#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 0.67 -0.16 4.33 0.00 -1.26 -5.12 119.30 117.76 2k6q s MET 1 Ca 0.00 -1.20 -0.29 0.00 0.00 0.00 0.00 55.69 54.20 2k6q s MET 1 Cb 0.00 0.03 -0.02 0.00 0.00 0.00 0.00 34.83 34.84 2k6q s MET 1 CO 0.00 -0.06 1.27 -1.25 0.00 0.00 0.00 175.02 174.98 2k6q s PRO 2 N -3.61 4.23 -0.15 3.16 0.04 -1.26 -4.97 135.00 132.45 2k6q s PRO 2 Ca 0.06 1.68 -0.33 0.00 0.04 0.00 0.00 61.00 62.45 2k6q s PRO 2 Cb 0.05 -3.76 0.13 0.00 0.04 0.00 0.00 34.50 30.96 2k6q s PRO 2 CO -0.07 -0.70 1.13 -1.54 0.04 0.00 0.00 177.00 175.86 2k6q s SER 3 N 2.00 -0.20 -0.02 6.66 1.04 -1.26 -5.18 113.70 116.74 2k6q s SER 3 Ca 0.55 0.02 -0.20 0.00 0.48 0.00 0.00 55.95 56.81 2k6q s SER 3 Cb -0.22 0.20 0.04 0.00 0.10 0.00 0.00 66.02 66.14 2k6q s SER 3 CO 0.15 -0.32 0.43 -1.83 0.98 0.00 0.00 173.24 172.65 2k6q s GLU 4 N -2.45 0.79 0.06 4.02 -1.05 -1.26 -5.17 118.70 113.65 2k6q s GLU 4 Ca 0.08 -0.06 -0.01 0.00 -0.15 0.00 0.00 54.97 54.83 2k6q s GLU 4 Cb -0.01 0.36 0.01 0.00 -0.44 0.00 0.00 34.13 34.06 2k6q s GLU 4 CO -0.05 -0.23 0.03 1.63 0.95 0.00 0.00 175.26 177.59 2k6q n LYS 5 N 1.14 -1.04 -4.36 -4.83 5.02 -1.26 -5.03 118.16 107.80 2k6q n LYS 5 Ca -0.21 -0.05 -0.22 0.00 -2.02 0.00 0.00 58.31 55.81 2k6q n LYS 5 Cb 0.56 -0.08 -0.11 0.00 -0.02 0.00 0.00 35.03 35.38 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 -0.80 1.93 0.61 -0.18 -4.23 -1.26 -4.81 115.64 106.89 2k6q s THR 6 Ca 0.02 -2.05 0.26 0.00 -1.18 0.00 0.00 61.69 58.75 2k6q s THR 6 Cb -0.00 -1.97 0.36 0.00 1.34 0.00 0.00 72.50 72.23 2k6q s THR 6 CO 0.02 -0.37 1.52 -0.26 -0.54 0.00 0.00 174.62 174.99 2k6q h PHE 7 N 2.97 0.00 -0.11 3.99 -1.00 -1.95 1.81 116.94 122.66 2k6q h PHE 7 Ca -0.41 0.00 -0.16 0.00 2.81 0.00 0.00 57.97 60.21 2k6q h PHE 7 Cb 1.22 0.00 0.01 0.00 3.61 0.00 0.00 35.95 40.78 2k6q h PHE 7 CO 0.71 0.00 -0.54 1.57 -1.61 0.00 0.00 178.31 178.43 2k6q h LYS 8 N 0.00 0.56 0.00 1.51 2.10 -1.95 -3.10 116.57 115.69 2k6q h LYS 8 Ca 0.35 -0.46 0.00 0.00 -2.00 0.00 0.00 60.65 58.54 2k6q h LYS 8 Cb 2.19 0.09 0.00 0.00 -0.90 0.00 0.00 32.23 33.61 2k6q h LYS 8 CO -0.00 1.08 -0.33 1.04 -2.00 0.00 0.00 179.45 179.24 2k6q n GLN 9 N -4.19 0.27 0.00 0.07 6.02 0.52 -4.64 117.38 115.44 2k6q n GLN 9 Ca -0.08 0.38 0.00 0.00 -0.01 0.00 0.00 57.00 57.30 2k6q n GLN 9 Cb 0.62 -1.28 0.00 0.00 1.02 0.00 0.00 30.24 30.60 2k6q n GLN 9 CO 0.00 0.00 0.00 -2.13 -1.01 0.00 0.00 177.06 173.92 2k6q n ARG 10 N -3.66 0.00 -1.68 -1.09 3.00 0.38 -4.36 116.66 109.25 2k6q n ARG 10 Ca -0.05 0.57 -0.44 0.00 -0.00 0.00 0.00 57.85 57.93 2k6q n ARG 10 Cb 0.17 -1.20 -0.04 0.00 0.00 0.00 0.00 32.46 31.39 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 -1.62 2.53 -1.94 -0.14 3.00 -1.17 -4.88 116.66 112.43 2k6q n ARG 11 Ca 0.00 0.92 -0.42 0.00 -0.01 0.00 0.00 57.85 58.34 2k6q n ARG 11 Cb 0.00 -2.78 -0.03 0.00 0.00 0.00 0.00 32.46 29.65 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 2.75 6.62 0.19 0.55 0.01 -1.26 -4.54 113.70 118.01 2k6q s SER 12 Ca 0.84 2.42 -0.25 0.00 1.31 0.00 0.00 55.95 60.27 2k6q s SER 12 Cb -0.57 -2.55 0.06 0.00 0.21 0.00 0.00 66.02 63.17 2k6q s SER 12 CO 0.41 -0.91 1.53 0.33 0.41 0.00 0.00 173.24 175.02 2k6q n PHE 13 N 6.19 -0.24 -0.18 2.43 7.35 -1.26 0.18 117.46 131.93 2k6q n PHE 13 Ca 0.16 1.23 0.11 0.00 -0.76 0.00 0.00 57.45 58.20 2k6q n PHE 13 Cb 0.41 -0.70 0.42 0.00 0.35 0.00 0.00 39.48 39.96 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 0.58 -0.48 -4.13 5.08 -1.99 0.12 114.58 113.75 2k6q h GLU 14 Ca 0.24 -0.03 -0.10 0.00 -1.00 0.00 0.00 59.36 58.47 2k6q h GLU 14 Cb 0.48 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.59 2k6q h GLU 14 CO -0.95 0.38 -0.07 0.37 -1.00 0.00 0.00 179.01 177.74 2k6q h GLN 15 N 0.59 0.90 0.66 2.33 4.15 0.16 -0.61 115.11 123.30 2k6q h GLN 15 Ca 0.36 -0.32 -0.03 0.00 0.77 0.00 0.00 58.65 59.42 2k6q h GLN 15 Cb 0.57 -0.06 0.01 0.00 0.21 0.00 0.00 27.48 28.21 2k6q h GLN 15 CO -0.13 0.97 -0.32 0.00 -1.93 0.00 0.00 178.83 