#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 3.03 0.00 -1.46 1.00 -1.26 -4.90 119.30 115.70 2k6q s MET 1 Ca 0.00 1.47 0.24 0.00 0.00 0.00 0.00 55.69 57.40 2k6q s MET 1 Cb 0.00 -1.97 1.41 0.00 0.00 0.00 0.00 34.83 34.26 2k6q s MET 1 CO 0.00 -1.08 1.78 -0.35 0.00 0.00 0.00 175.02 175.37 2k6q n PRO 2 N -1.98 0.75 -1.95 2.03 -0.04 -1.26 -4.77 135.00 127.78 2k6q n PRO 2 Ca 0.11 0.00 -0.15 0.00 -0.04 0.00 0.00 63.50 63.42 2k6q n PRO 2 Cb 0.52 -1.49 0.07 0.00 -0.04 0.00 0.00 33.50 32.56 2k6q n PRO 2 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2k6q n SER 3 N -0.99 0.95 -4.87 3.54 7.64 -1.26 -5.09 113.62 113.54 2k6q n SER 3 Ca 0.18 -1.78 -0.30 0.00 1.01 0.00 0.00 58.87 57.97 2k6q n SER 3 Cb 0.08 -0.41 -0.03 0.00 -1.01 0.00 0.00 64.21 62.84 2k6q n SER 3 CO 0.00 0.00 0.00 -1.83 -3.01 0.00 0.00 175.04 170.20 2k6q s GLU 4 N -4.12 3.78 1.00 1.43 -1.05 -1.26 -5.06 118.70 113.41 2k6q s GLU 4 Ca 0.43 0.49 -0.13 0.00 -0.15 0.00 0.00 54.97 55.61 2k6q s GLU 4 Cb -0.03 -2.37 0.21 0.00 -0.44 0.00 0.00 34.13 31.50 2k6q s GLU 4 CO 0.29 -0.06 0.47 1.63 0.95 0.00 0.00 175.26 178.53 2k6q n LYS 5 N -1.37 -1.91 -4.34 -4.83 5.02 -1.26 -5.02 118.16 104.45 2k6q n LYS 5 Ca 0.03 -0.79 -0.24 0.00 -2.02 0.00 0.00 58.31 55.28 2k6q n LYS 5 Cb 0.54 -1.42 -0.12 0.00 -0.02 0.00 0.00 35.03 34.01 2k6q n LYS 5 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2k6q s THR 6 N -1.95 1.93 0.62 -0.18 -4.23 -1.26 -4.83 115.64 105.74 2k6q s THR 6 Ca 0.36 -1.78 0.25 0.00 -1.18 0.00 0.00 61.69 59.34 2k6q s THR 6 Cb -0.06 -1.81 0.33 0.00 1.34 0.00 0.00 72.50 72.29 2k6q s THR 6 CO 0.31 -0.14 1.56 -0.26 -0.54 0.00 0.00 174.62 175.55 2k6q h PHE 7 N 3.62 0.00 0.08 3.99 -1.00 -1.95 1.77 116.94 123.46 2k6q h PHE 7 Ca -0.46 0.00 -0.26 0.00 2.81 0.00 0.00 57.97 60.06 2k6q h PHE 7 Cb 1.19 0.00 0.03 0.00 3.61 0.00 0.00 35.95 40.78 2k6q h PHE 7 CO 0.65 0.00 -1.07 1.57 -1.61 0.00 0.00 178.31 177.84 2k6q h LYS 8 N 0.00 0.58 0.00 1.51 2.10 -1.95 -3.12 116.57 115.70 2k6q h LYS 8 Ca 0.26 -0.74 0.00 0.00 -2.00 0.00 0.00 60.65 58.18 2k6q h LYS 8 Cb 1.88 0.24 0.00 0.00 -0.90 0.00 0.00 32.23 33.45 2k6q h LYS 8 CO -0.00 1.32 -0.33 1.96 -2.00 0.00 0.00 179.45 180.39 2k6q h GLN 9 N 0.18 0.00 0.00 0.07 4.20 0.16 -3.43 115.11 116.29 2k6q h GLN 9 Ca -0.16 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.55 2k6q h GLN 9 Cb 1.76 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.54 2k6q h GLN 9 CO 0.21 0.00 0.00 -2.13 -0.67 0.00 0.00 178.83 176.24 2k6q n ARG 10 N -3.92 0.00 -1.93 1.46 3.00 0.49 -4.40 116.66 111.36 2k6q n ARG 10 Ca -0.05 0.60 -0.42 0.00 -0.00 0.00 0.00 57.85 57.98 2k6q n ARG 10 Cb 0.17 -1.27 -0.03 0.00 0.00 0.00 0.00 32.46 31.34 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 -2.07 4.21 -0.11 -0.14 3.00 -1.18 -4.94 118.95 117.72 2k6q s ARG 11 Ca 0.00 2.36 -0.30 0.00 0.00 0.00 0.00 55.73 57.79 2k6q s ARG 11 Cb 0.00 -3.28 -0.02 0.00 0.00 0.00 0.00 34.95 31.65 2k6q s ARG 11 CO 0.00 -0.64 1.19 -1.12 0.00 0.00 0.00 175.30 174.72 2k6q s SER 12 N 1.50 7.04 0.24 0.23 0.01 -1.26 -4.46 113.70 117.00 2k6q s SER 12 Ca 0.71 1.71 -0.13 0.00 1.31 0.00 0.00 55.95 59.55 2k6q s SER 12 Cb -0.43 -2.55 0.31 0.00 0.21 0.00 0.00 66.02 63.56 2k6q s SER 12 CO 0.32 -0.64 1.48 0.33 0.41 0.00 0.00 173.24 175.14 2k6q n PHE 13 N 5.74 0.15 -0.31 2.43 7.35 -1.26 0.18 117.46 131.73 2k6q n PHE 13 Ca 0.12 1.17 0.14 0.00 -0.76 0.00 0.00 57.45 58.12 2k6q n PHE 13 Cb 0.46 -0.93 0.33 0.00 0.35 0.00 0.00 39.48 39.69 2k6q n PHE 13 CO 0.00 0.00 0.00 0.93 -0.76 0.00 0.00 176.76 176.93 2k6q h GLU 14 N 0.00 0.40 -0.62 -4.13 5.08 -1.99 0.57 114.58 113.90 2k6q h GLU 14 Ca 0.38 -0.02 -0.07 0.00 -1.00 0.00 0.00 59.36 58.64 2k6q h GLU 14 Cb 0.62 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.75 2k6q h GLU 14 CO -0.96 0.27 0.10 1.96 -1.00 0.00 0.00 179.01 179.38 2k6q h GLN 15 N 0.42 1.02 0.00 2.33 1.08 0.15 -1.33 115.11 118.78 2k6q h GLN 15 Ca 0.58 -0.27 -0.05 0.00 -1.45 0.00 0.00 58.65 57.46 2k6q h GLN 