#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 1.23 -0.03 -1.46 1.00 -1.26 -4.97 119.30 113.82 2k6q s MET 1 Ca 0.00 -1.75 -0.23 0.00 0.00 0.00 0.00 55.69 53.71 2k6q s MET 1 Cb 0.00 -2.54 -0.22 0.00 0.00 0.00 0.00 34.83 32.07 2k6q s MET 1 CO 0.00 -1.05 1.09 -1.00 0.00 0.00 0.00 175.02 174.06 2k6q h PRO 2 N 7.34 0.25 -1.41 2.03 0.13 -2.15 -3.47 132.00 134.72 2k6q h PRO 2 Ca -0.07 -0.24 0.12 0.00 -0.87 0.00 0.00 66.00 64.95 2k6q h PRO 2 Cb 0.97 0.06 -0.29 0.00 0.13 0.00 0.00 31.00 31.88 2k6q h PRO 2 CO 0.51 0.93 0.54 0.45 -0.23 0.00 0.00 178.00 180.20 2k6q s SER 3 N -6.38 -0.35 -0.06 1.44 0.15 -1.26 -5.16 113.70 102.07 2k6q s SER 3 Ca -0.15 0.61 0.03 0.00 0.70 0.00 0.00 55.95 57.14 2k6q s SER 3 Cb 0.02 0.91 0.01 0.00 -1.71 0.00 0.00 66.02 65.25 2k6q s SER 3 CO 0.76 -0.10 -0.14 -0.70 1.20 0.00 0.00 173.24 174.26 2k6q s GLU 4 N 0.77 1.81 1.17 5.44 2.56 -1.26 -5.13 118.70 124.05 2k6q s GLU 4 Ca -0.03 -0.50 -0.17 0.00 0.00 0.00 0.00 54.97 54.28 2k6q s GLU 4 Cb -0.04 -1.50 0.23 0.00 2.00 0.00 0.00 34.13 34.83 2k6q s GLU 4 CO -0.12 0.09 0.49 1.63 -0.56 0.00 0.00 175.26 176.79 2k6q n LYS 5 N 3.61 -2.97 -4.29 4.30 5.02 -1.26 -5.02 118.16 117.55 2k6q n LYS 5 Ca -0.21 -0.88 -0.26 0.00 -2.02 0.00 0.00 58.31 54.94 2k6q n LYS 5 Cb 0.52 -1.67 -0.09 0.00 -0.02 0.00 0.00 35.03 33.78 2k6q n LYS 5 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 2k6q s THR 6 N -2.12 3.22 0.64 -0.18 -1.32 -1.26 -4.76 115.64 109.86 2k6q s THR 6 Ca 0.49 -1.71 0.24 0.00 -1.21 0.00 0.00 61.69 59.49 2k6q s THR 6 Cb -0.10 -2.62 0.27 0.00 -1.51 0.00 0.00 72.50 68.55 2k6q s THR 6 CO 0.46 -0.16 1.68 -0.26 -2.21 0.00 0.00 174.62 174.12 2k6q h PHE 7 N 2.72 0.00 0.11 9.09 -1.00 -1.95 1.89 116.94 127.80 2k6q h PHE 7 Ca -0.46 0.00 -0.28 0.00 2.81 0.00 0.00 57.97 60.04 2k6q h PHE 7 Cb 1.21 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.77 2k6q h PHE 7 CO 0.66 0.00 -1.31 1.57 -1.61 0.00 0.00 178.31 177.62 2k6q h LYS 8 N 0.00 0.23 0.00 1.51 5.09 -1.94 -3.30 116.57 118.16 2k6q h LYS 8 Ca 0.10 -0.39 0.00 0.00 0.09 0.00 0.00 60.65 60.46 2k6q h LYS 8 Cb 1.28 0.15 0.00 0.00 0.10 0.00 0.00 32.23 33.75 2k6q h LYS 8 CO -0.00 1.14 -0.37 1.04 -2.09 0.00 0.00 179.45 179.17 2k6q n GLN 9 N -3.47 0.24 0.00 0.07 6.02 0.49 -4.72 117.38 116.00 2k6q n GLN 9 Ca -0.10 0.23 0.00 0.00 -0.01 0.00 0.00 57.00 57.12 2k6q n GLN 9 Cb 1.02 -1.07 0.00 0.00 1.02 0.00 0.00 30.24 31.21 2k6q n GLN 9 CO 0.00 0.00 0.00 -2.13 -1.01 0.00 0.00 177.06 173.92 2k6q n ARG 10 N -3.42 0.00 -1.40 -1.09 3.00 0.53 -4.10 116.66 110.17 2k6q n ARG 10 Ca -0.05 0.54 -0.52 0.00 -0.00 0.00 0.00 57.85 57.82 2k6q n ARG 10 Cb 0.19 -0.99 -0.09 0.00 0.00 0.00 0.00 32.46 31.58 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 -1.34 0.67 -1.66 -0.14 3.00 -1.24 -4.80 116.66 111.15 2k6q n ARG 11 Ca 0.00 0.17 -0.47 0.00 -0.01 0.00 0.00 57.85 57.54 2k6q n ARG 11 Cb 0.00 -2.15 -0.04 0.00 0.00 0.00 0.00 32.46 30.26 2k6q n ARG 11 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 2k6q n SER 12 N 9.56 2.89 -0.32 0.55 2.88 -1.26 -4.76 113.62 123.16 2k6q n SER 12 Ca 0.47 1.09 0.19 0.00 -1.33 0.00 0.00 58.87 59.29 2k6q n SER 12 Cb 0.15 -1.39 0.39 0.00 -0.75 0.00 0.00 64.21 62.61 2k6q n SER 12 CO 0.00 0.00 0.00 0.15 -1.23 0.00 0.00 175.04 173.96 2k6q h PHE 13 N 5.70 0.66 -0.75 0.66 3.57 -1.87 0.90 116.94 125.81 2k6q h PHE 13 Ca -0.45 0.04 -0.06 0.00 3.53 0.00 0.00 57.97 61.03 2k6q h PHE 13 Cb 1.27 -0.14 -0.03 0.00 2.79 0.00 0.00 35.95 39.84 2k6q h PHE 13 CO 0.62 -0.20 0.24 0.93 -2.23 0.00 0.00 178.31 177.67 2k6q h GLU 14 N 0.27 1.16 -0.37 1.11 5.08 -1.99 0.16 114.58 120.00 2k6q h GLU 14 Ca 0.65 -0.25 -0.05 0.00 -1.00 0.00 0.00 59.36 58.72 2k6q h GLU 14 Cb 1.42 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 30.48 2k6q h GLU 14 CO -0.64 0.99 0.02 1.96 -1.00 0.00 0.00 179.01 180.34 2k6q h GLN 15 N 1.12 0.57 0.27 2.33 1.08 0.39 -1.84 115.11 119.03 2k6q h GLN 15 Ca 0.24 -0.12 -0.01 0.00 -1.45 0.00 0.00 58.65 57.31 2k6q h