#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ggg s VAL 6 N 0.00 5.17 -0.20 4.08 1.01 -1.26 0.01 120.40 129.21 1ggg s VAL 6 Ca 0.00 0.54 -0.00 0.00 0.00 0.00 0.00 61.98 62.52 1ggg s VAL 6 Cb 0.00 -3.71 0.01 0.00 0.00 0.00 0.00 36.38 32.68 1ggg s VAL 6 CO 0.00 0.14 -0.14 -0.69 0.00 0.00 0.00 175.10 174.41 1ggg s VAL 7 N 2.08 2.50 0.16 2.92 1.01 0.14 -1.39 120.40 127.81 1ggg s VAL 7 Ca 0.15 -0.86 0.04 0.00 0.00 0.00 0.00 61.98 61.30 1ggg s VAL 7 Cb -0.16 -2.12 -0.04 0.00 0.00 0.00 0.00 36.38 34.07 1ggg s VAL 7 CO 0.10 0.45 0.24 0.00 0.00 0.00 0.00 175.10 175.89 1ggg s ALA 8 N 1.34 3.83 0.15 5.51 0.00 -0.95 -1.61 121.76 130.03 1ggg s ALA 8 Ca 0.04 -1.11 -0.04 0.00 0.00 0.00 0.00 51.96 50.85 1ggg s ALA 8 Cb -0.14 -1.64 -0.03 0.00 0.00 0.00 0.00 23.12 21.32 1ggg s ALA 8 CO -0.09 0.50 0.14 0.95 0.00 0.00 0.00 175.76 177.26 1ggg s THR 9 N -1.77 0.08 0.80 0.00 -4.23 -1.19 -1.88 115.64 107.45 1ggg s THR 9 Ca 0.33 -1.74 -0.14 0.00 -1.18 0.00 0.00 61.69 58.96 1ggg s THR 9 Cb -0.11 -2.02 0.04 0.00 1.34 0.00 0.00 72.50 71.76 1ggg s THR 9 CO 0.27 -0.37 0.89 -0.67 -0.54 0.00 0.00 174.62 174.20 1ggg n ASP 10 N -0.15 -0.08 0.09 3.99 -0.08 -1.26 -1.18 116.55 117.88 1ggg n ASP 10 Ca -0.05 0.55 -0.04 0.00 -1.51 0.00 0.00 54.79 53.74 1ggg n ASP 10 Cb 0.64 -1.38 -0.07 0.00 2.34 0.00 0.00 41.12 42.65 1ggg n ASP 10 CO 0.00 0.00 0.00 0.74 0.12 0.00 0.00 177.20 178.06 1ggg h THR 11 N -0.82 1.44 -1.24 5.18 2.02 -1.84 -3.40 112.91 114.25 1ggg h THR 11 Ca -0.46 -3.01 0.11 0.00 0.77 0.00 0.00 66.41 63.82 1ggg h THR 11 Cb 1.31 2.70 -0.21 0.00 -1.74 0.00 0.00 68.15 70.21 1ggg h THR 11 CO 0.43 0.82 -0.12 0.00 0.37 0.00 0.00 175.52 177.02 1ggg s ALA 12 N -2.81 -2.38 -0.36 6.16 0.00 -1.26 -4.74 121.76 116.36 1ggg s ALA 12 Ca 0.02 1.99 0.01 0.00 0.00 0.00 0.00 51.96 53.98 1ggg s ALA 12 Cb 0.09 -2.07 0.15 0.00 0.00 0.00 0.00 23.12 21.29 1ggg s ALA 12 CO 0.79 -1.17 0.28 0.12 0.00 0.00 0.00 175.76 175.79 1ggg s PHE 13 N 2.83 0.35 0.14 0.00 5.36 -0.21 -5.03 117.98 121.43 1ggg s PHE 13 Ca 0.07 -1.38 -0.30 0.00 -0.96 0.00 0.00 56.93 54.36 1ggg s PHE 13 Cb -0.12 -0.71 -0.07 0.00 -0.34 0.00 0.00 43.02 41.78 1ggg s PHE 13 CO -0.19 -0.88 0.97 0.08 -1.46 0.00 0.00 175.22 173.73 1ggg s VAL 14 N 1.12 4.37 -0.44 3.12 1.01 -1.25 -0.24 120.40 128.09 1ggg s VAL 14 Ca 0.19 2.04 0.04 0.00 0.00 0.00 0.00 61.98 64.25 1ggg s VAL 14 Cb -0.18 -4.30 0.62 0.00 0.00 0.00 0.00 36.38 32.51 1ggg s VAL 14 CO -0.02 0.35 1.84 -0.81 0.00 0.00 0.00 175.10 176.47 1ggg n PRO 15 N 2.51 2.23 0.11 2.72 -0.04 -1.26 -4.92 135.00 136.34 1ggg n PRO 15 Ca 0.02 -3.08 -0.24 0.00 -0.04 0.00 0.00 63.50 60.16 1ggg n PRO 15 Cb 0.49 -2.13 -0.15 0.00 -0.04 0.00 0.00 33.50 31.66 1ggg n PRO 15 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 1ggg h PHE 16 N 1.10 0.84 -1.98 0.54 0.04 -0.93 -1.19 116.94 115.36 1ggg h PHE 16 Ca 0.56 -0.62 -0.04 0.00 2.80 0.00 0.00 57.97 60.68 1ggg h PHE 16 Cb 2.48 -0.03 -0.21 0.00 2.20 0.00 0.00 35.95 40.39 1ggg h PHE 16 CO 1.48 1.60 0.15 -1.83 -0.60 0.00 0.00 178.31 179.11 1ggg s GLU 17 N -2.58 0.83 -0.00 1.51 1.03 0.16 -1.92 118.70 117.72 1ggg s GLU 17 Ca -0.12 0.96 -0.30 0.00 0.03 0.00 0.00 54.97 55.54 1ggg s GLU 17 Cb 0.04 0.40 0.11 0.00 -0.80 0.00 0.00 34.13 33.89 1ggg s GLU 17 CO 0.90 -0.10 1.24 -0.59 -1.33 0.00 0.00 175.26 175.37 1ggg s PHE 18 N 0.34 -0.06 -0.25 4.83 -0.71 -0.79 -1.04 117.98 120.29 1ggg s PHE 18 Ca -0.00 -0.07 -0.12 0.00 -1.04 0.00 0.00 56.93 55.70 1ggg s PHE 18 Cb -0.05 0.56 -0.05 0.00 -1.21 0.00 0.00 43.02 42.27 1ggg s PHE 18 CO 0.01 -0.35 0.25 0.21 -1.34 0.00 0.00 175.22 174.00 1ggg s LYS 19 N -2.54 4.03 -0.58 1.99 2.20 -1.26 -1.37 119.74 122.21 1ggg s LYS 19 Ca 0.14 -0.15 0.03 0.00 -0.36 0.00 0.00 55.97 55.62 1ggg s LYS 19 Cb 0.04 -3.60 0.14 0.00 -1.51 0.00 0.00 37.83 32.90 1ggg s LYS 19 CO -0.03 -0.10 0.34 -1.14 -0.36 0.00 0.00 175.35 174.06 1ggg s GLN 20 N 1.54 2.20 6.74 4.03 2.00 -0.80 -4.97 119.66 130.40 1ggg s GLN 20 Ca 0.11 -2.72 0.00 0.00 -2.00 0.00 0.00 55.36 50.75 1ggg s GLN 20 Cb -0.15 -3.44 0.00 0.00 0.80 0.00 0.00 33.01 30.22 1ggg s GLN 20 CO 0.08 -1.15 0.00 0.41 -0.50 0.00 0.00 175.29 174.13 1ggg n GLY 21 N 3.02 2.01 0.28 2.59 0.00 -1.26 -3.14 105.19 108.68 1ggg n GLY 21 Ca 0.08 -0.21 0.03 0.00 0.00 0.00 0.00 46.02 45.93 1ggg n GLY 21 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1ggg n ASP 22 N 9.90 1.64 -1.85 1.61 2.03 -1.26 -4.99 116.55 123.64 1ggg n ASP 22 Ca 0.00 -1.34 0.00 0.00 0.52 0.00 0.00 54.79 53.97 1ggg n ASP 22 Cb 0.00 -0.01 0.00 0.00 -0.72 0.00 0.00 41.12 40.39 1ggg n ASP 22 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1ggg n LEU 23 N 0.35 0.00 -4.44 -2.67 -0.00 -1.19 -5.15 117.00 103.90 1ggg n LEU 23 Ca 0.04 0.00 -0.29 0.00 -0.00 0.00 0.00 56.01 55.76 1ggg n LEU 23 Cb 0.18 0.00 -0.12 0.00 -0.00 0.00 0.00 43.42 43.48 1ggg n LEU 23 CO 0.04 -0.08 -0.53 -0.31 -0.00 0.00 0.00 177.39 176.51 1ggg s TYR 24 N -0.51 2.43 0.17 1.47 1.51 -1.26 -1.91 117.35 119.25 1ggg s TYR 24 Ca 0.00 -0.32 -0.02 0.00 -1.01 0.00 0.00 57.07 55.72 1ggg s TYR 24 Cb 0.00 -1.30 -0.04 0.00 -0.11 0.00 0.00 41.96 40.51 1ggg s TYR 24 CO 0.00 0.36 0.12 0.14 -1.11 0.00 0.00 175.55 175.06 1ggg s VAL 25 N -1.10 0.04 -5.00 0.71 -7.23 -0.47 -4.90 120.40 102.45 1ggg s VAL 25 Ca 0.16 -1.92 0.00 0.00 -1.81 0.00 0.00 61.98 58.41 1ggg s VAL 25 Cb -0.10 -2.28 0.00 0.00 0.56 0.00 0.00 36.38 34.55 1ggg s VAL 25 CO 0.08 -0.19 0.00 0.61 -0.31 0.00 0.00 175.10 175.29 1ggg n GLY 26 N -0.20 0.78 0.15 2.32 0.00 -1.26 -1.88 105.19 105.10 1ggg n GLY 26 Ca -0.01 -1.90 -0.10 0.00 0.00 0.00 0.00 46.02 44.01 1ggg n GLY 26 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1ggg h PHE 27 N 0.00 0.44 -0.27 1.61 3.57 -0.85 -1.78 116.94 119.66 1ggg h PHE 27 Ca 0.00 -0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.46 1ggg h PHE 27 Cb 0.00 -0.13 -0.01 0.00 2.79 0.00 0.00 35.95 38.59 1ggg h PHE 27 CO 0.00 0.40 0.11 -0.44 -2.23 0.00 0.00 178.31 176.15 1ggg h ASP 28 N 0.34 0.37 -0.67 0.41 3.32 -1.65 -0.90 116.42 117.65 1ggg h ASP 28 Ca 0.10 -0.16 -0.02 0.00 0.02 0.00 0.00 57.03 56.97 1ggg h ASP 28 Cb 0.14 -0.10 -0.03 0.00 0.22 0.00 0.00 39.33 39.56 1ggg h ASP 28 CO -0.01 0.43 0.36 0.58 -1.72 0.00 0.00 179.24 178.88 1ggg h VAL 29 N 0.29 1.21 0.01 -1.35 2.07 -1.59 -0.30 116.25 116.60 1ggg h VAL 29 Ca 0.09 -0.55 -0.27 0.00 0.82 0.00 0.00 66.70 66.79 1ggg h VAL 29 Cb 0.17 0.30 0.02 0.00 -1.52 0.00 0.00 31.29 30.26 1ggg h VAL 29 CO -0.01 0.24 -1.05 0.44 0.02 0.00 0.00 177.57 177.21 1ggg h ASP 30 N 0.96 0.87 -0.22 0.57 3.32 -1.23 -2.35 116.42 118.35 1ggg h ASP 30 Ca 0.24 -0.71 -0.13 0.00 0.02 0.00 0.00 57.03 56.45 1ggg h ASP 30 Cb 0.05 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.32 1ggg h ASP 30 CO -0.04 1.51 -0.32 0.25 -1.72 0.00 0.00 179.24 178.92 1ggg h LEU 31 N 0.37 0.77 -0.18 1.55 5.85 -0.74 -2.52 115.31 120.41 1ggg h LEU 31 Ca -0.13 -0.31 -0.12 0.00 0.84 0.00 0.00 57.88 58.15 1ggg h LEU 31 Cb 1.71 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 42.53 1ggg h LEU 31 CO 0.20 1.03 -0.38 -0.25 -0.34 0.00 0.00 178.44 178.71 1ggg h TRP 32 N 0.62 0.72 -0.77 1.25 2.91 -1.16 -2.21 115.95 117.30 1ggg h TRP 32 Ca 0.07 -0.26 0.15 0.00 1.13 0.00 0.00 58.89 59.98 1ggg h TRP 32 Cb 0.85 -0.13 -0.10 0.00 -0.51 0.00 0.00 29.16 29.27 1ggg h TRP 32 CO 0.04 1.01 0.31 0.00 -1.03 0.00 0.00 178.44 178.77 1ggg h ALA 33 N 0.58 1.10 -0.42 2.65 0.00 -1.44 0.55 119.26 122.28 1ggg h ALA 33 Ca 0.00 0.12 -0.07 0.00 