#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k6q s MET 1 N 0.00 3.56 0.00 1.43 1.00 -1.26 -4.97 119.30 119.06 2k6q s MET 1 Ca 0.00 -0.23 0.24 0.00 0.00 0.00 0.00 55.69 55.70 2k6q s MET 1 Cb 0.00 -2.77 1.42 0.00 0.00 0.00 0.00 34.83 33.47 2k6q s MET 1 CO 0.00 0.33 1.79 -0.35 0.00 0.00 0.00 175.02 176.80 2k6q n PRO 2 N -0.78 0.73 -3.39 2.03 -0.04 -1.26 -4.57 135.00 127.72 2k6q n PRO 2 Ca -0.04 0.00 -0.43 0.00 -0.04 0.00 0.00 63.50 62.99 2k6q n PRO 2 Cb 0.54 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 32.41 2k6q n PRO 2 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2k6q s SER 3 N -2.03 6.15 0.29 3.54 0.15 -1.26 -5.04 113.70 115.50 2k6q s SER 3 Ca 0.35 -0.96 -0.30 0.00 0.70 0.00 0.00 55.95 55.74 2k6q s SER 3 Cb 0.16 -2.19 -0.12 0.00 -1.71 0.00 0.00 66.02 62.16 2k6q s SER 3 CO 0.28 -0.56 1.54 1.21 1.20 0.00 0.00 173.24 176.90 2k6q n GLU 4 N 5.34 2.52 -0.46 5.44 4.07 -1.26 -4.95 120.64 131.34 2k6q n GLU 4 Ca -0.10 0.90 -0.17 0.00 -0.06 0.00 0.00 57.16 57.73 2k6q n GLU 4 Cb 0.46 -2.64 0.16 0.00 -0.06 0.00 0.00 31.44 29.36 2k6q n GLU 4 CO 0.00 0.00 0.00 1.63 -0.06 0.00 0.00 177.13 178.70 2k6q n LYS 5 N 1.98 -1.77 -4.33 5.31 4.76 -1.26 -5.02 118.16 117.83 2k6q n LYS 5 Ca 0.09 -0.80 -0.25 0.00 -2.87 0.00 0.00 58.31 54.48 2k6q n LYS 5 Cb 0.36 -1.49 -0.13 0.00 -1.84 0.00 0.00 35.03 31.93 2k6q n LYS 5 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 2k6q s THR 6 N -2.05 1.81 0.59 -0.18 -4.23 -1.26 -4.82 115.64 105.50 2k6q s THR 6 Ca 0.37 -1.56 0.34 0.00 -1.18 0.00 0.00 61.69 59.66 2k6q s THR 6 Cb -0.06 -1.63 0.50 0.00 1.34 0.00 0.00 72.50 72.65 2k6q s THR 6 CO 0.31 -0.01 1.49 2.19 -0.54 0.00 0.00 174.62 178.05 2k6q h PHE 7 N 4.09 0.00 -0.04 3.99 -5.15 -1.95 1.72 116.94 119.61 2k6q h PHE 7 Ca -0.47 0.00 -0.04 0.00 -0.20 0.00 0.00 57.97 57.26 2k6q h PHE 7 Cb 1.18 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.35 2k6q h PHE 7 CO 0.60 0.00 -0.14 1.57 -2.00 0.00 0.00 178.31 178.34 2k6q h LYS 8 N 0.00 0.17 0.00 6.09 2.10 -1.95 -2.98 116.57 119.99 2k6q h LYS 8 Ca 0.59 -0.13 0.00 0.00 -2.00 0.00 0.00 60.65 59.12 2k6q h LYS 8 Cb 2.92 0.02 0.00 0.00 -0.90 0.00 0.00 32.23 34.27 2k6q h LYS 8 CO -0.01 0.76 -0.15 1.96 -2.00 0.00 0.00 179.45 180.02 2k6q h GLN 9 N -0.39 0.00 0.00 0.07 1.08 0.16 -3.40 115.11 112.63 2k6q h GLN 9 Ca -0.01 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.19 2k6q h GLN 9 Cb 0.78 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.21 2k6q h GLN 9 CO 0.03 0.00 0.00 -2.13 -0.95 0.00 0.00 178.83 175.78 2k6q n ARG 10 N -3.43 0.00 -2.11 1.46 3.00 0.39 -4.17 116.66 111.80 2k6q n ARG 10 Ca -0.02 0.73 -0.43 0.00 -0.00 0.00 0.00 57.85 58.13 2k6q n ARG 10 Cb 0.08 -1.35 -0.03 0.00 0.00 0.00 0.00 32.46 31.16 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 -2.41 3.89 0.15 -0.14 3.00 -1.13 -4.92 118.95 117.39 2k6q s ARG 11 Ca 0.00 1.76 -0.34 0.00 0.00 0.00 0.00 55.73 57.14 2k6q s ARG 11 Cb 0.00 -4.01 -0.14 0.00 0.00 0.00 0.00 34.95 30.80 2k6q s ARG 11 CO 0.00 -1.17 1.53 0.43 0.00 0.00 0.00 175.30 176.09 2k6q n SER 12 N 8.09 2.81 -0.06 0.23 7.64 -1.26 -4.35 113.62 126.73 2k6q n SER 12 Ca 0.18 1.09 -0.07 0.00 1.01 0.00 0.00 58.87 61.08 2k6q n SER 12 Cb 0.45 -1.38 -0.05 0.00 -1.01 0.00 0.00 64.21 62.22 2k6q n SER 12 CO 0.00 0.00 0.00 0.15 -3.01 0.00 0.00 175.04 172.18 2k6q h PHE 13 N 5.65 -0.85 -0.01 1.43 3.57 -1.85 0.81 116.94 125.69 2k6q h PHE 13 Ca -0.45 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.09 2k6q h PHE 13 Cb 1.27 0.39 -0.00 0.00 2.79 0.00 0.00 35.95 40.40 2k6q h PHE 13 CO 0.62 -0.25 0.38 0.93 -2.23 0.00 0.00 178.31 177.76 2k6q h GLU 14 N -0.22 0.00 0.01 1.11 5.08 -1.98 1.20 114.58 119.78 2k6q h GLU 14 Ca 0.03 0.00 -0.25 0.00 -1.00 0.00 0.00 59.36 58.14 2k6q h GLU 14 Cb 0.31 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.52 2k6q h GLU 14 CO -0.28 0.00 -1.31 1.96 -1.00 0.00 0.00 179.01 178.37 2k6q h GLN 15 N 0.00 0.02 0.00 2.33 1.08 0.02 -2.61 115.11 115.96 2k6q h GLN 15 Ca 0.00 -0.03 0.00 0.00 -1.45 0.00 0.00 58.65 57.17 