177.42 2k6q h ARG 16 N 0.76 -0.86 -0.29 1.69 3.08 0.15 -3.04 114.38 115.87 2k6q h ARG 16 Ca 0.13 0.06 0.06 0.00 0.07 0.00 0.00 59.98 60.29 2k6q h ARG 16 Cb 0.61 0.20 -0.08 0.00 0.08 0.00 0.00 29.97 30.77 2k6q h ARG 16 CO 0.04 -0.57 -0.43 -0.24 -1.07 0.00 0.00 179.97 177.69 2k6q h VAL 17 N -1.20 0.12 -1.68 2.04 3.04 -0.91 0.64 116.25 118.30 2k6q h VAL 17 Ca -0.09 0.00 0.49 0.00 -1.01 0.00 0.00 66.70 66.09 2k6q h VAL 17 Cb 0.68 0.12 -0.07 0.00 -2.01 0.00 0.00 31.29 30.01 2k6q h VAL 17 CO 0.15 0.00 1.31 -0.08 -1.01 0.00 0.00 177.57 177.94 2k6q h GLU 18 N -0.40 0.00 0.15 4.17 4.81 -1.16 0.95 114.58 123.10 2k6q h GLU 18 Ca 0.11 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.33 2k6q h GLU 18 Cb 0.60 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.98 2k6q h GLU 18 CO -0.50 0.00 -0.07 0.22 -0.73 0.00 0.00 179.01 177.93 2k6q h ASP 19 N 0.00 -0.17 -0.87 1.04 3.58 0.40 -3.26 116.42 117.14 2k6q h ASP 19 Ca 0.80 -0.34 0.18 0.00 0.42 0.00 0.00 57.03 58.09 2k6q h ASP 19 Cb 3.42 0.04 -0.11 0.00 1.72 0.00 0.00 39.33 44.40 2k6q h ASP 19 CO -0.01 0.42 0.41 1.62 -2.88 0.00 0.00 179.24 178.80 2k6q h VAL 20 N -0.92 0.61 -1.29 2.25 3.04 0.14 0.45 116.25 120.51 2k6q h VAL 20 Ca -0.02 -0.18 0.39 0.00 -1.01 0.00 0.00 66.70 65.88 2k6q h VAL 20 Cb 0.49 0.05 -0.10 0.00 -2.01 0.00 0.00 31.29 29.73 2k6q h VAL 20 CO 0.03 0.09 0.87 -0.09 -1.01 0.00 0.00 177.57 177.47 2k6q h ARG 21 N 0.51 0.14 0.30 4.17 2.43 -0.97 0.57 114.38 121.53 2k6q h ARG 21 Ca 0.51 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.65 2k6q h ARG 21 Cb 0.84 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.36 2k6q h ARG 21 CO -0.44 0.09 -0.15 -0.07 -1.51 0.00 0.00 179.97 177.89 2k6q h LEU 22 N 0.14 -0.34 -2.05 3.80 3.38 -0.18 -1.30 115.31 118.76 2k6q h LEU 22 Ca 0.72 0.01 0.08 0.00 0.09 0.00 0.00 57.88 58.78 2k6q h LEU 22 Cb 2.36 0.09 -0.01 0.00 0.09 0.00 0.00 40.66 43.19 2k6q h LEU 22 CO -0.25 -0.20 0.36 0.40 0.09 0.00 0.00 178.44 178.84 2k6q h ILE 23 N -0.49 0.32 -0.08 1.22 5.03 -1.07 1.19 117.51 123.62 2k6q h ILE 23 Ca -0.04 0.00 -0.13 0.00 -0.12 0.00 0.00 64.86 64.57 2k6q h ILE 23 Cb 0.31 0.70 -0.01 0.00 -3.03 0.00 0.00 36.82 34.79 2k6q h ILE 23 CO 0.07 0.00 -0.51 0.03 -0.68 0.00 0.00 178.15 177.06 2k6q h ARG 24 N 0.00 0.22 0.00 2.37 2.47 0.35 0.91 114.38 120.69 2k6q h ARG 24 Ca 0.13 -0.12 0.00 0.00 -1.26 0.00 0.00 59.98 58.73 2k6q h ARG 24 Cb 0.86 0.01 0.00 0.00 -1.65 0.00 0.00 29.97 29.19 2k6q h ARG 24 CO -0.00 0.68 -1.28 -0.85 0.56 0.00 0.00 179.97 179.07 2k6q n GLU 25 N -3.94 0.36 -0.09 0.04 0.28 0.24 -4.03 120.64 113.50 2k6q n GLU 25 Ca -0.02 -0.06 -0.10 0.00 -0.16 0.00 0.00 57.16 56.82 2k6q n GLU 25 Cb 0.55 -1.48 -0.03 0.00 1.43 0.00 0.00 31.44 31.91 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 -1.72 0.52 -3.84 3.44 6.02 0.34 -4.79 117.38 117.36 2k6q n GLN 26 Ca 0.01 0.29 -0.29 0.00 -0.01 0.00 0.00 57.00 57.00 2k6q n GLN 26 Cb 0.39 -1.50 -0.11 0.00 1.02 0.00 0.00 30.24 30.05 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 -4.48 3.46 0.19 1.08 8.25 0.31 -4.87 115.22 119.16 2k6q n HIS 27 Ca -0.16 -4.28 0.07 0.00 -0.26 0.00 0.00 57.72 53.09 2k6q n HIS 27 Cb 0.49 -0.72 0.27 0.00 1.12 0.00 0.00 29.99 31.15 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 5.45 0.00 -0.10 -0.41 0.13 -1.68 -2.75 132.00 132.64 2k6q h PRO 28 Ca 0.15 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.28 2k6q h PRO 28 Cb 0.76 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.89 2k6q h PRO 28 CO 0.75 0.34 0.00 0.25 -0.23 0.00 0.00 178.00 179.11 2k6q n THR 29 N -3.34 0.13 -4.33 1.56 -2.24 -1.26 -4.80 114.28 100.00 2k6q n THR 29 Ca 0.01 -0.15 -0.19 0.00 -2.27 0.00 0.00 64.05 61.46 2k6q n THR 29 Cb 0.56 0.04 -0.10 0.00 -2.10 0.00 0.00 70.33 68.72 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 -1.87 1.27 -0.24 -0.78 -0.14 -1.04 -1.94 119.74 115.01 2k6q s LYS 30 Ca 0.14 -1.51 -0.07 0.00 -1.36 0.00 0.00 55.97 53.17 2k6q s LYS 30 Cb 0.07 -1.10 -0.03 0.00 -1.68 