0.00 0.00 0.00 54.91 54.97 1ggg h ALA 33 Cb 0.98 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.86 1ggg h ALA 33 CO 0.08 -0.23 0.00 0.00 0.00 0.00 0.00 179.25 179.11 1ggg h ALA 34 N 1.57 0.56 -0.25 0.00 0.00 -1.45 -2.24 119.26 117.45 1ggg h ALA 34 Ca 0.43 -0.26 -0.04 0.00 0.00 0.00 0.00 54.91 55.04 1ggg h ALA 34 Cb 0.69 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 1ggg h ALA 34 CO -0.43 0.34 -0.03 0.82 0.00 0.00 0.00 179.25 179.95 1ggg h ILE 35 N 0.57 1.17 -0.04 0.00 2.04 -0.67 -2.63 117.51 117.95 1ggg h ILE 35 Ca 0.12 -0.68 -0.12 0.00 1.00 0.00 0.00 64.86 65.18 1ggg h ILE 35 Cb 0.48 1.01 -0.01 0.00 -0.74 0.00 0.00 36.82 37.55 1ggg h ILE 35 CO 0.02 0.23 -0.52 0.00 0.00 0.00 0.00 178.15 177.87 1ggg h ALA 36 N 1.62 1.06 -0.58 1.87 0.00 -0.75 -2.78 119.26 119.71 1ggg h ALA 36 Ca 0.08 -0.48 -0.09 0.00 0.00 0.00 0.00 54.91 54.42 1ggg h ALA 36 Cb 0.29 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 1ggg h ALA 36 CO 0.01 0.66 0.00 0.87 0.00 0.00 0.00 179.25 180.79 1ggg h LYS 37 N 0.08 1.01 -0.44 0.00 1.57 -1.12 0.39 116.57 118.05 1ggg h LYS 37 Ca -0.00 -0.31 -0.01 0.00 -1.87 0.00 0.00 60.65 58.47 1ggg h LYS 37 Cb 0.95 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 33.14 1ggg h LYS 37 CO 0.07 0.99 0.25 0.93 -0.57 0.00 0.00 179.45 181.12 1ggg h GLU 38 N 0.92 0.61 -0.01 3.15 4.39 -1.21 -3.02 114.58 119.41 1ggg h GLU 38 Ca 0.17 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.80 1ggg h GLU 38 Cb 0.53 -0.12 0.00 0.00 -0.10 0.00 0.00 28.75 29.06 1ggg h GLU 38 CO 0.03 0.47 -0.49 1.28 -1.16 0.00 0.00 179.01 179.14 1ggg n LEU 39 N -4.72 1.56 -3.33 1.33 4.77 -1.08 -5.00 117.00 110.53 1ggg n LEU 39 Ca 0.01 -0.56 -0.15 0.00 -0.03 0.00 0.00 56.01 55.28 1ggg n LEU 39 Cb 0.07 -0.04 0.04 0.00 -2.33 0.00 0.00 43.42 41.15 1ggg n LEU 39 CO 0.36 0.30 0.09 0.29 -1.33 0.00 0.00 177.39 177.09 1ggg n LYS 40 N -0.45 -1.65 -4.14 3.23 4.76 -0.04 -4.99 118.16 114.87 1ggg n LYS 40 Ca 0.09 0.97 -0.32 0.00 -2.87 0.00 0.00 58.31 56.18 1ggg n LYS 40 Cb 0.41 -5.13 -0.07 0.00 -1.84 0.00 0.00 35.03 28.40 1ggg n LYS 40 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1ggg s LEU 41 N -5.16 3.72 -0.01 -0.35 1.02 -0.21 -5.03 118.68 112.65 1ggg s LEU 41 Ca 0.28 0.03 -0.07 0.00 0.02 0.00 0.00 54.13 54.39 1ggg s LEU 41 Cb -0.06 -2.24 -0.05 0.00 0.02 0.00 0.00 46.19 43.86 1ggg s LEU 41 CO 0.78 0.24 0.26 -1.81 0.02 0.00 0.00 176.35 175.84 1ggg s ASP 42 N -1.90 6.50 0.10 2.29 1.01 -1.26 -4.81 116.67 118.60 1ggg s ASP 42 Ca 0.24 0.57 -0.17 0.00 0.71 0.00 0.00 52.55 53.91 1ggg s ASP 42 Cb -0.12 -2.10 0.03 0.00 1.01 0.00 0.00 42.92 41.75 1ggg s ASP 42 CO 0.15 0.28 0.40 -0.72 0.21 0.00 0.00 175.17 175.50 1ggg s TYR 43 N -1.24 -0.22 -0.08 4.23 1.13 -1.26 -0.76 117.35 119.16 1ggg s TYR 43 Ca 0.25 -0.03 0.03 0.00 -1.41 0.00 0.00 57.07 55.92 1ggg s TYR 43 Cb -0.13 0.24 -0.02 0.00 -1.10 0.00 0.00 41.96 40.95 1ggg s TYR 43 CO 0.14 -0.66 -0.17 -2.00 -2.51 0.00 0.00 175.55 170.34 1ggg s GLU 44 N -3.44 2.79 0.16 -3.49 2.12 0.10 -4.87 118.70 112.07 1ggg s GLU 44 Ca 0.01 -0.76 -0.08 0.00 0.36 0.00 0.00 54.97 54.50 1ggg s GLU 44 Cb 0.01 -2.39 -0.06 0.00 0.26 0.00 0.00 34.13 31.95 1ggg s GLU 44 CO -0.09 0.42 0.45 -1.17 -0.54 0.00 0.00 175.26 174.33 1ggg s LEU 45 N -0.22 4.25 -0.43 2.70 0.20 -1.26 0.24 118.68 124.15 1ggg s LEU 45 Ca -0.00 0.77 0.06 0.00 0.69 0.00 0.00 54.13 55.65 1ggg s LEU 45 Cb -0.13 -3.39 0.18 0.00 -0.43 0.00 0.00 46.19 42.41 1ggg s LEU 45 CO 0.03 0.03 0.56 -0.75 -0.29 0.00 0.00 176.35 175.93 1ggg s LYS 46 N -2.56 0.86 0.34 1.98 2.20 -0.63 -4.91 119.74 117.02 1ggg s LYS 46 Ca 0.42 -0.90 -0.29 0.00 -0.36 0.00 0.00 55.97 54.84 1ggg s LYS 46 Cb -0.12 -0.35 -0.10 0.00 -1.51 0.00 0.00 37.83 35.74 1ggg s LYS 46 CO 0.22 -1.26 1.33 -1.25 -0.36 0.00 0.00 175.35 174.03 1ggg s PRO 47 N 1.21 4.32 0.17 4.03 0.04 -1.26 -3.17 135.00 140.34 1ggg s PRO 47 Ca 0.23 2.26 -0.14 0.00 0.04 0.00 0.00 61.00 63.39 1ggg s PRO 47 Cb -0.05 -3.05 0.02 0.00 0.04 0.00 0.00 34.50 31.45 1ggg s PRO 47 CO -0.07 -0.24 0.42 0.00 0.04 0.00 0.00 177.00 177.16 1ggg s MET 48 N -1.84 1.25 0.34 4.56 0.23 -0.32 -4.90 119.30 118.61 1ggg s MET 48 Ca 0.49 -0.93 -0.29 0.00 -1.03 0.00 0.00 55.69 53.94 1ggg s MET 48 Cb -0.41 0.46 -0.11 0.00 -1.53 0.00 0.00 34.83 33.25 1ggg s MET 48 CO 0.54 -0.50 1.49 0.34 -2.03 0.00 0.00 175.02 174.87 1ggg s ASP 49 N -2.89 6.41 0.22 -1.18 -1.08 -1.26 -2.52 116.67 114.36 1ggg s ASP 49 Ca 0.10 2.97 -0.09 0.00 -0.52 0.00 0.00 52.55 55.01 1ggg s ASP 49 Cb 0.01 -2.66 0.32 0.00 -1.46 0.00 0.00 42.92 39.14 1ggg s ASP 49 CO -0.04 -0.84 1.69 0.15 0.52 0.00 0.00 175.17 176.65 1ggg h PHE 50 N 3.62 0.17 0.00 -5.34 3.57 -1.96 -1.79 116.94 115.20 1ggg h PHE 50 Ca -0.49 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.04 1ggg h PHE 50 Cb 1.23 0.02 0.00 0.00 2.79 0.00 0.00 35.95 39.99 1ggg h PHE 50 CO 0.55 -0.07 0.00 0.43 -2.23 0.00 0.00 178.31 176.99 1ggg n SER 51 N -5.16 0.00 -0.99 0.41 7.64 -1.26 -0.65 113.62 113.61 1ggg n SER 51 Ca 0.10 -1.31 0.12 0.00 1.01 0.00 0.00 58.87 58.79 1ggg n SER 51 Cb 0.35 0.00 0.18 0.00 -1.01 0.00 0.00 64.21 63.74 1ggg n SER 51 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ggg n GLY 52 N 0.65 1.18 0.07 0.23 0.00 -0.67 -4.59 105.19 102.05 1ggg n GLY 52 Ca 0.12 -0.68 -0.11 0.00 0.00 0.00 0.00 46.02 45.36 1ggg n GLY 52 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1ggg h ILE 53 N 4.36 0.94 -0.61 -0.61 2.04 -0.98 -3.04 117.51 119.62 1ggg h ILE 53 Ca 0.00 -1.80 -0.02 0.00 1.00 0.00 0.00 64.86 64.04 1ggg h ILE 53 Cb 0.94 1.87 -0.03 0.00 -0.74 0.00 0.00 36.82 38.87 1ggg h ILE 53 CO 0.00 0.32 0.31 0.40 0.00 0.00 0.00 178.15 179.18 1ggg h ILE 54 N -1.00 1.21 -0.87 -0.67 2.04 -1.81 0.14 117.51 116.54 1ggg h ILE 54 Ca -0.07 -0.56 0.22 0.00 1.00 0.00 0.00 64.86 65.46 1ggg h ILE 54 Cb 0.73 0.46 -0.13 0.00 -0.74 0.00 0.00 36.82 37.14 1ggg h ILE 54 CO -0.04 0.23 0.31 -0.65 0.00 0.00 0.00 178.15 178.00 1ggg h PRO 55 N 0.83 0.30 0.00 2.37 0.11 -1.82 0.52 132.00 134.31 1ggg h PRO 55 Ca 0.21 -0.02 -0.16 0.00 0.11 0.00 0.00 66.00 66.14 1ggg h PRO 55 Cb 0.09 -0.07 -0.02 0.00 0.11 0.00 0.00 31.00 31.11 1ggg h PRO 55 CO -0.03 0.20 -0.78 0.00 -0.21 0.00 0.00 178.00 177.18 1ggg h ALA 56 N 1.73 0.52 -0.43 -0.75 0.00 -0.98 -2.63 119.26 116.72 1ggg h ALA 56 Ca 0.54 -0.70 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 1ggg h ALA 56 Cb 1.05 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.72 1ggg h ALA 56 CO -0.58 0.95 0.23 -0.07 0.00 0.00 0.00 179.25 179.79 1ggg h LEU 57 N 0.00 0.54 -0.96 0.00 -0.00 0.60 0.45 115.31 115.94 1ggg h LEU 57 Ca -0.01 -0.09 -0.07 0.00 -0.00 0.00 0.00 57.88 57.71 1ggg h LEU 57 Cb 1.59 -0.14 -0.01 0.00 -0.00 0.00 0.00 40.66 42.10 1ggg h LEU 57 CO 0.10 0.48 -0.32 1.56 -0.00 0.00 0.00 178.44 180.26 1ggg h GLN 58 N 0.56 0.00 -0.01 1.13 4.20 -0.60 -2.10 115.11 118.30 1ggg h GLN 58 Ca 0.15 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.86 1ggg h GLN 58 Cb 0.06 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.84 1ggg h GLN 58 CO -0.02 0.32 -0.04 0.25 -0.67 0.00 0.00 178.83 178.67 1ggg n THR 59 N -3.47 0.00 -3.84 -0.54 -2.24 -1.07 -4.92 114.28 98.19 1ggg n THR 59 Ca -0.00 -0.21 -0.28 0.00 -2.27 0.00 0.00 64.05 61.30 1ggg n THR 59 Cb 0.49 0.39 0.03 0.00 -2.10 0.00 0.00 70.33 69.14 1ggg n THR 59 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1ggg n LYS 60 N -0.06 -5.51 0.00 -0.78 5.02 -0.79 -4.89 118.16 111.14 1ggg n LYS 60 Ca 0.18 0.62 