#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1q7h s LYS 4 N 0.00 2.63 -0.10 -1.46 1.02 -1.26 -4.45 119.74 116.12 1q7h s LYS 4 Ca 0.00 -0.83 -0.06 0.00 0.02 0.00 0.00 55.97 55.10 1q7h s LYS 4 Cb 0.00 -2.57 0.04 0.00 -0.52 0.00 0.00 37.83 34.78 1q7h s LYS 4 CO 0.00 0.53 0.25 -1.01 -0.92 0.00 0.00 175.35 174.20 1q7h s HIS 5 N -1.39 -0.31 0.24 3.18 3.76 -0.88 -4.92 115.29 114.96 1q7h s HIS 5 Ca 0.27 0.75 -0.30 0.00 -0.15 0.00 0.00 55.06 55.63 1q7h s HIS 5 Cb -0.11 0.06 -0.09 0.00 1.11 0.00 0.00 32.58 33.55 1q7h s HIS 5 CO 0.19 -0.20 1.17 -0.06 -0.85 0.00 0.00 174.74 174.99 1q7h s PHE 6 N 0.93 3.45 0.34 1.40 0.08 -1.26 -0.61 117.98 122.30 1q7h s PHE 6 Ca -0.07 1.53 0.03 0.00 0.12 0.00 0.00 56.93 58.54 1q7h s PHE 6 Cb -0.08 -3.40 -0.02 0.00 -0.57 0.00 0.00 43.02 38.95 1q7h s PHE 6 CO -0.06 -1.02 0.51 0.96 -0.10 0.00 0.00 175.22 175.51 1q7h s ILE 7 N -0.62 4.73 1.09 0.64 -4.36 -0.25 -4.92 121.20 117.51 1q7h s ILE 7 Ca 0.49 -0.70 -0.12 0.00 -0.26 0.00 0.00 60.65 60.06 1q7h s ILE 7 Cb -0.33 -3.70 0.24 0.00 1.25 0.00 0.00 42.46 39.92 1q7h s ILE 7 CO 0.40 -0.38 1.06 -0.94 0.24 0.00 0.00 174.94 175.32 1q7h s SER 8 N -4.08 1.56 0.20 4.36 1.04 -1.26 -4.72 113.70 110.78 1q7h s SER 8 Ca 0.41 1.72 -0.11 0.00 0.48 0.00 0.00 55.95 58.45 1q7h s SER 8 Cb -0.09 -2.38 0.13 0.00 0.10 0.00 0.00 66.02 63.77 1q7h s SER 8 CO 0.34 -3.88 1.81 0.50 0.98 0.00 0.00 173.24 172.99 1q7h h LYS 9 N -2.40 0.98 -0.30 4.02 3.11 -1.99 -1.47 116.57 118.52 1q7h h LYS 9 Ca -0.56 -0.12 -0.10 0.00 -2.81 0.00 0.00 60.65 57.07 1q7h h LYS 9 Cb 1.31 -0.19 -0.01 0.00 -1.00 0.00 0.00 32.23 32.34 1q7h h LYS 9 CO 0.48 0.74 -0.21 0.87 -2.81 0.00 0.00 179.45 178.52 1q7h h LYS 10 N 0.97 0.56 -0.23 1.90 1.57 -2.00 -1.06 116.57 118.28 1q7h h LYS 10 Ca 0.25 -0.21 -0.06 0.00 -1.87 0.00 0.00 60.65 58.76 1q7h h LYS 10 Cb 0.05 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.31 1q7h h LYS 10 CO -0.04 0.74 -0.08 0.93 -0.57 0.00 0.00 179.45 180.43 1q7h h GLU 11 N 0.50 0.47 -0.49 3.15 4.39 -1.83 -3.10 114.58 117.66 1q7h h GLU 11 Ca 0.08 -0.19 0.02 0.00 0.34 0.00 0.00 59.36 59.61 1q7h h GLU 11 Cb 0.65 -0.02 -0.03 0.00 -0.10 0.00 0.00 28.75 29.24 1q7h h GLU 11 CO 0.05 0.71 0.29 0.00 -1.16 0.00 0.00 179.01 178.90 1q7h h ALA 12 N 0.74 0.63 -1.00 3.43 0.00 -1.08 -2.42 119.26 119.56 1q7h h ALA 12 Ca 0.06 -0.01 0.21 0.00 0.00 0.00 0.00 54.91 55.17 1q7h h ALA 12 Cb 0.56 -0.14 -0.11 0.00 0.00 0.00 0.00 17.79 18.10 1q7h h ALA 12 CO 0.03 -0.01 0.61 -0.22 0.00 0.00 0.00 179.25 179.66 1q7h h LYS 13 N 0.58 0.63 -0.79 0.00 3.64 -1.12 0.14 116.57 119.66 1q7h h LYS 13 Ca 0.20 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.53 1q7h h LYS 13 Cb 0.03 -0.14 -0.04 0.00 -0.41 0.00 0.00 32.23 31.67 1q7h h LYS 13 CO -0.09 0.42 0.46 -0.09 -2.27 0.00 0.00 179.45 177.87 1q7h h ARG 14 N 0.65 1.08 -0.28 1.90 2.43 -1.38 -0.68 114.38 118.10 1q7h h ARG 14 Ca 0.59 -0.11 -0.16 0.00 -0.81 0.00 0.00 59.98 59.49 1q7h h ARG 14 Cb 1.07 -0.22 -0.01 0.00 -0.42 0.00 0.00 29.97 30.39 1q7h h ARG 14 CO -0.38 0.77 -0.46 0.82 -1.51 0.00 0.00 179.97 179.21 1q7h h ILE 15 N 1.08 1.29 -0.54 1.20 1.08 -0.81 -1.72 117.51 119.10 1q7h h ILE 15 Ca 0.28 -1.66 -0.01 0.00 -0.39 0.00 0.00 64.86 63.08 1q7h h ILE 15 Cb -0.01 1.57 -0.03 0.00 -3.07 0.00 0.00 36.82 35.28 1q7h h ILE 15 CO -0.05 0.53 0.31 -0.50 -0.69 0.00 0.00 178.15 177.75 1q7h h TRP 16 N 0.58 0.73 -0.57 1.37 6.55 -0.62 -2.67 115.95 121.32 1q7h h TRP 16 Ca 0.03 -0.01 -0.08 0.00 0.95 0.00 0.00 58.89 59.78 1q7h h TRP 16 Cb 1.02 -0.23 -0.02 0.00 -0.86 0.00 0.00 29.16 29.06 1q7h h TRP 16 CO 0.05 0.52 0.04 0.93 -1.05 0.00 0.00 178.44 178.94 1q7h h GLU 17 N 0.72 0.95 -0.35 0.49 5.08 -1.04 0.44 114.58 120.86 1q7h h GLU 17 Ca 0.19 -0.26 0.00 0.00 -1.00 0.00 0.00 59.36 58.29 1q7h h GLU 17 Cb 0.03 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.17 1q7h h GLU 17 CO -0.03 0.91 0.00 1.04 -1.00 0.00 0.00 179.01 179.93 1q7h n GLN 18 N -4.21 0.15 0.00 2.33 1.13 -0.66 -2.90 117.38 113.23 1q7h n GLN 18 Ca 0.03 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.09 1q7h n GLN 18 Cb 0.30 -1.12 0.00 0.00 0.11 0.00 0.00 30.24 29.53 1q7h n GLN 18 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 1q7h n SER 20 N 0.48 0.00 0.27 1.08 2.88 0.14 -4.30 113.62 114.17 1q7h n SER 20 Ca 0.00 0.00 0.11 0.00 -1.33 0.00 0.00 58.87 57.65 1q7h n SER 20 Cb 0.04 0.00 0.74 0.00 -0.75 0.00 0.00 64.21 64.24 1q7h n SER 20 CO 0.00 0.00 0.00 0.03 -1.23 0.00 0.00 175.04 173.84 1q7h h ARG 21 N 0.00 0.00 -0.44 -1.46 3.08 -1.80 -1.20 114.38 112.56 1q7h h ARG 21 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1q7h h ARG 21 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 1q7h h ARG 21 CO 0.00 0.06 0.00 0.66 -1.07 0.00 0.00 179.97 179.62 1q7h n TYR 22 N -4.07 0.82 -1.05 3.04 4.01 -1.26 -4.94 117.16 113.72 