#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 3.07 0.49 4.33 -1.94 -1.26 -5.05 119.30 118.95 2k6q s MET 1 Ca 0.00 0.33 -0.20 0.00 -1.71 0.00 0.00 55.69 54.11 2k6q s MET 1 Cb 0.00 -2.15 -0.08 0.00 2.01 0.00 0.00 34.83 34.61 2k6q s MET 1 CO 0.00 -0.76 1.04 -1.25 -0.01 0.00 0.00 175.02 174.04 2k6q s PRO 2 N -5.14 3.77 -1.26 2.03 0.04 -1.26 -3.75 135.00 129.43 2k6q s PRO 2 Ca 0.55 1.34 -0.02 0.00 0.04 0.00 0.00 61.00 62.92 2k6q s PRO 2 Cb -0.11 -2.09 0.01 0.00 0.04 0.00 0.00 34.50 32.35 2k6q s PRO 2 CO 0.49 -0.46 0.97 0.43 0.04 0.00 0.00 177.00 178.47 2k6q n SER 3 N -1.05 -2.64 -4.85 6.66 7.64 -1.26 -4.97 113.62 113.15 2k6q n SER 3 Ca 0.09 -0.65 -0.34 0.00 1.01 0.00 0.00 58.87 58.98 2k6q n SER 3 Cb 0.53 -4.86 -0.06 0.00 -1.01 0.00 0.00 64.21 58.81 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 -5.68 4.00 1.11 1.43 -1.05 -1.25 -5.06 118.70 112.21 2k6q s GLU 4 Ca 0.12 0.57 -0.16 0.00 -0.15 0.00 0.00 54.97 55.35 2k6q s GLU 4 Cb -0.05 -2.70 0.24 0.00 -0.44 0.00 0.00 34.13 31.18 2k6q s GLU 4 CO 0.75 0.32 0.55 1.63 0.95 0.00 0.00 175.26 179.46 2k6q n LYS 5 N 0.20 -2.45 -4.36 -4.83 4.76 -1.26 -5.02 118.16 105.20 2k6q n LYS 5 Ca -0.01 -0.93 -0.25 0.00 -2.87 0.00 0.00 58.31 54.25 2k6q n LYS 5 Cb 0.52 -1.55 -0.12 0.00 -1.84 0.00 0.00 35.03 32.04 2k6q n LYS 5 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 2k6q s THR 6 N -2.03 2.03 0.61 -0.18 -4.23 -1.26 -4.82 115.64 105.77 2k6q s THR 6 Ca 0.43 -1.81 0.25 0.00 -1.18 0.00 0.00 61.69 59.38 2k6q s THR 6 Cb -0.08 -1.88 0.34 0.00 1.34 0.00 0.00 72.50 72.23 2k6q s THR 6 CO 0.36 -0.10 1.57 0.15 -0.54 0.00 0.00 174.62 176.06 2k6q h PHE 7 N 3.60 0.00 0.14 3.99 3.04 -1.95 1.80 116.94 127.56 2k6q h PHE 7 Ca -0.46 0.00 -0.29 0.00 3.98 0.00 0.00 57.97 61.20 2k6q h PHE 7 Cb 1.19 0.00 0.03 0.00 2.56 0.00 0.00 35.95 39.73 2k6q h PHE 7 CO 0.65 0.00 -1.20 1.57 -2.02 0.00 0.00 178.31 177.31 2k6q h LYS 8 N 0.00 0.57 0.00 1.11 2.10 -1.94 -3.26 116.57 115.15 2k6q h LYS 8 Ca 0.28 -0.80 0.00 0.00 -2.00 0.00 0.00 60.65 58.13 2k6q h LYS 8 Cb 1.91 0.27 0.00 0.00 -0.90 0.00 0.00 32.23 33.51 2k6q h LYS 8 CO -0.00 1.36 -0.26 1.96 -2.00 0.00 0.00 179.45 180.51 2k6q h GLN 9 N 0.16 0.00 0.00 0.07 1.08 0.16 -3.43 115.11 113.16 2k6q h GLN 9 Ca -0.19 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.01 2k6q h GLN 9 Cb 1.89 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 29.32 2k6q h GLN 9 CO 0.23 0.00 0.00 -2.13 -0.95 0.00 0.00 178.83 175.98 2k6q n ARG 10 N -3.54 0.00 -1.62 1.46 3.00 0.49 -4.40 116.66 112.05 2k6q n ARG 10 Ca -0.04 0.49 -0.46 0.00 -0.00 0.00 0.00 57.85 57.85 2k6q n ARG 10 Cb 0.13 -0.97 -0.03 0.00 0.00 0.00 0.00 32.46 31.60 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 -1.05 1.57 -2.05 -0.14 3.00 -1.23 -4.86 116.66 111.90 2k6q n ARG 11 Ca 0.00 0.55 -0.42 0.00 -0.01 0.00 0.00 57.85 57.97 2k6q n ARG 11 Cb 0.00 -2.07 -0.03 0.00 0.00 0.00 0.00 32.46 30.37 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 -0.13 6.71 0.31 0.55 0.01 -1.26 -4.73 113.70 115.16 2k6q s SER 12 Ca 0.65 2.38 0.07 0.00 1.31 0.00 0.00 55.95 60.36 2k6q s SER 12 Cb -0.72 -2.57 0.76 0.00 0.21 0.00 0.00 66.02 63.70 2k6q s SER 12 CO 0.55 -0.79 1.78 0.15 0.41 0.00 0.00 173.24 175.35 2k6q h PHE 13 N 7.63 1.04 -0.07 2.43 3.57 -1.86 0.53 116.94 130.21 2k6q h PHE 13 Ca -0.41 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.06 2k6q h PHE 13 Cb 1.20 -0.31 -0.01 0.00 2.79 0.00 0.00 35.95 39.61 2k6q h PHE 13 CO 0.73 0.24 -0.24 0.93 -2.23 0.00 0.00 178.31 177.73 2k6q h GLU 14 N 0.74 0.12 -0.09 1.11 5.08 -1.98 -0.69 114.58 118.87 2k6q h GLU 14 Ca 0.57 -0.03 -0.05 0.00 -1.00 0.00 0.00 59.36 58.85 2k6q h GLU 14 Cb 0.92 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 30.15 2k6q h GLU 14 CO -0.36 0.36 -0.13 1.96 -1.00 0.00 0.00 179.01 179.84 2k6q h GLN 15 N 0.11 0.25 0.47 2.33 1.08 -0.36 -0.26 115.11 118.73 2k6q h GLN 15 Ca 0.02 -0.14 -0.02 0.00 -1.45 0.00 0.00 58.65 57.05 2k6q h GLN 15 Cb 0.49 0.01 