#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 -1.46 0.00 -1.26 -5.05 119.30 112.37 2k6q s MET 1 Ca 0.00 0.31 -0.00 0.00 0.00 0.00 0.00 55.69 56.00 2k6q s MET 1 Cb 0.00 0.31 0.01 0.00 0.00 0.00 0.00 34.83 35.15 2k6q s MET 1 CO 0.00 -0.15 1.39 -1.00 0.00 0.00 0.00 175.02 175.26 2k6q h PRO 2 N 4.52 0.32 -6.08 4.11 0.13 -2.10 -3.44 132.00 129.45 2k6q h PRO 2 Ca -0.28 -0.31 -0.61 0.00 -0.87 0.00 0.00 66.00 63.94 2k6q h PRO 2 Cb 1.17 0.08 -0.29 0.00 0.13 0.00 0.00 31.00 32.09 2k6q h PRO 2 CO 0.30 0.99 -0.85 -1.12 -0.23 0.00 0.00 178.00 177.08 2k6q s SER 3 N -6.98 2.48 -0.16 1.44 0.01 -1.26 -5.13 113.70 104.10 2k6q s SER 3 Ca -0.05 -0.42 -0.07 0.00 1.31 0.00 0.00 55.95 56.73 2k6q s SER 3 Cb 0.10 -0.26 -0.04 0.00 0.21 0.00 0.00 66.02 66.03 2k6q s SER 3 CO 0.84 0.24 0.06 -0.70 0.41 0.00 0.00 173.24 174.09 2k6q s GLU 4 N -0.67 3.80 1.11 12.44 2.56 -1.26 -5.09 118.70 131.59 2k6q s GLU 4 Ca 0.08 -0.33 -0.16 0.00 0.00 0.00 0.00 54.97 54.56 2k6q s GLU 4 Cb -0.08 -3.15 0.20 0.00 2.00 0.00 0.00 34.13 33.09 2k6q s GLU 4 CO -0.00 0.38 0.36 1.63 -0.56 0.00 0.00 175.26 177.07 2k6q n LYS 5 N 3.20 -2.59 -4.36 4.30 5.02 -1.26 -5.01 118.16 117.45 2k6q n LYS 5 Ca -0.17 -0.76 -0.28 0.00 -2.02 0.00 0.00 58.31 55.08 2k6q n LYS 5 Cb 0.53 -1.60 -0.11 0.00 -0.02 0.00 0.00 35.03 33.82 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 -2.12 2.62 0.62 -0.18 -4.23 -1.26 -4.78 115.64 106.32 2k6q s THR 6 Ca 0.46 -1.77 0.24 0.00 -1.18 0.00 0.00 61.69 59.44 2k6q s THR 6 Cb -0.08 -2.23 0.31 0.00 1.34 0.00 0.00 72.50 71.83 2k6q s THR 6 CO 0.44 -0.02 1.59 -0.26 -0.54 0.00 0.00 174.62 175.83 2k6q h PHE 7 N 3.42 0.00 0.20 3.99 -1.00 -1.95 1.83 116.94 123.42 2k6q h PHE 7 Ca -0.48 0.00 -0.32 0.00 2.81 0.00 0.00 57.97 59.98 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 0.64 0.00 -1.38 1.57 -1.61 0.00 0.00 178.31 177.54 2k6q h LYS 8 N 0.00 0.53 0.00 1.51 2.10 -1.94 -3.26 116.57 115.50 2k6q h LYS 8 Ca 0.22 -0.83 0.00 0.00 -2.00 0.00 0.00 60.65 58.04 2k6q h LYS 8 Cb 1.71 0.30 0.00 0.00 -0.90 0.00 0.00 32.23 33.34 2k6q h LYS 8 CO -0.00 1.39 -0.21 1.04 -2.00 0.00 0.00 179.45 179.67 2k6q n GLN 9 N -3.71 0.15 0.00 0.07 1.13 0.50 -4.58 117.38 110.94 2k6q n GLN 9 Ca -0.15 0.26 0.00 0.00 -1.94 0.00 0.00 57.00 55.17 2k6q n GLN 9 Cb 1.06 -0.98 0.00 0.00 0.11 0.00 0.00 30.24 30.43 2k6q n GLN 9 CO 0.00 0.00 0.00 -2.13 -1.44 0.00 0.00 177.06 173.49 2k6q n ARG 10 N -3.05 0.00 -1.75 -1.09 3.00 0.50 -4.40 116.66 109.87 2k6q n ARG 10 Ca -0.03 0.72 -0.42 0.00 -0.00 0.00 0.00 57.85 58.12 2k6q n ARG 10 Cb 0.11 -1.23 -0.01 0.00 0.00 0.00 0.00 32.46 31.34 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 -1.90 2.54 -1.95 -0.14 3.00 -1.23 -4.89 116.66 112.09 2k6q n ARG 11 Ca 0.00 0.89 -0.42 0.00 -0.01 0.00 0.00 57.85 58.31 2k6q n ARG 11 Cb 0.00 -2.60 -0.03 0.00 0.00 0.00 0.00 32.46 29.83 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 -0.03 6.61 0.13 0.55 0.01 -1.26 -4.63 113.70 115.08 2k6q s SER 12 Ca 0.56 2.52 -0.31 0.00 1.31 0.00 0.00 55.95 60.03 2k6q s SER 12 Cb -0.51 -2.58 -0.08 0.00 0.21 0.00 0.00 66.02 63.07 2k6q s SER 12 CO 0.60 -0.85 1.56 0.15 0.41 0.00 0.00 173.24 175.11 2k6q h PHE 13 N 7.67 -1.47 0.00 2.43 3.57 -1.86 0.80 116.94 128.08 2k6q h PHE 13 Ca -0.42 0.07 0.00 0.00 3.53 0.00 0.00 57.97 61.14 2k6q h PHE 13 Cb 1.20 0.68 0.00 0.00 2.79 0.00 0.00 35.95 40.62 2k6q h PHE 13 CO 0.72 -0.50 0.37 1.49 -2.23 0.00 0.00 178.31 178.16 2k6q h GLU 14 N -0.46 0.00 -0.01 1.11 4.81 -1.98 0.54 114.58 118.60 2k6q h GLU 14 Ca 0.08 0.00 -0.23 0.00 -0.13 0.00 0.00 59.36 59.08 2k6q h GLU 14 Cb 0.63 0.00 0.02 0.00 0.63 0.00 0.00 28.75 30.03 2k6q h GLU 14 CO -0.50 0.00 -0.90 0.37 -0.73 0.00 0.00 179.01 177.24 2k6q h GLN 15 N 0.00 0.62 0.01 1.92 4.15 0.25 -3.05 115.11 119.01 2k6q h GLN 15 Ca 0.00 -0.66 -0.02 0.00 0.77 0.00 0.00 58.65 58.74 2k6q h GLN 15 Cb 0.73 0.19 0.00 0.00 0.21 0.00 0.00 27.48 28.61 2k6q h GLN 15 CO 0.00 1.26 -0.08 0.00 -1.93 0.00 0.00 