#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 -3.32 0.00 -1.46 2.00 -1.26 -4.83 117.12 108.25 2k6q n MET 1 Ca 0.00 2.69 0.00 0.00 0.00 0.00 0.00 57.70 60.39 2k6q n MET 1 Cb 0.00 -3.90 0.00 0.00 0.00 0.00 0.00 33.22 29.32 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 -4.36 0.00 -2.62 0.03 -0.04 -1.26 -4.83 135.00 121.92 2k6q n PRO 2 Ca -0.09 0.39 -0.40 0.00 -0.04 0.00 0.00 63.50 63.36 2k6q n PRO 2 Cb 0.69 -1.01 -0.05 0.00 -0.04 0.00 0.00 33.50 33.08 2k6q n PRO 2 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 2k6q s SER 3 N -2.41 7.46 0.28 3.54 0.01 -1.26 -5.00 113.70 116.32 2k6q s SER 3 Ca 0.00 2.10 -0.21 0.00 1.31 0.00 0.00 55.95 59.15 2k6q s SER 3 Cb 0.00 -2.62 0.02 0.00 0.21 0.00 0.00 66.02 63.63 2k6q s SER 3 CO 0.00 0.01 0.71 -1.83 0.41 0.00 0.00 173.24 172.53 2k6q s GLU 4 N -1.26 1.77 0.96 12.44 -1.05 -1.26 -5.10 118.70 125.20 2k6q s GLU 4 Ca 0.43 -1.00 -0.12 0.00 -0.15 0.00 0.00 54.97 54.13 2k6q s GLU 4 Cb -0.29 0.60 0.17 0.00 -0.44 0.00 0.00 34.13 34.17 2k6q s GLU 4 CO 0.36 -0.81 1.11 0.15 0.95 0.00 0.00 175.26 177.03 2k6q s LYS 5 N -3.92 0.75 0.11 -4.83 -0.14 -1.26 -5.06 119.74 105.39 2k6q s LYS 5 Ca 0.11 0.40 0.05 0.00 -1.36 0.00 0.00 55.97 55.18 2k6q s LYS 5 Cb -0.06 -1.78 -0.04 0.00 -1.68 0.00 0.00 37.83 34.27 2k6q s LYS 5 CO 0.07 -2.49 -0.00 -0.08 -0.76 0.00 0.00 175.35 172.09 2k6q s THR 6 N -3.12 3.93 0.63 2.17 -1.32 -1.26 -4.79 115.64 111.88 2k6q s THR 6 Ca 0.65 -1.10 0.24 0.00 -1.21 0.00 0.00 61.69 60.26 2k6q s THR 6 Cb -0.17 -2.90 0.29 0.00 -1.51 0.00 0.00 72.50 68.22 2k6q s THR 6 CO 0.56 0.06 1.62 -0.26 -2.21 0.00 0.00 174.62 174.39 2k6q h PHE 7 N 3.26 0.00 0.16 9.09 0.04 -1.97 1.78 116.94 129.30 2k6q h PHE 7 Ca -0.48 0.00 -0.31 0.00 2.80 0.00 0.00 57.97 59.99 2k6q h PHE 7 Cb 1.17 0.00 0.01 0.00 2.20 0.00 0.00 35.95 39.33 2k6q h PHE 7 CO 0.61 0.00 -1.42 1.57 -0.60 0.00 0.00 178.31 178.46 2k6q h LYS 8 N 0.00 0.35 0.00 1.51 2.10 -1.93 -3.27 116.57 115.32 2k6q h LYS 8 Ca 0.17 -0.59 0.00 0.00 -2.00 0.00 0.00 60.65 58.23 2k6q h LYS 8 Cb 1.53 0.22 0.00 0.00 -0.90 0.00 0.00 32.23 33.08 2k6q h LYS 8 CO -0.00 1.26 -0.26 1.96 -2.00 0.00 0.00 179.45 180.41 2k6q h GLN 9 N 0.09 0.00 0.00 0.07 1.08 0.17 -3.42 115.11 113.10 2k6q h GLN 9 Ca -0.21 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.99 2k6q h GLN 9 Cb 2.05 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 29.48 2k6q h GLN 9 CO 0.21 0.00 0.00 -2.13 -0.95 0.00 0.00 178.83 175.96 2k6q n ARG 10 N -3.80 0.00 -1.23 1.46 3.00 0.42 -4.49 116.66 112.02 2k6q n ARG 10 Ca -0.04 0.65 -0.41 0.00 -0.00 0.00 0.00 57.85 58.06 2k6q n ARG 10 Cb 0.13 -1.08 -0.01 0.00 0.00 0.00 0.00 32.46 31.51 2k6q n ARG 10 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 2k6q n ARG 11 N -1.95 0.00 -2.17 -0.14 3.00 -1.23 -4.74 116.66 109.42 2k6q n ARG 11 Ca 0.00 0.00 -0.43 0.00 -0.01 0.00 0.00 57.85 57.41 2k6q n ARG 11 Cb 0.00 -0.93 -0.02 0.00 0.00 0.00 0.00 32.46 31.51 2k6q n ARG 11 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.63 176.51 2k6q s SER 12 N -0.93 6.19 0.14 0.55 0.01 -1.26 -4.89 113.70 113.50 2k6q s SER 12 Ca 0.56 1.18 -0.27 0.00 1.31 0.00 0.00 55.95 58.74 2k6q s SER 12 Cb -0.67 -2.53 -0.06 0.00 0.21 0.00 0.00 66.02 62.96 2k6q s SER 12 CO 0.56 -1.49 1.35 0.33 0.41 0.00 0.00 173.24 174.41 2k6q n PHE 13 N 9.26 -0.38 -0.34 2.43 7.35 -1.26 0.19 117.46 134.71 2k6q n PHE 13 Ca 0.19 1.08 0.24 0.00 -0.76 0.00 0.00 57.45 58.20 2k6q n PHE 13 Cb 0.47 -0.57 0.47 0.00 0.35 0.00 0.00 39.48 40.20 2k6q n PHE 13 CO 0.00 0.00 0.00 1.05 -0.76 0.00 0.00 176.76 177.05 2k6q h GLU 14 N 0.00 0.33 0.54 -4.13 4.11 -1.98 0.28 114.58 113.72 2k6q h GLU 14 Ca 0.14 -0.02 -0.03 0.00 0.07 0.00 0.00 59.36 59.52 2k6q h GLU 14 Cb 0.35 -0.07 0.01 0.00 0.50 0.00 0.00 28.75 29.54 2k6q h GLU 14 CO -0.81 0.22 -0.26 0.37 0.07 0.00 0.00 179.01 178.60 2k6q h GLN 15 N 0.34 -0.70 -1.03 1.06 5.75 0.17 0.34 115.11 121.04 2k6q h GLN 15 Ca 0.73 0.05 0.26 0.00 -0.15 0.00 0.00 58.65 59.54 2k6q h GLN 15 Cb 1.66 0.16 -0.11 0.00 