0.00 0.00 -0.05 0.00 0.00 27.48 27.94 2k6q h GLN 15 CO 0.03 0.71 -0.23 0.00 -0.95 0.00 0.00 178.83 178.39 2k6q h ARG 16 N -0.19 -0.61 -0.89 1.46 2.47 -0.95 -1.61 114.38 114.06 2k6q h ARG 16 Ca 0.01 0.04 0.09 0.00 -1.26 0.00 0.00 59.98 58.86 2k6q h ARG 16 Cb 0.68 0.14 -0.06 0.00 -1.65 0.00 0.00 29.97 29.07 2k6q h ARG 16 CO 0.03 -0.37 0.58 -0.24 0.56 0.00 0.00 179.97 180.53 2k6q h VAL 17 N -0.71 1.00 0.35 2.04 3.04 -1.21 -1.93 116.25 118.83 2k6q h VAL 17 Ca -0.06 -0.32 -0.00 0.00 -1.01 0.00 0.00 66.70 65.31 2k6q h VAL 17 Cb 0.52 -0.01 -0.03 0.00 -2.01 0.00 0.00 31.29 29.77 2k6q h VAL 17 CO 0.11 0.17 -0.41 -0.08 -1.01 0.00 0.00 177.57 176.35 2k6q h GLU 18 N 0.93 -0.77 -0.31 4.17 4.81 -0.65 -2.58 114.58 120.18 2k6q h GLU 18 Ca 0.40 0.05 0.07 0.00 -0.13 0.00 0.00 59.36 59.76 2k6q h GLU 18 Cb 0.34 0.17 -0.08 0.00 0.63 0.00 0.00 28.75 29.81 2k6q h GLU 18 CO -0.17 -0.51 -0.29 0.22 -0.73 0.00 0.00 179.01 177.53 2k6q h ASP 19 N -0.80 -0.93 -1.72 1.04 3.58 -0.68 0.48 116.42 117.39 2k6q h ASP 19 Ca -0.02 0.16 0.53 0.00 0.42 0.00 0.00 57.03 58.12 2k6q h ASP 19 Cb 0.73 0.44 -0.11 0.00 1.72 0.00 0.00 39.33 42.11 2k6q h ASP 19 CO -0.10 -0.31 1.19 0.52 -2.88 0.00 0.00 179.24 177.66 2k6q n VAL 20 N -5.40 -0.11 0.12 2.25 0.31 -0.79 0.16 118.33 114.87 2k6q n VAL 20 Ca -0.00 1.62 -0.13 0.00 -0.01 0.00 0.00 64.34 65.82 2k6q n VAL 20 Cb 0.32 -2.68 -0.06 0.00 -0.91 0.00 0.00 33.84 30.51 2k6q n VAL 20 CO 0.00 0.00 0.00 -0.09 -1.32 0.00 0.00 176.83 175.42 2k6q h ARG 21 N 0.00 -0.36 -0.06 5.55 2.43 0.27 1.21 114.38 123.42 2k6q h ARG 21 Ca 0.91 0.02 0.03 0.00 -0.81 0.00 0.00 59.98 60.13 2k6q h ARG 21 Cb 3.37 0.08 -0.03 0.00 -0.42 0.00 0.00 29.97 32.97 2k6q h ARG 21 CO -0.21 -0.24 -0.09 -0.07 -1.51 0.00 0.00 179.97 177.85 2k6q h LEU 22 N -0.37 -0.27 -1.97 3.80 3.38 0.15 0.18 115.31 120.20 2k6q h LEU 22 Ca 0.01 0.05 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 2k6q h LEU 22 Cb 0.37 0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.25 2k6q h LEU 22 CO -0.07 -0.13 -0.09 -0.29 0.09 0.00 0.00 178.44 177.95 2k6q h ILE 23 N -0.13 0.84 -0.09 1.22 6.09 -1.11 1.56 117.51 125.90 2k6q h ILE 23 Ca 0.06 -0.33 -0.15 0.00 -1.37 0.00 0.00 64.86 63.07 2k6q h ILE 23 Cb 0.21 1.19 -0.01 0.00 0.47 0.00 0.00 36.82 38.67 2k6q h ILE 23 CO -0.14 0.09 -0.60 0.03 -3.07 0.00 0.00 178.15 174.45 2k6q h ARG 24 N 0.00 0.30 -0.02 2.19 2.47 0.36 0.84 114.38 120.52 2k6q h ARG 24 Ca -0.00 -0.20 0.00 0.00 -1.26 0.00 0.00 59.98 58.52 2k6q h ARG 24 Cb 0.18 0.03 0.00 0.00 -1.65 0.00 0.00 29.97 28.53 2k6q h ARG 24 CO 0.01 0.81 -0.46 -0.85 0.56 0.00 0.00 179.97 180.04 2k6q n GLU 25 N -3.89 1.28 -0.05 0.04 0.28 0.43 -4.11 120.64 114.63 2k6q n GLU 25 Ca -0.03 -1.00 -0.07 0.00 -0.16 0.00 0.00 57.16 55.91 2k6q n GLU 25 Cb 0.62 -1.46 -0.02 0.00 1.43 0.00 0.00 31.44 32.01 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 -0.01 0.36 -3.82 3.44 6.02 0.52 -4.85 117.38 119.04 2k6q n GLN 26 Ca 0.09 0.14 -0.31 0.00 -0.01 0.00 0.00 57.00 56.92 2k6q n GLN 26 Cb 0.46 -1.12 -0.10 0.00 1.02 0.00 0.00 30.24 30.49 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 -2.60 3.66 0.18 1.08 3.76 0.29 -4.88 115.29 116.79 2k6q s HIS 27 Ca -0.20 -3.24 0.03 0.00 -0.15 0.00 0.00 55.06 51.51 2k6q s HIS 27 Cb 0.03 -2.89 0.06 0.00 1.11 0.00 0.00 32.58 30.89 2k6q s HIS 27 CO 0.29 -0.61 1.42 -1.00 -0.85 0.00 0.00 174.74 173.99 2k6q h PRO 28 N 5.64 0.21 -1.04 8.40 0.13 -1.70 -3.09 132.00 140.55 2k6q h PRO 28 Ca 0.14 -0.20 -0.26 0.00 -0.87 0.00 0.00 66.00 64.81 2k6q h PRO 28 Cb 0.78 0.05 -0.15 0.00 0.13 0.00 0.00 31.00 31.81 2k6q h PRO 28 CO 0.76 0.90 0.33 0.25 -0.23 0.00 0.00 178.00 180.01 2k6q n THR 29 N -3.71 2.12 -4.01 1.56 -2.24 -1.26 -4.82 114.28 101.91 2k6q n THR 29 Ca -0.03 -0.98 -0.12 0.00 -2.27 0.00 0.00 64.05 60.64 2k6q n THR 29 Cb 0.76 -0.79 -0.13 0.00 -2.10 0.00 0.00 70.33 68.07 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 -1.61 0.30 -0.35 -0.78 -0.14 -1.17 -3.50 119.74 112.49 2k6q s