#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kc5 h THR 2 N 0.00 0.28 -3.32 1.12 1.35 -2.03 -3.46 112.91 106.84 2kc5 h THR 2 Ca 0.00 -1.42 -0.57 0.00 -0.55 0.00 0.00 66.41 63.88 2kc5 h THR 2 Cb 0.00 2.03 -0.06 0.00 -1.73 0.00 0.00 68.15 68.40 2kc5 h THR 2 CO 0.00 0.16 -0.00 -1.61 -0.25 0.00 0.00 175.52 173.81 2kc5 s GLU 3 N -3.14 4.35 0.16 4.72 0.41 -1.26 -5.02 118.70 118.91 2kc5 s GLU 3 Ca 0.04 0.74 -0.10 0.00 -0.41 0.00 0.00 54.97 55.24 2kc5 s GLU 3 Cb 0.07 -3.37 -0.00 0.00 -1.78 0.00 0.00 34.13 29.04 2kc5 s GLU 3 CO 0.72 0.29 0.31 -1.21 -0.49 0.00 0.00 175.26 174.88 2kc5 s GLU 4 N 0.09 1.15 -0.14 1.61 2.02 -1.26 -1.34 118.70 120.83 2kc5 s GLU 4 Ca 0.32 -1.09 0.02 0.00 0.02 0.00 0.00 54.97 54.24 2kc5 s GLU 4 Cb -0.18 0.40 0.01 0.00 0.10 0.00 0.00 34.13 34.45 2kc5 s GLU 4 CO 0.17 -0.43 -0.21 0.42 0.02 0.00 0.00 175.26 175.23 2kc5 s ILE 5 N -3.94 2.16 0.37 -1.63 -1.09 0.41 -4.49 121.20 113.00 2kc5 s ILE 5 Ca 0.14 -0.95 -0.25 0.00 -2.23 0.00 0.00 60.65 57.36 2kc5 s ILE 5 Cb 0.03 -1.86 -0.09 0.00 -1.58 0.00 0.00 42.46 38.95 2kc5 s ILE 5 CO -0.02 0.55 1.02 0.00 -1.23 0.00 0.00 174.94 175.26 2kc5 s ALA 6 N 0.73 3.14 0.52 9.38 0.00 -1.26 -1.56 121.76 132.71 2kc5 s ALA 6 Ca -0.09 0.65 -0.22 0.00 0.00 0.00 0.00 51.96 52.30 2kc5 s ALA 6 Cb -0.16 -3.25 -0.06 0.00 0.00 0.00 0.00 23.12 19.66 2kc5 s ALA 6 CO 0.00 -0.09 1.31 0.20 0.00 0.00 0.00 175.76 177.19 2kc5 s GLY 7 N -1.55 2.86 0.07 0.00 0.00 0.54 -4.91 107.32 104.32 2kc5 s GLY 7 Ca 0.55 1.24 -0.19 0.00 0.00 0.00 0.00 44.72 46.32 2kc5 s GLY 7 CO 0.27 1.74 0.56 -1.36 0.00 0.00 0.00 173.10 174.31 2kc5 s PHE 8 N -1.36 3.80 0.14 1.90 0.40 -0.13 -4.59 117.98 118.14 2kc5 s PHE 8 Ca 0.69 1.25 -0.09 0.00 -0.60 0.00 0.00 56.93 58.18 2kc5 s PHE 8 Cb -0.38 -2.49 -0.03 0.00 0.51 0.00 0.00 43.02 40.63 2kc5 s PHE 8 CO 0.45 0.59 1.43 1.96 0.70 0.00 0.00 175.22 180.34 2kc5 h GLN 9 N 4.58 0.78 -3.36 0.44 7.50 -1.87 -2.75 115.11 120.45 2kc5 h GLN 9 Ca -0.50 -0.51 -0.02 0.00 0.50 0.00 0.00 58.65 58.13 2kc5 h GLN 9 Cb 1.21 0.06 -0.09 0.00 0.05 0.00 0.00 27.48 28.71 2kc5 h GLN 9 CO 0.63 1.13 0.01 0.95 -1.50 0.00 0.00 178.83 180.06 2kc5 s THR 10 N -4.07 0.02 0.36 -0.54 -4.23 -1.26 -4.77 115.64 101.15 2kc5 s THR 10 Ca -0.10 -0.94 -0.27 0.00 -1.18 0.00 0.00 61.69 59.20 2kc5 s THR 10 Cb 0.10 -1.74 -0.12 0.00 1.34 0.00 0.00 72.50 72.08 2kc5 s THR 10 CO 0.88 -0.09 1.18 -1.20 -0.54 0.00 0.00 174.62 174.84 2kc5 n SER 11 N -0.36 2.15 -2.07 3.99 7.64 -1.26 -4.87 113.62 118.84 2kc5 n SER 11 Ca -0.08 1.16 -0.09 0.00 1.01 0.00 0.00 58.87 60.87 2kc5 n SER 11 Cb 0.62 -1.42 -0.13 0.00 -1.01 0.00 0.00 64.21 62.27 2kc5 n SER 11 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 2kc5 n PRO 12 N 0.45 1.54 -0.19 1.43 -0.04 -1.26 -4.71 135.00 132.21 2kc5 n PRO 12 Ca 0.07 -0.75 -0.01 0.00 -0.04 0.00 0.00 63.50 62.77 2kc5 n PRO 12 Cb 0.36 -1.85 0.09 0.00 -0.04 0.00 0.00 33.50 32.06 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 3.49 0.36 -0.63 0.54 3.64 -1.97 -0.71 116.57 121.29 2kc5 h LYS 13 Ca 0.14 -0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 59.46 2kc5 h LYS 13 Cb 1.18 -0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 32.89 2kc5 h LYS 13 CO 0.27 0.24 0.24 0.00 -2.27 0.00 0.00 179.45 177.92 2kc5 h ALA 14 N 1.39 0.83 -0.26 5.00 0.00 -1.97 -1.08 119.26 123.17 2kc5 h ALA 14 Ca 0.28 -0.18 -0.19 0.00 0.00 0.00 0.00 54.91 54.81 2kc5 h ALA 14 Cb 0.34 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.88 2kc5 h ALA 14 CO -0.29 0.46 -0.59 1.96 0.00 0.00 0.00 179.25 180.79 2kc5 h GLN 15 N 0.90 0.85 -0.49 0.00 7.50 -1.62 0.65 115.11 122.90 2kc5 h GLN 15 Ca 0.21 -0.57 0.03 0.00 0.50 0.00 0.00 58.65 58.81 2kc5 h GLN 15 Cb 0.23 0.08 -0.04 0.00 0.05 0.00 0.00 27.48 27.81 2kc5 h GLN 15 CO -0.01 1.20 0.27 0.28 -1.50 0.00 0.00 178.83 179.07 2kc5 h VAL 16 N 0.63 1.01 0.37 -0.54 2.07 -1.08 -0.89 116.25 117.82 2kc5 h VAL 16 Ca -0.00 -0.19 -0.02 0.00 0.82 0.00 0.00 66.70 67.32 2kc5 h VAL 16 Cb 1.21 0.43 0.00 0.00 -1.52 0.00 0.00 31.29 31.41 2kc5 h VAL 16 CO 0.13 0.10 -0.18 -0.61 0.02 0.00 0.00 177.57 177.03 2kc5 h GLN 17 N 0.54 -0.48 -0.64 1.57 4.15 -0.70 -1.07 115.11 118.47 2kc5 h GLN 17 Ca 0.20 0.03 -0.08 0.00 0.77 0.00 0.00 58.65 59.58 2kc5 h GLN 17 Cb 0.06 0.11 -0.03 0.00 0.21 0.00 0.00 27.48 27.83 2kc5 h GLN 17 CO -0.11 -0.28 0.10 0.00 -1.93 0.00 0.00 178.83 176.60 2kc5 h ALA 18 N 0.06 0.97 -0.20 3.38 0.00 -0.79 0.97 119.26 123.64 2kc5 h ALA 18 Ca -0.05 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.58 2kc5 h ALA 18 Cb 0.42 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 2kc5 h ALA 18 CO 0.08 0.65 0.08 0.00 0.00 0.00 0.00 179.25 180.06 2kc5 h ALA 19 N 1.12 0.26 0.00 0.00 0.00 -1.11 -2.59 119.26 116.94 2kc5 h ALA 19 Ca 0.20 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 2kc5 h ALA 19 Cb 0.43 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 2kc5 h ALA 19 CO 0.01 -0.15 -0.24 0.74 0.00 0.00 0.00 179.25 179.62 2kc5 h PHE 20 N 0.16 0.00 -0.64 0.00 0.04 -0.78 -0.03 116.94 115.69 2kc5 h PHE 20 Ca 0.07 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.81 2kc5 h PHE 20 Cb 0.18 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.30 2kc5 h PHE 20 CO -0.01 0.24 0.30 1.49 -0.60 0.00 0.00 178.31 179.72 2kc5 h GLU 21 N 0.00 0.92 