0.14 0.00 -2.02 0.00 0.00 58.31 57.23 1ggg n LYS 60 Cb 0.33 -5.43 0.55 0.00 -0.02 0.00 0.00 35.03 30.46 1ggg n LYS 60 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1ggg n ASN 61 N -2.90 0.21 -3.62 4.39 5.15 0.14 -4.77 115.26 113.86 1ggg n ASN 61 Ca -0.05 0.03 -0.15 0.00 -0.60 0.00 0.00 54.58 53.81 1ggg n ASN 61 Cb 0.57 -0.22 -0.07 0.00 -0.53 0.00 0.00 39.78 39.53 1ggg n ASN 61 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 1ggg s VAL 62 N -2.84 0.00 -0.05 3.44 1.01 -1.18 -4.98 120.40 115.81 1ggg s VAL 62 Ca 0.18 -0.04 0.13 0.00 0.00 0.00 0.00 61.98 62.25 1ggg s VAL 62 Cb 0.19 -0.91 -0.23 0.00 0.00 0.00 0.00 36.38 35.44 1ggg s VAL 62 CO 0.55 -0.02 0.65 0.47 0.00 0.00 0.00 175.10 176.75 1ggg n ASP 63 N 2.08 0.84 -3.67 3.32 8.00 -0.49 -4.59 116.55 122.05 1ggg n ASP 63 Ca -0.16 0.40 -0.08 0.00 0.71 0.00 0.00 54.79 55.66 1ggg n ASP 63 Cb 0.56 -0.02 -0.02 0.00 -0.02 0.00 0.00 41.12 41.62 1ggg n ASP 63 CO 0.00 0.00 0.00 -1.48 -0.39 0.00 0.00 177.20 175.33 1ggg s LEU 64 N -6.06 -0.35 -0.06 0.64 2.34 -1.22 -4.47 118.68 109.50 1ggg s LEU 64 Ca -0.05 -0.32 -0.10 0.00 0.06 0.00 0.00 54.13 53.72 1ggg s LEU 64 Cb 0.08 2.50 0.02 0.00 -0.56 0.00 0.00 46.19 48.23 1ggg s LEU 64 CO 0.82 -1.07 0.25 0.00 -1.06 0.00 0.00 176.35 175.30 1ggg s ALA 65 N -3.65 -0.62 -0.09 1.48 0.00 -0.23 -2.24 121.76 116.40 1ggg s ALA 65 Ca 0.08 0.51 0.02 0.00 0.00 0.00 0.00 51.96 52.57 1ggg s ALA 65 Cb -0.03 -0.24 0.01 0.00 0.00 0.00 0.00 23.12 22.86 1ggg s ALA 65 CO -0.02 -0.17 -0.14 -0.51 0.00 0.00 0.00 175.76 174.92 1ggg s LEU 66 N -0.41 1.70 -0.17 0.00 1.02 -0.79 -0.84 118.68 119.19 1ggg s LEU 66 Ca -0.05 -0.38 0.07 0.00 0.02 0.00 0.00 54.13 53.78 1ggg s LEU 66 Cb -0.03 -1.00 0.21 0.00 0.02 0.00 0.00 46.19 45.38 1ggg s LEU 66 CO 0.01 0.03 1.12 0.00 0.02 0.00 0.00 176.35 177.53 1ggg n ALA 67 N 4.01 2.00 -3.53 4.21 0.00 -1.26 -3.87 120.51 122.06 1ggg n ALA 67 Ca -0.20 -0.68 -0.21 0.00 0.00 0.00 0.00 53.44 52.35 1ggg n ALA 67 Cb 0.52 -0.60 0.05 0.00 0.00 0.00 0.00 19.45 19.42 1ggg n ALA 67 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ggg n GLY 68 N -0.79 -0.67 3.53 0.00 0.00 -1.26 -4.83 105.19 101.18 1ggg n GLY 68 Ca -0.16 0.31 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 1ggg n GLY 68 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ggg s ILE 69 N -3.51 5.13 0.25 -0.61 1.01 -1.26 -4.98 121.20 117.24 1ggg s ILE 69 Ca 0.21 -0.02 -0.30 0.00 0.00 0.00 0.00 60.65 60.54 1ggg s ILE 69 Cb -0.05 -3.90 -0.10 0.00 0.01 0.00 0.00 42.46 38.43 1ggg s ILE 69 CO 0.79 -0.19 1.36 -0.89 0.00 0.00 0.00 174.94 176.01 1ggg s THR 70 N 2.09 2.86 -0.51 2.92 2.01 -1.26 -0.95 115.64 122.80 1ggg s THR 70 Ca 0.13 0.75 -0.28 0.00 0.31 0.00 0.00 61.69 62.59 1ggg s THR 70 Cb -0.17 -3.48 0.03 0.00 0.01 0.00 0.00 72.50 68.90 1ggg s THR 70 CO 0.12 0.13 1.12 -0.63 -0.69 0.00 0.00 174.62 174.67 1ggg s ILE 71 N -0.26 4.19 0.15 1.82 1.01 -0.82 -4.85 121.20 122.43 1ggg s ILE 71 Ca 0.56 1.02 0.10 0.00 0.00 0.00 0.00 60.65 62.33 1ggg s ILE 71 Cb -0.39 -4.62 -0.04 0.00 0.01 0.00 0.00 42.46 37.42 1ggg s ILE 71 CO 0.44 -1.10 -0.23 0.42 0.00 0.00 0.00 174.94 174.48 1ggg s THR 72 N 4.50 2.06 0.27 2.92 -4.23 -1.26 -4.80 115.64 115.10 1ggg s THR 72 Ca 0.44 -1.83 0.01 0.00 -1.18 0.00 0.00 61.69 59.13 1ggg s THR 72 Cb -0.08 -1.90 0.09 0.00 1.34 0.00 0.00 72.50 71.95 1ggg s THR 72 CO 0.29 -0.10 1.74 0.44 -0.54 0.00 0.00 174.62 176.45 1ggg h ASP 73 N 3.57 0.60 -0.90 3.99 3.32 -1.99 -1.65 116.42 123.36 1ggg h ASP 73 Ca -0.46 -0.18 0.19 0.00 0.02 0.00 0.00 57.03 56.60 1ggg h ASP 73 Cb 1.19 -0.16 -0.07 0.00 0.22 0.00 0.00 39.33 40.51 1ggg h ASP 73 CO 0.45 0.77 0.59 -0.33 -1.72 0.00 0.00 179.24 178.99 1ggg h GLU 74 N 0.56 0.49 0.08 3.56 3.07 -2.00 -2.67 114.58 117.67 1ggg h GLU 74 Ca 0.10 -0.03 -0.29 0.00 -0.50 0.00 0.00 59.36 58.64 1ggg h GLU 74 Cb 0.57 -0.11 -0.02 0.00 -0.84 0.00 0.00 28.75 28.35 1ggg h GLU 74 CO 0.04 0.32 -1.47 0.00 -1.40 0.00 0.00 179.01 176.50 1ggg h ARG 75 N 0.50 0.17 -0.18 2.33 3.08 -1.72 -3.26 114.38 115.30 1ggg h ARG 75 Ca 0.47 -0.29 0.05 0.00 0.07 0.00 0.00 59.98 60.29 1ggg h ARG 75 Cb 1.03 0.11 -0.01 0.00 0.08 0.00 0.00 29.97 31.17 1ggg h ARG 75 CO -0.20 1.00 0.16 0.87 -1.07 0.00 0.00 179.97 180.73 1ggg h LYS 76 N 0.05 0.00 -0.62 0.04 1.57 -0.99 -0.64 116.57 115.97 1ggg h LYS 76 Ca -0.21 0.00 0.08 0.00 -1.87 0.00 0.00 60.65 58.65 1ggg h LYS 76 Cb 1.97 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 34.22 1ggg h LYS 76 CO 0.14 0.00 0.27 0.87 -0.57 0.00 0.00 179.45 180.17 1ggg h LYS 77 N 0.00 0.47 0.07 3.15 1.57 -1.57 -3.32 116.57 116.94 1ggg h LYS 77 Ca 0.09 -0.03 -0.34 0.00 -1.87 0.00 0.00 60.65 58.50 1ggg h LYS 77 Cb 0.41 -0.11 -0.03 0.00 0.08 0.00 0.00 32.23 32.58 1ggg h LYS 77 CO -0.00 0.31 -1.89 0.00 -0.57 0.00 0.00 179.45 177.31 1ggg n ALA 78 N -2.42 0.94 -4.51 3.86 0.00 -0.48 -5.02 120.51 112.88 1ggg n ALA 78 Ca 0.09 -0.65 -0.28 0.00 0.00 0.00 0.00 53.44 52.60 1ggg n ALA 78 Cb 0.24 -0.53 -0.07 0.00 0.00 0.00 0.00 19.45 19.09 1ggg n ALA 78 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 1ggg n ILE 79 N -3.77 0.00 -4.40 0.00 -5.35 -0.37 -4.71 119.36 100.76 1ggg n ILE 79 Ca -0.35 -2.36 -0.26 0.00 -0.27 0.00 0.00 62.75 59.51 1ggg n ILE 79 Cb 0.93 0.79 -0.12 0.00 -1.74 0.00 0.00 39.64 39.51 1ggg n ILE 79 CO 0.00 0.00 0.00 -1.81 -1.76 0.00 0.00 176.55 172.98 1ggg s ASP 80 N -3.53 3.22 0.00 7.28 1.01 -0.56 -4.15 116.67 119.94 1ggg s ASP 80 Ca 0.18 -0.86 0.04 0.00 0.71 0.00 0.00 52.55 52.62 1ggg s ASP 80 Cb 0.01 -0.23 -0.01 0.00 1.01 0.00 0.00 42.92 43.70 1ggg s ASP 80 CO 0.12 0.08 -0.13 -0.36 0.21 0.00 0.00 175.17 175.10 1ggg s PHE 81 N -1.73 1.15 0.70 4.23 0.08 -1.26 -0.80 117.98 120.35 1ggg s PHE 81 Ca 0.19 -0.25 -0.12 0.00 0.12 0.00 0.00 56.93 56.87 1ggg s PHE 81 Cb -0.08 -0.72 0.17 0.00 -0.57 0.00 0.00 43.02 41.82 1ggg s PHE 81 CO 0.09 -0.01 0.79 -1.13 -0.10 0.00 0.00 175.22 174.86 1ggg n SER 82 N 2.52 -0.71 0.00 1.36 3.41 -0.93 -4.90 113.62 114.37 1ggg n SER 82 Ca -0.15 -1.14 0.03 0.00 -0.26 0.00 0.00 58.87 57.35 1ggg n SER 82 Cb 0.55 -0.65 0.19 0.00 -0.26 0.00 0.00 64.21 64.04 1ggg n SER 82 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1ggg n ASP 83 N -3.84 0.00 -0.49 4.04 8.00 -1.26 -4.64 116.55 118.36 1ggg n ASP 83 Ca 0.10 -0.28 0.00 0.00 0.71 0.00 0.00 54.79 55.32 1ggg n ASP 83 Cb 0.38 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.48 1ggg n ASP 83 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ggg n GLY 84 N -0.47 -3.78 0.00 0.44 0.00 -1.26 -4.99 105.19 95.13 1ggg n GLY 84 Ca 0.05 -0.83 0.00 0.00 0.00 0.00 0.00 46.02 45.24 1ggg n GLY 84 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 1ggg n TYR 85 N -0.23 0.00 -3.62 1.61 4.11 -0.10 -4.96 117.16 113.97 1ggg n TYR 85 Ca 0.00 -0.07 -0.05 0.00 -0.00 0.00 0.00 57.90 57.78 1ggg n TYR 85 Cb 0.00 -0.01 -0.07 0.00 -0.00 0.00 0.00 39.34 39.26 1ggg n TYR 85 CO 0.00 0.00 0.00 -0.47 -0.00 0.00 0.00 176.86 176.39 1ggg s TYR 86 N -0.14 -1.04 -0.28 -3.48 5.04 -1.25 -4.96 117.35 111.24 1ggg s TYR 86 Ca 0.00 1.82 -0.24 0.00 -2.44 0.00 0.00 57.07 56.20 1ggg s TYR 86 Cb 0.00 0.50 -0.00 0.00 0.35 0.00 0.00 41.96 42.81 1ggg s TYR 86 CO 0.00 -0.58 0.83 0.21 -1.34 0.00 0.00 175.55 174.67 1ggg s LYS 87 N 2.73 4.07 0.53 4.97 2.20 -1.26 -0.72 119.74 132.26 1ggg s LYS 87 Ca -0.02 0.78 0.02 0.00 -0.36 0.00 0.00 55.97 56.39 1ggg s LYS 87 Cb -0.12 -3.69 0.01 0.00 -1.51 0.00 0.00 37.83 32.51 1ggg s LYS 87 CO -0.16 -0.63 0.11 0.45 -0.36 0.00 0.00 175.35 174.77 1ggg s SER 88 N 1.50 4.28 0.00 1.43 0.15 0.13 -4.94 113.70 116.26 1ggg s SER 88 Ca 0.34 -1.58 0.00 0.00 0.70 0.00 0.00 55.95 55.41 1ggg s SER 88 Cb -0.14 0.60 0.00 0.00 -1.71 0.00 0.00 66.02 64.76 1ggg s SER 88 CO 0.10 -0.97 0.00 0.61 1.20 0.00 0.00 173.24 174.19 1ggg n GLY 89 N -1.43 0.99 3.92 9.45 0.00 -1.26 -0.75 105.19 116.11 1ggg n GLY 89 Ca -0.16 -1.90 -0.27 0.00 0.00 0.00 0.00 46.02 43.69 1ggg n GLY 89 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ggg s LEU 90 N 0.00 4.11 -0.04 0.99 1.02 -0.32 0.12 118.68 124.56 1ggg s LEU 90 Ca 0.00 0.54 -0.03 0.00 0.02 0.00 0.00 54.13 54.66 1ggg s LEU 90 Cb 0.00 -3.35 0.02 0.00 0.02 0.00 0.00 46.19 42.87 1ggg s LEU 90 CO 0.00 -0.16 0.11 -0.76 0.02 0.00 0.00 176.35 175.56 1ggg s LEU 91 N -3.63 1.39 0.02 1.79 1.43 0.13 -1.79 118.68 118.02 1ggg s LEU 91 Ca 0.41 0.22 -0.25 0.00 -1.03 0.00 0.00 54.13 53.49 1ggg s LEU 91 Cb -0.11 0.34 -0.05 0.00 0.03 0.00 0.00 46.19 46.41 1ggg s LEU 91 CO 0.31 -0.06 0.76 -0.69 0.23 0.00 0.00 176.35 176.89 1ggg s VAL 92 N 0.34 4.81 -0.15 -1.59 1.01 -1.25 -2.89 120.40 120.68 1ggg s VAL 92 Ca -0.02 1.61 0.02 0.00 0.00 0.00 0.00 61.98 63.58 1ggg s VAL 92 Cb -0.04 -4.11 0.02 0.00 0.00 0.00 0.00 36.38 32.25 1ggg s VAL 92 CO -0.01 0.33 -0.20 -0.32 0.00 0.00 0.00 175.10 174.90 1ggg s MET 93 N 0.19 2.85 0.46 2.72 1.75 -0.50 -2.41 119.30 124.35 1ggg s MET 93 Ca 0.39 -0.78 0.04 0.00 -1.25 0.00 0.00 55.69 54.09 1ggg s MET 93 Cb -0.20 -2.40 -0.04 0.00 2.84 0.00 0.00 34.83 35.03 1ggg s MET 93 CO 0.22 -0.13 0.02 0.14 -0.65 0.00 0.00 175.02 174.63 1ggg s VAL 94 N 1.11 1.62 0.83 10.11 -7.23 -0.83 -1.64 120.40 124.37 1ggg s VAL 94 Ca -0.01 -1.97 -0.13 0.00 -1.81 0.00 0.00 61.98 58.07 1ggg s VAL 94 Cb -0.14 -2.59 0.09 0.00 0.56 0.00 0.00 36.38 34.30 1ggg s VAL 94 CO -0.08 0.00 1.19 -0.75 -0.31 0.00 0.00 175.10 175.16 1ggg s LYS 95 N -3.81 1.53 0.04 4.82 2.47 -1.26 -2.24 119.74 121.30 1ggg s LYS 95 Ca 0.22 1.70 -0.31 0.00 -1.56 0.00 0.00 55.97 56.02 1ggg s LYS 95 Cb 0.06 -1.77 -0.18 0.00 -1.46 0.00 0.00 37.83 34.48 1ggg s LYS 95 CO 0.11 -2.28 1.41 0.00 0.16 0.00 0.00 175.35 174.75 1ggg h ALA 96 N -1.09 -0.95 -0.95 3.13 0.00 -1.05 -3.37 119.26 114.98 1ggg h ALA 96 Ca -0.46 -0.22 -0.60 0.00 0.00 0.00 0.00 54.91 53.64 1ggg h ALA 96 Cb 1.29 0.37 -0.09 0.00 0.00 0.00 0.00 17.79 19.36 1ggg h ALA 96 CO 0.45 -0.96 1.71 0.54 0.00 0.00 0.00 179.25 180.99 1ggg s ASN 97 N -4.43 6.47 -0.15 0.00 4.22 -1.26 -4.78 114.94 115.01 1ggg s ASN 97 Ca -0.17 -1.81 -0.30 0.00 -2.14 0.00 0.00 52.86 48.44 1ggg s ASN 97 Cb 0.02 -2.57 0.13 0.00 1.28 0.00 0.00 41.25 40.11 1ggg s ASN 97 CO 0.55 -1.54 1.03 0.21 -2.04 0.00 0.00 177.10 175.31 1ggg s ASN 98 N 4.95 -0.33 -0.44 3.54 3.84 -1.26 -5.08 114.94 120.16 1ggg s ASN 98 Ca 0.52 0.29 0.09 0.00 0.21 0.00 0.00 52.86 53.97 1ggg s ASN 98 Cb 0.01 0.28 0.30 0.00 -0.55 0.00 0.00 41.25 41.29 1ggg s ASN 98 CO -0.01 -0.35 0.68 0.59 -2.79 0.00 0.00 177.10 175.23 1ggg n ASN 99 N 0.53 1.44 -4.92 -4.21 3.02 -1.26 -5.02 115.26 104.84 1ggg n ASN 99 Ca -0.08 -3.04 -0.20 0.00 -0.03 0.00 0.00 54.58 51.23 1ggg n ASN 99 Cb 0.59 -0.63 -0.02 0.00 -0.61 0.00 0.00 39.78 39.11 1ggg n ASN 99 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1ggg s ASP 100 N -2.11 5.42 0.00 6.41 -1.08 -1.26 -5.14 116.67 118.91 1ggg s ASP 100 Ca 0.39 -0.50 0.00 0.00 -0.52 0.00 0.00 52.55 51.92 1ggg s ASP 100 Cb 0.25 -0.81 0.00 0.00 -1.46 0.00 0.00 42.92 40.89 1ggg s ASP 100 CO -0.09 -0.56 0.00 0.55 0.52 0.00 0.00 175.17 175.59 1ggg n VAL 101 N -1.59 0.00 -2.97 1.11 3.14 -1.26 -5.03 118.33 111.72 1ggg n VAL 101 Ca 0.03 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.41 1ggg n VAL 101 Cb 0.60 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.38 1ggg n VAL 101 CO 0.00 0.00 0.00 1.17 -6.46 0.00 0.00 176.83 171.54 1ggg n LYS 102 N 0.00 0.00 -1.08 1.45 0.00 -1.26 -4.40 118.16 112.87 1ggg n LYS 102 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 58.31 58.04 1ggg n LYS 102 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 35.03 34.97 1ggg n LYS 102 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.40 177.83 1ggg n SER 103 N -0.59 6.84 -2.77 3.14 7.64 -1.26 -4.54 113.62 122.08 1ggg n SER 103 Ca 0.00 -2.46 -0.38 0.00 1.01 0.00 0.00 58.87 57.04 1ggg n SER 103 Cb 0.00 -1.38 0.04 0.00 -1.01 0.00 0.00 64.21 61.86 1ggg n SER 103 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 1ggg n VAL 104 N 3.39 3.49 -1.58 0.44 0.24 -1.26 -4.73 118.33 118.32 1ggg n VAL 104 Ca 0.60 -4.12 -0.33 0.00 -2.04 0.00 0.00 64.34 58.45 1ggg n VAL 104 Cb 0.39 -1.23 0.02 0.00 -1.47 0.00 0.00 33.84 31.55 1ggg n VAL 104 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 1ggg n LYS 105 N -0.60 2.55 -0.88 7.34 5.02 -1.26 -4.80 118.16 125.52 1ggg n LYS 105 Ca 0.54 -2.96 0.00 0.00 -2.02 0.00 0.00 58.31 53.87 1ggg n LYS 105 Cb 0.35 -2.17 0.00 0.00 -0.02 0.00 0.00 35.03 33.19 1ggg n LYS 105 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1ggg n ASP 106 N -0.15 1.20 0.00 4.39 -0.08 -1.26 -4.47 116.55 116.18 1ggg n ASP 106 Ca 0.52 -0.44 0.00 0.00 -1.51 0.00 0.00 54.79 53.36 1ggg n ASP 106 Cb 0.44 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.90 1ggg n ASP 106 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 1ggg n LEU 107 N 0.00 0.00 0.00 -2.67 4.32 -1.18 -0.87 117.00 116.61 1ggg n LEU 107 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.99 1ggg n LEU 107 Cb 0.00 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.80 1ggg n LEU 107 CO 0.00 0.00 -0.29 0.47 -1.22 0.00 0.00 177.39 176.35 1ggg n ASP 108 N 0.00 2.89 0.00 -1.43 8.00 -1.26 -5.00 116.55 119.75 1ggg n ASP 108 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 1ggg n ASP 108 Cb 0.00 0.38 0.00 0.00 -0.02 0.00 0.00 41.12 41.48 1ggg n ASP 108 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ggg n GLY 109 N 1.79 -2.71 2.57 0.44 0.00 -0.05 -4.97 105.19 102.26 1ggg n GLY 109 Ca 0.00 -0.71 -0.05 0.00 0.00 0.00 0.00 46.02 45.26 1ggg n GLY 109 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1ggg n LYS 110 N 0.00 -4.27 -3.89 1.61 -0.00 -1.26 -4.62 118.16 105.73 1ggg n LYS 110 Ca 0.00 3.26 -0.27 0.00 -0.00 0.00 0.00 58.31 61.30 1ggg n LYS 110 Cb 0.00 -5.00 -0.17 0.00 -0.00 0.00 0.00 35.03 29.86 1ggg n LYS 110 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 1ggg s VAL 111 N -0.82 1.02 -0.18 0.58 1.01 -1.26 -2.28 120.40 118.47 1ggg s VAL 111 Ca -0.23 -0.37 -0.01 0.00 0.00 0.00 0.00 61.98 61.36 1ggg s VAL 111 Cb 0.02 -1.09 -0.00 0.00 0.00 0.00 0.00 36.38 35.30 1ggg s VAL 111 CO 0.77 0.29 -0.11 -0.69 0.00 0.00 0.00 175.10 175.36 1ggg s VAL 112 N 1.70 2.95 0.18 2.92 1.01 -0.90 -0.47 120.40 127.79 1ggg s VAL 112 Ca 0.04 -0.66 -0.09 0.00 0.00 0.00 0.00 61.98 61.27 1ggg s VAL 112 Cb -0.13 -2.29 -0.07 0.00 0.00 0.00 0.00 36.38 33.90 1ggg s VAL 112 CO -0.08 0.48 0.48 0.00 0.00 0.00 0.00 175.10 175.99 1ggg s ALA 113 N 1.04 3.65 -0.14 5.51 0.00 -0.80 0.05 121.76 131.06 1ggg s ALA 113 Ca -0.01 -0.36 -0.31 0.00 0.00 0.00 0.00 51.96 51.29 1ggg s ALA 113 Cb -0.15 -2.33 0.13 0.00 0.00 0.00 0.00 23.12 20.77 1ggg s ALA 113 CO -0.02 0.56 1.05 0.54 0.00 0.00 0.00 175.76 177.89 1ggg s VAL 114 N -1.70 0.00 0.19 0.00 0.11 -0.92 -2.70 120.40 115.38 1ggg s VAL 114 Ca 0.43 0.00 -0.09 0.00 -2.93 0.00 0.00 61.98 59.40 1ggg s VAL 114 Cb -0.12 -1.00 -0.07 0.00 -1.53 0.00 0.00 36.38 33.66 1ggg s VAL 114 CO 0.22 0.00 0.49 -0.75 -3.33 0.00 0.00 175.10 171.73 1ggg