#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 0.00 -2.54 4.33 2.81 -1.26 -4.84 117.12 115.62 2k6q n MET 1 Ca 0.00 0.00 -0.35 0.00 -1.81 0.00 0.00 57.70 55.54 2k6q n MET 1 Cb 0.00 -1.40 -0.04 0.00 -0.71 0.00 0.00 33.22 31.07 2k6q n MET 1 CO 0.00 0.00 0.00 -1.25 1.51 0.00 0.00 175.97 176.23 2k6q s PRO 2 N 8.46 3.90 0.07 0.03 0.04 -1.26 -4.99 135.00 141.26 2k6q s PRO 2 Ca 1.29 1.41 -0.01 0.00 0.04 0.00 0.00 61.00 63.73 2k6q s PRO 2 Cb -1.18 -2.22 -0.00 0.00 0.04 0.00 0.00 34.50 31.14 2k6q s PRO 2 CO 0.47 -0.35 -0.02 0.43 0.04 0.00 0.00 177.00 177.57 2k6q n SER 3 N -0.71 1.01 -4.82 6.66 7.64 -1.26 -5.05 113.62 117.09 2k6q n SER 3 Ca 0.08 0.13 -0.34 0.00 1.01 0.00 0.00 58.87 59.75 2k6q n SER 3 Cb 0.52 -0.31 -0.07 0.00 -1.01 0.00 0.00 64.21 63.34 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 -2.04 4.27 1.06 1.43 -1.05 -1.26 -5.04 118.70 116.07 2k6q s GLU 4 Ca -0.01 1.09 -0.12 0.00 -0.15 0.00 0.00 54.97 55.78 2k6q s GLU 4 Cb 0.00 -2.37 0.22 0.00 -0.44 0.00 0.00 34.13 31.54 2k6q s GLU 4 CO 0.02 0.08 1.07 0.15 0.95 0.00 0.00 175.26 177.53 2k6q s LYS 5 N -2.87 -0.05 0.11 -4.83 -0.14 -1.26 -5.04 119.74 105.67 2k6q s LYS 5 Ca 0.58 0.81 0.06 0.00 -1.36 0.00 0.00 55.97 56.05 2k6q s LYS 5 Cb -0.11 -1.66 -0.04 0.00 -1.68 0.00 0.00 37.83 34.34 2k6q s LYS 5 CO 0.16 -3.13 -0.01 -0.08 -0.76 0.00 0.00 175.35 171.53 2k6q s THR 6 N -2.69 3.89 0.63 2.17 -1.32 -1.26 -4.79 115.64 112.27 2k6q s THR 6 Ca 0.67 -1.12 0.24 0.00 -1.21 0.00 0.00 61.69 60.27 2k6q s THR 6 Cb -0.22 -2.88 0.29 0.00 -1.51 0.00 0.00 72.50 68.18 2k6q s THR 6 CO 0.61 0.06 1.65 -0.26 -2.21 0.00 0.00 174.62 174.47 2k6q h PHE 7 N 3.27 0.00 0.15 9.09 -1.00 -1.96 1.76 116.94 128.24 2k6q h PHE 7 Ca -0.48 0.00 -0.29 0.00 2.81 0.00 0.00 57.97 60.01 2k6q h PHE 7 Cb 1.17 0.00 0.01 0.00 3.61 0.00 0.00 35.95 40.74 2k6q h PHE 7 CO 0.61 0.00 -1.38 1.57 -1.61 0.00 0.00 178.31 177.50 2k6q h LYS 8 N 0.00 0.31 0.00 1.51 2.10 -1.93 -3.29 116.57 115.27 2k6q h LYS 8 Ca 0.15 -0.53 0.00 0.00 -2.00 0.00 0.00 60.65 58.28 2k6q h LYS 8 Cb 1.45 0.20 0.00 0.00 -0.90 0.00 0.00 32.23 32.98 2k6q h LYS 8 CO -0.00 1.22 -0.30 1.96 -2.00 0.00 0.00 179.45 180.34 2k6q h GLN 9 N 0.08 0.00 0.00 0.07 1.08 0.16 -3.43 115.11 113.07 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 2.02 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 29.45 2k6q h GLN 9 CO 0.20 0.00 0.00 -2.13 -0.95 0.00 0.00 178.83 175.95 2k6q n ARG 10 N -3.66 0.00 -1.58 1.46 3.00 0.44 -4.37 116.66 111.96 2k6q n ARG 10 Ca -0.04 0.47 -0.53 0.00 -0.00 0.00 0.00 57.85 57.75 2k6q n ARG 10 Cb 0.15 -0.93 -0.06 0.00 0.00 0.00 0.00 32.46 31.62 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 -0.98 0.99 -1.64 -0.14 3.00 -1.24 -4.78 116.66 111.87 2k6q n ARG 11 Ca 0.00 0.36 -0.42 0.00 -0.01 0.00 0.00 57.85 57.77 2k6q n ARG 11 Cb 0.00 -1.97 -0.03 0.00 0.00 0.00 0.00 32.46 30.46 2k6q n ARG 11 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.63 176.50 2k6q n SER 12 N 2.36 3.88 -0.26 0.55 3.41 -1.26 -4.78 113.62 117.52 2k6q n SER 12 Ca 0.18 0.68 -0.07 0.00 -0.26 0.00 0.00 58.87 59.41 2k6q n SER 12 Cb 0.18 -1.53 -0.06 0.00 -0.26 0.00 0.00 64.21 62.53 2k6q n SER 12 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 2k6q n PHE 13 N 8.82 -0.27 -0.32 7.33 7.35 -1.26 0.12 117.46 139.24 2k6q n PHE 13 Ca 0.23 0.76 0.18 0.00 -0.76 0.00 0.00 57.45 57.86 2k6q n PHE 13 Cb 0.42 -0.53 0.37 0.00 0.35 0.00 0.00 39.48 40.08 2k6q n PHE 13 CO 0.00 0.00 0.00 0.93 -0.76 0.00 0.00 176.76 176.93 2k6q h GLU 14 N 0.00 0.16 -0.19 -4.13 5.08 -1.98 1.69 114.58 115.21 2k6q h GLU 14 Ca 0.10 -0.01 -0.13 0.00 -1.00 0.00 0.00 59.36 58.32 2k6q h GLU 14 Cb 0.25 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.45 2k6q h GLU 14 CO -0.57 0.11 -0.42 1.96 -1.00 0.00 0.00 179.01 179.08 2k6q h GLN 15 N 0.17 0.46 0.00 2.33 7.50 0.63 0.46 115.11 126.66 2k6q h GLN 15 Ca 0.64 -0.24 0.00 0.00 0.50 0.00 0.00 58.65 59.55 2k6q h GLN 15 Cb 1.39 0.01 0.00 0.00 