0.12 1.51 4.22 -0.56 0.14 114.58 120.93 2kc5 h GLU 21 Ca -0.00 -0.13 -0.17 0.00 0.08 0.00 0.00 59.36 59.14 2kc5 h GLU 21 Cb 0.72 -0.17 0.02 0.00 0.50 0.00 0.00 28.75 29.81 2kc5 h GLU 21 CO 0.03 0.72 -0.75 1.49 -2.18 0.00 0.00 179.01 178.32 2kc5 h GLU 22 N 0.91 0.26 -0.17 1.92 4.57 -0.95 -3.11 114.58 118.01 2kc5 h GLU 22 Ca 0.22 -0.44 -0.02 0.00 -1.18 0.00 0.00 59.36 57.94 2kc5 h GLU 22 Cb 0.11 0.16 -0.01 0.00 -0.16 0.00 0.00 28.75 28.86 2kc5 h GLU 22 CO -0.03 1.21 0.01 0.82 -1.18 0.00 0.00 179.01 179.84 2kc5 h ILE 23 N -0.45 1.11 0.00 2.32 2.04 -0.97 0.51 117.51 122.07 2kc5 h ILE 23 Ca -0.14 -0.40 -0.05 0.00 1.00 0.00 0.00 64.86 65.28 2kc5 h ILE 23 Cb 1.57 0.97 -0.01 0.00 -0.74 0.00 0.00 36.82 38.61 2kc5 h ILE 23 CO 0.12 0.13 -0.23 0.00 0.00 0.00 0.00 178.15 178.17 2kc5 h ALA 24 N 1.78 1.08 0.18 1.87 0.00 -1.02 -3.13 119.26 120.02 2kc5 h ALA 24 Ca 0.06 -0.21 -0.31 0.00 0.00 0.00 0.00 54.91 54.45 2kc5 h ALA 24 Cb 0.15 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 17.92 2kc5 h ALA 24 CO 0.00 0.29 -1.48 -0.09 0.00 0.00 0.00 179.25 177.98 2kc5 h ARG 25 N 0.00 0.37 -6.32 0.00 2.43 -0.95 -3.42 114.38 106.50 2kc5 h ARG 25 Ca -0.00 -0.64 -0.54 0.00 -0.81 0.00 0.00 59.98 57.99 2kc5 h ARG 25 Cb 0.68 0.24 0.02 0.00 -0.42 0.00 0.00 29.97 30.49 2kc5 h ARG 25 CO 0.03 1.31 1.26 0.54 -1.51 0.00 0.00 179.97 181.60 2kc5 n ARG 26 N -3.78 2.76 -3.44 0.20 3.00 -0.02 -3.82 116.66 111.56 2kc5 n ARG 26 Ca -0.22 0.99 -0.05 0.00 -0.01 0.00 0.00 57.85 58.57 2kc5 n ARG 26 Cb 1.00 -3.02 -0.06 0.00 0.00 0.00 0.00 32.46 30.37 2kc5 n ARG 26 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.63 176.51 2kc5 s SER 27 N 4.85 -0.48 0.78 0.55 0.01 -1.26 -4.93 113.70 113.22 2kc5 s SER 27 Ca 0.90 0.80 -0.09 0.00 1.31 0.00 0.00 55.95 58.87 2kc5 s SER 27 Cb -0.43 1.60 0.10 0.00 0.21 0.00 0.00 66.02 67.50 2kc5 s SER 27 CO 0.42 -0.26 1.11 -0.32 0.41 0.00 0.00 173.24 174.60 2kc5 s MET 28 N 2.69 1.79 1.95 12.44 1.75 -1.26 -2.81 119.30 135.84 2kc5 s MET 28 Ca 0.08 -0.28 0.00 0.00 -1.25 0.00 0.00 55.69 54.24 2kc5 s MET 28 Cb -0.14 -2.07 0.00 0.00 2.84 0.00 0.00 34.83 35.46 2kc5 s MET 28 CO -0.17 -1.57 0.00 1.58 -0.65 0.00 0.00 175.02 174.21 2kc5 n HIS 29 N -3.17 -1.75 0.23 4.11 -0.00 -1.26 -4.06 115.22 109.31 2kc5 n HIS 29 Ca 0.10 0.00 0.03 0.00 -0.00 0.00 0.00 57.72 57.85 2kc5 n HIS 29 Cb 0.60 0.25 0.13 0.00 -0.00 0.00 0.00 29.99 30.97 2kc5 n HIS 29 CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 176.34 172.87 2kc5 n ASP 30 N -2.41 0.00 0.19 0.26 2.03 -1.26 -1.42 116.55 113.94 2kc5 n ASP 30 Ca 0.00 0.39 0.06 0.00 0.52 0.00 0.00 54.79 55.77 2kc5 n ASP 30 Cb 0.00 -0.42 0.55 0.00 -0.72 0.00 0.00 41.12 40.52 2kc5 n ASP 30 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 2kc5 h LEU 31 N 0.00 0.12 -0.63 -2.67 -0.00 -1.89 -3.49 115.31 106.74 2kc5 h LEU 31 Ca 0.00 -0.01 0.25 0.00 -0.00 0.00 0.00 57.88 58.12 2kc5 h LEU 31 Cb 0.08 -0.03 -0.14 0.00 -0.00 0.00 0.00 40.66 40.58 2kc5 h LEU 31 CO 0.00 0.14 -1.14 -1.20 -0.00 0.00 0.00 178.44 176.23 2kc5 n SER 32 N -4.46 -7.55 -2.88 -0.43 7.64 -0.51 -4.57 113.62 100.86 2kc5 n SER 32 Ca -0.01 1.49 -0.30 0.00 1.01 0.00 0.00 58.87 61.05 2kc5 n SER 32 Cb 0.13 -4.72 -0.07 0.00 -1.01 0.00 0.00 64.21 58.54 2kc5 n SER 32 CO 0.00 0.00 0.00 2.22 -3.01 0.00 0.00 175.04 174.25 2kc5 n PHE 33 N -3.81 1.65 -1.82 1.43 -1.74 -1.12 -4.50 117.46 107.54 2kc5 n PHE 33 Ca -0.07 -2.51 -0.37 0.00 -0.56 0.00 0.00 57.45 53.94 2kc5 n PHE 33 Cb 0.60 -2.08 0.06 0.00 1.52 0.00 0.00 39.48 39.58 2kc5 n PHE 33 CO 0.00 0.00 0.00 -0.51 -0.56 0.00 0.00 176.76 175.69 2kc5 s LEU 34 N -0.30 3.62 0.77 5.98 1.43 -1.25 -4.80 118.68 124.13 2kc5 s LEU 34 Ca 0.67 2.57 -0.12 0.00 -1.03 0.00 0.00 54.13 56.22 2kc5 s LEU 34 Cb 0.24 -4.58 0.06 0.00 0.03 0.00 0.00 46.19 41.93 2kc5 s LEU 34 CO -0.06 -1.86 1.13 -1.38 0.23 0.00 0.00 176.35 174.41 2kc5 s HIS 35 N -1.44 2.29 0.40 0.29 -3.43 -1.26 -4.48 115.29 107.66 2kc5 s HIS 35 Ca 0.80 1.61 0.16 0.00 -0.80 0.00 0.00 55.06 56.83 2kc5 s HIS 35 Cb -0.36 -3.21 0.93 0.00 -1.43 0.00 0.00 32.58 28.51 2kc5 s HIS 35 CO 0.38 -2.13 1.92 -1.35 -2.00 0.00 0.00 174.74 171.57 2kc5 h PRO 36 N -0.86 0.00 -0.06 -0.38 0.11 -1.88 -3.47 132.00 125.46 2kc5 h PRO 36 Ca -0.45 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.64 2kc5 h PRO 36 Cb 1.25 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.35 2kc5 h PRO 36 CO 0.50 0.27 -0.02 0.43 -0.21 0.00 0.00 178.00 178.96 2kc5 n SER 37 N -4.09 -5.96 -3.28 -2.05 7.64 -1.26 -4.87 113.62 99.75 2kc5 n SER 37 Ca -0.02 0.03 -0.03 0.00 1.01 0.00 0.00 58.87 59.86 2kc5 n SER 37 Cb 0.33 -3.57 -0.05 0.00 -1.01 0.00 0.00 64.21 59.91 2kc5 n SER 37 CO 0.00 0.00 0.00 -0.32 -3.01 0.00 0.00 175.04 171.71 2kc5 s MET 38 N -2.09 0.46 -0.05 1.43 -2.45 -1.26 -5.06 119.30 110.27 2kc5 s MET 38 Ca 0.00 0.80 -0.34 0.00 -1.25 0.00 0.00 55.69 54.90 2kc5 s MET 38 Cb 0.00 0.07 -0.12 0.00 1.25 0.00 0.00 34.83 36.03 2kc5 s MET 38 CO 0.00 -0.61 1.85 -2.30 1.05 0.00 0.00 175.02 175.02 2kc5 n PRO 39 N 5.40 2.23 -2.04 4.11 -0.02 -1.26 -4.49 135.00 138.93 2kc5 n PRO 39 Ca -0.03 0.82 -0.37 0.00 -2.02 0.00 0.00 63.50 61.90 2kc5 n PRO 39 Cb 0.50 -2.66 0.02 0.00 -0.02 0.00 0.00 33.50 31.34 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 3.72 2.65 0.05 -1.45 -7.23 -1.26 -4.89 120.40 112.00 2kc5 s VAL 40 Ca 0.91 0.44 -0.05 0.00 -1.81 0.00 0.00 61.98 61.48 2kc5 s VAL 40 Cb -0.67 -3.20 -0.02 0.00 0.56 0.00 0.00 36.38 33.05 2kc5 s VAL 40 CO 0.49 -0.05 0.07 -0.47 -0.31 0.00 0.00 175.10 174.83 2kc5 s TYR 41 N -1.52 0.30 -0.03 2.82 5.04 -0.50 -4.98 117.35 118.48 2kc5 s TYR 41 Ca 0.72 -0.72 -0.00 0.00 -2.44 0.00 0.00 57.07 54.63 2kc5 s TYR 41 Cb -0.32 -0.21 0.03 0.00 0.35 0.00 0.00 41.96 41.81 2kc5 s TYR 41 CO 0.36 -0.41 0.03 0.08 -1.34 0.00 0.00 175.55 174.27 2kc5 s VAL 42 N -3.34 0.03 0.28 3.14 1.01 -1.26 -0.79 120.40 119.47 2kc5 s VAL 42 Ca 0.01 0.23 -0.11 0.00 0.00 0.00 0.00 61.98 62.11 2kc5 s VAL 42 Cb 0.03 -0.19 -0.08 0.00 0.00 0.00 0.00 36.38 36.15 2kc5 s VAL 42 CO -0.08 0.14 0.62 -0.94 0.00 0.00 0.00 175.10 174.85 2kc5 s SER 43 N 1.41 6.65 -0.04 3.32 1.04 0.42 -4.95 113.70 121.56 2kc5 s SER 43 Ca -0.05 1.03 0.02 0.00 0.48 0.00 0.00 55.95 57.44 2kc5 s SER 43 Cb -0.13 -2.27 0.01 0.00 0.10 0.00 0.00 66.02 63.73 2kc5 s SER 43 CO -0.03 -0.15 -0.08 -0.62 0.98 0.00 0.00 173.24 173.35 2kc5 s ASP 44 N -2.45 1.17 -0.22 7.02 2.15 -1.26 -2.29 116.67 120.79 2kc5 s ASP 44 Ca 0.50 -0.18 -0.28 0.00 0.43 0.00 0.00 52.55 53.02 2kc5 s ASP 44 Cb -0.11 -0.44 0.13 0.00 -0.30 0.00 0.00 42.92 42.20 2kc5 s ASP 44 CO 0.21 0.02 1.07 0.72 -0.17 0.00 0.00 175.17 177.02 2kc5 s PHE 45 N 0.52 -0.36 0.53 -5.34 -0.71 -0.38 -4.97 117.98 107.27 2kc5 s PHE 45 Ca -0.08 0.74 0.00 0.00 -1.04 0.00 0.00 56.93 56.55 2kc5 s PHE 45 Cb -0.12 0.42 0.00 0.00 -1.21 0.00 0.00 43.02 42.12 2kc5 s PHE 45 CO 0.01 -0.26 0.00 2.41 -1.34 0.00 0.00 175.22 176.04 2kc5 n THR 46 N 1.30 -0.45 -2.79 -4.49 -1.04 -1.26 -1.73 114.28 103.82 2kc5 n THR 46 Ca -0.10 0.69 -0.30 0.00 -2.04 0.00 0.00 64.05 62.30 2kc5 n THR 46 Cb 0.57 -1.15 -0.02 0.00 -1.82 0.00 0.00 70.33 67.91 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 -4.25 5.13 -4.75 -4.42 7.94 -1.26 -1.71 117.00 113.68 2kc5 n LEU 47 Ca -0.06 -5.54 -0.41 0.00 -1.11 0.00 0.00 56.01 48.88 2kc5 n LEU 47 Cb 0.67 -0.67 -0.03 0.00 0.53 0.00 0.00 43.42 43.91 2kc5 n LEU 47 CO 0.03 2.27 0.88 0.12 -1.11 0.00 0.00 177.39 179.58 2kc5 s PHE 48 N -3.66 3.39 -1.60 1.96 5.36 -0.05 -2.12 117.98 121.27 2kc5 s PHE 48 Ca 0.47 1.48 0.00 0.00 -0.96 0.00 0.00 56.93 57.92 2kc5 s PHE 48 Cb 0.29 -3.45 0.00 0.00 -0.34 0.00 0.00 43.02 39.52 2kc5 s PHE 48 CO -0.15 -1.19 0.00 0.39 -1.46 0.00 0.00 175.22 172.80 2kc5 n GLU 49 N 1.86 -1.53 -1.18 10.12 -0.58 -1.26 -0.88 120.64 127.19 2kc5 n GLU 49 Ca 0.02 0.89 -0.04 0.00 -0.42 0.00 0.00 57.16 57.61 2kc5 n GLU 49 Cb 0.44 -5.28 -0.02 0.00 -0.57 0.00 0.00 31.44 26.01 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 -0.47 0.67 2.99 0.62 0.00 -0.90 -5.02 105.19 103.09 2kc5 n GLY 50 Ca -0.17 -0.87 -0.15 0.00 0.00 0.00 0.00 46.02 44.83 2kc5 n GLY 50 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2kc5 s GLN 51 N -2.46 0.47 0.25 1.61 -0.21 -0.05 -3.05 119.66 116.22 2kc5 s GLN 51 Ca 0.00 -0.37 -0.30 0.00 0.02 0.00 0.00 55.36 54.71 2kc5 s GLN 51 Cb 0.00 -0.39 -0.10 0.00 1.00 0.00 0.00 33.01 33.52 2kc5 s GLN 51 CO 0.00 0.10 1.42 -1.58 -2.12 0.00 0.00 175.29 173.11 2kc5 s TRP 52 N -0.52 3.03 0.25 0.91 0.52 0.53 -0.87 118.94 122.80 2kc5 s TRP 52 Ca -0.02 1.07 0.06 0.00 0.02 0.00 0.00 56.10 57.24 2kc5 s TRP 52 Cb -0.05 -3.80 -0.03 0.00 -1.15 0.00 0.00 33.47 28.45 2kc5 s TRP 52 CO 0.00 -2.55 0.27 0.99 0.02 0.00 0.00 176.95 175.68 2kc5 s THR 53 N -0.09 4.82 0.08 2.01 2.01 -0.70 -1.29 115.64 122.48 2kc5 s THR 53 Ca 0.58 -1.21 -0.27 0.00 0.31 0.00 0.00 61.69 61.10 2kc5 s THR 53 Cb -0.41 -3.61 0.08 0.00 0.01 0.00 0.00 72.50 68.57 2kc5 s THR 53 CO 0.44 -0.34 1.05 -0.83 -0.69 0.00 0.00 174.62 174.25 2kc5 s GLY 54 N -3.91 -0.30 0.03 4.40 0.00 0.16 -1.25 107.32 106.44 2kc5 s GLY 54 Ca 0.34 0.40 0.02 0.00 0.00 0.00 0.00 44.72 45.47 2kc5 s GLY 54 CO 0.27 0.08 -0.07 0.00 0.00 0.00 0.00 173.10 173.38 2kc5 s VAL 56 N -0.98 3.49 0.00 0.00 0.11 0.32 -0.43 120.40 122.92 2kc5 s VAL 56 Ca -0.06 -0.79 0.07 0.00 -2.93 0.00 0.00 61.98 58.26 2kc5 s VAL 56 Cb -0.07 -2.49 -0.02 0.00 -1.53 0.00 0.00 36.38 32.26 2kc5 s VAL 56 CO 0.00 0.42 -0.21 -0.51 -3.33 0.00 0.00 175.10 171.47 2kc5 s ILE 57 N -0.95 1.69 0.29 7.04 -1.16 0.03 -1.28 121.20 126.85 2kc5 s ILE 57 Ca 0.16 -1.01 0.03 0.00 -0.51 0.00 0.00 60.65 59.31 2kc5 s ILE 57 Cb -0.11 -1.42 -0.04 0.00 0.61 0.00 0.00 42.46 41.50 2kc5 s ILE 57 CO 0.06 0.39 0.16 0.42 -2.81 0.00 0.00 174.94 173.16 2kc5 s THR 58 N -0.60 0.26 0.48 4.00 -4.23 0.27 -1.41 115.64 114.42 2kc5 s THR 58 Ca 0.08 -2.00 0.26 0.00 -1.18 0.00 0.00 61.69 58.85 2kc5 s THR 58 Cb -0.08 -2.52 0.30 0.00 1.34 0.00 0.00 72.50 71.54 2kc5 s THR 58 CO 0.00 0.00 2.13 1.55 -0.54 0.00 0.00 174.62 177.76 2kc5 h PRO 59 N 2.29 0.00 0.00 3.99 0.13 -1.90 -3.25 132.00 133.26 2kc5 h PRO 59 Ca -0.33 0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 64.59 2kc5 h PRO 59 Cb 1.25 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.34 2kc5 h PRO 59 CO 0.51 0.08 -1.73 -2.67 -0.23 0.00 0.00 178.00 173.97 2kc5 n TRP 60 N -3.81 0.66 -3.91 1.56 4.27 -1.26 -4.48 117.44 110.47 2kc5 n TRP 60 Ca -0.02 0.22 -0.08 0.00 -3.89 0.00 0.00 57.50 53.73 2kc5 n TRP 60 Cb 0.18 -1.02 -0.03 0.00 -1.36 0.00 0.00 31.31 29.08 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 -2.86 1.71 -0.04 -2.67 0.23 -1.23 -4.48 119.30 109.97 2kc5 s MET 61 Ca -0.05 -1.10 0.00 0.00 -1.03 0.00 0.00 55.69 53.51 2kc5 s MET 61 Cb 0.09 0.56 0.03 0.00 -1.53 0.00 0.00 34.83 33.97 2kc5 s MET 61 CO 0.83 -0.76 0.00 -1.17 -2.03 0.00 0.00 175.02 171.89 2kc5 s LEU 62 N -2.96 1.03 -0.01 0.18 0.20 0.06 -0.56 118.68 116.61 2kc5 s LEU 62 Ca 0.15 -0.03 -0.01 0.00 0.69 0.00 0.00 54.13 54.94 2kc5 s LEU 62 Cb -0.04 -0.25 0.01 0.00 -0.43 0.00 0.00 46.19 45.48 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 1.21 -0.01 0.45 3.68 0.01 -0.41 -0.49 113.70 118.14 2kc5 s SER 63 Ca -0.07 0.06 -0.23 0.00 1.31 0.00 0.00 55.95 57.02 2kc5 s SER 63 Cb -0.13 0.03 -0.08 0.00 0.21 0.00 0.00 66.02 66.05 2kc5 s SER 63 CO -0.02 -0.04 1.12 0.00 0.41 0.00 0.00 173.24 174.71 2kc5 s ALA 64 N 0.28 2.98 0.01 1.44 0.00 -0.24 -0.52 121.76 125.71 2kc5 s ALA 64 Ca -0.02 0.84 0.01 0.00 0.00 0.00 0.00 51.96 52.78 2kc5 s ALA 64 Cb -0.03 -3.34 -0.01 0.00 0.00 0.00 0.00 23.12 19.74 2kc5 s ALA 64 CO -0.01 -0.52 -0.03 0.14 0.00 0.00 0.00 175.76 175.34 2kc5 s VAL 65 N -1.62 0.20 -0.03 0.00 -7.23 -0.07 -1.63 120.40 110.03 2kc5 s VAL 65 Ca 0.63 -0.46 -0.04 0.00 -1.81 0.00 0.00 61.98 60.31 2kc5 s VAL 65 Cb -0.26 -0.24 0.01 0.00 0.56 0.00 0.00 36.38 36.45 2kc5 s VAL 65 CO 0.31 -0.16 0.09 -0.63 -0.31 0.00 0.00 175.10 174.40 2kc5 s ILE 66 N -0.62 0.02 -0.04 -0.62 1.01 0.10 -0.67 121.20 120.38 2kc5 s ILE 66 Ca -0.05 -0.15 0.03 0.00 0.00 0.00 0.00 60.65 60.47 2kc5 s ILE 66 Cb -0.05 -0.18 0.01 0.00 0.01 0.00 0.00 42.46 42.25 2kc5 s ILE 66 CO -0.00 -0.08 -0.11 -0.36 0.00 0.00 0.00 174.94 174.38 2kc5 s PHE 67 N -0.23 1.21 0.23 3.97 0.08 -0.41 -0.97 117.98 121.85 2kc5 s PHE 67 Ca -0.03 -0.35 -0.30 0.00 0.12 0.00 0.00 56.93 56.37 2kc5 s PHE 67 Cb -0.02 -0.87 -0.15 0.00 -0.57 0.00 0.00 43.02 41.41 2kc5 s PHE 67 CO 0.00 -0.16 1.00 -2.30 -0.10 0.00 0.00 175.22 173.66 2kc5 n PRO 68 N 3.45 1.07 -1.22 0.24 -0.02 -1.26 -0.34 135.00 136.91 2kc5 n PRO 68 Ca -0.20 0.38 -0.30 0.00 -2.02 0.00 0.00 63.50 61.36 2kc5 n PRO 68 Cb 0.53 -1.75 0.24 0.00 -0.02 0.00 0.00 33.50 32.51 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 -0.41 1.63 0.43 -1.23 0.00 -1.17 -0.96 107.32 105.61 2kc5 s GLY 69 Ca 0.65 -1.08 -0.24 0.00 0.00 0.00 0.00 44.72 44.05 2kc5 s GLY 69 CO 0.56 -0.17 1.18 2.56 0.00 0.00 0.00 173.10 177.23 2kc5 s PRO 70 N -5.56 3.90 -1.18 2.90 0.04 -1.04 -2.88 135.00 131.18 2kc5 s PRO 70 Ca 0.72 1.84 -0.15 0.00 0.04 0.00 0.00 61.00 63.45 2kc5 s PRO 70 Cb -0.07 -2.55 -0.01 0.00 0.04 0.00 0.00 34.50 31.90 2kc5 s PRO 70 CO 0.55 -0.45 0.74 -3.47 0.04 0.00 0.00 177.00 174.42 2kc5 n ASP 71 N -0.19 -4.34 -4.20 6.66 2.03 -1.26 -4.95 116.55 110.29 2kc5 n ASP 71 Ca 0.06 -0.98 -0.21 0.00 0.52 0.00 0.00 54.79 54.18 2kc5 n ASP 71 Cb 0.47 -3.50 -0.12 0.00 -0.72 0.00 0.00 41.12 37.24 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 -5.97 0.95 -0.60 -0.67 -0.21 -1.25 -4.97 119.66 106.95 2kc5 s GLN 72 Ca 0.37 -0.97 0.04 0.00 0.02 0.00 0.00 55.36 54.82 2kc5 s GLN 72 Cb -0.13 -1.03 0.16 0.00 1.00 0.00 0.00 33.01 33.01 2kc5 s GLN 72 CO 0.85 0.24 0.40 -0.51 -2.12 0.00 0.00 175.29 174.15 2kc5 s LEU 73 N -1.64 3.94 0.58 2.90 2.01 -1.26 -0.34 118.68 124.87 2kc5 s LEU 73 Ca 0.01 -3.44 -0.19 0.00 0.01 0.00 0.00 54.13 50.53 2kc5 s LEU 73 Cb -0.10 -1.38 -0.04 0.00 0.01 0.00 0.00 46.19 44.69 2kc5 s LEU 73 CO 0.03 -0.14 1.14 0.26 1.01 0.00 0.00 176.35 178.64 2kc5 s TRP 74 N -0.80 2.59 0.71 0.29 0.23 -0.60 -4.87 118.94 116.48 2kc5 s TRP 74 Ca 0.24 1.54 -0.14 0.00 -2.03 0.00 0.00 56.10 55.71 2kc5 s TRP 74 Cb -0.09 -3.31 0.03 0.00 0.03 0.00 0.00 33.47 30.12 2kc5 s TRP 74 CO -0.12 -1.74 1.15 -1.25 0.96 0.00 0.00 176.95 175.95 2kc5 s PRO 75 N -3.44 2.40 0.16 4.98 0.04 -1.26 -0.44 135.00 137.44 2kc5 s PRO 75 Ca 0.73 1.53 -0.31 0.00 0.04 0.00 0.00 61.00 62.98 2kc5 s PRO 75 Cb -0.25 -1.89 -0.10 0.00 0.04 0.00 0.00 34.50 32.30 2kc5 s PRO 75 CO 0.31 -1.58 1.60 -1.17 0.04 0.00 0.00 177.00 176.20 2kc5 s LEU 76 N -5.14 4.37 0.31 -3.56 2.96 -0.45 -4.18 118.68 112.99 2kc5 s LEU 76 Ca 0.69 2.63 0.07 0.00 -0.22 0.00 0.00 54.13 57.30 2kc5 s LEU 76 Cb -0.24 -3.59 -0.03 0.00 0.50 0.00 0.00 46.19 42.84 2kc5 s LEU 76 CO 0.45 -0.85 0.30 -0.13 -1.32 0.00 0.00 176.35 174.80 2kc5 s ARG 77 N 1.38 2.90 0.39 1.98 1.81 -1.26 -4.91 118.95 121.23 2kc5 s ARG 77 Ca 0.71 -1.14 -0.06 0.00 -1.72 0.00 0.00 55.73 53.52 2kc5 s ARG 77 Cb -0.44 -2.59 -0.05 0.00 -0.45 0.00 0.00 34.95 31.43 2kc5 s ARG 77 CO 0.32 0.20 0.68 0.21 -0.68 0.00 0.00 175.30 176.02 2kc5 s LYS 78 N -3.98 3.62 0.37 3.54 2.47 -1.26 -5.07 119.74 119.42 2kc5 s LYS 78 Ca 0.39 0.13 -0.11 0.00 -1.56 0.00 0.00 55.97 54.82 2kc5 s LYS 78 Cb -0.07 -2.50 -0.07 0.00 -1.46 0.00 0.00 37.83 33.73 2kc5 s LYS 78 CO 0.27 0.01 0.74 0.08 0.16 0.00 0.00 175.35 176.61 2kc5 s VAL 79 N -2.40 4.77 -0.29 4.02 1.01 -1.26 -3.55 120.40 122.71 2kc5 s VAL 79 Ca 0.46 0.67 0.00 0.00 0.00 0.00 0.00 61.98 63.11 2kc5 s VAL 79 Cb -0.10 -3.70 0.00 0.00 0.00 0.00 0.00 36.38 32.58 2kc5 s VAL 79 CO 0.36 -0.41 0.00 -1.20 0.00 0.00 0.00 175.10 173.85 2kc5 n SER 80 N -1.01 -5.06 -4.81 3.32 7.64 0.27 -4.98 113.62 108.98 2kc5 n SER 80 Ca 0.02 0.07 -0.32 0.00 1.01 0.00 0.00 58.87 59.66 2kc5 n SER 80 Cb 0.54 -2.80 0.04 0.00 -1.01 0.00 0.00 64.21 60.97 