#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k6q n MET 1 N 0.00 0.44 0.00 4.33 2.00 -1.26 -4.99 117.12 117.64 2k6q n MET 1 Ca 0.00 0.19 0.00 0.00 0.00 0.00 0.00 57.70 57.89 2k6q n MET 1 Cb 0.00 -2.01 0.00 0.00 0.00 0.00 0.00 33.22 31.21 2k6q n MET 1 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 175.97 175.62 2k6q n PRO 2 N -1.18 0.00 -2.58 0.03 -0.04 -1.26 -4.98 135.00 124.99 2k6q n PRO 2 Ca 0.12 0.02 -0.15 0.00 -0.04 0.00 0.00 63.50 63.45 2k6q n PRO 2 Cb 0.49 -0.65 0.05 0.00 -0.04 0.00 0.00 33.50 33.36 2k6q n PRO 2 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2k6q n SER 3 N -0.57 1.68 -3.52 3.54 3.41 -1.26 -5.15 113.62 111.76 2k6q n SER 3 Ca 0.00 -2.22 -0.20 0.00 -0.26 0.00 0.00 58.87 56.19 2k6q n SER 3 Cb 0.00 -0.33 -0.08 0.00 -0.26 0.00 0.00 64.21 63.54 2k6q n SER 3 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 175.04 173.05 2k6q s GLU 4 N -4.07 1.73 0.73 4.33 -1.05 -1.26 -5.15 118.70 113.96 2k6q s GLU 4 Ca 0.48 -2.00 -0.05 0.00 -0.15 0.00 0.00 54.97 53.25 2k6q s GLU 4 Cb -0.04 0.21 0.11 0.00 -0.44 0.00 0.00 34.13 33.97 2k6q s GLU 4 CO 0.30 -0.61 1.02 0.15 0.95 0.00 0.00 175.26 177.07 2k6q s LYS 5 N -3.54 1.79 0.06 -4.83 -0.14 -1.26 -5.09 119.74 106.73 2k6q s LYS 5 Ca 0.39 -0.71 -0.01 0.00 -1.36 0.00 0.00 55.97 54.27 2k6q s LYS 5 Cb 0.03 -2.23 -0.04 0.00 -1.68 0.00 0.00 37.83 33.90 2k6q s LYS 5 CO 0.25 -1.43 0.23 0.95 -0.76 0.00 0.00 175.35 174.58 2k6q s THR 6 N -3.23 5.37 0.37 2.17 -4.23 -1.26 -4.67 115.64 110.17 2k6q s THR 6 Ca 0.64 -0.31 0.30 0.00 -1.18 0.00 0.00 61.69 61.15 2k6q s THR 6 Cb -0.07 -3.62 0.46 0.00 1.34 0.00 0.00 72.50 70.61 2k6q s THR 6 CO 0.45 0.16 1.22 0.49 -0.54 0.00 0.00 174.62 176.39 2k6q n PHE 7 N 0.36 0.36 0.14 3.99 3.72 -1.26 0.23 117.46 125.00 2k6q n PHE 7 Ca -0.06 0.37 -0.13 0.00 -0.05 0.00 0.00 57.45 57.58 2k6q n PHE 7 Cb 0.51 -0.77 -0.08 0.00 -0.94 0.00 0.00 39.48 38.21 2k6q n PHE 7 CO 0.00 0.00 0.00 1.57 -0.05 0.00 0.00 176.76 178.28 2k6q h LYS 8 N 0.00 -0.37 0.28 -1.08 2.10 -1.92 -2.79 116.57 112.78 2k6q h LYS 8 Ca 0.70 0.03 -0.01 0.00 -2.00 0.00 0.00 60.65 59.37 2k6q h LYS 8 Cb 2.47 0.08 0.00 0.00 -0.90 0.00 0.00 32.23 33.89 2k6q h LYS 8 CO -0.24 -0.04 -0.13 1.96 -2.00 0.00 0.00 179.45 178.99 2k6q h GLN 9 N -0.76 -0.36 0.00 0.07 4.20 0.24 -3.36 115.11 115.15 2k6q h GLN 9 Ca -0.04 0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.69 2k6q h GLN 9 Cb 0.50 0.08 0.00 0.00 0.30 0.00 0.00 27.48 28.36 2k6q h GLN 9 CO 0.07 -0.06 0.00 -2.13 -0.67 0.00 0.00 178.83 176.04 2k6q n ARG 10 N -5.03 0.00 -2.59 1.46 0.00 0.34 -4.18 116.66 106.67 2k6q n ARG 10 Ca -0.07 0.72 -0.41 0.00 -0.00 0.00 0.00 57.85 58.09 2k6q n ARG 10 Cb 0.24 -1.10 -0.04 0.00 0.00 0.00 0.00 32.46 31.55 2k6q n ARG 10 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.63 178.66 2k6q s ARG 11 N -2.77 4.63 -0.11 -0.14 3.00 -1.05 -4.99 118.95 117.52 2k6q s ARG 11 Ca 0.00 1.63 -0.30 0.00 0.00 0.00 0.00 55.73 57.06 2k6q s ARG 11 Cb 0.00 -3.31 -0.02 0.00 0.00 0.00 0.00 34.95 31.62 2k6q s ARG 11 CO 0.00 0.13 1.21 -1.12 0.00 0.00 0.00 175.30 175.52 2k6q s SER 12 N -0.09 7.02 0.10 0.23 0.01 -1.26 -4.70 113.70 115.01 2k6q s SER 12 Ca 0.48 1.73 -0.18 0.00 1.31 0.00 0.00 55.95 59.29 2k6q s SER 12 Cb -0.27 -2.55 -0.04 0.00 0.21 0.00 0.00 66.02 63.37 2k6q s SER 12 CO 0.33 -0.65 1.20 0.33 0.41 0.00 0.00 173.24 174.86 2k6q n PHE 13 N 5.80 -0.26 -0.36 2.43 7.35 -1.26 0.19 117.46 131.34 2k6q n PHE 13 Ca 0.12 0.75 0.32 0.00 -0.76 0.00 0.00 57.45 57.88 2k6q n PHE 13 Cb 0.46 -0.53 0.59 0.00 0.35 0.00 0.00 39.48 40.34 2k6q n PHE 13 CO 0.00 0.00 0.00 1.49 -0.76 0.00 0.00 176.76 177.49 2k6q h GLU 14 N 0.00 0.08 -0.05 -4.13 4.81 -1.99 1.59 114.58 114.89 2k6q h GLU 14 Ca 0.10 -0.01 -0.24 0.00 -0.13 0.00 0.00 59.36 59.08 2k6q h GLU 14 Cb 0.24 -0.02 0.02 0.00 0.63 0.00 0.00 28.75 29.62 2k6q h GLU 14 CO -0.56 0.06 -0.90 0.37 -0.73 0.00 0.00 179.01 177.25 2k6q h GLN 15 N 0.09 0.71 0.00 1.92 5.75 0.16 -2.65 115.11 121.08 2k6q h GLN 15 Ca 0.82 -0.69 -0.04 0.00 -0.15 0.00 0.00 58.65 58.60 2k6q h GLN 15 Cb 2.24 0.18 -0.01 0.00 1.07 0.00 0.00 27.48 