178.83 178.09 2k6q h ARG 16 N 0.25 0.03 -0.97 1.69 -0.00 0.60 -3.17 114.38 112.81 2k6q h ARG 16 Ca -0.11 -0.05 0.31 0.00 -0.50 0.00 0.00 59.98 59.63 2k6q h ARG 16 Cb 1.57 0.02 -0.15 0.00 0.00 0.00 0.00 29.97 31.41 2k6q h ARG 16 CO 0.18 1.00 0.45 -0.39 0.00 0.00 0.00 179.97 181.21 2k6q h VAL 17 N -0.91 0.24 -0.43 2.04 -1.51 -0.71 1.03 116.25 116.00 2k6q h VAL 17 Ca -0.01 -0.08 -0.03 0.00 -1.23 0.00 0.00 66.70 65.35 2k6q h VAL 17 Cb 1.03 -0.01 -0.02 0.00 -2.13 0.00 0.00 31.29 30.17 2k6q h VAL 17 CO 0.01 0.04 0.14 -0.08 -1.23 0.00 0.00 177.57 176.46 2k6q h GLU 18 N 0.23 0.66 -0.73 5.19 4.57 -1.61 -1.96 114.58 120.93 2k6q h GLU 18 Ca 0.70 -0.14 0.16 0.00 -1.18 0.00 0.00 59.36 58.90 2k6q h GLU 18 Cb 1.59 -0.10 -0.05 0.00 -0.16 0.00 0.00 28.75 30.04 2k6q h GLU 18 CO -0.66 0.64 0.49 0.22 -1.18 0.00 0.00 179.01 178.52 2k6q h ASP 19 N 0.55 0.31 -0.21 1.04 1.82 0.11 0.11 116.42 120.14 2k6q h ASP 19 Ca 0.14 0.02 -0.08 0.00 -0.39 0.00 0.00 57.03 56.72 2k6q h ASP 19 Cb 0.25 -0.04 -0.00 0.00 0.68 0.00 0.00 39.33 40.21 2k6q h ASP 19 CO -0.01 0.16 -0.17 0.58 -1.61 0.00 0.00 179.24 178.19 2k6q h VAL 20 N 0.32 1.32 -0.93 2.25 2.07 -0.53 -3.03 116.25 117.72 2k6q h VAL 20 Ca 0.36 -1.31 0.36 0.00 0.82 0.00 0.00 66.70 66.93 2k6q h VAL 20 Cb 0.93 1.71 -0.17 0.00 -1.52 0.00 0.00 31.29 32.24 2k6q h VAL 20 CO -0.10 0.40 0.39 -1.14 0.02 0.00 0.00 177.57 177.15 2k6q n ARG 21 N -4.46 -0.06 0.24 1.57 0.63 0.38 0.56 116.66 115.51 2k6q n ARG 21 Ca -0.05 1.31 -0.10 0.00 -0.92 0.00 0.00 57.85 58.09 2k6q n ARG 21 Cb 0.38 -2.29 -0.05 0.00 0.45 0.00 0.00 32.46 30.96 2k6q n ARG 21 CO 0.00 0.00 0.00 -0.07 -2.51 0.00 0.00 177.63 175.05 2k6q h LEU 22 N 0.00 -0.55 -1.56 6.15 -0.00 -1.47 -0.70 115.31 117.17 2k6q h LEU 22 Ca 0.74 0.02 0.20 0.00 -0.00 0.00 0.00 57.88 58.84 2k6q h LEU 22 Cb 1.88 0.14 -0.03 0.00 -0.00 0.00 0.00 40.66 42.66 2k6q h LEU 22 CO -0.75 -0.23 0.81 -0.29 -0.00 0.00 0.00 178.44 177.98 2k6q h ILE 23 N -0.98 0.19 0.22 1.22 6.09 -0.38 2.00 117.51 125.87 2k6q h ILE 23 Ca -0.07 0.00 -0.32 0.00 -1.37 0.00 0.00 64.86 63.10 2k6q h ILE 23 Cb 0.50 0.35 0.03 0.00 0.47 0.00 0.00 36.82 38.17 2k6q h ILE 23 CO 0.11 0.00 -1.42 0.03 -3.07 0.00 0.00 178.15 173.80 2k6q h ARG 24 N 0.00 0.52 -0.01 2.19 2.47 0.35 0.72 114.38 120.62 2k6q h ARG 24 Ca 0.33 -0.85 0.00 0.00 -1.26 0.00 0.00 59.98 58.20 2k6q h ARG 24 Cb 1.95 0.31 0.00 0.00 -1.65 0.00 0.00 29.97 30.58 2k6q h ARG 24 CO -0.00 1.40 -0.21 -0.85 0.56 0.00 0.00 179.97 180.88 2k6q n GLU 25 N -3.70 0.91 -0.03 0.04 0.28 0.50 -3.63 120.64 115.01 2k6q n GLU 25 Ca -0.15 -0.51 -0.07 0.00 -0.16 0.00 0.00 57.16 56.27 2k6q n GLU 25 Cb 1.08 -1.49 -0.02 0.00 1.43 0.00 0.00 31.44 32.44 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 -0.60 0.24 -3.83 3.44 6.02 0.56 -4.87 117.38 118.33 2k6q n GLN 26 Ca 0.13 0.10 -0.30 0.00 -0.01 0.00 0.00 57.00 56.92 2k6q n GLN 26 Cb 0.34 -0.92 -0.11 0.00 1.02 0.00 0.00 30.24 30.58 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 -2.34 3.67 0.20 1.08 3.76 0.25 -4.88 115.29 117.03 2k6q s HIS 27 Ca -0.14 -3.27 0.06 0.00 -0.15 0.00 0.00 55.06 51.56 2k6q s HIS 27 Cb 0.03 -2.84 0.12 0.00 1.11 0.00 0.00 32.58 31.00 2k6q s HIS 27 CO 0.20 -0.59 1.47 -1.00 -0.85 0.00 0.00 174.74 173.96 2k6q h PRO 28 N 5.53 0.10 -0.97 8.40 0.13 -1.62 -3.05 132.00 140.51 2k6q h PRO 28 Ca 0.15 -0.09 -0.23 0.00 -0.87 0.00 0.00 66.00 64.96 2k6q h PRO 28 Cb 0.77 0.02 -0.14 0.00 0.13 0.00 0.00 31.00 31.78 2k6q h PRO 28 CO 0.75 0.82 0.29 0.25 -0.23 0.00 0.00 178.00 179.89 2k6q n THR 29 N -3.68 2.03 -4.08 1.56 -2.24 -1.26 -4.83 114.28 101.78 2k6q n THR 29 Ca -0.02 -0.94 -0.14 0.00 -2.27 0.00 0.00 64.05 60.68 2k6q n THR 29 Cb 0.74 -0.69 -0.12 0.00 -2.10 0.00 0.00 70.33 68.16 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 -1.71 0.49 -0.32 -0.78 -0.14 -1.15 -2.98 119.74 113.15 2k6q s LYS 30 Ca 0.29 -0.59 -0.12 0.00 -1.36 0.00 0.00 55.97 54.19 2k6q s LYS 30 Cb 0.24 -0.31 -0.03 0.00 -1.68 0.00 0.00 37.83 