GLN 15 Cb 0.31 -0.08 0.00 0.00 -0.05 0.00 0.00 27.48 27.66 2k6q h GLN 15 CO -0.01 0.58 -0.13 -0.09 -0.95 0.00 0.00 178.83 178.23 2k6q h ARG 16 N 0.55 -0.35 -1.47 1.46 2.43 -0.45 -0.69 114.38 115.86 2k6q h ARG 16 Ca 0.12 0.02 0.43 0.00 -0.81 0.00 0.00 59.98 59.74 2k6q h ARG 16 Cb 0.32 0.08 -0.06 0.00 -0.42 0.00 0.00 29.97 29.89 2k6q h ARG 16 CO 0.01 -0.23 1.07 0.28 -1.51 0.00 0.00 179.97 179.58 2k6q h VAL 17 N -1.08 0.25 0.24 0.20 2.07 -0.71 1.43 116.25 118.66 2k6q h VAL 17 Ca -0.04 0.00 -0.34 0.00 0.82 0.00 0.00 66.70 67.14 2k6q h VAL 17 Cb 0.28 0.25 0.03 0.00 -1.52 0.00 0.00 31.29 30.33 2k6q h VAL 17 CO 0.06 0.00 -1.57 -0.08 0.02 0.00 0.00 177.57 176.00 2k6q h GLU 18 N 0.00 0.50 -0.13 1.57 4.81 -1.33 -2.25 114.58 117.75 2k6q h GLU 18 Ca 0.70 -0.86 -0.01 0.00 -0.13 0.00 0.00 59.36 59.06 2k6q h GLU 18 Cb 2.83 0.32 -0.01 0.00 0.63 0.00 0.00 28.75 32.52 2k6q h GLU 18 CO -0.01 1.41 0.05 0.22 -0.73 0.00 0.00 179.01 179.95 2k6q h ASP 19 N 0.14 0.16 0.41 1.04 1.82 0.34 -1.49 116.42 118.84 2k6q h ASP 19 Ca -0.29 -0.01 -0.31 0.00 -0.39 0.00 0.00 57.03 56.04 2k6q h ASP 19 Cb 2.16 -0.04 0.02 0.00 0.68 0.00 0.00 39.33 42.15 2k6q h ASP 19 CO 0.25 0.16 -1.36 0.58 -1.61 0.00 0.00 179.24 177.26 2k6q h VAL 20 N 0.18 1.37 -0.98 2.25 2.07 -0.72 -3.28 116.25 117.15 2k6q h VAL 20 Ca 0.05 -2.83 0.33 0.00 0.82 0.00 0.00 66.70 65.07 2k6q h VAL 20 Cb 0.05 2.97 -0.16 0.00 -1.52 0.00 0.00 31.29 32.63 2k6q h VAL 20 CO -0.00 0.84 0.44 -0.09 0.02 0.00 0.00 177.57 178.78 2k6q h ARG 21 N 0.13 0.16 0.42 1.57 2.43 -0.63 0.66 114.38 119.12 2k6q h ARG 21 Ca -0.20 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 58.94 2k6q h ARG 21 Cb 2.06 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 31.58 2k6q h ARG 21 CO 0.24 0.11 -0.20 -0.07 -1.51 0.00 0.00 179.97 178.54 2k6q h LEU 22 N 0.17 -0.48 -1.62 3.80 3.38 -1.60 0.27 115.31 119.22 2k6q h LEU 22 Ca 0.73 0.02 0.15 0.00 0.09 0.00 0.00 57.88 58.86 2k6q h LEU 22 Cb 1.72 0.12 -0.02 0.00 0.09 0.00 0.00 40.66 42.57 2k6q h LEU 22 CO -0.70 -0.28 0.68 -0.29 0.09 0.00 0.00 178.44 177.93 2k6q h ILE 23 N -0.69 0.20 0.14 1.22 6.09 -1.12 1.80 117.51 125.15 2k6q h ILE 23 Ca -0.06 0.00 -0.29 0.00 -1.37 0.00 0.00 64.86 63.14 2k6q h ILE 23 Cb 0.43 0.44 0.00 0.00 0.47 0.00 0.00 36.82 38.17 2k6q h ILE 23 CO 0.10 0.00 -1.35 0.03 -3.07 0.00 0.00 178.15 173.86 2k6q h ARG 24 N 0.00 0.29 -0.01 2.19 2.47 0.65 0.91 114.38 120.89 2k6q h ARG 24 Ca 0.24 -0.50 0.00 0.00 -1.26 0.00 0.00 59.98 58.47 2k6q h ARG 24 Cb 1.59 0.19 0.00 0.00 -1.65 0.00 0.00 29.97 30.10 2k6q h ARG 24 CO -0.00 1.21 -0.29 -0.85 0.56 0.00 0.00 179.97 180.60 2k6q n GLU 25 N -3.53 0.85 -0.01 0.04 0.28 0.49 -3.78 120.64 114.98 2k6q n GLU 25 Ca -0.12 -0.53 -0.05 0.00 -0.16 0.00 0.00 57.16 56.31 2k6q n GLU 25 Cb 1.04 -1.49 -0.02 0.00 1.43 0.00 0.00 31.44 32.40 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 -0.61 0.14 -3.84 3.44 6.02 0.49 -4.89 117.38 118.14 2k6q n GLN 26 Ca 0.12 0.06 -0.30 0.00 -0.01 0.00 0.00 57.00 56.87 2k6q n GLN 26 Cb 0.36 -0.75 -0.11 0.00 1.02 0.00 0.00 30.24 30.76 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 -2.18 3.65 0.20 1.08 3.76 0.32 -4.88 115.29 117.24 2k6q s HIS 27 Ca -0.09 -3.27 0.06 0.00 -0.15 0.00 0.00 55.06 51.61 2k6q s HIS 27 Cb 0.02 -2.84 0.11 0.00 1.11 0.00 0.00 32.58 30.98 2k6q s HIS 27 CO 0.12 -0.59 1.46 -1.00 -0.85 0.00 0.00 174.74 173.87 2k6q h PRO 28 N 5.56 0.11 -0.99 8.40 0.13 -1.64 -3.06 132.00 140.49 2k6q h PRO 28 Ca 0.15 -0.11 -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 2.08 -4.11 1.56 -2.24 -1.26 -4.83 114.28 101.80 2k6q n THR 29 Ca -0.02 -0.95 -0.14 0.00 -2.27 0.00 0.00 64.05 60.66 2k6q n THR 29 Cb 0.74 -0.72 -0.12 0.00 -2.10 0.00 0.00 70.33 68.13 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 -1.66 0.57 -0.30 -0.78 -0.14 -1.16 -2.90 119.74 113.37 2k6q s LYS 30 Ca 0.28 -0.69 -0.10 0.00 -1.36 0.00 0.00 55.97 54.10 2k6q s LYS 30 Cb 0.24 -0.41 -0.02 0.00 -1.68 0.00 0.00 37.83 35.96 2k6q s LYS 