15 Cb 1.12 -0.12 -0.01 0.00 -0.05 0.00 0.00 27.48 28.42 2k6q h GLN 15 CO -0.53 0.96 -0.24 0.00 -0.95 0.00 0.00 178.83 178.07 2k6q h ARG 16 N 0.93 0.00 -0.08 1.46 3.08 0.99 -2.58 114.38 118.18 2k6q h ARG 16 Ca 0.19 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 60.14 2k6q h ARG 16 Cb 0.43 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.48 2k6q h ARG 16 CO 0.01 0.24 -0.34 0.28 -1.07 0.00 0.00 179.97 179.09 2k6q h VAL 17 N 0.00 1.41 -0.25 2.04 2.07 0.47 -3.12 116.25 118.87 2k6q h VAL 17 Ca -0.00 -1.73 0.04 0.00 0.82 0.00 0.00 66.70 65.82 2k6q h VAL 17 Cb 0.65 2.29 -0.04 0.00 -1.52 0.00 0.00 31.29 32.67 2k6q h VAL 17 CO 0.03 0.50 0.03 -0.08 0.02 0.00 0.00 177.57 178.07 2k6q h GLU 18 N -0.10 0.11 -1.01 1.57 4.81 -1.04 -0.59 114.58 118.32 2k6q h GLU 18 Ca -0.02 -0.01 0.25 0.00 -0.13 0.00 0.00 59.36 59.45 2k6q h GLU 18 Cb 0.99 -0.03 -0.12 0.00 0.63 0.00 0.00 28.75 30.23 2k6q h GLU 18 CO 0.07 0.07 0.62 0.22 -0.73 0.00 0.00 179.01 179.26 2k6q h ASP 19 N 0.11 0.63 -0.19 1.04 1.82 -1.51 0.99 116.42 119.31 2k6q h ASP 19 Ca 0.12 0.12 -0.12 0.00 -0.39 0.00 0.00 57.03 56.76 2k6q h ASP 19 Cb 0.14 0.02 -0.01 0.00 0.68 0.00 0.00 39.33 40.15 2k6q h ASP 19 CO -0.18 0.11 -0.28 0.58 -1.61 0.00 0.00 179.24 177.86 2k6q h VAL 20 N 0.55 1.28 -0.12 2.25 2.07 -1.09 -2.23 116.25 118.96 2k6q h VAL 20 Ca 0.63 -1.40 0.03 0.00 0.82 0.00 0.00 66.70 66.79 2k6q h VAL 20 Cb 1.27 1.34 -0.00 0.00 -1.52 0.00 0.00 31.29 32.38 2k6q h VAL 20 CO -0.43 0.46 0.40 -0.09 0.02 0.00 0.00 177.57 177.93 2k6q h ARG 21 N 0.58 0.00 0.00 1.57 2.43 0.21 0.77 114.38 119.94 2k6q h ARG 21 Ca 0.07 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.24 2k6q h ARG 21 Cb 0.78 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.33 2k6q h ARG 21 CO 0.06 0.00 -0.42 1.28 -1.51 0.00 0.00 179.97 179.38 2k6q n LEU 22 N -3.10 1.20 0.17 3.80 4.77 -0.88 -3.55 117.00 119.41 2k6q n LEU 22 Ca 0.01 0.43 0.17 0.00 -0.03 0.00 0.00 56.01 56.58 2k6q n LEU 22 Cb 0.48 -0.72 0.63 0.00 -2.33 0.00 0.00 43.42 41.49 2k6q n LEU 22 CO 0.17 -0.45 1.15 -0.29 -1.33 0.00 0.00 177.39 176.64 2k6q h ILE 23 N -0.65 0.14 0.01 -0.08 6.09 -1.01 1.88 117.51 123.88 2k6q h ILE 23 Ca 0.00 0.00 -0.24 0.00 -1.37 0.00 0.00 64.86 63.25 2k6q h ILE 23 Cb 0.42 0.48 0.01 0.00 0.47 0.00 0.00 36.82 38.20 2k6q h ILE 23 CO 0.00 0.00 -0.98 0.03 -3.07 0.00 0.00 178.15 174.13 2k6q h ARG 24 N 0.00 0.47 -0.01 2.19 2.47 0.40 0.57 114.38 120.46 2k6q h ARG 24 Ca 0.14 -0.51 0.00 0.00 -1.26 0.00 0.00 59.98 58.35 2k6q h ARG 24 Cb 1.31 0.15 0.00 0.00 -1.65 0.00 0.00 29.97 29.78 2k6q h ARG 24 CO -0.00 1.16 -0.42 -0.85 0.56 0.00 0.00 179.97 180.42 2k6q n GLU 25 N -3.76 1.21 -0.08 0.04 0.28 0.44 -3.97 120.64 114.79 2k6q n GLU 25 Ca -0.08 -0.96 -0.16 0.00 -0.16 0.00 0.00 57.16 55.80 2k6q n GLU 25 Cb 0.86 -1.48 -0.05 0.00 1.43 0.00 0.00 31.44 32.19 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 -0.05 0.39 -3.88 3.44 6.02 0.53 -4.84 117.38 118.98 2k6q n GLN 26 Ca 0.10 0.17 -0.28 0.00 -0.01 0.00 0.00 57.00 56.97 2k6q n GLN 26 Cb 0.46 -1.16 -0.12 0.00 1.02 0.00 0.00 30.24 30.44 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 -2.44 3.43 0.15 1.08 3.76 0.20 -4.90 115.29 116.57 2k6q s HIS 27 Ca -0.24 -3.28 -0.03 0.00 -0.15 0.00 0.00 55.06 51.36 2k6q s HIS 27 Cb 0.08 -2.64 -0.03 0.00 1.11 0.00 0.00 32.58 31.10 2k6q s HIS 27 CO 0.32 -0.58 1.36 -1.00 -0.85 0.00 0.00 174.74 174.00 2k6q h PRO 28 N 5.51 0.39 -1.16 8.40 0.13 -1.69 -3.13 132.00 140.46 2k6q h PRO 28 Ca 0.13 -0.38 -0.28 0.00 -0.87 0.00 0.00 66.00 64.60 2k6q h PRO 28 Cb 0.77 0.10 -0.15 0.00 0.13 0.00 0.00 31.00 31.85 2k6q h PRO 28 CO 0.70 1.04 0.36 0.25 -0.23 0.00 0.00 178.00 180.12 2k6q n THR 29 N -3.78 2.32 -4.00 1.56 -2.24 -1.26 -4.83 114.28 102.04 2k6q n THR 29 Ca -0.05 -1.19 -0.11 0.00 -2.27 0.00 0.00 64.05 60.43 2k6q n THR 29 Cb 0.78 -0.92 -0.12 0.00 -2.10 0.00 0.00 70.33 67.97 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 0.35 -0.35 -0.78 -0.14 -1.18 -3.77 119.74 