30.97 2k6q h GLN 15 CO -0.64 1.28 -0.17 0.00 -2.65 0.00 0.00 178.83 176.65 2k6q h ARG 16 N 0.39 0.00 0.01 1.69 3.08 0.60 0.25 114.38 120.40 2k6q h ARG 16 Ca -0.10 0.00 -0.20 0.00 0.07 0.00 0.00 59.98 59.75 2k6q h ARG 16 Cb 1.55 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.59 2k6q h ARG 16 CO 0.18 0.17 -0.91 0.28 -1.07 0.00 0.00 179.97 178.62 2k6q h VAL 17 N 0.00 1.50 0.10 2.04 2.07 0.23 -2.83 116.25 119.36 2k6q h VAL 17 Ca -0.00 -2.69 -0.26 0.00 0.82 0.00 0.00 66.70 64.57 2k6q h VAL 17 Cb 0.37 2.52 0.01 0.00 -1.52 0.00 0.00 31.29 32.67 2k6q h VAL 17 CO 0.02 0.78 -1.17 -0.08 0.02 0.00 0.00 177.57 177.15 2k6q h GLU 18 N 0.10 0.35 0.19 1.57 4.81 -0.93 -2.91 114.58 117.76 2k6q h GLU 18 Ca -0.05 -0.51 -0.00 0.00 -0.13 0.00 0.00 59.36 58.67 2k6q h GLU 18 Cb 1.55 0.18 -0.01 0.00 0.63 0.00 0.00 28.75 31.10 2k6q h GLU 18 CO 0.14 1.21 -0.13 0.22 -0.73 0.00 0.00 179.01 179.71 2k6q h ASP 19 N 0.13 -0.33 -0.93 1.04 1.82 -0.55 -2.13 116.42 115.47 2k6q h ASP 19 Ca -0.13 0.03 0.07 0.00 -0.39 0.00 0.00 57.03 56.61 2k6q h ASP 19 Cb 1.86 0.11 -0.07 0.00 0.68 0.00 0.00 39.33 41.91 2k6q h ASP 19 CO 0.20 -0.21 0.59 1.62 -1.61 0.00 0.00 179.24 179.83 2k6q h VAL 20 N -0.32 1.04 -1.49 2.25 3.04 -1.59 -0.87 116.25 118.32 2k6q h VAL 20 Ca -0.01 -0.36 0.49 0.00 -1.01 0.00 0.00 66.70 65.81 2k6q h VAL 20 Cb 0.28 -0.10 -0.13 0.00 -2.01 0.00 0.00 31.29 29.33 2k6q h VAL 20 CO 0.00 0.19 0.98 -0.09 -1.01 0.00 0.00 177.57 177.64 2k6q h ARG 21 N 1.05 0.01 0.06 4.17 9.65 -1.17 1.62 114.38 129.75 2k6q h ARG 21 Ca 0.41 -0.00 -0.00 0.00 -1.10 0.00 0.00 59.98 59.29 2k6q h ARG 21 Cb 0.22 -0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.80 2k6q h ARG 21 CO -0.19 0.01 -0.03 -0.07 2.80 0.00 0.00 179.97 182.49 2k6q h LEU 22 N 0.01 -0.06 -1.86 3.80 3.38 -1.14 -1.59 115.31 117.84 2k6q h LEU 22 Ca 0.89 -0.27 -0.02 0.00 0.09 0.00 0.00 57.88 58.56 2k6q h LEU 22 Cb 2.99 0.02 -0.00 0.00 0.09 0.00 0.00 40.66 43.76 2k6q h LEU 22 CO -0.39 0.24 -0.12 -0.29 0.09 0.00 0.00 178.44 177.98 2k6q h ILE 23 N -0.37 0.50 -0.08 1.22 6.09 0.20 0.87 117.51 125.93 2k6q h ILE 23 Ca -0.01 -0.56 -0.14 0.00 -1.37 0.00 0.00 64.86 62.78 2k6q h ILE 23 Cb 0.33 1.38 -0.01 0.00 0.47 0.00 0.00 36.82 38.99 2k6q h ILE 23 CO 0.01 0.11 -0.55 0.03 -3.07 0.00 0.00 178.15 174.69 2k6q h ARG 24 N 0.00 0.25 0.00 2.19 2.47 0.42 0.81 114.38 120.52 2k6q h ARG 24 Ca -0.00 -0.15 0.00 0.00 -1.26 0.00 0.00 59.98 58.56 2k6q h ARG 24 Cb 0.37 0.02 0.00 0.00 -1.65 0.00 0.00 29.97 28.71 2k6q h ARG 24 CO 0.02 0.73 -1.72 -0.85 0.56 0.00 0.00 179.97 178.71 2k6q n GLU 25 N -3.92 0.62 -0.08 0.04 0.28 -0.61 -3.80 120.64 113.18 2k6q n GLU 25 Ca -0.02 -0.11 -0.07 0.00 -0.16 0.00 0.00 57.16 56.79 2k6q n GLU 25 Cb 0.58 -1.59 -0.03 0.00 1.43 0.00 0.00 31.44 31.83 2k6q n GLU 25 CO 0.00 0.00 0.00 1.04 -0.16 0.00 0.00 177.13 178.01 2k6q n GLN 26 N -2.33 0.47 -3.85 3.44 6.02 0.29 -4.72 117.38 116.70 2k6q n GLN 26 Ca -0.03 0.51 -0.28 0.00 -0.01 0.00 0.00 57.00 57.19 2k6q n GLN 26 Cb 0.55 -1.68 -0.12 0.00 1.02 0.00 0.00 30.24 30.02 2k6q n GLN 26 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 2k6q n HIS 27 N -4.58 3.32 0.10 1.08 8.25 0.28 -4.88 115.22 118.79 2k6q n HIS 27 Ca -0.11 -4.30 -0.05 0.00 -0.26 0.00 0.00 57.72 53.00 2k6q n HIS 27 Cb 0.33 -0.63 0.05 0.00 1.12 0.00 0.00 29.99 30.87 2k6q n HIS 27 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 2k6q h PRO 28 N 5.27 0.09 -1.01 -0.41 0.13 -1.64 -3.07 132.00 131.35 2k6q h PRO 28 Ca 0.15 -0.09 -0.26 0.00 -0.87 0.00 0.00 66.00 64.93 2k6q h PRO 28 Cb 0.74 0.02 -0.15 0.00 0.13 0.00 0.00 31.00 31.74 2k6q h PRO 28 CO 0.73 0.82 0.33 0.25 -0.23 0.00 0.00 178.00 179.90 2k6q n THR 29 N -3.68 2.12 -4.06 1.56 -2.24 -1.26 -4.83 114.28 101.89 2k6q n THR 29 Ca -0.02 -0.98 -0.13 0.00 -2.27 0.00 0.00 64.05 60.65 2k6q n THR 29 Cb 0.74 -0.75 -0.11 0.00 -2.10 0.00 0.00 70.33 68.10 2k6q n THR 29 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2k6q s LYS 30 N -1.66 0.52 -0.38 -0.78 -0.14 -1.16 -3.42 119.74 112.73 2k6q s LYS 30 Ca 0.29 -0.74 -0.15 0.00 -1.36 0.00 0.00 55.97 54.00 2k6q s LYS 30 Cb 0.24 -0.29 0.00 0.00 -1.68 0.00 0.00 37.83 36.10 2k6q s LYS 30 CO 0.05 0.05 0.34 0.42 -0.76 0.00 0.00 175.35 175.45 2k6q s ILE 31 N -1.35 5.20 0.26 2.17 -1.09 0.68 -4.93 121.20 122.13 2k6q s ILE 31 Ca -0.10 -0.28 -0.30 0.00 -2.23 0.00 0.00 60.65 57.75 2k6q s ILE 31 Cb -0.10 -3.88 -0.09 0.00 -1.58 0.00 0.00 42.46 36.81 2k6q s ILE 31 CO 0.00 -0.21 1.09 -2.16 -1.23 0.00 0.00 174.94 172.43 2k6q s PRO 32 N 1.90 4.65 0.11 2.79 0.04 -1.26 -2.36 135.00 140.87 2k6q s PRO 32 Ca 0.09 1.76 -0.08 0.00 0.04 0.00 0.00 61.00 62.81 2k6q s PRO 32 Cb -0.17 -3.21 -0.01 0.00 0.04 0.00 0.00 34.50 31.14 2k6q s PRO 32 CO 0.11 0.21 0.19 0.14 0.04 0.00 0.00 177.00 177.70 2k6q s VAL 33 N -0.99 0.13 -0.30 -0.36 -7.23 -1.17 -2.86 120.40 107.62 2k6q s VAL 33 Ca 0.45 -1.31 -0.00 0.00 -1.81 0.00 0.00 61.98 59.31 2k6q s VAL 33 Cb -0.31 -1.50 0.09 0.00 0.56 0.00 0.00 36.38 35.22 2k6q s VAL 33 CO 0.39 -0.58 0.07 -0.63 -0.31 0.00 0.00 175.10 174.04 2k6q s ILE 34 N -3.90 1.12 -0.27 -0.62 -1.09 0.51 -3.11 121.20 113.84 2k6q s ILE 34 Ca 0.09 -1.45 -0.23 0.00 -2.23 0.00 0.00 60.65 56.82 2k6q s ILE 34 Cb 0.05 -1.78 -0.01 0.00 -1.58 0.00 0.00 42.46 39.14 2k6q s ILE 34 CO -0.08 -0.57 0.78 -0.63 -1.23 0.00 0.00 174.94 173.22 2k6q s ILE 35 N 1.51 4.84 0.15 2.92 -1.09 0.16 -1.46 121.20 128.24 2k6q s ILE 35 Ca 0.08 1.36 0.08 0.00 -2.23 0.00 0.00 60.65 59.94 2k6q s ILE 35 Cb -0.18 -4.10 -0.04 0.00 -1.58 0.00 0.00 42.46 36.56 2k6q s ILE 35 CO -0.19 -0.12 -0.18 -1.61 -1.23 0.00 0.00 174.94 171.60 2k6q s GLU 36 N 2.84 1.22 0.25 2.79 2.02 -0.33 -4.53 118.70 122.95 2k6q s GLU 36 Ca 0.33 -1.36 -0.30 0.00 0.02 0.00 0.00 54.97 53.66 2k6q s GLU 36 Cb -0.15 -1.27 -0.09 0.00 0.10 0.00 0.00 34.13 32.72 2k6q s GLU 36 CO 0.09 0.26 1.20 -0.98 0.02 0.00 0.00 175.26 175.85 2k6q s ARG 37 N -2.70 4.51 0.50 1.61 1.70 -1.26 -2.00 118.95 121.30 2k6q s ARG 37 Ca 0.14 1.95 -0.23 0.00 -0.47 0.00 0.00 55.73 57.11 2k6q s ARG 37 Cb -0.06 -3.18 -0.06 0.00 -0.57 0.00 0.00 34.95 31.08 2k6q s ARG 37 CO 0.06 -0.02 1.34 -0.47 -1.08 0.00 0.00 175.30 175.14 2k6q s TYR 38 N -0.69 2.45 -0.56 5.89 5.04 -0.38 -4.81 117.35 124.29 2k6q s TYR 38 Ca 0.49 1.37 -0.26 0.00 -2.44 0.00 0.00 57.07 56.23 2k6q s TYR 38 Cb -0.34 -3.76 -0.09 0.00 0.35 0.00 0.00 41.96 38.12 2k6q s TYR 38 CO 0.42 -2.65 2.43 1.63 -1.34 0.00 0.00 175.55 176.04 2k6q n LYS 39 N -0.65 0.91 0.00 4.97 5.02 -1.26 0.55 118.16 127.70 2k6q n LYS 39 Ca 0.08 -0.16 0.00 0.00 -2.02 0.00 0.00 58.31 56.21 2k6q n LYS 39 Cb 0.44 -3.42 0.00 0.00 -0.02 0.00 0.00 35.03 32.03 2k6q n LYS 39 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2k6q n GLY 40 N 6.17 1.42 3.51 0.72 0.00 -1.26 -5.07 105.19 110.67 2k6q n GLY 40 Ca 0.40 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.99 2k6q n GLY 40 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2k6q s GLU 41 N -0.25 3.30 -0.07 1.61 2.56 0.19 -4.77 118.70 121.27 2k6q s GLU 41 Ca 0.00 -0.33 0.07 0.00 0.00 0.00 0.00 54.97 54.71 2k6q s GLU 41 Cb 0.00 -4.08 -0.10 0.00 2.00 0.00 0.00 34.13 31.95 2k6q s GLU 41 CO 0.00 -1.55 0.05 0.36 -0.56 0.00 0.00 175.26 173.56 2k6q n LYS 42 N 7.56 2.40 0.00 4.30 0.00 -1.26 -4.78 118.16 126.38 2k6q n LYS 42 Ca 0.01 -0.01 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 2k6q n LYS 42 Cb 0.47 -1.21 0.00 0.00 -0.00 0.00 0.00 35.03 34.29 2k6q n LYS 42 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.40 178.44 2k6q n GLN 43 N -2.24 0.00 -1.52 -1.58 6.02 -1.26 -4.75 117.38 112.04 2k6q n GLN 43 Ca -0.12 0.27 -0.37 0.00 -0.01 0.00 0.00 57.00 56.77 2k6q n GLN 43 Cb 0.70 -1.22 0.06 0.00 1.02 0.00 0.00 30.24 30.81 2k6q n GLN 43 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 2k6q n LEU 44 N -1.31 3.19 -4.76 1.08 7.99 -1.26 -4.98 117.00 116.95 2k6q n LEU 44 Ca 0.00 0.74 -0.30 0.00 -0.01 0.00 0.00 56.01 56.44 2k6q n LEU 44 Cb 0.00 -1.36 0.23 0.00 -0.11 0.00 0.00 43.42 42.18 2k6q n LEU 44 CO 0.00 -2.13 0.76 -2.16 -1.51 0.00 0.00 177.39 172.35 2k6q s PRO 45 N -2.85 -0.57 -0.09 3.23 0.04 -1.26 -4.92 135.00 128.58 2k6q s PRO 45 Ca 0.74 -0.35 0.05 0.00 0.04 0.00 0.00 61.00 61.49 2k6q s PRO 45 Cb -0.39 -1.70 