0.00 0.00 37.83 35.10 2k6q s LYS 30 CO 0.11 0.19 0.05 0.42 -0.76 0.00 0.00 175.35 175.36 2k6q s ILE 31 N -2.75 4.17 -0.01 2.17 -1.09 0.11 -4.85 121.20 118.95 2k6q s ILE 31 Ca 0.19 -0.22 -0.30 0.00 -2.23 0.00 0.00 60.65 58.09 2k6q s ILE 31 Cb -0.02 -2.94 -0.04 0.00 -1.58 0.00 0.00 42.46 37.88 2k6q s ILE 31 CO 0.06 0.36 1.19 -2.16 -1.23 0.00 0.00 174.94 173.16 2k6q s PRO 32 N 1.52 4.39 0.11 2.79 0.04 -1.26 -2.62 135.00 139.97 2k6q s PRO 32 Ca 0.06 1.71 0.04 0.00 0.04 0.00 0.00 61.00 62.84 2k6q s PRO 32 Cb -0.15 -3.47 -0.04 0.00 0.04 0.00 0.00 34.50 30.88 2k6q s PRO 32 CO 0.03 -0.36 -0.10 0.14 0.04 0.00 0.00 177.00 176.74 2k6q s VAL 33 N 1.72 1.02 -0.35 -0.36 -7.23 -1.12 -2.46 120.40 111.62 2k6q s VAL 33 Ca 0.57 -1.72 0.01 0.00 -1.81 0.00 0.00 61.98 59.02 2k6q s VAL 33 Cb -0.26 -1.47 0.11 0.00 0.56 0.00 0.00 36.38 35.32 2k6q s VAL 33 CO 0.25 -0.58 0.13 -0.63 -0.31 0.00 0.00 175.10 173.96 2k6q s ILE 34 N -2.58 1.21 -0.08 -0.62 -1.09 0.32 -2.25 121.20 116.11 2k6q s ILE 34 Ca 0.08 -1.85 -0.18 0.00 -2.23 0.00 0.00 60.65 56.47 2k6q s ILE 34 Cb -0.02 -1.89 -0.05 0.00 -1.58 0.00 0.00 42.46 38.92 2k6q s ILE 34 CO 0.00 -0.73 0.48 -0.63 -1.23 0.00 0.00 174.94 172.83 2k6q s ILE 35 N 1.16 5.13 -0.01 2.92 1.01 0.22 -2.48 121.20 129.15 2k6q s ILE 35 Ca 0.12 0.97 -0.01 0.00 0.00 0.00 0.00 60.65 61.73 2k6q s ILE 35 Cb -0.20 -3.81 0.00 0.00 0.01 0.00 0.00 42.46 38.46 2k6q s ILE 35 CO -0.16 0.38 0.02 -1.61 0.00 0.00 0.00 174.94 173.57 2k6q s GLU 36 N 0.23 0.03 0.36 2.79 0.41 -0.79 -4.45 118.70 117.28 2k6q s GLU 36 Ca 0.26 0.02 -0.27 0.00 -0.41 0.00 0.00 54.97 54.56 2k6q s GLU 36 Cb -0.16 0.01 -0.12 0.00 -1.78 0.00 0.00 34.13 32.09 2k6q s GLU 36 CO 0.12 -0.00 1.23 2.89 -0.49 0.00 0.00 175.26 179.00 2k6q n ARG 37 N 3.04 1.92 -1.82 1.61 1.85 -1.26 -2.89 116.66 119.11 2k6q n ARG 37 Ca -0.12 0.68 -0.41 0.00 -1.00 0.00 0.00 57.85 57.00 2k6q n ARG 37 Cb 0.60 -2.25 0.00 0.00 -1.05 0.00 0.00 32.46 29.76 2k6q n ARG 37 CO 0.00 0.00 0.00 -0.47 -0.01 0.00 0.00 177.63 177.15 2k6q s TYR 38 N -1.13 2.58 -0.67 2.89 6.14 -0.62 -4.80 117.35 121.73 2k6q s TYR 38 Ca 0.58 1.20 -0.25 0.00 0.64 0.00 0.00 57.07 59.24 2k6q s TYR 38 Cb -0.57 -3.98 -0.12 0.00 0.42 0.00 0.00 41.96 37.71 2k6q s TYR 38 CO 0.61 -2.92 2.42 0.36 0.64 0.00 0.00 175.55 176.66 2k6q n LYS 39 N 0.32 0.72 0.00 4.97 2.85 -1.26 0.69 118.16 126.46 2k6q n LYS 39 Ca 0.02 -0.37 0.00 0.00 -1.05 0.00 0.00 58.31 56.91 2k6q n LYS 39 Cb 0.40 -3.33 0.00 0.00 -0.65 0.00 0.00 35.03 31.45 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 6.36 1.59 3.61 2.58 0.00 -1.26 -5.09 105.19 112.98 2k6q n GLY 40 Ca 0.44 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 46.04 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 -0.06 3.90 -0.01 1.61 -6.30 0.22 -4.83 118.70 113.22 2k6q s GLU 41 Ca 0.00 0.54 0.00 0.00 -2.50 0.00 0.00 54.97 53.01 2k6q s GLU 41 Cb 0.00 -3.76 -0.01 0.00 0.00 0.00 0.00 34.13 30.36 2k6q s GLU 41 CO 0.00 -0.77 -0.01 0.36 0.02 0.00 0.00 175.26 174.86 2k6q n LYS 42 N 6.37 0.02 0.00 4.30 -0.00 -1.26 -4.88 118.16 122.71 2k6q n LYS 42 Ca 0.04 0.01 0.00 0.00 -0.00 0.00 0.00 58.31 58.36 2k6q n LYS 42 Cb 0.48 -1.00 0.00 0.00 -0.00 0.00 0.00 35.03 34.51 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 -2.55 0.00 -1.53 -1.58 6.02 -1.26 -4.58 117.38 111.91 2k6q n GLN 43 Ca -0.02 0.19 -0.37 0.00 -0.01 0.00 0.00 57.00 56.79 2k6q n GLN 43 Cb 0.52 -0.76 0.06 0.00 1.02 0.00 0.00 30.24 31.08 2k6q n GLN 43 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 2k6q n LEU 44 N -0.45 3.57 -4.80 1.08 4.77 -1.26 -4.97 117.00 114.94 2k6q n LEU 44 Ca 0.00 0.75 -0.30 0.00 -0.03 0.00 0.00 56.01 56.43 2k6q n LEU 44 Cb 0.00 -1.39 0.10 0.00 -2.33 0.00 0.00 43.42 39.80 2k6q n LEU 44 CO 0.00 -1.98 0.71 -2.16 -1.33 0.00 0.00 177.39 172.63 2k6q s PRO 45 N -2.95 1.98 -0.22 3.23 0.04 -1.26 -4.98 135.00 130.83 2k6q s PRO 45 Ca 0.75 0.60 -0.29 0.00 0.04 0.00 0.00 61.00 62.10 2k6q s PRO 45 Cb -0.39 -1.91 0.00 0.00 0.04 0.00 0.00 34.50 