36.05 2k6q s LYS 30 CO 0.06 0.06 0.22 0.42 -0.76 0.00 0.00 175.35 175.36 2k6q s ILE 31 N -1.03 5.30 0.24 2.17 -1.09 0.42 -4.90 121.20 122.31 2k6q s ILE 31 Ca -0.07 -0.07 -0.30 0.00 -2.23 0.00 0.00 60.65 57.99 2k6q s ILE 31 Cb -0.08 -3.65 -0.09 0.00 -1.58 0.00 0.00 42.46 37.07 2k6q s ILE 31 CO 0.00 0.09 1.10 -2.16 -1.23 0.00 0.00 174.94 172.74 2k6q s PRO 32 N 1.74 4.63 0.06 2.79 0.04 -1.26 -2.94 135.00 140.05 2k6q s PRO 32 Ca 0.06 1.76 -0.09 0.00 0.04 0.00 0.00 61.00 62.78 2k6q s PRO 32 Cb -0.17 -3.22 -0.00 0.00 0.04 0.00 0.00 34.50 31.15 2k6q s PRO 32 CO 0.11 0.17 0.18 0.14 0.04 0.00 0.00 177.00 177.64 2k6q s VAL 33 N -0.81 0.13 -0.38 -0.36 -7.23 -1.22 -2.84 120.40 107.69 2k6q s VAL 33 Ca 0.46 -1.03 0.01 0.00 -1.81 0.00 0.00 61.98 59.61 2k6q s VAL 33 Cb -0.31 -1.08 0.12 0.00 0.56 0.00 0.00 36.38 35.67 2k6q s VAL 33 CO 0.38 -0.57 0.15 -0.63 -0.31 0.00 0.00 175.10 174.13 2k6q s ILE 34 N -3.07 1.39 -0.26 -0.62 -1.09 0.44 -3.20 121.20 114.78 2k6q s ILE 34 Ca -0.01 -2.10 -0.17 0.00 -2.23 0.00 0.00 60.65 56.14 2k6q s ILE 34 Cb 0.01 -2.01 -0.03 0.00 -1.58 0.00 0.00 42.46 38.85 2k6q s ILE 34 CO -0.07 -0.76 0.45 -0.63 -1.23 0.00 0.00 174.94 172.71 2k6q s ILE 35 N 0.91 5.12 0.28 2.92 1.01 -0.75 -2.15 121.20 128.54 2k6q s ILE 35 Ca 0.13 0.74 0.04 0.00 0.00 0.00 0.00 60.65 61.57 2k6q s ILE 35 Cb -0.21 -3.77 -0.06 0.00 0.01 0.00 0.00 42.46 38.43 2k6q s ILE 35 CO -0.11 0.13 0.00 -1.61 0.00 0.00 0.00 174.94 173.35 2k6q s GLU 36 N 2.15 1.51 0.23 2.79 0.41 -0.90 -4.33 118.70 120.57 2k6q s GLU 36 Ca 0.19 -1.79 -0.30 0.00 -0.41 0.00 0.00 54.97 52.65 2k6q s GLU 36 Cb -0.16 -0.86 -0.09 0.00 -1.78 0.00 0.00 34.13 31.24 2k6q s GLU 36 CO 0.09 -0.09 1.02 -0.98 -0.49 0.00 0.00 175.26 174.82 2k6q s ARG 37 N -3.83 4.73 0.35 1.61 1.70 -1.26 -1.61 118.95 120.63 2k6q s ARG 37 Ca 0.32 1.64 -0.28 0.00 -0.47 0.00 0.00 55.73 56.93 2k6q s ARG 37 Cb 0.06 -3.26 -0.12 0.00 -0.57 0.00 0.00 34.95 31.07 2k6q s ARG 37 CO 0.12 0.31 1.43 0.98 -1.08 0.00 0.00 175.30 177.06 2k6q n TYR 38 N 1.63 2.69 -1.55 5.89 4.19 -1.06 -4.78 117.16 124.17 2k6q n TYR 38 Ca -0.01 0.46 -0.28 0.00 3.31 0.00 0.00 57.90 61.39 2k6q n TYR 38 Cb 0.46 -2.50 -0.06 0.00 0.49 0.00 0.00 39.34 37.73 2k6q n TYR 38 CO 0.00 0.00 0.00 1.63 0.91 0.00 0.00 176.86 179.40 2k6q n LYS 39 N 0.77 0.74 0.00 2.98 5.02 -1.26 0.80 118.16 127.21 2k6q n LYS 39 Ca 0.04 -0.30 0.00 0.00 -2.02 0.00 0.00 58.31 56.03 2k6q n LYS 39 Cb 0.37 -3.26 0.00 0.00 -0.02 0.00 0.00 35.03 32.12 2k6q n LYS 39 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2k6q n GLY 40 N 6.30 1.53 3.32 0.72 0.00 -1.26 -5.09 105.19 110.70 2k6q n GLY 40 Ca 0.44 0.00 -0.40 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 -0.10 2.71 -0.08 1.61 2.56 0.24 -4.86 118.70 120.78 2k6q s GLU 41 Ca 0.00 -1.29 0.06 0.00 0.00 0.00 0.00 54.97 53.75 2k6q s GLU 41 Cb 0.00 -3.76 -0.10 0.00 2.00 0.00 0.00 34.13 32.27 2k6q s GLU 41 CO 0.00 -0.84 0.01 0.36 -0.56 0.00 0.00 175.26 174.23 2k6q n LYS 42 N 4.96 2.34 0.00 4.30 0.00 -1.26 -4.70 118.16 123.80 2k6q n LYS 42 Ca -0.11 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.20 2k6q n LYS 42 Cb 0.44 -1.21 0.00 0.00 -0.00 0.00 0.00 35.03 34.26 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 -2.37 0.00 -1.52 -1.58 1.13 -1.26 -4.47 117.38 107.31 2k6q n GLN 43 Ca -0.14 0.51 -0.36 0.00 -1.94 0.00 0.00 57.00 55.07 2k6q n GLN 43 Cb 0.76 -0.99 0.08 0.00 0.11 0.00 0.00 30.24 30.20 2k6q n GLN 43 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 2k6q n LEU 44 N -1.12 4.86 -4.80 1.08 4.77 -1.26 -4.98 117.00 115.55 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 -1.49 0.09 0.00 -2.33 0.00 0.00 43.42 39.69 2k6q n LEU 44 CO 0.00 -1.48 0.71 -2.16 -1.33 0.00 0.00 177.39 173.13 2k6q s PRO 45 N -3.40 2.01 -0.28 3.23 0.04 -1.26 -4.96 135.00 130.38 2k6q s PRO 45 Ca 0.78 0.62 -0.29 0.00 0.04 0.00 0.00 61.00 62.15 2k6q s PRO 45 Cb -0.36 -1.91 -0.01 0.00 0.04 0.00 0.00 34.50 32.26 2k6q s PRO 45 CO 0.45 -1.67 1.41 0.54 0.04 0.00 0.00 177.00 177.77 2k6q s VAL 46 N -3.16 3.98 0.26 -0.36 0.11 -1.26 -4.93 120.40 115.04 2k6q s VAL 46 Ca 0.61 1.10 -0.26 0.00 -2.93 0.00 0.00 61.98 60.50 2k6q s VAL 46 Cb -0.14 -4.00 -0.17 0.00 -1.53 0.00 0.00 36.38 30.54 2k6q s VAL 46 CO 0.54 -0.42 0.41 -0.11 -3.33 0.00 0.00 175.10 172.19 2k6q n LEU 47 N 7.95 -1.62 -0.35 2.54 -0.00 -1.26 -4.69 117.00 119.57 2k6q n LEU 47 Ca 0.16 1.04 0.33 0.00 -0.00 0.00 0.00 56.01 57.54 2k6q n LEU 47 Cb 0.46 -0.94 0.60 0.00 -0.00 0.00 0.00 43.42 43.54 2k6q n LEU 47 CO 0.64 -3.29 1.10 0.44 -0.00 0.00 0.00 177.39 176.28 2k6q h ASP 48 N 0.83 0.32 -1.27 1.96 5.19 -1.93 -3.43 116.42 118.10 2k6q h ASP 48 Ca -0.31 0.23 -0.01 0.00 -0.62 0.00 0.00 57.03 56.33 2k6q h ASP 48 Cb 1.44 0.23 0.00 0.00 0.18 0.00 0.00 39.33 41.18 2k6q h ASP 48 CO 0.54 -0.37 0.03 2.29 -3.12 0.00 0.00 179.24 178.61 2k6q n LYS 49 N -5.13 0.13 -0.02 3.56 0.00 -1.26 -5.07 118.16 110.36 2k6q n LYS 49 Ca 0.38 -0.26 -0.02 0.00 -0.00 0.00 0.00 58.31 58.41 2k6q n LYS 49 Cb 1.31 0.32 -0.04 0.00 -0.00 0.00 0.00 35.03 36.62 2k6q n LYS 49 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.40 177.65 2k6q n THR 50 N -0.06 0.32 -3.25 0.58 -2.24 -1.26 -4.82 114.28 103.55 2k6q n THR 50 Ca -0.01 -0.22 -0.38 0.00 -2.27 0.00 0.00 64.05 61.17 2k6q n THR 50 Cb 0.07 -0.66 -0.06 0.00 -2.10 0.00 0.00 70.33 67.58 2k6q n THR 50 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2k6q s LYS 51 N -2.18 4.36 -0.01 -0.78 1.02 -1.26 -1.80 119.74 119.09 2k6q s LYS 51 Ca -0.03 0.55 -0.00 0.00 0.02 0.00 0.00 55.97 56.51 2k6q s LYS 51 Cb 0.02 -3.44 0.01 0.00 -0.52 0.00 0.00 37.83 33.90 2k6q s LYS 51 CO 0.23 0.14 0.02 -0.06 -0.92 0.00 0.00 175.35 174.76 2k6q s PHE 52 N 0.64 0.00 -0.45 3.18 0.40 -1.20 -5.03 117.98 115.53 2k6q s PHE 52 Ca 0.29 0.06 -0.11 0.00 -0.60 0.00 0.00 56.93 56.57 2k6q s PHE 52 Cb -0.16 -0.07 0.09 0.00 0.51 0.00 0.00 43.02 43.40 2k6q s PHE 52 CO 0.12 -0.03 0.33 -0.51 0.70 0.00 0.00 175.22 175.83 2k6q s LEU 53 N 0.34 5.47 0.02 -0.37 1.43 -1.26 -3.39 118.68 120.92 2k6q s LEU 53 Ca -0.03 -1.61 -0.09 0.00 -1.03 0.00 0.00 54.13 51.37 2k6q s LEU 53 Cb -0.04 -2.04 -0.05 0.00 0.03 0.00 0.00 46.19 44.08 2k6q s LEU 53 CO -0.01 -0.63 0.33 0.54 0.23 0.00 0.00 176.35 176.81 2k6q s VAL 54 N 1.46 5.20 0.06 -1.59 0.11 -1.15 -4.90 120.40 119.59 2k6q s VAL 54 Ca 0.04 0.37 -0.30 0.00 -2.93 0.00 0.00 61.98 59.15 2k6q s VAL 54 Cb -0.25 -3.61 -0.05 0.00 -1.53 0.00 0.00 36.38 30.94 2k6q s VAL 54 CO 0.02 0.38 1.16 -2.16 -3.33 0.00 0.00 175.10 171.18 2k6q s PRO 55 N -1.67 4.46 -0.40 1.54 0.04 -1.26 -0.44 135.00 137.27 2k6q s PRO 55 Ca 0.28 1.72 -0.07 0.00 0.04 0.00 0.00 61.00 62.98 2k6q s PRO 55 Cb -0.14 -3.36 -0.19 0.00 0.04 0.00 0.00 34.50 30.85 2k6q s PRO 55 CO 0.16 -0.21 3.38 -0.40 0.04 0.00 0.00 177.00 179.97 2k6q n ASP 56 N 3.81 6.13 -0.59 6.66 5.75 -1.16 -3.19 116.55 133.96 2k6q n ASP 56 Ca 0.08 -2.59 -0.00 0.00 -0.01 0.00 0.00 54.79 52.27 2k6q n ASP 56 Cb 0.47 -1.43 -0.00 0.00 -1.03 0.00 0.00 41.12 39.13 2k6q n ASP 56 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2k6q n HIS 57 N 2.53 0.00 -3.72 2.11 1.44 -1.26 -4.95 115.22 111.37 2k6q n HIS 57 Ca 0.51 -0.06 0.00 0.00 -2.01 0.00 0.00 57.72 56.16 2k6q n HIS 57 Cb 0.73 0.14 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 0.03 0.00 -4.17 0.61 0.24 -1.19 -5.14 118.33 108.71 2k6q n VAL 58 Ca -0.02 0.00 -0.23 0.00 -2.04 0.00 0.00 64.34 62.06 2k6q n VAL 58 Cb 0.62 0.00 -0.06 0.00 -1.47 0.00 0.00 33.84 32.93 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 -0.45 4.79 0.59 -1.34 4.22 -1.26 -3.54 114.94 117.96 2k6q s ASN 59 Ca 0.00 -0.62 0.30 0.00 -2.14 0.00 0.00 52.86 50.39 2k6q s ASN 59 Cb 0.00 -0.90 1.79 0.00 1.28 0.00 0.00 41.25 43.42 2k6q s ASN 59 CO 0.00 -0.14 2.21 0.00 -2.04 0.00 0.00 177.10 177.13 2k6q h MET 60 N 1.66 0.00 -0.01 3.55 -0.00 -1.82 -1.96 114.93 116.35 2k6q h MET 60 Ca -0.45 0.00 0.01 0.00 -0.00 0.00 0.00 59.70 59.26 2k6q h MET 60 Cb 