0.05 0.00 0.00 27.48 28.93 2k6q h GLN 15 CO -0.71 0.80 0.00 -0.09 -1.50 0.00 0.00 178.83 177.33 2k6q h ARG 16 N 0.38 0.00 0.13 1.46 9.65 0.73 -2.51 114.38 124.21 2k6q h ARG 16 Ca 0.03 0.00 -0.32 0.00 -1.10 0.00 0.00 59.98 58.59 2k6q h ARG 16 Cb 0.90 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 29.47 2k6q h ARG 16 CO 0.08 0.00 -1.70 0.28 2.80 0.00 0.00 179.97 181.43 2k6q h VAL 17 N 0.00 0.85 -0.11 0.20 2.07 0.15 -3.34 116.25 116.07 2k6q h VAL 17 Ca 0.00 -2.38 -0.00 0.00 0.82 0.00 0.00 66.70 65.14 2k6q h VAL 17 Cb 0.74 2.60 -0.01 0.00 -1.52 0.00 0.00 31.29 33.11 2k6q h VAL 17 CO 0.00 0.78 0.06 -0.08 0.02 0.00 0.00 177.57 178.35 2k6q h GLU 18 N -0.13 0.15 -1.13 1.57 4.81 -0.91 -1.86 114.58 117.08 2k6q h GLU 18 Ca -0.36 -0.02 0.33 0.00 -0.13 0.00 0.00 59.36 59.18 2k6q h GLU 18 Cb 1.90 -0.03 -0.11 0.00 0.63 0.00 0.00 28.75 31.14 2k6q h GLU 18 CO 0.07 0.18 0.72 0.22 -0.73 0.00 0.00 179.01 179.47 2k6q h ASP 19 N 0.09 0.38 -0.21 1.04 -0.00 -1.62 0.90 116.42 117.01 2k6q h ASP 19 Ca 0.04 0.11 -0.09 0.00 -0.00 0.00 0.00 57.03 57.09 2k6q h ASP 19 Cb 0.07 0.06 -0.00 0.00 -0.00 0.00 0.00 39.33 39.45 2k6q h ASP 19 CO -0.01 -0.02 -0.22 0.58 -0.00 0.00 0.00 179.24 179.57 2k6q h VAL 20 N 0.28 1.33 -0.94 2.25 2.07 -1.48 -3.15 116.25 116.61 2k6q h VAL 20 Ca 0.68 -1.39 0.22 0.00 0.82 0.00 0.00 66.70 67.03 2k6q h VAL 20 Cb 1.88 1.76 -0.18 0.00 -1.52 0.00 0.00 31.29 33.24 2k6q h VAL 20 CO -0.36 0.43 -0.11 -1.14 0.02 0.00 0.00 177.57 176.41 2k6q n ARG 21 N -4.41 -0.08 0.14 1.57 0.63 0.31 0.86 116.66 115.68 2k6q n ARG 21 Ca -0.05 1.43 -0.14 0.00 -0.92 0.00 0.00 57.85 58.17 2k6q n ARG 21 Cb 0.42 -2.20 -0.07 0.00 0.45 0.00 0.00 32.46 31.06 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 -0.95 -2.47 6.15 3.38 -1.46 0.72 115.31 120.68 2k6q h LEU 22 Ca 0.51 0.10 -0.00 0.00 0.09 0.00 0.00 57.88 58.58 2k6q h LEU 22 Cb 0.92 0.35 -0.00 0.00 0.09 0.00 0.00 40.66 42.02 2k6q h LEU 22 CO -0.92 -0.43 -0.00 -0.29 0.09 0.00 0.00 178.44 176.88 2k6q h ILE 23 N -0.60 0.52 0.02 1.22 6.09 0.41 1.47 117.51 126.64 2k6q h ILE 23 Ca 0.02 -0.01 -0.22 0.00 -1.37 0.00 0.00 64.86 63.27 2k6q h ILE 23 Cb 0.60 1.01 -0.00 0.00 0.47 0.00 0.00 36.82 38.89 2k6q h ILE 23 CO -0.16 0.00 -0.97 0.03 -3.07 0.00 0.00 178.15 173.99 2k6q h ARG 24 N 0.00 0.29 -0.01 2.19 2.47 0.32 1.20 114.38 120.84 2k6q h ARG 24 Ca -0.00 -0.34 0.00 0.00 -1.26 0.00 0.00 59.98 58.38 2k6q h ARG 24 Cb 0.01 0.10 0.00 0.00 -1.65 0.00 0.00 29.97 28.43 2k6q h ARG 24 CO 0.00 1.06 -0.41 -0.85 0.56 0.00 0.00 179.97 180.33 2k6q n GLU 25 N -3.66 1.07 -0.01 0.04 0.28 0.23 -4.01 120.64 114.57 2k6q n GLU 25 Ca -0.06 -0.82 -0.04 0.00 -0.16 0.00 0.00 57.16 56.08 2k6q n GLU 25 Cb 0.86 -1.48 -0.01 0.00 1.43 0.00 0.00 31.44 32.23 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 -0.25 0.17 -3.83 3.44 6.02 0.48 -4.89 117.38 118.52 2k6q n GLN 26 Ca 0.10 0.07 -0.30 0.00 -0.01 0.00 0.00 57.00 56.86 2k6q n GLN 26 Cb 0.43 -0.80 -0.11 0.00 1.02 0.00 0.00 30.24 30.78 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 -2.25 3.65 0.20 1.08 3.76 0.41 -4.88 115.29 117.27 2k6q s HIS 27 Ca -0.10 -3.26 0.06 0.00 -0.15 0.00 0.00 55.06 51.61 2k6q s HIS 27 Cb 0.02 -2.86 0.11 0.00 1.11 0.00 0.00 32.58 30.97 2k6q s HIS 27 CO 0.14 -0.60 1.46 -1.00 -0.85 0.00 0.00 174.74 173.89 2k6q h PRO 28 N 5.59 0.11 -0.99 8.40 0.13 -1.66 -3.06 132.00 140.51 2k6q h PRO 28 Ca 0.14 -0.10 -0.25 0.00 -0.87 0.00 0.00 66.00 64.92 2k6q h PRO 28 Cb 0.77 0.03 -0.15 0.00 0.13 0.00 0.00 31.00 31.78 2k6q h PRO 28 CO 0.75 0.83 0.32 0.25 -0.23 0.00 0.00 178.00 179.92 2k6q n THR 29 N -3.68 2.09 -4.16 1.56 -2.24 -1.26 -4.83 114.28 101.75 2k6q n THR 29 Ca -0.02 -0.96 -0.15 0.00 -2.27 0.00 0.00 64.05 60.65 2k6q n THR 29 Cb 0.74 -0.72 -0.13 0.00 -2.10 0.00 0.00 70.33 68.12 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 -1.67 0.58 -0.31 -0.78 -0.14 -1.16 -3.28 119.74 112.98 2k6q s LYS 30 Ca 0.29 -0.56 -0.12 0.00 -1.36 0.00 0.00 55.97 54.21 2k6q