32.24 2k6q s PRO 45 CO 0.48 -1.68 1.14 0.08 0.04 0.00 0.00 177.00 177.06 2k6q s VAL 46 N -3.17 4.48 0.84 -0.36 1.01 -1.26 -4.97 120.40 116.98 2k6q s VAL 46 Ca 0.61 1.78 -0.17 0.00 0.00 0.00 0.00 61.98 64.20 2k6q s VAL 46 Cb -0.14 -4.20 -0.14 0.00 0.00 0.00 0.00 36.38 31.90 2k6q s VAL 46 CO 0.54 -0.21 -0.52 -0.11 0.00 0.00 0.00 175.10 174.80 2k6q n LEU 47 N 6.56 -4.93 -0.03 3.92 -0.00 -1.26 -4.85 117.00 116.41 2k6q n LEU 47 Ca 0.13 0.34 -0.13 0.00 -0.00 0.00 0.00 56.01 56.35 2k6q n LEU 47 Cb 0.46 -0.82 -0.01 0.00 -0.00 0.00 0.00 43.42 43.05 2k6q n LEU 47 CO 0.55 -5.51 0.41 0.44 -0.00 0.00 0.00 177.39 173.28 2k6q h ASP 48 N -0.71 0.80 -4.30 1.96 5.19 -1.93 -3.46 116.42 113.97 2k6q h ASP 48 Ca -0.43 -0.46 -0.42 0.00 -0.62 0.00 0.00 57.03 55.10 2k6q h ASP 48 Cb 1.34 -0.23 -0.09 0.00 0.18 0.00 0.00 39.33 40.53 2k6q h ASP 48 CO 0.30 1.22 -0.35 0.29 -3.12 0.00 0.00 179.24 177.58 2k6q n LYS 49 N -3.96 0.69 -0.04 3.56 4.01 -1.26 -5.08 118.16 116.08 2k6q n LYS 49 Ca -0.04 -2.60 -0.05 0.00 -0.51 0.00 0.00 58.31 55.11 2k6q n LYS 49 Cb 0.65 1.38 -0.05 0.00 -0.51 0.00 0.00 35.03 36.50 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 -0.70 0.50 -4.41 -0.18 -1.04 -1.26 -4.90 114.28 102.28 2k6q n THR 50 Ca -0.05 -0.26 -0.31 0.00 -2.04 0.00 0.00 64.05 61.39 2k6q n THR 50 Cb 0.46 -0.82 -0.11 0.00 -1.82 0.00 0.00 70.33 68.05 2k6q n THR 50 CO 0.00 0.00 0.00 -1.59 -0.64 0.00 0.00 175.07 172.84 2k6q s LYS 51 N -2.18 2.17 0.01 -2.82 -2.85 -1.26 0.70 119.74 113.51 2k6q s LYS 51 Ca -0.07 -0.96 -0.00 0.00 -1.00 0.00 0.00 55.97 53.94 2k6q s LYS 51 Cb 0.03 -2.29 -0.01 0.00 -2.06 0.00 0.00 37.83 33.49 2k6q s LYS 51 CO 0.26 0.54 -0.01 -0.06 0.10 0.00 0.00 175.35 176.17 2k6q s PHE 52 N -1.07 0.16 -0.49 1.78 0.40 -0.95 -4.97 117.98 112.83 2k6q s PHE 52 Ca 0.18 -0.32 -0.15 0.00 -0.60 0.00 0.00 56.93 56.04 2k6q s PHE 52 Cb -0.11 -0.12 0.10 0.00 0.51 0.00 0.00 43.02 43.40 2k6q s PHE 52 CO 0.09 -0.13 0.42 -0.51 0.70 0.00 0.00 175.22 175.80 2k6q s LEU 53 N -0.93 5.78 0.06 -0.37 1.43 -1.26 -2.81 118.68 120.58 2k6q s LEU 53 Ca -0.10 -1.53 -0.14 0.00 -1.03 0.00 0.00 54.13 51.33 2k6q s LEU 53 Cb -0.06 -2.17 -0.06 0.00 0.03 0.00 0.00 46.19 43.93 2k6q s LEU 53 CO -0.01 -0.71 0.45 0.54 0.23 0.00 0.00 176.35 176.85 2k6q s VAL 54 N 1.59 4.98 -0.08 -1.59 0.11 -1.08 -4.89 120.40 119.45 2k6q s VAL 54 Ca 0.04 0.76 -0.30 0.00 -2.93 0.00 0.00 61.98 59.55 2k6q s VAL 54 Cb -0.26 -3.72 -0.03 0.00 -1.53 0.00 0.00 36.38 30.84 2k6q s VAL 54 CO 0.05 0.42 1.24 -2.16 -3.33 0.00 0.00 175.10 171.31 2k6q s PRO 55 N -1.51 4.31 -0.95 1.54 0.04 -1.26 0.07 135.00 137.24 2k6q s PRO 55 Ca 0.30 1.70 -0.08 0.00 0.04 0.00 0.00 61.00 62.96 2k6q s PRO 55 Cb -0.16 -3.62 -0.13 0.00 0.04 0.00 0.00 34.50 30.63 2k6q s PRO 55 CO 0.16 -0.53 2.91 -0.40 0.04 0.00 0.00 177.00 179.18 2k6q n ASP 56 N 5.63 6.68 -0.99 6.66 3.85 -0.82 -3.19 116.55 134.37 2k6q n ASP 56 Ca 0.12 -2.45 -0.06 0.00 -0.71 0.00 0.00 54.79 51.68 2k6q n ASP 56 Cb 0.46 -1.37 -0.06 0.00 -1.35 0.00 0.00 41.12 38.79 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 3.34 0.00 -3.19 2.11 1.44 -1.26 -4.94 115.22 112.73 2k6q n HIS 57 Ca 0.59 -0.47 0.00 0.00 -2.01 0.00 0.00 57.72 55.82 2k6q n HIS 57 Cb 0.41 0.46 0.00 0.00 0.12 0.00 0.00 29.99 30.98 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 0.02 0.00 -4.27 0.61 0.24 -1.19 -5.13 118.33 108.60 2k6q n VAL 58 Ca -0.25 0.00 -0.27 0.00 -2.04 0.00 0.00 64.34 61.78 2k6q n VAL 58 Cb 0.71 0.00 -0.09 0.00 -1.47 0.00 0.00 33.84 32.99 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 0.19 4.39 0.60 -1.34 4.22 -1.26 -3.37 114.94 118.37 2k6q s ASN 59 Ca 0.00 -0.54 0.29 0.00 -2.14 0.00 0.00 52.86 50.47 2k6q s ASN 59 Cb 0.00 -0.80 1.50 0.00 1.28 0.00 0.00 41.25 43.23 2k6q s ASN 59 CO 0.00 0.10 1.91 0.00 -2.04 0.00 0.00 177.10 177.07 2k6q h MET 60 N 2.81 0.00 0.10 3.55 -0.00 -1.82 -0.30 114.93 119.27 2k6q h MET 60 Ca -0.47 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.24 2k6q h MET 60 Cb 