#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k6q n MET 1 N 0.00 -2.51 0.09 -1.46 3.85 -1.26 -4.74 117.12 111.10 2k6q n MET 1 Ca 0.00 1.96 -0.06 0.00 -1.00 0.00 0.00 57.70 58.60 2k6q n MET 1 Cb 0.00 -3.08 -0.03 0.00 -1.05 0.00 0.00 33.22 29.06 2k6q n MET 1 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 175.97 174.97 2k6q h PRO 2 N -1.33 -0.31 -6.00 3.17 0.13 -2.08 -3.46 132.00 122.11 2k6q h PRO 2 Ca -0.11 0.02 -0.56 0.00 -0.87 0.00 0.00 66.00 64.48 2k6q h PRO 2 Cb 1.19 0.07 0.23 0.00 0.13 0.00 0.00 31.00 32.63 2k6q h PRO 2 CO 0.05 -0.16 -1.76 0.45 -0.23 0.00 0.00 178.00 176.35 2k6q n SER 3 N -4.99 -5.69 -4.37 1.44 2.88 -1.26 -4.99 113.62 96.64 2k6q n SER 3 Ca -0.05 0.25 -0.20 0.00 -1.33 0.00 0.00 58.87 57.54 2k6q n SER 3 Cb 0.15 -0.77 -0.10 0.00 -0.75 0.00 0.00 64.21 62.74 2k6q n SER 3 CO 0.00 0.00 0.00 -1.83 -1.23 0.00 0.00 175.04 171.98 2k6q s GLU 4 N -1.85 1.40 0.47 -1.46 -1.05 -1.26 -5.10 118.70 109.84 2k6q s GLU 4 Ca 0.43 -1.59 -0.07 0.00 -0.15 0.00 0.00 54.97 53.59 2k6q s GLU 4 Cb -0.23 -1.31 0.10 0.00 -0.44 0.00 0.00 34.13 32.26 2k6q s GLU 4 CO 0.80 0.23 0.24 1.63 0.95 0.00 0.00 175.26 179.11 2k6q n LYS 5 N -0.30 -1.47 -4.39 -4.83 5.02 -1.26 -5.02 118.16 105.90 2k6q n LYS 5 Ca -0.08 -0.40 -0.25 0.00 -2.02 0.00 0.00 58.31 55.56 2k6q n LYS 5 Cb 0.60 -0.65 -0.11 0.00 -0.02 0.00 0.00 35.03 34.84 2k6q n LYS 5 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2k6q s THR 6 N -1.23 2.16 0.61 -0.18 -4.23 -1.26 -4.80 115.64 106.71 2k6q s THR 6 Ca 0.18 -2.02 0.26 0.00 -1.18 0.00 0.00 61.69 58.93 2k6q s THR 6 Cb -0.03 -2.03 0.36 0.00 1.34 0.00 0.00 72.50 72.13 2k6q s THR 6 CO 0.15 -0.21 1.54 -0.26 -0.54 0.00 0.00 174.62 175.30 2k6q h PHE 7 N 3.15 0.00 0.08 3.99 -1.00 -1.95 1.85 116.94 123.05 2k6q h PHE 7 Ca -0.44 0.00 -0.24 0.00 2.81 0.00 0.00 57.97 60.10 2k6q h PHE 7 Cb 1.21 0.00 0.02 0.00 3.61 0.00 0.00 35.95 40.79 2k6q h PHE 7 CO 0.70 0.00 -0.99 1.57 -1.61 0.00 0.00 178.31 177.98 2k6q h LYS 8 N 0.00 0.53 0.00 1.51 2.10 -1.94 -3.22 116.57 115.55 2k6q h LYS 8 Ca 0.33 -0.68 0.00 0.00 -2.00 0.00 0.00 60.65 58.30 2k6q h LYS 8 Cb 2.09 0.22 0.00 0.00 -0.90 0.00 0.00 32.23 33.63 2k6q h LYS 8 CO -0.00 1.28 -0.27 1.96 -2.00 0.00 0.00 179.45 180.42 2k6q h GLN 9 N 0.08 0.00 0.00 0.07 4.20 0.17 -3.41 115.11 116.23 2k6q h GLN 9 Ca -0.15 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.56 2k6q h GLN 9 Cb 1.70 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.48 2k6q h GLN 9 CO 0.19 0.00 0.00 -2.13 -0.67 0.00 0.00 178.83 176.22 2k6q n ARG 10 N -3.73 0.00 -1.77 1.46 3.00 0.50 -4.35 116.66 111.77 2k6q n ARG 10 Ca -0.04 0.68 -0.41 0.00 -0.00 0.00 0.00 57.85 58.08 2k6q n ARG 10 Cb 0.14 -1.16 -0.01 0.00 0.00 0.00 0.00 32.46 31.44 2k6q n ARG 10 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.63 178.66 2k6q s ARG 11 N -1.90 4.10 -0.11 -0.14 3.00 -1.21 -4.88 118.95 117.81 2k6q s ARG 11 Ca 0.00 2.60 -0.29 0.00 0.00 0.00 0.00 55.73 58.04 2k6q s ARG 11 Cb 0.00 -2.99 -0.05 0.00 0.00 0.00 0.00 34.95 31.91 2k6q s ARG 11 CO 0.00 -0.60 1.82 -1.12 0.00 0.00 0.00 175.30 175.40 2k6q s SER 12 N 0.19 6.32 0.17 0.23 0.01 -1.26 -4.68 113.70 114.68 2k6q s SER 12 Ca 0.58 2.11 -0.28 0.00 1.31 0.00 0.00 55.95 59.67 2k6q s SER 12 Cb -0.48 -2.53 -0.01 0.00 0.21 0.00 0.00 66.02 63.22 2k6q s SER 12 CO 0.56 -1.23 1.55 0.15 0.41 0.00 0.00 173.24 174.67 2k6q h PHE 13 N 11.11 -1.65 -0.97 2.43 3.57 -1.85 1.40 116.94 130.97 2k6q h PHE 13 Ca -0.41 0.11 0.24 0.00 3.53 0.00 0.00 57.97 61.45 2k6q h PHE 13 Cb 1.20 0.84 -0.07 0.00 2.79 0.00 0.00 35.95 40.71 2k6q h PHE 13 CO 0.92 -0.40 0.65 0.93 -2.23 0.00 0.00 178.31 178.18 2k6q h GLU 14 N -0.08 0.31 -0.04 1.11 4.39 -1.97 0.76 114.58 119.05 2k6q h GLU 14 Ca 0.18 -0.02 -0.22 0.00 0.34 0.00 0.00 59.36 59.64 2k6q h GLU 14 Cb 0.49 -0.07 0.01 0.00 -0.10 0.00 0.00 28.75 29.07 2k6q h GLU 14 CO -0.87 0.21 -0.89 0.37 -1.16 0.00 0.00 179.01 176.67 2k6q h GLN 15 N 0.32 0.52 0.00 2.33 5.75 0.12 -2.50 115.11 121.65 2k6q h