LYS 30 Ca 0.28 -0.38 -0.16 0.00 -1.36 0.00 0.00 55.97 54.35 2k6q s LYS 30 Cb 0.23 -0.14 -0.01 0.00 -1.68 0.00 0.00 37.83 36.24 2k6q s LYS 30 CO 0.05 0.03 0.39 0.42 -0.76 0.00 0.00 175.35 175.48 2k6q s ILE 31 N -0.73 5.14 0.10 2.17 -1.09 0.90 -4.89 121.20 122.79 2k6q s ILE 31 Ca -0.06 0.03 -0.30 0.00 -2.23 0.00 0.00 60.65 58.09 2k6q s ILE 31 Cb -0.05 -3.87 -0.06 0.00 -1.58 0.00 0.00 42.46 36.89 2k6q s ILE 31 CO -0.00 -0.15 1.15 -2.16 -1.23 0.00 0.00 174.94 172.55 2k6q s PRO 32 N 2.08 4.49 0.09 2.79 0.04 -1.26 -1.98 135.00 141.25 2k6q s PRO 32 Ca 0.13 1.73 0.00 0.00 0.04 0.00 0.00 61.00 62.91 2k6q s PRO 32 Cb -0.16 -3.33 -0.04 0.00 0.04 0.00 0.00 34.50 31.01 2k6q s PRO 32 CO 0.12 -0.14 -0.04 0.14 0.04 0.00 0.00 177.00 177.13 2k6q s VAL 33 N 0.61 0.47 -0.34 -0.36 -7.23 -1.17 -3.10 120.40 109.28 2k6q s VAL 33 Ca 0.55 -1.89 -0.01 0.00 -1.81 0.00 0.00 61.98 58.83 2k6q s VAL 33 Cb -0.29 -1.68 0.12 0.00 0.56 0.00 0.00 36.38 35.09 2k6q s VAL 33 CO 0.31 -0.86 0.16 -0.63 -0.31 0.00 0.00 175.10 173.76 2k6q s ILE 34 N -3.77 0.62 -0.17 -0.62 -1.09 0.44 -3.28 121.20 113.33 2k6q s ILE 34 Ca 0.12 -1.56 -0.14 0.00 -2.23 0.00 0.00 60.65 56.84 2k6q s ILE 34 Cb 0.07 -1.47 -0.05 0.00 -1.58 0.00 0.00 42.46 39.43 2k6q s ILE 34 CO -0.06 -0.80 0.31 -0.63 -1.23 0.00 0.00 174.94 172.54 2k6q s ILE 35 N 1.36 5.29 0.22 2.92 1.01 -1.13 -2.34 121.20 128.53 2k6q s ILE 35 Ca 0.13 0.57 0.03 0.00 0.00 0.00 0.00 60.65 61.38 2k6q s ILE 35 Cb -0.20 -3.65 -0.05 0.00 0.01 0.00 0.00 42.46 38.57 2k6q s ILE 35 CO -0.17 0.36 0.00 -1.61 0.00 0.00 0.00 174.94 173.53 2k6q s GLU 36 N 0.62 1.31 0.20 2.79 0.41 -0.89 -4.61 118.70 118.53 2k6q s GLU 36 Ca 0.17 -1.66 -0.30 0.00 -0.41 0.00 0.00 54.97 52.77 2k6q s GLU 36 Cb -0.13 -0.55 -0.08 0.00 -1.78 0.00 0.00 34.13 31.59 2k6q s GLU 36 CO 0.05 -0.11 1.16 -0.98 -0.49 0.00 0.00 175.26 174.88 2k6q s ARG 37 N -3.88 4.54 0.36 1.61 1.70 -1.26 -2.89 118.95 119.13 2k6q s ARG 37 Ca 0.28 1.83 -0.28 0.00 -0.47 0.00 0.00 55.73 57.09 2k6q s ARG 37 Cb 0.06 -3.24 -0.12 0.00 -0.57 0.00 0.00 34.95 31.08 2k6q s ARG 37 CO 0.08 -0.00 1.38 0.98 -1.08 0.00 0.00 175.30 176.66 2k6q n TYR 38 N 2.24 2.60 -1.55 5.89 4.19 -1.16 -4.79 117.16 124.59 2k6q n TYR 38 Ca 0.03 0.50 -0.33 0.00 3.31 0.00 0.00 57.90 61.42 2k6q n TYR 38 Cb 0.45 -2.47 -0.04 0.00 0.49 0.00 0.00 39.34 37.77 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 0.52 0.94 0.00 2.98 2.85 -1.26 0.35 118.16 124.53 2k6q n LYS 39 Ca 0.03 -0.14 0.00 0.00 -1.05 0.00 0.00 58.31 57.15 2k6q n LYS 39 Cb 0.37 -3.44 0.00 0.00 -0.65 0.00 0.00 35.03 31.31 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 6.14 1.34 3.19 2.58 0.00 -1.26 -5.08 105.19 112.11 2k6q n GLY 40 Ca 0.39 0.00 -0.38 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 -0.02 2.35 -0.03 1.61 -6.30 0.15 -4.86 118.70 111.61 2k6q s GLU 41 Ca 0.00 -1.57 0.09 0.00 -2.50 0.00 0.00 54.97 51.00 2k6q s GLU 41 Cb 0.00 -3.60 -0.14 0.00 0.00 0.00 0.00 34.13 30.38 2k6q s GLU 41 CO 0.00 -0.94 0.17 0.36 0.02 0.00 0.00 175.26 174.87 2k6q n LYS 42 N 4.74 0.83 0.00 4.30 -0.00 -1.26 -4.64 118.16 122.13 2k6q n LYS 42 Ca -0.08 -0.07 0.00 0.00 -0.00 0.00 0.00 58.31 58.16 2k6q n LYS 42 Cb 0.42 -1.23 0.00 0.00 -0.00 0.00 0.00 35.03 34.22 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 -1.96 0.00 -1.23 -1.58 1.13 -1.26 -4.57 117.38 107.91 2k6q n GLN 43 Ca -0.05 0.29 -0.34 0.00 -1.94 0.00 0.00 57.00 54.95 2k6q n GLN 43 Cb 0.39 -0.86 0.11 0.00 0.11 0.00 0.00 30.24 29.99 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 -0.65 4.32 -4.80 1.08 4.32 -1.26 -4.98 117.00 115.03 2k6q n LEU 44 Ca 0.00 0.63 -0.30 0.00 -0.02 0.00 0.00 56.01 56.32 2k6q n LEU 44 Cb 0.00 -1.49 0.10 0.00 -1.62 0.00 0.00 43.42 40.41 2k6q n LEU 44 CO 0.00 -1.73 0.71 -2.16 -1.22 0.00 0.00 177.39 173.00 2k6q s PRO 45 N -3.84 1.88 -0.18 3.23 0.04 -1.26 -5.00 135.00 129.87 2k6q s PRO 45 Ca 0.74 0.56 -0.26 0.00 0.04 0.00 0.00 61.00 62.08 2k6q s PRO 45 Cb -0.31 -1.90 -0.01 0.00 0.04 