1.21 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 32.80 2k6q h MET 60 CO 0.55 0.00 -0.08 1.03 -0.00 0.00 0.00 176.91 178.41 2k6q h SER 61 N 0.00 -0.22 -0.80 -0.10 0.87 -1.91 -2.90 113.55 108.49 2k6q h SER 61 Ca 0.18 0.02 0.10 0.00 -1.23 0.00 0.00 61.79 60.86 2k6q h SER 61 Cb 1.07 0.07 -0.12 0.00 -0.44 0.00 0.00 62.40 62.98 2k6q h SER 61 CO -0.00 -0.13 -0.48 -0.33 -0.53 0.00 0.00 176.83 175.35 2k6q h GLU 62 N -0.20 -0.11 -0.99 2.24 4.39 -1.45 0.58 114.58 119.03 2k6q h GLU 62 Ca -0.00 0.01 0.25 0.00 0.34 0.00 0.00 59.36 59.96 2k6q h GLU 62 Cb 0.18 0.03 -0.19 0.00 -0.10 0.00 0.00 28.75 28.67 2k6q h GLU 62 CO -0.01 -0.07 -0.06 1.25 -1.16 0.00 0.00 179.01 178.96 2k6q h LEU 63 N -0.11 -0.62 0.09 1.33 5.85 -1.60 0.47 115.31 120.73 2k6q h LEU 63 Ca 0.21 0.29 0.01 0.00 0.84 0.00 0.00 57.88 59.22 2k6q h LEU 63 Cb 0.53 0.53 -0.04 0.00 0.37 0.00 0.00 40.66 42.05 2k6q h LEU 63 CO -0.84 -0.35 -0.41 0.40 -0.34 0.00 0.00 178.44 176.91 2k6q h ILE 64 N 0.00 0.00 -0.77 4.05 1.08 0.19 1.14 117.51 123.19 2k6q h ILE 64 Ca 0.57 0.00 0.19 0.00 -0.39 0.00 0.00 64.86 65.23 2k6q h ILE 64 Cb 1.09 0.00 -0.04 0.00 -3.07 0.00 0.00 36.82 34.80 2k6q h ILE 64 CO -0.96 0.00 0.53 0.11 -0.69 0.00 0.00 178.15 177.15 2k6q h LYS 65 N -0.58 0.20 0.00 2.37 1.57 -0.00 1.25 116.57 121.38 2k6q h LYS 65 Ca -0.01 -0.01 -0.10 0.00 -1.87 0.00 0.00 60.65 58.66 2k6q h LYS 65 Cb 0.58 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.83 2k6q h LYS 65 CO -0.22 0.13 -0.48 0.82 -0.57 0.00 0.00 179.45 179.13 2k6q h ILE 66 N 0.21 1.07 0.00 1.86 2.04 0.25 -2.19 117.51 120.75 2k6q h ILE 66 Ca 0.38 -1.83 0.00 0.00 1.00 0.00 0.00 64.86 64.41 2k6q h ILE 66 Cb 1.19 2.07 0.00 0.00 -0.74 0.00 0.00 36.82 39.34 2k6q h ILE 66 CO -0.08 0.47 -0.00 0.40 0.00 0.00 0.00 178.15 178.94 2k6q h ILE 67 N 0.00 0.00 -0.82 -0.67 1.08 1.00 -3.02 117.51 115.08 2k6q h ILE 67 Ca -0.00 -0.06 0.24 0.00 -0.39 0.00 0.00 64.86 64.64 2k6q h ILE 67 Cb 1.03 0.00 -0.03 0.00 -3.07 0.00 0.00 36.82 34.75 2k6q h ILE 67 CO 0.06 0.00 0.92 0.08 -0.69 0.00 0.00 178.15 178.53 2k6q h ARG 68 N -0.06 0.00 -0.17 2.37 0.11 -0.59 1.61 114.38 117.65 2k6q h ARG 68 Ca 0.00 0.00 -0.21 0.00 0.10 0.00 0.00 59.98 59.87 2k6q h ARG 68 Cb 0.00 0.00 0.01 0.00 1.11 0.00 0.00 29.97 31.09 2k6q h ARG 68 CO 0.00 0.00 -0.71 0.00 0.10 0.00 0.00 179.97 179.36 2k6q h ARG 69 N 0.00 0.78 -0.25 0.08 2.47 -1.49 -2.30 114.38 113.68 2k6q h ARG 69 Ca 0.39 -0.61 -0.06 0.00 -1.26 0.00 0.00 59.98 58.44 2k6q h ARG 69 Cb 2.23 0.12 -0.01 0.00 -1.65 0.00 0.00 29.97 30.67 2k6q h ARG 69 CO -0.00 1.22 -0.07 0.00 0.56 0.00 0.00 179.97 181.68 2k6q h ARG 70 N 0.51 0.48 0.00 0.04 3.08 0.25 -2.07 114.38 116.67 2k6q h ARG 70 Ca -0.04 -0.19 0.00 0.00 0.07 0.00 0.00 59.98 59.82 2k6q h ARG 70 Cb 1.34 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 31.36 2k6q h ARG 70 CO 0.15 0.72 0.00 1.28 -1.07 0.00 0.00 179.97 181.04 2k6q n LEU 71 N -4.54 0.00 -4.14 3.04 4.77 -0.53 -4.86 117.00 110.73 2k6q n LEU 71 Ca -0.04 0.43 -0.39 0.00 -0.03 0.00 0.00 56.01 55.98 2k6q n LEU 71 Cb 0.31 -0.43 -0.03 0.00 -2.33 0.00 0.00 43.42 40.94 2k6q n LEU 71 CO 0.39 -0.24 -0.28 0.00 -1.33 0.00 0.00 177.39 175.93 2k6q n GLN 72 N -1.43 -0.51 -2.28 3.23 10.64 -0.78 -4.92 117.38 121.33 2k6q n GLN 72 Ca 0.04 0.05 -0.24 0.00 -1.83 0.00 0.00 57.00 55.02 2k6q n GLN 72 Cb 0.14 -2.73 0.14 0.00 -0.86 0.00 0.00 30.24 26.93 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 -4.73 0.00 0.00 2.61 4.77 -1.17 -5.08 117.00 113.41 2k6q n LEU 73 Ca -0.19 -1.84 -0.16 0.00 -0.03 0.00 0.00 56.01 53.80 2k6q n LEU 73 Cb 0.59 -0.74 -0.02 0.00 -2.33 0.00 0.00 43.42 40.91 2k6q n LEU 73 CO 0.75 -1.11 -0.08 0.59 -1.33 0.00 0.00 177.39 176.21 2k6q n ASN 74 N -3.21 2.49 0.24 -1.43 4.13 -1.26 -5.00 115.26 111.22 2k6q n ASN 74 Ca 0.16 -2.10 0.14 0.00 1.68 0.00 0.00 54.58 54.46 2k6q n ASN 74 Cb 0.57 0.12 0.40 0.00 -1.54 0.00 0.00 39.78 39.33 2k6q n ASN 74 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2k6q h ALA 75 