GLN 15 Ca 0.51 -0.50 0.00 0.00 -0.15 0.00 0.00 58.65 58.51 2k6q h GLN 15 Cb 1.43 0.13 0.00 0.00 1.07 0.00 0.00 27.48 30.11 2k6q h GLN 15 CO -0.18 1.14 0.00 -0.09 -2.65 0.00 0.00 178.83 177.05 2k6q h ARG 16 N 0.31 0.00 0.03 1.69 2.43 0.47 -3.24 114.38 116.08 2k6q h ARG 16 Ca -0.07 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.09 2k6q h ARG 16 Cb 1.51 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 31.06 2k6q h ARG 16 CO 0.16 0.00 -0.01 0.28 -1.51 0.00 0.00 179.97 178.89 2k6q h VAL 17 N 0.00 0.00 -1.66 0.20 2.07 0.40 -3.29 116.25 113.96 2k6q h VAL 17 Ca 0.00 -0.93 0.50 0.00 0.82 0.00 0.00 66.70 67.08 2k6q h VAL 17 Cb 0.68 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 30.36 2k6q h VAL 17 CO 0.00 0.00 1.17 1.05 0.02 0.00 0.00 177.57 179.81 2k6q h GLU 18 N -0.98 0.02 0.37 1.57 4.11 -1.52 0.22 114.58 118.37 2k6q h GLU 18 Ca -0.00 -0.00 -0.02 0.00 0.07 0.00 0.00 59.36 59.41 2k6q h GLU 18 Cb 0.03 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.27 2k6q h GLU 18 CO 0.01 0.01 -0.25 0.22 0.07 0.00 0.00 179.01 179.08 2k6q h ASP 19 N 0.02 -0.63 -0.65 3.06 -0.00 -1.63 -2.09 116.42 114.50 2k6q h ASP 19 Ca 0.85 0.04 0.13 0.00 -0.00 0.00 0.00 57.03 58.04 2k6q h ASP 19 Cb 3.20 0.19 -0.10 0.00 -0.00 0.00 0.00 39.33 42.62 2k6q h ASP 19 CO -0.13 -0.37 0.13 1.62 -0.00 0.00 0.00 179.24 180.49 2k6q h VAL 20 N -0.58 0.58 -1.14 2.25 3.04 -0.70 0.33 116.25 120.01 2k6q h VAL 20 Ca -0.05 -0.08 0.36 0.00 -1.01 0.00 0.00 66.70 65.91 2k6q h VAL 20 Cb 0.47 0.31 -0.13 0.00 -2.01 0.00 0.00 31.29 29.94 2k6q h VAL 20 CO 0.04 0.04 0.71 -0.09 -1.01 0.00 0.00 177.57 177.27 2k6q h ARG 21 N 0.24 0.23 0.38 4.17 1.12 -1.02 1.06 114.38 120.57 2k6q h ARG 21 Ca 0.35 -0.01 -0.02 0.00 -1.11 0.00 0.00 59.98 59.19 2k6q h ARG 21 Cb 0.55 -0.05 0.00 0.00 -0.01 0.00 0.00 29.97 30.47 2k6q h ARG 21 CO -0.46 0.15 -0.18 -0.07 -3.11 0.00 0.00 179.97 176.30 2k6q h LEU 22 N 0.23 -0.44 -2.04 3.80 3.38 0.35 0.42 115.31 121.01 2k6q h LEU 22 Ca 0.74 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.72 2k6q h LEU 22 Cb 2.02 0.11 0.00 0.00 0.09 0.00 0.00 40.66 42.88 2k6q h LEU 22 CO -0.45 -0.27 0.10 0.40 0.09 0.00 0.00 178.44 178.31 2k6q h ILE 23 N -0.60 0.00 0.06 1.22 5.03 -0.93 1.33 117.51 123.61 2k6q h ILE 23 Ca -0.05 0.00 -0.24 0.00 -0.12 0.00 0.00 64.86 64.45 2k6q h ILE 23 Cb 0.40 0.68 -0.00 0.00 -3.03 0.00 0.00 36.82 34.86 2k6q h ILE 23 CO 0.09 0.00 -1.07 0.03 -0.68 0.00 0.00 178.15 176.52 2k6q h ARG 24 N 0.00 0.23 -0.00 2.37 2.47 0.15 0.87 114.38 120.47 2k6q h ARG 24 Ca 0.00 -0.33 0.00 0.00 -1.26 0.00 0.00 59.98 58.39 2k6q h ARG 24 Cb 0.21 0.11 0.00 0.00 -1.65 0.00 0.00 29.97 28.64 2k6q h ARG 24 CO 0.00 1.10 -0.93 -0.85 0.56 0.00 0.00 179.97 179.85 2k6q n GLU 25 N -3.57 0.39 -0.09 0.04 0.28 0.12 -3.87 120.64 113.94 2k6q n GLU 25 Ca -0.06 -0.05 -0.16 0.00 -0.16 0.00 0.00 57.16 56.74 2k6q n GLU 25 Cb 0.93 -1.45 -0.07 0.00 1.43 0.00 0.00 31.44 32.28 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 -1.41 0.39 -3.54 3.44 6.02 0.41 -4.81 117.38 117.88 2k6q n GLN 26 Ca 0.04 0.14 -0.27 0.00 -0.01 0.00 0.00 57.00 56.90 2k6q n GLN 26 Cb 0.32 -1.20 -0.09 0.00 1.02 0.00 0.00 30.24 30.28 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 -3.46 2.51 0.16 1.08 8.25 0.30 -4.88 115.22 119.18 2k6q n HIS 27 Ca -0.32 -4.04 0.04 0.00 -0.26 0.00 0.00 57.72 53.14 2k6q n HIS 27 Cb 0.77 -0.47 0.21 0.00 1.12 0.00 0.00 29.99 31.63 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 4.68 0.00 -0.68 -0.41 0.13 -1.64 -2.85 132.00 131.23 2k6q h PRO 28 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 2k6q h PRO 28 Cb 0.75 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.88 2k6q h PRO 28 CO 0.70 0.46 0.00 0.25 -0.23 0.00 0.00 178.00 179.18 2k6q n THR 29 N -3.43 0.91 -4.31 1.56 -2.24 -1.26 -4.84 114.28 100.67 2k6q n THR 29 Ca 0.00 -0.52 -0.16 0.00 -2.27 0.00 0.00 64.05 61.10 2k6q n THR 29 Cb 0.60 -0.24 -0.10 0.00 -2.10 0.00 0.00 70.33 68.49 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 -1.68 1.25 -0.26 -0.78 -0.14 -1.08 -3.49 119.74 113.58 2k6q s LYS 30 Ca 0.21 -1.61 -0.04 0.00 -1.36 0.00 0.00 55.97 53.17 2k6q s LYS 30 Cb 0.15 -0.63 0.01 0.00 -1.68 0.00 0.00 37.83 35.67 2k6q s LYS 30 CO 0.08 -0.04 0.00 0.42 -0.76 0.00 0.00 175.35 175.06 2k6q s ILE 31 N -3.38 3.51 0.27 2.17 -1.09 0.64 -4.87 121.20 118.45 2k6q s ILE 31 Ca 0.25 -0.68 -0.30 0.00 -2.23 0.00 0.00 60.65 57.69 2k6q s ILE 31 Cb 0.05 -2.72 -0.09 0.00 -1.58 0.00 0.00 42.46 38.11 2k6q s ILE 31 CO 0.06 0.24 1.08 -2.16 -1.23 0.00 0.00 174.94 172.93 2k6q s PRO 32 N 1.45 4.67 0.13 2.79 0.04 -1.26 -1.87 135.00 140.95 2k6q s PRO 32 Ca 0.03 1.77 -0.07 0.00 0.04 0.00 0.00 61.00 62.76 2k6q s PRO 32 Cb -0.16 -3.20 -0.01 0.00 0.04 0.00 0.00 34.50 31.17 2k6q s PRO 32 CO -0.01 0.25 0.20 0.14 0.04 0.00 0.00 177.00 177.62 2k6q s VAL 33 N -1.16 0.11 -0.19 -0.36 -7.23 -1.07 -3.50 120.40 107.00 2k6q s VAL 33 Ca 0.44 -1.39 -0.01 0.00 -1.81 0.00 0.00 61.98 59.21 2k6q s VAL 33 Cb -0.31 -1.65 0.05 0.00 0.56 0.00 0.00 36.38 35.03 2k6q s VAL 33 CO 0.40 -0.49 -0.02 -0.63 -0.31 0.00 0.00 175.10 174.05 2k6q s ILE 34 N -3.93 0.95 -0.13 -0.62 -1.09 0.53 -2.83 121.20 114.09 2k6q s ILE 34 Ca 0.13 -0.71 -0.04 0.00 -2.23 0.00 0.00 60.65 57.79 2k6q s ILE 34 Cb 0.05 -1.28 -0.03 0.00 -1.58 0.00 0.00 42.46 39.61 2k6q s ILE 34 CO -0.05 -0.05 0.01 -0.63 -1.23 0.00 0.00 174.94 172.99 2k6q s ILE 35 N 1.68 4.34 0.10 2.92 -1.09 0.14 -0.54 121.20 128.74 2k6q s ILE 35 Ca -0.01 -0.22 -0.18 0.00 -2.23 0.00 0.00 60.65 58.01 2k6q s ILE 35 Cb -0.17 -2.88 0.04 0.00 -1.58 0.00 0.00 42.46 37.87 2k6q s ILE 35 CO -0.07 0.54 0.43 -1.83 -1.23 0.00 0.00 174.94 172.78 2k6q s GLU 36 N -0.25 1.04 0.57 2.79 1.03 -0.96 -4.18 118.70 118.75 2k6q s GLU 36 Ca 0.06 -0.55 -0.19 0.00 0.03 0.00 0.00 54.97 54.31 2k6q s GLU 36 Cb -0.12 0.46 -0.04 0.00 -0.80 0.00 0.00 34.13 33.63 2k6q s GLU 36 CO 0.02 -0.40 1.19 -0.98 -1.33 0.00 0.00 175.26 173.76 2k6q s ARG 37 N -3.33 3.11 0.36 -4.83 1.70 -1.26 -2.74 118.95 111.97 2k6q s ARG 37 Ca -0.00 1.79 -0.27 0.00 -0.47 0.00 0.00 55.73 56.77 2k6q s ARG 37 Cb 0.01 -1.98 -0.10 0.00 -0.57 0.00 0.00 34.95 32.31 2k6q s ARG 37 CO -0.09 -1.08 1.28 -0.47 -1.08 0.00 0.00 175.30 173.87 2k6q s TYR 38 N -1.62 2.99 -0.74 5.89 6.14 -1.11 -4.82 117.35 124.08 2k6q s TYR 38 Ca 0.75 1.44 -0.25 0.00 0.64 0.00 0.00 57.07 59.65 2k6q s TYR 38 Cb -0.29 -3.64 -0.14 0.00 0.42 0.00 0.00 41.96 38.31 2k6q s TYR 38 CO 0.32 -1.84 2.41 1.63 0.64 0.00 0.00 175.55 178.71 2k6q n LYS 39 N 0.52 0.62 0.00 4.97 5.02 -1.26 0.88 118.16 128.91 2k6q n LYS 39 Ca 0.02 -0.52 0.00 0.00 -2.02 0.00 0.00 58.31 55.79 2k6q n LYS 39 Cb 0.43 -3.31 0.00 0.00 -0.02 0.00 0.00 35.03 32.13 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 6.47 1.62 3.18 0.72 0.00 -1.26 -5.07 105.19 110.85 2k6q n GLY 40 Ca 0.47 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 46.12 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 -0.01 2.28 -0.08 1.61 2.56 0.26 -4.86 118.70 120.45 2k6q s GLU 41 Ca 0.00 -1.58 0.08 0.00 0.00 0.00 0.00 54.97 53.48 2k6q s GLU 41 Cb 0.00 -3.54 -0.12 0.00 2.00 0.00 0.00 34.13 32.47 2k6q s GLU 41 CO 0.00 -0.92 0.06 0.36 -0.56 0.00 0.00 175.26 174.19 2k6q n LYS 42 N 4.69 2.20 0.00 4.30 -0.00 -1.26 -4.58 118.16 123.51 2k6q n LYS 42 Ca -0.07 -0.02 0.00 0.00 -0.00 0.00 0.00 58.31 58.22 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 -2.27 0.00 -1.01 -1.58 1.13 -1.26 -4.49 117.38 107.91 2k6q n GLN 43 Ca -0.13 0.62 -0.34 0.00 -1.94 0.00 0.00 57.00 55.21 2k6q n GLN 43 Cb 0.72 -1.09 0.11 0.00 0.11 0.00 0.00 30.24 30.09 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 -1.60 1.75 -4.80 1.08 4.77 -1.26 -4.97 117.00 111.98 2k6q n LEU 44 Ca 0.00 0.49 -0.30 0.00 -0.03 0.00 0.00 56.01 56.17 2k6q n LEU 44 Cb 0.00 -1.32 0.10 0.00 -2.33 0.00 0.00 43.42 39.87 2k6q n LEU 44 CO 0.00 -2.79 0.71 -2.16 -1.33 0.00 0.00 177.39 171.82 2k6q s PRO 45 N -3.62 1.79 0.18 3.23 0.04 -1.26 -5.00 135.00 130.36 2k6q s PRO 45 Ca 0.65 0.52 -0.30 0.00 0.04 0.00 0.00 61.00 61.91 2k6q s PRO 45 Cb -0.27 -1.89 -0.08 0.00 0.04 0.00 0.00 34.50 32.29 2k6q s PRO 45 CO 0.59 -1.80 1.11 0.08 0.04 0.00 0.00 177.00 177.02 2k6q s VAL 46 N -3.20 3.80 0.36 -0.36 1.01 -1.26 -4.99 120.40 115.76 2k6q s VAL 46 Ca 0.62 1.56 -0.28 0.00 0.00 0.00 0.00 61.98 63.88 2k6q s VAL 46 Cb -0.14 -4.00 -0.10 0.00 0.00 0.00 0.00 36.38 32.14 2k6q s VAL 46 CO 0.54 0.27 1.33 -0.22 0.00 0.00 0.00 175.10 177.02 2k6q s LEU 47 N -0.42 4.35 0.28 3.92 1.98 -1.26 -4.88 118.68 122.65 2k6q s LEU 47 Ca 0.50 2.72 -0.01 0.00 -2.89 0.00 0.00 54.13 54.45 2k6q s LEU 47 Cb -0.30 -3.73 0.63 0.00 0.66 0.00 0.00 46.19 43.45 2k6q s LEU 47 CO 0.36 -0.67 1.62 -0.78 -1.89 0.00 0.00 176.35 174.98 2k6q h ASP 48 N 3.12 -0.26 -3.50 3.68 -0.00 -1.94 -3.43 116.42 114.08 2k6q h ASP 48 Ca -0.49 0.22 -0.24 0.00 -0.00 0.00 0.00 57.03 56.51 2k6q h ASP 48 Cb 1.23 0.36 -0.06 0.00 -0.00 0.00 0.00 39.33 40.86 2k6q h ASP 48 CO 0.64 -0.22 -0.19 2.29 -0.00 0.00 0.00 179.24 181.76 2k6q n LYS 49 N -5.35 0.38 -0.00 0.28 0.00 -1.26 -5.06 118.16 107.16 2k6q n LYS 49 Ca 0.19 -2.02 0.02 0.00 -0.00 0.00 0.00 58.31 56.50 2k6q n LYS 49 Cb 0.63 1.81 -0.02 0.00 -0.00 0.00 0.00 35.03 37.46 2k6q n LYS 49 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.40 179.81 2k6q n THR 50 N -0.40 0.00 -4.75 0.58 -1.04 -1.26 -4.83 114.28 102.58 2k6q n THR 50 Ca 0.03 -0.42 -0.33 0.00 -2.04 0.00 0.00 64.05 61.28 2k6q n THR 50 Cb 0.40 1.00 -0.14 0.00 -1.82 0.00 0.00 70.33 69.77 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 -1.31 3.20 0.03 -2.82 1.02 -1.26 -0.69 119.74 117.92 2k6q s LYS 51 Ca 0.01 -0.66 0.02 0.00 0.02 0.00 0.00 55.97 55.36 2k6q s LYS 51 Cb 0.02 -2.61 -0.02 0.00 -0.52 0.00 0.00 37.83 34.70 2k6q s LYS 51 CO 0.13 0.33 -0.06 -0.06 -0.92 0.00 0.00 175.35 174.77 2k6q s PHE 52 N 0.06 0.55 -0.34 3.18 0.40 -1.13 -4.97 117.98 115.73 2k6q s PHE 52 Ca -0.04 -0.49 0.00 0.00 -0.60 0.00 0.00 56.93 55.80 2k6q s PHE 52 Cb -0.14 -0.34 0.08 0.00 0.51 0.00 0.00 43.02 43.13 2k6q s PHE 52 CO 0.04 -0.11 0.06 -0.51 0.70 0.00 0.00 175.22 175.40 2k6q s LEU 53 N -1.49 4.50 0.12 -0.37 1.43 -1.26 -2.61 118.68 118.99 2k6q s LEU 53 Ca -0.11 -1.78 -0.19 0.00 -1.03 0.00 0.00 54.13 51.01 2k6q s LEU 53 Cb -0.10 -1.70 -0.07 0.00 0.03 0.00 0.00 46.19 44.36 2k6q s LEU 53 CO -0.00 -0.37 0.61 -0.69 0.23 0.00 0.00 176.35 176.13 2k6q s VAL 54 N 1.09 4.70 -0.06 -1.59 1.01 -0.78 -4.88 120.40 119.88 2k6q s VAL 54 Ca 0.03 1.20 -0.30 0.00 0.00 0.00 0.00 61.98 62.91 2k6q s VAL 54 Cb -0.20 -3.89 -0.03 0.00 0.00 0.00 0.00 36.38 32.26 2k6q s VAL 54 CO -0.05 0.44 1.23 -2.16 0.00 0.00 0.00 175.10 174.56 2k6q s PRO 55 N -1.40 4.33 -1.03 2.72 0.04 -1.26 -0.26 135.00 138.15 2k6q s PRO 55 Ca 0.33 1.70 -0.07 0.00 0.04 0.00 0.00 61.00 63.00 2k6q s PRO 55 Cb -0.19 -3.58 -0.11 0.00 0.04 0.00 0.00 34.50 30.66 2k6q s PRO 55 CO 0.20 -0.49 2.72 -0.40 0.04 0.00 0.00 177.00 179.08 2k6q n ASP 56 N 5.36 6.54 -0.87 6.66 3.85 -1.23 -3.04 116.55 133.83 2k6q n ASP 56 Ca 0.11 -2.43 -0.05 0.00 -0.71 0.00 0.00 54.79 51.71 2k6q n ASP 56 Cb 0.46 -1.32 -0.05 0.00 -1.35 0.00 0.00 41.12 38.85 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 3.55 0.00 -2.44 2.11 1.44 -1.26 -4.99 115.22 113.63 2k6q n HIS 57 Ca 0.58 -0.38 0.00 0.00 -2.01 0.00 0.00 57.72 55.91 2k6q n HIS 57 Cb 0.32 0.44 0.00 0.00 0.12 0.00 0.00 29.99 30.87 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 -4.41 0.61 0.24 -1.17 -5.13 118.33 108.48 2k6q n VAL 58 Ca -0.21 0.00 -0.27 0.00 -2.04 0.00 0.00 64.34 61.82 2k6q n VAL 58 Cb 0.61 0.00 -0.11 0.00 -1.47 0.00 0.00 33.84 32.86 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 1.38 3.58 0.64 -1.34 4.22 -1.26 -3.50 114.94 118.66 2k6q s ASN 59 Ca 0.00 -0.83 0.29 0.00 -2.14 0.00 0.00 52.86 50.17 2k6q s ASN 59 Cb 0.00 -0.34 1.54 0.00 1.28 0.00 0.00 41.25 43.73 2k6q s ASN 59 CO 0.00 0.11 1.89 0.00 -2.04 0.00 0.00 177.10 177.06 2k6q h MET 60 N 3.07 0.00 -0.46 3.55 -0.00 -1.57 0.36 114.93 119.88 2k6q h MET 60 