0.00 0.00 34.50 32.32 2k6q s PRO 45 CO 0.50 -1.74 0.88 0.08 0.04 0.00 0.00 177.00 176.76 2k6q s VAL 46 N -3.18 4.83 0.41 -0.36 1.01 -1.26 -4.98 120.40 116.86 2k6q s VAL 46 Ca 0.61 1.73 -0.21 0.00 0.00 0.00 0.00 61.98 64.11 2k6q s VAL 46 Cb -0.14 -4.18 -0.15 0.00 0.00 0.00 0.00 36.38 31.90 2k6q s VAL 46 CO 0.54 -0.02 0.16 -0.11 0.00 0.00 0.00 175.10 175.66 2k6q n LEU 47 N 5.48 -2.43 -0.28 3.92 -0.00 -1.26 -4.76 117.00 117.67 2k6q n LEU 47 Ca 0.06 0.82 0.09 0.00 -0.00 0.00 0.00 56.01 56.99 2k6q n LEU 47 Cb 0.48 -0.92 0.24 0.00 -0.00 0.00 0.00 43.42 43.22 2k6q n LEU 47 CO 0.49 -4.01 0.96 0.44 -0.00 0.00 0.00 177.39 175.27 2k6q h ASP 48 N 0.38 0.06 -2.63 1.96 5.19 -1.94 -3.43 116.42 116.01 2k6q h ASP 48 Ca -0.37 0.17 -0.11 0.00 -0.62 0.00 0.00 57.03 56.10 2k6q h ASP 48 Cb 1.44 0.21 -0.03 0.00 0.18 0.00 0.00 39.33 41.13 2k6q h ASP 48 CO 0.47 -0.07 -0.10 0.29 -3.12 0.00 0.00 179.24 176.71 2k6q n LYS 49 N -5.16 0.09 -0.03 3.56 4.01 -1.26 -5.08 118.16 114.30 2k6q n LYS 49 Ca 0.18 -0.74 -0.02 0.00 -0.51 0.00 0.00 58.31 57.22 2k6q n LYS 49 Cb 0.57 0.60 -0.05 0.00 -0.51 0.00 0.00 35.03 35.65 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 -0.14 0.38 -3.40 -0.18 -1.04 -1.26 -4.92 114.28 103.71 2k6q n THR 50 Ca 0.02 -0.25 -0.38 0.00 -2.04 0.00 0.00 64.05 61.40 2k6q n THR 50 Cb 0.13 -0.71 -0.07 0.00 -1.82 0.00 0.00 70.33 67.85 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 -2.18 4.19 -0.05 -2.82 1.02 -1.26 -2.84 119.74 115.80 2k6q s LYS 51 Ca -0.03 0.20 0.00 0.00 0.02 0.00 0.00 55.97 56.16 2k6q s LYS 51 Cb 0.02 -3.52 0.03 0.00 -0.52 0.00 0.00 37.83 33.84 2k6q s LYS 51 CO 0.25 0.00 -0.02 -0.06 -0.92 0.00 0.00 175.35 174.61 2k6q s PHE 52 N 1.17 0.57 -0.54 3.18 0.40 -1.20 -5.05 117.98 116.51 2k6q s PHE 52 Ca 0.19 -0.12 -0.20 0.00 -0.60 0.00 0.00 56.93 56.20 2k6q s PHE 52 Cb -0.15 -0.61 0.07 0.00 0.51 0.00 0.00 43.02 42.84 2k6q s PHE 52 CO 0.08 -0.21 0.71 -0.51 0.70 0.00 0.00 175.22 175.99 2k6q s LEU 53 N 1.25 4.90 0.15 -0.37 1.43 -1.26 -3.06 118.68 121.72 2k6q s LEU 53 Ca -0.06 -0.96 -0.21 0.00 -1.03 0.00 0.00 54.13 51.86 2k6q s LEU 53 Cb -0.13 -2.46 -0.08 0.00 0.03 0.00 0.00 46.19 43.55 2k6q s LEU 53 CO -0.02 -1.03 0.68 -0.69 0.23 0.00 0.00 176.35 175.52 2k6q s VAL 54 N 2.94 4.57 0.15 -1.59 1.01 -0.84 -4.87 120.40 121.77 2k6q s VAL 54 Ca 0.17 1.37 -0.30 0.00 0.00 0.00 0.00 61.98 63.22 2k6q s VAL 54 Cb -0.19 -3.96 -0.07 0.00 0.00 0.00 0.00 36.38 32.16 2k6q s VAL 54 CO 0.11 0.43 1.13 -2.16 0.00 0.00 0.00 175.10 174.61 2k6q s PRO 55 N -1.42 4.54 -0.27 2.72 0.04 -1.26 -0.07 135.00 139.28 2k6q s PRO 55 Ca 0.36 1.74 -0.03 0.00 0.04 0.00 0.00 61.00 63.11 2k6q s PRO 55 Cb -0.20 -3.29 0.03 0.00 0.04 0.00 0.00 34.50 31.08 2k6q s PRO 55 CO 0.22 -0.02 2.66 -0.40 0.04 0.00 0.00 177.00 179.50 2k6q n ASP 56 N 2.78 6.08 -0.30 6.66 3.85 -1.23 -3.35 116.55 131.04 2k6q n ASP 56 Ca 0.04 -2.92 0.00 0.00 -0.71 0.00 0.00 54.79 51.20 2k6q n ASP 56 Cb 0.46 -1.21 0.00 0.00 -1.35 0.00 0.00 41.12 39.02 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 1.15 0.00 -3.25 2.11 1.44 -1.26 -4.95 115.22 110.45 2k6q n HIS 57 Ca 0.37 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 56.08 2k6q n HIS 57 Cb 0.63 0.02 0.00 0.00 0.12 0.00 0.00 29.99 30.76 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 -4.18 0.61 0.24 -1.21 -5.14 118.33 108.64 2k6q n VAL 58 Ca 0.00 0.00 -0.27 0.00 -2.04 0.00 0.00 64.34 62.03 2k6q n VAL 58 Cb 0.60 0.00 -0.05 0.00 -1.47 0.00 0.00 33.84 32.92 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 0.49 4.43 0.44 -1.34 0.01 -1.26 -3.64 114.94 114.07 2k6q s ASN 59 Ca 0.00 -1.26 0.22 0.00 -0.71 0.00 0.00 52.86 51.11 2k6q s ASN 59 Cb 0.00 0.03 1.00 0.00 0.41 0.00 0.00 41.25 42.70 2k6q s ASN 59 CO 0.00 -0.80 1.88 0.00 -1.51 0.00 0.00 177.10 176.67 2k6q h MET 60 N 1.18 0.00 -0.41 -0.60 -0.00 -1.82 -2.86 114.93 110.43 2k6q h MET 60 Ca -0.41 0.00 -0.09 0.00 -0.00 0.00 0.00 59.70 59.20 2k6q h MET 60 Cb 1.28 