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 -1.76 3.08 -0.04 1.43 2.02 -1.23 -4.78 118.70 117.42 2kc5 s GLU 81 Ca 0.00 1.04 0.03 0.00 0.02 0.00 0.00 54.97 56.05 2kc5 s GLU 81 Cb 0.00 -2.01 -0.03 0.00 0.10 0.00 0.00 34.13 32.19 2kc5 s GLU 81 CO 0.00 -0.99 -0.10 0.15 0.02 0.00 0.00 175.26 174.34 2kc5 s LYS 82 N -4.71 2.58 -0.15 1.61 1.02 -1.26 -0.27 119.74 118.56 2kc5 s LYS 82 Ca 0.60 -0.66 0.02 0.00 0.02 0.00 0.00 55.97 55.95 2kc5 s LYS 82 Cb -0.15 -2.47 0.01 0.00 -0.52 0.00 0.00 37.83 34.71 2kc5 s LYS 82 CO 0.49 0.63 -0.21 0.42 -0.92 0.00 0.00 175.35 175.76 2kc5 s ILE 83 N -0.82 2.02 -0.13 2.17 -1.09 -0.13 -4.96 121.20 118.26 2kc5 s ILE 83 Ca 0.13 -0.95 -0.29 0.00 -2.23 0.00 0.00 60.65 57.31 2kc5 s ILE 83 Cb -0.11 -1.80 -0.02 0.00 -1.58 0.00 0.00 42.46 38.96 2kc5 s ILE 83 CO 0.02 0.54 1.20 -0.83 -1.23 0.00 0.00 174.94 174.65 2kc5 s GLY 84 N 0.93 1.83 -0.00 6.18 0.00 -1.26 -0.83 107.32 114.17 2kc5 s GLY 84 Ca -0.04 0.47 0.04 0.00 0.00 0.00 0.00 44.72 45.19 2kc5 s GLY 84 CO -0.04 2.34 -0.12 1.08 0.00 0.00 0.00 173.10 176.36 2kc5 s LEU 85 N 2.97 2.89 -0.18 0.66 1.43 -0.45 -4.97 118.68 121.03 2kc5 s LEU 85 Ca 0.54 -0.23 -0.15 0.00 -1.03 0.00 0.00 54.13 53.25 2kc5 s LEU 85 Cb -0.22 -1.65 -0.04 0.00 0.03 0.00 0.00 46.19 44.31 2kc5 s LEU 85 CO 0.16 0.30 0.36 -1.58 0.23 0.00 0.00 176.35 175.81 2kc5 s GLN 86 N -1.21 4.22 0.07 1.70 -0.44 -1.26 -1.17 119.66 121.56 2kc5 s GLN 86 Ca 0.15 0.16 0.02 0.00 -2.50 0.00 0.00 55.36 53.19 2kc5 s GLN 86 Cb -0.11 -3.49 -0.03 0.00 -1.64 0.00 0.00 33.01 27.74 2kc5 s GLN 86 CO 0.05 0.08 -0.08 -0.51 0.50 0.00 0.00 175.29 175.33 2kc5 s LEU 87 N 0.93 2.36 0.58 3.68 1.02 -1.22 -4.81 118.68 121.22 2kc5 s LEU 87 Ca 0.18 -0.73 0.35 0.00 0.02 0.00 0.00 54.13 53.95 2kc5 s LEU 87 Cb -0.14 -0.15 1.78 0.00 0.02 0.00 0.00 46.19 47.70 2kc5 s LEU 87 CO 0.07 -0.30 2.16 -0.65 0.02 0.00 0.00 176.35 177.64 2kc5 h PRO 88 N 3.88 0.00 -0.05 1.29 0.11 -1.81 -0.11 132.00 135.31 2kc5 h PRO 88 Ca -0.36 0.00 0.01 0.00 0.11 0.00 0.00 66.00 65.76 2kc5 h PRO 88 Cb 1.19 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.30 2kc5 h PRO 88 CO 0.50 0.04 0.08 -0.92 -0.21 0.00 0.00 178.00 177.49 2kc5 h TYR 89 N 0.00 0.00 0.00 0.65 3.20 -1.84 -3.48 116.97 115.50 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 0.26 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.53 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 -1.27 4.06 3.72 1.82 0.00 -0.06 -5.06 105.19 108.41 2kc5 n GLY 90 Ca -0.02 -1.45 -0.42 0.00 0.00 0.00 0.00 46.02 44.13 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 -1.83 2.43 -0.06 2.61 2.01 -1.25 -3.43 115.64 116.11 2kc5 s THR 91 Ca 0.00 0.32 -0.06 0.00 0.31 0.00 0.00 61.69 62.27 2kc5 s THR 91 Cb 0.00 -3.21 0.02 0.00 0.01 0.00 0.00 72.50 69.32 2kc5 s THR 91 CO 0.00 0.03 0.17 -0.32 -0.69 0.00 0.00 174.62 173.81 2kc5 s MET 92 N 0.86 0.19 0.02 4.92 0.00 -0.32 -4.96 119.30 120.01 2kc5 s MET 92 Ca 0.70 0.26 -0.29 0.00 0.00 0.00 0.00 55.69 56.35 2kc5 s MET 92 Cb -0.45 0.06 -0.04 0.00 0.00 0.00 0.00 34.83 34.40 2kc5 s MET 92 CO 0.34 -0.04 0.95 0.95 0.00 0.00 0.00 175.02 177.22 2kc5 s THR 93 N 0.23 4.81 -0.16 10.11 -4.23 -1.26 -1.34 115.64 123.79 2kc5 s THR 93 Ca -0.01 2.01 -0.06 0.00 -1.18 0.00 0.00 61.69 62.45 2kc5 s THR 93 Cb -0.02 -4.30 -0.04 0.00 1.34 0.00 0.00 72.50 69.48 2kc5 s THR 93 CO -0.01 0.20 0.05 -0.36 -0.54 0.00 0.00 174.62 173.96 2kc5 s PHE 94 N 0.79 3.24 0.13 3.99 0.40 -0.01 -4.82 117.98 121.70 2kc5 s PHE 94 Ca 0.50 0.07 -0.24 0.00 -0.60 0.00 0.00 56.93 56.66 2kc5 s PHE 94 Cb -0.21 -2.02 -0.07 0.00 0.51 0.00 0.00 43.02 41.22 2kc5 s PHE 94 CO 0.28 0.21 0.73 0.99 0.70 0.00 0.00 175.22 178.12 2kc5 s THR 95 N 0.14 4.49 -0.34 0.64 2.01 0.62 -0.96 115.64 122.24 2kc5 s THR 95 Ca 0.04 1.59 -0.29 0.00 0.31 0.00 0.00 61.69 63.35 2kc5 s THR 95 Cb -0.12 -4.09 -0.01 0.00 0.01 0.00 0.00 72.50 68.29 2kc5 s THR 95 CO 0.01 0.51 1.63 -0.69 -0.69 0.00 0.00 174.62 175.38 2kc5 s VAL 96 N -0.99 3.67 0.27 3.82 1.01 0.63 -0.87 120.40 127.94 2kc5 s VAL 96 Ca 0.35 0.70 -0.02 0.00 0.00 0.00 0.00 61.98 63.00 2kc5 s VAL 96 Cb -0.22 -3.86 -0.04 0.00 0.00 0.00 0.00 36.38 32.26 2kc5 s VAL 96 CO 0.24 -0.51 0.50 -0.83 0.00 0.00 0.00 175.10 174.50 2kc5 s GLY 97 N 4.97 1.71 -0.07 4.51 0.00 0.26 -0.56 107.32 118.14 2kc5 s GLY 97 Ca 0.72 -0.73 -0.01 0.00 0.00 0.00 0.00 44.72 44.70 2kc5 s GLY 97 CO 0.32 -0.65 -0.02 1.85 0.00 0.00 0.00 173.10 174.60 2kc5 s GLU 98 N -3.66 0.77 -0.01 2.90 2.12 -1.26 -1.62 118.70 117.94 2kc5 s GLU 98 Ca 0.41 0.01 -0.03 0.00 0.36 0.00 0.00 54.97 55.72 2kc5 s GLU 98 Cb -0.11 -1.01 -0.00 0.00 0.26 0.00 0.00 34.13 33.27 2kc5 s GLU 98 CO 0.31 -0.25 0.07 -1.17 -0.54 0.00 0.00 175.26 173.68 2kc5 s LEU 99 N 1.69 1.81 0.23 2.70 2.96 -0.86 -4.99 118.68 122.22 2kc5 s LEU 99 Ca 0.01 -0.13 -0.32 0.00 -0.22 0.00 0.00 54.13 53.47 2kc5 s LEU 99 Cb -0.13 0.34 -0.12 0.00 0.50 0.00 0.00 46.19 46.78 2kc5 s LEU 99 CO -0.04 -0.20 1.64 -0.67 -1.32 0.00 0.00 176.35 175.75 2kc5 n ASP 100 N 2.18 3.72 0.00 3.68 2.03 -1.26 -0.64 116.55 126.25 2kc5 n ASP 100 Ca -0.19 1.10 0.00 0.00 0.52 0.00 0.00 54.79 56.22 2kc5 n ASP 100 Cb 0.57 -1.55 0.00 0.00 -0.72 0.00 0.00 41.12 39.42 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 3.15 0.64 0.00 0.27 0.00 -1.26 -4.72 105.19 