1q7h n TYR 22 Ca -0.03 -0.59 -0.02 0.00 -0.16 0.00 0.00 57.90 57.10 1q7h n TYR 22 Cb 0.14 -0.12 -0.01 0.00 -0.31 0.00 0.00 39.34 39.04 1q7h n TYR 22 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1q7h n GLY 23 N 0.58 0.51 3.54 2.72 0.00 -0.45 -1.01 105.19 111.09 1q7h n GLY 23 Ca 0.18 -0.30 -0.43 0.00 0.00 0.00 0.00 46.02 45.47 1q7h n GLY 23 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1q7h s ILE 24 N -1.92 4.65 -0.53 -0.61 1.01 -1.26 -4.05 121.20 118.48 1q7h s ILE 24 Ca 0.00 0.43 -0.19 0.00 0.00 0.00 0.00 60.65 60.89 1q7h s ILE 24 Cb 0.00 -4.32 0.08 0.00 0.01 0.00 0.00 42.46 38.22 1q7h s ILE 24 CO 0.00 -0.72 0.63 -0.62 0.00 0.00 0.00 174.94 174.24 1q7h s ASP 25 N 2.13 6.20 -0.10 3.58 -1.08 -1.26 -3.04 116.67 123.10 1q7h s ASP 25 Ca 0.30 -1.13 0.14 0.00 -0.52 0.00 0.00 52.55 51.34 1q7h s ASP 25 Cb -0.12 -2.29 0.22 0.00 -1.46 0.00 0.00 42.92 39.27 1q7h s ASP 25 CO 0.23 -0.95 1.11 2.30 0.52 0.00 0.00 175.17 178.38 1q7h n ILE 26 N 5.56 1.41 -1.65 4.11 -5.35 -1.26 -4.94 119.36 117.24 1q7h n ILE 26 Ca -0.08 -1.71 -0.47 0.00 -0.27 0.00 0.00 62.75 60.23 1q7h n ILE 26 Cb 0.44 -0.05 -0.04 0.00 -1.74 0.00 0.00 39.64 38.25 1q7h n ILE 26 CO 0.00 0.00 0.00 0.41 -1.76 0.00 0.00 176.55 175.20 1q7h n THR 27 N -1.07 0.36 0.00 7.28 -1.04 -1.26 -1.30 114.28 117.25 1q7h n THR 27 Ca 0.12 -0.09 0.00 0.00 -2.04 0.00 0.00 64.05 62.04 1q7h n THR 27 Cb 0.66 -1.36 0.00 0.00 -1.82 0.00 0.00 70.33 67.80 1q7h n THR 27 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1q7h n GLY 28 N 2.79 1.98 3.71 3.41 0.00 -1.26 -5.03 105.19 110.79 1q7h n GLY 28 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 1q7h n GLY 28 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1q7h s GLU 29 N -0.49 4.52 0.32 1.61 0.41 -0.42 -5.02 118.70 119.64 1q7h s GLU 29 Ca 0.00 1.55 -0.24 0.00 -0.41 0.00 0.00 54.97 55.87 1q7h s GLU 29 Cb 0.00 -3.41 -0.10 0.00 -1.78 0.00 0.00 34.13 28.84 1q7h s GLU 29 CO 0.00 -0.11 0.90 -1.54 -0.49 0.00 0.00 175.26 174.03 1q7h s SER 30 N 0.95 7.23 0.08 -0.19 1.04 -1.26 -4.97 113.70 116.58 1q7h s SER 30 Ca 0.54 1.74 0.08 0.00 0.48 0.00 0.00 55.95 58.79 1q7h s SER 30 Cb -0.24 -2.54 -0.03 0.00 0.10 0.00 0.00 66.02 63.30 1q7h s SER 30 CO 0.29 -0.09 -0.21 -0.76 0.98 0.00 0.00 173.24 173.44 1q7h s LEU 31 N -2.21 2.25 -0.03 2.42 1.43 -1.26 -4.70 118.68 116.57 1q7h s LEU 31 Ca 0.51 -0.63 0.03 0.00 -1.03 0.00 0.00 54.13 53.00 1q7h s LEU 31 Cb -0.17 -0.95 -0.03 0.00 0.03 0.00 0.00 46.19 45.07 1q7h s LEU 31 CO 0.22 0.11 -0.09 -1.61 0.23 0.00 0.00 176.35 175.21 1q7h s GLU 32 N -1.65 2.58 0.11 1.70 2.02 -0.82 -1.10 118.70 121.55 1q7h s GLU 32 Ca 0.07 -0.67 0.09 0.00 0.02 0.00 0.00 54.97 54.49 1q7h s GLU 32 Cb -0.10 -2.49 -0.04 0.00 0.10 0.00 0.00 34.13 31.61 1q7h s GLU 32 CO 0.03 0.62 -0.20 0.54 0.02 0.00 0.00 175.26 176.28 1q7h s VAL 33 N -0.88 2.68 0.05 2.63 0.11 0.22 0.01 120.40 125.22 1q7h s VAL 33 Ca 0.14 -1.53 -0.05 0.00 -2.93 0.00 0.00 61.98 57.61 1q7h s VAL 33 Cb -0.11 -2.21 -0.02 0.00 -1.53 0.00 0.00 36.38 32.52 1q7h s VAL 33 CO 0.04 0.13 0.08 0.00 -3.33 0.00 0.00 175.10 172.02 1q7h s ALA 34 N -1.09 0.04 0.35 1.54 0.00 -0.54 -2.07 121.76 119.98 1q7h s ALA 34 Ca 0.17 -0.71 0.04 0.00 0.00 0.00 0.00 51.96 51.45 1q7h s ALA 34 Cb -0.10 0.30 -0.06 0.00 0.00 0.00 0.00 23.12 23.26 1q7h s ALA 34 CO 0.08 -0.36 0.07 0.00 0.00 0.00 0.00 175.76 175.55 1q7h s ALA 35 N -3.12 2.52 0.00 0.00 0.00 -1.26 -1.29 121.76 118.60 1q7h s ALA 35 Ca -0.01 -1.89 0.00 0.00 0.00 0.00 0.00 51.96 50.07 1q7h s ALA 35 Cb 0.02 0.65 0.00 0.00 0.00 0.00 0.00 23.12 23.79 1q7h s ALA 35 CO -0.07 -0.30 0.06 1.04 0.00 0.00 0.00 175.76 176.49 1q7h n GLN 36 N -0.74 0.00 -0.52 0.00 1.13 -0.66 -4.97 117.38 111.61 1q7h n GLN 36 Ca -0.03 -0.06 0.00 0.00 -1.94 0.00 0.00 57.00 54.96 1q7h n GLN 36 Cb 0.66 -0.12 0.00 0.00 0.11 0.00 0.00 30.24 30.90 1q7h n GLN 36 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 1q7h n LYS 37 N 0.00 -1.69 0.00 -1.09 4.76 -1.26 -4.34 118.16 114.54 1q7h n LYS 37 Ca 0.00 0.24 0.00 0.00 -2.87 0.00 0.00 58.31 55.68 1q7h n LYS 37 Cb 0.38 -3.76 -0.00 0.00 -1.84 0.00 0.00 35.03 29.81 1q7h n LYS 37 CO 0.00 0.00 0.00 -1.13 -1.37 0.00 0.00 177.40 174.90 1q7h n SER 38 N 0.63 0.20 0.00 4.39 3.41 -1.26 -5.04 113.62 115.95 1q7h n SER 38 Ca 0.00 -0.60 0.00 0.00 -0.26 0.00 0.00 58.87 58.01 1q7h n SER 38 Cb 0.24 0.83 0.00 0.00 -0.26 0.00 0.00 64.21 65.02 1q7h n SER 38 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1q7h n ALA 39 N -0.84 0.00 -2.39 7.33 0.00 -1.26 -4.82 120.51 118.54 1q7h n ALA 39 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.24 1q7h n ALA 39 Cb 0.01 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.36 1q7h n ALA 39 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1q7h s SER 40 N 0.00 2.68 0.01 0.00 0.01 -0.90 -1.66 113.70 113.84 1q7h s