s LYS 115 N -1.79 3.76 0.14 1.54 2.20 -1.26 -2.09 119.74 122.24 1ggg s LYS 115 Ca 0.03 0.18 -0.31 0.00 -0.36 0.00 0.00 55.97 55.51 1ggg s LYS 115 Cb -0.01 -2.74 -0.10 0.00 -1.51 0.00 0.00 37.83 33.47 1ggg s LYS 115 CO -0.03 0.38 1.73 -1.12 -0.36 0.00 0.00 175.35 175.95 1ggg s SER 116 N -2.31 6.47 -0.07 1.43 0.01 0.20 -4.29 113.70 115.14 1ggg s SER 116 Ca 0.44 2.72 -0.01 0.00 1.31 0.00 0.00 55.95 60.41 1ggg s SER 116 Cb -0.12 -2.58 0.00 0.00 0.21 0.00 0.00 66.02 63.53 1ggg s SER 116 CO 0.22 -0.95 0.08 0.61 0.41 0.00 0.00 173.24 173.61 1ggg n GLY 117 N 4.05 -0.60 3.60 3.44 0.00 -1.26 -4.99 105.19 109.43 1ggg n GLY 117 Ca 0.16 -0.03 -0.06 0.00 0.00 0.00 0.00 46.02 46.09 1ggg n GLY 117 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ggg s THR 118 N -2.06 0.00 0.49 2.61 2.01 -1.26 -5.05 115.64 112.38 1ggg s THR 118 Ca 0.02 0.00 0.21 0.00 0.31 0.00 0.00 61.69 62.23 1ggg s THR 118 Cb -0.00 -1.00 0.38 0.00 0.01 0.00 0.00 72.50 71.88 1ggg s THR 118 CO 0.09 0.00 1.97 1.23 -0.69 0.00 0.00 174.62 177.22 1ggg h GLY 119 N 2.26 0.26 1.63 4.40 0.00 -1.98 -2.48 103.07 107.17 1ggg h GLY 119 Ca -0.13 -0.07 -0.17 0.00 0.00 0.00 0.00 47.33 46.95 1ggg h GLY 119 CO 0.27 0.03 -0.70 1.48 0.00 0.00 0.00 176.54 177.62 1ggg h SER 120 N 0.16 0.43 -0.36 0.19 4.64 -1.91 -0.40 113.55 116.30 1ggg h SER 120 Ca 0.29 -0.27 0.06 0.00 -0.47 0.00 0.00 61.79 61.39 1ggg h SER 120 Cb 0.93 -0.13 -0.08 0.00 -0.31 0.00 0.00 62.40 62.81 1ggg h SER 120 CO -0.04 1.00 -0.49 0.58 -0.87 0.00 0.00 176.83 177.00 1ggg h VAL 121 N 0.25 0.06 0.00 0.95 2.07 -1.70 -0.10 116.25 117.77 1ggg h VAL 121 Ca -0.02 0.00 -0.13 0.00 0.82 0.00 0.00 66.70 67.37 1ggg h VAL 121 Cb 1.26 0.06 -0.02 0.00 -1.52 0.00 0.00 31.29 31.07 1ggg h VAL 121 CO 0.12 0.00 -0.62 0.44 0.02 0.00 0.00 177.57 177.53 1ggg h ASP 122 N -0.40 0.00 0.04 0.57 5.19 -1.52 -1.13 116.42 119.18 1ggg h ASP 122 Ca 0.10 0.00 -0.28 0.00 -0.62 0.00 0.00 57.03 56.23 1ggg h ASP 122 Cb 0.61 0.00 0.02 0.00 0.18 0.00 0.00 39.33 40.14 1ggg h ASP 122 CO -0.56 0.62 -1.10 0.22 -3.12 0.00 0.00 179.24 175.30 1ggg h TYR 123 N 0.00 1.04 0.14 4.55 5.03 -0.82 -2.91 116.97 123.99 1ggg h TYR 123 Ca -0.01 -0.59 -0.01 0.00 2.58 0.00 0.00 58.73 60.71 1ggg h TYR 123 Cb 1.23 -0.11 0.00 0.00 1.55 0.00 0.00 36.73 39.41 1ggg h TYR 123 CO 0.00 1.43 -0.07 0.00 -1.32 0.00 0.00 178.16 178.20 1ggg h ALA 124 N 0.36 -0.19 -0.68 1.82 0.00 -0.89 -0.17 119.26 119.52 1ggg h ALA 124 Ca -0.15 -0.20 0.07 0.00 0.00 0.00 0.00 54.91 54.63 1ggg h ALA 124 Cb 1.76 0.07 -0.10 0.00 0.00 0.00 0.00 17.79 19.53 1ggg h ALA 124 CO 0.21 -0.40 -0.57 0.87 0.00 0.00 0.00 179.25 179.36 1ggg h LYS 125 N -0.59 -0.20 -0.26 0.00 1.57 -1.30 0.24 116.57 116.04 1ggg h LYS 125 Ca -0.02 0.01 -0.13 0.00 -1.87 0.00 0.00 60.65 58.65 1ggg h LYS 125 Cb 0.45 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.80 1ggg h LYS 125 CO 0.03 -0.13 -0.36 0.00 -0.57 0.00 0.00 179.45 178.42 1ggg h ALA 126 N 0.20 0.87 -3.00 3.86 0.00 -1.52 -3.41 119.26 116.26 1ggg h ALA 126 Ca 0.11 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1ggg h ALA 126 Cb 0.50 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1ggg h ALA 126 CO -0.75 0.63 0.00 0.09 0.00 0.00 0.00 179.25 179.22 1ggg n ASN 127 N -4.05 0.00 -4.73 0.00 3.02 0.55 -4.95 115.26 105.10 1ggg n ASN 127 Ca -0.01 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.12 1ggg n ASN 127 Cb 0.49 0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.64 1ggg n ASN 127 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 1ggg n ILE 128 N -1.42 0.29 -3.56 2.41 2.08 0.54 -4.93 119.36 114.77 1ggg n ILE 128 Ca 0.00 -0.07 -0.41 0.00 0.56 0.00 0.00 62.75 62.83 1ggg n ILE 128 Cb 0.00 -2.00 -0.09 0.00 -0.75 0.00 0.00 39.64 36.80 1ggg n ILE 128 CO 0.00 0.00 0.00 -0.54 0.56 0.00 0.00 176.55 176.57 1ggg s LYS 129 N 0.70 2.50 0.37 0.38 3.01 -1.26 -4.52 119.74 120.92 1ggg s LYS 129 Ca 0.72 -1.71 0.03 0.00 -1.01 0.00 0.00 55.97 54.00 1ggg s LYS 129 Cb -0.50 -3.90 -0.04 0.00 -1.01 0.00 0.00 37.83 32.38 1ggg s LYS 129 CO 0.37 -1.15 0.09 -0.08 0.51 0.00 0.00 175.35 175.08 1ggg s THR 130 N 1.37 0.89 0.09 2.17 -1.32 -1.26 -3.07 115.64 114.50 1ggg s THR 130 Ca 0.05 -2.00 -0.32 0.00 -1.21 0.00 0.00 61.69 58.21 1ggg s THR 130 Cb -0.26 -2.56 -0.15 0.00 -1.51 0.00 0.00 72.50 68.03 1ggg s THR 130 CO -0.00 0.00 1.61 0.11 -2.21 0.00 0.00 174.62 174.13 1ggg h LYS 131 N 1.95 -0.77 -4.42 7.08 1.57 -1.71 -3.45 116.57 116.81 1ggg h LYS 131 Ca -0.38 0.05 -0.31 0.00 -1.87 0.00 0.00 60.65 58.14 1ggg h LYS 131 Cb 1.26 0.18 -0.26 0.00 0.08 0.00 0.00 32.23 33.49 1ggg h LYS 131 CO 0.64 -0.52 -0.75 -0.51 -0.57 0.00 0.00 179.45 177.74 1ggg s ASP 132 N -4.52 0.73 -0.43 0.86 1.01 -1.25 -5.07 116.67 107.99 1ggg s ASP 132 Ca -0.17 -0.24 0.03 0.00 0.71 0.00 0.00 52.55 52.88 1ggg s ASP 132 Cb 0.05 -0.04 0.12 0.00 1.01 0.00 0.00 42.92 44.06 1ggg s ASP 132 CO 0.63 -0.02 0.16 -0.76 0.21 0.00 0.00 175.17 175.39 1ggg s LEU 133 N -0.59 4.65 -0.16 1.23 1.43 -1.26 -2.11 118.68 121.87 1ggg s LEU 133 Ca -0.02 -2.52 -0.25 0.00 -1.03 0.00 0.00 54.13 50.31 1ggg s LEU 133 Cb -0.05 -1.66 -0.02 0.00 0.03 0.00 0.00 46.19 44.50 1ggg s LEU 133 CO 0.00 -0.33 0.83 -0.13 0.23 0.00 0.00 176.35 176.94 1ggg s ARG 134 N 0.40 4.31 0.12 1.70 1.81 0.11 -4.99 118.95 122.41 1ggg s ARG 134 Ca 0.13 1.02 0.08 0.00 -1.72 0.00 0.00 55.73 55.24 1ggg s ARG 134 Cb -0.22 -3.56 -0.04 0.00 -0.45 0.00 0.00 34.95 30.68 1ggg s ARG 134 CO -0.04 -0.30 -0.13 -0.65 -0.68 0.00 0.00 175.30 173.50 1ggg s GLN 135 N 2.03 1.99 0.01 3.54 -0.21 -1.26 -2.17 119.66 123.60 1ggg s GLN 135 Ca 0.38 -1.13 0.00 0.00 0.02 0.00 0.00 55.36 54.64 1ggg s GLN 135 Cb -0.17 -2.21 -0.01 0.00 1.00 0.00 0.00 33.01 31.62 1ggg s GLN 135 CO 0.13 0.48 -0.02 -0.06 -2.12 0.00 0.00 175.29 173.71 1ggg s PHE 136 N -1.29 0.15 0.27 0.91 0.08 -0.89 -4.86 117.98 112.35 1ggg s PHE 136 Ca 0.21 -0.28 -0.02 0.00 0.12 0.00 0.00 56.93 56.96 1ggg s PHE 136 Cb -0.10 -0.11 0.61 0.00 -0.57 0.00 0.00 43.02 42.85 1ggg s PHE 136 CO 0.13 -0.10 1.63 -1.35 -0.10 0.00 0.00 175.22 175.42 1ggg h PRO 137 N 5.35 0.12 -4.31 0.24 0.11 -1.94 0.59 132.00 132.16 1ggg h PRO 137 Ca -0.28 -0.01 -0.16 0.00 0.11 0.00 0.00 66.00 65.66 1ggg h PRO 137 Cb 1.21 -0.03 -0.16 0.00 0.11 0.00 0.00 31.00 32.13 1ggg h PRO 137 CO 0.46 0.08 -0.69 0.54 -0.21 0.00 0.00 178.00 178.18 1ggg s ASN 138 N -5.11 0.62 0.37 -2.05 4.22 -1.26 -4.58 114.94 107.15 1ggg s ASN 138 Ca -0.13 -0.91 0.16 0.00 -2.14 0.00 0.00 52.86 49.84 1ggg s ASN 138 Cb 0.25 0.16 0.72 0.00 1.28 0.00 0.00 41.25 43.65 1ggg s ASN 138 CO 0.77 -0.51 1.77 0.16 -2.04 0.00 0.00 177.10 177.25 1ggg h ILE 139 N 3.37 1.06 -0.62 0.54 -0.00 -1.92 -1.34 117.51 118.61 1ggg h ILE 139 Ca -0.34 -1.46 0.18 0.00 -0.00 0.00 0.00 64.86 63.24 1ggg h ILE 139 Cb 1.16 1.84 -0.02 0.00 -0.00 0.00 0.00 36.82 39.79 1ggg h ILE 139 CO 0.61 0.38 0.51 -0.78 -0.00 0.00 0.00 178.15 178.87 1ggg h ASP 140 N 0.00 0.00 0.93 2.16 3.58 -1.98 0.80 116.42 121.91 1ggg h ASP 140 Ca -0.00 0.00 -0.07 0.00 0.42 0.00 0.00 57.03 57.37 1ggg h ASP 140 Cb 0.80 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.84 1ggg h ASP 140 CO 0.05 0.00 -0.35 0.78 -2.88 0.00 0.00 179.24 176.84 1ggg h ASN 141 N 0.00 0.00 0.33 2.28 2.35 -1.65 -2.11 115.58 116.78 1ggg h ASN 141 Ca 0.29 0.00 -0.33 0.00 -0.55 0.00 0.00 56.30 55.71 1ggg h ASN 141 Cb 1.30 0.00 0.01 0.00 0.05 0.00 0.00 38.32 39.68 1ggg h ASN 141 CO -0.00 0.35 -1.60 0.00 -1.65 0.00 0.00 177.43 174.53 1ggg h ALA 