s LYS 30 Cb 0.24 -0.47 -0.03 0.00 -1.68 0.00 0.00 37.83 35.88 2k6q s LYS 30 CO 0.06 0.11 0.23 0.42 -0.76 0.00 0.00 175.35 175.41 2k6q s ILE 31 N -0.83 5.29 0.25 2.17 -1.09 0.83 -4.90 121.20 122.91 2k6q s ILE 31 Ca -0.03 0.02 -0.30 0.00 -2.23 0.00 0.00 60.65 58.11 2k6q s ILE 31 Cb -0.07 -3.63 -0.09 0.00 -1.58 0.00 0.00 42.46 37.09 2k6q s ILE 31 CO 0.00 0.12 1.09 -2.16 -1.23 0.00 0.00 174.94 172.76 2k6q s PRO 32 N 1.77 4.64 0.03 2.79 0.04 -1.26 -2.28 135.00 140.73 2k6q s PRO 32 Ca 0.07 1.76 -0.10 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 31.16 2k6q s PRO 32 CO 0.11 0.19 0.20 0.14 0.04 0.00 0.00 177.00 177.67 2k6q s VAL 33 N -0.89 0.10 -0.35 -0.36 -7.23 -1.21 -2.32 120.40 108.13 2k6q s VAL 33 Ca 0.46 -0.83 0.03 0.00 -1.81 0.00 0.00 61.98 59.83 2k6q s VAL 33 Cb -0.31 -0.81 0.10 0.00 0.56 0.00 0.00 36.38 35.93 2k6q s VAL 33 CO 0.39 -0.46 0.08 -0.63 -0.31 0.00 0.00 175.10 174.17 2k6q s ILE 34 N -2.27 2.07 -0.21 -0.62 -1.09 0.42 -3.11 121.20 116.39 2k6q s ILE 34 Ca -0.07 -2.30 -0.14 0.00 -2.23 0.00 0.00 60.65 55.91 2k6q s ILE 34 Cb -0.02 -2.52 -0.04 0.00 -1.58 0.00 0.00 42.46 38.29 2k6q s ILE 34 CO -0.02 -0.64 0.31 -0.63 -1.23 0.00 0.00 174.94 172.73 2k6q s ILE 35 N 0.89 5.26 0.09 2.92 1.01 -0.96 -1.00 121.20 129.41 2k6q s ILE 35 Ca 0.12 0.52 -0.04 0.00 0.00 0.00 0.00 60.65 61.25 2k6q s ILE 35 Cb -0.20 -3.64 -0.03 0.00 0.01 0.00 0.00 42.46 38.60 2k6q s ILE 35 CO -0.10 0.30 0.09 -1.61 0.00 0.00 0.00 174.94 173.62 2k6q s GLU 36 N 1.11 0.82 0.33 2.79 0.41 -0.71 -4.56 118.70 118.89 2k6q s GLU 36 Ca 0.15 -1.21 -0.28 0.00 -0.41 0.00 0.00 54.97 53.23 2k6q s GLU 36 Cb -0.14 0.27 -0.09 0.00 -1.78 0.00 0.00 34.13 32.39 2k6q s GLU 36 CO 0.06 -0.23 1.16 -0.98 -0.49 0.00 0.00 175.26 174.79 2k6q s ARG 37 N -3.94 4.41 0.35 1.61 1.70 -1.26 -1.75 118.95 120.07 2k6q s ARG 37 Ca 0.12 1.89 -0.28 0.00 -0.47 0.00 0.00 55.73 56.99 2k6q s ARG 37 Cb 0.06 -3.01 -0.11 0.00 -0.57 0.00 0.00 34.95 31.32 2k6q s ARG 37 CO -0.06 -0.02 1.47 0.98 -1.08 0.00 0.00 175.30 176.58 2k6q n TYR 38 N 0.77 2.82 -1.54 5.89 4.19 -1.05 -4.77 117.16 123.46 2k6q n TYR 38 Ca 0.01 0.44 -0.24 0.00 3.31 0.00 0.00 57.90 61.41 2k6q n TYR 38 Cb 0.45 -2.52 -0.09 0.00 0.49 0.00 0.00 39.34 37.67 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 0.58 0.00 2.98 5.02 -1.26 0.12 118.16 126.37 2k6q n LYS 39 Ca 0.03 -0.39 0.00 0.00 -2.02 0.00 0.00 58.31 55.93 2k6q n LYS 39 Cb 0.38 -3.04 0.00 0.00 -0.02 0.00 0.00 35.03 32.35 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 6.35 1.60 3.61 0.72 0.00 -1.26 -5.09 105.19 111.12 2k6q n GLY 40 Ca 0.49 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 46.08 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 3.87 -0.00 1.61 2.56 0.32 -4.83 118.70 122.21 2k6q s GLU 41 Ca 0.00 0.58 0.07 0.00 0.00 0.00 0.00 54.97 55.61 2k6q s GLU 41 Cb 0.00 -3.78 -0.08 0.00 2.00 0.00 0.00 34.13 32.27 2k6q s GLU 41 CO 0.00 -0.87 0.25 0.36 -0.56 0.00 0.00 175.26 174.44 2k6q n LYS 42 N 6.60 3.64 0.00 4.30 -0.00 -1.26 -4.83 118.16 126.60 2k6q n LYS 42 Ca 0.06 -0.02 0.00 0.00 -0.00 0.00 0.00 58.31 58.36 2k6q n LYS 42 Cb 0.48 -0.90 0.00 0.00 -0.00 0.00 0.00 35.03 34.61 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 -1.30 0.00 -1.65 -1.58 6.02 -1.26 -4.85 117.38 112.75 2k6q n GLN 43 Ca 0.01 0.00 -0.41 0.00 -0.01 0.00 0.00 57.00 56.59 2k6q n GLN 43 Cb 0.12 -0.30 0.02 0.00 1.02 0.00 0.00 30.24 31.10 2k6q n GLN 43 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 2k6q n LEU 44 N -0.16 3.37 -4.79 1.08 4.77 -1.26 -4.97 117.00 115.05 2k6q n LEU 44 Ca 0.00 1.04 -0.29 0.00 -0.03 0.00 0.00 56.01 56.73 2k6q n LEU 44 Cb 0.00 -1.42 0.13 0.00 -2.33 0.00 0.00 43.42 39.80 2k6q n LEU 44 CO 0.00 -1.16 0.72 -2.16 -1.33 0.00 0.00 177.39 173.46 2k6q s PRO 45 N -2.19 1.21 -0.27 3.23 0.04 -1.26 -4.96 135.00 130.80 2k6q s PRO 45 Ca 0.64 0.31 -0.29 0.00 0.04 0.00 0.00 61.00 61.70 2k6q s PRO 45 Cb -0.52 -1.85 -0.01 0.00 0.04 0.00 0.00 34.50 32.17 2k6q