Ca -0.46 0.00 -0.02 0.00 -0.00 0.00 0.00 59.70 59.22 2k6q h MET 60 Cb 1.21 0.00 -0.02 0.00 -0.00 0.00 0.00 31.60 32.79 2k6q h MET 60 CO 0.50 0.00 0.21 1.03 -0.00 0.00 0.00 176.91 178.65 2k6q h SER 61 N 0.00 0.58 -0.17 -0.10 0.87 -1.95 -2.52 113.55 110.26 2k6q h SER 61 Ca 0.07 -0.05 0.04 0.00 -1.23 0.00 0.00 61.79 60.61 2k6q h SER 61 Cb 0.86 -0.15 -0.04 0.00 -0.44 0.00 0.00 62.40 62.63 2k6q h SER 61 CO -0.00 0.51 -0.08 -0.33 -0.53 0.00 0.00 176.83 176.40 2k6q h GLU 62 N 0.65 -0.06 -0.87 2.24 5.08 -0.67 -0.19 114.58 120.75 2k6q h GLU 62 Ca 0.16 0.00 0.16 0.00 -1.00 0.00 0.00 59.36 58.68 2k6q h GLU 62 Cb 0.09 0.01 -0.07 0.00 0.50 0.00 0.00 28.75 29.29 2k6q h GLU 62 CO -0.02 -0.04 0.57 1.25 -1.00 0.00 0.00 179.01 179.77 2k6q h LEU 63 N -0.06 0.57 -1.45 1.33 5.85 -1.57 0.76 115.31 120.73 2k6q h LEU 63 Ca 0.09 0.04 -0.04 0.00 0.84 0.00 0.00 57.88 58.82 2k6q h LEU 63 Cb 0.20 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.15 2k6q h LEU 63 CO -0.21 0.27 -0.02 0.40 -0.34 0.00 0.00 178.44 178.53 2k6q h ILE 64 N 0.59 1.15 0.21 4.05 1.08 -0.91 0.38 117.51 124.06 2k6q h ILE 64 Ca 0.44 -0.61 -0.33 0.00 -0.39 0.00 0.00 64.86 63.98 2k6q h ILE 64 Cb 0.84 1.02 0.04 0.00 -3.07 0.00 0.00 36.82 35.64 2k6q h ILE 64 CO -0.19 0.20 -1.40 0.11 -0.69 0.00 0.00 178.15 176.18 2k6q h LYS 65 N 0.32 0.58 -0.03 2.37 1.57 0.10 -2.27 116.57 119.20 2k6q h LYS 65 Ca 0.07 -0.90 -0.06 0.00 -1.87 0.00 0.00 60.65 57.89 2k6q h LYS 65 Cb 0.26 0.32 -0.01 0.00 0.08 0.00 0.00 32.23 32.88 2k6q h LYS 65 CO 0.01 1.42 -0.27 0.82 -0.57 0.00 0.00 179.45 180.87 2k6q h ILE 66 N 0.20 1.21 0.04 1.86 1.08 0.21 -1.56 117.51 120.54 2k6q h ILE 66 Ca -0.23 -0.98 -0.00 0.00 -0.39 0.00 0.00 64.86 63.25 2k6q h ILE 66 Cb 2.08 1.48 0.00 0.00 -3.07 0.00 0.00 36.82 37.32 2k6q h ILE 66 CO 0.26 0.29 -0.02 0.40 -0.69 0.00 0.00 178.15 178.39 2k6q h ILE 67 N 0.05 0.00 -1.27 -0.67 1.08 -0.27 -2.99 117.51 113.45 2k6q h ILE 67 Ca 0.01 -0.06 0.44 0.00 -0.39 0.00 0.00 64.86 64.85 2k6q h ILE 67 Cb 0.50 0.00 -0.14 0.00 -3.07 0.00 0.00 36.82 34.12 2k6q h ILE 67 CO 0.04 0.00 0.80 0.08 -0.69 0.00 0.00 178.15 178.38 2k6q h ARG 68 N -0.11 0.07 -0.40 2.37 0.11 -1.44 1.31 114.38 116.30 2k6q h ARG 68 Ca -0.00 -0.00 0.03 0.00 0.10 0.00 0.00 59.98 60.10 2k6q h ARG 68 Cb 0.04 -0.02 -0.03 0.00 1.11 0.00 0.00 29.97 31.07 2k6q h ARG 68 CO 0.01 0.05 0.20 0.00 0.10 0.00 0.00 179.97 180.33 2k6q h ARG 69 N 0.07 0.40 0.12 0.08 2.47 -1.32 0.20 114.38 116.39 2k6q h ARG 69 Ca 0.83 -0.02 -0.01 0.00 -1.26 0.00 0.00 59.98 59.52 2k6q h ARG 69 Cb 2.54 -0.09 0.00 0.00 -1.65 0.00 0.00 29.97 30.77 2k6q h ARG 69 CO -0.49 0.27 -0.06 0.00 0.56 0.00 0.00 179.97 180.25 2k6q h ARG 70 N 0.41 -0.15 0.00 0.04 -0.00 0.19 -0.57 114.38 114.30 2k6q h ARG 70 Ca 0.17 0.01 0.00 0.00 -0.50 0.00 0.00 59.98 59.66 2k6q h ARG 70 Cb 0.06 0.03 0.00 0.00 0.00 0.00 0.00 29.97 30.07 2k6q h ARG 70 CO -0.11 -0.08 0.00 -0.07 0.00 0.00 0.00 179.97 179.71 2k6q h LEU 71 N -0.18 0.00 -1.89 3.04 3.38 -1.06 -3.45 115.31 115.14 2k6q h LEU 71 Ca -0.02 0.00 -0.58 0.00 0.09 0.00 0.00 57.88 57.38 2k6q h LEU 71 Cb 0.14 0.00 -0.23 0.00 0.09 0.00 0.00 40.66 40.66 2k6q h LEU 71 CO 0.03 0.00 -0.89 0.00 0.09 0.00 0.00 178.44 177.67 2k6q n GLN 72 N -2.60 -0.90 -1.82 1.13 10.64 0.03 -4.90 117.38 118.96 2k6q n GLN 72 Ca -0.02 0.09 -0.23 0.00 -1.83 0.00 0.00 57.00 55.01 2k6q n GLN 72 Cb 0.06 -3.55 0.15 0.00 -0.86 0.00 0.00 30.24 26.04 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 -4.22 0.00 0.00 2.61 4.77 -1.24 -5.09 117.00 113.83 2k6q n LEU 73 Ca -0.22 -1.42 -0.14 0.00 -0.03 0.00 0.00 56.01 54.21 2k6q n LEU 73 Cb 0.60 -0.76 -0.04 0.00 -2.33 0.00 0.00 43.42 40.89 2k6q n LEU 73 CO 0.81 -1.18 -0.09 0.59 -1.33 0.00 0.00 177.39 176.19 2k6q n ASN 74 N -3.47 1.20 -0.22 -1.43 4.13 -1.26 -5.00 115.26 109.20 2k6q n ASN 74 Ca 0.14 -2.15 -0.04 0.00 1.68 0.00 0.00 54.58 54.21 2k6q n ASN 74 Cb 0.49 0.52 0.06 0.00 -1.54 0.00 0.00 39.78 39.32 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 