N 1.01 1.00 0.00 5.41 0.00 -2.03 -2.54 119.26 122.11 2k6q h ALA 75 Ca -0.21 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.70 2k6q h ALA 75 Cb 0.66 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.45 2k6q h ALA 75 CO 0.34 0.00 -0.11 -2.95 0.00 0.00 0.00 179.25 176.53 2k6q h ASN 76 N 0.00 0.00 -3.76 0.00 -1.07 -2.05 -3.43 115.58 105.27 2k6q h ASN 76 Ca 0.00 -0.02 -0.66 0.00 0.07 0.00 0.00 56.30 55.69 2k6q h ASN 76 Cb 0.77 0.00 -0.17 0.00 -2.07 0.00 0.00 38.32 36.85 2k6q h ASN 76 CO 0.00 0.01 -0.42 -1.58 0.07 0.00 0.00 177.43 175.51 2k6q s GLN 77 N -3.16 3.72 -0.06 4.14 2.00 -0.96 -5.06 119.66 120.28 2k6q s GLN 77 Ca 0.08 -0.41 -0.24 0.00 -2.00 0.00 0.00 55.36 52.80 2k6q s GLN 77 Cb 0.10 -3.74 -0.04 0.00 0.80 0.00 0.00 33.01 30.13 2k6q s GLN 77 CO 0.65 -0.36 0.71 0.00 -0.50 0.00 0.00 175.29 175.79 2k6q s ALA 78 N 1.84 3.33 -0.02 1.58 0.00 -1.26 -4.58 121.76 122.65 2k6q s ALA 78 Ca 0.09 0.15 0.02 0.00 0.00 0.00 0.00 51.96 52.22 2k6q s ALA 78 Cb -0.17 -2.97 0.01 0.00 0.00 0.00 0.00 23.12 19.99 2k6q s ALA 78 CO 0.11 -0.11 -0.07 0.12 0.00 0.00 0.00 175.76 175.82 2k6q s PHE 79 N 0.80 0.73 -0.08 0.00 5.36 -1.26 -3.99 117.98 119.55 2k6q s PHE 79 Ca 0.38 -0.17 -0.03 0.00 -0.96 0.00 0.00 56.93 56.15 2k6q s PHE 79 Cb -0.18 -0.55 0.04 0.00 -0.34 0.00 0.00 43.02 42.00 2k6q s PHE 79 CO 0.19 -0.09 0.15 -0.06 -1.46 0.00 0.00 175.22 173.94 2k6q s PHE 80 N 0.29 -0.16 -0.44 10.12 0.08 -0.10 -4.98 117.98 122.78 2k6q s PHE 80 Ca -0.04 0.55 -0.22 0.00 0.12 0.00 0.00 56.93 57.34 2k6q s PHE 80 Cb -0.08 -0.20 0.02 0.00 -0.57 0.00 0.00 43.02 42.19 2k6q s PHE 80 CO 0.00 -0.23 0.72 -1.17 -0.10 0.00 0.00 175.22 174.44 2k6q s LEU 81 N 1.86 4.37 -0.40 -0.37 2.96 -1.26 -2.42 118.68 123.42 2k6q s LEU 81 Ca -0.02 -0.21 -0.26 0.00 -0.22 0.00 0.00 54.13 53.42 2k6q s LEU 81 Cb -0.12 -2.85 0.02 0.00 0.50 0.00 0.00 46.19 43.74 2k6q s LEU 81 CO -0.06 -0.85 0.95 -0.76 -1.32 0.00 0.00 176.35 174.31 2k6q s LEU 82 N 3.07 3.97 -0.47 -0.68 2.01 0.37 -4.12 118.68 122.83 2k6q s LEU 82 Ca 0.26 0.46 -0.27 0.00 0.01 0.00 0.00 54.13 54.60 2k6q s LEU 82 Cb -0.13 -3.28 0.03 0.00 0.01 0.00 0.00 46.19 42.82 2k6q s LEU 82 CO 0.21 -0.94 1.01 -0.69 1.01 0.00 0.00 176.35 176.95 2k6q s VAL 83 N 3.63 4.36 -0.81 -1.59 1.01 0.42 -0.60 120.40 126.83 2k6q s VAL 83 Ca 0.39 0.93 0.00 0.00 0.00 0.00 0.00 61.98 63.30 2k6q s VAL 83 Cb -0.11 -4.50 0.00 0.00 0.00 0.00 0.00 36.38 31.77 2k6q s VAL 83 CO 0.22 -0.91 0.00 0.59 0.00 0.00 0.00 175.10 175.00 2k6q n ASN 84 N 7.44 -4.72 0.00 3.32 3.02 -0.89 -1.09 115.26 122.34 2k6q n ASN 84 Ca 0.08 0.19 0.00 0.00 -0.03 0.00 0.00 54.58 54.82 2k6q n ASN 84 Cb 0.49 -2.89 0.00 0.00 -0.61 0.00 0.00 39.78 36.77 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 -0.98 0.85 3.02 7.41 0.00 -1.21 -5.00 105.19 109.27 2k6q n GLY 85 Ca -0.08 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.69 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 -2.04 1.58 1.23 1.61 -3.43 -0.25 -4.98 115.29 109.01 2k6q s HIS 86 Ca 0.00 -0.65 -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 30.25 2k6q s HIS 86 CO 0.00 -0.35 0.73 -1.13 -2.00 0.00 0.00 174.74 171.99 2k6q n SER 87 N 4.04 -2.47 -2.15 7.38 3.41 -1.26 0.16 113.62 122.73 2k6q n SER 87 Ca -0.21 -0.32 -0.24 0.00 -0.26 0.00 0.00 58.87 57.85 2k6q n SER 87 Cb 0.51 -1.11 0.02 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 3.49 -0.69 4.33 0.00 -1.26 -4.61 117.12 114.01 2k6q n MET 88 Ca 0.04 -4.21 0.52 0.00 0.00 0.00 0.00 57.70 54.05 2k6q n MET 88 Cb 0.56 -2.24 0.80 0.00 0.00 0.00 0.00 33.22 32.34 2k6q n MET 88 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 175.97 177.30 2k6q n VAL 89 N -0.65 -0.02 -4.03 3.17 0.24 -1.26 -3.06 118.33 112.73 2k6q n VAL 89 Ca 0.41 1.49 -0.31 0.00 -2.04 0.00 0.00 64.34 63.88 2k6q n VAL 89 Cb 0.90 -2.47 -0.15 0.00 -1.47 0.00 0.00 33.84 30.65 2k6q n VAL 89 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 2k6q s SER 90 N -3.89 4.48 -0.61 -1.34 0.15 -1.26 -5.06 113.70 