103.27 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 -2.02 0.00 -4.99 1.61 0.31 -0.59 -4.82 118.33 107.82 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 0.01 -0.50 0.00 0.00 -0.91 0.00 0.00 33.84 32.43 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 -1.69 -0.15 -4.74 4.52 7.64 0.18 -4.68 113.62 114.70 2kc5 n SER 103 Ca 0.00 0.00 -0.41 0.00 1.01 0.00 0.00 58.87 59.47 2kc5 n SER 103 Cb 0.32 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.47 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 4.71 0.21 1.43 -0.21 -1.26 -2.03 119.66 122.51 2kc5 s GLN 104 Ca 0.00 1.58 -0.14 0.00 0.02 0.00 0.00 55.36 56.82 2kc5 s GLN 104 Cb 0.00 -3.30 0.01 0.00 1.00 0.00 0.00 33.01 30.72 2kc5 s GLN 104 CO 0.00 0.27 0.45 1.52 -2.12 0.00 0.00 175.29 175.41 2kc5 s TYR 105 N -0.58 0.17 -0.17 0.91 1.13 -0.64 -4.87 117.35 113.31 2kc5 s TYR 105 Ca 0.45 -0.53 0.00 0.00 -1.41 0.00 0.00 57.07 55.59 2kc5 s TYR 105 Cb -0.27 0.22 0.01 0.00 -1.10 0.00 0.00 41.96 40.82 2kc5 s TYR 105 CO 0.33 -0.90 -0.17 -0.51 -2.51 0.00 0.00 175.55 171.79 2kc5 s LEU 106 N -2.95 2.33 0.06 -3.49 1.02 -0.15 -0.57 118.68 114.94 2kc5 s LEU 106 Ca 0.16 -0.56 -0.05 0.00 0.02 0.00 0.00 54.13 53.70 2kc5 s LEU 106 Cb 0.00 -1.53 -0.02 0.00 0.02 0.00 0.00 46.19 44.66 2kc5 s LEU 106 CO 0.02 0.03 0.09 -0.44 0.02 0.00 0.00 176.35 176.08 2kc5 s SER 107 N 1.11 0.25 -0.12 2.29 0.01 -0.05 0.01 113.70 117.20 2kc5 s SER 107 Ca 0.00 -0.72 -0.12 0.00 1.31 0.00 0.00 55.95 56.42 2kc5 s SER 107 Cb -0.14 0.26 0.03 0.00 0.21 0.00 0.00 66.02 66.38 2kc5 s SER 107 CO -0.06 -0.62 0.34 0.00 0.41 0.00 0.00 173.24 173.31 2kc5 s SER 109 N 0.12 6.77 -0.17 0.00 0.01 -1.26 -1.08 113.70 118.09 2kc5 s SER 109 Ca -0.01 2.64 -0.07 0.00 1.31 0.00 0.00 55.95 59.82 2kc5 s SER 109 Cb -0.02 -2.64 -0.08 0.00 0.21 0.00 0.00 66.02 63.49 2kc5 s SER 109 CO 0.01 -0.56 -0.21 0.18 0.41 0.00 0.00 173.24 173.07 2kc5 n LEU 110 N 1.36 1.47 -3.81 2.44 4.77 0.35 -4.87 117.00 118.71 2kc5 n LEU 110 Ca 0.02 0.16 -0.05 0.00 -0.03 0.00 0.00 56.01 56.11 2kc5 n LEU 110 Cb 0.42 -0.51 -0.01 0.00 -2.33 0.00 0.00 43.42 40.99 2kc5 n LEU 110 CO 0.59 0.42 0.64 0.00 -1.33 0.00 0.00 177.39 177.71 2kc5 s MET 111 N -2.31 1.53 -0.30 3.23 0.23 -1.06 -5.02 119.30 115.59 2kc5 s MET 111 Ca -0.23 -0.89 -0.04 0.00 -1.03 0.00 0.00 55.69 53.50 2kc5 s MET 111 Cb 0.09 0.49 0.04 0.00 -1.53 0.00 0.00 34.83 33.91 2kc5 s MET 111 CO 0.31 -0.70 0.04 -1.12 -2.03 0.00 0.00 175.02 171.51 2kc5 s SER 112 N -3.02 4.98 -1.49 -1.18 0.01 -1.26 -0.76 113.70 110.97 2kc5 s SER 112 Ca 0.14 -1.07 -0.09 0.00 1.31 0.00 0.00 55.95 56.23 2kc5 s SER 112 Cb -0.03 -1.78 -0.07 0.00 0.21 0.00 0.00 66.02 64.35 2kc5 s SER 112 CO 0.05 -0.25 2.92 -0.81 0.41 0.00 0.00 173.24 175.56 2kc5 n PRO 113 N 4.73 3.74 -0.78 12.44 -0.04 -1.26 -4.68 135.00 149.16 2kc5 n PRO 113 Ca -0.14 -2.33 -0.13 0.00 -0.04 0.00 0.00 63.50 60.87 2kc5 n PRO 113 Cb 0.45 -2.73 0.14 0.00 -0.04 0.00 0.00 33.50 31.32 2kc5 n PRO 113 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2kc5 n LEU 114 N 3.23 5.27 -4.78 1.53 4.77 -1.26 -4.91 117.00 120.85 2kc5 n LEU 114 Ca 0.75 -2.77 -0.36 0.00 -0.03 0.00 0.00 56.01 53.59 2kc5 n LEU 114 Cb 0.27 -0.71 -0.03 0.00 -2.33 0.00 0.00 43.42 40.62 2kc5 n LEU 114 CO 0.79 0.81 0.76 -0.44 -1.33 0.00 0.00 177.39 177.98 2kc5 s SER 115 N -0.51 6.51 0.44 -1.43 0.01 -1.26 -4.97 113.70 112.48 2kc5 s SER 115 Ca 0.37 2.11 0.25 0.00 1.31 0.00 0.00 55.95 59.99 2kc5 s SER 115 Cb 0.31 -2.59 0.59 0.00 0.21 0.00 0.00 66.02 64.54 2kc5 s SER 115 CO 0.08 -0.67 1.70 0.45 0.41 0.00 0.00 173.24 175.20 2kc5 h HIS 116 N 2.21 0.00 0.00 2.43 3.86 -2.03 -2.77 115.15 118.85 2kc5 h HIS 116 Ca -0.49 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.72 2kc5 h HIS 116 Cb 1.23 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.70 2kc5 h HIS 116 CO 0.56 0.00 0.00 -1.13 0.86 0.00 0.00 177.93 178.22 2kc5 n SER 117 N -3.00 0.00 -4.76 2.45 3.41 -1.26 -4.91 113.62 105.54 2kc5 n SER 117 Ca 0.03 -0.33 -0.40 0.00 -0.26 0.00 0.00 58.87 57.92 2kc5 n SER 117 Cb 0.47 -0.18 0.02 0.00 -0.26 0.00 0.00 64.21 64.26 2kc5 n SER 117 CO 0.00 0.00 0.00 -0.32 -0.16 0.00 0.00 175.04 174.56 2kc5 s MET 118 N -2.36 3.66 0.24 4.33 0.00 -1.05 -4.95 119.30 119.17 2kc5 s MET 118 Ca 0.29 2.34 -0.19 0.00 0.00 0.00 0.00 55.69 58.13 2kc5 s MET 118 Cb 0.17 -2.62 0.02 0.00 0.00 0.00 0.00 34.83 32.41 2kc5 s MET 118 CO 0.35 -0.81 0.61 0.45 0.00 0.00 0.00 175.02 175.61 2kc5 s SER 119 N -0.62 -0.26 0.49 1.11 0.15 -1.26 -5.01 113.70 108.30 2kc5 s SER 119 Ca 0.62 -0.58 0.14 0.00 0.70 0.00 0.00 55.95 56.83 2kc5 s SER 119 Cb -0.42 0.65 1.16 0.00 -1.71 0.00 0.00 66.02 65.70 2kc5 s SER 119 CO 0.54 -1.19 2.12 0.40 1.20 0.00 0.00 173.24 176.30 2kc5 h ILE 120 N 2.11 1.01 -0.19 6.45 5.03 -1.96 0.53 117.51 130.50 2kc5 h ILE 120 Ca -0.25 -0.05 -0.04 0.00 -0.12 0.00 0.00 64.86 64.40 2kc5 h ILE 120 Cb 1.26 0.84 -0.01 0.00 -3.03 0.00 0.00 36.82 35.89 2kc5 h ILE 120 CO 0.31 0.03 -0.03 -0.33 -0.68 0.00 0.00 178.15 177.45 2kc5 h GLU 121 N 0.16 0.35 -0.28 2.37 5.08 -1.99 -1.01 114.58 119.27 2kc5 h GLU 121 Ca 0.06 -0.12 -0.04 0.00 -1.00 0.00 0.00 59.36 58.25 2kc5 h GLU 121 Cb 0.04 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.25 2kc5 h GLU 121 CO -0.01 0.59 0.00 0.93 -1.00 0.00 0.00 