112.15 2k6q s LYS 30 Ca 0.29 -0.57 -0.12 0.00 -1.36 0.00 0.00 55.97 54.22 2k6q s LYS 30 Cb 0.24 -0.06 -0.00 0.00 -1.68 0.00 0.00 37.83 36.33 2k6q s LYS 30 CO 0.04 -0.00 0.22 0.42 -0.76 0.00 0.00 175.35 175.26 2k6q s ILE 31 N -1.20 4.98 0.20 2.17 -1.09 0.69 -4.92 121.20 122.02 2k6q s ILE 31 Ca -0.11 -0.44 -0.30 0.00 -2.23 0.00 0.00 60.65 57.57 2k6q s ILE 31 Cb -0.08 -3.62 -0.08 0.00 -1.58 0.00 0.00 42.46 37.10 2k6q s ILE 31 CO -0.00 -0.07 1.11 -2.16 -1.23 0.00 0.00 174.94 172.59 2k6q s PRO 32 N 1.66 4.59 -0.01 2.79 0.04 -1.26 -1.83 135.00 140.98 2k6q s PRO 32 Ca 0.05 1.75 -0.10 0.00 0.04 0.00 0.00 61.00 62.74 2k6q s PRO 32 Cb -0.18 -3.26 0.01 0.00 0.04 0.00 0.00 34.50 31.11 2k6q s PRO 32 CO 0.09 0.08 0.20 0.14 0.04 0.00 0.00 177.00 177.55 2k6q s VAL 33 N -0.38 0.07 -0.42 -0.36 -7.23 -1.10 -3.17 120.40 107.81 2k6q s VAL 33 Ca 0.49 -0.56 0.04 0.00 -1.81 0.00 0.00 61.98 60.14 2k6q s VAL 33 Cb -0.30 -0.48 0.11 0.00 0.56 0.00 0.00 36.38 36.27 2k6q s VAL 33 CO 0.36 -0.31 0.14 -0.63 -0.31 0.00 0.00 175.10 174.36 2k6q s ILE 34 N -1.23 2.31 -0.15 -0.62 -1.09 0.21 -2.52 121.20 118.11 2k6q s ILE 34 Ca -0.13 -2.71 -0.18 0.00 -2.23 0.00 0.00 60.65 55.40 2k6q s ILE 34 Cb -0.06 -2.67 -0.04 0.00 -1.58 0.00 0.00 42.46 38.11 2k6q s ILE 34 CO 0.02 -0.69 0.48 -0.63 -1.23 0.00 0.00 174.94 172.88 2k6q s ILE 35 N 0.43 5.17 0.31 2.92 1.01 -0.82 -2.42 121.20 127.79 2k6q s ILE 35 Ca 0.14 0.91 0.04 0.00 0.00 0.00 0.00 60.65 61.74 2k6q s ILE 35 Cb -0.22 -3.81 -0.06 0.00 0.01 0.00 0.00 42.46 38.38 2k6q s ILE 35 CO -0.05 0.27 0.03 -1.61 0.00 0.00 0.00 174.94 173.58 2k6q s GLU 36 N 1.02 1.61 0.06 2.79 2.02 -0.80 -4.48 118.70 120.90 2k6q s GLU 36 Ca 0.24 -1.87 -0.30 0.00 0.02 0.00 0.00 54.97 53.06 2k6q s GLU 36 Cb -0.15 -0.91 -0.04 0.00 0.10 0.00 0.00 34.13 33.12 2k6q s GLU 36 CO 0.10 -0.13 0.98 -0.98 0.02 0.00 0.00 175.26 175.24 2k6q s ARG 37 N -3.85 4.62 0.22 1.61 1.70 -1.26 -1.17 118.95 120.81 2k6q s ARG 37 Ca 0.34 1.45 -0.32 0.00 -0.47 0.00 0.00 55.73 56.73 2k6q s ARG 37 Cb 0.08 -3.41 -0.13 0.00 -0.57 0.00 0.00 34.95 30.92 2k6q s ARG 37 CO 0.14 0.07 1.63 0.98 -1.08 0.00 0.00 175.30 177.04 2k6q n TYR 38 N 3.36 2.59 -1.51 5.89 4.19 -0.82 -4.78 117.16 126.09 2k6q n TYR 38 Ca 0.04 0.18 -0.41 0.00 3.31 0.00 0.00 57.90 61.02 2k6q n TYR 38 Cb 0.50 -2.61 -0.08 0.00 0.49 0.00 0.00 39.34 37.64 2k6q n TYR 38 CO 0.00 0.00 0.00 0.36 0.91 0.00 0.00 176.86 178.13 2k6q n LYS 39 N 3.28 0.70 0.00 2.98 2.85 -1.26 0.12 118.16 126.83 2k6q n LYS 39 Ca 0.14 0.06 0.00 0.00 -1.05 0.00 0.00 58.31 57.47 2k6q n LYS 39 Cb 0.33 -2.57 0.00 0.00 -0.65 0.00 0.00 35.03 32.14 2k6q n LYS 39 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2k6q n GLY 40 N 6.30 1.40 3.42 2.58 0.00 -1.26 -5.08 105.19 112.56 2k6q n GLY 40 Ca 0.48 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 46.06 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 -0.26 3.10 -0.06 1.61 2.12 0.32 -4.79 118.70 120.74 2k6q s GLU 41 Ca 0.00 -1.02 0.03 0.00 0.36 0.00 0.00 54.97 54.34 2k6q s GLU 41 Cb 0.00 -4.15 -0.06 0.00 0.26 0.00 0.00 34.13 30.19 2k6q s GLU 41 CO 0.00 -1.31 -0.01 0.36 -0.54 0.00 0.00 175.26 173.76 2k6q n LYS 42 N 6.19 2.01 0.00 4.30 0.00 -1.26 -4.80 118.16 124.61 2k6q n LYS 42 Ca -0.08 0.01 0.00 0.00 -0.00 0.00 0.00 58.31 58.25 2k6q n LYS 42 Cb 0.44 -1.13 0.00 0.00 -0.00 0.00 0.00 35.03 34.34 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 -2.38 0.00 -1.62 -1.58 1.13 -1.26 -4.62 117.38 107.04 2k6q n GLN 43 Ca -0.10 0.52 -0.39 0.00 -1.94 0.00 0.00 57.00 55.09 2k6q n GLN 43 Cb 0.65 -1.30 0.04 0.00 0.11 0.00 0.00 30.24 29.74 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 -1.75 3.51 -4.79 1.08 4.77 -1.26 -4.97 117.00 113.59 2k6q n LEU 44 Ca 0.00 0.89 -0.29 0.00 -0.03 0.00 0.00 56.01 56.58 2k6q n LEU 44 Cb 0.00 -1.40 0.13 0.00 -2.33 0.00 0.00 43.42 39.83 2k6q n LEU 44 CO 0.00 -1.64 0.71 -2.16 -1.33 0.00 0.00 177.39 172.98 2k6q s PRO 45 N -2.54 1.16 0.04 3.23 0.04 -1.26 -5.00 135.00 130.67 2k6q s