1.34 0.82 -0.99 5.41 0.00 -2.03 -1.10 119.26 122.71 2k6q h ALA 75 Ca -0.17 -0.02 0.18 0.00 0.00 0.00 0.00 54.91 54.90 2k6q h ALA 75 Cb 0.64 -0.21 -0.10 0.00 0.00 0.00 0.00 17.79 18.12 2k6q h ALA 75 CO 0.27 0.16 0.60 -0.91 0.00 0.00 0.00 179.25 179.37 2k6q h ASN 76 N 0.78 0.78 -3.15 0.00 2.35 -2.05 -3.39 115.58 110.91 2k6q h ASN 76 Ca 0.25 0.09 -0.59 0.00 -0.55 0.00 0.00 56.30 55.50 2k6q h ASN 76 Cb 0.01 -0.05 -0.06 0.00 0.05 0.00 0.00 38.32 38.27 2k6q h ASN 76 CO -0.10 0.29 -0.13 -1.58 -1.65 0.00 0.00 177.43 174.26 2k6q s GLN 77 N -5.87 4.09 -0.17 0.81 2.00 -0.42 -5.07 119.66 115.03 2k6q s GLN 77 Ca -0.11 0.53 -0.04 0.00 -2.00 0.00 0.00 55.36 53.74 2k6q s GLN 77 Cb 0.25 -3.27 -0.02 0.00 0.80 0.00 0.00 33.01 30.76 2k6q s GLN 77 CO 0.80 0.57 -0.04 0.00 -0.50 0.00 0.00 175.29 176.12 2k6q s ALA 78 N -0.75 2.96 -0.08 1.58 0.00 -1.26 -4.39 121.76 119.82 2k6q s ALA 78 Ca 0.26 -0.90 0.03 0.00 0.00 0.00 0.00 51.96 51.35 2k6q s ALA 78 Cb -0.17 -1.59 -0.02 0.00 0.00 0.00 0.00 23.12 21.34 2k6q s ALA 78 CO 0.15 0.06 -0.18 0.12 0.00 0.00 0.00 175.76 175.91 2k6q s PHE 79 N 0.63 2.63 -0.08 0.00 5.36 -1.26 -3.99 117.98 121.27 2k6q s PHE 79 Ca -0.02 -0.57 -0.03 0.00 -0.96 0.00 0.00 56.93 55.34 2k6q s PHE 79 Cb -0.14 -1.69 0.05 0.00 -0.34 0.00 0.00 43.02 40.89 2k6q s PHE 79 CO 0.02 -0.12 0.16 -0.06 -1.46 0.00 0.00 175.22 173.76 2k6q s PHE 80 N -0.12 -0.18 -0.04 10.12 0.08 0.14 -4.97 117.98 123.00 2k6q s PHE 80 Ca -0.03 0.60 -0.16 0.00 0.12 0.00 0.00 56.93 57.45 2k6q s PHE 80 Cb -0.14 -0.24 -0.05 0.00 -0.57 0.00 0.00 43.02 42.02 2k6q s PHE 80 CO 0.04 -0.26 0.44 -1.17 -0.10 0.00 0.00 175.22 174.17 2k6q s LEU 81 N 2.16 4.40 -0.33 -0.37 0.20 -1.26 0.11 118.68 123.58 2k6q s LEU 81 Ca 0.02 0.92 -0.00 0.00 0.69 0.00 0.00 54.13 55.76 2k6q s LEU 81 Cb -0.12 -2.65 0.08 0.00 -0.43 0.00 0.00 46.19 43.07 2k6q s LEU 81 CO -0.06 0.19 0.05 -0.76 -0.29 0.00 0.00 176.35 175.49 2k6q s LEU 82 N -0.40 4.41 -0.42 -0.68 2.01 0.32 -4.30 118.68 119.62 2k6q s LEU 82 Ca 0.25 -1.71 -0.28 0.00 0.01 0.00 0.00 54.13 52.39 2k6q s LEU 82 Cb -0.16 -1.70 0.00 0.00 0.01 0.00 0.00 46.19 44.34 2k6q s LEU 82 CO 0.12 -0.36 1.53 -0.69 1.01 0.00 0.00 176.35 177.97 2k6q s VAL 83 N 1.12 3.76 -0.99 -1.59 1.01 0.63 -0.05 120.40 124.28 2k6q s VAL 83 Ca 0.02 0.74 0.00 0.00 0.00 0.00 0.00 61.98 62.74 2k6q s VAL 83 Cb -0.20 -4.08 0.00 0.00 0.00 0.00 0.00 36.38 32.09 2k6q s VAL 83 CO -0.04 -0.73 0.00 0.59 0.00 0.00 0.00 175.10 174.92 2k6q n ASN 84 N 9.47 -3.89 0.00 3.32 3.02 0.14 -1.75 115.26 125.57 2k6q n ASN 84 Ca 0.18 0.15 0.00 0.00 -0.03 0.00 0.00 54.58 54.87 2k6q n ASN 84 Cb 0.48 -2.63 0.00 0.00 -0.61 0.00 0.00 39.78 37.02 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 -1.44 0.70 3.08 7.41 0.00 -0.94 -5.03 105.19 108.97 2k6q n GLY 85 Ca -0.11 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.70 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 -2.29 1.14 1.23 1.61 -3.43 -0.72 -4.93 115.29 107.91 2k6q s HIS 86 Ca 0.00 -0.22 -0.17 0.00 -0.80 0.00 0.00 55.06 53.87 2k6q s HIS 86 Cb 0.00 -0.74 0.27 0.00 -1.43 0.00 0.00 32.58 30.68 2k6q s HIS 86 CO 0.00 -0.03 0.70 -1.13 -2.00 0.00 0.00 174.74 172.29 2k6q n SER 87 N 2.80 -2.53 -0.07 7.38 3.41 -1.26 0.23 113.62 123.59 2k6q n SER 87 Ca -0.14 -0.33 0.09 0.00 -0.26 0.00 0.00 58.87 58.23 2k6q n SER 87 Cb 0.55 -1.10 0.13 0.00 -0.26 0.00 0.00 64.21 63.54 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 -4.31 1.39 -1.72 4.33 0.00 -1.26 -4.52 117.12 111.03 2k6q n MET 88 Ca 0.04 -2.50 -0.66 0.00 0.00 0.00 0.00 57.70 54.57 2k6q n MET 88 Cb 0.56 -1.46 -0.10 0.00 0.00 0.00 0.00 33.22 32.22 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 -1.37 0.02 -1.77 3.17 3.14 -1.26 -1.13 118.33 119.13 2k6q n VAL 89 Ca 0.15 -0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.53 2k6q n VAL 89 Cb 0.61 -0.50 0.00 0.00 -1.06 0.00 0.00 33.84 32.89 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 3.85 -1.57 0.00 6.55 2.88 -1.26 -5.00 113.62 119.08 