SER 40 Ca 0.00 -0.97 0.02 0.00 1.31 0.00 0.00 55.95 56.31 1q7h s SER 40 Cb 0.00 -0.15 -0.01 0.00 0.21 0.00 0.00 66.02 66.06 1q7h s SER 40 CO 0.00 -0.12 -0.07 0.00 0.41 0.00 0.00 173.24 173.46 1q7h s ALA 41 N -2.67 0.56 -0.22 1.44 0.00 -0.41 -0.45 121.76 120.01 1q7h s ALA 41 Ca 0.21 -0.44 -0.05 0.00 0.00 0.00 0.00 51.96 51.68 1q7h s ALA 41 Cb -0.03 -0.08 -0.02 0.00 0.00 0.00 0.00 23.12 23.00 1q7h s ALA 41 CO 0.07 0.09 -0.01 0.71 0.00 0.00 0.00 175.76 176.61 1q7h s TYR 42 N -0.55 2.99 0.03 0.00 2.02 0.26 -1.47 117.35 120.63 1q7h s TYR 42 Ca -0.01 -0.72 -0.01 0.00 -0.37 0.00 0.00 57.07 55.96 1q7h s TYR 42 Cb -0.05 -2.12 -0.04 0.00 -0.40 0.00 0.00 41.96 39.36 1q7h s TYR 42 CO 0.00 -0.43 0.17 0.71 -1.57 0.00 0.00 175.55 174.44 1q7h s TYR 43 N 1.35 3.47 -0.10 2.71 2.02 0.10 -2.25 117.35 124.64 1q7h s TYR 43 Ca 0.04 0.27 -0.00 0.00 -0.37 0.00 0.00 57.07 57.01 1q7h s TYR 43 Cb -0.14 -1.77 0.02 0.00 -0.40 0.00 0.00 41.96 39.67 1q7h s TYR 43 CO -0.00 0.60 -0.08 0.42 -1.57 0.00 0.00 175.55 174.92 1q7h s ILE 44 N -1.40 1.01 -1.51 2.71 1.01 -0.57 -1.94 121.20 120.52 1q7h s ILE 44 Ca 0.30 -0.30 -0.11 0.00 0.00 0.00 0.00 60.65 60.54 1q7h s ILE 44 Cb -0.13 -1.02 0.07 0.00 0.01 0.00 0.00 42.46 41.40 1q7h s ILE 44 CO 0.22 0.36 0.90 0.61 0.00 0.00 0.00 174.94 177.03 1q7h n GLY 45 N 4.78 -0.45 2.61 6.18 0.00 -1.26 -2.01 105.19 115.04 1q7h n GLY 45 Ca -0.14 0.18 0.00 0.00 0.00 0.00 0.00 46.02 46.06 1q7h n GLY 45 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1q7h n GLY 46 N -1.67 1.64 3.45 -0.02 0.00 -1.26 -5.03 105.19 102.30 1q7h n GLY 46 Ca -0.03 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.67 1q7h n GLY 46 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1q7h s LYS 47 N -0.13 2.34 0.81 1.61 1.02 -0.85 -5.06 119.74 119.47 1q7h s LYS 47 Ca 0.00 -0.80 -0.11 0.00 0.02 0.00 0.00 55.97 55.08 1q7h s LYS 47 Cb 0.00 -2.28 0.08 0.00 -0.52 0.00 0.00 37.83 35.11 1q7h s LYS 47 CO 0.00 0.59 1.09 -1.25 -0.92 0.00 0.00 175.35 174.86 1q7h s PRO 48 N -0.89 1.98 0.11 -1.68 0.04 -1.26 -1.52 135.00 131.78 1q7h s PRO 48 Ca 0.12 0.98 -0.36 0.00 0.04 0.00 0.00 61.00 61.78 1q7h s PRO 48 Cb -0.10 -1.88 -0.16 0.00 0.04 0.00 0.00 34.50 32.40 1q7h s PRO 48 CO 0.01 -1.79 1.39 0.28 0.04 0.00 0.00 177.00 176.94 1q7h n VAL 50 N -3.59 0.02 -4.30 -0.36 0.31 -0.96 -4.58 118.33 104.87 1q7h n VAL 50 Ca 0.08 -0.01 -0.35 0.00 -0.01 0.00 0.00 64.34 64.06 1q7h n VAL 50 Cb 0.54 -1.00 -0.09 0.00 -0.91 0.00 0.00 33.84 32.38 1q7h n VAL 50 CO 0.00 0.00 0.00 -0.36 -1.32 0.00 0.00 176.83 175.15 1q7h s PHE 51 N 0.57 3.20 -0.56 3.52 0.08 0.21 -0.58 117.98 124.42 1q7h s PHE 51 Ca 0.83 0.21 -0.06 0.00 0.12 0.00 0.00 56.93 58.02 1q7h s PHE 51 Cb -0.88 -1.78 0.15 0.00 -0.57 0.00 0.00 43.02 39.93 1q7h s PHE 51 CO 0.45 0.50 0.41 -1.14 -0.10 0.00 0.00 175.22 175.33 1q7h s GLN 52 N -1.06 2.56 -0.42 0.44 2.00 0.41 0.29 119.66 123.89 1q7h s GLN 52 Ca 0.15 -2.15 0.06 0.00 -2.00 0.00 0.00 55.36 51.42 1q7h s GLN 52 Cb -0.11 -3.85 0.22 0.00 0.80 0.00 0.00 33.01 30.06 1q7h s GLN 52 CO 0.04 -1.18 0.47 0.00 -0.50 0.00 0.00 175.29 174.12 1q7h n ALA 53 N 4.20 2.68 0.00 1.58 0.00 -1.26 -2.12 120.51 125.58 1q7h n ALA 53 Ca 0.02 -3.38 0.00 0.00 0.00 0.00 0.00 53.44 50.08 1q7h n ALA 53 Cb 0.41 -0.80 0.00 0.00 0.00 0.00 0.00 19.45 19.06 1q7h n ALA 53 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1q7h n GLY 54 N 1.90 1.91 3.89 0.00 0.00 -1.26 -4.87 105.19 106.77 1q7h n GLY 54 Ca 0.25 -0.51 -0.20 0.00 0.00 0.00 0.00 46.02 45.55 1q7h n GLY 54 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1q7h s ASP 55 N -4.00 5.21 -0.22 1.61 1.01 -1.26 -5.07 116.67 113.95 1q7h s ASP 55 Ca 0.00 -0.64 -0.25 0.00 0.71 0.00 0.00 52.55 52.37 1q7h s ASP 55 Cb 0.00 -0.67 -0.01 0.00 1.01 0.00 0.00 42.92 43.25 1q7h s ASP 55 CO 0.00 -0.61 0.86 -0.76 0.21 0.00 0.00 175.17 174.87 1q7h s LEU 56 N -4.14 4.10 -0.15 1.23 1.43 -1.26 -4.40 118.68 115.50 1q7h s LEU 56 Ca 0.48 1.11 -0.00 0.00 -1.03 0.00 0.00 54.13 54.69 1q7h s LEU 56 Cb -0.05 -3.24 -0.01 0.00 0.03 0.00 0.00 46.19 42.92 1q7h s LEU 56 CO 0.28 -0.51 -0.14 -0.63 0.23 0.00 0.00 176.35 175.59 1q7h s ILE 57 N 2.73 2.86 0.43 -0.59 1.01 0.15 -4.94 121.20 122.85 1q7h s ILE 57 Ca 0.37 -0.71 -0.23 0.00 0.00 0.00 0.00 60.65 60.07 1q7h s ILE 57 Cb -0.16 -2.21 -0.09 0.00 0.01 0.00 0.00 42.46 40.02 1q7h s ILE 57 CO 0.08 0.51 1.06 -2.16 0.00 0.00 0.00 174.94 174.44 1q7h s PRO 58 N 0.64 4.01 0.69 2.79 0.04 -1.26 0.67 135.00 142.59 1q7h s PRO 58 Ca -0.08 1.51 -0.10 0.00 0.04 0.00 0.00 61.00 62.37 1q7h s PRO 58 Cb -0.16 -2.41 0.02 0.00 0.04 0.00 0.00 34.50 32.00 1q7h s PRO 58 CO 0.03 -0.27 1.06 -1.54 0.04 0.00 0.00 177.00 176.31 1q7h s SER 59 N -1.64 5.33 0.52 6.66 1.04 -1.26 -4.83 113.70 119.52 1q7h s SER 59 Ca 0.61 0.96 0.28 0.00 0.48 0.00 0.00 55.95 58.28 1q7h s SER 59 Cb -0.21 -1.76 1.43 0.00 0.10 0.00 0.00 66.02 65.58 1q7h s SER 59 CO 0.27 -1.36 2.06 -0.37 0.98 0.00 0.00 173.24 174.81 1q7h h VAL 60 N -0.59 0.53 -0.30 5.02 -1.51 -1.93 -1.01 116.25 116.45 1q7h h VAL 60 Ca -0.45 -0.56 -0.12 0.00 -1.23 0.00 0.00 66.70 64.34 1q7h h VAL 60 Cb 1.27 1.37 -0.00 0.00 -2.13 0.00 0.00 31.29 31.79 1q7h h VAL 60 CO 0.63 0.12 -0.29 1.88 -1.23 0.00 0.00 177.57 178.68 1q7h h TYR 61 N 0.00 0.87 -0.52 5.19 0.05 -1.92 -2.52 116.97 118.13 1q7h h TYR 61 Ca -0.00 -0.26 -0.09 0.00 0.05 0.00 0.00 58.73 58.43 1q7h h TYR 61 Cb 0.36 -0.19 -0.02 0.00 1.01 0.00 0.00 36.73 37.90 1q7h h TYR 61 CO 0.00 1.01 -0.01 1.25 -1.05 0.00 0.00 178.16 179.36 1q7h h LEU 62 N 0.49 0.91 -1.65 3.88 5.85 -1.62 -0.93 115.31 122.23 1q7h h LEU 62 Ca 0.05 -0.31 0.09 0.00 0.84 0.00 0.00 57.88 58.55 1q7h h LEU 62 Cb 0.86 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.61 1q7h h LEU 62 CO 0.07 1.00 0.39 -0.07 -0.34 0.00 0.00 178.44 179.49 1q7h h LEU 63 N 0.79 0.36 0.00 2.25 3.38 -1.10 0.17 115.31 121.16 1q7h h LEU 63 Ca 0.15 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.12 1q7h h LEU 63 Cb 0.54 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.22 1q7h h LEU 63 CO 0.03 0.22 -0.83 0.78 0.09 0.00 0.00 178.44 178.73 1q7h h ASN 64 N 0.40 0.00 0.17 -0.43 4.21 -1.08 -3.14 115.58 115.71 1q7h h ASN 64 Ca 0.27 -0.16 -0.35 0.00 1.21 0.00 0.00 56.30 57.27 1q7h h ASN 64 Cb 0.51 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.71 1q7h h ASN 64 CO -0.07 0.08 -1.78 0.22 -1.29 0.00 0.00 177.43 174.59 1q7h h TYR 65 N 0.00 0.64 -2.66 1.19 3.20 -0.05 -3.43 116.97 115.86 1q7h h TYR 65 Ca 0.00 -0.47 -0.58 0.00 3.14 0.00 0.00 58.73 60.83 1q7h h TYR 65 Cb 0.84 -0.03 -0.39 0.00 1.54 0.00 0.00 36.73 38.69 1q7h h TYR 65 CO 0.00 1.70 -0.83 1.03 -1.64 0.00 0.00 178.16 178.42 1q7h s ARG 66 N -2.56 0.56 0.41 1.82 1.81 0.49 -5.09 118.95 116.40 1q7h s ARG 66 Ca -0.18 -1.27 -0.25 0.00 -1.72 0.00 0.00 55.73 52.31 1q7h s ARG 66 Cb 0.06 -1.38 -0.11 0.00 -0.45 0.00 0.00 34.95 33.07 1q7h s ARG 66 CO 0.82 -1.18 1.12 0.09 -0.68 0.00 0.00 175.30 175.48 1q7h n ASN 67 N 4.18 1.79 -4.86 0.23 3.02 -1.19 -4.53 115.26 113.91 1q7h n ASN 67 Ca 0.09 1.08 -0.30 0.00 -0.03 0.00 0.00 54.58 55.42 1q7h n ASN 67 Cb 0.38 -1.41 0.06 0.00 -0.61 0.00 0.00 39.78 38.20 1q7h n ASN 67 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1q7h s PRO 68 N -2.05 2.67 0.00 3.52 0.04 -1.26 -4.33 135.00 133.59 1q7h s PRO 68 Ca 0.62 0.55 0.11 0.00 0.04 0.00 0.00 61.00 62.31 1q7h s PRO 68 Cb -0.55 -1.99 0.07 0.00 0.04 0.00 0.00 34.50 32.07 1q7h s PRO 68 CO 0.58 -1.18 0.81 -1.13 0.04 0.00 0.00 177.00 176.11 1q7h n SER 69 N -3.12 1.78 -4.03 6.66 3.41 -0.18 -4.92 113.62 113.22 1q7h n SER 69 Ca 0.07 -1.39 -0.10 0.00 -0.26 0.00 0.00 58.87 57.19 1q7h n SER 69 Cb 0.57 0.07 -0.08 0.00 -0.26 0.00 0.00 64.21 64.51 1q7h n SER 69 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1q7h s ARG 70 N -0.96 1.10 -1.42 4.33 1.70 -1.23 -4.91 118.95 117.56 1q7h s ARG 70 Ca 0.12 -1.28 -0.03 0.00 -0.47 0.00 0.00 55.73 54.07 1q7h s ARG 70 Cb 0.09 0.33 0.00 0.00 -0.57 0.00 0.00 34.95 34.80 1q7h s ARG 70 CO 0.15 -0.38 0.36 0.09 -1.08 0.00 0.00 175.30 174.45 1q7h n ASN 71 N -0.19 -5.48 -4.82 -2.89 4.13 -1.26 -4.80 115.26 99.96 1q7h n ASN 71 Ca -0.06 -0.18 -0.38 0.00 1.68 0.00 0.00 54.58 55.64 1q7h n ASN 71 Cb 0.63 -4.38 -0.06 0.00 -1.54 0.00 0.00 39.78 34.43 1q7h n ASN 71 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1q7h s ILE 72 N -3.04 4.79 -0.08 2.41 1.01 -1.26 -1.05 121.20 123.99 1q7h s ILE 72 Ca 0.18 1.11 0.00 0.00 0.00 0.00 0.00 60.65 61.94 1q7h s ILE 72 Cb -0.08 -3.85 0.02 0.00 0.01 0.00 0.00 42.46 38.56 1q7h s ILE 72 CO 0.22 0.51 -0.07 -0.69 0.00 0.00 0.00 174.94 174.92 1q7h s VAL 73 N -1.16 0.81 -0.19 2.92 1.01 -0.42 -1.39 120.40 121.98 1q7h s VAL 73 Ca 0.30 -0.22 -0.08 0.00 0.00 0.00 0.00 61.98 61.98 1q7h s VAL 73 Cb -0.18 -0.83 -0.04 0.00 0.00 0.00 0.00 36.38 35.33 1q7h s VAL 73 CO 0.18 0.31 0.07 -0.89 0.00 0.00 0.00 175.10 174.77 1q7h s THR 74 N 1.31 4.76 0.28 3.92 2.01 0.24 -0.60 115.64 127.56 1q7h s THR 74 Ca -0.04 -0.04 0.09 0.00 0.31 0.00 0.00 61.69 62.01 1q7h s THR 74 Cb -0.14 -3.16 -0.04 0.00 0.01 0.00 0.00 72.50 69.17 1q7h s THR 74 CO -0.03 0.44 0.04 0.68 -0.69 0.00 0.00 174.62 175.06 1q7h s VAL 75 N 0.51 3.44 0.83 3.82 -7.23 -0.73 0.23 120.40 121.28 1q7h s VAL 75 Ca 0.03 -1.84 -0.09 0.00 -1.81 0.00 0.00 61.98 58.27 1q7h s VAL 75 Cb -0.13 -2.91 0.14 0.00 0.56 0.00 0.00 36.38 34.04 1q7h s VAL 75 CO 0.01 -0.34 1.15 1.51 -0.31 0.00 0.00 175.10 177.12 1q7h s ASP 76 N -3.72 3.91 0.25 4.85 1.47 -0.29 -3.06 116.67 120.08 1q7h s ASP 76 Ca 0.33 0.13 -0.04 0.00 1.18 0.00 0.00 52.55 54.15 1q7h s ASP 76 Cb -0.06 -0.43 0.42 0.00 -0.34 0.00 0.00 42.92 42.51 1q7h s ASP 76 CO 0.21 -2.19 1.81 -0.08 0.68 0.00 0.00 175.17 175.59 