30 CO 0.06 0.08 0.16 0.42 -0.76 0.00 0.00 175.35 175.31 2k6q s ILE 31 N -1.14 4.77 0.14 2.17 -1.09 0.11 -4.90 121.20 121.26 2k6q s ILE 31 Ca -0.07 -0.26 -0.30 0.00 -2.23 0.00 0.00 60.65 57.80 2k6q s ILE 31 Cb -0.09 -3.38 -0.07 0.00 -1.58 0.00 0.00 42.46 37.35 2k6q s ILE 31 CO 0.01 0.13 1.14 -2.16 -1.23 0.00 0.00 174.94 172.82 2k6q s PRO 32 N 1.65 4.53 0.04 2.79 0.04 -1.26 -3.04 135.00 139.75 2k6q s PRO 32 Ca 0.05 1.74 -0.00 0.00 0.04 0.00 0.00 61.00 62.83 2k6q s PRO 32 Cb -0.17 -3.30 -0.03 0.00 0.04 0.00 0.00 34.50 31.04 2k6q s PRO 32 CO 0.07 -0.04 -0.03 0.14 0.04 0.00 0.00 177.00 177.17 2k6q s VAL 33 N 0.19 0.22 -0.35 -0.36 -7.23 -1.22 -1.59 120.40 110.06 2k6q s VAL 33 Ca 0.52 -1.38 0.03 0.00 -1.81 0.00 0.00 61.98 59.34 2k6q s VAL 33 Cb -0.29 -0.93 0.10 0.00 0.56 0.00 0.00 36.38 35.82 2k6q s VAL 33 CO 0.33 -0.74 0.09 -0.63 -0.31 0.00 0.00 175.10 173.84 2k6q s ILE 34 N -2.69 1.91 -0.37 -0.62 -1.09 0.42 -3.19 121.20 115.56 2k6q s ILE 34 Ca -0.04 -2.20 -0.22 0.00 -2.23 0.00 0.00 60.65 55.96 2k6q s ILE 34 Cb -0.01 -2.41 0.01 0.00 -1.58 0.00 0.00 42.46 38.47 2k6q s ILE 34 CO -0.05 -0.65 0.75 -0.63 -1.23 0.00 0.00 174.94 173.13 2k6q s ILE 35 N 0.96 4.76 0.19 2.92 -1.09 -0.48 -1.63 121.20 126.83 2k6q s ILE 35 Ca 0.11 0.75 0.09 0.00 -2.23 0.00 0.00 60.65 59.37 2k6q s ILE 35 Cb -0.19 -4.19 -0.04 0.00 -1.58 0.00 0.00 42.46 36.45 2k6q s ILE 35 CO -0.11 -0.44 -0.17 -1.61 -1.23 0.00 0.00 174.94 171.37 2k6q s GLU 36 N 3.03 1.35 0.35 2.79 2.02 -0.54 -4.32 118.70 123.39 2k6q s GLU 36 Ca 0.29 -1.52 -0.27 0.00 0.02 0.00 0.00 54.97 53.50 2k6q s GLU 36 Cb -0.13 -1.32 -0.09 0.00 0.10 0.00 0.00 34.13 32.68 2k6q s GLU 36 CO 0.17 0.25 1.16 -0.98 0.02 0.00 0.00 175.26 175.88 2k6q s ARG 37 N -3.18 4.29 0.32 1.61 1.70 -1.26 -2.60 118.95 119.83 2k6q s ARG 37 Ca 0.20 1.87 -0.29 0.00 -0.47 0.00 0.00 55.73 57.04 2k6q s ARG 37 Cb -0.04 -2.89 -0.10 0.00 -0.57 0.00 0.00 34.95 31.35 2k6q s ARG 37 CO 0.08 -0.12 1.39 -0.47 -1.08 0.00 0.00 175.30 175.09 2k6q s TYR 38 N -1.31 2.92 -0.57 5.89 6.14 -1.06 -4.84 117.35 124.52 2k6q s TYR 38 Ca 0.52 1.26 -0.27 0.00 0.64 0.00 0.00 57.07 59.22 2k6q s TYR 38 Cb -0.32 -3.80 -0.09 0.00 0.42 0.00 0.00 41.96 38.16 2k6q s TYR 38 CO 0.41 -2.35 2.46 0.36 0.64 0.00 0.00 175.55 177.08 2k6q n LYS 39 N 1.09 0.87 0.00 4.97 2.85 -1.26 0.84 118.16 127.52 2k6q n LYS 39 Ca 0.02 -0.01 0.00 0.00 -1.05 0.00 0.00 58.31 57.27 2k6q n LYS 39 Cb 0.41 -3.14 0.00 0.00 -0.65 0.00 0.00 35.03 31.65 2k6q n LYS 39 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2k6q n GLY 40 N 6.09 1.31 3.38 2.58 0.00 -1.26 -5.08 105.19 112.20 2k6q n GLY 40 Ca 0.42 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 46.02 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 -0.13 2.83 -0.06 1.61 2.56 0.25 -4.86 118.70 120.90 2k6q s GLU 41 Ca 0.00 -1.13 0.02 0.00 0.00 0.00 0.00 54.97 53.85 2k6q s GLU 41 Cb 0.00 -3.81 -0.05 0.00 2.00 0.00 0.00 34.13 32.27 2k6q s GLU 41 CO 0.00 -0.76 -0.04 0.36 -0.56 0.00 0.00 175.26 174.26 2k6q n LYS 42 N 5.03 1.03 0.00 4.30 0.00 -1.26 -4.72 118.16 122.53 2k6q n LYS 42 Ca -0.11 0.03 0.00 0.00 -0.00 0.00 0.00 58.31 58.22 2k6q n LYS 42 Cb 0.46 -1.13 0.00 0.00 -0.00 0.00 0.00 35.03 34.36 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 -2.54 0.00 -1.61 -1.58 6.02 -1.26 -4.46 117.38 111.95 2k6q n GLN 43 Ca -0.10 0.55 -0.37 0.00 -0.01 0.00 0.00 57.00 57.07 2k6q n GLN 43 Cb 0.63 -1.02 0.07 0.00 1.02 0.00 0.00 30.24 30.94 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 -1.31 4.87 -4.79 1.08 4.77 -1.26 -4.98 117.00 115.38 2k6q n LEU 44 Ca 0.00 0.78 -0.29 0.00 -0.03 0.00 0.00 56.01 56.47 2k6q n LEU 44 Cb 0.00 -1.48 0.11 0.00 -2.33 0.00 0.00 43.42 39.73 2k6q n LEU 44 CO 0.00 -1.47 0.71 -2.16 -1.33 0.00 0.00 177.39 173.14 2k6q s PRO 45 N -3.21 1.59 -0.27 3.23 0.04 -1.26 -4.99 135.00 130.12 2k6q s PRO 45 Ca 0.79 0.46 -0.28 0.00 0.04 0.00 0.00 61.00 62.01 2k6q s PRO 45 Cb -0.38 -1.88 0.01 0.00 0.04 0.00 0.00 34.50 32.29 2k6q s