PRO 45 Ca 0.71 0.29 -0.30 0.00 0.04 0.00 0.00 61.00 61.75 2k6q s PRO 45 Cb -0.45 -1.84 -0.04 0.00 0.04 0.00 0.00 34.50 32.20 2k6q s PRO 45 CO 0.50 -2.19 0.99 0.08 0.04 0.00 0.00 177.00 176.43 2k6q s VAL 46 N -3.28 4.68 0.58 -0.36 1.01 -1.26 -5.00 120.40 116.76 2k6q s VAL 46 Ca 0.64 2.02 -0.20 0.00 0.00 0.00 0.00 61.98 64.43 2k6q s VAL 46 Cb -0.15 -4.29 -0.04 0.00 0.00 0.00 0.00 36.38 31.90 2k6q s VAL 46 CO 0.53 0.21 1.32 -0.22 0.00 0.00 0.00 175.10 176.94 2k6q s LEU 47 N 0.67 3.76 0.32 3.92 1.98 -1.26 -4.86 118.68 123.21 2k6q s LEU 47 Ca 0.51 2.67 0.09 0.00 -2.89 0.00 0.00 54.13 54.51 2k6q s LEU 47 Cb -0.22 -4.40 0.90 0.00 0.66 0.00 0.00 46.19 43.12 2k6q s LEU 47 CO 0.29 -1.67 1.69 0.44 -1.89 0.00 0.00 176.35 175.21 2k6q h ASP 48 N 1.16 0.50 -2.25 3.68 5.19 -1.94 -3.44 116.42 119.32 2k6q h ASP 48 Ca -0.51 0.16 -0.07 0.00 -0.62 0.00 0.00 57.03 55.99 2k6q h ASP 48 Cb 1.31 0.11 -0.01 0.00 0.18 0.00 0.00 39.33 40.91 2k6q h ASP 48 CO 0.56 -0.01 0.02 2.29 -3.12 0.00 0.00 179.24 178.97 2k6q n LYS 49 N -5.00 0.38 -0.04 3.56 0.00 -1.26 -5.07 118.16 110.73 2k6q n LYS 49 Ca 0.27 -1.07 -0.03 0.00 -0.00 0.00 0.00 58.31 57.47 2k6q n LYS 49 Cb 0.79 1.16 -0.06 0.00 -0.00 0.00 0.00 35.03 36.92 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 -0.24 0.49 -3.10 0.58 -1.04 -1.26 -4.92 114.28 104.79 2k6q n THR 50 Ca -0.02 -0.31 -0.40 0.00 -2.04 0.00 0.00 64.05 61.28 2k6q n THR 50 Cb 0.25 -0.73 -0.06 0.00 -1.82 0.00 0.00 70.33 67.97 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 -2.20 4.22 0.04 -2.82 1.02 -1.26 -1.94 119.74 116.79 2k6q s LYS 51 Ca -0.04 0.66 0.04 0.00 0.02 0.00 0.00 55.97 56.65 2k6q s LYS 51 Cb 0.02 -3.57 -0.02 0.00 -0.52 0.00 0.00 37.83 33.74 2k6q s LYS 51 CO 0.31 -0.24 -0.11 -0.06 -0.92 0.00 0.00 175.35 174.33 2k6q s PHE 52 N 1.91 0.99 -0.37 3.18 0.40 -1.05 -5.04 117.98 118.01 2k6q s PHE 52 Ca 0.30 -0.36 -0.02 0.00 -0.60 0.00 0.00 56.93 56.25 2k6q s PHE 52 Cb -0.16 -0.59 0.09 0.00 0.51 0.00 0.00 43.02 42.87 2k6q s PHE 52 CO 0.11 0.00 0.12 -0.51 0.70 0.00 0.00 175.22 175.64 2k6q s LEU 53 N -1.14 4.74 0.15 -0.37 1.43 -1.26 -2.70 118.68 119.52 2k6q s LEU 53 Ca -0.01 -1.74 -0.19 0.00 -1.03 0.00 0.00 54.13 51.15 2k6q s LEU 53 Cb -0.08 -1.78 -0.07 0.00 0.03 0.00 0.00 46.19 44.29 2k6q s LEU 53 CO 0.01 -0.43 0.64 -0.69 0.23 0.00 0.00 176.35 176.11 2k6q s VAL 54 N 1.18 4.66 0.12 -1.59 1.01 -0.76 -4.86 120.40 120.16 2k6q s VAL 54 Ca 0.04 1.22 -0.30 0.00 0.00 0.00 0.00 61.98 62.94 2k6q s VAL 54 Cb -0.21 -3.89 -0.07 0.00 0.00 0.00 0.00 36.38 32.21 2k6q s VAL 54 CO -0.03 0.38 1.14 -2.16 0.00 0.00 0.00 175.10 174.43 2k6q s PRO 55 N -1.55 4.52 -0.24 2.72 0.04 -1.26 -0.22 135.00 139.01 2k6q s PRO 55 Ca 0.36 1.73 -0.03 0.00 0.04 0.00 0.00 61.00 63.10 2k6q s PRO 55 Cb -0.18 -3.31 0.04 0.00 0.04 0.00 0.00 34.50 31.08 2k6q s PRO 55 CO 0.21 -0.08 2.55 -0.40 0.04 0.00 0.00 177.00 179.32 2k6q n ASP 56 N 3.08 6.04 -0.23 6.66 3.85 -1.25 -3.27 116.55 131.44 2k6q n ASP 56 Ca 0.05 -2.88 0.00 0.00 -0.71 0.00 0.00 54.79 51.26 2k6q n ASP 56 Cb 0.46 -1.19 0.00 0.00 -1.35 0.00 0.00 41.12 39.04 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 1.12 0.00 -3.51 2.11 1.44 -1.26 -4.95 115.22 110.18 2k6q n HIS 57 Ca 0.33 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 56.04 2k6q n HIS 57 Cb 0.62 0.01 0.00 0.00 0.12 0.00 0.00 29.99 30.75 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 -4.37 0.61 0.24 -1.20 -5.14 118.33 108.47 2k6q n VAL 58 Ca 0.00 0.00 -0.25 0.00 -2.04 0.00 0.00 64.34 62.05 2k6q n VAL 58 Cb 0.58 0.00 -0.09 0.00 -1.47 0.00 0.00 33.84 32.85 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 -0.01 4.01 0.61 -1.34 4.22 -1.26 -3.56 114.94 117.61 2k6q s ASN 59 Ca 0.00 -0.78 0.26 0.00 -2.14 0.00 0.00 52.86 50.20 2k6q s ASN 59 Cb 0.00 -0.56 1.20 0.00 1.28 0.00 0.00 41.25 43.17 2k6q s ASN 59 CO 0.00 0.06 1.63 0.00 -2.04 0.00 0.00 177.10 176.75 2k6q h MET 60 N 2.47 0.00 0.19 3.55 -0.00 -1.80 0.23 114.93 119.58 2k6q h MET 60 Ca -0.44 