s PRO 45 CO 0.56 -2.15 1.41 0.54 0.04 0.00 0.00 177.00 177.40 2k6q s VAL 46 N -3.27 3.98 0.52 -0.36 0.11 -1.26 -4.94 120.40 115.18 2k6q s VAL 46 Ca 0.64 1.11 -0.18 0.00 -2.93 0.00 0.00 61.98 60.62 2k6q s VAL 46 Cb -0.15 -3.99 -0.15 0.00 -1.53 0.00 0.00 36.38 30.56 2k6q s VAL 46 CO 0.53 -0.41 -0.12 -0.11 -3.33 0.00 0.00 175.10 171.67 2k6q n LEU 47 N 7.90 -3.56 -0.21 2.54 -0.00 -1.26 -4.83 117.00 117.57 2k6q n LEU 47 Ca 0.16 0.65 -0.08 0.00 -0.00 0.00 0.00 56.01 56.73 2k6q n LEU 47 Cb 0.46 -0.86 0.02 0.00 -0.00 0.00 0.00 43.42 43.05 2k6q n LEU 47 CO 0.64 -4.76 0.91 -0.78 -0.00 0.00 0.00 177.39 173.40 2k6q h ASP 48 N -0.03 0.91 -4.17 1.96 3.58 -1.92 -3.45 116.42 113.30 2k6q h ASP 48 Ca -0.41 -0.24 -0.34 0.00 0.42 0.00 0.00 57.03 56.46 2k6q h ASP 48 Cb 1.44 -0.24 -0.14 0.00 1.72 0.00 0.00 39.33 42.11 2k6q h ASP 48 CO 0.42 0.91 -0.65 -0.54 -2.88 0.00 0.00 179.24 176.49 2k6q s LYS 49 N -5.30 1.27 -0.19 0.28 3.01 -1.26 -5.06 119.74 112.49 2k6q s LYS 49 Ca -0.12 -1.64 0.10 0.00 -1.01 0.00 0.00 55.97 53.30 2k6q s LYS 49 Cb 0.13 -0.45 -0.19 0.00 -1.01 0.00 0.00 37.83 36.30 2k6q s LYS 49 CO 0.82 -0.13 -0.04 2.41 0.51 0.00 0.00 175.35 178.92 2k6q n THR 50 N -0.36 1.24 -3.63 2.17 -1.04 -1.26 -4.87 114.28 106.52 2k6q n THR 50 Ca -0.05 -0.65 -0.37 0.00 -2.04 0.00 0.00 64.05 60.94 2k6q n THR 50 Cb 0.64 -0.82 -0.06 0.00 -1.82 0.00 0.00 70.33 68.27 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 -2.43 3.84 -0.02 -2.82 1.02 -1.26 -2.26 119.74 115.80 2k6q s LYS 51 Ca -0.17 0.17 0.00 0.00 0.02 0.00 0.00 55.97 55.99 2k6q s LYS 51 Cb 0.06 -3.26 0.03 0.00 -0.52 0.00 0.00 37.83 34.14 2k6q s LYS 51 CO 0.64 0.61 0.02 -0.06 -0.92 0.00 0.00 175.35 175.65 2k6q s PHE 52 N -0.71 0.15 -0.52 3.18 0.40 -1.18 -5.02 117.98 114.29 2k6q s PHE 52 Ca 0.19 0.07 -0.18 0.00 -0.60 0.00 0.00 56.93 56.41 2k6q s PHE 52 Cb -0.14 -0.30 0.07 0.00 0.51 0.00 0.00 43.02 43.15 2k6q s PHE 52 CO 0.08 -0.10 0.60 -0.51 0.70 0.00 0.00 175.22 175.99 2k6q s LEU 53 N 1.02 5.19 0.06 -0.37 1.43 -1.26 -3.29 118.68 121.46 2k6q s LEU 53 Ca -0.09 -1.11 -0.16 0.00 -1.03 0.00 0.00 54.13 51.74 2k6q s LEU 53 Cb -0.13 -2.37 -0.06 0.00 0.03 0.00 0.00 46.19 43.66 2k6q s LEU 53 CO -0.02 -0.90 0.49 -0.69 0.23 0.00 0.00 176.35 175.46 2k6q s VAL 54 N 2.45 4.91 0.17 -1.59 1.01 -0.97 -4.89 120.40 121.50 2k6q s VAL 54 Ca 0.12 0.91 -0.30 0.00 0.00 0.00 0.00 61.98 62.72 2k6q s VAL 54 Cb -0.21 -3.77 -0.08 0.00 0.00 0.00 0.00 36.38 32.32 2k6q s VAL 54 CO 0.10 0.47 1.12 -2.16 0.00 0.00 0.00 175.10 174.62 2k6q s PRO 55 N -1.37 4.57 -0.28 2.72 0.04 -1.26 -0.12 135.00 139.30 2k6q s PRO 55 Ca 0.29 1.75 -0.03 0.00 0.04 0.00 0.00 61.00 63.05 2k6q s PRO 55 Cb -0.17 -3.27 0.03 0.00 0.04 0.00 0.00 34.50 31.13 2k6q s PRO 55 CO 0.17 0.03 2.64 -0.40 0.04 0.00 0.00 177.00 179.48 2k6q n ASP 56 N 2.47 6.11 -0.61 6.66 5.75 -1.21 -3.35 116.55 132.38 2k6q n ASP 56 Ca 0.03 -2.94 -0.00 0.00 -0.01 0.00 0.00 54.79 51.87 2k6q n ASP 56 Cb 0.46 -1.21 -0.00 0.00 -1.03 0.00 0.00 41.12 39.34 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 1.11 0.00 -3.80 2.11 1.44 -1.26 -4.93 115.22 109.89 2k6q n HIS 57 Ca 0.37 -0.07 0.00 0.00 -2.01 0.00 0.00 57.72 56.01 2k6q n HIS 57 Cb 0.63 0.13 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 0.03 0.00 -4.28 0.61 0.24 -1.21 -5.12 118.33 108.60 2k6q n VAL 58 Ca -0.02 0.00 -0.29 0.00 -2.04 0.00 0.00 64.34 61.99 2k6q n VAL 58 Cb 0.63 0.00 -0.11 0.00 -1.47 0.00 0.00 33.84 32.90 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 -0.60 4.06 0.57 -1.34 4.22 -1.26 -3.17 114.94 117.42 2k6q s ASN 59 Ca 0.00 -0.53 0.37 0.00 -2.14 0.00 0.00 52.86 50.56 2k6q s ASN 59 Cb 0.00 -0.64 1.43 0.00 1.28 0.00 0.00 41.25 43.32 2k6q s ASN 59 CO 0.00 0.17 1.63 0.00 -2.04 0.00 0.00 177.10 176.86 2k6q h MET 60 N 3.56 0.00 -0.16 3.55 -0.00 -1.79 0.43 114.93 120.52 2k6q h MET 60 Ca -0.49 0.00 0.04 0.00 -0.00 0.00 0.00 59.70 59.25 2k6q h MET 60 Cb 1.17 0.00 -0.04 0.00 -0.00 0.00 0.00 31.60 