142 N 1.65 0.15 -0.43 -0.83 0.00 0.36 -1.38 119.26 118.78 1ggg h ALA 142 Ca -0.00 -1.07 0.04 0.00 0.00 0.00 0.00 54.91 53.88 1ggg h ALA 142 Cb 0.90 0.32 -0.04 0.00 0.00 0.00 0.00 17.79 18.97 1ggg h ALA 142 CO 0.05 1.01 0.19 1.88 0.00 0.00 0.00 179.25 182.38 1ggg h TYR 143 N 0.10 0.35 -0.46 0.00 0.05 -0.48 -1.77 116.97 114.75 1ggg h TYR 143 Ca -0.28 0.02 -0.03 0.00 0.05 0.00 0.00 58.73 58.49 1ggg h TYR 143 Cb 2.07 -0.09 -0.02 0.00 1.01 0.00 0.00 36.73 39.70 1ggg h TYR 143 CO 0.09 0.16 0.18 0.52 -1.05 0.00 0.00 178.16 178.06 1ggg h MET 144 N 0.39 0.69 -0.55 4.88 2.86 -1.39 -2.47 114.93 119.34 1ggg h MET 144 Ca 0.19 -0.13 0.03 0.00 -2.06 0.00 0.00 59.70 57.73 1ggg h MET 144 Cb 0.13 -0.11 -0.03 0.00 0.06 0.00 0.00 31.60 31.65 1ggg h MET 144 CO -0.16 0.64 0.37 1.49 1.06 0.00 0.00 176.91 180.31 1ggg h GLU 145 N 0.61 0.62 0.00 1.72 4.57 -1.13 -2.78 114.58 118.18 1ggg h GLU 145 Ca 0.15 -0.04 -0.09 0.00 -1.18 0.00 0.00 59.36 58.21 1ggg h GLU 145 Cb 0.20 -0.14 -0.01 0.00 -0.16 0.00 0.00 28.75 28.64 1ggg h GLU 145 CO -0.01 0.41 -0.41 1.25 -1.18 0.00 0.00 179.01 179.07 1ggg h LEU 146 N 0.64 0.00 -2.01 1.64 5.85 -1.08 -2.95 115.31 117.41 1ggg h LEU 146 Ca 0.22 0.00 0.17 0.00 0.84 0.00 0.00 57.88 59.11 1ggg h LEU 146 Cb 0.09 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.09 1ggg h LEU 146 CO -0.06 0.41 0.43 1.23 -0.34 0.00 0.00 178.44 180.11 1ggg h GLY 147 N 3.53 0.00 -0.44 3.75 0.00 -1.15 -2.95 103.07 105.81 1ggg h GLY 147 Ca -0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 1ggg h GLY 147 CO 0.05 0.00 -0.20 -1.30 0.00 0.00 0.00 176.54 175.09 1ggg n THR 148 N -4.25 1.39 -3.88 4.70 -2.24 -1.24 -4.99 114.28 103.77 1ggg n THR 148 Ca 0.11 -1.76 -0.33 0.00 -2.27 0.00 0.00 64.05 59.81 1ggg n THR 148 Cb 0.67 -0.02 0.01 0.00 -2.10 0.00 0.00 70.33 68.89 1ggg n THR 148 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1ggg n ASN 149 N -0.99 -4.67 -0.01 3.42 3.02 -1.12 -4.85 115.26 110.06 1ggg n ASN 149 Ca 0.12 -1.08 0.00 0.00 -0.03 0.00 0.00 54.58 53.59 1ggg n ASN 149 Cb 0.68 -1.81 -0.04 0.00 -0.61 0.00 0.00 39.78 38.00 1ggg n ASN 149 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1ggg n ARG 150 N -3.57 1.73 -4.74 3.52 3.00 -1.17 -4.93 116.66 110.49 1ggg n ARG 150 Ca -0.23 -0.03 -0.29 0.00 -0.01 0.00 0.00 57.85 57.30 1ggg n ARG 150 Cb 0.64 -1.13 -0.14 0.00 0.00 0.00 0.00 32.46 31.83 1ggg n ARG 150 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1ggg s ALA 151 N -2.24 2.20 0.06 7.54 0.00 -1.12 -4.92 121.76 123.28 1ggg s ALA 151 Ca -0.02 -1.29 -0.15 0.00 0.00 0.00 0.00 51.96 50.50 1ggg s ALA 151 Cb 0.02 -0.43 -0.25 0.00 0.00 0.00 0.00 23.12 22.47 1ggg s ALA 151 CO 0.21 0.51 1.16 -0.44 0.00 0.00 0.00 175.76 177.21 1ggg h ASP 152 N 4.58 0.87 -5.20 0.00 3.32 -1.14 -3.43 116.42 115.43 1ggg h ASP 152 Ca -0.47 -0.76 0.13 0.00 0.02 0.00 0.00 57.03 55.95 1ggg h ASP 152 Cb 1.15 -0.27 -0.07 0.00 0.22 0.00 0.00 39.33 40.37 1ggg h ASP 152 CO 0.42 1.52 0.38 0.00 -1.72 0.00 0.00 179.24 179.85 1ggg s ALA 153 N -3.24 -1.46 0.05 3.45 0.00 -1.10 -4.49 121.76 114.97 1ggg s ALA 153 Ca -0.10 -0.08 0.09 0.00 0.00 0.00 0.00 51.96 51.87 1ggg s ALA 153 Cb 0.06 0.72 -0.03 0.00 0.00 0.00 0.00 23.12 23.88 1ggg s ALA 153 CO 0.91 -1.04 -0.26 0.08 0.00 0.00 0.00 175.76 175.46 1ggg s VAL 154 N -3.48 2.08 -0.18 0.00 1.01 -0.65 -1.90 120.40 117.28 1ggg s VAL 154 Ca 0.12 -1.39 -0.03 0.00 0.00 0.00 0.00 61.98 60.69 1ggg s VAL 154 Cb -0.03 -1.78 -0.01 0.00 0.00 0.00 0.00 36.38 34.55 1ggg s VAL 154 CO 0.04 0.32 -0.07 -0.76 0.00 0.00 0.00 175.10 174.64 1ggg s LEU 155 N -1.29 2.93 0.25 3.92 1.43 -1.10 -1.41 118.68 123.41 1ggg s LEU 155 Ca 0.11 -0.31 -0.20 0.00 -1.03 0.00 0.00 54.13 52.70 1ggg s LEU 155 Cb -0.10 -1.71 0.07 0.00 0.03 0.00 0.00 46.19 44.48 1ggg s LEU 155 CO 0.02 0.08 0.95 -2.28 0.23 0.00 0.00 176.35 175.35 1ggg s HIS 156 N 0.88 0.07 0.58 0.29 2.46 -1.14 -4.64 115.29 113.79 1ggg s HIS 156 Ca -0.02 -0.56 -0.15 0.00 0.47 0.00 0.00 55.06 54.80 1ggg s HIS 156 Cb -0.15 0.74 -0.05 0.00 -0.13 0.00 0.00 32.58 33.00 1ggg s HIS 156 CO 0.01 -1.13 1.03 0.16 -2.47 0.00 0.00 174.74 172.34 1ggg s ASP 157 N -3.27 6.04 0.16 9.88 1.47 -1.26 0.22 116.67 129.91 1ggg s ASP 157 Ca 0.19 1.71 -0.17 0.00 1.18 0.00 0.00 52.55 55.46 1ggg s ASP 157 Cb -0.03 -2.52 0.07 0.00 -0.34 0.00 0.00 42.92 40.09 1ggg s ASP 157 CO 0.07 -0.99 1.71 0.74 0.68 0.00 0.00 175.17 177.38 1ggg h THR 158 N 0.49 0.75 -0.14 2.11 2.02 0.58 -2.33 112.91 116.39 1ggg h THR 158 Ca -0.47 -0.04 -0.18 0.00 0.77 0.00 0.00 66.41 66.50 1ggg h THR 158 Cb 1.21 0.64 -0.00 0.00 -1.74 0.00 0.00 68.15 68.25 1ggg h THR 158 CO 0.59 0.02 -0.64 1.55 0.37 0.00 0.00 175.52 177.41 1ggg h PRO 159 N 0.10 0.52 -0.32 6.66 0.13 -1.93 -1.02 132.00 136.14 1ggg h PRO 159 Ca 0.17 -0.37 -0.08 0.00 -0.87 0.00 0.00 66.00 64.84 1ggg h PRO 159 Cb 0.22 0.06 -0.02 0.00 0.13 0.00 0.00 31.00 31.40 1ggg h PRO 159 CO -0.27 0.99 -0.15 -0.91 -0.23 0.00 0.00 178.00 177.43 1ggg h ASN 160 N 0.38 0.56 0.30 1.44 -0.26 -1.87 -0.34 115.58 115.79 1ggg h ASN 160 Ca -0.01 -0.16 -0.01 0.00 -0.56 0.00 0.00 56.30 55.55 1ggg h ASN 160 Cb 1.20 -0.15 0.00 0.00 -1.06 0.00 0.00 38.32 38.32 1ggg h ASN 160 CO 0.12 0.73 -0.14 0.40 -1.06 0.00 0.00 177.43 177.47 1ggg h ILE 161 N 0.52 0.73 -0.41 2.81 1.08 -1.22 -2.31 117.51 118.71 1ggg h ILE 161 Ca 0.09 -0.53 0.01 0.00 -0.39 0.00 0.00 64.86 64.04 1ggg h ILE 161 Cb 0.56 1.01 -0.02 0.00 -3.07 0.00 0.00 36.82 35.29 1ggg h ILE 161 CO 0.04 0.11 0.27 -0.07 -0.69 0.00 0.00 178.15 177.80 1ggg h LEU 162 N -0.69 0.46 -0.52 1.44 -0.00 -1.13 -1.55 115.31 113.31 1ggg h LEU 162 Ca -0.04 -0.01 -0.15 0.00 -0.00 0.00 0.00 57.88 57.68 1ggg h LEU 162 Cb 0.48 -0.11 -0.01 0.00 -0.00 0.00 0.00 40.66 41.02 1ggg h LEU 162 CO 0.07 0.33 -0.38 0.22 -0.00 0.00 0.00 178.44 178.68 1ggg h TYR 163 N 0.54 0.94 -0.69 1.13 3.20 -1.13 -2.43 116.97 118.53 1ggg h TYR 163 Ca 0.15 -0.27 -0.07 0.00 3.14 0.00 0.00 58.73 61.68 1ggg h TYR 163 Cb -0.05 -0.20 -0.03 0.00 1.54 0.00 0.00 36.73 37.99 1ggg h TYR 163 CO -0.05 1.04 0.16 0.35 -1.64 0.00 0.00 178.16 178.02 1ggg h PHE 164 N 0.65 1.17 0.00 -3.82 3.57 -1.04 -1.21 116.94 116.25 1ggg h PHE 164 Ca 0.06 -0.14 -0.01 0.00 3.53 0.00 0.00 57.97 61.40 1ggg h PHE 164 Cb 0.94 -0.33 -0.00 0.00 2.79 0.00 0.00 35.95 39.35 1ggg h PHE 164 CO 0.05 0.96 -0.06 0.82 -2.23 0.00 0.00 178.31 177.85 1ggg h ILE 165 N 1.04 0.98 0.00 1.41 2.04 -1.09 0.42 117.51 122.31 1ggg h ILE 165 Ca 0.21 -0.21 -0.16 0.00 1.00 0.00 0.00 64.86 65.70 1ggg h ILE 165 Cb 0.39 1.12 -0.03 0.00 -0.74 0.00 0.00 36.82 37.55 1ggg h ILE 165 CO 0.00 0.06 -1.01 0.50 0.00 0.00 0.00 178.15 177.70 1ggg h LYS 166 N 0.00 0.00 0.00 2.37 3.64 -0.77 -3.32 116.57 118.50 1ggg h LYS 166 Ca -0.00 0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 59.31 1ggg h LYS 166 Cb 0.11 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.92 1ggg h LYS 166 CO 0.01 0.52 -0.87 0.25 -2.27 0.00 0.00 179.45 177.09 1ggg n THR 167 N -3.12 1.20 -0.03 1.00 -2.24 -0.66 -4.87 114.28 105.56 1ggg n THR 167 Ca -0.04 0.14 0.01 0.00 -2.27 0.00 0.00 64.05 61.89 1ggg n THR 167 Cb 0.84 -1.89 -0.08 0.00 -2.10 0.00 0.00 70.33 67.09 1ggg n THR 167 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ggg n ALA 168 N -3.88 2.10 0.52 6.98 0.00 -0.64 -4.43 120.51 121.16 1ggg n ALA 168 Ca -0.13 -0.44 -0.01 0.00 0.00 0.00 0.00 53.44 52.87 1ggg n ALA 168 Cb 0.39 -0.18 0.08 0.00 0.00 0.00 0.00 19.45 19.74 1ggg n ALA 168 