1q7h h GLU 77 N -1.05 0.76 -0.21 2.11 4.81 -2.00 -2.36 114.58 116.64 1q7h h GLU 77 Ca -0.42 -0.05 -0.06 0.00 -0.13 0.00 0.00 59.36 58.71 1q7h h GLU 77 Cb 1.27 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 30.46 1q7h h GLU 77 CO 0.45 0.50 -0.12 0.78 -0.73 0.00 0.00 179.01 179.89 1q7h h GLY 78 N 0.78 0.36 1.35 1.92 0.00 -1.95 -3.17 103.07 102.35 1q7h h GLY 78 Ca 0.41 -0.22 -0.26 0.00 0.00 0.00 0.00 47.33 47.25 1q7h h GLY 78 CO -0.26 0.21 -1.07 0.00 0.00 0.00 0.00 176.54 175.42 1q7h h ALA 79 N 1.57 0.17 -0.83 3.60 0.00 -1.75 -3.39 119.26 118.63 1q7h h ALA 79 Ca 0.06 -0.73 0.12 0.00 0.00 0.00 0.00 54.91 54.36 1q7h h ALA 79 Cb 0.40 0.04 -0.13 0.00 0.00 0.00 0.00 17.79 18.10 1q7h h ALA 79 CO 0.02 0.74 -0.44 1.49 0.00 0.00 0.00 179.25 181.07 1q7h h GLU 80 N 0.30 -0.08 -0.84 0.00 4.81 -1.47 -1.39 114.58 115.91 1q7h h GLU 80 Ca -0.13 0.01 0.10 0.00 -0.13 0.00 0.00 59.36 59.21 1q7h h GLU 80 Cb 1.72 0.02 -0.06 0.00 0.63 0.00 0.00 28.75 31.06 1q7h h GLU 80 CO 0.20 -0.06 0.54 -1.35 -0.73 0.00 0.00 179.01 177.62 1q7h h PRO 81 N -0.09 0.75 0.10 0.92 0.11 -1.76 0.12 132.00 132.16 1q7h h PRO 81 Ca 0.25 -0.05 -0.26 0.00 0.11 0.00 0.00 66.00 66.05 1q7h h PRO 81 Cb 0.55 -0.17 -0.00 0.00 0.11 0.00 0.00 31.00 31.48 1q7h h PRO 81 CO -0.86 0.50 -1.19 0.45 -0.21 0.00 0.00 178.00 176.68 1q7h h HIS 82 N 0.77 0.38 -0.54 0.65 3.86 -1.62 -3.07 115.15 115.58 1q7h h HIS 82 Ca 0.39 -0.28 -0.07 0.00 -1.16 0.00 0.00 60.37 59.25 1q7h h HIS 82 Cb 0.47 -0.02 -0.02 0.00 1.06 0.00 0.00 27.41 28.90 1q7h h HIS 82 CO -0.00 1.22 0.03 0.82 0.86 0.00 0.00 177.93 180.86 1q7h h ILE 83 N 0.06 1.25 0.00 2.45 1.08 -0.68 -0.42 117.51 121.24 1q7h h ILE 83 Ca -0.11 -1.01 0.00 0.00 -0.39 0.00 0.00 64.86 63.35 1q7h h ILE 83 Cb 1.93 0.80 0.00 0.00 -3.07 0.00 0.00 36.82 36.48 1q7h h ILE 83 CO 0.19 0.36 0.00 -0.07 -0.69 0.00 0.00 178.15 177.94 1q7h h LEU 84 N 0.83 0.00 -2.66 1.44 3.38 -0.69 -0.03 115.31 117.57 1q7h h LEU 84 Ca 0.16 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.13 1q7h h LEU 84 Cb 0.45 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.20 1q7h h LEU 84 CO 0.02 0.00 0.00 0.59 0.09 0.00 0.00 178.44 179.14 1q7h n ASN 85 N -2.96 3.61 0.00 -0.43 3.02 -0.27 -4.32 115.26 113.91 1q7h n ASN 85 Ca -0.02 -1.98 0.00 0.00 -0.03 0.00 0.00 54.58 52.54 1q7h n ASN 85 Cb 0.09 -0.38 0.00 0.00 -0.61 0.00 0.00 39.78 38.88 1q7h n ASN 85 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1q7h n GLY 86 N 1.37 0.73 3.73 7.41 0.00 -0.02 -5.05 105.19 113.35 1q7h n GLY 86 Ca 0.20 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.87 1q7h n GLY 86 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1q7h s SER 87 N -2.26 4.48 0.89 1.61 0.15 -0.57 -4.59 113.70 113.40 1q7h s SER 87 Ca 0.00 2.45 -0.11 0.00 0.70 0.00 0.00 55.95 59.00 1q7h s SER 87 Cb 0.00 -2.60 0.13 0.00 -1.71 0.00 0.00 66.02 61.84 1q7h s SER 87 CO 0.00 -2.08 1.11 -1.81 1.20 0.00 0.00 173.24 171.66 1q7h s ASP 88 N -1.74 3.33 -0.24 5.45 1.01 -1.26 -4.37 116.67 118.85 1q7h s ASP 88 Ca 0.78 1.90 -0.08 0.00 0.71 0.00 0.00 52.55 55.86 1q7h s ASP 88 Cb -0.32 -2.47 -0.04 0.00 1.01 0.00 0.00 42.92 41.10 1q7h s ASP 88 CO 0.41 -2.79 0.09 -0.22 0.21 0.00 0.00 175.17 172.87 1q7h s LEU 89 N -6.38 3.63 -0.08 1.23 2.96 0.15 -4.89 118.68 115.30 1q7h s LEU 89 Ca 0.65 -0.11 -0.04 0.00 -0.22 0.00 0.00 54.13 54.40 1q7h s LEU 89 Cb -0.20 -1.97 -0.04 0.00 0.50 0.00 0.00 46.19 44.48 1q7h s LEU 89 CO 0.58 0.01 0.11 -0.36 -1.32 0.00 0.00 176.35 175.37 1q7h s PHE 90 N 1.37 3.47 0.33 5.38 0.08 -1.26 -0.47 117.98 126.87 1q7h s PHE 90 Ca 0.06 0.39 0.11 0.00 0.12 0.00 0.00 56.93 57.61 1q7h s PHE 90 Cb -0.15 -1.86 0.96 0.00 -0.57 0.00 0.00 43.02 41.40 1q7h s PHE 90 CO 0.04 0.65 1.69 0.00 -0.10 0.00 0.00 175.22 177.51 1q7h h ALA 91 N 4.68 1.82 -0.10 5.36 0.00 -1.30 -1.49 119.26 128.22 1q7h h ALA 91 Ca -0.52 0.16 0.03 0.00 0.00 0.00 0.00 54.91 54.58 1q7h h ALA 91 Cb 1.21 0.11 -0.00 0.00 0.00 0.00 0.00 17.79 19.10 1q7h h ALA 91 CO 0.60 -0.43 0.15 -1.35 0.00 0.00 0.00 179.25 178.22 1q7h h PRO 92 N 0.43 0.00 -0.27 0.00 0.11 -1.83 -1.10 132.00 129.34 1q7h h PRO 92 Ca 0.68 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.79 1q7h h PRO 92 Cb 1.42 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.53 1q7h h PRO 92 CO -0.55 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 177.65 1q7h n GLY 93 N -1.32 0.92 3.67 -0.55 0.00 -0.56 -4.88 105.19 102.47 1q7h n GLY 93 Ca -0.00 -0.56 -0.39 0.00 0.00 0.00 0.00 46.02 45.07 1q7h n GLY 93 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1q7h s ILE 94 N -1.66 5.12 -0.12 -0.61 1.01 -0.42 -1.14 121.20 123.38 1q7h s ILE 94 Ca 0.35 0.95 -0.14 0.00 0.00 0.00 0.00 60.65 61.80 1q7h s ILE 94 Cb 0.19 -3.83 -0.26 0.00 0.01 0.00 0.00 42.46 38.57 1q7h s ILE 94 CO 0.28 0.20 0.46 0.58 0.00 0.00 0.00 174.94 176.47 