2k6q h GLN 15 Cb 0.77 0.01 0.00 0.00 -0.05 0.00 0.00 27.48 28.21 2k6q h GLN 15 CO -0.00 0.81 -1.02 -2.13 -0.95 0.00 0.00 178.83 175.54 2k6q n ARG 16 N -3.24 0.55 0.07 1.46 0.63 0.35 -3.85 116.66 112.62 2k6q n ARG 16 Ca -0.08 0.09 -0.22 0.00 -0.92 0.00 0.00 57.85 56.73 2k6q n ARG 16 Cb 0.99 -1.78 -0.15 0.00 0.45 0.00 0.00 32.46 31.98 2k6q n ARG 16 CO 0.00 0.00 0.00 -0.39 -2.51 0.00 0.00 177.63 174.73 2k6q h VAL 17 N 0.00 1.33 -0.04 5.15 -1.51 0.37 -3.24 116.25 118.31 2k6q h VAL 17 Ca 0.00 -2.55 0.01 0.00 -1.23 0.00 0.00 66.70 62.94 2k6q h VAL 17 Cb 0.95 3.04 -0.00 0.00 -2.13 0.00 0.00 31.29 33.15 2k6q h VAL 17 CO 0.00 0.74 0.08 -0.08 -1.23 0.00 0.00 177.57 177.09 2k6q h GLU 18 N -0.21 0.00 0.54 5.19 4.57 -1.60 -2.04 114.58 121.02 2k6q h GLU 18 Ca -0.21 0.00 -0.03 0.00 -1.18 0.00 0.00 59.36 57.94 2k6q h GLU 18 Cb 1.81 0.00 0.01 0.00 -0.16 0.00 0.00 28.75 30.41 2k6q h GLU 18 CO 0.16 0.00 -0.26 0.22 -1.18 0.00 0.00 179.01 177.95 2k6q h ASP 19 N 0.00 -0.62 -0.80 1.04 -0.00 -1.66 -3.07 116.42 111.31 2k6q h ASP 19 Ca 0.02 -0.05 0.17 0.00 -0.00 0.00 0.00 57.03 57.17 2k6q h ASP 19 Cb 0.18 0.16 -0.11 0.00 -0.00 0.00 0.00 39.33 39.57 2k6q h ASP 19 CO -0.00 -0.25 0.30 1.62 -0.00 0.00 0.00 179.24 180.91 2k6q h VAL 20 N -1.04 0.57 -1.09 2.25 3.04 -1.47 0.20 116.25 118.71 2k6q h VAL 20 Ca -0.07 -0.13 0.41 0.00 -1.01 0.00 0.00 66.70 65.89 2k6q h VAL 20 Cb 0.63 0.14 -0.15 0.00 -2.01 0.00 0.00 31.29 29.90 2k6q h VAL 20 CO 0.12 0.07 0.65 -1.14 -1.01 0.00 0.00 177.57 176.27 2k6q n ARG 21 N -5.05 -0.05 0.30 4.17 0.63 -1.01 0.72 116.66 116.37 2k6q n ARG 21 Ca 0.17 1.22 -0.13 0.00 -0.92 0.00 0.00 57.85 58.19 2k6q n ARG 21 Cb 0.50 -2.29 -0.06 0.00 0.45 0.00 0.00 32.46 31.05 2k6q n ARG 21 CO 0.00 0.00 0.00 -0.07 -2.51 0.00 0.00 177.63 175.05 2k6q h LEU 22 N 0.00 -0.69 -2.07 6.15 3.38 -0.65 -2.51 115.31 118.93 2k6q h LEU 22 Ca 0.80 0.00 0.06 0.00 0.09 0.00 0.00 57.88 58.83 2k6q h LEU 22 Cb 2.34 0.18 -0.01 0.00 0.09 0.00 0.00 40.66 43.26 2k6q h LEU 22 CO -0.58 -0.30 0.34 -0.29 0.09 0.00 0.00 178.44 177.71 2k6q h ILE 23 N -1.18 0.25 -0.09 1.22 6.09 0.29 0.85 117.51 124.93 2k6q h ILE 23 Ca -0.08 0.00 -0.14 0.00 -1.37 0.00 0.00 64.86 63.27 2k6q h ILE 23 Cb 0.64 0.70 -0.01 0.00 0.47 0.00 0.00 36.82 38.63 2k6q h ILE 23 CO 0.14 0.00 -0.56 0.03 -3.07 0.00 0.00 178.15 174.69 2k6q h ARG 24 N 0.00 0.26 -0.01 2.19 2.47 0.51 0.97 114.38 120.76 2k6q h ARG 24 Ca 0.10 -0.16 0.00 0.00 -1.26 0.00 0.00 59.98 58.65 2k6q h ARG 24 Cb 0.78 0.02 0.00 0.00 -1.65 0.00 0.00 29.97 29.12 2k6q h ARG 24 CO -0.00 0.75 -0.48 -0.85 0.56 0.00 0.00 179.97 179.95 2k6q n GLU 25 N -3.91 1.24 -0.04 0.04 0.28 0.24 -4.04 120.64 114.45 2k6q n GLU 25 Ca -0.02 -0.93 -0.06 0.00 -0.16 0.00 0.00 57.16 55.99 2k6q n GLU 25 Cb 0.59 -1.45 -0.02 0.00 1.43 0.00 0.00 31.44 31.99 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 -0.10 0.33 -3.80 3.44 6.02 0.19 -4.86 117.38 118.60 2k6q n GLN 26 Ca 0.09 0.13 -0.28 0.00 -0.01 0.00 0.00 57.00 56.93 2k6q n GLN 26 Cb 0.44 -1.08 -0.11 0.00 1.02 0.00 0.00 30.24 30.51 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 -4.09 3.38 0.17 1.08 8.25 0.33 -4.87 115.22 119.47 2k6q n HIS 27 Ca -0.09 -4.28 0.05 0.00 -0.26 0.00 0.00 57.72 53.14 2k6q n HIS 27 Cb 0.33 -0.64 0.24 0.00 1.12 0.00 0.00 29.99 31.04 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 5.18 0.00 -0.83 -0.41 0.13 -1.67 -2.89 132.00 131.51 2k6q h PRO 28 Ca 0.16 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.26 2k6q h PRO 28 Cb 0.74 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.85 2k6q h PRO 28 CO 0.75 0.41 0.03 0.25 -0.23 0.00 0.00 178.00 179.21 2k6q n THR 29 N -3.40 1.36 -4.20 1.56 -2.24 -1.26 -4.84 114.28 101.26 2k6q n THR 29 Ca 0.01 -0.67 -0.14 0.00 -2.27 0.00 0.00 64.05 60.97 2k6q n THR 29 Cb 0.58 -0.44 -0.11 0.00 -2.10 0.00 0.00 70.33 68.27 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 -1.78 0.91 -0.23 -0.78 -0.14 -1.09 -2.80 119.74 113.82 2k6q s LYS 30 Ca 0.25 -1.25 -0.06 0.00 -1.36 0.00 0.00 55.97 53.55 2k6q s LYS 30 