179.01 179.52 2kc5 h GLU 122 N 0.08 0.41 0.44 2.33 4.39 -1.73 0.10 114.58 120.61 2kc5 h GLU 122 Ca 0.05 -0.08 -0.01 0.00 0.34 0.00 0.00 59.36 59.66 2kc5 h GLU 122 Cb 0.45 -0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 29.01 2kc5 h GLU 122 CO 0.01 0.44 -0.40 0.78 -1.16 0.00 0.00 179.01 178.68 2kc5 h GLY 123 N 0.72 -1.15 0.97 -3.84 0.00 -0.49 0.13 103.07 99.41 2kc5 h GLY 123 Ca 0.09 0.52 -0.05 0.00 0.00 0.00 0.00 47.33 47.89 2kc5 h GLY 123 CO 0.01 -0.36 0.08 1.46 0.00 0.00 0.00 176.54 177.73 2kc5 h GLN 124 N -0.83 0.76 -0.92 4.80 4.20 -0.89 -0.72 115.11 121.51 2kc5 h GLN 124 Ca -0.06 -0.20 0.03 0.00 0.06 0.00 0.00 58.65 58.49 2kc5 h GLN 124 Cb 0.71 -0.09 -0.05 0.00 0.30 0.00 0.00 27.48 28.35 2kc5 h GLN 124 CO -0.03 0.77 0.59 0.00 -0.67 0.00 0.00 178.83 179.50 2kc5 h ARG 125 N 0.63 1.12 0.00 1.46 3.08 -0.82 -2.18 114.38 117.67 2kc5 h ARG 125 Ca 0.14 -0.07 -0.04 0.00 0.07 0.00 0.00 59.98 60.08 2kc5 h ARG 125 Cb 0.37 -0.25 -0.01 0.00 0.08 0.00 0.00 29.97 30.17 2kc5 h ARG 125 CO 0.01 0.74 -0.32 1.25 -1.07 0.00 0.00 179.97 180.58 2kc5 h LEU 126 N 1.15 0.00 -0.36 3.04 5.85 -0.51 0.11 115.31 124.59 2kc5 h LEU 126 Ca 0.37 0.00 -0.10 0.00 0.84 0.00 0.00 57.88 58.99 2kc5 h LEU 126 Cb 0.00 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.03 2kc5 h LEU 126 CO -0.12 0.20 -0.15 0.74 -0.34 0.00 0.00 178.44 178.77 2kc5 h THR 127 N 0.00 1.28 -0.33 1.05 2.02 -0.76 0.11 112.91 116.29 2kc5 h THR 127 Ca -0.01 -1.26 -0.15 0.00 0.77 0.00 0.00 66.41 65.76 2kc5 h THR 127 Cb 1.16 1.34 -0.00 0.00 -1.74 0.00 0.00 68.15 68.91 2kc5 h THR 127 CO 0.02 0.42 -0.37 -0.78 0.37 0.00 0.00 175.52 175.18 2kc5 h ASP 128 N 0.53 0.89 0.25 4.18 3.58 -1.27 -0.89 116.42 123.69 2kc5 h ASP 128 Ca 0.08 -0.48 -0.08 0.00 0.42 0.00 0.00 57.03 56.98 2kc5 h ASP 128 Cb 0.69 -0.25 -0.01 0.00 1.72 0.00 0.00 39.33 41.48 2kc5 h ASP 128 CO 0.05 1.19 -0.32 -0.78 -2.88 0.00 0.00 179.24 176.50 2kc5 h ASP 129 N 0.60 0.11 -0.37 2.28 3.58 -0.80 -0.29 116.42 121.54 2kc5 h ASP 129 Ca 0.05 -0.03 -0.13 0.00 0.42 0.00 0.00 57.03 57.33 2kc5 h ASP 129 Cb 0.96 -0.03 -0.01 0.00 1.72 0.00 0.00 39.33 41.97 2kc5 h ASP 129 CO 0.09 0.43 -0.29 0.00 -2.88 0.00 0.00 179.24 176.58 2kc5 h ALA 131 N 0.77 -0.41 -0.13 0.00 0.00 -0.83 -1.73 119.26 116.93 2kc5 h ALA 131 Ca 0.07 -0.04 0.05 0.00 0.00 0.00 0.00 54.91 54.98 2kc5 h ALA 131 Cb 0.87 0.38 -0.06 0.00 0.00 0.00 0.00 17.79 18.98 2kc5 h ALA 131 CO 0.08 -0.78 -0.27 -0.09 0.00 0.00 0.00 179.25 178.19 2kc5 h ARG 132 N -0.45 -0.33 -0.28 0.00 9.65 -0.93 -1.34 114.38 120.71 2kc5 h ARG 132 Ca 0.03 0.02 0.06 0.00 -1.10 0.00 0.00 59.98 58.99 2kc5 h ARG 132 Cb 0.47 0.08 -0.08 0.00 -1.39 0.00 0.00 29.97 29.04 2kc5 h ARG 132 CO -0.13 -0.22 -0.35 1.98 2.80 0.00 0.00 179.97 184.05 2kc5 h MET 133 N -0.34 -0.33 0.00 0.20 4.05 -0.62 0.16 114.93 118.04 2kc5 h MET 133 Ca 0.10 0.02 -0.10 0.00 -0.28 0.00 0.00 59.70 59.44 2kc5 h MET 133 Cb 0.50 0.07 -0.01 0.00 -0.80 0.00 0.00 31.60 31.35 2kc5 h MET 133 CO -0.33 -0.22 -0.50 -0.84 0.23 0.00 0.00 176.91 175.26 2kc5 h ILE 134 N -0.34 0.89 -0.11 1.77 3.07 -1.07 -2.59 117.51 119.14 2kc5 h ILE 134 Ca 0.13 -2.15 -0.15 0.00 1.55 0.00 0.00 64.86 64.25 2kc5 h ILE 134 Cb 0.56 2.36 -0.01 0.00 -0.27 0.00 0.00 36.82 39.45 2kc5 h ILE 134 CO -0.46 0.49 -0.58 -0.07 -1.05 0.00 0.00 178.15 176.47 2kc5 h LEU 135 N 0.00 0.39 2.12 0.16 3.38 -1.02 -3.37 115.31 116.97 2kc5 h LEU 135 Ca -0.00 -0.22 -0.35 0.00 0.09 0.00 0.00 57.88 57.39 2kc5 h LEU 135 Cb 1.32 -0.11 -0.07 0.00 0.09 0.00 0.00 40.66 41.89 2kc5 h LEU 135 CO 0.06 0.88 -0.40 -1.20 0.09 0.00 0.00 178.44 177.88 2kc5 n SER 136 N -3.91 -4.95 -3.93 -0.43 7.64 0.53 -4.58 113.62 103.99 2kc5 n SER 136 Ca -0.03 0.21 -0.10 0.00 1.01 0.00 0.00 58.87 59.96 2kc5 n SER 136 Cb 0.61 -4.26 -0.10 0.00 -1.01 0.00 0.00 64.21 59.45 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 -5.27 1.93 0.66 -3.43 1.43 -1.24 -5.03 118.68 107.74 2kc5 s LEU 137 Ca 0.00 -0.40 -0.17 0.00 -1.03 0.00 0.00 54.13 52.53 2kc5 s LEU 137 Cb 0.00 0.37 -0.01 0.00 0.03 0.00 0.00 46.19 46.59 2kc5 s LEU 137 CO 0.00 -0.35 1.19 -0.81 0.23 0.00 0.00 176.35 176.61 2kc5 n PRO 138 N 1.44 0.92 -3.75 1.29 -0.04 -1.26 -4.67 135.00 128.93 2kc5 n PRO 138 Ca -0.23 0.37 -0.13 0.00 -0.04 0.00 0.00 63.50 63.48 2kc5 n PRO 138 Cb 0.56 -2.43 -0.08 0.00 -0.04 0.00 0.00 33.50 31.51 2kc5 n PRO 138 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2kc5 s VAL 139 N -1.52 0.07 -0.00 0.52 0.11 -1.26 -5.06 120.40 113.26 2kc5 s VAL 139 Ca 0.80 -0.57 -0.30 0.00 -2.93 0.00 0.00 61.98 58.99 2kc5 s VAL 139 Cb -0.37 -0.79 -0.08 0.00 -1.53 0.00 0.00 36.38 33.61 2kc5 s VAL 139 CO 0.43 -0.31 1.94 -0.89 -3.33 0.00 0.00 175.10 172.94 2kc5 s THR 140 N -1.95 3.11 0.00 5.04 2.01 -1.26 -4.97 115.64 117.63 2kc5 s THR 140 Ca -0.09 0.13 -0.30 0.00 0.31 0.00 0.00 61.69 61.74 2kc5 s THR 140 Cb -0.03 -3.09 -0.05 0.00 0.01 0.00 0.00 72.50 69.34 2kc5 s THR 140 CO 0.01 -0.02 1.30 0.21 -0.69 0.00 0.00 174.62 175.43 2kc5 s ASN 141 N 4.63 6.95 -1.35 3.53 3.84 -1.26 -4.92 114.94 126.36 2kc5 s ASN 141 Ca 0.87 2.02 -0.08 0.00 0.21 0.00 0.00 52.86 55.88 2kc5 s ASN 141 Cb -0.40 -2.56 -0.06 0.00 -0.55 0.00 0.00 41.25 37.67 2kc5 s ASN 141 CO 0.39 -0.63 2.92 -0.81 -2.79 0.00 0.00 177.10 176.18 2kc5 n PRO 142 N 4.96 3.66 -2.79 