0.31 0.00 0.04 0.00 0.00 34.50 32.76 2k6q s PRO 45 CO 0.49 -3.23 0.98 0.28 0.04 0.00 0.00 177.00 175.56 2k6q n VAL 46 N -4.36 1.05 -1.51 -0.36 0.31 -1.26 -4.94 118.33 107.26 2k6q n VAL 46 Ca 0.16 -0.53 0.10 0.00 -0.01 0.00 0.00 64.34 64.05 2k6q n VAL 46 Cb 0.59 -0.40 -0.05 0.00 -0.91 0.00 0.00 33.84 33.07 2k6q n VAL 46 CO 0.00 0.00 0.00 -0.11 -1.32 0.00 0.00 176.83 175.40 2k6q n LEU 47 N 0.24 -1.30 0.00 7.52 -0.00 -1.26 -4.37 117.00 117.83 2k6q n LEU 47 Ca 0.11 2.57 0.11 0.00 -0.00 0.00 0.00 56.01 58.80 2k6q n LEU 47 Cb 0.61 -3.11 0.53 0.00 -0.00 0.00 0.00 43.42 41.44 2k6q n LEU 47 CO 0.12 -1.54 0.87 0.47 -0.00 0.00 0.00 177.39 177.31 2k6q n ASP 48 N -3.60 0.00 -3.54 1.96 9.92 -1.26 -4.82 116.55 115.21 2k6q n ASP 48 Ca -0.05 0.22 -0.07 0.00 -0.53 0.00 0.00 54.79 54.36 2k6q n ASP 48 Cb 0.59 -0.39 -0.02 0.00 -0.64 0.00 0.00 41.12 40.66 2k6q n ASP 48 CO 0.00 0.00 0.00 -1.59 0.13 0.00 0.00 177.20 175.74 2k6q s LYS 49 N -2.78 0.64 -0.10 -1.24 0.00 -1.26 -5.05 119.74 109.94 2k6q s LYS 49 Ca 0.16 -0.23 0.14 0.00 0.00 0.00 0.00 55.97 56.04 2k6q s LYS 49 Cb 0.15 0.29 -0.20 0.00 0.00 0.00 0.00 37.83 38.07 2k6q s LYS 49 CO 0.38 -0.28 0.15 2.41 0.00 0.00 0.00 175.35 178.01 2k6q n THR 50 N -0.18 0.66 -3.48 3.79 -1.04 -1.26 -4.90 114.28 107.87 2k6q n THR 50 Ca -0.05 -0.53 -0.38 0.00 -2.04 0.00 0.00 64.05 61.05 2k6q n THR 50 Cb 0.60 -0.36 -0.06 0.00 -1.82 0.00 0.00 70.33 68.69 2k6q n THR 50 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 2k6q s LYS 51 N -2.59 3.99 0.02 -2.82 1.02 -1.26 -0.66 119.74 117.43 2k6q s LYS 51 Ca -0.07 0.40 0.00 0.00 0.02 0.00 0.00 55.97 56.32 2k6q s LYS 51 Cb 0.06 -3.26 -0.02 0.00 -0.52 0.00 0.00 37.83 34.10 2k6q s LYS 51 CO 0.61 0.60 -0.03 -0.06 -0.92 0.00 0.00 175.35 175.56 2k6q s PHE 52 N -0.78 0.22 -0.31 3.18 0.40 -1.18 -4.98 117.98 114.53 2k6q s PHE 52 Ca 0.24 -0.43 0.03 0.00 -0.60 0.00 0.00 56.93 56.16 2k6q s PHE 52 Cb -0.16 -0.16 0.08 0.00 0.51 0.00 0.00 43.02 43.29 2k6q s PHE 52 CO 0.12 -0.15 0.00 -0.51 0.70 0.00 0.00 175.22 175.38 2k6q s LEU 53 N -1.19 4.26 0.06 -0.37 1.43 -1.26 -3.03 118.68 118.59 2k6q s LEU 53 Ca -0.13 -1.81 -0.15 0.00 -1.03 0.00 0.00 54.13 51.02 2k6q s LEU 53 Cb -0.08 -1.62 -0.06 0.00 0.03 0.00 0.00 46.19 44.45 2k6q s LEU 53 CO -0.01 -0.32 0.47 -0.69 0.23 0.00 0.00 176.35 176.04 2k6q s VAL 54 N 1.02 4.94 0.19 -1.59 1.01 -0.99 -4.90 120.40 120.08 2k6q s VAL 54 Ca 0.02 0.84 -0.30 0.00 0.00 0.00 0.00 61.98 62.55 2k6q s VAL 54 Cb -0.20 -3.74 -0.08 0.00 0.00 0.00 0.00 36.38 32.36 2k6q s VAL 54 CO -0.06 0.45 1.11 -2.16 0.00 0.00 0.00 175.10 174.44 2k6q s PRO 55 N -1.43 4.59 -0.17 2.72 0.04 -1.26 -0.23 135.00 139.26 2k6q s PRO 55 Ca 0.29 1.75 -0.05 0.00 0.04 0.00 0.00 61.00 63.03 2k6q s PRO 55 Cb -0.16 -3.26 -0.14 0.00 0.04 0.00 0.00 34.50 30.97 2k6q s PRO 55 CO 0.17 0.07 3.30 -0.40 0.04 0.00 0.00 177.00 180.18 2k6q n ASP 56 N 2.23 5.70 -0.93 6.66 5.68 -1.22 -3.31 116.55 131.36 2k6q n ASP 56 Ca 0.02 -2.75 -0.03 0.00 -0.50 0.00 0.00 54.79 51.53 2k6q n ASP 56 Cb 0.46 -1.35 -0.04 0.00 -1.14 0.00 0.00 41.12 39.05 2k6q n ASP 56 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2k6q n HIS 57 N 1.89 0.00 -2.86 2.11 1.44 -1.26 -4.98 115.22 111.56 2k6q n HIS 57 Ca 0.45 -0.35 0.00 0.00 -2.01 0.00 0.00 57.72 55.81 2k6q n HIS 57 Cb 0.78 0.31 0.00 0.00 0.12 0.00 0.00 29.99 31.20 2k6q n HIS 57 CO 0.00 0.00 0.00 1.33 -2.81 0.00 0.00 176.34 174.86 2k6q n VAL 58 N 0.07 0.00 -4.42 0.61 0.24 -1.21 -5.14 118.33 108.49 2k6q n VAL 58 Ca -0.15 0.00 -0.23 0.00 -2.04 0.00 0.00 64.34 61.92 2k6q n VAL 58 Cb 0.72 0.00 -0.10 0.00 -1.47 0.00 0.00 33.84 32.98 2k6q n VAL 58 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 2k6q s ASN 59 N 1.13 3.25 0.64 -1.34 6.03 -1.26 -3.68 114.94 119.71 2k6q s ASN 59 Ca 0.00 -0.98 0.31 0.00 -1.03 0.00 0.00 52.86 51.16 2k6q s ASN 59 Cb 0.00 -0.24 1.70 0.00 -3.03 0.00 0.00 41.25 39.68 2k6q s ASN 59 CO 0.00 0.00 2.00 0.00 -2.03 0.00 0.00 177.10 177.07 2k6q h MET 60 N 2.59 0.00 0.00 3.55 -0.00 -1.80 0.33 114.93 119.60 2k6q h MET 60 Ca -0.41 0.00 -0.03 0.00 -0.00 0.00 0.00 59.70 59.26 2k6q h MET 60 