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ggg n GLY 169 N 2.12 2.09 3.45 0.00 0.00 0.14 -4.95 105.19 108.04 1ggg n GLY 169 Ca -0.08 -0.24 -0.55 0.00 0.00 0.00 0.00 46.02 45.16 1ggg n GLY 169 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1ggg n ASN 170 N 0.14 1.84 0.00 1.61 0.23 -1.25 -2.30 115.26 115.53 1ggg n ASN 170 Ca 0.09 0.62 0.00 0.00 -0.53 0.00 0.00 54.58 54.76 1ggg n ASN 170 Cb 0.57 -1.15 0.00 0.00 -2.08 0.00 0.00 39.78 37.13 1ggg n ASN 170 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1ggg n GLY 171 N 6.28 2.03 0.42 4.83 0.00 -1.26 -4.69 105.19 112.79 1ggg n GLY 171 Ca 0.41 -0.24 0.24 0.00 0.00 0.00 0.00 46.02 46.43 1ggg n GLY 171 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 1ggg h GLN 172 N 0.00 0.00 -6.21 1.61 3.07 -1.91 -3.42 115.11 108.25 1ggg h GLN 172 Ca 0.00 0.00 -0.53 0.00 0.09 0.00 0.00 58.65 58.21 1ggg h GLN 172 Cb 0.00 0.00 -0.07 0.00 0.08 0.00 0.00 27.48 27.49 1ggg h GLN 172 CO 0.00 0.00 -0.58 -0.06 0.09 0.00 0.00 178.83 178.28 1ggg s PHE 173 N -4.87 2.94 0.21 0.06 0.08 -0.97 -0.51 117.98 114.92 1ggg s PHE 173 Ca -0.05 -0.15 -0.21 0.00 0.12 0.00 0.00 56.93 56.64 1ggg s PHE 173 Cb 0.19 -1.32 0.04 0.00 -0.57 0.00 0.00 43.02 41.36 1ggg s PHE 173 CO 0.69 0.56 0.63 -1.59 -0.10 0.00 0.00 175.22 175.40 1ggg s LYS 174 N -3.71 1.47 0.30 0.44 -2.85 -0.95 -4.61 119.74 109.84 1ggg s LYS 174 Ca 0.32 -0.73 0.11 0.00 -1.00 0.00 0.00 55.97 54.67 1ggg s LYS 174 Cb -0.07 0.58 -0.05 0.00 -2.06 0.00 0.00 37.83 36.23 1ggg s LYS 174 CO 0.23 -0.65 -0.10 0.00 0.10 0.00 0.00 175.35 174.92 1ggg s ALA 175 N -3.83 2.96 -0.09 0.59 0.00 -1.26 -1.96 121.76 118.16 1ggg s ALA 175 Ca 0.06 -1.88 -0.04 0.00 0.00 0.00 0.00 51.96 50.10 1ggg s ALA 175 Cb -0.03 -0.36 0.05 0.00 0.00 0.00 0.00 23.12 22.79 1ggg s ALA 175 CO -0.04 0.20 0.20 0.08 0.00 0.00 0.00 175.76 176.21 1ggg s VAL 176 N -2.49 -0.15 0.00 0.00 1.01 -1.01 -4.99 120.40 112.77 1ggg s VAL 176 Ca 0.32 0.22 0.00 0.00 0.00 0.00 0.00 61.98 62.52 1ggg s VAL 176 Cb -0.03 -0.33 0.00 0.00 0.00 0.00 0.00 36.38 36.01 1ggg s VAL 176 CO 0.17 0.09 0.00 0.61 0.00 0.00 0.00 175.10 175.97 1ggg n GLY 177 N 4.62 -0.04 0.00 4.51 0.00 -1.26 -3.91 105.19 109.11 1ggg n GLY 177 Ca -0.19 -1.53 0.00 0.00 0.00 0.00 0.00 46.02 44.30 1ggg n GLY 177 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1ggg n ASP 178 N 0.52 0.00 -4.76 1.61 2.03 -1.26 -5.09 116.55 109.60 1ggg n ASP 178 Ca 0.00 -0.50 -0.41 0.00 0.52 0.00 0.00 54.79 54.40 1ggg n ASP 178 Cb 0.00 0.00 -0.02 0.00 -0.72 0.00 0.00 41.12 40.38 1ggg n ASP 178 CO 0.00 0.00 0.00 -0.44 -1.92 0.00 0.00 177.20 174.84 1ggg s SER 179 N 0.39 6.64 0.10 1.67 0.01 -1.26 -4.84 113.70 116.41 1ggg s SER 179 Ca 0.00 2.74 0.02 0.00 1.31 0.00 0.00 55.95 60.02 1ggg s SER 179 Cb 0.00 -2.64 -0.04 0.00 0.21 0.00 0.00 66.02 63.55 1ggg s SER 179 CO 0.00 -0.67 0.17 -0.76 0.41 0.00 0.00 173.24 172.39 1ggg s LEU 180 N -1.13 4.10 -1.54 2.44 1.02 -0.74 -4.42 118.68 118.41 1ggg s LEU 180 Ca 0.55 0.10 -0.14 0.00 0.02 0.00 0.00 54.13 54.66 1ggg s LEU 180 Cb -0.42 -2.72 0.10 0.00 0.02 0.00 0.00 46.19 43.17 1ggg s LEU 180 CO 0.50 0.13 0.83 1.21 0.02 0.00 0.00 176.35 179.04 1ggg n GLU 181 N 0.08 -4.44 -1.49 1.70 4.07 -1.26 -1.17 120.64 118.12 1ggg n GLU 181 Ca -0.07 0.52 -0.46 0.00 -0.06 0.00 0.00 57.16 57.09 1ggg n GLU 181 Cb 0.52 -5.34 -0.02 0.00 -0.06 0.00 0.00 31.44 26.55 1ggg n GLU 181 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1ggg n ALA 182 N -4.34 -1.54 -2.89 4.31 0.00 -1.25 -4.68 120.51 110.10 1ggg n ALA 182 Ca 0.04 0.41 -0.10 0.00 0.00 0.00 0.00 53.44 53.79 1ggg n ALA 182 Cb 0.52 -1.81 -0.10 0.00 0.00 0.00 0.00 19.45 18.06 1ggg n ALA 182 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1ggg s GLN 183 N -1.29 0.52 0.01 0.00 -1.52 0.07 -4.96 119.66 112.50 1ggg s GLN 183 Ca 0.61 -0.61 0.01 0.00 -1.95 0.00 0.00 55.36 53.43 1ggg s GLN 183 Cb -0.81 0.21 -0.04 0.00 -0.22 0.00 0.00 33.01 32.15 1ggg s GLN 183 CO 0.58 -0.12 0.03 -0.65 -0.25 0.00 0.00 175.29 174.88 1ggg s GLN 184 N -2.03 2.88 0.27 2.91 -1.52 -1.26 0.22 119.66 121.12 1ggg s GLN 184 Ca -0.10 -0.58 -0.19 0.00 -1.95 0.00 0.00 55.36 52.54 1ggg s GLN 184 Cb -0.05 -2.73 -0.09 0.00 -0.22 0.00 0.00 33.01 29.93 1ggg s GLN 184 CO -0.02 0.62 0.75 0.71 -0.25 0.00 0.00 175.29 177.10 1ggg s TYR 185 N -1.16 3.55 0.06 0.91 2.02 0.11 -1.95 117.35 120.89 1ggg s TYR 185 Ca 0.22 1.36 0.03 0.00 -0.37 0.00 0.00 57.07 58.32 1ggg s TYR 185 Cb -0.12 -2.62 -0.03 0.00 -0.40 0.00 0.00 41.96 38.80 1ggg s TYR 185 CO 0.13 0.24 -0.10 0.20 -1.57 0.00 0.00 175.55 174.44 1ggg s GLY 186 N -1.86 0.67 0.11 0.71 0.00 -0.12 -0.92 107.32 105.91 1ggg s GLY 186 Ca 0.48 -0.89 -0.29 0.00 0.00 0.00 0.00 44.72 44.02 1ggg s GLY 186 CO 0.20 -0.94 0.91 -0.42 0.00 0.00 0.00 173.10 172.85 1ggg s ILE 187 N -1.42 4.50 -0.15 0.90 1.01 -1.26 -4.26 121.20 120.50 1ggg s ILE 187 Ca -0.06 1.96 -0.08 0.00 0.00 0.00 0.00 60.65 62.48 1ggg s ILE 187 Cb -0.09 -4.27 -0.04 0.00 0.01 0.00 0.00 42.46 38.06 1ggg s ILE 187 CO 0.01 0.36 0.11 0.00 0.00 0.00 0.00 174.94 175.42 1ggg s ALA 188 N -0.20 3.70 0.14 9.38 0.00 -0.02 -2.19 121.76 132.57 1ggg s ALA 188 Ca 0.44 -0.69 0.08 0.00 0.00 0.00 0.00 51.96 51.79 1ggg s ALA 188 Cb -0.23 -2.00 -0.04 0.00 0.00 0.00 0.00 23.12 20.86 1ggg s ALA 188 CO 0.28 0.39 -0.18 -0.06 0.00 0.00 0.00 175.76 176.19 1ggg s PHE 189 N -0.32 1.76 0.47 0.00 0.40 0.02 -1.07 117.98 119.24 1ggg s PHE 189 Ca 0.11 -0.46 -0.22 0.00 -0.60 0.00 0.00 56.93 55.76 1ggg s PHE 189 Cb -0.12 -0.91 -0.08 0.00 0.51 0.00 0.00 43.02 42.43 1ggg s PHE 189 CO 0.01 0.27 1.08 -1.25 0.70 0.00 0.00 175.22 176.04 1ggg s PRO 190 N -2.52 3.81 0.82 0.24 0.04 -1.26 -1.49 135.00 134.65 1ggg s PRO 190 Ca 0.12 1.53 -0.11 0.00 0.04 0.00 0.00 61.00 62.58 1ggg s PRO 190 Cb -0.07 -2.26 0.09 0.00 0.04 0.00 0.00 34.50 32.30 1ggg s PRO 190 CO 0.05 -0.45 1.13 0.15 0.04 0.00 0.00 177.00 177.92 1ggg s LYS 191 N -2.93 1.74 -0.43 4.56 1.02 -1.26 -3.78 119.74 118.66 1ggg s LYS 191 Ca 0.65 1.40 -0.02 0.00 0.02 0.00 0.00 55.97 58.02 1ggg s LYS 191 Cb -0.22 -1.82 0.00 0.00 -0.52 0.00 0.00 37.83 35.27 1ggg s LYS 191 CO 0.26 -2.07 0.37 0.41 -0.92 0.00 0.00 175.35 173.41 1ggg n GLY 192 N -0.41 0.34 2.25 -3.33 0.00 -1.26 -4.96 105.19 97.81 1ggg n GLY 192 Ca 0.11 -0.33 -0.01 0.00 0.00 0.00 0.00 46.02 45.78 1ggg n GLY 192 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1ggg n SER 193 N -0.73 1.83 -0.13 1.61 7.64 -1.25 -4.94 113.62 117.66 1ggg n SER 193 Ca -0.04 -2.34 -0.04 0.00 1.01 0.00 0.00 58.87 57.46 1ggg n SER 193 Cb 0.54 -0.42 0.04 0.00 -1.01 0.00 0.00 64.21 63.36 1ggg n SER 193 CO 0.00 0.00 0.00 0.44 -3.01 0.00 0.00 175.04 172.47 1ggg h ASP 194 N 2.03 0.05 -0.39 6.43 5.19 -1.93 -1.91 116.42 125.90 1ggg h ASP 194 Ca -0.09 0.07 0.00 0.00 -0.62 0.00 0.00 57.03 56.38 1ggg h ASP 194 Cb 1.46 0.08 -0.02 0.00 0.18 0.00 0.00 39.33 41.03 1ggg h ASP 194 CO 0.22 0.06 0.24 -0.33 -3.12 0.00 0.00 179.24 176.31 1ggg h GLU 195 N 0.24 0.52 -0.14 3.56 5.08 -1.99 -1.54 114.58 120.31 1ggg h GLU 195 Ca 0.20 -0.04 -0.15 0.00 -1.00 0.00 0.00 59.36 58.37 1ggg h GLU 195 Cb 0.24 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 1ggg h GLU 195 CO -0.25 0.37 -0.56 1.25 -1.00 0.00 0.00 179.01 178.81 1ggg h LEU 196 N 0.51 0.48 -0.74 1.33 6.46 -1.92 -2.08 115.31 119.34 1ggg h LEU 196 Ca 0.14 -0.26 -0.13 0.00 -0.12 0.00 0.00 57.88 57.51 1ggg h LEU 196 Cb -0.02 -0.14 -0.02 0.00 -0.73 0.00 0.00 40.66 39.75 1ggg h LEU 196 CO -0.03 0.94 -0.61 -0.09 -0.62 0.00 0.00 