1.07 0.00 0.00 27.48 30.26 2k6q h GLN 15 CO -0.59 -0.40 0.64 0.00 -2.65 0.00 0.00 178.83 175.83 2k6q h ARG 16 N -1.08 0.46 -0.05 1.69 2.47 0.11 0.63 114.38 118.62 2k6q h ARG 16 Ca -0.07 -0.03 -0.24 0.00 -1.26 0.00 0.00 59.98 58.38 2k6q h ARG 16 Cb 0.62 -0.10 0.01 0.00 -1.65 0.00 0.00 29.97 28.84 2k6q h ARG 16 CO 0.12 0.31 -0.92 0.28 0.56 0.00 0.00 179.97 180.31 2k6q h VAL 17 N 0.48 1.32 -0.24 2.04 2.07 -0.45 -2.69 116.25 118.76 2k6q h VAL 17 Ca 0.62 -2.22 0.02 0.00 0.82 0.00 0.00 66.70 65.94 2k6q h VAL 17 Cb 1.39 2.26 -0.02 0.00 -1.52 0.00 0.00 31.29 33.40 2k6q h VAL 17 CO -0.38 0.68 0.10 -0.08 0.02 0.00 0.00 177.57 177.91 2k6q h GLU 18 N 0.38 0.21 -0.98 1.57 4.81 0.42 -1.67 114.58 119.32 2k6q h GLU 18 Ca -0.09 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.13 2k6q h GLU 18 Cb 1.56 -0.05 -0.05 0.00 0.63 0.00 0.00 28.75 30.84 2k6q h GLU 18 CO 0.18 0.14 0.62 0.22 -0.73 0.00 0.00 179.01 179.44 2k6q h ASP 19 N 0.22 1.15 -0.49 1.04 3.58 -0.67 -0.34 116.42 120.90 2k6q h ASP 19 Ca 0.10 -0.05 0.09 0.00 0.42 0.00 0.00 57.03 57.60 2k6q h ASP 19 Cb 0.06 -0.29 -0.03 0.00 1.72 0.00 0.00 39.33 40.79 2k6q h ASP 19 CO -0.09 0.86 0.34 0.58 -2.88 0.00 0.00 179.24 178.04 2k6q h VAL 20 N 1.34 0.89 0.01 2.25 2.07 -0.98 -1.14 116.25 120.69 2k6q h VAL 20 Ca 0.36 -0.10 -0.00 0.00 0.82 0.00 0.00 66.70 67.78 2k6q h VAL 20 Cb -0.11 0.59 0.00 0.00 -1.52 0.00 0.00 31.29 30.24 2k6q h VAL 20 CO -0.07 0.05 -0.01 -0.09 0.02 0.00 0.00 177.57 177.47 2k6q h ARG 21 N 0.28 -0.02 0.27 1.57 2.43 -0.20 0.82 114.38 119.54 2k6q h ARG 21 Ca 0.23 0.00 0.01 0.00 -0.81 0.00 0.00 59.98 59.40 2k6q h ARG 21 Cb 0.52 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.05 2k6q h ARG 21 CO -0.05 0.06 -0.35 -0.07 -1.51 0.00 0.00 179.97 178.04 2k6q h LEU 22 N -0.09 -0.98 -1.93 3.80 3.38 -1.11 0.44 115.31 118.82 2k6q h LEU 22 Ca -0.00 0.09 -0.00 0.00 0.09 0.00 0.00 57.88 58.06 2k6q h LEU 22 Cb 0.08 0.35 -0.00 0.00 0.09 0.00 0.00 40.66 41.18 2k6q h LEU 22 CO 0.00 -0.48 0.00 -0.29 0.09 0.00 0.00 178.44 177.77 2k6q h ILE 23 N -0.68 1.02 -0.13 1.22 6.09 -1.29 1.55 117.51 125.28 2k6q h ILE 23 Ca -0.01 -0.08 -0.11 0.00 -1.37 0.00 0.00 64.86 63.29 2k6q h ILE 23 Cb 0.65 0.99 -0.01 0.00 0.47 0.00 0.00 36.82 38.92 2k6q h ILE 23 CO -0.11 0.03 -0.41 0.03 -3.07 0.00 0.00 178.15 174.61 2k6q h ARG 24 N 0.05 0.30 -0.01 2.19 2.47 0.24 1.04 114.38 120.65 2k6q h ARG 24 Ca 0.01 -0.14 0.00 0.00 -1.26 0.00 0.00 59.98 58.59 2k6q h ARG 24 Cb 0.03 -0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.35 2k6q h ARG 24 CO -0.00 0.66 -0.48 -0.85 0.56 0.00 0.00 179.97 179.86 2k6q n GLU 25 N -4.02 1.22 -0.03 0.04 0.28 0.14 -4.09 120.64 114.17 2k6q n GLU 25 Ca -0.02 -0.96 -0.05 0.00 -0.16 0.00 0.00 57.16 55.98 2k6q n GLU 25 Cb 0.49 -1.46 -0.02 0.00 1.43 0.00 0.00 31.44 31.88 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 -0.07 0.28 -3.84 3.44 6.02 0.51 -4.86 117.38 118.86 2k6q n GLN 26 Ca 0.09 0.11 -0.30 0.00 -0.01 0.00 0.00 57.00 56.89 2k6q n GLN 26 Cb 0.46 -0.95 -0.11 0.00 1.02 0.00 0.00 30.24 30.66 2k6q n GLN 26 CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 177.06 175.04 2k6q s HIS 27 N -2.24 3.66 0.18 1.08 3.76 0.36 -4.87 115.29 117.22 2k6q s HIS 27 Ca -0.15 -3.28 0.11 0.00 -0.15 0.00 0.00 55.06 51.59 2k6q s HIS 27 Cb 0.02 -2.83 0.23 0.00 1.11 0.00 0.00 32.58 31.11 2k6q s HIS 27 CO 0.22 -0.59 1.53 -1.00 -0.85 0.00 0.00 174.74 174.05 2k6q h PRO 28 N 5.52 0.00 -0.92 8.40 0.13 -1.69 -3.00 132.00 140.44 2k6q h PRO 28 Ca 0.15 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 65.12 2k6q h PRO 28 Cb 0.76 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 31.80 2k6q h PRO 28 CO 0.75 0.68 0.20 0.25 -0.23 0.00 0.00 178.00 179.65 2k6q n THR 29 N -3.60 1.82 -4.19 1.56 -2.24 -1.26 -4.83 114.28 101.54 2k6q n THR 29 Ca -0.00 -0.85 -0.17 0.00 -2.27 0.00 0.00 64.05 60.76 2k6q n THR 29 Cb 0.70 -0.61 -0.12 0.00 -2.10 0.00 0.00 70.33 68.19 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 -1.72 0.70 -0.37 -0.78 -0.14 -1.13 -3.28 119.74 113.02 2k6q s LYS 30 Ca 0.28 -0.72 -0.17 0.00 -1.36 0.00 0.00 55.97 53.99 2k6q s LYS 30 Cb 0.23 -0.62 0.00 0.00 -1.68 0.00 0.00 37.83 35.76 2k6q s LYS 30 CO 0.06 0.14 0.47 0.42 -0.76 0.00 0.00 175.35 175.69 2k6q s ILE 31 N -1.03 5.05 0.04 2.17 -1.09 0.76 -4.88 121.20 122.23 2k6q s ILE 31 Ca -0.03 0.12 -0.30 0.00 -2.23 0.00 0.00 60.65 58.21 2k6q s ILE 31 Cb -0.08 -3.96 -0.05 0.00 -1.58 0.00 0.00 42.46 36.78 2k6q s ILE 31 CO 0.01 -0.25 1.17 -2.16 -1.23 0.00 0.00 174.94 172.48 2k6q s PRO 32 N 2.29 4.44 0.02 2.79 0.04 -1.26 -2.11 135.00 141.21 2k6q s PRO 32 Ca 0.16 1.72 -0.03 0.00 0.04 0.00 0.00 61.00 62.90 2k6q s PRO 32 Cb -0.16 -3.38 -0.01 0.00 0.04 0.00 0.00 34.50 30.99 2k6q s PRO 32 CO 0.13 -0.25 0.03 0.14 0.04 0.00 0.00 177.00 177.09 2k6q s VAL 33 N 1.16 0.11 -0.40 -0.36 -7.23 -1.19 -2.65 120.40 109.85 2k6q s VAL 33 Ca 0.58 -0.93 0.03 0.00 -1.81 0.00 0.00 61.98 59.85 2k6q s VAL 33 Cb -0.28 -0.45 0.11 0.00 0.56 0.00 0.00 36.38 36.32 2k6q s VAL 33 CO 0.28 -0.51 0.15 -0.63 -0.31 0.00 0.00 175.10 174.08 2k6q s ILE 34 N -1.72 1.94 -0.25 -0.62 -1.09 0.24 -2.92 121.20 116.78 2k6q s ILE 34 Ca -0.13 -2.46 -0.14 0.00 -2.23 0.00 0.00 60.65 55.68 2k6q s ILE 34 Cb -0.07 -2.40 -0.04 0.00 -1.58 0.00 0.00 42.46 38.37 2k6q s ILE 34 CO -0.01 -0.72 0.34 -0.63 -1.23 0.00 0.00 174.94 172.69 2k6q s ILE 35 N 0.62 5.21 0.49 2.92 1.01 -0.98 -2.55 121.20 127.93 2k6q s ILE 35 Ca 0.14 0.53 0.02 0.00 0.00 0.00 0.00 60.65 61.33 2k6q s ILE 35 Cb -0.21 -3.67 -0.01 0.00 0.01 0.00 0.00 42.46 38.58 2k6q s ILE 35 CO -0.08 0.21 0.06 -1.83 0.00 0.00 0.00 174.94 173.30 2k6q s GLU 36 N 1.73 2.15 0.20 2.79 4.04 -0.93 -4.56 118.70 124.11 2k6q s GLU 36 Ca 0.14 -2.37 -0.26 0.00 0.04 0.00 0.00 54.97 52.52 2k6q s GLU 36 Cb -0.15 -1.13 -0.08 0.00 0.02 0.00 0.00 34.13 32.78 2k6q s GLU 36 CO 0.09 -0.47 0.82 -0.98 -1.84 0.00 0.00 175.26 172.88 2k6q s ARG 37 N -3.80 4.61 0.71 -4.83 1.70 -1.26 -2.69 118.95 113.39 2k6q s ARG 37 Ca 0.09 1.22 -0.15 0.00 -0.47 0.00 0.00 55.73 56.41 2k6q s ARG 37 Cb 0.00 -3.21 0.03 0.00 -0.57 0.00 0.00 34.95 31.21 2k6q s ARG 37 CO 0.06 0.53 1.19 -0.47 -1.08 0.00 0.00 175.30 175.53 2k6q s TYR 38 N -1.21 2.16 -0.83 5.89 6.14 -1.13 -4.86 117.35 123.50 2k6q s TYR 38 Ca 0.38 1.59 -0.25 0.00 0.64 0.00 0.00 57.07 59.43 2k6q s TYR 38 Cb -0.23 -3.42 0.01 0.00 0.42 0.00 0.00 41.96 38.74 2k6q s TYR 38 CO 0.27 -2.44 1.58 0.15 0.64 0.00 0.00 175.55 175.75 2k6q s LYS 39 N -3.91 3.07 0.00 4.97 1.02 -1.26 -2.18 119.74 121.45 2k6q s LYS 39 Ca 0.73 -0.34 0.00 0.00 0.02 0.00 0.00 55.97 56.38 2k6q s LYS 39 Cb -0.28 -4.75 0.00 0.00 -0.52 0.00 0.00 37.83 32.28 2k6q s LYS 39 CO 0.44 -2.53 0.00 0.41 -0.92 0.00 0.00 175.35 172.75 2k6q n GLY 40 N 6.19 1.66 3.09 -3.33 0.00 -1.26 -5.09 105.19 106.45 2k6q n GLY 40 Ca 0.23 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.04 1.96 -0.01 1.61 -6.30 -0.92 -4.87 118.70 110.12 2k6q s GLU 41 Ca 0.00 -1.64 0.08 0.00 -2.50 0.00 0.00 54.97 50.91 2k6q s GLU 41 Cb 0.00 -3.27 -0.13 0.00 0.00 0.00 0.00 34.13 30.74 2k6q s GLU 41 CO 0.00 -0.85 0.20 0.36 0.02 0.00 0.00 175.26 174.99 2k6q n LYS 42 N 4.46 0.71 0.00 4.30 0.00 -1.26 -4.65 118.16 121.72 2k6q n LYS 42 Ca -0.04 -0.07 0.00 0.00 -0.00 0.00 0.00 58.31 58.20 2k6q n LYS 42 Cb 0.42 -1.17 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 -1.73 0.00 -1.44 -1.58 1.13 -1.26 -4.62 117.38 107.89 2k6q n GLN 43 Ca -0.01 0.37 -0.37 0.00 -1.94 0.00 0.00 57.00 55.05 2k6q n GLN 43 Cb 0.21 -1.10 0.07 0.00 0.11 0.00 0.00 30.24 29.53 2k6q n GLN 43 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 2k6q n LEU 44 N -1.12 2.98 -4.80 1.08 4.77 -1.26 -4.97 117.00 113.68 2k6q n LEU 44 Ca 0.00 0.70 -0.30 0.00 -0.03 0.00 0.00 56.01 56.38 2k6q n LEU 44 Cb 0.00 -1.35 0.10 0.00 -2.33 0.00 0.00 43.42 39.83 2k6q n LEU 44 CO 0.00 -2.23 0.71 -2.16 -1.33 0.00 0.00 177.39 172.38 2k6q s PRO 45 N -2.98 1.94 -0.25 3.23 0.04 -1.26 -4.97 135.00 130.74 2k6q s PRO 45 Ca 0.73 0.59 -0.29 0.00 0.04 0.00 0.00 61.00 62.07 2k6q s PRO 45 Cb -0.37 -1.91 -0.00 0.00 0.04 0.00 0.00 34.50 32.26 2k6q s PRO 45 CO 0.50 -1.71 1.24 0.08 0.04 0.00 0.00 177.00 177.15 2k6q s VAL 46 N -3.17 4.28 0.37 -0.36 1.01 -1.26 -4.95 120.40 116.32 2k6q s VAL 46 Ca 0.61 1.49 -0.22 0.00 0.00 0.00 0.00 61.98 63.86 2k6q s VAL 46 Cb -0.14 -4.15 -0.16 0.00 0.00 0.00 0.00 36.38 31.92 2k6q s VAL 46 CO 0.54 -0.34 0.18 -0.11 0.00 0.00 0.00 175.10 175.36 2k6q n LEU 47 N 7.10 -2.49 -0.23 3.92 -0.00 -1.26 -4.78 117.00 119.26 2k6q n LEU 47 Ca 0.14 0.87 0.04 0.00 -0.00 0.00 0.00 56.01 57.05 2k6q n LEU 47 Cb 0.46 -0.90 0.15 0.00 -0.00 0.00 0.00 43.42 43.12 2k6q n LEU 47 CO 0.59 -3.95 0.90 -0.78 -0.00 0.00 0.00 177.39 174.16 2k6q h ASP 48 N 0.46 -0.08 -3.16 1.96 -0.00 -1.92 -3.44 116.42 110.24 2k6q h ASP 48 Ca -0.35 0.14 -0.19 0.00 -0.00 0.00 0.00 57.03 56.63 2k6q h ASP 48 Cb 1.44 0.21 -0.05 0.00 -0.00 0.00 0.00 39.33 40.94 2k6q h ASP 48 CO 0.49 -0.05 -0.18 0.29 -0.00 0.00 0.00 179.24 179.78 2k6q n LYS 49 N -5.19 0.28 -0.02 0.28 4.01 -1.26 -5.08 118.16 111.18 2k6q n LYS 49 Ca 0.12 -1.30 -0.03 0.00 -0.51 0.00 0.00 58.31 56.60 2k6q n LYS 49 Cb 0.41 0.99 -0.03 0.00 -0.51 0.00 0.00 35.03 35.89 2k6q n LYS 49 CO 0.00 0.00 0.00 2.41 -1.11 0.00 0.00 177.40 178.70 2k6q n THR 50 N -0.27 0.30 -3.39 -0.18 -1.04 -1.26 -4.93 114.28 103.51 2k6q n THR 50 Ca 0.02 -0.16 -0.38 0.00 -2.04 0.00 0.00 64.05 61.50 2k6q n THR 50 Cb 0.23 -0.81 -0.07 0.00 -1.82 0.00 0.00 70.33 67.87 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 -2.11 4.23 -0.03 -2.82 1.02 -1.26 -2.31 119.74 116.45 2k6q s LYS 51 Ca -0.04 0.25 0.02 0.00 0.02 0.00 0.00 55.97 56.22 2k6q s LYS 51 Cb 0.02 -3.50 0.01 0.00 -0.52 0.00 0.00 37.83 33.84 2k6q s LYS 51 CO 0.15 0.05 -0.08 -0.06 -0.92 0.00 0.00 175.35 174.49 2k6q s PHE 52 N 1.03 0.95 -0.49 3.18 0.08 -1.15 -5.05 117.98 116.53 2k6q s PHE 52 Ca 0.20 -0.26 -0.16 0.00 0.12 0.00 0.00 56.93 56.84 2k6q s PHE 52 Cb -0.15 -0.71 0.08 0.00 -0.57 0.00 0.00 43.02 41.68 2k6q s PHE 52 CO 0.08 -0.14 0.45 -0.51 -0.10 0.00 0.00 175.22 175.00 2k6q s LEU 53 N 0.38 5.65 0.18 -0.37 1.43 -1.26 -3.14 118.68 121.54 2k6q s LEU 53 Ca -0.06 -1.37 -0.23 0.00 -1.03 0.00 0.00 54.13 51.44 2k6q s LEU 53 Cb -0.10 -2.22 -0.08 0.00 0.03 0.00 0.00 46.19 43.82 2k6q s LEU 53 CO 0.01 -0.73 0.74 -0.69 0.23 0.00 0.00 176.35 175.91 2k6q s VAL 54 N 1.77 4.47 -0.12 -1.59 1.01 -0.90 -4.85 120.40 120.20 2k6q s VAL 54 Ca 0.05 1.52 -0.29 0.00 0.00 0.00 0.00 61.98 63.26 2k6q s VAL 54 Cb -0.25 -4.02 -0.02 0.00 0.00 0.00 0.00 36.38 32.09 2k6q s VAL 54 CO 0.07 0.42 1.25 -2.16 0.00 0.00 0.00 175.10 174.68 2k6q s PRO 55 N -1.41 4.27 -1.06 2.72 0.04 -1.26 -0.17 135.00 138.14 2k6q s PRO 55 Ca 0.37 1.68 -0.08 0.00 0.04 0.00 0.00 61.00 63.02 2k6q s PRO 55 Cb -0.21 -3.69 -0.11 0.00 0.04 0.00 0.00 34.50 30.53 2k6q s PRO 55 CO 0.24 -0.61 2.78 -0.40 0.04 0.00 0.00 177.00 179.04 2k6q n ASP 56 N 6.09 6.73 -0.87 6.66 5.75 -1.21 -3.10 116.55 136.60 2k6q n ASP 56 Ca 0.13 -2.45 -0.05 0.00 -0.01 0.00 0.00 54.79 52.41 2k6q n ASP 56 Cb 0.45 -1.35 -0.05 0.00 -1.03 0.00 0.00 41.12 39.14 2k6q n ASP 56 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2k6q n HIS 57 N 3.51 0.00 -2.66 2.11 1.44 -1.26 -5.00 115.22 113.36 2k6q n HIS 57 Ca 0.60 -0.37 0.00 0.00 -2.01 0.00 0.00 57.72 55.93 2k6q n HIS 57 Cb 0.33 0.44 0.00 0.00 0.12 0.00 0.00 29.99 30.88 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 0.00 0.00 -4.44 0.61 0.24 -1.18 -5.15 118.33 108.42 2k6q n VAL 58 Ca -0.21 0.00 -0.24 0.00 -2.04 0.00 0.00 64.34 61.85 2k6q n VAL 58 Cb 0.63 0.00 -0.10 0.00 -1.47 0.00 0.00 33.84 32.91 2k6q n VAL 58 CO 0.00 0.00 0.00 0.20 -2.14 0.00 0.00 176.83 174.89 2k6q s ASN 59 N 1.20 3.76 0.62 -1.34 0.01 -1.26 -3.62 114.94 114.31 2k6q s ASN 59 Ca 0.00 -0.95 0.32 0.00 -0.71 0.00 0.00 52.86 51.52 2k6q s ASN 59 Cb 0.00 -0.40 1.75 0.00 0.41 0.00 0.00 41.25 43.01 2k6q s ASN 59 CO 0.00 0.04 2.07 0.00 -1.51 0.00 0.00 177.10 177.69 2k6q h MET 60 N 2.25 0.00 0.48 -0.60 -0.00 -1.83 -1.71 114.93 113.52 2k6q h MET 60 Ca -0.41 0.00 -0.02 0.00 -0.00 0.00 0.00 59.70 59.27 2k6q h MET 60 Cb 1.26 0.00 -0.00 0.00 -0.00 0.00 0.00 31.60 32.85 2k6q h MET 60 CO 0.59 0.00 -0.27 1.03 -0.00 0.00 0.00 176.91 178.27 2k6q h SER 61 N 0.00 -0.66 -0.81 -0.10 0.87 -1.92 -2.83 113.55 108.11 2k6q h SER 61 Ca 0.07 0.03 0.14 0.00 -1.23 0.00 0.00 61.79 60.80 2k6q h SER 61 Cb 0.55 0.19 -0.15 0.00 -0.44 0.00 0.00 62.40 62.55 2k6q h SER 61 CO -0.00 -0.44 -0.30 -0.33 -0.53 0.00 0.00 176.83 175.23 2k6q h GLU 62 N -0.70 -0.05 -0.96 2.24 5.08 -1.72 0.77 114.58 119.24 2k6q h GLU 62 Ca -0.06 0.00 0.30 0.00 -1.00 0.00 0.00 59.36 58.60 2k6q h GLU 62 Cb 0.56 0.01 -0.17 0.00 0.50 0.00 0.00 28.75 29.65 2k6q h GLU 62 CO 0.08 -0.03 0.22 1.25 -1.00 0.00 0.00 179.01 179.52 2k6q h LEU 63 N -0.05 -0.14 -0.11 1.33 6.46 -1.57 1.04 115.31 122.28 2k6q h LEU 63 Ca 0.34 0.25 0.04 0.00 -0.12 0.00 0.00 57.88 58.39 2k6q h LEU 63 Cb 0.59 0.37 -0.04 0.00 -0.73 0.00 0.00 40.66 40.84 2k6q h LEU 63 CO -0.84 -0.31 -0.16 0.40 -0.62 0.00 0.00 178.44 176.90 2k6q h ILE 64 N 0.07 0.58 -0.36 4.05 1.08 0.62 0.48 117.51 124.03 2k6q h ILE 64 Ca 0.65 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 65.12 2k6q h ILE 64 Cb 1.44 0.58 -0.02 0.00 -3.07 0.00 0.00 36.82 35.76 2k6q h ILE 64 CO -0.81 0.00 0.24 0.11 -0.69 0.00 0.00 178.15 177.00 2k6q h LYS 65 N -0.21 0.48 -0.44 2.37 1.57 0.11 0.14 116.57 120.60 2k6q h LYS 65 Ca 0.09 -0.03 -0.11 0.00 -1.87 0.00 0.00 60.65 58.73 2k6q h LYS 65 Cb 0.34 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.52 2k6q h LYS 65 CO -0.23 0.32 -0.18 0.82 -0.57 0.00 0.00 179.45 179.61 2k6q h ILE 66 N 0.49 1.27 0.05 1.86 1.08 0.17 -2.20 117.51 120.23 2k6q h ILE 66 Ca 0.13 -1.29 -0.00 0.00 -0.39 0.00 0.00 64.86 63.31 2k6q h ILE 66 Cb -0.05 1.12 0.00 0.00 -3.07 0.00 0.00 36.82 34.82 2k6q h ILE 66 CO -0.03 0.44 -0.02 0.40 -0.69 0.00 0.00 178.15 178.25 2k6q h ILE 67 N 0.74 0.00 -1.89 -0.67 1.08 0.15 -2.76 117.51 114.16 2k6q h ILE 67 Ca 0.11 -0.05 0.55 0.00 -0.39 0.00 0.00 64.86 65.07 2k6q h ILE 67 Cb 0.70 0.00 -0.08 0.00 -3.07 0.00 0.00 36.82 34.37 2k6q h ILE 67 CO 0.05 0.00 1.36 -2.11 -0.69 0.00 0.00 178.15 176.77 2k6q n ARG 68 N -2.34 0.00 0.03 2.37 1.85 0.34 0.20 116.66 119.11 2k6q n ARG 68 Ca -0.01 1.03 -0.13 0.00 -1.00 0.00 0.00 57.85 57.75 2k6q n ARG 68 Cb 0.03 -2.39 -0.09 0.00 -1.05 0.00 0.00 32.46 28.96 2k6q n ARG 68 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2k6q h ARG 69 N 0.00 -0.10 0.00 2.89 2.47 -1.35 -0.33 114.38 117.97 2k6q h ARG 69 Ca 0.90 0.01 -0.01 0.00 -1.26 0.00 0.00 59.98 59.62 2k6q h ARG 69 Cb 3.61 0.02 -0.00 0.00 -1.65 0.00 0.00 29.97 31.95 2k6q h ARG 69 CO -0.01 0.28 -0.04 0.00 0.56 0.00 0.00 179.97 180.76 2k6q h ARG 70 N -0.50 0.00 -0.01 0.04 -0.00 0.25 0.32 114.38 114.48 2k6q h ARG 70 Ca -0.01 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.47 2k6q h ARG 70 Cb 0.43 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.40 2k6q h ARG 70 CO 0.02 0.04 -0.23 1.28 0.00 0.00 0.00 179.97 181.07 2k6q n LEU 71 N -3.52 1.39 -3.07 3.04 4.77 -0.44 -4.75 117.00 114.43 2k6q n LEU 71 Ca -0.02 -0.43 -0.13 0.00 -0.03 0.00 0.00 56.01 55.40 2k6q n LEU 71 Cb 0.14 -0.07 -0.04 0.00 -2.33 0.00 0.00 43.42 41.13 2k6q n LEU 71 CO 0.26 0.25 -0.15 0.00 -1.33 0.00 0.00 177.39 176.42 2k6q n GLN 72 N -0.28 -0.96 -0.70 3.23 0.00 0.11 -4.83 117.38 113.96 2k6q n GLN 72 Ca 0.13 0.04 -0.11 0.00 0.00 0.00 0.00 57.00 57.06 2k6q n GLN 72 Cb 0.38 -1.44 0.08 0.00 0.00 0.00 0.00 30.24 29.26 2k6q n GLN 72 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 2k6q n LEU 73 N -2.24 0.00 -4.49 2.61 4.77 -1.19 -5.07 117.00 111.38 2k6q n LEU 73 Ca -0.09 -0.54 -0.25 0.00 -0.03 0.00 0.00 56.01 55.10 2k6q n LEU 73 Cb 0.24 -0.38 -0.08 0.00 -2.33 0.00 0.00 43.42 40.87 2k6q n LEU 73 CO 0.33 -0.88 -0.20 0.21 -1.33 0.00 0.00 177.39 175.52 2k6q s ASN 74 N -2.81 2.66 0.59 -1.43 2.47 -1.26 -4.99 114.94 110.16 2k6q s ASN 74 Ca 0.28 -1.64 0.38 0.00 0.42 0.00 0.00 52.86 52.30 2k6q s ASN 74 Cb -0.01 0.45 1.89 0.00 -1.45 0.00 0.00 41.25 42.13 2k6q s ASN 74 CO 0.20 -0.90 2.16 0.00 -3.72 0.00 0.00 177.10 174.84 2k6q h ALA 75 N 1.85 1.00 0.02 1.71 0.00 -2.03 -0.71 119.26 121.10 2k6q h ALA 75 Ca -0.35 0.00 -0.22 0.00 0.00 0.00 0.00 54.91 54.34 2k6q h ALA 75 Cb 1.27 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.05 2k6q h ALA 75 CO 0.57 0.00 -0.96 -0.97 0.00 0.00 0.00 179.25 177.90 2k6q h ASN 76 N 0.00 0.33 -3.59 0.00 -0.00 -2.04 -3.42 115.58 106.87 2k6q h ASN 76 Ca 0.00 -0.29 -0.66 0.00 -0.00 0.00 0.00 56.30 55.36 2k6q h ASN 76 Cb 0.23 -0.10 -0.16 0.00 -0.00 0.00 0.00 38.32 38.28 2k6q h ASN 76 CO 0.00 1.11 -0.03 -1.58 -0.00 0.00 0.00 177.43 176.94 2k6q s GLN 77 N -3.10 3.42 0.17 6.67 2.00 -0.27 -5.04 119.66 123.50 2k6q s GLN 77 Ca -0.03 -0.33 -0.30 0.00 -2.00 0.00 0.00 55.36 52.69 2k6q s GLN 77 Cb 0.09 -3.88 -0.07 0.00 0.80 0.00 0.00 33.01 29.95 2k6q s GLN 77 CO 0.85 -0.79 0.96 0.00 -0.50 0.00 0.00 175.29 175.81 2k6q s ALA 78 N 2.47 3.29 -0.02 1.58 0.00 -1.26 -4.36 121.76 123.47 2k6q s ALA 78 Ca 0.19 0.61 0.01 0.00 0.00 0.00 0.00 51.96 52.76 2k6q s ALA 78 Cb -0.15 -3.25 0.01 0.00 0.00 0.00 0.00 23.12 19.73 2k6q s ALA 78 CO 0.15 0.07 -0.01 0.12 0.00 0.00 0.00 175.76 176.09 2k6q s PHE 79 N -0.55 0.24 -0.06 0.00 5.36 -1.26 -4.07 117.98 117.65 2k6q s PHE 79 Ca 0.44 -0.01 -0.03 0.00 -0.96 0.00 0.00 56.93 56.38 2k6q s PHE 79 Cb -0.25 -0.26 0.03 0.00 -0.34 0.00 0.00 43.02 42.20 2k6q s PHE 79 CO 0.31 -0.07 0.14 -0.06 -1.46 0.00 0.00 175.22 174.08 2k6q s PHE 80 N 0.51 -0.15 -0.43 10.12 0.08 -0.06 -4.96 117.98 123.09 2k6q s PHE 80 Ca -0.05 0.43 -0.18 0.00 0.12 0.00 0.00 56.93 57.26 2k6q s PHE 80 Cb -0.08 -0.07 0.03 0.00 -0.57 0.00 0.00 43.02 42.33 2k6q s PHE 80 CO -0.01 -0.14 0.46 -1.17 -0.10 0.00 0.00 175.22 174.25 2k6q s LEU 81 N 0.95 4.88 -0.58 -0.37 2.96 -1.26 -2.00 118.68 123.25 2k6q s LEU 81 Ca -0.07 -0.69 -0.25 0.00 -0.22 0.00 0.00 54.13 52.89 2k6q s LEU 81 Cb -0.09 -2.40 0.04 0.00 0.50 0.00 0.00 46.19 44.23 2k6q s LEU 81 CO -0.05 -0.61 1.01 -0.76 -1.32 0.00 0.00 176.35 174.63 2k6q s LEU 82 N 2.18 3.94 -0.41 -0.68 2.01 0.35 -4.13 118.68 121.94 2k6q s LEU 82 Ca 0.12 -0.32 -0.29 0.00 0.01 0.00 0.00 54.13 53.65 2k6q s LEU 82 Cb -0.17 -2.84 0.02 0.00 0.01 0.00 0.00 46.19 43.20 2k6q s LEU 82 CO 0.14 -1.33 1.29 -0.69 1.01 0.00 0.00 176.35 176.76 2k6q s VAL 83 N 4.27 4.07 -0.14 -1.59 1.01 0.49 -0.68 120.40 127.82 2k6q s VAL 83 Ca 0.32 1.12 0.00 0.00 0.00 0.00 0.00 61.98 63.42 2k6q s VAL 83 Cb -0.12 -4.35 0.00 0.00 0.00 0.00 0.00 36.38 31.92 2k6q s VAL 83 CO 0.19 -0.79 0.00 0.59 0.00 0.00 0.00 175.10 175.09 2k6q n ASN 84 N 8.22 -5.14 0.00 3.32 3.02 -0.90 -0.65 115.26 123.13 2k6q n ASN 84 Ca 0.14 0.03 0.00 0.00 -0.03 0.00 0.00 54.58 54.73 2k6q n ASN 84 Cb 0.48 -2.76 0.00 0.00 -0.61 0.00 0.00 39.78 36.90 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 -0.20 1.07 3.04 7.41 0.00 -1.13 -5.01 105.19 110.38 2k6q n GLY 85 Ca -0.01 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.79 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 1.17 1.23 1.61 -3.43 0.18 -4.98 115.29 109.07 2k6q s HIS 86 Ca 0.00 -0.30 -0.16 0.00 -0.80 0.00 0.00 55.06 53.80 2k6q s HIS 86 Cb 0.00 -0.81 0.28 0.00 -1.43 0.00 0.00 32.58 30.62 2k6q s HIS 86 CO 0.00 -0.11 0.77 -1.13 -2.00 0.00 0.00 174.74 172.27 2k6q n SER 87 N 3.22 -2.45 -1.40 7.38 3.41 -1.26 0.18 113.62 122.70 2k6q n SER 87 Ca -0.18 -0.33 0.02 0.00 -0.26 0.00 0.00 58.87 58.12 2k6q n SER 87 Cb 0.54 -1.13 0.09 0.00 -0.26 0.00 0.00 64.21 63.45 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 -4.54 1.02 0.21 4.33 0.00 -1.26 -4.60 117.12 112.29 2k6q n MET 88 Ca 0.04 -2.79 0.14 0.00 0.00 0.00 0.00 57.70 55.09 2k6q n MET 88 Cb 0.56 -0.91 0.74 0.00 0.00 0.00 0.00 33.22 33.61 2k6q n MET 88 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 175.97 175.73 2k6q h VAL 89 N 4.45 0.00 -0.52 3.17 3.04 -1.93 0.55 116.25 125.02 2k6q h VAL 89 Ca -0.09 0.00 -0.10 0.00 -1.01 0.00 0.00 66.70 65.49 2k6q h VAL 89 Cb 1.50 0.60 -0.06 0.00 -2.01 0.00 0.00 31.29 31.32 2k6q h VAL 89 CO 0.13 0.00 0.10 -1.20 -1.01 0.00 0.00 177.57 175.59 2k6q n SER 90 N -2.46 4.49 -4.50 3.17 7.64 -1.26 -4.97 113.62 115.72 2k6q n SER 90 Ca -0.02 -3.16 -0.36 0.00 1.01 0.00 0.00 58.87 56.34 2k6q n SER 90 Cb 0.07 -0.66 -0.17 0.00 -1.01 0.00 0.00 64.21 62.44 2k6q n SER 90 CO 0.00 0.00 0.00 0.55 -3.01 0.00 0.00 175.04 172.58 2k6q n VAL 91 N -0.22 0.00 -0.78 0.44 3.14 0.19 -4.57 118.33 116.54 2k6q n VAL 91 Ca 0.31 -0.14 0.01 0.00 -2.96 0.00 0.00 64.34 61.56 2k6q n VAL 91 Cb 1.16 -0.36 0.01 0.00 -1.06 0.00 0.00 33.84 33.60 2k6q n VAL 91 CO 0.00 0.00 0.00 -1.20 -6.46 0.00 0.00 176.83 169.17 2k6q n SER 92 N 9.08 0.87 -4.15 6.55 7.64 -1.26 -4.93 113.62 127.42 2k6q n SER 92 Ca 0.67 -1.62 -0.21 0.00 1.01 0.00 0.00 58.87 58.72 2k6q n SER 92 Cb 0.06 -0.06 -0.14 0.00 -1.01 0.00 0.00 64.21 63.07 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 -0.57 1.17 0.25 0.44 2.01 -1.26 -5.12 115.64 112.56 2k6q s THR 93 Ca 0.03 -0.94 -0.30 0.00 0.31 0.00 0.00 61.69 60.79 2k6q s THR 93 Cb 0.02 -1.03 -0.09 0.00 0.01 0.00 0.00 72.50 71.41 2k6q s THR 93 CO 0.00 0.09 1.09 -2.16 -0.69 0.00 0.00 174.62 172.95 2k6q s PRO 94 N -0.98 4.64 0.56 4.92 0.04 -1.26 -3.12 135.00 139.80 2k6q s PRO 94 Ca 0.03 1.77 0.36 0.00 0.04 0.00 0.00 61.00 63.19 2k6q s PRO 94 Cb -0.07 -3.21 1.47 0.00 0.04 0.00 0.00 34.50 32.73 2k6q s PRO 94 CO 0.01 0.20 1.72 0.97 0.04 0.00 0.00 177.00 179.94 2k6q h ILE 95 N 3.24 0.28 -0.54 0.56 6.09 -1.80 1.19 117.51 126.53 2k6q h ILE 95 Ca -0.46 0.00 -0.02 0.00 -1.37 0.00 0.00 64.86 63.01 2k6q h ILE 95 Cb 1.21 0.33 -0.02 0.00 0.47 0.00 0.00 36.82 38.81 2k6q h ILE 95 CO 0.68 0.00 0.26 0.77 -3.07 0.00 0.00 178.15 176.79 2k6q h SER 96 N 0.00 0.71 0.01 2.19 4.64 -1.90 -1.60 113.55 117.61 2k6q h SER 96 Ca 0.54 -0.13 -0.00 0.00 -0.47 0.00 0.00 61.79 61.73 2k6q h SER 96 Cb 2.37 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 64.27 2k6q h SER 96 CO -0.01 0.64 -0.01 -0.33 -0.87 0.00 0.00 176.83 176.26 2k6q h GLU 97 N 0.73 -0.01 -1.63 4.77 5.08 0.94 -3.13 114.58 121.32 2k6q h GLU 97 Ca 0.19 0.00 0.47 0.00 -1.00 0.00 0.00 59.36 59.02 2k6q h GLU 97 Cb 0.12 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 29.31 2k6q h GLU 97 CO -0.02 0.45 1.21 0.28 -1.00 0.00 0.00 179.01 179.92 2k6q h VAL 98 N -0.99 0.14 -0.02 3.13 2.07 -0.84 1.43 116.25 121.16 2k6q h VAL 98 Ca -0.00 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.49 2k6q h VAL 98 Cb 0.47 0.15 0.00 0.00 -1.52 0.00 0.00 31.29 30.39 2k6q h VAL 98 CO 0.00 0.00 -0.09 0.22 0.02 0.00 0.00 177.57 177.72 2k6q h TYR 99 N 0.00 0.14 -0.00 1.57 3.20 -1.33 -0.56 116.97 119.98 2k6q h TYR 99 Ca 0.77 -0.06 0.00 0.00 3.14 0.00 0.00 58.73 62.59 2k6q h TYR 99 Cb 3.18 -0.02 0.00 0.00 1.54 0.00 0.00 36.73 41.43 2k6q h TYR 99 CO 0.00 0.72 -0.02 -0.85 -1.64 0.00 0.00 178.16 176.37 2k6q n GLU 100 N -4.68 0.69 -0.03 1.82 0.28 0.36 0.81 120.64 119.89 2k6q n GLU 100 Ca -0.09 -0.08 0.05 0.00 -0.16 0.00 0.00 57.16 56.89 2k6q n GLU 100 Cb 0.37 -1.50 0.06 0.00 1.43 0.00 0.00 31.44 31.80 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 -1.09 2.09 0.00 -1.84 7.64 0.40 -4.71 113.62 116.11 2k6q n SER 101 Ca 0.17 -1.55 0.00 0.00 1.01 0.00 0.00 58.87 58.50 2k6q n SER 101 Cb 0.21 -0.04 0.00 0.00 -1.01 0.00 0.00 64.21 63.37 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 0.59 0.00 -0.97 1.43 -0.58 -0.23 -4.96 120.64 115.92 2k6q n GLU 102 Ca 0.07 0.00 -0.33 0.00 -0.42 0.00 0.00 57.16 56.48 2k6q n GLU 102 Cb 0.30 -0.22 0.03 0.00 -0.57 0.00 0.00 31.44 30.97 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 -2.60 0.00 -3.06 3.49 -4.01 0.24 -4.97 116.66 105.75 2k6q n ARG 103 Ca 0.00 0.00 -0.16 0.00 -1.04 0.00 0.00 57.85 56.65 2k6q n ARG 103 Cb 0.18 -0.90 -0.02 0.00 -3.04 0.00 0.00 32.46 28.69 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 2.85 2.30 -0.15 2.89 10.43 -1.26 -4.90 116.55 128.71 2k6q n ASP 104 Ca 0.01 -2.10 0.29 0.00 2.57 0.00 0.00 54.79 55.56 2k6q n ASP 104 Cb 0.48 0.07 0.69 0.00 1.84 0.00 0.00 41.12 44.20 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 