Cb 1.24 0.00 -0.00 0.00 -0.00 0.00 0.00 31.60 32.83 2k6q h MET 60 CO 0.57 0.00 -0.13 1.03 -0.00 0.00 0.00 176.91 178.39 2k6q h SER 61 N 0.00 0.00 0.85 -0.10 0.87 -1.90 -2.95 113.55 110.32 2k6q h SER 61 Ca 0.05 0.00 -0.04 0.00 -1.23 0.00 0.00 61.79 60.57 2k6q h SER 61 Cb 0.65 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.61 2k6q h SER 61 CO -0.00 0.13 -0.44 -0.33 -0.53 0.00 0.00 176.83 175.66 2k6q h GLU 62 N 0.00 -1.14 -1.41 2.24 4.39 -0.73 -0.40 114.58 117.53 2k6q h GLU 62 Ca -0.00 0.08 0.41 0.00 0.34 0.00 0.00 59.36 60.19 2k6q h GLU 62 Cb 0.23 0.26 -0.06 0.00 -0.10 0.00 0.00 28.75 29.08 2k6q h GLU 62 CO 0.02 -0.76 1.10 1.25 -1.16 0.00 0.00 179.01 179.46 2k6q h LEU 63 N -1.18 0.00 0.15 1.33 5.85 -1.65 0.82 115.31 120.63 2k6q h LEU 63 Ca -0.12 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.60 2k6q h LEU 63 Cb 0.92 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.95 2k6q h LEU 63 CO 0.17 0.00 -0.07 0.40 -0.34 0.00 0.00 178.44 178.59 2k6q h ILE 64 N 0.00 0.81 -0.11 4.05 1.08 -1.26 0.16 117.51 122.25 2k6q h ILE 64 Ca 0.67 -1.16 0.03 0.00 -0.39 0.00 0.00 64.86 64.01 2k6q h ILE 64 Cb 2.87 1.38 -0.00 0.00 -3.07 0.00 0.00 36.82 37.99 2k6q h ILE 64 CO -0.01 0.22 0.11 0.11 -0.69 0.00 0.00 178.15 177.89 2k6q h LYS 65 N -0.89 0.00 0.11 2.37 1.57 0.20 -0.88 116.57 119.04 2k6q h LYS 65 Ca -0.02 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.75 2k6q h LYS 65 Cb 0.52 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.83 2k6q h LYS 65 CO 0.03 0.00 -0.05 0.82 -0.57 0.00 0.00 179.45 179.68 2k6q h ILE 66 N 0.00 0.00 -0.54 1.86 1.08 0.01 -2.60 117.51 117.32 2k6q h ILE 66 Ca 0.05 -0.85 0.05 0.00 -0.39 0.00 0.00 64.86 63.73 2k6q h ILE 66 Cb 0.26 0.00 -0.08 0.00 -3.07 0.00 0.00 36.82 33.93 2k6q h ILE 66 CO -0.00 0.00 -0.47 0.40 -0.69 0.00 0.00 178.15 177.39 2k6q h ILE 67 N -0.99 0.00 -0.98 -0.67 1.08 -0.25 0.99 117.51 116.68 2k6q h ILE 67 Ca -0.01 0.00 0.20 0.00 -0.39 0.00 0.00 64.86 64.66 2k6q h ILE 67 Cb 0.11 0.00 -0.11 0.00 -3.07 0.00 0.00 36.82 33.75 2k6q h ILE 67 CO 0.02 0.00 0.57 0.08 -0.69 0.00 0.00 178.15 178.14 2k6q h ARG 68 N -0.19 0.66 -0.08 2.37 0.11 -1.33 0.69 114.38 116.60 2k6q h ARG 68 Ca 0.09 -0.04 -0.07 0.00 0.10 0.00 0.00 59.98 60.06 2k6q h ARG 68 Cb 0.42 -0.15 -0.01 0.00 1.11 0.00 0.00 29.97 31.34 2k6q h ARG 68 CO -0.61 0.44 -0.29 0.00 0.10 0.00 0.00 179.97 179.61 2k6q h ARG 69 N 0.68 0.15 -0.11 0.08 2.47 0.52 0.10 114.38 118.28 2k6q h ARG 69 Ca 0.58 -0.05 -0.16 0.00 -1.26 0.00 0.00 59.98 59.09 2k6q h ARG 69 Cb 0.96 -0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 29.26 2k6q h ARG 69 CO -0.41 0.43 -0.61 0.00 0.56 0.00 0.00 179.97 179.94 2k6q h ARG 70 N 0.14 0.37 0.00 0.04 3.08 0.67 -2.79 114.38 115.88 2k6q h ARG 70 Ca 0.02 -0.26 0.00 0.00 0.07 0.00 0.00 59.98 59.81 2k6q h ARG 70 Cb 0.59 0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.68 2k6q h ARG 70 CO 0.04 0.87 -0.17 -0.07 -1.07 0.00 0.00 179.97 179.56 2k6q h LEU 71 N 0.27 0.00 -1.64 3.04 3.38 -0.48 -3.47 115.31 116.41 2k6q h LEU 71 Ca -0.01 -0.01 -0.62 0.00 0.09 0.00 0.00 57.88 57.33 2k6q h LEU 71 Cb 1.14 0.00 -0.30 0.00 0.09 0.00 0.00 40.66 41.60 2k6q h LEU 71 CO 0.10 0.00 -0.94 0.00 0.09 0.00 0.00 178.44 177.70 2k6q n GLN 72 N -2.93 -0.89 -1.64 1.13 10.64 0.31 -4.89 117.38 119.11 2k6q n GLN 72 Ca 0.03 0.12 -0.30 0.00 -1.83 0.00 0.00 57.00 55.03 2k6q n GLN 72 Cb 0.52 -4.17 0.19 0.00 -0.86 0.00 0.00 30.24 25.92 2k6q n GLN 72 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 2k6q s LEU 73 N -7.31 2.04 0.37 2.61 1.43 -1.25 -5.08 118.68 111.47 2k6q s LEU 73 Ca 0.42 0.47 0.08 0.00 -1.03 0.00 0.00 54.13 54.07 2k6q s LEU 73 Cb -0.25 -2.47 -0.04 0.00 0.03 0.00 0.00 46.19 43.46 2k6q s LEU 73 CO 1.01 -3.08 0.17 0.20 0.23 0.00 0.00 176.35 174.88 2k6q s ASN 74 N -4.50 4.62 0.27 2.29 0.01 -1.26 -4.98 114.94 111.40 2k6q s ASN 74 Ca 0.71 -0.86 0.00 0.00 -0.71 0.00 0.00 52.86 52.00 2k6q s ASN 74 Cb -0.07 -0.64 0.61 0.00 0.41 0.00 0.00 41.25 41.56 2k6q s ASN 74 CO 0.54 -0.39 1.70 0.00 -1.51 0.00 0.00 177.10 177.44 2k6q h ALA 75 N 1.48 1.25 -0.98 0.60 0.00 -2.03 0.87 