1.25 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 32.84 2k6q h MET 60 CO 0.61 0.00 -0.04 1.03 -0.00 0.00 0.00 176.91 178.51 2k6q h SER 61 N 0.00 -0.13 -0.86 -0.10 0.87 -1.92 -2.66 113.55 108.76 2k6q h SER 61 Ca 0.03 0.02 0.15 0.00 -1.23 0.00 0.00 61.79 60.76 2k6q h SER 61 Cb 0.16 0.06 -0.15 0.00 -0.44 0.00 0.00 62.40 62.03 2k6q h SER 61 CO -0.00 -0.06 -0.31 -0.33 -0.53 0.00 0.00 176.83 175.60 2k6q h GLU 62 N -0.07 -0.04 -1.01 2.24 4.39 -1.76 1.40 114.58 119.73 2k6q h GLU 62 Ca 0.02 0.00 0.27 0.00 0.34 0.00 0.00 59.36 59.99 2k6q h GLU 62 Cb 0.10 0.01 -0.13 0.00 -0.10 0.00 0.00 28.75 28.63 2k6q h GLU 62 CO -0.05 -0.02 0.59 1.25 -1.16 0.00 0.00 179.01 179.61 2k6q h LEU 63 N -0.04 0.62 -1.05 1.33 5.85 -1.57 1.29 115.31 121.75 2k6q h LEU 63 Ca 0.35 0.15 0.02 0.00 0.84 0.00 0.00 57.88 59.24 2k6q h LEU 63 Cb 0.61 0.06 -0.05 0.00 0.37 0.00 0.00 40.66 41.65 2k6q h LEU 63 CO -0.89 0.03 0.64 0.40 -0.34 0.00 0.00 178.44 178.29 2k6q h ILE 64 N 0.50 1.22 -0.15 4.05 1.08 0.19 0.51 117.51 124.91 2k6q h ILE 64 Ca 0.67 -0.44 -0.20 0.00 -0.39 0.00 0.00 64.86 64.50 2k6q h ILE 64 Cb 1.37 -0.18 0.00 0.00 -3.07 0.00 0.00 36.82 34.94 2k6q h ILE 64 CO -0.51 0.23 -0.71 0.11 -0.69 0.00 0.00 178.15 176.59 2k6q h LYS 65 N 1.28 0.66 -0.04 2.37 1.57 0.19 -0.12 116.57 122.49 2k6q h LYS 65 Ca 0.37 -0.51 -0.07 0.00 -1.87 0.00 0.00 60.65 58.57 2k6q h LYS 65 Cb -0.09 0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.31 2k6q h LYS 65 CO -0.09 1.13 -0.30 0.82 -0.57 0.00 0.00 179.45 180.43 2k6q h ILE 66 N 0.47 1.23 0.02 1.86 1.08 0.78 0.49 117.51 123.44 2k6q h ILE 66 Ca -0.03 -1.10 -0.00 0.00 -0.39 0.00 0.00 64.86 63.34 2k6q h ILE 66 Cb 1.31 1.54 0.00 0.00 -3.07 0.00 0.00 36.82 36.60 2k6q h ILE 66 CO 0.14 0.32 -0.01 0.40 -0.69 0.00 0.00 178.15 178.31 2k6q h ILE 67 N 0.06 0.00 -0.99 -0.67 1.08 0.19 -2.82 117.51 114.35 2k6q h ILE 67 Ca 0.01 -0.09 0.32 0.00 -0.39 0.00 0.00 64.86 64.70 2k6q h ILE 67 Cb 0.57 0.00 -0.15 0.00 -3.07 0.00 0.00 36.82 34.17 2k6q h ILE 67 CO 0.04 0.00 0.54 0.08 -0.69 0.00 0.00 178.15 178.12 2k6q h ARG 68 N -0.11 0.30 -0.70 2.37 0.11 -1.08 1.43 114.38 116.70 2k6q h ARG 68 Ca -0.00 -0.02 -0.01 0.00 0.10 0.00 0.00 59.98 60.05 2k6q h ARG 68 Cb 0.02 -0.07 -0.03 0.00 1.11 0.00 0.00 29.97 30.99 2k6q h ARG 68 CO 0.00 0.20 0.40 0.00 0.10 0.00 0.00 179.97 180.67 2k6q h ARG 69 N 0.31 0.96 -0.04 0.08 2.47 -1.01 -0.54 114.38 116.61 2k6q h ARG 69 Ca 0.72 -0.09 -0.01 0.00 -1.26 0.00 0.00 59.98 59.33 2k6q h ARG 69 Cb 1.63 -0.20 -0.00 0.00 -1.65 0.00 0.00 29.97 29.75 2k6q h ARG 69 CO -0.62 0.69 -0.03 0.00 0.56 0.00 0.00 179.97 180.58 2k6q h ARG 70 N 0.97 0.09 0.00 0.04 3.08 0.22 -2.60 114.38 116.17 2k6q h ARG 70 Ca 0.25 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.26 2k6q h ARG 70 Cb -0.00 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.04 2k6q h ARG 70 CO -0.04 0.51 0.00 -0.07 -1.07 0.00 0.00 179.97 179.30 2k6q h LEU 71 N -0.33 0.00 -2.13 3.04 3.38 -0.76 -3.45 115.31 115.05 2k6q h LEU 71 Ca 0.01 0.00 -0.58 0.00 0.09 0.00 0.00 57.88 57.39 2k6q h LEU 71 Cb 0.49 0.00 -0.19 0.00 0.09 0.00 0.00 40.66 41.05 2k6q h LEU 71 CO 0.01 0.00 -0.92 0.00 0.09 0.00 0.00 178.44 177.62 2k6q n GLN 72 N -2.69 -0.93 -1.62 1.13 10.64 -0.24 -4.90 117.38 118.78 2k6q n GLN 72 Ca -0.02 0.08 -0.26 0.00 -1.83 0.00 0.00 57.00 54.98 2k6q n GLN 72 Cb 0.09 -3.35 0.18 0.00 -0.86 0.00 0.00 30.24 26.30 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 -4.40 0.00 -5.01 2.61 4.77 -1.25 -5.09 117.00 108.63 2k6q n LEU 73 Ca -0.31 -1.26 -0.20 0.00 -0.03 0.00 0.00 56.01 54.22 2k6q n LEU 73 Cb 0.66 -0.88 0.05 0.00 -2.33 0.00 0.00 43.42 40.91 2k6q n LEU 73 CO 0.80 -1.36 0.33 0.21 -1.33 0.00 0.00 177.39 176.04 2k6q s ASN 74 N -5.18 5.15 0.45 -1.43 3.84 -1.26 -4.98 114.94 111.53 2k6q s ASN 74 Ca 0.65 -0.53 0.24 0.00 0.21 0.00 0.00 52.86 53.44 2k6q s ASN 74 Cb -0.02 -0.19 0.99 0.00 -0.55 0.00 0.00 41.25 41.48 2k6q s ASN 74 CO 0.46 -1.24 1.86 0.00 -2.79 