1q7h h VAL 95 N 5.05 0.91 -2.88 2.92 2.07 -0.52 -3.47 116.25 120.33 1q7h h VAL 95 Ca -0.35 -2.35 0.01 0.00 0.82 0.00 0.00 66.70 64.83 1q7h h VAL 95 Cb 1.16 2.59 0.00 0.00 -1.52 0.00 0.00 31.29 33.52 1q7h h VAL 95 CO 0.74 0.70 0.34 -1.54 0.02 0.00 0.00 177.57 177.83 1q7h n SER 96 N -3.89 -2.14 -4.68 0.57 3.41 -1.14 -5.01 113.62 100.75 1q7h n SER 96 Ca -0.28 -2.42 -0.43 0.00 -0.26 0.00 0.00 58.87 55.49 1q7h n SER 96 Cb 0.91 3.55 -0.02 0.00 -0.26 0.00 0.00 64.21 68.38 1q7h n SER 96 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1q7h s ASP 98 N -3.11 7.15 0.00 4.04 -1.08 -0.49 -0.59 116.67 122.59 1q7h s ASP 98 Ca 0.17 1.54 0.19 0.00 -0.52 0.00 0.00 52.55 53.93 1q7h s ASP 98 Cb -0.04 -2.55 1.14 0.00 -1.46 0.00 0.00 42.92 40.01 1q7h s ASP 98 CO 0.10 -0.56 1.55 -0.90 0.52 0.00 0.00 175.17 175.89 1q7h n ASP 99 N 5.57 0.00 -0.80 -0.34 5.68 -1.26 -2.37 116.55 123.03 1q7h n ASP 99 Ca 0.10 -0.76 0.13 0.00 -0.50 0.00 0.00 54.79 53.76 1q7h n ASP 99 Cb 0.47 0.00 0.21 0.00 -1.14 0.00 0.00 41.12 40.66 1q7h n ASP 99 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 1q7h n SER 100 N -0.94 2.53 -4.73 -1.12 3.41 -1.26 -4.70 113.62 106.81 1q7h n SER 100 Ca 0.14 -1.83 -0.42 0.00 -0.26 0.00 0.00 58.87 56.51 1q7h n SER 100 Cb 0.07 0.02 -0.03 0.00 -0.26 0.00 0.00 64.21 64.01 1q7h n SER 100 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1q7h s ILE 101 N -2.03 2.93 0.15 -1.33 1.01 -1.00 -4.94 121.20 115.99 1q7h s ILE 101 Ca 0.30 0.72 0.07 0.00 0.00 0.00 0.00 60.65 61.74 1q7h s ILE 101 Cb 0.20 -3.46 -0.04 0.00 0.01 0.00 0.00 42.46 39.17 1q7h s ILE 101 CO 0.33 0.08 -0.16 -0.13 0.00 0.00 0.00 174.94 175.06 1q7h s ARG 102 N 0.44 1.19 0.11 2.79 1.81 -1.26 -0.84 118.95 123.19 1q7h s ARG 102 Ca 0.63 -1.37 -0.36 0.00 -1.72 0.00 0.00 55.73 52.91 1q7h s ARG 102 Cb -0.40 -1.13 -0.16 0.00 -0.45 0.00 0.00 34.95 32.81 1q7h s ARG 102 CO 0.36 0.22 1.42 1.17 -0.68 0.00 0.00 175.30 177.79 1q7h n LYS 103 N 0.27 1.49 0.00 3.54 4.81 -1.26 -1.43 118.16 125.59 1q7h n LYS 103 Ca -0.13 0.54 0.00 0.00 -0.87 0.00 0.00 58.31 57.85 1q7h n LYS 103 Cb 0.58 -2.22 0.00 0.00 0.02 0.00 0.00 35.03 33.40 1q7h n LYS 103 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1q7h n GLY 104 N 2.83 3.20 0.00 3.14 0.00 -0.35 -4.99 105.19 109.01 1q7h n GLY 104 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 1q7h n GLY 104 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1q7h n ASP 105 N 0.00 0.00 -3.59 1.61 8.00 -0.51 -4.70 116.55 117.35 1q7h n ASP 105 Ca 0.00 0.00 -0.06 0.00 0.71 0.00 0.00 54.79 55.44 1q7h n ASP 105 Cb 0.00 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.07 1q7h n ASP 105 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 1q7h s ILE 107 N 0.00 0.00 -0.25 0.53 -4.36 0.14 -0.61 121.20 116.66 1q7h s ILE 107 Ca 0.00 0.00 0.02 0.00 -0.26 0.00 0.00 60.65 60.41 1q7h s ILE 107 Cb 0.00 -1.00 0.05 0.00 1.25 0.00 0.00 42.46 42.76 1q7h s ILE 107 CO 0.00 0.00 -0.11 -0.36 0.24 0.00 0.00 174.94 174.71 1q7h s PHE 108 N -1.86 3.14 -0.11 1.37 0.08 -0.21 0.05 117.98 120.44 1q7h s PHE 108 Ca 0.06 -2.05 -0.22 0.00 0.12 0.00 0.00 56.93 54.85 1q7h s PHE 108 Cb -0.01 -1.96 -0.03 0.00 -0.57 0.00 0.00 43.02 40.45 1q7h s PHE 108 CO -0.04 -0.84 0.66 0.08 -0.10 0.00 0.00 175.22 174.97 1q7h s VAL 109 N 1.18 5.05 0.13 -0.44 1.01 -0.20 -1.30 120.40 125.84 1q7h s VAL 109 Ca -0.05 1.32 0.07 0.00 0.00 0.00 0.00 61.98 63.33 1q7h s VAL 109 Cb -0.18 -3.99 -0.04 0.00 0.00 0.00 0.00 36.38 32.17 1q7h s VAL 109 CO -0.06 0.22 -0.17 -1.59 0.00 0.00 0.00 175.10 173.49 1q7h s LYS 110 N 1.10 1.14 0.61 2.72 -2.85 0.23 -0.30 119.74 122.38 1q7h s LYS 110 Ca 0.34 -1.27 -0.14 0.00 -1.00 0.00 0.00 55.97 53.90 1q7h s LYS 110 Cb -0.17 -1.18 -0.03 0.00 -2.06 0.00 0.00 37.83 34.39 1q7h s LYS 110 CO 0.15 0.25 1.04 0.45 0.10 0.00 0.00 175.35 177.34 1q7h s SER 111 N -2.37 5.87 0.26 0.03 0.15 0.18 -1.77 113.70 116.06 1q7h s SER 111 Ca 0.10 1.65 0.21 0.00 0.70 0.00 0.00 55.95 58.62 1q7h s SER 111 Cb -0.07 -2.51 1.01 0.00 -1.71 0.00 0.00 66.02 62.74 1q7h s SER 111 CO 0.05 -1.11 1.64 -1.54 1.20 0.00 0.00 173.24 173.48 1q7h n SER 112 N -2.39 0.56 -0.12 5.45 3.41 -1.17 -0.84 113.62 118.52 1q7h n SER 112 Ca 0.08 0.70 0.15 0.00 -0.26 0.00 0.00 58.87 59.53 1q7h n SER 112 Cb 0.53 -0.79 0.81 0.00 -0.26 0.00 0.00 64.21 64.50 1q7h n SER 112 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1q7h n LYS 113 N -2.18 1.09 0.00 4.33 5.02 -1.26 -4.95 118.16 120.21 1q7h n LYS 113 Ca 0.00 -0.24 0.00 0.00 -2.02 0.00 0.00 58.31 56.05 1q7h n LYS 113 Cb 0.13 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 33.64 1q7h n LYS 113 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1q7h n GLY 114 N 1.08 3.08 3.80 0.72 0.00 -0.02 -5.07 105.19 108.77 1q7h n GLY 114 Ca 0.21 -0.96 -0.34 0.00 0.00 0.00 0.00 46.02 44.93 1q7h n GLY 114 