119.26 120.45 2k6q h ALA 75 Ca -0.43 0.15 0.23 0.00 0.00 0.00 0.00 54.91 54.86 2k6q h ALA 75 Cb 1.25 0.15 -0.08 0.00 0.00 0.00 0.00 17.79 19.11 2k6q h ALA 75 CO 0.65 -0.30 0.63 -0.91 0.00 0.00 0.00 179.25 179.32 2k6q h ASN 76 N 0.39 0.47 -3.26 0.00 2.35 -2.05 -3.38 115.58 110.10 2k6q h ASN 76 Ca 0.50 0.06 -0.57 0.00 -0.55 0.00 0.00 56.30 55.74 2k6q h ASN 76 Cb 0.88 -0.02 -0.05 0.00 0.05 0.00 0.00 38.32 39.19 2k6q h ASN 76 CO -0.50 0.15 -0.03 -1.58 -1.65 0.00 0.00 177.43 173.82 2k6q s GLN 77 N -5.50 4.24 -0.08 0.81 2.00 0.30 -5.07 119.66 116.36 2k6q s GLN 77 Ca -0.09 0.74 -0.00 0.00 -2.00 0.00 0.00 55.36 54.01 2k6q s GLN 77 Cb 0.24 -3.28 -0.03 0.00 0.80 0.00 0.00 33.01 30.74 2k6q s GLN 77 CO 0.79 0.54 -0.05 0.00 -0.50 0.00 0.00 175.29 176.07 2k6q s ALA 78 N -0.78 3.04 -0.07 1.58 0.00 -1.26 -4.58 121.76 119.69 2k6q s ALA 78 Ca 0.30 -0.86 0.01 0.00 0.00 0.00 0.00 51.96 51.40 2k6q s ALA 78 Cb -0.19 -1.32 0.02 0.00 0.00 0.00 0.00 23.12 21.63 2k6q s ALA 78 CO 0.18 0.54 -0.08 0.12 0.00 0.00 0.00 175.76 176.52 2k6q s PHE 79 N -0.69 1.20 -0.12 0.00 5.36 -1.26 -4.09 117.98 118.37 2k6q s PHE 79 Ca 0.11 -0.45 -0.02 0.00 -0.96 0.00 0.00 56.93 55.61 2k6q s PHE 79 Cb -0.11 -0.96 0.04 0.00 -0.34 0.00 0.00 43.02 41.65 2k6q s PHE 79 CO 0.02 -0.29 0.00 -0.06 -1.46 0.00 0.00 175.22 173.43 2k6q s PHE 80 N 0.99 0.95 -0.21 10.12 0.08 0.11 -4.95 117.98 125.07 2k6q s PHE 80 Ca -0.09 -0.52 -0.20 0.00 0.12 0.00 0.00 56.93 56.24 2k6q s PHE 80 Cb -0.15 -0.96 -0.03 0.00 -0.57 0.00 0.00 43.02 41.32 2k6q s PHE 80 CO 0.00 -0.46 0.57 -1.17 -0.10 0.00 0.00 175.22 174.06 2k6q s LEU 81 N 1.88 4.13 -0.29 -0.37 1.98 -1.26 -1.66 118.68 123.10 2k6q s LEU 81 Ca 0.03 0.74 -0.08 0.00 -2.89 0.00 0.00 54.13 51.92 2k6q s LEU 81 Cb -0.14 -2.79 -0.00 0.00 0.66 0.00 0.00 46.19 43.91 2k6q s LEU 81 CO -0.07 -0.24 0.10 -0.76 -1.89 0.00 0.00 176.35 173.50 2k6q s LEU 82 N 1.87 3.86 -0.47 -0.68 2.01 0.21 -3.94 118.68 121.53 2k6q s LEU 82 Ca 0.26 -0.55 -0.26 0.00 0.01 0.00 0.00 54.13 53.60 2k6q s LEU 82 Cb -0.16 -1.93 0.03 0.00 0.01 0.00 0.00 46.19 44.14 2k6q s LEU 82 CO 0.10 -0.16 0.95 -0.69 1.01 0.00 0.00 176.35 177.55 2k6q s VAL 83 N 1.56 4.44 -0.03 -1.59 1.01 0.45 -0.28 120.40 125.95 2k6q s VAL 83 Ca 0.04 0.73 0.00 0.00 0.00 0.00 0.00 61.98 62.76 2k6q s VAL 83 Cb -0.17 -4.46 0.00 0.00 0.00 0.00 0.00 36.38 31.75 2k6q s VAL 83 CO 0.04 -0.88 0.00 -3.20 0.00 0.00 0.00 175.10 171.05 2k6q n ASN 84 N 7.27 -4.11 0.00 3.32 2.85 -0.96 -1.79 115.26 121.84 2k6q n ASN 84 Ca 0.06 0.01 0.00 0.00 -0.11 0.00 0.00 54.58 54.54 2k6q n ASN 84 Cb 0.48 -1.64 0.00 0.00 1.24 0.00 0.00 39.78 39.87 2k6q n ASN 84 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2k6q n GLY 85 N -1.54 0.84 3.07 8.20 0.00 -1.21 -4.99 105.19 109.56 2k6q n GLY 85 Ca -0.00 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.76 2k6q n GLY 85 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2k6q s HIS 86 N -2.00 1.65 1.23 1.61 -3.43 -0.74 -4.96 115.29 108.65 2k6q s HIS 86 Ca 0.00 -0.60 -0.16 0.00 -0.80 0.00 0.00 55.06 53.50 2k6q s HIS 86 Cb 0.00 -1.17 0.27 0.00 -1.43 0.00 0.00 32.58 30.25 2k6q s HIS 86 CO 0.00 -0.27 0.71 -1.13 -2.00 0.00 0.00 174.74 172.04 2k6q n SER 87 N 3.64 -2.51 -2.20 7.38 3.41 -1.26 0.17 113.62 122.24 2k6q n SER 87 Ca -0.21 -0.33 -0.28 0.00 -0.26 0.00 0.00 58.87 57.78 2k6q n SER 87 Cb 0.52 -1.10 0.03 0.00 -0.26 0.00 0.00 64.21 63.40 2k6q n SER 87 CO 0.00 0.00 0.00 1.15 -0.16 0.00 0.00 175.04 176.03 2k6q n MET 88 N -4.33 3.31 -0.59 4.33 0.00 -1.25 -4.59 117.12 113.99 2k6q n MET 88 Ca 0.04 -3.94 0.46 0.00 0.00 0.00 0.00 57.70 54.26 2k6q n MET 88 Cb 0.56 -2.28 0.72 0.00 0.00 0.00 0.00 33.22 32.22 2k6q n MET 88 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 175.97 177.30 2k6q n VAL 89 N -0.73 -0.07 -3.94 3.17 0.24 -1.26 -2.83 118.33 112.90 2k6q n VAL 89 Ca 0.49 1.47 -0.31 0.00 -2.04 0.00 0.00 64.34 63.95 2k6q n VAL 89 Cb 0.81 -2.43 -0.15 0.00 -1.47 0.00 0.00 33.84 30.60 2k6q n VAL 89 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 2k6q s SER 90 N -4.00 4.41 -0.75 -1.34 0.01 -1.26 -5.05 113.70 105.73 2k6q