106.16 2k6q s SER 90 Ca -0.05 -1.65 -0.07 0.00 0.70 0.00 0.00 55.95 54.88 2k6q s SER 90 Cb 0.27 -1.51 0.16 0.00 -1.71 0.00 0.00 66.02 63.23 2k6q s SER 90 CO 0.87 -0.27 0.48 0.54 1.20 0.00 0.00 173.24 176.06 2k6q s VAL 91 N 1.08 4.30 -0.03 4.45 0.11 -1.17 -4.78 120.40 124.36 2k6q s VAL 91 Ca -0.01 -2.43 0.04 0.00 -2.93 0.00 0.00 61.98 56.66 2k6q s VAL 91 Cb -0.19 -3.77 0.07 0.00 -1.53 0.00 0.00 36.38 30.95 2k6q s VAL 91 CO -0.07 -0.87 0.90 -0.24 -3.33 0.00 0.00 175.10 171.49 2k6q n SER 92 N 4.11 1.07 -4.18 3.54 2.88 -1.26 -4.91 113.62 114.87 2k6q n SER 92 Ca 0.04 -1.99 -0.23 0.00 -1.33 0.00 0.00 58.87 55.35 2k6q n SER 92 Cb 0.41 -0.15 -0.14 0.00 -0.75 0.00 0.00 64.21 63.58 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 -0.94 1.37 0.28 2.46 2.01 -1.26 -5.11 115.64 114.45 2k6q s THR 93 Ca 0.07 -0.96 -0.29 0.00 0.31 0.00 0.00 61.69 60.82 2k6q s THR 93 Cb 0.07 -1.18 -0.09 0.00 0.01 0.00 0.00 72.50 71.30 2k6q s THR 93 CO 0.01 0.20 1.08 -2.16 -0.69 0.00 0.00 174.62 173.05 2k6q s PRO 94 N -0.89 4.66 0.55 4.92 0.04 -1.26 -2.94 135.00 140.07 2k6q s PRO 94 Ca 0.05 1.76 0.34 0.00 0.04 0.00 0.00 61.00 63.19 2k6q s PRO 94 Cb -0.08 -3.19 1.49 0.00 0.04 0.00 0.00 34.50 32.77 2k6q s PRO 94 CO 0.01 0.24 1.81 0.97 0.04 0.00 0.00 177.00 180.07 2k6q h ILE 95 N 3.08 0.41 -0.96 0.56 2.10 -1.80 0.93 117.51 121.84 2k6q h ILE 95 Ca -0.47 0.00 0.01 0.00 1.08 0.00 0.00 64.86 65.48 2k6q h ILE 95 Cb 1.21 0.45 -0.05 0.00 -1.09 0.00 0.00 36.82 37.34 2k6q h ILE 95 CO 0.67 0.00 0.63 -1.28 -1.08 0.00 0.00 178.15 177.09 2k6q h SER 96 N 0.00 1.10 0.00 2.19 0.87 -1.89 -1.07 113.55 114.74 2k6q h SER 96 Ca 0.48 -0.03 -0.07 0.00 -1.23 0.00 0.00 61.79 60.94 2k6q h SER 96 Cb 2.01 -0.27 -0.01 0.00 -0.44 0.00 0.00 62.40 63.69 2k6q h SER 96 CO -0.01 0.79 -0.44 -0.33 -0.53 0.00 0.00 176.83 176.32 2k6q h GLU 97 N 1.29 0.00 -1.44 2.24 5.08 0.39 -2.95 114.58 119.20 2k6q h GLU 97 Ca 0.35 0.00 0.45 0.00 -1.00 0.00 0.00 59.36 59.16 2k6q h GLU 97 Cb -0.15 0.00 -0.11 0.00 0.50 0.00 0.00 28.75 29.00 2k6q h GLU 97 CO -0.08 0.69 0.97 0.28 -1.00 0.00 0.00 179.01 179.87 2k6q h VAL 98 N -1.00 0.15 0.14 3.13 2.07 -0.77 1.63 116.25 121.60 2k6q h VAL 98 Ca -0.10 -0.03 -0.28 0.00 0.82 0.00 0.00 66.70 67.11 2k6q h VAL 98 Cb 0.85 0.07 0.03 0.00 -1.52 0.00 0.00 31.29 30.71 2k6q h VAL 98 CO -0.06 0.01 -1.18 0.22 0.02 0.00 0.00 177.57 176.58 2k6q h TYR 99 N 0.07 0.91 0.00 1.57 5.03 -1.29 -2.34 116.97 120.92 2k6q h TYR 99 Ca 0.81 -0.60 0.00 0.00 2.58 0.00 0.00 58.73 61.52 2k6q h TYR 99 Cb 2.75 -0.06 0.00 0.00 1.55 0.00 0.00 36.73 40.97 2k6q h TYR 99 CO -0.00 1.45 0.00 -0.85 -1.32 0.00 0.00 178.16 177.43 2k6q n GLU 100 N -3.87 0.50 -0.05 1.82 0.28 0.47 0.96 120.64 120.76 2k6q n GLU 100 Ca -0.14 0.03 0.03 0.00 -0.16 0.00 0.00 57.16 56.91 2k6q n GLU 100 Cb 0.96 -1.50 0.05 0.00 1.43 0.00 0.00 31.44 32.38 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 -1.21 1.99 0.05 -1.84 7.64 0.35 -4.76 113.62 115.84 2k6q n SER 101 Ca 0.15 -1.64 0.00 0.00 1.01 0.00 0.00 58.87 58.39 2k6q n SER 101 Cb 0.18 -0.06 0.00 0.00 -1.01 0.00 0.00 64.21 63.32 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 0.15 0.00 -0.95 1.43 -0.58 -0.88 -5.00 120.64 114.80 2k6q n GLU 102 Ca 0.05 0.00 -0.31 0.00 -0.42 0.00 0.00 57.16 56.47 2k6q n GLU 102 Cb 0.24 -0.13 0.02 0.00 -0.57 0.00 0.00 31.44 31.00 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 -2.98 0.00 -3.14 3.49 -4.01 0.27 -4.98 116.66 105.31 2k6q n ARG 103 Ca 0.00 0.00 -0.17 0.00 -1.04 0.00 0.00 57.85 56.64 2k6q n ARG 103 Cb 0.08 -0.82 -0.02 0.00 -3.04 0.00 0.00 32.46 28.66 2k6q n ARG 103 CO 0.00 0.00 0.00 -3.47 -3.04 0.00 0.00 177.63 171.12 2k6q n ASP 104 N 2.34 2.37 -0.31 2.89 -0.08 -1.26 -4.94 116.55 117.56 2k6q n ASP 104 Ca 0.04 -2.16 -0.02 0.00 -1.51 0.00 0.00 54.79 51.14 2k6q n ASP 104 Cb 0.41 0.08 0.04 0.00 2.34 0.00 0.00 41.12 43.99 2k6q n ASP 104 CO 0.00 0.00 0.00 -0.33 0.12 0.00 0.00 177.20 176.99 2k6q h GLU 105 N 0.00 -0.06 -0.98 -0.67 5.08 -1.96 0.39 