0.00 -0.01 0.00 -0.00 0.00 0.00 59.70 59.26 2k6q h MET 60 Cb 1.23 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 -0.11 1.03 -0.00 0.00 0.00 176.91 178.39 2k6q h SER 61 N 0.00 -0.28 -0.76 -0.10 0.87 -1.91 -2.64 113.55 108.73 2k6q h SER 61 Ca 0.26 0.02 0.15 0.00 -1.23 0.00 0.00 61.79 60.99 2k6q h SER 61 Cb 1.77 0.08 -0.14 0.00 -0.44 0.00 0.00 62.40 63.67 2k6q h SER 61 CO -0.00 -0.18 -0.18 -0.33 -0.53 0.00 0.00 176.83 175.60 2k6q h GLU 62 N -0.29 0.00 -1.01 2.24 4.39 -0.92 0.99 114.58 119.98 2k6q h GLU 62 Ca -0.02 -0.00 0.21 0.00 0.34 0.00 0.00 59.36 59.90 2k6q h GLU 62 Cb 0.24 -0.00 -0.11 0.00 -0.10 0.00 0.00 28.75 28.78 2k6q h GLU 62 CO 0.02 0.00 0.61 1.25 -1.16 0.00 0.00 179.01 179.73 2k6q h LEU 63 N 0.00 0.74 -1.68 1.33 7.12 -1.53 1.35 115.31 122.64 2k6q h LEU 63 Ca 0.37 0.11 -0.03 0.00 0.13 0.00 0.00 57.88 58.46 2k6q h LEU 63 Cb 0.57 -0.01 -0.01 0.00 -0.53 0.00 0.00 40.66 40.68 2k6q h LEU 63 CO -0.78 0.20 -0.12 0.40 -0.13 0.00 0.00 178.44 178.02 2k6q h ILE 64 N 0.69 1.11 -0.00 4.05 1.08 0.12 0.97 117.51 125.52 2k6q h ILE 64 Ca 0.61 -0.50 -0.18 0.00 -0.39 0.00 0.00 64.86 64.40 2k6q h ILE 64 Cb 1.04 1.22 -0.02 0.00 -3.07 0.00 0.00 36.82 35.99 2k6q h ILE 64 CO -0.42 0.15 -0.82 0.11 -0.69 0.00 0.00 178.15 176.48 2k6q h LYS 65 N 0.05 0.10 0.20 2.37 1.79 0.24 -2.29 116.57 119.03 2k6q h LYS 65 Ca 0.01 -0.10 -0.01 0.00 -2.18 0.00 0.00 60.65 58.37 2k6q h LYS 65 Cb 0.25 0.03 0.00 0.00 -1.58 0.00 0.00 32.23 30.93 2k6q h LYS 65 CO 0.02 0.86 -0.10 0.82 -1.08 0.00 0.00 179.45 179.97 2k6q h ILE 66 N 0.06 0.82 0.20 1.86 1.08 0.57 -0.65 117.51 121.45 2k6q h ILE 66 Ca -0.02 -0.97 0.00 0.00 -0.39 0.00 0.00 64.86 63.48 2k6q h ILE 66 Cb 1.43 1.32 -0.04 0.00 -3.07 0.00 0.00 36.82 36.46 2k6q h ILE 66 CO 0.12 0.19 -0.46 0.40 -0.69 0.00 0.00 178.15 177.70 2k6q h ILE 67 N -0.81 0.00 -0.08 -0.67 1.08 -0.94 0.36 117.51 116.45 2k6q h ILE 67 Ca -0.03 0.00 0.02 0.00 -0.39 0.00 0.00 64.86 64.47 2k6q h ILE 67 Cb 0.52 0.00 -0.00 0.00 -3.07 0.00 0.00 36.82 34.26 2k6q h ILE 67 CO 0.04 0.00 0.18 0.08 -0.69 0.00 0.00 178.15 177.76 2k6q h ARG 68 N -0.73 0.00 0.00 2.37 0.11 -1.51 0.58 114.38 115.20 2k6q h ARG 68 Ca -0.02 0.00 -0.10 0.00 0.10 0.00 0.00 59.98 59.96 2k6q h ARG 68 Cb 0.70 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.77 2k6q h ARG 68 CO -0.20 0.00 -0.47 0.00 0.10 0.00 0.00 179.97 179.40 2k6q h ARG 69 N 0.00 0.00 0.08 0.08 2.47 1.00 -2.22 114.38 115.78 2k6q h ARG 69 Ca 0.04 0.00 -0.20 0.00 -1.26 0.00 0.00 59.98 58.56 2k6q h ARG 69 Cb 0.39 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 28.71 2k6q h ARG 69 CO -0.00 0.47 -0.98 0.00 0.56 0.00 0.00 179.97 180.01 2k6q h ARG 70 N 0.00 0.17 0.00 0.04 -0.00 0.38 -3.30 114.38 111.67 2k6q h ARG 70 Ca -0.00 -0.29 -0.03 0.00 -0.50 0.00 0.00 59.98 59.15 2k6q h ARG 70 Cb 1.35 0.11 -0.00 0.00 0.00 0.00 0.00 29.97 31.42 2k6q h ARG 70 CO 0.06 1.14 -0.16 -0.07 0.00 0.00 0.00 179.97 180.94 2k6q h LEU 71 N -0.57 0.00 -2.05 3.04 3.38 -1.18 -3.46 115.31 114.47 2k6q h LEU 71 Ca -0.22 0.00 -0.54 0.00 0.09 0.00 0.00 57.88 57.21 2k6q h LEU 71 Cb 1.51 0.00 -0.19 0.00 0.09 0.00 0.00 40.66 42.07 2k6q h LEU 71 CO 0.02 0.16 -0.85 0.00 0.09 0.00 0.00 178.44 177.87 2k6q n GLN 72 N -3.63 -0.94 -0.50 1.13 10.64 -0.84 -4.89 117.38 118.36 2k6q n GLN 72 Ca -0.01 0.08 -0.11 0.00 -1.83 0.00 0.00 57.00 55.12 2k6q n GLN 72 Cb 0.29 -3.15 0.09 0.00 -0.86 0.00 0.00 30.24 26.61 2k6q n GLN 72 CO 0.00 0.00 0.00 1.28 -1.83 0.00 0.00 177.06 176.51 2k6q n LEU 73 N -4.12 0.00 0.00 2.61 4.77 -1.26 -5.08 117.00 113.91 2k6q n LEU 73 Ca -0.28 -0.48 -0.11 0.00 -0.03 0.00 0.00 56.01 55.11 2k6q n LEU 73 Cb 0.61 -0.38 0.02 0.00 -2.33 0.00 0.00 43.42 41.33 2k6q n LEU 73 CO 0.75 -1.27 0.12 -0.46 -1.33 0.00 0.00 177.39 175.20 2k6q n ASN 74 N -3.59 1.45 0.11 -1.43 0.23 -1.26 -4.99 115.26 105.77 2k6q n ASN 74 Ca 0.06 -1.87 0.13 0.00 -0.53 0.00 0.00 54.58 52.37 2k6q n ASN 74 Cb 0.22 -0.13 0.43 0.00 -2.08 0.00 0.00 39.78 38.22 2k6q n ASN 74 