.52 -1.26 -4.90 118.95 116.11 2kc5 s ARG 149 Ca 0.56 -0.71 -0.05 0.00 -0.52 0.00 0.00 55.73 55.00 2kc5 s ARG 149 Cb -0.40 -0.02 0.02 0.00 0.52 0.00 0.00 34.95 35.07 2kc5 s ARG 149 CO 0.45 -0.02 1.44 0.00 0.02 0.00 0.00 175.30 177.18 2kc5 h ARG 150 N 4.47 0.60 -6.40 3.54 3.08 -2.05 -3.47 114.38 114.15 2kc5 h ARG 150 Ca -0.33 -0.43 -0.50 0.00 0.07 0.00 0.00 59.98 58.79 2kc5 h ARG 150 Cb 1.20 0.07 -0.14 0.00 0.08 0.00 0.00 29.97 31.18 2kc5 h ARG 150 CO 0.43 1.05 -0.76 0.00 -1.07 0.00 0.00 179.97 179.62 2kc5 n ALA 151 N -2.54 -1.22 -1.67 0.04 0.00 -1.26 -4.96 120.51 108.90 2kc5 n ALA 151 Ca -0.04 0.07 -0.29 0.00 0.00 0.00 0.00 53.44 53.17 2kc5 n ALA 151 Cb 0.66 -3.65 0.10 0.00 0.00 0.00 0.00 19.45 16.56 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 -7.13 2.43 -0.07 0.00 2.34 -1.26 -5.10 118.68 109.89 2kc5 s LEU 152 Ca 0.67 1.06 0.03 0.00 0.06 0.00 0.00 54.13 55.95 2kc5 s LEU 152 Cb -0.36 -3.58 0.01 0.00 -0.56 0.00 0.00 46.19 41.70 2kc5 s LEU 152 CO 0.82 -2.06 -0.17 -0.22 -1.06 0.00 0.00 176.35 173.67 2kc5 s LEU 153 N -5.76 1.82 0.57 1.48 2.96 -1.26 -5.14 118.68 113.34 2kc5 s LEU 153 Ca 0.62 -0.38 -0.16 0.00 -0.22 0.00 0.00 54.13 53.98 2kc5 s LEU 153 Cb -0.13 -1.02 -0.05 0.00 0.50 0.00 0.00 46.19 45.48 2kc5 s LEU 153 CO 0.52 0.09 1.03 -0.36 -1.32 0.00 0.00 176.35 176.32 2kc5 s PHE 154 N 0.46 3.14 1.11 5.38 0.08 -1.26 -5.07 117.98 121.82 2kc5 s PHE 154 Ca -0.14 1.50 -0.18 0.00 0.12 0.00 0.00 56.93 58.23 2kc5 s PHE 154 Cb -0.16 -2.94 0.25 0.00 -0.57 0.00 0.00 43.02 39.61 2kc5 s PHE 154 CO 0.05 -0.87 1.19 0.20 -0.10 0.00 0.00 175.22 175.68 2kc5 s GLY 155 N -2.87 1.65 -0.01 4.36 0.00 -1.26 -5.11 107.32 104.09 2kc5 s GLY 155 Ca 0.62 -1.03 0.02 0.00 0.00 0.00 0.00 44.72 44.33 2kc5 s GLY 155 CO 0.35 -0.19 -0.05 1.09 0.00 0.00 0.00 173.10 174.29 2kc5 s ARG 156 N -5.58 0.50 0.09 2.90 1.70 -1.26 -5.05 118.95 112.24 2kc5 s ARG 156 Ca 0.72 -0.17 -0.04 0.00 -0.47 0.00 0.00 55.73 55.76 2kc5 s ARG 156 Cb -0.08 -0.50 -0.25 0.00 -0.57 0.00 0.00 34.95 33.55 2kc5 s ARG 156 CO 0.55 0.08 1.17 -0.09 -1.08 0.00 0.00 175.30 175.93 2kc5 h ARG 157 N 6.23 0.28 -6.42 3.89 2.43 -2.08 -3.45 114.38 115.26 2kc5 h ARG 157 Ca -0.30 -0.45 -0.54 0.00 -0.81 0.00 0.00 59.98 57.88 2kc5 h ARG 157 Cb 1.18 0.16 -0.00 0.00 -0.42 0.00 0.00 29.97 30.89 2kc5 h ARG 157 CO 0.50 1.20 0.66 -1.12 -1.51 0.00 0.00 179.97 179.69 2kc5 s SER 158 N -7.13 7.02 0.00 -3.80 0.01 -1.26 -4.96 113.70 103.58 2kc5 s SER 158 Ca -0.04 1.99 0.00 0.00 1.31 0.00 0.00 55.95 59.21 2kc5 s SER 158 Cb 0.07 -2.57 0.00 0.00 0.21 0.00 0.00 66.02 63.73 2kc5 s SER 158 CO 0.88 -0.56 0.00 0.61 0.41 0.00 0.00 173.24 174.58 2kc5 n GLY 159 N 3.35 1.95 3.88 3.44 0.00 -1.26 -5.18 105.19 111.37 2kc5 n GLY 159 Ca 0.10 -0.24 -0.30 0.00 0.00 0.00 0.00 46.02 45.59 2kc5 n GLY 159 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2kc5 s GLU 160 N -1.63 3.74 -0.02 1.61 0.41 -1.26 -5.11 118.70 116.44 2kc5 s GLU 160 Ca 0.00 0.35 -0.09 0.00 -0.41 0.00 0.00 54.97 54.82 2kc5 s GLU 160 Cb 0.00 -2.45 0.01 0.00 -1.78 0.00 0.00 34.13 29.91 2kc5 s GLU 160 CO 0.00 0.02 0.19 1.21 -0.49 0.00 0.00 175.26 176.19 2kc5 s ASN 161 N -3.18 -0.08 0.00 -0.19 2.47 -1.26 -5.30 114.94 107.40 2kc5 s ASN 161 Ca 0.49 0.01 0.00 0.00 0.42 0.00 0.00 52.86 53.79 2kc5 s ASN 161 Cb -0.10 0.29 0.00 0.00 -1.45 0.00 0.00 41.25 39.98 2kc5 s ASN 161 CO 0.31 -0.31 0.00 0.00 -3.72 0.00 0.00 177.10 173.38