114.58 116.38 2k6q h GLU 105 Ca -0.22 0.00 0.17 0.00 -1.00 0.00 0.00 59.36 58.32 2k6q h GLU 105 Cb 0.72 0.01 -0.17 0.00 0.50 0.00 0.00 28.75 29.81 2k6q h GLU 105 CO 0.35 -0.04 -0.32 0.38 -1.00 0.00 0.00 179.01 178.39 2k6q h ASP 106 N -0.06 -1.17 0.00 1.42 3.04 -1.95 -3.45 116.42 114.25 2k6q h ASP 106 Ca 0.31 0.30 0.00 0.00 -3.24 0.00 0.00 57.03 54.41 2k6q h ASP 106 Cb 0.59 0.68 0.00 0.00 -1.04 0.00 0.00 39.33 39.56 2k6q h ASP 106 CO -0.86 -0.31 0.00 0.61 -2.04 0.00 0.00 179.24 176.64 2k6q n GLY 107 N -1.55 1.87 3.01 7.15 0.00 0.14 -4.63 105.19 111.19 2k6q n GLY 107 Ca 0.13 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.93 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 1.16 0.17 1.61 2.19 -1.26 -4.81 117.98 115.03 2k6q s PHE 108 Ca 0.00 -0.34 -0.30 0.00 0.33 0.00 0.00 56.93 56.62 2k6q s PHE 108 Cb 0.00 -0.84 -0.07 0.00 -1.31 0.00 0.00 43.02 40.80 2k6q s PHE 108 CO 0.00 -0.16 1.01 -0.51 1.83 0.00 0.00 175.22 177.39 2k6q s LEU 109 N 0.37 4.53 -0.27 6.12 2.01 -1.03 -4.27 118.68 126.14 2k6q s LEU 109 Ca -0.07 1.95 0.02 0.00 0.01 0.00 0.00 54.13 56.04 2k6q s LEU 109 Cb -0.11 -3.60 0.07 0.00 0.01 0.00 0.00 46.19 42.56 2k6q s LEU 109 CO 0.01 -0.08 -0.05 -0.31 1.01 0.00 0.00 176.35 176.94 2k6q s TYR 110 N -0.37 2.95 0.04 0.29 2.02 -1.26 0.12 117.35 121.14 2k6q s TYR 110 Ca 0.46 -2.21 0.04 0.00 -0.37 0.00 0.00 57.07 55.00 2k6q s TYR 110 Cb -0.26 -1.97 -0.02 0.00 -0.40 0.00 0.00 41.96 39.30 2k6q s TYR 110 CO 0.32 -0.85 -0.12 -1.64 -1.57 0.00 0.00 175.55 171.70 2k6q s MET 111 N 1.20 0.75 0.05 -0.62 -1.94 -1.03 -2.10 119.30 115.60 2k6q s MET 111 Ca -0.03 -0.75 0.07 0.00 -1.71 0.00 0.00 55.69 53.28 2k6q s MET 111 Cb -0.19 -0.69 -0.03 0.00 2.01 0.00 0.00 34.83 35.92 2k6q s MET 111 CO -0.07 0.16 -0.18 0.08 -0.01 0.00 0.00 175.02 175.00 2k6q s VAL 112 N -1.01 2.77 0.24 -6.03 1.01 0.23 -1.88 120.40 115.73 2k6q s VAL 112 Ca -0.02 -1.22 0.11 0.00 0.00 0.00 0.00 61.98 60.85 2k6q s VAL 112 Cb -0.08 -2.17 -0.05 0.00 0.00 0.00 0.00 36.38 34.08 2k6q s VAL 112 CO 0.01 0.32 -0.21 -0.72 0.00 0.00 0.00 175.10 174.50 2k6q s TYR 113 N -0.94 2.25 -0.05 5.22 -0.85 -1.14 0.14 117.35 121.98 2k6q s TYR 113 Ca 0.15 -0.36 -0.30 0.00 -0.52 0.00 0.00 57.07 56.04 2k6q s TYR 113 Cb -0.10 -1.03 0.10 0.00 0.38 0.00 0.00 41.96 41.31 2k6q s TYR 113 CO 0.06 0.62 1.33 0.00 -1.52 0.00 0.00 175.55 176.03 2k6q s ALA 114 N -2.24 -2.56 -0.29 9.51 0.00 -1.02 -1.59 121.76 123.58 2k6q s ALA 114 Ca 0.26 0.21 0.03 0.00 0.00 0.00 0.00 51.96 52.46 2k6q s ALA 114 Cb -0.06 0.81 0.43 0.00 0.00 0.00 0.00 23.12 24.30 2k6q s ALA 114 CO 0.13 -1.14 1.58 0.43 0.00 0.00 0.00 175.76 176.75 2k6q n SER 115 N -0.95 3.48 -3.71 0.00 7.64 -1.26 -0.92 113.62 117.91 2k6q n SER 115 Ca 0.02 -3.01 -0.11 0.00 1.01 0.00 0.00 58.87 56.78 2k6q n SER 115 Cb 0.59 -0.71 -0.12 0.00 -1.01 0.00 0.00 64.21 62.96 2k6q n SER 115 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2k6q s GLN 116 N -2.09 0.33 0.00 1.43 -2.07 -1.26 -4.81 119.66 111.20 2k6q s GLN 116 Ca 0.36 0.67 0.06 0.00 -1.82 0.00 0.00 55.36 54.63 2k6q s GLN 116 Cb 0.30 -0.03 -0.06 0.00 -1.09 0.00 0.00 33.01 32.13 2k6q s GLN 116 CO 0.07 -0.15 0.25 -1.91 -1.32 0.00 0.00 175.29 172.24 2k6q n GLU 117 N 4.10 5.00 -3.44 9.60 2.13 -1.26 -4.77 120.64 132.01 2k6q n GLU 117 Ca -0.23 -0.01 -0.26 0.00 0.66 0.00 0.00 57.16 57.32 2k6q n GLU 117 Cb 0.55 -0.78 -0.09 0.00 0.27 0.00 0.00 31.44 31.39 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 -1.12 0.93 -0.07 6.31 -2.24 -1.26 -4.71 114.28 112.11 2k6q n THR 118 Ca 0.01 -4.60 -0.08 0.00 -2.27 0.00 0.00 64.05 57.11 2k6q n THR 118 Cb 0.09 -2.02 -0.08 0.00 -2.10 0.00 0.00 70.33 66.22 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 1.44 0.00 0.00 4.78 -1.74 -1.26 -5.27 117.46 115.42 2k6q n PHE 119 Ca 0.26 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 57.15 2k6q n PHE 119 Cb 0.44 -0.60 0.00 0.00 1.52 0.00 0.00 39.48 40.84 2k6q n PHE 119 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61