Cb 0.20 -0.55 -0.03 0.00 -1.68 0.00 0.00 37.83 35.77 2k6q s LYS 30 CO 0.07 0.08 0.04 0.42 -0.76 0.00 0.00 175.35 175.19 2k6q s ILE 31 N -2.76 4.13 0.32 2.17 -1.09 0.10 -4.86 121.20 119.21 2k6q s ILE 31 Ca 0.09 -0.24 -0.28 0.00 -2.23 0.00 0.00 60.65 57.99 2k6q s ILE 31 Cb -0.01 -2.91 -0.09 0.00 -1.58 0.00 0.00 42.46 37.87 2k6q s ILE 31 CO -0.00 0.38 1.07 -2.16 -1.23 0.00 0.00 174.94 173.00 2k6q s PRO 32 N 1.36 4.50 0.12 2.79 0.04 -1.26 -2.70 135.00 139.85 2k6q s PRO 32 Ca 0.05 1.69 -0.08 0.00 0.04 0.00 0.00 61.00 62.70 2k6q s PRO 32 Cb -0.15 -2.99 -0.01 0.00 0.04 0.00 0.00 34.50 31.40 2k6q s PRO 32 CO 0.02 0.12 0.22 0.14 0.04 0.00 0.00 177.00 177.53 2k6q s VAL 33 N -1.32 0.11 -0.33 -0.36 -7.23 -1.22 -2.66 120.40 107.38 2k6q s VAL 33 Ca 0.49 -1.32 -0.01 0.00 -1.81 0.00 0.00 61.98 59.33 2k6q s VAL 33 Cb -0.28 -1.59 0.11 0.00 0.56 0.00 0.00 36.38 35.19 2k6q s VAL 33 CO 0.36 -0.50 0.16 -0.63 -0.31 0.00 0.00 175.10 174.17 2k6q s ILE 34 N -3.92 0.44 -0.24 -0.62 -1.09 0.51 -3.57 121.20 112.71 2k6q s ILE 34 Ca 0.11 -1.42 -0.16 0.00 -2.23 0.00 0.00 60.65 56.96 2k6q s ILE 34 Cb 0.04 -1.34 -0.04 0.00 -1.58 0.00 0.00 42.46 39.55 2k6q s ILE 34 CO -0.06 -0.80 0.40 -0.63 -1.23 0.00 0.00 174.94 172.61 2k6q s ILE 35 N 1.47 5.17 0.39 2.92 1.01 -0.71 -1.88 121.20 129.57 2k6q s ILE 35 Ca 0.13 0.65 0.04 0.00 0.00 0.00 0.00 60.65 61.47 2k6q s ILE 35 Cb -0.19 -3.72 -0.04 0.00 0.01 0.00 0.00 42.46 38.52 2k6q s ILE 35 CO -0.19 0.18 0.08 -1.61 0.00 0.00 0.00 174.94 173.41 2k6q s GLU 36 N 1.82 1.87 -0.02 2.79 0.41 -0.75 -4.35 118.70 120.47 2k6q s GLU 36 Ca 0.17 -2.11 -0.25 0.00 -0.41 0.00 0.00 54.97 52.37 2k6q s GLU 36 Cb -0.15 -0.86 -0.04 0.00 -1.78 0.00 0.00 34.13 31.29 2k6q s GLU 36 CO 0.09 -0.34 0.76 -0.98 -0.49 0.00 0.00 175.26 174.30 2k6q s ARG 37 N -3.80 4.47 0.26 1.61 1.70 -1.26 -2.16 118.95 119.77 2k6q s ARG 37 Ca 0.26 1.02 -0.30 0.00 -0.47 0.00 0.00 55.73 56.24 2k6q s ARG 37 Cb 0.05 -3.42 -0.13 0.00 -0.57 0.00 0.00 34.95 30.88 2k6q s ARG 37 CO 0.13 0.13 1.31 0.98 -1.08 0.00 0.00 175.30 176.77 2k6q n TYR 38 N 3.43 2.00 -1.55 5.89 4.19 -1.11 -4.78 117.16 125.23 2k6q n TYR 38 Ca -0.01 0.52 -0.40 0.00 3.31 0.00 0.00 57.90 61.32 2k6q n TYR 38 Cb 0.51 -2.41 -0.04 0.00 0.49 0.00 0.00 39.34 37.89 2k6q n TYR 38 CO 0.00 0.00 0.00 1.63 0.91 0.00 0.00 176.86 179.40 2k6q n LYS 39 N 1.51 1.26 0.00 2.98 4.01 -1.26 0.41 118.16 127.07 2k6q n LYS 39 Ca 0.10 0.18 0.00 0.00 -0.51 0.00 0.00 58.31 58.08 2k6q n LYS 39 Cb 0.32 -3.19 0.00 0.00 -0.51 0.00 0.00 35.03 31.65 2k6q n LYS 39 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2k6q n GLY 40 N 6.01 1.07 3.21 0.72 0.00 -1.26 -5.08 105.19 109.87 2k6q n GLY 40 Ca 0.37 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 46.03 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 -0.02 2.51 -0.03 1.61 -6.30 0.17 -4.89 118.70 111.75 2k6q s GLU 41 Ca 0.00 -1.23 0.10 0.00 -2.50 0.00 0.00 54.97 51.33 2k6q s GLU 41 Cb 0.00 -3.30 -0.14 0.00 0.00 0.00 0.00 34.13 30.68 2k6q s GLU 41 CO 0.00 -0.64 0.18 0.36 0.02 0.00 0.00 175.26 175.18 2k6q n LYS 42 N 4.70 0.73 0.00 4.30 -0.00 -1.26 -4.65 118.16 121.97 2k6q n LYS 42 Ca -0.13 -0.07 0.00 0.00 -0.00 0.00 0.00 58.31 58.11 2k6q n LYS 42 Cb 0.44 -1.23 0.00 0.00 -0.00 0.00 0.00 35.03 34.24 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 -1.94 0.00 -1.62 -1.58 3.00 -1.26 -4.54 117.38 109.45 2k6q n GLN 43 Ca -0.04 0.46 -0.38 0.00 -0.01 0.00 0.00 57.00 57.02 2k6q n GLN 43 Cb 0.36 -1.08 0.04 0.00 0.00 0.00 0.00 30.24 29.57 2k6q n GLN 43 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 2k6q n LEU 44 N -1.17 3.50 -4.77 1.08 4.77 -1.26 -4.98 117.00 114.17 2k6q n LEU 44 Ca 0.00 0.85 -0.30 0.00 -0.03 0.00 0.00 56.01 56.53 2k6q n LEU 44 Cb 0.00 -1.39 0.21 0.00 -2.33 0.00 0.00 43.42 39.91 2k6q n LEU 44 CO 0.00 -1.77 0.75 -2.16 -1.33 0.00 0.00 177.39 172.88 2k6q s PRO 45 N -2.61 -0.19 -0.54 3.23 0.04 -1.26 -4.96 135.00 128.70 2k6q s PRO 45 Ca 0.73 -0.21 -0.28 0.00 0.04 0.00 0.00 61.00 61.27 2k6q s PRO 45 Cb -0.44 -1.73 0.03 0.00 