0.00 -0.23 -1.24 4.39 -1.95 0.72 114.58 116.27 2k6q h GLU 105 Ca -0.21 0.00 -0.05 0.00 0.34 0.00 0.00 59.36 59.45 2k6q h GLU 105 Cb 0.69 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.33 2k6q h GLU 105 CO 0.33 0.00 -0.04 0.38 -1.16 0.00 0.00 179.01 178.52 2k6q h ASP 106 N 0.00 0.44 0.00 1.42 3.04 -1.95 -3.47 116.42 115.89 2k6q h ASP 106 Ca 0.42 -0.35 0.00 0.00 -3.24 0.00 0.00 57.03 53.86 2k6q h ASP 106 Cb 1.97 -0.12 0.00 0.00 -1.04 0.00 0.00 39.33 40.14 2k6q h ASP 106 CO -0.00 0.68 0.00 0.61 -2.04 0.00 0.00 179.24 178.49 2k6q n GLY 107 N -0.19 0.87 3.57 7.15 0.00 0.25 -4.62 105.19 112.21 2k6q n GLY 107 Ca -0.04 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.64 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 3.10 0.35 1.61 2.19 -1.26 -4.84 117.98 117.13 2k6q s PHE 108 Ca 0.00 -0.09 -0.25 0.00 0.33 0.00 0.00 56.93 56.92 2k6q s PHE 108 Cb 0.00 -1.92 -0.10 0.00 -1.31 0.00 0.00 43.02 39.69 2k6q s PHE 108 CO 0.00 0.15 0.99 -0.51 1.83 0.00 0.00 175.22 177.67 2k6q s LEU 109 N -0.02 4.26 -0.09 6.12 2.01 -1.08 -4.18 118.68 125.71 2k6q s LEU 109 Ca 0.02 1.92 -0.00 0.00 0.01 0.00 0.00 54.13 56.08 2k6q s LEU 109 Cb -0.13 -4.08 0.02 0.00 0.01 0.00 0.00 46.19 42.02 2k6q s LEU 109 CO 0.02 -0.22 -0.06 -0.31 1.01 0.00 0.00 176.35 176.79 2k6q s TYR 110 N -1.64 1.23 -0.03 0.29 2.02 -1.26 0.79 117.35 118.75 2k6q s TYR 110 Ca 0.53 -0.53 -0.07 0.00 -0.37 0.00 0.00 57.07 56.62 2k6q s TYR 110 Cb -0.20 -1.06 0.01 0.00 -0.40 0.00 0.00 41.96 40.31 2k6q s TYR 110 CO 0.25 -0.41 0.16 -1.64 -1.57 0.00 0.00 175.55 172.35 2k6q s MET 111 N 1.53 0.38 -0.03 -0.62 -1.94 -1.06 -2.13 119.30 115.43 2k6q s MET 111 Ca 0.01 -0.12 0.04 0.00 -1.71 0.00 0.00 55.69 53.90 2k6q s MET 111 Cb -0.13 0.16 -0.03 0.00 2.01 0.00 0.00 34.83 36.84 2k6q s MET 111 CO -0.05 -0.08 -0.13 0.08 -0.01 0.00 0.00 175.02 174.83 2k6q s VAL 112 N -0.76 3.21 0.08 -6.03 1.01 0.14 -2.20 120.40 115.85 2k6q s VAL 112 Ca -0.08 -0.75 0.10 0.00 0.00 0.00 0.00 61.98 61.25 2k6q s VAL 112 Cb -0.05 -2.29 -0.03 0.00 0.00 0.00 0.00 36.38 34.00 2k6q s VAL 112 CO 0.01 0.54 -0.26 -0.72 0.00 0.00 0.00 175.10 174.67 2k6q s TYR 113 N -0.80 2.35 0.35 5.22 -0.85 -1.09 0.13 117.35 122.65 2k6q s TYR 113 Ca 0.13 -0.38 -0.17 0.00 -0.52 0.00 0.00 57.07 56.13 2k6q s TYR 113 Cb -0.11 -1.35 0.06 0.00 0.38 0.00 0.00 41.96 40.94 2k6q s TYR 113 CO 0.02 0.22 0.83 0.00 -1.52 0.00 0.00 175.55 175.10 2k6q s ALA 114 N -0.92 -0.91 -0.48 9.51 0.00 -0.85 -2.85 121.76 125.27 2k6q s ALA 114 Ca 0.13 -0.66 0.05 0.00 0.00 0.00 0.00 51.96 51.48 2k6q s ALA 114 Cb -0.10 0.69 0.38 0.00 0.00 0.00 0.00 23.12 24.10 2k6q s ALA 114 CO 0.04 -1.00 1.25 0.45 0.00 0.00 0.00 175.76 176.49 2k6q n SER 115 N -1.35 3.38 -3.75 0.00 2.88 -1.26 -0.88 113.62 112.64 2k6q n SER 115 Ca -0.07 -2.59 -0.13 0.00 -1.33 0.00 0.00 58.87 54.75 2k6q n SER 115 Cb 0.60 -0.62 -0.10 0.00 -0.75 0.00 0.00 64.21 63.34 2k6q n SER 115 CO 0.00 0.00 0.00 -1.58 -1.23 0.00 0.00 175.04 172.23 2k6q s GLN 116 N -1.80 0.49 0.00 -1.46 2.00 -1.26 -4.70 119.66 112.94 2k6q s GLN 116 Ca 0.28 0.32 0.00 0.00 -2.00 0.00 0.00 55.36 53.96 2k6q s GLN 116 Cb 0.22 0.23 0.00 0.00 0.80 0.00 0.00 33.01 34.26 2k6q s GLN 116 CO 0.07 -0.09 0.31 -1.91 -0.50 0.00 0.00 175.29 173.17 2k6q n GLU 117 N 2.45 1.40 -3.21 1.67 2.13 -1.26 -4.70 120.64 119.12 2k6q n GLU 117 Ca -0.15 -0.31 -0.23 0.00 0.66 0.00 0.00 57.16 57.13 2k6q n GLU 117 Cb 0.57 -0.79 -0.06 0.00 0.27 0.00 0.00 31.44 31.43 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 -0.29 -0.17 -0.11 6.31 -2.24 -1.26 -4.74 114.28 111.79 2k6q n THR 118 Ca 0.00 -4.29 -0.14 0.00 -2.27 0.00 0.00 64.05 57.36 2k6q n THR 118 Cb 0.02 -1.66 -0.14 0.00 -2.10 0.00 0.00 70.33 66.44 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 1.11 0.09 0.00 4.78 1.16 -1.26 -5.27 117.46 118.06 2k6q n PHE 119 Ca 0.23 0.03 0.00 0.00 -1.87 0.00 0.00 57.45 55.83 2k6q n PHE 119 Cb 0.54 -1.01 0.00 0.00 -1.61 0.00 0.00 39.48 37.39 2k6q n PHE 119 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30