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 32.87 2k6q h MET 60 CO 0.67 0.25 -0.10 1.03 -0.00 0.00 0.00 176.91 178.75 2k6q h SER 61 N 0.00 0.79 -0.62 -0.10 0.87 -1.93 -2.59 113.55 109.97 2k6q h SER 61 Ca -0.00 -0.36 0.17 0.00 -1.23 0.00 0.00 61.79 60.36 2k6q h SER 61 Cb 0.64 -0.22 -0.03 0.00 -0.44 0.00 0.00 62.40 62.36 2k6q h SER 61 CO 0.03 0.97 0.44 -0.33 -0.53 0.00 0.00 176.83 177.42 2k6q h GLU 62 N 0.60 0.05 0.00 2.24 4.39 -1.91 0.72 114.58 120.68 2k6q h GLU 62 Ca 0.10 -0.00 -0.06 0.00 0.34 0.00 0.00 59.36 59.74 2k6q h GLU 62 Cb 0.63 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.26 2k6q h GLU 62 CO 0.04 0.03 -0.29 1.25 -1.16 0.00 0.00 179.01 178.89 2k6q h LEU 63 N 0.05 0.00 -0.00 1.33 7.12 -1.51 -1.75 115.31 120.55 2k6q h LEU 63 Ca 0.30 0.00 -0.22 0.00 0.13 0.00 0.00 57.88 58.09 2k6q h LEU 63 Cb 1.11 0.00 0.02 0.00 -0.53 0.00 0.00 40.66 41.25 2k6q h LEU 63 CO -0.02 0.29 -0.84 0.40 -0.13 0.00 0.00 178.44 178.14 2k6q h ILE 64 N 0.00 1.34 0.00 4.05 2.04 0.40 0.21 117.51 125.56 2k6q h ILE 64 Ca -0.00 -2.16 -0.01 0.00 1.00 0.00 0.00 64.86 63.69 2k6q h ILE 64 Cb 0.52 2.47 -0.00 0.00 -0.74 0.00 0.00 36.82 39.06 2k6q h ILE 64 CO 0.04 0.65 -0.04 0.11 0.00 0.00 0.00 178.15 178.91 2k6q h LYS 65 N 0.18 0.00 0.00 2.37 1.79 -0.91 -0.75 116.57 119.25 2k6q h LYS 65 Ca -0.10 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.37 2k6q h LYS 65 Cb 1.52 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 32.17 2k6q h LYS 65 CO 0.17 0.04 -0.37 0.82 -1.08 0.00 0.00 179.45 179.02 2k6q h ILE 66 N 0.00 0.00 -0.99 1.86 2.04 -1.20 -3.13 117.51 116.09 2k6q h ILE 66 Ca -0.00 -0.80 0.22 0.00 1.00 0.00 0.00 64.86 65.28 2k6q h ILE 66 Cb 0.13 0.00 -0.19 0.00 -0.74 0.00 0.00 36.82 36.02 2k6q h ILE 66 CO 0.00 0.00 -0.16 -0.38 0.00 0.00 0.00 178.15 177.61 2k6q n ILE 67 N -4.14 -0.42 -0.19 -0.67 2.08 0.73 0.19 119.36 116.94 2k6q n ILE 67 Ca -0.05 2.24 -0.07 0.00 0.56 0.00 0.00 62.75 65.42 2k6q n ILE 67 Cb 0.19 -3.15 0.02 0.00 -0.75 0.00 0.00 39.64 35.96 2k6q n ILE 67 CO 0.00 0.00 0.00 0.08 0.56 0.00 0.00 176.55 177.19 2k6q h ARG 68 N 0.00 0.75 -0.29 0.38 0.11 -1.32 -1.38 114.38 112.62 2k6q h ARG 68 Ca 0.51 -0.08 0.06 0.00 0.10 0.00 0.00 59.98 60.58 2k6q h ARG 68 Cb 0.89 -0.15 -0.01 0.00 1.11 0.00 0.00 29.97 31.80 2k6q h ARG 68 CO -0.99 0.56 0.20 0.00 0.10 0.00 0.00 179.97 179.84 2k6q h ARG 69 N 0.73 0.12 -0.15 0.08 2.47 0.22 -0.64 114.38 117.21 2k6q h ARG 69 Ca 0.19 -0.01 -0.22 0.00 -1.26 0.00 0.00 59.98 58.69 2k6q h ARG 69 Cb 0.02 -0.03 0.01 0.00 -1.65 0.00 0.00 29.97 28.32 2k6q h ARG 69 CO -0.03 0.08 -0.75 0.00 0.56 0.00 0.00 179.97 179.83 2k6q h ARG 70 N 0.12 0.77 0.00 0.04 -0.00 0.31 -2.72 114.38 112.91 2k6q h ARG 70 Ca 0.13 -0.63 0.00 0.00 -0.50 0.00 0.00 59.98 58.98 2k6q h ARG 70 Cb 0.37 0.13 0.00 0.00 0.00 0.00 0.00 29.97 30.47 2k6q h ARG 70 CO -0.02 1.24 0.00 1.28 0.00 0.00 0.00 179.97 182.47 2k6q n LEU 71 N -3.97 0.00 -4.21 3.04 4.77 -0.33 -4.79 117.00 111.51 2k6q n LEU 71 Ca -0.08 0.43 -0.36 0.00 -0.03 0.00 0.00 56.01 55.97 2k6q n LEU 71 Cb 0.73 -0.43 -0.03 0.00 -2.33 0.00 0.00 43.42 41.36 2k6q n LEU 71 CO 0.52 -0.23 -0.04 0.00 -1.33 0.00 0.00 177.39 176.31 2k6q n GLN 72 N -1.43 -2.83 -1.29 3.23 10.64 -0.67 -4.90 117.38 120.12 2k6q n GLN 72 Ca 0.04 0.34 -0.29 0.00 -1.83 0.00 0.00 57.00 55.26 2k6q n GLN 72 Cb 0.14 -5.05 0.19 0.00 -0.86 0.00 0.00 30.24 24.66 2k6q n GLN 72 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 2k6q s LEU 73 N -7.20 1.49 0.38 2.61 1.43 -1.23 -5.07 118.68 111.09 2k6q s LEU 73 Ca 0.74 0.88 0.08 0.00 -1.03 0.00 0.00 54.13 54.80 2k6q s LEU 73 Cb -0.41 -2.95 -0.03 0.00 0.03 0.00 0.00 46.19 42.84 2k6q s LEU 73 CO 0.91 -3.28 0.28 0.21 0.23 0.00 0.00 176.35 174.70 2k6q s ASN 74 N -3.84 4.97 0.35 2.29 3.84 -1.26 -4.97 114.94 116.32 2k6q s ASN 74 Ca 0.67 -0.72 0.26 0.00 0.21 0.00 0.00 52.86 53.28 2k6q s ASN 74 Cb -0.14 -0.70 1.25 0.00 -0.55 0.00 0.00 41.25 41.11 2k6q s ASN 74 CO 0.56 -0.49 1.78 0.00 -2.79 0.00 0.00 177.10 