0.04 0.00 0.00 34.50 32.40 2k6q s PRO 45 CO 0.49 -3.00 1.21 0.08 0.04 0.00 0.00 177.00 175.82 2k6q s VAL 46 N -3.45 4.04 0.37 -0.36 1.01 -1.26 -4.96 120.40 115.79 2k6q s VAL 46 Ca 0.72 0.97 -0.22 0.00 0.00 0.00 0.00 61.98 63.45 2k6q s VAL 46 Cb -0.07 -4.65 -0.16 0.00 0.00 0.00 0.00 36.38 31.51 2k6q s VAL 46 CO 0.54 -1.21 0.17 -0.11 0.00 0.00 0.00 175.10 174.50 2k6q n LEU 47 N 8.40 -2.49 -0.37 3.92 -0.00 -1.26 -4.71 117.00 120.49 2k6q n LEU 47 Ca 0.10 0.86 0.28 0.00 -0.00 0.00 0.00 56.01 57.26 2k6q n LEU 47 Cb 0.49 -0.90 0.54 0.00 -0.00 0.00 0.00 43.42 43.55 2k6q n LEU 47 CO 0.72 -3.95 1.17 0.44 -0.00 0.00 0.00 177.39 175.76 2k6q h ASP 48 N 0.45 0.41 -0.90 1.96 3.45 -1.93 -3.43 116.42 116.42 2k6q h ASP 48 Ca -0.36 0.16 0.00 0.00 0.43 0.00 0.00 57.03 57.26 2k6q h ASP 48 Cb 1.44 0.12 0.00 0.00 -0.56 0.00 0.00 39.33 40.33 2k6q h ASP 48 CO 0.49 -0.13 0.00 2.29 -1.57 0.00 0.00 179.24 180.32 2k6q n LYS 49 N -4.87 0.00 -0.03 3.56 0.00 -1.26 -5.07 118.16 110.49 2k6q n LYS 49 Ca 0.33 0.00 -0.03 0.00 -0.00 0.00 0.00 58.31 58.61 2k6q n LYS 49 Cb 1.13 0.00 -0.04 0.00 -0.00 0.00 0.00 35.03 36.12 2k6q n LYS 49 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.40 179.81 2k6q n THR 50 N 0.00 0.34 -3.34 0.58 -1.04 -1.26 -4.83 114.28 104.72 2k6q n THR 50 Ca 0.00 -0.19 -0.38 0.00 -2.04 0.00 0.00 64.05 61.45 2k6q n THR 50 Cb 0.00 -0.83 -0.06 0.00 -1.82 0.00 0.00 70.33 67.62 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 -2.12 4.33 -0.02 -2.82 1.02 -1.26 -1.75 119.74 117.12 2k6q s LYS 51 Ca -0.04 0.40 -0.01 0.00 0.02 0.00 0.00 55.97 56.34 2k6q s LYS 51 Cb 0.02 -3.44 0.01 0.00 -0.52 0.00 0.00 37.83 33.90 2k6q s LYS 51 CO 0.18 0.16 0.04 -0.06 -0.92 0.00 0.00 175.35 174.76 2k6q s PHE 52 N 0.62 -0.03 -0.50 3.18 0.40 -1.23 -5.04 117.98 115.38 2k6q s PHE 52 Ca 0.25 0.13 -0.16 0.00 -0.60 0.00 0.00 56.93 56.55 2k6q s PHE 52 Cb -0.15 -0.07 0.10 0.00 0.51 0.00 0.00 43.02 43.41 2k6q s PHE 52 CO 0.09 -0.05 0.44 -0.51 0.70 0.00 0.00 175.22 175.89 2k6q s LEU 53 N 0.42 5.85 0.06 -0.37 1.43 -1.26 -3.45 118.68 121.35 2k6q s LEU 53 Ca -0.03 -1.52 -0.11 0.00 -1.03 0.00 0.00 54.13 51.44 2k6q s LEU 53 Cb -0.05 -2.19 -0.06 0.00 0.03 0.00 0.00 46.19 43.92 2k6q s LEU 53 CO -0.01 -0.73 0.41 0.54 0.23 0.00 0.00 176.35 176.78 2k6q s VAL 54 N 1.62 5.07 -0.01 -1.59 0.11 -1.10 -4.90 120.40 119.61 2k6q s VAL 54 Ca 0.04 0.57 -0.30 0.00 -2.93 0.00 0.00 61.98 59.35 2k6q s VAL 54 Cb -0.27 -3.66 -0.04 0.00 -1.53 0.00 0.00 36.38 30.88 2k6q s VAL 54 CO 0.05 0.36 1.20 -2.16 -3.33 0.00 0.00 175.10 171.22 2k6q s PRO 55 N -1.69 4.39 -0.57 1.54 0.04 -1.26 0.03 135.00 137.47 2k6q s PRO 55 Ca 0.31 1.71 -0.07 0.00 0.04 0.00 0.00 61.00 62.99 2k6q s PRO 55 Cb -0.15 -3.48 -0.16 0.00 0.04 0.00 0.00 34.50 30.76 2k6q s PRO 55 CO 0.17 -0.37 3.27 -0.40 0.04 0.00 0.00 177.00 179.70 2k6q n ASP 56 N 4.72 6.50 -1.03 6.66 3.85 -1.12 -3.38 116.55 132.75 2k6q n ASP 56 Ca 0.10 -2.64 -0.03 0.00 -0.71 0.00 0.00 54.79 51.51 2k6q n ASP 56 Cb 0.46 -1.43 -0.04 0.00 -1.35 0.00 0.00 41.12 38.77 2k6q n ASP 56 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2k6q n HIS 57 N 2.52 0.00 -3.19 2.11 1.44 -1.26 -4.88 115.22 111.96 2k6q n HIS 57 Ca 0.54 -0.42 0.00 0.00 -2.01 0.00 0.00 57.72 55.84 2k6q n HIS 57 Cb 0.65 0.30 0.00 0.00 0.12 0.00 0.00 29.99 31.06 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 0.11 0.00 -4.33 0.61 0.24 -1.22 -5.12 118.33 108.62 2k6q n VAL 58 Ca -0.16 0.00 -0.30 0.00 -2.04 0.00 0.00 64.34 61.84 2k6q n VAL 58 Cb 0.78 0.00 -0.11 0.00 -1.47 0.00 0.00 33.84 33.04 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 0.33 4.26 0.62 -1.34 4.22 -1.26 -3.17 114.94 118.60 2k6q s ASN 59 Ca 0.00 -0.39 0.24 0.00 -2.14 0.00 0.00 52.86 50.57 2k6q s ASN 59 Cb 0.00 -0.79 1.13 0.00 1.28 0.00 0.00 41.25 42.87 2k6q s ASN 59 CO 0.00 0.20 1.59 0.00 -2.04 0.00 0.00 177.10 176.86 2k6q h MET 60 N 3.88 0.00 0.30 3.55 -0.00 -1.81 0.18 114.93 121.03 2k6q h MET 60 Ca -0.49 0.00 -0.01 0.00 -0.00 0.00 0.00 59.70 59.20 2k6q h MET 60 Cb 1.17 0.00 -0.00 0.00 -0.00 