s SER 90 Ca -0.05 -1.80 -0.06 0.00 1.31 0.00 0.00 55.95 55.34 2k6q s SER 90 Cb 0.26 -1.37 0.19 0.00 0.21 0.00 0.00 66.02 65.31 2k6q s SER 90 CO 0.81 -0.35 0.62 0.54 0.41 0.00 0.00 173.24 175.27 2k6q s VAL 91 N 1.17 4.47 -0.07 3.43 0.11 -1.13 -4.77 120.40 123.61 2k6q s VAL 91 Ca 0.06 -2.98 0.10 0.00 -2.93 0.00 0.00 61.98 56.24 2k6q s VAL 91 Cb -0.19 -3.82 0.16 0.00 -1.53 0.00 0.00 36.38 31.00 2k6q s VAL 91 CO -0.11 -0.97 1.06 -1.20 -3.33 0.00 0.00 175.10 170.55 2k6q n SER 92 N 3.42 1.49 -4.18 3.54 7.64 -1.26 -4.88 113.62 119.38 2k6q n SER 92 Ca 0.12 -2.55 -0.22 0.00 1.01 0.00 0.00 58.87 57.23 2k6q n SER 92 Cb 0.40 -0.30 -0.14 0.00 -1.01 0.00 0.00 64.21 63.17 2k6q n SER 92 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2k6q s THR 93 N -1.68 1.32 0.24 0.44 2.01 -1.26 -5.11 115.64 111.60 2k6q s THR 93 Ca 0.18 -1.05 -0.30 0.00 0.31 0.00 0.00 61.69 60.83 2k6q s THR 93 Cb 0.15 -1.17 -0.09 0.00 0.01 0.00 0.00 72.50 71.41 2k6q s THR 93 CO 0.02 0.09 1.09 -2.16 -0.69 0.00 0.00 174.62 172.97 2k6q s PRO 94 N -1.11 4.63 0.60 4.92 0.04 -1.26 -2.74 135.00 140.08 2k6q s PRO 94 Ca 0.04 1.76 0.28 0.00 0.04 0.00 0.00 61.00 63.12 2k6q s PRO 94 Cb -0.08 -3.22 1.25 0.00 0.04 0.00 0.00 34.50 32.48 2k6q s PRO 94 CO 0.01 0.18 1.64 0.97 0.04 0.00 0.00 177.00 179.84 2k6q h ILE 95 N 3.33 0.19 -0.50 0.56 6.09 -1.80 1.19 117.51 126.57 2k6q h ILE 95 Ca -0.46 0.00 -0.05 0.00 -1.37 0.00 0.00 64.86 62.98 2k6q h ILE 95 Cb 1.21 0.35 -0.02 0.00 0.47 0.00 0.00 36.82 38.83 2k6q h ILE 95 CO 0.69 0.00 0.12 0.77 -3.07 0.00 0.00 178.15 176.66 2k6q h SER 96 N 0.00 0.75 0.00 2.19 4.64 -1.87 -1.88 113.55 117.38 2k6q h SER 96 Ca 0.33 -0.23 -0.01 0.00 -0.47 0.00 0.00 61.79 61.41 2k6q h SER 96 Cb 1.92 -0.20 -0.00 0.00 -0.31 0.00 0.00 62.40 63.81 2k6q h SER 96 CO -0.00 0.79 -0.08 -0.33 -0.87 0.00 0.00 176.83 176.33 2k6q h GLU 97 N 0.68 0.00 -1.58 4.77 5.08 0.97 -2.54 114.58 121.97 2k6q h GLU 97 Ca 0.16 0.00 0.46 0.00 -1.00 0.00 0.00 59.36 58.98 2k6q h GLU 97 Cb 0.33 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 29.50 2k6q h GLU 97 CO 0.00 0.54 1.11 0.28 -1.00 0.00 0.00 179.01 179.94 2k6q h VAL 98 N -1.00 0.17 0.11 3.13 2.07 -0.98 1.06 116.25 120.82 2k6q h VAL 98 Ca -0.02 -0.01 -0.17 0.00 0.82 0.00 0.00 66.70 67.32 2k6q h VAL 98 Cb 0.58 0.14 0.01 0.00 -1.52 0.00 0.00 31.29 30.50 2k6q h VAL 98 CO -0.01 0.01 -0.78 0.22 0.02 0.00 0.00 177.57 177.02 2k6q h TYR 99 N 0.03 0.43 0.00 1.57 5.03 -1.40 -2.12 116.97 120.51 2k6q h TYR 99 Ca 0.79 -0.32 0.00 0.00 2.58 0.00 0.00 58.73 61.78 2k6q h TYR 99 Cb 3.00 -0.02 0.00 0.00 1.55 0.00 0.00 36.73 41.26 2k6q h TYR 99 CO -0.00 1.30 0.00 -0.85 -1.32 0.00 0.00 178.16 177.29 2k6q n GLU 100 N -4.18 0.35 0.00 1.82 0.28 0.29 0.19 120.64 119.39 2k6q n GLU 100 Ca -0.15 0.08 0.04 0.00 -0.16 0.00 0.00 57.16 56.97 2k6q n GLU 100 Cb 0.78 -1.50 -0.02 0.00 1.43 0.00 0.00 31.44 32.13 2k6q n GLU 100 CO 0.00 0.00 0.00 0.43 -0.16 0.00 0.00 177.13 177.40 2k6q n SER 101 N -1.22 0.76 0.05 -1.84 7.64 0.28 -4.79 113.62 114.51 2k6q n SER 101 Ca 0.10 -0.88 0.00 0.00 1.01 0.00 0.00 58.87 59.10 2k6q n SER 101 Cb 0.13 0.70 0.00 0.00 -1.01 0.00 0.00 64.21 64.03 2k6q n SER 101 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2k6q n GLU 102 N -0.68 0.00 -1.02 1.43 -0.58 -0.68 -5.03 120.64 114.08 2k6q n GLU 102 Ca 0.02 0.00 -0.32 0.00 -0.42 0.00 0.00 57.16 56.44 2k6q n GLU 102 Cb 0.15 -0.38 0.01 0.00 -0.57 0.00 0.00 31.44 30.65 2k6q n GLU 102 CO 0.00 0.00 0.00 2.89 -0.48 0.00 0.00 177.13 179.54 2k6q n ARG 103 N -3.33 0.00 -3.02 3.49 -4.01 0.51 -4.97 116.66 105.33 2k6q n ARG 103 Ca 0.00 0.00 -0.19 0.00 -1.04 0.00 0.00 57.85 56.62 2k6q n ARG 103 Cb 0.11 -0.84 0.05 0.00 -3.04 0.00 0.00 32.46 28.73 2k6q n ARG 103 CO 0.00 0.00 0.00 -0.25 -3.04 0.00 0.00 177.63 174.34 2k6q n ASP 104 N 2.21 2.11 -0.30 2.89 10.43 -1.26 -4.88 116.55 127.74 2k6q n ASP 104 Ca 0.06 -2.49 0.11 0.00 2.57 0.00 0.00 54.79 55.04 2k6q n ASP 104 Cb 0.40 -0.30 0.28 0.00 1.84 0.00 0.00 41.12 43.35 2k6q n ASP 104 CO 0.00 0.00 0.00 -0.33 -1.07 0.00 0.00 177.20 175.80 2k6q h GLU 105 N 0.00 0.47 -0.86 -1.24 5.08 -1.94 