176.16 2k6q h ALA 75 N 1.24 1.00 0.00 1.71 0.00 -2.04 0.13 119.26 121.29 2k6q h ALA 75 Ca -0.43 0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.39 2k6q h ALA 75 Cb 1.26 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.03 2k6q h ALA 75 CO 0.60 0.00 -0.90 -0.97 0.00 0.00 0.00 179.25 177.98 2k6q h ASN 76 N 0.00 0.00 -3.55 0.00 -0.00 -2.04 -3.45 115.58 106.54 2k6q h ASN 76 Ca 0.00 0.00 -0.52 0.00 -0.00 0.00 0.00 56.30 55.78 2k6q h ASN 76 Cb 0.17 0.00 -0.03 0.00 -0.00 0.00 0.00 38.32 38.46 2k6q h ASN 76 CO 0.00 0.35 0.21 -1.58 -0.00 0.00 0.00 177.43 176.41 2k6q s GLN 77 N -3.07 4.61 -0.08 6.67 2.00 0.44 -5.06 119.66 125.17 2k6q s GLN 77 Ca 0.01 1.21 0.00 0.00 -2.00 0.00 0.00 55.36 54.58 2k6q s GLN 77 Cb 0.08 -3.28 -0.03 0.00 0.80 0.00 0.00 33.01 30.59 2k6q s GLN 77 CO 0.77 0.53 -0.06 0.00 -0.50 0.00 0.00 175.29 176.03 2k6q s ALA 78 N -1.03 2.99 -0.00 1.58 0.00 -1.26 -4.70 121.76 119.33 2k6q s ALA 78 Ca 0.37 -0.88 -0.05 0.00 0.00 0.00 0.00 51.96 51.41 2k6q s ALA 78 Cb -0.23 -1.28 -0.00 0.00 0.00 0.00 0.00 23.12 21.60 2k6q s ALA 78 CO 0.27 0.52 0.09 0.12 0.00 0.00 0.00 175.76 176.76 2k6q s PHE 79 N -0.63 0.06 -0.09 0.00 2.19 -1.26 -3.98 117.98 114.28 2k6q s PHE 79 Ca 0.09 -0.13 -0.03 0.00 0.33 0.00 0.00 56.93 57.19 2k6q s PHE 79 Cb -0.12 -0.06 0.05 0.00 -1.31 0.00 0.00 43.02 41.58 2k6q s PHE 79 CO 0.02 -0.21 0.16 -0.06 1.83 0.00 0.00 175.22 176.96 2k6q s PHE 80 N -1.08 -0.18 -0.46 10.12 0.08 0.29 -4.92 117.98 121.81 2k6q s PHE 80 Ca -0.12 0.62 -0.24 0.00 0.12 0.00 0.00 56.93 57.31 2k6q s PHE 80 Cb -0.07 -0.26 0.03 0.00 -0.57 0.00 0.00 43.02 42.15 2k6q s PHE 80 CO 0.01 -0.27 0.86 -1.17 -0.10 0.00 0.00 175.22 174.54 2k6q s LEU 81 N 2.30 4.13 -0.33 -0.37 2.96 -1.26 -2.02 118.68 124.09 2k6q s LEU 81 Ca 0.03 -0.03 -0.19 0.00 -0.22 0.00 0.00 54.13 53.72 2k6q s LEU 81 Cb -0.12 -3.06 -0.01 0.00 0.50 0.00 0.00 46.19 43.50 2k6q s LEU 81 CO -0.06 -1.00 0.57 -0.76 -1.32 0.00 0.00 176.35 173.78 2k6q s LEU 82 N 3.56 4.24 -0.45 -0.68 2.01 0.17 -4.19 118.68 123.34 2k6q s LEU 82 Ca 0.33 0.18 -0.25 0.00 0.01 0.00 0.00 54.13 54.41 2k6q s LEU 82 Cb -0.11 -2.69 0.02 0.00 0.01 0.00 0.00 46.19 43.42 2k6q s LEU 82 CO 0.24 -0.48 0.89 -0.69 1.01 0.00 0.00 176.35 177.32 2k6q s VAL 83 N 2.51 4.53 0.00 -1.59 1.01 0.44 -0.21 120.40 127.09 2k6q s VAL 83 Ca 0.22 0.73 0.00 0.00 0.00 0.00 0.00 61.98 62.93 2k6q s VAL 83 Cb -0.15 -4.39 0.00 0.00 0.00 0.00 0.00 36.38 31.84 2k6q s VAL 83 CO 0.13 -0.76 0.00 0.59 0.00 0.00 0.00 175.10 175.05 2k6q n ASN 84 N 7.00 -3.03 0.00 3.32 3.02 -0.35 -1.59 115.26 123.63 2k6q n ASN 84 Ca 0.05 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.60 2k6q n ASN 84 Cb 0.48 -1.53 0.00 0.00 -0.61 0.00 0.00 39.78 38.13 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 -1.55 0.97 3.12 7.41 0.00 -1.22 -5.00 105.19 108.92 2k6q n GLY 85 Ca 0.00 0.00 -0.23 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 1.37 1.21 1.61 -3.43 -0.62 -4.97 115.29 108.46 2k6q s HIS 86 Ca 0.00 -0.28 -0.16 0.00 -0.80 0.00 0.00 55.06 53.82 2k6q s HIS 86 Cb 0.00 -0.89 0.26 0.00 -1.43 0.00 0.00 32.58 30.52 2k6q s HIS 86 CO 0.00 -0.04 0.71 -1.13 -2.00 0.00 0.00 174.74 172.28 2k6q n SER 87 N 2.79 -2.33 -0.53 7.38 3.41 -1.26 0.17 113.62 123.25 2k6q n SER 87 Ca -0.15 -0.28 0.06 0.00 -0.26 0.00 0.00 58.87 58.25 2k6q n SER 87 Cb 0.55 -1.13 0.16 0.00 -0.26 0.00 0.00 64.21 63.53 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 -4.29 2.65 -1.59 4.33 0.00 -1.26 -4.58 117.12 112.38 2k6q n MET 88 Ca 0.03 -2.33 -0.62 0.00 0.00 0.00 0.00 57.70 54.78 2k6q n MET 88 Cb 0.56 -1.47 -0.09 0.00 0.00 0.00 0.00 33.22 32.23 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 -0.34 0.00 -0.60 3.17 0.24 -1.26 -0.06 118.33 119.48 2k6q n VAL 89 Ca 0.14 -0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.44 2k6q n VAL 89 Cb 0.60 -0.20 0.00 0.00 -1.47 0.00 0.00 33.84 32.76 2k6q n VAL 89 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 2k6q n SER 90 N 2.43 -1.52 -4.15 -1.34 3.41 -1.26 -4.93 113.62 106.27 2k6q n SER 90 Ca 0.24 0.00 -0.53 0.00 -0.26 0.00 0.00 58.87 58.32 2k6q n SER 90 Cb 0.03 -0.27 -0.12 0.00 -0.26 0.00 0.00 64.21 63.59 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 -2.55 0.00 -1.08 -3.33 3.14 0.92 -4.67 118.33 110.76 2k6q n VAL 91 Ca 0.00 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.38 2k6q n VAL 91 Cb 0.03 -0.48 0.01 0.00 -1.06 0.00 0.00 33.84 32.33 2k6q n VAL 91 CO 0.00 0.00 0.00 -1.54 -6.46 0.00 0.00 176.83 168.83 2k6q n SER 92 N 8.01 0.34 -4.25 6.55 3.41 -1.26 -4.97 113.62 121.44 2k6q n SER 92 Ca 0.56 -1.40 -0.26 0.00 -0.26 0.00 0.00 58.87 57.50 2k6q n SER 92 Cb -0.02 -0.06 -0.15 0.00 -0.26 0.00 0.00 64.21 63.73 2k6q n SER 92 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2k6q s THR 93 N -0.23 1.68 0.36 6.66 2.01 -1.26 -5.11 115.64 119.74 2k6q s THR 93 Ca 0.01 -1.10 -0.26 0.00 0.31 0.00 0.00 61.69 60.65 2k6q s THR 93 Cb 0.01 -1.44 -0.09 0.00 0.01 0.00 0.00 72.50 70.99 2k6q s THR 93 CO 0.00 0.30 1.06 -2.16 -0.69 0.00 0.00 174.62 173.13 2k6q s PRO 94 N -0.95 4.33 0.66 4.92 0.04 -1.26 -3.01 135.00 139.74 2k6q s PRO 94 Ca 0.08 1.61 0.33 0.00 0.04 0.00 0.00 61.00 63.05 2k6q s PRO 94 Cb -0.09 -2.77 1.79 0.00 0.04 0.00 0.00 34.50 33.47 2k6q s PRO 94 CO 0.01 -0.01 2.01 0.97 0.04 0.00 0.00 177.00 180.02 2k6q h ILE 95 N 2.51 0.02 -0.30 0.56 2.10 -1.76 0.61 117.51 121.25 2k6q h ILE 95 Ca -0.48 0.00 -0.13 0.00 1.08 0.00 0.00 64.86 65.34 2k6q h ILE 95 Cb 1.21 0.73 -0.01 0.00 -1.09 0.00 0.00 36.82 37.66 2k6q h ILE 95 CO 0.64 0.00 -0.33 0.77 -1.08 0.00 0.00 178.15 178.15 2k6q h SER 96 N 0.00 0.68 0.00 2.19 4.64 -1.88 -2.63 113.55 116.55 2k6q h SER 96 Ca 0.01 -0.28 -0.27 0.00 -0.47 0.00 0.00 61.79 60.78 2k6q h SER 96 Cb 0.55 -0.19 -0.04 0.00 -0.31 0.00 0.00 62.40 62.41 2k6q h SER 96 CO -0.00 0.96 -1.49 -0.62 -0.87 0.00 0.00 176.83 174.81 2k6q n GLU 97 N -4.07 0.57 -0.37 4.77 -0.58 0.17 -3.22 120.64 117.92 2k6q n GLU 97 Ca -0.01 0.52 0.30 0.00 -0.42 0.00 0.00 57.16 57.55 2k6q n GLU 97 Cb 0.48 -1.70 0.56 0.00 -0.57 0.00 0.00 31.44 30.21 2k6q n GLU 97 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 2k6q h VAL 98 N -1.00 0.19 0.06 2.62 2.07 -0.58 1.86 116.25 121.47 2k6q h VAL 98 Ca -0.41 -0.06 -0.25 0.00 0.82 0.00 0.00 66.70 66.80 2k6q h VAL 98 Cb 1.36 -0.01 0.01 0.00 -1.52 0.00 0.00 31.29 31.13 2k6q h VAL 98 CO -0.25 0.03 -1.08 0.22 0.02 0.00 0.00 177.57 176.52 2k6q h TYR 99 N 0.18 0.63 -0.00 1.57 5.03 -1.63 -2.02 116.97 120.72 2k6q h TYR 99 Ca 0.78 -0.38 0.00 0.00 2.58 0.00 0.00 58.73 61.71 2k6q h TYR 99 Cb 2.09 -0.05 0.00 0.00 1.55 0.00 0.00 36.73 40.32 2k6q h TYR 99 CO -0.01 1.23 -0.03 -0.85 -1.32 0.00 0.00 178.16 177.18 2k6q n GLU 100 N -3.69 0.64 -0.03 1.82 -0.00 0.50 0.51 120.64 120.39 2k6q n GLU 100 Ca -0.08 -0.08 0.02 0.00 -0.00 0.00 0.00 57.16 57.01 2k6q n GLU 100 Cb 0.91 -1.50 0.04 0.00 -0.00 0.00 0.00 31.44 30.89 2k6q n GLU 100 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.13 177.56 2k6q n SER 101 N -1.11 1.90 0.00 -1.84 7.64 0.51 -4.74 113.62 115.99 2k6q n SER 101 Ca 0.16 -1.66 0.00 0.00 1.01 0.00 0.00 58.87 58.39 2k6q n SER 101 Cb 0.23 -0.05 0.00 0.00 -1.01 0.00 0.00 64.21 63.38 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 -0.01 0.00 -1.07 1.43 -0.58 -0.77 -5.00 120.64 114.64 2k6q n GLU 102 Ca 0.03 0.00 -0.34 0.00 -0.42 0.00 0.00 57.16 56.44 2k6q n GLU 102 Cb 0.22 -0.25 0.01 0.00 -0.57 0.00 0.00 31.44 30.85 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 -2.52 0.00 -2.30 3.49 -4.01 0.18 -4.97 116.66 106.54 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 0.16 -0.86 0.02 0.00 -3.04 0.00 0.00 32.46 28.74 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 2.14 1.42 -0.21 2.89 8.00 -1.26 -4.93 116.55 124.59 2k6q n ASP 104 Ca 0.07 -1.88 0.01 0.00 0.71 0.00 0.00 54.79 53.70 2k6q n ASP 104 Cb 0.40 -0.15 0.11 0.00 -0.02 0.00 0.00 41.12 41.46 2k6q n ASP 104 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 