PRO 45 CO 0.44 -1.92 0.99 0.08 0.04 0.00 0.00 177.00 176.63 2k6q s VAL 46 N -3.22 4.66 0.35 -0.36 1.01 -1.26 -4.97 120.40 116.61 2k6q s VAL 46 Ca 0.62 1.76 -0.24 0.00 0.00 0.00 0.00 61.98 64.13 2k6q s VAL 46 Cb -0.15 -4.30 -0.15 0.00 0.00 0.00 0.00 36.38 31.79 2k6q s VAL 46 CO 0.54 -0.28 0.39 -0.11 0.00 0.00 0.00 175.10 175.64 2k6q n LEU 47 N 6.45 -1.30 -0.29 3.92 -0.00 -1.26 -4.77 117.00 119.75 2k6q n LEU 47 Ca 0.10 0.94 0.12 0.00 -0.00 0.00 0.00 56.01 57.18 2k6q n LEU 47 Cb 0.47 -1.00 0.28 0.00 -0.00 0.00 0.00 43.42 43.17 2k6q n LEU 47 CO 0.54 -3.32 0.95 -0.78 -0.00 0.00 0.00 177.39 174.77 2k6q h ASP 48 N 0.74 0.03 -2.69 1.96 3.58 -1.93 -3.44 116.42 114.67 2k6q h ASP 48 Ca -0.36 0.19 -0.13 0.00 0.42 0.00 0.00 57.03 57.15 2k6q h ASP 48 Cb 1.42 0.25 -0.03 0.00 1.72 0.00 0.00 39.33 42.69 2k6q h ASP 48 CO 0.52 -0.13 -0.06 2.29 -2.88 0.00 0.00 179.24 178.98 2k6q n LYS 49 N -5.20 0.35 -0.02 0.28 2.85 -1.26 -5.07 118.16 110.08 2k6q n LYS 49 Ca 0.21 -1.32 -0.00 0.00 -1.05 0.00 0.00 58.31 56.14 2k6q n LYS 49 Cb 0.66 1.29 -0.05 0.00 -0.65 0.00 0.00 35.03 36.27 2k6q n LYS 49 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 177.40 179.76 2k6q n THR 50 N -0.27 0.26 -3.09 0.58 -1.04 -1.26 -4.77 114.28 104.68 2k6q n THR 50 Ca 0.00 -0.23 -0.39 0.00 -2.04 0.00 0.00 64.05 61.39 2k6q n THR 50 Cb 0.28 -0.33 -0.05 0.00 -1.82 0.00 0.00 70.33 68.41 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 -2.30 4.39 -0.03 -2.82 1.02 -1.26 -1.39 119.74 117.35 2k6q s LYS 51 Ca -0.03 0.78 -0.00 0.00 0.02 0.00 0.00 55.97 56.74 2k6q s LYS 51 Cb 0.03 -3.47 0.03 0.00 -0.52 0.00 0.00 37.83 33.91 2k6q s LYS 51 CO 0.28 0.03 0.05 -0.06 -0.92 0.00 0.00 175.35 174.73 2k6q s PHE 52 N 0.96 0.00 -0.51 3.18 0.40 -1.19 -5.02 117.98 115.80 2k6q s PHE 52 Ca 0.35 0.18 -0.18 0.00 -0.60 0.00 0.00 56.93 56.68 2k6q s PHE 52 Cb -0.17 -0.21 0.07 0.00 0.51 0.00 0.00 43.02 43.22 2k6q s PHE 52 CO 0.16 -0.10 0.55 -0.51 0.70 0.00 0.00 175.22 176.02 2k6q s LEU 53 N 1.06 5.30 -0.05 -0.37 1.43 -1.26 -3.44 118.68 121.35 2k6q s LEU 53 Ca -0.09 -1.16 -0.03 0.00 -1.03 0.00 0.00 54.13 51.82 2k6q s LEU 53 Cb -0.12 -2.33 -0.04 0.00 0.03 0.00 0.00 46.19 43.73 2k6q s LEU 53 CO -0.03 -0.84 0.12 0.54 0.23 0.00 0.00 176.35 176.36 2k6q s VAL 54 N 2.26 5.10 0.19 -1.59 0.11 -1.17 -4.92 120.40 120.38 2k6q s VAL 54 Ca 0.10 -0.15 -0.30 0.00 -2.93 0.00 0.00 61.98 58.70 2k6q s VAL 54 Cb -0.22 -3.30 -0.08 0.00 -1.53 0.00 0.00 36.38 31.25 2k6q s VAL 54 CO 0.09 0.44 1.11 -2.16 -3.33 0.00 0.00 175.10 171.26 2k6q s PRO 55 N -1.51 4.58 -0.30 1.54 0.04 -1.26 0.10 135.00 138.19 2k6q s PRO 55 Ca 0.21 1.75 -0.03 0.00 0.04 0.00 0.00 61.00 62.97 2k6q s PRO 55 Cb -0.12 -3.26 0.03 0.00 0.04 0.00 0.00 34.50 31.19 2k6q s PRO 55 CO 0.11 0.06 2.68 -0.40 0.04 0.00 0.00 177.00 179.49 2k6q n ASP 56 N 2.30 6.15 -0.71 6.66 5.75 -1.14 -3.46 116.55 132.10 2k6q n ASP 56 Ca 0.03 -2.97 -0.00 0.00 -0.01 0.00 0.00 54.79 51.83 2k6q n ASP 56 Cb 0.46 -1.21 -0.01 0.00 -1.03 0.00 0.00 41.12 39.33 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 1.09 0.00 -3.62 2.11 1.44 -1.26 -4.85 115.22 110.13 2k6q n HIS 57 Ca 0.39 -0.14 0.00 0.00 -2.01 0.00 0.00 57.72 55.97 2k6q n HIS 57 Cb 0.63 0.10 0.00 0.00 0.12 0.00 0.00 29.99 30.84 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 0.07 0.00 -4.39 0.61 0.24 -1.22 -5.11 118.33 108.53 2k6q n VAL 58 Ca -0.03 0.00 -0.30 0.00 -2.04 0.00 0.00 64.34 61.97 2k6q n VAL 58 Cb 0.70 0.00 -0.11 0.00 -1.47 0.00 0.00 33.84 32.96 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 -0.24 4.24 0.60 -1.34 4.22 -1.26 -3.12 114.94 118.04 2k6q s ASN 59 Ca 0.00 -0.37 0.28 0.00 -2.14 0.00 0.00 52.86 50.63 2k6q s ASN 59 Cb 0.00 -0.80 1.21 0.00 1.28 0.00 0.00 41.25 42.95 2k6q s ASN 59 CO 0.00 0.22 1.60 0.00 -2.04 0.00 0.00 177.10 176.88 2k6q h MET 60 N 4.03 0.00 0.22 3.55 -0.00 -1.80 0.19 114.93 121.12 2k6q h MET 60 Ca -0.49 0.00 0.01 0.00 -0.00 0.00 0.00 59.70 59.22 2k6q h MET 60 Cb 1.16 0.00 -0.02 0.00 -0.00 