0.00 0.00 31.60 32.76 2k6q h MET 60 CO 0.51 0.00 -0.18 1.03 -0.00 0.00 0.00 176.91 178.27 2k6q h SER 61 N 0.00 -0.45 -0.86 -0.10 0.87 -1.89 -2.73 113.55 108.37 2k6q h SER 61 Ca 0.22 0.03 0.16 0.00 -1.23 0.00 0.00 61.79 60.97 2k6q h SER 61 Cb 1.71 0.14 -0.16 0.00 -0.44 0.00 0.00 62.40 63.65 2k6q h SER 61 CO -0.00 -0.29 -0.28 -0.33 -0.53 0.00 0.00 176.83 175.39 2k6q h GLU 62 N -0.46 -0.03 -0.87 2.24 4.39 -1.04 0.88 114.58 119.70 2k6q h GLU 62 Ca -0.03 0.00 0.23 0.00 0.34 0.00 0.00 59.36 59.90 2k6q h GLU 62 Cb 0.38 0.01 -0.15 0.00 -0.10 0.00 0.00 28.75 28.89 2k6q h GLU 62 CO 0.03 -0.02 0.11 1.25 -1.16 0.00 0.00 179.01 179.22 2k6q h LEU 63 N -0.03 -0.24 -0.99 1.33 6.46 -1.57 1.62 115.31 121.89 2k6q h LEU 63 Ca 0.37 0.22 0.03 0.00 -0.12 0.00 0.00 57.88 58.38 2k6q h LEU 63 Cb 0.62 0.35 -0.06 0.00 -0.73 0.00 0.00 40.66 40.84 2k6q h LEU 63 CO -0.89 -0.22 0.65 0.40 -0.62 0.00 0.00 178.44 177.76 2k6q h ILE 64 N 0.12 1.19 0.00 4.05 1.08 0.83 0.67 117.51 125.44 2k6q h ILE 64 Ca 0.52 -0.44 -0.04 0.00 -0.39 0.00 0.00 64.86 64.52 2k6q h ILE 64 Cb 1.03 -0.19 -0.01 0.00 -3.07 0.00 0.00 36.82 34.58 2k6q h ILE 64 CO -0.73 0.23 -0.19 0.11 -0.69 0.00 0.00 178.15 176.88 2k6q h LYS 65 N 1.27 0.00 0.10 2.37 1.57 0.28 -0.08 116.57 122.07 2k6q h LYS 65 Ca 0.39 0.00 -0.28 0.00 -1.87 0.00 0.00 60.65 58.88 2k6q h LYS 65 Cb -0.03 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.27 2k6q h LYS 65 CO -0.12 0.19 -1.39 0.82 -0.57 0.00 0.00 179.45 178.39 2k6q h ILE 66 N 0.00 1.31 0.04 1.86 1.08 0.27 -2.91 117.51 119.16 2k6q h ILE 66 Ca -0.00 -2.95 -0.00 0.00 -0.39 0.00 0.00 64.86 61.51 2k6q h ILE 66 Cb 0.64 2.81 0.00 0.00 -3.07 0.00 0.00 36.82 37.19 2k6q h ILE 66 CO 0.03 0.84 -0.02 0.40 -0.69 0.00 0.00 178.15 178.71 2k6q h ILE 67 N 0.06 0.00 -1.26 -0.67 1.08 0.62 -2.75 117.51 114.59 2k6q h ILE 67 Ca -0.18 -0.05 0.37 0.00 -0.39 0.00 0.00 64.86 64.61 2k6q h ILE 67 Cb 1.97 0.00 -0.10 0.00 -3.07 0.00 0.00 36.82 35.62 2k6q h ILE 67 CO 0.17 0.00 0.84 0.08 -0.69 0.00 0.00 178.15 178.55 2k6q h ARG 68 N -0.10 0.16 -0.85 2.37 0.11 -1.21 1.28 114.38 116.14 2k6q h ARG 68 Ca -0.00 -0.01 -0.03 0.00 0.10 0.00 0.00 59.98 60.04 2k6q h ARG 68 Cb 0.04 -0.04 -0.04 0.00 1.11 0.00 0.00 29.97 31.04 2k6q h ARG 68 CO 0.01 0.11 0.42 0.00 0.10 0.00 0.00 179.97 180.61 2k6q h ARG 69 N 0.16 1.21 0.07 0.08 -0.00 -1.55 0.15 114.38 114.50 2k6q h ARG 69 Ca 0.70 -0.17 -0.00 0.00 -0.50 0.00 0.00 59.98 60.01 2k6q h ARG 69 Cb 2.26 -0.22 0.00 0.00 0.00 0.00 0.00 29.97 32.00 2k6q h ARG 69 CO -0.26 0.91 -0.03 0.00 0.00 0.00 0.00 179.97 180.59 2k6q h ARG 70 N 1.20 -0.09 0.00 0.04 3.08 0.19 -2.79 114.38 116.02 2k6q h ARG 70 Ca 0.29 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.35 2k6q h ARG 70 Cb 0.09 0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.16 2k6q h ARG 70 CO -0.04 0.36 0.00 -0.07 -1.07 0.00 0.00 179.97 179.15 2k6q h LEU 71 N -0.57 0.00 -1.53 3.04 3.38 -1.11 -3.45 115.31 115.07 2k6q h LEU 71 Ca -0.01 0.00 -0.62 0.00 0.09 0.00 0.00 57.88 57.34 2k6q h LEU 71 Cb 0.49 0.00 -0.32 0.00 0.09 0.00 0.00 40.66 40.92 2k6q h LEU 71 CO 0.01 0.00 -0.92 0.00 0.09 0.00 0.00 178.44 177.63 2k6q n GLN 72 N -3.04 -0.80 -1.55 1.13 10.64 0.50 -4.88 117.38 119.38 2k6q n GLN 72 Ca -0.02 0.12 -0.29 0.00 -1.83 0.00 0.00 57.00 54.98 2k6q n GLN 72 Cb 0.10 -4.25 0.13 0.00 -0.86 0.00 0.00 30.24 25.36 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 -7.23 2.14 0.52 2.61 1.43 -1.24 -5.08 118.68 111.82 2k6q s LEU 73 Ca 0.52 1.02 0.06 0.00 -1.03 0.00 0.00 54.13 54.70 2k6q s LEU 73 Cb -0.31 -3.40 0.02 0.00 0.03 0.00 0.00 46.19 42.54 2k6q s LEU 73 CO 1.01 -2.42 0.39 0.20 0.23 0.00 0.00 176.35 175.76 2k6q s ASN 74 N -4.03 4.69 0.27 2.29 -0.87 -1.26 -4.97 114.94 111.06 2k6q s ASN 74 Ca 0.63 -1.15 -0.01 0.00 -1.57 0.00 0.00 52.86 50.77 2k6q s ASN 74 Cb -0.15 0.20 0.49 0.00 -0.02 0.00 0.00 41.25 41.77 2k6q s ASN 74 CO 0.53 -1.00 1.85 0.00 -2.57 0.00 0.00 177.10 175.91 2k6q h ALA 75 N 0.83 1.43 -0.97 0.60 0.00 -2.03 0.11 119.26 119.23 2k6q h ALA 75 Ca -0.38 0.01 