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1q7h s TYR 115 N -0.66 3.07 0.26 1.61 -0.85 -1.26 -4.68 117.35 114.83 1q7h s TYR 115 Ca 0.00 1.59 -0.23 0.00 -0.52 0.00 0.00 57.07 57.91 1q7h s TYR 115 Cb 0.00 -3.04 -0.09 0.00 0.38 0.00 0.00 41.96 39.21 1q7h s TYR 115 CO 0.00 -0.70 0.82 -0.06 -1.52 0.00 0.00 175.55 174.08 1q7h s PHE 116 N -1.98 3.69 0.00 -3.49 0.08 -1.26 -0.65 117.98 114.37 1q7h s PHE 116 Ca 0.66 1.57 0.00 0.00 0.12 0.00 0.00 56.93 59.27 1q7h s PHE 116 Cb -0.16 -2.75 0.00 0.00 -0.57 0.00 0.00 43.02 39.54 1q7h s PHE 116 CO 0.19 0.30 0.00 0.44 -0.10 0.00 0.00 175.22 176.06 1q7h n ILE 117 N 0.74 0.00 -3.70 0.64 -5.35 0.58 -4.89 119.36 107.38 1q7h n ILE 117 Ca -0.01 -0.15 -0.05 0.00 -0.27 0.00 0.00 62.75 62.27 1q7h n ILE 117 Cb 0.50 0.63 -0.02 0.00 -1.74 0.00 0.00 39.64 39.02 1q7h n ILE 117 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1q7h s ALA 118 N -1.27 -1.63 -0.05 -1.28 0.00 -1.14 -4.11 121.76 112.27 1q7h s ALA 118 Ca 0.00 0.26 0.05 0.00 0.00 0.00 0.00 51.96 52.28 1q7h s ALA 118 Cb 0.00 0.64 -0.02 0.00 0.00 0.00 0.00 23.12 23.74 1q7h s ALA 118 CO 0.00 -0.96 -0.20 0.08 0.00 0.00 0.00 175.76 174.68 1q7h s VAL 119 N -3.35 2.51 0.00 0.00 1.01 -0.10 -1.03 120.40 119.44 1q7h s VAL 119 Ca 0.10 -0.92 0.00 0.00 0.00 0.00 0.00 61.98 61.16 1q7h s VAL 119 Cb -0.02 -1.94 0.00 0.00 0.00 0.00 0.00 36.38 34.42 1q7h s VAL 119 CO -0.00 0.58 0.00 0.61 0.00 0.00 0.00 175.10 176.29 1q7h n GLY 120 N 2.59 4.76 3.20 4.51 0.00 0.11 -0.91 105.19 119.46 1q7h n GLY 120 Ca -0.17 -0.68 -0.28 0.00 0.00 0.00 0.00 46.02 44.89 1q7h n GLY 120 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1q7h s ALA 122 N -2.00 1.74 -0.19 4.61 0.00 0.22 0.25 121.76 126.39 1q7h s ALA 122 Ca 0.00 -0.86 0.16 0.00 0.00 0.00 0.00 51.96 51.26 1q7h s ALA 122 Cb 0.00 -0.50 0.53 0.00 0.00 0.00 0.00 23.12 23.16 1q7h s ALA 122 CO 0.00 0.38 1.43 0.39 0.00 0.00 0.00 175.76 177.96 1q7h n GLU 123 N 2.79 2.84 -4.11 0.00 -0.58 0.14 -1.22 120.64 120.51 1q7h n GLU 123 Ca -0.16 -2.87 -0.31 0.00 -0.42 0.00 0.00 57.16 53.40 1q7h n GLU 123 Cb 0.53 -1.85 -0.07 0.00 -0.57 0.00 0.00 31.44 29.47 1q7h n GLU 123 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1q7h s ASP 125 N -1.98 5.28 0.39 1.62 1.01 -1.26 -4.88 116.67 116.85 1q7h s ASP 125 Ca 0.43 -0.07 0.10 0.00 0.71 0.00 0.00 52.55 53.71 1q7h s ASP 125 Cb 0.35 -1.35 0.88 0.00 1.01 0.00 0.00 42.92 43.80 1q7h s ASP 125 CO 0.08 0.19 1.93 0.00 0.21 0.00 0.00 175.17 177.58 1q7h h ALA 126 N 3.49 1.88 0.10 5.23 0.00 -1.28 -2.33 119.26 126.35 1q7h h ALA 126 Ca -0.47 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.43 1q7h h ALA 126 Cb 1.17 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.82 1q7h h ALA 126 CO 0.62 -0.05 -0.07 0.78 0.00 0.00 0.00 179.25 180.53 1q7h h GLY 127 N 0.61 -0.17 1.20 0.00 0.00 -1.84 -3.04 103.07 99.84 1q7h h GLY 127 Ca 0.36 0.08 -0.09 0.00 0.00 0.00 0.00 47.33 47.68 1q7h h GLY 127 CO -0.13 -0.08 -0.01 -2.09 0.00 0.00 0.00 176.54 174.23 1q7h h GLU 128 N -0.17 0.96 -0.03 4.80 4.81 -1.90 -2.30 114.58 120.76 1q7h h GLU 128 Ca -0.00 -0.29 0.00 0.00 -0.13 0.00 0.00 59.36 58.93 1q7h h GLU 128 Cb 0.15 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.44 1q7h h GLU 128 CO -0.00 0.96 0.00 0.28 -0.73 0.00 0.00 179.01 179.51 1q7h n VAL 129 N -4.19 0.00 0.00 0.32 0.31 -0.91 -1.49 118.33 112.37 1q7h n VAL 129 Ca 0.03 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.36 1q7h n VAL 129 Cb 0.34 -0.10 0.00 0.00 -0.91 0.00 0.00 33.84 33.17 1q7h n VAL 129 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1q7h n ALA 131 N 0.31 0.00 -0.10 3.52 0.00 -0.87 -0.28 120.51 123.10 1q7h n ALA 131 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.31 1q7h n ALA 131 Cb 0.01 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.34 1q7h n ALA 131 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1q7h n THR 132 N 0.00 1.25 -3.46 0.00 -2.24 -0.56 -5.01 114.28 104.26 1q7h n THR 132 Ca 0.00 -0.59 -0.24 0.00 -2.27 0.00 0.00 64.05 60.94 1q7h n THR 132 Cb 0.00 -0.99 0.06 0.00 -2.10 0.00 0.00 70.33 67.30 1q7h n THR 132 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1q7h n LYS 133 N -2.95 -6.56 -3.74 -0.78 4.76 0.62 -4.99 118.16 104.52 1q7h n LYS 133 Ca -0.35 0.81 -0.14 0.00 -2.87 0.00 0.00 58.31 55.76 1q7h n LYS 133 Cb 0.98 -5.78 -0.08 0.00 -1.84 0.00 0.00 35.03 28.31 1q7h n LYS 133 CO 0.00 0.00 0.00 -0.98 -1.37 0.00 0.00 177.40 175.05 1q7h s ARG 134 N -6.17 0.70 0.00 1.97 1.70 -1.26 -3.42 118.95 112.47 1q7h s ARG 134 Ca 0.51 -0.16 0.00 0.00 -0.47 0.00 0.00 55.73 55.61 1q7h s ARG 134 Cb -0.23 0.31 0.00 0.00 -0.57 0.00 0.00 34.95 34.46 1q7h s ARG 134 CO 0.63 -0.19 0.00 0.41 -1.08 0.00 0.00 175.30 175.06 1q7h n GLY 135 N 1.24 1.82 3.60 3.88 0.00 -1.26 -4.74 105.19 109.74 1q7h n GLY 135 Ca -0.21 -2.03 -0.43 0.00 