0.00 0.00 31.60 32.74 2k6q h MET 60 CO 0.51 0.00 -0.27 1.03 -0.00 0.00 0.00 176.91 178.18 2k6q h SER 61 N 0.00 -0.73 -0.80 -0.10 0.87 -1.89 -2.75 113.55 108.14 2k6q h SER 61 Ca 0.35 0.07 0.10 0.00 -1.23 0.00 0.00 61.79 61.09 2k6q h SER 61 Cb 2.06 0.26 -0.12 0.00 -0.44 0.00 0.00 62.40 64.16 2k6q h SER 61 CO -0.00 -0.38 -0.48 -0.33 -0.53 0.00 0.00 176.83 175.11 2k6q h GLU 62 N -0.54 -0.11 -0.99 2.24 5.08 -1.03 0.88 114.58 120.11 2k6q h GLU 62 Ca 0.00 0.01 0.34 0.00 -1.00 0.00 0.00 59.36 58.71 2k6q h GLU 62 Cb 0.52 0.02 -0.18 0.00 0.50 0.00 0.00 28.75 29.62 2k6q h GLU 62 CO -0.09 -0.07 0.31 1.25 -1.00 0.00 0.00 179.01 179.41 2k6q h LEU 63 N -0.11 -0.02 0.48 1.33 6.46 -1.57 0.95 115.31 122.82 2k6q h LEU 63 Ca 0.21 0.26 -0.02 0.00 -0.12 0.00 0.00 57.88 58.21 2k6q h LEU 63 Cb 0.53 0.35 0.00 0.00 -0.73 0.00 0.00 40.66 40.82 2k6q h LEU 63 CO -0.84 -0.37 -0.24 0.40 -0.62 0.00 0.00 178.44 176.77 2k6q h ILE 64 N 0.03 0.51 0.00 4.05 1.08 0.88 0.46 117.51 124.52 2k6q h ILE 64 Ca 0.72 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 65.19 2k6q h ILE 64 Cb 1.73 0.51 0.00 0.00 -3.07 0.00 0.00 36.82 35.99 2k6q h ILE 64 CO -0.82 0.00 0.13 0.11 -0.69 0.00 0.00 178.15 176.88 2k6q h LYS 65 N -0.66 0.00 0.18 2.37 1.57 0.14 0.29 116.57 120.46 2k6q h LYS 65 Ca -0.06 0.00 -0.35 0.00 -1.87 0.00 0.00 60.65 58.37 2k6q h LYS 65 Cb 0.51 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.83 2k6q h LYS 65 CO 0.10 0.00 -1.72 0.82 -0.57 0.00 0.00 179.45 178.08 2k6q h ILE 66 N 0.00 0.98 0.18 1.86 1.08 0.12 -3.18 117.51 118.55 2k6q h ILE 66 Ca 0.00 -2.55 -0.01 0.00 -0.39 0.00 0.00 64.86 61.91 2k6q h ILE 66 Cb 0.26 2.78 0.00 0.00 -3.07 0.00 0.00 36.82 36.79 2k6q h ILE 66 CO 0.00 0.85 -0.09 0.40 -0.69 0.00 0.00 178.15 178.62 2k6q h ILE 67 N 0.11 0.93 -0.11 -0.67 1.08 0.31 -2.56 117.51 116.59 2k6q h ILE 67 Ca -0.33 -0.74 0.03 0.00 -0.39 0.00 0.00 64.86 63.43 2k6q h ILE 67 Cb 2.10 1.36 -0.00 0.00 -3.07 0.00 0.00 36.82 37.20 2k6q h ILE 67 CO 0.18 0.16 0.30 0.08 -0.69 0.00 0.00 178.15 178.19 2k6q h ARG 68 N -0.62 0.00 0.00 2.37 0.11 -0.77 0.75 114.38 116.22 2k6q h ARG 68 Ca -0.03 0.00 -0.17 0.00 0.10 0.00 0.00 59.98 59.89 2k6q h ARG 68 Cb 0.46 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 31.51 2k6q h ARG 68 CO 0.04 0.00 -0.79 0.00 0.10 0.00 0.00 179.97 179.32 2k6q h ARG 69 N 0.00 0.00 0.08 0.08 2.47 -1.44 -2.28 114.38 113.29 2k6q h ARG 69 Ca 0.05 0.00 -0.29 0.00 -1.26 0.00 0.00 59.98 58.48 2k6q h ARG 69 Cb 0.66 0.00 0.03 0.00 -1.65 0.00 0.00 29.97 29.01 2k6q h ARG 69 CO -0.00 0.79 -1.19 0.00 0.56 0.00 0.00 179.97 180.13 2k6q h ARG 70 N 0.00 0.65 0.00 0.04 2.47 0.73 -3.04 114.38 115.22 2k6q h ARG 70 Ca -0.01 -0.81 0.00 0.00 -1.26 0.00 0.00 59.98 57.90 2k6q h ARG 70 Cb 1.47 0.26 0.00 0.00 -1.65 0.00 0.00 29.97 30.04 2k6q h ARG 70 CO 0.10 1.36 0.00 1.28 0.56 0.00 0.00 179.97 183.28 2k6q n LEU 71 N -3.81 0.00 -4.28 3.04 4.77 -0.73 -4.73 117.00 111.26 2k6q n LEU 71 Ca -0.13 0.33 -0.35 0.00 -0.03 0.00 0.00 56.01 55.84 2k6q n LEU 71 Cb 0.96 -0.33 -0.08 0.00 -2.33 0.00 0.00 43.42 41.63 2k6q n LEU 71 CO 0.57 -0.04 -0.30 0.00 -1.33 0.00 0.00 177.39 176.30 2k6q n GLN 72 N -1.33 -0.84 -2.12 3.23 10.64 -0.86 -4.89 117.38 121.21 2k6q n GLN 72 Ca 0.11 0.11 -0.27 0.00 -1.83 0.00 0.00 57.00 55.12 2k6q n GLN 72 Cb 0.23 -3.88 0.13 0.00 -0.86 0.00 0.00 30.24 25.86 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 -6.97 2.76 0.00 2.61 1.43 -1.19 -5.07 118.68 112.24 2k6q s LEU 73 Ca 0.39 0.28 0.01 0.00 -1.03 0.00 0.00 54.13 53.78 2k6q s LEU 73 Cb -0.23 -2.60 -0.00 0.00 0.03 0.00 0.00 46.19 43.39 2k6q s LEU 73 CO 0.95 -2.15 0.03 -3.20 0.23 0.00 0.00 176.35 172.20 2k6q n ASN 74 N -3.31 0.92 -0.02 2.29 2.85 -1.26 -4.99 115.26 111.75 2k6q n ASN 74 Ca 0.12 -1.38 0.00 0.00 -0.11 0.00 0.00 54.58 53.22 2k6q n ASN 74 Cb 0.60 0.19 0.31 0.00 1.24 0.00 0.00 39.78 42.11 2k6q n ASN 74 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2k6q h ALA 75 N 1.12 1.41 -0.84 5.20 0.00 -2.03 -1.69 119.26 122.43 2k6q h ALA 75 Ca -0.05 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.68 2k6q h ALA 75 Cb 0.21 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.80 2k6q h ALA 75 CO 0.09 0.42 0.51 -0.91 0.00 0.00 0.00 179.25 179.35 2k6q h ASN 76 N 0.55 1.01 -3.05 0.00 2.35 -2.04 -3.41 115.58 110.99 2k6q h ASN 76 Ca 0.13 -0.06 -0.61 0.00 -0.55 0.00 0.00 56.30 55.21 2k6q h ASN 76 Cb 0.25 -0.25 -0.06 0.00 0.05 0.00 0.00 38.32 38.31 2k6q h ASN 76 CO 0.00 0.77 -0.22 -1.58 -1.65 0.00 0.00 177.43 174.75 2k6q s GLN 77 N -5.85 3.97 -0.14 0.81 2.00 -0.64 -5.08 119.66 114.73 2k6q s GLN 77 Ca -0.12 0.36 -0.05 0.00 -2.00 0.00 0.00 55.36 53.55 2k6q s GLN 77 Cb 0.17 -3.26 -0.04 0.00 0.80 0.00 0.00 33.01 30.69 2k6q s GLN 77 CO 0.81 0.60 0.05 0.00 -0.50 0.00 0.00 175.29 176.25 2k6q s ALA 78 N -0.75 3.44 -0.02 1.58 0.00 -1.26 -4.34 121.76 120.41 2k6q s ALA 78 Ca 0.23 -0.75 0.01 0.00 0.00 0.00 0.00 51.96 51.45 2k6q s ALA 78 Cb -0.16 -1.77 0.01 0.00 0.00 0.00 0.00 23.12 21.20 2k6q s ALA 78 CO 0.12 0.40 -0.03 0.12 0.00 0.00 0.00 175.76 176.37 2k6q s PHE 79 N -0.31 0.48 -0.13 0.00 5.36 -1.26 -4.07 117.98 118.05 2k6q s PHE 79 Ca 0.08 -0.09 -0.04 0.00 -0.96 0.00 0.00 56.93 55.93 2k6q s PHE 79 Cb -0.12 -0.44 0.06 0.00 -0.34 0.00 0.00 43.02 42.19 2k6q s PHE 79 CO 0.02 -0.10 0.17 -0.06 -1.46 0.00 0.00 175.22 173.78 2k6q s PHE 80 N 0.58 -0.15 -0.36 10.12 0.08 0.32 -4.99 117.98 123.58 2k6q s PHE 80 Ca -0.07 0.36 -0.25 0.00 0.12 0.00 0.00 56.93 57.10 2k6q s PHE 80 Cb -0.10 -0.35 0.01 0.00 -0.57 0.00 0.00 43.02 42.01 2k6q s PHE 80 CO -0.01 -0.40 0.88 -1.17 -0.10 0.00 0.00 175.22 174.42 2k6q s LEU 81 N 2.28 4.04 -0.32 -0.37 0.20 -1.26 -1.91 118.68 121.33 2k6q s LEU 81 Ca 0.04 0.54 -0.23 0.00 0.69 0.00 0.00 54.13 55.17 2k6q s LEU 81 Cb -0.14 -3.20 0.00 0.00 -0.43 0.00 0.00 46.19 42.43 2k6q s LEU 81 CO -0.08 -0.81 0.78 -0.76 -0.29 0.00 0.00 176.35 175.19 2k6q s LEU 82 N 3.35 4.10 -0.58 -0.68 2.01 0.15 -4.24 118.68 122.78 2k6q s LEU 82 Ca 0.36 0.57 -0.28 0.00 0.01 0.00 0.00 54.13 54.80 2k6q s LEU 82 Cb -0.12 -3.05 0.01 0.00 0.01 0.00 0.00 46.19 43.04 2k6q s LEU 82 CO 0.18 -0.64 1.41 -0.69 1.01 0.00 0.00 176.35 177.61 2k6q s VAL 83 N 2.98 3.78 0.00 -1.59 1.01 0.48 -0.46 120.40 126.60 2k6q s VAL 83 Ca 0.32 0.64 0.00 0.00 0.00 0.00 0.00 61.98 62.94 2k6q s VAL 83 Cb -0.14 -4.48 0.00 0.00 0.00 0.00 0.00 36.38 31.77 2k6q s VAL 83 CO 0.14 -1.23 0.00 0.59 0.00 0.00 0.00 175.10 174.60 2k6q n ASN 84 N 9.62 -3.72 0.00 3.32 3.02 -0.50 -1.33 115.26 125.67 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 0.49 -1.88 0.00 0.00 -0.61 0.00 0.00 39.78 37.78 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 -1.16 0.83 3.21 7.41 0.00 -1.12 -4.97 105.19 109.39 2k6q n GLY 85 Ca 0.00 0.00 -0.32 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 -2.00 2.66 1.22 1.61 -3.43 -0.44 -4.92 115.29 109.99 2k6q s HIS 86 Ca 0.00 -1.17 -0.16 0.00 -0.80 0.00 0.00 55.06 52.93 2k6q s HIS 86 Cb 0.00 -1.79 0.27 0.00 -1.43 0.00 0.00 32.58 29.62 2k6q s HIS 86 CO 0.00 -0.51 0.70 0.45 -2.00 0.00 0.00 174.74 173.38 2k6q n SER 87 N 3.85 -2.47 -2.15 7.38 2.88 -1.26 0.18 113.62 122.03 2k6q n SER 87 Ca -0.19 -0.32 -0.26 0.00 -1.33 0.00 0.00 58.87 56.77 2k6q n SER 87 Cb 0.52 -1.11 0.02 0.00 -0.75 0.00 0.00 64.21 62.90 2k6q n SER 87 CO 0.00 0.00 0.00 1.15 -1.23 0.00 0.00 175.04 174.96 2k6q n MET 88 N -4.29 3.50 -0.63 -1.46 0.00 -1.26 -4.60 117.12 108.39 2k6q n MET 88 Ca 0.04 -4.17 0.48 0.00 0.00 0.00 0.00 57.70 54.05 2k6q n MET 88 Cb 0.56 -2.27 0.75 0.00 0.00 0.00 0.00 33.22 32.25 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 -0.67 -0.04 -4.00 3.17 3.14 -1.26 -2.87 118.33 115.79 2k6q n VAL 89 Ca 0.44 1.44 -0.31 0.00 -2.96 0.00 0.00 64.34 62.96 2k6q n VAL 89 Cb 0.87 -2.40 -0.15 0.00 -1.06 0.00 0.00 33.84 31.10 2k6q n VAL 89 CO 0.00 0.00 0.00 -0.44 -6.46 0.00 0.00 176.83 169.93 2k6q s SER 90 N -3.94 4.55 -0.75 6.55 0.01 -1.26 -5.05 113.70 113.81 2k6q s SER 90 Ca -0.05 -1.84 -0.07 0.00 1.31 0.00 0.00 55.95 55.30 2k6q s SER 90 Cb 0.26 -1.51 0.19 0.00 0.21 0.00 0.00 66.02 65.17 2k6q s SER 90 CO 0.82 -0.32 0.62 0.54 0.41 0.00 0.00 173.24 175.32 2k6q s VAL 91 N 1.05 4.56 -0.06 3.43 0.11 -1.14 -4.76 120.40 123.59 2k6q s VAL 91 Ca 0.04 -2.92 0.09 0.00 -2.93 0.00 0.00 61.98 56.27 2k6q s VAL 91 Cb -0.19 -3.88 0.14 0.00 -1.53 0.00 0.00 36.38 30.93 2k6q s VAL 91 CO -0.08 -0.97 1.03 -0.24 -3.33 0.00 0.00 175.10 171.51 2k6q n SER 92 N 3.48 1.49 -4.19 3.54 2.88 -1.26 -4.87 113.62 114.69 2k6q n SER 92 Ca 0.12 -2.46 -0.23 0.00 -1.33 0.00 0.00 58.87 54.98 2k6q n SER 92 Cb 0.41 -0.27 -0.14 0.00 -0.75 0.00 0.00 64.21 63.47 2k6q n SER 92 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 2k6q s THR 93 N -1.59 1.36 0.24 2.46 2.01 -1.26 -5.11 115.64 113.76 2k6q s THR 93 Ca 0.16 -1.06 -0.30 0.00 0.31 0.00 0.00 61.69 60.81 2k6q s THR 93 Cb 0.14 -1.20 -0.09 0.00 0.01 0.00 0.00 72.50 71.36 2k6q s THR 93 CO 0.01 0.12 1.09 -2.16 -0.69 0.00 0.00 174.62 173.00 2k6q s PRO 94 N -1.09 4.64 0.59 4.92 0.04 -1.26 -2.75 135.00 140.09 2k6q s PRO 94 Ca 0.05 1.76 0.30 0.00 0.04 0.00 0.00 61.00 63.14 2k6q s PRO 94 Cb -0.08 -3.22 1.31 0.00 0.04 0.00 0.00 34.50 32.55 2k6q s PRO 94 CO 0.01 0.19 1.67 0.97 0.04 0.00 0.00 177.00 179.88 2k6q h ILE 95 N 3.30 0.22 -0.58 0.56 6.09 -1.80 1.04 117.51 126.34 2k6q h ILE 95 Ca -0.46 0.00 -0.01 0.00 -1.37 0.00 0.00 64.86 63.02 2k6q h ILE 95 Cb 1.21 0.36 -0.03 0.00 0.47 0.00 0.00 36.82 38.83 2k6q h ILE 95 CO 0.69 0.00 0.32 0.77 -3.07 0.00 0.00 178.15 176.86 2k6q h SER 96 N 0.00 0.72 0.00 2.19 4.64 -1.87 -1.56 113.55 117.67 2k6q h SER 96 Ca 0.38 -0.09 -0.01 0.00 -0.47 0.00 0.00 61.79 61.60 2k6q h SER 96 Cb 2.00 -0.18 -0.00 0.00 -0.31 0.00 0.00 62.40 63.90 2k6q h SER 96 CO -0.00 0.60 -0.09 -0.33 -0.87 0.00 0.00 176.83 176.13 2k6q h GLU 97 N 0.78 0.00 -1.83 4.77 5.08 0.67 -2.72 114.58 121.34 2k6q h GLU 97 Ca 0.20 0.00 0.53 0.00 -1.00 0.00 0.00 59.36 59.09 2k6q h GLU 97 Cb 0.04 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 29.21 2k6q h GLU 97 CO -0.03 0.41 1.31 0.28 -1.00 0.00 0.00 179.01 179.98 2k6q h VAL 98 N -1.00 0.08 0.06 3.13 2.07 -1.11 1.30 116.25 120.80 2k6q h VAL 98 Ca -0.02 -0.00 -0.11 0.00 0.82 0.00 0.00 66.70 67.39 2k6q h VAL 98 Cb 0.46 0.08 0.01 0.00 -1.52 0.00 0.00 31.29 30.32 2k6q h VAL 98 CO -0.01 0.00 -0.52 0.22 0.02 0.00 0.00 177.57 177.28 2k6q h TYR 99 N 0.00 0.25 0.00 1.57 5.03 -1.35 -1.82 116.97 120.65 2k6q h TYR 99 Ca 0.87 -0.18 0.00 0.00 2.58 0.00 0.00 58.73 62.00 2k6q h TYR 99 Cb 3.49 -0.01 0.00 0.00 1.55 0.00 0.00 36.73 41.76 2k6q h TYR 99 CO -0.00 1.20 0.00 -0.85 -1.32 0.00 0.00 178.16 177.19 2k6q n GLU 100 N -4.35 0.35 -0.00 1.82 0.28 0.37 0.19 120.64 119.30 2k6q n GLU 100 Ca -0.14 0.08 0.04 0.00 -0.16 0.00 0.00 57.16 56.99 2k6q n GLU 100 Cb 0.66 -1.50 -0.06 0.00 1.43 0.00 0.00 31.44 31.98 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 -1.22 0.73 0.04 -1.84 7.64 0.30 -4.78 113.62 114.49 2k6q n SER 101 Ca 0.10 -0.63 0.00 0.00 1.01 0.00 0.00 58.87 59.35 2k6q n SER 101 Cb 0.13 1.05 0.00 0.00 -1.01 0.00 0.00 64.21 64.38 2k6q n SER 101 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2k6q n GLU 102 N -1.30 0.00 -1.04 1.43 -0.58 -0.69 -5.03 120.64 113.43 2k6q n GLU 102 Ca 0.01 0.00 -0.34 0.00 -0.42 0.00 0.00 57.16 56.42 2k6q n GLU 102 Cb 0.16 -0.47 0.02 0.00 -0.57 0.00 0.00 31.44 30.57 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 -3.37 0.00 -2.91 3.49 -4.01 0.51 -4.98 116.66 105.38 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 -0.88 -0.01 0.00 -3.04 0.00 0.00 32.46 28.65 2k6q n ARG 103 CO 0.00 0.00 0.00 -3.47 -3.04 0.00 0.00 177.63 171.12 2k6q n ASP 104 N 2.41 2.14 -0.28 2.89 4.64 -1.26 -4.87 116.55 122.21 2k6q n ASP 104 Ca 0.05 -2.06 0.09 0.00 -1.38 0.00 0.00 54.79 51.49 2k6q n ASP 104 Cb 0.43 0.03 0.21 0.00 -1.04 0.00 0.00 41.12 40.75 2k6q n ASP 104 CO 0.00 0.00 0.00 -0.33 -0.82 0.00 0.00 177.20 176.05 2k6q h GLU 105 N 0.00 0.12 -1.00 -0.67 