0.21 114.58 116.29 2k6q h GLU 105 Ca -0.27 -0.03 0.22 0.00 -1.00 0.00 0.00 59.36 58.29 2k6q h GLU 105 Cb 1.15 -0.11 -0.15 0.00 0.50 0.00 0.00 28.75 30.15 2k6q h GLU 105 CO 0.39 0.31 0.12 0.38 -1.00 0.00 0.00 179.01 179.21 2k6q h ASP 106 N 0.48 -0.21 0.00 1.42 2.03 -1.95 -3.45 116.42 114.74 2k6q h ASP 106 Ca 0.53 0.21 0.00 0.00 -0.73 0.00 0.00 57.03 57.04 2k6q h ASP 106 Cb 0.93 0.34 0.00 0.00 -0.83 0.00 0.00 39.33 39.77 2k6q h ASP 106 CO -0.47 -0.21 0.00 0.61 -1.03 0.00 0.00 179.24 178.14 2k6q n GLY 107 N -1.42 1.09 3.35 7.15 0.00 0.72 -4.61 105.19 111.47 2k6q n GLY 107 Ca 0.19 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.88 2k6q n GLY 107 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2k6q s PHE 108 N -2.00 2.75 0.20 1.61 0.08 -1.26 -4.69 117.98 114.67 2k6q s PHE 108 Ca 0.00 -0.68 -0.25 0.00 0.12 0.00 0.00 56.93 56.12 2k6q s PHE 108 Cb 0.00 -1.79 -0.08 0.00 -0.57 0.00 0.00 43.02 40.57 2k6q s PHE 108 CO 0.00 -0.22 0.81 -0.51 -0.10 0.00 0.00 175.22 175.20 2k6q s LEU 109 N 0.25 4.53 -0.25 -0.37 1.43 -1.14 -4.00 118.68 119.12 2k6q s LEU 109 Ca -0.11 1.67 0.01 0.00 -1.03 0.00 0.00 54.13 54.67 2k6q s LEU 109 Cb -0.16 -3.47 0.05 0.00 0.03 0.00 0.00 46.19 42.63 2k6q s LEU 109 CO 0.06 0.14 -0.09 -0.31 0.23 0.00 0.00 176.35 176.37 2k6q s TYR 110 N -1.28 3.16 0.14 0.29 2.02 -1.26 0.19 117.35 120.61 2k6q s TYR 110 Ca 0.39 -2.00 0.09 0.00 -0.37 0.00 0.00 57.07 55.19 2k6q s TYR 110 Cb -0.22 -1.98 -0.04 0.00 -0.40 0.00 0.00 41.96 39.32 2k6q s TYR 110 CO 0.26 -0.83 -0.20 -1.64 -1.57 0.00 0.00 175.55 171.57 2k6q s MET 111 N 1.20 1.25 -0.08 -0.62 -1.94 -0.54 -2.26 119.30 116.31 2k6q s MET 111 Ca -0.04 -1.32 0.01 0.00 -1.71 0.00 0.00 55.69 52.63 2k6q s MET 111 Cb -0.18 -1.43 0.02 0.00 2.01 0.00 0.00 34.83 35.24 2k6q s MET 111 CO -0.05 0.31 -0.11 0.08 -0.01 0.00 0.00 175.02 175.24 2k6q s VAL 112 N -1.62 1.09 0.19 -6.03 1.01 0.61 -1.19 120.40 114.46 2k6q s VAL 112 Ca 0.13 -0.42 0.09 0.00 0.00 0.00 0.00 61.98 61.78 2k6q s VAL 112 Cb -0.08 -1.03 -0.04 0.00 0.00 0.00 0.00 36.38 35.23 2k6q s VAL 112 CO 0.06 0.36 -0.13 -0.72 0.00 0.00 0.00 175.10 174.67 2k6q s TYR 113 N 0.97 2.56 0.17 5.22 -0.85 -0.85 0.68 117.35 125.25 2k6q s TYR 113 Ca -0.09 -0.25 -0.22 0.00 -0.52 0.00 0.00 57.07 55.99 2k6q s TYR 113 Cb -0.15 -1.25 0.08 0.00 0.38 0.00 0.00 41.96 41.02 2k6q s TYR 113 CO 0.00 0.52 1.06 0.00 -1.52 0.00 0.00 175.55 175.61 2k6q s ALA 114 N -1.73 -1.66 -0.53 9.51 0.00 -0.66 -1.25 121.76 125.44 2k6q s ALA 114 Ca 0.24 -0.36 0.04 0.00 0.00 0.00 0.00 51.96 51.88 2k6q s ALA 114 Cb -0.08 0.79 0.28 0.00 0.00 0.00 0.00 23.12 24.11 2k6q s ALA 114 CO 0.14 -1.07 1.09 -1.13 0.00 0.00 0.00 175.76 174.78 2k6q n SER 115 N -1.28 2.91 -3.78 0.00 3.41 -1.26 0.07 113.62 113.69 2k6q n SER 115 Ca -0.02 -2.42 -0.13 0.00 -0.26 0.00 0.00 58.87 56.04 2k6q n SER 115 Cb 0.59 -0.59 -0.09 0.00 -0.26 0.00 0.00 64.21 63.87 2k6q n SER 115 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 175.04 173.30 2k6q s GLN 116 N -1.47 0.62 0.00 4.33 0.74 -1.26 -4.76 119.66 117.86 2k6q s GLN 116 Ca 0.20 -0.22 0.00 0.00 0.05 0.00 0.00 55.36 55.39 2k6q s GLN 116 Cb 0.16 0.27 0.00 0.00 1.10 0.00 0.00 33.01 34.54 2k6q s GLN 116 CO 0.05 -0.17 0.35 -1.91 -0.55 0.00 0.00 175.29 173.06 2k6q n GLU 117 N 1.35 0.12 -3.53 1.67 2.13 -1.26 -4.53 120.64 116.58 2k6q n GLU 117 Ca -0.22 -0.35 -0.29 0.00 0.66 0.00 0.00 57.16 56.97 2k6q n GLU 117 Cb 0.56 -0.83 -0.12 0.00 0.27 0.00 0.00 31.44 31.32 2k6q n GLU 117 CO 0.00 0.00 0.00 0.95 -0.41 0.00 0.00 177.13 177.67 2k6q s THR 118 N -0.12 0.59 -0.04 6.31 -4.23 -1.26 -4.69 115.64 112.20 2k6q s THR 118 Ca 0.00 -2.16 0.03 0.00 -1.18 0.00 0.00 61.69 58.37 2k6q s THR 118 Cb 0.00 -1.42 -0.04 0.00 1.34 0.00 0.00 72.50 72.38 2k6q s THR 118 CO 0.00 -1.01 0.00 2.22 -0.54 0.00 0.00 174.62 175.30 2k6q n PHE 119 N 3.65 0.00 0.00 3.99 -1.74 -1.26 -5.25 117.46 116.86 2k6q n PHE 119 Ca 0.14 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 57.03 2k6q n PHE 119 Cb 0.38 -0.17 0.00 0.00 1.52 0.00 0.00 39.48 41.21 2k6q n PHE 119 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61