0.00 0.00 0.00 46.02 43.34 1q7h n GLY 135 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1q7h s LYS 136 N -2.12 3.76 0.13 1.61 2.20 -1.26 -0.88 119.74 123.17 1q7h s LYS 136 Ca 0.00 0.64 -0.01 0.00 -0.36 0.00 0.00 55.97 56.24 1q7h s LYS 136 Cb 0.00 -3.89 -0.11 0.00 -1.51 0.00 0.00 37.83 32.32 1q7h s LYS 136 CO 0.00 -1.34 1.30 0.00 -0.36 0.00 0.00 175.35 174.95 1q7h h ALA 137 N 9.16 0.37 -2.59 3.13 0.00 -1.08 -3.41 119.26 124.83 1q7h h ALA 137 Ca -0.23 -0.77 0.03 0.00 0.00 0.00 0.00 54.91 53.94 1q7h h ALA 137 Cb 1.06 -0.05 -0.14 0.00 0.00 0.00 0.00 17.79 18.66 1q7h h ALA 137 CO 1.12 0.92 0.33 0.00 0.00 0.00 0.00 179.25 181.62 1q7h s ALA 138 N -3.06 -1.71 -0.09 0.00 0.00 -0.90 0.27 121.76 116.27 1q7h s ALA 138 Ca -0.04 0.80 -0.02 0.00 0.00 0.00 0.00 51.96 52.70 1q7h s ALA 138 Cb 0.09 0.58 -0.03 0.00 0.00 0.00 0.00 23.12 23.76 1q7h s ALA 138 CO 0.85 -0.69 0.01 -0.98 0.00 0.00 0.00 175.76 174.95 1q7h s ARG 139 N -3.23 3.01 -0.13 0.00 1.70 -1.26 -0.68 118.95 118.36 1q7h s ARG 139 Ca 0.02 -0.39 -0.22 0.00 -0.47 0.00 0.00 55.73 54.67 1q7h s ARG 139 Cb -0.01 -2.82 -0.03 0.00 -0.57 0.00 0.00 34.95 31.52 1q7h s ARG 139 CO -0.09 0.71 0.64 0.42 -1.08 0.00 0.00 175.30 175.90 1q7h s ILE 140 N -0.90 5.05 -0.62 4.99 1.09 -1.26 -4.41 121.20 125.14 1q7h s ILE 140 Ca 0.13 1.27 0.14 0.00 -1.10 0.00 0.00 60.65 61.10 1q7h s ILE 140 Cb -0.11 -3.97 -0.16 0.00 -1.06 0.00 0.00 42.46 37.16 1q7h s ILE 140 CO 0.03 0.19 0.58 2.30 -0.10 0.00 0.00 174.94 177.94 1q7h n ILE 141 N 4.18 0.00 -3.67 2.92 -5.35 -0.09 -4.97 119.36 112.38 1q7h n ILE 141 Ca -0.02 -0.18 -0.11 0.00 -0.27 0.00 0.00 62.75 62.18 1q7h n ILE 141 Cb 0.51 0.95 -0.09 0.00 -1.74 0.00 0.00 39.64 39.26 1q7h n ILE 141 CO 0.00 0.00 0.00 -2.28 -1.76 0.00 0.00 176.55 172.51 1q7h s HIS 142 N -2.37 -0.77 0.19 4.28 5.04 -1.07 -4.98 115.29 115.62 1q7h s HIS 142 Ca 0.05 1.66 -0.13 0.00 -1.54 0.00 0.00 55.06 55.09 1q7h s HIS 142 Cb 0.11 0.37 0.01 0.00 0.04 0.00 0.00 32.58 33.10 1q7h s HIS 142 CO 0.58 -0.39 0.43 -0.59 -2.34 0.00 0.00 174.74 172.42 1q7h s PHE 143 N 1.05 0.16 0.31 3.88 -0.12 -1.26 -0.92 117.98 121.07 1q7h s PHE 143 Ca -0.06 -0.51 -0.30 0.00 -0.05 0.00 0.00 56.93 56.01 1q7h s PHE 143 Cb -0.06 0.19 -0.12 0.00 -0.63 0.00 0.00 43.02 42.40 1q7h s PHE 143 CO -0.10 -0.86 1.47 -2.30 -0.05 0.00 0.00 175.22 173.39 1q7h n PRO 144 N -0.30 2.43 -1.02 1.99 -0.02 -1.26 -2.32 135.00 134.51 1q7h n PRO 144 Ca -0.08 0.86 -0.01 0.00 -2.02 0.00 0.00 63.50 62.26 1q7h n PRO 144 Cb 0.62 -2.56 -0.00 0.00 -0.02 0.00 0.00 33.50 31.54 1q7h n PRO 144 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1q7h n GLY 145 N 1.56 0.33 0.57 -1.23 0.00 -1.26 -4.88 105.19 100.28 1q7h n GLY 145 Ca 0.07 -0.04 -0.05 0.00 0.00 0.00 0.00 46.02 46.00 1q7h n GLY 145 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1q7h n ASP 146 N -0.38 -0.71 -0.09 1.61 5.75 -0.98 -4.64 116.55 117.11 1q7h n ASP 146 Ca -0.01 -0.79 -0.00 0.00 -0.01 0.00 0.00 54.79 53.98 1q7h n ASP 146 Cb 0.23 -0.16 0.27 0.00 -1.03 0.00 0.00 41.12 40.43 1q7h n ASP 146 CO 0.00 0.00 0.00 1.05 -0.11 0.00 0.00 177.20 178.14 1q7h h GLU 147 N 0.00 0.73 -0.50 0.11 4.11 -1.95 -1.26 114.58 115.83 1q7h h GLU 147 Ca -0.07 -0.11 -0.03 0.00 0.07 0.00 0.00 59.36 59.23 1q7h h GLU 147 Cb 0.19 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.29 1q7h h GLU 147 CO 0.04 0.61 0.18 -0.07 0.07 0.00 0.00 179.01 179.85 1q7h h LEU 148 N 0.72 0.70 -0.53 3.06 3.38 -1.93 -0.22 115.31 120.49 1q7h h LEU 148 Ca 0.17 -0.18 -0.16 0.00 0.09 0.00 0.00 57.88 57.80 1q7h h LEU 148 Cb 0.16 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 1q7h h LEU 148 CO -0.02 0.69 -0.63 0.40 0.09 0.00 0.00 178.44 178.97 1q7h h ILE 149 N 0.66 1.37 -0.04 1.22 2.04 -1.81 -1.41 117.51 119.54 1q7h h ILE 149 Ca 0.16 -1.98 -0.13 0.00 1.00 0.00 0.00 64.86 63.91 1q7h h ILE 149 Cb 0.22 1.98 -0.01 0.00 -0.74 0.00 0.00 36.82 38.26 1q7h h ILE 149 CO -0.01 0.60 -0.57 0.03 0.00 0.00 0.00 178.15 178.20 1q7h h ARG 150 N 0.28 0.13 0.00 2.37 3.08 -1.09 -3.05 114.38 116.11 1q7h h ARG 150 Ca -0.01 -0.09 -0.13 0.00 0.07 0.00 0.00 59.98 59.82 1q7h h ARG 150 Cb 1.17 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 31.21 1q7h h ARG 150 CO 0.11 0.67 -0.61 0.00 -1.07 0.00 0.00 179.97 179.06 1q7h h ALA 151 N 1.32 0.63 -2.16 0.04 0.00 -0.89 -3.38 119.26 114.82 1q7h h ALA 151 Ca -0.00 -0.55 -0.59 0.00 0.00 0.00 0.00 54.91 53.76 1q7h h ALA 151 Cb 1.03 -0.10 -0.42 0.00 0.00 0.00 0.00 17.79 18.31 1q7h h ALA 151 CO 0.08 0.76 -0.67 1.19 0.00 0.00 0.00 179.25 180.61 1q7h n PHE 152 N -3.29 3.06 0.00 0.00 3.72 -0.54 -5.05 117.46 115.36 1q7h n PHE 152 Ca 0.01 -4.07 0.00 0.00 -0.05 0.00 0.00 57.45 53.35 1q7h n PHE 152 Cb 0.76 -0.53 0.00 0.00 -0.94 0.00 0.00 39.48 38.77 1q7h n PHE 152 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 176.76 174.41