0.09 0.00 0.00 0.00 0.00 54.91 54.64 2k6q h ALA 75 Cb 1.29 -0.23 -0.07 0.00 0.00 0.00 0.00 17.79 18.78 2k6q h ALA 75 CO 0.58 0.28 0.62 -0.91 0.00 0.00 0.00 179.25 179.82 2k6q h ASN 76 N 1.02 0.93 -3.44 0.00 2.35 -2.04 -3.38 115.58 111.02 2k6q h ASN 76 Ca 0.46 0.03 -0.60 0.00 -0.55 0.00 0.00 56.30 55.65 2k6q h ASN 76 Cb 0.37 -0.17 -0.10 0.00 0.05 0.00 0.00 38.32 38.47 2k6q h ASN 76 CO -0.23 0.55 -0.10 -1.58 -1.65 0.00 0.00 177.43 174.41 2k6q s GLN 77 N -5.94 4.21 -0.13 0.81 2.00 0.39 -5.06 119.66 115.94 2k6q s GLN 77 Ca -0.12 0.36 -0.06 0.00 -2.00 0.00 0.00 55.36 53.54 2k6q s GLN 77 Cb 0.21 -3.53 -0.04 0.00 0.80 0.00 0.00 33.01 30.45 2k6q s GLN 77 CO 0.81 -0.06 0.07 0.00 -0.50 0.00 0.00 175.29 175.60 2k6q s ALA 78 N 1.37 3.54 -0.04 1.58 0.00 -1.26 -4.27 121.76 122.68 2k6q s ALA 78 Ca 0.23 -0.73 0.03 0.00 0.00 0.00 0.00 51.96 51.50 2k6q s ALA 78 Cb -0.15 -1.82 0.00 0.00 0.00 0.00 0.00 23.12 21.15 2k6q s ALA 78 CO 0.09 0.44 -0.13 0.12 0.00 0.00 0.00 175.76 176.29 2k6q s PHE 79 N -0.45 1.32 -0.11 0.00 5.36 -1.26 -3.88 117.98 118.96 2k6q s PHE 79 Ca 0.10 -0.37 -0.04 0.00 -0.96 0.00 0.00 56.93 55.66 2k6q s PHE 79 Cb -0.12 -0.92 0.06 0.00 -0.34 0.00 0.00 43.02 41.70 2k6q s PHE 79 CO 0.02 -0.15 0.17 -0.06 -1.46 0.00 0.00 175.22 173.74 2k6q s PHE 80 N 0.20 -0.17 -0.37 10.12 0.08 0.16 -4.98 117.98 123.02 2k6q s PHE 80 Ca -0.05 0.47 -0.25 0.00 0.12 0.00 0.00 56.93 57.23 2k6q s PHE 80 Cb -0.11 -0.31 0.01 0.00 -0.57 0.00 0.00 43.02 42.05 2k6q s PHE 80 CO 0.02 -0.35 0.86 -1.17 -0.10 0.00 0.00 175.22 174.48 2k6q s LEU 81 N 2.29 4.06 -0.32 -0.37 0.20 -1.26 -1.46 118.68 121.82 2k6q s LEU 81 Ca 0.04 0.46 -0.21 0.00 0.69 0.00 0.00 54.13 55.10 2k6q s LEU 81 Cb -0.13 -3.15 -0.00 0.00 -0.43 0.00 0.00 46.19 42.48 2k6q s LEU 81 CO -0.07 -0.81 0.69 -0.76 -0.29 0.00 0.00 176.35 175.11 2k6q s LEU 82 N 3.31 4.14 -0.39 -0.68 2.01 0.16 -4.27 118.68 122.97 2k6q s LEU 82 Ca 0.35 0.46 -0.28 0.00 0.01 0.00 0.00 54.13 54.67 2k6q s LEU 82 Cb -0.12 -2.91 0.02 0.00 0.01 0.00 0.00 46.19 43.19 2k6q s LEU 82 CO 0.18 -0.55 1.03 -0.69 1.01 0.00 0.00 176.35 177.33 2k6q s VAL 83 N 2.76 4.45 -1.89 -1.59 1.01 0.50 -0.14 120.40 125.50 2k6q s VAL 83 Ca 0.28 1.36 0.00 0.00 0.00 0.00 0.00 61.98 63.61 2k6q s VAL 83 Cb -0.14 -4.44 0.00 0.00 0.00 0.00 0.00 36.38 31.80 2k6q s VAL 83 CO 0.13 -0.66 0.00 0.59 0.00 0.00 0.00 175.10 175.16 2k6q n ASN 84 N 7.11 -5.18 0.00 3.32 3.02 -0.27 -0.24 115.26 123.02 2k6q n ASN 84 Ca 0.10 0.42 0.00 0.00 -0.03 0.00 0.00 54.58 55.07 2k6q n ASN 84 Cb 0.48 -4.26 0.00 0.00 -0.61 0.00 0.00 39.78 35.39 2k6q n ASN 84 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2k6q n GLY 85 N -0.77 0.79 3.01 7.41 0.00 -1.20 -5.02 105.19 109.41 2k6q n GLY 85 Ca -0.18 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.58 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 -2.19 1.56 1.23 1.61 -3.43 0.67 -4.98 115.29 109.76 2k6q s HIS 86 Ca 0.00 -0.64 -0.16 0.00 -0.80 0.00 0.00 55.06 53.45 2k6q s HIS 86 Cb 0.00 -1.17 0.27 0.00 -1.43 0.00 0.00 32.58 30.26 2k6q s HIS 86 CO 0.00 -0.35 0.72 -1.13 -2.00 0.00 0.00 174.74 171.98 2k6q n SER 87 N 4.06 -2.52 -2.15 7.38 3.41 -1.26 0.19 113.62 122.72 2k6q n SER 87 Ca -0.21 -0.34 -0.25 0.00 -0.26 0.00 0.00 58.87 57.82 2k6q n SER 87 Cb 0.51 -1.11 0.01 0.00 -0.26 0.00 0.00 64.21 63.37 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 -4.38 3.56 -0.67 4.33 0.00 -1.26 -4.59 117.12 114.11 2k6q n MET 88 Ca 0.04 -4.26 0.51 0.00 0.00 0.00 0.00 57.70 53.99 2k6q n MET 88 Cb 0.56 -2.27 0.78 0.00 0.00 0.00 0.00 33.22 32.29 2k6q n MET 88 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 175.97 177.52 2k6q n VAL 89 N -0.65 -0.02 -4.01 3.17 3.14 -1.26 -2.99 118.33 115.71 2k6q n VAL 89 Ca 0.43 1.47 -0.32 0.00 -2.96 0.00 0.00 64.34 62.96 2k6q n VAL 89 Cb 0.88 -2.45 -0.15 0.00 -1.06 0.00 0.00 33.84 31.07 2k6q n VAL 89 CO 0.00 0.00 0.00 -0.55 -6.46 0.00 0.00 176.83 169.82 2k6q s SER 90 N -3.91 4.70 -0.73 6.55 0.15 -1.26 -5.04 113.70 114.16 2k6q s SER 90 Ca -0.05 -1.75 -0.04 0.00 0.70 