32.73 2k6q h MET 60 CO 0.49 0.00 -0.09 1.03 -0.00 0.00 0.00 176.91 178.34 2k6q h SER 61 N 0.00 -0.30 -0.68 -0.10 0.87 -1.90 -2.57 113.55 108.86 2k6q h SER 61 Ca 0.59 0.07 0.09 0.00 -1.23 0.00 0.00 61.79 61.31 2k6q h SER 61 Cb 2.65 0.16 -0.11 0.00 -0.44 0.00 0.00 62.40 64.66 2k6q h SER 61 CO -0.01 -0.12 -0.48 -0.33 -0.53 0.00 0.00 176.83 175.36 2k6q h GLU 62 N -0.09 -0.18 -1.16 2.24 4.39 -0.53 0.93 114.58 120.18 2k6q h GLU 62 Ca 0.09 0.01 0.44 0.00 0.34 0.00 0.00 59.36 60.24 2k6q h GLU 62 Cb 0.22 0.04 -0.16 0.00 -0.10 0.00 0.00 28.75 28.75 2k6q h GLU 62 CO -0.21 -0.12 0.69 1.25 -1.16 0.00 0.00 179.01 179.45 2k6q h LEU 63 N -0.19 0.28 0.51 1.33 5.85 -1.55 0.56 115.31 122.11 2k6q h LEU 63 Ca 0.18 0.21 -0.03 0.00 0.84 0.00 0.00 57.88 59.09 2k6q h LEU 63 Cb 0.54 0.22 0.01 0.00 0.37 0.00 0.00 40.66 41.80 2k6q h LEU 63 CO -0.76 -0.35 -0.25 0.40 -0.34 0.00 0.00 178.44 177.15 2k6q h ILE 64 N 0.02 0.00 -0.24 4.05 1.08 0.92 0.43 117.51 123.77 2k6q h ILE 64 Ca 0.86 -0.09 0.07 0.00 -0.39 0.00 0.00 64.86 65.31 2k6q h ILE 64 Cb 2.46 0.00 -0.01 0.00 -3.07 0.00 0.00 36.82 36.20 2k6q h ILE 64 CO -0.63 0.00 0.47 0.11 -0.69 0.00 0.00 178.15 177.41 2k6q h LYS 65 N -0.78 0.00 0.05 2.37 1.57 0.13 0.43 116.57 120.34 2k6q h LYS 65 Ca -0.07 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.62 2k6q h LYS 65 Cb 0.53 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.84 2k6q h LYS 65 CO 0.12 0.00 -0.39 0.82 -0.57 0.00 0.00 179.45 179.42 2k6q h ILE 66 N 0.00 1.60 0.23 1.86 1.08 0.45 -3.22 117.51 119.51 2k6q h ILE 66 Ca 0.11 -2.27 0.01 0.00 -0.39 0.00 0.00 64.86 62.32 2k6q h ILE 66 Cb 1.05 3.09 -0.03 0.00 -3.07 0.00 0.00 36.82 37.86 2k6q h ILE 66 CO -0.00 0.62 -0.30 0.40 -0.69 0.00 0.00 178.15 178.18 2k6q h ILE 67 N -0.58 0.37 -0.97 -0.67 1.08 0.43 -2.08 117.51 115.09 2k6q h ILE 67 Ca -0.06 0.00 0.21 0.00 -0.39 0.00 0.00 64.86 64.61 2k6q h ILE 67 Cb 1.24 0.37 -0.18 0.00 -3.07 0.00 0.00 36.82 35.17 2k6q h ILE 67 CO 0.07 0.00 -0.20 0.03 -0.69 0.00 0.00 178.15 177.36 2k6q h ARG 68 N -0.58 0.00 -0.78 2.37 3.08 -1.28 1.35 114.38 118.54 2k6q h ARG 68 Ca 0.00 -0.00 0.12 0.00 0.07 0.00 0.00 59.98 60.17 2k6q h ARG 68 Cb 0.56 -0.00 -0.08 0.00 0.08 0.00 0.00 29.97 30.53 2k6q h ARG 68 CO -0.10 0.00 0.39 0.00 -1.07 0.00 0.00 179.97 179.19 2k6q h ARG 69 N 0.00 0.60 0.27 0.04 2.47 -1.39 1.47 114.38 117.84 2k6q h ARG 69 Ca 0.49 -0.04 -0.01 0.00 -1.26 0.00 0.00 59.98 59.16 2k6q h ARG 69 Cb 0.79 -0.13 0.00 0.00 -1.65 0.00 0.00 29.97 28.98 2k6q h ARG 69 CO -0.99 0.40 -0.13 0.00 0.56 0.00 0.00 179.97 179.81 2k6q h ARG 70 N 0.62 -0.35 0.00 0.04 -0.00 0.20 -2.26 114.38 112.63 2k6q h ARG 70 Ca 0.40 0.02 0.00 0.00 -0.50 0.00 0.00 59.98 59.91 2k6q h ARG 70 Cb 0.49 0.08 0.00 0.00 0.00 0.00 0.00 29.97 30.54 2k6q h ARG 70 CO -0.31 -0.09 0.00 -0.07 0.00 0.00 0.00 179.97 179.49 2k6q h LEU 71 N -0.57 0.00 -3.22 3.04 3.38 -0.18 -3.45 115.31 114.31 2k6q h LEU 71 Ca -0.04 0.00 -0.57 0.00 0.09 0.00 0.00 57.88 57.36 2k6q h LEU 71 Cb 0.42 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 41.08 2k6q h LEU 71 CO 0.06 0.00 -0.93 0.00 0.09 0.00 0.00 178.44 177.66 2k6q n GLN 72 N -2.57 -0.52 -2.44 1.13 10.64 0.50 -4.91 117.38 119.22 2k6q n GLN 72 Ca 0.00 0.04 -0.24 0.00 -1.83 0.00 0.00 57.00 54.97 2k6q n GLN 72 Cb 0.19 -2.63 0.05 0.00 -0.86 0.00 0.00 30.24 26.99 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 -7.24 3.09 0.68 2.61 1.43 -1.23 -5.06 118.68 112.95 2k6q s LEU 73 Ca 0.28 0.29 -0.03 0.00 -1.03 0.00 0.00 54.13 53.65 2k6q s LEU 73 Cb -0.16 -3.06 0.08 0.00 0.03 0.00 0.00 46.19 43.08 2k6q s LEU 73 CO 0.92 -1.31 0.95 0.20 0.23 0.00 0.00 176.35 177.33 2k6q s ASN 74 N -4.44 4.70 0.00 2.29 -0.87 -1.26 -4.95 114.94 110.40 2k6q s ASN 74 Ca 0.58 0.01 0.18 0.00 -1.57 0.00 0.00 52.86 52.06 2k6q s ASN 74 Cb -0.11 -0.61 0.82 0.00 -0.02 0.00 0.00 41.25 41.34 2k6q s ASN 74 CO 0.42 -1.61 1.56 0.00 -2.57 0.00 0.00 177.10 174.89 2k6q n ALA 75 N -2.76 1.88 -0.03 0.60 0.00 -1.26 -2.15 120.51 116.79 2k6q n ALA 75 Ca 0.11 -0.07 -0.14 0.00 0.00 0.00 0.00 53.44 53.33 2k6q n ALA 75 Cb 0.60 -1.29 -0.14 0.00 0.00 0.00 0.00 19.45 18.62 2k6q n ALA 75 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2k6q n ASN 76 N -1.41 1.34 -4.76 0.00 3.02 -1.26 -4.92 115.26 107.27 2k6q n ASN 76 Ca 0.06 0.24 -0.37 0.00 -0.03 0.00 0.00 54.58 54.48 2k6q n ASN 76 Cb 0.18 -0.27 0.01 0.00 -0.61 0.00 0.00 39.78 39.10 2k6q n ASN 76 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 2k6q s GLN 77 N -2.56 3.43 -0.17 3.52 -0.44 -0.91 -5.02 119.66 117.50 2k6q s GLN 77 Ca -0.15 1.93 -0.03 0.00 -2.50 0.00 0.00 55.36 54.62 2k6q s GLN 77 Cb 0.07 -2.28 -0.02 0.00 -1.64 0.00 0.00 33.01 29.15 2k6q s GLN 77 CO 0.78 -0.87 -0.07 0.00 0.50 0.00 0.00 175.29 175.64 2k6q s ALA 78 N -1.48 2.82 -0.02 1.58 0.00 -1.26 -4.79 121.76 118.62 2k6q s ALA 78 Ca 0.68 -0.96 0.02 0.00 0.00 0.00 0.00 51.96 51.70 2k6q s ALA 78 Cb -0.33 -1.51 0.01 0.00 0.00 0.00 0.00 23.12 21.29 2k6q s ALA 78 CO 0.39 0.00 -0.06 0.12 0.00 0.00 0.00 175.76 176.20 2k6q s PHE 79 N 0.75 0.72 -0.11 0.00 5.36 -1.26 -3.99 117.98 119.45 2k6q s PHE 79 Ca -0.03 -0.17 -0.04 0.00 -0.96 0.00 0.00 56.93 55.74 2k6q s PHE 79 Cb -0.15 -0.55 0.06 0.00 -0.34 0.00 0.00 43.02 42.04 2k6q s PHE 79 CO 0.02 -0.09 0.16 -0.06 -1.46 0.00 0.00 175.22 173.79 2k6q s PHE 80 N 0.30 -0.15 -0.32 10.12 0.08 0.50 -4.99 117.98 123.52 2k6q s PHE 80 Ca -0.04 0.43 -0.24 0.00 0.12 0.00 0.00 56.93 57.20 2k6q s PHE 80 Cb -0.08 -0.33 0.01 0.00 -0.57 0.00 0.00 43.02 42.04 2k6q s PHE 80 CO 0.00 -0.36 0.83 -1.17 -0.10 0.00 0.00 175.22 174.43 2k6q s LEU 81 N 2.28 4.07 -0.26 -0.37 0.20 -1.26 -1.99 118.68 121.34 2k6q s LEU 81 Ca 0.04 0.65 -0.19 0.00 0.69 0.00 0.00 54.13 55.32 2k6q s LEU 81 Cb -0.13 -3.14 -0.02 0.00 -0.43 0.00 0.00 46.19 42.46 2k6q s LEU 81 CO -0.07 -0.69 0.56 -0.76 -0.29 0.00 0.00 176.35 175.10 2k6q s LEU 82 N 3.11 4.05 -0.42 -0.68 2.01 0.13 -4.22 118.68 122.67 2k6q s LEU 82 Ca 0.34 0.59 -0.24 0.00 0.01 0.00 0.00 54.13 54.83 2k6q s LEU 82 Cb -0.14 -2.74 0.02 0.00 0.01 0.00 0.00 46.19 43.35 2k6q s LEU 82 CO 0.14 -0.32 0.85 -0.69 1.01 0.00 0.00 176.35 177.34 2k6q s VAL 83 N 2.39 4.61 -0.16 -1.59 1.01 0.37 0.05 120.40 127.07 2k6q s VAL 83 Ca 0.23 0.76 0.00 0.00 0.00 0.00 0.00 61.98 62.97 2k6q s VAL 83 Cb -0.16 -4.33 0.00 0.00 0.00 0.00 0.00 36.38 31.90 2k6q s VAL 83 CO 0.09 -0.65 0.00 0.59 0.00 0.00 0.00 175.10 175.13 2k6q n ASN 84 N 6.78 -4.59 0.00 3.32 3.02 -0.48 -1.22 115.26 122.08 2k6q n ASN 84 Ca 0.04 0.04 0.00 0.00 -0.03 0.00 0.00 54.58 54.63 2k6q n ASN 84 Cb 0.48 -2.22 0.00 0.00 -0.61 0.00 0.00 39.78 37.43 2k6q n ASN 84 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2k6q n GLY 85 N -0.94 0.83 3.08 7.41 0.00 -1.23 -5.00 105.19 109.34 2k6q n GLY 85 Ca -0.01 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.74 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 1.75 1.23 1.61 -3.43 -0.36 -4.97 115.29 109.12 2k6q s HIS 86 Ca 0.00 -0.67 -0.16 0.00 -0.80 0.00 0.00 55.06 53.43 2k6q s HIS 86 Cb 0.00 -1.24 0.27 0.00 -1.43 0.00 0.00 32.58 30.18 2k6q s HIS 86 CO 0.00 -0.31 0.73 -1.13 -2.00 0.00 0.00 174.74 172.03 2k6q n SER 87 N 3.72 -2.49 -2.12 7.38 3.41 -1.26 0.14 113.62 122.40 2k6q n SER 87 Ca -0.22 -0.33 -0.26 0.00 -0.26 0.00 0.00 58.87 57.80 2k6q n SER 87 Cb 0.52 -1.11 0.02 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 -4.39 3.48 -0.68 4.33 0.00 -1.26 -4.61 117.12 113.99 2k6q n MET 88 Ca 0.04 -4.10 0.51 0.00 0.00 0.00 0.00 57.70 54.15 2k6q n MET 88 Cb 0.56 -2.28 0.79 0.00 0.00 0.00 0.00 33.22 32.29 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 -0.70 -0.02 -4.02 3.17 0.24 -1.26 -2.91 118.33 112.82 2k6q n VAL 89 Ca 0.46 1.49 -0.31 0.00 -2.04 0.00 0.00 64.34 63.93 2k6q n VAL 89 Cb 0.89 -2.47 -0.15 0.00 -1.47 0.00 0.00 33.84 30.64 2k6q n VAL 89 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 2k6q s SER 90 N -3.90 4.62 -0.72 -1.34 0.01 -1.26 -5.05 113.70 106.06 