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2k6q n ALA 75 N -2.55 2.15 0.06 -2.53 0.00 -1.26 -2.70 120.51 113.68 2k6q n ALA 75 Ca -0.08 -0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.32 2k6q n ALA 75 Cb 0.31 -1.45 -0.09 0.00 0.00 0.00 0.00 19.45 18.22 2k6q n ALA 75 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.50 176.53 2k6q h ASN 76 N 0.00 0.00 -3.40 0.00 -0.00 -2.05 -3.45 115.58 106.68 2k6q h ASN 76 Ca 0.00 0.00 -0.55 0.00 -0.00 0.00 0.00 56.30 55.75 2k6q h ASN 76 Cb 0.65 0.00 -0.04 0.00 -0.00 0.00 0.00 38.32 38.94 2k6q h ASN 76 CO 0.00 0.84 0.10 -1.58 -0.00 0.00 0.00 177.43 176.79 2k6q s GLN 77 N -2.77 4.43 -0.14 6.67 2.00 -1.10 -5.06 119.66 123.69 2k6q s GLN 77 Ca -0.00 0.98 -0.01 0.00 -2.00 0.00 0.00 55.36 54.33 2k6q s GLN 77 Cb 0.09 -3.29 -0.01 0.00 0.80 0.00 0.00 33.01 30.60 2k6q s GLN 77 CO 0.80 0.50 -0.11 0.00 -0.50 0.00 0.00 175.29 175.98 2k6q s ALA 78 N -0.78 2.67 0.01 1.58 0.00 -1.26 -4.66 121.76 119.31 2k6q s ALA 78 Ca 0.34 -0.92 0.08 0.00 0.00 0.00 0.00 51.96 51.46 2k6q s ALA 78 Cb -0.21 -1.29 -0.02 0.00 0.00 0.00 0.00 23.12 21.59 2k6q s ALA 78 CO 0.23 0.16 -0.25 0.12 0.00 0.00 0.00 175.76 176.02 2k6q s PHE 79 N 0.49 2.22 -0.07 0.00 5.36 -1.26 -3.84 117.98 120.88 2k6q s PHE 79 Ca -0.08 -0.41 -0.04 0.00 -0.96 0.00 0.00 56.93 55.44 2k6q s PHE 79 Cb -0.16 -1.39 0.03 0.00 -0.34 0.00 0.00 43.02 41.17 2k6q s PHE 79 CO 0.04 0.03 0.15 -0.06 -1.46 0.00 0.00 175.22 173.92 2k6q s PHE 80 N -0.68 -0.18 -0.25 10.12 0.08 0.37 -4.89 117.98 122.55 2k6q s PHE 80 Ca 0.10 0.48 -0.12 0.00 0.12 0.00 0.00 56.93 57.51 2k6q s PHE 80 Cb -0.10 -0.03 -0.05 0.00 -0.57 0.00 0.00 43.02 42.28 2k6q s PHE 80 CO 0.00 -0.15 0.25 -1.17 -0.10 0.00 0.00 175.22 174.05 2k6q s LEU 81 N 0.86 4.08 -0.43 -0.37 1.98 -1.26 -0.88 118.68 122.66 2k6q s LEU 81 Ca -0.06 0.17 -0.11 0.00 -2.89 0.00 0.00 54.13 51.24 2k6q s LEU 81 Cb -0.08 -2.23 0.08 0.00 0.66 0.00 0.00 46.19 44.61 2k6q s LEU 81 CO -0.04 -0.04 0.29 -0.76 -1.89 0.00 0.00 176.35 173.90 2k6q s LEU 82 N 1.50 5.24 -0.38 -0.68 2.01 0.22 -4.05 118.68 122.54 2k6q s LEU 82 Ca 0.10 -1.45 -0.29 0.00 0.01 0.00 0.00 54.13 52.51 2k6q s LEU 82 Cb -0.15 -2.03 0.01 0.00 0.01 0.00 0.00 46.19 44.03 2k6q s LEU 82 CO 0.08 -0.56 1.33 -0.69 1.01 0.00 0.00 176.35 177.52 2k6q s VAL 83 N 1.48 4.04 -0.13 -1.59 1.01 0.61 -0.72 120.40 125.09 2k6q s VAL 83 Ca 0.03 1.10 0.00 0.00 0.00 0.00 0.00 61.98 63.12 2k6q s VAL 83 Cb -0.23 -4.25 0.00 0.00 0.00 0.00 0.00 36.38 31.89 2k6q s VAL 83 CO 0.03 -0.70 0.00 -3.20 0.00 0.00 0.00 175.10 171.23 2k6q n ASN 84 N 8.24 -4.94 0.00 3.32 2.85 -1.04 -0.90 115.26 122.78 2k6q n ASN 84 Ca 0.15 0.03 0.00 0.00 -0.11 0.00 0.00 54.58 54.65 2k6q n ASN 84 Cb 0.48 -2.55 0.00 0.00 1.24 0.00 0.00 39.78 38.94 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 -0.46 1.03 3.10 8.20 0.00 -1.08 -4.96 105.19 111.01 2k6q n GLY 85 Ca -0.01 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.81 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 1.07 1.10 1.61 -3.43 -0.08 -4.98 115.29 108.59 2k6q s HIS 86 Ca 0.00 -0.29 -0.13 0.00 -0.80 0.00 0.00 55.06 53.84 2k6q s HIS 86 Cb 0.00 -0.66 0.21 0.00 -1.43 0.00 0.00 32.58 30.70 2k6q s HIS 86 CO 0.00 0.00 0.80 -1.13 -2.00 0.00 0.00 174.74 172.41 2k6q n SER 87 N 2.26 -1.50 -0.46 7.38 3.41 -1.26 0.22 113.62 123.67 2k6q n SER 87 Ca -0.16 -0.01 0.05 0.00 -0.26 0.00 0.00 58.87 58.48 2k6q n SER 87 Cb 0.55 -1.24 0.12 0.00 -0.26 0.00 0.00 64.21 63.38 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 -4.02 2.84 -1.42 4.33 0.00 -1.26 -4.58 117.12 113.02 2k6q n MET 88 Ca 0.05 -2.00 -0.54 0.00 0.00 0.00 0.00 57.70 55.21 2k6q n MET 88 Cb 0.55 -1.26 -0.06 0.00 0.00 0.00 0.00 33.22 32.45 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 0.04 0.69 -0.87 3.17 3.14 -1.26 -1.02 118.33 122.22 2k6q n VAL 89 Ca 0.10 -0.17 0.00 0.00 -2.96 0.00 0.00 64.34 61.30 2k6q n VAL 89 Cb 0.43 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.21 2k6q n VAL 89 CO 0.00 0.00 0.00 -1.54 -6.46 0.00 0.00 176.83 168.83 2k6q n SER 90 N 1.63 -1.73 -4.36 6.55 3.41 -1.26 -4.90 113.62 112.97 2k6q n SER 90 Ca 0.19 0.00 -0.35 0.00 -0.26 0.00 0.00 58.87 58.44 2k6q n SER 90 Cb 0.14 -0.35 -0.16 0.00 -0.26 0.00 0.00 64.21 63.58 2k6q n SER 90 CO 0.00 0.00 0.00 0.55 -0.16 0.00 0.00 175.04 175.43 2k6q n VAL 91 N -2.79 0.00 -0.59 -3.33 3.14 -0.19 -4.57 118.33 110.00 2k6q n VAL 91 Ca 0.00 -0.11 0.00 0.00 -2.96 0.00 0.00 64.34 61.27 2k6q n VAL 91 Cb 0.09 -0.37 0.00 0.00 -1.06 0.00 0.00 33.84 32.50 2k6q n VAL 91 CO 0.00 0.00 0.00 -0.24 -6.46 0.00 0.00 176.83 170.13 2k6q n SER 92 N 9.03 0.79 -4.34 6.55 2.88 -1.26 -4.91 113.62 122.36 2k6q n SER 92 Ca 0.64 -1.38 -0.30 0.00 -1.33 0.00 0.00 58.87 56.50 2k6q n SER 92 Cb 0.05 0.00 -0.15 0.00 -0.75 0.00 0.00 64.21 63.36 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 -0.38 2.13 0.27 2.46 2.01 -1.26 -5.10 115.64 115.76 2k6q s THR 93 Ca 0.00 -1.35 -0.30 0.00 0.31 0.00 0.00 61.69 60.36 2k6q s THR 93 Cb 0.00 -1.81 -0.09 0.00 0.01 0.00 0.00 72.50 70.61 2k6q s THR 93 CO 0.00 0.40 1.08 -2.16 -0.69 0.00 0.00 174.62 173.26 2k6q s PRO 94 N -1.14 4.66 0.63 4.92 0.04 -1.26 -2.76 135.00 140.09 2k6q s PRO 94 Ca 0.11 1.77 0.26 0.00 0.04 0.00 0.00 61.00 63.18 2k6q s PRO 94 Cb -0.10 -3.21 1.34 0.00 0.04 0.00 0.00 34.50 32.57 2k6q s PRO 94 CO 0.02 0.23 1.76 0.97 0.04 0.00 0.00 177.00 180.01 2k6q h ILE 95 N 3.17 0.16 -0.43 0.56 6.09 -1.81 1.07 117.51 126.32 2k6q h ILE 95 Ca -0.46 0.00 -0.14 0.00 -1.37 0.00 0.00 64.86 62.89 2k6q h ILE 95 Cb 1.21 0.51 -0.01 0.00 0.47 0.00 0.00 36.82 39.00 2k6q h ILE 95 CO 0.68 0.00 -0.27 -1.28 -3.07 0.00 0.00 178.15 174.20 2k6q h SER 96 N 0.00 0.95 0.03 2.19 0.87 -1.87 -2.13 113.55 113.59 2k6q h SER 96 Ca 0.14 -0.38 -0.15 0.00 -1.23 0.00 0.00 61.79 60.17 2k6q h SER 96 Cb 1.25 -0.26 -0.01 0.00 -0.44 0.00 0.00 62.40 62.93 2k6q h SER 96 CO -0.00 1.16 -0.81 -0.33 -0.53 0.00 0.00 176.83 176.32 2k6q h GLU 97 N 0.78 0.06 -1.10 2.24 4.39 0.62 -2.74 114.58 118.83 2k6q h GLU 97 Ca 0.09 -0.10 0.30 0.00 0.34 0.00 0.00 59.36 59.99 2k6q h GLU 97 Cb 0.84 0.04 -0.09 0.00 -0.10 0.00 0.00 28.75 29.44 2k6q h GLU 97 CO 0.07 1.05 0.72 0.28 -1.16 0.00 0.00 179.01 179.97 2k6q h VAL 98 N -0.85 0.46 0.12 3.13 2.07 -0.58 1.67 116.25 122.28 2k6q h VAL 98 Ca -0.20 -0.09 -0.28 0.00 0.82 0.00 0.00 66.70 66.94 2k6q h VAL 98 Cb 1.29 0.16 0.00 0.00 -1.52 0.00 0.00 31.29 31.22 2k6q h VAL 98 CO -0.07 0.05 -1.29 0.22 0.02 0.00 0.00 177.57 176.50 2k6q h TYR 99 N 0.28 0.46 -0.00 1.57 5.03 -1.49 -2.69 116.97 120.13 2k6q h TYR 99 Ca 0.61 -0.34 0.00 0.00 2.58 0.00 0.00 58.73 61.58 2k6q h TYR 99 Cb 1.77 -0.02 0.00 0.00 1.55 0.00 0.00 36.73 40.03 2k6q h TYR 99 CO -0.00 1.29 -0.06 -0.85 -1.32 0.00 0.00 178.16 177.21 2k6q n GLU 100 N -3.50 0.69 -0.06 1.82 0.28 0.23 0.45 120.64 120.54 2k6q n GLU 100 Ca -0.10 -0.16 0.03 0.00 -0.16 0.00 0.00 57.16 56.78 2k6q n GLU 100 Cb 1.03 -1.50 0.06 0.00 1.43 0.00 0.00 31.44 32.46 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 -1.02 2.10 0.00 -1.84 7.64 0.51 -4.71 113.62 116.30 2k6q n SER 101 Ca 0.16 -1.68 0.00 0.00 1.01 0.00 0.00 58.87 58.36 2k6q n SER 101 Cb 0.25 -0.08 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 0.21 0.00 -1.00 1.43 -0.58 -1.02 -5.01 120.64 114.68 2k6q n GLU 102 Ca 0.05 0.00 -0.32 0.00 -0.42 0.00 0.00 57.16 56.47 2k6q n GLU 102 Cb 0.27 -0.32 0.02 0.00 -0.57 0.00 0.00 31.44 30.83 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 -2.33 0.00 -2.36 3.49 -4.01 0.17 -4.97 116.66 106.66 2k6q n ARG 103 Ca 0.00 0.00 -0.12 0.00 -1.04 0.00 0.00 57.85 56.69 2k6q n ARG 103 Cb 0.14 -0.85 0.02 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 2.38 1.49 -0.29 2.89 9.92 -1.26 -4.90 116.55 126.79 2k6q n ASP 104 Ca 0.04 -1.88 0.11 0.00 -0.53 0.00 0.00 54.79 52.53 2k6q n ASP 104 Cb 0.42 -0.12 0.27 0.00 -0.64 0.00 0.00 41.12 41.05 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 0.32 -0.48 -1.24 5.08 -1.95 0.32 114.58 116.64 2k6q h GLU 105 Ca -0.16 -0.02 0.08 0.00 -1.00 0.00 0.00 59.36 58.26 2k6q h GLU 105 Cb 0.65 -0.07 -0.07 0.00 0.50 0.00 0.00 28.75 29.76 2k6q h GLU 105 CO 0.24 0.21 0.08 0.38 -1.00 0.00 0.00 179.01 178.93 2k6q h ASP 106 N 0.33 -0.02 0.00 1.42 2.03 -1.95 -3.46 116.42 114.76 2k6q h ASP 106 Ca 0.52 0.09 0.00 0.00 -0.73 0.00 0.00 57.03 56.91 2k6q h ASP 106 Cb 0.97 0.13 0.00 0.00 -0.83 0.00 0.00 39.33 39.59 2k6q h ASP 106 CO -0.55 0.02 0.00 0.61 -1.03 0.00 0.00 179.24 178.29 2k6q n GLY 107 N -1.28 1.51 3.29 7.15 0.00 0.11 -4.84 105.19 111.13 2k6q n GLY 107 Ca 0.05 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.75 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 2.60 0.22 1.61 2.19 -1.26 -4.83 117.98 116.51 2k6q s PHE 108 Ca 0.00 -0.78 -0.30 0.00 0.33 0.00 0.00 56.93 56.18 2k6q s PHE 108 Cb 0.00 -1.70 -0.08 0.00 -1.31 0.00 0.00 43.02 39.92 2k6q s PHE 108 CO 0.00 -0.26 0.98 -0.51 1.83 0.00 0.00 175.22 177.26 2k6q s LEU 109 N 0.11 4.60 -0.26 6.12 2.01 -1.19 -3.97 118.68 126.09 2k6q s LEU 109 Ca -0.10 1.98 0.01 0.00 0.01 0.00 0.00 54.13 56.03 2k6q s LEU 109 Cb -0.16 -3.61 0.07 0.00 0.01 0.00 0.00 46.19 42.51 2k6q s LEU 109 CO 0.06 0.05 -0.01 -0.31 1.01 0.00 0.00 176.35 177.15 2k6q s TYR 110 N -0.90 2.43 0.09 0.29 2.02 -1.26 0.66 117.35 120.68 2k6q s TYR 110 Ca 0.43 -1.90 0.04 0.00 -0.37 0.00 0.00 57.07 55.26 2k6q s TYR 110 Cb -0.27 -1.78 -0.03 0.00 -0.40 0.00 0.00 41.96 39.48 2k6q s TYR 110 CO 0.33 -0.81 -0.10 -1.64 -1.57 0.00 0.00 175.55 171.76 2k6q s MET 111 N 1.38 0.79 0.02 -0.62 -1.94 -1.02 -2.50 119.30 115.41 2k6q s MET 111 Ca -0.01 -1.08 0.07 0.00 -1.71 0.00 0.00 55.69 52.96 2k6q s MET 111 Cb -0.19 -0.52 -0.03 0.00 2.01 0.00 0.00 34.83 36.11 2k6q s MET 111 CO -0.10 0.08 -0.18 0.08 -0.01 0.00 0.00 175.02 174.90 2k6q s VAL 112 N -2.19 2.78 -0.02 -6.03 1.01 0.10 -1.90 120.40 114.15 2k6q s VAL 112 Ca 0.02 -1.10 0.07 0.00 0.00 0.00 0.00 61.98 60.98 2k6q s VAL 112 Cb -0.04 -2.14 -0.02 0.00 0.00 0.00 0.00 36.38 34.17 2k6q s VAL 112 CO 0.00 0.40 -0.24 -0.72 0.00 0.00 0.00 175.10 174.54 2k6q s TYR 113 N -0.87 2.13 0.19 5.22 -0.85 -0.32 0.71 117.35 123.56 2k6q s TYR 113 Ca 0.14 -0.41 -0.22 0.00 -0.52 0.00 0.00 57.07 56.06 2k6q s TYR 113 Cb -0.10 -1.37 0.08 0.00 0.38 0.00 0.00 41.96 40.94 2k6q s TYR 113 CO 0.04 -0.04 1.04 0.00 -1.52 0.00 0.00 175.55 175.07 2k6q s ALA 114 N -0.55 -1.59 -0.19 9.51 0.00 -0.06 -1.94 121.76 126.94 2k6q s ALA 114 Ca 0.09 -0.36 -0.01 0.00 0.00 0.00 0.00 51.96 51.68 2k6q s ALA 114 Cb -0.09 0.77 0.13 0.00 0.00 0.00 0.00 23.12 23.93 2k6q s ALA 114 CO -0.01 -1.07 2.01 0.45 0.00 0.00 0.00 175.76 177.14 2k6q n SER 115 N -1.25 6.01 -3.71 0.00 2.88 -1.25 0.14 113.62 116.44 2k6q n SER 115 Ca -0.03 -2.80 -0.12 0.00 -1.33 0.00 0.00 58.87 54.59 2k6q n SER 115 Cb 0.59 -1.08 -0.13 0.00 -0.75 0.00 0.00 64.21 62.84 2k6q n SER 115 CO 0.00 0.00 0.00 -1.10 -1.23 0.00 0.00 175.04 172.71 2k6q s GLN 116 N -1.09 0.24 0.00 -1.46 -0.21 -1.26 -4.87 119.66 111.01 2k6q s GLN 116 Ca 0.19 0.62 0.00 0.00 0.02 0.00 0.00 55.36 56.19 2k6q s GLN 116 Cb 0.15 -0.08 0.00 0.00 1.00 0.00 0.00 33.01 34.07 2k6q s GLN 116 CO -0.00 -0.18 0.23 -1.91 -2.12 0.00 0.00 175.29 171.31 2k6q n GLU 117 N 4.40 0.79 0.00 2.91 2.13 -1.26 -4.66 120.64 124.94 2k6q n GLU 117 Ca -0.22 -0.23 0.00 0.00 0.66 0.00 0.00 57.16 57.37 2k6q n GLU 117 Cb 0.53 -0.67 0.00 0.00 0.27 0.00 0.00 31.44 31.56 2k6q n GLU 117 CO 0.00 0.00 0.00 -2.37 -0.41 0.00 0.00 177.13 174.35 2k6q n THR 118 N -0.18 0.09 -0.41 6.31 5.66 -1.26 -4.54 114.28 119.95 2k6q n THR 118 Ca 0.00 -0.30 0.34 0.00 -3.05 0.00 0.00 64.05 61.03 2k6q n THR 118 Cb 0.07 1.35 0.61 0.00 -1.55 0.00 0.00 70.33 70.81 2k6q n THR 118 CO 0.00 0.00 0.00 2.19 -3.05 0.00 0.00 175.07 174.21 2k6q h PHE 119 N 0.00 0.59 0.00 1.09 -0.00 -1.97 -3.53 116.94 113.12 2k6q h PHE 119 Ca 0.00 0.03 0.00 0.00 -0.00 0.00 0.00 57.97 58.00 2k6q h PHE 119 Cb 0.33 -0.15 0.00 0.00 -0.00 0.00 0.00 35.95 36.13 2k6q h PHE 119 CO 0.00 -0.18 0.00 0.41 -0.00 0.00 0.00 178.31 178.54