0.00 0.00 55.95 54.81 2k6q s SER 90 Cb 0.26 -1.62 0.19 0.00 -1.71 0.00 0.00 66.02 63.14 2k6q s SER 90 CO 0.86 -0.30 0.58 0.54 1.20 0.00 0.00 173.24 176.12 2k6q s VAL 91 N 1.04 4.20 -0.08 4.45 0.11 -1.16 -4.78 120.40 124.17 2k6q s VAL 91 Ca 0.01 -3.12 0.12 0.00 -2.93 0.00 0.00 61.98 56.06 2k6q s VAL 91 Cb -0.20 -3.67 0.19 0.00 -1.53 0.00 0.00 36.38 31.17 2k6q s VAL 91 CO -0.06 -0.96 1.09 -0.24 -3.33 0.00 0.00 175.10 171.61 2k6q n SER 92 N 3.26 1.54 -4.13 3.54 2.88 -1.26 -4.87 113.62 114.57 2k6q n SER 92 Ca 0.12 -2.70 -0.20 0.00 -1.33 0.00 0.00 58.87 54.76 2k6q n SER 92 Cb 0.39 -0.34 -0.14 0.00 -0.75 0.00 0.00 64.21 63.37 2k6q n SER 92 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 2k6q s THR 93 N -1.87 1.09 0.23 2.46 2.01 -1.26 -5.11 115.64 113.19 2k6q s THR 93 Ca 0.21 -0.93 -0.30 0.00 0.31 0.00 0.00 61.69 60.98 2k6q s THR 93 Cb 0.18 -0.98 -0.09 0.00 0.01 0.00 0.00 72.50 71.63 2k6q s THR 93 CO 0.02 0.05 1.09 -2.16 -0.69 0.00 0.00 174.62 172.93 2k6q s PRO 94 N -1.00 4.63 0.50 4.92 0.04 -1.26 -2.79 135.00 140.03 2k6q s PRO 94 Ca 0.02 1.76 0.34 0.00 0.04 0.00 0.00 61.00 63.15 2k6q s PRO 94 Cb -0.07 -3.23 1.47 0.00 0.04 0.00 0.00 34.50 32.70 2k6q s PRO 94 CO 0.01 0.17 1.74 0.97 0.04 0.00 0.00 177.00 179.93 2k6q h ILE 95 N 3.37 0.34 -0.75 0.56 6.09 -1.81 1.12 117.51 126.44 2k6q h ILE 95 Ca -0.46 -0.03 0.06 0.00 -1.37 0.00 0.00 64.86 63.06 2k6q h ILE 95 Cb 1.21 0.24 -0.06 0.00 0.47 0.00 0.00 36.82 38.68 2k6q h ILE 95 CO 0.69 0.02 0.44 0.77 -3.07 0.00 0.00 178.15 177.01 2k6q h SER 96 N 0.10 0.69 0.00 2.19 4.64 -1.88 -0.48 113.55 118.80 2k6q h SER 96 Ca 0.65 0.02 -0.04 0.00 -0.47 0.00 0.00 61.79 61.96 2k6q h SER 96 Cb 2.34 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 64.31 2k6q h SER 96 CO -0.12 0.45 -0.28 -0.33 -0.87 0.00 0.00 176.83 175.67 2k6q h GLU 97 N 0.82 0.00 -1.67 4.77 5.08 0.76 -2.91 114.58 121.43 2k6q h GLU 97 Ca 0.33 0.00 0.50 0.00 -1.00 0.00 0.00 59.36 59.19 2k6q h GLU 97 Cb 0.15 0.00 -0.09 0.00 0.50 0.00 0.00 28.75 29.31 2k6q h GLU 97 CO -0.17 0.53 1.17 0.28 -1.00 0.00 0.00 179.01 179.83 2k6q h VAL 98 N -1.00 0.08 0.07 3.13 2.07 -0.62 1.33 116.25 121.31 2k6q h VAL 98 Ca -0.06 -0.01 -0.11 0.00 0.82 0.00 0.00 66.70 67.34 2k6q h VAL 98 Cb 0.66 0.06 0.01 0.00 -1.52 0.00 0.00 31.29 30.50 2k6q h VAL 98 CO -0.04 0.00 -0.49 0.22 0.02 0.00 0.00 177.57 177.29 2k6q h TYR 99 N 0.02 0.35 0.00 1.57 5.03 -1.17 -1.96 116.97 120.82 2k6q h TYR 99 Ca 0.86 -0.24 0.00 0.00 2.58 0.00 0.00 58.73 61.93 2k6q h TYR 99 Cb 3.22 -0.02 0.00 0.00 1.55 0.00 0.00 36.73 41.48 2k6q h TYR 99 CO -0.00 1.16 0.00 -0.85 -1.32 0.00 0.00 178.16 177.15 2k6q n GLU 100 N -4.32 0.31 0.00 1.82 0.28 0.39 0.18 120.64 119.29 2k6q n GLU 100 Ca -0.12 0.10 0.05 0.00 -0.16 0.00 0.00 57.16 57.03 2k6q n GLU 100 Cb 0.67 -1.50 -0.03 0.00 1.43 0.00 0.00 31.44 32.01 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 -1.24 0.79 0.06 -1.84 7.64 0.25 -4.78 113.62 114.50 2k6q n SER 101 Ca 0.09 -0.90 0.00 0.00 1.01 0.00 0.00 58.87 59.08 2k6q n SER 101 Cb 0.13 0.75 0.00 0.00 -1.01 0.00 0.00 64.21 64.08 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 -0.77 0.00 -0.99 1.43 1.02 -0.60 -5.03 120.64 115.71 2k6q n GLU 102 Ca 0.03 0.00 -0.33 0.00 -0.02 0.00 0.00 57.16 56.84 2k6q n GLU 102 Cb 0.17 -0.40 0.02 0.00 -0.02 0.00 0.00 31.44 31.21 2k6q n GLU 102 CO 0.00 0.00 0.00 2.89 1.18 0.00 0.00 177.13 181.20 2k6q n ARG 103 N -3.40 0.00 -3.25 3.49 -4.01 0.48 -4.98 116.66 104.99 2k6q n ARG 103 Ca 0.00 0.00 -0.18 0.00 -1.04 0.00 0.00 57.85 56.63 2k6q n ARG 103 Cb 0.07 -0.89 -0.01 0.00 -3.04 0.00 0.00 32.46 28.58 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 2.71 2.39 -0.26 2.89 9.92 -1.26 -4.88 116.55 128.06 2k6q n ASP 104 Ca 0.02 -2.30 0.01 0.00 -0.53 0.00 0.00 54.79 51.99 2k6q n ASP 104 Cb 0.46 0.06 0.08 0.00 -0.64 0.00 0.00 41.12 41.08 2k6q n ASP 104 CO 0.00 0.00 0.00 -0.33 0.13 0.00 0.00 177.20 177.00 2k6q h GLU 105 N 0.00 -0.01 -0.97 -1.24 4.39 -1.96 0.24 114.58 115.03 2k6q h GLU 105 Ca -0.24 0.00 0.18 0.00 0.34 0.00 