178.44 178.04 1ggg h ARG 197 N 0.33 0.08 0.00 1.25 2.43 -0.98 0.13 114.38 117.61 1ggg h ARG 197 Ca 0.00 -0.05 -0.09 0.00 -0.81 0.00 0.00 59.98 59.03 1ggg h ARG 197 Cb 1.09 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.63 1ggg h ARG 197 CO 0.10 0.66 -0.56 -0.44 -1.51 0.00 0.00 179.97 178.22 1ggg h ASP 198 N 0.06 0.00 -0.12 -3.80 3.32 -1.22 -2.32 116.42 112.33 1ggg h ASP 198 Ca -0.01 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 56.96 1ggg h ASP 198 Cb 1.08 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.64 1ggg h ASP 198 CO 0.08 0.42 -0.27 0.11 -1.72 0.00 0.00 179.24 177.87 1ggg h LYS 199 N 0.00 0.39 -0.41 3.56 1.57 -1.06 -2.57 116.57 118.06 1ggg h LYS 199 Ca -0.02 -0.26 -0.07 0.00 -1.87 0.00 0.00 60.65 58.42 1ggg h LYS 199 Cb 1.34 0.04 -0.02 0.00 0.08 0.00 0.00 32.23 33.67 1ggg h LYS 199 CO 0.05 0.87 -0.05 0.28 -0.57 0.00 0.00 179.45 180.03 1ggg h VAL 200 N -0.02 1.24 -0.80 0.50 2.07 -1.00 -2.34 116.25 115.89 1ggg h VAL 200 Ca 0.00 -1.01 -0.03 0.00 0.82 0.00 0.00 66.70 66.48 1ggg h VAL 200 Cb 0.87 0.98 -0.04 0.00 -1.52 0.00 0.00 31.29 31.58 1ggg h VAL 200 CO 0.06 0.35 0.39 0.78 0.02 0.00 0.00 177.57 179.17 1ggg h ASN 201 N 0.64 1.04 -0.53 0.57 2.35 -1.46 -2.51 115.58 115.67 1ggg h ASN 201 Ca 0.12 -0.13 -0.01 0.00 -0.55 0.00 0.00 56.30 55.73 1ggg h ASN 201 Cb 0.47 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 38.55 1ggg h ASN 201 CO 0.02 0.87 0.28 1.23 -1.65 0.00 0.00 177.43 178.18 1ggg h GLY 202 N 1.13 0.80 2.00 2.83 0.00 -1.02 -3.07 103.07 105.74 1ggg h GLY 202 Ca 0.28 -0.38 -0.02 0.00 0.00 0.00 0.00 47.33 47.21 1ggg h GLY 202 CO -0.04 0.36 -0.08 0.00 0.00 0.00 0.00 176.54 176.78 1ggg h ALA 203 N 1.11 1.00 -0.07 3.60 0.00 -1.17 -1.37 119.26 122.37 1ggg h ALA 203 Ca 0.18 -0.07 -0.16 0.00 0.00 0.00 0.00 54.91 54.86 1ggg h ALA 203 Cb 0.08 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1ggg h ALA 203 CO -0.03 0.10 -0.64 1.25 0.00 0.00 0.00 179.25 179.93 1ggg h LEU 204 N 0.00 0.31 -0.07 0.00 5.85 -1.38 -2.51 115.31 117.50 1ggg h LEU 204 Ca -0.00 -0.19 -0.01 0.00 0.84 0.00 0.00 57.88 58.53 1ggg h LEU 204 Cb 0.65 -0.09 -0.00 0.00 0.37 0.00 0.00 40.66 41.58 1ggg h LEU 204 CO 0.01 0.87 0.02 0.11 -0.34 0.00 0.00 178.44 179.11 1ggg h LYS 205 N 0.19 0.12 -1.00 1.25 6.56 -1.17 -1.55 116.57 120.97 1ggg h LYS 205 Ca -0.01 -0.03 0.03 0.00 -1.06 0.00 0.00 60.65 59.58 1ggg h LYS 205 Cb 1.17 -0.01 -0.05 0.00 -0.57 0.00 0.00 32.23 32.76 1ggg h LYS 205 CO 0.10 0.31 0.66 1.15 -2.06 0.00 0.00 179.45 179.61 1ggg h THR 206 N -0.10 1.20 0.00 -0.16 2.02 -1.40 0.12 112.91 114.59 1ggg h THR 206 Ca 0.02 -0.44 -0.09 0.00 0.77 0.00 0.00 66.41 66.67 1ggg h THR 206 Cb 0.25 -0.20 -0.01 0.00 -1.74 0.00 0.00 68.15 66.44 1ggg h THR 206 CO 0.00 0.24 -0.44 -0.07 0.37 0.00 0.00 175.52 175.62 1ggg h LEU 207 N 1.29 0.00 -0.06 2.58 4.07 -1.26 -1.77 115.31 120.16 1ggg h LEU 207 Ca 0.39 0.00 -0.20 0.00 0.08 0.00 0.00 57.88 58.14 1ggg h LEU 207 Cb -0.05 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 41.66 1ggg h LEU 207 CO -0.11 0.44 -0.96 0.03 -1.08 0.00 0.00 178.44 176.76 1ggg h ARG 208 N 0.00 0.00 0.07 1.13 3.08 0.18 0.19 114.38 119.02 1ggg h ARG 208 Ca -0.00 0.00 -0.26 0.00 0.07 0.00 0.00 59.98 59.78 1ggg h ARG 208 Cb 0.96 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.99 1ggg h ARG 208 CO 0.06 0.96 -1.30 0.93 -1.07 0.00 0.00 179.97 179.55 1ggg h GLU 209 N 0.00 0.14 -0.13 0.04 5.08 -0.68 -3.33 114.58 115.69 1ggg h GLU 209 Ca -0.01 -0.24 0.00 0.00 -1.00 0.00 0.00 59.36 58.11 1ggg h GLU 209 Cb 1.71 0.09 0.00 0.00 0.50 0.00 0.00 28.75 31.05 1ggg h GLU 209 CO 0.13 1.03 0.00 0.27 -1.00 0.00 0.00 179.01 179.43 1ggg n ASN 210 N -3.39 2.27 0.00 1.42 0.23 -0.69 -4.95 115.26 110.16 1ggg n ASN 210 Ca -0.09 -1.77 0.00 0.00 -0.53 0.00 0.00 54.58 52.19 1ggg n ASN 210 Cb 1.00 -0.08 0.00 0.00 -2.08 0.00 0.00 39.78 38.63 1ggg n ASN 210 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1ggg n GLY 211 N 1.27 0.71 0.18 4.83 0.00 -1.24 -4.97 105.19 105.97 1ggg n GLY 211 Ca 0.17 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.07 1ggg n GLY 211 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1ggg h THR 212 N 0.00 1.36 0.54 2.61 2.02 -1.67 -2.52 112.91 115.25 1ggg h THR 212 Ca 0.00 -2.16 -0.02 0.00 0.77 0.00 0.00 66.41 65.00 1ggg h THR 212 Cb 0.00 2.15 -0.02 0.00 -1.74 0.00 0.00 68.15 68.54 1ggg h THR 212 CO 0.00 0.66 -0.51 0.22 0.37 0.00 0.00 175.52 176.26 1ggg h TYR 213 N 0.33 -1.39 -0.94 3.16 3.20 -1.32 -1.17 116.97 118.83 1ggg h TYR 213 Ca -0.05 0.01 0.26 0.00 3.14 0.00 0.00 58.73 62.09 1ggg h TYR 213 Cb 1.39 0.54 -0.14 0.00 1.54 0.00 0.00 36.73 40.06 1ggg h TYR 213 CO 0.06 -0.68 0.43 -0.97 -1.64 0.00 0.00 178.16 175.36 1ggg h ASN 214 N -1.03 0.34 1.44 -2.11 -0.73 -1.80 -0.16 115.58 111.53 1ggg h ASN 214 Ca -0.07 0.18 -0.10 0.00 1.87 0.00 0.00 56.30 58.18 1ggg h ASN 214 Cb 0.89 0.16 -0.01 0.00 0.27 0.00 0.00 38.32 39.62 1ggg h ASN 214 CO -0.04 -0.07 -0.47 -0.33 -0.37 0.00 0.00 177.43 176.15 1ggg h GLU 215 N 0.35 0.00 -0.12 6.67 4.39 -1.10 -2.24 114.58 122.53 1ggg h GLU 215 Ca 0.63 0.00 -0.20 0.00 0.34 0.00 0.00 59.36 60.13 1ggg h GLU 215 Cb 1.30 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.95 1ggg h GLU 215 CO -0.58 0.47 -0.74 0.82 -1.16 0.00 0.00 179.01 177.82 1ggg h ILE 216 N 0.00 1.33 -0.18 3.13 2.04 -0.34 -3.10 117.51 120.39 1ggg h ILE 216 Ca -0.00 -2.05 0.01 0.00 1.00 0.00 0.00 64.86 63.82 1ggg h ILE 216 Cb 1.31 2.03 -0.02 0.00 -0.74 0.00 0.00 36.82 39.41 1ggg h ILE 216 CO 0.06 0.63 0.08 0.22 0.00 0.00 0.00 178.15 179.14 1ggg h TYR 217 N 0.40 0.14 -0.01 1.37 5.03 -0.95 -3.00 116.97 119.95 1ggg h TYR 217 Ca -0.04 0.01 -0.04 0.00 2.58 0.00 0.00 58.73 61.24 1ggg h TYR 217 Cb 1.33 -0.04 -0.01 0.00 1.55 0.00 0.00 36.73 39.57 1ggg h TYR 217 CO 0.06 0.08 -0.17 -0.22 -1.32 0.00 0.00 178.16 176.59 1ggg h LYS 218 N 0.18 0.02 -0.57 1.82 1.63 -1.44 -1.96 116.57 116.25 1ggg h LYS 218 Ca 0.07 -0.00 -0.02 0.00 -0.85 0.00 0.00 60.65 59.85 1ggg h LYS 218 Cb 0.03 -0.00 -0.03 0.00 -0.60 0.00 0.00 32.23 31.63 1ggg h LYS 218 CO -0.06 0.19 0.26 -0.22 -3.45 0.00 0.00 179.45 176.17 1ggg h LYS 219 N 0.01 0.82 0.00 1.90 3.64 -1.44 -1.52 116.57 119.99 1ggg h LYS 219 Ca 0.00 -0.13 -0.14 0.00 -1.27 0.00 0.00 60.65 59.12 1ggg h LYS 219 Cb 0.32 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 31.97 1ggg h LYS 219 CO 0.02 0.68 -1.80 0.91 -2.27 0.00 0.00 179.45 177.00 1ggg n TRP 220 N -4.53 0.40 -0.18 1.91 7.02 -1.12 -4.56 117.44 116.38 1ggg n TRP 220 Ca 0.03 0.13 0.00 0.00 -1.02 0.00 0.00 57.50 56.64 1ggg n TRP 220 Cb 0.13 -0.84 0.00 0.00 -2.42 0.00 0.00 31.31 28.18 1ggg n TRP 220 CO 0.00 0.00 0.00 1.19 -2.02 0.00 0.00 177.69 176.86 1ggg n PHE 221 N -2.61 0.00 -2.01 -5.99 3.72 -0.75 -4.73 117.46 105.10 1ggg n PHE 221 Ca -0.12 -0.27 -0.15 0.00 -0.05 0.00 0.00 57.45 56.86 1ggg n PHE 221 Cb 0.78 -0.03 -0.03 0.00 -0.94 0.00 0.00 39.48 39.27 1ggg n PHE 221 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1ggg n GLY 222 N -0.27 0.30 0.00 1.37 0.00 -0.57 -4.82 105.19 101.20 1ggg n GLY 222 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1ggg n GLY 222 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ggg n THR 223 N -2.89 0.00 0.82 2.61 -2.24 -1.26 -5.05 114.28 106.27 1ggg n THR 223 Ca -0.16 0.00 0.10 0.00 -2.27 0.00 0.00 64.05 61.72 1ggg n THR 223 Cb 0.57 0.00 0.08 0.00 -2.10 0.00 0.00 70.33 68.88 1ggg n THR 223 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88