2k6q n SER 90 Ca 0.30 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.84 2k6q n SER 90 Cb -0.03 -0.39 0.00 0.00 -0.75 0.00 0.00 64.21 63.03 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 -1.38 0.00 -2.41 2.46 3.14 -0.28 -4.59 118.33 115.26 2k6q n VAL 91 Ca 0.00 0.99 -0.02 0.00 -2.96 0.00 0.00 64.34 62.35 2k6q n VAL 91 Cb 0.39 -1.44 -0.00 0.00 -1.06 0.00 0.00 33.84 31.73 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 -1.37 -0.94 -3.84 6.55 7.64 -1.26 -4.83 113.62 115.57 2k6q n SER 92 Ca 0.00 0.39 -0.12 0.00 1.01 0.00 0.00 58.87 60.14 2k6q n SER 92 Cb 0.00 -0.94 -0.13 0.00 -1.01 0.00 0.00 64.21 62.13 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 -1.88 -0.00 0.23 0.44 2.01 -1.26 -5.11 115.64 110.07 2k6q s THR 93 Ca 0.03 0.01 -0.30 0.00 0.31 0.00 0.00 61.69 61.75 2k6q s THR 93 Cb -0.02 -0.12 -0.09 0.00 0.01 0.00 0.00 72.50 72.29 2k6q s THR 93 CO 0.04 0.01 1.10 -2.16 -0.69 0.00 0.00 174.62 172.91 2k6q s PRO 94 N 0.11 4.62 0.66 4.92 0.04 -1.26 -1.60 135.00 142.49 2k6q s PRO 94 Ca -0.01 1.76 0.31 0.00 0.04 0.00 0.00 61.00 63.10 2k6q s PRO 94 Cb -0.01 -3.23 1.68 0.00 0.04 0.00 0.00 34.50 32.97 2k6q s PRO 94 CO -0.00 0.15 1.96 0.97 0.04 0.00 0.00 177.00 180.11 2k6q h ILE 95 N 3.40 0.05 -0.26 0.56 6.09 -1.80 0.67 117.51 126.21 2k6q h ILE 95 Ca -0.45 0.00 -0.16 0.00 -1.37 0.00 0.00 64.86 62.87 2k6q h ILE 95 Cb 1.21 0.69 -0.00 0.00 0.47 0.00 0.00 36.82 39.19 2k6q h ILE 95 CO 0.70 0.00 -0.50 0.77 -3.07 0.00 0.00 178.15 176.05 2k6q h SER 96 N 0.00 0.79 0.05 2.19 4.64 -1.89 -1.99 113.55 117.34 2k6q h SER 96 Ca 0.02 -0.40 -0.19 0.00 -0.47 0.00 0.00 61.79 60.75 2k6q h SER 96 Cb 0.65 -0.23 -0.01 0.00 -0.31 0.00 0.00 62.40 62.51 2k6q h SER 96 CO -0.00 1.15 -0.98 -0.33 -0.87 0.00 0.00 176.83 175.80 2k6q h GLU 97 N 0.57 0.10 -0.74 4.77 4.39 -0.21 -2.72 114.58 120.74 2k6q h GLU 97 Ca 0.03 -0.17 0.21 0.00 0.34 0.00 0.00 59.36 59.76 2k6q h GLU 97 Cb 1.06 0.06 -0.03 0.00 -0.10 0.00 0.00 28.75 29.74 2k6q h GLU 97 CO 0.10 1.08 0.53 0.28 -1.16 0.00 0.00 179.01 179.84 2k6q h VAL 98 N -0.72 0.64 0.19 3.13 2.07 -0.69 1.54 116.25 122.41 2k6q h VAL 98 Ca -0.24 -0.01 -0.32 0.00 0.82 0.00 0.00 66.70 66.95 2k6q h VAL 98 Cb 1.41 0.60 0.02 0.00 -1.52 0.00 0.00 31.29 31.79 2k6q h VAL 98 CO -0.04 0.01 -1.51 0.22 0.02 0.00 0.00 177.57 176.26 2k6q h TYR 99 N 0.04 0.72 -0.00 1.57 5.03 -1.46 -2.85 116.97 120.02 2k6q h TYR 99 Ca 0.35 -0.53 0.00 0.00 2.58 0.00 0.00 58.73 61.14 2k6q h TYR 99 Cb 1.36 -0.03 0.00 0.00 1.55 0.00 0.00 36.73 39.61 2k6q h TYR 99 CO -0.00 1.50 -0.07 -0.85 -1.32 0.00 0.00 178.16 177.42 2k6q n GLU 100 N -3.60 0.74 -0.09 1.82 0.28 0.56 0.30 120.64 120.67 2k6q n GLU 100 Ca -0.17 -0.20 0.05 0.00 -0.16 0.00 0.00 57.16 56.68 2k6q n GLU 100 Cb 1.07 -1.50 0.09 0.00 1.43 0.00 0.00 31.44 32.54 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 -0.95 2.35 0.00 -1.84 7.64 0.50 -4.69 113.62 116.62 2k6q n SER 101 Ca 0.16 -1.74 0.00 0.00 1.01 0.00 0.00 58.87 58.30 2k6q n SER 101 Cb 0.25 -0.11 0.00 0.00 -1.01 0.00 0.00 64.21 63.34 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 0.42 0.00 -1.11 1.43 -0.58 -1.08 -5.00 120.64 114.72 2k6q n GLU 102 Ca 0.08 0.00 -0.36 0.00 -0.42 0.00 0.00 57.16 56.46 2k6q n GLU 102 Cb 0.33 -0.28 0.00 0.00 -0.57 0.00 0.00 31.44 30.92 2k6q n GLU 102 CO 0.00 0.00 0.00 2.89 -0.48 0.00 0.00 177.13 179.54 2k6q n ARG 103 N -2.33 0.00 -3.01 3.49 -4.01 0.15 -4.98 116.66 105.97 2k6q n ARG 103 Ca 0.00 0.00 -0.15 0.00 -1.04 0.00 0.00 57.85 56.66 2k6q n ARG 103 Cb 0.12 -0.86 -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 -0.25 -3.04 0.00 0.00 177.63 174.34 2k6q n ASP 104 N 2.06 2.29 -0.33 2.89 8.00 -1.26 -4.90 116.55 125.30 2k6q n ASP 104 Ca 0.09 -2.05 0.12 0.00 0.71 0.00 0.00 54.79 53.66 2k6q n ASP 104 Cb 0.36 0.08 0.24 0.00 -0.02 0.00 0.00 41.12 41.78 2k6q n ASP 104 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2k6q n GLU 105 N -0.91 -0.08 -0.19 -1.24 1.02 -1.26 0.19 120.64 118.17 2k6q n GLU 105 Ca -0.06 1.44 -0.00 0.00 -0.02 0.00 0.00 57.16 58.52 2k6q n GLU 105 Cb 0.32 -2.24 0.08 0.00 -0.02 0.00 0.00 31.44 29.58 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 -0.31 0.00 1.62 -0.00 -1.94 -3.46 116.42 112.33 2k6q h ASP 106 Ca 0.54 0.15 0.00 0.00 -0.00 0.00 0.00 57.03 57.72 2k6q h ASP 106 Cb 1.04 0.28 0.00 0.00 -0.00 0.00 0.00 39.33 40.65 2k6q h ASP 106 CO -0.92 -0.12 0.00 0.61 -0.00 0.00 0.00 179.24 178.81 2k6q n GLY 107 N -1.36 0.97 3.41 7.15 0.00 0.50 -4.70 105.19 111.15 2k6q n GLY 107 Ca 0.08 -0.02 -0.33 0.00 0.00 0.00 0.00 46.02 45.75 2k6q n GLY 107 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2k6q s PHE 108 N -2.00 2.75 0.15 1.61 2.19 -1.26 -4.86 117.98 116.57 2k6q s PHE 108 Ca 0.00 -0.45 -0.30 0.00 0.33 0.00 0.00 56.93 56.52 2k6q s PHE 108 Cb 0.00 -1.75 -0.07 0.00 -1.31 0.00 0.00 43.02 39.90 2k6q s PHE 108 CO 0.00 -0.05 1.03 -0.51 1.83 0.00 0.00 175.22 177.52 2k6q s LEU 109 N -0.12 4.51 -0.21 6.12 2.01 -1.23 -4.29 118.68 125.46 2k6q s LEU 109 Ca -0.01 1.95 -0.03 0.00 0.01 0.00 0.00 54.13 56.04 2k6q s LEU 109 Cb -0.14 -3.60 -0.01 0.00 0.01 0.00 0.00 46.19 42.46 2k6q s LEU 109 CO 0.04 -0.12 -0.06 -0.31 1.01 0.00 0.00 176.35 176.90 2k6q s TYR 110 N -0.20 2.93 0.07 0.29 2.02 -1.26 0.20 117.35 121.40 2k6q s TYR 110 Ca 0.48 -0.97 0.05 0.00 -0.37 0.00 0.00 57.07 56.26 2k6q s TYR 110 Cb -0.26 -2.07 -0.03 0.00 -0.40 0.00 0.00 41.96 39.20 2k6q s TYR 110 CO 0.32 -0.54 -0.14 -1.64 -1.57 0.00 0.00 175.55 171.99 2k6q s MET 111 N 1.36 0.81 -0.08 -0.62 -1.94 0.30 0.25 119.30 119.38 2k6q s MET 111 Ca 0.04 -0.96 -0.01 0.00 -1.71 0.00 0.00 55.69 53.05 2k6q s MET 111 Cb -0.14 -0.80 0.03 0.00 2.01 0.00 0.00 34.83 35.93 2k6q s MET 111 CO -0.03 0.17 -0.00 0.08 -0.01 0.00 0.00 175.02 175.23 2k6q s VAL 112 N -1.34 0.40 0.12 -6.03 1.01 0.93 -2.25 120.40 113.25 2k6q s VAL 112 Ca -0.02 0.09 0.02 0.00 0.00 0.00 0.00 61.98 62.07 2k6q s VAL 112 Cb -0.10 -0.57 -0.04 0.00 0.00 0.00 0.00 36.38 35.68 2k6q s VAL 112 CO 0.02 0.25 0.24 -0.72 0.00 0.00 0.00 175.10 174.89 2k6q s TYR 113 N 1.96 3.45 0.22 5.22 -0.85 -1.11 0.12 117.35 126.36 2k6q s TYR 113 Ca 0.05 0.14 -0.21 0.00 -0.52 0.00 0.00 57.07 56.53 2k6q s TYR 113 Cb -0.12 -1.68 0.07 0.00 0.38 0.00 0.00 41.96 40.61 2k6q s TYR 113 CO -0.05 0.54 1.00 0.00 -1.52 0.00 0.00 175.55 175.51 2k6q s ALA 114 N -1.66 -1.46 -0.69 9.51 0.00 0.12 -2.74 121.76 124.85 2k6q s ALA 114 Ca 0.34 -0.41 0.05 0.00 0.00 0.00 0.00 51.96 51.94 2k6q s ALA 114 Cb -0.12 0.75 0.32 0.00 0.00 0.00 0.00 23.12 24.07 2k6q s ALA 114 CO 0.28 -1.05 1.00 0.45 0.00 0.00 0.00 175.76 176.43 2k6q n SER 115 N -1.27 2.86 -3.74 0.00 2.88 -1.26 0.26 113.62 113.36 2k6q n SER 115 Ca -0.04 -2.37 -0.12 0.00 -1.33 0.00 0.00 58.87 55.01 2k6q n SER 115 Cb 0.59 -0.58 -0.11 0.00 -0.75 0.00 0.00 64.21 63.37 2k6q n SER 115 CO 0.00 0.00 0.00 -1.10 -1.23 0.00 0.00 175.04 172.71 2k6q s GLN 116 N -1.66 0.38 0.00 -1.46 -0.21 -1.26 -4.88 119.66 110.57 2k6q s GLN 116 Ca 0.21 0.57 0.00 0.00 0.02 0.00 0.00 55.36 56.16 2k6q s GLN 116 Cb 0.16 0.11 0.00 0.00 1.00 0.00 0.00 33.01 34.28 2k6q s GLN 116 CO 0.06 -0.09 0.20 -1.91 -2.12 0.00 0.00 175.29 171.43 2k6q n GLU 117 N 3.38 3.55 -0.03 2.91 2.13 -1.26 -4.65 120.64 126.66 2k6q n GLU 117 Ca -0.17 -0.20 -0.01 0.00 0.66 0.00 0.00 57.16 57.44 2k6q n GLU 117 Cb 0.56 -0.69 -0.08 0.00 0.27 0.00 0.00 31.44 31.50 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 -0.56 0.44 0.18 6.31 -2.24 -1.26 -4.48 114.28 112.66 2k6q n THR 118 Ca 0.00 -0.36 0.18 0.00 -2.27 0.00 0.00 64.05 61.61 2k6q n THR 118 Cb 0.00 -0.39 0.80 0.00 -2.10 0.00 0.00 70.33 68.65 2k6q n THR 118 CO 0.00 0.00 0.00 2.19 -0.57 0.00 0.00 175.07 176.69 2k6q h PHE 119 N 0.00 0.00 0.00 4.78 -0.00 -1.98 -3.53 116.94 116.21 2k6q h PHE 119 Ca -0.17 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.80 2k6q h PHE 119 Cb 1.21 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 37.16 2k6q h PHE 119 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 178.31 178.72