0.43 -0.04 -1.26 -3.95 135.00 136.01 2kc5 n PRO 142 Ca 0.12 -2.33 -0.02 0.00 -0.04 0.00 0.00 63.50 61.23 2kc5 n PRO 142 Cb 0.45 -2.65 0.06 0.00 -0.04 0.00 0.00 33.50 31.31 2kc5 n PRO 142 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 2kc5 n ASP 143 N 2.99 1.10 -4.73 3.54 2.03 -1.26 -5.13 116.55 115.08 2kc5 n ASP 143 Ca 0.71 -2.17 -0.29 0.00 0.52 0.00 0.00 54.79 53.55 2kc5 n ASP 143 Cb 0.32 -0.31 0.12 0.00 -0.72 0.00 0.00 41.12 40.53 2kc5 n ASP 143 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 2kc5 s VAL 144 N -3.12 1.99 0.95 5.18 -7.23 -1.25 -5.05 120.40 111.86 2kc5 s VAL 144 Ca 0.25 0.00 -0.14 0.00 -1.81 0.00 0.00 61.98 60.28 2kc5 s VAL 144 Cb 0.36 -2.93 -0.01 0.00 0.56 0.00 0.00 36.38 34.36 2kc5 s VAL 144 CO -0.04 0.00 0.11 -2.65 -0.31 0.00 0.00 175.10 172.21 2kc5 n PRO 145 N -3.53 -0.20 -1.85 4.82 -0.02 -1.26 -4.90 135.00 128.06 2kc5 n PRO 145 Ca 0.09 -0.03 -0.42 0.00 -2.02 0.00 0.00 63.50 61.12 2kc5 n PRO 145 Cb 0.60 -1.64 -0.03 0.00 -0.02 0.00 0.00 33.50 32.42 2kc5 n PRO 145 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 2kc5 s HIS 146 N -2.28 1.66 -0.66 6.00 5.65 -1.26 -4.89 115.29 119.52 2kc5 s HIS 146 Ca 0.53 -0.11 0.23 0.00 0.25 0.00 0.00 55.06 55.95 2kc5 s HIS 146 Cb -0.21 -4.07 0.03 0.00 -1.18 0.00 0.00 32.58 27.15 2kc5 s HIS 146 CO 0.71 -4.66 1.01 0.00 -0.65 0.00 0.00 174.74 171.15 2kc5 n ALA 147 N 7.29 3.55 -1.77 1.58 0.00 -1.26 -4.94 120.51 124.96 2kc5 n ALA 147 Ca 0.18 -0.43 -0.37 0.00 0.00 0.00 0.00 53.44 52.82 2kc5 n ALA 147 Cb 0.42 -0.95 -0.00 0.00 0.00 0.00 0.00 19.45 18.92 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 -3.57 2.81 0.08 0.00 0.00 -1.26 -5.06 107.32 100.31 2kc5 s GLY 148 Ca 0.04 1.01 -0.04 0.00 0.00 0.00 0.00 44.72 45.73 2kc5 s GLY 148 CO 0.81 1.48 0.08 0.50 0.00 0.00 0.00 173.10 175.97 2kc5 s ARG 149 N -2.69 0.76 0.47 2.90 1.81 -1.26 -5.15 118.95 115.79 2kc5 s ARG 149 Ca 0.64 -1.14 -0.23 0.00 -1.72 0.00 0.00 55.73 53.28 2kc5 s ARG 149 Cb -0.31 0.27 -0.07 0.00 -0.45 0.00 0.00 34.95 34.39 2kc5 s ARG 149 CO 0.37 -0.20 1.25 1.03 -0.68 0.00 0.00 175.30 177.07 2kc5 s ARG 150 N -3.91 3.64 0.15 3.54 0.52 -1.26 -5.03 118.95 116.60 2kc5 s ARG 150 Ca 0.08 1.98 -0.23 0.00 -0.52 0.00 0.00 55.73 57.04 2kc5 s ARG 150 Cb 0.07 -2.45 -0.08 0.00 0.52 0.00 0.00 34.95 33.01 2kc5 s ARG 150 CO -0.09 -0.70 0.71 0.00 0.02 0.00 0.00 175.30 175.24 2kc5 s ALA 151 N -1.42 3.48 0.24 2.13 0.00 -1.26 -5.08 121.76 119.87 2kc5 s ALA 151 Ca 0.64 0.25 -0.18 0.00 0.00 0.00 0.00 51.96 52.66 2kc5 s ALA 151 Cb -0.34 -2.85 0.02 0.00 0.00 0.00 0.00 23.12 19.95 2kc5 s ALA 151 CO 0.41 0.33 0.61 -0.48 0.00 0.00 0.00 175.76 176.63 2kc5 s LEU 152 N -1.26 -0.06 -1.13 0.00 -0.00 -1.26 -4.99 118.68 109.98 2kc5 s LEU 152 Ca 0.35 -0.62 -0.18 0.00 -0.00 0.00 0.00 54.13 53.68 2kc5 s LEU 152 Cb -0.21 2.35 -0.02 0.00 -0.00 0.00 0.00 46.19 48.31 2kc5 s LEU 152 CO 0.24 -1.20 0.81 -0.11 -0.00 0.00 0.00 176.35 176.08 2kc5 n LEU 153 N -0.41 -3.34 -4.76 1.48 0.00 -1.26 -4.96 117.00 103.76 2kc5 n LEU 153 Ca -0.06 -0.96 -0.36 0.00 0.00 0.00 0.00 56.01 54.63 2kc5 n LEU 153 Cb 0.61 -2.54 0.02 0.00 0.00 0.00 0.00 43.42 41.51 2kc5 n LEU 153 CO 0.17 0.41 0.84 -0.36 0.00 0.00 0.00 177.39 178.45 2kc5 s PHE 154 N -3.46 2.51 -1.50 1.96 0.08 -1.26 -5.01 117.98 111.31 2kc5 s PHE 154 Ca 0.46 1.51 0.00 0.00 0.12 0.00 0.00 56.93 59.02 2kc5 s PHE 154 Cb -0.15 -3.47 0.00 0.00 -0.57 0.00 0.00 43.02 38.84 2kc5 s PHE 154 CO 0.84 -2.05 0.00 0.41 -0.10 0.00 0.00 175.22 174.32 2kc5 n GLY 155 N 0.46 -1.48 3.18 4.36 0.00 -1.26 -5.17 105.19 105.28 2kc5 n GLY 155 Ca 0.12 -1.03 -0.13 0.00 0.00 0.00 0.00 46.02 44.99 2kc5 n GLY 155 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2kc5 s ARG 156 N -1.37 0.55 0.07 1.61 3.52 -1.26 -5.13 118.95 116.94 2kc5 s ARG 156 Ca 0.00 -0.17 -0.31 0.00 -0.13 0.00 0.00 55.73 55.12 2kc5 s ARG 156 Cb 0.00 0.24 -0.07 0.00 -1.56 0.00 0.00 34.95 33.56 2kc5 s ARG 156 CO 0.00 -0.14 1.39 0.50 -0.81 0.00 0.00 175.30 176.24 2kc5 s ARG 157 N -1.11 4.31 0.03 5.12 6.06 -1.26 -5.02 118.95 127.08 2kc5 s ARG 157 Ca -0.12 2.02 0.01 0.00 -2.50 0.00 0.00 55.73 55.14 2kc5 s ARG 157 Cb -0.05 -3.37 -0.02 0.00 0.06 0.00 0.00 34.95 31.56 2kc5 s ARG 157 CO 0.03 -0.48 -0.05 -1.12 -2.50 0.00 0.00 175.30 171.18 2kc5 s SER 158 N 1.40 0.49 0.00 -2.12 0.01 -1.26 -4.75 113.70 107.47 2kc5 s SER 158 Ca 0.64 -0.53 0.00 0.00 1.31 0.00 0.00 55.95 57.37 2kc5 s SER 158 Cb -0.35 0.08 0.00 0.00 0.21 0.00 0.00 66.02 65.96 2kc5 s SER 158 CO 0.29 -0.27 0.00 0.61 0.41 0.00 0.00 173.24 174.28 2kc5 n GLY 159 N 1.52 1.07 0.26 3.44 0.00 -1.26 -4.74 105.19 105.49 2kc5 n GLY 159 Ca -0.23 -0.39 -0.04 0.00 0.00 0.00 0.00 46.02 45.36 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 0.62 -6.23 1.61 4.81 -2.05 -3.39 114.58 109.95 2kc5 h GLU 160 Ca 0.00 -0.19 -0.56 0.00 -0.13 0.00 0.00 59.36 58.48 2kc5 h GLU 160 Cb 0.00 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.29 2kc5 h GLU 160 CO 0.00 0.73 0.75 1.21 -0.73 0.00 0.00 179.01 180.97 2kc5 s ASN 161 N -6.74 7.05 0.00 1.04 2.47 -1.26 -5.27 114.94 112.24 2kc5 s ASN 161 Ca -0.08 1.69 0.17 0.00 0.42 0.00 0.00 52.86 55.06 2kc5 s ASN 161 Cb 0.14 -2.55 1.03 0.00 -1.45 0.00 0.00 41.25 38.43 2kc5 s ASN 161 CO 0.80 -0.63 1.44 0.00 -3.72 0.00 0.00 177.10 174.99