0.00 0.00 177.10 175.39 2k6q h ALA 75 N 0.17 1.06 0.09 1.71 0.00 -2.04 -2.71 119.26 117.54 2k6q h ALA 75 Ca -0.36 -0.20 -0.28 0.00 0.00 0.00 0.00 54.91 54.08 2k6q h ALA 75 Cb 1.28 -0.04 0.02 0.00 0.00 0.00 0.00 17.79 19.06 2k6q h ALA 75 CO 0.43 0.28 -1.16 -0.91 0.00 0.00 0.00 179.25 177.89 2k6q h ASN 76 N 0.00 0.72 -3.97 0.00 2.35 -2.05 -3.45 115.58 109.19 2k6q h ASN 76 Ca -0.00 -0.66 -0.53 0.00 -0.55 0.00 0.00 56.30 54.56 2k6q h ASN 76 Cb 0.69 -0.23 0.09 0.00 0.05 0.00 0.00 38.32 38.92 2k6q h ASN 76 CO 0.03 1.47 0.61 -1.58 -1.65 0.00 0.00 177.43 176.31 2k6q s GLN 77 N -3.02 3.82 -0.06 0.81 -0.44 -1.02 -5.02 119.66 114.73 2k6q s GLN 77 Ca -0.08 2.16 0.02 0.00 -2.50 0.00 0.00 55.36 54.96 2k6q s GLN 77 Cb 0.07 -2.65 -0.03 0.00 -1.64 0.00 0.00 33.01 28.76 2k6q s GLN 77 CO 0.91 -0.62 -0.11 0.00 0.50 0.00 0.00 175.29 175.97 2k6q s ALA 78 N -1.29 2.79 -0.04 1.58 0.00 -1.26 -4.73 121.76 118.82 2k6q s ALA 78 Ca 0.60 -0.94 -0.03 0.00 0.00 0.00 0.00 51.96 51.59 2k6q s ALA 78 Cb -0.38 -1.08 0.02 0.00 0.00 0.00 0.00 23.12 21.68 2k6q s ALA 78 CO 0.48 0.56 0.09 0.12 0.00 0.00 0.00 175.76 177.01 2k6q s PHE 79 N -0.74 -0.09 -0.05 0.00 5.36 -1.26 -4.07 117.98 117.12 2k6q s PHE 79 Ca 0.11 0.26 -0.03 0.00 -0.96 0.00 0.00 56.93 56.31 2k6q s PHE 79 Cb -0.11 -0.02 0.02 0.00 -0.34 0.00 0.00 43.02 42.58 2k6q s PHE 79 CO 0.01 -0.07 0.12 -0.06 -1.46 0.00 0.00 175.22 173.76 2k6q s PHE 80 N 0.37 -0.13 -0.36 10.12 0.08 0.89 -4.93 117.98 124.02 2k6q s PHE 80 Ca -0.03 0.38 -0.14 0.00 0.12 0.00 0.00 56.93 57.26 2k6q s PHE 80 Cb -0.04 -0.03 -0.01 0.00 -0.57 0.00 0.00 43.02 42.37 2k6q s PHE 80 CO -0.01 -0.11 0.28 -1.17 -0.10 0.00 0.00 175.22 174.11 2k6q s LEU 81 N 0.62 4.62 -0.44 -0.37 2.96 -1.26 -1.60 118.68 123.20 2k6q s LEU 81 Ca -0.05 -0.48 -0.20 0.00 -0.22 0.00 0.00 54.13 53.19 2k6q s LEU 81 Cb -0.06 -2.19 0.03 0.00 0.50 0.00 0.00 46.19 44.46 2k6q s LEU 81 CO -0.03 -0.31 0.62 -0.76 -1.32 0.00 0.00 176.35 174.56 2k6q s LEU 82 N 1.79 4.57 -0.43 -0.68 2.01 0.22 -4.14 118.68 122.02 2k6q s LEU 82 Ca 0.07 -0.42 -0.29 0.00 0.01 0.00 0.00 54.13 53.51 2k6q s LEU 82 Cb -0.17 -2.67 0.03 0.00 0.01 0.00 0.00 46.19 43.38 2k6q s LEU 82 CO 0.11 -0.77 1.10 -0.69 1.01 0.00 0.00 176.35 177.11 2k6q s VAL 83 N 2.74 4.31 0.00 -1.59 1.01 0.51 -0.21 120.40 127.17 2k6q s VAL 83 Ca 0.21 1.33 0.00 0.00 0.00 0.00 0.00 61.98 63.52 2k6q s VAL 83 Cb -0.15 -4.54 0.00 0.00 0.00 0.00 0.00 36.38 31.69 2k6q s VAL 83 CO 0.18 -0.85 0.00 0.59 0.00 0.00 0.00 175.10 175.02 2k6q n ASN 84 N 7.53 -3.87 0.00 3.32 3.02 -0.54 -1.28 115.26 123.43 2k6q n ASN 84 Ca 0.12 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.67 2k6q n ASN 84 Cb 0.48 -1.97 0.00 0.00 -0.61 0.00 0.00 39.78 37.68 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 -1.06 1.08 3.07 7.41 0.00 -1.16 -4.99 105.19 109.54 2k6q n GLY 85 Ca 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.84 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 0.94 1.10 1.61 -3.43 -0.41 -4.98 115.29 108.12 2k6q s HIS 86 Ca 0.00 -0.26 -0.13 0.00 -0.80 0.00 0.00 55.06 53.87 2k6q s HIS 86 Cb 0.00 -0.58 0.21 0.00 -1.43 0.00 0.00 32.58 30.78 2k6q s HIS 86 CO 0.00 -0.01 0.84 -1.13 -2.00 0.00 0.00 174.74 172.44 2k6q n SER 87 N 2.39 -1.44 -0.46 7.38 3.41 -1.26 0.19 113.62 123.83 2k6q n SER 87 Ca -0.16 -0.00 0.05 0.00 -0.26 0.00 0.00 58.87 58.50 2k6q n SER 87 Cb 0.56 -1.25 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 -4.13 2.83 -1.44 4.33 0.00 -1.26 -4.60 117.12 112.84 2k6q n MET 88 Ca 0.05 -2.02 -0.53 0.00 0.00 0.00 0.00 57.70 55.20 2k6q n MET 88 Cb 0.55 -1.27 -0.05 0.00 0.00 0.00 0.00 33.22 32.44 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 0.02 1.04 -0.77 3.17 3.14 -1.26 -1.20 118.33 122.47 2k6q n VAL 89 Ca 0.10 -0.26 0.00 0.00 -2.96 0.00 0.00 64.34 61.22 2k6q n VAL 89 Cb 0.44 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.22 2k6q n VAL 89 CO 0.00 0.00 0.00 -0.24 -6.46 0.00 0.00 176.83 170.13 2k6q n SER 90 N 