0.00 59.36 59.64 2k6q h GLU 105 Cb 0.83 0.00 -0.17 0.00 -0.10 0.00 0.00 28.75 29.31 2k6q h GLU 105 CO 0.39 -0.01 -0.29 -0.40 -1.16 0.00 0.00 179.01 177.54 2k6q n ASP 106 N -5.49 -0.45 0.00 1.42 3.85 -1.26 -4.81 116.55 109.81 2k6q n ASP 106 Ca 0.10 1.67 0.00 0.00 -0.71 0.00 0.00 54.79 55.85 2k6q n ASP 106 Cb 0.38 -0.46 0.00 0.00 -1.35 0.00 0.00 41.12 39.69 2k6q n ASP 106 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2k6q n GLY 107 N -1.55 1.88 2.93 6.12 0.00 0.84 -4.72 105.19 110.68 2k6q n GLY 107 Ca 0.13 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.94 2k6q n GLY 107 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2k6q s PHE 108 N -2.00 0.92 0.24 1.61 2.19 -1.26 -4.69 117.98 114.99 2k6q s PHE 108 Ca 0.00 -0.29 -0.30 0.00 0.33 0.00 0.00 56.93 56.67 2k6q s PHE 108 Cb 0.00 -0.76 -0.09 0.00 -1.31 0.00 0.00 43.02 40.86 2k6q s PHE 108 CO 0.00 -0.21 0.99 -0.51 1.83 0.00 0.00 175.22 177.32 2k6q s LEU 109 N 0.83 4.61 -0.29 6.12 1.43 -1.09 -4.24 118.68 126.06 2k6q s LEU 109 Ca -0.12 2.03 0.02 0.00 -1.03 0.00 0.00 54.13 55.03 2k6q s LEU 109 Cb -0.15 -3.61 0.07 0.00 0.03 0.00 0.00 46.19 42.53 2k6q s LEU 109 CO 0.01 0.06 -0.05 -0.31 0.23 0.00 0.00 176.35 176.29 2k6q s TYR 110 N -1.08 3.39 -0.02 0.29 2.02 -1.26 0.19 117.35 120.89 2k6q s TYR 110 Ca 0.42 -2.43 0.04 0.00 -0.37 0.00 0.00 57.07 54.74 2k6q s TYR 110 Cb -0.27 -2.22 -0.01 0.00 -0.40 0.00 0.00 41.96 39.05 2k6q s TYR 110 CO 0.34 -0.89 -0.15 -1.64 -1.57 0.00 0.00 175.55 171.65 2k6q s MET 111 N 1.08 1.25 -0.19 -0.62 -1.94 -0.79 -1.12 119.30 116.97 2k6q s MET 111 Ca -0.03 -0.52 -0.02 0.00 -1.71 0.00 0.00 55.69 53.41 2k6q s MET 111 Cb -0.20 -1.19 -0.00 0.00 2.01 0.00 0.00 34.83 35.45 2k6q s MET 111 CO -0.05 0.30 -0.10 0.08 -0.01 0.00 0.00 175.02 175.23 2k6q s VAL 112 N -0.26 2.93 0.09 -6.03 1.01 0.80 -1.81 120.40 117.12 2k6q s VAL 112 Ca 0.04 -0.65 0.01 0.00 0.00 0.00 0.00 61.98 61.38 2k6q s VAL 112 Cb -0.07 -2.29 -0.04 0.00 0.00 0.00 0.00 36.38 33.99 2k6q s VAL 112 CO -0.00 0.48 0.23 -0.72 0.00 0.00 0.00 175.10 175.08 2k6q s TYR 113 N 1.20 3.48 0.13 5.22 -0.85 -0.92 0.37 117.35 125.99 2k6q s TYR 113 Ca 0.02 0.19 -0.24 0.00 -0.52 0.00 0.00 57.07 56.52 2k6q s TYR 113 Cb -0.14 -1.72 0.08 0.00 0.38 0.00 0.00 41.96 40.56 2k6q s TYR 113 CO -0.04 0.56 1.11 0.00 -1.52 0.00 0.00 175.55 175.66 2k6q s ALA 114 N -1.59 -1.85 -0.48 9.51 0.00 -0.54 -2.76 121.76 124.05 2k6q s ALA 114 Ca 0.34 -0.23 0.04 0.00 0.00 0.00 0.00 51.96 52.11 2k6q s ALA 114 Cb -0.12 0.80 0.32 0.00 0.00 0.00 0.00 23.12 24.12 2k6q s ALA 114 CO 0.28 -1.09 1.17 0.45 0.00 0.00 0.00 175.76 176.57 2k6q n SER 115 N -1.19 3.12 -3.70 0.00 2.88 -1.25 0.36 113.62 113.85 2k6q n SER 115 Ca -0.01 -2.50 -0.15 0.00 -1.33 0.00 0.00 58.87 54.88 2k6q n SER 115 Cb 0.59 -0.60 -0.14 0.00 -0.75 0.00 0.00 64.21 63.30 2k6q n SER 115 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2k6q s GLN 116 N -1.59 0.10 -0.01 -1.46 -2.07 -1.26 -4.84 119.66 108.53 2k6q s GLN 116 Ca 0.23 0.53 0.14 0.00 -1.82 0.00 0.00 55.36 54.44 2k6q s GLN 116 Cb 0.18 -0.18 -0.17 0.00 -1.09 0.00 0.00 33.01 31.75 2k6q s GLN 116 CO 0.06 -0.24 0.49 -1.91 -1.32 0.00 0.00 175.29 172.37 2k6q n GLU 117 N 4.80 1.73 -2.06 9.60 2.13 -1.26 -4.47 120.64 131.10 2k6q n GLU 117 Ca -0.15 -0.05 -0.21 0.00 0.66 0.00 0.00 57.16 57.42 2k6q n GLU 117 Cb 0.51 -1.22 0.03 0.00 0.27 0.00 0.00 31.44 31.03 2k6q n GLU 117 CO 0.00 0.00 0.00 0.25 -0.41 0.00 0.00 177.13 176.97 2k6q n THR 118 N -1.57 2.38 0.00 6.31 -2.24 -1.26 -4.45 114.28 113.45 2k6q n THR 118 Ca 0.01 -4.04 0.00 0.00 -2.27 0.00 0.00 64.05 57.74 2k6q n THR 118 Cb 0.27 -0.85 0.00 0.00 -2.10 0.00 0.00 70.33 67.65 2k6q n THR 118 CO 0.00 0.00 0.00 2.22 -0.57 0.00 0.00 175.07 176.72 2k6q n PHE 119 N -0.71 0.00 0.00 4.78 1.16 -1.26 -5.22 117.46 116.22 2k6q n PHE 119 Ca 0.39 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.97 2k6q n PHE 119 Cb 0.94 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 38.81 2k6q n PHE 119 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30