5.08 -1.95 0.28 114.58 116.44 2k6q h GLU 105 Ca -0.20 -0.01 0.21 0.00 -1.00 0.00 0.00 59.36 58.37 2k6q h GLU 105 Cb 0.68 -0.03 -0.19 0.00 0.50 0.00 0.00 28.75 29.72 2k6q h GLU 105 CO 0.31 0.08 -0.21 -0.40 -1.00 0.00 0.00 179.01 177.79 2k6q n ASP 106 N -5.33 -0.32 0.00 1.42 5.75 -1.26 -4.79 116.55 112.02 2k6q n ASP 106 Ca 0.17 1.71 0.00 0.00 -0.01 0.00 0.00 54.79 56.66 2k6q n ASP 106 Cb 0.57 -0.53 0.00 0.00 -1.03 0.00 0.00 41.12 40.12 2k6q n ASP 106 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2k6q n GLY 107 N -1.61 0.60 3.57 6.12 0.00 0.99 -4.34 105.19 110.51 2k6q n GLY 107 Ca 0.17 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.85 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 3.06 0.41 1.61 2.19 -1.26 -4.62 117.98 117.37 2k6q s PHE 108 Ca 0.00 -0.09 -0.22 0.00 0.33 0.00 0.00 56.93 56.94 2k6q s PHE 108 Cb 0.00 -1.89 -0.10 0.00 -1.31 0.00 0.00 43.02 39.72 2k6q s PHE 108 CO 0.00 0.16 0.97 -0.51 1.83 0.00 0.00 175.22 177.67 2k6q s LEU 109 N -0.13 4.02 -0.21 6.12 1.43 -0.62 -4.29 118.68 125.00 2k6q s LEU 109 Ca 0.03 1.78 0.01 0.00 -1.03 0.00 0.00 54.13 54.91 2k6q s LEU 109 Cb -0.13 -4.41 0.05 0.00 0.03 0.00 0.00 46.19 41.73 2k6q s LEU 109 CO 0.02 -0.37 -0.07 -0.31 0.23 0.00 0.00 176.35 175.86 2k6q s TYR 110 N -2.00 2.33 0.07 0.29 2.02 -1.26 0.16 117.35 118.95 2k6q s TYR 110 Ca 0.60 -1.63 0.07 0.00 -0.37 0.00 0.00 57.07 55.74 2k6q s TYR 110 Cb -0.13 -1.57 -0.03 0.00 -0.40 0.00 0.00 41.96 39.83 2k6q s TYR 110 CO 0.17 -0.75 -0.18 -1.64 -1.57 0.00 0.00 175.55 171.59 2k6q s MET 111 N 1.42 1.05 -0.17 -0.62 -1.94 -0.65 -1.41 119.30 116.98 2k6q s MET 111 Ca -0.04 -1.00 0.00 0.00 -1.71 0.00 0.00 55.69 52.95 2k6q s MET 111 Cb -0.18 -1.18 0.04 0.00 2.01 0.00 0.00 34.83 35.53 2k6q s MET 111 CO -0.07 0.28 -0.08 0.08 -0.01 0.00 0.00 175.02 175.22 2k6q s VAL 112 N -1.08 1.35 0.17 -6.03 1.01 0.39 -1.46 120.40 114.76 2k6q s VAL 112 Ca 0.03 -0.74 0.03 0.00 0.00 0.00 0.00 61.98 61.30 2k6q s VAL 112 Cb -0.09 -1.45 -0.03 0.00 0.00 0.00 0.00 36.38 34.80 2k6q s VAL 112 CO 0.03 0.20 0.29 -0.72 0.00 0.00 0.00 175.10 174.90 2k6q s TYR 113 N 1.54 3.45 -0.01 5.22 -0.85 -1.07 0.32 117.35 125.95 2k6q s TYR 113 Ca 0.01 0.07 -0.28 0.00 -0.52 0.00 0.00 57.07 56.34 2k6q s TYR 113 Cb -0.15 -1.63 0.10 0.00 0.38 0.00 0.00 41.96 40.66 2k6q s TYR 113 CO -0.08 0.50 1.28 0.00 -1.52 0.00 0.00 175.55 175.72 2k6q s ALA 114 N -1.81 -2.40 -0.27 9.51 0.00 -0.80 -2.55 121.76 123.43 2k6q s ALA 114 Ca 0.34 0.10 0.01 0.00 0.00 0.00 0.00 51.96 52.42 2k6q s ALA 114 Cb -0.10 0.82 0.33 0.00 0.00 0.00 0.00 23.12 24.16 2k6q s ALA 114 CO 0.28 -1.13 1.61 0.45 0.00 0.00 0.00 175.76 176.97 2k6q n SER 115 N -1.00 4.15 -3.67 0.00 2.88 -1.26 -0.52 113.62 114.20 2k6q n SER 115 Ca 0.02 -2.92 -0.11 0.00 -1.33 0.00 0.00 58.87 54.53 2k6q n SER 115 Cb 0.59 -0.77 -0.11 0.00 -0.75 0.00 0.00 64.21 63.17 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 -1.82 0.27 0.00 -1.46 -0.21 -1.26 -4.90 119.66 110.28 2k6q s GLN 116 Ca 0.31 0.85 0.09 0.00 0.02 0.00 0.00 55.36 56.63 2k6q s GLN 116 Cb 0.26 0.10 -0.05 0.00 1.00 0.00 0.00 33.01 34.32 2k6q s GLN 116 CO 0.04 -0.23 0.49 -1.91 -2.12 0.00 0.00 175.29 171.56 2k6q n GLU 117 N 5.03 3.17 -2.74 2.91 2.13 -1.26 -4.63 120.64 125.25 2k6q n GLU 117 Ca -0.13 -0.27 -0.17 0.00 0.66 0.00 0.00 57.16 57.26 2k6q n GLU 117 Cb 0.51 -0.99 0.00 0.00 0.27 0.00 0.00 31.44 31.24 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 -0.78 1.34 0.02 6.31 -2.24 -1.26 -4.71 114.28 112.95 2k6q n THR 118 Ca 0.03 -4.09 -0.06 0.00 -2.27 0.00 0.00 64.05 57.66 2k6q n THR 118 Cb 0.17 -0.22 -0.12 0.00 -2.10 0.00 0.00 70.33 68.06 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 2.89 0.00 0.00 4.78 -0.00 -2.00 -3.56 116.94 119.06 2k6q h PHE 119 Ca 0.06 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 58.03 2k6q h PHE 119 Cb 1.00 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 36.95 2k6q h PHE 119 CO 0.61 0.91 0.00 0.41 -0.00 0.00 0.00 178.31 180.24