2k6q s SER 90 Ca -0.05 -1.89 -0.07 0.00 1.31 0.00 0.00 55.95 55.25 2k6q s SER 90 Cb 0.27 -1.57 0.19 0.00 0.21 0.00 0.00 66.02 65.12 2k6q s SER 90 CO 0.87 -0.32 0.59 0.54 0.41 0.00 0.00 173.24 175.33 2k6q s VAL 91 N 1.00 4.50 -0.05 3.43 0.11 -1.15 -4.77 120.40 123.47 2k6q s VAL 91 Ca 0.05 -2.83 0.08 0.00 -2.93 0.00 0.00 61.98 56.34 2k6q s VAL 91 Cb -0.19 -3.85 0.12 0.00 -1.53 0.00 0.00 36.38 30.93 2k6q s VAL 91 CO -0.08 -0.95 1.00 -1.20 -3.33 0.00 0.00 175.10 170.54 2k6q n SER 92 N 3.59 1.42 -4.20 3.54 7.64 -1.26 -4.90 113.62 119.45 2k6q n SER 92 Ca 0.11 -2.32 -0.22 0.00 1.01 0.00 0.00 58.87 57.45 2k6q n SER 92 Cb 0.41 -0.22 -0.13 0.00 -1.01 0.00 0.00 64.21 63.26 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 -1.41 1.37 0.34 0.44 2.01 -1.26 -5.11 115.64 112.03 2k6q s THR 93 Ca 0.13 -1.17 -0.27 0.00 0.31 0.00 0.00 61.69 60.70 2k6q s THR 93 Cb 0.11 -1.23 -0.09 0.00 0.01 0.00 0.00 72.50 71.30 2k6q s THR 93 CO 0.01 0.04 1.07 -2.16 -0.69 0.00 0.00 174.62 172.89 2k6q s PRO 94 N -1.31 4.39 0.64 4.92 0.04 -1.26 -2.79 135.00 139.63 2k6q s PRO 94 Ca 0.04 1.64 0.28 0.00 0.04 0.00 0.00 61.00 62.99 2k6q s PRO 94 Cb -0.09 -2.84 1.49 0.00 0.04 0.00 0.00 34.50 33.10 2k6q s PRO 94 CO 0.02 0.03 1.86 0.97 0.04 0.00 0.00 177.00 179.92 2k6q h ILE 95 N 2.61 0.10 -0.30 0.56 6.09 -1.80 0.70 117.51 125.47 2k6q h ILE 95 Ca -0.47 0.00 -0.16 0.00 -1.37 0.00 0.00 64.86 62.86 2k6q h ILE 95 Cb 1.21 0.61 -0.00 0.00 0.47 0.00 0.00 36.82 39.11 2k6q h ILE 95 CO 0.64 0.00 -0.43 0.77 -3.07 0.00 0.00 178.15 176.07 2k6q h SER 96 N 0.00 0.90 0.00 2.19 4.64 -1.85 -2.60 113.55 116.82 2k6q h SER 96 Ca 0.06 -0.51 -0.04 0.00 -0.47 0.00 0.00 61.79 60.84 2k6q h SER 96 Cb 0.89 -0.25 -0.01 0.00 -0.31 0.00 0.00 62.40 62.72 2k6q h SER 96 CO -0.00 1.23 -0.23 -0.33 -0.87 0.00 0.00 176.83 176.62 2k6q h GLU 97 N 0.59 0.00 -1.40 4.77 4.39 -0.14 -3.01 114.58 119.78 2k6q h GLU 97 Ca 0.03 0.00 0.41 0.00 0.34 0.00 0.00 59.36 60.14 2k6q h GLU 97 Cb 1.03 0.00 -0.06 0.00 -0.10 0.00 0.00 28.75 29.62 2k6q h GLU 97 CO 0.10 0.77 1.01 0.28 -1.16 0.00 0.00 179.01 180.01 2k6q h VAL 98 N -1.00 0.30 0.16 3.13 2.07 -0.67 1.52 116.25 121.76 2k6q h VAL 98 Ca -0.06 -0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.45 2k6q h VAL 98 Cb 0.84 0.30 0.00 0.00 -1.52 0.00 0.00 31.29 30.91 2k6q h VAL 98 CO -0.03 0.00 -0.07 0.22 0.02 0.00 0.00 177.57 177.70 2k6q h TYR 99 N 0.00 -0.19 0.00 1.57 5.03 -1.53 -2.28 116.97 119.57 2k6q h TYR 99 Ca 0.67 -0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.97 2k6q h TYR 99 Cb 2.67 0.06 0.00 0.00 1.55 0.00 0.00 36.73 41.02 2k6q h TYR 99 CO -0.00 0.15 0.00 -0.85 -1.32 0.00 0.00 178.16 176.14 2k6q n GLU 100 N -4.90 0.32 0.00 1.82 0.28 0.43 0.18 120.64 118.78 2k6q n GLU 100 Ca -0.06 0.09 0.09 0.00 -0.16 0.00 0.00 57.16 57.12 2k6q n GLU 100 Cb 0.22 -1.50 0.02 0.00 1.43 0.00 0.00 31.44 31.60 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 -1.23 1.95 0.11 -1.84 7.64 0.49 -4.74 113.62 116.01 2k6q n SER 101 Ca 0.10 -1.48 0.00 0.00 1.01 0.00 0.00 58.87 58.50 2k6q n SER 101 Cb 0.13 0.34 0.00 0.00 -1.01 0.00 0.00 64.21 63.67 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 0.22 0.00 -0.98 1.43 -0.58 -0.49 -4.99 120.64 115.24 2k6q n GLU 102 Ca 0.08 0.00 -0.34 0.00 -0.42 0.00 0.00 57.16 56.48 2k6q n GLU 102 Cb 0.40 -0.14 0.03 0.00 -0.57 0.00 0.00 31.44 31.15 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 -3.45 0.00 -3.52 3.49 -4.01 0.48 -4.98 116.66 104.67 2k6q n ARG 103 Ca 0.00 0.00 -0.23 0.00 -1.04 0.00 0.00 57.85 56.58 2k6q n ARG 103 Cb 0.01 -0.92 0.02 0.00 -3.04 0.00 0.00 32.46 28.53 2k6q n ARG 103 CO 0.00 0.00 0.00 0.34 -3.04 0.00 0.00 177.63 174.93 2k6q s ASP 104 N -0.92 4.86 0.47 2.89 2.15 -1.26 -4.85 116.67 120.02 2k6q s ASP 104 Ca 0.41 -1.04 0.31 0.00 0.43 0.00 0.00 52.55 52.66 2k6q s ASP 104 Cb -0.25 0.26 1.41 0.00 -0.30 0.00 0.00 42.92 44.04 2k6q s ASP 104 CO 0.72 -1.14 1.72 -0.33 -0.17 0.00 0.00 175.17 175.96 2k6q h GLU 