1.76 -1.86 -4.21 6.55 2.88 -1.26 -4.90 113.62 112.58 2k6q n SER 90 Ca 0.19 0.00 -0.37 0.00 -1.33 0.00 0.00 58.87 57.36 2k6q n SER 90 Cb 0.17 -0.34 -0.15 0.00 -0.75 0.00 0.00 64.21 63.14 2k6q n SER 90 CO 0.00 0.00 0.00 0.55 -1.23 0.00 0.00 175.04 174.36 2k6q n VAL 91 N -2.72 0.00 -1.18 2.46 3.14 -0.34 -4.61 118.33 115.07 2k6q n VAL 91 Ca 0.00 -0.03 0.02 0.00 -2.96 0.00 0.00 64.34 61.37 2k6q n VAL 91 Cb 0.04 -0.43 0.03 0.00 -1.06 0.00 0.00 33.84 32.42 2k6q n VAL 91 CO 0.00 0.00 0.00 -1.20 -6.46 0.00 0.00 176.83 169.17 2k6q n SER 92 N 9.49 0.84 -4.12 6.55 7.64 -1.26 -4.94 113.62 127.82 2k6q n SER 92 Ca 0.62 -1.95 -0.21 0.00 1.01 0.00 0.00 58.87 58.34 2k6q n SER 92 Cb 0.04 -0.16 -0.14 0.00 -1.01 0.00 0.00 64.21 62.94 2k6q n SER 92 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2k6q s THR 93 N -0.78 1.07 0.37 0.44 2.01 -1.26 -5.12 115.64 112.37 2k6q s THR 93 Ca 0.07 -0.80 -0.25 0.00 0.31 0.00 0.00 61.69 61.01 2k6q s THR 93 Cb 0.06 -0.94 -0.09 0.00 0.01 0.00 0.00 72.50 71.54 2k6q s THR 93 CO 0.01 0.12 1.06 -2.16 -0.69 0.00 0.00 174.62 172.96 2k6q s PRO 94 N -0.78 4.28 0.66 4.92 0.04 -1.26 -2.97 135.00 139.89 2k6q s PRO 94 Ca 0.03 1.58 0.32 0.00 0.04 0.00 0.00 61.00 62.97 2k6q s PRO 94 Cb -0.07 -2.70 1.75 0.00 0.04 0.00 0.00 34.50 33.52 2k6q s PRO 94 CO 0.00 -0.05 2.00 0.97 0.04 0.00 0.00 177.00 179.96 2k6q h ILE 95 N 2.41 0.06 -0.47 0.56 2.10 -1.79 0.51 117.51 120.89 2k6q h ILE 95 Ca -0.48 0.00 -0.11 0.00 1.08 0.00 0.00 64.86 65.36 2k6q h ILE 95 Cb 1.21 0.73 -0.02 0.00 -1.09 0.00 0.00 36.82 37.65 2k6q h ILE 95 CO 0.63 0.00 -0.13 0.77 -1.08 0.00 0.00 178.15 178.34 2k6q h SER 96 N 0.00 0.87 0.00 2.19 4.64 -1.90 -2.37 113.55 116.99 2k6q h SER 96 Ca 0.02 -0.28 -0.18 0.00 -0.47 0.00 0.00 61.79 60.88 2k6q h SER 96 Cb 0.59 -0.24 -0.03 0.00 -0.31 0.00 0.00 62.40 62.41 2k6q h SER 96 CO -0.00 1.01 -1.08 -0.33 -0.87 0.00 0.00 176.83 175.56 2k6q h GLU 97 N 0.78 0.00 -1.23 4.77 5.08 -0.51 -3.08 114.58 120.39 2k6q h GLU 97 Ca 0.12 0.00 0.41 0.00 -1.00 0.00 0.00 59.36 58.89 2k6q h GLU 97 Cb 0.65 0.00 -0.13 0.00 0.50 0.00 0.00 28.75 29.77 2k6q h GLU 97 CO 0.05 0.83 0.78 0.28 -1.00 0.00 0.00 179.01 179.94 2k6q h VAL 98 N -1.00 0.16 0.13 3.13 2.07 -0.78 1.78 116.25 121.75 2k6q h VAL 98 Ca -0.28 -0.04 -0.28 0.00 0.82 0.00 0.00 66.70 66.91 2k6q h VAL 98 Cb 1.15 0.02 0.02 0.00 -1.52 0.00 0.00 31.29 30.96 2k6q h VAL 98 CO -0.17 0.02 -1.24 0.22 0.02 0.00 0.00 177.57 176.43 2k6q h TYR 99 N 0.13 0.74 0.00 1.57 5.03 -1.57 -2.40 116.97 120.46 2k6q h TYR 99 Ca 0.79 -0.49 0.00 0.00 2.58 0.00 0.00 58.73 61.61 2k6q h TYR 99 Cb 2.35 -0.05 0.00 0.00 1.55 0.00 0.00 36.73 40.59 2k6q h TYR 99 CO -0.01 1.36 0.00 -0.85 -1.32 0.00 0.00 178.16 177.34 2k6q n GLU 100 N -3.67 0.58 -0.04 1.82 0.28 0.51 0.87 120.64 120.99 2k6q n GLU 100 Ca -0.11 0.01 0.02 0.00 -0.16 0.00 0.00 57.16 56.92 2k6q n GLU 100 Cb 1.00 -1.50 0.04 0.00 1.43 0.00 0.00 31.44 32.41 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 -1.20 1.94 0.02 -1.84 7.64 0.42 -4.76 113.62 115.83 2k6q n SER 101 Ca 0.17 -1.66 0.00 0.00 1.01 0.00 0.00 58.87 58.39 2k6q n SER 101 Cb 0.20 -0.05 0.00 0.00 -1.01 0.00 0.00 64.21 63.35 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 0.04 0.00 -0.95 1.43 -0.58 -0.91 -5.01 120.64 114.66 2k6q n GLU 102 Ca 0.04 0.00 -0.31 0.00 -0.42 0.00 0.00 57.16 56.47 2k6q n GLU 102 Cb 0.23 -0.11 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 -2.72 0.00 -3.79 3.49 -4.01 0.25 -4.97 116.66 104.91 2k6q n ARG 103 Ca 0.00 0.00 -0.26 0.00 -1.04 0.00 0.00 57.85 56.55 2k6q n ARG 103 Cb 0.10 -0.81 -0.00 0.00 -3.04 0.00 0.00 32.46 28.71 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 2.29 2.73 -0.36 2.89 9.92 -1.26 -4.91 116.55 127.85 2k6q n ASP 104 Ca 0.04 -2.85 -0.00 0.00 -0.53 0.00 0.00 54.79 51.45 2k6q n ASP 104 Cb 0.40 -0.03 0.05 0.00 -0.64 0.00 0.00 41.12 40.91 2k6q n ASP 104 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 2k6q n GLU 105 N -1.73 -0.20 -0.27 -1.24 1.02 -1.26 0.15 120.64 117.10 2k6q n GLU 105 Ca -0.03 1.44 0.03 0.00 -0.02 0.00 0.00 57.16 58.58 2k6q n GLU 105 Cb 0.61 -2.14 0.11 0.00 -0.02 0.00 0.00 31.44 29.99 2k6q n GLU 105 CO 0.00 0.00 0.00 0.38 1.18 0.00 0.00 177.13 178.69 2k6q h ASP 106 N 0.00 -0.66 0.00 1.62 2.03 -1.95 -3.45 116.42 114.01 2k6q h ASP 106 Ca 0.34 0.23 0.00 0.00 -0.73 0.00 0.00 57.03 56.87 2k6q h ASP 106 Cb 0.58 0.46 0.00 0.00 -0.83 0.00 0.00 39.33 39.54 2k6q h ASP 106 CO -0.93 -0.25 0.00 0.61 -1.03 0.00 0.00 179.24 177.64 2k6q n GLY 107 N -1.49 1.44 3.27 7.15 0.00 0.39 -4.74 105.19 111.19 2k6q n GLY 107 Ca 0.12 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.82 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 2.59 0.28 1.61 2.19 -1.26 -4.74 117.98 116.66 2k6q s PHE 108 Ca 0.00 -0.88 -0.28 0.00 0.33 0.00 0.00 56.93 56.10 2k6q s PHE 108 Cb 0.00 -1.71 -0.09 0.00 -1.31 0.00 0.00 43.02 39.90 2k6q s PHE 108 CO 0.00 -0.32 0.99 -0.51 1.83 0.00 0.00 175.22 177.20 2k6q s LEU 109 N 0.22 4.50 -0.25 6.12 2.01 -1.13 -4.15 118.68 125.99 2k6q s LEU 109 Ca -0.14 2.00 0.01 0.00 0.01 0.00 0.00 54.13 56.01 2k6q s LEU 109 Cb -0.17 -3.77 0.07 0.00 0.01 0.00 0.00 46.19 42.33 2k6q s LEU 109 CO 0.07 -0.03 -0.02 -0.31 1.01 0.00 0.00 176.35 177.08 2k6q s TYR 110 N -1.33 2.37 -0.02 0.29 2.02 -1.26 0.16 117.35 119.58 2k6q s TYR 110 Ca 0.46 -1.84 0.03 0.00 -0.37 0.00 0.00 57.07 55.35 2k6q s TYR 110 Cb -0.25 -1.71 -0.00 0.00 -0.40 0.00 0.00 41.96 39.59 2k6q s TYR 110 CO 0.32 -0.80 -0.10 -1.64 -1.57 0.00 0.00 175.55 171.75 2k6q s MET 111 N 1.40 1.01 -0.14 -0.62 -1.94 -0.91 -1.47 119.30 116.63 2k6q s MET 111 Ca -0.02 -0.36 -0.06 0.00 -1.71 0.00 0.00 55.69 53.54 2k6q s MET 111 Cb -0.19 -0.95 -0.04 0.00 2.01 0.00 0.00 34.83 35.67 2k6q s MET 111 CO -0.09 0.17 0.06 0.08 -0.01 0.00 0.00 175.02 175.23 2k6q s VAL 112 N 0.02 4.81 0.01 -6.03 1.01 0.71 -2.11 120.40 118.81 2k6q s VAL 112 Ca -0.01 -0.04 0.04 0.00 0.00 0.00 0.00 61.98 61.98 2k6q s VAL 112 Cb -0.07 -3.11 -0.03 0.00 0.00 0.00 0.00 36.38 33.16 2k6q s VAL 112 CO 0.00 0.53 -0.11 -0.72 0.00 0.00 0.00 175.10 174.80 2k6q s TYR 113 N -0.23 2.76 0.37 5.22 -0.85 -0.63 0.70 117.35 124.69 2k6q s TYR 113 Ca 0.08 -0.12 -0.12 0.00 -0.52 0.00 0.00 57.07 56.39 2k6q s TYR 113 Cb -0.12 -1.57 0.04 0.00 0.38 0.00 0.00 41.96 40.69 2k6q s TYR 113 CO 0.01 0.31 0.70 0.00 -1.52 0.00 0.00 175.55 175.06 2k6q s ALA 114 N -0.94 -0.35 -0.90 9.51 0.00 -0.63 -2.56 121.76 125.89 2k6q s ALA 114 Ca 0.16 -0.94 0.07 0.00 0.00 0.00 0.00 51.96 51.24 2k6q s ALA 114 Cb -0.11 0.81 0.35 0.00 0.00 0.00 0.00 23.12 24.18 2k6q s ALA 114 CO 0.06 -0.93 1.09 0.45 0.00 0.00 0.00 175.76 176.42 2k6q n SER 115 N -1.37 2.87 -3.75 0.00 2.88 -1.26 -0.07 113.62 112.92 2k6q n SER 115 Ca -0.06 -2.34 -0.13 0.00 -1.33 0.00 0.00 58.87 55.01 2k6q n SER 115 Cb 0.60 -0.52 -0.08 0.00 -0.75 0.00 0.00 64.21 63.46 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 -1.74 0.70 0.00 -1.46 0.74 -1.26 -4.55 119.66 112.08 2k6q s GLN 116 Ca 0.24 -0.20 0.00 0.00 0.05 0.00 0.00 55.36 55.45 2k6q s GLN 116 Cb 0.17 0.31 0.00 0.00 1.10 0.00 0.00 33.01 34.59 2k6q s GLN 116 CO 0.08 -0.20 0.33 -1.91 -0.55 0.00 0.00 175.29 173.05 2k6q n GLU 117 N 1.20 0.37 -2.85 1.67 2.13 -1.26 -4.64 120.64 117.26 2k6q n GLU 117 Ca -0.21 -0.33 -0.17 0.00 0.66 0.00 0.00 57.16 57.11 2k6q n GLU 117 Cb 0.56 -0.81 -0.00 0.00 0.27 0.00 0.00 31.44 31.46 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 -0.15 1.12 0.03 6.31 -2.24 -1.26 -4.77 114.28 113.31 2k6q n THR 118 Ca 0.00 -4.22 0.05 0.00 -2.27 0.00 0.00 64.05 57.62 2k6q n THR 118 Cb 0.04 -0.23 -0.09 0.00 -2.10 0.00 0.00 70.33 67.94 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 -0.04 0.60 0.00 4.78 -1.74 -1.26 -5.27 117.46 114.52 2k6q n PHE 119 Ca 0.22 0.19 0.00 0.00 -0.56 0.00 0.00 57.45 57.30 2k6q n PHE 119 Cb 0.68 -0.88 0.00 0.00 1.52 0.00 0.00 39.48 40.81 2k6q n PHE 119 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61