2k6q h GLU 105 N 0.00 0.15 -0.67 -1.24 4.39 -1.96 0.34 114.58 115.59 2k6q h GLU 105 Ca -0.16 -0.01 0.13 0.00 0.34 0.00 0.00 59.36 59.67 2k6q h GLU 105 Cb 0.66 -0.03 -0.13 0.00 -0.10 0.00 0.00 28.75 29.15 2k6q h GLU 105 CO 0.24 0.10 -0.19 0.38 -1.16 0.00 0.00 179.01 178.37 2k6q h ASP 106 N 0.15 -0.70 0.00 1.42 2.03 -1.94 -3.46 116.42 113.92 2k6q h ASP 106 Ca 0.33 0.21 0.00 0.00 -0.73 0.00 0.00 57.03 56.84 2k6q h ASP 106 Cb 0.54 0.44 0.00 0.00 -0.83 0.00 0.00 39.33 39.48 2k6q h ASP 106 CO -0.51 -0.24 0.00 0.61 -1.03 0.00 0.00 179.24 178.08 2k6q n GLY 107 N -1.46 0.76 3.01 7.15 0.00 0.11 -4.41 105.19 110.35 2k6q n GLY 107 Ca 0.08 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.97 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 -1.39 -0.25 0.21 1.61 2.19 -1.26 -4.85 117.98 114.23 2k6q s PHE 108 Ca 0.00 0.64 -0.30 0.00 0.33 0.00 0.00 56.93 57.60 2k6q s PHE 108 Cb 0.00 0.00 -0.08 0.00 -1.31 0.00 0.00 43.02 41.63 2k6q s PHE 108 CO 0.00 -0.19 0.99 -0.51 1.83 0.00 0.00 175.22 177.34 2k6q s LEU 109 N 1.07 4.58 -0.25 6.12 2.01 -1.18 -4.15 118.68 126.89 2k6q s LEU 109 Ca -0.08 1.99 0.01 0.00 0.01 0.00 0.00 54.13 56.06 2k6q s LEU 109 Cb -0.10 -3.61 0.06 0.00 0.01 0.00 0.00 46.19 42.56 2k6q s LEU 109 CO -0.06 0.01 -0.05 -0.31 1.01 0.00 0.00 176.35 176.95 2k6q s TYR 110 N -0.79 2.60 -0.01 0.29 2.02 -1.26 0.17 117.35 120.36 2k6q s TYR 110 Ca 0.44 -1.93 0.04 0.00 -0.37 0.00 0.00 57.07 55.24 2k6q s TYR 110 Cb -0.27 -1.73 -0.01 0.00 -0.40 0.00 0.00 41.96 39.56 2k6q s TYR 110 CO 0.33 -0.81 -0.12 -1.64 -1.57 0.00 0.00 175.55 171.74 2k6q s MET 111 N 1.32 1.06 -0.12 -0.62 -1.94 -0.99 -1.21 119.30 116.81 2k6q s MET 111 Ca -0.05 -0.44 -0.01 0.00 -1.71 0.00 0.00 55.69 53.48 2k6q s MET 111 Cb -0.19 -1.01 -0.03 0.00 2.01 0.00 0.00 34.83 35.61 2k6q s MET 111 CO -0.07 0.25 -0.07 0.08 -0.01 0.00 0.00 175.02 175.20 2k6q s VAL 112 N -0.21 3.66 0.15 -6.03 1.01 0.71 -2.09 120.40 117.60 2k6q s VAL 112 Ca 0.03 -0.46 0.08 0.00 0.00 0.00 0.00 61.98 61.63 2k6q s VAL 112 Cb -0.06 -2.55 -0.04 0.00 0.00 0.00 0.00 36.38 33.73 2k6q s VAL 112 CO -0.00 0.54 -0.08 -0.72 0.00 0.00 0.00 175.10 174.84 2k6q s TYR 113 N -0.09 2.71 0.15 5.22 -0.85 -1.14 0.42 117.35 123.77 2k6q s TYR 113 Ca 0.01 -0.18 -0.23 0.00 -0.52 0.00 0.00 57.07 56.14 2k6q s TYR 113 Cb -0.13 -1.35 0.08 0.00 0.38 0.00 0.00 41.96 40.93 2k6q s TYR 113 CO 0.03 0.48 1.09 0.00 -1.52 0.00 0.00 175.55 175.63 2k6q s ALA 114 N -1.54 -1.76 -0.47 9.51 0.00 -0.86 -2.96 121.76 123.68 2k6q s ALA 114 Ca 0.24 -0.25 0.04 0.00 0.00 0.00 0.00 51.96 51.99 2k6q s ALA 114 Cb -0.10 0.78 0.31 0.00 0.00 0.00 0.00 23.12 24.12 2k6q s ALA 114 CO 0.15 -1.08 1.17 0.45 0.00 0.00 0.00 175.76 176.45 2k6q n SER 115 N -1.18 3.11 -3.75 0.00 2.88 -1.26 0.10 113.62 113.52 2k6q n SER 115 Ca -0.02 -2.50 -0.13 0.00 -1.33 0.00 0.00 58.87 54.89 2k6q n SER 115 Cb 0.59 -0.60 -0.10 0.00 -0.75 0.00 0.00 64.21 63.35 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 -1.57 0.48 0.00 -1.46 2.00 -1.26 -4.77 119.66 113.08 2k6q s GLN 116 Ca 0.23 0.35 0.00 0.00 -2.00 0.00 0.00 55.36 53.93 2k6q s GLN 116 Cb 0.18 0.23 0.00 0.00 0.80 0.00 0.00 33.01 34.22 2k6q s GLN 116 CO 0.06 -0.08 0.34 -1.91 -0.50 0.00 0.00 175.29 173.20 2k6q n GLU 117 N 2.52 0.68 -3.20 1.67 2.13 -1.26 -4.66 120.64 118.52 2k6q n GLU 117 Ca -0.15 -0.34 -0.23 0.00 0.66 0.00 0.00 57.16 57.10 2k6q n GLU 117 Cb 0.57 -0.83 -0.06 0.00 0.27 0.00 0.00 31.44 31.40 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 -0.19 -0.04 -0.11 6.31 -2.24 -1.26 -4.74 114.28 112.00 2k6q n THR 118 Ca 0.00 -4.37 -0.17 0.00 -2.27 0.00 0.00 64.05 57.24 2k6q n THR 118 Cb 0.02 -1.51 -0.13 0.00 -2.10 0.00 0.00 70.33 66.62 2k6q n THR 118 CO 0.00 0.00 0.00 2.22 -0.57 0.00 0.00 175.07 176.72 2k6q n PHE 119 N 0.97 0.15 -0.06 4.78 1.16 -1.26 -5.27 117.46 117.94 2k6q n PHE 119 Ca 0.24 0.04 0.00 0.00 -1.87 0.00 0.00 57.45 55.85 2k6q n PHE 119 Cb 0.54 -1.02 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