105 N 0.56 0.14 -0.83 4.34 4.39 -1.96 0.46 114.58 121.67 2k6q h GLU 105 Ca -0.35 -0.01 0.21 0.00 0.34 0.00 0.00 59.36 59.56 2k6q h GLU 105 Cb 1.29 -0.03 -0.14 0.00 -0.10 0.00 0.00 28.75 29.78 2k6q h GLU 105 CO 0.51 0.09 0.15 0.38 -1.16 0.00 0.00 179.01 178.98 2k6q h ASP 106 N 0.14 -0.13 0.00 1.42 3.04 -1.96 -3.45 116.42 115.49 2k6q h ASP 106 Ca 0.68 0.20 0.00 0.00 -3.24 0.00 0.00 57.03 54.67 2k6q h ASP 106 Cb 2.28 0.29 0.00 0.00 -1.04 0.00 0.00 39.33 40.87 2k6q h ASP 106 CO -0.20 -0.16 0.00 0.61 -2.04 0.00 0.00 179.24 177.45 2k6q n GLY 107 N -1.40 1.43 2.80 7.15 0.00 0.16 -4.56 105.19 110.78 2k6q n GLY 107 Ca 0.18 -0.22 -0.18 0.00 0.00 0.00 0.00 46.02 45.81 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 0.31 0.50 1.61 2.19 -1.26 -4.71 117.98 114.62 2k6q s PHE 108 Ca 0.00 0.01 -0.18 0.00 0.33 0.00 0.00 56.93 57.09 2k6q s PHE 108 Cb 0.00 -0.44 -0.08 0.00 -1.31 0.00 0.00 43.02 41.19 2k6q s PHE 108 CO 0.00 -0.15 0.99 -0.51 1.83 0.00 0.00 175.22 177.38 2k6q s LEU 109 N 1.20 3.72 -0.22 6.12 1.43 -0.98 -4.27 118.68 125.67 2k6q s LEU 109 Ca -0.07 1.66 -0.03 0.00 -1.03 0.00 0.00 54.13 54.66 2k6q s LEU 109 Cb -0.13 -4.52 0.07 0.00 0.03 0.00 0.00 46.19 41.63 2k6q s LEU 109 CO -0.02 -0.61 0.06 -0.31 0.23 0.00 0.00 176.35 175.70 2k6q s TYR 110 N -2.42 1.03 0.02 0.29 2.02 -1.26 0.16 117.35 117.19 2k6q s TYR 110 Ca 0.61 -0.98 0.07 0.00 -0.37 0.00 0.00 57.07 56.40 2k6q s TYR 110 Cb -0.11 -1.11 -0.02 0.00 -0.40 0.00 0.00 41.96 40.32 2k6q s TYR 110 CO 0.26 -0.67 -0.20 -1.64 -1.57 0.00 0.00 175.55 171.73 2k6q s MET 111 N 1.85 1.46 -0.18 -0.62 -1.94 -0.17 -1.38 119.30 118.32 2k6q s MET 111 Ca 0.02 -0.84 -0.01 0.00 -1.71 0.00 0.00 55.69 53.15 2k6q s MET 111 Cb -0.17 -1.50 -0.00 0.00 2.01 0.00 0.00 34.83 35.17 2k6q s MET 111 CO -0.14 0.40 -0.13 0.08 -0.01 0.00 0.00 175.02 175.22 2k6q s VAL 112 N -0.67 2.79 0.11 -6.03 1.01 0.11 -1.74 120.40 115.98 2k6q s VAL 112 Ca 0.07 -0.71 0.03 0.00 0.00 0.00 0.00 61.98 61.37 2k6q s VAL 112 Cb -0.08 -2.21 -0.04 0.00 0.00 0.00 0.00 36.38 34.05 2k6q s VAL 112 CO 0.01 0.49 0.17 -0.72 0.00 0.00 0.00 175.10 175.05 2k6q s TYR 113 N 1.06 3.31 0.10 5.22 -0.85 -0.72 0.20 117.35 125.67 2k6q s TYR 113 Ca -0.00 0.10 -0.25 0.00 -0.52 0.00 0.00 57.07 56.39 2k6q s TYR 113 Cb -0.15 -1.63 0.09 0.00 0.38 0.00 0.00 41.96 40.65 2k6q s TYR 113 CO -0.03 0.53 1.13 0.00 -1.52 0.00 0.00 175.55 175.67 2k6q s ALA 114 N -1.59 -1.93 -0.28 9.51 0.00 -0.84 -2.54 121.76 124.08 2k6q s ALA 114 Ca 0.32 -0.07 0.03 0.00 0.00 0.00 0.00 51.96 52.24 2k6q s ALA 114 Cb -0.12 0.74 0.39 0.00 0.00 0.00 0.00 23.12 24.14 2k6q s ALA 114 CO 0.25 -1.09 1.52 0.45 0.00 0.00 0.00 175.76 176.89 2k6q n SER 115 N -1.03 3.45 -3.66 0.00 2.88 -1.26 -0.37 113.62 113.64 2k6q n SER 115 Ca -0.02 -2.91 -0.11 0.00 -1.33 0.00 0.00 58.87 54.50 2k6q n SER 115 Cb 0.60 -0.69 -0.11 0.00 -0.75 0.00 0.00 64.21 63.25 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 -1.92 0.25 0.00 -1.46 -0.21 -1.26 -4.85 119.66 110.21 2k6q s GLN 116 Ca 0.33 0.90 0.15 0.00 0.02 0.00 0.00 55.36 56.76 2k6q s GLN 116 Cb 0.28 0.16 -0.06 0.00 1.00 0.00 0.00 33.01 34.39 2k6q s GLN 116 CO 0.07 -0.26 0.78 -1.91 -2.12 0.00 0.00 175.29 171.84 2k6q n GLU 117 N 5.30 1.82 -2.73 2.91 2.13 -1.26 -4.53 120.64 124.28 2k6q n GLU 117 Ca -0.09 -0.54 -0.17 0.00 0.66 0.00 0.00 57.16 57.02 2k6q n GLU 117 Cb 0.50 -1.24 0.00 0.00 0.27 0.00 0.00 31.44 30.97 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 -0.52 1.38 0.01 6.31 -2.24 -1.26 -4.74 114.28 113.21 2k6q n THR 118 Ca 0.05 -4.09 -0.03 0.00 -2.27 0.00 0.00 64.05 57.71 2k6q n THR 118 Cb 0.30 -0.23 -0.11 0.00 -2.10 0.00 0.00 70.33 68.19 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 -0.13 0.92 0.00 4.78 -1.74 -1.26 -5.27 117.46 114.75 2k6q n PHE 119 Ca 0.22 0.32 0.00 0.00 -0.56 0.00 0.00 57.45 57.43 2k6q n PHE 119 Cb 0.70 -1.11 0.00 0.00 1.52 0.00 0.00 39.48 40.60 2k6q n PHE 119 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61